Result table
| image | mrblock_id | pdb_id | cing | stage | position | program | type |
|
|
1961 | 1b9u RC | cing | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 1H MET 1 1H MET 1 -13.550 -24.365 -3.737
2 2H MET 1 2H MET 1 -13.531 -25.932 -4.367
3 HA MET 1 HA MET 1 -11.215 -26.171 -3.862
4 1HB MET 1 1HB MET 1 -11.773 -23.651 -5.494
5 2HB MET 1 2HB MET 1 -10.232 -24.519 -5.439
6 1HG MET 1 1HG MET 1 -11.349 -26.560 -6.313
7 2HG MET 1 2HG MET 1 -12.868 -25.663 -6.445
8 1HE MET 1 1HE MET 1 -11.596 -27.339 -8.808
9 2HE MET 1 2HE MET 1 -13.126 -26.434 -8.934
10 3HE MET 1 3HE MET 1 -11.860 -26.221 -10.165
11 H ASN 2 H ASN 2 -11.266 -25.814 -1.504
12 HA ASN 2 HA ASN 2 -10.745 -23.176 -0.387
13 1HB ASN 2 1HB ASN 2 -10.558 -25.955 0.839
14 2HB ASN 2 2HB ASN 2 -10.489 -24.428 1.731
15 1HD2 ASN 2 2HD2 ASN 2 -12.418 -26.492 2.248
16 2HD2 ASN 2 1HD2 ASN 2 -13.989 -25.802 1.865
17 H LEU 3 H LEU 3 -8.932 -22.947 -2.081
18 HA LEU 3 HA LEU 3 -6.336 -24.120 -1.372
19 1HB LEU 3 1HB LEU 3 -7.356 -23.563 -3.774
20 2HB LEU 3 2HB LEU 3 -6.690 -21.977 -3.467
21 HG LEU 3 HG LEU 3 -5.075 -23.177 -4.697
22 1HD1 LEU 3 1HD1 LEU 3 -4.038 -22.008 -2.759
23 2HD1 LEU 3 2HD1 LEU 3 -4.086 -23.518 -1.828
24 3HD1 LEU 3 3HD1 LEU 3 -3.104 -23.408 -3.295
25 1HD2 LEU 3 1HD2 LEU 3 -6.030 -25.436 -4.427
26 2HD2 LEU 3 2HD2 LEU 3 -4.273 -25.433 -4.219
27 3HD2 LEU 3 3HD2 LEU 3 -5.328 -25.554 -2.802
28 H ASN 4 H ASN 4 -6.957 -23.141 0.744
29 HA ASN 4 HA ASN 4 -6.959 -20.823 1.889
30 1HB ASN 4 1HB ASN 4 -6.467 -23.020 3.003
31 2HB ASN 4 2HB ASN 4 -4.774 -22.836 2.617
32 1HD2 ASN 4 2HD2 ASN 4 -7.482 -21.365 4.481
33 2HD2 ASN 4 1HD2 ASN 4 -6.430 -20.543 5.623
34 H ALA 5 H ALA 5 -3.765 -21.992 0.863
35 HA ALA 5 HA ALA 5 -2.173 -19.784 1.490
36 1HB ALA 5 1HB ALA 5 -1.301 -22.012 0.902
37 2HB ALA 5 2HB ALA 5 -1.803 -21.783 -0.786
38 3HB ALA 5 3HB ALA 5 -0.538 -20.756 -0.083
39 H THR 6 H THR 6 -4.125 -20.266 -1.432
40 HA THR 6 HA THR 6 -3.047 -17.909 -2.825
41 HB THR 6 HB THR 6 -5.437 -19.698 -3.421
42 HG1 THR 6 HG1 THR 6 -3.163 -20.422 -3.660
43 1HG2 THR 6 1HG2 THR 6 -4.251 -17.427 -5.079
44 2HG2 THR 6 2HG2 THR 6 -5.397 -18.642 -5.679
45 3HG2 THR 6 3HG2 THR 6 -5.904 -17.505 -4.427
46 H ILE 7 H ILE 7 -5.637 -18.466 -0.471
47 HA ILE 7 HA ILE 7 -7.067 -15.966 -1.177
48 HB ILE 7 HB ILE 7 -7.550 -17.932 1.103
49 1HG1 ILE 7 1HG1 ILE 7 -7.854 -19.177 -0.932
50 2HG1 ILE 7 2HG1 ILE 7 -9.420 -18.825 -0.218
51 1HG2 ILE 7 1HG2 ILE 7 -9.272 -15.686 -0.029
52 2HG2 ILE 7 2HG2 ILE 7 -9.809 -16.887 1.164
53 3HG2 ILE 7 3HG2 ILE 7 -8.519 -15.752 1.572
54 1HD1 ILE 7 1HD1 ILE 7 -9.756 -16.983 -1.887
55 2HD1 ILE 7 2HD1 ILE 7 -8.186 -17.389 -2.620
56 3HD1 ILE 7 3HD1 ILE 7 -9.507 -18.563 -2.645
57 H LEU 8 H LEU 8 -5.277 -17.401 1.512
58 HA LEU 8 HA LEU 8 -4.632 -15.252 3.146
59 1HB LEU 8 1HB LEU 8 -4.110 -17.646 3.513
60 2HB LEU 8 2HB LEU 8 -3.002 -17.631 2.151
61 HG LEU 8 HG LEU 8 -1.496 -16.055 3.344
62 1HD1 LEU 8 1HD1 LEU 8 -3.490 -16.328 5.645
63 2HD1 LEU 8 2HD1 LEU 8 -1.869 -15.615 5.777
64 3HD1 LEU 8 3HD1 LEU 8 -3.087 -14.835 4.766
65 1HD2 LEU 8 1HD2 LEU 8 -1.164 -18.491 3.559
66 2HD2 LEU 8 2HD2 LEU 8 -0.693 -17.651 5.045
67 3HD2 LEU 8 3HD2 LEU 8 -2.237 -18.526 4.973
68 H GLY 9 H GLY 9 -2.746 -16.395 0.236
69 1HA GLY 9 1HA GLY 9 -0.941 -14.240 0.258
70 2HA GLY 9 2HA GLY 9 -1.201 -15.294 -1.075
71 H GLN 10 H GLN 10 -4.141 -14.563 -1.383
72 HA GLN 10 HA GLN 10 -4.027 -12.112 -2.878
73 1HB GLN 10 1HB GLN 10 -5.700 -13.861 -3.261
74 2HB GLN 10 2HB GLN 10 -6.438 -13.539 -1.687
75 1HG GLN 10 1HG GLN 10 -6.965 -11.216 -2.414
76 2HG GLN 10 2HG GLN 10 -6.218 -11.535 -3.984
77 1HE2 GLN 10 2HE2 GLN 10 -7.180 -13.551 -5.184
78 2HE2 GLN 10 1HE2 GLN 10 -8.929 -13.694 -5.082
79 H ALA 11 H ALA 11 -5.121 -12.832 0.495
80 HA ALA 11 HA ALA 11 -5.644 -10.109 1.203
81 1HB ALA 11 1HB ALA 11 -6.556 -12.028 2.459
82 2HB ALA 11 2HB ALA 11 -4.929 -12.458 3.015
83 3HB ALA 11 3HB ALA 11 -5.657 -10.922 3.510
84 H ILE 12 H ILE 12 -2.605 -11.981 1.148
85 HA ILE 12 HA ILE 12 -0.983 -10.017 2.497
86 HB ILE 12 HB ILE 12 -0.378 -12.218 0.507
87 1HG1 ILE 12 1HG1 ILE 12 -0.966 -12.770 2.929
88 2HG1 ILE 12 2HG1 ILE 12 0.559 -13.417 2.319
89 1HG2 ILE 12 1HG2 ILE 12 1.636 -10.301 1.636
90 2HG2 ILE 12 2HG2 ILE 12 2.047 -11.889 0.950
91 3HG2 ILE 12 3HG2 ILE 12 1.299 -10.660 -0.069
92 1HD1 ILE 12 1HD1 ILE 12 0.332 -10.855 3.963
93 2HD1 ILE 12 2HD1 ILE 12 0.748 -12.458 4.597
94 3HD1 ILE 12 3HD1 ILE 12 1.825 -11.659 3.437
95 H ALA 13 H ALA 13 -1.704 -10.571 -0.978
96 HA ALA 13 HA ALA 13 -0.277 -8.414 -2.062
97 1HB ALA 13 1HB ALA 13 -1.305 -10.243 -3.363
98 2HB ALA 13 2HB ALA 13 -2.920 -9.606 -3.011
99 3HB ALA 13 3HB ALA 13 -1.785 -8.649 -3.977
100 H PHE 14 H PHE 14 -3.624 -8.511 -0.757
101 HA PHE 14 HA PHE 14 -4.232 -5.744 -1.172
102 1HB PHE 14 1HB PHE 14 -5.937 -7.445 -0.789
103 2HB PHE 14 2HB PHE 14 -5.338 -7.740 0.831
104 HD1 PHE 14 HD1 PHE 14 -6.747 -5.019 -1.362
105 HD2 PHE 14 HD2 PHE 14 -6.220 -6.478 2.672
106 HE1 PHE 14 HE1 PHE 14 -8.217 -3.204 -0.509
107 HE2 PHE 14 HE2 PHE 14 -7.694 -4.668 3.518
108 HZ PHE 14 HZ PHE 14 -8.700 -3.032 1.930
109 H VAL 15 H VAL 15 -3.145 -7.392 1.878
110 HA VAL 15 HA VAL 15 -3.155 -5.006 3.424
111 HB VAL 15 HB VAL 15 -1.901 -7.740 3.886
112 1HG1 VAL 15 1HG1 VAL 15 -2.065 -5.387 5.826
113 2HG1 VAL 15 2HG1 VAL 15 -1.674 -7.058 6.279
114 3HG1 VAL 15 3HG1 VAL 15 -0.582 -6.160 5.225
115 1HG2 VAL 15 1HG2 VAL 15 -4.426 -7.585 3.880
116 2HG2 VAL 15 2HG2 VAL 15 -3.771 -8.013 5.464
117 3HG2 VAL 15 3HG2 VAL 15 -4.324 -6.357 5.148
118 H LEU 16 H LEU 16 -0.380 -6.798 1.942
119 HA LEU 16 HA LEU 16 1.653 -5.014 2.678
120 1HB LEU 16 1HB LEU 16 1.370 -6.624 0.136
121 2HB LEU 16 2HB LEU 16 2.809 -5.694 0.545
122 HG LEU 16 HG LEU 16 1.705 -7.958 2.264
123 1HD1 LEU 16 1HD1 LEU 16 2.673 -8.673 0.050
124 2HD1 LEU 16 2HD1 LEU 16 4.158 -7.783 0.423
125 3HD1 LEU 16 3HD1 LEU 16 3.703 -9.186 1.402
126 1HD2 LEU 16 1HD2 LEU 16 4.233 -6.271 2.534
127 2HD2 LEU 16 2HD2 LEU 16 2.916 -6.432 3.718
128 3HD2 LEU 16 3HD2 LEU 16 3.959 -7.806 3.379
129 H PHE 17 H PHE 17 -0.517 -4.723 -0.202
130 HA PHE 17 HA PHE 17 0.517 -2.321 -1.264
131 1HB PHE 17 1HB PHE 17 -1.304 -3.910 -2.164
132 2HB PHE 17 2HB PHE 17 -2.458 -3.051 -1.232
133 HD1 PHE 17 HD1 PHE 17 -0.190 -2.822 -4.137
134 HD2 PHE 17 HD2 PHE 17 -3.053 -0.683 -1.707
135 HE1 PHE 17 HE1 PHE 17 -0.323 -1.033 -5.861
136 HE2 PHE 17 HE2 PHE 17 -3.177 1.104 -3.430
137 HZ PHE 17 HZ PHE 17 -1.814 0.932 -5.509
138 H VAL 18 H VAL 18 -2.277 -2.766 0.831
139 HA VAL 18 HA VAL 18 -2.918 -0.098 1.415
140 HB VAL 18 HB VAL 18 -3.298 -2.596 3.105
141 1HG1 VAL 18 1HG1 VAL 18 -4.448 0.188 3.596
142 2HG1 VAL 18 2HG1 VAL 18 -5.016 -1.302 4.374
143 3HG1 VAL 18 3HG1 VAL 18 -3.381 -0.722 4.686
144 1HG2 VAL 18 1HG2 VAL 18 -4.530 -2.430 0.892
145 2HG2 VAL 18 2HG2 VAL 18 -5.603 -2.453 2.295
146 3HG2 VAL 18 3HG2 VAL 18 -5.265 -0.927 1.459
147 H LEU 19 H LEU 19 -0.734 -2.149 3.501
148 HA LEU 19 HA LEU 19 -0.074 0.091 5.168
149 1HB LEU 19 1HB LEU 19 1.636 -2.330 4.754
150 2HB LEU 19 2HB LEU 19 1.621 -1.188 6.108
151 HG LEU 19 HG LEU 19 -0.533 -3.099 5.511
152 1HD1 LEU 19 1HD1 LEU 19 1.472 -4.184 6.432
153 2HD1 LEU 19 2HD1 LEU 19 1.461 -3.053 7.802
154 3HD1 LEU 19 3HD1 LEU 19 0.144 -4.229 7.604
155 1HD2 LEU 19 1HD2 LEU 19 -0.306 -1.069 7.763
156 2HD2 LEU 19 2HD2 LEU 19 -1.545 -1.128 6.487
157 3HD2 LEU 19 3HD2 LEU 19 -1.499 -2.385 7.725
158 H PHE 20 H PHE 20 1.483 -1.217 2.196
159 HA PHE 20 HA PHE 20 3.797 0.413 2.259
160 1HB PHE 20 1HB PHE 20 3.517 -1.423 0.667
161 2HB PHE 20 2HB PHE 20 2.184 -0.607 -0.125
162 HD1 PHE 20 HD1 PHE 20 2.592 1.521 -1.449
163 HD2 PHE 20 HD2 PHE 20 5.813 -0.930 0.074
164 HE1 PHE 20 HE1 PHE 20 4.190 2.674 -2.961
165 HE2 PHE 20 HE2 PHE 20 7.402 0.220 -1.451
166 HZ PHE 20 HZ PHE 20 6.596 2.028 -2.963
167 H CYS 21 H CYS 21 0.445 1.129 1.126
168 HA CYS 21 HA CYS 21 0.954 3.879 0.536
169 1HB CYS 21 1HB CYS 21 -1.070 2.653 -0.221
170 2HB CYS 21 2HB CYS 21 -1.693 2.675 1.437
171 HG CYS 21 HG CYS 21 -0.768 5.253 -0.385
172 H MET 22 H MET 22 0.201 2.176 3.714
173 HA MET 22 HA MET 22 -0.095 4.660 5.086
174 1HB MET 22 1HB MET 22 0.407 1.912 6.215
175 2HB MET 22 2HB MET 22 0.041 3.352 7.149
176 1HG MET 22 1HG MET 22 -2.123 3.639 6.057
177 2HG MET 22 2HG MET 22 -1.819 2.260 5.014
178 1HE MET 22 1HE MET 22 -1.338 2.766 8.948
179 2HE MET 22 2HE MET 22 -2.922 3.474 8.536
180 3HE MET 22 3HE MET 22 -2.835 1.984 9.498
181 H LYS 23 H LYS 23 2.743 3.123 3.920
182 HA LYS 23 HA LYS 23 4.414 4.751 5.774
183 1HB LYS 23 1HB LYS 23 4.384 2.167 6.061
184 2HB LYS 23 2HB LYS 23 5.051 2.050 4.445
185 1HG LYS 23 1HG LYS 23 7.055 3.379 5.192
186 2HG LYS 23 2HG LYS 23 6.403 3.388 6.841
187 1HD LYS 23 1HD LYS 23 6.525 0.923 6.924
188 2HD LYS 23 2HD LYS 23 6.971 0.869 5.216
189 1HE LYS 23 1HE LYS 23 9.047 2.285 5.842
190 2HE LYS 23 2HE LYS 23 8.635 1.950 7.531
191 1HZ LYS 23 1HZ LYS 23 8.769 -0.430 6.925
192 2HZ LYS 23 2HZ LYS 23 9.296 0.005 5.417
193 3HZ LYS 23 3HZ LYS 23 10.200 0.365 6.744
194 H TYR 24 H TYR 24 4.619 3.371 2.463
195 HA TYR 24 HA TYR 24 6.868 5.202 1.864
196 1HB TYR 24 1HB TYR 24 5.533 3.035 0.224
197 2HB TYR 24 2HB TYR 24 6.920 3.981 -0.290
198 HD1 TYR 24 HD1 TYR 24 9.132 3.801 0.915
199 HD2 TYR 24 HD2 TYR 24 5.807 1.223 1.854
200 HE1 TYR 24 HE1 TYR 24 10.634 2.351 2.259
201 HE2 TYR 24 HE2 TYR 24 7.325 -0.285 3.116
202 HH TYR 24 HH TYR 24 10.803 0.405 3.475
203 H VAL 25 H VAL 25 3.551 5.599 1.880
204 HA VAL 25 HA VAL 25 3.712 7.749 -0.208
205 HB VAL 25 HB VAL 25 1.244 6.165 0.542
206 1HG1 VAL 25 1HG1 VAL 25 1.683 8.353 -1.528
207 2HG1 VAL 25 2HG1 VAL 25 0.221 7.359 -1.376
208 3HG1 VAL 25 3HG1 VAL 25 0.668 8.461 -0.074
209 1HG2 VAL 25 1HG2 VAL 25 2.944 6.113 -1.995
210 2HG2 VAL 25 2HG2 VAL 25 2.801 4.790 -0.823
211 3HG2 VAL 25 3HG2 VAL 25 1.395 5.275 -1.773
212 H TRP 26 H TRP 26 2.456 6.864 3.066
213 HA TRP 26 HA TRP 26 1.106 9.214 3.648
214 1HB TRP 26 1HB TRP 26 2.458 7.071 5.262
215 2HB TRP 26 2HB TRP 26 2.026 8.538 6.104
216 HD1 TRP 26 HD1 TRP 26 -0.431 7.457 3.428
217 HE1 TRP 26 HE1 TRP 26 -2.600 6.635 4.550
218 HE3 TRP 26 HE3 TRP 26 1.178 7.248 8.297
219 HZ2 TRP 26 HZ2 TRP 26 -3.521 5.995 7.178
220 HZ3 TRP 26 HZ3 TRP 26 -0.378 6.521 10.089
221 HH2 TRP 26 HH2 TRP 26 -2.728 5.910 9.546
222 HA PRO 27 HA PRO 27 4.933 11.397 5.583
223 1HB PRO 27 1HB PRO 27 7.458 10.555 4.575
224 2HB PRO 27 2HB PRO 27 6.758 10.288 6.186
225 1HG PRO 27 1HG PRO 27 6.737 8.436 3.820
226 2HG PRO 27 2HG PRO 27 6.905 8.042 5.545
227 1HD PRO 27 1HD PRO 27 4.572 7.683 4.205
228 2HD PRO 27 2HD PRO 27 4.584 8.215 5.907
229 HA PRO 28 HA PRO 28 6.434 13.138 1.433
230 1HB PRO 28 1HB PRO 28 5.923 11.904 -0.993
231 2HB PRO 28 2HB PRO 28 7.386 11.631 -0.013
232 1HG PRO 28 1HG PRO 28 4.862 9.970 -0.049
233 2HG PRO 28 2HG PRO 28 6.540 9.393 -0.192
234 1HD PRO 28 1HD PRO 28 5.299 9.304 2.191
235 2HD PRO 28 2HD PRO 28 6.998 9.846 2.097
236 H LEU 29 H LEU 29 3.313 11.344 1.181
237 HA LEU 29 HA LEU 29 1.768 13.341 -0.087
238 1HB LEU 29 1HB LEU 29 1.077 11.025 0.406
239 2HB LEU 29 2HB LEU 29 0.983 11.366 2.116
240 HG LEU 29 HG LEU 29 -1.170 11.230 0.860
241 1HD1 LEU 29 1HD1 LEU 29 -1.008 12.309 3.086
242 2HD1 LEU 29 2HD1 LEU 29 -0.829 13.887 2.295
243 3HD1 LEU 29 3HD1 LEU 29 -2.309 12.951 2.073
244 1HD2 LEU 29 1HD2 LEU 29 -0.465 12.461 -1.186
245 2HD2 LEU 29 2HD2 LEU 29 -1.973 13.070 -0.484
246 3HD2 LEU 29 3HD2 LEU 29 -0.469 13.975 -0.254
247 H MET 30 H MET 30 2.505 12.814 3.363
248 HA MET 30 HA MET 30 1.100 15.025 4.456
249 1HB MET 30 1HB MET 30 1.989 13.038 5.692
250 2HB MET 30 2HB MET 30 3.622 13.693 5.540
251 1HG MET 30 1HG MET 30 2.890 15.739 6.783
252 2HG MET 30 2HG MET 30 1.283 15.037 6.968
253 1HE MET 30 1HE MET 30 0.791 12.870 8.340
254 2HE MET 30 2HE MET 30 2.131 11.876 7.707
255 3HE MET 30 3HE MET 30 1.941 12.102 9.458
256 H ALA 31 H ALA 31 4.549 14.742 3.468
257 HA ALA 31 HA ALA 31 5.339 17.398 4.056
258 1HB ALA 31 1HB ALA 31 6.915 15.544 3.615
259 2HB ALA 31 2HB ALA 31 6.419 15.515 1.911
260 3HB ALA 31 3HB ALA 31 7.245 16.937 2.572
261 H ALA 32 H ALA 32 3.962 16.021 1.040
262 HA ALA 32 HA ALA 32 4.121 18.330 -0.566
263 1HB ALA 32 1HB ALA 32 3.758 16.086 -1.464
264 2HB ALA 32 2HB ALA 32 2.150 16.014 -0.719
265 3HB ALA 32 3HB ALA 32 2.484 17.191 -2.002
266 H ILE 33 H ILE 33 1.329 17.134 1.414
267 HA ILE 33 HA ILE 33 -0.310 19.451 0.736
268 HB ILE 33 HB ILE 33 -0.749 17.178 2.702
269 1HG1 ILE 33 1HG1 ILE 33 -1.765 17.732 -0.132
270 2HG1 ILE 33 2HG1 ILE 33 -0.649 16.455 0.357
271 1HG2 ILE 33 1HG2 ILE 33 -2.051 19.199 3.381
272 2HG2 ILE 33 2HG2 ILE 33 -2.715 19.310 1.739
273 3HG2 ILE 33 3HG2 ILE 33 -3.100 17.930 2.790
274 1HD1 ILE 33 1HD1 ILE 33 -2.513 15.505 1.812
275 2HD1 ILE 33 2HD1 ILE 33 -3.611 16.653 1.014
276 3HD1 ILE 33 3HD1 ILE 33 -2.777 15.429 0.057
277 H GMA 34 H GLU 34 1.272 18.351 3.782
278 HA GMA 34 HA GLU 34 0.629 20.928 5.120
279 1HB GMA 34 1HB GLU 34 -0.092 18.849 6.193
280 2HB GMA 34 2HB GLU 34 1.563 18.233 6.194
281 1HG GMA 34 1HG GLU 34 2.260 20.120 7.679
282 2HG GMA 34 2HG GLU 34 0.598 20.722 7.673
283 2HN GMA 34 2HN GLU 34 4.652 19.911 4.835
284 1HN GMA 34 1NH GLU 34 3.432 18.645 4.752
Start of MODEL 2
1 1H MET 1 1H MET 1 -11.106 -20.785 -6.219
2 2H MET 1 2H MET 1 -9.880 -21.744 -5.563
3 HA MET 1 HA MET 1 -10.272 -19.814 -4.142
4 1HB MET 1 1HB MET 1 -12.369 -19.372 -3.167
5 2HB MET 1 2HB MET 1 -12.614 -19.483 -4.904
6 1HG MET 1 1HG MET 1 -13.347 -21.589 -2.816
7 2HG MET 1 2HG MET 1 -14.441 -20.502 -3.660
8 1HE MET 1 1HE MET 1 -15.304 -23.282 -3.410
9 2HE MET 1 2HE MET 1 -16.163 -22.237 -4.566
10 3HE MET 1 3HE MET 1 -15.644 -23.867 -5.055
11 H ASN 2 H ASN 2 -11.266 -23.212 -3.865
12 HA ASN 2 HA ASN 2 -10.751 -23.445 -1.009
13 1HB ASN 2 1HB ASN 2 -11.020 -25.596 -3.149
14 2HB ASN 2 2HB ASN 2 -11.068 -25.852 -1.402
15 1HD2 ASN 2 2HD2 ASN 2 -12.785 -24.110 -0.316
16 2HD2 ASN 2 1HD2 ASN 2 -14.355 -24.223 -1.097
17 H LEU 3 H LEU 3 -8.622 -22.222 -1.405
18 HA LEU 3 HA LEU 3 -6.393 -24.090 -1.126
19 1HB LEU 3 1HB LEU 3 -6.782 -23.568 -3.682
20 2HB LEU 3 2HB LEU 3 -6.106 -22.003 -3.306
21 HG LEU 3 HG LEU 3 -4.378 -23.381 -4.162
22 1HD1 LEU 3 1HD1 LEU 3 -3.656 -22.051 -2.195
23 2HD1 LEU 3 2HD1 LEU 3 -3.928 -23.461 -1.146
24 3HD1 LEU 3 3HD1 LEU 3 -2.698 -23.519 -2.417
25 1HD2 LEU 3 1HD2 LEU 3 -5.481 -25.576 -3.846
26 2HD2 LEU 3 2HD2 LEU 3 -3.776 -25.598 -3.373
27 3HD2 LEU 3 3HD2 LEU 3 -5.033 -25.559 -2.129
28 H ASN 4 H ASN 4 -6.394 -23.296 0.937
29 HA ASN 4 HA ASN 4 -6.630 -20.934 2.108
30 1HB ASN 4 1HB ASN 4 -5.972 -23.101 3.187
31 2HB ASN 4 2HB ASN 4 -4.313 -22.842 2.701
32 1HD2 ASN 4 2HD2 ASN 4 -6.971 -21.460 4.709
33 2HD2 ASN 4 1HD2 ASN 4 -5.885 -20.613 5.799
34 H ALA 5 H ALA 5 -3.443 -21.940 0.909
35 HA ALA 5 HA ALA 5 -1.945 -19.628 1.395
36 1HB ALA 5 1HB ALA 5 -0.980 -21.815 0.808
37 2HB ALA 5 2HB ALA 5 -1.576 -21.648 -0.855
38 3HB ALA 5 3HB ALA 5 -0.347 -20.531 -0.234
39 H THR 6 H THR 6 -4.142 -20.250 -1.327
40 HA THR 6 HA THR 6 -3.241 -17.960 -2.901
41 HB THR 6 HB THR 6 -5.822 -19.560 -3.159
42 HG1 THR 6 HG1 THR 6 -3.316 -19.853 -4.457
43 1HG2 THR 6 1HG2 THR 6 -4.337 -17.764 -5.134
44 2HG2 THR 6 2HG2 THR 6 -5.734 -18.789 -5.516
45 3HG2 THR 6 3HG2 THR 6 -5.919 -17.434 -4.399
46 H ILE 7 H ILE 7 -5.673 -18.469 -0.344
47 HA ILE 7 HA ILE 7 -7.107 -15.940 -0.940
48 HB ILE 7 HB ILE 7 -7.443 -17.952 1.328
49 1HG1 ILE 7 1HG1 ILE 7 -7.986 -19.086 -0.732
50 2HG1 ILE 7 2HG1 ILE 7 -9.461 -18.724 0.152
51 1HG2 ILE 7 1HG2 ILE 7 -9.173 -15.592 0.474
52 2HG2 ILE 7 2HG2 ILE 7 -9.663 -16.843 1.635
53 3HG2 ILE 7 3HG2 ILE 7 -8.298 -15.786 2.000
54 1HD1 ILE 7 1HD1 ILE 7 -9.860 -16.760 -1.385
55 2HD1 ILE 7 2HD1 ILE 7 -8.413 -17.239 -2.304
56 3HD1 ILE 7 3HD1 ILE 7 -9.808 -18.318 -2.217
57 H LEU 8 H LEU 8 -5.081 -17.397 1.562
58 HA LEU 8 HA LEU 8 -4.338 -15.257 3.172
59 1HB LEU 8 1HB LEU 8 -3.750 -17.649 3.446
60 2HB LEU 8 2HB LEU 8 -2.754 -17.576 2.002
61 HG LEU 8 HG LEU 8 -1.194 -15.990 3.111
62 1HD1 LEU 8 1HD1 LEU 8 -2.995 -16.359 5.551
63 2HD1 LEU 8 2HD1 LEU 8 -1.387 -15.610 5.577
64 3HD1 LEU 8 3HD1 LEU 8 -2.695 -14.838 4.679
65 1HD2 LEU 8 1HD2 LEU 8 -0.776 -18.415 3.248
66 2HD2 LEU 8 2HD2 LEU 8 -0.226 -17.597 4.718
67 3HD2 LEU 8 3HD2 LEU 8 -1.746 -18.514 4.733
68 H GLY 9 H GLY 9 -2.728 -16.312 0.062
69 1HA GLY 9 1HA GLY 9 -0.933 -14.148 -0.012
70 2HA GLY 9 2HA GLY 9 -1.291 -15.179 -1.340
71 H GLN 10 H GLN 10 -4.256 -14.464 -1.420
72 HA GLN 10 HA GLN 10 -4.320 -11.966 -2.827
73 1HB GLN 10 1HB GLN 10 -6.374 -13.821 -1.592
74 2HB GLN 10 2HB GLN 10 -6.847 -12.247 -2.180
75 1HG GLN 10 1HG GLN 10 -6.018 -12.743 -4.429
76 2HG GLN 10 2HG GLN 10 -5.363 -14.285 -3.889
77 1HE2 GLN 10 2HE2 GLN 10 -8.497 -12.458 -4.001
78 2HE2 GLN 10 1HE2 GLN 10 -9.463 -13.889 -4.330
79 H ALA 11 H ALA 11 -5.084 -12.816 0.609
80 HA ALA 11 HA ALA 11 -5.574 -10.120 1.432
81 1HB ALA 11 1HB ALA 11 -6.347 -12.081 2.713
82 2HB ALA 11 2HB ALA 11 -4.672 -12.497 3.118
83 3HB ALA 11 3HB ALA 11 -5.377 -10.985 3.710
84 H ILE 12 H ILE 12 -2.525 -11.938 1.065
85 HA ILE 12 HA ILE 12 -0.819 -9.986 2.323
86 HB ILE 12 HB ILE 12 -0.362 -12.130 0.234
87 1HG1 ILE 12 1HG1 ILE 12 -0.719 -12.735 2.690
88 2HG1 ILE 12 2HG1 ILE 12 0.747 -13.354 1.927
89 1HG2 ILE 12 1HG2 ILE 12 1.721 -10.206 1.215
90 2HG2 ILE 12 2HG2 ILE 12 2.088 -11.773 0.460
91 3HG2 ILE 12 3HG2 ILE 12 1.233 -10.536 -0.459
92 1HD1 ILE 12 1HD1 ILE 12 0.656 -10.823 3.631
93 2HD1 ILE 12 2HD1 ILE 12 1.138 -12.434 4.197
94 3HD1 ILE 12 3HD1 ILE 12 2.097 -11.607 2.956
95 H ALA 13 H ALA 13 -1.835 -10.458 -1.092
96 HA ALA 13 HA ALA 13 -0.535 -8.249 -2.232
97 1HB ALA 13 1HB ALA 13 -1.653 -10.053 -3.492
98 2HB ALA 13 2HB ALA 13 -3.237 -9.452 -2.979
99 3HB ALA 13 3HB ALA 13 -2.204 -8.449 -4.011
100 H PHE 14 H PHE 14 -3.762 -8.438 -0.657
101 HA PHE 14 HA PHE 14 -4.447 -5.676 -0.934
102 1HB PHE 14 1HB PHE 14 -6.076 -7.426 -0.445
103 2HB PHE 14 2HB PHE 14 -5.333 -7.738 1.112
104 HD1 PHE 14 HD1 PHE 14 -7.002 -5.023 -0.895
105 HD2 PHE 14 HD2 PHE 14 -6.056 -6.516 3.050
106 HE1 PHE 14 HE1 PHE 14 -8.438 -3.264 0.121
107 HE2 PHE 14 HE2 PHE 14 -7.495 -4.761 4.057
108 HZ PHE 14 HZ PHE 14 -8.695 -3.137 2.596
109 H VAL 15 H VAL 15 -3.049 -7.377 1.957
110 HA VAL 15 HA VAL 15 -2.952 -5.020 3.554
111 HB VAL 15 HB VAL 15 -1.633 -7.751 3.836
112 1HG1 VAL 15 1HG1 VAL 15 -1.644 -5.446 5.837
113 2HG1 VAL 15 2HG1 VAL 15 -1.200 -7.122 6.215
114 3HG1 VAL 15 3HG1 VAL 15 -0.215 -6.191 5.087
115 1HG2 VAL 15 1HG2 VAL 15 -4.149 -7.631 4.062
116 2HG2 VAL 15 2HG2 VAL 15 -3.349 -8.084 5.570
117 3HG2 VAL 15 3HG2 VAL 15 -3.948 -6.428 5.342
118 H LEU 16 H LEU 16 -0.301 -6.740 1.784
119 HA LEU 16 HA LEU 16 1.762 -4.930 2.361
120 1HB LEU 16 1HB LEU 16 1.270 -6.506 -0.170
121 2HB LEU 16 2HB LEU 16 2.726 -5.559 0.121
122 HG LEU 16 HG LEU 16 1.819 -7.868 1.895
123 1HD1 LEU 16 1HD1 LEU 16 2.591 -8.531 -0.410
124 2HD1 LEU 16 2HD1 LEU 16 4.091 -7.625 -0.158
125 3HD1 LEU 16 3HD1 LEU 16 3.746 -9.051 0.835
126 1HD2 LEU 16 1HD2 LEU 16 4.335 -6.144 1.961
127 2HD2 LEU 16 2HD2 LEU 16 3.135 -6.345 3.259
128 3HD2 LEU 16 3HD2 LEU 16 4.164 -7.696 2.802
129 H PHE 17 H PHE 17 -0.688 -4.633 -0.288
130 HA PHE 17 HA PHE 17 0.204 -2.195 -1.400
131 1HB PHE 17 1HB PHE 17 -1.660 -3.786 -2.169
132 2HB PHE 17 2HB PHE 17 -2.738 -2.993 -1.100
133 HD1 PHE 17 HD1 PHE 17 -0.743 -2.584 -4.187
134 HD2 PHE 17 HD2 PHE 17 -3.466 -0.648 -1.444
135 HE1 PHE 17 HE1 PHE 17 -1.085 -0.739 -5.822
136 HE2 PHE 17 HE2 PHE 17 -3.797 1.197 -3.078
137 HZ PHE 17 HZ PHE 17 -2.610 1.152 -5.268
138 H VAL 18 H VAL 18 -2.380 -2.717 0.929
139 HA VAL 18 HA VAL 18 -2.989 -0.056 1.597
140 HB VAL 18 HB VAL 18 -3.249 -2.598 3.249
141 1HG1 VAL 18 1HG1 VAL 18 -4.384 0.159 3.890
142 2HG1 VAL 18 2HG1 VAL 18 -4.897 -1.357 4.655
143 3HG1 VAL 18 3HG1 VAL 18 -3.248 -0.778 4.884
144 1HG2 VAL 18 1HG2 VAL 18 -4.623 -2.386 1.122
145 2HG2 VAL 18 2HG2 VAL 18 -5.605 -2.454 2.589
146 3HG2 VAL 18 3HG2 VAL 18 -5.329 -0.904 1.775
147 H LEU 19 H LEU 19 -0.530 -2.111 3.278
148 HA LEU 19 HA LEU 19 0.189 0.055 5.063
149 1HB LEU 19 1HB LEU 19 1.707 -2.447 4.457
150 2HB LEU 19 2HB LEU 19 1.946 -1.323 5.811
151 HG LEU 19 HG LEU 19 -0.492 -2.926 5.466
152 1HD1 LEU 19 1HD1 LEU 19 1.440 -4.357 6.003
153 2HD1 LEU 19 2HD1 LEU 19 1.818 -3.328 7.400
154 3HD1 LEU 19 3HD1 LEU 19 0.320 -4.282 7.375
155 1HD2 LEU 19 1HD2 LEU 19 0.396 -1.129 7.753
156 2HD2 LEU 19 2HD2 LEU 19 -1.012 -0.885 6.696
157 3HD2 LEU 19 3HD2 LEU 19 -0.989 -2.235 7.831
158 H PHE 20 H PHE 20 1.554 -1.159 1.968
159 HA PHE 20 HA PHE 20 3.827 0.559 1.851
160 1HB PHE 20 1HB PHE 20 3.440 -1.246 0.248
161 2HB PHE 20 2HB PHE 20 1.985 -0.478 -0.352
162 HD1 PHE 20 HD1 PHE 20 2.104 1.605 -1.740
163 HD2 PHE 20 HD2 PHE 20 5.661 -0.504 -0.478
164 HE1 PHE 20 HE1 PHE 20 3.418 2.759 -3.505
165 HE2 PHE 20 HE2 PHE 20 6.959 0.619 -2.277
166 HZ PHE 20 HZ PHE 20 5.839 2.242 -3.798
167 H CYS 21 H CYS 21 0.344 1.152 0.983
168 HA CYS 21 HA CYS 21 0.685 3.940 0.498
169 1HB CYS 21 1HB CYS 21 -1.346 2.670 -0.143
170 2HB CYS 21 2HB CYS 21 -1.818 2.579 1.561
171 HG CYS 21 HG CYS 21 -1.635 5.225 1.918
172 H MET 22 H MET 22 0.212 2.069 3.626
173 HA MET 22 HA MET 22 -0.282 4.397 5.153
174 1HB MET 22 1HB MET 22 -0.877 2.003 5.700
175 2HB MET 22 2HB MET 22 0.809 1.785 6.224
176 1HG MET 22 1HG MET 22 0.520 3.522 7.928
177 2HG MET 22 2HG MET 22 -1.110 3.858 7.343
178 1HE MET 22 1HE MET 22 -3.197 2.551 7.916
179 2HE MET 22 2HE MET 22 -2.594 1.138 7.013
180 3HE MET 22 3HE MET 22 -3.211 0.938 8.666
181 H LYS 23 H LYS 23 2.733 3.111 3.974
182 HA LYS 23 HA LYS 23 4.230 5.043 5.667
183 1HB LYS 23 1HB LYS 23 4.327 2.121 5.735
184 2HB LYS 23 2HB LYS 23 5.793 2.623 4.947
185 1HG LYS 23 1HG LYS 23 6.283 2.440 7.249
186 2HG LYS 23 2HG LYS 23 6.287 4.171 6.878
187 1HD LYS 23 1HD LYS 23 3.988 4.380 7.817
188 2HD LYS 23 2HD LYS 23 3.934 2.650 8.143
189 1HE LYS 23 1HE LYS 23 5.907 4.648 9.377
190 2HE LYS 23 2HE LYS 23 4.427 4.068 10.153
191 1HZ LYS 23 1HZ LYS 23 5.315 1.842 10.065
192 2HZ LYS 23 2HZ LYS 23 6.711 2.384 9.381
193 3HZ LYS 23 3HZ LYS 23 6.314 2.841 10.910
194 H TYR 24 H TYR 24 4.399 3.312 2.552
195 HA TYR 24 HA TYR 24 6.765 4.767 1.744
196 1HB TYR 24 1HB TYR 24 5.810 2.446 0.936
197 2HB TYR 24 2HB TYR 24 4.861 3.410 -0.178
198 HD1 TYR 24 HD1 TYR 24 6.024 4.801 -1.938
199 HD2 TYR 24 HD2 TYR 24 8.207 2.193 0.730
200 HE1 TYR 24 HE1 TYR 24 8.015 4.964 -3.401
201 HE2 TYR 24 HE2 TYR 24 10.192 2.346 -0.739
202 HH TYR 24 HH TYR 24 10.188 4.302 -3.751
203 H VAL 25 H VAL 25 3.337 5.417 1.696
204 HA VAL 25 HA VAL 25 3.644 7.686 -0.240
205 HB VAL 25 HB VAL 25 1.131 6.179 0.526
206 1HG1 VAL 25 1HG1 VAL 25 1.622 8.338 -1.564
207 2HG1 VAL 25 2HG1 VAL 25 0.131 7.391 -1.389
208 3HG1 VAL 25 3HG1 VAL 25 0.624 8.492 -0.103
209 1HG2 VAL 25 1HG2 VAL 25 2.823 6.066 -2.017
210 2HG2 VAL 25 2HG2 VAL 25 2.645 4.754 -0.837
211 3HG2 VAL 25 3HG2 VAL 25 1.252 5.275 -1.787
212 H TRP 26 H TRP 26 2.068 6.834 2.916
213 HA TRP 26 HA TRP 26 0.825 9.220 3.442
214 1HB TRP 26 1HB TRP 26 2.003 7.074 5.186
215 2HB TRP 26 2HB TRP 26 1.414 8.531 5.955
216 HD1 TRP 26 HD1 TRP 26 -0.674 7.403 3.020
217 HE1 TRP 26 HE1 TRP 26 -2.911 6.440 3.877
218 HE3 TRP 26 HE3 TRP 26 0.386 7.165 8.034
219 HZ2 TRP 26 HZ2 TRP 26 -4.084 5.695 6.369
220 HZ3 TRP 26 HZ3 TRP 26 -1.332 6.347 9.632
221 HH2 TRP 26 HH2 TRP 26 -3.564 5.614 8.812
222 HA PRO 27 HA PRO 27 4.465 11.267 5.793
223 1HB PRO 27 1HB PRO 27 7.078 10.364 5.138
224 2HB PRO 27 2HB PRO 27 6.155 10.101 6.633
225 1HG PRO 27 1HG PRO 27 6.421 8.275 4.266
226 2HG PRO 27 2HG PRO 27 6.343 7.856 5.991
227 1HD PRO 27 1HD PRO 27 4.200 7.558 4.349
228 2HD PRO 27 2HD PRO 27 4.001 8.086 6.042
229 HA PRO 28 HA PRO 28 6.549 12.974 1.889
230 1HB PRO 28 1HB PRO 28 6.316 11.760 -0.593
231 2HB PRO 28 2HB PRO 28 7.639 11.454 0.560
232 1HG PRO 28 1HG PRO 28 5.108 9.841 0.196
233 2HG PRO 28 2HG PRO 28 6.782 9.238 0.272
234 1HD PRO 28 1HD PRO 28 5.234 9.167 2.470
235 2HD PRO 28 2HD PRO 28 6.943 9.672 2.601
236 H LEU 29 H LEU 29 3.435 11.274 1.248
237 HA LEU 29 HA LEU 29 2.125 13.320 -0.196
238 1HB LEU 29 1HB LEU 29 1.295 11.015 0.224
239 2HB LEU 29 2HB LEU 29 0.970 11.407 1.894
240 HG LEU 29 HG LEU 29 -0.994 11.323 0.394
241 1HD1 LEU 29 1HD1 LEU 29 -1.045 12.600 2.540
242 2HD1 LEU 29 2HD1 LEU 29 -0.732 14.090 1.626
243 3HD1 LEU 29 3HD1 LEU 29 -2.197 13.160 1.318
244 1HD2 LEU 29 1HD2 LEU 29 0.030 12.347 -1.626
245 2HD2 LEU 29 2HD2 LEU 29 -1.512 13.096 -1.174
246 3HD2 LEU 29 3HD2 LEU 29 0.007 13.931 -0.820
247 H MET 30 H MET 30 2.400 12.769 3.327
248 HA MET 30 HA MET 30 0.945 15.027 4.233
249 1HB MET 30 1HB MET 30 1.618 13.019 5.571
250 2HB MET 30 2HB MET 30 3.275 13.628 5.622
251 1HG MET 30 1HG MET 30 2.457 15.697 6.765
252 2HG MET 30 2HG MET 30 0.818 15.050 6.745
253 1HE MET 30 1HE MET 30 0.064 12.938 8.065
254 2HE MET 30 2HE MET 30 1.418 11.876 7.592
255 3HE MET 30 3HE MET 30 1.037 12.121 9.310
256 H ALA 31 H ALA 31 4.475 14.643 3.647
257 HA ALA 31 HA ALA 31 5.252 17.278 4.348
258 1HB ALA 31 1HB ALA 31 6.831 15.390 4.092
259 2HB ALA 31 2HB ALA 31 6.542 15.376 2.340
260 3HB ALA 31 3HB ALA 31 7.317 16.778 3.102
261 H ALA 32 H ALA 32 4.257 15.943 1.167
262 HA ALA 32 HA ALA 32 4.644 18.273 -0.373
263 1HB ALA 32 1HB ALA 32 4.407 16.038 -1.339
264 2HB ALA 32 2HB ALA 32 2.713 15.959 -0.818
265 3HB ALA 32 3HB ALA 32 3.215 17.149 -2.032
266 H ILE 33 H ILE 33 1.631 17.057 1.206
267 HA ILE 33 HA ILE 33 0.045 19.332 0.314
268 HB ILE 33 HB ILE 33 -0.557 17.053 2.227
269 1HG1 ILE 33 1HG1 ILE 33 -0.146 16.262 -0.066
270 2HG1 ILE 33 2HG1 ILE 33 -1.822 16.054 0.420
271 1HG2 ILE 33 1HG2 ILE 33 -2.419 19.173 1.082
272 2HG2 ILE 33 2HG2 ILE 33 -2.964 17.660 1.838
273 3HG2 ILE 33 3HG2 ILE 33 -2.067 18.846 2.786
274 1HD1 ILE 33 1HD1 ILE 33 -2.454 18.056 -0.939
275 2HD1 ILE 33 2HD1 ILE 33 -0.757 18.222 -1.450
276 3HD1 ILE 33 3HD1 ILE 33 -1.683 16.785 -1.896
277 H GMA 34 H GLU 34 1.268 18.279 3.530
278 HA GMA 34 HA GLU 34 0.372 20.836 4.767
279 1HB GMA 34 1HB GLU 34 -0.445 18.744 5.739
280 2HB GMA 34 2HB GLU 34 1.207 18.169 5.977
281 1HG GMA 34 1HG GLU 34 1.646 20.076 7.530
282 2HG GMA 34 2HG GLU 34 -0.012 20.639 7.286
283 2HN GMA 34 2HN GLU 34 4.418 19.920 5.050
284 1HN GMA 34 1NH GLU 34 3.257 18.622 4.799
Start of MODEL 3
1 1H MET 1 1H MET 1 -11.230 -28.954 1.030
2 2H MET 1 2H MET 1 -11.408 -29.403 -0.590
3 HA MET 1 HA MET 1 -8.856 -29.228 0.887
4 1HB MET 1 1HB MET 1 -9.428 -29.875 -2.036
5 2HB MET 1 2HB MET 1 -7.821 -29.649 -1.331
6 1HG MET 1 1HG MET 1 -8.257 -31.528 0.247
7 2HG MET 1 2HG MET 1 -9.806 -31.825 -0.546
8 1HE MET 1 1HE MET 1 -10.088 -32.703 -2.967
9 2HE MET 1 2HE MET 1 -9.017 -31.489 -3.714
10 3HE MET 1 3HE MET 1 -8.751 -33.218 -4.019
11 H ASN 2 H ASN 2 -9.395 -27.065 1.571
12 HA ASN 2 HA ASN 2 -10.001 -24.929 -0.228
13 1HB ASN 2 1HB ASN 2 -10.521 -24.859 2.175
14 2HB ASN 2 2HB ASN 2 -8.798 -24.916 2.571
15 1HD2 ASN 2 2HD2 ASN 2 -8.934 -22.870 3.733
16 2HD2 ASN 2 1HD2 ASN 2 -9.128 -21.371 2.846
17 H LEU 3 H LEU 3 -8.686 -23.595 -1.405
18 HA LEU 3 HA LEU 3 -5.764 -24.007 -1.545
19 1HB LEU 3 1HB LEU 3 -7.592 -22.073 -3.037
20 2HB LEU 3 2HB LEU 3 -5.875 -22.326 -3.324
21 HG LEU 3 HG LEU 3 -6.991 -23.422 -5.037
22 1HD1 LEU 3 1HD1 LEU 3 -5.067 -24.671 -4.063
23 2HD1 LEU 3 2HD1 LEU 3 -6.207 -25.649 -3.111
24 3HD1 LEU 3 3HD1 LEU 3 -6.239 -25.718 -4.880
25 1HD2 LEU 3 1HD2 LEU 3 -9.244 -23.626 -3.962
26 2HD2 LEU 3 2HD2 LEU 3 -8.734 -25.038 -4.900
27 3HD2 LEU 3 3HD2 LEU 3 -8.676 -25.096 -3.140
28 H ASN 4 H ASN 4 -6.213 -23.407 0.934
29 HA ASN 4 HA ASN 4 -6.804 -20.950 1.902
30 1HB ASN 4 1HB ASN 4 -6.244 -23.123 3.131
31 2HB ASN 4 2HB ASN 4 -4.557 -22.662 3.079
32 1HD2 ASN 4 2HD2 ASN 4 -3.951 -20.543 4.179
33 2HD2 ASN 4 1HD2 ASN 4 -4.959 -20.024 5.519
34 H ALA 5 H ALA 5 -3.497 -21.976 1.128
35 HA ALA 5 HA ALA 5 -2.017 -19.658 1.663
36 1HB ALA 5 1HB ALA 5 -1.033 -21.861 1.165
37 2HB ALA 5 2HB ALA 5 -1.561 -21.732 -0.526
38 3HB ALA 5 3HB ALA 5 -0.346 -20.609 0.119
39 H THR 6 H THR 6 -4.059 -20.312 -1.158
40 HA THR 6 HA THR 6 -3.050 -18.069 -2.735
41 HB THR 6 HB THR 6 -5.629 -19.649 -3.120
42 HG1 THR 6 HG1 THR 6 -3.723 -20.946 -3.182
43 1HG2 THR 6 1HG2 THR 6 -3.984 -17.933 -5.034
44 2HG2 THR 6 2HG2 THR 6 -5.384 -18.930 -5.476
45 3HG2 THR 6 3HG2 THR 6 -5.598 -17.541 -4.406
46 H ILE 7 H ILE 7 -5.620 -18.525 -0.309
47 HA ILE 7 HA ILE 7 -7.045 -16.032 -1.038
48 HB ILE 7 HB ILE 7 -7.473 -18.031 1.229
49 1HG1 ILE 7 1HG1 ILE 7 -9.007 -17.683 -1.394
50 2HG1 ILE 7 2HG1 ILE 7 -7.858 -18.981 -1.059
51 1HG2 ILE 7 1HG2 ILE 7 -8.333 -15.750 1.771
52 2HG2 ILE 7 2HG2 ILE 7 -9.256 -15.747 0.256
53 3HG2 ILE 7 3HG2 ILE 7 -9.645 -16.895 1.554
54 1HD1 ILE 7 1HD1 ILE 7 -9.277 -19.718 0.874
55 2HD1 ILE 7 2HD1 ILE 7 -10.519 -18.557 0.343
56 3HD1 ILE 7 3HD1 ILE 7 -10.034 -19.882 -0.721
57 H LEU 8 H LEU 8 -5.152 -17.417 1.613
58 HA LEU 8 HA LEU 8 -4.498 -15.238 3.209
59 1HB LEU 8 1HB LEU 8 -3.924 -17.622 3.573
60 2HB LEU 8 2HB LEU 8 -2.851 -17.584 2.184
61 HG LEU 8 HG LEU 8 -1.353 -15.966 3.334
62 1HD1 LEU 8 1HD1 LEU 8 -3.284 -16.277 5.684
63 2HD1 LEU 8 2HD1 LEU 8 -1.679 -15.526 5.776
64 3HD1 LEU 8 3HD1 LEU 8 -2.937 -14.779 4.791
65 1HD2 LEU 8 1HD2 LEU 8 -0.945 -18.388 3.555
66 2HD2 LEU 8 2HD2 LEU 8 -0.470 -17.529 5.027
67 3HD2 LEU 8 3HD2 LEU 8 -1.989 -18.447 4.991
68 H GLY 9 H GLY 9 -2.723 -16.365 0.219
69 1HA GLY 9 1HA GLY 9 -0.928 -14.201 0.180
70 2HA GLY 9 2HA GLY 9 -1.224 -15.261 -1.140
71 H GLN 10 H GLN 10 -4.178 -14.547 -1.375
72 HA GLN 10 HA GLN 10 -4.180 -12.092 -2.856
73 1HB GLN 10 1HB GLN 10 -6.289 -13.902 -1.646
74 2HB GLN 10 2HB GLN 10 -6.733 -12.359 -2.327
75 1HG GLN 10 1HG GLN 10 -5.831 -12.954 -4.512
76 2HG GLN 10 2HG GLN 10 -5.164 -14.454 -3.882
77 1HE2 GLN 10 2HE2 GLN 10 -8.242 -12.726 -4.557
78 2HE2 GLN 10 1HE2 GLN 10 -9.203 -14.193 -4.666
79 H ALA 11 H ALA 11 -5.113 -12.851 0.562
80 HA ALA 11 HA ALA 11 -5.634 -10.134 1.292
81 1HB ALA 11 1HB ALA 11 -6.475 -12.063 2.582
82 2HB ALA 11 2HB ALA 11 -4.823 -12.471 3.079
83 3HB ALA 11 3HB ALA 11 -5.552 -10.944 3.598
84 H ILE 12 H ILE 12 -2.575 -11.965 1.122
85 HA ILE 12 HA ILE 12 -0.931 -9.986 2.420
86 HB ILE 12 HB ILE 12 -0.375 -12.181 0.410
87 1HG1 ILE 12 1HG1 ILE 12 -0.855 -12.721 2.861
88 2HG1 ILE 12 2HG1 ILE 12 0.644 -13.364 2.186
89 1HG2 ILE 12 1HG2 ILE 12 1.662 -10.236 1.442
90 2HG2 ILE 12 2HG2 ILE 12 2.061 -11.823 0.746
91 3HG2 ILE 12 3HG2 ILE 12 1.256 -10.608 -0.245
92 1HD1 ILE 12 1HD1 ILE 12 0.483 -10.788 3.816
93 2HD1 ILE 12 2HD1 ILE 12 0.928 -12.384 4.448
94 3HD1 ILE 12 3HD1 ILE 12 1.952 -11.597 3.232
95 H ALA 13 H ALA 13 -1.777 -10.536 -1.029
96 HA ALA 13 HA ALA 13 -0.414 -8.357 -2.155
97 1HB ALA 13 1HB ALA 13 -1.475 -10.188 -3.427
98 2HB ALA 13 2HB ALA 13 -3.080 -9.568 -3.008
99 3HB ALA 13 3HB ALA 13 -1.992 -8.594 -4.010
100 H PHE 14 H PHE 14 -3.716 -8.500 -0.739
101 HA PHE 14 HA PHE 14 -4.376 -5.745 -1.111
102 1HB PHE 14 1HB PHE 14 -6.035 -7.476 -0.664
103 2HB PHE 14 2HB PHE 14 -5.369 -7.758 0.933
104 HD1 PHE 14 HD1 PHE 14 -6.929 -5.081 -1.209
105 HD2 PHE 14 HD2 PHE 14 -6.178 -6.490 2.807
106 HE1 PHE 14 HE1 PHE 14 -8.400 -3.293 -0.302
107 HE2 PHE 14 HE2 PHE 14 -7.653 -4.706 3.707
108 HZ PHE 14 HZ PHE 14 -8.772 -3.109 2.156
109 H VAL 15 H VAL 15 -3.129 -7.379 1.884
110 HA VAL 15 HA VAL 15 -3.096 -4.987 3.428
111 HB VAL 15 HB VAL 15 -1.799 -7.712 3.833
112 1HG1 VAL 15 1HG1 VAL 15 -1.896 -5.360 5.777
113 2HG1 VAL 15 2HG1 VAL 15 -1.475 -7.028 6.215
114 3HG1 VAL 15 3HG1 VAL 15 -0.436 -6.125 5.112
115 1HG2 VAL 15 1HG2 VAL 15 -4.321 -7.585 3.940
116 2HG2 VAL 15 2HG2 VAL 15 -3.594 -8.002 5.494
117 3HG2 VAL 15 3HG2 VAL 15 -4.179 -6.352 5.199
118 H LEU 16 H LEU 16 -0.374 -6.754 1.823
119 HA LEU 16 HA LEU 16 1.666 -4.934 2.447
120 1HB LEU 16 1HB LEU 16 1.287 -6.575 -0.062
121 2HB LEU 16 2HB LEU 16 2.730 -5.623 0.273
122 HG LEU 16 HG LEU 16 1.737 -7.884 2.063
123 1HD1 LEU 16 1HD1 LEU 16 2.613 -8.607 -0.188
124 2HD1 LEU 16 2HD1 LEU 16 4.102 -7.696 0.110
125 3HD1 LEU 16 3HD1 LEU 16 3.707 -9.096 1.123
126 1HD2 LEU 16 1HD2 LEU 16 4.252 -6.160 2.198
127 2HD2 LEU 16 2HD2 LEU 16 2.993 -6.327 3.444
128 3HD2 LEU 16 3HD2 LEU 16 4.038 -7.690 3.070
129 H PHE 17 H PHE 17 -0.669 -4.694 -0.309
130 HA PHE 17 HA PHE 17 0.287 -2.287 -1.439
131 1HB PHE 17 1HB PHE 17 -1.554 -3.886 -2.253
132 2HB PHE 17 2HB PHE 17 -2.672 -3.058 -1.251
133 HD1 PHE 17 HD1 PHE 17 -0.543 -2.743 -4.258
134 HD2 PHE 17 HD2 PHE 17 -3.359 -0.714 -1.681
135 HE1 PHE 17 HE1 PHE 17 -0.800 -0.939 -5.952
136 HE2 PHE 17 HE2 PHE 17 -3.606 1.089 -3.374
137 HZ PHE 17 HZ PHE 17 -2.329 0.978 -5.511
138 H VAL 18 H VAL 18 -2.403 -2.740 0.782
139 HA VAL 18 HA VAL 18 -3.025 -0.066 1.375
140 HB VAL 18 HB VAL 18 -3.356 -2.570 3.069
141 1HG1 VAL 18 1HG1 VAL 18 -4.513 0.201 3.600
142 2HG1 VAL 18 2HG1 VAL 18 -5.058 -1.297 4.379
143 3HG1 VAL 18 3HG1 VAL 18 -3.419 -0.711 4.661
144 1HG2 VAL 18 1HG2 VAL 18 -4.643 -2.410 0.885
145 2HG2 VAL 18 2HG2 VAL 18 -5.684 -2.441 2.313
146 3HG2 VAL 18 3HG2 VAL 18 -5.373 -0.911 1.472
147 H LEU 19 H LEU 19 -0.634 -2.090 3.180
148 HA LEU 19 HA LEU 19 0.030 0.117 4.938
149 1HB LEU 19 1HB LEU 19 1.561 -2.402 4.457
150 2HB LEU 19 2HB LEU 19 1.748 -1.243 5.790
151 HG LEU 19 HG LEU 19 -0.682 -2.849 5.392
152 1HD1 LEU 19 1HD1 LEU 19 1.221 -4.276 6.033
153 2HD1 LEU 19 2HD1 LEU 19 1.554 -3.216 7.418
154 3HD1 LEU 19 3HD1 LEU 19 0.052 -4.163 7.359
155 1HD2 LEU 19 1HD2 LEU 19 0.132 -1.004 7.669
156 2HD2 LEU 19 2HD2 LEU 19 -1.234 -0.777 6.554
157 3HD2 LEU 19 3HD2 LEU 19 -1.263 -2.100 7.717
158 H PHE 20 H PHE 20 1.462 -1.156 1.905
159 HA PHE 20 HA PHE 20 3.766 0.538 1.880
160 1HB PHE 20 1HB PHE 20 3.455 -1.330 0.314
161 2HB PHE 20 2HB PHE 20 2.054 -0.561 -0.403
162 HD1 PHE 20 HD1 PHE 20 2.298 1.454 -1.866
163 HD2 PHE 20 HD2 PHE 20 5.732 -0.642 -0.281
164 HE1 PHE 20 HE1 PHE 20 3.742 2.502 -3.597
165 HE2 PHE 20 HE2 PHE 20 7.161 0.378 -2.042
166 HZ PHE 20 HZ PHE 20 6.167 1.938 -3.708
167 H CYS 21 H CYS 21 0.329 1.132 0.876
168 HA CYS 21 HA CYS 21 0.714 3.919 0.335
169 1HB CYS 21 1HB CYS 21 -1.303 2.703 -0.359
170 2HB CYS 21 2HB CYS 21 -1.810 2.539 1.328
171 HG CYS 21 HG CYS 21 -1.130 5.329 -0.284
172 H MET 22 H MET 22 0.098 2.095 3.474
173 HA MET 22 HA MET 22 -0.297 4.451 4.977
174 1HB MET 22 1HB MET 22 -0.984 2.089 5.544
175 2HB MET 22 2HB MET 22 0.689 1.822 6.094
176 1HG MET 22 1HG MET 22 0.444 3.574 7.776
177 2HG MET 22 2HG MET 22 -1.157 3.984 7.160
178 1HE MET 22 1HE MET 22 -3.314 2.783 7.691
179 2HE MET 22 2HE MET 22 -2.764 1.324 6.827
180 3HE MET 22 3HE MET 22 -3.425 1.189 8.471
181 H LYS 23 H LYS 23 2.669 3.108 3.772
182 HA LYS 23 HA LYS 23 4.225 4.920 5.547
183 1HB LYS 23 1HB LYS 23 4.255 2.173 5.759
184 2HB LYS 23 2HB LYS 23 5.380 2.312 4.428
185 1HG LYS 23 1HG LYS 23 6.816 3.850 5.776
186 2HG LYS 23 2HG LYS 23 5.674 3.712 7.127
187 1HD LYS 23 1HD LYS 23 6.074 1.257 7.217
188 2HD LYS 23 2HD LYS 23 7.217 1.394 5.865
189 1HE LYS 23 1HE LYS 23 8.657 2.907 7.237
190 2HE LYS 23 2HE LYS 23 7.514 2.775 8.585
191 1HZ LYS 23 1HZ LYS 23 7.969 0.422 8.658
192 2HZ LYS 23 2HZ LYS 23 9.030 0.544 7.406
193 3HZ LYS 23 3HZ LYS 23 9.361 1.281 8.840
194 H TYR 24 H TYR 24 4.366 3.359 2.340
195 HA TYR 24 HA TYR 24 6.720 4.845 1.572
196 1HB TYR 24 1HB TYR 24 5.739 2.520 0.736
197 2HB TYR 24 2HB TYR 24 4.850 3.515 -0.399
198 HD1 TYR 24 HD1 TYR 24 6.100 4.816 -2.155
199 HD2 TYR 24 HD2 TYR 24 8.153 2.281 0.681
200 HE1 TYR 24 HE1 TYR 24 8.152 4.913 -3.543
201 HE2 TYR 24 HE2 TYR 24 10.195 2.371 -0.703
202 HH TYR 24 HH TYR 24 11.162 3.188 -2.632
203 H VAL 25 H VAL 25 3.325 5.534 1.606
204 HA VAL 25 HA VAL 25 3.605 7.817 -0.322
205 HB VAL 25 HB VAL 25 1.105 6.279 0.437
206 1HG1 VAL 25 1HG1 VAL 25 1.549 8.517 -1.580
207 2HG1 VAL 25 2HG1 VAL 25 0.067 7.554 -1.420
208 3HG1 VAL 25 3HG1 VAL 25 0.573 8.609 -0.099
209 1HG2 VAL 25 1HG2 VAL 25 2.753 6.264 -2.134
210 2HG2 VAL 25 2HG2 VAL 25 2.604 4.913 -0.994
211 3HG2 VAL 25 3HG2 VAL 25 1.190 5.456 -1.904
212 H TRP 26 H TRP 26 2.136 6.889 2.857
213 HA TRP 26 HA TRP 26 0.877 9.260 3.454
214 1HB TRP 26 1HB TRP 26 2.076 7.057 5.109
215 2HB TRP 26 2HB TRP 26 1.510 8.490 5.937
216 HD1 TRP 26 HD1 TRP 26 -0.545 7.337 2.953
217 HE1 TRP 26 HE1 TRP 26 -2.804 6.412 3.775
218 HE3 TRP 26 HE3 TRP 26 0.379 7.251 8.000
219 HZ2 TRP 26 HZ2 TRP 26 -4.059 5.772 6.261
220 HZ3 TRP 26 HZ3 TRP 26 -1.386 6.493 9.574
221 HH2 TRP 26 HH2 TRP 26 -3.605 5.758 8.719
222 HA PRO 27 HA PRO 27 4.570 11.246 5.792
223 1HB PRO 27 1HB PRO 27 7.162 10.341 5.048
224 2HB PRO 27 2HB PRO 27 6.277 10.056 6.563
225 1HG PRO 27 1HG PRO 27 6.462 8.274 4.153
226 2HG PRO 27 2HG PRO 27 6.430 7.822 5.871
227 1HD PRO 27 1HD PRO 27 4.237 7.572 4.291
228 2HD PRO 27 2HD PRO 27 4.091 8.078 5.995
229 HA PRO 28 HA PRO 28 6.567 13.029 1.878
230 1HB PRO 28 1HB PRO 28 6.257 11.878 -0.625
231 2HB PRO 28 2HB PRO 28 7.609 11.533 0.485
232 1HG PRO 28 1HG PRO 28 5.056 9.950 0.147
233 2HG PRO 28 2HG PRO 28 6.725 9.331 0.167
234 1HD PRO 28 1HD PRO 28 5.229 9.221 2.401
235 2HD PRO 28 2HD PRO 28 6.946 9.705 2.501
236 H LEU 29 H LEU 29 3.426 11.366 1.257
237 HA LEU 29 HA LEU 29 2.084 13.463 -0.091
238 1HB LEU 29 1HB LEU 29 1.276 11.160 0.290
239 2HB LEU 29 2HB LEU 29 0.938 11.512 1.971
240 HG LEU 29 HG LEU 29 -0.318 13.164 -0.258
241 1HD1 LEU 29 1HD1 LEU 29 -1.358 10.522 0.861
242 2HD1 LEU 29 2HD1 LEU 29 -2.249 11.611 -0.223
243 3HD1 LEU 29 3HD1 LEU 29 -0.782 10.807 -0.795
244 1HD2 LEU 29 1HD2 LEU 29 -1.228 12.456 2.581
245 2HD2 LEU 29 2HD2 LEU 29 -0.671 14.049 2.040
246 3HD2 LEU 29 3HD2 LEU 29 -2.175 13.391 1.410
247 H MET 30 H MET 30 2.473 12.828 3.411
248 HA MET 30 HA MET 30 1.057 15.082 4.391
249 1HB MET 30 1HB MET 30 1.735 13.063 5.710
250 2HB MET 30 2HB MET 30 3.406 13.634 5.699
251 1HG MET 30 1HG MET 30 2.720 15.701 6.886
252 2HG MET 30 2HG MET 30 1.037 15.155 6.868
253 1HE MET 30 1HE MET 30 0.898 15.673 9.442
254 2HE MET 30 2HE MET 30 2.033 15.011 10.643
255 3HE MET 30 3HE MET 30 2.603 16.188 9.436
256 H ALA 31 H ALA 31 4.568 14.674 3.760
257 HA ALA 31 HA ALA 31 5.416 17.283 4.465
258 1HB ALA 31 1HB ALA 31 6.932 15.352 4.167
259 2HB ALA 31 2HB ALA 31 6.625 15.375 2.418
260 3HB ALA 31 3HB ALA 31 7.445 16.742 3.196
261 H ALA 32 H ALA 32 4.177 16.040 1.339
262 HA ALA 32 HA ALA 32 4.608 18.401 -0.169
263 1HB ALA 32 1HB ALA 32 4.321 16.210 -1.202
264 2HB ALA 32 2HB ALA 32 2.644 16.122 -0.629
265 3HB ALA 32 3HB ALA 32 3.116 17.353 -1.816
266 H ILE 33 H ILE 33 1.574 17.119 1.332
267 HA ILE 33 HA ILE 33 -0.033 19.399 0.628
268 HB ILE 33 HB ILE 33 -0.460 17.163 2.642
269 1HG1 ILE 33 1HG1 ILE 33 -0.291 16.339 0.322
270 2HG1 ILE 33 2HG1 ILE 33 -1.900 16.136 0.996
271 1HG2 ILE 33 1HG2 ILE 33 -2.421 19.276 1.663
272 2HG2 ILE 33 2HG2 ILE 33 -2.893 17.776 2.490
273 3HG2 ILE 33 3HG2 ILE 33 -1.899 18.969 3.327
274 1HD1 ILE 33 1HD1 ILE 33 -2.691 18.113 -0.312
275 2HD1 ILE 33 2HD1 ILE 33 -1.062 18.283 -1.009
276 3HD1 ILE 33 3HD1 ILE 33 -2.020 16.834 -1.333
277 H GMA 34 H GLU 34 1.466 18.418 3.729
278 HA GMA 34 HA GLU 34 1.265 21.216 4.759
279 1HB GMA 34 1HB GLU 34 -0.057 19.543 6.068
280 2HB GMA 34 2HB GLU 34 1.412 18.595 6.318
281 1HG GMA 34 1HG GLU 34 0.921 19.957 8.289
282 2HG GMA 34 2HG GLU 34 2.426 20.513 7.569
283 2HN GMA 34 2HN GLU 34 4.676 20.614 3.575
284 1HN GMA 34 1NH GLU 34 3.116 21.227 3.052
Start of MODEL 4
1 1H MET 1 1H MET 1 -10.538 -28.946 -1.957
2 2H MET 1 2H MET 1 -11.935 -28.012 -2.147
3 HA MET 1 HA MET 1 -9.429 -27.719 -3.687
4 1HB MET 1 1HB MET 1 -12.030 -26.118 -3.756
5 2HB MET 1 2HB MET 1 -10.551 -25.699 -4.626
6 1HG MET 1 1HG MET 1 -10.651 -27.846 -5.868
7 2HG MET 1 2HG MET 1 -12.140 -28.263 -5.018
8 1HE MET 1 1HE MET 1 -10.431 -26.018 -7.664
9 2HE MET 1 2HE MET 1 -11.775 -25.033 -8.285
10 3HE MET 1 3HE MET 1 -11.121 -24.711 -6.666
11 H ASN 2 H ASN 2 -8.600 -27.832 -1.331
12 HA ASN 2 HA ASN 2 -9.043 -25.516 0.369
13 1HB ASN 2 1HB ASN 2 -8.696 -27.924 1.110
14 2HB ASN 2 2HB ASN 2 -7.002 -27.760 0.661
15 1HD2 ASN 2 2HD2 ASN 2 -9.591 -26.442 2.798
16 2HD2 ASN 2 1HD2 ASN 2 -8.474 -25.925 4.053
17 H LEU 3 H LEU 3 -8.251 -24.265 -1.815
18 HA LEU 3 HA LEU 3 -5.330 -23.838 -1.922
19 1HB LEU 3 1HB LEU 3 -7.666 -22.586 -3.419
20 2HB LEU 3 2HB LEU 3 -5.991 -22.101 -3.637
21 HG LEU 3 HG LEU 3 -6.642 -23.512 -5.417
22 1HD1 LEU 3 1HD1 LEU 3 -4.282 -23.607 -4.607
23 2HD1 LEU 3 2HD1 LEU 3 -4.683 -25.071 -3.682
24 3HD1 LEU 3 3HD1 LEU 3 -4.809 -25.078 -5.445
25 1HD2 LEU 3 1HD2 LEU 3 -8.376 -24.865 -4.250
26 2HD2 LEU 3 2HD2 LEU 3 -7.279 -25.815 -5.264
27 3HD2 LEU 3 3HD2 LEU 3 -7.080 -25.838 -3.509
28 H ASN 4 H ASN 4 -6.090 -23.383 0.657
29 HA ASN 4 HA ASN 4 -6.921 -20.876 1.438
30 1HB ASN 4 1HB ASN 4 -5.065 -22.955 2.700
31 2HB ASN 4 2HB ASN 4 -5.710 -21.547 3.524
32 1HD2 ASN 4 2HD2 ASN 4 -6.769 -22.987 5.073
33 2HD2 ASN 4 1HD2 ASN 4 -8.271 -23.765 4.599
34 H ALA 5 H ALA 5 -3.587 -21.980 0.739
35 HA ALA 5 HA ALA 5 -2.083 -19.707 1.400
36 1HB ALA 5 1HB ALA 5 -1.126 -21.887 0.765
37 2HB ALA 5 2HB ALA 5 -1.693 -21.667 -0.904
38 3HB ALA 5 3HB ALA 5 -0.455 -20.587 -0.231
39 H THR 6 H THR 6 -4.130 -20.241 -1.479
40 HA THR 6 HA THR 6 -3.187 -17.889 -2.888
41 HB THR 6 HB THR 6 -5.745 -19.478 -3.361
42 HG1 THR 6 HG1 THR 6 -4.413 -20.597 -4.867
43 1HG2 THR 6 1HG2 THR 6 -4.035 -17.752 -5.214
44 2HG2 THR 6 2HG2 THR 6 -5.427 -18.733 -5.711
45 3HG2 THR 6 3HG2 THR 6 -5.666 -17.357 -4.633
46 H ILE 7 H ILE 7 -5.619 -18.433 -0.380
47 HA ILE 7 HA ILE 7 -7.088 -15.916 -0.963
48 HB ILE 7 HB ILE 7 -7.411 -17.864 1.363
49 1HG1 ILE 7 1HG1 ILE 7 -7.867 -19.181 -0.577
50 2HG1 ILE 7 2HG1 ILE 7 -9.387 -18.770 0.200
51 1HG2 ILE 7 1HG2 ILE 7 -9.222 -15.658 0.295
52 2HG2 ILE 7 2HG2 ILE 7 -9.656 -16.818 1.566
53 3HG2 ILE 7 3HG2 ILE 7 -8.346 -15.665 1.833
54 1HD1 ILE 7 1HD1 ILE 7 -9.752 -16.977 -1.537
55 2HD1 ILE 7 2HD1 ILE 7 -8.248 -17.500 -2.330
56 3HD1 ILE 7 3HD1 ILE 7 -9.621 -18.606 -2.216
57 H LEU 8 H LEU 8 -5.091 -17.406 1.554
58 HA LEU 8 HA LEU 8 -4.375 -15.283 3.194
59 1HB LEU 8 1HB LEU 8 -3.857 -17.680 3.450
60 2HB LEU 8 2HB LEU 8 -2.757 -17.623 2.090
61 HG LEU 8 HG LEU 8 -1.727 -17.685 4.378
62 1HD1 LEU 8 1HD1 LEU 8 -0.455 -16.896 2.377
63 2HD1 LEU 8 2HD1 LEU 8 -0.830 -15.223 2.839
64 3HD1 LEU 8 3HD1 LEU 8 0.117 -16.243 3.920
65 1HD2 LEU 8 1HD2 LEU 8 -3.309 -16.130 5.513
66 2HD2 LEU 8 2HD2 LEU 8 -1.609 -15.700 5.768
67 3HD2 LEU 8 3HD2 LEU 8 -2.587 -14.770 4.622
68 H GLY 9 H GLY 9 -2.692 -16.327 0.128
69 1HA GLY 9 1HA GLY 9 -0.893 -14.163 0.108
70 2HA GLY 9 2HA GLY 9 -1.211 -15.188 -1.231
71 H GLN 10 H GLN 10 -4.203 -14.448 -1.332
72 HA GLN 10 HA GLN 10 -4.160 -11.939 -2.753
73 1HB GLN 10 1HB GLN 10 -6.270 -13.831 -1.709
74 2HB GLN 10 2HB GLN 10 -6.744 -12.228 -2.210
75 1HG GLN 10 1HG GLN 10 -5.825 -12.525 -4.438
76 2HG GLN 10 2HG GLN 10 -5.112 -14.077 -4.001
77 1HE2 GLN 10 2HE2 GLN 10 -6.680 -15.797 -3.247
78 2HE2 GLN 10 1HE2 GLN 10 -8.245 -15.863 -4.066
79 H ALA 11 H ALA 11 -5.044 -12.814 0.641
80 HA ALA 11 HA ALA 11 -5.558 -10.121 1.467
81 1HB ALA 11 1HB ALA 11 -6.350 -12.090 2.728
82 2HB ALA 11 2HB ALA 11 -4.681 -12.505 3.159
83 3HB ALA 11 3HB ALA 11 -5.398 -10.997 3.745
84 H ILE 12 H ILE 12 -2.505 -11.943 1.147
85 HA ILE 12 HA ILE 12 -0.816 -9.988 2.425
86 HB ILE 12 HB ILE 12 -0.339 -12.146 0.357
87 1HG1 ILE 12 1HG1 ILE 12 -0.707 -12.710 2.821
88 2HG1 ILE 12 2HG1 ILE 12 0.760 -13.348 2.068
89 1HG2 ILE 12 1HG2 ILE 12 1.740 -10.207 1.320
90 2HG2 ILE 12 2HG2 ILE 12 2.110 -11.784 0.586
91 3HG2 ILE 12 3HG2 ILE 12 1.258 -10.558 -0.352
92 1HD1 ILE 12 1HD1 ILE 12 0.684 -10.789 3.730
93 2HD1 ILE 12 2HD1 ILE 12 1.149 -12.394 4.327
94 3HD1 ILE 12 3HD1 ILE 12 2.119 -11.600 3.072
95 H ALA 13 H ALA 13 -1.787 -10.468 -1.004
96 HA ALA 13 HA ALA 13 -0.470 -8.261 -2.127
97 1HB ALA 13 1HB ALA 13 -1.576 -10.065 -3.400
98 2HB ALA 13 2HB ALA 13 -3.165 -9.455 -2.912
99 3HB ALA 13 3HB ALA 13 -2.112 -8.459 -3.930
100 H PHE 14 H PHE 14 -3.721 -8.446 -0.606
101 HA PHE 14 HA PHE 14 -4.407 -5.689 -0.888
102 1HB PHE 14 1HB PHE 14 -6.038 -7.440 -0.414
103 2HB PHE 14 2HB PHE 14 -5.310 -7.750 1.151
104 HD1 PHE 14 HD1 PHE 14 -6.977 -5.049 -0.873
105 HD2 PHE 14 HD2 PHE 14 -6.040 -6.520 3.081
106 HE1 PHE 14 HE1 PHE 14 -8.422 -3.289 0.129
107 HE2 PHE 14 HE2 PHE 14 -7.490 -4.765 4.076
108 HZ PHE 14 HZ PHE 14 -8.690 -3.152 2.602
109 H VAL 15 H VAL 15 -3.034 -7.377 2.021
110 HA VAL 15 HA VAL 15 -2.946 -5.016 3.613
111 HB VAL 15 HB VAL 15 -1.617 -7.739 3.901
112 1HG1 VAL 15 1HG1 VAL 15 -1.631 -5.428 5.897
113 2HG1 VAL 15 2HG1 VAL 15 -1.182 -7.102 6.279
114 3HG1 VAL 15 3HG1 VAL 15 -0.202 -6.171 5.147
115 1HG2 VAL 15 1HG2 VAL 15 -4.133 -7.624 4.129
116 2HG2 VAL 15 2HG2 VAL 15 -3.329 -8.074 5.637
117 3HG2 VAL 15 3HG2 VAL 15 -3.933 -6.421 5.409
118 H LEU 16 H LEU 16 -0.287 -6.731 1.858
119 HA LEU 16 HA LEU 16 1.770 -4.912 2.417
120 1HB LEU 16 1HB LEU 16 1.278 -6.511 -0.100
121 2HB LEU 16 2HB LEU 16 2.732 -5.559 0.181
122 HG LEU 16 HG LEU 16 1.835 -7.854 1.979
123 1HD1 LEU 16 1HD1 LEU 16 2.596 -8.539 -0.323
124 2HD1 LEU 16 2HD1 LEU 16 4.096 -7.627 -0.088
125 3HD1 LEU 16 3HD1 LEU 16 3.758 -9.043 0.921
126 1HD2 LEU 16 1HD2 LEU 16 4.349 -6.126 2.016
127 2HD2 LEU 16 2HD2 LEU 16 3.154 -6.314 3.319
128 3HD2 LEU 16 3HD2 LEU 16 4.181 -7.669 2.873
129 H PHE 17 H PHE 17 -0.687 -4.639 -0.232
130 HA PHE 17 HA PHE 17 0.199 -2.203 -1.356
131 1HB PHE 17 1HB PHE 17 -1.667 -3.801 -2.114
132 2HB PHE 17 2HB PHE 17 -2.743 -3.002 -1.046
133 HD1 PHE 17 HD1 PHE 17 -0.752 -2.607 -4.138
134 HD2 PHE 17 HD2 PHE 17 -3.471 -0.659 -1.401
135 HE1 PHE 17 HE1 PHE 17 -1.098 -0.771 -5.781
136 HE2 PHE 17 HE2 PHE 17 -3.808 1.175 -3.044
137 HZ PHE 17 HZ PHE 17 -2.624 1.122 -5.236
138 H VAL 18 H VAL 18 -2.379 -2.720 0.981
139 HA VAL 18 HA VAL 18 -2.988 -0.057 1.642
140 HB VAL 18 HB VAL 18 -3.246 -2.595 3.301
141 1HG1 VAL 18 1HG1 VAL 18 -4.389 0.163 3.932
142 2HG1 VAL 18 2HG1 VAL 18 -4.901 -1.352 4.701
143 3HG1 VAL 18 3HG1 VAL 18 -3.252 -0.768 4.930
144 1HG2 VAL 18 1HG2 VAL 18 -4.620 -2.394 1.172
145 2HG2 VAL 18 2HG2 VAL 18 -5.604 -2.458 2.639
146 3HG2 VAL 18 3HG2 VAL 18 -5.329 -0.911 1.818
147 H LEU 19 H LEU 19 -0.497 -2.093 3.287
148 HA LEU 19 HA LEU 19 0.213 0.080 5.075
149 1HB LEU 19 1HB LEU 19 1.729 -2.422 4.475
150 2HB LEU 19 2HB LEU 19 1.973 -1.289 5.822
151 HG LEU 19 HG LEU 19 -0.467 -2.894 5.497
152 1HD1 LEU 19 1HD1 LEU 19 1.465 -4.327 6.028
153 2HD1 LEU 19 2HD1 LEU 19 1.854 -3.292 7.419
154 3HD1 LEU 19 3HD1 LEU 19 0.354 -4.245 7.405
155 1HD2 LEU 19 1HD2 LEU 19 0.436 -1.091 7.772
156 2HD2 LEU 19 2HD2 LEU 19 -0.978 -0.849 6.722
157 3HD2 LEU 19 3HD2 LEU 19 -0.951 -2.195 7.860
158 H PHE 20 H PHE 20 1.560 -1.143 1.978
159 HA PHE 20 HA PHE 20 3.829 0.581 1.841
160 1HB PHE 20 1HB PHE 20 3.437 -1.240 0.254
161 2HB PHE 20 2HB PHE 20 1.982 -0.475 -0.348
162 HD1 PHE 20 HD1 PHE 20 2.097 1.594 -1.754
163 HD2 PHE 20 HD2 PHE 20 5.658 -0.504 -0.481
164 HE1 PHE 20 HE1 PHE 20 3.410 2.738 -3.528
165 HE2 PHE 20 HE2 PHE 20 6.954 0.608 -2.289
166 HZ PHE 20 HZ PHE 20 5.830 2.220 -3.820
167 H CYS 21 H CYS 21 0.340 1.156 1.005
168 HA CYS 21 HA CYS 21 0.651 3.947 0.507
169 1HB CYS 21 1HB CYS 21 -1.373 2.717 -0.118
170 2HB CYS 21 2HB CYS 21 -1.803 2.509 1.584
171 HG CYS 21 HG CYS 21 -1.248 5.343 0.004
172 H MET 22 H MET 22 0.176 2.080 3.645
173 HA MET 22 HA MET 22 -0.270 4.405 5.177
174 1HB MET 22 1HB MET 22 -0.863 2.015 5.734
175 2HB MET 22 2HB MET 22 0.829 1.799 6.246
176 1HG MET 22 1HG MET 22 0.554 3.538 7.947
177 2HG MET 22 2HG MET 22 -1.080 3.878 7.373
178 1HE MET 22 1HE MET 22 -3.166 2.579 7.962
179 2HE MET 22 2HE MET 22 -2.575 1.161 7.060
180 3HE MET 22 3HE MET 22 -3.181 0.970 8.717
181 H LYS 23 H LYS 23 2.735 3.136 3.963
182 HA LYS 23 HA LYS 23 4.246 5.062 5.646
183 1HB LYS 23 1HB LYS 23 4.332 2.137 5.725
184 2HB LYS 23 2HB LYS 23 5.803 2.634 4.947
185 1HG LYS 23 1HG LYS 23 6.241 2.444 7.286
186 2HG LYS 23 2HG LYS 23 6.301 4.167 6.884
187 1HD LYS 23 1HD LYS 23 4.018 4.475 7.802
188 2HD LYS 23 2HD LYS 23 3.872 2.731 8.080
189 1HE LYS 23 1HE LYS 23 5.749 2.845 9.715
190 2HE LYS 23 2HE LYS 23 5.924 4.581 9.402
191 1HZ LYS 23 1HZ LYS 23 3.692 4.891 10.224
192 2HZ LYS 23 2HZ LYS 23 3.532 3.281 10.522
193 3HZ LYS 23 3HZ LYS 23 4.631 4.169 11.369
194 H TYR 24 H TYR 24 4.388 3.319 2.535
195 HA TYR 24 HA TYR 24 6.755 4.771 1.716
196 1HB TYR 24 1HB TYR 24 5.803 2.442 0.919
197 2HB TYR 24 2HB TYR 24 4.857 3.402 -0.203
198 HD1 TYR 24 HD1 TYR 24 6.023 4.779 -1.969
199 HD2 TYR 24 HD2 TYR 24 8.203 2.198 0.728
200 HE1 TYR 24 HE1 TYR 24 8.020 4.925 -3.433
201 HE2 TYR 24 HE2 TYR 24 10.191 2.336 -0.735
202 HH TYR 24 HH TYR 24 11.074 3.204 -2.677
203 H VAL 25 H VAL 25 3.325 5.412 1.679
204 HA VAL 25 HA VAL 25 3.622 7.674 -0.266
205 HB VAL 25 HB VAL 25 1.109 6.175 0.519
206 1HG1 VAL 25 1HG1 VAL 25 1.598 8.322 -1.585
207 2HG1 VAL 25 2HG1 VAL 25 0.105 7.381 -1.401
208 3HG1 VAL 25 3HG1 VAL 25 0.608 8.485 -0.120
209 1HG2 VAL 25 1HG2 VAL 25 2.792 6.044 -2.031
210 2HG2 VAL 25 2HG2 VAL 25 2.613 4.739 -0.845
211 3HG2 VAL 25 3HG2 VAL 25 1.218 5.259 -1.792
212 H TRP 26 H TRP 26 2.063 6.832 2.899
213 HA TRP 26 HA TRP 26 0.828 9.219 3.431
214 1HB TRP 26 1HB TRP 26 2.022 7.088 5.183
215 2HB TRP 26 2HB TRP 26 1.407 8.543 5.937
216 HD1 TRP 26 HD1 TRP 26 -0.605 7.311 2.975
217 HE1 TRP 26 HE1 TRP 26 -2.830 6.311 3.797
218 HE3 TRP 26 HE3 TRP 26 0.328 7.247 8.021
219 HZ2 TRP 26 HZ2 TRP 26 -4.061 5.622 6.285
220 HZ3 TRP 26 HZ3 TRP 26 -1.412 6.434 9.597
221 HH2 TRP 26 HH2 TRP 26 -3.604 5.623 8.742
222 HA PRO 27 HA PRO 27 4.490 11.262 5.757
223 1HB PRO 27 1HB PRO 27 7.097 10.359 5.085
224 2HB PRO 27 2HB PRO 27 6.182 10.090 6.585
225 1HG PRO 27 1HG PRO 27 6.431 8.274 4.208
226 2HG PRO 27 2HG PRO 27 6.367 7.847 5.932
227 1HD PRO 27 1HD PRO 27 4.211 7.555 4.309
228 2HD PRO 27 2HD PRO 27 4.026 8.081 6.004
229 HA PRO 28 HA PRO 28 6.531 12.978 1.840
230 1HB PRO 28 1HB PRO 28 6.282 11.770 -0.642
231 2HB PRO 28 2HB PRO 28 7.615 11.460 0.499
232 1HG PRO 28 1HG PRO 28 5.079 9.848 0.150
233 2HG PRO 28 2HG PRO 28 6.754 9.244 0.208
234 1HD PRO 28 1HD PRO 28 5.225 9.166 2.421
235 2HD PRO 28 2HD PRO 28 6.935 9.668 2.537
236 H LEU 29 H LEU 29 3.415 11.270 1.235
237 HA LEU 29 HA LEU 29 2.094 13.308 -0.215
238 1HB LEU 29 1HB LEU 29 1.257 11.003 0.205
239 2HB LEU 29 2HB LEU 29 0.938 11.427 1.877
240 HG LEU 29 HG LEU 29 -0.700 13.141 1.154
241 1HD1 LEU 29 1HD1 LEU 29 -0.052 12.132 -1.659
242 2HD1 LEU 29 2HD1 LEU 29 -1.493 13.080 -1.252
243 3HD1 LEU 29 3HD1 LEU 29 0.104 13.799 -1.059
244 1HD2 LEU 29 1HD2 LEU 29 -1.395 10.822 1.653
245 2HD2 LEU 29 2HD2 LEU 29 -2.420 11.556 0.404
246 3HD2 LEU 29 3HD2 LEU 29 -1.165 10.383 -0.054
247 H MET 30 H MET 30 2.408 12.767 3.294
248 HA MET 30 HA MET 30 0.955 15.017 4.241
249 1HB MET 30 1HB MET 30 1.606 13.057 5.608
250 2HB MET 30 2HB MET 30 3.295 13.566 5.553
251 1HG MET 30 1HG MET 30 2.752 15.652 6.734
252 2HG MET 30 2HG MET 30 1.034 15.238 6.723
253 1HE MET 30 1HE MET 30 1.194 15.962 9.268
254 2HE MET 30 2HE MET 30 2.122 15.070 10.497
255 3HE MET 30 3HE MET 30 2.971 16.076 9.303
256 H ALA 31 H ALA 31 4.479 14.640 3.613
257 HA ALA 31 HA ALA 31 5.297 17.268 4.279
258 1HB ALA 31 1HB ALA 31 6.839 15.367 3.975
259 2HB ALA 31 2HB ALA 31 6.505 15.363 2.230
260 3HB ALA 31 3HB ALA 31 7.309 16.755 2.980
261 H ALA 32 H ALA 32 4.209 15.928 1.131
262 HA ALA 32 HA ALA 32 4.567 18.239 -0.442
263 1HB ALA 32 1HB ALA 32 4.290 15.997 -1.378
264 2HB ALA 32 2HB ALA 32 2.609 15.935 -0.815
265 3HB ALA 32 3HB ALA 32 3.090 17.109 -2.054
266 H ILE 33 H ILE 33 1.574 17.061 1.212
267 HA ILE 33 HA ILE 33 -0.032 19.324 0.370
268 HB ILE 33 HB ILE 33 -0.505 17.133 2.423
269 1HG1 ILE 33 1HG1 ILE 33 -1.602 17.542 -0.407
270 2HG1 ILE 33 2HG1 ILE 33 -0.307 16.423 0.016
271 1HG2 ILE 33 1HG2 ILE 33 -1.877 19.128 2.999
272 2HG2 ILE 33 2HG2 ILE 33 -2.482 19.193 1.331
273 3HG2 ILE 33 3HG2 ILE 33 -2.884 17.831 2.396
274 1HD1 ILE 33 1HD1 ILE 33 -1.895 15.229 1.568
275 2HD1 ILE 33 2HD1 ILE 33 -3.208 16.229 0.905
276 3HD1 ILE 33 3HD1 ILE 33 -2.310 15.143 -0.155
277 H GMA 34 H GLU 34 1.336 18.369 3.547
278 HA GMA 34 HA GLU 34 0.730 21.051 4.705
279 1HB GMA 34 1HB GLU 34 -0.426 19.273 5.753
280 2HB GMA 34 2HB GLU 34 1.003 18.260 5.890
281 1HG GMA 34 1HG GLU 34 0.785 20.964 7.293
282 2HG GMA 34 2HG GLU 34 0.168 19.473 8.005
283 2HN GMA 34 2HN GLU 34 4.596 19.628 5.195
284 1HN GMA 34 1NH GLU 34 3.274 18.473 5.057
Start of MODEL 5
1 1H MET 1 1H MET 1 -0.028 -23.923 -4.234
2 2H MET 1 2H MET 1 0.296 -22.308 -4.602
3 HA MET 1 HA MET 1 -2.008 -21.830 -4.829
4 1HB MET 1 1HB MET 1 -0.796 -22.498 -6.863
5 2HB MET 1 2HB MET 1 -1.158 -24.200 -6.550
6 1HG MET 1 1HG MET 1 -2.657 -23.313 -8.242
7 2HG MET 1 2HG MET 1 -3.582 -23.735 -6.804
8 1HE MET 1 1HE MET 1 -4.888 -22.126 -9.093
9 2HE MET 1 2HE MET 1 -5.707 -22.460 -7.547
10 3HE MET 1 3HE MET 1 -5.691 -20.808 -8.207
11 H ASN 2 H ASN 2 -3.574 -22.206 -3.312
12 HA ASN 2 HA ASN 2 -5.054 -24.698 -3.297
13 1HB ASN 2 1HB ASN 2 -3.122 -25.265 -1.781
14 2HB ASN 2 2HB ASN 2 -3.540 -23.879 -0.768
15 1HD2 ASN 2 2HD2 ASN 2 -3.688 -25.497 1.005
16 2HD2 ASN 2 1HD2 ASN 2 -5.158 -26.450 1.138
17 H LEU 3 H LEU 3 -7.037 -24.519 -2.026
18 HA LEU 3 HA LEU 3 -8.145 -21.820 -2.076
19 1HB LEU 3 1HB LEU 3 -9.193 -24.109 -2.827
20 2HB LEU 3 2HB LEU 3 -9.684 -24.250 -1.146
21 HG LEU 3 HG LEU 3 -10.329 -21.975 -3.095
22 1HD1 LEU 3 1HD1 LEU 3 -11.465 -24.100 -3.637
23 2HD1 LEU 3 2HD1 LEU 3 -12.105 -24.192 -1.983
24 3HD1 LEU 3 3HD1 LEU 3 -12.621 -22.886 -3.070
25 1HD2 LEU 3 1HD2 LEU 3 -11.380 -22.392 -0.259
26 2HD2 LEU 3 2HD2 LEU 3 -10.334 -21.060 -0.809
27 3HD2 LEU 3 3HD2 LEU 3 -11.983 -21.195 -1.418
28 H ASN 4 H ASN 4 -6.237 -21.684 -0.330
29 HA ASN 4 HA ASN 4 -7.375 -20.770 2.142
30 1HB ASN 4 1HB ASN 4 -7.140 -23.210 2.537
31 2HB ASN 4 2HB ASN 4 -5.428 -23.143 2.157
32 1HD2 ASN 4 2HD2 ASN 4 -6.056 -24.208 4.578
33 2HD2 ASN 4 1HD2 ASN 4 -5.688 -23.061 5.857
34 H ALA 5 H ALA 5 -4.163 -21.993 1.065
35 HA ALA 5 HA ALA 5 -2.603 -19.778 1.822
36 1HB ALA 5 1HB ALA 5 -1.721 -22.047 1.371
37 2HB ALA 5 2HB ALA 5 -2.085 -21.852 -0.357
38 3HB ALA 5 3HB ALA 5 -0.869 -20.820 0.420
39 H THR 6 H THR 6 -4.267 -20.391 -1.312
40 HA THR 6 HA THR 6 -3.125 -18.099 -2.623
41 HB THR 6 HB THR 6 -5.721 -19.574 -3.250
42 HG1 THR 6 HG1 THR 6 -4.336 -20.681 -4.723
43 1HG2 THR 6 1HG2 THR 6 -3.918 -17.837 -4.998
44 2HG2 THR 6 2HG2 THR 6 -5.291 -18.800 -5.576
45 3HG2 THR 6 3HG2 THR 6 -5.572 -17.444 -4.482
46 H ILE 7 H ILE 7 -5.841 -18.421 -0.360
47 HA ILE 7 HA ILE 7 -7.098 -15.864 -1.184
48 HB ILE 7 HB ILE 7 -7.791 -18.004 0.868
49 1HG1 ILE 7 1HG1 ILE 7 -9.881 -18.178 -0.394
50 2HG1 ILE 7 2HG1 ILE 7 -9.379 -16.898 -1.502
51 1HG2 ILE 7 1HG2 ILE 7 -9.137 -15.298 0.473
52 2HG2 ILE 7 2HG2 ILE 7 -9.814 -16.647 1.405
53 3HG2 ILE 7 3HG2 ILE 7 -8.329 -15.874 1.946
54 1HD1 ILE 7 1HD1 ILE 7 -7.883 -19.539 -1.207
55 2HD1 ILE 7 2HD1 ILE 7 -9.192 -19.269 -2.376
56 3HD1 ILE 7 3HD1 ILE 7 -7.710 -18.325 -2.504
57 H LEU 8 H LEU 8 -5.449 -17.333 1.585
58 HA LEU 8 HA LEU 8 -4.794 -15.169 3.210
59 1HB LEU 8 1HB LEU 8 -4.444 -17.613 3.532
60 2HB LEU 8 2HB LEU 8 -3.120 -17.588 2.382
61 HG LEU 8 HG LEU 8 -3.159 -15.943 4.967
62 1HD1 LEU 8 1HD1 LEU 8 -3.373 -18.347 5.497
63 2HD1 LEU 8 2HD1 LEU 8 -1.961 -18.710 4.484
64 3HD1 LEU 8 3HD1 LEU 8 -1.778 -17.741 5.962
65 1HD2 LEU 8 1HD2 LEU 8 -0.884 -16.762 3.087
66 2HD2 LEU 8 2HD2 LEU 8 -1.439 -15.110 3.432
67 3HD2 LEU 8 3HD2 LEU 8 -0.644 -16.041 4.689
68 H GLY 9 H GLY 9 -2.867 -16.417 0.366
69 1HA GLY 9 1HA GLY 9 -0.987 -14.323 0.456
70 2HA GLY 9 2HA GLY 9 -1.200 -15.395 -0.868
71 H GLN 10 H GLN 10 -4.122 -14.560 -1.344
72 HA GLN 10 HA GLN 10 -3.859 -12.132 -2.859
73 1HB GLN 10 1HB GLN 10 -6.146 -13.839 -1.856
74 2HB GLN 10 2HB GLN 10 -6.459 -12.300 -2.628
75 1HG GLN 10 1HG GLN 10 -5.417 -12.940 -4.678
76 2HG GLN 10 2HG GLN 10 -4.702 -14.387 -3.971
77 1HE2 GLN 10 2HE2 GLN 10 -5.976 -14.870 -6.247
78 2HE2 GLN 10 1HE2 GLN 10 -7.549 -15.597 -5.953
79 H ALA 11 H ALA 11 -5.094 -12.806 0.479
80 HA ALA 11 HA ALA 11 -5.595 -10.059 1.114
81 1HB ALA 11 1HB ALA 11 -6.596 -11.932 2.370
82 2HB ALA 11 2HB ALA 11 -5.001 -12.382 2.999
83 3HB ALA 11 3HB ALA 11 -5.715 -10.822 3.433
84 H ILE 12 H ILE 12 -2.602 -11.998 1.206
85 HA ILE 12 HA ILE 12 -0.982 -10.043 2.572
86 HB ILE 12 HB ILE 12 -0.372 -12.316 0.670
87 1HG1 ILE 12 1HG1 ILE 12 -1.027 -12.728 3.106
88 2HG1 ILE 12 2HG1 ILE 12 0.475 -13.470 2.543
89 1HG2 ILE 12 1HG2 ILE 12 1.669 -10.406 1.759
90 2HG2 ILE 12 2HG2 ILE 12 2.049 -12.029 1.141
91 3HG2 ILE 12 3HG2 ILE 12 1.351 -10.821 0.063
92 1HD1 ILE 12 1HD1 ILE 12 0.357 -10.823 4.057
93 2HD1 ILE 12 2HD1 ILE 12 0.674 -12.412 4.783
94 3HD1 ILE 12 3HD1 ILE 12 1.809 -11.735 3.599
95 H ALA 13 H ALA 13 -1.604 -10.651 -0.916
96 HA ALA 13 HA ALA 13 -0.088 -8.548 -1.990
97 1HB ALA 13 1HB ALA 13 -1.126 -10.372 -3.292
98 2HB ALA 13 2HB ALA 13 -2.731 -9.685 -3.001
99 3HB ALA 13 3HB ALA 13 -1.542 -8.775 -3.946
100 H PHE 14 H PHE 14 -3.484 -8.544 -0.814
101 HA PHE 14 HA PHE 14 -4.021 -5.778 -1.287
102 1HB PHE 14 1HB PHE 14 -5.767 -7.441 -0.921
103 2HB PHE 14 2HB PHE 14 -5.221 -7.713 0.724
104 HD1 PHE 14 HD1 PHE 14 -6.527 -5.019 -1.564
105 HD2 PHE 14 HD2 PHE 14 -6.120 -6.391 2.515
106 HE1 PHE 14 HE1 PHE 14 -7.990 -3.164 -0.789
107 HE2 PHE 14 HE2 PHE 14 -7.588 -4.541 3.281
108 HZ PHE 14 HZ PHE 14 -8.532 -2.929 1.632
109 H VAL 15 H VAL 15 -3.042 -7.381 1.825
110 HA VAL 15 HA VAL 15 -3.029 -4.957 3.318
111 HB VAL 15 HB VAL 15 -1.846 -7.709 3.859
112 1HG1 VAL 15 1HG1 VAL 15 -1.982 -5.311 5.744
113 2HG1 VAL 15 2HG1 VAL 15 -1.644 -6.981 6.242
114 3HG1 VAL 15 3HG1 VAL 15 -0.511 -6.137 5.186
115 1HG2 VAL 15 1HG2 VAL 15 -4.367 -7.495 3.808
116 2HG2 VAL 15 2HG2 VAL 15 -3.748 -7.905 5.411
117 3HG2 VAL 15 3HG2 VAL 15 -4.256 -6.243 5.052
118 H LEU 16 H LEU 16 -0.270 -6.837 1.923
119 HA LEU 16 HA LEU 16 1.789 -5.070 2.628
120 1HB LEU 16 1HB LEU 16 1.494 -6.752 0.135
121 2HB LEU 16 2HB LEU 16 2.949 -5.841 0.529
122 HG LEU 16 HG LEU 16 1.786 -8.026 2.312
123 1HD1 LEU 16 1HD1 LEU 16 2.740 -8.837 0.128
124 2HD1 LEU 16 2HD1 LEU 16 4.244 -7.970 0.473
125 3HD1 LEU 16 3HD1 LEU 16 3.754 -9.327 1.499
126 1HD2 LEU 16 1HD2 LEU 16 4.354 -6.392 2.533
127 2HD2 LEU 16 2HD2 LEU 16 3.029 -6.476 3.716
128 3HD2 LEU 16 3HD2 LEU 16 4.036 -7.888 3.431
129 H PHE 17 H PHE 17 -0.362 -4.823 -0.276
130 HA PHE 17 HA PHE 17 0.730 -2.470 -1.392
131 1HB PHE 17 1HB PHE 17 -1.113 -4.038 -2.275
132 2HB PHE 17 2HB PHE 17 -2.258 -3.141 -1.370
133 HD1 PHE 17 HD1 PHE 17 0.045 -3.002 -4.254
134 HD2 PHE 17 HD2 PHE 17 -2.817 -0.779 -1.898
135 HE1 PHE 17 HE1 PHE 17 -0.043 -1.242 -6.012
136 HE2 PHE 17 HE2 PHE 17 -2.894 0.979 -3.653
137 HZ PHE 17 HZ PHE 17 -1.510 0.750 -5.712
138 H VAL 18 H VAL 18 -2.099 -2.793 0.676
139 HA VAL 18 HA VAL 18 -2.677 -0.091 1.172
140 HB VAL 18 HB VAL 18 -3.161 -2.537 2.917
141 1HG1 VAL 18 1HG1 VAL 18 -4.271 0.277 3.302
142 2HG1 VAL 18 2HG1 VAL 18 -4.894 -1.182 4.097
143 3HG1 VAL 18 3HG1 VAL 18 -3.257 -0.629 4.446
144 1HG2 VAL 18 1HG2 VAL 18 -4.330 -2.412 0.664
145 2HG2 VAL 18 2HG2 VAL 18 -5.443 -2.375 2.036
146 3HG2 VAL 18 3HG2 VAL 18 -5.050 -0.880 1.169
147 H LEU 19 H LEU 19 -0.484 -2.142 3.202
148 HA LEU 19 HA LEU 19 0.159 0.087 4.922
149 1HB LEU 19 1HB LEU 19 1.696 -2.449 4.566
150 2HB LEU 19 2HB LEU 19 1.809 -1.269 5.887
151 HG LEU 19 HG LEU 19 -0.607 -2.867 5.379
152 1HD1 LEU 19 1HD1 LEU 19 1.240 -4.311 6.127
153 2HD1 LEU 19 2HD1 LEU 19 1.517 -3.243 7.519
154 3HD1 LEU 19 3HD1 LEU 19 0.008 -4.173 7.393
155 1HD2 LEU 19 1HD2 LEU 19 0.104 -1.016 7.683
156 2HD2 LEU 19 2HD2 LEU 19 -1.192 -0.777 6.491
157 3HD2 LEU 19 3HD2 LEU 19 -1.307 -2.092 7.659
158 H PHE 20 H PHE 20 1.712 -1.280 1.985
159 HA PHE 20 HA PHE 20 4.057 0.327 2.072
160 1HB PHE 20 1HB PHE 20 3.725 -1.545 0.494
161 2HB PHE 20 2HB PHE 20 2.463 -0.664 -0.343
162 HD1 PHE 20 HD1 PHE 20 3.045 1.466 -1.628
163 HD2 PHE 20 HD2 PHE 20 6.052 -1.200 -0.031
164 HE1 PHE 20 HE1 PHE 20 4.753 2.500 -3.105
165 HE2 PHE 20 HE2 PHE 20 7.748 -0.180 -1.534
166 HZ PHE 20 HZ PHE 20 7.107 1.682 -3.059
167 H CYS 21 H CYS 21 0.727 1.023 0.822
168 HA CYS 21 HA CYS 21 1.223 3.787 0.273
169 1HB CYS 21 1HB CYS 21 -0.766 2.527 -0.546
170 2HB CYS 21 2HB CYS 21 -1.427 2.534 1.097
171 HG CYS 21 HG CYS 21 -1.208 5.192 1.339
172 H MET 22 H MET 22 0.408 2.037 3.392
173 HA MET 22 HA MET 22 -0.052 4.424 4.844
174 1HB MET 22 1HB MET 22 -0.777 2.092 5.441
175 2HB MET 22 2HB MET 22 0.883 1.801 6.021
176 1HG MET 22 1HG MET 22 0.650 3.568 7.680
177 2HG MET 22 2HG MET 22 -0.933 4.007 7.038
178 1HE MET 22 1HE MET 22 -3.125 2.871 7.574
179 2HE MET 22 2HE MET 22 -2.604 1.403 6.708
180 3HE MET 22 3HE MET 22 -3.280 1.277 8.346
181 H LYS 23 H LYS 23 2.941 3.023 3.752
182 HA LYS 23 HA LYS 23 4.444 4.853 5.556
183 1HB LYS 23 1HB LYS 23 4.521 2.209 5.843
184 2HB LYS 23 2HB LYS 23 5.458 2.206 4.365
185 1HG LYS 23 1HG LYS 23 7.165 3.695 5.422
186 2HG LYS 23 2HG LYS 23 6.206 3.712 6.915
187 1HD LYS 23 1HD LYS 23 6.460 1.241 7.100
188 2HD LYS 23 2HD LYS 23 7.411 1.227 5.602
189 1HE LYS 23 1HE LYS 23 9.120 2.703 6.670
190 2HE LYS 23 2HE LYS 23 8.169 2.724 8.166
191 1HZ LYS 23 1HZ LYS 23 8.480 0.351 8.323
192 2HZ LYS 23 2HZ LYS 23 9.364 0.331 6.935
193 3HZ LYS 23 3HZ LYS 23 9.935 1.119 8.263
194 H TYR 24 H TYR 24 4.762 3.459 2.269
195 HA TYR 24 HA TYR 24 7.038 5.204 1.668
196 1HB TYR 24 1HB TYR 24 5.379 3.329 -0.048
197 2HB TYR 24 2HB TYR 24 6.725 4.272 -0.641
198 HD1 TYR 24 HD1 TYR 24 5.868 1.666 1.943
199 HD2 TYR 24 HD2 TYR 24 8.957 3.458 -0.488
200 HE1 TYR 24 HE1 TYR 24 7.431 -0.136 2.608
201 HE2 TYR 24 HE2 TYR 24 10.518 1.642 0.173
202 HH TYR 24 HH TYR 24 9.523 -1.039 2.325
203 H VAL 25 H VAL 25 3.609 5.609 1.624
204 HA VAL 25 HA VAL 25 3.786 7.898 -0.315
205 HB VAL 25 HB VAL 25 1.369 6.207 0.370
206 1HG1 VAL 25 1HG1 VAL 25 1.727 8.478 -1.625
207 2HG1 VAL 25 2HG1 VAL 25 0.306 7.421 -1.510
208 3HG1 VAL 25 3HG1 VAL 25 0.705 8.502 -0.173
209 1HG2 VAL 25 1HG2 VAL 25 3.078 6.312 -2.156
210 2HG2 VAL 25 2HG2 VAL 25 2.997 4.950 -1.023
211 3HG2 VAL 25 3HG2 VAL 25 1.569 5.398 -1.961
212 H TRP 26 H TRP 26 2.404 6.892 2.869
213 HA TRP 26 HA TRP 26 0.997 9.196 3.474
214 1HB TRP 26 1HB TRP 26 2.310 7.025 5.072
215 2HB TRP 26 2HB TRP 26 1.763 8.435 5.948
216 HD1 TRP 26 HD1 TRP 26 -0.391 7.275 3.031
217 HE1 TRP 26 HE1 TRP 26 -2.636 6.386 3.942
218 HE3 TRP 26 HE3 TRP 26 0.706 7.206 8.043
219 HZ2 TRP 26 HZ2 TRP 26 -3.809 5.776 6.470
220 HZ3 TRP 26 HZ3 TRP 26 -1.008 6.469 9.682
221 HH2 TRP 26 HH2 TRP 26 -3.265 5.762 8.910
222 HA PRO 27 HA PRO 27 4.661 11.349 5.720
223 1HB PRO 27 1HB PRO 27 7.263 10.590 4.854
224 2HB PRO 27 2HB PRO 27 6.461 10.245 6.403
225 1HG PRO 27 1HG PRO 27 6.636 8.492 3.970
226 2HG PRO 27 2HG PRO 27 6.694 8.030 5.685
227 1HD PRO 27 1HD PRO 27 4.464 7.682 4.179
228 2HD PRO 27 2HD PRO 27 4.352 8.152 5.895
229 HA PRO 28 HA PRO 28 6.406 13.284 1.753
230 1HB PRO 28 1HB PRO 28 6.084 12.138 -0.747
231 2HB PRO 28 2HB PRO 28 7.485 11.851 0.317
232 1HG PRO 28 1HG PRO 28 5.003 10.145 0.047
233 2HG PRO 28 2HG PRO 28 6.701 9.611 -0.003
234 1HD PRO 28 1HD PRO 28 5.296 9.402 2.281
235 2HD PRO 28 2HD PRO 28 6.989 9.972 2.326
236 H LEU 29 H LEU 29 3.353 11.432 1.216
237 HA LEU 29 HA LEU 29 1.850 13.441 -0.077
238 1HB LEU 29 1HB LEU 29 1.122 11.111 0.299
239 2HB LEU 29 2HB LEU 29 0.928 11.434 2.011
240 HG LEU 29 HG LEU 29 -0.835 13.107 1.528
241 1HD1 LEU 29 1HD1 LEU 29 -0.431 12.281 -1.389
242 2HD1 LEU 29 2HD1 LEU 29 -1.825 13.195 -0.777
243 3HD1 LEU 29 3HD1 LEU 29 -0.217 13.911 -0.712
244 1HD2 LEU 29 1HD2 LEU 29 -1.392 10.738 1.941
245 2HD2 LEU 29 2HD2 LEU 29 -2.543 11.487 0.818
246 3HD2 LEU 29 3HD2 LEU 29 -1.278 10.402 0.198
247 H MET 30 H MET 30 2.360 12.810 3.397
248 HA MET 30 HA MET 30 0.836 14.960 4.471
249 1HB MET 30 1HB MET 30 1.690 12.953 5.699
250 2HB MET 30 2HB MET 30 3.315 13.645 5.670
251 1HG MET 30 1HG MET 30 2.465 15.638 6.917
252 2HG MET 30 2HG MET 30 0.863 14.903 6.977
253 1HE MET 30 1HE MET 30 0.296 12.729 8.289
254 2HE MET 30 2HE MET 30 1.668 11.751 7.700
255 3HE MET 30 3HE MET 30 1.387 11.931 9.445
256 H ALA 31 H ALA 31 4.341 14.782 3.690
257 HA ALA 31 HA ALA 31 5.083 17.405 4.450
258 1HB ALA 31 1HB ALA 31 6.688 15.598 3.954
259 2HB ALA 31 2HB ALA 31 6.250 15.667 2.235
260 3HB ALA 31 3HB ALA 31 7.035 17.056 3.008
261 H ALA 32 H ALA 32 3.939 16.177 1.274
262 HA ALA 32 HA ALA 32 4.040 18.615 -0.147
263 1HB ALA 32 1HB ALA 32 3.914 16.427 -1.230
264 2HB ALA 32 2HB ALA 32 2.270 16.180 -0.609
265 3HB ALA 32 3HB ALA 32 2.595 17.472 -1.780
266 H ILE 33 H ILE 33 1.216 17.053 1.454
267 HA ILE 33 HA ILE 33 -0.643 19.134 0.787
268 HB ILE 33 HB ILE 33 -0.760 16.819 2.743
269 1HG1 ILE 33 1HG1 ILE 33 -0.590 16.201 0.319
270 2HG1 ILE 33 2HG1 ILE 33 -2.062 15.658 1.113
271 1HG2 ILE 33 1HG2 ILE 33 -2.989 18.729 1.953
272 2HG2 ILE 33 2HG2 ILE 33 -3.253 17.139 2.702
273 3HG2 ILE 33 3HG2 ILE 33 -2.370 18.389 3.577
274 1HD1 ILE 33 1HD1 ILE 33 -1.846 18.063 -0.761
275 2HD1 ILE 33 2HD1 ILE 33 -2.503 16.470 -1.154
276 3HD1 ILE 33 3HD1 ILE 33 -3.337 17.489 0.022
277 H GMA 34 H GLU 34 1.224 18.498 3.801
278 HA GMA 34 HA GLU 34 -0.120 20.674 5.249
279 1HB GMA 34 1HB GLU 34 0.531 18.467 6.304
280 2HB GMA 34 2HB GLU 34 2.225 18.903 6.066
281 1HG GMA 34 1HG GLU 34 1.620 19.428 8.335
282 2HG GMA 34 2HG GLU 34 1.865 20.953 7.487
283 2HN GMA 34 2HN GLU 34 3.691 21.546 3.877
284 1HN GMA 34 1NH GLU 34 3.160 19.889 3.886
Start of MODEL 6
1 1H MET 1 1H MET 1 -14.346 -23.813 -1.303
2 2H MET 1 2H MET 1 -14.001 -22.590 -2.416
3 HA MET 1 HA MET 1 -12.696 -25.232 -2.284
4 1HB MET 1 1HB MET 1 -12.132 -22.841 -4.094
5 2HB MET 1 2HB MET 1 -11.183 -24.332 -4.013
6 1HG MET 1 1HG MET 1 -13.178 -25.645 -4.712
7 2HG MET 1 2HG MET 1 -14.114 -24.153 -4.816
8 1HE MET 1 1HE MET 1 -11.403 -26.407 -6.396
9 2HE MET 1 2HE MET 1 -10.831 -25.445 -7.779
10 3HE MET 1 3HE MET 1 -10.385 -24.967 -6.127
11 H ASN 2 H ASN 2 -11.550 -25.319 -0.419
12 HA ASN 2 HA ASN 2 -10.568 -22.985 0.992
13 1HB ASN 2 1HB ASN 2 -10.144 -25.956 1.502
14 2HB ASN 2 2HB ASN 2 -9.772 -24.653 2.631
15 1HD2 ASN 2 2HD2 ASN 2 -11.605 -23.331 3.486
16 2HD2 ASN 2 1HD2 ASN 2 -13.197 -24.072 3.537
17 H LEU 3 H LEU 3 -9.322 -22.366 -1.085
18 HA LEU 3 HA LEU 3 -6.670 -23.591 -1.459
19 1HB LEU 3 1HB LEU 3 -7.878 -21.081 -2.679
20 2HB LEU 3 2HB LEU 3 -6.411 -21.919 -3.207
21 HG LEU 3 HG LEU 3 -9.249 -23.026 -3.338
22 1HD1 LEU 3 1HD1 LEU 3 -8.811 -21.211 -4.950
23 2HD1 LEU 3 2HD1 LEU 3 -7.371 -22.069 -5.539
24 3HD1 LEU 3 3HD1 LEU 3 -8.986 -22.770 -5.770
25 1HD2 LEU 3 1HD2 LEU 3 -6.608 -24.238 -4.283
26 2HD2 LEU 3 2HD2 LEU 3 -7.681 -24.889 -3.023
27 3HD2 LEU 3 3HD2 LEU 3 -8.218 -24.855 -4.703
28 H ASN 4 H ASN 4 -6.700 -23.091 1.014
29 HA ASN 4 HA ASN 4 -6.441 -20.941 2.441
30 1HB ASN 4 1HB ASN 4 -5.930 -23.261 3.179
31 2HB ASN 4 2HB ASN 4 -4.294 -23.115 2.579
32 1HD2 ASN 4 2HD2 ASN 4 -2.852 -21.455 3.641
33 2HD2 ASN 4 1HD2 ASN 4 -3.228 -20.990 5.292
34 H ALA 5 H ALA 5 -3.346 -22.038 1.022
35 HA ALA 5 HA ALA 5 -1.832 -19.722 1.568
36 1HB ALA 5 1HB ALA 5 -0.864 -21.928 1.023
37 2HB ALA 5 2HB ALA 5 -1.439 -21.780 -0.651
38 3HB ALA 5 3HB ALA 5 -0.206 -20.665 -0.029
39 H THR 6 H THR 6 -3.884 -20.381 -1.264
40 HA THR 6 HA THR 6 -2.959 -18.098 -2.789
41 HB THR 6 HB THR 6 -5.574 -19.629 -3.115
42 HG1 THR 6 HG1 THR 6 -4.331 -20.852 -4.624
43 1HG2 THR 6 1HG2 THR 6 -3.859 -18.068 -5.102
44 2HG2 THR 6 2HG2 THR 6 -5.336 -18.973 -5.488
45 3HG2 THR 6 3HG2 THR 6 -5.425 -17.543 -4.455
46 H ILE 7 H ILE 7 -5.488 -18.612 -0.330
47 HA ILE 7 HA ILE 7 -6.957 -16.129 -1.003
48 HB ILE 7 HB ILE 7 -7.303 -18.239 1.169
49 1HG1 ILE 7 1HG1 ILE 7 -9.087 -17.638 -1.238
50 2HG1 ILE 7 2HG1 ILE 7 -7.814 -18.852 -1.283
51 1HG2 ILE 7 1HG2 ILE 7 -9.071 -15.837 0.505
52 2HG2 ILE 7 2HG2 ILE 7 -9.481 -17.125 1.653
53 3HG2 ILE 7 3HG2 ILE 7 -8.129 -16.055 1.992
54 1HD1 ILE 7 1HD1 ILE 7 -8.871 -20.067 0.616
55 2HD1 ILE 7 2HD1 ILE 7 -10.233 -18.927 0.556
56 3HD1 ILE 7 3HD1 ILE 7 -9.890 -19.966 -0.831
57 H LEU 8 H LEU 8 -5.003 -17.489 1.612
58 HA LEU 8 HA LEU 8 -4.342 -15.309 3.201
59 1HB LEU 8 1HB LEU 8 -3.728 -17.683 3.540
60 2HB LEU 8 2HB LEU 8 -2.694 -17.629 2.121
61 HG LEU 8 HG LEU 8 -1.182 -16.000 3.236
62 1HD1 LEU 8 1HD1 LEU 8 -3.042 -16.340 5.637
63 2HD1 LEU 8 2HD1 LEU 8 -1.443 -15.570 5.687
64 3HD1 LEU 8 3HD1 LEU 8 -2.738 -14.835 4.739
65 1HD2 LEU 8 1HD2 LEU 8 -0.744 -18.419 3.436
66 2HD2 LEU 8 2HD2 LEU 8 -0.235 -17.561 4.898
67 3HD2 LEU 8 3HD2 LEU 8 -1.747 -18.495 4.900
68 H GLY 9 H GLY 9 -2.600 -16.410 0.178
69 1HA GLY 9 1HA GLY 9 -0.848 -14.210 0.116
70 2HA GLY 9 2HA GLY 9 -1.141 -15.273 -1.203
71 H GLN 10 H GLN 10 -4.115 -14.600 -1.373
72 HA GLN 10 HA GLN 10 -4.179 -12.144 -2.858
73 1HB GLN 10 1HB GLN 10 -6.240 -13.988 -1.618
74 2HB GLN 10 2HB GLN 10 -6.717 -12.453 -2.295
75 1HG GLN 10 1HG GLN 10 -5.851 -13.038 -4.492
76 2HG GLN 10 2HG GLN 10 -5.130 -14.516 -3.874
77 1HE2 GLN 10 2HE2 GLN 10 -8.279 -12.872 -4.446
78 2HE2 GLN 10 1HE2 GLN 10 -9.197 -14.368 -4.553
79 H ALA 11 H ALA 11 -5.051 -12.931 0.569
80 HA ALA 11 HA ALA 11 -5.606 -10.227 1.321
81 1HB ALA 11 1HB ALA 11 -6.393 -12.175 2.613
82 2HB ALA 11 2HB ALA 11 -4.726 -12.557 3.084
83 3HB ALA 11 3HB ALA 11 -5.475 -11.045 3.621
84 H ILE 12 H ILE 12 -2.519 -12.001 1.091
85 HA ILE 12 HA ILE 12 -0.888 -9.992 2.362
86 HB ILE 12 HB ILE 12 -0.325 -12.174 0.338
87 1HG1 ILE 12 1HG1 ILE 12 -0.761 -12.740 2.788
88 2HG1 ILE 12 2HG1 ILE 12 0.746 -13.342 2.094
89 1HG2 ILE 12 1HG2 ILE 12 1.689 -10.195 1.354
90 2HG2 ILE 12 2HG2 ILE 12 2.109 -11.770 0.645
91 3HG2 ILE 12 3HG2 ILE 12 1.270 -10.567 -0.330
92 1HD1 ILE 12 1HD1 ILE 12 0.535 -10.784 3.748
93 2HD1 ILE 12 2HD1 ILE 12 1.032 -12.374 4.359
94 3HD1 ILE 12 3HD1 ILE 12 2.019 -11.546 3.140
95 H ALA 13 H ALA 13 -1.768 -10.562 -1.074
96 HA ALA 13 HA ALA 13 -0.472 -8.353 -2.220
97 1HB ALA 13 1HB ALA 13 -1.507 -10.209 -3.476
98 2HB ALA 13 2HB ALA 13 -3.121 -9.628 -3.034
99 3HB ALA 13 3HB ALA 13 -2.071 -8.628 -4.053
100 H PHE 14 H PHE 14 -3.740 -8.567 -0.739
101 HA PHE 14 HA PHE 14 -4.463 -5.823 -1.107
102 1HB PHE 14 1HB PHE 14 -6.083 -7.584 -0.638
103 2HB PHE 14 2HB PHE 14 -5.387 -7.858 0.948
104 HD1 PHE 14 HD1 PHE 14 -6.989 -5.172 -1.160
105 HD2 PHE 14 HD2 PHE 14 -6.240 -6.648 2.833
106 HE1 PHE 14 HE1 PHE 14 -8.487 -3.421 -0.227
107 HE2 PHE 14 HE2 PHE 14 -7.744 -4.902 3.758
108 HZ PHE 14 HZ PHE 14 -8.876 -3.291 2.231
109 H VAL 15 H VAL 15 -3.163 -7.436 1.879
110 HA VAL 15 HA VAL 15 -3.163 -5.045 3.419
111 HB VAL 15 HB VAL 15 -1.813 -7.742 3.826
112 1HG1 VAL 15 1HG1 VAL 15 -1.958 -5.391 5.770
113 2HG1 VAL 15 2HG1 VAL 15 -1.498 -7.048 6.206
114 3HG1 VAL 15 3HG1 VAL 15 -0.482 -6.121 5.103
115 1HG2 VAL 15 1HG2 VAL 15 -4.337 -7.665 3.936
116 2HG2 VAL 15 2HG2 VAL 15 -3.599 -8.064 5.490
117 3HG2 VAL 15 3HG2 VAL 15 -4.218 -6.429 5.193
118 H LEU 16 H LEU 16 -0.421 -6.751 1.784
119 HA LEU 16 HA LEU 16 1.595 -4.906 2.416
120 1HB LEU 16 1HB LEU 16 1.215 -6.515 -0.114
121 2HB LEU 16 2HB LEU 16 2.645 -5.541 0.215
122 HG LEU 16 HG LEU 16 1.718 -7.846 1.985
123 1HD1 LEU 16 1HD1 LEU 16 2.568 -8.525 -0.286
124 2HD1 LEU 16 2HD1 LEU 16 4.044 -7.589 -0.003
125 3HD1 LEU 16 3HD1 LEU 16 3.696 -9.007 0.997
126 1HD2 LEU 16 1HD2 LEU 16 4.205 -6.083 2.106
127 2HD2 LEU 16 2HD2 LEU 16 2.968 -6.285 3.368
128 3HD2 LEU 16 3HD2 LEU 16 4.028 -7.627 2.961
129 H PHE 17 H PHE 17 -0.728 -4.688 -0.351
130 HA PHE 17 HA PHE 17 0.164 -2.249 -1.454
131 1HB PHE 17 1HB PHE 17 -1.629 -3.900 -2.278
132 2HB PHE 17 2HB PHE 17 -2.774 -3.103 -1.284
133 HD1 PHE 17 HD1 PHE 17 -0.626 -2.729 -4.273
134 HD2 PHE 17 HD2 PHE 17 -3.533 -0.784 -1.731
135 HE1 PHE 17 HE1 PHE 17 -0.922 -0.938 -5.975
136 HE2 PHE 17 HE2 PHE 17 -3.821 1.004 -3.433
137 HZ PHE 17 HZ PHE 17 -2.518 0.930 -5.556
138 H VAL 18 H VAL 18 -2.510 -2.798 0.765
139 HA VAL 18 HA VAL 18 -3.237 -0.160 1.382
140 HB VAL 18 HB VAL 18 -3.423 -2.676 3.074
141 1HG1 VAL 18 1HG1 VAL 18 -4.658 0.054 3.650
142 2HG1 VAL 18 2HG1 VAL 18 -5.122 -1.464 4.444
143 3HG1 VAL 18 3HG1 VAL 18 -3.497 -0.819 4.675
144 1HG2 VAL 18 1HG2 VAL 18 -4.776 -2.539 0.928
145 2HG2 VAL 18 2HG2 VAL 18 -5.769 -2.627 2.388
146 3HG2 VAL 18 3HG2 VAL 18 -5.545 -1.077 1.556
147 H LEU 19 H LEU 19 -0.865 -2.115 3.343
148 HA LEU 19 HA LEU 19 -0.224 0.162 4.980
149 1HB LEU 19 1HB LEU 19 1.453 -2.284 4.564
150 2HB LEU 19 2HB LEU 19 1.520 -1.111 5.891
151 HG LEU 19 HG LEU 19 -0.741 -2.928 5.427
152 1HD1 LEU 19 1HD1 LEU 19 1.254 -4.135 6.214
153 2HD1 LEU 19 2HD1 LEU 19 1.403 -3.007 7.579
154 3HD1 LEU 19 3HD1 LEU 19 0.009 -4.103 7.474
155 1HD2 LEU 19 1HD2 LEU 19 -0.244 -0.936 7.671
156 2HD2 LEU 19 2HD2 LEU 19 -1.564 -0.896 6.479
157 3HD2 LEU 19 3HD2 LEU 19 -1.520 -2.172 7.697
158 H PHE 20 H PHE 20 1.255 -1.110 1.967
159 HA PHE 20 HA PHE 20 3.521 0.622 1.913
160 1HB PHE 20 1HB PHE 20 3.239 -1.241 0.362
161 2HB PHE 20 2HB PHE 20 1.810 -0.517 -0.345
162 HD1 PHE 20 HD1 PHE 20 1.986 1.565 -1.759
163 HD2 PHE 20 HD2 PHE 20 5.463 -0.604 -0.376
164 HE1 PHE 20 HE1 PHE 20 3.351 2.596 -3.561
165 HE2 PHE 20 HE2 PHE 20 6.809 0.392 -2.213
166 HZ PHE 20 HZ PHE 20 5.755 1.986 -3.812
167 H CYS 21 H CYS 21 0.061 1.191 0.975
168 HA CYS 21 HA CYS 21 0.456 3.973 0.394
169 1HB CYS 21 1HB CYS 21 -1.580 2.715 -0.263
170 2HB CYS 21 2HB CYS 21 -2.109 2.707 1.428
171 HG CYS 21 HG CYS 21 -3.413 4.492 0.087
172 H MET 22 H MET 22 -0.096 2.202 3.585
173 HA MET 22 HA MET 22 -0.377 4.671 4.981
174 1HB MET 22 1HB MET 22 0.206 1.939 6.125
175 2HB MET 22 2HB MET 22 -0.191 3.386 7.035
176 1HG MET 22 1HG MET 22 -2.347 3.599 5.809
177 2HG MET 22 2HG MET 22 -2.042 2.041 5.048
178 1HE MET 22 1HE MET 22 -4.487 1.414 5.868
179 2HE MET 22 2HE MET 22 -4.978 1.405 7.578
180 3HE MET 22 3HE MET 22 -4.658 2.950 6.756
181 H LYS 23 H LYS 23 2.463 3.205 3.736
182 HA LYS 23 HA LYS 23 4.132 4.895 5.538
183 1HB LYS 23 1HB LYS 23 4.047 2.201 5.803
184 2HB LYS 23 2HB LYS 23 5.057 2.211 4.370
185 1HG LYS 23 1HG LYS 23 6.727 3.652 5.541
186 2HG LYS 23 2HG LYS 23 5.697 3.656 6.985
187 1HD LYS 23 1HD LYS 23 5.897 1.180 7.135
188 2HD LYS 23 2HD LYS 23 6.926 1.174 5.689
189 1HE LYS 23 1HE LYS 23 8.601 2.600 6.876
190 2HE LYS 23 2HE LYS 23 7.573 2.609 8.319
191 1HZ LYS 23 1HZ LYS 23 7.834 0.228 8.443
192 2HZ LYS 23 2HZ LYS 23 8.789 0.219 7.103
193 3HZ LYS 23 3HZ LYS 23 9.303 0.969 8.475
194 H TYR 24 H TYR 24 4.161 3.363 2.316
195 HA TYR 24 HA TYR 24 6.555 4.777 1.521
196 1HB TYR 24 1HB TYR 24 5.456 2.486 0.690
197 2HB TYR 24 2HB TYR 24 4.627 3.532 -0.443
198 HD1 TYR 24 HD1 TYR 24 5.971 4.788 -2.174
199 HD2 TYR 24 HD2 TYR 24 7.847 2.112 0.653
200 HE1 TYR 24 HE1 TYR 24 8.042 4.805 -3.527
201 HE2 TYR 24 HE2 TYR 24 9.916 2.121 -0.702
202 HH TYR 24 HH TYR 24 10.189 4.010 -3.747
203 H VAL 25 H VAL 25 3.184 5.563 1.617
204 HA VAL 25 HA VAL 25 3.487 7.841 -0.311
205 HB VAL 25 HB VAL 25 0.964 6.374 0.508
206 1HG1 VAL 25 1HG1 VAL 25 1.424 8.589 -1.530
207 2HG1 VAL 25 2HG1 VAL 25 -0.081 7.671 -1.327
208 3HG1 VAL 25 3HG1 VAL 25 0.488 8.719 -0.027
209 1HG2 VAL 25 1HG2 VAL 25 2.553 6.301 -2.097
210 2HG2 VAL 25 2HG2 VAL 25 2.384 4.959 -0.948
211 3HG2 VAL 25 3HG2 VAL 25 0.970 5.543 -1.829
212 H TRP 26 H TRP 26 2.068 6.961 2.905
213 HA TRP 26 HA TRP 26 0.911 9.373 3.544
214 1HB TRP 26 1HB TRP 26 2.089 7.131 5.172
215 2HB TRP 26 2HB TRP 26 1.584 8.585 6.004
216 HD1 TRP 26 HD1 TRP 26 -0.664 7.683 3.118
217 HE1 TRP 26 HE1 TRP 26 -2.893 6.752 4.007
218 HE3 TRP 26 HE3 TRP 26 0.607 7.039 8.049
219 HZ2 TRP 26 HZ2 TRP 26 -3.986 5.862 6.492
220 HZ3 TRP 26 HZ3 TRP 26 -1.049 6.105 9.646
221 HH2 TRP 26 HH2 TRP 26 -3.342 5.513 8.880
222 HA PRO 27 HA PRO 27 4.743 11.236 5.753
223 1HB PRO 27 1HB PRO 27 7.276 10.253 4.913
224 2HB PRO 27 2HB PRO 27 6.440 9.994 6.460
225 1HG PRO 27 1HG PRO 27 6.480 8.209 4.045
226 2HG PRO 27 2HG PRO 27 6.496 7.757 5.763
227 1HD PRO 27 1HD PRO 27 4.242 7.578 4.261
228 2HD PRO 27 2HD PRO 27 4.172 8.083 5.970
229 HA PRO 28 HA PRO 28 6.648 12.968 1.776
230 1HB PRO 28 1HB PRO 28 6.243 11.824 -0.717
231 2HB PRO 28 2HB PRO 28 7.612 11.437 0.357
232 1HG PRO 28 1HG PRO 28 5.001 9.935 0.092
233 2HG PRO 28 2HG PRO 28 6.651 9.264 0.059
234 1HD PRO 28 1HD PRO 28 5.223 9.197 2.340
235 2HD PRO 28 2HD PRO 28 6.957 9.629 2.385
236 H LEU 29 H LEU 29 3.444 11.390 1.290
237 HA LEU 29 HA LEU 29 2.135 13.510 -0.048
238 1HB LEU 29 1HB LEU 29 1.222 11.239 0.351
239 2HB LEU 29 2HB LEU 29 1.017 11.616 2.051
240 HG LEU 29 HG LEU 29 -0.594 13.402 1.497
241 1HD1 LEU 29 1HD1 LEU 29 -0.143 12.518 -1.395
242 2HD1 LEU 29 2HD1 LEU 29 -1.517 13.501 -0.857
243 3HD1 LEU 29 3HD1 LEU 29 0.118 14.144 -0.723
244 1HD2 LEU 29 1HD2 LEU 29 -1.348 11.087 1.921
245 2HD2 LEU 29 2HD2 LEU 29 -2.411 11.917 0.767
246 3HD2 LEU 29 3HD2 LEU 29 -1.225 10.727 0.184
247 H MET 30 H MET 30 2.590 12.869 3.429
248 HA MET 30 HA MET 30 1.268 15.146 4.481
249 1HB MET 30 1HB MET 30 1.914 13.114 5.766
250 2HB MET 30 2HB MET 30 3.611 13.586 5.661
251 1HG MET 30 1HG MET 30 2.669 14.185 7.829
252 2HG MET 30 2HG MET 30 3.170 15.628 6.951
253 1HE MET 30 1HE MET 30 1.968 17.026 8.751
254 2HE MET 30 2HE MET 30 0.232 16.933 9.128
255 3HE MET 30 3HE MET 30 1.317 15.606 9.604
256 H ALA 31 H ALA 31 4.730 14.670 3.658
257 HA ALA 31 HA ALA 31 5.685 17.252 4.330
258 1HB ALA 31 1HB ALA 31 7.135 15.300 3.913
259 2HB ALA 31 2HB ALA 31 6.709 15.342 2.191
260 3HB ALA 31 3HB ALA 31 7.602 16.689 2.917
261 H ALA 32 H ALA 32 4.371 16.009 1.219
262 HA ALA 32 HA ALA 32 4.708 18.349 -0.318
263 1HB ALA 32 1HB ALA 32 4.308 16.138 -1.288
264 2HB ALA 32 2HB ALA 32 2.662 16.116 -0.629
265 3HB ALA 32 3HB ALA 32 3.109 17.305 -1.865
266 H ILE 33 H ILE 33 1.809 17.215 1.508
267 HA ILE 33 HA ILE 33 0.183 19.509 0.859
268 HB ILE 33 HB ILE 33 -0.099 17.339 2.966
269 1HG1 ILE 33 1HG1 ILE 33 -1.543 17.786 0.303
270 2HG1 ILE 33 2HG1 ILE 33 -0.218 16.650 0.537
271 1HG2 ILE 33 1HG2 ILE 33 -1.341 19.364 3.709
272 2HG2 ILE 33 2HG2 ILE 33 -2.137 19.455 2.126
273 3HG2 ILE 33 3HG2 ILE 33 -2.447 18.097 3.227
274 1HD1 ILE 33 1HD1 ILE 33 -1.598 15.463 2.288
275 2HD1 ILE 33 2HD1 ILE 33 -2.975 16.481 1.809
276 3HD1 ILE 33 3HD1 ILE 33 -2.240 15.391 0.635
277 H GMA 34 H GLU 34 1.729 18.543 3.973
278 HA GMA 34 HA GLU 34 1.417 21.320 5.015
279 1HB GMA 34 1HB GLU 34 0.335 19.477 6.246
280 2HB GMA 34 2HB GLU 34 1.900 18.686 6.471
281 1HG GMA 34 1HG GLU 34 2.714 20.700 7.728
282 2HG GMA 34 2HG GLU 34 1.146 21.476 7.482
283 2HN GMA 34 2HN GLU 34 5.235 19.684 5.117
284 1HN GMA 34 1NH GLU 34 3.840 18.608 5.078
Start of MODEL 7
1 1H MET 1 1H MET 1 -14.343 -23.983 -3.984
2 2H MET 1 2H MET 1 -14.046 -23.857 -2.327
3 HA MET 1 HA MET 1 -12.146 -24.950 -3.462
4 1HB MET 1 1HB MET 1 -12.137 -22.316 -5.007
5 2HB MET 1 2HB MET 1 -10.837 -23.516 -5.020
6 1HG MET 1 1HG MET 1 -12.418 -25.217 -5.913
7 2HG MET 1 2HG MET 1 -13.686 -23.985 -5.983
8 1HE MET 1 1HE MET 1 -12.889 -25.837 -8.420
9 2HE MET 1 2HE MET 1 -14.165 -24.595 -8.485
10 3HE MET 1 3HE MET 1 -12.907 -24.646 -9.742
11 H ASN 2 H ASN 2 -11.872 -24.768 -1.151
12 HA ASN 2 HA ASN 2 -10.866 -22.337 0.090
13 1HB ASN 2 1HB ASN 2 -11.046 -25.196 1.117
14 2HB ASN 2 2HB ASN 2 -10.670 -23.769 2.095
15 1HD2 ASN 2 2HD2 ASN 2 -12.777 -25.359 2.875
16 2HD2 ASN 2 1HD2 ASN 2 -14.276 -24.494 2.569
17 H LEU 3 H LEU 3 -9.155 -22.291 -1.742
18 HA LEU 3 HA LEU 3 -6.705 -23.853 -1.254
19 1HB LEU 3 1HB LEU 3 -7.767 -23.097 -3.553
20 2HB LEU 3 2HB LEU 3 -6.896 -21.604 -3.253
21 HG LEU 3 HG LEU 3 -5.812 -24.454 -3.479
22 1HD1 LEU 3 1HD1 LEU 3 -6.389 -23.352 -5.606
23 2HD1 LEU 3 2HD1 LEU 3 -5.352 -21.974 -5.192
24 3HD1 LEU 3 3HD1 LEU 3 -4.639 -23.577 -5.467
25 1HD2 LEU 3 1HD2 LEU 3 -4.210 -21.955 -2.804
26 2HD2 LEU 3 2HD2 LEU 3 -4.419 -23.385 -1.778
27 3HD2 LEU 3 3HD2 LEU 3 -3.518 -23.508 -3.289
28 H ASN 4 H ASN 4 -7.060 -22.920 0.926
29 HA ASN 4 HA ASN 4 -6.765 -20.745 2.218
30 1HB ASN 4 1HB ASN 4 -6.328 -23.033 3.120
31 2HB ASN 4 2HB ASN 4 -4.653 -22.920 2.633
32 1HD2 ASN 4 2HD2 ASN 4 -3.281 -21.207 3.695
33 2HD2 ASN 4 1HD2 ASN 4 -3.769 -20.644 5.285
34 H ALA 5 H ALA 5 -3.662 -21.986 0.956
35 HA ALA 5 HA ALA 5 -2.043 -19.767 1.564
36 1HB ALA 5 1HB ALA 5 -1.181 -22.011 0.994
37 2HB ALA 5 2HB ALA 5 -1.714 -21.804 -0.688
38 3HB ALA 5 3HB ALA 5 -0.435 -20.767 -0.023
39 H THR 6 H THR 6 -3.996 -20.314 -1.372
40 HA THR 6 HA THR 6 -2.942 -17.938 -2.743
41 HB THR 6 HB THR 6 -5.315 -19.730 -3.378
42 HG1 THR 6 HG1 THR 6 -3.822 -20.390 -5.023
43 1HG2 THR 6 1HG2 THR 6 -4.033 -17.502 -5.028
44 2HG2 THR 6 2HG2 THR 6 -5.189 -18.697 -5.650
45 3HG2 THR 6 3HG2 THR 6 -5.706 -17.537 -4.426
46 H ILE 7 H ILE 7 -5.522 -18.544 -0.399
47 HA ILE 7 HA ILE 7 -7.062 -16.123 -1.121
48 HB ILE 7 HB ILE 7 -7.384 -18.175 1.112
49 1HG1 ILE 7 1HG1 ILE 7 -9.065 -17.773 -1.407
50 2HG1 ILE 7 2HG1 ILE 7 -7.785 -18.978 -1.277
51 1HG2 ILE 7 1HG2 ILE 7 -8.305 -15.963 1.774
52 2HG2 ILE 7 2HG2 ILE 7 -9.237 -15.898 0.267
53 3HG2 ILE 7 3HG2 ILE 7 -9.595 -17.123 1.500
54 1HD1 ILE 7 1HD1 ILE 7 -8.954 -20.046 0.641
55 2HD1 ILE 7 2HD1 ILE 7 -10.318 -18.929 0.402
56 3HD1 ILE 7 3HD1 ILE 7 -9.878 -20.070 -0.872
57 H LEU 8 H LEU 8 -5.287 -17.401 1.658
58 HA LEU 8 HA LEU 8 -4.614 -15.233 3.216
59 1HB LEU 8 1HB LEU 8 -4.054 -17.611 3.598
60 2HB LEU 8 2HB LEU 8 -2.954 -17.590 2.226
61 HG LEU 8 HG LEU 8 -1.469 -15.979 3.389
62 1HD1 LEU 8 1HD1 LEU 8 -3.441 -16.255 5.709
63 2HD1 LEU 8 2HD1 LEU 8 -1.830 -15.518 5.822
64 3HD1 LEU 8 3HD1 LEU 8 -3.065 -14.767 4.812
65 1HD2 LEU 8 1HD2 LEU 8 -1.098 -18.408 3.631
66 2HD2 LEU 8 2HD2 LEU 8 -0.624 -17.541 5.100
67 3HD2 LEU 8 3HD2 LEU 8 -2.156 -18.440 5.057
68 H GLY 9 H GLY 9 -2.744 -16.395 0.306
69 1HA GLY 9 1HA GLY 9 -0.960 -14.229 0.241
70 2HA GLY 9 2HA GLY 9 -1.264 -15.294 -1.076
71 H GLN 10 H GLN 10 -4.218 -14.552 -1.239
72 HA GLN 10 HA GLN 10 -4.140 -12.104 -2.765
73 1HB GLN 10 1HB GLN 10 -6.112 -14.151 -2.194
74 2HB GLN 10 2HB GLN 10 -6.810 -12.623 -1.734
75 1HG GLN 10 1HG GLN 10 -7.316 -13.195 -4.063
76 2HG GLN 10 2HG GLN 10 -6.417 -11.682 -3.934
77 1HE2 GLN 10 2HE2 GLN 10 -5.006 -15.034 -3.789
78 2HE2 GLN 10 1HE2 GLN 10 -4.116 -14.835 -5.290
79 H ALA 11 H ALA 11 -5.190 -12.812 0.601
80 HA ALA 11 HA ALA 11 -5.655 -10.086 1.332
81 1HB ALA 11 1HB ALA 11 -6.528 -12.002 2.624
82 2HB ALA 11 2HB ALA 11 -4.883 -12.432 3.127
83 3HB ALA 11 3HB ALA 11 -5.595 -10.893 3.641
84 H ILE 12 H ILE 12 -2.624 -11.960 1.175
85 HA ILE 12 HA ILE 12 -0.956 -9.988 2.461
86 HB ILE 12 HB ILE 12 -0.420 -12.205 0.469
87 1HG1 ILE 12 1HG1 ILE 12 -0.931 -12.742 2.911
88 2HG1 ILE 12 2HG1 ILE 12 0.573 -13.394 2.259
89 1HG2 ILE 12 1HG2 ILE 12 1.632 -10.285 1.520
90 2HG2 ILE 12 2HG2 ILE 12 2.019 -11.879 0.833
91 3HG2 ILE 12 3HG2 ILE 12 1.242 -10.657 -0.170
92 1HD1 ILE 12 1HD1 ILE 12 0.400 -10.820 3.893
93 2HD1 ILE 12 2HD1 ILE 12 0.835 -12.420 4.524
94 3HD1 ILE 12 3HD1 ILE 12 1.874 -11.628 3.325
95 H ALA 13 H ALA 13 -1.787 -10.575 -0.988
96 HA ALA 13 HA ALA 13 -0.396 -8.424 -2.130
97 1HB ALA 13 1HB ALA 13 -1.465 -10.263 -3.385
98 2HB ALA 13 2HB ALA 13 -3.067 -9.616 -2.995
99 3HB ALA 13 3HB ALA 13 -1.955 -8.671 -3.997
100 H PHE 14 H PHE 14 -3.695 -8.510 -0.708
101 HA PHE 14 HA PHE 14 -4.319 -5.748 -1.126
102 1HB PHE 14 1HB PHE 14 -6.006 -7.450 -0.672
103 2HB PHE 14 2HB PHE 14 -5.354 -7.725 0.932
104 HD1 PHE 14 HD1 PHE 14 -6.839 -5.031 -1.246
105 HD2 PHE 14 HD2 PHE 14 -6.184 -6.447 2.785
106 HE1 PHE 14 HE1 PHE 14 -8.297 -3.218 -0.367
107 HE2 PHE 14 HE2 PHE 14 -7.646 -4.639 3.656
108 HZ PHE 14 HZ PHE 14 -8.712 -3.026 2.082
109 H VAL 15 H VAL 15 -3.123 -7.373 1.895
110 HA VAL 15 HA VAL 15 -3.077 -4.970 3.420
111 HB VAL 15 HB VAL 15 -1.826 -7.709 3.864
112 1HG1 VAL 15 1HG1 VAL 15 -1.903 -5.339 5.786
113 2HG1 VAL 15 2HG1 VAL 15 -1.516 -7.010 6.244
114 3HG1 VAL 15 3HG1 VAL 15 -0.451 -6.136 5.144
115 1HG2 VAL 15 1HG2 VAL 15 -4.349 -7.533 3.942
116 2HG2 VAL 15 2HG2 VAL 15 -3.644 -7.955 5.505
117 3HG2 VAL 15 3HG2 VAL 15 -4.195 -6.297 5.195
118 H LEU 16 H LEU 16 -0.360 -6.779 1.853
119 HA LEU 16 HA LEU 16 1.698 -4.987 2.506
120 1HB LEU 16 1HB LEU 16 1.333 -6.629 -0.003
121 2HB LEU 16 2HB LEU 16 2.785 -5.696 0.349
122 HG LEU 16 HG LEU 16 1.730 -7.938 2.128
123 1HD1 LEU 16 1HD1 LEU 16 2.632 -8.679 -0.106
124 2HD1 LEU 16 2HD1 LEU 16 4.128 -7.789 0.214
125 3HD1 LEU 16 3HD1 LEU 16 3.699 -9.180 1.223
126 1HD2 LEU 16 1HD2 LEU 16 4.267 -6.251 2.304
127 2HD2 LEU 16 2HD2 LEU 16 2.985 -6.398 3.527
128 3HD2 LEU 16 3HD2 LEU 16 4.017 -7.777 3.173
129 H PHE 17 H PHE 17 -0.593 -4.726 -0.280
130 HA PHE 17 HA PHE 17 0.412 -2.337 -1.411
131 1HB PHE 17 1HB PHE 17 -1.432 -3.928 -2.243
132 2HB PHE 17 2HB PHE 17 -2.559 -3.073 -1.273
133 HD1 PHE 17 HD1 PHE 17 -0.382 -2.830 -4.249
134 HD2 PHE 17 HD2 PHE 17 -3.192 -0.716 -1.734
135 HE1 PHE 17 HE1 PHE 17 -0.580 -1.042 -5.967
136 HE2 PHE 17 HE2 PHE 17 -3.379 1.071 -3.452
137 HZ PHE 17 HZ PHE 17 -2.076 0.910 -5.570
138 H VAL 18 H VAL 18 -2.319 -2.753 0.769
139 HA VAL 18 HA VAL 18 -2.932 -0.074 1.345
140 HB VAL 18 HB VAL 18 -3.283 -2.566 3.053
141 1HG1 VAL 18 1HG1 VAL 18 -4.428 0.215 3.559
142 2HG1 VAL 18 2HG1 VAL 18 -4.986 -1.275 4.346
143 3HG1 VAL 18 3HG1 VAL 18 -3.344 -0.697 4.632
144 1HG2 VAL 18 1HG2 VAL 18 -4.559 -2.412 0.861
145 2HG2 VAL 18 2HG2 VAL 18 -5.606 -2.430 2.284
146 3HG2 VAL 18 3HG2 VAL 18 -5.283 -0.907 1.436
147 H LEU 19 H LEU 19 -0.593 -2.111 3.213
148 HA LEU 19 HA LEU 19 0.077 0.094 4.960
149 1HB LEU 19 1HB LEU 19 1.604 -2.432 4.490
150 2HB LEU 19 2HB LEU 19 1.788 -1.274 5.824
151 HG LEU 19 HG LEU 19 -0.650 -2.863 5.411
152 1HD1 LEU 19 1HD1 LEU 19 1.238 -4.308 6.053
153 2HD1 LEU 19 2HD1 LEU 19 1.576 -3.255 7.444
154 3HD1 LEU 19 3HD1 LEU 19 0.067 -4.190 7.377
155 1HD2 LEU 19 1HD2 LEU 19 0.169 -1.034 7.698
156 2HD2 LEU 19 2HD2 LEU 19 -1.188 -0.790 6.577
157 3HD2 LEU 19 3HD2 LEU 19 -1.235 -2.118 7.736
158 H PHE 20 H PHE 20 1.554 -1.200 1.951
159 HA PHE 20 HA PHE 20 3.857 0.489 1.944
160 1HB PHE 20 1HB PHE 20 3.557 -1.378 0.379
161 2HB PHE 20 2HB PHE 20 2.168 -0.605 -0.356
162 HD1 PHE 20 HD1 PHE 20 2.436 1.398 -1.827
163 HD2 PHE 20 HD2 PHE 20 5.847 -0.679 -0.168
164 HE1 PHE 20 HE1 PHE 20 3.909 2.447 -3.532
165 HE2 PHE 20 HE2 PHE 20 7.308 0.346 -1.901
166 HZ PHE 20 HZ PHE 20 6.339 1.896 -3.593
167 H CYS 21 H CYS 21 0.436 1.094 0.890
168 HA CYS 21 HA CYS 21 0.857 3.873 0.335
169 1HB CYS 21 1HB CYS 21 -1.160 2.606 -0.384
170 2HB CYS 21 2HB CYS 21 -1.727 2.581 1.294
171 HG CYS 21 HG CYS 21 -1.511 5.237 1.569
172 H MET 22 H MET 22 0.216 2.073 3.472
173 HA MET 22 HA MET 22 -0.239 4.443 4.951
174 1HB MET 22 1HB MET 22 -0.932 2.081 5.520
175 2HB MET 22 2HB MET 22 0.733 1.819 6.094
176 1HG MET 22 1HG MET 22 0.463 3.585 7.761
177 2HG MET 22 2HG MET 22 -1.136 3.976 7.126
178 1HE MET 22 1HE MET 22 -3.288 2.765 7.653
179 2HE MET 22 2HE MET 22 -2.720 1.311 6.795
180 3HE MET 22 3HE MET 22 -3.392 1.171 8.432
181 H LYS 23 H LYS 23 2.743 3.076 3.804
182 HA LYS 23 HA LYS 23 4.276 4.904 5.586
183 1HB LYS 23 1HB LYS 23 4.320 2.169 5.806
184 2HB LYS 23 2HB LYS 23 5.433 2.297 4.464
185 1HG LYS 23 1HG LYS 23 6.886 3.832 5.788
186 2HG LYS 23 2HG LYS 23 5.744 3.721 7.143
187 1HD LYS 23 1HD LYS 23 6.153 1.254 7.276
188 2HD LYS 23 2HD LYS 23 7.240 1.363 5.890
189 1HE LYS 23 1HE LYS 23 8.573 1.251 7.914
190 2HE LYS 23 2HE LYS 23 8.774 2.845 7.175
191 1HZ LYS 23 1HZ LYS 23 6.993 2.220 9.440
192 2HZ LYS 23 2HZ LYS 23 8.454 2.969 9.553
193 3HZ LYS 23 3HZ LYS 23 7.208 3.710 8.776
194 H TYR 24 H TYR 24 4.458 3.356 2.379
195 HA TYR 24 HA TYR 24 6.808 4.856 1.633
196 1HB TYR 24 1HB TYR 24 5.839 2.528 0.788
197 2HB TYR 24 2HB TYR 24 4.955 3.521 -0.352
198 HD1 TYR 24 HD1 TYR 24 6.218 4.824 -2.100
199 HD2 TYR 24 HD2 TYR 24 8.253 2.296 0.755
200 HE1 TYR 24 HE1 TYR 24 8.280 4.939 -3.463
201 HE2 TYR 24 HE2 TYR 24 10.312 2.402 -0.611
202 HH TYR 24 HH TYR 24 10.468 4.263 -3.680
203 H VAL 25 H VAL 25 3.412 5.534 1.639
204 HA VAL 25 HA VAL 25 3.696 7.810 -0.297
205 HB VAL 25 HB VAL 25 1.203 6.240 0.420
206 1HG1 VAL 25 1HG1 VAL 25 1.656 8.470 -1.605
207 2HG1 VAL 25 2HG1 VAL 25 0.185 7.487 -1.465
208 3HG1 VAL 25 3HG1 VAL 25 0.648 8.561 -0.145
209 1HG2 VAL 25 1HG2 VAL 25 2.902 6.233 -2.117
210 2HG2 VAL 25 2HG2 VAL 25 2.747 4.886 -0.972
211 3HG2 VAL 25 3HG2 VAL 25 1.345 5.406 -1.912
212 H TRP 26 H TRP 26 2.214 6.878 2.874
213 HA TRP 26 HA TRP 26 0.909 9.234 3.453
214 1HB TRP 26 1HB TRP 26 2.130 7.046 5.108
215 2HB TRP 26 2HB TRP 26 1.582 8.480 5.944
216 HD1 TRP 26 HD1 TRP 26 -0.551 7.377 3.008
217 HE1 TRP 26 HE1 TRP 26 -2.808 6.482 3.887
218 HE3 TRP 26 HE3 TRP 26 0.517 7.197 8.024
219 HZ2 TRP 26 HZ2 TRP 26 -3.995 5.819 6.395
220 HZ3 TRP 26 HZ3 TRP 26 -1.214 6.442 9.637
221 HH2 TRP 26 HH2 TRP 26 -3.469 5.759 8.837
222 HA PRO 27 HA PRO 27 4.595 11.277 5.762
223 1HB PRO 27 1HB PRO 27 7.190 10.413 4.981
224 2HB PRO 27 2HB PRO 27 6.331 10.114 6.507
225 1HG PRO 27 1HG PRO 27 6.508 8.335 4.094
226 2HG PRO 27 2HG PRO 27 6.507 7.884 5.812
227 1HD PRO 27 1HD PRO 27 4.301 7.599 4.262
228 2HD PRO 27 2HD PRO 27 4.166 8.100 5.968
229 HA PRO 28 HA PRO 28 6.506 13.098 1.827
230 1HB PRO 28 1HB PRO 28 6.211 11.939 -0.673
231 2HB PRO 28 2HB PRO 28 7.573 11.620 0.431
232 1HG PRO 28 1HG PRO 28 5.047 9.992 0.109
233 2HG PRO 28 2HG PRO 28 6.727 9.401 0.115
234 1HD PRO 28 1HD PRO 28 5.254 9.264 2.362
235 2HD PRO 28 2HD PRO 28 6.961 9.782 2.447
236 H LEU 29 H LEU 29 3.397 11.374 1.249
237 HA LEU 29 HA LEU 29 2.008 13.429 -0.107
238 1HB LEU 29 1HB LEU 29 1.235 11.114 0.267
239 2HB LEU 29 2HB LEU 29 0.989 11.421 1.967
240 HG LEU 29 HG LEU 29 -1.040 11.355 0.515
241 1HD1 LEU 29 1HD1 LEU 29 -1.067 12.380 2.771
242 2HD1 LEU 29 2HD1 LEU 29 -0.781 13.971 2.041
243 3HD1 LEU 29 3HD1 LEU 29 -2.253 13.075 1.658
244 1HD2 LEU 29 1HD2 LEU 29 -0.127 12.619 -1.428
245 2HD2 LEU 29 2HD2 LEU 29 -1.683 13.242 -0.853
246 3HD2 LEU 29 3HD2 LEU 29 -0.190 14.112 -0.463
247 H MET 30 H MET 30 2.416 12.809 3.383
248 HA MET 30 HA MET 30 0.970 15.031 4.398
249 1HB MET 30 1HB MET 30 1.683 13.013 5.684
250 2HB MET 30 2HB MET 30 3.350 13.596 5.659
251 1HG MET 30 1HG MET 30 2.680 15.622 6.907
252 2HG MET 30 2HG MET 30 0.992 15.094 6.879
253 1HE MET 30 1HE MET 30 0.931 15.602 9.457
254 2HE MET 30 2HE MET 30 2.001 14.825 10.649
255 3HE MET 30 3HE MET 30 2.666 16.005 9.496
256 H ALA 31 H ALA 31 4.481 14.689 3.696
257 HA ALA 31 HA ALA 31 5.279 17.313 4.409
258 1HB ALA 31 1HB ALA 31 6.843 15.430 4.061
259 2HB ALA 31 2HB ALA 31 6.494 15.455 2.319
260 3HB ALA 31 3HB ALA 31 7.293 16.840 3.086
261 H ALA 32 H ALA 32 4.131 16.032 1.257
262 HA ALA 32 HA ALA 32 4.471 18.373 -0.274
263 1HB ALA 32 1HB ALA 32 4.147 16.155 -1.253
264 2HB ALA 32 2HB ALA 32 2.480 16.099 -0.650
265 3HB ALA 32 3HB ALA 32 2.944 17.298 -1.872
266 H ILE 33 H ILE 33 1.499 17.186 1.428
267 HA ILE 33 HA ILE 33 -0.041 19.541 0.679
268 HB ILE 33 HB ILE 33 -0.661 17.257 2.583
269 1HG1 ILE 33 1HG1 ILE 33 -1.461 17.860 -0.310
270 2HG1 ILE 33 2HG1 ILE 33 -0.412 16.554 0.243
271 1HG2 ILE 33 1HG2 ILE 33 -1.968 19.296 3.193
272 2HG2 ILE 33 2HG2 ILE 33 -2.514 19.438 1.510
273 3HG2 ILE 33 3HG2 ILE 33 -2.997 18.055 2.514
274 1HD1 ILE 33 1HD1 ILE 33 -2.399 15.641 1.557
275 2HD1 ILE 33 2HD1 ILE 33 -3.408 16.814 0.683
276 3HD1 ILE 33 3HD1 ILE 33 -2.531 15.572 -0.213
277 H GMA 34 H GLU 34 1.273 18.374 3.832
278 HA GMA 34 HA GLU 34 0.607 20.970 5.122
279 1HB GMA 34 1HB GLU 34 -0.241 18.883 6.121
280 2HB GMA 34 2HB GLU 34 1.410 18.275 6.298
281 1HG GMA 34 1HG GLU 34 1.939 20.225 7.795
282 2HG GMA 34 2HG GLU 34 0.270 20.779 7.628
283 2HN GMA 34 2HN GLU 34 4.608 19.835 5.139
284 1HN GMA 34 1NH GLU 34 3.360 18.608 4.956
Start of MODEL 8
1 1H MET 1 1H MET 1 -9.375 -20.073 -4.932
2 2H MET 1 2H MET 1 -10.196 -21.302 -5.753
3 HA MET 1 HA MET 1 -11.225 -19.752 -3.464
4 1HB MET 1 1HB MET 1 -12.929 -20.389 -5.106
5 2HB MET 1 2HB MET 1 -12.464 -22.088 -4.995
6 1HG MET 1 1HG MET 1 -13.070 -22.023 -2.534
7 2HG MET 1 2HG MET 1 -13.639 -20.369 -2.764
8 1HE MET 1 1HE MET 1 -15.684 -19.744 -4.289
9 2HE MET 1 2HE MET 1 -15.194 -20.721 -5.699
10 3HE MET 1 3HE MET 1 -16.810 -20.927 -4.993
11 H ASN 2 H ASN 2 -10.916 -23.243 -4.228
12 HA ASN 2 HA ASN 2 -10.327 -23.871 -1.444
13 1HB ASN 2 1HB ASN 2 -10.570 -25.687 -3.876
14 2HB ASN 2 2HB ASN 2 -10.549 -26.189 -2.184
15 1HD2 ASN 2 2HD2 ASN 2 -12.566 -24.942 -4.766
16 2HD2 ASN 2 1HD2 ASN 2 -14.025 -24.809 -3.800
17 H LEU 3 H LEU 3 -8.293 -22.403 -1.860
18 HA LEU 3 HA LEU 3 -5.958 -24.157 -1.716
19 1HB LEU 3 1HB LEU 3 -6.410 -23.532 -4.229
20 2HB LEU 3 2HB LEU 3 -5.751 -21.966 -3.797
21 HG LEU 3 HG LEU 3 -4.425 -24.710 -3.527
22 1HD1 LEU 3 1HD1 LEU 3 -4.602 -23.874 -5.842
23 2HD1 LEU 3 2HD1 LEU 3 -3.797 -22.364 -5.373
24 3HD1 LEU 3 3HD1 LEU 3 -2.917 -23.903 -5.300
25 1HD2 LEU 3 1HD2 LEU 3 -3.282 -21.978 -2.811
26 2HD2 LEU 3 2HD2 LEU 3 -3.551 -23.343 -1.705
27 3HD2 LEU 3 3HD2 LEU 3 -2.327 -23.463 -2.968
28 H ASN 4 H ASN 4 -5.991 -23.453 0.405
29 HA ASN 4 HA ASN 4 -6.418 -21.067 1.534
30 1HB ASN 4 1HB ASN 4 -5.703 -23.360 2.553
31 2HB ASN 4 2HB ASN 4 -4.068 -22.740 2.522
32 1HD2 ASN 4 2HD2 ASN 4 -4.710 -19.907 3.238
33 2HD2 ASN 4 1HD2 ASN 4 -5.245 -20.004 4.906
34 H ALA 5 H ALA 5 -3.201 -22.043 0.346
35 HA ALA 5 HA ALA 5 -1.692 -19.769 1.014
36 1HB ALA 5 1HB ALA 5 -0.724 -21.899 0.249
37 2HB ALA 5 2HB ALA 5 -1.328 -21.598 -1.393
38 3HB ALA 5 3HB ALA 5 -0.104 -20.529 -0.686
39 H THR 6 H THR 6 -3.913 -20.195 -1.738
40 HA THR 6 HA THR 6 -3.082 -17.726 -3.089
41 HB THR 6 HB THR 6 -5.541 -19.481 -3.493
42 HG1 THR 6 HG1 THR 6 -3.408 -20.347 -3.988
43 1HG2 THR 6 1HG2 THR 6 -4.439 -17.198 -5.187
44 2HG2 THR 6 2HG2 THR 6 -5.687 -18.348 -5.704
45 3HG2 THR 6 3HG2 THR 6 -6.019 -17.238 -4.372
46 H ILE 7 H ILE 7 -5.351 -18.526 -0.482
47 HA ILE 7 HA ILE 7 -6.933 -16.045 -0.835
48 HB ILE 7 HB ILE 7 -7.056 -18.181 1.335
49 1HG1 ILE 7 1HG1 ILE 7 -7.608 -19.272 -0.738
50 2HG1 ILE 7 2HG1 ILE 7 -9.074 -19.021 0.194
51 1HG2 ILE 7 1HG2 ILE 7 -8.966 -15.912 0.633
52 2HG2 ILE 7 2HG2 ILE 7 -9.313 -17.223 1.778
53 3HG2 ILE 7 3HG2 ILE 7 -8.006 -16.084 2.110
54 1HD1 ILE 7 1HD1 ILE 7 -9.646 -17.056 -1.262
55 2HD1 ILE 7 2HD1 ILE 7 -8.182 -17.373 -2.222
56 3HD1 ILE 7 3HD1 ILE 7 -9.481 -18.566 -2.168
57 H LEU 8 H LEU 8 -4.735 -17.553 1.477
58 HA LEU 8 HA LEU 8 -3.994 -15.472 3.172
59 1HB LEU 8 1HB LEU 8 -3.382 -17.867 3.276
60 2HB LEU 8 2HB LEU 8 -2.376 -17.704 1.854
61 HG LEU 8 HG LEU 8 -1.187 -17.838 4.054
62 1HD1 LEU 8 1HD1 LEU 8 -0.093 -16.858 2.026
63 2HD1 LEU 8 2HD1 LEU 8 -0.506 -15.239 2.632
64 3HD1 LEU 8 3HD1 LEU 8 0.557 -16.285 3.571
65 1HD2 LEU 8 1HD2 LEU 8 -2.760 -16.436 5.385
66 2HD2 LEU 8 2HD2 LEU 8 -1.066 -15.939 5.558
67 3HD2 LEU 8 3HD2 LEU 8 -2.161 -14.990 4.540
68 H GLY 9 H GLY 9 -2.440 -16.346 -0.019
69 1HA GLY 9 1HA GLY 9 -0.757 -14.092 -0.066
70 2HA GLY 9 2HA GLY 9 -1.105 -15.087 -1.423
71 H GLN 10 H GLN 10 -4.118 -14.496 -1.315
72 HA GLN 10 HA GLN 10 -4.269 -11.961 -2.661
73 1HB GLN 10 1HB GLN 10 -5.926 -13.729 -3.008
74 2HB GLN 10 2HB GLN 10 -6.456 -13.610 -1.330
75 1HG GLN 10 1HG GLN 10 -8.001 -12.438 -2.838
76 2HG GLN 10 2HG GLN 10 -7.270 -11.326 -1.687
77 1HE2 GLN 10 2HE2 GLN 10 -6.634 -12.640 -5.020
78 2HE2 GLN 10 1HE2 GLN 10 -6.144 -11.084 -5.674
79 H ALA 11 H ALA 11 -4.930 -12.935 0.762
80 HA ALA 11 HA ALA 11 -5.490 -10.287 1.694
81 1HB ALA 11 1HB ALA 11 -6.123 -12.321 2.945
82 2HB ALA 11 2HB ALA 11 -4.414 -12.677 3.259
83 3HB ALA 11 3HB ALA 11 -5.152 -11.215 3.932
84 H ILE 12 H ILE 12 -2.396 -11.971 1.125
85 HA ILE 12 HA ILE 12 -0.712 -9.966 2.341
86 HB ILE 12 HB ILE 12 -0.266 -12.054 0.194
87 1HG1 ILE 12 1HG1 ILE 12 -0.473 -12.709 2.650
88 2HG1 ILE 12 2HG1 ILE 12 0.984 -13.247 1.806
89 1HG2 ILE 12 1HG2 ILE 12 1.773 -10.047 1.099
90 2HG2 ILE 12 2HG2 ILE 12 2.172 -11.584 0.299
91 3HG2 ILE 12 3HG2 ILE 12 1.214 -10.376 -0.554
92 1HD1 ILE 12 1HD1 ILE 12 0.859 -10.750 3.558
93 2HD1 ILE 12 2HD1 ILE 12 1.445 -12.344 4.069
94 3HD1 ILE 12 3HD1 ILE 12 2.300 -11.452 2.795
95 H ALA 13 H ALA 13 -1.883 -10.422 -1.029
96 HA ALA 13 HA ALA 13 -0.737 -8.138 -2.185
97 1HB ALA 13 1HB ALA 13 -1.847 -9.967 -3.423
98 2HB ALA 13 2HB ALA 13 -3.426 -9.429 -2.828
99 3HB ALA 13 3HB ALA 13 -2.477 -8.375 -3.886
100 H PHE 14 H PHE 14 -3.873 -8.495 -0.465
101 HA PHE 14 HA PHE 14 -4.688 -5.764 -0.645
102 1HB PHE 14 1HB PHE 14 -6.215 -7.594 -0.126
103 2HB PHE 14 2HB PHE 14 -5.386 -7.910 1.387
104 HD1 PHE 14 HD1 PHE 14 -7.262 -5.222 -0.470
105 HD2 PHE 14 HD2 PHE 14 -6.070 -6.768 3.387
106 HE1 PHE 14 HE1 PHE 14 -8.705 -3.539 0.657
107 HE2 PHE 14 HE2 PHE 14 -7.521 -5.091 4.505
108 HZ PHE 14 HZ PHE 14 -8.844 -3.477 3.144
109 H VAL 15 H VAL 15 -3.093 -7.459 2.148
110 HA VAL 15 HA VAL 15 -3.020 -5.134 3.789
111 HB VAL 15 HB VAL 15 -1.561 -7.801 3.947
112 1HG1 VAL 15 1HG1 VAL 15 -1.578 -5.535 5.994
113 2HG1 VAL 15 2HG1 VAL 15 -1.035 -7.194 6.313
114 3HG1 VAL 15 3HG1 VAL 15 -0.155 -6.195 5.158
115 1HG2 VAL 15 1HG2 VAL 15 -4.067 -7.801 4.301
116 2HG2 VAL 15 2HG2 VAL 15 -3.169 -8.247 5.757
117 3HG2 VAL 15 3HG2 VAL 15 -3.854 -6.618 5.598
118 H LEU 16 H LEU 16 -0.390 -6.687 1.842
119 HA LEU 16 HA LEU 16 1.616 -4.797 2.352
120 1HB LEU 16 1HB LEU 16 1.056 -6.336 -0.187
121 2HB LEU 16 2HB LEU 16 2.479 -5.326 0.047
122 HG LEU 16 HG LEU 16 1.789 -7.716 1.812
123 1HD1 LEU 16 1HD1 LEU 16 2.447 -8.294 -0.549
124 2HD1 LEU 16 2HD1 LEU 16 3.915 -7.318 -0.369
125 3HD1 LEU 16 3HD1 LEU 16 3.701 -8.779 0.610
126 1HD2 LEU 16 1HD2 LEU 16 4.222 -5.875 1.768
127 2HD2 LEU 16 2HD2 LEU 16 3.112 -6.157 3.130
128 3HD2 LEU 16 3HD2 LEU 16 4.171 -7.449 2.582
129 H PHE 17 H PHE 17 -0.963 -4.563 -0.182
130 HA PHE 17 HA PHE 17 -0.255 -2.062 -1.272
131 1HB PHE 17 1HB PHE 17 -2.088 -3.734 -1.966
132 2HB PHE 17 2HB PHE 17 -3.141 -2.992 -0.836
133 HD1 PHE 17 HD1 PHE 17 -1.337 -2.493 -4.023
134 HD2 PHE 17 HD2 PHE 17 -3.962 -0.663 -1.116
135 HE1 PHE 17 HE1 PHE 17 -1.836 -0.654 -5.623
136 HE2 PHE 17 HE2 PHE 17 -4.449 1.174 -2.716
137 HZ PHE 17 HZ PHE 17 -3.389 1.182 -4.971
138 H VAL 18 H VAL 18 -2.670 -2.759 1.189
139 HA VAL 18 HA VAL 18 -3.380 -0.157 1.974
140 HB VAL 18 HB VAL 18 -3.354 -2.734 3.581
141 1HG1 VAL 18 1HG1 VAL 18 -4.559 -0.049 4.385
142 2HG1 VAL 18 2HG1 VAL 18 -4.924 -1.604 5.160
143 3HG1 VAL 18 3HG1 VAL 18 -3.292 -0.944 5.252
144 1HG2 VAL 18 1HG2 VAL 18 -4.919 -2.556 1.593
145 2HG2 VAL 18 2HG2 VAL 18 -5.761 -2.703 3.140
146 3HG2 VAL 18 3HG2 VAL 18 -5.639 -1.126 2.339
147 H LEU 19 H LEU 19 -0.787 -2.127 3.605
148 HA LEU 19 HA LEU 19 -0.040 0.074 5.286
149 1HB LEU 19 1HB LEU 19 1.660 -2.267 4.522
150 2HB LEU 19 2HB LEU 19 1.847 -1.170 5.904
151 HG LEU 19 HG LEU 19 -0.401 -3.038 5.604
152 1HD1 LEU 19 1HD1 LEU 19 1.705 -4.234 6.036
153 2HD1 LEU 19 2HD1 LEU 19 2.009 -3.197 7.446
154 3HD1 LEU 19 3HD1 LEU 19 0.638 -4.325 7.447
155 1HD2 LEU 19 1HD2 LEU 19 0.339 -1.189 7.901
156 2HD2 LEU 19 2HD2 LEU 19 -1.124 -1.113 6.894
157 3HD2 LEU 19 3HD2 LEU 19 -0.893 -2.465 8.002
158 H PHE 20 H PHE 20 1.226 -1.033 2.103
159 HA PHE 20 HA PHE 20 3.394 0.784 1.852
160 1HB PHE 20 1HB PHE 20 2.973 -1.025 0.273
161 2HB PHE 20 2HB PHE 20 1.455 -0.316 -0.230
162 HD1 PHE 20 HD1 PHE 20 1.424 1.872 -1.521
163 HD2 PHE 20 HD2 PHE 20 5.050 -0.360 -0.765
164 HE1 PHE 20 HE1 PHE 20 2.539 3.036 -3.411
165 HE2 PHE 20 HE2 PHE 20 6.135 0.758 -2.701
166 HZ PHE 20 HZ PHE 20 4.885 2.460 -4.022
167 H CYS 21 H CYS 21 -0.155 1.253 1.257
168 HA CYS 21 HA CYS 21 0.067 4.044 0.698
169 1HB CYS 21 1HB CYS 21 -1.958 2.671 0.196
170 2HB CYS 21 2HB CYS 21 -2.354 2.674 1.924
171 HG CYS 21 HG CYS 21 -2.159 5.347 2.106
172 H MET 22 H MET 22 -0.088 2.219 3.896
173 HA MET 22 HA MET 22 -0.498 4.669 5.326
174 1HB MET 22 1HB MET 22 0.203 1.919 6.340
175 2HB MET 22 2HB MET 22 -0.125 3.315 7.355
176 1HG MET 22 1HG MET 22 -2.371 3.572 6.496
177 2HG MET 22 2HG MET 22 -2.137 2.283 5.330
178 1HE MET 22 1HE MET 22 -2.490 3.209 9.086
179 2HE MET 22 2HE MET 22 -2.587 1.617 9.870
180 3HE MET 22 3HE MET 22 -1.040 2.178 9.204
181 H LYS 23 H LYS 23 2.361 3.304 3.985
182 HA LYS 23 HA LYS 23 4.015 5.114 5.650
183 1HB LYS 23 1HB LYS 23 3.928 2.199 5.778
184 2HB LYS 23 2HB LYS 23 5.456 2.600 5.045
185 1HG LYS 23 1HG LYS 23 4.429 3.769 7.676
186 2HG LYS 23 2HG LYS 23 5.511 2.377 7.530
187 1HD LYS 23 1HD LYS 23 7.221 3.806 6.394
188 2HD LYS 23 2HD LYS 23 6.144 5.195 6.515
189 1HE LYS 23 1HE LYS 23 7.778 5.365 8.274
190 2HE LYS 23 2HE LYS 23 6.191 5.066 8.994
191 1HZ LYS 23 1HZ LYS 23 8.276 3.031 8.540
192 2HZ LYS 23 2HZ LYS 23 7.920 3.727 9.988
193 3HZ LYS 23 3HZ LYS 23 6.814 2.762 9.245
194 H TYR 24 H TYR 24 3.980 3.311 2.575
195 HA TYR 24 HA TYR 24 6.410 4.606 1.660
196 1HB TYR 24 1HB TYR 24 5.271 2.331 0.921
197 2HB TYR 24 2HB TYR 24 4.373 3.351 -0.187
198 HD1 TYR 24 HD1 TYR 24 5.638 4.692 -1.945
199 HD2 TYR 24 HD2 TYR 24 7.611 1.852 0.648
200 HE1 TYR 24 HE1 TYR 24 7.625 4.723 -3.418
201 HE2 TYR 24 HE2 TYR 24 9.594 1.872 -0.832
202 HH TYR 24 HH TYR 24 9.733 3.887 -3.802
203 H VAL 25 H VAL 25 3.003 5.385 1.699
204 HA VAL 25 HA VAL 25 3.318 7.616 -0.270
205 HB VAL 25 HB VAL 25 0.803 6.250 0.726
206 1HG1 VAL 25 1HG1 VAL 25 1.205 8.376 -1.420
207 2HG1 VAL 25 2HG1 VAL 25 -0.305 7.496 -1.111
208 3HG1 VAL 25 3HG1 VAL 25 0.343 8.582 0.120
209 1HG2 VAL 25 1HG2 VAL 25 2.262 6.050 -1.951
210 2HG2 VAL 25 2HG2 VAL 25 2.133 4.756 -0.745
211 3HG2 VAL 25 3HG2 VAL 25 0.686 5.328 -1.577
212 H TRP 26 H TRP 26 1.823 6.952 2.968
213 HA TRP 26 HA TRP 26 0.814 9.432 3.506
214 1HB TRP 26 1HB TRP 26 1.885 7.237 5.272
215 2HB TRP 26 2HB TRP 26 1.385 8.749 6.003
216 HD1 TRP 26 HD1 TRP 26 -0.882 7.912 3.164
217 HE1 TRP 26 HE1 TRP 26 -3.123 7.005 4.058
218 HE3 TRP 26 HE3 TRP 26 0.435 7.099 8.058
219 HZ2 TRP 26 HZ2 TRP 26 -4.201 6.067 6.525
220 HZ3 TRP 26 HZ3 TRP 26 -1.229 6.176 9.654
221 HH2 TRP 26 HH2 TRP 26 -3.548 5.671 8.904
222 HA PRO 27 HA PRO 27 4.656 11.237 5.699
223 1HB PRO 27 1HB PRO 27 7.182 10.157 4.980
224 2HB PRO 27 2HB PRO 27 6.289 9.973 6.507
225 1HG PRO 27 1HG PRO 27 6.365 8.106 4.160
226 2HG PRO 27 2HG PRO 27 6.307 7.715 5.892
227 1HD PRO 27 1HD PRO 27 4.104 7.538 4.309
228 2HD PRO 27 2HD PRO 27 3.988 8.093 6.001
229 HA PRO 28 HA PRO 28 6.723 12.766 1.717
230 1HB PRO 28 1HB PRO 28 6.372 11.529 -0.739
231 2HB PRO 28 2HB PRO 28 7.696 11.156 0.395
232 1HG PRO 28 1HG PRO 28 5.058 9.700 0.106
233 2HG PRO 28 2HG PRO 28 6.694 8.996 0.152
234 1HD PRO 28 1HD PRO 28 5.194 9.051 2.385
235 2HD PRO 28 2HD PRO 28 6.936 9.446 2.469
236 H LEU 29 H LEU 29 3.511 11.223 1.174
237 HA LEU 29 HA LEU 29 2.264 13.293 -0.282
238 1HB LEU 29 1HB LEU 29 1.271 11.089 0.218
239 2HB LEU 29 2HB LEU 29 1.085 11.538 1.901
240 HG LEU 29 HG LEU 29 -0.472 13.358 1.293
241 1HD1 LEU 29 1HD1 LEU 29 -0.106 12.349 -1.571
242 2HD1 LEU 29 2HD1 LEU 29 -1.404 13.436 -1.038
243 3HD1 LEU 29 3HD1 LEU 29 0.270 13.978 -0.965
244 1HD2 LEU 29 1HD2 LEU 29 -1.296 11.083 1.802
245 2HD2 LEU 29 2HD2 LEU 29 -2.339 11.909 0.629
246 3HD2 LEU 29 3HD2 LEU 29 -1.199 10.660 0.077
247 H MET 30 H MET 30 2.621 12.836 3.244
248 HA MET 30 HA MET 30 1.363 15.243 4.105
249 1HB MET 30 1HB MET 30 1.907 13.257 5.541
250 2HB MET 30 2HB MET 30 3.611 13.726 5.506
251 1HG MET 30 1HG MET 30 3.036 15.907 6.548
252 2HG MET 30 2HG MET 30 1.326 15.460 6.545
253 1HE MET 30 1HE MET 30 1.159 16.158 9.057
254 2HE MET 30 2HE MET 30 2.239 15.538 10.329
255 3HE MET 30 3HE MET 30 2.886 16.595 9.052
256 H ALA 31 H ALA 31 4.830 14.567 3.412
257 HA ALA 31 HA ALA 31 5.884 17.114 4.051
258 1HB ALA 31 1HB ALA 31 7.258 15.099 3.646
259 2HB ALA 31 2HB ALA 31 6.852 15.162 1.919
260 3HB ALA 31 3HB ALA 31 7.789 16.470 2.659
261 H ALA 32 H ALA 32 4.611 15.886 0.927
262 HA ALA 32 HA ALA 32 4.982 18.231 -0.600
263 1HB ALA 32 1HB ALA 32 4.608 16.025 -1.585
264 2HB ALA 32 2HB ALA 32 2.948 15.994 -0.961
265 3HB ALA 32 3HB ALA 32 3.415 17.189 -2.185
266 H ILE 33 H ILE 33 1.993 17.060 1.041
267 HA ILE 33 HA ILE 33 0.379 19.308 0.301
268 HB ILE 33 HB ILE 33 0.029 17.112 2.364
269 1HG1 ILE 33 1HG1 ILE 33 0.100 16.368 -0.029
270 2HG1 ILE 33 2HG1 ILE 33 -1.414 16.030 0.798
271 1HG2 ILE 33 1HG2 ILE 33 -1.988 19.218 1.502
272 2HG2 ILE 33 2HG2 ILE 33 -2.416 17.701 2.323
273 3HG2 ILE 33 3HG2 ILE 33 -1.391 18.884 3.137
274 1HD1 ILE 33 1HD1 ILE 33 -0.953 18.308 -1.188
275 2HD1 ILE 33 2HD1 ILE 33 -1.787 16.781 -1.502
276 3HD1 ILE 33 3HD1 ILE 33 -2.490 17.941 -0.369
277 H GMA 34 H GLU 34 2.274 18.652 3.271
278 HA GMA 34 HA GLU 34 1.185 20.961 4.711
279 1HB GMA 34 1HB GLU 34 1.829 18.750 5.792
280 2HB GMA 34 2HB GLU 34 3.513 19.113 5.403
281 1HG GMA 34 1HG GLU 34 3.163 19.749 7.678
282 2HG GMA 34 2HG GLU 34 3.294 21.251 6.767
283 2HN GMA 34 2HN GLU 34 4.914 21.548 2.992
284 1HN GMA 34 1NH GLU 34 4.311 19.924 3.163
Start of MODEL 9
1 1H MET 1 1H MET 1 1.860 -23.152 -3.281
2 2H MET 1 2H MET 1 0.549 -22.938 -2.240
3 HA MET 1 HA MET 1 -0.248 -23.509 -4.499
4 1HB MET 1 1HB MET 1 1.478 -25.978 -4.007
5 2HB MET 1 2HB MET 1 0.305 -25.792 -5.318
6 1HG MET 1 1HG MET 1 1.565 -23.825 -6.168
7 2HG MET 1 2HG MET 1 2.786 -24.077 -4.912
8 1HE MET 1 1HE MET 1 4.682 -24.025 -6.716
9 2HE MET 1 2HE MET 1 4.682 -25.050 -8.171
10 3HE MET 1 3HE MET 1 3.457 -23.772 -7.987
11 H ASN 2 H ASN 2 -1.831 -23.107 -2.728
12 HA ASN 2 HA ASN 2 -3.560 -25.392 -2.343
13 1HB ASN 2 1HB ASN 2 -1.929 -25.689 -0.453
14 2HB ASN 2 2HB ASN 2 -2.307 -24.058 0.110
15 1HD2 ASN 2 2HD2 ASN 2 -2.780 -25.293 2.166
16 2HD2 ASN 2 1HD2 ASN 2 -4.383 -25.996 2.325
17 H LEU 3 H LEU 3 -5.660 -24.745 -1.607
18 HA LEU 3 HA LEU 3 -6.694 -22.279 -2.522
19 1HB LEU 3 1HB LEU 3 -7.761 -24.350 -0.556
20 2HB LEU 3 2HB LEU 3 -8.660 -22.901 -1.003
21 HG LEU 3 HG LEU 3 -8.641 -23.546 -3.377
22 1HD1 LEU 3 1HD1 LEU 3 -7.300 -26.109 -2.392
23 2HD1 LEU 3 2HD1 LEU 3 -8.101 -25.940 -3.966
24 3HD1 LEU 3 3HD1 LEU 3 -6.678 -24.969 -3.611
25 1HD2 LEU 3 1HD2 LEU 3 -10.529 -24.132 -1.891
26 2HD2 LEU 3 2HD2 LEU 3 -10.301 -25.356 -3.146
27 3HD2 LEU 3 3HD2 LEU 3 -9.746 -25.675 -1.491
28 H ASN 4 H ASN 4 -5.980 -23.306 0.848
29 HA ASN 4 HA ASN 4 -6.454 -20.969 2.270
30 1HB ASN 4 1HB ASN 4 -5.770 -23.205 3.172
31 2HB ASN 4 2HB ASN 4 -4.119 -22.913 2.673
32 1HD2 ASN 4 2HD2 ASN 4 -2.955 -21.011 3.692
33 2HD2 ASN 4 1HD2 ASN 4 -3.469 -20.531 5.301
34 H ALA 5 H ALA 5 -3.309 -21.938 0.894
35 HA ALA 5 HA ALA 5 -1.822 -19.601 1.363
36 1HB ALA 5 1HB ALA 5 -0.838 -21.776 0.753
37 2HB ALA 5 2HB ALA 5 -1.479 -21.618 -0.895
38 3HB ALA 5 3HB ALA 5 -0.256 -20.480 -0.303
39 H THR 6 H THR 6 -3.955 -20.339 -1.406
40 HA THR 6 HA THR 6 -3.266 -17.993 -2.917
41 HB THR 6 HB THR 6 -5.769 -19.740 -3.028
42 HG1 THR 6 HG1 THR 6 -3.372 -19.751 -4.542
43 1HG2 THR 6 1HG2 THR 6 -4.665 -17.725 -5.043
44 2HG2 THR 6 2HG2 THR 6 -5.965 -18.890 -5.364
45 3HG2 THR 6 3HG2 THR 6 -6.210 -17.609 -4.174
46 H ILE 7 H ILE 7 -5.700 -18.501 -0.333
47 HA ILE 7 HA ILE 7 -7.063 -15.930 -0.961
48 HB ILE 7 HB ILE 7 -7.507 -17.981 1.245
49 1HG1 ILE 7 1HG1 ILE 7 -8.181 -18.894 -0.909
50 2HG1 ILE 7 2HG1 ILE 7 -9.587 -18.537 0.080
51 1HG2 ILE 7 1HG2 ILE 7 -9.048 -15.434 0.597
52 2HG2 ILE 7 2HG2 ILE 7 -9.643 -16.728 1.657
53 3HG2 ILE 7 3HG2 ILE 7 -8.192 -15.827 2.096
54 1HD1 ILE 7 1HD1 ILE 7 -9.938 -16.430 -1.277
55 2HD1 ILE 7 2HD1 ILE 7 -8.569 -16.923 -2.304
56 3HD1 ILE 7 3HD1 ILE 7 -10.022 -17.922 -2.222
57 H LEU 8 H LEU 8 -5.050 -17.407 1.536
58 HA LEU 8 HA LEU 8 -4.321 -15.259 3.144
59 1HB LEU 8 1HB LEU 8 -3.728 -17.647 3.425
60 2HB LEU 8 2HB LEU 8 -2.727 -17.576 1.982
61 HG LEU 8 HG LEU 8 -1.170 -15.986 3.092
62 1HD1 LEU 8 1HD1 LEU 8 -2.982 -16.341 5.527
63 2HD1 LEU 8 2HD1 LEU 8 -1.373 -15.593 5.555
64 3HD1 LEU 8 3HD1 LEU 8 -2.677 -14.826 4.647
65 1HD2 LEU 8 1HD2 LEU 8 -0.753 -18.411 3.248
66 2HD2 LEU 8 2HD2 LEU 8 -0.205 -17.581 4.711
67 3HD2 LEU 8 3HD2 LEU 8 -1.726 -18.499 4.732
68 H GLY 9 H GLY 9 -2.700 -16.305 0.031
69 1HA GLY 9 1HA GLY 9 -0.907 -14.135 -0.011
70 2HA GLY 9 2HA GLY 9 -1.243 -15.164 -1.344
71 H GLN 10 H GLN 10 -4.211 -14.464 -1.461
72 HA GLN 10 HA GLN 10 -4.274 -11.969 -2.868
73 1HB GLN 10 1HB GLN 10 -6.332 -13.814 -1.624
74 2HB GLN 10 2HB GLN 10 -6.800 -12.280 -2.318
75 1HG GLN 10 1HG GLN 10 -5.942 -12.866 -4.499
76 2HG GLN 10 2HG GLN 10 -5.186 -14.334 -3.878
77 1HE2 GLN 10 2HE2 GLN 10 -6.509 -15.178 -5.820
78 2HE2 GLN 10 1HE2 GLN 10 -8.150 -15.688 -5.445
79 H ALA 11 H ALA 11 -5.066 -12.832 0.563
80 HA ALA 11 HA ALA 11 -5.593 -10.140 1.381
81 1HB ALA 11 1HB ALA 11 -6.364 -12.108 2.652
82 2HB ALA 11 2HB ALA 11 -4.690 -12.514 3.071
83 3HB ALA 11 3HB ALA 11 -5.411 -11.008 3.660
84 H ILE 12 H ILE 12 -2.527 -11.935 1.047
85 HA ILE 12 HA ILE 12 -0.848 -9.974 2.327
86 HB ILE 12 HB ILE 12 -0.357 -12.116 0.245
87 1HG1 ILE 12 1HG1 ILE 12 -0.726 -12.709 2.704
88 2HG1 ILE 12 2HG1 ILE 12 0.744 -13.328 1.946
89 1HG2 ILE 12 1HG2 ILE 12 1.706 -10.173 1.230
90 2HG2 ILE 12 2HG2 ILE 12 2.088 -11.741 0.481
91 3HG2 ILE 12 3HG2 ILE 12 1.230 -10.511 -0.446
92 1HD1 ILE 12 1HD1 ILE 12 0.646 -10.786 3.634
93 2HD1 ILE 12 2HD1 ILE 12 1.124 -12.394 4.216
94 3HD1 ILE 12 3HD1 ILE 12 2.089 -11.578 2.971
95 H ALA 13 H ALA 13 -1.832 -10.442 -1.098
96 HA ALA 13 HA ALA 13 -0.532 -8.225 -2.223
97 1HB ALA 13 1HB ALA 13 -1.631 -10.032 -3.495
98 2HB ALA 13 2HB ALA 13 -3.222 -9.437 -2.996
99 3HB ALA 13 3HB ALA 13 -2.185 -8.429 -4.016
100 H PHE 14 H PHE 14 -3.774 -8.433 -0.681
101 HA PHE 14 HA PHE 14 -4.469 -5.674 -0.954
102 1HB PHE 14 1HB PHE 14 -6.096 -7.430 -0.487
103 2HB PHE 14 2HB PHE 14 -5.364 -7.750 1.074
104 HD1 PHE 14 HD1 PHE 14 -7.034 -5.032 -0.928
105 HD2 PHE 14 HD2 PHE 14 -6.097 -6.536 3.015
106 HE1 PHE 14 HE1 PHE 14 -8.476 -3.279 0.088
107 HE2 PHE 14 HE2 PHE 14 -7.543 -4.787 4.023
108 HZ PHE 14 HZ PHE 14 -8.740 -3.160 2.564
109 H VAL 15 H VAL 15 -3.086 -7.377 1.941
110 HA VAL 15 HA VAL 15 -3.011 -5.033 3.556
111 HB VAL 15 HB VAL 15 -1.670 -7.754 3.814
112 1HG1 VAL 15 1HG1 VAL 15 -1.690 -5.465 5.832
113 2HG1 VAL 15 2HG1 VAL 15 -1.238 -7.141 6.198
114 3HG1 VAL 15 3HG1 VAL 15 -0.259 -6.199 5.075
115 1HG2 VAL 15 1HG2 VAL 15 -4.187 -7.649 4.044
116 2HG2 VAL 15 2HG2 VAL 15 -3.381 -8.114 5.546
117 3HG2 VAL 15 3HG2 VAL 15 -3.990 -6.460 5.337
118 H LEU 16 H LEU 16 -0.341 -6.719 1.785
119 HA LEU 16 HA LEU 16 1.705 -4.894 2.370
120 1HB LEU 16 1HB LEU 16 1.232 -6.472 -0.164
121 2HB LEU 16 2HB LEU 16 2.680 -5.515 0.132
122 HG LEU 16 HG LEU 16 1.787 -7.831 1.904
123 1HD1 LEU 16 1HD1 LEU 16 2.563 -8.490 -0.401
124 2HD1 LEU 16 2HD1 LEU 16 4.056 -7.573 -0.149
125 3HD1 LEU 16 3HD1 LEU 16 3.721 -9.001 0.845
126 1HD2 LEU 16 1HD2 LEU 16 4.292 -6.090 1.970
127 2HD2 LEU 16 2HD2 LEU 16 3.092 -6.296 3.266
128 3HD2 LEU 16 3HD2 LEU 16 4.128 -7.642 2.812
129 H PHE 17 H PHE 17 -0.750 -4.606 -0.276
130 HA PHE 17 HA PHE 17 0.131 -2.160 -1.382
131 1HB PHE 17 1HB PHE 17 -1.736 -3.760 -2.147
132 2HB PHE 17 2HB PHE 17 -2.811 -2.957 -1.081
133 HD1 PHE 17 HD1 PHE 17 -0.826 -2.579 -4.175
134 HD2 PHE 17 HD2 PHE 17 -3.517 -0.603 -1.430
135 HE1 PHE 17 HE1 PHE 17 -1.163 -0.743 -5.820
136 HE2 PHE 17 HE2 PHE 17 -3.845 1.232 -3.074
137 HZ PHE 17 HZ PHE 17 -2.671 1.164 -5.271
138 H VAL 18 H VAL 18 -2.442 -2.704 0.956
139 HA VAL 18 HA VAL 18 -3.058 -0.049 1.644
140 HB VAL 18 HB VAL 18 -3.296 -2.601 3.284
141 1HG1 VAL 18 1HG1 VAL 18 -4.448 0.147 3.938
142 2HG1 VAL 18 2HG1 VAL 18 -4.947 -1.376 4.702
143 3HG1 VAL 18 3HG1 VAL 18 -3.301 -0.784 4.925
144 1HG2 VAL 18 1HG2 VAL 18 -4.680 -2.395 1.165
145 2HG2 VAL 18 2HG2 VAL 18 -5.656 -2.469 2.636
146 3HG2 VAL 18 3HG2 VAL 18 -5.393 -0.916 1.821
147 H LEU 19 H LEU 19 -0.568 -2.095 3.282
148 HA LEU 19 HA LEU 19 0.157 0.059 5.084
149 1HB LEU 19 1HB LEU 19 1.691 -2.415 4.420
150 2HB LEU 19 2HB LEU 19 1.926 -1.312 5.794
151 HG LEU 19 HG LEU 19 -0.511 -2.917 5.445
152 1HD1 LEU 19 1HD1 LEU 19 1.421 -4.383 5.874
153 2HD1 LEU 19 2HD1 LEU 19 1.848 -3.410 7.297
154 3HD1 LEU 19 3HD1 LEU 19 0.342 -4.352 7.279
155 1HD2 LEU 19 1HD2 LEU 19 0.448 -1.260 7.803
156 2HD2 LEU 19 2HD2 LEU 19 -0.956 -0.903 6.773
157 3HD2 LEU 19 3HD2 LEU 19 -0.973 -2.320 7.823
158 H PHE 20 H PHE 20 1.489 -1.125 1.961
159 HA PHE 20 HA PHE 20 3.753 0.603 1.831
160 1HB PHE 20 1HB PHE 20 3.362 -1.208 0.234
161 2HB PHE 20 2HB PHE 20 1.903 -0.446 -0.359
162 HD1 PHE 20 HD1 PHE 20 2.009 1.647 -1.740
163 HD2 PHE 20 HD2 PHE 20 5.570 -0.485 -0.532
164 HE1 PHE 20 HE1 PHE 20 3.305 2.795 -3.523
165 HE2 PHE 20 HE2 PHE 20 6.849 0.629 -2.350
166 HZ PHE 20 HZ PHE 20 5.718 2.263 -3.852
167 H CYS 21 H CYS 21 0.263 1.180 1.006
168 HA CYS 21 HA CYS 21 0.571 3.974 0.523
169 1HB CYS 21 1HB CYS 21 -1.454 2.741 -0.104
170 2HB CYS 21 2HB CYS 21 -1.884 2.535 1.598
171 HG CYS 21 HG CYS 21 -1.324 5.366 0.017
172 H MET 22 H MET 22 0.115 2.087 3.653
173 HA MET 22 HA MET 22 -0.329 4.404 5.199
174 1HB MET 22 1HB MET 22 -0.887 1.968 5.736
175 2HB MET 22 2HB MET 22 0.802 1.821 6.276
176 1HG MET 22 1HG MET 22 0.330 3.717 7.906
177 2HG MET 22 2HG MET 22 -1.334 3.712 7.325
178 1HE MET 22 1HE MET 22 1.308 0.966 8.441
179 2HE MET 22 2HE MET 22 1.267 2.203 9.721
180 3HE MET 22 3HE MET 22 0.638 0.570 10.039
181 H LYS 23 H LYS 23 2.668 3.140 3.957
182 HA LYS 23 HA LYS 23 4.182 5.044 5.654
183 1HB LYS 23 1HB LYS 23 4.247 2.137 5.730
184 2HB LYS 23 2HB LYS 23 5.737 2.600 4.961
185 1HG LYS 23 1HG LYS 23 4.758 3.676 7.649
186 2HG LYS 23 2HG LYS 23 5.921 2.361 7.427
187 1HD LYS 23 1HD LYS 23 7.450 3.922 6.204
188 2HD LYS 23 2HD LYS 23 6.322 5.252 6.518
189 1HE LYS 23 1HE LYS 23 6.579 4.905 8.971
190 2HE LYS 23 2HE LYS 23 7.724 3.588 8.664
191 1HZ LYS 23 1HZ LYS 23 8.095 6.396 7.860
192 2HZ LYS 23 2HZ LYS 23 8.847 5.648 9.120
193 3HZ LYS 23 3HZ LYS 23 9.158 5.173 7.574
194 H TYR 24 H TYR 24 4.327 3.307 2.538
195 HA TYR 24 HA TYR 24 6.706 4.739 1.718
196 1HB TYR 24 1HB TYR 24 5.728 2.418 0.921
197 2HB TYR 24 2HB TYR 24 4.798 3.392 -0.202
198 HD1 TYR 24 HD1 TYR 24 5.995 4.774 -1.951
199 HD2 TYR 24 HD2 TYR 24 8.117 2.124 0.724
200 HE1 TYR 24 HE1 TYR 24 7.997 4.911 -3.400
201 HE2 TYR 24 HE2 TYR 24 10.116 2.250 -0.731
202 HH TYR 24 HH TYR 24 10.161 4.213 -3.737
203 H VAL 25 H VAL 25 3.279 5.402 1.683
204 HA VAL 25 HA VAL 25 3.591 7.668 -0.257
205 HB VAL 25 HB VAL 25 1.070 6.189 0.538
206 1HG1 VAL 25 1HG1 VAL 25 1.565 8.334 -1.565
207 2HG1 VAL 25 2HG1 VAL 25 0.065 7.406 -1.373
208 3HG1 VAL 25 3HG1 VAL 25 0.584 8.505 -0.095
209 1HG2 VAL 25 1HG2 VAL 25 2.737 6.047 -2.021
210 2HG2 VAL 25 2HG2 VAL 25 2.553 4.741 -0.835
211 3HG2 VAL 25 3HG2 VAL 25 1.158 5.276 -1.775
212 H TRP 26 H TRP 26 2.019 6.832 2.905
213 HA TRP 26 HA TRP 26 0.809 9.228 3.433
214 1HB TRP 26 1HB TRP 26 1.968 7.080 5.190
215 2HB TRP 26 2HB TRP 26 1.363 8.539 5.944
216 HD1 TRP 26 HD1 TRP 26 -0.658 7.371 2.971
217 HE1 TRP 26 HE1 TRP 26 -2.895 6.381 3.779
218 HE3 TRP 26 HE3 TRP 26 0.289 7.184 8.011
219 HZ2 TRP 26 HZ2 TRP 26 -4.127 5.661 6.255
220 HZ3 TRP 26 HZ3 TRP 26 -1.453 6.356 9.574
221 HH2 TRP 26 HH2 TRP 26 -3.662 5.599 8.711
222 HA PRO 27 HA PRO 27 4.463 11.242 5.789
223 1HB PRO 27 1HB PRO 27 7.069 10.317 5.144
224 2HB PRO 27 2HB PRO 27 6.139 10.065 6.638
225 1HG PRO 27 1HG PRO 27 6.399 8.231 4.274
226 2HG PRO 27 2HG PRO 27 6.309 7.818 6.001
227 1HD PRO 27 1HD PRO 27 4.172 7.534 4.348
228 2HD PRO 27 2HD PRO 27 3.970 8.064 6.040
229 HA PRO 28 HA PRO 28 6.571 12.924 1.886
230 1HB PRO 28 1HB PRO 28 6.331 11.707 -0.592
231 2HB PRO 28 2HB PRO 28 7.649 11.388 0.563
232 1HG PRO 28 1HG PRO 28 5.101 9.803 0.198
233 2HG PRO 28 2HG PRO 28 6.769 9.181 0.276
234 1HD PRO 28 1HD PRO 28 5.215 9.130 2.472
235 2HD PRO 28 2HD PRO 28 6.931 9.615 2.604
236 H LEU 29 H LEU 29 3.436 11.256 1.277
237 HA LEU 29 HA LEU 29 2.147 13.308 -0.186
238 1HB LEU 29 1HB LEU 29 1.259 11.033 0.219
239 2HB LEU 29 2HB LEU 29 0.979 11.430 1.902
240 HG LEU 29 HG LEU 29 -0.655 13.154 1.287
241 1HD1 LEU 29 1HD1 LEU 29 -0.072 12.318 -1.594
242 2HD1 LEU 29 2HD1 LEU 29 -1.482 13.270 -1.094
243 3HD1 LEU 29 3HD1 LEU 29 0.135 13.938 -0.892
244 1HD2 LEU 29 1HD2 LEU 29 -1.363 10.813 1.651
245 2HD2 LEU 29 2HD2 LEU 29 -2.400 11.632 0.466
246 3HD2 LEU 29 3HD2 LEU 29 -1.162 10.480 -0.083
247 H MET 30 H MET 30 2.422 12.763 3.324
248 HA MET 30 HA MET 30 0.999 15.042 4.259
249 1HB MET 30 1HB MET 30 1.641 12.996 5.568
250 2HB MET 30 2HB MET 30 3.306 13.584 5.628
251 1HG MET 30 1HG MET 30 2.517 15.644 6.796
252 2HG MET 30 2HG MET 30 0.866 15.020 6.762
253 1HE MET 30 1HE MET 30 0.076 12.902 8.054
254 2HE MET 30 2HE MET 30 1.418 11.829 7.574
255 3HE MET 30 3HE MET 30 1.033 12.057 9.293
256 H ALA 31 H ALA 31 4.506 14.624 3.601
257 HA ALA 31 HA ALA 31 5.340 17.252 4.285
258 1HB ALA 31 1HB ALA 31 6.881 15.352 3.983
259 2HB ALA 31 2HB ALA 31 6.537 15.335 2.241
260 3HB ALA 31 3HB ALA 31 7.344 16.732 2.975
261 H ALA 32 H ALA 32 4.317 15.895 1.108
262 HA ALA 32 HA ALA 32 4.650 18.200 -0.466
263 1HB ALA 32 1HB ALA 32 4.373 15.947 -1.387
264 2HB ALA 32 2HB ALA 32 2.690 15.894 -0.826
265 3HB ALA 32 3HB ALA 32 3.176 17.058 -2.074
266 H ILE 33 H ILE 33 1.683 17.036 1.217
267 HA ILE 33 HA ILE 33 0.019 19.286 0.540
268 HB ILE 33 HB ILE 33 -0.143 17.214 2.759
269 1HG1 ILE 33 1HG1 ILE 33 -1.741 17.504 0.165
270 2HG1 ILE 33 2HG1 ILE 33 -0.352 16.439 0.343
271 1HG2 ILE 33 1HG2 ILE 33 -2.243 19.266 1.909
272 2HG2 ILE 33 2HG2 ILE 33 -2.505 17.943 3.062
273 3HG2 ILE 33 3HG2 ILE 33 -1.394 19.234 3.467
274 1HD1 ILE 33 1HD1 ILE 33 -1.542 15.240 2.210
275 2HD1 ILE 33 2HD1 ILE 33 -2.999 16.183 1.817
276 3HD1 ILE 33 3HD1 ILE 33 -2.305 15.096 0.613
277 H GMA 34 H GLU 34 1.799 18.514 3.550
278 HA GMA 34 HA GLU 34 3.096 19.633 4.920
279 1HB GMA 34 1HB GLU 34 3.661 21.214 3.218
280 2HB GMA 34 2HB GLU 34 2.174 22.115 3.502
281 1HG GMA 34 1HG GLU 34 4.390 21.704 5.579
282 2HG GMA 34 2HG GLU 34 4.260 23.131 4.547
283 2HN GMA 34 2HN GLU 34 -0.719 20.649 5.791
284 1HN GMA 34 1NH GLU 34 -0.063 21.226 4.267
Start of MODEL 10
1 1H MET 1 1H MET 1 -8.115 -17.520 -4.536
2 2H MET 1 2H MET 1 -8.173 -18.275 -3.029
3 HA MET 1 HA MET 1 -10.399 -17.447 -3.634
4 1HB MET 1 1HB MET 1 -9.940 -19.249 -6.060
5 2HB MET 1 2HB MET 1 -11.495 -18.557 -5.579
6 1HG MET 1 1HG MET 1 -10.562 -16.266 -5.827
7 2HG MET 1 2HG MET 1 -9.018 -16.955 -6.328
8 1HE MET 1 1HE MET 1 -12.703 -16.244 -7.245
9 2HE MET 1 2HE MET 1 -12.850 -16.922 -8.883
10 3HE MET 1 3HE MET 1 -12.747 -18.010 -7.484
11 H ASN 2 H ASN 2 -9.488 -20.807 -4.497
12 HA ASN 2 HA ASN 2 -10.851 -21.874 -2.047
13 1HB ASN 2 1HB ASN 2 -11.057 -23.017 -4.872
14 2HB ASN 2 2HB ASN 2 -11.655 -23.777 -3.397
15 1HD2 ASN 2 2HD2 ASN 2 -12.168 -21.043 -5.644
16 2HD2 ASN 2 1HD2 ASN 2 -13.795 -20.704 -5.073
17 H LEU 3 H LEU 3 -8.387 -21.324 -1.711
18 HA LEU 3 HA LEU 3 -6.811 -23.704 -1.488
19 1HB LEU 3 1HB LEU 3 -6.661 -23.134 -4.002
20 2HB LEU 3 2HB LEU 3 -5.721 -21.737 -3.526
21 HG LEU 3 HG LEU 3 -5.096 -24.676 -2.949
22 1HD1 LEU 3 1HD1 LEU 3 -4.867 -24.046 -5.328
23 2HD1 LEU 3 2HD1 LEU 3 -3.788 -22.710 -4.882
24 3HD1 LEU 3 3HD1 LEU 3 -3.290 -24.390 -4.603
25 1HD2 LEU 3 1HD2 LEU 3 -3.453 -22.188 -2.313
26 2HD2 LEU 3 2HD2 LEU 3 -4.080 -23.386 -1.155
27 3HD2 LEU 3 3HD2 LEU 3 -2.814 -23.840 -2.289
28 H ASN 4 H ASN 4 -6.562 -23.121 0.571
29 HA ASN 4 HA ASN 4 -6.375 -21.008 2.063
30 1HB ASN 4 1HB ASN 4 -5.848 -23.349 2.748
31 2HB ASN 4 2HB ASN 4 -4.199 -23.157 2.201
32 1HD2 ASN 4 2HD2 ASN 4 -2.812 -21.519 3.355
33 2HD2 ASN 4 1HD2 ASN 4 -3.244 -21.105 5.006
34 H ALA 5 H ALA 5 -3.290 -22.054 0.592
35 HA ALA 5 HA ALA 5 -1.738 -19.788 1.217
36 1HB ALA 5 1HB ALA 5 -0.805 -21.959 0.523
37 2HB ALA 5 2HB ALA 5 -1.403 -21.704 -1.128
38 3HB ALA 5 3HB ALA 5 -0.159 -20.634 -0.457
39 H THR 6 H THR 6 -3.951 -20.245 -1.543
40 HA THR 6 HA THR 6 -3.030 -17.831 -2.949
41 HB THR 6 HB THR 6 -5.560 -19.460 -3.391
42 HG1 THR 6 HG1 THR 6 -3.529 -20.581 -3.710
43 1HG2 THR 6 1HG2 THR 6 -4.138 -17.422 -5.155
44 2HG2 THR 6 2HG2 THR 6 -5.489 -18.458 -5.656
45 3HG2 THR 6 3HG2 THR 6 -5.741 -17.227 -4.415
46 H ILE 7 H ILE 7 -5.390 -18.570 -0.400
47 HA ILE 7 HA ILE 7 -6.962 -16.103 -0.820
48 HB ILE 7 HB ILE 7 -7.047 -18.230 1.367
49 1HG1 ILE 7 1HG1 ILE 7 -9.037 -17.798 -0.906
50 2HG1 ILE 7 2HG1 ILE 7 -7.724 -18.969 -0.991
51 1HG2 ILE 7 1HG2 ILE 7 -7.902 -16.048 2.185
52 2HG2 ILE 7 2HG2 ILE 7 -8.983 -15.941 0.783
53 3HG2 ILE 7 3HG2 ILE 7 -9.215 -17.200 2.011
54 1HD1 ILE 7 1HD1 ILE 7 -8.586 -20.091 1.073
55 2HD1 ILE 7 2HD1 ILE 7 -10.012 -19.031 1.006
56 3HD1 ILE 7 3HD1 ILE 7 -9.683 -20.159 -0.312
57 H LEU 8 H LEU 8 -4.817 -17.525 1.596
58 HA LEU 8 HA LEU 8 -4.052 -15.418 3.235
59 1HB LEU 8 1HB LEU 8 -3.504 -17.852 3.319
60 2HB LEU 8 2HB LEU 8 -2.382 -17.657 1.986
61 HG LEU 8 HG LEU 8 -2.126 -16.218 4.681
62 1HD1 LEU 8 1HD1 LEU 8 -2.064 -18.668 4.999
63 2HD1 LEU 8 2HD1 LEU 8 -0.809 -18.810 3.752
64 3HD1 LEU 8 3HD1 LEU 8 -0.468 -17.958 5.272
65 1HD2 LEU 8 1HD2 LEU 8 -0.134 -16.651 2.398
66 2HD2 LEU 8 2HD2 LEU 8 -0.747 -15.097 3.003
67 3HD2 LEU 8 3HD2 LEU 8 0.314 -16.065 4.011
68 H GLY 9 H GLY 9 -2.454 -16.381 0.096
69 1HA GLY 9 1HA GLY 9 -0.770 -14.130 -0.004
70 2HA GLY 9 2HA GLY 9 -1.115 -15.162 -1.337
71 H GLN 10 H GLN 10 -4.125 -14.558 -1.259
72 HA GLN 10 HA GLN 10 -4.263 -12.066 -2.695
73 1HB GLN 10 1HB GLN 10 -5.867 -13.829 -3.018
74 2HB GLN 10 2HB GLN 10 -6.469 -13.703 -1.371
75 1HG GLN 10 1HG GLN 10 -6.541 -11.300 -3.251
76 2HG GLN 10 2HG GLN 10 -7.742 -12.576 -3.365
77 1HE2 GLN 10 2HE2 GLN 10 -6.605 -9.916 -1.286
78 2HE2 GLN 10 1HE2 GLN 10 -8.058 -9.919 -0.292
79 H ALA 11 H ALA 11 -4.935 -12.932 0.748
80 HA ALA 11 HA ALA 11 -5.511 -10.259 1.592
81 1HB ALA 11 1HB ALA 11 -6.174 -12.254 2.886
82 2HB ALA 11 2HB ALA 11 -4.473 -12.607 3.242
83 3HB ALA 11 3HB ALA 11 -5.217 -11.125 3.860
84 H ILE 12 H ILE 12 -2.414 -11.970 1.125
85 HA ILE 12 HA ILE 12 -0.738 -9.948 2.319
86 HB ILE 12 HB ILE 12 -0.274 -12.082 0.219
87 1HG1 ILE 12 1HG1 ILE 12 -0.541 -12.688 2.683
88 2HG1 ILE 12 2HG1 ILE 12 0.923 -13.262 1.880
89 1HG2 ILE 12 1HG2 ILE 12 1.767 -10.083 1.139
90 2HG2 ILE 12 2HG2 ILE 12 2.168 -11.635 0.372
91 3HG2 ILE 12 3HG2 ILE 12 1.242 -10.428 -0.520
92 1HD1 ILE 12 1HD1 ILE 12 0.797 -10.734 3.587
93 2HD1 ILE 12 2HD1 ILE 12 1.349 -12.327 4.137
94 3HD1 ILE 12 3HD1 ILE 12 2.244 -11.469 2.869
95 H ALA 13 H ALA 13 -1.835 -10.483 -1.062
96 HA ALA 13 HA ALA 13 -0.664 -8.231 -2.253
97 1HB ALA 13 1HB ALA 13 -1.744 -10.090 -3.466
98 2HB ALA 13 2HB ALA 13 -3.336 -9.546 -2.914
99 3HB ALA 13 3HB ALA 13 -2.373 -8.513 -3.982
100 H PHE 14 H PHE 14 -3.809 -8.529 -0.548
101 HA PHE 14 HA PHE 14 -4.611 -5.791 -0.832
102 1HB PHE 14 1HB PHE 14 -6.169 -7.588 -0.302
103 2HB PHE 14 2HB PHE 14 -5.371 -7.883 1.233
104 HD1 PHE 14 HD1 PHE 14 -7.156 -5.195 -0.716
105 HD2 PHE 14 HD2 PHE 14 -6.114 -6.718 3.193
106 HE1 PHE 14 HE1 PHE 14 -8.621 -3.488 0.345
107 HE2 PHE 14 HE2 PHE 14 -7.584 -5.016 4.247
108 HZ PHE 14 HZ PHE 14 -8.845 -3.403 2.826
109 H VAL 15 H VAL 15 -3.092 -7.436 2.028
110 HA VAL 15 HA VAL 15 -3.042 -5.085 3.625
111 HB VAL 15 HB VAL 15 -1.617 -7.761 3.873
112 1HG1 VAL 15 1HG1 VAL 15 -1.664 -5.459 5.878
113 2HG1 VAL 15 2HG1 VAL 15 -1.149 -7.117 6.242
114 3HG1 VAL 15 3HG1 VAL 15 -0.227 -6.149 5.093
115 1HG2 VAL 15 1HG2 VAL 15 -4.132 -7.726 4.160
116 2HG2 VAL 15 2HG2 VAL 15 -3.279 -8.156 5.645
117 3HG2 VAL 15 3HG2 VAL 15 -3.939 -6.523 5.439
118 H LEU 16 H LEU 16 -0.376 -6.692 1.775
119 HA LEU 16 HA LEU 16 1.639 -4.820 2.321
120 1HB LEU 16 1HB LEU 16 1.125 -6.377 -0.218
121 2HB LEU 16 2HB LEU 16 2.556 -5.383 0.040
122 HG LEU 16 HG LEU 16 1.788 -7.746 1.811
123 1HD1 LEU 16 1HD1 LEU 16 2.499 -8.359 -0.526
124 2HD1 LEU 16 2HD1 LEU 16 3.973 -7.399 -0.321
125 3HD1 LEU 16 3HD1 LEU 16 3.718 -8.847 0.668
126 1HD2 LEU 16 1HD2 LEU 16 4.248 -5.940 1.811
127 2HD2 LEU 16 2HD2 LEU 16 3.100 -6.193 3.146
128 3HD2 LEU 16 3HD2 LEU 16 4.154 -7.505 2.639
129 H PHE 17 H PHE 17 -0.870 -4.581 -0.273
130 HA PHE 17 HA PHE 17 -0.094 -2.102 -1.378
131 1HB PHE 17 1HB PHE 17 -1.913 -3.778 -2.111
132 2HB PHE 17 2HB PHE 17 -3.001 -3.005 -1.037
133 HD1 PHE 17 HD1 PHE 17 -1.081 -2.586 -4.164
134 HD2 PHE 17 HD2 PHE 17 -3.783 -0.671 -1.386
135 HE1 PHE 17 HE1 PHE 17 -1.505 -0.777 -5.817
136 HE2 PHE 17 HE2 PHE 17 -4.197 1.138 -3.039
137 HZ PHE 17 HZ PHE 17 -3.061 1.087 -5.258
138 H VAL 18 H VAL 18 -2.605 -2.752 1.002
139 HA VAL 18 HA VAL 18 -3.322 -0.140 1.737
140 HB VAL 18 HB VAL 18 -3.361 -2.701 3.372
141 1HG1 VAL 18 1HG1 VAL 18 -4.586 -0.002 4.101
142 2HG1 VAL 18 2HG1 VAL 18 -4.981 -1.546 4.882
143 3HG1 VAL 18 3HG1 VAL 18 -3.352 -0.890 5.022
144 1HG2 VAL 18 1HG2 VAL 18 -4.856 -2.543 1.329
145 2HG2 VAL 18 2HG2 VAL 18 -5.752 -2.667 2.848
146 3HG2 VAL 18 3HG2 VAL 18 -5.598 -1.101 2.032
147 H LEU 19 H LEU 19 -0.786 -2.108 3.460
148 HA LEU 19 HA LEU 19 -0.078 0.112 5.138
149 1HB LEU 19 1HB LEU 19 1.622 -2.255 4.465
150 2HB LEU 19 2HB LEU 19 1.775 -1.136 5.835
151 HG LEU 19 HG LEU 19 -0.478 -2.993 5.494
152 1HD1 LEU 19 1HD1 LEU 19 1.606 -4.197 6.011
153 2HD1 LEU 19 2HD1 LEU 19 1.873 -3.139 7.414
154 3HD1 LEU 19 3HD1 LEU 19 0.494 -4.257 7.390
155 1HD2 LEU 19 1HD2 LEU 19 0.206 -1.113 7.784
156 2HD2 LEU 19 2HD2 LEU 19 -1.224 -1.041 6.729
157 3HD2 LEU 19 3HD2 LEU 19 -1.039 -2.376 7.866
158 H PHE 20 H PHE 20 1.254 -1.036 1.999
159 HA PHE 20 HA PHE 20 3.452 0.756 1.811
160 1HB PHE 20 1HB PHE 20 3.076 -1.068 0.234
161 2HB PHE 20 2HB PHE 20 1.589 -0.346 -0.340
162 HD1 PHE 20 HD1 PHE 20 1.638 1.818 -1.662
163 HD2 PHE 20 HD2 PHE 20 5.214 -0.415 -0.694
164 HE1 PHE 20 HE1 PHE 20 2.857 2.964 -3.500
165 HE2 PHE 20 HE2 PHE 20 6.404 0.687 -2.576
166 HZ PHE 20 HZ PHE 20 5.232 2.380 -3.978
167 H CYS 21 H CYS 21 -0.076 1.266 1.120
168 HA CYS 21 HA CYS 21 0.202 4.058 0.564
169 1HB CYS 21 1HB CYS 21 -1.839 2.783 0.019
170 2HB CYS 21 2HB CYS 21 -2.244 2.686 1.741
171 HG CYS 21 HG CYS 21 -1.665 5.410 -0.007
172 H MET 22 H MET 22 -0.133 2.229 3.760
173 HA MET 22 HA MET 22 -0.486 4.682 5.176
174 1HB MET 22 1HB MET 22 0.141 1.928 6.229
175 2HB MET 22 2HB MET 22 -0.207 3.335 7.219
176 1HG MET 22 1HG MET 22 -2.417 3.612 6.273
177 2HG MET 22 2HG MET 22 -2.158 2.303 5.136
178 1HE MET 22 1HE MET 22 -2.627 3.295 8.862
179 2HE MET 22 2HE MET 22 -2.783 1.718 9.668
180 3HE MET 22 3HE MET 22 -1.201 2.240 9.050
181 H LYS 23 H LYS 23 2.387 3.308 3.904
182 HA LYS 23 HA LYS 23 3.998 5.109 5.605
183 1HB LYS 23 1HB LYS 23 3.922 2.192 5.743
184 2HB LYS 23 2HB LYS 23 5.451 2.578 5.043
185 1HG LYS 23 1HG LYS 23 4.304 3.603 7.672
186 2HG LYS 23 2HG LYS 23 5.560 2.380 7.514
187 1HD LYS 23 1HD LYS 23 5.899 5.334 6.735
188 2HD LYS 23 2HD LYS 23 6.334 4.622 8.272
189 1HE LYS 23 1HE LYS 23 8.340 4.810 7.066
190 2HE LYS 23 2HE LYS 23 7.958 3.085 7.119
191 1HZ LYS 23 1HZ LYS 23 7.320 4.847 4.837
192 2HZ LYS 23 2HZ LYS 23 8.717 3.972 4.946
193 3HZ LYS 23 3HZ LYS 23 7.267 3.207 4.868
194 H TYR 24 H TYR 24 3.968 3.388 2.505
195 HA TYR 24 HA TYR 24 6.457 4.661 1.671
196 1HB TYR 24 1HB TYR 24 5.348 2.377 0.899
197 2HB TYR 24 2HB TYR 24 4.493 3.397 -0.241
198 HD1 TYR 24 HD1 TYR 24 5.815 4.743 -1.948
199 HD2 TYR 24 HD2 TYR 24 7.697 1.895 0.704
200 HE1 TYR 24 HE1 TYR 24 7.850 4.759 -3.365
201 HE2 TYR 24 HE2 TYR 24 9.721 1.902 -0.713
202 HH TYR 24 HH TYR 24 10.720 2.744 -2.614
203 H VAL 25 H VAL 25 3.045 5.419 1.637
204 HA VAL 25 HA VAL 25 3.405 7.662 -0.313
205 HB VAL 25 HB VAL 25 0.856 6.280 0.567
206 1HG1 VAL 25 1HG1 VAL 25 1.356 8.405 -1.558
207 2HG1 VAL 25 2HG1 VAL 25 -0.168 7.528 -1.313
208 3HG1 VAL 25 3HG1 VAL 25 0.429 8.612 -0.056
209 1HG2 VAL 25 1HG2 VAL 25 2.436 6.080 -2.041
210 2HG2 VAL 25 2HG2 VAL 25 2.250 4.785 -0.845
211 3HG2 VAL 25 3HG2 VAL 25 0.842 5.360 -1.742
212 H TRP 26 H TRP 26 1.842 6.933 2.880
213 HA TRP 26 HA TRP 26 0.803 9.405 3.433
214 1HB TRP 26 1HB TRP 26 1.862 7.205 5.199
215 2HB TRP 26 2HB TRP 26 1.310 8.706 5.921
216 HD1 TRP 26 HD1 TRP 26 -0.789 7.714 2.972
217 HE1 TRP 26 HE1 TRP 26 -3.056 6.798 3.775
218 HE3 TRP 26 HE3 TRP 26 0.246 7.196 7.972
219 HZ2 TRP 26 HZ2 TRP 26 -4.277 6.003 6.233
220 HZ3 TRP 26 HZ3 TRP 26 -1.499 6.340 9.518
221 HH2 TRP 26 HH2 TRP 26 -3.762 5.756 8.665
222 HA PRO 27 HA PRO 27 4.631 11.160 5.702
223 1HB PRO 27 1HB PRO 27 7.165 10.118 4.962
224 2HB PRO 27 2HB PRO 27 6.265 9.879 6.476
225 1HG PRO 27 1HG PRO 27 6.362 8.091 4.069
226 2HG PRO 27 2HG PRO 27 6.305 7.645 5.789
227 1HD PRO 27 1HD PRO 27 4.109 7.498 4.195
228 2HD PRO 27 2HD PRO 27 3.981 8.000 5.903
229 HA PRO 28 HA PRO 28 6.689 12.819 1.766
230 1HB PRO 28 1HB PRO 28 6.322 11.662 -0.725
231 2HB PRO 28 2HB PRO 28 7.658 11.261 0.385
232 1HG PRO 28 1HG PRO 28 5.028 9.799 0.067
233 2HG PRO 28 2HG PRO 28 6.668 9.103 0.081
234 1HD PRO 28 1HD PRO 28 5.181 9.078 2.325
235 2HD PRO 28 2HD PRO 28 6.921 9.482 2.411
236 H LEU 29 H LEU 29 3.481 11.278 1.171
237 HA LEU 29 HA LEU 29 2.234 13.387 -0.226
238 1HB LEU 29 1HB LEU 29 1.293 11.133 0.191
239 2HB LEU 29 2HB LEU 29 1.038 11.544 1.876
240 HG LEU 29 HG LEU 29 -0.542 13.335 1.232
241 1HD1 LEU 29 1HD1 LEU 29 -0.008 12.376 -1.623
242 2HD1 LEU 29 2HD1 LEU 29 -1.391 13.379 -1.153
243 3HD1 LEU 29 3HD1 LEU 29 0.243 14.017 -0.981
244 1HD2 LEU 29 1HD2 LEU 29 -1.326 11.034 1.686
245 2HD2 LEU 29 2HD2 LEU 29 -2.348 11.848 0.486
246 3HD2 LEU 29 3HD2 LEU 29 -1.159 10.637 -0.039
247 H MET 30 H MET 30 2.593 12.818 3.273
248 HA MET 30 HA MET 30 1.280 15.155 4.236
249 1HB MET 30 1HB MET 30 1.844 13.152 5.599
250 2HB MET 30 2HB MET 30 3.553 13.598 5.545
251 1HG MET 30 1HG MET 30 3.052 15.735 6.690
252 2HG MET 30 2HG MET 30 1.331 15.334 6.703
253 1HE MET 30 1HE MET 30 1.353 15.998 9.253
254 2HE MET 30 2HE MET 30 2.397 15.225 10.468
255 3HE MET 30 3HE MET 30 3.110 16.277 9.224
256 H ALA 31 H ALA 31 4.776 14.558 3.602
257 HA ALA 31 HA ALA 31 5.728 17.144 4.257
258 1HB ALA 31 1HB ALA 31 7.163 15.139 4.009
259 2HB ALA 31 2HB ALA 31 6.876 15.149 2.255
260 3HB ALA 31 3HB ALA 31 7.746 16.490 3.023
261 H ALA 32 H ALA 32 4.395 15.915 1.174
262 HA ALA 32 HA ALA 32 4.928 18.225 -0.386
263 1HB ALA 32 1HB ALA 32 4.485 16.042 -1.378
264 2HB ALA 32 2HB ALA 32 2.823 16.059 -0.760
265 3HB ALA 32 3HB ALA 32 3.331 17.246 -1.976
266 H ILE 33 H ILE 33 1.836 17.129 1.152
267 HA ILE 33 HA ILE 33 0.353 19.492 0.506
268 HB ILE 33 HB ILE 33 -0.126 17.308 2.569
269 1HG1 ILE 33 1HG1 ILE 33 -1.355 17.790 -0.194
270 2HG1 ILE 33 2HG1 ILE 33 -0.082 16.618 0.143
271 1HG2 ILE 33 1HG2 ILE 33 -1.372 19.363 3.223
272 2HG2 ILE 33 2HG2 ILE 33 -2.055 19.468 1.589
273 3HG2 ILE 33 3HG2 ILE 33 -2.469 18.119 2.665
274 1HD1 ILE 33 1HD1 ILE 33 -1.619 15.466 1.774
275 2HD1 ILE 33 2HD1 ILE 33 -2.930 16.523 1.202
276 3HD1 ILE 33 3HD1 ILE 33 -2.141 15.416 0.078
277 H GMA 34 H GLU 34 1.808 18.439 3.604
278 HA GMA 34 HA GLU 34 1.842 21.232 4.663
279 1HB GMA 34 1HB GLU 34 0.565 19.519 5.980
280 2HB GMA 34 2HB GLU 34 2.049 18.574 6.149
281 1HG GMA 34 1HG GLU 34 3.107 20.495 7.365
282 2HG GMA 34 2HG GLU 34 1.634 21.442 7.135
283 2HN GMA 34 2HN GLU 34 5.133 20.422 3.171
284 1HN GMA 34 1NH GLU 34 3.560 21.056 2.719