Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
9205 | 1niy RC | 5674 | cing | 1-original | 3 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 1H GLU 1 1H GLU 1 7.981 9.438 1.305
2 2H GLU 1 2H GLU 1 7.002 10.130 0.103
3 3H GLU 1 3H GLU 1 7.793 8.653 -0.186
4 HA GLU 1 HA GLU 1 5.790 8.969 1.986
5 1HB GLU 1 2HB GLU 1 4.214 7.949 0.271
6 2HB GLU 1 1HB GLU 1 4.691 9.613 -0.059
7 1HG GLU 1 2HG GLU 1 6.053 9.016 -1.848
8 2HG GLU 1 1HG GLU 1 6.325 7.385 -1.234
9 H CYS 2 H CYS 2 5.716 7.105 3.188
10 HA CYS 2 HA CYS 2 6.369 4.490 2.010
11 1HB CYS 2 2HB CYS 2 8.586 5.388 2.375
12 2HB CYS 2 1HB CYS 2 8.158 5.919 4.000
13 H LEU 3 H LEU 3 4.258 3.909 2.826
14 HA LEU 3 HA LEU 3 3.750 4.124 5.741
15 1HB LEU 3 2HB LEU 3 2.207 3.211 3.305
16 2HB LEU 3 1HB LEU 3 1.573 2.983 4.934
17 HG LEU 3 HG LEU 3 2.527 5.678 3.957
18 1HD1 LEU 3 1HD1 LEU 3 0.673 4.687 2.511
19 2HD1 LEU 3 2HD1 LEU 3 0.292 6.222 3.291
20 3HD1 LEU 3 3HD1 LEU 3 -0.342 4.716 3.953
21 1HD2 LEU 3 1HD2 LEU 3 2.215 5.181 6.430
22 2HD2 LEU 3 2HD2 LEU 3 0.504 4.929 6.088
23 3HD2 LEU 3 3HD2 LEU 3 1.232 6.510 5.815
24 H GLY 4 H GLY 4 3.608 2.293 7.115
25 1HA GLY 4 2HA GLY 4 5.251 0.015 6.439
26 2HA GLY 4 1HA GLY 4 4.279 0.182 7.901
27 H PHE 5 H PHE 5 4.323 -2.295 6.799
28 HA PHE 5 HA PHE 5 2.294 -2.784 4.799
29 1HB PHE 5 2HB PHE 5 4.041 -4.390 5.176
30 2HB PHE 5 1HB PHE 5 3.685 -4.468 6.900
31 HD1 PHE 5 HD1 PHE 5 2.722 -6.491 7.516
32 HD2 PHE 5 HD2 PHE 5 1.621 -4.720 3.759
33 HE1 PHE 5 HE1 PHE 5 1.118 -8.337 7.113
34 HE2 PHE 5 HE2 PHE 5 0.017 -6.567 3.361
35 HZ PHE 5 HZ PHE 5 -0.235 -8.375 5.037
36 H GLY 6 H GLY 6 0.108 -2.832 5.056
37 1HA GLY 6 2HA GLY 6 -1.977 -3.205 6.107
38 2HA GLY 6 1HA GLY 6 -1.124 -3.626 7.591
39 H LYS 7 H LYS 7 -0.685 -0.622 5.748
40 HA LYS 7 HA LYS 7 -1.665 0.888 8.143
41 1HB LYS 7 2HB LYS 7 0.775 0.950 7.180
42 2HB LYS 7 1HB LYS 7 0.070 1.979 5.933
43 1HG LYS 7 2HG LYS 7 0.718 3.553 7.529
44 2HG LYS 7 1HG LYS 7 -0.965 3.269 7.972
45 1HD LYS 7 2HD LYS 7 -0.188 1.555 9.625
46 2HD LYS 7 1HD LYS 7 1.476 1.999 9.245
47 1HE LYS 7 2HE LYS 7 1.368 3.886 10.514
48 2HE LYS 7 1HE LYS 7 -0.228 4.320 9.873
49 1HZ LYS 7 1HZ LYS 7 -1.225 2.622 11.263
50 2HZ LYS 7 2HZ LYS 7 -0.346 3.709 12.226
51 3HZ LYS 7 3HZ LYS 7 0.295 2.177 11.869
52 H GLY 8 H GLY 8 -3.366 2.312 7.854
53 1HA GLY 8 2HA GLY 8 -5.064 2.178 5.589
54 2HA GLY 8 1HA GLY 8 -5.120 3.457 6.802
55 H CYS 9 H CYS 9 -4.654 2.909 3.564
56 HA CYS 9 HA CYS 9 -3.343 5.568 3.224
57 1HB CYS 9 2HB CYS 9 -1.694 4.656 1.749
58 2HB CYS 9 1HB CYS 9 -1.716 3.588 3.151
59 H ASN 10 H ASN 10 -3.439 6.156 0.767
60 HA ASN 10 HA ASN 10 -6.193 5.545 -0.206
61 1HB ASN 10 2HB ASN 10 -5.280 7.889 0.245
62 2HB ASN 10 1HB ASN 10 -4.210 7.644 -1.134
63 1HD2 ASN 10 1HD2 ASN 10 -5.191 9.135 -2.597
64 2HD2 ASN 10 2HD2 ASN 10 -6.787 8.976 -3.152
65 HA PRO 11 HA PRO 11 -4.229 2.950 -3.279
66 1HB PRO 11 2HB PRO 11 -6.490 2.388 -4.719
67 2HB PRO 11 1HB PRO 11 -6.095 1.596 -3.180
68 1HG PRO 11 2HG PRO 11 -7.974 3.837 -3.727
69 2HG PRO 11 1HG PRO 11 -8.147 2.463 -2.624
70 1HD PRO 11 2HD PRO 11 -7.470 4.962 -1.793
71 2HD PRO 11 1HD PRO 11 -6.953 3.484 -0.952
72 H SER 12 H SER 12 -6.245 5.763 -3.983
73 HA SER 12 HA SER 12 -5.653 5.933 -6.814
74 1HB SER 12 2HB SER 12 -6.726 7.749 -4.665
75 2HB SER 12 1HB SER 12 -6.389 8.389 -6.271
76 HG SER 12 HG SER 12 -8.282 6.507 -5.429
77 H ASN 13 H ASN 13 -4.254 7.522 -3.916
78 HA ASN 13 HA ASN 13 -2.154 8.823 -5.542
79 1HB ASN 13 2HB ASN 13 -3.101 8.837 -2.690
80 2HB ASN 13 1HB ASN 13 -1.488 9.449 -3.055
81 1HD2 ASN 13 1HD2 ASN 13 -1.345 11.557 -3.929
82 2HD2 ASN 13 2HD2 ASN 13 -2.689 12.478 -4.407
83 H ASP 14 H ASP 14 -2.494 6.174 -3.223
84 HA ASP 14 HA ASP 14 -1.082 4.385 -2.673
85 1HB ASP 14 2HB ASP 14 -0.955 4.607 -5.303
86 2HB ASP 14 1HB ASP 14 0.693 5.146 -4.975
87 H GLN 15 H GLN 15 -0.182 5.123 -0.733
88 HA GLN 15 HA GLN 15 2.380 6.678 -0.928
89 1HB GLN 15 2HB GLN 15 0.116 6.576 1.067
90 2HB GLN 15 1HB GLN 15 1.690 7.236 1.511
91 1HG GLN 15 2HG GLN 15 0.624 8.234 -1.057
92 2HG GLN 15 1HG GLN 15 -0.319 8.697 0.359
93 1HE2 GLN 15 1HE2 GLN 15 2.046 9.929 -1.527
94 2HE2 GLN 15 2HE2 GLN 15 2.946 10.789 -0.373
95 H CYS 16 H CYS 16 1.699 3.581 -0.832
96 HA CYS 16 HA CYS 16 2.847 2.656 1.681
97 1HB CYS 16 2HB CYS 16 2.314 1.370 -1.015
98 2HB CYS 16 1HB CYS 16 2.866 0.473 0.399
99 H CYS 17 H CYS 17 4.929 1.395 1.750
100 HA CYS 17 HA CYS 17 7.086 2.880 0.418
101 1HB CYS 17 2HB CYS 17 6.739 1.618 2.826
102 2HB CYS 17 1HB CYS 17 7.686 0.419 1.944
103 H LYS 18 H LYS 18 7.983 2.276 -1.505
104 HA LYS 18 HA LYS 18 7.168 -0.133 -2.908
105 1HB LYS 18 2HB LYS 18 8.052 2.293 -3.645
106 2HB LYS 18 1HB LYS 18 9.593 1.436 -3.680
107 1HG LYS 18 2HG LYS 18 7.501 -0.151 -4.925
108 2HG LYS 18 1HG LYS 18 7.630 1.432 -5.690
109 1HD LYS 18 2HD LYS 18 10.152 -0.067 -5.088
110 2HD LYS 18 1HD LYS 18 9.179 -0.579 -6.467
111 1HE LYS 18 2HE LYS 18 9.288 1.669 -7.435
112 2HE LYS 18 1HE LYS 18 10.174 2.260 -6.015
113 1HZ LYS 18 1HZ LYS 18 11.926 0.688 -6.447
114 2HZ LYS 18 2HZ LYS 18 11.663 1.606 -7.852
115 3HZ LYS 18 3HZ LYS 18 11.071 0.016 -7.750
116 H SER 19 H SER 19 9.996 0.783 -0.976
117 HA SER 19 HA SER 19 11.782 -1.305 -1.735
118 1HB SER 19 2HB SER 19 11.344 0.367 0.738
119 2HB SER 19 1HB SER 19 12.635 -0.830 0.674
120 HG SER 19 HG SER 19 13.689 0.710 -0.297
121 H SER 20 H SER 20 9.069 -1.294 0.568
122 HA SER 20 HA SER 20 9.713 -4.074 1.425
123 1HB SER 20 2HB SER 20 7.807 -1.901 2.308
124 2HB SER 20 1HB SER 20 7.693 -3.540 2.944
125 HG SER 20 HG SER 20 9.634 -1.582 3.326
126 H ASN 21 H ASN 21 8.477 -3.122 -1.316
127 HA ASN 21 HA ASN 21 6.825 -3.880 -2.815
128 1HB ASN 21 2HB ASN 21 7.018 -6.245 -0.915
129 2HB ASN 21 1HB ASN 21 6.380 -6.304 -2.557
130 1HD2 ASN 21 1HD2 ASN 21 8.064 -5.317 -4.259
131 2HD2 ASN 21 2HD2 ASN 21 9.675 -5.801 -4.037
132 H LEU 22 H LEU 22 5.661 -2.119 -1.124
133 HA LEU 22 HA LEU 22 3.163 -3.451 -0.130
134 1HB LEU 22 2HB LEU 22 4.595 -0.885 0.626
135 2HB LEU 22 1HB LEU 22 3.014 -1.338 1.261
136 HG LEU 22 HG LEU 22 5.485 -3.077 1.501
137 1HD1 LEU 22 1HD1 LEU 22 5.589 -2.324 3.830
138 2HD1 LEU 22 2HD1 LEU 22 4.198 -1.272 3.572
139 3HD1 LEU 22 3HD1 LEU 22 5.721 -0.939 2.748
140 1HD2 LEU 22 1HD2 LEU 22 4.087 -4.224 3.221
141 2HD2 LEU 22 2HD2 LEU 22 3.369 -4.308 1.613
142 3HD2 LEU 22 3HD2 LEU 22 2.741 -3.164 2.801
143 H VAL 23 H VAL 23 1.254 -2.877 -1.101
144 HA VAL 23 HA VAL 23 1.218 -0.466 -2.890
145 HB VAL 23 HB VAL 23 -0.224 -1.909 -4.406
146 1HG1 VAL 23 1HG1 VAL 23 2.247 -1.515 -4.738
147 2HG1 VAL 23 2HG1 VAL 23 1.655 -3.026 -5.430
148 3HG1 VAL 23 3HG1 VAL 23 2.542 -3.041 -3.905
149 1HG2 VAL 23 1HG2 VAL 23 0.872 -4.202 -2.751
150 2HG2 VAL 23 2HG2 VAL 23 -0.280 -4.292 -4.083
151 3HG2 VAL 23 3HG2 VAL 23 -0.763 -3.571 -2.549
152 H CYS 24 H CYS 24 -0.692 0.766 -2.736
153 HA CYS 24 HA CYS 24 -2.402 0.326 -0.432
154 1HB CYS 24 2HB CYS 24 -2.245 2.257 -2.733
155 2HB CYS 24 1HB CYS 24 -3.672 2.260 -1.698
156 H SER 25 H SER 25 -4.078 -1.096 -0.377
157 HA SER 25 HA SER 25 -5.172 -2.281 -2.832
158 1HB SER 25 2HB SER 25 -5.623 -2.579 0.143
159 2HB SER 25 1HB SER 25 -6.610 -3.448 -1.029
160 HG SER 25 HG SER 25 -4.995 -4.815 -0.841
161 H ARG 26 H ARG 26 -7.498 -2.243 -3.318
162 HA ARG 26 HA ARG 26 -8.713 0.417 -2.800
163 1HB ARG 26 2HB ARG 26 -9.138 -1.891 -4.692
164 2HB ARG 26 1HB ARG 26 -10.380 -0.650 -4.518
165 1HG ARG 26 2HG ARG 26 -8.748 1.093 -5.091
166 2HG ARG 26 1HG ARG 26 -7.477 -0.122 -5.220
167 1HD ARG 26 2HD ARG 26 -9.909 -0.661 -6.841
168 2HD ARG 26 1HD ARG 26 -8.921 0.718 -7.363
169 HE ARG 26 HE ARG 26 -7.062 -0.778 -7.702
170 1HH1 ARG 26 2HH1 ARG 26 -9.247 -2.473 -8.901
171 2HH1 ARG 26 1HH1 ARG 26 -8.980 -4.000 -8.130
172 1HH2 ARG 26 1HH2 ARG 26 -6.975 -2.677 -5.616
173 2HH2 ARG 26 2HH2 ARG 26 -7.689 -4.116 -6.263
174 H LYS 27 H LYS 27 -9.436 -3.045 -2.358
175 HA LYS 27 HA LYS 27 -12.014 -2.614 -1.071
176 1HB LYS 27 2HB LYS 27 -10.268 -4.777 -1.947
177 2HB LYS 27 1HB LYS 27 -10.973 -5.131 -0.370
178 1HG LYS 27 2HG LYS 27 -13.214 -4.763 -1.223
179 2HG LYS 27 1HG LYS 27 -12.575 -4.216 -2.774
180 1HD LYS 27 2HD LYS 27 -13.187 -6.477 -3.146
181 2HD LYS 27 1HD LYS 27 -11.437 -6.518 -2.926
182 1HE LYS 27 2HE LYS 27 -12.658 -6.732 -0.335
183 2HE LYS 27 1HE LYS 27 -13.407 -7.926 -1.413
184 1HZ LYS 27 1HZ LYS 27 -10.484 -7.483 -1.081
185 2HZ LYS 27 2HZ LYS 27 -11.197 -8.605 -2.140
186 3HZ LYS 27 3HZ LYS 27 -11.357 -8.797 -0.459
187 H HIS 28 H HIS 28 -8.697 -3.279 0.052
188 HA HIS 28 HA HIS 28 -9.531 -3.134 2.891
189 1HB HIS 28 2HB HIS 28 -6.929 -3.678 1.430
190 2HB HIS 28 1HB HIS 28 -7.067 -3.670 3.189
191 HD1 HIS 28 HD1 HIS 28 -8.120 -5.603 0.141
192 HD2 HIS 28 HD2 HIS 28 -8.469 -5.892 4.285
193 HE1 HIS 28 HE1 HIS 28 -9.024 -7.918 0.623
194 H ARG 29 H ARG 29 -8.140 -1.070 0.436
195 HA ARG 29 HA ARG 29 -7.354 1.152 0.504
196 1HB ARG 29 2HB ARG 29 -9.687 0.961 1.849
197 2HB ARG 29 1HB ARG 29 -8.654 1.531 3.160
198 1HG ARG 29 2HG ARG 29 -7.831 3.272 1.362
199 2HG ARG 29 1HG ARG 29 -9.367 2.894 0.582
200 1HD ARG 29 2HD ARG 29 -10.612 3.547 2.564
201 2HD ARG 29 1HD ARG 29 -9.110 3.752 3.487
202 HE ARG 29 HE ARG 29 -8.631 5.415 1.405
203 1HH1 ARG 29 1HH2 ARG 29 -9.434 6.705 3.932
204 2HH1 ARG 29 2HH2 ARG 29 -10.889 7.543 3.503
205 1HH2 ARG 29 2HH1 ARG 29 -11.385 5.730 0.577
206 2HH2 ARG 29 1HH1 ARG 29 -11.997 6.988 1.598
207 H TRP 30 H TRP 30 -5.527 -0.782 1.537
208 HA TRP 30 HA TRP 30 -3.984 0.937 3.397
209 1HB TRP 30 2HB TRP 30 -3.833 -0.741 5.091
210 2HB TRP 30 1HB TRP 30 -5.533 -0.664 4.654
211 HD1 TRP 30 HD1 TRP 30 -4.684 -2.412 1.820
212 HE1 TRP 30 HE1 TRP 30 -4.586 -4.966 2.107
213 HE3 TRP 30 HE3 TRP 30 -4.324 -2.713 6.904
214 HZ2 TRP 30 HZ2 TRP 30 -4.386 -6.888 4.210
215 HZ3 TRP 30 HZ3 TRP 30 -4.186 -4.919 8.021
216 HH2 TRP 30 HH2 TRP 30 -4.217 -7.005 6.683
217 H CYS 31 H CYS 31 -1.767 -0.336 3.858
218 HA CYS 31 HA CYS 31 -0.592 -0.870 1.225
219 1HB CYS 31 2HB CYS 31 0.408 -0.803 4.086
220 2HB CYS 31 1HB CYS 31 1.466 -1.202 2.735
221 H LYS 32 H LYS 32 -0.658 -2.879 0.312
222 HA LYS 32 HA LYS 32 -0.803 -5.271 2.122
223 1HB LYS 32 2HB LYS 32 -2.802 -4.741 0.713
224 2HB LYS 32 1HB LYS 32 -1.794 -4.901 -0.725
225 1HG LYS 32 2HG LYS 32 -1.471 -7.216 -0.391
226 2HG LYS 32 1HG LYS 32 -1.965 -7.128 1.301
227 1HD LYS 32 2HD LYS 32 -3.910 -7.979 0.394
228 2HD LYS 32 1HD LYS 32 -4.241 -6.257 0.206
229 1HE LYS 32 2HE LYS 32 -3.646 -6.284 -2.106
230 2HE LYS 32 1HE LYS 32 -2.872 -7.875 -1.964
231 1HZ LYS 32 1HZ LYS 32 -5.177 -7.940 -2.883
232 2HZ LYS 32 2HZ LYS 32 -5.745 -7.381 -1.382
233 3HZ LYS 32 3HZ LYS 32 -4.960 -8.886 -1.491
234 H TYR 33 H TYR 33 0.476 -7.108 1.515
235 HA TYR 33 HA TYR 33 2.831 -6.443 -0.195
236 1HB TYR 33 2HB TYR 33 2.939 -7.225 2.251
237 2HB TYR 33 1HB TYR 33 2.419 -8.802 1.658
238 HD1 TYR 33 HD1 TYR 33 3.808 -9.905 -0.212
239 HD2 TYR 33 HD2 TYR 33 5.205 -6.577 2.118
240 HE1 TYR 33 HE1 TYR 33 6.143 -10.431 -0.862
241 HE2 TYR 33 HE2 TYR 33 7.539 -7.103 1.469
242 HH TYR 33 HH TYR 33 8.653 -9.704 0.553
243 H GLU 34 H GLU 34 2.936 -7.350 -2.212
244 HA GLU 34 HA GLU 34 0.929 -9.309 -3.073
245 1HB GLU 34 2HB GLU 34 3.091 -7.623 -4.262
246 2HB GLU 34 1HB GLU 34 2.584 -9.043 -5.176
247 1HG GLU 34 2HG GLU 34 0.636 -6.993 -4.089
248 2HG GLU 34 1HG GLU 34 1.306 -6.921 -5.719
249 H ILE 35 H ILE 35 1.225 -11.446 -2.627
250 HA ILE 35 HA ILE 35 4.023 -12.532 -2.615
251 HB ILE 35 HB ILE 35 2.645 -12.448 -0.469
252 1HG1 ILE 35 1HG1 ILE 35 3.137 -15.330 -1.045
253 2HG1 ILE 35 2HG1 ILE 35 4.497 -14.230 -1.279
254 1HG2 ILE 35 1HG2 ILE 35 0.490 -13.091 -1.651
255 2HG2 ILE 35 2HG2 ILE 35 1.125 -14.734 -1.748
256 3HG2 ILE 35 3HG2 ILE 35 0.833 -13.992 -0.174
257 1HD1 ILE 35 1HD1 ILE 35 4.152 -13.344 1.015
258 2HD1 ILE 35 2HD1 ILE 35 2.841 -14.500 1.248
259 3HD1 ILE 35 3HD1 ILE 35 4.495 -15.073 1.024
260 1HN NH2 36 1HN NH2 36 1.932 -13.499 -5.598
261 2HN NH2 36 2HN NH2 36 2.259 -11.997 -4.708
Start of MODEL 2
1 1H GLU 1 1H GLU 1 6.059 11.511 -1.480
2 2H GLU 1 2H GLU 1 7.237 12.394 -0.635
3 3H GLU 1 3H GLU 1 5.877 11.788 0.185
4 HA GLU 1 HA GLU 1 8.056 10.167 -1.040
5 1HB GLU 1 2HB GLU 1 8.382 11.571 1.109
6 2HB GLU 1 1HB GLU 1 7.244 10.453 1.860
7 1HG GLU 1 2HG GLU 1 9.469 9.628 2.301
8 2HG GLU 1 1HG GLU 1 8.737 8.558 1.107
9 H CYS 2 H CYS 2 7.786 7.853 -0.638
10 HA CYS 2 HA CYS 2 5.084 6.889 -1.027
11 1HB CYS 2 2HB CYS 2 6.207 4.699 -0.994
12 2HB CYS 2 1HB CYS 2 7.140 5.851 -1.946
13 H LEU 3 H LEU 3 4.072 5.207 0.418
14 HA LEU 3 HA LEU 3 4.271 6.050 3.269
15 1HB LEU 3 2HB LEU 3 2.248 4.508 1.622
16 2HB LEU 3 1HB LEU 3 2.094 4.727 3.364
17 HG LEU 3 HG LEU 3 2.399 7.030 1.418
18 1HD1 LEU 3 1HD1 LEU 3 0.060 7.285 1.374
19 2HD1 LEU 3 2HD1 LEU 3 -0.173 6.244 2.778
20 3HD1 LEU 3 3HD1 LEU 3 0.269 5.540 1.223
21 1HD2 LEU 3 1HD2 LEU 3 1.348 8.220 3.455
22 2HD2 LEU 3 2HD2 LEU 3 3.035 7.727 3.599
23 3HD2 LEU 3 3HD2 LEU 3 1.769 6.768 4.364
24 H GLY 4 H GLY 4 4.447 4.454 4.954
25 1HA GLY 4 2HA GLY 4 6.131 2.165 4.239
26 2HA GLY 4 1HA GLY 4 5.673 2.648 5.873
27 H PHE 5 H PHE 5 5.246 0.326 6.231
28 HA PHE 5 HA PHE 5 3.046 -0.958 4.776
29 1HB PHE 5 2HB PHE 5 4.889 -2.293 5.568
30 2HB PHE 5 1HB PHE 5 4.734 -1.644 7.200
31 HD1 PHE 5 HD1 PHE 5 3.765 -3.078 8.749
32 HD2 PHE 5 HD2 PHE 5 2.469 -3.250 4.655
33 HE1 PHE 5 HE1 PHE 5 2.168 -4.885 9.328
34 HE2 PHE 5 HE2 PHE 5 0.875 -5.056 5.236
35 HZ PHE 5 HZ PHE 5 0.724 -5.873 7.571
36 H GLY 6 H GLY 6 0.924 -1.111 5.463
37 1HA GLY 6 2HA GLY 6 -0.987 -0.817 6.787
38 2HA GLY 6 1HA GLY 6 0.072 -0.638 8.184
39 H LYS 7 H LYS 7 0.042 1.329 5.220
40 HA LYS 7 HA LYS 7 -0.500 3.729 6.927
41 1HB LYS 7 2HB LYS 7 1.430 3.042 4.907
42 2HB LYS 7 1HB LYS 7 0.460 4.395 4.325
43 1HG LYS 7 2HG LYS 7 2.247 5.392 5.543
44 2HG LYS 7 1HG LYS 7 0.853 5.466 6.621
45 1HD LYS 7 2HD LYS 7 1.623 3.395 7.745
46 2HD LYS 7 1HD LYS 7 3.034 3.358 6.687
47 1HE LYS 7 2HE LYS 7 2.939 5.977 7.784
48 2HE LYS 7 1HE LYS 7 2.680 4.850 9.130
49 1HZ LYS 7 1HZ LYS 7 4.844 4.670 7.096
50 2HZ LYS 7 2HZ LYS 7 4.570 3.544 8.339
51 3HZ LYS 7 3HZ LYS 7 5.041 5.131 8.716
52 H GLY 8 H GLY 8 -2.288 4.988 6.438
53 1HA GLY 8 2HA GLY 8 -4.390 3.925 4.813
54 2HA GLY 8 1HA GLY 8 -4.355 5.554 5.486
55 H CYS 9 H CYS 9 -4.466 3.903 2.630
56 HA CYS 9 HA CYS 9 -3.486 6.282 1.113
57 1HB CYS 9 2HB CYS 9 -2.347 4.673 -0.455
58 2HB CYS 9 1HB CYS 9 -1.645 4.686 1.161
59 H ASN 10 H ASN 10 -4.101 5.793 -1.370
60 HA ASN 10 HA ASN 10 -6.974 4.975 -1.347
61 1HB ASN 10 2HB ASN 10 -5.230 6.750 -3.059
62 2HB ASN 10 1HB ASN 10 -6.818 6.230 -3.620
63 1HD2 ASN 10 1HD2 ASN 10 -5.945 8.999 -2.843
64 2HD2 ASN 10 2HD2 ASN 10 -6.997 9.474 -1.599
65 HA PRO 11 HA PRO 11 -5.872 1.324 -3.604
66 1HB PRO 11 2HB PRO 11 -8.361 0.723 -4.592
67 2HB PRO 11 1HB PRO 11 -7.886 0.426 -2.907
68 1HG PRO 11 2HG PRO 11 -9.473 2.673 -4.056
69 2HG PRO 11 1HG PRO 11 -9.715 1.776 -2.548
70 1HD PRO 11 2HD PRO 11 -8.583 4.236 -2.622
71 2HD PRO 11 1HD PRO 11 -8.155 3.015 -1.402
72 H SER 12 H SER 12 -7.902 3.814 -5.180
73 HA SER 12 HA SER 12 -7.320 3.008 -7.898
74 1HB SER 12 2HB SER 12 -8.297 5.548 -6.567
75 2HB SER 12 1HB SER 12 -8.169 5.388 -8.316
76 HG SER 12 HG SER 12 -9.943 4.235 -6.527
77 H ASN 13 H ASN 13 -5.731 5.132 -5.563
78 HA ASN 13 HA ASN 13 -3.524 5.602 -7.538
79 1HB ASN 13 2HB ASN 13 -4.966 7.407 -5.598
80 2HB ASN 13 1HB ASN 13 -3.308 7.775 -6.074
81 1HD2 ASN 13 1HD2 ASN 13 -6.634 7.470 -7.302
82 2HD2 ASN 13 2HD2 ASN 13 -6.338 8.248 -8.781
83 H ASP 14 H ASP 14 -2.680 3.578 -6.492
84 HA ASP 14 HA ASP 14 -2.111 3.113 -3.806
85 1HB ASP 14 2HB ASP 14 -1.613 1.445 -5.408
86 2HB ASP 14 1HB ASP 14 -0.640 2.547 -6.379
87 H GLN 15 H GLN 15 -0.933 4.184 -2.295
88 HA GLN 15 HA GLN 15 1.195 6.102 -3.207
89 1HB GLN 15 2HB GLN 15 -0.868 6.139 -0.997
90 2HB GLN 15 1HB GLN 15 0.551 7.183 -0.931
91 1HG GLN 15 2HG GLN 15 -0.164 8.504 -2.668
92 2HG GLN 15 1HG GLN 15 -0.972 7.169 -3.490
93 1HE2 GLN 15 1HE2 GLN 15 -1.325 8.882 -0.312
94 2HE2 GLN 15 2HE2 GLN 15 -3.017 8.987 -0.401
95 H CYS 16 H CYS 16 1.284 3.116 -2.333
96 HA CYS 16 HA CYS 16 2.809 3.239 0.198
97 1HB CYS 16 2HB CYS 16 2.095 0.976 -1.698
98 2HB CYS 16 1HB CYS 16 2.800 0.773 -0.095
99 H CYS 17 H CYS 17 4.971 2.084 0.264
100 HA CYS 17 HA CYS 17 6.720 3.107 -1.879
101 1HB CYS 17 2HB CYS 17 6.903 2.823 0.840
102 2HB CYS 17 1HB CYS 17 7.812 1.416 0.292
103 H LYS 18 H LYS 18 7.764 1.849 -3.401
104 HA LYS 18 HA LYS 18 6.878 -0.934 -3.768
105 1HB LYS 18 2HB LYS 18 7.241 0.926 -5.531
106 2HB LYS 18 1HB LYS 18 8.962 0.583 -5.348
107 1HG LYS 18 2HG LYS 18 8.153 -1.924 -5.675
108 2HG LYS 18 1HG LYS 18 6.795 -1.142 -6.482
109 1HD LYS 18 2HD LYS 18 9.292 0.069 -7.312
110 2HD LYS 18 1HD LYS 18 9.336 -1.674 -7.576
111 1HE LYS 18 2HE LYS 18 8.178 -1.237 -9.492
112 2HE LYS 18 1HE LYS 18 6.780 -0.972 -8.433
113 1HZ LYS 18 1HZ LYS 18 7.194 0.981 -9.798
114 2HZ LYS 18 2HZ LYS 18 8.785 1.083 -9.211
115 3HZ LYS 18 3HZ LYS 18 7.471 1.336 -8.163
116 H SER 19 H SER 19 9.715 0.761 -2.568
117 HA SER 19 HA SER 19 11.703 -1.262 -2.844
118 1HB SER 19 2HB SER 19 11.930 1.173 -2.169
119 2HB SER 19 1HB SER 19 11.344 0.716 -0.572
120 HG SER 19 HG SER 19 13.479 0.494 -0.368
121 H SER 20 H SER 20 9.235 -0.749 -0.315
122 HA SER 20 HA SER 20 10.187 -3.155 1.159
123 1HB SER 20 2HB SER 20 8.253 -0.892 1.683
124 2HB SER 20 1HB SER 20 8.331 -2.296 2.743
125 HG SER 20 HG SER 20 10.162 -0.244 2.324
126 H ASN 21 H ASN 21 8.580 -3.071 -1.541
127 HA ASN 21 HA ASN 21 6.820 -4.283 -2.540
128 1HB ASN 21 2HB ASN 21 7.335 -6.014 -0.097
129 2HB ASN 21 1HB ASN 21 6.628 -6.548 -1.620
130 1HD2 ASN 21 1HD2 ASN 21 8.174 -5.893 -3.625
131 2HD2 ASN 21 2HD2 ASN 21 9.816 -6.247 -3.387
132 H LEU 22 H LEU 22 5.625 -2.196 -1.417
133 HA LEU 22 HA LEU 22 3.387 -3.305 0.257
134 1HB LEU 22 2HB LEU 22 4.742 -0.592 0.206
135 2HB LEU 22 1HB LEU 22 3.262 -0.920 1.108
136 HG LEU 22 HG LEU 22 5.772 -2.566 1.470
137 1HD1 LEU 22 1HD1 LEU 22 6.333 -0.260 2.028
138 2HD1 LEU 22 2HD1 LEU 22 6.146 -1.184 3.518
139 3HD1 LEU 22 3HD1 LEU 22 4.860 -0.103 2.984
140 1HD2 LEU 22 1HD2 LEU 22 4.650 -3.076 3.652
141 2HD2 LEU 22 2HD2 LEU 22 3.708 -3.606 2.258
142 3HD2 LEU 22 3HD2 LEU 22 3.259 -2.133 3.117
143 H VAL 23 H VAL 23 1.337 -3.007 -0.545
144 HA VAL 23 HA VAL 23 0.951 -1.093 -2.822
145 HB VAL 23 HB VAL 23 -0.456 -2.847 -3.882
146 1HG1 VAL 23 1HG1 VAL 23 1.345 -4.216 -4.667
147 2HG1 VAL 23 2HG1 VAL 23 2.255 -3.991 -3.173
148 3HG1 VAL 23 3HG1 VAL 23 2.047 -2.643 -4.291
149 1HG2 VAL 23 1HG2 VAL 23 -1.136 -4.030 -1.822
150 2HG2 VAL 23 2HG2 VAL 23 0.525 -4.573 -1.582
151 3HG2 VAL 23 3HG2 VAL 23 -0.399 -5.148 -2.969
152 H CYS 24 H CYS 24 -1.126 -0.092 -2.861
153 HA CYS 24 HA CYS 24 -2.511 0.039 -0.297
154 1HB CYS 24 2HB CYS 24 -2.082 1.847 -2.137
155 2HB CYS 24 1HB CYS 24 -3.515 1.164 -2.907
156 H SER 25 H SER 25 -4.011 -1.437 0.315
157 HA SER 25 HA SER 25 -5.253 -3.274 -1.605
158 1HB SER 25 2HB SER 25 -5.493 -2.819 1.384
159 2HB SER 25 1HB SER 25 -6.282 -4.143 0.532
160 HG SER 25 HG SER 25 -4.405 -5.107 0.293
161 H ARG 26 H ARG 26 -7.659 -3.576 -1.609
162 HA ARG 26 HA ARG 26 -9.048 -0.945 -1.721
163 1HB ARG 26 2HB ARG 26 -9.435 -3.712 -2.836
164 2HB ARG 26 1HB ARG 26 -10.804 -2.601 -2.786
165 1HG ARG 26 2HG ARG 26 -9.912 -1.208 -4.370
166 2HG ARG 26 1HG ARG 26 -8.255 -1.495 -3.838
167 1HD ARG 26 2HD ARG 26 -7.963 -3.069 -5.440
168 2HD ARG 26 1HD ARG 26 -9.413 -3.941 -4.902
169 HE ARG 26 HE ARG 26 -9.626 -1.508 -6.636
170 1HH1 ARG 26 2HH1 ARG 26 -12.088 -2.896 -5.581
171 2HH1 ARG 26 1HH1 ARG 26 -12.522 -3.911 -6.916
172 1HH2 ARG 26 1HH2 ARG 26 -9.431 -3.629 -8.477
173 2HH2 ARG 26 2HH2 ARG 26 -11.014 -4.326 -8.559
174 H LYS 27 H LYS 27 -9.333 -4.152 -0.177
175 HA LYS 27 HA LYS 27 -11.801 -3.572 1.233
176 1HB LYS 27 2HB LYS 27 -9.733 -5.677 1.056
177 2HB LYS 27 1HB LYS 27 -10.528 -5.575 2.626
178 1HG LYS 27 2HG LYS 27 -12.681 -5.926 1.679
179 2HG LYS 27 1HG LYS 27 -12.096 -5.615 0.045
180 1HD LYS 27 2HD LYS 27 -11.992 -7.886 -0.099
181 2HD LYS 27 1HD LYS 27 -10.477 -7.689 0.781
182 1HE LYS 27 2HE LYS 27 -13.017 -7.847 2.375
183 2HE LYS 27 1HE LYS 27 -12.346 -9.343 1.698
184 1HZ LYS 27 1HZ LYS 27 -11.307 -9.002 3.795
185 2HZ LYS 27 2HZ LYS 27 -10.964 -7.376 3.443
186 3HZ LYS 27 3HZ LYS 27 -10.153 -8.619 2.613
187 H HIS 28 H HIS 28 -8.348 -3.548 2.186
188 HA HIS 28 HA HIS 28 -9.020 -2.425 4.846
189 1HB HIS 28 2HB HIS 28 -6.407 -3.185 3.500
190 2HB HIS 28 1HB HIS 28 -6.575 -2.728 5.194
191 HD1 HIS 28 HD1 HIS 28 -9.251 -4.308 5.737
192 HD2 HIS 28 HD2 HIS 28 -5.861 -5.905 3.911
193 HE1 HIS 28 HE1 HIS 28 -9.382 -6.816 6.053
194 H ARG 29 H ARG 29 -7.909 -1.321 1.715
195 HA ARG 29 HA ARG 29 -7.337 0.826 0.931
196 1HB ARG 29 2HB ARG 29 -9.528 1.081 2.376
197 2HB ARG 29 1HB ARG 29 -8.457 1.916 3.501
198 1HG ARG 29 2HG ARG 29 -7.747 3.437 1.685
199 2HG ARG 29 1HG ARG 29 -8.847 2.618 0.577
200 1HD ARG 29 2HD ARG 29 -10.680 3.681 1.431
201 2HD ARG 29 1HD ARG 29 -10.103 3.524 3.102
202 HE ARG 29 HE ARG 29 -8.523 5.383 1.474
203 1HH1 ARG 29 1HH2 ARG 29 -9.085 5.451 4.495
204 2HH1 ARG 29 2HH2 ARG 29 -10.085 6.860 4.607
205 1HH2 ARG 29 2HH1 ARG 29 -10.744 6.985 1.196
206 2HH2 ARG 29 1HH1 ARG 29 -11.027 7.733 2.732
207 H TRP 30 H TRP 30 -5.260 -0.559 2.265
208 HA TRP 30 HA TRP 30 -3.662 1.726 3.265
209 1HB TRP 30 2HB TRP 30 -3.207 0.741 5.381
210 2HB TRP 30 1HB TRP 30 -4.939 0.539 5.160
211 HD1 TRP 30 HD1 TRP 30 -4.302 -1.991 3.000
212 HE1 TRP 30 HE1 TRP 30 -3.844 -4.286 4.068
213 HE3 TRP 30 HE3 TRP 30 -3.115 -0.532 7.749
214 HZ2 TRP 30 HZ2 TRP 30 -3.079 -5.368 6.598
215 HZ3 TRP 30 HZ3 TRP 30 -2.529 -2.220 9.467
216 HH2 TRP 30 HH2 TRP 30 -2.508 -4.633 8.898
217 H CYS 31 H CYS 31 -1.306 0.770 3.788
218 HA CYS 31 HA CYS 31 -0.418 -0.548 1.328
219 1HB CYS 31 2HB CYS 31 0.965 0.413 3.851
220 2HB CYS 31 1HB CYS 31 1.826 -0.235 2.457
221 H LYS 32 H LYS 32 -0.316 -2.727 1.097
222 HA LYS 32 HA LYS 32 -0.070 -4.434 3.554
223 1HB LYS 32 2HB LYS 32 -2.212 -4.477 2.201
224 2HB LYS 32 1HB LYS 32 -1.271 -5.109 0.850
225 1HG LYS 32 2HG LYS 32 -0.744 -7.111 2.007
226 2HG LYS 32 1HG LYS 32 -1.225 -6.433 3.562
227 1HD LYS 32 2HD LYS 32 -3.493 -6.668 3.124
228 2HD LYS 32 1HD LYS 32 -3.267 -6.601 1.376
229 1HE LYS 32 2HE LYS 32 -3.724 -8.886 1.726
230 2HE LYS 32 1HE LYS 32 -1.949 -8.863 1.752
231 1HZ LYS 32 1HZ LYS 32 -2.866 -10.005 3.701
232 2HZ LYS 32 2HZ LYS 32 -3.701 -8.593 4.143
233 3HZ LYS 32 3HZ LYS 32 -2.001 -8.616 4.146
234 H TYR 33 H TYR 33 1.608 -5.931 3.576
235 HA TYR 33 HA TYR 33 3.747 -5.679 1.619
236 1HB TYR 33 2HB TYR 33 3.591 -6.343 4.231
237 2HB TYR 33 1HB TYR 33 3.617 -7.962 3.535
238 HD1 TYR 33 HD1 TYR 33 5.615 -5.219 4.578
239 HD2 TYR 33 HD2 TYR 33 5.436 -8.378 1.671
240 HE1 TYR 33 HE1 TYR 33 8.061 -5.025 4.215
241 HE2 TYR 33 HE2 TYR 33 7.880 -8.184 1.310
242 HH TYR 33 HH TYR 33 9.928 -7.089 3.141
243 H GLU 34 H GLU 34 3.964 -6.860 -0.244
244 HA GLU 34 HA GLU 34 2.118 -9.174 -0.681
245 1HB GLU 34 2HB GLU 34 3.777 -7.544 -2.637
246 2HB GLU 34 1HB GLU 34 2.510 -8.697 -3.050
247 1HG GLU 34 2HG GLU 34 2.157 -6.081 -1.555
248 2HG GLU 34 1HG GLU 34 1.593 -6.445 -3.184
249 H ILE 35 H ILE 35 3.021 -11.092 -1.771
250 HA ILE 35 HA ILE 35 5.588 -11.914 -0.663
251 HB ILE 35 HB ILE 35 3.655 -13.159 -2.653
252 1HG1 ILE 35 1HG1 ILE 35 4.085 -14.149 0.137
253 2HG1 ILE 35 2HG1 ILE 35 3.159 -12.663 -0.067
254 1HG2 ILE 35 1HG2 ILE 35 6.073 -14.321 -1.236
255 2HG2 ILE 35 2HG2 ILE 35 4.848 -15.295 -2.048
256 3HG2 ILE 35 3HG2 ILE 35 5.837 -14.169 -2.977
257 1HD1 ILE 35 1HD1 ILE 35 2.570 -15.275 -1.491
258 2HD1 ILE 35 2HD1 ILE 35 1.706 -14.685 -0.071
259 3HD1 ILE 35 3HD1 ILE 35 1.616 -13.795 -1.591
260 1HN NH2 36 1HN NH2 36 6.123 -9.971 -4.007
261 2HN NH2 36 2HN NH2 36 4.865 -9.851 -2.758
Start of MODEL 3
1 1H GLU 1 1H GLU 1 10.719 8.761 -3.255
2 2H GLU 1 2H GLU 1 9.775 7.769 -4.261
3 3H GLU 1 3H GLU 1 10.401 7.157 -2.806
4 HA GLU 1 HA GLU 1 9.027 8.770 -1.557
5 1HB GLU 1 2HB GLU 1 8.436 9.458 -4.419
6 2HB GLU 1 1HB GLU 1 7.171 9.705 -3.217
7 1HG GLU 1 2HG GLU 1 8.169 11.696 -2.813
8 2HG GLU 1 1HG GLU 1 9.400 10.758 -1.966
9 H CYS 2 H CYS 2 8.053 7.024 -0.557
10 HA CYS 2 HA CYS 2 5.852 5.644 -2.027
11 1HB CYS 2 2HB CYS 2 6.747 3.474 -1.450
12 2HB CYS 2 1HB CYS 2 8.053 4.389 -2.198
13 H LEU 3 H LEU 3 4.814 4.016 -0.259
14 HA LEU 3 HA LEU 3 4.386 5.653 2.217
15 1HB LEU 3 2HB LEU 3 2.660 3.667 0.701
16 2HB LEU 3 1HB LEU 3 2.182 4.422 2.222
17 HG LEU 3 HG LEU 3 2.997 6.030 -0.209
18 1HD1 LEU 3 1HD1 LEU 3 0.668 6.269 -0.770
19 2HD1 LEU 3 2HD1 LEU 3 0.170 5.395 0.678
20 3HD1 LEU 3 3HD1 LEU 3 0.988 4.540 -0.631
21 1HD2 LEU 3 1HD2 LEU 3 3.103 7.355 1.761
22 2HD2 LEU 3 2HD2 LEU 3 1.653 6.611 2.436
23 3HD2 LEU 3 3HD2 LEU 3 1.521 7.719 1.070
24 H GLY 4 H GLY 4 4.483 4.602 4.244
25 1HA GLY 4 2HA GLY 4 6.106 2.193 4.382
26 2HA GLY 4 1HA GLY 4 5.419 3.056 5.758
27 H PHE 5 H PHE 5 5.222 0.491 6.154
28 HA PHE 5 HA PHE 5 2.955 -0.835 4.900
29 1HB PHE 5 2HB PHE 5 4.770 -2.132 5.798
30 2HB PHE 5 1HB PHE 5 4.656 -1.325 7.361
31 HD1 PHE 5 HD1 PHE 5 2.541 -3.340 4.994
32 HD2 PHE 5 HD2 PHE 5 3.463 -2.365 9.076
33 HE1 PHE 5 HE1 PHE 5 0.925 -5.052 5.770
34 HE2 PHE 5 HE2 PHE 5 1.847 -4.079 9.849
35 HZ PHE 5 HZ PHE 5 0.578 -5.422 8.196
36 H GLY 6 H GLY 6 0.828 -0.815 5.551
37 1HA GLY 6 2HA GLY 6 -1.090 -0.327 6.806
38 2HA GLY 6 1HA GLY 6 -0.051 -0.198 8.224
39 H LYS 7 H LYS 7 0.156 1.722 5.233
40 HA LYS 7 HA LYS 7 -0.417 4.169 6.879
41 1HB LYS 7 2HB LYS 7 1.498 3.570 4.614
42 2HB LYS 7 1HB LYS 7 1.087 5.226 5.060
43 1HG LYS 7 2HG LYS 7 2.027 3.247 7.135
44 2HG LYS 7 1HG LYS 7 3.179 4.165 6.165
45 1HD LYS 7 2HD LYS 7 2.633 6.171 7.154
46 2HD LYS 7 1HD LYS 7 0.958 5.695 7.439
47 1HE LYS 7 2HE LYS 7 1.652 4.234 9.288
48 2HE LYS 7 1HE LYS 7 3.355 4.629 8.981
49 1HZ LYS 7 1HZ LYS 7 2.446 6.067 10.700
50 2HZ LYS 7 2HZ LYS 7 1.211 6.581 9.653
51 3HZ LYS 7 3HZ LYS 7 2.831 6.973 9.319
52 H GLY 8 H GLY 8 -1.674 5.821 5.841
53 1HA GLY 8 2HA GLY 8 -3.861 5.023 4.270
54 2HA GLY 8 1HA GLY 8 -3.297 6.691 4.382
55 H CYS 9 H CYS 9 -3.986 4.386 2.182
56 HA CYS 9 HA CYS 9 -2.213 5.624 0.140
57 1HB CYS 9 2HB CYS 9 -0.889 3.772 0.842
58 2HB CYS 9 1HB CYS 9 -2.296 2.723 0.996
59 H ASN 10 H ASN 10 -3.172 5.607 -1.925
60 HA ASN 10 HA ASN 10 -6.031 4.833 -2.035
61 1HB ASN 10 2HB ASN 10 -4.233 6.763 -3.238
62 2HB ASN 10 1HB ASN 10 -5.109 5.893 -4.496
63 1HD2 ASN 10 1HD2 ASN 10 -5.351 8.570 -2.483
64 2HD2 ASN 10 2HD2 ASN 10 -7.040 8.734 -2.464
65 HA PRO 11 HA PRO 11 -5.049 1.017 -4.080
66 1HB PRO 11 2HB PRO 11 -7.525 0.502 -5.146
67 2HB PRO 11 1HB PRO 11 -7.128 0.251 -3.434
68 1HG PRO 11 2HG PRO 11 -8.551 2.527 -4.731
69 2HG PRO 11 1HG PRO 11 -8.898 1.705 -3.201
70 1HD PRO 11 2HD PRO 11 -7.639 4.097 -3.312
71 2HD PRO 11 1HD PRO 11 -7.310 2.899 -2.041
72 H SER 12 H SER 12 -6.697 3.656 -5.807
73 HA SER 12 HA SER 12 -6.176 2.640 -8.478
74 1HB SER 12 2HB SER 12 -7.954 4.276 -7.804
75 2HB SER 12 1HB SER 12 -6.693 5.463 -7.485
76 HG SER 12 HG SER 12 -7.695 4.503 -9.881
77 H ASN 13 H ASN 13 -4.535 4.978 -6.328
78 HA ASN 13 HA ASN 13 -2.433 5.568 -8.285
79 1HB ASN 13 2HB ASN 13 -3.133 6.303 -5.457
80 2HB ASN 13 1HB ASN 13 -1.516 6.666 -6.059
81 1HD2 ASN 13 1HD2 ASN 13 -1.304 8.570 -7.285
82 2HD2 ASN 13 2HD2 ASN 13 -2.608 9.445 -7.929
83 H ASP 14 H ASP 14 -2.699 3.681 -5.278
84 HA ASP 14 HA ASP 14 -1.291 2.047 -4.331
85 1HB ASP 14 2HB ASP 14 -1.676 1.604 -7.103
86 2HB ASP 14 1HB ASP 14 0.022 1.254 -6.784
87 H GLN 15 H GLN 15 -0.043 3.991 -3.434
88 HA GLN 15 HA GLN 15 2.629 4.353 -4.728
89 1HB GLN 15 2HB GLN 15 0.859 5.907 -2.868
90 2HB GLN 15 1HB GLN 15 2.594 6.227 -2.853
91 1HG GLN 15 2HG GLN 15 2.562 6.675 -5.261
92 2HG GLN 15 1HG GLN 15 0.842 6.288 -5.329
93 1HE2 GLN 15 1HE2 GLN 15 -0.660 7.910 -4.651
94 2HE2 GLN 15 2HE2 GLN 15 -0.182 9.456 -4.137
95 H CYS 16 H CYS 16 1.811 1.952 -3.030
96 HA CYS 16 HA CYS 16 3.104 2.184 -0.451
97 1HB CYS 16 2HB CYS 16 2.278 -0.103 -2.258
98 2HB CYS 16 1HB CYS 16 2.996 -0.373 -0.671
99 H CYS 17 H CYS 17 5.172 1.220 0.150
100 HA CYS 17 HA CYS 17 7.290 1.701 -1.789
101 1HB CYS 17 2HB CYS 17 6.989 1.647 0.968
102 2HB CYS 17 1HB CYS 17 7.963 0.212 0.652
103 H LYS 18 H LYS 18 7.669 0.239 -3.401
104 HA LYS 18 HA LYS 18 6.902 -2.551 -3.298
105 1HB LYS 18 2HB LYS 18 8.585 -0.801 -5.095
106 2HB LYS 18 1HB LYS 18 8.432 -2.531 -5.402
107 1HG LYS 18 2HG LYS 18 5.976 -0.845 -4.961
108 2HG LYS 18 1HG LYS 18 6.742 -0.906 -6.548
109 1HD LYS 18 2HD LYS 18 6.624 -3.445 -6.375
110 2HD LYS 18 1HD LYS 18 5.588 -3.212 -4.966
111 1HE LYS 18 2HE LYS 18 4.244 -1.611 -6.595
112 2HE LYS 18 1HE LYS 18 5.020 -2.597 -7.850
113 1HZ LYS 18 1HZ LYS 18 4.275 -4.591 -6.666
114 2HZ LYS 18 2HZ LYS 18 2.960 -3.628 -7.147
115 3HZ LYS 18 3HZ LYS 18 3.471 -3.623 -5.527
116 H SER 19 H SER 19 9.895 -0.804 -2.570
117 HA SER 19 HA SER 19 11.750 -2.966 -2.586
118 1HB SER 19 2HB SER 19 11.505 -0.386 -1.029
119 2HB SER 19 1HB SER 19 12.908 -1.436 -0.869
120 HG SER 19 HG SER 19 12.216 0.274 -2.872
121 H SER 20 H SER 20 9.405 -1.921 -0.128
122 HA SER 20 HA SER 20 10.361 -4.036 1.748
123 1HB SER 20 2HB SER 20 8.636 -1.571 1.906
124 2HB SER 20 1HB SER 20 8.574 -2.778 3.187
125 HG SER 20 HG SER 20 10.651 -1.080 2.400
126 H ASN 21 H ASN 21 8.664 -4.428 -0.833
127 HA ASN 21 HA ASN 21 6.820 -5.723 -1.515
128 1HB ASN 21 2HB ASN 21 8.238 -7.269 -0.106
129 2HB ASN 21 1HB ASN 21 7.188 -6.895 1.260
130 1HD2 ASN 21 1HD2 ASN 21 7.163 -8.332 -2.027
131 2HD2 ASN 21 2HD2 ASN 21 5.762 -9.258 -1.780
132 H LEU 22 H LEU 22 5.566 -3.584 -1.225
133 HA LEU 22 HA LEU 22 3.404 -3.981 0.821
134 1HB LEU 22 2HB LEU 22 4.921 -1.503 -0.026
135 2HB LEU 22 1HB LEU 22 3.390 -1.413 0.842
136 HG LEU 22 HG LEU 22 5.708 -3.055 1.870
137 1HD1 LEU 22 1HD1 LEU 22 6.638 -0.872 1.783
138 2HD1 LEU 22 2HD1 LEU 22 6.023 -1.028 3.429
139 3HD1 LEU 22 3HD1 LEU 22 5.108 -0.116 2.228
140 1HD2 LEU 22 1HD2 LEU 22 4.511 -2.827 3.996
141 2HD2 LEU 22 2HD2 LEU 22 3.418 -3.469 2.771
142 3HD2 LEU 22 3HD2 LEU 22 3.321 -1.771 3.237
143 H VAL 23 H VAL 23 1.358 -3.886 -0.014
144 HA VAL 23 HA VAL 23 0.988 -2.768 -2.776
145 HB VAL 23 HB VAL 23 -0.702 -4.659 -3.028
146 1HG1 VAL 23 1HG1 VAL 23 1.625 -4.713 -3.961
147 2HG1 VAL 23 2HG1 VAL 23 0.990 -6.313 -3.575
148 3HG1 VAL 23 3HG1 VAL 23 2.149 -5.540 -2.495
149 1HG2 VAL 23 1HG2 VAL 23 -0.720 -6.466 -1.485
150 2HG2 VAL 23 2HG2 VAL 23 -0.769 -5.024 -0.471
151 3HG2 VAL 23 3HG2 VAL 23 0.745 -5.903 -0.682
152 H CYS 24 H CYS 24 -0.825 -1.446 -3.001
153 HA CYS 24 HA CYS 24 -2.141 -0.497 -0.590
154 1HB CYS 24 2HB CYS 24 -1.522 0.615 -2.925
155 2HB CYS 24 1HB CYS 24 -3.149 0.077 -3.348
156 H SER 25 H SER 25 -4.348 -0.738 -0.018
157 HA SER 25 HA SER 25 -5.742 -3.077 -1.279
158 1HB SER 25 2HB SER 25 -4.905 -2.640 1.308
159 2HB SER 25 1HB SER 25 -6.584 -2.110 1.380
160 HG SER 25 HG SER 25 -7.167 -4.118 1.231
161 H ARG 26 H ARG 26 -8.181 -2.910 -1.177
162 HA ARG 26 HA ARG 26 -9.058 -0.163 -1.934
163 1HB ARG 26 2HB ARG 26 -9.618 -2.906 -2.706
164 2HB ARG 26 1HB ARG 26 -11.113 -2.059 -2.307
165 1HG ARG 26 2HG ARG 26 -10.634 -0.306 -3.886
166 2HG ARG 26 1HG ARG 26 -9.002 -0.919 -4.156
167 1HD ARG 26 2HD ARG 26 -11.197 -2.869 -4.640
168 2HD ARG 26 1HD ARG 26 -11.072 -1.531 -5.799
169 HE ARG 26 HE ARG 26 -9.004 -2.425 -6.523
170 1HH1 ARG 26 1HH2 ARG 26 -10.113 -5.067 -5.376
171 2HH1 ARG 26 2HH2 ARG 26 -8.750 -5.611 -4.456
172 1HH2 ARG 26 2HH1 ARG 26 -7.151 -2.526 -4.500
173 2HH2 ARG 26 1HH1 ARG 26 -7.069 -4.169 -3.958
174 H LYS 27 H LYS 27 -10.080 -2.886 0.169
175 HA LYS 27 HA LYS 27 -12.209 -1.370 1.457
176 1HB LYS 27 2HB LYS 27 -10.996 -4.044 1.502
177 2HB LYS 27 1HB LYS 27 -11.526 -3.511 3.097
178 1HG LYS 27 2HG LYS 27 -13.479 -2.875 1.015
179 2HG LYS 27 1HG LYS 27 -13.153 -4.605 1.123
180 1HD LYS 27 2HD LYS 27 -13.345 -3.595 3.787
181 2HD LYS 27 1HD LYS 27 -14.733 -2.991 2.882
182 1HE LYS 27 2HE LYS 27 -15.108 -5.373 2.061
183 2HE LYS 27 1HE LYS 27 -13.893 -5.883 3.249
184 1HZ LYS 27 1HZ LYS 27 -16.172 -5.906 4.158
185 2HZ LYS 27 2HZ LYS 27 -16.285 -4.233 3.884
186 3HZ LYS 27 3HZ LYS 27 -15.150 -4.841 4.994
187 H HIS 28 H HIS 28 -8.824 -2.136 2.253
188 HA HIS 28 HA HIS 28 -9.008 -0.740 4.858
189 1HB HIS 28 2HB HIS 28 -6.749 -2.103 3.353
190 2HB HIS 28 1HB HIS 28 -6.627 -1.489 5.002
191 HD1 HIS 28 HD1 HIS 28 -9.016 -2.450 6.420
192 HD2 HIS 28 HD2 HIS 28 -7.180 -4.817 3.520
193 HE1 HIS 28 HE1 HIS 28 -9.729 -4.835 6.885
194 H ARG 29 H ARG 29 -8.026 -0.069 1.568
195 HA ARG 29 HA ARG 29 -7.073 1.834 0.559
196 1HB ARG 29 2HB ARG 29 -8.529 2.834 3.007
197 2HB ARG 29 1HB ARG 29 -7.702 3.962 1.933
198 1HG ARG 29 2HG ARG 29 -9.060 3.357 0.076
199 2HG ARG 29 1HG ARG 29 -9.663 1.914 0.890
200 1HD ARG 29 2HD ARG 29 -11.450 3.467 1.103
201 2HD ARG 29 1HD ARG 29 -10.611 3.592 2.662
202 HE ARG 29 HE ARG 29 -9.581 5.657 1.901
203 1HH1 ARG 29 1HH2 ARG 29 -12.408 6.277 1.233
204 2HH1 ARG 29 2HH2 ARG 29 -12.308 6.779 -0.422
205 1HH2 ARG 29 2HH1 ARG 29 -9.150 5.416 -0.921
206 2HH2 ARG 29 1HH1 ARG 29 -10.459 6.290 -1.644
207 H TRP 30 H TRP 30 -5.198 0.313 2.051
208 HA TRP 30 HA TRP 30 -3.269 2.445 2.757
209 1HB TRP 30 2HB TRP 30 -2.920 1.660 4.986
210 2HB TRP 30 1HB TRP 30 -4.662 1.772 4.787
211 HD1 TRP 30 HD1 TRP 30 -4.380 -1.138 2.947
212 HE1 TRP 30 HE1 TRP 30 -4.417 -3.297 4.348
213 HE3 TRP 30 HE3 TRP 30 -3.284 0.782 7.546
214 HZ2 TRP 30 HZ2 TRP 30 -4.040 -4.106 7.064
215 HZ3 TRP 30 HZ3 TRP 30 -3.131 -0.704 9.523
216 HH2 TRP 30 HH2 TRP 30 -3.507 -3.143 9.289
217 H CYS 31 H CYS 31 -1.114 1.123 3.559
218 HA CYS 31 HA CYS 31 -0.475 -0.660 1.287
219 1HB CYS 31 2HB CYS 31 1.062 0.722 3.493
220 2HB CYS 31 1HB CYS 31 1.838 -0.457 2.436
221 H LYS 32 H LYS 32 -0.157 -2.863 1.489
222 HA LYS 32 HA LYS 32 -0.158 -4.048 4.240
223 1HB LYS 32 2HB LYS 32 -2.377 -3.971 2.822
224 2HB LYS 32 1HB LYS 32 -1.627 -5.295 1.930
225 1HG LYS 32 2HG LYS 32 -1.600 -6.711 3.791
226 2HG LYS 32 1HG LYS 32 -1.714 -5.372 4.933
227 1HD LYS 32 2HD LYS 32 -3.945 -5.659 4.999
228 2HD LYS 32 1HD LYS 32 -4.022 -5.228 3.290
229 1HE LYS 32 2HE LYS 32 -3.912 -7.493 2.592
230 2HE LYS 32 1HE LYS 32 -3.312 -8.037 4.170
231 1HZ LYS 32 1HZ LYS 32 -5.403 -7.311 5.167
232 2HZ LYS 32 2HZ LYS 32 -5.680 -8.480 3.966
233 3HZ LYS 32 3HZ LYS 32 -5.984 -6.840 3.644
234 H TYR 33 H TYR 33 0.738 -6.279 4.255
235 HA TYR 33 HA TYR 33 3.004 -6.552 2.383
236 1HB TYR 33 2HB TYR 33 2.976 -6.891 4.939
237 2HB TYR 33 1HB TYR 33 2.156 -8.417 4.612
238 HD1 TYR 33 HD1 TYR 33 5.232 -6.458 3.786
239 HD2 TYR 33 HD2 TYR 33 3.375 -10.328 3.954
240 HE1 TYR 33 HE1 TYR 33 7.411 -7.528 3.276
241 HE2 TYR 33 HE2 TYR 33 5.552 -11.396 3.443
242 HH TYR 33 HH TYR 33 8.243 -10.376 3.872
243 H GLU 34 H GLU 34 3.271 -8.324 0.949
244 HA GLU 34 HA GLU 34 0.822 -9.488 -0.128
245 1HB GLU 34 2HB GLU 34 3.785 -9.836 -0.671
246 2HB GLU 34 1HB GLU 34 2.529 -10.611 -1.636
247 1HG GLU 34 2HG GLU 34 1.549 -8.186 -1.829
248 2HG GLU 34 1HG GLU 34 3.181 -7.686 -1.384
249 H ILE 35 H ILE 35 0.913 -11.983 -0.615
250 HA ILE 35 HA ILE 35 0.870 -13.398 1.915
251 HB ILE 35 HB ILE 35 0.317 -15.327 0.421
252 1HG1 ILE 35 1HG1 ILE 35 0.392 -13.472 -1.933
253 2HG1 ILE 35 2HG1 ILE 35 1.889 -14.258 -1.436
254 1HG2 ILE 35 1HG2 ILE 35 -1.327 -13.475 1.126
255 2HG2 ILE 35 2HG2 ILE 35 -1.154 -12.866 -0.520
256 3HG2 ILE 35 3HG2 ILE 35 -1.795 -14.485 -0.241
257 1HD1 ILE 35 1HD1 ILE 35 0.494 -16.444 -1.423
258 2HD1 ILE 35 2HD1 ILE 35 -0.674 -15.531 -2.377
259 3HD1 ILE 35 3HD1 ILE 35 0.963 -15.773 -2.986
260 1HN NH2 36 1HN NH2 36 4.063 -14.301 2.423
261 2HN NH2 36 2HN NH2 36 2.549 -13.498 2.893
Start of MODEL 4
1 1H GLU 1 1H GLU 1 -11.078 7.142 -3.808
2 2H GLU 1 2H GLU 1 -11.473 5.521 -4.128
3 3H GLU 1 3H GLU 1 -12.077 6.756 -5.125
4 HA GLU 1 HA GLU 1 -10.232 5.584 -6.203
5 1HB GLU 1 2HB GLU 1 -10.838 8.075 -6.404
6 2HB GLU 1 1HB GLU 1 -9.467 8.385 -5.339
7 1HG GLU 1 2HG GLU 1 -8.493 8.575 -7.461
8 2HG GLU 1 1HG GLU 1 -8.140 6.899 -7.040
9 H CYS 2 H CYS 2 -8.918 4.049 -5.201
10 HA CYS 2 HA CYS 2 -6.618 5.101 -3.618
11 1HB CYS 2 2HB CYS 2 -7.002 3.229 -1.985
12 2HB CYS 2 1HB CYS 2 -8.300 4.419 -1.995
13 H LEU 3 H LEU 3 -4.894 3.364 -3.397
14 HA LEU 3 HA LEU 3 -4.558 1.973 -5.980
15 1HB LEU 3 2HB LEU 3 -2.788 2.250 -3.525
16 2HB LEU 3 1HB LEU 3 -2.271 1.608 -5.082
17 HG LEU 3 HG LEU 3 -3.417 4.391 -4.716
18 1HD1 LEU 3 1HD1 LEU 3 -1.023 5.116 -5.031
19 2HD1 LEU 3 2HD1 LEU 3 -0.545 3.432 -4.816
20 3HD1 LEU 3 3HD1 LEU 3 -1.332 4.301 -3.498
21 1HD2 LEU 3 1HD2 LEU 3 -2.220 4.672 -6.964
22 2HD2 LEU 3 2HD2 LEU 3 -3.667 3.665 -6.980
23 3HD2 LEU 3 3HD2 LEU 3 -2.072 2.915 -6.991
24 H GLY 4 H GLY 4 -4.386 -0.298 -6.197
25 1HA GLY 4 2HA GLY 4 -5.688 -1.869 -4.071
26 2HA GLY 4 1HA GLY 4 -5.274 -2.451 -5.683
27 H PHE 5 H PHE 5 -4.560 -4.300 -4.110
28 HA PHE 5 HA PHE 5 -2.090 -3.956 -2.616
29 1HB PHE 5 2HB PHE 5 -3.624 -5.690 -1.994
30 2HB PHE 5 1HB PHE 5 -3.705 -6.305 -3.643
31 HD1 PHE 5 HD1 PHE 5 -2.374 -8.126 -4.239
32 HD2 PHE 5 HD2 PHE 5 -1.200 -5.671 -0.913
33 HE1 PHE 5 HE1 PHE 5 -0.488 -9.664 -3.770
34 HE2 PHE 5 HE2 PHE 5 0.686 -7.212 -0.446
35 HZ PHE 5 HZ PHE 5 1.042 -9.207 -1.873
36 H GLY 6 H GLY 6 0.025 -4.507 -3.267
37 1HA GLY 6 2HA GLY 6 1.798 -5.010 -4.721
38 2HA GLY 6 1HA GLY 6 0.631 -5.792 -5.787
39 H LYS 7 H LYS 7 0.631 -2.416 -4.673
40 HA LYS 7 HA LYS 7 0.956 -1.552 -7.528
41 1HB LYS 7 2HB LYS 7 -1.338 -1.352 -6.504
42 2HB LYS 7 1HB LYS 7 -0.653 -0.259 -5.301
43 1HG LYS 7 2HG LYS 7 -1.521 1.176 -6.973
44 2HG LYS 7 1HG LYS 7 0.210 1.117 -7.302
45 1HD LYS 7 2HD LYS 7 -0.877 -1.065 -8.702
46 2HD LYS 7 1HD LYS 7 -1.996 0.268 -8.982
47 1HE LYS 7 2HE LYS 7 -0.045 1.711 -9.633
48 2HE LYS 7 1HE LYS 7 1.000 0.283 -9.494
49 1HZ LYS 7 1HZ LYS 7 0.208 0.504 -11.758
50 2HZ LYS 7 2HZ LYS 7 -1.405 0.534 -11.228
51 3HZ LYS 7 3HZ LYS 7 -0.475 -0.877 -11.048
52 H GLY 8 H GLY 8 2.564 -0.040 -7.875
53 1HA GLY 8 2HA GLY 8 4.450 0.608 -5.813
54 2HA GLY 8 1HA GLY 8 4.398 1.350 -7.412
55 H CYS 9 H CYS 9 3.938 1.924 -4.128
56 HA CYS 9 HA CYS 9 2.548 4.512 -4.729
57 1HB CYS 9 2HB CYS 9 1.195 4.177 -2.733
58 2HB CYS 9 1HB CYS 9 1.045 2.747 -3.753
59 H ASN 10 H ASN 10 2.795 5.984 -2.643
60 HA ASN 10 HA ASN 10 5.691 6.059 -2.011
61 1HB ASN 10 2HB ASN 10 3.415 7.900 -2.227
62 2HB ASN 10 1HB ASN 10 4.433 8.232 -0.826
63 1HD2 ASN 10 1HD2 ASN 10 4.119 8.965 -4.082
64 2HD2 ASN 10 2HD2 ASN 10 5.729 9.385 -4.417
65 HA PRO 11 HA PRO 11 5.032 4.347 2.023
66 1HB PRO 11 2HB PRO 11 7.379 5.172 3.178
67 2HB PRO 11 1HB PRO 11 7.280 3.814 2.040
68 1HG PRO 11 2HG PRO 11 8.139 6.625 1.560
69 2HG PRO 11 1HG PRO 11 8.804 5.116 0.916
70 1HD PRO 11 2HD PRO 11 7.168 6.749 -0.515
71 2HD PRO 11 1HD PRO 11 7.247 4.990 -0.763
72 H SER 12 H SER 12 6.248 7.712 1.786
73 HA SER 12 HA SER 12 5.191 8.497 4.394
74 1HB SER 12 2HB SER 12 7.156 9.464 3.002
75 2HB SER 12 1HB SER 12 5.915 10.302 2.075
76 HG SER 12 HG SER 12 6.878 10.795 4.584
77 H ASN 13 H ASN 13 4.239 9.082 0.993
78 HA ASN 13 HA ASN 13 1.597 10.128 1.899
79 1HB ASN 13 2HB ASN 13 3.158 11.299 0.232
80 2HB ASN 13 1HB ASN 13 2.765 10.003 -0.897
81 1HD2 ASN 13 1HD2 ASN 13 0.800 10.188 -2.050
82 2HD2 ASN 13 2HD2 ASN 13 -0.376 11.371 -1.737
83 H ASP 14 H ASP 14 1.439 7.603 2.511
84 HA ASP 14 HA ASP 14 0.990 5.674 0.434
85 1HB ASP 14 2HB ASP 14 -0.006 4.371 2.278
86 2HB ASP 14 1HB ASP 14 1.469 5.170 2.816
87 H GLN 15 H GLN 15 -0.780 5.335 -0.853
88 HA GLN 15 HA GLN 15 -3.363 6.667 -0.127
89 1HB GLN 15 2HB GLN 15 -1.730 7.739 -1.906
90 2HB GLN 15 1HB GLN 15 -2.373 6.479 -2.960
91 1HG GLN 15 2HG GLN 15 -4.612 7.559 -1.645
92 2HG GLN 15 1HG GLN 15 -3.622 8.947 -2.098
93 1HE2 GLN 15 1HE2 GLN 15 -3.062 9.166 -4.444
94 2HE2 GLN 15 2HE2 GLN 15 -4.047 8.431 -5.615
95 H CYS 16 H CYS 16 -2.635 3.868 0.261
96 HA CYS 16 HA CYS 16 -3.791 2.326 -1.959
97 1HB CYS 16 2HB CYS 16 -1.962 1.833 -0.023
98 2HB CYS 16 1HB CYS 16 -3.397 1.145 0.740
99 H CYS 17 H CYS 17 -5.559 0.649 -1.286
100 HA CYS 17 HA CYS 17 -7.914 2.125 -0.390
101 1HB CYS 17 2HB CYS 17 -7.444 -0.806 -1.038
102 2HB CYS 17 1HB CYS 17 -9.024 -0.042 -0.876
103 H LYS 18 H LYS 18 -8.406 2.393 1.739
104 HA LYS 18 HA LYS 18 -7.095 0.941 3.877
105 1HB LYS 18 2HB LYS 18 -8.571 2.309 5.288
106 2HB LYS 18 1HB LYS 18 -7.902 3.291 3.986
107 1HG LYS 18 2HG LYS 18 -10.059 3.895 3.604
108 2HG LYS 18 1HG LYS 18 -10.201 2.319 2.828
109 1HD LYS 18 2HD LYS 18 -10.572 1.615 5.431
110 2HD LYS 18 1HD LYS 18 -11.255 3.241 5.439
111 1HE LYS 18 2HE LYS 18 -12.053 1.586 3.114
112 2HE LYS 18 1HE LYS 18 -12.669 1.028 4.682
113 1HZ LYS 18 1HZ LYS 18 -12.837 3.812 3.646
114 2HZ LYS 18 2HZ LYS 18 -13.406 3.282 5.158
115 3HZ LYS 18 3HZ LYS 18 -14.127 2.714 3.730
116 H SER 19 H SER 19 -10.050 0.404 2.065
117 HA SER 19 HA SER 19 -11.506 -1.172 3.961
118 1HB SER 19 2HB SER 19 -12.731 -1.887 1.956
119 2HB SER 19 1HB SER 19 -12.373 -0.167 1.857
120 HG SER 19 HG SER 19 -11.696 -0.894 -0.058
121 H SER 20 H SER 20 -8.927 -2.030 1.656
122 HA SER 20 HA SER 20 -9.151 -4.904 2.392
123 1HB SER 20 2HB SER 20 -8.226 -3.294 0.159
124 2HB SER 20 1HB SER 20 -6.988 -4.449 0.645
125 HG SER 20 HG SER 20 -8.382 -5.443 -0.796
126 H ASN 21 H ASN 21 -7.925 -2.479 4.070
127 HA ASN 21 HA ASN 21 -6.116 -2.175 5.546
128 1HB ASN 21 2HB ASN 21 -7.136 -4.798 5.642
129 2HB ASN 21 1HB ASN 21 -5.383 -4.987 5.672
130 1HD2 ASN 21 1HD2 ASN 21 -8.092 -3.344 7.347
131 2HD2 ASN 21 2HD2 ASN 21 -7.258 -3.122 8.809
132 H LEU 22 H LEU 22 -5.269 -1.567 3.042
133 HA LEU 22 HA LEU 22 -2.764 -3.116 2.536
134 1HB LEU 22 2HB LEU 22 -4.377 -1.103 0.942
135 2HB LEU 22 1HB LEU 22 -2.848 -1.782 0.386
136 HG LEU 22 HG LEU 22 -5.170 -3.529 1.220
137 1HD1 LEU 22 1HD1 LEU 22 -4.473 -2.608 -1.585
138 2HD1 LEU 22 2HD1 LEU 22 -5.836 -2.000 -0.646
139 3HD1 LEU 22 3HD1 LEU 22 -5.786 -3.694 -1.132
140 1HD2 LEU 22 1HD2 LEU 22 -3.014 -4.649 1.139
141 2HD2 LEU 22 2HD2 LEU 22 -2.663 -3.946 -0.440
142 3HD2 LEU 22 3HD2 LEU 22 -3.946 -5.144 -0.273
143 H VAL 23 H VAL 23 -0.755 -2.140 2.778
144 HA VAL 23 HA VAL 23 -0.695 0.772 3.505
145 HB VAL 23 HB VAL 23 0.973 0.155 5.250
146 1HG1 VAL 23 1HG1 VAL 23 -1.531 -1.516 5.570
147 2HG1 VAL 23 2HG1 VAL 23 -1.535 0.243 5.690
148 3HG1 VAL 23 3HG1 VAL 23 -0.596 -0.716 6.834
149 1HG2 VAL 23 1HG2 VAL 23 1.759 -1.936 4.109
150 2HG2 VAL 23 2HG2 VAL 23 0.237 -2.707 4.553
151 3HG2 VAL 23 3HG2 VAL 23 1.360 -2.185 5.808
152 H CYS 24 H CYS 24 1.199 1.882 2.824
153 HA CYS 24 HA CYS 24 2.589 0.731 0.526
154 1HB CYS 24 2HB CYS 24 2.608 3.323 2.066
155 2HB CYS 24 1HB CYS 24 3.823 3.021 0.823
156 H SER 25 H SER 25 3.959 -0.953 1.162
157 HA SER 25 HA SER 25 5.628 -0.883 3.534
158 1HB SER 25 2HB SER 25 4.742 -2.904 2.313
159 2HB SER 25 1HB SER 25 5.872 -2.551 1.009
160 HG SER 25 HG SER 25 7.308 -3.544 2.163
161 H ARG 26 H ARG 26 7.965 -0.707 3.570
162 HA ARG 26 HA ARG 26 9.028 1.220 1.579
163 1HB ARG 26 2HB ARG 26 9.786 0.201 4.310
164 2HB ARG 26 1HB ARG 26 10.971 1.074 3.337
165 1HG ARG 26 2HG ARG 26 9.686 3.047 3.316
166 2HG ARG 26 1HG ARG 26 8.206 2.197 3.760
167 1HD ARG 26 2HD ARG 26 9.027 1.816 6.017
168 2HD ARG 26 1HD ARG 26 10.614 2.487 5.592
169 HE ARG 26 HE ARG 26 8.652 4.425 4.903
170 1HH1 ARG 26 1HH2 ARG 26 10.982 5.125 6.581
171 2HH1 ARG 26 2HH2 ARG 26 10.265 5.454 8.123
172 1HH2 ARG 26 2HH1 ARG 26 7.270 3.864 7.366
173 2HH2 ARG 26 1HH1 ARG 26 8.159 4.738 8.569
174 H LYS 27 H LYS 27 9.685 -2.070 2.800
175 HA LYS 27 HA LYS 27 12.126 -2.562 1.400
176 1HB LYS 27 2HB LYS 27 10.111 -3.983 2.924
177 2HB LYS 27 1HB LYS 27 10.631 -4.960 1.551
178 1HG LYS 27 2HG LYS 27 12.701 -5.291 2.417
179 2HG LYS 27 1HG LYS 27 12.844 -3.615 2.949
180 1HD LYS 27 2HD LYS 27 12.754 -4.735 4.992
181 2HD LYS 27 1HD LYS 27 11.055 -4.333 4.742
182 1HE LYS 27 2HE LYS 27 10.977 -6.666 3.505
183 2HE LYS 27 1HE LYS 27 12.422 -6.999 4.480
184 1HZ LYS 27 1HZ LYS 27 10.433 -7.577 5.717
185 2HZ LYS 27 2HZ LYS 27 9.809 -6.011 5.507
186 3HZ LYS 27 3HZ LYS 27 11.202 -6.255 6.449
187 H HIS 28 H HIS 28 8.737 -3.246 0.443
188 HA HIS 28 HA HIS 28 9.634 -3.957 -2.303
189 1HB HIS 28 2HB HIS 28 7.036 -4.106 -0.757
190 2HB HIS 28 1HB HIS 28 7.131 -4.492 -2.473
191 HD1 HIS 28 HD1 HIS 28 10.258 -5.631 -1.529
192 HD2 HIS 28 HD2 HIS 28 6.435 -7.041 -0.641
193 HE1 HIS 28 HE1 HIS 28 10.526 -8.055 -0.859
194 H ARG 29 H ARG 29 8.452 -1.214 -0.584
195 HA ARG 29 HA ARG 29 7.731 0.911 -1.288
196 1HB ARG 29 2HB ARG 29 9.637 -0.176 -3.173
197 2HB ARG 29 1HB ARG 29 8.489 0.862 -4.019
198 1HG ARG 29 2HG ARG 29 8.950 2.415 -1.870
199 2HG ARG 29 1HG ARG 29 10.492 1.559 -1.929
200 1HD ARG 29 2HD ARG 29 10.904 2.290 -4.194
201 2HD ARG 29 1HD ARG 29 9.261 2.946 -4.335
202 HE ARG 29 HE ARG 29 10.346 4.194 -2.079
203 1HH1 ARG 29 1HH2 ARG 29 12.979 4.163 -3.361
204 2HH1 ARG 29 2HH2 ARG 29 12.952 5.568 -4.374
205 1HH2 ARG 29 2HH1 ARG 29 9.494 5.898 -4.275
206 2HH2 ARG 29 1HH1 ARG 29 10.974 6.552 -4.893
207 H TRP 30 H TRP 30 5.772 -1.200 -1.423
208 HA TRP 30 HA TRP 30 3.974 -0.037 -3.472
209 1HB TRP 30 2HB TRP 30 3.590 -2.124 -4.572
210 2HB TRP 30 1HB TRP 30 5.335 -1.987 -4.417
211 HD1 TRP 30 HD1 TRP 30 4.729 -2.813 -1.082
212 HE1 TRP 30 HE1 TRP 30 4.671 -5.343 -0.621
213 HE3 TRP 30 HE3 TRP 30 4.074 -4.561 -5.836
214 HZ2 TRP 30 HZ2 TRP 30 4.390 -7.787 -2.069
215 HZ3 TRP 30 HZ3 TRP 30 3.918 -6.997 -6.264
216 HH2 TRP 30 HH2 TRP 30 4.075 -8.611 -4.389
217 H CYS 31 H CYS 31 1.799 -1.635 -3.236
218 HA CYS 31 HA CYS 31 0.911 -1.136 -0.479
219 1HB CYS 31 2HB CYS 31 -0.267 -1.960 -3.108
220 2HB CYS 31 1HB CYS 31 -1.190 -2.294 -1.643
221 H LYS 32 H LYS 32 0.815 -2.680 1.114
222 HA LYS 32 HA LYS 32 1.264 -5.546 0.333
223 1HB LYS 32 2HB LYS 32 2.985 -4.015 1.664
224 2HB LYS 32 1HB LYS 32 1.946 -4.423 3.029
225 1HG LYS 32 2HG LYS 32 2.486 -6.789 1.456
226 2HG LYS 32 1HG LYS 32 3.999 -6.010 1.919
227 1HD LYS 32 2HD LYS 32 1.807 -6.413 3.946
228 2HD LYS 32 1HD LYS 32 2.933 -7.718 3.571
229 1HE LYS 32 2HE LYS 32 4.694 -5.669 3.905
230 2HE LYS 32 1HE LYS 32 3.417 -5.179 5.035
231 1HZ LYS 32 1HZ LYS 32 4.951 -6.706 6.108
232 2HZ LYS 32 2HZ LYS 32 4.686 -7.868 4.897
233 3HZ LYS 32 3HZ LYS 32 3.425 -7.428 5.949
234 H TYR 33 H TYR 33 -0.025 -7.109 1.399
235 HA TYR 33 HA TYR 33 -2.535 -6.102 2.591
236 1HB TYR 33 2HB TYR 33 -2.079 -8.015 0.823
237 2HB TYR 33 1HB TYR 33 -1.782 -8.997 2.257
238 HD1 TYR 33 HD1 TYR 33 -4.287 -6.667 0.742
239 HD2 TYR 33 HD2 TYR 33 -3.582 -9.906 3.473
240 HE1 TYR 33 HE1 TYR 33 -6.730 -6.909 1.082
241 HE2 TYR 33 HE2 TYR 33 -6.027 -10.148 3.814
242 HH TYR 33 HH TYR 33 -8.132 -8.226 3.471
243 H GLU 34 H GLU 34 -2.091 -5.452 4.721
244 HA GLU 34 HA GLU 34 -0.561 -7.286 6.499
245 1HB GLU 34 2HB GLU 34 -1.555 -4.433 6.632
246 2HB GLU 34 1HB GLU 34 -0.892 -5.244 8.050
247 1HG GLU 34 2HG GLU 34 0.644 -5.271 5.464
248 2HG GLU 34 1HG GLU 34 0.708 -3.851 6.508
249 H ILE 35 H ILE 35 -1.876 -8.898 7.309
250 HA ILE 35 HA ILE 35 -4.218 -8.112 8.924
251 HB ILE 35 HB ILE 35 -4.992 -8.322 6.543
252 1HG1 ILE 35 1HG1 ILE 35 -6.260 -10.655 7.858
253 2HG1 ILE 35 2HG1 ILE 35 -6.210 -9.182 8.827
254 1HG2 ILE 35 1HG2 ILE 35 -3.383 -10.104 5.883
255 2HG2 ILE 35 2HG2 ILE 35 -4.252 -11.242 6.913
256 3HG2 ILE 35 3HG2 ILE 35 -5.050 -10.539 5.507
257 1HD1 ILE 35 1HD1 ILE 35 -7.277 -9.362 5.994
258 2HD1 ILE 35 2HD1 ILE 35 -8.270 -9.307 7.450
259 3HD1 ILE 35 3HD1 ILE 35 -7.272 -7.921 7.012
260 1HN NH2 36 1HN NH2 36 -2.748 -10.412 10.948
261 2HN NH2 36 2HN NH2 36 -3.061 -8.724 10.487
Start of MODEL 5
1 1H GLU 1 1H GLU 1 7.525 9.805 -0.820
2 2H GLU 1 2H GLU 1 6.404 11.005 -1.254
3 3H GLU 1 3H GLU 1 6.322 9.464 -1.967
4 HA GLU 1 HA GLU 1 5.815 10.096 0.901
5 1HB GLU 1 2HB GLU 1 4.261 10.377 -1.427
6 2HB GLU 1 1HB GLU 1 3.698 8.878 -0.689
7 1HG GLU 1 2HG GLU 1 2.374 10.471 0.395
8 2HG GLU 1 1HG GLU 1 3.710 10.279 1.530
9 H CYS 2 H CYS 2 6.769 8.391 1.980
10 HA CYS 2 HA CYS 2 6.452 5.633 0.844
11 1HB CYS 2 2HB CYS 2 8.713 6.929 1.498
12 2HB CYS 2 1HB CYS 2 8.317 6.280 3.089
13 H LEU 3 H LEU 3 4.763 4.576 1.807
14 HA LEU 3 HA LEU 3 4.134 5.170 4.676
15 1HB LEU 3 2HB LEU 3 2.531 4.047 2.358
16 2HB LEU 3 1HB LEU 3 1.912 4.160 4.005
17 HG LEU 3 HG LEU 3 2.987 6.532 2.457
18 1HD1 LEU 3 1HD1 LEU 3 0.669 7.152 2.041
19 2HD1 LEU 3 2HD1 LEU 3 0.096 5.737 2.926
20 3HD1 LEU 3 3HD1 LEU 3 0.950 5.535 1.396
21 1HD2 LEU 3 1HD2 LEU 3 1.578 6.134 5.099
22 2HD2 LEU 3 2HD2 LEU 3 1.517 7.686 4.263
23 3HD2 LEU 3 3HD2 LEU 3 3.068 7.018 4.771
24 H GLY 4 H GLY 4 4.419 3.542 6.165
25 1HA GLY 4 2HA GLY 4 5.673 1.049 5.406
26 2HA GLY 4 1HA GLY 4 5.109 1.464 7.024
27 H PHE 5 H PHE 5 4.432 -0.919 6.895
28 HA PHE 5 HA PHE 5 2.175 -1.628 5.188
29 1HB PHE 5 2HB PHE 5 3.802 -3.275 5.962
30 2HB PHE 5 1HB PHE 5 3.438 -2.891 7.644
31 HD1 PHE 5 HD1 PHE 5 1.499 -3.784 8.744
32 HD2 PHE 5 HD2 PHE 5 2.068 -4.376 4.526
33 HE1 PHE 5 HE1 PHE 5 -0.346 -5.439 8.727
34 HE2 PHE 5 HE2 PHE 5 0.221 -6.032 4.513
35 HZ PHE 5 HZ PHE 5 -0.984 -6.564 6.611
36 H GLY 6 H GLY 6 -0.006 -1.631 5.724
37 1HA GLY 6 2HA GLY 6 -1.964 -1.300 6.982
38 2HA GLY 6 1HA GLY 6 -0.974 -1.283 8.439
39 H LYS 7 H LYS 7 -0.373 0.870 5.713
40 HA LYS 7 HA LYS 7 -1.077 3.188 7.476
41 1HB LYS 7 2HB LYS 7 0.850 2.739 5.185
42 2HB LYS 7 1HB LYS 7 0.458 4.358 5.762
43 1HG LYS 7 2HG LYS 7 1.453 2.156 7.587
44 2HG LYS 7 1HG LYS 7 2.526 3.316 6.804
45 1HD LYS 7 2HD LYS 7 0.969 5.125 7.830
46 2HD LYS 7 1HD LYS 7 0.406 3.828 8.885
47 1HE LYS 7 2HE LYS 7 3.354 4.019 8.643
48 2HE LYS 7 1HE LYS 7 2.576 5.390 9.456
49 1HZ LYS 7 1HZ LYS 7 3.043 3.556 11.000
50 2HZ LYS 7 2HZ LYS 7 2.061 2.526 10.072
51 3HZ LYS 7 3HZ LYS 7 1.380 3.862 10.872
52 H GLY 8 H GLY 8 -2.736 4.524 6.821
53 1HA GLY 8 2HA GLY 8 -4.539 3.829 4.754
54 2HA GLY 8 1HA GLY 8 -4.457 5.421 5.506
55 H CYS 9 H CYS 9 -4.257 3.918 2.586
56 HA CYS 9 HA CYS 9 -2.749 6.203 1.399
57 1HB CYS 9 2HB CYS 9 -1.250 4.768 0.263
58 2HB CYS 9 1HB CYS 9 -1.364 4.048 1.867
59 H ASN 10 H ASN 10 -2.921 5.830 -1.185
60 HA ASN 10 HA ASN 10 -5.818 5.297 -1.741
61 1HB ASN 10 2HB ASN 10 -4.392 7.554 -2.090
62 2HB ASN 10 1HB ASN 10 -4.036 6.771 -3.630
63 1HD2 ASN 10 1HD2 ASN 10 -5.680 6.797 -5.224
64 2HD2 ASN 10 2HD2 ASN 10 -7.249 7.381 -4.955
65 HA PRO 11 HA PRO 11 -4.499 1.848 -4.192
66 1HB PRO 11 2HB PRO 11 -6.801 1.491 -5.636
67 2HB PRO 11 1HB PRO 11 -6.631 1.002 -3.938
68 1HG PRO 11 2HG PRO 11 -7.944 3.407 -5.093
69 2HG PRO 11 1HG PRO 11 -8.431 2.404 -3.718
70 1HD PRO 11 2HD PRO 11 -7.206 4.829 -3.456
71 2HD PRO 11 1HD PRO 11 -7.083 3.529 -2.251
72 H SER 12 H SER 12 -6.191 4.543 -5.861
73 HA SER 12 HA SER 12 -5.197 3.982 -8.500
74 1HB SER 12 2HB SER 12 -7.116 5.487 -7.786
75 2HB SER 12 1HB SER 12 -5.912 6.668 -7.277
76 HG SER 12 HG SER 12 -5.651 7.194 -9.290
77 H ASN 13 H ASN 13 -3.958 6.018 -5.847
78 HA ASN 13 HA ASN 13 -1.364 6.282 -7.335
79 1HB ASN 13 2HB ASN 13 -2.969 8.161 -5.593
80 2HB ASN 13 1HB ASN 13 -1.237 8.405 -5.819
81 1HD2 ASN 13 1HD2 ASN 13 -4.367 8.407 -7.503
82 2HD2 ASN 13 2HD2 ASN 13 -3.801 9.174 -8.907
83 H ASP 14 H ASP 14 -1.033 4.112 -6.163
84 HA ASP 14 HA ASP 14 -0.953 3.764 -3.374
85 1HB ASP 14 2HB ASP 14 0.566 1.925 -3.881
86 2HB ASP 14 1HB ASP 14 -0.643 2.035 -5.157
87 H GLN 15 H GLN 15 0.349 4.514 -1.769
88 HA GLN 15 HA GLN 15 2.870 5.959 -2.527
89 1HB GLN 15 2HB GLN 15 0.656 6.552 -0.554
90 2HB GLN 15 1HB GLN 15 2.240 7.314 -0.412
91 1HG GLN 15 2HG GLN 15 1.954 8.589 -2.304
92 2HG GLN 15 1HG GLN 15 0.955 7.373 -3.100
93 1HE2 GLN 15 1HE2 GLN 15 0.864 10.274 -1.193
94 2HE2 GLN 15 2HE2 GLN 15 -0.820 10.331 -0.982
95 H CYS 16 H CYS 16 2.381 3.082 -1.614
96 HA CYS 16 HA CYS 16 3.349 2.911 1.136
97 1HB CYS 16 2HB CYS 16 3.137 0.888 -1.120
98 2HB CYS 16 1HB CYS 16 3.423 0.490 0.572
99 H CYS 17 H CYS 17 5.425 1.537 1.528
100 HA CYS 17 HA CYS 17 7.660 2.864 0.158
101 1HB CYS 17 2HB CYS 17 7.264 0.986 2.477
102 2HB CYS 17 1HB CYS 17 8.885 1.260 1.841
103 H LYS 18 H LYS 18 8.652 2.033 -1.616
104 HA LYS 18 HA LYS 18 7.943 -0.562 -2.723
105 1HB LYS 18 2HB LYS 18 9.815 1.705 -3.366
106 2HB LYS 18 1HB LYS 18 9.951 0.191 -4.260
107 1HG LYS 18 2HG LYS 18 7.221 1.360 -3.931
108 2HG LYS 18 1HG LYS 18 8.316 2.146 -5.068
109 1HD LYS 18 2HD LYS 18 8.496 -0.697 -5.438
110 2HD LYS 18 1HD LYS 18 6.796 -0.228 -5.471
111 1HE LYS 18 2HE LYS 18 7.272 1.477 -7.185
112 2HE LYS 18 1HE LYS 18 8.995 1.056 -7.135
113 1HZ LYS 18 1HZ LYS 18 7.847 -0.151 -8.904
114 2HZ LYS 18 2HZ LYS 18 6.776 -0.823 -7.769
115 3HZ LYS 18 3HZ LYS 18 8.428 -1.219 -7.720
116 H SER 19 H SER 19 10.574 0.635 -0.700
117 HA SER 19 HA SER 19 12.511 -1.419 -1.144
118 1HB SER 19 2HB SER 19 11.791 0.392 1.166
119 2HB SER 19 1HB SER 19 13.150 -0.724 1.264
120 HG SER 19 HG SER 19 13.893 1.229 0.481
121 H SER 20 H SER 20 9.689 -1.272 1.028
122 HA SER 20 HA SER 20 10.290 -3.989 2.083
123 1HB SER 20 2HB SER 20 8.378 -3.388 3.601
124 2HB SER 20 1HB SER 20 9.696 -2.221 3.648
125 HG SER 20 HG SER 20 8.195 -0.837 3.158
126 H ASN 21 H ASN 21 9.148 -3.228 -0.754
127 HA ASN 21 HA ASN 21 7.504 -4.032 -2.238
128 1HB ASN 21 2HB ASN 21 8.536 -6.150 -0.492
129 2HB ASN 21 1HB ASN 21 6.960 -6.548 -1.174
130 1HD2 ASN 21 1HD2 ASN 21 9.548 -7.791 -1.921
131 2HD2 ASN 21 2HD2 ASN 21 9.770 -7.472 -3.573
132 H LEU 22 H LEU 22 6.099 -2.301 -0.932
133 HA LEU 22 HA LEU 22 3.782 -3.702 0.361
134 1HB LEU 22 2HB LEU 22 4.943 -0.911 0.560
135 2HB LEU 22 1HB LEU 22 3.362 -1.321 1.223
136 HG LEU 22 HG LEU 22 5.953 -2.722 1.949
137 1HD1 LEU 22 1HD1 LEU 22 4.285 -0.753 3.546
138 2HD1 LEU 22 2HD1 LEU 22 5.812 -0.362 2.755
139 3HD1 LEU 22 3HD1 LEU 22 5.777 -1.530 4.076
140 1HD2 LEU 22 1HD2 LEU 22 4.102 -4.228 2.235
141 2HD2 LEU 22 2HD2 LEU 22 3.095 -2.958 2.930
142 3HD2 LEU 22 3HD2 LEU 22 4.471 -3.587 3.836
143 H VAL 23 H VAL 23 1.765 -3.486 -0.578
144 HA VAL 23 HA VAL 23 1.527 -1.680 -2.967
145 HB VAL 23 HB VAL 23 0.084 -3.434 -3.938
146 1HG1 VAL 23 1HG1 VAL 23 2.613 -3.495 -4.182
147 2HG1 VAL 23 2HG1 VAL 23 1.794 -5.036 -4.433
148 3HG1 VAL 23 3HG1 VAL 23 2.625 -4.718 -2.911
149 1HG2 VAL 23 1HG2 VAL 23 0.274 -5.723 -2.612
150 2HG2 VAL 23 2HG2 VAL 23 -0.988 -4.560 -2.208
151 3HG2 VAL 23 3HG2 VAL 23 0.470 -4.655 -1.223
152 H CYS 24 H CYS 24 -0.330 -0.397 -3.043
153 HA CYS 24 HA CYS 24 -1.847 -0.032 -0.596
154 1HB CYS 24 2HB CYS 24 -1.687 1.127 -3.336
155 2HB CYS 24 1HB CYS 24 -3.179 1.415 -2.440
156 H SER 25 H SER 25 -3.695 -1.074 -0.002
157 HA SER 25 HA SER 25 -4.954 -3.010 -1.836
158 1HB SER 25 2HB SER 25 -4.409 -3.373 0.618
159 2HB SER 25 1HB SER 25 -5.683 -2.219 1.002
160 HG SER 25 HG SER 25 -6.189 -4.596 0.881
161 H ARG 26 H ARG 26 -6.922 -2.702 -2.841
162 HA ARG 26 HA ARG 26 -8.124 -0.024 -2.816
163 1HB ARG 26 2HB ARG 26 -9.507 -0.971 -4.608
164 2HB ARG 26 1HB ARG 26 -7.824 -1.427 -4.855
165 1HG ARG 26 2HG ARG 26 -9.202 -3.373 -3.184
166 2HG ARG 26 1HG ARG 26 -10.021 -3.166 -4.730
167 1HD ARG 26 2HD ARG 26 -7.065 -3.333 -4.907
168 2HD ARG 26 1HD ARG 26 -7.880 -4.821 -4.388
169 HE ARG 26 HE ARG 26 -9.451 -4.021 -6.484
170 1HH1 ARG 26 2HH1 ARG 26 -7.796 -6.379 -6.943
171 2HH1 ARG 26 1HH1 ARG 26 -6.721 -5.887 -8.208
172 1HH2 ARG 26 1HH2 ARG 26 -7.307 -2.494 -7.745
173 2HH2 ARG 26 2HH2 ARG 26 -6.443 -3.682 -8.663
174 H LYS 27 H LYS 27 -8.700 -3.058 -1.197
175 HA LYS 27 HA LYS 27 -11.499 -2.371 -0.496
176 1HB LYS 27 2HB LYS 27 -10.637 -4.681 -1.135
177 2HB LYS 27 1HB LYS 27 -9.762 -4.693 0.396
178 1HG LYS 27 2HG LYS 27 -11.863 -4.413 1.629
179 2HG LYS 27 1HG LYS 27 -12.759 -4.329 0.112
180 1HD LYS 27 2HD LYS 27 -12.025 -6.615 -0.454
181 2HD LYS 27 1HD LYS 27 -11.132 -6.704 1.064
182 1HE LYS 27 2HE LYS 27 -13.801 -5.867 1.681
183 2HE LYS 27 1HE LYS 27 -13.898 -7.294 0.631
184 1HZ LYS 27 1HZ LYS 27 -12.193 -7.037 3.056
185 2HZ LYS 27 2HZ LYS 27 -12.256 -8.393 2.034
186 3HZ LYS 27 3HZ LYS 27 -13.618 -7.949 2.946
187 H HIS 28 H HIS 28 -8.332 -2.842 1.101
188 HA HIS 28 HA HIS 28 -9.413 -1.933 3.701
189 1HB HIS 28 2HB HIS 28 -6.765 -2.961 2.661
190 2HB HIS 28 1HB HIS 28 -6.947 -2.369 4.312
191 HD1 HIS 28 HD1 HIS 28 -8.115 -3.882 5.985
192 HD2 HIS 28 HD2 HIS 28 -8.395 -5.307 2.078
193 HE1 HIS 28 HE1 HIS 28 -9.119 -6.202 6.139
194 H ARG 29 H ARG 29 -7.997 -0.486 0.923
195 HA ARG 29 HA ARG 29 -7.139 1.666 0.501
196 1HB ARG 29 2HB ARG 29 -8.949 1.947 2.898
197 2HB ARG 29 1HB ARG 29 -8.121 3.357 2.238
198 1HG ARG 29 2HG ARG 29 -9.219 3.174 0.153
199 2HG ARG 29 1HG ARG 29 -9.704 1.505 0.457
200 1HD ARG 29 2HD ARG 29 -11.080 2.450 2.436
201 2HD ARG 29 1HD ARG 29 -10.846 4.032 1.665
202 HE ARG 29 HE ARG 29 -11.989 3.170 -0.328
203 1HH1 ARG 29 1HH2 ARG 29 -14.077 2.703 1.689
204 2HH1 ARG 29 2HH2 ARG 29 -14.459 1.025 1.486
205 1HH2 ARG 29 2HH1 ARG 29 -11.556 0.307 -0.284
206 2HH2 ARG 29 1HH1 ARG 29 -13.027 -0.335 0.366
207 H TRP 30 H TRP 30 -5.301 -0.035 1.844
208 HA TRP 30 HA TRP 30 -3.697 2.000 3.285
209 1HB TRP 30 2HB TRP 30 -3.422 0.615 5.237
210 2HB TRP 30 1HB TRP 30 -5.146 0.730 4.918
211 HD1 TRP 30 HD1 TRP 30 -4.266 -1.562 2.368
212 HE1 TRP 30 HE1 TRP 30 -4.423 -4.019 3.118
213 HE3 TRP 30 HE3 TRP 30 -4.355 -0.928 7.430
214 HZ2 TRP 30 HZ2 TRP 30 -4.569 -5.521 5.544
215 HZ3 TRP 30 HZ3 TRP 30 -4.505 -2.888 8.938
216 HH2 TRP 30 HH2 TRP 30 -4.612 -5.183 8.003
217 H CYS 31 H CYS 31 -1.531 0.573 4.036
218 HA CYS 31 HA CYS 31 -0.444 -0.378 1.445
219 1HB CYS 31 2HB CYS 31 0.643 0.524 4.105
220 2HB CYS 31 1HB CYS 31 1.689 -0.312 2.958
221 H LYS 32 H LYS 32 -0.711 -2.535 1.063
222 HA LYS 32 HA LYS 32 -0.646 -4.465 3.339
223 1HB LYS 32 2HB LYS 32 -2.312 -4.151 1.191
224 2HB LYS 32 1HB LYS 32 -1.187 -5.356 0.566
225 1HG LYS 32 2HG LYS 32 -1.577 -6.504 2.907
226 2HG LYS 32 1HG LYS 32 -3.059 -5.547 2.904
227 1HD LYS 32 2HD LYS 32 -3.948 -6.670 1.077
228 2HD LYS 32 1HD LYS 32 -2.361 -7.111 0.446
229 1HE LYS 32 2HE LYS 32 -2.825 -9.169 1.339
230 2HE LYS 32 1HE LYS 32 -2.385 -8.414 2.883
231 1HZ LYS 32 1HZ LYS 32 -5.105 -8.462 1.678
232 2HZ LYS 32 2HZ LYS 32 -4.689 -7.680 3.128
233 3HZ LYS 32 3HZ LYS 32 -4.599 -9.372 3.015
234 H TYR 33 H TYR 33 0.520 -6.618 2.723
235 HA TYR 33 HA TYR 33 3.187 -5.931 1.554
236 1HB TYR 33 2HB TYR 33 2.896 -6.742 3.941
237 2HB TYR 33 1HB TYR 33 2.360 -8.286 3.277
238 HD1 TYR 33 HD1 TYR 33 3.916 -9.870 2.405
239 HD2 TYR 33 HD2 TYR 33 5.211 -5.894 3.392
240 HE1 TYR 33 HE1 TYR 33 6.278 -10.564 2.106
241 HE2 TYR 33 HE2 TYR 33 7.572 -6.589 3.093
242 HH TYR 33 HH TYR 33 8.634 -8.852 1.496
243 H GLU 34 H GLU 34 4.154 -7.385 0.031
244 HA GLU 34 HA GLU 34 2.281 -8.724 -1.772
245 1HB GLU 34 2HB GLU 34 5.140 -7.950 -1.641
246 2HB GLU 34 1HB GLU 34 4.802 -9.381 -2.614
247 1HG GLU 34 2HG GLU 34 3.536 -8.211 -4.153
248 2HG GLU 34 1HG GLU 34 3.035 -6.995 -2.977
249 H ILE 35 H ILE 35 1.463 -10.692 -1.112
250 HA ILE 35 HA ILE 35 3.143 -12.553 0.476
251 HB ILE 35 HB ILE 35 0.254 -12.625 -0.469
252 1HG1 ILE 35 1HG1 ILE 35 0.531 -12.430 2.363
253 2HG1 ILE 35 2HG1 ILE 35 1.584 -11.207 1.652
254 1HG2 ILE 35 1HG2 ILE 35 1.796 -14.413 1.434
255 2HG2 ILE 35 2HG2 ILE 35 0.038 -14.404 1.302
256 3HG2 ILE 35 3HG2 ILE 35 1.023 -14.889 -0.078
257 1HD1 ILE 35 1HD1 ILE 35 -0.311 -10.402 0.268
258 2HD1 ILE 35 2HD1 ILE 35 -1.359 -11.598 1.030
259 3HD1 ILE 35 3HD1 ILE 35 -0.669 -10.290 1.991
260 1HN NH2 36 1HN NH2 36 3.205 -13.086 -3.409
261 2HN NH2 36 2HN NH2 36 2.923 -11.628 -2.433
Start of MODEL 6
1 1H GLU 1 1H GLU 1 4.362 10.135 4.353
2 2H GLU 1 2H GLU 1 5.080 11.483 3.610
3 3H GLU 1 3H GLU 1 5.956 10.563 4.740
4 HA GLU 1 HA GLU 1 5.032 9.614 2.071
5 1HB GLU 1 2HB GLU 1 7.442 10.943 3.172
6 2HB GLU 1 1HB GLU 1 7.765 9.555 2.132
7 1HG GLU 1 2HG GLU 1 5.691 11.099 0.913
8 2HG GLU 1 1HG GLU 1 6.998 12.198 1.355
9 H CYS 2 H CYS 2 5.601 7.425 1.633
10 HA CYS 2 HA CYS 2 6.011 5.161 2.127
11 1HB CYS 2 2HB CYS 2 8.174 6.502 2.881
12 2HB CYS 2 1HB CYS 2 7.642 6.029 4.493
13 H LEU 3 H LEU 3 3.923 4.568 2.818
14 HA LEU 3 HA LEU 3 3.167 4.987 5.664
15 1HB LEU 3 2HB LEU 3 1.739 3.911 3.210
16 2HB LEU 3 1HB LEU 3 0.985 4.047 4.798
17 HG LEU 3 HG LEU 3 2.226 6.375 3.300
18 1HD1 LEU 3 1HD1 LEU 3 -0.708 5.712 3.673
19 2HD1 LEU 3 2HD1 LEU 3 0.191 5.400 2.187
20 3HD1 LEU 3 3HD1 LEU 3 -0.032 7.056 2.753
21 1HD2 LEU 3 1HD2 LEU 3 0.804 7.646 5.007
22 2HD2 LEU 3 2HD2 LEU 3 2.220 6.817 5.653
23 3HD2 LEU 3 3HD2 LEU 3 0.617 6.110 5.852
24 H GLY 4 H GLY 4 2.789 3.214 7.084
25 1HA GLY 4 2HA GLY 4 4.361 0.823 6.577
26 2HA GLY 4 1HA GLY 4 3.373 1.124 8.005
27 H PHE 5 H PHE 5 3.108 -1.364 7.309
28 HA PHE 5 HA PHE 5 1.260 -1.961 5.159
29 1HB PHE 5 2HB PHE 5 2.783 -3.631 6.014
30 2HB PHE 5 1HB PHE 5 2.177 -3.419 7.656
31 HD1 PHE 5 HD1 PHE 5 0.409 -4.755 8.448
32 HD2 PHE 5 HD2 PHE 5 1.072 -4.420 4.216
33 HE1 PHE 5 HE1 PHE 5 -1.322 -6.483 8.038
34 HE2 PHE 5 HE2 PHE 5 -0.659 -6.148 3.810
35 HZ PHE 5 HZ PHE 5 -1.855 -7.179 5.719
36 H GLY 6 H GLY 6 -0.983 -2.135 5.227
37 1HA GLY 6 2HA GLY 6 -3.167 -2.080 6.099
38 2HA GLY 6 1HA GLY 6 -2.482 -2.177 7.719
39 H LYS 7 H LYS 7 -1.590 0.310 5.369
40 HA LYS 7 HA LYS 7 -2.710 2.365 7.229
41 1HB LYS 7 2HB LYS 7 -0.204 2.028 6.283
42 2HB LYS 7 1HB LYS 7 -0.858 3.030 4.987
43 1HG LYS 7 2HG LYS 7 -0.057 4.631 6.492
44 2HG LYS 7 1HG LYS 7 -1.758 4.518 6.943
45 1HD LYS 7 2HD LYS 7 -0.409 2.489 8.391
46 2HD LYS 7 1HD LYS 7 0.569 3.949 8.545
47 1HE LYS 7 2HE LYS 7 -1.276 5.204 9.440
48 2HE LYS 7 1HE LYS 7 -2.430 3.924 9.016
49 1HZ LYS 7 1HZ LYS 7 -0.139 3.612 10.888
50 2HZ LYS 7 2HZ LYS 7 -1.278 2.414 10.492
51 3HZ LYS 7 3HZ LYS 7 -1.759 3.796 11.356
52 H GLY 8 H GLY 8 -4.505 3.460 6.542
53 1HA GLY 8 2HA GLY 8 -5.906 2.939 4.155
54 2HA GLY 8 1HA GLY 8 -6.130 4.390 5.130
55 H CYS 9 H CYS 9 -5.176 3.288 2.114
56 HA CYS 9 HA CYS 9 -4.095 5.968 1.410
57 1HB CYS 9 2HB CYS 9 -2.082 5.038 0.476
58 2HB CYS 9 1HB CYS 9 -2.242 4.358 2.094
59 H ASN 10 H ASN 10 -3.790 6.050 -1.086
60 HA ASN 10 HA ASN 10 -6.181 4.799 -2.347
61 1HB ASN 10 2HB ASN 10 -4.467 7.211 -2.724
62 2HB ASN 10 1HB ASN 10 -5.223 6.541 -4.169
63 1HD2 ASN 10 1HD2 ASN 10 -7.396 7.090 -4.519
64 2HD2 ASN 10 2HD2 ASN 10 -8.404 7.806 -3.356
65 HA PRO 11 HA PRO 11 -3.622 1.943 -4.565
66 1HB PRO 11 2HB PRO 11 -5.355 1.342 -6.601
67 2HB PRO 11 1HB PRO 11 -5.532 0.706 -4.953
68 1HG PRO 11 2HG PRO 11 -6.946 2.976 -6.268
69 2HG PRO 11 1HG PRO 11 -7.577 1.736 -5.173
70 1HD PRO 11 2HD PRO 11 -6.996 4.260 -4.363
71 2HD PRO 11 1HD PRO 11 -6.875 2.846 -3.291
72 H SER 12 H SER 12 -5.228 4.602 -6.312
73 HA SER 12 HA SER 12 -3.619 4.469 -8.707
74 1HB SER 12 2HB SER 12 -5.875 5.626 -8.244
75 2HB SER 12 1HB SER 12 -4.933 6.916 -7.501
76 HG SER 12 HG SER 12 -5.395 7.206 -9.775
77 H ASN 13 H ASN 13 -3.366 6.397 -5.707
78 HA ASN 13 HA ASN 13 -0.940 7.778 -6.568
79 1HB ASN 13 2HB ASN 13 -2.728 8.653 -5.020
80 2HB ASN 13 1HB ASN 13 -2.181 7.484 -3.817
81 1HD2 ASN 13 1HD2 ASN 13 -0.540 8.203 -2.440
82 2HD2 ASN 13 2HD2 ASN 13 0.472 9.530 -2.751
83 H ASP 14 H ASP 14 -1.692 5.153 -4.277
84 HA ASP 14 HA ASP 14 -0.328 3.503 -3.302
85 1HB ASP 14 2HB ASP 14 0.116 3.468 -5.913
86 2HB ASP 14 1HB ASP 14 1.709 4.054 -5.437
87 H GLN 15 H GLN 15 0.061 5.044 -1.490
88 HA GLN 15 HA GLN 15 2.762 6.329 -1.517
89 1HB GLN 15 2HB GLN 15 0.155 7.054 -0.633
90 2HB GLN 15 1HB GLN 15 1.158 6.894 0.808
91 1HG GLN 15 2HG GLN 15 2.048 8.450 -1.629
92 2HG GLN 15 1HG GLN 15 1.167 9.195 -0.296
93 1HE2 GLN 15 1HE2 GLN 15 4.257 8.805 -1.394
94 2HE2 GLN 15 2HE2 GLN 15 5.095 8.815 0.081
95 H CYS 16 H CYS 16 1.973 3.340 -0.951
96 HA CYS 16 HA CYS 16 2.557 2.892 1.862
97 1HB CYS 16 2HB CYS 16 2.563 1.134 -0.612
98 2HB CYS 16 1HB CYS 16 2.745 0.515 1.029
99 H CYS 17 H CYS 17 4.507 1.477 2.477
100 HA CYS 17 HA CYS 17 6.968 2.800 1.597
101 1HB CYS 17 2HB CYS 17 6.081 0.832 3.667
102 2HB CYS 17 1HB CYS 17 7.795 0.862 3.260
103 H LYS 18 H LYS 18 7.753 2.172 -0.394
104 HA LYS 18 HA LYS 18 7.361 -0.448 -1.557
105 1HB LYS 18 2HB LYS 18 8.932 0.426 -3.261
106 2HB LYS 18 1HB LYS 18 7.715 1.630 -2.845
107 1HG LYS 18 2HG LYS 18 9.429 3.048 -2.453
108 2HG LYS 18 1HG LYS 18 9.766 2.094 -1.009
109 1HD LYS 18 2HD LYS 18 11.460 0.869 -2.050
110 2HD LYS 18 1HD LYS 18 10.831 1.185 -3.667
111 1HE LYS 18 2HE LYS 18 11.517 3.548 -3.494
112 2HE LYS 18 1HE LYS 18 12.133 3.252 -1.856
113 1HZ LYS 18 1HZ LYS 18 13.011 1.807 -4.304
114 2HZ LYS 18 2HZ LYS 18 13.609 1.564 -2.732
115 3HZ LYS 18 3HZ LYS 18 13.889 3.036 -3.533
116 H SER 19 H SER 19 9.786 0.876 0.608
117 HA SER 19 HA SER 19 11.924 -0.975 0.091
118 1HB SER 19 2HB SER 19 11.882 1.243 1.393
119 2HB SER 19 1HB SER 19 11.220 0.316 2.737
120 HG SER 19 HG SER 19 13.767 0.462 1.806
121 H SER 20 H SER 20 9.010 -1.166 2.106
122 HA SER 20 HA SER 20 9.866 -3.831 3.146
123 1HB SER 20 2HB SER 20 9.009 -1.854 4.576
124 2HB SER 20 1HB SER 20 7.422 -2.218 3.906
125 HG SER 20 HG SER 20 9.001 -3.649 5.694
126 H ASN 21 H ASN 21 8.836 -3.240 0.331
127 HA ASN 21 HA ASN 21 7.354 -4.191 -1.232
128 1HB ASN 21 2HB ASN 21 7.916 -6.177 0.910
129 2HB ASN 21 1HB ASN 21 6.578 -6.564 -0.171
130 1HD2 ASN 21 1HD2 ASN 21 7.081 -6.686 -2.533
131 2HD2 ASN 21 2HD2 ASN 21 8.671 -7.000 -3.039
132 H LEU 22 H LEU 22 5.874 -2.303 -0.398
133 HA LEU 22 HA LEU 22 3.293 -3.514 0.534
134 1HB LEU 22 2HB LEU 22 4.711 -0.993 1.437
135 2HB LEU 22 1HB LEU 22 3.008 -1.295 1.775
136 HG LEU 22 HG LEU 22 5.209 -3.234 2.527
137 1HD1 LEU 22 1HD1 LEU 22 5.086 -2.326 4.780
138 2HD1 LEU 22 2HD1 LEU 22 3.829 -1.190 4.290
139 3HD1 LEU 22 3HD1 LEU 22 5.468 -1.016 3.663
140 1HD2 LEU 22 1HD2 LEU 22 2.295 -2.929 3.322
141 2HD2 LEU 22 2HD2 LEU 22 3.416 -4.059 4.083
142 3HD2 LEU 22 3HD2 LEU 22 2.998 -4.243 2.379
143 H VAL 23 H VAL 23 1.559 -2.918 -0.728
144 HA VAL 23 HA VAL 23 1.834 -0.530 -2.518
145 HB VAL 23 HB VAL 23 0.752 -1.982 -4.300
146 1HG1 VAL 23 1HG1 VAL 23 2.854 -3.152 -4.869
147 2HG1 VAL 23 2HG1 VAL 23 3.445 -2.877 -3.231
148 3HG1 VAL 23 3HG1 VAL 23 3.165 -1.509 -4.307
149 1HG2 VAL 23 1HG2 VAL 23 1.587 -4.266 -2.488
150 2HG2 VAL 23 2HG2 VAL 23 0.735 -4.375 -4.028
151 3HG2 VAL 23 3HG2 VAL 23 -0.077 -3.699 -2.617
152 H CYS 24 H CYS 24 -0.122 0.576 -2.879
153 HA CYS 24 HA CYS 24 -2.221 0.249 -0.923
154 1HB CYS 24 2HB CYS 24 -1.780 1.899 -3.406
155 2HB CYS 24 1HB CYS 24 -3.306 1.985 -2.526
156 H SER 25 H SER 25 -4.197 -0.782 -1.110
157 HA SER 25 HA SER 25 -4.687 -2.356 -3.612
158 1HB SER 25 2HB SER 25 -5.437 -2.667 -0.695
159 2HB SER 25 1HB SER 25 -6.168 -3.656 -1.957
160 HG SER 25 HG SER 25 -4.441 -4.826 -1.499
161 H ARG 26 H ARG 26 -6.814 -2.331 -4.528
162 HA ARG 26 HA ARG 26 -8.347 0.142 -4.015
163 1HB ARG 26 2HB ARG 26 -9.453 -0.440 -6.082
164 2HB ARG 26 1HB ARG 26 -7.738 -0.780 -6.294
165 1HG ARG 26 2HG ARG 26 -8.213 -3.181 -5.687
166 2HG ARG 26 1HG ARG 26 -9.932 -2.787 -5.700
167 1HD ARG 26 2HD ARG 26 -9.593 -1.927 -8.085
168 2HD ARG 26 1HD ARG 26 -7.998 -2.705 -8.032
169 HE ARG 26 HE ARG 26 -9.085 -4.853 -7.829
170 1HH1 ARG 26 1HH2 ARG 26 -10.781 -3.572 -9.996
171 2HH1 ARG 26 2HH2 ARG 26 -12.381 -3.915 -9.429
172 1HH2 ARG 26 2HH1 ARG 26 -11.356 -4.702 -6.203
173 2HH2 ARG 26 1HH1 ARG 26 -12.708 -4.557 -7.276
174 H LYS 27 H LYS 27 -8.713 -3.358 -3.548
175 HA LYS 27 HA LYS 27 -11.528 -3.205 -2.767
176 1HB LYS 27 2HB LYS 27 -9.557 -5.165 -3.424
177 2HB LYS 27 1HB LYS 27 -10.168 -5.556 -1.816
178 1HG LYS 27 2HG LYS 27 -12.493 -4.939 -3.111
179 2HG LYS 27 1HG LYS 27 -11.551 -5.636 -4.429
180 1HD LYS 27 2HD LYS 27 -11.269 -7.696 -3.293
181 2HD LYS 27 1HD LYS 27 -11.755 -7.003 -1.745
182 1HE LYS 27 2HE LYS 27 -14.051 -6.574 -2.818
183 2HE LYS 27 1HE LYS 27 -13.514 -7.645 -4.127
184 1HZ LYS 27 1HZ LYS 27 -12.989 -9.342 -2.492
185 2HZ LYS 27 2HZ LYS 27 -14.622 -8.894 -2.359
186 3HZ LYS 27 3HZ LYS 27 -13.489 -8.323 -1.230
187 H HIS 28 H HIS 28 -8.395 -3.402 -1.063
188 HA HIS 28 HA HIS 28 -9.759 -3.288 1.578
189 1HB HIS 28 2HB HIS 28 -6.835 -3.478 0.780
190 2HB HIS 28 1HB HIS 28 -7.466 -3.674 2.414
191 HD1 HIS 28 HD1 HIS 28 -6.897 -5.496 -0.739
192 HD2 HIS 28 HD2 HIS 28 -9.156 -6.055 2.719
193 HE1 HIS 28 HE1 HIS 28 -7.600 -7.929 -0.728
194 H ARG 29 H ARG 29 -8.109 -1.184 -0.677
195 HA ARG 29 HA ARG 29 -7.631 1.118 -0.608
196 1HB ARG 29 2HB ARG 29 -9.992 0.580 0.917
197 2HB ARG 29 1HB ARG 29 -9.090 1.848 1.746
198 1HG ARG 29 2HG ARG 29 -10.050 3.258 0.252
199 2HG ARG 29 1HG ARG 29 -8.875 2.612 -0.894
200 1HD ARG 29 2HD ARG 29 -10.755 0.686 -1.103
201 2HD ARG 29 1HD ARG 29 -11.795 2.060 -0.675
202 HE ARG 29 HE ARG 29 -10.160 1.833 -3.121
203 1HH1 ARG 29 2HH1 ARG 29 -13.036 2.806 -2.959
204 2HH1 ARG 29 1HH1 ARG 29 -12.836 4.507 -3.217
205 1HH2 ARG 29 1HH2 ARG 29 -9.418 4.472 -2.590
206 2HH2 ARG 29 2HH2 ARG 29 -10.784 5.453 -3.008
207 H TRP 30 H TRP 30 -5.804 -0.674 0.793
208 HA TRP 30 HA TRP 30 -4.568 1.310 2.613
209 1HB TRP 30 2HB TRP 30 -4.519 -0.179 4.493
210 2HB TRP 30 1HB TRP 30 -6.173 -0.187 3.898
211 HD1 TRP 30 HD1 TRP 30 -4.819 -2.189 1.369
212 HE1 TRP 30 HE1 TRP 30 -4.802 -4.699 1.929
213 HE3 TRP 30 HE3 TRP 30 -5.452 -1.974 6.434
214 HZ2 TRP 30 HZ2 TRP 30 -5.030 -6.399 4.212
215 HZ3 TRP 30 HZ3 TRP 30 -5.551 -4.057 7.773
216 HH2 TRP 30 HH2 TRP 30 -5.341 -6.267 6.670
217 H CYS 31 H CYS 31 -2.472 -0.129 3.596
218 HA CYS 31 HA CYS 31 -0.898 -0.705 1.164
219 1HB CYS 31 2HB CYS 31 -0.321 -0.423 4.122
220 2HB CYS 31 1HB CYS 31 0.925 -0.904 2.972
221 H LYS 32 H LYS 32 -0.740 -2.757 0.390
222 HA LYS 32 HA LYS 32 -1.181 -5.055 2.271
223 1HB LYS 32 2HB LYS 32 -2.869 -4.665 0.473
224 2HB LYS 32 1HB LYS 32 -1.591 -4.822 -0.731
225 1HG LYS 32 2HG LYS 32 -1.990 -7.040 -0.739
226 2HG LYS 32 1HG LYS 32 -1.325 -7.096 0.893
227 1HD LYS 32 2HD LYS 32 -3.354 -7.522 1.771
228 2HD LYS 32 1HD LYS 32 -4.050 -6.123 0.957
229 1HE LYS 32 2HE LYS 32 -5.262 -7.890 -0.013
230 2HE LYS 32 1HE LYS 32 -3.940 -7.691 -1.179
231 1HZ LYS 32 1HZ LYS 32 -3.898 -9.543 1.150
232 2HZ LYS 32 2HZ LYS 32 -2.672 -9.369 -0.015
233 3HZ LYS 32 3HZ LYS 32 -4.182 -10.012 -0.455
234 H TYR 33 H TYR 33 0.335 -6.767 2.205
235 HA TYR 33 HA TYR 33 2.994 -6.128 1.160
236 1HB TYR 33 2HB TYR 33 2.163 -7.420 3.320
237 2HB TYR 33 1HB TYR 33 2.176 -8.811 2.235
238 HD1 TYR 33 HD1 TYR 33 4.216 -6.333 4.000
239 HD2 TYR 33 HD2 TYR 33 4.280 -9.560 1.164
240 HE1 TYR 33 HE1 TYR 33 6.677 -6.503 4.249
241 HE2 TYR 33 HE2 TYR 33 6.741 -9.730 1.414
242 HH TYR 33 HH TYR 33 8.422 -8.833 3.704
243 H GLU 34 H GLU 34 4.036 -7.140 -0.586
244 HA GLU 34 HA GLU 34 2.310 -8.355 -2.630
245 1HB GLU 34 2HB GLU 34 5.185 -7.487 -2.371
246 2HB GLU 34 1HB GLU 34 4.667 -8.428 -3.771
247 1HG GLU 34 2HG GLU 34 3.388 -6.721 -4.620
248 2HG GLU 34 1HG GLU 34 2.961 -6.105 -3.023
249 H ILE 35 H ILE 35 1.944 -10.526 -2.739
250 HA ILE 35 HA ILE 35 3.624 -12.401 -1.183
251 HB ILE 35 HB ILE 35 1.082 -12.359 -1.258
252 1HG1 ILE 35 1HG1 ILE 35 1.789 -15.051 -2.257
253 2HG1 ILE 35 2HG1 ILE 35 2.819 -14.451 -0.957
254 1HG2 ILE 35 1HG2 ILE 35 1.061 -12.001 -3.794
255 2HG2 ILE 35 2HG2 ILE 35 1.432 -13.718 -3.938
256 3HG2 ILE 35 3HG2 ILE 35 -0.069 -13.202 -3.170
257 1HD1 ILE 35 1HD1 ILE 35 -0.209 -14.428 -0.839
258 2HD1 ILE 35 2HD1 ILE 35 0.786 -15.713 -0.155
259 3HD1 ILE 35 3HD1 ILE 35 0.910 -14.071 0.476
260 1HN NH2 36 1HN NH2 36 5.796 -13.292 -3.586
261 2HN NH2 36 2HN NH2 36 5.384 -12.633 -1.987
Start of MODEL 7
1 1H GLU 1 1H GLU 1 7.528 11.175 0.488
2 2H GLU 1 2H GLU 1 8.791 10.100 0.854
3 3H GLU 1 3H GLU 1 8.737 11.630 1.588
4 HA GLU 1 HA GLU 1 8.005 9.950 3.162
5 1HB GLU 1 2HB GLU 1 6.911 12.359 2.558
6 2HB GLU 1 1HB GLU 1 5.492 11.330 2.370
7 1HG GLU 1 2HG GLU 1 5.737 10.469 4.619
8 2HG GLU 1 1HG GLU 1 7.281 11.301 4.814
9 H CYS 2 H CYS 2 7.213 7.883 3.275
10 HA CYS 2 HA CYS 2 5.138 7.038 1.274
11 1HB CYS 2 2HB CYS 2 6.342 4.951 1.046
12 2HB CYS 2 1HB CYS 2 7.505 6.259 0.839
13 H LEU 3 H LEU 3 3.921 5.060 2.037
14 HA LEU 3 HA LEU 3 3.292 5.310 4.938
15 1HB LEU 3 2HB LEU 3 1.925 4.107 2.515
16 2HB LEU 3 1HB LEU 3 1.293 3.914 4.149
17 HG LEU 3 HG LEU 3 1.948 6.642 3.035
18 1HD1 LEU 3 1HD1 LEU 3 -0.237 6.871 2.159
19 2HD1 LEU 3 2HD1 LEU 3 -0.813 5.422 2.984
20 3HD1 LEU 3 3HD1 LEU 3 0.276 5.277 1.604
21 1HD2 LEU 3 1HD2 LEU 3 1.493 6.067 5.543
22 2HD2 LEU 3 2HD2 LEU 3 -0.186 5.897 5.032
23 3HD2 LEU 3 3HD2 LEU 3 0.646 7.438 4.829
24 H GLY 4 H GLY 4 3.479 3.544 6.348
25 1HA GLY 4 2HA GLY 4 5.313 1.413 5.574
26 2HA GLY 4 1HA GLY 4 4.557 1.606 7.156
27 H PHE 5 H PHE 5 4.038 -0.667 7.210
28 HA PHE 5 HA PHE 5 2.233 -1.758 5.137
29 1HB PHE 5 2HB PHE 5 4.009 -3.149 6.034
30 2HB PHE 5 1HB PHE 5 3.476 -2.841 7.686
31 HD1 PHE 5 HD1 PHE 5 1.911 -3.974 4.452
32 HD2 PHE 5 HD2 PHE 5 2.303 -4.572 8.689
33 HE1 PHE 5 HE1 PHE 5 0.362 -5.905 4.325
34 HE2 PHE 5 HE2 PHE 5 0.755 -6.504 8.559
35 HZ PHE 5 HZ PHE 5 -0.216 -7.170 6.376
36 H GLY 6 H GLY 6 0.036 -1.708 5.331
37 1HA GLY 6 2HA GLY 6 -2.082 -1.795 6.384
38 2HA GLY 6 1HA GLY 6 -1.274 -1.818 7.951
39 H LYS 7 H LYS 7 -0.835 0.577 5.360
40 HA LYS 7 HA LYS 7 -1.841 2.679 7.250
41 1HB LYS 7 2HB LYS 7 0.466 2.400 5.397
42 2HB LYS 7 1HB LYS 7 -0.297 3.990 5.432
43 1HG LYS 7 2HG LYS 7 1.201 4.239 7.179
44 2HG LYS 7 1HG LYS 7 -0.185 3.600 8.062
45 1HD LYS 7 2HD LYS 7 1.158 1.331 7.108
46 2HD LYS 7 1HD LYS 7 2.436 2.413 7.658
47 1HE LYS 7 2HE LYS 7 0.922 2.728 9.776
48 2HE LYS 7 1HE LYS 7 0.181 1.204 9.246
49 1HZ LYS 7 1HZ LYS 7 2.389 0.221 9.102
50 2HZ LYS 7 2HZ LYS 7 2.088 0.780 10.677
51 3HZ LYS 7 3HZ LYS 7 3.093 1.670 9.636
52 H GLY 8 H GLY 8 -3.567 3.892 6.545
53 1HA GLY 8 2HA GLY 8 -5.149 3.199 4.324
54 2HA GLY 8 1HA GLY 8 -5.231 4.760 5.138
55 H CYS 9 H CYS 9 -4.689 3.364 2.195
56 HA CYS 9 HA CYS 9 -3.289 5.804 1.191
57 1HB CYS 9 2HB CYS 9 -1.627 4.511 0.105
58 2HB CYS 9 1HB CYS 9 -1.787 3.740 1.681
59 H ASN 10 H ASN 10 -3.286 5.569 -1.397
60 HA ASN 10 HA ASN 10 -6.088 4.849 -2.173
61 1HB ASN 10 2HB ASN 10 -4.018 6.835 -3.105
62 2HB ASN 10 1HB ASN 10 -5.376 6.409 -4.146
63 1HD2 ASN 10 1HD2 ASN 10 -5.338 9.032 -3.362
64 2HD2 ASN 10 2HD2 ASN 10 -6.494 9.331 -2.155
65 HA PRO 11 HA PRO 11 -4.403 1.602 -4.675
66 1HB PRO 11 2HB PRO 11 -6.548 1.208 -6.328
67 2HB PRO 11 1HB PRO 11 -6.514 0.659 -4.640
68 1HG PRO 11 2HG PRO 11 -7.815 3.059 -5.823
69 2HG PRO 11 1HG PRO 11 -8.391 1.977 -4.545
70 1HD PRO 11 2HD PRO 11 -7.300 4.432 -4.065
71 2HD PRO 11 1HD PRO 11 -7.237 3.084 -2.908
72 H SER 12 H SER 12 -5.712 4.571 -6.063
73 HA SER 12 HA SER 12 -4.514 4.078 -8.719
74 1HB SER 12 2HB SER 12 -5.527 6.346 -9.139
75 2HB SER 12 1HB SER 12 -6.684 5.157 -8.549
76 HG SER 12 HG SER 12 -5.688 7.444 -7.352
77 H ASN 13 H ASN 13 -4.006 6.267 -5.927
78 HA ASN 13 HA ASN 13 -1.682 7.560 -7.167
79 1HB ASN 13 2HB ASN 13 -3.501 8.312 -5.334
80 2HB ASN 13 1HB ASN 13 -2.258 7.704 -4.240
81 1HD2 ASN 13 1HD2 ASN 13 -2.925 10.160 -6.729
82 2HD2 ASN 13 2HD2 ASN 13 -1.572 11.124 -6.380
83 H ASP 14 H ASP 14 -2.266 5.064 -4.717
84 HA ASP 14 HA ASP 14 -0.829 3.519 -3.683
85 1HB ASP 14 2HB ASP 14 -0.062 3.896 -6.445
86 2HB ASP 14 1HB ASP 14 1.364 3.524 -5.476
87 H GLN 15 H GLN 15 -0.384 5.012 -1.911
88 HA GLN 15 HA GLN 15 2.191 6.520 -2.094
89 1HB GLN 15 2HB GLN 15 -0.229 6.586 -0.278
90 2HB GLN 15 1HB GLN 15 1.238 7.498 0.079
91 1HG GLN 15 2HG GLN 15 1.060 8.642 -2.104
92 2HG GLN 15 1HG GLN 15 -0.411 7.735 -2.457
93 1HE2 GLN 15 1HE2 GLN 15 -2.280 8.090 -0.881
94 2HE2 GLN 15 2HE2 GLN 15 -2.416 9.604 -0.127
95 H CYS 16 H CYS 16 1.870 3.483 -1.632
96 HA CYS 16 HA CYS 16 2.731 3.091 1.156
97 1HB CYS 16 2HB CYS 16 2.493 1.286 -1.273
98 2HB CYS 16 1HB CYS 16 2.897 0.713 0.344
99 H CYS 17 H CYS 17 4.842 1.972 1.608
100 HA CYS 17 HA CYS 17 7.035 3.273 0.139
101 1HB CYS 17 2HB CYS 17 6.542 2.516 2.747
102 2HB CYS 17 1HB CYS 17 7.661 1.266 2.205
103 H LYS 18 H LYS 18 7.768 2.327 -1.710
104 HA LYS 18 HA LYS 18 7.315 -0.432 -2.434
105 1HB LYS 18 2HB LYS 18 7.801 1.776 -3.802
106 2HB LYS 18 1HB LYS 18 9.485 1.287 -3.607
107 1HG LYS 18 2HG LYS 18 8.776 -1.008 -4.483
108 2HG LYS 18 1HG LYS 18 7.251 -0.251 -4.944
109 1HD LYS 18 2HD LYS 18 8.215 0.504 -6.828
110 2HD LYS 18 1HD LYS 18 9.331 1.460 -5.853
111 1HE LYS 18 2HE LYS 18 11.052 -0.020 -6.150
112 2HE LYS 18 1HE LYS 18 9.983 -1.431 -6.029
113 1HZ LYS 18 1HZ LYS 18 10.104 0.430 -8.346
114 2HZ LYS 18 2HZ LYS 18 9.116 -0.948 -8.220
115 3HZ LYS 18 3HZ LYS 18 10.805 -1.114 -8.302
116 H SER 19 H SER 19 9.872 1.194 -0.657
117 HA SER 19 HA SER 19 12.022 -0.649 -1.023
118 1HB SER 19 2HB SER 19 11.163 1.205 1.209
119 2HB SER 19 1HB SER 19 12.675 0.305 1.271
120 HG SER 19 HG SER 19 13.484 1.701 -0.064
121 H SER 20 H SER 20 9.183 -0.758 1.106
122 HA SER 20 HA SER 20 10.176 -3.299 2.331
123 1HB SER 20 2HB SER 20 8.081 -1.234 3.032
124 2HB SER 20 1HB SER 20 8.173 -2.782 3.868
125 HG SER 20 HG SER 20 9.857 -0.584 3.957
126 H ASN 21 H ASN 21 8.939 -2.966 -0.462
127 HA ASN 21 HA ASN 21 7.370 -4.082 -1.823
128 1HB ASN 21 2HB ASN 21 8.626 -5.827 -0.088
129 2HB ASN 21 1HB ASN 21 6.923 -6.199 0.176
130 1HD2 ASN 21 1HD2 ASN 21 9.464 -6.077 -2.326
131 2HD2 ASN 21 2HD2 ASN 21 8.639 -7.056 -3.441
132 H LEU 22 H LEU 22 6.079 -2.043 -0.623
133 HA LEU 22 HA LEU 22 3.594 -3.221 0.581
134 1HB LEU 22 2HB LEU 22 4.875 -0.475 0.768
135 2HB LEU 22 1HB LEU 22 3.321 -0.888 1.489
136 HG LEU 22 HG LEU 22 5.843 -2.445 2.093
137 1HD1 LEU 22 1HD1 LEU 22 6.266 -0.152 2.770
138 2HD1 LEU 22 2HD1 LEU 22 5.906 -1.101 4.212
139 3HD1 LEU 22 3HD1 LEU 22 4.676 -0.040 3.524
140 1HD2 LEU 22 1HD2 LEU 22 3.127 -2.165 3.416
141 2HD2 LEU 22 2HD2 LEU 22 4.490 -3.009 4.150
142 3HD2 LEU 22 3HD2 LEU 22 3.788 -3.607 2.647
143 H VAL 23 H VAL 23 1.809 -3.149 -0.711
144 HA VAL 23 HA VAL 23 1.727 -1.129 -2.937
145 HB VAL 23 HB VAL 23 0.375 -3.839 -2.885
146 1HG1 VAL 23 1HG1 VAL 23 0.973 -1.737 -4.951
147 2HG1 VAL 23 2HG1 VAL 23 -0.552 -2.553 -4.608
148 3HG1 VAL 23 3HG1 VAL 23 0.743 -3.417 -5.438
149 1HG2 VAL 23 1HG2 VAL 23 2.349 -4.500 -4.407
150 2HG2 VAL 23 2HG2 VAL 23 2.681 -4.411 -2.678
151 3HG2 VAL 23 3HG2 VAL 23 3.180 -3.095 -3.741
152 H CYS 24 H CYS 24 -0.539 -0.459 -3.500
153 HA CYS 24 HA CYS 24 -2.151 -0.119 -1.040
154 1HB CYS 24 2HB CYS 24 -1.962 1.103 -3.767
155 2HB CYS 24 1HB CYS 24 -3.473 1.287 -2.878
156 H SER 25 H SER 25 -4.082 -1.158 -0.677
157 HA SER 25 HA SER 25 -4.979 -3.175 -2.678
158 1HB SER 25 2HB SER 25 -4.471 -3.725 -0.272
159 2HB SER 25 1HB SER 25 -5.815 -2.690 0.199
160 HG SER 25 HG SER 25 -5.892 -5.220 -0.532
161 H ARG 26 H ARG 26 -7.301 -3.340 -3.161
162 HA ARG 26 HA ARG 26 -8.602 -0.677 -3.344
163 1HB ARG 26 2HB ARG 26 -8.269 -2.448 -5.216
164 2HB ARG 26 1HB ARG 26 -9.600 -3.309 -4.442
165 1HG ARG 26 2HG ARG 26 -11.101 -1.464 -4.773
166 2HG ARG 26 1HG ARG 26 -9.783 -0.402 -5.270
167 1HD ARG 26 2HD ARG 26 -10.291 -2.940 -6.814
168 2HD ARG 26 1HD ARG 26 -11.278 -1.500 -7.130
169 HE ARG 26 HE ARG 26 -8.287 -1.538 -7.320
170 1HH1 ARG 26 1HH2 ARG 26 -10.018 -1.566 -9.805
171 2HH1 ARG 26 2HH2 ARG 26 -10.045 0.112 -10.231
172 1HH2 ARG 26 2HH1 ARG 26 -8.908 1.190 -7.129
173 2HH2 ARG 26 1HH1 ARG 26 -9.414 1.677 -8.712
174 H LYS 27 H LYS 27 -9.389 -3.982 -2.183
175 HA LYS 27 HA LYS 27 -11.925 -3.192 -0.992
176 1HB LYS 27 2HB LYS 27 -10.090 -5.595 -0.839
177 2HB LYS 27 1HB LYS 27 -11.590 -5.515 0.084
178 1HG LYS 27 2HG LYS 27 -12.528 -4.784 -2.341
179 2HG LYS 27 1HG LYS 27 -11.184 -5.808 -2.846
180 1HD LYS 27 2HD LYS 27 -12.040 -7.632 -1.409
181 2HD LYS 27 1HD LYS 27 -13.397 -6.610 -0.932
182 1HE LYS 27 2HE LYS 27 -14.433 -7.679 -2.693
183 2HE LYS 27 1HE LYS 27 -13.597 -6.440 -3.649
184 1HZ LYS 27 1HZ LYS 27 -11.686 -7.932 -3.823
185 2HZ LYS 27 2HZ LYS 27 -13.078 -8.642 -4.490
186 3HZ LYS 27 3HZ LYS 27 -12.524 -9.127 -2.959
187 H HIS 28 H HIS 28 -8.591 -3.545 0.181
188 HA HIS 28 HA HIS 28 -9.396 -2.966 2.975
189 1HB HIS 28 2HB HIS 28 -6.746 -3.543 1.611
190 2HB HIS 28 1HB HIS 28 -6.948 -3.358 3.352
191 HD1 HIS 28 HD1 HIS 28 -7.934 -5.628 0.489
192 HD2 HIS 28 HD2 HIS 28 -8.034 -5.602 4.656
193 HE1 HIS 28 HE1 HIS 28 -8.618 -7.958 1.202
194 H ARG 29 H ARG 29 -8.052 -1.320 0.184
195 HA ARG 29 HA ARG 29 -7.349 0.904 -0.151
196 1HB ARG 29 2HB ARG 29 -9.461 0.884 1.949
197 2HB ARG 29 1HB ARG 29 -8.561 2.389 1.761
198 1HG ARG 29 2HG ARG 29 -9.705 2.882 -0.110
199 2HG ARG 29 1HG ARG 29 -9.219 1.353 -0.842
200 1HD ARG 29 2HD ARG 29 -11.084 0.245 0.504
201 2HD ARG 29 1HD ARG 29 -11.654 1.882 0.886
202 HE ARG 29 HE ARG 29 -11.174 1.205 -1.971
203 1HH1 ARG 29 1HH2 ARG 29 -13.654 -0.145 -1.125
204 2HH1 ARG 29 2HH2 ARG 29 -14.862 1.075 -1.352
205 1HH2 ARG 29 2HH1 ARG 29 -12.574 3.686 -1.505
206 2HH2 ARG 29 1HH1 ARG 29 -14.249 3.251 -1.567
207 H TRP 30 H TRP 30 -5.467 -0.658 1.252
208 HA TRP 30 HA TRP 30 -4.101 1.444 2.830
209 1HB TRP 30 2HB TRP 30 -3.919 0.105 4.799
210 2HB TRP 30 1HB TRP 30 -5.604 -0.005 4.313
211 HD1 TRP 30 HD1 TRP 30 -4.518 -2.161 1.856
212 HE1 TRP 30 HE1 TRP 30 -4.294 -4.616 2.594
213 HE3 TRP 30 HE3 TRP 30 -4.397 -1.549 6.923
214 HZ2 TRP 30 HZ2 TRP 30 -4.094 -6.126 5.012
215 HZ3 TRP 30 HZ3 TRP 30 -4.192 -3.513 8.419
216 HH2 TRP 30 HH2 TRP 30 -4.039 -5.799 7.471
217 H CYS 31 H CYS 31 -1.879 0.208 3.663
218 HA CYS 31 HA CYS 31 -0.593 -0.668 1.149
219 1HB CYS 31 2HB CYS 31 0.365 0.027 3.940
220 2HB CYS 31 1HB CYS 31 1.457 -0.506 2.664
221 H LYS 32 H LYS 32 -0.347 -2.813 0.686
222 HA LYS 32 HA LYS 32 -0.470 -4.790 2.943
223 1HB LYS 32 2HB LYS 32 -2.252 -4.526 0.975
224 2HB LYS 32 1HB LYS 32 -1.066 -5.485 0.089
225 1HG LYS 32 2HG LYS 32 -1.231 -6.784 2.539
226 2HG LYS 32 1HG LYS 32 -2.898 -6.303 2.219
227 1HD LYS 32 2HD LYS 32 -2.824 -7.370 0.022
228 2HD LYS 32 1HD LYS 32 -1.124 -7.779 0.251
229 1HE LYS 32 2HE LYS 32 -2.126 -9.782 0.913
230 2HE LYS 32 1HE LYS 32 -2.072 -8.936 2.471
231 1HZ LYS 32 1HZ LYS 32 -4.340 -8.851 0.547
232 2HZ LYS 32 2HZ LYS 32 -4.279 -8.061 2.051
233 3HZ LYS 32 3HZ LYS 32 -4.311 -9.758 1.980
234 H TYR 33 H TYR 33 0.924 -6.691 2.689
235 HA TYR 33 HA TYR 33 3.500 -6.038 1.409
236 1HB TYR 33 2HB TYR 33 2.597 -7.439 3.675
237 2HB TYR 33 1HB TYR 33 3.257 -8.679 2.608
238 HD1 TYR 33 HD1 TYR 33 4.012 -5.554 4.444
239 HD2 TYR 33 HD2 TYR 33 5.613 -8.756 2.068
240 HE1 TYR 33 HE1 TYR 33 6.312 -4.856 5.052
241 HE2 TYR 33 HE2 TYR 33 7.913 -8.058 2.678
242 HH TYR 33 HH TYR 33 8.855 -5.415 3.568
243 H GLU 34 H GLU 34 4.130 -6.849 -0.550
244 HA GLU 34 HA GLU 34 2.327 -8.732 -1.967
245 1HB GLU 34 2HB GLU 34 3.842 -6.472 -2.627
246 2HB GLU 34 1HB GLU 34 4.721 -7.812 -3.363
247 1HG GLU 34 2HG GLU 34 1.736 -7.432 -3.680
248 2HG GLU 34 1HG GLU 34 2.915 -6.780 -4.818
249 H ILE 35 H ILE 35 3.089 -10.722 -2.852
250 HA ILE 35 HA ILE 35 5.284 -11.993 -1.340
251 HB ILE 35 HB ILE 35 3.327 -12.992 -3.442
252 1HG1 ILE 35 1HG1 ILE 35 2.831 -14.142 -0.916
253 2HG1 ILE 35 2HG1 ILE 35 3.102 -12.428 -0.601
254 1HG2 ILE 35 1HG2 ILE 35 5.379 -14.395 -1.723
255 2HG2 ILE 35 2HG2 ILE 35 3.981 -15.246 -2.380
256 3HG2 ILE 35 3HG2 ILE 35 5.157 -14.508 -3.468
257 1HD1 ILE 35 1HD1 ILE 35 1.258 -13.397 -2.794
258 2HD1 ILE 35 2HD1 ILE 35 0.696 -13.097 -1.149
259 3HD1 ILE 35 3HD1 ILE 35 1.367 -11.776 -2.106
260 1HN NH2 36 1HN NH2 36 7.520 -10.749 -3.709
261 2HN NH2 36 2HN NH2 36 6.626 -10.435 -2.205
Start of MODEL 8
1 1H GLU 1 1H GLU 1 5.034 10.193 2.999
2 2H GLU 1 2H GLU 1 5.336 11.409 1.852
3 3H GLU 1 3H GLU 1 6.631 10.635 2.636
4 HA GLU 1 HA GLU 1 4.734 9.353 0.728
5 1HB GLU 1 2HB GLU 1 7.112 10.957 0.471
6 2HB GLU 1 1HB GLU 1 7.467 9.316 -0.072
7 1HG GLU 1 2HG GLU 1 5.450 9.384 -1.525
8 2HG GLU 1 1HG GLU 1 5.169 11.052 -1.022
9 H CYS 2 H CYS 2 5.556 7.156 0.112
10 HA CYS 2 HA CYS 2 6.251 4.976 0.662
11 1HB CYS 2 2HB CYS 2 8.384 6.578 0.924
12 2HB CYS 2 1HB CYS 2 8.233 6.085 2.609
13 H LEU 3 H LEU 3 4.328 4.394 1.796
14 HA LEU 3 HA LEU 3 4.126 4.937 4.700
15 1HB LEU 3 2HB LEU 3 2.400 3.594 2.602
16 2HB LEU 3 1HB LEU 3 1.952 3.631 4.307
17 HG LEU 3 HG LEU 3 2.678 6.174 2.860
18 1HD1 LEU 3 1HD1 LEU 3 0.829 4.836 1.664
19 2HD1 LEU 3 2HD1 LEU 3 0.434 6.487 2.143
20 3HD1 LEU 3 3HD1 LEU 3 -0.147 5.128 3.105
21 1HD2 LEU 3 1HD2 LEU 3 0.777 5.613 5.157
22 2HD2 LEU 3 2HD2 LEU 3 1.355 7.189 4.617
23 3HD2 LEU 3 3HD2 LEU 3 2.470 6.053 5.376
24 H GLY 4 H GLY 4 4.161 3.261 6.285
25 1HA GLY 4 2HA GLY 4 5.889 1.005 5.701
26 2HA GLY 4 1HA GLY 4 5.082 1.314 7.237
27 H PHE 5 H PHE 5 4.980 -1.223 6.779
28 HA PHE 5 HA PHE 5 2.912 -2.152 4.958
29 1HB PHE 5 2HB PHE 5 4.689 -3.633 5.560
30 2HB PHE 5 1HB PHE 5 4.464 -3.321 7.281
31 HD1 PHE 5 HD1 PHE 5 3.284 -4.887 8.536
32 HD2 PHE 5 HD2 PHE 5 2.504 -4.573 4.324
33 HE1 PHE 5 HE1 PHE 5 1.707 -6.795 8.684
34 HE2 PHE 5 HE2 PHE 5 0.930 -6.482 4.472
35 HZ PHE 5 HZ PHE 5 0.531 -7.593 6.653
36 H GLY 6 H GLY 6 0.735 -2.444 5.376
37 1HA GLY 6 2HA GLY 6 -1.296 -2.483 6.543
38 2HA GLY 6 1HA GLY 6 -0.375 -2.659 8.036
39 H LYS 7 H LYS 7 -0.175 -0.017 5.659
40 HA LYS 7 HA LYS 7 -0.932 1.894 7.842
41 1HB LYS 7 2HB LYS 7 0.987 1.873 5.547
42 2HB LYS 7 1HB LYS 7 0.275 3.424 5.990
43 1HG LYS 7 2HG LYS 7 1.483 1.619 8.083
44 2HG LYS 7 1HG LYS 7 2.485 2.733 7.155
45 1HD LYS 7 2HD LYS 7 -0.015 3.788 8.424
46 2HD LYS 7 1HD LYS 7 1.391 3.495 9.448
47 1HE LYS 7 2HE LYS 7 2.713 4.833 7.636
48 2HE LYS 7 1HE LYS 7 1.113 5.422 7.143
49 1HZ LYS 7 1HZ LYS 7 2.209 5.505 9.908
50 2HZ LYS 7 2HZ LYS 7 0.672 6.054 9.435
51 3HZ LYS 7 3HZ LYS 7 2.069 6.837 8.868
52 H GLY 8 H GLY 8 -2.719 3.196 7.504
53 1HA GLY 8 2HA GLY 8 -4.642 2.613 5.505
54 2HA GLY 8 1HA GLY 8 -4.623 4.090 6.468
55 H CYS 9 H CYS 9 -4.418 2.935 3.348
56 HA CYS 9 HA CYS 9 -3.220 5.510 2.398
57 1HB CYS 9 2HB CYS 9 -2.039 4.128 0.649
58 2HB CYS 9 1HB CYS 9 -1.485 3.813 2.291
59 H ASN 10 H ASN 10 -3.604 5.539 -0.170
60 HA ASN 10 HA ASN 10 -6.518 5.059 -0.560
61 1HB ASN 10 2HB ASN 10 -4.415 6.684 -2.025
62 2HB ASN 10 1HB ASN 10 -6.109 6.607 -2.508
63 1HD2 ASN 10 1HD2 ASN 10 -4.106 8.661 -0.992
64 2HD2 ASN 10 2HD2 ASN 10 -5.146 9.326 0.173
65 HA PRO 11 HA PRO 11 -5.554 1.594 -3.171
66 1HB PRO 11 2HB PRO 11 -8.012 1.351 -4.366
67 2HB PRO 11 1HB PRO 11 -7.674 0.795 -2.715
68 1HG PRO 11 2HG PRO 11 -9.009 3.294 -3.633
69 2HG PRO 11 1HG PRO 11 -9.403 2.240 -2.265
70 1HD PRO 11 2HD PRO 11 -8.079 4.593 -1.982
71 2HD PRO 11 1HD PRO 11 -7.837 3.208 -0.894
72 H SER 12 H SER 12 -7.230 4.466 -4.481
73 HA SER 12 HA SER 12 -6.512 3.974 -7.256
74 1HB SER 12 2HB SER 12 -8.277 5.562 -5.922
75 2HB SER 12 1HB SER 12 -7.006 6.734 -6.261
76 HG SER 12 HG SER 12 -8.772 5.485 -7.953
77 H ASN 13 H ASN 13 -5.160 5.965 -4.623
78 HA ASN 13 HA ASN 13 -2.715 6.437 -6.296
79 1HB ASN 13 2HB ASN 13 -4.275 8.363 -5.544
80 2HB ASN 13 1HB ASN 13 -3.656 8.061 -3.921
81 1HD2 ASN 13 1HD2 ASN 13 -2.942 9.566 -6.967
82 2HD2 ASN 13 2HD2 ASN 13 -1.363 10.063 -6.589
83 H ASP 14 H ASP 14 -2.222 4.163 -5.375
84 HA ASP 14 HA ASP 14 -1.772 3.660 -2.617
85 1HB ASP 14 2HB ASP 14 -0.413 1.806 -3.448
86 2HB ASP 14 1HB ASP 14 -1.817 2.003 -4.492
87 H GLN 15 H GLN 15 -0.176 4.297 -1.222
88 HA GLN 15 HA GLN 15 2.242 5.674 -2.353
89 1HB GLN 15 2HB GLN 15 0.134 6.516 -0.464
90 2HB GLN 15 1HB GLN 15 1.774 6.852 0.091
91 1HG GLN 15 2HG GLN 15 2.126 7.775 -2.337
92 2HG GLN 15 1HG GLN 15 0.364 7.872 -2.361
93 1HE2 GLN 15 1HE2 GLN 15 -0.669 9.231 -0.625
94 2HE2 GLN 15 2HE2 GLN 15 0.218 10.499 0.073
95 H CYS 16 H CYS 16 1.872 2.846 -1.395
96 HA CYS 16 HA CYS 16 3.133 2.653 1.236
97 1HB CYS 16 2HB CYS 16 2.642 0.644 -0.988
98 2HB CYS 16 1HB CYS 16 3.108 0.235 0.663
99 H CYS 17 H CYS 17 5.243 1.376 1.454
100 HA CYS 17 HA CYS 17 7.327 2.652 -0.146
101 1HB CYS 17 2HB CYS 17 7.161 0.693 2.136
102 2HB CYS 17 1HB CYS 17 8.707 0.977 1.337
103 H LYS 18 H LYS 18 8.191 1.853 -2.003
104 HA LYS 18 HA LYS 18 7.300 -0.651 -3.172
105 1HB LYS 18 2HB LYS 18 7.980 1.536 -4.308
106 2HB LYS 18 1HB LYS 18 9.651 1.086 -3.971
107 1HG LYS 18 2HG LYS 18 9.342 -1.018 -5.226
108 2HG LYS 18 1HG LYS 18 7.671 -0.567 -5.568
109 1HD LYS 18 2HD LYS 18 8.334 1.278 -6.920
110 2HD LYS 18 1HD LYS 18 9.997 1.205 -6.334
111 1HE LYS 18 2HE LYS 18 9.963 -1.226 -7.356
112 2HE LYS 18 1HE LYS 18 8.616 -0.586 -8.319
113 1HZ LYS 18 1HZ LYS 18 10.005 1.309 -8.926
114 2HZ LYS 18 2HZ LYS 18 10.726 -0.149 -9.415
115 3HZ LYS 18 3HZ LYS 18 11.301 0.664 -8.040
116 H SER 19 H SER 19 10.194 0.375 -1.390
117 HA SER 19 HA SER 19 11.933 -1.798 -1.995
118 1HB SER 19 2HB SER 19 12.329 0.418 -0.743
119 2HB SER 19 1HB SER 19 11.693 -0.404 0.680
120 HG SER 19 HG SER 19 14.114 -0.647 -0.568
121 H SER 20 H SER 20 9.310 -1.521 0.406
122 HA SER 20 HA SER 20 9.883 -4.239 1.459
123 1HB SER 20 2HB SER 20 9.291 -2.188 2.846
124 2HB SER 20 1HB SER 20 7.671 -2.291 2.164
125 HG SER 20 HG SER 20 7.274 -3.969 3.388
126 H ASN 21 H ASN 21 8.559 -3.405 -1.337
127 HA ASN 21 HA ASN 21 6.857 -4.241 -2.736
128 1HB ASN 21 2HB ASN 21 7.653 -6.440 -0.844
129 2HB ASN 21 1HB ASN 21 6.356 -6.730 -2.003
130 1HD2 ASN 21 1HD2 ASN 21 6.906 -6.535 -4.337
131 2HD2 ASN 21 2HD2 ASN 21 8.519 -6.679 -4.844
132 H LEU 22 H LEU 22 5.640 -2.481 -1.190
133 HA LEU 22 HA LEU 22 3.323 -3.866 0.114
134 1HB LEU 22 2HB LEU 22 4.610 -1.144 0.471
135 2HB LEU 22 1HB LEU 22 3.101 -1.609 1.257
136 HG LEU 22 HG LEU 22 5.705 -3.138 1.533
137 1HD1 LEU 22 1HD1 LEU 22 4.368 -1.139 3.381
138 2HD1 LEU 22 2HD1 LEU 22 5.927 -0.948 2.579
139 3HD1 LEU 22 3HD1 LEU 22 5.726 -2.168 3.837
140 1HD2 LEU 22 1HD2 LEU 22 4.433 -4.123 3.501
141 2HD2 LEU 22 2HD2 LEU 22 3.811 -4.575 1.914
142 3HD2 LEU 22 3HD2 LEU 22 2.988 -3.336 2.863
143 H VAL 23 H VAL 23 1.282 -3.480 -0.694
144 HA VAL 23 HA VAL 23 0.958 -1.336 -2.767
145 HB VAL 23 HB VAL 23 -0.536 -3.045 -3.940
146 1HG1 VAL 23 1HG1 VAL 23 2.387 -3.787 -3.633
147 2HG1 VAL 23 2HG1 VAL 23 1.778 -2.501 -4.675
148 3HG1 VAL 23 3HG1 VAL 23 1.349 -4.180 -5.003
149 1HG2 VAL 23 1HG2 VAL 23 -0.725 -4.525 -1.886
150 2HG2 VAL 23 2HG2 VAL 23 0.944 -5.015 -2.171
151 3HG2 VAL 23 3HG2 VAL 23 -0.298 -5.377 -3.369
152 H CYS 24 H CYS 24 -0.907 -0.123 -2.492
153 HA CYS 24 HA CYS 24 -2.454 -0.422 -0.066
154 1HB CYS 24 2HB CYS 24 -1.849 1.661 -1.515
155 2HB CYS 24 1HB CYS 24 -3.264 1.210 -2.469
156 H SER 25 H SER 25 -4.096 -1.845 0.227
157 HA SER 25 HA SER 25 -5.265 -3.391 -1.935
158 1HB SER 25 2HB SER 25 -4.871 -4.126 0.436
159 2HB SER 25 1HB SER 25 -6.142 -3.022 0.950
160 HG SER 25 HG SER 25 -6.294 -5.448 -0.385
161 H ARG 26 H ARG 26 -7.666 -3.465 -2.303
162 HA ARG 26 HA ARG 26 -8.781 -0.715 -2.508
163 1HB ARG 26 2HB ARG 26 -9.070 -3.347 -3.853
164 2HB ARG 26 1HB ARG 26 -10.546 -2.388 -3.749
165 1HG ARG 26 2HG ARG 26 -8.678 -0.500 -4.495
166 2HG ARG 26 1HG ARG 26 -8.130 -1.933 -5.364
167 1HD ARG 26 2HD ARG 26 -9.688 -0.989 -6.866
168 2HD ARG 26 1HD ARG 26 -10.678 -2.182 -6.002
169 HE ARG 26 HE ARG 26 -11.221 -0.200 -4.413
170 1HH1 ARG 26 2HH1 ARG 26 -12.820 -0.246 -6.974
171 2HH1 ARG 26 1HH1 ARG 26 -12.640 1.383 -7.532
172 1HH2 ARG 26 1HH2 ARG 26 -9.935 2.073 -5.462
173 2HH2 ARG 26 2HH2 ARG 26 -11.001 2.701 -6.674
174 H LYS 27 H LYS 27 -9.559 -3.903 -1.106
175 HA LYS 27 HA LYS 27 -12.091 -2.980 0.058
176 1HB LYS 27 2HB LYS 27 -11.446 -5.327 -0.756
177 2HB LYS 27 1HB LYS 27 -10.481 -5.462 0.713
178 1HG LYS 27 2HG LYS 27 -13.140 -4.465 1.320
179 2HG LYS 27 1HG LYS 27 -13.229 -5.998 0.454
180 1HD LYS 27 2HD LYS 27 -12.492 -7.148 2.248
181 2HD LYS 27 1HD LYS 27 -11.132 -6.048 2.471
182 1HE LYS 27 2HE LYS 27 -12.348 -5.684 4.447
183 2HE LYS 27 1HE LYS 27 -13.012 -4.416 3.399
184 1HZ LYS 27 1HZ LYS 27 -14.134 -7.156 3.695
185 2HZ LYS 27 2HZ LYS 27 -14.771 -5.914 2.724
186 3HZ LYS 27 3HZ LYS 27 -14.774 -5.761 4.415
187 H HIS 28 H HIS 28 -8.800 -3.720 1.259
188 HA HIS 28 HA HIS 28 -9.521 -2.827 3.993
189 1HB HIS 28 2HB HIS 28 -7.055 -3.995 2.673
190 2HB HIS 28 1HB HIS 28 -7.092 -3.515 4.370
191 HD1 HIS 28 HD1 HIS 28 -9.585 -4.558 5.494
192 HD2 HIS 28 HD2 HIS 28 -7.554 -6.697 2.548
193 HE1 HIS 28 HE1 HIS 28 -10.371 -6.957 5.682
194 H ARG 29 H ARG 29 -8.035 -1.543 1.110
195 HA ARG 29 HA ARG 29 -6.969 0.509 0.656
196 1HB ARG 29 2HB ARG 29 -8.775 1.102 3.013
197 2HB ARG 29 1HB ARG 29 -7.920 2.368 2.133
198 1HG ARG 29 2HG ARG 29 -9.457 2.330 0.491
199 2HG ARG 29 1HG ARG 29 -9.215 0.599 0.259
200 1HD ARG 29 2HD ARG 29 -11.242 0.209 1.186
201 2HD ARG 29 1HD ARG 29 -10.686 0.957 2.695
202 HE ARG 29 HE ARG 29 -12.314 2.260 0.653
203 1HH1 ARG 29 1HH2 ARG 29 -12.101 2.658 3.746
204 2HH1 ARG 29 2HH2 ARG 29 -11.567 4.305 3.798
205 1HH2 ARG 29 2HH1 ARG 29 -10.694 4.405 0.435
206 2HH2 ARG 29 1HH1 ARG 29 -10.769 5.297 1.917
207 H TRP 30 H TRP 30 -5.265 -1.205 2.032
208 HA TRP 30 HA TRP 30 -3.686 0.733 3.641
209 1HB TRP 30 2HB TRP 30 -3.595 -0.667 5.534
210 2HB TRP 30 1HB TRP 30 -5.268 -0.801 5.015
211 HD1 TRP 30 HD1 TRP 30 -4.543 -2.869 2.548
212 HE1 TRP 30 HE1 TRP 30 -4.083 -5.325 3.167
213 HE3 TRP 30 HE3 TRP 30 -3.443 -2.339 7.503
214 HZ2 TRP 30 HZ2 TRP 30 -3.355 -6.867 5.460
215 HZ3 TRP 30 HZ3 TRP 30 -2.875 -4.317 8.882
216 HH2 TRP 30 HH2 TRP 30 -2.830 -6.578 7.868
217 H CYS 31 H CYS 31 -1.399 -0.135 3.994
218 HA CYS 31 HA CYS 31 -0.329 -1.088 1.470
219 1HB CYS 31 2HB CYS 31 0.827 -0.561 4.219
220 2HB CYS 31 1HB CYS 31 1.820 -1.032 2.842
221 H LYS 32 H LYS 32 -0.835 -3.206 0.962
222 HA LYS 32 HA LYS 32 -0.397 -5.318 3.035
223 1HB LYS 32 2HB LYS 32 -2.555 -4.904 1.569
224 2HB LYS 32 1HB LYS 32 -1.628 -5.744 0.324
225 1HG LYS 32 2HG LYS 32 -1.470 -7.097 2.907
226 2HG LYS 32 1HG LYS 32 -3.131 -6.952 2.335
227 1HD LYS 32 2HD LYS 32 -2.762 -8.278 0.487
228 2HD LYS 32 1HD LYS 32 -1.071 -7.794 0.348
229 1HE LYS 32 2HE LYS 32 -0.734 -9.099 2.580
230 2HE LYS 32 1HE LYS 32 -2.287 -9.861 2.182
231 1HZ LYS 32 1HZ LYS 32 0.069 -9.692 0.374
232 2HZ LYS 32 2HZ LYS 32 -1.422 -10.412 -0.006
233 3HZ LYS 32 3HZ LYS 32 -0.434 -11.084 1.202
234 H TYR 33 H TYR 33 0.686 -7.345 2.209
235 HA TYR 33 HA TYR 33 3.162 -6.711 0.822
236 1HB TYR 33 2HB TYR 33 2.084 -8.735 2.500
237 2HB TYR 33 1HB TYR 33 2.614 -9.537 1.020
238 HD1 TYR 33 HD1 TYR 33 4.928 -9.787 0.506
239 HD2 TYR 33 HD2 TYR 33 3.700 -7.258 3.754
240 HE1 TYR 33 HE1 TYR 33 7.287 -9.587 1.242
241 HE2 TYR 33 HE2 TYR 33 6.058 -7.058 4.491
242 HH TYR 33 HH TYR 33 8.319 -8.912 3.942
243 H GLU 34 H GLU 34 3.507 -6.775 -1.355
244 HA GLU 34 HA GLU 34 1.382 -7.566 -3.198
245 1HB GLU 34 2HB GLU 34 3.016 -5.664 -3.483
246 2HB GLU 34 1HB GLU 34 4.293 -6.859 -3.712
247 1HG GLU 34 2HG GLU 34 1.929 -7.339 -5.396
248 2HG GLU 34 1HG GLU 34 2.730 -5.804 -5.732
249 H ILE 35 H ILE 35 1.052 -9.660 -3.818
250 HA ILE 35 HA ILE 35 3.256 -11.645 -3.512
251 HB ILE 35 HB ILE 35 0.260 -11.833 -3.969
252 1HG1 ILE 35 1HG1 ILE 35 1.868 -12.791 -1.596
253 2HG1 ILE 35 2HG1 ILE 35 1.267 -11.136 -1.691
254 1HG2 ILE 35 1HG2 ILE 35 2.385 -13.977 -3.780
255 2HG2 ILE 35 2HG2 ILE 35 0.686 -14.305 -3.442
256 3HG2 ILE 35 3HG2 ILE 35 1.177 -13.756 -5.045
257 1HD1 ILE 35 1HD1 ILE 35 -1.038 -12.037 -2.033
258 2HD1 ILE 35 2HD1 ILE 35 -0.402 -13.665 -1.800
259 3HD1 ILE 35 3HD1 ILE 35 -0.349 -12.500 -0.477
260 1HN NH2 36 1HN NH2 36 0.783 -11.673 -6.278
261 2HN NH2 36 2HN NH2 36 1.918 -12.759 -6.879
Start of MODEL 9
1 1H GLU 1 1H GLU 1 9.689 8.383 -0.600
2 2H GLU 1 2H GLU 1 9.097 9.328 0.680
3 3H GLU 1 3H GLU 1 9.195 9.982 -0.884
4 HA GLU 1 HA GLU 1 6.912 9.152 0.023
5 1HB GLU 1 2HB GLU 1 6.381 8.568 -2.380
6 2HB GLU 1 1HB GLU 1 7.280 10.070 -2.189
7 1HG GLU 1 2HG GLU 1 9.386 8.505 -2.495
8 2HG GLU 1 1HG GLU 1 8.220 7.422 -3.252
9 H CYS 2 H CYS 2 7.260 7.367 1.572
10 HA CYS 2 HA CYS 2 6.844 4.716 0.296
11 1HB CYS 2 2HB CYS 2 9.300 5.682 1.549
12 2HB CYS 2 1HB CYS 2 8.701 4.222 2.333
13 H LEU 3 H LEU 3 4.816 4.391 1.265
14 HA LEU 3 HA LEU 3 4.326 5.100 4.075
15 1HB LEU 3 2HB LEU 3 2.797 3.786 1.829
16 2HB LEU 3 1HB LEU 3 2.144 3.796 3.466
17 HG LEU 3 HG LEU 3 3.105 6.321 2.113
18 1HD1 LEU 3 1HD1 LEU 3 0.750 6.763 1.528
19 2HD1 LEU 3 2HD1 LEU 3 0.296 5.174 2.143
20 3HD1 LEU 3 3HD1 LEU 3 1.331 5.306 0.722
21 1HD2 LEU 3 1HD2 LEU 3 2.562 5.903 4.708
22 2HD2 LEU 3 2HD2 LEU 3 0.916 6.186 4.143
23 3HD2 LEU 3 3HD2 LEU 3 2.152 7.420 3.908
24 H GLY 4 H GLY 4 4.009 3.582 5.786
25 1HA GLY 4 2HA GLY 4 5.614 1.155 5.593
26 2HA GLY 4 1HA GLY 4 4.745 1.710 7.023
27 H PHE 5 H PHE 5 4.369 -0.784 6.963
28 HA PHE 5 HA PHE 5 2.314 -1.726 5.086
29 1HB PHE 5 2HB PHE 5 3.937 -3.315 5.777
30 2HB PHE 5 1HB PHE 5 3.812 -2.833 7.468
31 HD1 PHE 5 HD1 PHE 5 1.911 -4.442 4.681
32 HD2 PHE 5 HD2 PHE 5 2.282 -3.892 8.925
33 HE1 PHE 5 HE1 PHE 5 0.186 -6.182 5.059
34 HE2 PHE 5 HE2 PHE 5 0.557 -5.632 9.301
35 HZ PHE 5 HZ PHE 5 -0.491 -6.776 7.367
36 H GLY 6 H GLY 6 0.129 -2.010 5.562
37 1HA GLY 6 2HA GLY 6 -1.916 -1.736 6.661
38 2HA GLY 6 1HA GLY 6 -1.033 -1.921 8.176
39 H LYS 7 H LYS 7 -0.796 0.570 5.628
40 HA LYS 7 HA LYS 7 -1.357 2.644 7.726
41 1HB LYS 7 2HB LYS 7 0.980 2.454 6.744
42 2HB LYS 7 1HB LYS 7 0.284 2.890 5.184
43 1HG LYS 7 2HG LYS 7 0.121 5.077 5.746
44 2HG LYS 7 1HG LYS 7 -0.537 4.701 7.339
45 1HD LYS 7 2HD LYS 7 1.704 4.223 8.192
46 2HD LYS 7 1HD LYS 7 2.395 4.496 6.592
47 1HE LYS 7 2HE LYS 7 1.692 6.844 6.644
48 2HE LYS 7 1HE LYS 7 0.897 6.591 8.210
49 1HZ LYS 7 1HZ LYS 7 3.782 6.118 7.656
50 2HZ LYS 7 2HZ LYS 7 3.006 5.913 9.154
51 3HZ LYS 7 3HZ LYS 7 3.157 7.464 8.477
52 H GLY 8 H GLY 8 -2.764 4.366 7.109
53 1HA GLY 8 2HA GLY 8 -4.857 3.783 5.271
54 2HA GLY 8 1HA GLY 8 -4.529 5.384 5.940
55 H CYS 9 H CYS 9 -4.400 3.465 3.127
56 HA CYS 9 HA CYS 9 -2.908 5.636 1.690
57 1HB CYS 9 2HB CYS 9 -1.502 3.639 2.117
58 2HB CYS 9 1HB CYS 9 -2.707 2.629 1.319
59 H ASN 10 H ASN 10 -3.591 5.947 -0.513
60 HA ASN 10 HA ASN 10 -6.390 5.136 -1.032
61 1HB ASN 10 2HB ASN 10 -5.070 7.455 -1.328
62 2HB ASN 10 1HB ASN 10 -4.749 6.773 -2.922
63 1HD2 ASN 10 1HD2 ASN 10 -6.366 7.141 -4.453
64 2HD2 ASN 10 2HD2 ASN 10 -7.980 7.517 -4.090
65 HA PRO 11 HA PRO 11 -5.096 1.857 -3.727
66 1HB PRO 11 2HB PRO 11 -7.484 1.451 -5.003
67 2HB PRO 11 1HB PRO 11 -7.161 0.902 -3.347
68 1HG PRO 11 2HG PRO 11 -8.658 3.294 -4.290
69 2HG PRO 11 1HG PRO 11 -9.004 2.207 -2.936
70 1HD PRO 11 2HD PRO 11 -7.869 4.667 -2.637
71 2HD PRO 11 1HD PRO 11 -7.593 3.315 -1.516
72 H SER 12 H SER 12 -6.418 4.897 -4.863
73 HA SER 12 HA SER 12 -5.893 4.335 -7.709
74 1HB SER 12 2HB SER 12 -7.725 5.818 -6.556
75 2HB SER 12 1HB SER 12 -6.451 7.033 -6.489
76 HG SER 12 HG SER 12 -6.781 7.367 -8.527
77 H ASN 13 H ASN 13 -4.440 6.299 -5.095
78 HA ASN 13 HA ASN 13 -2.301 7.287 -6.857
79 1HB ASN 13 2HB ASN 13 -3.466 7.853 -4.259
80 2HB ASN 13 1HB ASN 13 -1.708 7.794 -4.149
81 1HD2 ASN 13 1HD2 ASN 13 -0.569 9.068 -6.056
82 2HD2 ASN 13 2HD2 ASN 13 -1.273 10.555 -6.471
83 H ASP 14 H ASP 14 -2.542 5.086 -4.056
84 HA ASP 14 HA ASP 14 -1.097 3.397 -3.277
85 1HB ASP 14 2HB ASP 14 -1.198 3.367 -6.189
86 2HB ASP 14 1HB ASP 14 0.329 2.713 -5.596
87 H GLN 15 H GLN 15 0.201 4.873 -1.982
88 HA GLN 15 HA GLN 15 2.839 5.621 -3.207
89 1HB GLN 15 2HB GLN 15 0.860 6.964 -1.492
90 2HB GLN 15 1HB GLN 15 2.513 7.111 -0.896
91 1HG GLN 15 2HG GLN 15 3.167 8.421 -2.643
92 2HG GLN 15 1HG GLN 15 2.197 7.519 -3.809
93 1HE2 GLN 15 1HE2 GLN 15 1.805 9.873 -1.099
94 2HE2 GLN 15 2HE2 GLN 15 0.437 10.629 -1.762
95 H CYS 16 H CYS 16 2.340 2.972 -2.127
96 HA CYS 16 HA CYS 16 3.508 2.918 0.582
97 1HB CYS 16 2HB CYS 16 1.748 1.348 -0.792
98 2HB CYS 16 1HB CYS 16 3.242 0.439 -1.019
99 H CYS 17 H CYS 17 5.431 1.383 0.923
100 HA CYS 17 HA CYS 17 7.602 2.186 -0.895
101 1HB CYS 17 2HB CYS 17 7.395 1.855 1.778
102 2HB CYS 17 1HB CYS 17 8.016 0.263 1.342
103 H LYS 18 H LYS 18 8.470 0.897 -2.460
104 HA LYS 18 HA LYS 18 7.288 -1.725 -3.032
105 1HB LYS 18 2HB LYS 18 8.697 -1.573 -5.033
106 2HB LYS 18 1HB LYS 18 7.909 -0.023 -4.750
107 1HG LYS 18 2HG LYS 18 10.008 0.833 -4.964
108 2HG LYS 18 1HG LYS 18 10.218 0.283 -3.303
109 1HD LYS 18 2HD LYS 18 12.023 -0.784 -4.256
110 2HD LYS 18 1HD LYS 18 10.797 -2.017 -4.547
111 1HE LYS 18 2HE LYS 18 10.710 -0.062 -6.678
112 2HE LYS 18 1HE LYS 18 12.359 -0.693 -6.501
113 1HZ LYS 18 1HZ LYS 18 11.026 -2.159 -7.892
114 2HZ LYS 18 2HZ LYS 18 9.880 -2.332 -6.651
115 3HZ LYS 18 3HZ LYS 18 11.454 -2.940 -6.449
116 H SER 19 H SER 19 10.174 -0.544 -1.427
117 HA SER 19 HA SER 19 11.839 -2.871 -1.691
118 1HB SER 19 2HB SER 19 13.017 -1.822 0.231
119 2HB SER 19 1HB SER 19 12.613 -0.637 -1.006
120 HG SER 19 HG SER 19 11.887 -0.699 1.564
121 H SER 20 H SER 20 9.280 -1.992 0.622
122 HA SER 20 HA SER 20 9.744 -4.461 2.205
123 1HB SER 20 2HB SER 20 9.237 -2.116 3.111
124 2HB SER 20 1HB SER 20 7.596 -2.348 2.518
125 HG SER 20 HG SER 20 7.268 -3.882 3.991
126 H ASN 21 H ASN 21 8.366 -4.055 -0.699
127 HA ASN 21 HA ASN 21 6.639 -5.108 -1.901
128 1HB ASN 21 2HB ASN 21 6.978 -7.016 0.441
129 2HB ASN 21 1HB ASN 21 6.189 -7.415 -1.085
130 1HD2 ASN 21 1HD2 ASN 21 7.609 -7.243 -3.096
131 2HD2 ASN 21 2HD2 ASN 21 9.273 -7.534 -2.933
132 H LEU 22 H LEU 22 5.352 -3.118 -1.004
133 HA LEU 22 HA LEU 22 2.970 -4.150 0.500
134 1HB LEU 22 2HB LEU 22 4.459 -1.520 0.788
135 2HB LEU 22 1HB LEU 22 2.927 -1.882 1.583
136 HG LEU 22 HG LEU 22 5.451 -3.523 1.921
137 1HD1 LEU 22 1HD1 LEU 22 5.538 -2.478 4.179
138 2HD1 LEU 22 2HD1 LEU 22 4.201 -1.424 3.718
139 3HD1 LEU 22 3HD1 LEU 22 5.752 -1.295 2.888
140 1HD2 LEU 22 1HD2 LEU 22 2.703 -3.568 3.184
141 2HD2 LEU 22 2HD2 LEU 22 4.096 -4.335 3.945
142 3HD2 LEU 22 3HD2 LEU 22 3.540 -4.886 2.365
143 H VAL 23 H VAL 23 0.996 -3.522 -0.371
144 HA VAL 23 HA VAL 23 1.014 -1.458 -2.544
145 HB VAL 23 HB VAL 23 -0.558 -2.989 -3.782
146 1HG1 VAL 23 1HG1 VAL 23 2.117 -4.264 -3.159
147 2HG1 VAL 23 2HG1 VAL 23 1.916 -2.873 -4.222
148 3HG1 VAL 23 3HG1 VAL 23 1.184 -4.421 -4.647
149 1HG2 VAL 23 1HG2 VAL 23 -0.573 -5.384 -3.088
150 2HG2 VAL 23 2HG2 VAL 23 -1.342 -4.338 -1.895
151 3HG2 VAL 23 3HG2 VAL 23 0.291 -4.941 -1.616
152 H CYS 24 H CYS 24 -0.819 -0.134 -2.573
153 HA CYS 24 HA CYS 24 -2.524 -0.163 -0.184
154 1HB CYS 24 2HB CYS 24 -2.539 1.578 -2.673
155 2HB CYS 24 1HB CYS 24 -3.339 1.952 -1.147
156 H SER 25 H SER 25 -4.199 -1.609 -0.152
157 HA SER 25 HA SER 25 -5.467 -2.615 -2.590
158 1HB SER 25 2HB SER 25 -5.008 -3.851 -0.409
159 2HB SER 25 1HB SER 25 -6.318 -2.914 0.304
160 HG SER 25 HG SER 25 -7.201 -4.795 -0.456
161 H ARG 26 H ARG 26 -7.888 -2.518 -2.835
162 HA ARG 26 HA ARG 26 -8.870 0.251 -2.388
163 1HB ARG 26 2HB ARG 26 -8.932 -0.892 -4.621
164 2HB ARG 26 1HB ARG 26 -10.029 -2.093 -3.937
165 1HG ARG 26 2HG ARG 26 -11.732 -0.722 -4.482
166 2HG ARG 26 1HG ARG 26 -11.152 0.379 -3.233
167 1HD ARG 26 2HD ARG 26 -11.088 1.795 -5.086
168 2HD ARG 26 1HD ARG 26 -9.457 1.104 -5.180
169 HE ARG 26 HE ARG 26 -11.177 -0.686 -6.537
170 1HH1 ARG 26 1HH2 ARG 26 -8.773 0.481 -7.835
171 2HH1 ARG 26 2HH2 ARG 26 -9.457 1.463 -9.087
172 1HH2 ARG 26 2HH1 ARG 26 -12.641 1.490 -7.693
173 2HH2 ARG 26 1HH1 ARG 26 -11.652 2.036 -9.006
174 H LYS 27 H LYS 27 -9.970 -3.123 -1.857
175 HA LYS 27 HA LYS 27 -12.366 -2.546 -0.432
176 1HB LYS 27 2HB LYS 27 -11.068 -4.747 -1.363
177 2HB LYS 27 1HB LYS 27 -10.743 -4.909 0.362
178 1HG LYS 27 2HG LYS 27 -12.978 -5.177 0.903
179 2HG LYS 27 1HG LYS 27 -13.533 -4.251 -0.493
180 1HD LYS 27 2HD LYS 27 -12.930 -6.084 -1.994
181 2HD LYS 27 1HD LYS 27 -12.273 -7.005 -0.641
182 1HE LYS 27 2HE LYS 27 -14.402 -7.933 -0.723
183 2HE LYS 27 1HE LYS 27 -14.745 -6.552 0.338
184 1HZ LYS 27 1HZ LYS 27 -15.303 -5.229 -1.600
185 2HZ LYS 27 2HZ LYS 27 -16.274 -6.621 -1.553
186 3HZ LYS 27 3HZ LYS 27 -14.963 -6.534 -2.630
187 H HIS 28 H HIS 28 -9.038 -3.086 0.777
188 HA HIS 28 HA HIS 28 -9.865 -2.452 3.551
189 1HB HIS 28 2HB HIS 28 -7.251 -3.233 2.221
190 2HB HIS 28 1HB HIS 28 -7.426 -2.972 3.956
191 HD1 HIS 28 HD1 HIS 28 -9.281 -4.560 5.162
192 HD2 HIS 28 HD2 HIS 28 -7.993 -5.776 1.387
193 HE1 HIS 28 HE1 HIS 28 -9.946 -6.991 4.926
194 H ARG 29 H ARG 29 -8.371 -0.877 0.798
195 HA ARG 29 HA ARG 29 -7.595 1.321 0.480
196 1HB ARG 29 2HB ARG 29 -9.903 1.384 1.917
197 2HB ARG 29 1HB ARG 29 -8.820 2.211 3.036
198 1HG ARG 29 2HG ARG 29 -8.121 3.403 0.685
199 2HG ARG 29 1HG ARG 29 -9.831 3.083 0.396
200 1HD ARG 29 2HD ARG 29 -9.810 4.053 3.005
201 2HD ARG 29 1HD ARG 29 -8.603 5.057 2.177
202 HE ARG 29 HE ARG 29 -11.464 4.811 1.399
203 1HH1 ARG 29 1HH2 ARG 29 -10.059 7.419 2.065
204 2HH1 ARG 29 2HH2 ARG 29 -9.794 8.080 0.486
205 1HH2 ARG 29 2HH1 ARG 29 -10.361 5.071 -1.158
206 2HH2 ARG 29 1HH1 ARG 29 -9.965 6.747 -1.344
207 H TRP 30 H TRP 30 -5.827 -0.490 1.882
208 HA TRP 30 HA TRP 30 -4.157 1.507 3.289
209 1HB TRP 30 2HB TRP 30 -4.120 0.355 5.347
210 2HB TRP 30 1HB TRP 30 -5.807 0.258 4.865
211 HD1 TRP 30 HD1 TRP 30 -5.163 -2.131 2.647
212 HE1 TRP 30 HE1 TRP 30 -4.874 -4.520 3.562
213 HE3 TRP 30 HE3 TRP 30 -4.143 -1.080 7.536
214 HZ2 TRP 30 HZ2 TRP 30 -4.295 -5.817 6.042
215 HZ3 TRP 30 HZ3 TRP 30 -3.731 -2.911 9.154
216 HH2 TRP 30 HH2 TRP 30 -3.805 -5.276 8.415
217 H CYS 31 H CYS 31 -1.976 0.339 3.925
218 HA CYS 31 HA CYS 31 -0.981 -0.973 1.494
219 1HB CYS 31 2HB CYS 31 0.104 0.195 4.024
220 2HB CYS 31 1HB CYS 31 1.121 -0.953 3.156
221 H LYS 32 H LYS 32 -0.599 -3.162 1.273
222 HA LYS 32 HA LYS 32 -0.697 -4.884 3.722
223 1HB LYS 32 2HB LYS 32 -2.227 -6.386 2.556
224 2HB LYS 32 1HB LYS 32 -2.903 -4.759 2.531
225 1HG LYS 32 2HG LYS 32 -3.071 -4.987 0.291
226 2HG LYS 32 1HG LYS 32 -1.314 -4.858 0.238
227 1HD LYS 32 2HD LYS 32 -1.563 -6.897 -0.812
228 2HD LYS 32 1HD LYS 32 -1.472 -7.449 0.860
229 1HE LYS 32 2HE LYS 32 -3.492 -8.434 0.527
230 2HE LYS 32 1HE LYS 32 -4.186 -6.803 0.461
231 1HZ LYS 32 1HZ LYS 32 -4.647 -8.000 -1.587
232 2HZ LYS 32 2HZ LYS 32 -2.990 -8.280 -1.828
233 3HZ LYS 32 3HZ LYS 32 -3.606 -6.697 -1.893
234 H TYR 33 H TYR 33 0.278 -7.063 3.309
235 HA TYR 33 HA TYR 33 2.648 -6.821 1.557
236 1HB TYR 33 2HB TYR 33 2.119 -7.880 4.057
237 2HB TYR 33 1HB TYR 33 2.199 -9.321 3.042
238 HD1 TYR 33 HD1 TYR 33 4.087 -6.696 4.653
239 HD2 TYR 33 HD2 TYR 33 4.224 -9.642 1.528
240 HE1 TYR 33 HE1 TYR 33 6.560 -6.522 4.596
241 HE2 TYR 33 HE2 TYR 33 6.698 -9.468 1.473
242 HH TYR 33 HH TYR 33 8.400 -7.209 2.359
243 H GLU 34 H GLU 34 3.013 -8.107 -0.253
244 HA GLU 34 HA GLU 34 0.691 -9.353 -1.524
245 1HB GLU 34 2HB GLU 34 3.619 -8.987 -2.208
246 2HB GLU 34 1HB GLU 34 2.507 -9.834 -3.282
247 1HG GLU 34 2HG GLU 34 2.206 -7.724 -4.134
248 2HG GLU 34 1HG GLU 34 1.046 -7.611 -2.810
249 H ILE 35 H ILE 35 0.094 -11.270 -0.483
250 HA ILE 35 HA ILE 35 2.221 -13.319 0.012
251 HB ILE 35 HB ILE 35 -0.624 -13.008 1.037
252 1HG1 ILE 35 1HG1 ILE 35 0.944 -11.318 1.928
253 2HG1 ILE 35 2HG1 ILE 35 0.483 -12.465 3.184
254 1HG2 ILE 35 1HG2 ILE 35 1.511 -15.086 1.524
255 2HG2 ILE 35 2HG2 ILE 35 0.241 -14.780 2.707
256 3HG2 ILE 35 3HG2 ILE 35 -0.179 -15.332 1.085
257 1HD1 ILE 35 1HD1 ILE 35 2.769 -13.535 1.860
258 2HD1 ILE 35 2HD1 ILE 35 3.113 -11.844 2.221
259 3HD1 ILE 35 3HD1 ILE 35 2.655 -12.947 3.519
260 1HN NH2 36 1HN NH2 36 -0.162 -13.696 -3.075
261 2HN NH2 36 2HN NH2 36 0.398 -12.257 -2.196
Start of MODEL 10
1 1H GLU 1 1H GLU 1 9.962 8.285 5.013
2 2H GLU 1 2H GLU 1 10.798 6.813 5.149
3 3H GLU 1 3H GLU 1 10.975 8.006 6.345
4 HA GLU 1 HA GLU 1 9.514 6.251 7.144
5 1HB GLU 1 2HB GLU 1 8.784 9.082 6.671
6 2HB GLU 1 1HB GLU 1 7.443 8.045 7.161
7 1HG GLU 1 2HG GLU 1 8.185 8.023 9.285
8 2HG GLU 1 1HG GLU 1 9.755 7.417 8.759
9 H CYS 2 H CYS 2 7.781 4.845 6.727
10 HA CYS 2 HA CYS 2 6.198 5.231 4.224
11 1HB CYS 2 2HB CYS 2 6.777 2.957 3.511
12 2HB CYS 2 1HB CYS 2 8.251 3.894 3.749
13 H LEU 3 H LEU 3 4.431 3.439 4.123
14 HA LEU 3 HA LEU 3 3.193 3.215 6.824
15 1HB LEU 3 2HB LEU 3 2.223 2.908 3.969
16 2HB LEU 3 1HB LEU 3 1.198 2.565 5.361
17 HG LEU 3 HG LEU 3 2.592 5.216 4.872
18 1HD1 LEU 3 1HD1 LEU 3 0.717 4.540 3.247
19 2HD1 LEU 3 2HD1 LEU 3 0.514 6.072 4.098
20 3HD1 LEU 3 3HD1 LEU 3 -0.366 4.641 4.636
21 1HD2 LEU 3 1HD2 LEU 3 2.218 5.064 7.190
22 2HD2 LEU 3 2HD2 LEU 3 0.725 4.147 6.984
23 3HD2 LEU 3 3HD2 LEU 3 0.759 5.871 6.616
24 H GLY 4 H GLY 4 2.629 1.203 7.726
25 1HA GLY 4 2HA GLY 4 4.149 -1.115 6.819
26 2HA GLY 4 1HA GLY 4 3.061 -1.067 8.205
27 H PHE 5 H PHE 5 2.245 -3.170 7.454
28 HA PHE 5 HA PHE 5 0.787 -3.270 4.891
29 1HB PHE 5 2HB PHE 5 2.014 -5.217 5.614
30 2HB PHE 5 1HB PHE 5 1.247 -5.183 7.200
31 HD1 PHE 5 HD1 PHE 5 -0.591 -6.566 7.582
32 HD2 PHE 5 HD2 PHE 5 0.325 -5.370 3.558
33 HE1 PHE 5 HE1 PHE 5 -2.420 -8.010 6.736
34 HE2 PHE 5 HE2 PHE 5 -1.505 -6.815 2.714
35 HZ PHE 5 HZ PHE 5 -2.877 -8.134 4.302
36 H GLY 6 H GLY 6 -1.456 -3.236 4.682
37 1HA GLY 6 2HA GLY 6 -3.706 -2.942 5.269
38 2HA GLY 6 1HA GLY 6 -3.293 -3.498 6.891
39 H LYS 7 H LYS 7 -2.063 -0.687 5.068
40 HA LYS 7 HA LYS 7 -3.073 1.068 7.286
41 1HB LYS 7 2HB LYS 7 -0.544 1.129 5.610
42 2HB LYS 7 1HB LYS 7 -1.020 2.438 6.693
43 1HG LYS 7 2HG LYS 7 -1.164 -0.163 8.010
44 2HG LYS 7 1HG LYS 7 0.455 0.174 7.400
45 1HD LYS 7 2HD LYS 7 0.819 1.750 8.975
46 2HD LYS 7 1HD LYS 7 -0.737 2.520 8.662
47 1HE LYS 7 2HE LYS 7 -0.929 1.749 10.904
48 2HE LYS 7 1HE LYS 7 -1.745 0.486 9.964
49 1HZ LYS 7 1HZ LYS 7 -0.073 -0.419 11.518
50 2HZ LYS 7 2HZ LYS 7 1.138 0.446 10.697
51 3HZ LYS 7 3HZ LYS 7 0.279 -0.785 9.900
52 H GLY 8 H GLY 8 -4.548 2.556 6.593
53 1HA GLY 8 2HA GLY 8 -5.452 2.824 3.932
54 2HA GLY 8 1HA GLY 8 -5.735 4.018 5.197
55 H CYS 9 H CYS 9 -4.450 3.696 2.196
56 HA CYS 9 HA CYS 9 -2.671 6.071 2.583
57 1HB CYS 9 2HB CYS 9 -1.111 4.914 0.926
58 2HB CYS 9 1HB CYS 9 -1.195 4.174 2.523
59 H ASN 10 H ASN 10 -1.985 6.765 0.157
60 HA ASN 10 HA ASN 10 -4.536 7.240 -1.275
61 1HB ASN 10 2HB ASN 10 -2.559 8.879 -0.602
62 2HB ASN 10 1HB ASN 10 -1.846 8.290 -2.103
63 1HD2 ASN 10 1HD2 ASN 10 -4.272 10.398 -0.768
64 2HD2 ASN 10 2HD2 ASN 10 -4.930 10.915 -2.245
65 HA PRO 11 HA PRO 11 -3.511 4.031 -4.192
66 1HB PRO 11 2HB PRO 11 -5.434 4.620 -6.052
67 2HB PRO 11 1HB PRO 11 -5.781 3.776 -4.530
68 1HG PRO 11 2HG PRO 11 -6.185 6.639 -5.239
69 2HG PRO 11 1HG PRO 11 -7.215 5.556 -4.290
70 1HD PRO 11 2HD PRO 11 -5.578 7.418 -3.170
71 2HD PRO 11 1HD PRO 11 -6.027 5.899 -2.362
72 H SER 12 H SER 12 -3.679 7.461 -5.000
73 HA SER 12 HA SER 12 -2.333 7.087 -7.610
74 1HB SER 12 2HB SER 12 -3.350 9.448 -6.009
75 2HB SER 12 1HB SER 12 -2.525 9.633 -7.554
76 HG SER 12 HG SER 12 -4.986 9.366 -7.390
77 H ASN 13 H ASN 13 -1.614 8.529 -4.411
78 HA ASN 13 HA ASN 13 1.139 9.205 -5.172
79 1HB ASN 13 2HB ASN 13 -0.758 9.940 -3.219
80 2HB ASN 13 1HB ASN 13 0.568 9.194 -2.328
81 1HD2 ASN 13 1HD2 ASN 13 2.630 10.287 -2.313
82 2HD2 ASN 13 2HD2 ASN 13 2.841 11.834 -2.978
83 H ASP 14 H ASP 14 -0.489 6.679 -3.292
84 HA ASP 14 HA ASP 14 0.274 4.626 -2.440
85 1HB ASP 14 2HB ASP 14 2.401 5.159 -4.544
86 2HB ASP 14 1HB ASP 14 2.102 3.597 -3.783
87 H GLN 15 H GLN 15 0.791 5.488 -0.342
88 HA GLN 15 HA GLN 15 3.631 6.299 0.118
89 1HB GLN 15 2HB GLN 15 1.375 7.511 0.839
90 2HB GLN 15 1HB GLN 15 1.463 6.377 2.187
91 1HG GLN 15 2HG GLN 15 3.496 7.258 2.963
92 2HG GLN 15 1HG GLN 15 3.875 8.003 1.409
93 1HE2 GLN 15 1HE2 GLN 15 1.531 8.247 4.134
94 2HE2 GLN 15 2HE2 GLN 15 1.252 9.910 3.940
95 H CYS 16 H CYS 16 2.760 3.437 -0.297
96 HA CYS 16 HA CYS 16 2.936 2.193 2.370
97 1HB CYS 16 2HB CYS 16 2.836 1.158 -0.480
98 2HB CYS 16 1HB CYS 16 2.858 0.109 0.936
99 H CYS 17 H CYS 17 4.684 0.595 2.836
100 HA CYS 17 HA CYS 17 7.320 1.687 2.252
101 1HB CYS 17 2HB CYS 17 6.163 0.271 4.271
102 2HB CYS 17 1HB CYS 17 7.042 -1.013 3.441
103 H LYS 18 H LYS 18 8.585 1.167 0.542
104 HA LYS 18 HA LYS 18 7.820 -0.869 -1.400
105 1HB LYS 18 2HB LYS 18 8.922 1.357 -1.845
106 2HB LYS 18 1HB LYS 18 10.391 0.718 -1.107
107 1HG LYS 18 2HG LYS 18 10.674 0.373 -3.443
108 2HG LYS 18 1HG LYS 18 10.217 -1.204 -2.800
109 1HD LYS 18 2HD LYS 18 8.190 -1.194 -3.851
110 2HD LYS 18 1HD LYS 18 7.962 0.538 -3.611
111 1HE LYS 18 2HE LYS 18 8.960 1.078 -5.607
112 2HE LYS 18 1HE LYS 18 10.150 -0.232 -5.478
113 1HZ LYS 18 1HZ LYS 18 7.251 -0.612 -6.023
114 2HZ LYS 18 2HZ LYS 18 8.429 -1.836 -5.953
115 3HZ LYS 18 3HZ LYS 18 8.472 -0.680 -7.198
116 H SER 19 H SER 19 10.087 -0.702 1.305
117 HA SER 19 HA SER 19 11.821 -2.868 0.649
118 1HB SER 19 2HB SER 19 11.958 -1.108 2.501
119 2HB SER 19 1HB SER 19 10.824 -2.106 3.406
120 HG SER 19 HG SER 19 13.062 -2.550 3.852
121 H SER 20 H SER 20 8.607 -2.843 2.196
122 HA SER 20 HA SER 20 8.691 -5.805 2.513
123 1HB SER 20 2HB SER 20 7.053 -3.508 3.534
124 2HB SER 20 1HB SER 20 6.346 -5.121 3.553
125 HG SER 20 HG SER 20 7.747 -5.726 5.036
126 H ASN 21 H ASN 21 8.297 -4.150 -0.137
127 HA ASN 21 HA ASN 21 7.003 -4.331 -2.095
128 1HB ASN 21 2HB ASN 21 7.602 -6.813 -1.028
129 2HB ASN 21 1HB ASN 21 5.861 -6.918 -1.280
130 1HD2 ASN 21 1HD2 ASN 21 6.462 -8.535 -3.030
131 2HD2 ASN 21 2HD2 ASN 21 6.918 -7.947 -4.555
132 H LEU 22 H LEU 22 5.698 -2.872 -0.026
133 HA LEU 22 HA LEU 22 2.885 -3.855 0.002
134 1HB LEU 22 2HB LEU 22 4.468 -1.722 1.451
135 2HB LEU 22 1HB LEU 22 2.712 -1.806 1.571
136 HG LEU 22 HG LEU 22 4.513 -4.168 2.159
137 1HD1 LEU 22 1HD1 LEU 22 5.112 -3.078 4.045
138 2HD1 LEU 22 2HD1 LEU 22 3.435 -3.245 4.562
139 3HD1 LEU 22 3HD1 LEU 22 3.963 -1.777 3.740
140 1HD2 LEU 22 1HD2 LEU 22 2.466 -5.160 2.029
141 2HD2 LEU 22 2HD2 LEU 22 1.611 -3.622 2.144
142 3HD2 LEU 22 3HD2 LEU 22 2.190 -4.421 3.606
143 H VAL 23 H VAL 23 1.298 -2.851 -1.204
144 HA VAL 23 HA VAL 23 1.982 -0.286 -2.597
145 HB VAL 23 HB VAL 23 0.806 -1.281 -4.597
146 1HG1 VAL 23 1HG1 VAL 23 2.728 -2.382 -5.371
147 2HG1 VAL 23 2HG1 VAL 23 3.074 -3.092 -3.795
148 3HG1 VAL 23 3HG1 VAL 23 3.361 -1.374 -4.070
149 1HG2 VAL 23 1HG2 VAL 23 0.340 -3.647 -4.668
150 2HG2 VAL 23 2HG2 VAL 23 -0.439 -3.013 -3.219
151 3HG2 VAL 23 3HG2 VAL 23 1.081 -3.898 -3.088
152 H CYS 24 H CYS 24 0.219 1.152 -2.830
153 HA CYS 24 HA CYS 24 -2.020 0.769 -1.002
154 1HB CYS 24 2HB CYS 24 -0.690 2.903 -1.803
155 2HB CYS 24 1HB CYS 24 -1.875 2.906 -3.110
156 H SER 25 H SER 25 -3.805 -0.408 -1.531
157 HA SER 25 HA SER 25 -4.416 -1.156 -4.297
158 1HB SER 25 2HB SER 25 -4.661 -2.557 -2.182
159 2HB SER 25 1HB SER 25 -6.044 -1.550 -1.770
160 HG SER 25 HG SER 25 -7.063 -2.969 -2.960
161 H ARG 26 H ARG 26 -6.820 -0.933 -4.996
162 HA ARG 26 HA ARG 26 -7.643 1.919 -4.649
163 1HB ARG 26 2HB ARG 26 -7.142 0.890 -6.908
164 2HB ARG 26 1HB ARG 26 -8.537 -0.163 -6.670
165 1HG ARG 26 2HG ARG 26 -10.061 1.622 -6.759
166 2HG ARG 26 1HG ARG 26 -8.822 2.822 -6.388
167 1HD ARG 26 2HD ARG 26 -8.700 3.198 -8.627
168 2HD ARG 26 1HD ARG 26 -7.927 1.605 -8.757
169 HE ARG 26 HE ARG 26 -10.851 2.115 -9.090
170 1HH1 ARG 26 1HH2 ARG 26 -9.232 1.149 -11.393
171 2HH1 ARG 26 2HH2 ARG 26 -9.505 -0.561 -11.355
172 1HH2 ARG 26 2HH1 ARG 26 -10.714 -0.562 -8.096
173 2HH2 ARG 26 1HH1 ARG 26 -10.347 -1.533 -9.483
174 H LYS 27 H LYS 27 -9.073 -1.374 -4.773
175 HA LYS 27 HA LYS 27 -11.707 -0.626 -3.909
176 1HB LYS 27 2HB LYS 27 -10.984 -2.762 -5.024
177 2HB LYS 27 1HB LYS 27 -10.197 -3.235 -3.518
178 1HG LYS 27 2HG LYS 27 -12.808 -2.454 -2.791
179 2HG LYS 27 1HG LYS 27 -12.994 -3.429 -4.248
180 1HD LYS 27 2HD LYS 27 -11.060 -4.756 -2.670
181 2HD LYS 27 1HD LYS 27 -12.352 -4.290 -1.565
182 1HE LYS 27 2HE LYS 27 -13.396 -5.339 -4.098
183 2HE LYS 27 1HE LYS 27 -12.398 -6.520 -3.228
184 1HZ LYS 27 1HZ LYS 27 -13.640 -6.064 -1.216
185 2HZ LYS 27 2HZ LYS 27 -14.707 -6.542 -2.449
186 3HZ LYS 27 3HZ LYS 27 -14.583 -4.903 -2.018
187 H HIS 28 H HIS 28 -8.859 -1.824 -2.105
188 HA HIS 28 HA HIS 28 -10.235 -1.436 0.490
189 1HB HIS 28 2HB HIS 28 -7.515 -2.466 -0.375
190 2HB HIS 28 1HB HIS 28 -8.034 -2.393 1.308
191 HD1 HIS 28 HD1 HIS 28 -10.578 -3.605 1.618
192 HD2 HIS 28 HD2 HIS 28 -8.122 -4.908 -1.488
193 HE1 HIS 28 HE1 HIS 28 -11.435 -5.889 0.938
194 H ARG 29 H ARG 29 -7.925 0.215 -1.570
195 HA ARG 29 HA ARG 29 -6.770 2.252 -1.323
196 1HB ARG 29 2HB ARG 29 -9.345 2.584 -0.591
197 2HB ARG 29 1HB ARG 29 -8.564 3.012 0.932
198 1HG ARG 29 2HG ARG 29 -7.050 4.290 -1.073
199 2HG ARG 29 1HG ARG 29 -8.737 4.548 -1.518
200 1HD ARG 29 2HD ARG 29 -9.238 5.543 0.620
201 2HD ARG 29 1HD ARG 29 -7.658 5.065 1.273
202 HE ARG 29 HE ARG 29 -6.610 6.626 -0.349
203 1HH1 ARG 29 2HH1 ARG 29 -8.349 8.331 1.393
204 2HH1 ARG 29 1HH1 ARG 29 -9.229 9.267 0.231
205 1HH2 ARG 29 1HH2 ARG 29 -8.467 7.163 -2.429
206 2HH2 ARG 29 2HH2 ARG 29 -9.295 8.603 -1.940
207 H TRP 30 H TRP 30 -5.569 0.126 0.063
208 HA TRP 30 HA TRP 30 -4.257 1.595 2.274
209 1HB TRP 30 2HB TRP 30 -4.760 -0.067 3.923
210 2HB TRP 30 1HB TRP 30 -6.282 0.315 3.132
211 HD1 TRP 30 HD1 TRP 30 -5.140 -1.610 0.512
212 HE1 TRP 30 HE1 TRP 30 -5.593 -4.130 0.751
213 HE3 TRP 30 HE3 TRP 30 -6.027 -1.874 5.534
214 HZ2 TRP 30 HZ2 TRP 30 -6.251 -6.014 2.794
215 HZ3 TRP 30 HZ3 TRP 30 -6.568 -4.045 6.598
216 HH2 TRP 30 HH2 TRP 30 -6.680 -6.114 5.236
217 H CYS 31 H CYS 31 -2.394 0.090 3.178
218 HA CYS 31 HA CYS 31 -0.756 -0.693 0.896
219 1HB CYS 31 2HB CYS 31 -0.434 -0.814 3.909
220 2HB CYS 31 1HB CYS 31 0.842 -1.288 2.788
221 H LYS 32 H LYS 32 -0.778 -2.688 -0.031
222 HA LYS 32 HA LYS 32 -1.522 -5.059 1.648
223 1HB LYS 32 2HB LYS 32 -3.352 -4.100 0.138
224 2HB LYS 32 1HB LYS 32 -2.348 -4.586 -1.229
225 1HG LYS 32 2HG LYS 32 -2.424 -6.909 -0.532
226 2HG LYS 32 1HG LYS 32 -3.269 -6.476 0.954
227 1HD LYS 32 2HD LYS 32 -5.232 -5.815 -0.245
228 2HD LYS 32 1HD LYS 32 -4.387 -5.875 -1.792
229 1HE LYS 32 2HE LYS 32 -4.158 -8.305 -1.624
230 2HE LYS 32 1HE LYS 32 -4.895 -8.286 -0.010
231 1HZ LYS 32 1HZ LYS 32 -6.553 -8.757 -1.718
232 2HZ LYS 32 2HZ LYS 32 -6.178 -7.300 -2.506
233 3HZ LYS 32 3HZ LYS 32 -6.876 -7.277 -0.957
234 H TYR 33 H TYR 33 -0.415 -6.996 1.063
235 HA TYR 33 HA TYR 33 2.150 -6.638 -0.291
236 1HB TYR 33 2HB TYR 33 1.120 -8.264 1.675
237 2HB TYR 33 1HB TYR 33 1.167 -9.365 0.298
238 HD1 TYR 33 HD1 TYR 33 3.448 -8.985 -1.200
239 HD2 TYR 33 HD2 TYR 33 3.012 -8.275 3.016
240 HE1 TYR 33 HE1 TYR 33 5.897 -9.239 -0.902
241 HE2 TYR 33 HE2 TYR 33 5.459 -8.529 3.312
242 HH TYR 33 HH TYR 33 7.393 -9.970 1.504
243 H GLU 34 H GLU 34 2.374 -6.771 -2.481
244 HA GLU 34 HA GLU 34 0.279 -7.588 -4.267
245 1HB GLU 34 2HB GLU 34 2.095 -7.371 -5.968
246 2HB GLU 34 1HB GLU 34 2.047 -6.002 -4.860
247 1HG GLU 34 2HG GLU 34 4.010 -6.624 -3.786
248 2HG GLU 34 1HG GLU 34 3.808 -8.330 -4.177
249 H ILE 35 H ILE 35 0.007 -9.523 -5.442
250 HA ILE 35 HA ILE 35 1.258 -11.926 -4.243
251 HB ILE 35 HB ILE 35 -1.234 -11.560 -4.693
252 1HG1 ILE 35 1HG1 ILE 35 -0.280 -13.999 -6.164
253 2HG1 ILE 35 2HG1 ILE 35 0.125 -13.813 -4.458
254 1HG2 ILE 35 1HG2 ILE 35 -0.765 -10.612 -7.029
255 2HG2 ILE 35 2HG2 ILE 35 -0.495 -12.278 -7.538
256 3HG2 ILE 35 3HG2 ILE 35 -2.071 -11.791 -6.915
257 1HD1 ILE 35 1HD1 ILE 35 -2.330 -13.412 -4.009
258 2HD1 ILE 35 2HD1 ILE 35 -2.644 -13.859 -5.686
259 3HD1 ILE 35 3HD1 ILE 35 -1.948 -15.038 -4.574
260 1HN NH2 36 1HN NH2 36 3.434 -10.854 -7.096
261 2HN NH2 36 2HN NH2 36 2.689 -10.079 -5.681
Start of MODEL 11
1 1H GLU 1 1H GLU 1 8.111 9.674 2.242
2 2H GLU 1 2H GLU 1 7.875 10.041 0.600
3 3H GLU 1 3H GLU 1 9.337 10.448 1.361
4 HA GLU 1 HA GLU 1 9.703 8.498 0.013
5 1HB GLU 1 2HB GLU 1 9.636 8.342 3.019
6 2HB GLU 1 1HB GLU 1 10.202 6.953 2.092
7 1HG GLU 1 2HG GLU 1 12.204 7.944 1.851
8 2HG GLU 1 1HG GLU 1 11.432 9.263 0.971
9 H CYS 2 H CYS 2 9.309 5.928 0.343
10 HA CYS 2 HA CYS 2 6.613 5.380 -0.471
11 1HB CYS 2 2HB CYS 2 7.385 3.112 -0.545
12 2HB CYS 2 1HB CYS 2 8.782 4.110 -0.940
13 H LEU 3 H LEU 3 5.084 3.920 0.695
14 HA LEU 3 HA LEU 3 4.978 4.595 3.600
15 1HB LEU 3 2HB LEU 3 2.972 3.630 1.543
16 2HB LEU 3 1HB LEU 3 2.578 3.819 3.249
17 HG LEU 3 HG LEU 3 3.804 6.085 1.679
18 1HD1 LEU 3 1HD1 LEU 3 0.843 5.527 2.025
19 2HD1 LEU 3 2HD1 LEU 3 1.733 5.308 0.518
20 3HD1 LEU 3 3HD1 LEU 3 1.560 6.919 1.214
21 1HD2 LEU 3 1HD2 LEU 3 3.708 6.112 4.202
22 2HD2 LEU 3 2HD2 LEU 3 1.949 6.051 4.080
23 3HD2 LEU 3 3HD2 LEU 3 2.830 7.437 3.438
24 H GLY 4 H GLY 4 4.817 2.950 5.177
25 1HA GLY 4 2HA GLY 4 5.877 0.334 4.426
26 2HA GLY 4 1HA GLY 4 5.448 0.847 6.058
27 H PHE 5 H PHE 5 4.445 -1.333 6.224
28 HA PHE 5 HA PHE 5 2.086 -1.940 4.594
29 1HB PHE 5 2HB PHE 5 3.453 -3.749 5.389
30 2HB PHE 5 1HB PHE 5 3.404 -3.143 7.043
31 HD1 PHE 5 HD1 PHE 5 0.913 -4.015 4.353
32 HD2 PHE 5 HD2 PHE 5 2.023 -4.315 8.494
33 HE1 PHE 5 HE1 PHE 5 -1.121 -5.360 4.803
34 HE2 PHE 5 HE2 PHE 5 -0.009 -5.663 8.940
35 HZ PHE 5 HZ PHE 5 -1.581 -6.185 7.095
36 H GLY 6 H GLY 6 -0.042 -1.523 5.135
37 1HA GLY 6 2HA GLY 6 -1.900 -0.838 6.401
38 2HA GLY 6 1HA GLY 6 -0.903 -0.964 7.850
39 H LYS 7 H LYS 7 -0.138 1.016 5.013
40 HA LYS 7 HA LYS 7 -0.288 3.439 6.768
41 1HB LYS 7 2HB LYS 7 1.730 2.325 5.165
42 2HB LYS 7 1HB LYS 7 1.133 3.700 4.236
43 1HG LYS 7 2HG LYS 7 2.759 4.698 5.590
44 2HG LYS 7 1HG LYS 7 1.285 4.974 6.519
45 1HD LYS 7 2HD LYS 7 1.770 2.877 7.807
46 2HD LYS 7 1HD LYS 7 3.311 2.763 6.956
47 1HE LYS 7 2HE LYS 7 4.069 4.866 7.897
48 2HE LYS 7 1HE LYS 7 2.469 5.178 8.598
49 1HZ LYS 7 1HZ LYS 7 2.670 3.151 9.894
50 2HZ LYS 7 2HZ LYS 7 3.971 4.190 10.234
51 3HZ LYS 7 3HZ LYS 7 4.199 2.840 9.227
52 H GLY 8 H GLY 8 -1.644 5.110 6.147
53 1HA GLY 8 2HA GLY 8 -3.721 4.699 4.250
54 2HA GLY 8 1HA GLY 8 -3.288 6.263 4.938
55 H CYS 9 H CYS 9 -3.646 4.760 2.065
56 HA CYS 9 HA CYS 9 -1.748 6.625 0.709
57 1HB CYS 9 2HB CYS 9 -1.133 4.702 -0.807
58 2HB CYS 9 1HB CYS 9 -0.600 4.489 0.859
59 H ASN 10 H ASN 10 -2.253 6.368 -1.829
60 HA ASN 10 HA ASN 10 -5.197 6.730 -2.110
61 1HB ASN 10 2HB ASN 10 -2.868 8.034 -3.031
62 2HB ASN 10 1HB ASN 10 -3.572 7.275 -4.456
63 1HD2 ASN 10 1HD2 ASN 10 -3.636 10.030 -4.429
64 2HD2 ASN 10 2HD2 ASN 10 -5.204 10.596 -4.112
65 HA PRO 11 HA PRO 11 -5.424 2.749 -4.078
66 1HB PRO 11 2HB PRO 11 -7.911 3.041 -5.204
67 2HB PRO 11 1HB PRO 11 -7.655 2.688 -3.484
68 1HG PRO 11 2HG PRO 11 -8.261 5.285 -4.813
69 2HG PRO 11 1HG PRO 11 -8.871 4.631 -3.285
70 1HD PRO 11 2HD PRO 11 -6.915 6.503 -3.403
71 2HD PRO 11 1HD PRO 11 -7.015 5.294 -2.104
72 H SER 12 H SER 12 -6.352 5.684 -5.918
73 HA SER 12 HA SER 12 -5.860 4.501 -8.533
74 1HB SER 12 2HB SER 12 -7.263 6.590 -7.721
75 2HB SER 12 1HB SER 12 -5.738 7.446 -7.927
76 HG SER 12 HG SER 12 -7.479 6.772 -9.784
77 H ASN 13 H ASN 13 -3.991 6.535 -6.284
78 HA ASN 13 HA ASN 13 -1.547 6.040 -7.950
79 1HB ASN 13 2HB ASN 13 -2.571 8.420 -7.716
80 2HB ASN 13 1HB ASN 13 -1.980 8.359 -6.055
81 1HD2 ASN 13 1HD2 ASN 13 -1.035 10.003 -8.489
82 2HD2 ASN 13 2HD2 ASN 13 0.633 9.692 -8.569
83 H ASP 14 H ASP 14 -1.544 4.005 -6.537
84 HA ASP 14 HA ASP 14 -1.250 4.012 -3.716
85 1HB ASP 14 2HB ASP 14 -0.359 1.791 -4.055
86 2HB ASP 14 1HB ASP 14 -1.573 2.065 -5.303
87 H GLN 15 H GLN 15 0.492 4.369 -2.353
88 HA GLN 15 HA GLN 15 3.113 5.128 -3.605
89 1HB GLN 15 2HB GLN 15 1.224 6.787 -2.387
90 2HB GLN 15 1HB GLN 15 2.421 6.516 -1.120
91 1HG GLN 15 2HG GLN 15 3.267 7.245 -3.922
92 2HG GLN 15 1HG GLN 15 2.816 8.489 -2.755
93 1HE2 GLN 15 1HE2 GLN 15 4.173 8.708 -0.799
94 2HE2 GLN 15 2HE2 GLN 15 5.740 8.055 -0.758
95 H CYS 16 H CYS 16 2.302 2.551 -2.386
96 HA CYS 16 HA CYS 16 3.517 2.457 0.289
97 1HB CYS 16 2HB CYS 16 2.595 0.288 -1.626
98 2HB CYS 16 1HB CYS 16 2.967 0.059 0.081
99 H CYS 17 H CYS 17 5.296 0.737 0.646
100 HA CYS 17 HA CYS 17 7.532 1.315 -1.179
101 1HB CYS 17 2HB CYS 17 7.190 0.828 1.535
102 2HB CYS 17 1HB CYS 17 7.939 -0.659 0.953
103 H LYS 18 H LYS 18 8.158 -0.014 -2.818
104 HA LYS 18 HA LYS 18 6.733 -2.467 -3.436
105 1HB LYS 18 2HB LYS 18 8.494 -0.592 -4.671
106 2HB LYS 18 1HB LYS 18 9.212 -2.191 -4.864
107 1HG LYS 18 2HG LYS 18 6.478 -2.571 -5.364
108 2HG LYS 18 1HG LYS 18 6.879 -1.059 -6.177
109 1HD LYS 18 2HD LYS 18 8.736 -3.396 -6.472
110 2HD LYS 18 1HD LYS 18 7.244 -3.368 -7.413
111 1HE LYS 18 2HE LYS 18 8.471 -0.763 -7.556
112 2HE LYS 18 1HE LYS 18 9.664 -1.997 -8.002
113 1HZ LYS 18 1HZ LYS 18 8.041 -2.997 -9.483
114 2HZ LYS 18 2HZ LYS 18 8.292 -1.371 -9.905
115 3HZ LYS 18 3HZ LYS 18 6.890 -1.823 -9.061
116 H SER 19 H SER 19 9.802 -1.729 -1.833
117 HA SER 19 HA SER 19 11.104 -4.245 -2.017
118 1HB SER 19 2HB SER 19 11.964 -2.030 -1.137
119 2HB SER 19 1HB SER 19 11.069 -2.346 0.348
120 HG SER 19 HG SER 19 12.748 -3.473 0.905
121 H SER 20 H SER 20 8.596 -3.121 0.256
122 HA SER 20 HA SER 20 8.615 -5.752 1.646
123 1HB SER 20 2HB SER 20 8.548 -3.452 2.768
124 2HB SER 20 1HB SER 20 6.898 -3.313 2.168
125 HG SER 20 HG SER 20 7.984 -5.012 4.108
126 H ASN 21 H ASN 21 7.447 -5.079 -1.212
127 HA ASN 21 HA ASN 21 5.549 -5.667 -2.481
128 1HB ASN 21 2HB ASN 21 5.439 -7.670 -0.197
129 2HB ASN 21 1HB ASN 21 4.614 -7.855 -1.743
130 1HD2 ASN 21 1HD2 ASN 21 7.678 -8.201 -0.115
131 2HD2 ASN 21 2HD2 ASN 21 8.563 -8.722 -1.468
132 H LEU 22 H LEU 22 4.684 -3.475 -1.499
133 HA LEU 22 HA LEU 22 2.208 -4.036 0.105
134 1HB LEU 22 2HB LEU 22 4.053 -1.633 -0.025
135 2HB LEU 22 1HB LEU 22 2.539 -1.659 0.876
136 HG LEU 22 HG LEU 22 4.772 -3.658 1.318
137 1HD1 LEU 22 1HD1 LEU 22 5.126 -2.282 3.443
138 2HD1 LEU 22 2HD1 LEU 22 4.167 -1.020 2.669
139 3HD1 LEU 22 3HD1 LEU 22 5.688 -1.542 1.944
140 1HD2 LEU 22 1HD2 LEU 22 3.521 -3.971 3.486
141 2HD2 LEU 22 2HD2 LEU 22 2.602 -4.455 2.061
142 3HD2 LEU 22 3HD2 LEU 22 2.260 -2.915 2.851
143 H VAL 23 H VAL 23 0.278 -3.346 -0.767
144 HA VAL 23 HA VAL 23 0.350 -1.543 -3.164
145 HB VAL 23 HB VAL 23 -1.481 -3.025 -4.080
146 1HG1 VAL 23 1HG1 VAL 23 0.019 -4.704 -4.910
147 2HG1 VAL 23 2HG1 VAL 23 1.067 -4.553 -3.500
148 3HG1 VAL 23 3HG1 VAL 23 0.975 -3.241 -4.675
149 1HG2 VAL 23 1HG2 VAL 23 -1.800 -5.241 -3.089
150 2HG2 VAL 23 2HG2 VAL 23 -2.146 -4.007 -1.880
151 3HG2 VAL 23 3HG2 VAL 23 -0.615 -4.880 -1.835
152 H CYS 24 H CYS 24 -1.312 0.008 -3.187
153 HA CYS 24 HA CYS 24 -2.717 0.528 -0.705
154 1HB CYS 24 2HB CYS 24 -1.847 2.079 -2.651
155 2HB CYS 24 1HB CYS 24 -3.435 1.765 -3.351
156 H SER 25 H SER 25 -4.801 -0.015 -0.135
157 HA SER 25 HA SER 25 -6.338 -1.753 -2.007
158 1HB SER 25 2HB SER 25 -5.659 -1.912 0.666
159 2HB SER 25 1HB SER 25 -7.310 -1.305 0.740
160 HG SER 25 HG SER 25 -7.936 -3.234 0.236
161 H ARG 26 H ARG 26 -8.647 -1.355 -2.305
162 HA ARG 26 HA ARG 26 -9.327 1.533 -2.336
163 1HB ARG 26 2HB ARG 26 -9.594 -0.057 -4.291
164 2HB ARG 26 1HB ARG 26 -10.868 -0.865 -3.373
165 1HG ARG 26 2HG ARG 26 -12.135 1.237 -3.246
166 2HG ARG 26 1HG ARG 26 -10.853 2.075 -4.122
167 1HD ARG 26 2HD ARG 26 -11.482 -0.176 -5.707
168 2HD ARG 26 1HD ARG 26 -13.039 0.508 -5.197
169 HE ARG 26 HE ARG 26 -12.047 2.763 -5.946
170 1HH1 ARG 26 2HH1 ARG 26 -9.372 1.932 -6.787
171 2HH1 ARG 26 1HH1 ARG 26 -9.560 1.604 -8.478
172 1HH2 ARG 26 1HH2 ARG 26 -13.027 1.385 -8.319
173 2HH2 ARG 26 2HH2 ARG 26 -11.636 1.294 -9.348
174 H LYS 27 H LYS 27 -10.311 -1.463 -0.733
175 HA LYS 27 HA LYS 27 -12.682 -0.239 0.513
176 1HB LYS 27 2HB LYS 27 -12.810 -2.480 1.618
177 2HB LYS 27 1HB LYS 27 -12.675 -2.598 -0.135
178 1HG LYS 27 2HG LYS 27 -10.702 -3.693 -0.001
179 2HG LYS 27 1HG LYS 27 -10.055 -2.534 1.157
180 1HD LYS 27 2HD LYS 27 -10.312 -4.049 2.792
181 2HD LYS 27 1HD LYS 27 -12.053 -4.031 2.517
182 1HE LYS 27 2HE LYS 27 -11.977 -5.899 1.087
183 2HE LYS 27 1HE LYS 27 -10.253 -5.670 0.730
184 1HZ LYS 27 1HZ LYS 27 -11.360 -6.353 3.405
185 2HZ LYS 27 2HZ LYS 27 -9.715 -6.188 3.011
186 3HZ LYS 27 3HZ LYS 27 -10.626 -7.462 2.351
187 H HIS 28 H HIS 28 -9.303 -0.745 1.323
188 HA HIS 28 HA HIS 28 -9.828 0.170 4.130
189 1HB HIS 28 2HB HIS 28 -7.730 -1.535 2.789
190 2HB HIS 28 1HB HIS 28 -7.413 -0.796 4.358
191 HD1 HIS 28 HD1 HIS 28 -7.463 -3.736 4.524
192 HD2 HIS 28 HD2 HIS 28 -11.004 -1.542 4.680
193 HE1 HIS 28 HE1 HIS 28 -9.181 -5.225 5.640
194 H ARG 29 H ARG 29 -8.403 1.096 1.100
195 HA ARG 29 HA ARG 29 -7.127 2.968 0.452
196 1HB ARG 29 2HB ARG 29 -8.817 3.715 2.773
197 2HB ARG 29 1HB ARG 29 -7.502 4.831 2.415
198 1HG ARG 29 2HG ARG 29 -9.206 5.663 1.054
199 2HG ARG 29 1HG ARG 29 -8.343 4.603 -0.060
200 1HD ARG 29 2HD ARG 29 -10.685 4.084 -0.310
201 2HD ARG 29 1HD ARG 29 -9.992 2.761 0.647
202 HE ARG 29 HE ARG 29 -11.268 5.108 1.997
203 1HH1 ARG 29 2HH1 ARG 29 -13.135 2.896 1.143
204 2HH1 ARG 29 1HH1 ARG 29 -13.180 1.902 2.562
205 1HH2 ARG 29 1HH2 ARG 29 -10.345 3.330 3.975
206 2HH2 ARG 29 2HH2 ARG 29 -11.595 2.148 4.168
207 H TRP 30 H TRP 30 -5.626 0.948 1.802
208 HA TRP 30 HA TRP 30 -3.442 2.616 2.901
209 1HB TRP 30 2HB TRP 30 -3.359 1.468 4.995
210 2HB TRP 30 1HB TRP 30 -5.047 1.890 4.748
211 HD1 TRP 30 HD1 TRP 30 -5.248 -0.685 2.521
212 HE1 TRP 30 HE1 TRP 30 -5.655 -3.003 3.555
213 HE3 TRP 30 HE3 TRP 30 -3.826 0.232 7.341
214 HZ2 TRP 30 HZ2 TRP 30 -5.415 -4.304 6.085
215 HZ3 TRP 30 HZ3 TRP 30 -3.929 -1.567 9.040
216 HH2 TRP 30 HH2 TRP 30 -4.721 -3.832 8.419
217 H CYS 31 H CYS 31 -1.469 1.083 3.395
218 HA CYS 31 HA CYS 31 -0.929 -0.439 0.969
219 1HB CYS 31 2HB CYS 31 0.582 -0.011 3.565
220 2HB CYS 31 1HB CYS 31 1.264 -0.805 2.148
221 H LYS 32 H LYS 32 -1.101 -2.623 0.684
222 HA LYS 32 HA LYS 32 -1.714 -4.326 3.082
223 1HB LYS 32 2HB LYS 32 -2.978 -3.918 0.446
224 2HB LYS 32 1HB LYS 32 -2.767 -5.614 0.881
225 1HG LYS 32 2HG LYS 32 -3.737 -4.008 3.125
226 2HG LYS 32 1HG LYS 32 -4.832 -3.960 1.743
227 1HD LYS 32 2HD LYS 32 -4.977 -6.370 1.683
228 2HD LYS 32 1HD LYS 32 -3.702 -6.526 2.893
229 1HE LYS 32 2HE LYS 32 -5.189 -5.274 4.513
230 2HE LYS 32 1HE LYS 32 -6.487 -5.389 3.308
231 1HZ LYS 32 1HZ LYS 32 -6.200 -7.785 3.261
232 2HZ LYS 32 2HZ LYS 32 -6.542 -7.271 4.843
233 3HZ LYS 32 3HZ LYS 32 -4.953 -7.688 4.409
234 H TYR 33 H TYR 33 -0.643 -6.344 3.175
235 HA TYR 33 HA TYR 33 1.785 -6.597 1.518
236 1HB TYR 33 2HB TYR 33 1.102 -7.124 4.131
237 2HB TYR 33 1HB TYR 33 1.039 -8.735 3.416
238 HD1 TYR 33 HD1 TYR 33 3.071 -9.332 1.812
239 HD2 TYR 33 HD2 TYR 33 3.160 -6.302 4.856
240 HE1 TYR 33 HE1 TYR 33 5.548 -9.444 1.852
241 HE2 TYR 33 HE2 TYR 33 5.636 -6.415 4.895
242 HH TYR 33 HH TYR 33 7.467 -7.423 2.711
243 H GLU 34 H GLU 34 1.579 -7.588 -0.456
244 HA GLU 34 HA GLU 34 -0.637 -9.279 -1.203
245 1HB GLU 34 2HB GLU 34 0.705 -9.600 -3.249
246 2HB GLU 34 1HB GLU 34 0.728 -7.908 -2.756
247 1HG GLU 34 2HG GLU 34 2.983 -8.055 -2.877
248 2HG GLU 34 1HG GLU 34 2.890 -8.992 -1.387
249 H ILE 35 H ILE 35 -0.501 -11.589 -1.759
250 HA ILE 35 HA ILE 35 1.110 -13.110 0.208
251 HB ILE 35 HB ILE 35 -1.016 -13.927 -1.806
252 1HG1 ILE 35 1HG1 ILE 35 -1.931 -12.378 -0.159
253 2HG1 ILE 35 2HG1 ILE 35 -2.489 -14.004 0.223
254 1HG2 ILE 35 1HG2 ILE 35 0.312 -15.396 0.483
255 2HG2 ILE 35 2HG2 ILE 35 -1.208 -15.924 -0.241
256 3HG2 ILE 35 3HG2 ILE 35 0.260 -15.867 -1.216
257 1HD1 ILE 35 1HD1 ILE 35 -0.365 -14.090 1.762
258 2HD1 ILE 35 2HD1 ILE 35 -0.433 -12.331 1.645
259 3HD1 ILE 35 3HD1 ILE 35 -1.797 -13.224 2.318
260 1HN NH2 36 1HN NH2 36 2.569 -12.845 -3.462
261 2HN NH2 36 2HN NH2 36 1.418 -11.796 -2.606
Start of MODEL 12
1 1H GLU 1 1H GLU 1 6.834 10.970 1.368
2 2H GLU 1 2H GLU 1 5.534 10.836 2.454
3 3H GLU 1 3H GLU 1 5.560 12.090 1.309
4 HA GLU 1 HA GLU 1 4.017 10.327 0.639
5 1HB GLU 1 2HB GLU 1 5.855 11.752 -0.787
6 2HB GLU 1 1HB GLU 1 6.279 10.111 -1.272
7 1HG GLU 1 2HG GLU 1 3.379 10.784 -1.237
8 2HG GLU 1 1HG GLU 1 4.349 11.527 -2.509
9 H CYS 2 H CYS 2 5.019 8.793 2.629
10 HA CYS 2 HA CYS 2 5.530 6.205 1.302
11 1HB CYS 2 2HB CYS 2 7.782 6.902 1.468
12 2HB CYS 2 1HB CYS 2 7.510 7.714 3.009
13 H LEU 3 H LEU 3 4.107 4.870 2.343
14 HA LEU 3 HA LEU 3 3.517 5.372 5.242
15 1HB LEU 3 2HB LEU 3 1.961 4.023 3.011
16 2HB LEU 3 1HB LEU 3 1.410 4.115 4.683
17 HG LEU 3 HG LEU 3 2.033 6.501 2.914
18 1HD1 LEU 3 1HD1 LEU 3 -0.010 5.300 2.229
19 2HD1 LEU 3 2HD1 LEU 3 -0.410 6.855 2.958
20 3HD1 LEU 3 3HD1 LEU 3 -0.608 5.368 3.886
21 1HD2 LEU 3 1HD2 LEU 3 1.309 6.151 5.797
22 2HD2 LEU 3 2HD2 LEU 3 0.624 7.528 4.935
23 3HD2 LEU 3 3HD2 LEU 3 2.374 7.339 5.047
24 H GLY 4 H GLY 4 3.659 3.614 6.693
25 1HA GLY 4 2HA GLY 4 5.450 1.450 5.932
26 2HA GLY 4 1HA GLY 4 4.703 1.665 7.514
27 H PHE 5 H PHE 5 4.752 -0.872 6.721
28 HA PHE 5 HA PHE 5 2.595 -1.767 5.032
29 1HB PHE 5 2HB PHE 5 4.517 -3.155 5.533
30 2HB PHE 5 1HB PHE 5 4.205 -3.045 7.264
31 HD1 PHE 5 HD1 PHE 5 2.590 -4.452 8.336
32 HD2 PHE 5 HD2 PHE 5 2.914 -4.405 4.052
33 HE1 PHE 5 HE1 PHE 5 1.114 -6.439 8.202
34 HE2 PHE 5 HE2 PHE 5 1.439 -6.395 3.922
35 HZ PHE 5 HZ PHE 5 0.539 -7.411 5.995
36 H GLY 6 H GLY 6 0.464 -2.256 5.546
37 1HA GLY 6 2HA GLY 6 -1.503 -2.451 6.810
38 2HA GLY 6 1HA GLY 6 -0.500 -2.580 8.254
39 H LYS 7 H LYS 7 -0.717 0.074 5.872
40 HA LYS 7 HA LYS 7 -1.496 1.904 8.123
41 1HB LYS 7 2HB LYS 7 0.824 2.081 7.095
42 2HB LYS 7 1HB LYS 7 0.038 2.559 5.590
43 1HG LYS 7 2HG LYS 7 0.353 4.653 6.494
44 2HG LYS 7 1HG LYS 7 -1.198 4.273 7.241
45 1HD LYS 7 2HD LYS 7 0.010 3.385 9.231
46 2HD LYS 7 1HD LYS 7 1.536 3.871 8.492
47 1HE LYS 7 2HE LYS 7 -0.681 5.891 8.856
48 2HE LYS 7 1HE LYS 7 0.429 5.517 10.187
49 1HZ LYS 7 1HZ LYS 7 1.751 7.006 9.166
50 2HZ LYS 7 2HZ LYS 7 0.955 6.866 7.673
51 3HZ LYS 7 3HZ LYS 7 2.128 5.722 8.124
52 H GLY 8 H GLY 8 -3.410 2.995 7.828
53 1HA GLY 8 2HA GLY 8 -5.180 2.443 5.673
54 2HA GLY 8 1HA GLY 8 -5.363 3.787 6.801
55 H CYS 9 H CYS 9 -4.955 3.077 3.590
56 HA CYS 9 HA CYS 9 -4.065 5.861 3.002
57 1HB CYS 9 2HB CYS 9 -2.353 5.061 1.490
58 2HB CYS 9 1HB CYS 9 -2.119 4.235 3.030
59 H ASN 10 H ASN 10 -4.334 6.255 0.534
60 HA ASN 10 HA ASN 10 -6.973 5.161 -0.286
61 1HB ASN 10 2HB ASN 10 -5.225 7.506 -1.032
62 2HB ASN 10 1HB ASN 10 -6.585 7.042 -2.056
63 1HD2 ASN 10 1HD2 ASN 10 -5.751 8.921 0.655
64 2HD2 ASN 10 2HD2 ASN 10 -7.312 9.139 1.287
65 HA PRO 11 HA PRO 11 -4.968 2.442 -3.171
66 1HB PRO 11 2HB PRO 11 -7.172 1.820 -4.676
67 2HB PRO 11 1HB PRO 11 -6.865 1.128 -3.070
68 1HG PRO 11 2HG PRO 11 -8.667 3.369 -3.853
69 2HG PRO 11 1HG PRO 11 -8.928 2.069 -2.679
70 1HD PRO 11 2HD PRO 11 -8.239 4.592 -1.958
71 2HD PRO 11 1HD PRO 11 -7.778 3.156 -1.017
72 H SER 12 H SER 12 -6.986 5.166 -4.209
73 HA SER 12 HA SER 12 -6.187 5.163 -6.991
74 1HB SER 12 2HB SER 12 -8.208 6.246 -5.860
75 2HB SER 12 1HB SER 12 -7.106 7.497 -5.292
76 HG SER 12 HG SER 12 -7.595 8.333 -7.181
77 H ASN 13 H ASN 13 -5.049 6.985 -4.119
78 HA ASN 13 HA ASN 13 -2.946 8.350 -5.649
79 1HB ASN 13 2HB ASN 13 -4.325 9.142 -3.589
80 2HB ASN 13 1HB ASN 13 -3.196 8.168 -2.647
81 1HD2 ASN 13 1HD2 ASN 13 -3.582 11.188 -4.335
82 2HD2 ASN 13 2HD2 ASN 13 -1.996 11.749 -4.113
83 H ASP 14 H ASP 14 -3.115 5.750 -3.222
84 HA ASP 14 HA ASP 14 -1.567 4.090 -2.608
85 1HB ASP 14 2HB ASP 14 -1.736 4.096 -5.271
86 2HB ASP 14 1HB ASP 14 -0.054 4.614 -5.140
87 H GLN 15 H GLN 15 -0.752 5.601 -0.927
88 HA GLN 15 HA GLN 15 1.806 6.985 -1.587
89 1HB GLN 15 2HB GLN 15 -0.217 8.035 -0.400
90 2HB GLN 15 1HB GLN 15 0.227 7.045 0.989
91 1HG GLN 15 2HG GLN 15 1.687 8.656 1.576
92 2HG GLN 15 1HG GLN 15 2.629 8.237 0.146
93 1HE2 GLN 15 1HE2 GLN 15 1.439 10.902 1.600
94 2HE2 GLN 15 2HE2 GLN 15 1.054 11.852 0.248
95 H CYS 16 H CYS 16 1.327 3.915 -1.005
96 HA CYS 16 HA CYS 16 2.726 3.385 1.486
97 1HB CYS 16 2HB CYS 16 2.122 1.740 -0.991
98 2HB CYS 16 1HB CYS 16 2.806 1.068 0.488
99 H CYS 17 H CYS 17 4.924 2.589 1.687
100 HA CYS 17 HA CYS 17 6.837 3.930 -0.046
101 1HB CYS 17 2HB CYS 17 6.731 2.800 2.534
102 2HB CYS 17 1HB CYS 17 7.950 1.868 1.665
103 H LYS 18 H LYS 18 7.689 3.137 -1.908
104 HA LYS 18 HA LYS 18 7.034 0.474 -2.892
105 1HB LYS 18 2HB LYS 18 8.085 2.998 -3.831
106 2HB LYS 18 1HB LYS 18 9.090 1.678 -4.429
107 1HG LYS 18 2HG LYS 18 6.223 1.086 -4.590
108 2HG LYS 18 1HG LYS 18 6.688 2.497 -5.541
109 1HD LYS 18 2HD LYS 18 8.144 1.277 -6.894
110 2HD LYS 18 1HD LYS 18 8.361 0.007 -5.690
111 1HE LYS 18 2HE LYS 18 6.072 -0.800 -6.082
112 2HE LYS 18 1HE LYS 18 5.797 0.510 -7.247
113 1HZ LYS 18 1HZ LYS 18 7.663 -0.293 -8.552
114 2HZ LYS 18 2HZ LYS 18 6.512 -1.528 -8.362
115 3HZ LYS 18 3HZ LYS 18 7.939 -1.545 -7.441
116 H SER 19 H SER 19 9.738 1.855 -1.139
117 HA SER 19 HA SER 19 11.851 0.110 -1.874
118 1HB SER 19 2HB SER 19 12.749 0.767 0.354
119 2HB SER 19 1HB SER 19 12.084 2.144 -0.519
120 HG SER 19 HG SER 19 10.681 2.368 1.022
121 H SER 20 H SER 20 9.220 -0.357 0.498
122 HA SER 20 HA SER 20 10.261 -3.089 1.115
123 1HB SER 20 2HB SER 20 9.057 -0.979 2.581
124 2HB SER 20 1HB SER 20 7.884 -2.292 2.554
125 HG SER 20 HG SER 20 10.434 -2.166 3.671
126 H ASN 21 H ASN 21 8.759 -2.207 -1.434
127 HA ASN 21 HA ASN 21 7.062 -3.038 -2.836
128 1HB ASN 21 2HB ASN 21 7.853 -5.293 -1.003
129 2HB ASN 21 1HB ASN 21 6.578 -5.541 -2.196
130 1HD2 ASN 21 1HD2 ASN 21 10.031 -4.652 -1.863
131 2HD2 ASN 21 2HD2 ASN 21 10.446 -5.038 -3.463
132 H LEU 22 H LEU 22 5.895 -1.318 -1.160
133 HA LEU 22 HA LEU 22 3.545 -2.740 0.051
134 1HB LEU 22 2HB LEU 22 4.836 -0.046 0.592
135 2HB LEU 22 1HB LEU 22 3.357 -0.600 1.372
136 HG LEU 22 HG LEU 22 5.907 -2.220 1.455
137 1HD1 LEU 22 1HD1 LEU 22 6.119 -1.235 3.802
138 2HD1 LEU 22 2HD1 LEU 22 4.968 -0.002 3.287
139 3HD1 LEU 22 3HD1 LEU 22 6.527 -0.147 2.475
140 1HD2 LEU 22 1HD2 LEU 22 3.406 -2.131 3.175
141 2HD2 LEU 22 2HD2 LEU 22 4.794 -3.181 3.458
142 3HD2 LEU 22 3HD2 LEU 22 3.814 -3.388 2.007
143 H VAL 23 H VAL 23 1.541 -2.296 -0.789
144 HA VAL 23 HA VAL 23 1.186 0.089 -2.557
145 HB VAL 23 HB VAL 23 -0.059 -1.482 -4.132
146 1HG1 VAL 23 1HG1 VAL 23 2.342 -0.676 -4.422
147 2HG1 VAL 23 2HG1 VAL 23 1.928 -2.165 -5.271
148 3HG1 VAL 23 3HG1 VAL 23 2.849 -2.234 -3.770
149 1HG2 VAL 23 1HG2 VAL 23 -0.297 -3.305 -2.384
150 2HG2 VAL 23 2HG2 VAL 23 1.422 -3.640 -2.597
151 3HG2 VAL 23 3HG2 VAL 23 0.307 -3.860 -3.946
152 H CYS 24 H CYS 24 -0.899 0.988 -2.393
153 HA CYS 24 HA CYS 24 -2.489 0.362 -0.086
154 1HB CYS 24 2HB CYS 24 -2.845 2.026 -2.579
155 2HB CYS 24 1HB CYS 24 -4.135 1.903 -1.383
156 H SER 25 H SER 25 -3.875 -1.325 0.153
157 HA SER 25 HA SER 25 -4.642 -3.050 -2.066
158 1HB SER 25 2HB SER 25 -4.206 -3.519 0.478
159 2HB SER 25 1HB SER 25 -5.886 -3.032 0.681
160 HG SER 25 HG SER 25 -5.760 -5.257 0.331
161 H ARG 26 H ARG 26 -6.896 -3.501 -2.663
162 HA ARG 26 HA ARG 26 -8.543 -1.040 -2.780
163 1HB ARG 26 2HB ARG 26 -8.146 -3.527 -4.285
164 2HB ARG 26 1HB ARG 26 -9.851 -3.113 -4.104
165 1HG ARG 26 2HG ARG 26 -9.124 -2.010 -6.094
166 2HG ARG 26 1HG ARG 26 -9.221 -0.756 -4.858
167 1HD ARG 26 2HD ARG 26 -7.069 -0.251 -5.405
168 2HD ARG 26 1HD ARG 26 -6.618 -1.765 -4.599
169 HE ARG 26 HE ARG 26 -6.388 -2.782 -6.730
170 1HH1 ARG 26 1HH2 ARG 26 -6.041 0.278 -7.465
171 2HH1 ARG 26 2HH2 ARG 26 -6.946 0.311 -8.942
172 1HH2 ARG 26 2HH1 ARG 26 -8.440 -2.781 -8.408
173 2HH2 ARG 26 1HH1 ARG 26 -8.307 -1.424 -9.476
174 H LYS 27 H LYS 27 -8.763 -4.390 -1.570
175 HA LYS 27 HA LYS 27 -11.456 -4.034 -0.472
176 1HB LYS 27 2HB LYS 27 -10.394 -6.167 -1.359
177 2HB LYS 27 1HB LYS 27 -9.377 -6.175 0.082
178 1HG LYS 27 2HG LYS 27 -11.756 -5.880 1.284
179 2HG LYS 27 1HG LYS 27 -12.301 -6.703 -0.178
180 1HD LYS 27 2HD LYS 27 -10.792 -8.555 0.228
181 2HD LYS 27 1HD LYS 27 -10.048 -7.708 1.583
182 1HE LYS 27 2HE LYS 27 -11.548 -8.962 2.806
183 2HE LYS 27 1HE LYS 27 -12.665 -7.657 2.359
184 1HZ LYS 27 1HZ LYS 27 -13.224 -8.891 0.341
185 2HZ LYS 27 2HZ LYS 27 -13.582 -9.802 1.729
186 3HZ LYS 27 3HZ LYS 27 -12.197 -10.156 0.812
187 H HIS 28 H HIS 28 -8.123 -4.090 0.815
188 HA HIS 28 HA HIS 28 -9.089 -3.611 3.575
189 1HB HIS 28 2HB HIS 28 -6.355 -3.968 2.308
190 2HB HIS 28 1HB HIS 28 -6.621 -3.782 4.041
191 HD1 HIS 28 HD1 HIS 28 -5.459 -6.409 2.707
192 HD2 HIS 28 HD2 HIS 28 -9.434 -5.835 3.820
193 HE1 HIS 28 HE1 HIS 28 -6.451 -8.716 3.038
194 H ARG 29 H ARG 29 -7.895 -1.772 0.861
195 HA ARG 29 HA ARG 29 -7.412 0.516 0.594
196 1HB ARG 29 2HB ARG 29 -9.180 0.486 3.060
197 2HB ARG 29 1HB ARG 29 -8.726 1.963 2.210
198 1HG ARG 29 2HG ARG 29 -9.966 1.422 0.317
199 2HG ARG 29 1HG ARG 29 -9.897 -0.310 0.641
200 1HD ARG 29 2HD ARG 29 -11.360 1.508 2.552
201 2HD ARG 29 1HD ARG 29 -12.157 0.938 1.073
202 HE ARG 29 HE ARG 29 -11.400 -1.413 1.878
203 1HH1 ARG 29 2HH1 ARG 29 -13.921 -0.553 3.180
204 2HH1 ARG 29 1HH1 ARG 29 -13.566 -0.740 4.864
205 1HH2 ARG 29 1HH2 ARG 29 -10.125 -0.875 4.394
206 2HH2 ARG 29 2HH2 ARG 29 -11.410 -0.923 5.554
207 H TRP 30 H TRP 30 -5.361 -0.971 1.903
208 HA TRP 30 HA TRP 30 -4.080 1.208 3.440
209 1HB TRP 30 2HB TRP 30 -3.760 -0.093 5.412
210 2HB TRP 30 1HB TRP 30 -5.445 -0.323 4.973
211 HD1 TRP 30 HD1 TRP 30 -4.365 -2.451 2.524
212 HE1 TRP 30 HE1 TRP 30 -3.926 -4.866 3.291
213 HE3 TRP 30 HE3 TRP 30 -3.961 -1.714 7.559
214 HZ2 TRP 30 HZ2 TRP 30 -3.467 -6.304 5.719
215 HZ3 TRP 30 HZ3 TRP 30 -3.525 -3.624 9.075
216 HH2 TRP 30 HH2 TRP 30 -3.278 -5.916 8.163
217 H CYS 31 H CYS 31 -1.702 0.431 4.016
218 HA CYS 31 HA CYS 31 -0.426 -0.325 1.536
219 1HB CYS 31 2HB CYS 31 0.462 0.063 4.397
220 2HB CYS 31 1HB CYS 31 1.600 -0.434 3.148
221 H LYS 32 H LYS 32 -0.466 -2.378 0.749
222 HA LYS 32 HA LYS 32 -0.220 -4.663 2.683
223 1HB LYS 32 2HB LYS 32 -2.427 -4.492 1.614
224 2HB LYS 32 1HB LYS 32 -1.671 -4.427 0.023
225 1HG LYS 32 2HG LYS 32 -1.659 -6.674 -0.066
226 2HG LYS 32 1HG LYS 32 -0.652 -6.727 1.380
227 1HD LYS 32 2HD LYS 32 -2.809 -6.404 2.719
228 2HD LYS 32 1HD LYS 32 -3.670 -6.752 1.219
229 1HE LYS 32 2HE LYS 32 -2.337 -8.909 1.060
230 2HE LYS 32 1HE LYS 32 -1.757 -8.581 2.705
231 1HZ LYS 32 1HZ LYS 32 -3.790 -9.924 2.719
232 2HZ LYS 32 2HZ LYS 32 -4.615 -8.694 1.886
233 3HZ LYS 32 3HZ LYS 32 -4.036 -8.418 3.460
234 H TYR 33 H TYR 33 1.239 -6.330 2.079
235 HA TYR 33 HA TYR 33 3.417 -5.563 0.301
236 1HB TYR 33 2HB TYR 33 3.699 -6.830 2.410
237 2HB TYR 33 1HB TYR 33 2.753 -8.158 1.738
238 HD1 TYR 33 HD1 TYR 33 5.770 -6.060 0.981
239 HD2 TYR 33 HD2 TYR 33 3.847 -9.880 0.597
240 HE1 TYR 33 HE1 TYR 33 7.811 -6.980 -0.082
241 HE2 TYR 33 HE2 TYR 33 5.888 -10.801 -0.467
242 HH TYR 33 HH TYR 33 8.033 -9.347 -1.888
243 H GLU 34 H GLU 34 3.661 -6.142 -1.831
244 HA GLU 34 HA GLU 34 1.489 -7.334 -3.309
245 1HB GLU 34 2HB GLU 34 3.219 -7.256 -5.170
246 2HB GLU 34 1HB GLU 34 2.950 -5.724 -4.343
247 1HG GLU 34 2HG GLU 34 5.091 -5.639 -3.634
248 2HG GLU 34 1HG GLU 34 5.022 -7.291 -3.021
249 H ILE 35 H ILE 35 1.002 -9.449 -2.766
250 HA ILE 35 HA ILE 35 3.126 -11.482 -2.457
251 HB ILE 35 HB ILE 35 0.094 -11.626 -2.264
252 1HG1 ILE 35 1HG1 ILE 35 2.002 -11.693 0.065
253 2HG1 ILE 35 2HG1 ILE 35 1.540 -10.141 -0.630
254 1HG2 ILE 35 1HG2 ILE 35 2.303 -13.604 -1.848
255 2HG2 ILE 35 2HG2 ILE 35 0.922 -13.660 -0.752
256 3HG2 ILE 35 3HG2 ILE 35 0.679 -13.855 -2.488
257 1HD1 ILE 35 1HD1 ILE 35 -0.745 -11.931 -0.220
258 2HD1 ILE 35 2HD1 ILE 35 0.094 -11.527 1.277
259 3HD1 ILE 35 3HD1 ILE 35 -0.543 -10.244 0.249
260 1HN NH2 36 1HN NH2 36 2.375 -11.387 -6.183
261 2HN NH2 36 2HN NH2 36 2.779 -10.161 -4.962
Start of MODEL 13
1 1H GLU 1 1H GLU 1 9.724 7.570 3.779
2 2H GLU 1 2H GLU 1 10.710 8.859 3.279
3 3H GLU 1 3H GLU 1 10.553 7.477 2.303
4 HA GLU 1 HA GLU 1 8.381 9.421 2.928
5 1HB GLU 1 2HB GLU 1 10.319 8.950 0.674
6 2HB GLU 1 1HB GLU 1 8.734 9.638 0.319
7 1HG GLU 1 2HG GLU 1 9.222 11.331 2.185
8 2HG GLU 1 1HG GLU 1 10.892 10.765 2.112
9 H CYS 2 H CYS 2 7.464 7.123 3.639
10 HA CYS 2 HA CYS 2 5.847 6.130 1.368
11 1HB CYS 2 2HB CYS 2 6.606 3.828 1.668
12 2HB CYS 2 1HB CYS 2 8.009 4.855 1.384
13 H LEU 3 H LEU 3 4.398 4.211 2.342
14 HA LEU 3 HA LEU 3 3.379 5.185 4.986
15 1HB LEU 3 2HB LEU 3 2.075 3.765 2.643
16 2HB LEU 3 1HB LEU 3 1.242 4.141 4.151
17 HG LEU 3 HG LEU 3 2.610 6.230 2.434
18 1HD1 LEU 3 1HD1 LEU 3 -0.360 5.683 2.620
19 2HD1 LEU 3 2HD1 LEU 3 0.649 5.039 1.325
20 3HD1 LEU 3 3HD1 LEU 3 0.468 6.783 1.518
21 1HD2 LEU 3 1HD2 LEU 3 0.730 6.321 4.809
22 2HD2 LEU 3 2HD2 LEU 3 1.072 7.727 3.801
23 3HD2 LEU 3 3HD2 LEU 3 2.371 6.959 4.714
24 H GLY 4 H GLY 4 3.110 3.704 6.657
25 1HA GLY 4 2HA GLY 4 4.573 1.203 6.508
26 2HA GLY 4 1HA GLY 4 3.637 1.771 7.890
27 H PHE 5 H PHE 5 3.270 -0.783 7.597
28 HA PHE 5 HA PHE 5 1.313 -1.606 5.621
29 1HB PHE 5 2HB PHE 5 2.809 -3.217 6.582
30 2HB PHE 5 1HB PHE 5 2.378 -2.737 8.222
31 HD1 PHE 5 HD1 PHE 5 0.786 -3.986 9.378
32 HD2 PHE 5 HD2 PHE 5 0.780 -4.044 5.083
33 HE1 PHE 5 HE1 PHE 5 -1.032 -5.670 9.404
34 HE2 PHE 5 HE2 PHE 5 -1.039 -5.729 5.110
35 HZ PHE 5 HZ PHE 5 -1.945 -6.541 7.269
36 H GLY 6 H GLY 6 -0.886 -1.405 5.722
37 1HA GLY 6 2HA GLY 6 -3.041 -1.228 6.681
38 2HA GLY 6 1HA GLY 6 -2.299 -1.197 8.280
39 H LYS 7 H LYS 7 -1.516 0.959 5.562
40 HA LYS 7 HA LYS 7 -2.549 3.256 7.200
41 1HB LYS 7 2HB LYS 7 -0.005 2.682 5.782
42 2HB LYS 7 1HB LYS 7 -0.627 4.320 5.582
43 1HG LYS 7 2HG LYS 7 -0.985 4.111 8.220
44 2HG LYS 7 1HG LYS 7 0.325 2.942 8.056
45 1HD LYS 7 2HD LYS 7 1.543 4.894 8.353
46 2HD LYS 7 1HD LYS 7 1.420 4.859 6.594
47 1HE LYS 7 2HE LYS 7 -0.435 6.423 6.622
48 2HE LYS 7 1HE LYS 7 -0.526 6.347 8.393
49 1HZ LYS 7 1HZ LYS 7 1.662 7.243 8.572
50 2HZ LYS 7 2HZ LYS 7 0.782 8.265 7.539
51 3HZ LYS 7 3HZ LYS 7 1.906 7.166 6.895
52 H GLY 8 H GLY 8 -3.713 4.858 6.062
53 1HA GLY 8 2HA GLY 8 -5.261 4.146 3.830
54 2HA GLY 8 1HA GLY 8 -4.957 5.814 4.314
55 H CYS 9 H CYS 9 -4.683 3.798 1.749
56 HA CYS 9 HA CYS 9 -2.532 5.461 0.518
57 1HB CYS 9 2HB CYS 9 -1.320 3.564 1.260
58 2HB CYS 9 1HB CYS 9 -2.645 2.465 0.885
59 H ASN 10 H ASN 10 -2.741 5.615 -1.781
60 HA ASN 10 HA ASN 10 -5.398 4.758 -2.847
61 1HB ASN 10 2HB ASN 10 -3.431 6.961 -3.323
62 2HB ASN 10 1HB ASN 10 -4.416 6.448 -4.693
63 1HD2 ASN 10 1HD2 ASN 10 -6.203 7.816 -4.855
64 2HD2 ASN 10 2HD2 ASN 10 -7.119 8.381 -3.542
65 HA PRO 11 HA PRO 11 -3.295 1.676 -5.239
66 1HB PRO 11 2HB PRO 11 -5.251 1.213 -7.102
67 2HB PRO 11 1HB PRO 11 -5.329 0.604 -5.437
68 1HG PRO 11 2HG PRO 11 -6.661 2.980 -6.646
69 2HG PRO 11 1HG PRO 11 -7.292 1.802 -5.484
70 1HD PRO 11 2HD PRO 11 -6.428 4.273 -4.765
71 2HD PRO 11 1HD PRO 11 -6.332 2.861 -3.688
72 H SER 12 H SER 12 -4.730 4.533 -6.783
73 HA SER 12 HA SER 12 -3.404 4.224 -9.344
74 1HB SER 12 2HB SER 12 -4.736 6.494 -7.853
75 2HB SER 12 1HB SER 12 -4.073 6.700 -9.472
76 HG SER 12 HG SER 12 -6.271 5.219 -8.588
77 H ASN 13 H ASN 13 -2.652 6.075 -6.376
78 HA ASN 13 HA ASN 13 -0.156 7.129 -7.545
79 1HB ASN 13 2HB ASN 13 -1.986 8.032 -5.734
80 2HB ASN 13 1HB ASN 13 -0.743 7.402 -4.653
81 1HD2 ASN 13 1HD2 ASN 13 -1.258 9.697 -7.359
82 2HD2 ASN 13 2HD2 ASN 13 0.102 10.652 -7.013
83 H ASP 14 H ASP 14 -1.145 4.794 -5.058
84 HA ASP 14 HA ASP 14 0.034 3.070 -3.979
85 1HB ASP 14 2HB ASP 14 0.547 2.866 -6.575
86 2HB ASP 14 1HB ASP 14 2.174 3.325 -6.070
87 H GLN 15 H GLN 15 0.570 4.459 -2.161
88 HA GLN 15 HA GLN 15 3.343 5.597 -2.197
89 1HB GLN 15 2HB GLN 15 0.769 6.236 -0.763
90 2HB GLN 15 1HB GLN 15 2.311 6.816 -0.130
91 1HG GLN 15 2HG GLN 15 2.588 7.504 -2.740
92 2HG GLN 15 1HG GLN 15 0.838 7.640 -2.571
93 1HE2 GLN 15 1HE2 GLN 15 3.910 9.066 -1.628
94 2HE2 GLN 15 2HE2 GLN 15 3.253 10.374 -0.768
95 H CYS 16 H CYS 16 2.474 2.701 -1.591
96 HA CYS 16 HA CYS 16 2.907 2.366 1.288
97 1HB CYS 16 2HB CYS 16 2.732 0.518 -1.107
98 2HB CYS 16 1HB CYS 16 2.976 -0.078 0.534
99 H CYS 17 H CYS 17 4.786 1.263 2.202
100 HA CYS 17 HA CYS 17 7.316 2.119 1.010
101 1HB CYS 17 2HB CYS 17 6.333 1.645 3.537
102 2HB CYS 17 1HB CYS 17 7.343 0.224 3.273
103 H LYS 18 H LYS 18 8.367 0.940 -0.528
104 HA LYS 18 HA LYS 18 7.670 -1.823 -1.143
105 1HB LYS 18 2HB LYS 18 8.398 -0.074 -2.780
106 2HB LYS 18 1HB LYS 18 10.002 -0.098 -2.046
107 1HG LYS 18 2HG LYS 18 10.577 -1.995 -3.129
108 2HG LYS 18 1HG LYS 18 9.053 -2.780 -2.716
109 1HD LYS 18 2HD LYS 18 8.224 -0.919 -4.552
110 2HD LYS 18 1HD LYS 18 9.819 -1.342 -5.174
111 1HE LYS 18 2HE LYS 18 7.920 -3.528 -4.325
112 2HE LYS 18 1HE LYS 18 7.773 -2.791 -5.933
113 1HZ LYS 18 1HZ LYS 18 9.313 -4.653 -5.994
114 2HZ LYS 18 2HZ LYS 18 10.254 -3.951 -4.767
115 3HZ LYS 18 3HZ LYS 18 10.139 -3.202 -6.289
116 H SER 19 H SER 19 10.111 -0.241 0.838
117 HA SER 19 HA SER 19 12.091 -2.277 1.003
118 1HB SER 19 2HB SER 19 11.055 -0.167 2.907
119 2HB SER 19 1HB SER 19 12.451 -1.169 3.293
120 HG SER 19 HG SER 19 12.184 0.913 1.513
121 H SER 20 H SER 20 8.992 -1.907 2.722
122 HA SER 20 HA SER 20 9.510 -4.404 4.267
123 1HB SER 20 2HB SER 20 8.660 -2.189 5.245
124 2HB SER 20 1HB SER 20 7.146 -2.516 4.406
125 HG SER 20 HG SER 20 8.079 -3.538 6.714
126 H ASN 21 H ASN 21 8.752 -4.169 1.251
127 HA ASN 21 HA ASN 21 7.361 -5.303 -0.273
128 1HB ASN 21 2HB ASN 21 8.255 -6.984 1.748
129 2HB ASN 21 1HB ASN 21 6.521 -7.304 1.711
130 1HD2 ASN 21 1HD2 ASN 21 9.348 -7.038 -0.517
131 2HD2 ASN 21 2HD2 ASN 21 8.765 -8.185 -1.624
132 H LEU 22 H LEU 22 5.956 -3.191 0.449
133 HA LEU 22 HA LEU 22 3.276 -4.212 1.348
134 1HB LEU 22 2HB LEU 22 4.679 -1.552 1.738
135 2HB LEU 22 1HB LEU 22 2.983 -1.819 2.137
136 HG LEU 22 HG LEU 22 5.267 -3.462 3.267
137 1HD1 LEU 22 1HD1 LEU 22 4.921 -2.180 5.335
138 2HD1 LEU 22 2HD1 LEU 22 3.687 -1.205 4.537
139 3HD1 LEU 22 3HD1 LEU 22 5.368 -1.100 4.015
140 1HD2 LEU 22 1HD2 LEU 22 3.440 -4.065 4.933
141 2HD2 LEU 22 2HD2 LEU 22 3.200 -4.696 3.305
142 3HD2 LEU 22 3HD2 LEU 22 2.296 -3.281 3.844
143 H VAL 23 H VAL 23 1.603 -3.883 -0.056
144 HA VAL 23 HA VAL 23 2.028 -2.032 -2.384
145 HB VAL 23 HB VAL 23 0.650 -3.702 -3.660
146 1HG1 VAL 23 1HG1 VAL 23 3.185 -3.725 -3.574
147 2HG1 VAL 23 2HG1 VAL 23 2.438 -5.268 -3.987
148 3HG1 VAL 23 3HG1 VAL 23 3.057 -4.996 -2.358
149 1HG2 VAL 23 1HG2 VAL 23 1.095 -5.551 -1.306
150 2HG2 VAL 23 2HG2 VAL 23 0.079 -5.818 -2.723
151 3HG2 VAL 23 3HG2 VAL 23 -0.400 -4.636 -1.504
152 H CYS 24 H CYS 24 0.030 -1.012 -3.174
153 HA CYS 24 HA CYS 24 -1.813 -0.343 -1.000
154 1HB CYS 24 2HB CYS 24 -0.807 1.030 -3.054
155 2HB CYS 24 1HB CYS 24 -2.271 0.447 -3.848
156 H SER 25 H SER 25 -4.098 -0.732 -1.013
157 HA SER 25 HA SER 25 -4.954 -3.051 -2.720
158 1HB SER 25 2HB SER 25 -5.639 -2.160 0.092
159 2HB SER 25 1HB SER 25 -6.524 -3.431 -0.747
160 HG SER 25 HG SER 25 -4.848 -4.315 0.490
161 H ARG 26 H ARG 26 -7.428 -3.087 -3.000
162 HA ARG 26 HA ARG 26 -8.374 -0.336 -3.709
163 1HB ARG 26 2HB ARG 26 -8.087 -2.242 -5.406
164 2HB ARG 26 1HB ARG 26 -9.461 -3.014 -4.613
165 1HG ARG 26 2HG ARG 26 -10.855 -1.041 -5.065
166 2HG ARG 26 1HG ARG 26 -9.485 -0.234 -5.828
167 1HD ARG 26 2HD ARG 26 -10.123 -2.940 -6.885
168 2HD ARG 26 1HD ARG 26 -11.305 -1.666 -7.242
169 HE ARG 26 HE ARG 26 -9.172 -0.310 -7.944
170 1HH1 ARG 26 2HH1 ARG 26 -7.287 -2.603 -7.618
171 2HH1 ARG 26 1HH1 ARG 26 -7.231 -3.269 -9.216
172 1HH2 ARG 26 1HH2 ARG 26 -10.111 -1.645 -10.281
173 2HH2 ARG 26 2HH2 ARG 26 -8.832 -2.726 -10.726
174 H LYS 27 H LYS 27 -9.602 -3.441 -2.381
175 HA LYS 27 HA LYS 27 -12.132 -2.408 -1.481
176 1HB LYS 27 2HB LYS 27 -11.544 -4.797 -1.874
177 2HB LYS 27 1HB LYS 27 -10.462 -4.743 -0.483
178 1HG LYS 27 2HG LYS 27 -12.380 -5.583 0.519
179 2HG LYS 27 1HG LYS 27 -12.631 -3.854 0.758
180 1HD LYS 27 2HD LYS 27 -13.646 -4.395 -1.809
181 2HD LYS 27 1HD LYS 27 -14.205 -5.728 -0.799
182 1HE LYS 27 2HE LYS 27 -14.433 -2.917 0.252
183 2HE LYS 27 1HE LYS 27 -15.635 -3.515 -0.907
184 1HZ LYS 27 1HZ LYS 27 -15.939 -5.478 0.492
185 2HZ LYS 27 2HZ LYS 27 -16.303 -4.056 1.348
186 3HZ LYS 27 3HZ LYS 27 -14.833 -4.862 1.622
187 H HIS 28 H HIS 28 -9.000 -2.881 0.191
188 HA HIS 28 HA HIS 28 -10.052 -1.625 2.662
189 1HB HIS 28 2HB HIS 28 -7.377 -2.812 1.856
190 2HB HIS 28 1HB HIS 28 -7.746 -2.213 3.473
191 HD1 HIS 28 HD1 HIS 28 -10.564 -3.307 3.892
192 HD2 HIS 28 HD2 HIS 28 -7.489 -5.561 2.204
193 HE1 HIS 28 HE1 HIS 28 -11.195 -5.738 4.218
194 H ARG 29 H ARG 29 -8.189 -0.753 -0.168
195 HA ARG 29 HA ARG 29 -7.136 1.255 -0.805
196 1HB ARG 29 2HB ARG 29 -9.305 2.008 1.141
197 2HB ARG 29 1HB ARG 29 -8.243 3.262 0.501
198 1HG ARG 29 2HG ARG 29 -8.840 1.960 -1.796
199 2HG ARG 29 1HG ARG 29 -10.318 1.652 -0.884
200 1HD ARG 29 2HD ARG 29 -10.873 3.710 -1.808
201 2HD ARG 29 1HD ARG 29 -10.051 4.279 -0.341
202 HE ARG 29 HE ARG 29 -7.965 4.465 -1.717
203 1HH1 ARG 29 1HH2 ARG 29 -8.934 2.855 -4.071
204 2HH1 ARG 29 2HH2 ARG 29 -9.311 4.094 -5.220
205 1HH2 ARG 29 2HH1 ARG 29 -9.351 6.641 -2.855
206 2HH2 ARG 29 1HH1 ARG 29 -9.549 6.245 -4.529
207 H TRP 30 H TRP 30 -5.577 -0.220 0.956
208 HA TRP 30 HA TRP 30 -4.130 1.934 2.382
209 1HB TRP 30 2HB TRP 30 -4.236 0.823 4.511
210 2HB TRP 30 1HB TRP 30 -5.881 0.905 3.899
211 HD1 TRP 30 HD1 TRP 30 -4.758 -1.701 1.831
212 HE1 TRP 30 HE1 TRP 30 -5.066 -4.040 2.863
213 HE3 TRP 30 HE3 TRP 30 -5.424 -0.416 6.723
214 HZ2 TRP 30 HZ2 TRP 30 -5.535 -5.213 5.426
215 HZ3 TRP 30 HZ3 TRP 30 -5.801 -2.163 8.439
216 HH2 TRP 30 HH2 TRP 30 -5.857 -4.558 7.798
217 H CYS 31 H CYS 31 -2.185 0.524 3.645
218 HA CYS 31 HA CYS 31 -0.744 -0.732 1.381
219 1HB CYS 31 2HB CYS 31 -0.044 0.332 4.117
220 2HB CYS 31 1HB CYS 31 1.125 -0.596 3.178
221 H LYS 32 H LYS 32 -1.003 -2.901 1.146
222 HA LYS 32 HA LYS 32 -1.248 -4.611 3.600
223 1HB LYS 32 2HB LYS 32 -3.144 -4.484 1.914
224 2HB LYS 32 1HB LYS 32 -2.053 -5.214 0.736
225 1HG LYS 32 2HG LYS 32 -1.763 -7.173 2.201
226 2HG LYS 32 1HG LYS 32 -2.832 -6.443 3.399
227 1HD LYS 32 2HD LYS 32 -4.436 -7.656 2.317
228 2HD LYS 32 1HD LYS 32 -4.414 -6.296 1.195
229 1HE LYS 32 2HE LYS 32 -4.123 -8.099 -0.276
230 2HE LYS 32 1HE LYS 32 -2.435 -7.677 0.069
231 1HZ LYS 32 1HZ LYS 32 -4.031 -9.655 1.615
232 2HZ LYS 32 2HZ LYS 32 -2.385 -9.290 1.833
233 3HZ LYS 32 3HZ LYS 32 -2.907 -10.061 0.413
234 H TYR 33 H TYR 33 0.058 -6.553 3.643
235 HA TYR 33 HA TYR 33 2.674 -6.323 2.452
236 1HB TYR 33 2HB TYR 33 1.461 -7.708 4.519
237 2HB TYR 33 1HB TYR 33 1.823 -8.990 3.362
238 HD1 TYR 33 HD1 TYR 33 3.217 -6.514 5.663
239 HD2 TYR 33 HD2 TYR 33 4.160 -9.371 2.597
240 HE1 TYR 33 HE1 TYR 33 5.604 -6.441 6.329
241 HE2 TYR 33 HE2 TYR 33 6.547 -9.298 3.264
242 HH TYR 33 HH TYR 33 7.988 -7.137 4.689
243 H GLU 34 H GLU 34 3.516 -7.316 0.608
244 HA GLU 34 HA GLU 34 1.689 -8.175 -1.464
245 1HB GLU 34 2HB GLU 34 4.145 -7.108 -1.427
246 2HB GLU 34 1HB GLU 34 4.616 -8.803 -1.542
247 1HG GLU 34 2HG GLU 34 2.511 -7.678 -3.380
248 2HG GLU 34 1HG GLU 34 4.221 -7.471 -3.749
249 H ILE 35 H ILE 35 0.600 -10.089 -1.136
250 HA ILE 35 HA ILE 35 2.189 -12.577 -0.965
251 HB ILE 35 HB ILE 35 1.841 -11.821 1.376
252 1HG1 ILE 35 1HG1 ILE 35 -0.032 -14.038 1.459
253 2HG1 ILE 35 2HG1 ILE 35 1.240 -14.344 0.277
254 1HG2 ILE 35 1HG2 ILE 35 -0.458 -10.735 0.633
255 2HG2 ILE 35 2HG2 ILE 35 -1.105 -12.308 1.097
256 3HG2 ILE 35 3HG2 ILE 35 -0.239 -11.327 2.280
257 1HD1 ILE 35 1HD1 ILE 35 2.870 -13.549 2.133
258 2HD1 ILE 35 2HD1 ILE 35 1.515 -13.808 3.232
259 3HD1 ILE 35 3HD1 ILE 35 2.158 -15.155 2.293
260 1HN NH2 36 1HN NH2 36 -0.789 -12.077 -3.238
261 2HN NH2 36 2HN NH2 36 0.566 -11.068 -2.686
Start of MODEL 14
1 1H GLU 1 1H GLU 1 12.339 7.500 -0.097
2 2H GLU 1 2H GLU 1 11.456 6.914 -1.426
3 3H GLU 1 3H GLU 1 11.649 5.953 -0.039
4 HA GLU 1 HA GLU 1 10.350 7.564 1.265
5 1HB GLU 1 2HB GLU 1 11.153 9.255 -0.688
6 2HB GLU 1 1HB GLU 1 9.532 8.885 -1.277
7 1HG GLU 1 2HG GLU 1 8.602 9.497 0.941
8 2HG GLU 1 1HG GLU 1 10.225 9.917 1.490
9 H CYS 2 H CYS 2 8.688 6.160 1.681
10 HA CYS 2 HA CYS 2 6.768 5.513 -0.503
11 1HB CYS 2 2HB CYS 2 6.916 3.098 0.161
12 2HB CYS 2 1HB CYS 2 8.419 3.716 -0.519
13 H LEU 3 H LEU 3 4.785 4.384 0.462
14 HA LEU 3 HA LEU 3 3.984 5.786 2.934
15 1HB LEU 3 2HB LEU 3 2.581 3.981 0.937
16 2HB LEU 3 1HB LEU 3 1.767 4.732 2.309
17 HG LEU 3 HG LEU 3 3.347 6.379 0.332
18 1HD1 LEU 3 1HD1 LEU 3 1.539 4.985 -0.800
19 2HD1 LEU 3 2HD1 LEU 3 1.370 6.732 -0.974
20 3HD1 LEU 3 3HD1 LEU 3 0.369 5.860 0.187
21 1HD2 LEU 3 1HD2 LEU 3 2.424 7.112 2.707
22 2HD2 LEU 3 2HD2 LEU 3 0.897 7.242 1.835
23 3HD2 LEU 3 3HD2 LEU 3 2.288 8.198 1.325
24 H GLY 4 H GLY 4 3.779 4.800 4.926
25 1HA GLY 4 2HA GLY 4 4.886 2.159 5.341
26 2HA GLY 4 1HA GLY 4 4.122 3.159 6.575
27 H PHE 5 H PHE 5 3.483 0.618 6.857
28 HA PHE 5 HA PHE 5 1.308 -0.393 5.253
29 1HB PHE 5 2HB PHE 5 2.637 -1.894 6.561
30 2HB PHE 5 1HB PHE 5 2.392 -0.945 8.026
31 HD1 PHE 5 HD1 PHE 5 0.962 -1.917 9.574
32 HD2 PHE 5 HD2 PHE 5 0.198 -2.493 5.385
33 HE1 PHE 5 HE1 PHE 5 -1.046 -3.264 10.124
34 HE2 PHE 5 HE2 PHE 5 -1.810 -3.839 5.939
35 HZ PHE 5 HZ PHE 5 -2.431 -4.224 8.307
36 H GLY 6 H GLY 6 -0.879 -0.002 5.415
37 1HA GLY 6 2HA GLY 6 -2.928 0.742 6.310
38 2HA GLY 6 1HA GLY 6 -2.108 1.040 7.841
39 H LYS 7 H LYS 7 -1.333 2.379 4.625
40 HA LYS 7 HA LYS 7 -1.956 5.108 5.717
41 1HB LYS 7 2HB LYS 7 0.525 4.029 5.166
42 2HB LYS 7 1HB LYS 7 0.154 4.888 3.671
43 1HG LYS 7 2HG LYS 7 -0.403 6.302 6.239
44 2HG LYS 7 1HG LYS 7 1.285 6.124 5.761
45 1HD LYS 7 2HD LYS 7 1.081 7.685 4.148
46 2HD LYS 7 1HD LYS 7 -0.378 6.927 3.510
47 1HE LYS 7 2HE LYS 7 -1.797 8.209 4.855
48 2HE LYS 7 1HE LYS 7 -0.541 8.497 6.076
49 1HZ LYS 7 1HZ LYS 7 -0.891 10.453 4.667
50 2HZ LYS 7 2HZ LYS 7 -0.494 9.540 3.290
51 3HZ LYS 7 3HZ LYS 7 0.677 9.832 4.487
52 H GLY 8 H GLY 8 -3.154 6.416 4.355
53 1HA GLY 8 2HA GLY 8 -4.655 5.377 2.211
54 2HA GLY 8 1HA GLY 8 -4.386 7.097 2.479
55 H CYS 9 H CYS 9 -4.057 4.788 0.194
56 HA CYS 9 HA CYS 9 -1.933 6.326 -1.224
57 1HB CYS 9 2HB CYS 9 -0.617 4.379 -1.607
58 2HB CYS 9 1HB CYS 9 -1.052 4.294 0.099
59 H ASN 10 H ASN 10 -1.750 5.199 -3.567
60 HA ASN 10 HA ASN 10 -4.559 4.930 -4.578
61 1HB ASN 10 2HB ASN 10 -2.146 6.360 -5.363
62 2HB ASN 10 1HB ASN 10 -2.762 5.380 -6.694
63 1HD2 ASN 10 1HD2 ASN 10 -4.302 6.448 -7.938
64 2HD2 ASN 10 2HD2 ASN 10 -5.342 7.665 -7.373
65 HA PRO 11 HA PRO 11 -3.570 0.737 -5.621
66 1HB PRO 11 2HB PRO 11 -5.595 0.279 -7.405
67 2HB PRO 11 1HB PRO 11 -5.844 0.335 -5.648
68 1HG PRO 11 2HG PRO 11 -6.391 2.415 -7.704
69 2HG PRO 11 1HG PRO 11 -7.320 1.980 -6.261
70 1HD PRO 11 2HD PRO 11 -5.680 4.158 -6.404
71 2HD PRO 11 1HD PRO 11 -6.059 3.306 -4.890
72 H SER 12 H SER 12 -4.089 3.178 -8.151
73 HA SER 12 HA SER 12 -2.832 1.594 -10.269
74 1HB SER 12 2HB SER 12 -3.071 3.771 -11.495
75 2HB SER 12 1HB SER 12 -4.571 3.235 -10.744
76 HG SER 12 HG SER 12 -2.937 5.396 -10.159
77 H ASN 13 H ASN 13 -1.827 4.224 -8.081
78 HA ASN 13 HA ASN 13 0.833 4.460 -9.307
79 1HB ASN 13 2HB ASN 13 -0.613 5.630 -6.927
80 2HB ASN 13 1HB ASN 13 1.096 5.959 -7.204
81 1HD2 ASN 13 1HD2 ASN 13 1.618 7.549 -8.764
82 2HD2 ASN 13 2HD2 ASN 13 0.476 8.299 -9.770
83 H ASP 14 H ASP 14 -0.525 3.153 -6.284
84 HA ASP 14 HA ASP 14 0.372 1.689 -4.677
85 1HB ASP 14 2HB ASP 14 0.906 0.766 -7.318
86 2HB ASP 14 1HB ASP 14 2.336 0.409 -6.349
87 H GLN 15 H GLN 15 1.400 3.730 -3.750
88 HA GLN 15 HA GLN 15 4.355 3.869 -4.152
89 1HB GLN 15 2HB GLN 15 2.612 5.826 -4.246
90 2HB GLN 15 1HB GLN 15 2.675 5.736 -2.486
91 1HG GLN 15 2HG GLN 15 4.701 6.733 -2.415
92 2HG GLN 15 1HG GLN 15 5.342 5.672 -3.669
93 1HE2 GLN 15 1HE2 GLN 15 5.834 6.711 -5.608
94 2HE2 GLN 15 2HE2 GLN 15 5.154 8.178 -6.123
95 H CYS 16 H CYS 16 2.865 1.752 -2.480
96 HA CYS 16 HA CYS 16 3.455 2.353 0.313
97 1HB CYS 16 2HB CYS 16 2.780 -0.159 -1.247
98 2HB CYS 16 1HB CYS 16 2.938 -0.126 0.509
99 H CYS 17 H CYS 17 5.080 1.091 1.586
100 HA CYS 17 HA CYS 17 7.701 1.130 0.349
101 1HB CYS 17 2HB CYS 17 6.689 0.001 2.980
102 2HB CYS 17 1HB CYS 17 8.385 0.263 2.584
103 H LYS 18 H LYS 18 8.426 -0.437 -1.014
104 HA LYS 18 HA LYS 18 7.196 -3.044 -1.286
105 1HB LYS 18 2HB LYS 18 9.651 -1.636 -2.327
106 2HB LYS 18 1HB LYS 18 9.372 -3.336 -2.705
107 1HG LYS 18 2HG LYS 18 6.981 -2.529 -3.393
108 2HG LYS 18 1HG LYS 18 7.734 -0.937 -3.487
109 1HD LYS 18 2HD LYS 18 9.345 -1.714 -5.106
110 2HD LYS 18 1HD LYS 18 8.824 -3.386 -4.896
111 1HE LYS 18 2HE LYS 18 6.739 -1.391 -5.695
112 2HE LYS 18 1HE LYS 18 7.903 -1.915 -6.927
113 1HZ LYS 18 1HZ LYS 18 6.327 -3.730 -5.174
114 2HZ LYS 18 2HZ LYS 18 7.430 -4.212 -6.374
115 3HZ LYS 18 3HZ LYS 18 5.992 -3.419 -6.808
116 H SER 19 H SER 19 10.013 -1.836 0.489
117 HA SER 19 HA SER 19 11.366 -4.273 1.041
118 1HB SER 19 2HB SER 19 11.025 -1.636 2.467
119 2HB SER 19 1HB SER 19 12.044 -2.906 3.140
120 HG SER 19 HG SER 19 12.401 -1.302 0.911
121 H SER 20 H SER 20 8.569 -2.780 2.676
122 HA SER 20 HA SER 20 8.494 -4.981 4.671
123 1HB SER 20 2HB SER 20 8.194 -2.474 5.139
124 2HB SER 20 1HB SER 20 6.627 -2.620 4.347
125 HG SER 20 HG SER 20 7.498 -3.562 6.803
126 H ASN 21 H ASN 21 7.735 -5.173 1.639
127 HA ASN 21 HA ASN 21 6.073 -6.226 0.339
128 1HB ASN 21 2HB ASN 21 6.353 -7.518 2.946
129 2HB ASN 21 1HB ASN 21 4.752 -7.784 2.257
130 1HD2 ASN 21 1HD2 ASN 21 8.073 -8.735 2.062
131 2HD2 ASN 21 2HD2 ASN 21 7.935 -9.708 0.677
132 H LEU 22 H LEU 22 5.141 -3.801 0.566
133 HA LEU 22 HA LEU 22 2.396 -3.995 1.767
134 1HB LEU 22 2HB LEU 22 4.306 -1.678 1.358
135 2HB LEU 22 1HB LEU 22 2.627 -1.464 1.851
136 HG LEU 22 HG LEU 22 4.649 -3.160 3.349
137 1HD1 LEU 22 1HD1 LEU 22 5.105 -0.674 3.358
138 2HD1 LEU 22 2HD1 LEU 22 4.774 -1.356 4.950
139 3HD1 LEU 22 3HD1 LEU 22 3.522 -0.449 4.101
140 1HD2 LEU 22 1HD2 LEU 22 1.859 -2.202 4.074
141 2HD2 LEU 22 2HD2 LEU 22 2.920 -3.153 5.113
142 3HD2 LEU 22 3HD2 LEU 22 2.286 -3.852 3.624
143 H VAL 23 H VAL 23 0.719 -3.834 0.360
144 HA VAL 23 HA VAL 23 1.218 -2.687 -2.370
145 HB VAL 23 HB VAL 23 -0.456 -4.445 -3.121
146 1HG1 VAL 23 1HG1 VAL 23 2.009 -5.584 -1.778
147 2HG1 VAL 23 2HG1 VAL 23 2.044 -4.698 -3.302
148 3HG1 VAL 23 3HG1 VAL 23 1.172 -6.227 -3.191
149 1HG2 VAL 23 1HG2 VAL 23 0.116 -5.733 -0.441
150 2HG2 VAL 23 2HG2 VAL 23 -1.046 -6.244 -1.664
151 3HG2 VAL 23 3HG2 VAL 23 -1.337 -4.776 -0.733
152 H CYS 24 H CYS 24 -0.482 -1.371 -3.178
153 HA CYS 24 HA CYS 24 -2.234 -0.151 -1.218
154 1HB CYS 24 2HB CYS 24 -1.718 0.037 -4.167
155 2HB CYS 24 1HB CYS 24 -3.151 0.825 -3.507
156 H SER 25 H SER 25 -4.333 -0.675 -0.721
157 HA SER 25 HA SER 25 -5.547 -3.058 -1.984
158 1HB SER 25 2HB SER 25 -5.358 -2.497 0.524
159 2HB SER 25 1HB SER 25 -6.637 -1.320 0.242
160 HG SER 25 HG SER 25 -6.753 -4.041 0.417
161 H ARG 26 H ARG 26 -8.007 -2.903 -2.373
162 HA ARG 26 HA ARG 26 -8.575 -0.458 -3.996
163 1HB ARG 26 2HB ARG 26 -9.635 -3.297 -3.928
164 2HB ARG 26 1HB ARG 26 -10.379 -2.035 -4.911
165 1HG ARG 26 2HG ARG 26 -7.533 -1.984 -5.327
166 2HG ARG 26 1HG ARG 26 -8.116 -3.631 -5.558
167 1HD ARG 26 2HD ARG 26 -8.461 -2.735 -7.695
168 2HD ARG 26 1HD ARG 26 -10.033 -2.398 -6.944
169 HE ARG 26 HE ARG 26 -7.819 -0.380 -6.905
170 1HH1 ARG 26 2HH1 ARG 26 -9.557 -0.149 -9.283
171 2HH1 ARG 26 1HH1 ARG 26 -10.809 0.922 -8.748
172 1HH2 ARG 26 1HH2 ARG 26 -10.098 0.494 -5.375
173 2HH2 ARG 26 2HH2 ARG 26 -11.115 1.287 -6.530
174 H LYS 27 H LYS 27 -10.166 -2.663 -1.650
175 HA LYS 27 HA LYS 27 -12.482 -0.958 -1.254
176 1HB LYS 27 2HB LYS 27 -12.211 -3.478 -0.880
177 2HB LYS 27 1HB LYS 27 -11.353 -3.071 0.605
178 1HG LYS 27 2HG LYS 27 -13.810 -1.556 0.442
179 2HG LYS 27 1HG LYS 27 -14.150 -3.276 0.252
180 1HD LYS 27 2HD LYS 27 -12.295 -2.342 2.429
181 2HD LYS 27 1HD LYS 27 -14.041 -2.269 2.665
182 1HE LYS 27 2HE LYS 27 -14.167 -4.713 2.059
183 2HE LYS 27 1HE LYS 27 -12.392 -4.744 2.039
184 1HZ LYS 27 1HZ LYS 27 -14.093 -3.883 4.324
185 2HZ LYS 27 2HZ LYS 27 -12.394 -3.863 4.299
186 3HZ LYS 27 3HZ LYS 27 -13.229 -5.340 4.228
187 H HIS 28 H HIS 28 -9.422 -1.459 0.527
188 HA HIS 28 HA HIS 28 -10.154 0.612 2.515
189 1HB HIS 28 2HB HIS 28 -7.940 -1.391 2.110
190 2HB HIS 28 1HB HIS 28 -7.765 -0.101 3.301
191 HD1 HIS 28 HD1 HIS 28 -9.531 -0.048 5.267
192 HD2 HIS 28 HD2 HIS 28 -9.718 -3.441 2.852
193 HE1 HIS 28 HE1 HIS 28 -10.947 -1.736 6.514
194 H ARG 29 H ARG 29 -8.302 0.341 -0.441
195 HA ARG 29 HA ARG 29 -6.950 1.889 -1.600
196 1HB ARG 29 2HB ARG 29 -9.238 3.039 -1.073
197 2HB ARG 29 1HB ARG 29 -8.308 3.990 0.084
198 1HG ARG 29 2HG ARG 29 -6.840 3.903 -2.370
199 2HG ARG 29 1HG ARG 29 -8.503 4.359 -2.743
200 1HD ARG 29 2HD ARG 29 -8.368 6.104 -0.927
201 2HD ARG 29 1HD ARG 29 -6.644 5.718 -0.760
202 HE ARG 29 HE ARG 29 -7.100 6.121 -3.515
203 1HH1 ARG 29 2HH1 ARG 29 -8.977 8.242 -2.491
204 2HH1 ARG 29 1HH1 ARG 29 -7.929 9.615 -2.365
205 1HH2 ARG 29 1HH2 ARG 29 -5.012 7.732 -2.523
206 2HH2 ARG 29 2HH2 ARG 29 -5.678 9.325 -2.383
207 H TRP 30 H TRP 30 -5.601 0.744 0.561
208 HA TRP 30 HA TRP 30 -3.761 2.944 1.299
209 1HB TRP 30 2HB TRP 30 -3.969 2.555 3.662
210 2HB TRP 30 1HB TRP 30 -5.599 2.740 3.031
211 HD1 TRP 30 HD1 TRP 30 -5.130 -0.503 1.844
212 HE1 TRP 30 HE1 TRP 30 -5.758 -2.340 3.533
213 HE3 TRP 30 HE3 TRP 30 -5.124 2.229 6.158
214 HZ2 TRP 30 HZ2 TRP 30 -6.204 -2.618 6.342
215 HZ3 TRP 30 HZ3 TRP 30 -5.657 1.152 8.325
216 HH2 TRP 30 HH2 TRP 30 -6.196 -1.266 8.423
217 H CYS 31 H CYS 31 -1.894 1.830 2.745
218 HA CYS 31 HA CYS 31 -0.744 -0.249 1.060
219 1HB CYS 31 2HB CYS 31 0.052 1.103 3.654
220 2HB CYS 31 1HB CYS 31 1.074 -0.085 2.846
221 H LYS 32 H LYS 32 -0.987 -2.417 1.332
222 HA LYS 32 HA LYS 32 -1.956 -3.442 3.984
223 1HB LYS 32 2HB LYS 32 -3.571 -3.444 2.037
224 2HB LYS 32 1HB LYS 32 -2.471 -4.540 1.201
225 1HG LYS 32 2HG LYS 32 -2.682 -5.864 3.535
226 2HG LYS 32 1HG LYS 32 -4.250 -5.055 3.533
227 1HD LYS 32 2HD LYS 32 -5.035 -6.307 1.804
228 2HD LYS 32 1HD LYS 32 -3.496 -6.251 0.943
229 1HE LYS 32 2HE LYS 32 -2.831 -7.818 3.097
230 2HE LYS 32 1HE LYS 32 -4.517 -8.296 2.817
231 1HZ LYS 32 1HZ LYS 32 -2.384 -8.143 0.747
232 2HZ LYS 32 2HZ LYS 32 -4.008 -8.552 0.458
233 3HZ LYS 32 3HZ LYS 32 -3.028 -9.570 1.400
234 H TYR 33 H TYR 33 -0.746 -5.123 4.855
235 HA TYR 33 HA TYR 33 1.846 -5.753 3.731
236 1HB TYR 33 2HB TYR 33 0.765 -5.756 6.196
237 2HB TYR 33 1HB TYR 33 0.576 -7.468 5.818
238 HD1 TYR 33 HD1 TYR 33 2.643 -8.742 4.951
239 HD2 TYR 33 HD2 TYR 33 2.859 -4.901 6.862
240 HE1 TYR 33 HE1 TYR 33 5.048 -9.113 5.421
241 HE2 TYR 33 HE2 TYR 33 5.265 -5.272 7.333
242 HH TYR 33 HH TYR 33 6.724 -7.913 7.489
243 H GLU 34 H GLU 34 2.403 -7.425 2.392
244 HA GLU 34 HA GLU 34 0.263 -9.229 1.414
245 1HB GLU 34 2HB GLU 34 2.162 -7.825 0.151
246 2HB GLU 34 1HB GLU 34 3.095 -9.293 0.447
247 1HG GLU 34 2HG GLU 34 0.824 -10.421 -0.453
248 2HG GLU 34 1HG GLU 34 0.718 -8.877 -1.301
249 H ILE 35 H ILE 35 -0.014 -11.053 2.656
250 HA ILE 35 HA ILE 35 2.436 -12.461 3.676
251 HB ILE 35 HB ILE 35 -0.413 -12.294 4.720
252 1HG1 ILE 35 1HG1 ILE 35 1.584 -11.546 6.620
253 2HG1 ILE 35 2HG1 ILE 35 1.937 -10.693 5.119
254 1HG2 ILE 35 1HG2 ILE 35 1.894 -14.071 5.415
255 2HG2 ILE 35 2HG2 ILE 35 0.874 -13.478 6.728
256 3HG2 ILE 35 3HG2 ILE 35 0.166 -14.424 5.418
257 1HD1 ILE 35 1HD1 ILE 35 -0.458 -9.962 5.033
258 2HD1 ILE 35 2HD1 ILE 35 -0.700 -10.704 6.614
259 3HD1 ILE 35 3HD1 ILE 35 0.406 -9.341 6.439
260 1HN NH2 36 1HN NH2 36 1.535 -14.505 0.963
261 2HN NH2 36 2HN NH2 36 2.356 -13.008 1.456
Start of MODEL 15
1 1H GLU 1 1H GLU 1 6.984 9.781 1.697
2 2H GLU 1 2H GLU 1 5.810 9.267 0.582
3 3H GLU 1 3H GLU 1 6.584 10.765 0.374
4 HA GLU 1 HA GLU 1 7.526 9.181 -1.171
5 1HB GLU 1 2HB GLU 1 9.073 10.192 1.209
6 2HB GLU 1 1HB GLU 1 9.910 9.290 -0.055
7 1HG GLU 1 2HG GLU 1 8.740 10.922 -1.701
8 2HG GLU 1 1HG GLU 1 8.455 11.921 -0.276
9 H CYS 2 H CYS 2 6.893 7.016 -1.274
10 HA CYS 2 HA CYS 2 6.960 4.695 -0.876
11 1HB CYS 2 2HB CYS 2 9.530 5.832 -0.429
12 2HB CYS 2 1HB CYS 2 9.283 4.626 0.832
13 H LEU 3 H LEU 3 5.027 4.882 0.503
14 HA LEU 3 HA LEU 3 5.227 5.281 3.373
15 1HB LEU 3 2HB LEU 3 3.088 4.024 1.616
16 2HB LEU 3 1HB LEU 3 2.857 4.512 3.293
17 HG LEU 3 HG LEU 3 3.589 6.352 0.992
18 1HD1 LEU 3 1HD1 LEU 3 1.371 7.197 1.151
19 2HD1 LEU 3 2HD1 LEU 3 1.080 6.364 2.678
20 3HD1 LEU 3 3HD1 LEU 3 1.195 5.442 1.179
21 1HD2 LEU 3 1HD2 LEU 3 3.282 6.788 3.968
22 2HD2 LEU 3 2HD2 LEU 3 3.069 8.107 2.817
23 3HD2 LEU 3 3HD2 LEU 3 4.618 7.272 2.924
24 H GLY 4 H GLY 4 5.209 3.682 5.018
25 1HA GLY 4 2HA GLY 4 6.432 1.132 4.319
26 2HA GLY 4 1HA GLY 4 5.992 1.657 5.943
27 H PHE 5 H PHE 5 5.211 -0.621 6.150
28 HA PHE 5 HA PHE 5 2.855 -1.444 4.611
29 1HB PHE 5 2HB PHE 5 4.390 -3.130 5.339
30 2HB PHE 5 1HB PHE 5 4.399 -2.511 6.990
31 HD1 PHE 5 HD1 PHE 5 3.095 -3.615 8.572
32 HD2 PHE 5 HD2 PHE 5 1.944 -3.781 4.436
33 HE1 PHE 5 HE1 PHE 5 1.215 -5.123 9.155
34 HE2 PHE 5 HE2 PHE 5 0.064 -5.288 5.021
35 HZ PHE 5 HZ PHE 5 -0.301 -5.959 7.379
36 H GLY 6 H GLY 6 0.720 -1.317 5.276
37 1HA GLY 6 2HA GLY 6 -1.142 -0.800 6.604
38 2HA GLY 6 1HA GLY 6 -0.077 -0.770 8.007
39 H LYS 7 H LYS 7 0.510 1.227 5.160
40 HA LYS 7 HA LYS 7 0.138 3.650 6.860
41 1HB LYS 7 2HB LYS 7 2.183 2.826 5.267
42 2HB LYS 7 1HB LYS 7 1.269 3.800 4.115
43 1HG LYS 7 2HG LYS 7 2.621 5.429 5.071
44 2HG LYS 7 1HG LYS 7 1.203 5.531 6.115
45 1HD LYS 7 2HD LYS 7 2.251 4.145 7.792
46 2HD LYS 7 1HD LYS 7 3.607 3.789 6.722
47 1HE LYS 7 2HE LYS 7 3.030 6.672 7.292
48 2HE LYS 7 1HE LYS 7 3.794 5.710 8.573
49 1HZ LYS 7 1HZ LYS 7 5.458 6.639 7.070
50 2HZ LYS 7 2HZ LYS 7 4.718 5.871 5.748
51 3HZ LYS 7 3HZ LYS 7 5.442 4.946 6.977
52 H GLY 8 H GLY 8 -1.484 5.114 6.402
53 1HA GLY 8 2HA GLY 8 -3.674 4.441 4.719
54 2HA GLY 8 1HA GLY 8 -3.377 6.047 5.384
55 H CYS 9 H CYS 9 -3.616 4.333 2.531
56 HA CYS 9 HA CYS 9 -2.352 6.562 1.007
57 1HB CYS 9 2HB CYS 9 -1.001 5.049 -0.266
58 2HB CYS 9 1HB CYS 9 -0.776 4.581 1.419
59 H ASN 10 H ASN 10 -2.942 6.322 -1.400
60 HA ASN 10 HA ASN 10 -5.805 5.519 -1.610
61 1HB ASN 10 2HB ASN 10 -4.274 7.721 -2.414
62 2HB ASN 10 1HB ASN 10 -4.569 6.834 -3.909
63 1HD2 ASN 10 1HD2 ASN 10 -6.566 7.245 -4.886
64 2HD2 ASN 10 2HD2 ASN 10 -7.917 7.896 -4.091
65 HA PRO 11 HA PRO 11 -4.729 1.972 -4.017
66 1HB PRO 11 2HB PRO 11 -7.080 1.630 -5.381
67 2HB PRO 11 1HB PRO 11 -6.883 1.220 -3.665
68 1HG PRO 11 2HG PRO 11 -8.130 3.622 -4.906
69 2HG PRO 11 1HG PRO 11 -8.628 2.699 -3.479
70 1HD PRO 11 2HD PRO 11 -7.309 5.078 -3.340
71 2HD PRO 11 1HD PRO 11 -7.195 3.820 -2.089
72 H SER 12 H SER 12 -6.186 4.779 -5.676
73 HA SER 12 HA SER 12 -5.341 3.985 -8.345
74 1HB SER 12 2HB SER 12 -6.573 6.323 -6.971
75 2HB SER 12 1HB SER 12 -5.769 6.651 -8.504
76 HG SER 12 HG SER 12 -7.349 5.684 -9.485
77 H ASN 13 H ASN 13 -4.092 6.349 -5.951
78 HA ASN 13 HA ASN 13 -1.794 7.102 -7.567
79 1HB ASN 13 2HB ASN 13 -3.082 7.795 -5.066
80 2HB ASN 13 1HB ASN 13 -1.339 7.662 -4.831
81 1HD2 ASN 13 1HD2 ASN 13 -0.053 9.378 -5.605
82 2HD2 ASN 13 2HD2 ASN 13 -0.643 10.653 -6.558
83 H ASP 14 H ASP 14 -2.310 4.889 -4.830
84 HA ASP 14 HA ASP 14 -0.983 3.158 -3.952
85 1HB ASP 14 2HB ASP 14 -1.190 2.733 -6.536
86 2HB ASP 14 1HB ASP 14 0.517 3.179 -6.561
87 H GLN 15 H GLN 15 0.007 4.812 -2.502
88 HA GLN 15 HA GLN 15 2.713 5.768 -3.289
89 1HB GLN 15 2HB GLN 15 0.644 6.394 -1.215
90 2HB GLN 15 1HB GLN 15 2.322 6.804 -0.861
91 1HG GLN 15 2HG GLN 15 2.201 7.781 -3.354
92 2HG GLN 15 1HG GLN 15 0.494 7.929 -2.932
93 1HE2 GLN 15 1HE2 GLN 15 3.719 9.171 -2.247
94 2HE2 GLN 15 2HE2 GLN 15 3.221 10.403 -1.191
95 H CYS 16 H CYS 16 1.869 2.852 -2.396
96 HA CYS 16 HA CYS 16 3.287 2.416 0.112
97 1HB CYS 16 2HB CYS 16 2.294 0.607 -2.113
98 2HB CYS 16 1HB CYS 16 2.973 0.008 -0.601
99 H CYS 17 H CYS 17 5.373 1.465 0.360
100 HA CYS 17 HA CYS 17 7.302 2.108 -1.747
101 1HB CYS 17 2HB CYS 17 7.430 2.208 0.887
102 2HB CYS 17 1HB CYS 17 7.902 0.516 0.732
103 H LYS 18 H LYS 18 8.421 0.640 -3.041
104 HA LYS 18 HA LYS 18 7.231 -2.018 -3.417
105 1HB LYS 18 2HB LYS 18 8.679 -0.070 -4.901
106 2HB LYS 18 1HB LYS 18 9.643 -1.547 -4.919
107 1HG LYS 18 2HG LYS 18 6.838 -2.167 -5.304
108 2HG LYS 18 1HG LYS 18 7.379 -0.987 -6.497
109 1HD LYS 18 2HD LYS 18 9.005 -3.456 -5.894
110 2HD LYS 18 1HD LYS 18 7.692 -3.489 -7.071
111 1HE LYS 18 2HE LYS 18 9.713 -1.281 -7.291
112 2HE LYS 18 1HE LYS 18 10.168 -2.902 -7.850
113 1HZ LYS 18 1HZ LYS 18 7.694 -1.443 -8.629
114 2HZ LYS 18 2HZ LYS 18 8.143 -2.993 -9.162
115 3HZ LYS 18 3HZ LYS 18 9.064 -1.637 -9.609
116 H SER 19 H SER 19 9.808 -0.773 -1.500
117 HA SER 19 HA SER 19 11.740 -2.864 -1.609
118 1HB SER 19 2HB SER 19 11.823 -0.565 -0.491
119 2HB SER 19 1HB SER 19 10.907 -1.278 0.835
120 HG SER 19 HG SER 19 13.108 -1.437 1.267
121 H SER 20 H SER 20 8.790 -2.531 0.392
122 HA SER 20 HA SER 20 9.219 -5.293 1.451
123 1HB SER 20 2HB SER 20 8.824 -3.252 2.922
124 2HB SER 20 1HB SER 20 7.192 -3.192 2.264
125 HG SER 20 HG SER 20 6.672 -4.842 3.466
126 H ASN 21 H ASN 21 8.035 -4.381 -1.321
127 HA ASN 21 HA ASN 21 6.262 -5.024 -2.741
128 1HB ASN 21 2HB ASN 21 6.517 -7.292 -0.745
129 2HB ASN 21 1HB ASN 21 5.514 -7.404 -2.191
130 1HD2 ASN 21 1HD2 ASN 21 6.685 -7.079 -4.332
131 2HD2 ASN 21 2HD2 ASN 21 8.322 -7.515 -4.434
132 H LEU 22 H LEU 22 5.163 -3.096 -1.399
133 HA LEU 22 HA LEU 22 2.738 -4.147 0.020
134 1HB LEU 22 2HB LEU 22 4.167 -1.468 0.076
135 2HB LEU 22 1HB LEU 22 2.694 -1.826 0.975
136 HG LEU 22 HG LEU 22 5.258 -3.416 1.260
137 1HD1 LEU 22 1HD1 LEU 22 5.717 -1.184 2.043
138 2HD1 LEU 22 2HD1 LEU 22 5.423 -2.186 3.464
139 3HD1 LEU 22 3HD1 LEU 22 4.165 -1.100 2.876
140 1HD2 LEU 22 1HD2 LEU 22 2.588 -3.361 2.670
141 2HD2 LEU 22 2HD2 LEU 22 4.028 -3.988 3.472
142 3HD2 LEU 22 3HD2 LEU 22 3.443 -4.747 1.992
143 H VAL 23 H VAL 23 0.704 -3.534 -0.721
144 HA VAL 23 HA VAL 23 0.589 -1.767 -3.145
145 HB VAL 23 HB VAL 23 -1.231 -3.312 -3.930
146 1HG1 VAL 23 1HG1 VAL 23 1.225 -3.558 -4.555
147 2HG1 VAL 23 2HG1 VAL 23 0.251 -5.018 -4.725
148 3HG1 VAL 23 3HG1 VAL 23 1.321 -4.828 -3.336
149 1HG2 VAL 23 1HG2 VAL 23 -1.610 -5.421 -2.823
150 2HG2 VAL 23 2HG2 VAL 23 -1.762 -4.164 -1.596
151 3HG2 VAL 23 3HG2 VAL 23 -0.290 -5.130 -1.692
152 H CYS 24 H CYS 24 -1.160 -0.303 -3.177
153 HA CYS 24 HA CYS 24 -2.397 0.320 -0.616
154 1HB CYS 24 2HB CYS 24 -2.437 1.378 -3.427
155 2HB CYS 24 1HB CYS 24 -3.634 1.964 -2.273
156 H SER 25 H SER 25 -4.059 -0.932 0.132
157 HA SER 25 HA SER 25 -5.825 -2.458 -1.624
158 1HB SER 25 2HB SER 25 -5.660 -1.871 1.339
159 2HB SER 25 1HB SER 25 -6.949 -2.860 0.661
160 HG SER 25 HG SER 25 -5.352 -4.267 1.162
161 H ARG 26 H ARG 26 -8.173 -2.143 -1.717
162 HA ARG 26 HA ARG 26 -8.935 0.730 -1.728
163 1HB ARG 26 2HB ARG 26 -9.304 -1.262 -3.505
164 2HB ARG 26 1HB ARG 26 -10.783 -1.460 -2.564
165 1HG ARG 26 2HG ARG 26 -10.558 1.306 -2.935
166 2HG ARG 26 1HG ARG 26 -10.092 0.613 -4.489
167 1HD ARG 26 2HD ARG 26 -12.580 -0.307 -3.023
168 2HD ARG 26 1HD ARG 26 -12.605 1.046 -4.170
169 HE ARG 26 HE ARG 26 -11.219 -1.160 -5.363
170 1HH1 ARG 26 1HH2 ARG 26 -13.698 -2.422 -4.062
171 2HH1 ARG 26 2HH2 ARG 26 -14.823 -2.358 -5.378
172 1HH2 ARG 26 2HH1 ARG 26 -12.949 -0.083 -7.219
173 2HH2 ARG 26 1HH1 ARG 26 -14.397 -1.032 -7.169
174 H LYS 27 H LYS 27 -10.035 -2.376 -0.332
175 HA LYS 27 HA LYS 27 -12.213 -1.222 1.199
176 1HB LYS 27 2HB LYS 27 -12.294 -3.462 2.188
177 2HB LYS 27 1HB LYS 27 -12.013 -3.602 0.454
178 1HG LYS 27 2HG LYS 27 -9.445 -3.467 1.365
179 2HG LYS 27 1HG LYS 27 -10.229 -4.282 2.718
180 1HD LYS 27 2HD LYS 27 -9.918 -6.165 1.486
181 2HD LYS 27 1HD LYS 27 -11.325 -5.605 0.582
182 1HE LYS 27 2HE LYS 27 -8.782 -4.372 -0.286
183 2HE LYS 27 1HE LYS 27 -8.880 -6.121 -0.561
184 1HZ LYS 27 1HZ LYS 27 -11.059 -5.806 -1.569
185 2HZ LYS 27 2HZ LYS 27 -9.884 -4.902 -2.397
186 3HZ LYS 27 3HZ LYS 27 -10.954 -4.130 -1.327
187 H HIS 28 H HIS 28 -8.767 -1.680 1.786
188 HA HIS 28 HA HIS 28 -9.093 -0.862 4.643
189 1HB HIS 28 2HB HIS 28 -6.802 -2.065 3.055
190 2HB HIS 28 1HB HIS 28 -6.716 -1.664 4.768
191 HD1 HIS 28 HD1 HIS 28 -9.467 -2.670 5.710
192 HD2 HIS 28 HD2 HIS 28 -6.988 -4.836 3.150
193 HE1 HIS 28 HE1 HIS 28 -10.160 -5.096 5.924
194 H ARG 29 H ARG 29 -8.038 0.317 1.540
195 HA ARG 29 HA ARG 29 -6.991 2.320 0.873
196 1HB ARG 29 2HB ARG 29 -8.400 2.989 3.468
197 2HB ARG 29 1HB ARG 29 -7.604 4.228 2.499
198 1HG ARG 29 2HG ARG 29 -9.577 2.330 1.242
199 2HG ARG 29 1HG ARG 29 -10.131 3.778 2.082
200 1HD ARG 29 2HD ARG 29 -9.360 5.180 0.438
201 2HD ARG 29 1HD ARG 29 -7.910 4.198 0.148
202 HE ARG 29 HE ARG 29 -9.190 2.786 -1.316
203 1HH1 ARG 29 2HH1 ARG 29 -10.339 5.598 -1.925
204 2HH1 ARG 29 1HH1 ARG 29 -12.031 5.235 -1.990
205 1HH2 ARG 29 1HH2 ARG 29 -11.696 2.136 -0.456
206 2HH2 ARG 29 2HH2 ARG 29 -12.801 3.270 -1.157
207 H TRP 30 H TRP 30 -5.220 0.493 2.127
208 HA TRP 30 HA TRP 30 -3.216 2.379 3.223
209 1HB TRP 30 2HB TRP 30 -2.990 1.231 5.290
210 2HB TRP 30 1HB TRP 30 -4.726 1.356 5.050
211 HD1 TRP 30 HD1 TRP 30 -4.534 -1.148 2.772
212 HE1 TRP 30 HE1 TRP 30 -4.501 -3.535 3.735
213 HE3 TRP 30 HE3 TRP 30 -3.149 -0.138 7.584
214 HZ2 TRP 30 HZ2 TRP 30 -3.965 -4.846 6.218
215 HZ3 TRP 30 HZ3 TRP 30 -2.887 -1.975 9.225
216 HH2 TRP 30 HH2 TRP 30 -3.293 -4.325 8.549
217 H CYS 31 H CYS 31 -1.115 0.872 3.749
218 HA CYS 31 HA CYS 31 -0.535 -0.500 1.200
219 1HB CYS 31 2HB CYS 31 1.040 0.305 3.655
220 2HB CYS 31 1HB CYS 31 1.761 -0.658 2.369
221 H LYS 32 H LYS 32 -0.790 -2.671 0.973
222 HA LYS 32 HA LYS 32 -0.718 -4.391 3.434
223 1HB LYS 32 2HB LYS 32 -2.937 -3.893 2.148
224 2HB LYS 32 1HB LYS 32 -2.289 -4.991 0.929
225 1HG LYS 32 2HG LYS 32 -1.850 -6.535 3.049
226 2HG LYS 32 1HG LYS 32 -3.158 -5.570 3.734
227 1HD LYS 32 2HD LYS 32 -4.346 -6.086 1.439
228 2HD LYS 32 1HD LYS 32 -3.216 -7.439 1.387
229 1HE LYS 32 2HE LYS 32 -4.209 -8.513 3.177
230 2HE LYS 32 1HE LYS 32 -4.706 -6.993 3.946
231 1HZ LYS 32 1HZ LYS 32 -6.325 -6.658 2.193
232 2HZ LYS 32 2HZ LYS 32 -6.600 -8.154 2.950
233 3HZ LYS 32 3HZ LYS 32 -5.846 -8.095 1.429
234 H TYR 33 H TYR 33 0.477 -6.318 3.251
235 HA TYR 33 HA TYR 33 2.513 -6.457 1.191
236 1HB TYR 33 2HB TYR 33 2.796 -7.208 3.536
237 2HB TYR 33 1HB TYR 33 1.589 -8.467 3.275
238 HD1 TYR 33 HD1 TYR 33 2.295 -10.584 2.592
239 HD2 TYR 33 HD2 TYR 33 4.790 -7.180 1.797
240 HE1 TYR 33 HE1 TYR 33 4.052 -12.084 1.691
241 HE2 TYR 33 HE2 TYR 33 6.548 -8.678 0.895
242 HH TYR 33 HH TYR 33 6.968 -11.569 1.457
243 H GLU 34 H GLU 34 2.252 -7.319 -0.818
244 HA GLU 34 HA GLU 34 -0.173 -8.782 -1.560
245 1HB GLU 34 2HB GLU 34 1.646 -7.134 -2.802
246 2HB GLU 34 1HB GLU 34 2.139 -8.717 -3.402
247 1HG GLU 34 2HG GLU 34 -0.777 -7.999 -3.400
248 2HG GLU 34 1HG GLU 34 0.265 -7.357 -4.668
249 H ILE 35 H ILE 35 -0.369 -10.994 -1.777
250 HA ILE 35 HA ILE 35 1.640 -12.752 -0.655
251 HB ILE 35 HB ILE 35 0.013 -14.505 -1.389
252 1HG1 ILE 35 1HG1 ILE 35 -1.748 -12.290 -2.423
253 2HG1 ILE 35 2HG1 ILE 35 -0.596 -13.076 -3.500
254 1HG2 ILE 35 1HG2 ILE 35 -0.256 -12.979 0.687
255 2HG2 ILE 35 2HG2 ILE 35 -1.526 -12.181 -0.241
256 3HG2 ILE 35 3HG2 ILE 35 -1.665 -13.895 0.150
257 1HD1 ILE 35 1HD1 ILE 35 -1.654 -15.288 -2.494
258 2HD1 ILE 35 2HD1 ILE 35 -3.016 -14.220 -2.155
259 3HD1 ILE 35 3HD1 ILE 35 -2.454 -14.432 -3.813
260 1HN NH2 36 1HN NH2 36 2.094 -11.076 -3.302
261 2HN NH2 36 2HN NH2 36 3.562 -12.089 -3.297
Start of MODEL 16
1 1H GLU 1 1H GLU 1 6.408 8.618 -3.034
2 2H GLU 1 2H GLU 1 5.853 9.984 -2.192
3 3H GLU 1 3H GLU 1 4.976 8.530 -2.130
4 HA GLU 1 HA GLU 1 7.726 8.897 -1.042
5 1HB GLU 1 2HB GLU 1 6.661 9.146 1.086
6 2HB GLU 1 1HB GLU 1 5.768 10.198 -0.010
7 1HG GLU 1 2HG GLU 1 4.152 8.253 -0.360
8 2HG GLU 1 1HG GLU 1 4.957 7.461 0.995
9 H CYS 2 H CYS 2 8.159 7.050 0.540
10 HA CYS 2 HA CYS 2 7.066 4.485 -0.565
11 1HB CYS 2 2HB CYS 2 9.703 5.524 0.085
12 2HB CYS 2 1HB CYS 2 9.394 4.021 0.953
13 H LEU 3 H LEU 3 5.360 3.984 0.813
14 HA LEU 3 HA LEU 3 5.672 4.356 3.745
15 1HB LEU 3 2HB LEU 3 3.400 3.553 1.904
16 2HB LEU 3 1HB LEU 3 3.236 3.621 3.658
17 HG LEU 3 HG LEU 3 4.111 5.953 1.923
18 1HD1 LEU 3 1HD1 LEU 3 1.493 5.812 3.383
19 2HD1 LEU 3 2HD1 LEU 3 1.644 5.025 1.812
20 3HD1 LEU 3 3HD1 LEU 3 1.929 6.759 1.961
21 1HD2 LEU 3 1HD2 LEU 3 4.888 6.660 3.944
22 2HD2 LEU 3 2HD2 LEU 3 3.958 5.452 4.831
23 3HD2 LEU 3 3HD2 LEU 3 3.188 6.951 4.311
24 H GLY 4 H GLY 4 5.411 2.570 5.219
25 1HA GLY 4 2HA GLY 4 6.518 0.047 4.235
26 2HA GLY 4 1HA GLY 4 6.111 0.415 5.911
27 H PHE 5 H PHE 5 5.198 -1.848 5.791
28 HA PHE 5 HA PHE 5 2.754 -2.264 4.222
29 1HB PHE 5 2HB PHE 5 4.225 -4.121 4.623
30 2HB PHE 5 1HB PHE 5 4.264 -3.799 6.354
31 HD1 PHE 5 HD1 PHE 5 1.621 -4.286 3.717
32 HD2 PHE 5 HD2 PHE 5 3.033 -5.274 7.654
33 HE1 PHE 5 HE1 PHE 5 -0.335 -5.772 4.046
34 HE2 PHE 5 HE2 PHE 5 1.074 -6.760 7.980
35 HZ PHE 5 HZ PHE 5 -0.609 -7.008 6.177
36 H GLY 6 H GLY 6 0.644 -2.172 5.001
37 1HA GLY 6 2HA GLY 6 -1.136 -1.753 6.468
38 2HA GLY 6 1HA GLY 6 -0.023 -2.004 7.811
39 H LYS 7 H LYS 7 0.155 0.396 5.179
40 HA LYS 7 HA LYS 7 0.098 2.551 7.269
41 1HB LYS 7 2HB LYS 7 2.254 2.061 6.014
42 2HB LYS 7 1HB LYS 7 1.428 2.574 4.542
43 1HG LYS 7 2HG LYS 7 2.251 4.627 5.118
44 2HG LYS 7 1HG LYS 7 0.835 4.667 6.167
45 1HD LYS 7 2HD LYS 7 2.344 3.501 7.918
46 2HD LYS 7 1HD LYS 7 3.688 4.007 6.894
47 1HE LYS 7 2HE LYS 7 2.939 6.364 7.068
48 2HE LYS 7 1HE LYS 7 1.604 5.852 8.120
49 1HZ LYS 7 1HZ LYS 7 3.532 6.522 9.430
50 2HZ LYS 7 2HZ LYS 7 4.495 5.372 8.634
51 3HZ LYS 7 3HZ LYS 7 3.215 4.868 9.632
52 H GLY 8 H GLY 8 -1.467 4.120 7.005
53 1HA GLY 8 2HA GLY 8 -3.619 3.824 5.180
54 2HA GLY 8 1HA GLY 8 -3.264 5.304 6.071
55 H CYS 9 H CYS 9 -3.582 4.103 3.009
56 HA CYS 9 HA CYS 9 -2.093 6.406 1.852
57 1HB CYS 9 2HB CYS 9 -0.858 4.973 0.355
58 2HB CYS 9 1HB CYS 9 -0.653 4.310 1.975
59 H ASN 10 H ASN 10 -2.519 6.258 -0.707
60 HA ASN 10 HA ASN 10 -5.471 5.974 -1.029
61 1HB ASN 10 2HB ASN 10 -4.117 8.110 -1.476
62 2HB ASN 10 1HB ASN 10 -3.450 7.271 -2.876
63 1HD2 ASN 10 1HD2 ASN 10 -4.514 8.490 -4.527
64 2HD2 ASN 10 2HD2 ASN 10 -6.200 8.517 -4.715
65 HA PRO 11 HA PRO 11 -4.611 2.284 -3.396
66 1HB PRO 11 2HB PRO 11 -7.168 1.863 -4.282
67 2HB PRO 11 1HB PRO 11 -6.627 1.461 -2.641
68 1HG PRO 11 2HG PRO 11 -8.164 3.823 -3.601
69 2HG PRO 11 1HG PRO 11 -8.356 2.879 -2.115
70 1HD PRO 11 2HD PRO 11 -7.112 5.295 -2.191
71 2HD PRO 11 1HD PRO 11 -6.706 4.028 -1.012
72 H SER 12 H SER 12 -5.965 5.260 -4.651
73 HA SER 12 HA SER 12 -5.890 4.396 -7.465
74 1HB SER 12 2HB SER 12 -7.380 6.167 -6.155
75 2HB SER 12 1HB SER 12 -6.050 7.250 -6.554
76 HG SER 12 HG SER 12 -7.933 6.032 -8.182
77 H ASN 13 H ASN 13 -3.942 6.480 -5.308
78 HA ASN 13 HA ASN 13 -1.969 6.983 -7.467
79 1HB ASN 13 2HB ASN 13 -2.922 8.656 -5.733
80 2HB ASN 13 1HB ASN 13 -1.840 7.870 -4.583
81 1HD2 ASN 13 1HD2 ASN 13 -1.953 9.950 -7.438
82 2HD2 ASN 13 2HD2 ASN 13 -0.304 10.350 -7.432
83 H ASP 14 H ASP 14 -2.308 5.120 -4.492
84 HA ASP 14 HA ASP 14 -0.973 3.434 -3.550
85 1HB ASP 14 2HB ASP 14 -1.010 2.953 -6.142
86 2HB ASP 14 1HB ASP 14 0.683 3.442 -6.057
87 H GLN 15 H GLN 15 0.012 4.756 -1.949
88 HA GLN 15 HA GLN 15 2.584 6.103 -2.639
89 1HB GLN 15 2HB GLN 15 0.667 6.183 -0.293
90 2HB GLN 15 1HB GLN 15 2.219 7.019 -0.280
91 1HG GLN 15 2HG GLN 15 1.579 8.528 -1.934
92 2HG GLN 15 1HG GLN 15 0.360 7.442 -2.601
93 1HE2 GLN 15 1HE2 GLN 15 1.041 9.390 0.360
94 2HE2 GLN 15 2HE2 GLN 15 -0.592 9.693 0.711
95 H CYS 16 H CYS 16 1.983 3.039 -2.069
96 HA CYS 16 HA CYS 16 3.614 2.512 0.327
97 1HB CYS 16 2HB CYS 16 2.425 0.732 -1.828
98 2HB CYS 16 1HB CYS 16 3.134 0.159 -0.320
99 H CYS 17 H CYS 17 5.626 1.274 0.211
100 HA CYS 17 HA CYS 17 7.340 2.101 -2.029
101 1HB CYS 17 2HB CYS 17 7.753 1.878 0.588
102 2HB CYS 17 1HB CYS 17 8.170 0.220 0.156
103 H LYS 18 H LYS 18 7.954 0.800 -3.721
104 HA LYS 18 HA LYS 18 6.675 -1.802 -4.104
105 1HB LYS 18 2HB LYS 18 8.524 0.031 -5.604
106 2HB LYS 18 1HB LYS 18 8.316 -1.625 -6.175
107 1HG LYS 18 2HG LYS 18 5.995 -1.331 -6.539
108 2HG LYS 18 1HG LYS 18 5.940 0.130 -5.553
109 1HD LYS 18 2HD LYS 18 7.859 0.467 -7.684
110 2HD LYS 18 1HD LYS 18 6.304 -0.026 -8.353
111 1HE LYS 18 2HE LYS 18 6.002 2.290 -8.228
112 2HE LYS 18 1HE LYS 18 5.379 1.804 -6.641
113 1HZ LYS 18 1HZ LYS 18 8.200 2.562 -7.209
114 2HZ LYS 18 2HZ LYS 18 7.561 2.142 -5.691
115 3HZ LYS 18 3HZ LYS 18 7.057 3.568 -6.462
116 H SER 19 H SER 19 9.698 -0.734 -2.750
117 HA SER 19 HA SER 19 11.420 -2.921 -3.340
118 1HB SER 19 2HB SER 19 11.912 -0.677 -2.240
119 2HB SER 19 1HB SER 19 11.259 -1.353 -0.750
120 HG SER 19 HG SER 19 13.696 -1.612 -1.726
121 H SER 20 H SER 20 8.982 -2.531 -0.751
122 HA SER 20 HA SER 20 9.549 -5.301 0.206
123 1HB SER 20 2HB SER 20 9.356 -3.141 1.651
124 2HB SER 20 1HB SER 20 7.621 -3.305 1.394
125 HG SER 20 HG SER 20 9.320 -4.748 2.981
126 H ASN 21 H ASN 21 7.994 -4.501 -2.345
127 HA ASN 21 HA ASN 21 6.035 -5.163 -3.476
128 1HB ASN 21 2HB ASN 21 6.357 -7.304 -1.349
129 2HB ASN 21 1HB ASN 21 5.281 -7.453 -2.738
130 1HD2 ASN 21 1HD2 ASN 21 6.369 -7.303 -4.947
131 2HD2 ASN 21 2HD2 ASN 21 7.972 -7.840 -5.093
132 H LEU 22 H LEU 22 5.217 -3.084 -2.135
133 HA LEU 22 HA LEU 22 2.860 -3.943 -0.481
134 1HB LEU 22 2HB LEU 22 4.577 -1.441 -0.430
135 2HB LEU 22 1HB LEU 22 3.124 -1.660 0.545
136 HG LEU 22 HG LEU 22 5.475 -3.567 0.619
137 1HD1 LEU 22 1HD1 LEU 22 5.874 -2.415 2.878
138 2HD1 LEU 22 2HD1 LEU 22 4.834 -1.123 2.277
139 3HD1 LEU 22 3HD1 LEU 22 6.339 -1.505 1.440
140 1HD2 LEU 22 1HD2 LEU 22 3.305 -4.484 1.366
141 2HD2 LEU 22 2HD2 LEU 22 3.108 -3.124 2.471
142 3HD2 LEU 22 3HD2 LEU 22 4.404 -4.289 2.732
143 H VAL 23 H VAL 23 0.886 -3.410 -1.300
144 HA VAL 23 HA VAL 23 0.727 -1.271 -3.401
145 HB VAL 23 HB VAL 23 -1.057 -2.786 -4.421
146 1HG1 VAL 23 1HG1 VAL 23 0.710 -3.122 -5.782
147 2HG1 VAL 23 2HG1 VAL 23 1.035 -4.584 -4.852
148 3HG1 VAL 23 3HG1 VAL 23 1.846 -3.075 -4.435
149 1HG2 VAL 23 1HG2 VAL 23 -1.347 -4.151 -2.304
150 2HG2 VAL 23 2HG2 VAL 23 0.220 -4.887 -2.642
151 3HG2 VAL 23 3HG2 VAL 23 -1.121 -5.110 -3.765
152 H CYS 24 H CYS 24 -0.968 0.175 -3.105
153 HA CYS 24 HA CYS 24 -2.354 0.235 -0.573
154 1HB CYS 24 2HB CYS 24 -2.465 1.767 -3.166
155 2HB CYS 24 1HB CYS 24 -3.604 2.118 -1.867
156 H SER 25 H SER 25 -4.055 -1.070 -0.067
157 HA SER 25 HA SER 25 -5.674 -2.383 -2.141
158 1HB SER 25 2HB SER 25 -4.869 -3.386 0.048
159 2HB SER 25 1HB SER 25 -6.001 -2.323 0.878
160 HG SER 25 HG SER 25 -6.444 -4.641 -0.479
161 H ARG 26 H ARG 26 -8.066 -2.189 -2.158
162 HA ARG 26 HA ARG 26 -8.941 0.620 -1.762
163 1HB ARG 26 2HB ARG 26 -9.277 -0.774 -3.868
164 2HB ARG 26 1HB ARG 26 -10.431 -1.740 -2.948
165 1HG ARG 26 2HG ARG 26 -11.977 -0.016 -2.805
166 2HG ARG 26 1HG ARG 26 -10.746 1.239 -2.940
167 1HD ARG 26 2HD ARG 26 -11.674 1.369 -5.072
168 2HD ARG 26 1HD ARG 26 -10.437 0.132 -5.372
169 HE ARG 26 HE ARG 26 -12.167 -1.584 -5.135
170 1HH1 ARG 26 2HH1 ARG 26 -13.315 0.372 -7.158
171 2HH1 ARG 26 1HH1 ARG 26 -14.932 0.566 -6.568
172 1HH2 ARG 26 1HH2 ARG 26 -14.233 -0.775 -3.438
173 2HH2 ARG 26 2HH2 ARG 26 -15.453 -0.086 -4.456
174 H LYS 27 H LYS 27 -9.631 -2.639 -0.524
175 HA LYS 27 HA LYS 27 -12.025 -1.996 0.943
176 1HB LYS 27 2HB LYS 27 -11.021 -4.259 0.241
177 2HB LYS 27 1HB LYS 27 -9.957 -4.095 1.637
178 1HG LYS 27 2HG LYS 27 -12.694 -3.519 2.391
179 2HG LYS 27 1HG LYS 27 -12.594 -5.100 1.618
180 1HD LYS 27 2HD LYS 27 -10.372 -5.094 3.265
181 2HD LYS 27 1HD LYS 27 -11.570 -4.232 4.229
182 1HE LYS 27 2HE LYS 27 -13.163 -6.080 3.973
183 2HE LYS 27 1HE LYS 27 -12.022 -6.941 2.923
184 1HZ LYS 27 1HZ LYS 27 -11.807 -7.693 5.212
185 2HZ LYS 27 2HZ LYS 27 -11.511 -6.104 5.732
186 3HZ LYS 27 3HZ LYS 27 -10.395 -6.892 4.721
187 H HIS 28 H HIS 28 -8.579 -2.138 1.924
188 HA HIS 28 HA HIS 28 -9.311 -0.894 4.541
189 1HB HIS 28 2HB HIS 28 -6.995 -2.501 3.466
190 2HB HIS 28 1HB HIS 28 -6.834 -1.588 4.966
191 HD1 HIS 28 HD1 HIS 28 -9.430 -2.025 6.380
192 HD2 HIS 28 HD2 HIS 28 -7.570 -5.088 4.246
193 HE1 HIS 28 HE1 HIS 28 -10.339 -4.200 7.308
194 H ARG 29 H ARG 29 -8.035 -0.040 1.475
195 HA ARG 29 HA ARG 29 -6.921 1.883 0.684
196 1HB ARG 29 2HB ARG 29 -8.508 2.677 3.102
197 2HB ARG 29 1HB ARG 29 -7.458 3.880 2.355
198 1HG ARG 29 2HG ARG 29 -8.629 2.942 0.131
199 2HG ARG 29 1HG ARG 29 -9.918 2.581 1.280
200 1HD ARG 29 2HD ARG 29 -9.544 5.040 2.103
201 2HD ARG 29 1HD ARG 29 -8.769 5.261 0.521
202 HE ARG 29 HE ARG 29 -11.594 4.356 0.909
203 1HH1 ARG 29 2HH1 ARG 29 -10.466 3.410 -1.663
204 2HH1 ARG 29 1HH1 ARG 29 -10.816 4.720 -2.741
205 1HH2 ARG 29 1HH2 ARG 29 -11.432 7.001 -0.192
206 2HH2 ARG 29 2HH2 ARG 29 -11.366 6.758 -1.906
207 H TRP 30 H TRP 30 -5.164 0.142 1.950
208 HA TRP 30 HA TRP 30 -3.173 2.038 3.054
209 1HB TRP 30 2HB TRP 30 -2.910 0.857 5.109
210 2HB TRP 30 1HB TRP 30 -4.645 1.045 4.900
211 HD1 TRP 30 HD1 TRP 30 -4.506 -1.465 2.590
212 HE1 TRP 30 HE1 TRP 30 -4.572 -3.849 3.555
213 HE3 TRP 30 HE3 TRP 30 -3.181 -0.494 7.422
214 HZ2 TRP 30 HZ2 TRP 30 -4.131 -5.174 6.048
215 HZ3 TRP 30 HZ3 TRP 30 -3.015 -2.335 9.071
216 HH2 TRP 30 HH2 TRP 30 -3.487 -4.672 8.392
217 H CYS 31 H CYS 31 -1.037 0.641 3.516
218 HA CYS 31 HA CYS 31 -0.311 -0.595 0.998
219 1HB CYS 31 2HB CYS 31 1.017 -0.321 3.706
220 2HB CYS 31 1HB CYS 31 1.824 -1.058 2.324
221 H LYS 32 H LYS 32 -0.685 -2.674 0.425
222 HA LYS 32 HA LYS 32 -1.110 -4.720 2.580
223 1HB LYS 32 2HB LYS 32 -3.046 -4.066 1.090
224 2HB LYS 32 1HB LYS 32 -2.121 -4.675 -0.283
225 1HG LYS 32 2HG LYS 32 -3.379 -6.555 0.267
226 2HG LYS 32 1HG LYS 32 -1.915 -6.847 1.206
227 1HD LYS 32 2HD LYS 32 -3.024 -5.728 3.165
228 2HD LYS 32 1HD LYS 32 -4.508 -5.646 2.216
229 1HE LYS 32 2HE LYS 32 -3.145 -8.308 2.452
230 2HE LYS 32 1HE LYS 32 -4.077 -7.709 3.838
231 1HZ LYS 32 1HZ LYS 32 -5.486 -8.928 2.269
232 2HZ LYS 32 2HZ LYS 32 -5.064 -7.841 1.034
233 3HZ LYS 32 3HZ LYS 32 -5.950 -7.301 2.380
234 H TYR 33 H TYR 33 0.035 -6.687 2.364
235 HA TYR 33 HA TYR 33 2.475 -6.614 0.774
236 1HB TYR 33 2HB TYR 33 1.335 -8.045 2.995
237 2HB TYR 33 1HB TYR 33 1.941 -9.212 1.819
238 HD1 TYR 33 HD1 TYR 33 2.843 -7.191 4.552
239 HD2 TYR 33 HD2 TYR 33 4.305 -8.554 0.749
240 HE1 TYR 33 HE1 TYR 33 5.166 -6.705 5.270
241 HE2 TYR 33 HE2 TYR 33 6.628 -8.069 1.466
242 HH TYR 33 HH TYR 33 7.564 -6.200 3.511
243 H GLU 34 H GLU 34 2.795 -7.495 -1.231
244 HA GLU 34 HA GLU 34 0.514 -8.628 -2.689
245 1HB GLU 34 2HB GLU 34 2.670 -7.089 -3.325
246 2HB GLU 34 1HB GLU 34 3.251 -8.675 -3.835
247 1HG GLU 34 2HG GLU 34 0.472 -8.171 -4.629
248 2HG GLU 34 1HG GLU 34 1.606 -7.014 -5.327
249 H ILE 35 H ILE 35 0.520 -10.744 -3.667
250 HA ILE 35 HA ILE 35 1.745 -12.823 -1.997
251 HB ILE 35 HB ILE 35 0.001 -12.867 -4.485
252 1HG1 ILE 35 1HG1 ILE 35 -1.316 -13.833 -2.151
253 2HG1 ILE 35 2HG1 ILE 35 -0.533 -12.315 -1.710
254 1HG2 ILE 35 1HG2 ILE 35 0.959 -15.062 -2.641
255 2HG2 ILE 35 2HG2 ILE 35 -0.482 -15.238 -3.641
256 3HG2 ILE 35 3HG2 ILE 35 1.090 -14.983 -4.397
257 1HD1 ILE 35 1HD1 ILE 35 -1.558 -11.248 -3.724
258 2HD1 ILE 35 2HD1 ILE 35 -2.416 -12.755 -4.047
259 3HD1 ILE 35 3HD1 ILE 35 -2.763 -11.840 -2.580
260 1HN NH2 36 1HN NH2 36 4.673 -12.332 -3.931
261 2HN NH2 36 2HN NH2 36 3.676 -11.645 -2.631
Start of MODEL 17
1 1H GLU 1 1H GLU 1 9.307 8.779 -3.963
2 2H GLU 1 2H GLU 1 10.597 7.704 -3.710
3 3H GLU 1 3H GLU 1 10.788 9.357 -3.367
4 HA GLU 1 HA GLU 1 10.467 7.953 -1.348
5 1HB GLU 1 2HB GLU 1 9.017 9.628 -0.372
6 2HB GLU 1 1HB GLU 1 9.972 10.420 -1.622
7 1HG GLU 1 2HG GLU 1 7.988 11.170 -2.423
8 2HG GLU 1 1HG GLU 1 7.765 9.532 -3.033
9 H CYS 2 H CYS 2 8.704 6.976 0.010
10 HA CYS 2 HA CYS 2 6.314 6.003 -1.449
11 1HB CYS 2 2HB CYS 2 6.935 3.652 -1.053
12 2HB CYS 2 1HB CYS 2 8.166 4.457 -2.020
13 H LEU 3 H LEU 3 4.924 4.639 0.080
14 HA LEU 3 HA LEU 3 4.995 5.851 2.808
15 1HB LEU 3 2HB LEU 3 2.870 4.423 1.176
16 2HB LEU 3 1HB LEU 3 2.610 5.035 2.810
17 HG LEU 3 HG LEU 3 3.527 6.763 0.493
18 1HD1 LEU 3 1HD1 LEU 3 0.760 6.422 1.690
19 2HD1 LEU 3 2HD1 LEU 3 1.260 5.885 0.086
20 3HD1 LEU 3 3HD1 LEU 3 1.205 7.607 0.462
21 1HD2 LEU 3 1HD2 LEU 3 2.596 7.317 3.325
22 2HD2 LEU 3 2HD2 LEU 3 2.695 8.570 2.088
23 3HD2 LEU 3 3HD2 LEU 3 4.154 7.725 2.606
24 H GLY 4 H GLY 4 4.823 4.500 4.680
25 1HA GLY 4 2HA GLY 4 6.081 1.884 4.431
26 2HA GLY 4 1HA GLY 4 5.527 2.627 5.931
27 H PHE 5 H PHE 5 4.821 0.272 6.243
28 HA PHE 5 HA PHE 5 2.515 -0.693 4.735
29 1HB PHE 5 2HB PHE 5 3.971 -2.320 5.658
30 2HB PHE 5 1HB PHE 5 4.032 -1.505 7.219
31 HD1 PHE 5 HD1 PHE 5 1.670 -3.273 4.904
32 HD2 PHE 5 HD2 PHE 5 2.575 -2.141 8.951
33 HE1 PHE 5 HE1 PHE 5 -0.216 -4.663 5.717
34 HE2 PHE 5 HE2 PHE 5 0.689 -3.533 9.760
35 HZ PHE 5 HZ PHE 5 -0.705 -4.793 8.142
36 H GLY 6 H GLY 6 0.347 -0.647 5.375
37 1HA GLY 6 2HA GLY 6 -1.576 0.084 6.485
38 2HA GLY 6 1HA GLY 6 -0.609 0.114 7.958
39 H LYS 7 H LYS 7 -0.312 1.980 4.932
40 HA LYS 7 HA LYS 7 -0.442 4.492 6.564
41 1HB LYS 7 2HB LYS 7 1.272 3.461 4.375
42 2HB LYS 7 1HB LYS 7 0.795 5.151 4.215
43 1HG LYS 7 2HG LYS 7 1.504 4.737 6.938
44 2HG LYS 7 1HG LYS 7 2.777 4.018 5.953
45 1HD LYS 7 2HD LYS 7 3.266 6.048 4.876
46 2HD LYS 7 1HD LYS 7 1.708 6.757 5.302
47 1HE LYS 7 2HE LYS 7 2.355 7.022 7.604
48 2HE LYS 7 1HE LYS 7 3.808 6.029 7.371
49 1HZ LYS 7 1HZ LYS 7 4.327 8.402 7.247
50 2HZ LYS 7 2HZ LYS 7 3.227 8.587 5.965
51 3HZ LYS 7 3HZ LYS 7 4.620 7.633 5.764
52 H GLY 8 H GLY 8 -1.894 6.080 5.882
53 1HA GLY 8 2HA GLY 8 -4.087 5.340 4.188
54 2HA GLY 8 1HA GLY 8 -3.762 6.971 4.778
55 H CYS 9 H CYS 9 -3.572 4.866 2.065
56 HA CYS 9 HA CYS 9 -2.348 7.076 0.456
57 1HB CYS 9 2HB CYS 9 -0.958 5.426 -0.669
58 2HB CYS 9 1HB CYS 9 -0.718 5.263 1.069
59 H ASN 10 H ASN 10 -2.706 6.536 -1.992
60 HA ASN 10 HA ASN 10 -5.575 5.870 -2.337
61 1HB ASN 10 2HB ASN 10 -4.256 7.917 -3.251
62 2HB ASN 10 1HB ASN 10 -3.625 6.789 -4.451
63 1HD2 ASN 10 1HD2 ASN 10 -6.543 8.471 -3.365
64 2HD2 ASN 10 2HD2 ASN 10 -7.501 8.042 -4.700
65 HA PRO 11 HA PRO 11 -4.579 1.830 -3.884
66 1HB PRO 11 2HB PRO 11 -6.980 1.288 -5.088
67 2HB PRO 11 1HB PRO 11 -6.736 1.218 -3.333
68 1HG PRO 11 2HG PRO 11 -7.972 3.362 -4.985
69 2HG PRO 11 1HG PRO 11 -8.447 2.748 -3.394
70 1HD PRO 11 2HD PRO 11 -7.078 5.074 -3.749
71 2HD PRO 11 1HD PRO 11 -6.941 4.073 -2.285
72 H SER 12 H SER 12 -6.156 4.207 -6.043
73 HA SER 12 HA SER 12 -5.385 2.935 -8.521
74 1HB SER 12 2HB SER 12 -6.172 5.764 -7.761
75 2HB SER 12 1HB SER 12 -5.997 5.214 -9.425
76 HG SER 12 HG SER 12 -7.992 4.591 -9.182
77 H ASN 13 H ASN 13 -3.928 5.540 -6.549
78 HA ASN 13 HA ASN 13 -1.724 5.992 -8.409
79 1HB ASN 13 2HB ASN 13 -2.891 7.463 -6.508
80 2HB ASN 13 1HB ASN 13 -1.628 6.742 -5.511
81 1HD2 ASN 13 1HD2 ASN 13 -0.374 8.709 -5.304
82 2HD2 ASN 13 2HD2 ASN 13 0.425 9.412 -6.626
83 H ASP 14 H ASP 14 -2.085 4.349 -5.269
84 HA ASP 14 HA ASP 14 -0.733 2.762 -4.175
85 1HB ASP 14 2HB ASP 14 -1.371 1.909 -6.655
86 2HB ASP 14 1HB ASP 14 0.386 1.914 -6.806
87 H GLN 15 H GLN 15 0.647 4.572 -3.349
88 HA GLN 15 HA GLN 15 3.345 4.667 -4.662
89 1HB GLN 15 2HB GLN 15 1.596 6.616 -3.202
90 2HB GLN 15 1HB GLN 15 3.345 6.829 -3.099
91 1HG GLN 15 2HG GLN 15 3.186 6.457 -5.735
92 2HG GLN 15 1HG GLN 15 1.545 7.047 -5.478
93 1HE2 GLN 15 1HE2 GLN 15 4.987 7.932 -5.058
94 2HE2 GLN 15 2HE2 GLN 15 4.706 9.602 -4.945
95 H CYS 16 H CYS 16 2.831 2.460 -3.019
96 HA CYS 16 HA CYS 16 3.822 3.062 -0.293
97 1HB CYS 16 2HB CYS 16 1.999 1.348 -1.181
98 2HB CYS 16 1HB CYS 16 3.407 0.310 -1.401
99 H CYS 17 H CYS 17 5.608 1.444 0.510
100 HA CYS 17 HA CYS 17 7.960 1.779 -1.216
101 1HB CYS 17 2HB CYS 17 7.561 0.455 1.491
102 2HB CYS 17 1HB CYS 17 9.120 0.857 0.774
103 H LYS 18 H LYS 18 9.057 0.133 -2.292
104 HA LYS 18 HA LYS 18 7.619 -2.423 -2.686
105 1HB LYS 18 2HB LYS 18 9.204 -0.677 -4.215
106 2HB LYS 18 1HB LYS 18 10.190 -2.126 -4.019
107 1HG LYS 18 2HG LYS 18 7.517 -2.974 -4.551
108 2HG LYS 18 1HG LYS 18 7.930 -1.738 -5.739
109 1HD LYS 18 2HD LYS 18 8.764 -3.648 -6.778
110 2HD LYS 18 1HD LYS 18 10.194 -3.084 -5.913
111 1HE LYS 18 2HE LYS 18 10.242 -4.963 -4.643
112 2HE LYS 18 1HE LYS 18 8.531 -4.779 -4.212
113 1HZ LYS 18 1HZ LYS 18 7.914 -5.664 -6.369
114 2HZ LYS 18 2HZ LYS 18 8.899 -6.778 -5.547
115 3HZ LYS 18 3HZ LYS 18 9.546 -5.833 -6.802
116 H SER 19 H SER 19 10.278 -1.230 -0.800
117 HA SER 19 HA SER 19 11.978 -3.503 -0.624
118 1HB SER 19 2HB SER 19 11.840 -0.974 0.429
119 2HB SER 19 1HB SER 19 11.491 -1.954 1.850
120 HG SER 19 HG SER 19 13.496 -2.574 1.865
121 H SER 20 H SER 20 9.030 -2.684 1.234
122 HA SER 20 HA SER 20 9.172 -5.329 2.614
123 1HB SER 20 2HB SER 20 7.735 -2.714 3.049
124 2HB SER 20 1HB SER 20 7.233 -4.169 3.903
125 HG SER 20 HG SER 20 8.787 -2.991 5.085
126 H ASN 21 H ASN 21 8.193 -4.680 -0.301
127 HA ASN 21 HA ASN 21 6.424 -5.330 -1.721
128 1HB ASN 21 2HB ASN 21 7.007 -7.373 0.308
129 2HB ASN 21 1HB ASN 21 5.405 -7.550 -0.405
130 1HD2 ASN 21 1HD2 ASN 21 5.277 -8.328 -2.561
131 2HD2 ASN 21 2HD2 ASN 21 6.637 -8.663 -3.520
132 H LEU 22 H LEU 22 5.399 -3.213 -0.635
133 HA LEU 22 HA LEU 22 2.830 -3.988 0.709
134 1HB LEU 22 2HB LEU 22 4.409 -1.395 0.730
135 2HB LEU 22 1HB LEU 22 2.915 -1.685 1.621
136 HG LEU 22 HG LEU 22 5.432 -3.334 1.971
137 1HD1 LEU 22 1HD1 LEU 22 5.550 -2.085 4.181
138 2HD1 LEU 22 2HD1 LEU 22 4.355 -0.968 3.522
139 3HD1 LEU 22 3HD1 LEU 22 5.935 -1.121 2.755
140 1HD2 LEU 22 1HD2 LEU 22 3.615 -4.641 2.696
141 2HD2 LEU 22 2HD2 LEU 22 2.720 -3.240 3.282
142 3HD2 LEU 22 3HD2 LEU 22 4.120 -3.830 4.177
143 H VAL 23 H VAL 23 0.898 -3.203 -0.174
144 HA VAL 23 HA VAL 23 1.075 -1.470 -2.611
145 HB VAL 23 HB VAL 23 -0.646 -3.060 -3.623
146 1HG1 VAL 23 1HG1 VAL 23 2.003 -4.381 -2.997
147 2HG1 VAL 23 2HG1 VAL 23 1.849 -3.033 -4.124
148 3HG1 VAL 23 3HG1 VAL 23 1.025 -4.556 -4.454
149 1HG2 VAL 23 1HG2 VAL 23 -1.210 -4.122 -1.389
150 2HG2 VAL 23 2HG2 VAL 23 0.351 -4.939 -1.459
151 3HG2 VAL 23 3HG2 VAL 23 -0.874 -5.272 -2.683
152 H CYS 24 H CYS 24 -0.664 -0.039 -2.820
153 HA CYS 24 HA CYS 24 -2.317 0.460 -0.490
154 1HB CYS 24 2HB CYS 24 -2.174 1.533 -3.316
155 2HB CYS 24 1HB CYS 24 -3.346 2.139 -2.146
156 H SER 25 H SER 25 -4.043 -0.832 -0.004
157 HA SER 25 HA SER 25 -5.392 -2.476 -2.006
158 1HB SER 25 2HB SER 25 -6.578 -3.310 -0.094
159 2HB SER 25 1HB SER 25 -4.940 -2.977 0.460
160 HG SER 25 HG SER 25 -6.721 -2.153 1.793
161 H ARG 26 H ARG 26 -7.818 -2.349 -2.267
162 HA ARG 26 HA ARG 26 -8.644 0.479 -2.684
163 1HB ARG 26 2HB ARG 26 -9.820 -2.182 -3.557
164 2HB ARG 26 1HB ARG 26 -10.376 -0.598 -4.099
165 1HG ARG 26 2HG ARG 26 -7.548 -0.685 -4.469
166 2HG ARG 26 1HG ARG 26 -8.219 -2.173 -5.140
167 1HD ARG 26 2HD ARG 26 -9.955 -0.688 -6.319
168 2HD ARG 26 1HD ARG 26 -8.913 0.681 -5.881
169 HE ARG 26 HE ARG 26 -7.535 -1.597 -7.154
170 1HH1 ARG 26 2HH1 ARG 26 -9.494 -0.408 -9.118
171 2HH1 ARG 26 1HH1 ARG 26 -8.530 0.809 -9.885
172 1HH2 ARG 26 1HH2 ARG 26 -6.081 0.793 -7.421
173 2HH2 ARG 26 2HH2 ARG 26 -6.592 1.490 -8.921
174 H LYS 27 H LYS 27 -9.613 -2.428 -0.883
175 HA LYS 27 HA LYS 27 -12.154 -1.410 0.049
176 1HB LYS 27 2HB LYS 27 -10.895 -3.807 -0.014
177 2HB LYS 27 1HB LYS 27 -10.595 -3.364 1.666
178 1HG LYS 27 2HG LYS 27 -13.328 -2.749 1.001
179 2HG LYS 27 1HG LYS 27 -12.984 -4.420 0.557
180 1HD LYS 27 2HD LYS 27 -11.778 -3.839 3.110
181 2HD LYS 27 1HD LYS 27 -13.485 -3.401 3.151
182 1HE LYS 27 2HE LYS 27 -12.738 -6.025 1.902
183 2HE LYS 27 1HE LYS 27 -12.739 -5.900 3.672
184 1HZ LYS 27 1HZ LYS 27 -14.962 -4.972 3.584
185 2HZ LYS 27 2HZ LYS 27 -14.940 -6.489 2.819
186 3HZ LYS 27 3HZ LYS 27 -14.971 -5.067 1.890
187 H HIS 28 H HIS 28 -8.918 -1.602 1.602
188 HA HIS 28 HA HIS 28 -9.894 0.169 3.795
189 1HB HIS 28 2HB HIS 28 -7.357 -1.448 3.404
190 2HB HIS 28 1HB HIS 28 -7.760 -0.548 4.864
191 HD1 HIS 28 HD1 HIS 28 -10.525 -1.237 5.548
192 HD2 HIS 28 HD2 HIS 28 -8.008 -4.086 3.835
193 HE1 HIS 28 HE1 HIS 28 -11.511 -3.499 6.116
194 H ARG 29 H ARG 29 -8.280 0.462 0.813
195 HA ARG 29 HA ARG 29 -6.951 2.158 -0.147
196 1HB ARG 29 2HB ARG 29 -8.742 3.440 1.897
197 2HB ARG 29 1HB ARG 29 -7.574 4.439 1.033
198 1HG ARG 29 2HG ARG 29 -8.829 4.415 -0.838
199 2HG ARG 29 1HG ARG 29 -8.946 2.656 -0.799
200 1HD ARG 29 2HD ARG 29 -11.024 2.704 0.142
201 2HD ARG 29 1HD ARG 29 -10.587 4.018 1.252
202 HE ARG 29 HE ARG 29 -11.108 4.529 -1.654
203 1HH1 ARG 29 1HH2 ARG 29 -10.089 6.689 0.243
204 2HH1 ARG 29 2HH2 ARG 29 -11.561 7.511 0.639
205 1HH2 ARG 29 2HH1 ARG 29 -13.612 4.958 -0.522
206 2HH2 ARG 29 1HH1 ARG 29 -13.560 6.529 0.205
207 H TRP 30 H TRP 30 -5.415 0.638 1.586
208 HA TRP 30 HA TRP 30 -3.511 2.672 2.596
209 1HB TRP 30 2HB TRP 30 -3.576 1.933 4.832
210 2HB TRP 30 1HB TRP 30 -5.270 1.918 4.362
211 HD1 TRP 30 HD1 TRP 30 -4.929 -0.890 2.646
212 HE1 TRP 30 HE1 TRP 30 -4.858 -3.086 3.989
213 HE3 TRP 30 HE3 TRP 30 -3.671 0.936 7.239
214 HZ2 TRP 30 HZ2 TRP 30 -4.341 -3.952 6.660
215 HZ3 TRP 30 HZ3 TRP 30 -3.400 -0.595 9.167
216 HH2 TRP 30 HH2 TRP 30 -3.733 -3.036 8.885
217 H CYS 31 H CYS 31 -1.441 1.479 3.393
218 HA CYS 31 HA CYS 31 -0.555 -0.304 1.275
219 1HB CYS 31 2HB CYS 31 0.574 0.929 3.770
220 2HB CYS 31 1HB CYS 31 1.479 -0.346 2.958
221 H LYS 32 H LYS 32 -0.752 -2.490 1.261
222 HA LYS 32 HA LYS 32 -1.188 -3.925 3.862
223 1HB LYS 32 2HB LYS 32 -3.048 -3.666 2.043
224 2HB LYS 32 1HB LYS 32 -2.109 -4.857 1.142
225 1HG LYS 32 2HG LYS 32 -2.531 -5.568 3.966
226 2HG LYS 32 1HG LYS 32 -4.019 -5.464 3.025
227 1HD LYS 32 2HD LYS 32 -3.040 -6.971 1.322
228 2HD LYS 32 1HD LYS 32 -1.573 -7.101 2.291
229 1HE LYS 32 2HE LYS 32 -4.223 -7.741 3.569
230 2HE LYS 32 1HE LYS 32 -3.434 -8.951 2.539
231 1HZ LYS 32 1HZ LYS 32 -2.691 -9.115 4.856
232 2HZ LYS 32 2HZ LYS 32 -2.129 -7.513 4.794
233 3HZ LYS 32 3HZ LYS 32 -1.413 -8.708 3.820
234 H TYR 33 H TYR 33 0.052 -5.813 4.177
235 HA TYR 33 HA TYR 33 2.387 -6.148 2.389
236 1HB TYR 33 2HB TYR 33 2.665 -6.024 4.827
237 2HB TYR 33 1HB TYR 33 1.573 -7.392 5.037
238 HD1 TYR 33 HD1 TYR 33 2.773 -9.274 5.715
239 HD2 TYR 33 HD2 TYR 33 4.416 -6.726 2.671
240 HE1 TYR 33 HE1 TYR 33 4.673 -10.841 5.429
241 HE2 TYR 33 HE2 TYR 33 6.315 -8.293 2.385
242 HH TYR 33 HH TYR 33 7.395 -10.237 4.292
243 H GLU 34 H GLU 34 2.471 -7.739 0.856
244 HA GLU 34 HA GLU 34 0.255 -9.558 0.419
245 1HB GLU 34 2HB GLU 34 2.735 -8.699 -0.857
246 2HB GLU 34 1HB GLU 34 2.478 -10.433 -1.050
247 1HG GLU 34 2HG GLU 34 0.250 -8.464 -1.555
248 2HG GLU 34 1HG GLU 34 1.420 -8.861 -2.814
249 H ILE 35 H ILE 35 -0.069 -11.404 1.579
250 HA ILE 35 HA ILE 35 2.160 -12.642 3.081
251 HB ILE 35 HB ILE 35 0.271 -13.998 4.022
252 1HG1 ILE 35 1HG1 ILE 35 -1.707 -12.208 2.692
253 2HG1 ILE 35 2HG1 ILE 35 -1.039 -13.515 1.716
254 1HG2 ILE 35 1HG2 ILE 35 0.119 -10.984 3.989
255 2HG2 ILE 35 2HG2 ILE 35 -0.953 -11.954 4.999
256 3HG2 ILE 35 3HG2 ILE 35 0.792 -12.033 5.236
257 1HD1 ILE 35 1HD1 ILE 35 -1.846 -14.302 4.448
258 2HD1 ILE 35 2HD1 ILE 35 -3.173 -13.806 3.397
259 3HD1 ILE 35 3HD1 ILE 35 -2.112 -15.128 2.912
260 1HN NH2 36 1HN NH2 36 3.072 -14.840 0.680
261 2HN NH2 36 2HN NH2 36 3.382 -13.420 1.703
Start of MODEL 18
1 1H GLU 1 1H GLU 1 10.417 6.925 3.475
2 2H GLU 1 2H GLU 1 11.553 8.123 3.079
3 3H GLU 1 3H GLU 1 11.108 6.956 1.927
4 HA GLU 1 HA GLU 1 9.297 9.036 3.057
5 1HB GLU 1 2HB GLU 1 11.032 8.760 0.615
6 2HB GLU 1 1HB GLU 1 9.534 9.682 0.499
7 1HG GLU 1 2HG GLU 1 10.616 11.442 1.392
8 2HG GLU 1 1HG GLU 1 10.757 10.529 2.895
9 H CYS 2 H CYS 2 8.197 6.672 3.380
10 HA CYS 2 HA CYS 2 6.203 6.449 1.221
11 1HB CYS 2 2HB CYS 2 6.715 4.015 0.904
12 2HB CYS 2 1HB CYS 2 8.030 5.067 0.385
13 H LEU 3 H LEU 3 4.530 4.725 1.842
14 HA LEU 3 HA LEU 3 3.922 4.978 4.723
15 1HB LEU 3 2HB LEU 3 2.461 3.867 2.307
16 2HB LEU 3 1HB LEU 3 1.761 3.924 3.925
17 HG LEU 3 HG LEU 3 2.935 6.439 2.797
18 1HD1 LEU 3 1HD1 LEU 3 1.180 6.892 1.364
19 2HD1 LEU 3 2HD1 LEU 3 0.064 5.833 2.225
20 3HD1 LEU 3 3HD1 LEU 3 1.281 5.144 1.151
21 1HD2 LEU 3 1HD2 LEU 3 1.178 7.452 4.160
22 2HD2 LEU 3 2HD2 LEU 3 2.052 6.269 5.133
23 3HD2 LEU 3 3HD2 LEU 3 0.467 5.869 4.471
24 H GLY 4 H GLY 4 4.174 3.321 6.184
25 1HA GLY 4 2HA GLY 4 5.568 0.902 5.418
26 2HA GLY 4 1HA GLY 4 4.939 1.262 7.025
27 H PHE 5 H PHE 5 4.544 -1.235 6.550
28 HA PHE 5 HA PHE 5 2.314 -2.007 4.894
29 1HB PHE 5 2HB PHE 5 4.038 -3.561 5.648
30 2HB PHE 5 1HB PHE 5 3.633 -3.245 7.334
31 HD1 PHE 5 HD1 PHE 5 1.641 -4.192 8.357
32 HD2 PHE 5 HD2 PHE 5 2.517 -4.862 4.206
33 HE1 PHE 5 HE1 PHE 5 -0.072 -5.982 8.284
34 HE2 PHE 5 HE2 PHE 5 0.804 -6.652 4.134
35 HZ PHE 5 HZ PHE 5 -0.490 -7.212 6.172
36 H GLY 6 H GLY 6 0.126 -2.176 5.401
37 1HA GLY 6 2HA GLY 6 -1.879 -1.877 6.575
38 2HA GLY 6 1HA GLY 6 -0.953 -2.083 8.060
39 H LYS 7 H LYS 7 -0.418 0.427 5.599
40 HA LYS 7 HA LYS 7 -1.056 2.481 7.690
41 1HB LYS 7 2HB LYS 7 1.307 2.225 6.842
42 2HB LYS 7 1HB LYS 7 0.724 2.667 5.238
43 1HG LYS 7 2HG LYS 7 1.629 4.647 6.341
44 2HG LYS 7 1HG LYS 7 -0.115 4.821 6.169
45 1HD LYS 7 2HD LYS 7 0.487 5.507 8.413
46 2HD LYS 7 1HD LYS 7 -0.365 3.969 8.525
47 1HE LYS 7 2HE LYS 7 1.522 3.672 9.941
48 2HE LYS 7 1HE LYS 7 2.026 2.904 8.424
49 1HZ LYS 7 1HZ LYS 7 3.131 4.889 7.749
50 2HZ LYS 7 2HZ LYS 7 3.660 4.536 9.324
51 3HZ LYS 7 3HZ LYS 7 2.515 5.764 9.066
52 H GLY 8 H GLY 8 -2.673 3.939 7.219
53 1HA GLY 8 2HA GLY 8 -4.498 3.570 5.091
54 2HA GLY 8 1HA GLY 8 -4.369 5.049 6.040
55 H CYS 9 H CYS 9 -4.095 3.824 2.954
56 HA CYS 9 HA CYS 9 -2.543 6.224 2.064
57 1HB CYS 9 2HB CYS 9 -1.182 4.854 0.663
58 2HB CYS 9 1HB CYS 9 -1.242 4.008 2.208
59 H ASN 10 H ASN 10 -2.791 6.315 -0.505
60 HA ASN 10 HA ASN 10 -5.713 6.051 -1.080
61 1HB ASN 10 2HB ASN 10 -3.813 8.100 -1.329
62 2HB ASN 10 1HB ASN 10 -4.083 7.548 -2.981
63 1HD2 ASN 10 1HD2 ASN 10 -5.525 9.093 -3.832
64 2HD2 ASN 10 2HD2 ASN 10 -6.995 9.528 -3.103
65 HA PRO 11 HA PRO 11 -4.728 2.769 -3.913
66 1HB PRO 11 2HB PRO 11 -7.084 2.759 -5.315
67 2HB PRO 11 1HB PRO 11 -6.920 2.068 -3.688
68 1HG PRO 11 2HG PRO 11 -8.018 4.711 -4.517
69 2HG PRO 11 1HG PRO 11 -8.606 3.582 -3.286
70 1HD PRO 11 2HD PRO 11 -7.185 5.806 -2.671
71 2HD PRO 11 1HD PRO 11 -7.108 4.317 -1.703
72 H SER 12 H SER 12 -6.185 5.795 -5.148
73 HA SER 12 HA SER 12 -5.208 5.460 -7.868
74 1HB SER 12 2HB SER 12 -6.349 7.711 -6.203
75 2HB SER 12 1HB SER 12 -5.812 7.985 -7.858
76 HG SER 12 HG SER 12 -7.455 6.852 -8.582
77 H ASN 13 H ASN 13 -4.016 7.072 -4.931
78 HA ASN 13 HA ASN 13 -1.511 7.839 -6.390
79 1HB ASN 13 2HB ASN 13 -2.934 8.893 -3.926
80 2HB ASN 13 1HB ASN 13 -1.301 9.395 -4.361
81 1HD2 ASN 13 1HD2 ASN 13 -3.812 11.058 -4.344
82 2HD2 ASN 13 2HD2 ASN 13 -3.969 11.654 -5.925
83 H ASP 14 H ASP 14 -1.130 5.374 -6.018
84 HA ASP 14 HA ASP 14 -0.697 4.189 -3.487
85 1HB ASP 14 2HB ASP 14 -0.618 3.354 -6.003
86 2HB ASP 14 1HB ASP 14 1.112 3.639 -5.820
87 H GLN 15 H GLN 15 0.650 4.916 -1.883
88 HA GLN 15 HA GLN 15 3.348 5.979 -2.664
89 1HB GLN 15 2HB GLN 15 1.215 7.040 -0.819
90 2HB GLN 15 1HB GLN 15 2.907 7.442 -0.523
91 1HG GLN 15 2HG GLN 15 3.132 8.523 -2.628
92 2HG GLN 15 1HG GLN 15 1.632 7.821 -3.236
93 1HE2 GLN 15 1HE2 GLN 15 2.883 10.166 -0.819
94 2HE2 GLN 15 2HE2 GLN 15 1.452 11.075 -0.736
95 H CYS 16 H CYS 16 2.645 3.246 -1.849
96 HA CYS 16 HA CYS 16 3.411 2.945 0.977
97 1HB CYS 16 2HB CYS 16 2.979 0.989 -1.305
98 2HB CYS 16 1HB CYS 16 3.185 0.531 0.385
99 H CYS 17 H CYS 17 5.281 1.391 1.488
100 HA CYS 17 HA CYS 17 7.738 2.379 0.278
101 1HB CYS 17 2HB CYS 17 7.124 0.153 2.249
102 2HB CYS 17 1HB CYS 17 8.747 0.732 1.885
103 H LYS 18 H LYS 18 8.685 1.577 -1.534
104 HA LYS 18 HA LYS 18 7.673 -0.786 -2.902
105 1HB LYS 18 2HB LYS 18 8.990 1.529 -3.570
106 2HB LYS 18 1HB LYS 18 10.294 0.346 -3.674
107 1HG LYS 18 2HG LYS 18 9.290 -0.818 -5.405
108 2HG LYS 18 1HG LYS 18 7.662 -0.349 -4.916
109 1HD LYS 18 2HD LYS 18 9.284 1.964 -5.649
110 2HD LYS 18 1HD LYS 18 9.154 0.806 -6.973
111 1HE LYS 18 2HE LYS 18 6.612 1.302 -5.537
112 2HE LYS 18 1HE LYS 18 7.248 2.695 -6.432
113 1HZ LYS 18 1HZ LYS 18 5.913 1.243 -7.861
114 2HZ LYS 18 2HZ LYS 18 6.953 -0.057 -7.523
115 3HZ LYS 18 3HZ LYS 18 7.530 1.297 -8.373
116 H SER 19 H SER 19 10.362 -0.144 -0.711
117 HA SER 19 HA SER 19 12.033 -2.381 -1.310
118 1HB SER 19 2HB SER 19 12.924 -1.928 0.943
119 2HB SER 19 1HB SER 19 12.620 -0.418 0.089
120 HG SER 19 HG SER 19 11.334 0.068 1.668
121 H SER 20 H SER 20 9.152 -2.109 0.774
122 HA SER 20 HA SER 20 9.410 -4.976 1.557
123 1HB SER 20 2HB SER 20 7.766 -2.606 2.463
124 2HB SER 20 1HB SER 20 7.422 -4.238 3.030
125 HG SER 20 HG SER 20 8.857 -3.206 4.436
126 H ASN 21 H ASN 21 8.419 -3.783 -1.188
127 HA ASN 21 HA ASN 21 6.721 -4.241 -2.758
128 1HB ASN 21 2HB ASN 21 7.711 -6.535 -1.591
129 2HB ASN 21 1HB ASN 21 5.972 -6.740 -1.381
130 1HD2 ASN 21 1HD2 ASN 21 8.560 -6.672 -3.750
131 2HD2 ASN 21 2HD2 ASN 21 7.593 -7.030 -5.098
132 H LEU 22 H LEU 22 5.689 -2.446 -1.038
133 HA LEU 22 HA LEU 22 3.132 -3.545 0.044
134 1HB LEU 22 2HB LEU 22 4.690 -0.971 0.408
135 2HB LEU 22 1HB LEU 22 3.092 -1.225 1.106
136 HG LEU 22 HG LEU 22 5.446 -3.073 1.586
137 1HD1 LEU 22 1HD1 LEU 22 4.698 -0.502 2.804
138 2HD1 LEU 22 2HD1 LEU 22 6.218 -1.391 2.898
139 3HD1 LEU 22 3HD1 LEU 22 4.885 -1.809 3.973
140 1HD2 LEU 22 1HD2 LEU 22 3.810 -4.408 2.393
141 2HD2 LEU 22 2HD2 LEU 22 2.597 -3.144 2.193
142 3HD2 LEU 22 3HD2 LEU 22 3.567 -3.211 3.664
143 H VAL 23 H VAL 23 1.161 -2.924 -0.813
144 HA VAL 23 HA VAL 23 1.121 -0.815 -2.942
145 HB VAL 23 HB VAL 23 -0.414 -2.386 -4.208
146 1HG1 VAL 23 1HG1 VAL 23 2.282 -3.652 -3.706
147 2HG1 VAL 23 2HG1 VAL 23 2.114 -2.128 -4.578
148 3HG1 VAL 23 3HG1 VAL 23 1.366 -3.594 -5.212
149 1HG2 VAL 23 1HG2 VAL 23 -0.504 -4.717 -3.589
150 2HG2 VAL 23 2HG2 VAL 23 -0.959 -3.781 -2.166
151 3HG2 VAL 23 3HG2 VAL 23 0.659 -4.471 -2.287
152 H CYS 24 H CYS 24 -0.867 0.347 -3.037
153 HA CYS 24 HA CYS 24 -2.415 0.447 -0.592
154 1HB CYS 24 2HB CYS 24 -2.462 1.750 -3.300
155 2HB CYS 24 1HB CYS 24 -3.814 2.000 -2.196
156 H SER 25 H SER 25 -4.338 -0.559 -0.118
157 HA SER 25 HA SER 25 -5.428 -2.509 -2.070
158 1HB SER 25 2HB SER 25 -4.876 -2.963 0.383
159 2HB SER 25 1HB SER 25 -6.256 -1.948 0.792
160 HG SER 25 HG SER 25 -7.204 -3.857 0.619
161 H ARG 26 H ARG 26 -7.917 -2.663 -2.081
162 HA ARG 26 HA ARG 26 -9.050 0.071 -2.505
163 1HB ARG 26 2HB ARG 26 -9.480 -2.691 -3.591
164 2HB ARG 26 1HB ARG 26 -10.825 -1.552 -3.650
165 1HG ARG 26 2HG ARG 26 -8.990 0.085 -4.620
166 2HG ARG 26 1HG ARG 26 -8.169 -1.420 -5.035
167 1HD ARG 26 2HD ARG 26 -10.251 -2.191 -6.200
168 2HD ARG 26 1HD ARG 26 -10.971 -0.600 -5.881
169 HE ARG 26 HE ARG 26 -8.592 -1.084 -7.614
170 1HH1 ARG 26 1HH2 ARG 26 -11.107 0.053 -8.748
171 2HH1 ARG 26 2HH2 ARG 26 -10.778 1.753 -8.757
172 1HH2 ARG 26 2HH1 ARG 26 -8.108 1.515 -6.546
173 2HH2 ARG 26 1HH1 ARG 26 -9.075 2.583 -7.506
174 H LYS 27 H LYS 27 -9.802 -3.075 -0.976
175 HA LYS 27 HA LYS 27 -12.265 -2.096 0.261
176 1HB LYS 27 2HB LYS 27 -12.355 -4.336 1.164
177 2HB LYS 27 1HB LYS 27 -11.729 -4.465 -0.478
178 1HG LYS 27 2HG LYS 27 -9.393 -4.414 0.519
179 2HG LYS 27 1HG LYS 27 -10.149 -4.575 2.104
180 1HD LYS 27 2HD LYS 27 -11.031 -6.714 1.594
181 2HD LYS 27 1HD LYS 27 -10.759 -6.504 -0.136
182 1HE LYS 27 2HE LYS 27 -8.211 -6.217 0.750
183 2HE LYS 27 1HE LYS 27 -8.843 -7.323 1.986
184 1HZ LYS 27 1HZ LYS 27 -8.047 -8.544 0.046
185 2HZ LYS 27 2HZ LYS 27 -9.114 -7.682 -0.955
186 3HZ LYS 27 3HZ LYS 27 -9.722 -8.735 0.232
187 H HIS 28 H HIS 28 -8.874 -2.364 1.208
188 HA HIS 28 HA HIS 28 -9.555 -1.519 3.996
189 1HB HIS 28 2HB HIS 28 -7.171 -2.811 2.654
190 2HB HIS 28 1HB HIS 28 -7.075 -2.167 4.292
191 HD1 HIS 28 HD1 HIS 28 -9.744 -3.018 5.466
192 HD2 HIS 28 HD2 HIS 28 -7.440 -5.535 3.070
193 HE1 HIS 28 HE1 HIS 28 -10.464 -5.383 6.012
194 H ARG 29 H ARG 29 -8.091 -0.397 1.021
195 HA ARG 29 HA ARG 29 -7.074 1.649 0.445
196 1HB ARG 29 2HB ARG 29 -9.216 2.068 2.288
197 2HB ARG 29 1HB ARG 29 -7.933 3.202 2.708
198 1HG ARG 29 2HG ARG 29 -9.054 4.415 1.074
199 2HG ARG 29 1HG ARG 29 -7.847 3.586 0.092
200 1HD ARG 29 2HD ARG 29 -9.883 3.195 -1.071
201 2HD ARG 29 1HD ARG 29 -9.656 1.708 -0.130
202 HE ARG 29 HE ARG 29 -11.230 3.939 1.072
203 1HH1 ARG 29 2HH1 ARG 29 -11.037 1.221 2.350
204 2HH1 ARG 29 1HH1 ARG 29 -12.527 0.487 1.860
205 1HH2 ARG 29 1HH2 ARG 29 -13.140 2.793 -0.666
206 2HH2 ARG 29 2HH2 ARG 29 -13.721 1.379 0.149
207 H TRP 30 H TRP 30 -5.364 -0.109 1.797
208 HA TRP 30 HA TRP 30 -3.614 1.812 3.250
209 1HB TRP 30 2HB TRP 30 -3.335 0.285 5.102
210 2HB TRP 30 1HB TRP 30 -5.058 0.519 4.853
211 HD1 TRP 30 HD1 TRP 30 -4.482 -1.650 2.140
212 HE1 TRP 30 HE1 TRP 30 -4.738 -4.136 2.745
213 HE3 TRP 30 HE3 TRP 30 -4.174 -1.350 7.223
214 HZ2 TRP 30 HZ2 TRP 30 -4.803 -5.787 5.078
215 HZ3 TRP 30 HZ3 TRP 30 -4.336 -3.393 8.613
216 HH2 TRP 30 HH2 TRP 30 -4.650 -5.610 7.548
217 H CYS 31 H CYS 31 -1.394 0.580 3.714
218 HA CYS 31 HA CYS 31 -0.461 -0.387 1.098
219 1HB CYS 31 2HB CYS 31 0.823 0.243 3.765
220 2HB CYS 31 1HB CYS 31 1.749 -0.355 2.389
221 H LYS 32 H LYS 32 -1.442 -2.477 0.916
222 HA LYS 32 HA LYS 32 -0.926 -4.515 3.000
223 1HB LYS 32 2HB LYS 32 -3.019 -4.048 1.411
224 2HB LYS 32 1HB LYS 32 -2.112 -5.076 0.302
225 1HG LYS 32 2HG LYS 32 -1.966 -6.820 2.060
226 2HG LYS 32 1HG LYS 32 -2.925 -5.799 3.132
227 1HD LYS 32 2HD LYS 32 -4.788 -5.840 1.522
228 2HD LYS 32 1HD LYS 32 -3.832 -6.849 0.435
229 1HE LYS 32 2HE LYS 32 -3.812 -8.675 2.012
230 2HE LYS 32 1HE LYS 32 -4.516 -7.656 3.282
231 1HZ LYS 32 1HZ LYS 32 -5.805 -8.275 0.674
232 2HZ LYS 32 2HZ LYS 32 -6.473 -7.333 1.921
233 3HZ LYS 32 3HZ LYS 32 -6.213 -8.996 2.154
234 H TYR 33 H TYR 33 0.105 -6.607 2.334
235 HA TYR 33 HA TYR 33 2.528 -6.118 0.719
236 1HB TYR 33 2HB TYR 33 2.543 -7.266 2.930
237 2HB TYR 33 1HB TYR 33 1.548 -8.553 2.250
238 HD1 TYR 33 HD1 TYR 33 2.672 -10.467 1.559
239 HD2 TYR 33 HD2 TYR 33 4.683 -6.675 1.344
240 HE1 TYR 33 HE1 TYR 33 4.707 -11.593 0.705
241 HE2 TYR 33 HE2 TYR 33 6.719 -7.804 0.490
242 HH TYR 33 HH TYR 33 6.911 -10.451 -0.887
243 H GLU 34 H GLU 34 2.981 -7.139 -1.246
244 HA GLU 34 HA GLU 34 0.699 -8.154 -2.786
245 1HB GLU 34 2HB GLU 34 3.000 -6.740 -3.298
246 2HB GLU 34 1HB GLU 34 3.438 -8.347 -3.878
247 1HG GLU 34 2HG GLU 34 0.844 -6.990 -4.649
248 2HG GLU 34 1HG GLU 34 2.324 -6.815 -5.591
249 H ILE 35 H ILE 35 0.406 -10.297 -3.474
250 HA ILE 35 HA ILE 35 1.578 -12.418 -1.884
251 HB ILE 35 HB ILE 35 -0.747 -12.221 -2.973
252 1HG1 ILE 35 1HG1 ILE 35 -0.336 -14.832 -3.789
253 2HG1 ILE 35 2HG1 ILE 35 1.004 -14.561 -2.675
254 1HG2 ILE 35 1HG2 ILE 35 0.284 -11.693 -5.260
255 2HG2 ILE 35 2HG2 ILE 35 0.661 -13.412 -5.370
256 3HG2 ILE 35 3HG2 ILE 35 -1.017 -12.882 -5.245
257 1HD1 ILE 35 1HD1 ILE 35 -1.798 -13.736 -1.932
258 2HD1 ILE 35 2HD1 ILE 35 -1.254 -15.396 -1.694
259 3HD1 ILE 35 3HD1 ILE 35 -0.429 -14.072 -0.872
260 1HN NH2 36 1HN NH2 36 3.174 -10.621 -4.010
261 2HN NH2 36 2HN NH2 36 4.449 -11.769 -3.521
Start of MODEL 19
1 1H GLU 1 1H GLU 1 10.444 8.787 -2.951
2 2H GLU 1 2H GLU 1 8.964 8.416 -3.699
3 3H GLU 1 3H GLU 1 9.983 7.168 -3.159
4 HA GLU 1 HA GLU 1 9.652 7.859 -0.853
5 1HB GLU 1 2HB GLU 1 8.349 10.068 -2.378
6 2HB GLU 1 1HB GLU 1 7.608 9.623 -0.842
7 1HG GLU 1 2HG GLU 1 10.580 9.970 -0.926
8 2HG GLU 1 1HG GLU 1 9.569 11.416 -0.939
9 H CYS 2 H CYS 2 8.422 6.207 -0.063
10 HA CYS 2 HA CYS 2 5.793 5.621 -1.387
11 1HB CYS 2 2HB CYS 2 6.338 3.225 -0.989
12 2HB CYS 2 1HB CYS 2 7.523 4.005 -2.033
13 H LEU 3 H LEU 3 4.434 4.151 0.137
14 HA LEU 3 HA LEU 3 4.431 5.395 2.845
15 1HB LEU 3 2HB LEU 3 2.426 3.848 1.175
16 2HB LEU 3 1HB LEU 3 2.101 4.361 2.830
17 HG LEU 3 HG LEU 3 3.059 6.376 0.816
18 1HD1 LEU 3 1HD1 LEU 3 0.726 6.852 0.204
19 2HD1 LEU 3 2HD1 LEU 3 0.178 5.505 1.203
20 3HD1 LEU 3 3HD1 LEU 3 1.148 5.197 -0.238
21 1HD2 LEU 3 1HD2 LEU 3 2.141 6.353 3.538
22 2HD2 LEU 3 2HD2 LEU 3 1.010 7.298 2.570
23 3HD2 LEU 3 3HD2 LEU 3 2.721 7.722 2.591
24 H GLY 4 H GLY 4 4.565 4.122 4.724
25 1HA GLY 4 2HA GLY 4 5.882 1.553 4.504
26 2HA GLY 4 1HA GLY 4 5.348 2.310 6.003
27 H PHE 5 H PHE 5 4.446 0.352 6.817
28 HA PHE 5 HA PHE 5 2.350 -1.032 5.260
29 1HB PHE 5 2HB PHE 5 3.868 -2.399 6.499
30 2HB PHE 5 1HB PHE 5 3.693 -1.409 7.946
31 HD1 PHE 5 HD1 PHE 5 2.346 -2.252 9.639
32 HD2 PHE 5 HD2 PHE 5 1.492 -3.327 5.568
33 HE1 PHE 5 HE1 PHE 5 0.478 -3.688 10.410
34 HE2 PHE 5 HE2 PHE 5 -0.377 -4.762 6.342
35 HZ PHE 5 HZ PHE 5 -0.883 -4.943 8.761
36 H GLY 6 H GLY 6 0.161 -0.880 5.668
37 1HA GLY 6 2HA GLY 6 -1.855 -0.092 6.549
38 2HA GLY 6 1HA GLY 6 -1.019 0.092 8.090
39 H LYS 7 H LYS 7 -0.484 1.670 4.933
40 HA LYS 7 HA LYS 7 -0.784 4.320 6.311
41 1HB LYS 7 2HB LYS 7 1.015 3.219 4.162
42 2HB LYS 7 1HB LYS 7 0.706 4.954 4.237
43 1HG LYS 7 2HG LYS 7 1.311 3.816 6.864
44 2HG LYS 7 1HG LYS 7 2.625 3.585 5.710
45 1HD LYS 7 2HD LYS 7 3.043 5.833 5.521
46 2HD LYS 7 1HD LYS 7 1.350 6.273 5.746
47 1HE LYS 7 2HE LYS 7 1.571 5.660 8.179
48 2HE LYS 7 1HE LYS 7 3.309 5.427 7.908
49 1HZ LYS 7 1HZ LYS 7 3.450 7.676 7.041
50 2HZ LYS 7 2HZ LYS 7 2.825 7.699 8.620
51 3HZ LYS 7 3HZ LYS 7 1.788 7.908 7.291
52 H GLY 8 H GLY 8 -2.066 5.897 5.266
53 1HA GLY 8 2HA GLY 8 -4.256 5.061 3.679
54 2HA GLY 8 1HA GLY 8 -3.728 6.737 3.838
55 H CYS 9 H CYS 9 -4.098 4.211 1.662
56 HA CYS 9 HA CYS 9 -2.434 5.638 -0.371
57 1HB CYS 9 2HB CYS 9 -1.004 3.882 0.321
58 2HB CYS 9 1HB CYS 9 -2.343 2.754 0.518
59 H ASN 10 H ASN 10 -3.308 5.495 -2.496
60 HA ASN 10 HA ASN 10 -6.117 4.515 -2.636
61 1HB ASN 10 2HB ASN 10 -4.829 6.805 -3.470
62 2HB ASN 10 1HB ASN 10 -4.890 5.863 -4.959
63 1HD2 ASN 10 1HD2 ASN 10 -6.898 5.745 -6.038
64 2HD2 ASN 10 2HD2 ASN 10 -8.351 6.351 -5.407
65 HA PRO 11 HA PRO 11 -4.837 0.911 -4.869
66 1HB PRO 11 2HB PRO 11 -7.220 0.329 -6.102
67 2HB PRO 11 1HB PRO 11 -6.909 0.012 -4.383
68 1HG PRO 11 2HG PRO 11 -8.358 2.291 -5.652
69 2HG PRO 11 1HG PRO 11 -8.770 1.362 -4.201
70 1HD PRO 11 2HD PRO 11 -7.630 3.805 -4.072
71 2HD PRO 11 1HD PRO 11 -7.307 2.538 -2.866
72 H SER 12 H SER 12 -5.970 3.820 -6.381
73 HA SER 12 HA SER 12 -5.505 2.875 -9.142
74 1HB SER 12 2HB SER 12 -6.202 5.565 -7.918
75 2HB SER 12 1HB SER 12 -6.147 5.243 -9.648
76 HG SER 12 HG SER 12 -7.971 4.178 -9.506
77 H ASN 13 H ASN 13 -3.950 4.998 -6.729
78 HA ASN 13 HA ASN 13 -1.730 5.657 -8.568
79 1HB ASN 13 2HB ASN 13 -2.676 7.346 -7.057
80 2HB ASN 13 1HB ASN 13 -2.334 6.319 -5.666
81 1HD2 ASN 13 1HD2 ASN 13 -0.552 7.779 -8.460
82 2HD2 ASN 13 2HD2 ASN 13 0.849 8.124 -7.567
83 H ASP 14 H ASP 14 -2.224 3.873 -5.523
84 HA ASP 14 HA ASP 14 -0.933 2.225 -4.450
85 1HB ASP 14 2HB ASP 14 -0.729 1.874 -7.351
86 2HB ASP 14 1HB ASP 14 0.661 1.202 -6.498
87 H GLN 15 H GLN 15 0.244 3.907 -3.273
88 HA GLN 15 HA GLN 15 3.010 4.440 -4.304
89 1HB GLN 15 2HB GLN 15 1.160 6.241 -3.736
90 2HB GLN 15 1HB GLN 15 1.666 5.943 -2.074
91 1HG GLN 15 2HG GLN 15 3.418 7.315 -2.400
92 2HG GLN 15 1HG GLN 15 4.041 6.185 -3.602
93 1HE2 GLN 15 1HE2 GLN 15 3.516 6.607 -5.888
94 2HE2 GLN 15 2HE2 GLN 15 2.965 8.133 -6.385
95 H CYS 16 H CYS 16 2.115 1.973 -2.799
96 HA CYS 16 HA CYS 16 3.179 2.263 -0.076
97 1HB CYS 16 2HB CYS 16 2.309 -0.076 -1.802
98 2HB CYS 16 1HB CYS 16 2.810 -0.245 -0.121
99 H CYS 17 H CYS 17 5.111 1.061 0.666
100 HA CYS 17 HA CYS 17 7.377 1.340 -1.133
101 1HB CYS 17 2HB CYS 17 7.040 0.060 1.599
102 2HB CYS 17 1HB CYS 17 8.594 0.393 0.838
103 H LYS 18 H LYS 18 7.459 -0.102 -2.842
104 HA LYS 18 HA LYS 18 6.514 -2.824 -2.760
105 1HB LYS 18 2HB LYS 18 7.381 -0.964 -4.641
106 2HB LYS 18 1HB LYS 18 8.625 -2.213 -4.705
107 1HG LYS 18 2HG LYS 18 7.019 -2.983 -6.243
108 2HG LYS 18 1HG LYS 18 6.631 -3.882 -4.777
109 1HD LYS 18 2HD LYS 18 4.933 -2.127 -4.211
110 2HD LYS 18 1HD LYS 18 5.258 -1.368 -5.770
111 1HE LYS 18 2HE LYS 18 4.262 -3.099 -6.976
112 2HE LYS 18 1HE LYS 18 4.562 -4.295 -5.700
113 1HZ LYS 18 1HZ LYS 18 2.989 -3.121 -4.279
114 2HZ LYS 18 2HZ LYS 18 2.236 -3.623 -5.717
115 3HZ LYS 18 3HZ LYS 18 2.682 -1.997 -5.512
116 H SER 19 H SER 19 9.657 -1.330 -2.073
117 HA SER 19 HA SER 19 11.266 -3.713 -2.088
118 1HB SER 19 2HB SER 19 11.436 -1.022 -0.711
119 2HB SER 19 1HB SER 19 12.715 -2.225 -0.577
120 HG SER 19 HG SER 19 13.276 -1.839 -2.578
121 H SER 20 H SER 20 9.067 -2.339 0.301
122 HA SER 20 HA SER 20 9.970 -4.295 2.366
123 1HB SER 20 2HB SER 20 8.264 -1.797 2.335
124 2HB SER 20 1HB SER 20 8.349 -2.844 3.749
125 HG SER 20 HG SER 20 10.267 -1.171 2.619
126 H ASN 21 H ASN 21 8.272 -4.905 -0.133
127 HA ASN 21 HA ASN 21 6.397 -6.206 -0.692
128 1HB ASN 21 2HB ASN 21 7.313 -7.008 2.034
129 2HB ASN 21 1HB ASN 21 5.768 -7.656 1.485
130 1HD2 ASN 21 1HD2 ASN 21 9.254 -7.635 0.829
131 2HD2 ASN 21 2HD2 ASN 21 9.230 -8.924 -0.275
132 H LEU 22 H LEU 22 5.399 -3.818 -0.537
133 HA LEU 22 HA LEU 22 3.002 -4.022 1.254
134 1HB LEU 22 2HB LEU 22 4.851 -1.698 0.670
135 2HB LEU 22 1HB LEU 22 3.237 -1.458 1.337
136 HG LEU 22 HG LEU 22 5.236 -3.341 2.602
137 1HD1 LEU 22 1HD1 LEU 22 5.467 -1.369 4.270
138 2HD1 LEU 22 2HD1 LEU 22 4.863 -0.369 2.949
139 3HD1 LEU 22 3HD1 LEU 22 6.363 -1.275 2.754
140 1HD2 LEU 22 1HD2 LEU 22 2.705 -1.961 3.552
141 2HD2 LEU 22 2HD2 LEU 22 3.773 -2.895 4.598
142 3HD2 LEU 22 3HD2 LEU 22 2.924 -3.688 3.272
143 H VAL 23 H VAL 23 1.136 -3.945 0.078
144 HA VAL 23 HA VAL 23 1.186 -2.593 -2.604
145 HB VAL 23 HB VAL 23 -0.405 -4.419 -3.302
146 1HG1 VAL 23 1HG1 VAL 23 1.611 -6.245 -2.764
147 2HG1 VAL 23 2HG1 VAL 23 2.442 -4.692 -2.677
148 3HG1 VAL 23 3HG1 VAL 23 1.564 -5.141 -4.138
149 1HG2 VAL 23 1HG2 VAL 23 -1.103 -4.965 -0.920
150 2HG2 VAL 23 2HG2 VAL 23 0.454 -5.771 -0.726
151 3HG2 VAL 23 3HG2 VAL 23 -0.705 -6.366 -1.914
152 H CYS 24 H CYS 24 -0.734 -1.440 -3.148
153 HA CYS 24 HA CYS 24 -2.291 -0.451 -0.901
154 1HB CYS 24 2HB CYS 24 -1.525 0.545 -3.273
155 2HB CYS 24 1HB CYS 24 -3.128 -0.030 -3.736
156 H SER 25 H SER 25 -4.257 -1.181 -0.192
157 HA SER 25 HA SER 25 -5.430 -3.591 -1.415
158 1HB SER 25 2HB SER 25 -6.022 -1.888 1.020
159 2HB SER 25 1HB SER 25 -6.963 -3.317 0.602
160 HG SER 25 HG SER 25 -5.444 -4.366 1.600
161 H ARG 26 H ARG 26 -7.821 -3.656 -1.826
162 HA ARG 26 HA ARG 26 -8.683 -1.261 -3.348
163 1HB ARG 26 2HB ARG 26 -8.776 -3.990 -3.746
164 2HB ARG 26 1HB ARG 26 -10.420 -3.642 -3.212
165 1HG ARG 26 2HG ARG 26 -9.465 -1.653 -5.119
166 2HG ARG 26 1HG ARG 26 -9.415 -3.282 -5.793
167 1HD ARG 26 2HD ARG 26 -11.639 -3.010 -6.205
168 2HD ARG 26 1HD ARG 26 -11.868 -3.202 -4.455
169 HE ARG 26 HE ARG 26 -11.122 -0.490 -5.360
170 1HH1 ARG 26 1HH2 ARG 26 -13.801 -0.971 -6.498
171 2HH1 ARG 26 2HH2 ARG 26 -14.862 -0.531 -5.201
172 1HH2 ARG 26 2HH1 ARG 26 -12.384 -0.676 -2.772
173 2HH2 ARG 26 1HH1 ARG 26 -14.057 -0.364 -3.087
174 H LYS 27 H LYS 27 -10.121 -3.464 -0.891
175 HA LYS 27 HA LYS 27 -12.296 -1.576 -0.319
176 1HB LYS 27 2HB LYS 27 -11.872 -4.303 -0.127
177 2HB LYS 27 1HB LYS 27 -11.791 -3.787 1.557
178 1HG LYS 27 2HG LYS 27 -14.004 -2.721 -0.159
179 2HG LYS 27 1HG LYS 27 -14.122 -4.376 0.438
180 1HD LYS 27 2HD LYS 27 -14.940 -3.491 2.349
181 2HD LYS 27 1HD LYS 27 -13.297 -2.940 2.674
182 1HE LYS 27 2HE LYS 27 -14.376 -0.890 2.771
183 2HE LYS 27 1HE LYS 27 -14.099 -0.951 1.019
184 1HZ LYS 27 1HZ LYS 27 -16.513 -1.985 2.418
185 2HZ LYS 27 2HZ LYS 27 -16.239 -2.029 0.741
186 3HZ LYS 27 3HZ LYS 27 -16.440 -0.540 1.534
187 H HIS 28 H HIS 28 -9.155 -2.383 1.084
188 HA HIS 28 HA HIS 28 -9.715 -0.880 3.571
189 1HB HIS 28 2HB HIS 28 -7.180 -2.187 2.526
190 2HB HIS 28 1HB HIS 28 -7.474 -1.668 4.184
191 HD1 HIS 28 HD1 HIS 28 -10.278 -2.753 4.679
192 HD2 HIS 28 HD2 HIS 28 -7.329 -4.949 2.715
193 HE1 HIS 28 HE1 HIS 28 -10.933 -5.188 4.900
194 H ARG 29 H ARG 29 -8.131 -0.389 0.472
195 HA ARG 29 HA ARG 29 -7.071 1.489 -0.468
196 1HB ARG 29 2HB ARG 29 -9.395 2.228 0.736
197 2HB ARG 29 1HB ARG 29 -8.257 3.265 1.596
198 1HG ARG 29 2HG ARG 29 -7.415 4.163 -0.506
199 2HG ARG 29 1HG ARG 29 -8.424 3.045 -1.424
200 1HD ARG 29 2HD ARG 29 -9.747 4.980 -1.458
201 2HD ARG 29 1HD ARG 29 -10.381 4.172 -0.010
202 HE ARG 29 HE ARG 29 -8.389 5.566 1.118
203 1HH1 ARG 29 1HH2 ARG 29 -11.186 6.716 1.088
204 2HH1 ARG 29 2HH2 ARG 29 -10.910 8.292 0.423
205 1HH2 ARG 29 2HH1 ARG 29 -7.754 7.504 -0.809
206 2HH2 ARG 29 1HH1 ARG 29 -8.959 8.740 -0.656
207 H TRP 30 H TRP 30 -5.416 0.108 1.333
208 HA TRP 30 HA TRP 30 -3.685 2.315 2.260
209 1HB TRP 30 2HB TRP 30 -3.685 1.665 4.539
210 2HB TRP 30 1HB TRP 30 -5.378 1.612 4.072
211 HD1 TRP 30 HD1 TRP 30 -4.798 -1.312 2.471
212 HE1 TRP 30 HE1 TRP 30 -4.786 -3.416 3.955
213 HE3 TRP 30 HE3 TRP 30 -4.063 0.846 7.033
214 HZ2 TRP 30 HZ2 TRP 30 -4.505 -4.094 6.721
215 HZ3 TRP 30 HZ3 TRP 30 -3.929 -0.549 9.076
216 HH2 TRP 30 HH2 TRP 30 -4.148 -3.014 8.927
217 H CYS 31 H CYS 31 -1.578 1.182 3.287
218 HA CYS 31 HA CYS 31 -0.589 -0.648 1.213
219 1HB CYS 31 2HB CYS 31 0.593 0.655 3.679
220 2HB CYS 31 1HB CYS 31 1.525 -0.401 2.620
221 H LYS 32 H LYS 32 -0.741 -2.832 1.378
222 HA LYS 32 HA LYS 32 -1.176 -4.060 4.077
223 1HB LYS 32 2HB LYS 32 -2.831 -4.200 2.077
224 2HB LYS 32 1HB LYS 32 -1.667 -5.323 1.376
225 1HG LYS 32 2HG LYS 32 -1.789 -6.549 3.658
226 2HG LYS 32 1HG LYS 32 -3.264 -5.616 3.917
227 1HD LYS 32 2HD LYS 32 -3.617 -6.552 1.350
228 2HD LYS 32 1HD LYS 32 -2.784 -7.899 2.125
229 1HE LYS 32 2HE LYS 32 -4.593 -7.263 4.070
230 2HE LYS 32 1HE LYS 32 -5.514 -6.852 2.610
231 1HZ LYS 32 1HZ LYS 32 -4.067 -9.407 3.094
232 2HZ LYS 32 2HZ LYS 32 -4.903 -9.005 1.670
233 3HZ LYS 32 3HZ LYS 32 -5.750 -9.203 3.129
234 H TYR 33 H TYR 33 0.291 -5.610 4.795
235 HA TYR 33 HA TYR 33 2.870 -5.828 3.468
236 1HB TYR 33 2HB TYR 33 2.335 -5.838 5.964
237 2HB TYR 33 1HB TYR 33 1.753 -7.488 5.744
238 HD1 TYR 33 HD1 TYR 33 4.730 -5.378 4.842
239 HD2 TYR 33 HD2 TYR 33 3.270 -9.224 6.080
240 HE1 TYR 33 HE1 TYR 33 7.059 -6.217 4.977
241 HE2 TYR 33 HE2 TYR 33 5.599 -10.063 6.216
242 HH TYR 33 HH TYR 33 8.108 -8.476 6.561
243 H GLU 34 H GLU 34 3.246 -7.187 1.772
244 HA GLU 34 HA GLU 34 1.472 -9.541 1.352
245 1HB GLU 34 2HB GLU 34 2.545 -7.554 -0.279
246 2HB GLU 34 1HB GLU 34 3.544 -8.963 -0.639
247 1HG GLU 34 2HG GLU 34 0.653 -9.532 -0.444
248 2HG GLU 34 1HG GLU 34 1.104 -8.477 -1.783
249 H ILE 35 H ILE 35 2.196 -11.520 1.982
250 HA ILE 35 HA ILE 35 5.102 -12.152 1.820
251 HB ILE 35 HB ILE 35 4.438 -11.166 4.076
252 1HG1 ILE 35 1HG1 ILE 35 5.312 -13.545 5.196
253 2HG1 ILE 35 2HG1 ILE 35 5.874 -13.669 3.530
254 1HG2 ILE 35 1HG2 ILE 35 2.188 -12.362 4.069
255 2HG2 ILE 35 2HG2 ILE 35 3.067 -13.831 4.491
256 3HG2 ILE 35 3HG2 ILE 35 3.092 -12.445 5.580
257 1HD1 ILE 35 1HD1 ILE 35 6.472 -11.049 4.161
258 2HD1 ILE 35 2HD1 ILE 35 6.786 -11.889 5.679
259 3HD1 ILE 35 3HD1 ILE 35 7.616 -12.390 4.206
260 1HN NH2 36 1HN NH2 36 4.411 -15.236 0.746
261 2HN NH2 36 2HN NH2 36 5.403 -13.768 0.885
Start of MODEL 20
1 1H GLU 1 1H GLU 1 -7.267 10.417 -5.069
2 2H GLU 1 2H GLU 1 -8.557 9.312 -5.012
3 3H GLU 1 3H GLU 1 -8.459 10.442 -6.276
4 HA GLU 1 HA GLU 1 -7.764 8.266 -7.071
5 1HB GLU 1 2HB GLU 1 -6.097 10.700 -6.885
6 2HB GLU 1 1HB GLU 1 -5.212 9.254 -7.368
7 1HG GLU 1 2HG GLU 1 -5.958 9.864 -9.448
8 2HG GLU 1 1HG GLU 1 -7.388 8.968 -8.936
9 H CYS 2 H CYS 2 -7.335 6.342 -6.054
10 HA CYS 2 HA CYS 2 -5.292 6.284 -3.868
11 1HB CYS 2 2HB CYS 2 -6.471 4.341 -3.103
12 2HB CYS 2 1HB CYS 2 -7.709 5.507 -3.563
13 H LEU 3 H LEU 3 -4.012 4.152 -3.819
14 HA LEU 3 HA LEU 3 -2.950 3.613 -6.555
15 1HB LEU 3 2HB LEU 3 -1.894 3.013 -3.769
16 2HB LEU 3 1HB LEU 3 -1.010 2.743 -5.269
17 HG LEU 3 HG LEU 3 -2.085 5.457 -4.461
18 1HD1 LEU 3 1HD1 LEU 3 0.782 4.536 -4.203
19 2HD1 LEU 3 2HD1 LEU 3 -0.356 4.437 -2.859
20 3HD1 LEU 3 3HD1 LEU 3 0.047 6.005 -3.559
21 1HD2 LEU 3 1HD2 LEU 3 -1.622 5.159 -6.856
22 2HD2 LEU 3 2HD2 LEU 3 -0.009 4.552 -6.483
23 3HD2 LEU 3 3HD2 LEU 3 -0.420 6.231 -6.137
24 H GLY 4 H GLY 4 -2.730 1.439 -7.311
25 1HA GLY 4 2HA GLY 4 -4.693 -0.446 -6.171
26 2HA GLY 4 1HA GLY 4 -3.830 -0.645 -7.696
27 H PHE 5 H PHE 5 -3.657 -2.905 -6.609
28 HA PHE 5 HA PHE 5 -1.744 -3.225 -4.431
29 1HB PHE 5 2HB PHE 5 -3.498 -4.846 -4.781
30 2HB PHE 5 1HB PHE 5 -3.027 -5.076 -6.464
31 HD1 PHE 5 HD1 PHE 5 -1.486 -6.749 -7.046
32 HD2 PHE 5 HD2 PHE 5 -1.729 -5.430 -2.965
33 HE1 PHE 5 HE1 PHE 5 0.084 -8.545 -6.372
34 HE2 PHE 5 HE2 PHE 5 -0.160 -7.228 -2.293
35 HZ PHE 5 HZ PHE 5 0.746 -8.785 -3.994
36 H GLY 6 H GLY 6 0.451 -3.736 -4.597
37 1HA GLY 6 2HA GLY 6 2.563 -4.031 -5.576
38 2HA GLY 6 1HA GLY 6 1.744 -4.511 -7.061
39 H LYS 7 H LYS 7 1.199 -1.426 -5.440
40 HA LYS 7 HA LYS 7 2.326 -0.034 -7.839
41 1HB LYS 7 2HB LYS 7 -0.069 0.267 -7.431
42 2HB LYS 7 1HB LYS 7 0.247 0.735 -5.762
43 1HG LYS 7 2HG LYS 7 -0.123 2.751 -7.056
44 2HG LYS 7 1HG LYS 7 1.585 2.680 -6.623
45 1HD LYS 7 2HD LYS 7 1.975 1.564 -8.888
46 2HD LYS 7 1HD LYS 7 0.321 2.022 -9.293
47 1HE LYS 7 2HE LYS 7 1.550 3.858 -10.112
48 2HE LYS 7 1HE LYS 7 1.102 4.422 -8.490
49 1HZ LYS 7 1HZ LYS 7 3.497 4.654 -8.907
50 2HZ LYS 7 2HZ LYS 7 3.617 2.980 -9.166
51 3HZ LYS 7 3HZ LYS 7 3.186 3.577 -7.635
52 H GLY 8 H GLY 8 4.088 1.288 -7.521
53 1HA GLY 8 2HA GLY 8 5.590 1.314 -5.123
54 2HA GLY 8 1HA GLY 8 5.785 2.481 -6.429
55 H CYS 9 H CYS 9 4.894 2.140 -3.210
56 HA CYS 9 HA CYS 9 3.781 4.909 -3.173
57 1HB CYS 9 2HB CYS 9 1.878 4.211 -1.902
58 2HB CYS 9 1HB CYS 9 1.999 3.062 -3.232
59 H ASN 10 H ASN 10 3.834 5.823 -0.924
60 HA ASN 10 HA ASN 10 6.262 4.887 0.518
61 1HB ASN 10 2HB ASN 10 5.567 7.312 -0.311
62 2HB ASN 10 1HB ASN 10 4.667 7.336 1.206
63 1HD2 ASN 10 1HD2 ASN 10 5.879 8.229 2.877
64 2HD2 ASN 10 2HD2 ASN 10 7.563 8.096 3.044
65 HA PRO 11 HA PRO 11 3.747 3.055 3.673
66 1HB PRO 11 2HB PRO 11 5.650 2.879 5.636
67 2HB PRO 11 1HB PRO 11 5.591 1.787 4.238
68 1HG PRO 11 2HG PRO 11 7.314 4.171 4.703
69 2HG PRO 11 1HG PRO 11 7.717 2.613 3.964
70 1HD PRO 11 2HD PRO 11 7.235 4.864 2.519
71 2HD PRO 11 1HD PRO 11 6.905 3.228 1.910
72 H SER 12 H SER 12 5.697 5.955 4.360
73 HA SER 12 HA SER 12 4.427 6.659 6.850
74 1HB SER 12 2HB SER 12 6.626 7.474 5.795
75 2HB SER 12 1HB SER 12 5.632 8.545 4.812
76 HG SER 12 HG SER 12 5.584 9.805 6.482
77 H ASN 13 H ASN 13 3.805 7.666 3.464
78 HA ASN 13 HA ASN 13 1.498 9.310 4.239
79 1HB ASN 13 2HB ASN 13 3.258 9.470 2.248
80 2HB ASN 13 1HB ASN 13 2.090 8.429 1.434
81 1HD2 ASN 13 1HD2 ASN 13 2.866 11.618 1.672
82 2HD2 ASN 13 2HD2 ASN 13 1.328 12.315 1.494
83 H ASP 14 H ASP 14 2.011 6.252 2.476
84 HA ASP 14 HA ASP 14 0.556 4.463 2.006
85 1HB ASP 14 2HB ASP 14 0.449 5.092 4.667
86 2HB ASP 14 1HB ASP 14 -1.255 5.209 4.229
87 H GLN 15 H GLN 15 -0.193 5.599 0.033
88 HA GLN 15 HA GLN 15 -2.929 6.804 0.292
89 1HB GLN 15 2HB GLN 15 -0.580 7.167 -1.555
90 2HB GLN 15 1HB GLN 15 -2.196 7.610 -2.105
91 1HG GLN 15 2HG GLN 15 -2.388 8.922 0.112
92 2HG GLN 15 1HG GLN 15 -0.637 8.738 0.220
93 1HE2 GLN 15 1HE2 GLN 15 0.574 10.316 -0.860
94 2HE2 GLN 15 2HE2 GLN 15 -0.030 11.334 -2.077
95 H CYS 16 H CYS 16 -2.492 3.900 0.251
96 HA CYS 16 HA CYS 16 -3.162 3.006 -2.482
97 1HB CYS 16 2HB CYS 16 -1.760 1.901 -0.485
98 2HB CYS 16 1HB CYS 16 -3.346 1.252 -0.068
99 H CYS 17 H CYS 17 -5.124 1.485 -2.676
100 HA CYS 17 HA CYS 17 -7.517 2.902 -1.741
101 1HB CYS 17 2HB CYS 17 -6.717 1.183 -3.866
102 2HB CYS 17 1HB CYS 17 -8.042 0.379 -3.026
103 H LYS 18 H LYS 18 -8.648 2.382 0.080
104 HA LYS 18 HA LYS 18 -7.847 0.112 1.754
105 1HB LYS 18 2HB LYS 18 -9.834 2.380 1.895
106 2HB LYS 18 1HB LYS 18 -9.836 1.106 3.114
107 1HG LYS 18 2HG LYS 18 -7.843 1.778 4.021
108 2HG LYS 18 1HG LYS 18 -7.189 2.292 2.466
109 1HD LYS 18 2HD LYS 18 -7.720 4.423 2.942
110 2HD LYS 18 1HD LYS 18 -9.420 3.972 3.068
111 1HE LYS 18 2HE LYS 18 -7.735 3.243 5.408
112 2HE LYS 18 1HE LYS 18 -8.016 4.978 5.164
113 1HZ LYS 18 1HZ LYS 18 -10.128 2.882 5.158
114 2HZ LYS 18 2HZ LYS 18 -10.377 4.551 4.956
115 3HZ LYS 18 3HZ LYS 18 -9.817 3.946 6.442
116 H SER 19 H SER 19 -10.345 0.752 -0.616
117 HA SER 19 HA SER 19 -12.358 -1.093 0.204
118 1HB SER 19 2HB SER 19 -12.377 0.712 -1.610
119 2HB SER 19 1HB SER 19 -11.527 -0.440 -2.635
120 HG SER 19 HG SER 19 -13.843 -0.486 -2.853
121 H SER 20 H SER 20 -9.347 -1.588 -1.634
122 HA SER 20 HA SER 20 -9.994 -4.477 -1.981
123 1HB SER 20 2HB SER 20 -8.400 -2.417 -3.320
124 2HB SER 20 1HB SER 20 -7.512 -3.925 -3.119
125 HG SER 20 HG SER 20 -8.893 -4.920 -4.404
126 H ASN 21 H ASN 21 -8.978 -2.949 0.609
127 HA ASN 21 HA ASN 21 -7.535 -3.440 2.406
128 1HB ASN 21 2HB ASN 21 -8.800 -5.667 1.601
129 2HB ASN 21 1HB ASN 21 -7.146 -6.176 1.263
130 1HD2 ASN 21 1HD2 ASN 21 -8.585 -4.217 3.950
131 2HD2 ASN 21 2HD2 ASN 21 -7.924 -5.178 5.184
132 H LEU 22 H LEU 22 -6.046 -1.981 0.847
133 HA LEU 22 HA LEU 22 -3.538 -3.542 0.299
134 1HB LEU 22 2HB LEU 22 -4.685 -1.103 -1.098
135 2HB LEU 22 1HB LEU 22 -3.157 -1.880 -1.507
136 HG LEU 22 HG LEU 22 -5.807 -3.337 -1.526
137 1HD1 LEU 22 1HD1 LEU 22 -5.915 -1.557 -3.183
138 2HD1 LEU 22 2HD1 LEU 22 -5.664 -3.094 -4.011
139 3HD1 LEU 22 3HD1 LEU 22 -4.313 -1.981 -3.789
140 1HD2 LEU 22 1HD2 LEU 22 -3.872 -4.800 -1.330
141 2HD2 LEU 22 2HD2 LEU 22 -3.048 -3.947 -2.635
142 3HD2 LEU 22 3HD2 LEU 22 -4.486 -4.909 -2.980
143 H VAL 23 H VAL 23 -1.709 -2.782 1.305
144 HA VAL 23 HA VAL 23 -1.779 -0.042 2.529
145 HB VAL 23 HB VAL 23 -0.525 -2.466 3.836
146 1HG1 VAL 23 1HG1 VAL 23 -0.932 0.362 4.474
147 2HG1 VAL 23 2HG1 VAL 23 0.183 -0.801 5.192
148 3HG1 VAL 23 3HG1 VAL 23 -1.485 -0.712 5.759
149 1HG2 VAL 23 1HG2 VAL 23 -2.818 -3.128 3.642
150 2HG2 VAL 23 2HG2 VAL 23 -3.390 -1.496 3.989
151 3HG2 VAL 23 3HG2 VAL 23 -2.657 -2.463 5.269
152 H CYS 24 H CYS 24 0.443 0.825 2.895
153 HA CYS 24 HA CYS 24 2.250 0.095 0.692
154 1HB CYS 24 2HB CYS 24 2.110 2.220 2.824
155 2HB CYS 24 1HB CYS 24 3.566 2.033 1.847
156 H SER 25 H SER 25 4.280 -0.870 0.911
157 HA SER 25 HA SER 25 4.828 -2.198 3.527
158 1HB SER 25 2HB SER 25 5.823 -2.648 0.696
159 2HB SER 25 1HB SER 25 6.280 -3.635 2.080
160 HG SER 25 HG SER 25 4.552 -4.632 1.133
161 H ARG 26 H ARG 26 7.323 -2.528 3.860
162 HA ARG 26 HA ARG 26 8.631 0.154 3.641
163 1HB ARG 26 2HB ARG 26 8.127 -1.155 5.841
164 2HB ARG 26 1HB ARG 26 9.493 -2.166 5.369
165 1HG ARG 26 2HG ARG 26 9.846 0.806 5.299
166 2HG ARG 26 1HG ARG 26 9.852 0.003 6.869
167 1HD ARG 26 2HD ARG 26 11.487 -1.379 4.837
168 2HD ARG 26 1HD ARG 26 12.069 0.244 5.255
169 HE ARG 26 HE ARG 26 11.871 -2.044 7.107
170 1HH1 ARG 26 1HH2 ARG 26 14.097 0.106 6.719
171 2HH1 ARG 26 2HH2 ARG 26 13.970 0.945 8.229
172 1HH2 ARG 26 2HH1 ARG 26 10.883 -0.427 9.038
173 2HH2 ARG 26 1HH1 ARG 26 12.148 0.642 9.544
174 H LYS 27 H LYS 27 9.452 -3.340 3.443
175 HA LYS 27 HA LYS 27 12.046 -2.910 2.231
176 1HB LYS 27 2HB LYS 27 10.159 -5.182 2.753
177 2HB LYS 27 1HB LYS 27 11.502 -5.452 1.641
178 1HG LYS 27 2HG LYS 27 12.742 -4.144 3.722
179 2HG LYS 27 1HG LYS 27 11.530 -5.109 4.565
180 1HD LYS 27 2HD LYS 27 13.274 -6.329 2.426
181 2HD LYS 27 1HD LYS 27 13.831 -6.206 4.094
182 1HE LYS 27 2HE LYS 27 12.694 -8.119 4.535
183 2HE LYS 27 1HE LYS 27 11.189 -7.229 4.235
184 1HZ LYS 27 1HZ LYS 27 11.439 -7.651 1.870
185 2HZ LYS 27 2HZ LYS 27 11.416 -9.120 2.723
186 3HZ LYS 27 3HZ LYS 27 12.885 -8.495 2.144
187 H HIS 28 H HIS 28 8.828 -3.750 0.920
188 HA HIS 28 HA HIS 28 9.853 -3.707 -1.856
189 1HB HIS 28 2HB HIS 28 7.120 -4.163 -0.614
190 2HB HIS 28 1HB HIS 28 7.477 -4.350 -2.331
191 HD1 HIS 28 HD1 HIS 28 10.079 -5.853 -2.346
192 HD2 HIS 28 HD2 HIS 28 7.040 -6.741 0.366
193 HE1 HIS 28 HE1 HIS 28 10.482 -8.230 -1.572
194 H ARG 29 H ARG 29 8.272 -1.545 0.385
195 HA ARG 29 HA ARG 29 7.412 0.636 0.141
196 1HB ARG 29 2HB ARG 29 9.552 0.308 -1.954
197 2HB ARG 29 1HB ARG 29 8.650 1.820 -1.860
198 1HG ARG 29 2HG ARG 29 9.499 2.365 0.224
199 2HG ARG 29 1HG ARG 29 9.766 0.681 0.672
200 1HD ARG 29 2HD ARG 29 11.361 1.861 -1.594
201 2HD ARG 29 1HD ARG 29 11.847 2.179 0.082
202 HE ARG 29 HE ARG 29 11.308 -0.637 -0.726
203 1HH1 ARG 29 2HH1 ARG 29 13.956 0.579 -1.692
204 2HH1 ARG 29 1HH1 ARG 29 15.026 0.077 -0.426
205 1HH2 ARG 29 1HH2 ARG 29 12.465 -0.736 1.775
206 2HH2 ARG 29 2HH2 ARG 29 14.180 -0.670 1.541
207 H TRP 30 H TRP 30 5.681 -1.302 -0.892
208 HA TRP 30 HA TRP 30 4.359 0.223 -3.066
209 1HB TRP 30 2HB TRP 30 4.292 -1.650 -4.555
210 2HB TRP 30 1HB TRP 30 5.955 -1.531 -4.001
211 HD1 TRP 30 HD1 TRP 30 4.782 -2.921 -1.057
212 HE1 TRP 30 HE1 TRP 30 4.703 -5.493 -1.047
213 HE3 TRP 30 HE3 TRP 30 4.997 -3.824 -6.076
214 HZ2 TRP 30 HZ2 TRP 30 4.732 -7.653 -2.920
215 HZ3 TRP 30 HZ3 TRP 30 4.972 -6.146 -6.935
216 HH2 TRP 30 HH2 TRP 30 4.840 -8.061 -5.365
217 H CYS 31 H CYS 31 2.190 -1.196 -3.607
218 HA CYS 31 HA CYS 31 0.747 -1.311 -1.048
219 1HB CYS 31 2HB CYS 31 0.101 -1.428 -3.980
220 2HB CYS 31 1HB CYS 31 -1.121 -1.914 -2.807
221 H LYS 32 H LYS 32 0.437 -3.169 0.089
222 HA LYS 32 HA LYS 32 0.865 -5.792 -1.305
223 1HB LYS 32 2HB LYS 32 1.563 -6.580 0.938
224 2HB LYS 32 1HB LYS 32 2.516 -5.185 0.434
225 1HG LYS 32 2HG LYS 32 1.688 -3.868 2.092
226 2HG LYS 32 1HG LYS 32 0.050 -4.489 1.895
227 1HD LYS 32 2HD LYS 32 0.447 -5.503 3.894
228 2HD LYS 32 1HD LYS 32 1.307 -6.688 2.912
229 1HE LYS 32 2HE LYS 32 2.918 -4.308 3.620
230 2HE LYS 32 1HE LYS 32 2.455 -5.327 4.996
231 1HZ LYS 32 1HZ LYS 32 3.236 -7.268 3.802
232 2HZ LYS 32 2HZ LYS 32 4.491 -6.131 3.930
233 3HZ LYS 32 3HZ LYS 32 3.658 -6.317 2.462
234 H TYR 33 H TYR 33 -0.465 -7.612 -0.358
235 HA TYR 33 HA TYR 33 -3.190 -6.627 0.421
236 1HB TYR 33 2HB TYR 33 -2.608 -7.885 -1.811
237 2HB TYR 33 1HB TYR 33 -2.575 -9.318 -0.784
238 HD1 TYR 33 HD1 TYR 33 -4.632 -9.646 0.815
239 HD2 TYR 33 HD2 TYR 33 -4.649 -7.122 -2.663
240 HE1 TYR 33 HE1 TYR 33 -7.109 -9.733 0.762
241 HE2 TYR 33 HE2 TYR 33 -7.125 -7.211 -2.714
242 HH TYR 33 HH TYR 33 -8.989 -7.775 -0.509
243 H GLU 34 H GLU 34 -3.000 -6.747 2.697
244 HA GLU 34 HA GLU 34 -1.764 -8.952 4.104
245 1HB GLU 34 2HB GLU 34 -2.903 -7.898 6.060
246 2HB GLU 34 1HB GLU 34 -2.057 -6.713 5.070
247 1HG GLU 34 2HG GLU 34 -3.978 -5.575 4.799
248 2HG GLU 34 1HG GLU 34 -4.695 -6.981 4.016
249 H ILE 35 H ILE 35 -2.650 -10.899 4.729
250 HA ILE 35 HA ILE 35 -4.164 -12.700 4.797
251 HB ILE 35 HB ILE 35 -6.087 -10.401 5.299
252 1HG1 ILE 35 2HG1 ILE 35 -4.150 -10.249 6.789
253 2HG1 ILE 35 1HG1 ILE 35 -5.549 -10.809 7.702
254 1HG2 ILE 35 1HG2 ILE 35 -7.418 -12.326 5.065
255 2HG2 ILE 35 2HG2 ILE 35 -7.119 -12.265 6.801
256 3HG2 ILE 35 3HG2 ILE 35 -6.196 -13.373 5.786
257 1HD1 ILE 35 1HD1 ILE 35 -4.424 -13.168 6.763
258 2HD1 ILE 35 2HD1 ILE 35 -4.230 -12.515 8.389
259 3HD1 ILE 35 3HD1 ILE 35 -3.019 -12.177 7.153
260 1HN NH2 36 1HN NH2 36 -7.213 -11.910 3.420
261 2HN NH2 36 2HN NH2 36 -6.599 -13.196 2.527