Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | in_recoord | stage | position | program | type |
|
|
4987 | 1g6m RC | 4891 | cing | recoord | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 1H LEU 1 1HT LEU 1 2.434 13.493 0.655
2 2H LEU 1 2HT LEU 1 1.308 13.104 1.891
3 3H LEU 1 3HT LEU 1 0.877 14.209 0.649
4 HA LEU 1 HA LEU 1 0.793 12.580 -0.949
5 1HB LEU 1 2HB LEU 1 2.897 11.519 0.387
6 2HB LEU 1 1HB LEU 1 1.639 10.386 0.843
7 HG LEU 1 HG LEU 1 1.165 10.248 -1.707
8 1HD1 LEU 1 1HD1 LEU 1 3.608 10.480 -2.769
9 2HD1 LEU 1 2HD1 LEU 1 3.683 11.787 -1.587
10 3HD1 LEU 1 3HD1 LEU 1 2.413 11.776 -2.810
11 1HD2 LEU 1 1HD2 LEU 1 2.368 8.306 -1.766
12 2HD2 LEU 1 2HD2 LEU 1 2.371 8.610 -0.029
13 3HD2 LEU 1 3HD2 LEU 1 3.783 9.028 -0.999
14 H GLU 2 H GLU 2 -1.232 11.899 -1.233
15 HA GLU 2 HA GLU 2 -2.726 10.943 1.120
16 1HB GLU 2 2HB GLU 2 -3.821 12.501 -1.228
17 2HB GLU 2 1HB GLU 2 -4.738 11.948 0.166
18 1HG GLU 2 2HG GLU 2 -3.201 13.360 1.584
19 2HG GLU 2 1HG GLU 2 -2.602 14.057 0.073
20 H CYS 3 H CYS 3 -2.329 8.765 0.687
21 HA CYS 3 HA CYS 3 -3.197 7.700 -1.890
22 1HB CYS 3 2HB CYS 3 -1.975 6.204 0.437
23 2HB CYS 3 1HB CYS 3 -2.155 5.630 -1.222
24 H HIS 4 H HIS 4 -4.135 5.259 -1.363
25 HA HIS 4 HA HIS 4 -6.729 5.813 -0.217
26 1HB HIS 4 2HB HIS 4 -5.548 3.492 -1.732
27 2HB HIS 4 1HB HIS 4 -7.149 3.410 -1.001
28 HD1 HIS 4 1HD HIS 4 -8.937 5.156 -1.952
29 HD2 HIS 4 2HD HIS 4 -5.436 4.759 -4.154
30 HE1 HIS 4 1HE HIS 4 -9.437 6.172 -4.198
31 HE2 HIS 4 2HE HIS 4 -7.333 5.836 -5.543
32 H ASN 5 H ASN 5 -7.604 4.862 1.590
33 HA ASN 5 HA ASN 5 -5.703 3.418 3.309
34 1HB ASN 5 2HB ASN 5 -7.287 4.150 5.169
35 2HB ASN 5 1HB ASN 5 -6.356 5.429 4.391
36 1HD2 ASN 5 1HD2 ASN 5 -8.281 6.399 5.661
37 2HD2 ASN 5 2HD2 ASN 5 -9.649 6.782 4.675
38 H GLN 6 H GLN 6 -8.948 3.378 1.980
39 HA GLN 6 HA GLN 6 -9.873 1.125 3.439
40 1HB GLN 6 2HB GLN 6 -11.180 2.921 2.038
41 2HB GLN 6 1HB GLN 6 -10.912 1.790 0.711
42 1HG GLN 6 2HG GLN 6 -12.986 1.174 1.509
43 2HG GLN 6 1HG GLN 6 -11.906 0.030 2.305
44 1HE2 GLN 6 1HE2 GLN 6 -14.047 2.708 2.706
45 2HE2 GLN 6 2HE2 GLN 6 -14.080 2.699 4.433
46 H GLN 7 H GLN 7 -10.209 -1.021 2.685
47 HA GLN 7 HA GLN 7 -8.622 -1.842 0.363
48 1HB GLN 7 2HB GLN 7 -7.818 -3.822 1.770
49 2HB GLN 7 1HB GLN 7 -7.063 -2.257 2.074
50 1HG GLN 7 2HG GLN 7 -7.734 -2.242 4.188
51 2HG GLN 7 1HG GLN 7 -9.387 -2.669 3.746
52 1HE2 GLN 7 1HE2 GLN 7 -6.628 -3.676 5.306
53 2HE2 GLN 7 2HE2 GLN 7 -6.990 -5.360 5.438
54 H SER 8 H SER 8 -9.113 -4.056 -0.349
55 HA SER 8 HA SER 8 -10.599 -5.630 -1.043
56 1HB SER 8 2HB SER 8 -11.714 -6.855 0.610
57 2HB SER 8 1HB SER 8 -10.383 -6.118 1.499
58 HG SER 8 HG SER 8 -11.884 -5.335 2.733
59 H SER 9 H SER 9 -11.215 -2.824 -1.479
60 HA SER 9 HA SER 9 -14.105 -3.101 -1.901
61 1HB SER 9 2HB SER 9 -13.623 -1.620 0.088
62 2HB SER 9 1HB SER 9 -12.822 -0.509 -1.022
63 HG SER 9 HG SER 9 -14.734 0.256 -1.385
64 H GLN 10 H GLN 10 -14.939 -1.690 -3.610
65 HA GLN 10 HA GLN 10 -13.085 -1.591 -5.824
66 1HB GLN 10 2HB GLN 10 -16.029 -1.370 -5.477
67 2HB GLN 10 1HB GLN 10 -15.326 -0.572 -6.883
68 1HG GLN 10 2HG GLN 10 -14.217 -3.181 -6.688
69 2HG GLN 10 1HG GLN 10 -15.969 -3.305 -6.533
70 1HE2 GLN 10 1HE2 GLN 10 -17.227 -3.018 -8.286
71 2HE2 GLN 10 2HE2 GLN 10 -16.625 -2.663 -9.875
72 H THR 11 H THR 11 -15.202 0.765 -4.193
73 HA THR 11 HA THR 11 -13.600 2.898 -5.324
74 HB THR 11 HB THR 11 -15.857 3.237 -5.907
75 HG1 THR 11 1HG THR 11 -15.517 4.779 -3.557
76 1HG2 THR 11 1HG2 THR 11 -17.647 3.378 -4.144
77 2HG2 THR 11 2HG2 THR 11 -16.517 2.568 -3.058
78 3HG2 THR 11 3HG2 THR 11 -17.060 1.760 -4.529
79 HA PRO 12 HA PRO 12 -12.323 2.779 -0.868
80 1HB PRO 12 2HB PRO 12 -9.709 3.330 -1.333
81 2HB PRO 12 1HB PRO 12 -10.368 1.691 -1.398
82 1HG PRO 12 2HG PRO 12 -9.782 3.590 -3.641
83 2HG PRO 12 1HG PRO 12 -9.441 1.849 -3.529
84 1HD PRO 12 2HD PRO 12 -11.560 2.829 -4.897
85 2HD PRO 12 1HD PRO 12 -11.610 1.263 -4.057
86 H THR 13 H THR 13 -10.946 4.504 0.307
87 HA THR 13 HA THR 13 -11.596 7.146 -0.830
88 HB THR 13 HB THR 13 -11.437 7.702 1.789
89 HG1 THR 13 1HG THR 13 -12.485 5.070 1.722
90 1HG2 THR 13 1HG2 THR 13 -13.890 6.512 0.517
91 2HG2 THR 13 2HG2 THR 13 -13.380 8.197 0.404
92 3HG2 THR 13 3HG2 THR 13 -13.846 7.520 1.964
93 H THR 14 H THR 14 -10.165 8.902 -0.269
94 HA THR 14 HA THR 14 -7.394 7.982 0.021
95 HB THR 14 HB THR 14 -6.742 10.082 -1.016
96 HG1 THR 14 1HG THR 14 -9.511 10.689 -1.035
97 1HG2 THR 14 1HG2 THR 14 -7.771 9.897 -3.204
98 2HG2 THR 14 2HG2 THR 14 -9.040 8.871 -2.534
99 3HG2 THR 14 3HG2 THR 14 -7.370 8.305 -2.560
100 H THR 15 H THR 15 -5.930 9.103 1.384
101 HA THR 15 HA THR 15 -6.874 11.111 3.210
102 HB THR 15 HB THR 15 -7.821 9.190 4.323
103 HG1 THR 15 1HG THR 15 -6.858 10.687 5.704
104 1HG2 THR 15 1HG2 THR 15 -6.736 7.286 3.614
105 2HG2 THR 15 2HG2 THR 15 -6.143 7.474 5.265
106 3HG2 THR 15 3HG2 THR 15 -5.134 7.964 3.904
107 H GLY 16 H GLY 16 -5.211 12.343 3.892
108 1HA GLY 16 2HA GLY 16 -2.595 11.734 2.941
109 2HA GLY 16 1HA GLY 16 -3.076 13.191 3.782
110 H CYS 17 H CYS 17 -0.816 11.120 4.051
111 HA CYS 17 HA CYS 17 -1.224 10.214 6.788
112 1HB CYS 17 2HB CYS 17 1.059 9.815 4.844
113 2HB CYS 17 1HB CYS 17 1.030 9.161 6.483
114 H SER 18 H SER 18 0.767 10.480 8.267
115 HA SER 18 HA SER 18 1.994 13.122 7.964
116 1HB SER 18 2HB SER 18 -0.079 12.445 9.865
117 2HB SER 18 1HB SER 18 1.400 12.912 10.702
118 HG SER 18 HG SER 18 0.469 14.815 10.324
119 H GLY 19 H GLY 19 3.449 13.385 10.152
120 1HA GLY 19 2HA GLY 19 5.110 12.461 11.515
121 2HA GLY 19 1HA GLY 19 4.756 10.880 10.835
122 H GLY 20 H GLY 20 5.619 10.371 8.726
123 1HA GLY 20 2HA GLY 20 7.336 12.023 7.289
124 2HA GLY 20 1HA GLY 20 8.292 11.085 8.430
125 H GLU 21 H GLU 21 5.373 10.033 6.754
126 HA GLU 21 HA GLU 21 6.998 7.984 5.396
127 1HB GLU 21 2HB GLU 21 5.093 7.458 7.196
128 2HB GLU 21 1HB GLU 21 4.071 7.588 5.764
129 1HG GLU 21 2HG GLU 21 4.716 5.603 5.005
130 2HG GLU 21 1HG GLU 21 6.419 5.954 5.292
131 H ASN 22 H ASN 22 7.319 8.674 3.370
132 HA ASN 22 HA ASN 22 5.062 9.866 1.912
133 1HB ASN 22 2HB ASN 22 8.039 9.957 1.399
134 2HB ASN 22 1HB ASN 22 6.837 10.593 0.281
135 1HD2 ASN 22 1HD2 ASN 22 8.992 11.570 2.393
136 2HD2 ASN 22 2HD2 ASN 22 8.213 12.960 3.061
137 H ASN 23 H ASN 23 5.446 6.978 2.415
138 HA ASN 23 HA ASN 23 5.340 6.111 -0.383
139 1HB ASN 23 2HB ASN 23 6.944 4.803 1.820
140 2HB ASN 23 1HB ASN 23 6.552 4.003 0.295
141 1HD2 ASN 23 1HD2 ASN 23 8.801 5.816 1.903
142 2HD2 ASN 23 2HD2 ASN 23 9.707 6.405 0.544
143 H CYS 24 H CYS 24 3.655 4.820 -0.821
144 HA CYS 24 HA CYS 24 2.157 3.712 1.462
145 1HB CYS 24 2HB CYS 24 1.016 4.527 -1.217
146 2HB CYS 24 1HB CYS 24 0.117 4.018 0.216
147 H TYR 25 H TYR 25 2.267 1.584 1.575
148 HA TYR 25 HA TYR 25 3.144 0.008 -0.616
149 1HB TYR 25 2HB TYR 25 3.196 -1.811 0.942
150 2HB TYR 25 1HB TYR 25 3.829 -0.381 1.752
151 HD1 TYR 25 1HD TYR 25 2.388 0.825 3.400
152 HD2 TYR 25 2HD TYR 25 1.264 -2.935 1.750
153 HE1 TYR 25 1HE TYR 25 0.759 0.521 5.216
154 HE2 TYR 25 2HE TYR 25 -0.370 -3.245 3.562
155 HH TYR 25 HH TYR 25 -1.359 -0.766 5.595
156 H LYS 26 H LYS 26 1.970 -2.222 -0.830
157 HA LYS 26 HA LYS 26 -0.895 -2.165 -0.666
158 1HB LYS 26 2HB LYS 26 -0.034 -0.869 -2.834
159 2HB LYS 26 1HB LYS 26 0.077 -2.512 -3.463
160 1HG LYS 26 2HG LYS 26 -2.414 -2.459 -2.296
161 2HG LYS 26 1HG LYS 26 -2.256 -0.843 -2.987
162 1HD LYS 26 2HD LYS 26 -1.299 -2.385 -5.012
163 2HD LYS 26 1HD LYS 26 -2.519 -3.451 -4.314
164 1HE LYS 26 2HE LYS 26 -3.914 -1.165 -4.371
165 2HE LYS 26 1HE LYS 26 -2.828 -0.870 -5.728
166 1HZ LYS 26 1HZ LYS 26 -3.566 -3.276 -6.377
167 2HZ LYS 26 2HZ LYS 26 -4.534 -1.944 -6.766
168 3HZ LYS 26 3HZ LYS 26 -4.917 -2.905 -5.428
169 H LYS 27 H LYS 27 -0.430 -4.052 0.549
170 HA LYS 27 HA LYS 27 0.902 -6.267 -0.726
171 1HB LYS 27 2HB LYS 27 0.536 -7.402 1.395
172 2HB LYS 27 1HB LYS 27 1.231 -5.814 1.654
173 1HG LYS 27 2HG LYS 27 -1.303 -5.137 1.927
174 2HG LYS 27 1HG LYS 27 -1.467 -6.847 2.335
175 1HD LYS 27 2HD LYS 27 0.576 -5.048 3.620
176 2HD LYS 27 1HD LYS 27 -1.048 -5.273 4.273
177 1HE LYS 27 2HE LYS 27 0.746 -7.603 3.674
178 2HE LYS 27 1HE LYS 27 0.843 -6.735 5.206
179 1HZ LYS 27 1HZ LYS 27 -0.651 -8.365 5.718
180 2HZ LYS 27 2HZ LYS 27 -1.311 -8.430 4.162
181 3HZ LYS 27 3HZ LYS 27 -1.719 -7.158 5.199
182 H GLU 28 H GLU 28 -0.008 -8.022 -1.621
183 HA GLU 28 HA GLU 28 -2.942 -8.246 -1.540
184 1HB GLU 28 2HB GLU 28 -2.332 -9.475 -3.867
185 2HB GLU 28 1HB GLU 28 -2.779 -7.776 -3.751
186 1HG GLU 28 2HG GLU 28 -0.361 -7.218 -3.625
187 2HG GLU 28 1HG GLU 28 0.001 -8.920 -3.913
188 H TRP 29 H TRP 29 -3.727 -10.156 -0.875
189 HA TRP 29 HA TRP 29 -1.902 -12.465 -0.848
190 1HB TRP 29 2HB TRP 29 -2.801 -13.185 1.275
191 2HB TRP 29 1HB TRP 29 -2.224 -11.534 1.438
192 HD1 TRP 29 HD TRP 29 -5.102 -13.637 2.152
193 HE1 TRP 29 1HE TRP 29 -7.138 -12.230 2.874
194 HE3 TRP 29 3HE TRP 29 -3.413 -9.035 0.756
195 HZ2 TRP 29 2HZ TRP 29 -7.910 -9.512 2.856
196 HZ3 TRP 29 3HZ TRP 29 -4.852 -7.079 1.146
197 HH2 TRP 29 HH TRP 29 -7.053 -7.311 2.173
198 H ARG 30 H ARG 30 -2.703 -14.382 -1.535
199 HA ARG 30 HA ARG 30 -5.446 -14.352 -2.568
200 1HB ARG 30 2HB ARG 30 -4.489 -16.454 -3.815
201 2HB ARG 30 1HB ARG 30 -4.136 -14.832 -4.400
202 1HG ARG 30 2HG ARG 30 -1.940 -14.949 -3.796
203 2HG ARG 30 1HG ARG 30 -2.248 -16.071 -2.468
204 1HD ARG 30 2HD ARG 30 -2.331 -17.914 -3.878
205 2HD ARG 30 1HD ARG 30 -2.659 -16.931 -5.304
206 HE ARG 30 HE ARG 30 -0.187 -16.131 -4.584
207 1HH1 ARG 30 1HH1 ARG 30 -1.588 -19.283 -5.115
208 2HH1 ARG 30 2HH1 ARG 30 -0.100 -19.994 -5.640
209 1HH2 ARG 30 1HH2 ARG 30 1.772 -17.066 -5.275
210 2HH2 ARG 30 2HH2 ARG 30 1.807 -18.737 -5.731
211 H ASP 31 H ASP 31 -6.637 -16.405 -2.516
212 HA ASP 31 HA ASP 31 -6.008 -17.970 -0.097
213 1HB ASP 31 2HB ASP 31 -8.442 -18.260 0.219
214 2HB ASP 31 1HB ASP 31 -7.966 -16.560 0.278
215 H ASN 32 H ASN 32 -7.497 -18.015 -3.302
216 HA ASN 32 HA ASN 32 -6.425 -20.515 -3.995
217 1HB ASN 32 2HB ASN 32 -8.671 -20.762 -2.347
218 2HB ASN 32 1HB ASN 32 -9.276 -21.060 -3.974
219 1HD2 ASN 32 1HD2 ASN 32 -8.424 -22.660 -1.415
220 2HD2 ASN 32 2HD2 ASN 32 -7.614 -24.025 -2.097
221 H ARG 33 H ARG 33 -9.699 -19.277 -4.637
222 HA ARG 33 HA ARG 33 -9.063 -19.162 -7.465
223 1HB ARG 33 2HB ARG 33 -11.495 -18.793 -7.729
224 2HB ARG 33 1HB ARG 33 -11.113 -20.284 -6.877
225 1HG ARG 33 2HG ARG 33 -11.371 -18.464 -4.847
226 2HG ARG 33 1HG ARG 33 -12.600 -17.941 -5.998
227 1HD ARG 33 2HD ARG 33 -13.756 -19.478 -4.713
228 2HD ARG 33 1HD ARG 33 -13.230 -20.454 -6.083
229 HE ARG 33 HE ARG 33 -11.851 -21.642 -4.680
230 1HH1 ARG 33 1HH1 ARG 33 -13.033 -18.812 -3.013
231 2HH1 ARG 33 2HH1 ARG 33 -12.453 -19.328 -1.466
232 1HH2 ARG 33 1HH2 ARG 33 -11.088 -22.321 -2.645
233 2HH2 ARG 33 2HH2 ARG 33 -11.348 -21.319 -1.257
234 H GLY 34 H GLY 34 -9.916 -17.060 -4.788
235 1HA GLY 34 2HA GLY 34 -9.514 -14.739 -6.576
236 2HA GLY 34 1HA GLY 34 -10.663 -14.734 -5.247
237 H TYR 35 H TYR 35 -9.055 -12.696 -5.155
238 HA TYR 35 HA TYR 35 -7.471 -13.165 -2.804
239 1HB TYR 35 2HB TYR 35 -5.380 -12.198 -3.792
240 2HB TYR 35 1HB TYR 35 -5.798 -13.793 -4.408
241 HD1 TYR 35 1HD TYR 35 -6.331 -10.187 -5.241
242 HD2 TYR 35 2HD TYR 35 -5.708 -14.140 -6.687
243 HE1 TYR 35 1HE TYR 35 -6.227 -9.323 -7.541
244 HE2 TYR 35 2HE TYR 35 -5.602 -13.287 -8.990
245 HH TYR 35 HH TYR 35 -6.351 -11.350 -10.274
246 H ARG 36 H ARG 36 -6.766 -11.204 -1.785
247 HA ARG 36 HA ARG 36 -8.101 -8.790 -2.821
248 1HB ARG 36 2HB ARG 36 -8.560 -10.178 -0.366
249 2HB ARG 36 1HB ARG 36 -7.847 -8.610 0.009
250 1HG ARG 36 2HG ARG 36 -9.708 -7.509 -0.535
251 2HG ARG 36 1HG ARG 36 -9.958 -8.465 -1.997
252 1HD ARG 36 2HD ARG 36 -11.804 -8.817 -0.495
253 2HD ARG 36 1HD ARG 36 -10.854 -10.296 -0.597
254 HE ARG 36 HE ARG 36 -10.983 -8.464 1.690
255 1HH1 ARG 36 1HH1 ARG 36 -9.889 -11.491 0.318
256 2HH1 ARG 36 2HH1 ARG 36 -9.463 -12.168 1.851
257 1HH2 ARG 36 1HH2 ARG 36 -10.417 -9.362 3.697
258 2HH2 ARG 36 2HH2 ARG 36 -9.761 -10.964 3.767
259 H THR 37 H THR 37 -7.206 -6.826 -1.335
260 HA THR 37 HA THR 37 -4.397 -7.023 -0.747
261 HB THR 37 HB THR 37 -4.391 -6.853 -3.216
262 HG1 THR 37 1HG THR 37 -3.453 -4.476 -1.996
263 1HG2 THR 37 1HG2 THR 37 -5.661 -5.454 -4.350
264 2HG2 THR 37 2HG2 THR 37 -4.986 -4.079 -3.477
265 3HG2 THR 37 3HG2 THR 37 -6.394 -4.926 -2.836
266 H GLU 38 H GLU 38 -3.688 -5.375 0.557
267 HA GLU 38 HA GLU 38 -5.610 -3.216 1.103
268 1HB GLU 38 2HB GLU 38 -4.239 -3.364 3.424
269 2HB GLU 38 1HB GLU 38 -5.756 -4.196 3.134
270 1HG GLU 38 2HG GLU 38 -4.762 -6.242 2.982
271 2HG GLU 38 1HG GLU 38 -3.226 -5.582 2.426
272 H ARG 39 H ARG 39 -4.751 -1.180 1.654
273 HA ARG 39 HA ARG 39 -1.952 -0.804 0.814
274 1HB ARG 39 2HB ARG 39 -3.858 1.480 0.747
275 2HB ARG 39 1HB ARG 39 -2.504 1.116 -0.312
276 1HG ARG 39 2HG ARG 39 -4.193 0.704 -1.758
277 2HG ARG 39 1HG ARG 39 -4.090 -0.894 -1.015
278 1HD ARG 39 2HD ARG 39 -5.790 0.217 0.694
279 2HD ARG 39 1HD ARG 39 -6.148 1.226 -0.706
280 HE ARG 39 HE ARG 39 -6.791 -1.561 -0.357
281 1HH1 ARG 39 1HH1 ARG 39 -6.309 1.016 -2.663
282 2HH1 ARG 39 2HH1 ARG 39 -7.273 0.265 -3.891
283 1HH2 ARG 39 1HH2 ARG 39 -8.057 -2.549 -1.972
284 2HH2 ARG 39 2HH2 ARG 39 -8.265 -1.758 -3.498
285 H GLY 40 H GLY 40 -1.538 1.774 1.604
286 1HA GLY 40 2HA GLY 40 -2.289 2.782 3.976
287 2HA GLY 40 1HA GLY 40 -1.273 1.431 4.474
288 H CYS 41 H CYS 41 0.059 3.089 5.480
289 HA CYS 41 HA CYS 41 1.849 4.381 3.528
290 1HB CYS 41 2HB CYS 41 0.499 5.452 5.912
291 2HB CYS 41 1HB CYS 41 2.222 5.827 5.826
292 H GLY 42 H GLY 42 3.893 3.720 3.584
293 1HA GLY 42 2HA GLY 42 5.880 3.407 5.033
294 2HA GLY 42 1HA GLY 42 4.856 2.405 6.051
295 H CYS 43 H CYS 43 7.371 2.051 4.246
296 HA CYS 43 HA CYS 43 6.405 -0.315 2.786
297 1HB CYS 43 2HB CYS 43 7.581 1.539 1.505
298 2HB CYS 43 1HB CYS 43 9.047 1.081 2.366
299 HA PRO 44 HA PRO 44 8.694 -2.148 6.322
300 1HB PRO 44 2HB PRO 44 7.274 -4.465 6.340
301 2HB PRO 44 1HB PRO 44 6.725 -2.991 7.155
302 1HG PRO 44 2HG PRO 44 5.924 -4.094 4.488
303 2HG PRO 44 1HG PRO 44 4.907 -3.390 5.759
304 1HD PRO 44 2HD PRO 44 5.662 -1.996 3.567
305 2HD PRO 44 1HD PRO 44 5.425 -1.226 5.150
306 H SER 45 H SER 45 10.213 -3.826 6.378
307 HA SER 45 HA SER 45 10.809 -5.014 3.752
308 1HB SER 45 2HB SER 45 12.530 -3.965 5.951
309 2HB SER 45 1HB SER 45 13.141 -5.319 5.000
310 HG SER 45 HG SER 45 13.698 -3.220 4.158
311 H VAL 46 H VAL 46 8.907 -6.315 5.178
312 HA VAL 46 HA VAL 46 10.114 -8.421 6.749
313 HB VAL 46 HB VAL 46 7.724 -9.315 6.732
314 1HG1 VAL 46 1HG1 VAL 46 6.970 -7.605 8.376
315 2HG1 VAL 46 2HG1 VAL 46 8.362 -6.625 7.918
316 3HG1 VAL 46 3HG1 VAL 46 8.604 -8.206 8.662
317 1HG2 VAL 46 1HG2 VAL 46 7.121 -7.929 4.689
318 2HG2 VAL 46 2HG2 VAL 46 7.020 -6.555 5.791
319 3HG2 VAL 46 3HG2 VAL 46 5.957 -7.944 6.013
320 H LYS 47 H LYS 47 9.055 -10.707 6.187
321 HA LYS 47 HA LYS 47 9.313 -11.187 3.301
322 1HB LYS 47 2HB LYS 47 10.597 -13.289 3.879
323 2HB LYS 47 1HB LYS 47 11.463 -11.777 4.113
324 1HG LYS 47 2HG LYS 47 11.454 -11.961 6.395
325 2HG LYS 47 1HG LYS 47 9.998 -12.956 6.418
326 1HD LYS 47 2HD LYS 47 11.345 -14.713 6.695
327 2HD LYS 47 1HD LYS 47 11.834 -14.488 5.015
328 1HE LYS 47 2HE LYS 47 13.165 -12.915 7.179
329 2HE LYS 47 1HE LYS 47 13.634 -14.591 6.900
330 1HZ LYS 47 1HZ LYS 47 15.038 -13.643 5.444
331 2HZ LYS 47 2HZ LYS 47 14.112 -12.239 5.271
332 3HZ LYS 47 3HZ LYS 47 13.692 -13.637 4.417
333 H LYS 48 H LYS 48 7.563 -12.185 2.581
334 HA LYS 48 HA LYS 48 6.457 -14.462 3.939
335 1HB LYS 48 2HB LYS 48 5.023 -11.828 3.931
336 2HB LYS 48 1HB LYS 48 4.108 -13.329 3.888
337 1HG LYS 48 2HG LYS 48 5.440 -14.008 5.950
338 2HG LYS 48 1HG LYS 48 5.931 -12.315 6.042
339 1HD LYS 48 2HD LYS 48 4.071 -12.106 7.298
340 2HD LYS 48 1HD LYS 48 3.259 -12.041 5.733
341 1HE LYS 48 2HE LYS 48 3.735 -14.756 6.712
342 2HE LYS 48 1HE LYS 48 2.681 -13.798 7.750
343 1HZ LYS 48 1HZ LYS 48 1.059 -13.746 6.209
344 2HZ LYS 48 2HZ LYS 48 1.808 -15.156 5.651
345 3HZ LYS 48 3HZ LYS 48 2.129 -13.675 4.899
346 H GLY 49 H GLY 49 4.753 -15.509 2.687
347 1HA GLY 49 2HA GLY 49 5.342 -15.595 -0.059
348 2HA GLY 49 1HA GLY 49 3.931 -16.326 0.705
349 H ILE 50 H ILE 50 3.071 -13.654 1.728
350 HA ILE 50 HA ILE 50 1.367 -12.966 -0.427
351 HB ILE 50 HB ILE 50 1.948 -11.312 2.031
352 1HG1 ILE 50 2HG1 ILE 50 -0.060 -13.538 1.600
353 2HG1 ILE 50 1HG1 ILE 50 1.321 -13.568 2.699
354 1HG2 ILE 50 1HG2 ILE 50 0.719 -10.243 0.113
355 2HG2 ILE 50 2HG2 ILE 50 -0.148 -10.269 1.649
356 3HG2 ILE 50 3HG2 ILE 50 -0.565 -11.422 0.381
357 1HD1 ILE 50 1HD1 ILE 50 -0.210 -12.999 4.228
358 2HD1 ILE 50 2HD1 ILE 50 -1.332 -12.366 3.023
359 3HD1 ILE 50 3HD1 ILE 50 0.014 -11.373 3.583
360 H GLY 51 H GLY 51 1.377 -11.231 -1.819
361 1HA GLY 51 2HA GLY 51 3.925 -10.194 -2.557
362 2HA GLY 51 1HA GLY 51 2.378 -9.728 -3.248
363 H ILE 52 H ILE 52 4.780 -8.154 -2.380
364 HA ILE 52 HA ILE 52 3.286 -6.145 -0.873
365 HB ILE 52 HB ILE 52 4.576 -7.384 0.811
366 1HG1 ILE 52 2HG1 ILE 52 6.110 -4.857 0.668
367 2HG1 ILE 52 1HG1 ILE 52 4.354 -4.692 0.565
368 1HG2 ILE 52 1HG2 ILE 52 6.397 -8.040 -0.809
369 2HG2 ILE 52 2HG2 ILE 52 6.935 -7.536 0.794
370 3HG2 ILE 52 3HG2 ILE 52 7.070 -6.427 -0.571
371 1HD1 ILE 52 1HD1 ILE 52 4.441 -6.290 2.661
372 2HD1 ILE 52 2HD1 ILE 52 4.638 -4.543 2.814
373 3HD1 ILE 52 3HD1 ILE 52 6.054 -5.596 2.820
374 H ASN 53 H ASN 53 3.426 -4.262 -1.882
375 HA ASN 53 HA ASN 53 5.899 -3.601 -3.328
376 1HB ASN 53 2HB ASN 53 4.548 -2.564 -5.121
377 2HB ASN 53 1HB ASN 53 4.252 -4.301 -4.989
378 1HD2 ASN 53 1HD2 ASN 53 2.215 -4.836 -5.167
379 2HD2 ASN 53 2HD2 ASN 53 0.857 -3.883 -4.688
380 H CYS 54 H CYS 54 6.037 -1.220 -3.818
381 HA CYS 54 HA CYS 54 4.537 0.473 -1.981
382 1HB CYS 54 2HB CYS 54 7.561 0.453 -1.977
383 2HB CYS 54 1HB CYS 54 6.504 1.437 -0.962
384 H CYS 55 H CYS 55 4.246 2.519 -2.711
385 HA CYS 55 HA CYS 55 5.753 3.348 -5.097
386 1HB CYS 55 2HB CYS 55 3.465 4.504 -5.711
387 2HB CYS 55 1HB CYS 55 3.767 2.820 -6.141
388 H THR 56 H THR 56 5.234 5.787 -5.549
389 HA THR 56 HA THR 56 4.977 7.282 -3.047
390 HB THR 56 HB THR 56 7.356 6.958 -3.249
391 HG1 THR 56 1HG THR 56 6.577 9.085 -2.698
392 1HG2 THR 56 1HG2 THR 56 8.536 8.017 -5.244
393 2HG2 THR 56 2HG2 THR 56 6.987 7.869 -6.075
394 3HG2 THR 56 3HG2 THR 56 7.805 6.428 -5.469
395 H THR 57 H THR 57 2.899 7.456 -4.470
396 HA THR 57 HA THR 57 2.956 10.098 -5.619
397 HB THR 57 HB THR 57 3.457 9.091 -7.659
398 HG1 THR 57 1HG THR 57 1.484 9.115 -8.830
399 1HG2 THR 57 1HG2 THR 57 1.404 6.964 -7.566
400 2HG2 THR 57 2HG2 THR 57 2.891 6.713 -6.652
401 3HG2 THR 57 3HG2 THR 57 2.963 7.008 -8.389
402 H ASP 58 H ASP 58 0.727 10.839 -6.213
403 HA ASP 58 HA ASP 58 -1.047 10.344 -4.096
404 1HB ASP 58 2HB ASP 58 -2.664 11.668 -5.543
405 2HB ASP 58 1HB ASP 58 -1.153 12.468 -5.137
406 H ARG 59 H ARG 59 -2.646 8.922 -3.817
407 HA ARG 59 HA ARG 59 -3.936 7.070 -4.138
408 1HB ARG 59 2HB ARG 59 -4.354 8.348 -6.847
409 2HB ARG 59 1HB ARG 59 -5.381 7.118 -6.124
410 1HG ARG 59 2HG ARG 59 -5.967 8.654 -4.321
411 2HG ARG 59 1HG ARG 59 -4.926 9.892 -5.037
412 1HD ARG 59 2HD ARG 59 -7.116 10.413 -5.739
413 2HD ARG 59 1HD ARG 59 -6.332 9.660 -7.134
414 HE ARG 59 HE ARG 59 -7.795 7.806 -5.497
415 1HH1 ARG 59 1HH1 ARG 59 -8.026 10.097 -8.119
416 2HH1 ARG 59 2HH1 ARG 59 -9.436 9.361 -8.803
417 1HH2 ARG 59 1HH2 ARG 59 -9.649 6.836 -6.396
418 2HH2 ARG 59 2HH2 ARG 59 -10.358 7.509 -7.826
419 H CYS 60 H CYS 60 -1.131 6.804 -4.793
420 HA CYS 60 HA CYS 60 -0.759 5.347 -7.174
421 1HB CYS 60 2HB CYS 60 1.417 4.929 -6.398
422 2HB CYS 60 1HB CYS 60 0.989 6.481 -5.685
423 H ASN 61 H ASN 61 -1.956 4.457 -4.043
424 HA ASN 61 HA ASN 61 -1.810 1.610 -4.743
425 1HB ASN 61 2HB ASN 61 -2.378 1.212 -2.356
426 2HB ASN 61 1HB ASN 61 -0.887 2.136 -2.562
427 1HD2 ASN 61 1HD2 ASN 61 -1.283 2.731 -0.329
428 2HD2 ASN 61 2HD2 ASN 61 -2.339 4.066 0.012
429 H ASN 62 H ASN 62 -3.562 2.369 -6.352
430 HA ASN 62 HA ASN 62 -6.197 2.116 -5.055
431 1HB ASN 62 2HB ASN 62 -5.690 4.320 -6.228
432 2HB ASN 62 1HB ASN 62 -5.702 3.407 -7.740
433 1HD2 ASN 62 1HD2 ASN 62 -7.443 4.888 -8.278
434 2HD2 ASN 62 2HD2 ASN 62 -9.058 4.507 -7.764
Start of MODEL 2
1 1H LEU 1 1HT LEU 1 1.904 15.080 1.461
2 2H LEU 1 2HT LEU 1 0.508 14.587 2.331
3 3H LEU 1 3HT LEU 1 0.353 15.612 0.963
4 HA LEU 1 HA LEU 1 0.909 13.957 -0.505
5 1HB LEU 1 2HB LEU 1 2.808 13.164 0.907
6 2HB LEU 1 1HB LEU 1 1.659 12.282 1.893
7 HG LEU 1 HG LEU 1 1.013 10.980 -0.151
8 1HD1 LEU 1 1HD1 LEU 1 2.850 11.017 -1.946
9 2HD1 LEU 1 2HD1 LEU 1 3.246 12.611 -1.303
10 3HD1 LEU 1 3HD1 LEU 1 1.640 12.301 -1.962
11 1HD2 LEU 1 1HD2 LEU 1 2.722 9.436 0.121
12 2HD2 LEU 1 2HD2 LEU 1 2.781 10.352 1.627
13 3HD2 LEU 1 3HD2 LEU 1 3.949 10.683 0.346
14 H GLU 2 H GLU 2 -0.382 12.065 -1.090
15 HA GLU 2 HA GLU 2 -2.628 11.507 0.704
16 1HB GLU 2 2HB GLU 2 -2.941 13.305 -1.299
17 2HB GLU 2 1HB GLU 2 -3.346 11.818 -2.145
18 1HG GLU 2 2HG GLU 2 -5.216 11.437 -0.878
19 2HG GLU 2 1HG GLU 2 -4.601 12.359 0.500
20 H CYS 3 H CYS 3 -3.445 9.458 0.564
21 HA CYS 3 HA CYS 3 -2.744 7.720 -1.634
22 1HB CYS 3 2HB CYS 3 -1.329 7.633 0.955
23 2HB CYS 3 1HB CYS 3 -1.911 6.075 0.362
24 H HIS 4 H HIS 4 -3.636 5.471 -1.252
25 HA HIS 4 HA HIS 4 -6.339 5.730 -0.303
26 1HB HIS 4 2HB HIS 4 -4.768 3.619 -1.737
27 2HB HIS 4 1HB HIS 4 -6.312 3.200 -0.995
28 HD1 HIS 4 1HD HIS 4 -8.445 4.158 -2.080
29 HD2 HIS 4 2HD HIS 4 -4.929 5.271 -3.996
30 HE1 HIS 4 1HE HIS 4 -9.162 5.154 -4.276
31 HE2 HIS 4 2HE HIS 4 -7.023 5.898 -5.380
32 H ASN 5 H ASN 5 -6.792 5.545 1.792
33 HA ASN 5 HA ASN 5 -5.078 4.140 3.611
34 1HB ASN 5 2HB ASN 5 -6.849 4.749 5.297
35 2HB ASN 5 1HB ASN 5 -6.166 6.120 4.424
36 1HD2 ASN 5 1HD2 ASN 5 -8.322 6.750 5.551
37 2HD2 ASN 5 2HD2 ASN 5 -9.684 6.756 4.485
38 H GLN 6 H GLN 6 -8.171 3.530 2.067
39 HA GLN 6 HA GLN 6 -8.740 1.170 3.590
40 1HB GLN 6 2HB GLN 6 -10.306 2.799 2.170
41 2HB GLN 6 1HB GLN 6 -9.989 1.594 0.921
42 1HG GLN 6 2HG GLN 6 -11.304 0.070 1.888
43 2HG GLN 6 1HG GLN 6 -10.735 0.460 3.510
44 1HE2 GLN 6 1HE2 GLN 6 -11.449 2.855 4.090
45 2HE2 GLN 6 2HE2 GLN 6 -13.142 3.137 3.894
46 H GLN 7 H GLN 7 -9.356 -0.852 2.092
47 HA GLN 7 HA GLN 7 -7.008 -1.418 0.406
48 1HB GLN 7 2HB GLN 7 -7.004 -3.712 1.251
49 2HB GLN 7 1HB GLN 7 -6.795 -2.557 2.567
50 1HG GLN 7 2HG GLN 7 -9.570 -3.063 2.267
51 2HG GLN 7 1HG GLN 7 -8.725 -4.610 2.289
52 1HE2 GLN 7 1HE2 GLN 7 -7.566 -5.210 4.122
53 2HE2 GLN 7 2HE2 GLN 7 -7.804 -4.439 5.650
54 H SER 8 H SER 8 -7.445 -3.545 -0.887
55 HA SER 8 HA SER 8 -8.574 -4.531 -2.597
56 1HB SER 8 2HB SER 8 -10.738 -5.299 -2.170
57 2HB SER 8 1HB SER 8 -10.101 -5.037 -0.547
58 HG SER 8 HG SER 8 -12.284 -4.044 -1.488
59 H SER 9 H SER 9 -9.946 -4.115 -4.459
60 HA SER 9 HA SER 9 -10.229 -1.230 -4.939
61 1HB SER 9 2HB SER 9 -8.691 -2.565 -6.422
62 2HB SER 9 1HB SER 9 -10.110 -3.433 -7.009
63 HG SER 9 HG SER 9 -9.912 -0.612 -7.092
64 H GLN 10 H GLN 10 -12.210 -2.940 -3.565
65 HA GLN 10 HA GLN 10 -14.389 -3.253 -5.431
66 1HB GLN 10 2HB GLN 10 -13.987 -3.755 -2.508
67 2HB GLN 10 1HB GLN 10 -15.628 -3.657 -3.147
68 1HG GLN 10 2HG GLN 10 -14.368 -5.348 -4.913
69 2HG GLN 10 1HG GLN 10 -13.659 -5.784 -3.359
70 1HE2 GLN 10 1HE2 GLN 10 -14.759 -7.825 -3.763
71 2HE2 GLN 10 2HE2 GLN 10 -16.428 -7.983 -3.308
72 H THR 11 H THR 11 -13.559 -1.092 -2.752
73 HA THR 11 HA THR 11 -14.779 1.145 -3.852
74 HB THR 11 HB THR 11 -16.869 -0.093 -3.379
75 HG1 THR 11 1HG THR 11 -16.466 2.185 -1.740
76 1HG2 THR 11 1HG2 THR 11 -15.632 -0.497 -0.800
77 2HG2 THR 11 2HG2 THR 11 -17.019 -1.304 -1.531
78 3HG2 THR 11 3HG2 THR 11 -17.240 0.215 -0.662
79 HA PRO 12 HA PRO 12 -12.049 1.569 -0.036
80 1HB PRO 12 2HB PRO 12 -9.833 2.520 -1.251
81 2HB PRO 12 1HB PRO 12 -10.143 0.789 -1.071
82 1HG PRO 12 2HG PRO 12 -10.578 2.555 -3.452
83 2HG PRO 12 1HG PRO 12 -9.879 0.922 -3.380
84 1HD PRO 12 2HD PRO 12 -12.455 1.400 -4.113
85 2HD PRO 12 1HD PRO 12 -11.943 -0.092 -3.292
86 H THR 13 H THR 13 -10.638 3.681 0.412
87 HA THR 13 HA THR 13 -12.055 6.010 -0.690
88 HB THR 13 HB THR 13 -12.162 7.016 1.535
89 HG1 THR 13 1HG THR 13 -11.204 4.542 2.526
90 1HG2 THR 13 1HG2 THR 13 -13.523 4.485 0.963
91 2HG2 THR 13 2HG2 THR 13 -14.176 6.049 1.451
92 3HG2 THR 13 3HG2 THR 13 -13.499 4.960 2.661
93 H THR 14 H THR 14 -10.894 8.058 -0.362
94 HA THR 14 HA THR 14 -7.985 7.619 -0.440
95 HB THR 14 HB THR 14 -8.095 9.970 -1.576
96 HG1 THR 14 1HG THR 14 -10.419 10.099 -1.093
97 1HG2 THR 14 1HG2 THR 14 -8.041 7.397 -2.605
98 2HG2 THR 14 2HG2 THR 14 -7.658 8.894 -3.457
99 3HG2 THR 14 3HG2 THR 14 -9.290 8.228 -3.532
100 H THR 15 H THR 15 -6.829 8.357 1.205
101 HA THR 15 HA THR 15 -7.549 10.841 2.522
102 HB THR 15 HB THR 15 -7.308 8.253 4.070
103 HG1 THR 15 1HG THR 15 -9.503 8.734 4.600
104 1HG2 THR 15 1HG2 THR 15 -7.041 10.997 4.909
105 2HG2 THR 15 2HG2 THR 15 -6.780 9.506 5.814
106 3HG2 THR 15 3HG2 THR 15 -8.398 10.201 5.707
107 H GLY 16 H GLY 16 -5.779 11.961 3.102
108 1HA GLY 16 2HA GLY 16 -3.216 10.871 2.496
109 2HA GLY 16 1HA GLY 16 -3.546 12.506 3.025
110 H CYS 17 H CYS 17 -1.374 10.932 3.925
111 HA CYS 17 HA CYS 17 -2.076 10.002 6.587
112 1HB CYS 17 2HB CYS 17 0.677 10.201 5.353
113 2HB CYS 17 1HB CYS 17 0.196 9.235 6.749
114 H SER 18 H SER 18 0.051 10.681 8.113
115 HA SER 18 HA SER 18 0.840 13.377 8.026
116 1HB SER 18 2HB SER 18 -1.786 13.287 8.653
117 2HB SER 18 1HB SER 18 -1.087 13.126 10.265
118 HG SER 18 HG SER 18 -1.491 15.336 9.382
119 H GLY 19 H GLY 19 2.804 12.454 8.619
120 1HA GLY 19 2HA GLY 19 3.634 12.534 11.196
121 2HA GLY 19 1HA GLY 19 3.028 10.892 11.037
122 H GLY 20 H GLY 20 5.080 13.145 9.175
123 1HA GLY 20 2HA GLY 20 7.016 12.788 7.998
124 2HA GLY 20 1HA GLY 20 7.459 11.799 9.385
125 H GLU 21 H GLU 21 5.125 11.438 6.711
126 HA GLU 21 HA GLU 21 6.506 8.974 5.924
127 1HB GLU 21 2HB GLU 21 4.255 8.825 7.411
128 2HB GLU 21 1HB GLU 21 3.548 8.895 5.796
129 1HG GLU 21 2HG GLU 21 3.965 6.746 5.514
130 2HG GLU 21 1HG GLU 21 5.690 7.040 5.729
131 H ASN 22 H ASN 22 6.755 8.771 3.782
132 HA ASN 22 HA ASN 22 4.990 10.279 1.994
133 1HB ASN 22 2HB ASN 22 7.101 10.823 0.628
134 2HB ASN 22 1HB ASN 22 6.805 11.768 2.084
135 1HD2 ASN 22 1HD2 ASN 22 8.773 9.329 0.595
136 2HD2 ASN 22 2HD2 ASN 22 10.034 9.335 1.776
137 H ASN 23 H ASN 23 5.197 7.449 2.676
138 HA ASN 23 HA ASN 23 5.598 6.432 -0.039
139 1HB ASN 23 2HB ASN 23 6.839 5.313 2.472
140 2HB ASN 23 1HB ASN 23 6.607 4.330 1.023
141 1HD2 ASN 23 1HD2 ASN 23 8.367 6.927 2.482
142 2HD2 ASN 23 2HD2 ASN 23 9.575 7.080 1.244
143 H CYS 24 H CYS 24 4.373 4.548 -0.538
144 HA CYS 24 HA CYS 24 2.419 3.702 1.465
145 1HB CYS 24 2HB CYS 24 1.584 4.469 -1.334
146 2HB CYS 24 1HB CYS 24 0.540 4.012 0.015
147 H TYR 25 H TYR 25 2.538 1.570 1.586
148 HA TYR 25 HA TYR 25 3.645 0.023 -0.529
149 1HB TYR 25 2HB TYR 25 3.711 -1.770 1.012
150 2HB TYR 25 1HB TYR 25 4.114 -0.325 1.933
151 HD1 TYR 25 1HD TYR 25 2.271 0.747 3.325
152 HD2 TYR 25 2HD TYR 25 1.926 -3.163 1.668
153 HE1 TYR 25 1HE TYR 25 0.484 0.230 4.931
154 HE2 TYR 25 2HE TYR 25 0.137 -3.683 3.274
155 HH TYR 25 HH TYR 25 -0.415 -2.445 5.884
156 H LYS 26 H LYS 26 2.561 -2.174 -0.945
157 HA LYS 26 HA LYS 26 -0.308 -2.240 -0.919
158 1HB LYS 26 2HB LYS 26 0.327 -0.733 -2.885
159 2HB LYS 26 1HB LYS 26 1.011 -2.175 -3.634
160 1HG LYS 26 2HG LYS 26 -1.730 -2.513 -2.664
161 2HG LYS 26 1HG LYS 26 -1.551 -1.306 -3.939
162 1HD LYS 26 2HD LYS 26 -0.022 -3.698 -4.516
163 2HD LYS 26 1HD LYS 26 -1.728 -4.067 -4.259
164 1HE LYS 26 2HE LYS 26 -2.374 -3.003 -6.138
165 2HE LYS 26 1HE LYS 26 -1.193 -1.710 -5.934
166 1HZ LYS 26 1HZ LYS 26 -0.111 -4.320 -6.603
167 2HZ LYS 26 2HZ LYS 26 0.328 -2.789 -7.169
168 3HZ LYS 26 3HZ LYS 26 -1.020 -3.575 -7.819
169 H LYS 27 H LYS 27 -0.168 -4.235 0.036
170 HA LYS 27 HA LYS 27 1.312 -6.316 -1.407
171 1HB LYS 27 2HB LYS 27 0.844 -7.540 0.869
172 2HB LYS 27 1HB LYS 27 2.165 -6.400 0.719
173 1HG LYS 27 2HG LYS 27 0.753 -4.664 1.718
174 2HG LYS 27 1HG LYS 27 -0.551 -5.839 1.891
175 1HD LYS 27 2HD LYS 27 2.135 -6.438 3.050
176 2HD LYS 27 1HD LYS 27 1.049 -5.337 3.899
177 1HE LYS 27 2HE LYS 27 -0.712 -7.182 3.623
178 2HE LYS 27 1HE LYS 27 0.646 -8.235 3.231
179 1HZ LYS 27 1HZ LYS 27 1.016 -6.667 5.624
180 2HZ LYS 27 2HZ LYS 27 1.290 -8.315 5.356
181 3HZ LYS 27 3HZ LYS 27 -0.268 -7.766 5.717
182 H GLU 28 H GLU 28 0.303 -8.016 -2.275
183 HA GLU 28 HA GLU 28 -2.584 -8.307 -1.777
184 1HB GLU 28 2HB GLU 28 -2.285 -9.489 -4.184
185 2HB GLU 28 1HB GLU 28 -2.703 -7.789 -3.982
186 1HG GLU 28 2HG GLU 28 -0.563 -7.075 -4.518
187 2HG GLU 28 1HG GLU 28 0.157 -8.646 -4.168
188 H TRP 29 H TRP 29 -3.339 -10.278 -1.226
189 HA TRP 29 HA TRP 29 -1.577 -12.600 -1.500
190 1HB TRP 29 2HB TRP 29 -1.857 -13.291 0.767
191 2HB TRP 29 1HB TRP 29 -1.344 -11.610 0.811
192 HD1 TRP 29 HD TRP 29 -3.781 -13.845 2.271
193 HE1 TRP 29 1HE TRP 29 -5.685 -12.556 3.434
194 HE3 TRP 29 3HE TRP 29 -2.901 -9.210 0.331
195 HZ2 TRP 29 2HZ TRP 29 -6.675 -9.911 3.512
196 HZ3 TRP 29 3HZ TRP 29 -4.368 -7.351 0.998
197 HH2 TRP 29 HH TRP 29 -6.215 -7.696 2.557
198 H ARG 30 H ARG 30 -2.675 -14.646 -1.399
199 HA ARG 30 HA ARG 30 -5.546 -14.419 -2.024
200 1HB ARG 30 2HB ARG 30 -4.851 -16.845 -3.050
201 2HB ARG 30 1HB ARG 30 -4.904 -15.348 -3.976
202 1HG ARG 30 2HG ARG 30 -2.484 -15.036 -3.482
203 2HG ARG 30 1HG ARG 30 -2.481 -16.630 -2.727
204 1HD ARG 30 2HD ARG 30 -2.311 -17.634 -4.703
205 2HD ARG 30 1HD ARG 30 -3.701 -16.752 -5.331
206 HE ARG 30 HE ARG 30 -0.915 -16.137 -5.744
207 1HH1 ARG 30 1HH1 ARG 30 -4.178 -14.895 -5.792
208 2HH1 ARG 30 2HH1 ARG 30 -3.805 -13.611 -6.892
209 1HH2 ARG 30 1HH2 ARG 30 -0.425 -14.447 -7.189
210 2HH2 ARG 30 2HH2 ARG 30 -1.676 -13.356 -7.684
211 H ASP 31 H ASP 31 -6.972 -15.974 -1.208
212 HA ASP 31 HA ASP 31 -6.044 -18.067 0.528
213 1HB ASP 31 2HB ASP 31 -7.208 -17.210 2.553
214 2HB ASP 31 1HB ASP 31 -5.824 -16.223 2.080
215 H ASN 32 H ASN 32 -7.565 -19.626 0.864
216 HA ASN 32 HA ASN 32 -9.451 -20.844 0.537
217 1HB ASN 32 2HB ASN 32 -10.363 -18.201 1.334
218 2HB ASN 32 1HB ASN 32 -11.544 -19.018 0.315
219 1HD2 ASN 32 1HD2 ASN 32 -9.777 -19.127 3.312
220 2HD2 ASN 32 2HD2 ASN 32 -10.767 -20.314 4.083
221 H ARG 33 H ARG 33 -10.664 -18.011 -1.211
222 HA ARG 33 HA ARG 33 -10.435 -19.538 -3.708
223 1HB ARG 33 2HB ARG 33 -12.607 -18.006 -4.195
224 2HB ARG 33 1HB ARG 33 -12.688 -19.666 -3.611
225 1HG ARG 33 2HG ARG 33 -12.453 -17.589 -1.541
226 2HG ARG 33 1HG ARG 33 -13.953 -17.583 -2.465
227 1HD ARG 33 2HD ARG 33 -13.046 -20.229 -1.556
228 2HD ARG 33 1HD ARG 33 -13.506 -19.112 -0.272
229 HE ARG 33 HE ARG 33 -15.260 -20.494 -1.985
230 1HH1 ARG 33 1HH1 ARG 33 -14.820 -17.348 -0.540
231 2HH1 ARG 33 2HH1 ARG 33 -16.510 -16.971 -0.544
232 1HH2 ARG 33 1HH2 ARG 33 -17.484 -20.001 -1.990
233 2HH2 ARG 33 2HH2 ARG 33 -18.023 -18.477 -1.366
234 H GLY 34 H GLY 34 -11.608 -16.270 -2.952
235 1HA GLY 34 2HA GLY 34 -10.076 -15.176 -5.135
236 2HA GLY 34 1HA GLY 34 -11.137 -14.286 -4.054
237 H TYR 35 H TYR 35 -9.206 -12.782 -4.404
238 HA TYR 35 HA TYR 35 -7.361 -13.188 -2.158
239 1HB TYR 35 2HB TYR 35 -5.684 -11.889 -3.734
240 2HB TYR 35 1HB TYR 35 -5.838 -13.639 -3.824
241 HD1 TYR 35 1HD TYR 35 -6.551 -10.467 -5.510
242 HD2 TYR 35 2HD TYR 35 -6.889 -14.701 -5.735
243 HE1 TYR 35 1HE TYR 35 -7.091 -10.290 -7.903
244 HE2 TYR 35 2HE TYR 35 -7.429 -14.538 -8.127
245 HH TYR 35 HH TYR 35 -8.171 -11.553 -9.645
246 H ARG 36 H ARG 36 -6.324 -11.157 -1.441
247 HA ARG 36 HA ARG 36 -7.911 -8.767 -2.070
248 1HB ARG 36 2HB ARG 36 -7.625 -10.139 0.530
249 2HB ARG 36 1HB ARG 36 -7.407 -8.390 0.574
250 1HG ARG 36 2HG ARG 36 -9.611 -8.222 0.708
251 2HG ARG 36 1HG ARG 36 -9.677 -8.754 -0.974
252 1HD ARG 36 2HD ARG 36 -9.446 -11.133 0.245
253 2HD ARG 36 1HD ARG 36 -10.270 -10.232 1.517
254 HE ARG 36 HE ARG 36 -11.351 -11.033 -1.039
255 1HH1 ARG 36 1HH1 ARG 36 -11.691 -8.913 1.714
256 2HH1 ARG 36 2HH1 ARG 36 -13.383 -8.649 1.459
257 1HH2 ARG 36 1HH2 ARG 36 -13.575 -10.685 -1.375
258 2HH2 ARG 36 2HH2 ARG 36 -14.453 -9.654 -0.294
259 H THR 37 H THR 37 -6.851 -6.752 -1.229
260 HA THR 37 HA THR 37 -3.957 -6.957 -0.920
261 HB THR 37 HB THR 37 -4.271 -6.751 -3.332
262 HG1 THR 37 1HG THR 37 -3.444 -4.263 -2.257
263 1HG2 THR 37 1HG2 THR 37 -5.179 -4.092 -3.598
264 2HG2 THR 37 2HG2 THR 37 -6.372 -4.977 -2.645
265 3HG2 THR 37 3HG2 THR 37 -5.898 -5.570 -4.236
266 H GLU 38 H GLU 38 -3.329 -5.659 0.678
267 HA GLU 38 HA GLU 38 -5.081 -3.416 1.410
268 1HB GLU 38 2HB GLU 38 -3.484 -3.639 3.558
269 2HB GLU 38 1HB GLU 38 -4.989 -4.524 3.387
270 1HG GLU 38 2HG GLU 38 -3.920 -6.517 2.953
271 2HG GLU 38 1HG GLU 38 -2.443 -5.727 2.407
272 H ARG 39 H ARG 39 -4.147 -1.412 2.009
273 HA ARG 39 HA ARG 39 -1.350 -1.004 1.250
274 1HB ARG 39 2HB ARG 39 -3.608 0.714 0.209
275 2HB ARG 39 1HB ARG 39 -1.896 0.920 -0.130
276 1HG ARG 39 2HG ARG 39 -2.392 -0.206 -2.003
277 2HG ARG 39 1HG ARG 39 -2.248 -1.621 -0.959
278 1HD ARG 39 2HD ARG 39 -4.286 -1.997 -1.966
279 2HD ARG 39 1HD ARG 39 -4.772 -1.178 -0.482
280 HE ARG 39 HE ARG 39 -4.522 0.861 -2.225
281 1HH1 ARG 39 1HH1 ARG 39 -6.211 -2.190 -2.395
282 2HH1 ARG 39 2HH1 ARG 39 -7.453 -1.586 -3.439
283 1HH2 ARG 39 1HH2 ARG 39 -6.156 1.656 -3.597
284 2HH2 ARG 39 2HH2 ARG 39 -7.422 0.597 -4.122
285 H GLY 40 H GLY 40 -0.874 1.499 1.639
286 1HA GLY 40 2HA GLY 40 -2.060 3.174 3.350
287 2HA GLY 40 1HA GLY 40 -1.496 1.917 4.450
288 H CYS 41 H CYS 41 -0.432 4.119 5.146
289 HA CYS 41 HA CYS 41 1.910 4.844 3.634
290 1HB CYS 41 2HB CYS 41 0.464 5.874 5.960
291 2HB CYS 41 1HB CYS 41 2.217 5.990 6.129
292 H GLY 42 H GLY 42 3.868 3.980 3.783
293 1HA GLY 42 2HA GLY 42 5.624 3.316 5.472
294 2HA GLY 42 1HA GLY 42 4.416 2.185 6.064
295 H CYS 43 H CYS 43 6.795 1.154 5.384
296 HA CYS 43 HA CYS 43 6.114 -0.433 3.032
297 1HB CYS 43 2HB CYS 43 7.663 1.523 2.408
298 2HB CYS 43 1HB CYS 43 8.905 0.662 3.312
299 HA PRO 44 HA PRO 44 7.724 -2.759 6.823
300 1HB PRO 44 2HB PRO 44 5.454 -4.484 5.988
301 2HB PRO 44 1HB PRO 44 5.933 -3.953 7.608
302 1HG PRO 44 2HG PRO 44 3.803 -2.899 6.399
303 2HG PRO 44 1HG PRO 44 4.881 -1.899 7.389
304 1HD PRO 44 2HD PRO 44 4.687 -2.107 4.412
305 2HD PRO 44 1HD PRO 44 4.969 -0.677 5.428
306 H SER 45 H SER 45 7.629 -5.457 6.687
307 HA SER 45 HA SER 45 8.762 -6.153 4.062
308 1HB SER 45 2HB SER 45 10.432 -7.582 5.314
309 2HB SER 45 1HB SER 45 10.665 -5.842 5.482
310 HG SER 45 HG SER 45 10.578 -7.432 7.434
311 H VAL 46 H VAL 46 7.260 -7.498 3.259
312 HA VAL 46 HA VAL 46 5.783 -9.316 4.923
313 HB VAL 46 HB VAL 46 4.901 -10.127 2.687
314 1HG1 VAL 46 1HG1 VAL 46 3.465 -8.699 3.790
315 2HG1 VAL 46 2HG1 VAL 46 3.733 -7.839 2.274
316 3HG1 VAL 46 3HG1 VAL 46 4.598 -7.348 3.732
317 1HG2 VAL 46 1HG2 VAL 46 6.044 -7.653 1.490
318 2HG2 VAL 46 2HG2 VAL 46 5.481 -9.128 0.704
319 3HG2 VAL 46 3HG2 VAL 46 7.031 -9.114 1.546
320 H LYS 47 H LYS 47 5.537 -11.639 3.822
321 HA LYS 47 HA LYS 47 8.227 -12.791 3.909
322 1HB LYS 47 2HB LYS 47 7.133 -14.905 4.387
323 2HB LYS 47 1HB LYS 47 6.531 -13.663 5.478
324 1HG LYS 47 2HG LYS 47 4.621 -13.413 3.749
325 2HG LYS 47 1HG LYS 47 5.147 -15.003 3.194
326 1HD LYS 47 2HD LYS 47 4.654 -16.007 5.259
327 2HD LYS 47 1HD LYS 47 4.562 -14.452 6.088
328 1HE LYS 47 2HE LYS 47 2.631 -14.103 4.258
329 2HE LYS 47 1HE LYS 47 2.548 -15.854 4.439
330 1HZ LYS 47 1HZ LYS 47 2.573 -14.114 6.817
331 2HZ LYS 47 2HZ LYS 47 1.961 -15.682 6.651
332 3HZ LYS 47 3HZ LYS 47 1.132 -14.376 5.970
333 H LYS 48 H LYS 48 8.013 -15.115 2.609
334 HA LYS 48 HA LYS 48 8.119 -14.319 -0.134
335 1HB LYS 48 2HB LYS 48 8.945 -16.587 1.456
336 2HB LYS 48 1HB LYS 48 8.169 -17.124 -0.027
337 1HG LYS 48 2HG LYS 48 9.927 -15.025 -0.719
338 2HG LYS 48 1HG LYS 48 10.802 -16.115 0.358
339 1HD LYS 48 2HD LYS 48 10.844 -17.778 -1.161
340 2HD LYS 48 1HD LYS 48 9.197 -17.454 -1.705
341 1HE LYS 48 2HE LYS 48 10.153 -15.399 -2.861
342 2HE LYS 48 1HE LYS 48 11.743 -16.094 -2.547
343 1HZ LYS 48 1HZ LYS 48 11.060 -16.731 -4.721
344 2HZ LYS 48 2HZ LYS 48 9.561 -17.283 -4.168
345 3HZ LYS 48 3HZ LYS 48 10.973 -18.109 -3.744
346 H GLY 49 H GLY 49 6.665 -14.603 -1.734
347 1HA GLY 49 2HA GLY 49 4.865 -16.002 -2.675
348 2HA GLY 49 1HA GLY 49 4.177 -16.050 -1.053
349 H ILE 50 H ILE 50 3.653 -13.833 -0.126
350 HA ILE 50 HA ILE 50 1.735 -12.586 -1.722
351 HB ILE 50 HB ILE 50 3.135 -11.371 0.661
352 1HG1 ILE 50 2HG1 ILE 50 0.847 -13.329 0.452
353 2HG1 ILE 50 1HG1 ILE 50 2.349 -13.502 1.364
354 1HG2 ILE 50 1HG2 ILE 50 1.534 -10.028 -0.935
355 2HG2 ILE 50 2HG2 ILE 50 1.428 -9.847 0.815
356 3HG2 ILE 50 3HG2 ILE 50 0.282 -10.881 -0.035
357 1HD1 ILE 50 1HD1 ILE 50 1.251 -12.796 3.146
358 2HD1 ILE 50 2HD1 ILE 50 -0.172 -12.408 2.179
359 3HD1 ILE 50 3HD1 ILE 50 1.110 -11.213 2.380
360 H GLY 51 H GLY 51 1.701 -10.756 -2.964
361 1HA GLY 51 2HA GLY 51 4.326 -9.759 -3.805
362 2HA GLY 51 1HA GLY 51 2.816 -9.562 -4.682
363 H ILE 52 H ILE 52 5.074 -8.051 -2.735
364 HA ILE 52 HA ILE 52 3.167 -5.939 -1.971
365 HB ILE 52 HB ILE 52 4.341 -6.950 -0.067
366 1HG1 ILE 52 2HG1 ILE 52 5.388 -4.156 -0.556
367 2HG1 ILE 52 1HG1 ILE 52 3.707 -4.502 -0.139
368 1HG2 ILE 52 1HG2 ILE 52 6.377 -7.709 -0.955
369 2HG2 ILE 52 2HG2 ILE 52 6.819 -6.405 0.146
370 3HG2 ILE 52 3HG2 ILE 52 6.788 -6.117 -1.593
371 1HD1 ILE 52 1HD1 ILE 52 6.160 -4.696 1.532
372 2HD1 ILE 52 2HD1 ILE 52 4.794 -5.757 1.884
373 3HD1 ILE 52 3HD1 ILE 52 4.582 -4.006 1.912
374 H ASN 53 H ASN 53 3.851 -3.733 -2.177
375 HA ASN 53 HA ASN 53 6.207 -3.085 -3.688
376 1HB ASN 53 2HB ASN 53 5.049 -2.108 -5.616
377 2HB ASN 53 1HB ASN 53 4.723 -3.839 -5.498
378 1HD2 ASN 53 1HD2 ASN 53 3.411 -0.644 -5.216
379 2HD2 ASN 53 2HD2 ASN 53 1.749 -1.110 -5.148
380 H CYS 54 H CYS 54 6.842 -1.035 -3.290
381 HA CYS 54 HA CYS 54 4.926 0.710 -1.888
382 1HB CYS 54 2HB CYS 54 7.922 0.488 -1.533
383 2HB CYS 54 1HB CYS 54 6.908 1.701 -0.748
384 H CYS 55 H CYS 55 4.788 2.842 -2.458
385 HA CYS 55 HA CYS 55 6.475 3.750 -4.689
386 1HB CYS 55 2HB CYS 55 4.242 5.052 -5.322
387 2HB CYS 55 1HB CYS 55 4.572 3.425 -5.921
388 H THR 56 H THR 56 5.926 6.257 -5.024
389 HA THR 56 HA THR 56 5.653 7.579 -2.433
390 HB THR 56 HB THR 56 8.052 7.175 -2.676
391 HG1 THR 56 1HG THR 56 7.326 9.881 -3.113
392 1HG2 THR 56 1HG2 THR 56 9.151 7.330 -4.581
393 2HG2 THR 56 2HG2 THR 56 8.672 9.018 -4.760
394 3HG2 THR 56 3HG2 THR 56 7.639 7.735 -5.393
395 H THR 57 H THR 57 3.660 7.743 -4.117
396 HA THR 57 HA THR 57 3.746 10.505 -4.994
397 HB THR 57 HB THR 57 4.341 9.677 -7.079
398 HG1 THR 57 1HG THR 57 1.525 9.441 -7.206
399 1HG2 THR 57 1HG2 THR 57 4.116 7.600 -7.839
400 2HG2 THR 57 2HG2 THR 57 2.399 7.541 -7.448
401 3HG2 THR 57 3HG2 THR 57 3.599 7.200 -6.203
402 H ASP 58 H ASP 58 1.560 11.301 -5.618
403 HA ASP 58 HA ASP 58 -0.320 10.647 -3.644
404 1HB ASP 58 2HB ASP 58 -1.859 12.094 -5.060
405 2HB ASP 58 1HB ASP 58 -0.368 12.848 -4.511
406 H ARG 59 H ARG 59 -2.004 9.284 -3.580
407 HA ARG 59 HA ARG 59 -3.279 7.466 -4.105
408 1HB ARG 59 2HB ARG 59 -3.515 9.088 -6.641
409 2HB ARG 59 1HB ARG 59 -4.506 7.679 -6.293
410 1HG ARG 59 2HG ARG 59 -5.068 8.977 -4.096
411 2HG ARG 59 1HG ARG 59 -4.539 10.379 -5.036
412 1HD ARG 59 2HD ARG 59 -6.583 8.414 -6.046
413 2HD ARG 59 1HD ARG 59 -7.018 9.840 -5.098
414 HE ARG 59 HE ARG 59 -6.195 9.767 -7.854
415 1HH1 ARG 59 1HH1 ARG 59 -6.434 11.742 -4.987
416 2HH1 ARG 59 2HH1 ARG 59 -6.445 13.234 -5.865
417 1HH2 ARG 59 1HH2 ARG 59 -6.209 11.729 -9.010
418 2HH2 ARG 59 2HH2 ARG 59 -6.318 13.228 -8.148
419 H CYS 60 H CYS 60 -0.408 7.268 -4.700
420 HA CYS 60 HA CYS 60 0.059 5.966 -7.133
421 1HB CYS 60 2HB CYS 60 2.173 5.393 -6.252
422 2HB CYS 60 1HB CYS 60 1.754 6.929 -5.501
423 H ASN 61 H ASN 61 -1.466 4.880 -4.244
424 HA ASN 61 HA ASN 61 -1.286 2.087 -5.145
425 1HB ASN 61 2HB ASN 61 -2.065 1.532 -2.828
426 2HB ASN 61 1HB ASN 61 -0.497 2.343 -2.887
427 1HD2 ASN 61 1HD2 ASN 61 -1.114 2.689 -0.592
428 2HD2 ASN 61 2HD2 ASN 61 -2.025 4.118 -0.215
429 H ASN 62 H ASN 62 -2.951 3.461 -6.685
430 HA ASN 62 HA ASN 62 -5.635 3.534 -5.670
431 1HB ASN 62 2HB ASN 62 -4.860 5.071 -7.447
432 2HB ASN 62 1HB ASN 62 -4.651 3.690 -8.529
433 1HD2 ASN 62 1HD2 ASN 62 -6.772 6.032 -7.358
434 2HD2 ASN 62 2HD2 ASN 62 -8.230 5.435 -8.091
Start of MODEL 3
1 1H LEU 1 1HT LEU 1 2.560 13.939 1.506
2 2H LEU 1 2HT LEU 1 1.422 13.202 2.558
3 3H LEU 1 3HT LEU 1 0.939 14.494 1.537
4 HA LEU 1 HA LEU 1 1.116 13.227 -0.360
5 1HB LEU 1 2HB LEU 1 3.282 12.199 0.499
6 2HB LEU 1 1HB LEU 1 2.285 11.007 1.310
7 HG LEU 1 HG LEU 1 1.641 11.272 -1.526
8 1HD1 LEU 1 1HD1 LEU 1 3.782 11.538 -2.197
9 2HD1 LEU 1 2HD1 LEU 1 3.844 9.799 -1.911
10 3HD1 LEU 1 3HD1 LEU 1 4.449 10.916 -0.687
11 1HD2 LEU 1 1HD2 LEU 1 1.269 9.037 -1.365
12 2HD2 LEU 1 2HD2 LEU 1 1.156 9.448 0.347
13 3HD2 LEU 1 3HD2 LEU 1 2.650 8.770 -0.299
14 H GLU 2 H GLU 2 -0.762 12.337 -0.972
15 HA GLU 2 HA GLU 2 -2.466 11.179 1.119
16 1HB GLU 2 2HB GLU 2 -3.028 13.184 -0.620
17 2HB GLU 2 1HB GLU 2 -3.638 11.803 -1.520
18 1HG GLU 2 2HG GLU 2 -5.361 11.474 -0.116
19 2HG GLU 2 1HG GLU 2 -4.421 11.920 1.312
20 H CYS 3 H CYS 3 -3.369 9.174 0.924
21 HA CYS 3 HA CYS 3 -2.922 7.646 -1.525
22 1HB CYS 3 2HB CYS 3 -1.583 7.170 1.063
23 2HB CYS 3 1HB CYS 3 -2.296 5.742 0.310
24 H HIS 4 H HIS 4 -3.968 5.382 -1.248
25 HA HIS 4 HA HIS 4 -6.685 5.840 -0.389
26 1HB HIS 4 2HB HIS 4 -5.270 3.670 -1.908
27 2HB HIS 4 1HB HIS 4 -6.897 3.406 -1.284
28 HD1 HIS 4 1HD HIS 4 -8.820 4.764 -2.379
29 HD2 HIS 4 2HD HIS 4 -5.086 5.401 -4.087
30 HE1 HIS 4 1HE HIS 4 -9.268 5.958 -4.546
31 HE2 HIS 4 2HE HIS 4 -6.999 6.266 -5.597
32 H ASN 5 H ASN 5 -7.855 4.232 0.908
33 HA ASN 5 HA ASN 5 -6.139 2.908 2.898
34 1HB ASN 5 2HB ASN 5 -7.934 3.514 4.596
35 2HB ASN 5 1HB ASN 5 -6.937 4.848 4.020
36 1HD2 ASN 5 1HD2 ASN 5 -9.018 5.712 5.115
37 2HD2 ASN 5 2HD2 ASN 5 -10.262 6.153 4.000
38 H GLN 6 H GLN 6 -9.351 3.065 1.431
39 HA GLN 6 HA GLN 6 -10.345 0.664 2.511
40 1HB GLN 6 2HB GLN 6 -11.546 2.600 1.218
41 2HB GLN 6 1HB GLN 6 -11.172 1.627 -0.204
42 1HG GLN 6 2HG GLN 6 -13.070 0.553 0.188
43 2HG GLN 6 1HG GLN 6 -12.254 -0.195 1.560
44 1HE2 GLN 6 1HE2 GLN 6 -14.998 0.178 1.472
45 2HE2 GLN 6 2HE2 GLN 6 -15.448 1.335 2.673
46 H GLN 7 H GLN 7 -10.654 -1.386 1.501
47 HA GLN 7 HA GLN 7 -9.130 -2.027 -0.872
48 1HB GLN 7 2HB GLN 7 -7.872 -3.859 0.316
49 2HB GLN 7 1HB GLN 7 -7.348 -2.219 0.699
50 1HG GLN 7 2HG GLN 7 -9.407 -3.360 2.469
51 2HG GLN 7 1HG GLN 7 -7.816 -4.117 2.540
52 1HE2 GLN 7 1HE2 GLN 7 -5.972 -2.633 2.843
53 2HE2 GLN 7 2HE2 GLN 7 -6.192 -1.261 3.871
54 H SER 8 H SER 8 -9.268 -4.504 -1.259
55 HA SER 8 HA SER 8 -10.649 -6.231 -1.803
56 1HB SER 8 2HB SER 8 -11.686 -7.370 0.025
57 2HB SER 8 1HB SER 8 -10.211 -6.637 0.655
58 HG SER 8 HG SER 8 -12.876 -6.012 1.165
59 H SER 9 H SER 9 -11.612 -3.516 -2.350
60 HA SER 9 HA SER 9 -14.216 -4.149 -3.222
61 1HB SER 9 2HB SER 9 -15.014 -3.899 -1.008
62 2HB SER 9 1HB SER 9 -14.004 -2.483 -0.717
63 HG SER 9 HG SER 9 -16.367 -2.699 -2.234
64 H GLN 10 H GLN 10 -15.164 -2.486 -4.494
65 HA GLN 10 HA GLN 10 -13.211 -0.691 -5.620
66 1HB GLN 10 2HB GLN 10 -15.933 -1.634 -6.330
67 2HB GLN 10 1HB GLN 10 -15.473 -0.040 -6.928
68 1HG GLN 10 2HG GLN 10 -13.322 -1.838 -7.403
69 2HG GLN 10 1HG GLN 10 -14.815 -2.579 -7.978
70 1HE2 GLN 10 1HE2 GLN 10 -13.390 0.677 -7.939
71 2HE2 GLN 10 2HE2 GLN 10 -13.687 1.011 -9.616
72 H THR 11 H THR 11 -14.430 1.541 -6.345
73 HA THR 11 HA THR 11 -14.715 3.673 -5.569
74 HB THR 11 HB THR 11 -17.020 2.905 -5.750
75 HG1 THR 11 1HG THR 11 -17.903 4.452 -4.455
76 1HG2 THR 11 1HG2 THR 11 -17.182 1.027 -4.344
77 2HG2 THR 11 2HG2 THR 11 -18.228 2.259 -3.641
78 3HG2 THR 11 3HG2 THR 11 -16.644 1.940 -2.935
79 HA PRO 12 HA PRO 12 -12.788 2.722 -1.352
80 1HB PRO 12 2HB PRO 12 -10.218 3.309 -1.951
81 2HB PRO 12 1HB PRO 12 -10.900 1.694 -2.180
82 1HG PRO 12 2HG PRO 12 -10.458 3.868 -4.193
83 2HG PRO 12 1HG PRO 12 -10.136 2.126 -4.335
84 1HD PRO 12 2HD PRO 12 -12.345 3.308 -5.387
85 2HD PRO 12 1HD PRO 12 -12.335 1.630 -4.799
86 H THR 13 H THR 13 -11.100 4.333 -0.243
87 HA THR 13 HA THR 13 -11.873 7.074 -0.994
88 HB THR 13 HB THR 13 -11.614 7.458 1.587
89 HG1 THR 13 1HG THR 13 -12.201 5.643 2.783
90 1HG2 THR 13 1HG2 THR 13 -13.936 7.137 1.962
91 2HG2 THR 13 2HG2 THR 13 -14.048 5.976 0.639
92 3HG2 THR 13 3HG2 THR 13 -13.733 7.677 0.295
93 H THR 14 H THR 14 -10.394 8.627 0.496
94 HA THR 14 HA THR 14 -7.620 7.672 0.285
95 HB THR 14 HB THR 14 -6.922 9.795 -0.658
96 HG1 THR 14 1HG THR 14 -8.361 11.416 -1.075
97 1HG2 THR 14 1HG2 THR 14 -7.361 8.514 -2.484
98 2HG2 THR 14 2HG2 THR 14 -8.502 9.832 -2.754
99 3HG2 THR 14 3HG2 THR 14 -9.063 8.305 -2.070
100 H THR 15 H THR 15 -6.124 8.652 1.707
101 HA THR 15 HA THR 15 -7.067 10.548 3.676
102 HB THR 15 HB THR 15 -7.863 8.452 4.634
103 HG1 THR 15 1HG THR 15 -7.262 9.606 6.306
104 1HG2 THR 15 1HG2 THR 15 -5.058 7.459 4.882
105 2HG2 THR 15 2HG2 THR 15 -6.043 7.054 3.477
106 3HG2 THR 15 3HG2 THR 15 -6.578 6.588 5.092
107 H GLY 16 H GLY 16 -5.457 11.949 3.903
108 1HA GLY 16 2HA GLY 16 -2.805 11.292 3.095
109 2HA GLY 16 1HA GLY 16 -3.354 12.850 3.674
110 H CYS 17 H CYS 17 -1.173 10.608 4.320
111 HA CYS 17 HA CYS 17 -1.555 10.268 7.154
112 1HB CYS 17 2HB CYS 17 0.879 9.695 5.449
113 2HB CYS 17 1HB CYS 17 0.617 9.142 7.105
114 H SER 18 H SER 18 0.419 10.803 8.597
115 HA SER 18 HA SER 18 1.678 13.338 7.908
116 1HB SER 18 2HB SER 18 -0.569 13.768 9.068
117 2HB SER 18 1HB SER 18 0.185 13.103 10.517
118 HG SER 18 HG SER 18 1.407 14.835 10.694
119 H GLY 19 H GLY 19 3.672 13.565 8.777
120 1HA GLY 19 2HA GLY 19 5.156 13.215 10.700
121 2HA GLY 19 1HA GLY 19 4.469 11.605 10.841
122 H GLY 20 H GLY 20 5.992 13.574 8.280
123 1HA GLY 20 2HA GLY 20 7.527 13.011 6.669
124 2HA GLY 20 1HA GLY 20 8.319 12.152 7.987
125 H GLU 21 H GLU 21 5.371 11.646 6.040
126 HA GLU 21 HA GLU 21 6.398 8.978 5.353
127 1HB GLU 21 2HB GLU 21 4.496 9.170 7.172
128 2HB GLU 21 1HB GLU 21 3.463 9.381 5.757
129 1HG GLU 21 2HG GLU 21 3.489 7.209 5.326
130 2HG GLU 21 1HG GLU 21 5.250 7.153 5.394
131 H ASN 22 H ASN 22 6.716 8.954 3.231
132 HA ASN 22 HA ASN 22 4.648 10.128 1.496
133 1HB ASN 22 2HB ASN 22 7.616 10.204 0.924
134 2HB ASN 22 1HB ASN 22 6.334 10.949 -0.024
135 1HD2 ASN 22 1HD2 ASN 22 8.681 12.136 1.247
136 2HD2 ASN 22 2HD2 ASN 22 8.078 13.363 2.303
137 H ASN 23 H ASN 23 5.124 7.366 2.422
138 HA ASN 23 HA ASN 23 5.340 6.122 -0.227
139 1HB ASN 23 2HB ASN 23 6.642 5.120 2.313
140 2HB ASN 23 1HB ASN 23 6.544 4.203 0.806
141 1HD2 ASN 23 1HD2 ASN 23 7.627 5.051 -1.052
142 2HD2 ASN 23 2HD2 ASN 23 9.030 6.055 -0.855
143 H CYS 24 H CYS 24 4.065 4.290 -0.548
144 HA CYS 24 HA CYS 24 2.281 3.498 1.639
145 1HB CYS 24 2HB CYS 24 1.258 4.090 -1.142
146 2HB CYS 24 1HB CYS 24 0.309 3.694 0.293
147 H TYR 25 H TYR 25 2.419 1.368 1.859
148 HA TYR 25 HA TYR 25 3.506 -0.263 -0.191
149 1HB TYR 25 2HB TYR 25 3.596 -1.979 1.424
150 2HB TYR 25 1HB TYR 25 3.940 -0.492 2.301
151 HD1 TYR 25 1HD TYR 25 2.106 0.552 3.678
152 HD2 TYR 25 2HD TYR 25 1.766 -3.358 2.023
153 HE1 TYR 25 1HE TYR 25 0.294 0.045 5.260
154 HE2 TYR 25 2HE TYR 25 -0.048 -3.870 3.601
155 HH TYR 25 HH TYR 25 -0.757 -1.925 6.288
156 H LYS 26 H LYS 26 2.504 -2.317 -0.836
157 HA LYS 26 HA LYS 26 -0.393 -2.463 -0.737
158 1HB LYS 26 2HB LYS 26 0.161 -0.998 -2.703
159 2HB LYS 26 1HB LYS 26 1.034 -2.361 -3.402
160 1HG LYS 26 2HG LYS 26 -1.427 -3.436 -2.806
161 2HG LYS 26 1HG LYS 26 -1.818 -1.800 -3.335
162 1HD LYS 26 2HD LYS 26 0.151 -2.866 -5.095
163 2HD LYS 26 1HD LYS 26 -1.139 -4.057 -4.917
164 1HE LYS 26 2HE LYS 26 -1.774 -1.175 -5.431
165 2HE LYS 26 1HE LYS 26 -1.335 -2.249 -6.759
166 1HZ LYS 26 1HZ LYS 26 -3.162 -3.703 -6.137
167 2HZ LYS 26 2HZ LYS 26 -3.728 -2.143 -6.458
168 3HZ LYS 26 3HZ LYS 26 -3.580 -2.675 -4.860
169 H LYS 27 H LYS 27 -0.250 -4.432 0.274
170 HA LYS 27 HA LYS 27 1.251 -6.541 -1.104
171 1HB LYS 27 2HB LYS 27 0.775 -7.728 1.173
172 2HB LYS 27 1HB LYS 27 2.065 -6.549 1.048
173 1HG LYS 27 2HG LYS 27 0.566 -4.850 1.993
174 2HG LYS 27 1HG LYS 27 -0.696 -6.073 2.150
175 1HD LYS 27 2HD LYS 27 1.914 -6.758 3.341
176 2HD LYS 27 1HD LYS 27 1.039 -5.437 4.119
177 1HE LYS 27 2HE LYS 27 0.076 -7.137 5.257
178 2HE LYS 27 1HE LYS 27 -0.967 -7.194 3.836
179 1HZ LYS 27 1HZ LYS 27 1.491 -8.746 3.702
180 2HZ LYS 27 2HZ LYS 27 -0.058 -9.120 3.136
181 3HZ LYS 27 3HZ LYS 27 0.310 -9.311 4.775
182 H GLU 28 H GLU 28 0.217 -8.126 -2.101
183 HA GLU 28 HA GLU 28 -2.666 -8.444 -1.617
184 1HB GLU 28 2HB GLU 28 -2.422 -9.651 -3.951
185 2HB GLU 28 1HB GLU 28 -2.588 -7.901 -3.848
186 1HG GLU 28 2HG GLU 28 0.139 -9.088 -3.840
187 2HG GLU 28 1HG GLU 28 -0.757 -9.025 -5.356
188 H TRP 29 H TRP 29 -3.526 -10.503 -1.358
189 HA TRP 29 HA TRP 29 -1.720 -12.787 -1.382
190 1HB TRP 29 2HB TRP 29 -2.162 -13.458 0.873
191 2HB TRP 29 1HB TRP 29 -1.623 -11.785 0.927
192 HD1 TRP 29 HD TRP 29 -4.143 -13.941 2.326
193 HE1 TRP 29 1HE TRP 29 -6.109 -12.612 3.325
194 HE3 TRP 29 3HE TRP 29 -3.173 -9.388 0.230
195 HZ2 TRP 29 2HZ TRP 29 -7.110 -9.972 3.233
196 HZ3 TRP 29 3HZ TRP 29 -4.679 -7.512 0.736
197 HH2 TRP 29 HH TRP 29 -6.605 -7.799 2.206
198 H ARG 30 H ARG 30 -2.771 -14.799 -1.513
199 HA ARG 30 HA ARG 30 -5.379 -14.668 -2.714
200 1HB ARG 30 2HB ARG 30 -5.027 -17.221 -2.806
201 2HB ARG 30 1HB ARG 30 -3.987 -16.196 -3.789
202 1HG ARG 30 2HG ARG 30 -2.153 -16.512 -2.370
203 2HG ARG 30 1HG ARG 30 -3.162 -17.132 -1.061
204 1HD ARG 30 2HD ARG 30 -3.747 -18.957 -2.900
205 2HD ARG 30 1HD ARG 30 -2.158 -18.490 -3.504
206 HE ARG 30 HE ARG 30 -1.241 -19.664 -1.786
207 1HH1 ARG 30 1HH1 ARG 30 -4.501 -18.798 -0.887
208 2HH1 ARG 30 2HH1 ARG 30 -4.451 -19.668 0.610
209 1HH2 ARG 30 1HH2 ARG 30 -1.175 -20.808 0.182
210 2HH2 ARG 30 2HH2 ARG 30 -2.565 -20.810 1.216
211 H ASP 31 H ASP 31 -7.058 -16.314 -2.077
212 HA ASP 31 HA ASP 31 -7.113 -17.128 0.683
213 1HB ASP 31 2HB ASP 31 -9.242 -15.829 1.150
214 2HB ASP 31 1HB ASP 31 -7.758 -14.875 1.094
215 H ASN 32 H ASN 32 -7.307 -19.111 -0.577
216 HA ASN 32 HA ASN 32 -8.542 -20.917 -1.202
217 1HB ASN 32 2HB ASN 32 -11.021 -19.263 -0.720
218 2HB ASN 32 1HB ASN 32 -10.880 -21.018 -0.713
219 1HD2 ASN 32 1HD2 ASN 32 -11.162 -18.390 1.201
220 2HD2 ASN 32 2HD2 ASN 32 -10.477 -19.009 2.661
221 H ARG 33 H ARG 33 -10.400 -18.084 -2.355
222 HA ARG 33 HA ARG 33 -10.337 -19.281 -5.039
223 1HB ARG 33 2HB ARG 33 -12.197 -17.306 -5.253
224 2HB ARG 33 1HB ARG 33 -12.561 -18.983 -4.850
225 1HG ARG 33 2HG ARG 33 -12.370 -18.336 -2.431
226 2HG ARG 33 1HG ARG 33 -12.280 -16.656 -2.963
227 1HD ARG 33 2HD ARG 33 -14.467 -17.599 -4.323
228 2HD ARG 33 1HD ARG 33 -14.576 -18.456 -2.786
229 HE ARG 33 HE ARG 33 -15.170 -15.738 -3.231
230 1HH1 ARG 33 1HH1 ARG 33 -13.605 -17.814 -0.903
231 2HH1 ARG 33 2HH1 ARG 33 -13.938 -16.770 0.438
232 1HH2 ARG 33 1HH2 ARG 33 -15.610 -14.365 -1.469
233 2HH2 ARG 33 2HH2 ARG 33 -15.077 -14.813 0.118
234 H GLY 34 H GLY 34 -10.986 -15.899 -4.222
235 1HA GLY 34 2HA GLY 34 -9.000 -15.105 -6.203
236 2HA GLY 34 1HA GLY 34 -10.203 -14.064 -5.460
237 H TYR 35 H TYR 35 -7.883 -12.918 -5.632
238 HA TYR 35 HA TYR 35 -6.624 -13.236 -2.986
239 1HB TYR 35 2HB TYR 35 -4.735 -11.881 -4.381
240 2HB TYR 35 1HB TYR 35 -4.771 -13.632 -4.232
241 HD1 TYR 35 1HD TYR 35 -5.657 -15.010 -6.097
242 HD2 TYR 35 2HD TYR 35 -5.124 -10.807 -6.476
243 HE1 TYR 35 1HE TYR 35 -5.783 -15.222 -8.543
244 HE2 TYR 35 2HE TYR 35 -5.249 -11.006 -8.924
245 HH TYR 35 HH TYR 35 -6.287 -13.861 -10.486
246 H ARG 36 H ARG 36 -6.518 -11.517 -1.677
247 HA ARG 36 HA ARG 36 -7.838 -9.070 -2.563
248 1HB ARG 36 2HB ARG 36 -6.973 -9.968 0.193
249 2HB ARG 36 1HB ARG 36 -7.870 -8.491 -0.159
250 1HG ARG 36 2HG ARG 36 -9.106 -10.916 -1.227
251 2HG ARG 36 1HG ARG 36 -8.970 -10.889 0.531
252 1HD ARG 36 2HD ARG 36 -10.533 -9.299 0.740
253 2HD ARG 36 1HD ARG 36 -9.886 -8.362 -0.607
254 HE ARG 36 HE ARG 36 -11.419 -9.351 -1.992
255 1HH1 ARG 36 1HH1 ARG 36 -11.268 -11.145 0.997
256 2HH1 ARG 36 2HH1 ARG 36 -12.630 -12.143 0.613
257 1HH2 ARG 36 1HH2 ARG 36 -13.212 -10.662 -2.499
258 2HH2 ARG 36 2HH2 ARG 36 -13.734 -11.868 -1.371
259 H THR 37 H THR 37 -6.853 -7.054 -1.246
260 HA THR 37 HA THR 37 -3.975 -7.016 -1.169
261 HB THR 37 HB THR 37 -5.294 -5.215 -3.194
262 HG1 THR 37 1HG THR 37 -4.470 -6.678 -4.757
263 1HG2 THR 37 1HG2 THR 37 -2.480 -5.851 -2.460
264 2HG2 THR 37 2HG2 THR 37 -3.238 -4.292 -2.784
265 3HG2 THR 37 3HG2 THR 37 -2.873 -5.388 -4.116
266 H GLU 38 H GLU 38 -3.483 -5.766 0.510
267 HA GLU 38 HA GLU 38 -5.303 -3.563 1.192
268 1HB GLU 38 2HB GLU 38 -3.915 -3.809 3.441
269 2HB GLU 38 1HB GLU 38 -5.336 -4.788 3.116
270 1HG GLU 38 2HG GLU 38 -3.809 -6.568 2.266
271 2HG GLU 38 1HG GLU 38 -2.453 -5.589 2.820
272 H ARG 39 H ARG 39 -4.370 -1.601 2.011
273 HA ARG 39 HA ARG 39 -1.583 -1.154 1.182
274 1HB ARG 39 2HB ARG 39 -2.235 1.062 0.320
275 2HB ARG 39 1HB ARG 39 -3.012 -0.248 -0.557
276 1HG ARG 39 2HG ARG 39 -4.856 0.292 1.373
277 2HG ARG 39 1HG ARG 39 -4.178 1.891 1.061
278 1HD ARG 39 2HD ARG 39 -5.938 1.730 -0.456
279 2HD ARG 39 1HD ARG 39 -4.520 1.332 -1.421
280 HE ARG 39 HE ARG 39 -6.588 -0.530 -0.505
281 1HH1 ARG 39 1HH1 ARG 39 -3.687 0.050 -2.372
282 2HH1 ARG 39 2HH1 ARG 39 -3.810 -1.438 -3.246
283 1HH2 ARG 39 1HH2 ARG 39 -6.739 -2.482 -1.656
284 2HH2 ARG 39 2HH2 ARG 39 -5.538 -2.873 -2.842
285 H GLY 40 H GLY 40 -1.104 1.333 1.937
286 1HA GLY 40 2HA GLY 40 -2.080 2.571 4.101
287 2HA GLY 40 1HA GLY 40 -1.300 1.171 4.834
288 H CYS 41 H CYS 41 -0.435 3.601 5.590
289 HA CYS 41 HA CYS 41 1.832 4.404 3.977
290 1HB CYS 41 2HB CYS 41 0.451 5.437 6.399
291 2HB CYS 41 1HB CYS 41 2.163 5.834 6.222
292 H GLY 42 H GLY 42 3.842 3.663 4.186
293 1HA GLY 42 2HA GLY 42 5.671 3.201 5.805
294 2HA GLY 42 1HA GLY 42 4.517 2.184 6.656
295 H CYS 43 H CYS 43 7.186 1.782 5.158
296 HA CYS 43 HA CYS 43 6.286 -0.583 3.650
297 1HB CYS 43 2HB CYS 43 7.193 1.356 2.244
298 2HB CYS 43 1HB CYS 43 8.762 0.986 2.949
299 HA PRO 44 HA PRO 44 9.020 -2.090 7.016
300 1HB PRO 44 2HB PRO 44 7.870 -4.553 7.151
301 2HB PRO 44 1HB PRO 44 7.227 -3.136 7.999
302 1HG PRO 44 2HG PRO 44 6.352 -4.355 5.406
303 2HG PRO 44 1HG PRO 44 5.364 -3.747 6.747
304 1HD PRO 44 2HD PRO 44 5.793 -2.310 4.498
305 2HD PRO 44 1HD PRO 44 5.602 -1.547 6.090
306 H SER 45 H SER 45 9.866 -4.629 7.063
307 HA SER 45 HA SER 45 10.934 -5.157 4.371
308 1HB SER 45 2HB SER 45 12.991 -6.015 5.826
309 2HB SER 45 1HB SER 45 12.854 -4.328 5.328
310 HG SER 45 HG SER 45 12.790 -5.408 7.821
311 H VAL 46 H VAL 46 8.779 -6.518 4.917
312 HA VAL 46 HA VAL 46 9.277 -8.938 6.383
313 HB VAL 46 HB VAL 46 7.057 -9.622 5.359
314 1HG1 VAL 46 1HG1 VAL 46 7.632 -8.186 7.565
315 2HG1 VAL 46 2HG1 VAL 46 6.005 -8.712 7.132
316 3HG1 VAL 46 3HG1 VAL 46 6.538 -7.078 6.738
317 1HG2 VAL 46 1HG2 VAL 46 7.345 -7.955 3.444
318 2HG2 VAL 46 2HG2 VAL 46 6.809 -6.734 4.598
319 3HG2 VAL 46 3HG2 VAL 46 5.748 -8.080 4.184
320 H LYS 47 H LYS 47 8.459 -11.024 5.099
321 HA LYS 47 HA LYS 47 9.464 -11.150 2.390
322 1HB LYS 47 2HB LYS 47 11.029 -13.046 2.975
323 2HB LYS 47 1HB LYS 47 11.552 -11.447 3.483
324 1HG LYS 47 2HG LYS 47 11.421 -11.952 5.672
325 2HG LYS 47 1HG LYS 47 9.991 -12.965 5.464
326 1HD LYS 47 2HD LYS 47 12.757 -13.787 4.593
327 2HD LYS 47 1HD LYS 47 12.075 -14.182 6.173
328 1HE LYS 47 2HE LYS 47 11.333 -16.038 5.157
329 2HE LYS 47 1HE LYS 47 10.082 -14.984 4.500
330 1HZ LYS 47 1HZ LYS 47 11.027 -14.977 2.457
331 2HZ LYS 47 2HZ LYS 47 11.592 -16.487 2.969
332 3HZ LYS 47 3HZ LYS 47 12.606 -15.136 3.042
333 H LYS 48 H LYS 48 7.954 -12.267 1.363
334 HA LYS 48 HA LYS 48 7.282 -14.918 1.976
335 1HB LYS 48 2HB LYS 48 5.835 -13.012 3.504
336 2HB LYS 48 1HB LYS 48 4.719 -13.684 2.323
337 1HG LYS 48 2HG LYS 48 6.449 -15.497 3.948
338 2HG LYS 48 1HG LYS 48 4.975 -14.814 4.637
339 1HD LYS 48 2HD LYS 48 3.966 -15.676 2.334
340 2HD LYS 48 1HD LYS 48 5.318 -16.803 2.460
341 1HE LYS 48 2HE LYS 48 3.739 -17.990 3.599
342 2HE LYS 48 1HE LYS 48 4.409 -17.050 4.931
343 1HZ LYS 48 1HZ LYS 48 1.810 -16.840 3.632
344 2HZ LYS 48 2HZ LYS 48 2.530 -15.389 4.117
345 3HZ LYS 48 3HZ LYS 48 2.233 -16.605 5.253
346 H GLY 49 H GLY 49 5.295 -15.643 0.661
347 1HA GLY 49 2HA GLY 49 5.700 -14.966 -2.022
348 2HA GLY 49 1HA GLY 49 4.301 -15.839 -1.398
349 H ILE 50 H ILE 50 3.681 -13.474 0.375
350 HA ILE 50 HA ILE 50 1.691 -12.287 -1.086
351 HB ILE 50 HB ILE 50 3.235 -10.927 1.109
352 1HG1 ILE 50 2HG1 ILE 50 2.660 -12.964 2.084
353 2HG1 ILE 50 1HG1 ILE 50 1.275 -11.950 2.473
354 1HG2 ILE 50 1HG2 ILE 50 0.319 -10.648 0.440
355 2HG2 ILE 50 2HG2 ILE 50 1.556 -9.603 -0.259
356 3HG2 ILE 50 3HG2 ILE 50 1.306 -9.629 1.486
357 1HD1 ILE 50 1HD1 ILE 50 0.323 -12.964 0.246
358 2HD1 ILE 50 2HD1 ILE 50 0.211 -13.831 1.777
359 3HD1 ILE 50 3HD1 ILE 50 1.472 -14.249 0.618
360 H GLY 51 H GLY 51 1.568 -10.776 -2.637
361 1HA GLY 51 2HA GLY 51 3.988 -9.672 -3.734
362 2HA GLY 51 1HA GLY 51 2.356 -9.414 -4.333
363 H ILE 52 H ILE 52 4.728 -8.380 -1.949
364 HA ILE 52 HA ILE 52 3.127 -6.031 -1.291
365 HB ILE 52 HB ILE 52 4.229 -7.251 0.540
366 1HG1 ILE 52 2HG1 ILE 52 5.762 -4.742 0.619
367 2HG1 ILE 52 1HG1 ILE 52 4.062 -4.534 0.189
368 1HG2 ILE 52 1HG2 ILE 52 6.910 -6.234 -0.091
369 2HG2 ILE 52 2HG2 ILE 52 6.337 -7.534 -1.138
370 3HG2 ILE 52 3HG2 ILE 52 6.411 -7.775 0.607
371 1HD1 ILE 52 1HD1 ILE 52 3.376 -4.956 2.266
372 2HD1 ILE 52 2HD1 ILE 52 5.053 -4.655 2.721
373 3HD1 ILE 52 3HD1 ILE 52 4.491 -6.307 2.466
374 H ASN 53 H ASN 53 3.341 -4.214 -2.388
375 HA ASN 53 HA ASN 53 5.977 -3.493 -3.466
376 1HB ASN 53 2HB ASN 53 4.816 -2.563 -5.488
377 2HB ASN 53 1HB ASN 53 4.759 -4.324 -5.367
378 1HD2 ASN 53 1HD2 ASN 53 2.799 -5.306 -4.672
379 2HD2 ASN 53 2HD2 ASN 53 1.287 -4.504 -4.903
380 H CYS 54 H CYS 54 6.593 -1.506 -2.898
381 HA CYS 54 HA CYS 54 4.562 0.295 -1.773
382 1HB CYS 54 2HB CYS 54 7.559 0.251 -1.359
383 2HB CYS 54 1HB CYS 54 6.444 1.397 -0.610
384 H CYS 55 H CYS 55 4.524 2.483 -2.320
385 HA CYS 55 HA CYS 55 6.121 3.266 -4.660
386 1HB CYS 55 2HB CYS 55 3.936 4.592 -5.295
387 2HB CYS 55 1HB CYS 55 4.124 2.900 -5.759
388 H THR 56 H THR 56 5.607 5.779 -5.047
389 HA THR 56 HA THR 56 5.470 7.187 -2.495
390 HB THR 56 HB THR 56 7.833 6.765 -2.720
391 HG1 THR 56 1HG THR 56 7.407 8.813 -1.979
392 1HG2 THR 56 1HG2 THR 56 9.144 7.573 -4.604
393 2HG2 THR 56 2HG2 THR 56 7.662 8.030 -5.443
394 3HG2 THR 56 3HG2 THR 56 7.994 6.332 -5.101
395 H THR 57 H THR 57 3.495 7.225 -4.340
396 HA THR 57 HA THR 57 3.589 9.998 -5.235
397 HB THR 57 HB THR 57 4.091 9.163 -7.319
398 HG1 THR 57 1HG THR 57 2.351 9.968 -8.128
399 1HG2 THR 57 1HG2 THR 57 2.356 6.924 -7.712
400 2HG2 THR 57 2HG2 THR 57 3.372 6.662 -6.296
401 3HG2 THR 57 3HG2 THR 57 4.111 7.024 -7.854
402 H ASP 58 H ASP 58 1.448 10.874 -5.733
403 HA ASP 58 HA ASP 58 -0.420 10.270 -3.744
404 1HB ASP 58 2HB ASP 58 -1.947 11.748 -5.148
405 2HB ASP 58 1HB ASP 58 -0.431 12.465 -4.621
406 H ARG 59 H ARG 59 -2.175 8.994 -3.648
407 HA ARG 59 HA ARG 59 -3.509 7.206 -4.129
408 1HB ARG 59 2HB ARG 59 -3.764 9.043 -6.471
409 2HB ARG 59 1HB ARG 59 -4.550 7.472 -6.543
410 1HG ARG 59 2HG ARG 59 -5.491 8.171 -4.202
411 2HG ARG 59 1HG ARG 59 -5.119 9.802 -4.778
412 1HD ARG 59 2HD ARG 59 -6.471 8.218 -6.799
413 2HD ARG 59 1HD ARG 59 -7.414 8.328 -5.307
414 HE ARG 59 HE ARG 59 -6.411 10.871 -6.090
415 1HH1 ARG 59 1HH1 ARG 59 -8.894 8.527 -6.814
416 2HH1 ARG 59 2HH1 ARG 59 -9.997 9.705 -7.443
417 1HH2 ARG 59 1HH2 ARG 59 -7.862 12.421 -6.917
418 2HH2 ARG 59 2HH2 ARG 59 -9.411 11.915 -7.502
419 H CYS 60 H CYS 60 -0.685 6.840 -4.696
420 HA CYS 60 HA CYS 60 -0.329 5.469 -7.142
421 1HB CYS 60 2HB CYS 60 1.810 4.839 -6.271
422 2HB CYS 60 1HB CYS 60 1.482 6.489 -5.750
423 H ASN 61 H ASN 61 -1.699 4.545 -4.117
424 HA ASN 61 HA ASN 61 -1.612 1.712 -4.912
425 1HB ASN 61 2HB ASN 61 -2.055 1.187 -2.550
426 2HB ASN 61 1HB ASN 61 -0.591 2.160 -2.728
427 1HD2 ASN 61 1HD2 ASN 61 -1.080 2.468 -0.397
428 2HD2 ASN 61 2HD2 ASN 61 -2.109 3.797 0.036
429 H ASN 62 H ASN 62 -3.394 2.773 -6.398
430 HA ASN 62 HA ASN 62 -5.927 3.341 -5.323
431 1HB ASN 62 2HB ASN 62 -6.714 2.780 -7.676
432 2HB ASN 62 1HB ASN 62 -5.496 4.050 -7.544
433 1HD2 ASN 62 1HD2 ASN 62 -5.338 3.413 -9.874
434 2HD2 ASN 62 2HD2 ASN 62 -4.201 2.161 -10.273
Start of MODEL 4
1 1H LEU 1 1HT LEU 1 1.409 14.902 0.477
2 2H LEU 1 2HT LEU 1 3.025 14.355 0.285
3 3H LEU 1 3HT LEU 1 2.040 13.709 1.533
4 HA LEU 1 HA LEU 1 1.358 13.479 -1.309
5 1HB LEU 1 2HB LEU 1 3.658 12.537 -0.494
6 2HB LEU 1 1HB LEU 1 2.677 11.311 0.286
7 HG LEU 1 HG LEU 1 1.678 10.800 -1.966
8 1HD1 LEU 1 1HD1 LEU 1 2.334 11.821 -3.866
9 2HD1 LEU 1 2HD1 LEU 1 3.990 12.047 -3.303
10 3HD1 LEU 1 3HD1 LEU 1 2.718 13.145 -2.765
11 1HD2 LEU 1 1HD2 LEU 1 3.893 9.753 -2.810
12 2HD2 LEU 1 2HD2 LEU 1 3.232 9.237 -1.258
13 3HD2 LEU 1 3HD2 LEU 1 4.567 10.389 -1.308
14 H GLU 2 H GLU 2 -0.293 11.960 -1.671
15 HA GLU 2 HA GLU 2 -1.836 11.260 0.738
16 1HB GLU 2 2HB GLU 2 -3.841 11.354 -0.652
17 2HB GLU 2 1HB GLU 2 -2.969 12.879 -0.717
18 1HG GLU 2 2HG GLU 2 -1.901 11.909 -2.858
19 2HG GLU 2 1HG GLU 2 -3.258 10.778 -2.822
20 H CYS 3 H CYS 3 -2.991 9.251 0.733
21 HA CYS 3 HA CYS 3 -2.392 7.296 -1.308
22 1HB CYS 3 2HB CYS 3 -0.962 7.367 1.273
23 2HB CYS 3 1HB CYS 3 -1.620 5.794 0.819
24 H HIS 4 H HIS 4 -3.459 5.196 -0.858
25 HA HIS 4 HA HIS 4 -6.095 5.655 0.194
26 1HB HIS 4 2HB HIS 4 -4.737 3.354 -1.191
27 2HB HIS 4 1HB HIS 4 -6.348 3.182 -0.494
28 HD1 HIS 4 1HD HIS 4 -8.267 4.586 -1.610
29 HD2 HIS 4 2HD HIS 4 -4.612 4.730 -3.583
30 HE1 HIS 4 1HE HIS 4 -8.767 5.536 -3.884
31 HE2 HIS 4 2HE HIS 4 -6.529 5.690 -5.031
32 H ASN 5 H ASN 5 -7.018 4.748 2.001
33 HA ASN 5 HA ASN 5 -5.159 3.387 3.836
34 1HB ASN 5 2HB ASN 5 -6.563 4.287 5.673
35 2HB ASN 5 1HB ASN 5 -5.852 5.562 4.684
36 1HD2 ASN 5 1HD2 ASN 5 -7.784 6.370 6.141
37 2HD2 ASN 5 2HD2 ASN 5 -9.252 6.570 5.248
38 H GLN 6 H GLN 6 -8.330 3.306 2.371
39 HA GLN 6 HA GLN 6 -9.276 1.114 3.973
40 1HB GLN 6 2HB GLN 6 -10.558 2.991 2.543
41 2HB GLN 6 1HB GLN 6 -10.541 1.692 1.350
42 1HG GLN 6 2HG GLN 6 -12.517 1.270 2.401
43 2HG GLN 6 1HG GLN 6 -11.430 0.262 3.355
44 1HE2 GLN 6 1HE2 GLN 6 -14.010 1.547 4.017
45 2HE2 GLN 6 2HE2 GLN 6 -13.702 2.486 5.434
46 H GLN 7 H GLN 7 -9.744 -1.004 3.208
47 HA GLN 7 HA GLN 7 -8.287 -1.847 0.806
48 1HB GLN 7 2HB GLN 7 -7.375 -3.794 1.999
49 2HB GLN 7 1HB GLN 7 -6.798 -2.279 2.693
50 1HG GLN 7 2HG GLN 7 -9.232 -3.326 3.936
51 2HG GLN 7 1HG GLN 7 -7.816 -4.365 4.105
52 1HE2 GLN 7 1HE2 GLN 7 -9.387 -1.528 5.139
53 2HE2 GLN 7 2HE2 GLN 7 -8.180 -0.981 6.247
54 H SER 8 H SER 8 -8.847 -4.185 0.256
55 HA SER 8 HA SER 8 -10.428 -5.682 -0.406
56 1HB SER 8 2HB SER 8 -11.745 -6.662 1.266
57 2HB SER 8 1HB SER 8 -10.398 -5.975 2.174
58 HG SER 8 HG SER 8 -13.059 -5.094 1.989
59 H SER 9 H SER 9 -13.088 -5.911 -0.287
60 HA SER 9 HA SER 9 -15.010 -5.155 -1.242
61 1HB SER 9 2HB SER 9 -15.122 -3.783 0.788
62 2HB SER 9 1HB SER 9 -14.146 -2.537 0.011
63 HG SER 9 HG SER 9 -16.785 -2.886 -0.101
64 H GLN 10 H GLN 10 -15.892 -3.197 -2.678
65 HA GLN 10 HA GLN 10 -14.041 -3.052 -4.907
66 1HB GLN 10 2HB GLN 10 -16.972 -2.595 -4.540
67 2HB GLN 10 1HB GLN 10 -16.163 -1.866 -5.927
68 1HG GLN 10 2HG GLN 10 -15.292 -4.515 -5.875
69 2HG GLN 10 1HG GLN 10 -17.016 -4.581 -5.514
70 1HE2 GLN 10 1HE2 GLN 10 -16.213 -5.732 -7.774
71 2HE2 GLN 10 2HE2 GLN 10 -16.666 -4.785 -9.157
72 H THR 11 H THR 11 -16.375 -0.531 -4.100
73 HA THR 11 HA THR 11 -14.664 1.550 -4.799
74 HB THR 11 HB THR 11 -16.417 2.886 -3.325
75 HG1 THR 11 1HG THR 11 -17.944 0.596 -3.903
76 1HG2 THR 11 1HG2 THR 11 -18.121 2.174 -5.330
77 2HG2 THR 11 2HG2 THR 11 -16.542 1.801 -6.024
78 3HG2 THR 11 3HG2 THR 11 -16.883 3.427 -5.431
79 HA PRO 12 HA PRO 12 -12.449 1.584 -0.863
80 1HB PRO 12 2HB PRO 12 -10.181 2.665 -1.751
81 2HB PRO 12 1HB PRO 12 -10.615 1.002 -2.168
82 1HG PRO 12 2HG PRO 12 -10.796 3.483 -3.819
83 2HG PRO 12 1HG PRO 12 -10.346 1.835 -4.307
84 1HD PRO 12 2HD PRO 12 -12.865 3.013 -4.629
85 2HD PRO 12 1HD PRO 12 -12.508 1.275 -4.728
86 H THR 13 H THR 13 -10.822 3.544 -0.068
87 HA THR 13 HA THR 13 -12.331 6.051 -0.392
88 HB THR 13 HB THR 13 -12.314 6.489 1.918
89 HG1 THR 13 1HG THR 13 -10.308 5.975 2.574
90 1HG2 THR 13 1HG2 THR 13 -12.686 3.777 2.671
91 2HG2 THR 13 2HG2 THR 13 -13.398 4.028 1.076
92 3HG2 THR 13 3HG2 THR 13 -13.893 5.040 2.433
93 H THR 14 H THR 14 -10.932 7.872 0.818
94 HA THR 14 HA THR 14 -8.103 7.514 0.146
95 HB THR 14 HB THR 14 -8.043 9.660 -1.035
96 HG1 THR 14 1HG THR 14 -9.684 10.960 -1.030
97 1HG2 THR 14 1HG2 THR 14 -9.098 7.330 -2.072
98 2HG2 THR 14 2HG2 THR 14 -8.527 8.728 -2.984
99 3HG2 THR 14 3HG2 THR 14 -10.237 8.581 -2.574
100 H THR 15 H THR 15 -6.755 8.391 1.586
101 HA THR 15 HA THR 15 -7.456 10.683 3.168
102 HB THR 15 HB THR 15 -7.169 7.987 4.508
103 HG1 THR 15 1HG THR 15 -9.288 8.549 5.279
104 1HG2 THR 15 1HG2 THR 15 -6.105 9.959 5.719
105 2HG2 THR 15 2HG2 THR 15 -7.297 9.003 6.601
106 3HG2 THR 15 3HG2 THR 15 -7.749 10.565 5.917
107 H GLY 16 H GLY 16 -5.647 11.814 3.471
108 1HA GLY 16 2HA GLY 16 -3.125 10.677 2.795
109 2HA GLY 16 1HA GLY 16 -3.421 12.341 3.247
110 H CYS 17 H CYS 17 -1.184 10.982 4.140
111 HA CYS 17 HA CYS 17 -1.795 10.349 6.945
112 1HB CYS 17 2HB CYS 17 0.733 9.807 5.370
113 2HB CYS 17 1HB CYS 17 0.413 9.293 7.028
114 H SER 18 H SER 18 0.342 10.899 8.329
115 HA SER 18 HA SER 18 0.382 13.734 8.498
116 1HB SER 18 2HB SER 18 1.624 11.477 9.977
117 2HB SER 18 1HB SER 18 2.427 13.042 10.105
118 HG SER 18 HG SER 18 0.913 12.960 11.715
119 H GLY 19 H GLY 19 1.942 15.205 7.942
120 1HA GLY 19 2HA GLY 19 3.466 14.806 5.680
121 2HA GLY 19 1HA GLY 19 3.739 16.095 6.838
122 H GLY 20 H GLY 20 4.703 12.904 5.812
123 1HA GLY 20 2HA GLY 20 7.350 13.193 6.542
124 2HA GLY 20 1HA GLY 20 6.536 12.371 7.866
125 H GLU 21 H GLU 21 4.667 10.953 6.200
126 HA GLU 21 HA GLU 21 6.504 8.928 5.126
127 1HB GLU 21 2HB GLU 21 4.840 8.379 6.989
128 2HB GLU 21 1HB GLU 21 3.584 8.523 5.760
129 1HG GLU 21 2HG GLU 21 4.029 6.513 4.923
130 2HG GLU 21 1HG GLU 21 5.769 6.802 4.926
131 H ASN 22 H ASN 22 6.700 8.810 2.999
132 HA ASN 22 HA ASN 22 4.481 9.767 1.319
133 1HB ASN 22 2HB ASN 22 7.459 9.699 0.868
134 2HB ASN 22 1HB ASN 22 6.326 9.902 -0.464
135 1HD2 ASN 22 1HD2 ASN 22 7.126 11.236 2.715
136 2HD2 ASN 22 2HD2 ASN 22 6.763 12.876 2.311
137 H ASN 23 H ASN 23 6.517 7.061 2.060
138 HA ASN 23 HA ASN 23 5.845 5.570 -0.308
139 1HB ASN 23 2HB ASN 23 7.444 5.075 2.157
140 2HB ASN 23 1HB ASN 23 6.840 3.669 1.275
141 1HD2 ASN 23 1HD2 ASN 23 8.272 6.821 0.465
142 2HD2 ASN 23 2HD2 ASN 23 9.439 6.189 -0.656
143 H CYS 24 H CYS 24 4.453 3.819 -0.474
144 HA CYS 24 HA CYS 24 2.768 3.177 1.826
145 1HB CYS 24 2HB CYS 24 1.577 3.852 -0.867
146 2HB CYS 24 1HB CYS 24 0.713 3.490 0.629
147 H TYR 25 H TYR 25 2.837 1.054 2.045
148 HA TYR 25 HA TYR 25 3.611 -0.650 -0.091
149 1HB TYR 25 2HB TYR 25 3.573 -2.417 1.576
150 2HB TYR 25 1HB TYR 25 4.418 -1.005 2.203
151 HD1 TYR 25 1HD TYR 25 3.336 0.420 3.909
152 HD2 TYR 25 2HD TYR 25 1.554 -3.215 2.588
153 HE1 TYR 25 1HE TYR 25 1.868 0.430 5.881
154 HE2 TYR 25 2HE TYR 25 0.080 -3.209 4.558
155 HH TYR 25 HH TYR 25 0.590 -1.277 7.235
156 H LYS 26 H LYS 26 2.431 -2.340 -0.993
157 HA LYS 26 HA LYS 26 -0.470 -2.329 -0.496
158 1HB LYS 26 2HB LYS 26 0.224 -1.095 -2.621
159 2HB LYS 26 1HB LYS 26 0.741 -2.664 -3.242
160 1HG LYS 26 2HG LYS 26 -1.386 -3.409 -3.519
161 2HG LYS 26 1HG LYS 26 -2.015 -2.462 -2.170
162 1HD LYS 26 2HD LYS 26 -2.902 -1.212 -3.832
163 2HD LYS 26 1HD LYS 26 -1.300 -0.475 -3.836
164 1HE LYS 26 2HE LYS 26 -1.320 -0.977 -6.026
165 2HE LYS 26 1HE LYS 26 -0.905 -2.601 -5.477
166 1HZ LYS 26 1HZ LYS 26 -3.567 -2.656 -5.295
167 2HZ LYS 26 2HZ LYS 26 -2.709 -3.159 -6.663
168 3HZ LYS 26 3HZ LYS 26 -3.378 -1.608 -6.609
169 H LYS 27 H LYS 27 -0.259 -4.202 0.764
170 HA LYS 27 HA LYS 27 1.007 -6.539 -0.360
171 1HB LYS 27 2HB LYS 27 0.508 -7.558 1.780
172 2HB LYS 27 1HB LYS 27 1.243 -5.988 2.021
173 1HG LYS 27 2HG LYS 27 -1.376 -5.328 2.049
174 2HG LYS 27 1HG LYS 27 -1.434 -6.956 2.729
175 1HD LYS 27 2HD LYS 27 0.561 -4.964 3.735
176 2HD LYS 27 1HD LYS 27 -1.106 -4.926 4.312
177 1HE LYS 27 2HE LYS 27 -0.705 -7.486 4.699
178 2HE LYS 27 1HE LYS 27 0.993 -7.011 4.696
179 1HZ LYS 27 1HZ LYS 27 -1.074 -6.488 6.663
180 2HZ LYS 27 2HZ LYS 27 -0.036 -5.191 6.344
181 3HZ LYS 27 3HZ LYS 27 0.597 -6.670 6.868
182 H GLU 28 H GLU 28 0.004 -7.960 -1.598
183 HA GLU 28 HA GLU 28 -2.926 -8.184 -1.420
184 1HB GLU 28 2HB GLU 28 -2.432 -9.212 -3.848
185 2HB GLU 28 1HB GLU 28 -2.751 -7.500 -3.584
186 1HG GLU 28 2HG GLU 28 -0.449 -6.964 -3.711
187 2HG GLU 28 1HG GLU 28 0.020 -8.662 -3.634
188 H TRP 29 H TRP 29 -3.795 -10.165 -1.090
189 HA TRP 29 HA TRP 29 -2.044 -12.507 -1.297
190 1HB TRP 29 2HB TRP 29 -2.766 -13.370 0.844
191 2HB TRP 29 1HB TRP 29 -2.092 -11.764 1.079
192 HD1 TRP 29 HD TRP 29 -4.940 -13.786 2.014
193 HE1 TRP 29 1HE TRP 29 -6.844 -12.355 2.998
194 HE3 TRP 29 3HE TRP 29 -3.293 -9.177 0.576
195 HZ2 TRP 29 2HZ TRP 29 -7.543 -9.622 3.146
196 HZ3 TRP 29 3HZ TRP 29 -4.630 -7.203 1.179
197 HH2 TRP 29 HH TRP 29 -6.710 -7.422 2.438
198 H ARG 30 H ARG 30 -2.961 -14.145 -2.340
199 HA ARG 30 HA ARG 30 -5.709 -13.925 -3.180
200 1HB ARG 30 2HB ARG 30 -5.116 -16.093 -4.399
201 2HB ARG 30 1HB ARG 30 -4.267 -14.633 -4.892
202 1HG ARG 30 2HG ARG 30 -2.275 -15.428 -4.247
203 2HG ARG 30 1HG ARG 30 -2.929 -16.167 -2.784
204 1HD ARG 30 2HD ARG 30 -3.976 -17.617 -4.962
205 2HD ARG 30 1HD ARG 30 -2.258 -17.389 -5.286
206 HE ARG 30 HE ARG 30 -2.838 -18.282 -2.612
207 1HH1 ARG 30 1HH1 ARG 30 -2.220 -19.278 -5.900
208 2HH1 ARG 30 2HH1 ARG 30 -1.669 -20.856 -5.450
209 1HH2 ARG 30 1HH2 ARG 30 -2.113 -20.357 -2.019
210 2HH2 ARG 30 2HH2 ARG 30 -1.608 -21.470 -3.247
211 H ASP 31 H ASP 31 -7.029 -16.005 -3.211
212 HA ASP 31 HA ASP 31 -6.696 -17.533 -0.726
213 1HB ASP 31 2HB ASP 31 -9.173 -17.351 -0.350
214 2HB ASP 31 1HB ASP 31 -8.293 -15.834 -0.142
215 H ASN 32 H ASN 32 -8.487 -17.229 -3.778
216 HA ASN 32 HA ASN 32 -7.933 -19.864 -4.592
217 1HB ASN 32 2HB ASN 32 -10.164 -19.598 -2.802
218 2HB ASN 32 1HB ASN 32 -10.745 -20.100 -4.386
219 1HD2 ASN 32 1HD2 ASN 32 -10.569 -22.166 -4.933
220 2HD2 ASN 32 2HD2 ASN 32 -9.674 -23.359 -4.063
221 H ARG 33 H ARG 33 -11.013 -18.119 -4.879
222 HA ARG 33 HA ARG 33 -10.842 -18.188 -7.742
223 1HB ARG 33 2HB ARG 33 -13.018 -16.896 -7.559
224 2HB ARG 33 1HB ARG 33 -13.006 -18.515 -6.867
225 1HG ARG 33 2HG ARG 33 -12.223 -16.564 -4.909
226 2HG ARG 33 1HG ARG 33 -13.774 -16.131 -5.632
227 1HD ARG 33 2HD ARG 33 -13.696 -18.949 -5.078
228 2HD ARG 33 1HD ARG 33 -13.275 -18.039 -3.628
229 HE ARG 33 HE ARG 33 -15.841 -18.160 -4.916
230 1HH1 ARG 33 1HH1 ARG 33 -13.777 -16.283 -2.821
231 2HH1 ARG 33 2HH1 ARG 33 -15.093 -15.451 -2.062
232 1HH2 ARG 33 1HH2 ARG 33 -17.574 -17.067 -3.920
233 2HH2 ARG 33 2HH2 ARG 33 -17.248 -15.896 -2.686
234 H GLY 34 H GLY 34 -10.414 -15.793 -5.212
235 1HA GLY 34 2HA GLY 34 -9.369 -13.949 -7.251
236 2HA GLY 34 1HA GLY 34 -10.566 -13.368 -6.104
237 H TYR 35 H TYR 35 -8.763 -11.808 -5.700
238 HA TYR 35 HA TYR 35 -7.267 -12.708 -3.381
239 1HB TYR 35 2HB TYR 35 -5.174 -11.553 -4.348
240 2HB TYR 35 1HB TYR 35 -5.569 -13.166 -4.933
241 HD1 TYR 35 1HD TYR 35 -5.778 -13.560 -7.217
242 HD2 TYR 35 2HD TYR 35 -5.978 -9.562 -5.779
243 HE1 TYR 35 1HE TYR 35 -5.762 -12.734 -9.532
244 HE2 TYR 35 2HE TYR 35 -5.965 -8.724 -8.090
245 HH TYR 35 HH TYR 35 -5.092 -9.643 -10.377
246 H ARG 36 H ARG 36 -7.041 -11.141 -1.878
247 HA ARG 36 HA ARG 36 -8.176 -8.523 -2.518
248 1HB ARG 36 2HB ARG 36 -7.432 -9.533 0.223
249 2HB ARG 36 1HB ARG 36 -8.550 -8.234 -0.192
250 1HG ARG 36 2HG ARG 36 -9.686 -10.353 -1.464
251 2HG ARG 36 1HG ARG 36 -8.988 -11.125 -0.040
252 1HD ARG 36 2HD ARG 36 -10.607 -10.320 1.248
253 2HD ARG 36 1HD ARG 36 -10.259 -8.673 0.722
254 HE ARG 36 HE ARG 36 -11.692 -9.677 -1.335
255 1HH1 ARG 36 1HH1 ARG 36 -12.241 -9.566 2.109
256 2HH1 ARG 36 2HH1 ARG 36 -13.965 -9.509 1.959
257 1HH2 ARG 36 1HH2 ARG 36 -13.959 -9.602 -1.535
258 2HH2 ARG 36 2HH2 ARG 36 -14.941 -9.529 -0.110
259 H THR 37 H THR 37 -7.135 -6.684 -1.122
260 HA THR 37 HA THR 37 -4.292 -6.881 -0.744
261 HB THR 37 HB THR 37 -4.463 -6.612 -3.202
262 HG1 THR 37 1HG THR 37 -2.744 -5.637 -1.882
263 1HG2 THR 37 1HG2 THR 37 -6.458 -4.751 -2.629
264 2HG2 THR 37 2HG2 THR 37 -5.768 -5.141 -4.205
265 3HG2 THR 37 3HG2 THR 37 -5.096 -3.818 -3.250
266 H GLU 38 H GLU 38 -3.578 -5.386 0.686
267 HA GLU 38 HA GLU 38 -5.403 -3.180 1.354
268 1HB GLU 38 2HB GLU 38 -4.015 -3.552 3.664
269 2HB GLU 38 1HB GLU 38 -5.605 -4.219 3.338
270 1HG GLU 38 2HG GLU 38 -4.824 -6.336 3.096
271 2HG GLU 38 1HG GLU 38 -3.253 -5.810 2.498
272 H ARG 39 H ARG 39 -4.479 -1.206 1.938
273 HA ARG 39 HA ARG 39 -1.625 -0.942 1.251
274 1HB ARG 39 2HB ARG 39 -2.449 1.526 0.753
275 2HB ARG 39 1HB ARG 39 -2.562 0.257 -0.457
276 1HG ARG 39 2HG ARG 39 -4.868 0.689 1.370
277 2HG ARG 39 1HG ARG 39 -4.590 1.839 0.062
278 1HD ARG 39 2HD ARG 39 -4.298 -0.706 -1.078
279 2HD ARG 39 1HD ARG 39 -5.717 -0.806 -0.038
280 HE ARG 39 HE ARG 39 -5.708 1.525 -1.704
281 1HH1 ARG 39 1HH1 ARG 39 -6.492 -1.873 -1.584
282 2HH1 ARG 39 2HH1 ARG 39 -7.678 -1.772 -2.841
283 1HH2 ARG 39 1HH2 ARG 39 -7.269 1.660 -3.359
284 2HH2 ARG 39 2HH2 ARG 39 -8.119 0.233 -3.849
285 H GLY 40 H GLY 40 -0.924 1.435 2.055
286 1HA GLY 40 2HA GLY 40 -1.876 2.603 4.343
287 2HA GLY 40 1HA GLY 40 -0.934 1.227 4.916
288 H CYS 41 H CYS 41 -0.150 3.684 5.699
289 HA CYS 41 HA CYS 41 1.937 4.615 3.894
290 1HB CYS 41 2HB CYS 41 0.625 5.665 6.352
291 2HB CYS 41 1HB CYS 41 2.289 6.172 6.040
292 H GLY 42 H GLY 42 3.949 3.878 3.981
293 1HA GLY 42 2HA GLY 42 5.878 3.663 5.605
294 2HA GLY 42 1HA GLY 42 4.833 2.538 6.459
295 H CYS 43 H CYS 43 6.853 1.207 6.083
296 HA CYS 43 HA CYS 43 6.314 -0.704 4.057
297 1HB CYS 43 2HB CYS 43 7.422 1.158 2.742
298 2HB CYS 43 1HB CYS 43 8.887 0.830 3.662
299 HA PRO 44 HA PRO 44 9.080 -1.920 7.657
300 1HB PRO 44 2HB PRO 44 7.299 -3.084 9.282
301 2HB PRO 44 1HB PRO 44 7.538 -1.329 9.281
302 1HG PRO 44 2HG PRO 44 5.381 -2.950 7.983
303 2HG PRO 44 1HG PRO 44 5.251 -1.422 8.872
304 1HD PRO 44 2HD PRO 44 5.302 -1.614 6.130
305 2HD PRO 44 1HD PRO 44 5.799 -0.172 7.038
306 H SER 45 H SER 45 9.716 -4.066 8.250
307 HA SER 45 HA SER 45 10.206 -6.237 7.781
308 1HB SER 45 2HB SER 45 7.762 -6.336 8.645
309 2HB SER 45 1HB SER 45 7.341 -6.641 6.960
310 HG SER 45 HG SER 45 7.853 -8.629 7.370
311 H VAL 46 H VAL 46 9.847 -8.042 6.022
312 HA VAL 46 HA VAL 46 10.149 -6.715 3.413
313 HB VAL 46 HB VAL 46 12.033 -8.161 4.571
314 1HG1 VAL 46 1HG1 VAL 46 10.309 -10.137 4.554
315 2HG1 VAL 46 2HG1 VAL 46 12.024 -10.425 4.261
316 3HG1 VAL 46 3HG1 VAL 46 10.899 -10.344 2.904
317 1HG2 VAL 46 1HG2 VAL 46 12.941 -7.526 2.653
318 2HG2 VAL 46 2HG2 VAL 46 11.367 -7.490 1.858
319 3HG2 VAL 46 3HG2 VAL 46 12.289 -8.993 1.922
320 H LYS 47 H LYS 47 9.961 -8.889 1.763
321 HA LYS 47 HA LYS 47 7.094 -9.418 1.872
322 1HB LYS 47 2HB LYS 47 7.283 -10.041 -0.460
323 2HB LYS 47 1HB LYS 47 8.079 -8.496 -0.202
324 1HG LYS 47 2HG LYS 47 9.736 -9.418 -1.389
325 2HG LYS 47 1HG LYS 47 10.156 -10.197 0.138
326 1HD LYS 47 2HD LYS 47 9.368 -12.233 -0.525
327 2HD LYS 47 1HD LYS 47 8.132 -11.533 -1.574
328 1HE LYS 47 2HE LYS 47 10.510 -10.744 -2.742
329 2HE LYS 47 1HE LYS 47 10.841 -12.387 -2.194
330 1HZ LYS 47 1HZ LYS 47 8.543 -12.848 -3.302
331 2HZ LYS 47 2HZ LYS 47 9.946 -12.774 -4.244
332 3HZ LYS 47 3HZ LYS 47 8.898 -11.447 -4.181
333 H LYS 48 H LYS 48 6.203 -11.404 2.077
334 HA LYS 48 HA LYS 48 7.946 -13.756 2.042
335 1HB LYS 48 2HB LYS 48 6.474 -12.681 4.389
336 2HB LYS 48 1HB LYS 48 6.439 -14.424 4.158
337 1HG LYS 48 2HG LYS 48 8.857 -14.510 4.200
338 2HG LYS 48 1HG LYS 48 8.938 -12.752 4.335
339 1HD LYS 48 2HD LYS 48 9.240 -13.593 6.525
340 2HD LYS 48 1HD LYS 48 7.584 -12.986 6.460
341 1HE LYS 48 2HE LYS 48 7.721 -15.155 7.598
342 2HE LYS 48 1HE LYS 48 6.745 -15.240 6.132
343 1HZ LYS 48 1HZ LYS 48 8.388 -16.407 5.012
344 2HZ LYS 48 2HZ LYS 48 8.446 -17.079 6.563
345 3HZ LYS 48 3HZ LYS 48 9.611 -15.947 6.089
346 H GLY 49 H GLY 49 6.606 -13.662 -0.047
347 1HA GLY 49 2HA GLY 49 5.181 -15.220 -1.135
348 2HA GLY 49 1HA GLY 49 4.272 -15.393 0.366
349 H ILE 50 H ILE 50 3.336 -13.127 1.092
350 HA ILE 50 HA ILE 50 1.306 -12.466 -0.682
351 HB ILE 50 HB ILE 50 2.388 -10.739 1.531
352 1HG1 ILE 50 2HG1 ILE 50 1.927 -12.841 2.504
353 2HG1 ILE 50 1HG1 ILE 50 0.489 -11.873 2.795
354 1HG2 ILE 50 1HG2 ILE 50 0.766 -9.724 -0.139
355 2HG2 ILE 50 2HG2 ILE 50 0.292 -9.658 1.559
356 3HG2 ILE 50 3HG2 ILE 50 -0.429 -10.859 0.488
357 1HD1 ILE 50 1HD1 ILE 50 -0.225 -13.030 0.495
358 2HD1 ILE 50 2HD1 ILE 50 -0.550 -13.730 2.081
359 3HD1 ILE 50 3HD1 ILE 50 0.842 -14.275 1.144
360 H GLY 51 H GLY 51 1.123 -11.072 -2.348
361 1HA GLY 51 2HA GLY 51 3.407 -9.912 -3.525
362 2HA GLY 51 1HA GLY 51 1.743 -9.593 -3.989
363 H ILE 52 H ILE 52 4.291 -8.683 -1.720
364 HA ILE 52 HA ILE 52 2.867 -6.194 -1.122
365 HB ILE 52 HB ILE 52 3.735 -7.475 0.791
366 1HG1 ILE 52 2HG1 ILE 52 5.356 -4.947 0.534
367 2HG1 ILE 52 1HG1 ILE 52 3.598 -4.911 0.700
368 1HG2 ILE 52 1HG2 ILE 52 5.685 -8.461 -0.329
369 2HG2 ILE 52 2HG2 ILE 52 6.120 -7.676 1.189
370 3HG2 ILE 52 3HG2 ILE 52 6.463 -6.879 -0.344
371 1HD1 ILE 52 1HD1 ILE 52 5.159 -4.699 2.785
372 2HD1 ILE 52 2HD1 ILE 52 5.196 -6.458 2.674
373 3HD1 ILE 52 3HD1 ILE 52 3.658 -5.620 2.871
374 H ASN 53 H ASN 53 3.445 -4.312 -1.989
375 HA ASN 53 HA ASN 53 6.159 -3.958 -3.018
376 1HB ASN 53 2HB ASN 53 5.259 -2.960 -5.120
377 2HB ASN 53 1HB ASN 53 4.931 -4.689 -4.969
378 1HD2 ASN 53 1HD2 ASN 53 3.552 -1.481 -4.747
379 2HD2 ASN 53 2HD2 ASN 53 1.906 -1.967 -4.943
380 H CYS 54 H CYS 54 6.956 -2.106 -2.294
381 HA CYS 54 HA CYS 54 5.122 -0.083 -1.257
382 1HB CYS 54 2HB CYS 54 8.105 -0.464 -0.940
383 2HB CYS 54 1HB CYS 54 7.214 0.907 -0.272
384 H CYS 55 H CYS 55 4.678 1.712 -2.331
385 HA CYS 55 HA CYS 55 6.437 2.482 -4.564
386 1HB CYS 55 2HB CYS 55 4.321 3.765 -5.324
387 2HB CYS 55 1HB CYS 55 4.360 2.013 -5.530
388 H THR 56 H THR 56 6.011 4.966 -5.087
389 HA THR 56 HA THR 56 5.908 6.533 -2.626
390 HB THR 56 HB THR 56 8.261 6.027 -2.830
391 HG1 THR 56 1HG THR 56 9.041 8.125 -2.949
392 1HG2 THR 56 1HG2 THR 56 9.110 5.581 -4.830
393 2HG2 THR 56 2HG2 THR 56 9.193 7.327 -5.068
394 3HG2 THR 56 3HG2 THR 56 7.802 6.421 -5.662
395 H THR 57 H THR 57 3.848 6.794 -4.069
396 HA THR 57 HA THR 57 4.082 9.391 -5.309
397 HB THR 57 HB THR 57 2.584 8.208 -7.253
398 HG1 THR 57 1HG THR 57 4.690 6.411 -6.653
399 1HG2 THR 57 1HG2 THR 57 5.429 8.993 -7.085
400 2HG2 THR 57 2HG2 THR 57 4.140 9.597 -8.127
401 3HG2 THR 57 3HG2 THR 57 4.915 8.054 -8.486
402 H ASP 58 H ASP 58 2.012 10.402 -5.690
403 HA ASP 58 HA ASP 58 0.172 9.999 -3.641
404 1HB ASP 58 2HB ASP 58 -1.268 11.561 -4.917
405 2HB ASP 58 1HB ASP 58 0.385 12.137 -4.763
406 H ARG 59 H ARG 59 -1.368 8.532 -3.363
407 HA ARG 59 HA ARG 59 -2.848 6.847 -3.750
408 1HB ARG 59 2HB ARG 59 -3.207 8.233 -6.414
409 2HB ARG 59 1HB ARG 59 -4.318 7.077 -5.693
410 1HG ARG 59 2HG ARG 59 -4.638 8.651 -3.797
411 2HG ARG 59 1HG ARG 59 -3.644 9.826 -4.669
412 1HD ARG 59 2HD ARG 59 -5.258 10.254 -6.212
413 2HD ARG 59 1HD ARG 59 -5.911 8.612 -6.143
414 HE ARG 59 HE ARG 59 -6.440 9.903 -3.709
415 1HH1 ARG 59 1HH1 ARG 59 -7.387 10.049 -7.064
416 2HH1 ARG 59 2HH1 ARG 59 -8.966 10.672 -6.721
417 1HH2 ARG 59 1HH2 ARG 59 -8.515 10.721 -3.254
418 2HH2 ARG 59 2HH2 ARG 59 -9.606 11.054 -4.558
419 H CYS 60 H CYS 60 -0.031 6.519 -4.547
420 HA CYS 60 HA CYS 60 0.199 5.098 -6.951
421 1HB CYS 60 2HB CYS 60 2.341 4.379 -6.119
422 2HB CYS 60 1HB CYS 60 2.089 6.055 -5.639
423 H ASN 61 H ASN 61 -1.170 4.212 -3.930
424 HA ASN 61 HA ASN 61 -0.989 1.355 -4.552
425 1HB ASN 61 2HB ASN 61 -1.968 1.067 -2.256
426 2HB ASN 61 1HB ASN 61 -0.399 1.877 -2.281
427 1HD2 ASN 61 1HD2 ASN 61 -0.996 2.639 -0.172
428 2HD2 ASN 61 2HD2 ASN 61 -2.014 4.038 -0.019
429 H ASN 62 H ASN 62 -2.591 2.861 -6.263
430 HA ASN 62 HA ASN 62 -5.348 2.463 -5.410
431 1HB ASN 62 2HB ASN 62 -4.518 4.526 -6.677
432 2HB ASN 62 1HB ASN 62 -4.434 3.482 -8.099
433 1HD2 ASN 62 1HD2 ASN 62 -6.075 3.951 -9.360
434 2HD2 ASN 62 2HD2 ASN 62 -7.727 4.150 -8.857
Start of MODEL 5
1 1H LEU 1 1HT LEU 1 2.350 14.702 1.893
2 2H LEU 1 2HT LEU 1 1.897 13.431 2.955
3 3H LEU 1 3HT LEU 1 0.763 14.650 2.538
4 HA LEU 1 HA LEU 1 1.069 13.917 0.187
5 1HB LEU 1 2HB LEU 1 3.122 12.525 1.172
6 2HB LEU 1 1HB LEU 1 1.879 11.302 1.352
7 HG LEU 1 HG LEU 1 1.555 12.237 -1.256
8 1HD1 LEU 1 1HD1 LEU 1 3.592 12.454 -2.276
9 2HD1 LEU 1 2HD1 LEU 1 4.444 11.561 -1.015
10 3HD1 LEU 1 3HD1 LEU 1 3.926 13.222 -0.724
11 1HD2 LEU 1 1HD2 LEU 1 1.447 9.898 -0.212
12 2HD2 LEU 1 2HD2 LEU 1 3.177 9.818 -0.544
13 3HD2 LEU 1 3HD2 LEU 1 2.034 10.037 -1.869
14 H GLU 2 H GLU 2 -0.306 11.964 -0.570
15 HA GLU 2 HA GLU 2 -2.321 11.254 1.442
16 1HB GLU 2 2HB GLU 2 -2.777 12.644 -1.179
17 2HB GLU 2 1HB GLU 2 -4.026 11.616 -0.490
18 1HG GLU 2 2HG GLU 2 -4.191 12.985 1.451
19 2HG GLU 2 1HG GLU 2 -2.767 13.919 0.978
20 H CYS 3 H CYS 3 -3.449 9.322 1.035
21 HA CYS 3 HA CYS 3 -2.876 7.777 -1.331
22 1HB CYS 3 2HB CYS 3 -1.500 7.270 1.247
23 2HB CYS 3 1HB CYS 3 -2.132 5.854 0.404
24 H HIS 4 H HIS 4 -3.692 5.338 -0.718
25 HA HIS 4 HA HIS 4 -6.477 5.732 -0.038
26 1HB HIS 4 2HB HIS 4 -4.876 3.461 -1.191
27 2HB HIS 4 1HB HIS 4 -6.537 3.224 -0.648
28 HD1 HIS 4 1HD HIS 4 -8.375 4.716 -1.916
29 HD2 HIS 4 2HD HIS 4 -4.620 4.534 -3.689
30 HE1 HIS 4 1HE HIS 4 -8.708 5.511 -4.278
31 HE2 HIS 4 2HE HIS 4 -6.442 5.297 -5.359
32 H ASN 5 H ASN 5 -7.586 4.658 1.608
33 HA ASN 5 HA ASN 5 -5.869 3.641 3.770
34 1HB ASN 5 2HB ASN 5 -7.895 4.206 5.229
35 2HB ASN 5 1HB ASN 5 -6.987 5.566 4.572
36 1HD2 ASN 5 1HD2 ASN 5 -9.232 6.334 5.344
37 2HD2 ASN 5 2HD2 ASN 5 -10.401 6.481 4.078
38 H GLN 6 H GLN 6 -9.017 3.171 2.221
39 HA GLN 6 HA GLN 6 -9.485 0.664 3.530
40 1HB GLN 6 2HB GLN 6 -11.173 2.406 2.483
41 2HB GLN 6 1HB GLN 6 -10.924 1.440 1.028
42 1HG GLN 6 2HG GLN 6 -12.408 -0.021 1.758
43 2HG GLN 6 1HG GLN 6 -11.391 -0.355 3.159
44 1HE2 GLN 6 1HE2 GLN 6 -11.869 0.592 5.118
45 2HE2 GLN 6 2HE2 GLN 6 -13.363 1.403 5.426
46 H GLN 7 H GLN 7 -9.900 -1.349 2.258
47 HA GLN 7 HA GLN 7 -7.848 -1.651 0.168
48 1HB GLN 7 2HB GLN 7 -7.751 -4.038 0.846
49 2HB GLN 7 1HB GLN 7 -7.269 -2.930 2.128
50 1HG GLN 7 2HG GLN 7 -10.087 -3.897 1.980
51 2HG GLN 7 1HG GLN 7 -8.829 -4.938 2.647
52 1HE2 GLN 7 1HE2 GLN 7 -7.271 -3.384 4.081
53 2HE2 GLN 7 2HE2 GLN 7 -8.140 -2.567 5.332
54 H SER 8 H SER 8 -8.396 -3.858 -1.086
55 HA SER 8 HA SER 8 -9.682 -4.807 -2.702
56 1HB SER 8 2HB SER 8 -11.822 -5.528 -2.100
57 2HB SER 8 1HB SER 8 -11.045 -5.289 -0.535
58 HG SER 8 HG SER 8 -13.243 -4.346 -0.931
59 H SER 9 H SER 9 -12.178 -4.210 -3.736
60 HA SER 9 HA SER 9 -11.726 -1.500 -4.787
61 1HB SER 9 2HB SER 9 -12.833 -2.218 -6.823
62 2HB SER 9 1HB SER 9 -11.555 -3.366 -6.426
63 HG SER 9 HG SER 9 -13.968 -4.000 -6.939
64 H GLN 10 H GLN 10 -13.966 -3.521 -3.117
65 HA GLN 10 HA GLN 10 -16.340 -2.083 -3.697
66 1HB GLN 10 2HB GLN 10 -15.511 -4.098 -1.657
67 2HB GLN 10 1HB GLN 10 -16.989 -3.178 -1.373
68 1HG GLN 10 2HG GLN 10 -17.021 -4.111 -4.056
69 2HG GLN 10 1HG GLN 10 -16.605 -5.461 -3.001
70 1HE2 GLN 10 1HE2 GLN 10 -18.678 -2.658 -2.410
71 2HE2 GLN 10 2HE2 GLN 10 -20.124 -3.569 -2.105
72 H THR 11 H THR 11 -16.884 -0.115 -3.077
73 HA THR 11 HA THR 11 -16.906 1.886 -1.997
74 HB THR 11 HB THR 11 -16.561 0.101 0.417
75 HG1 THR 11 1HG THR 11 -18.382 -0.367 -0.942
76 1HG2 THR 11 1HG2 THR 11 -17.223 1.779 1.794
77 2HG2 THR 11 2HG2 THR 11 -18.091 2.636 0.519
78 3HG2 THR 11 3HG2 THR 11 -16.331 2.720 0.598
79 HA PRO 12 HA PRO 12 -12.279 1.996 -1.460
80 1HB PRO 12 2HB PRO 12 -11.645 3.386 -3.662
81 2HB PRO 12 1HB PRO 12 -11.917 1.640 -3.720
82 1HG PRO 12 2HG PRO 12 -13.755 3.873 -4.490
83 2HG PRO 12 1HG PRO 12 -13.456 2.331 -5.317
84 1HD PRO 12 2HD PRO 12 -15.613 2.817 -3.679
85 2HD PRO 12 1HD PRO 12 -14.944 1.201 -3.997
86 H THR 13 H THR 13 -11.257 3.638 -0.419
87 HA THR 13 HA THR 13 -12.383 6.344 -0.645
88 HB THR 13 HB THR 13 -11.704 6.402 1.930
89 HG1 THR 13 1HG THR 13 -12.564 3.729 1.565
90 1HG2 THR 13 1HG2 THR 13 -13.919 6.343 2.501
91 2HG2 THR 13 2HG2 THR 13 -14.288 5.036 1.376
92 3HG2 THR 13 3HG2 THR 13 -14.020 6.671 0.772
93 H THR 14 H THR 14 -10.810 7.829 0.833
94 HA THR 14 HA THR 14 -8.039 7.144 0.124
95 HB THR 14 HB THR 14 -7.815 9.702 -0.303
96 HG1 THR 14 1HG THR 14 -10.583 9.325 -0.784
97 1HG2 THR 14 1HG2 THR 14 -7.713 7.845 -2.034
98 2HG2 THR 14 2HG2 THR 14 -8.136 9.461 -2.599
99 3HG2 THR 14 3HG2 THR 14 -9.394 8.242 -2.386
100 H THR 15 H THR 15 -6.476 8.724 1.232
101 HA THR 15 HA THR 15 -7.359 9.894 3.705
102 HB THR 15 HB THR 15 -7.265 7.501 4.308
103 HG1 THR 15 1HG THR 15 -6.315 7.916 6.175
104 1HG2 THR 15 1HG2 THR 15 -4.333 7.697 3.663
105 2HG2 THR 15 2HG2 THR 15 -5.526 6.736 2.788
106 3HG2 THR 15 3HG2 THR 15 -5.136 6.345 4.463
107 H GLY 16 H GLY 16 -5.018 10.067 5.074
108 1HA GLY 16 2HA GLY 16 -2.862 10.770 3.345
109 2HA GLY 16 1HA GLY 16 -3.667 12.162 4.041
110 H CYS 17 H CYS 17 -1.186 9.989 4.427
111 HA CYS 17 HA CYS 17 -1.184 9.863 7.306
112 1HB CYS 17 2HB CYS 17 1.037 9.184 5.365
113 2HB CYS 17 1HB CYS 17 0.948 8.715 7.065
114 H SER 18 H SER 18 1.312 10.351 8.126
115 HA SER 18 HA SER 18 1.414 13.216 8.159
116 1HB SER 18 2HB SER 18 3.658 12.534 9.470
117 2HB SER 18 1HB SER 18 2.063 12.467 10.220
118 HG SER 18 HG SER 18 3.233 10.524 10.518
119 H GLY 19 H GLY 19 3.131 14.545 7.471
120 1HA GLY 19 2HA GLY 19 4.120 14.148 4.948
121 2HA GLY 19 1HA GLY 19 4.850 15.235 6.116
122 H GLY 20 H GLY 20 5.781 13.425 8.003
123 1HA GLY 20 2HA GLY 20 8.270 12.745 7.079
124 2HA GLY 20 1HA GLY 20 7.498 11.972 8.459
125 H GLU 21 H GLU 21 5.310 10.943 6.722
126 HA GLU 21 HA GLU 21 6.826 8.745 5.479
127 1HB GLU 21 2HB GLU 21 5.211 8.399 7.531
128 2HB GLU 21 1HB GLU 21 3.960 8.453 6.289
129 1HG GLU 21 2HG GLU 21 4.425 6.397 5.582
130 2HG GLU 21 1HG GLU 21 6.163 6.695 5.584
131 H ASN 22 H ASN 22 6.963 9.405 3.384
132 HA ASN 22 HA ASN 22 4.458 10.114 2.013
133 1HB ASN 22 2HB ASN 22 7.337 10.785 1.495
134 2HB ASN 22 1HB ASN 22 6.175 10.825 0.172
135 1HD2 ASN 22 1HD2 ASN 22 6.910 13.113 0.210
136 2HD2 ASN 22 2HD2 ASN 22 6.045 14.213 1.223
137 H ASN 23 H ASN 23 5.434 7.377 2.701
138 HA ASN 23 HA ASN 23 5.524 6.292 -0.037
139 1HB ASN 23 2HB ASN 23 6.729 5.003 2.416
140 2HB ASN 23 1HB ASN 23 6.893 4.468 0.742
141 1HD2 ASN 23 1HD2 ASN 23 7.335 6.972 -0.437
142 2HD2 ASN 23 2HD2 ASN 23 8.895 7.542 0.067
143 H CYS 24 H CYS 24 4.116 4.683 -0.542
144 HA CYS 24 HA CYS 24 2.420 3.626 1.617
145 1HB CYS 24 2HB CYS 24 1.357 4.376 -1.107
146 2HB CYS 24 1HB CYS 24 0.437 3.915 0.328
147 H TYR 25 H TYR 25 2.596 1.492 1.684
148 HA TYR 25 HA TYR 25 3.537 0.041 -0.592
149 1HB TYR 25 2HB TYR 25 3.955 -1.751 0.904
150 2HB TYR 25 1HB TYR 25 4.435 -0.279 1.741
151 HD1 TYR 25 1HD TYR 25 2.845 0.692 3.460
152 HD2 TYR 25 2HD TYR 25 2.348 -3.210 1.831
153 HE1 TYR 25 1HE TYR 25 1.397 0.093 5.352
154 HE2 TYR 25 2HE TYR 25 0.898 -3.818 3.720
155 HH TYR 25 HH TYR 25 0.673 -2.922 6.231
156 H LYS 26 H LYS 26 2.536 -1.971 -1.263
157 HA LYS 26 HA LYS 26 -0.357 -2.115 -0.771
158 1HB LYS 26 2HB LYS 26 0.246 -0.985 -2.985
159 2HB LYS 26 1HB LYS 26 0.860 -2.557 -3.499
160 1HG LYS 26 2HG LYS 26 -1.866 -2.571 -2.398
161 2HG LYS 26 1HG LYS 26 -1.663 -1.693 -3.915
162 1HD LYS 26 2HD LYS 26 -0.424 -4.386 -3.677
163 2HD LYS 26 1HD LYS 26 -2.177 -4.290 -3.863
164 1HE LYS 26 2HE LYS 26 -1.686 -2.723 -5.833
165 2HE LYS 26 1HE LYS 26 -0.033 -3.331 -5.732
166 1HZ LYS 26 1HZ LYS 26 -0.626 -5.337 -6.532
167 2HZ LYS 26 2HZ LYS 26 -1.909 -4.469 -7.214
168 3HZ LYS 26 3HZ LYS 26 -2.141 -5.334 -5.779
169 H LYS 27 H LYS 27 -0.521 -3.987 0.321
170 HA LYS 27 HA LYS 27 1.127 -6.253 -0.507
171 1HB LYS 27 2HB LYS 27 0.203 -7.211 1.686
172 2HB LYS 27 1HB LYS 27 1.375 -5.913 1.788
173 1HG LYS 27 2HG LYS 27 -0.341 -4.319 2.268
174 2HG LYS 27 1HG LYS 27 -1.599 -5.516 1.956
175 1HD LYS 27 2HD LYS 27 0.470 -5.780 4.131
176 2HD LYS 27 1HD LYS 27 -1.137 -5.095 4.381
177 1HE LYS 27 2HE LYS 27 -2.041 -7.267 3.424
178 2HE LYS 27 1HE LYS 27 -0.408 -7.906 3.607
179 1HZ LYS 27 1HZ LYS 27 -0.827 -6.872 6.028
180 2HZ LYS 27 2HZ LYS 27 -1.168 -8.479 5.625
181 3HZ LYS 27 3HZ LYS 27 -2.406 -7.327 5.626
182 H GLU 28 H GLU 28 0.297 -7.854 -1.648
183 HA GLU 28 HA GLU 28 -2.622 -8.242 -1.633
184 1HB GLU 28 2HB GLU 28 -1.872 -9.362 -3.986
185 2HB GLU 28 1HB GLU 28 -2.444 -7.705 -3.821
186 1HG GLU 28 2HG GLU 28 -0.297 -6.823 -3.972
187 2HG GLU 28 1HG GLU 28 0.466 -8.364 -3.583
188 H TRP 29 H TRP 29 -3.391 -10.385 -1.766
189 HA TRP 29 HA TRP 29 -1.578 -12.627 -1.718
190 1HB TRP 29 2HB TRP 29 -2.026 -13.392 0.510
191 2HB TRP 29 1HB TRP 29 -1.469 -11.728 0.635
192 HD1 TRP 29 HD TRP 29 -4.002 -13.919 1.953
193 HE1 TRP 29 1HE TRP 29 -5.949 -12.615 3.023
194 HE3 TRP 29 3HE TRP 29 -3.004 -9.287 0.052
195 HZ2 TRP 29 2HZ TRP 29 -6.923 -9.965 3.054
196 HZ3 TRP 29 3HZ TRP 29 -4.487 -7.422 0.649
197 HH2 TRP 29 HH TRP 29 -6.404 -7.751 2.121
198 H ARG 30 H ARG 30 -2.633 -14.502 -2.308
199 HA ARG 30 HA ARG 30 -5.498 -14.253 -2.837
200 1HB ARG 30 2HB ARG 30 -4.993 -16.395 -4.213
201 2HB ARG 30 1HB ARG 30 -4.482 -14.832 -4.842
202 1HG ARG 30 2HG ARG 30 -2.215 -15.259 -4.013
203 2HG ARG 30 1HG ARG 30 -2.740 -16.834 -3.412
204 1HD ARG 30 2HD ARG 30 -3.027 -17.691 -5.554
205 2HD ARG 30 1HD ARG 30 -3.140 -16.092 -6.284
206 HE ARG 30 HE ARG 30 -0.845 -16.009 -6.407
207 1HH1 ARG 30 1HH1 ARG 30 -1.800 -18.710 -4.412
208 2HH1 ARG 30 2HH1 ARG 30 -0.208 -19.390 -4.355
209 1HH2 ARG 30 1HH2 ARG 30 1.247 -16.901 -6.331
210 2HH2 ARG 30 2HH2 ARG 30 1.522 -18.362 -5.442
211 H ASP 31 H ASP 31 -6.771 -16.321 -2.649
212 HA ASP 31 HA ASP 31 -5.898 -17.873 -0.301
213 1HB ASP 31 2HB ASP 31 -8.403 -18.010 0.244
214 2HB ASP 31 1HB ASP 31 -7.587 -16.478 0.566
215 H ASN 32 H ASN 32 -8.225 -17.862 -3.003
216 HA ASN 32 HA ASN 32 -7.395 -20.355 -4.007
217 1HB ASN 32 2HB ASN 32 -8.871 -20.723 -1.739
218 2HB ASN 32 1HB ASN 32 -10.122 -20.788 -2.976
219 1HD2 ASN 32 1HD2 ASN 32 -7.322 -22.317 -1.648
220 2HD2 ASN 32 2HD2 ASN 32 -7.445 -23.790 -2.541
221 H ARG 33 H ARG 33 -10.677 -19.024 -3.585
222 HA ARG 33 HA ARG 33 -11.257 -19.244 -6.354
223 1HB ARG 33 2HB ARG 33 -13.348 -18.070 -5.757
224 2HB ARG 33 1HB ARG 33 -13.023 -19.453 -4.715
225 1HG ARG 33 2HG ARG 33 -11.846 -17.496 -3.303
226 2HG ARG 33 1HG ARG 33 -13.132 -16.581 -4.087
227 1HD ARG 33 2HD ARG 33 -14.801 -18.073 -3.205
228 2HD ARG 33 1HD ARG 33 -13.559 -19.137 -2.545
229 HE ARG 33 HE ARG 33 -13.018 -16.813 -1.320
230 1HH1 ARG 33 1HH1 ARG 33 -16.001 -18.580 -1.735
231 2HH1 ARG 33 2HH1 ARG 33 -16.692 -18.002 -0.257
232 1HH2 ARG 33 1HH2 ARG 33 -13.928 -16.054 0.623
233 2HH2 ARG 33 2HH2 ARG 33 -15.517 -16.569 1.082
234 H GLY 34 H GLY 34 -10.345 -16.589 -4.218
235 1HA GLY 34 2HA GLY 34 -9.650 -15.006 -6.582
236 2HA GLY 34 1HA GLY 34 -10.769 -14.301 -5.427
237 H TYR 35 H TYR 35 -9.345 -12.600 -4.966
238 HA TYR 35 HA TYR 35 -7.420 -13.222 -2.915
239 1HB TYR 35 2HB TYR 35 -5.629 -11.829 -4.133
240 2HB TYR 35 1HB TYR 35 -5.872 -13.491 -4.657
241 HD1 TYR 35 1HD TYR 35 -5.963 -13.871 -6.927
242 HD2 TYR 35 2HD TYR 35 -7.186 -10.077 -5.442
243 HE1 TYR 35 1HE TYR 35 -6.331 -13.096 -9.231
244 HE2 TYR 35 2HE TYR 35 -7.558 -9.290 -7.742
245 HH TYR 35 HH TYR 35 -6.457 -11.013 -10.475
246 H ARG 36 H ARG 36 -6.328 -11.095 -2.166
247 HA ARG 36 HA ARG 36 -8.067 -8.779 -2.567
248 1HB ARG 36 2HB ARG 36 -7.331 -9.730 0.203
249 2HB ARG 36 1HB ARG 36 -8.426 -8.416 -0.229
250 1HG ARG 36 2HG ARG 36 -10.028 -9.937 0.113
251 2HG ARG 36 1HG ARG 36 -9.593 -10.516 -1.496
252 1HD ARG 36 2HD ARG 36 -9.069 -12.483 -0.610
253 2HD ARG 36 1HD ARG 36 -7.779 -11.701 0.303
254 HE ARG 36 HE ARG 36 -9.073 -11.834 2.191
255 1HH1 ARG 36 1HH1 ARG 36 -11.062 -12.485 -0.602
256 2HH1 ARG 36 2HH1 ARG 36 -12.426 -12.996 0.333
257 1HH2 ARG 36 1HH2 ARG 36 -10.866 -12.507 3.423
258 2HH2 ARG 36 2HH2 ARG 36 -12.316 -13.009 2.618
259 H THR 37 H THR 37 -7.143 -6.778 -1.734
260 HA THR 37 HA THR 37 -4.274 -6.839 -1.179
261 HB THR 37 HB THR 37 -3.661 -5.413 -2.943
262 HG1 THR 37 1HG THR 37 -4.993 -3.884 -3.418
263 1HG2 THR 37 1HG2 THR 37 -4.442 -7.782 -3.655
264 2HG2 THR 37 2HG2 THR 37 -4.100 -6.562 -4.882
265 3HG2 THR 37 3HG2 THR 37 -5.767 -6.911 -4.426
266 H GLU 38 H GLU 38 -3.747 -5.412 0.384
267 HA GLU 38 HA GLU 38 -5.681 -3.273 0.962
268 1HB GLU 38 2HB GLU 38 -4.380 -3.481 3.298
269 2HB GLU 38 1HB GLU 38 -5.843 -4.376 2.932
270 1HG GLU 38 2HG GLU 38 -4.140 -6.172 2.059
271 2HG GLU 38 1HG GLU 38 -3.030 -5.316 3.126
272 H ARG 39 H ARG 39 -4.875 -1.256 1.645
273 HA ARG 39 HA ARG 39 -2.235 -0.664 0.540
274 1HB ARG 39 2HB ARG 39 -4.039 1.478 1.566
275 2HB ARG 39 1HB ARG 39 -2.955 1.494 0.184
276 1HG ARG 39 2HG ARG 39 -5.591 0.045 0.324
277 2HG ARG 39 1HG ARG 39 -5.298 1.580 -0.492
278 1HD ARG 39 2HD ARG 39 -3.568 0.385 -1.877
279 2HD ARG 39 1HD ARG 39 -4.160 -1.121 -1.178
280 HE ARG 39 HE ARG 39 -6.287 0.388 -2.296
281 1HH1 ARG 39 1HH1 ARG 39 -3.607 -1.668 -3.168
282 2HH1 ARG 39 2HH1 ARG 39 -4.334 -2.202 -4.645
283 1HH2 ARG 39 1HH2 ARG 39 -7.247 -0.314 -4.238
284 2HH2 ARG 39 2HH2 ARG 39 -6.401 -1.435 -5.253
285 H GLY 40 H GLY 40 -1.567 1.628 1.885
286 1HA GLY 40 2HA GLY 40 -1.674 1.896 4.558
287 2HA GLY 40 1HA GLY 40 -0.583 0.523 4.379
288 H CYS 41 H CYS 41 0.361 2.726 5.622
289 HA CYS 41 HA CYS 41 1.969 4.124 3.594
290 1HB CYS 41 2HB CYS 41 0.850 4.912 6.222
291 2HB CYS 41 1HB CYS 41 2.464 5.522 5.852
292 H GLY 42 H GLY 42 4.228 4.454 3.995
293 1HA GLY 42 2HA GLY 42 6.323 3.897 4.796
294 2HA GLY 42 1HA GLY 42 5.548 3.066 6.136
295 H CYS 43 H CYS 43 7.821 2.126 4.705
296 HA CYS 43 HA CYS 43 6.682 -0.287 3.454
297 1HB CYS 43 2HB CYS 43 7.936 1.291 1.903
298 2HB CYS 43 1HB CYS 43 9.391 0.867 2.798
299 HA PRO 44 HA PRO 44 8.909 -1.500 7.376
300 1HB PRO 44 2HB PRO 44 6.937 -3.702 7.049
301 2HB PRO 44 1HB PRO 44 7.375 -2.785 8.500
302 1HG PRO 44 2HG PRO 44 5.063 -2.339 7.253
303 2HG PRO 44 1HG PRO 44 5.999 -1.003 7.948
304 1HD PRO 44 2HD PRO 44 5.724 -1.843 5.093
305 2HD PRO 44 1HD PRO 44 5.824 -0.212 5.785
306 H SER 45 H SER 45 9.299 -4.130 7.821
307 HA SER 45 HA SER 45 10.402 -5.228 5.328
308 1HB SER 45 2HB SER 45 11.844 -4.570 7.854
309 2HB SER 45 1HB SER 45 12.315 -6.038 6.999
310 HG SER 45 HG SER 45 13.523 -4.578 6.004
311 H VAL 46 H VAL 46 8.019 -6.072 6.296
312 HA VAL 46 HA VAL 46 8.326 -8.323 8.054
313 HB VAL 46 HB VAL 46 5.920 -8.763 7.371
314 1HG1 VAL 46 1HG1 VAL 46 5.062 -6.834 8.680
315 2HG1 VAL 46 2HG1 VAL 46 6.674 -6.124 8.610
316 3HG1 VAL 46 3HG1 VAL 46 6.423 -7.658 9.441
317 1HG2 VAL 46 1HG2 VAL 46 6.258 -7.404 5.209
318 2HG2 VAL 46 2HG2 VAL 46 5.965 -5.997 6.232
319 3HG2 VAL 46 3HG2 VAL 46 4.730 -7.246 6.075
320 H LYS 47 H LYS 47 7.075 -10.405 7.196
321 HA LYS 47 HA LYS 47 8.701 -11.403 5.031
322 1HB LYS 47 2HB LYS 47 7.467 -13.555 5.514
323 2HB LYS 47 1HB LYS 47 8.400 -12.898 6.852
324 1HG LYS 47 2HG LYS 47 5.667 -11.933 6.851
325 2HG LYS 47 1HG LYS 47 5.758 -13.694 6.918
326 1HD LYS 47 2HD LYS 47 7.150 -13.613 8.866
327 2HD LYS 47 1HD LYS 47 7.315 -11.861 8.736
328 1HE LYS 47 2HE LYS 47 5.351 -11.487 9.750
329 2HE LYS 47 1HE LYS 47 4.542 -12.777 8.860
330 1HZ LYS 47 1HZ LYS 47 4.493 -13.671 10.924
331 2HZ LYS 47 2HZ LYS 47 5.883 -12.865 11.450
332 3HZ LYS 47 3HZ LYS 47 6.022 -14.235 10.469
333 H LYS 48 H LYS 48 8.148 -11.330 2.963
334 HA LYS 48 HA LYS 48 5.390 -10.739 2.232
335 1HB LYS 48 2HB LYS 48 6.280 -10.299 0.000
336 2HB LYS 48 1HB LYS 48 7.182 -9.409 1.218
337 1HG LYS 48 2HG LYS 48 8.277 -12.048 0.537
338 2HG LYS 48 1HG LYS 48 8.307 -10.854 -0.762
339 1HD LYS 48 2HD LYS 48 9.800 -9.517 0.317
340 2HD LYS 48 1HD LYS 48 9.200 -9.957 1.917
341 1HE LYS 48 2HE LYS 48 10.878 -11.389 2.151
342 2HE LYS 48 1HE LYS 48 10.311 -12.286 0.744
343 1HZ LYS 48 1HZ LYS 48 11.570 -10.622 -0.626
344 2HZ LYS 48 2HZ LYS 48 12.524 -11.664 0.303
345 3HZ LYS 48 3HZ LYS 48 12.276 -10.070 0.810
346 H GLY 49 H GLY 49 4.378 -11.892 0.421
347 1HA GLY 49 2HA GLY 49 5.360 -14.595 -0.084
348 2HA GLY 49 1HA GLY 49 3.814 -14.463 0.752
349 H ILE 50 H ILE 50 2.025 -13.525 -0.356
350 HA ILE 50 HA ILE 50 1.734 -14.321 -2.999
351 HB ILE 50 HB ILE 50 0.114 -12.393 -1.446
352 1HG1 ILE 50 2HG1 ILE 50 0.346 -14.741 -0.609
353 2HG1 ILE 50 1HG1 ILE 50 -1.298 -14.326 -1.073
354 1HG2 ILE 50 1HG2 ILE 50 -1.447 -13.544 -3.453
355 2HG2 ILE 50 2HG2 ILE 50 0.062 -13.133 -4.262
356 3HG2 ILE 50 3HG2 ILE 50 -0.852 -11.884 -3.419
357 1HD1 ILE 50 1HD1 ILE 50 -0.271 -15.379 -3.382
358 2HD1 ILE 50 2HD1 ILE 50 -1.278 -16.230 -2.211
359 3HD1 ILE 50 3HD1 ILE 50 0.479 -16.360 -2.123
360 H GLY 51 H GLY 51 1.817 -10.960 -1.818
361 1HA GLY 51 2HA GLY 51 3.536 -10.137 -3.971
362 2HA GLY 51 1HA GLY 51 1.871 -9.623 -4.199
363 H ILE 52 H ILE 52 4.393 -8.104 -3.699
364 HA ILE 52 HA ILE 52 3.280 -6.270 -1.772
365 HB ILE 52 HB ILE 52 4.488 -7.818 -0.298
366 1HG1 ILE 52 2HG1 ILE 52 6.279 -5.467 -0.221
367 2HG1 ILE 52 1HG1 ILE 52 4.551 -5.105 -0.234
368 1HG2 ILE 52 1HG2 ILE 52 6.855 -8.137 -0.424
369 2HG2 ILE 52 2HG2 ILE 52 6.990 -6.983 -1.751
370 3HG2 ILE 52 3HG2 ILE 52 6.164 -8.521 -2.001
371 1HD1 ILE 52 1HD1 ILE 52 6.199 -5.984 1.923
372 2HD1 ILE 52 2HD1 ILE 52 4.919 -7.163 1.639
373 3HD1 ILE 52 3HD1 ILE 52 4.512 -5.474 1.942
374 H ASN 53 H ASN 53 3.607 -4.292 -2.532
375 HA ASN 53 HA ASN 53 6.109 -3.673 -3.922
376 1HB ASN 53 2HB ASN 53 4.733 -2.345 -5.607
377 2HB ASN 53 1HB ASN 53 4.681 -4.104 -5.767
378 1HD2 ASN 53 1HD2 ASN 53 2.844 -5.178 -4.652
379 2HD2 ASN 53 2HD2 ASN 53 1.309 -4.387 -4.697
380 H CYS 54 H CYS 54 6.951 -1.767 -3.331
381 HA CYS 54 HA CYS 54 5.263 0.015 -1.707
382 1HB CYS 54 2HB CYS 54 8.196 -0.630 -1.628
383 2HB CYS 54 1HB CYS 54 7.590 0.876 -0.934
384 H CYS 55 H CYS 55 4.777 1.952 -2.494
385 HA CYS 55 HA CYS 55 6.497 3.081 -4.604
386 1HB CYS 55 2HB CYS 55 4.332 4.207 -5.405
387 2HB CYS 55 1HB CYS 55 4.526 2.486 -5.743
388 H THR 56 H THR 56 6.015 5.531 -4.852
389 HA THR 56 HA THR 56 5.499 6.779 -2.254
390 HB THR 56 HB THR 56 7.512 7.982 -2.187
391 HG1 THR 56 1HG THR 56 8.764 8.371 -3.897
392 1HG2 THR 56 1HG2 THR 56 7.716 5.360 -1.991
393 2HG2 THR 56 2HG2 THR 56 9.127 6.416 -1.916
394 3HG2 THR 56 3HG2 THR 56 8.729 5.581 -3.418
395 H THR 57 H THR 57 3.641 6.859 -4.132
396 HA THR 57 HA THR 57 3.728 9.642 -5.033
397 HB THR 57 HB THR 57 2.347 8.495 -7.083
398 HG1 THR 57 1HG THR 57 3.300 6.642 -7.681
399 1HG2 THR 57 1HG2 THR 57 5.002 9.615 -6.750
400 2HG2 THR 57 2HG2 THR 57 3.820 9.850 -8.038
401 3HG2 THR 57 3HG2 THR 57 4.900 8.457 -8.076
402 H ASP 58 H ASP 58 1.641 10.596 -5.356
403 HA ASP 58 HA ASP 58 -0.236 9.962 -3.408
404 1HB ASP 58 2HB ASP 58 -1.757 11.478 -4.793
405 2HB ASP 58 1HB ASP 58 -0.243 12.173 -4.228
406 H ARG 59 H ARG 59 -1.739 8.440 -3.273
407 HA ARG 59 HA ARG 59 -3.133 6.724 -3.807
408 1HB ARG 59 2HB ARG 59 -3.474 8.464 -6.247
409 2HB ARG 59 1HB ARG 59 -4.431 7.017 -5.965
410 1HG ARG 59 2HG ARG 59 -4.836 8.245 -3.629
411 2HG ARG 59 1HG ARG 59 -4.549 9.660 -4.652
412 1HD ARG 59 2HD ARG 59 -6.341 7.663 -5.832
413 2HD ARG 59 1HD ARG 59 -6.952 8.396 -4.343
414 HE ARG 59 HE ARG 59 -6.111 10.519 -5.814
415 1HH1 ARG 59 1HH1 ARG 59 -8.271 7.851 -6.442
416 2HH1 ARG 59 2HH1 ARG 59 -9.266 8.751 -7.536
417 1HH2 ARG 59 1HH2 ARG 59 -7.418 11.705 -7.252
418 2HH2 ARG 59 2HH2 ARG 59 -8.782 10.939 -7.997
419 H CYS 60 H CYS 60 -0.274 6.582 -4.595
420 HA CYS 60 HA CYS 60 0.013 5.290 -7.070
421 1HB CYS 60 2HB CYS 60 2.198 4.660 -6.291
422 2HB CYS 60 1HB CYS 60 1.857 6.291 -5.719
423 H ASN 61 H ASN 61 -1.153 4.184 -4.012
424 HA ASN 61 HA ASN 61 -0.858 1.377 -4.757
425 1HB ASN 61 2HB ASN 61 -1.759 0.935 -2.478
426 2HB ASN 61 1HB ASN 61 -0.300 1.929 -2.464
427 1HD2 ASN 61 1HD2 ASN 61 -0.890 2.654 -0.384
428 2HD2 ASN 61 2HD2 ASN 61 -2.108 3.875 -0.178
429 H ASN 62 H ASN 62 -2.529 2.709 -6.474
430 HA ASN 62 HA ASN 62 -5.271 2.276 -5.619
431 1HB ASN 62 2HB ASN 62 -4.297 4.180 -7.178
432 2HB ASN 62 1HB ASN 62 -4.559 2.973 -8.439
433 1HD2 ASN 62 1HD2 ASN 62 -6.023 4.749 -9.151
434 2HD2 ASN 62 2HD2 ASN 62 -7.658 4.716 -8.563
Start of MODEL 6
1 1H LEU 1 1HT LEU 1 0.815 14.781 2.286
2 2H LEU 1 2HT LEU 1 0.861 15.521 0.737
3 3H LEU 1 3HT LEU 1 2.317 15.024 1.497
4 HA LEU 1 HA LEU 1 1.487 13.575 -0.305
5 1HB LEU 1 2HB LEU 1 3.012 13.047 1.729
6 2HB LEU 1 1HB LEU 1 1.623 12.175 2.347
7 HG LEU 1 HG LEU 1 1.736 11.051 -0.070
8 1HD1 LEU 1 1HD1 LEU 1 3.900 12.628 -0.298
9 2HD1 LEU 1 2HD1 LEU 1 3.733 11.073 -1.115
10 3HD1 LEU 1 3HD1 LEU 1 4.644 11.183 0.391
11 1HD2 LEU 1 1HD2 LEU 1 3.027 10.417 2.524
12 2HD2 LEU 1 2HD2 LEU 1 3.465 9.428 1.129
13 3HD2 LEU 1 3HD2 LEU 1 1.779 9.545 1.635
14 H GLU 2 H GLU 2 -0.095 12.247 -1.072
15 HA GLU 2 HA GLU 2 -2.399 11.653 0.626
16 1HB GLU 2 2HB GLU 2 -2.731 13.814 -0.735
17 2HB GLU 2 1HB GLU 2 -2.818 12.761 -2.140
18 1HG GLU 2 2HG GLU 2 -4.875 12.029 -1.632
19 2HG GLU 2 1HG GLU 2 -4.542 11.980 0.103
20 H CYS 3 H CYS 3 -2.779 9.550 0.483
21 HA CYS 3 HA CYS 3 -2.386 8.217 -2.112
22 1HB CYS 3 2HB CYS 3 -1.215 7.561 0.527
23 2HB CYS 3 1HB CYS 3 -1.841 6.196 -0.401
24 H HIS 4 H HIS 4 -3.301 5.777 -1.699
25 HA HIS 4 HA HIS 4 -6.122 6.208 -1.175
26 1HB HIS 4 2HB HIS 4 -4.504 4.048 -2.487
27 2HB HIS 4 1HB HIS 4 -6.162 3.724 -1.982
28 HD1 HIS 4 1HD HIS 4 -8.036 5.221 -3.146
29 HD2 HIS 4 2HD HIS 4 -4.244 5.438 -4.834
30 HE1 HIS 4 1HE HIS 4 -8.368 6.253 -5.415
31 HE2 HIS 4 2HE HIS 4 -6.050 6.460 -6.379
32 H ASN 5 H ASN 5 -7.256 5.363 0.491
33 HA ASN 5 HA ASN 5 -5.721 3.959 2.558
34 1HB ASN 5 2HB ASN 5 -7.582 4.615 4.073
35 2HB ASN 5 1HB ASN 5 -6.800 6.001 3.316
36 1HD2 ASN 5 1HD2 ASN 5 -9.039 6.619 4.299
37 2HD2 ASN 5 2HD2 ASN 5 -10.302 6.711 3.123
38 H GLN 6 H GLN 6 -8.439 3.631 0.411
39 HA GLN 6 HA GLN 6 -9.781 1.499 1.620
40 1HB GLN 6 2HB GLN 6 -10.523 2.899 -0.371
41 2HB GLN 6 1HB GLN 6 -9.485 1.870 -1.358
42 1HG GLN 6 2HG GLN 6 -11.302 0.366 0.349
43 2HG GLN 6 1HG GLN 6 -12.127 1.424 -0.794
44 1HE2 GLN 6 1HE2 GLN 6 -12.303 0.795 -2.849
45 2HE2 GLN 6 2HE2 GLN 6 -11.528 -0.586 -3.537
46 H GLN 7 H GLN 7 -9.829 -0.752 0.967
47 HA GLN 7 HA GLN 7 -7.408 -1.819 -0.249
48 1HB GLN 7 2HB GLN 7 -7.052 -3.410 1.613
49 2HB GLN 7 1HB GLN 7 -6.803 -1.733 2.098
50 1HG GLN 7 2HG GLN 7 -9.485 -2.941 2.511
51 2HG GLN 7 1HG GLN 7 -8.170 -3.418 3.584
52 1HE2 GLN 7 1HE2 GLN 7 -9.644 -2.403 5.171
53 2HE2 GLN 7 2HE2 GLN 7 -9.497 -0.703 5.442
54 H SER 8 H SER 8 -7.686 -3.846 -1.174
55 HA SER 8 HA SER 8 -8.804 -5.580 -2.133
56 1HB SER 8 2HB SER 8 -10.185 -6.870 -0.785
57 2HB SER 8 1HB SER 8 -9.316 -5.930 0.428
58 HG SER 8 HG SER 8 -11.781 -6.089 0.437
59 H SER 9 H SER 9 -11.624 -6.087 -2.219
60 HA SER 9 HA SER 9 -12.376 -3.988 -4.089
61 1HB SER 9 2HB SER 9 -14.225 -6.251 -3.636
62 2HB SER 9 1HB SER 9 -13.639 -5.556 -5.147
63 HG SER 9 HG SER 9 -12.576 -7.597 -3.592
64 H GLN 10 H GLN 10 -12.419 -2.974 -1.569
65 HA GLN 10 HA GLN 10 -15.199 -3.051 -0.667
66 1HB GLN 10 2HB GLN 10 -12.607 -2.198 0.564
67 2HB GLN 10 1HB GLN 10 -14.118 -1.536 1.183
68 1HG GLN 10 2HG GLN 10 -14.449 -4.333 0.945
69 2HG GLN 10 1HG GLN 10 -12.900 -4.044 1.735
70 1HE2 GLN 10 1HE2 GLN 10 -12.867 -2.826 3.678
71 2HE2 GLN 10 2HE2 GLN 10 -14.277 -2.732 4.688
72 H THR 11 H THR 11 -15.869 -0.767 0.269
73 HA THR 11 HA THR 11 -16.374 0.896 -1.886
74 HB THR 11 HB THR 11 -16.737 2.606 0.156
75 HG1 THR 11 1HG THR 11 -15.757 1.120 1.634
76 1HG2 THR 11 1HG2 THR 11 -18.382 0.951 -1.312
77 2HG2 THR 11 2HG2 THR 11 -18.889 2.206 -0.181
78 3HG2 THR 11 3HG2 THR 11 -18.743 0.535 0.364
79 HA PRO 12 HA PRO 12 -12.233 2.689 -2.296
80 1HB PRO 12 2HB PRO 12 -13.778 4.423 -4.159
81 2HB PRO 12 1HB PRO 12 -12.257 3.563 -4.422
82 1HG PRO 12 2HG PRO 12 -14.522 2.659 -5.485
83 2HG PRO 12 1HG PRO 12 -13.318 1.536 -4.818
84 1HD PRO 12 2HD PRO 12 -15.916 2.448 -3.653
85 2HD PRO 12 1HD PRO 12 -15.142 0.848 -3.583
86 H THR 13 H THR 13 -11.274 4.487 -1.445
87 HA THR 13 HA THR 13 -12.912 6.789 -0.728
88 HB THR 13 HB THR 13 -11.582 6.611 1.585
89 HG1 THR 13 1HG THR 13 -11.114 4.621 2.157
90 1HG2 THR 13 1HG2 THR 13 -13.684 6.665 2.261
91 2HG2 THR 13 2HG2 THR 13 -13.726 4.910 2.089
92 3HG2 THR 13 3HG2 THR 13 -14.246 5.941 0.755
93 H THR 14 H THR 14 -11.266 8.337 0.629
94 HA THR 14 HA THR 14 -8.609 8.286 -0.547
95 HB THR 14 HB THR 14 -8.754 10.438 -1.584
96 HG1 THR 14 1HG THR 14 -11.448 10.583 -0.723
97 1HG2 THR 14 1HG2 THR 14 -9.739 8.486 -2.854
98 2HG2 THR 14 2HG2 THR 14 -10.220 10.100 -3.379
99 3HG2 THR 14 3HG2 THR 14 -11.320 9.124 -2.404
100 H THR 15 H THR 15 -7.222 8.760 1.011
101 HA THR 15 HA THR 15 -7.628 10.993 2.773
102 HB THR 15 HB THR 15 -7.587 8.195 3.919
103 HG1 THR 15 1HG THR 15 -9.644 8.715 3.307
104 1HG2 THR 15 1HG2 THR 15 -6.311 9.925 5.244
105 2HG2 THR 15 2HG2 THR 15 -7.626 9.101 6.082
106 3HG2 THR 15 3HG2 THR 15 -7.856 10.742 5.478
107 H GLY 16 H GLY 16 -5.696 11.916 2.957
108 1HA GLY 16 2HA GLY 16 -3.330 10.509 2.220
109 2HA GLY 16 1HA GLY 16 -3.431 12.195 2.679
110 H CYS 17 H CYS 17 -1.312 11.320 3.685
111 HA CYS 17 HA CYS 17 -1.889 10.284 6.382
112 1HB CYS 17 2HB CYS 17 0.807 10.231 5.030
113 2HB CYS 17 1HB CYS 17 0.279 9.316 6.444
114 H SER 18 H SER 18 0.377 10.936 7.706
115 HA SER 18 HA SER 18 1.311 13.566 7.346
116 1HB SER 18 2HB SER 18 -1.171 13.899 8.013
117 2HB SER 18 1HB SER 18 -0.645 13.424 9.628
118 HG SER 18 HG SER 18 0.917 15.141 9.482
119 H GLY 19 H GLY 19 3.301 12.895 7.968
120 1HA GLY 19 2HA GLY 19 4.293 13.015 10.432
121 2HA GLY 19 1HA GLY 19 3.619 11.393 10.446
122 H GLY 20 H GLY 20 5.857 10.758 10.858
123 1HA GLY 20 2HA GLY 20 7.989 11.175 9.147
124 2HA GLY 20 1HA GLY 20 7.796 9.761 10.175
125 H GLU 21 H GLU 21 5.182 9.247 8.621
126 HA GLU 21 HA GLU 21 6.395 7.504 6.682
127 1HB GLU 21 2HB GLU 21 4.152 7.320 8.190
128 2HB GLU 21 1HB GLU 21 3.459 7.848 6.656
129 1HG GLU 21 2HG GLU 21 3.818 5.871 5.677
130 2HG GLU 21 1HG GLU 21 5.414 5.688 6.404
131 H ASN 22 H ASN 22 6.848 8.026 4.657
132 HA ASN 22 HA ASN 22 5.191 10.047 3.307
133 1HB ASN 22 2HB ASN 22 8.149 9.969 3.643
134 2HB ASN 22 1HB ASN 22 7.522 10.516 2.091
135 1HD2 ASN 22 1HD2 ASN 22 8.715 12.465 2.931
136 2HD2 ASN 22 2HD2 ASN 22 7.795 13.603 3.847
137 H ASN 23 H ASN 23 5.243 7.070 3.268
138 HA ASN 23 HA ASN 23 5.516 6.772 0.362
139 1HB ASN 23 2HB ASN 23 6.574 4.858 2.452
140 2HB ASN 23 1HB ASN 23 6.408 4.454 0.741
141 1HD2 ASN 23 1HD2 ASN 23 8.758 4.715 2.564
142 2HD2 ASN 23 2HD2 ASN 23 9.836 5.797 1.739
143 H CYS 24 H CYS 24 4.491 4.555 -0.290
144 HA CYS 24 HA CYS 24 2.206 3.868 1.386
145 1HB CYS 24 2HB CYS 24 1.774 4.576 -1.513
146 2HB CYS 24 1HB CYS 24 0.559 4.283 -0.266
147 H TYR 25 H TYR 25 2.208 1.735 1.530
148 HA TYR 25 HA TYR 25 3.519 0.135 -0.433
149 1HB TYR 25 2HB TYR 25 3.415 -1.625 1.136
150 2HB TYR 25 1HB TYR 25 3.738 -0.171 2.072
151 HD1 TYR 25 1HD TYR 25 1.801 0.924 3.290
152 HD2 TYR 25 2HD TYR 25 1.533 -2.969 1.587
153 HE1 TYR 25 1HE TYR 25 -0.147 0.443 4.710
154 HE2 TYR 25 2HE TYR 25 -0.418 -3.458 3.002
155 HH TYR 25 HH TYR 25 -2.272 -1.902 4.184
156 H LYS 26 H LYS 26 2.471 -1.999 -1.009
157 HA LYS 26 HA LYS 26 -0.392 -2.085 -1.201
158 1HB LYS 26 2HB LYS 26 0.227 -0.524 -3.054
159 2HB LYS 26 1HB LYS 26 1.203 -1.811 -3.760
160 1HG LYS 26 2HG LYS 26 -0.996 -3.173 -3.704
161 2HG LYS 26 1HG LYS 26 -1.769 -1.595 -3.542
162 1HD LYS 26 2HD LYS 26 0.102 -2.431 -5.759
163 2HD LYS 26 1HD LYS 26 -1.653 -2.297 -5.883
164 1HE LYS 26 2HE LYS 26 -1.148 -0.242 -6.675
165 2HE LYS 26 1HE LYS 26 -1.084 0.154 -4.959
166 1HZ LYS 26 1HZ LYS 26 1.216 -0.500 -6.719
167 2HZ LYS 26 2HZ LYS 26 1.330 -0.291 -5.045
168 3HZ LYS 26 3HZ LYS 26 0.861 1.003 -6.027
169 H LYS 27 H LYS 27 0.019 -4.054 -0.101
170 HA LYS 27 HA LYS 27 1.523 -6.091 -1.545
171 1HB LYS 27 2HB LYS 27 1.092 -7.383 0.618
172 2HB LYS 27 1HB LYS 27 2.177 -6.009 0.700
173 1HG LYS 27 2HG LYS 27 0.532 -4.666 1.743
174 2HG LYS 27 1HG LYS 27 -0.738 -5.844 1.404
175 1HD LYS 27 2HD LYS 27 -0.345 -6.449 3.548
176 2HD LYS 27 1HD LYS 27 0.955 -7.387 2.810
177 1HE LYS 27 2HE LYS 27 2.121 -4.933 3.156
178 2HE LYS 27 1HE LYS 27 1.077 -5.055 4.572
179 1HZ LYS 27 1HZ LYS 27 3.396 -5.966 4.811
180 2HZ LYS 27 2HZ LYS 27 2.933 -7.221 3.777
181 3HZ LYS 27 3HZ LYS 27 2.146 -7.015 5.259
182 H GLU 28 H GLU 28 0.574 -7.613 -2.698
183 HA GLU 28 HA GLU 28 -2.274 -8.189 -2.221
184 1HB GLU 28 2HB GLU 28 -1.921 -9.044 -4.757
185 2HB GLU 28 1HB GLU 28 -2.476 -7.422 -4.350
186 1HG GLU 28 2HG GLU 28 -0.069 -6.700 -4.445
187 2HG GLU 28 1HG GLU 28 0.300 -8.289 -5.114
188 H TRP 29 H TRP 29 -2.871 -10.313 -2.012
189 HA TRP 29 HA TRP 29 -1.130 -12.476 -2.759
190 1HB TRP 29 2HB TRP 29 -0.590 -13.305 -0.617
191 2HB TRP 29 1HB TRP 29 -0.131 -11.611 -0.618
192 HD1 TRP 29 HD TRP 29 -1.774 -14.017 1.496
193 HE1 TRP 29 1HE TRP 29 -3.205 -12.883 3.314
194 HE3 TRP 29 3HE TRP 29 -1.920 -9.296 -0.436
195 HZ2 TRP 29 2HZ TRP 29 -4.253 -10.310 3.851
196 HZ3 TRP 29 3HZ TRP 29 -3.151 -7.557 0.784
197 HH2 TRP 29 HH TRP 29 -4.293 -8.049 2.885
198 H ARG 30 H ARG 30 -2.034 -14.616 -2.033
199 HA ARG 30 HA ARG 30 -4.971 -14.469 -1.977
200 1HB ARG 30 2HB ARG 30 -4.592 -16.922 -2.937
201 2HB ARG 30 1HB ARG 30 -4.653 -15.508 -3.985
202 1HG ARG 30 2HG ARG 30 -2.816 -16.792 -4.702
203 2HG ARG 30 1HG ARG 30 -2.136 -15.431 -3.810
204 1HD ARG 30 2HD ARG 30 -1.490 -16.744 -2.033
205 2HD ARG 30 1HD ARG 30 -2.710 -17.973 -2.364
206 HE ARG 30 HE ARG 30 -0.674 -17.753 -4.390
207 1HH1 ARG 30 1HH1 ARG 30 -1.573 -19.262 -1.373
208 2HH1 ARG 30 2HH1 ARG 30 -0.520 -20.618 -1.594
209 1HH2 ARG 30 1HH2 ARG 30 0.711 -19.537 -4.681
210 2HH2 ARG 30 2HH2 ARG 30 0.777 -20.774 -3.471
211 H ASP 31 H ASP 31 -6.066 -16.287 -0.917
212 HA ASP 31 HA ASP 31 -4.457 -17.417 1.279
213 1HB ASP 31 2HB ASP 31 -6.629 -17.332 2.614
214 2HB ASP 31 1HB ASP 31 -5.836 -15.784 2.300
215 H ASN 32 H ASN 32 -7.473 -17.838 -0.564
216 HA ASN 32 HA ASN 32 -6.964 -20.507 -1.250
217 1HB ASN 32 2HB ASN 32 -7.666 -20.349 1.401
218 2HB ASN 32 1HB ASN 32 -9.217 -20.662 0.628
219 1HD2 ASN 32 1HD2 ASN 32 -7.608 -22.356 2.375
220 2HD2 ASN 32 2HD2 ASN 32 -7.312 -23.809 1.488
221 H ARG 33 H ARG 33 -9.953 -18.956 -0.077
222 HA ARG 33 HA ARG 33 -11.493 -19.737 -2.283
223 1HB ARG 33 2HB ARG 33 -13.102 -18.011 -1.447
224 2HB ARG 33 1HB ARG 33 -12.584 -19.175 -0.232
225 1HG ARG 33 2HG ARG 33 -10.751 -17.162 0.039
226 2HG ARG 33 1HG ARG 33 -12.234 -16.285 -0.337
227 1HD ARG 33 2HD ARG 33 -12.300 -16.454 1.978
228 2HD ARG 33 1HD ARG 33 -13.313 -17.798 1.453
229 HE ARG 33 HE ARG 33 -10.881 -18.940 1.692
230 1HH1 ARG 33 1HH1 ARG 33 -12.782 -16.954 3.843
231 2HH1 ARG 33 2HH1 ARG 33 -12.138 -17.675 5.279
232 1HH2 ARG 33 1HH2 ARG 33 -10.035 -19.890 3.581
233 2HH2 ARG 33 2HH2 ARG 33 -10.579 -19.342 5.132
234 H GLY 34 H GLY 34 -9.640 -16.822 -1.608
235 1HA GLY 34 2HA GLY 34 -9.584 -16.175 -4.422
236 2HA GLY 34 1HA GLY 34 -10.486 -15.025 -3.447
237 H TYR 35 H TYR 35 -9.092 -13.314 -3.754
238 HA TYR 35 HA TYR 35 -6.624 -13.460 -2.206
239 1HB TYR 35 2HB TYR 35 -5.682 -11.960 -4.232
240 2HB TYR 35 1HB TYR 35 -5.463 -13.704 -4.148
241 HD1 TYR 35 1HD TYR 35 -8.144 -11.354 -5.300
242 HD2 TYR 35 2HD TYR 35 -5.799 -14.804 -6.136
243 HE1 TYR 35 1HE TYR 35 -9.282 -11.596 -7.466
244 HE2 TYR 35 2HE TYR 35 -6.929 -15.055 -8.305
245 HH TYR 35 HH TYR 35 -8.154 -13.567 -9.926
246 H ARG 36 H ARG 36 -5.844 -11.427 -1.484
247 HA ARG 36 HA ARG 36 -7.728 -9.191 -1.824
248 1HB ARG 36 2HB ARG 36 -6.479 -10.161 0.753
249 2HB ARG 36 1HB ARG 36 -7.326 -8.622 0.583
250 1HG ARG 36 2HG ARG 36 -9.391 -9.658 0.275
251 2HG ARG 36 1HG ARG 36 -8.657 -11.214 -0.120
252 1HD ARG 36 2HD ARG 36 -8.121 -11.661 2.104
253 2HD ARG 36 1HD ARG 36 -8.263 -9.969 2.576
254 HE ARG 36 HE ARG 36 -10.516 -10.272 2.876
255 1HH1 ARG 36 1HH1 ARG 36 -9.229 -12.983 1.094
256 2HH1 ARG 36 2HH1 ARG 36 -10.689 -13.908 1.202
257 1HH2 ARG 36 1HH2 ARG 36 -12.437 -11.488 3.021
258 2HH2 ARG 36 2HH2 ARG 36 -12.510 -13.059 2.296
259 H THR 37 H THR 37 -6.644 -7.154 -0.696
260 HA THR 37 HA THR 37 -3.788 -6.991 -0.975
261 HB THR 37 HB THR 37 -5.481 -5.393 -2.901
262 HG1 THR 37 1HG THR 37 -4.067 -7.806 -3.231
263 1HG2 THR 37 1HG2 THR 37 -3.659 -4.143 -3.078
264 2HG2 THR 37 2HG2 THR 37 -2.915 -5.530 -3.874
265 3HG2 THR 37 3HG2 THR 37 -2.688 -5.280 -2.143
266 H GLU 38 H GLU 38 -3.102 -5.578 0.520
267 HA GLU 38 HA GLU 38 -4.978 -3.479 1.377
268 1HB GLU 38 2HB GLU 38 -3.313 -3.628 3.475
269 2HB GLU 38 1HB GLU 38 -4.780 -4.583 3.345
270 1HG GLU 38 2HG GLU 38 -3.332 -6.389 2.316
271 2HG GLU 38 1HG GLU 38 -1.949 -5.440 2.856
272 H ARG 39 H ARG 39 -4.158 -1.434 1.875
273 HA ARG 39 HA ARG 39 -1.403 -0.887 1.015
274 1HB ARG 39 2HB ARG 39 -3.730 0.865 0.225
275 2HB ARG 39 1HB ARG 39 -2.065 0.974 -0.327
276 1HG ARG 39 2HG ARG 39 -2.306 -0.696 -1.839
277 2HG ARG 39 1HG ARG 39 -3.500 -1.557 -0.867
278 1HD ARG 39 2HD ARG 39 -5.229 -0.065 -1.518
279 2HD ARG 39 1HD ARG 39 -4.078 1.053 -2.248
280 HE ARG 39 HE ARG 39 -3.750 -1.310 -3.602
281 1HH1 ARG 39 1HH1 ARG 39 -6.402 0.879 -3.002
282 2HH1 ARG 39 2HH1 ARG 39 -7.204 0.513 -4.492
283 1HH2 ARG 39 1HH2 ARG 39 -4.805 -1.792 -5.562
284 2HH2 ARG 39 2HH2 ARG 39 -6.297 -1.003 -5.946
285 H GLY 40 H GLY 40 -1.463 1.879 1.310
286 1HA GLY 40 2HA GLY 40 -2.517 3.284 3.237
287 2HA GLY 40 1HA GLY 40 -1.709 2.072 4.230
288 H CYS 41 H CYS 41 -0.316 3.522 5.215
289 HA CYS 41 HA CYS 41 1.674 4.768 3.437
290 1HB CYS 41 2HB CYS 41 0.140 5.861 5.612
291 2HB CYS 41 1HB CYS 41 1.862 5.952 5.988
292 H GLY 42 H GLY 42 3.792 4.329 3.738
293 1HA GLY 42 2HA GLY 42 5.683 3.674 5.025
294 2HA GLY 42 1HA GLY 42 4.601 2.867 6.152
295 H CYS 43 H CYS 43 6.916 1.679 5.067
296 HA CYS 43 HA CYS 43 5.767 -0.343 3.258
297 1HB CYS 43 2HB CYS 43 7.836 1.121 2.592
298 2HB CYS 43 1HB CYS 43 8.719 0.008 3.630
299 HA PRO 44 HA PRO 44 6.096 -2.614 7.243
300 1HB PRO 44 2HB PRO 44 4.553 -4.528 5.567
301 2HB PRO 44 1HB PRO 44 4.239 -3.962 7.217
302 1HG PRO 44 2HG PRO 44 2.779 -3.077 5.170
303 2HG PRO 44 1HG PRO 44 3.249 -1.994 6.494
304 1HD PRO 44 2HD PRO 44 4.369 -2.212 3.732
305 2HD PRO 44 1HD PRO 44 4.100 -0.769 4.731
306 H SER 45 H SER 45 6.275 -5.309 7.225
307 HA SER 45 HA SER 45 8.202 -6.169 5.237
308 1HB SER 45 2HB SER 45 9.946 -6.720 6.866
309 2HB SER 45 1HB SER 45 9.602 -4.991 6.896
310 HG SER 45 HG SER 45 8.677 -5.187 8.830
311 H VAL 46 H VAL 46 6.826 -7.823 4.686
312 HA VAL 46 HA VAL 46 6.508 -9.928 6.717
313 HB VAL 46 HB VAL 46 4.385 -8.531 5.989
314 1HG1 VAL 46 1HG1 VAL 46 3.257 -9.168 4.101
315 2HG1 VAL 46 2HG1 VAL 46 4.069 -10.732 4.013
316 3HG1 VAL 46 3HG1 VAL 46 4.925 -9.266 3.536
317 1HG2 VAL 46 1HG2 VAL 46 3.630 -11.332 5.988
318 2HG2 VAL 46 2HG2 VAL 46 3.294 -10.069 7.170
319 3HG2 VAL 46 3HG2 VAL 46 4.822 -10.948 7.230
320 H LYS 47 H LYS 47 5.364 -11.854 5.151
321 HA LYS 47 HA LYS 47 7.630 -12.733 3.608
322 1HB LYS 47 2HB LYS 47 6.390 -14.823 3.352
323 2HB LYS 47 1HB LYS 47 6.401 -14.308 5.032
324 1HG LYS 47 2HG LYS 47 4.124 -13.337 4.659
325 2HG LYS 47 1HG LYS 47 4.130 -14.112 3.073
326 1HD LYS 47 2HD LYS 47 2.959 -15.488 4.713
327 2HD LYS 47 1HD LYS 47 4.421 -16.295 4.142
328 1HE LYS 47 2HE LYS 47 5.531 -15.990 6.144
329 2HE LYS 47 1HE LYS 47 4.532 -14.613 6.607
330 1HZ LYS 47 1HZ LYS 47 2.662 -16.209 6.864
331 2HZ LYS 47 2HZ LYS 47 3.927 -16.450 7.961
332 3HZ LYS 47 3HZ LYS 47 3.759 -17.476 6.628
333 H LYS 48 H LYS 48 7.822 -12.855 1.434
334 HA LYS 48 HA LYS 48 6.066 -11.280 -0.170
335 1HB LYS 48 2HB LYS 48 8.667 -11.917 -0.385
336 2HB LYS 48 1HB LYS 48 7.993 -13.115 -1.481
337 1HG LYS 48 2HG LYS 48 6.720 -11.037 -2.458
338 2HG LYS 48 1HG LYS 48 8.053 -10.153 -1.712
339 1HD LYS 48 2HD LYS 48 8.676 -12.534 -3.392
340 2HD LYS 48 1HD LYS 48 8.215 -11.030 -4.191
341 1HE LYS 48 2HE LYS 48 10.360 -10.440 -4.016
342 2HE LYS 48 1HE LYS 48 10.045 -10.211 -2.296
343 1HZ LYS 48 1HZ LYS 48 11.715 -11.680 -2.095
344 2HZ LYS 48 2HZ LYS 48 11.506 -12.320 -3.646
345 3HZ LYS 48 3HZ LYS 48 10.509 -12.832 -2.381
346 H GLY 49 H GLY 49 4.085 -12.008 -0.637
347 1HA GLY 49 2HA GLY 49 3.745 -14.854 -1.306
348 2HA GLY 49 1HA GLY 49 2.454 -13.748 -0.836
349 H ILE 50 H ILE 50 1.214 -12.967 -2.412
350 HA ILE 50 HA ILE 50 1.485 -13.734 -5.065
351 HB ILE 50 HB ILE 50 -0.285 -12.074 -3.540
352 1HG1 ILE 50 2HG1 ILE 50 -0.380 -14.363 -5.127
353 2HG1 ILE 50 1HG1 ILE 50 -1.724 -13.599 -4.277
354 1HG2 ILE 50 1HG2 ILE 50 0.146 -11.250 -6.385
355 2HG2 ILE 50 2HG2 ILE 50 0.398 -10.271 -4.941
356 3HG2 ILE 50 3HG2 ILE 50 -1.227 -10.781 -5.384
357 1HD1 ILE 50 1HD1 ILE 50 -2.120 -14.087 -6.692
358 2HD1 ILE 50 2HD1 ILE 50 -0.898 -12.875 -7.077
359 3HD1 ILE 50 3HD1 ILE 50 -2.370 -12.404 -6.227
360 H GLY 51 H GLY 51 2.190 -10.609 -3.536
361 1HA GLY 51 2HA GLY 51 4.493 -9.968 -4.854
362 2HA GLY 51 1HA GLY 51 3.224 -9.451 -5.953
363 H ILE 52 H ILE 52 5.181 -8.498 -3.445
364 HA ILE 52 HA ILE 52 3.323 -6.358 -2.640
365 HB ILE 52 HB ILE 52 4.070 -7.780 -0.777
366 1HG1 ILE 52 2HG1 ILE 52 5.361 -5.054 -0.575
367 2HG1 ILE 52 1HG1 ILE 52 3.612 -5.299 -0.528
368 1HG2 ILE 52 1HG2 ILE 52 6.201 -8.353 -0.372
369 2HG2 ILE 52 2HG2 ILE 52 6.815 -6.748 -0.767
370 3HG2 ILE 52 3HG2 ILE 52 6.462 -7.898 -2.056
371 1HD1 ILE 52 1HD1 ILE 52 3.906 -6.735 1.452
372 2HD1 ILE 52 2HD1 ILE 52 4.472 -5.084 1.706
373 3HD1 ILE 52 3HD1 ILE 52 5.633 -6.381 1.422
374 H ASN 53 H ASN 53 4.079 -4.221 -2.516
375 HA ASN 53 HA ASN 53 6.745 -3.570 -3.408
376 1HB ASN 53 2HB ASN 53 6.010 -2.227 -5.340
377 2HB ASN 53 1HB ASN 53 5.628 -3.937 -5.554
378 1HD2 ASN 53 1HD2 ASN 53 3.891 -3.854 -6.831
379 2HD2 ASN 53 2HD2 ASN 53 2.418 -3.038 -6.448
380 H CYS 54 H CYS 54 7.017 -1.130 -3.538
381 HA CYS 54 HA CYS 54 5.112 0.331 -1.870
382 1HB CYS 54 2HB CYS 54 7.984 -0.216 -1.184
383 2HB CYS 54 1HB CYS 54 7.213 1.276 -0.642
384 H CYS 55 H CYS 55 4.905 2.437 -2.413
385 HA CYS 55 HA CYS 55 6.818 3.524 -4.374
386 1HB CYS 55 2HB CYS 55 4.781 4.850 -5.220
387 2HB CYS 55 1HB CYS 55 4.886 3.142 -5.650
388 H THR 56 H THR 56 6.390 6.038 -4.554
389 HA THR 56 HA THR 56 5.875 7.208 -1.929
390 HB THR 56 HB THR 56 8.274 6.732 -1.923
391 HG1 THR 56 1HG THR 56 8.788 8.659 -1.172
392 1HG2 THR 56 1HG2 THR 56 8.808 6.708 -4.259
393 2HG2 THR 56 2HG2 THR 56 9.779 7.941 -3.455
394 3HG2 THR 56 3HG2 THR 56 8.375 8.411 -4.415
395 H THR 57 H THR 57 4.184 7.441 -4.014
396 HA THR 57 HA THR 57 4.465 10.269 -4.711
397 HB THR 57 HB THR 57 3.269 9.328 -6.966
398 HG1 THR 57 1HG THR 57 3.832 7.358 -7.356
399 1HG2 THR 57 1HG2 THR 57 6.256 9.411 -6.781
400 2HG2 THR 57 2HG2 THR 57 5.270 10.871 -6.717
401 3HG2 THR 57 3HG2 THR 57 5.218 9.834 -8.142
402 H ASP 58 H ASP 58 2.451 11.318 -5.224
403 HA ASP 58 HA ASP 58 0.357 10.648 -3.514
404 1HB ASP 58 2HB ASP 58 -0.946 12.322 -4.927
405 2HB ASP 58 1HB ASP 58 0.537 12.908 -4.185
406 H ARG 59 H ARG 59 -1.265 9.248 -3.656
407 HA ARG 59 HA ARG 59 -2.655 7.632 -4.454
408 1HB ARG 59 2HB ARG 59 -2.617 9.614 -6.711
409 2HB ARG 59 1HB ARG 59 -3.544 8.126 -6.840
410 1HG ARG 59 2HG ARG 59 -4.440 8.952 -4.471
411 2HG ARG 59 1HG ARG 59 -4.014 10.521 -5.171
412 1HD ARG 59 2HD ARG 59 -5.307 9.490 -7.257
413 2HD ARG 59 1HD ARG 59 -6.106 8.572 -5.976
414 HE ARG 59 HE ARG 59 -6.231 11.124 -5.085
415 1HH1 ARG 59 1HH1 ARG 59 -7.132 9.597 -8.091
416 2HH1 ARG 59 2HH1 ARG 59 -8.419 10.709 -8.414
417 1HH2 ARG 59 1HH2 ARG 59 -7.925 12.587 -5.507
418 2HH2 ARG 59 2HH2 ARG 59 -8.870 12.407 -6.949
419 H CYS 60 H CYS 60 0.252 7.330 -4.853
420 HA CYS 60 HA CYS 60 0.785 6.154 -7.356
421 1HB CYS 60 2HB CYS 60 2.817 5.337 -6.327
422 2HB CYS 60 1HB CYS 60 2.518 6.991 -5.796
423 H ASN 61 H ASN 61 -0.792 4.982 -4.511
424 HA ASN 61 HA ASN 61 -0.629 2.216 -5.474
425 1HB ASN 61 2HB ASN 61 -1.619 1.660 -3.224
426 2HB ASN 61 1HB ASN 61 -0.019 2.406 -3.165
427 1HD2 ASN 61 1HD2 ASN 61 -2.741 2.322 -1.554
428 2HD2 ASN 61 2HD2 ASN 61 -2.855 3.956 -0.982
429 H ASN 62 H ASN 62 -2.112 3.213 -7.226
430 HA ASN 62 HA ASN 62 -4.909 3.262 -6.354
431 1HB ASN 62 2HB ASN 62 -3.872 5.067 -7.866
432 2HB ASN 62 1HB ASN 62 -3.925 3.848 -9.143
433 1HD2 ASN 62 1HD2 ASN 62 -6.084 2.795 -9.440
434 2HD2 ASN 62 2HD2 ASN 62 -7.482 3.824 -9.345
Start of MODEL 7
1 1H LEU 1 1HT LEU 1 1.025 14.947 0.701
2 2H LEU 1 2HT LEU 1 0.684 15.344 -0.933
3 3H LEU 1 3HT LEU 1 2.309 15.141 -0.418
4 HA LEU 1 HA LEU 1 1.336 13.281 -1.696
5 1HB LEU 1 2HB LEU 1 3.217 13.381 0.193
6 2HB LEU 1 1HB LEU 1 2.088 12.328 1.022
7 HG LEU 1 HG LEU 1 2.145 10.890 -1.109
8 1HD1 LEU 1 1HD1 LEU 1 4.232 12.905 -1.676
9 2HD1 LEU 1 2HD1 LEU 1 3.205 11.987 -2.778
10 3HD1 LEU 1 3HD1 LEU 1 4.621 11.226 -2.052
11 1HD2 LEU 1 1HD2 LEU 1 3.457 10.725 1.229
12 2HD2 LEU 1 2HD2 LEU 1 4.826 10.814 0.121
13 3HD2 LEU 1 3HD2 LEU 1 3.622 9.538 -0.065
14 H GLU 2 H GLU 2 -0.411 12.063 -2.004
15 HA GLU 2 HA GLU 2 -2.152 11.465 0.287
16 1HB GLU 2 2HB GLU 2 -2.897 12.735 -2.321
17 2HB GLU 2 1HB GLU 2 -4.058 11.699 -1.503
18 1HG GLU 2 2HG GLU 2 -4.443 13.190 0.141
19 2HG GLU 2 1HG GLU 2 -2.773 13.769 0.157
20 H CYS 3 H CYS 3 -2.246 9.343 0.512
21 HA CYS 3 HA CYS 3 -2.173 7.658 -1.905
22 1HB CYS 3 2HB CYS 3 -0.782 7.471 0.675
23 2HB CYS 3 1HB CYS 3 -1.528 5.964 0.143
24 H HIS 4 H HIS 4 -3.758 6.184 -2.222
25 HA HIS 4 HA HIS 4 -6.116 6.380 -0.600
26 1HB HIS 4 2HB HIS 4 -5.647 4.450 -2.870
27 2HB HIS 4 1HB HIS 4 -7.175 5.108 -2.292
28 HD1 HIS 4 1HD HIS 4 -7.951 7.303 -3.274
29 HD2 HIS 4 2HD HIS 4 -4.084 6.291 -4.406
30 HE1 HIS 4 1HE HIS 4 -7.329 8.943 -5.076
31 HE2 HIS 4 2HE HIS 4 -5.025 8.246 -5.816
32 H ASN 5 H ASN 5 -6.612 5.119 1.074
33 HA ASN 5 HA ASN 5 -4.954 2.815 1.668
34 1HB ASN 5 2HB ASN 5 -6.053 2.808 3.840
35 2HB ASN 5 1HB ASN 5 -5.530 4.445 3.446
36 1HD2 ASN 5 1HD2 ASN 5 -7.182 4.531 5.300
37 2HD2 ASN 5 2HD2 ASN 5 -8.797 4.895 4.799
38 H GLN 6 H GLN 6 -7.873 3.397 0.071
39 HA GLN 6 HA GLN 6 -9.622 1.427 0.709
40 1HB GLN 6 2HB GLN 6 -9.769 3.139 -1.168
41 2HB GLN 6 1HB GLN 6 -8.855 1.997 -2.152
42 1HG GLN 6 2HG GLN 6 -11.165 0.795 -0.850
43 2HG GLN 6 1HG GLN 6 -11.581 2.121 -1.932
44 1HE2 GLN 6 1HE2 GLN 6 -11.619 1.758 -4.053
45 2HE2 GLN 6 2HE2 GLN 6 -11.087 0.308 -4.826
46 H GLN 7 H GLN 7 -10.060 -0.688 -0.247
47 HA GLN 7 HA GLN 7 -7.914 -2.159 -1.464
48 1HB GLN 7 2HB GLN 7 -7.605 -3.785 0.317
49 2HB GLN 7 1HB GLN 7 -7.214 -2.169 0.902
50 1HG GLN 7 2HG GLN 7 -8.821 -2.210 2.444
51 2HG GLN 7 1HG GLN 7 -9.995 -2.931 1.343
52 1HE2 GLN 7 1HE2 GLN 7 -9.316 -3.511 4.165
53 2HE2 GLN 7 2HE2 GLN 7 -8.952 -5.199 4.209
54 H SER 8 H SER 8 -8.690 -4.721 -0.991
55 HA SER 8 HA SER 8 -10.722 -5.207 -2.741
56 1HB SER 8 2HB SER 8 -10.932 -7.444 -1.707
57 2HB SER 8 1HB SER 8 -9.246 -6.970 -1.917
58 HG SER 8 HG SER 8 -9.089 -6.573 0.246
59 H SER 9 H SER 9 -12.900 -6.163 -2.345
60 HA SER 9 HA SER 9 -15.017 -6.085 -1.512
61 1HB SER 9 2HB SER 9 -13.884 -4.945 1.046
62 2HB SER 9 1HB SER 9 -15.395 -5.828 0.831
63 HG SER 9 HG SER 9 -14.311 -7.587 1.143
64 H GLN 10 H GLN 10 -16.676 -4.479 -0.656
65 HA GLN 10 HA GLN 10 -16.338 -2.021 -2.084
66 1HB GLN 10 2HB GLN 10 -18.527 -3.430 -0.685
67 2HB GLN 10 1HB GLN 10 -18.658 -1.673 -0.722
68 1HG GLN 10 2HG GLN 10 -17.939 -2.585 -3.319
69 2HG GLN 10 1HG GLN 10 -19.310 -3.532 -2.744
70 1HE2 GLN 10 1HE2 GLN 10 -18.855 -1.253 -4.747
71 2HE2 GLN 10 2HE2 GLN 10 -20.142 -0.144 -4.387
72 H THR 11 H THR 11 -17.612 -0.116 -0.629
73 HA THR 11 HA THR 11 -17.342 1.491 0.945
74 HB THR 11 HB THR 11 -16.193 -0.804 2.535
75 HG1 THR 11 1HG THR 11 -18.744 0.393 2.377
76 1HG2 THR 11 1HG2 THR 11 -16.877 0.673 4.504
77 2HG2 THR 11 2HG2 THR 11 -16.785 2.010 3.357
78 3HG2 THR 11 3HG2 THR 11 -15.355 1.031 3.688
79 HA PRO 12 HA PRO 12 -12.928 1.965 -0.496
80 1HB PRO 12 2HB PRO 12 -13.977 4.523 -1.507
81 2HB PRO 12 1HB PRO 12 -13.069 3.272 -2.359
82 1HG PRO 12 2HG PRO 12 -15.676 3.699 -2.841
83 2HG PRO 12 1HG PRO 12 -14.964 2.072 -2.900
84 1HD PRO 12 2HD PRO 12 -16.588 3.357 -0.730
85 2HD PRO 12 1HD PRO 12 -16.663 1.696 -1.365
86 H THR 13 H THR 13 -11.383 3.640 0.131
87 HA THR 13 HA THR 13 -12.301 5.647 2.019
88 HB THR 13 HB THR 13 -10.329 4.699 3.561
89 HG1 THR 13 1HG THR 13 -9.911 2.899 2.264
90 1HG2 THR 13 1HG2 THR 13 -12.053 3.353 4.813
91 2HG2 THR 13 2HG2 THR 13 -13.190 3.803 3.541
92 3HG2 THR 13 3HG2 THR 13 -12.437 5.052 4.532
93 H THR 14 H THR 14 -10.275 6.826 2.950
94 HA THR 14 HA THR 14 -7.964 6.845 1.230
95 HB THR 14 HB THR 14 -8.222 9.198 0.533
96 HG1 THR 14 1HG THR 14 -9.606 10.236 1.737
97 1HG2 THR 14 1HG2 THR 14 -9.089 7.294 -0.901
98 2HG2 THR 14 2HG2 THR 14 -9.715 8.909 -1.239
99 3HG2 THR 14 3HG2 THR 14 -10.695 7.753 -0.338
100 H THR 15 H THR 15 -6.214 7.947 2.128
101 HA THR 15 HA THR 15 -6.609 9.455 4.583
102 HB THR 15 HB THR 15 -6.440 7.158 5.388
103 HG1 THR 15 1HG THR 15 -3.995 8.518 5.841
104 1HG2 THR 15 1HG2 THR 15 -4.778 5.665 4.911
105 2HG2 THR 15 2HG2 THR 15 -3.640 6.919 4.416
106 3HG2 THR 15 3HG2 THR 15 -4.970 6.464 3.350
107 H GLY 16 H GLY 16 -5.674 11.270 3.761
108 1HA GLY 16 2HA GLY 16 -3.257 11.173 2.253
109 2HA GLY 16 1HA GLY 16 -4.108 12.619 2.751
110 H CYS 17 H CYS 17 -1.326 10.871 3.148
111 HA CYS 17 HA CYS 17 -0.854 11.954 5.845
112 1HB CYS 17 2HB CYS 17 0.847 9.851 4.520
113 2HB CYS 17 1HB CYS 17 0.706 10.231 6.238
114 H SER 18 H SER 18 1.604 12.376 6.194
115 HA SER 18 HA SER 18 3.236 13.180 4.059
116 1HB SER 18 2HB SER 18 1.344 14.898 3.909
117 2HB SER 18 1HB SER 18 1.964 15.551 5.425
118 HG SER 18 HG SER 18 3.166 15.495 2.885
119 H GLY 19 H GLY 19 5.258 13.902 4.752
120 1HA GLY 19 2HA GLY 19 6.976 14.309 6.230
121 2HA GLY 19 1HA GLY 19 5.767 14.763 7.421
122 H GLY 20 H GLY 20 4.681 13.000 8.585
123 1HA GLY 20 2HA GLY 20 6.409 11.283 9.841
124 2HA GLY 20 1HA GLY 20 4.668 11.035 9.770
125 H GLU 21 H GLU 21 4.651 10.744 6.858
126 HA GLU 21 HA GLU 21 6.030 8.155 6.597
127 1HB GLU 21 2HB GLU 21 3.666 7.738 7.003
128 2HB GLU 21 1HB GLU 21 3.225 8.839 5.698
129 1HG GLU 21 2HG GLU 21 5.023 6.636 4.947
130 2HG GLU 21 1HG GLU 21 3.397 6.166 5.436
131 H ASN 22 H ASN 22 6.898 7.668 4.610
132 HA ASN 22 HA ASN 22 6.683 9.751 2.540
133 1HB ASN 22 2HB ASN 22 9.079 8.599 3.837
134 2HB ASN 22 1HB ASN 22 9.172 8.790 2.088
135 1HD2 ASN 22 1HD2 ASN 22 10.929 10.262 2.951
136 2HD2 ASN 22 2HD2 ASN 22 10.485 11.910 3.216
137 H ASN 23 H ASN 23 6.116 6.554 3.253
138 HA ASN 23 HA ASN 23 6.054 5.882 0.408
139 1HB ASN 23 2HB ASN 23 7.339 4.205 2.567
140 2HB ASN 23 1HB ASN 23 6.955 3.602 0.951
141 1HD2 ASN 23 1HD2 ASN 23 8.346 3.960 -0.660
142 2HD2 ASN 23 2HD2 ASN 23 9.783 4.928 -0.533
143 H CYS 24 H CYS 24 4.484 4.377 -0.176
144 HA CYS 24 HA CYS 24 2.509 3.772 1.925
145 1HB CYS 24 2HB CYS 24 1.931 3.952 -1.035
146 2HB CYS 24 1HB CYS 24 0.774 3.945 0.299
147 H TYR 25 H TYR 25 2.365 1.696 2.453
148 HA TYR 25 HA TYR 25 3.672 -0.296 0.919
149 1HB TYR 25 2HB TYR 25 3.468 -1.664 2.767
150 2HB TYR 25 1HB TYR 25 3.448 -0.064 3.503
151 HD1 TYR 25 1HD TYR 25 1.538 -3.098 2.844
152 HD2 TYR 25 2HD TYR 25 1.338 0.879 4.356
153 HE1 TYR 25 1HE TYR 25 -0.609 -3.617 3.925
154 HE2 TYR 25 2HE TYR 25 -0.808 0.365 5.440
155 HH TYR 25 HH TYR 25 -2.667 -1.244 5.172
156 H LYS 26 H LYS 26 2.853 -1.576 -0.585
157 HA LYS 26 HA LYS 26 -0.070 -1.954 -0.674
158 1HB LYS 26 2HB LYS 26 1.063 -0.566 -2.557
159 2HB LYS 26 1HB LYS 26 1.688 -2.119 -3.112
160 1HG LYS 26 2HG LYS 26 -0.307 -2.790 -3.901
161 2HG LYS 26 1HG LYS 26 -1.202 -2.044 -2.577
162 1HD LYS 26 2HD LYS 26 -1.714 -0.974 -4.718
163 2HD LYS 26 1HD LYS 26 -0.925 0.148 -3.610
164 1HE LYS 26 2HE LYS 26 0.763 -1.408 -5.504
165 2HE LYS 26 1HE LYS 26 -0.176 -0.055 -6.132
166 1HZ LYS 26 1HZ LYS 26 0.928 1.060 -3.984
167 2HZ LYS 26 2HZ LYS 26 1.638 1.097 -5.519
168 3HZ LYS 26 3HZ LYS 26 2.140 -0.051 -4.383
169 H LYS 27 H LYS 27 -0.550 -4.000 -0.120
170 HA LYS 27 HA LYS 27 1.272 -6.130 -0.996
171 1HB LYS 27 2HB LYS 27 0.393 -7.225 1.216
172 2HB LYS 27 1HB LYS 27 1.749 -6.118 1.253
173 1HG LYS 27 2HG LYS 27 0.413 -4.379 2.108
174 2HG LYS 27 1HG LYS 27 -1.079 -5.237 1.729
175 1HD LYS 27 2HD LYS 27 -0.891 -5.591 4.005
176 2HD LYS 27 1HD LYS 27 -0.136 -7.044 3.347
177 1HE LYS 27 2HE LYS 27 2.036 -5.543 3.486
178 2HE LYS 27 1HE LYS 27 1.095 -4.713 4.724
179 1HZ LYS 27 1HZ LYS 27 1.234 -6.454 6.124
180 2HZ LYS 27 2HZ LYS 27 2.617 -6.826 5.221
181 3HZ LYS 27 3HZ LYS 27 1.155 -7.614 4.893
182 H GLU 28 H GLU 28 0.307 -7.660 -2.175
183 HA GLU 28 HA GLU 28 -2.614 -7.882 -2.065
184 1HB GLU 28 2HB GLU 28 -2.323 -8.989 -4.302
185 2HB GLU 28 1HB GLU 28 -1.901 -7.283 -4.258
186 1HG GLU 28 2HG GLU 28 0.127 -7.735 -5.012
187 2HG GLU 28 1HG GLU 28 0.414 -8.854 -3.681
188 H TRP 29 H TRP 29 -3.534 -9.766 -1.443
189 HA TRP 29 HA TRP 29 -1.835 -12.153 -1.297
190 1HB TRP 29 2HB TRP 29 -2.464 -12.684 0.908
191 2HB TRP 29 1HB TRP 29 -2.086 -10.969 0.960
192 HD1 TRP 29 HD TRP 29 -4.607 -13.339 2.020
193 HE1 TRP 29 1HE TRP 29 -6.777 -12.160 2.753
194 HE3 TRP 29 3HE TRP 29 -3.671 -8.700 0.114
195 HZ2 TRP 29 2HZ TRP 29 -7.930 -9.590 2.548
196 HZ3 TRP 29 3HZ TRP 29 -5.355 -6.937 0.424
197 HH2 TRP 29 HH TRP 29 -7.438 -7.370 1.618
198 H ARG 30 H ARG 30 -2.709 -13.740 -2.416
199 HA ARG 30 HA ARG 30 -5.567 -13.694 -2.986
200 1HB ARG 30 2HB ARG 30 -4.862 -15.604 -4.569
201 2HB ARG 30 1HB ARG 30 -4.381 -13.960 -4.976
202 1HG ARG 30 2HG ARG 30 -2.154 -14.353 -4.236
203 2HG ARG 30 1HG ARG 30 -2.600 -15.907 -3.530
204 1HD ARG 30 2HD ARG 30 -2.079 -16.889 -5.453
205 2HD ARG 30 1HD ARG 30 -3.388 -15.999 -6.231
206 HE ARG 30 HE ARG 30 -1.194 -14.297 -6.089
207 1HH1 ARG 30 1HH1 ARG 30 -2.058 -17.302 -7.637
208 2HH1 ARG 30 2HH1 ARG 30 -1.015 -17.046 -8.995
209 1HH2 ARG 30 1HH2 ARG 30 0.178 -13.959 -7.873
210 2HH2 ARG 30 2HH2 ARG 30 0.256 -15.149 -9.130
211 H ASP 31 H ASP 31 -6.543 -15.988 -3.215
212 HA ASP 31 HA ASP 31 -5.615 -17.827 -1.156
213 1HB ASP 31 2HB ASP 31 -7.831 -17.941 -0.086
214 2HB ASP 31 1HB ASP 31 -7.128 -16.327 0.053
215 H ASN 32 H ASN 32 -5.356 -18.394 -3.721
216 HA ASN 32 HA ASN 32 -5.796 -19.978 -5.289
217 1HB ASN 32 2HB ASN 32 -7.121 -20.980 -2.873
218 2HB ASN 32 1HB ASN 32 -7.836 -21.586 -4.364
219 1HD2 ASN 32 1HD2 ASN 32 -7.118 -23.607 -4.482
220 2HD2 ASN 32 2HD2 ASN 32 -5.457 -24.079 -4.451
221 H ARG 33 H ARG 33 -9.073 -19.882 -3.946
222 HA ARG 33 HA ARG 33 -10.327 -19.633 -6.423
223 1HB ARG 33 2HB ARG 33 -12.253 -18.659 -4.885
224 2HB ARG 33 1HB ARG 33 -11.828 -20.368 -4.870
225 1HG ARG 33 2HG ARG 33 -10.294 -18.754 -2.985
226 2HG ARG 33 1HG ARG 33 -12.031 -18.755 -2.677
227 1HD ARG 33 2HD ARG 33 -10.178 -21.123 -2.849
228 2HD ARG 33 1HD ARG 33 -11.086 -20.562 -1.445
229 HE ARG 33 HE ARG 33 -13.031 -21.108 -3.227
230 1HH1 ARG 33 1HH1 ARG 33 -10.295 -22.950 -2.086
231 2HH1 ARG 33 2HH1 ARG 33 -11.075 -24.480 -2.303
232 1HH2 ARG 33 1HH2 ARG 33 -14.060 -23.120 -3.512
233 2HH2 ARG 33 2HH2 ARG 33 -13.213 -24.576 -3.113
234 H GLY 34 H GLY 34 -10.520 -17.079 -3.947
235 1HA GLY 34 2HA GLY 34 -10.474 -15.111 -6.135
236 2HA GLY 34 1HA GLY 34 -11.163 -14.843 -4.540
237 H TYR 35 H TYR 35 -9.810 -12.834 -4.857
238 HA TYR 35 HA TYR 35 -7.400 -13.136 -3.322
239 1HB TYR 35 2HB TYR 35 -6.050 -11.831 -5.089
240 2HB TYR 35 1HB TYR 35 -6.292 -13.555 -5.344
241 HD1 TYR 35 1HD TYR 35 -6.745 -14.160 -7.517
242 HD2 TYR 35 2HD TYR 35 -8.142 -10.393 -6.116
243 HE1 TYR 35 1HE TYR 35 -7.705 -13.698 -9.733
244 HE2 TYR 35 2HE TYR 35 -9.106 -9.921 -8.328
245 HH TYR 35 HH TYR 35 -9.391 -12.322 -10.760
246 H ARG 36 H ARG 36 -6.489 -11.083 -2.656
247 HA ARG 36 HA ARG 36 -8.174 -8.741 -3.144
248 1HB ARG 36 2HB ARG 36 -7.457 -9.776 -0.394
249 2HB ARG 36 1HB ARG 36 -8.237 -8.229 -0.723
250 1HG ARG 36 2HG ARG 36 -10.234 -9.184 -0.784
251 2HG ARG 36 1HG ARG 36 -9.695 -10.360 -1.982
252 1HD ARG 36 2HD ARG 36 -8.520 -11.290 0.306
253 2HD ARG 36 1HD ARG 36 -10.042 -10.638 0.912
254 HE ARG 36 HE ARG 36 -10.409 -12.277 -1.397
255 1HH1 ARG 36 1HH1 ARG 36 -9.936 -12.360 2.061
256 2HH1 ARG 36 2HH1 ARG 36 -10.710 -13.897 2.255
257 1HH2 ARG 36 1HH2 ARG 36 -11.430 -14.298 -1.141
258 2HH2 ARG 36 2HH2 ARG 36 -11.560 -14.996 0.438
259 H THR 37 H THR 37 -7.142 -6.788 -1.901
260 HA THR 37 HA THR 37 -4.289 -6.890 -1.575
261 HB THR 37 HB THR 37 -4.437 -6.797 -4.020
262 HG1 THR 37 1HG THR 37 -3.665 -4.273 -2.993
263 1HG2 THR 37 1HG2 THR 37 -5.724 -5.423 -5.217
264 2HG2 THR 37 2HG2 THR 37 -5.454 -4.059 -4.132
265 3HG2 THR 37 3HG2 THR 37 -6.663 -5.278 -3.731
266 H GLU 38 H GLU 38 -3.760 -5.456 -0.040
267 HA GLU 38 HA GLU 38 -5.580 -3.193 0.412
268 1HB GLU 38 2HB GLU 38 -4.422 -3.337 2.768
269 2HB GLU 38 1HB GLU 38 -5.789 -4.364 2.376
270 1HG GLU 38 2HG GLU 38 -4.112 -6.133 1.736
271 2HG GLU 38 1HG GLU 38 -2.877 -5.096 2.445
272 H ARG 39 H ARG 39 -4.575 -1.247 1.321
273 HA ARG 39 HA ARG 39 -1.728 -0.932 1.055
274 1HB ARG 39 2HB ARG 39 -1.929 0.917 -0.628
275 2HB ARG 39 1HB ARG 39 -2.246 -0.689 -1.262
276 1HG ARG 39 2HG ARG 39 -4.649 0.645 -0.307
277 2HG ARG 39 1HG ARG 39 -3.830 1.525 -1.599
278 1HD ARG 39 2HD ARG 39 -4.332 -1.419 -1.827
279 2HD ARG 39 1HD ARG 39 -5.600 -0.258 -2.215
280 HE ARG 39 HE ARG 39 -3.098 0.263 -3.537
281 1HH1 ARG 39 1HH1 ARG 39 -6.116 -1.483 -3.696
282 2HH1 ARG 39 2HH1 ARG 39 -6.077 -1.642 -5.420
283 1HH2 ARG 39 1HH2 ARG 39 -3.046 0.055 -5.804
284 2HH2 ARG 39 2HH2 ARG 39 -4.334 -0.768 -6.617
285 H GLY 40 H GLY 40 -0.996 1.227 1.685
286 1HA GLY 40 2HA GLY 40 -2.738 3.212 2.675
287 2HA GLY 40 1HA GLY 40 -2.273 2.148 4.001
288 H CYS 41 H CYS 41 -1.290 4.064 4.930
289 HA CYS 41 HA CYS 41 1.097 5.072 3.606
290 1HB CYS 41 2HB CYS 41 -0.468 5.882 6.043
291 2HB CYS 41 1HB CYS 41 1.144 6.524 5.743
292 H GLY 42 H GLY 42 3.102 4.408 4.075
293 1HA GLY 42 2HA GLY 42 4.700 3.917 5.909
294 2HA GLY 42 1HA GLY 42 3.480 2.820 6.540
295 H CYS 43 H CYS 43 5.455 1.395 6.438
296 HA CYS 43 HA CYS 43 5.184 -0.377 4.221
297 1HB CYS 43 2HB CYS 43 6.686 1.423 3.291
298 2HB CYS 43 1HB CYS 43 7.878 0.960 4.500
299 HA PRO 44 HA PRO 44 7.003 -1.999 8.258
300 1HB PRO 44 2HB PRO 44 4.818 -3.090 9.373
301 2HB PRO 44 1HB PRO 44 5.206 -1.372 9.574
302 1HG PRO 44 2HG PRO 44 3.253 -2.669 7.709
303 2HG PRO 44 1HG PRO 44 3.059 -1.207 8.693
304 1HD PRO 44 2HD PRO 44 3.674 -1.173 6.025
305 2HD PRO 44 1HD PRO 44 4.132 0.114 7.158
306 H SER 45 H SER 45 6.299 -4.409 9.158
307 HA SER 45 HA SER 45 6.442 -6.641 8.751
308 1HB SER 45 2HB SER 45 4.632 -5.652 6.613
309 2HB SER 45 1HB SER 45 5.302 -7.268 6.400
310 HG SER 45 HG SER 45 3.919 -6.355 8.707
311 H VAL 46 H VAL 46 7.025 -8.251 6.758
312 HA VAL 46 HA VAL 46 9.439 -7.096 5.524
313 HB VAL 46 HB VAL 46 9.558 -8.987 7.371
314 1HG1 VAL 46 1HG1 VAL 46 8.078 -10.422 5.734
315 2HG1 VAL 46 2HG1 VAL 46 9.336 -11.160 6.724
316 3HG1 VAL 46 3HG1 VAL 46 9.648 -10.802 5.025
317 1HG2 VAL 46 1HG2 VAL 46 11.719 -9.006 6.843
318 2HG2 VAL 46 2HG2 VAL 46 11.281 -7.959 5.493
319 3HG2 VAL 46 3HG2 VAL 46 11.410 -9.702 5.253
320 H LYS 47 H LYS 47 10.111 -9.145 3.851
321 HA LYS 47 HA LYS 47 8.035 -8.907 1.810
322 1HB LYS 47 2HB LYS 47 9.876 -9.852 0.317
323 2HB LYS 47 1HB LYS 47 10.139 -8.245 0.980
324 1HG LYS 47 2HG LYS 47 11.669 -9.078 2.602
325 2HG LYS 47 1HG LYS 47 11.266 -10.750 2.206
326 1HD LYS 47 2HD LYS 47 12.034 -9.915 -0.215
327 2HD LYS 47 1HD LYS 47 12.998 -8.818 0.776
328 1HE LYS 47 2HE LYS 47 13.958 -10.708 1.968
329 2HE LYS 47 1HE LYS 47 12.955 -11.823 1.040
330 1HZ LYS 47 1HZ LYS 47 15.359 -11.467 0.305
331 2HZ LYS 47 2HZ LYS 47 14.830 -9.982 -0.307
332 3HZ LYS 47 3HZ LYS 47 14.160 -11.423 -0.887
333 H LYS 48 H LYS 48 6.536 -10.461 2.322
334 HA LYS 48 HA LYS 48 7.484 -13.240 2.485
335 1HB LYS 48 2HB LYS 48 5.369 -13.772 3.546
336 2HB LYS 48 1HB LYS 48 6.137 -12.437 4.393
337 1HG LYS 48 2HG LYS 48 4.366 -11.500 2.306
338 2HG LYS 48 1HG LYS 48 3.533 -12.537 3.464
339 1HD LYS 48 2HD LYS 48 5.353 -10.511 4.605
340 2HD LYS 48 1HD LYS 48 3.896 -9.894 3.822
341 1HE LYS 48 2HE LYS 48 2.501 -11.253 5.239
342 2HE LYS 48 1HE LYS 48 3.914 -12.036 5.944
343 1HZ LYS 48 1HZ LYS 48 2.766 -9.431 6.505
344 2HZ LYS 48 2HZ LYS 48 4.456 -9.479 6.446
345 3HZ LYS 48 3HZ LYS 48 3.619 -10.482 7.521
346 H GLY 49 H GLY 49 5.273 -14.638 1.788
347 1HA GLY 49 2HA GLY 49 5.386 -14.855 -0.947
348 2HA GLY 49 1HA GLY 49 4.010 -15.385 0.016
349 H ILE 50 H ILE 50 3.467 -12.612 0.922
350 HA ILE 50 HA ILE 50 1.489 -11.879 -0.826
351 HB ILE 50 HB ILE 50 3.093 -10.063 0.958
352 1HG1 ILE 50 2HG1 ILE 50 2.147 -11.866 2.221
353 2HG1 ILE 50 1HG1 ILE 50 1.149 -10.444 2.486
354 1HG2 ILE 50 1HG2 ILE 50 0.328 -9.330 0.575
355 2HG2 ILE 50 2HG2 ILE 50 1.190 -9.360 -0.962
356 3HG2 ILE 50 3HG2 ILE 50 1.786 -8.361 0.361
357 1HD1 ILE 50 1HD1 ILE 50 0.498 -12.987 1.172
358 2HD1 ILE 50 2HD1 ILE 50 -0.175 -11.533 0.433
359 3HD1 ILE 50 3HD1 ILE 50 -0.517 -11.903 2.123
360 H GLY 51 H GLY 51 1.397 -10.938 -2.773
361 1HA GLY 51 2HA GLY 51 3.818 -10.271 -4.164
362 2HA GLY 51 1HA GLY 51 2.182 -10.140 -4.795
363 H ILE 52 H ILE 52 3.721 -8.190 -5.572
364 HA ILE 52 HA ILE 52 4.123 -5.961 -5.594
365 HB ILE 52 HB ILE 52 1.581 -6.110 -5.661
366 1HG1 ILE 52 2HG1 ILE 52 2.233 -3.464 -4.514
367 2HG1 ILE 52 1HG1 ILE 52 3.273 -4.010 -5.833
368 1HG2 ILE 52 1HG2 ILE 52 0.571 -6.397 -3.695
369 2HG2 ILE 52 2HG2 ILE 52 0.838 -4.673 -3.452
370 3HG2 ILE 52 3HG2 ILE 52 1.973 -5.841 -2.788
371 1HD1 ILE 52 1HD1 ILE 52 1.160 -4.434 -7.144
372 2HD1 ILE 52 2HD1 ILE 52 1.557 -2.746 -6.819
373 3HD1 ILE 52 3HD1 ILE 52 0.308 -3.557 -5.874
374 H ASN 53 H ASN 53 4.407 -3.925 -4.221
375 HA ASN 53 HA ASN 53 5.001 -4.484 -1.417
376 1HB ASN 53 2HB ASN 53 6.999 -4.740 -3.272
377 2HB ASN 53 1HB ASN 53 7.181 -3.056 -2.773
378 1HD2 ASN 53 1HD2 ASN 53 6.468 -6.171 -1.217
379 2HD2 ASN 53 2HD2 ASN 53 7.604 -5.979 0.070
380 H CYS 54 H CYS 54 6.488 -2.178 -0.937
381 HA CYS 54 HA CYS 54 4.372 -0.226 -0.864
382 1HB CYS 54 2HB CYS 54 7.215 0.247 0.018
383 2HB CYS 54 1HB CYS 54 5.740 1.004 0.623
384 H CYS 55 H CYS 55 5.047 2.148 -1.308
385 HA CYS 55 HA CYS 55 6.746 2.396 -3.668
386 1HB CYS 55 2HB CYS 55 4.852 3.856 -4.688
387 2HB CYS 55 1HB CYS 55 4.750 2.100 -4.832
388 H THR 56 H THR 56 6.622 4.872 -4.377
389 HA THR 56 HA THR 56 6.520 6.592 -2.012
390 HB THR 56 HB THR 56 8.841 5.805 -2.166
391 HG1 THR 56 1HG THR 56 8.403 7.985 -1.528
392 1HG2 THR 56 1HG2 THR 56 9.910 7.152 -4.328
393 2HG2 THR 56 2HG2 THR 56 8.491 6.334 -4.982
394 3HG2 THR 56 3HG2 THR 56 9.738 5.406 -4.149
395 H THR 57 H THR 57 4.892 6.307 -4.441
396 HA THR 57 HA THR 57 5.313 8.994 -5.577
397 HB THR 57 HB THR 57 3.766 7.751 -7.440
398 HG1 THR 57 1HG THR 57 4.509 5.692 -7.728
399 1HG2 THR 57 1HG2 THR 57 5.977 7.253 -8.640
400 2HG2 THR 57 2HG2 THR 57 6.733 8.024 -7.245
401 3HG2 THR 57 3HG2 THR 57 5.590 8.926 -8.241
402 H ASP 58 H ASP 58 3.483 10.276 -5.965
403 HA ASP 58 HA ASP 58 1.471 10.167 -4.041
404 1HB ASP 58 2HB ASP 58 0.330 11.867 -5.561
405 2HB ASP 58 1HB ASP 58 1.947 12.274 -5.005
406 H ARG 59 H ARG 59 -0.350 9.038 -3.890
407 HA ARG 59 HA ARG 59 -2.066 7.628 -4.385
408 1HB ARG 59 2HB ARG 59 -1.874 9.023 -7.060
409 2HB ARG 59 1HB ARG 59 -3.205 7.984 -6.567
410 1HG ARG 59 2HG ARG 59 -3.700 9.521 -4.716
411 2HG ARG 59 1HG ARG 59 -2.390 10.576 -5.265
412 1HD ARG 59 2HD ARG 59 -3.855 10.216 -7.553
413 2HD ARG 59 1HD ARG 59 -5.105 10.242 -6.303
414 HE ARG 59 HE ARG 59 -3.188 12.376 -6.081
415 1HH1 ARG 59 1HH1 ARG 59 -6.180 11.352 -7.558
416 2HH1 ARG 59 2HH1 ARG 59 -6.749 12.966 -7.818
417 1HH2 ARG 59 1HH2 ARG 59 -3.934 14.499 -6.423
418 2HH2 ARG 59 2HH2 ARG 59 -5.474 14.754 -7.174
419 H CYS 60 H CYS 60 0.635 6.677 -4.750
420 HA CYS 60 HA CYS 60 0.833 5.135 -7.119
421 1HB CYS 60 2HB CYS 60 2.702 4.023 -5.941
422 2HB CYS 60 1HB CYS 60 2.816 5.781 -5.889
423 H ASN 61 H ASN 61 -0.967 4.717 -4.252
424 HA ASN 61 HA ASN 61 -1.305 1.852 -4.846
425 1HB ASN 61 2HB ASN 61 -1.908 1.502 -2.529
426 2HB ASN 61 1HB ASN 61 -0.355 2.337 -2.600
427 1HD2 ASN 61 1HD2 ASN 61 -1.145 2.663 -0.300
428 2HD2 ASN 61 2HD2 ASN 61 -2.037 4.120 0.003
429 H ASN 62 H ASN 62 -2.681 3.947 -6.229
430 HA ASN 62 HA ASN 62 -5.251 4.439 -5.232
431 1HB ASN 62 2HB ASN 62 -5.815 4.985 -7.574
432 2HB ASN 62 1HB ASN 62 -4.301 5.730 -7.065
433 1HD2 ASN 62 1HD2 ASN 62 -2.372 5.015 -7.934
434 2HD2 ASN 62 2HD2 ASN 62 -2.307 4.013 -9.352
Start of MODEL 8
1 1H LEU 1 1HT LEU 1 1.141 15.930 -0.756
2 2H LEU 1 2HT LEU 1 0.668 15.486 0.833
3 3H LEU 1 3HT LEU 1 -0.504 15.588 -0.416
4 HA LEU 1 HA LEU 1 0.583 13.799 -1.576
5 1HB LEU 1 2HB LEU 1 2.805 14.336 -0.515
6 2HB LEU 1 1HB LEU 1 2.222 13.560 0.945
7 HG LEU 1 HG LEU 1 2.078 11.960 -1.544
8 1HD1 LEU 1 1HD1 LEU 1 4.288 11.674 -1.897
9 2HD1 LEU 1 2HD1 LEU 1 4.701 11.910 -0.198
10 3HD1 LEU 1 3HD1 LEU 1 4.381 13.304 -1.231
11 1HD2 LEU 1 1HD2 LEU 1 1.433 10.662 0.196
12 2HD2 LEU 1 2HD2 LEU 1 2.390 11.565 1.370
13 3HD2 LEU 1 3HD2 LEU 1 3.170 10.385 0.317
14 H GLU 2 H GLU 2 -0.876 12.224 -1.502
15 HA GLU 2 HA GLU 2 -1.648 11.058 1.053
16 1HB GLU 2 2HB GLU 2 -3.482 12.595 -0.743
17 2HB GLU 2 1HB GLU 2 -4.112 11.209 0.135
18 1HG GLU 2 2HG GLU 2 -4.207 12.335 2.046
19 2HG GLU 2 1HG GLU 2 -2.573 12.976 1.841
20 H CYS 3 H CYS 3 -3.070 9.115 0.722
21 HA CYS 3 HA CYS 3 -2.680 7.867 -1.905
22 1HB CYS 3 2HB CYS 3 -2.086 6.500 0.728
23 2HB CYS 3 1HB CYS 3 -1.952 5.780 -0.878
24 H HIS 4 H HIS 4 -3.922 5.705 -1.973
25 HA HIS 4 HA HIS 4 -6.638 6.274 -1.170
26 1HB HIS 4 2HB HIS 4 -5.373 4.120 -2.865
27 2HB HIS 4 1HB HIS 4 -7.094 4.159 -2.490
28 HD1 HIS 4 1HD HIS 4 -8.525 5.955 -3.665
29 HD2 HIS 4 2HD HIS 4 -4.500 6.051 -4.702
30 HE1 HIS 4 1HE HIS 4 -8.385 7.460 -5.674
31 HE2 HIS 4 2HE HIS 4 -5.951 7.444 -6.329
32 H ASN 5 H ASN 5 -7.986 4.473 -0.267
33 HA ASN 5 HA ASN 5 -6.465 2.751 1.563
34 1HB ASN 5 2HB ASN 5 -8.282 3.240 3.292
35 2HB ASN 5 1HB ASN 5 -7.117 4.527 2.989
36 1HD2 ASN 5 1HD2 ASN 5 -9.173 5.398 4.161
37 2HD2 ASN 5 2HD2 ASN 5 -10.289 6.179 3.098
38 H GLN 6 H GLN 6 -8.372 2.648 -0.971
39 HA GLN 6 HA GLN 6 -10.495 0.937 -0.093
40 1HB GLN 6 2HB GLN 6 -10.266 2.456 -2.249
41 2HB GLN 6 1HB GLN 6 -9.586 0.981 -2.936
42 1HG GLN 6 2HG GLN 6 -11.722 -0.140 -1.997
43 2HG GLN 6 1HG GLN 6 -12.353 1.504 -1.946
44 1HE2 GLN 6 1HE2 GLN 6 -13.313 -0.663 -3.545
45 2HE2 GLN 6 2HE2 GLN 6 -13.137 -0.196 -5.198
46 H GLN 7 H GLN 7 -10.735 -1.289 -0.515
47 HA GLN 7 HA GLN 7 -8.551 -2.834 -1.564
48 1HB GLN 7 2HB GLN 7 -8.199 -4.150 0.517
49 2HB GLN 7 1HB GLN 7 -7.652 -2.479 0.641
50 1HG GLN 7 2HG GLN 7 -8.967 -2.116 2.381
51 2HG GLN 7 1HG GLN 7 -10.381 -2.685 1.495
52 1HE2 GLN 7 1HE2 GLN 7 -7.860 -3.521 3.721
53 2HE2 GLN 7 2HE2 GLN 7 -8.510 -5.046 4.209
54 H SER 8 H SER 8 -9.531 -4.327 -2.722
55 HA SER 8 HA SER 8 -10.987 -5.902 -3.448
56 1HB SER 8 2HB SER 8 -11.821 -7.487 -1.878
57 2HB SER 8 1HB SER 8 -10.269 -6.937 -1.249
58 HG SER 8 HG SER 8 -12.422 -6.996 0.091
59 H SER 9 H SER 9 -12.817 -4.689 -0.637
60 HA SER 9 HA SER 9 -15.312 -4.723 -1.809
61 1HB SER 9 2HB SER 9 -14.760 -4.324 0.630
62 2HB SER 9 1HB SER 9 -14.435 -2.644 0.201
63 HG SER 9 HG SER 9 -16.515 -2.528 0.664
64 H GLN 10 H GLN 10 -16.694 -3.003 -2.559
65 HA GLN 10 HA GLN 10 -15.399 -1.364 -4.525
66 1HB GLN 10 2HB GLN 10 -18.172 -2.105 -3.811
67 2HB GLN 10 1HB GLN 10 -17.976 -0.532 -4.582
68 1HG GLN 10 2HG GLN 10 -16.429 -2.448 -6.010
69 2HG GLN 10 1HG GLN 10 -18.055 -3.087 -5.781
70 1HE2 GLN 10 1HE2 GLN 10 -16.297 -1.635 -7.971
71 2HE2 GLN 10 2HE2 GLN 10 -17.465 -0.594 -8.725
72 H THR 11 H THR 11 -16.789 0.954 -4.633
73 HA THR 11 HA THR 11 -16.868 3.081 -3.844
74 HB THR 11 HB THR 11 -17.046 1.659 -1.185
75 HG1 THR 11 1HG THR 11 -18.791 1.240 -2.545
76 1HG2 THR 11 1HG2 THR 11 -17.862 3.644 -0.197
77 2HG2 THR 11 2HG2 THR 11 -17.867 4.492 -1.742
78 3HG2 THR 11 3HG2 THR 11 -16.338 4.053 -0.982
79 HA PRO 12 HA PRO 12 -12.349 3.140 -3.077
80 1HB PRO 12 2HB PRO 12 -11.834 5.217 -4.731
81 2HB PRO 12 1HB PRO 12 -12.016 3.560 -5.318
82 1HG PRO 12 2HG PRO 12 -14.007 5.798 -5.314
83 2HG PRO 12 1HG PRO 12 -13.637 4.628 -6.599
84 1HD PRO 12 2HD PRO 12 -15.780 4.377 -4.949
85 2HD PRO 12 1HD PRO 12 -14.927 2.978 -5.642
86 H THR 13 H THR 13 -11.008 4.687 -2.028
87 HA THR 13 HA THR 13 -12.183 7.204 -1.187
88 HB THR 13 HB THR 13 -11.335 6.397 1.248
89 HG1 THR 13 1HG THR 13 -12.471 4.091 0.049
90 1HG2 THR 13 1HG2 THR 13 -13.473 6.563 1.909
91 2HG2 THR 13 2HG2 THR 13 -14.060 5.467 0.658
92 3HG2 THR 13 3HG2 THR 13 -13.713 7.150 0.264
93 H THR 14 H THR 14 -10.549 8.316 0.402
94 HA THR 14 HA THR 14 -7.787 7.631 -0.258
95 HB THR 14 HB THR 14 -7.549 10.255 -0.618
96 HG1 THR 14 1HG THR 14 -10.146 9.712 -1.611
97 1HG2 THR 14 1HG2 THR 14 -8.677 8.845 -2.974
98 2HG2 THR 14 2HG2 THR 14 -7.180 8.247 -2.258
99 3HG2 THR 14 3HG2 THR 14 -7.274 9.905 -2.852
100 H THR 15 H THR 15 -6.332 8.146 1.307
101 HA THR 15 HA THR 15 -6.920 10.047 3.380
102 HB THR 15 HB THR 15 -8.219 8.091 4.144
103 HG1 THR 15 1HG THR 15 -7.019 9.514 5.624
104 1HG2 THR 15 1HG2 THR 15 -5.682 6.606 4.641
105 2HG2 THR 15 2HG2 THR 15 -6.538 6.424 3.110
106 3HG2 THR 15 3HG2 THR 15 -7.345 6.018 4.625
107 H GLY 16 H GLY 16 -5.009 11.055 3.397
108 1HA GLY 16 2HA GLY 16 -2.570 9.682 2.857
109 2HA GLY 16 1HA GLY 16 -2.740 11.386 3.222
110 H CYS 17 H CYS 17 -0.621 10.272 4.310
111 HA CYS 17 HA CYS 17 -1.355 9.534 7.061
112 1HB CYS 17 2HB CYS 17 1.384 9.289 5.818
113 2HB CYS 17 1HB CYS 17 0.784 8.512 7.285
114 H SER 18 H SER 18 0.882 10.179 8.433
115 HA SER 18 HA SER 18 0.824 13.110 8.352
116 1HB SER 18 2HB SER 18 0.202 11.815 10.462
117 2HB SER 18 1HB SER 18 1.912 11.400 10.591
118 HG SER 18 HG SER 18 0.900 14.047 10.443
119 H GLY 19 H GLY 19 2.953 14.109 9.248
120 1HA GLY 19 2HA GLY 19 4.939 13.869 7.371
121 2HA GLY 19 1HA GLY 19 5.195 14.515 8.982
122 H GLY 20 H GLY 20 4.427 11.881 10.180
123 1HA GLY 20 2HA GLY 20 6.927 10.828 10.635
124 2HA GLY 20 1HA GLY 20 5.429 9.931 10.848
125 H GLU 21 H GLU 21 4.650 9.986 8.088
126 HA GLU 21 HA GLU 21 6.750 8.318 6.874
127 1HB GLU 21 2HB GLU 21 4.468 7.274 7.864
128 2HB GLU 21 1HB GLU 21 3.930 7.674 6.233
129 1HG GLU 21 2HG GLU 21 4.808 5.764 5.551
130 2HG GLU 21 1HG GLU 21 6.403 6.428 5.902
131 H ASN 22 H ASN 22 6.130 7.912 4.450
132 HA ASN 22 HA ASN 22 4.876 10.227 3.215
133 1HB ASN 22 2HB ASN 22 7.418 10.614 3.620
134 2HB ASN 22 1HB ASN 22 7.631 9.489 2.284
135 1HD2 ASN 22 1HD2 ASN 22 6.657 12.650 3.235
136 2HD2 ASN 22 2HD2 ASN 22 6.449 13.298 1.647
137 H ASN 23 H ASN 23 6.686 7.235 2.674
138 HA ASN 23 HA ASN 23 5.450 6.801 0.103
139 1HB ASN 23 2HB ASN 23 7.131 4.880 1.729
140 2HB ASN 23 1HB ASN 23 6.772 4.777 0.003
141 1HD2 ASN 23 1HD2 ASN 23 9.341 4.689 0.837
142 2HD2 ASN 23 2HD2 ASN 23 10.165 6.154 0.402
143 H CYS 24 H CYS 24 4.031 5.107 -0.429
144 HA CYS 24 HA CYS 24 2.535 4.018 1.864
145 1HB CYS 24 2HB CYS 24 1.565 4.935 -0.842
146 2HB CYS 24 1HB CYS 24 0.586 3.931 0.231
147 H TYR 25 H TYR 25 2.786 1.911 2.097
148 HA TYR 25 HA TYR 25 3.801 0.294 -0.015
149 1HB TYR 25 2HB TYR 25 4.111 -1.387 1.633
150 2HB TYR 25 1HB TYR 25 4.541 0.145 2.389
151 HD1 TYR 25 1HD TYR 25 2.352 -2.746 2.503
152 HD2 TYR 25 2HD TYR 25 2.920 1.217 3.966
153 HE1 TYR 25 1HE TYR 25 0.771 -3.192 4.331
154 HE2 TYR 25 2HE TYR 25 1.339 0.774 5.795
155 HH TYR 25 HH TYR 25 0.397 -1.087 7.005
156 H LYS 26 H LYS 26 2.830 -1.514 -0.923
157 HA LYS 26 HA LYS 26 -0.074 -1.744 -0.484
158 1HB LYS 26 2HB LYS 26 0.729 -0.819 -2.752
159 2HB LYS 26 1HB LYS 26 1.313 -2.451 -3.069
160 1HG LYS 26 2HG LYS 26 -1.185 -3.043 -2.355
161 2HG LYS 26 1HG LYS 26 -1.451 -1.404 -2.954
162 1HD LYS 26 2HD LYS 26 -0.158 -3.671 -4.470
163 2HD LYS 26 1HD LYS 26 -1.784 -3.038 -4.729
164 1HE LYS 26 2HE LYS 26 -1.010 -1.432 -6.057
165 2HE LYS 26 1HE LYS 26 0.141 -0.906 -4.829
166 1HZ LYS 26 1HZ LYS 26 1.613 -2.738 -5.593
167 2HZ LYS 26 2HZ LYS 26 1.352 -1.539 -6.756
168 3HZ LYS 26 3HZ LYS 26 0.542 -3.019 -6.873
169 H LYS 27 H LYS 27 -0.873 -3.848 -0.224
170 HA LYS 27 HA LYS 27 0.994 -6.053 -0.519
171 1HB LYS 27 2HB LYS 27 0.180 -6.730 1.848
172 2HB LYS 27 1HB LYS 27 1.494 -5.589 1.692
173 1HG LYS 27 2HG LYS 27 0.177 -3.811 2.365
174 2HG LYS 27 1HG LYS 27 -1.325 -4.637 1.940
175 1HD LYS 27 2HD LYS 27 0.502 -5.458 4.196
176 2HD LYS 27 1HD LYS 27 -0.941 -4.460 4.391
177 1HE LYS 27 2HE LYS 27 -1.963 -6.427 4.764
178 2HE LYS 27 1HE LYS 27 -1.953 -6.556 3.006
179 1HZ LYS 27 1HZ LYS 27 -0.916 -8.483 3.400
180 2HZ LYS 27 2HZ LYS 27 -0.461 -8.054 4.972
181 3HZ LYS 27 3HZ LYS 27 0.463 -7.536 3.654
182 H GLU 28 H GLU 28 -0.028 -7.785 -1.363
183 HA GLU 28 HA GLU 28 -2.949 -7.934 -1.070
184 1HB GLU 28 2HB GLU 28 -2.686 -9.415 -3.182
185 2HB GLU 28 1HB GLU 28 -2.630 -7.664 -3.352
186 1HG GLU 28 2HG GLU 28 -0.434 -7.660 -3.914
187 2HG GLU 28 1HG GLU 28 -0.065 -9.075 -2.930
188 H TRP 29 H TRP 29 -3.837 -9.777 -0.284
189 HA TRP 29 HA TRP 29 -2.046 -12.067 0.159
190 1HB TRP 29 2HB TRP 29 -2.911 -12.435 2.351
191 2HB TRP 29 1HB TRP 29 -2.463 -10.739 2.267
192 HD1 TRP 29 HD TRP 29 -5.187 -12.922 3.266
193 HE1 TRP 29 1HE TRP 29 -7.344 -11.590 3.730
194 HE3 TRP 29 3HE TRP 29 -3.827 -8.469 1.180
195 HZ2 TRP 29 2HZ TRP 29 -8.328 -8.983 3.269
196 HZ3 TRP 29 3HZ TRP 29 -5.431 -6.606 1.232
197 HH2 TRP 29 HH TRP 29 -7.632 -6.856 2.257
198 H ARG 30 H ARG 30 -2.753 -13.791 -0.871
199 HA ARG 30 HA ARG 30 -5.530 -13.949 -1.707
200 1HB ARG 30 2HB ARG 30 -4.618 -16.037 -2.914
201 2HB ARG 30 1HB ARG 30 -4.111 -14.452 -3.488
202 1HG ARG 30 2HG ARG 30 -2.399 -15.759 -1.459
203 2HG ARG 30 1HG ARG 30 -2.415 -16.463 -3.077
204 1HD ARG 30 2HD ARG 30 -2.120 -13.516 -2.826
205 2HD ARG 30 1HD ARG 30 -0.737 -14.525 -2.410
206 HE ARG 30 HE ARG 30 -1.821 -14.054 -5.037
207 1HH1 ARG 30 1HH1 ARG 30 0.111 -16.188 -3.063
208 2HH1 ARG 30 2HH1 ARG 30 0.973 -16.855 -4.409
209 1HH2 ARG 30 1HH2 ARG 30 -0.689 -14.932 -6.807
210 2HH2 ARG 30 2HH2 ARG 30 0.519 -16.143 -6.534
211 H ASP 31 H ASP 31 -6.543 -16.179 -1.661
212 HA ASP 31 HA ASP 31 -5.772 -17.927 0.488
213 1HB ASP 31 2HB ASP 31 -7.932 -17.659 1.727
214 2HB ASP 31 1HB ASP 31 -6.870 -16.252 1.829
215 H ASN 32 H ASN 32 -5.906 -19.724 -0.717
216 HA ASN 32 HA ASN 32 -6.837 -21.498 -1.790
217 1HB ASN 32 2HB ASN 32 -9.047 -20.287 -0.405
218 2HB ASN 32 1HB ASN 32 -9.596 -20.904 -1.961
219 1HD2 ASN 32 1HD2 ASN 32 -10.020 -21.788 0.861
220 2HD2 ASN 32 2HD2 ASN 32 -9.596 -23.463 0.864
221 H ARG 33 H ARG 33 -9.273 -19.129 -2.815
222 HA ARG 33 HA ARG 33 -8.152 -19.281 -5.533
223 1HB ARG 33 2HB ARG 33 -10.794 -18.784 -5.984
224 2HB ARG 33 1HB ARG 33 -10.048 -20.378 -6.055
225 1HG ARG 33 2HG ARG 33 -10.709 -20.792 -3.742
226 2HG ARG 33 1HG ARG 33 -11.442 -19.189 -3.662
227 1HD ARG 33 2HD ARG 33 -12.459 -20.532 -5.956
228 2HD ARG 33 1HD ARG 33 -12.592 -21.617 -4.574
229 HE ARG 33 HE ARG 33 -13.565 -19.290 -3.613
230 1HH1 ARG 33 1HH1 ARG 33 -14.282 -21.165 -6.467
231 2HH1 ARG 33 2HH1 ARG 33 -15.937 -20.661 -6.534
232 1HH2 ARG 33 1HH2 ARG 33 -15.741 -18.627 -3.700
233 2HH2 ARG 33 2HH2 ARG 33 -16.766 -19.221 -4.964
234 H GLY 34 H GLY 34 -10.267 -17.371 -3.392
235 1HA GLY 34 2HA GLY 34 -9.994 -15.019 -5.037
236 2HA GLY 34 1HA GLY 34 -10.819 -15.118 -3.490
237 H TYR 35 H TYR 35 -9.330 -12.922 -4.050
238 HA TYR 35 HA TYR 35 -7.393 -12.992 -1.929
239 1HB TYR 35 2HB TYR 35 -5.510 -12.157 -3.326
240 2HB TYR 35 1HB TYR 35 -5.970 -13.815 -3.700
241 HD1 TYR 35 1HD TYR 35 -6.676 -14.420 -5.872
242 HD2 TYR 35 2HD TYR 35 -6.242 -10.309 -4.864
243 HE1 TYR 35 1HE TYR 35 -6.932 -13.818 -8.242
244 HE2 TYR 35 2HE TYR 35 -6.497 -9.696 -7.232
245 HH TYR 35 HH TYR 35 -7.544 -11.933 -9.610
246 H ARG 36 H ARG 36 -6.639 -10.885 -1.325
247 HA ARG 36 HA ARG 36 -8.102 -8.652 -2.558
248 1HB ARG 36 2HB ARG 36 -7.817 -9.153 0.412
249 2HB ARG 36 1HB ARG 36 -8.550 -7.724 -0.319
250 1HG ARG 36 2HG ARG 36 -10.392 -8.945 -1.108
251 2HG ARG 36 1HG ARG 36 -9.587 -10.492 -0.843
252 1HD ARG 36 2HD ARG 36 -11.112 -10.317 0.923
253 2HD ARG 36 1HD ARG 36 -9.564 -9.856 1.630
254 HE ARG 36 HE ARG 36 -10.619 -7.487 0.868
255 1HH1 ARG 36 1HH1 ARG 36 -11.851 -10.137 2.774
256 2HH1 ARG 36 2HH1 ARG 36 -12.865 -9.129 3.750
257 1HH2 ARG 36 1HH2 ARG 36 -11.951 -6.158 2.151
258 2HH2 ARG 36 2HH2 ARG 36 -12.923 -6.870 3.396
259 H THR 37 H THR 37 -7.211 -6.525 -1.279
260 HA THR 37 HA THR 37 -4.386 -6.656 -0.735
261 HB THR 37 HB THR 37 -4.352 -6.679 -3.175
262 HG1 THR 37 1HG THR 37 -2.723 -5.490 -2.178
263 1HG2 THR 37 1HG2 THR 37 -6.492 -4.818 -2.952
264 2HG2 THR 37 2HG2 THR 37 -5.839 -5.598 -4.392
265 3HG2 THR 37 3HG2 THR 37 -5.163 -4.068 -3.835
266 H GLU 38 H GLU 38 -3.901 -5.168 0.734
267 HA GLU 38 HA GLU 38 -5.711 -2.875 1.044
268 1HB GLU 38 2HB GLU 38 -4.519 -2.874 3.392
269 2HB GLU 38 1HB GLU 38 -5.883 -3.933 3.075
270 1HG GLU 38 2HG GLU 38 -4.275 -5.753 2.575
271 2HG GLU 38 1HG GLU 38 -2.966 -4.671 3.046
272 H ARG 39 H ARG 39 -4.488 -1.020 2.283
273 HA ARG 39 HA ARG 39 -1.790 -0.685 1.187
274 1HB ARG 39 2HB ARG 39 -4.146 1.133 0.754
275 2HB ARG 39 1HB ARG 39 -2.498 1.741 0.674
276 1HG ARG 39 2HG ARG 39 -2.073 0.730 -1.298
277 2HG ARG 39 1HG ARG 39 -3.078 -0.670 -0.923
278 1HD ARG 39 2HD ARG 39 -5.082 0.807 -1.242
279 2HD ARG 39 1HD ARG 39 -3.986 2.051 -1.840
280 HE ARG 39 HE ARG 39 -3.908 0.942 -3.828
281 1HH1 ARG 39 1HH1 ARG 39 -4.962 -1.298 -1.368
282 2HH1 ARG 39 2HH1 ARG 39 -5.266 -2.581 -2.492
283 1HH2 ARG 39 1HH2 ARG 39 -4.307 -0.744 -5.306
284 2HH2 ARG 39 2HH2 ARG 39 -4.895 -2.268 -4.726
285 H GLY 40 H GLY 40 -0.967 1.613 2.024
286 1HA GLY 40 2HA GLY 40 -1.766 2.812 4.338
287 2HA GLY 40 1HA GLY 40 -0.930 1.362 4.890
288 H CYS 41 H CYS 41 0.501 2.963 5.922
289 HA CYS 41 HA CYS 41 2.472 4.048 4.019
290 1HB CYS 41 2HB CYS 41 1.275 5.137 6.485
291 2HB CYS 41 1HB CYS 41 3.022 5.352 6.349
292 H GLY 42 H GLY 42 4.622 3.604 4.297
293 1HA GLY 42 2HA GLY 42 6.503 2.842 5.552
294 2HA GLY 42 1HA GLY 42 5.404 1.978 6.617
295 H CYS 43 H CYS 43 7.489 1.729 3.981
296 HA CYS 43 HA CYS 43 6.300 -0.768 3.029
297 1HB CYS 43 2HB CYS 43 7.088 0.995 1.416
298 2HB CYS 43 1HB CYS 43 8.731 0.663 1.952
299 HA PRO 44 HA PRO 44 9.383 -2.678 5.767
300 1HB PRO 44 2HB PRO 44 8.106 -5.008 6.114
301 2HB PRO 44 1HB PRO 44 7.572 -3.531 6.936
302 1HG PRO 44 2HG PRO 44 6.472 -4.834 4.473
303 2HG PRO 44 1HG PRO 44 5.603 -4.133 5.851
304 1HD PRO 44 2HD PRO 44 5.999 -2.829 3.473
305 2HD PRO 44 1HD PRO 44 5.768 -2.005 5.026
306 H SER 45 H SER 45 10.004 -5.282 5.650
307 HA SER 45 HA SER 45 10.478 -5.955 2.837
308 1HB SER 45 2HB SER 45 12.608 -5.746 4.976
309 2HB SER 45 1HB SER 45 12.853 -6.542 3.421
310 HG SER 45 HG SER 45 12.137 -4.441 2.511
311 H VAL 46 H VAL 46 8.652 -7.394 3.644
312 HA VAL 46 HA VAL 46 9.371 -9.556 5.393
313 HB VAL 46 HB VAL 46 7.145 -10.490 4.613
314 1HG1 VAL 46 1HG1 VAL 46 7.625 -9.005 6.653
315 2HG1 VAL 46 2HG1 VAL 46 5.951 -9.182 6.125
316 3HG1 VAL 46 3HG1 VAL 46 6.853 -7.724 5.718
317 1HG2 VAL 46 1HG2 VAL 46 5.708 -9.253 3.274
318 2HG2 VAL 46 2HG2 VAL 46 7.267 -9.055 2.473
319 3HG2 VAL 46 3HG2 VAL 46 6.630 -7.765 3.494
320 H LYS 47 H LYS 47 8.602 -11.838 4.461
321 HA LYS 47 HA LYS 47 10.488 -12.439 2.356
322 1HB LYS 47 2HB LYS 47 9.827 -14.801 2.808
323 2HB LYS 47 1HB LYS 47 10.412 -13.946 4.228
324 1HG LYS 47 2HG LYS 47 8.457 -14.132 5.300
325 2HG LYS 47 1HG LYS 47 7.513 -13.805 3.846
326 1HD LYS 47 2HD LYS 47 8.351 -16.207 3.166
327 2HD LYS 47 1HD LYS 47 8.538 -16.394 4.911
328 1HE LYS 47 2HE LYS 47 6.175 -15.683 5.184
329 2HE LYS 47 1HE LYS 47 6.017 -15.660 3.428
330 1HZ LYS 47 1HZ LYS 47 5.275 -17.747 3.867
331 2HZ LYS 47 2HZ LYS 47 6.236 -17.941 5.245
332 3HZ LYS 47 3HZ LYS 47 6.924 -18.096 3.708
333 H LYS 48 H LYS 48 9.532 -14.404 0.886
334 HA LYS 48 HA LYS 48 7.644 -13.092 -0.836
335 1HB LYS 48 2HB LYS 48 9.598 -15.165 -1.077
336 2HB LYS 48 1HB LYS 48 8.060 -15.780 -1.666
337 1HG LYS 48 2HG LYS 48 8.688 -14.843 -3.597
338 2HG LYS 48 1HG LYS 48 8.121 -13.348 -2.851
339 1HD LYS 48 2HD LYS 48 10.671 -13.520 -1.892
340 2HD LYS 48 1HD LYS 48 10.844 -14.219 -3.503
341 1HE LYS 48 2HE LYS 48 9.209 -11.838 -3.565
342 2HE LYS 48 1HE LYS 48 10.780 -11.512 -2.836
343 1HZ LYS 48 1HZ LYS 48 11.388 -11.270 -4.971
344 2HZ LYS 48 2HZ LYS 48 10.119 -12.212 -5.573
345 3HZ LYS 48 3HZ LYS 48 11.502 -12.958 -4.949
346 H GLY 49 H GLY 49 5.558 -13.690 -1.315
347 1HA GLY 49 2HA GLY 49 4.000 -15.746 -1.036
348 2HA GLY 49 1HA GLY 49 4.287 -15.442 0.677
349 H ILE 50 H ILE 50 3.578 -13.402 1.563
350 HA ILE 50 HA ILE 50 1.204 -12.391 0.157
351 HB ILE 50 HB ILE 50 1.873 -12.068 3.083
352 1HG1 ILE 50 2HG1 ILE 50 0.153 -14.130 1.687
353 2HG1 ILE 50 1HG1 ILE 50 1.618 -14.431 2.622
354 1HG2 ILE 50 1HG2 ILE 50 0.349 -10.389 2.376
355 2HG2 ILE 50 2HG2 ILE 50 -0.599 -11.617 3.215
356 3HG2 ILE 50 3HG2 ILE 50 -0.604 -11.550 1.452
357 1HD1 ILE 50 1HD1 ILE 50 -0.070 -15.025 4.080
358 2HD1 ILE 50 2HD1 ILE 50 -1.115 -13.697 3.574
359 3HD1 ILE 50 3HD1 ILE 50 0.301 -13.373 4.573
360 H GLY 51 H GLY 51 0.713 -10.089 0.345
361 1HA GLY 51 2HA GLY 51 1.377 -7.835 0.740
362 2HA GLY 51 1HA GLY 51 3.037 -8.381 0.893
363 H ILE 52 H ILE 52 3.472 -6.577 -0.541
364 HA ILE 52 HA ILE 52 3.949 -7.420 -3.162
365 HB ILE 52 HB ILE 52 1.362 -6.882 -3.078
366 1HG1 ILE 52 2HG1 ILE 52 2.002 -5.834 -5.565
367 2HG1 ILE 52 1HG1 ILE 52 3.421 -6.793 -5.131
368 1HG2 ILE 52 1HG2 ILE 52 2.471 -4.275 -2.761
369 2HG2 ILE 52 2HG2 ILE 52 0.784 -4.763 -2.845
370 3HG2 ILE 52 3HG2 ILE 52 1.663 -4.375 -4.320
371 1HD1 ILE 52 1HD1 ILE 52 0.632 -7.654 -5.662
372 2HD1 ILE 52 2HD1 ILE 52 1.605 -8.590 -4.528
373 3HD1 ILE 52 3HD1 ILE 52 2.158 -8.363 -6.187
374 H ASN 53 H ASN 53 3.943 -4.944 -4.477
375 HA ASN 53 HA ASN 53 6.325 -3.821 -3.336
376 1HB ASN 53 2HB ASN 53 6.295 -2.363 -5.364
377 2HB ASN 53 1HB ASN 53 6.234 -4.089 -5.728
378 1HD2 ASN 53 1HD2 ASN 53 4.433 -4.947 -6.672
379 2HD2 ASN 53 2HD2 ASN 53 3.131 -3.987 -7.281
380 H CYS 54 H CYS 54 6.447 -1.272 -3.668
381 HA CYS 54 HA CYS 54 4.111 -0.030 -2.392
382 1HB CYS 54 2HB CYS 54 6.944 0.564 -1.531
383 2HB CYS 54 1HB CYS 54 5.443 1.061 -0.745
384 H CYS 55 H CYS 55 4.897 2.512 -2.146
385 HA CYS 55 HA CYS 55 6.299 3.465 -4.466
386 1HB CYS 55 2HB CYS 55 4.274 4.808 -5.259
387 2HB CYS 55 1HB CYS 55 4.291 3.085 -5.644
388 H THR 56 H THR 56 6.013 5.958 -4.609
389 HA THR 56 HA THR 56 5.570 7.143 -1.972
390 HB THR 56 HB THR 56 7.924 6.676 -1.930
391 HG1 THR 56 1HG THR 56 8.724 8.779 -1.768
392 1HG2 THR 56 1HG2 THR 56 9.061 8.235 -3.940
393 2HG2 THR 56 2HG2 THR 56 7.825 7.259 -4.735
394 3HG2 THR 56 3HG2 THR 56 9.094 6.478 -3.791
395 H THR 57 H THR 57 3.908 7.355 -4.172
396 HA THR 57 HA THR 57 4.235 10.197 -4.843
397 HB THR 57 HB THR 57 2.917 9.282 -7.034
398 HG1 THR 57 1HG THR 57 3.621 7.342 -7.617
399 1HG2 THR 57 1HG2 THR 57 4.917 9.542 -8.287
400 2HG2 THR 57 2HG2 THR 57 5.915 9.273 -6.858
401 3HG2 THR 57 3HG2 THR 57 4.937 10.735 -6.988
402 H ASP 58 H ASP 58 2.256 11.331 -5.264
403 HA ASP 58 HA ASP 58 0.201 10.754 -3.471
404 1HB ASP 58 2HB ASP 58 -1.076 12.490 -4.835
405 2HB ASP 58 1HB ASP 58 0.454 13.005 -4.141
406 H ARG 59 H ARG 59 -1.514 9.456 -3.558
407 HA ARG 59 HA ARG 59 -3.012 7.915 -4.306
408 1HB ARG 59 2HB ARG 59 -2.933 9.528 -6.860
409 2HB ARG 59 1HB ARG 59 -4.220 8.450 -6.341
410 1HG ARG 59 2HG ARG 59 -4.665 9.921 -4.427
411 2HG ARG 59 1HG ARG 59 -3.399 11.017 -4.997
412 1HD ARG 59 2HD ARG 59 -4.947 10.703 -7.232
413 2HD ARG 59 1HD ARG 59 -6.149 10.656 -5.937
414 HE ARG 59 HE ARG 59 -4.614 12.813 -5.325
415 1HH1 ARG 59 1HH1 ARG 59 -6.369 11.820 -8.172
416 2HH1 ARG 59 2HH1 ARG 59 -6.691 13.440 -8.692
417 1HH2 ARG 59 1HH2 ARG 59 -5.036 14.945 -6.006
418 2HH2 ARG 59 2HH2 ARG 59 -5.934 15.215 -7.462
419 H CYS 60 H CYS 60 -0.145 7.442 -4.759
420 HA CYS 60 HA CYS 60 0.246 6.206 -7.270
421 1HB CYS 60 2HB CYS 60 2.288 5.337 -6.300
422 2HB CYS 60 1HB CYS 60 2.075 7.017 -5.812
423 H ASN 61 H ASN 61 -1.150 5.137 -4.271
424 HA ASN 61 HA ASN 61 -1.209 2.369 -5.245
425 1HB ASN 61 2HB ASN 61 -1.728 1.709 -2.972
426 2HB ASN 61 1HB ASN 61 -0.315 2.768 -2.956
427 1HD2 ASN 61 1HD2 ASN 61 -1.271 2.635 -0.629
428 2HD2 ASN 61 2HD2 ASN 61 -2.305 3.963 -0.200
429 H ASN 62 H ASN 62 -2.850 3.830 -6.710
430 HA ASN 62 HA ASN 62 -5.514 3.831 -5.540
431 1HB ASN 62 2HB ASN 62 -4.698 5.698 -7.016
432 2HB ASN 62 1HB ASN 62 -4.714 4.558 -8.364
433 1HD2 ASN 62 1HD2 ASN 62 -6.183 6.359 -9.108
434 2HD2 ASN 62 2HD2 ASN 62 -7.877 6.166 -8.768
Start of MODEL 9
1 1H LEU 1 1HT LEU 1 -0.066 15.095 2.210
2 2H LEU 1 2HT LEU 1 -0.355 15.815 0.680
3 3H LEU 1 3HT LEU 1 1.252 15.623 1.251
4 HA LEU 1 HA LEU 1 0.483 14.024 -0.465
5 1HB LEU 1 2HB LEU 1 2.460 13.702 0.903
6 2HB LEU 1 1HB LEU 1 1.483 13.105 2.232
7 HG LEU 1 HG LEU 1 0.783 11.215 0.649
8 1HD1 LEU 1 1HD1 LEU 1 2.014 12.657 -1.256
9 2HD1 LEU 1 2HD1 LEU 1 1.801 10.908 -1.339
10 3HD1 LEU 1 3HD1 LEU 1 3.332 11.585 -0.783
11 1HD2 LEU 1 1HD2 LEU 1 2.694 11.380 2.530
12 2HD2 LEU 1 2HD2 LEU 1 3.680 10.945 1.133
13 3HD2 LEU 1 3HD2 LEU 1 2.342 9.907 1.625
14 H GLU 2 H GLU 2 -0.858 12.348 -1.003
15 HA GLU 2 HA GLU 2 -2.695 11.286 0.998
16 1HB GLU 2 2HB GLU 2 -3.605 13.380 -0.350
17 2HB GLU 2 1HB GLU 2 -3.910 12.163 -1.582
18 1HG GLU 2 2HG GLU 2 -5.533 11.127 -0.362
19 2HG GLU 2 1HG GLU 2 -4.836 11.617 1.187
20 H CYS 3 H CYS 3 -3.479 9.247 0.531
21 HA CYS 3 HA CYS 3 -2.744 8.052 -2.038
22 1HB CYS 3 2HB CYS 3 -1.630 7.354 0.605
23 2HB CYS 3 1HB CYS 3 -2.167 5.986 -0.373
24 H HIS 4 H HIS 4 -4.149 6.524 -2.772
25 HA HIS 4 HA HIS 4 -6.691 6.347 -1.453
26 1HB HIS 4 2HB HIS 4 -5.876 4.790 -3.897
27 2HB HIS 4 1HB HIS 4 -7.473 5.375 -3.442
28 HD1 HIS 4 1HD HIS 4 -8.123 7.714 -4.173
29 HD2 HIS 4 2HD HIS 4 -4.155 6.785 -4.990
30 HE1 HIS 4 1HE HIS 4 -7.286 9.573 -5.646
31 HE2 HIS 4 2HE HIS 4 -4.906 8.951 -6.188
32 H ASN 5 H ASN 5 -7.325 4.799 -0.096
33 HA ASN 5 HA ASN 5 -5.621 2.450 0.246
34 1HB ASN 5 2HB ASN 5 -6.823 2.120 2.361
35 2HB ASN 5 1HB ASN 5 -6.180 3.758 2.255
36 1HD2 ASN 5 1HD2 ASN 5 -7.914 3.618 4.052
37 2HD2 ASN 5 2HD2 ASN 5 -9.472 4.191 3.568
38 H GLN 6 H GLN 6 -7.847 2.996 -1.868
39 HA GLN 6 HA GLN 6 -10.000 1.304 -1.501
40 1HB GLN 6 2HB GLN 6 -9.352 2.910 -3.476
41 2HB GLN 6 1HB GLN 6 -8.673 1.442 -4.178
42 1HG GLN 6 2HG GLN 6 -11.374 1.081 -3.156
43 2HG GLN 6 1HG GLN 6 -11.262 2.299 -4.424
44 1HE2 GLN 6 1HE2 GLN 6 -10.841 1.686 -6.493
45 2HE2 GLN 6 2HE2 GLN 6 -10.742 0.040 -7.004
46 H GLN 7 H GLN 7 -10.443 -0.824 -2.136
47 HA GLN 7 HA GLN 7 -8.362 -2.588 -3.016
48 1HB GLN 7 2HB GLN 7 -8.517 -4.077 -1.003
49 2HB GLN 7 1HB GLN 7 -7.709 -2.536 -0.718
50 1HG GLN 7 2HG GLN 7 -9.194 -1.923 0.813
51 2HG GLN 7 1HG GLN 7 -10.558 -2.401 -0.196
52 1HE2 GLN 7 1HE2 GLN 7 -10.182 -5.063 -0.497
53 2HE2 GLN 7 2HE2 GLN 7 -10.284 -5.862 1.031
54 H SER 8 H SER 8 -9.328 -5.009 -2.540
55 HA SER 8 HA SER 8 -11.623 -5.153 -4.190
56 1HB SER 8 2HB SER 8 -11.565 -7.614 -3.538
57 2HB SER 8 1HB SER 8 -10.102 -6.977 -4.289
58 HG SER 8 HG SER 8 -9.116 -7.651 -2.571
59 H SER 9 H SER 9 -13.740 -5.553 -3.741
60 HA SER 9 HA SER 9 -15.689 -5.701 -2.587
61 1HB SER 9 2HB SER 9 -15.793 -6.988 -0.667
62 2HB SER 9 1HB SER 9 -14.247 -7.510 -1.337
63 HG SER 9 HG SER 9 -14.750 -5.773 0.827
64 H GLN 10 H GLN 10 -13.327 -4.425 -0.222
65 HA GLN 10 HA GLN 10 -15.044 -2.626 1.011
66 1HB GLN 10 2HB GLN 10 -12.122 -2.982 0.832
67 2HB GLN 10 1HB GLN 10 -12.656 -1.358 1.263
68 1HG GLN 10 2HG GLN 10 -14.157 -3.191 2.808
69 2HG GLN 10 1HG GLN 10 -12.463 -3.670 2.902
70 1HE2 GLN 10 1HE2 GLN 10 -11.962 -3.026 4.909
71 2HE2 GLN 10 2HE2 GLN 10 -12.054 -1.385 5.470
72 H THR 11 H THR 11 -15.881 -0.716 0.479
73 HA THR 11 HA THR 11 -15.871 0.295 -2.083
74 HB THR 11 HB THR 11 -16.528 2.509 -0.731
75 HG1 THR 11 1HG THR 11 -15.963 1.788 1.291
76 1HG2 THR 11 1HG2 THR 11 -18.820 1.474 -0.348
77 2HG2 THR 11 2HG2 THR 11 -18.145 0.012 -1.066
78 3HG2 THR 11 3HG2 THR 11 -18.205 1.507 -2.001
79 HA PRO 12 HA PRO 12 -12.226 2.751 -2.494
80 1HB PRO 12 2HB PRO 12 -13.042 4.838 -3.979
81 2HB PRO 12 1HB PRO 12 -12.992 3.196 -4.631
82 1HG PRO 12 2HG PRO 12 -15.329 4.747 -3.583
83 2HG PRO 12 1HG PRO 12 -15.220 3.726 -5.033
84 1HD PRO 12 2HD PRO 12 -16.316 2.885 -2.676
85 2HD PRO 12 1HD PRO 12 -15.542 1.790 -3.844
86 H THR 13 H THR 13 -11.093 4.225 -1.344
87 HA THR 13 HA THR 13 -12.304 6.631 -0.338
88 HB THR 13 HB THR 13 -11.422 5.813 2.072
89 HG1 THR 13 1HG THR 13 -10.977 3.704 1.358
90 1HG2 THR 13 1HG2 THR 13 -14.009 4.762 2.006
91 2HG2 THR 13 2HG2 THR 13 -13.993 6.094 0.850
92 3HG2 THR 13 3HG2 THR 13 -13.508 6.371 2.523
93 H THR 14 H THR 14 -10.735 7.941 0.931
94 HA THR 14 HA THR 14 -7.961 7.312 0.160
95 HB THR 14 HB THR 14 -7.551 9.652 -0.235
96 HG1 THR 14 1HG THR 14 -10.255 10.141 0.448
97 1HG2 THR 14 1HG2 THR 14 -8.316 8.982 -2.257
98 2HG2 THR 14 2HG2 THR 14 -9.566 10.165 -1.869
99 3HG2 THR 14 3HG2 THR 14 -9.871 8.446 -1.618
100 H THR 15 H THR 15 -6.309 7.968 1.591
101 HA THR 15 HA THR 15 -7.092 9.028 4.188
102 HB THR 15 HB THR 15 -7.346 6.738 4.690
103 HG1 THR 15 1HG THR 15 -4.649 7.273 5.367
104 1HG2 THR 15 1HG2 THR 15 -6.418 5.655 2.791
105 2HG2 THR 15 2HG2 THR 15 -5.572 5.059 4.218
106 3HG2 THR 15 3HG2 THR 15 -4.801 6.250 3.170
107 H GLY 16 H GLY 16 -5.844 10.840 3.619
108 1HA GLY 16 2HA GLY 16 -3.103 10.556 2.892
109 2HA GLY 16 1HA GLY 16 -3.939 12.061 3.204
110 H CYS 17 H CYS 17 -1.330 10.638 4.146
111 HA CYS 17 HA CYS 17 -1.753 10.872 7.037
112 1HB CYS 17 2HB CYS 17 0.536 9.726 5.427
113 2HB CYS 17 1HB CYS 17 0.545 9.867 7.187
114 H SER 18 H SER 18 0.391 11.719 8.154
115 HA SER 18 HA SER 18 1.654 13.911 6.769
116 1HB SER 18 2HB SER 18 -0.745 14.458 8.081
117 2HB SER 18 1HB SER 18 0.498 14.977 9.218
118 HG SER 18 HG SER 18 1.405 16.222 7.511
119 H GLY 19 H GLY 19 3.705 13.631 7.337
120 1HA GLY 19 2HA GLY 19 5.044 14.151 9.510
121 2HA GLY 19 1HA GLY 19 4.320 12.637 10.029
122 H GLY 20 H GLY 20 6.571 11.951 10.282
123 1HA GLY 20 2HA GLY 20 8.482 11.789 8.316
124 2HA GLY 20 1HA GLY 20 8.292 10.597 9.598
125 H GLU 21 H GLU 21 5.545 9.949 8.574
126 HA GLU 21 HA GLU 21 6.380 7.900 6.734
127 1HB GLU 21 2HB GLU 21 4.476 7.968 8.643
128 2HB GLU 21 1HB GLU 21 3.492 8.345 7.228
129 1HG GLU 21 2HG GLU 21 3.631 6.263 6.420
130 2HG GLU 21 1HG GLU 21 5.325 6.087 6.873
131 H ASN 22 H ASN 22 6.642 8.325 4.646
132 HA ASN 22 HA ASN 22 4.575 9.880 3.263
133 1HB ASN 22 2HB ASN 22 7.542 10.350 3.199
134 2HB ASN 22 1HB ASN 22 6.531 10.804 1.832
135 1HD2 ASN 22 1HD2 ASN 22 4.915 12.391 2.136
136 2HD2 ASN 22 2HD2 ASN 22 5.028 13.536 3.424
137 H ASN 23 H ASN 23 5.203 6.996 3.496
138 HA ASN 23 HA ASN 23 5.567 6.442 0.628
139 1HB ASN 23 2HB ASN 23 6.519 4.700 2.912
140 2HB ASN 23 1HB ASN 23 6.720 4.367 1.189
141 1HD2 ASN 23 1HD2 ASN 23 8.148 5.665 -0.022
142 2HD2 ASN 23 2HD2 ASN 23 9.426 6.551 0.750
143 H CYS 24 H CYS 24 4.134 5.050 -0.296
144 HA CYS 24 HA CYS 24 2.044 3.964 1.471
145 1HB CYS 24 2HB CYS 24 1.754 4.694 -1.448
146 2HB CYS 24 1HB CYS 24 0.468 4.200 -0.342
147 H TYR 25 H TYR 25 2.131 1.841 1.683
148 HA TYR 25 HA TYR 25 3.487 0.235 -0.261
149 1HB TYR 25 2HB TYR 25 3.414 -1.513 1.404
150 2HB TYR 25 1HB TYR 25 3.981 -0.021 2.144
151 HD1 TYR 25 1HD TYR 25 1.446 -2.604 2.170
152 HD2 TYR 25 2HD TYR 25 2.411 1.295 3.583
153 HE1 TYR 25 1HE TYR 25 -0.302 -2.796 3.889
154 HE2 TYR 25 2HE TYR 25 0.666 1.110 5.304
155 HH TYR 25 HH TYR 25 -1.758 -1.060 5.238
156 H LYS 26 H LYS 26 2.580 -1.856 -0.903
157 HA LYS 26 HA LYS 26 -0.341 -1.995 -0.962
158 1HB LYS 26 2HB LYS 26 0.443 -0.840 -3.048
159 2HB LYS 26 1HB LYS 26 1.358 -2.294 -3.449
160 1HG LYS 26 2HG LYS 26 -0.952 -3.475 -3.195
161 2HG LYS 26 1HG LYS 26 -1.591 -1.849 -3.441
162 1HD LYS 26 2HD LYS 26 0.334 -3.255 -5.292
163 2HD LYS 26 1HD LYS 26 -1.408 -3.136 -5.543
164 1HE LYS 26 2HE LYS 26 -1.102 -0.618 -5.413
165 2HE LYS 26 1HE LYS 26 0.630 -0.925 -5.543
166 1HZ LYS 26 1HZ LYS 26 -1.321 -1.953 -7.520
167 2HZ LYS 26 2HZ LYS 26 0.360 -1.852 -7.672
168 3HZ LYS 26 3HZ LYS 26 -0.575 -0.443 -7.680
169 H LYS 27 H LYS 27 -0.353 -3.795 0.336
170 HA LYS 27 HA LYS 27 1.301 -6.075 -0.443
171 1HB LYS 27 2HB LYS 27 0.262 -6.974 1.782
172 2HB LYS 27 1HB LYS 27 1.570 -5.807 1.825
173 1HG LYS 27 2HG LYS 27 0.200 -4.102 2.531
174 2HG LYS 27 1HG LYS 27 -1.255 -4.855 1.873
175 1HD LYS 27 2HD LYS 27 -1.247 -4.953 4.311
176 2HD LYS 27 1HD LYS 27 -1.152 -6.572 3.614
177 1HE LYS 27 2HE LYS 27 1.123 -6.788 4.146
178 2HE LYS 27 1HE LYS 27 1.308 -5.056 4.424
179 1HZ LYS 27 1HZ LYS 27 -0.364 -5.444 6.311
180 2HZ LYS 27 2HZ LYS 27 1.236 -5.941 6.544
181 3HZ LYS 27 3HZ LYS 27 0.046 -7.079 6.159
182 H GLU 28 H GLU 28 0.513 -7.764 -1.479
183 HA GLU 28 HA GLU 28 -2.396 -8.207 -1.475
184 1HB GLU 28 2HB GLU 28 -1.648 -9.351 -3.803
185 2HB GLU 28 1HB GLU 28 -2.221 -7.690 -3.675
186 1HG GLU 28 2HG GLU 28 0.124 -6.936 -3.524
187 2HG GLU 28 1HG GLU 28 0.649 -8.604 -3.751
188 H TRP 29 H TRP 29 -3.051 -10.193 -0.889
189 HA TRP 29 HA TRP 29 -1.151 -12.417 -1.014
190 1HB TRP 29 2HB TRP 29 -1.639 -13.128 1.248
191 2HB TRP 29 1HB TRP 29 -1.051 -11.470 1.285
192 HD1 TRP 29 HD TRP 29 -3.661 -13.550 2.662
193 HE1 TRP 29 1HE TRP 29 -5.574 -12.147 3.668
194 HE3 TRP 29 3HE TRP 29 -2.477 -9.022 0.631
195 HZ2 TRP 29 2HZ TRP 29 -6.454 -9.463 3.605
196 HZ3 TRP 29 3HZ TRP 29 -3.899 -7.086 1.151
197 HH2 TRP 29 HH TRP 29 -5.846 -7.300 2.609
198 H ARG 30 H ARG 30 -2.055 -14.382 -1.455
199 HA ARG 30 HA ARG 30 -4.868 -14.349 -2.196
200 1HB ARG 30 2HB ARG 30 -4.238 -16.641 -3.160
201 2HB ARG 30 1HB ARG 30 -3.561 -15.213 -3.934
202 1HG ARG 30 2HG ARG 30 -1.453 -15.756 -3.376
203 2HG ARG 30 1HG ARG 30 -1.920 -16.378 -1.792
204 1HD ARG 30 2HD ARG 30 -2.964 -18.328 -3.134
205 2HD ARG 30 1HD ARG 30 -1.935 -17.762 -4.449
206 HE ARG 30 HE ARG 30 -0.240 -17.990 -2.331
207 1HH1 ARG 30 1HH1 ARG 30 -2.471 -20.160 -3.911
208 2HH1 ARG 30 2HH1 ARG 30 -1.547 -21.578 -3.544
209 1HH2 ARG 30 1HH2 ARG 30 0.977 -19.854 -1.848
210 2HH2 ARG 30 2HH2 ARG 30 0.410 -21.404 -2.372
211 H ASP 31 H ASP 31 -6.049 -16.496 -1.830
212 HA ASP 31 HA ASP 31 -5.347 -17.973 0.529
213 1HB ASP 31 2HB ASP 31 -7.313 -17.326 1.859
214 2HB ASP 31 1HB ASP 31 -6.260 -15.943 1.558
215 H ASN 32 H ASN 32 -7.880 -18.964 1.176
216 HA ASN 32 HA ASN 32 -8.224 -20.966 -0.727
217 1HB ASN 32 2HB ASN 32 -10.129 -19.977 1.402
218 2HB ASN 32 1HB ASN 32 -10.355 -21.462 0.484
219 1HD2 ASN 32 1HD2 ASN 32 -8.606 -19.891 3.003
220 2HD2 ASN 32 2HD2 ASN 32 -7.764 -21.285 3.582
221 H ARG 33 H ARG 33 -10.850 -18.700 0.070
222 HA ARG 33 HA ARG 33 -12.298 -19.076 -2.241
223 1HB ARG 33 2HB ARG 33 -13.241 -16.755 -1.719
224 2HB ARG 33 1HB ARG 33 -13.414 -18.006 -0.492
225 1HG ARG 33 2HG ARG 33 -11.015 -16.807 0.140
226 2HG ARG 33 1HG ARG 33 -12.023 -15.460 -0.385
227 1HD ARG 33 2HD ARG 33 -13.782 -16.223 1.178
228 2HD ARG 33 1HD ARG 33 -12.693 -17.488 1.744
229 HE ARG 33 HE ARG 33 -11.657 -15.930 3.042
230 1HH1 ARG 33 1HH1 ARG 33 -13.360 -14.267 0.491
231 2HH1 ARG 33 2HH1 ARG 33 -13.005 -12.690 1.112
232 1HH2 ARG 33 1HH2 ARG 33 -11.192 -13.857 3.862
233 2HH2 ARG 33 2HH2 ARG 33 -11.774 -12.456 3.026
234 H GLY 34 H GLY 34 -10.147 -16.289 -1.581
235 1HA GLY 34 2HA GLY 34 -9.276 -16.290 -4.341
236 2HA GLY 34 1HA GLY 34 -10.288 -14.922 -3.905
237 H TYR 35 H TYR 35 -8.799 -13.311 -4.047
238 HA TYR 35 HA TYR 35 -6.634 -13.392 -2.061
239 1HB TYR 35 2HB TYR 35 -5.331 -11.980 -3.832
240 2HB TYR 35 1HB TYR 35 -5.357 -13.734 -3.968
241 HD1 TYR 35 1HD TYR 35 -6.415 -14.814 -5.817
242 HD2 TYR 35 2HD TYR 35 -6.716 -10.597 -5.348
243 HE1 TYR 35 1HE TYR 35 -7.299 -14.630 -8.103
244 HE2 TYR 35 2HE TYR 35 -7.603 -10.400 -7.634
245 HH TYR 35 HH TYR 35 -7.282 -12.488 -9.918
246 H ARG 36 H ARG 36 -5.851 -11.266 -1.418
247 HA ARG 36 HA ARG 36 -7.762 -9.089 -1.918
248 1HB ARG 36 2HB ARG 36 -6.894 -10.231 0.713
249 2HB ARG 36 1HB ARG 36 -7.287 -8.515 0.598
250 1HG ARG 36 2HG ARG 36 -9.514 -9.088 -0.239
251 2HG ARG 36 1HG ARG 36 -9.119 -10.803 -0.101
252 1HD ARG 36 2HD ARG 36 -9.160 -8.826 2.177
253 2HD ARG 36 1HD ARG 36 -10.434 -9.989 1.812
254 HE ARG 36 HE ARG 36 -8.206 -11.523 2.071
255 1HH1 ARG 36 1HH1 ARG 36 -9.762 -9.147 4.100
256 2HH1 ARG 36 2HH1 ARG 36 -9.237 -9.883 5.577
257 1HH2 ARG 36 1HH2 ARG 36 -7.514 -12.491 4.013
258 2HH2 ARG 36 2HH2 ARG 36 -7.961 -11.780 5.528
259 H THR 37 H THR 37 -6.857 -6.959 -1.018
260 HA THR 37 HA THR 37 -3.998 -6.743 -0.846
261 HB THR 37 HB THR 37 -5.342 -5.451 -3.222
262 HG1 THR 37 1HG THR 37 -4.564 -7.062 -4.450
263 1HG2 THR 37 1HG2 THR 37 -3.492 -4.242 -3.313
264 2HG2 THR 37 2HG2 THR 37 -2.635 -5.732 -3.707
265 3HG2 THR 37 3HG2 THR 37 -2.728 -5.185 -2.034
266 H GLU 38 H GLU 38 -3.593 -5.152 0.547
267 HA GLU 38 HA GLU 38 -5.529 -2.944 0.740
268 1HB GLU 38 2HB GLU 38 -4.363 -2.883 3.160
269 2HB GLU 38 1HB GLU 38 -5.822 -3.798 2.821
270 1HG GLU 38 2HG GLU 38 -4.520 -5.814 2.532
271 2HG GLU 38 1HG GLU 38 -3.026 -4.911 2.770
272 H ARG 39 H ARG 39 -4.692 -0.868 1.283
273 HA ARG 39 HA ARG 39 -1.814 -0.547 0.740
274 1HB ARG 39 2HB ARG 39 -3.832 1.519 -0.085
275 2HB ARG 39 1HB ARG 39 -2.192 1.280 -0.673
276 1HG ARG 39 2HG ARG 39 -3.044 -0.931 -1.624
277 2HG ARG 39 1HG ARG 39 -4.659 -0.287 -1.327
278 1HD ARG 39 2HD ARG 39 -3.320 1.781 -2.607
279 2HD ARG 39 1HD ARG 39 -2.774 0.326 -3.440
280 HE ARG 39 HE ARG 39 -5.641 0.600 -3.041
281 1HH1 ARG 39 1HH1 ARG 39 -2.923 0.971 -5.209
282 2HH1 ARG 39 2HH1 ARG 39 -3.906 0.970 -6.634
283 1HH2 ARG 39 1HH2 ARG 39 -6.926 0.601 -4.916
284 2HH2 ARG 39 2HH2 ARG 39 -6.175 0.762 -6.469
285 H GLY 40 H GLY 40 -1.582 2.154 1.143
286 1HA GLY 40 2HA GLY 40 -2.502 3.724 2.935
287 2HA GLY 40 1HA GLY 40 -2.215 2.361 4.017
288 H CYS 41 H CYS 41 -0.987 4.447 4.880
289 HA CYS 41 HA CYS 41 1.582 4.893 3.684
290 1HB CYS 41 2HB CYS 41 0.705 5.732 6.444
291 2HB CYS 41 1HB CYS 41 1.918 6.482 5.411
292 H GLY 42 H GLY 42 3.324 3.676 3.976
293 1HA GLY 42 2HA GLY 42 4.607 2.848 6.141
294 2HA GLY 42 1HA GLY 42 3.318 1.656 6.082
295 H CYS 43 H CYS 43 5.321 0.262 5.948
296 HA CYS 43 HA CYS 43 5.553 -0.784 3.351
297 1HB CYS 43 2HB CYS 43 6.960 1.323 3.141
298 2HB CYS 43 1HB CYS 43 8.086 0.577 4.269
299 HA PRO 44 HA PRO 44 6.517 -3.531 7.016
300 1HB PRO 44 2HB PRO 44 5.158 -5.385 5.124
301 2HB PRO 44 1HB PRO 44 4.947 -5.201 6.872
302 1HG PRO 44 2HG PRO 44 3.123 -4.258 5.175
303 2HG PRO 44 1HG PRO 44 3.554 -3.361 6.643
304 1HD PRO 44 2HD PRO 44 4.343 -2.855 3.807
305 2HD PRO 44 1HD PRO 44 3.972 -1.696 5.100
306 H SER 45 H SER 45 7.246 -6.044 6.584
307 HA SER 45 HA SER 45 9.193 -6.041 4.388
308 1HB SER 45 2HB SER 45 11.002 -6.663 5.783
309 2HB SER 45 1HB SER 45 10.213 -5.334 6.631
310 HG SER 45 HG SER 45 9.213 -6.837 7.976
311 H VAL 46 H VAL 46 7.037 -7.385 3.917
312 HA VAL 46 HA VAL 46 7.554 -10.172 4.712
313 HB VAL 46 HB VAL 46 5.079 -10.318 3.647
314 1HG1 VAL 46 1HG1 VAL 46 4.475 -10.948 5.720
315 2HG1 VAL 46 2HG1 VAL 46 5.068 -9.461 6.461
316 3HG1 VAL 46 3HG1 VAL 46 6.194 -10.759 6.063
317 1HG2 VAL 46 1HG2 VAL 46 4.949 -7.727 5.153
318 2HG2 VAL 46 2HG2 VAL 46 3.723 -8.479 4.132
319 3HG2 VAL 46 3HG2 VAL 46 5.160 -7.766 3.402
320 H LYS 47 H LYS 47 7.443 -11.806 3.130
321 HA LYS 47 HA LYS 47 7.125 -11.101 0.347
322 1HB LYS 47 2HB LYS 47 9.357 -11.794 -0.345
323 2HB LYS 47 1HB LYS 47 9.456 -10.444 0.777
324 1HG LYS 47 2HG LYS 47 10.938 -11.642 1.909
325 2HG LYS 47 1HG LYS 47 9.593 -12.668 2.412
326 1HD LYS 47 2HD LYS 47 9.997 -13.935 0.216
327 2HD LYS 47 1HD LYS 47 11.546 -13.090 0.170
328 1HE LYS 47 2HE LYS 47 11.847 -13.968 2.574
329 2HE LYS 47 1HE LYS 47 10.545 -15.087 2.171
330 1HZ LYS 47 1HZ LYS 47 12.268 -16.341 1.485
331 2HZ LYS 47 2HZ LYS 47 13.293 -15.021 1.225
332 3HZ LYS 47 3HZ LYS 47 12.125 -15.424 0.071
333 H LYS 48 H LYS 48 8.180 -13.252 -0.895
334 HA LYS 48 HA LYS 48 7.872 -15.454 -1.373
335 1HB LYS 48 2HB LYS 48 8.964 -15.739 0.887
336 2HB LYS 48 1HB LYS 48 7.349 -15.866 1.573
337 1HG LYS 48 2HG LYS 48 7.676 -18.063 1.275
338 2HG LYS 48 1HG LYS 48 7.185 -17.714 -0.383
339 1HD LYS 48 2HD LYS 48 9.325 -17.872 -1.195
340 2HD LYS 48 1HD LYS 48 10.057 -17.410 0.344
341 1HE LYS 48 2HE LYS 48 8.686 -20.044 -0.187
342 2HE LYS 48 1HE LYS 48 10.429 -19.789 -0.260
343 1HZ LYS 48 1HZ LYS 48 8.660 -19.894 2.067
344 2HZ LYS 48 2HZ LYS 48 9.995 -18.858 2.146
345 3HZ LYS 48 3HZ LYS 48 10.224 -20.511 1.870
346 H GLY 49 H GLY 49 6.021 -15.243 -2.579
347 1HA GLY 49 2HA GLY 49 3.870 -16.064 -3.031
348 2HA GLY 49 1HA GLY 49 3.590 -16.216 -1.297
349 H ILE 50 H ILE 50 4.056 -13.719 -0.356
350 HA ILE 50 HA ILE 50 1.799 -12.255 -1.472
351 HB ILE 50 HB ILE 50 3.398 -11.656 1.020
352 1HG1 ILE 50 2HG1 ILE 50 0.816 -13.190 0.646
353 2HG1 ILE 50 1HG1 ILE 50 2.353 -13.835 1.227
354 1HG2 ILE 50 1HG2 ILE 50 1.839 -10.047 1.562
355 2HG2 ILE 50 2HG2 ILE 50 0.597 -10.748 0.526
356 3HG2 ILE 50 3HG2 ILE 50 1.941 -9.858 -0.188
357 1HD1 ILE 50 1HD1 ILE 50 1.993 -11.950 3.062
358 2HD1 ILE 50 2HD1 ILE 50 1.304 -13.567 3.211
359 3HD1 ILE 50 3HD1 ILE 50 0.306 -12.232 2.633
360 H GLY 51 H GLY 51 1.956 -10.409 -2.595
361 1HA GLY 51 2HA GLY 51 4.655 -9.345 -3.071
362 2HA GLY 51 1HA GLY 51 3.262 -9.110 -4.116
363 H ILE 52 H ILE 52 5.166 -7.781 -1.663
364 HA ILE 52 HA ILE 52 3.185 -5.639 -1.243
365 HB ILE 52 HB ILE 52 3.535 -6.902 0.818
366 1HG1 ILE 52 2HG1 ILE 52 4.964 -4.263 1.119
367 2HG1 ILE 52 1HG1 ILE 52 3.238 -4.354 0.756
368 1HG2 ILE 52 1HG2 ILE 52 6.189 -7.043 -0.042
369 2HG2 ILE 52 2HG2 ILE 52 5.514 -7.679 1.457
370 3HG2 ILE 52 3HG2 ILE 52 6.221 -6.064 1.424
371 1HD1 ILE 52 1HD1 ILE 52 4.676 -4.850 3.261
372 2HD1 ILE 52 2HD1 ILE 52 3.405 -6.014 2.885
373 3HD1 ILE 52 3HD1 ILE 52 3.025 -4.294 2.982
374 H ASN 53 H ASN 53 3.820 -4.022 -2.544
375 HA ASN 53 HA ASN 53 6.672 -3.367 -2.709
376 1HB ASN 53 2HB ASN 53 4.312 -2.882 -4.474
377 2HB ASN 53 1HB ASN 53 5.660 -1.749 -4.538
378 1HD2 ASN 53 1HD2 ASN 53 7.111 -2.188 -6.017
379 2HD2 ASN 53 2HD2 ASN 53 7.504 -3.752 -6.635
380 H CYS 54 H CYS 54 6.860 -0.818 -3.171
381 HA CYS 54 HA CYS 54 5.172 0.753 -1.417
382 1HB CYS 54 2HB CYS 54 8.125 0.418 -0.833
383 2HB CYS 54 1HB CYS 54 7.049 1.569 -0.036
384 H CYS 55 H CYS 55 5.188 2.914 -1.902
385 HA CYS 55 HA CYS 55 7.149 3.848 -3.878
386 1HB CYS 55 2HB CYS 55 5.185 5.174 -4.899
387 2HB CYS 55 1HB CYS 55 5.319 3.457 -5.284
388 H THR 56 H THR 56 6.982 6.313 -4.125
389 HA THR 56 HA THR 56 6.235 7.598 -1.598
390 HB THR 56 HB THR 56 8.572 7.124 -1.313
391 HG1 THR 56 1HG THR 56 9.166 9.117 -0.819
392 1HG2 THR 56 1HG2 THR 56 10.249 7.429 -2.819
393 2HG2 THR 56 2HG2 THR 56 9.394 8.704 -3.685
394 3HG2 THR 56 3HG2 THR 56 8.928 7.018 -3.911
395 H THR 57 H THR 57 4.677 7.841 -3.761
396 HA THR 57 HA THR 57 5.132 10.624 -4.549
397 HB THR 57 HB THR 57 3.978 9.655 -6.812
398 HG1 THR 57 1HG THR 57 4.547 7.667 -7.188
399 1HG2 THR 57 1HG2 THR 57 6.103 9.842 -7.904
400 2HG2 THR 57 2HG2 THR 57 6.949 9.713 -6.362
401 3HG2 THR 57 3HG2 THR 57 5.950 11.125 -6.706
402 H ASP 58 H ASP 58 3.250 11.823 -4.942
403 HA ASP 58 HA ASP 58 1.031 11.219 -3.390
404 1HB ASP 58 2HB ASP 58 -0.088 13.038 -4.790
405 2HB ASP 58 1HB ASP 58 1.384 13.487 -3.939
406 H ARG 59 H ARG 59 -0.553 9.801 -3.657
407 HA ARG 59 HA ARG 59 -2.042 8.364 -4.601
408 1HB ARG 59 2HB ARG 59 -1.747 10.204 -6.982
409 2HB ARG 59 1HB ARG 59 -3.003 8.989 -6.793
410 1HG ARG 59 2HG ARG 59 -3.821 10.165 -4.798
411 2HG ARG 59 1HG ARG 59 -2.581 11.405 -5.042
412 1HD ARG 59 2HD ARG 59 -3.641 12.304 -6.852
413 2HD ARG 59 1HD ARG 59 -4.379 10.766 -7.320
414 HE ARG 59 HE ARG 59 -5.638 11.364 -5.009
415 1HH1 ARG 59 1HH1 ARG 59 -5.072 13.178 -7.936
416 2HH1 ARG 59 2HH1 ARG 59 -6.524 14.110 -7.785
417 1HH2 ARG 59 1HH2 ARG 59 -7.547 12.587 -4.811
418 2HH2 ARG 59 2HH2 ARG 59 -7.929 13.775 -6.012
419 H CYS 60 H CYS 60 0.696 7.674 -4.688
420 HA CYS 60 HA CYS 60 1.377 6.649 -7.261
421 1HB CYS 60 2HB CYS 60 3.283 5.662 -6.125
422 2HB CYS 60 1HB CYS 60 3.067 7.331 -5.605
423 H ASN 61 H ASN 61 -0.861 5.623 -5.019
424 HA ASN 61 HA ASN 61 -0.663 2.854 -5.999
425 1HB ASN 61 2HB ASN 61 -1.512 2.044 -3.873
426 2HB ASN 61 1HB ASN 61 -0.064 3.017 -3.597
427 1HD2 ASN 61 1HD2 ASN 61 -1.262 2.793 -1.419
428 2HD2 ASN 61 2HD2 ASN 61 -2.304 4.120 -1.010
429 H ASN 62 H ASN 62 -2.041 4.254 -7.626
430 HA ASN 62 HA ASN 62 -4.866 4.111 -6.807
431 1HB ASN 62 2HB ASN 62 -4.023 6.349 -7.532
432 2HB ASN 62 1HB ASN 62 -3.684 5.660 -9.123
433 1HD2 ASN 62 1HD2 ASN 62 -6.390 5.504 -6.825
434 2HD2 ASN 62 2HD2 ASN 62 -7.614 5.934 -7.980
Start of MODEL 10
1 1H LEU 1 1HT LEU 1 2.575 13.255 2.182
2 2H LEU 1 2HT LEU 1 1.319 12.504 3.078
3 3H LEU 1 3HT LEU 1 1.027 13.988 2.266
4 HA LEU 1 HA LEU 1 1.109 13.025 0.201
5 1HB LEU 1 2HB LEU 1 3.144 11.672 0.842
6 2HB LEU 1 1HB LEU 1 2.051 10.481 1.521
7 HG LEU 1 HG LEU 1 0.998 10.339 -0.798
8 1HD1 LEU 1 1HD1 LEU 1 3.547 11.274 -1.946
9 2HD1 LEU 1 2HD1 LEU 1 2.448 12.525 -1.364
10 3HD1 LEU 1 3HD1 LEU 1 1.906 11.372 -2.584
11 1HD2 LEU 1 1HD2 LEU 1 2.353 8.576 -1.319
12 2HD2 LEU 1 2HD2 LEU 1 2.829 8.832 0.359
13 3HD2 LEU 1 3HD2 LEU 1 3.833 9.460 -0.947
14 H GLU 2 H GLU 2 -0.828 12.427 -0.569
15 HA GLU 2 HA GLU 2 -2.703 11.170 1.302
16 1HB GLU 2 2HB GLU 2 -2.949 13.100 -0.922
17 2HB GLU 2 1HB GLU 2 -4.246 11.919 -0.804
18 1HG GLU 2 2HG GLU 2 -4.782 12.614 1.412
19 2HG GLU 2 1HG GLU 2 -3.345 13.643 1.491
20 H CYS 3 H CYS 3 -3.132 9.084 1.086
21 HA CYS 3 HA CYS 3 -3.074 7.894 -1.602
22 1HB CYS 3 2HB CYS 3 -1.657 6.989 0.871
23 2HB CYS 3 1HB CYS 3 -2.251 5.775 -0.263
24 H HIS 4 H HIS 4 -4.010 5.512 -1.357
25 HA HIS 4 HA HIS 4 -6.699 5.867 -0.406
26 1HB HIS 4 2HB HIS 4 -5.271 3.640 -1.855
27 2HB HIS 4 1HB HIS 4 -6.951 3.512 -1.336
28 HD1 HIS 4 1HD HIS 4 -8.602 5.372 -2.405
29 HD2 HIS 4 2HD HIS 4 -4.911 4.879 -4.250
30 HE1 HIS 4 1HE HIS 4 -8.839 6.427 -4.676
31 HE2 HIS 4 2HE HIS 4 -6.619 6.045 -5.804
32 H ASN 5 H ASN 5 -7.785 4.308 0.977
33 HA ASN 5 HA ASN 5 -5.985 2.973 2.882
34 1HB ASN 5 2HB ASN 5 -7.676 3.620 4.671
35 2HB ASN 5 1HB ASN 5 -6.682 4.931 4.037
36 1HD2 ASN 5 1HD2 ASN 5 -8.681 5.846 5.235
37 2HD2 ASN 5 2HD2 ASN 5 -9.974 6.308 4.185
38 H GLN 6 H GLN 6 -9.274 3.189 1.608
39 HA GLN 6 HA GLN 6 -10.253 0.815 2.750
40 1HB GLN 6 2HB GLN 6 -11.375 2.822 1.335
41 2HB GLN 6 1HB GLN 6 -11.288 1.586 0.082
42 1HG GLN 6 2HG GLN 6 -12.317 0.537 2.580
43 2HG GLN 6 1HG GLN 6 -13.276 1.887 1.976
44 1HE2 GLN 6 1HE2 GLN 6 -14.983 1.113 0.971
45 2HE2 GLN 6 2HE2 GLN 6 -14.996 -0.194 -0.159
46 H GLN 7 H GLN 7 -10.805 -1.188 1.611
47 HA GLN 7 HA GLN 7 -9.268 -1.866 -0.743
48 1HB GLN 7 2HB GLN 7 -8.194 -3.835 0.397
49 2HB GLN 7 1HB GLN 7 -7.557 -2.260 0.872
50 1HG GLN 7 2HG GLN 7 -9.702 -2.957 2.617
51 2HG GLN 7 1HG GLN 7 -8.575 -4.310 2.518
52 1HE2 GLN 7 1HE2 GLN 7 -8.003 -3.948 4.692
53 2HE2 GLN 7 2HE2 GLN 7 -6.938 -2.662 5.136
54 H SER 8 H SER 8 -9.547 -4.379 -1.117
55 HA SER 8 HA SER 8 -11.017 -6.007 -1.729
56 1HB SER 8 2HB SER 8 -12.207 -7.040 0.012
57 2HB SER 8 1HB SER 8 -10.880 -6.230 0.845
58 HG SER 8 HG SER 8 -13.601 -5.510 0.717
59 H SER 9 H SER 9 -11.653 -3.234 -2.442
60 HA SER 9 HA SER 9 -14.265 -3.673 -3.476
61 1HB SER 9 2HB SER 9 -14.812 -3.013 -1.124
62 2HB SER 9 1HB SER 9 -14.031 -1.460 -1.425
63 HG SER 9 HG SER 9 -15.594 -0.960 -2.898
64 H GLN 10 H GLN 10 -14.665 -2.390 -5.220
65 HA GLN 10 HA GLN 10 -12.497 -0.890 -6.285
66 1HB GLN 10 2HB GLN 10 -15.315 -1.448 -7.164
67 2HB GLN 10 1HB GLN 10 -14.313 -0.292 -8.038
68 1HG GLN 10 2HG GLN 10 -12.592 -2.270 -8.044
69 2HG GLN 10 1HG GLN 10 -14.042 -3.244 -7.801
70 1HE2 GLN 10 1HE2 GLN 10 -15.661 -3.233 -9.400
71 2HE2 GLN 10 2HE2 GLN 10 -15.304 -2.772 -11.035
72 H THR 11 H THR 11 -12.555 1.347 -6.938
73 HA THR 11 HA THR 11 -12.742 3.567 -6.477
74 HB THR 11 HB THR 11 -15.589 2.757 -5.865
75 HG1 THR 11 1HG THR 11 -14.384 3.750 -8.230
76 1HG2 THR 11 1HG2 THR 11 -14.448 5.230 -5.382
77 2HG2 THR 11 2HG2 THR 11 -16.166 4.871 -5.548
78 3HG2 THR 11 3HG2 THR 11 -15.238 5.406 -6.949
79 HA PRO 12 HA PRO 12 -12.499 2.676 -1.861
80 1HB PRO 12 2HB PRO 12 -9.828 3.006 -1.581
81 2HB PRO 12 1HB PRO 12 -10.554 1.452 -2.010
82 1HG PRO 12 2HG PRO 12 -9.263 3.494 -3.780
83 2HG PRO 12 1HG PRO 12 -9.091 1.726 -3.797
84 1HD PRO 12 2HD PRO 12 -10.701 3.069 -5.524
85 2HD PRO 12 1HD PRO 12 -11.057 1.422 -4.957
86 H THR 13 H THR 13 -11.279 4.162 -0.218
87 HA THR 13 HA THR 13 -11.774 6.920 -1.075
88 HB THR 13 HB THR 13 -11.447 7.154 1.581
89 HG1 THR 13 1HG THR 13 -11.798 5.356 2.631
90 1HG2 THR 13 1HG2 THR 13 -13.929 6.259 0.150
91 2HG2 THR 13 2HG2 THR 13 -13.454 7.901 0.587
92 3HG2 THR 13 3HG2 THR 13 -13.904 6.750 1.844
93 H THR 14 H THR 14 -10.348 8.450 0.535
94 HA THR 14 HA THR 14 -7.550 7.580 0.293
95 HB THR 14 HB THR 14 -6.928 9.831 -0.488
96 HG1 THR 14 1HG THR 14 -8.492 11.166 0.183
97 1HG2 THR 14 1HG2 THR 14 -8.716 9.603 -2.609
98 2HG2 THR 14 2HG2 THR 14 -8.453 7.956 -2.037
99 3HG2 THR 14 3HG2 THR 14 -7.079 8.955 -2.509
100 H THR 15 H THR 15 -6.061 8.714 1.690
101 HA THR 15 HA THR 15 -7.086 10.440 3.750
102 HB THR 15 HB THR 15 -7.787 8.242 4.601
103 HG1 THR 15 1HG THR 15 -6.941 8.521 6.613
104 1HG2 THR 15 1HG2 THR 15 -6.192 6.574 5.293
105 2HG2 THR 15 2HG2 THR 15 -4.863 7.539 4.650
106 3HG2 THR 15 3HG2 THR 15 -6.060 6.847 3.555
107 H GLY 16 H GLY 16 -5.524 11.846 4.214
108 1HA GLY 16 2HA GLY 16 -2.872 11.411 3.268
109 2HA GLY 16 1HA GLY 16 -3.466 12.858 4.053
110 H CYS 17 H CYS 17 -1.046 10.984 4.386
111 HA CYS 17 HA CYS 17 -1.362 10.131 7.147
112 1HB CYS 17 2HB CYS 17 1.074 9.992 5.357
113 2HB CYS 17 1HB CYS 17 0.872 9.183 6.913
114 H SER 18 H SER 18 0.985 10.563 8.338
115 HA SER 18 HA SER 18 2.089 13.142 8.043
116 1HB SER 18 2HB SER 18 -0.387 13.379 9.084
117 2HB SER 18 1HB SER 18 0.531 13.121 10.567
118 HG SER 18 HG SER 18 0.254 15.374 9.638
119 H GLY 19 H GLY 19 4.097 12.574 8.587
120 1HA GLY 19 2HA GLY 19 5.283 12.370 10.899
121 2HA GLY 19 1HA GLY 19 4.504 10.795 10.886
122 H GLY 20 H GLY 20 6.462 12.803 8.675
123 1HA GLY 20 2HA GLY 20 8.148 12.232 7.226
124 2HA GLY 20 1HA GLY 20 8.698 11.220 8.559
125 H GLU 21 H GLU 21 5.750 10.889 6.624
126 HA GLU 21 HA GLU 21 6.839 8.409 5.483
127 1HB GLU 21 2HB GLU 21 5.120 8.259 7.509
128 2HB GLU 21 1HB GLU 21 3.949 8.498 6.211
129 1HG GLU 21 2HG GLU 21 4.363 6.469 5.273
130 2HG GLU 21 1HG GLU 21 6.037 6.429 5.822
131 H ASN 22 H ASN 22 7.066 9.042 3.408
132 HA ASN 22 HA ASN 22 4.712 10.217 2.081
133 1HB ASN 22 2HB ASN 22 7.658 10.547 1.518
134 2HB ASN 22 1HB ASN 22 6.416 11.014 0.361
135 1HD2 ASN 22 1HD2 ASN 22 8.316 12.050 2.865
136 2HD2 ASN 22 2HD2 ASN 22 7.448 13.478 3.301
137 H ASN 23 H ASN 23 5.239 7.376 2.547
138 HA ASN 23 HA ASN 23 5.261 6.502 -0.263
139 1HB ASN 23 2HB ASN 23 6.543 5.054 2.067
140 2HB ASN 23 1HB ASN 23 6.425 4.434 0.418
141 1HD2 ASN 23 1HD2 ASN 23 7.763 7.026 2.388
142 2HD2 ASN 23 2HD2 ASN 23 9.118 7.357 1.355
143 H CYS 24 H CYS 24 3.999 4.620 -0.717
144 HA CYS 24 HA CYS 24 2.151 3.779 1.396
145 1HB CYS 24 2HB CYS 24 1.140 4.436 -1.366
146 2HB CYS 24 1HB CYS 24 0.208 4.149 0.107
147 H TYR 25 H TYR 25 2.245 1.647 1.526
148 HA TYR 25 HA TYR 25 3.280 0.080 -0.611
149 1HB TYR 25 2HB TYR 25 3.379 -1.702 0.946
150 2HB TYR 25 1HB TYR 25 3.829 -0.248 1.832
151 HD1 TYR 25 1HD TYR 25 2.158 0.807 3.366
152 HD2 TYR 25 2HD TYR 25 1.497 -3.003 1.584
153 HE1 TYR 25 1HE TYR 25 0.420 0.333 5.039
154 HE2 TYR 25 2HE TYR 25 -0.244 -3.484 3.254
155 HH TYR 25 HH TYR 25 -0.778 -2.690 5.641
156 H LYS 26 H LYS 26 2.181 -2.128 -0.953
157 HA LYS 26 HA LYS 26 -0.687 -2.191 -0.850
158 1HB LYS 26 2HB LYS 26 -0.146 -0.723 -2.854
159 2HB LYS 26 1HB LYS 26 0.581 -2.150 -3.592
160 1HG LYS 26 2HG LYS 26 -1.431 -3.171 -3.936
161 2HG LYS 26 1HG LYS 26 -2.204 -2.355 -2.575
162 1HD LYS 26 2HD LYS 26 -3.165 -1.065 -4.138
163 2HD LYS 26 1HD LYS 26 -1.595 -0.263 -4.230
164 1HE LYS 26 2HE LYS 26 -1.738 -0.773 -6.416
165 2HE LYS 26 1HE LYS 26 -1.182 -2.360 -5.885
166 1HZ LYS 26 1HZ LYS 26 -3.800 -1.535 -6.837
167 2HZ LYS 26 2HZ LYS 26 -3.801 -2.624 -5.544
168 3HZ LYS 26 3HZ LYS 26 -3.012 -3.025 -6.985
169 H LYS 27 H LYS 27 -0.391 -4.141 0.212
170 HA LYS 27 HA LYS 27 1.006 -6.259 -1.250
171 1HB LYS 27 2HB LYS 27 0.640 -7.443 1.046
172 2HB LYS 27 1HB LYS 27 1.913 -6.252 0.864
173 1HG LYS 27 2HG LYS 27 0.864 -4.734 2.195
174 2HG LYS 27 1HG LYS 27 -0.748 -5.320 1.784
175 1HD LYS 27 2HD LYS 27 -0.773 -6.772 3.494
176 2HD LYS 27 1HD LYS 27 0.886 -7.290 3.193
177 1HE LYS 27 2HE LYS 27 1.165 -4.712 4.155
178 2HE LYS 27 1HE LYS 27 -0.152 -5.377 5.121
179 1HZ LYS 27 1HZ LYS 27 1.650 -6.043 6.325
180 2HZ LYS 27 2HZ LYS 27 2.652 -6.220 4.973
181 3HZ LYS 27 3HZ LYS 27 1.478 -7.388 5.314
182 H GLU 28 H GLU 28 -0.016 -7.943 -2.093
183 HA GLU 28 HA GLU 28 -2.880 -8.284 -1.498
184 1HB GLU 28 2HB GLU 28 -2.612 -9.536 -3.875
185 2HB GLU 28 1HB GLU 28 -3.061 -7.839 -3.717
186 1HG GLU 28 2HG GLU 28 -0.653 -7.255 -3.964
187 2HG GLU 28 1HG GLU 28 -0.325 -8.955 -4.295
188 H TRP 29 H TRP 29 -3.544 -10.243 -0.798
189 HA TRP 29 HA TRP 29 -1.692 -12.506 -1.038
190 1HB TRP 29 2HB TRP 29 -1.950 -13.130 1.250
191 2HB TRP 29 1HB TRP 29 -1.521 -11.426 1.235
192 HD1 TRP 29 HD TRP 29 -3.855 -13.730 2.756
193 HE1 TRP 29 1HE TRP 29 -5.821 -12.498 3.876
194 HE3 TRP 29 3HE TRP 29 -3.182 -9.111 0.690
195 HZ2 TRP 29 2HZ TRP 29 -6.931 -9.902 3.880
196 HZ3 TRP 29 3HZ TRP 29 -4.737 -7.307 1.301
197 HH2 TRP 29 HH TRP 29 -6.571 -7.693 2.865
198 H ARG 30 H ARG 30 -2.640 -14.552 -1.113
199 HA ARG 30 HA ARG 30 -5.505 -14.526 -1.720
200 1HB ARG 30 2HB ARG 30 -4.897 -16.812 -2.759
201 2HB ARG 30 1HB ARG 30 -4.423 -15.347 -3.611
202 1HG ARG 30 2HG ARG 30 -2.341 -16.158 -1.807
203 2HG ARG 30 1HG ARG 30 -2.810 -17.507 -2.839
204 1HD ARG 30 2HD ARG 30 -1.037 -16.255 -3.899
205 2HD ARG 30 1HD ARG 30 -2.531 -16.066 -4.815
206 HE ARG 30 HE ARG 30 -2.028 -13.978 -2.886
207 1HH1 ARG 30 1HH1 ARG 30 -1.551 -15.046 -6.176
208 2HH1 ARG 30 2HH1 ARG 30 -1.304 -13.446 -6.790
209 1HH2 ARG 30 1HH2 ARG 30 -1.701 -11.876 -3.694
210 2HH2 ARG 30 2HH2 ARG 30 -1.388 -11.647 -5.382
211 H ASP 31 H ASP 31 -6.636 -16.648 -1.230
212 HA ASP 31 HA ASP 31 -5.725 -17.705 1.365
213 1HB ASP 31 2HB ASP 31 -8.197 -17.957 1.903
214 2HB ASP 31 1HB ASP 31 -7.578 -16.303 1.873
215 H ASN 32 H ASN 32 -7.760 -18.342 -1.476
216 HA ASN 32 HA ASN 32 -6.731 -20.935 -1.869
217 1HB ASN 32 2HB ASN 32 -8.637 -20.843 0.172
218 2HB ASN 32 1HB ASN 32 -9.521 -21.438 -1.230
219 1HD2 ASN 32 1HD2 ASN 32 -6.285 -21.894 0.165
220 2HD2 ASN 32 2HD2 ASN 32 -6.313 -23.620 0.092
221 H ARG 33 H ARG 33 -9.759 -19.086 -2.196
222 HA ARG 33 HA ARG 33 -9.803 -19.826 -5.044
223 1HB ARG 33 2HB ARG 33 -12.289 -18.889 -4.654
224 2HB ARG 33 1HB ARG 33 -11.853 -20.579 -4.420
225 1HG ARG 33 2HG ARG 33 -11.487 -20.046 -1.997
226 2HG ARG 33 1HG ARG 33 -12.174 -18.453 -2.314
227 1HD ARG 33 2HD ARG 33 -13.993 -20.221 -3.442
228 2HD ARG 33 1HD ARG 33 -13.496 -21.006 -1.943
229 HE ARG 33 HE ARG 33 -14.596 -19.380 -0.761
230 1HH1 ARG 33 1HH1 ARG 33 -14.254 -18.343 -4.075
231 2HH1 ARG 33 2HH1 ARG 33 -15.286 -16.965 -3.882
232 1HH2 ARG 33 1HH2 ARG 33 -15.952 -17.569 -0.504
233 2HH2 ARG 33 2HH2 ARG 33 -16.249 -16.525 -1.853
234 H GLY 34 H GLY 34 -10.129 -17.181 -2.742
235 1HA GLY 34 2HA GLY 34 -9.821 -15.299 -5.001
236 2HA GLY 34 1HA GLY 34 -10.840 -14.947 -3.613
237 H TYR 35 H TYR 35 -9.153 -13.038 -4.043
238 HA TYR 35 HA TYR 35 -7.240 -13.277 -1.869
239 1HB TYR 35 2HB TYR 35 -5.473 -12.161 -3.365
240 2HB TYR 35 1HB TYR 35 -5.754 -13.885 -3.586
241 HD1 TYR 35 1HD TYR 35 -5.866 -14.633 -5.758
242 HD2 TYR 35 2HD TYR 35 -7.099 -10.651 -4.906
243 HE1 TYR 35 1HE TYR 35 -6.295 -14.260 -8.151
244 HE2 TYR 35 2HE TYR 35 -7.531 -10.268 -7.297
245 HH TYR 35 HH TYR 35 -7.567 -12.820 -9.592
246 H ARG 36 H ARG 36 -6.419 -11.211 -1.143
247 HA ARG 36 HA ARG 36 -8.057 -8.928 -2.029
248 1HB ARG 36 2HB ARG 36 -7.852 -10.151 0.601
249 2HB ARG 36 1HB ARG 36 -7.433 -8.438 0.644
250 1HG ARG 36 2HG ARG 36 -9.561 -7.862 -0.352
251 2HG ARG 36 1HG ARG 36 -9.977 -9.570 -0.507
252 1HD ARG 36 2HD ARG 36 -9.333 -9.331 2.156
253 2HD ARG 36 1HD ARG 36 -10.136 -7.801 1.808
254 HE ARG 36 HE ARG 36 -11.805 -9.621 0.718
255 1HH1 ARG 36 1HH1 ARG 36 -10.347 -9.329 3.875
256 2HH1 ARG 36 2HH1 ARG 36 -11.658 -10.113 4.690
257 1HH2 ARG 36 1HH2 ARG 36 -13.530 -10.652 1.789
258 2HH2 ARG 36 2HH2 ARG 36 -13.464 -10.865 3.507
259 H THR 37 H THR 37 -7.050 -6.835 -0.907
260 HA THR 37 HA THR 37 -4.158 -6.883 -0.819
261 HB THR 37 HB THR 37 -5.366 -5.005 -2.817
262 HG1 THR 37 1HG THR 37 -6.038 -7.000 -3.550
263 1HG2 THR 37 1HG2 THR 37 -2.659 -6.281 -2.544
264 2HG2 THR 37 2HG2 THR 37 -3.075 -4.585 -2.297
265 3HG2 THR 37 3HG2 THR 37 -3.165 -5.290 -3.911
266 H GLU 38 H GLU 38 -3.557 -5.547 0.761
267 HA GLU 38 HA GLU 38 -5.367 -3.350 1.484
268 1HB GLU 38 2HB GLU 38 -3.818 -3.467 3.629
269 2HB GLU 38 1HB GLU 38 -5.214 -4.514 3.443
270 1HG GLU 38 2HG GLU 38 -3.702 -6.279 2.580
271 2HG GLU 38 1HG GLU 38 -2.336 -5.221 2.926
272 H ARG 39 H ARG 39 -4.439 -1.338 2.160
273 HA ARG 39 HA ARG 39 -1.752 -0.831 1.070
274 1HB ARG 39 2HB ARG 39 -4.273 0.776 0.682
275 2HB ARG 39 1HB ARG 39 -2.675 1.462 0.426
276 1HG ARG 39 2HG ARG 39 -3.209 0.820 -1.698
277 2HG ARG 39 1HG ARG 39 -2.364 -0.621 -1.130
278 1HD ARG 39 2HD ARG 39 -4.288 -1.469 -2.138
279 2HD ARG 39 1HD ARG 39 -4.684 -1.457 -0.420
280 HE ARG 39 HE ARG 39 -5.617 0.929 -1.271
281 1HH1 ARG 39 1HH1 ARG 39 -6.062 -2.337 -2.418
282 2HH1 ARG 39 2HH1 ARG 39 -7.652 -2.038 -3.035
283 1HH2 ARG 39 1HH2 ARG 39 -7.708 1.326 -2.083
284 2HH2 ARG 39 2HH2 ARG 39 -8.586 0.042 -2.845
285 H GLY 40 H GLY 40 -1.239 1.655 1.762
286 1HA GLY 40 2HA GLY 40 -1.986 2.952 3.952
287 2HA GLY 40 1HA GLY 40 -1.232 1.534 4.677
288 H CYS 41 H CYS 41 -0.208 3.932 5.325
289 HA CYS 41 HA CYS 41 1.957 4.653 3.566
290 1HB CYS 41 2HB CYS 41 0.801 5.679 6.082
291 2HB CYS 41 1HB CYS 41 2.539 5.926 5.895
292 H GLY 42 H GLY 42 3.903 3.751 3.516
293 1HA GLY 42 2HA GLY 42 5.802 3.186 5.151
294 2HA GLY 42 1HA GLY 42 4.669 1.980 5.742
295 H CYS 43 H CYS 43 6.801 0.785 5.086
296 HA CYS 43 HA CYS 43 6.181 -0.604 2.629
297 1HB CYS 43 2HB CYS 43 7.728 1.413 2.106
298 2HB CYS 43 1HB CYS 43 8.983 0.450 2.877
299 HA PRO 44 HA PRO 44 7.922 -3.070 6.270
300 1HB PRO 44 2HB PRO 44 5.616 -4.770 5.495
301 2HB PRO 44 1HB PRO 44 6.158 -4.267 7.105
302 1HG PRO 44 2HG PRO 44 3.977 -3.201 5.992
303 2HG PRO 44 1HG PRO 44 5.086 -2.218 6.968
304 1HD PRO 44 2HD PRO 44 4.795 -2.363 3.994
305 2HD PRO 44 1HD PRO 44 5.092 -0.953 5.031
306 H SER 45 H SER 45 8.570 -5.399 6.191
307 HA SER 45 HA SER 45 8.508 -6.935 3.855
308 1HB SER 45 2HB SER 45 10.101 -4.796 3.388
309 2HB SER 45 1HB SER 45 11.283 -5.919 4.061
310 HG SER 45 HG SER 45 9.532 -6.464 1.892
311 H VAL 46 H VAL 46 8.105 -8.397 5.602
312 HA VAL 46 HA VAL 46 10.563 -9.457 6.756
313 HB VAL 46 HB VAL 46 8.053 -9.358 8.273
314 1HG1 VAL 46 1HG1 VAL 46 9.265 -10.947 9.351
315 2HG1 VAL 46 2HG1 VAL 46 9.926 -9.525 10.156
316 3HG1 VAL 46 3HG1 VAL 46 10.805 -10.269 8.821
317 1HG2 VAL 46 1HG2 VAL 46 8.857 -7.459 9.534
318 2HG2 VAL 46 2HG2 VAL 46 8.807 -7.055 7.817
319 3HG2 VAL 46 3HG2 VAL 46 10.345 -7.441 8.588
320 H LYS 47 H LYS 47 8.547 -10.084 4.670
321 HA LYS 47 HA LYS 47 8.525 -12.944 5.084
322 1HB LYS 47 2HB LYS 47 6.040 -13.039 4.479
323 2HB LYS 47 1HB LYS 47 6.452 -12.566 6.121
324 1HG LYS 47 2HG LYS 47 6.176 -10.357 4.199
325 2HG LYS 47 1HG LYS 47 4.697 -11.249 4.562
326 1HD LYS 47 2HD LYS 47 5.756 -10.921 7.048
327 2HD LYS 47 1HD LYS 47 6.275 -9.436 6.249
328 1HE LYS 47 2HE LYS 47 3.938 -9.031 5.561
329 2HE LYS 47 1HE LYS 47 3.450 -10.473 6.452
330 1HZ LYS 47 1HZ LYS 47 4.528 -7.938 7.532
331 2HZ LYS 47 2HZ LYS 47 4.487 -9.357 8.451
332 3HZ LYS 47 3HZ LYS 47 3.047 -8.680 7.879
333 H LYS 48 H LYS 48 7.309 -13.995 3.102
334 HA LYS 48 HA LYS 48 7.839 -12.439 0.672
335 1HB LYS 48 2HB LYS 48 8.862 -14.513 -0.337
336 2HB LYS 48 1HB LYS 48 9.831 -13.720 0.896
337 1HG LYS 48 2HG LYS 48 8.159 -15.669 2.139
338 2HG LYS 48 1HG LYS 48 9.010 -16.411 0.782
339 1HD LYS 48 2HD LYS 48 10.504 -16.700 2.532
340 2HD LYS 48 1HD LYS 48 11.096 -15.225 1.765
341 1HE LYS 48 2HE LYS 48 10.246 -13.862 3.455
342 2HE LYS 48 1HE LYS 48 9.134 -15.105 4.026
343 1HZ LYS 48 1HZ LYS 48 10.772 -16.171 5.180
344 2HZ LYS 48 2HZ LYS 48 11.327 -14.579 5.312
345 3HZ LYS 48 3HZ LYS 48 12.018 -15.622 4.175
346 H GLY 49 H GLY 49 7.014 -13.709 -1.310
347 1HA GLY 49 2HA GLY 49 5.412 -15.183 -2.255
348 2HA GLY 49 1HA GLY 49 4.673 -15.353 -0.663
349 H ILE 50 H ILE 50 3.928 -13.049 0.192
350 HA ILE 50 HA ILE 50 1.747 -12.289 -1.394
351 HB ILE 50 HB ILE 50 3.022 -10.667 0.812
352 1HG1 ILE 50 2HG1 ILE 50 1.081 -12.977 0.870
353 2HG1 ILE 50 1HG1 ILE 50 2.612 -12.815 1.733
354 1HG2 ILE 50 1HG2 ILE 50 1.109 -9.413 0.919
355 2HG2 ILE 50 2HG2 ILE 50 0.102 -10.689 0.235
356 3HG2 ILE 50 3HG2 ILE 50 1.161 -9.746 -0.812
357 1HD1 ILE 50 1HD1 ILE 50 1.349 -12.261 3.479
358 2HD1 ILE 50 2HD1 ILE 50 -0.063 -11.939 2.472
359 3HD1 ILE 50 3HD1 ILE 50 1.170 -10.695 2.686
360 H GLY 51 H GLY 51 1.388 -10.632 -2.804
361 1HA GLY 51 2HA GLY 51 3.723 -9.447 -4.026
362 2HA GLY 51 1HA GLY 51 2.060 -9.277 -4.568
363 H ILE 52 H ILE 52 4.552 -8.010 -2.488
364 HA ILE 52 HA ILE 52 2.826 -5.755 -1.742
365 HB ILE 52 HB ILE 52 3.987 -6.892 0.101
366 1HG1 ILE 52 2HG1 ILE 52 5.329 -4.223 -0.164
367 2HG1 ILE 52 1HG1 ILE 52 3.567 -4.309 -0.086
368 1HG2 ILE 52 1HG2 ILE 52 6.510 -5.990 -1.281
369 2HG2 ILE 52 2HG2 ILE 52 5.958 -7.655 -1.098
370 3HG2 ILE 52 3HG2 ILE 52 6.421 -6.718 0.323
371 1HD1 ILE 52 1HD1 ILE 52 5.506 -4.490 2.023
372 2HD1 ILE 52 2HD1 ILE 52 4.476 -5.922 1.998
373 3HD1 ILE 52 3HD1 ILE 52 3.754 -4.317 2.117
374 H ASN 53 H ASN 53 3.174 -3.737 -2.458
375 HA ASN 53 HA ASN 53 5.686 -3.100 -3.813
376 1HB ASN 53 2HB ASN 53 4.504 -2.107 -5.723
377 2HB ASN 53 1HB ASN 53 4.155 -3.832 -5.589
378 1HD2 ASN 53 1HD2 ASN 53 2.103 -4.500 -5.183
379 2HD2 ASN 53 2HD2 ASN 53 0.743 -3.436 -5.121
380 H CYS 54 H CYS 54 6.362 -1.042 -3.493
381 HA CYS 54 HA CYS 54 4.543 0.732 -2.002
382 1HB CYS 54 2HB CYS 54 7.565 0.624 -1.884
383 2HB CYS 54 1HB CYS 54 6.529 1.701 -0.944
384 H CYS 55 H CYS 55 4.570 2.952 -2.453
385 HA CYS 55 HA CYS 55 6.039 3.816 -4.833
386 1HB CYS 55 2HB CYS 55 3.853 5.031 -5.518
387 2HB CYS 55 1HB CYS 55 4.013 3.311 -5.879
388 H THR 56 H THR 56 5.358 6.316 -5.158
389 HA THR 56 HA THR 56 5.188 7.656 -2.572
390 HB THR 56 HB THR 56 7.594 7.288 -2.944
391 HG1 THR 56 1HG THR 56 6.720 9.968 -3.228
392 1HG2 THR 56 1HG2 THR 56 6.988 8.419 -5.594
393 2HG2 THR 56 2HG2 THR 56 8.212 7.246 -5.106
394 3HG2 THR 56 3HG2 THR 56 8.476 8.968 -4.823
395 H THR 57 H THR 57 3.151 7.701 -4.257
396 HA THR 57 HA THR 57 3.111 10.466 -5.154
397 HB THR 57 HB THR 57 1.788 9.341 -7.245
398 HG1 THR 57 1HG THR 57 4.030 7.679 -6.752
399 1HG2 THR 57 1HG2 THR 57 4.267 10.691 -6.878
400 2HG2 THR 57 2HG2 THR 57 3.219 10.650 -8.295
401 3HG2 THR 57 3HG2 THR 57 4.468 9.422 -8.086
402 H ASP 58 H ASP 58 0.991 11.330 -5.384
403 HA ASP 58 HA ASP 58 -0.846 10.474 -3.476
404 1HB ASP 58 2HB ASP 58 -2.434 12.028 -4.732
405 2HB ASP 58 1HB ASP 58 -0.941 12.741 -4.136
406 H ARG 59 H ARG 59 -2.342 8.933 -3.460
407 HA ARG 59 HA ARG 59 -3.685 7.220 -4.124
408 1HB ARG 59 2HB ARG 59 -4.007 8.715 -6.722
409 2HB ARG 59 1HB ARG 59 -5.150 7.617 -5.962
410 1HG ARG 59 2HG ARG 59 -5.144 9.344 -4.030
411 2HG ARG 59 1HG ARG 59 -4.479 10.438 -5.251
412 1HD ARG 59 2HD ARG 59 -6.914 8.833 -5.890
413 2HD ARG 59 1HD ARG 59 -7.068 10.268 -4.869
414 HE ARG 59 HE ARG 59 -5.610 10.723 -7.307
415 1HH1 ARG 59 1HH1 ARG 59 -8.774 10.624 -5.839
416 2HH1 ARG 59 2HH1 ARG 59 -9.489 11.677 -7.013
417 1HH2 ARG 59 1HH2 ARG 59 -6.548 12.109 -8.851
418 2HH2 ARG 59 2HH2 ARG 59 -8.226 12.521 -8.723
419 H CYS 60 H CYS 60 -0.819 7.125 -4.757
420 HA CYS 60 HA CYS 60 -0.427 5.949 -7.299
421 1HB CYS 60 2HB CYS 60 1.768 5.344 -6.448
422 2HB CYS 60 1HB CYS 60 1.375 6.995 -5.975
423 H ASN 61 H ASN 61 -1.422 4.709 -4.199
424 HA ASN 61 HA ASN 61 -1.140 1.949 -5.129
425 1HB ASN 61 2HB ASN 61 -1.639 1.311 -2.816
426 2HB ASN 61 1HB ASN 61 -0.310 2.472 -2.874
427 1HD2 ASN 61 1HD2 ASN 61 -1.014 2.601 -0.562
428 2HD2 ASN 61 2HD2 ASN 61 -2.222 3.786 -0.172
429 H ASN 62 H ASN 62 -3.004 3.236 -6.585
430 HA ASN 62 HA ASN 62 -5.625 3.200 -5.566
431 1HB ASN 62 2HB ASN 62 -6.253 3.115 -8.029
432 2HB ASN 62 1HB ASN 62 -5.236 4.467 -7.532
433 1HD2 ASN 62 1HD2 ASN 62 -4.053 4.905 -9.263
434 2HD2 ASN 62 2HD2 ASN 62 -3.072 3.761 -10.127
Start of MODEL 11
1 1H LEU 1 1HT LEU 1 2.075 14.212 1.267
2 2H LEU 1 2HT LEU 1 1.822 12.922 2.370
3 3H LEU 1 3HT LEU 1 0.511 13.928 1.907
4 HA LEU 1 HA LEU 1 0.919 13.178 -0.409
5 1HB LEU 1 2HB LEU 1 3.170 12.122 0.751
6 2HB LEU 1 1HB LEU 1 2.128 10.715 0.642
7 HG LEU 1 HG LEU 1 1.838 11.640 -1.859
8 1HD1 LEU 1 1HD1 LEU 1 4.298 12.885 -0.793
9 2HD1 LEU 1 2HD1 LEU 1 3.216 13.421 -2.079
10 3HD1 LEU 1 3HD1 LEU 1 4.402 12.156 -2.395
11 1HD2 LEU 1 1HD2 LEU 1 3.718 9.746 -0.576
12 2HD2 LEU 1 2HD2 LEU 1 4.016 10.157 -2.264
13 3HD2 LEU 1 3HD2 LEU 1 2.469 9.462 -1.787
14 H GLU 2 H GLU 2 -1.141 12.637 -0.696
15 HA GLU 2 HA GLU 2 -2.566 11.033 1.234
16 1HB GLU 2 2HB GLU 2 -3.306 12.518 -1.259
17 2HB GLU 2 1HB GLU 2 -4.413 11.319 -0.606
18 1HG GLU 2 2HG GLU 2 -4.454 12.519 1.525
19 2HG GLU 2 1HG GLU 2 -3.359 13.734 0.852
20 H CYS 3 H CYS 3 -3.852 9.146 0.590
21 HA CYS 3 HA CYS 3 -3.054 7.696 -1.773
22 1HB CYS 3 2HB CYS 3 -2.104 6.921 0.965
23 2HB CYS 3 1HB CYS 3 -2.427 5.674 -0.242
24 H HIS 4 H HIS 4 -4.044 5.370 -1.625
25 HA HIS 4 HA HIS 4 -6.828 5.738 -0.878
26 1HB HIS 4 2HB HIS 4 -5.349 3.755 -2.594
27 2HB HIS 4 1HB HIS 4 -7.026 3.494 -2.120
28 HD1 HIS 4 1HD HIS 4 -8.809 5.081 -3.152
29 HD2 HIS 4 2HD HIS 4 -4.940 5.709 -4.533
30 HE1 HIS 4 1HE HIS 4 -9.050 6.548 -5.181
31 HE2 HIS 4 2HE HIS 4 -6.704 6.837 -6.052
32 H ASN 5 H ASN 5 -6.945 5.423 1.319
33 HA ASN 5 HA ASN 5 -5.581 3.464 2.780
34 1HB ASN 5 2HB ASN 5 -7.446 3.827 4.481
35 2HB ASN 5 1HB ASN 5 -6.547 5.262 3.994
36 1HD2 ASN 5 1HD2 ASN 5 -8.701 5.906 5.098
37 2HD2 ASN 5 2HD2 ASN 5 -9.961 6.312 3.987
38 H GLN 6 H GLN 6 -8.535 3.316 0.925
39 HA GLN 6 HA GLN 6 -9.357 0.774 1.998
40 1HB GLN 6 2HB GLN 6 -10.695 2.758 0.733
41 2HB GLN 6 1HB GLN 6 -10.433 1.651 -0.614
42 1HG GLN 6 2HG GLN 6 -12.483 0.988 0.211
43 2HG GLN 6 1HG GLN 6 -11.371 -0.147 0.974
44 1HE2 GLN 6 1HE2 GLN 6 -11.062 -0.079 3.165
45 2HE2 GLN 6 2HE2 GLN 6 -12.027 0.883 4.228
46 H GLN 7 H GLN 7 -9.663 -1.135 0.612
47 HA GLN 7 HA GLN 7 -7.426 -1.431 -1.282
48 1HB GLN 7 2HB GLN 7 -7.812 -3.959 -0.682
49 2HB GLN 7 1HB GLN 7 -6.872 -2.922 0.391
50 1HG GLN 7 2HG GLN 7 -9.811 -3.325 0.800
51 2HG GLN 7 1HG GLN 7 -8.629 -4.484 1.410
52 1HE2 GLN 7 1HE2 GLN 7 -10.485 -2.728 2.843
53 2HE2 GLN 7 2HE2 GLN 7 -9.509 -1.775 3.904
54 H SER 8 H SER 8 -7.997 -3.673 -2.593
55 HA SER 8 HA SER 8 -9.870 -2.931 -4.506
56 1HB SER 8 2HB SER 8 -9.781 -5.470 -5.091
57 2HB SER 8 1HB SER 8 -8.313 -4.506 -5.241
58 HG SER 8 HG SER 8 -7.933 -6.462 -4.124
59 H SER 9 H SER 9 -11.817 -2.352 -3.537
60 HA SER 9 HA SER 9 -13.589 -4.591 -2.986
61 1HB SER 9 2HB SER 9 -13.469 -2.284 -1.039
62 2HB SER 9 1HB SER 9 -14.366 -3.793 -0.875
63 HG SER 9 HG SER 9 -12.258 -4.843 -0.871
64 H GLN 10 H GLN 10 -15.799 -3.150 -2.117
65 HA GLN 10 HA GLN 10 -16.641 -1.966 -4.586
66 1HB GLN 10 2HB GLN 10 -17.957 -2.582 -1.965
67 2HB GLN 10 1HB GLN 10 -18.764 -1.528 -3.123
68 1HG GLN 10 2HG GLN 10 -18.093 -3.582 -4.728
69 2HG GLN 10 1HG GLN 10 -18.303 -4.430 -3.197
70 1HE2 GLN 10 1HE2 GLN 10 -19.955 -1.682 -4.719
71 2HE2 GLN 10 2HE2 GLN 10 -21.548 -2.365 -4.616
72 H THR 11 H THR 11 -17.524 -0.532 -1.489
73 HA THR 11 HA THR 11 -17.287 2.083 -2.463
74 HB THR 11 HB THR 11 -17.242 1.490 0.466
75 HG1 THR 11 1HG THR 11 -19.404 1.028 -1.303
76 1HG2 THR 11 1HG2 THR 11 -17.566 3.816 -0.837
77 2HG2 THR 11 2HG2 THR 11 -18.271 3.463 0.742
78 3HG2 THR 11 3HG2 THR 11 -19.244 3.284 -0.719
79 HA PRO 12 HA PRO 12 -12.866 2.350 -1.592
80 1HB PRO 12 2HB PRO 12 -12.272 4.232 -3.379
81 2HB PRO 12 1HB PRO 12 -12.686 2.593 -3.895
82 1HG PRO 12 2HG PRO 12 -14.346 5.072 -3.936
83 2HG PRO 12 1HG PRO 12 -14.276 3.745 -5.113
84 1HD PRO 12 2HD PRO 12 -16.202 4.068 -3.100
85 2HD PRO 12 1HD PRO 12 -15.893 2.580 -4.022
86 H THR 13 H THR 13 -11.402 4.111 -0.906
87 HA THR 13 HA THR 13 -12.585 6.618 -0.097
88 HB THR 13 HB THR 13 -11.826 6.254 2.314
89 HG1 THR 13 1HG THR 13 -10.739 4.421 2.390
90 1HG2 THR 13 1HG2 THR 13 -14.065 4.400 1.618
91 2HG2 THR 13 2HG2 THR 13 -14.238 6.148 1.462
92 3HG2 THR 13 3HG2 THR 13 -13.872 5.436 3.033
93 H THR 14 H THR 14 -10.956 8.053 0.953
94 HA THR 14 HA THR 14 -8.218 7.351 0.122
95 HB THR 14 HB THR 14 -7.884 9.722 -0.500
96 HG1 THR 14 1HG THR 14 -9.338 10.916 0.511
97 1HG2 THR 14 1HG2 THR 14 -10.191 8.404 -1.909
98 2HG2 THR 14 2HG2 THR 14 -8.479 8.249 -2.300
99 3HG2 THR 14 3HG2 THR 14 -9.294 9.797 -2.514
100 H THR 15 H THR 15 -6.512 8.431 1.284
101 HA THR 15 HA THR 15 -7.287 9.592 3.862
102 HB THR 15 HB THR 15 -6.879 7.200 4.254
103 HG1 THR 15 1HG THR 15 -5.248 7.489 5.846
104 1HG2 THR 15 1HG2 THR 15 -4.350 7.755 2.805
105 2HG2 THR 15 2HG2 THR 15 -5.399 6.337 2.757
106 3HG2 THR 15 3HG2 THR 15 -4.330 6.597 4.135
107 H GLY 16 H GLY 16 -4.992 10.148 5.021
108 1HA GLY 16 2HA GLY 16 -3.011 11.066 3.187
109 2HA GLY 16 1HA GLY 16 -3.967 12.365 3.873
110 H CYS 17 H CYS 17 -1.082 11.107 4.132
111 HA CYS 17 HA CYS 17 -0.979 11.425 7.060
112 1HB CYS 17 2HB CYS 17 0.684 9.545 5.364
113 2HB CYS 17 1HB CYS 17 0.899 9.813 7.096
114 H SER 18 H SER 18 1.597 11.626 7.583
115 HA SER 18 HA SER 18 3.123 13.148 5.736
116 1HB SER 18 2HB SER 18 1.242 14.749 6.547
117 2HB SER 18 1HB SER 18 2.162 14.808 8.051
118 HG SER 18 HG SER 18 3.121 16.372 6.968
119 H GLY 19 H GLY 19 4.924 14.413 7.098
120 1HA GLY 19 2HA GLY 19 6.581 14.326 8.714
121 2HA GLY 19 1HA GLY 19 5.610 13.159 9.598
122 H GLY 20 H GLY 20 7.265 11.732 10.032
123 1HA GLY 20 2HA GLY 20 9.273 10.859 8.379
124 2HA GLY 20 1HA GLY 20 8.546 9.869 9.638
125 H GLU 21 H GLU 21 5.901 10.014 8.249
126 HA GLU 21 HA GLU 21 6.350 7.750 6.499
127 1HB GLU 21 2HB GLU 21 4.380 8.311 8.266
128 2HB GLU 21 1HB GLU 21 3.624 8.872 6.775
129 1HG GLU 21 2HG GLU 21 3.149 6.799 6.176
130 2HG GLU 21 1HG GLU 21 4.836 6.315 6.339
131 H ASN 22 H ASN 22 6.301 7.771 4.337
132 HA ASN 22 HA ASN 22 4.921 9.809 2.852
133 1HB ASN 22 2HB ASN 22 7.354 10.622 3.595
134 2HB ASN 22 1HB ASN 22 7.819 9.689 2.175
135 1HD2 ASN 22 1HD2 ASN 22 5.186 11.913 3.038
136 2HD2 ASN 22 2HD2 ASN 22 5.332 12.900 1.628
137 H ASN 23 H ASN 23 4.929 6.912 3.093
138 HA ASN 23 HA ASN 23 5.234 6.287 0.258
139 1HB ASN 23 2HB ASN 23 6.711 4.972 2.494
140 2HB ASN 23 1HB ASN 23 6.141 3.960 1.164
141 1HD2 ASN 23 1HD2 ASN 23 8.029 6.841 1.917
142 2HD2 ASN 23 2HD2 ASN 23 9.098 6.714 0.555
143 H CYS 24 H CYS 24 3.934 4.529 -0.452
144 HA CYS 24 HA CYS 24 1.979 3.543 1.506
145 1HB CYS 24 2HB CYS 24 1.316 4.602 -1.249
146 2HB CYS 24 1HB CYS 24 0.174 3.846 -0.133
147 H TYR 25 H TYR 25 2.121 1.425 1.559
148 HA TYR 25 HA TYR 25 3.242 -0.071 -0.583
149 1HB TYR 25 2HB TYR 25 3.263 -1.904 0.925
150 2HB TYR 25 1HB TYR 25 3.688 -0.476 1.865
151 HD1 TYR 25 1HD TYR 25 1.175 -3.068 1.293
152 HD2 TYR 25 2HD TYR 25 2.136 0.430 3.515
153 HE1 TYR 25 1HE TYR 25 -0.638 -3.581 2.874
154 HE2 TYR 25 2HE TYR 25 0.327 -0.072 5.103
155 HH TYR 25 HH TYR 25 -0.963 -2.021 5.869
156 H LYS 26 H LYS 26 2.222 -2.070 -1.399
157 HA LYS 26 HA LYS 26 -0.690 -2.180 -1.269
158 1HB LYS 26 2HB LYS 26 -0.074 -0.578 -3.143
159 2HB LYS 26 1HB LYS 26 0.663 -1.956 -3.962
160 1HG LYS 26 2HG LYS 26 -1.433 -3.060 -4.159
161 2HG LYS 26 1HG LYS 26 -2.218 -1.888 -3.101
162 1HD LYS 26 2HD LYS 26 -2.790 -0.759 -4.935
163 2HD LYS 26 1HD LYS 26 -1.083 -0.355 -5.129
164 1HE LYS 26 2HE LYS 26 -1.690 -1.285 -7.185
165 2HE LYS 26 1HE LYS 26 -0.879 -2.601 -6.337
166 1HZ LYS 26 1HZ LYS 26 -3.316 -3.123 -5.584
167 2HZ LYS 26 2HZ LYS 26 -2.736 -3.663 -7.079
168 3HZ LYS 26 3HZ LYS 26 -3.714 -2.285 -7.000
169 H LYS 27 H LYS 27 0.245 -4.103 -0.127
170 HA LYS 27 HA LYS 27 1.495 -6.141 -1.709
171 1HB LYS 27 2HB LYS 27 1.088 -7.508 0.403
172 2HB LYS 27 1HB LYS 27 2.161 -6.125 0.533
173 1HG LYS 27 2HG LYS 27 0.565 -4.864 1.692
174 2HG LYS 27 1HG LYS 27 -0.748 -5.943 1.222
175 1HD LYS 27 2HD LYS 27 1.550 -6.837 2.945
176 2HD LYS 27 1HD LYS 27 0.077 -6.133 3.616
177 1HE LYS 27 2HE LYS 27 -1.161 -7.922 2.260
178 2HE LYS 27 1HE LYS 27 0.412 -8.702 2.100
179 1HZ LYS 27 1HZ LYS 27 -1.308 -8.458 4.428
180 2HZ LYS 27 2HZ LYS 27 0.348 -8.272 4.719
181 3HZ LYS 27 3HZ LYS 27 -0.230 -9.690 4.000
182 H GLU 28 H GLU 28 0.674 -8.342 -1.855
183 HA GLU 28 HA GLU 28 -2.257 -8.446 -2.109
184 1HB GLU 28 2HB GLU 28 -1.478 -10.187 -4.015
185 2HB GLU 28 1HB GLU 28 -1.832 -8.491 -4.334
186 1HG GLU 28 2HG GLU 28 0.380 -7.940 -4.584
187 2HG GLU 28 1HG GLU 28 0.941 -9.281 -3.588
188 H TRP 29 H TRP 29 -3.235 -10.441 -1.661
189 HA TRP 29 HA TRP 29 -1.614 -12.707 -0.915
190 1HB TRP 29 2HB TRP 29 -2.144 -12.836 1.365
191 2HB TRP 29 1HB TRP 29 -1.742 -11.142 1.123
192 HD1 TRP 29 HD TRP 29 -4.179 -13.185 2.786
193 HE1 TRP 29 1HE TRP 29 -6.324 -11.873 3.346
194 HE3 TRP 29 3HE TRP 29 -3.434 -9.120 -0.209
195 HZ2 TRP 29 2HZ TRP 29 -7.531 -9.428 2.614
196 HZ3 TRP 29 3HZ TRP 29 -5.127 -7.339 -0.220
197 HH2 TRP 29 HH TRP 29 -7.131 -7.488 1.162
198 H ARG 30 H ARG 30 -2.664 -14.590 -1.194
199 HA ARG 30 HA ARG 30 -5.380 -14.446 -2.216
200 1HB ARG 30 2HB ARG 30 -4.862 -17.005 -2.550
201 2HB ARG 30 1HB ARG 30 -4.187 -15.797 -3.639
202 1HG ARG 30 2HG ARG 30 -2.059 -16.007 -2.751
203 2HG ARG 30 1HG ARG 30 -2.649 -16.695 -1.237
204 1HD ARG 30 2HD ARG 30 -3.266 -18.258 -3.649
205 2HD ARG 30 1HD ARG 30 -1.552 -18.131 -3.257
206 HE ARG 30 HE ARG 30 -3.336 -18.909 -1.095
207 1HH1 ARG 30 1HH1 ARG 30 -1.061 -19.920 -3.550
208 2HH1 ARG 30 2HH1 ARG 30 -0.737 -21.443 -2.793
209 1HH2 ARG 30 1HH2 ARG 30 -2.909 -20.912 -0.108
210 2HH2 ARG 30 2HH2 ARG 30 -1.786 -22.007 -0.843
211 H ASP 31 H ASP 31 -7.003 -16.014 -1.553
212 HA ASP 31 HA ASP 31 -6.714 -17.354 0.971
213 1HB ASP 31 2HB ASP 31 -8.517 -16.097 2.117
214 2HB ASP 31 1HB ASP 31 -7.094 -15.099 1.798
215 H ASN 32 H ASN 32 -7.269 -19.051 -0.541
216 HA ASN 32 HA ASN 32 -8.728 -20.614 -1.317
217 1HB ASN 32 2HB ASN 32 -9.964 -19.958 0.831
218 2HB ASN 32 1HB ASN 32 -10.998 -18.975 -0.202
219 1HD2 ASN 32 1HD2 ASN 32 -12.847 -20.121 0.090
220 2HD2 ASN 32 2HD2 ASN 32 -13.068 -21.743 -0.463
221 H ARG 33 H ARG 33 -8.607 -20.460 -3.473
222 HA ARG 33 HA ARG 33 -8.866 -19.652 -5.586
223 1HB ARG 33 2HB ARG 33 -10.844 -20.422 -6.341
224 2HB ARG 33 1HB ARG 33 -10.917 -21.082 -4.716
225 1HG ARG 33 2HG ARG 33 -12.057 -18.651 -4.349
226 2HG ARG 33 1HG ARG 33 -12.571 -19.027 -5.993
227 1HD ARG 33 2HD ARG 33 -13.861 -20.778 -5.335
228 2HD ARG 33 1HD ARG 33 -12.800 -21.194 -3.990
229 HE ARG 33 HE ARG 33 -14.038 -19.828 -2.627
230 1HH1 ARG 33 1HH1 ARG 33 -14.867 -19.174 -5.954
231 2HH1 ARG 33 2HH1 ARG 33 -16.211 -18.159 -5.550
232 1HH2 ARG 33 1HH2 ARG 33 -15.805 -18.493 -2.095
233 2HH2 ARG 33 2HH2 ARG 33 -16.743 -17.773 -3.359
234 H GLY 34 H GLY 34 -8.446 -17.461 -3.746
235 1HA GLY 34 2HA GLY 34 -9.478 -15.352 -5.445
236 2HA GLY 34 1HA GLY 34 -10.055 -15.302 -3.788
237 H TYR 35 H TYR 35 -8.648 -13.204 -4.829
238 HA TYR 35 HA TYR 35 -6.447 -13.061 -2.993
239 1HB TYR 35 2HB TYR 35 -4.932 -12.240 -4.999
240 2HB TYR 35 1HB TYR 35 -5.014 -13.942 -4.558
241 HD1 TYR 35 1HD TYR 35 -5.983 -11.426 -7.041
242 HD2 TYR 35 2HD TYR 35 -6.125 -15.546 -5.994
243 HE1 TYR 35 1HE TYR 35 -6.682 -11.978 -9.333
244 HE2 TYR 35 2HE TYR 35 -6.824 -16.110 -8.283
245 HH TYR 35 HH TYR 35 -8.008 -14.886 -10.201
246 H ARG 36 H ARG 36 -5.958 -10.995 -2.417
247 HA ARG 36 HA ARG 36 -7.119 -8.802 -3.979
248 1HB ARG 36 2HB ARG 36 -7.435 -9.047 -0.981
249 2HB ARG 36 1HB ARG 36 -8.074 -7.766 -2.010
250 1HG ARG 36 2HG ARG 36 -9.948 -8.918 -2.230
251 2HG ARG 36 1HG ARG 36 -9.048 -10.194 -3.050
252 1HD ARG 36 2HD ARG 36 -9.891 -11.423 -1.334
253 2HD ARG 36 1HD ARG 36 -8.435 -10.826 -0.540
254 HE ARG 36 HE ARG 36 -10.736 -9.130 -0.205
255 1HH1 ARG 36 1HH1 ARG 36 -8.975 -11.866 1.058
256 2HH1 ARG 36 2HH1 ARG 36 -9.610 -11.693 2.659
257 1HH2 ARG 36 1HH2 ARG 36 -11.567 -8.898 1.902
258 2HH2 ARG 36 2HH2 ARG 36 -11.081 -10.008 3.140
259 H THR 37 H THR 37 -6.407 -6.627 -2.825
260 HA THR 37 HA THR 37 -3.617 -6.899 -1.947
261 HB THR 37 HB THR 37 -2.953 -5.031 -3.357
262 HG1 THR 37 1HG THR 37 -4.921 -3.915 -3.426
263 1HG2 THR 37 1HG2 THR 37 -2.498 -6.658 -4.803
264 2HG2 THR 37 2HG2 THR 37 -3.951 -6.122 -5.649
265 3HG2 THR 37 3HG2 THR 37 -4.036 -7.472 -4.516
266 H GLU 38 H GLU 38 -2.994 -5.557 -0.308
267 HA GLU 38 HA GLU 38 -4.981 -3.582 0.590
268 1HB GLU 38 2HB GLU 38 -3.599 -4.108 2.857
269 2HB GLU 38 1HB GLU 38 -5.100 -4.902 2.415
270 1HG GLU 38 2HG GLU 38 -3.537 -6.624 1.255
271 2HG GLU 38 1HG GLU 38 -2.305 -5.935 2.309
272 H ARG 39 H ARG 39 -4.231 -1.638 1.434
273 HA ARG 39 HA ARG 39 -1.377 -1.075 1.010
274 1HB ARG 39 2HB ARG 39 -3.545 0.901 0.332
275 2HB ARG 39 1HB ARG 39 -1.846 0.957 -0.113
276 1HG ARG 39 2HG ARG 39 -2.342 -0.002 -2.041
277 2HG ARG 39 1HG ARG 39 -2.882 -1.440 -1.173
278 1HD ARG 39 2HD ARG 39 -5.114 -0.389 -0.924
279 2HD ARG 39 1HD ARG 39 -4.552 0.960 -1.910
280 HE ARG 39 HE ARG 39 -4.233 -1.590 -3.185
281 1HH1 ARG 39 1HH1 ARG 39 -6.458 1.026 -2.567
282 2HH1 ARG 39 2HH1 ARG 39 -7.429 0.697 -3.962
283 1HH2 ARG 39 1HH2 ARG 39 -5.508 -2.025 -5.021
284 2HH2 ARG 39 2HH2 ARG 39 -6.890 -1.036 -5.357
285 H GLY 40 H GLY 40 -1.542 1.669 1.704
286 1HA GLY 40 2HA GLY 40 -2.742 2.694 3.790
287 2HA GLY 40 1HA GLY 40 -1.890 1.379 4.602
288 H CYS 41 H CYS 41 -1.272 3.735 5.565
289 HA CYS 41 HA CYS 41 0.891 4.993 4.145
290 1HB CYS 41 2HB CYS 41 -0.417 5.399 6.817
291 2HB CYS 41 1HB CYS 41 1.119 6.186 6.448
292 H GLY 42 H GLY 42 2.902 4.272 4.109
293 1HA GLY 42 2HA GLY 42 4.805 3.823 5.749
294 2HA GLY 42 1HA GLY 42 3.795 2.486 6.280
295 H CYS 43 H CYS 43 5.862 1.335 5.699
296 HA CYS 43 HA CYS 43 5.489 -0.056 3.257
297 1HB CYS 43 2HB CYS 43 6.569 2.089 2.462
298 2HB CYS 43 1HB CYS 43 8.004 1.613 3.362
299 HA PRO 44 HA PRO 44 7.806 -2.320 6.551
300 1HB PRO 44 2HB PRO 44 6.328 -4.580 6.432
301 2HB PRO 44 1HB PRO 44 5.826 -3.167 7.377
302 1HG PRO 44 2HG PRO 44 4.933 -4.041 4.654
303 2HG PRO 44 1HG PRO 44 3.963 -3.432 6.007
304 1HD PRO 44 2HD PRO 44 4.706 -1.880 3.903
305 2HD PRO 44 1HD PRO 44 4.464 -1.235 5.539
306 H SER 45 H SER 45 8.293 -4.933 6.303
307 HA SER 45 HA SER 45 9.091 -5.483 3.547
308 1HB SER 45 2HB SER 45 11.026 -5.469 5.876
309 2HB SER 45 1HB SER 45 11.394 -6.063 4.257
310 HG SER 45 HG SER 45 10.633 -3.411 4.932
311 H VAL 46 H VAL 46 8.101 -7.363 3.184
312 HA VAL 46 HA VAL 46 8.199 -9.429 5.276
313 HB VAL 46 HB VAL 46 6.357 -10.427 3.617
314 1HG1 VAL 46 1HG1 VAL 46 4.697 -9.699 5.156
315 2HG1 VAL 46 2HG1 VAL 46 5.653 -8.289 5.614
316 3HG1 VAL 46 3HG1 VAL 46 6.194 -9.906 6.065
317 1HG2 VAL 46 1HG2 VAL 46 6.105 -7.441 3.291
318 2HG2 VAL 46 2HG2 VAL 46 4.863 -8.614 2.851
319 3HG2 VAL 46 3HG2 VAL 46 6.419 -8.620 2.018
320 H LYS 47 H LYS 47 8.516 -11.635 4.604
321 HA LYS 47 HA LYS 47 9.888 -11.917 2.016
322 1HB LYS 47 2HB LYS 47 11.504 -13.446 3.117
323 2HB LYS 47 1HB LYS 47 11.608 -11.793 3.706
324 1HG LYS 47 2HG LYS 47 11.093 -12.386 5.791
325 2HG LYS 47 1HG LYS 47 9.779 -13.438 5.263
326 1HD LYS 47 2HD LYS 47 12.019 -14.812 4.455
327 2HD LYS 47 1HD LYS 47 12.537 -14.088 5.978
328 1HE LYS 47 2HE LYS 47 10.073 -15.777 5.563
329 2HE LYS 47 1HE LYS 47 11.570 -16.301 6.333
330 1HZ LYS 47 1HZ LYS 47 9.479 -15.350 7.671
331 2HZ LYS 47 2HZ LYS 47 10.349 -13.917 7.449
332 3HZ LYS 47 3HZ LYS 47 11.071 -15.231 8.230
333 H LYS 48 H LYS 48 7.815 -12.757 1.311
334 HA LYS 48 HA LYS 48 7.725 -15.556 1.269
335 1HB LYS 48 2HB LYS 48 6.652 -14.579 3.627
336 2HB LYS 48 1HB LYS 48 5.237 -14.834 2.617
337 1HG LYS 48 2HG LYS 48 5.299 -16.967 3.209
338 2HG LYS 48 1HG LYS 48 6.783 -17.123 2.270
339 1HD LYS 48 2HD LYS 48 7.725 -16.043 4.581
340 2HD LYS 48 1HD LYS 48 6.385 -17.023 5.179
341 1HE LYS 48 2HE LYS 48 8.103 -18.337 3.188
342 2HE LYS 48 1HE LYS 48 8.894 -17.954 4.717
343 1HZ LYS 48 1HZ LYS 48 8.019 -19.924 5.311
344 2HZ LYS 48 2HZ LYS 48 6.792 -19.875 4.147
345 3HZ LYS 48 3HZ LYS 48 6.620 -19.014 5.593
346 H GLY 49 H GLY 49 5.183 -16.164 0.653
347 1HA GLY 49 2HA GLY 49 4.841 -15.113 -1.919
348 2HA GLY 49 1HA GLY 49 3.623 -16.021 -1.025
349 H ILE 50 H ILE 50 3.137 -14.317 1.095
350 HA ILE 50 HA ILE 50 1.474 -12.352 -0.178
351 HB ILE 50 HB ILE 50 1.980 -12.821 2.765
352 1HG1 ILE 50 2HG1 ILE 50 -0.235 -13.820 0.957
353 2HG1 ILE 50 1HG1 ILE 50 1.060 -14.802 1.643
354 1HG2 ILE 50 1HG2 ILE 50 -0.477 -11.759 2.665
355 2HG2 ILE 50 2HG2 ILE 50 0.241 -10.957 1.268
356 3HG2 ILE 50 3HG2 ILE 50 0.984 -10.791 2.859
357 1HD1 ILE 50 1HD1 ILE 50 -0.160 -13.516 3.809
358 2HD1 ILE 50 2HD1 ILE 50 -0.259 -15.219 3.364
359 3HD1 ILE 50 3HD1 ILE 50 -1.467 -14.081 2.770
360 H GLY 51 H GLY 51 1.575 -10.096 0.062
361 1HA GLY 51 2HA GLY 51 2.676 -8.166 1.120
362 2HA GLY 51 1HA GLY 51 4.173 -9.074 1.031
363 H ILE 52 H ILE 52 4.882 -7.042 0.019
364 HA ILE 52 HA ILE 52 5.612 -7.234 -2.543
365 HB ILE 52 HB ILE 52 2.909 -6.985 -2.794
366 1HG1 ILE 52 2HG1 ILE 52 4.468 -5.726 -4.963
367 2HG1 ILE 52 1HG1 ILE 52 5.022 -7.318 -4.438
368 1HG2 ILE 52 1HG2 ILE 52 2.828 -4.708 -1.971
369 2HG2 ILE 52 2HG2 ILE 52 2.413 -4.771 -3.682
370 3HG2 ILE 52 3HG2 ILE 52 3.998 -4.207 -3.190
371 1HD1 ILE 52 1HD1 ILE 52 3.416 -7.319 -6.350
372 2HD1 ILE 52 2HD1 ILE 52 2.185 -6.726 -5.236
373 3HD1 ILE 52 3HD1 ILE 52 2.929 -8.303 -4.971
374 H ASN 53 H ASN 53 5.785 -4.825 -3.632
375 HA ASN 53 HA ASN 53 7.285 -3.342 -1.660
376 1HB ASN 53 2HB ASN 53 7.304 -3.633 -4.521
377 2HB ASN 53 1HB ASN 53 7.231 -1.919 -4.103
378 1HD2 ASN 53 1HD2 ASN 53 9.380 -2.064 -5.184
379 2HD2 ASN 53 2HD2 ASN 53 10.748 -2.411 -4.189
380 H CYS 54 H CYS 54 7.087 -0.768 -2.508
381 HA CYS 54 HA CYS 54 4.276 -0.007 -2.161
382 1HB CYS 54 2HB CYS 54 6.357 1.557 -0.693
383 2HB CYS 54 1HB CYS 54 4.649 1.327 -0.313
384 H CYS 55 H CYS 55 4.485 2.683 -2.073
385 HA CYS 55 HA CYS 55 6.164 3.522 -4.313
386 1HB CYS 55 2HB CYS 55 4.106 4.771 -5.228
387 2HB CYS 55 1HB CYS 55 4.220 3.038 -5.533
388 H THR 56 H THR 56 5.702 6.019 -4.673
389 HA THR 56 HA THR 56 5.203 7.376 -2.142
390 HB THR 56 HB THR 56 7.581 6.941 -2.037
391 HG1 THR 56 1HG THR 56 7.195 9.629 -2.845
392 1HG2 THR 56 1HG2 THR 56 9.118 7.283 -3.668
393 2HG2 THR 56 2HG2 THR 56 8.186 8.569 -4.435
394 3HG2 THR 56 3HG2 THR 56 7.724 6.884 -4.670
395 H THR 57 H THR 57 3.340 7.815 -3.689
396 HA THR 57 HA THR 57 3.685 10.465 -4.745
397 HB THR 57 HB THR 57 2.481 9.434 -6.954
398 HG1 THR 57 1HG THR 57 3.695 7.611 -7.558
399 1HG2 THR 57 1HG2 THR 57 4.260 10.178 -8.110
400 2HG2 THR 57 2HG2 THR 57 5.422 9.359 -7.067
401 3HG2 THR 57 3HG2 THR 57 4.689 10.876 -6.549
402 H ASP 58 H ASP 58 1.644 11.458 -5.361
403 HA ASP 58 HA ASP 58 -0.424 10.916 -3.581
404 1HB ASP 58 2HB ASP 58 -1.772 12.420 -5.142
405 2HB ASP 58 1HB ASP 58 -0.300 13.102 -4.466
406 H ARG 59 H ARG 59 -1.880 9.341 -3.542
407 HA ARG 59 HA ARG 59 -3.236 7.626 -4.175
408 1HB ARG 59 2HB ARG 59 -3.396 9.335 -6.659
409 2HB ARG 59 1HB ARG 59 -4.385 7.904 -6.407
410 1HG ARG 59 2HG ARG 59 -5.156 9.025 -4.248
411 2HG ARG 59 1HG ARG 59 -4.433 10.499 -4.905
412 1HD ARG 59 2HD ARG 59 -6.096 9.157 -6.863
413 2HD ARG 59 1HD ARG 59 -6.997 9.530 -5.388
414 HE ARG 59 HE ARG 59 -5.711 11.847 -5.924
415 1HH1 ARG 59 1HH1 ARG 59 -7.735 9.750 -7.844
416 2HH1 ARG 59 2HH1 ARG 59 -8.352 11.035 -8.826
417 1HH2 ARG 59 1HH2 ARG 59 -6.522 13.540 -7.217
418 2HH2 ARG 59 2HH2 ARG 59 -7.663 13.186 -8.471
419 H CYS 60 H CYS 60 -0.351 7.448 -4.676
420 HA CYS 60 HA CYS 60 0.220 6.229 -7.127
421 1HB CYS 60 2HB CYS 60 2.271 5.517 -6.110
422 2HB CYS 60 1HB CYS 60 1.885 7.119 -5.487
423 H ASN 61 H ASN 61 -1.505 5.053 -4.407
424 HA ASN 61 HA ASN 61 -1.318 2.305 -5.455
425 1HB ASN 61 2HB ASN 61 -2.063 1.612 -3.142
426 2HB ASN 61 1HB ASN 61 -0.449 2.322 -3.231
427 1HD2 ASN 61 1HD2 ASN 61 -3.076 2.221 -1.395
428 2HD2 ASN 61 2HD2 ASN 61 -3.026 3.798 -0.670
429 H ASN 62 H ASN 62 -2.989 3.487 -6.939
430 HA ASN 62 HA ASN 62 -5.645 3.681 -5.805
431 1HB ASN 62 2HB ASN 62 -4.667 5.154 -7.683
432 2HB ASN 62 1HB ASN 62 -4.988 3.779 -8.744
433 1HD2 ASN 62 1HD2 ASN 62 -6.251 5.829 -9.554
434 2HD2 ASN 62 2HD2 ASN 62 -7.923 5.859 -9.080
Start of MODEL 12
1 1H LEU 1 1HT LEU 1 1.496 15.340 0.593
2 2H LEU 1 2HT LEU 1 0.353 15.015 1.831
3 3H LEU 1 3HT LEU 1 -0.178 15.541 0.286
4 HA LEU 1 HA LEU 1 0.434 13.567 -0.721
5 1HB LEU 1 2HB LEU 1 2.315 13.539 1.396
6 2HB LEU 1 1HB LEU 1 1.381 12.061 1.534
7 HG LEU 1 HG LEU 1 1.912 11.585 -0.869
8 1HD1 LEU 1 1HD1 LEU 1 4.187 13.456 -0.792
9 2HD1 LEU 1 2HD1 LEU 1 2.599 14.177 -1.054
10 3HD1 LEU 1 3HD1 LEU 1 3.191 12.928 -2.149
11 1HD2 LEU 1 1HD2 LEU 1 3.189 10.729 1.170
12 2HD2 LEU 1 2HD2 LEU 1 4.421 11.917 0.746
13 3HD2 LEU 1 3HD2 LEU 1 4.001 10.637 -0.393
14 H GLU 2 H GLU 2 -0.905 11.741 -0.729
15 HA GLU 2 HA GLU 2 -2.481 11.040 1.569
16 1HB GLU 2 2HB GLU 2 -3.461 13.120 0.022
17 2HB GLU 2 1HB GLU 2 -4.318 11.716 -0.598
18 1HG GLU 2 2HG GLU 2 -5.058 11.174 1.674
19 2HG GLU 2 1HG GLU 2 -4.222 12.611 2.275
20 H CYS 3 H CYS 3 -2.761 8.915 1.479
21 HA CYS 3 HA CYS 3 -2.855 7.624 -1.169
22 1HB CYS 3 2HB CYS 3 -1.291 7.020 1.243
23 2HB CYS 3 1HB CYS 3 -2.103 5.622 0.536
24 H HIS 4 H HIS 4 -4.018 5.523 -1.194
25 HA HIS 4 HA HIS 4 -6.589 5.832 0.044
26 1HB HIS 4 2HB HIS 4 -5.457 3.696 -1.774
27 2HB HIS 4 1HB HIS 4 -7.140 3.788 -1.260
28 HD1 HIS 4 1HD HIS 4 -8.584 5.714 -2.265
29 HD2 HIS 4 2HD HIS 4 -4.728 5.461 -3.792
30 HE1 HIS 4 1HE HIS 4 -8.581 7.157 -4.324
31 HE2 HIS 4 2HE HIS 4 -6.256 6.938 -5.267
32 H ASN 5 H ASN 5 -6.946 5.191 2.064
33 HA ASN 5 HA ASN 5 -5.275 3.324 3.424
34 1HB ASN 5 2HB ASN 5 -7.034 3.536 5.240
35 2HB ASN 5 1HB ASN 5 -6.275 5.045 4.741
36 1HD2 ASN 5 1HD2 ASN 5 -8.399 5.486 6.005
37 2HD2 ASN 5 2HD2 ASN 5 -9.753 5.832 4.987
38 H GLN 6 H GLN 6 -8.397 3.153 1.834
39 HA GLN 6 HA GLN 6 -9.159 0.608 2.806
40 1HB GLN 6 2HB GLN 6 -10.395 2.543 1.349
41 2HB GLN 6 1HB GLN 6 -10.064 1.347 0.095
42 1HG GLN 6 2HG GLN 6 -12.096 0.612 0.773
43 2HG GLN 6 1HG GLN 6 -11.087 -0.290 1.902
44 1HE2 GLN 6 1HE2 GLN 6 -11.729 -0.226 3.921
45 2HE2 GLN 6 2HE2 GLN 6 -12.633 1.042 4.669
46 H GLN 7 H GLN 7 -9.724 -0.981 0.683
47 HA GLN 7 HA GLN 7 -7.122 -1.511 -0.581
48 1HB GLN 7 2HB GLN 7 -7.339 -3.872 -0.162
49 2HB GLN 7 1HB GLN 7 -7.492 -3.012 1.369
50 1HG GLN 7 2HG GLN 7 -10.077 -3.352 0.194
51 2HG GLN 7 1HG GLN 7 -9.236 -4.901 0.244
52 1HE2 GLN 7 1HE2 GLN 7 -9.593 -2.058 2.347
53 2HE2 GLN 7 2HE2 GLN 7 -9.926 -2.953 3.786
54 H SER 8 H SER 8 -7.728 -3.676 -2.089
55 HA SER 8 HA SER 8 -8.921 -2.631 -4.350
56 1HB SER 8 2HB SER 8 -8.918 -4.873 -5.247
57 2HB SER 8 1HB SER 8 -7.472 -4.673 -4.257
58 HG SER 8 HG SER 8 -8.422 -6.622 -3.730
59 H SER 9 H SER 9 -10.928 -1.909 -4.567
60 HA SER 9 HA SER 9 -13.158 -3.662 -4.036
61 1HB SER 9 2HB SER 9 -14.351 -1.881 -2.676
62 2HB SER 9 1HB SER 9 -13.034 -2.711 -1.850
63 HG SER 9 HG SER 9 -12.668 -0.259 -3.214
64 H GLN 10 H GLN 10 -15.280 -2.169 -4.411
65 HA GLN 10 HA GLN 10 -15.168 -1.446 -7.140
66 1HB GLN 10 2HB GLN 10 -17.214 -1.459 -5.002
67 2HB GLN 10 1HB GLN 10 -17.502 -0.341 -6.335
68 1HG GLN 10 2HG GLN 10 -16.703 -2.932 -7.314
69 2HG GLN 10 1HG GLN 10 -18.100 -3.058 -6.245
70 1HE2 GLN 10 1HE2 GLN 10 -19.539 -3.567 -7.851
71 2HE2 GLN 10 2HE2 GLN 10 -20.037 -2.435 -9.070
72 H THR 11 H THR 11 -14.826 0.373 -4.192
73 HA THR 11 HA THR 11 -13.764 2.602 -5.537
74 HB THR 11 HB THR 11 -16.049 3.658 -4.076
75 HG1 THR 11 1HG THR 11 -17.636 2.755 -5.121
76 1HG2 THR 11 1HG2 THR 11 -14.440 4.647 -5.962
77 2HG2 THR 11 2HG2 THR 11 -16.071 5.248 -5.665
78 3HG2 THR 11 3HG2 THR 11 -15.778 4.103 -6.974
79 HA PRO 12 HA PRO 12 -12.283 2.159 -1.234
80 1HB PRO 12 2HB PRO 12 -9.810 3.171 -1.734
81 2HB PRO 12 1HB PRO 12 -10.239 1.483 -2.033
82 1HG PRO 12 2HG PRO 12 -10.091 3.771 -3.960
83 2HG PRO 12 1HG PRO 12 -9.515 2.100 -4.156
84 1HD PRO 12 2HD PRO 12 -11.842 2.966 -5.229
85 2HD PRO 12 1HD PRO 12 -11.623 1.299 -4.650
86 H THR 13 H THR 13 -10.692 3.963 -0.094
87 HA THR 13 HA THR 13 -12.016 6.558 -0.544
88 HB THR 13 HB THR 13 -11.440 6.776 2.040
89 HG1 THR 13 1HG THR 13 -11.857 3.993 1.705
90 1HG2 THR 13 1HG2 THR 13 -13.766 6.377 0.649
91 2HG2 THR 13 2HG2 THR 13 -13.636 6.730 2.373
92 3HG2 THR 13 3HG2 THR 13 -13.773 5.060 1.822
93 H THR 14 H THR 14 -10.665 8.252 0.937
94 HA THR 14 HA THR 14 -7.807 7.855 0.402
95 HB THR 14 HB THR 14 -7.821 10.355 -0.294
96 HG1 THR 14 1HG THR 14 -9.684 11.223 -0.733
97 1HG2 THR 14 1HG2 THR 14 -9.179 8.880 -2.437
98 2HG2 THR 14 2HG2 THR 14 -7.732 8.114 -1.780
99 3HG2 THR 14 3HG2 THR 14 -7.643 9.747 -2.442
100 H THR 15 H THR 15 -6.458 8.685 1.918
101 HA THR 15 HA THR 15 -7.300 10.702 3.782
102 HB THR 15 HB THR 15 -8.366 8.709 4.756
103 HG1 THR 15 1HG THR 15 -7.714 10.147 6.272
104 1HG2 THR 15 1HG2 THR 15 -6.992 6.938 5.742
105 2HG2 THR 15 2HG2 THR 15 -5.574 7.605 4.932
106 3HG2 THR 15 3HG2 THR 15 -6.907 6.952 3.981
107 H GLY 16 H GLY 16 -5.571 11.840 4.424
108 1HA GLY 16 2HA GLY 16 -2.983 11.040 3.540
109 2HA GLY 16 1HA GLY 16 -3.384 12.544 4.340
110 H CYS 17 H CYS 17 -1.130 10.716 4.787
111 HA CYS 17 HA CYS 17 -1.671 9.600 7.423
112 1HB CYS 17 2HB CYS 17 0.937 9.599 5.891
113 2HB CYS 17 1HB CYS 17 0.511 8.588 7.274
114 H SER 18 H SER 18 0.589 9.909 8.814
115 HA SER 18 HA SER 18 0.466 12.681 9.598
116 1HB SER 18 2HB SER 18 0.811 10.407 11.017
117 2HB SER 18 1HB SER 18 2.493 10.906 10.835
118 HG SER 18 HG SER 18 1.736 13.015 11.622
119 H GLY 19 H GLY 19 2.109 14.191 9.514
120 1HA GLY 19 2HA GLY 19 3.780 14.227 7.320
121 2HA GLY 19 1HA GLY 19 3.986 15.242 8.735
122 H GLY 20 H GLY 20 4.954 12.272 7.168
123 1HA GLY 20 2HA GLY 20 7.559 12.327 8.054
124 2HA GLY 20 1HA GLY 20 6.660 11.337 9.197
125 H GLU 21 H GLU 21 4.822 10.288 7.237
126 HA GLU 21 HA GLU 21 6.633 8.361 5.961
127 1HB GLU 21 2HB GLU 21 4.555 7.858 7.593
128 2HB GLU 21 1HB GLU 21 3.709 7.854 6.044
129 1HG GLU 21 2HG GLU 21 4.378 5.779 5.700
130 2HG GLU 21 1HG GLU 21 6.055 6.322 5.711
131 H ASN 22 H ASN 22 7.099 8.914 3.930
132 HA ASN 22 HA ASN 22 4.957 10.016 2.241
133 1HB ASN 22 2HB ASN 22 7.915 10.378 2.303
134 2HB ASN 22 1HB ASN 22 7.111 10.466 0.739
135 1HD2 ASN 22 1HD2 ASN 22 6.171 11.530 3.986
136 2HD2 ASN 22 2HD2 ASN 22 5.905 13.182 3.554
137 H ASN 23 H ASN 23 5.309 7.180 2.879
138 HA ASN 23 HA ASN 23 5.518 6.195 0.127
139 1HB ASN 23 2HB ASN 23 6.978 5.128 2.533
140 2HB ASN 23 1HB ASN 23 6.604 4.087 1.157
141 1HD2 ASN 23 1HD2 ASN 23 8.550 6.657 2.362
142 2HD2 ASN 23 2HD2 ASN 23 9.605 6.790 0.990
143 H CYS 24 H CYS 24 4.229 4.392 -0.344
144 HA CYS 24 HA CYS 24 2.372 3.563 1.779
145 1HB CYS 24 2HB CYS 24 1.514 3.996 -1.080
146 2HB CYS 24 1HB CYS 24 0.493 3.724 0.334
147 H TYR 25 H TYR 25 2.527 1.449 2.091
148 HA TYR 25 HA TYR 25 3.753 -0.236 0.158
149 1HB TYR 25 2HB TYR 25 3.806 -1.893 1.854
150 2HB TYR 25 1HB TYR 25 4.164 -0.360 2.641
151 HD1 TYR 25 1HD TYR 25 1.756 -3.114 2.341
152 HD2 TYR 25 2HD TYR 25 2.534 0.676 4.136
153 HE1 TYR 25 1HE TYR 25 -0.062 -3.497 3.948
154 HE2 TYR 25 2HE TYR 25 0.717 0.292 5.743
155 HH TYR 25 HH TYR 25 -0.430 -2.046 6.703
156 H LYS 26 H LYS 26 2.897 -2.036 -0.825
157 HA LYS 26 HA LYS 26 -0.039 -2.266 -0.792
158 1HB LYS 26 2HB LYS 26 0.941 -1.308 -2.930
159 2HB LYS 26 1HB LYS 26 1.746 -2.859 -3.164
160 1HG LYS 26 2HG LYS 26 -0.386 -3.987 -3.296
161 2HG LYS 26 1HG LYS 26 -1.234 -2.482 -2.940
162 1HD LYS 26 2HD LYS 26 0.372 -1.830 -5.095
163 2HD LYS 26 1HD LYS 26 -0.169 -3.470 -5.459
164 1HE LYS 26 2HE LYS 26 -1.970 -1.165 -4.725
165 2HE LYS 26 1HE LYS 26 -1.679 -1.743 -6.365
166 1HZ LYS 26 1HZ LYS 26 -3.696 -2.577 -4.847
167 2HZ LYS 26 2HZ LYS 26 -2.543 -3.751 -4.454
168 3HZ LYS 26 3HZ LYS 26 -3.000 -3.521 -6.067
169 H LYS 27 H LYS 27 -0.838 -4.381 -0.611
170 HA LYS 27 HA LYS 27 1.092 -6.554 -0.691
171 1HB LYS 27 2HB LYS 27 -0.055 -7.258 1.547
172 2HB LYS 27 1HB LYS 27 1.286 -6.137 1.569
173 1HG LYS 27 2HG LYS 27 -0.089 -4.334 2.051
174 2HG LYS 27 1HG LYS 27 -1.536 -5.156 1.458
175 1HD LYS 27 2HD LYS 27 -1.547 -5.015 3.895
176 2HD LYS 27 1HD LYS 27 -1.443 -6.693 3.358
177 1HE LYS 27 2HE LYS 27 0.608 -6.979 4.241
178 2HE LYS 27 1HE LYS 27 1.144 -5.365 3.773
179 1HZ LYS 27 1HZ LYS 27 1.046 -5.021 5.979
180 2HZ LYS 27 2HZ LYS 27 -0.061 -6.271 6.253
181 3HZ LYS 27 3HZ LYS 27 -0.602 -4.772 5.689
182 H GLU 28 H GLU 28 0.228 -8.285 -1.700
183 HA GLU 28 HA GLU 28 -2.703 -8.510 -1.780
184 1HB GLU 28 2HB GLU 28 -2.124 -9.941 -3.875
185 2HB GLU 28 1HB GLU 28 -2.133 -8.185 -4.000
186 1HG GLU 28 2HG GLU 28 0.111 -8.068 -4.296
187 2HG GLU 28 1HG GLU 28 0.429 -9.485 -3.295
188 H TRP 29 H TRP 29 -3.623 -10.376 -1.106
189 HA TRP 29 HA TRP 29 -1.949 -12.739 -0.749
190 1HB TRP 29 2HB TRP 29 -2.455 -13.061 1.530
191 2HB TRP 29 1HB TRP 29 -2.024 -11.360 1.409
192 HD1 TRP 29 HD TRP 29 -4.514 -13.516 2.877
193 HE1 TRP 29 1HE TRP 29 -6.618 -12.212 3.589
194 HE3 TRP 29 3HE TRP 29 -3.635 -9.156 0.370
195 HZ2 TRP 29 2HZ TRP 29 -7.750 -9.665 3.141
196 HZ3 TRP 29 3HZ TRP 29 -5.276 -7.335 0.563
197 HH2 TRP 29 HH TRP 29 -7.289 -7.584 1.921
198 H ARG 30 H ARG 30 -3.023 -14.666 -0.949
199 HA ARG 30 HA ARG 30 -5.782 -14.472 -1.892
200 1HB ARG 30 2HB ARG 30 -5.251 -16.915 -2.593
201 2HB ARG 30 1HB ARG 30 -4.552 -15.587 -3.513
202 1HG ARG 30 2HG ARG 30 -2.436 -15.874 -2.439
203 2HG ARG 30 1HG ARG 30 -3.114 -17.048 -1.309
204 1HD ARG 30 2HD ARG 30 -3.225 -18.712 -2.891
205 2HD ARG 30 1HD ARG 30 -3.329 -17.573 -4.233
206 HE ARG 30 HE ARG 30 -0.821 -17.240 -3.121
207 1HH1 ARG 30 1HH1 ARG 30 -2.611 -19.812 -4.657
208 2HH1 ARG 30 2HH1 ARG 30 -1.199 -20.581 -5.299
209 1HH2 ARG 30 1HH2 ARG 30 1.038 -18.249 -3.965
210 2HH2 ARG 30 2HH2 ARG 30 0.873 -19.694 -4.906
211 H ASP 31 H ASP 31 -7.143 -16.479 -1.405
212 HA ASP 31 HA ASP 31 -6.641 -17.611 1.233
213 1HB ASP 31 2HB ASP 31 -9.029 -17.045 1.902
214 2HB ASP 31 1HB ASP 31 -7.889 -15.696 1.882
215 H ASN 32 H ASN 32 -6.322 -19.252 -0.642
216 HA ASN 32 HA ASN 32 -6.967 -21.227 -1.556
217 1HB ASN 32 2HB ASN 32 -7.944 -21.697 0.639
218 2HB ASN 32 1HB ASN 32 -9.421 -20.859 0.179
219 1HD2 ASN 32 1HD2 ASN 32 -10.979 -22.255 -0.157
220 2HD2 ASN 32 2HD2 ASN 32 -10.836 -23.770 -0.976
221 H ARG 33 H ARG 33 -10.207 -19.798 -1.234
222 HA ARG 33 HA ARG 33 -10.844 -20.383 -3.935
223 1HB ARG 33 2HB ARG 33 -12.828 -18.731 -3.340
224 2HB ARG 33 1HB ARG 33 -12.773 -20.379 -2.720
225 1HG ARG 33 2HG ARG 33 -11.430 -18.392 -1.041
226 2HG ARG 33 1HG ARG 33 -13.169 -18.157 -1.216
227 1HD ARG 33 2HD ARG 33 -13.119 -20.802 -0.775
228 2HD ARG 33 1HD ARG 33 -11.663 -20.335 0.105
229 HE ARG 33 HE ARG 33 -12.980 -19.335 1.691
230 1HH1 ARG 33 1HH1 ARG 33 -14.912 -19.981 -1.144
231 2HH1 ARG 33 2HH1 ARG 33 -16.405 -19.563 -0.374
232 1HH2 ARG 33 1HH2 ARG 33 -14.945 -18.784 2.704
233 2HH2 ARG 33 2HH2 ARG 33 -16.425 -18.883 1.809
234 H GLY 34 H GLY 34 -11.267 -17.136 -2.568
235 1HA GLY 34 2HA GLY 34 -10.196 -16.058 -5.082
236 2HA GLY 34 1HA GLY 34 -11.251 -15.201 -3.969
237 H TYR 35 H TYR 35 -9.531 -13.533 -4.402
238 HA TYR 35 HA TYR 35 -7.636 -13.604 -2.202
239 1HB TYR 35 2HB TYR 35 -5.807 -12.759 -3.785
240 2HB TYR 35 1HB TYR 35 -6.181 -14.478 -3.835
241 HD1 TYR 35 1HD TYR 35 -6.641 -15.492 -5.874
242 HD2 TYR 35 2HD TYR 35 -7.010 -11.266 -5.541
243 HE1 TYR 35 1HE TYR 35 -7.027 -15.341 -8.297
244 HE2 TYR 35 2HE TYR 35 -7.398 -11.104 -7.964
245 HH TYR 35 HH TYR 35 -8.390 -13.220 -9.815
246 H ARG 36 H ARG 36 -6.465 -11.441 -2.040
247 HA ARG 36 HA ARG 36 -7.863 -9.193 -3.223
248 1HB ARG 36 2HB ARG 36 -8.190 -10.023 -0.386
249 2HB ARG 36 1HB ARG 36 -7.995 -8.298 -0.702
250 1HG ARG 36 2HG ARG 36 -10.062 -8.101 -1.512
251 2HG ARG 36 1HG ARG 36 -9.926 -9.576 -2.471
252 1HD ARG 36 2HD ARG 36 -10.035 -10.519 0.114
253 2HD ARG 36 1HD ARG 36 -11.137 -9.144 0.147
254 HE ARG 36 HE ARG 36 -11.617 -11.654 -1.055
255 1HH1 ARG 36 1HH1 ARG 36 -12.143 -8.242 -1.568
256 2HH1 ARG 36 2HH1 ARG 36 -13.565 -8.479 -2.528
257 1HH2 ARG 36 1HH2 ARG 36 -13.485 -11.967 -2.318
258 2HH2 ARG 36 2HH2 ARG 36 -14.327 -10.593 -2.954
259 H THR 37 H THR 37 -6.932 -7.090 -2.015
260 HA THR 37 HA THR 37 -4.183 -7.363 -1.193
261 HB THR 37 HB THR 37 -3.982 -7.512 -3.645
262 HG1 THR 37 1HG THR 37 -2.438 -5.909 -3.833
263 1HG2 THR 37 1HG2 THR 37 -5.012 -4.698 -3.794
264 2HG2 THR 37 2HG2 THR 37 -6.007 -6.110 -4.154
265 3HG2 THR 37 3HG2 THR 37 -4.568 -5.774 -5.119
266 H GLU 38 H GLU 38 -3.875 -5.893 0.341
267 HA GLU 38 HA GLU 38 -5.527 -3.467 0.308
268 1HB GLU 38 2HB GLU 38 -4.661 -3.438 2.795
269 2HB GLU 38 1HB GLU 38 -6.037 -4.424 2.332
270 1HG GLU 38 2HG GLU 38 -4.886 -6.380 2.567
271 2HG GLU 38 1HG GLU 38 -3.326 -5.634 2.226
272 H ARG 39 H ARG 39 -4.413 -1.590 1.513
273 HA ARG 39 HA ARG 39 -1.539 -1.493 1.035
274 1HB ARG 39 2HB ARG 39 -3.386 0.600 -0.117
275 2HB ARG 39 1HB ARG 39 -1.639 0.509 -0.299
276 1HG ARG 39 2HG ARG 39 -2.259 -0.362 -2.297
277 2HG ARG 39 1HG ARG 39 -2.239 -1.845 -1.346
278 1HD ARG 39 2HD ARG 39 -4.262 -1.820 -2.609
279 2HD ARG 39 1HD ARG 39 -4.677 -1.518 -0.923
280 HE ARG 39 HE ARG 39 -4.419 0.970 -1.963
281 1HH1 ARG 39 1HH1 ARG 39 -6.259 -1.844 -2.897
282 2HH1 ARG 39 2HH1 ARG 39 -7.540 -0.924 -3.612
283 1HH2 ARG 39 1HH2 ARG 39 -6.103 2.183 -2.903
284 2HH2 ARG 39 2HH2 ARG 39 -7.451 1.362 -3.616
285 H GLY 40 H GLY 40 -0.736 0.816 1.693
286 1HA GLY 40 2HA GLY 40 -2.115 2.417 3.499
287 2HA GLY 40 1HA GLY 40 -1.361 1.130 4.440
288 H CYS 41 H CYS 41 -0.445 3.380 5.230
289 HA CYS 41 HA CYS 41 1.711 4.410 3.623
290 1HB CYS 41 2HB CYS 41 0.296 5.201 6.024
291 2HB CYS 41 1HB CYS 41 2.042 5.349 6.244
292 H GLY 42 H GLY 42 3.898 4.147 3.933
293 1HA GLY 42 2HA GLY 42 5.776 3.402 5.257
294 2HA GLY 42 1HA GLY 42 4.728 2.185 5.970
295 H CYS 43 H CYS 43 6.769 0.946 5.293
296 HA CYS 43 HA CYS 43 6.117 -0.795 3.210
297 1HB CYS 43 2HB CYS 43 6.739 1.169 1.795
298 2HB CYS 43 1HB CYS 43 8.361 1.096 2.473
299 HA PRO 44 HA PRO 44 9.405 -2.029 6.311
300 1HB PRO 44 2HB PRO 44 8.074 -4.208 7.252
301 2HB PRO 44 1HB PRO 44 7.874 -2.584 7.929
302 1HG PRO 44 2HG PRO 44 6.143 -4.051 5.973
303 2HG PRO 44 1HG PRO 44 5.668 -3.070 7.373
304 1HD PRO 44 2HD PRO 44 5.579 -2.120 4.844
305 2HD PRO 44 1HD PRO 44 5.954 -1.082 6.236
306 H SER 45 H SER 45 10.325 -4.345 6.555
307 HA SER 45 HA SER 45 11.017 -5.262 3.946
308 1HB SER 45 2HB SER 45 11.654 -6.992 6.263
309 2HB SER 45 1HB SER 45 12.704 -6.390 4.980
310 HG SER 45 HG SER 45 13.311 -4.883 6.294
311 H VAL 46 H VAL 46 9.144 -6.009 2.948
312 HA VAL 46 HA VAL 46 7.507 -8.029 4.169
313 HB VAL 46 HB VAL 46 6.462 -8.110 1.858
314 1HG1 VAL 46 1HG1 VAL 46 6.549 -5.589 3.486
315 2HG1 VAL 46 2HG1 VAL 46 5.347 -6.878 3.528
316 3HG1 VAL 46 3HG1 VAL 46 5.442 -5.807 2.130
317 1HG2 VAL 46 1HG2 VAL 46 7.968 -5.576 1.337
318 2HG2 VAL 46 2HG2 VAL 46 7.042 -6.570 0.211
319 3HG2 VAL 46 3HG2 VAL 46 8.600 -7.137 0.813
320 H LYS 47 H LYS 47 6.942 -9.935 2.529
321 HA LYS 47 HA LYS 47 9.504 -11.206 1.816
322 1HB LYS 47 2HB LYS 47 8.202 -13.379 2.228
323 2HB LYS 47 1HB LYS 47 8.687 -12.443 3.634
324 1HG LYS 47 2HG LYS 47 6.436 -11.495 3.778
325 2HG LYS 47 1HG LYS 47 5.951 -12.451 2.376
326 1HD LYS 47 2HD LYS 47 6.891 -14.431 3.862
327 2HD LYS 47 1HD LYS 47 6.508 -13.310 5.169
328 1HE LYS 47 2HE LYS 47 4.358 -13.842 5.025
329 2HE LYS 47 1HE LYS 47 4.329 -13.352 3.332
330 1HZ LYS 47 1HZ LYS 47 3.825 -15.506 3.026
331 2HZ LYS 47 2HZ LYS 47 4.511 -16.006 4.489
332 3HZ LYS 47 3HZ LYS 47 5.498 -15.735 3.143
333 H LYS 48 H LYS 48 8.828 -13.296 0.365
334 HA LYS 48 HA LYS 48 7.634 -12.100 -2.011
335 1HB LYS 48 2HB LYS 48 9.861 -13.610 -1.716
336 2HB LYS 48 1HB LYS 48 8.693 -14.858 -2.133
337 1HG LYS 48 2HG LYS 48 8.540 -12.504 -3.849
338 2HG LYS 48 1HG LYS 48 10.100 -13.326 -3.908
339 1HD LYS 48 2HD LYS 48 9.156 -15.319 -4.667
340 2HD LYS 48 1HD LYS 48 7.540 -14.870 -4.123
341 1HE LYS 48 2HE LYS 48 7.213 -14.394 -6.299
342 2HE LYS 48 1HE LYS 48 8.031 -12.887 -5.887
343 1HZ LYS 48 1HZ LYS 48 9.455 -15.288 -6.886
344 2HZ LYS 48 2HZ LYS 48 10.068 -13.720 -6.723
345 3HZ LYS 48 3HZ LYS 48 8.898 -14.052 -7.898
346 H GLY 49 H GLY 49 5.702 -12.532 -0.167
347 1HA GLY 49 2HA GLY 49 4.050 -14.495 -1.523
348 2HA GLY 49 1HA GLY 49 4.378 -14.841 0.176
349 H ILE 50 H ILE 50 3.070 -13.971 1.655
350 HA ILE 50 HA ILE 50 0.732 -12.621 0.973
351 HB ILE 50 HB ILE 50 2.080 -12.611 3.661
352 1HG1 ILE 50 2HG1 ILE 50 1.924 -14.883 3.048
353 2HG1 ILE 50 1HG1 ILE 50 0.489 -14.575 4.016
354 1HG2 ILE 50 1HG2 ILE 50 0.309 -11.042 3.676
355 2HG2 ILE 50 2HG2 ILE 50 -0.327 -12.502 4.434
356 3HG2 ILE 50 3HG2 ILE 50 -0.750 -12.119 2.764
357 1HD1 ILE 50 1HD1 ILE 50 0.731 -15.266 1.175
358 2HD1 ILE 50 2HD1 ILE 50 -0.503 -14.072 1.582
359 3HD1 ILE 50 3HD1 ILE 50 -0.530 -15.664 2.342
360 H GLY 51 H GLY 51 1.338 -10.823 -0.342
361 1HA GLY 51 2HA GLY 51 1.178 -8.342 0.499
362 2HA GLY 51 1HA GLY 51 2.831 -8.675 0.975
363 H ILE 52 H ILE 52 3.389 -6.924 -0.419
364 HA ILE 52 HA ILE 52 4.347 -7.783 -2.910
365 HB ILE 52 HB ILE 52 1.777 -7.379 -3.287
366 1HG1 ILE 52 2HG1 ILE 52 2.968 -6.145 -5.562
367 2HG1 ILE 52 1HG1 ILE 52 4.111 -7.326 -4.919
368 1HG2 ILE 52 1HG2 ILE 52 2.729 -4.677 -2.863
369 2HG2 ILE 52 2HG2 ILE 52 1.086 -5.296 -2.982
370 3HG2 ILE 52 3HG2 ILE 52 1.978 -4.878 -4.443
371 1HD1 ILE 52 1HD1 ILE 52 2.799 -8.445 -6.521
372 2HD1 ILE 52 2HD1 ILE 52 1.300 -7.794 -5.859
373 3HD1 ILE 52 3HD1 ILE 52 2.223 -8.986 -4.945
374 H ASN 53 H ASN 53 4.499 -5.349 -4.256
375 HA ASN 53 HA ASN 53 6.590 -4.105 -2.734
376 1HB ASN 53 2HB ASN 53 6.962 -2.753 -4.757
377 2HB ASN 53 1HB ASN 53 6.865 -4.476 -5.132
378 1HD2 ASN 53 1HD2 ASN 53 6.255 -1.831 -6.569
379 2HD2 ASN 53 2HD2 ASN 53 4.716 -2.124 -7.297
380 H CYS 54 H CYS 54 6.666 -1.544 -3.195
381 HA CYS 54 HA CYS 54 4.130 -0.406 -2.223
382 1HB CYS 54 2HB CYS 54 6.796 0.650 -1.319
383 2HB CYS 54 1HB CYS 54 5.212 0.865 -0.574
384 H CYS 55 H CYS 55 4.768 2.224 -2.138
385 HA CYS 55 HA CYS 55 6.083 3.038 -4.576
386 1HB CYS 55 2HB CYS 55 4.032 4.294 -5.375
387 2HB CYS 55 1HB CYS 55 3.987 2.541 -5.576
388 H THR 56 H THR 56 5.673 5.535 -4.863
389 HA THR 56 HA THR 56 5.357 6.888 -2.303
390 HB THR 56 HB THR 56 7.727 6.313 -2.335
391 HG1 THR 56 1HG THR 56 8.483 8.353 -1.971
392 1HG2 THR 56 1HG2 THR 56 7.793 6.356 -4.940
393 2HG2 THR 56 2HG2 THR 56 9.221 6.784 -3.999
394 3HG2 THR 56 3HG2 THR 56 8.214 8.052 -4.698
395 H THR 57 H THR 57 3.459 7.434 -3.765
396 HA THR 57 HA THR 57 3.889 10.070 -4.816
397 HB THR 57 HB THR 57 2.538 9.087 -6.977
398 HG1 THR 57 1HG THR 57 4.575 7.215 -6.365
399 1HG2 THR 57 1HG2 THR 57 5.076 8.943 -7.902
400 2HG2 THR 57 2HG2 THR 57 5.284 9.951 -6.470
401 3HG2 THR 57 3HG2 THR 57 4.149 10.433 -7.731
402 H ASP 58 H ASP 58 1.861 11.144 -5.393
403 HA ASP 58 HA ASP 58 -0.145 10.747 -3.517
404 1HB ASP 58 2HB ASP 58 -1.509 12.234 -5.084
405 2HB ASP 58 1HB ASP 58 0.011 12.890 -4.494
406 H ARG 59 H ARG 59 -1.625 9.210 -3.341
407 HA ARG 59 HA ARG 59 -3.058 7.513 -3.832
408 1HB ARG 59 2HB ARG 59 -3.375 8.925 -6.485
409 2HB ARG 59 1HB ARG 59 -4.510 7.803 -5.746
410 1HG ARG 59 2HG ARG 59 -5.053 9.352 -4.028
411 2HG ARG 59 1HG ARG 59 -3.733 10.430 -4.503
412 1HD ARG 59 2HD ARG 59 -4.896 10.629 -6.748
413 2HD ARG 59 1HD ARG 59 -6.282 9.836 -5.991
414 HE ARG 59 HE ARG 59 -5.762 11.886 -4.311
415 1HH1 ARG 59 1HH1 ARG 59 -6.231 11.711 -7.765
416 2HH1 ARG 59 2HH1 ARG 59 -6.899 13.304 -7.881
417 1HH2 ARG 59 1HH2 ARG 59 -6.639 13.983 -4.462
418 2HH2 ARG 59 2HH2 ARG 59 -7.129 14.595 -6.006
419 H CYS 60 H CYS 60 -0.212 7.262 -4.560
420 HA CYS 60 HA CYS 60 0.138 5.959 -7.005
421 1HB CYS 60 2HB CYS 60 2.235 5.198 -6.115
422 2HB CYS 60 1HB CYS 60 1.951 6.836 -5.533
423 H ASN 61 H ASN 61 -1.292 4.880 -4.055
424 HA ASN 61 HA ASN 61 -1.288 2.109 -5.044
425 1HB ASN 61 2HB ASN 61 -1.708 1.412 -2.743
426 2HB ASN 61 1HB ASN 61 -0.257 2.412 -2.824
427 1HD2 ASN 61 1HD2 ASN 61 -0.947 2.356 -0.442
428 2HD2 ASN 61 2HD2 ASN 61 -1.926 3.690 0.082
429 H ASN 62 H ASN 62 -3.027 3.280 -6.462
430 HA ASN 62 HA ASN 62 -5.591 3.633 -5.198
431 1HB ASN 62 2HB ASN 62 -4.456 4.561 -7.530
432 2HB ASN 62 1HB ASN 62 -5.589 3.338 -8.116
433 1HD2 ASN 62 1HD2 ASN 62 -7.773 3.468 -6.875
434 2HD2 ASN 62 2HD2 ASN 62 -8.458 5.063 -6.784
Start of MODEL 13
1 1H LEU 1 1HT LEU 1 2.005 14.779 1.150
2 2H LEU 1 2HT LEU 1 1.645 13.688 2.425
3 3H LEU 1 3HT LEU 1 0.409 14.684 1.771
4 HA LEU 1 HA LEU 1 0.872 13.562 -0.398
5 1HB LEU 1 2HB LEU 1 3.037 12.629 0.554
6 2HB LEU 1 1HB LEU 1 2.047 11.493 1.451
7 HG LEU 1 HG LEU 1 1.083 10.861 -0.879
8 1HD1 LEU 1 1HD1 LEU 1 1.896 12.264 -2.455
9 2HD1 LEU 1 2HD1 LEU 1 3.217 11.097 -2.473
10 3HD1 LEU 1 3HD1 LEU 1 3.376 12.596 -1.556
11 1HD2 LEU 1 1HD2 LEU 1 3.611 10.081 0.438
12 2HD2 LEU 1 2HD2 LEU 1 3.367 9.509 -1.213
13 3HD2 LEU 1 3HD2 LEU 1 2.190 9.115 0.041
14 H GLU 2 H GLU 2 -0.912 12.451 -1.003
15 HA GLU 2 HA GLU 2 -2.505 11.159 1.108
16 1HB GLU 2 2HB GLU 2 -4.529 11.961 -0.255
17 2HB GLU 2 1HB GLU 2 -3.692 13.146 0.739
18 1HG GLU 2 2HG GLU 2 -2.636 12.974 -1.969
19 2HG GLU 2 1HG GLU 2 -4.343 13.426 -1.909
20 H CYS 3 H CYS 3 -2.701 9.069 0.693
21 HA CYS 3 HA CYS 3 -2.683 8.172 -2.109
22 1HB CYS 3 2HB CYS 3 -1.601 7.046 0.407
23 2HB CYS 3 1HB CYS 3 -2.317 5.885 -0.713
24 H HIS 4 H HIS 4 -3.831 5.850 -2.176
25 HA HIS 4 HA HIS 4 -6.586 6.382 -1.371
26 1HB HIS 4 2HB HIS 4 -5.273 4.715 -3.468
27 2HB HIS 4 1HB HIS 4 -6.858 4.213 -2.878
28 HD1 HIS 4 1HD HIS 4 -8.717 6.266 -2.989
29 HD2 HIS 4 2HD HIS 4 -5.406 6.502 -5.489
30 HE1 HIS 4 1HE HIS 4 -9.353 7.898 -4.794
31 HE2 HIS 4 2HE HIS 4 -7.370 7.949 -6.347
32 H ASN 5 H ASN 5 -7.365 5.485 0.411
33 HA ASN 5 HA ASN 5 -5.967 3.350 1.742
34 1HB ASN 5 2HB ASN 5 -7.761 3.592 3.457
35 2HB ASN 5 1HB ASN 5 -6.942 5.110 3.090
36 1HD2 ASN 5 1HD2 ASN 5 -9.094 5.548 4.287
37 2HD2 ASN 5 2HD2 ASN 5 -10.399 5.989 3.242
38 H GLN 6 H GLN 6 -8.211 3.411 -0.726
39 HA GLN 6 HA GLN 6 -10.062 1.448 -0.138
40 1HB GLN 6 2HB GLN 6 -9.669 2.920 -2.285
41 2HB GLN 6 1HB GLN 6 -8.794 1.496 -2.848
42 1HG GLN 6 2HG GLN 6 -11.197 0.515 -1.838
43 2HG GLN 6 1HG GLN 6 -11.631 1.985 -2.708
44 1HE2 GLN 6 1HE2 GLN 6 -9.828 -1.034 -3.019
45 2HE2 GLN 6 2HE2 GLN 6 -10.083 -1.221 -4.717
46 H GLN 7 H GLN 7 -10.167 -0.798 -0.669
47 HA GLN 7 HA GLN 7 -7.692 -2.223 -1.173
48 1HB GLN 7 2HB GLN 7 -7.800 -3.582 0.836
49 2HB GLN 7 1HB GLN 7 -7.682 -1.879 1.274
50 1HG GLN 7 2HG GLN 7 -10.314 -3.310 1.138
51 2HG GLN 7 1HG GLN 7 -9.308 -3.324 2.585
52 1HE2 GLN 7 1HE2 GLN 7 -11.986 -2.119 1.870
53 2HE2 GLN 7 2HE2 GLN 7 -11.858 -0.473 2.381
54 H SER 8 H SER 8 -8.480 -4.762 -0.526
55 HA SER 8 HA SER 8 -9.823 -5.704 -2.672
56 1HB SER 8 2HB SER 8 -10.624 -7.591 -1.011
57 2HB SER 8 1HB SER 8 -8.912 -7.392 -1.382
58 HG SER 8 HG SER 8 -8.605 -7.011 0.649
59 H SER 9 H SER 9 -11.363 -4.808 0.409
60 HA SER 9 HA SER 9 -14.008 -5.287 -0.607
61 1HB SER 9 2HB SER 9 -13.668 -3.591 1.801
62 2HB SER 9 1HB SER 9 -14.715 -4.986 1.541
63 HG SER 9 HG SER 9 -12.664 -6.228 1.608
64 H GLN 10 H GLN 10 -15.615 -3.709 -1.014
65 HA GLN 10 HA GLN 10 -14.773 -1.497 -2.501
66 1HB GLN 10 2HB GLN 10 -17.420 -2.305 -1.328
67 2HB GLN 10 1HB GLN 10 -17.232 -0.793 -2.213
68 1HG GLN 10 2HG GLN 10 -16.288 -2.200 -4.105
69 2HG GLN 10 1HG GLN 10 -16.910 -3.595 -3.225
70 1HE2 GLN 10 1HE2 GLN 10 -19.060 -4.021 -3.234
71 2HE2 GLN 10 2HE2 GLN 10 -20.218 -3.121 -4.163
72 H THR 11 H THR 11 -13.918 0.338 -1.818
73 HA THR 11 HA THR 11 -15.091 1.931 0.180
74 HB THR 11 HB THR 11 -12.317 1.127 0.955
75 HG1 THR 11 1HG THR 11 -14.640 -0.218 1.855
76 1HG2 THR 11 1HG2 THR 11 -12.705 2.486 2.645
77 2HG2 THR 11 2HG2 THR 11 -14.026 1.440 3.167
78 3HG2 THR 11 3HG2 THR 11 -14.344 2.780 2.066
79 HA PRO 12 HA PRO 12 -12.320 3.921 -3.058
80 1HB PRO 12 2HB PRO 12 -14.764 5.409 -3.733
81 2HB PRO 12 1HB PRO 12 -13.674 4.508 -4.789
82 1HG PRO 12 2HG PRO 12 -16.152 3.626 -4.213
83 2HG PRO 12 1HG PRO 12 -14.788 2.515 -4.464
84 1HD PRO 12 2HD PRO 12 -16.035 3.442 -1.900
85 2HD PRO 12 1HD PRO 12 -15.471 1.819 -2.360
86 H THR 13 H THR 13 -11.228 5.038 -1.421
87 HA THR 13 HA THR 13 -12.099 7.755 -1.026
88 HB THR 13 HB THR 13 -11.893 7.611 1.477
89 HG1 THR 13 1HG THR 13 -12.111 4.830 0.971
90 1HG2 THR 13 1HG2 THR 13 -14.096 7.084 1.864
91 2HG2 THR 13 2HG2 THR 13 -14.114 5.801 0.654
92 3HG2 THR 13 3HG2 THR 13 -14.109 7.491 0.148
93 H THR 14 H THR 14 -10.463 8.957 0.388
94 HA THR 14 HA THR 14 -7.772 7.809 0.075
95 HB THR 14 HB THR 14 -7.159 10.342 -0.388
96 HG1 THR 14 1HG THR 14 -9.763 10.161 -1.488
97 1HG2 THR 14 1HG2 THR 14 -7.251 8.152 -1.976
98 2HG2 THR 14 2HG2 THR 14 -6.709 9.750 -2.493
99 3HG2 THR 14 3HG2 THR 14 -8.366 9.234 -2.811
100 H THR 15 H THR 15 -6.227 8.491 1.591
101 HA THR 15 HA THR 15 -7.081 10.287 3.720
102 HB THR 15 HB THR 15 -7.830 8.044 4.435
103 HG1 THR 15 1HG THR 15 -6.744 8.086 6.449
104 1HG2 THR 15 1HG2 THR 15 -5.930 6.829 3.241
105 2HG2 THR 15 2HG2 THR 15 -6.418 6.242 4.831
106 3HG2 THR 15 3HG2 THR 15 -4.963 7.225 4.662
107 H GLY 16 H GLY 16 -5.464 11.658 4.054
108 1HA GLY 16 2HA GLY 16 -2.837 11.099 3.100
109 2HA GLY 16 1HA GLY 16 -3.369 12.585 3.857
110 H CYS 17 H CYS 17 -0.989 10.719 4.232
111 HA CYS 17 HA CYS 17 -1.331 9.881 6.997
112 1HB CYS 17 2HB CYS 17 1.117 9.692 5.227
113 2HB CYS 17 1HB CYS 17 0.876 8.883 6.778
114 H SER 18 H SER 18 0.418 10.437 8.576
115 HA SER 18 HA SER 18 0.660 13.282 8.744
116 1HB SER 18 2HB SER 18 2.188 12.472 10.786
117 2HB SER 18 1HB SER 18 0.426 12.436 10.862
118 HG SER 18 HG SER 18 2.121 10.405 11.070
119 H GLY 19 H GLY 19 2.573 14.518 8.822
120 1HA GLY 19 2HA GLY 19 4.435 14.072 6.847
121 2HA GLY 19 1HA GLY 19 4.688 15.148 8.208
122 H GLY 20 H GLY 20 5.321 11.997 6.886
123 1HA GLY 20 2HA GLY 20 7.745 11.685 8.190
124 2HA GLY 20 1HA GLY 20 6.527 10.821 9.117
125 H GLU 21 H GLU 21 4.932 10.045 6.868
126 HA GLU 21 HA GLU 21 6.739 8.069 5.637
127 1HB GLU 21 2HB GLU 21 4.688 7.492 7.298
128 2HB GLU 21 1HB GLU 21 3.838 7.485 5.753
129 1HG GLU 21 2HG GLU 21 4.499 5.381 5.543
130 2HG GLU 21 1HG GLU 21 6.114 6.018 5.240
131 H ASN 22 H ASN 22 7.164 8.814 3.646
132 HA ASN 22 HA ASN 22 4.963 9.918 2.049
133 1HB ASN 22 2HB ASN 22 7.926 10.257 2.020
134 2HB ASN 22 1HB ASN 22 7.061 10.422 0.495
135 1HD2 ASN 22 1HD2 ASN 22 8.410 12.542 1.466
136 2HD2 ASN 22 2HD2 ASN 22 7.313 13.751 2.032
137 H ASN 23 H ASN 23 5.414 7.038 2.590
138 HA ASN 23 HA ASN 23 5.585 6.160 -0.211
139 1HB ASN 23 2HB ASN 23 6.720 4.704 2.188
140 2HB ASN 23 1HB ASN 23 6.686 4.082 0.536
141 1HD2 ASN 23 1HD2 ASN 23 8.565 5.540 2.782
142 2HD2 ASN 23 2HD2 ASN 23 9.736 6.291 1.743
143 H CYS 24 H CYS 24 4.103 4.649 -0.855
144 HA CYS 24 HA CYS 24 2.147 3.789 1.178
145 1HB CYS 24 2HB CYS 24 1.571 4.417 -1.724
146 2HB CYS 24 1HB CYS 24 0.393 3.960 -0.490
147 H TYR 25 H TYR 25 2.202 1.670 1.482
148 HA TYR 25 HA TYR 25 3.349 -0.060 -0.477
149 1HB TYR 25 2HB TYR 25 3.382 -1.717 1.232
150 2HB TYR 25 1HB TYR 25 3.886 -0.200 1.967
151 HD1 TYR 25 1HD TYR 25 2.236 1.069 3.374
152 HD2 TYR 25 2HD TYR 25 1.488 -2.905 2.030
153 HE1 TYR 25 1HE TYR 25 0.499 0.818 5.096
154 HE2 TYR 25 2HE TYR 25 -0.251 -3.159 3.750
155 HH TYR 25 HH TYR 25 -0.717 -2.046 6.081
156 H LYS 26 H LYS 26 2.336 -2.129 -0.997
157 HA LYS 26 HA LYS 26 -0.574 -2.217 -0.875
158 1HB LYS 26 2HB LYS 26 -0.136 -1.045 -2.977
159 2HB LYS 26 1HB LYS 26 0.983 -2.315 -3.473
160 1HG LYS 26 2HG LYS 26 -0.718 -3.836 -3.869
161 2HG LYS 26 1HG LYS 26 -1.867 -2.969 -2.850
162 1HD LYS 26 2HD LYS 26 -2.673 -2.050 -4.714
163 2HD LYS 26 1HD LYS 26 -1.167 -1.137 -4.824
164 1HE LYS 26 2HE LYS 26 -0.450 -2.330 -6.573
165 2HE LYS 26 1HE LYS 26 -0.926 -3.859 -5.834
166 1HZ LYS 26 1HZ LYS 26 -2.267 -3.700 -7.700
167 2HZ LYS 26 2HZ LYS 26 -2.538 -2.041 -7.509
168 3HZ LYS 26 3HZ LYS 26 -3.285 -3.144 -6.467
169 H LYS 27 H LYS 27 -0.578 -4.065 0.329
170 HA LYS 27 HA LYS 27 1.031 -6.319 -0.627
171 1HB LYS 27 2HB LYS 27 0.161 -7.257 1.678
172 2HB LYS 27 1HB LYS 27 1.532 -6.167 1.597
173 1HG LYS 27 2HG LYS 27 0.082 -4.295 2.171
174 2HG LYS 27 1HG LYS 27 -1.308 -5.381 2.223
175 1HD LYS 27 2HD LYS 27 0.594 -6.570 3.880
176 2HD LYS 27 1HD LYS 27 0.695 -4.846 4.241
177 1HE LYS 27 2HE LYS 27 -1.605 -4.739 4.806
178 2HE LYS 27 1HE LYS 27 -1.913 -6.343 4.142
179 1HZ LYS 27 1HZ LYS 27 -1.028 -7.367 5.955
180 2HZ LYS 27 2HZ LYS 27 -1.615 -5.968 6.702
181 3HZ LYS 27 3HZ LYS 27 0.027 -6.096 6.322
182 H GLU 28 H GLU 28 0.129 -7.918 -1.704
183 HA GLU 28 HA GLU 28 -2.755 -8.404 -1.381
184 1HB GLU 28 2HB GLU 28 -2.284 -9.368 -3.859
185 2HB GLU 28 1HB GLU 28 -2.850 -7.731 -3.544
186 1HG GLU 28 2HG GLU 28 -0.766 -6.802 -3.947
187 2HG GLU 28 1HG GLU 28 0.077 -8.326 -3.680
188 H TRP 29 H TRP 29 -3.277 -10.403 -0.757
189 HA TRP 29 HA TRP 29 -1.357 -12.579 -1.228
190 1HB TRP 29 2HB TRP 29 -1.832 -13.488 0.997
191 2HB TRP 29 1HB TRP 29 -1.160 -11.868 1.118
192 HD1 TRP 29 HD TRP 29 -3.858 -13.911 2.408
193 HE1 TRP 29 1HE TRP 29 -5.644 -12.482 3.597
194 HE3 TRP 29 3HE TRP 29 -2.422 -9.309 0.747
195 HZ2 TRP 29 2HZ TRP 29 -6.339 -9.750 3.801
196 HZ3 TRP 29 3HZ TRP 29 -3.691 -7.338 1.482
197 HH2 TRP 29 HH TRP 29 -5.610 -7.553 2.979
198 H ARG 30 H ARG 30 -2.256 -14.191 -2.323
199 HA ARG 30 HA ARG 30 -5.156 -14.358 -2.492
200 1HB ARG 30 2HB ARG 30 -4.556 -16.130 -4.250
201 2HB ARG 30 1HB ARG 30 -4.195 -14.449 -4.623
202 1HG ARG 30 2HG ARG 30 -1.985 -14.816 -4.694
203 2HG ARG 30 1HG ARG 30 -2.018 -15.910 -3.309
204 1HD ARG 30 2HD ARG 30 -2.116 -17.725 -4.613
205 2HD ARG 30 1HD ARG 30 -3.336 -17.008 -5.664
206 HE ARG 30 HE ARG 30 -1.674 -16.573 -7.149
207 1HH1 ARG 30 1HH1 ARG 30 -0.246 -16.774 -3.970
208 2HH1 ARG 30 2HH1 ARG 30 1.372 -16.555 -4.546
209 1HH2 ARG 30 1HH2 ARG 30 0.454 -16.286 -7.909
210 2HH2 ARG 30 2HH2 ARG 30 1.770 -16.278 -6.782
211 H ASP 31 H ASP 31 -6.071 -16.640 -2.619
212 HA ASP 31 HA ASP 31 -4.788 -18.393 -0.635
213 1HB ASP 31 2HB ASP 31 -7.132 -18.923 0.191
214 2HB ASP 31 1HB ASP 31 -6.511 -17.323 0.606
215 H ASN 32 H ASN 32 -7.358 -18.187 -3.086
216 HA ASN 32 HA ASN 32 -6.449 -20.328 -4.621
217 1HB ASN 32 2HB ASN 32 -7.604 -21.256 -2.264
218 2HB ASN 32 1HB ASN 32 -8.880 -21.436 -3.463
219 1HD2 ASN 32 1HD2 ASN 32 -8.603 -22.853 -5.168
220 2HD2 ASN 32 2HD2 ASN 32 -7.353 -24.046 -5.188
221 H ARG 33 H ARG 33 -9.764 -19.668 -3.504
222 HA ARG 33 HA ARG 33 -10.693 -19.376 -6.193
223 1HB ARG 33 2HB ARG 33 -12.861 -18.782 -5.030
224 2HB ARG 33 1HB ARG 33 -12.210 -20.382 -4.683
225 1HG ARG 33 2HG ARG 33 -11.176 -18.523 -2.789
226 2HG ARG 33 1HG ARG 33 -12.929 -18.347 -2.869
227 1HD ARG 33 2HD ARG 33 -13.283 -20.329 -1.888
228 2HD ARG 33 1HD ARG 33 -12.042 -21.127 -2.850
229 HE ARG 33 HE ARG 33 -10.603 -19.672 -1.088
230 1HH1 ARG 33 1HH1 ARG 33 -13.227 -21.942 -0.711
231 2HH1 ARG 33 2HH1 ARG 33 -12.703 -22.481 0.848
232 1HH2 ARG 33 1HH2 ARG 33 -9.910 -20.382 0.962
233 2HH2 ARG 33 2HH2 ARG 33 -10.820 -21.595 1.799
234 H GLY 34 H GLY 34 -9.797 -17.227 -3.583
235 1HA GLY 34 2HA GLY 34 -10.017 -14.975 -5.446
236 2HA GLY 34 1HA GLY 34 -10.864 -14.857 -3.911
237 H TYR 35 H TYR 35 -9.411 -12.900 -3.851
238 HA TYR 35 HA TYR 35 -7.187 -13.488 -2.126
239 1HB TYR 35 2HB TYR 35 -5.577 -12.124 -3.531
240 2HB TYR 35 1HB TYR 35 -5.969 -13.723 -4.155
241 HD1 TYR 35 1HD TYR 35 -6.156 -10.147 -4.740
242 HD2 TYR 35 2HD TYR 35 -7.487 -13.953 -6.097
243 HE1 TYR 35 1HE TYR 35 -6.827 -9.141 -6.881
244 HE2 TYR 35 2HE TYR 35 -8.161 -12.959 -8.243
245 HH TYR 35 HH TYR 35 -7.305 -10.710 -9.581
246 H ARG 36 H ARG 36 -6.204 -11.491 -1.243
247 HA ARG 36 HA ARG 36 -8.071 -9.214 -1.365
248 1HB ARG 36 2HB ARG 36 -7.122 -10.774 0.934
249 2HB ARG 36 1HB ARG 36 -6.950 -9.030 1.139
250 1HG ARG 36 2HG ARG 36 -9.129 -8.762 1.470
251 2HG ARG 36 1HG ARG 36 -9.543 -9.738 0.060
252 1HD ARG 36 2HD ARG 36 -9.435 -11.749 1.307
253 2HD ARG 36 1HD ARG 36 -8.664 -10.942 2.673
254 HE ARG 36 HE ARG 36 -11.042 -9.669 2.459
255 1HH1 ARG 36 1HH1 ARG 36 -10.144 -13.034 2.682
256 2HH1 ARG 36 2HH1 ARG 36 -11.604 -13.500 3.488
257 1HH2 ARG 36 1HH2 ARG 36 -12.964 -10.280 3.520
258 2HH2 ARG 36 2HH2 ARG 36 -13.205 -11.937 3.964
259 H THR 37 H THR 37 -7.082 -7.144 -0.631
260 HA THR 37 HA THR 37 -4.219 -6.911 -0.690
261 HB THR 37 HB THR 37 -4.679 -7.115 -3.086
262 HG1 THR 37 1HG THR 37 -3.028 -5.697 -2.504
263 1HG2 THR 37 1HG2 THR 37 -7.033 -5.935 -2.721
264 2HG2 THR 37 2HG2 THR 37 -6.193 -5.941 -4.273
265 3HG2 THR 37 3HG2 THR 37 -6.092 -4.530 -3.220
266 H GLU 38 H GLU 38 -3.799 -5.400 0.790
267 HA GLU 38 HA GLU 38 -5.700 -3.173 1.082
268 1HB GLU 38 2HB GLU 38 -4.409 -3.122 3.432
269 2HB GLU 38 1HB GLU 38 -5.869 -4.059 3.165
270 1HG GLU 38 2HG GLU 38 -4.431 -6.020 2.654
271 2HG GLU 38 1HG GLU 38 -3.033 -5.054 3.118
272 H ARG 39 H ARG 39 -4.851 -1.104 1.595
273 HA ARG 39 HA ARG 39 -2.106 -0.711 0.614
274 1HB ARG 39 2HB ARG 39 -4.188 1.452 0.786
275 2HB ARG 39 1HB ARG 39 -2.745 1.397 -0.216
276 1HG ARG 39 2HG ARG 39 -4.930 -0.598 -0.631
277 2HG ARG 39 1HG ARG 39 -5.070 1.033 -1.290
278 1HD ARG 39 2HD ARG 39 -3.413 0.711 -2.809
279 2HD ARG 39 1HD ARG 39 -2.522 -0.394 -1.764
280 HE ARG 39 HE ARG 39 -3.668 -2.151 -2.691
281 1HH1 ARG 39 1HH1 ARG 39 -5.244 0.835 -3.574
282 2HH1 ARG 39 2HH1 ARG 39 -6.301 0.083 -4.721
283 1HH2 ARG 39 1HH2 ARG 39 -5.056 -3.141 -4.200
284 2HH2 ARG 39 2HH2 ARG 39 -6.196 -2.173 -5.076
285 H GLY 40 H GLY 40 -1.725 1.902 1.492
286 1HA GLY 40 2HA GLY 40 -2.182 2.879 3.875
287 2HA GLY 40 1HA GLY 40 -1.330 1.415 4.357
288 H CYS 41 H CYS 41 -0.069 3.377 5.316
289 HA CYS 41 HA CYS 41 1.896 4.369 3.375
290 1HB CYS 41 2HB CYS 41 0.777 5.390 5.904
291 2HB CYS 41 1HB CYS 41 2.517 5.629 5.719
292 H GLY 42 H GLY 42 4.089 4.024 3.618
293 1HA GLY 42 2HA GLY 42 5.965 3.312 4.998
294 2HA GLY 42 1HA GLY 42 4.884 2.159 5.764
295 H CYS 43 H CYS 43 6.828 0.788 5.156
296 HA CYS 43 HA CYS 43 6.156 -0.641 2.720
297 1HB CYS 43 2HB CYS 43 7.976 1.171 2.275
298 2HB CYS 43 1HB CYS 43 9.046 0.065 3.128
299 HA PRO 44 HA PRO 44 7.606 -3.134 6.472
300 1HB PRO 44 2HB PRO 44 5.261 -4.428 6.935
301 2HB PRO 44 1HB PRO 44 5.668 -2.874 7.681
302 1HG PRO 44 2HG PRO 44 3.952 -3.439 5.292
303 2HG PRO 44 1HG PRO 44 3.667 -2.315 6.634
304 1HD PRO 44 2HD PRO 44 4.591 -1.496 4.227
305 2HD PRO 44 1HD PRO 44 5.057 -0.703 5.746
306 H SER 45 H SER 45 7.942 -5.409 6.518
307 HA SER 45 HA SER 45 6.863 -7.219 4.657
308 1HB SER 45 2HB SER 45 9.283 -7.451 3.501
309 2HB SER 45 1HB SER 45 7.994 -6.453 2.827
310 HG SER 45 HG SER 45 9.895 -5.440 4.658
311 H VAL 46 H VAL 46 6.799 -8.722 6.243
312 HA VAL 46 HA VAL 46 9.361 -9.710 7.231
313 HB VAL 46 HB VAL 46 6.937 -9.672 8.884
314 1HG1 VAL 46 1HG1 VAL 46 9.025 -9.705 10.611
315 2HG1 VAL 46 2HG1 VAL 46 9.689 -10.593 9.238
316 3HG1 VAL 46 3HG1 VAL 46 8.203 -11.147 10.012
317 1HG2 VAL 46 1HG2 VAL 46 7.535 -7.355 8.402
318 2HG2 VAL 46 2HG2 VAL 46 9.171 -7.663 8.981
319 3HG2 VAL 46 3HG2 VAL 46 7.810 -7.742 10.100
320 H LYS 47 H LYS 47 7.250 -10.432 5.273
321 HA LYS 47 HA LYS 47 7.315 -13.288 5.761
322 1HB LYS 47 2HB LYS 47 4.853 -13.497 5.256
323 2HB LYS 47 1HB LYS 47 5.241 -12.807 6.826
324 1HG LYS 47 2HG LYS 47 5.058 -10.580 5.256
325 2HG LYS 47 1HG LYS 47 3.831 -11.637 4.555
326 1HD LYS 47 2HD LYS 47 2.694 -11.836 6.629
327 2HD LYS 47 1HD LYS 47 4.033 -11.097 7.510
328 1HE LYS 47 2HE LYS 47 2.618 -9.581 5.352
329 2HE LYS 47 1HE LYS 47 1.921 -9.687 6.968
330 1HZ LYS 47 1HZ LYS 47 4.730 -8.893 6.710
331 2HZ LYS 47 2HZ LYS 47 3.586 -8.440 7.869
332 3HZ LYS 47 3HZ LYS 47 3.538 -7.755 6.324
333 H LYS 48 H LYS 48 7.874 -14.269 3.937
334 HA LYS 48 HA LYS 48 7.765 -12.819 1.431
335 1HB LYS 48 2HB LYS 48 8.987 -15.429 2.293
336 2HB LYS 48 1HB LYS 48 8.888 -14.989 0.594
337 1HG LYS 48 2HG LYS 48 10.030 -12.783 1.394
338 2HG LYS 48 1HG LYS 48 10.509 -13.770 2.776
339 1HD LYS 48 2HD LYS 48 11.921 -15.054 1.541
340 2HD LYS 48 1HD LYS 48 10.924 -14.943 0.090
341 1HE LYS 48 2HE LYS 48 11.933 -13.041 -0.624
342 2HE LYS 48 1HE LYS 48 12.212 -12.447 1.011
343 1HZ LYS 48 1HZ LYS 48 13.842 -14.541 0.974
344 2HZ LYS 48 2HZ LYS 48 14.325 -12.987 0.513
345 3HZ LYS 48 3HZ LYS 48 13.893 -14.122 -0.664
346 H GLY 49 H GLY 49 7.264 -14.385 -0.550
347 1HA GLY 49 2HA GLY 49 5.775 -15.890 -1.570
348 2HA GLY 49 1HA GLY 49 4.927 -16.054 -0.033
349 H ILE 50 H ILE 50 4.265 -13.518 0.615
350 HA ILE 50 HA ILE 50 2.131 -12.974 -1.231
351 HB ILE 50 HB ILE 50 2.931 -11.345 1.180
352 1HG1 ILE 50 2HG1 ILE 50 1.177 -13.799 0.961
353 2HG1 ILE 50 1HG1 ILE 50 2.633 -13.604 1.940
354 1HG2 ILE 50 1HG2 ILE 50 1.367 -10.272 -0.383
355 2HG2 ILE 50 2HG2 ILE 50 0.618 -10.620 1.175
356 3HG2 ILE 50 3HG2 ILE 50 0.279 -11.649 -0.216
357 1HD1 ILE 50 1HD1 ILE 50 1.196 -13.216 3.602
358 2HD1 ILE 50 2HD1 ILE 50 -0.132 -12.854 2.501
359 3HD1 ILE 50 3HD1 ILE 50 1.051 -11.606 2.895
360 H GLY 51 H GLY 51 1.746 -10.979 -2.312
361 1HA GLY 51 2HA GLY 51 4.200 -9.752 -3.283
362 2HA GLY 51 1HA GLY 51 2.586 -9.519 -3.939
363 H ILE 52 H ILE 52 4.867 -7.704 -2.921
364 HA ILE 52 HA ILE 52 3.082 -5.776 -1.690
365 HB ILE 52 HB ILE 52 3.984 -6.994 0.244
366 1HG1 ILE 52 2HG1 ILE 52 5.469 -4.468 0.513
367 2HG1 ILE 52 1HG1 ILE 52 3.821 -4.278 -0.094
368 1HG2 ILE 52 1HG2 ILE 52 6.710 -5.938 -0.105
369 2HG2 ILE 52 2HG2 ILE 52 6.261 -7.269 -1.172
370 3HG2 ILE 52 3HG2 ILE 52 6.160 -7.468 0.578
371 1HD1 ILE 52 1HD1 ILE 52 4.604 -4.505 2.547
372 2HD1 ILE 52 2HD1 ILE 52 3.923 -6.083 2.158
373 3HD1 ILE 52 3HD1 ILE 52 2.962 -4.624 1.917
374 H ASN 53 H ASN 53 3.406 -3.897 -2.653
375 HA ASN 53 HA ASN 53 6.119 -3.219 -3.578
376 1HB ASN 53 2HB ASN 53 5.073 -2.049 -5.508
377 2HB ASN 53 1HB ASN 53 4.792 -3.791 -5.529
378 1HD2 ASN 53 1HD2 ASN 53 3.385 -0.731 -5.616
379 2HD2 ASN 53 2HD2 ASN 53 1.731 -1.214 -5.493
380 H CYS 54 H CYS 54 6.686 -1.007 -3.501
381 HA CYS 54 HA CYS 54 4.842 0.695 -1.959
382 1HB CYS 54 2HB CYS 54 7.838 0.526 -1.568
383 2HB CYS 54 1HB CYS 54 6.726 1.569 -0.677
384 H CYS 55 H CYS 55 4.634 2.757 -2.617
385 HA CYS 55 HA CYS 55 6.378 3.668 -4.813
386 1HB CYS 55 2HB CYS 55 4.337 5.061 -5.493
387 2HB CYS 55 1HB CYS 55 4.263 3.325 -5.803
388 H THR 56 H THR 56 5.995 6.223 -5.039
389 HA THR 56 HA THR 56 5.876 7.486 -2.415
390 HB THR 56 HB THR 56 8.219 6.892 -2.609
391 HG1 THR 56 1HG THR 56 7.667 8.980 -1.767
392 1HG2 THR 56 1HG2 THR 56 8.248 8.454 -5.180
393 2HG2 THR 56 2HG2 THR 56 8.418 6.705 -5.031
394 3HG2 THR 56 3HG2 THR 56 9.650 7.771 -4.358
395 H THR 57 H THR 57 3.991 7.760 -4.344
396 HA THR 57 HA THR 57 4.315 10.570 -5.066
397 HB THR 57 HB THR 57 4.771 9.914 -7.195
398 HG1 THR 57 1HG THR 57 2.936 9.970 -8.420
399 1HG2 THR 57 1HG2 THR 57 3.883 7.318 -6.325
400 2HG2 THR 57 2HG2 THR 57 5.015 7.757 -7.601
401 3HG2 THR 57 3HG2 THR 57 3.286 7.694 -7.941
402 H ASP 58 H ASP 58 2.346 11.715 -5.304
403 HA ASP 58 HA ASP 58 0.349 11.089 -3.508
404 1HB ASP 58 2HB ASP 58 -1.017 12.782 -4.847
405 2HB ASP 58 1HB ASP 58 0.520 13.337 -4.199
406 H ARG 59 H ARG 59 -1.368 9.787 -3.518
407 HA ARG 59 HA ARG 59 -2.810 8.152 -4.190
408 1HB ARG 59 2HB ARG 59 -2.994 9.966 -6.602
409 2HB ARG 59 1HB ARG 59 -4.135 8.687 -6.214
410 1HG ARG 59 2HG ARG 59 -4.441 9.926 -3.979
411 2HG ARG 59 1HG ARG 59 -3.673 11.288 -4.808
412 1HD ARG 59 2HD ARG 59 -5.386 11.216 -6.540
413 2HD ARG 59 1HD ARG 59 -6.138 9.822 -5.756
414 HE ARG 59 HE ARG 59 -5.919 12.082 -4.014
415 1HH1 ARG 59 1HH1 ARG 59 -7.837 10.654 -6.557
416 2HH1 ARG 59 2HH1 ARG 59 -9.292 11.465 -6.086
417 1HH2 ARG 59 1HH2 ARG 59 -7.834 13.150 -3.394
418 2HH2 ARG 59 2HH2 ARG 59 -9.290 12.882 -4.291
419 H CYS 60 H CYS 60 -0.276 7.325 -4.536
420 HA CYS 60 HA CYS 60 0.039 6.289 -7.228
421 1HB CYS 60 2HB CYS 60 2.227 5.562 -6.438
422 2HB CYS 60 1HB CYS 60 1.965 7.259 -6.051
423 H ASN 61 H ASN 61 -2.118 5.314 -5.402
424 HA ASN 61 HA ASN 61 -1.688 2.506 -5.866
425 1HB ASN 61 2HB ASN 61 -1.979 1.772 -3.572
426 2HB ASN 61 1HB ASN 61 -0.588 2.856 -3.666
427 1HD2 ASN 61 1HD2 ASN 61 -1.464 2.532 -1.251
428 2HD2 ASN 61 2HD2 ASN 61 -2.409 3.877 -0.693
429 H ASN 62 H ASN 62 -3.493 3.850 -7.166
430 HA ASN 62 HA ASN 62 -6.017 4.061 -5.819
431 1HB ASN 62 2HB ASN 62 -5.028 5.212 -8.053
432 2HB ASN 62 1HB ASN 62 -5.959 3.900 -8.780
433 1HD2 ASN 62 1HD2 ASN 62 -8.124 3.679 -7.240
434 2HD2 ASN 62 2HD2 ASN 62 -9.045 5.152 -7.242
Start of MODEL 14
1 1H LEU 1 1HT LEU 1 2.130 14.532 0.425
2 2H LEU 1 2HT LEU 1 1.856 13.477 1.750
3 3H LEU 1 3HT LEU 1 0.570 14.430 1.130
4 HA LEU 1 HA LEU 1 0.948 13.246 -1.025
5 1HB LEU 1 2HB LEU 1 3.173 12.371 0.025
6 2HB LEU 1 1HB LEU 1 2.146 11.148 0.749
7 HG LEU 1 HG LEU 1 1.410 11.092 -1.920
8 1HD1 LEU 1 1HD1 LEU 1 3.161 11.434 -3.291
9 2HD1 LEU 1 2HD1 LEU 1 4.337 10.859 -2.109
10 3HD1 LEU 1 3HD1 LEU 1 3.707 12.502 -1.997
11 1HD2 LEU 1 1HD2 LEU 1 2.398 8.924 -1.933
12 2HD2 LEU 1 2HD2 LEU 1 1.782 9.214 -0.306
13 3HD2 LEU 1 3HD2 LEU 1 3.510 9.358 -0.634
14 H GLU 2 H GLU 2 -0.944 12.291 -1.460
15 HA GLU 2 HA GLU 2 -2.521 11.279 0.799
16 1HB GLU 2 2HB GLU 2 -3.285 13.126 -0.932
17 2HB GLU 2 1HB GLU 2 -3.695 11.725 -1.911
18 1HG GLU 2 2HG GLU 2 -4.803 11.053 0.478
19 2HG GLU 2 1HG GLU 2 -4.999 12.810 0.472
20 H CYS 3 H CYS 3 -3.680 9.310 0.624
21 HA CYS 3 HA CYS 3 -3.259 7.564 -1.619
22 1HB CYS 3 2HB CYS 3 -1.556 7.379 0.772
23 2HB CYS 3 1HB CYS 3 -2.305 5.858 0.283
24 H HIS 4 H HIS 4 -4.115 5.281 -1.038
25 HA HIS 4 HA HIS 4 -6.743 5.647 0.059
26 1HB HIS 4 2HB HIS 4 -5.314 3.293 -1.177
27 2HB HIS 4 1HB HIS 4 -6.963 3.200 -0.564
28 HD1 HIS 4 1HD HIS 4 -8.797 4.482 -1.897
29 HD2 HIS 4 2HD HIS 4 -5.013 4.610 -3.609
30 HE1 HIS 4 1HE HIS 4 -9.147 5.330 -4.238
31 HE2 HIS 4 2HE HIS 4 -6.830 5.518 -5.209
32 H ASN 5 H ASN 5 -7.651 4.058 1.622
33 HA ASN 5 HA ASN 5 -5.671 3.112 3.570
34 1HB ASN 5 2HB ASN 5 -7.297 3.882 5.382
35 2HB ASN 5 1HB ASN 5 -6.393 5.149 4.553
36 1HD2 ASN 5 1HD2 ASN 5 -8.367 6.116 5.756
37 2HD2 ASN 5 2HD2 ASN 5 -9.729 6.413 4.734
38 H GLN 6 H GLN 6 -9.071 3.055 2.593
39 HA GLN 6 HA GLN 6 -9.844 0.785 4.033
40 1HB GLN 6 2HB GLN 6 -11.126 2.560 2.422
41 2HB GLN 6 1HB GLN 6 -11.091 1.139 1.379
42 1HG GLN 6 2HG GLN 6 -12.395 -0.112 2.826
43 2HG GLN 6 1HG GLN 6 -12.029 0.917 4.208
44 1HE2 GLN 6 1HE2 GLN 6 -14.547 0.000 2.714
45 2HE2 GLN 6 2HE2 GLN 6 -15.455 1.458 2.531
46 H GLN 7 H GLN 7 -10.747 -1.203 2.638
47 HA GLN 7 HA GLN 7 -8.927 -2.093 0.587
48 1HB GLN 7 2HB GLN 7 -8.099 -4.045 1.783
49 2HB GLN 7 1HB GLN 7 -7.641 -2.569 2.632
50 1HG GLN 7 2HG GLN 7 -8.486 -3.458 4.471
51 2HG GLN 7 1HG GLN 7 -10.084 -3.306 3.743
52 1HE2 GLN 7 1HE2 GLN 7 -11.100 -5.111 4.313
53 2HE2 GLN 7 2HE2 GLN 7 -10.522 -6.716 4.038
54 H SER 8 H SER 8 -9.459 -4.423 -0.043
55 HA SER 8 HA SER 8 -10.984 -5.895 -0.863
56 1HB SER 8 2HB SER 8 -12.472 -6.866 0.663
57 2HB SER 8 1HB SER 8 -11.220 -6.195 1.708
58 HG SER 8 HG SER 8 -12.557 -4.511 2.222
59 H SER 9 H SER 9 -11.181 -3.466 -2.018
60 HA SER 9 HA SER 9 -13.888 -3.442 -2.926
61 1HB SER 9 2HB SER 9 -12.899 -1.076 -1.316
62 2HB SER 9 1HB SER 9 -14.342 -1.056 -2.331
63 HG SER 9 HG SER 9 -15.339 -1.859 -0.679
64 H GLN 10 H GLN 10 -14.226 -1.841 -4.667
65 HA GLN 10 HA GLN 10 -11.902 -1.710 -6.344
66 1HB GLN 10 2HB GLN 10 -14.803 -1.136 -6.638
67 2HB GLN 10 1HB GLN 10 -13.707 -0.314 -7.748
68 1HG GLN 10 2HG GLN 10 -12.917 -3.017 -7.671
69 2HG GLN 10 1HG GLN 10 -14.674 -2.997 -7.820
70 1HE2 GLN 10 1HE2 GLN 10 -12.401 -3.649 -9.693
71 2HE2 GLN 10 2HE2 GLN 10 -12.747 -2.723 -11.120
72 H THR 11 H THR 11 -14.186 0.840 -5.344
73 HA THR 11 HA THR 11 -12.009 2.747 -5.512
74 HB THR 11 HB THR 11 -14.978 3.269 -5.541
75 HG1 THR 11 1HG THR 11 -14.510 2.353 -7.460
76 1HG2 THR 11 1HG2 THR 11 -13.970 5.433 -6.687
77 2HG2 THR 11 2HG2 THR 11 -12.628 5.059 -5.606
78 3HG2 THR 11 3HG2 THR 11 -14.243 5.322 -4.948
79 HA PRO 12 HA PRO 12 -12.889 2.337 -0.967
80 1HB PRO 12 2HB PRO 12 -10.298 2.307 -0.178
81 2HB PRO 12 1HB PRO 12 -11.154 0.848 -0.690
82 1HG PRO 12 2HG PRO 12 -9.268 2.581 -2.245
83 2HG PRO 12 1HG PRO 12 -9.352 0.809 -2.164
84 1HD PRO 12 2HD PRO 12 -10.397 2.228 -4.223
85 2HD PRO 12 1HD PRO 12 -11.104 0.698 -3.656
86 H THR 13 H THR 13 -11.870 3.737 0.842
87 HA THR 13 HA THR 13 -12.032 6.479 -0.027
88 HB THR 13 HB THR 13 -11.644 6.891 2.485
89 HG1 THR 13 1HG THR 13 -11.990 5.064 3.779
90 1HG2 THR 13 1HG2 THR 13 -13.976 5.899 1.120
91 2HG2 THR 13 2HG2 THR 13 -13.840 7.126 2.378
92 3HG2 THR 13 3HG2 THR 13 -13.972 5.424 2.819
93 H THR 14 H THR 14 -10.398 7.975 1.368
94 HA THR 14 HA THR 14 -7.679 6.943 1.171
95 HB THR 14 HB THR 14 -7.772 7.817 -0.988
96 HG1 THR 14 1HG THR 14 -6.096 9.001 -0.650
97 1HG2 THR 14 1HG2 THR 14 -9.399 9.143 -1.665
98 2HG2 THR 14 2HG2 THR 14 -8.655 10.479 -0.786
99 3HG2 THR 14 3HG2 THR 14 -9.864 9.467 0.005
100 H THR 15 H THR 15 -6.072 8.547 2.001
101 HA THR 15 HA THR 15 -7.028 10.663 3.693
102 HB THR 15 HB THR 15 -7.540 8.905 5.216
103 HG1 THR 15 1HG THR 15 -4.958 9.814 5.942
104 1HG2 THR 15 1HG2 THR 15 -4.766 7.809 4.843
105 2HG2 THR 15 2HG2 THR 15 -6.226 7.114 4.142
106 3HG2 THR 15 3HG2 THR 15 -6.031 7.173 5.893
107 H GLY 16 H GLY 16 -5.446 12.140 4.071
108 1HA GLY 16 2HA GLY 16 -2.964 11.774 2.723
109 2HA GLY 16 1HA GLY 16 -3.490 13.226 3.544
110 H CYS 17 H CYS 17 -1.164 10.961 3.562
111 HA CYS 17 HA CYS 17 -0.942 10.621 6.437
112 1HB CYS 17 2HB CYS 17 1.025 9.793 4.296
113 2HB CYS 17 1HB CYS 17 0.955 9.213 5.962
114 H SER 18 H SER 18 1.464 10.914 7.251
115 HA SER 18 HA SER 18 2.990 13.046 6.195
116 1HB SER 18 2HB SER 18 0.922 14.256 7.078
117 2HB SER 18 1HB SER 18 1.473 13.806 8.693
118 HG SER 18 HG SER 18 3.115 15.182 6.842
119 H GLY 19 H GLY 19 4.504 13.941 8.059
120 1HA GLY 19 2HA GLY 19 6.059 13.484 9.695
121 2HA GLY 19 1HA GLY 19 5.001 12.202 10.263
122 H GLY 20 H GLY 20 7.508 13.012 7.919
123 1HA GLY 20 2HA GLY 20 8.994 11.705 6.758
124 2HA GLY 20 1HA GLY 20 9.017 10.746 8.234
125 H GLU 21 H GLU 21 6.097 11.100 6.368
126 HA GLU 21 HA GLU 21 6.412 8.326 5.422
127 1HB GLU 21 2HB GLU 21 4.668 8.972 7.318
128 2HB GLU 21 1HB GLU 21 3.694 9.449 5.926
129 1HG GLU 21 2HG GLU 21 3.143 7.347 5.531
130 2HG GLU 21 1HG GLU 21 4.838 6.869 5.457
131 H ASN 22 H ASN 22 7.014 8.729 3.341
132 HA ASN 22 HA ASN 22 5.084 10.225 1.691
133 1HB ASN 22 2HB ASN 22 8.037 9.981 1.105
134 2HB ASN 22 1HB ASN 22 6.864 11.018 0.298
135 1HD2 ASN 22 1HD2 ASN 22 6.564 13.016 1.037
136 2HD2 ASN 22 2HD2 ASN 22 7.239 13.649 2.495
137 H ASN 23 H ASN 23 5.263 7.336 2.371
138 HA ASN 23 HA ASN 23 5.218 6.339 -0.378
139 1HB ASN 23 2HB ASN 23 6.827 5.170 1.889
140 2HB ASN 23 1HB ASN 23 6.357 4.217 0.479
141 1HD2 ASN 23 1HD2 ASN 23 9.007 4.881 1.369
142 2HD2 ASN 23 2HD2 ASN 23 9.758 5.779 0.085
143 H CYS 24 H CYS 24 3.806 4.614 -0.727
144 HA CYS 24 HA CYS 24 2.090 3.908 1.563
145 1HB CYS 24 2HB CYS 24 1.082 4.063 -1.271
146 2HB CYS 24 1HB CYS 24 0.152 4.021 0.228
147 H TYR 25 H TYR 25 2.246 1.835 2.040
148 HA TYR 25 HA TYR 25 3.315 -0.028 0.164
149 1HB TYR 25 2HB TYR 25 3.523 -1.516 2.017
150 2HB TYR 25 1HB TYR 25 4.019 0.082 2.563
151 HD1 TYR 25 1HD TYR 25 1.542 -2.585 2.892
152 HD2 TYR 25 2HD TYR 25 2.609 1.353 4.110
153 HE1 TYR 25 1HE TYR 25 -0.075 -2.721 4.739
154 HE2 TYR 25 2HE TYR 25 0.995 1.224 5.961
155 HH TYR 25 HH TYR 25 -1.332 -1.291 6.199
156 H LYS 26 H LYS 26 2.189 -1.439 -1.024
157 HA LYS 26 HA LYS 26 -0.640 -1.888 -0.331
158 1HB LYS 26 2HB LYS 26 0.041 -0.750 -2.583
159 2HB LYS 26 1HB LYS 26 0.507 -2.379 -3.068
160 1HG LYS 26 2HG LYS 26 -1.848 -3.076 -2.404
161 2HG LYS 26 1HG LYS 26 -2.220 -1.353 -2.353
162 1HD LYS 26 2HD LYS 26 -0.878 -1.748 -4.774
163 2HD LYS 26 1HD LYS 26 -1.983 -3.116 -4.625
164 1HE LYS 26 2HE LYS 26 -3.819 -1.824 -4.845
165 2HE LYS 26 1HE LYS 26 -3.118 -0.493 -3.925
166 1HZ LYS 26 1HZ LYS 26 -2.672 -1.146 -6.782
167 2HZ LYS 26 2HZ LYS 26 -1.721 -0.035 -5.933
168 3HZ LYS 26 3HZ LYS 26 -3.376 0.251 -6.137
169 H LYS 27 H LYS 27 -0.875 -3.837 0.615
170 HA LYS 27 HA LYS 27 0.787 -6.038 -0.394
171 1HB LYS 27 2HB LYS 27 0.509 -6.912 1.998
172 2HB LYS 27 1HB LYS 27 1.657 -5.617 1.726
173 1HG LYS 27 2HG LYS 27 0.150 -4.009 2.629
174 2HG LYS 27 1HG LYS 27 -1.162 -5.188 2.678
175 1HD LYS 27 2HD LYS 27 1.399 -5.554 4.214
176 2HD LYS 27 1HD LYS 27 0.009 -4.693 4.879
177 1HE LYS 27 2HE LYS 27 -1.339 -6.613 4.839
178 2HE LYS 27 1HE LYS 27 -0.241 -7.463 3.753
179 1HZ LYS 27 1HZ LYS 27 -0.045 -8.305 5.993
180 2HZ LYS 27 2HZ LYS 27 0.306 -6.761 6.587
181 3HZ LYS 27 3HZ LYS 27 1.394 -7.534 5.548
182 H GLU 28 H GLU 28 -0.381 -7.532 -1.361
183 HA GLU 28 HA GLU 28 -3.040 -8.162 -0.296
184 1HB GLU 28 2HB GLU 28 -3.198 -9.018 -2.876
185 2HB GLU 28 1HB GLU 28 -3.824 -7.490 -2.282
186 1HG GLU 28 2HG GLU 28 -2.286 -6.276 -3.373
187 2HG GLU 28 1HG GLU 28 -1.013 -7.463 -3.121
188 H TRP 29 H TRP 29 -3.748 -10.404 -0.959
189 HA TRP 29 HA TRP 29 -1.561 -12.326 -1.283
190 1HB TRP 29 2HB TRP 29 -2.501 -13.657 0.673
191 2HB TRP 29 1HB TRP 29 -1.622 -12.201 1.111
192 HD1 TRP 29 HD TRP 29 -4.839 -13.910 1.554
193 HE1 TRP 29 1HE TRP 29 -6.478 -12.442 2.899
194 HE3 TRP 29 3HE TRP 29 -2.250 -9.530 1.415
195 HZ2 TRP 29 2HZ TRP 29 -6.632 -9.762 3.784
196 HZ3 TRP 29 3HZ TRP 29 -3.198 -7.557 2.534
197 HH2 TRP 29 HH TRP 29 -5.346 -7.672 3.695
198 H ARG 30 H ARG 30 -2.226 -14.002 -2.540
199 HA ARG 30 HA ARG 30 -5.109 -14.239 -3.044
200 1HB ARG 30 2HB ARG 30 -4.078 -15.667 -5.056
201 2HB ARG 30 1HB ARG 30 -4.318 -13.926 -5.155
202 1HG ARG 30 2HG ARG 30 -2.150 -14.459 -6.009
203 2HG ARG 30 1HG ARG 30 -1.952 -13.621 -4.469
204 1HD ARG 30 2HD ARG 30 -0.457 -15.596 -4.761
205 2HD ARG 30 1HD ARG 30 -1.487 -15.671 -3.332
206 HE ARG 30 HE ARG 30 -2.532 -17.504 -4.221
207 1HH1 ARG 30 1HH1 ARG 30 -0.699 -15.919 -6.732
208 2HH1 ARG 30 2HH1 ARG 30 -0.941 -17.188 -7.885
209 1HH2 ARG 30 1HH2 ARG 30 -2.854 -19.175 -5.736
210 2HH2 ARG 30 2HH2 ARG 30 -2.165 -19.036 -7.320
211 H ASP 31 H ASP 31 -6.038 -16.347 -3.264
212 HA ASP 31 HA ASP 31 -4.505 -18.641 -2.419
213 1HB ASP 31 2HB ASP 31 -5.958 -19.130 -0.460
214 2HB ASP 31 1HB ASP 31 -4.970 -17.681 -0.249
215 H ASN 32 H ASN 32 -5.173 -20.246 -3.639
216 HA ASN 32 HA ASN 32 -6.471 -21.666 -4.833
217 1HB ASN 32 2HB ASN 32 -7.940 -21.068 -2.530
218 2HB ASN 32 1HB ASN 32 -9.091 -20.919 -3.852
219 1HD2 ASN 32 1HD2 ASN 32 -9.976 -22.703 -4.631
220 2HD2 ASN 32 2HD2 ASN 32 -9.449 -24.315 -4.296
221 H ARG 33 H ARG 33 -8.918 -19.106 -4.454
222 HA ARG 33 HA ARG 33 -8.743 -18.648 -7.356
223 1HB ARG 33 2HB ARG 33 -11.361 -18.107 -6.799
224 2HB ARG 33 1HB ARG 33 -10.767 -19.627 -7.466
225 1HG ARG 33 2HG ARG 33 -10.575 -20.469 -5.111
226 2HG ARG 33 1HG ARG 33 -11.408 -19.003 -4.591
227 1HD ARG 33 2HD ARG 33 -13.252 -19.634 -6.197
228 2HD ARG 33 1HD ARG 33 -12.449 -21.194 -6.372
229 HE ARG 33 HE ARG 33 -13.014 -20.428 -3.647
230 1HH1 ARG 33 1HH1 ARG 33 -14.197 -22.074 -6.491
231 2HH1 ARG 33 2HH1 ARG 33 -15.308 -23.065 -5.606
232 1HH2 ARG 33 1HH2 ARG 33 -14.474 -21.731 -2.485
233 2HH2 ARG 33 2HH2 ARG 33 -15.465 -22.870 -3.333
234 H GLY 34 H GLY 34 -10.515 -17.227 -4.598
235 1HA GLY 34 2HA GLY 34 -10.173 -14.581 -5.682
236 2HA GLY 34 1HA GLY 34 -10.981 -14.998 -4.180
237 H TYR 35 H TYR 35 -9.468 -12.775 -4.236
238 HA TYR 35 HA TYR 35 -7.369 -13.447 -2.346
239 1HB TYR 35 2HB TYR 35 -5.688 -12.052 -3.499
240 2HB TYR 35 1HB TYR 35 -6.160 -13.448 -4.461
241 HD1 TYR 35 1HD TYR 35 -6.706 -13.140 -6.684
242 HD2 TYR 35 2HD TYR 35 -7.007 -9.837 -4.019
243 HE1 TYR 35 1HE TYR 35 -7.228 -11.667 -8.580
244 HE2 TYR 35 2HE TYR 35 -7.534 -8.354 -5.909
245 HH TYR 35 HH TYR 35 -8.400 -9.489 -8.952
246 H ARG 36 H ARG 36 -6.386 -11.372 -1.435
247 HA ARG 36 HA ARG 36 -8.427 -9.248 -1.322
248 1HB ARG 36 2HB ARG 36 -6.975 -10.613 0.932
249 2HB ARG 36 1HB ARG 36 -7.633 -8.987 1.122
250 1HG ARG 36 2HG ARG 36 -9.802 -9.706 1.053
251 2HG ARG 36 1HG ARG 36 -9.415 -11.130 0.084
252 1HD ARG 36 2HD ARG 36 -8.243 -12.065 2.089
253 2HD ARG 36 1HD ARG 36 -8.880 -10.709 3.019
254 HE ARG 36 HE ARG 36 -10.936 -11.723 3.033
255 1HH1 ARG 36 1HH1 ARG 36 -8.910 -13.292 0.665
256 2HH1 ARG 36 2HH1 ARG 36 -10.025 -14.586 0.385
257 1HH2 ARG 36 1HH2 ARG 36 -12.405 -13.425 2.665
258 2HH2 ARG 36 2HH2 ARG 36 -12.009 -14.661 1.519
259 H THR 37 H THR 37 -7.553 -7.147 -0.507
260 HA THR 37 HA THR 37 -4.693 -6.770 -0.719
261 HB THR 37 HB THR 37 -5.511 -6.749 -3.083
262 HG1 THR 37 1HG THR 37 -3.697 -5.442 -2.236
263 1HG2 THR 37 1HG2 THR 37 -6.604 -4.047 -2.844
264 2HG2 THR 37 2HG2 THR 37 -7.640 -5.325 -2.208
265 3HG2 THR 37 3HG2 THR 37 -7.089 -5.387 -3.883
266 H GLU 38 H GLU 38 -4.067 -5.249 0.660
267 HA GLU 38 HA GLU 38 -6.024 -3.209 1.476
268 1HB GLU 38 2HB GLU 38 -4.360 -3.316 3.606
269 2HB GLU 38 1HB GLU 38 -5.866 -4.212 3.493
270 1HG GLU 38 2HG GLU 38 -4.624 -6.161 2.675
271 2HG GLU 38 1HG GLU 38 -3.121 -5.255 2.835
272 H ARG 39 H ARG 39 -5.238 -1.133 1.908
273 HA ARG 39 HA ARG 39 -2.501 -0.606 0.951
274 1HB ARG 39 2HB ARG 39 -4.720 1.381 0.588
275 2HB ARG 39 1HB ARG 39 -3.197 1.252 -0.279
276 1HG ARG 39 2HG ARG 39 -4.282 0.214 -1.903
277 2HG ARG 39 1HG ARG 39 -4.542 -1.138 -0.800
278 1HD ARG 39 2HD ARG 39 -6.541 0.330 0.040
279 2HD ARG 39 1HD ARG 39 -6.380 1.094 -1.540
280 HE ARG 39 HE ARG 39 -7.374 -1.552 -0.977
281 1HH1 ARG 39 1HH1 ARG 39 -5.998 0.551 -3.401
282 2HH1 ARG 39 2HH1 ARG 39 -6.648 -0.351 -4.729
283 1HH2 ARG 39 1HH2 ARG 39 -8.229 -2.736 -2.723
284 2HH2 ARG 39 2HH2 ARG 39 -7.915 -2.216 -4.345
285 H GLY 40 H GLY 40 -1.340 1.021 1.987
286 1HA GLY 40 2HA GLY 40 -2.563 2.577 4.098
287 2HA GLY 40 1HA GLY 40 -1.476 1.312 4.672
288 H CYS 41 H CYS 41 -0.242 3.091 5.582
289 HA CYS 41 HA CYS 41 1.538 4.303 3.574
290 1HB CYS 41 2HB CYS 41 -0.036 5.577 5.691
291 2HB CYS 41 1HB CYS 41 1.672 6.021 5.727
292 H GLY 42 H GLY 42 3.619 3.818 3.827
293 1HA GLY 42 2HA GLY 42 5.600 3.653 5.162
294 2HA GLY 42 1HA GLY 42 4.603 3.141 6.515
295 H CYS 43 H CYS 43 6.484 2.147 3.848
296 HA CYS 43 HA CYS 43 5.468 -0.553 3.764
297 1HB CYS 43 2HB CYS 43 6.376 0.574 1.747
298 2HB CYS 43 1HB CYS 43 7.965 0.596 2.504
299 HA PRO 44 HA PRO 44 8.104 -1.592 7.292
300 1HB PRO 44 2HB PRO 44 7.143 -4.114 7.613
301 2HB PRO 44 1HB PRO 44 6.299 -2.677 8.212
302 1HG PRO 44 2HG PRO 44 5.817 -4.255 5.711
303 2HG PRO 44 1HG PRO 44 4.640 -3.598 6.865
304 1HD PRO 44 2HD PRO 44 5.194 -2.382 4.515
305 2HD PRO 44 1HD PRO 44 4.767 -1.472 5.978
306 H SER 45 H SER 45 9.524 -3.552 7.768
307 HA SER 45 HA SER 45 10.788 -4.416 5.257
308 1HB SER 45 2HB SER 45 12.234 -4.633 7.853
309 2HB SER 45 1HB SER 45 12.853 -4.237 6.250
310 HG SER 45 HG SER 45 12.900 -2.341 7.300
311 H VAL 46 H VAL 46 8.615 -5.869 5.944
312 HA VAL 46 HA VAL 46 9.545 -8.229 7.390
313 HB VAL 46 HB VAL 46 7.106 -8.964 6.915
314 1HG1 VAL 46 1HG1 VAL 46 8.158 -8.188 9.095
315 2HG1 VAL 46 2HG1 VAL 46 6.405 -8.047 8.962
316 3HG1 VAL 46 3HG1 VAL 46 7.423 -6.620 8.762
317 1HG2 VAL 46 1HG2 VAL 46 6.845 -6.989 5.280
318 2HG2 VAL 46 2HG2 VAL 46 6.607 -6.020 6.733
319 3HG2 VAL 46 3HG2 VAL 46 5.515 -7.358 6.378
320 H LYS 47 H LYS 47 9.666 -10.259 6.478
321 HA LYS 47 HA LYS 47 10.089 -10.317 3.621
322 1HB LYS 47 2HB LYS 47 10.860 -12.615 3.999
323 2HB LYS 47 1HB LYS 47 11.643 -11.488 5.098
324 1HG LYS 47 2HG LYS 47 9.459 -12.302 6.539
325 2HG LYS 47 1HG LYS 47 9.919 -13.764 5.664
326 1HD LYS 47 2HD LYS 47 12.329 -13.117 6.459
327 2HD LYS 47 1HD LYS 47 11.456 -12.194 7.685
328 1HE LYS 47 2HE LYS 47 10.420 -14.133 8.545
329 2HE LYS 47 1HE LYS 47 10.892 -15.098 7.146
330 1HZ LYS 47 1HZ LYS 47 12.429 -15.749 8.690
331 2HZ LYS 47 2HZ LYS 47 12.511 -14.235 9.439
332 3HZ LYS 47 3HZ LYS 47 13.275 -14.484 7.951
333 H LYS 48 H LYS 48 7.739 -9.790 3.272
334 HA LYS 48 HA LYS 48 6.260 -12.300 2.935
335 1HB LYS 48 2HB LYS 48 5.574 -10.579 4.912
336 2HB LYS 48 1HB LYS 48 4.617 -9.932 3.586
337 1HG LYS 48 2HG LYS 48 3.135 -11.422 4.460
338 2HG LYS 48 1HG LYS 48 3.942 -12.455 3.280
339 1HD LYS 48 2HD LYS 48 5.532 -12.704 5.514
340 2HD LYS 48 1HD LYS 48 3.905 -12.609 6.193
341 1HE LYS 48 2HE LYS 48 3.814 -14.808 5.775
342 2HE LYS 48 1HE LYS 48 3.540 -14.322 4.101
343 1HZ LYS 48 1HZ LYS 48 5.277 -15.804 3.929
344 2HZ LYS 48 2HZ LYS 48 6.017 -15.295 5.363
345 3HZ LYS 48 3HZ LYS 48 6.100 -14.326 3.978
346 H GLY 49 H GLY 49 5.188 -12.492 1.032
347 1HA GLY 49 2HA GLY 49 4.640 -10.151 -0.598
348 2HA GLY 49 1HA GLY 49 5.866 -11.242 -1.241
349 H ILE 50 H ILE 50 2.535 -11.254 0.025
350 HA ILE 50 HA ILE 50 1.894 -13.657 -1.438
351 HB ILE 50 HB ILE 50 -0.175 -12.027 -0.105
352 1HG1 ILE 50 2HG1 ILE 50 0.787 -13.658 1.918
353 2HG1 ILE 50 1HG1 ILE 50 2.250 -12.981 1.207
354 1HG2 ILE 50 1HG2 ILE 50 -0.968 -14.033 -1.049
355 2HG2 ILE 50 2HG2 ILE 50 -0.776 -14.404 0.663
356 3HG2 ILE 50 3HG2 ILE 50 0.436 -14.941 -0.496
357 1HD1 ILE 50 1HD1 ILE 50 1.918 -11.123 2.349
358 2HD1 ILE 50 2HD1 ILE 50 0.420 -11.779 3.011
359 3HD1 ILE 50 3HD1 ILE 50 0.393 -10.873 1.499
360 H GLY 51 H GLY 51 1.496 -10.220 -1.770
361 1HA GLY 51 2HA GLY 51 0.754 -10.499 -4.519
362 2HA GLY 51 1HA GLY 51 -0.600 -9.981 -3.525
363 H ILE 52 H ILE 52 1.138 -8.676 -5.672
364 HA ILE 52 HA ILE 52 2.176 -6.687 -6.103
365 HB ILE 52 HB ILE 52 -0.358 -6.285 -5.292
366 1HG1 ILE 52 2HG1 ILE 52 -0.129 -4.009 -6.209
367 2HG1 ILE 52 1HG1 ILE 52 1.624 -4.145 -6.092
368 1HG2 ILE 52 1HG2 ILE 52 -0.641 -4.723 -3.635
369 2HG2 ILE 52 2HG2 ILE 52 1.027 -4.159 -3.731
370 3HG2 ILE 52 3HG2 ILE 52 0.663 -5.710 -2.976
371 1HD1 ILE 52 1HD1 ILE 52 1.771 -5.523 -7.887
372 2HD1 ILE 52 2HD1 ILE 52 0.318 -4.628 -8.333
373 3HD1 ILE 52 3HD1 ILE 52 0.180 -6.233 -7.616
374 H ASN 53 H ASN 53 2.735 -4.412 -4.714
375 HA ASN 53 HA ASN 53 4.163 -5.122 -2.280
376 1HB ASN 53 2HB ASN 53 5.470 -5.203 -4.749
377 2HB ASN 53 1HB ASN 53 5.954 -3.663 -4.032
378 1HD2 ASN 53 1HD2 ASN 53 6.608 -6.910 -4.201
379 2HD2 ASN 53 2HD2 ASN 53 7.603 -7.063 -2.797
380 H CYS 54 H CYS 54 5.812 -2.871 -2.202
381 HA CYS 54 HA CYS 54 3.842 -0.837 -1.546
382 1HB CYS 54 2HB CYS 54 6.818 -0.704 -1.074
383 2HB CYS 54 1HB CYS 54 5.551 0.215 -0.259
384 H CYS 55 H CYS 55 4.177 1.415 -2.116
385 HA CYS 55 HA CYS 55 5.740 1.837 -4.563
386 1HB CYS 55 2HB CYS 55 3.770 3.280 -5.369
387 2HB CYS 55 1HB CYS 55 3.601 1.527 -5.492
388 H THR 56 H THR 56 5.715 4.291 -5.111
389 HA THR 56 HA THR 56 5.720 5.906 -2.664
390 HB THR 56 HB THR 56 8.005 5.200 -2.870
391 HG1 THR 56 1HG THR 56 7.618 7.450 -2.438
392 1HG2 THR 56 1HG2 THR 56 8.586 6.451 -5.439
393 2HG2 THR 56 2HG2 THR 56 7.603 4.991 -5.552
394 3HG2 THR 56 3HG2 THR 56 9.172 4.938 -4.748
395 H THR 57 H THR 57 3.673 6.303 -4.150
396 HA THR 57 HA THR 57 4.144 8.875 -5.393
397 HB THR 57 HB THR 57 2.509 7.821 -7.303
398 HG1 THR 57 1HG THR 57 3.192 5.823 -7.833
399 1HG2 THR 57 1HG2 THR 57 4.098 8.491 -8.695
400 2HG2 THR 57 2HG2 THR 57 5.281 7.377 -8.011
401 3HG2 THR 57 3HG2 THR 57 5.012 8.949 -7.258
402 H ASP 58 H ASP 58 2.217 10.116 -5.683
403 HA ASP 58 HA ASP 58 0.351 9.867 -3.633
404 1HB ASP 58 2HB ASP 58 -0.973 11.543 -5.033
405 2HB ASP 58 1HB ASP 58 0.653 12.016 -4.562
406 H ARG 59 H ARG 59 -1.380 8.618 -3.384
407 HA ARG 59 HA ARG 59 -3.042 7.119 -3.801
408 1HB ARG 59 2HB ARG 59 -3.170 8.694 -6.378
409 2HB ARG 59 1HB ARG 59 -4.367 7.500 -5.894
410 1HG ARG 59 2HG ARG 59 -4.260 9.109 -3.692
411 2HG ARG 59 1HG ARG 59 -3.995 10.260 -5.010
412 1HD ARG 59 2HD ARG 59 -6.019 8.981 -6.097
413 2HD ARG 59 1HD ARG 59 -6.366 8.545 -4.419
414 HE ARG 59 HE ARG 59 -7.007 10.710 -4.022
415 1HH1 ARG 59 1HH1 ARG 59 -5.297 10.573 -7.062
416 2HH1 ARG 59 2HH1 ARG 59 -5.695 12.199 -7.501
417 1HH2 ARG 59 1HH2 ARG 59 -7.532 12.850 -4.600
418 2HH2 ARG 59 2HH2 ARG 59 -6.963 13.492 -6.105
419 H CYS 60 H CYS 60 -0.264 6.484 -4.594
420 HA CYS 60 HA CYS 60 -0.218 5.036 -7.002
421 1HB CYS 60 2HB CYS 60 1.852 4.094 -6.177
422 2HB CYS 60 1HB CYS 60 1.789 5.807 -5.770
423 H ASN 61 H ASN 61 -1.546 4.305 -3.907
424 HA ASN 61 HA ASN 61 -1.758 1.459 -4.595
425 1HB ASN 61 2HB ASN 61 -2.400 1.131 -2.229
426 2HB ASN 61 1HB ASN 61 -0.818 1.900 -2.390
427 1HD2 ASN 61 1HD2 ASN 61 -1.325 2.437 -0.120
428 2HD2 ASN 61 2HD2 ASN 61 -2.207 3.900 0.189
429 H ASN 62 H ASN 62 -3.356 2.428 -6.245
430 HA ASN 62 HA ASN 62 -6.015 2.721 -5.020
431 1HB ASN 62 2HB ASN 62 -5.194 4.571 -6.512
432 2HB ASN 62 1HB ASN 62 -5.208 3.419 -7.851
433 1HD2 ASN 62 1HD2 ASN 62 -6.666 5.298 -8.543
434 2HD2 ASN 62 2HD2 ASN 62 -8.361 5.081 -8.236
Start of MODEL 15
1 1H LEU 1 1HT LEU 1 2.245 14.995 0.631
2 2H LEU 1 2HT LEU 1 1.187 14.319 1.801
3 3H LEU 1 3HT LEU 1 0.560 15.289 0.530
4 HA LEU 1 HA LEU 1 0.980 13.708 -1.059
5 1HB LEU 1 2HB LEU 1 3.256 13.250 0.121
6 2HB LEU 1 1HB LEU 1 2.381 11.975 0.949
7 HG LEU 1 HG LEU 1 2.106 11.984 -1.990
8 1HD1 LEU 1 1HD1 LEU 1 4.487 12.628 -1.638
9 2HD1 LEU 1 2HD1 LEU 1 4.268 11.070 -2.435
10 3HD1 LEU 1 3HD1 LEU 1 4.704 11.133 -0.727
11 1HD2 LEU 1 1HD2 LEU 1 3.007 9.640 -0.425
12 2HD2 LEU 1 2HD2 LEU 1 1.794 9.759 -1.701
13 3HD2 LEU 1 3HD2 LEU 1 1.402 10.276 -0.061
14 H GLU 2 H GLU 2 -0.680 12.371 -1.476
15 HA GLU 2 HA GLU 2 -2.106 11.207 0.826
16 1HB GLU 2 2HB GLU 2 -3.351 12.012 -1.804
17 2HB GLU 2 1HB GLU 2 -4.182 11.529 -0.331
18 1HG GLU 2 2HG GLU 2 -2.411 13.829 0.009
19 2HG GLU 2 1HG GLU 2 -3.736 14.095 -1.131
20 H CYS 3 H CYS 3 -3.410 9.260 0.282
21 HA CYS 3 HA CYS 3 -2.590 7.735 -2.032
22 1HB CYS 3 2HB CYS 3 -1.421 7.295 0.626
23 2HB CYS 3 1HB CYS 3 -2.090 5.844 -0.122
24 H HIS 4 H HIS 4 -3.830 5.804 -2.331
25 HA HIS 4 HA HIS 4 -6.499 6.044 -1.303
26 1HB HIS 4 2HB HIS 4 -5.228 4.043 -3.183
27 2HB HIS 4 1HB HIS 4 -6.948 4.127 -2.816
28 HD1 HIS 4 1HD HIS 4 -8.286 6.106 -3.829
29 HD2 HIS 4 2HD HIS 4 -4.284 5.991 -4.942
30 HE1 HIS 4 1HE HIS 4 -8.077 7.713 -5.753
31 HE2 HIS 4 2HE HIS 4 -5.666 7.559 -6.467
32 H ASN 5 H ASN 5 -7.641 4.437 -0.151
33 HA ASN 5 HA ASN 5 -5.953 2.465 1.239
34 1HB ASN 5 2HB ASN 5 -7.380 2.844 3.263
35 2HB ASN 5 1HB ASN 5 -6.403 4.239 2.810
36 1HD2 ASN 5 1HD2 ASN 5 -8.225 4.922 4.384
37 2HD2 ASN 5 2HD2 ASN 5 -9.600 5.621 3.601
38 H GLN 6 H GLN 6 -8.312 2.721 -0.950
39 HA GLN 6 HA GLN 6 -10.241 0.868 0.084
40 1HB GLN 6 2HB GLN 6 -10.729 2.637 -1.637
41 2HB GLN 6 1HB GLN 6 -9.806 1.677 -2.793
42 1HG GLN 6 2HG GLN 6 -11.946 0.253 -1.359
43 2HG GLN 6 1HG GLN 6 -12.467 1.505 -2.483
44 1HE2 GLN 6 1HE2 GLN 6 -13.384 -0.009 -3.867
45 2HE2 GLN 6 2HE2 GLN 6 -12.423 -1.031 -4.875
46 H GLN 7 H GLN 7 -10.731 -1.189 -0.972
47 HA GLN 7 HA GLN 7 -8.555 -2.516 -2.356
48 1HB GLN 7 2HB GLN 7 -8.689 -4.448 -0.691
49 2HB GLN 7 1HB GLN 7 -7.831 -3.000 -0.165
50 1HG GLN 7 2HG GLN 7 -9.207 -2.701 1.544
51 2HG GLN 7 1HG GLN 7 -10.633 -2.872 0.520
52 1HE2 GLN 7 1HE2 GLN 7 -10.398 -5.431 -0.370
53 2HE2 GLN 7 2HE2 GLN 7 -10.516 -6.534 0.955
54 H SER 8 H SER 8 -9.360 -5.061 -2.405
55 HA SER 8 HA SER 8 -11.685 -4.972 -4.040
56 1HB SER 8 2HB SER 8 -11.319 -7.293 -4.427
57 2HB SER 8 1HB SER 8 -9.717 -6.572 -4.274
58 HG SER 8 HG SER 8 -11.142 -8.086 -2.353
59 H SER 9 H SER 9 -12.887 -3.928 -2.099
60 HA SER 9 HA SER 9 -15.000 -5.501 -1.346
61 1HB SER 9 2HB SER 9 -12.676 -5.801 0.474
62 2HB SER 9 1HB SER 9 -14.244 -5.562 1.247
63 HG SER 9 HG SER 9 -13.256 -7.764 0.061
64 H GLN 10 H GLN 10 -12.945 -3.356 0.629
65 HA GLN 10 HA GLN 10 -15.079 -1.805 1.594
66 1HB GLN 10 2HB GLN 10 -12.105 -1.365 1.450
67 2HB GLN 10 1HB GLN 10 -13.188 -0.159 2.140
68 1HG GLN 10 2HG GLN 10 -14.025 -1.993 3.672
69 2HG GLN 10 1HG GLN 10 -12.649 -2.944 3.115
70 1HE2 GLN 10 1HE2 GLN 10 -10.679 -2.569 3.948
71 2HE2 GLN 10 2HE2 GLN 10 -10.331 -1.349 5.135
72 H THR 11 H THR 11 -15.603 0.399 1.145
73 HA THR 11 HA THR 11 -15.879 0.958 -1.593
74 HB THR 11 HB THR 11 -16.498 3.324 -0.457
75 HG1 THR 11 1HG THR 11 -15.879 2.744 1.610
76 1HG2 THR 11 1HG2 THR 11 -18.474 2.673 -1.191
77 2HG2 THR 11 2HG2 THR 11 -18.662 1.693 0.264
78 3HG2 THR 11 3HG2 THR 11 -17.958 0.987 -1.191
79 HA PRO 12 HA PRO 12 -12.327 3.401 -2.537
80 1HB PRO 12 2HB PRO 12 -13.303 5.408 -4.056
81 2HB PRO 12 1HB PRO 12 -13.246 3.735 -4.623
82 1HG PRO 12 2HG PRO 12 -15.552 5.273 -3.487
83 2HG PRO 12 1HG PRO 12 -15.515 4.180 -4.886
84 1HD PRO 12 2HD PRO 12 -16.427 3.420 -2.441
85 2HD PRO 12 1HD PRO 12 -15.648 2.293 -3.575
86 H THR 13 H THR 13 -11.144 4.740 -1.334
87 HA THR 13 HA THR 13 -12.139 7.320 -0.525
88 HB THR 13 HB THR 13 -11.415 6.698 1.938
89 HG1 THR 13 1HG THR 13 -12.057 4.561 2.425
90 1HG2 THR 13 1HG2 THR 13 -13.564 6.869 2.503
91 2HG2 THR 13 2HG2 THR 13 -14.048 5.527 1.465
92 3HG2 THR 13 3HG2 THR 13 -13.829 7.138 0.780
93 H THR 14 H THR 14 -10.473 8.623 0.545
94 HA THR 14 HA THR 14 -7.753 7.650 -0.038
95 HB THR 14 HB THR 14 -7.223 10.097 -0.513
96 HG1 THR 14 1HG THR 14 -9.004 11.369 -1.104
97 1HG2 THR 14 1HG2 THR 14 -9.192 9.339 -2.563
98 2HG2 THR 14 2HG2 THR 14 -7.914 8.169 -2.234
99 3HG2 THR 14 3HG2 THR 14 -7.501 9.811 -2.724
100 H THR 15 H THR 15 -6.269 7.884 1.533
101 HA THR 15 HA THR 15 -6.999 9.503 3.884
102 HB THR 15 HB THR 15 -7.262 7.166 4.456
103 HG1 THR 15 1HG THR 15 -5.913 7.133 6.207
104 1HG2 THR 15 1HG2 THR 15 -5.598 6.374 2.667
105 2HG2 THR 15 2HG2 THR 15 -5.688 5.494 4.193
106 3HG2 THR 15 3HG2 THR 15 -4.374 6.636 3.909
107 H GLY 16 H GLY 16 -5.726 11.261 3.467
108 1HA GLY 16 2HA GLY 16 -3.029 10.992 2.586
109 2HA GLY 16 1HA GLY 16 -3.837 12.487 3.004
110 H CYS 17 H CYS 17 -1.143 11.441 3.707
111 HA CYS 17 HA CYS 17 -1.399 11.743 6.622
112 1HB CYS 17 2HB CYS 17 0.709 10.006 5.344
113 2HB CYS 17 1HB CYS 17 0.244 10.087 7.045
114 H SER 18 H SER 18 0.622 12.513 7.659
115 HA SER 18 HA SER 18 2.414 13.981 5.874
116 1HB SER 18 2HB SER 18 0.367 15.377 6.785
117 2HB SER 18 1HB SER 18 1.343 15.446 8.253
118 HG SER 18 HG SER 18 2.060 16.334 5.657
119 H GLY 19 H GLY 19 4.371 14.726 6.932
120 1HA GLY 19 2HA GLY 19 5.855 14.769 8.802
121 2HA GLY 19 1HA GLY 19 4.907 13.486 9.541
122 H GLY 20 H GLY 20 6.931 12.394 9.911
123 1HA GLY 20 2HA GLY 20 8.818 11.671 8.056
124 2HA GLY 20 1HA GLY 20 8.372 10.674 9.435
125 H GLU 21 H GLU 21 5.577 10.450 8.361
126 HA GLU 21 HA GLU 21 6.052 8.103 6.762
127 1HB GLU 21 2HB GLU 21 4.216 8.533 8.579
128 2HB GLU 21 1HB GLU 21 3.326 9.253 7.237
129 1HG GLU 21 2HG GLU 21 3.062 7.252 6.157
130 2HG GLU 21 1HG GLU 21 4.494 6.537 6.898
131 H ASN 22 H ASN 22 6.654 8.469 4.709
132 HA ASN 22 HA ASN 22 4.853 10.098 3.051
133 1HB ASN 22 2HB ASN 22 7.350 10.959 3.700
134 2HB ASN 22 1HB ASN 22 7.686 10.063 2.222
135 1HD2 ASN 22 1HD2 ASN 22 8.062 12.787 2.411
136 2HD2 ASN 22 2HD2 ASN 22 6.920 13.592 1.395
137 H ASN 23 H ASN 23 5.177 7.171 3.563
138 HA ASN 23 HA ASN 23 5.468 6.369 0.754
139 1HB ASN 23 2HB ASN 23 6.598 4.900 3.146
140 2HB ASN 23 1HB ASN 23 6.550 4.257 1.501
141 1HD2 ASN 23 1HD2 ASN 23 7.867 5.187 -0.086
142 2HD2 ASN 23 2HD2 ASN 23 9.254 6.144 0.334
143 H CYS 24 H CYS 24 4.123 4.691 0.080
144 HA CYS 24 HA CYS 24 2.029 3.926 2.007
145 1HB CYS 24 2HB CYS 24 1.615 4.118 -0.973
146 2HB CYS 24 1HB CYS 24 0.394 4.022 0.300
147 H TYR 25 H TYR 25 2.087 1.851 2.505
148 HA TYR 25 HA TYR 25 3.549 -0.011 0.935
149 1HB TYR 25 2HB TYR 25 3.452 -1.431 2.760
150 2HB TYR 25 1HB TYR 25 3.377 0.156 3.519
151 HD1 TYR 25 1HD TYR 25 1.443 0.850 4.733
152 HD2 TYR 25 2HD TYR 25 1.397 -2.820 2.572
153 HE1 TYR 25 1HE TYR 25 -0.650 0.220 5.858
154 HE2 TYR 25 2HE TYR 25 -0.699 -3.454 3.691
155 HH TYR 25 HH TYR 25 -1.951 -2.945 5.686
156 H LYS 26 H LYS 26 2.786 -1.330 -0.585
157 HA LYS 26 HA LYS 26 -0.110 -1.893 -0.612
158 1HB LYS 26 2HB LYS 26 0.867 -0.424 -2.506
159 2HB LYS 26 1HB LYS 26 1.619 -1.911 -3.081
160 1HG LYS 26 2HG LYS 26 -0.864 -2.809 -2.849
161 2HG LYS 26 1HG LYS 26 -1.229 -1.098 -3.079
162 1HD LYS 26 2HD LYS 26 0.784 -2.167 -4.925
163 2HD LYS 26 1HD LYS 26 -0.816 -2.893 -5.091
164 1HE LYS 26 2HE LYS 26 -1.806 -0.680 -5.340
165 2HE LYS 26 1HE LYS 26 -0.222 0.064 -5.134
166 1HZ LYS 26 1HZ LYS 26 -0.977 -1.773 -7.342
167 2HZ LYS 26 2HZ LYS 26 0.522 -1.014 -7.152
168 3HZ LYS 26 3HZ LYS 26 -0.859 -0.090 -7.466
169 H LYS 27 H LYS 27 -0.442 -3.969 -0.047
170 HA LYS 27 HA LYS 27 1.464 -5.974 -1.029
171 1HB LYS 27 2HB LYS 27 0.742 -7.143 1.215
172 2HB LYS 27 1HB LYS 27 2.068 -6.000 1.179
173 1HG LYS 27 2HG LYS 27 0.425 -4.243 1.879
174 2HG LYS 27 1HG LYS 27 -0.753 -5.535 2.107
175 1HD LYS 27 2HD LYS 27 1.900 -5.261 3.518
176 2HD LYS 27 1HD LYS 27 0.307 -4.985 4.222
177 1HE LYS 27 2HE LYS 27 -0.205 -7.400 3.580
178 2HE LYS 27 1HE LYS 27 1.529 -7.575 3.315
179 1HZ LYS 27 1HZ LYS 27 0.913 -8.276 5.535
180 2HZ LYS 27 2HZ LYS 27 0.235 -6.762 5.862
181 3HZ LYS 27 3HZ LYS 27 1.902 -6.904 5.613
182 H GLU 28 H GLU 28 0.613 -7.780 -1.893
183 HA GLU 28 HA GLU 28 -2.303 -8.136 -1.723
184 1HB GLU 28 2HB GLU 28 -1.774 -9.375 -4.018
185 2HB GLU 28 1HB GLU 28 -2.121 -7.651 -3.950
186 1HG GLU 28 2HG GLU 28 0.382 -7.301 -3.815
187 2HG GLU 28 1HG GLU 28 0.546 -9.007 -4.223
188 H TRP 29 H TRP 29 -3.085 -10.240 -1.496
189 HA TRP 29 HA TRP 29 -1.179 -12.433 -1.385
190 1HB TRP 29 2HB TRP 29 -1.657 -13.084 0.862
191 2HB TRP 29 1HB TRP 29 -1.238 -11.378 0.907
192 HD1 TRP 29 HD TRP 29 -3.694 -13.688 2.199
193 HE1 TRP 29 1HE TRP 29 -5.769 -12.461 3.111
194 HE3 TRP 29 3HE TRP 29 -2.853 -9.085 0.163
195 HZ2 TRP 29 2HZ TRP 29 -6.892 -9.873 2.979
196 HZ3 TRP 29 3HZ TRP 29 -4.471 -7.287 0.601
197 HH2 TRP 29 HH TRP 29 -6.448 -7.671 1.981
198 H ARG 30 H ARG 30 -2.079 -14.437 -1.733
199 HA ARG 30 HA ARG 30 -4.936 -14.421 -2.433
200 1HB ARG 30 2HB ARG 30 -3.994 -16.692 -3.599
201 2HB ARG 30 1HB ARG 30 -4.119 -15.135 -4.409
202 1HG ARG 30 2HG ARG 30 -1.751 -14.689 -3.703
203 2HG ARG 30 1HG ARG 30 -1.675 -16.367 -3.161
204 1HD ARG 30 2HD ARG 30 -1.575 -17.176 -5.264
205 2HD ARG 30 1HD ARG 30 -2.699 -15.971 -5.891
206 HE ARG 30 HE ARG 30 0.173 -15.813 -5.848
207 1HH1 ARG 30 1HH1 ARG 30 -2.796 -13.983 -5.985
208 2HH1 ARG 30 2HH1 ARG 30 -2.062 -12.611 -6.743
209 1HH2 ARG 30 1HH2 ARG 30 1.141 -14.008 -6.844
210 2HH2 ARG 30 2HH2 ARG 30 0.174 -12.625 -7.232
211 H ASP 31 H ASP 31 -6.277 -16.091 -1.793
212 HA ASP 31 HA ASP 31 -5.296 -18.276 -0.205
213 1HB ASP 31 2HB ASP 31 -6.689 -17.623 1.810
214 2HB ASP 31 1HB ASP 31 -5.221 -16.674 1.555
215 H ASN 32 H ASN 32 -6.801 -19.907 0.065
216 HA ASN 32 HA ASN 32 -8.616 -21.179 -0.426
217 1HB ASN 32 2HB ASN 32 -9.718 -18.538 0.253
218 2HB ASN 32 1HB ASN 32 -10.793 -19.548 -0.710
219 1HD2 ASN 32 1HD2 ASN 32 -8.949 -19.368 2.264
220 2HD2 ASN 32 2HD2 ASN 32 -9.877 -20.540 3.132
221 H ARG 33 H ARG 33 -9.821 -18.347 -2.177
222 HA ARG 33 HA ARG 33 -9.384 -19.809 -4.693
223 1HB ARG 33 2HB ARG 33 -11.559 -18.248 -5.242
224 2HB ARG 33 1HB ARG 33 -11.627 -19.953 -4.799
225 1HG ARG 33 2HG ARG 33 -12.127 -19.425 -2.538
226 2HG ARG 33 1HG ARG 33 -11.784 -17.713 -2.797
227 1HD ARG 33 2HD ARG 33 -13.673 -17.673 -4.438
228 2HD ARG 33 1HD ARG 33 -14.065 -19.317 -3.937
229 HE ARG 33 HE ARG 33 -14.627 -16.896 -2.512
230 1HH1 ARG 33 1HH1 ARG 33 -14.031 -20.317 -2.165
231 2HH1 ARG 33 2HH1 ARG 33 -14.881 -20.439 -0.662
232 1HH2 ARG 33 1HH2 ARG 33 -15.746 -17.055 -0.535
233 2HH2 ARG 33 2HH2 ARG 33 -15.855 -18.589 0.264
234 H GLY 34 H GLY 34 -10.711 -16.582 -4.048
235 1HA GLY 34 2HA GLY 34 -8.985 -15.439 -6.053
236 2HA GLY 34 1HA GLY 34 -10.191 -14.585 -5.103
237 H TYR 35 H TYR 35 -8.662 -12.870 -4.868
238 HA TYR 35 HA TYR 35 -6.931 -13.278 -2.568
239 1HB TYR 35 2HB TYR 35 -5.108 -11.929 -3.807
240 2HB TYR 35 1HB TYR 35 -5.270 -13.643 -4.169
241 HD1 TYR 35 1HD TYR 35 -5.379 -14.315 -6.377
242 HD2 TYR 35 2HD TYR 35 -6.462 -10.322 -5.387
243 HE1 TYR 35 1HE TYR 35 -5.626 -13.797 -8.766
244 HE2 TYR 35 2HE TYR 35 -6.715 -9.792 -7.776
245 HH TYR 35 HH TYR 35 -5.491 -11.141 -10.099
246 H ARG 36 H ARG 36 -6.031 -11.166 -1.779
247 HA ARG 36 HA ARG 36 -7.788 -8.908 -2.456
248 1HB ARG 36 2HB ARG 36 -7.234 -10.109 0.236
249 2HB ARG 36 1HB ARG 36 -7.576 -8.384 0.101
250 1HG ARG 36 2HG ARG 36 -9.731 -8.820 -0.841
251 2HG ARG 36 1HG ARG 36 -9.385 -10.547 -0.951
252 1HD ARG 36 2HD ARG 36 -9.269 -9.148 1.690
253 2HD ARG 36 1HD ARG 36 -10.821 -9.648 1.019
254 HE ARG 36 HE ARG 36 -8.817 -11.334 2.173
255 1HH1 ARG 36 1HH1 ARG 36 -11.428 -11.221 -0.140
256 2HH1 ARG 36 2HH1 ARG 36 -11.742 -12.921 -0.057
257 1HH2 ARG 36 1HH2 ARG 36 -9.229 -13.570 2.284
258 2HH2 ARG 36 2HH2 ARG 36 -10.494 -14.256 1.321
259 H THR 37 H THR 37 -6.917 -6.807 -1.682
260 HA THR 37 HA THR 37 -4.025 -6.766 -1.277
261 HB THR 37 HB THR 37 -3.578 -5.301 -3.098
262 HG1 THR 37 1HG THR 37 -6.387 -5.204 -3.464
263 1HG2 THR 37 1HG2 THR 37 -3.890 -6.620 -4.947
264 2HG2 THR 37 2HG2 THR 37 -5.507 -7.123 -4.452
265 3HG2 THR 37 3HG2 THR 37 -4.089 -7.789 -3.641
266 H GLU 38 H GLU 38 -3.601 -5.447 0.362
267 HA GLU 38 HA GLU 38 -5.502 -3.284 0.940
268 1HB GLU 38 2HB GLU 38 -4.102 -3.385 3.198
269 2HB GLU 38 1HB GLU 38 -5.484 -4.428 2.912
270 1HG GLU 38 2HG GLU 38 -3.926 -6.198 2.161
271 2HG GLU 38 1HG GLU 38 -2.581 -5.145 2.595
272 H ARG 39 H ARG 39 -4.676 -1.250 1.646
273 HA ARG 39 HA ARG 39 -1.865 -0.703 1.088
274 1HB ARG 39 2HB ARG 39 -4.097 0.847 -0.236
275 2HB ARG 39 1HB ARG 39 -2.374 1.150 -0.404
276 1HG ARG 39 2HG ARG 39 -2.709 -0.022 -2.310
277 2HG ARG 39 1HG ARG 39 -2.397 -1.374 -1.220
278 1HD ARG 39 2HD ARG 39 -4.329 -2.161 -2.069
279 2HD ARG 39 1HD ARG 39 -5.054 -1.084 -0.877
280 HE ARG 39 HE ARG 39 -4.809 0.526 -3.006
281 1HH1 ARG 39 1HH1 ARG 39 -6.105 -2.700 -2.681
282 2HH1 ARG 39 2HH1 ARG 39 -7.245 -2.506 -3.970
283 1HH2 ARG 39 1HH2 ARG 39 -6.310 0.781 -4.700
284 2HH2 ARG 39 2HH2 ARG 39 -7.361 -0.530 -5.116
285 H GLY 40 H GLY 40 -1.192 1.443 1.835
286 1HA GLY 40 2HA GLY 40 -2.753 3.258 3.224
287 2HA GLY 40 1HA GLY 40 -2.285 2.028 4.397
288 H CYS 41 H CYS 41 -1.396 4.290 5.163
289 HA CYS 41 HA CYS 41 1.096 5.068 3.955
290 1HB CYS 41 2HB CYS 41 -0.479 5.953 6.350
291 2HB CYS 41 1HB CYS 41 1.197 6.469 6.158
292 H GLY 42 H GLY 42 2.991 4.126 4.306
293 1HA GLY 42 2HA GLY 42 4.503 3.604 6.331
294 2HA GLY 42 1HA GLY 42 3.276 2.395 6.670
295 H CYS 43 H CYS 43 5.194 0.970 6.535
296 HA CYS 43 HA CYS 43 5.200 -0.427 4.078
297 1HB CYS 43 2HB CYS 43 6.699 1.599 3.599
298 2HB CYS 43 1HB CYS 43 7.861 0.844 4.684
299 HA PRO 44 HA PRO 44 6.437 -3.079 7.559
300 1HB PRO 44 2HB PRO 44 5.237 -5.317 6.670
301 2HB PRO 44 1HB PRO 44 4.321 -4.006 7.433
302 1HG PRO 44 2HG PRO 44 4.656 -4.644 4.526
303 2HG PRO 44 1HG PRO 44 3.191 -4.173 5.405
304 1HD PRO 44 2HD PRO 44 4.681 -2.435 3.915
305 2HD PRO 44 1HD PRO 44 3.707 -1.939 5.313
306 H SER 45 H SER 45 7.091 -5.669 7.209
307 HA SER 45 HA SER 45 9.150 -5.656 5.102
308 1HB SER 45 2HB SER 45 9.377 -6.270 8.016
309 2HB SER 45 1HB SER 45 10.368 -7.201 6.890
310 HG SER 45 HG SER 45 10.267 -4.368 6.910
311 H VAL 46 H VAL 46 6.725 -6.728 4.549
312 HA VAL 46 HA VAL 46 6.672 -9.546 5.140
313 HB VAL 46 HB VAL 46 4.774 -9.521 3.450
314 1HG1 VAL 46 1HG1 VAL 46 3.255 -8.257 5.030
315 2HG1 VAL 46 2HG1 VAL 46 4.705 -7.866 5.955
316 3HG1 VAL 46 3HG1 VAL 46 4.220 -9.549 5.743
317 1HG2 VAL 46 1HG2 VAL 46 4.884 -6.541 3.753
318 2HG2 VAL 46 2HG2 VAL 46 3.910 -7.504 2.641
319 3HG2 VAL 46 3HG2 VAL 46 5.650 -7.365 2.394
320 H LYS 47 H LYS 47 7.053 -11.232 3.714
321 HA LYS 47 HA LYS 47 7.824 -10.752 0.987
322 1HB LYS 47 2HB LYS 47 10.106 -11.636 1.195
323 2HB LYS 47 1HB LYS 47 9.905 -10.141 2.098
324 1HG LYS 47 2HG LYS 47 9.306 -12.238 3.876
325 2HG LYS 47 1HG LYS 47 10.774 -12.703 3.015
326 1HD LYS 47 2HD LYS 47 11.333 -10.120 3.556
327 2HD LYS 47 1HD LYS 47 10.311 -10.515 4.940
328 1HE LYS 47 2HE LYS 47 12.207 -11.286 5.856
329 2HE LYS 47 1HE LYS 47 11.938 -12.693 4.829
330 1HZ LYS 47 1HZ LYS 47 14.205 -11.429 4.797
331 2HZ LYS 47 2HZ LYS 47 13.397 -10.403 3.721
332 3HZ LYS 47 3HZ LYS 47 13.549 -12.050 3.365
333 H LYS 48 H LYS 48 8.596 -12.845 -0.055
334 HA LYS 48 HA LYS 48 8.209 -15.016 -0.604
335 1HB LYS 48 2HB LYS 48 9.215 -15.168 1.854
336 2HB LYS 48 1HB LYS 48 7.604 -15.773 2.213
337 1HG LYS 48 2HG LYS 48 7.862 -17.579 0.673
338 2HG LYS 48 1HG LYS 48 9.380 -16.913 0.068
339 1HD LYS 48 2HD LYS 48 10.571 -17.704 1.815
340 2HD LYS 48 1HD LYS 48 9.278 -17.382 2.972
341 1HE LYS 48 2HE LYS 48 9.571 -19.744 2.866
342 2HE LYS 48 1HE LYS 48 8.065 -19.360 2.035
343 1HZ LYS 48 1HZ LYS 48 8.951 -20.680 0.464
344 2HZ LYS 48 2HZ LYS 48 10.545 -20.435 0.976
345 3HZ LYS 48 3HZ LYS 48 9.781 -19.278 0.007
346 H GLY 49 H GLY 49 6.327 -14.805 -1.748
347 1HA GLY 49 2HA GLY 49 4.171 -15.867 -1.972
348 2HA GLY 49 1HA GLY 49 3.874 -15.513 -0.271
349 H ILE 50 H ILE 50 4.006 -13.049 0.207
350 HA ILE 50 HA ILE 50 1.870 -11.797 -1.015
351 HB ILE 50 HB ILE 50 4.170 -10.484 0.412
352 1HG1 ILE 50 2HG1 ILE 50 3.189 -12.177 1.803
353 2HG1 ILE 50 1HG1 ILE 50 2.585 -10.618 2.345
354 1HG2 ILE 50 1HG2 ILE 50 2.664 -8.650 0.831
355 2HG2 ILE 50 2HG2 ILE 50 1.349 -9.490 0.008
356 3HG2 ILE 50 3HG2 ILE 50 2.749 -8.930 -0.909
357 1HD1 ILE 50 1HD1 ILE 50 1.151 -12.905 1.286
358 2HD1 ILE 50 2HD1 ILE 50 0.690 -11.377 0.535
359 3HD1 ILE 50 3HD1 ILE 50 0.580 -11.568 2.285
360 H GLY 51 H GLY 51 1.655 -10.160 -2.551
361 1HA GLY 51 2HA GLY 51 3.946 -9.920 -4.395
362 2HA GLY 51 1HA GLY 51 2.259 -9.797 -4.870
363 H ILE 52 H ILE 52 3.980 -7.886 -5.689
364 HA ILE 52 HA ILE 52 4.444 -5.669 -5.718
365 HB ILE 52 HB ILE 52 1.835 -5.867 -5.840
366 1HG1 ILE 52 2HG1 ILE 52 2.535 -3.082 -5.216
367 2HG1 ILE 52 1HG1 ILE 52 3.656 -3.884 -6.320
368 1HG2 ILE 52 1HG2 ILE 52 0.601 -5.373 -4.065
369 2HG2 ILE 52 2HG2 ILE 52 1.563 -3.942 -3.704
370 3HG2 ILE 52 3HG2 ILE 52 2.067 -5.517 -3.100
371 1HD1 ILE 52 1HD1 ILE 52 2.236 -3.273 -7.916
372 2HD1 ILE 52 2HD1 ILE 52 0.945 -2.934 -6.765
373 3HD1 ILE 52 3HD1 ILE 52 1.209 -4.582 -7.333
374 H ASN 53 H ASN 53 4.411 -3.547 -4.265
375 HA ASN 53 HA ASN 53 4.938 -4.134 -1.463
376 1HB ASN 53 2HB ASN 53 7.208 -3.336 -1.488
377 2HB ASN 53 1HB ASN 53 7.058 -4.616 -2.695
378 1HD2 ASN 53 1HD2 ASN 53 9.166 -3.218 -3.083
379 2HD2 ASN 53 2HD2 ASN 53 8.995 -2.041 -4.335
380 H CYS 54 H CYS 54 6.332 -1.774 -0.901
381 HA CYS 54 HA CYS 54 4.143 0.094 -0.875
382 1HB CYS 54 2HB CYS 54 6.904 0.781 0.078
383 2HB CYS 54 1HB CYS 54 5.344 1.293 0.724
384 H CYS 55 H CYS 55 4.803 2.508 -1.227
385 HA CYS 55 HA CYS 55 6.567 2.876 -3.510
386 1HB CYS 55 2HB CYS 55 4.687 4.201 -4.670
387 2HB CYS 55 1HB CYS 55 4.627 2.439 -4.759
388 H THR 56 H THR 56 6.308 5.361 -4.197
389 HA THR 56 HA THR 56 5.915 7.039 -1.843
390 HB THR 56 HB THR 56 8.265 6.361 -1.717
391 HG1 THR 56 1HG THR 56 9.002 8.359 -1.384
392 1HG2 THR 56 1HG2 THR 56 9.408 7.817 -3.847
393 2HG2 THR 56 2HG2 THR 56 8.234 6.693 -4.533
394 3HG2 THR 56 3HG2 THR 56 9.532 6.093 -3.501
395 H THR 57 H THR 57 4.130 7.293 -3.633
396 HA THR 57 HA THR 57 4.655 9.837 -4.888
397 HB THR 57 HB THR 57 3.502 8.632 -7.041
398 HG1 THR 57 1HG THR 57 5.403 6.795 -6.017
399 1HG2 THR 57 1HG2 THR 57 5.356 9.198 -8.175
400 2HG2 THR 57 2HG2 THR 57 6.438 8.437 -7.008
401 3HG2 THR 57 3HG2 THR 57 5.751 10.026 -6.668
402 H ASP 58 H ASP 58 2.722 10.897 -5.627
403 HA ASP 58 HA ASP 58 0.531 10.576 -3.941
404 1HB ASP 58 2HB ASP 58 -0.634 12.071 -5.653
405 2HB ASP 58 1HB ASP 58 0.837 12.701 -4.926
406 H ARG 59 H ARG 59 -1.103 9.183 -3.932
407 HA ARG 59 HA ARG 59 -2.531 7.522 -4.550
408 1HB ARG 59 2HB ARG 59 -2.341 8.962 -7.203
409 2HB ARG 59 1HB ARG 59 -3.525 7.716 -6.829
410 1HG ARG 59 2HG ARG 59 -4.411 9.121 -5.020
411 2HG ARG 59 1HG ARG 59 -3.248 10.382 -5.453
412 1HD ARG 59 2HD ARG 59 -4.267 10.730 -7.559
413 2HD ARG 59 1HD ARG 59 -5.233 9.256 -7.416
414 HE ARG 59 HE ARG 59 -6.041 10.767 -5.309
415 1HH1 ARG 59 1HH1 ARG 59 -5.806 11.342 -8.742
416 2HH1 ARG 59 2HH1 ARG 59 -7.132 12.455 -8.773
417 1HH2 ARG 59 1HH2 ARG 59 -7.784 12.230 -5.346
418 2HH2 ARG 59 2HH2 ARG 59 -8.255 12.959 -6.844
419 H CYS 60 H CYS 60 0.345 7.064 -4.760
420 HA CYS 60 HA CYS 60 0.960 5.565 -7.068
421 1HB CYS 60 2HB CYS 60 2.919 4.847 -5.838
422 2HB CYS 60 1HB CYS 60 2.641 6.562 -5.549
423 H ASN 61 H ASN 61 -1.025 4.845 -4.404
424 HA ASN 61 HA ASN 61 -0.909 1.978 -5.072
425 1HB ASN 61 2HB ASN 61 -1.484 1.449 -2.770
426 2HB ASN 61 1HB ASN 61 -0.032 2.452 -2.801
427 1HD2 ASN 61 1HD2 ASN 61 -0.944 2.528 -0.482
428 2HD2 ASN 61 2HD2 ASN 61 -1.953 3.897 -0.132
429 H ASN 62 H ASN 62 -2.513 3.249 -6.664
430 HA ASN 62 HA ASN 62 -5.200 3.268 -5.491
431 1HB ASN 62 2HB ASN 62 -4.285 5.211 -6.907
432 2HB ASN 62 1HB ASN 62 -4.504 4.138 -8.292
433 1HD2 ASN 62 1HD2 ASN 62 -5.925 6.004 -8.868
434 2HD2 ASN 62 2HD2 ASN 62 -7.584 5.924 -8.354
Start of MODEL 16
1 1H LEU 1 1HT LEU 1 0.716 14.498 2.012
2 2H LEU 1 2HT LEU 1 -0.070 15.497 0.858
3 3H LEU 1 3HT LEU 1 1.636 15.310 0.816
4 HA LEU 1 HA LEU 1 0.493 14.046 -0.887
5 1HB LEU 1 2HB LEU 1 2.681 13.395 -0.062
6 2HB LEU 1 1HB LEU 1 1.953 12.542 1.287
7 HG LEU 1 HG LEU 1 1.133 11.658 -1.418
8 1HD1 LEU 1 1HD1 LEU 1 3.311 10.135 -1.173
9 2HD1 LEU 1 2HD1 LEU 1 3.931 11.627 -0.467
10 3HD1 LEU 1 3HD1 LEU 1 3.288 11.630 -2.109
11 1HD2 LEU 1 1HD2 LEU 1 0.508 10.725 0.931
12 2HD2 LEU 1 2HD2 LEU 1 2.084 9.939 0.832
13 3HD2 LEU 1 3HD2 LEU 1 0.856 9.611 -0.392
14 H GLU 2 H GLU 2 -0.964 12.446 -1.457
15 HA GLU 2 HA GLU 2 -2.625 11.347 0.710
16 1HB GLU 2 2HB GLU 2 -3.644 12.409 -1.932
17 2HB GLU 2 1HB GLU 2 -4.622 11.675 -0.668
18 1HG GLU 2 2HG GLU 2 -3.188 13.763 0.550
19 2HG GLU 2 1HG GLU 2 -3.807 14.396 -0.980
20 H CYS 3 H CYS 3 -3.880 9.426 0.054
21 HA CYS 3 HA CYS 3 -3.089 8.004 -2.316
22 1HB CYS 3 2HB CYS 3 -1.793 7.468 0.283
23 2HB CYS 3 1HB CYS 3 -2.391 6.044 -0.569
24 H HIS 4 H HIS 4 -4.174 5.889 -2.484
25 HA HIS 4 HA HIS 4 -6.845 6.051 -1.446
26 1HB HIS 4 2HB HIS 4 -5.591 3.854 -3.101
27 2HB HIS 4 1HB HIS 4 -7.306 4.199 -2.908
28 HD1 HIS 4 1HD HIS 4 -8.000 6.705 -3.856
29 HD2 HIS 4 2HD HIS 4 -4.524 4.963 -5.323
30 HE1 HIS 4 1HE HIS 4 -7.488 7.924 -5.994
31 HE2 HIS 4 2HE HIS 4 -5.429 6.795 -6.908
32 H ASN 5 H ASN 5 -7.360 5.316 0.505
33 HA ASN 5 HA ASN 5 -5.697 3.400 1.875
34 1HB ASN 5 2HB ASN 5 -7.409 3.694 3.714
35 2HB ASN 5 1HB ASN 5 -6.583 5.170 3.213
36 1HD2 ASN 5 1HD2 ASN 5 -8.643 5.730 4.512
37 2HD2 ASN 5 2HD2 ASN 5 -10.002 6.143 3.526
38 H GLN 6 H GLN 6 -8.278 3.155 -0.275
39 HA GLN 6 HA GLN 6 -9.839 1.095 0.734
40 1HB GLN 6 2HB GLN 6 -10.028 2.465 -1.482
41 2HB GLN 6 1HB GLN 6 -9.073 1.149 -2.163
42 1HG GLN 6 2HG GLN 6 -11.413 0.329 -0.582
43 2HG GLN 6 1HG GLN 6 -11.763 1.186 -2.083
44 1HE2 GLN 6 1HE2 GLN 6 -11.159 0.269 -4.047
45 2HE2 GLN 6 2HE2 GLN 6 -10.759 -1.406 -4.193
46 H GLN 7 H GLN 7 -9.821 -1.167 0.389
47 HA GLN 7 HA GLN 7 -7.496 -2.476 -0.668
48 1HB GLN 7 2HB GLN 7 -6.931 -3.643 1.466
49 2HB GLN 7 1HB GLN 7 -6.564 -1.919 1.470
50 1HG GLN 7 2HG GLN 7 -7.550 -2.046 3.489
51 2HG GLN 7 1HG GLN 7 -9.003 -1.811 2.519
52 1HE2 GLN 7 1HE2 GLN 7 -10.572 -3.030 3.272
53 2HE2 GLN 7 2HE2 GLN 7 -10.431 -4.671 3.794
54 H SER 8 H SER 8 -7.851 -4.632 -1.108
55 HA SER 8 HA SER 8 -9.081 -6.474 -1.624
56 1HB SER 8 2HB SER 8 -10.170 -7.567 0.159
57 2HB SER 8 1HB SER 8 -8.927 -6.593 0.943
58 HG SER 8 HG SER 8 -10.474 -5.117 1.537
59 H SER 9 H SER 9 -10.065 -3.835 -2.450
60 HA SER 9 HA SER 9 -11.845 -2.936 -3.539
61 1HB SER 9 2HB SER 9 -11.908 -5.615 -4.134
62 2HB SER 9 1HB SER 9 -13.532 -5.343 -3.505
63 HG SER 9 HG SER 9 -12.649 -4.775 -5.901
64 H GLN 10 H GLN 10 -11.775 -2.773 -0.694
65 HA GLN 10 HA GLN 10 -14.501 -3.168 0.219
66 1HB GLN 10 2HB GLN 10 -11.917 -2.391 1.484
67 2HB GLN 10 1HB GLN 10 -13.410 -1.889 2.276
68 1HG GLN 10 2HG GLN 10 -13.629 -4.636 1.553
69 2HG GLN 10 1HG GLN 10 -12.104 -4.387 2.402
70 1HE2 GLN 10 1HE2 GLN 10 -15.007 -5.456 2.954
71 2HE2 GLN 10 2HE2 GLN 10 -15.318 -4.847 4.550
72 H THR 11 H THR 11 -15.174 -1.137 1.737
73 HA THR 11 HA THR 11 -16.247 0.776 0.119
74 HB THR 11 HB THR 11 -15.390 1.643 2.839
75 HG1 THR 11 1HG THR 11 -16.568 0.164 3.847
76 1HG2 THR 11 1HG2 THR 11 -18.173 1.693 2.537
77 2HG2 THR 11 2HG2 THR 11 -17.495 2.277 1.017
78 3HG2 THR 11 3HG2 THR 11 -17.056 3.056 2.537
79 HA PRO 12 HA PRO 12 -12.389 2.809 -1.189
80 1HB PRO 12 2HB PRO 12 -14.378 4.405 -2.709
81 2HB PRO 12 1HB PRO 12 -12.914 3.594 -3.276
82 1HG PRO 12 2HG PRO 12 -15.323 2.594 -3.821
83 2HG PRO 12 1HG PRO 12 -13.955 1.528 -3.430
84 1HD PRO 12 2HD PRO 12 -16.259 2.371 -1.713
85 2HD PRO 12 1HD PRO 12 -15.459 0.787 -1.832
86 H THR 13 H THR 13 -11.422 4.655 -0.510
87 HA THR 13 HA THR 13 -12.952 6.951 0.329
88 HB THR 13 HB THR 13 -11.647 6.806 2.627
89 HG1 THR 13 1HG THR 13 -11.400 4.726 3.338
90 1HG2 THR 13 1HG2 THR 13 -13.686 6.686 3.455
91 2HG2 THR 13 2HG2 THR 13 -13.802 4.985 3.007
92 3HG2 THR 13 3HG2 THR 13 -14.288 6.233 1.860
93 H THR 14 H THR 14 -11.257 8.501 1.556
94 HA THR 14 HA THR 14 -8.760 8.417 -0.007
95 HB THR 14 HB THR 14 -8.879 10.950 0.043
96 HG1 THR 14 1HG THR 14 -10.470 11.152 1.650
97 1HG2 THR 14 1HG2 THR 14 -10.965 9.410 -1.471
98 2HG2 THR 14 2HG2 THR 14 -9.376 9.931 -2.032
99 3HG2 THR 14 3HG2 THR 14 -10.639 11.124 -1.728
100 H THR 15 H THR 15 -6.887 9.181 0.990
101 HA THR 15 HA THR 15 -7.030 10.061 3.759
102 HB THR 15 HB THR 15 -6.959 7.605 3.911
103 HG1 THR 15 1HG THR 15 -4.460 8.722 4.635
104 1HG2 THR 15 1HG2 THR 15 -4.579 7.916 2.149
105 2HG2 THR 15 2HG2 THR 15 -5.881 6.727 2.090
106 3HG2 THR 15 3HG2 THR 15 -4.633 6.608 3.330
107 H GLY 16 H GLY 16 -4.886 10.755 4.579
108 1HA GLY 16 2HA GLY 16 -2.781 11.119 2.690
109 2HA GLY 16 1HA GLY 16 -3.635 12.603 3.062
110 H CYS 17 H CYS 17 -0.931 11.000 3.757
111 HA CYS 17 HA CYS 17 -0.890 11.895 6.566
112 1HB CYS 17 2HB CYS 17 0.833 9.746 5.312
113 2HB CYS 17 1HB CYS 17 0.785 10.198 7.018
114 H SER 18 H SER 18 1.635 12.094 7.199
115 HA SER 18 HA SER 18 3.389 13.151 5.255
116 1HB SER 18 2HB SER 18 1.419 14.938 5.715
117 2HB SER 18 1HB SER 18 2.537 15.393 7.000
118 HG SER 18 HG SER 18 2.991 16.528 5.086
119 H GLY 19 H GLY 19 5.426 13.330 6.062
120 1HA GLY 19 2HA GLY 19 6.922 13.905 7.890
121 2HA GLY 19 1HA GLY 19 5.721 13.261 8.998
122 H GLY 20 H GLY 20 6.560 11.524 9.950
123 1HA GLY 20 2HA GLY 20 8.648 9.958 9.104
124 2HA GLY 20 1HA GLY 20 7.390 9.400 10.202
125 H GLU 21 H GLU 21 5.318 9.785 8.089
126 HA GLU 21 HA GLU 21 5.974 7.406 6.476
127 1HB GLU 21 2HB GLU 21 4.036 7.491 8.322
128 2HB GLU 21 1HB GLU 21 3.133 8.144 6.955
129 1HG GLU 21 2HG GLU 21 3.102 6.174 5.859
130 2HG GLU 21 1HG GLU 21 4.700 5.700 6.436
131 H ASN 22 H ASN 22 6.381 7.975 4.445
132 HA ASN 22 HA ASN 22 4.530 9.820 3.112
133 1HB ASN 22 2HB ASN 22 7.480 10.098 3.386
134 2HB ASN 22 1HB ASN 22 6.770 10.517 1.830
135 1HD2 ASN 22 1HD2 ASN 22 5.334 12.247 1.700
136 2HD2 ASN 22 2HD2 ASN 22 5.233 13.444 2.942
137 H ASN 23 H ASN 23 4.964 6.859 3.147
138 HA ASN 23 HA ASN 23 5.218 6.523 0.241
139 1HB ASN 23 2HB ASN 23 6.438 4.726 2.349
140 2HB ASN 23 1HB ASN 23 6.388 4.365 0.620
141 1HD2 ASN 23 1HD2 ASN 23 8.316 5.436 2.997
142 2HD2 ASN 23 2HD2 ASN 23 9.418 6.419 2.082
143 H CYS 24 H CYS 24 3.747 5.161 -0.679
144 HA CYS 24 HA CYS 24 1.771 3.972 1.148
145 1HB CYS 24 2HB CYS 24 1.312 4.567 -1.771
146 2HB CYS 24 1HB CYS 24 0.113 4.258 -0.513
147 H TYR 25 H TYR 25 1.915 1.861 1.364
148 HA TYR 25 HA TYR 25 3.247 0.255 -0.597
149 1HB TYR 25 2HB TYR 25 3.245 -1.466 1.080
150 2HB TYR 25 1HB TYR 25 3.719 0.049 1.844
151 HD1 TYR 25 1HD TYR 25 2.106 1.249 3.301
152 HD2 TYR 25 2HD TYR 25 1.263 -2.618 1.738
153 HE1 TYR 25 1HE TYR 25 0.325 0.967 4.972
154 HE2 TYR 25 2HE TYR 25 -0.520 -2.910 3.405
155 HH TYR 25 HH TYR 25 -0.813 -1.346 6.078
156 H LYS 26 H LYS 26 2.330 -1.727 -1.436
157 HA LYS 26 HA LYS 26 -0.608 -1.916 -1.278
158 1HB LYS 26 2HB LYS 26 -0.071 -0.564 -3.288
159 2HB LYS 26 1HB LYS 26 0.911 -1.895 -3.897
160 1HG LYS 26 2HG LYS 26 -0.911 -3.189 -4.407
161 2HG LYS 26 1HG LYS 26 -1.941 -2.404 -3.209
162 1HD LYS 26 2HD LYS 26 -2.611 -1.799 -5.479
163 2HD LYS 26 1HD LYS 26 -2.024 -0.390 -4.591
164 1HE LYS 26 2HE LYS 26 -0.247 -0.117 -5.949
165 2HE LYS 26 1HE LYS 26 0.026 -1.852 -6.108
166 1HZ LYS 26 1HZ LYS 26 -2.328 -0.713 -7.418
167 2HZ LYS 26 2HZ LYS 26 -1.340 -1.997 -7.901
168 3HZ LYS 26 3HZ LYS 26 -0.816 -0.403 -8.112
169 H LYS 27 H LYS 27 0.083 -3.743 0.090
170 HA LYS 27 HA LYS 27 1.501 -5.915 -1.114
171 1HB LYS 27 2HB LYS 27 1.115 -7.046 1.003
172 2HB LYS 27 1HB LYS 27 1.709 -5.417 1.263
173 1HG LYS 27 2HG LYS 27 -0.751 -4.771 1.543
174 2HG LYS 27 1HG LYS 27 -1.046 -6.504 1.703
175 1HD LYS 27 2HD LYS 27 1.141 -5.361 3.339
176 2HD LYS 27 1HD LYS 27 -0.507 -4.918 3.790
177 1HE LYS 27 2HE LYS 27 -0.331 -6.827 5.005
178 2HE LYS 27 1HE LYS 27 -0.864 -7.539 3.483
179 1HZ LYS 27 1HZ LYS 27 0.944 -8.824 3.940
180 2HZ LYS 27 2HZ LYS 27 1.785 -7.589 4.733
181 3HZ LYS 27 3HZ LYS 27 1.701 -7.606 3.043
182 H GLU 28 H GLU 28 0.790 -7.843 -1.826
183 HA GLU 28 HA GLU 28 -2.128 -8.197 -2.029
184 1HB GLU 28 2HB GLU 28 -1.216 -9.668 -4.105
185 2HB GLU 28 1HB GLU 28 -1.742 -7.995 -4.249
186 1HG GLU 28 2HG GLU 28 0.266 -7.998 -5.374
187 2HG GLU 28 1HG GLU 28 0.733 -7.423 -3.775
188 H TRP 29 H TRP 29 -2.920 -10.344 -1.925
189 HA TRP 29 HA TRP 29 -1.145 -12.531 -1.385
190 1HB TRP 29 2HB TRP 29 -1.728 -12.973 0.878
191 2HB TRP 29 1HB TRP 29 -1.263 -11.278 0.814
192 HD1 TRP 29 HD TRP 29 -3.805 -13.420 2.201
193 HE1 TRP 29 1HE TRP 29 -5.895 -12.095 2.918
194 HE3 TRP 29 3HE TRP 29 -2.834 -9.032 -0.216
195 HZ2 TRP 29 2HZ TRP 29 -6.979 -9.520 2.511
196 HZ3 TRP 29 3HZ TRP 29 -4.444 -7.185 0.000
197 HH2 TRP 29 HH TRP 29 -6.472 -7.423 1.336
198 H ARG 30 H ARG 30 -2.137 -14.519 -1.597
199 HA ARG 30 HA ARG 30 -4.917 -14.408 -2.528
200 1HB ARG 30 2HB ARG 30 -4.160 -16.842 -3.321
201 2HB ARG 30 1HB ARG 30 -3.857 -15.400 -4.283
202 1HG ARG 30 2HG ARG 30 -1.602 -15.373 -3.759
203 2HG ARG 30 1HG ARG 30 -1.823 -16.359 -2.311
204 1HD ARG 30 2HD ARG 30 -0.746 -17.501 -4.301
205 2HD ARG 30 1HD ARG 30 -2.126 -18.326 -3.574
206 HE ARG 30 HE ARG 30 -3.300 -18.012 -5.518
207 1HH1 ARG 30 1HH1 ARG 30 -0.465 -15.978 -5.559
208 2HH1 ARG 30 2HH1 ARG 30 -0.667 -15.515 -7.215
209 1HH2 ARG 30 1HH2 ARG 30 -3.570 -17.403 -7.696
210 2HH2 ARG 30 2HH2 ARG 30 -2.430 -16.324 -8.428
211 H ASP 31 H ASP 31 -6.388 -16.071 -1.943
212 HA ASP 31 HA ASP 31 -5.739 -17.922 0.154
213 1HB ASP 31 2HB ASP 31 -7.471 -16.978 1.735
214 2HB ASP 31 1HB ASP 31 -5.993 -16.022 1.583
215 H ASN 32 H ASN 32 -7.029 -19.654 0.018
216 HA ASN 32 HA ASN 32 -8.713 -21.044 -0.610
217 1HB ASN 32 2HB ASN 32 -10.318 -18.487 -0.800
218 2HB ASN 32 1HB ASN 32 -10.993 -20.112 -0.862
219 1HD2 ASN 32 1HD2 ASN 32 -11.822 -20.774 0.968
220 2HD2 ASN 32 2HD2 ASN 32 -11.309 -20.313 2.552
221 H ARG 33 H ARG 33 -9.583 -18.225 -2.605
222 HA ARG 33 HA ARG 33 -8.831 -19.776 -4.980
223 1HB ARG 33 2HB ARG 33 -10.911 -18.267 -5.898
224 2HB ARG 33 1HB ARG 33 -11.027 -19.962 -5.431
225 1HG ARG 33 2HG ARG 33 -11.357 -17.986 -3.267
226 2HG ARG 33 1HG ARG 33 -12.632 -18.037 -4.485
227 1HD ARG 33 2HD ARG 33 -11.745 -20.661 -3.516
228 2HD ARG 33 1HD ARG 33 -12.511 -19.644 -2.296
229 HE ARG 33 HE ARG 33 -14.217 -19.474 -4.380
230 1HH1 ARG 33 1HH1 ARG 33 -12.764 -22.181 -2.724
231 2HH1 ARG 33 2HH1 ARG 33 -14.098 -23.243 -3.028
232 1HH2 ARG 33 1HH2 ARG 33 -15.971 -20.869 -4.781
233 2HH2 ARG 33 2HH2 ARG 33 -15.918 -22.499 -4.197
234 H GLY 34 H GLY 34 -10.286 -16.558 -4.654
235 1HA GLY 34 2HA GLY 34 -8.267 -15.447 -6.391
236 2HA GLY 34 1HA GLY 34 -9.634 -14.591 -5.695
237 H TYR 35 H TYR 35 -7.645 -13.040 -5.646
238 HA TYR 35 HA TYR 35 -6.473 -13.250 -2.953
239 1HB TYR 35 2HB TYR 35 -4.553 -11.845 -4.034
240 2HB TYR 35 1HB TYR 35 -4.580 -13.589 -4.254
241 HD1 TYR 35 1HD TYR 35 -4.838 -14.554 -6.413
242 HD2 TYR 35 2HD TYR 35 -5.278 -10.355 -5.891
243 HE1 TYR 35 1HE TYR 35 -4.791 -14.252 -8.852
244 HE2 TYR 35 2HE TYR 35 -5.232 -10.041 -8.329
245 HH TYR 35 HH TYR 35 -4.451 -11.185 -10.319
246 H ARG 36 H ARG 36 -5.492 -10.952 -2.390
247 HA ARG 36 HA ARG 36 -7.302 -8.829 -3.271
248 1HB ARG 36 2HB ARG 36 -7.080 -9.934 -0.508
249 2HB ARG 36 1HB ARG 36 -7.313 -8.195 -0.696
250 1HG ARG 36 2HG ARG 36 -9.433 -8.423 -1.477
251 2HG ARG 36 1HG ARG 36 -9.110 -9.988 -2.225
252 1HD ARG 36 2HD ARG 36 -9.167 -11.082 -0.087
253 2HD ARG 36 1HD ARG 36 -9.294 -9.536 0.750
254 HE ARG 36 HE ARG 36 -11.539 -9.559 0.348
255 1HH1 ARG 36 1HH1 ARG 36 -10.004 -11.789 -1.853
256 2HH1 ARG 36 2HH1 ARG 36 -11.500 -12.392 -2.483
257 1HH2 ARG 36 1HH2 ARG 36 -13.507 -10.348 -0.480
258 2HH2 ARG 36 2HH2 ARG 36 -13.490 -11.574 -1.705
259 H THR 37 H THR 37 -6.598 -6.674 -2.280
260 HA THR 37 HA THR 37 -3.707 -6.556 -1.829
261 HB THR 37 HB THR 37 -4.269 -4.336 -3.447
262 HG1 THR 37 1HG THR 37 -5.331 -6.708 -4.580
263 1HG2 THR 37 1HG2 THR 37 -2.485 -5.007 -4.604
264 2HG2 THR 37 2HG2 THR 37 -3.127 -6.630 -4.853
265 3HG2 THR 37 3HG2 THR 37 -2.328 -6.221 -3.335
266 H GLU 38 H GLU 38 -3.156 -5.147 -0.258
267 HA GLU 38 HA GLU 38 -5.162 -3.156 0.538
268 1HB GLU 38 2HB GLU 38 -3.764 -3.535 2.831
269 2HB GLU 38 1HB GLU 38 -5.283 -4.321 2.452
270 1HG GLU 38 2HG GLU 38 -3.535 -6.058 1.342
271 2HG GLU 38 1HG GLU 38 -2.580 -5.431 2.681
272 H ARG 39 H ARG 39 -4.437 -1.148 1.153
273 HA ARG 39 HA ARG 39 -1.564 -0.629 0.916
274 1HB ARG 39 2HB ARG 39 -3.538 1.219 -0.395
275 2HB ARG 39 1HB ARG 39 -1.805 1.096 -0.657
276 1HG ARG 39 2HG ARG 39 -2.544 0.087 -2.551
277 2HG ARG 39 1HG ARG 39 -2.459 -1.322 -1.493
278 1HD ARG 39 2HD ARG 39 -4.571 -1.643 -2.225
279 2HD ARG 39 1HD ARG 39 -4.949 -0.499 -0.940
280 HE ARG 39 HE ARG 39 -4.470 1.057 -3.136
281 1HH1 ARG 39 1HH1 ARG 39 -6.649 -1.566 -2.395
282 2HH1 ARG 39 2HH1 ARG 39 -7.883 -1.011 -3.475
283 1HH2 ARG 39 1HH2 ARG 39 -6.093 1.788 -4.556
284 2HH2 ARG 39 2HH2 ARG 39 -7.568 0.892 -4.703
285 H GLY 40 H GLY 40 -1.610 2.115 1.127
286 1HA GLY 40 2HA GLY 40 -2.936 3.699 2.635
287 2HA GLY 40 1HA GLY 40 -2.689 2.447 3.852
288 H CYS 41 H CYS 41 -1.717 4.396 4.954
289 HA CYS 41 HA CYS 41 0.847 5.281 4.009
290 1HB CYS 41 2HB CYS 41 -0.697 5.759 6.559
291 2HB CYS 41 1HB CYS 41 0.897 6.446 6.251
292 H GLY 42 H GLY 42 2.662 4.169 4.249
293 1HA GLY 42 2HA GLY 42 4.024 3.320 6.315
294 2HA GLY 42 1HA GLY 42 2.788 2.071 6.294
295 H CYS 43 H CYS 43 4.797 0.734 6.066
296 HA CYS 43 HA CYS 43 5.029 -0.157 3.383
297 1HB CYS 43 2HB CYS 43 6.511 1.908 3.408
298 2HB CYS 43 1HB CYS 43 7.566 1.029 4.509
299 HA PRO 44 HA PRO 44 6.171 -3.109 6.834
300 1HB PRO 44 2HB PRO 44 4.122 -4.835 6.529
301 2HB PRO 44 1HB PRO 44 3.979 -3.368 7.511
302 1HG PRO 44 2HG PRO 44 3.058 -3.869 4.706
303 2HG PRO 44 1HG PRO 44 2.212 -3.049 6.031
304 1HD PRO 44 2HD PRO 44 3.512 -1.718 4.042
305 2HD PRO 44 1HD PRO 44 3.329 -1.071 5.684
306 H SER 45 H SER 45 5.878 -5.742 6.449
307 HA SER 45 HA SER 45 6.340 -6.587 3.761
308 1HB SER 45 2HB SER 45 8.682 -6.238 5.624
309 2HB SER 45 1HB SER 45 8.714 -7.431 4.324
310 HG SER 45 HG SER 45 8.209 -5.647 2.889
311 H VAL 46 H VAL 46 6.983 -8.934 3.688
312 HA VAL 46 HA VAL 46 6.653 -10.486 6.081
313 HB VAL 46 HB VAL 46 4.290 -9.768 5.148
314 1HG1 VAL 46 1HG1 VAL 46 5.059 -10.939 2.897
315 2HG1 VAL 46 2HG1 VAL 46 3.379 -10.938 3.432
316 3HG1 VAL 46 3HG1 VAL 46 4.392 -12.353 3.713
317 1HG2 VAL 46 1HG2 VAL 46 5.218 -11.714 6.852
318 2HG2 VAL 46 2HG2 VAL 46 4.163 -12.603 5.755
319 3HG2 VAL 46 3HG2 VAL 46 3.536 -11.222 6.653
320 H LYS 47 H LYS 47 5.978 -12.909 5.009
321 HA LYS 47 HA LYS 47 8.214 -13.400 3.158
322 1HB LYS 47 2HB LYS 47 8.243 -15.701 4.083
323 2HB LYS 47 1HB LYS 47 8.566 -14.469 5.295
324 1HG LYS 47 2HG LYS 47 5.771 -14.934 5.260
325 2HG LYS 47 1HG LYS 47 6.583 -16.499 5.303
326 1HD LYS 47 2HD LYS 47 7.635 -14.408 7.113
327 2HD LYS 47 1HD LYS 47 6.043 -15.063 7.502
328 1HE LYS 47 2HE LYS 47 7.214 -16.654 8.574
329 2HE LYS 47 1HE LYS 47 7.422 -17.335 6.962
330 1HZ LYS 47 1HZ LYS 47 9.534 -16.224 6.774
331 2HZ LYS 47 2HZ LYS 47 9.519 -17.154 8.186
332 3HZ LYS 47 3HZ LYS 47 9.328 -15.475 8.277
333 H LYS 48 H LYS 48 7.761 -15.798 2.162
334 HA LYS 48 HA LYS 48 6.638 -16.953 0.557
335 1HB LYS 48 2HB LYS 48 4.078 -15.864 1.712
336 2HB LYS 48 1HB LYS 48 4.333 -17.392 0.882
337 1HG LYS 48 2HG LYS 48 6.008 -17.696 2.971
338 2HG LYS 48 1HG LYS 48 4.772 -16.667 3.696
339 1HD LYS 48 2HD LYS 48 3.188 -18.281 3.607
340 2HD LYS 48 1HD LYS 48 3.785 -18.928 2.077
341 1HE LYS 48 2HE LYS 48 5.039 -20.472 3.099
342 2HE LYS 48 1HE LYS 48 5.646 -19.316 4.284
343 1HZ LYS 48 1HZ LYS 48 3.742 -19.640 5.630
344 2HZ LYS 48 2HZ LYS 48 4.298 -21.181 5.213
345 3HZ LYS 48 3HZ LYS 48 2.945 -20.532 4.433
346 H GLY 49 H GLY 49 4.535 -16.556 -1.034
347 1HA GLY 49 2HA GLY 49 5.383 -14.595 -2.835
348 2HA GLY 49 1HA GLY 49 3.808 -15.384 -2.868
349 H ILE 50 H ILE 50 3.213 -14.358 -0.124
350 HA ILE 50 HA ILE 50 1.810 -12.039 -0.865
351 HB ILE 50 HB ILE 50 2.566 -12.900 1.931
352 1HG1 ILE 50 2HG1 ILE 50 0.102 -13.574 0.303
353 2HG1 ILE 50 1HG1 ILE 50 1.428 -14.688 0.651
354 1HG2 ILE 50 1HG2 ILE 50 1.718 -10.812 2.280
355 2HG2 ILE 50 2HG2 ILE 50 0.214 -11.734 2.265
356 3HG2 ILE 50 3HG2 ILE 50 0.722 -10.852 0.825
357 1HD1 ILE 50 1HD1 ILE 50 0.852 -14.086 3.135
358 2HD1 ILE 50 2HD1 ILE 50 -0.080 -15.294 2.251
359 3HD1 ILE 50 3HD1 ILE 50 -0.710 -13.658 2.437
360 H GLY 51 H GLY 51 2.195 -9.872 -0.569
361 1HA GLY 51 2HA GLY 51 3.659 -8.297 0.832
362 2HA GLY 51 1HA GLY 51 4.985 -9.177 0.088
363 H ILE 52 H ILE 52 5.545 -6.931 -0.550
364 HA ILE 52 HA ILE 52 5.357 -6.474 -3.232
365 HB ILE 52 HB ILE 52 2.846 -6.082 -2.452
366 1HG1 ILE 52 2HG1 ILE 52 4.475 -5.291 -4.664
367 2HG1 ILE 52 1HG1 ILE 52 2.766 -5.712 -4.650
368 1HG2 ILE 52 1HG2 ILE 52 4.236 -3.719 -1.435
369 2HG2 ILE 52 2HG2 ILE 52 2.679 -4.397 -1.005
370 3HG2 ILE 52 3HG2 ILE 52 2.823 -3.358 -2.412
371 1HD1 ILE 52 1HD1 ILE 52 3.423 -3.478 -5.647
372 2HD1 ILE 52 2HD1 ILE 52 3.728 -2.942 -3.998
373 3HD1 ILE 52 3HD1 ILE 52 2.113 -3.468 -4.471
374 H ASN 53 H ASN 53 5.331 -3.778 -3.540
375 HA ASN 53 HA ASN 53 7.459 -2.865 -1.739
376 1HB ASN 53 2HB ASN 53 8.195 -1.407 -3.571
377 2HB ASN 53 1HB ASN 53 8.153 -3.093 -4.093
378 1HD2 ASN 53 1HD2 ASN 53 7.446 -3.288 -6.078
379 2HD2 ASN 53 2HD2 ASN 53 6.203 -2.345 -6.823
380 H CYS 54 H CYS 54 7.478 -0.218 -2.171
381 HA CYS 54 HA CYS 54 4.759 0.756 -1.664
382 1HB CYS 54 2HB CYS 54 7.070 1.742 -0.009
383 2HB CYS 54 1HB CYS 54 5.341 1.883 0.313
384 H CYS 55 H CYS 55 4.288 2.531 -2.779
385 HA CYS 55 HA CYS 55 6.384 3.821 -4.319
386 1HB CYS 55 2HB CYS 55 4.353 5.148 -5.229
387 2HB CYS 55 1HB CYS 55 4.514 3.445 -5.661
388 H THR 56 H THR 56 6.111 6.304 -4.573
389 HA THR 56 HA THR 56 5.563 7.551 -1.974
390 HB THR 56 HB THR 56 7.970 7.083 -2.058
391 HG1 THR 56 1HG THR 56 7.160 9.069 -1.123
392 1HG2 THR 56 1HG2 THR 56 8.098 7.261 -4.604
393 2HG2 THR 56 2HG2 THR 56 9.439 7.902 -3.656
394 3HG2 THR 56 3HG2 THR 56 8.238 8.999 -4.338
395 H THR 57 H THR 57 3.876 7.667 -4.164
396 HA THR 57 HA THR 57 4.031 10.520 -4.789
397 HB THR 57 HB THR 57 4.723 9.960 -6.875
398 HG1 THR 57 1HG THR 57 3.058 10.168 -8.161
399 1HG2 THR 57 1HG2 THR 57 5.239 7.836 -7.222
400 2HG2 THR 57 2HG2 THR 57 3.587 7.626 -7.802
401 3HG2 THR 57 3HG2 THR 57 3.984 7.267 -6.123
402 H ASP 58 H ASP 58 1.994 11.488 -5.328
403 HA ASP 58 HA ASP 58 -0.123 10.626 -3.720
404 1HB ASP 58 2HB ASP 58 -1.444 12.346 -5.054
405 2HB ASP 58 1HB ASP 58 -0.008 12.933 -4.226
406 H ARG 59 H ARG 59 -1.884 9.395 -4.064
407 HA ARG 59 HA ARG 59 -3.188 7.783 -5.008
408 1HB ARG 59 2HB ARG 59 -2.896 9.482 -7.490
409 2HB ARG 59 1HB ARG 59 -4.189 8.341 -7.146
410 1HG ARG 59 2HG ARG 59 -4.515 9.877 -5.027
411 2HG ARG 59 1HG ARG 59 -3.719 11.068 -6.065
412 1HD ARG 59 2HD ARG 59 -5.406 10.581 -7.822
413 2HD ARG 59 1HD ARG 59 -6.233 9.514 -6.680
414 HE ARG 59 HE ARG 59 -7.081 11.360 -5.616
415 1HH1 ARG 59 1HH1 ARG 59 -4.514 12.362 -7.759
416 2HH1 ARG 59 2HH1 ARG 59 -4.841 14.051 -7.562
417 1HH2 ARG 59 1HH2 ARG 59 -7.511 13.582 -5.356
418 2HH2 ARG 59 2HH2 ARG 59 -6.542 14.744 -6.197
419 H CYS 60 H CYS 60 -0.290 7.404 -5.131
420 HA CYS 60 HA CYS 60 0.403 6.254 -7.632
421 1HB CYS 60 2HB CYS 60 2.400 5.491 -6.490
422 2HB CYS 60 1HB CYS 60 2.050 7.155 -6.031
423 H ASN 61 H ASN 61 -1.219 5.084 -4.798
424 HA ASN 61 HA ASN 61 -0.947 2.308 -5.683
425 1HB ASN 61 2HB ASN 61 -1.922 1.704 -3.525
426 2HB ASN 61 1HB ASN 61 -0.554 2.797 -3.298
427 1HD2 ASN 61 1HD2 ASN 61 -1.686 2.971 -1.176
428 2HD2 ASN 61 2HD2 ASN 61 -2.898 4.204 -1.021
429 H ASN 62 H ASN 62 -2.409 3.808 -7.430
430 HA ASN 62 HA ASN 62 -5.205 3.758 -6.885
431 1HB ASN 62 2HB ASN 62 -3.662 5.005 -8.749
432 2HB ASN 62 1HB ASN 62 -4.360 3.701 -9.714
433 1HD2 ASN 62 1HD2 ASN 62 -4.976 6.197 -10.407
434 2HD2 ASN 62 2HD2 ASN 62 -6.615 6.579 -9.975
Start of MODEL 17
1 1H LEU 1 1HT LEU 1 1.110 13.239 2.686
2 2H LEU 1 2HT LEU 1 0.944 14.652 1.724
3 3H LEU 1 3HT LEU 1 2.422 13.780 1.726
4 HA LEU 1 HA LEU 1 0.946 13.476 -0.233
5 1HB LEU 1 2HB LEU 1 2.732 11.869 1.068
6 2HB LEU 1 1HB LEU 1 1.332 10.817 0.972
7 HG LEU 1 HG LEU 1 1.388 11.613 -1.574
8 1HD1 LEU 1 1HD1 LEU 1 3.460 12.145 -2.417
9 2HD1 LEU 1 2HD1 LEU 1 4.318 11.468 -1.033
10 3HD1 LEU 1 3HD1 LEU 1 3.479 13.012 -0.881
11 1HD2 LEU 1 1HD2 LEU 1 1.410 9.346 -1.273
12 2HD2 LEU 1 2HD2 LEU 1 2.756 9.398 -0.134
13 3HD2 LEU 1 3HD2 LEU 1 3.055 9.594 -1.861
14 H GLU 2 H GLU 2 -0.596 11.607 -0.923
15 HA GLU 2 HA GLU 2 -2.700 11.099 1.025
16 1HB GLU 2 2HB GLU 2 -3.120 12.663 -1.522
17 2HB GLU 2 1HB GLU 2 -4.434 11.893 -0.644
18 1HG GLU 2 2HG GLU 2 -3.432 13.258 1.373
19 2HG GLU 2 1HG GLU 2 -2.805 14.272 0.068
20 H CYS 3 H CYS 3 -2.551 8.925 0.899
21 HA CYS 3 HA CYS 3 -2.763 7.690 -1.766
22 1HB CYS 3 2HB CYS 3 -1.288 6.956 0.694
23 2HB CYS 3 1HB CYS 3 -2.040 5.622 -0.181
24 H HIS 4 H HIS 4 -3.749 5.337 -1.468
25 HA HIS 4 HA HIS 4 -6.448 5.761 -0.584
26 1HB HIS 4 2HB HIS 4 -5.033 3.418 -1.864
27 2HB HIS 4 1HB HIS 4 -6.744 3.408 -1.444
28 HD1 HIS 4 1HD HIS 4 -8.337 4.790 -2.920
29 HD2 HIS 4 2HD HIS 4 -4.351 5.006 -4.077
30 HE1 HIS 4 1HE HIS 4 -8.355 5.861 -5.196
31 HE2 HIS 4 2HE HIS 4 -5.926 6.074 -5.831
32 H ASN 5 H ASN 5 -7.579 4.130 0.763
33 HA ASN 5 HA ASN 5 -5.831 2.938 2.803
34 1HB ASN 5 2HB ASN 5 -7.595 3.612 4.505
35 2HB ASN 5 1HB ASN 5 -6.615 4.924 3.853
36 1HD2 ASN 5 1HD2 ASN 5 -8.678 5.827 4.950
37 2HD2 ASN 5 2HD2 ASN 5 -9.945 6.216 3.841
38 H GLN 6 H GLN 6 -9.071 3.028 1.393
39 HA GLN 6 HA GLN 6 -10.119 0.742 2.589
40 1HB GLN 6 2HB GLN 6 -11.113 2.574 0.899
41 2HB GLN 6 1HB GLN 6 -10.838 1.261 -0.246
42 1HG GLN 6 2HG GLN 6 -13.076 1.094 0.517
43 2HG GLN 6 1HG GLN 6 -12.166 -0.222 1.258
44 1HE2 GLN 6 1HE2 GLN 6 -12.710 -0.561 3.277
45 2HE2 GLN 6 2HE2 GLN 6 -13.192 0.637 4.425
46 H GLN 7 H GLN 7 -10.383 -1.406 1.812
47 HA GLN 7 HA GLN 7 -8.776 -2.321 -0.407
48 1HB GLN 7 2HB GLN 7 -7.535 -3.980 1.018
49 2HB GLN 7 1HB GLN 7 -7.045 -2.300 1.238
50 1HG GLN 7 2HG GLN 7 -7.162 -2.969 3.407
51 2HG GLN 7 1HG GLN 7 -8.811 -2.387 3.182
52 1HE2 GLN 7 1HE2 GLN 7 -6.776 -5.166 3.574
53 2HE2 GLN 7 2HE2 GLN 7 -8.039 -6.309 3.861
54 H SER 8 H SER 8 -8.995 -4.714 -0.704
55 HA SER 8 HA SER 8 -10.235 -6.607 -0.896
56 1HB SER 8 2HB SER 8 -11.325 -7.459 0.958
57 2HB SER 8 1HB SER 8 -10.268 -6.270 1.717
58 HG SER 8 HG SER 8 -12.925 -6.399 1.779
59 H SER 9 H SER 9 -12.512 -4.133 0.332
60 HA SER 9 HA SER 9 -14.482 -4.913 -1.627
61 1HB SER 9 2HB SER 9 -15.868 -3.142 -0.588
62 2HB SER 9 1HB SER 9 -15.216 -4.261 0.610
63 HG SER 9 HG SER 9 -14.232 -1.675 -0.024
64 H GLN 10 H GLN 10 -15.510 -3.323 -3.063
65 HA GLN 10 HA GLN 10 -13.493 -1.831 -4.498
66 1HB GLN 10 2HB GLN 10 -16.304 -2.680 -5.017
67 2HB GLN 10 1HB GLN 10 -15.678 -1.295 -5.913
68 1HG GLN 10 2HG GLN 10 -13.706 -3.292 -6.051
69 2HG GLN 10 1HG GLN 10 -15.249 -4.087 -6.353
70 1HE2 GLN 10 1HE2 GLN 10 -16.703 -2.792 -7.881
71 2HE2 GLN 10 2HE2 GLN 10 -15.931 -2.168 -9.304
72 H THR 11 H THR 11 -14.512 0.338 -5.510
73 HA THR 11 HA THR 11 -14.881 2.547 -5.120
74 HB THR 11 HB THR 11 -16.830 1.422 -3.101
75 HG1 THR 11 1HG THR 11 -17.039 2.086 -5.837
76 1HG2 THR 11 1HG2 THR 11 -16.391 4.192 -4.082
77 2HG2 THR 11 2HG2 THR 11 -16.854 3.618 -2.480
78 3HG2 THR 11 3HG2 THR 11 -18.040 3.637 -3.787
79 HA PRO 12 HA PRO 12 -12.251 2.314 -1.206
80 1HB PRO 12 2HB PRO 12 -9.867 2.931 -2.328
81 2HB PRO 12 1HB PRO 12 -10.464 1.271 -2.214
82 1HG PRO 12 2HG PRO 12 -10.526 3.151 -4.545
83 2HG PRO 12 1HG PRO 12 -10.116 1.422 -4.510
84 1HD PRO 12 2HD PRO 12 -12.547 2.345 -5.295
85 2HD PRO 12 1HD PRO 12 -12.325 0.771 -4.497
86 H THR 13 H THR 13 -10.662 4.122 -0.485
87 HA THR 13 HA THR 13 -11.425 6.709 -1.641
88 HB THR 13 HB THR 13 -11.374 7.379 0.968
89 HG1 THR 13 1HG THR 13 -12.497 5.759 2.116
90 1HG2 THR 13 1HG2 THR 13 -13.228 8.079 -0.233
91 2HG2 THR 13 2HG2 THR 13 -13.904 6.981 0.970
92 3HG2 THR 13 3HG2 THR 13 -13.674 6.436 -0.693
93 H THR 14 H THR 14 -10.117 8.454 -0.147
94 HA THR 14 HA THR 14 -7.331 7.498 -0.067
95 HB THR 14 HB THR 14 -6.690 9.818 -0.808
96 HG1 THR 14 1HG THR 14 -8.239 11.146 -1.607
97 1HG2 THR 14 1HG2 THR 14 -7.736 7.707 -2.419
98 2HG2 THR 14 2HG2 THR 14 -6.448 8.857 -2.778
99 3HG2 THR 14 3HG2 THR 14 -8.123 9.264 -3.150
100 H THR 15 H THR 15 -5.913 8.660 1.379
101 HA THR 15 HA THR 15 -7.099 10.419 3.347
102 HB THR 15 HB THR 15 -7.671 8.188 4.215
103 HG1 THR 15 1HG THR 15 -5.617 9.488 5.676
104 1HG2 THR 15 1HG2 THR 15 -4.741 7.660 4.554
105 2HG2 THR 15 2HG2 THR 15 -5.671 7.023 3.199
106 3HG2 THR 15 3HG2 THR 15 -6.097 6.573 4.850
107 H GLY 16 H GLY 16 -5.648 11.955 3.746
108 1HA GLY 16 2HA GLY 16 -2.938 11.643 2.925
109 2HA GLY 16 1HA GLY 16 -3.653 13.088 3.603
110 H CYS 17 H CYS 17 -1.319 10.899 4.118
111 HA CYS 17 HA CYS 17 -1.666 10.553 6.974
112 1HB CYS 17 2HB CYS 17 0.759 9.872 5.303
113 2HB CYS 17 1HB CYS 17 0.348 9.244 6.901
114 H SER 18 H SER 18 0.796 10.843 8.032
115 HA SER 18 HA SER 18 2.181 13.196 7.361
116 1HB SER 18 2HB SER 18 -0.035 14.175 8.114
117 2HB SER 18 1HB SER 18 0.342 13.575 9.728
118 HG SER 18 HG SER 18 1.998 15.326 8.230
119 H GLY 19 H GLY 19 3.722 13.860 9.084
120 1HA GLY 19 2HA GLY 19 5.091 13.425 10.912
121 2HA GLY 19 1HA GLY 19 4.069 12.052 11.315
122 H GLY 20 H GLY 20 6.528 13.132 8.990
123 1HA GLY 20 2HA GLY 20 8.123 11.968 7.820
124 2HA GLY 20 1HA GLY 20 8.269 11.038 9.309
125 H GLU 21 H GLU 21 6.169 11.288 6.439
126 HA GLU 21 HA GLU 21 6.462 8.479 5.908
127 1HB GLU 21 2HB GLU 21 4.571 8.896 7.716
128 2HB GLU 21 1HB GLU 21 3.620 9.307 6.290
129 1HG GLU 21 2HG GLU 21 3.477 7.176 5.614
130 2HG GLU 21 1HG GLU 21 5.136 6.805 6.081
131 H ASN 22 H ASN 22 6.913 8.648 3.806
132 HA ASN 22 HA ASN 22 4.991 10.075 2.101
133 1HB ASN 22 2HB ASN 22 7.461 11.086 2.575
134 2HB ASN 22 1HB ASN 22 7.802 10.069 1.180
135 1HD2 ASN 22 1HD2 ASN 22 5.930 12.767 2.367
136 2HD2 ASN 22 2HD2 ASN 22 5.556 13.440 0.821
137 H ASN 23 H ASN 23 5.370 7.223 2.807
138 HA ASN 23 HA ASN 23 5.626 6.206 0.066
139 1HB ASN 23 2HB ASN 23 6.870 4.980 2.536
140 2HB ASN 23 1HB ASN 23 6.767 4.175 0.967
141 1HD2 ASN 23 1HD2 ASN 23 7.918 5.085 -0.804
142 2HD2 ASN 23 2HD2 ASN 23 9.331 6.055 -0.527
143 H CYS 24 H CYS 24 4.189 4.619 -0.491
144 HA CYS 24 HA CYS 24 2.282 3.790 1.598
145 1HB CYS 24 2HB CYS 24 1.552 4.048 -1.311
146 2HB CYS 24 1HB CYS 24 0.484 3.961 0.092
147 H TYR 25 H TYR 25 2.381 1.695 2.005
148 HA TYR 25 HA TYR 25 3.670 -0.098 0.212
149 1HB TYR 25 2HB TYR 25 3.793 -1.580 1.988
150 2HB TYR 25 1HB TYR 25 3.823 -0.016 2.795
151 HD1 TYR 25 1HD TYR 25 1.766 0.818 3.929
152 HD2 TYR 25 2HD TYR 25 2.024 -3.134 2.361
153 HE1 TYR 25 1HE TYR 25 -0.165 0.153 5.299
154 HE2 TYR 25 2HE TYR 25 0.093 -3.804 3.727
155 HH TYR 25 HH TYR 25 -2.010 -1.750 5.082
156 H LYS 26 H LYS 26 2.725 -1.392 -1.238
157 HA LYS 26 HA LYS 26 -0.162 -1.926 -0.947
158 1HB LYS 26 2HB LYS 26 0.363 -0.425 -2.861
159 2HB LYS 26 1HB LYS 26 1.402 -1.683 -3.529
160 1HG LYS 26 2HG LYS 26 -0.322 -2.673 -4.499
161 2HG LYS 26 1HG LYS 26 -1.198 -2.759 -2.969
162 1HD LYS 26 2HD LYS 26 -2.572 -1.127 -3.606
163 2HD LYS 26 1HD LYS 26 -1.212 -0.062 -3.968
164 1HE LYS 26 2HE LYS 26 -2.411 -0.286 -5.988
165 2HE LYS 26 1HE LYS 26 -0.989 -1.315 -6.156
166 1HZ LYS 26 1HZ LYS 26 -3.597 -2.377 -5.244
167 2HZ LYS 26 2HZ LYS 26 -2.266 -3.236 -5.836
168 3HZ LYS 26 3HZ LYS 26 -3.190 -2.283 -6.884
169 H LYS 27 H LYS 27 -0.471 -3.997 -0.402
170 HA LYS 27 HA LYS 27 1.257 -6.026 -1.640
171 1HB LYS 27 2HB LYS 27 0.709 -7.208 0.686
172 2HB LYS 27 1HB LYS 27 2.117 -6.193 0.458
173 1HG LYS 27 2HG LYS 27 1.283 -4.534 1.757
174 2HG LYS 27 1HG LYS 27 -0.393 -4.908 1.363
175 1HD LYS 27 2HD LYS 27 -0.391 -5.720 3.479
176 2HD LYS 27 1HD LYS 27 0.263 -7.150 2.679
177 1HE LYS 27 2HE LYS 27 2.021 -4.971 3.776
178 2HE LYS 27 1HE LYS 27 1.477 -6.329 4.762
179 1HZ LYS 27 1HZ LYS 27 3.720 -6.359 3.347
180 2HZ LYS 27 2HZ LYS 27 2.664 -7.006 2.196
181 3HZ LYS 27 3HZ LYS 27 2.836 -7.758 3.701
182 H GLU 28 H GLU 28 0.179 -7.599 -2.663
183 HA GLU 28 HA GLU 28 -2.682 -7.921 -2.101
184 1HB GLU 28 2HB GLU 28 -2.740 -8.935 -4.387
185 2HB GLU 28 1HB GLU 28 -2.344 -7.222 -4.359
186 1HG GLU 28 2HG GLU 28 -0.484 -7.622 -5.482
187 2HG GLU 28 1HG GLU 28 0.070 -8.721 -4.222
188 H TRP 29 H TRP 29 -3.185 -9.700 -0.989
189 HA TRP 29 HA TRP 29 -1.487 -12.080 -1.332
190 1HB TRP 29 2HB TRP 29 -1.764 -12.664 0.938
191 2HB TRP 29 1HB TRP 29 -1.417 -10.943 0.951
192 HD1 TRP 29 HD TRP 29 -3.778 -13.412 2.226
193 HE1 TRP 29 1HE TRP 29 -5.799 -12.278 3.354
194 HE3 TRP 29 3HE TRP 29 -3.028 -8.646 0.579
195 HZ2 TRP 29 2HZ TRP 29 -6.917 -9.688 3.519
196 HZ3 TRP 29 3HZ TRP 29 -4.614 -6.899 1.265
197 HH2 TRP 29 HH TRP 29 -6.515 -7.404 2.705
198 H ARG 30 H ARG 30 -2.431 -13.903 -1.988
199 HA ARG 30 HA ARG 30 -5.346 -13.911 -2.276
200 1HB ARG 30 2HB ARG 30 -4.737 -15.947 -3.788
201 2HB ARG 30 1HB ARG 30 -4.480 -14.312 -4.387
202 1HG ARG 30 2HG ARG 30 -2.123 -14.463 -3.860
203 2HG ARG 30 1HG ARG 30 -2.360 -16.067 -3.162
204 1HD ARG 30 2HD ARG 30 -3.300 -15.660 -5.938
205 2HD ARG 30 1HD ARG 30 -1.556 -15.673 -5.684
206 HE ARG 30 HE ARG 30 -3.355 -17.908 -5.501
207 1HH1 ARG 30 1HH1 ARG 30 -0.272 -16.626 -4.487
208 2HH1 ARG 30 2HH1 ARG 30 0.421 -18.186 -4.193
209 1HH2 ARG 30 1HH2 ARG 30 -2.445 -19.961 -5.115
210 2HH2 ARG 30 2HH2 ARG 30 -0.812 -20.078 -4.549
211 H ASP 31 H ASP 31 -6.318 -16.202 -2.166
212 HA ASP 31 HA ASP 31 -5.099 -17.701 0.054
213 1HB ASP 31 2HB ASP 31 -7.696 -18.144 0.577
214 2HB ASP 31 1HB ASP 31 -6.792 -16.805 1.290
215 H ASN 32 H ASN 32 -8.136 -18.233 -1.700
216 HA ASN 32 HA ASN 32 -7.049 -20.326 -3.327
217 1HB ASN 32 2HB ASN 32 -8.556 -22.102 -2.305
218 2HB ASN 32 1HB ASN 32 -7.133 -21.661 -1.366
219 1HD2 ASN 32 1HD2 ASN 32 -7.431 -20.172 0.406
220 2HD2 ASN 32 2HD2 ASN 32 -8.937 -20.152 1.254
221 H ARG 33 H ARG 33 -9.980 -18.957 -1.881
222 HA ARG 33 HA ARG 33 -11.494 -19.568 -4.295
223 1HB ARG 33 2HB ARG 33 -13.291 -18.242 -2.817
224 2HB ARG 33 1HB ARG 33 -12.971 -19.962 -2.611
225 1HG ARG 33 2HG ARG 33 -11.506 -19.497 -0.751
226 2HG ARG 33 1HG ARG 33 -11.712 -17.761 -0.984
227 1HD ARG 33 2HD ARG 33 -13.196 -18.238 0.738
228 2HD ARG 33 1HD ARG 33 -14.227 -18.245 -0.691
229 HE ARG 33 HE ARG 33 -13.323 -20.852 -0.260
230 1HH1 ARG 33 1HH1 ARG 33 -15.378 -18.488 1.279
231 2HH1 ARG 33 2HH1 ARG 33 -16.391 -19.673 2.031
232 1HH2 ARG 33 1HH2 ARG 33 -14.655 -22.413 0.728
233 2HH2 ARG 33 2HH2 ARG 33 -15.980 -21.902 1.720
234 H GLY 34 H GLY 34 -10.073 -16.878 -2.596
235 1HA GLY 34 2HA GLY 34 -10.478 -15.205 -4.947
236 2HA GLY 34 1HA GLY 34 -11.187 -14.623 -3.449
237 H TYR 35 H TYR 35 -9.776 -12.769 -3.731
238 HA TYR 35 HA TYR 35 -7.327 -13.110 -2.267
239 1HB TYR 35 2HB TYR 35 -5.995 -11.892 -4.106
240 2HB TYR 35 1HB TYR 35 -6.303 -13.613 -4.312
241 HD1 TYR 35 1HD TYR 35 -7.885 -10.335 -5.175
242 HD2 TYR 35 2HD TYR 35 -7.027 -14.322 -6.383
243 HE1 TYR 35 1HE TYR 35 -8.900 -9.882 -7.368
244 HE2 TYR 35 2HE TYR 35 -8.040 -13.882 -8.579
245 HH TYR 35 HH TYR 35 -9.981 -11.244 -9.213
246 H ARG 36 H ARG 36 -6.514 -11.178 -1.432
247 HA ARG 36 HA ARG 36 -8.063 -8.750 -2.021
248 1HB ARG 36 2HB ARG 36 -7.358 -9.772 0.739
249 2HB ARG 36 1HB ARG 36 -8.112 -8.215 0.390
250 1HG ARG 36 2HG ARG 36 -10.137 -9.122 0.250
251 2HG ARG 36 1HG ARG 36 -9.569 -10.423 -0.797
252 1HD ARG 36 2HD ARG 36 -9.510 -11.876 0.894
253 2HD ARG 36 1HD ARG 36 -8.633 -10.746 1.926
254 HE ARG 36 HE ARG 36 -10.612 -10.176 2.927
255 1HH1 ARG 36 1HH1 ARG 36 -11.297 -11.896 -0.030
256 2HH1 ARG 36 2HH1 ARG 36 -12.995 -12.017 0.287
257 1HH2 ARG 36 1HH2 ARG 36 -12.845 -10.334 3.346
258 2HH2 ARG 36 2HH2 ARG 36 -13.874 -11.131 2.203
259 H THR 37 H THR 37 -6.984 -6.762 -1.421
260 HA THR 37 HA THR 37 -4.116 -6.967 -0.900
261 HB THR 37 HB THR 37 -4.180 -6.952 -3.302
262 HG1 THR 37 1HG THR 37 -3.133 -4.948 -3.699
263 1HG2 THR 37 1HG2 THR 37 -5.176 -4.631 -4.232
264 2HG2 THR 37 2HG2 THR 37 -6.324 -4.983 -2.940
265 3HG2 THR 37 3HG2 THR 37 -6.058 -6.158 -4.229
266 H GLU 38 H GLU 38 -3.466 -5.462 0.509
267 HA GLU 38 HA GLU 38 -5.323 -3.287 1.127
268 1HB GLU 38 2HB GLU 38 -3.646 -3.101 3.151
269 2HB GLU 38 1HB GLU 38 -4.934 -4.291 3.146
270 1HG GLU 38 2HG GLU 38 -3.352 -5.996 2.403
271 2HG GLU 38 1HG GLU 38 -2.064 -4.794 2.390
272 H ARG 39 H ARG 39 -4.510 -1.171 1.546
273 HA ARG 39 HA ARG 39 -1.850 -0.519 0.583
274 1HB ARG 39 2HB ARG 39 -2.802 1.211 -0.992
275 2HB ARG 39 1HB ARG 39 -2.989 -0.460 -1.502
276 1HG ARG 39 2HG ARG 39 -5.239 0.539 0.064
277 2HG ARG 39 1HG ARG 39 -4.969 1.422 -1.440
278 1HD ARG 39 2HD ARG 39 -4.795 -0.926 -2.509
279 2HD ARG 39 1HD ARG 39 -5.591 -1.482 -1.037
280 HE ARG 39 HE ARG 39 -6.952 0.708 -2.285
281 1HH1 ARG 39 1HH1 ARG 39 -6.533 -2.756 -2.320
282 2HH1 ARG 39 2HH1 ARG 39 -8.082 -3.062 -3.031
283 1HH2 ARG 39 1HH2 ARG 39 -8.988 0.309 -3.222
284 2HH2 ARG 39 2HH2 ARG 39 -9.476 -1.322 -3.543
285 H GLY 40 H GLY 40 -1.019 0.947 1.911
286 1HA GLY 40 2HA GLY 40 -2.622 3.178 2.843
287 2HA GLY 40 1HA GLY 40 -2.102 2.061 4.103
288 H CYS 41 H CYS 41 -0.810 3.584 5.135
289 HA CYS 41 HA CYS 41 1.478 4.614 3.606
290 1HB CYS 41 2HB CYS 41 -0.048 5.585 5.958
291 2HB CYS 41 1HB CYS 41 1.691 5.889 5.973
292 H GLY 42 H GLY 42 3.603 4.528 4.555
293 1HA GLY 42 2HA GLY 42 5.282 3.615 5.879
294 2HA GLY 42 1HA GLY 42 4.051 2.790 6.822
295 H CYS 43 H CYS 43 6.637 2.206 5.005
296 HA CYS 43 HA CYS 43 5.517 -0.224 3.777
297 1HB CYS 43 2HB CYS 43 6.586 1.307 2.183
298 2HB CYS 43 1HB CYS 43 8.078 1.239 3.114
299 HA PRO 44 HA PRO 44 7.894 -1.937 7.292
300 1HB PRO 44 2HB PRO 44 6.499 -4.264 7.410
301 2HB PRO 44 1HB PRO 44 5.938 -2.765 8.171
302 1HG PRO 44 2HG PRO 44 5.132 -3.982 5.554
303 2HG PRO 44 1HG PRO 44 4.116 -3.241 6.804
304 1HD PRO 44 2HD PRO 44 4.843 -1.927 4.554
305 2HD PRO 44 1HD PRO 44 4.599 -1.097 6.104
306 H SER 45 H SER 45 9.172 -3.924 7.491
307 HA SER 45 HA SER 45 10.120 -4.809 4.863
308 1HB SER 45 2HB SER 45 11.955 -5.810 6.585
309 2HB SER 45 1HB SER 45 12.047 -4.186 5.904
310 HG SER 45 HG SER 45 10.760 -4.801 8.355
311 H VAL 46 H VAL 46 7.948 -6.092 5.036
312 HA VAL 46 HA VAL 46 8.048 -8.474 6.640
313 HB VAL 46 HB VAL 46 6.024 -9.100 5.237
314 1HG1 VAL 46 1HG1 VAL 46 4.634 -7.974 6.667
315 2HG1 VAL 46 2HG1 VAL 46 5.537 -6.466 6.526
316 3HG1 VAL 46 3HG1 VAL 46 6.175 -7.785 7.506
317 1HG2 VAL 46 1HG2 VAL 46 6.881 -7.231 3.509
318 2HG2 VAL 46 2HG2 VAL 46 5.723 -6.280 4.440
319 3HG2 VAL 46 3HG2 VAL 46 5.201 -7.753 3.623
320 H LYS 47 H LYS 47 7.702 -10.637 5.561
321 HA LYS 47 HA LYS 47 9.059 -10.896 2.985
322 1HB LYS 47 2HB LYS 47 10.489 -12.727 3.881
323 2HB LYS 47 1HB LYS 47 10.872 -11.146 4.548
324 1HG LYS 47 2HG LYS 47 10.737 -12.063 6.560
325 2HG LYS 47 1HG LYS 47 8.997 -12.203 6.304
326 1HD LYS 47 2HD LYS 47 9.307 -14.404 6.577
327 2HD LYS 47 1HD LYS 47 9.980 -14.378 4.946
328 1HE LYS 47 2HE LYS 47 11.762 -13.731 7.244
329 2HE LYS 47 1HE LYS 47 11.320 -15.414 6.964
330 1HZ LYS 47 1HZ LYS 47 12.750 -13.585 5.124
331 2HZ LYS 47 2HZ LYS 47 12.094 -15.060 4.617
332 3HZ LYS 47 3HZ LYS 47 13.310 -15.035 5.792
333 H LYS 48 H LYS 48 7.558 -11.893 1.807
334 HA LYS 48 HA LYS 48 6.718 -14.539 2.467
335 1HB LYS 48 2HB LYS 48 4.898 -12.259 2.982
336 2HB LYS 48 1HB LYS 48 4.195 -13.638 2.147
337 1HG LYS 48 2HG LYS 48 4.014 -14.749 4.050
338 2HG LYS 48 1HG LYS 48 5.742 -14.572 4.358
339 1HD LYS 48 2HD LYS 48 5.402 -12.477 5.460
340 2HD LYS 48 1HD LYS 48 3.709 -12.432 4.967
341 1HE LYS 48 2HE LYS 48 3.374 -13.240 7.049
342 2HE LYS 48 1HE LYS 48 3.743 -14.779 6.273
343 1HZ LYS 48 1HZ LYS 48 5.243 -14.917 7.920
344 2HZ LYS 48 2HZ LYS 48 5.300 -13.246 8.179
345 3HZ LYS 48 3HZ LYS 48 6.187 -13.935 6.915
346 H GLY 49 H GLY 49 4.723 -15.053 0.815
347 1HA GLY 49 2HA GLY 49 5.860 -14.390 -1.799
348 2HA GLY 49 1HA GLY 49 4.720 -15.691 -1.458
349 H ILE 50 H ILE 50 4.539 -12.233 -0.673
350 HA ILE 50 HA ILE 50 1.887 -12.146 -1.888
351 HB ILE 50 HB ILE 50 3.302 -9.992 -0.313
352 1HG1 ILE 50 2HG1 ILE 50 1.505 -12.258 0.544
353 2HG1 ILE 50 1HG1 ILE 50 3.092 -11.819 1.180
354 1HG2 ILE 50 1HG2 ILE 50 0.342 -10.270 -0.651
355 2HG2 ILE 50 2HG2 ILE 50 1.314 -9.471 -1.886
356 3HG2 ILE 50 3HG2 ILE 50 1.291 -8.843 -0.240
357 1HD1 ILE 50 1HD1 ILE 50 1.641 -11.123 2.836
358 2HD1 ILE 50 2HD1 ILE 50 0.434 -10.551 1.683
359 3HD1 ILE 50 3HD1 ILE 50 1.926 -9.641 1.924
360 H GLY 51 H GLY 51 1.312 -10.797 -3.565
361 1HA GLY 51 2HA GLY 51 3.462 -10.023 -5.333
362 2HA GLY 51 1HA GLY 51 1.741 -9.921 -5.671
363 H ILE 52 H ILE 52 3.215 -7.893 -6.529
364 HA ILE 52 HA ILE 52 3.560 -5.658 -6.482
365 HB ILE 52 HB ILE 52 1.035 -5.837 -6.295
366 1HG1 ILE 52 2HG1 ILE 52 1.818 -3.272 -5.024
367 2HG1 ILE 52 1HG1 ILE 52 2.653 -3.705 -6.519
368 1HG2 ILE 52 1HG2 ILE 52 1.725 -5.688 -3.449
369 2HG2 ILE 52 2HG2 ILE 52 0.293 -6.336 -4.240
370 3HG2 ILE 52 3HG2 ILE 52 0.437 -4.603 -3.960
371 1HD1 ILE 52 1HD1 ILE 52 0.607 -3.781 -7.724
372 2HD1 ILE 52 2HD1 ILE 52 0.630 -2.276 -6.805
373 3HD1 ILE 52 3HD1 ILE 52 -0.340 -3.638 -6.243
374 H ASN 53 H ASN 53 4.041 -3.713 -5.105
375 HA ASN 53 HA ASN 53 4.939 -4.386 -2.400
376 1HB ASN 53 2HB ASN 53 6.681 -4.323 -4.593
377 2HB ASN 53 1HB ASN 53 6.940 -2.790 -3.755
378 1HD2 ASN 53 1HD2 ASN 53 8.244 -2.792 -2.065
379 2HD2 ASN 53 2HD2 ASN 53 8.791 -4.191 -1.211
380 H CYS 54 H CYS 54 6.391 -2.057 -1.949
381 HA CYS 54 HA CYS 54 4.225 -0.184 -1.580
382 1HB CYS 54 2HB CYS 54 7.107 0.300 -0.844
383 2HB CYS 54 1HB CYS 54 5.658 0.985 -0.105
384 H CYS 55 H CYS 55 4.849 2.233 -1.876
385 HA CYS 55 HA CYS 55 6.403 2.719 -4.287
386 1HB CYS 55 2HB CYS 55 4.408 4.108 -5.178
387 2HB CYS 55 1HB CYS 55 4.374 2.356 -5.392
388 H THR 56 H THR 56 6.009 5.249 -4.829
389 HA THR 56 HA THR 56 5.879 6.801 -2.365
390 HB THR 56 HB THR 56 8.224 6.207 -2.477
391 HG1 THR 56 1HG THR 56 7.612 8.417 -1.967
392 1HG2 THR 56 1HG2 THR 56 8.668 5.639 -4.699
393 2HG2 THR 56 2HG2 THR 56 9.591 7.113 -4.408
394 3HG2 THR 56 3HG2 THR 56 8.074 7.186 -5.303
395 H THR 57 H THR 57 3.914 7.044 -4.016
396 HA THR 57 HA THR 57 4.258 9.675 -5.170
397 HB THR 57 HB THR 57 2.901 8.540 -7.240
398 HG1 THR 57 1HG THR 57 4.929 6.700 -6.509
399 1HG2 THR 57 1HG2 THR 57 5.705 9.336 -6.833
400 2HG2 THR 57 2HG2 THR 57 4.528 9.874 -8.031
401 3HG2 THR 57 3HG2 THR 57 5.366 8.338 -8.246
402 H ASP 58 H ASP 58 2.242 10.731 -5.643
403 HA ASP 58 HA ASP 58 0.253 10.304 -3.753
404 1HB ASP 58 2HB ASP 58 -1.053 11.939 -5.023
405 2HB ASP 58 1HB ASP 58 0.622 12.451 -4.884
406 H ARG 59 H ARG 59 -1.394 8.934 -3.621
407 HA ARG 59 HA ARG 59 -2.844 7.253 -4.124
408 1HB ARG 59 2HB ARG 59 -2.980 8.702 -6.774
409 2HB ARG 59 1HB ARG 59 -4.142 7.514 -6.200
410 1HG ARG 59 2HG ARG 59 -4.217 9.232 -4.145
411 2HG ARG 59 1HG ARG 59 -3.794 10.345 -5.453
412 1HD ARG 59 2HD ARG 59 -5.715 9.352 -6.753
413 2HD ARG 59 1HD ARG 59 -6.193 8.532 -5.262
414 HE ARG 59 HE ARG 59 -7.051 10.508 -4.514
415 1HH1 ARG 59 1HH1 ARG 59 -4.804 11.195 -7.095
416 2HH1 ARG 59 2HH1 ARG 59 -5.179 12.884 -7.141
417 1HH2 ARG 59 1HH2 ARG 59 -7.545 12.731 -4.573
418 2HH2 ARG 59 2HH2 ARG 59 -6.734 13.757 -5.709
419 H CYS 60 H CYS 60 0.027 6.894 -4.748
420 HA CYS 60 HA CYS 60 0.364 5.459 -7.137
421 1HB CYS 60 2HB CYS 60 2.451 4.704 -6.171
422 2HB CYS 60 1HB CYS 60 2.209 6.404 -5.778
423 H ASN 61 H ASN 61 -0.887 4.556 -4.016
424 HA ASN 61 HA ASN 61 -0.936 1.730 -4.805
425 1HB ASN 61 2HB ASN 61 -1.453 1.257 -2.455
426 2HB ASN 61 1HB ASN 61 0.020 2.221 -2.595
427 1HD2 ASN 61 1HD2 ASN 61 -1.064 2.209 -0.213
428 2HD2 ASN 61 2HD2 ASN 61 -1.905 3.688 0.133
429 H ASN 62 H ASN 62 -2.634 2.674 -6.388
430 HA ASN 62 HA ASN 62 -5.274 2.824 -5.115
431 1HB ASN 62 2HB ASN 62 -4.592 4.633 -6.705
432 2HB ASN 62 1HB ASN 62 -4.541 3.422 -7.990
433 1HD2 ASN 62 1HD2 ASN 62 -6.174 5.755 -7.899
434 2HD2 ASN 62 2HD2 ASN 62 -7.828 5.225 -7.907
Start of MODEL 18
1 1H LEU 1 1HT LEU 1 2.850 13.716 2.093
2 2H LEU 1 2HT LEU 1 1.678 12.830 2.981
3 3H LEU 1 3HT LEU 1 1.301 14.392 2.378
4 HA LEU 1 HA LEU 1 1.416 13.643 0.165
5 1HB LEU 1 2HB LEU 1 3.151 11.804 1.150
6 2HB LEU 1 1HB LEU 1 1.720 10.811 0.948
7 HG LEU 1 HG LEU 1 1.803 12.075 -1.460
8 1HD1 LEU 1 1HD1 LEU 1 3.894 12.552 -2.195
9 2HD1 LEU 1 2HD1 LEU 1 4.658 11.364 -1.139
10 3HD1 LEU 1 3HD1 LEU 1 4.135 12.916 -0.486
11 1HD2 LEU 1 1HD2 LEU 1 1.474 9.721 -1.214
12 2HD2 LEU 1 2HD2 LEU 1 3.118 9.500 -0.613
13 3HD2 LEU 1 3HD2 LEU 1 2.848 9.967 -2.292
14 H GLU 2 H GLU 2 -0.026 11.528 -0.672
15 HA GLU 2 HA GLU 2 -2.233 10.989 1.104
16 1HB GLU 2 2HB GLU 2 -2.359 13.274 -0.544
17 2HB GLU 2 1HB GLU 2 -3.399 12.073 -1.297
18 1HG GLU 2 2HG GLU 2 -4.101 11.878 1.340
19 2HG GLU 2 1HG GLU 2 -3.764 13.603 1.158
20 H CYS 3 H CYS 3 -2.438 8.873 0.788
21 HA CYS 3 HA CYS 3 -2.286 7.841 -1.966
22 1HB CYS 3 2HB CYS 3 -1.477 6.699 0.676
23 2HB CYS 3 1HB CYS 3 -1.980 5.599 -0.609
24 H HIS 4 H HIS 4 -3.493 5.523 -1.932
25 HA HIS 4 HA HIS 4 -6.269 6.195 -1.417
26 1HB HIS 4 2HB HIS 4 -4.875 4.030 -2.979
27 2HB HIS 4 1HB HIS 4 -6.606 3.963 -2.652
28 HD1 HIS 4 1HD HIS 4 -8.107 5.708 -3.855
29 HD2 HIS 4 2HD HIS 4 -4.086 5.902 -4.886
30 HE1 HIS 4 1HE HIS 4 -8.009 7.158 -5.907
31 HE2 HIS 4 2HE HIS 4 -5.577 7.187 -6.565
32 H ASN 5 H ASN 5 -7.718 4.736 -0.345
33 HA ASN 5 HA ASN 5 -6.377 3.087 1.696
34 1HB ASN 5 2HB ASN 5 -8.496 3.516 3.048
35 2HB ASN 5 1HB ASN 5 -7.428 4.899 2.815
36 1HD2 ASN 5 1HD2 ASN 5 -9.682 5.681 3.539
37 2HD2 ASN 5 2HD2 ASN 5 -10.693 6.218 2.243
38 H GLN 6 H GLN 6 -8.797 3.174 -0.784
39 HA GLN 6 HA GLN 6 -10.452 1.071 -0.142
40 1HB GLN 6 2HB GLN 6 -10.396 2.648 -2.224
41 2HB GLN 6 1HB GLN 6 -9.430 1.363 -2.947
42 1HG GLN 6 2HG GLN 6 -11.357 -0.186 -2.230
43 2HG GLN 6 1HG GLN 6 -12.285 1.303 -2.060
44 1HE2 GLN 6 1HE2 GLN 6 -13.663 0.550 -3.726
45 2HE2 GLN 6 2HE2 GLN 6 -13.190 0.660 -5.384
46 H GLN 7 H GLN 7 -10.477 -1.158 -0.743
47 HA GLN 7 HA GLN 7 -8.051 -2.421 -1.644
48 1HB GLN 7 2HB GLN 7 -7.907 -3.890 0.400
49 2HB GLN 7 1HB GLN 7 -7.418 -2.213 0.640
50 1HG GLN 7 2HG GLN 7 -10.220 -3.042 1.246
51 2HG GLN 7 1HG GLN 7 -8.926 -3.397 2.389
52 1HE2 GLN 7 1HE2 GLN 7 -11.049 -1.045 1.171
53 2HE2 GLN 7 2HE2 GLN 7 -10.475 0.298 2.095
54 H SER 8 H SER 8 -8.720 -3.931 -3.004
55 HA SER 8 HA SER 8 -9.979 -5.528 -4.024
56 1HB SER 8 2HB SER 8 -10.693 -7.330 -2.695
57 2HB SER 8 1HB SER 8 -9.388 -6.612 -1.751
58 HG SER 8 HG SER 8 -11.426 -7.112 -0.616
59 H SER 9 H SER 9 -11.144 -2.885 -3.609
60 HA SER 9 HA SER 9 -13.107 -1.793 -3.964
61 1HB SER 9 2HB SER 9 -14.304 -4.475 -4.668
62 2HB SER 9 1HB SER 9 -14.793 -2.883 -5.249
63 HG SER 9 HG SER 9 -12.775 -2.754 -6.328
64 H GLN 10 H GLN 10 -12.521 -2.756 -1.332
65 HA GLN 10 HA GLN 10 -14.914 -3.818 -0.166
66 1HB GLN 10 2HB GLN 10 -12.285 -2.837 0.855
67 2HB GLN 10 1HB GLN 10 -13.633 -2.961 1.986
68 1HG GLN 10 2HG GLN 10 -13.707 -5.371 0.673
69 2HG GLN 10 1HG GLN 10 -11.980 -5.041 0.803
70 1HE2 GLN 10 1HE2 GLN 10 -14.954 -5.501 2.579
71 2HE2 GLN 10 2HE2 GLN 10 -14.213 -5.870 4.106
72 H THR 11 H THR 11 -13.460 -0.625 -0.478
73 HA THR 11 HA THR 11 -15.931 0.687 -0.254
74 HB THR 11 HB THR 11 -14.354 1.745 1.952
75 HG1 THR 11 1HG THR 11 -14.300 0.062 3.234
76 1HG2 THR 11 1HG2 THR 11 -16.746 2.268 1.466
77 2HG2 THR 11 2HG2 THR 11 -16.408 1.779 3.126
78 3HG2 THR 11 3HG2 THR 11 -17.143 0.636 2.001
79 HA PRO 12 HA PRO 12 -12.901 3.119 -2.611
80 1HB PRO 12 2HB PRO 12 -14.771 4.596 -3.939
81 2HB PRO 12 1HB PRO 12 -14.264 2.982 -4.448
82 1HG PRO 12 2HG PRO 12 -16.684 3.806 -2.890
83 2HG PRO 12 1HG PRO 12 -16.548 2.628 -4.213
84 1HD PRO 12 2HD PRO 12 -16.677 1.875 -1.625
85 2HD PRO 12 1HD PRO 12 -15.720 0.977 -2.825
86 H THR 13 H THR 13 -11.906 4.625 -1.431
87 HA THR 13 HA THR 13 -13.243 7.113 -0.860
88 HB THR 13 HB THR 13 -12.478 6.988 1.596
89 HG1 THR 13 1HG THR 13 -12.648 4.216 1.039
90 1HG2 THR 13 1HG2 THR 13 -14.901 6.559 0.519
91 2HG2 THR 13 2HG2 THR 13 -14.570 6.526 2.251
92 3HG2 THR 13 3HG2 THR 13 -14.639 5.019 1.337
93 H THR 14 H THR 14 -11.553 8.448 0.640
94 HA THR 14 HA THR 14 -8.863 7.981 -0.454
95 HB THR 14 HB THR 14 -8.765 10.593 -0.497
96 HG1 THR 14 1HG THR 14 -10.817 11.477 -1.033
97 1HG2 THR 14 1HG2 THR 14 -9.280 10.669 -2.768
98 2HG2 THR 14 2HG2 THR 14 -10.471 9.374 -2.634
99 3HG2 THR 14 3HG2 THR 14 -8.751 9.011 -2.488
100 H THR 15 H THR 15 -7.184 8.355 0.915
101 HA THR 15 HA THR 15 -7.804 9.508 3.549
102 HB THR 15 HB THR 15 -7.736 7.041 3.706
103 HG1 THR 15 1HG THR 15 -7.069 8.089 5.526
104 1HG2 THR 15 1HG2 THR 15 -5.565 5.891 3.509
105 2HG2 THR 15 2HG2 THR 15 -4.898 7.342 2.758
106 3HG2 THR 15 3HG2 THR 15 -6.199 6.454 1.963
107 H GLY 16 H GLY 16 -5.507 9.681 4.768
108 1HA GLY 16 2HA GLY 16 -3.354 10.421 3.052
109 2HA GLY 16 1HA GLY 16 -4.147 11.798 3.793
110 H CYS 17 H CYS 17 -1.402 10.757 4.112
111 HA CYS 17 HA CYS 17 -1.426 9.933 6.927
112 1HB CYS 17 2HB CYS 17 1.028 10.099 5.188
113 2HB CYS 17 1HB CYS 17 0.766 9.121 6.635
114 H SER 18 H SER 18 0.395 10.892 8.274
115 HA SER 18 HA SER 18 0.969 13.678 7.588
116 1HB SER 18 2HB SER 18 -1.160 13.384 9.064
117 2HB SER 18 1HB SER 18 -0.010 13.043 10.356
118 HG SER 18 HG SER 18 -0.259 15.196 10.450
119 H GLY 19 H GLY 19 2.249 14.574 9.731
120 1HA GLY 19 2HA GLY 19 4.114 14.370 11.085
121 2HA GLY 19 1HA GLY 19 4.019 12.626 10.890
122 H GLY 20 H GLY 20 4.775 11.766 8.765
123 1HA GLY 20 2HA GLY 20 6.310 13.250 6.985
124 2HA GLY 20 1HA GLY 20 7.373 12.615 8.235
125 H GLU 21 H GLU 21 4.555 11.250 6.542
126 HA GLU 21 HA GLU 21 6.277 9.006 5.713
127 1HB GLU 21 2HB GLU 21 4.266 8.760 7.480
128 2HB GLU 21 1HB GLU 21 3.356 8.557 5.983
129 1HG GLU 21 2HG GLU 21 4.149 6.506 5.654
130 2HG GLU 21 1HG GLU 21 5.802 6.988 6.034
131 H ASN 22 H ASN 22 6.585 9.008 3.597
132 HA ASN 22 HA ASN 22 4.442 10.030 1.856
133 1HB ASN 22 2HB ASN 22 7.438 10.041 1.567
134 2HB ASN 22 1HB ASN 22 6.384 10.244 0.171
135 1HD2 ASN 22 1HD2 ASN 22 6.761 11.495 3.471
136 2HD2 ASN 22 2HD2 ASN 22 6.447 13.144 3.063
137 H ASN 23 H ASN 23 6.436 7.305 2.605
138 HA ASN 23 HA ASN 23 5.918 5.917 0.132
139 1HB ASN 23 2HB ASN 23 7.249 5.153 2.724
140 2HB ASN 23 1HB ASN 23 6.932 3.960 1.462
141 1HD2 ASN 23 1HD2 ASN 23 8.267 7.238 1.772
142 2HD2 ASN 23 2HD2 ASN 23 9.618 6.968 0.715
143 H CYS 24 H CYS 24 4.377 4.438 -0.286
144 HA CYS 24 HA CYS 24 2.527 3.742 1.899
145 1HB CYS 24 2HB CYS 24 1.839 4.202 -1.013
146 2HB CYS 24 1HB CYS 24 0.704 3.735 0.257
147 H TYR 25 H TYR 25 2.590 1.652 2.359
148 HA TYR 25 HA TYR 25 3.795 -0.220 0.603
149 1HB TYR 25 2HB TYR 25 3.867 -1.660 2.408
150 2HB TYR 25 1HB TYR 25 3.879 -0.091 3.204
151 HD1 TYR 25 1HD TYR 25 1.930 -3.109 2.529
152 HD2 TYR 25 2HD TYR 25 1.944 0.677 4.466
153 HE1 TYR 25 1HE TYR 25 -0.049 -3.776 3.828
154 HE2 TYR 25 2HE TYR 25 -0.034 0.021 5.774
155 HH TYR 25 HH TYR 25 -1.968 -1.641 5.479
156 H LYS 26 H LYS 26 2.854 -1.634 -0.750
157 HA LYS 26 HA LYS 26 -0.064 -2.004 -0.546
158 1HB LYS 26 2HB LYS 26 0.992 -0.609 -2.541
159 2HB LYS 26 1HB LYS 26 1.315 -2.217 -3.190
160 1HG LYS 26 2HG LYS 26 -0.895 -2.680 -3.518
161 2HG LYS 26 1HG LYS 26 -1.428 -1.613 -2.218
162 1HD LYS 26 2HD LYS 26 -2.019 -0.243 -3.902
163 2HD LYS 26 1HD LYS 26 -0.303 0.170 -3.926
164 1HE LYS 26 2HE LYS 26 0.098 -1.021 -5.829
165 2HE LYS 26 1HE LYS 26 -1.177 -2.194 -5.494
166 1HZ LYS 26 1HZ LYS 26 -1.794 -0.841 -7.361
167 2HZ LYS 26 2HZ LYS 26 -1.548 0.583 -6.482
168 3HZ LYS 26 3HZ LYS 26 -2.809 -0.463 -6.061
169 H LYS 27 H LYS 27 -0.437 -4.054 0.080
170 HA LYS 27 HA LYS 27 1.116 -6.184 -1.193
171 1HB LYS 27 2HB LYS 27 0.741 -7.290 1.191
172 2HB LYS 27 1HB LYS 27 2.161 -6.337 0.819
173 1HG LYS 27 2HG LYS 27 0.890 -4.369 1.792
174 2HG LYS 27 1HG LYS 27 -0.258 -5.556 2.404
175 1HD LYS 27 2HD LYS 27 2.401 -6.415 3.018
176 2HD LYS 27 1HD LYS 27 2.190 -4.751 3.561
177 1HE LYS 27 2HE LYS 27 0.823 -5.359 5.222
178 2HE LYS 27 1HE LYS 27 -0.096 -6.444 4.180
179 1HZ LYS 27 1HZ LYS 27 1.243 -8.211 4.681
180 2HZ LYS 27 2HZ LYS 27 1.297 -7.377 6.151
181 3HZ LYS 27 3HZ LYS 27 2.584 -7.253 5.061
182 H GLU 28 H GLU 28 -0.059 -7.883 -1.881
183 HA GLU 28 HA GLU 28 -2.901 -7.958 -1.138
184 1HB GLU 28 2HB GLU 28 -2.995 -9.309 -3.374
185 2HB GLU 28 1HB GLU 28 -2.964 -7.549 -3.410
186 1HG GLU 28 2HG GLU 28 -0.499 -7.687 -3.765
187 2HG GLU 28 1HG GLU 28 -0.672 -9.433 -3.913
188 H TRP 29 H TRP 29 -3.450 -9.629 0.096
189 HA TRP 29 HA TRP 29 -1.795 -12.057 -0.026
190 1HB TRP 29 2HB TRP 29 -2.282 -12.495 2.234
191 2HB TRP 29 1HB TRP 29 -1.994 -10.765 2.182
192 HD1 TRP 29 HD TRP 29 -4.446 -13.273 3.241
193 HE1 TRP 29 1HE TRP 29 -6.595 -12.153 4.118
194 HE3 TRP 29 3HE TRP 29 -3.555 -8.513 1.648
195 HZ2 TRP 29 2HZ TRP 29 -7.749 -9.576 4.129
196 HZ3 TRP 29 3HZ TRP 29 -5.229 -6.774 2.131
197 HH2 TRP 29 HH TRP 29 -7.280 -7.295 3.348
198 H ARG 30 H ARG 30 -2.750 -14.075 -0.197
199 HA ARG 30 HA ARG 30 -5.529 -14.025 -1.144
200 1HB ARG 30 2HB ARG 30 -4.695 -16.458 -1.912
201 2HB ARG 30 1HB ARG 30 -4.477 -15.016 -2.899
202 1HG ARG 30 2HG ARG 30 -2.439 -16.278 -2.869
203 2HG ARG 30 1HG ARG 30 -2.198 -14.779 -1.969
204 1HD ARG 30 2HD ARG 30 -1.861 -15.855 -0.024
205 2HD ARG 30 1HD ARG 30 -3.118 -17.048 -0.351
206 HE ARG 30 HE ARG 30 -0.797 -17.434 -1.973
207 1HH1 ARG 30 1HH1 ARG 30 -2.151 -18.024 1.188
208 2HH1 ARG 30 2HH1 ARG 30 -1.163 -19.413 1.490
209 1HH2 ARG 30 1HH2 ARG 30 0.505 -19.262 -1.578
210 2HH2 ARG 30 2HH2 ARG 30 0.346 -20.116 -0.080
211 H ASP 31 H ASP 31 -6.966 -15.726 -0.547
212 HA ASP 31 HA ASP 31 -6.353 -16.834 2.109
213 1HB ASP 31 2HB ASP 31 -8.843 -17.003 2.359
214 2HB ASP 31 1HB ASP 31 -8.246 -15.350 2.190
215 H ASN 32 H ASN 32 -7.778 -17.594 -1.034
216 HA ASN 32 HA ASN 32 -6.881 -20.300 -0.901
217 1HB ASN 32 2HB ASN 32 -9.740 -19.665 -0.310
218 2HB ASN 32 1HB ASN 32 -9.381 -21.099 -1.266
219 1HD2 ASN 32 1HD2 ASN 32 -9.497 -19.737 1.834
220 2HD2 ASN 32 2HD2 ASN 32 -8.853 -21.078 2.711
221 H ARG 33 H ARG 33 -9.290 -18.166 -2.420
222 HA ARG 33 HA ARG 33 -8.442 -19.209 -5.039
223 1HB ARG 33 2HB ARG 33 -10.751 -17.976 -5.635
224 2HB ARG 33 1HB ARG 33 -10.665 -19.668 -5.150
225 1HG ARG 33 2HG ARG 33 -11.099 -18.910 -2.798
226 2HG ARG 33 1HG ARG 33 -11.408 -17.299 -3.448
227 1HD ARG 33 2HD ARG 33 -13.525 -18.294 -3.268
228 2HD ARG 33 1HD ARG 33 -13.108 -18.418 -4.977
229 HE ARG 33 HE ARG 33 -13.213 -20.680 -4.767
230 1HH1 ARG 33 1HH1 ARG 33 -12.655 -19.324 -1.600
231 2HH1 ARG 33 2HH1 ARG 33 -12.758 -20.851 -0.791
232 1HH2 ARG 33 1HH2 ARG 33 -13.350 -22.689 -3.704
233 2HH2 ARG 33 2HH2 ARG 33 -13.154 -22.762 -1.985
234 H GLY 34 H GLY 34 -9.698 -16.243 -3.503
235 1HA GLY 34 2HA GLY 34 -8.146 -14.687 -5.472
236 2HA GLY 34 1HA GLY 34 -9.582 -14.105 -4.643
237 H TYR 35 H TYR 35 -7.711 -12.362 -4.484
238 HA TYR 35 HA TYR 35 -6.692 -12.610 -1.753
239 1HB TYR 35 2HB TYR 35 -4.593 -11.329 -2.708
240 2HB TYR 35 1HB TYR 35 -4.675 -13.086 -2.759
241 HD1 TYR 35 1HD TYR 35 -4.003 -14.070 -4.727
242 HD2 TYR 35 2HD TYR 35 -5.762 -10.199 -4.880
243 HE1 TYR 35 1HE TYR 35 -3.661 -14.017 -7.161
244 HE2 TYR 35 2HE TYR 35 -5.426 -10.136 -7.315
245 HH TYR 35 HH TYR 35 -3.450 -12.354 -8.955
246 H ARG 36 H ARG 36 -6.421 -10.659 -0.655
247 HA ARG 36 HA ARG 36 -7.868 -8.410 -1.866
248 1HB ARG 36 2HB ARG 36 -7.310 -9.129 1.014
249 2HB ARG 36 1HB ARG 36 -8.036 -7.600 0.520
250 1HG ARG 36 2HG ARG 36 -9.856 -8.923 -0.578
251 2HG ARG 36 1HG ARG 36 -9.170 -10.365 0.174
252 1HD ARG 36 2HD ARG 36 -9.422 -9.234 2.387
253 2HD ARG 36 1HD ARG 36 -10.284 -7.934 1.564
254 HE ARG 36 HE ARG 36 -12.125 -9.289 1.407
255 1HH1 ARG 36 1HH1 ARG 36 -9.358 -11.224 2.294
256 2HH1 ARG 36 2HH1 ARG 36 -10.296 -12.644 2.612
257 1HH2 ARG 36 1HH2 ARG 36 -13.360 -11.156 1.825
258 2HH2 ARG 36 2HH2 ARG 36 -12.568 -12.606 2.347
259 H THR 37 H THR 37 -6.822 -6.602 -2.402
260 HA THR 37 HA THR 37 -3.993 -6.381 -1.745
261 HB THR 37 HB THR 37 -5.702 -4.668 -3.559
262 HG1 THR 37 1HG THR 37 -4.727 -5.886 -5.212
263 1HG2 THR 37 1HG2 THR 37 -3.955 -3.306 -3.606
264 2HG2 THR 37 2HG2 THR 37 -3.109 -4.590 -4.469
265 3HG2 THR 37 3HG2 THR 37 -2.941 -4.444 -2.720
266 H GLU 38 H GLU 38 -3.617 -5.519 0.209
267 HA GLU 38 HA GLU 38 -5.291 -3.362 1.200
268 1HB GLU 38 2HB GLU 38 -3.597 -3.600 3.185
269 2HB GLU 38 1HB GLU 38 -4.885 -4.769 2.966
270 1HG GLU 38 2HG GLU 38 -3.363 -6.340 1.981
271 2HG GLU 38 1HG GLU 38 -2.072 -5.141 1.972
272 H ARG 39 H ARG 39 -4.408 -1.395 2.000
273 HA ARG 39 HA ARG 39 -1.843 -0.612 0.792
274 1HB ARG 39 2HB ARG 39 -4.526 0.679 0.508
275 2HB ARG 39 1HB ARG 39 -3.087 1.687 0.494
276 1HG ARG 39 2HG ARG 39 -3.326 1.297 -1.737
277 2HG ARG 39 1HG ARG 39 -2.283 -0.060 -1.302
278 1HD ARG 39 2HD ARG 39 -3.845 -1.291 -2.354
279 2HD ARG 39 1HD ARG 39 -4.727 -1.128 -0.839
280 HE ARG 39 HE ARG 39 -6.079 0.540 -1.832
281 1HH1 ARG 39 1HH1 ARG 39 -3.848 -0.921 -4.096
282 2HH1 ARG 39 2HH1 ARG 39 -4.729 -0.394 -5.487
283 1HH2 ARG 39 1HH2 ARG 39 -7.229 1.227 -3.667
284 2HH2 ARG 39 2HH2 ARG 39 -6.643 0.825 -5.247
285 H GLY 40 H GLY 40 -1.496 1.870 1.626
286 1HA GLY 40 2HA GLY 40 -2.126 3.070 3.838
287 2HA GLY 40 1HA GLY 40 -1.482 1.595 4.555
288 H CYS 41 H CYS 41 -0.374 3.966 5.258
289 HA CYS 41 HA CYS 41 1.915 4.558 3.611
290 1HB CYS 41 2HB CYS 41 0.619 5.715 5.956
291 2HB CYS 41 1HB CYS 41 2.379 5.729 6.086
292 H GLY 42 H GLY 42 4.136 4.370 4.352
293 1HA GLY 42 2HA GLY 42 5.822 3.404 5.717
294 2HA GLY 42 1HA GLY 42 4.600 2.375 6.446
295 H CYS 43 H CYS 43 6.211 0.701 6.090
296 HA CYS 43 HA CYS 43 5.572 -0.907 3.875
297 1HB CYS 43 2HB CYS 43 7.000 0.763 2.697
298 2HB CYS 43 1HB CYS 43 8.343 0.296 3.735
299 HA PRO 44 HA PRO 44 7.057 -3.216 7.563
300 1HB PRO 44 2HB PRO 44 5.690 -5.329 5.966
301 2HB PRO 44 1HB PRO 44 5.571 -4.967 7.696
302 1HG PRO 44 2HG PRO 44 3.608 -4.288 6.031
303 2HG PRO 44 1HG PRO 44 4.086 -3.217 7.361
304 1HD PRO 44 2HD PRO 44 4.672 -2.996 4.441
305 2HD PRO 44 1HD PRO 44 4.335 -1.717 5.625
306 H SER 45 H SER 45 7.960 -5.669 7.443
307 HA SER 45 HA SER 45 9.975 -5.648 5.294
308 1HB SER 45 2HB SER 45 10.476 -5.491 7.960
309 2HB SER 45 1HB SER 45 10.537 -7.238 7.722
310 HG SER 45 HG SER 45 12.277 -5.286 6.889
311 H VAL 46 H VAL 46 7.580 -6.775 4.686
312 HA VAL 46 HA VAL 46 8.155 -9.662 4.771
313 HB VAL 46 HB VAL 46 5.514 -9.613 4.185
314 1HG1 VAL 46 1HG1 VAL 46 7.095 -10.009 6.643
315 2HG1 VAL 46 2HG1 VAL 46 6.001 -11.109 5.806
316 3HG1 VAL 46 3HG1 VAL 46 5.352 -9.846 6.851
317 1HG2 VAL 46 1HG2 VAL 46 5.429 -7.155 4.523
318 2HG2 VAL 46 2HG2 VAL 46 5.877 -7.411 6.210
319 3HG2 VAL 46 3HG2 VAL 46 4.353 -8.051 5.595
320 H LYS 47 H LYS 47 8.341 -10.683 2.869
321 HA LYS 47 HA LYS 47 7.059 -9.728 0.480
322 1HB LYS 47 2HB LYS 47 9.228 -9.500 -0.781
323 2HB LYS 47 1HB LYS 47 8.899 -8.221 0.379
324 1HG LYS 47 2HG LYS 47 10.771 -8.642 1.489
325 2HG LYS 47 1HG LYS 47 10.389 -10.360 1.607
326 1HD LYS 47 2HD LYS 47 11.478 -10.863 -0.393
327 2HD LYS 47 1HD LYS 47 11.424 -9.189 -0.951
328 1HE LYS 47 2HE LYS 47 12.926 -8.727 1.116
329 2HE LYS 47 1HE LYS 47 13.240 -10.461 1.058
330 1HZ LYS 47 1HZ LYS 47 14.361 -10.288 -0.904
331 2HZ LYS 47 2HZ LYS 47 14.736 -8.778 -0.242
332 3HZ LYS 47 3HZ LYS 47 13.522 -8.909 -1.412
333 H LYS 48 H LYS 48 6.237 -11.921 0.903
334 HA LYS 48 HA LYS 48 7.594 -13.831 -0.733
335 1HB LYS 48 2HB LYS 48 7.770 -14.026 2.218
336 2HB LYS 48 1HB LYS 48 7.375 -15.512 1.367
337 1HG LYS 48 2HG LYS 48 9.406 -14.983 -0.103
338 2HG LYS 48 1HG LYS 48 9.846 -13.833 1.163
339 1HD LYS 48 2HD LYS 48 10.961 -15.684 1.912
340 2HD LYS 48 1HD LYS 48 9.411 -15.918 2.723
341 1HE LYS 48 2HE LYS 48 10.259 -17.973 1.642
342 2HE LYS 48 1HE LYS 48 8.697 -17.457 1.011
343 1HZ LYS 48 1HZ LYS 48 9.574 -16.935 -0.998
344 2HZ LYS 48 2HZ LYS 48 10.686 -18.134 -0.560
345 3HZ LYS 48 3HZ LYS 48 11.085 -16.501 -0.371
346 H GLY 49 H GLY 49 5.868 -14.348 -1.927
347 1HA GLY 49 2HA GLY 49 3.972 -15.723 -2.268
348 2HA GLY 49 1HA GLY 49 3.579 -15.560 -0.558
349 H ILE 50 H ILE 50 3.751 -12.734 -0.395
350 HA ILE 50 HA ILE 50 1.158 -12.061 -1.430
351 HB ILE 50 HB ILE 50 3.138 -10.280 -0.003
352 1HG1 ILE 50 2HG1 ILE 50 0.915 -12.039 1.055
353 2HG1 ILE 50 1HG1 ILE 50 2.640 -12.185 1.396
354 1HG2 ILE 50 1HG2 ILE 50 0.907 -9.518 -1.350
355 2HG2 ILE 50 2HG2 ILE 50 1.586 -8.658 0.030
356 3HG2 ILE 50 3HG2 ILE 50 0.257 -9.793 0.266
357 1HD1 ILE 50 1HD1 ILE 50 2.197 -9.677 2.256
358 2HD1 ILE 50 2HD1 ILE 50 2.067 -11.108 3.279
359 3HD1 ILE 50 3HD1 ILE 50 0.618 -10.401 2.564
360 H GLY 51 H GLY 51 0.637 -10.726 -3.092
361 1HA GLY 51 2HA GLY 51 2.727 -10.158 -5.014
362 2HA GLY 51 1HA GLY 51 1.002 -9.920 -5.246
363 H ILE 52 H ILE 52 2.681 -8.033 -6.176
364 HA ILE 52 HA ILE 52 3.219 -5.836 -6.149
365 HB ILE 52 HB ILE 52 0.649 -5.875 -5.847
366 1HG1 ILE 52 2HG1 ILE 52 1.477 -3.221 -4.976
367 2HG1 ILE 52 1HG1 ILE 52 2.524 -3.873 -6.240
368 1HG2 ILE 52 1HG2 ILE 52 -0.203 -5.785 -3.809
369 2HG2 ILE 52 2HG2 ILE 52 0.624 -4.256 -3.524
370 3HG2 ILE 52 3HG2 ILE 52 1.416 -5.774 -3.116
371 1HD1 ILE 52 1HD1 ILE 52 -0.470 -3.792 -6.459
372 2HD1 ILE 52 2HD1 ILE 52 0.704 -4.118 -7.733
373 3HD1 ILE 52 3HD1 ILE 52 0.587 -2.504 -7.033
374 H ASN 53 H ASN 53 3.782 -3.892 -4.724
375 HA ASN 53 HA ASN 53 4.694 -4.661 -2.055
376 1HB ASN 53 2HB ASN 53 6.980 -3.910 -2.498
377 2HB ASN 53 1HB ASN 53 6.539 -5.233 -3.578
378 1HD2 ASN 53 1HD2 ASN 53 7.932 -4.762 -5.198
379 2HD2 ASN 53 2HD2 ASN 53 7.834 -3.336 -6.168
380 H CYS 54 H CYS 54 6.321 -2.445 -1.607
381 HA CYS 54 HA CYS 54 4.299 -0.413 -1.226
382 1HB CYS 54 2HB CYS 54 7.180 -0.095 -0.435
383 2HB CYS 54 1HB CYS 54 5.739 0.567 0.337
384 H CYS 55 H CYS 55 5.028 1.933 -1.520
385 HA CYS 55 HA CYS 55 6.755 2.366 -3.817
386 1HB CYS 55 2HB CYS 55 4.892 3.810 -4.864
387 2HB CYS 55 1HB CYS 55 4.792 2.059 -5.061
388 H THR 56 H THR 56 6.826 4.810 -4.322
389 HA THR 56 HA THR 56 6.438 6.398 -1.886
390 HB THR 56 HB THR 56 8.737 5.709 -1.762
391 HG1 THR 56 1HG THR 56 8.508 7.839 -1.213
392 1HG2 THR 56 1HG2 THR 56 9.076 6.761 -4.561
393 2HG2 THR 56 2HG2 THR 56 9.138 5.068 -4.068
394 3HG2 THR 56 3HG2 THR 56 10.367 6.198 -3.501
395 H THR 57 H THR 57 4.645 6.742 -3.721
396 HA THR 57 HA THR 57 5.262 9.352 -4.833
397 HB THR 57 HB THR 57 3.930 8.322 -6.969
398 HG1 THR 57 1HG THR 57 5.720 6.304 -6.097
399 1HG2 THR 57 1HG2 THR 57 6.044 8.247 -8.158
400 2HG2 THR 57 2HG2 THR 57 6.918 8.296 -6.626
401 3HG2 THR 57 3HG2 THR 57 5.942 9.677 -7.130
402 H ASP 58 H ASP 58 3.384 10.582 -5.383
403 HA ASP 58 HA ASP 58 1.244 10.281 -3.620
404 1HB ASP 58 2HB ASP 58 0.130 11.994 -5.148
405 2HB ASP 58 1HB ASP 58 1.673 12.455 -4.443
406 H ARG 59 H ARG 59 -0.523 9.057 -3.664
407 HA ARG 59 HA ARG 59 -2.101 7.568 -4.355
408 1HB ARG 59 2HB ARG 59 -1.826 9.200 -6.883
409 2HB ARG 59 1HB ARG 59 -3.074 7.987 -6.636
410 1HG ARG 59 2HG ARG 59 -3.672 9.336 -4.528
411 2HG ARG 59 1HG ARG 59 -2.719 10.628 -5.273
412 1HD ARG 59 2HD ARG 59 -4.905 9.214 -6.773
413 2HD ARG 59 1HD ARG 59 -5.252 10.582 -5.708
414 HE ARG 59 HE ARG 59 -3.254 11.477 -7.335
415 1HH1 ARG 59 1HH1 ARG 59 -6.415 10.098 -7.872
416 2HH1 ARG 59 2HH1 ARG 59 -6.673 10.954 -9.355
417 1HH2 ARG 59 1HH2 ARG 59 -3.594 12.605 -9.285
418 2HH2 ARG 59 2HH2 ARG 59 -5.073 12.377 -10.157
419 H CYS 60 H CYS 60 0.733 6.892 -4.673
420 HA CYS 60 HA CYS 60 1.164 5.499 -7.083
421 1HB CYS 60 2HB CYS 60 3.080 4.538 -5.959
422 2HB CYS 60 1HB CYS 60 2.959 6.248 -5.555
423 H ASN 61 H ASN 61 -0.809 4.769 -4.410
424 HA ASN 61 HA ASN 61 -0.822 1.913 -5.120
425 1HB ASN 61 2HB ASN 61 -1.702 1.447 -2.924
426 2HB ASN 61 1HB ASN 61 -0.272 2.467 -2.747
427 1HD2 ASN 61 1HD2 ASN 61 -1.695 2.445 -0.621
428 2HD2 ASN 61 2HD2 ASN 61 -2.704 3.846 -0.445
429 H ASN 62 H ASN 62 -2.126 3.548 -6.858
430 HA ASN 62 HA ASN 62 -4.847 3.997 -6.261
431 1HB ASN 62 2HB ASN 62 -5.062 4.128 -8.781
432 2HB ASN 62 1HB ASN 62 -3.882 5.223 -8.060
433 1HD2 ASN 62 1HD2 ASN 62 -3.560 4.884 -10.615
434 2HD2 ASN 62 2HD2 ASN 62 -2.249 3.805 -10.985