Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
504873 | 2ena RC | 10171 | cing | 1-original | 5 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 H1 GLY 1 H GLY 1 18.436 -13.804 -3.305
2 HA2 GLY 1 1HA GLY 1 16.649 -12.672 -4.344
3 HA3 GLY 1 2HA GLY 1 15.799 -14.202 -4.500
4 H SER 2 H SER 2 15.962 -15.074 -1.834
5 HA SER 2 HA SER 2 14.645 -14.996 0.029
6 HB2 SER 2 1HB SER 2 15.902 -12.266 -0.080
7 HB3 SER 2 2HB SER 2 14.795 -12.694 1.225
8 HG SER 2 HG SER 2 16.830 -14.501 0.641
9 H SER 3 H SER 3 13.170 -14.724 -2.308
10 HA SER 3 HA SER 3 11.352 -12.510 -2.096
11 HB2 SER 3 1HB SER 3 11.882 -13.565 -4.272
12 HB3 SER 3 2HB SER 3 11.109 -15.052 -3.725
13 HG SER 3 HG SER 3 9.153 -14.020 -3.697
14 H GLY 4 H GLY 4 9.246 -12.509 -1.361
15 HA2 GLY 4 1HA GLY 4 8.211 -14.969 -0.146
16 HA3 GLY 4 2HA GLY 4 8.413 -13.561 0.885
17 H SER 5 H SER 5 6.781 -14.721 -2.034
18 HA SER 5 HA SER 5 4.547 -12.921 -1.386
19 HB2 SER 5 1HB SER 5 6.048 -12.231 -3.401
20 HB3 SER 5 2HB SER 5 5.238 -13.553 -4.241
21 HG SER 5 HG SER 5 3.902 -11.419 -2.931
22 H SER 6 H SER 6 2.471 -13.624 -2.255
23 HA SER 6 HA SER 6 2.151 -16.250 -3.324
24 HB2 SER 6 1HB SER 6 0.902 -17.166 -1.343
25 HB3 SER 6 2HB SER 6 2.636 -16.982 -1.083
26 HG SER 6 HG SER 6 1.160 -16.181 0.621
27 H GLY 7 H GLY 7 0.052 -16.645 -4.028
28 HA2 GLY 7 1HA GLY 7 -1.922 -15.912 -4.981
29 HA3 GLY 7 2HA GLY 7 -2.317 -15.541 -3.309
30 H THR 8 H THR 8 -3.522 -13.722 -3.744
31 HA THR 8 HA THR 8 -1.960 -11.376 -4.555
32 HB THR 8 HB THR 8 -3.940 -10.513 -5.823
33 HG1 THR 8 HG1 THR 8 -5.651 -11.795 -6.168
34 HG21 THR 8 3HG2 THR 8 -2.196 -12.739 -6.631
35 HG22 THR 8 1HG2 THR 8 -2.472 -11.177 -7.402
36 HG23 THR 8 2HG2 THR 8 -3.615 -12.497 -7.650
37 H ALA 9 H ALA 9 -3.051 -9.317 -3.964
38 HA ALA 9 HA ALA 9 -3.878 -9.378 -1.256
39 HB1 ALA 9 3HB ALA 9 -4.545 -6.873 -2.070
40 HB2 ALA 9 1HB ALA 9 -2.927 -7.370 -1.573
41 HB3 ALA 9 2HB ALA 9 -3.350 -7.327 -3.285
42 H GLU 10 H GLU 10 -5.806 -10.000 -0.552
43 HA GLU 10 HA GLU 10 -8.051 -10.617 -1.897
44 HB2 GLU 10 1HB GLU 10 -9.259 -9.633 0.269
45 HB3 GLU 10 2HB GLU 10 -8.315 -11.115 0.309
46 HG2 GLU 10 1HG GLU 10 -6.436 -9.988 1.235
47 HG3 GLU 10 2HG GLU 10 -7.186 -8.413 0.983
48 H LYS 11 H LYS 11 -6.873 -7.416 -1.306
49 HA LYS 11 HA LYS 11 -9.368 -6.183 -2.184
50 HB2 LYS 11 1HB LYS 11 -6.763 -4.888 -1.359
51 HB3 LYS 11 2HB LYS 11 -8.289 -4.061 -1.641
52 HG2 LYS 11 1HG LYS 11 -7.492 -5.833 0.627
53 HG3 LYS 11 2HG LYS 11 -8.200 -4.216 0.661
54 HD2 LYS 11 1HD LYS 11 -9.625 -6.723 -0.230
55 HD3 LYS 11 2HD LYS 11 -9.798 -5.963 1.353
56 HE2 LYS 11 1HE LYS 11 -10.403 -3.846 -0.039
57 HE3 LYS 11 2HE LYS 11 -10.723 -5.007 -1.325
58 HZ1 LYS 11 3HZ LYS 11 -12.321 -6.109 0.069
59 HZ2 LYS 11 1HZ LYS 11 -12.707 -4.464 -0.012
60 HZ3 LYS 11 2HZ LYS 11 -11.963 -5.091 1.372
61 HA PRO 12 HA PRO 12 -8.157 -5.636 -6.370
62 HB2 PRO 12 1HB PRO 12 -9.407 -3.299 -6.957
63 HB3 PRO 12 2HB PRO 12 -10.274 -4.824 -6.744
64 HG2 PRO 12 1HG PRO 12 -9.895 -2.574 -4.806
65 HG3 PRO 12 2HG PRO 12 -11.356 -3.518 -5.153
66 HD2 PRO 12 1HD PRO 12 -9.794 -3.991 -2.992
67 HD3 PRO 12 2HD PRO 12 -10.684 -5.280 -3.828
68 H PHE 13 H PHE 13 -7.613 -2.993 -4.115
69 HA PHE 13 HA PHE 13 -5.625 -1.801 -5.896
70 HB2 PHE 13 1HB PHE 13 -6.493 -0.798 -3.183
71 HB3 PHE 13 2HB PHE 13 -5.647 0.099 -4.439
72 HD1 PHE 13 HD1 PHE 13 -6.834 0.858 -6.437
73 HD2 PHE 13 HD2 PHE 13 -8.860 -1.117 -3.257
74 HE1 PHE 13 HE1 PHE 13 -8.989 1.650 -7.323
75 HE2 PHE 13 HE2 PHE 13 -11.018 -0.329 -4.138
76 HZ PHE 13 HZ PHE 13 -11.084 1.056 -6.174
77 H ARG 14 H ARG 14 -3.462 -1.683 -5.428
78 HA ARG 14 HA ARG 14 -2.440 -2.667 -2.907
79 HB2 ARG 14 1HB ARG 14 -2.831 -4.712 -4.313
80 HB3 ARG 14 2HB ARG 14 -1.660 -4.077 -5.461
81 HG2 ARG 14 1HG ARG 14 -0.028 -4.015 -3.502
82 HG3 ARG 14 2HG ARG 14 -1.201 -5.029 -2.657
83 HD2 ARG 14 1HD ARG 14 0.511 -6.392 -3.720
84 HD3 ARG 14 2HD ARG 14 -1.065 -6.681 -4.456
85 HE ARG 14 HE ARG 14 0.548 -4.706 -5.806
86 HH11 ARG 14 1HH1 ARG 14 -0.286 -8.076 -5.547
87 HH12 ARG 14 2HH1 ARG 14 0.222 -8.460 -7.159
88 HH21 ARG 14 1HH2 ARG 14 1.220 -5.199 -7.930
89 HH22 ARG 14 2HH2 ARG 14 1.079 -6.823 -8.513
90 H CYS 15 H CYS 15 -0.460 -1.843 -2.425
91 HA CYS 15 HA CYS 15 0.609 0.127 -4.282
92 HB2 CYS 15 1HB CYS 15 0.270 0.804 -1.960
93 HB3 CYS 15 2HB CYS 15 1.327 -0.492 -1.409
94 H ASP 16 H ASP 16 2.100 -0.474 -5.696
95 HA ASP 16 HA ASP 16 3.700 -2.840 -5.283
96 HB2 ASP 16 1HB ASP 16 2.759 -2.203 -7.512
97 HB3 ASP 16 2HB ASP 16 3.857 -0.826 -7.532
98 H THR 17 H THR 17 4.215 -0.934 -3.320
99 HA THR 17 HA THR 17 7.014 -0.273 -3.929
100 HB THR 17 HB THR 17 5.256 1.517 -2.253
101 HG1 THR 17 HG1 THR 17 4.949 2.767 -4.051
102 HG21 THR 17 3HG2 THR 17 7.107 3.149 -2.814
103 HG22 THR 17 1HG2 THR 17 8.014 1.774 -3.441
104 HG23 THR 17 2HG2 THR 17 7.555 1.825 -1.739
105 H CYS 18 H CYS 18 4.637 -0.466 -1.277
106 HA CYS 18 HA CYS 18 6.748 -1.662 0.398
107 HB2 CYS 18 1HB CYS 18 5.487 -0.815 2.348
108 HB3 CYS 18 2HB CYS 18 6.014 0.484 1.283
109 H ASP 19 H ASP 19 4.384 -2.635 -1.468
110 HA ASP 19 HA ASP 19 3.083 -4.497 -1.592
111 HB2 ASP 19 1HB ASP 19 5.099 -5.620 -0.693
112 HB3 ASP 19 2HB ASP 19 4.517 -5.320 0.943
113 H LYS 20 H LYS 20 1.735 -2.408 -0.699
114 HA LYS 20 HA LYS 20 0.215 -3.360 1.638
115 HB2 LYS 20 1HB LYS 20 0.968 -0.654 0.675
116 HB3 LYS 20 2HB LYS 20 -0.628 -0.822 1.395
117 HG2 LYS 20 1HG LYS 20 0.579 -1.953 3.349
118 HG3 LYS 20 2HG LYS 20 2.053 -1.274 2.653
119 HD2 LYS 20 1HD LYS 20 0.679 0.949 2.649
120 HD3 LYS 20 2HD LYS 20 -0.295 0.122 3.866
121 HE2 LYS 20 1HE LYS 20 1.868 -0.346 5.089
122 HE3 LYS 20 2HE LYS 20 2.642 0.772 3.968
123 HZ1 LYS 20 3HZ LYS 20 1.548 2.562 4.854
124 HZ2 LYS 20 1HZ LYS 20 1.741 1.610 6.239
125 HZ3 LYS 20 2HZ LYS 20 0.253 1.643 5.437
126 H SER 21 H SER 21 -2.139 -2.385 1.531
127 HA SER 21 HA SER 21 -3.277 -2.362 -1.127
128 HB2 SER 21 1HB SER 21 -4.896 -4.244 -0.472
129 HB3 SER 21 2HB SER 21 -3.257 -4.717 -0.917
130 HG SER 21 HG SER 21 -3.354 -4.200 1.708
131 H PHE 22 H PHE 22 -5.351 -1.503 -1.196
132 HA PHE 22 HA PHE 22 -6.514 -0.665 1.370
133 HB2 PHE 22 1HB PHE 22 -6.189 1.091 -1.073
134 HB3 PHE 22 2HB PHE 22 -7.032 1.542 0.405
135 HD1 PHE 22 HD2 PHE 22 -3.702 0.245 -0.670
136 HD2 PHE 22 HD1 PHE 22 -5.888 2.798 1.942
137 HE1 PHE 22 HE2 PHE 22 -1.590 1.083 0.273
138 HE2 PHE 22 HE1 PHE 22 -3.779 3.641 2.889
139 HZ PHE 22 HZ PHE 22 -1.626 2.782 2.055
140 H ARG 23 H ARG 23 -8.802 0.057 1.142
141 HA ARG 23 HA ARG 23 -10.200 -1.776 -0.645
142 HB2 ARG 23 1HB ARG 23 -11.319 -0.044 1.566
143 HB3 ARG 23 2HB ARG 23 -12.156 -1.343 0.727
144 HG2 ARG 23 1HG ARG 23 -10.141 -2.776 1.624
145 HG3 ARG 23 2HG ARG 23 -10.052 -1.480 2.818
146 HD2 ARG 23 1HD ARG 23 -12.657 -2.822 2.202
147 HD3 ARG 23 2HD ARG 23 -11.509 -3.556 3.321
148 HE ARG 23 HE ARG 23 -13.113 -1.193 3.765
149 HH11 ARG 23 1HH1 ARG 23 -10.351 -3.061 4.764
150 HH12 ARG 23 2HH1 ARG 23 -10.316 -2.397 6.363
151 HH21 ARG 23 1HH2 ARG 23 -13.078 -0.311 5.868
152 HH22 ARG 23 2HH2 ARG 23 -11.868 -0.833 6.991
153 H GLN 24 H GLN 24 -9.879 1.663 0.011
154 HA GLN 24 HA GLN 24 -11.697 2.254 -2.219
155 HB2 GLN 24 1HB GLN 24 -10.578 4.252 -0.261
156 HB3 GLN 24 2HB GLN 24 -11.973 4.432 -1.317
157 HG2 GLN 24 1HG GLN 24 -11.955 2.320 0.793
158 HG3 GLN 24 2HG GLN 24 -12.315 3.995 1.212
159 HE21 GLN 24 1HE2 GLN 24 -14.121 1.886 1.522
160 HE22 GLN 24 2HE2 GLN 24 -15.453 2.143 0.452
161 H ARG 25 H ARG 25 -10.988 3.181 -4.054
162 HA ARG 25 HA ARG 25 -8.299 3.098 -4.771
163 HB2 ARG 25 1HB ARG 25 -10.318 3.163 -6.306
164 HB3 ARG 25 2HB ARG 25 -10.354 4.902 -6.045
165 HG2 ARG 25 1HG ARG 25 -8.179 5.150 -7.036
166 HG3 ARG 25 2HG ARG 25 -8.002 3.400 -7.170
167 HD2 ARG 25 1HD ARG 25 -9.749 3.271 -8.786
168 HD3 ARG 25 2HD ARG 25 -10.204 4.952 -8.513
169 HE ARG 25 HE ARG 25 -7.546 4.919 -9.345
170 HH11 ARG 25 1HH1 ARG 25 -10.696 4.133 -10.602
171 HH12 ARG 25 2HH1 ARG 25 -10.271 4.481 -12.245
172 HH21 ARG 25 1HH2 ARG 25 -6.974 5.381 -11.504
173 HH22 ARG 25 2HH2 ARG 25 -8.153 5.190 -12.757
174 H SER 26 H SER 26 -10.214 5.695 -3.399
175 HA SER 26 HA SER 26 -8.294 7.754 -3.838
176 HB2 SER 26 1HB SER 26 -10.618 8.343 -3.492
177 HB3 SER 26 2HB SER 26 -10.619 7.570 -1.907
178 HG SER 26 HG SER 26 -8.927 9.142 -1.363
179 H ALA 27 H ALA 27 -8.512 5.185 -1.617
180 HA ALA 27 HA ALA 27 -6.963 6.455 0.469
181 HB1 ALA 27 3HB ALA 27 -7.548 4.712 1.762
182 HB2 ALA 27 1HB ALA 27 -8.734 4.407 0.493
183 HB3 ALA 27 2HB ALA 27 -7.205 3.528 0.501
184 H LEU 28 H LEU 28 -6.430 4.204 -2.182
185 HA LEU 28 HA LEU 28 -3.672 3.742 -1.426
186 HB2 LEU 28 1HB LEU 28 -4.568 1.850 -2.382
187 HB3 LEU 28 2HB LEU 28 -5.494 2.762 -3.572
188 HG LEU 28 HG LEU 28 -3.033 3.304 -4.460
189 HD11 LEU 28 1HD1 LEU 28 -1.710 2.124 -2.952
190 HD12 LEU 28 2HD1 LEU 28 -1.818 1.044 -4.341
191 HD13 LEU 28 3HD1 LEU 28 -2.810 0.746 -2.914
192 HD21 LEU 28 3HD2 LEU 28 -3.677 2.098 -6.240
193 HD22 LEU 28 1HD2 LEU 28 -5.173 1.872 -5.332
194 HD23 LEU 28 2HD2 LEU 28 -3.918 0.633 -5.288
195 H ASN 29 H ASN 29 -5.417 5.347 -4.074
196 HA ASN 29 HA ASN 29 -3.285 6.206 -5.596
197 HB2 ASN 29 1HB ASN 29 -6.038 7.237 -5.106
198 HB3 ASN 29 2HB ASN 29 -4.906 8.297 -5.941
199 HD21 ASN 29 1HD2 ASN 29 -7.005 7.653 -7.350
200 HD22 ASN 29 2HD2 ASN 29 -6.654 6.456 -8.545
201 H SER 30 H SER 30 -4.361 7.354 -2.503
202 HA SER 30 HA SER 30 -2.712 9.747 -2.637
203 HB2 SER 30 1HB SER 30 -4.764 8.679 -0.758
204 HB3 SER 30 2HB SER 30 -3.554 9.784 -0.107
205 HG SER 30 HG SER 30 -5.684 10.296 -1.727
206 H HIS 31 H HIS 31 -2.783 6.627 -0.996
207 HA HIS 31 HA HIS 31 -0.641 7.047 0.764
208 HB2 HIS 31 1HB HIS 31 -1.984 5.150 1.173
209 HB3 HIS 31 2HB HIS 31 -1.811 4.567 -0.480
210 HD1 HIS 31 HD1 HIS 31 0.015 4.730 2.794
211 HD2 HIS 31 HD2 HIS 31 0.448 3.024 -0.970
212 HE1 HIS 31 HE1 HIS 31 1.915 3.097 3.011
213 H ARG 32 H ARG 32 -0.729 5.967 -2.591
214 HA ARG 32 HA ARG 32 1.949 5.182 -2.838
215 HB2 ARG 32 1HB ARG 32 0.138 6.378 -4.944
216 HB3 ARG 32 2HB ARG 32 1.628 5.499 -5.256
217 HG2 ARG 32 1HG ARG 32 0.386 3.634 -3.844
218 HG3 ARG 32 2HG ARG 32 -1.035 4.494 -4.438
219 HD2 ARG 32 1HD ARG 32 -0.434 2.676 -5.941
220 HD3 ARG 32 2HD ARG 32 -0.230 4.237 -6.733
221 HE ARG 32 HE ARG 32 2.237 3.756 -5.798
222 HH11 ARG 32 1HH1 ARG 32 0.003 1.785 -7.599
223 HH12 ARG 32 2HH1 ARG 32 1.245 0.889 -8.410
224 HH21 ARG 32 1HH2 ARG 32 3.881 2.583 -6.859
225 HH22 ARG 32 2HH2 ARG 32 3.451 1.343 -7.987
226 H MET 33 H MET 33 0.485 8.315 -2.702
227 HA MET 33 HA MET 33 2.488 9.828 -3.974
228 HB2 MET 33 1HB MET 33 0.638 10.645 -1.727
229 HB3 MET 33 2HB MET 33 1.547 11.745 -2.754
230 HG2 MET 33 1HG MET 33 0.269 10.491 -4.673
231 HG3 MET 33 2HG MET 33 -0.862 10.122 -3.373
232 HE1 MET 33 3HE MET 33 -2.259 11.639 -2.159
233 HE2 MET 33 1HE MET 33 -2.846 13.160 -2.832
234 HE3 MET 33 2HE MET 33 -3.074 11.655 -3.724
235 H ILE 34 H ILE 34 2.063 8.849 -0.596
236 HA ILE 34 HA ILE 34 4.111 10.278 0.585
237 HB ILE 34 HB ILE 34 3.962 8.862 2.402
238 HG12 ILE 34 1HG1 ILE 34 3.559 6.687 0.370
239 HG13 ILE 34 2HG1 ILE 34 4.786 6.814 1.626
240 HG21 ILE 34 1HG2 ILE 34 1.723 9.751 1.596
241 HG22 ILE 34 2HG2 ILE 34 1.398 8.115 1.025
242 HG23 ILE 34 3HG2 ILE 34 1.676 8.411 2.741
243 HD11 ILE 34 3HD1 ILE 34 1.864 6.343 2.155
244 HD12 ILE 34 1HD1 ILE 34 3.081 5.072 2.047
245 HD13 ILE 34 2HD1 ILE 34 3.185 6.286 3.322
246 H HIS 35 H HIS 35 4.288 7.531 -1.526
247 HA HIS 35 HA HIS 35 7.057 6.963 -0.895
248 HB2 HIS 35 1HB HIS 35 5.254 5.859 -3.059
249 HB3 HIS 35 2HB HIS 35 6.873 5.272 -2.692
250 HD1 HIS 35 HD1 HIS 35 6.802 5.000 0.308
251 HD2 HIS 35 HD2 HIS 35 3.617 3.917 -2.131
252 HE1 HIS 35 HE1 HIS 35 5.469 3.336 1.642
253 H THR 36 H THR 36 5.287 8.948 -3.064
254 HA THR 36 HA THR 36 7.443 9.207 -4.983
255 HB THR 36 HB THR 36 6.018 10.747 -6.168
256 HG1 THR 36 HG1 THR 36 3.842 11.102 -5.103
257 HG21 THR 36 3HG2 THR 36 5.524 8.285 -6.275
258 HG22 THR 36 1HG2 THR 36 4.162 9.330 -6.676
259 HG23 THR 36 2HG2 THR 36 4.244 8.558 -5.093
260 H GLY 37 H GLY 37 8.335 9.857 -2.448
261 HA2 GLY 37 1HA GLY 37 8.924 12.712 -2.814
262 HA3 GLY 37 2HA GLY 37 8.348 12.162 -1.247
263 H GLU 38 H GLU 38 9.645 10.382 -0.231
264 HA GLU 38 HA GLU 38 12.275 11.171 0.148
265 HB2 GLU 38 1HB GLU 38 10.770 8.655 0.747
266 HB3 GLU 38 2HB GLU 38 12.508 8.697 1.002
267 HG2 GLU 38 1HG GLU 38 10.815 10.858 2.154
268 HG3 GLU 38 2HG GLU 38 10.861 9.280 2.937
269 H LYS 39 H LYS 39 14.140 9.436 -0.107
270 HA LYS 39 HA LYS 39 14.199 8.695 -2.958
271 HB2 LYS 39 1HB LYS 39 16.692 8.935 -2.743
272 HB3 LYS 39 2HB LYS 39 15.788 10.434 -2.572
273 HG2 LYS 39 1HG LYS 39 16.097 10.458 -0.224
274 HG3 LYS 39 2HG LYS 39 16.719 8.806 -0.223
275 HD2 LYS 39 1HD LYS 39 18.061 11.116 -1.623
276 HD3 LYS 39 2HD LYS 39 18.472 10.575 0.007
277 HE2 LYS 39 1HE LYS 39 20.018 9.400 -1.198
278 HE3 LYS 39 2HE LYS 39 18.691 8.239 -1.198
279 HZ1 LYS 39 3HZ LYS 39 18.247 9.857 -3.375
280 HZ2 LYS 39 1HZ LYS 39 18.828 8.268 -3.397
281 HZ3 LYS 39 2HZ LYS 39 19.913 9.565 -3.393
282 HA PRO 40 HA PRO 40 14.551 4.805 -0.401
283 HB2 PRO 40 1HB PRO 40 12.657 3.428 -1.775
284 HB3 PRO 40 2HB PRO 40 12.278 4.465 -0.395
285 HG2 PRO 40 1HG PRO 40 12.051 5.049 -3.322
286 HG3 PRO 40 2HG PRO 40 10.917 5.431 -2.014
287 HD2 PRO 40 1HD PRO 40 12.618 7.266 -3.048
288 HD3 PRO 40 2HD PRO 40 12.114 7.284 -1.346
289 H SER 41 H SER 41 14.992 2.573 -1.249
290 HA SER 41 HA SER 41 16.868 2.750 -3.422
291 HB2 SER 41 1HB SER 41 16.002 0.480 -1.628
292 HB3 SER 41 2HB SER 41 17.177 0.275 -2.926
293 HG SER 41 HG SER 41 18.614 1.434 -1.839
294 H GLY 42 H GLY 42 15.379 3.298 -5.132
295 HA2 GLY 42 1HA GLY 42 14.847 1.481 -7.003
296 HA3 GLY 42 2HA GLY 42 13.467 1.252 -5.939
297 HA PRO 43 HA PRO 43 13.235 5.693 -7.925
298 HB2 PRO 43 1HB PRO 43 14.568 5.923 -10.278
299 HB3 PRO 43 2HB PRO 43 15.295 6.329 -8.719
300 HG2 PRO 43 1HG PRO 43 15.582 3.835 -10.350
301 HG3 PRO 43 2HG PRO 43 16.825 4.753 -9.481
302 HD2 PRO 43 1HD PRO 43 15.726 2.487 -8.487
303 HD3 PRO 43 2HD PRO 43 16.273 3.818 -7.448
304 H SER 44 H SER 44 11.604 6.256 -9.331
305 HA SER 44 HA SER 44 10.835 4.304 -11.387
306 HB2 SER 44 1HB SER 44 8.427 4.671 -10.692
307 HB3 SER 44 2HB SER 44 9.404 3.745 -9.553
308 HG SER 44 HG SER 44 8.608 5.184 -8.213
309 H SER 45 H SER 45 8.725 5.375 -12.523
310 HA SER 45 HA SER 45 8.020 6.963 -13.990
311 HB2 SER 45 1HB SER 45 7.646 8.251 -11.895
312 HB3 SER 45 2HB SER 45 9.273 8.916 -12.045
313 HG SER 45 HG SER 45 8.644 10.139 -13.687
314 H GLY 46 H GLY 46 10.390 5.725 -14.651
315 HA2 GLY 46 1HA GLY 46 11.644 7.820 -16.255
316 HA3 GLY 46 2HA GLY 46 12.695 6.912 -15.177
Start of MODEL 2
1 H1 GLY 1 H GLY 1 9.387 -7.986 -12.493
2 HA2 GLY 1 1HA GLY 1 7.519 -8.450 -11.012
3 HA3 GLY 1 2HA GLY 1 7.723 -9.834 -12.077
4 H SER 2 H SER 2 8.629 -11.743 -11.273
5 HA SER 2 HA SER 2 8.566 -13.370 -9.634
6 HB2 SER 2 1HB SER 2 10.936 -12.307 -9.775
7 HB3 SER 2 2HB SER 2 10.541 -11.612 -8.203
8 HG SER 2 HG SER 2 11.135 -14.210 -8.886
9 H SER 3 H SER 3 6.443 -11.623 -9.218
10 HA SER 3 HA SER 3 6.390 -11.375 -6.281
11 HB2 SER 3 1HB SER 3 4.679 -9.629 -6.577
12 HB3 SER 3 2HB SER 3 6.173 -9.205 -7.411
13 HG SER 3 HG SER 3 3.763 -10.183 -8.529
14 H GLY 4 H GLY 4 5.688 -13.504 -5.940
15 HA2 GLY 4 1HA GLY 4 3.406 -14.594 -7.269
16 HA3 GLY 4 2HA GLY 4 4.194 -15.256 -5.844
17 H SER 5 H SER 5 1.541 -15.475 -5.917
18 HA SER 5 HA SER 5 -0.469 -14.822 -5.011
19 HB2 SER 5 1HB SER 5 -0.289 -14.392 -2.571
20 HB3 SER 5 2HB SER 5 0.687 -15.768 -3.086
21 HG SER 5 HG SER 5 1.805 -13.186 -2.931
22 H SER 6 H SER 6 0.502 -12.804 -6.654
23 HA SER 6 HA SER 6 0.005 -10.328 -5.156
24 HB2 SER 6 1HB SER 6 0.918 -9.181 -7.164
25 HB3 SER 6 2HB SER 6 2.065 -10.315 -6.451
26 HG SER 6 HG SER 6 0.506 -10.630 -8.790
27 H GLY 7 H GLY 7 -0.998 -12.080 -8.075
28 HA2 GLY 7 1HA GLY 7 -2.987 -10.241 -8.879
29 HA3 GLY 7 2HA GLY 7 -2.893 -11.928 -9.362
30 H THR 8 H THR 8 -2.976 -12.754 -6.482
31 HA THR 8 HA THR 8 -5.884 -12.707 -6.246
32 HB THR 8 HB THR 8 -5.489 -14.420 -4.437
33 HG1 THR 8 HG1 THR 8 -3.210 -13.699 -4.165
34 HG21 THR 8 3HG2 THR 8 -6.105 -15.198 -6.607
35 HG22 THR 8 1HG2 THR 8 -4.772 -16.210 -6.054
36 HG23 THR 8 2HG2 THR 8 -4.478 -14.930 -7.232
37 H ALA 9 H ALA 9 -4.775 -10.255 -5.671
38 HA ALA 9 HA ALA 9 -4.271 -9.921 -2.878
39 HB1 ALA 9 3HB ALA 9 -4.317 -8.250 -5.244
40 HB2 ALA 9 1HB ALA 9 -5.036 -7.444 -3.850
41 HB3 ALA 9 2HB ALA 9 -3.391 -8.073 -3.754
42 H GLU 10 H GLU 10 -5.755 -10.102 -1.341
43 HA GLU 10 HA GLU 10 -8.402 -10.509 -1.500
44 HB2 GLU 10 1HB GLU 10 -8.457 -9.031 0.730
45 HB3 GLU 10 2HB GLU 10 -7.750 -10.640 0.675
46 HG2 GLU 10 1HG GLU 10 -6.014 -8.304 0.077
47 HG3 GLU 10 2HG GLU 10 -6.473 -8.615 1.750
48 H LYS 11 H LYS 11 -6.802 -7.479 -2.041
49 HA LYS 11 HA LYS 11 -9.419 -6.226 -2.559
50 HB2 LYS 11 1HB LYS 11 -6.914 -4.836 -1.592
51 HB3 LYS 11 2HB LYS 11 -8.470 -4.076 -1.902
52 HG2 LYS 11 1HG LYS 11 -7.834 -6.086 0.246
53 HG3 LYS 11 2HG LYS 11 -8.190 -4.370 0.460
54 HD2 LYS 11 1HD LYS 11 -10.045 -6.582 -0.374
55 HD3 LYS 11 2HD LYS 11 -10.190 -5.482 0.999
56 HE2 LYS 11 1HE LYS 11 -10.194 -3.684 -0.970
57 HE3 LYS 11 2HE LYS 11 -10.844 -5.059 -1.862
58 HZ1 LYS 11 3HZ LYS 11 -12.230 -3.356 -0.200
59 HZ2 LYS 11 1HZ LYS 11 -12.108 -4.806 0.665
60 HZ3 LYS 11 2HZ LYS 11 -12.798 -4.798 -0.879
61 HA PRO 12 HA PRO 12 -8.078 -5.473 -6.672
62 HB2 PRO 12 1HB PRO 12 -9.403 -3.169 -7.227
63 HB3 PRO 12 2HB PRO 12 -10.212 -4.736 -7.099
64 HG2 PRO 12 1HG PRO 12 -10.000 -2.543 -5.073
65 HG3 PRO 12 2HG PRO 12 -11.406 -3.532 -5.508
66 HD2 PRO 12 1HD PRO 12 -9.908 -4.018 -3.305
67 HD3 PRO 12 2HD PRO 12 -10.710 -5.312 -4.219
68 H PHE 13 H PHE 13 -7.506 -3.138 -4.180
69 HA PHE 13 HA PHE 13 -5.581 -1.712 -5.882
70 HB2 PHE 13 1HB PHE 13 -6.517 -0.849 -3.148
71 HB3 PHE 13 2HB PHE 13 -5.727 0.127 -4.382
72 HD1 PHE 13 HD1 PHE 13 -6.968 0.904 -6.335
73 HD2 PHE 13 HD2 PHE 13 -8.868 -1.292 -3.223
74 HE1 PHE 13 HE1 PHE 13 -9.167 1.619 -7.177
75 HE2 PHE 13 HE2 PHE 13 -11.069 -0.581 -4.060
76 HZ PHE 13 HZ PHE 13 -11.221 0.875 -6.040
77 H ARG 14 H ARG 14 -3.440 -1.686 -5.419
78 HA ARG 14 HA ARG 14 -2.466 -2.706 -2.882
79 HB2 ARG 14 1HB ARG 14 -2.829 -4.658 -4.530
80 HB3 ARG 14 2HB ARG 14 -1.447 -4.001 -5.397
81 HG2 ARG 14 1HG ARG 14 -0.178 -4.161 -3.209
82 HG3 ARG 14 2HG ARG 14 -1.531 -5.129 -2.619
83 HD2 ARG 14 1HD ARG 14 -1.043 -6.894 -3.982
84 HD3 ARG 14 2HD ARG 14 -0.326 -5.873 -5.228
85 HE ARG 14 HE ARG 14 1.227 -5.922 -2.831
86 HH11 ARG 14 1HH1 ARG 14 0.514 -7.656 -5.764
87 HH12 ARG 14 2HH1 ARG 14 2.044 -8.468 -5.810
88 HH21 ARG 14 1HH2 ARG 14 3.245 -6.985 -2.880
89 HH22 ARG 14 2HH2 ARG 14 3.597 -8.086 -4.169
90 H CYS 15 H CYS 15 -0.485 -1.908 -2.336
91 HA CYS 15 HA CYS 15 0.602 0.141 -4.102
92 HB2 CYS 15 1HB CYS 15 0.180 0.736 -1.762
93 HB3 CYS 15 2HB CYS 15 1.263 -0.547 -1.230
94 H ASP 16 H ASP 16 2.033 -0.549 -5.553
95 HA ASP 16 HA ASP 16 3.710 -2.842 -5.075
96 HB2 ASP 16 1HB ASP 16 3.152 -1.031 -7.368
97 HB3 ASP 16 2HB ASP 16 4.701 -1.870 -7.363
98 H THR 17 H THR 17 4.219 -0.938 -3.150
99 HA THR 17 HA THR 17 6.981 -0.184 -3.814
100 HB THR 17 HB THR 17 5.148 1.572 -2.176
101 HG1 THR 17 HG1 THR 17 4.390 2.030 -4.122
102 HG21 THR 17 3HG2 THR 17 7.463 2.802 -3.407
103 HG22 THR 17 1HG2 THR 17 7.924 1.466 -2.353
104 HG23 THR 17 2HG2 THR 17 6.959 2.799 -1.718
105 H CYS 18 H CYS 18 4.625 -0.508 -1.161
106 HA CYS 18 HA CYS 18 6.800 -1.593 0.507
107 HB2 CYS 18 1HB CYS 18 5.608 -0.733 2.468
108 HB3 CYS 18 2HB CYS 18 5.994 0.569 1.347
109 H ASP 19 H ASP 19 4.494 -2.682 -1.324
110 HA ASP 19 HA ASP 19 3.226 -4.569 -1.406
111 HB2 ASP 19 1HB ASP 19 5.025 -5.160 0.923
112 HB3 ASP 19 2HB ASP 19 3.725 -6.273 0.506
113 H LYS 20 H LYS 20 1.782 -2.545 -0.601
114 HA LYS 20 HA LYS 20 0.276 -3.508 1.743
115 HB2 LYS 20 1HB LYS 20 1.032 -0.778 0.850
116 HB3 LYS 20 2HB LYS 20 -0.568 -0.969 1.555
117 HG2 LYS 20 1HG LYS 20 0.646 -2.152 3.483
118 HG3 LYS 20 2HG LYS 20 2.108 -1.422 2.817
119 HD2 LYS 20 1HD LYS 20 1.235 0.779 3.120
120 HD3 LYS 20 2HD LYS 20 -0.363 0.150 3.528
121 HE2 LYS 20 1HE LYS 20 2.132 -0.354 5.143
122 HE3 LYS 20 2HE LYS 20 0.962 0.917 5.493
123 HZ1 LYS 20 3HZ LYS 20 0.800 -1.922 5.988
124 HZ2 LYS 20 1HZ LYS 20 -0.604 -1.258 5.316
125 HZ3 LYS 20 2HZ LYS 20 0.014 -0.640 6.764
126 H SER 21 H SER 21 -2.077 -2.516 1.625
127 HA SER 21 HA SER 21 -3.177 -2.449 -1.048
128 HB2 SER 21 1HB SER 21 -4.830 -4.331 -0.383
129 HB3 SER 21 2HB SER 21 -3.213 -4.791 -0.915
130 HG SER 21 HG SER 21 -4.377 -4.956 1.602
131 H PHE 22 H PHE 22 -5.253 -1.588 -1.133
132 HA PHE 22 HA PHE 22 -6.429 -0.759 1.432
133 HB2 PHE 22 1HB PHE 22 -6.148 0.995 -1.018
134 HB3 PHE 22 2HB PHE 22 -6.940 1.445 0.489
135 HD1 PHE 22 HD2 PHE 22 -3.652 0.132 -0.691
136 HD2 PHE 22 HD1 PHE 22 -5.741 2.705 1.979
137 HE1 PHE 22 HE2 PHE 22 -1.506 0.964 0.180
138 HE2 PHE 22 HE1 PHE 22 -3.599 3.541 2.855
139 HZ PHE 22 HZ PHE 22 -1.478 2.670 1.956
140 H ARG 23 H ARG 23 -8.714 0.167 1.026
141 HA ARG 23 HA ARG 23 -10.098 -1.707 -0.765
142 HB2 ARG 23 1HB ARG 23 -11.163 -0.183 1.620
143 HB3 ARG 23 2HB ARG 23 -12.070 -1.337 0.651
144 HG2 ARG 23 1HG ARG 23 -10.096 -2.943 1.324
145 HG3 ARG 23 2HG ARG 23 -9.942 -1.807 2.666
146 HD2 ARG 23 1HD ARG 23 -12.650 -2.832 1.994
147 HD3 ARG 23 2HD ARG 23 -11.525 -3.924 2.800
148 HE ARG 23 HE ARG 23 -11.395 -1.694 4.316
149 HH11 ARG 23 1HH1 ARG 23 -14.045 -3.625 3.147
150 HH12 ARG 23 2HH1 ARG 23 -15.066 -3.280 4.503
151 HH21 ARG 23 1HH2 ARG 23 -12.730 -1.232 6.107
152 HH22 ARG 23 2HH2 ARG 23 -14.317 -1.917 6.186
153 H GLN 24 H GLN 24 -9.846 1.682 0.141
154 HA GLN 24 HA GLN 24 -11.757 2.416 -1.952
155 HB2 GLN 24 1HB GLN 24 -10.414 4.303 -0.027
156 HB3 GLN 24 2HB GLN 24 -11.896 4.553 -0.939
157 HG2 GLN 24 1HG GLN 24 -11.783 2.329 1.033
158 HG3 GLN 24 2HG GLN 24 -11.952 3.984 1.616
159 HE21 GLN 24 1HE2 GLN 24 -13.403 1.483 -0.356
160 HE22 GLN 24 2HE2 GLN 24 -15.006 2.125 -0.331
161 H ARG 25 H ARG 25 -11.143 3.265 -3.839
162 HA ARG 25 HA ARG 25 -8.530 3.185 -4.755
163 HB2 ARG 25 1HB ARG 25 -10.563 3.282 -6.188
164 HB3 ARG 25 2HB ARG 25 -10.727 4.986 -5.786
165 HG2 ARG 25 1HG ARG 25 -8.674 5.514 -6.891
166 HG3 ARG 25 2HG ARG 25 -8.315 3.804 -7.139
167 HD2 ARG 25 1HD ARG 25 -10.040 3.562 -8.718
168 HD3 ARG 25 2HD ARG 25 -10.794 5.085 -8.248
169 HE ARG 25 HE ARG 25 -8.620 4.722 -10.093
170 HH11 ARG 25 1HH1 ARG 25 -10.201 6.943 -7.928
171 HH12 ARG 25 2HH1 ARG 25 -9.613 8.357 -8.740
172 HH21 ARG 25 1HH2 ARG 25 -7.840 6.575 -11.171
173 HH22 ARG 25 2HH2 ARG 25 -8.271 8.146 -10.585
174 H SER 26 H SER 26 -10.275 5.789 -3.182
175 HA SER 26 HA SER 26 -8.289 7.785 -3.702
176 HB2 SER 26 1HB SER 26 -10.400 7.844 -1.539
177 HB3 SER 26 2HB SER 26 -9.593 9.219 -2.292
178 HG SER 26 HG SER 26 -11.762 8.721 -3.083
179 H ALA 27 H ALA 27 -8.495 5.186 -1.559
180 HA ALA 27 HA ALA 27 -6.911 6.383 0.550
181 HB1 ALA 27 3HB ALA 27 -8.692 4.635 0.926
182 HB2 ALA 27 1HB ALA 27 -7.573 3.466 0.226
183 HB3 ALA 27 2HB ALA 27 -7.138 4.329 1.702
184 H LEU 28 H LEU 28 -6.449 4.183 -2.159
185 HA LEU 28 HA LEU 28 -3.680 3.688 -1.460
186 HB2 LEU 28 1HB LEU 28 -4.616 1.812 -2.413
187 HB3 LEU 28 2HB LEU 28 -5.548 2.744 -3.583
188 HG LEU 28 HG LEU 28 -3.096 3.266 -4.502
189 HD11 LEU 28 1HD1 LEU 28 -1.719 1.247 -4.378
190 HD12 LEU 28 2HD1 LEU 28 -2.866 0.535 -3.245
191 HD13 LEU 28 3HD1 LEU 28 -1.954 1.973 -2.788
192 HD21 LEU 28 3HD2 LEU 28 -5.260 1.868 -5.359
193 HD22 LEU 28 1HD2 LEU 28 -4.026 0.608 -5.330
194 HD23 LEU 28 2HD2 LEU 28 -3.769 2.071 -6.281
195 H ASN 29 H ASN 29 -5.463 5.311 -4.073
196 HA ASN 29 HA ASN 29 -3.358 6.176 -5.624
197 HB2 ASN 29 1HB ASN 29 -6.079 7.276 -5.052
198 HB3 ASN 29 2HB ASN 29 -4.948 8.258 -5.979
199 HD21 ASN 29 1HD2 ASN 29 -7.396 7.225 -6.933
200 HD22 ASN 29 2HD2 ASN 29 -7.041 6.128 -8.220
201 H SER 30 H SER 30 -4.381 7.320 -2.508
202 HA SER 30 HA SER 30 -2.730 9.707 -2.654
203 HB2 SER 30 1HB SER 30 -4.826 9.941 -1.486
204 HB3 SER 30 2HB SER 30 -4.458 8.562 -0.450
205 HG SER 30 HG SER 30 -4.008 10.975 0.178
206 H HIS 31 H HIS 31 -2.754 6.573 -1.034
207 HA HIS 31 HA HIS 31 -0.566 6.975 0.668
208 HB2 HIS 31 1HB HIS 31 -1.912 5.067 1.066
209 HB3 HIS 31 2HB HIS 31 -1.731 4.496 -0.590
210 HD1 HIS 31 HD1 HIS 31 0.141 4.721 2.665
211 HD2 HIS 31 HD2 HIS 31 0.496 2.926 -1.065
212 HE1 HIS 31 HE1 HIS 31 2.048 3.096 2.880
213 H ARG 32 H ARG 32 -0.725 5.826 -2.675
214 HA ARG 32 HA ARG 32 1.959 5.115 -2.988
215 HB2 ARG 32 1HB ARG 32 0.080 6.251 -5.068
216 HB3 ARG 32 2HB ARG 32 1.569 5.376 -5.397
217 HG2 ARG 32 1HG ARG 32 0.636 3.372 -4.381
218 HG3 ARG 32 2HG ARG 32 -0.850 4.246 -4.005
219 HD2 ARG 32 1HD ARG 32 0.254 3.752 -6.769
220 HD3 ARG 32 2HD ARG 32 -1.081 2.873 -6.024
221 HE ARG 32 HE ARG 32 -2.461 4.690 -6.393
222 HH11 ARG 32 1HH1 ARG 32 0.841 5.502 -7.142
223 HH12 ARG 32 2HH1 ARG 32 0.433 6.987 -7.937
224 HH21 ARG 32 1HH2 ARG 32 -3.011 6.643 -7.436
225 HH22 ARG 32 2HH2 ARG 32 -1.758 7.635 -8.102
226 H MET 33 H MET 33 0.460 8.210 -2.776
227 HA MET 33 HA MET 33 2.403 9.745 -4.143
228 HB2 MET 33 1HB MET 33 0.593 10.594 -1.875
229 HB3 MET 33 2HB MET 33 1.425 11.665 -2.994
230 HG2 MET 33 1HG MET 33 0.130 10.530 -4.841
231 HG3 MET 33 2HG MET 33 -0.836 9.781 -3.572
232 HE1 MET 33 3HE MET 33 -1.869 12.454 -6.019
233 HE2 MET 33 1HE MET 33 -2.334 10.850 -5.450
234 HE3 MET 33 2HE MET 33 -3.287 12.261 -4.987
235 H ILE 34 H ILE 34 2.018 8.853 -0.733
236 HA ILE 34 HA ILE 34 4.044 10.333 0.404
237 HB ILE 34 HB ILE 34 3.947 8.940 2.241
238 HG12 ILE 34 1HG1 ILE 34 3.609 6.725 0.242
239 HG13 ILE 34 2HG1 ILE 34 4.834 6.909 1.493
240 HG21 ILE 34 1HG2 ILE 34 1.402 8.027 0.950
241 HG22 ILE 34 2HG2 ILE 34 1.694 8.497 2.624
242 HG23 ILE 34 3HG2 ILE 34 1.662 9.723 1.357
243 HD11 ILE 34 3HD1 ILE 34 1.929 6.338 2.024
244 HD12 ILE 34 1HD1 ILE 34 3.200 5.117 1.952
245 HD13 ILE 34 2HD1 ILE 34 3.242 6.363 3.201
246 H HIS 35 H HIS 35 4.277 7.537 -1.648
247 HA HIS 35 HA HIS 35 7.064 7.060 -1.043
248 HB2 HIS 35 1HB HIS 35 5.282 5.893 -3.191
249 HB3 HIS 35 2HB HIS 35 6.914 5.345 -2.818
250 HD1 HIS 35 HD1 HIS 35 6.862 5.083 0.175
251 HD2 HIS 35 HD2 HIS 35 3.674 3.944 -2.233
252 HE1 HIS 35 HE1 HIS 35 5.562 3.409 1.528
253 H THR 36 H THR 36 5.202 8.216 -3.845
254 HA THR 36 HA THR 36 7.092 8.660 -5.713
255 HB THR 36 HB THR 36 5.827 10.547 -6.545
256 HG1 THR 36 HG1 THR 36 5.556 11.555 -4.430
257 HG21 THR 36 3HG2 THR 36 4.859 8.140 -6.488
258 HG22 THR 36 1HG2 THR 36 3.795 9.478 -6.918
259 HG23 THR 36 2HG2 THR 36 3.741 8.796 -5.293
260 H GLY 37 H GLY 37 6.484 10.756 -2.911
261 HA2 GLY 37 1HA GLY 37 8.857 11.504 -2.091
262 HA3 GLY 37 2HA GLY 37 8.824 12.372 -3.619
263 H GLU 38 H GLU 38 8.796 14.436 -2.855
264 HA GLU 38 HA GLU 38 6.596 15.169 -1.044
265 HB2 GLU 38 1HB GLU 38 9.313 16.339 -1.531
266 HB3 GLU 38 2HB GLU 38 8.028 17.346 -0.879
267 HG2 GLU 38 1HG GLU 38 7.940 16.191 1.105
268 HG3 GLU 38 2HG GLU 38 8.624 14.725 0.406
269 H LYS 39 H LYS 39 5.957 14.736 -3.700
270 HA LYS 39 HA LYS 39 5.459 17.477 -4.664
271 HB2 LYS 39 1HB LYS 39 5.786 14.980 -6.338
272 HB3 LYS 39 2HB LYS 39 5.441 16.592 -6.951
273 HG2 LYS 39 1HG LYS 39 7.700 16.444 -7.302
274 HG3 LYS 39 2HG LYS 39 7.649 17.229 -5.722
275 HD2 LYS 39 1HD LYS 39 8.035 15.104 -4.621
276 HD3 LYS 39 2HD LYS 39 7.984 14.263 -6.172
277 HE2 LYS 39 1HE LYS 39 10.265 14.492 -5.715
278 HE3 LYS 39 2HE LYS 39 9.919 15.792 -6.854
279 HZ1 LYS 39 3HZ LYS 39 10.016 16.135 -3.907
280 HZ2 LYS 39 1HZ LYS 39 9.852 17.358 -5.065
281 HZ3 LYS 39 2HZ LYS 39 11.299 16.490 -4.951
282 HA PRO 40 HA PRO 40 1.381 15.563 -3.677
283 HB2 PRO 40 1HB PRO 40 0.295 17.860 -2.720
284 HB3 PRO 40 2HB PRO 40 1.264 16.767 -1.724
285 HG2 PRO 40 1HG PRO 40 2.072 19.307 -3.087
286 HG3 PRO 40 2HG PRO 40 2.469 18.738 -1.455
287 HD2 PRO 40 1HD PRO 40 4.198 18.536 -3.529
288 HD3 PRO 40 2HD PRO 40 4.145 17.348 -2.211
289 H SER 41 H SER 41 0.432 15.262 -5.617
290 HA SER 41 HA SER 41 -0.542 17.654 -7.032
291 HB2 SER 41 1HB SER 41 1.417 16.384 -8.142
292 HB3 SER 41 2HB SER 41 0.224 15.131 -8.486
293 HG SER 41 HG SER 41 0.682 17.285 -9.886
294 H GLY 42 H GLY 42 -2.562 17.442 -6.005
295 HA2 GLY 42 1HA GLY 42 -4.366 15.658 -7.356
296 HA3 GLY 42 2HA GLY 42 -4.134 15.237 -5.666
297 HA PRO 43 HA PRO 43 -7.578 18.370 -6.066
298 HB2 PRO 43 1HB PRO 43 -9.429 16.900 -4.731
299 HB3 PRO 43 2HB PRO 43 -9.172 16.767 -6.475
300 HG2 PRO 43 1HG PRO 43 -8.160 15.011 -4.272
301 HG3 PRO 43 2HG PRO 43 -8.837 14.554 -5.845
302 HD2 PRO 43 1HD PRO 43 -6.174 14.585 -5.359
303 HD3 PRO 43 2HD PRO 43 -6.857 14.955 -6.955
304 H SER 44 H SER 44 -6.258 19.610 -4.611
305 HA SER 44 HA SER 44 -6.896 19.147 -1.770
306 HB2 SER 44 1HB SER 44 -4.764 20.399 -1.287
307 HB3 SER 44 2HB SER 44 -4.532 18.838 -2.075
308 HG SER 44 HG SER 44 -4.822 20.967 -3.798
309 H SER 45 H SER 45 -8.649 20.541 -3.413
310 HA SER 45 HA SER 45 -8.178 23.368 -3.208
311 HB2 SER 45 1HB SER 45 -9.506 22.715 -5.056
312 HB3 SER 45 2HB SER 45 -10.548 21.705 -4.054
313 HG SER 45 HG SER 45 -11.631 23.429 -3.409
314 H GLY 46 H GLY 46 -10.263 21.016 -1.555
315 HA2 GLY 46 1HA GLY 46 -10.222 22.638 0.839
316 HA3 GLY 46 2HA GLY 46 -11.796 22.539 0.065
Start of MODEL 3
1 H1 GLY 1 H GLY 1 9.334 -19.139 1.623
2 HA2 GLY 1 1HA GLY 1 7.376 -18.175 0.391
3 HA3 GLY 1 2HA GLY 1 7.746 -19.352 -0.861
4 H SER 2 H SER 2 6.245 -18.799 2.193
5 HA SER 2 HA SER 2 5.733 -21.596 2.714
6 HB2 SER 2 1HB SER 2 4.610 -20.856 4.700
7 HB3 SER 2 2HB SER 2 6.058 -19.866 4.525
8 HG SER 2 HG SER 2 4.078 -18.699 5.025
9 H SER 3 H SER 3 3.591 -22.498 2.872
10 HA SER 3 HA SER 3 1.998 -21.918 0.595
11 HB2 SER 3 1HB SER 3 0.460 -23.645 1.534
12 HB3 SER 3 2HB SER 3 2.135 -24.189 1.433
13 HG SER 3 HG SER 3 1.447 -24.742 3.444
14 H GLY 4 H GLY 4 -0.221 -21.263 0.545
15 HA2 GLY 4 1HA GLY 4 -2.163 -20.315 1.556
16 HA3 GLY 4 2HA GLY 4 -1.173 -19.823 2.922
17 H SER 5 H SER 5 0.938 -18.617 1.473
18 HA SER 5 HA SER 5 -0.432 -16.170 0.626
19 HB2 SER 5 1HB SER 5 1.392 -16.240 2.460
20 HB3 SER 5 2HB SER 5 2.528 -16.411 1.122
21 HG SER 5 HG SER 5 2.282 -14.373 0.685
22 H SER 6 H SER 6 -0.944 -16.559 -1.498
23 HA SER 6 HA SER 6 1.094 -16.147 -3.422
24 HB2 SER 6 1HB SER 6 1.590 -18.503 -3.037
25 HB3 SER 6 2HB SER 6 -0.101 -18.927 -3.303
26 HG SER 6 HG SER 6 1.080 -17.491 -5.341
27 H GLY 7 H GLY 7 0.201 -15.133 -5.104
28 HA2 GLY 7 1HA GLY 7 -1.608 -15.363 -6.845
29 HA3 GLY 7 2HA GLY 7 -2.714 -15.431 -5.482
30 H THR 8 H THR 8 -3.605 -13.587 -4.821
31 HA THR 8 HA THR 8 -2.223 -11.057 -5.322
32 HB THR 8 HB THR 8 -4.255 -10.011 -6.229
33 HG1 THR 8 HG1 THR 8 -6.090 -11.115 -6.449
34 HG21 THR 8 3HG2 THR 8 -4.310 -11.324 -8.426
35 HG22 THR 8 1HG2 THR 8 -3.131 -12.397 -7.674
36 HG23 THR 8 2HG2 THR 8 -2.750 -10.690 -7.903
37 H ALA 9 H ALA 9 -3.442 -9.203 -4.265
38 HA ALA 9 HA ALA 9 -3.938 -9.901 -1.534
39 HB1 ALA 9 3HB ALA 9 -3.239 -7.818 -1.244
40 HB2 ALA 9 1HB ALA 9 -3.277 -7.547 -2.986
41 HB3 ALA 9 2HB ALA 9 -4.710 -7.220 -2.012
42 H GLU 10 H GLU 10 -5.843 -9.701 -0.356
43 HA GLU 10 HA GLU 10 -8.199 -10.543 -1.548
44 HB2 GLU 10 1HB GLU 10 -7.777 -10.754 0.849
45 HB3 GLU 10 2HB GLU 10 -7.851 -9.007 1.033
46 HG2 GLU 10 1HG GLU 10 -10.198 -9.037 0.346
47 HG3 GLU 10 2HG GLU 10 -10.121 -10.791 0.180
48 H LYS 11 H LYS 11 -6.824 -7.418 -1.474
49 HA LYS 11 HA LYS 11 -9.373 -6.199 -2.299
50 HB2 LYS 11 1HB LYS 11 -6.851 -4.835 -1.336
51 HB3 LYS 11 2HB LYS 11 -8.373 -4.044 -1.725
52 HG2 LYS 11 1HG LYS 11 -7.741 -5.845 0.586
53 HG3 LYS 11 2HG LYS 11 -8.331 -4.181 0.609
54 HD2 LYS 11 1HD LYS 11 -9.866 -6.615 -0.304
55 HD3 LYS 11 2HD LYS 11 -10.117 -5.721 1.197
56 HE2 LYS 11 1HE LYS 11 -10.460 -3.687 -0.389
57 HE3 LYS 11 2HE LYS 11 -10.741 -4.921 -1.617
58 HZ1 LYS 11 3HZ LYS 11 -12.800 -5.118 -0.870
59 HZ2 LYS 11 1HZ LYS 11 -12.512 -3.976 0.345
60 HZ3 LYS 11 2HZ LYS 11 -12.223 -5.616 0.640
61 HA PRO 12 HA PRO 12 -7.923 -5.695 -6.415
62 HB2 PRO 12 1HB PRO 12 -9.225 -3.421 -7.126
63 HB3 PRO 12 2HB PRO 12 -10.043 -4.977 -6.935
64 HG2 PRO 12 1HG PRO 12 -9.874 -2.679 -5.024
65 HG3 PRO 12 2HG PRO 12 -11.272 -3.687 -5.441
66 HD2 PRO 12 1HD PRO 12 -9.832 -4.058 -3.179
67 HD3 PRO 12 2HD PRO 12 -10.616 -5.397 -4.042
68 H PHE 13 H PHE 13 -7.584 -3.038 -4.151
69 HA PHE 13 HA PHE 13 -5.588 -1.742 -5.845
70 HB2 PHE 13 1HB PHE 13 -6.523 -0.821 -3.128
71 HB3 PHE 13 2HB PHE 13 -5.740 0.132 -4.385
72 HD1 PHE 13 HD2 PHE 13 -8.872 -1.392 -3.273
73 HD2 PHE 13 HD1 PHE 13 -6.984 0.962 -6.275
74 HE1 PHE 13 HE2 PHE 13 -11.078 -0.718 -4.128
75 HE2 PHE 13 HE1 PHE 13 -9.188 1.640 -7.134
76 HZ PHE 13 HZ PHE 13 -11.238 0.800 -6.061
77 H ARG 14 H ARG 14 -3.448 -1.774 -5.455
78 HA ARG 14 HA ARG 14 -2.415 -2.613 -2.879
79 HB2 ARG 14 1HB ARG 14 -2.846 -4.724 -4.174
80 HB3 ARG 14 2HB ARG 14 -1.674 -4.166 -5.361
81 HG2 ARG 14 1HG ARG 14 0.050 -4.129 -3.603
82 HG3 ARG 14 2HG ARG 14 -1.134 -4.769 -2.462
83 HD2 ARG 14 1HD ARG 14 0.292 -6.541 -3.354
84 HD3 ARG 14 2HD ARG 14 -1.390 -6.768 -3.829
85 HE ARG 14 HE ARG 14 -0.416 -5.464 -5.943
86 HH11 ARG 14 1HH1 ARG 14 0.824 -8.183 -4.157
87 HH12 ARG 14 2HH1 ARG 14 1.631 -8.878 -5.523
88 HH21 ARG 14 1HH2 ARG 14 0.643 -6.369 -7.749
89 HH22 ARG 14 2HH2 ARG 14 1.529 -7.846 -7.566
90 H CYS 15 H CYS 15 -0.450 -1.748 -2.448
91 HA CYS 15 HA CYS 15 0.631 0.101 -4.410
92 HB2 CYS 15 1HB CYS 15 0.373 0.934 -2.157
93 HB3 CYS 15 2HB CYS 15 1.313 -0.406 -1.509
94 H ASP 16 H ASP 16 2.148 -0.507 -5.788
95 HA ASP 16 HA ASP 16 3.693 -2.908 -5.340
96 HB2 ASP 16 1HB ASP 16 2.701 -1.935 -7.587
97 HB3 ASP 16 2HB ASP 16 4.228 -1.058 -7.626
98 H THR 17 H THR 17 4.214 -0.891 -3.441
99 HA THR 17 HA THR 17 7.034 -0.310 -4.060
100 HB THR 17 HB THR 17 5.292 1.512 -2.399
101 HG1 THR 17 HG1 THR 17 4.650 2.421 -4.196
102 HG21 THR 17 3HG2 THR 17 7.172 3.118 -2.973
103 HG22 THR 17 1HG2 THR 17 8.067 1.714 -3.553
104 HG23 THR 17 2HG2 THR 17 7.580 1.812 -1.861
105 H CYS 18 H CYS 18 4.685 -0.419 -1.376
106 HA CYS 18 HA CYS 18 6.784 -1.663 0.278
107 HB2 CYS 18 1HB CYS 18 5.633 -0.726 2.239
108 HB3 CYS 18 2HB CYS 18 6.135 0.539 1.122
109 H ASP 19 H ASP 19 4.423 -2.629 -1.541
110 HA ASP 19 HA ASP 19 3.051 -4.442 -1.607
111 HB2 ASP 19 1HB ASP 19 5.025 -5.590 -0.635
112 HB3 ASP 19 2HB ASP 19 4.417 -5.223 0.977
113 H LYS 20 H LYS 20 1.869 -2.188 -0.696
114 HA LYS 20 HA LYS 20 0.307 -2.972 1.662
115 HB2 LYS 20 1HB LYS 20 1.100 -0.394 0.459
116 HB3 LYS 20 2HB LYS 20 -0.536 -0.455 1.101
117 HG2 LYS 20 1HG LYS 20 1.629 -1.504 2.825
118 HG3 LYS 20 2HG LYS 20 1.563 0.242 2.573
119 HD2 LYS 20 1HD LYS 20 -0.566 0.415 3.526
120 HD3 LYS 20 2HD LYS 20 -0.883 -1.313 3.352
121 HE2 LYS 20 1HE LYS 20 -0.453 -0.752 5.678
122 HE3 LYS 20 2HE LYS 20 0.825 -1.788 5.044
123 HZ1 LYS 20 3HZ LYS 20 1.194 1.118 4.930
124 HZ2 LYS 20 1HZ LYS 20 2.347 -0.109 5.106
125 HZ3 LYS 20 2HZ LYS 20 1.385 0.342 6.422
126 H SER 21 H SER 21 -2.053 -2.106 1.525
127 HA SER 21 HA SER 21 -3.253 -2.263 -1.097
128 HB2 SER 21 1HB SER 21 -4.771 -4.174 -0.368
129 HB3 SER 21 2HB SER 21 -3.105 -4.612 -0.746
130 HG SER 21 HG SER 21 -4.017 -5.487 1.265
131 H PHE 22 H PHE 22 -5.412 -1.568 -1.136
132 HA PHE 22 HA PHE 22 -6.576 -0.693 1.404
133 HB2 PHE 22 1HB PHE 22 -6.235 1.104 -1.007
134 HB3 PHE 22 2HB PHE 22 -7.104 1.522 0.466
135 HD1 PHE 22 HD2 PHE 22 -3.744 0.266 -0.566
136 HD2 PHE 22 HD1 PHE 22 -5.996 2.784 2.024
137 HE1 PHE 22 HE2 PHE 22 -1.655 1.115 0.418
138 HE2 PHE 22 HE1 PHE 22 -3.910 3.638 3.011
139 HZ PHE 22 HZ PHE 22 -1.737 2.803 2.210
140 H ARG 23 H ARG 23 -8.867 0.130 1.048
141 HA ARG 23 HA ARG 23 -10.206 -1.727 -0.778
142 HB2 ARG 23 1HB ARG 23 -11.397 -0.084 1.463
143 HB3 ARG 23 2HB ARG 23 -12.192 -1.373 0.569
144 HG2 ARG 23 1HG ARG 23 -10.426 -2.930 1.456
145 HG3 ARG 23 2HG ARG 23 -9.917 -1.613 2.515
146 HD2 ARG 23 1HD ARG 23 -12.729 -2.686 2.414
147 HD3 ARG 23 2HD ARG 23 -11.506 -3.264 3.544
148 HE ARG 23 HE ARG 23 -12.000 -0.405 3.554
149 HH11 ARG 23 1HH1 ARG 23 -12.679 -3.509 4.976
150 HH12 ARG 23 2HH1 ARG 23 -13.248 -2.845 6.472
151 HH21 ARG 23 1HH2 ARG 23 -12.747 0.482 5.518
152 HH22 ARG 23 2HH2 ARG 23 -13.287 -0.575 6.779
153 H GLN 24 H GLN 24 -9.926 1.690 -0.015
154 HA GLN 24 HA GLN 24 -11.733 2.338 -2.237
155 HB2 GLN 24 1HB GLN 24 -10.613 4.281 -0.224
156 HB3 GLN 24 2HB GLN 24 -12.002 4.497 -1.282
157 HG2 GLN 24 1HG GLN 24 -12.069 2.283 0.696
158 HG3 GLN 24 2HG GLN 24 -12.278 3.935 1.273
159 HE21 GLN 24 1HE2 GLN 24 -14.387 2.850 1.861
160 HE22 GLN 24 2HE2 GLN 24 -15.664 2.964 0.702
161 H ARG 25 H ARG 25 -10.972 3.139 -4.087
162 HA ARG 25 HA ARG 25 -8.301 3.125 -4.783
163 HB2 ARG 25 1HB ARG 25 -10.350 3.241 -6.303
164 HB3 ARG 25 2HB ARG 25 -10.311 4.981 -6.047
165 HG2 ARG 25 1HG ARG 25 -8.046 5.059 -6.978
166 HG3 ARG 25 2HG ARG 25 -8.111 3.318 -7.256
167 HD2 ARG 25 1HD ARG 25 -9.872 5.422 -8.505
168 HD3 ARG 25 2HD ARG 25 -8.618 4.478 -9.309
169 HE ARG 25 HE ARG 25 -10.240 2.554 -8.422
170 HH11 ARG 25 1HH1 ARG 25 -10.918 5.533 -10.090
171 HH12 ARG 25 2HH1 ARG 25 -12.330 4.919 -10.885
172 HH21 ARG 25 1HH2 ARG 25 -12.097 1.733 -9.462
173 HH22 ARG 25 2HH2 ARG 25 -13.000 2.758 -10.526
174 H SER 26 H SER 26 -10.213 5.712 -3.385
175 HA SER 26 HA SER 26 -8.307 7.781 -3.792
176 HB2 SER 26 1HB SER 26 -10.544 8.471 -3.400
177 HB3 SER 26 2HB SER 26 -10.671 7.492 -1.938
178 HG SER 26 HG SER 26 -10.298 9.844 -1.684
179 H ALA 27 H ALA 27 -8.557 5.204 -1.543
180 HA ALA 27 HA ALA 27 -6.923 6.432 0.494
181 HB1 ALA 27 3HB ALA 27 -7.191 4.449 1.722
182 HB2 ALA 27 1HB ALA 27 -8.724 4.673 0.878
183 HB3 ALA 27 2HB ALA 27 -7.549 3.503 0.277
184 H LEU 28 H LEU 28 -6.481 4.229 -2.203
185 HA LEU 28 HA LEU 28 -3.725 3.679 -1.495
186 HB2 LEU 28 1HB LEU 28 -4.661 1.825 -2.474
187 HB3 LEU 28 2HB LEU 28 -5.610 2.776 -3.614
188 HG LEU 28 HG LEU 28 -3.179 3.305 -4.574
189 HD11 LEU 28 1HD1 LEU 28 -2.916 0.563 -3.349
190 HD12 LEU 28 2HD1 LEU 28 -2.003 2.000 -2.891
191 HD13 LEU 28 3HD1 LEU 28 -1.790 1.294 -4.494
192 HD21 LEU 28 3HD2 LEU 28 -4.090 0.657 -5.425
193 HD22 LEU 28 1HD2 LEU 28 -3.904 2.147 -6.349
194 HD23 LEU 28 2HD2 LEU 28 -5.358 1.883 -5.386
195 H ASN 29 H ASN 29 -5.464 5.351 -4.108
196 HA ASN 29 HA ASN 29 -3.333 6.198 -5.633
197 HB2 ASN 29 1HB ASN 29 -6.038 7.348 -5.071
198 HB3 ASN 29 2HB ASN 29 -4.883 8.297 -6.003
199 HD21 ASN 29 1HD2 ASN 29 -7.227 7.539 -7.133
200 HD22 ASN 29 2HD2 ASN 29 -6.944 6.338 -8.342
201 H SER 30 H SER 30 -4.366 7.330 -2.517
202 HA SER 30 HA SER 30 -2.627 9.666 -2.636
203 HB2 SER 30 1HB SER 30 -4.764 8.704 -0.791
204 HB3 SER 30 2HB SER 30 -3.524 9.771 -0.132
205 HG SER 30 HG SER 30 -4.561 10.581 -2.548
206 H HIS 31 H HIS 31 -2.818 6.510 -1.123
207 HA HIS 31 HA HIS 31 -0.746 6.834 0.756
208 HB2 HIS 31 1HB HIS 31 -2.064 4.953 1.132
209 HB3 HIS 31 2HB HIS 31 -2.031 4.467 -0.560
210 HD1 HIS 31 HD1 HIS 31 0.057 4.376 2.567
211 HD2 HIS 31 HD2 HIS 31 0.044 2.780 -1.268
212 HE1 HIS 31 HE1 HIS 31 1.854 2.616 2.565
213 H ARG 32 H ARG 32 -0.740 5.866 -2.632
214 HA ARG 32 HA ARG 32 1.945 5.037 -2.781
215 HB2 ARG 32 1HB ARG 32 0.255 6.254 -4.973
216 HB3 ARG 32 2HB ARG 32 1.708 5.287 -5.194
217 HG2 ARG 32 1HG ARG 32 0.336 3.503 -3.841
218 HG3 ARG 32 2HG ARG 32 -1.037 4.443 -4.429
219 HD2 ARG 32 1HD ARG 32 -0.602 2.661 -5.978
220 HD3 ARG 32 2HD ARG 32 -0.154 4.189 -6.734
221 HE ARG 32 HE ARG 32 2.181 3.362 -5.699
222 HH11 ARG 32 1HH1 ARG 32 -0.214 1.751 -7.646
223 HH12 ARG 32 2HH1 ARG 32 0.931 0.709 -8.424
224 HH21 ARG 32 1HH2 ARG 32 3.698 1.996 -6.717
225 HH22 ARG 32 2HH2 ARG 32 3.155 0.849 -7.894
226 H MET 33 H MET 33 0.480 8.172 -2.709
227 HA MET 33 HA MET 33 2.530 9.676 -3.916
228 HB2 MET 33 1HB MET 33 0.537 10.460 -1.782
229 HB3 MET 33 2HB MET 33 1.556 11.594 -2.660
230 HG2 MET 33 1HG MET 33 0.482 10.580 -4.770
231 HG3 MET 33 2HG MET 33 -0.736 9.958 -3.659
232 HE1 MET 33 3HE MET 33 -2.577 12.207 -5.473
233 HE2 MET 33 1HE MET 33 -2.541 10.773 -4.447
234 HE3 MET 33 2HE MET 33 -3.221 12.279 -3.832
235 H ILE 34 H ILE 34 1.970 8.734 -0.545
236 HA ILE 34 HA ILE 34 3.940 10.160 0.732
237 HB ILE 34 HB ILE 34 3.778 8.690 2.508
238 HG12 ILE 34 1HG1 ILE 34 3.478 6.556 0.413
239 HG13 ILE 34 2HG1 ILE 34 4.686 6.690 1.685
240 HG21 ILE 34 1HG2 ILE 34 1.280 7.886 1.051
241 HG22 ILE 34 2HG2 ILE 34 1.501 8.205 2.771
242 HG23 ILE 34 3HG2 ILE 34 1.539 9.537 1.616
243 HD11 ILE 34 3HD1 ILE 34 3.048 6.113 3.353
244 HD12 ILE 34 1HD1 ILE 34 1.773 6.091 2.135
245 HD13 ILE 34 2HD1 ILE 34 3.064 4.891 2.083
246 H HIS 35 H HIS 35 4.296 7.529 -1.481
247 HA HIS 35 HA HIS 35 7.056 7.018 -0.743
248 HB2 HIS 35 1HB HIS 35 5.388 5.912 -3.012
249 HB3 HIS 35 2HB HIS 35 7.001 5.360 -2.570
250 HD1 HIS 35 HD1 HIS 35 6.833 4.950 0.379
251 HD2 HIS 35 HD2 HIS 35 3.705 3.975 -2.176
252 HE1 HIS 35 HE1 HIS 35 5.464 3.240 1.613
253 H THR 36 H THR 36 5.974 9.622 -1.942
254 HA THR 36 HA THR 36 8.191 9.988 -3.796
255 HB THR 36 HB THR 36 6.901 10.948 -5.558
256 HG1 THR 36 HG1 THR 36 4.675 10.619 -3.809
257 HG21 THR 36 3HG2 THR 36 5.582 8.395 -4.627
258 HG22 THR 36 1HG2 THR 36 7.023 8.520 -5.635
259 HG23 THR 36 2HG2 THR 36 5.464 9.066 -6.254
260 H GLY 37 H GLY 37 8.823 12.175 -4.066
261 HA2 GLY 37 1HA GLY 37 8.096 14.549 -3.598
262 HA3 GLY 37 2HA GLY 37 7.721 13.959 -1.986
263 H GLU 38 H GLU 38 9.148 14.976 -0.709
264 HA GLU 38 HA GLU 38 11.909 15.296 -1.535
265 HB2 GLU 38 1HB GLU 38 10.463 16.116 0.989
266 HB3 GLU 38 2HB GLU 38 12.147 16.484 0.644
267 HG2 GLU 38 1HG GLU 38 10.984 18.425 0.086
268 HG3 GLU 38 2HG GLU 38 11.304 17.636 -1.457
269 H LYS 39 H LYS 39 13.566 14.894 0.335
270 HA LYS 39 HA LYS 39 13.040 12.257 1.532
271 HB2 LYS 39 1HB LYS 39 15.177 11.446 0.899
272 HB3 LYS 39 2HB LYS 39 14.482 12.163 -0.549
273 HG2 LYS 39 1HG LYS 39 15.792 14.280 0.178
274 HG3 LYS 39 2HG LYS 39 16.725 13.146 1.158
275 HD2 LYS 39 1HD LYS 39 17.548 12.023 -0.698
276 HD3 LYS 39 2HD LYS 39 16.238 12.581 -1.741
277 HE2 LYS 39 1HE LYS 39 17.187 14.905 -1.482
278 HE3 LYS 39 2HE LYS 39 18.587 14.160 -0.711
279 HZ1 LYS 39 3HZ LYS 39 17.737 13.146 -3.325
280 HZ2 LYS 39 1HZ LYS 39 19.289 13.242 -2.658
281 HZ3 LYS 39 2HZ LYS 39 18.545 14.631 -3.271
282 HA PRO 40 HA PRO 40 14.435 14.100 5.280
283 HB2 PRO 40 1HB PRO 40 15.132 11.851 6.632
284 HB3 PRO 40 2HB PRO 40 13.451 12.318 6.346
285 HG2 PRO 40 1HG PRO 40 15.143 10.335 4.874
286 HG3 PRO 40 2HG PRO 40 13.451 10.199 5.389
287 HD2 PRO 40 1HD PRO 40 14.155 10.813 2.847
288 HD3 PRO 40 2HD PRO 40 12.677 11.438 3.607
289 H SER 41 H SER 41 16.440 12.764 3.017
290 HA SER 41 HA SER 41 18.850 13.155 4.664
291 HB2 SER 41 1HB SER 41 20.033 11.800 2.975
292 HB3 SER 41 2HB SER 41 18.680 10.915 3.680
293 HG SER 41 HG SER 41 18.881 10.829 1.325
294 H GLY 42 H GLY 42 20.571 14.397 3.857
295 HA2 GLY 42 1HA GLY 42 21.547 15.694 2.041
296 HA3 GLY 42 2HA GLY 42 19.913 16.083 1.524
297 HA PRO 43 HA PRO 43 21.767 19.384 4.390
298 HB2 PRO 43 1HB PRO 43 22.162 21.315 2.523
299 HB3 PRO 43 2HB PRO 43 23.398 20.127 2.952
300 HG2 PRO 43 1HG PRO 43 21.518 20.148 0.622
301 HG3 PRO 43 2HG PRO 43 23.244 19.744 0.663
302 HD2 PRO 43 1HD PRO 43 21.307 17.853 0.616
303 HD3 PRO 43 2HD PRO 43 22.856 17.613 1.449
304 H SER 44 H SER 44 19.782 19.716 5.335
305 HA SER 44 HA SER 44 18.191 21.860 4.258
306 HB2 SER 44 1HB SER 44 16.058 20.597 4.295
307 HB3 SER 44 2HB SER 44 17.176 19.982 3.077
308 HG SER 44 HG SER 44 16.033 18.449 4.608
309 H SER 45 H SER 45 16.613 22.659 5.781
310 HA SER 45 HA SER 45 17.554 22.516 8.470
311 HB2 SER 45 1HB SER 45 16.021 24.239 8.947
312 HB3 SER 45 2HB SER 45 16.473 24.524 7.266
313 HG SER 45 HG SER 45 14.518 23.973 6.628
314 H GLY 46 H GLY 46 16.493 21.734 10.310
315 HA2 GLY 46 1HA GLY 46 14.400 19.728 9.736
316 HA3 GLY 46 2HA GLY 46 15.653 19.503 10.947
Start of MODEL 4
1 H1 GLY 1 H GLY 1 9.098 -1.758 -16.252
2 HA2 GLY 1 1HA GLY 1 11.064 -3.092 -16.312
3 HA3 GLY 1 2HA GLY 1 11.974 -1.731 -15.675
4 H SER 2 H SER 2 9.720 -4.303 -14.865
5 HA SER 2 HA SER 2 10.922 -4.683 -12.309
6 HB2 SER 2 1HB SER 2 9.299 -2.652 -12.069
7 HB3 SER 2 2HB SER 2 8.034 -3.879 -12.116
8 HG SER 2 HG SER 2 8.636 -3.517 -9.984
9 H SER 3 H SER 3 9.521 -6.304 -10.988
10 HA SER 3 HA SER 3 8.389 -8.252 -12.888
11 HB2 SER 3 1HB SER 3 9.933 -8.734 -10.331
12 HB3 SER 3 2HB SER 3 9.137 -10.002 -11.263
13 HG SER 3 HG SER 3 11.052 -8.253 -12.395
14 H GLY 4 H GLY 4 6.857 -9.832 -11.828
15 HA2 GLY 4 1HA GLY 4 4.948 -8.291 -10.230
16 HA3 GLY 4 2HA GLY 4 4.602 -9.768 -11.118
17 H SER 5 H SER 5 3.936 -9.127 -8.369
18 HA SER 5 HA SER 5 5.675 -10.909 -6.833
19 HB2 SER 5 1HB SER 5 3.405 -9.110 -5.950
20 HB3 SER 5 2HB SER 5 4.390 -10.096 -4.869
21 HG SER 5 HG SER 5 5.834 -8.486 -6.567
22 H SER 6 H SER 6 4.979 -12.796 -5.894
23 HA SER 6 HA SER 6 2.834 -14.153 -7.193
24 HB2 SER 6 1HB SER 6 4.841 -15.357 -6.480
25 HB3 SER 6 2HB SER 6 4.497 -14.964 -4.795
26 HG SER 6 HG SER 6 2.334 -16.064 -5.507
27 H GLY 7 H GLY 7 0.838 -14.749 -6.427
28 HA2 GLY 7 1HA GLY 7 -0.851 -14.983 -4.789
29 HA3 GLY 7 2HA GLY 7 0.074 -13.939 -3.720
30 H THR 8 H THR 8 -2.529 -13.432 -3.846
31 HA THR 8 HA THR 8 -2.617 -10.880 -5.275
32 HB THR 8 HB THR 8 -4.948 -11.293 -6.004
33 HG1 THR 8 HG1 THR 8 -5.815 -13.341 -5.830
34 HG21 THR 8 3HG2 THR 8 -3.181 -11.613 -7.619
35 HG22 THR 8 1HG2 THR 8 -4.399 -12.867 -7.847
36 HG23 THR 8 2HG2 THR 8 -2.885 -13.247 -7.026
37 H ALA 9 H ALA 9 -3.144 -9.333 -3.890
38 HA ALA 9 HA ALA 9 -3.928 -9.780 -1.243
39 HB1 ALA 9 3HB ALA 9 -4.759 -7.183 -1.931
40 HB2 ALA 9 1HB ALA 9 -3.259 -7.668 -1.141
41 HB3 ALA 9 2HB ALA 9 -3.324 -7.525 -2.898
42 H GLU 10 H GLU 10 -5.885 -9.530 -0.161
43 HA GLU 10 HA GLU 10 -8.171 -10.518 -1.426
44 HB2 GLU 10 1HB GLU 10 -7.750 -10.617 1.016
45 HB3 GLU 10 2HB GLU 10 -8.043 -8.886 1.116
46 HG2 GLU 10 1HG GLU 10 -9.992 -10.141 1.819
47 HG3 GLU 10 2HG GLU 10 -10.333 -9.218 0.357
48 H LYS 11 H LYS 11 -6.902 -7.333 -1.285
49 HA LYS 11 HA LYS 11 -9.447 -6.182 -2.193
50 HB2 LYS 11 1HB LYS 11 -6.924 -4.760 -1.325
51 HB3 LYS 11 2HB LYS 11 -8.470 -4.007 -1.693
52 HG2 LYS 11 1HG LYS 11 -7.746 -5.734 0.648
53 HG3 LYS 11 2HG LYS 11 -8.354 -4.077 0.643
54 HD2 LYS 11 1HD LYS 11 -9.885 -6.552 -0.155
55 HD3 LYS 11 2HD LYS 11 -10.106 -5.614 1.324
56 HE2 LYS 11 1HE LYS 11 -10.544 -3.633 -0.275
57 HE3 LYS 11 2HE LYS 11 -10.780 -4.876 -1.502
58 HZ1 LYS 11 3HZ LYS 11 -12.884 -4.330 -0.555
59 HZ2 LYS 11 1HZ LYS 11 -12.309 -4.551 1.020
60 HZ3 LYS 11 2HZ LYS 11 -12.467 -5.878 -0.016
61 HA PRO 12 HA PRO 12 -8.060 -5.780 -6.340
62 HB2 PRO 12 1HB PRO 12 -9.330 -3.498 -7.085
63 HB3 PRO 12 2HB PRO 12 -10.174 -5.032 -6.843
64 HG2 PRO 12 1HG PRO 12 -9.929 -2.692 -4.992
65 HG3 PRO 12 2HG PRO 12 -11.353 -3.682 -5.361
66 HD2 PRO 12 1HD PRO 12 -9.882 -4.027 -3.114
67 HD3 PRO 12 2HD PRO 12 -10.706 -5.370 -3.931
68 H PHE 13 H PHE 13 -7.655 -3.050 -4.167
69 HA PHE 13 HA PHE 13 -5.659 -1.841 -5.920
70 HB2 PHE 13 1HB PHE 13 -6.556 -0.855 -3.210
71 HB3 PHE 13 2HB PHE 13 -5.731 0.059 -4.468
72 HD1 PHE 13 HD2 PHE 13 -8.922 -1.359 -3.381
73 HD2 PHE 13 HD1 PHE 13 -6.928 0.918 -6.373
74 HE1 PHE 13 HE2 PHE 13 -11.096 -0.622 -4.264
75 HE2 PHE 13 HE1 PHE 13 -9.099 1.659 -7.261
76 HZ PHE 13 HZ PHE 13 -11.187 0.888 -6.207
77 H ARG 14 H ARG 14 -3.504 -1.779 -5.502
78 HA ARG 14 HA ARG 14 -2.474 -2.714 -2.954
79 HB2 ARG 14 1HB ARG 14 -2.823 -4.758 -4.376
80 HB3 ARG 14 2HB ARG 14 -1.656 -4.096 -5.512
81 HG2 ARG 14 1HG ARG 14 0.005 -4.057 -3.632
82 HG3 ARG 14 2HG ARG 14 -1.171 -4.960 -2.675
83 HD2 ARG 14 1HD ARG 14 0.438 -6.470 -3.690
84 HD3 ARG 14 2HD ARG 14 -1.169 -6.736 -4.366
85 HE ARG 14 HE ARG 14 0.516 -4.937 -5.876
86 HH11 ARG 14 1HH1 ARG 14 -0.550 -8.217 -5.402
87 HH12 ARG 14 2HH1 ARG 14 -0.126 -8.724 -7.004
88 HH21 ARG 14 1HH2 ARG 14 1.078 -5.592 -7.988
89 HH22 ARG 14 2HH2 ARG 14 0.801 -7.230 -8.473
90 H CYS 15 H CYS 15 -0.510 -1.859 -2.460
91 HA CYS 15 HA CYS 15 0.515 0.165 -4.273
92 HB2 CYS 15 1HB CYS 15 0.201 0.713 -1.895
93 HB3 CYS 15 2HB CYS 15 1.348 -0.548 -1.452
94 H ASP 16 H ASP 16 2.041 -0.296 -5.699
95 HA ASP 16 HA ASP 16 3.646 -2.686 -5.445
96 HB2 ASP 16 1HB ASP 16 2.735 -2.016 -7.632
97 HB3 ASP 16 2HB ASP 16 3.675 -0.527 -7.566
98 H THR 17 H THR 17 4.149 -0.872 -3.378
99 HA THR 17 HA THR 17 6.952 -0.190 -3.945
100 HB THR 17 HB THR 17 5.060 1.540 -2.339
101 HG1 THR 17 HG1 THR 17 4.958 1.528 -4.768
102 HG21 THR 17 3HG2 THR 17 7.950 1.969 -3.108
103 HG22 THR 17 1HG2 THR 17 7.366 1.567 -1.494
104 HG23 THR 17 2HG2 THR 17 6.931 3.109 -2.230
105 H CYS 18 H CYS 18 4.583 -0.402 -1.283
106 HA CYS 18 HA CYS 18 6.665 -1.721 0.333
107 HB2 CYS 18 1HB CYS 18 5.423 -0.912 2.317
108 HB3 CYS 18 2HB CYS 18 6.000 0.406 1.301
109 H ASP 19 H ASP 19 4.548 -2.776 -1.597
110 HA ASP 19 HA ASP 19 3.106 -4.532 -1.759
111 HB2 ASP 19 1HB ASP 19 4.742 -5.373 0.635
112 HB3 ASP 19 2HB ASP 19 3.561 -6.424 -0.140
113 H LYS 20 H LYS 20 1.787 -2.463 -0.776
114 HA LYS 20 HA LYS 20 0.291 -3.470 1.552
115 HB2 LYS 20 1HB LYS 20 1.041 -0.754 0.633
116 HB3 LYS 20 2HB LYS 20 -0.566 -0.922 1.327
117 HG2 LYS 20 1HG LYS 20 0.640 -2.109 3.272
118 HG3 LYS 20 2HG LYS 20 2.097 -1.361 2.615
119 HD2 LYS 20 1HD LYS 20 1.158 0.834 2.879
120 HD3 LYS 20 2HD LYS 20 -0.405 0.158 3.344
121 HE2 LYS 20 1HE LYS 20 2.160 -0.224 4.884
122 HE3 LYS 20 2HE LYS 20 0.936 0.988 5.263
123 HZ1 LYS 20 3HZ LYS 20 -0.652 -0.978 5.389
124 HZ2 LYS 20 1HZ LYS 20 0.453 -0.794 6.657
125 HZ3 LYS 20 2HZ LYS 20 0.729 -1.953 5.456
126 H SER 21 H SER 21 -2.070 -2.509 1.493
127 HA SER 21 HA SER 21 -3.245 -2.455 -1.148
128 HB2 SER 21 1HB SER 21 -4.828 -4.357 -0.554
129 HB3 SER 21 2HB SER 21 -3.170 -4.826 -0.930
130 HG SER 21 HG SER 21 -3.552 -5.878 0.915
131 H PHE 22 H PHE 22 -5.303 -1.576 -1.180
132 HA PHE 22 HA PHE 22 -6.432 -0.779 1.417
133 HB2 PHE 22 1HB PHE 22 -6.174 0.984 -1.029
134 HB3 PHE 22 2HB PHE 22 -6.997 1.425 0.464
135 HD1 PHE 22 HD2 PHE 22 -3.672 0.197 -0.698
136 HD2 PHE 22 HD1 PHE 22 -5.841 2.660 2.013
137 HE1 PHE 22 HE2 PHE 22 -1.553 1.057 0.210
138 HE2 PHE 22 HE1 PHE 22 -3.725 3.525 2.924
139 HZ PHE 22 HZ PHE 22 -1.578 2.723 2.024
140 H ARG 23 H ARG 23 -8.720 0.265 0.946
141 HA ARG 23 HA ARG 23 -10.160 -1.713 -0.677
142 HB2 ARG 23 1HB ARG 23 -11.179 0.097 1.521
143 HB3 ARG 23 2HB ARG 23 -12.129 -1.111 0.666
144 HG2 ARG 23 1HG ARG 23 -11.582 -2.179 2.639
145 HG3 ARG 23 2HG ARG 23 -10.358 -2.780 1.518
146 HD2 ARG 23 1HD ARG 23 -8.737 -1.220 2.377
147 HD3 ARG 23 2HD ARG 23 -9.957 -0.454 3.393
148 HE ARG 23 HE ARG 23 -10.013 -2.980 4.277
149 HH11 ARG 23 1HH1 ARG 23 -7.370 -0.799 3.663
150 HH12 ARG 23 2HH1 ARG 23 -6.352 -1.480 4.888
151 HH21 ARG 23 1HH2 ARG 23 -8.682 -3.886 5.893
152 HH22 ARG 23 2HH2 ARG 23 -7.099 -3.236 6.156
153 H GLN 24 H GLN 24 -9.950 1.759 -0.025
154 HA GLN 24 HA GLN 24 -11.647 2.281 -2.361
155 HB2 GLN 24 1HB GLN 24 -10.671 4.347 -0.401
156 HB3 GLN 24 2HB GLN 24 -12.049 4.440 -1.489
157 HG2 GLN 24 1HG GLN 24 -12.057 2.315 0.578
158 HG3 GLN 24 2HG GLN 24 -12.324 3.979 1.095
159 HE21 GLN 24 1HE2 GLN 24 -13.989 1.391 0.653
160 HE22 GLN 24 2HE2 GLN 24 -15.418 1.988 -0.112
161 H ARG 25 H ARG 25 -10.835 3.085 -4.194
162 HA ARG 25 HA ARG 25 -8.143 3.089 -4.793
163 HB2 ARG 25 1HB ARG 25 -10.106 3.158 -6.402
164 HB3 ARG 25 2HB ARG 25 -10.150 4.896 -6.137
165 HG2 ARG 25 1HG ARG 25 -7.758 4.969 -6.898
166 HG3 ARG 25 2HG ARG 25 -7.940 3.279 -7.374
167 HD2 ARG 25 1HD ARG 25 -9.960 4.056 -8.724
168 HD3 ARG 25 2HD ARG 25 -9.361 5.693 -8.459
169 HE ARG 25 HE ARG 25 -7.424 3.854 -9.557
170 HH11 ARG 25 1HH1 ARG 25 -9.905 6.202 -10.232
171 HH12 ARG 25 2HH1 ARG 25 -9.316 6.559 -11.822
172 HH21 ARG 25 1HH2 ARG 25 -6.640 4.316 -11.649
173 HH22 ARG 25 2HH2 ARG 25 -7.460 5.485 -12.627
174 H SER 26 H SER 26 -10.126 5.687 -3.510
175 HA SER 26 HA SER 26 -8.238 7.770 -3.872
176 HB2 SER 26 1HB SER 26 -10.540 8.354 -3.514
177 HB3 SER 26 2HB SER 26 -10.582 7.480 -1.982
178 HG SER 26 HG SER 26 -9.300 9.023 -1.067
179 H ALA 27 H ALA 27 -8.518 5.217 -1.586
180 HA ALA 27 HA ALA 27 -6.916 6.476 0.455
181 HB1 ALA 27 3HB ALA 27 -8.642 4.280 0.353
182 HB2 ALA 27 1HB ALA 27 -7.047 3.612 0.699
183 HB3 ALA 27 2HB ALA 27 -7.727 4.860 1.744
184 H LEU 28 H LEU 28 -6.423 4.196 -2.178
185 HA LEU 28 HA LEU 28 -3.671 3.697 -1.431
186 HB2 LEU 28 1HB LEU 28 -4.558 1.814 -2.388
187 HB3 LEU 28 2HB LEU 28 -5.529 2.728 -3.541
188 HG LEU 28 HG LEU 28 -3.112 3.287 -4.519
189 HD11 LEU 28 1HD1 LEU 28 -2.452 1.480 -2.541
190 HD12 LEU 28 2HD1 LEU 28 -1.449 1.936 -3.918
191 HD13 LEU 28 3HD1 LEU 28 -2.472 0.503 -4.010
192 HD21 LEU 28 3HD2 LEU 28 -5.260 1.832 -5.314
193 HD22 LEU 28 1HD2 LEU 28 -3.999 0.599 -5.298
194 HD23 LEU 28 2HD2 LEU 28 -3.794 2.057 -6.270
195 H ASN 29 H ASN 29 -5.391 5.317 -4.087
196 HA ASN 29 HA ASN 29 -3.224 6.152 -5.586
197 HB2 ASN 29 1HB ASN 29 -5.989 7.187 -5.168
198 HB3 ASN 29 2HB ASN 29 -4.841 8.225 -6.007
199 HD21 ASN 29 1HD2 ASN 29 -6.974 7.485 -7.385
200 HD22 ASN 29 2HD2 ASN 29 -6.583 6.285 -8.565
201 H SER 30 H SER 30 -4.368 7.327 -2.531
202 HA SER 30 HA SER 30 -2.736 9.732 -2.659
203 HB2 SER 30 1HB SER 30 -4.821 8.669 -0.816
204 HB3 SER 30 2HB SER 30 -3.626 9.776 -0.140
205 HG SER 30 HG SER 30 -5.564 10.774 -1.033
206 H HIS 31 H HIS 31 -2.780 6.602 -1.055
207 HA HIS 31 HA HIS 31 -0.688 7.060 0.768
208 HB2 HIS 31 1HB HIS 31 -2.000 5.145 1.163
209 HB3 HIS 31 2HB HIS 31 -1.817 4.570 -0.491
210 HD1 HIS 31 HD1 HIS 31 0.071 4.819 2.758
211 HD2 HIS 31 HD2 HIS 31 0.380 2.963 -0.946
212 HE1 HIS 31 HE1 HIS 31 1.963 3.178 2.984
213 H ARG 32 H ARG 32 -0.693 5.910 -2.573
214 HA ARG 32 HA ARG 32 2.012 5.203 -2.753
215 HB2 ARG 32 1HB ARG 32 0.192 6.276 -4.916
216 HB3 ARG 32 2HB ARG 32 1.724 5.457 -5.188
217 HG2 ARG 32 1HG ARG 32 0.812 3.432 -4.142
218 HG3 ARG 32 2HG ARG 32 -0.733 4.258 -3.927
219 HD2 ARG 32 1HD ARG 32 0.634 3.623 -6.538
220 HD3 ARG 32 2HD ARG 32 -0.824 2.867 -5.898
221 HE ARG 32 HE ARG 32 -2.045 4.742 -6.504
222 HH11 ARG 32 1HH1 ARG 32 1.358 5.262 -7.025
223 HH12 ARG 32 2HH1 ARG 32 1.127 6.692 -7.974
224 HH21 ARG 32 1HH2 ARG 32 -2.362 6.624 -7.753
225 HH22 ARG 32 2HH2 ARG 32 -0.989 7.467 -8.387
226 H MET 33 H MET 33 0.486 8.280 -2.611
227 HA MET 33 HA MET 33 2.453 9.828 -3.930
228 HB2 MET 33 1HB MET 33 0.521 10.626 -1.746
229 HB3 MET 33 2HB MET 33 1.438 11.742 -2.749
230 HG2 MET 33 1HG MET 33 0.274 10.524 -4.719
231 HG3 MET 33 2HG MET 33 -0.865 9.995 -3.483
232 HE1 MET 33 3HE MET 33 -2.770 12.846 -5.392
233 HE2 MET 33 1HE MET 33 -1.873 11.410 -5.887
234 HE3 MET 33 2HE MET 33 -3.040 11.309 -4.569
235 H ILE 34 H ILE 34 2.026 8.834 -0.566
236 HA ILE 34 HA ILE 34 3.991 10.374 0.640
237 HB ILE 34 HB ILE 34 3.881 8.956 2.468
238 HG12 ILE 34 1HG1 ILE 34 3.528 6.768 0.442
239 HG13 ILE 34 2HG1 ILE 34 4.744 6.920 1.705
240 HG21 ILE 34 1HG2 ILE 34 1.336 8.138 1.101
241 HG22 ILE 34 2HG2 ILE 34 1.607 8.491 2.807
242 HG23 ILE 34 3HG2 ILE 34 1.626 9.798 1.622
243 HD11 ILE 34 3HD1 ILE 34 3.126 6.385 3.394
244 HD12 ILE 34 1HD1 ILE 34 1.826 6.386 2.202
245 HD13 ILE 34 2HD1 ILE 34 3.084 5.150 2.136
246 H HIS 35 H HIS 35 4.291 7.485 -1.309
247 HA HIS 35 HA HIS 35 7.055 7.040 -0.659
248 HB2 HIS 35 1HB HIS 35 5.360 5.923 -2.903
249 HB3 HIS 35 2HB HIS 35 6.970 5.357 -2.466
250 HD1 HIS 35 HD1 HIS 35 6.775 5.052 0.521
251 HD2 HIS 35 HD2 HIS 35 3.705 3.960 -2.057
252 HE1 HIS 35 HE1 HIS 35 5.407 3.362 1.783
253 H THR 36 H THR 36 5.387 8.032 -3.654
254 HA THR 36 HA THR 36 7.374 8.573 -5.350
255 HB THR 36 HB THR 36 6.100 10.319 -6.354
256 HG1 THR 36 HG1 THR 36 4.564 10.543 -3.970
257 HG21 THR 36 3HG2 THR 36 4.352 9.017 -6.876
258 HG22 THR 36 1HG2 THR 36 3.744 9.028 -5.222
259 HG23 THR 36 2HG2 THR 36 4.996 7.879 -5.693
260 H GLY 37 H GLY 37 9.228 9.662 -5.346
261 HA2 GLY 37 1HA GLY 37 10.171 11.121 -3.160
262 HA3 GLY 37 2HA GLY 37 10.871 11.157 -4.772
263 H GLU 38 H GLU 38 11.008 13.412 -3.310
264 HA GLU 38 HA GLU 38 8.763 15.137 -3.895
265 HB2 GLU 38 1HB GLU 38 10.062 16.876 -2.784
266 HB3 GLU 38 2HB GLU 38 10.032 15.413 -1.810
267 HG2 GLU 38 1HG GLU 38 12.277 14.842 -2.723
268 HG3 GLU 38 2HG GLU 38 12.300 16.420 -3.507
269 H LYS 39 H LYS 39 9.674 17.479 -4.680
270 HA LYS 39 HA LYS 39 10.329 18.720 -6.470
271 HB2 LYS 39 1HB LYS 39 12.396 16.582 -6.355
272 HB3 LYS 39 2HB LYS 39 12.316 17.552 -7.820
273 HG2 LYS 39 1HG LYS 39 12.497 18.776 -5.084
274 HG3 LYS 39 2HG LYS 39 13.920 18.326 -6.026
275 HD2 LYS 39 1HD LYS 39 11.786 20.065 -7.211
276 HD3 LYS 39 2HD LYS 39 13.037 20.754 -6.172
277 HE2 LYS 39 1HE LYS 39 13.574 19.100 -8.636
278 HE3 LYS 39 2HE LYS 39 13.567 20.862 -8.600
279 HZ1 LYS 39 3HZ LYS 39 15.496 18.990 -7.413
280 HZ2 LYS 39 1HZ LYS 39 15.277 20.508 -6.698
281 HZ3 LYS 39 2HZ LYS 39 15.778 20.396 -8.310
282 HA PRO 40 HA PRO 40 7.951 15.664 -9.176
283 HB2 PRO 40 1HB PRO 40 5.552 16.931 -9.053
284 HB3 PRO 40 2HB PRO 40 6.040 15.683 -7.900
285 HG2 PRO 40 1HG PRO 40 6.107 18.661 -7.607
286 HG3 PRO 40 2HG PRO 40 5.591 17.433 -6.436
287 HD2 PRO 40 1HD PRO 40 8.025 18.615 -6.332
288 HD3 PRO 40 2HD PRO 40 7.755 16.939 -5.813
289 H SER 41 H SER 41 6.412 16.450 -11.064
290 HA SER 41 HA SER 41 7.869 17.870 -12.881
291 HB2 SER 41 1HB SER 41 5.645 16.546 -13.164
292 HB3 SER 41 2HB SER 41 4.873 18.110 -12.901
293 HG SER 41 HG SER 41 5.847 18.895 -14.717
294 H GLY 42 H GLY 42 7.462 20.007 -13.872
295 HA2 GLY 42 1HA GLY 42 8.005 22.133 -12.321
296 HA3 GLY 42 2HA GLY 42 7.036 22.286 -13.779
297 HA PRO 43 HA PRO 43 3.483 23.454 -11.499
298 HB2 PRO 43 1HB PRO 43 1.474 21.957 -12.543
299 HB3 PRO 43 2HB PRO 43 2.242 23.283 -13.424
300 HG2 PRO 43 1HG PRO 43 2.730 20.337 -13.633
301 HG3 PRO 43 2HG PRO 43 2.591 21.543 -14.926
302 HD2 PRO 43 1HD PRO 43 4.979 20.615 -14.049
303 HD3 PRO 43 2HD PRO 43 4.761 22.271 -14.651
304 H SER 44 H SER 44 3.567 22.919 -9.380
305 HA SER 44 HA SER 44 3.755 20.425 -8.235
306 HB2 SER 44 1HB SER 44 2.577 23.008 -7.244
307 HB3 SER 44 2HB SER 44 2.546 21.560 -6.237
308 HG SER 44 HG SER 44 4.808 21.478 -6.389
309 H SER 45 H SER 45 2.136 19.209 -6.980
310 HA SER 45 HA SER 45 -0.454 19.156 -8.385
311 HB2 SER 45 1HB SER 45 0.934 16.843 -7.012
312 HB3 SER 45 2HB SER 45 -0.541 16.767 -7.975
313 HG SER 45 HG SER 45 0.722 17.456 -9.776
314 H GLY 46 H GLY 46 -2.128 17.875 -6.943
315 HA2 GLY 46 1HA GLY 46 -1.948 18.934 -4.192
316 HA3 GLY 46 2HA GLY 46 -3.409 19.116 -5.151
Start of MODEL 5
1 H1 GLY 1 H GLY 1 14.533 -19.799 -10.877
2 HA2 GLY 1 1HA GLY 1 15.995 -17.720 -10.610
3 HA3 GLY 1 2HA GLY 1 16.270 -17.915 -12.335
4 H SER 2 H SER 2 13.609 -17.619 -9.990
5 HA SER 2 HA SER 2 12.274 -15.808 -11.880
6 HB2 SER 2 1HB SER 2 11.070 -17.840 -12.175
7 HB3 SER 2 2HB SER 2 11.050 -18.165 -10.442
8 HG SER 2 HG SER 2 9.540 -16.613 -10.156
9 H SER 3 H SER 3 11.210 -14.090 -10.977
10 HA SER 3 HA SER 3 12.020 -13.235 -8.418
11 HB2 SER 3 1HB SER 3 10.613 -11.310 -8.787
12 HB3 SER 3 2HB SER 3 11.378 -11.730 -10.320
13 HG SER 3 HG SER 3 9.466 -12.644 -11.004
14 H GLY 4 H GLY 4 8.959 -14.569 -9.609
15 HA2 GLY 4 1HA GLY 4 7.981 -16.141 -7.850
16 HA3 GLY 4 2HA GLY 4 8.015 -14.718 -6.818
17 H SER 5 H SER 5 5.702 -16.248 -7.492
18 HA SER 5 HA SER 5 4.084 -15.480 -9.506
19 HB2 SER 5 1HB SER 5 3.557 -16.083 -6.636
20 HB3 SER 5 2HB SER 5 2.234 -15.407 -7.585
21 HG SER 5 HG SER 5 3.088 -17.205 -9.138
22 H SER 6 H SER 6 2.687 -13.790 -9.996
23 HA SER 6 HA SER 6 3.561 -11.212 -9.630
24 HB2 SER 6 1HB SER 6 1.221 -10.521 -10.284
25 HB3 SER 6 2HB SER 6 1.979 -11.687 -11.368
26 HG SER 6 HG SER 6 0.814 -13.329 -10.203
27 H GLY 7 H GLY 7 0.999 -12.880 -7.806
28 HA2 GLY 7 1HA GLY 7 1.082 -12.491 -5.348
29 HA3 GLY 7 2HA GLY 7 1.271 -10.787 -5.735
30 H THR 8 H THR 8 -0.734 -11.725 -4.046
31 HA THR 8 HA THR 8 -3.084 -10.844 -5.530
32 HB THR 8 HB THR 8 -3.116 -13.334 -5.630
33 HG1 THR 8 HG1 THR 8 -5.289 -13.467 -4.899
34 HG21 THR 8 3HG2 THR 8 -3.886 -13.578 -2.802
35 HG22 THR 8 1HG2 THR 8 -2.175 -13.259 -3.080
36 HG23 THR 8 2HG2 THR 8 -2.940 -14.666 -3.818
37 H ALA 9 H ALA 9 -4.661 -9.867 -4.258
38 HA ALA 9 HA ALA 9 -4.200 -9.728 -1.371
39 HB1 ALA 9 3HB ALA 9 -4.863 -7.111 -2.077
40 HB2 ALA 9 1HB ALA 9 -3.307 -7.699 -1.490
41 HB3 ALA 9 2HB ALA 9 -3.617 -7.602 -3.224
42 H GLU 10 H GLU 10 -6.035 -9.582 -0.183
43 HA GLU 10 HA GLU 10 -8.470 -10.358 -1.132
44 HB2 GLU 10 1HB GLU 10 -9.316 -9.921 0.960
45 HB3 GLU 10 2HB GLU 10 -7.593 -9.910 1.311
46 HG2 GLU 10 1HG GLU 10 -7.654 -7.418 1.020
47 HG3 GLU 10 2HG GLU 10 -9.411 -7.546 0.956
48 H LYS 11 H LYS 11 -7.018 -7.260 -1.442
49 HA LYS 11 HA LYS 11 -9.536 -6.176 -2.526
50 HB2 LYS 11 1HB LYS 11 -7.222 -4.634 -1.337
51 HB3 LYS 11 2HB LYS 11 -8.712 -3.942 -1.963
52 HG2 LYS 11 1HG LYS 11 -8.338 -5.623 0.496
53 HG3 LYS 11 2HG LYS 11 -8.924 -3.962 0.381
54 HD2 LYS 11 1HD LYS 11 -10.332 -6.460 -0.554
55 HD3 LYS 11 2HD LYS 11 -10.795 -5.415 0.792
56 HE2 LYS 11 1HE LYS 11 -10.853 -3.569 -1.067
57 HE3 LYS 11 2HE LYS 11 -11.027 -4.950 -2.148
58 HZ1 LYS 11 3HZ LYS 11 -13.126 -3.839 -1.208
59 HZ2 LYS 11 1HZ LYS 11 -12.767 -4.679 0.216
60 HZ3 LYS 11 2HZ LYS 11 -13.047 -5.528 -1.220
61 HA PRO 12 HA PRO 12 -7.623 -5.762 -6.457
62 HB2 PRO 12 1HB PRO 12 -8.856 -3.535 -7.402
63 HB3 PRO 12 2HB PRO 12 -9.674 -5.095 -7.249
64 HG2 PRO 12 1HG PRO 12 -9.755 -2.725 -5.421
65 HG3 PRO 12 2HG PRO 12 -11.084 -3.768 -5.960
66 HD2 PRO 12 1HD PRO 12 -9.916 -4.034 -3.532
67 HD3 PRO 12 2HD PRO 12 -10.579 -5.415 -4.428
68 H PHE 13 H PHE 13 -7.645 -2.943 -4.344
69 HA PHE 13 HA PHE 13 -5.575 -1.591 -5.834
70 HB2 PHE 13 1HB PHE 13 -6.501 -0.886 -3.054
71 HB3 PHE 13 2HB PHE 13 -5.801 0.175 -4.272
72 HD1 PHE 13 HD2 PHE 13 -8.823 -1.642 -3.249
73 HD2 PHE 13 HD1 PHE 13 -7.141 1.144 -5.991
74 HE1 PHE 13 HE2 PHE 13 -11.083 -1.021 -3.999
75 HE2 PHE 13 HE1 PHE 13 -9.398 1.771 -6.745
76 HZ PHE 13 HZ PHE 13 -11.373 0.686 -5.749
77 H ARG 14 H ARG 14 -3.442 -1.707 -5.509
78 HA ARG 14 HA ARG 14 -2.391 -2.692 -2.978
79 HB2 ARG 14 1HB ARG 14 -2.751 -4.675 -4.495
80 HB3 ARG 14 2HB ARG 14 -1.566 -3.969 -5.586
81 HG2 ARG 14 1HG ARG 14 0.105 -4.059 -3.769
82 HG3 ARG 14 2HG ARG 14 -1.090 -4.868 -2.753
83 HD2 ARG 14 1HD ARG 14 -1.171 -6.748 -4.217
84 HD3 ARG 14 2HD ARG 14 -0.211 -5.912 -5.436
85 HE ARG 14 HE ARG 14 1.663 -6.591 -4.335
86 HH11 ARG 14 1HH1 ARG 14 -1.020 -6.697 -2.120
87 HH12 ARG 14 2HH1 ARG 14 -0.100 -7.405 -0.834
88 HH21 ARG 14 1HH2 ARG 14 2.886 -7.524 -2.651
89 HH22 ARG 14 2HH2 ARG 14 2.122 -7.875 -1.137
90 H CYS 15 H CYS 15 -0.452 -1.819 -2.452
91 HA CYS 15 HA CYS 15 0.577 0.247 -4.218
92 HB2 CYS 15 1HB CYS 15 0.230 0.762 -1.841
93 HB3 CYS 15 2HB CYS 15 1.370 -0.503 -1.396
94 H ASP 16 H ASP 16 2.135 -0.171 -5.623
95 HA ASP 16 HA ASP 16 3.750 -2.556 -5.389
96 HB2 ASP 16 1HB ASP 16 4.521 -2.068 -7.593
97 HB3 ASP 16 2HB ASP 16 2.801 -1.690 -7.566
98 H THR 17 H THR 17 4.211 -0.786 -3.280
99 HA THR 17 HA THR 17 7.016 -0.071 -3.791
100 HB THR 17 HB THR 17 5.192 1.609 -2.069
101 HG1 THR 17 HG1 THR 17 4.769 1.589 -4.458
102 HG21 THR 17 3HG2 THR 17 7.462 1.872 -1.419
103 HG22 THR 17 1HG2 THR 17 7.067 3.269 -2.418
104 HG23 THR 17 2HG2 THR 17 8.006 1.939 -3.095
105 H CYS 18 H CYS 18 4.607 -0.364 -1.174
106 HA CYS 18 HA CYS 18 6.681 -1.672 0.459
107 HB2 CYS 18 1HB CYS 18 5.360 -0.951 2.426
108 HB3 CYS 18 2HB CYS 18 5.923 0.408 1.459
109 H ASP 19 H ASP 19 4.498 -2.642 -1.538
110 HA ASP 19 HA ASP 19 3.152 -4.460 -1.782
111 HB2 ASP 19 1HB ASP 19 4.963 -5.272 0.462
112 HB3 ASP 19 2HB ASP 19 3.625 -6.323 0.004
113 H LYS 20 H LYS 20 1.789 -2.444 -0.725
114 HA LYS 20 HA LYS 20 0.273 -3.587 1.526
115 HB2 LYS 20 1HB LYS 20 0.970 -0.804 0.749
116 HB3 LYS 20 2HB LYS 20 -0.608 -1.060 1.482
117 HG2 LYS 20 1HG LYS 20 0.653 -2.294 3.331
118 HG3 LYS 20 2HG LYS 20 2.105 -1.550 2.657
119 HD2 LYS 20 1HD LYS 20 1.361 0.616 3.151
120 HD3 LYS 20 2HD LYS 20 -0.309 0.088 3.369
121 HE2 LYS 20 1HE LYS 20 1.982 -0.700 5.164
122 HE3 LYS 20 2HE LYS 20 0.869 0.626 5.494
123 HZ1 LYS 20 3HZ LYS 20 -0.796 -1.442 5.011
124 HZ2 LYS 20 1HZ LYS 20 -0.320 -0.920 6.548
125 HZ3 LYS 20 2HZ LYS 20 0.486 -2.208 5.805
126 H SER 21 H SER 21 -2.095 -2.636 1.484
127 HA SER 21 HA SER 21 -3.216 -2.494 -1.188
128 HB2 SER 21 1HB SER 21 -4.884 -4.367 -0.498
129 HB3 SER 21 2HB SER 21 -3.289 -4.830 -1.090
130 HG SER 21 HG SER 21 -4.396 -5.112 1.417
131 H PHE 22 H PHE 22 -5.283 -1.612 -1.248
132 HA PHE 22 HA PHE 22 -6.440 -0.805 1.331
133 HB2 PHE 22 1HB PHE 22 -6.111 0.986 -1.086
134 HB3 PHE 22 2HB PHE 22 -6.931 1.422 0.409
135 HD1 PHE 22 HD2 PHE 22 -3.629 0.170 -0.784
136 HD2 PHE 22 HD1 PHE 22 -5.756 2.571 2.014
137 HE1 PHE 22 HE2 PHE 22 -1.496 0.968 0.148
138 HE2 PHE 22 HE1 PHE 22 -3.626 3.373 2.950
139 HZ PHE 22 HZ PHE 22 -1.493 2.571 2.017
140 H ARG 23 H ARG 23 -8.719 0.045 1.040
141 HA ARG 23 HA ARG 23 -10.124 -1.734 -0.822
142 HB2 ARG 23 1HB ARG 23 -10.506 -1.519 1.807
143 HB3 ARG 23 2HB ARG 23 -11.576 -0.222 1.292
144 HG2 ARG 23 1HG ARG 23 -12.606 -1.946 -0.290
145 HG3 ARG 23 2HG ARG 23 -11.750 -3.149 0.678
146 HD2 ARG 23 1HD ARG 23 -14.042 -2.858 1.461
147 HD3 ARG 23 2HD ARG 23 -12.881 -2.347 2.686
148 HE ARG 23 HE ARG 23 -13.619 -0.174 2.453
149 HH11 ARG 23 1HH1 ARG 23 -14.983 -2.178 -0.046
150 HH12 ARG 23 2HH1 ARG 23 -16.123 -0.982 -0.564
151 HH21 ARG 23 1HH2 ARG 23 -15.117 1.410 1.779
152 HH22 ARG 23 2HH2 ARG 23 -16.198 1.059 0.474
153 H GLN 24 H GLN 24 -9.772 1.628 0.107
154 HA GLN 24 HA GLN 24 -11.740 2.436 -1.905
155 HB2 GLN 24 1HB GLN 24 -10.264 4.272 -0.031
156 HB3 GLN 24 2HB GLN 24 -11.780 4.565 -0.872
157 HG2 GLN 24 1HG GLN 24 -12.611 2.532 0.545
158 HG3 GLN 24 2HG GLN 24 -11.249 2.963 1.578
159 HE21 GLN 24 1HE2 GLN 24 -13.816 4.660 -0.198
160 HE22 GLN 24 2HE2 GLN 24 -14.271 5.693 1.110
161 H ARG 25 H ARG 25 -11.162 3.228 -3.823
162 HA ARG 25 HA ARG 25 -8.570 3.107 -4.806
163 HB2 ARG 25 1HB ARG 25 -10.671 3.196 -6.168
164 HB3 ARG 25 2HB ARG 25 -10.759 4.920 -5.832
165 HG2 ARG 25 1HG ARG 25 -8.563 5.207 -6.927
166 HG3 ARG 25 2HG ARG 25 -8.580 3.491 -7.338
167 HD2 ARG 25 1HD ARG 25 -9.401 4.464 -9.267
168 HD3 ARG 25 2HD ARG 25 -10.879 4.032 -8.409
169 HE ARG 25 HE ARG 25 -9.957 6.704 -7.874
170 HH11 ARG 25 1HH1 ARG 25 -11.861 4.691 -9.982
171 HH12 ARG 25 2HH1 ARG 25 -12.863 5.992 -10.534
172 HH21 ARG 25 1HH2 ARG 25 -11.269 8.425 -8.594
173 HH22 ARG 25 2HH2 ARG 25 -12.524 8.116 -9.745
174 H SER 26 H SER 26 -10.256 5.736 -3.218
175 HA SER 26 HA SER 26 -8.253 7.703 -3.830
176 HB2 SER 26 1HB SER 26 -10.540 8.430 -3.470
177 HB3 SER 26 2HB SER 26 -10.546 7.726 -1.854
178 HG SER 26 HG SER 26 -10.126 10.071 -2.042
179 H ALA 27 H ALA 27 -8.492 5.172 -1.615
180 HA ALA 27 HA ALA 27 -6.906 6.414 0.466
181 HB1 ALA 27 3HB ALA 27 -8.503 4.875 1.262
182 HB2 ALA 27 1HB ALA 27 -8.018 3.646 0.093
183 HB3 ALA 27 2HB ALA 27 -6.944 4.068 1.428
184 H LEU 28 H LEU 28 -6.448 4.202 -2.220
185 HA LEU 28 HA LEU 28 -3.695 3.659 -1.482
186 HB2 LEU 28 1HB LEU 28 -4.647 1.784 -2.419
187 HB3 LEU 28 2HB LEU 28 -5.561 2.713 -3.605
188 HG LEU 28 HG LEU 28 -3.104 3.193 -4.524
189 HD11 LEU 28 1HD1 LEU 28 -1.833 1.996 -2.946
190 HD12 LEU 28 2HD1 LEU 28 -1.868 0.986 -4.391
191 HD13 LEU 28 3HD1 LEU 28 -2.907 0.599 -3.020
192 HD21 LEU 28 3HD2 LEU 28 -5.274 1.785 -5.357
193 HD22 LEU 28 1HD2 LEU 28 -4.039 0.527 -5.310
194 HD23 LEU 28 2HD2 LEU 28 -3.784 1.976 -6.283
195 H ASN 29 H ASN 29 -5.434 5.275 -4.129
196 HA ASN 29 HA ASN 29 -3.284 6.095 -5.656
197 HB2 ASN 29 1HB ASN 29 -5.968 7.362 -5.139
198 HB3 ASN 29 2HB ASN 29 -4.805 8.087 -6.245
199 HD21 ASN 29 1HD2 ASN 29 -7.066 7.500 -7.372
200 HD22 ASN 29 2HD2 ASN 29 -6.986 6.058 -8.320
201 H SER 30 H SER 30 -4.371 7.280 -2.584
202 HA SER 30 HA SER 30 -2.719 9.671 -2.741
203 HB2 SER 30 1HB SER 30 -4.792 8.636 -0.868
204 HB3 SER 30 2HB SER 30 -3.580 9.737 -0.214
205 HG SER 30 HG SER 30 -5.695 10.256 -1.843
206 H HIS 31 H HIS 31 -2.795 6.560 -1.093
207 HA HIS 31 HA HIS 31 -0.672 6.999 0.693
208 HB2 HIS 31 1HB HIS 31 -2.039 5.105 1.087
209 HB3 HIS 31 2HB HIS 31 -1.806 4.498 -0.550
210 HD1 HIS 31 HD1 HIS 31 -0.093 4.727 2.780
211 HD2 HIS 31 HD2 HIS 31 0.481 2.967 -0.940
212 HE1 HIS 31 HE1 HIS 31 1.812 3.114 3.086
213 H ARG 32 H ARG 32 -0.727 5.818 -2.638
214 HA ARG 32 HA ARG 32 1.951 5.058 -2.857
215 HB2 ARG 32 1HB ARG 32 0.141 6.216 -4.986
216 HB3 ARG 32 2HB ARG 32 1.651 5.366 -5.287
217 HG2 ARG 32 1HG ARG 32 0.717 3.336 -4.319
218 HG3 ARG 32 2HG ARG 32 -0.791 4.186 -3.979
219 HD2 ARG 32 1HD ARG 32 0.388 3.442 -6.638
220 HD3 ARG 32 2HD ARG 32 -1.187 3.011 -5.974
221 HE ARG 32 HE ARG 32 -2.006 5.077 -6.618
222 HH11 ARG 32 1HH1 ARG 32 1.436 4.919 -7.112
223 HH12 ARG 32 2HH1 ARG 32 1.497 6.362 -8.068
224 HH21 ARG 32 1HH2 ARG 32 -1.940 6.979 -7.876
225 HH22 ARG 32 2HH2 ARG 32 -0.424 7.534 -8.502
226 H MET 33 H MET 33 0.509 8.184 -2.696
227 HA MET 33 HA MET 33 2.528 9.681 -3.992
228 HB2 MET 33 1HB MET 33 0.659 10.556 -1.782
229 HB3 MET 33 2HB MET 33 1.556 11.618 -2.860
230 HG2 MET 33 1HG MET 33 0.304 10.713 -4.766
231 HG3 MET 33 2HG MET 33 -0.616 9.696 -3.660
232 HE1 MET 33 3HE MET 33 -3.334 11.175 -4.348
233 HE2 MET 33 1HE MET 33 -2.754 12.569 -5.260
234 HE3 MET 33 2HE MET 33 -2.029 10.982 -5.520
235 H ILE 34 H ILE 34 1.990 8.865 -0.576
236 HA ILE 34 HA ILE 34 4.010 10.274 0.624
237 HB ILE 34 HB ILE 34 3.831 8.876 2.449
238 HG12 ILE 34 1HG1 ILE 34 3.529 6.668 0.434
239 HG13 ILE 34 2HG1 ILE 34 4.729 6.842 1.710
240 HG21 ILE 34 1HG2 ILE 34 1.326 8.023 1.034
241 HG22 ILE 34 2HG2 ILE 34 1.555 8.408 2.739
242 HG23 ILE 34 3HG2 ILE 34 1.591 9.694 1.532
243 HD11 ILE 34 3HD1 ILE 34 1.811 6.307 2.195
244 HD12 ILE 34 1HD1 ILE 34 3.058 5.063 2.119
245 HD13 ILE 34 2HD1 ILE 34 3.114 6.292 3.383
246 H HIS 35 H HIS 35 4.278 7.508 -1.456
247 HA HIS 35 HA HIS 35 7.032 6.972 -0.754
248 HB2 HIS 35 1HB HIS 35 5.316 5.873 -2.990
249 HB3 HIS 35 2HB HIS 35 6.921 5.290 -2.561
250 HD1 HIS 35 HD1 HIS 35 6.762 4.955 0.410
251 HD2 HIS 35 HD2 HIS 35 3.619 3.962 -2.119
252 HE1 HIS 35 HE1 HIS 35 5.374 3.289 1.684
253 H THR 36 H THR 36 5.282 8.270 -3.561
254 HA THR 36 HA THR 36 7.320 8.706 -5.324
255 HB THR 36 HB THR 36 6.043 10.473 -6.310
256 HG1 THR 36 HG1 THR 36 5.124 10.802 -3.694
257 HG21 THR 36 3HG2 THR 36 5.081 8.097 -6.222
258 HG22 THR 36 1HG2 THR 36 3.981 9.403 -6.659
259 HG23 THR 36 2HG2 THR 36 3.952 8.735 -5.027
260 H GLY 37 H GLY 37 8.537 10.654 -5.878
261 HA2 GLY 37 1HA GLY 37 10.148 11.565 -3.796
262 HA3 GLY 37 2HA GLY 37 10.024 12.328 -5.375
263 H GLU 38 H GLU 38 9.343 12.601 -2.065
264 HA GLU 38 HA GLU 38 7.169 14.412 -2.151
265 HB2 GLU 38 1HB GLU 38 8.265 13.062 -0.159
266 HB3 GLU 38 2HB GLU 38 9.191 14.543 0.042
267 HG2 GLU 38 1HG GLU 38 6.779 15.626 -0.097
268 HG3 GLU 38 2HG GLU 38 6.308 14.029 0.481
269 H LYS 39 H LYS 39 7.182 16.687 -1.745
270 HA LYS 39 HA LYS 39 8.589 18.264 -3.408
271 HB2 LYS 39 1HB LYS 39 7.774 19.033 -0.599
272 HB3 LYS 39 2HB LYS 39 8.146 20.160 -1.897
273 HG2 LYS 39 1HG LYS 39 5.953 18.122 -2.116
274 HG3 LYS 39 2HG LYS 39 5.699 19.727 -1.426
275 HD2 LYS 39 1HD LYS 39 6.929 19.356 -4.141
276 HD3 LYS 39 2HD LYS 39 5.179 19.394 -3.916
277 HE2 LYS 39 1HE LYS 39 5.225 21.607 -3.119
278 HE3 LYS 39 2HE LYS 39 6.967 21.561 -2.853
279 HZ1 LYS 39 3HZ LYS 39 5.603 22.433 -5.121
280 HZ2 LYS 39 1HZ LYS 39 6.444 21.032 -5.560
281 HZ3 LYS 39 2HZ LYS 39 7.276 22.341 -4.886
282 HA PRO 40 HA PRO 40 12.810 18.326 -2.160
283 HB2 PRO 40 1HB PRO 40 13.559 20.685 -3.274
284 HB3 PRO 40 2HB PRO 40 13.253 19.228 -4.226
285 HG2 PRO 40 1HG PRO 40 11.465 21.577 -3.729
286 HG3 PRO 40 2HG PRO 40 11.760 20.696 -5.239
287 HD2 PRO 40 1HD PRO 40 9.560 20.279 -3.717
288 HD3 PRO 40 2HD PRO 40 10.317 18.990 -4.674
289 H SER 41 H SER 41 14.172 19.230 -0.630
290 HA SER 41 HA SER 41 12.886 20.912 1.337
291 HB2 SER 41 1HB SER 41 14.809 20.445 2.731
292 HB3 SER 41 2HB SER 41 14.292 18.943 1.966
293 HG SER 41 HG SER 41 16.680 19.902 1.929
294 H GLY 42 H GLY 42 13.207 23.030 1.660
295 HA2 GLY 42 1HA GLY 42 14.347 24.682 -0.255
296 HA3 GLY 42 2HA GLY 42 14.021 25.161 1.404
297 HA PRO 43 HA PRO 43 18.281 25.280 2.429
298 HB2 PRO 43 1HB PRO 43 18.542 23.787 4.681
299 HB3 PRO 43 2HB PRO 43 17.733 25.358 4.659
300 HG2 PRO 43 1HG PRO 43 16.541 22.612 4.596
301 HG3 PRO 43 2HG PRO 43 16.026 24.035 5.521
302 HD2 PRO 43 1HD PRO 43 14.803 23.265 3.231
303 HD3 PRO 43 2HD PRO 43 14.933 24.967 3.719
304 H SER 44 H SER 44 20.114 24.354 1.728
305 HA SER 44 HA SER 44 20.039 21.713 0.626
306 HB2 SER 44 1HB SER 44 22.144 23.852 0.821
307 HB3 SER 44 2HB SER 44 22.552 22.237 0.244
308 HG SER 44 HG SER 44 20.320 23.455 -0.883
309 H SER 45 H SER 45 19.649 20.385 2.441
310 HA SER 45 HA SER 45 22.078 19.757 3.942
311 HB2 SER 45 1HB SER 45 20.459 21.294 5.264
312 HB3 SER 45 2HB SER 45 19.448 19.855 5.399
313 HG SER 45 HG SER 45 21.129 18.812 6.455
314 H GLY 46 H GLY 46 22.048 17.616 4.900
315 HA2 GLY 46 1HA GLY 46 20.606 15.560 5.145
316 HA3 GLY 46 2HA GLY 46 20.209 15.814 3.452
Start of MODEL 6
1 H1 GLY 1 H GLY 1 15.065 -12.262 -15.370
2 HA2 GLY 1 1HA GLY 1 13.165 -10.613 -15.444
3 HA3 GLY 1 2HA GLY 1 12.808 -11.305 -17.020
4 H SER 2 H SER 2 10.673 -11.671 -16.067
5 HA SER 2 HA SER 2 10.399 -14.365 -15.188
6 HB2 SER 2 1HB SER 2 10.997 -12.894 -13.081
7 HB3 SER 2 2HB SER 2 9.295 -12.443 -13.176
8 HG SER 2 HG SER 2 8.841 -14.738 -13.165
9 H SER 3 H SER 3 8.500 -15.128 -15.879
10 HA SER 3 HA SER 3 6.610 -13.263 -17.051
11 HB2 SER 3 1HB SER 3 5.491 -15.383 -17.856
12 HB3 SER 3 2HB SER 3 7.150 -15.160 -18.411
13 HG SER 3 HG SER 3 6.192 -16.881 -16.382
14 H GLY 4 H GLY 4 4.208 -13.885 -16.788
15 HA2 GLY 4 1HA GLY 4 2.502 -14.747 -15.315
16 HA3 GLY 4 2HA GLY 4 3.646 -14.615 -13.989
17 H SER 5 H SER 5 4.308 -12.405 -13.366
18 HA SER 5 HA SER 5 3.692 -10.384 -12.507
19 HB2 SER 5 1HB SER 5 4.154 -9.830 -14.923
20 HB3 SER 5 2HB SER 5 2.419 -9.946 -15.216
21 HG SER 5 HG SER 5 3.748 -8.144 -13.472
22 H SER 6 H SER 6 1.935 -12.447 -11.846
23 HA SER 6 HA SER 6 -0.738 -11.265 -12.079
24 HB2 SER 6 1HB SER 6 0.174 -14.002 -11.169
25 HB3 SER 6 2HB SER 6 -1.503 -13.458 -11.117
26 HG SER 6 HG SER 6 0.042 -14.235 -13.265
27 H GLY 7 H GLY 7 -1.144 -9.806 -10.542
28 HA2 GLY 7 1HA GLY 7 0.122 -9.835 -7.981
29 HA3 GLY 7 2HA GLY 7 -1.178 -8.765 -8.487
30 H THR 8 H THR 8 -0.900 -10.010 -5.925
31 HA THR 8 HA THR 8 -3.456 -11.434 -5.863
32 HB THR 8 HB THR 8 -2.598 -13.108 -4.284
33 HG1 THR 8 HG1 THR 8 -0.324 -13.265 -3.993
34 HG21 THR 8 3HG2 THR 8 -2.674 -13.864 -6.521
35 HG22 THR 8 1HG2 THR 8 -1.084 -14.335 -5.922
36 HG23 THR 8 2HG2 THR 8 -1.249 -12.926 -6.969
37 H ALA 9 H ALA 9 -4.741 -10.431 -4.474
38 HA ALA 9 HA ALA 9 -3.921 -9.771 -1.823
39 HB1 ALA 9 3HB ALA 9 -3.146 -7.716 -2.176
40 HB2 ALA 9 1HB ALA 9 -3.680 -7.731 -3.857
41 HB3 ALA 9 2HB ALA 9 -4.797 -7.248 -2.580
42 H GLU 10 H GLU 10 -5.653 -9.464 -0.464
43 HA GLU 10 HA GLU 10 -8.153 -10.429 -1.268
44 HB2 GLU 10 1HB GLU 10 -8.841 -10.111 0.925
45 HB3 GLU 10 2HB GLU 10 -7.096 -10.239 1.099
46 HG2 GLU 10 1HG GLU 10 -6.888 -7.850 1.274
47 HG3 GLU 10 2HG GLU 10 -8.608 -7.642 0.948
48 H LYS 11 H LYS 11 -6.771 -7.368 -1.687
49 HA LYS 11 HA LYS 11 -9.415 -6.214 -2.295
50 HB2 LYS 11 1HB LYS 11 -6.957 -4.678 -1.439
51 HB3 LYS 11 2HB LYS 11 -8.572 -4.030 -1.696
52 HG2 LYS 11 1HG LYS 11 -7.705 -5.921 0.479
53 HG3 LYS 11 2HG LYS 11 -8.168 -4.226 0.657
54 HD2 LYS 11 1HD LYS 11 -9.918 -6.562 -0.082
55 HD3 LYS 11 2HD LYS 11 -10.041 -5.514 1.334
56 HE2 LYS 11 1HE LYS 11 -10.396 -3.618 -0.372
57 HE3 LYS 11 2HE LYS 11 -10.719 -4.911 -1.525
58 HZ1 LYS 11 3HZ LYS 11 -12.536 -3.784 0.155
59 HZ2 LYS 11 1HZ LYS 11 -12.152 -5.237 0.933
60 HZ3 LYS 11 2HZ LYS 11 -12.724 -5.255 -0.659
61 HA PRO 12 HA PRO 12 -8.076 -5.618 -6.434
62 HB2 PRO 12 1HB PRO 12 -9.443 -3.368 -7.096
63 HB3 PRO 12 2HB PRO 12 -10.222 -4.943 -6.900
64 HG2 PRO 12 1HG PRO 12 -10.060 -2.656 -4.974
65 HG3 PRO 12 2HG PRO 12 -11.445 -3.692 -5.368
66 HD2 PRO 12 1HD PRO 12 -9.944 -4.048 -3.142
67 HD3 PRO 12 2HD PRO 12 -10.718 -5.397 -3.998
68 H PHE 13 H PHE 13 -7.509 -3.213 -4.028
69 HA PHE 13 HA PHE 13 -5.655 -1.776 -5.798
70 HB2 PHE 13 1HB PHE 13 -6.579 -0.918 -3.054
71 HB3 PHE 13 2HB PHE 13 -5.765 0.063 -4.267
72 HD1 PHE 13 HD2 PHE 13 -8.933 -1.457 -3.255
73 HD2 PHE 13 HD1 PHE 13 -6.968 0.970 -6.148
74 HE1 PHE 13 HE2 PHE 13 -11.117 -0.728 -4.123
75 HE2 PHE 13 HE1 PHE 13 -9.149 1.704 -7.019
76 HZ PHE 13 HZ PHE 13 -11.227 0.854 -6.007
77 H ARG 14 H ARG 14 -3.504 -1.748 -5.424
78 HA ARG 14 HA ARG 14 -2.430 -2.689 -2.896
79 HB2 ARG 14 1HB ARG 14 -2.803 -4.729 -4.324
80 HB3 ARG 14 2HB ARG 14 -1.643 -4.063 -5.467
81 HG2 ARG 14 1HG ARG 14 0.060 -4.068 -3.667
82 HG3 ARG 14 2HG ARG 14 -1.111 -4.865 -2.615
83 HD2 ARG 14 1HD ARG 14 0.457 -6.450 -3.668
84 HD3 ARG 14 2HD ARG 14 -1.222 -6.759 -4.109
85 HE ARG 14 HE ARG 14 0.907 -5.864 -5.856
86 HH11 ARG 14 1HH1 ARG 14 -2.520 -6.270 -5.395
87 HH12 ARG 14 2HH1 ARG 14 -2.882 -6.245 -7.089
88 HH21 ARG 14 1HH2 ARG 14 0.442 -5.829 -8.088
89 HH22 ARG 14 2HH2 ARG 14 -1.196 -5.995 -8.620
90 H CYS 15 H CYS 15 -0.469 -1.819 -2.429
91 HA CYS 15 HA CYS 15 0.531 0.196 -4.268
92 HB2 CYS 15 1HB CYS 15 0.242 0.794 -1.912
93 HB3 CYS 15 2HB CYS 15 1.354 -0.486 -1.438
94 H ASP 16 H ASP 16 2.066 -0.253 -5.688
95 HA ASP 16 HA ASP 16 3.671 -2.643 -5.437
96 HB2 ASP 16 1HB ASP 16 2.739 -1.926 -7.621
97 HB3 ASP 16 2HB ASP 16 3.750 -0.485 -7.556
98 H THR 17 H THR 17 4.171 -0.827 -3.369
99 HA THR 17 HA THR 17 6.974 -0.141 -3.936
100 HB THR 17 HB THR 17 5.132 1.574 -2.261
101 HG1 THR 17 HG1 THR 17 6.234 2.512 -4.649
102 HG21 THR 17 3HG2 THR 17 7.150 2.165 -1.419
103 HG22 THR 17 1HG2 THR 17 7.242 3.130 -2.892
104 HG23 THR 17 2HG2 THR 17 8.032 1.554 -2.819
105 H CYS 18 H CYS 18 4.606 -0.386 -1.276
106 HA CYS 18 HA CYS 18 6.706 -1.662 0.350
107 HB2 CYS 18 1HB CYS 18 5.365 -0.941 2.318
108 HB3 CYS 18 2HB CYS 18 5.950 0.408 1.348
109 H ASP 19 H ASP 19 4.361 -2.578 -1.581
110 HA ASP 19 HA ASP 19 3.094 -4.454 -1.805
111 HB2 ASP 19 1HB ASP 19 4.963 -5.199 0.398
112 HB3 ASP 19 2HB ASP 19 3.580 -6.247 0.094
113 H LYS 20 H LYS 20 1.854 -2.319 -0.630
114 HA LYS 20 HA LYS 20 0.312 -3.440 1.603
115 HB2 LYS 20 1HB LYS 20 1.002 -0.689 0.728
116 HB3 LYS 20 2HB LYS 20 -0.587 -0.911 1.448
117 HG2 LYS 20 1HG LYS 20 0.641 -2.076 3.362
118 HG3 LYS 20 2HG LYS 20 2.107 -1.367 2.680
119 HD2 LYS 20 1HD LYS 20 1.357 0.824 3.065
120 HD3 LYS 20 2HD LYS 20 -0.312 0.302 3.305
121 HE2 LYS 20 1HE LYS 20 0.451 0.757 5.463
122 HE3 LYS 20 2HE LYS 20 0.592 -0.994 5.325
123 HZ1 LYS 20 3HZ LYS 20 2.951 -0.699 4.799
124 HZ2 LYS 20 1HZ LYS 20 2.566 -0.075 6.323
125 HZ3 LYS 20 2HZ LYS 20 2.796 0.972 5.015
126 H SER 21 H SER 21 -2.063 -2.504 1.555
127 HA SER 21 HA SER 21 -3.229 -2.439 -1.093
128 HB2 SER 21 1HB SER 21 -4.817 -4.350 -0.459
129 HB3 SER 21 2HB SER 21 -3.175 -4.798 -0.919
130 HG SER 21 HG SER 21 -4.139 -5.745 1.089
131 H PHE 22 H PHE 22 -5.321 -1.615 -1.126
132 HA PHE 22 HA PHE 22 -6.460 -0.825 1.466
133 HB2 PHE 22 1HB PHE 22 -6.203 0.967 -0.958
134 HB3 PHE 22 2HB PHE 22 -7.020 1.387 0.544
135 HD1 PHE 22 HD2 PHE 22 -3.698 0.114 -0.587
136 HD2 PHE 22 HD1 PHE 22 -5.858 2.671 2.041
137 HE1 PHE 22 HE2 PHE 22 -1.576 0.966 0.321
138 HE2 PHE 22 HE1 PHE 22 -3.740 3.528 2.953
139 HZ PHE 22 HZ PHE 22 -1.595 2.675 2.094
140 H ARG 23 H ARG 23 -8.740 0.274 0.918
141 HA ARG 23 HA ARG 23 -10.149 -1.681 -0.772
142 HB2 ARG 23 1HB ARG 23 -11.271 -0.027 1.496
143 HB3 ARG 23 2HB ARG 23 -12.104 -1.300 0.614
144 HG2 ARG 23 1HG ARG 23 -10.170 -2.806 1.455
145 HG3 ARG 23 2HG ARG 23 -9.924 -1.522 2.641
146 HD2 ARG 23 1HD ARG 23 -12.659 -2.643 2.207
147 HD3 ARG 23 2HD ARG 23 -11.495 -3.531 3.189
148 HE ARG 23 HE ARG 23 -11.651 -0.824 4.014
149 HH11 ARG 23 1HH1 ARG 23 -13.367 -3.850 4.150
150 HH12 ARG 23 2HH1 ARG 23 -14.171 -3.477 5.639
151 HH21 ARG 23 1HH2 ARG 23 -12.704 -0.321 5.975
152 HH22 ARG 23 2HH2 ARG 23 -13.794 -1.469 6.675
153 H GLN 24 H GLN 24 -9.889 1.738 0.042
154 HA GLN 24 HA GLN 24 -11.730 2.416 -2.132
155 HB2 GLN 24 1HB GLN 24 -10.457 4.341 -0.195
156 HB3 GLN 24 2HB GLN 24 -11.891 4.587 -1.183
157 HG2 GLN 24 1HG GLN 24 -11.837 2.444 0.898
158 HG3 GLN 24 2HG GLN 24 -12.152 4.122 1.341
159 HE21 GLN 24 1HE2 GLN 24 -14.246 3.635 1.999
160 HE22 GLN 24 2HE2 GLN 24 -15.510 3.305 0.868
161 H ARG 25 H ARG 25 -11.052 3.227 -4.016
162 HA ARG 25 HA ARG 25 -8.416 3.119 -4.849
163 HB2 ARG 25 1HB ARG 25 -10.447 3.234 -6.319
164 HB3 ARG 25 2HB ARG 25 -10.525 4.959 -5.985
165 HG2 ARG 25 1HG ARG 25 -8.524 5.384 -7.134
166 HG3 ARG 25 2HG ARG 25 -8.080 3.676 -7.156
167 HD2 ARG 25 1HD ARG 25 -9.836 3.178 -8.710
168 HD3 ARG 25 2HD ARG 25 -10.484 4.812 -8.573
169 HE ARG 25 HE ARG 25 -7.967 5.232 -9.453
170 HH11 ARG 25 1HH1 ARG 25 -10.560 3.183 -10.549
171 HH12 ARG 25 2HH1 ARG 25 -10.082 3.248 -12.213
172 HH21 ARG 25 1HH2 ARG 25 -7.328 5.324 -11.640
173 HH22 ARG 25 2HH2 ARG 25 -8.243 4.465 -12.832
174 H SER 26 H SER 26 -10.183 5.764 -3.370
175 HA SER 26 HA SER 26 -8.184 7.745 -3.865
176 HB2 SER 26 1HB SER 26 -10.428 8.505 -3.510
177 HB3 SER 26 2HB SER 26 -10.539 7.650 -1.972
178 HG SER 26 HG SER 26 -9.824 9.416 -1.109
179 H ALA 27 H ALA 27 -8.470 5.184 -1.656
180 HA ALA 27 HA ALA 27 -6.871 6.388 0.432
181 HB1 ALA 27 3HB ALA 27 -7.461 3.459 0.217
182 HB2 ALA 27 1HB ALA 27 -7.224 4.445 1.660
183 HB3 ALA 27 2HB ALA 27 -8.705 4.604 0.716
184 H LEU 28 H LEU 28 -6.418 4.145 -2.242
185 HA LEU 28 HA LEU 28 -3.660 3.626 -1.510
186 HB2 LEU 28 1HB LEU 28 -4.572 1.735 -2.431
187 HB3 LEU 28 2HB LEU 28 -5.545 2.639 -3.590
188 HG LEU 28 HG LEU 28 -3.155 3.170 -4.613
189 HD11 LEU 28 1HD1 LEU 28 -2.524 0.394 -3.925
190 HD12 LEU 28 2HD1 LEU 28 -2.375 1.534 -2.588
191 HD13 LEU 28 3HD1 LEU 28 -1.468 1.798 -4.076
192 HD21 LEU 28 3HD2 LEU 28 -3.789 1.819 -6.308
193 HD22 LEU 28 1HD2 LEU 28 -5.280 1.713 -5.372
194 HD23 LEU 28 2HD2 LEU 28 -4.069 0.437 -5.248
195 H ASN 29 H ASN 29 -5.409 5.210 -4.169
196 HA ASN 29 HA ASN 29 -3.261 6.023 -5.706
197 HB2 ASN 29 1HB ASN 29 -6.020 7.061 -5.267
198 HB3 ASN 29 2HB ASN 29 -4.882 8.098 -6.122
199 HD21 ASN 29 1HD2 ASN 29 -7.009 7.365 -7.493
200 HD22 ASN 29 2HD2 ASN 29 -6.632 6.153 -8.665
201 H SER 30 H SER 30 -4.351 7.230 -2.645
202 HA SER 30 HA SER 30 -2.693 9.619 -2.830
203 HB2 SER 30 1HB SER 30 -4.762 10.047 -1.766
204 HB3 SER 30 2HB SER 30 -4.645 8.596 -0.772
205 HG SER 30 HG SER 30 -2.904 10.830 -0.581
206 H HIS 31 H HIS 31 -2.834 6.555 -1.093
207 HA HIS 31 HA HIS 31 -0.753 6.997 0.722
208 HB2 HIS 31 1HB HIS 31 -2.065 5.096 1.131
209 HB3 HIS 31 2HB HIS 31 -1.904 4.515 -0.524
210 HD1 HIS 31 HD1 HIS 31 -0.078 4.641 2.748
211 HD2 HIS 31 HD2 HIS 31 0.355 2.970 -1.031
212 HE1 HIS 31 HE1 HIS 31 1.813 2.995 2.953
213 H ARG 32 H ARG 32 -0.713 5.959 -2.638
214 HA ARG 32 HA ARG 32 1.966 5.142 -2.787
215 HB2 ARG 32 1HB ARG 32 0.232 6.367 -4.941
216 HB3 ARG 32 2HB ARG 32 1.742 5.509 -5.216
217 HG2 ARG 32 1HG ARG 32 0.474 3.605 -3.882
218 HG3 ARG 32 2HG ARG 32 -0.937 4.463 -4.505
219 HD2 ARG 32 1HD ARG 32 -0.412 2.792 -6.098
220 HD3 ARG 32 2HD ARG 32 0.130 4.323 -6.784
221 HE ARG 32 HE ARG 32 2.251 3.099 -5.389
222 HH11 ARG 32 1HH1 ARG 32 0.368 2.766 -8.298
223 HH12 ARG 32 2HH1 ARG 32 1.637 1.990 -9.187
224 HH21 ARG 32 1HH2 ARG 32 3.930 2.077 -6.548
225 HH22 ARG 32 2HH2 ARG 32 3.662 1.598 -8.190
226 H MET 33 H MET 33 0.509 8.293 -2.738
227 HA MET 33 HA MET 33 2.580 9.796 -3.891
228 HB2 MET 33 1HB MET 33 0.599 10.581 -1.746
229 HB3 MET 33 2HB MET 33 1.609 11.708 -2.642
230 HG2 MET 33 1HG MET 33 0.466 10.516 -4.708
231 HG3 MET 33 2HG MET 33 -0.786 10.197 -3.511
232 HE1 MET 33 3HE MET 33 -2.829 13.217 -3.543
233 HE2 MET 33 1HE MET 33 -2.697 11.460 -3.622
234 HE3 MET 33 2HE MET 33 -2.136 12.322 -2.189
235 H ILE 34 H ILE 34 1.978 8.870 -0.519
236 HA ILE 34 HA ILE 34 3.971 10.254 0.764
237 HB ILE 34 HB ILE 34 3.762 8.798 2.545
238 HG12 ILE 34 1HG1 ILE 34 3.475 6.662 0.454
239 HG13 ILE 34 2HG1 ILE 34 4.642 6.775 1.767
240 HG21 ILE 34 1HG2 ILE 34 1.479 8.368 2.795
241 HG22 ILE 34 2HG2 ILE 34 1.544 9.669 1.607
242 HG23 ILE 34 3HG2 ILE 34 1.266 8.009 1.082
243 HD11 ILE 34 3HD1 ILE 34 2.965 5.005 2.095
244 HD12 ILE 34 1HD1 ILE 34 2.950 6.215 3.377
245 HD13 ILE 34 2HD1 ILE 34 1.705 6.238 2.127
246 H HIS 35 H HIS 35 4.273 7.523 -1.364
247 HA HIS 35 HA HIS 35 7.031 7.013 -0.634
248 HB2 HIS 35 1HB HIS 35 5.340 5.864 -2.865
249 HB3 HIS 35 2HB HIS 35 6.947 5.304 -2.413
250 HD1 HIS 35 HD1 HIS 35 6.781 4.984 0.548
251 HD2 HIS 35 HD2 HIS 35 3.635 3.974 -1.970
252 HE1 HIS 35 HE1 HIS 35 5.394 3.329 1.837
253 H THR 36 H THR 36 6.758 9.628 -1.394
254 HA THR 36 HA THR 36 8.296 9.670 -3.895
255 HB THR 36 HB THR 36 7.150 11.631 -4.703
256 HG1 THR 36 HG1 THR 36 5.606 12.667 -3.534
257 HG21 THR 36 3HG2 THR 36 5.448 9.284 -3.958
258 HG22 THR 36 1HG2 THR 36 6.052 9.768 -5.542
259 HG23 THR 36 2HG2 THR 36 4.733 10.665 -4.789
260 H GLY 37 H GLY 37 9.541 11.697 -4.176
261 HA2 GLY 37 1HA GLY 37 9.984 13.288 -1.786
262 HA3 GLY 37 2HA GLY 37 11.324 12.254 -2.258
263 H GLU 38 H GLU 38 11.475 12.433 -4.911
264 HA GLU 38 HA GLU 38 12.931 14.572 -5.546
265 HB2 GLU 38 1HB GLU 38 12.260 12.624 -7.052
266 HB3 GLU 38 2HB GLU 38 10.858 13.586 -7.499
267 HG2 GLU 38 1HG GLU 38 12.198 15.257 -8.491
268 HG3 GLU 38 2HG GLU 38 13.672 14.591 -7.789
269 H LYS 39 H LYS 39 12.696 16.674 -6.242
270 HA LYS 39 HA LYS 39 10.063 17.873 -5.721
271 HB2 LYS 39 1HB LYS 39 12.162 18.590 -4.423
272 HB3 LYS 39 2HB LYS 39 12.666 19.375 -5.914
273 HG2 LYS 39 1HG LYS 39 10.929 20.920 -5.834
274 HG3 LYS 39 2HG LYS 39 9.985 19.942 -4.707
275 HD2 LYS 39 1HD LYS 39 11.552 20.406 -2.929
276 HD3 LYS 39 2HD LYS 39 12.614 21.268 -4.044
277 HE2 LYS 39 1HE LYS 39 10.757 22.881 -4.450
278 HE3 LYS 39 2HE LYS 39 9.834 22.066 -3.189
279 HZ1 LYS 39 3HZ LYS 39 10.998 23.075 -1.595
280 HZ2 LYS 39 1HZ LYS 39 11.520 24.144 -2.799
281 HZ3 LYS 39 2HZ LYS 39 12.483 22.823 -2.366
282 HA PRO 40 HA PRO 40 9.677 18.644 -10.063
283 HB2 PRO 40 1HB PRO 40 7.563 20.341 -9.918
284 HB3 PRO 40 2HB PRO 40 7.408 18.594 -9.704
285 HG2 PRO 40 1HG PRO 40 7.556 20.749 -7.632
286 HG3 PRO 40 2HG PRO 40 6.494 19.330 -7.697
287 HD2 PRO 40 1HD PRO 40 8.718 19.417 -6.154
288 HD3 PRO 40 2HD PRO 40 8.128 17.916 -6.894
289 H SER 41 H SER 41 10.711 20.822 -7.731
290 HA SER 41 HA SER 41 11.691 22.877 -7.775
291 HB2 SER 41 1HB SER 41 12.272 21.839 -10.542
292 HB3 SER 41 2HB SER 41 12.852 23.420 -10.017
293 HG SER 41 HG SER 41 14.448 22.299 -9.229
294 H GLY 42 H GLY 42 8.907 22.894 -8.139
295 HA2 GLY 42 1HA GLY 42 8.445 24.940 -10.196
296 HA3 GLY 42 2HA GLY 42 7.200 24.013 -9.372
297 HA PRO 43 HA PRO 43 7.179 28.196 -7.464
298 HB2 PRO 43 1HB PRO 43 4.479 28.293 -7.196
299 HB3 PRO 43 2HB PRO 43 5.314 28.757 -8.683
300 HG2 PRO 43 1HG PRO 43 3.937 26.186 -8.007
301 HG3 PRO 43 2HG PRO 43 3.886 27.120 -9.514
302 HD2 PRO 43 1HD PRO 43 5.440 24.923 -9.213
303 HD3 PRO 43 2HD PRO 43 5.909 26.290 -10.243
304 H SER 44 H SER 44 6.911 28.735 -5.314
305 HA SER 44 HA SER 44 6.049 26.551 -3.533
306 HB2 SER 44 1HB SER 44 7.686 27.385 -1.888
307 HB3 SER 44 2HB SER 44 8.472 26.920 -3.397
308 HG SER 44 HG SER 44 8.811 29.010 -3.885
309 H SER 45 H SER 45 4.188 28.342 -4.480
310 HA SER 45 HA SER 45 3.792 30.639 -2.922
311 HB2 SER 45 1HB SER 45 2.549 30.333 -4.971
312 HB3 SER 45 2HB SER 45 1.795 28.866 -4.346
313 HG SER 45 HG SER 45 1.473 31.166 -2.827
314 H GLY 46 H GLY 46 2.612 27.317 -2.496
315 HA2 GLY 46 1HA GLY 46 1.389 26.399 -0.740
316 HA3 GLY 46 2HA GLY 46 2.783 26.995 0.149
Start of MODEL 7
1 H1 GLY 1 H GLY 1 13.278 -21.730 -16.789
2 HA2 GLY 1 1HA GLY 1 11.279 -23.671 -17.714
3 HA3 GLY 1 2HA GLY 1 12.071 -23.678 -16.145
4 H SER 2 H SER 2 9.309 -23.966 -16.461
5 HA SER 2 HA SER 2 7.891 -21.541 -16.155
6 HB2 SER 2 1HB SER 2 6.006 -22.870 -15.651
7 HB3 SER 2 2HB SER 2 6.970 -23.872 -16.735
8 HG SER 2 HG SER 2 7.861 -24.468 -14.392
9 H SER 3 H SER 3 6.929 -20.650 -14.268
10 HA SER 3 HA SER 3 8.335 -21.326 -11.767
11 HB2 SER 3 1HB SER 3 9.224 -19.228 -12.552
12 HB3 SER 3 2HB SER 3 7.604 -18.593 -12.839
13 HG SER 3 HG SER 3 8.985 -18.287 -10.683
14 H GLY 4 H GLY 4 7.039 -21.918 -10.163
15 HA2 GLY 4 1HA GLY 4 4.171 -21.285 -10.387
16 HA3 GLY 4 2HA GLY 4 4.846 -22.639 -9.491
17 H SER 5 H SER 5 2.970 -20.696 -8.519
18 HA SER 5 HA SER 5 4.132 -20.120 -6.018
19 HB2 SER 5 1HB SER 5 4.374 -17.755 -6.057
20 HB3 SER 5 2HB SER 5 5.212 -18.343 -7.494
21 HG SER 5 HG SER 5 3.602 -16.486 -7.632
22 H SER 6 H SER 6 2.640 -18.451 -4.795
23 HA SER 6 HA SER 6 -0.086 -18.361 -5.706
24 HB2 SER 6 1HB SER 6 -0.985 -19.676 -3.779
25 HB3 SER 6 2HB SER 6 -0.072 -20.654 -4.928
26 HG SER 6 HG SER 6 0.695 -19.761 -2.362
27 H GLY 7 H GLY 7 -0.680 -16.384 -5.128
28 HA2 GLY 7 1HA GLY 7 -0.900 -15.496 -2.497
29 HA3 GLY 7 2HA GLY 7 0.622 -14.873 -3.118
30 H THR 8 H THR 8 -2.045 -13.629 -2.356
31 HA THR 8 HA THR 8 -2.026 -11.566 -4.283
32 HB THR 8 HB THR 8 -3.165 -13.221 -5.693
33 HG1 THR 8 HG1 THR 8 -3.770 -10.942 -5.739
34 HG21 THR 8 3HG2 THR 8 -4.975 -13.412 -3.317
35 HG22 THR 8 1HG2 THR 8 -4.281 -14.700 -4.300
36 HG23 THR 8 2HG2 THR 8 -5.607 -13.724 -4.934
37 H ALA 9 H ALA 9 -3.194 -9.784 -3.616
38 HA ALA 9 HA ALA 9 -3.988 -9.758 -0.868
39 HB1 ALA 9 3HB ALA 9 -4.833 -7.365 -2.022
40 HB2 ALA 9 1HB ALA 9 -3.327 -7.657 -1.152
41 HB3 ALA 9 2HB ALA 9 -3.377 -7.818 -2.908
42 H GLU 10 H GLU 10 -6.043 -9.280 -0.013
43 HA GLU 10 HA GLU 10 -8.212 -10.487 -1.448
44 HB2 GLU 10 1HB GLU 10 -8.652 -8.942 1.069
45 HB3 GLU 10 2HB GLU 10 -9.372 -10.459 0.548
46 HG2 GLU 10 1HG GLU 10 -6.600 -10.032 1.628
47 HG3 GLU 10 2HG GLU 10 -7.930 -10.898 2.394
48 H LYS 11 H LYS 11 -6.901 -7.424 -1.459
49 HA LYS 11 HA LYS 11 -9.464 -6.190 -2.225
50 HB2 LYS 11 1HB LYS 11 -6.926 -4.813 -1.329
51 HB3 LYS 11 2HB LYS 11 -8.461 -4.034 -1.690
52 HG2 LYS 11 1HG LYS 11 -7.737 -5.770 0.638
53 HG3 LYS 11 2HG LYS 11 -8.401 -4.135 0.633
54 HD2 LYS 11 1HD LYS 11 -9.851 -6.640 -0.223
55 HD3 LYS 11 2HD LYS 11 -10.090 -5.772 1.295
56 HE2 LYS 11 1HE LYS 11 -10.543 -3.742 -0.303
57 HE3 LYS 11 2HE LYS 11 -10.880 -5.011 -1.480
58 HZ1 LYS 11 3HZ LYS 11 -12.845 -4.194 -0.199
59 HZ2 LYS 11 1HZ LYS 11 -12.169 -4.891 1.187
60 HZ3 LYS 11 2HZ LYS 11 -12.602 -5.866 -0.125
61 HA PRO 12 HA PRO 12 -8.064 -5.754 -6.366
62 HB2 PRO 12 1HB PRO 12 -9.355 -3.479 -7.093
63 HB3 PRO 12 2HB PRO 12 -10.184 -5.024 -6.869
64 HG2 PRO 12 1HG PRO 12 -9.970 -2.700 -4.994
65 HG3 PRO 12 2HG PRO 12 -11.382 -3.701 -5.378
66 HD2 PRO 12 1HD PRO 12 -9.915 -4.053 -3.129
67 HD3 PRO 12 2HD PRO 12 -10.723 -5.397 -3.963
68 H PHE 13 H PHE 13 -7.653 -3.088 -4.132
69 HA PHE 13 HA PHE 13 -5.692 -1.808 -5.876
70 HB2 PHE 13 1HB PHE 13 -6.494 -0.879 -3.124
71 HB3 PHE 13 2HB PHE 13 -5.803 0.068 -4.437
72 HD1 PHE 13 HD2 PHE 13 -8.843 -1.477 -3.117
73 HD2 PHE 13 HD1 PHE 13 -7.173 0.880 -6.243
74 HE1 PHE 13 HE2 PHE 13 -11.106 -0.827 -3.831
75 HE2 PHE 13 HE1 PHE 13 -9.434 1.534 -6.962
76 HZ PHE 13 HZ PHE 13 -11.404 0.680 -5.756
77 H ARG 14 H ARG 14 -3.534 -1.753 -5.488
78 HA ARG 14 HA ARG 14 -2.468 -2.747 -2.975
79 HB2 ARG 14 1HB ARG 14 -2.805 -4.763 -4.409
80 HB3 ARG 14 2HB ARG 14 -1.711 -4.056 -5.591
81 HG2 ARG 14 1HG ARG 14 0.092 -4.087 -3.939
82 HG3 ARG 14 2HG ARG 14 -1.008 -4.807 -2.761
83 HD2 ARG 14 1HD ARG 14 -1.325 -6.721 -4.304
84 HD3 ARG 14 2HD ARG 14 -0.122 -6.012 -5.380
85 HE ARG 14 HE ARG 14 1.245 -6.178 -3.094
86 HH11 ARG 14 1HH1 ARG 14 -0.776 -8.493 -4.730
87 HH12 ARG 14 2HH1 ARG 14 0.100 -9.868 -4.143
88 HH21 ARG 14 1HH2 ARG 14 2.407 -7.980 -2.315
89 HH22 ARG 14 2HH2 ARG 14 1.910 -9.575 -2.769
90 H CYS 15 H CYS 15 -0.566 -1.812 -2.452
91 HA CYS 15 HA CYS 15 0.451 0.229 -4.244
92 HB2 CYS 15 1HB CYS 15 0.136 0.796 -1.894
93 HB3 CYS 15 2HB CYS 15 1.221 -0.505 -1.412
94 H ASP 16 H ASP 16 1.931 -0.268 -5.710
95 HA ASP 16 HA ASP 16 3.598 -2.605 -5.440
96 HB2 ASP 16 1HB ASP 16 4.425 -2.016 -7.669
97 HB3 ASP 16 2HB ASP 16 2.665 -1.976 -7.626
98 H THR 17 H THR 17 4.100 -0.814 -3.378
99 HA THR 17 HA THR 17 6.877 -0.060 -3.977
100 HB THR 17 HB THR 17 5.064 1.627 -2.249
101 HG1 THR 17 HG1 THR 17 5.016 3.053 -4.037
102 HG21 THR 17 3HG2 THR 17 7.285 3.027 -3.333
103 HG22 THR 17 1HG2 THR 17 7.882 1.525 -2.630
104 HG23 THR 17 2HG2 THR 17 6.947 2.649 -1.644
105 H CYS 18 H CYS 18 4.518 -0.404 -1.324
106 HA CYS 18 HA CYS 18 6.654 -1.647 0.282
107 HB2 CYS 18 1HB CYS 18 5.422 -0.880 2.279
108 HB3 CYS 18 2HB CYS 18 5.918 0.463 1.255
109 H ASP 19 H ASP 19 4.460 -2.684 -1.633
110 HA ASP 19 HA ASP 19 3.104 -4.503 -1.804
111 HB2 ASP 19 1HB ASP 19 5.293 -5.414 -0.655
112 HB3 ASP 19 2HB ASP 19 4.228 -5.624 0.732
113 H LYS 20 H LYS 20 1.770 -2.441 -0.775
114 HA LYS 20 HA LYS 20 0.273 -3.523 1.519
115 HB2 LYS 20 1HB LYS 20 1.000 -0.771 0.678
116 HB3 LYS 20 2HB LYS 20 -0.594 -0.981 1.393
117 HG2 LYS 20 1HG LYS 20 0.628 -2.194 3.290
118 HG3 LYS 20 2HG LYS 20 2.093 -1.470 2.623
119 HD2 LYS 20 1HD LYS 20 1.375 0.700 3.085
120 HD3 LYS 20 2HD LYS 20 -0.314 0.210 3.233
121 HE2 LYS 20 1HE LYS 20 1.790 -0.774 5.135
122 HE3 LYS 20 2HE LYS 20 0.969 0.767 5.381
123 HZ1 LYS 20 3HZ LYS 20 -0.533 -0.460 6.459
124 HZ2 LYS 20 1HZ LYS 20 -0.002 -1.915 5.778
125 HZ3 LYS 20 2HZ LYS 20 -1.079 -0.927 4.928
126 H SER 21 H SER 21 -2.090 -2.559 1.481
127 HA SER 21 HA SER 21 -3.252 -2.446 -1.168
128 HB2 SER 21 1HB SER 21 -4.861 -4.344 -0.574
129 HB3 SER 21 2HB SER 21 -3.217 -4.812 -1.008
130 HG SER 21 HG SER 21 -3.698 -5.917 0.832
131 H PHE 22 H PHE 22 -5.322 -1.578 -1.194
132 HA PHE 22 HA PHE 22 -6.450 -0.800 1.408
133 HB2 PHE 22 1HB PHE 22 -6.198 0.998 -1.013
134 HB3 PHE 22 2HB PHE 22 -6.988 1.421 0.503
135 HD1 PHE 22 HD2 PHE 22 -3.698 0.146 -0.712
136 HD2 PHE 22 HD1 PHE 22 -5.790 2.653 2.018
137 HE1 PHE 22 HE2 PHE 22 -1.553 0.970 0.169
138 HE2 PHE 22 HE1 PHE 22 -3.649 3.482 2.903
139 HZ PHE 22 HZ PHE 22 -1.527 2.640 1.979
140 H ARG 23 H ARG 23 -8.743 0.122 1.074
141 HA ARG 23 HA ARG 23 -10.167 -1.742 -0.690
142 HB2 ARG 23 1HB ARG 23 -11.258 -0.119 1.615
143 HB3 ARG 23 2HB ARG 23 -12.098 -1.389 0.735
144 HG2 ARG 23 1HG ARG 23 -10.370 -2.993 1.542
145 HG3 ARG 23 2HG ARG 23 -9.718 -1.698 2.547
146 HD2 ARG 23 1HD ARG 23 -11.197 -3.091 3.859
147 HD3 ARG 23 2HD ARG 23 -11.905 -1.489 3.656
148 HE ARG 23 HE ARG 23 -13.059 -2.811 1.657
149 HH11 ARG 23 1HH1 ARG 23 -12.574 -3.709 4.985
150 HH12 ARG 23 2HH1 ARG 23 -13.998 -4.694 5.063
151 HH21 ARG 23 1HH2 ARG 23 -14.935 -4.105 1.746
152 HH22 ARG 23 2HH2 ARG 23 -15.339 -4.919 3.220
153 H GLN 24 H GLN 24 -9.668 1.640 -0.026
154 HA GLN 24 HA GLN 24 -11.622 2.348 -2.107
155 HB2 GLN 24 1HB GLN 24 -10.340 4.282 -0.190
156 HB3 GLN 24 2HB GLN 24 -11.808 4.494 -1.135
157 HG2 GLN 24 1HG GLN 24 -12.977 2.897 0.234
158 HG3 GLN 24 2HG GLN 24 -11.499 2.528 1.122
159 HE21 GLN 24 1HE2 GLN 24 -12.678 3.079 3.030
160 HE22 GLN 24 2HE2 GLN 24 -12.879 4.734 3.482
161 H ARG 25 H ARG 25 -10.922 3.070 -4.008
162 HA ARG 25 HA ARG 25 -8.280 3.011 -4.814
163 HB2 ARG 25 1HB ARG 25 -10.409 3.117 -6.239
164 HB3 ARG 25 2HB ARG 25 -10.308 4.863 -6.051
165 HG2 ARG 25 1HG ARG 25 -8.067 4.817 -7.069
166 HG3 ARG 25 2HG ARG 25 -8.237 3.078 -7.312
167 HD2 ARG 25 1HD ARG 25 -10.156 5.115 -8.424
168 HD3 ARG 25 2HD ARG 25 -8.764 4.500 -9.314
169 HE ARG 25 HE ARG 25 -10.035 2.241 -8.611
170 HH11 ARG 25 1HH1 ARG 25 -11.146 5.187 -10.096
171 HH12 ARG 25 2HH1 ARG 25 -12.409 4.413 -10.993
172 HH21 ARG 25 1HH2 ARG 25 -11.696 1.209 -9.786
173 HH22 ARG 25 2HH2 ARG 25 -12.722 2.150 -10.815
174 H SER 26 H SER 26 -10.121 5.660 -3.428
175 HA SER 26 HA SER 26 -8.167 7.672 -3.946
176 HB2 SER 26 1HB SER 26 -10.532 8.231 -3.564
177 HB3 SER 26 2HB SER 26 -10.410 7.630 -1.911
178 HG SER 26 HG SER 26 -9.739 10.045 -2.894
179 H ALA 27 H ALA 27 -8.453 5.181 -1.629
180 HA ALA 27 HA ALA 27 -6.843 6.459 0.398
181 HB1 ALA 27 3HB ALA 27 -7.526 3.535 0.220
182 HB2 ALA 27 1HB ALA 27 -7.089 4.468 1.652
183 HB3 ALA 27 2HB ALA 27 -8.638 4.747 0.855
184 H LEU 28 H LEU 28 -6.374 4.194 -2.241
185 HA LEU 28 HA LEU 28 -3.623 3.667 -1.486
186 HB2 LEU 28 1HB LEU 28 -4.542 1.774 -2.402
187 HB3 LEU 28 2HB LEU 28 -5.492 2.677 -3.580
188 HG LEU 28 HG LEU 28 -3.067 3.185 -4.556
189 HD11 LEU 28 1HD1 LEU 28 -2.741 0.843 -2.777
190 HD12 LEU 28 2HD1 LEU 28 -1.572 2.067 -3.271
191 HD13 LEU 28 3HD1 LEU 28 -1.992 0.755 -4.371
192 HD21 LEU 28 3HD2 LEU 28 -4.008 0.483 -5.252
193 HD22 LEU 28 1HD2 LEU 28 -3.721 1.888 -6.278
194 HD23 LEU 28 2HD2 LEU 28 -5.217 1.764 -5.353
195 H ASN 29 H ASN 29 -5.341 5.215 -4.188
196 HA ASN 29 HA ASN 29 -3.182 6.023 -5.702
197 HB2 ASN 29 1HB ASN 29 -5.898 7.229 -5.250
198 HB3 ASN 29 2HB ASN 29 -4.727 8.026 -6.297
199 HD21 ASN 29 1HD2 ASN 29 -6.960 7.355 -7.479
200 HD22 ASN 29 2HD2 ASN 29 -6.780 5.953 -8.473
201 H SER 30 H SER 30 -4.325 7.280 -2.675
202 HA SER 30 HA SER 30 -2.659 9.660 -2.860
203 HB2 SER 30 1HB SER 30 -4.868 9.891 -1.838
204 HB3 SER 30 2HB SER 30 -4.461 8.666 -0.637
205 HG SER 30 HG SER 30 -4.134 10.688 0.262
206 H HIS 31 H HIS 31 -2.774 6.580 -1.169
207 HA HIS 31 HA HIS 31 -0.722 7.048 0.687
208 HB2 HIS 31 1HB HIS 31 -2.020 5.141 1.096
209 HB3 HIS 31 2HB HIS 31 -1.859 4.561 -0.559
210 HD1 HIS 31 HD1 HIS 31 -0.048 4.670 2.718
211 HD2 HIS 31 HD2 HIS 31 0.420 3.039 -1.074
212 HE1 HIS 31 HE1 HIS 31 1.851 3.034 2.920
213 H ARG 32 H ARG 32 -0.653 6.038 -2.676
214 HA ARG 32 HA ARG 32 2.040 5.232 -2.794
215 HB2 ARG 32 1HB ARG 32 0.247 6.368 -4.946
216 HB3 ARG 32 2HB ARG 32 1.816 5.632 -5.245
217 HG2 ARG 32 1HG ARG 32 0.997 3.516 -4.333
218 HG3 ARG 32 2HG ARG 32 -0.580 4.257 -4.048
219 HD2 ARG 32 1HD ARG 32 -0.780 4.700 -6.462
220 HD3 ARG 32 2HD ARG 32 0.769 3.900 -6.722
221 HE ARG 32 HE ARG 32 -1.122 2.243 -5.354
222 HH11 ARG 32 1HH1 ARG 32 -0.086 3.377 -8.478
223 HH12 ARG 32 2HH1 ARG 32 -0.708 2.002 -9.328
224 HH21 ARG 32 1HH2 ARG 32 -1.946 0.428 -6.462
225 HH22 ARG 32 2HH2 ARG 32 -1.767 0.325 -8.181
226 H MET 33 H MET 33 0.572 8.344 -2.643
227 HA MET 33 HA MET 33 2.631 9.868 -3.846
228 HB2 MET 33 1HB MET 33 0.591 10.650 -1.756
229 HB3 MET 33 2HB MET 33 1.610 11.781 -2.637
230 HG2 MET 33 1HG MET 33 0.563 10.678 -4.740
231 HG3 MET 33 2HG MET 33 -0.682 10.144 -3.614
232 HE1 MET 33 3HE MET 33 -2.892 12.939 -4.789
233 HE2 MET 33 1HE MET 33 -2.180 11.491 -5.501
234 HE3 MET 33 2HE MET 33 -2.846 11.435 -3.869
235 H ILE 34 H ILE 34 2.009 8.873 -0.507
236 HA ILE 34 HA ILE 34 3.944 10.331 0.817
237 HB ILE 34 HB ILE 34 3.705 8.896 2.605
238 HG12 ILE 34 1HG1 ILE 34 3.561 6.736 0.531
239 HG13 ILE 34 2HG1 ILE 34 4.645 6.881 1.910
240 HG21 ILE 34 1HG2 ILE 34 1.490 9.691 1.553
241 HG22 ILE 34 2HG2 ILE 34 1.270 7.998 1.112
242 HG23 ILE 34 3HG2 ILE 34 1.432 8.454 2.808
243 HD11 ILE 34 3HD1 ILE 34 1.702 6.293 2.107
244 HD12 ILE 34 1HD1 ILE 34 2.979 5.077 2.140
245 HD13 ILE 34 2HD1 ILE 34 2.879 6.286 3.421
246 H HIS 35 H HIS 35 4.321 7.601 -1.297
247 HA HIS 35 HA HIS 35 7.034 7.044 -0.494
248 HB2 HIS 35 1HB HIS 35 5.435 6.072 -2.871
249 HB3 HIS 35 2HB HIS 35 7.022 5.467 -2.403
250 HD1 HIS 35 HD1 HIS 35 6.693 5.012 0.559
251 HD2 HIS 35 HD2 HIS 35 3.743 4.068 -2.210
252 HE1 HIS 35 HE1 HIS 35 5.264 3.265 1.668
253 H THR 36 H THR 36 5.448 9.142 -2.704
254 HA THR 36 HA THR 36 7.766 9.524 -4.397
255 HB THR 36 HB THR 36 6.453 11.040 -5.667
256 HG1 THR 36 HG1 THR 36 4.288 11.008 -3.884
257 HG21 THR 36 3HG2 THR 36 4.530 8.948 -4.649
258 HG22 THR 36 1HG2 THR 36 5.808 8.639 -5.823
259 HG23 THR 36 2HG2 THR 36 4.495 9.748 -6.219
260 H GLY 37 H GLY 37 8.450 10.018 -1.775
261 HA2 GLY 37 1HA GLY 37 8.566 12.963 -1.618
262 HA3 GLY 37 2HA GLY 37 8.719 11.881 -0.241
263 H GLU 38 H GLU 38 10.315 12.958 -3.204
264 HA GLU 38 HA GLU 38 12.888 12.178 -1.997
265 HB2 GLU 38 1HB GLU 38 13.786 11.869 -4.215
266 HB3 GLU 38 2HB GLU 38 12.314 10.920 -4.059
267 HG2 GLU 38 1HG GLU 38 11.132 12.897 -5.156
268 HG3 GLU 38 2HG GLU 38 12.746 13.461 -5.585
269 H LYS 39 H LYS 39 11.568 14.634 -1.454
270 HA LYS 39 HA LYS 39 12.157 16.821 -1.179
271 HB2 LYS 39 1HB LYS 39 14.544 15.688 -1.469
272 HB3 LYS 39 2HB LYS 39 14.523 16.589 -2.979
273 HG2 LYS 39 1HG LYS 39 14.136 17.785 -0.243
274 HG3 LYS 39 2HG LYS 39 15.640 17.807 -1.167
275 HD2 LYS 39 1HD LYS 39 13.064 18.945 -2.227
276 HD3 LYS 39 2HD LYS 39 14.209 19.900 -1.282
277 HE2 LYS 39 1HE LYS 39 15.157 18.368 -3.666
278 HE3 LYS 39 2HE LYS 39 14.329 19.908 -3.889
279 HZ1 LYS 39 3HZ LYS 39 16.173 20.389 -1.926
280 HZ2 LYS 39 1HZ LYS 39 16.296 20.848 -3.550
281 HZ3 LYS 39 2HZ LYS 39 16.999 19.402 -3.024
282 HA PRO 40 HA PRO 40 10.566 17.329 -5.598
283 HB2 PRO 40 1HB PRO 40 7.963 17.751 -4.952
284 HB3 PRO 40 2HB PRO 40 8.625 16.143 -5.270
285 HG2 PRO 40 1HG PRO 40 8.092 17.488 -2.649
286 HG3 PRO 40 2HG PRO 40 7.768 15.813 -3.134
287 HD2 PRO 40 1HD PRO 40 9.915 16.506 -1.636
288 HD3 PRO 40 2HD PRO 40 9.951 15.158 -2.791
289 H SER 41 H SER 41 9.348 18.976 -2.675
290 HA SER 41 HA SER 41 10.395 21.501 -3.536
291 HB2 SER 41 1HB SER 41 7.486 20.881 -3.858
292 HB3 SER 41 2HB SER 41 7.957 22.506 -3.361
293 HG SER 41 HG SER 41 8.626 22.885 -5.315
294 H GLY 42 H GLY 42 9.405 23.299 -2.008
295 HA2 GLY 42 1HA GLY 42 9.070 22.133 0.682
296 HA3 GLY 42 2HA GLY 42 10.232 23.418 0.393
297 HA PRO 43 HA PRO 43 5.660 25.109 0.148
298 HB2 PRO 43 1HB PRO 43 4.011 23.847 1.896
299 HB3 PRO 43 2HB PRO 43 4.179 23.354 0.207
300 HG2 PRO 43 1HG PRO 43 5.451 22.192 2.655
301 HG3 PRO 43 2HG PRO 43 4.726 21.358 1.269
302 HD2 PRO 43 1HD PRO 43 7.401 21.671 1.544
303 HD3 PRO 43 2HD PRO 43 6.601 21.638 -0.041
304 H SER 44 H SER 44 7.921 24.600 2.444
305 HA SER 44 HA SER 44 8.547 25.655 4.360
306 HB2 SER 44 1HB SER 44 6.563 27.659 3.281
307 HB3 SER 44 2HB SER 44 7.506 27.950 4.743
308 HG SER 44 HG SER 44 8.473 27.520 2.113
309 H SER 45 H SER 45 6.935 23.598 4.869
310 HA SER 45 HA SER 45 4.737 24.465 6.568
311 HB2 SER 45 1HB SER 45 4.132 22.562 5.344
312 HB3 SER 45 2HB SER 45 5.705 21.797 5.575
313 HG SER 45 HG SER 45 4.697 20.781 7.119
314 H GLY 46 H GLY 46 4.800 24.580 8.730
315 HA2 GLY 46 1HA GLY 46 7.195 24.633 10.147
316 HA3 GLY 46 2HA GLY 46 5.602 24.497 10.879
Start of MODEL 8
1 H1 GLY 1 H GLY 1 12.015 -23.945 -0.318
2 HA2 GLY 1 1HA GLY 1 10.756 -22.546 1.851
3 HA3 GLY 1 2HA GLY 1 11.470 -21.455 0.672
4 H SER 2 H SER 2 10.032 -20.707 -0.720
5 HA SER 2 HA SER 2 8.125 -22.552 -1.938
6 HB2 SER 2 1HB SER 2 7.183 -21.181 0.122
7 HB3 SER 2 2HB SER 2 7.062 -19.894 -1.077
8 HG SER 2 HG SER 2 5.223 -21.489 -0.750
9 H SER 3 H SER 3 8.146 -22.301 -4.065
10 HA SER 3 HA SER 3 8.944 -19.684 -5.162
11 HB2 SER 3 1HB SER 3 9.846 -20.996 -7.119
12 HB3 SER 3 2HB SER 3 10.716 -21.242 -5.605
13 HG SER 3 HG SER 3 10.150 -23.184 -6.853
14 H GLY 4 H GLY 4 6.813 -18.962 -5.390
15 HA2 GLY 4 1HA GLY 4 5.564 -19.303 -7.804
16 HA3 GLY 4 2HA GLY 4 4.831 -20.514 -6.763
17 H SER 5 H SER 5 5.046 -17.161 -7.544
18 HA SER 5 HA SER 5 3.575 -16.232 -5.257
19 HB2 SER 5 1HB SER 5 4.560 -14.983 -7.800
20 HB3 SER 5 2HB SER 5 3.370 -14.134 -6.814
21 HG SER 5 HG SER 5 5.702 -13.744 -6.379
22 H SER 6 H SER 6 1.676 -17.450 -5.231
23 HA SER 6 HA SER 6 -0.182 -16.972 -7.465
24 HB2 SER 6 1HB SER 6 0.466 -19.373 -6.761
25 HB3 SER 6 2HB SER 6 -0.563 -19.089 -5.357
26 HG SER 6 HG SER 6 -1.519 -20.056 -7.369
27 H GLY 7 H GLY 7 -2.470 -16.694 -6.889
28 HA2 GLY 7 1HA GLY 7 -4.192 -16.006 -5.448
29 HA3 GLY 7 2HA GLY 7 -3.003 -15.768 -4.176
30 H THR 8 H THR 8 -5.085 -13.951 -4.883
31 HA THR 8 HA THR 8 -3.474 -11.673 -5.836
32 HB THR 8 HB THR 8 -5.205 -12.224 -7.477
33 HG1 THR 8 HG1 THR 8 -5.526 -9.842 -5.965
34 HG21 THR 8 3HG2 THR 8 -6.760 -12.827 -5.246
35 HG22 THR 8 1HG2 THR 8 -7.286 -12.821 -6.928
36 HG23 THR 8 2HG2 THR 8 -7.503 -11.382 -5.931
37 H ALA 9 H ALA 9 -3.743 -9.693 -4.791
38 HA ALA 9 HA ALA 9 -4.070 -9.688 -2.059
39 HB1 ALA 9 3HB ALA 9 -3.656 -7.734 -4.100
40 HB2 ALA 9 1HB ALA 9 -4.831 -7.120 -2.937
41 HB3 ALA 9 2HB ALA 9 -3.243 -7.657 -2.387
42 H GLU 10 H GLU 10 -5.756 -9.840 -0.736
43 HA GLU 10 HA GLU 10 -8.303 -10.459 -1.370
44 HB2 GLU 10 1HB GLU 10 -7.133 -10.181 0.953
45 HB3 GLU 10 2HB GLU 10 -7.871 -8.586 0.929
46 HG2 GLU 10 1HG GLU 10 -10.050 -9.482 0.887
47 HG3 GLU 10 2HG GLU 10 -9.456 -11.100 0.518
48 H LYS 11 H LYS 11 -6.851 -7.337 -1.639
49 HA LYS 11 HA LYS 11 -9.463 -6.174 -2.351
50 HB2 LYS 11 1HB LYS 11 -6.983 -4.663 -1.522
51 HB3 LYS 11 2HB LYS 11 -8.600 -4.010 -1.746
52 HG2 LYS 11 1HG LYS 11 -7.672 -5.881 0.419
53 HG3 LYS 11 2HG LYS 11 -8.184 -4.201 0.593
54 HD2 LYS 11 1HD LYS 11 -9.879 -6.583 -0.135
55 HD3 LYS 11 2HD LYS 11 -9.997 -5.572 1.307
56 HE2 LYS 11 1HE LYS 11 -10.446 -3.648 -0.340
57 HE3 LYS 11 2HE LYS 11 -10.752 -4.919 -1.522
58 HZ1 LYS 11 3HZ LYS 11 -12.120 -4.975 1.085
59 HZ2 LYS 11 1HZ LYS 11 -12.605 -5.646 -0.391
60 HZ3 LYS 11 2HZ LYS 11 -12.701 -3.975 -0.149
61 HA PRO 12 HA PRO 12 -8.111 -5.625 -6.493
62 HB2 PRO 12 1HB PRO 12 -9.441 -3.357 -7.169
63 HB3 PRO 12 2HB PRO 12 -10.245 -4.918 -6.964
64 HG2 PRO 12 1HG PRO 12 -10.047 -2.623 -5.051
65 HG3 PRO 12 2HG PRO 12 -11.448 -3.638 -5.440
66 HD2 PRO 12 1HD PRO 12 -9.956 -4.007 -3.211
67 HD3 PRO 12 2HD PRO 12 -10.752 -5.348 -4.060
68 H PHE 13 H PHE 13 -7.523 -3.198 -4.107
69 HA PHE 13 HA PHE 13 -5.629 -1.819 -5.879
70 HB2 PHE 13 1HB PHE 13 -6.554 -0.899 -3.157
71 HB3 PHE 13 2HB PHE 13 -5.732 0.049 -4.392
72 HD1 PHE 13 HD1 PHE 13 -6.930 0.899 -6.313
73 HD2 PHE 13 HD2 PHE 13 -8.913 -1.388 -3.321
74 HE1 PHE 13 HE1 PHE 13 -9.105 1.636 -7.196
75 HE2 PHE 13 HE2 PHE 13 -11.091 -0.656 -4.200
76 HZ PHE 13 HZ PHE 13 -11.189 0.857 -6.140
77 H ARG 14 H ARG 14 -3.480 -1.773 -5.456
78 HA ARG 14 HA ARG 14 -2.458 -2.731 -2.914
79 HB2 ARG 14 1HB ARG 14 -2.814 -4.754 -4.391
80 HB3 ARG 14 2HB ARG 14 -1.594 -4.087 -5.468
81 HG2 ARG 14 1HG ARG 14 -0.074 -4.053 -3.401
82 HG3 ARG 14 2HG ARG 14 -1.270 -5.136 -2.684
83 HD2 ARG 14 1HD ARG 14 -0.793 -6.847 -4.138
84 HD3 ARG 14 2HD ARG 14 -0.223 -5.757 -5.401
85 HE ARG 14 HE ARG 14 1.459 -5.785 -3.076
86 HH11 ARG 14 1HH1 ARG 14 0.740 -7.363 -6.094
87 HH12 ARG 14 2HH1 ARG 14 2.327 -8.034 -6.272
88 HH21 ARG 14 1HH2 ARG 14 3.553 -6.663 -3.298
89 HH22 ARG 14 2HH2 ARG 14 3.926 -7.636 -4.680
90 H CYS 15 H CYS 15 -0.507 -1.865 -2.402
91 HA CYS 15 HA CYS 15 0.529 0.167 -4.198
92 HB2 CYS 15 1HB CYS 15 0.233 0.764 -1.861
93 HB3 CYS 15 2HB CYS 15 1.269 -0.569 -1.359
94 H ASP 16 H ASP 16 2.113 -0.224 -5.581
95 HA ASP 16 HA ASP 16 3.700 -2.636 -5.357
96 HB2 ASP 16 1HB ASP 16 4.419 -2.206 -7.570
97 HB3 ASP 16 2HB ASP 16 2.727 -1.718 -7.529
98 H THR 17 H THR 17 4.155 -0.784 -3.278
99 HA THR 17 HA THR 17 6.968 -0.099 -3.808
100 HB THR 17 HB THR 17 5.117 1.571 -2.100
101 HG1 THR 17 HG1 THR 17 6.125 2.115 -4.712
102 HG21 THR 17 3HG2 THR 17 7.288 1.917 -1.311
103 HG22 THR 17 1HG2 THR 17 7.066 3.221 -2.478
104 HG23 THR 17 2HG2 THR 17 7.995 1.789 -2.921
105 H CYS 18 H CYS 18 4.608 -0.349 -1.139
106 HA CYS 18 HA CYS 18 6.684 -1.729 0.433
107 HB2 CYS 18 1HB CYS 18 5.467 -0.931 2.443
108 HB3 CYS 18 2HB CYS 18 6.078 0.388 1.450
109 H ASP 19 H ASP 19 4.681 -2.827 -1.493
110 HA ASP 19 HA ASP 19 3.167 -4.527 -1.669
111 HB2 ASP 19 1HB ASP 19 3.599 -6.338 0.205
112 HB3 ASP 19 2HB ASP 19 4.786 -6.048 -1.064
113 H LYS 20 H LYS 20 1.818 -2.494 -0.730
114 HA LYS 20 HA LYS 20 0.329 -3.479 1.613
115 HB2 LYS 20 1HB LYS 20 1.074 -0.765 0.681
116 HB3 LYS 20 2HB LYS 20 -0.528 -0.936 1.387
117 HG2 LYS 20 1HG LYS 20 0.689 -2.107 3.329
118 HG3 LYS 20 2HG LYS 20 2.146 -1.370 2.658
119 HD2 LYS 20 1HD LYS 20 1.087 0.841 2.830
120 HD3 LYS 20 2HD LYS 20 -0.348 0.091 3.531
121 HE2 LYS 20 1HE LYS 20 2.397 -0.183 4.734
122 HE3 LYS 20 2HE LYS 20 1.293 1.124 5.160
123 HZ1 LYS 20 3HZ LYS 20 1.233 -0.846 6.666
124 HZ2 LYS 20 1HZ LYS 20 0.582 -1.746 5.390
125 HZ3 LYS 20 2HZ LYS 20 -0.267 -0.421 6.011
126 H SER 21 H SER 21 -2.031 -2.531 1.547
127 HA SER 21 HA SER 21 -3.202 -2.474 -1.096
128 HB2 SER 21 1HB SER 21 -4.791 -4.383 -0.470
129 HB3 SER 21 2HB SER 21 -3.146 -4.836 -0.917
130 HG SER 21 HG SER 21 -3.152 -5.822 0.937
131 H PHE 22 H PHE 22 -5.265 -1.605 -1.129
132 HA PHE 22 HA PHE 22 -6.395 -0.813 1.469
133 HB2 PHE 22 1HB PHE 22 -6.179 0.947 -0.983
134 HB3 PHE 22 2HB PHE 22 -6.968 1.385 0.529
135 HD1 PHE 22 HD2 PHE 22 -3.666 0.114 -0.659
136 HD2 PHE 22 HD1 PHE 22 -5.781 2.678 1.999
137 HE1 PHE 22 HE2 PHE 22 -1.530 0.981 0.198
138 HE2 PHE 22 HE1 PHE 22 -3.648 3.550 2.861
139 HZ PHE 22 HZ PHE 22 -1.518 2.701 1.961
140 H ARG 23 H ARG 23 -8.683 0.284 0.920
141 HA ARG 23 HA ARG 23 -10.111 -1.714 -0.700
142 HB2 ARG 23 1HB ARG 23 -11.132 0.000 1.572
143 HB3 ARG 23 2HB ARG 23 -12.081 -1.179 0.676
144 HG2 ARG 23 1HG ARG 23 -11.531 -2.417 2.504
145 HG3 ARG 23 2HG ARG 23 -10.169 -2.811 1.453
146 HD2 ARG 23 1HD ARG 23 -8.743 -1.293 2.583
147 HD3 ARG 23 2HD ARG 23 -10.094 -0.557 3.443
148 HE ARG 23 HE ARG 23 -9.769 -3.351 4.010
149 HH11 ARG 23 1HH1 ARG 23 -8.737 -0.132 4.843
150 HH12 ARG 23 2HH1 ARG 23 -8.248 -0.563 6.448
151 HH21 ARG 23 1HH2 ARG 23 -9.128 -3.932 6.121
152 HH22 ARG 23 2HH2 ARG 23 -8.470 -2.725 7.173
153 H GLN 24 H GLN 24 -9.934 1.736 0.058
154 HA GLN 24 HA GLN 24 -11.698 2.322 -2.207
155 HB2 GLN 24 1HB GLN 24 -10.616 4.403 -0.341
156 HB3 GLN 24 2HB GLN 24 -12.118 4.408 -1.255
157 HG2 GLN 24 1HG GLN 24 -13.172 2.959 0.242
158 HG3 GLN 24 2HG GLN 24 -11.645 2.452 0.963
159 HE21 GLN 24 1HE2 GLN 24 -14.150 3.655 2.078
160 HE22 GLN 24 2HE2 GLN 24 -13.609 5.012 3.000
161 H ARG 25 H ARG 25 -10.958 3.148 -4.060
162 HA ARG 25 HA ARG 25 -8.297 3.131 -4.780
163 HB2 ARG 25 1HB ARG 25 -10.321 3.254 -6.301
164 HB3 ARG 25 2HB ARG 25 -10.345 4.985 -5.993
165 HG2 ARG 25 1HG ARG 25 -8.013 5.098 -6.874
166 HG3 ARG 25 2HG ARG 25 -8.169 3.402 -7.335
167 HD2 ARG 25 1HD ARG 25 -8.760 4.456 -9.292
168 HD3 ARG 25 2HD ARG 25 -10.335 4.226 -8.535
169 HE ARG 25 HE ARG 25 -9.072 6.753 -7.945
170 HH11 ARG 25 1HH1 ARG 25 -11.189 5.003 -10.084
171 HH12 ARG 25 2HH1 ARG 25 -11.993 6.424 -10.663
172 HH21 ARG 25 1HH2 ARG 25 -10.123 8.632 -8.699
173 HH22 ARG 25 2HH2 ARG 25 -11.385 8.488 -9.875
174 H SER 26 H SER 26 -10.200 5.763 -3.423
175 HA SER 26 HA SER 26 -8.254 7.792 -3.796
176 HB2 SER 26 1HB SER 26 -10.784 8.016 -3.256
177 HB3 SER 26 2HB SER 26 -10.281 7.837 -1.575
178 HG SER 26 HG SER 26 -9.753 9.857 -1.636
179 H ALA 27 H ALA 27 -8.556 5.219 -1.555
180 HA ALA 27 HA ALA 27 -6.942 6.427 0.509
181 HB1 ALA 27 3HB ALA 27 -8.733 4.339 0.450
182 HB2 ALA 27 1HB ALA 27 -7.175 3.528 0.607
183 HB3 ALA 27 2HB ALA 27 -7.659 4.746 1.788
184 H LEU 28 H LEU 28 -6.475 4.221 -2.184
185 HA LEU 28 HA LEU 28 -3.721 3.686 -1.445
186 HB2 LEU 28 1HB LEU 28 -4.637 1.809 -2.394
187 HB3 LEU 28 2HB LEU 28 -5.593 2.731 -3.552
188 HG LEU 28 HG LEU 28 -3.159 3.263 -4.514
189 HD11 LEU 28 1HD1 LEU 28 -2.828 0.942 -2.743
190 HD12 LEU 28 2HD1 LEU 28 -1.635 2.086 -3.357
191 HD13 LEU 28 3HD1 LEU 28 -2.177 0.749 -4.371
192 HD21 LEU 28 3HD2 LEU 28 -3.881 2.081 -6.275
193 HD22 LEU 28 1HD2 LEU 28 -5.333 1.818 -5.309
194 HD23 LEU 28 2HD2 LEU 28 -4.058 0.600 -5.334
195 H ASN 29 H ASN 29 -5.448 5.278 -4.117
196 HA ASN 29 HA ASN 29 -3.309 6.116 -5.633
197 HB2 ASN 29 1HB ASN 29 -6.040 7.228 -5.138
198 HB3 ASN 29 2HB ASN 29 -4.887 8.196 -6.052
199 HD21 ASN 29 1HD2 ASN 29 -7.175 7.398 -7.241
200 HD22 ASN 29 2HD2 ASN 29 -6.845 6.189 -8.431
201 H SER 30 H SER 30 -4.402 7.318 -2.562
202 HA SER 30 HA SER 30 -2.737 9.695 -2.709
203 HB2 SER 30 1HB SER 30 -4.732 8.618 -0.753
204 HB3 SER 30 2HB SER 30 -3.563 9.822 -0.210
205 HG SER 30 HG SER 30 -5.778 10.371 -1.326
206 H HIS 31 H HIS 31 -2.787 6.567 -1.094
207 HA HIS 31 HA HIS 31 -0.652 6.990 0.678
208 HB2 HIS 31 1HB HIS 31 -1.932 5.079 1.112
209 HB3 HIS 31 2HB HIS 31 -1.862 4.536 -0.562
210 HD1 HIS 31 HD1 HIS 31 0.209 4.662 2.578
211 HD2 HIS 31 HD2 HIS 31 0.286 2.913 -1.190
212 HE1 HIS 31 HE1 HIS 31 2.081 2.984 2.653
213 H ARG 32 H ARG 32 -0.731 5.926 -2.684
214 HA ARG 32 HA ARG 32 1.942 5.149 -2.944
215 HB2 ARG 32 1HB ARG 32 0.137 6.391 -5.028
216 HB3 ARG 32 2HB ARG 32 1.628 5.518 -5.357
217 HG2 ARG 32 1HG ARG 32 0.563 3.529 -4.220
218 HG3 ARG 32 2HG ARG 32 -0.951 4.434 -4.270
219 HD2 ARG 32 1HD ARG 32 0.732 3.864 -6.701
220 HD3 ARG 32 2HD ARG 32 -0.591 2.827 -6.170
221 HE ARG 32 HE ARG 32 -1.814 5.191 -6.344
222 HH11 ARG 32 1HH1 ARG 32 0.349 3.568 -8.537
223 HH12 ARG 32 2HH1 ARG 32 -0.352 4.273 -9.956
224 HH21 ARG 32 1HH2 ARG 32 -2.745 6.126 -8.205
225 HH22 ARG 32 2HH2 ARG 32 -2.111 5.729 -9.766
226 H MET 33 H MET 33 0.496 8.285 -2.744
227 HA MET 33 HA MET 33 2.515 9.809 -3.983
228 HB2 MET 33 1HB MET 33 0.713 10.652 -1.708
229 HB3 MET 33 2HB MET 33 1.553 11.715 -2.828
230 HG2 MET 33 1HG MET 33 0.212 10.855 -4.669
231 HG3 MET 33 2HG MET 33 -0.616 9.763 -3.562
232 HE1 MET 33 3HE MET 33 -2.096 11.065 -5.327
233 HE2 MET 33 1HE MET 33 -3.436 11.647 -4.338
234 HE3 MET 33 2HE MET 33 -2.443 12.793 -5.240
235 H ILE 34 H ILE 34 2.006 8.916 -0.581
236 HA ILE 34 HA ILE 34 4.032 10.269 0.649
237 HB ILE 34 HB ILE 34 3.907 8.777 2.410
238 HG12 ILE 34 1HG1 ILE 34 3.576 6.680 0.288
239 HG13 ILE 34 2HG1 ILE 34 4.776 6.777 1.572
240 HG21 ILE 34 1HG2 ILE 34 1.643 8.343 2.739
241 HG22 ILE 34 2HG2 ILE 34 1.645 9.638 1.542
242 HG23 ILE 34 3HG2 ILE 34 1.368 7.971 1.038
243 HD11 ILE 34 3HD1 ILE 34 3.132 6.170 3.215
244 HD12 ILE 34 1HD1 ILE 34 1.854 6.208 2.000
245 HD13 ILE 34 2HD1 ILE 34 3.123 4.985 1.909
246 H HIS 35 H HIS 35 4.299 7.500 -1.462
247 HA HIS 35 HA HIS 35 7.083 7.038 -0.850
248 HB2 HIS 35 1HB HIS 35 5.351 5.922 -3.066
249 HB3 HIS 35 2HB HIS 35 6.968 5.362 -2.652
250 HD1 HIS 35 HD1 HIS 35 6.872 4.963 0.292
251 HD2 HIS 35 HD2 HIS 35 3.655 4.030 -2.165
252 HE1 HIS 35 HE1 HIS 35 5.512 3.282 1.576
253 H THR 36 H THR 36 5.599 7.553 -4.037
254 HA THR 36 HA THR 36 6.599 8.451 -5.925
255 HB THR 36 HB THR 36 6.572 10.842 -5.873
256 HG1 THR 36 HG1 THR 36 6.895 12.000 -4.058
257 HG21 THR 36 3HG2 THR 36 4.480 11.139 -4.221
258 HG22 THR 36 1HG2 THR 36 4.516 9.380 -4.322
259 HG23 THR 36 2HG2 THR 36 4.356 10.344 -5.790
260 H GLY 37 H GLY 37 8.568 7.016 -4.715
261 HA2 GLY 37 1HA GLY 37 10.895 8.819 -4.613
262 HA3 GLY 37 2HA GLY 37 10.838 7.200 -3.932
263 H GLU 38 H GLU 38 10.485 8.835 -7.080
264 HA GLU 38 HA GLU 38 12.302 6.851 -8.233
265 HB2 GLU 38 1HB GLU 38 9.987 6.069 -8.655
266 HB3 GLU 38 2HB GLU 38 9.646 7.585 -9.477
267 HG2 GLU 38 1HG GLU 38 10.111 5.746 -11.031
268 HG3 GLU 38 2HG GLU 38 11.259 7.075 -11.189
269 H LYS 39 H LYS 39 13.561 7.603 -9.901
270 HA LYS 39 HA LYS 39 14.379 10.173 -10.024
271 HB2 LYS 39 1HB LYS 39 14.303 8.050 -12.145
272 HB3 LYS 39 2HB LYS 39 14.948 9.646 -12.509
273 HG2 LYS 39 1HG LYS 39 15.971 8.253 -10.097
274 HG3 LYS 39 2HG LYS 39 16.487 7.668 -11.680
275 HD2 LYS 39 1HD LYS 39 16.604 10.594 -11.134
276 HD3 LYS 39 2HD LYS 39 17.828 9.551 -10.407
277 HE2 LYS 39 1HE LYS 39 18.726 10.287 -12.466
278 HE3 LYS 39 2HE LYS 39 18.223 8.616 -12.719
279 HZ1 LYS 39 3HZ LYS 39 16.447 9.255 -14.016
280 HZ2 LYS 39 1HZ LYS 39 17.613 10.397 -14.460
281 HZ3 LYS 39 2HZ LYS 39 16.385 10.820 -13.377
282 HA PRO 40 HA PRO 40 11.098 12.578 -11.725
283 HB2 PRO 40 1HB PRO 40 12.545 14.752 -12.469
284 HB3 PRO 40 2HB PRO 40 12.151 14.391 -10.784
285 HG2 PRO 40 1HG PRO 40 14.684 13.868 -12.290
286 HG3 PRO 40 2HG PRO 40 14.470 14.493 -10.644
287 HD2 PRO 40 1HD PRO 40 15.101 11.909 -11.150
288 HD3 PRO 40 2HD PRO 40 14.110 12.395 -9.759
289 H SER 41 H SER 41 10.185 13.036 -13.692
290 HA SER 41 HA SER 41 11.148 11.701 -15.968
291 HB2 SER 41 1HB SER 41 9.292 12.697 -17.150
292 HB3 SER 41 2HB SER 41 8.750 12.279 -15.525
293 HG SER 41 HG SER 41 9.535 14.850 -16.440
294 H GLY 42 H GLY 42 11.199 15.136 -15.076
295 HA2 GLY 42 1HA GLY 42 13.555 15.558 -16.679
296 HA3 GLY 42 2HA GLY 42 12.122 16.335 -17.335
297 HA PRO 43 HA PRO 43 13.920 18.489 -13.354
298 HB2 PRO 43 1HB PRO 43 16.391 19.384 -14.037
299 HB3 PRO 43 2HB PRO 43 16.120 17.837 -13.226
300 HG2 PRO 43 1HG PRO 43 16.592 18.396 -16.128
301 HG3 PRO 43 2HG PRO 43 17.267 17.109 -15.113
302 HD2 PRO 43 1HD PRO 43 15.198 16.692 -16.809
303 HD3 PRO 43 2HD PRO 43 15.370 15.811 -15.277
304 H SER 44 H SER 44 13.806 19.102 -16.711
305 HA SER 44 HA SER 44 13.555 21.996 -16.208
306 HB2 SER 44 1HB SER 44 14.288 22.375 -18.518
307 HB3 SER 44 2HB SER 44 15.502 21.460 -17.623
308 HG SER 44 HG SER 44 14.936 19.638 -18.701
309 H SER 45 H SER 45 11.337 21.886 -15.795
310 HA SER 45 HA SER 45 9.493 20.602 -17.536
311 HB2 SER 45 1HB SER 45 7.774 21.631 -16.212
312 HB3 SER 45 2HB SER 45 9.074 21.169 -15.114
313 HG SER 45 HG SER 45 8.078 23.632 -15.674
314 H GLY 46 H GLY 46 7.888 21.628 -18.877
315 HA2 GLY 46 1HA GLY 46 8.852 23.269 -20.846
316 HA3 GLY 46 2HA GLY 46 7.146 23.141 -20.447
Start of MODEL 9
1 H1 GLY 1 H GLY 1 7.439 -27.952 -14.734
2 HA2 GLY 1 1HA GLY 1 8.743 -26.272 -12.745
3 HA3 GLY 1 2HA GLY 1 7.552 -25.754 -13.929
4 H SER 2 H SER 2 7.376 -24.860 -11.355
5 HA SER 2 HA SER 2 4.961 -26.248 -10.410
6 HB2 SER 2 1HB SER 2 7.395 -25.468 -8.865
7 HB3 SER 2 2HB SER 2 5.826 -25.341 -8.069
8 HG SER 2 HG SER 2 6.795 -27.398 -7.766
9 H SER 3 H SER 3 3.706 -24.800 -8.846
10 HA SER 3 HA SER 3 2.798 -22.550 -10.148
11 HB2 SER 3 1HB SER 3 1.454 -23.536 -8.426
12 HB3 SER 3 2HB SER 3 2.699 -23.254 -7.210
13 HG SER 3 HG SER 3 1.079 -21.345 -8.531
14 H GLY 4 H GLY 4 5.182 -22.731 -7.520
15 HA2 GLY 4 1HA GLY 4 6.964 -21.315 -7.091
16 HA3 GLY 4 2HA GLY 4 6.485 -20.348 -8.479
17 H SER 5 H SER 5 6.618 -18.356 -7.532
18 HA SER 5 HA SER 5 5.465 -17.796 -4.972
19 HB2 SER 5 1HB SER 5 6.023 -15.440 -5.499
20 HB3 SER 5 2HB SER 5 7.392 -16.520 -5.762
21 HG SER 5 HG SER 5 5.760 -15.219 -7.647
22 H SER 6 H SER 6 3.710 -16.341 -4.561
23 HA SER 6 HA SER 6 1.740 -16.214 -6.748
24 HB2 SER 6 1HB SER 6 1.230 -16.805 -3.823
25 HB3 SER 6 2HB SER 6 -0.031 -16.529 -5.024
26 HG SER 6 HG SER 6 0.141 -18.622 -5.256
27 H GLY 7 H GLY 7 0.943 -14.254 -7.173
28 HA2 GLY 7 1HA GLY 7 1.355 -12.139 -5.149
29 HA3 GLY 7 2HA GLY 7 1.553 -11.867 -6.874
30 H THR 8 H THR 8 -0.560 -11.683 -4.271
31 HA THR 8 HA THR 8 -2.636 -10.556 -5.852
32 HB THR 8 HB THR 8 -3.070 -12.974 -6.269
33 HG1 THR 8 HG1 THR 8 -5.350 -12.776 -5.339
34 HG21 THR 8 3HG2 THR 8 -2.305 -13.827 -4.091
35 HG22 THR 8 1HG2 THR 8 -3.943 -14.360 -4.463
36 HG23 THR 8 2HG2 THR 8 -3.682 -13.050 -3.312
37 H ALA 9 H ALA 9 -4.445 -9.789 -4.545
38 HA ALA 9 HA ALA 9 -3.991 -9.823 -1.652
39 HB1 ALA 9 3HB ALA 9 -3.462 -7.577 -3.365
40 HB2 ALA 9 1HB ALA 9 -4.749 -7.189 -2.222
41 HB3 ALA 9 2HB ALA 9 -3.186 -7.754 -1.632
42 H GLU 10 H GLU 10 -5.828 -9.768 -0.447
43 HA GLU 10 HA GLU 10 -8.254 -10.530 -1.521
44 HB2 GLU 10 1HB GLU 10 -7.660 -10.757 0.860
45 HB3 GLU 10 2HB GLU 10 -7.804 -9.016 1.057
46 HG2 GLU 10 1HG GLU 10 -9.782 -10.092 1.892
47 HG3 GLU 10 2HG GLU 10 -10.180 -9.163 0.449
48 H LYS 11 H LYS 11 -6.822 -7.451 -1.550
49 HA LYS 11 HA LYS 11 -9.399 -6.169 -2.171
50 HB2 LYS 11 1HB LYS 11 -6.785 -4.890 -1.349
51 HB3 LYS 11 2HB LYS 11 -8.283 -4.032 -1.684
52 HG2 LYS 11 1HG LYS 11 -7.584 -5.775 0.639
53 HG3 LYS 11 2HG LYS 11 -8.250 -4.140 0.623
54 HD2 LYS 11 1HD LYS 11 -9.718 -6.629 -0.248
55 HD3 LYS 11 2HD LYS 11 -9.909 -5.828 1.313
56 HE2 LYS 11 1HE LYS 11 -10.448 -3.730 -0.103
57 HE3 LYS 11 2HE LYS 11 -10.714 -4.880 -1.413
58 HZ1 LYS 11 3HZ LYS 11 -12.105 -5.950 0.654
59 HZ2 LYS 11 1HZ LYS 11 -12.769 -5.031 -0.602
60 HZ3 LYS 11 2HZ LYS 11 -12.360 -4.290 0.863
61 HA PRO 12 HA PRO 12 -8.231 -5.672 -6.376
62 HB2 PRO 12 1HB PRO 12 -9.536 -3.370 -6.985
63 HB3 PRO 12 2HB PRO 12 -10.368 -4.911 -6.744
64 HG2 PRO 12 1HG PRO 12 -10.023 -2.627 -4.840
65 HG3 PRO 12 2HG PRO 12 -11.465 -3.606 -5.162
66 HD2 PRO 12 1HD PRO 12 -9.878 -4.017 -3.008
67 HD3 PRO 12 2HD PRO 12 -10.745 -5.336 -3.819
68 H PHE 13 H PHE 13 -7.594 -3.131 -4.076
69 HA PHE 13 HA PHE 13 -5.681 -1.878 -5.915
70 HB2 PHE 13 1HB PHE 13 -6.561 -0.844 -3.218
71 HB3 PHE 13 2HB PHE 13 -5.725 0.044 -4.488
72 HD1 PHE 13 HD1 PHE 13 -6.946 0.502 -6.644
73 HD2 PHE 13 HD2 PHE 13 -8.897 -0.935 -3.145
74 HE1 PHE 13 HE1 PHE 13 -9.108 1.255 -7.545
75 HE2 PHE 13 HE2 PHE 13 -11.062 -0.185 -4.040
76 HZ PHE 13 HZ PHE 13 -11.170 0.911 -6.243
77 H ARG 14 H ARG 14 -3.521 -1.785 -5.487
78 HA ARG 14 HA ARG 14 -2.488 -2.712 -2.938
79 HB2 ARG 14 1HB ARG 14 -2.846 -4.765 -4.349
80 HB3 ARG 14 2HB ARG 14 -1.671 -4.114 -5.485
81 HG2 ARG 14 1HG ARG 14 -0.033 -4.053 -3.566
82 HG3 ARG 14 2HG ARG 14 -1.211 -4.997 -2.652
83 HD2 ARG 14 1HD ARG 14 0.471 -6.435 -3.689
84 HD3 ARG 14 2HD ARG 14 -1.136 -6.750 -4.343
85 HE ARG 14 HE ARG 14 0.467 -4.883 -5.861
86 HH11 ARG 14 1HH1 ARG 14 -0.492 -8.198 -5.405
87 HH12 ARG 14 2HH1 ARG 14 -0.078 -8.676 -7.018
88 HH21 ARG 14 1HH2 ARG 14 1.016 -5.500 -7.988
89 HH22 ARG 14 2HH2 ARG 14 0.780 -7.141 -8.486
90 H CYS 15 H CYS 15 -0.528 -1.850 -2.452
91 HA CYS 15 HA CYS 15 0.503 0.151 -4.289
92 HB2 CYS 15 1HB CYS 15 0.204 0.791 -1.960
93 HB3 CYS 15 2HB CYS 15 1.253 -0.523 -1.437
94 H ASP 16 H ASP 16 2.047 -0.318 -5.693
95 HA ASP 16 HA ASP 16 3.651 -2.706 -5.393
96 HB2 ASP 16 1HB ASP 16 4.319 -2.380 -7.627
97 HB3 ASP 16 2HB ASP 16 2.648 -1.825 -7.585
98 H THR 17 H THR 17 4.121 -0.787 -3.382
99 HA THR 17 HA THR 17 6.922 -0.095 -3.969
100 HB THR 17 HB THR 17 5.090 1.586 -2.252
101 HG1 THR 17 HG1 THR 17 5.281 1.467 -4.925
102 HG21 THR 17 3HG2 THR 17 6.905 2.759 -1.684
103 HG22 THR 17 1HG2 THR 17 7.455 2.847 -3.357
104 HG23 THR 17 2HG2 THR 17 7.865 1.446 -2.367
105 H CYS 18 H CYS 18 4.595 -0.370 -1.276
106 HA CYS 18 HA CYS 18 6.724 -1.664 0.299
107 HB2 CYS 18 1HB CYS 18 5.510 -0.873 2.309
108 HB3 CYS 18 2HB CYS 18 6.061 0.452 1.288
109 H ASP 19 H ASP 19 4.518 -2.690 -1.587
110 HA ASP 19 HA ASP 19 3.122 -4.481 -1.731
111 HB2 ASP 19 1HB ASP 19 5.300 -5.418 -0.580
112 HB3 ASP 19 2HB ASP 19 4.235 -5.596 0.812
113 H LYS 20 H LYS 20 1.783 -2.426 -0.771
114 HA LYS 20 HA LYS 20 0.309 -3.422 1.576
115 HB2 LYS 20 1HB LYS 20 1.041 -0.707 0.641
116 HB3 LYS 20 2HB LYS 20 -0.560 -0.880 1.346
117 HG2 LYS 20 1HG LYS 20 0.662 -2.051 3.288
118 HG3 LYS 20 2HG LYS 20 2.113 -1.303 2.618
119 HD2 LYS 20 1HD LYS 20 1.417 0.824 3.129
120 HD3 LYS 20 2HD LYS 20 -0.294 0.396 3.061
121 HE2 LYS 20 1HE LYS 20 -0.318 -0.407 5.208
122 HE3 LYS 20 2HE LYS 20 1.393 -0.833 5.183
123 HZ1 LYS 20 3HZ LYS 20 1.583 1.002 6.436
124 HZ2 LYS 20 1HZ LYS 20 0.119 1.665 5.907
125 HZ3 LYS 20 2HZ LYS 20 1.511 1.826 4.960
126 H SER 21 H SER 21 -2.056 -2.456 1.518
127 HA SER 21 HA SER 21 -3.237 -2.442 -1.123
128 HB2 SER 21 1HB SER 21 -4.847 -4.319 -0.421
129 HB3 SER 21 2HB SER 21 -3.218 -4.793 -0.904
130 HG SER 21 HG SER 21 -4.453 -4.954 1.555
131 H PHE 22 H PHE 22 -5.297 -1.562 -1.167
132 HA PHE 22 HA PHE 22 -6.419 -0.709 1.414
133 HB2 PHE 22 1HB PHE 22 -6.132 1.016 -1.055
134 HB3 PHE 22 2HB PHE 22 -6.967 1.485 0.422
135 HD1 PHE 22 HD2 PHE 22 -3.639 0.243 -0.711
136 HD2 PHE 22 HD1 PHE 22 -5.817 2.710 1.988
137 HE1 PHE 22 HE2 PHE 22 -1.524 1.102 0.205
138 HE2 PHE 22 HE1 PHE 22 -3.705 3.574 2.908
139 HZ PHE 22 HZ PHE 22 -1.554 2.769 2.017
140 H ARG 23 H ARG 23 -8.710 0.190 1.077
141 HA ARG 23 HA ARG 23 -10.139 -1.702 -0.651
142 HB2 ARG 23 1HB ARG 23 -11.248 -0.039 1.615
143 HB3 ARG 23 2HB ARG 23 -12.053 -1.362 0.780
144 HG2 ARG 23 1HG ARG 23 -10.088 -2.798 1.623
145 HG3 ARG 23 2HG ARG 23 -9.805 -1.468 2.748
146 HD2 ARG 23 1HD ARG 23 -12.440 -2.897 2.438
147 HD3 ARG 23 2HD ARG 23 -11.231 -3.304 3.656
148 HE ARG 23 HE ARG 23 -12.109 -0.544 3.634
149 HH11 ARG 23 1HH1 ARG 23 -12.512 -3.732 4.972
150 HH12 ARG 23 2HH1 ARG 23 -13.295 -3.171 6.412
151 HH21 ARG 23 1HH2 ARG 23 -13.139 0.208 5.526
152 HH22 ARG 23 2HH2 ARG 23 -13.652 -0.930 6.726
153 H GLN 24 H GLN 24 -9.752 1.709 0.050
154 HA GLN 24 HA GLN 24 -11.699 2.381 -2.040
155 HB2 GLN 24 1HB GLN 24 -10.342 4.313 -0.165
156 HB3 GLN 24 2HB GLN 24 -11.799 4.571 -1.117
157 HG2 GLN 24 1HG GLN 24 -11.731 2.443 0.976
158 HG3 GLN 24 2HG GLN 24 -11.985 4.129 1.424
159 HE21 GLN 24 1HE2 GLN 24 -14.013 2.947 2.184
160 HE22 GLN 24 2HE2 GLN 24 -15.343 2.942 1.081
161 H ARG 25 H ARG 25 -11.051 3.059 -3.975
162 HA ARG 25 HA ARG 25 -8.428 2.967 -4.849
163 HB2 ARG 25 1HB ARG 25 -10.532 2.991 -6.258
164 HB3 ARG 25 2HB ARG 25 -10.552 4.738 -6.057
165 HG2 ARG 25 1HG ARG 25 -8.321 4.852 -7.105
166 HG3 ARG 25 2HG ARG 25 -8.392 3.110 -7.377
167 HD2 ARG 25 1HD ARG 25 -9.034 4.343 -9.383
168 HD3 ARG 25 2HD ARG 25 -10.384 3.399 -8.756
169 HE ARG 25 HE ARG 25 -10.884 5.742 -7.634
170 HH11 ARG 25 1HH1 ARG 25 -9.893 4.999 -10.888
171 HH12 ARG 25 2HH1 ARG 25 -10.700 6.364 -11.585
172 HH21 ARG 25 1HH2 ARG 25 -11.950 7.543 -8.540
173 HH22 ARG 25 2HH2 ARG 25 -11.869 7.812 -10.248
174 H SER 26 H SER 26 -10.202 5.613 -3.406
175 HA SER 26 HA SER 26 -8.235 7.607 -4.045
176 HB2 SER 26 1HB SER 26 -10.461 8.401 -3.765
177 HB3 SER 26 2HB SER 26 -10.635 7.582 -2.213
178 HG SER 26 HG SER 26 -10.200 9.647 -1.681
179 H ALA 27 H ALA 27 -8.537 5.183 -1.681
180 HA ALA 27 HA ALA 27 -6.984 6.516 0.355
181 HB1 ALA 27 3HB ALA 27 -6.999 4.211 1.407
182 HB2 ALA 27 1HB ALA 27 -8.571 4.975 1.171
183 HB3 ALA 27 2HB ALA 27 -8.028 3.711 0.065
184 H LEU 28 H LEU 28 -6.431 4.205 -2.231
185 HA LEU 28 HA LEU 28 -3.695 3.714 -1.420
186 HB2 LEU 28 1HB LEU 28 -4.563 1.824 -2.381
187 HB3 LEU 28 2HB LEU 28 -5.505 2.728 -3.564
188 HG LEU 28 HG LEU 28 -3.088 3.279 -4.511
189 HD11 LEU 28 1HD1 LEU 28 -2.738 0.842 -2.824
190 HD12 LEU 28 2HD1 LEU 28 -1.651 2.210 -3.062
191 HD13 LEU 28 3HD1 LEU 28 -1.842 1.004 -4.334
192 HD21 LEU 28 3HD2 LEU 28 -3.685 1.958 -6.234
193 HD22 LEU 28 1HD2 LEU 28 -5.185 1.786 -5.322
194 HD23 LEU 28 2HD2 LEU 28 -3.936 0.547 -5.205
195 H ASN 29 H ASN 29 -5.334 5.247 -4.185
196 HA ASN 29 HA ASN 29 -3.157 6.086 -5.633
197 HB2 ASN 29 1HB ASN 29 -5.922 7.121 -5.262
198 HB3 ASN 29 2HB ASN 29 -4.763 8.186 -6.051
199 HD21 ASN 29 1HD2 ASN 29 -7.164 6.325 -6.799
200 HD22 ASN 29 2HD2 ASN 29 -6.615 5.592 -8.264
201 H SER 30 H SER 30 -4.358 7.333 -2.617
202 HA SER 30 HA SER 30 -2.703 9.713 -2.736
203 HB2 SER 30 1HB SER 30 -4.776 8.645 -0.880
204 HB3 SER 30 2HB SER 30 -3.586 9.765 -0.219
205 HG SER 30 HG SER 30 -5.183 11.045 -0.972
206 H HIS 31 H HIS 31 -2.753 6.596 -1.097
207 HA HIS 31 HA HIS 31 -0.659 7.052 0.713
208 HB2 HIS 31 1HB HIS 31 -1.974 5.131 1.091
209 HB3 HIS 31 2HB HIS 31 -1.760 4.555 -0.559
210 HD1 HIS 31 HD1 HIS 31 0.041 4.787 2.732
211 HD2 HIS 31 HD2 HIS 31 0.491 3.004 -0.993
212 HE1 HIS 31 HE1 HIS 31 1.953 3.174 2.986
213 H ARG 32 H ARG 32 -0.645 5.853 -2.617
214 HA ARG 32 HA ARG 32 2.042 5.153 -2.815
215 HB2 ARG 32 1HB ARG 32 0.311 6.353 -4.985
216 HB3 ARG 32 2HB ARG 32 1.777 5.411 -5.226
217 HG2 ARG 32 1HG ARG 32 0.584 3.517 -4.036
218 HG3 ARG 32 2HG ARG 32 -0.888 4.475 -4.212
219 HD2 ARG 32 1HD ARG 32 0.877 3.381 -6.392
220 HD3 ARG 32 2HD ARG 32 -0.797 2.952 -6.043
221 HE ARG 32 HE ARG 32 -0.368 5.730 -6.705
222 HH11 ARG 32 1HH1 ARG 32 -1.098 2.543 -7.900
223 HH12 ARG 32 2HH1 ARG 32 -1.854 3.117 -9.349
224 HH21 ARG 32 1HH2 ARG 32 -1.361 6.499 -8.609
225 HH22 ARG 32 2HH2 ARG 32 -2.002 5.367 -9.752
226 H MET 33 H MET 33 0.576 8.252 -2.586
227 HA MET 33 HA MET 33 2.587 9.795 -3.851
228 HB2 MET 33 1HB MET 33 0.682 10.613 -1.650
229 HB3 MET 33 2HB MET 33 1.581 11.702 -2.698
230 HG2 MET 33 1HG MET 33 0.347 10.441 -4.609
231 HG3 MET 33 2HG MET 33 -0.770 9.983 -3.325
232 HE1 MET 33 3HE MET 33 -2.970 12.553 -4.881
233 HE2 MET 33 1HE MET 33 -2.476 10.863 -4.773
234 HE3 MET 33 2HE MET 33 -3.120 11.685 -3.352
235 H ILE 34 H ILE 34 2.025 8.899 -0.461
236 HA ILE 34 HA ILE 34 4.011 10.316 0.790
237 HB ILE 34 HB ILE 34 3.847 8.865 2.583
238 HG12 ILE 34 1HG1 ILE 34 3.505 6.705 0.517
239 HG13 ILE 34 2HG1 ILE 34 4.746 6.854 1.756
240 HG21 ILE 34 1HG2 ILE 34 1.569 8.395 2.859
241 HG22 ILE 34 2HG2 ILE 34 1.613 9.717 1.694
242 HG23 ILE 34 3HG2 ILE 34 1.339 8.065 1.142
243 HD11 ILE 34 3HD1 ILE 34 1.843 6.286 2.299
244 HD12 ILE 34 1HD1 ILE 34 3.114 5.067 2.209
245 HD13 ILE 34 2HD1 ILE 34 3.159 6.297 3.472
246 H HIS 35 H HIS 35 4.338 7.591 -1.337
247 HA HIS 35 HA HIS 35 7.104 7.108 -0.620
248 HB2 HIS 35 1HB HIS 35 5.414 5.954 -2.849
249 HB3 HIS 35 2HB HIS 35 7.031 5.411 -2.412
250 HD1 HIS 35 HD1 HIS 35 6.877 5.092 0.559
251 HD2 HIS 35 HD2 HIS 35 3.757 4.013 -1.964
252 HE1 HIS 35 HE1 HIS 35 5.525 3.405 1.844
253 H THR 36 H THR 36 6.109 9.711 -1.802
254 HA THR 36 HA THR 36 8.002 9.818 -4.060
255 HB THR 36 HB THR 36 6.665 11.402 -5.196
256 HG1 THR 36 HG1 THR 36 4.987 12.486 -4.251
257 HG21 THR 36 3HG2 THR 36 5.615 9.484 -5.812
258 HG22 THR 36 1HG2 THR 36 4.267 10.224 -4.950
259 HG23 THR 36 2HG2 THR 36 5.266 9.012 -4.149
260 H GLY 37 H GLY 37 6.524 11.638 -1.396
261 HA2 GLY 37 1HA GLY 37 8.030 13.967 -1.552
262 HA3 GLY 37 2HA GLY 37 7.365 13.308 -0.065
263 H GLU 38 H GLU 38 8.658 11.947 1.235
264 HA GLU 38 HA GLU 38 10.594 11.424 2.314
265 HB2 GLU 38 1HB GLU 38 11.923 11.145 -0.364
266 HB3 GLU 38 2HB GLU 38 12.167 10.193 1.094
267 HG2 GLU 38 1HG GLU 38 9.486 10.113 -0.162
268 HG3 GLU 38 2HG GLU 38 10.806 9.283 -0.984
269 H LYS 39 H LYS 39 10.112 14.236 1.441
270 HA LYS 39 HA LYS 39 12.234 15.653 0.545
271 HB2 LYS 39 1HB LYS 39 10.119 16.662 1.307
272 HB3 LYS 39 2HB LYS 39 10.582 16.362 2.977
273 HG2 LYS 39 1HG LYS 39 12.480 17.869 2.735
274 HG3 LYS 39 2HG LYS 39 12.042 18.157 1.049
275 HD2 LYS 39 1HD LYS 39 9.992 18.632 3.158
276 HD3 LYS 39 2HD LYS 39 11.291 19.810 2.963
277 HE2 LYS 39 1HE LYS 39 9.523 18.850 0.718
278 HE3 LYS 39 2HE LYS 39 9.224 20.315 1.653
279 HZ1 LYS 39 3HZ LYS 39 11.895 20.180 0.626
280 HZ2 LYS 39 1HZ LYS 39 10.755 21.424 0.507
281 HZ3 LYS 39 2HZ LYS 39 10.732 20.147 -0.602
282 HA PRO 40 HA PRO 40 15.369 14.164 3.443
283 HB2 PRO 40 1HB PRO 40 17.465 14.984 1.925
284 HB3 PRO 40 2HB PRO 40 16.589 13.479 1.621
285 HG2 PRO 40 1HG PRO 40 16.313 16.138 0.273
286 HG3 PRO 40 2HG PRO 40 16.343 14.517 -0.446
287 HD2 PRO 40 1HD PRO 40 14.043 15.885 -0.032
288 HD3 PRO 40 2HD PRO 40 14.131 14.114 0.062
289 H SER 41 H SER 41 16.998 15.223 4.709
290 HA SER 41 HA SER 41 16.569 18.128 4.895
291 HB2 SER 41 1HB SER 41 17.336 16.064 6.957
292 HB3 SER 41 2HB SER 41 17.524 17.793 7.247
293 HG SER 41 HG SER 41 15.163 17.772 6.491
294 H GLY 42 H GLY 42 18.645 19.041 6.253
295 HA2 GLY 42 1HA GLY 42 20.954 18.376 4.536
296 HA3 GLY 42 2HA GLY 42 20.634 19.975 5.191
297 HA PRO 43 HA PRO 43 23.152 19.176 8.683
298 HB2 PRO 43 1HB PRO 43 21.756 20.286 10.729
299 HB3 PRO 43 2HB PRO 43 22.566 21.247 9.487
300 HG2 PRO 43 1HG PRO 43 19.679 20.489 9.711
301 HG3 PRO 43 2HG PRO 43 20.394 22.049 9.267
302 HD2 PRO 43 1HD PRO 43 19.420 20.317 7.428
303 HD3 PRO 43 2HD PRO 43 20.795 21.390 7.095
304 H SER 44 H SER 44 20.294 17.564 8.268
305 HA SER 44 HA SER 44 20.570 16.052 10.778
306 HB2 SER 44 1HB SER 44 18.324 17.169 10.011
307 HB3 SER 44 2HB SER 44 18.209 15.765 8.951
308 HG SER 44 HG SER 44 18.531 15.698 11.772
309 H SER 45 H SER 45 22.275 14.732 10.098
310 HA SER 45 HA SER 45 21.519 12.719 8.084
311 HB2 SER 45 1HB SER 45 24.198 14.044 8.516
312 HB3 SER 45 2HB SER 45 24.021 12.534 7.623
313 HG SER 45 HG SER 45 23.018 15.095 6.987
314 H GLY 46 H GLY 46 21.696 10.639 8.689
315 HA2 GLY 46 1HA GLY 46 21.887 9.865 11.330
316 HA3 GLY 46 2HA GLY 46 22.161 8.788 9.969
Start of MODEL 10
1 H1 GLY 1 H GLY 1 11.855 -26.348 -12.323
2 HA2 GLY 1 1HA GLY 1 13.874 -25.076 -12.307
3 HA3 GLY 1 2HA GLY 1 13.065 -23.839 -13.258
4 H SER 2 H SER 2 11.459 -22.508 -12.187
5 HA SER 2 HA SER 2 11.852 -22.363 -9.271
6 HB2 SER 2 1HB SER 2 12.069 -20.015 -9.336
7 HB3 SER 2 2HB SER 2 13.065 -20.580 -10.677
8 HG SER 2 HG SER 2 11.498 -19.961 -12.101
9 H SER 3 H SER 3 10.098 -21.583 -8.045
10 HA SER 3 HA SER 3 7.520 -21.570 -9.475
11 HB2 SER 3 1HB SER 3 6.524 -22.581 -7.431
12 HB3 SER 3 2HB SER 3 7.724 -23.625 -8.192
13 HG SER 3 HG SER 3 8.163 -21.934 -5.953
14 H GLY 4 H GLY 4 5.747 -20.527 -8.103
15 HA2 GLY 4 1HA GLY 4 6.096 -18.774 -6.041
16 HA3 GLY 4 2HA GLY 4 6.623 -17.868 -7.451
17 H SER 5 H SER 5 4.115 -18.180 -5.482
18 HA SER 5 HA SER 5 2.096 -17.901 -7.607
19 HB2 SER 5 1HB SER 5 1.936 -18.887 -4.775
20 HB3 SER 5 2HB SER 5 0.498 -18.252 -5.573
21 HG SER 5 HG SER 5 0.639 -19.851 -7.092
22 H SER 6 H SER 6 1.572 -15.875 -8.051
23 HA SER 6 HA SER 6 1.003 -14.015 -5.898
24 HB2 SER 6 1HB SER 6 2.432 -12.232 -6.913
25 HB3 SER 6 2HB SER 6 3.358 -13.571 -6.235
26 HG SER 6 HG SER 6 3.995 -14.135 -8.182
27 H GLY 7 H GLY 7 -0.110 -12.079 -6.646
28 HA2 GLY 7 1HA GLY 7 -0.952 -10.994 -8.786
29 HA3 GLY 7 2HA GLY 7 -1.546 -12.602 -9.171
30 H THR 8 H THR 8 -2.605 -13.442 -6.804
31 HA THR 8 HA THR 8 -5.065 -11.988 -6.738
32 HB THR 8 HB THR 8 -5.279 -14.322 -6.452
33 HG1 THR 8 HG1 THR 8 -6.676 -13.235 -5.060
34 HG21 THR 8 3HG2 THR 8 -4.162 -15.301 -4.261
35 HG22 THR 8 1HG2 THR 8 -3.018 -13.989 -4.543
36 HG23 THR 8 2HG2 THR 8 -3.277 -15.215 -5.784
37 H ALA 9 H ALA 9 -5.862 -10.622 -5.214
38 HA ALA 9 HA ALA 9 -4.353 -10.170 -2.757
39 HB1 ALA 9 3HB ALA 9 -4.219 -8.423 -5.017
40 HB2 ALA 9 1HB ALA 9 -5.009 -7.593 -3.676
41 HB3 ALA 9 2HB ALA 9 -3.404 -8.292 -3.459
42 H GLU 10 H GLU 10 -5.747 -10.170 -1.129
43 HA GLU 10 HA GLU 10 -8.391 -10.476 -1.105
44 HB2 GLU 10 1HB GLU 10 -6.685 -10.079 0.857
45 HB3 GLU 10 2HB GLU 10 -7.331 -8.445 0.819
46 HG2 GLU 10 1HG GLU 10 -9.040 -10.902 1.093
47 HG3 GLU 10 2HG GLU 10 -8.412 -9.986 2.461
48 H LYS 11 H LYS 11 -6.761 -7.450 -1.770
49 HA LYS 11 HA LYS 11 -9.376 -6.240 -2.389
50 HB2 LYS 11 1HB LYS 11 -6.899 -4.806 -1.415
51 HB3 LYS 11 2HB LYS 11 -8.447 -4.060 -1.791
52 HG2 LYS 11 1HG LYS 11 -7.862 -5.991 0.443
53 HG3 LYS 11 2HG LYS 11 -8.230 -4.270 0.586
54 HD2 LYS 11 1HD LYS 11 -10.055 -6.520 -0.214
55 HD3 LYS 11 2HD LYS 11 -10.241 -5.368 1.111
56 HE2 LYS 11 1HE LYS 11 -10.196 -3.650 -0.930
57 HE3 LYS 11 2HE LYS 11 -10.822 -5.062 -1.780
58 HZ1 LYS 11 3HZ LYS 11 -12.791 -4.851 -0.793
59 HZ2 LYS 11 1HZ LYS 11 -12.293 -3.305 -0.323
60 HZ3 LYS 11 2HZ LYS 11 -12.115 -4.609 0.738
61 HA PRO 12 HA PRO 12 -7.962 -5.614 -6.499
62 HB2 PRO 12 1HB PRO 12 -9.296 -3.342 -7.156
63 HB3 PRO 12 2HB PRO 12 -10.093 -4.911 -6.992
64 HG2 PRO 12 1HG PRO 12 -9.940 -2.650 -5.036
65 HG3 PRO 12 2HG PRO 12 -11.329 -3.666 -5.465
66 HD2 PRO 12 1HD PRO 12 -9.869 -4.065 -3.219
67 HD3 PRO 12 2HD PRO 12 -10.643 -5.395 -4.104
68 H PHE 13 H PHE 13 -7.536 -3.109 -4.117
69 HA PHE 13 HA PHE 13 -5.601 -1.716 -5.819
70 HB2 PHE 13 1HB PHE 13 -6.511 -0.865 -3.072
71 HB3 PHE 13 2HB PHE 13 -5.757 0.122 -4.319
72 HD1 PHE 13 HD2 PHE 13 -8.856 -1.439 -3.180
73 HD2 PHE 13 HD1 PHE 13 -7.038 0.965 -6.185
74 HE1 PHE 13 HE2 PHE 13 -11.082 -0.768 -3.985
75 HE2 PHE 13 HE1 PHE 13 -9.261 1.641 -6.994
76 HZ PHE 13 HZ PHE 13 -11.287 0.774 -5.895
77 H ARG 14 H ARG 14 -3.457 -1.728 -5.434
78 HA ARG 14 HA ARG 14 -2.415 -2.672 -2.893
79 HB2 ARG 14 1HB ARG 14 -2.792 -4.710 -4.323
80 HB3 ARG 14 2HB ARG 14 -1.616 -4.055 -5.455
81 HG2 ARG 14 1HG ARG 14 0.047 -4.045 -3.586
82 HG3 ARG 14 2HG ARG 14 -1.140 -4.919 -2.615
83 HD2 ARG 14 1HD ARG 14 0.451 -6.455 -3.636
84 HD3 ARG 14 2HD ARG 14 -1.173 -6.715 -4.272
85 HE ARG 14 HE ARG 14 -0.114 -5.040 -6.083
86 HH11 ARG 14 1HH1 ARG 14 1.064 -7.988 -4.656
87 HH12 ARG 14 2HH1 ARG 14 1.985 -8.448 -6.050
88 HH21 ARG 14 1HH2 ARG 14 1.094 -5.634 -7.924
89 HH22 ARG 14 2HH2 ARG 14 2.002 -7.108 -7.908
90 H CYS 15 H CYS 15 -0.439 -1.836 -2.413
91 HA CYS 15 HA CYS 15 0.597 0.168 -4.249
92 HB2 CYS 15 1HB CYS 15 0.273 0.787 -1.901
93 HB3 CYS 15 2HB CYS 15 1.371 -0.495 -1.400
94 H ASP 16 H ASP 16 2.128 -0.335 -5.656
95 HA ASP 16 HA ASP 16 3.723 -2.723 -5.337
96 HB2 ASP 16 1HB ASP 16 2.732 -1.774 -7.534
97 HB3 ASP 16 2HB ASP 16 4.109 -0.676 -7.506
98 H THR 17 H THR 17 4.203 -0.837 -3.313
99 HA THR 17 HA THR 17 7.015 -0.176 -3.872
100 HB THR 17 HB THR 17 5.297 1.566 -2.116
101 HG1 THR 17 HG1 THR 17 5.890 1.974 -4.876
102 HG21 THR 17 3HG2 THR 17 7.087 3.225 -2.691
103 HG22 THR 17 1HG2 THR 17 7.961 1.918 -3.490
104 HG23 THR 17 2HG2 THR 17 7.649 1.840 -1.755
105 H CYS 18 H CYS 18 4.631 -0.394 -1.226
106 HA CYS 18 HA CYS 18 6.718 -1.670 0.418
107 HB2 CYS 18 1HB CYS 18 5.462 -0.858 2.386
108 HB3 CYS 18 2HB CYS 18 6.007 0.462 1.355
109 H ASP 19 H ASP 19 4.514 -2.686 -1.511
110 HA ASP 19 HA ASP 19 3.127 -4.483 -1.672
111 HB2 ASP 19 1HB ASP 19 4.898 -5.257 0.629
112 HB3 ASP 19 2HB ASP 19 3.586 -6.313 0.113
113 H LYS 20 H LYS 20 1.762 -2.449 -0.732
114 HA LYS 20 HA LYS 20 0.273 -3.461 1.600
115 HB2 LYS 20 1HB LYS 20 1.006 -0.728 0.701
116 HB3 LYS 20 2HB LYS 20 -0.585 -0.921 1.425
117 HG2 LYS 20 1HG LYS 20 0.649 -2.102 3.339
118 HG3 LYS 20 2HG LYS 20 2.107 -1.380 2.654
119 HD2 LYS 20 1HD LYS 20 1.457 0.759 3.182
120 HD3 LYS 20 2HD LYS 20 -0.262 0.362 3.142
121 HE2 LYS 20 1HE LYS 20 1.590 -0.719 5.248
122 HE3 LYS 20 2HE LYS 20 0.775 0.834 5.422
123 HZ1 LYS 20 3HZ LYS 20 -1.343 -0.260 5.260
124 HZ2 LYS 20 1HZ LYS 20 -0.434 -1.005 6.477
125 HZ3 LYS 20 2HZ LYS 20 -0.607 -1.755 4.971
126 H SER 21 H SER 21 -2.087 -2.510 1.539
127 HA SER 21 HA SER 21 -3.250 -2.411 -1.106
128 HB2 SER 21 1HB SER 21 -4.831 -4.333 -0.542
129 HB3 SER 21 2HB SER 21 -3.176 -4.781 -0.952
130 HG SER 21 HG SER 21 -3.061 -5.681 0.930
131 H PHE 22 H PHE 22 -5.325 -1.559 -1.128
132 HA PHE 22 HA PHE 22 -6.467 -0.818 1.478
133 HB2 PHE 22 1HB PHE 22 -6.229 1.003 -0.927
134 HB3 PHE 22 2HB PHE 22 -7.029 1.404 0.590
135 HD1 PHE 22 HD2 PHE 22 -3.720 0.182 -0.629
136 HD2 PHE 22 HD1 PHE 22 -5.850 2.633 2.123
137 HE1 PHE 22 HE2 PHE 22 -1.589 1.024 0.265
138 HE2 PHE 22 HE1 PHE 22 -3.721 3.479 3.021
139 HZ PHE 22 HZ PHE 22 -1.587 2.674 2.093
140 H ARG 23 H ARG 23 -8.753 0.264 0.972
141 HA ARG 23 HA ARG 23 -10.162 -1.664 -0.747
142 HB2 ARG 23 1HB ARG 23 -11.244 -0.066 1.581
143 HB3 ARG 23 2HB ARG 23 -12.123 -1.277 0.656
144 HG2 ARG 23 1HG ARG 23 -10.441 -2.961 1.415
145 HG3 ARG 23 2HG ARG 23 -9.772 -1.721 2.477
146 HD2 ARG 23 1HD ARG 23 -12.281 -1.507 3.249
147 HD3 ARG 23 2HD ARG 23 -12.378 -3.154 2.627
148 HE ARG 23 HE ARG 23 -11.000 -2.267 4.999
149 HH11 ARG 23 1HH1 ARG 23 -11.287 -4.760 2.586
150 HH12 ARG 23 2HH1 ARG 23 -10.594 -5.991 3.589
151 HH21 ARG 23 1HH2 ARG 23 -10.086 -3.879 6.329
152 HH22 ARG 23 2HH2 ARG 23 -9.912 -5.489 5.718
153 H GLN 24 H GLN 24 -9.848 1.737 0.079
154 HA GLN 24 HA GLN 24 -11.743 2.454 -2.037
155 HB2 GLN 24 1HB GLN 24 -10.403 4.381 -0.155
156 HB3 GLN 24 2HB GLN 24 -11.899 4.594 -1.056
157 HG2 GLN 24 1HG GLN 24 -11.751 2.417 0.962
158 HG3 GLN 24 2HG GLN 24 -11.908 4.082 1.517
159 HE21 GLN 24 1HE2 GLN 24 -13.958 3.481 2.374
160 HE22 GLN 24 2HE2 GLN 24 -15.342 3.376 1.344
161 H ARG 25 H ARG 25 -11.080 3.185 -3.949
162 HA ARG 25 HA ARG 25 -8.453 3.098 -4.809
163 HB2 ARG 25 1HB ARG 25 -10.514 3.161 -6.250
164 HB3 ARG 25 2HB ARG 25 -10.587 4.894 -5.965
165 HG2 ARG 25 1HG ARG 25 -8.463 5.210 -7.056
166 HG3 ARG 25 2HG ARG 25 -8.263 3.466 -7.237
167 HD2 ARG 25 1HD ARG 25 -10.482 3.557 -8.531
168 HD3 ARG 25 2HD ARG 25 -10.198 5.295 -8.619
169 HE ARG 25 HE ARG 25 -7.976 3.686 -9.499
170 HH11 ARG 25 1HH1 ARG 25 -10.938 5.264 -10.425
171 HH12 ARG 25 2HH1 ARG 25 -10.506 5.380 -12.099
172 HH21 ARG 25 1HH2 ARG 25 -7.396 3.831 -11.700
173 HH22 ARG 25 2HH2 ARG 25 -8.491 4.563 -12.823
174 H SER 26 H SER 26 -10.241 5.753 -3.371
175 HA SER 26 HA SER 26 -8.249 7.735 -3.921
176 HB2 SER 26 1HB SER 26 -10.593 8.369 -3.597
177 HB3 SER 26 2HB SER 26 -10.543 7.756 -1.944
178 HG SER 26 HG SER 26 -9.629 9.544 -1.336
179 H ALA 27 H ALA 27 -8.551 5.242 -1.641
180 HA ALA 27 HA ALA 27 -7.000 6.520 0.438
181 HB1 ALA 27 3HB ALA 27 -8.041 3.718 0.092
182 HB2 ALA 27 1HB ALA 27 -7.054 4.221 1.464
183 HB3 ALA 27 2HB ALA 27 -8.628 4.968 1.189
184 H LEU 28 H LEU 28 -6.474 4.226 -2.175
185 HA LEU 28 HA LEU 28 -3.735 3.723 -1.379
186 HB2 LEU 28 1HB LEU 28 -4.647 1.835 -2.323
187 HB3 LEU 28 2HB LEU 28 -5.550 2.748 -3.531
188 HG LEU 28 HG LEU 28 -3.078 3.243 -4.409
189 HD11 LEU 28 1HD1 LEU 28 -2.076 1.920 -2.556
190 HD12 LEU 28 2HD1 LEU 28 -1.635 1.349 -4.165
191 HD13 LEU 28 3HD1 LEU 28 -2.849 0.482 -3.225
192 HD21 LEU 28 3HD2 LEU 28 -3.714 2.008 -6.174
193 HD22 LEU 28 1HD2 LEU 28 -5.225 1.832 -5.282
194 HD23 LEU 28 2HD2 LEU 28 -3.999 0.568 -5.196
195 H ASN 29 H ASN 29 -5.404 5.289 -4.103
196 HA ASN 29 HA ASN 29 -3.235 6.104 -5.588
197 HB2 ASN 29 1HB ASN 29 -5.960 7.265 -5.141
198 HB3 ASN 29 2HB ASN 29 -4.782 8.173 -6.084
199 HD21 ASN 29 1HD2 ASN 29 -7.021 7.461 -7.323
200 HD22 ASN 29 2HD2 ASN 29 -6.739 6.174 -8.440
201 H SER 30 H SER 30 -4.369 7.331 -2.543
202 HA SER 30 HA SER 30 -2.691 9.701 -2.685
203 HB2 SER 30 1HB SER 30 -4.737 8.660 -0.765
204 HB3 SER 30 2HB SER 30 -3.566 9.852 -0.201
205 HG SER 30 HG SER 30 -4.368 10.834 -2.427
206 H HIS 31 H HIS 31 -2.794 6.592 -1.036
207 HA HIS 31 HA HIS 31 -0.681 7.029 0.764
208 HB2 HIS 31 1HB HIS 31 -2.020 5.147 1.202
209 HB3 HIS 31 2HB HIS 31 -1.881 4.552 -0.450
210 HD1 HIS 31 HD1 HIS 31 0.066 4.779 2.765
211 HD2 HIS 31 HD2 HIS 31 0.272 2.891 -0.930
212 HE1 HIS 31 HE1 HIS 31 1.922 3.095 2.973
213 H ARG 32 H ARG 32 -0.729 5.852 -2.565
214 HA ARG 32 HA ARG 32 1.955 5.074 -2.753
215 HB2 ARG 32 1HB ARG 32 0.150 6.178 -4.913
216 HB3 ARG 32 2HB ARG 32 1.661 5.322 -5.188
217 HG2 ARG 32 1HG ARG 32 0.555 3.412 -3.850
218 HG3 ARG 32 2HG ARG 32 -0.951 4.265 -4.195
219 HD2 ARG 32 1HD ARG 32 -0.728 2.700 -5.930
220 HD3 ARG 32 2HD ARG 32 -0.221 4.236 -6.632
221 HE ARG 32 HE ARG 32 1.485 1.956 -5.999
222 HH11 ARG 32 1HH1 ARG 32 1.189 5.233 -7.136
223 HH12 ARG 32 2HH1 ARG 32 2.757 5.257 -7.871
224 HH21 ARG 32 1HH2 ARG 32 3.552 1.976 -6.963
225 HH22 ARG 32 2HH2 ARG 32 4.100 3.404 -7.773
226 H MET 33 H MET 33 0.466 8.204 -2.775
227 HA MET 33 HA MET 33 2.473 9.683 -4.066
228 HB2 MET 33 1HB MET 33 0.574 10.541 -1.876
229 HB3 MET 33 2HB MET 33 1.520 11.633 -2.878
230 HG2 MET 33 1HG MET 33 0.323 10.430 -4.846
231 HG3 MET 33 2HG MET 33 -0.836 9.960 -3.605
232 HE1 MET 33 3HE MET 33 -2.797 12.698 -5.394
233 HE2 MET 33 1HE MET 33 -2.248 11.025 -5.504
234 HE3 MET 33 2HE MET 33 -3.153 11.565 -4.089
235 H ILE 34 H ILE 34 2.006 8.881 -0.641
236 HA ILE 34 HA ILE 34 4.040 10.341 0.500
237 HB ILE 34 HB ILE 34 3.890 8.984 2.361
238 HG12 ILE 34 1HG1 ILE 34 3.547 6.741 0.396
239 HG13 ILE 34 2HG1 ILE 34 4.745 6.922 1.673
240 HG21 ILE 34 1HG2 ILE 34 1.631 9.788 1.403
241 HG22 ILE 34 2HG2 ILE 34 1.348 8.082 1.064
242 HG23 ILE 34 3HG2 ILE 34 1.626 8.617 2.721
243 HD11 ILE 34 3HD1 ILE 34 3.095 6.447 3.352
244 HD12 ILE 34 1HD1 ILE 34 1.819 6.408 2.136
245 HD13 ILE 34 2HD1 ILE 34 3.077 5.172 2.133
246 H HIS 35 H HIS 35 4.259 7.471 -1.461
247 HA HIS 35 HA HIS 35 7.031 6.980 -0.808
248 HB2 HIS 35 1HB HIS 35 5.273 5.777 -2.957
249 HB3 HIS 35 2HB HIS 35 6.884 5.213 -2.524
250 HD1 HIS 35 HD1 HIS 35 6.784 5.000 0.451
251 HD2 HIS 35 HD2 HIS 35 3.571 3.936 -1.959
252 HE1 HIS 35 HE1 HIS 35 5.410 3.406 1.828
253 H THR 36 H THR 36 6.646 9.589 -1.709
254 HA THR 36 HA THR 36 8.134 9.520 -4.248
255 HB THR 36 HB THR 36 7.013 11.536 -5.010
256 HG1 THR 36 HG1 THR 36 6.508 12.100 -2.644
257 HG21 THR 36 3HG2 THR 36 4.574 10.564 -5.005
258 HG22 THR 36 1HG2 THR 36 5.358 9.159 -4.283
259 HG23 THR 36 2HG2 THR 36 5.865 9.732 -5.872
260 H GLY 37 H GLY 37 9.369 9.575 -1.766
261 HA2 GLY 37 1HA GLY 37 11.345 11.314 -1.833
262 HA3 GLY 37 2HA GLY 37 10.066 12.370 -1.250
263 H GLU 38 H GLU 38 12.416 11.863 0.188
264 HA GLU 38 HA GLU 38 13.168 11.269 2.253
265 HB2 GLU 38 1HB GLU 38 11.120 12.588 2.852
266 HB3 GLU 38 2HB GLU 38 10.236 11.072 2.952
267 HG2 GLU 38 1HG GLU 38 11.392 10.375 4.841
268 HG3 GLU 38 2HG GLU 38 12.714 11.507 4.567
269 H LYS 39 H LYS 39 13.123 9.177 0.470
270 HA LYS 39 HA LYS 39 12.261 6.898 2.128
271 HB2 LYS 39 1HB LYS 39 12.092 5.583 0.100
272 HB3 LYS 39 2HB LYS 39 11.127 7.043 -0.066
273 HG2 LYS 39 1HG LYS 39 13.355 7.950 -1.170
274 HG3 LYS 39 2HG LYS 39 13.602 6.230 -1.479
275 HD2 LYS 39 1HD LYS 39 11.690 6.070 -2.804
276 HD3 LYS 39 2HD LYS 39 10.995 7.553 -2.144
277 HE2 LYS 39 1HE LYS 39 13.453 7.417 -3.887
278 HE3 LYS 39 2HE LYS 39 11.833 7.813 -4.458
279 HZ1 LYS 39 3HZ LYS 39 13.527 9.371 -2.592
280 HZ2 LYS 39 1HZ LYS 39 11.877 9.679 -2.803
281 HZ3 LYS 39 2HZ LYS 39 12.942 9.845 -4.106
282 HA PRO 40 HA PRO 40 16.493 5.796 2.625
283 HB2 PRO 40 1HB PRO 40 16.198 3.144 3.127
284 HB3 PRO 40 2HB PRO 40 15.778 4.397 4.301
285 HG2 PRO 40 1HG PRO 40 13.996 2.867 2.444
286 HG3 PRO 40 2HG PRO 40 13.741 3.285 4.148
287 HD2 PRO 40 1HD PRO 40 12.587 4.662 2.123
288 HD3 PRO 40 2HD PRO 40 13.060 5.430 3.651
289 H SER 41 H SER 41 14.621 3.418 0.728
290 HA SER 41 HA SER 41 16.369 3.661 -1.524
291 HB2 SER 41 1HB SER 41 16.633 1.321 0.333
292 HB3 SER 41 2HB SER 41 16.898 1.098 -1.396
293 HG SER 41 HG SER 41 18.256 3.213 -0.836
294 H GLY 42 H GLY 42 15.214 3.271 -3.301
295 HA2 GLY 42 1HA GLY 42 12.542 2.201 -3.043
296 HA3 GLY 42 2HA GLY 42 13.271 2.852 -4.503
297 HA PRO 43 HA PRO 43 12.896 -1.681 -5.161
298 HB2 PRO 43 1HB PRO 43 12.251 -1.460 -7.790
299 HB3 PRO 43 2HB PRO 43 11.054 -1.346 -6.494
300 HG2 PRO 43 1HG PRO 43 12.400 0.844 -8.028
301 HG3 PRO 43 2HG PRO 43 10.697 0.692 -7.557
302 HD2 PRO 43 1HD PRO 43 12.448 2.256 -6.208
303 HD3 PRO 43 2HD PRO 43 11.096 1.429 -5.410
304 H SER 44 H SER 44 14.150 -3.090 -6.527
305 HA SER 44 HA SER 44 16.782 -2.041 -7.045
306 HB2 SER 44 1HB SER 44 16.490 -4.263 -6.025
307 HB3 SER 44 2HB SER 44 15.668 -4.824 -7.481
308 HG SER 44 HG SER 44 17.622 -5.363 -8.058
309 H SER 45 H SER 45 14.225 -3.562 -8.991
310 HA SER 45 HA SER 45 15.528 -2.468 -11.398
311 HB2 SER 45 1HB SER 45 14.729 -4.313 -12.662
312 HB3 SER 45 2HB SER 45 15.376 -5.007 -11.175
313 HG SER 45 HG SER 45 13.342 -5.889 -11.655
314 H GLY 46 H GLY 46 14.171 -1.639 -13.063
315 HA2 GLY 46 1HA GLY 46 11.366 -1.435 -12.865
316 HA3 GLY 46 2HA GLY 46 12.093 0.007 -12.171
Start of MODEL 11
1 H1 GLY 1 H GLY 1 18.174 -19.009 -3.328
2 HA2 GLY 1 1HA GLY 1 15.904 -19.664 -5.073
3 HA3 GLY 1 2HA GLY 1 16.039 -20.481 -3.523
4 H SER 2 H SER 2 14.619 -17.953 -5.087
5 HA SER 2 HA SER 2 14.636 -16.068 -2.890
6 HB2 SER 2 1HB SER 2 13.368 -16.117 -5.617
7 HB3 SER 2 2HB SER 2 12.879 -14.918 -4.419
8 HG SER 2 HG SER 2 15.010 -14.190 -4.339
9 H SER 3 H SER 3 12.596 -15.263 -1.959
10 HA SER 3 HA SER 3 10.846 -17.515 -1.314
11 HB2 SER 3 1HB SER 3 10.997 -14.794 0.003
12 HB3 SER 3 2HB SER 3 10.144 -16.213 0.609
13 HG SER 3 HG SER 3 12.100 -16.110 1.654
14 H GLY 4 H GLY 4 8.573 -17.354 -1.385
15 HA2 GLY 4 1HA GLY 4 7.627 -15.571 -3.498
16 HA3 GLY 4 2HA GLY 4 6.775 -16.969 -2.860
17 H SER 5 H SER 5 7.976 -13.809 -1.722
18 HA SER 5 HA SER 5 5.860 -13.624 0.228
19 HB2 SER 5 1HB SER 5 6.855 -11.341 0.644
20 HB3 SER 5 2HB SER 5 7.978 -12.685 0.851
21 HG SER 5 HG SER 5 8.165 -10.593 -0.801
22 H SER 6 H SER 6 4.787 -13.912 -2.308
23 HA SER 6 HA SER 6 3.206 -11.492 -2.483
24 HB2 SER 6 1HB SER 6 3.543 -11.287 -4.949
25 HB3 SER 6 2HB SER 6 4.996 -10.927 -4.016
26 HG SER 6 HG SER 6 4.952 -12.518 -5.968
27 H GLY 7 H GLY 7 1.198 -12.242 -2.402
28 HA2 GLY 7 1HA GLY 7 0.555 -14.658 -3.979
29 HA3 GLY 7 2HA GLY 7 -0.129 -14.361 -2.388
30 H THR 8 H THR 8 -1.630 -12.616 -2.132
31 HA THR 8 HA THR 8 -2.589 -11.109 -4.340
32 HB THR 8 HB THR 8 -4.689 -13.029 -3.461
33 HG1 THR 8 HG1 THR 8 -3.718 -14.681 -4.341
34 HG21 THR 8 3HG2 THR 8 -4.087 -11.880 -6.182
35 HG22 THR 8 1HG2 THR 8 -5.071 -11.050 -4.977
36 HG23 THR 8 2HG2 THR 8 -5.594 -12.606 -5.624
37 H ALA 9 H ALA 9 -3.514 -9.333 -3.545
38 HA ALA 9 HA ALA 9 -4.098 -9.185 -0.714
39 HB1 ALA 9 3HB ALA 9 -3.317 -7.350 -2.748
40 HB2 ALA 9 1HB ALA 9 -4.807 -6.771 -2.001
41 HB3 ALA 9 2HB ALA 9 -3.390 -7.104 -1.003
42 H GLU 10 H GLU 10 -6.040 -9.463 0.154
43 HA GLU 10 HA GLU 10 -8.295 -10.332 -1.046
44 HB2 GLU 10 1HB GLU 10 -8.044 -10.194 1.383
45 HB3 GLU 10 2HB GLU 10 -8.184 -8.443 1.312
46 HG2 GLU 10 1HG GLU 10 -10.474 -8.801 0.303
47 HG3 GLU 10 2HG GLU 10 -10.303 -10.494 0.761
48 H LYS 11 H LYS 11 -7.063 -7.108 -1.142
49 HA LYS 11 HA LYS 11 -9.533 -6.155 -2.424
50 HB2 LYS 11 1HB LYS 11 -7.240 -4.603 -1.209
51 HB3 LYS 11 2HB LYS 11 -8.624 -3.877 -2.014
52 HG2 LYS 11 1HG LYS 11 -8.496 -5.289 0.613
53 HG3 LYS 11 2HG LYS 11 -9.179 -3.709 0.220
54 HD2 LYS 11 1HD LYS 11 -10.308 -6.380 -0.622
55 HD3 LYS 11 2HD LYS 11 -10.929 -5.362 0.680
56 HE2 LYS 11 1HE LYS 11 -10.996 -3.563 -1.263
57 HE3 LYS 11 2HE LYS 11 -11.100 -5.008 -2.267
58 HZ1 LYS 11 3HZ LYS 11 -13.195 -5.358 -1.646
59 HZ2 LYS 11 1HZ LYS 11 -13.185 -3.779 -1.038
60 HZ3 LYS 11 2HZ LYS 11 -12.867 -5.083 -0.009
61 HA PRO 12 HA PRO 12 -7.607 -5.907 -6.361
62 HB2 PRO 12 1HB PRO 12 -8.811 -3.708 -7.402
63 HB3 PRO 12 2HB PRO 12 -9.648 -5.250 -7.187
64 HG2 PRO 12 1HG PRO 12 -9.707 -2.806 -5.460
65 HG3 PRO 12 2HG PRO 12 -11.046 -3.855 -5.959
66 HD2 PRO 12 1HD PRO 12 -9.888 -4.033 -3.518
67 HD3 PRO 12 2HD PRO 12 -10.565 -5.442 -4.359
68 H PHE 13 H PHE 13 -7.632 -2.971 -4.404
69 HA PHE 13 HA PHE 13 -5.527 -1.724 -5.929
70 HB2 PHE 13 1HB PHE 13 -6.500 -0.886 -3.200
71 HB3 PHE 13 2HB PHE 13 -5.731 0.112 -4.430
72 HD1 PHE 13 HD2 PHE 13 -8.831 -1.607 -3.464
73 HD2 PHE 13 HD1 PHE 13 -6.986 1.066 -6.214
74 HE1 PHE 13 HE2 PHE 13 -11.047 -0.959 -4.315
75 HE2 PHE 13 HE1 PHE 13 -9.199 1.719 -7.069
76 HZ PHE 13 HZ PHE 13 -11.233 0.705 -6.121
77 H ARG 14 H ARG 14 -3.397 -1.823 -5.571
78 HA ARG 14 HA ARG 14 -2.379 -2.707 -2.989
79 HB2 ARG 14 1HB ARG 14 -2.738 -4.750 -4.428
80 HB3 ARG 14 2HB ARG 14 -1.529 -4.101 -5.528
81 HG2 ARG 14 1HG ARG 14 0.094 -4.104 -3.639
82 HG3 ARG 14 2HG ARG 14 -1.124 -4.929 -2.665
83 HD2 ARG 14 1HD ARG 14 -1.069 -6.844 -4.026
84 HD3 ARG 14 2HD ARG 14 -0.228 -5.997 -5.324
85 HE ARG 14 HE ARG 14 1.567 -5.857 -3.356
86 HH11 ARG 14 1HH1 ARG 14 -0.338 -8.524 -4.530
87 HH12 ARG 14 2HH1 ARG 14 0.845 -9.721 -4.116
88 HH21 ARG 14 1HH2 ARG 14 3.132 -7.423 -2.806
89 HH22 ARG 14 2HH2 ARG 14 2.818 -9.093 -3.135
90 H CYS 15 H CYS 15 -0.431 -1.835 -2.484
91 HA CYS 15 HA CYS 15 0.621 0.159 -4.316
92 HB2 CYS 15 1HB CYS 15 0.276 0.754 -1.956
93 HB3 CYS 15 2HB CYS 15 1.404 -0.507 -1.470
94 H ASP 16 H ASP 16 2.172 -0.322 -5.708
95 HA ASP 16 HA ASP 16 3.769 -2.710 -5.392
96 HB2 ASP 16 1HB ASP 16 2.796 -1.790 -7.593
97 HB3 ASP 16 2HB ASP 16 4.129 -0.640 -7.548
98 H THR 17 H THR 17 4.222 -0.811 -3.362
99 HA THR 17 HA THR 17 7.040 -0.153 -3.893
100 HB THR 17 HB THR 17 5.228 1.590 -2.221
101 HG1 THR 17 HG1 THR 17 4.978 1.410 -4.726
102 HG21 THR 17 3HG2 THR 17 7.929 1.433 -2.196
103 HG22 THR 17 1HG2 THR 17 7.028 2.908 -1.850
104 HG23 THR 17 2HG2 THR 17 7.689 2.636 -3.463
105 H CYS 18 H CYS 18 4.604 -0.447 -1.305
106 HA CYS 18 HA CYS 18 6.689 -1.664 0.386
107 HB2 CYS 18 1HB CYS 18 5.384 -0.890 2.329
108 HB3 CYS 18 2HB CYS 18 5.887 0.451 1.305
109 H ASP 19 H ASP 19 4.362 -2.594 -1.563
110 HA ASP 19 HA ASP 19 3.072 -4.456 -1.774
111 HB2 ASP 19 1HB ASP 19 4.867 -5.233 0.503
112 HB3 ASP 19 2HB ASP 19 3.552 -6.297 0.011
113 H LYS 20 H LYS 20 1.659 -2.472 -0.822
114 HA LYS 20 HA LYS 20 0.166 -3.556 1.476
115 HB2 LYS 20 1HB LYS 20 0.880 -0.785 0.673
116 HB3 LYS 20 2HB LYS 20 -0.701 -1.024 1.405
117 HG2 LYS 20 1HG LYS 20 0.568 -2.262 3.260
118 HG3 LYS 20 2HG LYS 20 2.009 -1.493 2.590
119 HD2 LYS 20 1HD LYS 20 1.314 0.625 3.179
120 HD3 LYS 20 2HD LYS 20 -0.393 0.175 3.194
121 HE2 LYS 20 1HE LYS 20 -0.218 -0.862 5.283
122 HE3 LYS 20 2HE LYS 20 1.539 -0.967 5.184
123 HZ1 LYS 20 3HZ LYS 20 1.796 1.205 5.787
124 HZ2 LYS 20 1HZ LYS 20 0.387 0.840 6.650
125 HZ3 LYS 20 2HZ LYS 20 0.289 1.685 5.188
126 H SER 21 H SER 21 -2.196 -2.585 1.421
127 HA SER 21 HA SER 21 -3.313 -2.468 -1.253
128 HB2 SER 21 1HB SER 21 -4.990 -4.321 -0.569
129 HB3 SER 21 2HB SER 21 -3.384 -4.809 -1.110
130 HG SER 21 HG SER 21 -4.435 -4.751 1.505
131 H PHE 22 H PHE 22 -5.350 -1.540 -1.330
132 HA PHE 22 HA PHE 22 -6.517 -0.710 1.239
133 HB2 PHE 22 1HB PHE 22 -6.131 1.054 -1.189
134 HB3 PHE 22 2HB PHE 22 -6.991 1.514 0.278
135 HD1 PHE 22 HD2 PHE 22 -3.665 0.211 -0.794
136 HD2 PHE 22 HD1 PHE 22 -5.852 2.689 1.887
137 HE1 PHE 22 HE2 PHE 22 -1.554 1.005 0.188
138 HE2 PHE 22 HE1 PHE 22 -3.744 3.488 2.873
139 HZ PHE 22 HZ PHE 22 -1.592 2.645 2.025
140 H ARG 23 H ARG 23 -8.788 -0.078 1.096
141 HA ARG 23 HA ARG 23 -10.206 -1.806 -0.767
142 HB2 ARG 23 1HB ARG 23 -10.611 -1.456 1.831
143 HB3 ARG 23 2HB ARG 23 -11.624 -0.137 1.258
144 HG2 ARG 23 1HG ARG 23 -11.891 -3.023 0.440
145 HG3 ARG 23 2HG ARG 23 -12.898 -2.191 1.627
146 HD2 ARG 23 1HD ARG 23 -13.309 -0.510 -0.326
147 HD3 ARG 23 2HD ARG 23 -12.785 -1.855 -1.339
148 HE ARG 23 HE ARG 23 -14.797 -2.640 0.523
149 HH11 ARG 23 1HH1 ARG 23 -14.271 -1.044 -2.526
150 HH12 ARG 23 2HH1 ARG 23 -15.849 -1.410 -3.139
151 HH21 ARG 23 1HH2 ARG 23 -16.878 -3.129 -0.273
152 HH22 ARG 23 2HH2 ARG 23 -17.332 -2.596 -1.856
153 H GLN 24 H GLN 24 -9.847 1.605 -0.009
154 HA GLN 24 HA GLN 24 -11.703 2.289 -2.177
155 HB2 GLN 24 1HB GLN 24 -10.480 4.243 -0.243
156 HB3 GLN 24 2HB GLN 24 -11.940 4.427 -1.206
157 HG2 GLN 24 1HG GLN 24 -12.829 4.040 0.860
158 HG3 GLN 24 2HG GLN 24 -12.780 2.402 0.209
159 HE21 GLN 24 1HE2 GLN 24 -12.936 2.772 2.889
160 HE22 GLN 24 2HE2 GLN 24 -11.445 2.329 3.642
161 H ARG 25 H ARG 25 -11.028 3.241 -4.012
162 HA ARG 25 HA ARG 25 -8.347 3.131 -4.787
163 HB2 ARG 25 1HB ARG 25 -10.344 3.173 -6.311
164 HB3 ARG 25 2HB ARG 25 -10.472 4.900 -6.002
165 HG2 ARG 25 1HG ARG 25 -8.132 5.131 -6.877
166 HG3 ARG 25 2HG ARG 25 -8.234 3.442 -7.379
167 HD2 ARG 25 1HD ARG 25 -8.798 4.759 -9.271
168 HD3 ARG 25 2HD ARG 25 -10.300 4.059 -8.669
169 HE ARG 25 HE ARG 25 -10.218 6.465 -7.446
170 HH11 ARG 25 1HH1 ARG 25 -9.884 5.468 -10.765
171 HH12 ARG 25 2HH1 ARG 25 -10.540 6.936 -11.408
172 HH21 ARG 25 1HH2 ARG 25 -11.084 8.403 -8.281
173 HH22 ARG 25 2HH2 ARG 25 -11.222 8.605 -9.994
174 H SER 26 H SER 26 -10.174 5.645 -3.222
175 HA SER 26 HA SER 26 -8.283 7.738 -3.743
176 HB2 SER 26 1HB SER 26 -10.753 8.062 -3.244
177 HB3 SER 26 2HB SER 26 -10.373 7.699 -1.560
178 HG SER 26 HG SER 26 -10.366 9.997 -2.255
179 H ALA 27 H ALA 27 -8.504 5.167 -1.504
180 HA ALA 27 HA ALA 27 -6.889 6.409 0.543
181 HB1 ALA 27 3HB ALA 27 -7.455 4.660 1.840
182 HB2 ALA 27 1HB ALA 27 -8.679 4.381 0.601
183 HB3 ALA 27 2HB ALA 27 -7.162 3.482 0.561
184 H LEU 28 H LEU 28 -6.424 4.205 -2.152
185 HA LEU 28 HA LEU 28 -3.657 3.702 -1.446
186 HB2 LEU 28 1HB LEU 28 -4.571 1.822 -2.398
187 HB3 LEU 28 2HB LEU 28 -5.535 2.744 -3.549
188 HG LEU 28 HG LEU 28 -3.107 3.295 -4.514
189 HD11 LEU 28 1HD1 LEU 28 -2.816 0.557 -3.285
190 HD12 LEU 28 2HD1 LEU 28 -1.933 2.006 -2.806
191 HD13 LEU 28 3HD1 LEU 28 -1.689 1.316 -4.410
192 HD21 LEU 28 3HD2 LEU 28 -4.019 0.626 -5.325
193 HD22 LEU 28 1HD2 LEU 28 -3.799 2.093 -6.279
194 HD23 LEU 28 2HD2 LEU 28 -5.269 1.871 -5.330
195 H ASN 29 H ASN 29 -5.432 5.303 -4.081
196 HA ASN 29 HA ASN 29 -3.317 6.171 -5.617
197 HB2 ASN 29 1HB ASN 29 -6.050 7.262 -5.080
198 HB3 ASN 29 2HB ASN 29 -4.915 8.234 -6.012
199 HD21 ASN 29 1HD2 ASN 29 -7.163 7.500 -7.229
200 HD22 ASN 29 2HD2 ASN 29 -6.868 6.262 -8.397
201 H SER 30 H SER 30 -4.376 7.326 -2.519
202 HA SER 30 HA SER 30 -2.711 9.710 -2.671
203 HB2 SER 30 1HB SER 30 -4.799 10.063 -1.573
204 HB3 SER 30 2HB SER 30 -4.586 8.635 -0.560
205 HG SER 30 HG SER 30 -3.189 11.095 -0.437
206 H HIS 31 H HIS 31 -2.822 6.605 -1.007
207 HA HIS 31 HA HIS 31 -0.699 7.015 0.775
208 HB2 HIS 31 1HB HIS 31 -2.016 5.120 1.196
209 HB3 HIS 31 2HB HIS 31 -1.902 4.557 -0.469
210 HD1 HIS 31 HD1 HIS 31 0.006 4.626 2.757
211 HD2 HIS 31 HD2 HIS 31 0.331 3.001 -1.053
212 HE1 HIS 31 HE1 HIS 31 1.887 2.963 2.894
213 H ARG 32 H ARG 32 -0.751 6.008 -2.595
214 HA ARG 32 HA ARG 32 1.924 5.181 -2.812
215 HB2 ARG 32 1HB ARG 32 0.093 6.382 -4.897
216 HB3 ARG 32 2HB ARG 32 1.631 5.603 -5.246
217 HG2 ARG 32 1HG ARG 32 0.682 3.541 -4.122
218 HG3 ARG 32 2HG ARG 32 -0.882 4.356 -4.182
219 HD2 ARG 32 1HD ARG 32 -0.931 3.144 -6.137
220 HD3 ARG 32 2HD ARG 32 -0.288 4.685 -6.702
221 HE ARG 32 HE ARG 32 1.156 2.169 -6.463
222 HH11 ARG 32 1HH1 ARG 32 1.246 5.590 -7.101
223 HH12 ARG 32 2HH1 ARG 32 2.780 5.533 -7.903
224 HH21 ARG 32 1HH2 ARG 32 3.177 2.080 -7.517
225 HH22 ARG 32 2HH2 ARG 32 3.878 3.536 -8.140
226 H MET 33 H MET 33 0.475 8.331 -2.708
227 HA MET 33 HA MET 33 2.512 9.836 -3.918
228 HB2 MET 33 1HB MET 33 0.574 10.599 -1.728
229 HB3 MET 33 2HB MET 33 1.584 11.740 -2.604
230 HG2 MET 33 1HG MET 33 0.410 10.574 -4.683
231 HG3 MET 33 2HG MET 33 -0.840 10.289 -3.474
232 HE1 MET 33 3HE MET 33 -2.963 12.561 -3.772
233 HE2 MET 33 1HE MET 33 -2.189 11.628 -2.490
234 HE3 MET 33 2HE MET 33 -2.216 13.389 -2.405
235 H ILE 34 H ILE 34 2.023 8.857 -0.546
236 HA ILE 34 HA ILE 34 4.062 10.249 0.679
237 HB ILE 34 HB ILE 34 3.881 8.809 2.473
238 HG12 ILE 34 1HG1 ILE 34 3.532 6.662 0.404
239 HG13 ILE 34 2HG1 ILE 34 4.724 6.773 1.694
240 HG21 ILE 34 1HG2 ILE 34 1.606 8.414 2.790
241 HG22 ILE 34 2HG2 ILE 34 1.644 9.686 1.571
242 HG23 ILE 34 3HG2 ILE 34 1.342 8.016 1.092
243 HD11 ILE 34 3HD1 ILE 34 3.036 6.260 3.341
244 HD12 ILE 34 1HD1 ILE 34 1.790 6.243 2.093
245 HD13 ILE 34 2HD1 ILE 34 3.061 5.019 2.088
246 H HIS 35 H HIS 35 4.269 7.542 -1.478
247 HA HIS 35 HA HIS 35 7.021 6.943 -0.811
248 HB2 HIS 35 1HB HIS 35 5.260 5.918 -3.047
249 HB3 HIS 35 2HB HIS 35 6.866 5.307 -2.660
250 HD1 HIS 35 HD1 HIS 35 6.730 4.937 0.323
251 HD2 HIS 35 HD2 HIS 35 3.581 3.972 -2.209
252 HE1 HIS 35 HE1 HIS 35 5.352 3.248 1.577
253 H THR 36 H THR 36 5.304 8.152 -3.692
254 HA THR 36 HA THR 36 7.279 8.642 -5.441
255 HB THR 36 HB THR 36 6.050 10.471 -6.351
256 HG1 THR 36 HG1 THR 36 5.144 10.770 -3.698
257 HG21 THR 36 3HG2 THR 36 3.916 9.529 -6.613
258 HG22 THR 36 1HG2 THR 36 3.917 8.853 -4.985
259 HG23 THR 36 2HG2 THR 36 4.953 8.155 -6.230
260 H GLY 37 H GLY 37 9.074 9.851 -5.622
261 HA2 GLY 37 1HA GLY 37 9.937 11.367 -3.308
262 HA3 GLY 37 2HA GLY 37 10.896 10.998 -4.733
263 H GLU 38 H GLU 38 9.613 13.465 -3.047
264 HA GLU 38 HA GLU 38 10.015 15.339 -5.163
265 HB2 GLU 38 1HB GLU 38 7.779 16.273 -5.263
266 HB3 GLU 38 2HB GLU 38 7.731 14.572 -5.706
267 HG2 GLU 38 1HG GLU 38 7.004 14.055 -3.385
268 HG3 GLU 38 2HG GLU 38 6.901 15.789 -3.084
269 H LYS 39 H LYS 39 11.021 16.957 -4.192
270 HA LYS 39 HA LYS 39 11.024 17.324 -1.385
271 HB2 LYS 39 1HB LYS 39 12.080 18.937 -3.693
272 HB3 LYS 39 2HB LYS 39 12.186 19.536 -2.043
273 HG2 LYS 39 1HG LYS 39 13.231 16.826 -2.763
274 HG3 LYS 39 2HG LYS 39 14.194 18.280 -3.036
275 HD2 LYS 39 1HD LYS 39 12.939 17.847 -0.364
276 HD3 LYS 39 2HD LYS 39 14.393 16.939 -0.787
277 HE2 LYS 39 1HE LYS 39 15.438 19.160 -1.400
278 HE3 LYS 39 2HE LYS 39 14.045 19.926 -0.638
279 HZ1 LYS 39 3HZ LYS 39 16.225 19.438 0.702
280 HZ2 LYS 39 1HZ LYS 39 15.522 17.911 0.889
281 HZ3 LYS 39 2HZ LYS 39 14.706 19.289 1.431
282 HA PRO 40 HA PRO 40 7.466 19.850 -0.793
283 HB2 PRO 40 1HB PRO 40 8.191 21.074 1.519
284 HB3 PRO 40 2HB PRO 40 7.691 19.380 1.444
285 HG2 PRO 40 1HG PRO 40 10.450 20.537 1.544
286 HG3 PRO 40 2HG PRO 40 9.790 19.140 2.415
287 HD2 PRO 40 1HD PRO 40 11.324 18.884 0.198
288 HD3 PRO 40 2HD PRO 40 10.029 17.738 0.601
289 H SER 41 H SER 41 6.788 22.082 -0.658
290 HA SER 41 HA SER 41 7.879 23.803 -2.437
291 HB2 SER 41 1HB SER 41 5.739 24.330 -1.549
292 HB3 SER 41 2HB SER 41 6.360 24.411 0.100
293 HG SER 41 HG SER 41 6.541 26.276 -1.972
294 H GLY 42 H GLY 42 8.683 23.631 1.015
295 HA2 GLY 42 1HA GLY 42 11.337 24.609 0.506
296 HA3 GLY 42 2HA GLY 42 10.328 25.788 1.330
297 HA PRO 43 HA PRO 43 11.111 21.917 4.193
298 HB2 PRO 43 1HB PRO 43 13.526 20.758 3.750
299 HB3 PRO 43 2HB PRO 43 12.038 20.207 2.969
300 HG2 PRO 43 1HG PRO 43 14.200 21.976 1.892
301 HG3 PRO 43 2HG PRO 43 13.342 20.645 1.094
302 HD2 PRO 43 1HD PRO 43 12.719 23.245 0.665
303 HD3 PRO 43 2HD PRO 43 11.505 21.951 0.613
304 H SER 44 H SER 44 11.326 23.587 5.692
305 HA SER 44 HA SER 44 13.579 25.234 5.989
306 HB2 SER 44 1HB SER 44 11.289 24.466 7.757
307 HB3 SER 44 2HB SER 44 12.649 25.345 8.455
308 HG SER 44 HG SER 44 10.803 26.591 7.517
309 H SER 45 H SER 45 14.995 25.244 7.969
310 HA SER 45 HA SER 45 16.506 22.850 8.047
311 HB2 SER 45 1HB SER 45 16.639 25.503 9.399
312 HB3 SER 45 2HB SER 45 17.542 24.171 10.120
313 HG SER 45 HG SER 45 18.857 25.203 8.636
314 H GLY 46 H GLY 46 16.251 21.092 9.255
315 HA2 GLY 46 1HA GLY 46 15.792 20.843 11.913
316 HA3 GLY 46 2HA GLY 46 14.171 21.005 11.255
Start of MODEL 12
1 H1 GLY 1 H GLY 1 6.021 -25.677 4.753
2 HA2 GLY 1 1HA GLY 1 6.622 -23.305 4.962
3 HA3 GLY 1 2HA GLY 1 5.988 -23.083 3.338
4 H SER 2 H SER 2 5.243 -21.688 5.775
5 HA SER 2 HA SER 2 2.635 -22.681 6.518
6 HB2 SER 2 1HB SER 2 4.250 -21.415 8.050
7 HB3 SER 2 2HB SER 2 3.757 -19.960 7.184
8 HG SER 2 HG SER 2 2.234 -21.644 8.847
9 H SER 3 H SER 3 2.715 -22.314 3.798
10 HA SER 3 HA SER 3 0.567 -20.427 3.436
11 HB2 SER 3 1HB SER 3 1.600 -19.014 1.819
12 HB3 SER 3 2HB SER 3 2.711 -19.079 3.187
13 HG SER 3 HG SER 3 4.110 -20.193 2.023
14 H GLY 4 H GLY 4 -0.587 -20.743 1.492
15 HA2 GLY 4 1HA GLY 4 0.308 -22.646 -0.468
16 HA3 GLY 4 2HA GLY 4 -0.922 -23.303 0.602
17 H SER 5 H SER 5 -3.029 -22.746 0.317
18 HA SER 5 HA SER 5 -3.742 -21.583 -2.193
19 HB2 SER 5 1HB SER 5 -6.099 -21.884 -1.322
20 HB3 SER 5 2HB SER 5 -5.126 -23.354 -1.371
21 HG SER 5 HG SER 5 -6.401 -22.747 0.641
22 H SER 6 H SER 6 -4.487 -19.586 -2.661
23 HA SER 6 HA SER 6 -5.570 -17.768 -0.800
24 HB2 SER 6 1HB SER 6 -2.623 -17.634 -1.270
25 HB3 SER 6 2HB SER 6 -3.516 -16.121 -1.121
26 HG SER 6 HG SER 6 -3.028 -16.585 0.929
27 H GLY 7 H GLY 7 -6.510 -16.046 -1.818
28 HA2 GLY 7 1HA GLY 7 -6.694 -16.169 -4.671
29 HA3 GLY 7 2HA GLY 7 -7.473 -14.989 -3.627
30 H THR 8 H THR 8 -6.409 -14.285 -6.086
31 HA THR 8 HA THR 8 -3.859 -13.430 -6.354
32 HB THR 8 HB THR 8 -4.725 -11.444 -7.603
33 HG1 THR 8 HG1 THR 8 -7.344 -12.298 -7.392
34 HG21 THR 8 3HG2 THR 8 -4.666 -13.949 -8.409
35 HG22 THR 8 1HG2 THR 8 -5.419 -12.702 -9.401
36 HG23 THR 8 2HG2 THR 8 -6.420 -13.763 -8.410
37 H ALA 9 H ALA 9 -6.389 -11.376 -4.893
38 HA ALA 9 HA ALA 9 -4.630 -10.501 -2.805
39 HB1 ALA 9 3HB ALA 9 -3.669 -8.831 -3.932
40 HB2 ALA 9 1HB ALA 9 -4.827 -8.943 -5.258
41 HB3 ALA 9 2HB ALA 9 -5.228 -8.015 -3.812
42 H GLU 10 H GLU 10 -5.899 -10.295 -1.090
43 HA GLU 10 HA GLU 10 -8.577 -10.523 -0.919
44 HB2 GLU 10 1HB GLU 10 -6.717 -10.141 0.921
45 HB3 GLU 10 2HB GLU 10 -7.327 -8.493 0.878
46 HG2 GLU 10 1HG GLU 10 -9.650 -9.710 1.119
47 HG3 GLU 10 2HG GLU 10 -8.646 -10.982 1.811
48 H LYS 11 H LYS 11 -6.820 -7.600 -1.733
49 HA LYS 11 HA LYS 11 -9.393 -6.290 -2.319
50 HB2 LYS 11 1HB LYS 11 -6.866 -4.928 -1.370
51 HB3 LYS 11 2HB LYS 11 -8.399 -4.143 -1.728
52 HG2 LYS 11 1HG LYS 11 -7.849 -6.094 0.498
53 HG3 LYS 11 2HG LYS 11 -8.143 -4.360 0.650
54 HD2 LYS 11 1HD LYS 11 -10.068 -6.536 -0.104
55 HD3 LYS 11 2HD LYS 11 -10.193 -5.352 1.199
56 HE2 LYS 11 1HE LYS 11 -10.110 -3.671 -0.862
57 HE3 LYS 11 2HE LYS 11 -10.778 -5.072 -1.697
58 HZ1 LYS 11 3HZ LYS 11 -12.014 -3.319 0.220
59 HZ2 LYS 11 1HZ LYS 11 -12.255 -4.959 0.560
60 HZ3 LYS 11 2HZ LYS 11 -12.724 -4.328 -0.938
61 HA PRO 12 HA PRO 12 -7.967 -5.747 -6.438
62 HB2 PRO 12 1HB PRO 12 -9.247 -3.451 -7.114
63 HB3 PRO 12 2HB PRO 12 -10.082 -4.999 -6.935
64 HG2 PRO 12 1HG PRO 12 -9.873 -2.724 -5.000
65 HG3 PRO 12 2HG PRO 12 -11.286 -3.711 -5.419
66 HD2 PRO 12 1HD PRO 12 -9.834 -4.123 -3.170
67 HD3 PRO 12 2HD PRO 12 -10.640 -5.443 -4.043
68 H PHE 13 H PHE 13 -7.657 -3.036 -4.209
69 HA PHE 13 HA PHE 13 -5.639 -1.771 -5.884
70 HB2 PHE 13 1HB PHE 13 -6.540 -0.878 -3.146
71 HB3 PHE 13 2HB PHE 13 -5.758 0.086 -4.395
72 HD1 PHE 13 HD2 PHE 13 -8.895 -1.431 -3.285
73 HD2 PHE 13 HD1 PHE 13 -7.009 0.957 -6.261
74 HE1 PHE 13 HE2 PHE 13 -11.102 -0.727 -4.114
75 HE2 PHE 13 HE1 PHE 13 -9.212 1.667 -7.093
76 HZ PHE 13 HZ PHE 13 -11.263 0.824 -6.020
77 H ARG 14 H ARG 14 -3.488 -1.716 -5.457
78 HA ARG 14 HA ARG 14 -2.458 -2.691 -2.927
79 HB2 ARG 14 1HB ARG 14 -2.841 -4.690 -4.482
80 HB3 ARG 14 2HB ARG 14 -1.534 -4.036 -5.459
81 HG2 ARG 14 1HG ARG 14 0.015 -4.264 -3.634
82 HG3 ARG 14 2HG ARG 14 -1.283 -4.769 -2.551
83 HD2 ARG 14 1HD ARG 14 -0.856 -6.308 -5.060
84 HD3 ARG 14 2HD ARG 14 0.296 -6.523 -3.743
85 HE ARG 14 HE ARG 14 -2.470 -7.373 -3.802
86 HH11 ARG 14 1HH1 ARG 14 0.353 -6.750 -1.862
87 HH12 ARG 14 2HH1 ARG 14 -0.164 -7.760 -0.552
88 HH21 ARG 14 1HH2 ARG 14 -3.161 -8.706 -2.085
89 HH22 ARG 14 2HH2 ARG 14 -2.163 -8.872 -0.680
90 H CYS 15 H CYS 15 -0.541 -1.780 -2.408
91 HA CYS 15 HA CYS 15 0.506 0.230 -4.218
92 HB2 CYS 15 1HB CYS 15 0.189 0.806 -1.863
93 HB3 CYS 15 2HB CYS 15 1.282 -0.488 -1.383
94 H ASP 16 H ASP 16 2.075 -0.186 -5.610
95 HA ASP 16 HA ASP 16 3.672 -2.586 -5.363
96 HB2 ASP 16 1HB ASP 16 2.693 -1.668 -7.541
97 HB3 ASP 16 2HB ASP 16 3.967 -0.453 -7.474
98 H THR 17 H THR 17 4.147 -0.778 -3.282
99 HA THR 17 HA THR 17 6.952 -0.075 -3.822
100 HB THR 17 HB THR 17 5.117 1.610 -2.112
101 HG1 THR 17 HG1 THR 17 4.780 1.576 -4.532
102 HG21 THR 17 3HG2 THR 17 7.491 1.709 -1.511
103 HG22 THR 17 1HG2 THR 17 6.946 3.233 -2.209
104 HG23 THR 17 2HG2 THR 17 7.899 2.109 -3.179
105 H CYS 18 H CYS 18 4.574 -0.348 -1.173
106 HA CYS 18 HA CYS 18 6.669 -1.633 0.450
107 HB2 CYS 18 1HB CYS 18 5.303 -0.943 2.416
108 HB3 CYS 18 2HB CYS 18 5.897 0.418 1.469
109 H ASP 19 H ASP 19 4.384 -2.572 -1.516
110 HA ASP 19 HA ASP 19 3.132 -4.455 -1.766
111 HB2 ASP 19 1HB ASP 19 4.941 -5.191 0.496
112 HB3 ASP 19 2HB ASP 19 3.590 -6.257 0.116
113 H LYS 20 H LYS 20 1.927 -2.280 -0.514
114 HA LYS 20 HA LYS 20 0.318 -3.441 1.644
115 HB2 LYS 20 1HB LYS 20 1.023 -0.681 0.810
116 HB3 LYS 20 2HB LYS 20 -0.576 -0.911 1.505
117 HG2 LYS 20 1HG LYS 20 0.612 -2.087 3.429
118 HG3 LYS 20 2HG LYS 20 2.099 -1.400 2.771
119 HD2 LYS 20 1HD LYS 20 1.428 0.785 3.208
120 HD3 LYS 20 2HD LYS 20 -0.278 0.344 3.308
121 HE2 LYS 20 1HE LYS 20 -0.074 -0.479 5.454
122 HE3 LYS 20 2HE LYS 20 1.651 -0.795 5.281
123 HZ1 LYS 20 3HZ LYS 20 2.188 1.360 5.741
124 HZ2 LYS 20 1HZ LYS 20 0.789 1.216 6.682
125 HZ3 LYS 20 2HZ LYS 20 0.720 1.983 5.176
126 H SER 21 H SER 21 -2.055 -2.495 1.563
127 HA SER 21 HA SER 21 -3.172 -2.406 -1.105
128 HB2 SER 21 1HB SER 21 -4.777 -4.314 -0.523
129 HB3 SER 21 2HB SER 21 -3.125 -4.769 -0.937
130 HG SER 21 HG SER 21 -2.691 -4.924 1.303
131 H PHE 22 H PHE 22 -5.270 -1.587 -1.169
132 HA PHE 22 HA PHE 22 -6.448 -0.802 1.406
133 HB2 PHE 22 1HB PHE 22 -6.153 1.003 -1.005
134 HB3 PHE 22 2HB PHE 22 -6.979 1.418 0.494
135 HD1 PHE 22 HD2 PHE 22 -3.655 0.165 -0.650
136 HD2 PHE 22 HD1 PHE 22 -5.822 2.655 2.037
137 HE1 PHE 22 HE2 PHE 22 -1.536 1.001 0.279
138 HE2 PHE 22 HE1 PHE 22 -3.706 3.496 2.970
139 HZ PHE 22 HZ PHE 22 -1.559 2.668 2.092
140 H ARG 23 H ARG 23 -8.729 0.207 0.929
141 HA ARG 23 HA ARG 23 -10.102 -1.684 -0.857
142 HB2 ARG 23 1HB ARG 23 -11.308 -0.108 1.420
143 HB3 ARG 23 2HB ARG 23 -12.046 -1.437 0.535
144 HG2 ARG 23 1HG ARG 23 -10.124 -2.864 1.414
145 HG3 ARG 23 2HG ARG 23 -9.812 -1.532 2.530
146 HD2 ARG 23 1HD ARG 23 -12.532 -2.774 2.264
147 HD3 ARG 23 2HD ARG 23 -11.308 -3.446 3.340
148 HE ARG 23 HE ARG 23 -11.714 -0.647 3.756
149 HH11 ARG 23 1HH1 ARG 23 -12.955 -3.817 4.485
150 HH12 ARG 23 2HH1 ARG 23 -13.713 -3.324 5.962
151 HH21 ARG 23 1HH2 ARG 23 -12.708 0.015 5.700
152 HH22 ARG 23 2HH2 ARG 23 -13.573 -1.144 6.652
153 H GLN 24 H GLN 24 -9.812 1.705 0.020
154 HA GLN 24 HA GLN 24 -11.680 2.437 -2.119
155 HB2 GLN 24 1HB GLN 24 -10.423 4.340 -0.157
156 HB3 GLN 24 2HB GLN 24 -11.892 4.556 -1.099
157 HG2 GLN 24 1HG GLN 24 -12.997 2.829 0.229
158 HG3 GLN 24 2HG GLN 24 -11.525 2.620 1.177
159 HE21 GLN 24 1HE2 GLN 24 -11.068 4.024 2.791
160 HE22 GLN 24 2HE2 GLN 24 -12.104 5.321 3.268
161 H ARG 25 H ARG 25 -10.985 3.242 -3.992
162 HA ARG 25 HA ARG 25 -8.336 3.207 -4.790
163 HB2 ARG 25 1HB ARG 25 -10.435 3.322 -6.236
164 HB3 ARG 25 2HB ARG 25 -10.393 5.061 -5.978
165 HG2 ARG 25 1HG ARG 25 -8.159 5.145 -6.986
166 HG3 ARG 25 2HG ARG 25 -8.238 3.406 -7.274
167 HD2 ARG 25 1HD ARG 25 -10.222 3.747 -8.683
168 HD3 ARG 25 2HD ARG 25 -10.103 5.485 -8.413
169 HE ARG 25 HE ARG 25 -7.680 4.872 -9.422
170 HH11 ARG 25 1HH1 ARG 25 -10.926 4.175 -10.468
171 HH12 ARG 25 2HH1 ARG 25 -10.517 4.150 -12.152
172 HH21 ARG 25 1HH2 ARG 25 -7.129 4.842 -11.635
173 HH22 ARG 25 2HH2 ARG 25 -8.357 4.529 -12.814
174 H SER 26 H SER 26 -10.152 5.741 -3.220
175 HA SER 26 HA SER 26 -8.256 7.821 -3.726
176 HB2 SER 26 1HB SER 26 -10.736 8.098 -3.144
177 HB3 SER 26 2HB SER 26 -10.264 7.791 -1.473
178 HG SER 26 HG SER 26 -10.257 10.009 -1.875
179 H ALA 27 H ALA 27 -8.442 5.227 -1.508
180 HA ALA 27 HA ALA 27 -6.759 6.446 0.503
181 HB1 ALA 27 3HB ALA 27 -7.077 3.530 0.556
182 HB2 ALA 27 1HB ALA 27 -7.347 4.728 1.822
183 HB3 ALA 27 2HB ALA 27 -8.586 4.442 0.600
184 H LEU 28 H LEU 28 -6.411 4.245 -2.208
185 HA LEU 28 HA LEU 28 -3.638 3.677 -1.570
186 HB2 LEU 28 1HB LEU 28 -4.641 1.817 -2.488
187 HB3 LEU 28 2HB LEU 28 -5.582 2.765 -3.639
188 HG LEU 28 HG LEU 28 -3.144 3.228 -4.624
189 HD11 LEU 28 1HD1 LEU 28 -1.806 2.001 -3.160
190 HD12 LEU 28 2HD1 LEU 28 -1.987 0.942 -4.558
191 HD13 LEU 28 3HD1 LEU 28 -2.941 0.652 -3.103
192 HD21 LEU 28 3HD2 LEU 28 -5.367 1.822 -5.384
193 HD22 LEU 28 1HD2 LEU 28 -4.102 0.595 -5.447
194 HD23 LEU 28 2HD2 LEU 28 -3.932 2.084 -6.377
195 H ASN 29 H ASN 29 -5.469 5.386 -4.084
196 HA ASN 29 HA ASN 29 -3.341 6.191 -5.683
197 HB2 ASN 29 1HB ASN 29 -6.087 7.244 -5.168
198 HB3 ASN 29 2HB ASN 29 -4.961 8.260 -6.064
199 HD21 ASN 29 1HD2 ASN 29 -7.263 7.366 -7.224
200 HD22 ASN 29 2HD2 ASN 29 -6.889 6.210 -8.452
201 H SER 30 H SER 30 -4.354 7.327 -2.576
202 HA SER 30 HA SER 30 -2.680 9.714 -2.759
203 HB2 SER 30 1HB SER 30 -4.941 9.866 -1.724
204 HB3 SER 30 2HB SER 30 -4.402 8.765 -0.457
205 HG SER 30 HG SER 30 -3.908 11.439 -0.784
206 H HIS 31 H HIS 31 -2.803 6.581 -1.207
207 HA HIS 31 HA HIS 31 -0.746 6.999 0.682
208 HB2 HIS 31 1HB HIS 31 -2.084 5.121 1.091
209 HB3 HIS 31 2HB HIS 31 -1.962 4.554 -0.572
210 HD1 HIS 31 HD1 HIS 31 -0.040 4.647 2.656
211 HD2 HIS 31 HD2 HIS 31 0.206 2.913 -1.112
212 HE1 HIS 31 HE1 HIS 31 1.802 2.943 2.819
213 H ARG 32 H ARG 32 -0.735 5.917 -2.672
214 HA ARG 32 HA ARG 32 1.943 5.092 -2.817
215 HB2 ARG 32 1HB ARG 32 0.149 6.238 -4.962
216 HB3 ARG 32 2HB ARG 32 1.699 5.467 -5.267
217 HG2 ARG 32 1HG ARG 32 0.655 3.460 -3.991
218 HG3 ARG 32 2HG ARG 32 -0.874 4.252 -4.374
219 HD2 ARG 32 1HD ARG 32 -0.529 2.762 -6.145
220 HD3 ARG 32 2HD ARG 32 -0.027 4.328 -6.782
221 HE ARG 32 HE ARG 32 2.140 2.842 -5.644
222 HH11 ARG 32 1HH1 ARG 32 0.189 3.277 -8.495
223 HH12 ARG 32 2HH1 ARG 32 1.403 2.677 -9.576
224 HH21 ARG 32 1HH2 ARG 32 3.746 2.050 -7.057
225 HH22 ARG 32 2HH2 ARG 32 3.425 1.979 -8.757
226 H MET 33 H MET 33 0.497 8.243 -2.803
227 HA MET 33 HA MET 33 2.559 9.719 -4.010
228 HB2 MET 33 1HB MET 33 0.627 10.575 -1.847
229 HB3 MET 33 2HB MET 33 1.596 11.660 -2.836
230 HG2 MET 33 1HG MET 33 0.423 10.571 -4.835
231 HG3 MET 33 2HG MET 33 -0.720 9.948 -3.648
232 HE1 MET 33 3HE MET 33 -3.027 12.689 -4.898
233 HE2 MET 33 1HE MET 33 -1.973 11.735 -5.941
234 HE3 MET 33 2HE MET 33 -2.761 10.979 -4.557
235 H ILE 34 H ILE 34 1.988 8.843 -0.621
236 HA ILE 34 HA ILE 34 4.001 10.255 0.614
237 HB ILE 34 HB ILE 34 3.787 8.853 2.435
238 HG12 ILE 34 1HG1 ILE 34 3.483 6.663 0.404
239 HG13 ILE 34 2HG1 ILE 34 4.644 6.800 1.720
240 HG21 ILE 34 1HG2 ILE 34 1.564 9.704 1.443
241 HG22 ILE 34 2HG2 ILE 34 1.276 8.013 1.037
242 HG23 ILE 34 3HG2 ILE 34 1.509 8.488 2.719
243 HD11 ILE 34 3HD1 ILE 34 1.700 6.315 2.094
244 HD12 ILE 34 1HD1 ILE 34 2.932 5.055 2.070
245 HD13 ILE 34 2HD1 ILE 34 2.951 6.284 3.335
246 H HIS 35 H HIS 35 4.259 7.486 -1.463
247 HA HIS 35 HA HIS 35 7.008 6.938 -0.731
248 HB2 HIS 35 1HB HIS 35 5.290 5.798 -2.945
249 HB3 HIS 35 2HB HIS 35 6.893 5.219 -2.503
250 HD1 HIS 35 HD1 HIS 35 6.726 4.953 0.477
251 HD2 HIS 35 HD2 HIS 35 3.589 3.906 -2.038
252 HE1 HIS 35 HE1 HIS 35 5.333 3.318 1.785
253 H THR 36 H THR 36 6.859 9.534 -1.476
254 HA THR 36 HA THR 36 8.428 9.537 -3.945
255 HB THR 36 HB THR 36 7.280 11.477 -4.849
256 HG1 THR 36 HG1 THR 36 6.298 12.627 -3.348
257 HG21 THR 36 3HG2 THR 36 5.187 9.426 -4.143
258 HG22 THR 36 1HG2 THR 36 6.451 9.143 -5.339
259 HG23 THR 36 2HG2 THR 36 5.273 10.432 -5.589
260 H GLY 37 H GLY 37 9.345 11.865 -4.285
261 HA2 GLY 37 1HA GLY 37 9.765 13.902 -2.741
262 HA3 GLY 37 2HA GLY 37 10.457 12.678 -1.687
263 H GLU 38 H GLU 38 12.586 13.038 -1.704
264 HA GLU 38 HA GLU 38 13.942 13.839 -4.134
265 HB2 GLU 38 1HB GLU 38 14.722 13.538 -1.263
266 HB3 GLU 38 2HB GLU 38 15.981 13.569 -2.490
267 HG2 GLU 38 1HG GLU 38 15.018 15.733 -3.296
268 HG3 GLU 38 2HG GLU 38 13.964 15.712 -1.884
269 H LYS 39 H LYS 39 13.240 11.751 -5.168
270 HA LYS 39 HA LYS 39 15.410 9.812 -4.894
271 HB2 LYS 39 1HB LYS 39 12.471 9.177 -4.709
272 HB3 LYS 39 2HB LYS 39 13.652 7.968 -5.193
273 HG2 LYS 39 1HG LYS 39 14.736 8.049 -3.094
274 HG3 LYS 39 2HG LYS 39 13.857 9.504 -2.619
275 HD2 LYS 39 1HD LYS 39 11.749 8.182 -2.710
276 HD3 LYS 39 2HD LYS 39 12.717 6.739 -3.017
277 HE2 LYS 39 1HE LYS 39 12.261 6.757 -0.695
278 HE3 LYS 39 2HE LYS 39 13.943 7.252 -0.874
279 HZ1 LYS 39 3HZ LYS 39 13.510 9.306 -0.109
280 HZ2 LYS 39 1HZ LYS 39 12.168 8.567 0.607
281 HZ3 LYS 39 2HZ LYS 39 11.994 9.401 -0.853
282 HA PRO 40 HA PRO 40 15.330 10.225 -9.294
283 HB2 PRO 40 1HB PRO 40 16.991 8.158 -9.877
284 HB3 PRO 40 2HB PRO 40 17.565 9.696 -9.221
285 HG2 PRO 40 1HG PRO 40 17.041 7.111 -7.805
286 HG3 PRO 40 2HG PRO 40 18.400 8.235 -7.617
287 HD2 PRO 40 1HD PRO 40 16.316 8.167 -5.889
288 HD3 PRO 40 2HD PRO 40 17.196 9.662 -6.265
289 H SER 41 H SER 41 13.024 9.552 -9.275
290 HA SER 41 HA SER 41 12.702 7.126 -10.811
291 HB2 SER 41 1HB SER 41 11.513 7.433 -8.058
292 HB3 SER 41 2HB SER 41 10.790 6.374 -9.268
293 HG SER 41 HG SER 41 13.525 6.115 -8.840
294 H GLY 42 H GLY 42 10.222 6.840 -11.283
295 HA2 GLY 42 1HA GLY 42 8.311 8.755 -11.136
296 HA3 GLY 42 2HA GLY 42 9.364 9.358 -12.408
297 HA PRO 43 HA PRO 43 7.644 5.170 -14.084
298 HB2 PRO 43 1HB PRO 43 5.800 3.888 -12.559
299 HB3 PRO 43 2HB PRO 43 7.538 3.598 -12.412
300 HG2 PRO 43 1HG PRO 43 5.756 5.318 -10.730
301 HG3 PRO 43 2HG PRO 43 7.042 4.207 -10.223
302 HD2 PRO 43 1HD PRO 43 7.405 6.887 -10.371
303 HD3 PRO 43 2HD PRO 43 8.711 5.728 -10.690
304 H SER 44 H SER 44 5.489 7.194 -12.170
305 HA SER 44 HA SER 44 3.352 7.946 -12.551
306 HB2 SER 44 1HB SER 44 4.678 8.359 -15.239
307 HB3 SER 44 2HB SER 44 3.142 9.090 -14.773
308 HG SER 44 HG SER 44 4.219 10.546 -13.726
309 H SER 45 H SER 45 3.415 5.173 -12.705
310 HA SER 45 HA SER 45 2.146 4.245 -15.099
311 HB2 SER 45 1HB SER 45 3.565 2.855 -13.493
312 HB3 SER 45 2HB SER 45 2.155 2.825 -12.435
313 HG SER 45 HG SER 45 1.767 2.131 -15.104
314 H GLY 46 H GLY 46 0.006 3.800 -15.476
315 HA2 GLY 46 1HA GLY 46 -2.007 3.907 -13.466
316 HA3 GLY 46 2HA GLY 46 -1.946 5.416 -14.366
Start of MODEL 13
1 H1 GLY 1 H GLY 1 5.916 -30.844 -11.401
2 HA2 GLY 1 1HA GLY 1 2.968 -30.847 -11.604
3 HA3 GLY 1 2HA GLY 1 3.845 -30.780 -10.082
4 H SER 2 H SER 2 2.478 -28.890 -9.691
5 HA SER 2 HA SER 2 3.889 -26.477 -10.315
6 HB2 SER 2 1HB SER 2 2.169 -25.316 -11.518
7 HB3 SER 2 2HB SER 2 2.450 -26.841 -12.358
8 HG SER 2 HG SER 2 0.169 -26.072 -11.765
9 H SER 3 H SER 3 3.353 -24.779 -8.946
10 HA SER 3 HA SER 3 1.060 -24.911 -7.217
11 HB2 SER 3 1HB SER 3 3.798 -25.209 -5.961
12 HB3 SER 3 2HB SER 3 2.253 -25.126 -5.114
13 HG SER 3 HG SER 3 2.010 -27.177 -5.453
14 H GLY 4 H GLY 4 1.252 -23.117 -5.479
15 HA2 GLY 4 1HA GLY 4 2.201 -20.987 -4.883
16 HA3 GLY 4 2HA GLY 4 2.821 -20.853 -6.522
17 H SER 5 H SER 5 -0.209 -20.979 -4.676
18 HA SER 5 HA SER 5 -1.419 -19.245 -6.729
19 HB2 SER 5 1HB SER 5 -3.587 -20.174 -6.126
20 HB3 SER 5 2HB SER 5 -2.479 -21.484 -6.537
21 HG SER 5 HG SER 5 -2.602 -20.711 -3.865
22 H SER 6 H SER 6 0.155 -18.151 -4.708
23 HA SER 6 HA SER 6 -1.878 -16.669 -3.191
24 HB2 SER 6 1HB SER 6 0.726 -17.750 -2.092
25 HB3 SER 6 2HB SER 6 -0.308 -16.599 -1.247
26 HG SER 6 HG SER 6 -1.893 -18.136 -1.103
27 H GLY 7 H GLY 7 -1.788 -14.795 -4.320
28 HA2 GLY 7 1HA GLY 7 0.599 -13.185 -4.014
29 HA3 GLY 7 2HA GLY 7 0.204 -13.588 -5.678
30 H THR 8 H THR 8 -2.517 -13.416 -5.715
31 HA THR 8 HA THR 8 -2.945 -10.646 -5.947
32 HB THR 8 HB THR 8 -4.221 -12.248 -7.276
33 HG1 THR 8 HG1 THR 8 -6.137 -10.986 -5.629
34 HG21 THR 8 3HG2 THR 8 -4.606 -13.547 -4.818
35 HG22 THR 8 1HG2 THR 8 -5.237 -14.025 -6.393
36 HG23 THR 8 2HG2 THR 8 -6.202 -12.999 -5.331
37 H ALA 9 H ALA 9 -3.764 -9.146 -4.601
38 HA ALA 9 HA ALA 9 -4.063 -9.835 -1.813
39 HB1 ALA 9 3HB ALA 9 -4.791 -7.135 -2.269
40 HB2 ALA 9 1HB ALA 9 -3.310 -7.767 -1.549
41 HB3 ALA 9 2HB ALA 9 -3.401 -7.499 -3.291
42 H GLU 10 H GLU 10 -5.911 -9.755 -0.593
43 HA GLU 10 HA GLU 10 -8.330 -10.471 -1.697
44 HB2 GLU 10 1HB GLU 10 -7.859 -10.783 0.660
45 HB3 GLU 10 2HB GLU 10 -7.802 -9.044 0.913
46 HG2 GLU 10 1HG GLU 10 -10.101 -8.808 0.693
47 HG3 GLU 10 2HG GLU 10 -10.277 -10.356 -0.131
48 H LYS 11 H LYS 11 -6.882 -7.390 -1.643
49 HA LYS 11 HA LYS 11 -9.442 -6.088 -2.291
50 HB2 LYS 11 1HB LYS 11 -6.828 -4.837 -1.425
51 HB3 LYS 11 2HB LYS 11 -8.317 -3.965 -1.765
52 HG2 LYS 11 1HG LYS 11 -7.641 -5.723 0.548
53 HG3 LYS 11 2HG LYS 11 -8.329 -4.098 0.534
54 HD2 LYS 11 1HD LYS 11 -9.756 -6.592 -0.387
55 HD3 LYS 11 2HD LYS 11 -9.965 -5.831 1.191
56 HE2 LYS 11 1HE LYS 11 -10.553 -3.712 -0.135
57 HE3 LYS 11 2HE LYS 11 -10.734 -4.791 -1.518
58 HZ1 LYS 11 3HZ LYS 11 -12.559 -5.801 -0.609
59 HZ2 LYS 11 1HZ LYS 11 -12.762 -4.229 -0.015
60 HZ3 LYS 11 2HZ LYS 11 -12.126 -5.436 0.986
61 HA PRO 12 HA PRO 12 -8.227 -5.538 -6.476
62 HB2 PRO 12 1HB PRO 12 -9.489 -3.207 -7.062
63 HB3 PRO 12 2HB PRO 12 -10.348 -4.738 -6.852
64 HG2 PRO 12 1HG PRO 12 -9.984 -2.488 -4.911
65 HG3 PRO 12 2HG PRO 12 -11.439 -3.439 -5.261
66 HD2 PRO 12 1HD PRO 12 -9.878 -3.907 -3.098
67 HD3 PRO 12 2HD PRO 12 -10.759 -5.200 -3.937
68 H PHE 13 H PHE 13 -7.527 -3.092 -4.109
69 HA PHE 13 HA PHE 13 -5.595 -1.821 -5.920
70 HB2 PHE 13 1HB PHE 13 -6.491 -0.829 -3.210
71 HB3 PHE 13 2HB PHE 13 -5.603 0.068 -4.438
72 HD1 PHE 13 HD1 PHE 13 -6.733 0.863 -6.455
73 HD2 PHE 13 HD2 PHE 13 -8.860 -1.109 -3.341
74 HE1 PHE 13 HE1 PHE 13 -8.855 1.696 -7.381
75 HE2 PHE 13 HE2 PHE 13 -10.985 -0.280 -4.262
76 HZ PHE 13 HZ PHE 13 -10.984 1.124 -6.285
77 H ARG 14 H ARG 14 -3.433 -1.691 -5.420
78 HA ARG 14 HA ARG 14 -2.439 -2.720 -2.905
79 HB2 ARG 14 1HB ARG 14 -2.799 -4.745 -4.330
80 HB3 ARG 14 2HB ARG 14 -1.650 -4.081 -5.484
81 HG2 ARG 14 1HG ARG 14 0.068 -4.091 -3.688
82 HG3 ARG 14 2HG ARG 14 -1.095 -4.914 -2.647
83 HD2 ARG 14 1HD ARG 14 -0.979 -6.870 -3.833
84 HD3 ARG 14 2HD ARG 14 -0.554 -6.056 -5.338
85 HE ARG 14 HE ARG 14 1.254 -6.953 -3.267
86 HH11 ARG 14 1HH1 ARG 14 0.804 -4.944 -6.074
87 HH12 ARG 14 2HH1 ARG 14 2.495 -4.851 -6.440
88 HH21 ARG 14 1HH2 ARG 14 3.483 -6.839 -3.738
89 HH22 ARG 14 2HH2 ARG 14 4.018 -5.930 -5.111
90 H CYS 15 H CYS 15 -0.515 -1.837 -2.364
91 HA CYS 15 HA CYS 15 0.573 0.168 -4.155
92 HB2 CYS 15 1HB CYS 15 0.247 0.758 -1.813
93 HB3 CYS 15 2HB CYS 15 1.289 -0.569 -1.309
94 H ASP 16 H ASP 16 2.072 -0.356 -5.590
95 HA ASP 16 HA ASP 16 3.684 -2.733 -5.275
96 HB2 ASP 16 1HB ASP 16 4.443 -2.321 -7.514
97 HB3 ASP 16 2HB ASP 16 2.711 -2.003 -7.473
98 H THR 17 H THR 17 4.208 -0.910 -3.249
99 HA THR 17 HA THR 17 6.998 -0.211 -3.853
100 HB THR 17 HB THR 17 5.206 1.535 -2.162
101 HG1 THR 17 HG1 THR 17 4.762 2.678 -3.919
102 HG21 THR 17 3HG2 THR 17 7.593 1.664 -1.638
103 HG22 THR 17 1HG2 THR 17 7.031 3.156 -2.391
104 HG23 THR 17 2HG2 THR 17 7.954 1.985 -3.333
105 H CYS 18 H CYS 18 4.641 -0.426 -1.182
106 HA CYS 18 HA CYS 18 6.748 -1.692 0.443
107 HB2 CYS 18 1HB CYS 18 5.515 -0.863 2.424
108 HB3 CYS 18 2HB CYS 18 6.071 0.444 1.383
109 H ASP 19 H ASP 19 4.541 -2.730 -1.449
110 HA ASP 19 HA ASP 19 3.151 -4.527 -1.581
111 HB2 ASP 19 1HB ASP 19 4.866 -5.276 0.778
112 HB3 ASP 19 2HB ASP 19 3.595 -6.343 0.189
113 H LYS 20 H LYS 20 1.774 -2.485 -0.706
114 HA LYS 20 HA LYS 20 0.278 -3.436 1.647
115 HB2 LYS 20 1HB LYS 20 1.030 -0.730 0.695
116 HB3 LYS 20 2HB LYS 20 -0.575 -0.896 1.395
117 HG2 LYS 20 1HG LYS 20 0.646 -2.060 3.348
118 HG3 LYS 20 2HG LYS 20 2.093 -1.301 2.680
119 HD2 LYS 20 1HD LYS 20 1.017 0.893 2.854
120 HD3 LYS 20 2HD LYS 20 -0.428 0.131 3.524
121 HE2 LYS 20 1HE LYS 20 0.623 0.777 5.452
122 HE3 LYS 20 2HE LYS 20 1.294 -0.842 5.259
123 HZ1 LYS 20 3HZ LYS 20 3.332 -0.033 4.906
124 HZ2 LYS 20 1HZ LYS 20 2.748 1.396 5.598
125 HZ3 LYS 20 2HZ LYS 20 2.788 1.227 3.916
126 H SER 21 H SER 21 -2.082 -2.490 1.554
127 HA SER 21 HA SER 21 -3.230 -2.457 -1.100
128 HB2 SER 21 1HB SER 21 -4.836 -4.354 -0.438
129 HB3 SER 21 2HB SER 21 -3.200 -4.809 -0.914
130 HG SER 21 HG SER 21 -4.398 -4.837 1.616
131 H PHE 22 H PHE 22 -5.280 -1.569 -1.161
132 HA PHE 22 HA PHE 22 -6.434 -0.750 1.418
133 HB2 PHE 22 1HB PHE 22 -6.179 0.980 -1.051
134 HB3 PHE 22 2HB PHE 22 -6.999 1.438 0.438
135 HD1 PHE 22 HD2 PHE 22 -3.674 0.173 -0.690
136 HD2 PHE 22 HD1 PHE 22 -5.841 2.725 1.940
137 HE1 PHE 22 HE2 PHE 22 -1.555 1.050 0.200
138 HE2 PHE 22 HE1 PHE 22 -3.724 3.606 2.834
139 HZ PHE 22 HZ PHE 22 -1.578 2.768 1.965
140 H ARG 23 H ARG 23 -8.734 0.167 1.031
141 HA ARG 23 HA ARG 23 -10.149 -1.799 -0.617
142 HB2 ARG 23 1HB ARG 23 -11.185 0.011 1.574
143 HB3 ARG 23 2HB ARG 23 -12.124 -1.211 0.726
144 HG2 ARG 23 1HG ARG 23 -11.585 -2.384 2.591
145 HG3 ARG 23 2HG ARG 23 -10.186 -2.785 1.593
146 HD2 ARG 23 1HD ARG 23 -9.111 -2.155 3.501
147 HD3 ARG 23 2HD ARG 23 -9.220 -0.588 2.701
148 HE ARG 23 HE ARG 23 -11.433 -1.207 4.448
149 HH11 ARG 23 1HH1 ARG 23 -8.273 0.228 4.173
150 HH12 ARG 23 2HH1 ARG 23 -8.470 1.244 5.563
151 HH21 ARG 23 1HH2 ARG 23 -11.705 0.126 6.279
152 HH22 ARG 23 2HH2 ARG 23 -10.422 1.185 6.760
153 H GLN 24 H GLN 24 -9.947 1.677 -0.007
154 HA GLN 24 HA GLN 24 -11.657 2.162 -2.344
155 HB2 GLN 24 1HB GLN 24 -10.737 4.274 -0.414
156 HB3 GLN 24 2HB GLN 24 -12.138 4.294 -1.477
157 HG2 GLN 24 1HG GLN 24 -12.026 2.206 0.625
158 HG3 GLN 24 2HG GLN 24 -12.343 3.867 1.122
159 HE21 GLN 24 1HE2 GLN 24 -13.362 1.602 -1.416
160 HE22 GLN 24 2HE2 GLN 24 -15.043 1.986 -1.320
161 H ARG 25 H ARG 25 -10.882 3.080 -4.154
162 HA ARG 25 HA ARG 25 -8.182 3.089 -4.760
163 HB2 ARG 25 1HB ARG 25 -10.136 3.167 -6.371
164 HB3 ARG 25 2HB ARG 25 -10.213 4.897 -6.067
165 HG2 ARG 25 1HG ARG 25 -7.953 5.167 -6.922
166 HG3 ARG 25 2HG ARG 25 -7.838 3.427 -7.190
167 HD2 ARG 25 1HD ARG 25 -8.363 4.395 -9.286
168 HD3 ARG 25 2HD ARG 25 -9.845 3.644 -8.698
169 HE ARG 25 HE ARG 25 -9.342 6.474 -9.052
170 HH11 ARG 25 1HH1 ARG 25 -11.366 4.018 -7.641
171 HH12 ARG 25 2HH1 ARG 25 -12.736 5.064 -7.466
172 HH21 ARG 25 1HH2 ARG 25 -11.139 7.861 -8.826
173 HH22 ARG 25 2HH2 ARG 25 -12.606 7.249 -8.141
174 H SER 26 H SER 26 -10.181 5.648 -3.425
175 HA SER 26 HA SER 26 -8.308 7.750 -3.752
176 HB2 SER 26 1HB SER 26 -10.818 7.937 -3.260
177 HB3 SER 26 2HB SER 26 -10.394 7.631 -1.576
178 HG SER 26 HG SER 26 -9.635 9.805 -3.216
179 H ALA 27 H ALA 27 -8.507 5.124 -1.569
180 HA ALA 27 HA ALA 27 -6.941 6.363 0.520
181 HB1 ALA 27 3HB ALA 27 -7.179 3.432 0.496
182 HB2 ALA 27 1HB ALA 27 -7.497 4.590 1.788
183 HB3 ALA 27 2HB ALA 27 -8.705 4.315 0.533
184 H LEU 28 H LEU 28 -6.417 4.150 -2.165
185 HA LEU 28 HA LEU 28 -3.649 3.700 -1.438
186 HB2 LEU 28 1HB LEU 28 -4.525 1.808 -2.402
187 HB3 LEU 28 2HB LEU 28 -5.489 2.718 -3.564
188 HG LEU 28 HG LEU 28 -3.053 3.304 -4.494
189 HD11 LEU 28 1HD1 LEU 28 -2.750 0.820 -2.881
190 HD12 LEU 28 2HD1 LEU 28 -1.614 2.143 -3.142
191 HD13 LEU 28 3HD1 LEU 28 -1.893 0.955 -4.416
192 HD21 LEU 28 3HD2 LEU 28 -5.195 1.821 -5.320
193 HD22 LEU 28 1HD2 LEU 28 -3.887 0.639 -5.358
194 HD23 LEU 28 2HD2 LEU 28 -3.746 2.139 -6.275
195 H ASN 29 H ASN 29 -5.430 5.312 -4.057
196 HA ASN 29 HA ASN 29 -3.318 6.201 -5.589
197 HB2 ASN 29 1HB ASN 29 -6.080 7.187 -5.079
198 HB3 ASN 29 2HB ASN 29 -4.968 8.283 -5.893
199 HD21 ASN 29 1HD2 ASN 29 -7.180 7.454 -7.194
200 HD22 ASN 29 2HD2 ASN 29 -6.761 6.355 -8.458
201 H SER 30 H SER 30 -4.385 7.320 -2.482
202 HA SER 30 HA SER 30 -2.760 9.729 -2.611
203 HB2 SER 30 1HB SER 30 -4.985 9.749 -1.489
204 HB3 SER 30 2HB SER 30 -4.355 8.622 -0.287
205 HG SER 30 HG SER 30 -3.662 10.324 0.714
206 H HIS 31 H HIS 31 -2.773 6.585 -1.024
207 HA HIS 31 HA HIS 31 -0.628 7.015 0.736
208 HB2 HIS 31 1HB HIS 31 -1.916 5.097 1.157
209 HB3 HIS 31 2HB HIS 31 -1.811 4.549 -0.514
210 HD1 HIS 31 HD1 HIS 31 0.140 4.636 2.688
211 HD2 HIS 31 HD2 HIS 31 0.436 3.029 -1.131
212 HE1 HIS 31 HE1 HIS 31 2.050 3.004 2.792
213 H ARG 32 H ARG 32 -0.732 6.018 -2.639
214 HA ARG 32 HA ARG 32 1.946 5.240 -2.922
215 HB2 ARG 32 1HB ARG 32 0.089 6.465 -4.970
216 HB3 ARG 32 2HB ARG 32 1.606 5.654 -5.337
217 HG2 ARG 32 1HG ARG 32 0.546 3.648 -4.083
218 HG3 ARG 32 2HG ARG 32 -0.973 4.495 -4.380
219 HD2 ARG 32 1HD ARG 32 -0.632 2.946 -6.167
220 HD3 ARG 32 2HD ARG 32 -0.371 4.571 -6.799
221 HE ARG 32 HE ARG 32 2.035 3.267 -5.919
222 HH11 ARG 32 1HH1 ARG 32 -0.176 3.719 -8.569
223 HH12 ARG 32 2HH1 ARG 32 0.994 3.325 -9.784
224 HH21 ARG 32 1HH2 ARG 32 3.586 2.746 -7.509
225 HH22 ARG 32 2HH2 ARG 32 3.134 2.771 -9.179
226 H MET 33 H MET 33 0.461 8.372 -2.755
227 HA MET 33 HA MET 33 2.451 9.919 -3.985
228 HB2 MET 33 1HB MET 33 0.665 10.703 -1.676
229 HB3 MET 33 2HB MET 33 1.509 11.805 -2.755
230 HG2 MET 33 1HG MET 33 0.166 10.583 -4.614
231 HG3 MET 33 2HG MET 33 -0.878 10.099 -3.280
232 HE1 MET 33 3HE MET 33 -2.903 12.982 -5.017
233 HE2 MET 33 1HE MET 33 -1.858 11.810 -5.821
234 HE3 MET 33 2HE MET 33 -2.919 11.292 -4.510
235 H ILE 34 H ILE 34 2.068 8.866 -0.624
236 HA ILE 34 HA ILE 34 4.124 10.268 0.568
237 HB ILE 34 HB ILE 34 4.014 8.794 2.345
238 HG12 ILE 34 1HG1 ILE 34 3.587 6.686 0.251
239 HG13 ILE 34 2HG1 ILE 34 4.821 6.769 1.504
240 HG21 ILE 34 1HG2 ILE 34 1.745 8.379 2.727
241 HG22 ILE 34 2HG2 ILE 34 1.755 9.700 1.560
242 HG23 ILE 34 3HG2 ILE 34 1.426 8.052 1.023
243 HD11 ILE 34 3HD1 ILE 34 3.229 6.187 3.191
244 HD12 ILE 34 1HD1 ILE 34 1.901 6.285 2.034
245 HD13 ILE 34 2HD1 ILE 34 3.117 5.016 1.877
246 H HIS 35 H HIS 35 4.292 7.576 -1.616
247 HA HIS 35 HA HIS 35 7.081 7.030 -1.041
248 HB2 HIS 35 1HB HIS 35 5.253 5.928 -3.185
249 HB3 HIS 35 2HB HIS 35 6.884 5.355 -2.848
250 HD1 HIS 35 HD1 HIS 35 6.881 5.025 0.135
251 HD2 HIS 35 HD2 HIS 35 3.634 3.982 -2.239
252 HE1 HIS 35 HE1 HIS 35 5.583 3.338 1.475
253 H THR 36 H THR 36 6.815 9.654 -1.732
254 HA THR 36 HA THR 36 8.168 9.724 -4.340
255 HB THR 36 HB THR 36 7.036 11.754 -4.986
256 HG1 THR 36 HG1 THR 36 6.313 11.773 -2.351
257 HG21 THR 36 3HG2 THR 36 5.254 9.486 -4.148
258 HG22 THR 36 1HG2 THR 36 5.844 9.890 -5.760
259 HG23 THR 36 2HG2 THR 36 4.614 10.895 -4.993
260 H GLY 37 H GLY 37 10.181 10.376 -3.956
261 HA2 GLY 37 1HA GLY 37 11.617 12.269 -3.487
262 HA3 GLY 37 2HA GLY 37 10.568 12.662 -2.132
263 H GLU 38 H GLU 38 10.968 11.788 -0.160
264 HA GLU 38 HA GLU 38 13.474 10.338 0.120
265 HB2 GLU 38 1HB GLU 38 13.201 12.194 1.605
266 HB3 GLU 38 2HB GLU 38 11.617 11.629 2.117
267 HG2 GLU 38 1HG GLU 38 13.344 11.239 3.807
268 HG3 GLU 38 2HG GLU 38 12.604 9.742 3.244
269 H LYS 39 H LYS 39 13.618 8.223 0.465
270 HA LYS 39 HA LYS 39 11.156 6.752 1.131
271 HB2 LYS 39 1HB LYS 39 12.445 4.773 0.163
272 HB3 LYS 39 2HB LYS 39 11.907 6.003 -0.973
273 HG2 LYS 39 1HG LYS 39 14.130 6.960 -1.037
274 HG3 LYS 39 2HG LYS 39 14.685 5.801 0.173
275 HD2 LYS 39 1HD LYS 39 13.515 4.955 -2.467
276 HD3 LYS 39 2HD LYS 39 15.238 5.270 -2.248
277 HE2 LYS 39 1HE LYS 39 13.658 3.314 -0.586
278 HE3 LYS 39 2HE LYS 39 14.569 2.866 -2.028
279 HZ1 LYS 39 3HZ LYS 39 15.748 4.160 0.370
280 HZ2 LYS 39 1HZ LYS 39 16.587 3.586 -0.982
281 HZ3 LYS 39 2HZ LYS 39 15.803 2.500 0.051
282 HA PRO 40 HA PRO 40 13.308 6.114 5.025
283 HB2 PRO 40 1HB PRO 40 11.178 4.993 6.281
284 HB3 PRO 40 2HB PRO 40 11.355 6.738 6.062
285 HG2 PRO 40 1HG PRO 40 9.734 4.784 4.475
286 HG3 PRO 40 2HG PRO 40 9.294 6.408 5.037
287 HD2 PRO 40 1HD PRO 40 10.089 5.911 2.496
288 HD3 PRO 40 2HD PRO 40 10.429 7.446 3.320
289 H SER 41 H SER 41 14.612 4.446 5.411
290 HA SER 41 HA SER 41 14.245 1.919 4.132
291 HB2 SER 41 1HB SER 41 16.297 1.279 5.456
292 HB3 SER 41 2HB SER 41 16.492 2.703 4.434
293 HG SER 41 HG SER 41 16.587 2.473 7.165
294 H GLY 42 H GLY 42 13.243 0.156 4.857
295 HA2 GLY 42 1HA GLY 42 11.792 0.203 7.305
296 HA3 GLY 42 2HA GLY 42 11.942 -1.168 6.216
297 HA PRO 43 HA PRO 43 14.194 -2.113 10.179
298 HB2 PRO 43 1HB PRO 43 13.014 -4.528 10.565
299 HB3 PRO 43 2HB PRO 43 12.318 -3.013 11.154
300 HG2 PRO 43 1HG PRO 43 11.635 -4.583 8.699
301 HG3 PRO 43 2HG PRO 43 10.551 -3.795 9.860
302 HD2 PRO 43 1HD PRO 43 11.175 -2.690 7.468
303 HD3 PRO 43 2HD PRO 43 10.846 -1.714 8.914
304 H SER 44 H SER 44 16.184 -2.860 9.852
305 HA SER 44 HA SER 44 16.793 -4.578 7.622
306 HB2 SER 44 1HB SER 44 18.386 -3.123 9.695
307 HB3 SER 44 2HB SER 44 19.150 -4.443 8.809
308 HG SER 44 HG SER 44 17.859 -2.916 7.063
309 H SER 45 H SER 45 17.201 -6.712 7.636
310 HA SER 45 HA SER 45 17.233 -8.873 8.348
311 HB2 SER 45 1HB SER 45 19.299 -7.817 9.535
312 HB3 SER 45 2HB SER 45 18.320 -7.955 10.995
313 HG SER 45 HG SER 45 18.774 -9.995 11.027
314 H GLY 46 H GLY 46 14.803 -7.567 8.677
315 HA2 GLY 46 1HA GLY 46 13.829 -8.439 11.310
316 HA3 GLY 46 2HA GLY 46 12.992 -7.342 10.222
Start of MODEL 14
1 H1 GLY 1 H GLY 1 14.336 -17.921 -8.022
2 HA2 GLY 1 1HA GLY 1 14.039 -20.759 -8.327
3 HA3 GLY 1 2HA GLY 1 13.307 -20.167 -6.843
4 H SER 2 H SER 2 11.222 -20.705 -7.513
5 HA SER 2 HA SER 2 9.921 -18.688 -9.086
6 HB2 SER 2 1HB SER 2 10.753 -20.221 -10.854
7 HB3 SER 2 2HB SER 2 9.856 -21.540 -10.102
8 HG SER 2 HG SER 2 8.781 -20.417 -11.886
9 H SER 3 H SER 3 7.609 -18.808 -8.964
10 HA SER 3 HA SER 3 6.209 -20.840 -7.609
11 HB2 SER 3 1HB SER 3 7.373 -20.150 -5.617
12 HB3 SER 3 2HB SER 3 7.009 -18.453 -5.931
13 HG SER 3 HG SER 3 5.008 -18.733 -5.240
14 H GLY 4 H GLY 4 4.345 -20.666 -8.659
15 HA2 GLY 4 1HA GLY 4 3.414 -18.212 -9.780
16 HA3 GLY 4 2HA GLY 4 2.543 -19.739 -9.753
17 H SER 5 H SER 5 0.905 -17.796 -9.445
18 HA SER 5 HA SER 5 0.109 -17.934 -6.662
19 HB2 SER 5 1HB SER 5 0.477 -15.241 -7.995
20 HB3 SER 5 2HB SER 5 -0.109 -15.532 -6.357
21 HG SER 5 HG SER 5 1.935 -15.318 -5.882
22 H SER 6 H SER 6 -2.051 -18.024 -6.455
23 HA SER 6 HA SER 6 -3.666 -17.412 -8.844
24 HB2 SER 6 1HB SER 6 -5.253 -19.149 -8.002
25 HB3 SER 6 2HB SER 6 -3.666 -19.796 -8.417
26 HG SER 6 HG SER 6 -4.776 -19.327 -5.865
27 H GLY 7 H GLY 7 -3.576 -17.358 -5.308
28 HA2 GLY 7 1HA GLY 7 -6.078 -15.955 -5.079
29 HA3 GLY 7 2HA GLY 7 -4.938 -16.277 -3.781
30 H THR 8 H THR 8 -6.227 -13.934 -5.824
31 HA THR 8 HA THR 8 -3.991 -12.124 -5.799
32 HB THR 8 HB THR 8 -5.617 -10.465 -6.694
33 HG1 THR 8 HG1 THR 8 -7.502 -12.577 -6.803
34 HG21 THR 8 3HG2 THR 8 -5.120 -11.294 -8.701
35 HG22 THR 8 1HG2 THR 8 -6.292 -12.594 -8.495
36 HG23 THR 8 2HG2 THR 8 -4.637 -12.801 -7.923
37 H ALA 9 H ALA 9 -4.005 -10.032 -4.762
38 HA ALA 9 HA ALA 9 -4.272 -10.017 -2.064
39 HB1 ALA 9 3HB ALA 9 -3.904 -8.027 -4.097
40 HB2 ALA 9 1HB ALA 9 -4.927 -7.394 -2.807
41 HB3 ALA 9 2HB ALA 9 -3.330 -8.041 -2.429
42 H GLU 10 H GLU 10 -5.869 -9.981 -0.615
43 HA GLU 10 HA GLU 10 -8.479 -10.510 -1.102
44 HB2 GLU 10 1HB GLU 10 -7.369 -10.465 1.143
45 HB3 GLU 10 2HB GLU 10 -7.552 -8.717 1.146
46 HG2 GLU 10 1HG GLU 10 -9.888 -8.849 1.280
47 HG3 GLU 10 2HG GLU 10 -9.900 -10.552 0.827
48 H LYS 11 H LYS 11 -6.895 -7.475 -1.520
49 HA LYS 11 HA LYS 11 -9.486 -6.196 -2.105
50 HB2 LYS 11 1HB LYS 11 -6.897 -4.827 -1.356
51 HB3 LYS 11 2HB LYS 11 -8.460 -4.056 -1.596
52 HG2 LYS 11 1HG LYS 11 -7.610 -5.875 0.635
53 HG3 LYS 11 2HG LYS 11 -8.149 -4.197 0.730
54 HD2 LYS 11 1HD LYS 11 -9.820 -6.602 0.007
55 HD3 LYS 11 2HD LYS 11 -9.923 -5.644 1.486
56 HE2 LYS 11 1HE LYS 11 -10.434 -3.663 -0.034
57 HE3 LYS 11 2HE LYS 11 -10.672 -4.850 -1.316
58 HZ1 LYS 11 3HZ LYS 11 -12.661 -4.048 0.146
59 HZ2 LYS 11 1HZ LYS 11 -12.089 -5.218 1.226
60 HZ3 LYS 11 2HZ LYS 11 -12.552 -5.665 -0.338
61 HA PRO 12 HA PRO 12 -8.299 -5.738 -6.308
62 HB2 PRO 12 1HB PRO 12 -9.557 -3.418 -6.944
63 HB3 PRO 12 2HB PRO 12 -10.419 -4.940 -6.689
64 HG2 PRO 12 1HG PRO 12 -10.035 -2.643 -4.808
65 HG3 PRO 12 2HG PRO 12 -11.496 -3.597 -5.125
66 HD2 PRO 12 1HD PRO 12 -9.922 -4.016 -2.961
67 HD3 PRO 12 2HD PRO 12 -10.813 -5.326 -3.762
68 H PHE 13 H PHE 13 -7.729 -3.063 -4.104
69 HA PHE 13 HA PHE 13 -5.773 -1.886 -5.930
70 HB2 PHE 13 1HB PHE 13 -6.610 -0.869 -3.211
71 HB3 PHE 13 2HB PHE 13 -5.758 0.020 -4.469
72 HD1 PHE 13 HD1 PHE 13 -6.935 0.845 -6.426
73 HD2 PHE 13 HD2 PHE 13 -8.985 -1.228 -3.325
74 HE1 PHE 13 HE1 PHE 13 -9.084 1.653 -7.311
75 HE2 PHE 13 HE2 PHE 13 -11.137 -0.424 -4.206
76 HZ PHE 13 HZ PHE 13 -11.189 1.018 -6.202
77 H ARG 14 H ARG 14 -3.600 -1.716 -5.472
78 HA ARG 14 HA ARG 14 -2.549 -2.748 -2.977
79 HB2 ARG 14 1HB ARG 14 -2.928 -4.687 -4.662
80 HB3 ARG 14 2HB ARG 14 -1.536 -4.017 -5.502
81 HG2 ARG 14 1HG ARG 14 -0.296 -4.204 -3.299
82 HG3 ARG 14 2HG ARG 14 -1.655 -5.182 -2.740
83 HD2 ARG 14 1HD ARG 14 0.152 -5.753 -5.084
84 HD3 ARG 14 2HD ARG 14 0.088 -6.631 -3.556
85 HE ARG 14 HE ARG 14 -2.419 -6.906 -4.456
86 HH11 ARG 14 1HH1 ARG 14 0.664 -7.362 -6.007
87 HH12 ARG 14 2HH1 ARG 14 0.089 -8.596 -7.078
88 HH21 ARG 14 1HH2 ARG 14 -3.188 -8.529 -5.862
89 HH22 ARG 14 2HH2 ARG 14 -2.102 -9.259 -6.996
90 H CYS 15 H CYS 15 -0.610 -1.866 -2.457
91 HA CYS 15 HA CYS 15 0.410 0.191 -4.242
92 HB2 CYS 15 1HB CYS 15 0.055 0.762 -1.891
93 HB3 CYS 15 2HB CYS 15 1.159 -0.518 -1.398
94 H ASP 16 H ASP 16 1.830 -0.426 -5.732
95 HA ASP 16 HA ASP 16 3.550 -2.707 -5.343
96 HB2 ASP 16 1HB ASP 16 2.903 -0.866 -7.588
97 HB3 ASP 16 2HB ASP 16 4.464 -1.681 -7.638
98 H THR 17 H THR 17 4.044 -0.753 -3.420
99 HA THR 17 HA THR 17 6.784 0.041 -4.140
100 HB THR 17 HB THR 17 4.934 1.716 -2.435
101 HG1 THR 17 HG1 THR 17 4.182 2.224 -4.370
102 HG21 THR 17 3HG2 THR 17 6.658 3.366 -2.481
103 HG22 THR 17 1HG2 THR 17 7.598 2.439 -3.649
104 HG23 THR 17 2HG2 THR 17 7.408 1.845 -1.999
105 H CYS 18 H CYS 18 4.524 -0.373 -1.416
106 HA CYS 18 HA CYS 18 6.771 -1.457 0.155
107 HB2 CYS 18 1HB CYS 18 5.626 -0.658 2.172
108 HB3 CYS 18 2HB CYS 18 5.966 0.671 1.069
109 H ASP 19 H ASP 19 4.424 -2.550 -1.619
110 HA ASP 19 HA ASP 19 3.192 -4.460 -1.697
111 HB2 ASP 19 1HB ASP 19 5.368 -5.361 -0.700
112 HB3 ASP 19 2HB ASP 19 4.547 -5.314 0.858
113 H LYS 20 H LYS 20 1.747 -2.459 -0.815
114 HA LYS 20 HA LYS 20 0.318 -3.477 1.554
115 HB2 LYS 20 1HB LYS 20 1.004 -0.731 0.662
116 HB3 LYS 20 2HB LYS 20 -0.584 -0.949 1.387
117 HG2 LYS 20 1HG LYS 20 0.679 -2.126 3.292
118 HG3 LYS 20 2HG LYS 20 2.116 -1.358 2.613
119 HD2 LYS 20 1HD LYS 20 1.229 0.815 2.970
120 HD3 LYS 20 2HD LYS 20 -0.375 0.174 3.331
121 HE2 LYS 20 1HE LYS 20 0.236 -0.534 5.437
122 HE3 LYS 20 2HE LYS 20 1.943 -0.659 5.014
123 HZ1 LYS 20 3HZ LYS 20 0.396 1.696 5.817
124 HZ2 LYS 20 1HZ LYS 20 1.689 1.917 4.748
125 HZ3 LYS 20 2HZ LYS 20 1.957 1.226 6.269
126 H SER 21 H SER 21 -2.056 -2.481 1.494
127 HA SER 21 HA SER 21 -3.229 -2.452 -1.146
128 HB2 SER 21 1HB SER 21 -4.821 -4.356 -0.496
129 HB3 SER 21 2HB SER 21 -3.181 -4.810 -0.959
130 HG SER 21 HG SER 21 -3.194 -5.803 0.895
131 H PHE 22 H PHE 22 -5.298 -1.591 -1.182
132 HA PHE 22 HA PHE 22 -6.437 -0.795 1.410
133 HB2 PHE 22 1HB PHE 22 -6.159 0.980 -1.024
134 HB3 PHE 22 2HB PHE 22 -6.995 1.413 0.464
135 HD1 PHE 22 HD2 PHE 22 -3.660 0.143 -0.632
136 HD2 PHE 22 HD1 PHE 22 -5.851 2.688 1.984
137 HE1 PHE 22 HE2 PHE 22 -1.549 0.998 0.298
138 HE2 PHE 22 HE1 PHE 22 -3.743 3.548 2.918
139 HZ PHE 22 HZ PHE 22 -1.589 2.702 2.076
140 H ARG 23 H ARG 23 -8.725 0.217 0.962
141 HA ARG 23 HA ARG 23 -10.144 -1.722 -0.726
142 HB2 ARG 23 1HB ARG 23 -11.346 0.026 1.419
143 HB3 ARG 23 2HB ARG 23 -12.054 -1.398 0.667
144 HG2 ARG 23 1HG ARG 23 -10.139 -2.711 1.683
145 HG3 ARG 23 2HG ARG 23 -9.794 -1.267 2.636
146 HD2 ARG 23 1HD ARG 23 -11.183 -2.817 3.894
147 HD3 ARG 23 2HD ARG 23 -12.065 -1.330 3.546
148 HE ARG 23 HE ARG 23 -12.826 -2.904 1.520
149 HH11 ARG 23 1HH1 ARG 23 -12.646 -3.473 4.950
150 HH12 ARG 23 2HH1 ARG 23 -13.961 -4.601 4.964
151 HH21 ARG 23 1HH2 ARG 23 -14.558 -4.388 1.526
152 HH22 ARG 23 2HH2 ARG 23 -15.047 -5.122 3.015
153 H GLN 24 H GLN 24 -9.779 1.709 -0.068
154 HA GLN 24 HA GLN 24 -11.604 2.326 -2.285
155 HB2 GLN 24 1HB GLN 24 -10.458 4.295 -0.311
156 HB3 GLN 24 2HB GLN 24 -11.838 4.514 -1.379
157 HG2 GLN 24 1HG GLN 24 -13.109 2.884 -0.107
158 HG3 GLN 24 2HG GLN 24 -11.721 2.601 0.942
159 HE21 GLN 24 1HE2 GLN 24 -14.160 3.345 1.961
160 HE22 GLN 24 2HE2 GLN 24 -14.051 4.943 2.607
161 H ARG 25 H ARG 25 -10.850 3.098 -4.153
162 HA ARG 25 HA ARG 25 -8.183 3.035 -4.866
163 HB2 ARG 25 1HB ARG 25 -10.177 3.116 -6.410
164 HB3 ARG 25 2HB ARG 25 -10.241 4.850 -6.125
165 HG2 ARG 25 1HG ARG 25 -7.941 5.040 -7.015
166 HG3 ARG 25 2HG ARG 25 -7.983 3.317 -7.392
167 HD2 ARG 25 1HD ARG 25 -9.942 3.711 -8.837
168 HD3 ARG 25 2HD ARG 25 -9.822 5.437 -8.496
169 HE ARG 25 HE ARG 25 -8.063 5.576 -9.963
170 HH11 ARG 25 1HH1 ARG 25 -8.714 2.232 -9.246
171 HH12 ARG 25 2HH1 ARG 25 -7.646 1.627 -10.468
172 HH21 ARG 25 1HH2 ARG 25 -6.654 4.792 -11.576
173 HH22 ARG 25 2HH2 ARG 25 -6.474 3.083 -11.792
174 H SER 26 H SER 26 -10.036 5.644 -3.449
175 HA SER 26 HA SER 26 -8.091 7.681 -3.912
176 HB2 SER 26 1HB SER 26 -10.557 8.055 -3.459
177 HB3 SER 26 2HB SER 26 -10.223 7.681 -1.768
178 HG SER 26 HG SER 26 -10.111 9.905 -2.083
179 H ALA 27 H ALA 27 -8.427 5.159 -1.613
180 HA ALA 27 HA ALA 27 -6.801 6.391 0.426
181 HB1 ALA 27 3HB ALA 27 -7.395 4.659 1.743
182 HB2 ALA 27 1HB ALA 27 -8.644 4.432 0.518
183 HB3 ALA 27 2HB ALA 27 -7.168 3.467 0.463
184 H LEU 28 H LEU 28 -6.338 4.203 -2.267
185 HA LEU 28 HA LEU 28 -3.593 3.630 -1.498
186 HB2 LEU 28 1HB LEU 28 -4.497 1.745 -2.429
187 HB3 LEU 28 2HB LEU 28 -5.478 2.652 -3.578
188 HG LEU 28 HG LEU 28 -3.083 3.189 -4.604
189 HD11 LEU 28 1HD1 LEU 28 -2.724 0.702 -2.982
190 HD12 LEU 28 2HD1 LEU 28 -1.637 2.076 -3.179
191 HD13 LEU 28 3HD1 LEU 28 -1.845 0.922 -4.496
192 HD21 LEU 28 3HD2 LEU 28 -3.999 0.478 -5.296
193 HD22 LEU 28 1HD2 LEU 28 -3.762 1.896 -6.318
194 HD23 LEU 28 2HD2 LEU 28 -5.232 1.739 -5.357
195 H ASN 29 H ASN 29 -5.305 5.205 -4.190
196 HA ASN 29 HA ASN 29 -3.129 6.014 -5.690
197 HB2 ASN 29 1HB ASN 29 -5.894 7.072 -5.305
198 HB3 ASN 29 2HB ASN 29 -4.736 8.070 -6.180
199 HD21 ASN 29 1HD2 ASN 29 -6.996 7.137 -7.400
200 HD22 ASN 29 2HD2 ASN 29 -6.571 5.958 -8.589
201 H SER 30 H SER 30 -4.288 7.242 -2.663
202 HA SER 30 HA SER 30 -2.647 9.642 -2.830
203 HB2 SER 30 1HB SER 30 -4.908 9.750 -1.810
204 HB3 SER 30 2HB SER 30 -4.369 8.644 -0.548
205 HG SER 30 HG SER 30 -3.982 11.319 -0.778
206 H HIS 31 H HIS 31 -2.772 6.579 -1.091
207 HA HIS 31 HA HIS 31 -0.715 7.051 0.746
208 HB2 HIS 31 1HB HIS 31 -2.038 5.141 1.129
209 HB3 HIS 31 2HB HIS 31 -1.799 4.540 -0.509
210 HD1 HIS 31 HD1 HIS 31 -0.055 4.808 2.811
211 HD2 HIS 31 HD2 HIS 31 0.452 2.971 -0.881
212 HE1 HIS 31 HE1 HIS 31 1.843 3.188 3.121
213 H ARG 32 H ARG 32 -0.626 5.895 -2.586
214 HA ARG 32 HA ARG 32 2.076 5.163 -2.688
215 HB2 ARG 32 1HB ARG 32 0.350 6.268 -4.911
216 HB3 ARG 32 2HB ARG 32 1.864 5.399 -5.123
217 HG2 ARG 32 1HG ARG 32 0.589 3.552 -3.731
218 HG3 ARG 32 2HG ARG 32 -0.823 4.384 -4.385
219 HD2 ARG 32 1HD ARG 32 -0.145 2.539 -5.828
220 HD3 ARG 32 2HD ARG 32 0.044 4.089 -6.648
221 HE ARG 32 HE ARG 32 2.477 3.421 -5.436
222 HH11 ARG 32 1HH1 ARG 32 0.408 2.341 -8.019
223 HH12 ARG 32 2HH1 ARG 32 1.708 1.691 -8.963
224 HH21 ARG 32 1HH2 ARG 32 4.196 2.568 -6.669
225 HH22 ARG 32 2HH2 ARG 32 3.862 1.820 -8.194
226 H MET 33 H MET 33 0.567 8.256 -2.606
227 HA MET 33 HA MET 33 2.602 9.780 -3.851
228 HB2 MET 33 1HB MET 33 0.624 10.643 -1.733
229 HB3 MET 33 2HB MET 33 1.543 11.710 -2.786
230 HG2 MET 33 1HG MET 33 0.392 10.755 -4.731
231 HG3 MET 33 2HG MET 33 -0.552 9.732 -3.652
232 HE1 MET 33 3HE MET 33 -2.999 12.065 -5.166
233 HE2 MET 33 1HE MET 33 -1.611 13.031 -5.668
234 HE3 MET 33 2HE MET 33 -1.553 11.273 -5.795
235 H ILE 34 H ILE 34 1.972 8.919 -0.469
236 HA ILE 34 HA ILE 34 3.899 10.414 0.804
237 HB ILE 34 HB ILE 34 3.683 9.025 2.633
238 HG12 ILE 34 1HG1 ILE 34 3.496 6.795 0.626
239 HG13 ILE 34 2HG1 ILE 34 4.652 7.006 1.937
240 HG21 ILE 34 1HG2 ILE 34 1.412 8.552 2.851
241 HG22 ILE 34 2HG2 ILE 34 1.460 9.780 1.588
242 HG23 ILE 34 3HG2 ILE 34 1.250 8.083 1.159
243 HD11 ILE 34 3HD1 ILE 34 3.007 5.195 2.311
244 HD12 ILE 34 1HD1 ILE 34 3.001 6.434 3.565
245 HD13 ILE 34 2HD1 ILE 34 1.733 6.414 2.340
246 H HIS 35 H HIS 35 4.306 7.608 -1.210
247 HA HIS 35 HA HIS 35 7.032 7.128 -0.401
248 HB2 HIS 35 1HB HIS 35 5.444 6.034 -2.732
249 HB3 HIS 35 2HB HIS 35 7.036 5.470 -2.236
250 HD1 HIS 35 HD1 HIS 35 6.721 5.121 0.734
251 HD2 HIS 35 HD2 HIS 35 3.761 4.058 -1.980
252 HE1 HIS 35 HE1 HIS 35 5.308 3.410 1.917
253 H THR 36 H THR 36 5.370 8.666 -3.105
254 HA THR 36 HA THR 36 7.532 9.091 -4.802
255 HB THR 36 HB THR 36 6.256 10.801 -5.868
256 HG1 THR 36 HG1 THR 36 4.338 10.911 -3.820
257 HG21 THR 36 3HG2 THR 36 4.233 8.906 -4.679
258 HG22 THR 36 1HG2 THR 36 5.360 8.457 -5.958
259 HG23 THR 36 2HG2 THR 36 4.158 9.715 -6.244
260 H GLY 37 H GLY 37 9.361 10.179 -4.527
261 HA2 GLY 37 1HA GLY 37 9.385 12.387 -2.565
262 HA3 GLY 37 2HA GLY 37 10.765 11.354 -2.901
263 H GLU 38 H GLU 38 12.154 13.001 -3.472
264 HA GLU 38 HA GLU 38 11.584 15.140 -5.166
265 HB2 GLU 38 1HB GLU 38 13.911 15.518 -5.282
266 HB3 GLU 38 2HB GLU 38 13.638 14.793 -3.704
267 HG2 GLU 38 1HG GLU 38 14.342 13.031 -5.995
268 HG3 GLU 38 2HG GLU 38 15.604 13.999 -5.236
269 H LYS 39 H LYS 39 13.191 15.273 -7.271
270 HA LYS 39 HA LYS 39 12.857 14.869 -9.540
271 HB2 LYS 39 1HB LYS 39 14.286 13.089 -10.233
272 HB3 LYS 39 2HB LYS 39 14.977 13.759 -8.761
273 HG2 LYS 39 1HG LYS 39 13.553 11.842 -7.637
274 HG3 LYS 39 2HG LYS 39 13.717 11.115 -9.237
275 HD2 LYS 39 1HD LYS 39 16.139 12.229 -7.901
276 HD3 LYS 39 2HD LYS 39 15.505 10.673 -7.360
277 HE2 LYS 39 1HE LYS 39 15.574 9.919 -9.747
278 HE3 LYS 39 2HE LYS 39 16.413 11.420 -10.135
279 HZ1 LYS 39 3HZ LYS 39 18.308 10.726 -9.141
280 HZ2 LYS 39 1HZ LYS 39 17.692 9.201 -9.538
281 HZ3 LYS 39 2HZ LYS 39 17.511 9.804 -7.968
282 HA PRO 40 HA PRO 40 9.156 12.005 -8.895
283 HB2 PRO 40 1HB PRO 40 7.232 13.866 -9.345
284 HB3 PRO 40 2HB PRO 40 7.892 13.536 -7.739
285 HG2 PRO 40 1HG PRO 40 8.572 15.737 -9.651
286 HG3 PRO 40 2HG PRO 40 8.328 15.814 -7.896
287 HD2 PRO 40 1HD PRO 40 10.789 15.762 -9.024
288 HD3 PRO 40 2HD PRO 40 10.449 15.035 -7.440
289 H SER 41 H SER 41 7.083 12.205 -10.533
290 HA SER 41 HA SER 41 8.274 12.430 -13.220
291 HB2 SER 41 1HB SER 41 6.059 10.572 -12.316
292 HB3 SER 41 2HB SER 41 6.760 10.642 -13.932
293 HG SER 41 HG SER 41 8.473 9.592 -13.249
294 H GLY 42 H GLY 42 7.161 14.675 -12.036
295 HA2 GLY 42 1HA GLY 42 5.847 16.187 -13.540
296 HA3 GLY 42 2HA GLY 42 4.599 14.950 -13.484
297 HA PRO 43 HA PRO 43 3.964 18.197 -10.128
298 HB2 PRO 43 1HB PRO 43 1.586 19.133 -11.043
299 HB3 PRO 43 2HB PRO 43 3.141 19.808 -11.545
300 HG2 PRO 43 1HG PRO 43 1.381 17.845 -12.964
301 HG3 PRO 43 2HG PRO 43 2.256 19.241 -13.620
302 HD2 PRO 43 1HD PRO 43 3.171 16.704 -13.862
303 HD3 PRO 43 2HD PRO 43 4.257 18.101 -13.717
304 H SER 44 H SER 44 1.461 16.268 -11.783
305 HA SER 44 HA SER 44 -0.349 15.130 -10.950
306 HB2 SER 44 1HB SER 44 0.285 13.383 -9.323
307 HB3 SER 44 2HB SER 44 1.467 13.520 -10.624
308 HG SER 44 HG SER 44 1.735 14.029 -7.932
309 H SER 45 H SER 45 -0.376 17.736 -10.022
310 HA SER 45 HA SER 45 -1.040 17.544 -7.173
311 HB2 SER 45 1HB SER 45 -1.092 20.026 -7.244
312 HB3 SER 45 2HB SER 45 0.458 19.370 -7.768
313 HG SER 45 HG SER 45 -1.640 20.222 -9.482
314 H GLY 46 H GLY 46 -3.001 18.709 -6.429
315 HA2 GLY 46 1HA GLY 46 -5.280 17.812 -7.909
316 HA3 GLY 46 2HA GLY 46 -5.307 18.716 -6.402
Start of MODEL 15
1 H1 GLY 1 H GLY 1 10.660 -23.398 -3.477
2 HA2 GLY 1 1HA GLY 1 9.587 -25.550 -4.921
3 HA3 GLY 1 2HA GLY 1 9.410 -25.902 -3.208
4 H SER 2 H SER 2 9.137 -22.858 -5.028
5 HA SER 2 HA SER 2 6.639 -22.295 -3.648
6 HB2 SER 2 1HB SER 2 8.391 -20.540 -3.879
7 HB3 SER 2 2HB SER 2 8.159 -20.580 -5.627
8 HG SER 2 HG SER 2 6.251 -19.853 -3.658
9 H SER 3 H SER 3 5.123 -23.640 -4.566
10 HA SER 3 HA SER 3 4.606 -23.249 -7.441
11 HB2 SER 3 1HB SER 3 5.208 -25.584 -6.747
12 HB3 SER 3 2HB SER 3 3.755 -25.610 -5.748
13 HG SER 3 HG SER 3 3.782 -25.139 -8.547
14 H GLY 4 H GLY 4 3.679 -21.371 -5.613
15 HA2 GLY 4 1HA GLY 4 0.798 -21.993 -5.429
16 HA3 GLY 4 2HA GLY 4 1.637 -20.859 -4.380
17 H SER 5 H SER 5 -0.688 -20.701 -6.373
18 HA SER 5 HA SER 5 -0.179 -19.246 -8.610
19 HB2 SER 5 1HB SER 5 -2.405 -19.128 -6.610
20 HB3 SER 5 2HB SER 5 -2.360 -17.942 -7.915
21 HG SER 5 HG SER 5 -2.243 -20.753 -8.294
22 H SER 6 H SER 6 -0.366 -17.972 -5.303
23 HA SER 6 HA SER 6 0.203 -15.947 -4.414
24 HB2 SER 6 1HB SER 6 2.426 -17.080 -5.303
25 HB3 SER 6 2HB SER 6 2.421 -15.702 -6.403
26 HG SER 6 HG SER 6 3.433 -14.872 -4.708
27 H GLY 7 H GLY 7 -1.798 -15.732 -6.351
28 HA2 GLY 7 1HA GLY 7 -1.109 -13.157 -7.630
29 HA3 GLY 7 2HA GLY 7 -2.212 -14.323 -8.347
30 H THR 8 H THR 8 -3.879 -15.015 -6.373
31 HA THR 8 HA THR 8 -5.853 -13.198 -6.290
32 HB THR 8 HB THR 8 -5.989 -15.490 -5.315
33 HG1 THR 8 HG1 THR 8 -7.655 -14.896 -4.038
34 HG21 THR 8 3HG2 THR 8 -3.886 -14.934 -3.825
35 HG22 THR 8 1HG2 THR 8 -5.124 -16.056 -3.262
36 HG23 THR 8 2HG2 THR 8 -5.116 -14.389 -2.685
37 H ALA 9 H ALA 9 -6.541 -11.489 -5.011
38 HA ALA 9 HA ALA 9 -4.709 -10.472 -2.968
39 HB1 ALA 9 3HB ALA 9 -5.576 -8.210 -4.415
40 HB2 ALA 9 1HB ALA 9 -3.933 -8.830 -4.239
41 HB3 ALA 9 2HB ALA 9 -4.938 -9.364 -5.587
42 H GLU 10 H GLU 10 -5.987 -10.436 -1.230
43 HA GLU 10 HA GLU 10 -8.632 -10.495 -0.915
44 HB2 GLU 10 1HB GLU 10 -6.496 -9.142 0.640
45 HB3 GLU 10 2HB GLU 10 -8.155 -8.730 1.048
46 HG2 GLU 10 1HG GLU 10 -6.816 -11.409 1.182
47 HG3 GLU 10 2HG GLU 10 -7.551 -10.481 2.488
48 H LYS 11 H LYS 11 -6.811 -7.593 -1.753
49 HA LYS 11 HA LYS 11 -9.365 -6.265 -2.383
50 HB2 LYS 11 1HB LYS 11 -6.846 -4.928 -1.379
51 HB3 LYS 11 2HB LYS 11 -8.361 -4.126 -1.770
52 HG2 LYS 11 1HG LYS 11 -7.878 -6.082 0.465
53 HG3 LYS 11 2HG LYS 11 -8.168 -4.347 0.610
54 HD2 LYS 11 1HD LYS 11 -10.084 -6.515 -0.192
55 HD3 LYS 11 2HD LYS 11 -10.235 -5.333 1.110
56 HE2 LYS 11 1HE LYS 11 -10.091 -3.652 -0.953
57 HE3 LYS 11 2HE LYS 11 -10.760 -5.049 -1.795
58 HZ1 LYS 11 3HZ LYS 11 -12.237 -3.241 -0.508
59 HZ2 LYS 11 1HZ LYS 11 -12.033 -4.384 0.723
60 HZ3 LYS 11 2HZ LYS 11 -12.723 -4.843 -0.752
61 HA PRO 12 HA PRO 12 -7.861 -5.727 -6.475
62 HB2 PRO 12 1HB PRO 12 -9.129 -3.431 -7.175
63 HB3 PRO 12 2HB PRO 12 -9.966 -4.980 -7.012
64 HG2 PRO 12 1HG PRO 12 -9.796 -2.706 -5.072
65 HG3 PRO 12 2HG PRO 12 -11.200 -3.694 -5.518
66 HD2 PRO 12 1HD PRO 12 -9.791 -4.106 -3.243
67 HD3 PRO 12 2HD PRO 12 -10.579 -5.426 -4.131
68 H PHE 13 H PHE 13 -7.568 -3.047 -4.215
69 HA PHE 13 HA PHE 13 -5.547 -1.747 -5.859
70 HB2 PHE 13 1HB PHE 13 -6.428 -0.909 -3.099
71 HB3 PHE 13 2HB PHE 13 -5.678 0.081 -4.347
72 HD1 PHE 13 HD2 PHE 13 -8.780 -1.504 -3.223
73 HD2 PHE 13 HD1 PHE 13 -6.969 0.989 -6.160
74 HE1 PHE 13 HE2 PHE 13 -11.008 -0.808 -4.002
75 HE2 PHE 13 HE1 PHE 13 -9.194 1.689 -6.943
76 HZ PHE 13 HZ PHE 13 -11.217 0.790 -5.865
77 H ARG 14 H ARG 14 -3.396 -1.689 -5.423
78 HA ARG 14 HA ARG 14 -2.360 -2.707 -2.917
79 HB2 ARG 14 1HB ARG 14 -2.734 -4.729 -4.352
80 HB3 ARG 14 2HB ARG 14 -1.589 -4.058 -5.506
81 HG2 ARG 14 1HG ARG 14 0.160 -4.114 -3.788
82 HG3 ARG 14 2HG ARG 14 -0.993 -4.823 -2.656
83 HD2 ARG 14 1HD ARG 14 0.443 -6.526 -3.675
84 HD3 ARG 14 2HD ARG 14 -1.251 -6.760 -4.102
85 HE ARG 14 HE ARG 14 0.259 -5.235 -6.025
86 HH11 ARG 14 1HH1 ARG 14 -0.743 -8.409 -5.006
87 HH12 ARG 14 2HH1 ARG 14 -0.531 -9.122 -6.571
88 HH21 ARG 14 1HH2 ARG 14 0.543 -6.161 -8.090
89 HH22 ARG 14 2HH2 ARG 14 0.202 -7.842 -8.324
90 H CYS 15 H CYS 15 -0.429 -1.819 -2.404
91 HA CYS 15 HA CYS 15 0.632 0.178 -4.227
92 HB2 CYS 15 1HB CYS 15 0.284 0.784 -1.879
93 HB3 CYS 15 2HB CYS 15 1.383 -0.495 -1.374
94 H ASP 16 H ASP 16 2.141 -0.358 -5.647
95 HA ASP 16 HA ASP 16 3.754 -2.725 -5.309
96 HB2 ASP 16 1HB ASP 16 2.761 -1.705 -7.510
97 HB3 ASP 16 2HB ASP 16 4.216 -0.713 -7.481
98 H THR 17 H THR 17 4.248 -0.906 -3.267
99 HA THR 17 HA THR 17 7.052 -0.223 -3.818
100 HB THR 17 HB THR 17 5.222 1.536 -2.180
101 HG1 THR 17 HG1 THR 17 5.246 2.919 -3.979
102 HG21 THR 17 3HG2 THR 17 8.088 1.720 -3.064
103 HG22 THR 17 1HG2 THR 17 7.424 1.865 -1.437
104 HG23 THR 17 2HG2 THR 17 7.166 3.154 -2.612
105 H CYS 18 H CYS 18 4.636 -0.444 -1.203
106 HA CYS 18 HA CYS 18 6.712 -1.681 0.482
107 HB2 CYS 18 1HB CYS 18 5.389 -0.894 2.422
108 HB3 CYS 18 2HB CYS 18 5.950 0.432 1.408
109 H ASP 19 H ASP 19 4.445 -2.660 -1.468
110 HA ASP 19 HA ASP 19 3.137 -4.512 -1.658
111 HB2 ASP 19 1HB ASP 19 5.184 -5.603 -0.724
112 HB3 ASP 19 2HB ASP 19 4.491 -5.427 0.886
113 H LYS 20 H LYS 20 1.822 -2.405 -0.641
114 HA LYS 20 HA LYS 20 0.260 -3.465 1.618
115 HB2 LYS 20 1HB LYS 20 1.000 -0.722 0.748
116 HB3 LYS 20 2HB LYS 20 -0.595 -0.928 1.460
117 HG2 LYS 20 1HG LYS 20 0.610 -2.105 3.380
118 HG3 LYS 20 2HG LYS 20 2.088 -1.414 2.705
119 HD2 LYS 20 1HD LYS 20 1.140 0.828 2.913
120 HD3 LYS 20 2HD LYS 20 -0.351 0.144 3.565
121 HE2 LYS 20 1HE LYS 20 0.697 0.673 5.518
122 HE3 LYS 20 2HE LYS 20 1.340 -0.952 5.283
123 HZ1 LYS 20 3HZ LYS 20 3.377 -0.130 4.582
124 HZ2 LYS 20 1HZ LYS 20 2.963 0.921 5.841
125 HZ3 LYS 20 2HZ LYS 20 2.767 1.409 4.234
126 H SER 21 H SER 21 -2.098 -2.485 1.518
127 HA SER 21 HA SER 21 -3.209 -2.391 -1.149
128 HB2 SER 21 1HB SER 21 -4.816 -4.290 -0.620
129 HB3 SER 21 2HB SER 21 -3.151 -4.766 -0.954
130 HG SER 21 HG SER 21 -4.120 -4.329 1.669
131 H PHE 22 H PHE 22 -5.286 -1.536 -1.218
132 HA PHE 22 HA PHE 22 -6.466 -0.753 1.359
133 HB2 PHE 22 1HB PHE 22 -6.163 1.051 -1.052
134 HB3 PHE 22 2HB PHE 22 -6.977 1.471 0.452
135 HD1 PHE 22 HD2 PHE 22 -3.670 0.224 -0.740
136 HD2 PHE 22 HD1 PHE 22 -5.802 2.664 2.019
137 HE1 PHE 22 HE2 PHE 22 -1.539 1.040 0.179
138 HE2 PHE 22 HE1 PHE 22 -3.675 3.486 2.942
139 HZ PHE 22 HZ PHE 22 -1.539 2.673 2.023
140 H ARG 23 H ARG 23 -8.749 0.177 0.970
141 HA ARG 23 HA ARG 23 -10.128 -1.659 -0.863
142 HB2 ARG 23 1HB ARG 23 -11.292 -0.140 1.475
143 HB3 ARG 23 2HB ARG 23 -12.073 -1.414 0.549
144 HG2 ARG 23 1HG ARG 23 -10.071 -2.863 1.342
145 HG3 ARG 23 2HG ARG 23 -9.895 -1.615 2.578
146 HD2 ARG 23 1HD ARG 23 -11.893 -2.134 3.581
147 HD3 ARG 23 2HD ARG 23 -12.591 -2.782 2.097
148 HE ARG 23 HE ARG 23 -11.795 -4.840 2.679
149 HH11 ARG 23 1HH1 ARG 23 -10.072 -2.419 4.493
150 HH12 ARG 23 2HH1 ARG 23 -9.222 -3.569 5.470
151 HH21 ARG 23 1HH2 ARG 23 -10.681 -6.364 3.959
152 HH22 ARG 23 2HH2 ARG 23 -9.568 -5.813 5.165
153 H GLN 24 H GLN 24 -9.862 1.714 0.088
154 HA GLN 24 HA GLN 24 -11.776 2.490 -1.984
155 HB2 GLN 24 1HB GLN 24 -10.384 4.343 -0.061
156 HB3 GLN 24 2HB GLN 24 -11.873 4.622 -0.953
157 HG2 GLN 24 1HG GLN 24 -13.076 3.098 0.413
158 HG3 GLN 24 2HG GLN 24 -11.596 2.519 1.174
159 HE21 GLN 24 1HE2 GLN 24 -12.501 3.012 3.209
160 HE22 GLN 24 2HE2 GLN 24 -12.553 4.638 3.792
161 H ARG 25 H ARG 25 -11.163 3.307 -3.882
162 HA ARG 25 HA ARG 25 -8.554 3.219 -4.808
163 HB2 ARG 25 1HB ARG 25 -10.604 3.309 -6.227
164 HB3 ARG 25 2HB ARG 25 -10.746 5.020 -5.848
165 HG2 ARG 25 1HG ARG 25 -8.633 5.471 -6.937
166 HG3 ARG 25 2HG ARG 25 -8.404 3.749 -7.249
167 HD2 ARG 25 1HD ARG 25 -9.218 4.617 -9.268
168 HD3 ARG 25 2HD ARG 25 -10.616 3.855 -8.511
169 HE ARG 25 HE ARG 25 -10.205 6.682 -8.976
170 HH11 ARG 25 1HH1 ARG 25 -12.014 4.234 -7.288
171 HH12 ARG 25 2HH1 ARG 25 -13.373 5.264 -6.982
172 HH21 ARG 25 1HH2 ARG 25 -11.988 8.049 -8.580
173 HH22 ARG 25 2HH2 ARG 25 -13.358 7.433 -7.719
174 H SER 26 H SER 26 -10.285 5.824 -3.230
175 HA SER 26 HA SER 26 -8.283 7.809 -3.772
176 HB2 SER 26 1HB SER 26 -10.433 7.920 -1.651
177 HB3 SER 26 2HB SER 26 -9.600 9.277 -2.409
178 HG SER 26 HG SER 26 -11.844 8.452 -3.165
179 H ALA 27 H ALA 27 -8.528 5.237 -1.610
180 HA ALA 27 HA ALA 27 -6.983 6.458 0.516
181 HB1 ALA 27 3HB ALA 27 -7.151 4.312 1.623
182 HB2 ALA 27 1HB ALA 27 -8.734 4.803 1.020
183 HB3 ALA 27 2HB ALA 27 -7.802 3.578 0.158
184 H LEU 28 H LEU 28 -6.481 4.268 -2.184
185 HA LEU 28 HA LEU 28 -3.729 3.749 -1.420
186 HB2 LEU 28 1HB LEU 28 -4.661 1.864 -2.361
187 HB3 LEU 28 2HB LEU 28 -5.565 2.784 -3.563
188 HG LEU 28 HG LEU 28 -3.093 3.278 -4.442
189 HD11 LEU 28 1HD1 LEU 28 -1.565 1.572 -4.096
190 HD12 LEU 28 2HD1 LEU 28 -2.792 0.455 -3.500
191 HD13 LEU 28 3HD1 LEU 28 -2.263 1.802 -2.492
192 HD21 LEU 28 3HD2 LEU 28 -3.778 2.098 -6.216
193 HD22 LEU 28 1HD2 LEU 28 -5.255 1.832 -5.288
194 HD23 LEU 28 2HD2 LEU 28 -3.975 0.619 -5.275
195 H ASN 29 H ASN 29 -5.461 5.341 -4.085
196 HA ASN 29 HA ASN 29 -3.332 6.176 -5.615
197 HB2 ASN 29 1HB ASN 29 -6.034 7.358 -5.074
198 HB3 ASN 29 2HB ASN 29 -4.879 8.239 -6.069
199 HD21 ASN 29 1HD2 ASN 29 -7.328 7.340 -7.016
200 HD22 ASN 29 2HD2 ASN 29 -7.050 6.121 -8.209
201 H SER 30 H SER 30 -4.387 7.364 -2.527
202 HA SER 30 HA SER 30 -2.713 9.735 -2.681
203 HB2 SER 30 1HB SER 30 -4.802 10.043 -1.548
204 HB3 SER 30 2HB SER 30 -4.521 8.638 -0.520
205 HG SER 30 HG SER 30 -3.141 9.763 0.678
206 H HIS 31 H HIS 31 -2.798 6.628 -1.009
207 HA HIS 31 HA HIS 31 -0.632 7.034 0.720
208 HB2 HIS 31 1HB HIS 31 -1.991 5.148 1.141
209 HB3 HIS 31 2HB HIS 31 -1.824 4.556 -0.509
210 HD1 HIS 31 HD1 HIS 31 0.016 4.735 2.757
211 HD2 HIS 31 HD2 HIS 31 0.420 2.992 -0.993
212 HE1 HIS 31 HE1 HIS 31 1.907 3.093 2.980
213 H ARG 32 H ARG 32 -0.758 5.911 -2.624
214 HA ARG 32 HA ARG 32 1.915 5.124 -2.891
215 HB2 ARG 32 1HB ARG 32 0.062 6.287 -4.979
216 HB3 ARG 32 2HB ARG 32 1.569 5.445 -5.316
217 HG2 ARG 32 1HG ARG 32 0.583 3.450 -4.135
218 HG3 ARG 32 2HG ARG 32 -0.955 4.315 -4.143
219 HD2 ARG 32 1HD ARG 32 0.682 3.519 -6.548
220 HD3 ARG 32 2HD ARG 32 -0.845 2.804 -6.031
221 HE ARG 32 HE ARG 32 -1.105 5.601 -6.471
222 HH11 ARG 32 1HH1 ARG 32 -0.892 2.538 -8.112
223 HH12 ARG 32 2HH1 ARG 32 -1.772 3.074 -9.505
224 HH21 ARG 32 1HH2 ARG 32 -2.265 6.319 -8.299
225 HH22 ARG 32 2HH2 ARG 32 -2.551 5.226 -9.610
226 H MET 33 H MET 33 0.481 8.254 -2.707
227 HA MET 33 HA MET 33 2.480 9.747 -4.032
228 HB2 MET 33 1HB MET 33 0.657 10.626 -1.787
229 HB3 MET 33 2HB MET 33 1.533 11.685 -2.883
230 HG2 MET 33 1HG MET 33 0.238 10.540 -4.754
231 HG3 MET 33 2HG MET 33 -0.792 9.893 -3.479
232 HE1 MET 33 3HE MET 33 -3.436 12.086 -4.022
233 HE2 MET 33 1HE MET 33 -2.594 12.138 -5.571
234 HE3 MET 33 2HE MET 33 -2.609 10.649 -4.624
235 H ILE 34 H ILE 34 2.028 8.854 -0.631
236 HA ILE 34 HA ILE 34 4.068 10.281 0.543
237 HB ILE 34 HB ILE 34 3.921 8.875 2.366
238 HG12 ILE 34 1HG1 ILE 34 3.562 6.681 0.346
239 HG13 ILE 34 2HG1 ILE 34 4.782 6.835 1.606
240 HG21 ILE 34 1HG2 ILE 34 1.377 7.991 1.065
241 HG22 ILE 34 2HG2 ILE 34 1.661 8.510 2.725
242 HG23 ILE 34 3HG2 ILE 34 1.655 9.695 1.420
243 HD11 ILE 34 3HD1 ILE 34 1.864 6.306 2.109
244 HD12 ILE 34 1HD1 ILE 34 3.120 5.069 2.048
245 HD13 ILE 34 2HD1 ILE 34 3.164 6.311 3.300
246 H HIS 35 H HIS 35 4.275 7.490 -1.522
247 HA HIS 35 HA HIS 35 7.045 6.957 -0.886
248 HB2 HIS 35 1HB HIS 35 5.271 5.847 -3.071
249 HB3 HIS 35 2HB HIS 35 6.886 5.264 -2.682
250 HD1 HIS 35 HD1 HIS 35 6.795 4.964 0.303
251 HD2 HIS 35 HD2 HIS 35 3.607 3.927 -2.151
252 HE1 HIS 35 HE1 HIS 35 5.444 3.303 1.622
253 H THR 36 H THR 36 5.266 8.098 -3.755
254 HA THR 36 HA THR 36 7.153 8.543 -5.586
255 HB THR 36 HB THR 36 5.973 10.496 -6.384
256 HG1 THR 36 HG1 THR 36 4.289 10.591 -4.148
257 HG21 THR 36 3HG2 THR 36 3.845 9.561 -6.702
258 HG22 THR 36 1HG2 THR 36 3.853 8.780 -5.121
259 HG23 THR 36 2HG2 THR 36 4.888 8.169 -6.412
260 H GLY 37 H GLY 37 9.098 9.451 -5.663
261 HA2 GLY 37 1HA GLY 37 9.647 11.991 -4.445
262 HA3 GLY 37 2HA GLY 37 10.424 10.661 -3.597
263 H GLU 38 H GLU 38 9.931 11.642 -6.994
264 HA GLU 38 HA GLU 38 12.821 11.248 -7.407
265 HB2 GLU 38 1HB GLU 38 10.547 10.495 -9.246
266 HB3 GLU 38 2HB GLU 38 12.230 10.547 -9.753
267 HG2 GLU 38 1HG GLU 38 12.678 8.914 -7.850
268 HG3 GLU 38 2HG GLU 38 10.930 8.700 -7.783
269 H LYS 39 H LYS 39 13.141 13.490 -7.079
270 HA LYS 39 HA LYS 39 12.200 15.162 -9.317
271 HB2 LYS 39 1HB LYS 39 12.438 15.762 -6.395
272 HB3 LYS 39 2HB LYS 39 12.660 17.063 -7.558
273 HG2 LYS 39 1HG LYS 39 10.420 17.229 -7.074
274 HG3 LYS 39 2HG LYS 39 10.402 16.231 -8.531
275 HD2 LYS 39 1HD LYS 39 8.985 15.033 -7.178
276 HD3 LYS 39 2HD LYS 39 10.526 14.262 -6.796
277 HE2 LYS 39 1HE LYS 39 9.467 16.577 -5.202
278 HE3 LYS 39 2HE LYS 39 9.006 14.913 -4.844
279 HZ1 LYS 39 3HZ LYS 39 11.566 14.552 -4.857
280 HZ2 LYS 39 1HZ LYS 39 10.810 15.194 -3.486
281 HZ3 LYS 39 2HZ LYS 39 11.622 16.216 -4.561
282 HA PRO 40 HA PRO 40 16.392 15.987 -10.326
283 HB2 PRO 40 1HB PRO 40 16.216 18.528 -11.265
284 HB3 PRO 40 2HB PRO 40 15.602 17.130 -12.156
285 HG2 PRO 40 1HG PRO 40 14.116 19.093 -10.452
286 HG3 PRO 40 2HG PRO 40 13.666 18.411 -12.026
287 HD2 PRO 40 1HD PRO 40 12.636 17.499 -9.693
288 HD3 PRO 40 2HD PRO 40 12.904 16.444 -11.096
289 H SER 41 H SER 41 18.213 17.490 -9.915
290 HA SER 41 HA SER 41 18.548 18.023 -7.207
291 HB2 SER 41 1HB SER 41 20.616 19.084 -7.799
292 HB3 SER 41 2HB SER 41 20.370 17.757 -8.933
293 HG SER 41 HG SER 41 19.744 20.482 -9.428
294 H GLY 42 H GLY 42 18.348 19.813 -5.927
295 HA2 GLY 42 1HA GLY 42 17.296 22.264 -7.178
296 HA3 GLY 42 2HA GLY 42 16.448 21.540 -5.820
297 HA PRO 43 HA PRO 43 20.287 24.232 -4.604
298 HB2 PRO 43 1HB PRO 43 19.355 26.772 -4.826
299 HB3 PRO 43 2HB PRO 43 20.230 25.953 -6.125
300 HG2 PRO 43 1HG PRO 43 17.282 26.338 -5.776
301 HG3 PRO 43 2HG PRO 43 18.265 26.501 -7.242
302 HD2 PRO 43 1HD PRO 43 16.780 24.298 -6.723
303 HD3 PRO 43 2HD PRO 43 18.313 24.227 -7.616
304 H SER 44 H SER 44 17.044 23.822 -3.864
305 HA SER 44 HA SER 44 16.976 25.474 -1.498
306 HB2 SER 44 1HB SER 44 14.775 24.322 -1.109
307 HB3 SER 44 2HB SER 44 14.895 25.147 -2.663
308 HG SER 44 HG SER 44 15.330 22.372 -2.243
309 H SER 45 H SER 45 16.632 24.614 0.654
310 HA SER 45 HA SER 45 17.440 21.868 1.142
311 HB2 SER 45 1HB SER 45 19.287 22.469 2.626
312 HB3 SER 45 2HB SER 45 19.584 23.097 1.005
313 HG SER 45 HG SER 45 18.251 24.769 2.784
314 H GLY 46 H GLY 46 17.478 21.454 3.597
315 HA2 GLY 46 1HA GLY 46 14.948 22.240 4.635
316 HA3 GLY 46 2HA GLY 46 16.166 21.296 5.480
Start of MODEL 16
1 H1 GLY 1 H GLY 1 15.262 -15.174 -8.875
2 HA2 GLY 1 1HA GLY 1 13.756 -15.422 -7.145
3 HA3 GLY 1 2HA GLY 1 14.606 -14.145 -6.287
4 H SER 2 H SER 2 12.675 -14.380 -9.279
5 HA SER 2 HA SER 2 11.655 -11.767 -9.115
6 HB2 SER 2 1HB SER 2 11.680 -13.439 -11.111
7 HB3 SER 2 2HB SER 2 10.142 -13.994 -10.451
8 HG SER 2 HG SER 2 10.816 -11.443 -11.456
9 H SER 3 H SER 3 10.326 -10.952 -7.652
10 HA SER 3 HA SER 3 8.358 -12.737 -6.380
11 HB2 SER 3 1HB SER 3 10.096 -11.755 -4.867
12 HB3 SER 3 2HB SER 3 9.475 -10.154 -5.266
13 HG SER 3 HG SER 3 8.120 -12.263 -3.943
14 H GLY 4 H GLY 4 6.251 -12.298 -6.600
15 HA2 GLY 4 1HA GLY 4 4.313 -11.085 -6.977
16 HA3 GLY 4 2HA GLY 4 5.287 -9.626 -7.085
17 H SER 5 H SER 5 3.874 -12.275 -8.833
18 HA SER 5 HA SER 5 4.646 -10.969 -11.360
19 HB2 SER 5 1HB SER 5 4.252 -13.890 -10.716
20 HB3 SER 5 2HB SER 5 4.245 -13.285 -12.372
21 HG SER 5 HG SER 5 6.343 -12.802 -12.226
22 H SER 6 H SER 6 2.120 -12.962 -9.839
23 HA SER 6 HA SER 6 0.174 -12.101 -11.812
24 HB2 SER 6 1HB SER 6 0.241 -14.450 -10.927
25 HB3 SER 6 2HB SER 6 -0.274 -13.819 -9.363
26 HG SER 6 HG SER 6 -1.856 -14.586 -11.197
27 H GLY 7 H GLY 7 0.822 -11.675 -8.361
28 HA2 GLY 7 1HA GLY 7 0.271 -9.863 -7.020
29 HA3 GLY 7 2HA GLY 7 -0.586 -9.156 -8.381
30 H THR 8 H THR 8 -0.812 -11.322 -5.652
31 HA THR 8 HA THR 8 -3.732 -11.443 -6.018
32 HB THR 8 HB THR 8 -3.646 -13.360 -4.395
33 HG1 THR 8 HG1 THR 8 -0.949 -13.754 -4.935
34 HG21 THR 8 3HG2 THR 8 -2.394 -13.409 -7.102
35 HG22 THR 8 1HG2 THR 8 -3.907 -14.125 -6.549
36 HG23 THR 8 2HG2 THR 8 -2.370 -14.880 -6.129
37 H ALA 9 H ALA 9 -4.909 -10.209 -4.720
38 HA ALA 9 HA ALA 9 -4.142 -9.843 -1.941
39 HB1 ALA 9 3HB ALA 9 -3.884 -7.744 -3.966
40 HB2 ALA 9 1HB ALA 9 -4.791 -7.264 -2.532
41 HB3 ALA 9 2HB ALA 9 -3.146 -7.882 -2.370
42 H GLU 10 H GLU 10 -5.881 -9.867 -0.657
43 HA GLU 10 HA GLU 10 -8.414 -10.498 -1.505
44 HB2 GLU 10 1HB GLU 10 -7.645 -10.718 0.822
45 HB3 GLU 10 2HB GLU 10 -7.683 -8.969 0.999
46 HG2 GLU 10 1HG GLU 10 -9.634 -10.128 1.988
47 HG3 GLU 10 2HG GLU 10 -10.056 -8.923 0.773
48 H LYS 11 H LYS 11 -6.870 -7.460 -1.643
49 HA LYS 11 HA LYS 11 -9.438 -6.115 -2.166
50 HB2 LYS 11 1HB LYS 11 -6.786 -4.883 -1.395
51 HB3 LYS 11 2HB LYS 11 -8.286 -4.007 -1.668
52 HG2 LYS 11 1HG LYS 11 -7.544 -5.812 0.596
53 HG3 LYS 11 2HG LYS 11 -8.156 -4.157 0.640
54 HD2 LYS 11 1HD LYS 11 -9.725 -6.592 -0.209
55 HD3 LYS 11 2HD LYS 11 -9.855 -5.779 1.352
56 HE2 LYS 11 1HE LYS 11 -10.365 -3.673 -0.065
57 HE3 LYS 11 2HE LYS 11 -10.701 -4.823 -1.358
58 HZ1 LYS 11 3HZ LYS 11 -12.751 -4.532 -0.373
59 HZ2 LYS 11 1HZ LYS 11 -12.122 -4.443 1.195
60 HZ3 LYS 11 2HZ LYS 11 -12.198 -5.933 0.398
61 HA PRO 12 HA PRO 12 -8.348 -5.588 -6.388
62 HB2 PRO 12 1HB PRO 12 -9.620 -3.255 -6.942
63 HB3 PRO 12 2HB PRO 12 -10.476 -4.783 -6.702
64 HG2 PRO 12 1HG PRO 12 -10.048 -2.529 -4.779
65 HG3 PRO 12 2HG PRO 12 -11.516 -3.477 -5.083
66 HD2 PRO 12 1HD PRO 12 -9.892 -3.943 -2.967
67 HD3 PRO 12 2HD PRO 12 -10.802 -5.236 -3.776
68 H PHE 13 H PHE 13 -7.581 -3.126 -4.055
69 HA PHE 13 HA PHE 13 -5.687 -1.880 -5.924
70 HB2 PHE 13 1HB PHE 13 -6.531 -0.852 -3.211
71 HB3 PHE 13 2HB PHE 13 -5.657 0.027 -4.462
72 HD1 PHE 13 HD1 PHE 13 -6.806 0.869 -6.426
73 HD2 PHE 13 HD2 PHE 13 -8.910 -1.187 -3.350
74 HE1 PHE 13 HE1 PHE 13 -8.937 1.703 -7.331
75 HE2 PHE 13 HE2 PHE 13 -11.044 -0.357 -4.250
76 HZ PHE 13 HZ PHE 13 -11.060 1.089 -6.243
77 H ARG 14 H ARG 14 -3.514 -1.710 -5.445
78 HA ARG 14 HA ARG 14 -2.482 -2.749 -2.947
79 HB2 ARG 14 1HB ARG 14 -2.869 -4.716 -4.554
80 HB3 ARG 14 2HB ARG 14 -1.539 -4.050 -5.493
81 HG2 ARG 14 1HG ARG 14 -0.124 -4.202 -3.435
82 HG3 ARG 14 2HG ARG 14 -1.451 -5.076 -2.668
83 HD2 ARG 14 1HD ARG 14 0.200 -5.896 -5.042
84 HD3 ARG 14 2HD ARG 14 0.024 -6.724 -3.495
85 HE ARG 14 HE ARG 14 -2.012 -7.586 -4.203
86 HH11 ARG 14 1HH1 ARG 14 -0.726 -5.346 -6.538
87 HH12 ARG 14 2HH1 ARG 14 -1.825 -5.820 -7.791
88 HH21 ARG 14 1HH2 ARG 14 -3.464 -8.218 -5.845
89 HH22 ARG 14 2HH2 ARG 14 -3.382 -7.452 -7.395
90 H CYS 15 H CYS 15 -0.563 -1.848 -2.416
91 HA CYS 15 HA CYS 15 0.482 0.190 -4.195
92 HB2 CYS 15 1HB CYS 15 0.171 0.747 -1.841
93 HB3 CYS 15 2HB CYS 15 1.240 -0.569 -1.367
94 H ASP 16 H ASP 16 2.048 -0.209 -5.595
95 HA ASP 16 HA ASP 16 3.660 -2.605 -5.363
96 HB2 ASP 16 1HB ASP 16 2.633 -1.618 -7.529
97 HB3 ASP 16 2HB ASP 16 3.999 -0.506 -7.488
98 H THR 17 H THR 17 4.163 -0.842 -3.280
99 HA THR 17 HA THR 17 6.950 -0.108 -3.851
100 HB THR 17 HB THR 17 5.071 1.593 -2.200
101 HG1 THR 17 HG1 THR 17 5.811 1.644 -4.892
102 HG21 THR 17 3HG2 THR 17 7.206 1.933 -1.320
103 HG22 THR 17 1HG2 THR 17 7.052 3.222 -2.514
104 HG23 THR 17 2HG2 THR 17 7.985 1.774 -2.894
105 H CYS 18 H CYS 18 4.587 -0.354 -1.185
106 HA CYS 18 HA CYS 18 6.685 -1.654 0.424
107 HB2 CYS 18 1HB CYS 18 5.406 -0.883 2.409
108 HB3 CYS 18 2HB CYS 18 5.993 0.446 1.415
109 H ASP 19 H ASP 19 4.554 -2.708 -1.515
110 HA ASP 19 HA ASP 19 3.163 -4.501 -1.694
111 HB2 ASP 19 1HB ASP 19 5.007 -5.240 0.538
112 HB3 ASP 19 2HB ASP 19 3.627 -6.283 0.206
113 H LYS 20 H LYS 20 1.838 -2.421 -0.682
114 HA LYS 20 HA LYS 20 0.317 -3.467 1.610
115 HB2 LYS 20 1HB LYS 20 1.042 -0.735 0.712
116 HB3 LYS 20 2HB LYS 20 -0.561 -0.931 1.410
117 HG2 LYS 20 1HG LYS 20 0.660 -2.112 3.343
118 HG3 LYS 20 2HG LYS 20 2.112 -1.354 2.686
119 HD2 LYS 20 1HD LYS 20 1.404 0.769 3.207
120 HD3 LYS 20 2HD LYS 20 -0.305 0.330 3.144
121 HE2 LYS 20 1HE LYS 20 -0.293 -0.548 5.278
122 HE3 LYS 20 2HE LYS 20 1.443 -0.858 5.253
123 HZ1 LYS 20 3HZ LYS 20 1.760 1.593 5.307
124 HZ2 LYS 20 1HZ LYS 20 1.041 0.962 6.703
125 HZ3 LYS 20 2HZ LYS 20 0.096 1.767 5.555
126 H SER 21 H SER 21 -2.049 -2.488 1.525
127 HA SER 21 HA SER 21 -3.195 -2.447 -1.128
128 HB2 SER 21 1HB SER 21 -4.803 -4.346 -0.483
129 HB3 SER 21 2HB SER 21 -3.164 -4.803 -0.949
130 HG SER 21 HG SER 21 -2.791 -5.477 1.018
131 H PHE 22 H PHE 22 -5.254 -1.570 -1.186
132 HA PHE 22 HA PHE 22 -6.412 -0.765 1.395
133 HB2 PHE 22 1HB PHE 22 -6.134 0.993 -1.052
134 HB3 PHE 22 2HB PHE 22 -6.962 1.437 0.437
135 HD1 PHE 22 HD2 PHE 22 -3.635 0.165 -0.677
136 HD2 PHE 22 HD1 PHE 22 -5.809 2.708 1.955
137 HE1 PHE 22 HE2 PHE 22 -1.518 1.023 0.238
138 HE2 PHE 22 HE1 PHE 22 -3.695 3.571 2.873
139 HZ PHE 22 HZ PHE 22 -1.546 2.727 2.015
140 H ARG 23 H ARG 23 -8.707 0.133 1.034
141 HA ARG 23 HA ARG 23 -10.115 -1.787 -0.673
142 HB2 ARG 23 1HB ARG 23 -11.280 -0.013 1.476
143 HB3 ARG 23 2HB ARG 23 -12.047 -1.394 0.703
144 HG2 ARG 23 1HG ARG 23 -10.101 -2.758 1.682
145 HG3 ARG 23 2HG ARG 23 -9.841 -1.355 2.721
146 HD2 ARG 23 1HD ARG 23 -12.595 -2.452 2.494
147 HD3 ARG 23 2HD ARG 23 -11.415 -3.353 3.445
148 HE ARG 23 HE ARG 23 -11.313 -0.680 4.244
149 HH11 ARG 23 1HH1 ARG 23 -13.519 -3.373 4.318
150 HH12 ARG 23 2HH1 ARG 23 -14.312 -2.851 5.767
151 HH21 ARG 23 1HH2 ARG 23 -12.350 0.017 6.152
152 HH22 ARG 23 2HH2 ARG 23 -13.647 -0.922 6.809
153 H GLN 24 H GLN 24 -9.852 1.666 -0.009
154 HA GLN 24 HA GLN 24 -11.620 2.225 -2.286
155 HB2 GLN 24 1HB GLN 24 -10.587 4.218 -0.272
156 HB3 GLN 24 2HB GLN 24 -11.926 4.417 -1.395
157 HG2 GLN 24 1HG GLN 24 -12.073 2.235 0.617
158 HG3 GLN 24 2HG GLN 24 -12.327 3.898 1.147
159 HE21 GLN 24 1HE2 GLN 24 -13.812 5.127 -0.491
160 HE22 GLN 24 2HE2 GLN 24 -15.278 4.301 -0.883
161 H ARG 25 H ARG 25 -10.857 3.081 -4.121
162 HA ARG 25 HA ARG 25 -8.172 3.062 -4.783
163 HB2 ARG 25 1HB ARG 25 -10.129 3.130 -6.369
164 HB3 ARG 25 2HB ARG 25 -10.241 4.857 -6.055
165 HG2 ARG 25 1HG ARG 25 -7.945 5.134 -6.903
166 HG3 ARG 25 2HG ARG 25 -7.903 3.410 -7.281
167 HD2 ARG 25 1HD ARG 25 -8.458 4.487 -9.301
168 HD3 ARG 25 2HD ARG 25 -9.970 3.816 -8.692
169 HE ARG 25 HE ARG 25 -9.265 6.622 -8.913
170 HH11 ARG 25 1HH1 ARG 25 -11.451 4.233 -7.635
171 HH12 ARG 25 2HH1 ARG 25 -12.743 5.359 -7.386
172 HH21 ARG 25 1HH2 ARG 25 -10.959 8.114 -8.590
173 HH22 ARG 25 2HH2 ARG 25 -12.463 7.566 -7.931
174 H SER 26 H SER 26 -10.110 5.641 -3.407
175 HA SER 26 HA SER 26 -8.217 7.722 -3.797
176 HB2 SER 26 1HB SER 26 -10.573 8.220 -3.387
177 HB3 SER 26 2HB SER 26 -10.472 7.480 -1.790
178 HG SER 26 HG SER 26 -8.606 9.185 -1.676
179 H ALA 27 H ALA 27 -8.488 5.156 -1.524
180 HA ALA 27 HA ALA 27 -6.858 6.385 0.509
181 HB1 ALA 27 3HB ALA 27 -7.515 3.460 0.254
182 HB2 ALA 27 1HB ALA 27 -7.072 4.355 1.708
183 HB3 ALA 27 2HB ALA 27 -8.631 4.644 0.935
184 H LEU 28 H LEU 28 -6.385 4.197 -2.193
185 HA LEU 28 HA LEU 28 -3.619 3.691 -1.473
186 HB2 LEU 28 1HB LEU 28 -4.508 1.799 -2.413
187 HB3 LEU 28 2HB LEU 28 -5.502 2.704 -3.553
188 HG LEU 28 HG LEU 28 -3.095 3.280 -4.557
189 HD11 LEU 28 1HD1 LEU 28 -2.568 0.453 -3.882
190 HD12 LEU 28 2HD1 LEU 28 -2.274 1.640 -2.612
191 HD13 LEU 28 3HD1 LEU 28 -1.447 1.785 -4.162
192 HD21 LEU 28 3HD2 LEU 28 -3.967 0.602 -5.361
193 HD22 LEU 28 1HD2 LEU 28 -3.822 2.084 -6.307
194 HD23 LEU 28 2HD2 LEU 28 -5.257 1.805 -5.320
195 H ASN 29 H ASN 29 -5.384 5.240 -4.147
196 HA ASN 29 HA ASN 29 -3.264 6.109 -5.671
197 HB2 ASN 29 1HB ASN 29 -6.024 7.135 -5.192
198 HB3 ASN 29 2HB ASN 29 -4.899 8.170 -6.066
199 HD21 ASN 29 1HD2 ASN 29 -7.060 7.419 -7.390
200 HD22 ASN 29 2HD2 ASN 29 -6.696 6.211 -8.570
201 H SER 30 H SER 30 -4.373 7.306 -2.604
202 HA SER 30 HA SER 30 -2.733 9.704 -2.771
203 HB2 SER 30 1HB SER 30 -4.871 9.975 -1.693
204 HB3 SER 30 2HB SER 30 -4.547 8.628 -0.602
205 HG SER 30 HG SER 30 -2.670 10.654 -0.570
206 H HIS 31 H HIS 31 -2.797 6.608 -1.092
207 HA HIS 31 HA HIS 31 -0.688 7.070 0.698
208 HB2 HIS 31 1HB HIS 31 -1.996 5.163 1.125
209 HB3 HIS 31 2HB HIS 31 -1.837 4.575 -0.528
210 HD1 HIS 31 HD1 HIS 31 -0.007 4.724 2.737
211 HD2 HIS 31 HD2 HIS 31 0.446 3.065 -1.044
212 HE1 HIS 31 HE1 HIS 31 1.906 3.103 2.939
213 H ARG 32 H ARG 32 -0.717 5.996 -2.655
214 HA ARG 32 HA ARG 32 1.961 5.204 -2.866
215 HB2 ARG 32 1HB ARG 32 0.189 6.431 -4.988
216 HB3 ARG 32 2HB ARG 32 1.683 5.552 -5.286
217 HG2 ARG 32 1HG ARG 32 0.454 3.651 -3.957
218 HG3 ARG 32 2HG ARG 32 -0.986 4.535 -4.465
219 HD2 ARG 32 1HD ARG 32 -0.446 2.787 -6.065
220 HD3 ARG 32 2HD ARG 32 -0.251 4.380 -6.796
221 HE ARG 32 HE ARG 32 1.871 2.495 -6.120
222 HH11 ARG 32 1HH1 ARG 32 0.931 5.620 -7.332
223 HH12 ARG 32 2HH1 ARG 32 2.464 5.938 -8.075
224 HH21 ARG 32 1HH2 ARG 32 3.893 2.901 -7.094
225 HH22 ARG 32 2HH2 ARG 32 4.148 4.390 -7.939
226 H MET 33 H MET 33 0.514 8.342 -2.710
227 HA MET 33 HA MET 33 2.550 9.856 -3.933
228 HB2 MET 33 1HB MET 33 0.686 10.689 -1.703
229 HB3 MET 33 2HB MET 33 1.583 11.770 -2.761
230 HG2 MET 33 1HG MET 33 0.307 10.557 -4.662
231 HG3 MET 33 2HG MET 33 -0.788 10.066 -3.371
232 HE1 MET 33 3HE MET 33 -1.663 12.673 -6.020
233 HE2 MET 33 1HE MET 33 -2.046 11.073 -5.384
234 HE3 MET 33 2HE MET 33 -3.004 12.469 -4.892
235 H ILE 34 H ILE 34 2.022 8.909 -0.554
236 HA ILE 34 HA ILE 34 4.041 10.297 0.689
237 HB ILE 34 HB ILE 34 3.865 8.843 2.475
238 HG12 ILE 34 1HG1 ILE 34 3.548 6.710 0.387
239 HG13 ILE 34 2HG1 ILE 34 4.721 6.816 1.696
240 HG21 ILE 34 1HG2 ILE 34 1.625 9.710 1.546
241 HG22 ILE 34 2HG2 ILE 34 1.339 8.033 1.085
242 HG23 ILE 34 3HG2 ILE 34 1.592 8.450 2.780
243 HD11 ILE 34 3HD1 ILE 34 3.053 6.240 3.312
244 HD12 ILE 34 1HD1 ILE 34 1.784 6.308 2.089
245 HD13 ILE 34 2HD1 ILE 34 3.020 5.052 2.010
246 H HIS 35 H HIS 35 4.298 7.600 -1.475
247 HA HIS 35 HA HIS 35 7.061 7.054 -0.789
248 HB2 HIS 35 1HB HIS 35 5.322 5.955 -3.007
249 HB3 HIS 35 2HB HIS 35 6.938 5.381 -2.605
250 HD1 HIS 35 HD1 HIS 35 6.820 5.039 0.371
251 HD2 HIS 35 HD2 HIS 35 3.659 4.018 -2.124
252 HE1 HIS 35 HE1 HIS 35 5.466 3.354 1.656
253 H THR 36 H THR 36 5.331 8.132 -3.716
254 HA THR 36 HA THR 36 7.280 8.645 -5.469
255 HB THR 36 HB THR 36 6.023 10.451 -6.396
256 HG1 THR 36 HG1 THR 36 5.192 10.791 -3.741
257 HG21 THR 36 3HG2 THR 36 4.971 8.093 -6.199
258 HG22 THR 36 1HG2 THR 36 3.946 9.439 -6.695
259 HG23 THR 36 2HG2 THR 36 3.885 8.849 -5.033
260 H GLY 37 H GLY 37 8.894 10.121 -5.862
261 HA2 GLY 37 1HA GLY 37 9.831 11.588 -3.516
262 HA3 GLY 37 2HA GLY 37 10.760 11.246 -4.968
263 H GLU 38 H GLU 38 11.404 13.494 -4.862
264 HA GLU 38 HA GLU 38 9.333 15.290 -5.946
265 HB2 GLU 38 1HB GLU 38 11.649 15.946 -4.121
266 HB3 GLU 38 2HB GLU 38 10.666 17.158 -4.930
267 HG2 GLU 38 1HG GLU 38 8.709 16.447 -3.737
268 HG3 GLU 38 2HG GLU 38 9.588 15.097 -3.023
269 H LYS 39 H LYS 39 9.958 14.552 -8.062
270 HA LYS 39 HA LYS 39 12.636 15.300 -8.961
271 HB2 LYS 39 1HB LYS 39 11.247 13.114 -9.555
272 HB3 LYS 39 2HB LYS 39 10.597 14.157 -10.813
273 HG2 LYS 39 1HG LYS 39 12.634 14.360 -11.884
274 HG3 LYS 39 2HG LYS 39 13.551 13.927 -10.439
275 HD2 LYS 39 1HD LYS 39 11.696 11.906 -11.592
276 HD3 LYS 39 2HD LYS 39 13.215 12.223 -12.435
277 HE2 LYS 39 1HE LYS 39 14.360 11.875 -10.200
278 HE3 LYS 39 2HE LYS 39 12.818 11.256 -9.612
279 HZ1 LYS 39 3HZ LYS 39 12.910 9.636 -11.492
280 HZ2 LYS 39 1HZ LYS 39 14.099 9.412 -10.310
281 HZ3 LYS 39 2HZ LYS 39 14.499 10.139 -11.784
282 HA PRO 40 HA PRO 40 11.271 19.140 -10.644
283 HB2 PRO 40 1HB PRO 40 13.307 19.553 -12.392
284 HB3 PRO 40 2HB PRO 40 13.487 19.748 -10.644
285 HG2 PRO 40 1HG PRO 40 14.256 17.434 -12.381
286 HG3 PRO 40 2HG PRO 40 15.159 18.184 -11.051
287 HD2 PRO 40 1HD PRO 40 13.760 15.886 -10.748
288 HD3 PRO 40 2HD PRO 40 13.955 17.065 -9.435
289 H SER 41 H SER 41 11.187 16.236 -12.237
290 HA SER 41 HA SER 41 11.060 16.490 -14.883
291 HB2 SER 41 1HB SER 41 10.222 14.546 -13.413
292 HB3 SER 41 2HB SER 41 8.652 15.347 -13.476
293 HG SER 41 HG SER 41 9.996 13.941 -15.421
294 H GLY 42 H GLY 42 8.225 17.345 -12.881
295 HA2 GLY 42 1HA GLY 42 7.691 19.597 -14.667
296 HA3 GLY 42 2HA GLY 42 6.451 18.356 -14.552
297 HA PRO 43 HA PRO 43 6.585 21.434 -10.807
298 HB2 PRO 43 1HB PRO 43 5.464 23.698 -11.800
299 HB3 PRO 43 2HB PRO 43 7.210 23.429 -11.760
300 HG2 PRO 43 1HG PRO 43 5.293 23.093 -14.035
301 HG3 PRO 43 2HG PRO 43 6.912 23.817 -14.033
302 HD2 PRO 43 1HD PRO 43 6.445 21.295 -14.901
303 HD3 PRO 43 2HD PRO 43 7.966 21.769 -14.116
304 H SER 44 H SER 44 4.976 20.008 -10.084
305 HA SER 44 HA SER 44 2.233 20.622 -10.958
306 HB2 SER 44 1HB SER 44 1.610 18.399 -10.155
307 HB3 SER 44 2HB SER 44 2.940 18.277 -11.306
308 HG SER 44 HG SER 44 3.484 18.470 -8.556
309 H SER 45 H SER 45 3.462 22.352 -9.170
310 HA SER 45 HA SER 45 1.691 22.077 -6.888
311 HB2 SER 45 1HB SER 45 3.577 22.558 -5.281
312 HB3 SER 45 2HB SER 45 3.611 20.947 -5.998
313 HG SER 45 HG SER 45 5.215 21.643 -7.405
314 H GLY 46 H GLY 46 1.718 24.069 -5.517
315 HA2 GLY 46 1HA GLY 46 2.410 26.427 -7.160
316 HA3 GLY 46 2HA GLY 46 0.925 26.319 -6.226
Start of MODEL 17
1 H1 GLY 1 H GLY 1 15.604 -18.885 -3.521
2 HA2 GLY 1 1HA GLY 1 13.489 -17.593 -3.814
3 HA3 GLY 1 2HA GLY 1 14.444 -16.470 -4.771
4 H SER 2 H SER 2 13.488 -19.891 -4.637
5 HA SER 2 HA SER 2 14.165 -20.524 -7.284
6 HB2 SER 2 1HB SER 2 12.078 -21.730 -5.454
7 HB3 SER 2 2HB SER 2 12.566 -22.433 -6.996
8 HG SER 2 HG SER 2 14.803 -22.111 -5.873
9 H SER 3 H SER 3 10.937 -19.827 -5.931
10 HA SER 3 HA SER 3 10.210 -18.439 -8.380
11 HB2 SER 3 1HB SER 3 8.079 -19.787 -8.560
12 HB3 SER 3 2HB SER 3 9.549 -20.661 -8.989
13 HG SER 3 HG SER 3 8.072 -20.824 -6.576
14 H GLY 4 H GLY 4 8.090 -17.347 -8.188
15 HA2 GLY 4 1HA GLY 4 6.575 -17.162 -5.874
16 HA3 GLY 4 2HA GLY 4 7.889 -16.010 -5.687
17 H SER 5 H SER 5 4.850 -16.626 -7.102
18 HA SER 5 HA SER 5 4.990 -14.056 -8.537
19 HB2 SER 5 1HB SER 5 4.785 -15.871 -10.144
20 HB3 SER 5 2HB SER 5 3.402 -16.528 -9.270
21 HG SER 5 HG SER 5 3.392 -14.713 -11.187
22 H SER 6 H SER 6 3.575 -12.543 -7.941
23 HA SER 6 HA SER 6 2.116 -12.543 -5.661
24 HB2 SER 6 1HB SER 6 2.516 -10.553 -7.102
25 HB3 SER 6 2HB SER 6 1.261 -11.129 -8.198
26 HG SER 6 HG SER 6 0.119 -9.864 -6.906
27 H GLY 7 H GLY 7 0.594 -13.875 -4.948
28 HA2 GLY 7 1HA GLY 7 -1.001 -15.472 -6.708
29 HA3 GLY 7 2HA GLY 7 -1.135 -15.402 -4.957
30 H THR 8 H THR 8 -2.528 -13.901 -3.999
31 HA THR 8 HA THR 8 -4.219 -12.314 -5.786
32 HB THR 8 HB THR 8 -6.268 -13.088 -4.623
33 HG1 THR 8 HG1 THR 8 -4.469 -14.985 -3.485
34 HG21 THR 8 3HG2 THR 8 -5.712 -15.659 -5.534
35 HG22 THR 8 1HG2 THR 8 -4.656 -14.613 -6.483
36 HG23 THR 8 2HG2 THR 8 -6.397 -14.333 -6.473
37 H ALA 9 H ALA 9 -5.398 -10.631 -4.720
38 HA ALA 9 HA ALA 9 -4.385 -9.988 -2.028
39 HB1 ALA 9 3HB ALA 9 -3.415 -8.174 -2.858
40 HB2 ALA 9 1HB ALA 9 -4.056 -8.523 -4.464
41 HB3 ALA 9 2HB ALA 9 -5.006 -7.571 -3.322
42 H GLU 10 H GLU 10 -5.981 -9.973 -0.598
43 HA GLU 10 HA GLU 10 -8.601 -10.330 -0.860
44 HB2 GLU 10 1HB GLU 10 -7.220 -9.830 1.270
45 HB3 GLU 10 2HB GLU 10 -7.701 -8.159 1.013
46 HG2 GLU 10 1HG GLU 10 -9.287 -8.947 2.497
47 HG3 GLU 10 2HG GLU 10 -10.098 -9.074 0.937
48 H LYS 11 H LYS 11 -6.977 -7.258 -1.423
49 HA LYS 11 HA LYS 11 -9.513 -6.176 -2.467
50 HB2 LYS 11 1HB LYS 11 -7.167 -4.684 -1.277
51 HB3 LYS 11 2HB LYS 11 -8.589 -3.928 -1.984
52 HG2 LYS 11 1HG LYS 11 -8.371 -5.513 0.548
53 HG3 LYS 11 2HG LYS 11 -8.970 -3.869 0.314
54 HD2 LYS 11 1HD LYS 11 -10.301 -6.425 -0.580
55 HD3 LYS 11 2HD LYS 11 -10.831 -5.355 0.719
56 HE2 LYS 11 1HE LYS 11 -10.772 -3.581 -1.266
57 HE3 LYS 11 2HE LYS 11 -11.044 -5.036 -2.223
58 HZ1 LYS 11 3HZ LYS 11 -13.031 -3.672 -1.234
59 HZ2 LYS 11 1HZ LYS 11 -12.714 -4.603 0.143
60 HZ3 LYS 11 2HZ LYS 11 -13.094 -5.360 -1.320
61 HA PRO 12 HA PRO 12 -7.693 -5.802 -6.445
62 HB2 PRO 12 1HB PRO 12 -8.924 -3.568 -7.376
63 HB3 PRO 12 2HB PRO 12 -9.755 -5.117 -7.192
64 HG2 PRO 12 1HG PRO 12 -9.765 -2.735 -5.379
65 HG3 PRO 12 2HG PRO 12 -11.118 -3.766 -5.878
66 HD2 PRO 12 1HD PRO 12 -9.894 -4.029 -3.477
67 HD3 PRO 12 2HD PRO 12 -10.595 -5.409 -4.348
68 H PHE 13 H PHE 13 -7.602 -3.004 -4.319
69 HA PHE 13 HA PHE 13 -5.539 -1.696 -5.878
70 HB2 PHE 13 1HB PHE 13 -6.464 -0.904 -3.120
71 HB3 PHE 13 2HB PHE 13 -5.729 0.113 -4.355
72 HD1 PHE 13 HD2 PHE 13 -8.802 -1.558 -3.272
73 HD2 PHE 13 HD1 PHE 13 -7.028 1.017 -6.160
74 HE1 PHE 13 HE2 PHE 13 -11.040 -0.904 -4.059
75 HE2 PHE 13 HE1 PHE 13 -9.263 1.676 -6.951
76 HZ PHE 13 HZ PHE 13 -11.273 0.713 -5.901
77 H ARG 14 H ARG 14 -3.399 -1.705 -5.476
78 HA ARG 14 HA ARG 14 -2.368 -2.681 -2.945
79 HB2 ARG 14 1HB ARG 14 -2.731 -4.710 -4.373
80 HB3 ARG 14 2HB ARG 14 -1.579 -4.043 -5.523
81 HG2 ARG 14 1HG ARG 14 0.128 -4.042 -3.713
82 HG3 ARG 14 2HG ARG 14 -1.036 -4.880 -2.685
83 HD2 ARG 14 1HD ARG 14 -1.165 -6.678 -4.391
84 HD3 ARG 14 2HD ARG 14 0.104 -5.859 -5.299
85 HE ARG 14 HE ARG 14 0.927 -6.337 -2.630
86 HH11 ARG 14 1HH1 ARG 14 0.410 -7.934 -5.680
87 HH12 ARG 14 2HH1 ARG 14 1.578 -9.176 -5.376
88 HH21 ARG 14 1HH2 ARG 14 2.468 -7.967 -2.218
89 HH22 ARG 14 2HH2 ARG 14 2.748 -9.194 -3.406
90 H CYS 15 H CYS 15 -0.410 -1.828 -2.442
91 HA CYS 15 HA CYS 15 0.638 0.187 -4.258
92 HB2 CYS 15 1HB CYS 15 0.317 0.822 -1.932
93 HB3 CYS 15 2HB CYS 15 1.352 -0.500 -1.400
94 H ASP 16 H ASP 16 2.145 -0.340 -5.683
95 HA ASP 16 HA ASP 16 3.757 -2.711 -5.361
96 HB2 ASP 16 1HB ASP 16 2.791 -1.898 -7.561
97 HB3 ASP 16 2HB ASP 16 4.005 -0.622 -7.526
98 H THR 17 H THR 17 4.266 -0.913 -3.312
99 HA THR 17 HA THR 17 7.066 -0.223 -3.875
100 HB THR 17 HB THR 17 5.272 1.533 -2.199
101 HG1 THR 17 HG1 THR 17 4.584 2.306 -4.038
102 HG21 THR 17 3HG2 THR 17 7.124 3.156 -2.507
103 HG22 THR 17 1HG2 THR 17 8.048 1.900 -3.329
104 HG23 THR 17 2HG2 THR 17 7.616 1.707 -1.630
105 H CYS 18 H CYS 18 4.657 -0.459 -1.255
106 HA CYS 18 HA CYS 18 6.735 -1.729 0.406
107 HB2 CYS 18 1HB CYS 18 5.488 -0.896 2.369
108 HB3 CYS 18 2HB CYS 18 6.043 0.415 1.333
109 H ASP 19 H ASP 19 4.516 -2.722 -1.522
110 HA ASP 19 HA ASP 19 3.118 -4.510 -1.682
111 HB2 ASP 19 1HB ASP 19 4.966 -5.260 0.539
112 HB3 ASP 19 2HB ASP 19 3.554 -6.273 0.253
113 H LYS 20 H LYS 20 1.759 -2.465 -0.779
114 HA LYS 20 HA LYS 20 0.252 -3.429 1.562
115 HB2 LYS 20 1HB LYS 20 1.017 -0.722 0.626
116 HB3 LYS 20 2HB LYS 20 -0.595 -0.883 1.312
117 HG2 LYS 20 1HG LYS 20 0.584 -2.044 3.278
118 HG3 LYS 20 2HG LYS 20 2.059 -1.334 2.620
119 HD2 LYS 20 1HD LYS 20 0.991 0.895 2.736
120 HD3 LYS 20 2HD LYS 20 -0.422 0.150 3.487
121 HE2 LYS 20 1HE LYS 20 0.907 -0.561 5.374
122 HE3 LYS 20 2HE LYS 20 2.377 0.035 4.604
123 HZ1 LYS 20 3HZ LYS 20 0.617 1.431 6.257
124 HZ2 LYS 20 1HZ LYS 20 0.502 2.121 4.716
125 HZ3 LYS 20 2HZ LYS 20 2.005 2.015 5.485
126 H SER 21 H SER 21 -2.106 -2.492 1.475
127 HA SER 21 HA SER 21 -3.250 -2.453 -1.184
128 HB2 SER 21 1HB SER 21 -4.876 -4.333 -0.487
129 HB3 SER 21 2HB SER 21 -3.255 -4.799 -1.000
130 HG SER 21 HG SER 21 -2.677 -5.003 1.175
131 H PHE 22 H PHE 22 -5.297 -1.556 -1.254
132 HA PHE 22 HA PHE 22 -6.464 -0.729 1.316
133 HB2 PHE 22 1HB PHE 22 -6.121 1.020 -1.129
134 HB3 PHE 22 2HB PHE 22 -6.990 1.476 0.332
135 HD1 PHE 22 HD2 PHE 22 -3.639 0.202 -0.698
136 HD2 PHE 22 HD1 PHE 22 -5.877 2.720 1.904
137 HE1 PHE 22 HE2 PHE 22 -1.545 1.049 0.278
138 HE2 PHE 22 HE1 PHE 22 -3.786 3.572 2.884
139 HZ PHE 22 HZ PHE 22 -1.617 2.735 2.071
140 H ARG 23 H ARG 23 -8.750 0.088 1.025
141 HA ARG 23 HA ARG 23 -10.152 -1.751 -0.771
142 HB2 ARG 23 1HB ARG 23 -10.550 -1.384 1.839
143 HB3 ARG 23 2HB ARG 23 -11.611 -0.115 1.242
144 HG2 ARG 23 1HG ARG 23 -12.693 -1.873 -0.210
145 HG3 ARG 23 2HG ARG 23 -11.780 -3.066 0.715
146 HD2 ARG 23 1HD ARG 23 -12.991 -2.717 2.624
147 HD3 ARG 23 2HD ARG 23 -13.363 -1.044 2.211
148 HE ARG 23 HE ARG 23 -14.759 -2.392 0.365
149 HH11 ARG 23 1HH1 ARG 23 -14.502 -2.777 3.815
150 HH12 ARG 23 2HH1 ARG 23 -16.109 -3.398 3.997
151 HH21 ARG 23 1HH2 ARG 23 -16.876 -3.208 0.591
152 HH22 ARG 23 2HH2 ARG 23 -17.458 -3.644 2.162
153 H GLN 24 H GLN 24 -9.873 1.663 0.033
154 HA GLN 24 HA GLN 24 -11.738 2.338 -2.126
155 HB2 GLN 24 1HB GLN 24 -10.493 4.252 -0.158
156 HB3 GLN 24 2HB GLN 24 -11.912 4.509 -1.164
157 HG2 GLN 24 1HG GLN 24 -13.263 3.197 0.172
158 HG3 GLN 24 2HG GLN 24 -11.899 2.331 0.877
159 HE21 GLN 24 1HE2 GLN 24 -14.251 4.254 1.733
160 HE22 GLN 24 2HE2 GLN 24 -13.490 5.225 2.943
161 H ARG 25 H ARG 25 -11.059 3.150 -4.006
162 HA ARG 25 HA ARG 25 -8.406 3.098 -4.808
163 HB2 ARG 25 1HB ARG 25 -10.448 3.143 -6.289
164 HB3 ARG 25 2HB ARG 25 -10.530 4.877 -6.006
165 HG2 ARG 25 1HG ARG 25 -8.315 5.146 -7.002
166 HG3 ARG 25 2HG ARG 25 -8.237 3.406 -7.289
167 HD2 ARG 25 1HD ARG 25 -8.895 4.622 -9.307
168 HD3 ARG 25 2HD ARG 25 -10.176 3.546 -8.753
169 HE ARG 25 HE ARG 25 -10.504 6.173 -7.714
170 HH11 ARG 25 1HH1 ARG 25 -10.927 4.244 -10.582
171 HH12 ARG 25 2HH1 ARG 25 -12.210 5.224 -11.209
172 HH21 ARG 25 1HH2 ARG 25 -12.193 7.471 -8.530
173 HH22 ARG 25 2HH2 ARG 25 -12.929 7.060 -10.042
174 H SER 26 H SER 26 -10.250 5.672 -3.324
175 HA SER 26 HA SER 26 -8.312 7.720 -3.840
176 HB2 SER 26 1HB SER 26 -10.582 8.420 -3.529
177 HB3 SER 26 2HB SER 26 -10.695 7.577 -1.985
178 HG SER 26 HG SER 26 -8.701 9.505 -2.249
179 H ALA 27 H ALA 27 -8.574 5.184 -1.593
180 HA ALA 27 HA ALA 27 -7.031 6.459 0.494
181 HB1 ALA 27 3HB ALA 27 -7.918 3.596 0.158
182 HB2 ALA 27 1HB ALA 27 -7.118 4.252 1.586
183 HB3 ALA 27 2HB ALA 27 -8.715 4.839 1.122
184 H LEU 28 H LEU 28 -6.489 4.224 -2.160
185 HA LEU 28 HA LEU 28 -3.744 3.726 -1.371
186 HB2 LEU 28 1HB LEU 28 -4.633 1.840 -2.336
187 HB3 LEU 28 2HB LEU 28 -5.560 2.756 -3.523
188 HG LEU 28 HG LEU 28 -3.111 3.297 -4.426
189 HD11 LEU 28 1HD1 LEU 28 -1.589 1.509 -4.171
190 HD12 LEU 28 2HD1 LEU 28 -2.785 0.509 -3.347
191 HD13 LEU 28 3HD1 LEU 28 -2.124 1.934 -2.544
192 HD21 LEU 28 3HD2 LEU 28 -3.750 2.066 -6.191
193 HD22 LEU 28 1HD2 LEU 28 -5.241 1.839 -5.276
194 HD23 LEU 28 2HD2 LEU 28 -3.978 0.609 -5.222
195 H ASN 29 H ASN 29 -5.441 5.323 -4.057
196 HA ASN 29 HA ASN 29 -3.294 6.169 -5.554
197 HB2 ASN 29 1HB ASN 29 -6.024 7.281 -5.063
198 HB3 ASN 29 2HB ASN 29 -4.865 8.262 -5.954
199 HD21 ASN 29 1HD2 ASN 29 -7.018 7.638 -7.299
200 HD22 ASN 29 2HD2 ASN 29 -6.729 6.385 -8.453
201 H SER 30 H SER 30 -4.389 7.344 -2.474
202 HA SER 30 HA SER 30 -2.726 9.722 -2.594
203 HB2 SER 30 1HB SER 30 -4.751 8.631 -0.694
204 HB3 SER 30 2HB SER 30 -3.546 9.753 -0.063
205 HG SER 30 HG SER 30 -4.877 11.201 -0.815
206 H HIS 31 H HIS 31 -2.795 6.602 -0.942
207 HA HIS 31 HA HIS 31 -0.635 7.007 0.792
208 HB2 HIS 31 1HB HIS 31 -1.971 5.106 1.199
209 HB3 HIS 31 2HB HIS 31 -1.815 4.535 -0.460
210 HD1 HIS 31 HD1 HIS 31 0.061 4.694 2.790
211 HD2 HIS 31 HD2 HIS 31 0.421 2.975 -0.975
212 HE1 HIS 31 HE1 HIS 31 1.958 3.053 2.979
213 H ARG 32 H ARG 32 -0.746 5.942 -2.569
214 HA ARG 32 HA ARG 32 1.936 5.169 -2.835
215 HB2 ARG 32 1HB ARG 32 0.096 6.348 -4.925
216 HB3 ARG 32 2HB ARG 32 1.595 5.488 -5.252
217 HG2 ARG 32 1HG ARG 32 0.417 3.589 -3.860
218 HG3 ARG 32 2HG ARG 32 -1.041 4.443 -4.368
219 HD2 ARG 32 1HD ARG 32 -0.612 2.759 -5.991
220 HD3 ARG 32 2HD ARG 32 -0.187 4.306 -6.721
221 HE ARG 32 HE ARG 32 2.004 2.885 -5.478
222 HH11 ARG 32 1HH1 ARG 32 0.208 3.493 -8.398
223 HH12 ARG 32 2HH1 ARG 32 1.494 2.997 -9.447
224 HH21 ARG 32 1HH2 ARG 32 3.705 2.230 -6.850
225 HH22 ARG 32 2HH2 ARG 32 3.482 2.278 -8.566
226 H MET 33 H MET 33 0.455 8.291 -2.683
227 HA MET 33 HA MET 33 2.436 9.817 -3.975
228 HB2 MET 33 1HB MET 33 0.573 10.599 -1.726
229 HB3 MET 33 2HB MET 33 1.502 11.725 -2.706
230 HG2 MET 33 1HG MET 33 0.257 10.513 -4.680
231 HG3 MET 33 2HG MET 33 -0.901 10.129 -3.408
232 HE1 MET 33 3HE MET 33 -3.113 11.759 -3.689
233 HE2 MET 33 1HE MET 33 -2.253 11.613 -2.156
234 HE3 MET 33 2HE MET 33 -2.791 13.196 -2.717
235 H ILE 34 H ILE 34 2.054 8.821 -0.599
236 HA ILE 34 HA ILE 34 4.100 10.267 0.569
237 HB ILE 34 HB ILE 34 3.985 8.839 2.382
238 HG12 ILE 34 1HG1 ILE 34 3.560 6.673 0.345
239 HG13 ILE 34 2HG1 ILE 34 4.808 6.799 1.580
240 HG21 ILE 34 1HG2 ILE 34 1.406 8.066 1.055
241 HG22 ILE 34 2HG2 ILE 34 1.712 8.405 2.757
242 HG23 ILE 34 3HG2 ILE 34 1.727 9.718 1.580
243 HD11 ILE 34 3HD1 ILE 34 1.897 6.310 2.153
244 HD12 ILE 34 1HD1 ILE 34 3.121 5.048 2.024
245 HD13 ILE 34 2HD1 ILE 34 3.234 6.259 3.301
246 H HIS 35 H HIS 35 4.274 7.470 -1.498
247 HA HIS 35 HA HIS 35 7.054 6.945 -0.912
248 HB2 HIS 35 1HB HIS 35 5.246 5.831 -3.067
249 HB3 HIS 35 2HB HIS 35 6.868 5.251 -2.703
250 HD1 HIS 35 HD1 HIS 35 6.814 4.971 0.292
251 HD2 HIS 35 HD2 HIS 35 3.613 3.892 -2.127
252 HE1 HIS 35 HE1 HIS 35 5.490 3.305 1.632
253 H THR 36 H THR 36 5.184 8.293 -3.607
254 HA THR 36 HA THR 36 7.071 8.681 -5.519
255 HB THR 36 HB THR 36 5.855 10.633 -6.285
256 HG1 THR 36 HG1 THR 36 4.274 11.592 -4.949
257 HG21 THR 36 3HG2 THR 36 4.484 8.980 -6.967
258 HG22 THR 36 1HG2 THR 36 3.409 9.581 -5.705
259 HG23 THR 36 2HG2 THR 36 4.467 8.207 -5.382
260 H GLY 37 H GLY 37 6.596 10.671 -2.625
261 HA2 GLY 37 1HA GLY 37 8.152 11.954 -1.488
262 HA3 GLY 37 2HA GLY 37 9.357 11.484 -2.678
263 H GLU 38 H GLU 38 10.103 13.679 -2.626
264 HA GLU 38 HA GLU 38 8.615 15.360 -4.492
265 HB2 GLU 38 1HB GLU 38 8.862 17.350 -3.115
266 HB3 GLU 38 2HB GLU 38 7.947 16.124 -2.250
267 HG2 GLU 38 1HG GLU 38 9.666 15.696 -0.766
268 HG3 GLU 38 2HG GLU 38 10.894 16.361 -1.841
269 H LYS 39 H LYS 39 9.917 17.027 -5.477
270 HA LYS 39 HA LYS 39 12.687 17.302 -5.006
271 HB2 LYS 39 1HB LYS 39 13.601 16.149 -6.931
272 HB3 LYS 39 2HB LYS 39 12.722 15.005 -5.925
273 HG2 LYS 39 1HG LYS 39 10.766 15.315 -7.481
274 HG3 LYS 39 2HG LYS 39 11.862 16.201 -8.544
275 HD2 LYS 39 1HD LYS 39 13.293 14.257 -8.743
276 HD3 LYS 39 2HD LYS 39 12.293 13.370 -7.590
277 HE2 LYS 39 1HE LYS 39 11.243 14.468 -10.189
278 HE3 LYS 39 2HE LYS 39 11.900 12.841 -10.025
279 HZ1 LYS 39 3HZ LYS 39 9.549 12.722 -9.795
280 HZ2 LYS 39 1HZ LYS 39 9.526 13.959 -8.640
281 HZ3 LYS 39 2HZ LYS 39 10.215 12.461 -8.262
282 HA PRO 40 HA PRO 40 11.909 20.878 -7.442
283 HB2 PRO 40 1HB PRO 40 14.448 21.532 -8.143
284 HB3 PRO 40 2HB PRO 40 13.815 21.758 -6.508
285 HG2 PRO 40 1HG PRO 40 15.522 19.549 -7.589
286 HG3 PRO 40 2HG PRO 40 15.655 20.414 -6.047
287 HD2 PRO 40 1HD PRO 40 14.528 17.960 -6.248
288 HD3 PRO 40 2HD PRO 40 13.992 19.163 -5.057
289 H SER 41 H SER 41 14.159 18.506 -8.838
290 HA SER 41 HA SER 41 13.927 19.414 -11.506
291 HB2 SER 41 1HB SER 41 15.075 17.397 -12.127
292 HB3 SER 41 2HB SER 41 15.762 17.943 -10.598
293 HG SER 41 HG SER 41 15.310 15.697 -10.592
294 H GLY 42 H GLY 42 12.130 19.411 -12.677
295 HA2 GLY 42 1HA GLY 42 10.705 17.597 -13.829
296 HA3 GLY 42 2HA GLY 42 10.129 17.305 -12.195
297 HA PRO 43 HA PRO 43 7.724 20.743 -14.459
298 HB2 PRO 43 1HB PRO 43 5.497 19.329 -15.098
299 HB3 PRO 43 2HB PRO 43 6.885 19.477 -16.183
300 HG2 PRO 43 1HG PRO 43 6.146 17.231 -14.347
301 HG3 PRO 43 2HG PRO 43 6.747 17.162 -16.014
302 HD2 PRO 43 1HD PRO 43 8.346 16.735 -13.871
303 HD3 PRO 43 2HD PRO 43 8.938 17.477 -15.371
304 H SER 44 H SER 44 7.384 18.538 -11.909
305 HA SER 44 HA SER 44 4.888 19.566 -10.890
306 HB2 SER 44 1HB SER 44 5.245 18.067 -9.019
307 HB3 SER 44 2HB SER 44 5.626 17.211 -10.512
308 HG SER 44 HG SER 44 7.864 18.306 -9.784
309 H SER 45 H SER 45 4.617 21.246 -9.573
310 HA SER 45 HA SER 45 6.901 22.236 -8.021
311 HB2 SER 45 1HB SER 45 6.886 23.634 -9.993
312 HB3 SER 45 2HB SER 45 5.151 23.909 -9.837
313 HG SER 45 HG SER 45 6.075 25.670 -8.937
314 H GLY 46 H GLY 46 6.358 23.378 -6.131
315 HA2 GLY 46 1HA GLY 46 4.368 24.476 -4.972
316 HA3 GLY 46 2HA GLY 46 3.574 22.936 -5.263
Start of MODEL 18
1 H1 GLY 1 H GLY 1 2.903 -22.235 6.722
2 HA2 GLY 1 1HA GLY 1 0.820 -22.420 8.812
3 HA3 GLY 1 2HA GLY 1 1.267 -20.899 8.054
4 H SER 2 H SER 2 -0.734 -23.638 7.898
5 HA SER 2 HA SER 2 -1.344 -23.837 5.195
6 HB2 SER 2 1HB SER 2 -2.156 -25.401 6.947
7 HB3 SER 2 2HB SER 2 -3.273 -24.157 7.508
8 HG SER 2 HG SER 2 -3.831 -24.254 5.045
9 H SER 3 H SER 3 -1.841 -22.198 3.897
10 HA SER 3 HA SER 3 -4.084 -20.473 4.614
11 HB2 SER 3 1HB SER 3 -2.886 -18.437 3.955
12 HB3 SER 3 2HB SER 3 -2.071 -19.228 5.305
13 HG SER 3 HG SER 3 -0.535 -18.666 3.786
14 H GLY 4 H GLY 4 -5.289 -19.774 2.880
15 HA2 GLY 4 1HA GLY 4 -4.357 -20.646 0.215
16 HA3 GLY 4 2HA GLY 4 -6.001 -20.940 0.762
17 H SER 5 H SER 5 -5.039 -19.441 -1.567
18 HA SER 5 HA SER 5 -6.741 -17.154 -1.271
19 HB2 SER 5 1HB SER 5 -3.761 -16.825 -1.334
20 HB3 SER 5 2HB SER 5 -4.787 -15.610 -2.096
21 HG SER 5 HG SER 5 -4.186 -15.802 0.444
22 H SER 6 H SER 6 -7.889 -17.456 -3.066
23 HA SER 6 HA SER 6 -6.945 -18.684 -5.415
24 HB2 SER 6 1HB SER 6 -9.393 -17.122 -4.691
25 HB3 SER 6 2HB SER 6 -9.075 -17.471 -6.390
26 HG SER 6 HG SER 6 -8.707 -19.738 -5.357
27 H GLY 7 H GLY 7 -7.568 -15.255 -4.679
28 HA2 GLY 7 1HA GLY 7 -6.408 -14.427 -7.204
29 HA3 GLY 7 2HA GLY 7 -7.071 -13.375 -5.963
30 H THR 8 H THR 8 -5.305 -11.966 -6.086
31 HA THR 8 HA THR 8 -2.783 -13.055 -5.016
32 HB THR 8 HB THR 8 -2.465 -12.208 -7.276
33 HG1 THR 8 HG1 THR 8 -0.738 -11.839 -5.879
34 HG21 THR 8 3HG2 THR 8 -3.006 -9.400 -6.522
35 HG22 THR 8 1HG2 THR 8 -4.417 -10.429 -6.770
36 HG23 THR 8 2HG2 THR 8 -3.236 -10.225 -8.064
37 H ALA 9 H ALA 9 -5.079 -10.383 -4.913
38 HA ALA 9 HA ALA 9 -4.092 -9.722 -2.231
39 HB1 ALA 9 3HB ALA 9 -3.216 -7.811 -2.953
40 HB2 ALA 9 1HB ALA 9 -3.889 -8.040 -4.567
41 HB3 ALA 9 2HB ALA 9 -4.857 -7.272 -3.308
42 H GLU 10 H GLU 10 -5.739 -10.000 -0.888
43 HA GLU 10 HA GLU 10 -8.326 -10.511 -1.355
44 HB2 GLU 10 1HB GLU 10 -8.807 -9.242 0.855
45 HB3 GLU 10 2HB GLU 10 -7.720 -10.624 0.885
46 HG2 GLU 10 1HG GLU 10 -5.864 -8.840 0.557
47 HG3 GLU 10 2HG GLU 10 -7.093 -7.719 1.141
48 H LYS 11 H LYS 11 -6.812 -7.408 -1.694
49 HA LYS 11 HA LYS 11 -9.418 -6.235 -2.418
50 HB2 LYS 11 1HB LYS 11 -6.968 -4.735 -1.483
51 HB3 LYS 11 2HB LYS 11 -8.572 -4.072 -1.763
52 HG2 LYS 11 1HG LYS 11 -7.770 -6.005 0.399
53 HG3 LYS 11 2HG LYS 11 -8.209 -4.307 0.596
54 HD2 LYS 11 1HD LYS 11 -9.976 -6.611 -0.191
55 HD3 LYS 11 2HD LYS 11 -10.122 -5.553 1.214
56 HE2 LYS 11 1HE LYS 11 -10.415 -3.662 -0.503
57 HE3 LYS 11 2HE LYS 11 -10.709 -4.952 -1.667
58 HZ1 LYS 11 3HZ LYS 11 -12.598 -3.819 -0.129
59 HZ2 LYS 11 1HZ LYS 11 -12.217 -5.193 0.781
60 HZ3 LYS 11 2HZ LYS 11 -12.725 -5.356 -0.824
61 HA PRO 12 HA PRO 12 -7.958 -5.608 -6.511
62 HB2 PRO 12 1HB PRO 12 -9.282 -3.335 -7.184
63 HB3 PRO 12 2HB PRO 12 -10.083 -4.903 -7.028
64 HG2 PRO 12 1HG PRO 12 -9.949 -2.641 -5.072
65 HG3 PRO 12 2HG PRO 12 -11.334 -3.656 -5.516
66 HD2 PRO 12 1HD PRO 12 -9.900 -4.055 -3.253
67 HD3 PRO 12 2HD PRO 12 -10.665 -5.386 -4.146
68 H PHE 13 H PHE 13 -7.566 -3.092 -4.132
69 HA PHE 13 HA PHE 13 -5.623 -1.688 -5.811
70 HB2 PHE 13 1HB PHE 13 -6.518 -0.879 -3.047
71 HB3 PHE 13 2HB PHE 13 -5.777 0.128 -4.287
72 HD1 PHE 13 HD1 PHE 13 -7.076 0.967 -6.151
73 HD2 PHE 13 HD2 PHE 13 -8.862 -1.433 -3.124
74 HE1 PHE 13 HE1 PHE 13 -9.307 1.647 -6.933
75 HE2 PHE 13 HE2 PHE 13 -11.096 -0.758 -3.902
76 HZ PHE 13 HZ PHE 13 -11.321 0.784 -5.809
77 H ARG 14 H ARG 14 -3.476 -1.678 -5.420
78 HA ARG 14 HA ARG 14 -2.429 -2.684 -2.904
79 HB2 ARG 14 1HB ARG 14 -2.785 -4.684 -4.389
80 HB3 ARG 14 2HB ARG 14 -1.619 -3.987 -5.505
81 HG2 ARG 14 1HG ARG 14 0.051 -4.012 -3.643
82 HG3 ARG 14 2HG ARG 14 -1.125 -4.920 -2.690
83 HD2 ARG 14 1HD ARG 14 0.473 -6.419 -3.753
84 HD3 ARG 14 2HD ARG 14 -1.150 -6.674 -4.393
85 HE ARG 14 HE ARG 14 -0.066 -4.921 -6.143
86 HH11 ARG 14 1HH1 ARG 14 0.983 -7.985 -4.865
87 HH12 ARG 14 2HH1 ARG 14 1.868 -8.424 -6.288
88 HH21 ARG 14 1HH2 ARG 14 1.096 -5.487 -8.023
89 HH22 ARG 14 2HH2 ARG 14 1.932 -7.002 -8.083
90 H CYS 15 H CYS 15 -0.469 -1.833 -2.395
91 HA CYS 15 HA CYS 15 0.550 0.233 -4.167
92 HB2 CYS 15 1HB CYS 15 0.260 0.830 -1.839
93 HB3 CYS 15 2HB CYS 15 1.262 -0.524 -1.328
94 H ASP 16 H ASP 16 2.095 -0.188 -5.584
95 HA ASP 16 HA ASP 16 3.699 -2.581 -5.373
96 HB2 ASP 16 1HB ASP 16 4.573 -1.945 -7.565
97 HB3 ASP 16 2HB ASP 16 2.814 -1.848 -7.552
98 H THR 17 H THR 17 4.174 -0.817 -3.254
99 HA THR 17 HA THR 17 6.989 -0.137 -3.760
100 HB THR 17 HB THR 17 5.179 1.576 -2.056
101 HG1 THR 17 HG1 THR 17 4.614 2.580 -3.825
102 HG21 THR 17 3HG2 THR 17 7.455 1.799 -1.395
103 HG22 THR 17 1HG2 THR 17 7.077 3.207 -2.386
104 HG23 THR 17 2HG2 THR 17 8.003 1.870 -3.070
105 H CYS 18 H CYS 18 4.580 -0.346 -1.133
106 HA CYS 18 HA CYS 18 6.616 -1.727 0.489
107 HB2 CYS 18 1HB CYS 18 5.365 -0.916 2.468
108 HB3 CYS 18 2HB CYS 18 5.988 0.399 1.478
109 H ASP 19 H ASP 19 4.636 -2.817 -1.477
110 HA ASP 19 HA ASP 19 3.113 -4.507 -1.675
111 HB2 ASP 19 1HB ASP 19 3.597 -6.481 -0.349
112 HB3 ASP 19 2HB ASP 19 5.108 -5.709 -0.820
113 H LYS 20 H LYS 20 1.786 -2.456 -0.707
114 HA LYS 20 HA LYS 20 0.271 -3.457 1.611
115 HB2 LYS 20 1HB LYS 20 1.018 -0.737 0.689
116 HB3 LYS 20 2HB LYS 20 -0.578 -0.915 1.405
117 HG2 LYS 20 1HG LYS 20 0.615 -2.064 3.348
118 HG3 LYS 20 2HG LYS 20 2.100 -1.404 2.659
119 HD2 LYS 20 1HD LYS 20 0.811 0.847 2.679
120 HD3 LYS 20 2HD LYS 20 -0.245 0.037 3.838
121 HE2 LYS 20 1HE LYS 20 2.748 0.209 4.136
122 HE3 LYS 20 2HE LYS 20 1.628 1.370 4.847
123 HZ1 LYS 20 3HZ LYS 20 2.213 -1.361 5.636
124 HZ2 LYS 20 1HZ LYS 20 0.582 -0.917 5.708
125 HZ3 LYS 20 2HZ LYS 20 1.736 -0.038 6.578
126 H SER 21 H SER 21 -2.085 -2.476 1.530
127 HA SER 21 HA SER 21 -3.241 -2.411 -1.117
128 HB2 SER 21 1HB SER 21 -4.846 -4.315 -0.495
129 HB3 SER 21 2HB SER 21 -3.207 -4.770 -0.960
130 HG SER 21 HG SER 21 -2.721 -4.864 1.305
131 H PHE 22 H PHE 22 -5.326 -1.571 -1.154
132 HA PHE 22 HA PHE 22 -6.468 -0.785 1.439
133 HB2 PHE 22 1HB PHE 22 -6.213 1.013 -0.982
134 HB3 PHE 22 2HB PHE 22 -7.008 1.433 0.531
135 HD1 PHE 22 HD2 PHE 22 -3.710 0.158 -0.663
136 HD2 PHE 22 HD1 PHE 22 -5.818 2.683 2.038
137 HE1 PHE 22 HE2 PHE 22 -1.571 0.991 0.222
138 HE2 PHE 22 HE1 PHE 22 -3.683 3.521 2.927
139 HZ PHE 22 HZ PHE 22 -1.555 2.674 2.021
140 H ARG 23 H ARG 23 -8.759 0.182 1.038
141 HA ARG 23 HA ARG 23 -10.162 -1.698 -0.733
142 HB2 ARG 23 1HB ARG 23 -11.231 -0.138 1.626
143 HB3 ARG 23 2HB ARG 23 -12.119 -1.330 0.687
144 HG2 ARG 23 1HG ARG 23 -10.492 -3.049 1.409
145 HG3 ARG 23 2HG ARG 23 -9.723 -1.836 2.435
146 HD2 ARG 23 1HD ARG 23 -11.148 -2.904 3.911
147 HD3 ARG 23 2HD ARG 23 -12.102 -1.510 3.407
148 HE ARG 23 HE ARG 23 -12.648 -3.706 1.723
149 HH11 ARG 23 1HH1 ARG 23 -13.213 -2.556 4.960
150 HH12 ARG 23 2HH1 ARG 23 -14.703 -3.422 5.147
151 HH21 ARG 23 1HH2 ARG 23 -14.608 -4.850 1.957
152 HH22 ARG 23 2HH2 ARG 23 -15.494 -4.726 3.438
153 H GLN 24 H GLN 24 -9.765 1.686 0.052
154 HA GLN 24 HA GLN 24 -11.706 2.415 -2.028
155 HB2 GLN 24 1HB GLN 24 -10.393 4.362 -0.154
156 HB3 GLN 24 2HB GLN 24 -11.920 4.519 -1.011
157 HG2 GLN 24 1HG GLN 24 -11.591 2.382 1.042
158 HG3 GLN 24 2HG GLN 24 -11.892 4.045 1.542
159 HE21 GLN 24 1HE2 GLN 24 -13.685 5.045 -0.027
160 HE22 GLN 24 2HE2 GLN 24 -15.134 4.106 -0.085
161 H ARG 25 H ARG 25 -11.055 3.227 -3.916
162 HA ARG 25 HA ARG 25 -8.423 3.151 -4.777
163 HB2 ARG 25 1HB ARG 25 -10.506 3.246 -6.205
164 HB3 ARG 25 2HB ARG 25 -10.539 4.979 -5.912
165 HG2 ARG 25 1HG ARG 25 -8.339 5.197 -6.958
166 HG3 ARG 25 2HG ARG 25 -8.317 3.459 -7.260
167 HD2 ARG 25 1HD ARG 25 -9.041 4.339 -9.285
168 HD3 ARG 25 2HD ARG 25 -10.543 3.868 -8.491
169 HE ARG 25 HE ARG 25 -10.272 6.447 -7.761
170 HH11 ARG 25 1HH1 ARG 25 -10.129 4.833 -10.843
171 HH12 ARG 25 2HH1 ARG 25 -10.725 6.196 -11.731
172 HH21 ARG 25 1HH2 ARG 25 -11.057 8.248 -8.920
173 HH22 ARG 25 2HH2 ARG 25 -11.252 8.138 -10.637
174 H SER 26 H SER 26 -10.148 5.673 -3.118
175 HA SER 26 HA SER 26 -8.235 7.737 -3.698
176 HB2 SER 26 1HB SER 26 -10.579 8.297 -3.227
177 HB3 SER 26 2HB SER 26 -10.421 7.624 -1.605
178 HG SER 26 HG SER 26 -9.670 9.482 -1.014
179 H ALA 27 H ALA 27 -8.436 5.159 -1.478
180 HA ALA 27 HA ALA 27 -6.762 6.368 0.545
181 HB1 ALA 27 3HB ALA 27 -7.260 4.581 1.842
182 HB2 ALA 27 1HB ALA 27 -8.595 4.428 0.699
183 HB3 ALA 27 2HB ALA 27 -7.148 3.437 0.504
184 H LEU 28 H LEU 28 -6.392 4.215 -2.195
185 HA LEU 28 HA LEU 28 -3.614 3.658 -1.545
186 HB2 LEU 28 1HB LEU 28 -4.579 1.780 -2.454
187 HB3 LEU 28 2HB LEU 28 -5.558 2.705 -3.591
188 HG LEU 28 HG LEU 28 -3.153 3.216 -4.623
189 HD11 LEU 28 1HD1 LEU 28 -1.962 1.931 -2.910
190 HD12 LEU 28 2HD1 LEU 28 -1.733 1.249 -4.520
191 HD13 LEU 28 3HD1 LEU 28 -2.847 0.482 -3.388
192 HD21 LEU 28 3HD2 LEU 28 -5.342 1.812 -5.376
193 HD22 LEU 28 1HD2 LEU 28 -4.120 0.540 -5.361
194 HD23 LEU 28 2HD2 LEU 28 -3.883 1.978 -6.354
195 H ASN 29 H ASN 29 -5.447 5.259 -4.139
196 HA ASN 29 HA ASN 29 -3.348 6.097 -5.726
197 HB2 ASN 29 1HB ASN 29 -6.088 7.158 -5.187
198 HB3 ASN 29 2HB ASN 29 -4.972 8.153 -6.118
199 HD21 ASN 29 1HD2 ASN 29 -7.287 7.263 -7.237
200 HD22 ASN 29 2HD2 ASN 29 -6.940 6.079 -8.446
201 H SER 30 H SER 30 -4.373 7.288 -2.633
202 HA SER 30 HA SER 30 -2.704 9.669 -2.844
203 HB2 SER 30 1HB SER 30 -4.913 9.881 -1.782
204 HB3 SER 30 2HB SER 30 -4.445 8.693 -0.566
205 HG SER 30 HG SER 30 -4.202 11.117 -0.162
206 H HIS 31 H HIS 31 -2.814 6.573 -1.191
207 HA HIS 31 HA HIS 31 -0.716 7.017 0.631
208 HB2 HIS 31 1HB HIS 31 -2.030 5.137 1.092
209 HB3 HIS 31 2HB HIS 31 -1.945 4.553 -0.567
210 HD1 HIS 31 HD1 HIS 31 -0.020 4.608 2.642
211 HD2 HIS 31 HD2 HIS 31 0.286 2.990 -1.172
212 HE1 HIS 31 HE1 HIS 31 1.849 2.930 2.772
213 H ARG 32 H ARG 32 -0.752 5.947 -2.719
214 HA ARG 32 HA ARG 32 1.915 5.095 -2.908
215 HB2 ARG 32 1HB ARG 32 0.103 6.283 -5.016
216 HB3 ARG 32 2HB ARG 32 1.643 5.502 -5.351
217 HG2 ARG 32 1HG ARG 32 0.745 3.425 -4.322
218 HG3 ARG 32 2HG ARG 32 -0.819 4.229 -4.181
219 HD2 ARG 32 1HD ARG 32 0.688 3.778 -6.755
220 HD3 ARG 32 2HD ARG 32 -0.665 2.803 -6.184
221 HE ARG 32 HE ARG 32 -1.683 5.306 -6.211
222 HH11 ARG 32 1HH1 ARG 32 0.005 3.389 -8.576
223 HH12 ARG 32 2HH1 ARG 32 -0.786 4.125 -9.930
224 HH21 ARG 32 1HH2 ARG 32 -2.732 6.284 -7.985
225 HH22 ARG 32 2HH2 ARG 32 -2.342 5.773 -9.593
226 H MET 33 H MET 33 0.507 8.259 -2.823
227 HA MET 33 HA MET 33 2.580 9.722 -4.042
228 HB2 MET 33 1HB MET 33 0.641 10.572 -1.884
229 HB3 MET 33 2HB MET 33 1.641 11.665 -2.832
230 HG2 MET 33 1HG MET 33 0.466 10.520 -4.859
231 HG3 MET 33 2HG MET 33 -0.744 10.083 -3.655
232 HE1 MET 33 3HE MET 33 -2.107 11.358 -5.639
233 HE2 MET 33 1HE MET 33 -2.916 11.567 -4.086
234 HE3 MET 33 2HE MET 33 -2.731 12.942 -5.176
235 H ILE 34 H ILE 34 1.980 8.895 -0.640
236 HA ILE 34 HA ILE 34 3.993 10.258 0.611
237 HB ILE 34 HB ILE 34 3.788 8.822 2.404
238 HG12 ILE 34 1HG1 ILE 34 3.506 6.659 0.338
239 HG13 ILE 34 2HG1 ILE 34 4.684 6.799 1.639
240 HG21 ILE 34 1HG2 ILE 34 1.553 9.650 1.395
241 HG22 ILE 34 2HG2 ILE 34 1.295 7.951 1.000
242 HG23 ILE 34 3HG2 ILE 34 1.518 8.443 2.679
243 HD11 ILE 34 3HD1 ILE 34 3.019 5.019 2.000
244 HD12 ILE 34 1HD1 ILE 34 3.017 6.240 3.272
245 HD13 ILE 34 2HD1 ILE 34 1.755 6.248 2.040
246 H HIS 35 H HIS 35 4.278 7.515 -1.504
247 HA HIS 35 HA HIS 35 7.035 6.992 -0.787
248 HB2 HIS 35 1HB HIS 35 5.335 5.865 -3.022
249 HB3 HIS 35 2HB HIS 35 6.939 5.293 -2.573
250 HD1 HIS 35 HD1 HIS 35 6.786 4.943 0.378
251 HD2 HIS 35 HD2 HIS 35 3.607 3.998 -2.125
252 HE1 HIS 35 HE1 HIS 35 5.387 3.294 1.661
253 H THR 36 H THR 36 6.608 9.637 -1.619
254 HA THR 36 HA THR 36 8.249 9.682 -4.057
255 HB THR 36 HB THR 36 7.057 11.617 -4.914
256 HG1 THR 36 HG1 THR 36 5.142 12.319 -3.840
257 HG21 THR 36 3HG2 THR 36 4.659 10.069 -4.510
258 HG22 THR 36 1HG2 THR 36 6.038 9.011 -4.802
259 HG23 THR 36 2HG2 THR 36 5.628 10.268 -5.969
260 H GLY 37 H GLY 37 9.600 11.554 -4.285
261 HA2 GLY 37 1HA GLY 37 10.146 13.764 -3.166
262 HA3 GLY 37 2HA GLY 37 10.185 12.821 -1.683
263 H GLU 38 H GLU 38 11.830 11.168 -1.473
264 HA GLU 38 HA GLU 38 14.351 12.080 -2.508
265 HB2 GLU 38 1HB GLU 38 15.253 10.134 -1.168
266 HB3 GLU 38 2HB GLU 38 14.365 11.344 -0.252
267 HG2 GLU 38 1HG GLU 38 12.552 9.952 0.087
268 HG3 GLU 38 2HG GLU 38 12.966 8.914 -1.276
269 H LYS 39 H LYS 39 13.244 11.542 -4.751
270 HA LYS 39 HA LYS 39 14.318 8.927 -5.570
271 HB2 LYS 39 1HB LYS 39 11.778 10.208 -6.599
272 HB3 LYS 39 2HB LYS 39 12.480 8.707 -7.189
273 HG2 LYS 39 1HG LYS 39 11.504 9.155 -4.376
274 HG3 LYS 39 2HG LYS 39 10.582 8.362 -5.655
275 HD2 LYS 39 1HD LYS 39 12.255 6.616 -5.822
276 HD3 LYS 39 2HD LYS 39 13.266 7.436 -4.630
277 HE2 LYS 39 1HE LYS 39 11.233 7.226 -3.071
278 HE3 LYS 39 2HE LYS 39 10.637 6.043 -4.234
279 HZ1 LYS 39 3HZ LYS 39 13.165 5.220 -3.830
280 HZ2 LYS 39 1HZ LYS 39 11.814 4.606 -3.017
281 HZ3 LYS 39 2HZ LYS 39 12.760 5.808 -2.296
282 HA PRO 40 HA PRO 40 16.180 12.413 -8.028
283 HB2 PRO 40 1HB PRO 40 18.742 11.561 -7.750
284 HB3 PRO 40 2HB PRO 40 17.947 12.615 -6.575
285 HG2 PRO 40 1HG PRO 40 18.375 9.654 -6.477
286 HG3 PRO 40 2HG PRO 40 18.566 10.855 -5.186
287 HD2 PRO 40 1HD PRO 40 16.375 9.278 -5.396
288 HD3 PRO 40 2HD PRO 40 16.304 10.929 -4.749
289 H SER 41 H SER 41 16.068 9.000 -8.145
290 HA SER 41 HA SER 41 17.626 8.447 -10.405
291 HB2 SER 41 1HB SER 41 16.427 6.838 -8.736
292 HB3 SER 41 2HB SER 41 15.071 6.965 -9.856
293 HG SER 41 HG SER 41 16.977 6.493 -11.442
294 H GLY 42 H GLY 42 17.299 10.097 -11.930
295 HA2 GLY 42 1HA GLY 42 16.417 10.845 -13.924
296 HA3 GLY 42 2HA GLY 42 15.224 9.559 -13.820
297 HA PRO 43 HA PRO 43 12.667 13.265 -13.394
298 HB2 PRO 43 1HB PRO 43 10.369 12.019 -14.127
299 HB3 PRO 43 2HB PRO 43 11.556 12.610 -15.295
300 HG2 PRO 43 1HG PRO 43 11.141 9.834 -14.255
301 HG3 PRO 43 2HG PRO 43 11.456 10.371 -15.915
302 HD2 PRO 43 1HD PRO 43 13.391 9.340 -14.326
303 HD3 PRO 43 2HD PRO 43 13.722 10.581 -15.551
304 H SER 44 H SER 44 11.238 13.917 -11.811
305 HA SER 44 HA SER 44 10.204 11.904 -9.954
306 HB2 SER 44 1HB SER 44 12.287 12.598 -8.932
307 HB3 SER 44 2HB SER 44 11.872 14.298 -9.148
308 HG SER 44 HG SER 44 9.887 13.132 -7.830
309 H SER 45 H SER 45 8.080 12.226 -10.169
310 HA SER 45 HA SER 45 6.737 14.465 -10.993
311 HB2 SER 45 1HB SER 45 4.743 13.535 -9.891
312 HB3 SER 45 2HB SER 45 5.664 12.271 -10.705
313 HG SER 45 HG SER 45 6.679 12.239 -8.381
314 H GLY 46 H GLY 46 8.031 13.779 -7.820
315 HA2 GLY 46 1HA GLY 46 8.161 15.040 -5.905
316 HA3 GLY 46 2HA GLY 46 8.164 16.420 -6.992
Start of MODEL 19
1 H1 GLY 1 H GLY 1 11.521 -17.339 -0.941
2 HA2 GLY 1 1HA GLY 1 11.330 -15.186 0.990
3 HA3 GLY 1 2HA GLY 1 10.413 -14.929 -0.487
4 H SER 2 H SER 2 9.434 -15.226 2.239
5 HA SER 2 HA SER 2 7.756 -17.618 1.849
6 HB2 SER 2 1HB SER 2 8.909 -16.492 4.403
7 HB3 SER 2 2HB SER 2 7.570 -17.640 4.389
8 HG SER 2 HG SER 2 9.944 -18.373 4.492
9 H SER 3 H SER 3 5.927 -16.756 1.040
10 HA SER 3 HA SER 3 4.188 -15.315 2.749
11 HB2 SER 3 1HB SER 3 4.074 -13.192 1.698
12 HB3 SER 3 2HB SER 3 5.794 -13.502 1.928
13 HG SER 3 HG SER 3 5.939 -13.183 -0.137
14 H GLY 4 H GLY 4 2.069 -15.241 1.967
15 HA2 GLY 4 1HA GLY 4 1.276 -15.675 -0.682
16 HA3 GLY 4 2HA GLY 4 1.374 -17.242 0.107
17 H SER 5 H SER 5 -0.821 -15.208 -0.853
18 HA SER 5 HA SER 5 -2.667 -15.910 1.280
19 HB2 SER 5 1HB SER 5 -1.648 -13.611 1.779
20 HB3 SER 5 2HB SER 5 -2.540 -13.036 0.370
21 HG SER 5 HG SER 5 -3.860 -12.719 2.103
22 H SER 6 H SER 6 -4.946 -15.337 0.672
23 HA SER 6 HA SER 6 -5.794 -16.514 -1.597
24 HB2 SER 6 1HB SER 6 -7.890 -15.307 -1.390
25 HB3 SER 6 2HB SER 6 -7.275 -15.670 0.222
26 HG SER 6 HG SER 6 -7.880 -13.300 -0.810
27 H GLY 7 H GLY 7 -4.814 -16.197 -3.523
28 HA2 GLY 7 1HA GLY 7 -4.275 -15.181 -5.509
29 HA3 GLY 7 2HA GLY 7 -5.538 -14.018 -5.134
30 H THR 8 H THR 8 -4.202 -12.413 -6.140
31 HA THR 8 HA THR 8 -1.610 -11.772 -5.190
32 HB THR 8 HB THR 8 -2.261 -11.018 -7.381
33 HG1 THR 8 HG1 THR 8 -0.816 -9.617 -6.408
34 HG21 THR 8 3HG2 THR 8 -3.958 -9.062 -7.460
35 HG22 THR 8 1HG2 THR 8 -4.506 -9.686 -5.905
36 HG23 THR 8 2HG2 THR 8 -4.569 -10.712 -7.339
37 H ALA 9 H ALA 9 -4.845 -10.685 -4.324
38 HA ALA 9 HA ALA 9 -4.081 -9.899 -1.729
39 HB1 ALA 9 3HB ALA 9 -3.763 -7.886 -3.786
40 HB2 ALA 9 1HB ALA 9 -4.887 -7.372 -2.527
41 HB3 ALA 9 2HB ALA 9 -3.249 -7.868 -2.099
42 H GLU 10 H GLU 10 -5.846 -9.517 -0.425
43 HA GLU 10 HA GLU 10 -8.342 -10.452 -1.297
44 HB2 GLU 10 1HB GLU 10 -9.104 -10.070 0.875
45 HB3 GLU 10 2HB GLU 10 -7.377 -10.316 1.093
46 HG2 GLU 10 1HG GLU 10 -8.699 -7.620 0.909
47 HG3 GLU 10 2HG GLU 10 -8.307 -8.443 2.417
48 H LYS 11 H LYS 11 -6.885 -7.413 -1.660
49 HA LYS 11 HA LYS 11 -9.486 -6.201 -2.336
50 HB2 LYS 11 1HB LYS 11 -6.999 -4.730 -1.453
51 HB3 LYS 11 2HB LYS 11 -8.588 -4.035 -1.746
52 HG2 LYS 11 1HG LYS 11 -7.792 -5.902 0.473
53 HG3 LYS 11 2HG LYS 11 -8.273 -4.209 0.608
54 HD2 LYS 11 1HD LYS 11 -9.992 -6.560 -0.166
55 HD3 LYS 11 2HD LYS 11 -10.141 -5.538 1.266
56 HE2 LYS 11 1HE LYS 11 -10.510 -3.610 -0.370
57 HE3 LYS 11 2HE LYS 11 -10.741 -4.854 -1.598
58 HZ1 LYS 11 3HZ LYS 11 -12.379 -4.328 0.806
59 HZ2 LYS 11 1HZ LYS 11 -12.458 -5.805 -0.015
60 HZ3 LYS 11 2HZ LYS 11 -12.869 -4.372 -0.813
61 HA PRO 12 HA PRO 12 -8.075 -5.667 -6.460
62 HB2 PRO 12 1HB PRO 12 -9.357 -3.376 -7.152
63 HB3 PRO 12 2HB PRO 12 -10.191 -4.923 -6.957
64 HG2 PRO 12 1HG PRO 12 -9.977 -2.632 -5.042
65 HG3 PRO 12 2HG PRO 12 -11.391 -3.622 -5.448
66 HD2 PRO 12 1HD PRO 12 -9.932 -4.017 -3.201
67 HD3 PRO 12 2HD PRO 12 -10.740 -5.344 -4.059
68 H PHE 13 H PHE 13 -7.580 -3.133 -4.124
69 HA PHE 13 HA PHE 13 -5.628 -1.806 -5.857
70 HB2 PHE 13 1HB PHE 13 -6.490 -0.916 -3.106
71 HB3 PHE 13 2HB PHE 13 -5.718 0.045 -4.363
72 HD1 PHE 13 HD2 PHE 13 -8.852 -1.445 -3.212
73 HD2 PHE 13 HD1 PHE 13 -6.987 0.931 -6.211
74 HE1 PHE 13 HE2 PHE 13 -11.064 -0.719 -4.007
75 HE2 PHE 13 HE1 PHE 13 -9.196 1.662 -7.010
76 HZ PHE 13 HZ PHE 13 -11.238 0.836 -5.909
77 H ARG 14 H ARG 14 -3.472 -1.736 -5.419
78 HA ARG 14 HA ARG 14 -2.445 -2.780 -2.915
79 HB2 ARG 14 1HB ARG 14 -2.761 -4.794 -4.316
80 HB3 ARG 14 2HB ARG 14 -1.727 -4.081 -5.547
81 HG2 ARG 14 1HG ARG 14 0.141 -4.071 -3.956
82 HG3 ARG 14 2HG ARG 14 -0.902 -4.830 -2.751
83 HD2 ARG 14 1HD ARG 14 0.513 -6.479 -3.866
84 HD3 ARG 14 2HD ARG 14 -1.193 -6.764 -4.207
85 HE ARG 14 HE ARG 14 -0.818 -6.247 -6.423
86 HH11 ARG 14 1HH1 ARG 14 1.991 -5.468 -4.520
87 HH12 ARG 14 2HH1 ARG 14 3.012 -5.209 -5.896
88 HH21 ARG 14 1HH2 ARG 14 0.516 -5.909 -8.242
89 HH22 ARG 14 2HH2 ARG 14 2.172 -5.460 -8.012
90 H CYS 15 H CYS 15 -0.567 -1.833 -2.352
91 HA CYS 15 HA CYS 15 0.479 0.228 -4.087
92 HB2 CYS 15 1HB CYS 15 0.211 0.726 -1.725
93 HB3 CYS 15 2HB CYS 15 1.251 -0.627 -1.290
94 H ASP 16 H ASP 16 1.918 -0.244 -5.602
95 HA ASP 16 HA ASP 16 3.584 -2.595 -5.422
96 HB2 ASP 16 1HB ASP 16 4.358 -1.960 -7.659
97 HB3 ASP 16 2HB ASP 16 2.599 -1.930 -7.571
98 H THR 17 H THR 17 4.118 -0.792 -3.351
99 HA THR 17 HA THR 17 6.891 -0.060 -3.995
100 HB THR 17 HB THR 17 5.107 1.632 -2.240
101 HG1 THR 17 HG1 THR 17 5.323 3.113 -4.111
102 HG21 THR 17 3HG2 THR 17 7.912 1.927 -3.291
103 HG22 THR 17 1HG2 THR 17 7.366 1.940 -1.615
104 HG23 THR 17 2HG2 THR 17 6.983 3.295 -2.677
105 H CYS 18 H CYS 18 4.598 -0.335 -1.274
106 HA CYS 18 HA CYS 18 6.753 -1.597 0.289
107 HB2 CYS 18 1HB CYS 18 5.493 -0.866 2.299
108 HB3 CYS 18 2HB CYS 18 6.024 0.482 1.299
109 H ASP 19 H ASP 19 4.421 -2.568 -1.582
110 HA ASP 19 HA ASP 19 3.135 -4.436 -1.755
111 HB2 ASP 19 1HB ASP 19 5.107 -5.637 -1.012
112 HB3 ASP 19 2HB ASP 19 4.739 -5.269 0.670
113 H LYS 20 H LYS 20 1.767 -2.406 -0.755
114 HA LYS 20 HA LYS 20 0.301 -3.478 1.565
115 HB2 LYS 20 1HB LYS 20 1.043 -0.742 0.730
116 HB3 LYS 20 2HB LYS 20 -0.588 -0.924 1.364
117 HG2 LYS 20 1HG LYS 20 0.760 -2.267 3.245
118 HG3 LYS 20 2HG LYS 20 2.017 -1.139 2.732
119 HD2 LYS 20 1HD LYS 20 1.020 0.169 4.299
120 HD3 LYS 20 2HD LYS 20 -0.021 0.575 2.932
121 HE2 LYS 20 1HE LYS 20 -1.481 0.104 4.719
122 HE3 LYS 20 2HE LYS 20 -1.515 -1.329 3.693
123 HZ1 LYS 20 3HZ LYS 20 -1.277 -1.621 6.218
124 HZ2 LYS 20 1HZ LYS 20 0.338 -1.177 5.980
125 HZ3 LYS 20 2HZ LYS 20 -0.286 -2.545 5.205
126 H SER 21 H SER 21 -2.067 -2.401 1.496
127 HA SER 21 HA SER 21 -3.234 -2.396 -1.144
128 HB2 SER 21 1HB SER 21 -4.866 -4.261 -0.456
129 HB3 SER 21 2HB SER 21 -3.242 -4.747 -0.939
130 HG SER 21 HG SER 21 -2.735 -5.176 1.130
131 H PHE 22 H PHE 22 -5.376 -1.626 -1.175
132 HA PHE 22 HA PHE 22 -6.490 -0.753 1.393
133 HB2 PHE 22 1HB PHE 22 -6.173 1.035 -1.028
134 HB3 PHE 22 2HB PHE 22 -6.976 1.473 0.477
135 HD1 PHE 22 HD2 PHE 22 -3.690 0.157 -0.703
136 HD2 PHE 22 HD1 PHE 22 -5.780 2.678 2.016
137 HE1 PHE 22 HE2 PHE 22 -1.545 0.950 0.204
138 HE2 PHE 22 HE1 PHE 22 -3.638 3.476 2.928
139 HZ PHE 22 HZ PHE 22 -1.517 2.611 2.023
140 H ARG 23 H ARG 23 -8.767 0.154 1.054
141 HA ARG 23 HA ARG 23 -10.180 -1.674 -0.751
142 HB2 ARG 23 1HB ARG 23 -11.274 -0.059 1.559
143 HB3 ARG 23 2HB ARG 23 -12.135 -1.291 0.646
144 HG2 ARG 23 1HG ARG 23 -10.186 -2.834 1.437
145 HG3 ARG 23 2HG ARG 23 -9.981 -1.599 2.681
146 HD2 ARG 23 1HD ARG 23 -12.217 -1.908 3.457
147 HD3 ARG 23 2HD ARG 23 -12.606 -2.951 2.089
148 HE ARG 23 HE ARG 23 -11.545 -4.705 3.148
149 HH11 ARG 23 1HH1 ARG 23 -10.937 -1.730 4.852
150 HH12 ARG 23 2HH1 ARG 23 -10.257 -2.512 6.240
151 HH21 ARG 23 1HH2 ARG 23 -10.653 -5.746 4.971
152 HH22 ARG 23 2HH2 ARG 23 -10.095 -4.797 6.307
153 H GLN 24 H GLN 24 -9.834 1.724 0.074
154 HA GLN 24 HA GLN 24 -11.726 2.464 -2.034
155 HB2 GLN 24 1HB GLN 24 -10.329 4.368 -0.169
156 HB3 GLN 24 2HB GLN 24 -11.820 4.618 -1.067
157 HG2 GLN 24 1HG GLN 24 -11.656 2.486 1.019
158 HG3 GLN 24 2HG GLN 24 -11.916 4.169 1.475
159 HE21 GLN 24 1HE2 GLN 24 -13.278 1.345 0.064
160 HE22 GLN 24 2HE2 GLN 24 -14.886 1.947 -0.124
161 H ARG 25 H ARG 25 -11.076 3.195 -3.953
162 HA ARG 25 HA ARG 25 -8.443 3.058 -4.823
163 HB2 ARG 25 1HB ARG 25 -10.436 3.053 -6.302
164 HB3 ARG 25 2HB ARG 25 -10.645 4.771 -5.987
165 HG2 ARG 25 1HG ARG 25 -8.495 5.239 -7.023
166 HG3 ARG 25 2HG ARG 25 -8.248 3.515 -7.307
167 HD2 ARG 25 1HD ARG 25 -9.029 4.394 -9.350
168 HD3 ARG 25 2HD ARG 25 -10.407 3.565 -8.628
169 HE ARG 25 HE ARG 25 -11.450 5.611 -8.304
170 HH11 ARG 25 1HH1 ARG 25 -8.208 6.046 -9.495
171 HH12 ARG 25 2HH1 ARG 25 -8.434 7.720 -9.880
172 HH21 ARG 25 1HH2 ARG 25 -11.760 7.815 -8.806
173 HH22 ARG 25 2HH2 ARG 25 -10.455 8.725 -9.487
174 H SER 26 H SER 26 -10.060 5.555 -3.096
175 HA SER 26 HA SER 26 -8.178 7.628 -3.821
176 HB2 SER 26 1HB SER 26 -10.541 8.173 -3.329
177 HB3 SER 26 2HB SER 26 -10.312 7.615 -1.672
178 HG SER 26 HG SER 26 -10.016 9.802 -1.645
179 H ALA 27 H ALA 27 -8.384 5.125 -1.512
180 HA ALA 27 HA ALA 27 -6.695 6.378 0.464
181 HB1 ALA 27 3HB ALA 27 -6.970 3.462 0.563
182 HB2 ALA 27 1HB ALA 27 -7.274 4.677 1.806
183 HB3 ALA 27 2HB ALA 27 -8.497 4.345 0.578
184 H LEU 28 H LEU 28 -6.328 4.103 -2.191
185 HA LEU 28 HA LEU 28 -3.555 3.571 -1.555
186 HB2 LEU 28 1HB LEU 28 -4.516 1.707 -2.488
187 HB3 LEU 28 2HB LEU 28 -5.496 2.646 -3.613
188 HG LEU 28 HG LEU 28 -3.094 3.162 -4.649
189 HD11 LEU 28 1HD1 LEU 28 -1.849 0.942 -4.608
190 HD12 LEU 28 2HD1 LEU 28 -2.792 0.570 -3.165
191 HD13 LEU 28 3HD1 LEU 28 -1.715 1.966 -3.178
192 HD21 LEU 28 3HD2 LEU 28 -4.029 0.498 -5.430
193 HD22 LEU 28 1HD2 LEU 28 -3.862 1.971 -6.385
194 HD23 LEU 28 2HD2 LEU 28 -5.292 1.729 -5.381
195 H ASN 29 H ASN 29 -5.344 5.187 -4.172
196 HA ASN 29 HA ASN 29 -3.201 6.030 -5.706
197 HB2 ASN 29 1HB ASN 29 -5.968 7.062 -5.260
198 HB3 ASN 29 2HB ASN 29 -4.834 8.068 -6.157
199 HD21 ASN 29 1HD2 ASN 29 -7.098 7.154 -7.353
200 HD22 ASN 29 2HD2 ASN 29 -6.698 5.968 -8.545
201 H SER 30 H SER 30 -4.335 7.223 -2.652
202 HA SER 30 HA SER 30 -2.703 9.630 -2.821
203 HB2 SER 30 1HB SER 30 -4.786 8.609 -0.934
204 HB3 SER 30 2HB SER 30 -3.624 9.798 -0.345
205 HG SER 30 HG SER 30 -4.839 11.216 -1.288
206 H HIS 31 H HIS 31 -2.763 6.516 -1.206
207 HA HIS 31 HA HIS 31 -0.707 7.006 0.660
208 HB2 HIS 31 1HB HIS 31 -2.036 5.106 1.071
209 HB3 HIS 31 2HB HIS 31 -1.829 4.498 -0.569
210 HD1 HIS 31 HD1 HIS 31 -0.060 4.728 2.734
211 HD2 HIS 31 HD2 HIS 31 0.436 2.946 -0.986
212 HE1 HIS 31 HE1 HIS 31 1.839 3.102 3.014
213 H ARG 32 H ARG 32 -0.673 5.846 -2.671
214 HA ARG 32 HA ARG 32 2.020 5.087 -2.810
215 HB2 ARG 32 1HB ARG 32 0.219 6.178 -4.980
216 HB3 ARG 32 2HB ARG 32 1.770 5.398 -5.259
217 HG2 ARG 32 1HG ARG 32 0.868 3.350 -4.182
218 HG3 ARG 32 2HG ARG 32 -0.704 4.147 -4.091
219 HD2 ARG 32 1HD ARG 32 0.856 3.518 -6.594
220 HD3 ARG 32 2HD ARG 32 -0.608 2.708 -6.038
221 HE ARG 32 HE ARG 32 -1.442 5.237 -6.244
222 HH11 ARG 32 1HH1 ARG 32 0.393 3.238 -8.424
223 HH12 ARG 32 2HH1 ARG 32 -0.208 4.016 -9.851
224 HH21 ARG 32 1HH2 ARG 32 -2.241 6.269 -8.115
225 HH22 ARG 32 2HH2 ARG 32 -1.706 5.740 -9.674
226 H MET 33 H MET 33 0.546 8.194 -2.697
227 HA MET 33 HA MET 33 2.593 9.693 -3.963
228 HB2 MET 33 1HB MET 33 0.554 10.528 -1.894
229 HB3 MET 33 2HB MET 33 1.565 11.636 -2.811
230 HG2 MET 33 1HG MET 33 0.536 10.600 -4.892
231 HG3 MET 33 2HG MET 33 -0.646 9.874 -3.805
232 HE1 MET 33 3HE MET 33 -2.476 11.971 -5.752
233 HE2 MET 33 1HE MET 33 -2.504 10.590 -4.656
234 HE3 MET 33 2HE MET 33 -3.291 12.098 -4.193
235 H ILE 34 H ILE 34 1.929 8.914 -0.563
236 HA ILE 34 HA ILE 34 3.851 10.375 0.717
237 HB ILE 34 HB ILE 34 3.658 8.957 2.529
238 HG12 ILE 34 1HG1 ILE 34 3.517 6.761 0.487
239 HG13 ILE 34 2HG1 ILE 34 4.639 6.954 1.829
240 HG21 ILE 34 1HG2 ILE 34 1.429 9.714 1.540
241 HG22 ILE 34 2HG2 ILE 34 1.234 8.042 1.014
242 HG23 ILE 34 3HG2 ILE 34 1.387 8.414 2.731
243 HD11 ILE 34 3HD1 ILE 34 3.012 5.122 2.137
244 HD12 ILE 34 1HD1 ILE 34 2.944 6.345 3.405
245 HD13 ILE 34 2HD1 ILE 34 1.717 6.319 2.138
246 H HIS 35 H HIS 35 4.292 7.507 -1.236
247 HA HIS 35 HA HIS 35 7.029 7.101 -0.460
248 HB2 HIS 35 1HB HIS 35 5.471 5.979 -2.798
249 HB3 HIS 35 2HB HIS 35 7.059 5.429 -2.272
250 HD1 HIS 35 HD1 HIS 35 6.741 5.044 0.668
251 HD2 HIS 35 HD2 HIS 35 3.746 4.050 -2.034
252 HE1 HIS 35 HE1 HIS 35 5.309 3.344 1.846
253 H THR 36 H THR 36 5.444 8.201 -3.458
254 HA THR 36 HA THR 36 7.492 8.754 -5.095
255 HB THR 36 HB THR 36 6.260 10.582 -6.057
256 HG1 THR 36 HG1 THR 36 5.624 11.879 -4.434
257 HG21 THR 36 3HG2 THR 36 4.159 8.752 -4.922
258 HG22 THR 36 1HG2 THR 36 5.316 8.213 -6.139
259 HG23 THR 36 2HG2 THR 36 4.199 9.528 -6.506
260 H GLY 37 H GLY 37 6.513 10.836 -2.384
261 HA2 GLY 37 1HA GLY 37 8.416 12.863 -2.805
262 HA3 GLY 37 2HA GLY 37 7.630 12.506 -1.275
263 H GLU 38 H GLU 38 8.851 11.754 0.333
264 HA GLU 38 HA GLU 38 11.662 11.323 -0.131
265 HB2 GLU 38 1HB GLU 38 9.982 11.219 2.377
266 HB3 GLU 38 2HB GLU 38 11.723 10.976 2.357
267 HG2 GLU 38 1HG GLU 38 11.755 13.284 1.157
268 HG3 GLU 38 2HG GLU 38 10.153 13.462 1.870
269 H LYS 39 H LYS 39 12.615 9.440 -0.501
270 HA LYS 39 HA LYS 39 11.080 6.977 -0.071
271 HB2 LYS 39 1HB LYS 39 12.212 7.697 -2.326
272 HB3 LYS 39 2HB LYS 39 13.672 7.074 -1.569
273 HG2 LYS 39 1HG LYS 39 12.721 4.896 -1.361
274 HG3 LYS 39 2HG LYS 39 11.138 5.482 -1.877
275 HD2 LYS 39 1HD LYS 39 11.946 5.915 -4.088
276 HD3 LYS 39 2HD LYS 39 13.611 5.588 -3.599
277 HE2 LYS 39 1HE LYS 39 12.714 3.691 -4.807
278 HE3 LYS 39 2HE LYS 39 12.988 3.256 -3.121
279 HZ1 LYS 39 3HZ LYS 39 10.899 2.534 -3.147
280 HZ2 LYS 39 1HZ LYS 39 10.546 3.301 -4.612
281 HZ3 LYS 39 2HZ LYS 39 10.419 4.156 -3.158
282 HA PRO 40 HA PRO 40 13.617 5.843 3.351
283 HB2 PRO 40 1HB PRO 40 13.128 3.172 3.345
284 HB3 PRO 40 2HB PRO 40 11.946 4.364 3.898
285 HG2 PRO 40 1HG PRO 40 12.135 2.969 1.256
286 HG3 PRO 40 2HG PRO 40 10.703 3.295 2.249
287 HD2 PRO 40 1HD PRO 40 11.355 4.801 0.096
288 HD3 PRO 40 2HD PRO 40 10.537 5.475 1.520
289 H SER 41 H SER 41 13.930 4.208 0.251
290 HA SER 41 HA SER 41 16.417 2.935 0.900
291 HB2 SER 41 1HB SER 41 16.470 2.275 -1.443
292 HB3 SER 41 2HB SER 41 14.846 2.028 -0.800
293 HG SER 41 HG SER 41 15.562 3.476 -2.893
294 H GLY 42 H GLY 42 15.560 5.576 -1.348
295 HA2 GLY 42 1HA GLY 42 17.734 7.213 -0.572
296 HA3 GLY 42 2HA GLY 42 18.159 6.319 -2.024
297 HA PRO 43 HA PRO 43 15.660 10.252 -2.948
298 HB2 PRO 43 1HB PRO 43 17.679 11.746 -3.978
299 HB3 PRO 43 2HB PRO 43 17.243 11.770 -2.265
300 HG2 PRO 43 1HG PRO 43 19.450 10.284 -3.636
301 HG3 PRO 43 2HG PRO 43 19.485 11.175 -2.104
302 HD2 PRO 43 1HD PRO 43 19.281 8.477 -2.216
303 HD3 PRO 43 2HD PRO 43 18.528 9.439 -0.927
304 H SER 44 H SER 44 17.424 7.864 -4.447
305 HA SER 44 HA SER 44 17.341 8.835 -7.145
306 HB2 SER 44 1HB SER 44 18.856 6.972 -6.024
307 HB3 SER 44 2HB SER 44 17.539 5.916 -6.534
308 HG SER 44 HG SER 44 18.448 5.973 -8.418
309 H SER 45 H SER 45 15.144 9.437 -7.389
310 HA SER 45 HA SER 45 13.434 7.192 -8.128
311 HB2 SER 45 1HB SER 45 11.509 8.054 -6.915
312 HB3 SER 45 2HB SER 45 12.834 7.773 -5.786
313 HG SER 45 HG SER 45 13.122 10.233 -6.615
314 H GLY 46 H GLY 46 11.449 7.973 -9.312
315 HA2 GLY 46 1HA GLY 46 10.951 10.452 -10.306
316 HA3 GLY 46 2HA GLY 46 12.284 9.885 -11.302
Start of MODEL 20
1 H1 GLY 1 H GLY 1 13.079 -20.390 3.863
2 HA2 GLY 1 1HA GLY 1 12.830 -19.691 1.516
3 HA3 GLY 1 2HA GLY 1 13.004 -21.385 1.081
4 H SER 2 H SER 2 10.858 -18.917 2.194
5 HA SER 2 HA SER 2 8.610 -20.787 1.871
6 HB2 SER 2 1HB SER 2 8.731 -18.605 3.964
7 HB3 SER 2 2HB SER 2 7.438 -19.782 3.737
8 HG SER 2 HG SER 2 10.041 -20.716 4.165
9 H SER 3 H SER 3 9.597 -19.161 -0.150
10 HA SER 3 HA SER 3 8.230 -16.669 -0.306
11 HB2 SER 3 1HB SER 3 9.114 -16.484 -2.481
12 HB3 SER 3 2HB SER 3 10.321 -17.431 -1.610
13 HG SER 3 HG SER 3 10.028 -18.889 -3.079
14 H GLY 4 H GLY 4 6.611 -16.156 -2.000
15 HA2 GLY 4 1HA GLY 4 4.627 -18.335 -2.172
16 HA3 GLY 4 2HA GLY 4 4.227 -16.626 -2.091
17 H SER 5 H SER 5 4.694 -19.265 -4.117
18 HA SER 5 HA SER 5 5.736 -18.360 -6.458
19 HB2 SER 5 1HB SER 5 4.999 -20.618 -6.363
20 HB3 SER 5 2HB SER 5 3.342 -20.140 -5.993
21 HG SER 5 HG SER 5 4.736 -19.835 -8.440
22 H SER 6 H SER 6 2.275 -18.107 -5.626
23 HA SER 6 HA SER 6 2.046 -15.453 -6.604
24 HB2 SER 6 1HB SER 6 2.238 -16.614 -8.778
25 HB3 SER 6 2HB SER 6 0.850 -17.616 -8.356
26 HG SER 6 HG SER 6 0.567 -15.559 -9.667
27 H GLY 7 H GLY 7 -0.298 -14.759 -6.705
28 HA2 GLY 7 1HA GLY 7 -2.339 -16.366 -5.587
29 HA3 GLY 7 2HA GLY 7 -1.594 -15.403 -4.320
30 H THR 8 H THR 8 -3.580 -14.307 -4.003
31 HA THR 8 HA THR 8 -3.985 -12.137 -5.929
32 HB THR 8 HB THR 8 -6.419 -12.322 -5.777
33 HG1 THR 8 HG1 THR 8 -6.860 -13.347 -3.902
34 HG21 THR 8 3HG2 THR 8 -6.406 -14.876 -6.741
35 HG22 THR 8 1HG2 THR 8 -4.718 -14.408 -6.943
36 HG23 THR 8 2HG2 THR 8 -5.995 -13.442 -7.682
37 H ALA 9 H ALA 9 -4.619 -10.196 -5.037
38 HA ALA 9 HA ALA 9 -4.221 -9.948 -2.179
39 HB1 ALA 9 3HB ALA 9 -4.907 -7.445 -3.183
40 HB2 ALA 9 1HB ALA 9 -3.282 -8.058 -2.873
41 HB3 ALA 9 2HB ALA 9 -3.996 -8.220 -4.478
42 H GLU 10 H GLU 10 -5.829 -10.081 -0.770
43 HA GLU 10 HA GLU 10 -8.440 -10.539 -1.155
44 HB2 GLU 10 1HB GLU 10 -7.366 -10.462 1.063
45 HB3 GLU 10 2HB GLU 10 -7.359 -8.706 0.992
46 HG2 GLU 10 1HG GLU 10 -9.184 -9.291 2.345
47 HG3 GLU 10 2HG GLU 10 -9.869 -8.824 0.789
48 H LYS 11 H LYS 11 -6.857 -7.479 -1.605
49 HA LYS 11 HA LYS 11 -9.446 -6.276 -2.340
50 HB2 LYS 11 1HB LYS 11 -6.969 -4.843 -1.365
51 HB3 LYS 11 2HB LYS 11 -8.511 -4.097 -1.764
52 HG2 LYS 11 1HG LYS 11 -7.945 -5.987 0.508
53 HG3 LYS 11 2HG LYS 11 -8.319 -4.265 0.616
54 HD2 LYS 11 1HD LYS 11 -10.133 -6.527 -0.178
55 HD3 LYS 11 2HD LYS 11 -10.325 -5.381 1.151
56 HE2 LYS 11 1HE LYS 11 -10.299 -3.640 -0.848
57 HE3 LYS 11 2HE LYS 11 -10.861 -5.044 -1.753
58 HZ1 LYS 11 3HZ LYS 11 -12.162 -3.676 0.517
59 HZ2 LYS 11 1HZ LYS 11 -12.562 -5.271 0.118
60 HZ3 LYS 11 2HZ LYS 11 -12.798 -4.033 -1.010
61 HA PRO 12 HA PRO 12 -7.969 -5.731 -6.439
62 HB2 PRO 12 1HB PRO 12 -9.244 -3.441 -7.146
63 HB3 PRO 12 2HB PRO 12 -10.078 -4.989 -6.969
64 HG2 PRO 12 1HG PRO 12 -9.899 -2.702 -5.045
65 HG3 PRO 12 2HG PRO 12 -11.304 -3.694 -5.476
66 HD2 PRO 12 1HD PRO 12 -9.882 -4.091 -3.206
67 HD3 PRO 12 2HD PRO 12 -10.673 -5.418 -4.081
68 H PHE 13 H PHE 13 -7.634 -3.070 -4.172
69 HA PHE 13 HA PHE 13 -5.622 -1.780 -5.844
70 HB2 PHE 13 1HB PHE 13 -6.495 -0.884 -3.103
71 HB3 PHE 13 2HB PHE 13 -5.771 0.080 -4.386
72 HD1 PHE 13 HD2 PHE 13 -8.844 -1.493 -3.172
73 HD2 PHE 13 HD1 PHE 13 -7.095 0.922 -6.209
74 HE1 PHE 13 HE2 PHE 13 -11.088 -0.837 -3.937
75 HE2 PHE 13 HE1 PHE 13 -9.336 1.583 -6.979
76 HZ PHE 13 HZ PHE 13 -11.336 0.703 -5.844
77 H ARG 14 H ARG 14 -3.477 -1.790 -5.440
78 HA ARG 14 HA ARG 14 -2.459 -2.754 -2.896
79 HB2 ARG 14 1HB ARG 14 -2.807 -4.797 -4.270
80 HB3 ARG 14 2HB ARG 14 -1.720 -4.132 -5.482
81 HG2 ARG 14 1HG ARG 14 0.033 -4.038 -3.655
82 HG3 ARG 14 2HG ARG 14 -1.067 -5.028 -2.694
83 HD2 ARG 14 1HD ARG 14 0.585 -6.406 -3.847
84 HD3 ARG 14 2HD ARG 14 -1.045 -6.746 -4.426
85 HE ARG 14 HE ARG 14 -0.117 -4.887 -6.172
86 HH11 ARG 14 1HH1 ARG 14 1.077 -7.954 -5.039
87 HH12 ARG 14 2HH1 ARG 14 1.906 -8.324 -6.515
88 HH21 ARG 14 1HH2 ARG 14 0.970 -5.362 -8.120
89 HH22 ARG 14 2HH2 ARG 14 1.845 -6.849 -8.266
90 H CYS 15 H CYS 15 -0.504 -1.901 -2.385
91 HA CYS 15 HA CYS 15 0.569 0.089 -4.218
92 HB2 CYS 15 1HB CYS 15 0.178 0.707 -1.867
93 HB3 CYS 15 2HB CYS 15 1.310 -0.539 -1.352
94 H ASP 16 H ASP 16 2.079 -0.495 -5.619
95 HA ASP 16 HA ASP 16 3.641 -2.872 -5.299
96 HB2 ASP 16 1HB ASP 16 4.509 -2.417 -7.456
97 HB3 ASP 16 2HB ASP 16 2.834 -1.873 -7.500
98 H THR 17 H THR 17 3.888 -0.110 -3.697
99 HA THR 17 HA THR 17 6.772 0.254 -3.919
100 HB THR 17 HB THR 17 5.027 1.706 -1.951
101 HG1 THR 17 HG1 THR 17 4.543 3.196 -3.590
102 HG21 THR 17 3HG2 THR 17 6.813 3.468 -3.052
103 HG22 THR 17 1HG2 THR 17 7.729 1.962 -3.047
104 HG23 THR 17 2HG2 THR 17 7.053 2.588 -1.543
105 H CYS 18 H CYS 18 4.500 -0.139 -1.191
106 HA CYS 18 HA CYS 18 6.634 -1.541 0.268
107 HB2 CYS 18 1HB CYS 18 5.258 -1.018 2.300
108 HB3 CYS 18 2HB CYS 18 5.881 0.399 1.462
109 H ASP 19 H ASP 19 4.283 -2.378 -1.688
110 HA ASP 19 HA ASP 19 3.066 -4.270 -2.029
111 HB2 ASP 19 1HB ASP 19 5.005 -5.102 0.069
112 HB3 ASP 19 2HB ASP 19 3.621 -6.155 -0.214
113 H LYS 20 H LYS 20 1.860 -2.207 -0.606
114 HA LYS 20 HA LYS 20 0.362 -3.509 1.546
115 HB2 LYS 20 1HB LYS 20 0.919 -0.698 0.771
116 HB3 LYS 20 2HB LYS 20 -0.641 -1.017 1.519
117 HG2 LYS 20 1HG LYS 20 0.660 -2.189 3.363
118 HG3 LYS 20 2HG LYS 20 2.098 -1.438 2.668
119 HD2 LYS 20 1HD LYS 20 0.720 0.756 2.836
120 HD3 LYS 20 2HD LYS 20 -0.262 -0.152 3.988
121 HE2 LYS 20 1HE LYS 20 2.122 -0.734 4.987
122 HE3 LYS 20 2HE LYS 20 2.552 0.783 4.198
123 HZ1 LYS 20 3HZ LYS 20 1.394 0.504 6.661
124 HZ2 LYS 20 1HZ LYS 20 0.118 1.003 5.669
125 HZ3 LYS 20 2HZ LYS 20 1.524 1.938 5.773
126 H SER 21 H SER 21 -2.047 -2.463 1.536
127 HA SER 21 HA SER 21 -3.241 -2.475 -1.095
128 HB2 SER 21 1HB SER 21 -4.842 -4.360 -0.362
129 HB3 SER 21 2HB SER 21 -3.225 -4.821 -0.892
130 HG SER 21 HG SER 21 -2.861 -4.486 1.586
131 H PHE 22 H PHE 22 -5.301 -1.597 -1.130
132 HA PHE 22 HA PHE 22 -6.431 -0.771 1.454
133 HB2 PHE 22 1HB PHE 22 -6.135 0.993 -0.987
134 HB3 PHE 22 2HB PHE 22 -6.961 1.440 0.503
135 HD1 PHE 22 HD2 PHE 22 -3.646 0.106 -0.578
136 HD2 PHE 22 HD1 PHE 22 -5.796 2.728 1.994
137 HE1 PHE 22 HE2 PHE 22 -1.522 0.939 0.342
138 HE2 PHE 22 HE1 PHE 22 -3.675 3.566 2.918
139 HZ PHE 22 HZ PHE 22 -1.534 2.671 2.093
140 H ARG 23 H ARG 23 -8.710 0.236 1.024
141 HA ARG 23 HA ARG 23 -10.137 -1.661 -0.709
142 HB2 ARG 23 1HB ARG 23 -11.159 -0.048 1.636
143 HB3 ARG 23 2HB ARG 23 -12.101 -1.198 0.697
144 HG2 ARG 23 1HG ARG 23 -10.214 -2.866 1.398
145 HG3 ARG 23 2HG ARG 23 -9.943 -1.692 2.688
146 HD2 ARG 23 1HD ARG 23 -12.091 -1.994 3.569
147 HD3 ARG 23 2HD ARG 23 -12.683 -2.758 2.094
148 HE ARG 23 HE ARG 23 -11.820 -4.767 2.814
149 HH11 ARG 23 1HH1 ARG 23 -10.654 -2.185 4.837
150 HH12 ARG 23 2HH1 ARG 23 -9.980 -3.248 6.028
151 HH21 ARG 23 1HH2 ARG 23 -10.937 -6.176 4.375
152 HH22 ARG 23 2HH2 ARG 23 -10.140 -5.518 5.764
153 H GLN 24 H GLN 24 -9.805 1.746 0.095
154 HA GLN 24 HA GLN 24 -11.685 2.452 -2.041
155 HB2 GLN 24 1HB GLN 24 -10.379 4.378 -0.131
156 HB3 GLN 24 2HB GLN 24 -11.851 4.601 -1.068
157 HG2 GLN 24 1HG GLN 24 -11.645 2.508 1.066
158 HG3 GLN 24 2HG GLN 24 -12.080 4.176 1.433
159 HE21 GLN 24 1HE2 GLN 24 -13.774 2.063 1.967
160 HE22 GLN 24 2HE2 GLN 24 -15.156 2.168 0.936
161 H ARG 25 H ARG 25 -11.009 3.221 -3.937
162 HA ARG 25 HA ARG 25 -8.383 3.120 -4.787
163 HB2 ARG 25 1HB ARG 25 -10.541 3.308 -6.168
164 HB3 ARG 25 2HB ARG 25 -10.376 5.047 -5.960
165 HG2 ARG 25 1HG ARG 25 -8.248 5.027 -7.088
166 HG3 ARG 25 2HG ARG 25 -8.287 3.266 -7.195
167 HD2 ARG 25 1HD ARG 25 -10.213 5.180 -8.509
168 HD3 ARG 25 2HD ARG 25 -8.930 4.277 -9.314
169 HE ARG 25 HE ARG 25 -10.232 2.374 -9.217
170 HH11 ARG 25 1HH1 ARG 25 -11.680 4.920 -7.335
171 HH12 ARG 25 2HH1 ARG 25 -13.188 4.091 -7.134
172 HH21 ARG 25 1HH2 ARG 25 -12.213 1.273 -8.959
173 HH22 ARG 25 2HH2 ARG 25 -13.490 2.016 -8.058
174 H SER 26 H SER 26 -10.148 5.791 -3.337
175 HA SER 26 HA SER 26 -8.153 7.764 -3.842
176 HB2 SER 26 1HB SER 26 -10.439 8.457 -3.443
177 HB3 SER 26 2HB SER 26 -10.435 7.692 -1.854
178 HG SER 26 HG SER 26 -8.699 9.188 -1.326
179 H ALA 27 H ALA 27 -8.441 5.225 -1.588
180 HA ALA 27 HA ALA 27 -6.797 6.430 0.457
181 HB1 ALA 27 3HB ALA 27 -8.629 4.657 0.786
182 HB2 ALA 27 1HB ALA 27 -7.405 3.501 0.260
183 HB3 ALA 27 2HB ALA 27 -7.130 4.486 1.697
184 H LEU 28 H LEU 28 -6.383 4.199 -2.227
185 HA LEU 28 HA LEU 28 -3.621 3.658 -1.526
186 HB2 LEU 28 1HB LEU 28 -4.560 1.777 -2.445
187 HB3 LEU 28 2HB LEU 28 -5.530 2.695 -3.596
188 HG LEU 28 HG LEU 28 -3.111 3.206 -4.602
189 HD11 LEU 28 1HD1 LEU 28 -2.838 0.552 -3.205
190 HD12 LEU 28 2HD1 LEU 28 -1.834 1.986 -2.994
191 HD13 LEU 28 3HD1 LEU 28 -1.789 1.094 -4.515
192 HD21 LEU 28 3HD2 LEU 28 -4.069 0.532 -5.353
193 HD22 LEU 28 1HD2 LEU 28 -3.829 1.975 -6.339
194 HD23 LEU 28 2HD2 LEU 28 -5.295 1.800 -5.374
195 H ASN 29 H ASN 29 -5.374 5.219 -4.201
196 HA ASN 29 HA ASN 29 -3.227 6.045 -5.725
197 HB2 ASN 29 1HB ASN 29 -5.981 7.126 -5.286
198 HB3 ASN 29 2HB ASN 29 -4.833 8.083 -6.217
199 HD21 ASN 29 1HD2 ASN 29 -7.059 7.273 -7.449
200 HD22 ASN 29 2HD2 ASN 29 -6.718 6.013 -8.582
201 H SER 30 H SER 30 -4.367 7.285 -2.690
202 HA SER 30 HA SER 30 -2.711 9.674 -2.876
203 HB2 SER 30 1HB SER 30 -4.922 9.906 -1.862
204 HB3 SER 30 2HB SER 30 -4.520 8.680 -0.660
205 HG SER 30 HG SER 30 -2.730 10.165 -0.092
206 H HIS 31 H HIS 31 -2.803 6.579 -1.225
207 HA HIS 31 HA HIS 31 -0.740 7.076 0.635
208 HB2 HIS 31 1HB HIS 31 -2.080 5.200 1.091
209 HB3 HIS 31 2HB HIS 31 -1.911 4.569 -0.545
210 HD1 HIS 31 HD1 HIS 31 -0.150 4.733 2.751
211 HD2 HIS 31 HD2 HIS 31 0.385 3.043 -1.007
212 HE1 HIS 31 HE1 HIS 31 1.740 3.095 3.013
213 H ARG 32 H ARG 32 -0.730 5.950 -2.697
214 HA ARG 32 HA ARG 32 1.934 5.094 -2.846
215 HB2 ARG 32 1HB ARG 32 0.161 6.280 -4.988
216 HB3 ARG 32 2HB ARG 32 1.699 5.483 -5.294
217 HG2 ARG 32 1HG ARG 32 0.746 3.432 -4.219
218 HG3 ARG 32 2HG ARG 32 -0.815 4.256 -4.194
219 HD2 ARG 32 1HD ARG 32 0.830 3.748 -6.670
220 HD3 ARG 32 2HD ARG 32 -0.525 2.751 -6.142
221 HE ARG 32 HE ARG 32 -1.583 5.244 -6.279
222 HH11 ARG 32 1HH1 ARG 32 0.196 3.251 -8.510
223 HH12 ARG 32 2HH1 ARG 32 -0.562 3.920 -9.916
224 HH21 ARG 32 1HH2 ARG 32 -2.589 6.134 -8.122
225 HH22 ARG 32 2HH2 ARG 32 -2.146 5.560 -9.695
226 H MET 33 H MET 33 0.562 8.255 -2.714
227 HA MET 33 HA MET 33 2.666 9.701 -3.935
228 HB2 MET 33 1HB MET 33 0.698 10.602 -1.825
229 HB3 MET 33 2HB MET 33 1.701 11.662 -2.806
230 HG2 MET 33 1HG MET 33 0.531 10.461 -4.798
231 HG3 MET 33 2HG MET 33 -0.680 10.051 -3.586
232 HE1 MET 33 3HE MET 33 -2.839 12.814 -4.854
233 HE2 MET 33 1HE MET 33 -2.333 11.156 -5.180
234 HE3 MET 33 2HE MET 33 -2.842 11.619 -3.556
235 H ILE 34 H ILE 34 1.948 8.967 -0.530
236 HA ILE 34 HA ILE 34 3.911 10.307 0.779
237 HB ILE 34 HB ILE 34 3.691 8.843 2.551
238 HG12 ILE 34 1HG1 ILE 34 3.481 6.701 0.454
239 HG13 ILE 34 2HG1 ILE 34 4.641 6.847 1.770
240 HG21 ILE 34 1HG2 ILE 34 1.470 9.653 1.504
241 HG22 ILE 34 2HG2 ILE 34 1.247 7.959 1.068
242 HG23 ILE 34 3HG2 ILE 34 1.420 8.418 2.762
243 HD11 ILE 34 3HD1 ILE 34 2.974 5.036 2.066
244 HD12 ILE 34 1HD1 ILE 34 2.993 6.217 3.376
245 HD13 ILE 34 2HD1 ILE 34 1.717 6.270 2.159
246 H HIS 35 H HIS 35 4.301 7.480 -1.246
247 HA HIS 35 HA HIS 35 7.041 7.032 -0.484
248 HB2 HIS 35 1HB HIS 35 5.458 5.932 -2.816
249 HB3 HIS 35 2HB HIS 35 7.037 5.359 -2.289
250 HD1 HIS 35 HD1 HIS 35 6.752 4.924 0.624
251 HD2 HIS 35 HD2 HIS 35 3.665 4.081 -2.026
252 HE1 HIS 35 HE1 HIS 35 5.286 3.258 1.808
253 H THR 36 H THR 36 5.628 7.764 -3.676
254 HA THR 36 HA THR 36 7.956 8.585 -4.917
255 HB THR 36 HB THR 36 6.175 8.289 -6.378
256 HG1 THR 36 HG1 THR 36 6.073 10.216 -7.446
257 HG21 THR 36 3HG2 THR 36 4.616 9.266 -4.216
258 HG22 THR 36 1HG2 THR 36 4.065 8.471 -5.691
259 HG23 THR 36 2HG2 THR 36 4.224 10.227 -5.641
260 H GLY 37 H GLY 37 9.317 9.984 -3.932
261 HA2 GLY 37 1HA GLY 37 8.956 12.720 -4.076
262 HA3 GLY 37 2HA GLY 37 8.447 12.263 -2.457
263 H GLU 38 H GLU 38 9.959 11.795 -0.927
264 HA GLU 38 HA GLU 38 12.478 12.866 -1.059
265 HB2 GLU 38 1HB GLU 38 11.255 12.066 1.001
266 HB3 GLU 38 2HB GLU 38 11.788 10.439 0.599
267 HG2 GLU 38 1HG GLU 38 14.145 11.312 0.669
268 HG3 GLU 38 2HG GLU 38 13.487 12.801 1.345
269 H LYS 39 H LYS 39 13.787 12.412 -2.748
270 HA LYS 39 HA LYS 39 14.133 10.128 -4.175
271 HB2 LYS 39 1HB LYS 39 16.203 12.154 -3.328
272 HB3 LYS 39 2HB LYS 39 16.539 10.876 -4.489
273 HG2 LYS 39 1HG LYS 39 14.324 12.878 -4.843
274 HG3 LYS 39 2HG LYS 39 15.959 13.114 -5.465
275 HD2 LYS 39 1HD LYS 39 15.538 10.711 -6.482
276 HD3 LYS 39 2HD LYS 39 13.849 11.198 -6.327
277 HE2 LYS 39 1HE LYS 39 14.154 13.056 -7.751
278 HE3 LYS 39 2HE LYS 39 15.910 12.933 -7.661
279 HZ1 LYS 39 3HZ LYS 39 15.922 11.071 -9.036
280 HZ2 LYS 39 1HZ LYS 39 14.770 12.082 -9.753
281 HZ3 LYS 39 2HZ LYS 39 14.273 10.762 -8.818
282 HA PRO 40 HA PRO 40 15.731 7.056 -1.451
283 HB2 PRO 40 1HB PRO 40 16.832 5.399 -3.298
284 HB3 PRO 40 2HB PRO 40 15.088 5.530 -3.044
285 HG2 PRO 40 1HG PRO 40 16.798 6.806 -5.144
286 HG3 PRO 40 2HG PRO 40 15.207 6.039 -5.310
287 HD2 PRO 40 1HD PRO 40 15.524 8.726 -5.188
288 HD3 PRO 40 2HD PRO 40 14.089 7.903 -4.543
289 H SER 41 H SER 41 17.902 5.638 -1.430
290 HA SER 41 HA SER 41 20.044 7.597 -1.205
291 HB2 SER 41 1HB SER 41 19.374 5.793 0.565
292 HB3 SER 41 2HB SER 41 20.328 4.706 -0.445
293 HG SER 41 HG SER 41 22.069 5.580 0.326
294 H GLY 42 H GLY 42 19.697 4.300 -2.536
295 HA2 GLY 42 1HA GLY 42 21.561 5.082 -4.680
296 HA3 GLY 42 2HA GLY 42 21.827 3.595 -3.783
297 HA PRO 43 HA PRO 43 18.628 3.224 -7.374
298 HB2 PRO 43 1HB PRO 43 20.245 2.720 -9.496
299 HB3 PRO 43 2HB PRO 43 19.696 4.346 -9.071
300 HG2 PRO 43 1HG PRO 43 22.312 3.015 -8.481
301 HG3 PRO 43 2HG PRO 43 21.999 4.672 -9.030
302 HD2 PRO 43 1HD PRO 43 22.529 4.070 -6.444
303 HD3 PRO 43 2HD PRO 43 21.457 5.405 -6.913
304 H SER 44 H SER 44 17.833 1.246 -7.064
305 HA SER 44 HA SER 44 19.249 -1.082 -7.922
306 HB2 SER 44 1HB SER 44 18.877 -0.592 -4.970
307 HB3 SER 44 2HB SER 44 19.050 -2.218 -5.632
308 HG SER 44 HG SER 44 20.914 -0.109 -5.582
309 H SER 45 H SER 45 17.935 -3.074 -7.609
310 HA SER 45 HA SER 45 15.292 -2.666 -8.443
311 HB2 SER 45 1HB SER 45 16.815 -5.065 -7.469
312 HB3 SER 45 2HB SER 45 15.084 -5.183 -7.785
313 HG SER 45 HG SER 45 15.959 -5.657 -9.703
314 H GLY 46 H GLY 46 13.320 -3.471 -7.356
315 HA2 GLY 46 1HA GLY 46 12.224 -4.063 -5.267
316 HA3 GLY 46 2HA GLY 46 13.443 -3.114 -4.428