Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
505131 | 2eoq RC | 10192 | cing | 1-original | 4 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 H1 GLY 1 H GLY 1 -10.368 4.087 14.905
2 HA2 GLY 1 1HA GLY 1 -10.791 2.589 12.412
3 HA3 GLY 1 2HA GLY 1 -9.763 4.014 12.383
4 H SER 2 H SER 2 -9.493 0.883 12.204
5 HA SER 2 HA SER 2 -6.873 0.855 13.457
6 HB2 SER 2 1HB SER 2 -8.479 0.034 15.204
7 HB3 SER 2 2HB SER 2 -8.890 -1.299 14.125
8 HG SER 2 HG SER 2 -6.225 -0.764 14.904
9 H SER 3 H SER 3 -5.742 -1.286 12.960
10 HA SER 3 HA SER 3 -5.409 -1.642 10.286
11 HB2 SER 3 1HB SER 3 -4.398 -3.828 10.795
12 HB3 SER 3 2HB SER 3 -3.908 -2.611 11.973
13 HG SER 3 HG SER 3 -5.789 -4.700 12.280
14 H GLY 4 H GLY 4 -6.645 -2.341 8.679
15 HA2 GLY 4 1HA GLY 4 -8.850 -4.199 9.330
16 HA3 GLY 4 2HA GLY 4 -8.965 -2.945 8.104
17 H SER 5 H SER 5 -8.729 -3.603 6.081
18 HA SER 5 HA SER 5 -8.168 -4.845 4.260
19 HB2 SER 5 1HB SER 5 -5.817 -5.339 6.063
20 HB3 SER 5 2HB SER 5 -5.948 -6.190 4.524
21 HG SER 5 HG SER 5 -5.359 -3.557 5.037
22 H SER 6 H SER 6 -10.087 -5.924 5.934
23 HA SER 6 HA SER 6 -9.456 -8.779 6.121
24 HB2 SER 6 1HB SER 6 -10.460 -7.697 8.104
25 HB3 SER 6 2HB SER 6 -11.873 -7.267 7.141
26 HG SER 6 HG SER 6 -12.487 -9.338 7.077
27 H GLY 7 H GLY 7 -10.314 -10.263 4.789
28 HA2 GLY 7 1HA GLY 7 -12.532 -10.761 3.585
29 HA3 GLY 7 2HA GLY 7 -12.157 -9.283 2.711
30 H THR 8 H THR 8 -12.056 -12.536 2.495
31 HA THR 8 HA THR 8 -10.712 -14.075 1.407
32 HB THR 8 HB THR 8 -10.523 -13.570 -0.985
33 HG1 THR 8 HG1 THR 8 -10.132 -11.529 -1.408
34 HG21 THR 8 3HG2 THR 8 -12.960 -13.317 0.571
35 HG22 THR 8 1HG2 THR 8 -12.669 -14.195 -0.929
36 HG23 THR 8 2HG2 THR 8 -13.074 -12.479 -0.977
37 H GLY 9 H GLY 9 -9.088 -12.576 3.113
38 HA2 GLY 9 1HA GLY 9 -6.806 -12.431 3.473
39 HA3 GLY 9 2HA GLY 9 -6.549 -12.909 1.802
40 H GLU 10 H GLU 10 -5.001 -11.376 1.345
41 HA GLU 10 HA GLU 10 -5.673 -8.562 1.740
42 HB2 GLU 10 1HB GLU 10 -3.347 -8.132 1.037
43 HB3 GLU 10 2HB GLU 10 -3.439 -9.239 2.400
44 HG2 GLU 10 1HG GLU 10 -3.214 -11.121 0.755
45 HG3 GLU 10 2HG GLU 10 -2.866 -9.906 -0.473
46 H LYS 11 H LYS 11 -4.638 -7.195 -0.225
47 HA LYS 11 HA LYS 11 -6.371 -7.743 -2.448
48 HB2 LYS 11 1HB LYS 11 -4.550 -5.536 -1.634
49 HB3 LYS 11 2HB LYS 11 -4.921 -5.682 -3.347
50 HG2 LYS 11 1HG LYS 11 -6.473 -4.156 -2.418
51 HG3 LYS 11 2HG LYS 11 -7.348 -5.656 -2.733
52 HD2 LYS 11 1HD LYS 11 -6.616 -6.144 -0.220
53 HD3 LYS 11 2HD LYS 11 -6.616 -4.380 -0.154
54 HE2 LYS 11 1HE LYS 11 -8.953 -4.719 -1.366
55 HE3 LYS 11 2HE LYS 11 -8.870 -6.275 -0.542
56 HZ1 LYS 11 3HZ LYS 11 -8.596 -3.637 0.793
57 HZ2 LYS 11 1HZ LYS 11 -8.627 -5.148 1.554
58 HZ3 LYS 11 2HZ LYS 11 -10.009 -4.567 0.771
59 HA PRO 12 HA PRO 12 -3.642 -9.831 -5.178
60 HB2 PRO 12 1HB PRO 12 -4.316 -8.759 -7.580
61 HB3 PRO 12 2HB PRO 12 -5.364 -9.877 -6.699
62 HG2 PRO 12 1HG PRO 12 -5.483 -6.889 -6.851
63 HG3 PRO 12 2HG PRO 12 -6.806 -8.068 -6.933
64 HD2 PRO 12 1HD PRO 12 -6.223 -6.686 -4.678
65 HD3 PRO 12 2HD PRO 12 -6.876 -8.337 -4.645
66 H PHE 13 H PHE 13 -3.159 -6.701 -4.347
67 HA PHE 13 HA PHE 13 -0.619 -6.602 -5.798
68 HB2 PHE 13 1HB PHE 13 -2.555 -4.284 -5.619
69 HB3 PHE 13 2HB PHE 13 -0.925 -4.201 -6.280
70 HD1 PHE 13 HD1 PHE 13 -0.393 -5.260 -8.412
71 HD2 PHE 13 HD2 PHE 13 -4.354 -5.266 -6.855
72 HE1 PHE 13 HE1 PHE 13 -1.260 -5.886 -10.628
73 HE2 PHE 13 HE2 PHE 13 -5.227 -5.894 -9.068
74 HZ PHE 13 HZ PHE 13 -3.679 -6.205 -10.958
75 H LYS 14 H LYS 14 0.857 -4.916 -4.866
76 HA LYS 14 HA LYS 14 0.320 -4.020 -2.183
77 HB2 LYS 14 1HB LYS 14 0.939 -6.355 -1.765
78 HB3 LYS 14 2HB LYS 14 2.436 -6.127 -2.661
79 HG2 LYS 14 1HG LYS 14 2.884 -4.250 -0.923
80 HG3 LYS 14 2HG LYS 14 1.669 -5.101 0.034
81 HD2 LYS 14 1HD LYS 14 2.982 -7.168 -0.160
82 HD3 LYS 14 2HD LYS 14 4.203 -6.297 -1.091
83 HE2 LYS 14 1HE LYS 14 4.996 -6.410 1.142
84 HE3 LYS 14 2HE LYS 14 4.449 -4.755 0.881
85 HZ1 LYS 14 3HZ LYS 14 3.244 -5.026 2.711
86 HZ2 LYS 14 1HZ LYS 14 3.514 -6.696 2.752
87 HZ3 LYS 14 2HZ LYS 14 2.246 -6.067 1.826
88 H CYS 15 H CYS 15 1.850 -2.517 -1.420
89 HA CYS 15 HA CYS 15 3.297 -1.173 -3.519
90 HB2 CYS 15 1HB CYS 15 1.965 -0.127 -1.538
91 HB3 CYS 15 2HB CYS 15 3.441 -0.406 -0.620
92 H ASP 16 H ASP 16 5.547 -0.264 -2.856
93 HA ASP 16 HA ASP 16 7.160 -2.509 -1.831
94 HB2 ASP 16 1HB ASP 16 7.512 -0.728 -4.192
95 HB3 ASP 16 2HB ASP 16 8.962 -1.233 -3.328
96 H ILE 17 H ILE 17 6.423 0.844 -1.620
97 HA ILE 17 HA ILE 17 8.794 1.471 -0.057
98 HB ILE 17 HB ILE 17 6.433 3.284 -0.510
99 HG12 ILE 17 1HG1 ILE 17 8.156 4.160 -2.354
100 HG13 ILE 17 2HG1 ILE 17 8.606 2.458 -2.371
101 HG21 ILE 17 1HG2 ILE 17 9.348 3.879 -0.021
102 HG22 ILE 17 2HG2 ILE 17 8.039 5.054 -0.145
103 HG23 ILE 17 3HG2 ILE 17 8.084 3.923 1.207
104 HD11 ILE 17 3HD1 ILE 17 6.771 3.389 -3.982
105 HD12 ILE 17 1HD1 ILE 17 6.601 1.798 -3.241
106 HD13 ILE 17 2HD1 ILE 17 5.730 3.179 -2.574
107 H CYS 18 H CYS 18 5.269 1.381 0.413
108 HA CYS 18 HA CYS 18 5.754 1.201 3.315
109 HB2 CYS 18 1HB CYS 18 3.561 2.239 3.655
110 HB3 CYS 18 2HB CYS 18 4.608 3.283 2.699
111 H GLY 19 H GLY 19 4.840 -0.522 0.651
112 HA2 GLY 19 1HA GLY 19 4.046 -2.686 0.494
113 HA3 GLY 19 2HA GLY 19 3.845 -2.694 2.240
114 H LYS 20 H LYS 20 2.352 -0.014 0.879
115 HA LYS 20 HA LYS 20 -0.212 -0.685 1.682
116 HB2 LYS 20 1HB LYS 20 0.964 1.366 -0.108
117 HB3 LYS 20 2HB LYS 20 -0.763 1.078 -0.279
118 HG2 LYS 20 1HG LYS 20 0.520 1.641 2.376
119 HG3 LYS 20 2HG LYS 20 -0.064 2.918 1.308
120 HD2 LYS 20 1HD LYS 20 -2.263 2.369 1.630
121 HD3 LYS 20 2HD LYS 20 -1.905 0.669 1.941
122 HE2 LYS 20 1HE LYS 20 -1.305 1.076 4.153
123 HE3 LYS 20 2HE LYS 20 -1.032 2.794 3.864
124 HZ1 LYS 20 3HZ LYS 20 -3.077 3.147 4.597
125 HZ2 LYS 20 1HZ LYS 20 -3.395 1.489 4.705
126 HZ3 LYS 20 2HZ LYS 20 -3.687 2.313 3.257
127 H SER 21 H SER 21 -1.908 -1.733 0.794
128 HA SER 21 HA SER 21 -1.415 -3.145 -1.726
129 HB2 SER 21 1HB SER 21 -2.804 -4.827 -0.974
130 HB3 SER 21 2HB SER 21 -2.199 -4.218 0.566
131 HG SER 21 HG SER 21 -4.638 -4.489 0.072
132 H PHE 22 H PHE 22 -3.140 -3.346 -3.291
133 HA PHE 22 HA PHE 22 -5.305 -1.418 -3.164
134 HB2 PHE 22 1HB PHE 22 -3.259 -1.299 -5.390
135 HB3 PHE 22 2HB PHE 22 -4.716 -0.318 -5.264
136 HD1 PHE 22 HD1 PHE 22 -1.580 -1.106 -3.422
137 HD2 PHE 22 HD2 PHE 22 -4.601 1.766 -4.280
138 HE1 PHE 22 HE1 PHE 22 -0.319 0.590 -2.162
139 HE2 PHE 22 HE2 PHE 22 -3.345 3.468 -3.023
140 HZ PHE 22 HZ PHE 22 -1.201 2.881 -1.962
141 H CYS 23 H CYS 23 -7.047 -2.480 -3.807
142 HA CYS 23 HA CYS 23 -7.177 -4.985 -4.884
143 HB2 CYS 23 1HB CYS 23 -9.480 -4.434 -5.595
144 HB3 CYS 23 2HB CYS 23 -9.132 -3.864 -3.968
145 HG CYS 23 HG CYS 23 -10.127 -2.163 -6.612
146 H GLY 24 H GLY 24 -6.673 -1.963 -6.565
147 HA2 GLY 24 1HA GLY 24 -6.275 -3.501 -9.049
148 HA3 GLY 24 2HA GLY 24 -7.205 -2.010 -9.067
149 H ARG 25 H ARG 25 -4.344 -3.186 -9.921
150 HA ARG 25 HA ARG 25 -2.340 -1.636 -8.870
151 HB2 ARG 25 1HB ARG 25 -2.348 -3.454 -10.775
152 HB3 ARG 25 2HB ARG 25 -2.416 -2.049 -11.830
153 HG2 ARG 25 1HG ARG 25 -0.161 -2.383 -11.704
154 HG3 ARG 25 2HG ARG 25 -0.394 -1.241 -10.379
155 HD2 ARG 25 1HD ARG 25 -0.521 -3.151 -8.811
156 HD3 ARG 25 2HD ARG 25 -0.174 -4.240 -10.154
157 HE ARG 25 HE ARG 25 1.691 -2.496 -8.792
158 HH11 ARG 25 1HH1 ARG 25 1.041 -4.450 -11.599
159 HH12 ARG 25 2HH1 ARG 25 2.712 -4.647 -12.010
160 HH21 ARG 25 1HH2 ARG 25 3.895 -2.748 -9.323
161 HH22 ARG 25 2HH2 ARG 25 4.335 -3.680 -10.715
162 H SER 26 H SER 26 -4.567 -0.778 -11.496
163 HA SER 26 HA SER 26 -3.664 1.544 -12.458
164 HB2 SER 26 1HB SER 26 -6.420 0.688 -11.691
165 HB3 SER 26 2HB SER 26 -6.176 2.361 -12.191
166 HG SER 26 HG SER 26 -6.255 0.114 -13.696
167 H ARG 27 H ARG 27 -4.786 1.045 -9.191
168 HA ARG 27 HA ARG 27 -4.614 3.882 -8.563
169 HB2 ARG 27 1HB ARG 27 -6.429 2.392 -7.644
170 HB3 ARG 27 2HB ARG 27 -5.192 1.593 -6.682
171 HG2 ARG 27 1HG ARG 27 -6.241 3.167 -5.272
172 HG3 ARG 27 2HG ARG 27 -4.663 3.839 -5.688
173 HD2 ARG 27 1HD ARG 27 -6.236 5.609 -5.866
174 HD3 ARG 27 2HD ARG 27 -5.811 5.134 -7.510
175 HE ARG 27 HE ARG 27 -7.966 4.383 -7.830
176 HH11 ARG 27 1HH1 ARG 27 -7.449 5.129 -4.469
177 HH12 ARG 27 2HH1 ARG 27 -9.127 5.017 -4.051
178 HH21 ARG 27 1HH2 ARG 27 -10.178 4.232 -7.292
179 HH22 ARG 27 2HH2 ARG 27 -10.678 4.505 -5.658
180 H LEU 28 H LEU 28 -3.166 0.858 -7.344
181 HA LEU 28 HA LEU 28 -1.307 1.907 -5.616
182 HB2 LEU 28 1HB LEU 28 -1.487 -0.404 -5.607
183 HB3 LEU 28 2HB LEU 28 -1.314 -0.523 -7.357
184 HG LEU 28 HG LEU 28 1.061 -0.092 -7.188
185 HD11 LEU 28 1HD1 LEU 28 1.145 1.438 -5.354
186 HD12 LEU 28 2HD1 LEU 28 2.124 0.031 -4.938
187 HD13 LEU 28 3HD1 LEU 28 0.515 0.222 -4.242
188 HD21 LEU 28 3HD2 LEU 28 -0.271 -2.332 -5.933
189 HD22 LEU 28 1HD2 LEU 28 1.331 -2.060 -5.248
190 HD23 LEU 28 2HD2 LEU 28 1.146 -2.306 -6.984
191 H ASN 29 H ASN 29 -0.705 1.096 -9.040
192 HA ASN 29 HA ASN 29 1.833 1.876 -9.413
193 HB2 ASN 29 1HB ASN 29 -0.597 2.122 -11.109
194 HB3 ASN 29 2HB ASN 29 0.840 2.992 -11.639
195 HD21 ASN 29 1HD2 ASN 29 -0.785 0.278 -12.129
196 HD22 ASN 29 2HD2 ASN 29 0.499 -0.806 -12.529
197 H ARG 30 H ARG 30 -0.908 4.154 -9.490
198 HA ARG 30 HA ARG 30 0.665 6.476 -9.754
199 HB2 ARG 30 1HB ARG 30 -2.022 6.418 -8.402
200 HB3 ARG 30 2HB ARG 30 -1.315 7.699 -9.378
201 HG2 ARG 30 1HG ARG 30 -2.418 5.065 -10.311
202 HG3 ARG 30 2HG ARG 30 -3.010 6.687 -10.679
203 HD2 ARG 30 1HD ARG 30 -0.231 5.869 -11.434
204 HD3 ARG 30 2HD ARG 30 -1.603 5.416 -12.446
205 HE ARG 30 HE ARG 30 -0.492 8.065 -12.091
206 HH11 ARG 30 1HH1 ARG 30 -3.189 6.155 -13.186
207 HH12 ARG 30 2HH1 ARG 30 -3.807 7.390 -14.232
208 HH21 ARG 30 1HH2 ARG 30 -1.295 9.699 -13.465
209 HH22 ARG 30 2HH2 ARG 30 -2.728 9.405 -14.391
210 H HIS 31 H HIS 31 -0.598 4.772 -6.930
211 HA HIS 31 HA HIS 31 0.032 6.639 -4.962
212 HB2 HIS 31 1HB HIS 31 -1.307 4.801 -4.315
213 HB3 HIS 31 2HB HIS 31 -0.135 3.631 -4.914
214 HD1 HIS 31 HD1 HIS 31 -0.533 6.154 -2.114
215 HD2 HIS 31 HD2 HIS 31 1.629 2.730 -3.041
216 HE1 HIS 31 HE1 HIS 31 0.703 5.549 -0.009
217 H SER 32 H SER 32 2.033 4.148 -6.465
218 HA SER 32 HA SER 32 4.266 4.370 -4.786
219 HB2 SER 32 1HB SER 32 3.919 2.535 -6.425
220 HB3 SER 32 2HB SER 32 4.244 3.673 -7.733
221 HG SER 32 HG SER 32 6.285 3.372 -7.395
222 H MET 33 H MET 33 2.981 6.574 -7.008
223 HA MET 33 HA MET 33 5.497 7.890 -7.597
224 HB2 MET 33 1HB MET 33 2.738 8.940 -8.201
225 HB3 MET 33 2HB MET 33 4.250 9.340 -9.004
226 HG2 MET 33 1HG MET 33 3.210 6.542 -9.058
227 HG3 MET 33 2HG MET 33 2.567 7.759 -10.158
228 HE1 MET 33 3HE MET 33 4.623 5.088 -9.611
229 HE2 MET 33 1HE MET 33 5.807 5.054 -10.919
230 HE3 MET 33 2HE MET 33 6.223 5.789 -9.371
231 H VAL 34 H VAL 34 2.870 8.155 -5.349
232 HA VAL 34 HA VAL 34 3.288 10.850 -4.563
233 HB VAL 34 HB VAL 34 1.838 10.424 -2.732
234 HG11 VAL 34 1HG1 VAL 34 0.519 10.475 -4.637
235 HG12 VAL 34 2HG1 VAL 34 1.145 8.937 -5.236
236 HG13 VAL 34 3HG1 VAL 34 0.026 8.964 -3.872
237 HG21 VAL 34 3HG2 VAL 34 2.093 8.592 -1.501
238 HG22 VAL 34 1HG2 VAL 34 1.324 7.658 -2.784
239 HG23 VAL 34 2HG2 VAL 34 3.077 7.842 -2.758
240 H HIS 35 H HIS 35 4.943 7.920 -3.889
241 HA HIS 35 HA HIS 35 6.069 8.678 -1.378
242 HB2 HIS 35 1HB HIS 35 6.712 6.541 -3.396
243 HB3 HIS 35 2HB HIS 35 7.738 6.806 -1.989
244 HD1 HIS 35 HD1 HIS 35 6.572 6.423 0.377
245 HD2 HIS 35 HD2 HIS 35 4.439 5.082 -2.926
246 HE1 HIS 35 HE1 HIS 35 4.825 4.863 1.293
247 H THR 36 H THR 36 6.820 9.337 -4.681
248 HA THR 36 HA THR 36 9.431 10.454 -3.910
249 HB THR 36 HB THR 36 9.416 8.773 -5.765
250 HG1 THR 36 HG1 THR 36 11.014 10.487 -5.587
251 HG21 THR 36 3HG2 THR 36 8.684 9.932 -8.014
252 HG22 THR 36 1HG2 THR 36 7.593 10.816 -6.949
253 HG23 THR 36 2HG2 THR 36 7.515 9.056 -7.027
254 H ALA 37 H ALA 37 6.789 11.711 -3.478
255 HA ALA 37 HA ALA 37 6.822 13.956 -5.345
256 HB1 ALA 37 3HB ALA 37 4.809 12.652 -3.811
257 HB2 ALA 37 1HB ALA 37 4.879 14.346 -3.326
258 HB3 ALA 37 2HB ALA 37 4.629 13.923 -5.020
259 H GLU 38 H GLU 38 8.814 14.888 -4.667
260 HA GLU 38 HA GLU 38 8.499 16.615 -2.341
261 HB2 GLU 38 1HB GLU 38 10.746 16.086 -1.491
262 HB3 GLU 38 2HB GLU 38 9.681 14.688 -1.438
263 HG2 GLU 38 1HG GLU 38 10.713 13.951 -3.606
264 HG3 GLU 38 2HG GLU 38 11.899 15.236 -3.387
265 H LYS 39 H LYS 39 9.053 18.622 -2.856
266 HA LYS 39 HA LYS 39 10.559 19.085 -5.314
267 HB2 LYS 39 1HB LYS 39 8.805 20.804 -3.582
268 HB3 LYS 39 2HB LYS 39 9.873 21.524 -4.779
269 HG2 LYS 39 1HG LYS 39 8.771 20.280 -6.547
270 HG3 LYS 39 2HG LYS 39 7.730 19.489 -5.361
271 HD2 LYS 39 1HD LYS 39 6.538 21.434 -4.923
272 HD3 LYS 39 2HD LYS 39 7.823 22.477 -5.537
273 HE2 LYS 39 1HE LYS 39 6.094 20.651 -7.205
274 HE3 LYS 39 2HE LYS 39 5.887 22.394 -7.049
275 HZ1 LYS 39 3HZ LYS 39 7.095 22.205 -8.981
276 HZ2 LYS 39 1HZ LYS 39 8.015 20.898 -8.425
277 HZ3 LYS 39 2HZ LYS 39 8.327 22.457 -7.849
278 HA PRO 40 HA PRO 40 14.288 20.295 -3.338
279 HB2 PRO 40 1HB PRO 40 15.179 22.215 -5.039
280 HB3 PRO 40 2HB PRO 40 15.195 20.493 -5.439
281 HG2 PRO 40 1HG PRO 40 13.226 22.604 -6.233
282 HG3 PRO 40 2HG PRO 40 13.937 21.311 -7.216
283 HD2 PRO 40 1HD PRO 40 11.447 21.142 -6.167
284 HD3 PRO 40 2HD PRO 40 12.484 19.719 -6.401
285 H SER 41 H SER 41 11.952 22.788 -4.153
286 HA SER 41 HA SER 41 13.034 25.013 -2.947
287 HB2 SER 41 1HB SER 41 10.124 24.171 -2.925
288 HB3 SER 41 2HB SER 41 10.722 25.805 -2.635
289 HG SER 41 HG SER 41 11.467 24.491 -4.994
290 H GLY 42 H GLY 42 11.000 22.522 -1.412
291 HA2 GLY 42 1HA GLY 42 11.314 23.679 1.203
292 HA3 GLY 42 2HA GLY 42 10.543 22.146 0.825
293 HA PRO 43 HA PRO 43 15.002 21.728 2.554
294 HB2 PRO 43 1HB PRO 43 14.468 21.430 5.200
295 HB3 PRO 43 2HB PRO 43 14.821 22.997 4.462
296 HG2 PRO 43 1HG PRO 43 12.175 21.790 5.171
297 HG3 PRO 43 2HG PRO 43 12.746 23.452 5.407
298 HD2 PRO 43 1HD PRO 43 11.116 22.749 3.363
299 HD3 PRO 43 2HD PRO 43 12.323 24.042 3.220
300 H SER 44 H SER 44 15.774 19.806 3.883
301 HA SER 44 HA SER 44 13.919 17.542 3.538
302 HB2 SER 44 1HB SER 44 15.938 17.723 1.934
303 HB3 SER 44 2HB SER 44 16.911 17.271 3.333
304 HG SER 44 HG SER 44 15.690 15.645 1.731
305 H SER 45 H SER 45 14.808 15.560 4.828
306 HA SER 45 HA SER 45 15.350 16.516 7.557
307 HB2 SER 45 1HB SER 45 13.969 14.012 6.573
308 HB3 SER 45 2HB SER 45 14.370 14.309 8.264
309 HG SER 45 HG SER 45 13.129 16.350 7.918
310 H GLY 46 H GLY 46 17.165 15.929 8.575
311 HA2 GLY 46 1HA GLY 46 19.284 14.689 7.210
312 HA3 GLY 46 2HA GLY 46 19.225 14.987 8.941
Start of MODEL 2
1 H1 GLY 1 H GLY 1 -3.579 8.608 13.976
2 HA2 GLY 1 1HA GLY 1 -6.432 8.374 13.492
3 HA3 GLY 1 2HA GLY 1 -5.174 7.322 12.859
4 H SER 2 H SER 2 -7.800 6.842 14.286
5 HA SER 2 HA SER 2 -6.851 5.400 16.652
6 HB2 SER 2 1HB SER 2 -8.834 6.874 16.887
7 HB3 SER 2 2HB SER 2 -9.689 5.879 15.709
8 HG SER 2 HG SER 2 -9.872 4.297 17.145
9 H SER 3 H SER 3 -5.951 3.527 15.957
10 HA SER 3 HA SER 3 -7.752 1.554 14.812
11 HB2 SER 3 1HB SER 3 -6.164 0.895 13.050
12 HB3 SER 3 2HB SER 3 -6.703 2.560 12.830
13 HG SER 3 HG SER 3 -4.727 3.215 13.107
14 H GLY 4 H GLY 4 -6.746 -0.649 14.814
15 HA2 GLY 4 1HA GLY 4 -4.772 -0.876 17.002
16 HA3 GLY 4 2HA GLY 4 -6.168 -1.937 16.879
17 H SER 5 H SER 5 -5.757 -3.872 16.069
18 HA SER 5 HA SER 5 -3.807 -4.140 13.904
19 HB2 SER 5 1HB SER 5 -2.701 -4.598 16.149
20 HB3 SER 5 2HB SER 5 -3.761 -6.001 16.284
21 HG SER 5 HG SER 5 -2.788 -6.326 13.972
22 H SER 6 H SER 6 -5.078 -4.889 12.329
23 HA SER 6 HA SER 6 -6.570 -7.361 12.831
24 HB2 SER 6 1HB SER 6 -7.688 -4.874 11.524
25 HB3 SER 6 2HB SER 6 -8.445 -6.462 11.402
26 HG SER 6 HG SER 6 -7.868 -5.142 13.847
27 H GLY 7 H GLY 7 -6.112 -8.862 11.362
28 HA2 GLY 7 1HA GLY 7 -5.202 -7.975 8.697
29 HA3 GLY 7 2HA GLY 7 -4.345 -9.228 9.582
30 H THR 8 H THR 8 -6.587 -8.672 7.219
31 HA THR 8 HA THR 8 -7.232 -11.441 6.975
32 HB THR 8 HB THR 8 -8.899 -11.023 8.639
33 HG1 THR 8 HG1 THR 8 -10.080 -10.928 6.043
34 HG21 THR 8 3HG2 THR 8 -9.880 -8.716 6.957
35 HG22 THR 8 1HG2 THR 8 -8.899 -8.543 8.411
36 HG23 THR 8 2HG2 THR 8 -10.516 -9.238 8.516
37 H GLY 9 H GLY 9 -7.692 -11.937 4.896
38 HA2 GLY 9 1HA GLY 9 -8.001 -11.653 2.640
39 HA3 GLY 9 2HA GLY 9 -9.066 -10.322 3.067
40 H GLU 10 H GLU 10 -6.334 -11.125 1.403
41 HA GLU 10 HA GLU 10 -5.195 -8.422 1.662
42 HB2 GLU 10 1HB GLU 10 -3.117 -9.349 0.771
43 HB3 GLU 10 2HB GLU 10 -3.624 -10.220 2.211
44 HG2 GLU 10 1HG GLU 10 -4.333 -12.084 0.956
45 HG3 GLU 10 2HG GLU 10 -4.237 -11.192 -0.561
46 H LYS 11 H LYS 11 -4.493 -7.347 -0.268
47 HA LYS 11 HA LYS 11 -6.315 -7.783 -2.475
48 HB2 LYS 11 1HB LYS 11 -4.468 -5.614 -1.617
49 HB3 LYS 11 2HB LYS 11 -4.851 -5.719 -3.330
50 HG2 LYS 11 1HG LYS 11 -6.377 -4.193 -2.347
51 HG3 LYS 11 2HG LYS 11 -7.271 -5.671 -2.709
52 HD2 LYS 11 1HD LYS 11 -6.047 -5.405 -0.013
53 HD3 LYS 11 2HD LYS 11 -7.481 -4.439 -0.369
54 HE2 LYS 11 1HE LYS 11 -8.702 -6.454 -0.984
55 HE3 LYS 11 2HE LYS 11 -7.265 -7.431 -0.689
56 HZ1 LYS 11 3HZ LYS 11 -8.964 -7.363 1.148
57 HZ2 LYS 11 1HZ LYS 11 -8.504 -5.756 1.415
58 HZ3 LYS 11 2HZ LYS 11 -7.375 -7.002 1.604
59 HA PRO 12 HA PRO 12 -3.597 -9.854 -5.229
60 HB2 PRO 12 1HB PRO 12 -4.274 -8.751 -7.616
61 HB3 PRO 12 2HB PRO 12 -5.323 -9.877 -6.746
62 HG2 PRO 12 1HG PRO 12 -5.436 -6.888 -6.861
63 HG3 PRO 12 2HG PRO 12 -6.761 -8.062 -6.954
64 HD2 PRO 12 1HD PRO 12 -6.170 -6.709 -4.684
65 HD3 PRO 12 2HD PRO 12 -6.826 -8.359 -4.670
66 H PHE 13 H PHE 13 -3.121 -6.720 -4.380
67 HA PHE 13 HA PHE 13 -0.574 -6.617 -5.820
68 HB2 PHE 13 1HB PHE 13 -2.501 -4.291 -5.634
69 HB3 PHE 13 2HB PHE 13 -0.876 -4.222 -6.308
70 HD1 PHE 13 HD1 PHE 13 -0.369 -5.287 -8.443
71 HD2 PHE 13 HD2 PHE 13 -4.318 -5.260 -6.855
72 HE1 PHE 13 HE1 PHE 13 -1.258 -5.909 -10.652
73 HE2 PHE 13 HE2 PHE 13 -5.213 -5.882 -9.061
74 HZ PHE 13 HZ PHE 13 -3.682 -6.208 -10.962
75 H LYS 14 H LYS 14 0.874 -4.884 -4.885
76 HA LYS 14 HA LYS 14 0.333 -4.017 -2.197
77 HB2 LYS 14 1HB LYS 14 0.966 -6.352 -1.790
78 HB3 LYS 14 2HB LYS 14 2.466 -6.108 -2.676
79 HG2 LYS 14 1HG LYS 14 2.893 -4.238 -0.927
80 HG3 LYS 14 2HG LYS 14 1.674 -5.096 0.019
81 HD2 LYS 14 1HD LYS 14 2.994 -7.153 -0.155
82 HD3 LYS 14 2HD LYS 14 4.212 -6.292 -1.098
83 HE2 LYS 14 1HE LYS 14 4.433 -4.723 0.875
84 HE3 LYS 14 2HE LYS 14 3.454 -5.872 1.785
85 HZ1 LYS 14 3HZ LYS 14 5.305 -7.490 0.773
86 HZ2 LYS 14 1HZ LYS 14 5.457 -6.731 2.277
87 HZ3 LYS 14 2HZ LYS 14 6.215 -6.072 0.916
88 H CYS 15 H CYS 15 1.857 -2.511 -1.423
89 HA CYS 15 HA CYS 15 3.293 -1.143 -3.512
90 HB2 CYS 15 1HB CYS 15 1.966 -0.102 -1.543
91 HB3 CYS 15 2HB CYS 15 3.416 -0.421 -0.597
92 H ASP 16 H ASP 16 5.544 -0.257 -2.909
93 HA ASP 16 HA ASP 16 7.170 -2.492 -1.883
94 HB2 ASP 16 1HB ASP 16 7.504 -0.708 -4.247
95 HB3 ASP 16 2HB ASP 16 8.957 -1.232 -3.402
96 H ILE 17 H ILE 17 6.405 0.843 -1.637
97 HA ILE 17 HA ILE 17 8.802 1.481 -0.112
98 HB ILE 17 HB ILE 17 6.439 3.295 -0.544
99 HG12 ILE 17 1HG1 ILE 17 8.143 4.162 -2.412
100 HG13 ILE 17 2HG1 ILE 17 8.585 2.458 -2.431
101 HG21 ILE 17 1HG2 ILE 17 8.003 4.040 1.132
102 HG22 ILE 17 2HG2 ILE 17 9.356 3.793 0.028
103 HG23 ILE 17 3HG2 ILE 17 8.165 5.051 -0.304
104 HD11 ILE 17 3HD1 ILE 17 5.702 3.040 -2.536
105 HD12 ILE 17 1HD1 ILE 17 6.647 3.517 -3.947
106 HD13 ILE 17 2HD1 ILE 17 6.657 1.838 -3.405
107 H CYS 18 H CYS 18 5.286 1.341 0.383
108 HA CYS 18 HA CYS 18 5.793 1.175 3.282
109 HB2 CYS 18 1HB CYS 18 3.599 2.217 3.640
110 HB3 CYS 18 2HB CYS 18 4.654 3.265 2.697
111 H GLY 19 H GLY 19 4.859 -0.540 0.625
112 HA2 GLY 19 1HA GLY 19 4.064 -2.706 0.478
113 HA3 GLY 19 2HA GLY 19 3.845 -2.701 2.222
114 H LYS 20 H LYS 20 2.370 -0.007 0.938
115 HA LYS 20 HA LYS 20 -0.197 -0.661 1.686
116 HB2 LYS 20 1HB LYS 20 1.003 1.369 -0.109
117 HB3 LYS 20 2HB LYS 20 -0.723 1.089 -0.298
118 HG2 LYS 20 1HG LYS 20 0.546 1.679 2.360
119 HG3 LYS 20 2HG LYS 20 -0.052 2.938 1.278
120 HD2 LYS 20 1HD LYS 20 -2.238 2.397 1.635
121 HD3 LYS 20 2HD LYS 20 -1.883 0.688 1.902
122 HE2 LYS 20 1HE LYS 20 -1.084 2.825 3.860
123 HE3 LYS 20 2HE LYS 20 -2.662 2.041 3.915
124 HZ1 LYS 20 3HZ LYS 20 -0.004 0.894 4.435
125 HZ2 LYS 20 1HZ LYS 20 -1.255 -0.111 3.899
126 HZ3 LYS 20 2HZ LYS 20 -1.426 0.756 5.341
127 H SER 21 H SER 21 -1.881 -1.731 0.812
128 HA SER 21 HA SER 21 -1.393 -3.145 -1.708
129 HB2 SER 21 1HB SER 21 -2.759 -4.836 -0.942
130 HB3 SER 21 2HB SER 21 -2.166 -4.211 0.597
131 HG SER 21 HG SER 21 -4.150 -3.762 1.073
132 H PHE 22 H PHE 22 -3.121 -3.354 -3.267
133 HA PHE 22 HA PHE 22 -5.299 -1.442 -3.130
134 HB2 PHE 22 1HB PHE 22 -3.267 -1.304 -5.367
135 HB3 PHE 22 2HB PHE 22 -4.726 -0.330 -5.225
136 HD1 PHE 22 HD1 PHE 22 -1.557 -1.104 -3.438
137 HD2 PHE 22 HD2 PHE 22 -4.629 1.741 -4.204
138 HE1 PHE 22 HE1 PHE 22 -0.295 0.593 -2.180
139 HE2 PHE 22 HE2 PHE 22 -3.371 3.442 -2.949
140 HZ PHE 22 HZ PHE 22 -1.200 2.870 -1.935
141 H CYS 23 H CYS 23 -7.036 -2.512 -3.774
142 HA CYS 23 HA CYS 23 -7.150 -5.018 -4.854
143 HB2 CYS 23 1HB CYS 23 -9.459 -4.460 -5.586
144 HB3 CYS 23 2HB CYS 23 -9.118 -3.948 -3.937
145 HG CYS 23 HG CYS 23 -8.356 -1.312 -5.371
146 H GLY 24 H GLY 24 -6.686 -1.986 -6.534
147 HA2 GLY 24 1HA GLY 24 -6.304 -3.518 -9.027
148 HA3 GLY 24 2HA GLY 24 -7.209 -2.011 -9.027
149 H ARG 25 H ARG 25 -4.363 -3.241 -9.886
150 HA ARG 25 HA ARG 25 -2.348 -1.689 -8.833
151 HB2 ARG 25 1HB ARG 25 -2.260 -3.572 -10.608
152 HB3 ARG 25 2HB ARG 25 -2.466 -2.275 -11.777
153 HG2 ARG 25 1HG ARG 25 -0.200 -2.388 -11.741
154 HG3 ARG 25 2HG ARG 25 -0.447 -1.226 -10.435
155 HD2 ARG 25 1HD ARG 25 -0.301 -3.035 -8.797
156 HD3 ARG 25 2HD ARG 25 -0.073 -4.201 -10.100
157 HE ARG 25 HE ARG 25 1.886 -2.349 -9.051
158 HH11 ARG 25 1HH1 ARG 25 0.989 -4.484 -11.650
159 HH12 ARG 25 2HH1 ARG 25 2.612 -4.682 -12.222
160 HH21 ARG 25 1HH2 ARG 25 4.028 -2.601 -9.795
161 HH22 ARG 25 2HH2 ARG 25 4.340 -3.611 -11.165
162 H SER 26 H SER 26 -4.570 -0.882 -11.472
163 HA SER 26 HA SER 26 -3.619 1.399 -12.508
164 HB2 SER 26 1HB SER 26 -5.852 0.418 -13.023
165 HB3 SER 26 2HB SER 26 -6.473 1.129 -11.533
166 HG SER 26 HG SER 26 -6.462 3.054 -12.431
167 H ARG 27 H ARG 27 -4.748 0.995 -9.236
168 HA ARG 27 HA ARG 27 -4.566 3.853 -8.691
169 HB2 ARG 27 1HB ARG 27 -6.312 2.095 -7.748
170 HB3 ARG 27 2HB ARG 27 -5.057 1.842 -6.543
171 HG2 ARG 27 1HG ARG 27 -6.222 4.536 -7.199
172 HG3 ARG 27 2HG ARG 27 -6.813 3.493 -5.905
173 HD2 ARG 27 1HD ARG 27 -4.326 3.480 -5.144
174 HD3 ARG 27 2HD ARG 27 -4.200 4.928 -6.142
175 HE ARG 27 HE ARG 27 -5.389 4.737 -3.574
176 HH11 ARG 27 1HH1 ARG 27 -5.712 6.323 -6.656
177 HH12 ARG 27 2HH1 ARG 27 -6.508 7.716 -6.003
178 HH21 ARG 27 1HH2 ARG 27 -6.435 6.567 -2.702
179 HH22 ARG 27 2HH2 ARG 27 -6.918 7.854 -3.753
180 H LEU 28 H LEU 28 -3.182 0.851 -7.349
181 HA LEU 28 HA LEU 28 -1.342 1.891 -5.618
182 HB2 LEU 28 1HB LEU 28 -1.499 -0.416 -5.611
183 HB3 LEU 28 2HB LEU 28 -1.326 -0.534 -7.361
184 HG LEU 28 HG LEU 28 1.048 -0.096 -7.192
185 HD11 LEU 28 1HD1 LEU 28 0.485 0.234 -4.254
186 HD12 LEU 28 2HD1 LEU 28 1.161 1.424 -5.366
187 HD13 LEU 28 3HD1 LEU 28 2.100 -0.001 -4.922
188 HD21 LEU 28 3HD2 LEU 28 -0.278 -2.342 -5.937
189 HD22 LEU 28 1HD2 LEU 28 1.330 -2.070 -5.265
190 HD23 LEU 28 2HD2 LEU 28 1.129 -2.312 -7.001
191 H ASN 29 H ASN 29 -0.743 1.177 -9.060
192 HA ASN 29 HA ASN 29 1.830 1.962 -9.358
193 HB2 ASN 29 1HB ASN 29 -0.559 2.140 -11.121
194 HB3 ASN 29 2HB ASN 29 0.876 3.029 -11.622
195 HD21 ASN 29 1HD2 ASN 29 -0.682 0.297 -12.156
196 HD22 ASN 29 2HD2 ASN 29 0.630 -0.775 -12.494
197 H ARG 30 H ARG 30 -0.971 4.158 -9.433
198 HA ARG 30 HA ARG 30 0.522 6.528 -9.745
199 HB2 ARG 30 1HB ARG 30 -2.147 6.352 -8.356
200 HB3 ARG 30 2HB ARG 30 -1.493 7.694 -9.284
201 HG2 ARG 30 1HG ARG 30 -2.622 5.103 -10.263
202 HG3 ARG 30 2HG ARG 30 -3.075 6.753 -10.698
203 HD2 ARG 30 1HD ARG 30 -1.018 7.049 -11.913
204 HD3 ARG 30 2HD ARG 30 -0.425 5.481 -11.367
205 HE ARG 30 HE ARG 30 -2.888 5.254 -12.784
206 HH11 ARG 30 1HH1 ARG 30 0.548 5.648 -13.186
207 HH12 ARG 30 2HH1 ARG 30 0.577 4.930 -14.763
208 HH21 ARG 30 1HH2 ARG 30 -2.862 4.307 -14.859
209 HH22 ARG 30 2HH2 ARG 30 -1.363 4.168 -15.714
210 H HIS 31 H HIS 31 -0.579 4.770 -6.894
211 HA HIS 31 HA HIS 31 0.023 6.681 -4.947
212 HB2 HIS 31 1HB HIS 31 -1.256 4.798 -4.281
213 HB3 HIS 31 2HB HIS 31 -0.039 3.668 -4.866
214 HD1 HIS 31 HD1 HIS 31 -0.385 6.322 -2.164
215 HD2 HIS 31 HD2 HIS 31 1.624 2.766 -2.928
216 HE1 HIS 31 HE1 HIS 31 0.847 5.776 -0.041
217 H SER 32 H SER 32 2.045 4.136 -6.364
218 HA SER 32 HA SER 32 4.306 4.460 -4.775
219 HB2 SER 32 1HB SER 32 3.953 2.610 -6.410
220 HB3 SER 32 2HB SER 32 4.269 3.749 -7.718
221 HG SER 32 HG SER 32 6.282 3.259 -7.412
222 H MET 33 H MET 33 2.922 6.643 -6.937
223 HA MET 33 HA MET 33 5.391 7.994 -7.632
224 HB2 MET 33 1HB MET 33 2.611 9.053 -8.091
225 HB3 MET 33 2HB MET 33 4.079 9.413 -8.990
226 HG2 MET 33 1HG MET 33 3.061 6.618 -8.949
227 HG3 MET 33 2HG MET 33 2.255 7.813 -9.962
228 HE1 MET 33 3HE MET 33 5.662 5.302 -10.986
229 HE2 MET 33 1HE MET 33 6.086 6.135 -9.491
230 HE3 MET 33 2HE MET 33 4.566 5.248 -9.605
231 H VAL 34 H VAL 34 2.910 8.183 -5.231
232 HA VAL 34 HA VAL 34 3.391 10.891 -4.449
233 HB VAL 34 HB VAL 34 1.861 10.560 -2.725
234 HG11 VAL 34 1HG1 VAL 34 1.085 8.483 -4.770
235 HG12 VAL 34 2HG1 VAL 34 -0.002 9.361 -3.692
236 HG13 VAL 34 3HG1 VAL 34 0.869 10.223 -4.961
237 HG21 VAL 34 3HG2 VAL 34 2.587 8.884 -1.361
238 HG22 VAL 34 1HG2 VAL 34 1.265 8.036 -2.163
239 HG23 VAL 34 2HG2 VAL 34 2.926 7.789 -2.701
240 H HIS 35 H HIS 35 4.986 7.924 -3.894
241 HA HIS 35 HA HIS 35 6.142 8.573 -1.358
242 HB2 HIS 35 1HB HIS 35 6.626 6.450 -3.422
243 HB3 HIS 35 2HB HIS 35 7.768 6.671 -2.100
244 HD1 HIS 35 HD1 HIS 35 6.715 6.391 0.364
245 HD2 HIS 35 HD2 HIS 35 4.422 4.971 -2.795
246 HE1 HIS 35 HE1 HIS 35 5.016 4.855 1.404
247 H THR 36 H THR 36 6.798 9.442 -4.595
248 HA THR 36 HA THR 36 9.430 10.505 -3.798
249 HB THR 36 HB THR 36 9.543 8.722 -5.550
250 HG1 THR 36 HG1 THR 36 10.689 10.313 -7.092
251 HG21 THR 36 3HG2 THR 36 8.714 9.089 -7.742
252 HG22 THR 36 1HG2 THR 36 8.288 10.761 -7.379
253 HG23 THR 36 2HG2 THR 36 7.375 9.440 -6.650
254 H ALA 37 H ALA 37 6.605 11.635 -3.758
255 HA ALA 37 HA ALA 37 6.916 13.884 -5.608
256 HB1 ALA 37 3HB ALA 37 4.726 12.463 -5.132
257 HB2 ALA 37 1HB ALA 37 4.537 13.660 -3.851
258 HB3 ALA 37 2HB ALA 37 4.661 14.179 -5.532
259 H GLU 38 H GLU 38 8.690 13.706 -3.383
260 HA GLU 38 HA GLU 38 8.412 16.326 -2.335
261 HB2 GLU 38 1HB GLU 38 7.975 15.905 -0.044
262 HB3 GLU 38 2HB GLU 38 6.748 15.021 -0.941
263 HG2 GLU 38 1HG GLU 38 9.255 13.631 -0.127
264 HG3 GLU 38 2HG GLU 38 7.983 13.908 1.062
265 H LYS 39 H LYS 39 10.050 16.505 -0.327
266 HA LYS 39 HA LYS 39 12.598 15.999 -1.373
267 HB2 LYS 39 1HB LYS 39 11.524 16.961 1.227
268 HB3 LYS 39 2HB LYS 39 13.192 16.403 1.204
269 HG2 LYS 39 1HG LYS 39 13.534 18.593 0.732
270 HG3 LYS 39 2HG LYS 39 13.309 17.988 -0.911
271 HD2 LYS 39 1HD LYS 39 10.897 18.852 0.596
272 HD3 LYS 39 2HD LYS 39 11.991 20.103 0.003
273 HE2 LYS 39 1HE LYS 39 11.753 19.330 -2.251
274 HE3 LYS 39 2HE LYS 39 10.850 17.911 -1.722
275 HZ1 LYS 39 3HZ LYS 39 9.002 19.208 -1.176
276 HZ2 LYS 39 1HZ LYS 39 9.528 19.844 -2.653
277 HZ3 LYS 39 2HZ LYS 39 9.875 20.656 -1.211
278 HA PRO 40 HA PRO 40 13.669 11.930 -0.129
279 HB2 PRO 40 1HB PRO 40 16.258 12.212 0.638
280 HB3 PRO 40 2HB PRO 40 15.743 12.294 -1.051
281 HG2 PRO 40 1HG PRO 40 16.344 14.522 0.856
282 HG3 PRO 40 2HG PRO 40 16.800 14.355 -0.850
283 HD2 PRO 40 1HD PRO 40 14.721 15.890 -0.041
284 HD3 PRO 40 2HD PRO 40 14.731 15.041 -1.600
285 H SER 41 H SER 41 13.569 14.451 2.125
286 HA SER 41 HA SER 41 14.487 13.028 4.427
287 HB2 SER 41 1HB SER 41 14.576 15.413 4.523
288 HB3 SER 41 2HB SER 41 12.873 15.560 4.089
289 HG SER 41 HG SER 41 13.477 14.092 6.374
290 H GLY 42 H GLY 42 13.392 11.081 4.563
291 HA2 GLY 42 1HA GLY 42 10.812 11.205 5.822
292 HA3 GLY 42 2HA GLY 42 10.744 10.517 4.206
293 HA PRO 43 HA PRO 43 12.338 7.489 7.607
294 HB2 PRO 43 1HB PRO 43 10.011 6.500 8.597
295 HB3 PRO 43 2HB PRO 43 10.853 7.877 9.318
296 HG2 PRO 43 1HG PRO 43 8.506 7.852 7.460
297 HG3 PRO 43 2HG PRO 43 8.777 8.840 8.908
298 HD2 PRO 43 1HD PRO 43 9.167 9.789 6.402
299 HD3 PRO 43 2HD PRO 43 10.133 10.331 7.790
300 H SER 44 H SER 44 12.728 5.458 6.930
301 HA SER 44 HA SER 44 10.837 3.784 5.660
302 HB2 SER 44 1HB SER 44 11.681 3.743 3.397
303 HB3 SER 44 2HB SER 44 11.265 5.409 3.801
304 HG SER 44 HG SER 44 13.303 5.268 2.780
305 H SER 45 H SER 45 11.495 1.709 5.768
306 HA SER 45 HA SER 45 13.808 1.037 7.210
307 HB2 SER 45 1HB SER 45 12.049 -0.701 5.463
308 HB3 SER 45 2HB SER 45 13.259 -1.309 6.593
309 HG SER 45 HG SER 45 11.229 0.442 7.460
310 H GLY 46 H GLY 46 13.065 0.595 3.750
311 HA2 GLY 46 1HA GLY 46 15.963 0.271 3.278
312 HA3 GLY 46 2HA GLY 46 14.709 -0.429 2.266
Start of MODEL 3
1 H1 GLY 1 H GLY 1 1.097 -10.879 16.729
2 HA2 GLY 1 1HA GLY 1 1.934 -9.048 15.627
3 HA3 GLY 1 2HA GLY 1 1.088 -9.653 14.211
4 H SER 2 H SER 2 -1.341 -9.219 14.243
5 HA SER 2 HA SER 2 -1.751 -6.447 15.148
6 HB2 SER 2 1HB SER 2 -1.836 -7.213 12.614
7 HB3 SER 2 2HB SER 2 -3.477 -7.691 13.047
8 HG SER 2 HG SER 2 -3.959 -5.601 13.542
9 H SER 3 H SER 3 -4.048 -5.871 15.618
10 HA SER 3 HA SER 3 -5.251 -7.995 17.244
11 HB2 SER 3 1HB SER 3 -6.486 -6.121 18.343
12 HB3 SER 3 2HB SER 3 -4.734 -5.975 18.476
13 HG SER 3 HG SER 3 -5.909 -4.022 17.840
14 H GLY 4 H GLY 4 -6.847 -9.087 16.315
15 HA2 GLY 4 1HA GLY 4 -9.260 -8.036 15.507
16 HA3 GLY 4 2HA GLY 4 -8.283 -8.105 14.048
17 H SER 5 H SER 5 -9.390 -9.687 12.983
18 HA SER 5 HA SER 5 -9.898 -12.220 14.338
19 HB2 SER 5 1HB SER 5 -11.073 -12.807 12.194
20 HB3 SER 5 2HB SER 5 -11.732 -11.393 13.016
21 HG SER 5 HG SER 5 -11.488 -10.575 11.071
22 H SER 6 H SER 6 -9.050 -14.189 13.676
23 HA SER 6 HA SER 6 -6.400 -14.307 12.952
24 HB2 SER 6 1HB SER 6 -6.730 -16.687 12.556
25 HB3 SER 6 2HB SER 6 -7.685 -16.185 13.950
26 HG SER 6 HG SER 6 -8.704 -17.550 12.213
27 H GLY 7 H GLY 7 -5.398 -13.726 11.150
28 HA2 GLY 7 1HA GLY 7 -4.871 -13.653 8.901
29 HA3 GLY 7 2HA GLY 7 -6.270 -14.667 8.582
30 H THR 8 H THR 8 -5.747 -12.731 6.806
31 HA THR 8 HA THR 8 -8.087 -11.054 7.031
32 HB THR 8 HB THR 8 -6.427 -9.664 8.182
33 HG1 THR 8 HG1 THR 8 -7.026 -8.692 5.567
34 HG21 THR 8 3HG2 THR 8 -4.409 -10.556 7.103
35 HG22 THR 8 1HG2 THR 8 -4.478 -8.798 6.991
36 HG23 THR 8 2HG2 THR 8 -4.883 -9.787 5.588
37 H GLY 9 H GLY 9 -8.662 -10.027 5.030
38 HA2 GLY 9 1HA GLY 9 -7.834 -11.585 2.743
39 HA3 GLY 9 2HA GLY 9 -9.080 -10.346 2.769
40 H GLU 10 H GLU 10 -5.957 -11.112 1.787
41 HA GLU 10 HA GLU 10 -5.019 -8.366 1.657
42 HB2 GLU 10 1HB GLU 10 -3.611 -10.534 2.079
43 HB3 GLU 10 2HB GLU 10 -3.634 -10.664 0.326
44 HG2 GLU 10 1HG GLU 10 -2.713 -8.335 0.237
45 HG3 GLU 10 2HG GLU 10 -2.501 -8.429 1.984
46 H LYS 11 H LYS 11 -4.372 -7.366 -0.343
47 HA LYS 11 HA LYS 11 -6.279 -7.903 -2.470
48 HB2 LYS 11 1HB LYS 11 -4.518 -5.630 -1.705
49 HB3 LYS 11 2HB LYS 11 -4.942 -5.788 -3.404
50 HG2 LYS 11 1HG LYS 11 -6.540 -4.340 -2.483
51 HG3 LYS 11 2HG LYS 11 -7.356 -5.896 -2.652
52 HD2 LYS 11 1HD LYS 11 -5.987 -5.307 -0.079
53 HD3 LYS 11 2HD LYS 11 -7.503 -4.471 -0.421
54 HE2 LYS 11 1HE LYS 11 -7.385 -7.408 -0.868
55 HE3 LYS 11 2HE LYS 11 -7.441 -6.824 0.795
56 HZ1 LYS 11 3HZ LYS 11 -9.603 -7.258 -0.704
57 HZ2 LYS 11 1HZ LYS 11 -9.356 -5.613 -1.011
58 HZ3 LYS 11 2HZ LYS 11 -9.558 -6.155 0.578
59 HA PRO 12 HA PRO 12 -3.549 -9.850 -5.299
60 HB2 PRO 12 1HB PRO 12 -4.258 -8.727 -7.667
61 HB3 PRO 12 2HB PRO 12 -5.282 -9.882 -6.807
62 HG2 PRO 12 1HG PRO 12 -5.446 -6.894 -6.881
63 HG3 PRO 12 2HG PRO 12 -6.752 -8.088 -6.983
64 HD2 PRO 12 1HD PRO 12 -6.170 -6.757 -4.698
65 HD3 PRO 12 2HD PRO 12 -6.798 -8.417 -4.702
66 H PHE 13 H PHE 13 -3.109 -6.731 -4.399
67 HA PHE 13 HA PHE 13 -0.574 -6.565 -5.850
68 HB2 PHE 13 1HB PHE 13 -2.550 -4.283 -5.647
69 HB3 PHE 13 2HB PHE 13 -0.921 -4.163 -6.302
70 HD1 PHE 13 HD1 PHE 13 -0.362 -5.211 -8.440
71 HD2 PHE 13 HD2 PHE 13 -4.332 -5.255 -6.906
72 HE1 PHE 13 HE1 PHE 13 -1.212 -5.825 -10.666
73 HE2 PHE 13 HE2 PHE 13 -5.188 -5.870 -9.129
74 HZ PHE 13 HZ PHE 13 -3.628 -6.157 -11.013
75 H LYS 14 H LYS 14 0.885 -4.894 -4.891
76 HA LYS 14 HA LYS 14 0.326 -4.021 -2.203
77 HB2 LYS 14 1HB LYS 14 0.960 -6.356 -1.803
78 HB3 LYS 14 2HB LYS 14 2.460 -6.108 -2.687
79 HG2 LYS 14 1HG LYS 14 2.884 -4.245 -0.930
80 HG3 LYS 14 2HG LYS 14 1.668 -5.111 0.012
81 HD2 LYS 14 1HD LYS 14 2.999 -7.170 -0.203
82 HD3 LYS 14 2HD LYS 14 4.225 -6.270 -1.100
83 HE2 LYS 14 1HE LYS 14 4.483 -4.783 0.881
84 HE3 LYS 14 2HE LYS 14 3.377 -5.836 1.762
85 HZ1 LYS 14 3HZ LYS 14 6.147 -6.290 0.981
86 HZ2 LYS 14 1HZ LYS 14 5.115 -7.629 0.913
87 HZ3 LYS 14 2HZ LYS 14 5.317 -6.790 2.368
88 H CYS 15 H CYS 15 1.835 -2.508 -1.423
89 HA CYS 15 HA CYS 15 3.288 -1.141 -3.503
90 HB2 CYS 15 1HB CYS 15 1.934 -0.090 -1.563
91 HB3 CYS 15 2HB CYS 15 3.364 -0.410 -0.587
92 H ASP 16 H ASP 16 5.530 -0.252 -2.893
93 HA ASP 16 HA ASP 16 7.150 -2.473 -1.830
94 HB2 ASP 16 1HB ASP 16 7.493 -0.715 -4.208
95 HB3 ASP 16 2HB ASP 16 8.947 -1.198 -3.338
96 H ILE 17 H ILE 17 6.369 0.859 -1.608
97 HA ILE 17 HA ILE 17 8.750 1.525 -0.073
98 HB ILE 17 HB ILE 17 6.362 3.304 -0.511
99 HG12 ILE 17 1HG1 ILE 17 8.053 4.202 -2.371
100 HG13 ILE 17 2HG1 ILE 17 8.537 2.510 -2.385
101 HG21 ILE 17 1HG2 ILE 17 7.962 4.016 1.187
102 HG22 ILE 17 2HG2 ILE 17 9.272 3.894 0.013
103 HG23 ILE 17 3HG2 ILE 17 7.999 5.094 -0.209
104 HD11 ILE 17 3HD1 ILE 17 6.563 1.812 -3.270
105 HD12 ILE 17 1HD1 ILE 17 5.643 3.135 -2.553
106 HD13 ILE 17 2HD1 ILE 17 6.651 3.428 -3.971
107 H CYS 18 H CYS 18 5.238 1.323 0.420
108 HA CYS 18 HA CYS 18 5.748 1.157 3.319
109 HB2 CYS 18 1HB CYS 18 3.548 2.187 3.684
110 HB3 CYS 18 2HB CYS 18 4.599 3.246 2.749
111 H GLY 19 H GLY 19 4.802 -0.536 0.645
112 HA2 GLY 19 1HA GLY 19 4.026 -2.711 0.493
113 HA3 GLY 19 2HA GLY 19 3.797 -2.712 2.235
114 H LYS 20 H LYS 20 2.321 -0.019 0.949
115 HA LYS 20 HA LYS 20 -0.250 -0.692 1.678
116 HB2 LYS 20 1HB LYS 20 0.953 1.364 -0.087
117 HB3 LYS 20 2HB LYS 20 -0.771 1.082 -0.282
118 HG2 LYS 20 1HG LYS 20 0.492 1.644 2.385
119 HG3 LYS 20 2HG LYS 20 -0.112 2.914 1.317
120 HD2 LYS 20 1HD LYS 20 -2.295 2.359 1.666
121 HD3 LYS 20 2HD LYS 20 -1.934 0.648 1.912
122 HE2 LYS 20 1HE LYS 20 -1.157 2.772 3.895
123 HE3 LYS 20 2HE LYS 20 -2.720 1.957 3.943
124 HZ1 LYS 20 3HZ LYS 20 -0.040 0.855 4.446
125 HZ2 LYS 20 1HZ LYS 20 -1.271 -0.168 3.898
126 HZ3 LYS 20 2HZ LYS 20 -1.458 0.677 5.351
127 H SER 21 H SER 21 -1.929 -1.747 0.772
128 HA SER 21 HA SER 21 -1.411 -3.143 -1.750
129 HB2 SER 21 1HB SER 21 -2.825 -4.822 -1.026
130 HB3 SER 21 2HB SER 21 -2.217 -4.232 0.521
131 HG SER 21 HG SER 21 -4.223 -2.731 0.155
132 H PHE 22 H PHE 22 -3.201 -3.397 -3.284
133 HA PHE 22 HA PHE 22 -5.331 -1.443 -3.192
134 HB2 PHE 22 1HB PHE 22 -3.267 -1.324 -5.401
135 HB3 PHE 22 2HB PHE 22 -4.728 -0.346 -5.292
136 HD1 PHE 22 HD1 PHE 22 -1.597 -1.116 -3.435
137 HD2 PHE 22 HD2 PHE 22 -4.641 1.734 -4.291
138 HE1 PHE 22 HE1 PHE 22 -0.355 0.587 -2.166
139 HE2 PHE 22 HE2 PHE 22 -3.403 3.441 -3.024
140 HZ PHE 22 HZ PHE 22 -1.257 2.870 -1.960
141 H CYS 23 H CYS 23 -7.051 -2.577 -3.774
142 HA CYS 23 HA CYS 23 -7.144 -5.058 -4.907
143 HB2 CYS 23 1HB CYS 23 -9.476 -4.581 -5.513
144 HB3 CYS 23 2HB CYS 23 -9.096 -3.966 -3.909
145 HG CYS 23 HG CYS 23 -8.459 -1.426 -5.635
146 H GLY 24 H GLY 24 -6.546 -2.045 -6.496
147 HA2 GLY 24 1HA GLY 24 -6.275 -3.499 -9.039
148 HA3 GLY 24 2HA GLY 24 -7.199 -2.005 -8.997
149 H ARG 25 H ARG 25 -4.327 -3.206 -9.873
150 HA ARG 25 HA ARG 25 -2.322 -1.652 -8.838
151 HB2 ARG 25 1HB ARG 25 -2.297 -3.477 -10.708
152 HB3 ARG 25 2HB ARG 25 -2.446 -2.105 -11.798
153 HG2 ARG 25 1HG ARG 25 -0.183 -2.312 -11.738
154 HG3 ARG 25 2HG ARG 25 -0.413 -1.201 -10.385
155 HD2 ARG 25 1HD ARG 25 -0.367 -3.096 -8.832
156 HD3 ARG 25 2HD ARG 25 -0.128 -4.198 -10.187
157 HE ARG 25 HE ARG 25 1.844 -2.473 -8.973
158 HH11 ARG 25 1HH1 ARG 25 0.963 -4.354 -11.767
159 HH12 ARG 25 2HH1 ARG 25 2.595 -4.536 -12.321
160 HH21 ARG 25 1HH2 ARG 25 3.996 -2.707 -9.691
161 HH22 ARG 25 2HH2 ARG 25 4.319 -3.600 -11.138
162 H SER 26 H SER 26 -4.569 -0.793 -11.444
163 HA SER 26 HA SER 26 -3.666 1.527 -12.417
164 HB2 SER 26 1HB SER 26 -5.867 0.616 -12.998
165 HB3 SER 26 2HB SER 26 -6.494 1.096 -11.422
166 HG SER 26 HG SER 26 -5.945 2.633 -13.664
167 H ARG 27 H ARG 27 -4.837 1.049 -9.153
168 HA ARG 27 HA ARG 27 -4.645 3.879 -8.524
169 HB2 ARG 27 1HB ARG 27 -6.453 2.427 -7.584
170 HB3 ARG 27 2HB ARG 27 -5.222 1.563 -6.672
171 HG2 ARG 27 1HG ARG 27 -6.369 3.216 -5.298
172 HG3 ARG 27 2HG ARG 27 -4.655 3.598 -5.472
173 HD2 ARG 27 1HD ARG 27 -5.056 5.446 -6.752
174 HD3 ARG 27 2HD ARG 27 -6.548 4.790 -7.424
175 HE ARG 27 HE ARG 27 -6.328 6.496 -5.189
176 HH11 ARG 27 1HH1 ARG 27 -8.067 3.694 -6.307
177 HH12 ARG 27 2HH1 ARG 27 -9.469 4.019 -5.342
178 HH21 ARG 27 1HH2 ARG 27 -8.168 6.933 -3.914
179 HH22 ARG 27 2HH2 ARG 27 -9.526 5.861 -3.982
180 H LEU 28 H LEU 28 -3.164 0.864 -7.326
181 HA LEU 28 HA LEU 28 -1.303 1.920 -5.604
182 HB2 LEU 28 1HB LEU 28 -1.467 -0.395 -5.613
183 HB3 LEU 28 2HB LEU 28 -1.291 -0.498 -7.363
184 HG LEU 28 HG LEU 28 1.078 -0.046 -7.190
185 HD11 LEU 28 1HD1 LEU 28 1.098 1.478 -5.325
186 HD12 LEU 28 2HD1 LEU 28 2.158 0.114 -4.974
187 HD13 LEU 28 3HD1 LEU 28 0.561 0.203 -4.231
188 HD21 LEU 28 3HD2 LEU 28 1.182 -2.261 -7.000
189 HD22 LEU 28 1HD2 LEU 28 -0.231 -2.306 -5.946
190 HD23 LEU 28 2HD2 LEU 28 1.370 -2.023 -5.262
191 H ASN 29 H ASN 29 -0.704 1.122 -9.032
192 HA ASN 29 HA ASN 29 1.818 1.928 -9.423
193 HB2 ASN 29 1HB ASN 29 -0.628 2.174 -11.095
194 HB3 ASN 29 2HB ASN 29 0.795 3.063 -11.628
195 HD21 ASN 29 1HD2 ASN 29 -0.809 0.331 -12.119
196 HD22 ASN 29 2HD2 ASN 29 0.482 -0.733 -12.548
197 H ARG 30 H ARG 30 -0.935 4.193 -9.460
198 HA ARG 30 HA ARG 30 0.625 6.525 -9.712
199 HB2 ARG 30 1HB ARG 30 -2.054 6.433 -8.342
200 HB3 ARG 30 2HB ARG 30 -1.360 7.736 -9.297
201 HG2 ARG 30 1HG ARG 30 -2.457 5.115 -10.272
202 HG3 ARG 30 2HG ARG 30 -3.050 6.741 -10.614
203 HD2 ARG 30 1HD ARG 30 -0.276 5.919 -11.391
204 HD3 ARG 30 2HD ARG 30 -1.657 5.512 -12.409
205 HE ARG 30 HE ARG 30 -2.003 8.136 -12.077
206 HH11 ARG 30 1HH1 ARG 30 0.833 6.288 -12.889
207 HH12 ARG 30 2HH1 ARG 30 1.552 7.557 -13.824
208 HH21 ARG 30 1HH2 ARG 30 -1.067 9.815 -13.305
209 HH22 ARG 30 2HH2 ARG 30 0.471 9.563 -14.059
210 H HIS 31 H HIS 31 -0.602 4.785 -6.895
211 HA HIS 31 HA HIS 31 0.038 6.639 -4.915
212 HB2 HIS 31 1HB HIS 31 -1.300 4.784 -4.293
213 HB3 HIS 31 2HB HIS 31 -0.107 3.628 -4.880
214 HD1 HIS 31 HD1 HIS 31 -0.547 6.161 -2.093
215 HD2 HIS 31 HD2 HIS 31 1.636 2.740 -2.984
216 HE1 HIS 31 HE1 HIS 31 0.675 5.572 0.025
217 H SER 32 H SER 32 2.027 4.163 -6.458
218 HA SER 32 HA SER 32 4.276 4.390 -4.790
219 HB2 SER 32 1HB SER 32 3.897 2.541 -6.416
220 HB3 SER 32 2HB SER 32 4.242 3.666 -7.730
221 HG SER 32 HG SER 32 6.294 3.462 -7.336
222 H MET 33 H MET 33 2.963 6.582 -6.998
223 HA MET 33 HA MET 33 5.476 7.884 -7.640
224 HB2 MET 33 1HB MET 33 2.726 8.965 -8.216
225 HB3 MET 33 2HB MET 33 4.229 9.298 -9.066
226 HG2 MET 33 1HG MET 33 3.162 6.517 -9.019
227 HG3 MET 33 2HG MET 33 2.439 7.710 -10.096
228 HE1 MET 33 3HE MET 33 6.195 5.860 -9.475
229 HE2 MET 33 1HE MET 33 4.610 5.092 -9.582
230 HE3 MET 33 2HE MET 33 5.709 5.041 -10.960
231 H VAL 34 H VAL 34 2.936 8.127 -5.316
232 HA VAL 34 HA VAL 34 3.378 10.848 -4.571
233 HB VAL 34 HB VAL 34 1.885 10.488 -2.782
234 HG11 VAL 34 1HG1 VAL 34 1.257 9.019 -5.285
235 HG12 VAL 34 2HG1 VAL 34 0.145 8.850 -3.926
236 HG13 VAL 34 3HG1 VAL 34 0.493 10.447 -4.588
237 HG21 VAL 34 3HG2 VAL 34 2.264 8.724 -1.469
238 HG22 VAL 34 1HG2 VAL 34 1.299 7.790 -2.612
239 HG23 VAL 34 2HG2 VAL 34 3.056 7.832 -2.768
240 H HIS 35 H HIS 35 5.028 7.929 -3.960
241 HA HIS 35 HA HIS 35 6.149 8.665 -1.422
242 HB2 HIS 35 1HB HIS 35 6.711 6.476 -3.408
243 HB3 HIS 35 2HB HIS 35 7.758 6.732 -2.015
244 HD1 HIS 35 HD1 HIS 35 6.536 6.512 0.376
245 HD2 HIS 35 HD2 HIS 35 4.466 5.012 -2.899
246 HE1 HIS 35 HE1 HIS 35 4.767 5.002 1.332
247 H THR 36 H THR 36 6.847 9.358 -4.704
248 HA THR 36 HA THR 36 9.544 10.305 -4.006
249 HB THR 36 HB THR 36 9.362 8.715 -5.926
250 HG1 THR 36 HG1 THR 36 10.874 10.719 -5.690
251 HG21 THR 36 3HG2 THR 36 8.584 10.100 -8.076
252 HG22 THR 36 1HG2 THR 36 7.518 10.834 -6.879
253 HG23 THR 36 2HG2 THR 36 7.476 9.091 -7.146
254 H ALA 37 H ALA 37 6.965 11.669 -3.427
255 HA ALA 37 HA ALA 37 7.219 14.055 -5.120
256 HB1 ALA 37 3HB ALA 37 5.040 14.715 -4.079
257 HB2 ALA 37 1HB ALA 37 4.981 13.241 -5.047
258 HB3 ALA 37 2HB ALA 37 5.013 13.140 -3.286
259 H GLU 38 H GLU 38 9.135 14.823 -4.101
260 HA GLU 38 HA GLU 38 8.986 15.521 -1.279
261 HB2 GLU 38 1HB GLU 38 11.319 16.239 -1.550
262 HB3 GLU 38 2HB GLU 38 11.078 14.594 -2.121
263 HG2 GLU 38 1HG GLU 38 10.778 15.722 -4.440
264 HG3 GLU 38 2HG GLU 38 11.612 17.078 -3.682
265 H LYS 39 H LYS 39 7.436 17.140 -1.216
266 HA LYS 39 HA LYS 39 7.967 19.573 -2.768
267 HB2 LYS 39 1HB LYS 39 5.535 18.562 -1.308
268 HB3 LYS 39 2HB LYS 39 5.667 20.233 -1.841
269 HG2 LYS 39 1HG LYS 39 5.929 17.871 -3.685
270 HG3 LYS 39 2HG LYS 39 4.413 18.723 -3.384
271 HD2 LYS 39 1HD LYS 39 5.358 20.779 -4.240
272 HD3 LYS 39 2HD LYS 39 6.932 20.007 -4.439
273 HE2 LYS 39 1HE LYS 39 6.236 18.758 -6.252
274 HE3 LYS 39 2HE LYS 39 4.537 18.845 -5.792
275 HZ1 LYS 39 3HZ LYS 39 5.996 20.537 -7.527
276 HZ2 LYS 39 1HZ LYS 39 5.344 21.445 -6.258
277 HZ3 LYS 39 2HZ LYS 39 4.332 20.500 -7.228
278 HA PRO 40 HA PRO 40 9.568 21.676 0.751
279 HB2 PRO 40 1HB PRO 40 9.050 24.233 0.001
280 HB3 PRO 40 2HB PRO 40 10.332 23.259 -0.729
281 HG2 PRO 40 1HG PRO 40 7.574 23.829 -1.745
282 HG3 PRO 40 2HG PRO 40 9.112 23.812 -2.629
283 HD2 PRO 40 1HD PRO 40 7.365 21.744 -2.705
284 HD3 PRO 40 2HD PRO 40 9.122 21.515 -2.819
285 H SER 41 H SER 41 8.144 21.036 2.392
286 HA SER 41 HA SER 41 5.758 22.715 2.773
287 HB2 SER 41 1HB SER 41 4.864 20.967 4.163
288 HB3 SER 41 2HB SER 41 5.455 20.218 2.680
289 HG SER 41 HG SER 41 6.595 20.181 5.260
290 H GLY 42 H GLY 42 5.669 24.122 4.411
291 HA2 GLY 42 1HA GLY 42 6.564 25.489 6.058
292 HA3 GLY 42 2HA GLY 42 6.510 23.983 6.960
293 HA PRO 43 HA PRO 43 10.886 25.417 7.028
294 HB2 PRO 43 1HB PRO 43 11.309 24.699 9.611
295 HB3 PRO 43 2HB PRO 43 10.606 26.253 9.149
296 HG2 PRO 43 1HG PRO 43 9.239 23.763 10.092
297 HG3 PRO 43 2HG PRO 43 8.928 25.449 10.544
298 HD2 PRO 43 1HD PRO 43 7.401 24.116 8.749
299 HD3 PRO 43 2HD PRO 43 7.697 25.863 8.640
300 H SER 44 H SER 44 12.800 24.183 7.117
301 HA SER 44 HA SER 44 12.451 21.416 6.458
302 HB2 SER 44 1HB SER 44 14.174 22.947 5.423
303 HB3 SER 44 2HB SER 44 15.060 22.866 6.945
304 HG SER 44 HG SER 44 14.659 20.898 5.003
305 H SER 45 H SER 45 11.890 20.104 8.096
306 HA SER 45 HA SER 45 13.393 20.285 10.615
307 HB2 SER 45 1HB SER 45 10.786 20.341 10.482
308 HB3 SER 45 2HB SER 45 10.934 18.598 10.260
309 HG SER 45 HG SER 45 12.257 18.670 12.233
310 H GLY 46 H GLY 46 12.274 17.981 8.162
311 HA2 GLY 46 1HA GLY 46 13.810 16.289 7.362
312 HA3 GLY 46 2HA GLY 46 14.473 16.198 8.987
Start of MODEL 4
1 H1 GLY 1 H GLY 1 -19.621 0.087 17.972
2 HA2 GLY 1 1HA GLY 1 -18.733 0.213 15.206
3 HA3 GLY 1 2HA GLY 1 -19.896 1.280 15.979
4 H SER 2 H SER 2 -16.485 0.607 15.509
5 HA SER 2 HA SER 2 -15.705 3.080 16.822
6 HB2 SER 2 1HB SER 2 -14.236 1.228 17.207
7 HB3 SER 2 2HB SER 2 -14.123 0.880 15.482
8 HG SER 2 HG SER 2 -12.691 2.624 16.987
9 H SER 3 H SER 3 -14.366 4.671 15.727
10 HA SER 3 HA SER 3 -15.324 5.134 13.004
11 HB2 SER 3 1HB SER 3 -14.554 7.448 13.342
12 HB3 SER 3 2HB SER 3 -15.640 6.944 14.636
13 HG SER 3 HG SER 3 -14.052 7.654 15.837
14 H GLY 4 H GLY 4 -13.412 3.129 13.211
15 HA2 GLY 4 1HA GLY 4 -10.935 4.409 12.257
16 HA3 GLY 4 2HA GLY 4 -11.047 2.775 12.895
17 H SER 5 H SER 5 -10.848 4.617 10.121
18 HA SER 5 HA SER 5 -12.264 2.776 8.388
19 HB2 SER 5 1HB SER 5 -11.384 4.266 6.565
20 HB3 SER 5 2HB SER 5 -12.348 5.106 7.780
21 HG SER 5 HG SER 5 -10.113 5.926 7.042
22 H SER 6 H SER 6 -11.281 0.824 8.316
23 HA SER 6 HA SER 6 -8.848 0.590 6.837
24 HB2 SER 6 1HB SER 6 -7.467 -0.464 8.509
25 HB3 SER 6 2HB SER 6 -7.999 1.092 9.146
26 HG SER 6 HG SER 6 -9.532 0.019 10.389
27 H GLY 7 H GLY 7 -9.120 -1.128 5.583
28 HA2 GLY 7 1HA GLY 7 -11.144 -3.099 6.266
29 HA3 GLY 7 2HA GLY 7 -10.292 -2.963 4.734
30 H THR 8 H THR 8 -10.776 -5.383 6.144
31 HA THR 8 HA THR 8 -8.032 -6.133 6.921
32 HB THR 8 HB THR 8 -8.985 -7.948 8.257
33 HG1 THR 8 HG1 THR 8 -11.082 -8.400 8.219
34 HG21 THR 8 3HG2 THR 8 -8.883 -6.425 9.884
35 HG22 THR 8 1HG2 THR 8 -10.593 -6.099 9.602
36 HG23 THR 8 2HG2 THR 8 -9.364 -5.135 8.782
37 H GLY 9 H GLY 9 -7.018 -7.599 5.703
38 HA2 GLY 9 1HA GLY 9 -7.646 -9.913 4.638
39 HA3 GLY 9 2HA GLY 9 -8.530 -8.867 3.537
40 H GLU 10 H GLU 10 -7.238 -9.669 1.811
41 HA GLU 10 HA GLU 10 -4.673 -8.271 1.610
42 HB2 GLU 10 1HB GLU 10 -5.112 -11.212 1.105
43 HB3 GLU 10 2HB GLU 10 -3.736 -10.331 0.455
44 HG2 GLU 10 1HG GLU 10 -3.077 -9.728 2.754
45 HG3 GLU 10 2HG GLU 10 -4.410 -10.708 3.363
46 H LYS 11 H LYS 11 -4.149 -7.569 -0.434
47 HA LYS 11 HA LYS 11 -6.263 -7.893 -2.455
48 HB2 LYS 11 1HB LYS 11 -4.457 -5.641 -1.715
49 HB3 LYS 11 2HB LYS 11 -4.931 -5.792 -3.402
50 HG2 LYS 11 1HG LYS 11 -6.439 -4.293 -2.315
51 HG3 LYS 11 2HG LYS 11 -7.305 -5.786 -2.682
52 HD2 LYS 11 1HD LYS 11 -6.494 -6.410 -0.232
53 HD3 LYS 11 2HD LYS 11 -6.482 -4.653 -0.060
54 HE2 LYS 11 1HE LYS 11 -8.863 -4.909 -1.203
55 HE3 LYS 11 2HE LYS 11 -8.759 -6.514 -0.481
56 HZ1 LYS 11 3HZ LYS 11 -9.346 -4.050 0.765
57 HZ2 LYS 11 1HZ LYS 11 -7.957 -4.714 1.466
58 HZ3 LYS 11 2HZ LYS 11 -9.392 -5.608 1.421
59 HA PRO 12 HA PRO 12 -3.566 -9.875 -5.291
60 HB2 PRO 12 1HB PRO 12 -4.284 -8.757 -7.659
61 HB3 PRO 12 2HB PRO 12 -5.310 -9.901 -6.786
62 HG2 PRO 12 1HG PRO 12 -5.454 -6.913 -6.872
63 HG3 PRO 12 2HG PRO 12 -6.769 -8.099 -6.959
64 HD2 PRO 12 1HD PRO 12 -6.162 -6.762 -4.684
65 HD3 PRO 12 2HD PRO 12 -6.801 -8.418 -4.677
66 H PHE 13 H PHE 13 -3.100 -6.754 -4.408
67 HA PHE 13 HA PHE 13 -0.575 -6.610 -5.880
68 HB2 PHE 13 1HB PHE 13 -2.534 -4.314 -5.665
69 HB3 PHE 13 2HB PHE 13 -0.909 -4.207 -6.334
70 HD1 PHE 13 HD1 PHE 13 -0.376 -5.260 -8.475
71 HD2 PHE 13 HD2 PHE 13 -4.332 -5.281 -6.906
72 HE1 PHE 13 HE1 PHE 13 -1.249 -5.873 -10.693
73 HE2 PHE 13 HE2 PHE 13 -5.211 -5.895 -9.120
74 HZ PHE 13 HZ PHE 13 -3.669 -6.192 -11.017
75 H LYS 14 H LYS 14 0.896 -4.931 -4.939
76 HA LYS 14 HA LYS 14 0.369 -4.048 -2.251
77 HB2 LYS 14 1HB LYS 14 0.981 -6.392 -1.850
78 HB3 LYS 14 2HB LYS 14 2.483 -6.157 -2.734
79 HG2 LYS 14 1HG LYS 14 2.932 -4.299 -0.985
80 HG3 LYS 14 2HG LYS 14 1.696 -5.134 -0.041
81 HD2 LYS 14 1HD LYS 14 2.991 -7.225 -0.253
82 HD3 LYS 14 2HD LYS 14 4.245 -6.337 -1.122
83 HE2 LYS 14 1HE LYS 14 5.075 -6.342 1.030
84 HE3 LYS 14 2HE LYS 14 4.227 -4.797 0.976
85 HZ1 LYS 14 3HZ LYS 14 2.485 -6.885 1.794
86 HZ2 LYS 14 1HZ LYS 14 2.885 -5.450 2.596
87 HZ3 LYS 14 2HZ LYS 14 3.848 -6.826 2.795
88 H CYS 15 H CYS 15 1.888 -2.538 -1.498
89 HA CYS 15 HA CYS 15 3.341 -1.196 -3.590
90 HB2 CYS 15 1HB CYS 15 2.023 -0.176 -1.569
91 HB3 CYS 15 2HB CYS 15 3.530 -0.433 -0.697
92 H ASP 16 H ASP 16 5.594 -0.278 -2.876
93 HA ASP 16 HA ASP 16 7.204 -2.539 -1.885
94 HB2 ASP 16 1HB ASP 16 7.549 -0.768 -4.253
95 HB3 ASP 16 2HB ASP 16 9.004 -1.263 -3.391
96 H ILE 17 H ILE 17 6.464 0.805 -1.652
97 HA ILE 17 HA ILE 17 8.849 1.428 -0.105
98 HB ILE 17 HB ILE 17 6.493 3.246 -0.560
99 HG12 ILE 17 1HG1 ILE 17 8.239 4.120 -2.390
100 HG13 ILE 17 2HG1 ILE 17 8.668 2.413 -2.412
101 HG21 ILE 17 1HG2 ILE 17 8.110 5.014 -0.194
102 HG22 ILE 17 2HG2 ILE 17 8.118 3.893 1.167
103 HG23 ILE 17 3HG2 ILE 17 9.405 3.827 -0.037
104 HD11 ILE 17 3HD1 ILE 17 5.799 2.867 -2.528
105 HD12 ILE 17 1HD1 ILE 17 6.679 3.592 -3.874
106 HD13 ILE 17 2HD1 ILE 17 6.835 1.866 -3.544
107 H CYS 18 H CYS 18 5.332 1.280 0.369
108 HA CYS 18 HA CYS 18 5.821 1.121 3.272
109 HB2 CYS 18 1HB CYS 18 3.615 2.152 3.610
110 HB3 CYS 18 2HB CYS 18 4.681 3.206 2.686
111 H GLY 19 H GLY 19 4.895 -0.591 0.604
112 HA2 GLY 19 1HA GLY 19 4.100 -2.755 0.446
113 HA3 GLY 19 2HA GLY 19 3.895 -2.764 2.191
114 H LYS 20 H LYS 20 2.408 -0.074 0.870
115 HA LYS 20 HA LYS 20 -0.158 -0.748 1.652
116 HB2 LYS 20 1HB LYS 20 1.023 1.315 -0.122
117 HB3 LYS 20 2HB LYS 20 -0.705 1.034 -0.290
118 HG2 LYS 20 1HG LYS 20 0.613 1.599 2.351
119 HG3 LYS 20 2HG LYS 20 -0.036 2.860 1.300
120 HD2 LYS 20 1HD LYS 20 -2.202 2.273 1.706
121 HD3 LYS 20 2HD LYS 20 -1.809 0.569 1.946
122 HE2 LYS 20 1HE LYS 20 -0.995 2.699 3.905
123 HE3 LYS 20 2HE LYS 20 -2.559 1.890 3.991
124 HZ1 LYS 20 3HZ LYS 20 0.094 0.563 4.125
125 HZ2 LYS 20 1HZ LYS 20 -1.399 -0.231 4.171
126 HZ3 LYS 20 2HZ LYS 20 -0.958 0.814 5.425
127 H SER 21 H SER 21 -1.861 -1.774 0.746
128 HA SER 21 HA SER 21 -1.361 -3.178 -1.776
129 HB2 SER 21 1HB SER 21 -2.760 -4.853 -1.037
130 HB3 SER 21 2HB SER 21 -2.186 -4.241 0.514
131 HG SER 21 HG SER 21 -4.250 -4.035 0.889
132 H PHE 22 H PHE 22 -3.155 -3.413 -3.307
133 HA PHE 22 HA PHE 22 -5.271 -1.443 -3.206
134 HB2 PHE 22 1HB PHE 22 -3.206 -1.339 -5.416
135 HB3 PHE 22 2HB PHE 22 -4.664 -0.356 -5.313
136 HD1 PHE 22 HD1 PHE 22 -1.539 -1.130 -3.449
137 HD2 PHE 22 HD2 PHE 22 -4.573 1.726 -4.316
138 HE1 PHE 22 HE1 PHE 22 -0.294 0.572 -2.182
139 HE2 PHE 22 HE2 PHE 22 -3.333 3.433 -3.052
140 HZ PHE 22 HZ PHE 22 -1.190 2.858 -1.983
141 H CYS 23 H CYS 23 -6.993 -2.589 -3.759
142 HA CYS 23 HA CYS 23 -7.123 -5.059 -4.888
143 HB2 CYS 23 1HB CYS 23 -9.443 -4.557 -5.508
144 HB3 CYS 23 2HB CYS 23 -9.063 -3.920 -3.912
145 HG CYS 23 HG CYS 23 -8.803 -1.860 -6.598
146 H GLY 24 H GLY 24 -6.610 -2.028 -6.526
147 HA2 GLY 24 1HA GLY 24 -6.288 -3.524 -9.045
148 HA3 GLY 24 2HA GLY 24 -7.204 -2.025 -9.020
149 H ARG 25 H ARG 25 -4.337 -3.251 -9.878
150 HA ARG 25 HA ARG 25 -2.326 -1.697 -8.852
151 HB2 ARG 25 1HB ARG 25 -2.265 -3.545 -10.670
152 HB3 ARG 25 2HB ARG 25 -2.479 -2.220 -11.806
153 HG2 ARG 25 1HG ARG 25 -0.216 -2.327 -11.797
154 HG3 ARG 25 2HG ARG 25 -0.443 -1.214 -10.446
155 HD2 ARG 25 1HD ARG 25 -0.220 -3.021 -8.864
156 HD3 ARG 25 2HD ARG 25 -0.145 -4.201 -10.172
157 HE ARG 25 HE ARG 25 1.981 -2.461 -9.265
158 HH11 ARG 25 1HH1 ARG 25 0.794 -4.545 -11.788
159 HH12 ARG 25 2HH1 ARG 25 2.362 -4.835 -12.466
160 HH21 ARG 25 1HH2 ARG 25 4.051 -2.835 -10.148
161 HH22 ARG 25 2HH2 ARG 25 4.214 -3.862 -11.531
162 H SER 26 H SER 26 -4.543 -0.859 -11.495
163 HA SER 26 HA SER 26 -3.632 1.444 -12.485
164 HB2 SER 26 1HB SER 26 -5.915 2.219 -12.767
165 HB3 SER 26 2HB SER 26 -5.872 0.469 -12.981
166 HG SER 26 HG SER 26 -6.619 1.829 -10.602
167 H ARG 27 H ARG 27 -4.770 1.004 -9.210
168 HA ARG 27 HA ARG 27 -4.568 3.846 -8.620
169 HB2 ARG 27 1HB ARG 27 -6.385 2.379 -7.671
170 HB3 ARG 27 2HB ARG 27 -5.149 1.582 -6.707
171 HG2 ARG 27 1HG ARG 27 -6.185 3.182 -5.312
172 HG3 ARG 27 2HG ARG 27 -4.600 3.831 -5.736
173 HD2 ARG 27 1HD ARG 27 -6.165 5.612 -5.926
174 HD3 ARG 27 2HD ARG 27 -5.721 5.129 -7.562
175 HE ARG 27 HE ARG 27 -7.967 3.683 -7.021
176 HH11 ARG 27 1HH1 ARG 27 -7.157 7.069 -6.954
177 HH12 ARG 27 2HH1 ARG 27 -8.762 7.594 -7.342
178 HH21 ARG 27 1HH2 ARG 27 -10.084 4.362 -7.532
179 HH22 ARG 27 2HH2 ARG 27 -10.426 6.054 -7.669
180 H LEU 28 H LEU 28 -3.148 0.839 -7.322
181 HA LEU 28 HA LEU 28 -1.278 1.878 -5.624
182 HB2 LEU 28 1HB LEU 28 -1.436 -0.432 -5.627
183 HB3 LEU 28 2HB LEU 28 -1.281 -0.539 -7.379
184 HG LEU 28 HG LEU 28 1.094 -0.094 -7.232
185 HD11 LEU 28 1HD1 LEU 28 1.218 1.415 -5.397
186 HD12 LEU 28 2HD1 LEU 28 2.168 -0.008 -4.972
187 HD13 LEU 28 3HD1 LEU 28 0.559 0.215 -4.285
188 HD21 LEU 28 3HD2 LEU 28 1.363 -2.080 -5.291
189 HD22 LEU 28 1HD2 LEU 28 1.225 -2.303 -7.035
190 HD23 LEU 28 2HD2 LEU 28 -0.218 -2.358 -6.023
191 H ASN 29 H ASN 29 -0.731 1.165 -9.076
192 HA ASN 29 HA ASN 29 1.828 1.952 -9.428
193 HB2 ASN 29 1HB ASN 29 -0.601 2.161 -11.132
194 HB3 ASN 29 2HB ASN 29 0.826 3.050 -11.657
195 HD21 ASN 29 1HD2 ASN 29 -0.759 0.316 -12.156
196 HD22 ASN 29 2HD2 ASN 29 0.542 -0.752 -12.548
197 H ARG 30 H ARG 30 -0.957 4.175 -9.475
198 HA ARG 30 HA ARG 30 0.575 6.529 -9.747
199 HB2 ARG 30 1HB ARG 30 -2.126 6.370 -8.419
200 HB3 ARG 30 2HB ARG 30 -1.435 7.719 -9.310
201 HG2 ARG 30 1HG ARG 30 -2.537 5.143 -10.369
202 HG3 ARG 30 2HG ARG 30 -3.018 6.797 -10.753
203 HD2 ARG 30 1HD ARG 30 -0.864 7.160 -11.861
204 HD3 ARG 30 2HD ARG 30 -0.391 5.505 -11.479
205 HE ARG 30 HE ARG 30 -2.843 5.682 -12.963
206 HH11 ARG 30 1HH1 ARG 30 0.630 5.580 -13.186
207 HH12 ARG 30 2HH1 ARG 30 0.638 4.962 -14.804
208 HH21 ARG 30 1HH2 ARG 30 -2.845 4.869 -15.094
209 HH22 ARG 30 2HH2 ARG 30 -1.339 4.559 -15.889
210 H HIS 31 H HIS 31 -0.612 4.765 -6.934
211 HA HIS 31 HA HIS 31 -0.030 6.648 -4.957
212 HB2 HIS 31 1HB HIS 31 -1.318 4.814 -4.264
213 HB3 HIS 31 2HB HIS 31 -0.191 3.647 -4.948
214 HD1 HIS 31 HD1 HIS 31 -0.422 6.096 -2.065
215 HD2 HIS 31 HD2 HIS 31 1.638 2.665 -3.181
216 HE1 HIS 31 HE1 HIS 31 0.898 5.414 -0.035
217 H SER 32 H SER 32 2.007 4.137 -6.402
218 HA SER 32 HA SER 32 4.237 4.392 -4.757
219 HB2 SER 32 1HB SER 32 3.907 2.604 -6.464
220 HB3 SER 32 2HB SER 32 4.258 3.788 -7.724
221 HG SER 32 HG SER 32 6.256 4.065 -6.193
222 H MET 33 H MET 33 2.928 6.621 -6.952
223 HA MET 33 HA MET 33 5.417 7.998 -7.495
224 HB2 MET 33 1HB MET 33 2.644 9.035 -8.052
225 HB3 MET 33 2HB MET 33 4.147 9.465 -8.858
226 HG2 MET 33 1HG MET 33 3.133 6.660 -8.972
227 HG3 MET 33 2HG MET 33 2.457 7.896 -10.030
228 HE1 MET 33 3HE MET 33 4.568 5.265 -9.531
229 HE2 MET 33 1HE MET 33 5.643 5.224 -10.929
230 HE3 MET 33 2HE MET 33 6.192 5.945 -9.416
231 H VAL 34 H VAL 34 2.761 8.194 -5.260
232 HA VAL 34 HA VAL 34 3.156 10.858 -4.388
233 HB VAL 34 HB VAL 34 1.745 10.339 -2.534
234 HG11 VAL 34 1HG1 VAL 34 1.016 8.998 -5.109
235 HG12 VAL 34 2HG1 VAL 34 -0.087 8.958 -3.732
236 HG13 VAL 34 3HG1 VAL 34 0.408 10.504 -4.423
237 HG21 VAL 34 3HG2 VAL 34 3.008 7.798 -2.671
238 HG22 VAL 34 1HG2 VAL 34 1.938 8.430 -1.419
239 HG23 VAL 34 2HG2 VAL 34 1.266 7.553 -2.795
240 H HIS 35 H HIS 35 4.867 7.942 -3.806
241 HA HIS 35 HA HIS 35 5.991 8.636 -1.278
242 HB2 HIS 35 1HB HIS 35 6.649 6.587 -3.376
243 HB3 HIS 35 2HB HIS 35 7.716 6.837 -1.998
244 HD1 HIS 35 HD1 HIS 35 6.638 6.360 0.396
245 HD2 HIS 35 HD2 HIS 35 4.439 5.046 -2.876
246 HE1 HIS 35 HE1 HIS 35 4.967 4.724 1.321
247 H THR 36 H THR 36 6.732 9.408 -4.567
248 HA THR 36 HA THR 36 9.303 10.585 -3.752
249 HB THR 36 HB THR 36 9.335 8.952 -5.655
250 HG1 THR 36 HG1 THR 36 10.615 10.385 -6.991
251 HG21 THR 36 3HG2 THR 36 8.546 9.821 -7.860
252 HG22 THR 36 1HG2 THR 36 7.730 11.126 -7.000
253 HG23 THR 36 2HG2 THR 36 7.244 9.452 -6.729
254 H ALA 37 H ALA 37 6.611 11.744 -3.311
255 HA ALA 37 HA ALA 37 6.952 14.221 -4.874
256 HB1 ALA 37 3HB ALA 37 4.395 13.028 -3.811
257 HB2 ALA 37 1HB ALA 37 4.533 14.593 -4.614
258 HB3 ALA 37 2HB ALA 37 4.894 13.111 -5.501
259 H GLU 38 H GLU 38 8.333 13.702 -2.459
260 HA GLU 38 HA GLU 38 7.082 15.712 -0.708
261 HB2 GLU 38 1HB GLU 38 8.270 14.461 1.191
262 HB3 GLU 38 2HB GLU 38 6.812 13.738 0.527
263 HG2 GLU 38 1HG GLU 38 7.943 12.015 -0.462
264 HG3 GLU 38 2HG GLU 38 9.440 12.935 -0.605
265 H LYS 39 H LYS 39 8.305 17.420 -1.410
266 HA LYS 39 HA LYS 39 10.991 17.459 -2.052
267 HB2 LYS 39 1HB LYS 39 9.420 19.661 -0.700
268 HB3 LYS 39 2HB LYS 39 10.927 19.866 -1.585
269 HG2 LYS 39 1HG LYS 39 9.812 19.106 -3.634
270 HG3 LYS 39 2HG LYS 39 8.299 18.951 -2.738
271 HD2 LYS 39 1HD LYS 39 9.819 21.540 -2.825
272 HD3 LYS 39 2HD LYS 39 8.678 21.095 -4.097
273 HE2 LYS 39 1HE LYS 39 7.957 21.136 -1.174
274 HE3 LYS 39 2HE LYS 39 7.756 22.529 -2.235
275 HZ1 LYS 39 3HZ LYS 39 6.627 20.079 -3.260
276 HZ2 LYS 39 1HZ LYS 39 5.963 21.634 -3.194
277 HZ3 LYS 39 2HZ LYS 39 5.899 20.629 -1.835
278 HA PRO 40 HA PRO 40 13.159 16.790 1.720
279 HB2 PRO 40 1HB PRO 40 15.510 17.990 1.087
280 HB3 PRO 40 2HB PRO 40 15.016 16.432 0.415
281 HG2 PRO 40 1HG PRO 40 14.846 19.160 -0.805
282 HG3 PRO 40 2HG PRO 40 15.352 17.632 -1.548
283 HD2 PRO 40 1HD PRO 40 12.881 18.678 -1.907
284 HD3 PRO 40 2HD PRO 40 13.182 16.929 -1.879
285 H SER 41 H SER 41 12.648 17.857 3.524
286 HA SER 41 HA SER 41 12.804 20.782 3.562
287 HB2 SER 41 1HB SER 41 10.757 19.332 4.361
288 HB3 SER 41 2HB SER 41 11.706 19.176 5.839
289 HG SER 41 HG SER 41 10.322 20.980 5.934
290 H GLY 42 H GLY 42 14.795 21.463 4.075
291 HA2 GLY 42 1HA GLY 42 16.451 22.001 5.637
292 HA3 GLY 42 2HA GLY 42 15.870 20.702 6.667
293 HA PRO 43 HA PRO 43 19.878 19.244 4.990
294 HB2 PRO 43 1HB PRO 43 20.569 17.899 7.244
295 HB3 PRO 43 2HB PRO 43 20.861 19.629 7.030
296 HG2 PRO 43 1HG PRO 43 18.650 18.249 8.503
297 HG3 PRO 43 2HG PRO 43 19.598 19.669 8.982
298 HD2 PRO 43 1HD PRO 43 17.105 19.865 7.944
299 HD3 PRO 43 2HD PRO 43 18.352 21.099 7.673
300 H SER 44 H SER 44 19.997 17.448 3.805
301 HA SER 44 HA SER 44 17.990 15.455 3.876
302 HB2 SER 44 1HB SER 44 19.059 15.879 1.784
303 HB3 SER 44 2HB SER 44 20.660 15.601 2.469
304 HG SER 44 HG SER 44 18.907 13.492 2.731
305 H SER 45 H SER 45 18.014 13.359 4.616
306 HA SER 45 HA SER 45 20.363 12.282 5.919
307 HB2 SER 45 1HB SER 45 17.866 12.976 7.479
308 HB3 SER 45 2HB SER 45 19.121 11.888 8.072
309 HG SER 45 HG SER 45 19.841 13.747 8.829
310 H GLY 46 H GLY 46 20.441 10.151 5.602
311 HA2 GLY 46 1HA GLY 46 19.808 8.096 4.762
312 HA3 GLY 46 2HA GLY 46 18.529 8.250 5.958
Start of MODEL 5
1 H1 GLY 1 H GLY 1 0.198 5.427 13.092
2 HA2 GLY 1 1HA GLY 1 1.016 4.541 10.502
3 HA3 GLY 1 2HA GLY 1 1.740 4.080 12.035
4 H SER 2 H SER 2 1.953 1.921 11.387
5 HA SER 2 HA SER 2 -0.369 0.410 10.587
6 HB2 SER 2 1HB SER 2 2.146 0.042 9.935
7 HB3 SER 2 2HB SER 2 2.205 -0.868 11.444
8 HG SER 2 HG SER 2 0.111 -1.801 10.374
9 H SER 3 H SER 3 1.824 0.368 13.394
10 HA SER 3 HA SER 3 1.565 -0.409 15.519
11 HB2 SER 3 1HB SER 3 -0.133 1.404 15.537
12 HB3 SER 3 2HB SER 3 -1.355 0.234 15.038
13 HG SER 3 HG SER 3 -1.357 -0.625 16.990
14 H GLY 4 H GLY 4 1.645 -2.402 13.586
15 HA2 GLY 4 1HA GLY 4 1.489 -4.753 14.081
16 HA3 GLY 4 2HA GLY 4 -0.053 -4.441 14.866
17 H SER 5 H SER 5 -0.614 -6.332 13.447
18 HA SER 5 HA SER 5 -1.198 -5.491 10.691
19 HB2 SER 5 1HB SER 5 -0.866 -8.195 11.974
20 HB3 SER 5 2HB SER 5 -1.677 -8.016 10.419
21 HG SER 5 HG SER 5 0.208 -7.109 9.585
22 H SER 6 H SER 6 -3.173 -4.710 10.412
23 HA SER 6 HA SER 6 -5.414 -6.035 11.788
24 HB2 SER 6 1HB SER 6 -4.893 -3.083 11.458
25 HB3 SER 6 2HB SER 6 -6.510 -3.713 11.770
26 HG SER 6 HG SER 6 -4.308 -3.553 13.445
27 H GLY 7 H GLY 7 -6.570 -7.048 10.288
28 HA2 GLY 7 1HA GLY 7 -7.975 -5.776 8.262
29 HA3 GLY 7 2HA GLY 7 -6.500 -6.386 7.527
30 H THR 8 H THR 8 -9.128 -7.208 6.845
31 HA THR 8 HA THR 8 -8.994 -10.037 7.655
32 HB THR 8 HB THR 8 -10.933 -8.931 8.722
33 HG1 THR 8 HG1 THR 8 -11.494 -10.974 8.418
34 HG21 THR 8 3HG2 THR 8 -12.774 -8.100 7.406
35 HG22 THR 8 1HG2 THR 8 -11.951 -8.533 5.908
36 HG23 THR 8 2HG2 THR 8 -11.307 -7.246 6.928
37 H GLY 9 H GLY 9 -7.724 -8.930 5.385
38 HA2 GLY 9 1HA GLY 9 -8.354 -10.706 3.389
39 HA3 GLY 9 2HA GLY 9 -9.347 -9.295 3.053
40 H GLU 10 H GLU 10 -6.935 -10.596 1.720
41 HA GLU 10 HA GLU 10 -5.140 -8.269 1.705
42 HB2 GLU 10 1HB GLU 10 -3.500 -9.763 0.635
43 HB3 GLU 10 2HB GLU 10 -4.034 -10.381 2.192
44 HG2 GLU 10 1HG GLU 10 -4.141 -12.292 0.981
45 HG3 GLU 10 2HG GLU 10 -5.767 -11.680 0.685
46 H LYS 11 H LYS 11 -4.213 -7.662 -0.416
47 HA LYS 11 HA LYS 11 -6.273 -7.836 -2.511
48 HB2 LYS 11 1HB LYS 11 -4.392 -5.681 -1.662
49 HB3 LYS 11 2HB LYS 11 -4.853 -5.762 -3.358
50 HG2 LYS 11 1HG LYS 11 -6.317 -4.239 -2.260
51 HG3 LYS 11 2HG LYS 11 -7.236 -5.695 -2.647
52 HD2 LYS 11 1HD LYS 11 -6.454 -6.380 -0.205
53 HD3 LYS 11 2HD LYS 11 -6.375 -4.627 -0.010
54 HE2 LYS 11 1HE LYS 11 -8.801 -5.915 -1.199
55 HE3 LYS 11 2HE LYS 11 -8.579 -5.880 0.549
56 HZ1 LYS 11 3HZ LYS 11 -9.040 -3.709 0.638
57 HZ2 LYS 11 1HZ LYS 11 -9.726 -3.921 -0.894
58 HZ3 LYS 11 2HZ LYS 11 -8.143 -3.342 -0.749
59 HA PRO 12 HA PRO 12 -3.548 -9.888 -5.272
60 HB2 PRO 12 1HB PRO 12 -4.234 -8.779 -7.653
61 HB3 PRO 12 2HB PRO 12 -5.276 -9.914 -6.787
62 HG2 PRO 12 1HG PRO 12 -5.404 -6.925 -6.890
63 HG3 PRO 12 2HG PRO 12 -6.724 -8.106 -6.985
64 HD2 PRO 12 1HD PRO 12 -6.135 -6.760 -4.711
65 HD3 PRO 12 2HD PRO 12 -6.783 -8.413 -4.702
66 H PHE 13 H PHE 13 -3.084 -6.757 -4.409
67 HA PHE 13 HA PHE 13 -0.541 -6.635 -5.854
68 HB2 PHE 13 1HB PHE 13 -2.479 -4.319 -5.653
69 HB3 PHE 13 2HB PHE 13 -0.856 -4.239 -6.330
70 HD1 PHE 13 HD1 PHE 13 -0.348 -5.300 -8.470
71 HD2 PHE 13 HD2 PHE 13 -4.295 -5.283 -6.876
72 HE1 PHE 13 HE1 PHE 13 -1.239 -5.916 -10.679
73 HE2 PHE 13 HE2 PHE 13 -5.192 -5.900 -9.083
74 HZ PHE 13 HZ PHE 13 -3.664 -6.218 -10.988
75 H LYS 14 H LYS 14 0.904 -4.906 -4.913
76 HA LYS 14 HA LYS 14 0.366 -4.032 -2.230
77 HB2 LYS 14 1HB LYS 14 0.953 -6.325 -1.725
78 HB3 LYS 14 2HB LYS 14 2.402 -6.212 -2.716
79 HG2 LYS 14 1HG LYS 14 2.983 -4.256 -1.054
80 HG3 LYS 14 2HG LYS 14 1.867 -5.129 -0.001
81 HD2 LYS 14 1HD LYS 14 3.199 -7.060 -0.007
82 HD3 LYS 14 2HD LYS 14 4.117 -6.527 -1.417
83 HE2 LYS 14 1HE LYS 14 4.204 -4.824 1.012
84 HE3 LYS 14 2HE LYS 14 5.075 -6.356 1.059
85 HZ1 LYS 14 3HZ LYS 14 5.707 -3.938 -0.355
86 HZ2 LYS 14 1HZ LYS 14 5.785 -5.313 -1.337
87 HZ3 LYS 14 2HZ LYS 14 6.709 -5.230 0.077
88 H CYS 15 H CYS 15 1.840 -2.489 -1.497
89 HA CYS 15 HA CYS 15 3.324 -1.169 -3.571
90 HB2 CYS 15 1HB CYS 15 2.003 -0.130 -1.575
91 HB3 CYS 15 2HB CYS 15 3.485 -0.419 -0.669
92 H ASP 16 H ASP 16 5.580 -0.273 -2.898
93 HA ASP 16 HA ASP 16 7.182 -2.531 -1.885
94 HB2 ASP 16 1HB ASP 16 7.530 -0.768 -4.258
95 HB3 ASP 16 2HB ASP 16 8.984 -1.264 -3.396
96 H ILE 17 H ILE 17 6.467 0.825 -1.677
97 HA ILE 17 HA ILE 17 8.853 1.447 -0.136
98 HB ILE 17 HB ILE 17 6.490 3.262 -0.568
99 HG12 ILE 17 1HG1 ILE 17 8.201 4.138 -2.425
100 HG13 ILE 17 2HG1 ILE 17 8.649 2.435 -2.445
101 HG21 ILE 17 1HG2 ILE 17 8.158 3.894 1.138
102 HG22 ILE 17 2HG2 ILE 17 9.408 3.859 -0.104
103 HG23 ILE 17 3HG2 ILE 17 8.095 5.032 -0.208
104 HD11 ILE 17 3HD1 ILE 17 6.756 1.823 -3.470
105 HD12 ILE 17 1HD1 ILE 17 5.766 2.959 -2.553
106 HD13 ILE 17 2HD1 ILE 17 6.691 3.520 -3.946
107 H CYS 18 H CYS 18 5.339 1.297 0.365
108 HA CYS 18 HA CYS 18 5.852 1.132 3.264
109 HB2 CYS 18 1HB CYS 18 3.674 2.185 3.637
110 HB3 CYS 18 2HB CYS 18 4.711 3.224 2.665
111 H GLY 19 H GLY 19 4.883 -0.562 0.594
112 HA2 GLY 19 1HA GLY 19 4.089 -2.730 0.444
113 HA3 GLY 19 2HA GLY 19 3.886 -2.735 2.190
114 H LYS 20 H LYS 20 2.412 -0.042 0.850
115 HA LYS 20 HA LYS 20 -0.155 -0.689 1.644
116 HB2 LYS 20 1HB LYS 20 1.042 1.346 -0.144
117 HB3 LYS 20 2HB LYS 20 -0.683 1.065 -0.340
118 HG2 LYS 20 1HG LYS 20 0.567 1.637 2.330
119 HG3 LYS 20 2HG LYS 20 -0.007 2.909 1.248
120 HD2 LYS 20 1HD LYS 20 -2.207 2.364 1.554
121 HD3 LYS 20 2HD LYS 20 -1.855 0.663 1.865
122 HE2 LYS 20 1HE LYS 20 -1.005 1.223 4.071
123 HE3 LYS 20 2HE LYS 20 -1.270 2.938 3.759
124 HZ1 LYS 20 3HZ LYS 20 -3.579 1.197 3.442
125 HZ2 LYS 20 1HZ LYS 20 -3.476 2.751 4.102
126 HZ3 LYS 20 2HZ LYS 20 -3.021 1.409 5.025
127 H SER 21 H SER 21 -1.822 -1.793 0.796
128 HA SER 21 HA SER 21 -1.358 -3.186 -1.737
129 HB2 SER 21 1HB SER 21 -2.706 -4.885 -0.962
130 HB3 SER 21 2HB SER 21 -2.115 -4.254 0.575
131 HG SER 21 HG SER 21 -4.602 -3.724 -0.678
132 H PHE 22 H PHE 22 -3.095 -3.394 -3.285
133 HA PHE 22 HA PHE 22 -5.281 -1.494 -3.127
134 HB2 PHE 22 1HB PHE 22 -3.248 -1.328 -5.362
135 HB3 PHE 22 2HB PHE 22 -4.723 -0.376 -5.230
136 HD1 PHE 22 HD1 PHE 22 -1.504 -1.067 -3.517
137 HD2 PHE 22 HD2 PHE 22 -4.714 1.663 -4.115
138 HE1 PHE 22 HE1 PHE 22 -0.275 0.649 -2.252
139 HE2 PHE 22 HE2 PHE 22 -3.490 3.384 -2.852
140 HZ PHE 22 HZ PHE 22 -1.268 2.878 -1.919
141 H CYS 23 H CYS 23 -7.015 -2.570 -3.768
142 HA CYS 23 HA CYS 23 -7.118 -5.070 -4.865
143 HB2 CYS 23 1HB CYS 23 -9.436 -4.512 -5.588
144 HB3 CYS 23 2HB CYS 23 -9.090 -4.035 -3.930
145 HG CYS 23 HG CYS 23 -8.867 -1.342 -4.445
146 H GLY 24 H GLY 24 -6.634 -2.034 -6.515
147 HA2 GLY 24 1HA GLY 24 -6.279 -3.539 -9.025
148 HA3 GLY 24 2HA GLY 24 -7.190 -2.036 -9.009
149 H ARG 25 H ARG 25 -4.333 -3.261 -9.869
150 HA ARG 25 HA ARG 25 -2.320 -1.715 -8.823
151 HB2 ARG 25 1HB ARG 25 -2.187 -3.568 -10.587
152 HB3 ARG 25 2HB ARG 25 -2.505 -2.307 -11.770
153 HG2 ARG 25 1HG ARG 25 -0.246 -2.274 -11.838
154 HG3 ARG 25 2HG ARG 25 -0.479 -1.149 -10.499
155 HD2 ARG 25 1HD ARG 25 -0.205 -3.022 -8.918
156 HD3 ARG 25 2HD ARG 25 0.100 -4.101 -10.280
157 HE ARG 25 HE ARG 25 1.845 -1.797 -10.098
158 HH11 ARG 25 1HH1 ARG 25 1.342 -5.151 -9.312
159 HH12 ARG 25 2HH1 ARG 25 3.027 -5.486 -9.086
160 HH21 ARG 25 1HH2 ARG 25 4.066 -2.225 -9.804
161 HH22 ARG 25 2HH2 ARG 25 4.575 -3.820 -9.365
162 H SER 26 H SER 26 -4.488 -0.885 -11.511
163 HA SER 26 HA SER 26 -3.569 1.416 -12.489
164 HB2 SER 26 1HB SER 26 -5.814 2.150 -12.884
165 HB3 SER 26 2HB SER 26 -5.836 0.387 -12.937
166 HG SER 26 HG SER 26 -7.460 1.702 -11.582
167 H ARG 27 H ARG 27 -4.838 1.014 -9.244
168 HA ARG 27 HA ARG 27 -4.615 3.846 -8.656
169 HB2 ARG 27 1HB ARG 27 -6.337 2.056 -7.725
170 HB3 ARG 27 2HB ARG 27 -5.074 1.808 -6.527
171 HG2 ARG 27 1HG ARG 27 -6.221 4.514 -7.150
172 HG3 ARG 27 2HG ARG 27 -6.883 3.445 -5.912
173 HD2 ARG 27 1HD ARG 27 -4.388 3.373 -5.097
174 HD3 ARG 27 2HD ARG 27 -4.279 4.894 -5.983
175 HE ARG 27 HE ARG 27 -5.501 4.491 -3.459
176 HH11 ARG 27 1HH1 ARG 27 -5.848 6.270 -6.432
177 HH12 ARG 27 2HH1 ARG 27 -6.701 7.586 -5.696
178 HH21 ARG 27 1HH2 ARG 27 -6.624 6.218 -2.480
179 HH22 ARG 27 2HH2 ARG 27 -7.141 7.556 -3.448
180 H LEU 28 H LEU 28 -3.182 0.842 -7.372
181 HA LEU 28 HA LEU 28 -1.350 1.886 -5.630
182 HB2 LEU 28 1HB LEU 28 -1.487 -0.424 -5.650
183 HB3 LEU 28 2HB LEU 28 -1.311 -0.519 -7.401
184 HG LEU 28 HG LEU 28 1.060 -0.046 -7.219
185 HD11 LEU 28 1HD1 LEU 28 1.207 1.423 -5.382
186 HD12 LEU 28 2HD1 LEU 28 2.075 -0.035 -4.901
187 HD13 LEU 28 3HD1 LEU 28 0.447 0.263 -4.292
188 HD21 LEU 28 3HD2 LEU 28 1.318 -2.063 -5.306
189 HD22 LEU 28 1HD2 LEU 28 1.212 -2.257 -7.056
190 HD23 LEU 28 2HD2 LEU 28 -0.247 -2.343 -6.070
191 H ASN 29 H ASN 29 -0.711 1.159 -9.065
192 HA ASN 29 HA ASN 29 1.829 1.974 -9.388
193 HB2 ASN 29 1HB ASN 29 -0.581 2.206 -11.115
194 HB3 ASN 29 2HB ASN 29 0.850 3.104 -11.612
195 HD21 ASN 29 1HD2 ASN 29 -0.723 0.385 -12.186
196 HD22 ASN 29 2HD2 ASN 29 0.582 -0.679 -12.572
197 H ARG 30 H ARG 30 -0.952 4.202 -9.445
198 HA ARG 30 HA ARG 30 0.561 6.560 -9.685
199 HB2 ARG 30 1HB ARG 30 -2.095 6.430 -8.280
200 HB3 ARG 30 2HB ARG 30 -1.439 7.731 -9.265
201 HG2 ARG 30 1HG ARG 30 -2.494 5.074 -10.192
202 HG3 ARG 30 2HG ARG 30 -3.148 6.679 -10.524
203 HD2 ARG 30 1HD ARG 30 -0.362 5.988 -11.361
204 HD3 ARG 30 2HD ARG 30 -1.733 5.455 -12.333
205 HE ARG 30 HE ARG 30 -0.760 8.162 -12.020
206 HH11 ARG 30 1HH1 ARG 30 -3.377 6.101 -13.033
207 HH12 ARG 30 2HH1 ARG 30 -4.089 7.295 -14.067
208 HH21 ARG 30 1HH2 ARG 30 -1.689 9.742 -13.378
209 HH22 ARG 30 2HH2 ARG 30 -3.128 9.365 -14.263
210 H HIS 31 H HIS 31 -0.628 4.799 -6.862
211 HA HIS 31 HA HIS 31 0.011 6.650 -4.882
212 HB2 HIS 31 1HB HIS 31 -1.297 4.781 -4.246
213 HB3 HIS 31 2HB HIS 31 -0.106 3.639 -4.862
214 HD1 HIS 31 HD1 HIS 31 -0.480 6.173 -2.061
215 HD2 HIS 31 HD2 HIS 31 1.638 2.721 -2.987
216 HE1 HIS 31 HE1 HIS 31 0.770 5.569 0.035
217 H SER 32 H SER 32 2.019 4.214 -6.459
218 HA SER 32 HA SER 32 4.277 4.428 -4.813
219 HB2 SER 32 1HB SER 32 3.928 2.628 -6.491
220 HB3 SER 32 2HB SER 32 4.215 3.802 -7.776
221 HG SER 32 HG SER 32 6.307 3.909 -7.238
222 H MET 33 H MET 33 2.924 6.671 -6.952
223 HA MET 33 HA MET 33 5.410 8.032 -7.562
224 HB2 MET 33 1HB MET 33 2.622 9.063 -8.063
225 HB3 MET 33 2HB MET 33 4.108 9.515 -8.888
226 HG2 MET 33 1HG MET 33 3.113 6.703 -9.011
227 HG3 MET 33 2HG MET 33 2.422 7.944 -10.054
228 HE1 MET 33 3HE MET 33 4.519 5.298 -9.642
229 HE2 MET 33 1HE MET 33 5.622 5.301 -11.019
230 HE3 MET 33 2HE MET 33 6.138 5.981 -9.475
231 H VAL 34 H VAL 34 2.777 8.263 -5.293
232 HA VAL 34 HA VAL 34 3.220 10.918 -4.425
233 HB VAL 34 HB VAL 34 1.822 10.422 -2.558
234 HG11 VAL 34 1HG1 VAL 34 1.060 9.089 -5.124
235 HG12 VAL 34 2HG1 VAL 34 -0.027 9.027 -3.735
236 HG13 VAL 34 3HG1 VAL 34 0.450 10.583 -4.414
237 HG21 VAL 34 3HG2 VAL 34 3.059 7.865 -2.697
238 HG22 VAL 34 1HG2 VAL 34 2.021 8.521 -1.431
239 HG23 VAL 34 2HG2 VAL 34 1.312 7.642 -2.785
240 H HIS 35 H HIS 35 4.903 7.982 -3.863
241 HA HIS 35 HA HIS 35 6.072 8.678 -1.352
242 HB2 HIS 35 1HB HIS 35 6.674 6.595 -3.437
243 HB3 HIS 35 2HB HIS 35 7.741 6.832 -2.056
244 HD1 HIS 35 HD1 HIS 35 6.646 6.392 0.336
245 HD2 HIS 35 HD2 HIS 35 4.427 5.109 -2.934
246 HE1 HIS 35 HE1 HIS 35 4.936 4.800 1.267
247 H THR 36 H THR 36 6.767 9.412 -4.655
248 HA THR 36 HA THR 36 9.395 10.504 -3.915
249 HB THR 36 HB THR 36 9.383 8.933 -5.823
250 HG1 THR 36 HG1 THR 36 9.911 11.471 -6.926
251 HG21 THR 36 3HG2 THR 36 7.397 10.904 -6.880
252 HG22 THR 36 1HG2 THR 36 7.353 9.142 -6.917
253 HG23 THR 36 2HG2 THR 36 8.434 10.020 -8.000
254 H ALA 37 H ALA 37 6.203 11.351 -4.920
255 HA ALA 37 HA ALA 37 6.904 14.030 -5.752
256 HB1 ALA 37 3HB ALA 37 4.813 12.379 -6.337
257 HB2 ALA 37 1HB ALA 37 4.084 13.497 -5.183
258 HB3 ALA 37 2HB ALA 37 4.853 14.114 -6.646
259 H GLU 38 H GLU 38 7.814 13.519 -3.170
260 HA GLU 38 HA GLU 38 6.130 14.253 -1.081
261 HB2 GLU 38 1HB GLU 38 9.096 14.686 -1.448
262 HB3 GLU 38 2HB GLU 38 8.249 15.014 0.058
263 HG2 GLU 38 1HG GLU 38 7.573 12.667 0.185
264 HG3 GLU 38 2HG GLU 38 8.440 12.342 -1.315
265 H LYS 39 H LYS 39 4.808 15.970 -1.302
266 HA LYS 39 HA LYS 39 5.270 18.332 -2.656
267 HB2 LYS 39 1HB LYS 39 3.541 17.712 -0.269
268 HB3 LYS 39 2HB LYS 39 3.566 19.310 -1.004
269 HG2 LYS 39 1HG LYS 39 2.557 18.581 -2.945
270 HG3 LYS 39 2HG LYS 39 3.057 16.906 -2.699
271 HD2 LYS 39 1HD LYS 39 1.520 17.089 -0.579
272 HD3 LYS 39 2HD LYS 39 0.784 18.412 -1.486
273 HE2 LYS 39 1HE LYS 39 1.233 15.754 -2.784
274 HE3 LYS 39 2HE LYS 39 -0.159 16.003 -1.731
275 HZ1 LYS 39 3HZ LYS 39 0.106 18.137 -3.585
276 HZ2 LYS 39 1HZ LYS 39 -1.203 17.095 -3.334
277 HZ3 LYS 39 2HZ LYS 39 0.036 16.655 -4.398
278 HA PRO 40 HA PRO 40 8.258 20.535 -0.290
279 HB2 PRO 40 1HB PRO 40 7.665 23.061 -1.089
280 HB3 PRO 40 2HB PRO 40 8.491 21.894 -2.128
281 HG2 PRO 40 1HG PRO 40 5.601 22.675 -2.080
282 HG3 PRO 40 2HG PRO 40 6.667 22.415 -3.473
283 HD2 PRO 40 1HD PRO 40 4.893 20.552 -2.629
284 HD3 PRO 40 2HD PRO 40 6.445 20.123 -3.375
285 H SER 41 H SER 41 4.907 20.817 0.178
286 HA SER 41 HA SER 41 5.103 22.780 2.314
287 HB2 SER 41 1HB SER 41 2.638 22.423 2.508
288 HB3 SER 41 2HB SER 41 3.147 22.909 0.891
289 HG SER 41 HG SER 41 2.392 20.337 1.795
290 H GLY 42 H GLY 42 6.252 21.852 3.966
291 HA2 GLY 42 1HA GLY 42 4.958 20.347 5.880
292 HA3 GLY 42 2HA GLY 42 5.809 19.184 4.876
293 HA PRO 43 HA PRO 43 8.621 20.803 8.259
294 HB2 PRO 43 1HB PRO 43 9.173 18.379 9.351
295 HB3 PRO 43 2HB PRO 43 7.798 19.369 9.856
296 HG2 PRO 43 1HG PRO 43 7.864 17.036 7.982
297 HG3 PRO 43 2HG PRO 43 6.691 17.414 9.256
298 HD2 PRO 43 1HD PRO 43 6.210 17.912 6.638
299 HD3 PRO 43 2HD PRO 43 5.561 18.931 7.939
300 H SER 44 H SER 44 10.896 20.487 8.408
301 HA SER 44 HA SER 44 12.065 18.806 6.295
302 HB2 SER 44 1HB SER 44 13.732 20.613 5.878
303 HB3 SER 44 2HB SER 44 12.084 21.086 5.464
304 HG SER 44 HG SER 44 12.932 21.634 8.053
305 H SER 45 H SER 45 14.321 18.244 6.647
306 HA SER 45 HA SER 45 15.323 18.581 9.365
307 HB2 SER 45 1HB SER 45 14.913 15.854 8.114
308 HB3 SER 45 2HB SER 45 15.695 16.170 9.662
309 HG SER 45 HG SER 45 13.475 17.350 9.962
310 H GLY 46 H GLY 46 17.549 18.381 9.556
311 HA2 GLY 46 1HA GLY 46 19.709 17.754 8.755
312 HA3 GLY 46 2HA GLY 46 19.050 17.689 7.127
Start of MODEL 6
1 H1 GLY 1 H GLY 1 -19.613 -10.840 11.668
2 HA2 GLY 1 1HA GLY 1 -17.015 -12.069 12.356
3 HA3 GLY 1 2HA GLY 1 -17.582 -11.947 10.697
4 H SER 2 H SER 2 -16.702 -10.006 13.528
5 HA SER 2 HA SER 2 -16.251 -7.686 11.812
6 HB2 SER 2 1HB SER 2 -16.012 -7.914 14.821
7 HB3 SER 2 2HB SER 2 -15.994 -6.424 13.878
8 HG SER 2 HG SER 2 -18.164 -8.252 13.963
9 H SER 3 H SER 3 -14.475 -9.594 14.238
10 HA SER 3 HA SER 3 -12.058 -9.474 12.707
11 HB2 SER 3 1HB SER 3 -12.315 -7.214 14.025
12 HB3 SER 3 2HB SER 3 -11.796 -8.187 15.401
13 HG SER 3 HG SER 3 -9.880 -8.584 14.406
14 H GLY 4 H GLY 4 -11.274 -11.452 12.953
15 HA2 GLY 4 1HA GLY 4 -10.734 -12.526 15.565
16 HA3 GLY 4 2HA GLY 4 -12.036 -13.371 14.739
17 H SER 5 H SER 5 -11.485 -15.032 13.497
18 HA SER 5 HA SER 5 -8.651 -15.358 12.809
19 HB2 SER 5 1HB SER 5 -9.212 -17.746 12.487
20 HB3 SER 5 2HB SER 5 -9.630 -17.184 14.106
21 HG SER 5 HG SER 5 -11.524 -17.182 12.014
22 H SER 6 H SER 6 -10.059 -13.549 11.252
23 HA SER 6 HA SER 6 -11.364 -14.368 9.004
24 HB2 SER 6 1HB SER 6 -9.201 -12.252 9.122
25 HB3 SER 6 2HB SER 6 -10.427 -12.398 7.862
26 HG SER 6 HG SER 6 -11.802 -11.445 9.128
27 H GLY 7 H GLY 7 -7.831 -14.235 9.424
28 HA2 GLY 7 1HA GLY 7 -6.413 -15.976 8.583
29 HA3 GLY 7 2HA GLY 7 -7.603 -16.288 7.328
30 H THR 8 H THR 8 -5.668 -16.208 5.939
31 HA THR 8 HA THR 8 -4.617 -13.525 5.452
32 HB THR 8 HB THR 8 -3.029 -15.426 5.571
33 HG1 THR 8 HG1 THR 8 -1.839 -14.686 3.857
34 HG21 THR 8 3HG2 THR 8 -3.687 -17.346 4.622
35 HG22 THR 8 1HG2 THR 8 -3.203 -16.622 3.089
36 HG23 THR 8 2HG2 THR 8 -4.884 -16.533 3.615
37 H GLY 9 H GLY 9 -4.704 -12.516 3.415
38 HA2 GLY 9 1HA GLY 9 -5.621 -13.318 1.022
39 HA3 GLY 9 2HA GLY 9 -7.116 -13.133 1.926
40 H GLU 10 H GLU 10 -4.100 -11.324 1.331
41 HA GLU 10 HA GLU 10 -5.503 -8.808 1.598
42 HB2 GLU 10 1HB GLU 10 -2.635 -9.385 0.836
43 HB3 GLU 10 2HB GLU 10 -3.297 -7.793 1.180
44 HG2 GLU 10 1HG GLU 10 -3.748 -8.441 3.467
45 HG3 GLU 10 2HG GLU 10 -3.176 -10.075 3.138
46 H LYS 11 H LYS 11 -5.166 -7.102 -0.100
47 HA LYS 11 HA LYS 11 -6.448 -7.686 -2.437
48 HB2 LYS 11 1HB LYS 11 -4.598 -5.511 -1.602
49 HB3 LYS 11 2HB LYS 11 -4.967 -5.641 -3.316
50 HG2 LYS 11 1HG LYS 11 -6.520 -4.114 -2.447
51 HG3 LYS 11 2HG LYS 11 -7.410 -5.625 -2.654
52 HD2 LYS 11 1HD LYS 11 -6.108 -5.117 -0.029
53 HD3 LYS 11 2HD LYS 11 -7.565 -4.202 -0.423
54 HE2 LYS 11 1HE LYS 11 -7.525 -7.162 -0.818
55 HE3 LYS 11 2HE LYS 11 -7.738 -6.504 0.804
56 HZ1 LYS 11 3HZ LYS 11 -9.483 -6.144 -1.558
57 HZ2 LYS 11 1HZ LYS 11 -9.583 -5.126 -0.210
58 HZ3 LYS 11 2HZ LYS 11 -9.885 -6.782 -0.043
59 HA PRO 12 HA PRO 12 -3.731 -9.806 -5.153
60 HB2 PRO 12 1HB PRO 12 -4.392 -8.732 -7.557
61 HB3 PRO 12 2HB PRO 12 -5.451 -9.840 -6.677
62 HG2 PRO 12 1HG PRO 12 -5.546 -6.852 -6.833
63 HG3 PRO 12 2HG PRO 12 -6.878 -8.020 -6.916
64 HD2 PRO 12 1HD PRO 12 -6.288 -6.641 -4.662
65 HD3 PRO 12 2HD PRO 12 -6.954 -8.286 -4.627
66 H PHE 13 H PHE 13 -3.233 -6.671 -4.335
67 HA PHE 13 HA PHE 13 -0.685 -6.598 -5.775
68 HB2 PHE 13 1HB PHE 13 -2.598 -4.259 -5.609
69 HB3 PHE 13 2HB PHE 13 -0.971 -4.203 -6.279
70 HD1 PHE 13 HD1 PHE 13 -0.462 -5.287 -8.405
71 HD2 PHE 13 HD2 PHE 13 -4.416 -5.226 -6.830
72 HE1 PHE 13 HE1 PHE 13 -1.347 -5.919 -10.612
73 HE2 PHE 13 HE2 PHE 13 -5.307 -5.859 -9.034
74 HZ PHE 13 HZ PHE 13 -3.772 -6.207 -10.929
75 H LYS 14 H LYS 14 0.791 -4.901 -4.848
76 HA LYS 14 HA LYS 14 0.253 -3.988 -2.174
77 HB2 LYS 14 1HB LYS 14 0.842 -6.326 -1.731
78 HB3 LYS 14 2HB LYS 14 2.346 -6.126 -2.621
79 HG2 LYS 14 1HG LYS 14 2.796 -4.231 -0.894
80 HG3 LYS 14 2HG LYS 14 1.581 -5.079 0.064
81 HD2 LYS 14 1HD LYS 14 2.883 -7.124 -0.047
82 HD3 LYS 14 2HD LYS 14 4.071 -6.337 -1.089
83 HE2 LYS 14 1HE LYS 14 4.894 -5.019 0.634
84 HE3 LYS 14 2HE LYS 14 3.431 -5.195 1.601
85 HZ1 LYS 14 3HZ LYS 14 5.737 -6.956 1.387
86 HZ2 LYS 14 1HZ LYS 14 4.229 -7.714 1.511
87 HZ3 LYS 14 2HZ LYS 14 4.736 -6.638 2.714
88 H CYS 15 H CYS 15 1.788 -2.490 -1.419
89 HA CYS 15 HA CYS 15 3.259 -1.174 -3.516
90 HB2 CYS 15 1HB CYS 15 1.945 -0.136 -1.496
91 HB3 CYS 15 2HB CYS 15 3.457 -0.391 -0.630
92 H ASP 16 H ASP 16 5.517 -0.264 -2.781
93 HA ASP 16 HA ASP 16 7.104 -2.542 -1.788
94 HB2 ASP 16 1HB ASP 16 7.471 -0.772 -4.151
95 HB3 ASP 16 2HB ASP 16 8.920 -1.265 -3.280
96 H ILE 17 H ILE 17 6.421 0.828 -1.589
97 HA ILE 17 HA ILE 17 8.789 1.415 -0.006
98 HB ILE 17 HB ILE 17 6.460 3.259 -0.509
99 HG12 ILE 17 1HG1 ILE 17 8.272 4.116 -2.287
100 HG13 ILE 17 2HG1 ILE 17 8.673 2.402 -2.301
101 HG21 ILE 17 1HG2 ILE 17 9.362 3.824 0.083
102 HG22 ILE 17 2HG2 ILE 17 8.072 5.013 -0.088
103 HG23 ILE 17 3HG2 ILE 17 8.054 3.883 1.265
104 HD11 ILE 17 3HD1 ILE 17 6.959 1.982 -3.626
105 HD12 ILE 17 1HD1 ILE 17 5.842 2.712 -2.474
106 HD13 ILE 17 2HD1 ILE 17 6.626 3.712 -3.697
107 H CYS 18 H CYS 18 5.261 1.361 0.432
108 HA CYS 18 HA CYS 18 5.717 1.198 3.340
109 HB2 CYS 18 1HB CYS 18 3.530 2.259 3.652
110 HB3 CYS 18 2HB CYS 18 4.597 3.288 2.702
111 H GLY 19 H GLY 19 4.807 -0.529 0.675
112 HA2 GLY 19 1HA GLY 19 3.986 -2.682 0.517
113 HA3 GLY 19 2HA GLY 19 3.787 -2.688 2.263
114 H LYS 20 H LYS 20 2.321 -0.002 0.864
115 HA LYS 20 HA LYS 20 -0.251 -0.642 1.682
116 HB2 LYS 20 1HB LYS 20 0.944 1.388 -0.118
117 HB3 LYS 20 2HB LYS 20 -0.785 1.117 -0.286
118 HG2 LYS 20 1HG LYS 20 0.507 1.680 2.365
119 HG3 LYS 20 2HG LYS 20 -0.067 2.958 1.291
120 HD2 LYS 20 1HD LYS 20 -2.271 2.429 1.615
121 HD3 LYS 20 2HD LYS 20 -1.926 0.729 1.943
122 HE2 LYS 20 1HE LYS 20 -2.521 1.498 4.033
123 HE3 LYS 20 2HE LYS 20 -0.766 1.660 4.079
124 HZ1 LYS 20 3HZ LYS 20 -2.669 3.851 3.449
125 HZ2 LYS 20 1HZ LYS 20 -0.987 3.994 3.550
126 HZ3 LYS 20 2HZ LYS 20 -1.889 3.632 4.934
127 H SER 21 H SER 21 -1.954 -1.683 0.802
128 HA SER 21 HA SER 21 -1.474 -3.111 -1.711
129 HB2 SER 21 1HB SER 21 -2.864 -4.781 -0.945
130 HB3 SER 21 2HB SER 21 -2.279 -4.153 0.596
131 HG SER 21 HG SER 21 -4.228 -3.521 1.048
132 H PHE 22 H PHE 22 -3.200 -3.303 -3.277
133 HA PHE 22 HA PHE 22 -5.347 -1.355 -3.160
134 HB2 PHE 22 1HB PHE 22 -3.296 -1.264 -5.382
135 HB3 PHE 22 2HB PHE 22 -4.746 -0.273 -5.268
136 HD1 PHE 22 HD1 PHE 22 -1.614 -1.065 -3.422
137 HD2 PHE 22 HD2 PHE 22 -4.630 1.812 -4.282
138 HE1 PHE 22 HE1 PHE 22 -0.348 0.632 -2.168
139 HE2 PHE 22 HE2 PHE 22 -3.369 3.514 -3.031
140 HZ PHE 22 HZ PHE 22 -1.225 2.926 -1.972
141 H CYS 23 H CYS 23 -7.089 -2.441 -3.763
142 HA CYS 23 HA CYS 23 -7.235 -4.938 -4.846
143 HB2 CYS 23 1HB CYS 23 -9.540 -4.349 -5.582
144 HB3 CYS 23 2HB CYS 23 -9.192 -3.856 -3.929
145 HG CYS 23 HG CYS 23 -10.786 -1.913 -5.203
146 H GLY 24 H GLY 24 -6.694 -1.929 -6.527
147 HA2 GLY 24 1HA GLY 24 -6.350 -3.469 -9.018
148 HA3 GLY 24 2HA GLY 24 -7.242 -1.955 -9.025
149 H ARG 25 H ARG 25 -4.397 -3.225 -9.858
150 HA ARG 25 HA ARG 25 -2.369 -1.691 -8.822
151 HB2 ARG 25 1HB ARG 25 -2.303 -3.568 -10.600
152 HB3 ARG 25 2HB ARG 25 -2.510 -2.269 -11.768
153 HG2 ARG 25 1HG ARG 25 -0.248 -2.375 -11.753
154 HG3 ARG 25 2HG ARG 25 -0.473 -1.240 -10.420
155 HD2 ARG 25 1HD ARG 25 -0.234 -3.002 -8.806
156 HD3 ARG 25 2HD ARG 25 -0.208 -4.223 -10.078
157 HE ARG 25 HE ARG 25 1.978 -2.555 -9.223
158 HH11 ARG 25 1HH1 ARG 25 0.674 -4.490 -11.807
159 HH12 ARG 25 2HH1 ARG 25 2.217 -4.787 -12.538
160 HH21 ARG 25 1HH2 ARG 25 4.015 -2.939 -10.177
161 HH22 ARG 25 2HH2 ARG 25 4.116 -3.905 -11.610
162 H SER 26 H SER 26 -4.553 -0.858 -11.492
163 HA SER 26 HA SER 26 -3.591 1.418 -12.507
164 HB2 SER 26 1HB SER 26 -6.390 0.706 -11.698
165 HB3 SER 26 2HB SER 26 -6.055 2.304 -12.365
166 HG SER 26 HG SER 26 -6.640 0.697 -13.949
167 H ARG 27 H ARG 27 -4.814 1.047 -9.249
168 HA ARG 27 HA ARG 27 -4.576 3.890 -8.693
169 HB2 ARG 27 1HB ARG 27 -6.320 2.127 -7.745
170 HB3 ARG 27 2HB ARG 27 -5.062 1.884 -6.541
171 HG2 ARG 27 1HG ARG 27 -6.176 4.593 -7.204
172 HG3 ARG 27 2HG ARG 27 -6.860 3.548 -5.957
173 HD2 ARG 27 1HD ARG 27 -5.016 3.749 -4.590
174 HD3 ARG 27 2HD ARG 27 -3.936 4.133 -5.929
175 HE ARG 27 HE ARG 27 -4.384 6.336 -5.571
176 HH11 ARG 27 1HH1 ARG 27 -6.971 4.448 -4.207
177 HH12 ARG 27 2HH1 ARG 27 -7.781 5.816 -3.518
178 HH21 ARG 27 1HH2 ARG 27 -5.441 8.145 -4.669
179 HH22 ARG 27 2HH2 ARG 27 -6.910 7.919 -3.782
180 H LEU 28 H LEU 28 -3.194 0.882 -7.361
181 HA LEU 28 HA LEU 28 -1.342 1.926 -5.640
182 HB2 LEU 28 1HB LEU 28 -1.521 -0.380 -5.612
183 HB3 LEU 28 2HB LEU 28 -1.350 -0.515 -7.360
184 HG LEU 28 HG LEU 28 1.030 -0.081 -7.190
185 HD11 LEU 28 1HD1 LEU 28 1.202 1.418 -5.378
186 HD12 LEU 28 2HD1 LEU 28 2.049 -0.045 -4.877
187 HD13 LEU 28 3HD1 LEU 28 0.428 0.288 -4.268
188 HD21 LEU 28 3HD2 LEU 28 1.109 -2.296 -7.004
189 HD22 LEU 28 1HD2 LEU 28 -0.316 -2.327 -5.964
190 HD23 LEU 28 2HD2 LEU 28 1.282 -2.067 -5.263
191 H ASN 29 H ASN 29 -0.723 1.121 -9.061
192 HA ASN 29 HA ASN 29 1.834 1.881 -9.400
193 HB2 ASN 29 1HB ASN 29 -0.573 2.126 -11.131
194 HB3 ASN 29 2HB ASN 29 0.878 2.981 -11.647
195 HD21 ASN 29 1HD2 ASN 29 -0.757 0.286 -12.161
196 HD22 ASN 29 2HD2 ASN 29 0.524 -0.815 -12.525
197 H ARG 30 H ARG 30 -0.905 4.158 -9.501
198 HA ARG 30 HA ARG 30 0.666 6.480 -9.777
199 HB2 ARG 30 1HB ARG 30 -2.019 6.432 -8.421
200 HB3 ARG 30 2HB ARG 30 -1.315 7.703 -9.412
201 HG2 ARG 30 1HG ARG 30 -2.427 5.062 -10.311
202 HG3 ARG 30 2HG ARG 30 -3.009 6.682 -10.702
203 HD2 ARG 30 1HD ARG 30 -0.235 5.840 -11.446
204 HD3 ARG 30 2HD ARG 30 -1.608 5.375 -12.449
205 HE ARG 30 HE ARG 30 -1.475 8.189 -11.835
206 HH11 ARG 30 1HH1 ARG 30 -0.513 5.661 -14.027
207 HH12 ARG 30 2HH1 ARG 30 -0.256 6.736 -15.361
208 HH21 ARG 30 1HH2 ARG 30 -1.140 9.615 -13.584
209 HH22 ARG 30 2HH2 ARG 30 -0.613 8.985 -15.108
210 H HIS 31 H HIS 31 -0.591 4.788 -6.945
211 HA HIS 31 HA HIS 31 0.040 6.667 -4.987
212 HB2 HIS 31 1HB HIS 31 -1.299 4.843 -4.317
213 HB3 HIS 31 2HB HIS 31 -0.145 3.662 -4.929
214 HD1 HIS 31 HD1 HIS 31 -0.505 6.175 -2.117
215 HD2 HIS 31 HD2 HIS 31 1.648 2.755 -3.081
216 HE1 HIS 31 HE1 HIS 31 0.752 5.560 -0.027
217 H SER 32 H SER 32 2.034 4.155 -6.468
218 HA SER 32 HA SER 32 4.268 4.375 -4.795
219 HB2 SER 32 1HB SER 32 3.926 2.546 -6.437
220 HB3 SER 32 2HB SER 32 4.239 3.687 -7.745
221 HG SER 32 HG SER 32 6.262 3.981 -6.180
222 H MET 33 H MET 33 2.991 6.587 -7.017
223 HA MET 33 HA MET 33 5.507 7.900 -7.604
224 HB2 MET 33 1HB MET 33 2.750 8.973 -8.179
225 HB3 MET 33 2HB MET 33 4.258 9.364 -8.994
226 HG2 MET 33 1HG MET 33 3.211 6.571 -9.053
227 HG3 MET 33 2HG MET 33 2.540 7.794 -10.129
228 HE1 MET 33 3HE MET 33 4.620 5.137 -9.628
229 HE2 MET 33 1HE MET 33 5.738 5.094 -10.992
230 HE3 MET 33 2HE MET 33 6.237 5.825 -9.467
231 H VAL 34 H VAL 34 2.917 8.144 -5.319
232 HA VAL 34 HA VAL 34 3.357 10.838 -4.520
233 HB VAL 34 HB VAL 34 1.900 10.418 -2.698
234 HG11 VAL 34 1HG1 VAL 34 0.577 10.473 -4.598
235 HG12 VAL 34 2HG1 VAL 34 1.198 8.934 -5.200
236 HG13 VAL 34 3HG1 VAL 34 0.081 8.962 -3.835
237 HG21 VAL 34 3HG2 VAL 34 1.333 7.687 -2.689
238 HG22 VAL 34 1HG2 VAL 34 3.091 7.793 -2.772
239 HG23 VAL 34 2HG2 VAL 34 2.221 8.593 -1.464
240 H HIS 35 H HIS 35 5.001 7.899 -3.904
241 HA HIS 35 HA HIS 35 6.140 8.620 -1.381
242 HB2 HIS 35 1HB HIS 35 6.730 6.480 -3.412
243 HB3 HIS 35 2HB HIS 35 7.782 6.727 -2.022
244 HD1 HIS 35 HD1 HIS 35 6.619 6.396 0.368
245 HD2 HIS 35 HD2 HIS 35 4.475 5.014 -2.912
246 HE1 HIS 35 HE1 HIS 35 4.873 4.849 1.309
247 H THR 36 H THR 36 6.880 9.286 -4.685
248 HA THR 36 HA THR 36 9.468 10.449 -3.885
249 HB THR 36 HB THR 36 9.605 8.646 -5.604
250 HG1 THR 36 HG1 THR 36 10.490 11.268 -5.959
251 HG21 THR 36 3HG2 THR 36 8.695 8.877 -7.751
252 HG22 THR 36 1HG2 THR 36 8.357 10.592 -7.523
253 HG23 THR 36 2HG2 THR 36 7.389 9.382 -6.680
254 H ALA 37 H ALA 37 6.341 11.078 -5.162
255 HA ALA 37 HA ALA 37 7.084 13.705 -6.184
256 HB1 ALA 37 3HB ALA 37 5.001 13.797 -7.198
257 HB2 ALA 37 1HB ALA 37 5.386 12.076 -7.259
258 HB3 ALA 37 2HB ALA 37 4.273 12.689 -6.035
259 H GLU 38 H GLU 38 7.727 14.637 -4.171
260 HA GLU 38 HA GLU 38 5.469 15.281 -2.389
261 HB2 GLU 38 1HB GLU 38 7.142 15.622 -0.607
262 HB3 GLU 38 2HB GLU 38 7.154 13.977 -1.227
263 HG2 GLU 38 1HG GLU 38 9.071 16.087 -2.168
264 HG3 GLU 38 2HG GLU 38 9.401 15.028 -0.798
265 H LYS 39 H LYS 39 4.915 17.355 -2.163
266 HA LYS 39 HA LYS 39 6.497 19.361 -3.582
267 HB2 LYS 39 1HB LYS 39 3.658 19.167 -2.675
268 HB3 LYS 39 2HB LYS 39 4.362 20.763 -2.898
269 HG2 LYS 39 1HG LYS 39 5.080 19.782 -5.219
270 HG3 LYS 39 2HG LYS 39 3.756 18.657 -4.911
271 HD2 LYS 39 1HD LYS 39 2.156 20.341 -4.921
272 HD3 LYS 39 2HD LYS 39 3.342 21.605 -4.591
273 HE2 LYS 39 1HE LYS 39 4.305 20.868 -6.917
274 HE3 LYS 39 2HE LYS 39 2.675 20.242 -7.160
275 HZ1 LYS 39 3HZ LYS 39 2.022 22.617 -6.341
276 HZ2 LYS 39 1HZ LYS 39 2.455 22.355 -7.955
277 HZ3 LYS 39 2HZ LYS 39 3.576 23.018 -6.876
278 HA PRO 40 HA PRO 40 8.046 21.368 -0.000
279 HB2 PRO 40 1HB PRO 40 7.897 23.984 -0.709
280 HB3 PRO 40 2HB PRO 40 9.073 22.865 -1.409
281 HG2 PRO 40 1HG PRO 40 6.459 23.809 -2.523
282 HG3 PRO 40 2HG PRO 40 8.019 23.609 -3.343
283 HD2 PRO 40 1HD PRO 40 6.024 21.788 -3.541
284 HD3 PRO 40 2HD PRO 40 7.740 21.334 -3.589
285 H SER 41 H SER 41 4.882 22.248 -1.167
286 HA SER 41 HA SER 41 4.222 23.573 1.357
287 HB2 SER 41 1HB SER 41 2.663 23.314 -1.225
288 HB3 SER 41 2HB SER 41 2.089 24.165 0.209
289 HG SER 41 HG SER 41 4.577 24.972 -0.501
290 H GLY 42 H GLY 42 4.174 21.764 2.727
291 HA2 GLY 42 1HA GLY 42 1.982 20.629 3.573
292 HA3 GLY 42 2HA GLY 42 2.203 19.680 2.110
293 HA PRO 43 HA PRO 43 4.819 18.182 5.859
294 HB2 PRO 43 1HB PRO 43 3.104 16.415 7.003
295 HB3 PRO 43 2HB PRO 43 3.217 18.107 7.504
296 HG2 PRO 43 1HG PRO 43 1.228 16.797 5.689
297 HG3 PRO 43 2HG PRO 43 0.956 17.992 6.972
298 HD2 PRO 43 1HD PRO 43 1.039 18.663 4.350
299 HD3 PRO 43 2HD PRO 43 1.589 19.758 5.634
300 H SER 44 H SER 44 5.989 17.194 4.167
301 HA SER 44 HA SER 44 5.128 15.075 2.577
302 HB2 SER 44 1HB SER 44 7.205 16.372 2.179
303 HB3 SER 44 2HB SER 44 7.944 15.580 3.570
304 HG SER 44 HG SER 44 6.833 13.997 1.545
305 H SER 45 H SER 45 4.855 12.952 2.892
306 HA SER 45 HA SER 45 6.233 11.388 4.784
307 HB2 SER 45 1HB SER 45 4.837 12.680 6.383
308 HB3 SER 45 2HB SER 45 3.391 12.069 5.579
309 HG SER 45 HG SER 45 5.276 10.205 6.445
310 H GLY 46 H GLY 46 5.741 9.184 4.612
311 HA2 GLY 46 1HA GLY 46 4.976 8.172 2.212
312 HA3 GLY 46 2HA GLY 46 4.795 7.279 3.714
Start of MODEL 7
1 H1 GLY 1 H GLY 1 13.186 -21.768 15.120
2 HA2 GLY 1 1HA GLY 1 11.353 -20.281 14.287
3 HA3 GLY 1 2HA GLY 1 12.949 -19.708 13.824
4 H SER 2 H SER 2 10.257 -19.437 12.549
5 HA SER 2 HA SER 2 10.730 -20.814 10.004
6 HB2 SER 2 1HB SER 2 8.443 -20.738 11.309
7 HB3 SER 2 2HB SER 2 8.288 -19.162 10.533
8 HG SER 2 HG SER 2 9.049 -21.302 8.925
9 H SER 3 H SER 3 10.002 -19.444 8.039
10 HA SER 3 HA SER 3 11.307 -16.812 8.261
11 HB2 SER 3 1HB SER 3 12.482 -18.494 6.832
12 HB3 SER 3 2HB SER 3 11.063 -18.538 5.786
13 HG SER 3 HG SER 3 12.460 -17.071 4.904
14 H GLY 4 H GLY 4 8.620 -17.025 8.917
15 HA2 GLY 4 1HA GLY 4 6.610 -16.007 8.483
16 HA3 GLY 4 2HA GLY 4 7.470 -15.041 7.293
17 H SER 5 H SER 5 4.946 -17.074 7.668
18 HA SER 5 HA SER 5 5.226 -18.529 5.174
19 HB2 SER 5 1HB SER 5 3.260 -19.687 5.780
20 HB3 SER 5 2HB SER 5 4.098 -19.418 7.308
21 HG SER 5 HG SER 5 2.705 -17.390 7.302
22 H SER 6 H SER 6 4.596 -17.784 3.267
23 HA SER 6 HA SER 6 2.925 -15.380 3.173
24 HB2 SER 6 1HB SER 6 5.219 -15.651 1.962
25 HB3 SER 6 2HB SER 6 4.293 -16.578 0.781
26 HG SER 6 HG SER 6 4.294 -13.865 1.301
27 H GLY 7 H GLY 7 0.819 -15.682 2.903
28 HA2 GLY 7 1HA GLY 7 -0.053 -17.903 1.158
29 HA3 GLY 7 2HA GLY 7 -0.921 -17.442 2.614
30 H THR 8 H THR 8 -2.846 -16.992 1.575
31 HA THR 8 HA THR 8 -2.802 -14.596 -0.140
32 HB THR 8 HB THR 8 -3.359 -16.583 -1.481
33 HG1 THR 8 HG1 THR 8 -4.480 -14.393 -1.644
34 HG21 THR 8 3HG2 THR 8 -5.231 -17.952 -1.059
35 HG22 THR 8 1HG2 THR 8 -5.869 -16.848 0.157
36 HG23 THR 8 2HG2 THR 8 -4.421 -17.795 0.500
37 H GLY 9 H GLY 9 -4.555 -13.150 0.073
38 HA2 GLY 9 1HA GLY 9 -6.848 -13.377 1.534
39 HA3 GLY 9 2HA GLY 9 -5.621 -13.018 2.740
40 H GLU 10 H GLU 10 -4.027 -11.196 1.599
41 HA GLU 10 HA GLU 10 -5.615 -8.838 1.687
42 HB2 GLU 10 1HB GLU 10 -2.712 -9.415 1.222
43 HB3 GLU 10 2HB GLU 10 -3.339 -7.802 0.913
44 HG2 GLU 10 1HG GLU 10 -3.750 -9.206 3.531
45 HG3 GLU 10 2HG GLU 10 -2.321 -8.231 3.192
46 H LYS 11 H LYS 11 -5.061 -7.076 -0.076
47 HA LYS 11 HA LYS 11 -6.469 -7.691 -2.370
48 HB2 LYS 11 1HB LYS 11 -4.598 -5.509 -1.597
49 HB3 LYS 11 2HB LYS 11 -5.012 -5.657 -3.299
50 HG2 LYS 11 1HG LYS 11 -6.510 -4.096 -2.322
51 HG3 LYS 11 2HG LYS 11 -7.419 -5.575 -2.642
52 HD2 LYS 11 1HD LYS 11 -6.155 -5.260 0.031
53 HD3 LYS 11 2HD LYS 11 -7.591 -4.298 -0.325
54 HE2 LYS 11 1HE LYS 11 -8.480 -6.644 -1.188
55 HE3 LYS 11 2HE LYS 11 -7.288 -7.239 -0.034
56 HZ1 LYS 11 3HZ LYS 11 -8.627 -6.736 1.642
57 HZ2 LYS 11 1HZ LYS 11 -9.844 -6.384 0.521
58 HZ3 LYS 11 2HZ LYS 11 -8.842 -5.149 1.097
59 HA PRO 12 HA PRO 12 -3.795 -9.831 -5.113
60 HB2 PRO 12 1HB PRO 12 -4.460 -8.753 -7.514
61 HB3 PRO 12 2HB PRO 12 -5.525 -9.848 -6.625
62 HG2 PRO 12 1HG PRO 12 -5.589 -6.860 -6.784
63 HG3 PRO 12 2HG PRO 12 -6.934 -8.013 -6.857
64 HD2 PRO 12 1HD PRO 12 -6.314 -6.637 -4.608
65 HD3 PRO 12 2HD PRO 12 -6.997 -8.275 -4.568
66 H PHE 13 H PHE 13 -3.255 -6.703 -4.300
67 HA PHE 13 HA PHE 13 -0.714 -6.661 -5.750
68 HB2 PHE 13 1HB PHE 13 -2.606 -4.304 -5.599
69 HB3 PHE 13 2HB PHE 13 -0.978 -4.265 -6.268
70 HD1 PHE 13 HD1 PHE 13 -0.476 -5.387 -8.382
71 HD2 PHE 13 HD2 PHE 13 -4.433 -5.244 -6.820
72 HE1 PHE 13 HE1 PHE 13 -1.365 -6.026 -10.585
73 HE2 PHE 13 HE2 PHE 13 -5.328 -5.884 -9.020
74 HZ PHE 13 HZ PHE 13 -3.794 -6.277 -10.906
75 H LYS 14 H LYS 14 0.751 -4.911 -4.848
76 HA LYS 14 HA LYS 14 0.233 -4.008 -2.171
77 HB2 LYS 14 1HB LYS 14 0.838 -6.344 -1.730
78 HB3 LYS 14 2HB LYS 14 2.337 -6.132 -2.624
79 HG2 LYS 14 1HG LYS 14 2.802 -4.248 -0.907
80 HG3 LYS 14 2HG LYS 14 1.567 -5.063 0.055
81 HD2 LYS 14 1HD LYS 14 2.851 -7.160 -0.121
82 HD3 LYS 14 2HD LYS 14 4.101 -6.299 -1.023
83 HE2 LYS 14 1HE LYS 14 4.995 -6.176 1.072
84 HE3 LYS 14 2HE LYS 14 4.020 -4.708 1.087
85 HZ1 LYS 14 3HZ LYS 14 3.869 -6.352 3.052
86 HZ2 LYS 14 1HZ LYS 14 2.862 -7.245 2.027
87 HZ3 LYS 14 2HZ LYS 14 2.448 -5.660 2.449
88 H CYS 15 H CYS 15 1.792 -2.521 -1.414
89 HA CYS 15 HA CYS 15 3.231 -1.193 -3.528
90 HB2 CYS 15 1HB CYS 15 1.933 -0.142 -1.520
91 HB3 CYS 15 2HB CYS 15 3.428 -0.425 -0.634
92 H ASP 16 H ASP 16 5.496 -0.300 -2.870
93 HA ASP 16 HA ASP 16 7.098 -2.567 -1.876
94 HB2 ASP 16 1HB ASP 16 7.443 -0.782 -4.234
95 HB3 ASP 16 2HB ASP 16 8.897 -1.298 -3.385
96 H ILE 17 H ILE 17 6.400 0.795 -1.649
97 HA ILE 17 HA ILE 17 8.790 1.387 -0.100
98 HB ILE 17 HB ILE 17 6.448 3.228 -0.550
99 HG12 ILE 17 1HG1 ILE 17 8.206 4.092 -2.375
100 HG13 ILE 17 2HG1 ILE 17 8.621 2.381 -2.400
101 HG21 ILE 17 1HG2 ILE 17 9.364 3.790 -0.029
102 HG22 ILE 17 2HG2 ILE 17 8.073 4.982 -0.171
103 HG23 ILE 17 3HG2 ILE 17 8.084 3.851 1.182
104 HD11 ILE 17 3HD1 ILE 17 6.798 1.861 -3.554
105 HD12 ILE 17 1HD1 ILE 17 5.758 2.837 -2.518
106 HD13 ILE 17 2HD1 ILE 17 6.633 3.591 -3.851
107 H CYS 18 H CYS 18 5.266 1.342 0.389
108 HA CYS 18 HA CYS 18 5.764 1.149 3.288
109 HB2 CYS 18 1HB CYS 18 3.594 2.224 3.645
110 HB3 CYS 18 2HB CYS 18 4.647 3.252 2.678
111 H GLY 19 H GLY 19 4.820 -0.557 0.628
112 HA2 GLY 19 1HA GLY 19 3.992 -2.709 0.473
113 HA3 GLY 19 2HA GLY 19 3.789 -2.713 2.218
114 H LYS 20 H LYS 20 2.339 -0.009 0.864
115 HA LYS 20 HA LYS 20 -0.232 -0.622 1.666
116 HB2 LYS 20 1HB LYS 20 0.985 1.381 -0.141
117 HB3 LYS 20 2HB LYS 20 -0.741 1.111 -0.346
118 HG2 LYS 20 1HG LYS 20 0.493 1.703 2.326
119 HG3 LYS 20 2HG LYS 20 -0.060 2.967 1.226
120 HD2 LYS 20 1HD LYS 20 -2.269 2.440 1.513
121 HD3 LYS 20 2HD LYS 20 -1.930 0.743 1.861
122 HE2 LYS 20 1HE LYS 20 -2.627 1.622 3.911
123 HE3 LYS 20 2HE LYS 20 -0.869 1.596 4.029
124 HZ1 LYS 20 3HZ LYS 20 -1.299 4.032 3.011
125 HZ2 LYS 20 1HZ LYS 20 -1.146 3.712 4.666
126 HZ3 LYS 20 2HZ LYS 20 -2.681 3.849 3.970
127 H SER 21 H SER 21 -1.934 -1.682 0.817
128 HA SER 21 HA SER 21 -1.481 -3.133 -1.687
129 HB2 SER 21 1HB SER 21 -2.871 -4.792 -0.893
130 HB3 SER 21 2HB SER 21 -2.262 -4.155 0.634
131 HG SER 21 HG SER 21 -4.713 -3.463 -0.623
132 H PHE 22 H PHE 22 -3.200 -3.324 -3.248
133 HA PHE 22 HA PHE 22 -5.357 -1.385 -3.128
134 HB2 PHE 22 1HB PHE 22 -3.323 -1.293 -5.366
135 HB3 PHE 22 2HB PHE 22 -4.769 -0.297 -5.231
136 HD1 PHE 22 HD1 PHE 22 -1.564 -1.075 -3.525
137 HD2 PHE 22 HD2 PHE 22 -4.685 1.752 -4.142
138 HE1 PHE 22 HE1 PHE 22 -0.276 0.614 -2.283
139 HE2 PHE 22 HE2 PHE 22 -3.402 3.446 -2.902
140 HZ PHE 22 HZ PHE 22 -1.194 2.878 -1.971
141 H CYS 23 H CYS 23 -7.116 -2.399 -3.803
142 HA CYS 23 HA CYS 23 -7.258 -4.928 -4.851
143 HB2 CYS 23 1HB CYS 23 -9.560 -4.384 -5.536
144 HB3 CYS 23 2HB CYS 23 -9.199 -3.765 -3.929
145 HG CYS 23 HG CYS 23 -9.377 -1.935 -6.814
146 H GLY 24 H GLY 24 -6.651 -1.939 -6.526
147 HA2 GLY 24 1HA GLY 24 -6.318 -3.480 -9.015
148 HA3 GLY 24 2HA GLY 24 -7.211 -1.966 -9.032
149 H ARG 25 H ARG 25 -4.369 -3.227 -9.863
150 HA ARG 25 HA ARG 25 -2.348 -1.682 -8.814
151 HB2 ARG 25 1HB ARG 25 -2.211 -3.579 -10.532
152 HB3 ARG 25 2HB ARG 25 -2.503 -2.343 -11.748
153 HG2 ARG 25 1HG ARG 25 -0.243 -2.332 -11.789
154 HG3 ARG 25 2HG ARG 25 -0.482 -1.173 -10.479
155 HD2 ARG 25 1HD ARG 25 0.076 -2.720 -8.840
156 HD3 ARG 25 2HD ARG 25 -0.251 -4.097 -9.891
157 HE ARG 25 HE ARG 25 2.208 -2.630 -9.673
158 HH11 ARG 25 1HH1 ARG 25 0.253 -4.642 -11.734
159 HH12 ARG 25 2HH1 ARG 25 1.593 -5.202 -12.679
160 HH21 ARG 25 1HH2 ARG 25 3.981 -3.359 -10.909
161 HH22 ARG 25 2HH2 ARG 25 3.713 -4.472 -12.208
162 H SER 26 H SER 26 -4.503 -0.890 -11.521
163 HA SER 26 HA SER 26 -3.555 1.368 -12.564
164 HB2 SER 26 1HB SER 26 -5.811 0.417 -13.040
165 HB3 SER 26 2HB SER 26 -6.402 1.164 -11.555
166 HG SER 26 HG SER 26 -5.294 3.124 -12.744
167 H ARG 27 H ARG 27 -4.792 1.070 -9.298
168 HA ARG 27 HA ARG 27 -4.491 3.917 -8.793
169 HB2 ARG 27 1HB ARG 27 -6.284 2.201 -7.829
170 HB3 ARG 27 2HB ARG 27 -5.046 1.979 -6.600
171 HG2 ARG 27 1HG ARG 27 -6.068 4.696 -7.359
172 HG3 ARG 27 2HG ARG 27 -6.854 3.697 -6.134
173 HD2 ARG 27 1HD ARG 27 -4.771 3.612 -4.862
174 HD3 ARG 27 2HD ARG 27 -3.972 4.588 -6.094
175 HE ARG 27 HE ARG 27 -4.998 6.461 -5.242
176 HH11 ARG 27 1HH1 ARG 27 -6.436 3.605 -3.865
177 HH12 ARG 27 2HH1 ARG 27 -7.343 4.478 -2.674
178 HH21 ARG 27 1HH2 ARG 27 -6.187 7.621 -3.680
179 HH22 ARG 27 2HH2 ARG 27 -7.202 6.762 -2.571
180 H LEU 28 H LEU 28 -3.194 0.896 -7.409
181 HA LEU 28 HA LEU 28 -1.349 1.892 -5.664
182 HB2 LEU 28 1HB LEU 28 -1.554 -0.414 -5.677
183 HB3 LEU 28 2HB LEU 28 -1.350 -0.523 -7.424
184 HG LEU 28 HG LEU 28 1.028 -0.126 -7.206
185 HD11 LEU 28 1HD1 LEU 28 2.002 -0.116 -4.868
186 HD12 LEU 28 2HD1 LEU 28 0.375 0.254 -4.298
187 HD13 LEU 28 3HD1 LEU 28 1.199 1.364 -5.392
188 HD21 LEU 28 3HD2 LEU 28 -0.365 -2.371 -6.090
189 HD22 LEU 28 1HD2 LEU 28 1.158 -2.121 -5.237
190 HD23 LEU 28 2HD2 LEU 28 1.152 -2.331 -6.989
191 H ASN 29 H ASN 29 -0.698 1.148 -9.093
192 HA ASN 29 HA ASN 29 1.880 1.898 -9.364
193 HB2 ASN 29 1HB ASN 29 -0.485 2.125 -11.151
194 HB3 ASN 29 2HB ASN 29 0.966 2.998 -11.633
195 HD21 ASN 29 1HD2 ASN 29 -0.620 0.296 -12.211
196 HD22 ASN 29 2HD2 ASN 29 0.680 -0.794 -12.538
197 H ARG 30 H ARG 30 -0.872 4.155 -9.485
198 HA ARG 30 HA ARG 30 0.675 6.492 -9.758
199 HB2 ARG 30 1HB ARG 30 -1.997 6.435 -8.382
200 HB3 ARG 30 2HB ARG 30 -1.314 7.692 -9.405
201 HG2 ARG 30 1HG ARG 30 -2.405 5.023 -10.248
202 HG3 ARG 30 2HG ARG 30 -3.027 6.626 -10.644
203 HD2 ARG 30 1HD ARG 30 -0.245 5.864 -11.427
204 HD3 ARG 30 2HD ARG 30 -1.613 5.308 -12.391
205 HE ARG 30 HE ARG 30 -2.106 7.925 -12.238
206 HH11 ARG 30 1HH1 ARG 30 0.821 6.188 -12.967
207 HH12 ARG 30 2HH1 ARG 30 1.454 7.426 -14.000
208 HH21 ARG 30 1HH2 ARG 30 -1.284 9.563 -13.596
209 HH22 ARG 30 2HH2 ARG 30 0.255 9.346 -14.357
210 H HIS 31 H HIS 31 -0.548 4.776 -6.926
211 HA HIS 31 HA HIS 31 0.072 6.659 -4.966
212 HB2 HIS 31 1HB HIS 31 -1.255 4.808 -4.317
213 HB3 HIS 31 2HB HIS 31 -0.064 3.649 -4.900
214 HD1 HIS 31 HD1 HIS 31 -0.412 6.258 -2.161
215 HD2 HIS 31 HD2 HIS 31 1.607 2.719 -2.974
216 HE1 HIS 31 HE1 HIS 31 0.797 5.671 -0.036
217 H SER 32 H SER 32 2.083 4.180 -6.474
218 HA SER 32 HA SER 32 4.320 4.397 -4.808
219 HB2 SER 32 1HB SER 32 3.967 2.597 -6.497
220 HB3 SER 32 2HB SER 32 4.316 3.766 -7.770
221 HG SER 32 HG SER 32 6.327 4.040 -6.251
222 H MET 33 H MET 33 3.008 6.641 -6.967
223 HA MET 33 HA MET 33 5.515 7.985 -7.544
224 HB2 MET 33 1HB MET 33 2.745 9.026 -8.117
225 HB3 MET 33 2HB MET 33 4.251 9.456 -8.916
226 HG2 MET 33 1HG MET 33 3.241 6.649 -9.026
227 HG3 MET 33 2HG MET 33 2.572 7.881 -10.093
228 HE1 MET 33 3HE MET 33 4.635 5.218 -9.648
229 HE2 MET 33 1HE MET 33 5.783 5.219 -10.988
230 HE3 MET 33 2HE MET 33 6.250 5.894 -9.427
231 H VAL 34 H VAL 34 2.842 8.231 -5.327
232 HA VAL 34 HA VAL 34 3.260 10.896 -4.475
233 HB VAL 34 HB VAL 34 1.831 10.410 -2.629
234 HG11 VAL 34 1HG1 VAL 34 0.518 10.553 -4.542
235 HG12 VAL 34 2HG1 VAL 34 1.104 9.015 -5.178
236 HG13 VAL 34 3HG1 VAL 34 -0.007 9.038 -3.808
237 HG21 VAL 34 3HG2 VAL 34 3.089 7.870 -2.704
238 HG22 VAL 34 1HG2 VAL 34 1.989 8.515 -1.485
239 HG23 VAL 34 2HG2 VAL 34 1.351 7.616 -2.862
240 H HIS 35 H HIS 35 4.939 7.967 -3.853
241 HA HIS 35 HA HIS 35 6.058 8.679 -1.328
242 HB2 HIS 35 1HB HIS 35 6.728 6.605 -3.402
243 HB3 HIS 35 2HB HIS 35 7.758 6.850 -1.995
244 HD1 HIS 35 HD1 HIS 35 6.631 6.369 0.364
245 HD2 HIS 35 HD2 HIS 35 4.462 5.122 -2.952
246 HE1 HIS 35 HE1 HIS 35 4.910 4.765 1.252
247 H THR 36 H THR 36 6.822 9.406 -4.621
248 HA THR 36 HA THR 36 9.413 10.542 -3.820
249 HB THR 36 HB THR 36 9.492 8.955 -5.706
250 HG1 THR 36 HG1 THR 36 11.095 10.244 -6.196
251 HG21 THR 36 3HG2 THR 36 8.529 9.651 -7.885
252 HG22 THR 36 1HG2 THR 36 7.703 10.974 -7.064
253 HG23 THR 36 2HG2 THR 36 7.300 9.303 -6.668
254 H ALA 37 H ALA 37 6.243 11.326 -4.954
255 HA ALA 37 HA ALA 37 6.932 14.009 -5.778
256 HB1 ALA 37 3HB ALA 37 4.134 13.053 -5.307
257 HB2 ALA 37 1HB ALA 37 4.728 14.236 -6.473
258 HB3 ALA 37 2HB ALA 37 5.048 12.519 -6.718
259 H GLU 38 H GLU 38 7.707 13.460 -3.126
260 HA GLU 38 HA GLU 38 5.764 14.559 -1.315
261 HB2 GLU 38 1HB GLU 38 8.695 13.908 -0.988
262 HB3 GLU 38 2HB GLU 38 7.676 14.507 0.313
263 HG2 GLU 38 1HG GLU 38 6.207 12.530 -0.007
264 HG3 GLU 38 2HG GLU 38 7.370 11.914 -1.180
265 H LYS 39 H LYS 39 5.267 16.600 -2.134
266 HA LYS 39 HA LYS 39 7.430 18.590 -1.906
267 HB2 LYS 39 1HB LYS 39 5.192 18.321 -3.870
268 HB3 LYS 39 2HB LYS 39 5.766 19.930 -3.454
269 HG2 LYS 39 1HG LYS 39 8.106 18.980 -4.006
270 HG3 LYS 39 2HG LYS 39 7.207 17.713 -4.846
271 HD2 LYS 39 1HD LYS 39 5.944 19.752 -5.911
272 HD3 LYS 39 2HD LYS 39 7.405 20.629 -5.452
273 HE2 LYS 39 1HE LYS 39 7.421 18.085 -7.065
274 HE3 LYS 39 2HE LYS 39 7.397 19.694 -7.785
275 HZ1 LYS 39 3HZ LYS 39 9.465 20.136 -6.444
276 HZ2 LYS 39 1HZ LYS 39 9.637 19.035 -7.718
277 HZ3 LYS 39 2HZ LYS 39 9.526 18.476 -6.126
278 HA PRO 40 HA PRO 40 5.135 20.735 1.158
279 HB2 PRO 40 1HB PRO 40 5.638 23.330 0.539
280 HB3 PRO 40 2HB PRO 40 6.855 22.256 1.240
281 HG2 PRO 40 1HG PRO 40 6.456 23.058 -1.616
282 HG3 PRO 40 2HG PRO 40 7.964 22.918 -0.694
283 HD2 PRO 40 1HD PRO 40 7.125 21.003 -2.415
284 HD3 PRO 40 2HD PRO 40 8.054 20.629 -0.949
285 H SER 41 H SER 41 2.982 20.794 1.214
286 HA SER 41 HA SER 41 1.569 22.385 -0.825
287 HB2 SER 41 1HB SER 41 -0.332 20.779 -0.577
288 HB3 SER 41 2HB SER 41 1.121 20.047 -1.257
289 HG SER 41 HG SER 41 1.444 19.668 1.238
290 H GLY 42 H GLY 42 1.517 21.153 2.496
291 HA2 GLY 42 1HA GLY 42 0.418 23.649 3.437
292 HA3 GLY 42 2HA GLY 42 -0.700 22.299 3.561
293 HA PRO 43 HA PRO 43 1.707 22.433 7.493
294 HB2 PRO 43 1HB PRO 43 -0.432 21.898 9.077
295 HB3 PRO 43 2HB PRO 43 -0.012 23.532 8.549
296 HG2 PRO 43 1HG PRO 43 -2.065 21.653 7.446
297 HG3 PRO 43 2HG PRO 43 -2.192 23.395 7.752
298 HD2 PRO 43 1HD PRO 43 -1.744 22.379 5.282
299 HD3 PRO 43 2HD PRO 43 -1.091 23.946 5.803
300 H SER 44 H SER 44 2.312 20.714 8.836
301 HA SER 44 HA SER 44 1.031 18.134 8.550
302 HB2 SER 44 1HB SER 44 3.772 18.713 7.448
303 HB3 SER 44 2HB SER 44 3.325 17.091 7.976
304 HG SER 44 HG SER 44 1.644 18.495 6.218
305 H SER 45 H SER 45 1.302 16.873 10.318
306 HA SER 45 HA SER 45 3.107 17.901 12.407
307 HB2 SER 45 1HB SER 45 0.629 17.974 12.877
308 HB3 SER 45 2HB SER 45 0.635 16.212 12.830
309 HG SER 45 HG SER 45 0.906 16.790 14.944
310 H GLY 46 H GLY 46 4.559 16.561 13.354
311 HA2 GLY 46 1HA GLY 46 4.410 13.688 12.781
312 HA3 GLY 46 2HA GLY 46 5.854 14.559 12.289
Start of MODEL 8
1 H1 GLY 1 H GLY 1 -15.688 10.418 11.124
2 HA2 GLY 1 1HA GLY 1 -13.785 10.232 13.379
3 HA3 GLY 1 2HA GLY 1 -15.459 9.707 13.495
4 H SER 2 H SER 2 -12.563 9.136 11.496
5 HA SER 2 HA SER 2 -13.372 6.597 10.581
6 HB2 SER 2 1HB SER 2 -11.637 7.866 9.431
7 HB3 SER 2 2HB SER 2 -10.593 7.769 10.849
8 HG SER 2 HG SER 2 -9.883 6.058 9.825
9 H SER 3 H SER 3 -13.644 4.813 11.727
10 HA SER 3 HA SER 3 -12.580 4.535 14.375
11 HB2 SER 3 1HB SER 3 -14.224 2.736 12.597
12 HB3 SER 3 2HB SER 3 -13.646 2.213 14.179
13 HG SER 3 HG SER 3 -15.784 3.161 14.173
14 H GLY 4 H GLY 4 -12.272 2.453 11.486
15 HA2 GLY 4 1HA GLY 4 -10.095 1.810 10.651
16 HA3 GLY 4 2HA GLY 4 -9.486 1.924 12.296
17 H SER 5 H SER 5 -12.018 0.174 10.492
18 HA SER 5 HA SER 5 -11.657 -2.129 12.238
19 HB2 SER 5 1HB SER 5 -13.616 -1.601 9.992
20 HB3 SER 5 2HB SER 5 -13.593 -3.067 10.972
21 HG SER 5 HG SER 5 -15.019 -1.794 11.996
22 H SER 6 H SER 6 -10.542 -3.900 11.717
23 HA SER 6 HA SER 6 -9.022 -3.952 9.284
24 HB2 SER 6 1HB SER 6 -8.041 -6.008 10.185
25 HB3 SER 6 2HB SER 6 -8.080 -4.753 11.422
26 HG SER 6 HG SER 6 -10.314 -6.367 11.328
27 H GLY 7 H GLY 7 -9.651 -4.777 7.408
28 HA2 GLY 7 1HA GLY 7 -12.132 -6.145 7.114
29 HA3 GLY 7 2HA GLY 7 -10.941 -5.874 5.850
30 H THR 8 H THR 8 -10.618 -7.795 4.926
31 HA THR 8 HA THR 8 -9.551 -9.947 6.572
32 HB THR 8 HB THR 8 -12.001 -10.374 6.451
33 HG1 THR 8 HG1 THR 8 -11.505 -12.435 6.395
34 HG21 THR 8 3HG2 THR 8 -11.648 -9.642 3.752
35 HG22 THR 8 1HG2 THR 8 -13.134 -10.158 4.546
36 HG23 THR 8 2HG2 THR 8 -12.097 -11.347 3.758
37 H GLY 9 H GLY 9 -8.439 -11.583 5.342
38 HA2 GLY 9 1HA GLY 9 -6.940 -12.207 3.718
39 HA3 GLY 9 2HA GLY 9 -8.176 -11.683 2.583
40 H GLU 10 H GLU 10 -6.510 -10.989 1.156
41 HA GLU 10 HA GLU 10 -5.551 -8.306 1.806
42 HB2 GLU 10 1HB GLU 10 -3.763 -10.472 0.685
43 HB3 GLU 10 2HB GLU 10 -3.311 -8.792 0.937
44 HG2 GLU 10 1HG GLU 10 -2.428 -9.688 2.818
45 HG3 GLU 10 2HG GLU 10 -4.050 -9.339 3.414
46 H LYS 11 H LYS 11 -4.416 -7.390 -0.278
47 HA LYS 11 HA LYS 11 -6.335 -7.778 -2.445
48 HB2 LYS 11 1HB LYS 11 -4.511 -5.585 -1.599
49 HB3 LYS 11 2HB LYS 11 -4.879 -5.713 -3.314
50 HG2 LYS 11 1HG LYS 11 -6.414 -4.180 -2.326
51 HG3 LYS 11 2HG LYS 11 -7.296 -5.652 -2.741
52 HD2 LYS 11 1HD LYS 11 -6.648 -6.287 -0.246
53 HD3 LYS 11 2HD LYS 11 -6.603 -4.531 -0.077
54 HE2 LYS 11 1HE LYS 11 -8.936 -5.952 -1.326
55 HE3 LYS 11 2HE LYS 11 -8.815 -5.714 0.416
56 HZ1 LYS 11 3HZ LYS 11 -8.537 -3.433 -1.433
57 HZ2 LYS 11 1HZ LYS 11 -8.984 -3.430 0.199
58 HZ3 LYS 11 2HZ LYS 11 -10.069 -3.985 -0.974
59 HA PRO 12 HA PRO 12 -3.582 -9.869 -5.149
60 HB2 PRO 12 1HB PRO 12 -4.271 -8.822 -7.557
61 HB3 PRO 12 2HB PRO 12 -5.304 -9.947 -6.667
62 HG2 PRO 12 1HG PRO 12 -5.461 -6.962 -6.840
63 HG3 PRO 12 2HG PRO 12 -6.769 -8.158 -6.912
64 HD2 PRO 12 1HD PRO 12 -6.201 -6.754 -4.667
65 HD3 PRO 12 2HD PRO 12 -6.833 -8.412 -4.622
66 H PHE 13 H PHE 13 -3.150 -6.715 -4.356
67 HA PHE 13 HA PHE 13 -0.613 -6.594 -5.815
68 HB2 PHE 13 1HB PHE 13 -2.567 -4.293 -5.611
69 HB3 PHE 13 2HB PHE 13 -0.950 -4.202 -6.300
70 HD1 PHE 13 HD1 PHE 13 -0.449 -5.242 -8.444
71 HD2 PHE 13 HD2 PHE 13 -4.380 -5.306 -6.811
72 HE1 PHE 13 HE1 PHE 13 -1.349 -5.876 -10.644
73 HE2 PHE 13 HE2 PHE 13 -5.286 -5.942 -9.008
74 HZ PHE 13 HZ PHE 13 -3.770 -6.229 -10.928
75 H LYS 14 H LYS 14 0.874 -4.941 -4.886
76 HA LYS 14 HA LYS 14 0.344 -4.034 -2.200
77 HB2 LYS 14 1HB LYS 14 0.977 -6.366 -1.788
78 HB3 LYS 14 2HB LYS 14 2.466 -6.131 -2.695
79 HG2 LYS 14 1HG LYS 14 2.922 -4.255 -0.961
80 HG3 LYS 14 2HG LYS 14 1.714 -5.105 0.005
81 HD2 LYS 14 1HD LYS 14 3.020 -7.159 -0.148
82 HD3 LYS 14 2HD LYS 14 4.216 -6.335 -1.152
83 HE2 LYS 14 1HE LYS 14 4.860 -4.914 0.646
84 HE3 LYS 14 2HE LYS 14 3.498 -5.442 1.633
85 HZ1 LYS 14 3HZ LYS 14 4.597 -7.250 2.308
86 HZ2 LYS 14 1HZ LYS 14 5.991 -6.450 1.779
87 HZ3 LYS 14 2HZ LYS 14 5.231 -7.580 0.775
88 H CYS 15 H CYS 15 1.883 -2.533 -1.441
89 HA CYS 15 HA CYS 15 3.303 -1.174 -3.550
90 HB2 CYS 15 1HB CYS 15 1.988 -0.129 -1.566
91 HB3 CYS 15 2HB CYS 15 3.458 -0.428 -0.644
92 H ASP 16 H ASP 16 5.558 -0.275 -2.939
93 HA ASP 16 HA ASP 16 7.188 -2.517 -1.939
94 HB2 ASP 16 1HB ASP 16 7.523 -0.694 -4.274
95 HB3 ASP 16 2HB ASP 16 8.975 -1.236 -3.437
96 H ILE 17 H ILE 17 6.435 0.825 -1.671
97 HA ILE 17 HA ILE 17 8.823 1.447 -0.131
98 HB ILE 17 HB ILE 17 6.448 3.254 -0.520
99 HG12 ILE 17 1HG1 ILE 17 8.130 4.157 -2.390
100 HG13 ILE 17 2HG1 ILE 17 8.581 2.456 -2.438
101 HG21 ILE 17 1HG2 ILE 17 8.104 3.903 1.167
102 HG22 ILE 17 2HG2 ILE 17 9.371 3.827 -0.057
103 HG23 ILE 17 3HG2 ILE 17 8.084 5.024 -0.194
104 HD11 ILE 17 3HD1 ILE 17 5.695 3.108 -2.539
105 HD12 ILE 17 1HD1 ILE 17 6.671 3.462 -3.964
106 HD13 ILE 17 2HD1 ILE 17 6.598 1.817 -3.331
107 H CYS 18 H CYS 18 5.304 1.332 0.382
108 HA CYS 18 HA CYS 18 5.828 1.099 3.273
109 HB2 CYS 18 1HB CYS 18 3.635 2.136 3.659
110 HB3 CYS 18 2HB CYS 18 4.690 3.200 2.734
111 H GLY 19 H GLY 19 4.883 -0.572 0.594
112 HA2 GLY 19 1HA GLY 19 4.080 -2.732 0.412
113 HA3 GLY 19 2HA GLY 19 3.873 -2.759 2.157
114 H LYS 20 H LYS 20 2.398 -0.045 0.879
115 HA LYS 20 HA LYS 20 -0.167 -0.699 1.653
116 HB2 LYS 20 1HB LYS 20 1.026 1.345 -0.132
117 HB3 LYS 20 2HB LYS 20 -0.703 1.071 -0.309
118 HG2 LYS 20 1HG LYS 20 0.574 1.615 2.353
119 HG3 LYS 20 2HG LYS 20 0.012 2.903 1.285
120 HD2 LYS 20 1HD LYS 20 -2.195 2.381 1.592
121 HD3 LYS 20 2HD LYS 20 -1.860 0.675 1.901
122 HE2 LYS 20 1HE LYS 20 -2.546 1.553 3.970
123 HE3 LYS 20 2HE LYS 20 -0.789 1.441 4.076
124 HZ1 LYS 20 3HZ LYS 20 -0.762 3.843 3.382
125 HZ2 LYS 20 1HZ LYS 20 -1.374 3.537 4.929
126 HZ3 LYS 20 2HZ LYS 20 -2.432 3.868 3.651
127 H SER 21 H SER 21 -1.858 -1.758 0.780
128 HA SER 21 HA SER 21 -1.386 -3.164 -1.744
129 HB2 SER 21 1HB SER 21 -2.771 -4.838 -0.983
130 HB3 SER 21 2HB SER 21 -2.192 -4.213 0.561
131 HG SER 21 HG SER 21 -4.498 -4.468 0.448
132 H PHE 22 H PHE 22 -3.138 -3.368 -3.294
133 HA PHE 22 HA PHE 22 -5.281 -1.422 -3.172
134 HB2 PHE 22 1HB PHE 22 -3.241 -1.300 -5.403
135 HB3 PHE 22 2HB PHE 22 -4.685 -0.304 -5.255
136 HD1 PHE 22 HD1 PHE 22 -1.547 -1.150 -3.440
137 HD2 PHE 22 HD2 PHE 22 -4.535 1.770 -4.255
138 HE1 PHE 22 HE1 PHE 22 -0.257 0.518 -2.172
139 HE2 PHE 22 HE2 PHE 22 -3.250 3.443 -2.989
140 HZ PHE 22 HZ PHE 22 -1.108 2.818 -1.946
141 H CYS 23 H CYS 23 -6.998 -2.572 -3.731
142 HA CYS 23 HA CYS 23 -7.127 -5.038 -4.858
143 HB2 CYS 23 1HB CYS 23 -9.442 -4.468 -5.580
144 HB3 CYS 23 2HB CYS 23 -9.092 -3.991 -3.923
145 HG CYS 23 HG CYS 23 -9.069 -1.338 -4.312
146 H GLY 24 H GLY 24 -6.596 -2.015 -6.506
147 HA2 GLY 24 1HA GLY 24 -6.265 -3.523 -9.017
148 HA3 GLY 24 2HA GLY 24 -7.161 -2.011 -9.002
149 H ARG 25 H ARG 25 -4.350 -3.225 -9.931
150 HA ARG 25 HA ARG 25 -2.306 -1.712 -8.865
151 HB2 ARG 25 1HB ARG 25 -2.200 -3.564 -10.636
152 HB3 ARG 25 2HB ARG 25 -2.509 -2.294 -11.813
153 HG2 ARG 25 1HG ARG 25 -0.250 -2.282 -11.889
154 HG3 ARG 25 2HG ARG 25 -0.466 -1.164 -10.540
155 HD2 ARG 25 1HD ARG 25 -0.130 -2.971 -8.956
156 HD3 ARG 25 2HD ARG 25 -0.007 -4.133 -10.276
157 HE ARG 25 HE ARG 25 1.913 -1.967 -10.338
158 HH11 ARG 25 1HH1 ARG 25 1.221 -5.230 -9.344
159 HH12 ARG 25 2HH1 ARG 25 2.888 -5.685 -9.218
160 HH21 ARG 25 1HH2 ARG 25 4.112 -2.552 -10.176
161 HH22 ARG 25 2HH2 ARG 25 4.532 -4.160 -9.690
162 H SER 26 H SER 26 -4.490 -0.857 -11.531
163 HA SER 26 HA SER 26 -3.542 1.445 -12.500
164 HB2 SER 26 1HB SER 26 -5.807 2.217 -12.856
165 HB3 SER 26 2HB SER 26 -5.780 0.463 -13.036
166 HG SER 26 HG SER 26 -6.732 0.247 -11.057
167 H ARG 27 H ARG 27 -4.754 0.996 -9.254
168 HA ARG 27 HA ARG 27 -4.571 3.835 -8.649
169 HB2 ARG 27 1HB ARG 27 -6.296 2.040 -7.740
170 HB3 ARG 27 2HB ARG 27 -5.037 1.776 -6.541
171 HG2 ARG 27 1HG ARG 27 -6.365 4.412 -7.137
172 HG3 ARG 27 2HG ARG 27 -6.717 3.363 -5.762
173 HD2 ARG 27 1HD ARG 27 -4.097 3.593 -5.406
174 HD3 ARG 27 2HD ARG 27 -4.363 5.098 -6.286
175 HE ARG 27 HE ARG 27 -6.177 4.683 -4.089
176 HH11 ARG 27 1HH1 ARG 27 -3.082 5.942 -5.067
177 HH12 ARG 27 2HH1 ARG 27 -2.964 7.045 -3.736
178 HH21 ARG 27 1HH2 ARG 27 -6.034 6.131 -2.333
179 HH22 ARG 27 2HH2 ARG 27 -4.643 7.151 -2.181
180 H LEU 28 H LEU 28 -3.137 0.821 -7.390
181 HA LEU 28 HA LEU 28 -1.311 1.857 -5.632
182 HB2 LEU 28 1HB LEU 28 -1.449 -0.453 -5.664
183 HB3 LEU 28 2HB LEU 28 -1.268 -0.540 -7.415
184 HG LEU 28 HG LEU 28 1.101 -0.077 -7.226
185 HD11 LEU 28 1HD1 LEU 28 1.227 1.403 -5.387
186 HD12 LEU 28 2HD1 LEU 28 2.123 -0.043 -4.922
187 HD13 LEU 28 3HD1 LEU 28 0.496 0.226 -4.296
188 HD21 LEU 28 3HD2 LEU 28 -0.206 -2.361 -6.020
189 HD22 LEU 28 1HD2 LEU 28 1.396 -2.083 -5.335
190 HD23 LEU 28 2HD2 LEU 28 1.206 -2.295 -7.076
191 H ASN 29 H ASN 29 -0.697 1.183 -9.081
192 HA ASN 29 HA ASN 29 1.860 1.998 -9.380
193 HB2 ASN 29 1HB ASN 29 -0.539 2.196 -11.125
194 HB3 ASN 29 2HB ASN 29 0.883 3.112 -11.615
195 HD21 ASN 29 1HD2 ASN 29 -0.649 0.374 -12.197
196 HD22 ASN 29 2HD2 ASN 29 0.673 -0.675 -12.569
197 H ARG 30 H ARG 30 -0.944 4.196 -9.452
198 HA ARG 30 HA ARG 30 0.545 6.570 -9.696
199 HB2 ARG 30 1HB ARG 30 -2.136 6.352 -8.336
200 HB3 ARG 30 2HB ARG 30 -1.476 7.725 -9.213
201 HG2 ARG 30 1HG ARG 30 -2.500 5.132 -10.322
202 HG3 ARG 30 2HG ARG 30 -3.093 6.766 -10.624
203 HD2 ARG 30 1HD ARG 30 -1.148 7.319 -11.887
204 HD3 ARG 30 2HD ARG 30 -0.341 5.827 -11.404
205 HE ARG 30 HE ARG 30 -2.501 4.891 -12.674
206 HH11 ARG 30 1HH1 ARG 30 -0.189 7.343 -13.547
207 HH12 ARG 30 2HH1 ARG 30 -0.340 7.064 -15.251
208 HH21 ARG 30 1HH2 ARG 30 -2.709 4.514 -14.914
209 HH22 ARG 30 2HH2 ARG 30 -1.775 5.455 -16.027
210 H HIS 31 H HIS 31 -0.591 4.771 -6.882
211 HA HIS 31 HA HIS 31 0.013 6.650 -4.902
212 HB2 HIS 31 1HB HIS 31 -1.287 4.792 -4.245
213 HB3 HIS 31 2HB HIS 31 -0.116 3.641 -4.881
214 HD1 HIS 31 HD1 HIS 31 -0.417 6.174 -2.069
215 HD2 HIS 31 HD2 HIS 31 1.630 2.688 -3.029
216 HE1 HIS 31 HE1 HIS 31 0.851 5.544 0.010
217 H SER 32 H SER 32 2.029 4.189 -6.439
218 HA SER 32 HA SER 32 4.281 4.429 -4.794
219 HB2 SER 32 1HB SER 32 3.915 2.622 -6.480
220 HB3 SER 32 2HB SER 32 4.264 3.790 -7.754
221 HG SER 32 HG SER 32 6.060 2.414 -6.937
222 H MET 33 H MET 33 2.938 6.642 -6.975
223 HA MET 33 HA MET 33 5.425 8.005 -7.576
224 HB2 MET 33 1HB MET 33 2.640 9.023 -8.118
225 HB3 MET 33 2HB MET 33 4.133 9.464 -8.936
226 HG2 MET 33 1HG MET 33 3.137 6.650 -9.027
227 HG3 MET 33 2HG MET 33 2.461 7.877 -10.096
228 HE1 MET 33 3HE MET 33 6.196 5.953 -9.437
229 HE2 MET 33 1HE MET 33 4.583 5.253 -9.572
230 HE3 MET 33 2HE MET 33 5.679 5.214 -10.953
231 H VAL 34 H VAL 34 2.812 8.215 -5.299
232 HA VAL 34 HA VAL 34 3.226 10.898 -4.470
233 HB VAL 34 HB VAL 34 1.799 10.429 -2.626
234 HG11 VAL 34 1HG1 VAL 34 0.469 10.530 -4.525
235 HG12 VAL 34 2HG1 VAL 34 1.076 8.997 -5.154
236 HG13 VAL 34 3HG1 VAL 34 -0.030 9.012 -3.780
237 HG21 VAL 34 3HG2 VAL 34 1.987 8.556 -1.448
238 HG22 VAL 34 1HG2 VAL 34 1.328 7.635 -2.800
239 HG23 VAL 34 2HG2 VAL 34 3.068 7.889 -2.671
240 H HIS 35 H HIS 35 4.898 7.963 -3.855
241 HA HIS 35 HA HIS 35 6.039 8.674 -1.340
242 HB2 HIS 35 1HB HIS 35 6.663 6.589 -3.413
243 HB3 HIS 35 2HB HIS 35 7.735 6.841 -2.039
244 HD1 HIS 35 HD1 HIS 35 6.638 6.427 0.364
245 HD2 HIS 35 HD2 HIS 35 4.446 5.070 -2.894
246 HE1 HIS 35 HE1 HIS 35 4.949 4.823 1.311
247 H THR 36 H THR 36 6.751 9.442 -4.625
248 HA THR 36 HA THR 36 9.358 10.564 -3.844
249 HB THR 36 HB THR 36 9.352 8.933 -5.742
250 HG1 THR 36 HG1 THR 36 10.408 10.650 -7.216
251 HG21 THR 36 3HG2 THR 36 7.483 10.973 -6.850
252 HG22 THR 36 1HG2 THR 36 7.446 9.216 -6.992
253 HG23 THR 36 2HG2 THR 36 8.587 10.154 -7.954
254 H ALA 37 H ALA 37 6.726 11.788 -3.338
255 HA ALA 37 HA ALA 37 6.841 14.137 -5.098
256 HB1 ALA 37 3HB ALA 37 4.649 13.362 -5.081
257 HB2 ALA 37 1HB ALA 37 4.690 12.989 -3.358
258 HB3 ALA 37 2HB ALA 37 4.625 14.667 -3.896
259 H GLU 38 H GLU 38 8.906 14.552 -3.782
260 HA GLU 38 HA GLU 38 8.189 16.362 -1.590
261 HB2 GLU 38 1HB GLU 38 10.197 14.132 -1.495
262 HB3 GLU 38 2HB GLU 38 10.402 15.561 -0.492
263 HG2 GLU 38 1HG GLU 38 7.861 13.973 -0.471
264 HG3 GLU 38 2HG GLU 38 9.241 13.539 0.535
265 H LYS 39 H LYS 39 9.768 18.023 -1.180
266 HA LYS 39 HA LYS 39 10.756 19.245 -3.478
267 HB2 LYS 39 1HB LYS 39 10.306 20.186 -1.080
268 HB3 LYS 39 2HB LYS 39 11.992 19.772 -0.797
269 HG2 LYS 39 1HG LYS 39 12.676 21.214 -2.627
270 HG3 LYS 39 2HG LYS 39 10.988 21.596 -2.974
271 HD2 LYS 39 1HD LYS 39 11.594 23.409 -1.695
272 HD3 LYS 39 2HD LYS 39 10.956 22.326 -0.456
273 HE2 LYS 39 1HE LYS 39 13.283 21.537 -0.046
274 HE3 LYS 39 2HE LYS 39 13.852 22.769 -1.172
275 HZ1 LYS 39 3HZ LYS 39 12.144 23.951 0.732
276 HZ2 LYS 39 1HZ LYS 39 13.782 24.262 0.441
277 HZ3 LYS 39 2HZ LYS 39 13.333 23.059 1.541
278 HA PRO 40 HA PRO 40 14.502 17.066 -4.303
279 HB2 PRO 40 1HB PRO 40 15.684 18.920 -5.895
280 HB3 PRO 40 2HB PRO 40 14.337 17.911 -6.434
281 HG2 PRO 40 1HG PRO 40 14.311 20.738 -5.452
282 HG3 PRO 40 2HG PRO 40 13.442 20.022 -6.821
283 HD2 PRO 40 1HD PRO 40 12.259 20.494 -4.432
284 HD3 PRO 40 2HD PRO 40 11.796 19.134 -5.474
285 H SER 41 H SER 41 15.425 17.080 -2.211
286 HA SER 41 HA SER 41 17.838 18.508 -1.966
287 HB2 SER 41 1HB SER 41 17.409 20.118 -0.319
288 HB3 SER 41 2HB SER 41 16.022 20.276 -1.396
289 HG SER 41 HG SER 41 15.776 20.025 1.070
290 H GLY 42 H GLY 42 18.912 18.099 0.157
291 HA2 GLY 42 1HA GLY 42 18.917 16.858 2.242
292 HA3 GLY 42 2HA GLY 42 17.798 15.722 1.504
293 HA PRO 43 HA PRO 43 22.305 14.298 1.165
294 HB2 PRO 43 1HB PRO 43 22.149 12.216 2.900
295 HB3 PRO 43 2HB PRO 43 22.609 13.848 3.398
296 HG2 PRO 43 1HG PRO 43 19.957 12.478 3.617
297 HG3 PRO 43 2HG PRO 43 20.795 13.490 4.807
298 HD2 PRO 43 1HD PRO 43 18.783 14.427 3.257
299 HD3 PRO 43 2HD PRO 43 20.130 15.451 3.794
300 H SER 44 H SER 44 22.950 12.524 -0.046
301 HA SER 44 HA SER 44 21.074 11.349 -1.745
302 HB2 SER 44 1HB SER 44 23.315 11.456 -2.511
303 HB3 SER 44 2HB SER 44 23.927 10.625 -1.081
304 HG SER 44 HG SER 44 23.517 8.782 -2.000
305 H SER 45 H SER 45 22.731 9.995 1.090
306 HA SER 45 HA SER 45 21.954 7.415 1.110
307 HB2 SER 45 1HB SER 45 23.222 8.657 2.925
308 HB3 SER 45 2HB SER 45 21.654 9.140 3.572
309 HG SER 45 HG SER 45 22.530 6.467 3.177
310 H GLY 46 H GLY 46 20.121 6.278 1.108
311 HA2 GLY 46 1HA GLY 46 17.632 7.317 0.613
312 HA3 GLY 46 2HA GLY 46 17.896 5.740 1.342
Start of MODEL 9
1 H1 GLY 1 H GLY 1 6.840 -14.492 9.071
2 HA2 GLY 1 1HA GLY 1 6.829 -14.448 6.492
3 HA3 GLY 1 2HA GLY 1 5.210 -13.804 6.719
4 H SER 2 H SER 2 7.372 -12.503 5.376
5 HA SER 2 HA SER 2 8.823 -10.667 6.813
6 HB2 SER 2 1HB SER 2 9.194 -10.807 4.466
7 HB3 SER 2 2HB SER 2 7.510 -10.426 4.105
8 HG SER 2 HG SER 2 8.081 -8.416 4.082
9 H SER 3 H SER 3 5.497 -10.300 5.614
10 HA SER 3 HA SER 3 5.192 -7.772 6.998
11 HB2 SER 3 1HB SER 3 3.425 -9.414 5.200
12 HB3 SER 3 2HB SER 3 2.769 -8.058 6.118
13 HG SER 3 HG SER 3 4.336 -8.056 3.883
14 H GLY 4 H GLY 4 5.538 -8.560 9.159
15 HA2 GLY 4 1HA GLY 4 4.864 -9.354 11.207
16 HA3 GLY 4 2HA GLY 4 3.256 -8.893 10.669
17 H SER 5 H SER 5 1.980 -10.529 11.281
18 HA SER 5 HA SER 5 2.645 -13.206 10.265
19 HB2 SER 5 1HB SER 5 3.089 -12.951 12.762
20 HB3 SER 5 2HB SER 5 1.347 -12.764 12.956
21 HG SER 5 HG SER 5 1.207 -14.836 11.800
22 H SER 6 H SER 6 0.075 -11.197 11.688
23 HA SER 6 HA SER 6 -2.087 -12.748 10.798
24 HB2 SER 6 1HB SER 6 -1.755 -9.927 11.724
25 HB3 SER 6 2HB SER 6 -3.273 -10.384 10.952
26 HG SER 6 HG SER 6 -3.787 -11.550 12.639
27 H GLY 7 H GLY 7 -2.548 -13.238 8.760
28 HA2 GLY 7 1HA GLY 7 -2.995 -11.185 6.814
29 HA3 GLY 7 2HA GLY 7 -1.543 -12.112 6.468
30 H THR 8 H THR 8 -5.019 -12.171 6.640
31 HA THR 8 HA THR 8 -5.015 -14.848 5.409
32 HB THR 8 HB THR 8 -7.414 -14.973 6.117
33 HG1 THR 8 HG1 THR 8 -7.716 -13.363 8.005
34 HG21 THR 8 3HG2 THR 8 -5.104 -14.873 7.973
35 HG22 THR 8 1HG2 THR 8 -6.185 -16.210 7.582
36 HG23 THR 8 2HG2 THR 8 -6.710 -14.948 8.697
37 H GLY 9 H GLY 9 -6.509 -11.632 5.275
38 HA2 GLY 9 1HA GLY 9 -7.292 -12.228 2.487
39 HA3 GLY 9 2HA GLY 9 -8.238 -11.200 3.554
40 H GLU 10 H GLU 10 -5.883 -11.272 1.165
41 HA GLU 10 HA GLU 10 -5.240 -8.445 1.673
42 HB2 GLU 10 1HB GLU 10 -3.418 -10.715 1.020
43 HB3 GLU 10 2HB GLU 10 -3.046 -9.131 0.354
44 HG2 GLU 10 1HG GLU 10 -1.831 -9.212 2.328
45 HG3 GLU 10 2HG GLU 10 -3.261 -8.271 2.749
46 H LYS 11 H LYS 11 -4.414 -7.352 -0.364
47 HA LYS 11 HA LYS 11 -6.296 -7.916 -2.495
48 HB2 LYS 11 1HB LYS 11 -4.535 -5.641 -1.741
49 HB3 LYS 11 2HB LYS 11 -4.958 -5.804 -3.440
50 HG2 LYS 11 1HG LYS 11 -6.513 -4.319 -2.395
51 HG3 LYS 11 2HG LYS 11 -7.350 -5.822 -2.793
52 HD2 LYS 11 1HD LYS 11 -6.130 -5.587 -0.094
53 HD3 LYS 11 2HD LYS 11 -7.594 -4.655 -0.420
54 HE2 LYS 11 1HE LYS 11 -7.270 -7.633 -0.774
55 HE3 LYS 11 2HE LYS 11 -8.122 -6.836 0.547
56 HZ1 LYS 11 3HZ LYS 11 -9.134 -5.881 -1.890
57 HZ2 LYS 11 1HZ LYS 11 -9.935 -6.773 -0.695
58 HZ3 LYS 11 2HZ LYS 11 -9.127 -7.572 -1.948
59 HA PRO 12 HA PRO 12 -3.580 -9.861 -5.339
60 HB2 PRO 12 1HB PRO 12 -4.271 -8.716 -7.701
61 HB3 PRO 12 2HB PRO 12 -5.310 -9.866 -6.851
62 HG2 PRO 12 1HG PRO 12 -5.443 -6.876 -6.907
63 HG3 PRO 12 2HG PRO 12 -6.761 -8.056 -7.019
64 HD2 PRO 12 1HD PRO 12 -6.172 -6.745 -4.725
65 HD3 PRO 12 2HD PRO 12 -6.817 -8.399 -4.741
66 H PHE 13 H PHE 13 -3.112 -6.752 -4.417
67 HA PHE 13 HA PHE 13 -0.570 -6.603 -5.857
68 HB2 PHE 13 1HB PHE 13 -2.524 -4.302 -5.654
69 HB3 PHE 13 2HB PHE 13 -0.891 -4.197 -6.304
70 HD1 PHE 13 HD1 PHE 13 -0.335 -5.256 -8.440
71 HD2 PHE 13 HD2 PHE 13 -4.313 -5.239 -6.925
72 HE1 PHE 13 HE1 PHE 13 -1.183 -5.854 -10.671
73 HE2 PHE 13 HE2 PHE 13 -5.167 -5.838 -9.153
74 HZ PHE 13 HZ PHE 13 -3.602 -6.147 -11.030
75 H LYS 14 H LYS 14 0.843 -4.835 -4.901
76 HA LYS 14 HA LYS 14 0.298 -3.993 -2.216
77 HB2 LYS 14 1HB LYS 14 0.890 -6.336 -1.795
78 HB3 LYS 14 2HB LYS 14 2.404 -6.118 -2.663
79 HG2 LYS 14 1HG LYS 14 2.820 -4.241 -0.907
80 HG3 LYS 14 2HG LYS 14 1.599 -5.110 0.025
81 HD2 LYS 14 1HD LYS 14 2.936 -7.173 -0.206
82 HD3 LYS 14 2HD LYS 14 4.173 -6.251 -1.064
83 HE2 LYS 14 1HE LYS 14 4.362 -4.786 0.952
84 HE3 LYS 14 2HE LYS 14 3.274 -5.892 1.791
85 HZ1 LYS 14 3HZ LYS 14 5.522 -6.455 2.322
86 HZ2 LYS 14 1HZ LYS 14 5.954 -6.534 0.688
87 HZ3 LYS 14 2HZ LYS 14 4.894 -7.680 1.338
88 H CYS 15 H CYS 15 1.802 -2.482 -1.444
89 HA CYS 15 HA CYS 15 3.296 -1.148 -3.509
90 HB2 CYS 15 1HB CYS 15 1.958 -0.128 -1.500
91 HB3 CYS 15 2HB CYS 15 3.454 -0.396 -0.611
92 H ASP 16 H ASP 16 5.544 -0.244 -2.762
93 HA ASP 16 HA ASP 16 7.130 -2.518 -1.759
94 HB2 ASP 16 1HB ASP 16 7.506 -0.750 -4.122
95 HB3 ASP 16 2HB ASP 16 8.952 -1.238 -3.242
96 H ILE 17 H ILE 17 6.409 0.832 -1.530
97 HA ILE 17 HA ILE 17 8.776 1.428 0.058
98 HB ILE 17 HB ILE 17 6.451 3.272 -0.468
99 HG12 ILE 17 1HG1 ILE 17 8.287 4.129 -2.225
100 HG13 ILE 17 2HG1 ILE 17 8.680 2.413 -2.238
101 HG21 ILE 17 1HG2 ILE 17 8.025 3.895 1.323
102 HG22 ILE 17 2HG2 ILE 17 9.345 3.838 0.156
103 HG23 ILE 17 3HG2 ILE 17 8.057 5.027 -0.028
104 HD11 ILE 17 3HD1 ILE 17 6.967 1.990 -3.565
105 HD12 ILE 17 1HD1 ILE 17 5.848 2.759 -2.441
106 HD13 ILE 17 2HD1 ILE 17 6.669 3.725 -3.668
107 H CYS 18 H CYS 18 5.248 1.331 0.460
108 HA CYS 18 HA CYS 18 5.675 1.181 3.373
109 HB2 CYS 18 1HB CYS 18 3.466 2.226 3.655
110 HB3 CYS 18 2HB CYS 18 4.560 3.269 2.752
111 H GLY 19 H GLY 19 4.802 -0.548 0.701
112 HA2 GLY 19 1HA GLY 19 3.992 -2.705 0.537
113 HA3 GLY 19 2HA GLY 19 3.756 -2.704 2.279
114 H LYS 20 H LYS 20 2.306 -0.010 0.932
115 HA LYS 20 HA LYS 20 -0.275 -0.662 1.667
116 HB2 LYS 20 1HB LYS 20 0.946 1.373 -0.113
117 HB3 LYS 20 2HB LYS 20 -0.783 1.104 -0.296
118 HG2 LYS 20 1HG LYS 20 0.507 1.682 2.355
119 HG3 LYS 20 2HG LYS 20 -0.107 2.942 1.283
120 HD2 LYS 20 1HD LYS 20 -2.286 2.394 1.664
121 HD3 LYS 20 2HD LYS 20 -1.925 0.685 1.918
122 HE2 LYS 20 1HE LYS 20 -1.165 2.847 3.871
123 HE3 LYS 20 2HE LYS 20 -2.687 1.961 3.955
124 HZ1 LYS 20 3HZ LYS 20 -1.219 -0.105 3.960
125 HZ2 LYS 20 1HZ LYS 20 -1.269 0.817 5.377
126 HZ3 LYS 20 2HZ LYS 20 0.058 0.939 4.336
127 H SER 21 H SER 21 -1.962 -1.700 0.750
128 HA SER 21 HA SER 21 -1.433 -3.125 -1.753
129 HB2 SER 21 1HB SER 21 -2.887 -4.776 -1.035
130 HB3 SER 21 2HB SER 21 -2.269 -4.193 0.510
131 HG SER 21 HG SER 21 -4.794 -4.127 -0.466
132 H PHE 22 H PHE 22 -3.242 -3.392 -3.283
133 HA PHE 22 HA PHE 22 -5.335 -1.400 -3.237
134 HB2 PHE 22 1HB PHE 22 -3.245 -1.341 -5.424
135 HB3 PHE 22 2HB PHE 22 -4.701 -0.355 -5.361
136 HD1 PHE 22 HD1 PHE 22 -1.606 -1.100 -3.436
137 HD2 PHE 22 HD2 PHE 22 -4.621 1.746 -4.402
138 HE1 PHE 22 HE1 PHE 22 -0.376 0.624 -2.182
139 HE2 PHE 22 HE2 PHE 22 -3.396 3.474 -3.151
140 HZ PHE 22 HZ PHE 22 -1.270 2.914 -2.040
141 H CYS 23 H CYS 23 -7.048 -2.580 -3.754
142 HA CYS 23 HA CYS 23 -7.152 -5.054 -4.891
143 HB2 CYS 23 1HB CYS 23 -9.499 -4.556 -5.497
144 HB3 CYS 23 2HB CYS 23 -9.100 -4.019 -3.870
145 HG CYS 23 HG CYS 23 -10.843 -2.210 -5.260
146 H GLY 24 H GLY 24 -6.546 -2.055 -6.483
147 HA2 GLY 24 1HA GLY 24 -6.310 -3.502 -9.029
148 HA3 GLY 24 2HA GLY 24 -7.263 -2.026 -8.981
149 H ARG 25 H ARG 25 -4.267 -3.280 -9.637
150 HA ARG 25 HA ARG 25 -2.336 -1.640 -8.705
151 HB2 ARG 25 1HB ARG 25 -2.206 -3.491 -10.501
152 HB3 ARG 25 2HB ARG 25 -2.484 -2.195 -11.656
153 HG2 ARG 25 1HG ARG 25 -0.213 -2.233 -11.664
154 HG3 ARG 25 2HG ARG 25 -0.479 -1.078 -10.357
155 HD2 ARG 25 1HD ARG 25 -0.389 -3.074 -8.785
156 HD3 ARG 25 2HD ARG 25 0.229 -3.993 -10.157
157 HE ARG 25 HE ARG 25 1.656 -1.548 -9.549
158 HH11 ARG 25 1HH1 ARG 25 1.429 -4.991 -9.083
159 HH12 ARG 25 2HH1 ARG 25 3.091 -5.170 -8.625
160 HH21 ARG 25 1HH2 ARG 25 3.845 -1.771 -8.948
161 HH22 ARG 25 2HH2 ARG 25 4.464 -3.338 -8.547
162 H SER 26 H SER 26 -4.652 -0.839 -11.255
163 HA SER 26 HA SER 26 -3.813 1.446 -12.337
164 HB2 SER 26 1HB SER 26 -6.118 0.413 -12.564
165 HB3 SER 26 2HB SER 26 -6.570 1.298 -11.108
166 HG SER 26 HG SER 26 -6.838 2.241 -13.410
167 H ARG 27 H ARG 27 -4.887 1.117 -9.002
168 HA ARG 27 HA ARG 27 -4.540 3.950 -8.479
169 HB2 ARG 27 1HB ARG 27 -5.497 1.599 -6.889
170 HB3 ARG 27 2HB ARG 27 -4.995 3.063 -6.054
171 HG2 ARG 27 1HG ARG 27 -7.083 2.996 -8.219
172 HG3 ARG 27 2HG ARG 27 -7.438 2.906 -6.493
173 HD2 ARG 27 1HD ARG 27 -6.091 5.079 -6.302
174 HD3 ARG 27 2HD ARG 27 -6.262 5.184 -8.054
175 HE ARG 27 HE ARG 27 -8.323 5.597 -6.072
176 HH11 ARG 27 1HH1 ARG 27 -7.599 4.924 -9.411
177 HH12 ARG 27 2HH1 ARG 27 -9.125 5.501 -9.993
178 HH21 ARG 27 1HH2 ARG 27 -10.336 6.360 -6.828
179 HH22 ARG 27 2HH2 ARG 27 -10.681 6.318 -8.523
180 H LEU 28 H LEU 28 -3.125 0.919 -7.241
181 HA LEU 28 HA LEU 28 -1.175 1.911 -5.606
182 HB2 LEU 28 1HB LEU 28 -1.431 -0.412 -5.675
183 HB3 LEU 28 2HB LEU 28 -1.212 -0.473 -7.423
184 HG LEU 28 HG LEU 28 1.151 -0.099 -7.195
185 HD11 LEU 28 1HD1 LEU 28 2.190 0.056 -4.948
186 HD12 LEU 28 2HD1 LEU 28 0.577 0.227 -4.255
187 HD13 LEU 28 3HD1 LEU 28 1.194 1.452 -5.363
188 HD21 LEU 28 3HD2 LEU 28 -0.220 -2.313 -5.931
189 HD22 LEU 28 1HD2 LEU 28 1.381 -2.051 -5.239
190 HD23 LEU 28 2HD2 LEU 28 1.203 -2.313 -6.974
191 H ASN 29 H ASN 29 -0.715 1.161 -9.066
192 HA ASN 29 HA ASN 29 1.821 1.949 -9.502
193 HB2 ASN 29 1HB ASN 29 -0.654 2.130 -11.128
194 HB3 ASN 29 2HB ASN 29 0.726 3.067 -11.695
195 HD21 ASN 29 1HD2 ASN 29 -0.794 0.263 -12.111
196 HD22 ASN 29 2HD2 ASN 29 0.524 -0.751 -12.579
197 H ARG 30 H ARG 30 -0.947 4.194 -9.491
198 HA ARG 30 HA ARG 30 0.607 6.532 -9.795
199 HB2 ARG 30 1HB ARG 30 -2.085 6.401 -8.443
200 HB3 ARG 30 2HB ARG 30 -1.387 7.745 -9.337
201 HG2 ARG 30 1HG ARG 30 -2.486 5.168 -10.407
202 HG3 ARG 30 2HG ARG 30 -3.013 6.817 -10.749
203 HD2 ARG 30 1HD ARG 30 -0.914 7.256 -11.910
204 HD3 ARG 30 2HD ARG 30 -0.358 5.624 -11.539
205 HE ARG 30 HE ARG 30 -1.677 4.817 -13.236
206 HH11 ARG 30 1HH1 ARG 30 -2.545 8.119 -12.554
207 HH12 ARG 30 2HH1 ARG 30 -3.570 8.274 -13.943
208 HH21 ARG 30 1HH2 ARG 30 -3.024 5.008 -15.067
209 HH22 ARG 30 2HH2 ARG 30 -3.842 6.503 -15.371
210 H HIS 31 H HIS 31 -0.572 4.791 -6.965
211 HA HIS 31 HA HIS 31 0.057 6.678 -5.003
212 HB2 HIS 31 1HB HIS 31 -1.272 4.845 -4.332
213 HB3 HIS 31 2HB HIS 31 -0.115 3.672 -4.951
214 HD1 HIS 31 HD1 HIS 31 -0.449 6.197 -2.144
215 HD2 HIS 31 HD2 HIS 31 1.670 2.756 -3.106
216 HE1 HIS 31 HE1 HIS 31 0.818 5.583 -0.060
217 H SER 32 H SER 32 2.038 4.158 -6.494
218 HA SER 32 HA SER 32 4.290 4.388 -4.851
219 HB2 SER 32 1HB SER 32 3.924 2.558 -6.492
220 HB3 SER 32 2HB SER 32 4.240 3.698 -7.800
221 HG SER 32 HG SER 32 5.990 2.358 -6.234
222 H MET 33 H MET 33 2.983 6.600 -7.051
223 HA MET 33 HA MET 33 5.492 7.913 -7.673
224 HB2 MET 33 1HB MET 33 2.727 8.978 -8.218
225 HB3 MET 33 2HB MET 33 4.225 9.377 -9.048
226 HG2 MET 33 1HG MET 33 3.200 6.577 -9.099
227 HG3 MET 33 2HG MET 33 2.495 7.795 -10.159
228 HE1 MET 33 3HE MET 33 6.211 5.805 -9.630
229 HE2 MET 33 1HE MET 33 4.576 5.152 -9.730
230 HE3 MET 33 2HE MET 33 5.629 5.111 -11.144
231 H VAL 34 H VAL 34 2.904 8.178 -5.379
232 HA VAL 34 HA VAL 34 3.350 10.866 -4.583
233 HB VAL 34 HB VAL 34 1.937 10.429 -2.721
234 HG11 VAL 34 1HG1 VAL 34 0.121 8.930 -3.878
235 HG12 VAL 34 2HG1 VAL 34 0.529 10.517 -4.533
236 HG13 VAL 34 3HG1 VAL 34 1.203 9.060 -5.264
237 HG21 VAL 34 3HG2 VAL 34 3.147 7.833 -2.813
238 HG22 VAL 34 1HG2 VAL 34 2.206 8.579 -1.522
239 HG23 VAL 34 2HG2 VAL 34 1.391 7.672 -2.795
240 H HIS 35 H HIS 35 5.005 7.925 -3.958
241 HA HIS 35 HA HIS 35 6.186 8.679 -1.466
242 HB2 HIS 35 1HB HIS 35 6.759 6.519 -3.482
243 HB3 HIS 35 2HB HIS 35 7.813 6.778 -2.095
244 HD1 HIS 35 HD1 HIS 35 6.631 6.490 0.301
245 HD2 HIS 35 HD2 HIS 35 4.526 5.032 -2.971
246 HE1 HIS 35 HE1 HIS 35 4.892 4.945 1.255
247 H THR 36 H THR 36 6.891 9.278 -4.796
248 HA THR 36 HA THR 36 9.522 10.386 -4.080
249 HB THR 36 HB THR 36 9.474 8.668 -5.897
250 HG1 THR 36 HG1 THR 36 10.398 11.302 -6.285
251 HG21 THR 36 3HG2 THR 36 7.995 10.819 -7.417
252 HG22 THR 36 1HG2 THR 36 7.317 9.278 -6.893
253 HG23 THR 36 2HG2 THR 36 8.609 9.311 -8.094
254 H ALA 37 H ALA 37 6.851 11.651 -3.687
255 HA ALA 37 HA ALA 37 6.696 13.778 -5.622
256 HB1 ALA 37 3HB ALA 37 5.300 13.561 -2.959
257 HB2 ALA 37 1HB ALA 37 4.865 14.612 -4.307
258 HB3 ALA 37 2HB ALA 37 4.702 12.863 -4.464
259 H GLU 38 H GLU 38 8.920 14.527 -5.375
260 HA GLU 38 HA GLU 38 9.171 16.392 -3.111
261 HB2 GLU 38 1HB GLU 38 11.310 14.637 -4.317
262 HB3 GLU 38 2HB GLU 38 11.664 16.003 -3.269
263 HG2 GLU 38 1HG GLU 38 10.864 14.961 -1.399
264 HG3 GLU 38 2HG GLU 38 9.758 13.934 -2.311
265 H LYS 39 H LYS 39 9.610 18.441 -3.642
266 HA LYS 39 HA LYS 39 9.906 19.097 -6.460
267 HB2 LYS 39 1HB LYS 39 9.403 20.773 -4.002
268 HB3 LYS 39 2HB LYS 39 9.654 21.468 -5.598
269 HG2 LYS 39 1HG LYS 39 7.719 19.989 -6.356
270 HG3 LYS 39 2HG LYS 39 7.386 19.760 -4.637
271 HD2 LYS 39 1HD LYS 39 6.042 21.567 -5.111
272 HD3 LYS 39 2HD LYS 39 7.517 22.376 -4.576
273 HE2 LYS 39 1HE LYS 39 8.181 22.816 -6.820
274 HE3 LYS 39 2HE LYS 39 6.915 21.771 -7.464
275 HZ1 LYS 39 3HZ LYS 39 6.755 24.510 -6.526
276 HZ2 LYS 39 1HZ LYS 39 5.471 23.513 -6.057
277 HZ3 LYS 39 2HZ LYS 39 5.834 23.709 -7.697
278 HA PRO 40 HA PRO 40 14.201 20.002 -6.388
279 HB2 PRO 40 1HB PRO 40 14.334 22.100 -8.106
280 HB3 PRO 40 2HB PRO 40 14.028 20.442 -8.637
281 HG2 PRO 40 1HG PRO 40 12.086 22.675 -8.184
282 HG3 PRO 40 2HG PRO 40 12.151 21.500 -9.511
283 HD2 PRO 40 1HD PRO 40 10.439 21.252 -7.428
284 HD3 PRO 40 2HD PRO 40 11.132 19.849 -8.266
285 H SER 41 H SER 41 11.987 21.937 -4.905
286 HA SER 41 HA SER 41 14.061 23.817 -3.980
287 HB2 SER 41 1HB SER 41 11.113 24.277 -4.445
288 HB3 SER 41 2HB SER 41 12.098 25.363 -3.465
289 HG SER 41 HG SER 41 13.134 26.035 -5.214
290 H GLY 42 H GLY 42 14.588 23.605 -1.912
291 HA2 GLY 42 1HA GLY 42 13.428 23.688 0.376
292 HA3 GLY 42 2HA GLY 42 12.724 22.163 -0.142
293 HA PRO 43 HA PRO 43 16.564 21.197 2.246
294 HB2 PRO 43 1HB PRO 43 15.447 19.161 3.653
295 HB3 PRO 43 2HB PRO 43 15.347 20.850 4.165
296 HG2 PRO 43 1HG PRO 43 13.316 19.181 2.732
297 HG3 PRO 43 2HG PRO 43 13.085 20.320 4.071
298 HD2 PRO 43 1HD PRO 43 12.540 20.967 1.498
299 HD3 PRO 43 2HD PRO 43 13.120 22.158 2.680
300 H SER 44 H SER 44 18.017 19.620 1.750
301 HA SER 44 HA SER 44 17.559 18.011 -0.533
302 HB2 SER 44 1HB SER 44 19.804 18.006 1.495
303 HB3 SER 44 2HB SER 44 19.812 17.041 0.018
304 HG SER 44 HG SER 44 20.898 19.042 -0.247
305 H SER 45 H SER 45 18.184 15.596 -0.468
306 HA SER 45 HA SER 45 16.423 14.327 1.492
307 HB2 SER 45 1HB SER 45 16.603 12.341 -0.031
308 HB3 SER 45 2HB SER 45 15.929 13.776 -0.805
309 HG SER 45 HG SER 45 17.594 13.857 -2.092
310 H GLY 46 H GLY 46 17.245 13.363 3.219
311 HA2 GLY 46 1HA GLY 46 20.081 12.563 3.160
312 HA3 GLY 46 2HA GLY 46 19.172 12.961 4.611
Start of MODEL 10
1 H1 GLY 1 H GLY 1 -28.061 -0.835 8.660
2 HA2 GLY 1 1HA GLY 1 -25.839 0.341 8.180
3 HA3 GLY 1 2HA GLY 1 -25.202 -0.774 9.379
4 H SER 2 H SER 2 -23.950 -0.910 7.091
5 HA SER 2 HA SER 2 -24.923 -2.342 4.961
6 HB2 SER 2 1HB SER 2 -22.637 -2.989 4.482
7 HB3 SER 2 2HB SER 2 -22.640 -1.343 5.116
8 HG SER 2 HG SER 2 -22.380 -3.346 7.003
9 H SER 3 H SER 3 -24.335 -4.645 4.371
10 HA SER 3 HA SER 3 -24.086 -6.588 6.440
11 HB2 SER 3 1HB SER 3 -26.439 -5.946 6.810
12 HB3 SER 3 2HB SER 3 -26.804 -6.330 5.128
13 HG SER 3 HG SER 3 -26.256 -8.486 5.560
14 H GLY 4 H GLY 4 -23.617 -8.615 5.639
15 HA2 GLY 4 1HA GLY 4 -23.738 -10.264 3.866
16 HA3 GLY 4 2HA GLY 4 -23.773 -8.940 2.711
17 H SER 5 H SER 5 -21.735 -10.640 5.037
18 HA SER 5 HA SER 5 -19.327 -9.348 4.141
19 HB2 SER 5 1HB SER 5 -19.739 -11.775 5.903
20 HB3 SER 5 2HB SER 5 -18.189 -10.980 5.627
21 HG SER 5 HG SER 5 -19.347 -9.025 6.423
22 H SER 6 H SER 6 -17.875 -10.036 2.671
23 HA SER 6 HA SER 6 -18.649 -12.276 0.984
24 HB2 SER 6 1HB SER 6 -17.982 -10.075 -0.002
25 HB3 SER 6 2HB SER 6 -16.353 -10.338 0.619
26 HG SER 6 HG SER 6 -17.715 -11.664 -1.442
27 H GLY 7 H GLY 7 -15.739 -11.184 2.730
28 HA2 GLY 7 1HA GLY 7 -15.069 -13.626 3.843
29 HA3 GLY 7 2HA GLY 7 -14.293 -13.592 2.266
30 H THR 8 H THR 8 -12.216 -13.579 3.132
31 HA THR 8 HA THR 8 -11.327 -10.956 4.035
32 HB THR 8 HB THR 8 -11.767 -12.214 6.122
33 HG1 THR 8 HG1 THR 8 -9.457 -12.026 6.866
34 HG21 THR 8 3HG2 THR 8 -11.382 -14.475 5.393
35 HG22 THR 8 1HG2 THR 8 -10.237 -14.102 6.681
36 HG23 THR 8 2HG2 THR 8 -9.702 -14.109 5.001
37 H GLY 9 H GLY 9 -8.983 -10.699 3.919
38 HA2 GLY 9 1HA GLY 9 -6.963 -12.212 3.215
39 HA3 GLY 9 2HA GLY 9 -7.893 -12.311 1.727
40 H GLU 10 H GLU 10 -5.358 -11.341 1.626
41 HA GLU 10 HA GLU 10 -5.423 -8.448 1.751
42 HB2 GLU 10 1HB GLU 10 -3.288 -10.366 0.804
43 HB3 GLU 10 2HB GLU 10 -3.092 -8.621 0.886
44 HG2 GLU 10 1HG GLU 10 -3.864 -10.194 3.309
45 HG3 GLU 10 2HG GLU 10 -2.180 -10.064 2.804
46 H LYS 11 H LYS 11 -4.705 -7.167 -0.157
47 HA LYS 11 HA LYS 11 -6.395 -7.734 -2.387
48 HB2 LYS 11 1HB LYS 11 -4.553 -5.537 -1.591
49 HB3 LYS 11 2HB LYS 11 -4.941 -5.685 -3.300
50 HG2 LYS 11 1HG LYS 11 -6.466 -4.138 -2.333
51 HG3 LYS 11 2HG LYS 11 -7.356 -5.622 -2.684
52 HD2 LYS 11 1HD LYS 11 -6.144 -5.323 0.015
53 HD3 LYS 11 2HD LYS 11 -7.581 -4.369 -0.358
54 HE2 LYS 11 1HE LYS 11 -7.358 -7.361 -0.671
55 HE3 LYS 11 2HE LYS 11 -8.103 -6.543 0.702
56 HZ1 LYS 11 3HZ LYS 11 -9.628 -5.477 -0.950
57 HZ2 LYS 11 1HZ LYS 11 -9.831 -7.147 -0.767
58 HZ3 LYS 11 2HZ LYS 11 -9.016 -6.537 -2.117
59 HA PRO 12 HA PRO 12 -3.693 -9.850 -5.121
60 HB2 PRO 12 1HB PRO 12 -4.379 -8.788 -7.524
61 HB3 PRO 12 2HB PRO 12 -5.425 -9.898 -6.630
62 HG2 PRO 12 1HG PRO 12 -5.535 -6.911 -6.798
63 HG3 PRO 12 2HG PRO 12 -6.862 -8.084 -6.864
64 HD2 PRO 12 1HD PRO 12 -6.258 -6.693 -4.621
65 HD3 PRO 12 2HD PRO 12 -6.917 -8.341 -4.574
66 H PHE 13 H PHE 13 -3.200 -6.710 -4.320
67 HA PHE 13 HA PHE 13 -0.666 -6.631 -5.786
68 HB2 PHE 13 1HB PHE 13 -2.592 -4.303 -5.605
69 HB3 PHE 13 2HB PHE 13 -0.968 -4.233 -6.282
70 HD1 PHE 13 HD1 PHE 13 -0.461 -5.305 -8.413
71 HD2 PHE 13 HD2 PHE 13 -4.407 -5.289 -6.817
72 HE1 PHE 13 HE1 PHE 13 -1.351 -5.942 -10.617
73 HE2 PHE 13 HE2 PHE 13 -5.303 -5.927 -9.018
74 HZ PHE 13 HZ PHE 13 -3.775 -6.255 -10.921
75 H LYS 14 H LYS 14 0.811 -4.922 -4.878
76 HA LYS 14 HA LYS 14 0.300 -4.008 -2.200
77 HB2 LYS 14 1HB LYS 14 0.897 -6.343 -1.757
78 HB3 LYS 14 2HB LYS 14 2.391 -6.143 -2.663
79 HG2 LYS 14 1HG LYS 14 2.865 -4.248 -0.948
80 HG3 LYS 14 2HG LYS 14 1.650 -5.081 0.025
81 HD2 LYS 14 1HD LYS 14 2.940 -7.144 -0.107
82 HD3 LYS 14 2HD LYS 14 4.140 -6.344 -1.125
83 HE2 LYS 14 1HE LYS 14 4.950 -6.444 1.145
84 HE3 LYS 14 2HE LYS 14 4.603 -4.769 0.719
85 HZ1 LYS 14 3HZ LYS 14 3.416 -6.424 2.744
86 HZ2 LYS 14 1HZ LYS 14 2.268 -5.636 1.783
87 HZ3 LYS 14 2HZ LYS 14 3.443 -4.739 2.605
88 H CYS 15 H CYS 15 1.830 -2.497 -1.471
89 HA CYS 15 HA CYS 15 3.275 -1.182 -3.581
90 HB2 CYS 15 1HB CYS 15 1.994 -0.159 -1.525
91 HB3 CYS 15 2HB CYS 15 3.532 -0.400 -0.702
92 H ASP 16 H ASP 16 5.542 -0.260 -2.846
93 HA ASP 16 HA ASP 16 7.148 -2.546 -1.907
94 HB2 ASP 16 1HB ASP 16 7.487 -0.738 -4.247
95 HB3 ASP 16 2HB ASP 16 8.945 -1.253 -3.402
96 H ILE 17 H ILE 17 6.464 0.823 -1.665
97 HA ILE 17 HA ILE 17 8.844 1.386 -0.089
98 HB ILE 17 HB ILE 17 6.523 3.246 -0.571
99 HG12 ILE 17 1HG1 ILE 17 8.337 4.110 -2.344
100 HG13 ILE 17 2HG1 ILE 17 8.732 2.395 -2.372
101 HG21 ILE 17 1HG2 ILE 17 8.110 3.855 1.206
102 HG22 ILE 17 2HG2 ILE 17 9.426 3.783 0.035
103 HG23 ILE 17 3HG2 ILE 17 8.152 4.989 -0.144
104 HD11 ILE 17 3HD1 ILE 17 5.935 2.572 -2.544
105 HD12 ILE 17 1HD1 ILE 17 6.592 3.776 -3.653
106 HD13 ILE 17 2HD1 ILE 17 7.076 2.085 -3.797
107 H CYS 18 H CYS 18 5.316 1.357 0.361
108 HA CYS 18 HA CYS 18 5.780 1.170 3.266
109 HB2 CYS 18 1HB CYS 18 3.592 2.230 3.588
110 HB3 CYS 18 2HB CYS 18 4.663 3.264 2.648
111 H GLY 19 H GLY 19 4.881 -0.554 0.604
112 HA2 GLY 19 1HA GLY 19 4.047 -2.699 0.431
113 HA3 GLY 19 2HA GLY 19 3.858 -2.717 2.178
114 H LYS 20 H LYS 20 2.386 -0.020 0.804
115 HA LYS 20 HA LYS 20 -0.180 -0.653 1.638
116 HB2 LYS 20 1HB LYS 20 1.010 1.370 -0.170
117 HB3 LYS 20 2HB LYS 20 -0.719 1.096 -0.345
118 HG2 LYS 20 1HG LYS 20 0.568 1.677 2.306
119 HG3 LYS 20 2HG LYS 20 -0.021 2.944 1.226
120 HD2 LYS 20 1HD LYS 20 -2.219 2.395 1.560
121 HD3 LYS 20 2HD LYS 20 -1.857 0.699 1.891
122 HE2 LYS 20 1HE LYS 20 -2.565 1.659 3.940
123 HE3 LYS 20 2HE LYS 20 -0.817 1.457 4.053
124 HZ1 LYS 20 3HZ LYS 20 -1.727 4.016 3.030
125 HZ2 LYS 20 1HZ LYS 20 -0.479 3.664 4.117
126 HZ3 LYS 20 2HZ LYS 20 -2.080 3.717 4.657
127 H SER 21 H SER 21 -1.879 -1.716 0.787
128 HA SER 21 HA SER 21 -1.427 -3.150 -1.725
129 HB2 SER 21 1HB SER 21 -2.816 -4.813 -0.939
130 HB3 SER 21 2HB SER 21 -2.214 -4.179 0.593
131 HG SER 21 HG SER 21 -4.212 -2.700 0.229
132 H PHE 22 H PHE 22 -3.165 -3.349 -3.277
133 HA PHE 22 HA PHE 22 -5.313 -1.405 -3.156
134 HB2 PHE 22 1HB PHE 22 -3.268 -1.304 -5.383
135 HB3 PHE 22 2HB PHE 22 -4.723 -0.321 -5.267
136 HD1 PHE 22 HD1 PHE 22 -1.522 -1.058 -3.541
137 HD2 PHE 22 HD2 PHE 22 -4.679 1.727 -4.168
138 HE1 PHE 22 HE1 PHE 22 -0.262 0.647 -2.290
139 HE2 PHE 22 HE2 PHE 22 -3.424 3.436 -2.920
140 HZ PHE 22 HZ PHE 22 -1.213 2.898 -1.980
141 H CYS 23 H CYS 23 -7.059 -2.475 -3.775
142 HA CYS 23 HA CYS 23 -7.199 -4.979 -4.852
143 HB2 CYS 23 1HB CYS 23 -9.507 -4.433 -5.537
144 HB3 CYS 23 2HB CYS 23 -9.144 -3.849 -3.918
145 HG CYS 23 HG CYS 23 -10.667 -2.169 -5.997
146 H GLY 24 H GLY 24 -6.616 -1.981 -6.520
147 HA2 GLY 24 1HA GLY 24 -6.281 -3.512 -9.014
148 HA3 GLY 24 2HA GLY 24 -7.194 -2.011 -9.024
149 H ARG 25 H ARG 25 -4.317 -3.256 -9.822
150 HA ARG 25 HA ARG 25 -2.324 -1.674 -8.793
151 HB2 ARG 25 1HB ARG 25 -2.180 -3.573 -10.520
152 HB3 ARG 25 2HB ARG 25 -2.455 -2.326 -11.728
153 HG2 ARG 25 1HG ARG 25 -0.192 -2.333 -11.739
154 HG3 ARG 25 2HG ARG 25 -0.449 -1.166 -10.440
155 HD2 ARG 25 1HD ARG 25 1.031 -2.544 -9.394
156 HD3 ARG 25 2HD ARG 25 -0.466 -3.374 -8.973
157 HE ARG 25 HE ARG 25 0.312 -5.162 -10.139
158 HH11 ARG 25 1HH1 ARG 25 1.787 -2.289 -11.440
159 HH12 ARG 25 2HH1 ARG 25 2.758 -3.149 -12.588
160 HH21 ARG 25 1HH2 ARG 25 1.585 -6.306 -11.647
161 HH22 ARG 25 2HH2 ARG 25 2.642 -5.434 -12.705
162 H SER 26 H SER 26 -4.544 -0.903 -11.444
163 HA SER 26 HA SER 26 -3.616 1.359 -12.521
164 HB2 SER 26 1HB SER 26 -6.417 0.765 -11.578
165 HB3 SER 26 2HB SER 26 -6.031 2.234 -12.473
166 HG SER 26 HG SER 26 -4.947 0.461 -13.917
167 H ARG 27 H ARG 27 -4.769 1.040 -9.233
168 HA ARG 27 HA ARG 27 -4.504 3.897 -8.739
169 HB2 ARG 27 1HB ARG 27 -6.276 2.173 -7.755
170 HB3 ARG 27 2HB ARG 27 -5.024 1.956 -6.539
171 HG2 ARG 27 1HG ARG 27 -6.016 4.684 -7.279
172 HG3 ARG 27 2HG ARG 27 -6.862 3.681 -6.099
173 HD2 ARG 27 1HD ARG 27 -5.476 4.779 -4.675
174 HD3 ARG 27 2HD ARG 27 -4.399 3.456 -5.119
175 HE ARG 27 HE ARG 27 -3.770 5.285 -6.956
176 HH11 ARG 27 1HH1 ARG 27 -4.190 5.553 -3.510
177 HH12 ARG 27 2HH1 ARG 27 -3.049 6.845 -3.340
178 HH21 ARG 27 1HH2 ARG 27 -2.265 6.987 -6.745
179 HH22 ARG 27 2HH2 ARG 27 -1.956 7.661 -5.181
180 H LEU 28 H LEU 28 -3.152 0.877 -7.408
181 HA LEU 28 HA LEU 28 -1.299 1.893 -5.670
182 HB2 LEU 28 1HB LEU 28 -1.503 -0.417 -5.681
183 HB3 LEU 28 2HB LEU 28 -1.298 -0.525 -7.428
184 HG LEU 28 HG LEU 28 1.075 -0.121 -7.215
185 HD11 LEU 28 1HD1 LEU 28 1.225 1.390 -5.408
186 HD12 LEU 28 2HD1 LEU 28 2.065 -0.072 -4.892
187 HD13 LEU 28 3HD1 LEU 28 0.438 0.264 -4.302
188 HD21 LEU 28 3HD2 LEU 28 1.129 -2.337 -7.017
189 HD22 LEU 28 1HD2 LEU 28 -0.299 -2.350 -5.982
190 HD23 LEU 28 2HD2 LEU 28 1.298 -2.096 -5.278
191 H ASN 29 H ASN 29 -0.669 1.120 -9.097
192 HA ASN 29 HA ASN 29 1.897 1.901 -9.394
193 HB2 ASN 29 1HB ASN 29 -0.482 2.069 -11.170
194 HB3 ASN 29 2HB ASN 29 0.955 2.954 -11.673
195 HD21 ASN 29 1HD2 ASN 29 -0.593 0.237 -12.229
196 HD22 ASN 29 2HD2 ASN 29 0.718 -0.846 -12.537
197 H ARG 30 H ARG 30 -0.890 4.112 -9.497
198 HA ARG 30 HA ARG 30 0.637 6.467 -9.813
199 HB2 ARG 30 1HB ARG 30 -2.076 6.313 -8.505
200 HB3 ARG 30 2HB ARG 30 -1.381 7.660 -9.397
201 HG2 ARG 30 1HG ARG 30 -2.420 5.057 -10.467
202 HG3 ARG 30 2HG ARG 30 -2.969 6.694 -10.829
203 HD2 ARG 30 1HD ARG 30 -0.918 7.170 -12.004
204 HD3 ARG 30 2HD ARG 30 -0.248 5.608 -11.536
205 HE ARG 30 HE ARG 30 -2.570 5.040 -12.895
206 HH11 ARG 30 1HH1 ARG 30 0.406 6.711 -13.581
207 HH12 ARG 30 2HH1 ARG 30 0.379 6.337 -15.272
208 HH21 ARG 30 1HH2 ARG 30 -2.617 4.541 -15.120
209 HH22 ARG 30 2HH2 ARG 30 -1.342 5.103 -16.147
210 H HIS 31 H HIS 31 -0.579 4.762 -6.974
211 HA HIS 31 HA HIS 31 -0.013 6.677 -5.028
212 HB2 HIS 31 1HB HIS 31 -1.295 4.841 -4.318
213 HB3 HIS 31 2HB HIS 31 -0.146 3.673 -4.964
214 HD1 HIS 31 HD1 HIS 31 -0.414 6.199 -2.146
215 HD2 HIS 31 HD2 HIS 31 1.644 2.730 -3.142
216 HE1 HIS 31 HE1 HIS 31 0.880 5.570 -0.084
217 H SER 32 H SER 32 2.055 4.190 -6.456
218 HA SER 32 HA SER 32 4.272 4.457 -4.792
219 HB2 SER 32 1HB SER 32 3.993 2.664 -6.486
220 HB3 SER 32 2HB SER 32 4.288 3.849 -7.759
221 HG SER 32 HG SER 32 6.239 2.949 -7.374
222 H MET 33 H MET 33 2.953 6.683 -6.982
223 HA MET 33 HA MET 33 5.427 8.082 -7.525
224 HB2 MET 33 1HB MET 33 2.637 9.097 -8.043
225 HB3 MET 33 2HB MET 33 4.128 9.569 -8.848
226 HG2 MET 33 1HG MET 33 3.173 6.747 -9.012
227 HG3 MET 33 2HG MET 33 2.455 7.988 -10.037
228 HE1 MET 33 3HE MET 33 4.605 5.377 -9.668
229 HE2 MET 33 1HE MET 33 5.711 5.425 -11.042
230 HE3 MET 33 2HE MET 33 6.208 6.092 -9.487
231 H VAL 34 H VAL 34 2.843 8.200 -5.220
232 HA VAL 34 HA VAL 34 3.228 10.873 -4.334
233 HB VAL 34 HB VAL 34 1.807 10.353 -2.506
234 HG11 VAL 34 1HG1 VAL 34 0.473 10.455 -4.405
235 HG12 VAL 34 2HG1 VAL 34 1.100 8.935 -5.048
236 HG13 VAL 34 3HG1 VAL 34 -0.003 8.924 -3.671
237 HG21 VAL 34 3HG2 VAL 34 3.068 7.775 -2.673
238 HG22 VAL 34 1HG2 VAL 34 2.145 8.486 -1.349
239 HG23 VAL 34 2HG2 VAL 34 1.314 7.597 -2.627
240 H HIS 35 H HIS 35 4.941 7.949 -3.815
241 HA HIS 35 HA HIS 35 6.091 8.622 -1.286
242 HB2 HIS 35 1HB HIS 35 6.711 6.564 -3.390
243 HB3 HIS 35 2HB HIS 35 7.777 6.796 -2.008
244 HD1 HIS 35 HD1 HIS 35 6.692 6.318 0.379
245 HD2 HIS 35 HD2 HIS 35 4.469 5.065 -2.899
246 HE1 HIS 35 HE1 HIS 35 4.993 4.708 1.296
247 H THR 36 H THR 36 6.765 9.441 -4.563
248 HA THR 36 HA THR 36 9.333 10.640 -3.749
249 HB THR 36 HB THR 36 9.504 8.892 -5.526
250 HG1 THR 36 HG1 THR 36 10.683 11.181 -5.381
251 HG21 THR 36 3HG2 THR 36 8.579 9.172 -7.660
252 HG22 THR 36 1HG2 THR 36 8.204 10.871 -7.376
253 HG23 THR 36 2HG2 THR 36 7.266 9.614 -6.569
254 H ALA 37 H ALA 37 6.592 11.756 -3.511
255 HA ALA 37 HA ALA 37 6.476 13.862 -5.495
256 HB1 ALA 37 3HB ALA 37 4.392 14.403 -4.634
257 HB2 ALA 37 1HB ALA 37 4.485 12.662 -4.366
258 HB3 ALA 37 2HB ALA 37 4.779 13.778 -3.031
259 H GLU 38 H GLU 38 8.878 13.983 -4.154
260 HA GLU 38 HA GLU 38 8.718 15.899 -2.005
261 HB2 GLU 38 1HB GLU 38 11.147 15.822 -2.009
262 HB3 GLU 38 2HB GLU 38 10.493 14.191 -2.067
263 HG2 GLU 38 1HG GLU 38 11.240 13.811 -4.183
264 HG3 GLU 38 2HG GLU 38 11.158 15.512 -4.638
265 H LYS 39 H LYS 39 7.396 16.963 -4.121
266 HA LYS 39 HA LYS 39 8.637 18.437 -6.033
267 HB2 LYS 39 1HB LYS 39 6.325 19.229 -4.262
268 HB3 LYS 39 2HB LYS 39 6.826 20.169 -5.661
269 HG2 LYS 39 1HG LYS 39 6.462 18.134 -7.061
270 HG3 LYS 39 2HG LYS 39 5.773 17.351 -5.637
271 HD2 LYS 39 1HD LYS 39 4.187 19.339 -5.510
272 HD3 LYS 39 2HD LYS 39 4.741 19.747 -7.135
273 HE2 LYS 39 1HE LYS 39 3.516 17.111 -6.327
274 HE3 LYS 39 2HE LYS 39 2.655 18.423 -7.130
275 HZ1 LYS 39 3HZ LYS 39 4.743 18.089 -8.762
276 HZ2 LYS 39 1HZ LYS 39 3.251 17.319 -8.972
277 HZ3 LYS 39 2HZ LYS 39 4.526 16.501 -8.219
278 HA PRO 40 HA PRO 40 11.293 21.386 -4.152
279 HB2 PRO 40 1HB PRO 40 11.130 23.426 -5.936
280 HB3 PRO 40 2HB PRO 40 11.994 21.921 -6.274
281 HG2 PRO 40 1HG PRO 40 9.244 22.757 -7.112
282 HG3 PRO 40 2HG PRO 40 10.503 21.943 -8.059
283 HD2 PRO 40 1HD PRO 40 8.415 20.612 -6.965
284 HD3 PRO 40 2HD PRO 40 10.018 19.876 -7.163
285 H SER 41 H SER 41 7.983 22.186 -4.826
286 HA SER 41 HA SER 41 8.009 24.732 -3.504
287 HB2 SER 41 1HB SER 41 6.364 24.230 -5.261
288 HB3 SER 41 2HB SER 41 5.680 22.949 -4.261
289 HG SER 41 HG SER 41 5.574 24.926 -2.688
290 H GLY 42 H GLY 42 8.572 24.706 -1.401
291 HA2 GLY 42 1HA GLY 42 6.825 24.017 0.605
292 HA3 GLY 42 2HA GLY 42 7.835 22.595 0.387
293 HA PRO 43 HA PRO 43 9.837 25.893 3.173
294 HB2 PRO 43 1HB PRO 43 9.472 24.655 5.561
295 HB3 PRO 43 2HB PRO 43 8.313 25.809 4.890
296 HG2 PRO 43 1HG PRO 43 8.243 22.816 4.857
297 HG3 PRO 43 2HG PRO 43 6.928 23.963 5.176
298 HD2 PRO 43 1HD PRO 43 7.246 22.741 2.780
299 HD3 PRO 43 2HD PRO 43 6.577 24.379 2.937
300 H SER 44 H SER 44 11.765 25.539 4.521
301 HA SER 44 HA SER 44 13.269 23.246 3.545
302 HB2 SER 44 1HB SER 44 15.218 24.449 4.594
303 HB3 SER 44 2HB SER 44 14.387 25.364 3.336
304 HG SER 44 HG SER 44 14.906 26.255 5.659
305 H SER 45 H SER 45 12.814 24.852 6.699
306 HA SER 45 HA SER 45 13.977 23.006 8.344
307 HB2 SER 45 1HB SER 45 12.873 25.227 8.971
308 HB3 SER 45 2HB SER 45 11.359 24.327 9.059
309 HG SER 45 HG SER 45 13.433 23.148 10.412
310 H GLY 46 H GLY 46 10.678 22.922 7.047
311 HA2 GLY 46 1HA GLY 46 9.808 20.631 8.429
312 HA3 GLY 46 2HA GLY 46 9.140 21.224 6.916
Start of MODEL 11
1 H1 GLY 1 H GLY 1 -18.803 -19.061 15.306
2 HA2 GLY 1 1HA GLY 1 -19.425 -17.702 17.360
3 HA3 GLY 1 2HA GLY 1 -17.903 -18.294 18.010
4 H SER 2 H SER 2 -19.013 -15.556 17.234
5 HA SER 2 HA SER 2 -17.171 -14.705 15.163
6 HB2 SER 2 1HB SER 2 -19.127 -13.119 16.845
7 HB3 SER 2 2HB SER 2 -18.199 -12.478 15.489
8 HG SER 2 HG SER 2 -19.718 -14.766 15.029
9 H SER 3 H SER 3 -15.834 -15.764 17.352
10 HA SER 3 HA SER 3 -14.799 -13.446 18.818
11 HB2 SER 3 1HB SER 3 -15.523 -15.692 19.927
12 HB3 SER 3 2HB SER 3 -13.966 -16.284 19.347
13 HG SER 3 HG SER 3 -13.116 -15.323 20.996
14 H GLY 4 H GLY 4 -12.990 -12.502 18.162
15 HA2 GLY 4 1HA GLY 4 -11.176 -12.120 16.752
16 HA3 GLY 4 2HA GLY 4 -10.547 -13.465 17.692
17 H SER 5 H SER 5 -12.787 -12.993 14.955
18 HA SER 5 HA SER 5 -11.940 -15.495 13.778
19 HB2 SER 5 1HB SER 5 -14.317 -14.579 13.715
20 HB3 SER 5 2HB SER 5 -13.740 -13.426 12.513
21 HG SER 5 HG SER 5 -14.283 -15.026 11.225
22 H SER 6 H SER 6 -9.830 -15.303 13.138
23 HA SER 6 HA SER 6 -9.125 -13.104 11.333
24 HB2 SER 6 1HB SER 6 -7.602 -13.472 13.211
25 HB3 SER 6 2HB SER 6 -7.371 -15.149 12.716
26 HG SER 6 HG SER 6 -5.815 -13.341 12.024
27 H GLY 7 H GLY 7 -8.103 -13.504 9.319
28 HA2 GLY 7 1HA GLY 7 -7.733 -16.106 8.252
29 HA3 GLY 7 2HA GLY 7 -9.284 -15.461 7.735
30 H THR 8 H THR 8 -7.612 -16.028 5.771
31 HA THR 8 HA THR 8 -5.718 -14.105 5.035
32 HB THR 8 HB THR 8 -5.880 -16.276 3.910
33 HG1 THR 8 HG1 THR 8 -6.377 -14.231 1.999
34 HG21 THR 8 3HG2 THR 8 -8.368 -16.382 3.876
35 HG22 THR 8 1HG2 THR 8 -7.626 -16.770 2.324
36 HG23 THR 8 2HG2 THR 8 -8.362 -15.188 2.579
37 H GLY 9 H GLY 9 -5.880 -12.079 4.312
38 HA2 GLY 9 1HA GLY 9 -8.203 -11.198 2.825
39 HA3 GLY 9 2HA GLY 9 -8.043 -10.473 4.417
40 H GLU 10 H GLU 10 -6.327 -10.961 1.354
41 HA GLU 10 HA GLU 10 -5.114 -8.310 1.723
42 HB2 GLU 10 1HB GLU 10 -3.761 -10.904 1.172
43 HB3 GLU 10 2HB GLU 10 -3.150 -9.477 0.347
44 HG2 GLU 10 1HG GLU 10 -2.822 -8.368 2.495
45 HG3 GLU 10 2HG GLU 10 -3.442 -9.793 3.326
46 H LYS 11 H LYS 11 -4.399 -7.312 -0.303
47 HA LYS 11 HA LYS 11 -6.320 -7.838 -2.416
48 HB2 LYS 11 1HB LYS 11 -4.522 -5.589 -1.674
49 HB3 LYS 11 2HB LYS 11 -4.947 -5.752 -3.373
50 HG2 LYS 11 1HG LYS 11 -6.493 -4.248 -2.379
51 HG3 LYS 11 2HG LYS 11 -7.348 -5.760 -2.694
52 HD2 LYS 11 1HD LYS 11 -6.073 -5.413 -0.032
53 HD3 LYS 11 2HD LYS 11 -7.539 -4.490 -0.370
54 HE2 LYS 11 1HE LYS 11 -7.278 -7.476 -0.700
55 HE3 LYS 11 2HE LYS 11 -7.963 -6.684 0.718
56 HZ1 LYS 11 3HZ LYS 11 -9.347 -7.451 -1.483
57 HZ2 LYS 11 1HZ LYS 11 -9.133 -5.793 -1.746
58 HZ3 LYS 11 2HZ LYS 11 -9.882 -6.335 -0.329
59 HA PRO 12 HA PRO 12 -3.644 -9.847 -5.254
60 HB2 PRO 12 1HB PRO 12 -4.343 -8.720 -7.623
61 HB3 PRO 12 2HB PRO 12 -5.386 -9.851 -6.752
62 HG2 PRO 12 1HG PRO 12 -5.491 -6.861 -6.839
63 HG3 PRO 12 2HG PRO 12 -6.821 -8.031 -6.928
64 HD2 PRO 12 1HD PRO 12 -6.201 -6.701 -4.653
65 HD3 PRO 12 2HD PRO 12 -6.862 -8.349 -4.646
66 H PHE 13 H PHE 13 -3.147 -6.725 -4.379
67 HA PHE 13 HA PHE 13 -0.609 -6.621 -5.830
68 HB2 PHE 13 1HB PHE 13 -2.537 -4.295 -5.656
69 HB3 PHE 13 2HB PHE 13 -0.911 -4.226 -6.327
70 HD1 PHE 13 HD1 PHE 13 -0.393 -5.341 -8.446
71 HD2 PHE 13 HD2 PHE 13 -4.353 -5.230 -6.889
72 HE1 PHE 13 HE1 PHE 13 -1.276 -5.973 -10.654
73 HE2 PHE 13 HE2 PHE 13 -5.242 -5.862 -9.094
74 HZ PHE 13 HZ PHE 13 -3.703 -6.235 -10.980
75 H LYS 14 H LYS 14 0.855 -4.914 -4.899
76 HA LYS 14 HA LYS 14 0.312 -4.011 -2.223
77 HB2 LYS 14 1HB LYS 14 0.910 -6.345 -1.779
78 HB3 LYS 14 2HB LYS 14 2.411 -6.141 -2.672
79 HG2 LYS 14 1HG LYS 14 2.866 -4.249 -0.948
80 HG3 LYS 14 2HG LYS 14 1.647 -5.089 0.013
81 HD2 LYS 14 1HD LYS 14 2.951 -7.160 -0.160
82 HD3 LYS 14 2HD LYS 14 4.173 -6.307 -1.106
83 HE2 LYS 14 1HE LYS 14 4.697 -4.882 0.756
84 HE3 LYS 14 2HE LYS 14 3.360 -5.544 1.695
85 HZ1 LYS 14 3HZ LYS 14 4.608 -7.767 1.318
86 HZ2 LYS 14 1HZ LYS 14 5.146 -6.701 2.518
87 HZ3 LYS 14 2HZ LYS 14 5.947 -6.773 1.030
88 H CYS 15 H CYS 15 1.839 -2.506 -1.465
89 HA CYS 15 HA CYS 15 3.300 -1.176 -3.556
90 HB2 CYS 15 1HB CYS 15 1.994 -0.147 -1.533
91 HB3 CYS 15 2HB CYS 15 3.500 -0.420 -0.661
92 H ASP 16 H ASP 16 5.561 -0.273 -2.849
93 HA ASP 16 HA ASP 16 7.159 -2.549 -1.870
94 HB2 ASP 16 1HB ASP 16 7.504 -0.772 -4.232
95 HB3 ASP 16 2HB ASP 16 8.961 -1.266 -3.374
96 H ILE 17 H ILE 17 6.441 0.800 -1.618
97 HA ILE 17 HA ILE 17 8.831 1.394 -0.066
98 HB ILE 17 HB ILE 17 6.494 3.235 -0.535
99 HG12 ILE 17 1HG1 ILE 17 8.281 4.103 -2.333
100 HG13 ILE 17 2HG1 ILE 17 8.685 2.390 -2.361
101 HG21 ILE 17 1HG2 ILE 17 8.098 4.991 -0.119
102 HG22 ILE 17 2HG2 ILE 17 8.117 3.845 1.221
103 HG23 ILE 17 3HG2 ILE 17 9.402 3.810 0.013
104 HD11 ILE 17 3HD1 ILE 17 6.907 1.917 -3.590
105 HD12 ILE 17 1HD1 ILE 17 5.834 2.798 -2.502
106 HD13 ILE 17 2HD1 ILE 17 6.682 3.655 -3.790
107 H CYS 18 H CYS 18 5.308 1.309 0.398
108 HA CYS 18 HA CYS 18 5.788 1.133 3.301
109 HB2 CYS 18 1HB CYS 18 3.587 2.180 3.630
110 HB3 CYS 18 2HB CYS 18 4.665 3.226 2.713
111 H GLY 19 H GLY 19 4.861 -0.575 0.632
112 HA2 GLY 19 1HA GLY 19 4.051 -2.734 0.474
113 HA3 GLY 19 2HA GLY 19 3.835 -2.737 2.218
114 H LYS 20 H LYS 20 2.374 -0.035 0.912
115 HA LYS 20 HA LYS 20 -0.198 -0.682 1.671
116 HB2 LYS 20 1HB LYS 20 1.007 1.354 -0.117
117 HB3 LYS 20 2HB LYS 20 -0.723 1.087 -0.289
118 HG2 LYS 20 1HG LYS 20 0.585 1.660 2.354
119 HG3 LYS 20 2HG LYS 20 -0.037 2.922 1.288
120 HD2 LYS 20 1HD LYS 20 -2.214 2.370 1.682
121 HD3 LYS 20 2HD LYS 20 -1.848 0.662 1.936
122 HE2 LYS 20 1HE LYS 20 -1.065 2.822 3.882
123 HE3 LYS 20 2HE LYS 20 -2.598 1.955 3.974
124 HZ1 LYS 20 3HZ LYS 20 0.127 0.809 4.215
125 HZ2 LYS 20 1HZ LYS 20 -1.273 -0.130 4.079
126 HZ3 LYS 20 2HZ LYS 20 -1.064 0.886 5.414
127 H SER 21 H SER 21 -1.898 -1.717 0.777
128 HA SER 21 HA SER 21 -1.407 -3.137 -1.736
129 HB2 SER 21 1HB SER 21 -2.827 -4.798 -0.992
130 HB3 SER 21 2HB SER 21 -2.222 -4.195 0.551
131 HG SER 21 HG SER 21 -4.737 -3.908 -0.618
132 H PHE 22 H PHE 22 -3.191 -3.369 -3.272
133 HA PHE 22 HA PHE 22 -5.307 -1.397 -3.180
134 HB2 PHE 22 1HB PHE 22 -3.240 -1.306 -5.388
135 HB3 PHE 22 2HB PHE 22 -4.695 -0.320 -5.290
136 HD1 PHE 22 HD1 PHE 22 -1.560 -1.085 -3.443
137 HD2 PHE 22 HD2 PHE 22 -4.616 1.758 -4.278
138 HE1 PHE 22 HE1 PHE 22 -0.313 0.620 -2.182
139 HE2 PHE 22 HE2 PHE 22 -3.373 3.468 -3.019
140 HZ PHE 22 HZ PHE 22 -1.219 2.901 -1.970
141 H CYS 23 H CYS 23 -7.035 -2.526 -3.746
142 HA CYS 23 HA CYS 23 -7.172 -5.005 -4.855
143 HB2 CYS 23 1HB CYS 23 -9.485 -4.500 -5.486
144 HB3 CYS 23 2HB CYS 23 -9.109 -3.842 -3.898
145 HG CYS 23 HG CYS 23 -9.432 -2.101 -6.821
146 H GLY 24 H GLY 24 -6.655 -1.983 -6.516
147 HA2 GLY 24 1HA GLY 24 -6.329 -3.501 -9.023
148 HA3 GLY 24 2HA GLY 24 -7.223 -1.988 -9.009
149 H ARG 25 H ARG 25 -4.360 -3.271 -9.826
150 HA ARG 25 HA ARG 25 -2.339 -1.729 -8.807
151 HB2 ARG 25 1HB ARG 25 -2.221 -3.597 -10.554
152 HB3 ARG 25 2HB ARG 25 -2.531 -2.345 -11.749
153 HG2 ARG 25 1HG ARG 25 -0.265 -2.359 -11.815
154 HG3 ARG 25 2HG ARG 25 -0.498 -1.181 -10.521
155 HD2 ARG 25 1HD ARG 25 -0.109 -2.851 -8.847
156 HD3 ARG 25 2HD ARG 25 -0.092 -4.130 -10.060
157 HE ARG 25 HE ARG 25 1.910 -2.391 -10.789
158 HH11 ARG 25 1HH1 ARG 25 1.142 -4.326 -7.998
159 HH12 ARG 25 2HH1 ARG 25 2.797 -4.562 -7.544
160 HH21 ARG 25 1HH2 ARG 25 4.093 -2.695 -10.201
161 HH22 ARG 25 2HH2 ARG 25 4.475 -3.633 -8.797
162 H SER 26 H SER 26 -4.498 -0.896 -11.501
163 HA SER 26 HA SER 26 -3.557 1.385 -12.499
164 HB2 SER 26 1HB SER 26 -5.761 2.088 -12.974
165 HB3 SER 26 2HB SER 26 -5.876 0.333 -12.843
166 HG SER 26 HG SER 26 -7.534 1.364 -11.670
167 H ARG 27 H ARG 27 -4.821 1.029 -9.246
168 HA ARG 27 HA ARG 27 -4.560 3.862 -8.683
169 HB2 ARG 27 1HB ARG 27 -6.403 2.458 -7.726
170 HB3 ARG 27 2HB ARG 27 -5.193 1.609 -6.773
171 HG2 ARG 27 1HG ARG 27 -6.114 3.197 -5.325
172 HG3 ARG 27 2HG ARG 27 -4.566 3.880 -5.826
173 HD2 ARG 27 1HD ARG 27 -6.298 5.582 -5.868
174 HD3 ARG 27 2HD ARG 27 -5.723 5.248 -7.501
175 HE ARG 27 HE ARG 27 -7.856 3.635 -7.321
176 HH11 ARG 27 1HH1 ARG 27 -7.415 7.000 -6.547
177 HH12 ARG 27 2HH1 ARG 27 -9.055 7.431 -6.902
178 HH21 ARG 27 1HH2 ARG 27 -10.018 4.190 -7.791
179 HH22 ARG 27 2HH2 ARG 27 -10.535 5.832 -7.608
180 H LEU 28 H LEU 28 -3.164 0.859 -7.354
181 HA LEU 28 HA LEU 28 -1.308 1.894 -5.640
182 HB2 LEU 28 1HB LEU 28 -1.463 -0.415 -5.646
183 HB3 LEU 28 2HB LEU 28 -1.300 -0.522 -7.397
184 HG LEU 28 HG LEU 28 1.077 -0.065 -7.232
185 HD11 LEU 28 1HD1 LEU 28 0.509 0.215 -4.291
186 HD12 LEU 28 2HD1 LEU 28 1.203 1.414 -5.381
187 HD13 LEU 28 3HD1 LEU 28 2.126 -0.025 -4.951
188 HD21 LEU 28 3HD2 LEU 28 1.307 -2.082 -5.303
189 HD22 LEU 28 1HD2 LEU 28 1.235 -2.272 -7.055
190 HD23 LEU 28 2HD2 LEU 28 -0.244 -2.351 -6.099
191 H ASN 29 H ASN 29 -0.720 1.175 -9.085
192 HA ASN 29 HA ASN 29 1.839 1.965 -9.413
193 HB2 ASN 29 1HB ASN 29 -0.572 2.175 -11.140
194 HB3 ASN 29 2HB ASN 29 0.858 3.068 -11.650
195 HD21 ASN 29 1HD2 ASN 29 -0.711 0.351 -12.207
196 HD22 ASN 29 2HD2 ASN 29 0.594 -0.721 -12.575
197 H ARG 30 H ARG 30 -0.942 4.191 -9.483
198 HA ARG 30 HA ARG 30 0.581 6.545 -9.750
199 HB2 ARG 30 1HB ARG 30 -2.113 6.371 -8.406
200 HB3 ARG 30 2HB ARG 30 -1.429 7.731 -9.287
201 HG2 ARG 30 1HG ARG 30 -2.489 5.148 -10.382
202 HG3 ARG 30 2HG ARG 30 -3.040 6.792 -10.711
203 HD2 ARG 30 1HD ARG 30 -0.983 7.279 -11.891
204 HD3 ARG 30 2HD ARG 30 -0.344 5.687 -11.486
205 HE ARG 30 HE ARG 30 -2.641 5.131 -12.813
206 HH11 ARG 30 1HH1 ARG 30 0.149 7.083 -13.535
207 HH12 ARG 30 2HH1 ARG 30 0.035 6.845 -15.247
208 HH21 ARG 30 1HH2 ARG 30 -2.802 4.809 -15.065
209 HH22 ARG 30 2HH2 ARG 30 -1.644 5.552 -16.117
210 H HIS 31 H HIS 31 -0.601 4.789 -6.927
211 HA HIS 31 HA HIS 31 0.006 6.670 -4.957
212 HB2 HIS 31 1HB HIS 31 -1.295 4.833 -4.272
213 HB3 HIS 31 2HB HIS 31 -0.153 3.666 -4.932
214 HD1 HIS 31 HD1 HIS 31 -0.447 6.132 -2.071
215 HD2 HIS 31 HD2 HIS 31 1.680 2.728 -3.141
216 HE1 HIS 31 HE1 HIS 31 0.860 5.484 -0.022
217 H SER 32 H SER 32 2.024 4.183 -6.453
218 HA SER 32 HA SER 32 4.266 4.419 -4.805
219 HB2 SER 32 1HB SER 32 3.934 2.618 -6.484
220 HB3 SER 32 2HB SER 32 4.238 3.789 -7.767
221 HG SER 32 HG SER 32 6.040 2.968 -5.735
222 H MET 33 H MET 33 2.945 6.648 -6.988
223 HA MET 33 HA MET 33 5.436 8.010 -7.565
224 HB2 MET 33 1HB MET 33 2.660 9.053 -8.097
225 HB3 MET 33 2HB MET 33 4.155 9.483 -8.915
226 HG2 MET 33 1HG MET 33 3.162 6.673 -9.022
227 HG3 MET 33 2HG MET 33 2.444 7.903 -10.059
228 HE1 MET 33 3HE MET 33 5.644 5.287 -11.074
229 HE2 MET 33 1HE MET 33 6.181 5.964 -9.536
230 HE3 MET 33 2HE MET 33 4.563 5.276 -9.679
231 H VAL 34 H VAL 34 2.831 8.203 -5.280
232 HA VAL 34 HA VAL 34 3.239 10.876 -4.427
233 HB VAL 34 HB VAL 34 1.830 10.383 -2.578
234 HG11 VAL 34 1HG1 VAL 34 1.099 8.967 -5.111
235 HG12 VAL 34 2HG1 VAL 34 0.004 8.954 -3.728
236 HG13 VAL 34 3HG1 VAL 34 0.481 10.485 -4.463
237 HG21 VAL 34 3HG2 VAL 34 1.325 7.623 -2.695
238 HG22 VAL 34 1HG2 VAL 34 3.079 7.806 -2.722
239 HG23 VAL 34 2HG2 VAL 34 2.138 8.517 -1.410
240 H HIS 35 H HIS 35 4.936 7.948 -3.854
241 HA HIS 35 HA HIS 35 6.099 8.659 -1.345
242 HB2 HIS 35 1HB HIS 35 6.715 6.572 -3.422
243 HB3 HIS 35 2HB HIS 35 7.777 6.819 -2.040
244 HD1 HIS 35 HD1 HIS 35 6.655 6.411 0.356
245 HD2 HIS 35 HD2 HIS 35 4.498 5.047 -2.923
246 HE1 HIS 35 HE1 HIS 35 4.957 4.807 1.288
247 H THR 36 H THR 36 6.800 9.376 -4.652
248 HA THR 36 HA THR 36 9.430 10.465 -3.924
249 HB THR 36 HB THR 36 9.399 8.928 -5.852
250 HG1 THR 36 HG1 THR 36 10.174 11.601 -6.033
251 HG21 THR 36 3HG2 THR 36 7.478 10.964 -6.958
252 HG22 THR 36 1HG2 THR 36 7.257 9.222 -6.804
253 HG23 THR 36 2HG2 THR 36 8.388 9.865 -7.995
254 H ALA 37 H ALA 37 6.225 11.351 -4.792
255 HA ALA 37 HA ALA 37 6.914 14.027 -5.648
256 HB1 ALA 37 3HB ALA 37 4.201 14.028 -5.185
257 HB2 ALA 37 1HB ALA 37 4.991 13.671 -6.722
258 HB3 ALA 37 2HB ALA 37 4.532 12.356 -5.640
259 H GLU 38 H GLU 38 7.906 13.439 -3.087
260 HA GLU 38 HA GLU 38 6.123 14.771 -1.202
261 HB2 GLU 38 1HB GLU 38 8.736 13.307 -0.919
262 HB3 GLU 38 2HB GLU 38 8.090 14.285 0.391
263 HG2 GLU 38 1HG GLU 38 6.739 11.924 -0.897
264 HG3 GLU 38 2HG GLU 38 7.517 11.950 0.685
265 H LYS 39 H LYS 39 6.166 16.900 -1.015
266 HA LYS 39 HA LYS 39 7.780 18.690 -2.267
267 HB2 LYS 39 1HB LYS 39 6.356 18.875 0.376
268 HB3 LYS 39 2HB LYS 39 7.253 20.241 -0.274
269 HG2 LYS 39 1HG LYS 39 5.015 18.839 -1.718
270 HG3 LYS 39 2HG LYS 39 4.825 20.308 -0.757
271 HD2 LYS 39 1HD LYS 39 6.660 21.288 -2.264
272 HD3 LYS 39 2HD LYS 39 6.327 19.920 -3.328
273 HE2 LYS 39 1HE LYS 39 4.202 20.662 -3.835
274 HE3 LYS 39 2HE LYS 39 4.066 21.606 -2.352
275 HZ1 LYS 39 3HZ LYS 39 5.882 23.046 -3.361
276 HZ2 LYS 39 1HZ LYS 39 4.336 23.173 -4.036
277 HZ3 LYS 39 2HZ LYS 39 5.533 22.279 -4.827
278 HA PRO 40 HA PRO 40 11.775 18.691 -0.452
279 HB2 PRO 40 1HB PRO 40 12.427 21.324 -0.554
280 HB3 PRO 40 2HB PRO 40 12.355 20.296 -1.990
281 HG2 PRO 40 1HG PRO 40 10.322 22.225 -0.937
282 HG3 PRO 40 2HG PRO 40 10.855 21.962 -2.608
283 HD2 PRO 40 1HD PRO 40 8.550 20.927 -1.633
284 HD3 PRO 40 2HD PRO 40 9.516 20.105 -2.875
285 H SER 41 H SER 41 9.149 19.857 1.152
286 HA SER 41 HA SER 41 9.759 21.499 3.157
287 HB2 SER 41 1HB SER 41 8.280 20.247 4.631
288 HB3 SER 41 2HB SER 41 7.636 20.219 2.990
289 HG SER 41 HG SER 41 7.546 18.142 3.502
290 H GLY 42 H GLY 42 10.878 21.534 5.087
291 HA2 GLY 42 1HA GLY 42 12.929 19.433 5.356
292 HA3 GLY 42 2HA GLY 42 13.103 21.091 5.912
293 HA PRO 43 HA PRO 43 11.360 18.078 9.221
294 HB2 PRO 43 1HB PRO 43 13.659 17.322 10.451
295 HB3 PRO 43 2HB PRO 43 12.932 16.406 9.126
296 HG2 PRO 43 1HG PRO 43 15.198 18.360 9.057
297 HG3 PRO 43 2HG PRO 43 15.046 16.795 8.238
298 HD2 PRO 43 1HD PRO 43 14.615 19.150 6.973
299 HD3 PRO 43 2HD PRO 43 13.739 17.665 6.549
300 H SER 44 H SER 44 13.003 20.907 8.863
301 HA SER 44 HA SER 44 14.060 21.827 11.127
302 HB2 SER 44 1HB SER 44 11.921 23.196 9.485
303 HB3 SER 44 2HB SER 44 12.863 24.014 10.732
304 HG SER 44 HG SER 44 13.724 22.939 8.274
305 H SER 45 H SER 45 10.586 21.308 10.667
306 HA SER 45 HA SER 45 10.161 21.815 13.529
307 HB2 SER 45 1HB SER 45 8.751 23.092 11.938
308 HB3 SER 45 2HB SER 45 8.112 21.572 11.312
309 HG SER 45 HG SER 45 6.667 21.960 12.821
310 H GLY 46 H GLY 46 10.937 19.824 14.300
311 HA2 GLY 46 1HA GLY 46 10.590 17.698 15.113
312 HA3 GLY 46 2HA GLY 46 8.980 17.755 14.410
Start of MODEL 12
1 H1 GLY 1 H GLY 1 -19.064 -14.869 14.796
2 HA2 GLY 1 1HA GLY 1 -21.512 -15.566 13.386
3 HA3 GLY 1 2HA GLY 1 -21.236 -14.120 14.347
4 H SER 2 H SER 2 -21.709 -12.485 13.010
5 HA SER 2 HA SER 2 -21.030 -12.558 10.214
6 HB2 SER 2 1HB SER 2 -22.349 -10.539 12.012
7 HB3 SER 2 2HB SER 2 -21.864 -10.104 10.373
8 HG SER 2 HG SER 2 -23.359 -11.406 9.562
9 H SER 3 H SER 3 -20.176 -10.291 12.837
10 HA SER 3 HA SER 3 -17.524 -9.996 11.596
11 HB2 SER 3 1HB SER 3 -17.565 -7.592 12.131
12 HB3 SER 3 2HB SER 3 -18.874 -8.024 11.031
13 HG SER 3 HG SER 3 -19.176 -6.708 13.186
14 H GLY 4 H GLY 4 -15.870 -9.148 13.094
15 HA2 GLY 4 1HA GLY 4 -16.328 -9.096 15.902
16 HA3 GLY 4 2HA GLY 4 -15.661 -10.647 15.413
17 H SER 5 H SER 5 -15.046 -7.240 14.550
18 HA SER 5 HA SER 5 -13.056 -6.173 14.134
19 HB2 SER 5 1HB SER 5 -11.644 -6.003 16.108
20 HB3 SER 5 2HB SER 5 -13.338 -6.006 16.598
21 HG SER 5 HG SER 5 -12.115 -7.409 17.899
22 H SER 6 H SER 6 -13.129 -8.569 12.750
23 HA SER 6 HA SER 6 -10.575 -9.900 13.186
24 HB2 SER 6 1HB SER 6 -11.308 -11.501 11.534
25 HB3 SER 6 2HB SER 6 -12.646 -11.203 12.643
26 HG SER 6 HG SER 6 -12.358 -9.803 10.201
27 H GLY 7 H GLY 7 -9.438 -10.484 10.971
28 HA2 GLY 7 1HA GLY 7 -9.454 -8.332 9.038
29 HA3 GLY 7 2HA GLY 7 -8.024 -8.369 10.060
30 H THR 8 H THR 8 -9.758 -9.923 7.486
31 HA THR 8 HA THR 8 -7.338 -11.439 6.830
32 HB THR 8 HB THR 8 -8.811 -13.027 7.982
33 HG1 THR 8 HG1 THR 8 -8.633 -13.409 5.161
34 HG21 THR 8 3HG2 THR 8 -10.862 -13.394 6.065
35 HG22 THR 8 1HG2 THR 8 -10.842 -11.683 6.492
36 HG23 THR 8 2HG2 THR 8 -11.022 -12.904 7.752
37 H GLY 9 H GLY 9 -7.271 -12.161 4.584
38 HA2 GLY 9 1HA GLY 9 -7.913 -12.058 2.328
39 HA3 GLY 9 2HA GLY 9 -9.197 -10.941 2.767
40 H GLU 10 H GLU 10 -6.188 -11.239 1.335
41 HA GLU 10 HA GLU 10 -5.567 -8.391 1.715
42 HB2 GLU 10 1HB GLU 10 -3.322 -8.912 0.941
43 HB3 GLU 10 2HB GLU 10 -3.762 -9.970 2.274
44 HG2 GLU 10 1HG GLU 10 -4.483 -11.598 0.370
45 HG3 GLU 10 2HG GLU 10 -3.402 -10.610 -0.612
46 H LYS 11 H LYS 11 -4.520 -7.365 -0.276
47 HA LYS 11 HA LYS 11 -6.350 -7.745 -2.504
48 HB2 LYS 11 1HB LYS 11 -4.531 -5.587 -1.579
49 HB3 LYS 11 2HB LYS 11 -4.820 -5.692 -3.310
50 HG2 LYS 11 1HG LYS 11 -6.387 -4.155 -2.400
51 HG3 LYS 11 2HG LYS 11 -7.267 -5.623 -2.833
52 HD2 LYS 11 1HD LYS 11 -6.211 -5.414 -0.066
53 HD3 LYS 11 2HD LYS 11 -7.597 -4.407 -0.491
54 HE2 LYS 11 1HE LYS 11 -8.840 -6.367 -1.191
55 HE3 LYS 11 2HE LYS 11 -7.442 -7.395 -0.879
56 HZ1 LYS 11 3HZ LYS 11 -9.354 -7.107 0.878
57 HZ2 LYS 11 1HZ LYS 11 -8.449 -5.748 1.319
58 HZ3 LYS 11 2HZ LYS 11 -7.741 -7.283 1.358
59 HA PRO 12 HA PRO 12 -3.580 -9.860 -5.173
60 HB2 PRO 12 1HB PRO 12 -4.254 -8.817 -7.587
61 HB3 PRO 12 2HB PRO 12 -5.293 -9.940 -6.701
62 HG2 PRO 12 1HG PRO 12 -5.448 -6.956 -6.880
63 HG3 PRO 12 2HG PRO 12 -6.756 -8.151 -6.958
64 HD2 PRO 12 1HD PRO 12 -6.201 -6.743 -4.712
65 HD3 PRO 12 2HD PRO 12 -6.834 -8.401 -4.668
66 H PHE 13 H PHE 13 -3.142 -6.715 -4.371
67 HA PHE 13 HA PHE 13 -0.603 -6.592 -5.826
68 HB2 PHE 13 1HB PHE 13 -2.553 -4.288 -5.613
69 HB3 PHE 13 2HB PHE 13 -0.933 -4.196 -6.298
70 HD1 PHE 13 HD1 PHE 13 -0.432 -5.206 -8.450
71 HD2 PHE 13 HD2 PHE 13 -4.362 -5.310 -6.819
72 HE1 PHE 13 HE1 PHE 13 -1.327 -5.827 -10.656
73 HE2 PHE 13 HE2 PHE 13 -5.263 -5.932 -9.022
74 HZ PHE 13 HZ PHE 13 -3.746 -6.192 -10.944
75 H LYS 14 H LYS 14 0.870 -4.912 -4.892
76 HA LYS 14 HA LYS 14 0.346 -4.015 -2.209
77 HB2 LYS 14 1HB LYS 14 0.945 -6.356 -1.789
78 HB3 LYS 14 2HB LYS 14 2.446 -6.140 -2.679
79 HG2 LYS 14 1HG LYS 14 2.885 -4.255 -0.936
80 HG3 LYS 14 2HG LYS 14 1.679 -5.123 0.016
81 HD2 LYS 14 1HD LYS 14 3.008 -7.176 -0.188
82 HD3 LYS 14 2HD LYS 14 4.218 -6.294 -1.124
83 HE2 LYS 14 1HE LYS 14 4.393 -4.735 0.883
84 HE3 LYS 14 2HE LYS 14 3.478 -5.954 1.771
85 HZ1 LYS 14 3HZ LYS 14 6.129 -6.296 0.483
86 HZ2 LYS 14 1HZ LYS 14 5.225 -7.572 1.127
87 HZ3 LYS 14 2HZ LYS 14 5.782 -6.337 2.139
88 H CYS 15 H CYS 15 1.874 -2.511 -1.460
89 HA CYS 15 HA CYS 15 3.333 -1.185 -3.557
90 HB2 CYS 15 1HB CYS 15 2.022 -0.155 -1.532
91 HB3 CYS 15 2HB CYS 15 3.537 -0.408 -0.671
92 H ASP 16 H ASP 16 5.591 -0.270 -2.834
93 HA ASP 16 HA ASP 16 7.189 -2.539 -1.840
94 HB2 ASP 16 1HB ASP 16 7.538 -0.786 -4.218
95 HB3 ASP 16 2HB ASP 16 8.994 -1.270 -3.353
96 H ILE 17 H ILE 17 6.496 0.828 -1.656
97 HA ILE 17 HA ILE 17 8.875 1.435 -0.098
98 HB ILE 17 HB ILE 17 6.531 3.264 -0.587
99 HG12 ILE 17 1HG1 ILE 17 8.323 4.121 -2.387
100 HG13 ILE 17 2HG1 ILE 17 8.731 2.409 -2.397
101 HG21 ILE 17 1HG2 ILE 17 8.116 5.031 -0.171
102 HG22 ILE 17 2HG2 ILE 17 8.159 3.886 1.169
103 HG23 ILE 17 3HG2 ILE 17 9.435 3.867 -0.048
104 HD11 ILE 17 3HD1 ILE 17 5.893 2.725 -2.543
105 HD12 ILE 17 1HD1 ILE 17 6.675 3.697 -3.790
106 HD13 ILE 17 2HD1 ILE 17 6.996 1.965 -3.690
107 H CYS 18 H CYS 18 5.353 1.344 0.373
108 HA CYS 18 HA CYS 18 5.837 1.201 3.277
109 HB2 CYS 18 1HB CYS 18 3.658 2.264 3.614
110 HB3 CYS 18 2HB CYS 18 4.705 3.288 2.636
111 H GLY 19 H GLY 19 4.901 -0.532 0.624
112 HA2 GLY 19 1HA GLY 19 4.094 -2.693 0.486
113 HA3 GLY 19 2HA GLY 19 3.893 -2.685 2.232
114 H LYS 20 H LYS 20 2.422 -0.007 0.836
115 HA LYS 20 HA LYS 20 -0.147 -0.642 1.652
116 HB2 LYS 20 1HB LYS 20 1.050 1.371 -0.162
117 HB3 LYS 20 2HB LYS 20 -0.676 1.091 -0.349
118 HG2 LYS 20 1HG LYS 20 0.579 1.687 2.312
119 HG3 LYS 20 2HG LYS 20 0.014 2.951 1.218
120 HD2 LYS 20 1HD LYS 20 -2.192 2.414 1.518
121 HD3 LYS 20 2HD LYS 20 -1.844 0.720 1.869
122 HE2 LYS 20 1HE LYS 20 -1.039 1.296 4.068
123 HE3 LYS 20 2HE LYS 20 -1.208 3.015 3.719
124 HZ1 LYS 20 3HZ LYS 20 -3.522 2.867 3.756
125 HZ2 LYS 20 1HZ LYS 20 -3.036 1.910 5.065
126 HZ3 LYS 20 2HZ LYS 20 -3.524 1.181 3.619
127 H SER 21 H SER 21 -1.834 -1.724 0.801
128 HA SER 21 HA SER 21 -1.368 -3.148 -1.718
129 HB2 SER 21 1HB SER 21 -2.803 -4.817 -0.956
130 HB3 SER 21 2HB SER 21 -2.049 -4.274 0.542
131 HG SER 21 HG SER 21 -4.498 -4.478 0.339
132 H PHE 22 H PHE 22 -3.088 -3.351 -3.270
133 HA PHE 22 HA PHE 22 -5.292 -1.470 -3.104
134 HB2 PHE 22 1HB PHE 22 -3.284 -1.297 -5.360
135 HB3 PHE 22 2HB PHE 22 -4.749 -0.335 -5.192
136 HD1 PHE 22 HD1 PHE 22 -1.522 -1.080 -3.508
137 HD2 PHE 22 HD2 PHE 22 -4.683 1.709 -4.099
138 HE1 PHE 22 HE1 PHE 22 -0.256 0.616 -2.252
139 HE2 PHE 22 HE2 PHE 22 -3.422 3.409 -2.845
140 HZ PHE 22 HZ PHE 22 -1.205 2.864 -1.921
141 H CYS 23 H CYS 23 -7.032 -2.512 -3.785
142 HA CYS 23 HA CYS 23 -7.134 -5.029 -4.855
143 HB2 CYS 23 1HB CYS 23 -9.441 -4.423 -5.650
144 HB3 CYS 23 2HB CYS 23 -9.123 -4.038 -3.963
145 HG CYS 23 HG CYS 23 -10.613 -1.935 -4.796
146 H GLY 24 H GLY 24 -6.654 -2.001 -6.530
147 HA2 GLY 24 1HA GLY 24 -6.264 -3.531 -9.022
148 HA3 GLY 24 2HA GLY 24 -7.177 -2.029 -9.027
149 H ARG 25 H ARG 25 -4.358 -3.203 -9.949
150 HA ARG 25 HA ARG 25 -2.329 -1.677 -8.872
151 HB2 ARG 25 1HB ARG 25 -2.263 -3.521 -10.693
152 HB3 ARG 25 2HB ARG 25 -2.473 -2.194 -11.827
153 HG2 ARG 25 1HG ARG 25 -0.211 -2.291 -11.814
154 HG3 ARG 25 2HG ARG 25 -0.439 -1.196 -10.449
155 HD2 ARG 25 1HD ARG 25 -0.397 -3.213 -8.954
156 HD3 ARG 25 2HD ARG 25 0.079 -4.161 -10.362
157 HE ARG 25 HE ARG 25 1.742 -1.862 -9.786
158 HH11 ARG 25 1HH1 ARG 25 1.231 -5.279 -9.360
159 HH12 ARG 25 2HH1 ARG 25 2.888 -5.612 -8.979
160 HH21 ARG 25 1HH2 ARG 25 3.926 -2.287 -9.285
161 HH22 ARG 25 2HH2 ARG 25 4.420 -3.909 -8.936
162 H SER 26 H SER 26 -4.530 -0.830 -11.524
163 HA SER 26 HA SER 26 -3.594 1.487 -12.483
164 HB2 SER 26 1HB SER 26 -5.818 0.479 -13.035
165 HB3 SER 26 2HB SER 26 -6.460 1.192 -11.556
166 HG SER 26 HG SER 26 -5.240 2.666 -13.652
167 H ARG 27 H ARG 27 -4.755 0.988 -9.238
168 HA ARG 27 HA ARG 27 -4.634 3.832 -8.618
169 HB2 ARG 27 1HB ARG 27 -6.332 1.991 -7.724
170 HB3 ARG 27 2HB ARG 27 -5.078 1.771 -6.512
171 HG2 ARG 27 1HG ARG 27 -6.286 4.448 -7.144
172 HG3 ARG 27 2HG ARG 27 -6.933 3.361 -5.914
173 HD2 ARG 27 1HD ARG 27 -5.544 4.553 -4.579
174 HD3 ARG 27 2HD ARG 27 -4.370 3.374 -5.162
175 HE ARG 27 HE ARG 27 -4.191 5.356 -6.985
176 HH11 ARG 27 1HH1 ARG 27 -4.068 5.307 -3.506
177 HH12 ARG 27 2HH1 ARG 27 -3.010 6.674 -3.394
178 HH21 ARG 27 1HH2 ARG 27 -2.799 7.158 -6.850
179 HH22 ARG 27 2HH2 ARG 27 -2.290 7.727 -5.297
180 H LEU 28 H LEU 28 -3.155 0.821 -7.409
181 HA LEU 28 HA LEU 28 -1.345 1.884 -5.633
182 HB2 LEU 28 1HB LEU 28 -1.480 -0.427 -5.640
183 HB3 LEU 28 2HB LEU 28 -1.295 -0.532 -7.389
184 HG LEU 28 HG LEU 28 1.074 -0.051 -7.197
185 HD11 LEU 28 1HD1 LEU 28 0.442 0.272 -4.277
186 HD12 LEU 28 2HD1 LEU 28 1.212 1.425 -5.366
187 HD13 LEU 28 3HD1 LEU 28 2.075 -0.031 -4.872
188 HD21 LEU 28 3HD2 LEU 28 -0.231 -2.342 -6.014
189 HD22 LEU 28 1HD2 LEU 28 1.354 -2.058 -5.295
190 HD23 LEU 28 2HD2 LEU 28 1.202 -2.266 -7.040
191 H ASN 29 H ASN 29 -0.656 1.094 -9.045
192 HA ASN 29 HA ASN 29 1.871 1.934 -9.360
193 HB2 ASN 29 1HB ASN 29 -0.523 2.116 -11.115
194 HB3 ASN 29 2HB ASN 29 0.906 3.018 -11.613
195 HD21 ASN 29 1HD2 ASN 29 -0.636 0.288 -12.178
196 HD22 ASN 29 2HD2 ASN 29 0.680 -0.776 -12.524
197 H ARG 30 H ARG 30 -0.928 4.136 -9.475
198 HA ARG 30 HA ARG 30 0.561 6.504 -9.749
199 HB2 ARG 30 1HB ARG 30 -2.121 6.289 -8.386
200 HB3 ARG 30 2HB ARG 30 -1.460 7.669 -9.254
201 HG2 ARG 30 1HG ARG 30 -2.489 5.084 -10.373
202 HG3 ARG 30 2HG ARG 30 -3.061 6.724 -10.684
203 HD2 ARG 30 1HD ARG 30 -1.039 7.250 -11.885
204 HD3 ARG 30 2HD ARG 30 -0.340 5.687 -11.464
205 HE ARG 30 HE ARG 30 -2.627 5.046 -12.785
206 HH11 ARG 30 1HH1 ARG 30 0.129 7.040 -13.523
207 HH12 ARG 30 2HH1 ARG 30 0.033 6.767 -15.231
208 HH21 ARG 30 1HH2 ARG 30 -2.764 4.679 -15.032
209 HH22 ARG 30 2HH2 ARG 30 -1.614 5.424 -16.088
210 H HIS 31 H HIS 31 -0.618 4.783 -6.896
211 HA HIS 31 HA HIS 31 0.016 6.678 -4.953
212 HB2 HIS 31 1HB HIS 31 -1.296 4.844 -4.259
213 HB3 HIS 31 2HB HIS 31 -0.138 3.672 -4.882
214 HD1 HIS 31 HD1 HIS 31 -0.431 6.231 -2.096
215 HD2 HIS 31 HD2 HIS 31 1.633 2.749 -3.032
216 HE1 HIS 31 HE1 HIS 31 0.845 5.626 -0.016
217 H SER 32 H SER 32 2.014 4.167 -6.435
218 HA SER 32 HA SER 32 4.266 4.404 -4.802
219 HB2 SER 32 1HB SER 32 3.918 2.592 -6.465
220 HB3 SER 32 2HB SER 32 4.215 3.752 -7.759
221 HG SER 32 HG SER 32 5.992 2.562 -5.988
222 H MET 33 H MET 33 2.937 6.637 -6.965
223 HA MET 33 HA MET 33 5.436 7.980 -7.570
224 HB2 MET 33 1HB MET 33 2.661 9.025 -8.107
225 HB3 MET 33 2HB MET 33 4.157 9.449 -8.928
226 HG2 MET 33 1HG MET 33 3.136 6.645 -9.018
227 HG3 MET 33 2HG MET 33 2.460 7.877 -10.081
228 HE1 MET 33 3HE MET 33 5.603 5.180 -11.011
229 HE2 MET 33 1HE MET 33 6.165 5.873 -9.489
230 HE3 MET 33 2HE MET 33 4.529 5.225 -9.612
231 H VAL 34 H VAL 34 2.800 8.228 -5.313
232 HA VAL 34 HA VAL 34 3.229 10.895 -4.472
233 HB VAL 34 HB VAL 34 1.833 10.408 -2.598
234 HG11 VAL 34 1HG1 VAL 34 1.057 9.025 -5.140
235 HG12 VAL 34 2HG1 VAL 34 -0.033 9.056 -3.752
236 HG13 VAL 34 3HG1 VAL 34 0.495 10.567 -4.495
237 HG21 VAL 34 3HG2 VAL 34 1.330 7.623 -2.828
238 HG22 VAL 34 1HG2 VAL 34 3.074 7.858 -2.718
239 HG23 VAL 34 2HG2 VAL 34 2.016 8.507 -1.465
240 H HIS 35 H HIS 35 4.900 7.955 -3.850
241 HA HIS 35 HA HIS 35 6.061 8.671 -1.351
242 HB2 HIS 35 1HB HIS 35 6.694 6.599 -3.435
243 HB3 HIS 35 2HB HIS 35 7.759 6.848 -2.054
244 HD1 HIS 35 HD1 HIS 35 6.659 6.406 0.340
245 HD2 HIS 35 HD2 HIS 35 4.476 5.073 -2.934
246 HE1 HIS 35 HE1 HIS 35 4.971 4.791 1.270
247 H THR 36 H THR 36 6.805 9.365 -4.664
248 HA THR 36 HA THR 36 9.363 10.580 -3.859
249 HB THR 36 HB THR 36 9.444 8.858 -5.681
250 HG1 THR 36 HG1 THR 36 10.166 11.474 -6.550
251 HG21 THR 36 3HG2 THR 36 8.609 9.394 -7.874
252 HG22 THR 36 1HG2 THR 36 8.043 10.970 -7.322
253 HG23 THR 36 2HG2 THR 36 7.274 9.499 -6.726
254 H ALA 37 H ALA 37 6.674 11.750 -3.509
255 HA ALA 37 HA ALA 37 6.682 13.962 -5.419
256 HB1 ALA 37 3HB ALA 37 4.711 13.466 -3.198
257 HB2 ALA 37 1HB ALA 37 4.519 14.520 -4.599
258 HB3 ALA 37 2HB ALA 37 4.562 12.769 -4.811
259 H GLU 38 H GLU 38 8.873 13.839 -3.634
260 HA GLU 38 HA GLU 38 8.360 16.232 -1.994
261 HB2 GLU 38 1HB GLU 38 9.872 13.733 -1.346
262 HB3 GLU 38 2HB GLU 38 10.383 15.255 -0.630
263 HG2 GLU 38 1HG GLU 38 8.185 15.555 0.354
264 HG3 GLU 38 2HG GLU 38 7.629 14.062 -0.400
265 H LYS 39 H LYS 39 9.010 17.397 -3.936
266 HA LYS 39 HA LYS 39 11.375 17.196 -5.307
267 HB2 LYS 39 1HB LYS 39 9.816 19.647 -4.494
268 HB3 LYS 39 2HB LYS 39 11.201 19.719 -5.576
269 HG2 LYS 39 1HG LYS 39 9.982 18.055 -7.036
270 HG3 LYS 39 2HG LYS 39 8.563 18.355 -6.029
271 HD2 LYS 39 1HD LYS 39 10.092 20.543 -7.425
272 HD3 LYS 39 2HD LYS 39 8.707 19.719 -8.145
273 HE2 LYS 39 1HE LYS 39 7.374 20.386 -6.137
274 HE3 LYS 39 2HE LYS 39 8.751 21.354 -5.613
275 HZ1 LYS 39 3HZ LYS 39 7.486 22.883 -6.739
276 HZ2 LYS 39 1HZ LYS 39 6.952 21.775 -7.901
277 HZ3 LYS 39 2HZ LYS 39 8.532 22.375 -7.967
278 HA PRO 40 HA PRO 40 14.680 18.163 -2.584
279 HB2 PRO 40 1HB PRO 40 16.399 19.413 -4.273
280 HB3 PRO 40 2HB PRO 40 16.097 17.672 -4.324
281 HG2 PRO 40 1HG PRO 40 14.956 19.843 -6.040
282 HG3 PRO 40 2HG PRO 40 15.553 18.242 -6.512
283 HD2 PRO 40 1HD PRO 40 12.916 18.788 -6.231
284 HD3 PRO 40 2HD PRO 40 13.603 17.189 -5.880
285 H SER 41 H SER 41 12.633 20.479 -3.763
286 HA SER 41 HA SER 41 13.658 22.944 -3.564
287 HB2 SER 41 1HB SER 41 11.127 22.004 -2.195
288 HB3 SER 41 2HB SER 41 11.531 23.691 -2.513
289 HG SER 41 HG SER 41 11.531 21.828 -4.618
290 H GLY 42 H GLY 42 12.673 21.051 -0.704
291 HA2 GLY 42 1HA GLY 42 14.641 21.225 1.007
292 HA3 GLY 42 2HA GLY 42 14.168 22.918 0.993
293 HA PRO 43 HA PRO 43 11.467 20.121 3.834
294 HB2 PRO 43 1HB PRO 43 12.863 20.239 6.159
295 HB3 PRO 43 2HB PRO 43 13.083 18.949 4.971
296 HG2 PRO 43 1HG PRO 43 14.731 21.406 5.427
297 HG3 PRO 43 2HG PRO 43 15.264 19.744 5.115
298 HD2 PRO 43 1HD PRO 43 15.217 21.644 3.187
299 HD3 PRO 43 2HD PRO 43 14.924 19.928 2.843
300 H SER 44 H SER 44 9.833 21.264 4.648
301 HA SER 44 HA SER 44 10.311 24.026 5.482
302 HB2 SER 44 1HB SER 44 8.512 23.402 3.792
303 HB3 SER 44 2HB SER 44 7.631 22.676 5.135
304 HG SER 44 HG SER 44 7.393 25.090 4.446
305 H SER 45 H SER 45 11.273 22.198 7.289
306 HA SER 45 HA SER 45 9.302 22.325 9.478
307 HB2 SER 45 1HB SER 45 9.803 20.015 8.937
308 HB3 SER 45 2HB SER 45 11.535 20.331 9.025
309 HG SER 45 HG SER 45 11.447 20.320 11.153
310 H GLY 46 H GLY 46 9.771 23.968 10.783
311 HA2 GLY 46 1HA GLY 46 11.968 25.520 10.967
312 HA3 GLY 46 2HA GLY 46 10.978 25.148 12.370
Start of MODEL 13
1 H1 GLY 1 H GLY 1 -12.050 -0.169 22.886
2 HA2 GLY 1 1HA GLY 1 -11.887 -2.489 22.768
3 HA3 GLY 1 2HA GLY 1 -13.617 -2.324 23.032
4 H SER 2 H SER 2 -11.186 -2.360 20.440
5 HA SER 2 HA SER 2 -12.881 -2.700 18.275
6 HB2 SER 2 1HB SER 2 -10.958 -3.658 17.101
7 HB3 SER 2 2HB SER 2 -10.455 -2.278 18.077
8 HG SER 2 HG SER 2 -9.540 -4.763 18.165
9 H SER 3 H SER 3 -13.761 -4.456 17.219
10 HA SER 3 HA SER 3 -14.020 -6.877 18.856
11 HB2 SER 3 1HB SER 3 -16.032 -7.347 17.531
12 HB3 SER 3 2HB SER 3 -16.115 -5.734 18.241
13 HG SER 3 HG SER 3 -16.726 -5.776 16.018
14 H GLY 4 H GLY 4 -14.470 -8.906 17.416
15 HA2 GLY 4 1HA GLY 4 -12.069 -9.530 16.085
16 HA3 GLY 4 2HA GLY 4 -13.534 -10.500 16.056
17 H SER 5 H SER 5 -11.485 -8.446 14.293
18 HA SER 5 HA SER 5 -13.101 -7.318 12.368
19 HB2 SER 5 1HB SER 5 -10.299 -8.407 12.252
20 HB3 SER 5 2HB SER 5 -11.060 -7.715 10.819
21 HG SER 5 HG SER 5 -11.083 -6.288 13.239
22 H SER 6 H SER 6 -11.698 -10.582 12.380
23 HA SER 6 HA SER 6 -12.157 -12.447 11.155
24 HB2 SER 6 1HB SER 6 -14.959 -11.309 11.051
25 HB3 SER 6 2HB SER 6 -14.497 -13.003 10.890
26 HG SER 6 HG SER 6 -15.207 -11.925 13.069
27 H GLY 7 H GLY 7 -11.053 -10.400 9.646
28 HA2 GLY 7 1HA GLY 7 -12.362 -10.872 7.044
29 HA3 GLY 7 2HA GLY 7 -11.792 -9.269 7.486
30 H THR 8 H THR 8 -10.884 -12.462 6.464
31 HA THR 8 HA THR 8 -8.067 -11.642 6.298
32 HB THR 8 HB THR 8 -8.489 -13.773 7.457
33 HG1 THR 8 HG1 THR 8 -7.303 -14.629 5.086
34 HG21 THR 8 3HG2 THR 8 -9.393 -15.680 6.347
35 HG22 THR 8 1HG2 THR 8 -9.436 -14.837 4.799
36 HG23 THR 8 2HG2 THR 8 -10.528 -14.353 6.097
37 H GLY 9 H GLY 9 -7.047 -11.404 4.381
38 HA2 GLY 9 1HA GLY 9 -7.138 -12.456 2.004
39 HA3 GLY 9 2HA GLY 9 -8.707 -11.665 1.972
40 H GLU 10 H GLU 10 -5.311 -11.275 1.646
41 HA GLU 10 HA GLU 10 -5.370 -8.389 1.707
42 HB2 GLU 10 1HB GLU 10 -3.253 -10.437 1.113
43 HB3 GLU 10 2HB GLU 10 -2.979 -8.733 0.778
44 HG2 GLU 10 1HG GLU 10 -3.699 -9.872 3.469
45 HG3 GLU 10 2HG GLU 10 -2.072 -9.439 2.947
46 H LYS 11 H LYS 11 -5.049 -7.009 -0.057
47 HA LYS 11 HA LYS 11 -6.457 -7.591 -2.381
48 HB2 LYS 11 1HB LYS 11 -4.575 -5.449 -1.541
49 HB3 LYS 11 2HB LYS 11 -4.908 -5.594 -3.262
50 HG2 LYS 11 1HG LYS 11 -6.415 -3.995 -2.348
51 HG3 LYS 11 2HG LYS 11 -7.337 -5.449 -2.737
52 HD2 LYS 11 1HD LYS 11 -6.222 -5.196 0.007
53 HD3 LYS 11 2HD LYS 11 -7.609 -4.190 -0.417
54 HE2 LYS 11 1HE LYS 11 -7.473 -7.190 -0.709
55 HE3 LYS 11 2HE LYS 11 -8.268 -6.332 0.610
56 HZ1 LYS 11 3HZ LYS 11 -9.061 -6.525 -2.217
57 HZ2 LYS 11 1HZ LYS 11 -9.549 -5.190 -1.300
58 HZ3 LYS 11 2HZ LYS 11 -9.997 -6.750 -0.826
59 HA PRO 12 HA PRO 12 -3.751 -9.832 -5.012
60 HB2 PRO 12 1HB PRO 12 -4.405 -8.827 -7.448
61 HB3 PRO 12 2HB PRO 12 -5.470 -9.902 -6.535
62 HG2 PRO 12 1HG PRO 12 -5.548 -6.920 -6.782
63 HG3 PRO 12 2HG PRO 12 -6.887 -8.081 -6.829
64 HD2 PRO 12 1HD PRO 12 -6.289 -6.637 -4.618
65 HD3 PRO 12 2HD PRO 12 -6.964 -8.277 -4.534
66 H PHE 13 H PHE 13 -3.215 -6.696 -4.266
67 HA PHE 13 HA PHE 13 -0.684 -6.668 -5.738
68 HB2 PHE 13 1HB PHE 13 -2.579 -4.315 -5.571
69 HB3 PHE 13 2HB PHE 13 -0.953 -4.266 -6.245
70 HD1 PHE 13 HD1 PHE 13 -0.457 -5.317 -8.378
71 HD2 PHE 13 HD2 PHE 13 -4.399 -5.324 -6.772
72 HE1 PHE 13 HE1 PHE 13 -1.350 -5.956 -10.580
73 HE2 PHE 13 HE2 PHE 13 -5.298 -5.964 -8.970
74 HZ PHE 13 HZ PHE 13 -3.773 -6.282 -10.878
75 H LYS 14 H LYS 14 0.809 -4.946 -4.853
76 HA LYS 14 HA LYS 14 0.320 -4.046 -2.162
77 HB2 LYS 14 1HB LYS 14 0.959 -6.374 -1.745
78 HB3 LYS 14 2HB LYS 14 2.433 -6.148 -2.677
79 HG2 LYS 14 1HG LYS 14 2.929 -4.267 -0.964
80 HG3 LYS 14 2HG LYS 14 1.726 -5.096 0.026
81 HD2 LYS 14 1HD LYS 14 3.021 -7.183 -0.195
82 HD3 LYS 14 2HD LYS 14 4.241 -6.307 -1.123
83 HE2 LYS 14 1HE LYS 14 4.565 -4.807 0.831
84 HE3 LYS 14 2HE LYS 14 3.446 -5.817 1.745
85 HZ1 LYS 14 3HZ LYS 14 5.075 -7.230 2.188
86 HZ2 LYS 14 1HZ LYS 14 6.172 -6.178 1.444
87 HZ3 LYS 14 2HZ LYS 14 5.447 -7.416 0.548
88 H CYS 15 H CYS 15 1.875 -2.547 -1.424
89 HA CYS 15 HA CYS 15 3.259 -1.187 -3.554
90 HB2 CYS 15 1HB CYS 15 1.983 -0.164 -1.518
91 HB3 CYS 15 2HB CYS 15 3.496 -0.435 -0.659
92 H ASP 16 H ASP 16 5.525 -0.271 -2.931
93 HA ASP 16 HA ASP 16 7.172 -2.530 -1.998
94 HB2 ASP 16 1HB ASP 16 7.457 -0.686 -4.317
95 HB3 ASP 16 2HB ASP 16 8.931 -1.193 -3.498
96 H ILE 17 H ILE 17 6.415 0.806 -1.665
97 HA ILE 17 HA ILE 17 8.817 1.390 -0.125
98 HB ILE 17 HB ILE 17 6.462 3.223 -0.539
99 HG12 ILE 17 1HG1 ILE 17 8.215 4.140 -2.340
100 HG13 ILE 17 2HG1 ILE 17 8.650 2.435 -2.397
101 HG21 ILE 17 1HG2 ILE 17 9.371 3.764 0.043
102 HG22 ILE 17 2HG2 ILE 17 8.109 4.980 -0.152
103 HG23 ILE 17 3HG2 ILE 17 8.050 3.858 1.207
104 HD11 ILE 17 3HD1 ILE 17 5.785 2.833 -2.512
105 HD12 ILE 17 1HD1 ILE 17 6.634 3.667 -3.813
106 HD13 ILE 17 2HD1 ILE 17 6.850 1.931 -3.590
107 H CYS 18 H CYS 18 5.292 1.371 0.378
108 HA CYS 18 HA CYS 18 5.800 1.106 3.269
109 HB2 CYS 18 1HB CYS 18 3.598 2.144 3.634
110 HB3 CYS 18 2HB CYS 18 4.676 3.209 2.737
111 H GLY 19 H GLY 19 4.896 -0.582 0.599
112 HA2 GLY 19 1HA GLY 19 4.074 -2.732 0.409
113 HA3 GLY 19 2HA GLY 19 3.858 -2.756 2.153
114 H LYS 20 H LYS 20 2.391 -0.035 0.918
115 HA LYS 20 HA LYS 20 -0.172 -0.662 1.667
116 HB2 LYS 20 1HB LYS 20 1.032 1.338 -0.156
117 HB3 LYS 20 2HB LYS 20 -0.697 1.068 -0.335
118 HG2 LYS 20 1HG LYS 20 0.577 1.669 2.317
119 HG3 LYS 20 2HG LYS 20 0.007 2.930 1.221
120 HD2 LYS 20 1HD LYS 20 -2.191 2.429 1.570
121 HD3 LYS 20 2HD LYS 20 -1.867 0.718 1.857
122 HE2 LYS 20 1HE LYS 20 -1.065 2.877 3.792
123 HE3 LYS 20 2HE LYS 20 -2.635 2.078 3.855
124 HZ1 LYS 20 3HZ LYS 20 -0.073 1.129 4.717
125 HZ2 LYS 20 1HZ LYS 20 -0.865 0.019 3.716
126 HZ3 LYS 20 2HZ LYS 20 -1.620 0.577 5.123
127 H SER 21 H SER 21 -1.869 -1.733 0.821
128 HA SER 21 HA SER 21 -1.414 -3.170 -1.692
129 HB2 SER 21 1HB SER 21 -2.784 -4.851 -0.900
130 HB3 SER 21 2HB SER 21 -2.149 -4.227 0.622
131 HG SER 21 HG SER 21 -4.454 -4.484 0.601
132 H PHE 22 H PHE 22 -3.076 -3.318 -3.281
133 HA PHE 22 HA PHE 22 -5.279 -1.423 -3.113
134 HB2 PHE 22 1HB PHE 22 -3.274 -1.312 -5.375
135 HB3 PHE 22 2HB PHE 22 -4.720 -0.322 -5.214
136 HD1 PHE 22 HD1 PHE 22 -1.546 -1.132 -3.449
137 HD2 PHE 22 HD2 PHE 22 -4.571 1.759 -4.226
138 HE1 PHE 22 HE1 PHE 22 -0.246 0.554 -2.216
139 HE2 PHE 22 HE2 PHE 22 -3.276 3.450 -2.996
140 HZ PHE 22 HZ PHE 22 -1.110 2.849 -1.989
141 H CYS 23 H CYS 23 -7.052 -2.373 -3.852
142 HA CYS 23 HA CYS 23 -7.214 -4.924 -4.855
143 HB2 CYS 23 1HB CYS 23 -9.494 -4.316 -5.637
144 HB3 CYS 23 2HB CYS 23 -9.166 -3.781 -3.993
145 HG CYS 23 HG CYS 23 -8.739 -1.113 -4.698
146 H GLY 24 H GLY 24 -6.654 -1.937 -6.591
147 HA2 GLY 24 1HA GLY 24 -6.244 -3.532 -9.038
148 HA3 GLY 24 2HA GLY 24 -7.143 -2.023 -9.095
149 H ARG 25 H ARG 25 -4.336 -3.226 -9.974
150 HA ARG 25 HA ARG 25 -2.300 -1.702 -8.897
151 HB2 ARG 25 1HB ARG 25 -2.189 -3.580 -10.650
152 HB3 ARG 25 2HB ARG 25 -2.456 -2.313 -11.840
153 HG2 ARG 25 1HG ARG 25 -0.202 -2.303 -11.872
154 HG3 ARG 25 2HG ARG 25 -0.425 -1.212 -10.502
155 HD2 ARG 25 1HD ARG 25 -0.110 -3.028 -8.948
156 HD3 ARG 25 2HD ARG 25 -0.039 -4.192 -10.270
157 HE ARG 25 HE ARG 25 1.957 -2.094 -10.338
158 HH11 ARG 25 1HH1 ARG 25 1.155 -5.341 -9.369
159 HH12 ARG 25 2HH1 ARG 25 2.806 -5.857 -9.265
160 HH21 ARG 25 1HH2 ARG 25 4.134 -2.761 -10.203
161 HH22 ARG 25 2HH2 ARG 25 4.500 -4.388 -9.738
162 H SER 26 H SER 26 -4.483 -0.881 -11.571
163 HA SER 26 HA SER 26 -3.520 1.403 -12.578
164 HB2 SER 26 1HB SER 26 -5.816 0.336 -12.980
165 HB3 SER 26 2HB SER 26 -6.385 1.321 -11.633
166 HG SER 26 HG SER 26 -5.759 3.165 -12.786
167 H ARG 27 H ARG 27 -4.696 0.991 -9.322
168 HA ARG 27 HA ARG 27 -4.511 3.845 -8.763
169 HB2 ARG 27 1HB ARG 27 -6.270 2.082 -7.847
170 HB3 ARG 27 2HB ARG 27 -5.031 1.831 -6.626
171 HG2 ARG 27 1HG ARG 27 -6.183 4.527 -7.298
172 HG3 ARG 27 2HG ARG 27 -6.803 3.482 -6.018
173 HD2 ARG 27 1HD ARG 27 -4.839 3.667 -4.758
174 HD3 ARG 27 2HD ARG 27 -3.909 4.259 -6.134
175 HE ARG 27 HE ARG 27 -4.545 6.368 -5.563
176 HH11 ARG 27 1HH1 ARG 27 -6.846 4.126 -4.223
177 HH12 ARG 27 2HH1 ARG 27 -7.747 5.347 -3.387
178 HH21 ARG 27 1HH2 ARG 27 -5.722 7.986 -4.466
179 HH22 ARG 27 2HH2 ARG 27 -7.106 7.543 -3.526
180 H LEU 28 H LEU 28 -3.152 0.834 -7.413
181 HA LEU 28 HA LEU 28 -1.330 1.863 -5.657
182 HB2 LEU 28 1HB LEU 28 -1.498 -0.445 -5.663
183 HB3 LEU 28 2HB LEU 28 -1.295 -0.554 -7.410
184 HG LEU 28 HG LEU 28 1.076 -0.132 -7.201
185 HD11 LEU 28 1HD1 LEU 28 2.087 -0.038 -4.907
186 HD12 LEU 28 2HD1 LEU 28 0.461 0.224 -4.277
187 HD13 LEU 28 3HD1 LEU 28 1.176 1.395 -5.386
188 HD21 LEU 28 3HD2 LEU 28 1.314 -2.099 -5.256
189 HD22 LEU 28 1HD2 LEU 28 1.152 -2.346 -6.995
190 HD23 LEU 28 2HD2 LEU 28 -0.279 -2.369 -5.964
191 H ASN 29 H ASN 29 -0.721 1.194 -9.105
192 HA ASN 29 HA ASN 29 1.868 1.961 -9.368
193 HB2 ASN 29 1HB ASN 29 -0.501 2.135 -11.151
194 HB3 ASN 29 2HB ASN 29 0.923 3.052 -11.633
195 HD21 ASN 29 1HD2 ASN 29 -0.591 0.286 -12.177
196 HD22 ASN 29 2HD2 ASN 29 0.742 -0.756 -12.527
197 H ARG 30 H ARG 30 -0.923 4.170 -9.492
198 HA ARG 30 HA ARG 30 0.587 6.533 -9.758
199 HB2 ARG 30 1HB ARG 30 -2.113 6.364 -8.430
200 HB3 ARG 30 2HB ARG 30 -1.432 7.708 -9.338
201 HG2 ARG 30 1HG ARG 30 -2.544 5.123 -10.355
202 HG3 ARG 30 2HG ARG 30 -2.991 6.775 -10.786
203 HD2 ARG 30 1HD ARG 30 -0.815 7.069 -11.878
204 HD3 ARG 30 2HD ARG 30 -0.386 5.411 -11.457
205 HE ARG 30 HE ARG 30 -1.691 4.665 -13.188
206 HH11 ARG 30 1HH1 ARG 30 -2.414 8.011 -12.555
207 HH12 ARG 30 2HH1 ARG 30 -3.403 8.200 -13.965
208 HH21 ARG 30 1HH2 ARG 30 -2.991 4.901 -15.048
209 HH22 ARG 30 2HH2 ARG 30 -3.731 6.429 -15.382
210 H HIS 31 H HIS 31 -0.581 4.766 -6.941
211 HA HIS 31 HA HIS 31 -0.021 6.666 -4.970
212 HB2 HIS 31 1HB HIS 31 -1.296 4.822 -4.274
213 HB3 HIS 31 2HB HIS 31 -0.155 3.662 -4.947
214 HD1 HIS 31 HD1 HIS 31 -0.297 6.208 -2.128
215 HD2 HIS 31 HD2 HIS 31 1.555 2.624 -3.118
216 HE1 HIS 31 HE1 HIS 31 0.991 5.529 -0.078
217 H SER 32 H SER 32 2.040 4.180 -6.418
218 HA SER 32 HA SER 32 4.265 4.436 -4.770
219 HB2 SER 32 1HB SER 32 3.976 2.664 -6.487
220 HB3 SER 32 2HB SER 32 4.273 3.864 -7.744
221 HG SER 32 HG SER 32 6.335 3.751 -7.347
222 H MET 33 H MET 33 2.967 6.646 -7.023
223 HA MET 33 HA MET 33 5.432 8.064 -7.516
224 HB2 MET 33 1HB MET 33 2.643 9.073 -8.052
225 HB3 MET 33 2HB MET 33 4.138 9.552 -8.844
226 HG2 MET 33 1HG MET 33 3.131 6.741 -9.022
227 HG3 MET 33 2HG MET 33 2.516 8.002 -10.088
228 HE1 MET 33 3HE MET 33 6.228 6.057 -9.309
229 HE2 MET 33 1HE MET 33 4.619 5.356 -9.485
230 HE3 MET 33 2HE MET 33 5.753 5.309 -10.835
231 H VAL 34 H VAL 34 2.795 8.205 -5.259
232 HA VAL 34 HA VAL 34 3.215 10.867 -4.353
233 HB VAL 34 HB VAL 34 1.748 10.356 -2.543
234 HG11 VAL 34 1HG1 VAL 34 0.451 10.579 -4.450
235 HG12 VAL 34 2HG1 VAL 34 1.046 9.075 -5.155
236 HG13 VAL 34 3HG1 VAL 34 -0.087 9.030 -3.803
237 HG21 VAL 34 3HG2 VAL 34 2.969 7.811 -2.647
238 HG22 VAL 34 1HG2 VAL 34 1.820 8.421 -1.457
239 HG23 VAL 34 2HG2 VAL 34 1.239 7.569 -2.888
240 H HIS 35 H HIS 35 4.984 8.017 -3.946
241 HA HIS 35 HA HIS 35 6.033 8.606 -1.329
242 HB2 HIS 35 1HB HIS 35 6.616 6.543 -3.429
243 HB3 HIS 35 2HB HIS 35 7.727 6.770 -2.081
244 HD1 HIS 35 HD1 HIS 35 6.672 6.365 0.350
245 HD2 HIS 35 HD2 HIS 35 4.413 5.026 -2.869
246 HE1 HIS 35 HE1 HIS 35 4.993 4.768 1.325
247 H THR 36 H THR 36 6.753 9.500 -4.562
248 HA THR 36 HA THR 36 9.348 10.607 -3.706
249 HB THR 36 HB THR 36 9.484 8.926 -5.544
250 HG1 THR 36 HG1 THR 36 10.915 10.859 -5.294
251 HG21 THR 36 3HG2 THR 36 8.278 10.961 -7.377
252 HG22 THR 36 1HG2 THR 36 7.240 9.809 -6.538
253 HG23 THR 36 2HG2 THR 36 8.505 9.229 -7.622
254 H ALA 37 H ALA 37 6.231 11.285 -5.044
255 HA ALA 37 HA ALA 37 6.941 13.974 -5.871
256 HB1 ALA 37 3HB ALA 37 4.095 13.356 -5.735
257 HB2 ALA 37 1HB ALA 37 5.072 13.921 -7.091
258 HB3 ALA 37 2HB ALA 37 5.018 12.202 -6.698
259 H GLU 38 H GLU 38 7.664 14.668 -3.742
260 HA GLU 38 HA GLU 38 5.559 15.997 -2.312
261 HB2 GLU 38 1HB GLU 38 6.059 15.021 -0.114
262 HB3 GLU 38 2HB GLU 38 5.439 13.815 -1.233
263 HG2 GLU 38 1HG GLU 38 7.596 12.878 -1.552
264 HG3 GLU 38 2HG GLU 38 8.368 14.213 -0.697
265 H LYS 39 H LYS 39 6.528 17.210 -0.365
266 HA LYS 39 HA LYS 39 8.326 19.065 -1.113
267 HB2 LYS 39 1HB LYS 39 7.725 17.889 1.573
268 HB3 LYS 39 2HB LYS 39 9.014 19.077 1.425
269 HG2 LYS 39 1HG LYS 39 6.211 19.561 0.452
270 HG3 LYS 39 2HG LYS 39 6.765 19.980 2.075
271 HD2 LYS 39 1HD LYS 39 8.211 20.938 -0.377
272 HD3 LYS 39 2HD LYS 39 6.819 21.808 0.274
273 HE2 LYS 39 1HE LYS 39 7.934 22.156 2.363
274 HE3 LYS 39 2HE LYS 39 9.259 21.094 1.892
275 HZ1 LYS 39 3HZ LYS 39 8.664 23.828 0.989
276 HZ2 LYS 39 1HZ LYS 39 9.515 22.784 -0.035
277 HZ3 LYS 39 2HZ LYS 39 10.135 23.162 1.493
278 HA PRO 40 HA PRO 40 12.369 17.395 -1.449
279 HB2 PRO 40 1HB PRO 40 13.903 19.396 -0.441
280 HB3 PRO 40 2HB PRO 40 13.088 19.505 -2.006
281 HG2 PRO 40 1HG PRO 40 12.261 20.628 0.643
282 HG3 PRO 40 2HG PRO 40 12.209 21.387 -0.959
283 HD2 PRO 40 1HD PRO 40 10.019 20.311 0.215
284 HD3 PRO 40 2HD PRO 40 10.257 20.310 -1.545
285 H SER 41 H SER 41 10.871 17.673 1.468
286 HA SER 41 HA SER 41 12.534 17.609 3.544
287 HB2 SER 41 1HB SER 41 11.128 15.955 4.625
288 HB3 SER 41 2HB SER 41 10.115 17.008 3.638
289 HG SER 41 HG SER 41 9.671 15.387 2.341
290 H GLY 42 H GLY 42 12.176 14.896 1.276
291 HA2 GLY 42 1HA GLY 42 14.287 13.798 0.605
292 HA3 GLY 42 2HA GLY 42 14.745 13.851 2.301
293 HA PRO 43 HA PRO 43 12.152 9.983 1.047
294 HB2 PRO 43 1HB PRO 43 14.087 8.294 0.166
295 HB3 PRO 43 2HB PRO 43 13.172 9.354 -0.913
296 HG2 PRO 43 1HG PRO 43 15.910 9.730 0.238
297 HG3 PRO 43 2HG PRO 43 15.338 10.039 -1.412
298 HD2 PRO 43 1HD PRO 43 15.655 12.013 0.414
299 HD3 PRO 43 2HD PRO 43 14.402 12.067 -0.842
300 H SER 44 H SER 44 12.233 7.930 2.177
301 HA SER 44 HA SER 44 12.378 6.936 4.254
302 HB2 SER 44 1HB SER 44 15.106 6.908 3.016
303 HB3 SER 44 2HB SER 44 14.886 6.232 4.629
304 HG SER 44 HG SER 44 12.997 5.120 3.455
305 H SER 45 H SER 45 12.236 9.704 4.577
306 HA SER 45 HA SER 45 13.954 10.075 6.940
307 HB2 SER 45 1HB SER 45 13.314 12.032 4.744
308 HB3 SER 45 2HB SER 45 13.771 12.589 6.354
309 HG SER 45 HG SER 45 15.747 11.663 6.120
310 H GLY 46 H GLY 46 13.039 11.895 8.372
311 HA2 GLY 46 1HA GLY 46 10.456 12.783 8.407
312 HA3 GLY 46 2HA GLY 46 10.348 11.151 9.049
Start of MODEL 14
1 H1 GLY 1 H GLY 1 -17.544 5.771 4.930
2 HA2 GLY 1 1HA GLY 1 -15.599 4.908 5.791
3 HA3 GLY 1 2HA GLY 1 -16.427 4.829 7.340
4 H SER 2 H SER 2 -15.397 3.079 4.550
5 HA SER 2 HA SER 2 -16.828 0.750 4.626
6 HB2 SER 2 1HB SER 2 -14.868 -0.369 3.695
7 HB3 SER 2 2HB SER 2 -15.029 1.241 2.993
8 HG SER 2 HG SER 2 -12.916 0.273 4.134
9 H SER 3 H SER 3 -17.195 -0.775 6.088
10 HA SER 3 HA SER 3 -15.166 -1.568 7.985
11 HB2 SER 3 1HB SER 3 -16.064 0.262 9.244
12 HB3 SER 3 2HB SER 3 -17.720 -0.224 8.883
13 HG SER 3 HG SER 3 -16.106 -2.099 10.152
14 H GLY 4 H GLY 4 -15.390 -3.660 8.594
15 HA2 GLY 4 1HA GLY 4 -17.648 -5.151 8.986
16 HA3 GLY 4 2HA GLY 4 -17.383 -5.232 7.251
17 H SER 5 H SER 5 -16.569 -6.526 10.265
18 HA SER 5 HA SER 5 -14.030 -7.646 9.475
19 HB2 SER 5 1HB SER 5 -15.753 -7.772 11.915
20 HB3 SER 5 2HB SER 5 -14.530 -9.020 11.680
21 HG SER 5 HG SER 5 -13.219 -6.902 11.192
22 H SER 6 H SER 6 -15.850 -8.342 7.581
23 HA SER 6 HA SER 6 -17.217 -10.756 7.967
24 HB2 SER 6 1HB SER 6 -15.973 -9.738 5.401
25 HB3 SER 6 2HB SER 6 -17.265 -10.931 5.533
26 HG SER 6 HG SER 6 -18.019 -8.792 6.891
27 H GLY 7 H GLY 7 -13.963 -10.161 6.647
28 HA2 GLY 7 1HA GLY 7 -12.251 -11.761 7.567
29 HA3 GLY 7 2HA GLY 7 -13.378 -13.023 7.091
30 H THR 8 H THR 8 -11.460 -10.336 5.792
31 HA THR 8 HA THR 8 -11.209 -11.859 3.279
32 HB THR 8 HB THR 8 -10.682 -9.575 2.248
33 HG1 THR 8 HG1 THR 8 -10.698 -7.966 3.612
34 HG21 THR 8 3HG2 THR 8 -13.419 -9.144 2.841
35 HG22 THR 8 1HG2 THR 8 -13.157 -10.887 2.791
36 HG23 THR 8 2HG2 THR 8 -12.719 -9.890 1.405
37 H GLY 9 H GLY 9 -9.200 -12.226 2.471
38 HA2 GLY 9 1HA GLY 9 -6.975 -12.014 4.214
39 HA3 GLY 9 2HA GLY 9 -6.920 -12.511 2.530
40 H GLU 10 H GLU 10 -5.970 -11.190 1.114
41 HA GLU 10 HA GLU 10 -5.683 -8.352 1.818
42 HB2 GLU 10 1HB GLU 10 -3.358 -8.407 0.954
43 HB3 GLU 10 2HB GLU 10 -3.579 -9.385 2.398
44 HG2 GLU 10 1HG GLU 10 -3.974 -11.294 0.624
45 HG3 GLU 10 2HG GLU 10 -3.016 -10.219 -0.393
46 H LYS 11 H LYS 11 -4.480 -7.299 -0.267
47 HA LYS 11 HA LYS 11 -6.367 -7.756 -2.435
48 HB2 LYS 11 1HB LYS 11 -4.541 -5.553 -1.626
49 HB3 LYS 11 2HB LYS 11 -4.909 -5.704 -3.339
50 HG2 LYS 11 1HG LYS 11 -6.461 -4.170 -2.428
51 HG3 LYS 11 2HG LYS 11 -7.339 -5.673 -2.722
52 HD2 LYS 11 1HD LYS 11 -6.586 -6.122 -0.201
53 HD3 LYS 11 2HD LYS 11 -6.611 -4.357 -0.165
54 HE2 LYS 11 1HE LYS 11 -8.947 -4.756 -1.367
55 HE3 LYS 11 2HE LYS 11 -8.838 -6.293 -0.510
56 HZ1 LYS 11 3HZ LYS 11 -8.759 -3.578 0.686
57 HZ2 LYS 11 1HZ LYS 11 -8.465 -5.002 1.550
58 HZ3 LYS 11 2HZ LYS 11 -9.984 -4.731 0.858
59 HA PRO 12 HA PRO 12 -3.641 -9.866 -5.150
60 HB2 PRO 12 1HB PRO 12 -4.314 -8.809 -7.558
61 HB3 PRO 12 2HB PRO 12 -5.363 -9.920 -6.670
62 HG2 PRO 12 1HG PRO 12 -5.480 -6.934 -6.841
63 HG3 PRO 12 2HG PRO 12 -6.803 -8.111 -6.915
64 HD2 PRO 12 1HD PRO 12 -6.219 -6.716 -4.670
65 HD3 PRO 12 2HD PRO 12 -6.873 -8.366 -4.626
66 H PHE 13 H PHE 13 -3.157 -6.730 -4.341
67 HA PHE 13 HA PHE 13 -0.617 -6.642 -5.795
68 HB2 PHE 13 1HB PHE 13 -2.548 -4.318 -5.619
69 HB3 PHE 13 2HB PHE 13 -0.921 -4.245 -6.289
70 HD1 PHE 13 HD1 PHE 13 -0.404 -5.308 -8.421
71 HD2 PHE 13 HD2 PHE 13 -4.356 -5.309 -6.840
72 HE1 PHE 13 HE1 PHE 13 -1.284 -5.942 -10.629
73 HE2 PHE 13 HE2 PHE 13 -5.242 -5.944 -9.045
74 HZ PHE 13 HZ PHE 13 -3.705 -6.262 -10.944
75 H LYS 14 H LYS 14 0.859 -4.947 -4.875
76 HA LYS 14 HA LYS 14 0.329 -4.044 -2.192
77 HB2 LYS 14 1HB LYS 14 0.951 -6.376 -1.766
78 HB3 LYS 14 2HB LYS 14 2.443 -6.154 -2.670
79 HG2 LYS 14 1HG LYS 14 2.888 -4.262 -0.938
80 HG3 LYS 14 2HG LYS 14 1.693 -5.130 0.028
81 HD2 LYS 14 1HD LYS 14 3.032 -7.182 -0.194
82 HD3 LYS 14 2HD LYS 14 4.236 -6.283 -1.120
83 HE2 LYS 14 1HE LYS 14 4.444 -4.751 0.876
84 HE3 LYS 14 2HE LYS 14 3.466 -5.915 1.767
85 HZ1 LYS 14 3HZ LYS 14 5.268 -7.563 0.862
86 HZ2 LYS 14 1HZ LYS 14 5.548 -6.653 2.261
87 HZ3 LYS 14 2HZ LYS 14 6.214 -6.163 0.786
88 H CYS 15 H CYS 15 1.843 -2.523 -1.450
89 HA CYS 15 HA CYS 15 3.287 -1.188 -3.553
90 HB2 CYS 15 1HB CYS 15 1.965 -0.127 -1.585
91 HB3 CYS 15 2HB CYS 15 3.426 -0.426 -0.650
92 H ASP 16 H ASP 16 5.541 -0.292 -2.940
93 HA ASP 16 HA ASP 16 7.161 -2.524 -1.897
94 HB2 ASP 16 1HB ASP 16 7.500 -0.765 -4.279
95 HB3 ASP 16 2HB ASP 16 8.952 -1.280 -3.426
96 H ILE 17 H ILE 17 6.412 0.820 -1.695
97 HA ILE 17 HA ILE 17 8.807 1.475 -0.180
98 HB ILE 17 HB ILE 17 6.428 3.271 -0.593
99 HG12 ILE 17 1HG1 ILE 17 8.104 4.138 -2.488
100 HG13 ILE 17 2HG1 ILE 17 8.549 2.435 -2.507
101 HG21 ILE 17 1HG2 ILE 17 8.062 5.049 -0.311
102 HG22 ILE 17 2HG2 ILE 17 8.091 3.956 1.072
103 HG23 ILE 17 3HG2 ILE 17 9.353 3.858 -0.156
104 HD11 ILE 17 3HD1 ILE 17 6.607 3.458 -4.017
105 HD12 ILE 17 1HD1 ILE 17 6.591 1.797 -3.424
106 HD13 ILE 17 2HD1 ILE 17 5.664 3.043 -2.586
107 H CYS 18 H CYS 18 5.296 1.322 0.350
108 HA CYS 18 HA CYS 18 5.833 1.163 3.244
109 HB2 CYS 18 1HB CYS 18 3.658 2.213 3.632
110 HB3 CYS 18 2HB CYS 18 4.681 3.251 2.644
111 H GLY 19 H GLY 19 4.850 -0.544 0.589
112 HA2 GLY 19 1HA GLY 19 4.067 -2.718 0.459
113 HA3 GLY 19 2HA GLY 19 3.864 -2.710 2.204
114 H LYS 20 H LYS 20 2.379 -0.025 0.886
115 HA LYS 20 HA LYS 20 -0.185 -0.683 1.669
116 HB2 LYS 20 1HB LYS 20 0.999 1.353 -0.131
117 HB3 LYS 20 2HB LYS 20 -0.729 1.073 -0.299
118 HG2 LYS 20 1HG LYS 20 0.544 1.627 2.361
119 HG3 LYS 20 2HG LYS 20 0.001 2.916 1.285
120 HD2 LYS 20 1HD LYS 20 -2.217 2.400 1.565
121 HD3 LYS 20 2HD LYS 20 -1.888 0.702 1.918
122 HE2 LYS 20 1HE LYS 20 -2.613 1.684 3.948
123 HE3 LYS 20 2HE LYS 20 -0.868 1.472 4.090
124 HZ1 LYS 20 3HZ LYS 20 -2.370 3.977 3.614
125 HZ2 LYS 20 1HZ LYS 20 -0.708 3.859 3.320
126 HZ3 LYS 20 2HZ LYS 20 -1.310 3.615 4.881
127 H SER 21 H SER 21 -1.868 -1.759 0.804
128 HA SER 21 HA SER 21 -1.391 -3.171 -1.716
129 HB2 SER 21 1HB SER 21 -2.799 -4.843 -0.960
130 HB3 SER 21 2HB SER 21 -2.156 -4.248 0.571
131 HG SER 21 HG SER 21 -4.629 -4.469 0.045
132 H PHE 22 H PHE 22 -3.120 -3.375 -3.277
133 HA PHE 22 HA PHE 22 -5.287 -1.450 -3.149
134 HB2 PHE 22 1HB PHE 22 -3.239 -1.325 -5.372
135 HB3 PHE 22 2HB PHE 22 -4.702 -0.353 -5.254
136 HD1 PHE 22 HD1 PHE 22 -1.539 -1.100 -3.448
137 HD2 PHE 22 HD2 PHE 22 -4.633 1.718 -4.224
138 HE1 PHE 22 HE1 PHE 22 -0.294 0.608 -2.188
139 HE2 PHE 22 HE2 PHE 22 -3.393 3.431 -2.966
140 HZ PHE 22 HZ PHE 22 -1.220 2.877 -1.946
141 H CYS 23 H CYS 23 -7.031 -2.497 -3.810
142 HA CYS 23 HA CYS 23 -7.159 -5.009 -4.879
143 HB2 CYS 23 1HB CYS 23 -9.459 -4.452 -5.605
144 HB3 CYS 23 2HB CYS 23 -9.118 -3.893 -3.972
145 HG CYS 23 HG CYS 23 -8.405 -1.257 -5.243
146 H GLY 24 H GLY 24 -6.642 -1.991 -6.562
147 HA2 GLY 24 1HA GLY 24 -6.249 -3.533 -9.045
148 HA3 GLY 24 2HA GLY 24 -7.164 -2.032 -9.064
149 H ARG 25 H ARG 25 -4.332 -3.217 -9.950
150 HA ARG 25 HA ARG 25 -2.309 -1.688 -8.881
151 HB2 ARG 25 1HB ARG 25 -2.255 -3.526 -10.717
152 HB3 ARG 25 2HB ARG 25 -2.442 -2.184 -11.838
153 HG2 ARG 25 1HG ARG 25 -0.178 -2.329 -11.805
154 HG3 ARG 25 2HG ARG 25 -0.410 -1.214 -10.457
155 HD2 ARG 25 1HD ARG 25 -0.146 -2.956 -8.862
156 HD3 ARG 25 2HD ARG 25 -0.231 -4.198 -10.111
157 HE ARG 25 HE ARG 25 2.065 -2.584 -9.405
158 HH11 ARG 25 1HH1 ARG 25 0.588 -4.685 -11.757
159 HH12 ARG 25 2HH1 ARG 25 2.090 -5.123 -12.500
160 HH21 ARG 25 1HH2 ARG 25 4.049 -3.154 -10.376
161 HH22 ARG 25 2HH2 ARG 25 4.058 -4.253 -11.714
162 H SER 26 H SER 26 -4.534 -0.825 -11.504
163 HA SER 26 HA SER 26 -3.612 1.478 -12.491
164 HB2 SER 26 1HB SER 26 -5.872 0.490 -12.950
165 HB3 SER 26 2HB SER 26 -6.448 1.239 -11.461
166 HG SER 26 HG SER 26 -6.697 2.410 -13.579
167 H ARG 27 H ARG 27 -4.761 1.031 -9.217
168 HA ARG 27 HA ARG 27 -4.533 3.867 -8.613
169 HB2 ARG 27 1HB ARG 27 -6.372 2.466 -7.665
170 HB3 ARG 27 2HB ARG 27 -5.164 1.573 -6.751
171 HG2 ARG 27 1HG ARG 27 -5.801 3.059 -5.161
172 HG3 ARG 27 2HG ARG 27 -4.522 4.004 -5.927
173 HD2 ARG 27 1HD ARG 27 -7.401 4.190 -6.773
174 HD3 ARG 27 2HD ARG 27 -6.725 5.193 -5.490
175 HE ARG 27 HE ARG 27 -5.017 5.658 -7.492
176 HH11 ARG 27 1HH1 ARG 27 -8.497 5.625 -7.397
177 HH12 ARG 27 2HH1 ARG 27 -8.672 6.808 -8.650
178 HH21 ARG 27 1HH2 ARG 27 -5.235 7.216 -9.143
179 HH22 ARG 27 2HH2 ARG 27 -6.816 7.711 -9.644
180 H LEU 28 H LEU 28 -3.148 0.849 -7.303
181 HA LEU 28 HA LEU 28 -1.270 1.863 -5.607
182 HB2 LEU 28 1HB LEU 28 -1.451 -0.447 -5.626
183 HB3 LEU 28 2HB LEU 28 -1.281 -0.545 -7.377
184 HG LEU 28 HG LEU 28 1.095 -0.120 -7.206
185 HD11 LEU 28 1HD1 LEU 28 0.542 0.177 -4.262
186 HD12 LEU 28 2HD1 LEU 28 1.208 1.383 -5.362
187 HD13 LEU 28 3HD1 LEU 28 2.154 -0.045 -4.942
188 HD21 LEU 28 3HD2 LEU 28 1.207 -2.331 -7.018
189 HD22 LEU 28 1HD2 LEU 28 -0.243 -2.378 -6.014
190 HD23 LEU 28 2HD2 LEU 28 1.335 -2.115 -5.271
191 H ASN 29 H ASN 29 -0.718 1.159 -9.060
192 HA ASN 29 HA ASN 29 1.848 1.933 -9.399
193 HB2 ASN 29 1HB ASN 29 -0.571 2.140 -11.112
194 HB3 ASN 29 2HB ASN 29 0.848 3.046 -11.629
195 HD21 ASN 29 1HD2 ASN 29 -0.708 0.304 -12.156
196 HD22 ASN 29 2HD2 ASN 29 0.604 -0.750 -12.547
197 H ARG 30 H ARG 30 -0.926 4.169 -9.453
198 HA ARG 30 HA ARG 30 0.610 6.517 -9.722
199 HB2 ARG 30 1HB ARG 30 -2.087 6.356 -8.385
200 HB3 ARG 30 2HB ARG 30 -1.394 7.713 -9.262
201 HG2 ARG 30 1HG ARG 30 -2.438 5.127 -10.374
202 HG3 ARG 30 2HG ARG 30 -3.023 6.765 -10.675
203 HD2 ARG 30 1HD ARG 30 -1.003 7.311 -11.876
204 HD3 ARG 30 2HD ARG 30 -0.301 5.745 -11.475
205 HE ARG 30 HE ARG 30 -2.509 5.015 -12.785
206 HH11 ARG 30 1HH1 ARG 30 -0.077 7.391 -13.536
207 HH12 ARG 30 2HH1 ARG 30 -0.257 7.224 -15.251
208 HH21 ARG 30 1HH2 ARG 30 -2.755 4.786 -15.041
209 HH22 ARG 30 2HH2 ARG 30 -1.781 5.743 -16.106
210 H HIS 31 H HIS 31 -0.573 4.757 -6.905
211 HA HIS 31 HA HIS 31 0.022 6.631 -4.927
212 HB2 HIS 31 1HB HIS 31 -1.274 4.745 -4.303
213 HB3 HIS 31 2HB HIS 31 -0.054 3.617 -4.886
214 HD1 HIS 31 HD1 HIS 31 -0.403 6.252 -2.164
215 HD2 HIS 31 HD2 HIS 31 1.554 2.667 -2.927
216 HE1 HIS 31 HE1 HIS 31 0.790 5.669 -0.028
217 H SER 32 H SER 32 2.065 4.196 -6.465
218 HA SER 32 HA SER 32 4.308 4.454 -4.803
219 HB2 SER 32 1HB SER 32 3.961 2.633 -6.479
220 HB3 SER 32 2HB SER 32 4.308 3.796 -7.758
221 HG SER 32 HG SER 32 6.022 2.411 -6.225
222 H MET 33 H MET 33 2.946 6.661 -6.964
223 HA MET 33 HA MET 33 5.428 8.033 -7.580
224 HB2 MET 33 1HB MET 33 2.647 9.049 -8.131
225 HB3 MET 33 2HB MET 33 4.140 9.461 -8.963
226 HG2 MET 33 1HG MET 33 3.148 6.649 -9.005
227 HG3 MET 33 2HG MET 33 2.427 7.856 -10.068
228 HE1 MET 33 3HE MET 33 5.768 5.271 -10.918
229 HE2 MET 33 1HE MET 33 6.211 6.070 -9.409
230 HE3 MET 33 2HE MET 33 4.644 5.274 -9.558
231 H VAL 34 H VAL 34 2.846 8.201 -5.280
232 HA VAL 34 HA VAL 34 3.263 10.904 -4.466
233 HB VAL 34 HB VAL 34 1.778 10.468 -2.664
234 HG11 VAL 34 1HG1 VAL 34 -0.033 9.044 -3.869
235 HG12 VAL 34 2HG1 VAL 34 0.475 10.582 -4.570
236 HG13 VAL 34 3HG1 VAL 34 1.105 9.065 -5.216
237 HG21 VAL 34 3HG2 VAL 34 1.286 7.667 -2.858
238 HG22 VAL 34 1HG2 VAL 34 3.016 7.926 -2.635
239 HG23 VAL 34 2HG2 VAL 34 1.867 8.594 -1.475
240 H HIS 35 H HIS 35 4.923 7.981 -3.891
241 HA HIS 35 HA HIS 35 5.997 8.637 -1.321
242 HB2 HIS 35 1HB HIS 35 6.615 6.557 -3.397
243 HB3 HIS 35 2HB HIS 35 7.693 6.792 -2.024
244 HD1 HIS 35 HD1 HIS 35 6.560 6.426 0.387
245 HD2 HIS 35 HD2 HIS 35 4.418 5.020 -2.883
246 HE1 HIS 35 HE1 HIS 35 4.863 4.829 1.332
247 H THR 36 H THR 36 6.813 9.385 -4.595
248 HA THR 36 HA THR 36 9.409 10.478 -3.745
249 HB THR 36 HB THR 36 9.502 8.890 -5.632
250 HG1 THR 36 HG1 THR 36 10.279 11.562 -5.831
251 HG21 THR 36 3HG2 THR 36 7.380 10.651 -6.654
252 HG22 THR 36 1HG2 THR 36 7.706 8.953 -6.996
253 HG23 THR 36 2HG2 THR 36 8.613 10.211 -7.836
254 H ALA 37 H ALA 37 6.268 11.305 -4.918
255 HA ALA 37 HA ALA 37 7.016 13.987 -5.716
256 HB1 ALA 37 3HB ALA 37 4.419 14.175 -5.843
257 HB2 ALA 37 1HB ALA 37 5.295 13.222 -7.041
258 HB3 ALA 37 2HB ALA 37 4.476 12.418 -5.701
259 H GLU 38 H GLU 38 7.942 14.516 -3.586
260 HA GLU 38 HA GLU 38 5.850 15.344 -1.683
261 HB2 GLU 38 1HB GLU 38 8.545 14.140 -1.243
262 HB3 GLU 38 2HB GLU 38 7.942 15.295 -0.062
263 HG2 GLU 38 1HG GLU 38 5.935 13.915 0.241
264 HG3 GLU 38 2HG GLU 38 6.586 12.744 -0.905
265 H LYS 39 H LYS 39 5.715 17.449 -1.236
266 HA LYS 39 HA LYS 39 7.534 19.279 -2.542
267 HB2 LYS 39 1HB LYS 39 5.033 19.685 -0.903
268 HB3 LYS 39 2HB LYS 39 5.985 21.018 -1.543
269 HG2 LYS 39 1HG LYS 39 4.448 20.833 -3.201
270 HG3 LYS 39 2HG LYS 39 5.652 19.694 -3.807
271 HD2 LYS 39 1HD LYS 39 4.298 17.954 -2.415
272 HD3 LYS 39 2HD LYS 39 3.010 19.157 -2.513
273 HE2 LYS 39 1HE LYS 39 2.760 17.592 -4.322
274 HE3 LYS 39 2HE LYS 39 3.257 19.150 -4.979
275 HZ1 LYS 39 3HZ LYS 39 5.276 17.099 -4.353
276 HZ2 LYS 39 1HZ LYS 39 5.358 18.373 -5.462
277 HZ3 LYS 39 2HZ LYS 39 4.408 17.016 -5.802
278 HA PRO 40 HA PRO 40 10.147 20.059 0.911
279 HB2 PRO 40 1HB PRO 40 10.997 22.555 0.267
280 HB3 PRO 40 2HB PRO 40 11.553 21.104 -0.576
281 HG2 PRO 40 1HG PRO 40 9.448 23.074 -1.383
282 HG3 PRO 40 2HG PRO 40 10.711 22.318 -2.372
283 HD2 PRO 40 1HD PRO 40 8.144 21.457 -2.380
284 HD3 PRO 40 2HD PRO 40 9.519 20.361 -2.622
285 H SER 41 H SER 41 8.583 20.132 2.580
286 HA SER 41 HA SER 41 7.847 22.866 3.388
287 HB2 SER 41 1HB SER 41 6.125 20.410 3.795
288 HB3 SER 41 2HB SER 41 5.715 22.069 4.231
289 HG SER 41 HG SER 41 5.005 21.019 2.076
290 H GLY 42 H GLY 42 7.639 23.197 5.681
291 HA2 GLY 42 1HA GLY 42 8.272 21.210 7.593
292 HA3 GLY 42 2HA GLY 42 9.721 22.118 7.187
293 HA PRO 43 HA PRO 43 6.726 24.379 10.216
294 HB2 PRO 43 1HB PRO 43 7.537 23.397 12.614
295 HB3 PRO 43 2HB PRO 43 6.201 22.698 11.692
296 HG2 PRO 43 1HG PRO 43 9.049 21.795 11.881
297 HG3 PRO 43 2HG PRO 43 7.563 20.826 11.913
298 HD2 PRO 43 1HD PRO 43 9.093 21.074 9.692
299 HD3 PRO 43 2HD PRO 43 7.330 20.879 9.620
300 H SER 44 H SER 44 8.128 26.068 9.471
301 HA SER 44 HA SER 44 10.479 26.520 11.190
302 HB2 SER 44 1HB SER 44 10.703 26.295 8.592
303 HB3 SER 44 2HB SER 44 10.079 27.944 8.578
304 HG SER 44 HG SER 44 12.528 26.972 9.448
305 H SER 45 H SER 45 9.809 27.780 12.820
306 HA SER 45 HA SER 45 8.763 30.414 12.164
307 HB2 SER 45 1HB SER 45 6.759 28.976 12.545
308 HB3 SER 45 2HB SER 45 7.353 28.638 14.171
309 HG SER 45 HG SER 45 5.791 30.403 13.966
310 H GLY 46 H GLY 46 9.970 31.837 13.217
311 HA2 GLY 46 1HA GLY 46 11.561 32.637 14.695
312 HA3 GLY 46 2HA GLY 46 10.355 32.147 15.875
Start of MODEL 15
1 H1 GLY 1 H GLY 1 -10.300 -23.941 2.129
2 HA2 GLY 1 1HA GLY 1 -10.791 -23.353 -0.705
3 HA3 GLY 1 2HA GLY 1 -9.222 -23.361 0.086
4 H SER 2 H SER 2 -8.210 -24.755 -1.308
5 HA SER 2 HA SER 2 -9.186 -27.060 -2.450
6 HB2 SER 2 1HB SER 2 -6.948 -25.977 -2.892
7 HB3 SER 2 2HB SER 2 -6.355 -26.759 -1.427
8 HG SER 2 HG SER 2 -6.705 -27.793 -3.899
9 H SER 3 H SER 3 -7.319 -26.873 0.585
10 HA SER 3 HA SER 3 -8.726 -29.290 1.494
11 HB2 SER 3 1HB SER 3 -5.773 -28.766 1.429
12 HB3 SER 3 2HB SER 3 -6.450 -29.795 2.691
13 HG SER 3 HG SER 3 -6.881 -30.179 -0.087
14 H GLY 4 H GLY 4 -10.088 -27.849 2.680
15 HA2 GLY 4 1HA GLY 4 -10.640 -26.415 4.422
16 HA3 GLY 4 2HA GLY 4 -9.717 -27.606 5.327
17 H SER 5 H SER 5 -8.706 -25.114 2.998
18 HA SER 5 HA SER 5 -7.030 -23.952 5.126
19 HB2 SER 5 1HB SER 5 -6.348 -24.319 2.200
20 HB3 SER 5 2HB SER 5 -5.373 -23.394 3.342
21 HG SER 5 HG SER 5 -4.463 -25.269 3.664
22 H SER 6 H SER 6 -6.448 -21.670 4.765
23 HA SER 6 HA SER 6 -8.763 -20.130 4.169
24 HB2 SER 6 1HB SER 6 -6.928 -19.584 5.866
25 HB3 SER 6 2HB SER 6 -5.972 -19.027 4.492
26 HG SER 6 HG SER 6 -8.451 -18.020 5.421
27 H GLY 7 H GLY 7 -8.392 -18.032 2.779
28 HA2 GLY 7 1HA GLY 7 -6.852 -18.518 0.363
29 HA3 GLY 7 2HA GLY 7 -8.597 -18.538 0.157
30 H THR 8 H THR 8 -9.576 -16.539 1.544
31 HA THR 8 HA THR 8 -8.650 -14.224 0.122
32 HB THR 8 HB THR 8 -11.044 -14.555 0.493
33 HG1 THR 8 HG1 THR 8 -10.440 -12.308 2.071
34 HG21 THR 8 3HG2 THR 8 -10.619 -13.942 3.404
35 HG22 THR 8 1HG2 THR 8 -10.665 -15.599 2.805
36 HG23 THR 8 2HG2 THR 8 -12.069 -14.550 2.606
37 H GLY 9 H GLY 9 -6.902 -13.145 0.771
38 HA2 GLY 9 1HA GLY 9 -6.572 -12.677 3.671
39 HA3 GLY 9 2HA GLY 9 -5.211 -12.977 2.601
40 H GLU 10 H GLU 10 -4.615 -11.365 1.073
41 HA GLU 10 HA GLU 10 -5.624 -8.684 1.766
42 HB2 GLU 10 1HB GLU 10 -3.375 -7.837 1.157
43 HB3 GLU 10 2HB GLU 10 -3.344 -8.940 2.525
44 HG2 GLU 10 1HG GLU 10 -2.619 -10.747 1.035
45 HG3 GLU 10 2HG GLU 10 -2.614 -9.616 -0.316
46 H LYS 11 H LYS 11 -4.911 -7.075 -0.086
47 HA LYS 11 HA LYS 11 -6.457 -7.705 -2.342
48 HB2 LYS 11 1HB LYS 11 -4.617 -5.499 -1.574
49 HB3 LYS 11 2HB LYS 11 -5.002 -5.664 -3.282
50 HG2 LYS 11 1HG LYS 11 -6.527 -4.108 -2.322
51 HG3 LYS 11 2HG LYS 11 -7.415 -5.591 -2.680
52 HD2 LYS 11 1HD LYS 11 -6.773 -6.173 -0.190
53 HD3 LYS 11 2HD LYS 11 -6.645 -4.418 -0.051
54 HE2 LYS 11 1HE LYS 11 -9.061 -5.569 -1.353
55 HE3 LYS 11 2HE LYS 11 -8.920 -5.680 0.401
56 HZ1 LYS 11 3HZ LYS 11 -8.562 -3.119 -1.035
57 HZ2 LYS 11 1HZ LYS 11 -8.876 -3.367 0.609
58 HZ3 LYS 11 2HZ LYS 11 -10.087 -3.655 -0.536
59 HA PRO 12 HA PRO 12 -3.775 -9.838 -5.083
60 HB2 PRO 12 1HB PRO 12 -4.463 -8.782 -7.487
61 HB3 PRO 12 2HB PRO 12 -5.512 -9.883 -6.586
62 HG2 PRO 12 1HG PRO 12 -5.607 -6.896 -6.765
63 HG3 PRO 12 2HG PRO 12 -6.941 -8.063 -6.822
64 HD2 PRO 12 1HD PRO 12 -6.323 -6.666 -4.586
65 HD3 PRO 12 2HD PRO 12 -6.990 -8.310 -4.531
66 H PHE 13 H PHE 13 -3.253 -6.708 -4.282
67 HA PHE 13 HA PHE 13 -0.728 -6.645 -5.760
68 HB2 PHE 13 1HB PHE 13 -2.644 -4.309 -5.587
69 HB3 PHE 13 2HB PHE 13 -1.018 -4.244 -6.259
70 HD1 PHE 13 HD1 PHE 13 -0.507 -5.325 -8.385
71 HD2 PHE 13 HD2 PHE 13 -4.458 -5.291 -6.803
72 HE1 PHE 13 HE1 PHE 13 -1.392 -5.964 -10.590
73 HE2 PHE 13 HE2 PHE 13 -5.349 -5.931 -9.005
74 HZ PHE 13 HZ PHE 13 -3.815 -6.270 -10.902
75 H LYS 14 H LYS 14 0.756 -4.929 -4.864
76 HA LYS 14 HA LYS 14 0.255 -4.019 -2.180
77 HB2 LYS 14 1HB LYS 14 0.874 -6.356 -1.756
78 HB3 LYS 14 2HB LYS 14 2.365 -6.132 -2.662
79 HG2 LYS 14 1HG LYS 14 2.833 -4.251 -0.940
80 HG3 LYS 14 2HG LYS 14 1.612 -5.080 0.029
81 HD2 LYS 14 1HD LYS 14 2.905 -7.161 -0.145
82 HD3 LYS 14 2HD LYS 14 4.132 -6.312 -1.089
83 HE2 LYS 14 1HE LYS 14 4.381 -4.745 0.873
84 HE3 LYS 14 2HE LYS 14 3.369 -5.860 1.789
85 HZ1 LYS 14 3HZ LYS 14 5.923 -6.089 1.893
86 HZ2 LYS 14 1HZ LYS 14 5.761 -6.860 0.396
87 HZ3 LYS 14 2HZ LYS 14 4.978 -7.486 1.758
88 H CYS 15 H CYS 15 1.819 -2.531 -1.435
89 HA CYS 15 HA CYS 15 3.230 -1.192 -3.561
90 HB2 CYS 15 1HB CYS 15 1.948 -0.163 -1.520
91 HB3 CYS 15 2HB CYS 15 3.471 -0.418 -0.676
92 H ASP 16 H ASP 16 5.496 -0.274 -2.880
93 HA ASP 16 HA ASP 16 7.118 -2.545 -1.931
94 HB2 ASP 16 1HB ASP 16 7.432 -0.737 -4.273
95 HB3 ASP 16 2HB ASP 16 8.899 -1.233 -3.434
96 H ILE 17 H ILE 17 6.415 0.819 -1.678
97 HA ILE 17 HA ILE 17 8.800 1.393 -0.115
98 HB ILE 17 HB ILE 17 6.464 3.240 -0.578
99 HG12 ILE 17 1HG1 ILE 17 8.263 4.117 -2.361
100 HG13 ILE 17 2HG1 ILE 17 8.663 2.404 -2.398
101 HG21 ILE 17 1HG2 ILE 17 9.370 3.784 0.018
102 HG22 ILE 17 2HG2 ILE 17 8.099 4.991 -0.171
103 HG23 ILE 17 3HG2 ILE 17 8.051 3.867 1.186
104 HD11 ILE 17 3HD1 ILE 17 6.574 3.751 -3.728
105 HD12 ILE 17 1HD1 ILE 17 6.958 2.030 -3.747
106 HD13 ILE 17 2HD1 ILE 17 5.839 2.671 -2.543
107 H CYS 18 H CYS 18 5.273 1.376 0.359
108 HA CYS 18 HA CYS 18 5.756 1.173 3.260
109 HB2 CYS 18 1HB CYS 18 3.571 2.227 3.599
110 HB3 CYS 18 2HB CYS 18 4.623 3.264 2.641
111 H GLY 19 H GLY 19 4.847 -0.550 0.599
112 HA2 GLY 19 1HA GLY 19 4.026 -2.701 0.431
113 HA3 GLY 19 2HA GLY 19 3.841 -2.718 2.179
114 H LYS 20 H LYS 20 2.350 -0.025 0.837
115 HA LYS 20 HA LYS 20 -0.208 -0.676 1.666
116 HB2 LYS 20 1HB LYS 20 0.965 1.361 -0.138
117 HB3 LYS 20 2HB LYS 20 -0.763 1.080 -0.305
118 HG2 LYS 20 1HG LYS 20 0.529 1.649 2.345
119 HG3 LYS 20 2HG LYS 20 -0.057 2.923 1.274
120 HD2 LYS 20 1HD LYS 20 -2.255 2.382 1.607
121 HD3 LYS 20 2HD LYS 20 -1.900 0.681 1.921
122 HE2 LYS 20 1HE LYS 20 -1.021 1.249 4.113
123 HE3 LYS 20 2HE LYS 20 -1.283 2.963 3.796
124 HZ1 LYS 20 3HZ LYS 20 -3.697 2.372 3.522
125 HZ2 LYS 20 1HZ LYS 20 -3.088 2.242 5.095
126 HZ3 LYS 20 2HZ LYS 20 -3.326 0.851 4.163
127 H SER 21 H SER 21 -1.927 -1.707 0.797
128 HA SER 21 HA SER 21 -1.465 -3.150 -1.710
129 HB2 SER 21 1HB SER 21 -2.865 -4.805 -0.930
130 HB3 SER 21 2HB SER 21 -2.272 -4.172 0.605
131 HG SER 21 HG SER 21 -4.230 -2.708 0.350
132 H PHE 22 H PHE 22 -3.202 -3.344 -3.267
133 HA PHE 22 HA PHE 22 -5.333 -1.379 -3.159
134 HB2 PHE 22 1HB PHE 22 -3.306 -1.316 -5.404
135 HB3 PHE 22 2HB PHE 22 -4.732 -0.295 -5.254
136 HD1 PHE 22 HD1 PHE 22 -1.632 -1.190 -3.390
137 HD2 PHE 22 HD2 PHE 22 -4.499 1.806 -4.348
138 HE1 PHE 22 HE1 PHE 22 -0.304 0.472 -2.153
139 HE2 PHE 22 HE2 PHE 22 -3.176 3.473 -3.114
140 HZ PHE 22 HZ PHE 22 -1.075 2.807 -2.015
141 H CYS 23 H CYS 23 -7.089 -2.436 -3.773
142 HA CYS 23 HA CYS 23 -7.245 -4.946 -4.841
143 HB2 CYS 23 1HB CYS 23 -9.554 -4.399 -5.502
144 HB3 CYS 23 2HB CYS 23 -9.177 -3.789 -3.896
145 HG CYS 23 HG CYS 23 -10.433 -1.624 -4.597
146 H GLY 24 H GLY 24 -6.497 -2.006 -6.485
147 HA2 GLY 24 1HA GLY 24 -6.232 -3.522 -8.987
148 HA3 GLY 24 2HA GLY 24 -7.141 -2.018 -9.004
149 H ARG 25 H ARG 25 -4.281 -3.257 -9.827
150 HA ARG 25 HA ARG 25 -2.281 -1.680 -8.789
151 HB2 ARG 25 1HB ARG 25 -2.106 -3.588 -10.481
152 HB3 ARG 25 2HB ARG 25 -2.433 -2.379 -11.715
153 HG2 ARG 25 1HG ARG 25 -0.179 -2.297 -11.777
154 HG3 ARG 25 2HG ARG 25 -0.428 -1.151 -10.458
155 HD2 ARG 25 1HD ARG 25 0.028 -2.823 -8.820
156 HD3 ARG 25 2HD ARG 25 0.009 -4.100 -10.036
157 HE ARG 25 HE ARG 25 2.014 -2.047 -10.417
158 HH11 ARG 25 1HH1 ARG 25 1.248 -5.170 -9.083
159 HH12 ARG 25 2HH1 ARG 25 2.899 -5.694 -9.022
160 HH21 ARG 25 1HH2 ARG 25 4.191 -2.725 -10.341
161 HH22 ARG 25 2HH2 ARG 25 4.572 -4.302 -9.737
162 H SER 26 H SER 26 -4.430 -0.938 -11.516
163 HA SER 26 HA SER 26 -3.508 1.324 -12.572
164 HB2 SER 26 1HB SER 26 -6.335 0.808 -11.638
165 HB3 SER 26 2HB SER 26 -5.892 2.186 -12.645
166 HG SER 26 HG SER 26 -5.618 0.898 -14.312
167 H ARG 27 H ARG 27 -4.782 1.045 -9.314
168 HA ARG 27 HA ARG 27 -4.499 3.898 -8.832
169 HB2 ARG 27 1HB ARG 27 -6.289 2.165 -7.872
170 HB3 ARG 27 2HB ARG 27 -5.068 1.994 -6.617
171 HG2 ARG 27 1HG ARG 27 -5.877 4.740 -7.392
172 HG3 ARG 27 2HG ARG 27 -7.014 3.771 -6.452
173 HD2 ARG 27 1HD ARG 27 -4.189 3.843 -5.548
174 HD3 ARG 27 2HD ARG 27 -5.157 5.297 -5.313
175 HE ARG 27 HE ARG 27 -6.379 2.845 -4.390
176 HH11 ARG 27 1HH1 ARG 27 -4.401 5.594 -3.585
177 HH12 ARG 27 2HH1 ARG 27 -4.711 5.484 -1.884
178 HH21 ARG 27 1HH2 ARG 27 -6.794 2.689 -2.152
179 HH22 ARG 27 2HH2 ARG 27 -6.071 3.830 -1.070
180 H LEU 28 H LEU 28 -3.173 0.882 -7.472
181 HA LEU 28 HA LEU 28 -1.363 1.906 -5.688
182 HB2 LEU 28 1HB LEU 28 -1.552 -0.399 -5.681
183 HB3 LEU 28 2HB LEU 28 -1.343 -0.522 -7.427
184 HG LEU 28 HG LEU 28 1.032 -0.120 -7.209
185 HD11 LEU 28 1HD1 LEU 28 0.395 0.269 -4.295
186 HD12 LEU 28 2HD1 LEU 28 1.161 1.406 -5.404
187 HD13 LEU 28 3HD1 LEU 28 2.023 -0.045 -4.896
188 HD21 LEU 28 3HD2 LEU 28 -0.352 -2.342 -5.984
189 HD22 LEU 28 1HD2 LEU 28 1.231 -2.083 -5.250
190 HD23 LEU 28 2HD2 LEU 28 1.097 -2.332 -6.991
191 H ASN 29 H ASN 29 -0.735 1.210 -9.127
192 HA ASN 29 HA ASN 29 1.864 1.947 -9.378
193 HB2 ASN 29 1HB ASN 29 -0.493 2.149 -11.177
194 HB3 ASN 29 2HB ASN 29 0.951 3.038 -11.654
195 HD21 ASN 29 1HD2 ASN 29 -0.608 0.295 -12.192
196 HD22 ASN 29 2HD2 ASN 29 0.709 -0.771 -12.528
197 H ARG 30 H ARG 30 -0.904 4.184 -9.497
198 HA ARG 30 HA ARG 30 0.632 6.531 -9.776
199 HB2 ARG 30 1HB ARG 30 -2.051 6.450 -8.418
200 HB3 ARG 30 2HB ARG 30 -1.368 7.721 -9.423
201 HG2 ARG 30 1HG ARG 30 -2.440 5.055 -10.297
202 HG3 ARG 30 2HG ARG 30 -3.054 6.661 -10.696
203 HD2 ARG 30 1HD ARG 30 -0.264 5.884 -11.444
204 HD3 ARG 30 2HD ARG 30 -1.626 5.357 -12.433
205 HE ARG 30 HE ARG 30 -1.654 8.170 -11.892
206 HH11 ARG 30 1HH1 ARG 30 -0.354 5.687 -13.957
207 HH12 ARG 30 2HH1 ARG 30 -0.075 6.759 -15.289
208 HH21 ARG 30 1HH2 ARG 30 -1.292 9.591 -13.639
209 HH22 ARG 30 2HH2 ARG 30 -0.609 8.979 -15.107
210 H HIS 31 H HIS 31 -0.572 4.795 -6.951
211 HA HIS 31 HA HIS 31 0.021 6.692 -4.989
212 HB2 HIS 31 1HB HIS 31 -1.298 4.852 -4.323
213 HB3 HIS 31 2HB HIS 31 -0.128 3.685 -4.932
214 HD1 HIS 31 HD1 HIS 31 -0.426 6.263 -2.160
215 HD2 HIS 31 HD2 HIS 31 1.574 2.730 -3.042
216 HE1 HIS 31 HE1 HIS 31 0.809 5.647 -0.058
217 H SER 32 H SER 32 2.046 4.210 -6.477
218 HA SER 32 HA SER 32 4.274 4.422 -4.808
219 HB2 SER 32 1HB SER 32 3.957 2.642 -6.510
220 HB3 SER 32 2HB SER 32 4.266 3.828 -7.778
221 HG SER 32 HG SER 32 6.344 3.869 -7.264
222 H MET 33 H MET 33 2.975 6.684 -6.968
223 HA MET 33 HA MET 33 5.470 8.045 -7.520
224 HB2 MET 33 1HB MET 33 2.690 9.096 -8.026
225 HB3 MET 33 2HB MET 33 4.184 9.562 -8.827
226 HG2 MET 33 1HG MET 33 3.170 6.758 -9.014
227 HG3 MET 33 2HG MET 33 2.519 8.025 -10.051
228 HE1 MET 33 3HE MET 33 4.656 5.385 -9.535
229 HE2 MET 33 1HE MET 33 5.775 5.371 -10.898
230 HE3 MET 33 2HE MET 33 6.257 6.108 -9.370
231 H VAL 34 H VAL 34 2.829 8.252 -5.260
232 HA VAL 34 HA VAL 34 3.293 10.894 -4.348
233 HB VAL 34 HB VAL 34 1.854 10.395 -2.518
234 HG11 VAL 34 1HG1 VAL 34 0.001 9.053 -3.720
235 HG12 VAL 34 2HG1 VAL 34 0.535 10.582 -4.421
236 HG13 VAL 34 3HG1 VAL 34 1.110 9.055 -5.091
237 HG21 VAL 34 3HG2 VAL 34 3.050 7.804 -2.690
238 HG22 VAL 34 1HG2 VAL 34 2.063 8.489 -1.398
239 HG23 VAL 34 2HG2 VAL 34 1.295 7.639 -2.739
240 H HIS 35 H HIS 35 4.972 7.960 -3.869
241 HA HIS 35 HA HIS 35 6.105 8.591 -1.313
242 HB2 HIS 35 1HB HIS 35 6.671 6.512 -3.409
243 HB3 HIS 35 2HB HIS 35 7.751 6.723 -2.035
244 HD1 HIS 35 HD1 HIS 35 6.643 6.318 0.367
245 HD2 HIS 35 HD2 HIS 35 4.422 5.038 -2.902
246 HE1 HIS 35 HE1 HIS 35 4.917 4.747 1.302
247 H THR 36 H THR 36 6.767 9.475 -4.554
248 HA THR 36 HA THR 36 9.414 10.508 -3.775
249 HB THR 36 HB THR 36 9.365 8.862 -5.680
250 HG1 THR 36 HG1 THR 36 10.870 10.056 -6.828
251 HG21 THR 36 3HG2 THR 36 7.910 9.122 -7.345
252 HG22 THR 36 1HG2 THR 36 8.635 10.679 -7.743
253 HG23 THR 36 2HG2 THR 36 7.303 10.595 -6.589
254 H ALA 37 H ALA 37 6.263 11.307 -4.956
255 HA ALA 37 HA ALA 37 6.925 13.930 -5.902
256 HB1 ALA 37 3HB ALA 37 4.922 13.737 -6.833
257 HB2 ALA 37 1HB ALA 37 4.658 12.228 -5.960
258 HB3 ALA 37 2HB ALA 37 4.168 13.762 -5.239
259 H GLU 38 H GLU 38 8.136 14.624 -3.992
260 HA GLU 38 HA GLU 38 6.360 15.941 -2.083
261 HB2 GLU 38 1HB GLU 38 8.609 14.075 -1.358
262 HB3 GLU 38 2HB GLU 38 8.043 15.317 -0.249
263 HG2 GLU 38 1HG GLU 38 6.203 13.275 -1.451
264 HG3 GLU 38 2HG GLU 38 7.091 12.992 0.045
265 H LYS 39 H LYS 39 6.971 17.970 -1.617
266 HA LYS 39 HA LYS 39 9.445 18.943 -2.833
267 HB2 LYS 39 1HB LYS 39 7.062 20.423 -1.708
268 HB3 LYS 39 2HB LYS 39 8.469 21.196 -2.424
269 HG2 LYS 39 1HG LYS 39 7.847 19.611 -4.451
270 HG3 LYS 39 2HG LYS 39 6.246 19.722 -3.715
271 HD2 LYS 39 1HD LYS 39 7.805 22.227 -4.118
272 HD3 LYS 39 2HD LYS 39 7.053 21.468 -5.523
273 HE2 LYS 39 1HE LYS 39 4.905 21.436 -4.188
274 HE3 LYS 39 2HE LYS 39 5.719 22.477 -3.021
275 HZ1 LYS 39 3HZ LYS 39 5.436 23.138 -5.899
276 HZ2 LYS 39 1HZ LYS 39 5.992 24.153 -4.665
277 HZ3 LYS 39 2HZ LYS 39 4.370 23.678 -4.702
278 HA PRO 40 HA PRO 40 11.586 19.480 0.964
279 HB2 PRO 40 1HB PRO 40 13.056 21.695 0.418
280 HB3 PRO 40 2HB PRO 40 13.402 20.114 -0.292
281 HG2 PRO 40 1HG PRO 40 11.937 22.441 -1.474
282 HG3 PRO 40 2HG PRO 40 13.140 21.378 -2.226
283 HD2 PRO 40 1HD PRO 40 10.480 21.089 -2.640
284 HD3 PRO 40 2HD PRO 40 11.600 19.712 -2.630
285 H SER 41 H SER 41 11.866 20.900 2.799
286 HA SER 41 HA SER 41 9.600 22.117 3.722
287 HB2 SER 41 1HB SER 41 11.595 21.543 5.104
288 HB3 SER 41 2HB SER 41 12.416 22.959 4.449
289 HG SER 41 HG SER 41 9.997 22.971 5.938
290 H GLY 42 H GLY 42 12.360 23.733 2.158
291 HA2 GLY 42 1HA GLY 42 10.699 25.657 0.886
292 HA3 GLY 42 2HA GLY 42 11.469 26.355 2.304
293 HA PRO 43 HA PRO 43 14.271 26.356 -1.550
294 HB2 PRO 43 1HB PRO 43 14.043 28.979 -2.211
295 HB3 PRO 43 2HB PRO 43 12.991 27.725 -2.879
296 HG2 PRO 43 1HG PRO 43 12.471 29.637 -0.634
297 HG3 PRO 43 2HG PRO 43 11.396 29.143 -1.955
298 HD2 PRO 43 1HD PRO 43 11.210 28.106 0.539
299 HD3 PRO 43 2HD PRO 43 10.820 27.168 -0.917
300 H SER 44 H SER 44 14.042 27.566 1.503
301 HA SER 44 HA SER 44 16.260 29.384 1.503
302 HB2 SER 44 1HB SER 44 14.637 28.062 3.669
303 HB3 SER 44 2HB SER 44 16.068 29.020 4.050
304 HG SER 44 HG SER 44 13.599 29.864 3.485
305 H SER 45 H SER 45 17.212 27.259 0.208
306 HA SER 45 HA SER 45 18.662 25.573 2.101
307 HB2 SER 45 1HB SER 45 18.261 25.481 -0.884
308 HB3 SER 45 2HB SER 45 19.488 24.493 -0.092
309 HG SER 45 HG SER 45 17.246 23.607 -0.414
310 H GLY 46 H GLY 46 19.397 28.252 2.195
311 HA2 GLY 46 1HA GLY 46 22.001 28.287 0.805
312 HA3 GLY 46 2HA GLY 46 21.129 29.721 1.328
Start of MODEL 16
1 H1 GLY 1 H GLY 1 -19.509 -18.884 22.847
2 HA2 GLY 1 1HA GLY 1 -20.799 -17.968 21.182
3 HA3 GLY 1 2HA GLY 1 -20.013 -16.459 21.621
4 H SER 2 H SER 2 -20.737 -16.658 19.079
5 HA SER 2 HA SER 2 -18.980 -17.911 17.299
6 HB2 SER 2 1HB SER 2 -21.222 -16.846 16.760
7 HB3 SER 2 2HB SER 2 -20.390 -15.291 16.769
8 HG SER 2 HG SER 2 -19.252 -17.310 15.236
9 H SER 3 H SER 3 -16.852 -17.636 17.969
10 HA SER 3 HA SER 3 -15.780 -14.905 17.678
11 HB2 SER 3 1HB SER 3 -15.505 -15.716 19.960
12 HB3 SER 3 2HB SER 3 -14.734 -17.189 19.371
13 HG SER 3 HG SER 3 -13.729 -14.598 19.560
14 H GLY 4 H GLY 4 -13.631 -14.724 16.758
15 HA2 GLY 4 1HA GLY 4 -12.468 -16.986 15.411
16 HA3 GLY 4 2HA GLY 4 -13.286 -15.881 14.316
17 H SER 5 H SER 5 -10.931 -15.918 13.539
18 HA SER 5 HA SER 5 -9.662 -13.509 14.582
19 HB2 SER 5 1HB SER 5 -8.458 -16.241 14.655
20 HB3 SER 5 2HB SER 5 -7.406 -14.879 14.272
21 HG SER 5 HG SER 5 -8.111 -15.650 16.642
22 H SER 6 H SER 6 -8.512 -12.362 13.061
23 HA SER 6 HA SER 6 -9.234 -12.409 10.442
24 HB2 SER 6 1HB SER 6 -7.152 -11.133 9.959
25 HB3 SER 6 2HB SER 6 -7.993 -10.546 11.393
26 HG SER 6 HG SER 6 -6.010 -10.747 12.159
27 H GLY 7 H GLY 7 -8.164 -13.050 8.474
28 HA2 GLY 7 1HA GLY 7 -6.220 -15.231 8.738
29 HA3 GLY 7 2HA GLY 7 -7.739 -15.569 7.922
30 H THR 8 H THR 8 -7.419 -15.668 5.808
31 HA THR 8 HA THR 8 -5.430 -13.897 4.578
32 HB THR 8 HB THR 8 -5.717 -15.379 2.567
33 HG1 THR 8 HG1 THR 8 -7.843 -16.171 3.389
34 HG21 THR 8 3HG2 THR 8 -4.643 -17.416 3.745
35 HG22 THR 8 1HG2 THR 8 -4.749 -16.431 5.204
36 HG23 THR 8 2HG2 THR 8 -3.813 -15.862 3.821
37 H GLY 9 H GLY 9 -6.090 -12.130 3.555
38 HA2 GLY 9 1HA GLY 9 -8.287 -12.101 1.754
39 HA3 GLY 9 2HA GLY 9 -8.731 -11.329 3.269
40 H GLU 10 H GLU 10 -5.642 -11.300 1.520
41 HA GLU 10 HA GLU 10 -5.575 -8.405 1.745
42 HB2 GLU 10 1HB GLU 10 -3.282 -8.550 1.099
43 HB3 GLU 10 2HB GLU 10 -3.582 -9.848 2.246
44 HG2 GLU 10 1HG GLU 10 -3.811 -10.401 -0.671
45 HG3 GLU 10 2HG GLU 10 -2.215 -10.281 0.068
46 H LYS 11 H LYS 11 -4.418 -7.369 -0.320
47 HA LYS 11 HA LYS 11 -6.312 -7.778 -2.494
48 HB2 LYS 11 1HB LYS 11 -4.475 -5.594 -1.653
49 HB3 LYS 11 2HB LYS 11 -4.857 -5.714 -3.365
50 HG2 LYS 11 1HG LYS 11 -6.373 -4.176 -2.338
51 HG3 LYS 11 2HG LYS 11 -7.263 -5.632 -2.790
52 HD2 LYS 11 1HD LYS 11 -6.633 -6.332 -0.310
53 HD3 LYS 11 2HD LYS 11 -6.567 -4.581 -0.097
54 HE2 LYS 11 1HE LYS 11 -8.911 -6.046 -1.298
55 HE3 LYS 11 2HE LYS 11 -8.788 -5.620 0.409
56 HZ1 LYS 11 3HZ LYS 11 -8.266 -3.284 -0.879
57 HZ2 LYS 11 1HZ LYS 11 -9.746 -3.717 -0.182
58 HZ3 LYS 11 2HZ LYS 11 -9.480 -3.976 -1.832
59 HA PRO 12 HA PRO 12 -3.587 -9.854 -5.235
60 HB2 PRO 12 1HB PRO 12 -4.263 -8.766 -7.629
61 HB3 PRO 12 2HB PRO 12 -5.310 -9.890 -6.754
62 HG2 PRO 12 1HG PRO 12 -5.430 -6.902 -6.886
63 HG3 PRO 12 2HG PRO 12 -6.753 -8.079 -6.975
64 HD2 PRO 12 1HD PRO 12 -6.167 -6.713 -4.711
65 HD3 PRO 12 2HD PRO 12 -6.820 -8.364 -4.688
66 H PHE 13 H PHE 13 -3.115 -6.718 -4.399
67 HA PHE 13 HA PHE 13 -0.569 -6.616 -5.839
68 HB2 PHE 13 1HB PHE 13 -2.499 -4.293 -5.663
69 HB3 PHE 13 2HB PHE 13 -0.875 -4.224 -6.338
70 HD1 PHE 13 HD1 PHE 13 -0.366 -5.308 -8.466
71 HD2 PHE 13 HD2 PHE 13 -4.316 -5.260 -6.882
72 HE1 PHE 13 HE1 PHE 13 -1.254 -5.940 -10.672
73 HE2 PHE 13 HE2 PHE 13 -5.211 -5.893 -9.085
74 HZ PHE 13 HZ PHE 13 -3.680 -6.235 -10.983
75 H LYS 14 H LYS 14 0.885 -4.895 -4.908
76 HA LYS 14 HA LYS 14 0.340 -4.006 -2.228
77 HB2 LYS 14 1HB LYS 14 0.962 -6.341 -1.804
78 HB3 LYS 14 2HB LYS 14 2.465 -6.108 -2.687
79 HG2 LYS 14 1HG LYS 14 2.896 -4.230 -0.949
80 HG3 LYS 14 2HG LYS 14 1.671 -5.076 -0.001
81 HD2 LYS 14 1HD LYS 14 2.991 -7.152 -0.205
82 HD3 LYS 14 2HD LYS 14 4.232 -6.254 -1.082
83 HE2 LYS 14 1HE LYS 14 4.531 -4.798 0.880
84 HE3 LYS 14 2HE LYS 14 3.325 -5.744 1.751
85 HZ1 LYS 14 3HZ LYS 14 5.711 -6.326 2.196
86 HZ2 LYS 14 1HZ LYS 14 5.789 -6.942 0.622
87 HZ3 LYS 14 2HZ LYS 14 4.723 -7.623 1.745
88 H CYS 15 H CYS 15 1.856 -2.492 -1.466
89 HA CYS 15 HA CYS 15 3.297 -1.137 -3.555
90 HB2 CYS 15 1HB CYS 15 1.991 -0.149 -1.498
91 HB3 CYS 15 2HB CYS 15 3.526 -0.382 -0.667
92 H ASP 16 H ASP 16 5.548 -0.194 -2.784
93 HA ASP 16 HA ASP 16 7.172 -2.467 -1.846
94 HB2 ASP 16 1HB ASP 16 7.497 -0.677 -4.199
95 HB3 ASP 16 2HB ASP 16 8.960 -1.158 -3.344
96 H ILE 17 H ILE 17 6.426 0.876 -1.585
97 HA ILE 17 HA ILE 17 8.808 1.479 -0.021
98 HB ILE 17 HB ILE 17 6.465 3.310 -0.512
99 HG12 ILE 17 1HG1 ILE 17 8.276 4.191 -2.282
100 HG13 ILE 17 2HG1 ILE 17 8.685 2.479 -2.308
101 HG21 ILE 17 1HG2 ILE 17 8.050 3.934 1.268
102 HG22 ILE 17 2HG2 ILE 17 9.361 3.892 0.090
103 HG23 ILE 17 3HG2 ILE 17 8.063 5.074 -0.078
104 HD11 ILE 17 3HD1 ILE 17 7.011 2.111 -3.694
105 HD12 ILE 17 1HD1 ILE 17 5.871 2.694 -2.482
106 HD13 ILE 17 2HD1 ILE 17 6.580 3.820 -3.640
107 H CYS 18 H CYS 18 5.284 1.362 0.420
108 HA CYS 18 HA CYS 18 5.745 1.204 3.328
109 HB2 CYS 18 1HB CYS 18 3.545 2.235 3.647
110 HB3 CYS 18 2HB CYS 18 4.596 3.281 2.698
111 H GLY 19 H GLY 19 4.852 -0.523 0.656
112 HA2 GLY 19 1HA GLY 19 4.067 -2.691 0.496
113 HA3 GLY 19 2HA GLY 19 3.856 -2.699 2.241
114 H LYS 20 H LYS 20 2.357 -0.018 0.916
115 HA LYS 20 HA LYS 20 -0.207 -0.703 1.688
116 HB2 LYS 20 1HB LYS 20 0.966 1.355 -0.098
117 HB3 LYS 20 2HB LYS 20 -0.760 1.065 -0.263
118 HG2 LYS 20 1HG LYS 20 0.535 1.628 2.387
119 HG3 LYS 20 2HG LYS 20 -0.064 2.904 1.324
120 HD2 LYS 20 1HD LYS 20 -2.249 2.373 1.693
121 HD3 LYS 20 2HD LYS 20 -1.905 0.657 1.927
122 HE2 LYS 20 1HE LYS 20 -1.097 2.767 3.914
123 HE3 LYS 20 2HE LYS 20 -2.661 1.955 3.972
124 HZ1 LYS 20 3HZ LYS 20 -1.559 -0.148 4.236
125 HZ2 LYS 20 1HZ LYS 20 -0.984 0.920 5.416
126 HZ3 LYS 20 2HZ LYS 20 -0.037 0.568 4.060
127 H SER 21 H SER 21 -1.907 -1.735 0.780
128 HA SER 21 HA SER 21 -1.393 -3.143 -1.739
129 HB2 SER 21 1HB SER 21 -2.759 -4.840 -0.992
130 HB3 SER 21 2HB SER 21 -2.196 -4.214 0.558
131 HG SER 21 HG SER 21 -4.287 -4.108 0.900
132 H PHE 22 H PHE 22 -3.118 -3.349 -3.308
133 HA PHE 22 HA PHE 22 -5.283 -1.420 -3.183
134 HB2 PHE 22 1HB PHE 22 -3.228 -1.304 -5.402
135 HB3 PHE 22 2HB PHE 22 -4.691 -0.330 -5.292
136 HD1 PHE 22 HD1 PHE 22 -1.568 -1.093 -3.416
137 HD2 PHE 22 HD2 PHE 22 -4.592 1.761 -4.323
138 HE1 PHE 22 HE1 PHE 22 -0.326 0.618 -2.156
139 HE2 PHE 22 HE2 PHE 22 -3.355 3.477 -3.066
140 HZ PHE 22 HZ PHE 22 -1.219 2.906 -1.981
141 H CYS 23 H CYS 23 -7.012 -2.532 -3.776
142 HA CYS 23 HA CYS 23 -7.135 -5.021 -4.875
143 HB2 CYS 23 1HB CYS 23 -9.450 -4.450 -5.603
144 HB3 CYS 23 2HB CYS 23 -9.102 -3.975 -3.945
145 HG CYS 23 HG CYS 23 -9.683 -2.028 -6.650
146 H GLY 24 H GLY 24 -6.645 -1.995 -6.543
147 HA2 GLY 24 1HA GLY 24 -6.272 -3.517 -9.039
148 HA3 GLY 24 2HA GLY 24 -7.210 -2.030 -9.041
149 H ARG 25 H ARG 25 -4.296 -3.245 -9.811
150 HA ARG 25 HA ARG 25 -2.320 -1.660 -8.804
151 HB2 ARG 25 1HB ARG 25 -2.234 -3.499 -10.631
152 HB3 ARG 25 2HB ARG 25 -2.458 -2.170 -11.761
153 HG2 ARG 25 1HG ARG 25 -0.186 -2.294 -11.737
154 HG3 ARG 25 2HG ARG 25 -0.438 -1.136 -10.429
155 HD2 ARG 25 1HD ARG 25 1.019 -2.598 -9.429
156 HD3 ARG 25 2HD ARG 25 -0.527 -3.299 -8.952
157 HE ARG 25 HE ARG 25 -0.004 -4.624 -11.217
158 HH11 ARG 25 1HH1 ARG 25 1.971 -3.934 -8.434
159 HH12 ARG 25 2HH1 ARG 25 2.919 -5.377 -8.586
160 HH21 ARG 25 1HH2 ARG 25 1.237 -6.526 -11.428
161 HH22 ARG 25 2HH2 ARG 25 2.500 -6.850 -10.290
162 H SER 26 H SER 26 -4.607 -0.817 -11.372
163 HA SER 26 HA SER 26 -3.711 1.489 -12.391
164 HB2 SER 26 1HB SER 26 -6.072 0.347 -12.551
165 HB3 SER 26 2HB SER 26 -6.512 1.536 -11.325
166 HG SER 26 HG SER 26 -6.040 3.163 -12.730
167 H ARG 27 H ARG 27 -4.878 1.065 -9.109
168 HA ARG 27 HA ARG 27 -4.632 3.895 -8.512
169 HB2 ARG 27 1HB ARG 27 -6.445 2.456 -7.541
170 HB3 ARG 27 2HB ARG 27 -5.208 1.617 -6.615
171 HG2 ARG 27 1HG ARG 27 -6.360 3.309 -5.283
172 HG3 ARG 27 2HG ARG 27 -4.642 3.670 -5.458
173 HD2 ARG 27 1HD ARG 27 -5.019 5.492 -6.781
174 HD3 ARG 27 2HD ARG 27 -6.513 4.834 -7.447
175 HE ARG 27 HE ARG 27 -6.219 6.415 -5.045
176 HH11 ARG 27 1HH1 ARG 27 -8.240 4.249 -6.873
177 HH12 ARG 27 2HH1 ARG 27 -9.707 4.761 -6.106
178 HH21 ARG 27 1HH2 ARG 27 -8.144 7.098 -4.027
179 HH22 ARG 27 2HH2 ARG 27 -9.651 6.382 -4.488
180 H LEU 28 H LEU 28 -3.156 0.870 -7.336
181 HA LEU 28 HA LEU 28 -1.275 1.909 -5.624
182 HB2 LEU 28 1HB LEU 28 -1.457 -0.405 -5.643
183 HB3 LEU 28 2HB LEU 28 -1.290 -0.501 -7.394
184 HG LEU 28 HG LEU 28 1.086 -0.046 -7.223
185 HD11 LEU 28 1HD1 LEU 28 1.134 1.436 -5.335
186 HD12 LEU 28 2HD1 LEU 28 2.160 0.044 -4.990
187 HD13 LEU 28 3HD1 LEU 28 0.558 0.159 -4.263
188 HD21 LEU 28 3HD2 LEU 28 1.194 -2.262 -7.077
189 HD22 LEU 28 1HD2 LEU 28 -0.231 -2.330 -6.041
190 HD23 LEU 28 2HD2 LEU 28 1.362 -2.066 -5.331
191 H ASN 29 H ASN 29 -0.688 1.094 -9.050
192 HA ASN 29 HA ASN 29 1.827 1.901 -9.459
193 HB2 ASN 29 1HB ASN 29 -0.627 2.145 -11.118
194 HB3 ASN 29 2HB ASN 29 0.792 3.035 -11.661
195 HD21 ASN 29 1HD2 ASN 29 -0.807 0.331 -12.196
196 HD22 ASN 29 2HD2 ASN 29 0.480 -0.745 -12.609
197 H ARG 30 H ARG 30 -0.920 4.175 -9.504
198 HA ARG 30 HA ARG 30 0.657 6.499 -9.752
199 HB2 ARG 30 1HB ARG 30 -2.035 6.442 -8.410
200 HB3 ARG 30 2HB ARG 30 -1.324 7.720 -9.387
201 HG2 ARG 30 1HG ARG 30 -2.407 5.078 -10.327
202 HG3 ARG 30 2HG ARG 30 -3.033 6.691 -10.674
203 HD2 ARG 30 1HD ARG 30 -0.238 5.973 -11.451
204 HD3 ARG 30 2HD ARG 30 -1.591 5.439 -12.448
205 HE ARG 30 HE ARG 30 -2.106 8.046 -12.214
206 HH11 ARG 30 1HH1 ARG 30 0.842 6.355 -12.968
207 HH12 ARG 30 2HH1 ARG 30 1.475 7.631 -13.954
208 HH21 ARG 30 1HH2 ARG 30 -1.283 9.733 -13.509
209 HH22 ARG 30 2HH2 ARG 30 0.266 9.553 -14.260
210 H HIS 31 H HIS 31 -0.612 4.771 -6.947
211 HA HIS 31 HA HIS 31 0.005 6.628 -4.963
212 HB2 HIS 31 1HB HIS 31 -1.336 4.794 -4.324
213 HB3 HIS 31 2HB HIS 31 -0.174 3.622 -4.941
214 HD1 HIS 31 HD1 HIS 31 -0.511 6.138 -2.122
215 HD2 HIS 31 HD2 HIS 31 1.558 2.663 -3.072
216 HE1 HIS 31 HE1 HIS 31 0.720 5.494 -0.026
217 H SER 32 H SER 32 2.015 4.167 -6.495
218 HA SER 32 HA SER 32 4.241 4.372 -4.796
219 HB2 SER 32 1HB SER 32 3.893 2.544 -6.449
220 HB3 SER 32 2HB SER 32 4.237 3.688 -7.746
221 HG SER 32 HG SER 32 5.959 2.290 -6.275
222 H MET 33 H MET 33 2.963 6.583 -7.014
223 HA MET 33 HA MET 33 5.475 7.898 -7.609
224 HB2 MET 33 1HB MET 33 2.710 8.959 -8.167
225 HB3 MET 33 2HB MET 33 4.213 9.377 -8.978
226 HG2 MET 33 1HG MET 33 3.180 6.577 -9.067
227 HG3 MET 33 2HG MET 33 2.525 7.809 -10.143
228 HE1 MET 33 3HE MET 33 4.593 5.166 -9.594
229 HE2 MET 33 1HE MET 33 5.630 5.075 -11.018
230 HE3 MET 33 2HE MET 33 6.241 5.794 -9.527
231 H VAL 34 H VAL 34 2.847 8.184 -5.352
232 HA VAL 34 HA VAL 34 3.299 10.858 -4.537
233 HB VAL 34 HB VAL 34 1.877 10.416 -2.683
234 HG11 VAL 34 1HG1 VAL 34 0.489 10.506 -4.514
235 HG12 VAL 34 2HG1 VAL 34 1.153 9.035 -5.227
236 HG13 VAL 34 3HG1 VAL 34 0.061 8.932 -3.845
237 HG21 VAL 34 3HG2 VAL 34 3.087 7.817 -2.780
238 HG22 VAL 34 1HG2 VAL 34 2.152 8.565 -1.486
239 HG23 VAL 34 2HG2 VAL 34 1.331 7.661 -2.759
240 H HIS 35 H HIS 35 4.934 7.903 -3.886
241 HA HIS 35 HA HIS 35 6.105 8.653 -1.394
242 HB2 HIS 35 1HB HIS 35 6.699 6.508 -3.419
243 HB3 HIS 35 2HB HIS 35 7.744 6.762 -2.025
244 HD1 HIS 35 HD1 HIS 35 6.590 6.409 0.357
245 HD2 HIS 35 HD2 HIS 35 4.430 5.057 -2.923
246 HE1 HIS 35 HE1 HIS 35 4.842 4.863 1.295
247 H THR 36 H THR 36 6.851 9.246 -4.723
248 HA THR 36 HA THR 36 9.473 10.354 -3.984
249 HB THR 36 HB THR 36 9.364 8.658 -5.847
250 HG1 THR 36 HG1 THR 36 10.558 10.271 -7.324
251 HG21 THR 36 3HG2 THR 36 7.904 8.910 -7.509
252 HG22 THR 36 1HG2 THR 36 8.639 10.454 -7.936
253 HG23 THR 36 2HG2 THR 36 7.320 10.399 -6.766
254 H ALA 37 H ALA 37 6.304 11.176 -5.049
255 HA ALA 37 HA ALA 37 7.035 13.800 -6.024
256 HB1 ALA 37 3HB ALA 37 4.896 13.982 -6.789
257 HB2 ALA 37 1HB ALA 37 5.024 12.225 -6.712
258 HB3 ALA 37 2HB ALA 37 4.211 13.109 -5.419
259 H GLU 38 H GLU 38 8.091 14.540 -4.068
260 HA GLU 38 HA GLU 38 6.230 15.234 -1.898
261 HB2 GLU 38 1HB GLU 38 8.241 15.564 -0.510
262 HB3 GLU 38 2HB GLU 38 8.138 13.931 -1.152
263 HG2 GLU 38 1HG GLU 38 9.657 14.869 -3.043
264 HG3 GLU 38 2HG GLU 38 10.020 16.129 -1.865
265 H LYS 39 H LYS 39 5.352 17.156 -2.415
266 HA LYS 39 HA LYS 39 7.016 19.271 -3.533
267 HB2 LYS 39 1HB LYS 39 4.058 18.951 -3.091
268 HB3 LYS 39 2HB LYS 39 4.754 20.516 -3.488
269 HG2 LYS 39 1HG LYS 39 5.779 19.391 -5.512
270 HG3 LYS 39 2HG LYS 39 4.726 18.020 -5.155
271 HD2 LYS 39 1HD LYS 39 2.788 19.245 -5.579
272 HD3 LYS 39 2HD LYS 39 3.613 20.794 -5.393
273 HE2 LYS 39 1HE LYS 39 4.995 19.907 -7.459
274 HE3 LYS 39 2HE LYS 39 3.549 18.933 -7.717
275 HZ1 LYS 39 3HZ LYS 39 3.125 20.845 -8.916
276 HZ2 LYS 39 1HZ LYS 39 3.833 21.866 -7.768
277 HZ3 LYS 39 2HZ LYS 39 2.327 21.161 -7.458
278 HA PRO 40 HA PRO 40 7.723 21.280 0.320
279 HB2 PRO 40 1HB PRO 40 8.155 23.804 -0.581
280 HB3 PRO 40 2HB PRO 40 9.330 22.499 -0.781
281 HG2 PRO 40 1HG PRO 40 7.349 23.582 -2.747
282 HG3 PRO 40 2HG PRO 40 9.045 23.131 -3.001
283 HD2 PRO 40 1HD PRO 40 6.987 21.518 -3.705
284 HD3 PRO 40 2HD PRO 40 8.555 20.885 -3.162
285 H SER 41 H SER 41 4.970 21.642 -1.475
286 HA SER 41 HA SER 41 3.865 23.802 0.166
287 HB2 SER 41 1HB SER 41 3.551 23.830 -2.326
288 HB3 SER 41 2HB SER 41 2.566 22.376 -2.165
289 HG SER 41 HG SER 41 1.477 23.904 -0.473
290 H GLY 42 H GLY 42 2.958 23.223 2.022
291 HA2 GLY 42 1HA GLY 42 0.870 21.278 2.116
292 HA3 GLY 42 2HA GLY 42 2.338 20.675 2.872
293 HA PRO 43 HA PRO 43 -0.271 23.365 5.794
294 HB2 PRO 43 1HB PRO 43 -1.222 21.380 7.383
295 HB3 PRO 43 2HB PRO 43 -2.080 21.958 5.950
296 HG2 PRO 43 1HG PRO 43 -0.340 19.543 6.271
297 HG3 PRO 43 2HG PRO 43 -1.892 19.700 5.427
298 HD2 PRO 43 1HD PRO 43 0.481 19.698 4.123
299 HD3 PRO 43 2HD PRO 43 -0.922 20.623 3.551
300 H SER 44 H SER 44 -0.101 23.205 8.302
301 HA SER 44 HA SER 44 2.062 21.780 9.448
302 HB2 SER 44 1HB SER 44 3.621 23.635 9.818
303 HB3 SER 44 2HB SER 44 3.389 23.359 8.091
304 HG SER 44 HG SER 44 1.683 25.186 9.302
305 H SER 45 H SER 45 1.206 21.433 11.381
306 HA SER 45 HA SER 45 -0.669 23.209 12.595
307 HB2 SER 45 1HB SER 45 -0.834 20.804 12.959
308 HB3 SER 45 2HB SER 45 0.761 20.785 13.712
309 HG SER 45 HG SER 45 -0.447 22.530 15.099
310 H GLY 46 H GLY 46 -0.435 24.542 14.368
311 HA2 GLY 46 1HA GLY 46 2.011 24.732 15.843
312 HA3 GLY 46 2HA GLY 46 1.857 26.027 14.666
Start of MODEL 17
1 H1 GLY 1 H GLY 1 11.451 -13.734 11.662
2 HA2 GLY 1 1HA GLY 1 11.237 -10.831 12.151
3 HA3 GLY 1 2HA GLY 1 12.510 -11.590 11.207
4 H SER 2 H SER 2 11.203 -13.208 9.498
5 HA SER 2 HA SER 2 10.262 -11.425 7.535
6 HB2 SER 2 1HB SER 2 11.273 -13.463 6.809
7 HB3 SER 2 2HB SER 2 10.143 -14.437 7.749
8 HG SER 2 HG SER 2 9.139 -12.706 5.787
9 H SER 3 H SER 3 8.457 -10.278 7.901
10 HA SER 3 HA SER 3 5.983 -11.785 8.410
11 HB2 SER 3 1HB SER 3 5.191 -10.171 9.970
12 HB3 SER 3 2HB SER 3 6.841 -10.547 10.464
13 HG SER 3 HG SER 3 6.654 -8.344 10.473
14 H GLY 4 H GLY 4 4.395 -11.364 7.009
15 HA2 GLY 4 1HA GLY 4 3.652 -8.929 5.945
16 HA3 GLY 4 2HA GLY 4 4.841 -9.581 4.827
17 H SER 5 H SER 5 4.330 -12.174 4.630
18 HA SER 5 HA SER 5 1.498 -12.311 3.819
19 HB2 SER 5 1HB SER 5 3.353 -12.226 1.994
20 HB3 SER 5 2HB SER 5 3.655 -13.901 2.457
21 HG SER 5 HG SER 5 1.086 -12.937 1.759
22 H SER 6 H SER 6 0.735 -13.361 5.623
23 HA SER 6 HA SER 6 1.094 -16.183 5.710
24 HB2 SER 6 1HB SER 6 3.106 -15.758 6.917
25 HB3 SER 6 2HB SER 6 2.334 -14.516 7.904
26 HG SER 6 HG SER 6 2.316 -17.258 8.177
27 H GLY 7 H GLY 7 -0.659 -17.144 6.591
28 HA2 GLY 7 1HA GLY 7 -2.579 -17.395 7.870
29 HA3 GLY 7 2HA GLY 7 -2.279 -15.815 8.577
30 H THR 8 H THR 8 -3.268 -14.026 7.738
31 HA THR 8 HA THR 8 -5.511 -14.534 5.980
32 HB THR 8 HB THR 8 -5.765 -13.095 7.984
33 HG1 THR 8 HG1 THR 8 -7.325 -12.337 6.782
34 HG21 THR 8 3HG2 THR 8 -3.852 -11.333 6.468
35 HG22 THR 8 1HG2 THR 8 -3.705 -11.936 8.118
36 HG23 THR 8 2HG2 THR 8 -4.916 -10.714 7.730
37 H GLY 9 H GLY 9 -5.844 -13.658 3.957
38 HA2 GLY 9 1HA GLY 9 -3.422 -12.880 2.539
39 HA3 GLY 9 2HA GLY 9 -4.972 -13.283 1.815
40 H GLU 10 H GLU 10 -3.959 -11.243 0.641
41 HA GLU 10 HA GLU 10 -5.513 -8.977 1.622
42 HB2 GLU 10 1HB GLU 10 -2.565 -8.837 0.977
43 HB3 GLU 10 2HB GLU 10 -3.600 -7.428 1.153
44 HG2 GLU 10 1HG GLU 10 -4.122 -8.221 3.472
45 HG3 GLU 10 2HG GLU 10 -2.865 -9.439 3.261
46 H LYS 11 H LYS 11 -5.081 -7.085 -0.134
47 HA LYS 11 HA LYS 11 -6.426 -7.784 -2.421
48 HB2 LYS 11 1HB LYS 11 -4.653 -5.516 -1.676
49 HB3 LYS 11 2HB LYS 11 -5.042 -5.705 -3.380
50 HG2 LYS 11 1HG LYS 11 -6.598 -4.182 -2.383
51 HG3 LYS 11 2HG LYS 11 -7.444 -5.675 -2.796
52 HD2 LYS 11 1HD LYS 11 -6.802 -6.303 -0.308
53 HD3 LYS 11 2HD LYS 11 -6.756 -4.548 -0.128
54 HE2 LYS 11 1HE LYS 11 -9.066 -4.647 -1.332
55 HE3 LYS 11 2HE LYS 11 -9.059 -6.329 -0.806
56 HZ1 LYS 11 3HZ LYS 11 -9.878 -4.195 0.673
57 HZ2 LYS 11 1HZ LYS 11 -8.337 -4.521 1.291
58 HZ3 LYS 11 2HZ LYS 11 -9.515 -5.734 1.274
59 HA PRO 12 HA PRO 12 -3.691 -9.822 -5.180
60 HB2 PRO 12 1HB PRO 12 -4.358 -8.738 -7.577
61 HB3 PRO 12 2HB PRO 12 -5.408 -9.862 -6.706
62 HG2 PRO 12 1HG PRO 12 -5.530 -6.874 -6.842
63 HG3 PRO 12 2HG PRO 12 -6.851 -8.053 -6.935
64 HD2 PRO 12 1HD PRO 12 -6.277 -6.683 -4.671
65 HD3 PRO 12 2HD PRO 12 -6.928 -8.335 -4.648
66 H PHE 13 H PHE 13 -3.218 -6.693 -4.335
67 HA PHE 13 HA PHE 13 -0.668 -6.587 -5.766
68 HB2 PHE 13 1HB PHE 13 -2.617 -4.277 -5.616
69 HB3 PHE 13 2HB PHE 13 -0.979 -4.185 -6.254
70 HD1 PHE 13 HD1 PHE 13 -0.407 -5.270 -8.370
71 HD2 PHE 13 HD2 PHE 13 -4.395 -5.248 -6.882
72 HE1 PHE 13 HE1 PHE 13 -1.237 -5.906 -10.597
73 HE2 PHE 13 HE2 PHE 13 -5.231 -5.885 -9.107
74 HZ PHE 13 HZ PHE 13 -3.652 -6.215 -10.967
75 H LYS 14 H LYS 14 0.789 -4.883 -4.827
76 HA LYS 14 HA LYS 14 0.228 -3.967 -2.161
77 HB2 LYS 14 1HB LYS 14 0.812 -6.303 -1.703
78 HB3 LYS 14 2HB LYS 14 2.324 -6.106 -2.579
79 HG2 LYS 14 1HG LYS 14 2.758 -4.204 -0.854
80 HG3 LYS 14 2HG LYS 14 1.533 -5.050 0.095
81 HD2 LYS 14 1HD LYS 14 2.841 -7.105 -0.027
82 HD3 LYS 14 2HD LYS 14 4.053 -6.287 -1.017
83 HE2 LYS 14 1HE LYS 14 4.707 -4.889 0.774
84 HE3 LYS 14 2HE LYS 14 3.296 -5.334 1.734
85 HZ1 LYS 14 3HZ LYS 14 5.262 -7.381 0.939
86 HZ2 LYS 14 1HZ LYS 14 4.185 -7.388 2.244
87 HZ3 LYS 14 2HZ LYS 14 5.554 -6.395 2.282
88 H CYS 15 H CYS 15 1.716 -2.433 -1.423
89 HA CYS 15 HA CYS 15 3.222 -1.141 -3.502
90 HB2 CYS 15 1HB CYS 15 1.882 -0.058 -1.554
91 HB3 CYS 15 2HB CYS 15 3.333 -0.359 -0.604
92 H ASP 16 H ASP 16 5.475 -0.258 -2.841
93 HA ASP 16 HA ASP 16 7.055 -2.509 -1.780
94 HB2 ASP 16 1HB ASP 16 7.456 -0.736 -4.142
95 HB3 ASP 16 2HB ASP 16 8.887 -1.272 -3.265
96 H ILE 17 H ILE 17 6.339 0.845 -1.580
97 HA ILE 17 HA ILE 17 8.706 1.459 -0.002
98 HB ILE 17 HB ILE 17 6.369 3.297 -0.475
99 HG12 ILE 17 1HG1 ILE 17 8.103 4.136 -2.328
100 HG13 ILE 17 2HG1 ILE 17 8.526 2.428 -2.335
101 HG21 ILE 17 1HG2 ILE 17 9.285 3.758 0.134
102 HG22 ILE 17 2HG2 ILE 17 8.121 5.031 -0.230
103 HG23 ILE 17 3HG2 ILE 17 7.919 4.038 1.213
104 HD11 ILE 17 3HD1 ILE 17 6.608 1.827 -3.335
105 HD12 ILE 17 1HD1 ILE 17 5.651 3.031 -2.472
106 HD13 ILE 17 2HD1 ILE 17 6.613 3.506 -3.872
107 H CYS 18 H CYS 18 5.178 1.371 0.431
108 HA CYS 18 HA CYS 18 5.632 1.204 3.339
109 HB2 CYS 18 1HB CYS 18 3.459 2.280 3.663
110 HB3 CYS 18 2HB CYS 18 4.521 3.304 2.702
111 H GLY 19 H GLY 19 4.722 -0.507 0.667
112 HA2 GLY 19 1HA GLY 19 3.904 -2.663 0.508
113 HA3 GLY 19 2HA GLY 19 3.670 -2.660 2.250
114 H LYS 20 H LYS 20 2.239 0.041 0.885
115 HA LYS 20 HA LYS 20 -0.346 -0.590 1.631
116 HB2 LYS 20 1HB LYS 20 0.891 1.435 -0.144
117 HB3 LYS 20 2HB LYS 20 -0.836 1.173 -0.346
118 HG2 LYS 20 1HG LYS 20 0.392 1.712 2.338
119 HG3 LYS 20 2HG LYS 20 -0.118 3.007 1.253
120 HD2 LYS 20 1HD LYS 20 -2.356 2.462 1.443
121 HD3 LYS 20 2HD LYS 20 -2.016 0.795 1.912
122 HE2 LYS 20 1HE LYS 20 -1.455 1.410 4.103
123 HE3 LYS 20 2HE LYS 20 -1.261 3.108 3.670
124 HZ1 LYS 20 3HZ LYS 20 -3.697 1.601 4.235
125 HZ2 LYS 20 1HZ LYS 20 -3.795 2.806 3.052
126 HZ3 LYS 20 2HZ LYS 20 -3.300 3.200 4.620
127 H SER 21 H SER 21 -2.024 -1.649 0.735
128 HA SER 21 HA SER 21 -1.512 -3.081 -1.764
129 HB2 SER 21 1HB SER 21 -2.949 -4.723 -1.023
130 HB3 SER 21 2HB SER 21 -2.396 -4.091 0.528
131 HG SER 21 HG SER 21 -4.351 -3.447 0.923
132 H PHE 22 H PHE 22 -3.305 -3.332 -3.309
133 HA PHE 22 HA PHE 22 -5.379 -1.317 -3.286
134 HB2 PHE 22 1HB PHE 22 -3.270 -1.300 -5.456
135 HB3 PHE 22 2HB PHE 22 -4.721 -0.303 -5.421
136 HD1 PHE 22 HD1 PHE 22 -1.638 -1.039 -3.477
137 HD2 PHE 22 HD2 PHE 22 -4.652 1.801 -4.461
138 HE1 PHE 22 HE1 PHE 22 -0.410 0.691 -2.229
139 HE2 PHE 22 HE2 PHE 22 -3.429 3.535 -3.216
140 HZ PHE 22 HZ PHE 22 -1.305 2.982 -2.099
141 H CYS 23 H CYS 23 -7.091 -2.520 -3.766
142 HA CYS 23 HA CYS 23 -7.226 -4.987 -4.891
143 HB2 CYS 23 1HB CYS 23 -9.560 -4.463 -5.525
144 HB3 CYS 23 2HB CYS 23 -9.168 -3.915 -3.900
145 HG CYS 23 HG CYS 23 -8.601 -1.508 -6.089
146 H GLY 24 H GLY 24 -6.537 -2.028 -6.512
147 HA2 GLY 24 1HA GLY 24 -6.308 -3.508 -9.037
148 HA3 GLY 24 2HA GLY 24 -7.241 -2.019 -9.019
149 H ARG 25 H ARG 25 -4.278 -3.301 -9.685
150 HA ARG 25 HA ARG 25 -2.320 -1.689 -8.741
151 HB2 ARG 25 1HB ARG 25 -2.169 -3.550 -10.495
152 HB3 ARG 25 2HB ARG 25 -2.502 -2.299 -11.685
153 HG2 ARG 25 1HG ARG 25 -0.244 -2.242 -11.756
154 HG3 ARG 25 2HG ARG 25 -0.487 -1.113 -10.422
155 HD2 ARG 25 1HD ARG 25 -0.131 -2.906 -8.817
156 HD3 ARG 25 2HD ARG 25 0.051 -4.066 -10.133
157 HE ARG 25 HE ARG 25 1.898 -1.837 -10.171
158 HH11 ARG 25 1HH1 ARG 25 1.300 -5.121 -9.180
159 HH12 ARG 25 2HH1 ARG 25 2.980 -5.519 -9.029
160 HH21 ARG 25 1HH2 ARG 25 4.112 -2.349 -9.976
161 HH22 ARG 25 2HH2 ARG 25 4.578 -3.941 -9.481
162 H SER 26 H SER 26 -4.613 -0.871 -11.308
163 HA SER 26 HA SER 26 -3.724 1.406 -12.382
164 HB2 SER 26 1HB SER 26 -6.059 0.338 -12.581
165 HB3 SER 26 2HB SER 26 -6.508 1.376 -11.227
166 HG SER 26 HG SER 26 -5.644 2.127 -13.812
167 H ARG 27 H ARG 27 -4.905 1.092 -9.079
168 HA ARG 27 HA ARG 27 -4.567 3.918 -8.544
169 HB2 ARG 27 1HB ARG 27 -5.540 1.559 -6.980
170 HB3 ARG 27 2HB ARG 27 -5.048 3.015 -6.125
171 HG2 ARG 27 1HG ARG 27 -7.120 2.943 -8.307
172 HG3 ARG 27 2HG ARG 27 -7.477 2.889 -6.580
173 HD2 ARG 27 1HD ARG 27 -6.262 5.059 -6.343
174 HD3 ARG 27 2HD ARG 27 -6.140 5.120 -8.101
175 HE ARG 27 HE ARG 27 -8.823 4.804 -7.078
176 HH11 ARG 27 1HH1 ARG 27 -6.340 7.029 -8.080
177 HH12 ARG 27 2HH1 ARG 27 -7.448 8.320 -8.410
178 HH21 ARG 27 1HH2 ARG 27 -10.291 6.495 -7.508
179 HH22 ARG 27 2HH2 ARG 27 -9.695 8.015 -8.083
180 H LEU 28 H LEU 28 -3.136 0.891 -7.318
181 HA LEU 28 HA LEU 28 -1.221 1.901 -5.642
182 HB2 LEU 28 1HB LEU 28 -1.453 -0.421 -5.703
183 HB3 LEU 28 2HB LEU 28 -1.228 -0.487 -7.450
184 HG LEU 28 HG LEU 28 1.133 -0.095 -7.216
185 HD11 LEU 28 1HD1 LEU 28 2.165 0.072 -4.971
186 HD12 LEU 28 2HD1 LEU 28 0.552 0.217 -4.276
187 HD13 LEU 28 3HD1 LEU 28 1.150 1.455 -5.380
188 HD21 LEU 28 3HD2 LEU 28 1.177 -2.312 -7.003
189 HD22 LEU 28 1HD2 LEU 28 -0.228 -2.315 -5.938
190 HD23 LEU 28 2HD2 LEU 28 1.383 -2.047 -5.271
191 H ASN 29 H ASN 29 -0.710 1.151 -9.094
192 HA ASN 29 HA ASN 29 1.824 1.944 -9.505
193 HB2 ASN 29 1HB ASN 29 -0.636 2.147 -11.151
194 HB3 ASN 29 2HB ASN 29 0.754 3.079 -11.700
195 HD21 ASN 29 1HD2 ASN 29 -0.779 0.285 -12.143
196 HD22 ASN 29 2HD2 ASN 29 0.537 -0.734 -12.606
197 H ARG 30 H ARG 30 -0.938 4.199 -9.526
198 HA ARG 30 HA ARG 30 0.614 6.535 -9.800
199 HB2 ARG 30 1HB ARG 30 -2.073 6.399 -8.441
200 HB3 ARG 30 2HB ARG 30 -1.378 7.745 -9.333
201 HG2 ARG 30 1HG ARG 30 -2.547 5.199 -10.382
202 HG3 ARG 30 2HG ARG 30 -2.965 6.866 -10.783
203 HD2 ARG 30 1HD ARG 30 -0.817 7.141 -11.908
204 HD3 ARG 30 2HD ARG 30 -0.377 5.487 -11.487
205 HE ARG 30 HE ARG 30 -1.672 4.740 -13.219
206 HH11 ARG 30 1HH1 ARG 30 -2.494 8.051 -12.527
207 HH12 ARG 30 2HH1 ARG 30 -3.519 8.223 -13.912
208 HH21 ARG 30 1HH2 ARG 30 -3.020 4.954 -15.047
209 HH22 ARG 30 2HH2 ARG 30 -3.818 6.460 -15.345
210 H HIS 31 H HIS 31 -0.559 4.777 -6.977
211 HA HIS 31 HA HIS 31 0.067 6.649 -5.003
212 HB2 HIS 31 1HB HIS 31 -1.258 4.756 -4.407
213 HB3 HIS 31 2HB HIS 31 -0.011 3.632 -4.938
214 HD1 HIS 31 HD1 HIS 31 -0.432 6.327 -2.284
215 HD2 HIS 31 HD2 HIS 31 1.530 2.719 -2.912
216 HE1 HIS 31 HE1 HIS 31 0.706 5.793 -0.106
217 H SER 32 H SER 32 2.057 4.101 -6.455
218 HA SER 32 HA SER 32 4.312 4.364 -4.837
219 HB2 SER 32 1HB SER 32 3.940 2.535 -6.489
220 HB3 SER 32 2HB SER 32 4.282 3.679 -7.786
221 HG SER 32 HG SER 32 6.009 2.554 -5.893
222 H MET 33 H MET 33 2.979 6.591 -6.984
223 HA MET 33 HA MET 33 5.475 7.905 -7.655
224 HB2 MET 33 1HB MET 33 2.717 9.018 -8.114
225 HB3 MET 33 2HB MET 33 4.194 9.361 -9.003
226 HG2 MET 33 1HG MET 33 3.128 6.584 -8.996
227 HG3 MET 33 2HG MET 33 2.345 7.803 -9.998
228 HE1 MET 33 3HE MET 33 6.139 6.098 -9.483
229 HE2 MET 33 1HE MET 33 4.637 5.193 -9.670
230 HE3 MET 33 2HE MET 33 5.783 5.284 -11.007
231 H VAL 34 H VAL 34 2.997 8.106 -5.255
232 HA VAL 34 HA VAL 34 3.519 10.800 -4.445
233 HB VAL 34 HB VAL 34 1.988 10.470 -2.716
234 HG11 VAL 34 1HG1 VAL 34 1.408 9.220 -5.259
235 HG12 VAL 34 2HG1 VAL 34 0.440 8.529 -3.956
236 HG13 VAL 34 3HG1 VAL 34 0.398 10.266 -4.261
237 HG21 VAL 34 3HG2 VAL 34 3.011 7.691 -2.741
238 HG22 VAL 34 1HG2 VAL 34 2.638 8.751 -1.382
239 HG23 VAL 34 2HG2 VAL 34 1.337 7.926 -2.240
240 H HIS 35 H HIS 35 5.063 7.802 -3.919
241 HA HIS 35 HA HIS 35 6.245 8.454 -1.382
242 HB2 HIS 35 1HB HIS 35 6.631 6.252 -3.388
243 HB3 HIS 35 2HB HIS 35 7.766 6.455 -2.056
244 HD1 HIS 35 HD1 HIS 35 6.664 6.300 0.401
245 HD2 HIS 35 HD2 HIS 35 4.358 4.887 -2.753
246 HE1 HIS 35 HE1 HIS 35 4.883 4.873 1.457
247 H THR 36 H THR 36 6.884 9.251 -4.627
248 HA THR 36 HA THR 36 9.575 10.203 -3.888
249 HB THR 36 HB THR 36 9.601 8.350 -5.576
250 HG1 THR 36 HG1 THR 36 11.225 10.064 -5.461
251 HG21 THR 36 3HG2 THR 36 8.800 8.693 -7.787
252 HG22 THR 36 1HG2 THR 36 8.432 10.386 -7.465
253 HG23 THR 36 2HG2 THR 36 7.473 9.116 -6.705
254 H ALA 37 H ALA 37 6.906 11.520 -3.751
255 HA ALA 37 HA ALA 37 7.340 13.703 -5.678
256 HB1 ALA 37 3HB ALA 37 5.119 12.447 -5.625
257 HB2 ALA 37 1HB ALA 37 4.822 13.280 -4.098
258 HB3 ALA 37 2HB ALA 37 5.054 14.209 -5.580
259 H GLU 38 H GLU 38 8.950 13.518 -3.364
260 HA GLU 38 HA GLU 38 8.114 15.973 -1.989
261 HB2 GLU 38 1HB GLU 38 8.833 15.098 0.159
262 HB3 GLU 38 2HB GLU 38 7.590 14.060 -0.524
263 HG2 GLU 38 1HG GLU 38 9.279 12.466 -1.230
264 HG3 GLU 38 2HG GLU 38 10.550 13.517 -0.607
265 H LYS 39 H LYS 39 9.677 17.460 -1.817
266 HA LYS 39 HA LYS 39 11.983 17.471 -3.244
267 HB2 LYS 39 1HB LYS 39 12.716 19.330 -1.944
268 HB3 LYS 39 2HB LYS 39 10.960 19.406 -1.998
269 HG2 LYS 39 1HG LYS 39 11.159 18.075 0.260
270 HG3 LYS 39 2HG LYS 39 12.765 18.805 0.285
271 HD2 LYS 39 1HD LYS 39 10.311 20.457 -0.217
272 HD3 LYS 39 2HD LYS 39 10.832 20.067 1.423
273 HE2 LYS 39 1HE LYS 39 12.981 21.110 1.021
274 HE3 LYS 39 2HE LYS 39 12.545 21.418 -0.659
275 HZ1 LYS 39 3HZ LYS 39 11.712 23.346 0.000
276 HZ2 LYS 39 1HZ LYS 39 11.991 22.979 1.628
277 HZ3 LYS 39 2HZ LYS 39 10.537 22.522 0.896
278 HA PRO 40 HA PRO 40 14.824 14.681 -1.374
279 HB2 PRO 40 1HB PRO 40 17.156 15.782 -2.222
280 HB3 PRO 40 2HB PRO 40 16.069 14.892 -3.294
281 HG2 PRO 40 1HG PRO 40 16.368 17.848 -2.931
282 HG3 PRO 40 2HG PRO 40 16.188 16.918 -4.429
283 HD2 PRO 40 1HD PRO 40 14.125 18.242 -3.279
284 HD3 PRO 40 2HD PRO 40 13.903 16.732 -4.188
285 H SER 41 H SER 41 14.517 15.087 0.835
286 HA SER 41 HA SER 41 15.573 17.356 2.173
287 HB2 SER 41 1HB SER 41 14.599 14.667 3.134
288 HB3 SER 41 2HB SER 41 15.217 15.891 4.243
289 HG SER 41 HG SER 41 13.148 16.417 2.385
290 H GLY 42 H GLY 42 16.612 13.939 2.302
291 HA2 GLY 42 1HA GLY 42 19.325 14.399 1.873
292 HA3 GLY 42 2HA GLY 42 19.060 14.507 3.607
293 HA PRO 43 HA PRO 43 19.227 10.006 1.885
294 HB2 PRO 43 1HB PRO 43 21.895 9.509 1.923
295 HB3 PRO 43 2HB PRO 43 21.050 10.108 0.491
296 HG2 PRO 43 1HG PRO 43 22.670 11.618 2.505
297 HG3 PRO 43 2HG PRO 43 22.658 11.770 0.739
298 HD2 PRO 43 1HD PRO 43 21.333 13.489 2.358
299 HD3 PRO 43 2HD PRO 43 20.748 13.062 0.738
300 H SER 44 H SER 44 18.284 9.752 3.987
301 HA SER 44 HA SER 44 20.250 9.124 6.092
302 HB2 SER 44 1HB SER 44 17.378 9.989 6.498
303 HB3 SER 44 2HB SER 44 18.588 9.726 7.753
304 HG SER 44 HG SER 44 18.184 11.975 6.992
305 H SER 45 H SER 45 19.576 7.415 7.607
306 HA SER 45 HA SER 45 18.625 5.128 6.159
307 HB2 SER 45 1HB SER 45 19.443 5.489 9.050
308 HB3 SER 45 2HB SER 45 19.005 3.937 8.335
309 HG SER 45 HG SER 45 20.858 3.876 7.309
310 H GLY 46 H GLY 46 17.497 6.832 9.085
311 HA2 GLY 46 1HA GLY 46 14.743 6.344 8.318
312 HA3 GLY 46 2HA GLY 46 15.265 5.498 9.767
Start of MODEL 18
1 H1 GLY 1 H GLY 1 -13.167 5.571 14.892
2 HA2 GLY 1 1HA GLY 1 -13.538 7.262 12.538
3 HA3 GLY 1 2HA GLY 1 -11.904 6.709 12.872
4 H SER 2 H SER 2 -11.432 4.468 12.741
5 HA SER 2 HA SER 2 -13.476 2.856 11.370
6 HB2 SER 2 1HB SER 2 -11.860 3.740 9.713
7 HB3 SER 2 2HB SER 2 -10.546 2.983 10.614
8 HG SER 2 HG SER 2 -12.686 1.712 9.260
9 H SER 3 H SER 3 -13.903 1.120 12.543
10 HA SER 3 HA SER 3 -12.280 0.238 14.687
11 HB2 SER 3 1HB SER 3 -13.907 -1.463 15.027
12 HB3 SER 3 2HB SER 3 -14.798 -0.062 14.431
13 HG SER 3 HG SER 3 -14.435 -1.130 12.277
14 H GLY 4 H GLY 4 -11.738 -2.223 14.832
15 HA2 GLY 4 1HA GLY 4 -10.058 -2.818 12.491
16 HA3 GLY 4 2HA GLY 4 -9.777 -3.405 14.124
17 H SER 5 H SER 5 -12.445 -3.512 11.755
18 HA SER 5 HA SER 5 -12.335 -6.361 11.565
19 HB2 SER 5 1HB SER 5 -13.422 -6.257 13.733
20 HB3 SER 5 2HB SER 5 -14.614 -5.113 13.118
21 HG SER 5 HG SER 5 -14.548 -7.831 12.922
22 H SER 6 H SER 6 -12.826 -6.729 9.517
23 HA SER 6 HA SER 6 -15.207 -5.599 8.332
24 HB2 SER 6 1HB SER 6 -13.117 -4.000 8.026
25 HB3 SER 6 2HB SER 6 -12.718 -5.140 6.740
26 HG SER 6 HG SER 6 -15.270 -4.600 6.477
27 H GLY 7 H GLY 7 -15.658 -6.518 6.187
28 HA2 GLY 7 1HA GLY 7 -14.800 -9.300 6.111
29 HA3 GLY 7 2HA GLY 7 -16.105 -8.585 5.177
30 H THR 8 H THR 8 -12.626 -7.871 5.476
31 HA THR 8 HA THR 8 -12.322 -8.430 2.614
32 HB THR 8 HB THR 8 -10.868 -6.378 2.414
33 HG1 THR 8 HG1 THR 8 -10.922 -6.183 4.877
34 HG21 THR 8 3HG2 THR 8 -13.742 -5.761 3.088
35 HG22 THR 8 1HG2 THR 8 -13.236 -6.540 1.590
36 HG23 THR 8 2HG2 THR 8 -12.694 -4.903 1.959
37 H GLY 9 H GLY 9 -10.246 -9.059 1.975
38 HA2 GLY 9 1HA GLY 9 -8.424 -9.674 4.219
39 HA3 GLY 9 2HA GLY 9 -8.632 -10.714 2.818
40 H GLU 10 H GLU 10 -6.626 -10.721 1.960
41 HA GLU 10 HA GLU 10 -5.118 -8.263 1.698
42 HB2 GLU 10 1HB GLU 10 -3.325 -9.638 0.883
43 HB3 GLU 10 2HB GLU 10 -4.038 -10.437 2.277
44 HG2 GLU 10 1HG GLU 10 -5.022 -11.165 -0.430
45 HG3 GLU 10 2HG GLU 10 -3.446 -11.760 0.089
46 H LYS 11 H LYS 11 -4.438 -7.348 -0.266
47 HA LYS 11 HA LYS 11 -6.343 -7.720 -2.440
48 HB2 LYS 11 1HB LYS 11 -4.473 -5.569 -1.595
49 HB3 LYS 11 2HB LYS 11 -4.829 -5.693 -3.313
50 HG2 LYS 11 1HG LYS 11 -6.353 -4.134 -2.398
51 HG3 LYS 11 2HG LYS 11 -7.263 -5.612 -2.719
52 HD2 LYS 11 1HD LYS 11 -6.056 -5.291 -0.025
53 HD3 LYS 11 2HD LYS 11 -7.460 -4.296 -0.417
54 HE2 LYS 11 1HE LYS 11 -7.385 -7.285 -0.783
55 HE3 LYS 11 2HE LYS 11 -7.964 -6.502 0.687
56 HZ1 LYS 11 3HZ LYS 11 -9.138 -5.495 -1.753
57 HZ2 LYS 11 1HZ LYS 11 -9.874 -5.913 -0.288
58 HZ3 LYS 11 2HZ LYS 11 -9.506 -7.113 -1.422
59 HA PRO 12 HA PRO 12 -3.650 -9.882 -5.148
60 HB2 PRO 12 1HB PRO 12 -4.322 -8.823 -7.556
61 HB3 PRO 12 2HB PRO 12 -5.379 -9.921 -6.661
62 HG2 PRO 12 1HG PRO 12 -5.465 -6.934 -6.839
63 HG3 PRO 12 2HG PRO 12 -6.802 -8.098 -6.904
64 HD2 PRO 12 1HD PRO 12 -6.192 -6.704 -4.664
65 HD3 PRO 12 2HD PRO 12 -6.864 -8.347 -4.613
66 H PHE 13 H PHE 13 -3.134 -6.744 -4.355
67 HA PHE 13 HA PHE 13 -0.599 -6.687 -5.820
68 HB2 PHE 13 1HB PHE 13 -2.500 -4.340 -5.634
69 HB3 PHE 13 2HB PHE 13 -0.879 -4.290 -6.320
70 HD1 PHE 13 HD1 PHE 13 -0.399 -5.361 -8.455
71 HD2 PHE 13 HD2 PHE 13 -4.333 -5.315 -6.831
72 HE1 PHE 13 HE1 PHE 13 -1.310 -5.990 -10.653
73 HE2 PHE 13 HE2 PHE 13 -5.250 -5.944 -9.026
74 HZ PHE 13 HZ PHE 13 -3.738 -6.283 -10.940
75 H LYS 14 H LYS 14 0.862 -4.928 -4.921
76 HA LYS 14 HA LYS 14 0.364 -4.057 -2.227
77 HB2 LYS 14 1HB LYS 14 1.006 -6.391 -1.824
78 HB3 LYS 14 2HB LYS 14 2.493 -6.146 -2.731
79 HG2 LYS 14 1HG LYS 14 2.940 -4.271 -0.993
80 HG3 LYS 14 2HG LYS 14 1.737 -5.130 -0.028
81 HD2 LYS 14 1HD LYS 14 3.063 -7.190 -0.240
82 HD3 LYS 14 2HD LYS 14 4.275 -6.303 -1.168
83 HE2 LYS 14 1HE LYS 14 4.621 -4.816 0.771
84 HE3 LYS 14 2HE LYS 14 3.464 -5.777 1.691
85 HZ1 LYS 14 3HZ LYS 14 5.483 -6.663 2.315
86 HZ2 LYS 14 1HZ LYS 14 6.164 -6.513 0.773
87 HZ3 LYS 14 2HZ LYS 14 5.018 -7.719 1.077
88 H CYS 15 H CYS 15 1.911 -2.558 -1.474
89 HA CYS 15 HA CYS 15 3.307 -1.189 -3.592
90 HB2 CYS 15 1HB CYS 15 2.015 -0.185 -1.547
91 HB3 CYS 15 2HB CYS 15 3.538 -0.434 -0.700
92 H ASP 16 H ASP 16 5.564 -0.255 -2.913
93 HA ASP 16 HA ASP 16 7.209 -2.511 -1.967
94 HB2 ASP 16 1HB ASP 16 7.498 -0.710 -4.317
95 HB3 ASP 16 2HB ASP 16 8.973 -1.188 -3.481
96 H ILE 17 H ILE 17 6.473 0.844 -1.718
97 HA ILE 17 HA ILE 17 8.862 1.454 -0.176
98 HB ILE 17 HB ILE 17 6.491 3.262 -0.616
99 HG12 ILE 17 1HG1 ILE 17 8.259 4.173 -2.412
100 HG13 ILE 17 2HG1 ILE 17 8.691 2.467 -2.453
101 HG21 ILE 17 1HG2 ILE 17 8.052 5.042 -0.177
102 HG22 ILE 17 2HG2 ILE 17 8.124 3.874 1.142
103 HG23 ILE 17 3HG2 ILE 17 9.390 3.896 -0.086
104 HD11 ILE 17 3HD1 ILE 17 6.954 2.017 -3.739
105 HD12 ILE 17 1HD1 ILE 17 5.847 2.749 -2.578
106 HD13 ILE 17 2HD1 ILE 17 6.613 3.746 -3.816
107 H CYS 18 H CYS 18 5.343 1.350 0.333
108 HA CYS 18 HA CYS 18 5.861 1.152 3.229
109 HB2 CYS 18 1HB CYS 18 3.673 2.187 3.603
110 HB3 CYS 18 2HB CYS 18 4.706 3.238 2.639
111 H GLY 19 H GLY 19 4.928 -0.556 0.565
112 HA2 GLY 19 1HA GLY 19 4.131 -2.717 0.398
113 HA3 GLY 19 2HA GLY 19 3.951 -2.740 2.146
114 H LYS 20 H LYS 20 2.439 -0.054 0.811
115 HA LYS 20 HA LYS 20 -0.113 -0.719 1.649
116 HB2 LYS 20 1HB LYS 20 1.047 1.325 -0.151
117 HB3 LYS 20 2HB LYS 20 -0.677 1.028 -0.336
118 HG2 LYS 20 1HG LYS 20 0.590 1.618 2.323
119 HG3 LYS 20 2HG LYS 20 -0.015 2.878 1.246
120 HD2 LYS 20 1HD LYS 20 -2.203 2.300 1.576
121 HD3 LYS 20 2HD LYS 20 -1.821 0.605 1.888
122 HE2 LYS 20 1HE LYS 20 -2.507 1.457 3.962
123 HE3 LYS 20 2HE LYS 20 -0.746 1.422 4.051
124 HZ1 LYS 20 3HZ LYS 20 -1.880 3.506 4.870
125 HZ2 LYS 20 1HZ LYS 20 -2.236 3.851 3.252
126 HZ3 LYS 20 2HZ LYS 20 -0.626 3.730 3.756
127 H SER 21 H SER 21 -1.814 -1.786 0.800
128 HA SER 21 HA SER 21 -1.362 -3.203 -1.724
129 HB2 SER 21 1HB SER 21 -2.718 -4.895 -0.937
130 HB3 SER 21 2HB SER 21 -2.092 -4.273 0.589
131 HG SER 21 HG SER 21 -4.126 -2.815 0.260
132 H PHE 22 H PHE 22 -3.057 -3.372 -3.292
133 HA PHE 22 HA PHE 22 -5.260 -1.483 -3.113
134 HB2 PHE 22 1HB PHE 22 -3.257 -1.333 -5.375
135 HB3 PHE 22 2HB PHE 22 -4.713 -0.358 -5.205
136 HD1 PHE 22 HD1 PHE 22 -1.470 -1.115 -3.563
137 HD2 PHE 22 HD2 PHE 22 -4.643 1.675 -4.082
138 HE1 PHE 22 HE1 PHE 22 -0.186 0.572 -2.315
139 HE2 PHE 22 HE2 PHE 22 -3.363 3.367 -2.836
140 HZ PHE 22 HZ PHE 22 -1.132 2.817 -1.952
141 H CYS 23 H CYS 23 -7.019 -2.477 -3.820
142 HA CYS 23 HA CYS 23 -7.152 -5.007 -4.868
143 HB2 CYS 23 1HB CYS 23 -9.450 -4.424 -5.616
144 HB3 CYS 23 2HB CYS 23 -9.112 -3.911 -3.967
145 HG CYS 23 HG CYS 23 -10.686 -1.961 -5.195
146 H GLY 24 H GLY 24 -6.644 -1.989 -6.560
147 HA2 GLY 24 1HA GLY 24 -6.243 -3.537 -9.038
148 HA3 GLY 24 2HA GLY 24 -7.165 -2.040 -9.061
149 H ARG 25 H ARG 25 -4.315 -3.228 -9.919
150 HA ARG 25 HA ARG 25 -2.307 -1.677 -8.861
151 HB2 ARG 25 1HB ARG 25 -2.182 -3.530 -10.640
152 HB3 ARG 25 2HB ARG 25 -2.471 -2.250 -11.811
153 HG2 ARG 25 1HG ARG 25 -0.212 -2.240 -11.850
154 HG3 ARG 25 2HG ARG 25 -0.449 -1.132 -10.497
155 HD2 ARG 25 1HD ARG 25 0.145 -2.715 -8.925
156 HD3 ARG 25 2HD ARG 25 -0.253 -4.066 -9.985
157 HE ARG 25 HE ARG 25 2.256 -2.686 -9.809
158 HH11 ARG 25 1HH1 ARG 25 0.179 -4.574 -11.869
159 HH12 ARG 25 2HH1 ARG 25 1.474 -5.151 -12.865
160 HH21 ARG 25 1HH2 ARG 25 3.969 -3.439 -11.113
161 HH22 ARG 25 2HH2 ARG 25 3.629 -4.505 -12.434
162 H SER 26 H SER 26 -4.512 -0.850 -11.515
163 HA SER 26 HA SER 26 -3.603 1.449 -12.514
164 HB2 SER 26 1HB SER 26 -5.986 0.301 -12.663
165 HB3 SER 26 2HB SER 26 -6.419 1.570 -11.517
166 HG SER 26 HG SER 26 -5.139 2.878 -13.267
167 H ARG 27 H ARG 27 -4.791 1.039 -9.244
168 HA ARG 27 HA ARG 27 -4.548 3.879 -8.667
169 HB2 ARG 27 1HB ARG 27 -6.291 2.099 -7.729
170 HB3 ARG 27 2HB ARG 27 -5.034 1.874 -6.519
171 HG2 ARG 27 1HG ARG 27 -6.087 4.597 -7.193
172 HG3 ARG 27 2HG ARG 27 -6.894 3.550 -6.023
173 HD2 ARG 27 1HD ARG 27 -5.518 4.636 -4.586
174 HD3 ARG 27 2HD ARG 27 -4.401 3.369 -5.092
175 HE ARG 27 HE ARG 27 -3.108 4.977 -6.061
176 HH11 ARG 27 1HH1 ARG 27 -6.324 6.241 -5.643
177 HH12 ARG 27 2HH1 ARG 27 -5.906 7.837 -6.173
178 HH21 ARG 27 1HH2 ARG 27 -2.545 7.073 -6.761
179 HH22 ARG 27 2HH2 ARG 27 -3.757 8.309 -6.810
180 H LEU 28 H LEU 28 -3.155 0.845 -7.412
181 HA LEU 28 HA LEU 28 -1.308 1.850 -5.659
182 HB2 LEU 28 1HB LEU 28 -1.495 -0.462 -5.709
183 HB3 LEU 28 2HB LEU 28 -1.287 -0.538 -7.457
184 HG LEU 28 HG LEU 28 1.082 -0.120 -7.235
185 HD11 LEU 28 1HD1 LEU 28 1.226 1.367 -5.411
186 HD12 LEU 28 2HD1 LEU 28 2.066 -0.099 -4.905
187 HD13 LEU 28 3HD1 LEU 28 0.435 0.229 -4.320
188 HD21 LEU 28 3HD2 LEU 28 -0.277 -2.384 -6.087
189 HD22 LEU 28 1HD2 LEU 28 1.277 -2.120 -5.295
190 HD23 LEU 28 2HD2 LEU 28 1.204 -2.329 -7.045
191 H ASN 29 H ASN 29 -0.656 1.109 -9.089
192 HA ASN 29 HA ASN 29 1.891 1.919 -9.391
193 HB2 ASN 29 1HB ASN 29 -0.498 2.113 -11.146
194 HB3 ASN 29 2HB ASN 29 0.925 3.027 -11.638
195 HD21 ASN 29 1HD2 ASN 29 -0.599 0.300 -12.239
196 HD22 ASN 29 2HD2 ASN 29 0.722 -0.756 -12.589
197 H ARG 30 H ARG 30 -0.894 4.138 -9.481
198 HA ARG 30 HA ARG 30 0.628 6.496 -9.735
199 HB2 ARG 30 1HB ARG 30 -2.083 6.305 -8.426
200 HB3 ARG 30 2HB ARG 30 -1.391 7.679 -9.278
201 HG2 ARG 30 1HG ARG 30 -2.411 5.103 -10.429
202 HG3 ARG 30 2HG ARG 30 -2.984 6.745 -10.731
203 HD2 ARG 30 1HD ARG 30 -0.952 7.289 -11.902
204 HD3 ARG 30 2HD ARG 30 -0.247 5.728 -11.482
205 HE ARG 30 HE ARG 30 -1.485 4.740 -13.155
206 HH11 ARG 30 1HH1 ARG 30 -2.546 8.019 -12.665
207 HH12 ARG 30 2HH1 ARG 30 -3.522 8.055 -14.097
208 HH21 ARG 30 1HH2 ARG 30 -2.766 4.775 -15.042
209 HH22 ARG 30 2HH2 ARG 30 -3.647 6.209 -15.448
210 H HIS 31 H HIS 31 -0.598 4.749 -6.922
211 HA HIS 31 HA HIS 31 -0.013 6.625 -4.945
212 HB2 HIS 31 1HB HIS 31 -1.314 4.770 -4.292
213 HB3 HIS 31 2HB HIS 31 -0.139 3.617 -4.917
214 HD1 HIS 31 HD1 HIS 31 -0.457 6.154 -2.110
215 HD2 HIS 31 HD2 HIS 31 1.585 2.659 -3.047
216 HE1 HIS 31 HE1 HIS 31 0.790 5.523 -0.020
217 H SER 32 H SER 32 2.037 4.161 -6.434
218 HA SER 32 HA SER 32 4.260 4.403 -4.759
219 HB2 SER 32 1HB SER 32 3.945 2.606 -6.455
220 HB3 SER 32 2HB SER 32 4.279 3.785 -7.723
221 HG SER 32 HG SER 32 6.271 3.181 -7.401
222 H MET 33 H MET 33 2.938 6.644 -6.913
223 HA MET 33 HA MET 33 5.431 8.019 -7.472
224 HB2 MET 33 1HB MET 33 2.653 9.041 -8.038
225 HB3 MET 33 2HB MET 33 4.156 9.486 -8.835
226 HG2 MET 33 1HG MET 33 3.160 6.674 -8.963
227 HG3 MET 33 2HG MET 33 2.490 7.910 -10.025
228 HE1 MET 33 3HE MET 33 5.678 5.249 -10.927
229 HE2 MET 33 1HE MET 33 6.200 5.935 -9.388
230 HE3 MET 33 2HE MET 33 4.575 5.269 -9.551
231 H VAL 34 H VAL 34 2.717 8.258 -5.290
232 HA VAL 34 HA VAL 34 3.117 10.906 -4.407
233 HB VAL 34 HB VAL 34 1.703 10.385 -2.554
234 HG11 VAL 34 1HG1 VAL 34 0.981 9.019 -5.121
235 HG12 VAL 34 2HG1 VAL 34 -0.129 9.018 -3.748
236 HG13 VAL 34 3HG1 VAL 34 0.387 10.544 -4.466
237 HG21 VAL 34 3HG2 VAL 34 1.922 8.479 -1.435
238 HG22 VAL 34 1HG2 VAL 34 1.221 7.607 -2.799
239 HG23 VAL 34 2HG2 VAL 34 2.967 7.836 -2.702
240 H HIS 35 H HIS 35 4.805 7.975 -3.765
241 HA HIS 35 HA HIS 35 5.921 8.681 -1.248
242 HB2 HIS 35 1HB HIS 35 6.627 6.654 -3.353
243 HB3 HIS 35 2HB HIS 35 7.667 6.904 -1.954
244 HD1 HIS 35 HD1 HIS 35 6.579 6.366 0.411
245 HD2 HIS 35 HD2 HIS 35 4.398 5.116 -2.897
246 HE1 HIS 35 HE1 HIS 35 4.903 4.714 1.296
247 H THR 36 H THR 36 6.731 9.408 -4.546
248 HA THR 36 HA THR 36 9.251 10.656 -3.682
249 HB THR 36 HB THR 36 9.387 8.994 -5.542
250 HG1 THR 36 HG1 THR 36 10.982 10.165 -6.319
251 HG21 THR 36 3HG2 THR 36 7.223 10.585 -6.561
252 HG22 THR 36 1HG2 THR 36 7.857 9.054 -7.162
253 HG23 THR 36 2HG2 THR 36 8.558 10.575 -7.714
254 H ALA 37 H ALA 37 6.098 11.287 -4.942
255 HA ALA 37 HA ALA 37 6.751 14.007 -5.735
256 HB1 ALA 37 3HB ALA 37 4.062 12.645 -5.685
257 HB2 ALA 37 1HB ALA 37 4.468 14.162 -6.488
258 HB3 ALA 37 2HB ALA 37 5.166 12.646 -7.060
259 H GLU 38 H GLU 38 7.188 13.397 -2.993
260 HA GLU 38 HA GLU 38 5.269 15.260 -1.778
261 HB2 GLU 38 1HB GLU 38 5.108 13.957 0.222
262 HB3 GLU 38 2HB GLU 38 4.746 12.897 -1.133
263 HG2 GLU 38 1HG GLU 38 6.848 11.833 -0.989
264 HG3 GLU 38 2HG GLU 38 7.470 13.057 0.116
265 H LYS 39 H LYS 39 6.132 16.755 -0.420
266 HA LYS 39 HA LYS 39 9.051 16.648 -0.032
267 HB2 LYS 39 1HB LYS 39 7.187 18.894 -0.670
268 HB3 LYS 39 2HB LYS 39 8.631 19.240 0.273
269 HG2 LYS 39 1HG LYS 39 10.043 18.813 -1.470
270 HG3 LYS 39 2HG LYS 39 8.927 17.685 -2.243
271 HD2 LYS 39 1HD LYS 39 8.247 20.594 -2.043
272 HD3 LYS 39 2HD LYS 39 9.325 20.015 -3.314
273 HE2 LYS 39 1HE LYS 39 7.574 18.399 -3.995
274 HE3 LYS 39 2HE LYS 39 6.499 19.102 -2.788
275 HZ1 LYS 39 3HZ LYS 39 6.743 21.248 -3.950
276 HZ2 LYS 39 1HZ LYS 39 6.025 20.057 -4.914
277 HZ3 LYS 39 2HZ LYS 39 7.645 20.477 -5.155
278 HA PRO 40 HA PRO 40 8.390 16.601 4.318
279 HB2 PRO 40 1HB PRO 40 10.755 17.655 5.135
280 HB3 PRO 40 2HB PRO 40 10.603 16.013 4.500
281 HG2 PRO 40 1HG PRO 40 11.515 18.503 3.112
282 HG3 PRO 40 2HG PRO 40 12.195 16.868 3.036
283 HD2 PRO 40 1HD PRO 40 10.589 17.867 1.100
284 HD3 PRO 40 2HD PRO 40 10.614 16.144 1.523
285 H SER 41 H SER 41 8.237 18.006 6.192
286 HA SER 41 HA SER 41 7.547 20.748 5.417
287 HB2 SER 41 1HB SER 41 5.783 19.424 6.516
288 HB3 SER 41 2HB SER 41 6.827 19.200 7.920
289 HG SER 41 HG SER 41 5.964 21.718 6.932
290 H GLY 42 H GLY 42 10.266 20.226 5.635
291 HA2 GLY 42 1HA GLY 42 12.180 20.999 6.641
292 HA3 GLY 42 2HA GLY 42 11.162 22.289 7.263
293 HA PRO 43 HA PRO 43 12.838 19.880 10.856
294 HB2 PRO 43 1HB PRO 43 13.592 22.067 12.276
295 HB3 PRO 43 2HB PRO 43 14.633 21.298 11.073
296 HG2 PRO 43 1HG PRO 43 12.909 23.731 10.808
297 HG3 PRO 43 2HG PRO 43 14.561 23.461 10.223
298 HD2 PRO 43 1HD PRO 43 12.396 23.278 8.608
299 HD3 PRO 43 2HD PRO 43 13.848 22.285 8.373
300 H SER 44 H SER 44 11.197 19.176 12.067
301 HA SER 44 HA SER 44 9.522 21.158 13.442
302 HB2 SER 44 1HB SER 44 8.211 20.326 11.554
303 HB3 SER 44 2HB SER 44 8.511 18.662 12.055
304 HG SER 44 HG SER 44 6.728 18.927 13.141
305 H SER 45 H SER 45 8.423 20.286 15.354
306 HA SER 45 HA SER 45 9.860 17.996 16.526
307 HB2 SER 45 1HB SER 45 10.572 20.261 17.423
308 HB3 SER 45 2HB SER 45 8.946 20.415 18.089
309 HG SER 45 HG SER 45 9.379 18.917 19.546
310 H GLY 46 H GLY 46 6.964 20.046 16.859
311 HA2 GLY 46 1HA GLY 46 5.531 18.078 18.367
312 HA3 GLY 46 2HA GLY 46 4.864 19.551 17.677
Start of MODEL 19
1 H1 GLY 1 H GLY 1 12.088 -12.986 12.009
2 HA2 GLY 1 1HA GLY 1 11.055 -15.003 12.373
3 HA3 GLY 1 2HA GLY 1 9.550 -14.097 12.325
4 H SER 2 H SER 2 10.397 -16.797 11.271
5 HA SER 2 HA SER 2 10.524 -16.789 8.484
6 HB2 SER 2 1HB SER 2 10.882 -18.762 10.043
7 HB3 SER 2 2HB SER 2 9.126 -18.907 10.123
8 HG SER 2 HG SER 2 9.060 -19.510 8.050
9 H SER 3 H SER 3 9.051 -16.638 6.881
10 HA SER 3 HA SER 3 6.246 -16.196 7.674
11 HB2 SER 3 1HB SER 3 6.083 -14.728 5.656
12 HB3 SER 3 2HB SER 3 7.208 -14.124 6.872
13 HG SER 3 HG SER 3 8.874 -15.208 5.580
14 H GLY 4 H GLY 4 4.701 -16.557 5.778
15 HA2 GLY 4 1HA GLY 4 5.530 -19.010 4.352
16 HA3 GLY 4 2HA GLY 4 3.911 -18.759 4.988
17 H SER 5 H SER 5 2.454 -18.260 3.507
18 HA SER 5 HA SER 5 2.985 -16.288 1.480
19 HB2 SER 5 1HB SER 5 2.491 -19.167 0.684
20 HB3 SER 5 2HB SER 5 2.414 -17.797 -0.424
21 HG SER 5 HG SER 5 4.461 -18.843 -0.449
22 H SER 6 H SER 6 1.217 -15.086 1.541
23 HA SER 6 HA SER 6 -1.273 -16.069 2.542
24 HB2 SER 6 1HB SER 6 -0.557 -13.434 1.236
25 HB3 SER 6 2HB SER 6 -2.108 -13.784 2.000
26 HG SER 6 HG SER 6 -0.740 -14.316 3.914
27 H GLY 7 H GLY 7 -3.031 -16.770 1.471
28 HA2 GLY 7 1HA GLY 7 -2.833 -16.896 -1.466
29 HA3 GLY 7 2HA GLY 7 -3.749 -18.013 -0.465
30 H THR 8 H THR 8 -5.414 -16.688 0.989
31 HA THR 8 HA THR 8 -6.784 -14.759 -0.764
32 HB THR 8 HB THR 8 -8.949 -15.722 -0.127
33 HG1 THR 8 HG1 THR 8 -8.275 -16.666 1.873
34 HG21 THR 8 3HG2 THR 8 -7.481 -18.111 -1.090
35 HG22 THR 8 1HG2 THR 8 -7.323 -16.636 -2.044
36 HG23 THR 8 2HG2 THR 8 -8.918 -17.325 -1.743
37 H GLY 9 H GLY 9 -6.712 -12.871 0.277
38 HA2 GLY 9 1HA GLY 9 -8.123 -12.323 2.595
39 HA3 GLY 9 2HA GLY 9 -6.470 -12.636 3.103
40 H GLU 10 H GLU 10 -4.896 -11.476 1.328
41 HA GLU 10 HA GLU 10 -5.520 -8.651 1.665
42 HB2 GLU 10 1HB GLU 10 -2.994 -10.067 0.804
43 HB3 GLU 10 2HB GLU 10 -3.149 -8.321 0.938
44 HG2 GLU 10 1HG GLU 10 -2.220 -8.793 2.957
45 HG3 GLU 10 2HG GLU 10 -3.928 -8.902 3.376
46 H LYS 11 H LYS 11 -4.877 -7.156 -0.145
47 HA LYS 11 HA LYS 11 -6.407 -7.718 -2.437
48 HB2 LYS 11 1HB LYS 11 -4.551 -5.548 -1.597
49 HB3 LYS 11 2HB LYS 11 -4.934 -5.668 -3.310
50 HG2 LYS 11 1HG LYS 11 -6.442 -4.118 -2.301
51 HG3 LYS 11 2HG LYS 11 -7.344 -5.576 -2.719
52 HD2 LYS 11 1HD LYS 11 -6.172 -5.386 0.008
53 HD3 LYS 11 2HD LYS 11 -7.595 -4.407 -0.355
54 HE2 LYS 11 1HE LYS 11 -8.527 -6.652 -1.318
55 HE3 LYS 11 2HE LYS 11 -7.298 -7.378 -0.284
56 HZ1 LYS 11 3HZ LYS 11 -9.716 -5.904 0.458
57 HZ2 LYS 11 1HZ LYS 11 -8.367 -5.776 1.472
58 HZ3 LYS 11 2HZ LYS 11 -9.044 -7.293 1.152
59 HA PRO 12 HA PRO 12 -3.691 -9.825 -5.166
60 HB2 PRO 12 1HB PRO 12 -4.359 -8.742 -7.564
61 HB3 PRO 12 2HB PRO 12 -5.414 -9.856 -6.686
62 HG2 PRO 12 1HG PRO 12 -5.514 -6.867 -6.830
63 HG3 PRO 12 2HG PRO 12 -6.845 -8.037 -6.915
64 HD2 PRO 12 1HD PRO 12 -6.252 -6.665 -4.656
65 HD3 PRO 12 2HD PRO 12 -6.915 -8.312 -4.628
66 H PHE 13 H PHE 13 -3.201 -6.688 -4.341
67 HA PHE 13 HA PHE 13 -0.656 -6.605 -5.787
68 HB2 PHE 13 1HB PHE 13 -2.574 -4.272 -5.600
69 HB3 PHE 13 2HB PHE 13 -0.948 -4.206 -6.272
70 HD1 PHE 13 HD1 PHE 13 -0.440 -5.262 -8.409
71 HD2 PHE 13 HD2 PHE 13 -4.389 -5.247 -6.823
72 HE1 PHE 13 HE1 PHE 13 -1.326 -5.881 -10.619
73 HE2 PHE 13 HE2 PHE 13 -5.282 -5.868 -9.030
74 HZ PHE 13 HZ PHE 13 -3.750 -6.186 -10.932
75 H LYS 14 H LYS 14 0.814 -4.895 -4.858
76 HA LYS 14 HA LYS 14 0.286 -4.008 -2.174
77 HB2 LYS 14 1HB LYS 14 0.890 -6.348 -1.754
78 HB3 LYS 14 2HB LYS 14 2.390 -6.130 -2.645
79 HG2 LYS 14 1HG LYS 14 2.831 -4.247 -0.902
80 HG3 LYS 14 2HG LYS 14 1.623 -5.112 0.051
81 HD2 LYS 14 1HD LYS 14 2.952 -7.171 -0.169
82 HD3 LYS 14 2HD LYS 14 4.170 -6.274 -1.080
83 HE2 LYS 14 1HE LYS 14 4.386 -4.758 0.917
84 HE3 LYS 14 2HE LYS 14 3.368 -5.896 1.799
85 HZ1 LYS 14 3HZ LYS 14 5.362 -6.772 2.325
86 HZ2 LYS 14 1HZ LYS 14 6.140 -6.153 0.956
87 HZ3 LYS 14 2HZ LYS 14 5.196 -7.551 0.832
88 H CYS 15 H CYS 15 1.821 -2.511 -1.413
89 HA CYS 15 HA CYS 15 3.280 -1.179 -3.510
90 HB2 CYS 15 1HB CYS 15 1.957 -0.127 -1.524
91 HB3 CYS 15 2HB CYS 15 3.435 -0.414 -0.612
92 H ASP 16 H ASP 16 5.536 -0.284 -2.842
93 HA ASP 16 HA ASP 16 7.134 -2.539 -1.816
94 HB2 ASP 16 1HB ASP 16 7.494 -0.777 -4.189
95 HB3 ASP 16 2HB ASP 16 8.942 -1.285 -3.325
96 H ILE 17 H ILE 17 6.422 0.820 -1.620
97 HA ILE 17 HA ILE 17 8.804 1.440 -0.072
98 HB ILE 17 HB ILE 17 6.450 3.263 -0.520
99 HG12 ILE 17 1HG1 ILE 17 8.172 4.121 -2.376
100 HG13 ILE 17 2HG1 ILE 17 8.608 2.416 -2.389
101 HG21 ILE 17 1HG2 ILE 17 8.116 3.897 1.187
102 HG22 ILE 17 2HG2 ILE 17 9.370 3.848 -0.051
103 HG23 ILE 17 3HG2 ILE 17 8.063 5.027 -0.166
104 HD11 ILE 17 3HD1 ILE 17 6.646 3.528 -3.884
105 HD12 ILE 17 1HD1 ILE 17 6.728 1.823 -3.439
106 HD13 ILE 17 2HD1 ILE 17 5.731 2.934 -2.499
107 H CYS 18 H CYS 18 5.283 1.345 0.415
108 HA CYS 18 HA CYS 18 5.782 1.182 3.316
109 HB2 CYS 18 1HB CYS 18 3.602 2.239 3.668
110 HB3 CYS 18 2HB CYS 18 4.644 3.270 2.693
111 H GLY 19 H GLY 19 4.825 -0.532 0.654
112 HA2 GLY 19 1HA GLY 19 4.026 -2.697 0.512
113 HA3 GLY 19 2HA GLY 19 3.827 -2.696 2.258
114 H LYS 20 H LYS 20 2.351 -0.011 0.889
115 HA LYS 20 HA LYS 20 -0.216 -0.661 1.698
116 HB2 LYS 20 1HB LYS 20 0.976 1.378 -0.090
117 HB3 LYS 20 2HB LYS 20 -0.750 1.098 -0.277
118 HG2 LYS 20 1HG LYS 20 0.514 1.664 2.387
119 HG3 LYS 20 2HG LYS 20 -0.064 2.938 1.312
120 HD2 LYS 20 1HD LYS 20 -2.263 2.394 1.626
121 HD3 LYS 20 2HD LYS 20 -1.910 0.692 1.936
122 HE2 LYS 20 1HE LYS 20 -2.470 1.367 4.046
123 HE3 LYS 20 2HE LYS 20 -0.736 1.682 4.079
124 HZ1 LYS 20 3HZ LYS 20 -1.285 4.007 3.399
125 HZ2 LYS 20 1HZ LYS 20 -1.815 3.581 4.948
126 HZ3 LYS 20 2HZ LYS 20 -2.916 3.648 3.666
127 H SER 21 H SER 21 -1.918 -1.705 0.818
128 HA SER 21 HA SER 21 -1.439 -3.127 -1.698
129 HB2 SER 21 1HB SER 21 -2.825 -4.801 -0.934
130 HB3 SER 21 2HB SER 21 -2.235 -4.177 0.606
131 HG SER 21 HG SER 21 -4.288 -3.951 1.014
132 H PHE 22 H PHE 22 -3.172 -3.325 -3.259
133 HA PHE 22 HA PHE 22 -5.326 -1.387 -3.136
134 HB2 PHE 22 1HB PHE 22 -3.290 -1.269 -5.370
135 HB3 PHE 22 2HB PHE 22 -4.732 -0.270 -5.217
136 HD1 PHE 22 HD1 PHE 22 -1.596 -1.124 -3.401
137 HD2 PHE 22 HD2 PHE 22 -4.569 1.807 -4.231
138 HE1 PHE 22 HE1 PHE 22 -0.300 0.543 -2.139
139 HE2 PHE 22 HE2 PHE 22 -3.277 3.479 -2.970
140 HZ PHE 22 HZ PHE 22 -1.139 2.848 -1.923
141 H CYS 23 H CYS 23 -7.064 -2.464 -3.765
142 HA CYS 23 HA CYS 23 -7.204 -4.959 -4.848
143 HB2 CYS 23 1HB CYS 23 -9.498 -4.389 -5.589
144 HB3 CYS 23 2HB CYS 23 -9.162 -3.837 -3.953
145 HG CYS 23 HG CYS 23 -9.531 -1.303 -4.348
146 H GLY 24 H GLY 24 -6.710 -1.937 -6.545
147 HA2 GLY 24 1HA GLY 24 -6.306 -3.490 -9.022
148 HA3 GLY 24 2HA GLY 24 -7.203 -1.978 -9.042
149 H ARG 25 H ARG 25 -4.398 -3.179 -9.954
150 HA ARG 25 HA ARG 25 -2.353 -1.677 -8.871
151 HB2 ARG 25 1HB ARG 25 -2.321 -3.520 -10.706
152 HB3 ARG 25 2HB ARG 25 -2.484 -2.175 -11.828
153 HG2 ARG 25 1HG ARG 25 -0.222 -2.358 -11.784
154 HG3 ARG 25 2HG ARG 25 -0.444 -1.232 -10.443
155 HD2 ARG 25 1HD ARG 25 -0.283 -3.024 -8.846
156 HD3 ARG 25 2HD ARG 25 -0.242 -4.224 -10.137
157 HE ARG 25 HE ARG 25 1.943 -2.582 -9.215
158 HH11 ARG 25 1HH1 ARG 25 0.685 -4.536 -11.807
159 HH12 ARG 25 2HH1 ARG 25 2.243 -4.864 -12.490
160 HH21 ARG 25 1HH2 ARG 25 4.000 -3.006 -10.106
161 HH22 ARG 25 2HH2 ARG 25 4.128 -3.994 -11.522
162 H SER 26 H SER 26 -4.511 -0.809 -11.557
163 HA SER 26 HA SER 26 -3.554 1.499 -12.501
164 HB2 SER 26 1HB SER 26 -6.361 0.736 -11.772
165 HB3 SER 26 2HB SER 26 -6.033 2.354 -12.391
166 HG SER 26 HG SER 26 -6.368 1.231 -14.198
167 H ARG 27 H ARG 27 -4.813 1.035 -9.274
168 HA ARG 27 HA ARG 27 -4.646 3.869 -8.650
169 HB2 ARG 27 1HB ARG 27 -6.354 2.037 -7.759
170 HB3 ARG 27 2HB ARG 27 -5.102 1.809 -6.545
171 HG2 ARG 27 1HG ARG 27 -6.347 4.472 -7.179
172 HG3 ARG 27 2HG ARG 27 -6.917 3.394 -5.903
173 HD2 ARG 27 1HD ARG 27 -5.498 4.618 -4.639
174 HD3 ARG 27 2HD ARG 27 -4.311 3.483 -5.280
175 HE ARG 27 HE ARG 27 -4.237 5.423 -7.113
176 HH11 ARG 27 1HH1 ARG 27 -4.169 5.546 -3.635
177 HH12 ARG 27 2HH1 ARG 27 -3.214 6.990 -3.574
178 HH21 ARG 27 1HH2 ARG 27 -2.980 7.325 -7.047
179 HH22 ARG 27 2HH2 ARG 27 -2.539 8.002 -5.516
180 H LEU 28 H LEU 28 -3.189 0.858 -7.410
181 HA LEU 28 HA LEU 28 -1.375 1.927 -5.643
182 HB2 LEU 28 1HB LEU 28 -1.526 -0.382 -5.625
183 HB3 LEU 28 2HB LEU 28 -1.339 -0.508 -7.373
184 HG LEU 28 HG LEU 28 1.034 -0.038 -7.181
185 HD11 LEU 28 1HD1 LEU 28 2.016 -0.027 -4.836
186 HD12 LEU 28 2HD1 LEU 28 0.384 0.331 -4.272
187 HD13 LEU 28 3HD1 LEU 28 1.202 1.444 -5.368
188 HD21 LEU 28 3HD2 LEU 28 -0.291 -2.313 -5.990
189 HD22 LEU 28 1HD2 LEU 28 1.292 -2.035 -5.262
190 HD23 LEU 28 2HD2 LEU 28 1.150 -2.252 -7.007
191 H ASN 29 H ASN 29 -0.684 1.095 -9.046
192 HA ASN 29 HA ASN 29 1.846 1.899 -9.378
193 HB2 ASN 29 1HB ASN 29 -0.555 2.136 -11.117
194 HB3 ASN 29 2HB ASN 29 0.889 3.009 -11.621
195 HD21 ASN 29 1HD2 ASN 29 -0.716 0.305 -12.167
196 HD22 ASN 29 2HD2 ASN 29 0.576 -0.782 -12.532
197 H ARG 30 H ARG 30 -0.910 4.154 -9.456
198 HA ARG 30 HA ARG 30 0.627 6.494 -9.733
199 HB2 ARG 30 1HB ARG 30 -2.053 6.335 -8.358
200 HB3 ARG 30 2HB ARG 30 -1.368 7.697 -9.234
201 HG2 ARG 30 1HG ARG 30 -2.453 5.129 -10.341
202 HG3 ARG 30 2HG ARG 30 -3.002 6.778 -10.647
203 HD2 ARG 30 1HD ARG 30 -0.978 7.273 -11.861
204 HD3 ARG 30 2HD ARG 30 -0.307 5.694 -11.453
205 HE ARG 30 HE ARG 30 -2.803 5.609 -12.900
206 HH11 ARG 30 1HH1 ARG 30 0.671 5.676 -13.116
207 HH12 ARG 30 2HH1 ARG 30 0.717 4.967 -14.697
208 HH21 ARG 30 1HH2 ARG 30 -2.756 4.675 -14.981
209 HH22 ARG 30 2HH2 ARG 30 -1.233 4.399 -15.757
210 H HIS 31 H HIS 31 -0.569 4.778 -6.885
211 HA HIS 31 HA HIS 31 0.098 6.649 -4.931
212 HB2 HIS 31 1HB HIS 31 -1.240 4.792 -4.291
213 HB3 HIS 31 2HB HIS 31 -0.036 3.637 -4.855
214 HD1 HIS 31 HD1 HIS 31 -0.419 6.274 -2.147
215 HD2 HIS 31 HD2 HIS 31 1.626 2.738 -2.908
216 HE1 HIS 31 HE1 HIS 31 0.782 5.718 -0.008
217 H SER 32 H SER 32 2.064 4.143 -6.459
218 HA SER 32 HA SER 32 4.329 4.356 -4.828
219 HB2 SER 32 1HB SER 32 3.939 2.540 -6.485
220 HB3 SER 32 2HB SER 32 4.265 3.690 -7.781
221 HG SER 32 HG SER 32 6.030 2.238 -6.671
222 H MET 33 H MET 33 3.001 6.595 -6.977
223 HA MET 33 HA MET 33 5.518 7.912 -7.592
224 HB2 MET 33 1HB MET 33 2.760 8.968 -8.185
225 HB3 MET 33 2HB MET 33 4.269 9.352 -9.001
226 HG2 MET 33 1HG MET 33 3.220 6.559 -9.035
227 HG3 MET 33 2HG MET 33 2.554 7.773 -10.126
228 HE1 MET 33 3HE MET 33 4.640 5.138 -9.550
229 HE2 MET 33 1HE MET 33 5.699 5.038 -10.958
230 HE3 MET 33 2HE MET 33 6.275 5.797 -9.474
231 H VAL 34 H VAL 34 2.844 8.204 -5.384
232 HA VAL 34 HA VAL 34 3.281 10.882 -4.575
233 HB VAL 34 HB VAL 34 1.826 10.446 -2.740
234 HG11 VAL 34 1HG1 VAL 34 0.538 10.554 -4.674
235 HG12 VAL 34 2HG1 VAL 34 1.112 8.991 -5.260
236 HG13 VAL 34 3HG1 VAL 34 -0.013 9.066 -3.903
237 HG21 VAL 34 3HG2 VAL 34 1.875 8.562 -1.561
238 HG22 VAL 34 1HG2 VAL 34 1.386 7.621 -2.970
239 HG23 VAL 34 2HG2 VAL 34 3.095 7.942 -2.675
240 H HIS 35 H HIS 35 4.956 7.970 -3.935
241 HA HIS 35 HA HIS 35 6.050 8.687 -1.396
242 HB2 HIS 35 1HB HIS 35 6.708 6.593 -3.450
243 HB3 HIS 35 2HB HIS 35 7.756 6.851 -2.058
244 HD1 HIS 35 HD1 HIS 35 6.609 6.458 0.329
245 HD2 HIS 35 HD2 HIS 35 4.493 5.063 -2.963
246 HE1 HIS 35 HE1 HIS 35 4.907 4.855 1.254
247 H THR 36 H THR 36 6.851 9.375 -4.692
248 HA THR 36 HA THR 36 9.410 10.563 -3.852
249 HB THR 36 HB THR 36 9.495 8.849 -5.681
250 HG1 THR 36 HG1 THR 36 10.434 10.848 -7.139
251 HG21 THR 36 3HG2 THR 36 7.331 9.558 -6.735
252 HG22 THR 36 1HG2 THR 36 8.669 9.366 -7.866
253 HG23 THR 36 2HG2 THR 36 8.170 10.979 -7.357
254 H ALA 37 H ALA 37 6.730 11.759 -3.524
255 HA ALA 37 HA ALA 37 6.919 14.048 -5.358
256 HB1 ALA 37 3HB ALA 37 4.634 14.561 -4.748
257 HB2 ALA 37 1HB ALA 37 4.754 12.879 -5.266
258 HB3 ALA 37 2HB ALA 37 4.636 13.268 -3.549
259 H GLU 38 H GLU 38 8.802 13.826 -3.265
260 HA GLU 38 HA GLU 38 8.213 16.297 -1.843
261 HB2 GLU 38 1HB GLU 38 8.822 15.395 0.334
262 HB3 GLU 38 2HB GLU 38 7.443 14.524 -0.320
263 HG2 GLU 38 1HG GLU 38 9.234 12.856 -1.180
264 HG3 GLU 38 2HG GLU 38 10.259 13.609 0.039
265 H LYS 39 H LYS 39 9.993 17.529 -1.463
266 HA LYS 39 HA LYS 39 12.247 17.351 -2.955
267 HB2 LYS 39 1HB LYS 39 11.822 18.560 -0.233
268 HB3 LYS 39 2HB LYS 39 13.370 18.690 -1.057
269 HG2 LYS 39 1HG LYS 39 10.917 19.489 -2.531
270 HG3 LYS 39 2HG LYS 39 11.534 20.559 -1.270
271 HD2 LYS 39 1HD LYS 39 13.583 20.862 -2.379
272 HD3 LYS 39 2HD LYS 39 13.313 19.474 -3.434
273 HE2 LYS 39 1HE LYS 39 12.830 21.192 -4.872
274 HE3 LYS 39 2HE LYS 39 11.229 20.872 -4.206
275 HZ1 LYS 39 3HZ LYS 39 12.403 22.686 -2.496
276 HZ2 LYS 39 1HZ LYS 39 11.172 22.993 -3.616
277 HZ3 LYS 39 2HZ LYS 39 12.789 23.235 -4.049
278 HA PRO 40 HA PRO 40 14.747 14.059 -1.462
279 HB2 PRO 40 1HB PRO 40 17.209 14.983 -2.134
280 HB3 PRO 40 2HB PRO 40 16.050 14.384 -3.326
281 HG2 PRO 40 1HG PRO 40 16.684 17.206 -2.552
282 HG3 PRO 40 2HG PRO 40 16.429 16.519 -4.167
283 HD2 PRO 40 1HD PRO 40 14.510 17.906 -2.855
284 HD3 PRO 40 2HD PRO 40 14.134 16.574 -3.966
285 H SER 41 H SER 41 14.553 16.983 0.040
286 HA SER 41 HA SER 41 16.795 17.133 1.690
287 HB2 SER 41 1HB SER 41 15.332 18.430 3.232
288 HB3 SER 41 2HB SER 41 15.199 18.961 1.556
289 HG SER 41 HG SER 41 13.243 17.958 1.392
290 H GLY 42 H GLY 42 16.530 16.891 4.199
291 HA2 GLY 42 1HA GLY 42 15.006 14.597 5.053
292 HA3 GLY 42 2HA GLY 42 16.730 14.282 4.922
293 HA PRO 43 HA PRO 43 15.424 16.667 8.909
294 HB2 PRO 43 1HB PRO 43 14.727 14.632 10.565
295 HB3 PRO 43 2HB PRO 43 13.556 15.502 9.567
296 HG2 PRO 43 1HG PRO 43 14.870 12.858 9.075
297 HG3 PRO 43 2HG PRO 43 13.178 13.328 8.834
298 HD2 PRO 43 1HD PRO 43 14.955 13.186 6.796
299 HD3 PRO 43 2HD PRO 43 13.619 14.355 6.818
300 H SER 44 H SER 44 17.341 17.178 9.751
301 HA SER 44 HA SER 44 19.315 15.071 10.237
302 HB2 SER 44 1HB SER 44 20.950 16.868 10.402
303 HB3 SER 44 2HB SER 44 20.001 17.070 8.929
304 HG SER 44 HG SER 44 20.354 18.823 10.850
305 H SER 45 H SER 45 20.515 15.034 12.235
306 HA SER 45 HA SER 45 19.089 16.223 14.517
307 HB2 SER 45 1HB SER 45 19.340 14.154 15.780
308 HB3 SER 45 2HB SER 45 18.469 13.831 14.281
309 HG SER 45 HG SER 45 21.267 13.526 14.418
310 H GLY 46 H GLY 46 20.397 17.445 15.694
311 HA2 GLY 46 1HA GLY 46 22.274 17.982 16.964
312 HA3 GLY 46 2HA GLY 46 23.085 16.563 16.319
Start of MODEL 20
1 H1 GLY 1 H GLY 1 -0.802 10.234 9.255
2 HA2 GLY 1 1HA GLY 1 -0.422 7.709 8.574
3 HA3 GLY 1 2HA GLY 1 -0.278 8.184 10.260
4 H SER 2 H SER 2 -1.776 7.502 11.726
5 HA SER 2 HA SER 2 -3.203 5.907 12.565
6 HB2 SER 2 1HB SER 2 -5.522 6.326 11.959
7 HB3 SER 2 2HB SER 2 -4.658 7.860 12.059
8 HG SER 2 HG SER 2 -5.580 6.477 9.791
9 H SER 3 H SER 3 -1.525 4.749 10.678
10 HA SER 3 HA SER 3 -3.108 3.186 8.834
11 HB2 SER 3 1HB SER 3 -0.171 3.120 9.554
12 HB3 SER 3 2HB SER 3 -0.907 2.071 8.342
13 HG SER 3 HG SER 3 -0.380 4.803 8.257
14 H GLY 4 H GLY 4 -3.959 2.833 11.474
15 HA2 GLY 4 1HA GLY 4 -3.017 0.860 13.049
16 HA3 GLY 4 2HA GLY 4 -4.730 1.018 12.689
17 H SER 5 H SER 5 -3.275 -1.409 13.232
18 HA SER 5 HA SER 5 -2.955 -2.773 10.706
19 HB2 SER 5 1HB SER 5 -2.858 -3.773 13.561
20 HB3 SER 5 2HB SER 5 -2.523 -4.771 12.146
21 HG SER 5 HG SER 5 -0.728 -3.570 11.720
22 H SER 6 H SER 6 -5.466 -1.781 10.739
23 HA SER 6 HA SER 6 -7.205 -4.049 11.432
24 HB2 SER 6 1HB SER 6 -7.871 -1.146 10.895
25 HB3 SER 6 2HB SER 6 -9.074 -2.404 11.179
26 HG SER 6 HG SER 6 -8.331 -1.087 13.049
27 H GLY 7 H GLY 7 -8.253 -5.171 9.890
28 HA2 GLY 7 1HA GLY 7 -9.385 -4.746 7.604
29 HA3 GLY 7 2HA GLY 7 -7.740 -4.385 7.102
30 H THR 8 H THR 8 -9.994 -6.683 6.933
31 HA THR 8 HA THR 8 -8.206 -8.958 7.358
32 HB THR 8 HB THR 8 -10.173 -10.367 6.988
33 HG1 THR 8 HG1 THR 8 -11.250 -7.936 6.140
34 HG21 THR 8 3HG2 THR 8 -10.277 -8.156 8.990
35 HG22 THR 8 1HG2 THR 8 -10.042 -9.885 9.237
36 HG23 THR 8 2HG2 THR 8 -11.647 -9.258 8.862
37 H GLY 9 H GLY 9 -8.168 -10.678 5.682
38 HA2 GLY 9 1HA GLY 9 -7.682 -11.373 3.550
39 HA3 GLY 9 2HA GLY 9 -8.932 -10.256 3.019
40 H GLU 10 H GLU 10 -6.553 -10.822 1.590
41 HA GLU 10 HA GLU 10 -5.171 -8.224 1.775
42 HB2 GLU 10 1HB GLU 10 -3.898 -10.473 2.231
43 HB3 GLU 10 2HB GLU 10 -3.907 -10.608 0.478
44 HG2 GLU 10 1HG GLU 10 -2.978 -8.060 1.683
45 HG3 GLU 10 2HG GLU 10 -1.921 -9.467 1.775
46 H LYS 11 H LYS 11 -4.470 -7.278 -0.227
47 HA LYS 11 HA LYS 11 -6.378 -7.753 -2.368
48 HB2 LYS 11 1HB LYS 11 -4.541 -5.544 -1.597
49 HB3 LYS 11 2HB LYS 11 -4.939 -5.701 -3.303
50 HG2 LYS 11 1HG LYS 11 -6.489 -4.178 -2.406
51 HG3 LYS 11 2HG LYS 11 -7.366 -5.696 -2.611
52 HD2 LYS 11 1HD LYS 11 -6.046 -5.182 0.004
53 HD3 LYS 11 2HD LYS 11 -7.518 -4.285 -0.374
54 HE2 LYS 11 1HE LYS 11 -8.785 -6.262 -0.588
55 HE3 LYS 11 2HE LYS 11 -7.343 -7.273 -0.654
56 HZ1 LYS 11 3HZ LYS 11 -7.720 -5.674 1.753
57 HZ2 LYS 11 1HZ LYS 11 -7.102 -7.239 1.579
58 HZ3 LYS 11 2HZ LYS 11 -8.773 -6.981 1.539
59 HA PRO 12 HA PRO 12 -3.691 -9.867 -5.119
60 HB2 PRO 12 1HB PRO 12 -4.399 -8.816 -7.520
61 HB3 PRO 12 2HB PRO 12 -5.434 -9.925 -6.614
62 HG2 PRO 12 1HG PRO 12 -5.555 -6.939 -6.790
63 HG3 PRO 12 2HG PRO 12 -6.879 -8.117 -6.842
64 HD2 PRO 12 1HD PRO 12 -6.263 -6.717 -4.608
65 HD3 PRO 12 2HD PRO 12 -6.915 -8.367 -4.551
66 H PHE 13 H PHE 13 -3.193 -6.732 -4.321
67 HA PHE 13 HA PHE 13 -0.676 -6.645 -5.812
68 HB2 PHE 13 1HB PHE 13 -2.608 -4.324 -5.619
69 HB3 PHE 13 2HB PHE 13 -0.988 -4.247 -6.306
70 HD1 PHE 13 HD1 PHE 13 -0.491 -5.309 -8.441
71 HD2 PHE 13 HD2 PHE 13 -4.425 -5.326 -6.818
72 HE1 PHE 13 HE1 PHE 13 -1.391 -5.950 -10.640
73 HE2 PHE 13 HE2 PHE 13 -5.332 -5.968 -9.013
74 HZ PHE 13 HZ PHE 13 -3.815 -6.282 -10.927
75 H LYS 14 H LYS 14 0.826 -4.974 -4.913
76 HA LYS 14 HA LYS 14 0.328 -4.057 -2.225
77 HB2 LYS 14 1HB LYS 14 0.962 -6.390 -1.812
78 HB3 LYS 14 2HB LYS 14 2.443 -6.159 -2.733
79 HG2 LYS 14 1HG LYS 14 2.926 -4.284 -1.013
80 HG3 LYS 14 2HG LYS 14 1.713 -5.112 -0.033
81 HD2 LYS 14 1HD LYS 14 3.008 -7.200 -0.245
82 HD3 LYS 14 2HD LYS 14 4.236 -6.326 -1.162
83 HE2 LYS 14 1HE LYS 14 5.095 -6.352 1.000
84 HE3 LYS 14 2HE LYS 14 4.340 -4.763 0.881
85 HZ1 LYS 14 3HZ LYS 14 3.437 -7.135 2.372
86 HZ2 LYS 14 1HZ LYS 14 2.308 -5.977 1.872
87 HZ3 LYS 14 2HZ LYS 14 3.579 -5.533 2.896
88 H CYS 15 H CYS 15 1.888 -2.563 -1.485
89 HA CYS 15 HA CYS 15 3.273 -1.202 -3.613
90 HB2 CYS 15 1HB CYS 15 2.011 -0.205 -1.537
91 HB3 CYS 15 2HB CYS 15 3.556 -0.447 -0.728
92 H ASP 16 H ASP 16 5.542 -0.268 -2.917
93 HA ASP 16 HA ASP 16 7.184 -2.547 -2.022
94 HB2 ASP 16 1HB ASP 16 7.468 -0.705 -4.342
95 HB3 ASP 16 2HB ASP 16 8.945 -1.206 -3.522
96 H ILE 17 H ILE 17 6.463 0.808 -1.715
97 HA ILE 17 HA ILE 17 8.858 1.371 -0.160
98 HB ILE 17 HB ILE 17 6.518 3.219 -0.602
99 HG12 ILE 17 1HG1 ILE 17 8.314 4.123 -2.372
100 HG13 ILE 17 2HG1 ILE 17 8.727 2.413 -2.424
101 HG21 ILE 17 1HG2 ILE 17 8.140 3.791 1.178
102 HG22 ILE 17 2HG2 ILE 17 9.421 3.800 -0.033
103 HG23 ILE 17 3HG2 ILE 17 8.106 4.970 -0.132
104 HD11 ILE 17 3HD1 ILE 17 7.075 2.113 -3.855
105 HD12 ILE 17 1HD1 ILE 17 5.933 2.546 -2.583
106 HD13 ILE 17 2HD1 ILE 17 6.558 3.789 -3.667
107 H CYS 18 H CYS 18 5.333 1.340 0.325
108 HA CYS 18 HA CYS 18 5.826 1.111 3.222
109 HB2 CYS 18 1HB CYS 18 3.638 2.155 3.578
110 HB3 CYS 18 2HB CYS 18 4.686 3.204 2.629
111 H GLY 19 H GLY 19 4.924 -0.595 0.552
112 HA2 GLY 19 1HA GLY 19 4.103 -2.743 0.363
113 HA3 GLY 19 2HA GLY 19 3.928 -2.780 2.111
114 H LYS 20 H LYS 20 2.421 -0.078 0.800
115 HA LYS 20 HA LYS 20 -0.131 -0.744 1.639
116 HB2 LYS 20 1HB LYS 20 1.025 1.311 -0.155
117 HB3 LYS 20 2HB LYS 20 -0.703 1.027 -0.314
118 HG2 LYS 20 1HG LYS 20 0.604 1.578 2.333
119 HG3 LYS 20 2HG LYS 20 0.008 2.859 1.275
120 HD2 LYS 20 1HD LYS 20 -2.186 2.309 1.620
121 HD3 LYS 20 2HD LYS 20 -1.825 0.606 1.914
122 HE2 LYS 20 1HE LYS 20 -2.334 1.248 4.040
123 HE3 LYS 20 2HE LYS 20 -0.609 1.612 4.040
124 HZ1 LYS 20 3HZ LYS 20 -1.704 3.482 4.935
125 HZ2 LYS 20 1HZ LYS 20 -2.859 3.510 3.699
126 HZ3 LYS 20 2HZ LYS 20 -1.253 3.923 3.366
127 H SER 21 H SER 21 -1.845 -1.784 0.776
128 HA SER 21 HA SER 21 -1.395 -3.201 -1.747
129 HB2 SER 21 1HB SER 21 -2.779 -4.869 -0.970
130 HB3 SER 21 2HB SER 21 -2.187 -4.241 0.568
131 HG SER 21 HG SER 21 -4.293 -4.156 0.902
132 H PHE 22 H PHE 22 -3.130 -3.382 -3.301
133 HA PHE 22 HA PHE 22 -5.274 -1.432 -3.163
134 HB2 PHE 22 1HB PHE 22 -3.261 -1.333 -5.418
135 HB3 PHE 22 2HB PHE 22 -4.688 -0.317 -5.243
136 HD1 PHE 22 HD1 PHE 22 -1.576 -1.232 -3.407
137 HD2 PHE 22 HD2 PHE 22 -4.448 1.774 -4.319
138 HE1 PHE 22 HE1 PHE 22 -0.243 0.416 -2.158
139 HE2 PHE 22 HE2 PHE 22 -3.118 3.427 -3.073
140 HZ PHE 22 HZ PHE 22 -1.012 2.749 -1.991
141 H CYS 23 H CYS 23 -7.021 -2.511 -3.763
142 HA CYS 23 HA CYS 23 -7.192 -5.001 -4.842
143 HB2 CYS 23 1HB CYS 23 -9.484 -4.453 -5.523
144 HB3 CYS 23 2HB CYS 23 -9.121 -3.793 -3.933
145 HG CYS 23 HG CYS 23 -8.566 -1.193 -5.073
146 H GLY 24 H GLY 24 -6.535 -2.029 -6.526
147 HA2 GLY 24 1HA GLY 24 -6.164 -3.584 -8.996
148 HA3 GLY 24 2HA GLY 24 -7.106 -2.101 -9.045
149 H ARG 25 H ARG 25 -4.202 -3.292 -9.800
150 HA ARG 25 HA ARG 25 -2.246 -1.672 -8.762
151 HB2 ARG 25 1HB ARG 25 -2.083 -3.574 -10.505
152 HB3 ARG 25 2HB ARG 25 -2.322 -2.306 -11.700
153 HG2 ARG 25 1HG ARG 25 -0.048 -2.378 -11.641
154 HG3 ARG 25 2HG ARG 25 -0.345 -1.163 -10.396
155 HD2 ARG 25 1HD ARG 25 1.074 -2.501 -9.232
156 HD3 ARG 25 2HD ARG 25 -0.436 -3.334 -8.862
157 HE ARG 25 HE ARG 25 0.234 -5.100 -10.186
158 HH11 ARG 25 1HH1 ARG 25 2.408 -2.410 -10.584
159 HH12 ARG 25 2HH1 ARG 25 3.597 -3.330 -11.446
160 HH21 ARG 25 1HH2 ARG 25 1.791 -6.322 -11.319
161 HH22 ARG 25 2HH2 ARG 25 3.244 -5.555 -11.864
162 H SER 26 H SER 26 -4.406 -0.957 -11.486
163 HA SER 26 HA SER 26 -3.517 1.324 -12.534
164 HB2 SER 26 1HB SER 26 -5.737 0.306 -13.030
165 HB3 SER 26 2HB SER 26 -6.365 1.029 -11.549
166 HG SER 26 HG SER 26 -6.558 2.850 -12.565
167 H ARG 27 H ARG 27 -4.739 0.991 -9.270
168 HA ARG 27 HA ARG 27 -4.523 3.854 -8.779
169 HB2 ARG 27 1HB ARG 27 -6.299 2.101 -7.839
170 HB3 ARG 27 2HB ARG 27 -5.083 1.929 -6.580
171 HG2 ARG 27 1HG ARG 27 -5.912 4.675 -7.336
172 HG3 ARG 27 2HG ARG 27 -7.045 3.689 -6.409
173 HD2 ARG 27 1HD ARG 27 -4.222 3.783 -5.495
174 HD3 ARG 27 2HD ARG 27 -5.211 5.221 -5.246
175 HE ARG 27 HE ARG 27 -6.392 2.735 -4.353
176 HH11 ARG 27 1HH1 ARG 27 -4.490 5.529 -3.516
177 HH12 ARG 27 2HH1 ARG 27 -4.810 5.401 -1.818
178 HH21 ARG 27 1HH2 ARG 27 -6.821 2.556 -2.119
179 HH22 ARG 27 2HH2 ARG 27 -6.136 3.709 -1.025
180 H LEU 28 H LEU 28 -3.137 0.838 -7.490
181 HA LEU 28 HA LEU 28 -1.354 1.887 -5.674
182 HB2 LEU 28 1HB LEU 28 -1.503 -0.412 -5.638
183 HB3 LEU 28 2HB LEU 28 -1.342 -0.553 -7.388
184 HG LEU 28 HG LEU 28 1.040 -0.115 -7.231
185 HD11 LEU 28 1HD1 LEU 28 1.217 1.381 -5.414
186 HD12 LEU 28 2HD1 LEU 28 2.073 -0.081 -4.926
187 HD13 LEU 28 3HD1 LEU 28 0.455 0.242 -4.304
188 HD21 LEU 28 3HD2 LEU 28 1.217 -2.109 -5.255
189 HD22 LEU 28 1HD2 LEU 28 1.208 -2.315 -7.006
190 HD23 LEU 28 2HD2 LEU 28 -0.306 -2.376 -6.104
191 H ASN 29 H ASN 29 -0.729 1.196 -9.113
192 HA ASN 29 HA ASN 29 1.868 1.944 -9.365
193 HB2 ASN 29 1HB ASN 29 -0.491 2.145 -11.167
194 HB3 ASN 29 2HB ASN 29 0.965 3.014 -11.646
195 HD21 ASN 29 1HD2 ASN 29 -0.622 0.298 -12.192
196 HD22 ASN 29 2HD2 ASN 29 0.681 -0.791 -12.509
197 H ARG 30 H ARG 30 -0.915 4.160 -9.469
198 HA ARG 30 HA ARG 30 0.603 6.518 -9.763
199 HB2 ARG 30 1HB ARG 30 -2.093 6.356 -8.424
200 HB3 ARG 30 2HB ARG 30 -1.411 7.702 -9.328
201 HG2 ARG 30 1HG ARG 30 -2.446 5.091 -10.386
202 HG3 ARG 30 2HG ARG 30 -3.031 6.721 -10.724
203 HD2 ARG 30 1HD ARG 30 -1.083 7.241 -11.991
204 HD3 ARG 30 2HD ARG 30 -0.277 5.763 -11.469
205 HE ARG 30 HE ARG 30 -2.413 4.781 -12.728
206 HH11 ARG 30 1HH1 ARG 30 -0.157 7.266 -13.650
207 HH12 ARG 30 2HH1 ARG 30 -0.312 6.959 -15.348
208 HH21 ARG 30 1HH2 ARG 30 -2.626 4.367 -14.961
209 HH22 ARG 30 2HH2 ARG 30 -1.718 5.311 -16.093
210 H HIS 31 H HIS 31 -0.573 4.777 -6.931
211 HA HIS 31 HA HIS 31 0.004 6.675 -4.970
212 HB2 HIS 31 1HB HIS 31 -1.271 4.809 -4.294
213 HB3 HIS 31 2HB HIS 31 -0.087 3.666 -4.921
214 HD1 HIS 31 HD1 HIS 31 -0.341 6.266 -2.158
215 HD2 HIS 31 HD2 HIS 31 1.592 2.693 -3.030
216 HE1 HIS 31 HE1 HIS 31 0.912 5.652 -0.067
217 H SER 32 H SER 32 2.068 4.226 -6.463
218 HA SER 32 HA SER 32 4.302 4.482 -4.814
219 HB2 SER 32 1HB SER 32 3.999 2.706 -6.532
220 HB3 SER 32 2HB SER 32 4.302 3.907 -7.787
221 HG SER 32 HG SER 32 6.265 4.060 -6.006
222 H MET 33 H MET 33 2.934 6.743 -6.914
223 HA MET 33 HA MET 33 5.405 8.154 -7.478
224 HB2 MET 33 1HB MET 33 2.607 9.150 -7.994
225 HB3 MET 33 2HB MET 33 4.095 9.636 -8.796
226 HG2 MET 33 1HG MET 33 3.136 6.813 -8.973
227 HG3 MET 33 2HG MET 33 2.447 8.062 -10.008
228 HE1 MET 33 3HE MET 33 6.183 6.209 -9.318
229 HE2 MET 33 1HE MET 33 4.618 5.440 -9.579
230 HE3 MET 33 2HE MET 33 5.796 5.506 -10.890
231 H VAL 34 H VAL 34 2.759 8.283 -5.222
232 HA VAL 34 HA VAL 34 3.145 10.936 -4.306
233 HB VAL 34 HB VAL 34 1.735 10.379 -2.460
234 HG11 VAL 34 1HG1 VAL 34 0.429 10.591 -4.382
235 HG12 VAL 34 2HG1 VAL 34 0.988 9.054 -5.045
236 HG13 VAL 34 3HG1 VAL 34 -0.116 9.073 -3.669
237 HG21 VAL 34 3HG2 VAL 34 1.890 8.438 -1.392
238 HG22 VAL 34 1HG2 VAL 34 1.274 7.590 -2.810
239 HG23 VAL 34 2HG2 VAL 34 3.007 7.857 -2.626
240 H HIS 35 H HIS 35 4.860 8.013 -3.777
241 HA HIS 35 HA HIS 35 5.975 8.649 -1.233
242 HB2 HIS 35 1HB HIS 35 6.650 6.663 -3.385
243 HB3 HIS 35 2HB HIS 35 7.720 6.886 -2.004
244 HD1 HIS 35 HD1 HIS 35 6.649 6.343 0.381
245 HD2 HIS 35 HD2 HIS 35 4.460 5.084 -2.918
246 HE1 HIS 35 HE1 HIS 35 4.997 4.668 1.270
247 H THR 36 H THR 36 6.705 9.542 -4.488
248 HA THR 36 HA THR 36 9.290 10.670 -3.658
249 HB THR 36 HB THR 36 9.351 9.189 -5.634
250 HG1 THR 36 HG1 THR 36 10.938 10.500 -6.103
251 HG21 THR 36 3HG2 THR 36 8.383 10.540 -7.747
252 HG22 THR 36 1HG2 THR 36 7.206 11.019 -6.525
253 HG23 THR 36 2HG2 THR 36 7.461 9.311 -6.883
254 H ALA 37 H ALA 37 6.094 11.475 -4.701
255 HA ALA 37 HA ALA 37 6.727 14.201 -5.405
256 HB1 ALA 37 3HB ALA 37 4.291 14.461 -5.647
257 HB2 ALA 37 1HB ALA 37 4.914 13.082 -6.554
258 HB3 ALA 37 2HB ALA 37 4.070 12.825 -5.026
259 H GLU 38 H GLU 38 7.756 14.844 -3.419
260 HA GLU 38 HA GLU 38 6.514 14.784 -0.903
261 HB2 GLU 38 1HB GLU 38 8.103 16.699 -0.381
262 HB3 GLU 38 2HB GLU 38 8.838 15.204 -0.942
263 HG2 GLU 38 1HG GLU 38 8.182 17.277 -2.960
264 HG3 GLU 38 2HG GLU 38 9.556 17.555 -1.891
265 H LYS 39 H LYS 39 4.610 15.655 -0.438
266 HA LYS 39 HA LYS 39 3.557 17.906 -1.880
267 HB2 LYS 39 1HB LYS 39 2.465 16.587 0.611
268 HB3 LYS 39 2HB LYS 39 1.587 17.636 -0.494
269 HG2 LYS 39 1HG LYS 39 2.822 15.187 -1.619
270 HG3 LYS 39 2HG LYS 39 1.398 14.998 -0.593
271 HD2 LYS 39 1HD LYS 39 0.370 15.262 -2.614
272 HD3 LYS 39 2HD LYS 39 0.486 16.955 -2.128
273 HE2 LYS 39 1HE LYS 39 2.771 15.787 -3.619
274 HE3 LYS 39 2HE LYS 39 1.285 16.097 -4.516
275 HZ1 LYS 39 3HZ LYS 39 3.244 17.920 -3.914
276 HZ2 LYS 39 1HZ LYS 39 1.979 18.303 -2.858
277 HZ3 LYS 39 2HZ LYS 39 1.704 18.261 -4.526
278 HA PRO 40 HA PRO 40 4.904 21.199 0.694
279 HB2 PRO 40 1HB PRO 40 2.811 22.913 0.469
280 HB3 PRO 40 2HB PRO 40 3.959 22.621 -0.843
281 HG2 PRO 40 1HG PRO 40 1.228 21.469 -0.424
282 HG3 PRO 40 2HG PRO 40 1.969 22.076 -1.917
283 HD2 PRO 40 1HD PRO 40 1.812 19.436 -1.337
284 HD3 PRO 40 2HD PRO 40 3.155 20.131 -2.267
285 H SER 41 H SER 41 4.980 20.463 2.789
286 HA SER 41 HA SER 41 2.898 21.348 4.549
287 HB2 SER 41 1HB SER 41 3.345 18.397 4.112
288 HB3 SER 41 2HB SER 41 2.642 19.028 5.601
289 HG SER 41 HG SER 41 1.119 20.134 4.083
290 H GLY 42 H GLY 42 3.470 20.995 6.846
291 HA2 GLY 42 1HA GLY 42 6.394 20.704 7.174
292 HA3 GLY 42 2HA GLY 42 5.464 21.937 8.013
293 HA PRO 43 HA PRO 43 5.913 18.117 10.690
294 HB2 PRO 43 1HB PRO 43 7.092 19.379 12.784
295 HB3 PRO 43 2HB PRO 43 8.008 18.689 11.439
296 HG2 PRO 43 1HG PRO 43 7.202 21.532 11.922
297 HG3 PRO 43 2HG PRO 43 8.753 20.890 11.350
298 HD2 PRO 43 1HD PRO 43 6.914 21.960 9.676
299 HD3 PRO 43 2HD PRO 43 7.997 20.641 9.188
300 H SER 44 H SER 44 5.328 18.161 13.207
301 HA SER 44 HA SER 44 2.688 19.363 13.326
302 HB2 SER 44 1HB SER 44 4.046 17.562 15.344
303 HB3 SER 44 2HB SER 44 2.329 17.955 15.268
304 HG SER 44 HG SER 44 2.721 17.033 12.954
305 H SER 45 H SER 45 5.431 19.155 15.601
306 HA SER 45 HA SER 45 4.517 21.223 17.279
307 HB2 SER 45 1HB SER 45 6.322 19.394 17.701
308 HB3 SER 45 2HB SER 45 7.434 20.561 16.987
309 HG SER 45 HG SER 45 5.791 20.934 19.270
310 H GLY 46 H GLY 46 4.245 23.272 16.694
311 HA2 GLY 46 1HA GLY 46 5.824 25.260 16.268
312 HA3 GLY 46 2HA GLY 46 6.109 24.443 14.738