Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
505025 | 2eog RC | 10217 | 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 -12.787 20.586 17.351
2 HA2 GLY 1 1HA GLY 1 -12.317 20.102 14.483
3 HA3 GLY 1 2HA GLY 1 -11.715 21.572 15.235
4 H SER 2 H SER 2 -10.648 18.809 14.090
5 HA SER 2 HA SER 2 -8.397 18.732 15.943
6 HB2 SER 2 1HB SER 2 -8.452 16.275 16.090
7 HB3 SER 2 2HB SER 2 -9.915 16.987 16.770
8 HG SER 2 HG SER 2 -9.655 15.892 14.162
9 H SER 3 H SER 3 -6.603 17.340 15.056
10 HA SER 3 HA SER 3 -5.610 18.203 12.719
11 HB2 SER 3 1HB SER 3 -5.333 15.422 13.876
12 HB3 SER 3 2HB SER 3 -4.339 16.032 12.553
13 HG SER 3 HG SER 3 -3.735 16.268 14.995
14 H GLY 4 H GLY 4 -6.173 18.152 10.648
15 HA2 GLY 4 1HA GLY 4 -7.791 15.876 9.692
16 HA3 GLY 4 2HA GLY 4 -8.232 17.530 9.296
17 H SER 5 H SER 5 -5.951 14.947 8.727
18 HA SER 5 HA SER 5 -4.666 16.498 6.597
19 HB2 SER 5 1HB SER 5 -2.987 14.696 6.563
20 HB3 SER 5 2HB SER 5 -3.172 15.365 8.184
21 HG SER 5 HG SER 5 -4.346 13.576 8.776
22 H SER 6 H SER 6 -4.548 15.743 4.470
23 HA SER 6 HA SER 6 -6.797 14.066 3.693
24 HB2 SER 6 1HB SER 6 -4.958 15.930 2.215
25 HB3 SER 6 2HB SER 6 -5.966 14.779 1.337
26 HG SER 6 HG SER 6 -6.874 16.751 3.168
27 H GLY 7 H GLY 7 -3.280 14.207 3.176
28 HA2 GLY 7 1HA GLY 7 -1.761 12.560 2.677
29 HA3 GLY 7 2HA GLY 7 -2.917 11.426 3.359
30 H VAL 8 H VAL 8 -1.560 12.738 0.485
31 HA VAL 8 HA VAL 8 -3.116 10.805 -1.094
32 HB VAL 8 HB VAL 8 -3.164 12.372 -2.986
33 HG11 VAL 8 1HG1 VAL 8 -5.197 12.550 -2.018
34 HG12 VAL 8 2HG1 VAL 8 -4.527 12.894 -0.421
35 HG13 VAL 8 3HG1 VAL 8 -4.628 14.174 -1.631
36 HG21 VAL 8 3HG2 VAL 8 -1.175 13.686 -2.333
37 HG22 VAL 8 1HG2 VAL 8 -2.568 14.699 -2.712
38 HG23 VAL 8 2HG2 VAL 8 -2.114 14.417 -1.032
39 H LYS 9 H LYS 9 -2.063 10.193 -3.134
40 HA LYS 9 HA LYS 9 0.798 10.699 -3.304
41 HB2 LYS 9 1HB LYS 9 -0.420 8.078 -2.572
42 HB3 LYS 9 2HB LYS 9 0.974 8.069 -3.644
43 HG2 LYS 9 1HG LYS 9 2.382 8.963 -2.027
44 HG3 LYS 9 2HG LYS 9 1.039 9.581 -1.063
45 HD2 LYS 9 1HD LYS 9 0.388 7.263 -0.531
46 HD3 LYS 9 2HD LYS 9 1.780 6.680 -1.448
47 HE2 LYS 9 1HE LYS 9 2.586 6.667 0.717
48 HE3 LYS 9 2HE LYS 9 3.138 8.235 0.128
49 HZ1 LYS 9 3HZ LYS 9 0.717 8.828 1.134
50 HZ2 LYS 9 1HZ LYS 9 2.173 8.999 1.978
51 HZ3 LYS 9 2HZ LYS 9 1.226 7.615 2.198
52 HA PRO 10 HA PRO 10 0.037 10.516 -7.625
53 HB2 PRO 10 1HB PRO 10 2.466 9.721 -8.539
54 HB3 PRO 10 2HB PRO 10 2.161 11.343 -7.908
55 HG2 PRO 10 1HG PRO 10 3.403 8.984 -6.546
56 HG3 PRO 10 2HG PRO 10 3.901 10.686 -6.512
57 HD2 PRO 10 1HD PRO 10 2.500 9.536 -4.500
58 HD3 PRO 10 2HD PRO 10 2.316 11.247 -4.934
59 H TYR 11 H TYR 11 0.747 7.741 -5.809
60 HA TYR 11 HA TYR 11 -0.131 6.033 -8.036
61 HB2 TYR 11 1HB TYR 11 1.870 5.100 -5.986
62 HB3 TYR 11 2HB TYR 11 1.448 4.348 -7.521
63 HD1 TYR 11 HD1 TYR 11 2.088 5.589 -9.665
64 HD2 TYR 11 HD2 TYR 11 3.679 6.578 -5.844
65 HE1 TYR 11 HE1 TYR 11 3.965 6.747 -10.753
66 HE2 TYR 11 HE2 TYR 11 5.560 7.740 -6.922
67 HH TYR 11 HH TYR 11 6.634 7.334 -9.680
68 H GLY 12 H GLY 12 -1.752 4.668 -7.562
69 HA2 GLY 12 1HA GLY 12 -2.241 3.839 -4.820
70 HA3 GLY 12 2HA GLY 12 -3.473 4.878 -5.523
71 H CYS 13 H CYS 13 -1.973 1.732 -5.605
72 HA CYS 13 HA CYS 13 -3.013 0.511 -7.790
73 HB2 CYS 13 1HB CYS 13 -1.611 -0.603 -6.072
74 HB3 CYS 13 2HB CYS 13 -3.013 -0.682 -5.009
75 H SER 14 H SER 14 -4.933 -0.450 -8.408
76 HA SER 14 HA SER 14 -7.306 0.548 -7.012
77 HB2 SER 14 1HB SER 14 -6.828 0.851 -9.560
78 HB3 SER 14 2HB SER 14 -7.378 -0.820 -9.685
79 HG SER 14 HG SER 14 -8.813 1.425 -8.726
80 H GLU 15 H GLU 15 -5.916 -2.440 -8.306
81 HA GLU 15 HA GLU 15 -7.832 -4.291 -7.949
82 HB2 GLU 15 1HB GLU 15 -4.897 -4.354 -7.436
83 HB3 GLU 15 2HB GLU 15 -5.854 -5.735 -6.922
84 HG2 GLU 15 1HG GLU 15 -4.822 -5.929 -9.189
85 HG3 GLU 15 2HG GLU 15 -6.565 -6.185 -9.130
86 H CYS 16 H CYS 16 -5.618 -3.378 -5.302
87 HA CYS 16 HA CYS 16 -7.556 -4.431 -3.378
88 HB2 CYS 16 1HB CYS 16 -5.712 -4.201 -1.737
89 HB3 CYS 16 2HB CYS 16 -5.276 -5.219 -3.106
90 H GLY 17 H GLY 17 -5.725 -1.478 -4.101
91 HA2 GLY 17 1HA GLY 17 -6.825 0.666 -3.923
92 HA3 GLY 17 2HA GLY 17 -7.752 0.024 -2.575
93 H LYS 18 H LYS 18 -4.263 -0.134 -3.196
94 HA LYS 18 HA LYS 18 -3.847 1.243 -0.626
95 HB2 LYS 18 1HB LYS 18 -2.357 -0.950 -2.018
96 HB3 LYS 18 2HB LYS 18 -1.497 0.109 -0.908
97 HG2 LYS 18 1HG LYS 18 -3.335 -0.475 0.775
98 HG3 LYS 18 2HG LYS 18 -3.736 -1.793 -0.328
99 HD2 LYS 18 1HD LYS 18 -2.257 -2.782 1.173
100 HD3 LYS 18 2HD LYS 18 -1.225 -2.369 -0.198
101 HE2 LYS 18 1HE LYS 18 -0.021 -1.678 1.693
102 HE3 LYS 18 2HE LYS 18 -0.727 -0.200 1.041
103 HZ1 LYS 18 3HZ LYS 18 -1.326 -1.607 3.524
104 HZ2 LYS 18 1HZ LYS 18 -2.632 -0.885 2.725
105 HZ3 LYS 18 2HZ LYS 18 -1.306 0.053 3.198
106 H ALA 19 H ALA 19 -1.466 2.192 -0.605
107 HA ALA 19 HA ALA 19 -0.956 3.598 -3.132
108 HB1 ALA 19 3HB ALA 19 -2.211 5.198 -1.937
109 HB2 ALA 19 1HB ALA 19 -1.355 4.859 -0.432
110 HB3 ALA 19 2HB ALA 19 -0.524 5.679 -1.755
111 H PHE 20 H PHE 20 1.192 4.561 -3.256
112 HA PHE 20 HA PHE 20 3.149 3.604 -1.321
113 HB2 PHE 20 1HB PHE 20 3.646 3.058 -4.235
114 HB3 PHE 20 2HB PHE 20 4.449 2.365 -2.830
115 HD1 PHE 20 HD1 PHE 20 1.233 2.419 -4.670
116 HD2 PHE 20 HD2 PHE 20 3.731 0.340 -1.922
117 HE1 PHE 20 HE1 PHE 20 -0.275 0.477 -4.774
118 HE2 PHE 20 HE2 PHE 20 2.228 -1.605 -2.022
119 HZ PHE 20 HZ PHE 20 0.222 -1.539 -3.450
120 H ARG 21 H ARG 21 4.202 5.394 -0.787
121 HA ARG 21 HA ARG 21 4.259 7.817 -1.981
122 HB2 ARG 21 1HB ARG 21 5.254 7.444 0.197
123 HB3 ARG 21 2HB ARG 21 6.538 6.479 -0.518
124 HG2 ARG 21 1HG ARG 21 7.610 8.323 -1.408
125 HG3 ARG 21 2HG ARG 21 6.155 9.319 -1.356
126 HD2 ARG 21 1HD ARG 21 7.613 8.329 1.088
127 HD3 ARG 21 2HD ARG 21 7.885 9.907 0.350
128 HE ARG 21 HE ARG 21 5.131 9.432 0.970
129 HH11 ARG 21 1HH1 ARG 21 8.191 10.461 2.273
130 HH12 ARG 21 2HH1 ARG 21 7.481 11.402 3.543
131 HH21 ARG 21 1HH2 ARG 21 4.185 10.668 2.638
132 HH22 ARG 21 2HH2 ARG 21 5.203 11.518 3.750
133 H SER 22 H SER 22 6.396 5.103 -2.736
134 HA SER 22 HA SER 22 7.434 6.624 -5.033
135 HB2 SER 22 1HB SER 22 8.949 5.529 -3.152
136 HB3 SER 22 2HB SER 22 8.714 4.080 -4.130
137 HG SER 22 HG SER 22 10.467 5.934 -4.549
138 H LYS 23 H LYS 23 7.809 5.422 -7.026
139 HA LYS 23 HA LYS 23 5.521 3.931 -7.795
140 HB2 LYS 23 1HB LYS 23 6.668 5.342 -9.397
141 HB3 LYS 23 2HB LYS 23 8.148 4.409 -9.211
142 HG2 LYS 23 1HG LYS 23 7.232 2.544 -10.320
143 HG3 LYS 23 2HG LYS 23 5.594 3.192 -10.217
144 HD2 LYS 23 1HD LYS 23 6.160 3.643 -12.415
145 HD3 LYS 23 2HD LYS 23 6.566 5.160 -11.609
146 HE2 LYS 23 1HE LYS 23 8.918 4.080 -11.352
147 HE3 LYS 23 2HE LYS 23 8.377 3.018 -12.650
148 HZ1 LYS 23 3HZ LYS 23 8.820 4.603 -14.108
149 HZ2 LYS 23 1HZ LYS 23 9.400 5.598 -12.868
150 HZ3 LYS 23 2HZ LYS 23 7.774 5.678 -13.326
151 H SER 24 H SER 24 8.956 3.001 -7.555
152 HA SER 24 HA SER 24 8.908 0.390 -8.214
153 HB2 SER 24 1HB SER 24 10.788 1.898 -7.109
154 HB3 SER 24 2HB SER 24 10.299 1.038 -5.649
155 HG SER 24 HG SER 24 11.022 -0.811 -6.471
156 H TYR 25 H TYR 25 8.131 1.596 -4.952
157 HA TYR 25 HA TYR 25 7.540 -0.731 -3.663
158 HB2 TYR 25 1HB TYR 25 6.446 2.036 -3.468
159 HB3 TYR 25 2HB TYR 25 5.623 0.759 -2.581
160 HD1 TYR 25 HD1 TYR 25 7.213 -0.778 -1.134
161 HD2 TYR 25 HD2 TYR 25 8.182 3.157 -2.432
162 HE1 TYR 25 HE1 TYR 25 8.870 -0.596 0.674
163 HE2 TYR 25 HE2 TYR 25 9.842 3.349 -0.628
164 HH TYR 25 HH TYR 25 10.068 2.114 1.804
165 H LEU 26 H LEU 26 5.292 1.153 -5.676
166 HA LEU 26 HA LEU 26 3.044 -0.450 -5.400
167 HB2 LEU 26 1HB LEU 26 2.802 1.645 -6.453
168 HB3 LEU 26 2HB LEU 26 4.024 1.263 -7.665
169 HG LEU 26 HG LEU 26 2.377 -0.518 -8.492
170 HD11 LEU 26 1HD1 LEU 26 0.012 -0.006 -8.025
171 HD12 LEU 26 2HD1 LEU 26 0.526 1.164 -6.810
172 HD13 LEU 26 3HD1 LEU 26 0.887 -0.548 -6.592
173 HD21 LEU 26 3HD2 LEU 26 0.981 1.337 -9.631
174 HD22 LEU 26 1HD2 LEU 26 2.720 1.278 -9.918
175 HD23 LEU 26 2HD2 LEU 26 2.055 2.445 -8.774
176 H ILE 27 H ILE 27 5.377 -0.537 -8.102
177 HA ILE 27 HA ILE 27 4.451 -2.706 -9.472
178 HB ILE 27 HB ILE 27 7.357 -2.072 -8.944
179 HG12 ILE 27 1HG1 ILE 27 5.788 -1.314 -11.394
180 HG13 ILE 27 2HG1 ILE 27 5.767 -0.290 -9.962
181 HG21 ILE 27 1HG2 ILE 27 6.249 -3.508 -11.336
182 HG22 ILE 27 2HG2 ILE 27 7.922 -3.400 -10.790
183 HG23 ILE 27 3HG2 ILE 27 6.760 -4.370 -9.885
184 HD11 ILE 27 3HD1 ILE 27 8.405 -0.597 -10.233
185 HD12 ILE 27 1HD1 ILE 27 7.916 -0.775 -11.918
186 HD13 ILE 27 2HD1 ILE 27 7.493 0.687 -11.026
187 H ILE 28 H ILE 28 7.039 -2.936 -7.023
188 HA ILE 28 HA ILE 28 7.336 -5.616 -6.819
189 HB ILE 28 HB ILE 28 7.197 -3.713 -4.477
190 HG12 ILE 28 1HG1 ILE 28 9.691 -4.687 -5.847
191 HG13 ILE 28 2HG1 ILE 28 8.822 -3.280 -6.449
192 HG21 ILE 28 1HG2 ILE 28 8.695 -6.316 -4.614
193 HG22 ILE 28 2HG2 ILE 28 8.385 -5.306 -3.203
194 HG23 ILE 28 3HG2 ILE 28 7.061 -6.188 -3.964
195 HD11 ILE 28 3HD1 ILE 28 10.660 -2.635 -5.004
196 HD12 ILE 28 1HD1 ILE 28 9.111 -2.178 -4.296
197 HD13 ILE 28 2HD1 ILE 28 9.976 -3.590 -3.689
198 H HIS 29 H HIS 29 4.701 -3.718 -5.442
199 HA HIS 29 HA HIS 29 3.518 -5.902 -4.034
200 HB2 HIS 29 1HB HIS 29 2.845 -3.896 -3.123
201 HB3 HIS 29 2HB HIS 29 2.730 -3.100 -4.689
202 HD1 HIS 29 HD1 HIS 29 0.811 -5.419 -2.426
203 HD2 HIS 29 HD2 HIS 29 0.232 -3.153 -5.860
204 HE1 HIS 29 HE1 HIS 29 -1.667 -5.465 -2.852
205 H MET 30 H MET 30 2.690 -4.214 -7.059
206 HA MET 30 HA MET 30 0.450 -5.494 -7.860
207 HB2 MET 30 1HB MET 30 2.864 -4.695 -9.470
208 HB3 MET 30 2HB MET 30 1.424 -5.358 -10.231
209 HG2 MET 30 1HG MET 30 1.578 -2.851 -8.574
210 HG3 MET 30 2HG MET 30 1.400 -2.946 -10.325
211 HE1 MET 30 3HE MET 30 -0.506 -2.877 -11.499
212 HE2 MET 30 1HE MET 30 -1.076 -4.532 -11.289
213 HE3 MET 30 2HE MET 30 -2.168 -3.180 -10.991
214 H ARG 31 H ARG 31 3.695 -6.834 -7.826
215 HA ARG 31 HA ARG 31 3.563 -9.041 -9.376
216 HB2 ARG 31 1HB ARG 31 4.618 -9.031 -6.543
217 HB3 ARG 31 2HB ARG 31 5.068 -10.160 -7.814
218 HG2 ARG 31 1HG ARG 31 6.007 -8.284 -9.108
219 HG3 ARG 31 2HG ARG 31 5.619 -7.201 -7.769
220 HD2 ARG 31 1HD ARG 31 7.959 -7.885 -7.696
221 HD3 ARG 31 2HD ARG 31 7.076 -8.493 -6.296
222 HE ARG 31 HE ARG 31 6.963 -10.528 -8.110
223 HH11 ARG 31 1HH1 ARG 31 9.522 -8.684 -6.635
224 HH12 ARG 31 2HH1 ARG 31 10.670 -9.981 -6.700
225 HH21 ARG 31 1HH2 ARG 31 8.465 -12.242 -8.200
226 HH22 ARG 31 2HH2 ARG 31 10.068 -12.004 -7.591
227 H THR 32 H THR 32 2.238 -8.804 -6.086
228 HA THR 32 HA THR 32 1.273 -11.406 -5.852
229 HB THR 32 HB THR 32 -0.366 -10.466 -4.213
230 HG1 THR 32 HG1 THR 32 0.517 -8.102 -5.415
231 HG21 THR 32 3HG2 THR 32 1.349 -9.586 -2.650
232 HG22 THR 32 1HG2 THR 32 2.495 -9.526 -3.988
233 HG23 THR 32 2HG2 THR 32 1.846 -11.076 -3.451
234 H HIS 33 H HIS 33 -0.395 -8.498 -7.047
235 HA HIS 33 HA HIS 33 -2.855 -9.724 -7.605
236 HB2 HIS 33 1HB HIS 33 -1.508 -7.284 -8.758
237 HB3 HIS 33 2HB HIS 33 -3.128 -7.782 -9.236
238 HD1 HIS 33 HD1 HIS 33 -4.303 -8.522 -6.507
239 HD2 HIS 33 HD2 HIS 33 -2.027 -5.116 -7.203
240 HE1 HIS 33 HE1 HIS 33 -4.939 -6.905 -4.690
241 H THR 34 H THR 34 -0.190 -8.931 -9.839
242 HA THR 34 HA THR 34 -1.219 -10.057 -12.140
243 HB THR 34 HB THR 34 1.189 -10.431 -12.822
244 HG1 THR 34 HG1 THR 34 2.479 -10.618 -11.145
245 HG21 THR 34 3HG2 THR 34 1.003 -7.681 -11.702
246 HG22 THR 34 1HG2 THR 34 -0.239 -8.196 -12.842
247 HG23 THR 34 2HG2 THR 34 1.459 -8.212 -13.320
248 H GLY 35 H GLY 35 1.025 -11.643 -9.855
249 HA2 GLY 35 1HA GLY 35 0.659 -14.209 -11.093
250 HA3 GLY 35 2HA GLY 35 1.555 -13.880 -9.618
251 H GLU 36 H GLU 36 -0.039 -16.132 -9.888
252 HA GLU 36 HA GLU 36 -2.651 -16.078 -9.116
253 HB2 GLU 36 1HB GLU 36 -2.202 -18.229 -7.915
254 HB3 GLU 36 2HB GLU 36 -1.580 -18.173 -9.558
255 HG2 GLU 36 1HG GLU 36 0.217 -19.073 -8.515
256 HG3 GLU 36 2HG GLU 36 0.609 -17.365 -8.328
257 H LYS 37 H LYS 37 -3.629 -16.527 -6.965
258 HA LYS 37 HA LYS 37 -4.140 -15.845 -4.856
259 HB2 LYS 37 1HB LYS 37 -1.178 -16.226 -4.741
260 HB3 LYS 37 2HB LYS 37 -1.988 -15.482 -3.369
261 HG2 LYS 37 1HG LYS 37 -3.226 -17.399 -2.904
262 HG3 LYS 37 2HG LYS 37 -2.944 -18.082 -4.507
263 HD2 LYS 37 1HD LYS 37 -0.739 -18.670 -3.994
264 HD3 LYS 37 2HD LYS 37 -0.676 -17.582 -2.605
265 HE2 LYS 37 1HE LYS 37 -2.451 -20.013 -2.764
266 HE3 LYS 37 2HE LYS 37 -0.847 -20.014 -2.032
267 HZ1 LYS 37 3HZ LYS 37 -2.402 -19.702 -0.300
268 HZ2 LYS 37 1HZ LYS 37 -3.236 -18.498 -1.147
269 HZ3 LYS 37 2HZ LYS 37 -1.682 -18.193 -0.555
270 HA PRO 38 HA PRO 38 -2.967 -11.443 -6.116
271 HB2 PRO 38 1HB PRO 38 -5.419 -10.702 -7.014
272 HB3 PRO 38 2HB PRO 38 -4.194 -11.431 -8.058
273 HG2 PRO 38 1HG PRO 38 -6.553 -12.708 -6.730
274 HG3 PRO 38 2HG PRO 38 -5.944 -12.928 -8.381
275 HD2 PRO 38 1HD PRO 38 -5.442 -14.698 -6.393
276 HD3 PRO 38 2HD PRO 38 -4.291 -14.389 -7.709
277 H SER 39 H SER 39 -6.055 -12.616 -4.777
278 HA SER 39 HA SER 39 -6.124 -10.336 -2.949
279 HB2 SER 39 1HB SER 39 -8.195 -10.851 -4.143
280 HB3 SER 39 2HB SER 39 -8.179 -12.492 -3.498
281 HG SER 39 HG SER 39 -8.900 -10.115 -2.286
282 H GLY 40 H GLY 40 -5.055 -10.571 -1.100
283 HA2 GLY 40 1HA GLY 40 -5.073 -13.228 0.191
284 HA3 GLY 40 2HA GLY 40 -3.766 -12.065 0.351
285 HA PRO 41 HA PRO 41 -5.578 -10.738 4.125
286 HB2 PRO 41 1HB PRO 41 -4.471 -8.266 4.305
287 HB3 PRO 41 2HB PRO 41 -3.554 -9.751 4.581
288 HG2 PRO 41 1HG PRO 41 -3.690 -8.037 2.131
289 HG3 PRO 41 2HG PRO 41 -2.278 -8.795 2.888
290 HD2 PRO 41 1HD PRO 41 -3.499 -9.840 0.709
291 HD3 PRO 41 2HD PRO 41 -2.716 -10.851 1.942
292 H SER 42 H SER 42 -6.221 -9.271 1.127
293 HA SER 42 HA SER 42 -7.897 -7.147 2.063
294 HB2 SER 42 1HB SER 42 -8.621 -7.033 -0.340
295 HB3 SER 42 2HB SER 42 -6.877 -6.917 -0.107
296 HG SER 42 HG SER 42 -7.878 -8.466 -1.764
297 H SER 43 H SER 43 -9.344 -8.151 3.500
298 HA SER 43 HA SER 43 -11.228 -10.074 2.337
299 HB2 SER 43 1HB SER 43 -10.419 -9.387 5.138
300 HB3 SER 43 2HB SER 43 -12.003 -10.108 4.851
301 HG SER 43 HG SER 43 -10.944 -11.849 3.827
302 H GLY 44 H GLY 44 -11.407 -7.291 4.572
303 HA2 GLY 44 1HA GLY 44 -12.952 -5.528 3.320
304 HA3 GLY 44 2HA GLY 44 -14.135 -6.775 3.684
Start of MODEL 2
1 H1 GLY 1 H GLY 1 -11.862 30.893 -5.418
2 HA2 GLY 1 1HA GLY 1 -10.232 28.857 -6.806
3 HA3 GLY 1 2HA GLY 1 -9.603 29.953 -5.584
4 H SER 2 H SER 2 -8.863 27.743 -4.800
5 HA SER 2 HA SER 2 -10.702 26.901 -2.712
6 HB2 SER 2 1HB SER 2 -10.394 24.496 -3.244
7 HB3 SER 2 2HB SER 2 -11.253 25.360 -4.519
8 HG SER 2 HG SER 2 -9.398 23.876 -5.078
9 H SER 3 H SER 3 -9.579 26.959 -0.894
10 HA SER 3 HA SER 3 -6.682 26.806 -0.952
11 HB2 SER 3 1HB SER 3 -8.521 27.230 1.416
12 HB3 SER 3 2HB SER 3 -6.781 27.513 1.371
13 HG SER 3 HG SER 3 -8.007 29.440 1.088
14 H GLY 4 H GLY 4 -6.057 24.717 -1.263
15 HA2 GLY 4 1HA GLY 4 -5.964 22.971 0.919
16 HA3 GLY 4 2HA GLY 4 -7.293 22.458 -0.110
17 H SER 5 H SER 5 -6.691 22.253 -2.490
18 HA SER 5 HA SER 5 -5.556 21.017 -4.034
19 HB2 SER 5 1HB SER 5 -3.178 22.422 -2.792
20 HB3 SER 5 2HB SER 5 -3.208 21.650 -4.378
21 HG SER 5 HG SER 5 -4.052 24.115 -3.655
22 H SER 6 H SER 6 -6.181 19.537 -1.811
23 HA SER 6 HA SER 6 -4.343 18.235 -0.334
24 HB2 SER 6 1HB SER 6 -6.629 17.580 -0.144
25 HB3 SER 6 2HB SER 6 -6.692 17.065 -1.829
26 HG SER 6 HG SER 6 -4.801 15.840 -0.194
27 H GLY 7 H GLY 7 -2.437 17.360 -0.768
28 HA2 GLY 7 1HA GLY 7 -1.824 16.477 -3.475
29 HA3 GLY 7 2HA GLY 7 -0.681 16.660 -2.153
30 H VAL 8 H VAL 8 -1.836 14.438 -4.137
31 HA VAL 8 HA VAL 8 -1.749 12.308 -2.100
32 HB VAL 8 HB VAL 8 -3.173 10.943 -3.601
33 HG11 VAL 8 1HG1 VAL 8 -5.059 13.048 -3.321
34 HG12 VAL 8 2HG1 VAL 8 -4.825 11.635 -2.291
35 HG13 VAL 8 3HG1 VAL 8 -3.941 13.126 -1.960
36 HG21 VAL 8 3HG2 VAL 8 -3.195 13.481 -5.203
37 HG22 VAL 8 1HG2 VAL 8 -2.851 11.836 -5.739
38 HG23 VAL 8 2HG2 VAL 8 -4.501 12.301 -5.323
39 H LYS 9 H LYS 9 -0.969 10.211 -2.923
40 HA LYS 9 HA LYS 9 1.497 10.510 -4.286
41 HB2 LYS 9 1HB LYS 9 -0.064 8.242 -3.158
42 HB3 LYS 9 2HB LYS 9 1.180 7.856 -4.341
43 HG2 LYS 9 1HG LYS 9 2.220 7.668 -2.250
44 HG3 LYS 9 2HG LYS 9 2.768 9.213 -2.906
45 HD2 LYS 9 1HD LYS 9 0.339 9.158 -1.176
46 HD3 LYS 9 2HD LYS 9 1.928 9.016 -0.420
47 HE2 LYS 9 1HE LYS 9 2.588 11.129 -1.121
48 HE3 LYS 9 2HE LYS 9 1.384 11.187 -2.407
49 HZ1 LYS 9 3HZ LYS 9 1.047 12.539 -0.227
50 HZ2 LYS 9 1HZ LYS 9 0.481 11.066 0.384
51 HZ3 LYS 9 2HZ LYS 9 -0.270 11.769 -0.959
52 HA PRO 10 HA PRO 10 0.263 10.133 -8.495
53 HB2 PRO 10 1HB PRO 10 2.591 9.215 -9.548
54 HB3 PRO 10 2HB PRO 10 2.368 10.888 -9.024
55 HG2 PRO 10 1HG PRO 10 3.686 8.613 -7.591
56 HG3 PRO 10 2HG PRO 10 4.212 10.301 -7.734
57 HD2 PRO 10 1HD PRO 10 2.974 9.342 -5.525
58 HD3 PRO 10 2HD PRO 10 2.780 11.018 -6.076
59 H TYR 11 H TYR 11 1.321 7.453 -6.612
60 HA TYR 11 HA TYR 11 0.305 5.585 -8.652
61 HB2 TYR 11 1HB TYR 11 2.210 4.962 -6.388
62 HB3 TYR 11 2HB TYR 11 1.715 3.871 -7.678
63 HD1 TYR 11 HD1 TYR 11 2.379 4.465 -10.065
64 HD2 TYR 11 HD2 TYR 11 4.071 6.365 -6.655
65 HE1 TYR 11 HE1 TYR 11 4.281 5.212 -11.433
66 HE2 TYR 11 HE2 TYR 11 5.977 7.119 -8.014
67 HH TYR 11 HH TYR 11 6.568 7.514 -10.298
68 H GLY 12 H GLY 12 -0.885 3.724 -7.876
69 HA2 GLY 12 1HA GLY 12 -1.775 3.476 -5.202
70 HA3 GLY 12 2HA GLY 12 -2.965 4.371 -6.136
71 H CYS 13 H CYS 13 -2.689 1.535 -4.895
72 HA CYS 13 HA CYS 13 -2.987 -0.218 -7.148
73 HB2 CYS 13 1HB CYS 13 -2.077 -1.218 -5.206
74 HB3 CYS 13 2HB CYS 13 -3.346 -0.561 -4.176
75 H SER 14 H SER 14 -4.756 -0.443 -8.330
76 HA SER 14 HA SER 14 -7.320 0.469 -7.240
77 HB2 SER 14 1HB SER 14 -8.083 0.617 -9.534
78 HB3 SER 14 2HB SER 14 -6.519 1.423 -9.408
79 HG SER 14 HG SER 14 -5.958 0.140 -10.969
80 H GLU 15 H GLU 15 -6.345 -1.992 -6.310
81 HA GLU 15 HA GLU 15 -8.284 -3.847 -7.525
82 HB2 GLU 15 1HB GLU 15 -5.443 -4.285 -6.726
83 HB3 GLU 15 2HB GLU 15 -6.581 -5.608 -6.513
84 HG2 GLU 15 1HG GLU 15 -6.040 -4.171 -9.101
85 HG3 GLU 15 2HG GLU 15 -5.387 -5.742 -8.642
86 H CYS 16 H CYS 16 -6.362 -3.290 -4.574
87 HA CYS 16 HA CYS 16 -8.635 -4.311 -3.004
88 HB2 CYS 16 1HB CYS 16 -7.019 -4.774 -1.221
89 HB3 CYS 16 2HB CYS 16 -6.560 -5.589 -2.712
90 H GLY 17 H GLY 17 -6.156 -1.774 -3.113
91 HA2 GLY 17 1HA GLY 17 -7.135 0.511 -2.727
92 HA3 GLY 17 2HA GLY 17 -7.838 -0.186 -1.275
93 H LYS 18 H LYS 18 -4.833 0.755 -2.838
94 HA LYS 18 HA LYS 18 -3.701 1.452 -0.276
95 HB2 LYS 18 1HB LYS 18 -2.451 -0.706 -1.984
96 HB3 LYS 18 2HB LYS 18 -1.623 0.109 -0.664
97 HG2 LYS 18 1HG LYS 18 -3.591 -0.686 0.785
98 HG3 LYS 18 2HG LYS 18 -3.931 -1.793 -0.548
99 HD2 LYS 18 1HD LYS 18 -1.482 -2.492 -0.363
100 HD3 LYS 18 2HD LYS 18 -1.479 -1.645 1.186
101 HE2 LYS 18 1HE LYS 18 -3.536 -3.731 0.532
102 HE3 LYS 18 2HE LYS 18 -1.959 -4.165 1.189
103 HZ1 LYS 18 3HZ LYS 18 -2.626 -3.594 3.209
104 HZ2 LYS 18 1HZ LYS 18 -4.190 -3.375 2.603
105 HZ3 LYS 18 2HZ LYS 18 -3.126 -2.063 2.691
106 H ALA 19 H ALA 19 -1.477 2.431 -0.570
107 HA ALA 19 HA ALA 19 -1.229 3.683 -3.225
108 HB1 ALA 19 3HB ALA 19 -1.794 4.953 -0.718
109 HB2 ALA 19 1HB ALA 19 -0.243 5.515 -1.341
110 HB3 ALA 19 2HB ALA 19 -1.696 5.660 -2.331
111 H PHE 20 H PHE 20 0.984 4.831 -3.397
112 HA PHE 20 HA PHE 20 3.112 3.519 -1.921
113 HB2 PHE 20 1HB PHE 20 3.166 3.346 -4.927
114 HB3 PHE 20 2HB PHE 20 4.173 2.492 -3.763
115 HD1 PHE 20 HD1 PHE 20 0.891 2.626 -5.377
116 HD2 PHE 20 HD2 PHE 20 3.386 0.509 -2.655
117 HE1 PHE 20 HE1 PHE 20 -0.648 0.708 -5.463
118 HE2 PHE 20 HE2 PHE 20 1.851 -1.412 -2.737
119 HZ PHE 20 HZ PHE 20 -0.169 -1.315 -4.143
120 H ARG 21 H ARG 21 4.609 4.985 -1.470
121 HA ARG 21 HA ARG 21 4.533 7.618 -2.416
122 HB2 ARG 21 1HB ARG 21 6.290 8.030 -0.996
123 HB3 ARG 21 2HB ARG 21 5.685 6.529 -0.308
124 HG2 ARG 21 1HG ARG 21 7.902 6.046 -0.389
125 HG3 ARG 21 2HG ARG 21 7.423 5.468 -1.985
126 HD2 ARG 21 1HD ARG 21 8.202 7.478 -3.021
127 HD3 ARG 21 2HD ARG 21 8.476 8.239 -1.454
128 HE ARG 21 HE ARG 21 10.000 5.863 -1.695
129 HH11 ARG 21 1HH1 ARG 21 9.870 9.170 -2.775
130 HH12 ARG 21 2HH1 ARG 21 11.581 9.295 -3.017
131 HH21 ARG 21 1HH2 ARG 21 12.254 6.015 -2.009
132 HH22 ARG 21 2HH2 ARG 21 12.936 7.500 -2.582
133 H SER 22 H SER 22 6.224 4.794 -3.574
134 HA SER 22 HA SER 22 7.278 6.404 -5.802
135 HB2 SER 22 1HB SER 22 9.117 5.763 -4.289
136 HB3 SER 22 2HB SER 22 8.669 4.067 -4.468
137 HG SER 22 HG SER 22 9.917 5.788 -6.278
138 H LYS 23 H LYS 23 8.063 4.746 -7.598
139 HA LYS 23 HA LYS 23 5.690 3.397 -8.462
140 HB2 LYS 23 1HB LYS 23 7.024 2.825 -10.462
141 HB3 LYS 23 2HB LYS 23 7.087 4.541 -10.082
142 HG2 LYS 23 1HG LYS 23 9.266 3.796 -8.777
143 HG3 LYS 23 2HG LYS 23 9.220 2.486 -9.959
144 HD2 LYS 23 1HD LYS 23 8.889 5.311 -10.874
145 HD3 LYS 23 2HD LYS 23 10.502 4.703 -10.493
146 HE2 LYS 23 1HE LYS 23 10.222 2.899 -12.096
147 HE3 LYS 23 2HE LYS 23 8.576 3.431 -12.437
148 HZ1 LYS 23 3HZ LYS 23 9.293 5.124 -13.716
149 HZ2 LYS 23 1HZ LYS 23 10.670 4.156 -13.891
150 HZ3 LYS 23 2HZ LYS 23 10.665 5.425 -12.773
151 H SER 24 H SER 24 8.881 2.390 -7.322
152 HA SER 24 HA SER 24 8.649 -0.351 -7.822
153 HB2 SER 24 1HB SER 24 10.275 1.314 -5.948
154 HB3 SER 24 2HB SER 24 10.240 -0.432 -5.703
155 HG SER 24 HG SER 24 11.816 0.756 -7.296
156 H TYR 25 H TYR 25 7.913 1.475 -4.855
157 HA TYR 25 HA TYR 25 7.114 -0.539 -3.192
158 HB2 TYR 25 1HB TYR 25 6.276 2.303 -3.512
159 HB3 TYR 25 2HB TYR 25 5.310 1.278 -2.456
160 HD1 TYR 25 HD2 TYR 25 8.764 2.507 -3.043
161 HD2 TYR 25 HD1 TYR 25 6.028 0.792 -0.272
162 HE1 TYR 25 HE2 TYR 25 10.391 2.854 -1.231
163 HE2 TYR 25 HE1 TYR 25 7.646 1.136 1.547
164 HH TYR 25 HH TYR 25 10.819 1.703 1.103
165 H LEU 26 H LEU 26 5.429 0.728 -5.968
166 HA LEU 26 HA LEU 26 2.929 -0.554 -5.359
167 HB2 LEU 26 1HB LEU 26 2.732 1.379 -6.657
168 HB3 LEU 26 2HB LEU 26 4.034 0.892 -7.740
169 HG LEU 26 HG LEU 26 2.515 -0.913 -8.600
170 HD11 LEU 26 1HD1 LEU 26 0.315 0.640 -7.271
171 HD12 LEU 26 2HD1 LEU 26 1.027 -0.800 -6.544
172 HD13 LEU 26 3HD1 LEU 26 0.219 -0.910 -8.108
173 HD21 LEU 26 3HD2 LEU 26 0.958 0.859 -9.737
174 HD22 LEU 26 1HD2 LEU 26 2.690 0.844 -10.069
175 HD23 LEU 26 2HD2 LEU 26 2.021 2.010 -8.927
176 H ILE 27 H ILE 27 5.599 -1.153 -7.622
177 HA ILE 27 HA ILE 27 4.543 -3.419 -8.870
178 HB ILE 27 HB ILE 27 7.437 -2.743 -8.332
179 HG12 ILE 27 1HG1 ILE 27 5.965 -2.412 -10.933
180 HG13 ILE 27 2HG1 ILE 27 5.910 -1.157 -9.700
181 HG21 ILE 27 1HG2 ILE 27 6.412 -4.573 -10.480
182 HG22 ILE 27 2HG2 ILE 27 8.067 -4.360 -9.912
183 HG23 ILE 27 3HG2 ILE 27 6.880 -5.167 -8.886
184 HD11 ILE 27 3HD1 ILE 27 7.638 -0.904 -11.527
185 HD12 ILE 27 1HD1 ILE 27 8.211 -0.748 -9.867
186 HD13 ILE 27 2HD1 ILE 27 8.495 -2.242 -10.761
187 H ILE 28 H ILE 28 6.437 -3.094 -5.906
188 HA ILE 28 HA ILE 28 6.872 -5.831 -5.436
189 HB ILE 28 HB ILE 28 6.626 -3.588 -3.428
190 HG12 ILE 28 1HG1 ILE 28 9.124 -4.829 -4.588
191 HG13 ILE 28 2HG1 ILE 28 8.390 -3.362 -5.225
192 HG21 ILE 28 1HG2 ILE 28 7.923 -6.290 -3.103
193 HG22 ILE 28 2HG2 ILE 28 7.796 -5.023 -1.885
194 HG23 ILE 28 3HG2 ILE 28 6.344 -5.846 -2.454
195 HD11 ILE 28 3HD1 ILE 28 10.344 -3.386 -3.391
196 HD12 ILE 28 1HD1 ILE 28 9.153 -2.095 -3.537
197 HD13 ILE 28 2HD1 ILE 28 8.932 -3.367 -2.335
198 H HIS 29 H HIS 29 4.102 -3.797 -4.937
199 HA HIS 29 HA HIS 29 2.763 -5.832 -3.321
200 HB2 HIS 29 1HB HIS 29 2.377 -3.691 -2.433
201 HB3 HIS 29 2HB HIS 29 2.127 -2.977 -4.024
202 HD1 HIS 29 HD1 HIS 29 0.381 -4.985 -1.385
203 HD2 HIS 29 HD2 HIS 29 -0.465 -3.170 -5.025
204 HE1 HIS 29 HE1 HIS 29 -2.125 -5.028 -1.591
205 H MET 30 H MET 30 2.927 -4.661 -6.549
206 HA MET 30 HA MET 30 0.354 -5.674 -7.359
207 HB2 MET 30 1HB MET 30 2.698 -4.466 -8.791
208 HB3 MET 30 2HB MET 30 1.417 -5.258 -9.699
209 HG2 MET 30 1HG MET 30 0.654 -3.213 -7.688
210 HG3 MET 30 2HG MET 30 1.378 -2.674 -9.201
211 HE1 MET 30 3HE MET 30 -1.245 -2.372 -7.589
212 HE2 MET 30 1HE MET 30 -2.319 -1.944 -8.922
213 HE3 MET 30 2HE MET 30 -2.585 -3.436 -8.020
214 H ARG 31 H ARG 31 3.742 -6.623 -7.900
215 HA ARG 31 HA ARG 31 3.597 -8.749 -9.512
216 HB2 ARG 31 1HB ARG 31 5.413 -9.811 -8.225
217 HB3 ARG 31 2HB ARG 31 5.676 -8.086 -8.445
218 HG2 ARG 31 1HG ARG 31 5.007 -7.635 -6.187
219 HG3 ARG 31 2HG ARG 31 4.533 -9.318 -5.950
220 HD2 ARG 31 1HD ARG 31 6.690 -8.917 -4.929
221 HD3 ARG 31 2HD ARG 31 6.869 -10.004 -6.305
222 HE ARG 31 HE ARG 31 7.303 -7.238 -6.953
223 HH11 ARG 31 1HH1 ARG 31 8.764 -10.162 -5.756
224 HH12 ARG 31 2HH1 ARG 31 10.370 -9.704 -6.218
225 HH21 ARG 31 1HH2 ARG 31 9.412 -6.623 -7.566
226 HH22 ARG 31 2HH2 ARG 31 10.737 -7.690 -7.246
227 H THR 32 H THR 32 2.430 -8.671 -6.200
228 HA THR 32 HA THR 32 1.848 -11.468 -6.056
229 HB THR 32 HB THR 32 0.726 -10.983 -3.976
230 HG1 THR 32 HG1 THR 32 0.598 -8.660 -3.375
231 HG21 THR 32 3HG2 THR 32 3.128 -10.984 -3.826
232 HG22 THR 32 1HG2 THR 32 2.506 -9.700 -2.790
233 HG23 THR 32 2HG2 THR 32 3.206 -9.305 -4.361
234 H HIS 33 H HIS 33 -0.149 -8.552 -6.487
235 HA HIS 33 HA HIS 33 -2.635 -9.761 -6.671
236 HB2 HIS 33 1HB HIS 33 -1.462 -7.226 -7.704
237 HB3 HIS 33 2HB HIS 33 -3.014 -7.733 -8.364
238 HD1 HIS 33 HD1 HIS 33 -4.486 -8.731 -5.948
239 HD2 HIS 33 HD2 HIS 33 -2.077 -5.347 -5.863
240 HE1 HIS 33 HE1 HIS 33 -5.307 -7.370 -3.999
241 H THR 34 H THR 34 -0.452 -8.913 -9.361
242 HA THR 34 HA THR 34 -0.967 -11.294 -10.794
243 HB THR 34 HB THR 34 -3.160 -10.304 -11.203
244 HG1 THR 34 HG1 THR 34 -2.916 -10.182 -13.589
245 HG21 THR 34 3HG2 THR 34 -3.538 -8.173 -11.911
246 HG22 THR 34 1HG2 THR 34 -2.036 -8.094 -12.830
247 HG23 THR 34 2HG2 THR 34 -2.008 -7.896 -11.078
248 H GLY 35 H GLY 35 0.357 -11.511 -12.603
249 HA2 GLY 35 1HA GLY 35 1.851 -10.753 -14.265
250 HA3 GLY 35 2HA GLY 35 1.901 -9.185 -13.473
251 H GLU 36 H GLU 36 4.108 -10.863 -14.400
252 HA GLU 36 HA GLU 36 6.053 -11.855 -13.660
253 HB2 GLU 36 1HB GLU 36 5.709 -9.356 -12.022
254 HB3 GLU 36 2HB GLU 36 7.154 -10.347 -11.879
255 HG2 GLU 36 1HG GLU 36 7.776 -9.946 -14.113
256 HG3 GLU 36 2HG GLU 36 6.194 -9.277 -14.513
257 H LYS 37 H LYS 37 3.884 -13.190 -12.545
258 HA LYS 37 HA LYS 37 4.716 -13.673 -9.764
259 HB2 LYS 37 1HB LYS 37 2.309 -13.050 -10.261
260 HB3 LYS 37 2HB LYS 37 2.160 -14.603 -11.073
261 HG2 LYS 37 1HG LYS 37 1.311 -14.966 -8.931
262 HG3 LYS 37 2HG LYS 37 2.942 -15.639 -8.882
263 HD2 LYS 37 1HD LYS 37 3.749 -13.566 -7.837
264 HD3 LYS 37 2HD LYS 37 2.105 -12.922 -7.863
265 HE2 LYS 37 1HE LYS 37 1.375 -14.363 -6.218
266 HE3 LYS 37 2HE LYS 37 2.627 -15.556 -6.559
267 HZ1 LYS 37 3HZ LYS 37 3.595 -12.994 -5.624
268 HZ2 LYS 37 1HZ LYS 37 4.068 -14.557 -5.185
269 HZ3 LYS 37 2HZ LYS 37 2.689 -13.865 -4.491
270 HA PRO 38 HA PRO 38 6.355 -17.312 -12.075
271 HB2 PRO 38 1HB PRO 38 8.596 -17.534 -10.559
272 HB3 PRO 38 2HB PRO 38 8.484 -16.457 -11.956
273 HG2 PRO 38 1HG PRO 38 8.206 -15.819 -9.044
274 HG3 PRO 38 2HG PRO 38 9.071 -14.925 -10.308
275 HD2 PRO 38 1HD PRO 38 6.617 -14.194 -9.427
276 HD3 PRO 38 2HD PRO 38 7.146 -13.936 -11.102
277 H SER 39 H SER 39 5.905 -16.633 -8.663
278 HA SER 39 HA SER 39 6.150 -19.342 -7.791
279 HB2 SER 39 1HB SER 39 4.777 -17.040 -6.387
280 HB3 SER 39 2HB SER 39 5.351 -18.534 -5.647
281 HG SER 39 HG SER 39 7.193 -16.998 -7.072
282 H GLY 40 H GLY 40 4.545 -20.811 -7.249
283 HA2 GLY 40 1HA GLY 40 1.971 -20.327 -8.583
284 HA3 GLY 40 2HA GLY 40 2.644 -21.904 -8.199
285 HA PRO 41 HA PRO 41 -0.016 -22.034 -4.705
286 HB2 PRO 41 1HB PRO 41 1.308 -23.878 -3.215
287 HB3 PRO 41 2HB PRO 41 0.389 -24.296 -4.666
288 HG2 PRO 41 1HG PRO 41 3.338 -23.895 -4.341
289 HG3 PRO 41 2HG PRO 41 2.472 -25.151 -5.244
290 HD2 PRO 41 1HD PRO 41 3.570 -22.987 -6.446
291 HD3 PRO 41 2HD PRO 41 2.096 -23.770 -7.050
292 H SER 42 H SER 42 3.450 -22.062 -3.844
293 HA SER 42 HA SER 42 4.479 -21.245 -1.937
294 HB2 SER 42 1HB SER 42 3.151 -18.906 -3.295
295 HB3 SER 42 2HB SER 42 4.207 -18.683 -1.900
296 HG SER 42 HG SER 42 5.890 -19.585 -3.058
297 H SER 43 H SER 43 2.282 -22.530 -1.036
298 HA SER 43 HA SER 43 0.627 -20.797 0.562
299 HB2 SER 43 1HB SER 43 -0.347 -22.900 1.418
300 HB3 SER 43 2HB SER 43 -0.298 -22.875 -0.345
301 HG SER 43 HG SER 43 1.881 -23.977 1.006
302 H GLY 44 H GLY 44 3.194 -20.220 1.212
303 HA2 GLY 44 1HA GLY 44 4.810 -20.318 2.887
304 HA3 GLY 44 2HA GLY 44 3.375 -20.081 3.872
Start of MODEL 3
1 H1 GLY 1 H GLY 1 -23.264 18.008 5.412
2 HA2 GLY 1 1HA GLY 1 -21.898 16.248 4.296
3 HA3 GLY 1 2HA GLY 1 -21.848 17.325 2.908
4 H SER 2 H SER 2 -19.815 16.138 4.908
5 HA SER 2 HA SER 2 -17.979 18.279 4.793
6 HB2 SER 2 1HB SER 2 -17.756 18.821 7.155
7 HB3 SER 2 2HB SER 2 -19.411 19.140 6.636
8 HG SER 2 HG SER 2 -19.850 17.947 8.326
9 H SER 3 H SER 3 -16.331 17.018 4.204
10 HA SER 3 HA SER 3 -15.823 14.542 5.696
11 HB2 SER 3 1HB SER 3 -15.148 15.489 2.943
12 HB3 SER 3 2HB SER 3 -14.086 14.309 3.711
13 HG SER 3 HG SER 3 -15.622 13.139 2.662
14 H GLY 4 H GLY 4 -13.857 14.122 6.673
15 HA2 GLY 4 1HA GLY 4 -12.026 16.434 6.878
16 HA3 GLY 4 2HA GLY 4 -12.448 15.434 8.260
17 H SER 5 H SER 5 -11.244 14.938 4.937
18 HA SER 5 HA SER 5 -9.157 13.197 6.073
19 HB2 SER 5 1HB SER 5 -9.362 11.715 4.144
20 HB3 SER 5 2HB SER 5 -10.918 11.850 4.963
21 HG SER 5 HG SER 5 -11.004 12.048 2.633
22 H SER 6 H SER 6 -7.239 12.972 4.697
23 HA SER 6 HA SER 6 -6.778 14.751 2.524
24 HB2 SER 6 1HB SER 6 -5.975 15.592 5.273
25 HB3 SER 6 2HB SER 6 -4.871 15.939 3.942
26 HG SER 6 HG SER 6 -6.993 16.757 2.939
27 H GLY 7 H GLY 7 -4.947 14.214 1.404
28 HA2 GLY 7 1HA GLY 7 -2.644 13.350 1.471
29 HA3 GLY 7 2HA GLY 7 -3.209 12.173 2.648
30 H VAL 8 H VAL 8 -2.299 12.510 -0.465
31 HA VAL 8 HA VAL 8 -3.461 9.977 -1.210
32 HB VAL 8 HB VAL 8 -5.248 11.534 -1.875
33 HG11 VAL 8 1HG1 VAL 8 -3.257 13.282 -2.473
34 HG12 VAL 8 2HG1 VAL 8 -3.711 12.712 -4.081
35 HG13 VAL 8 3HG1 VAL 8 -4.925 13.437 -3.025
36 HG21 VAL 8 3HG2 VAL 8 -5.655 10.109 -3.530
37 HG22 VAL 8 1HG2 VAL 8 -4.461 10.913 -4.549
38 HG23 VAL 8 2HG2 VAL 8 -3.968 9.597 -3.482
39 H LYS 9 H LYS 9 -1.816 8.894 -2.046
40 HA LYS 9 HA LYS 9 0.464 10.276 -3.162
41 HB2 LYS 9 1HB LYS 9 -0.169 7.467 -2.385
42 HB3 LYS 9 2HB LYS 9 1.120 7.730 -3.552
43 HG2 LYS 9 1HG LYS 9 2.114 7.605 -1.402
44 HG3 LYS 9 2HG LYS 9 2.176 9.293 -1.914
45 HD2 LYS 9 1HD LYS 9 -0.172 8.399 -0.323
46 HD3 LYS 9 2HD LYS 9 1.371 8.594 0.513
47 HE2 LYS 9 1HE LYS 9 0.148 10.721 -1.233
48 HE3 LYS 9 2HE LYS 9 -0.130 10.617 0.505
49 HZ1 LYS 9 3HZ LYS 9 2.001 11.228 0.977
50 HZ2 LYS 9 1HZ LYS 9 1.780 12.088 -0.463
51 HZ3 LYS 9 2HZ LYS 9 2.633 10.628 -0.472
52 HA PRO 10 HA PRO 10 -0.587 9.965 -7.415
53 HB2 PRO 10 1HB PRO 10 1.881 9.726 -8.521
54 HB3 PRO 10 2HB PRO 10 1.277 11.240 -7.836
55 HG2 PRO 10 1HG PRO 10 3.104 9.204 -6.619
56 HG3 PRO 10 2HG PRO 10 3.219 10.973 -6.585
57 HD2 PRO 10 1HD PRO 10 2.261 9.535 -4.500
58 HD3 PRO 10 2HD PRO 10 1.675 11.166 -4.884
59 H TYR 11 H TYR 11 0.922 7.412 -5.737
60 HA TYR 11 HA TYR 11 0.384 5.577 -7.979
61 HB2 TYR 11 1HB TYR 11 2.448 5.188 -5.805
62 HB3 TYR 11 2HB TYR 11 2.181 4.151 -7.202
63 HD1 TYR 11 HD1 TYR 11 2.632 5.114 -9.512
64 HD2 TYR 11 HD2 TYR 11 3.917 7.016 -5.930
65 HE1 TYR 11 HE1 TYR 11 4.272 6.418 -10.800
66 HE2 TYR 11 HE2 TYR 11 5.559 8.327 -7.208
67 HH TYR 11 HH TYR 11 6.704 7.639 -9.979
68 H GLY 12 H GLY 12 -1.796 5.422 -7.142
69 HA2 GLY 12 1HA GLY 12 -2.004 3.916 -4.617
70 HA3 GLY 12 2HA GLY 12 -3.304 4.845 -5.348
71 H CYS 13 H CYS 13 -1.976 1.786 -4.952
72 HA CYS 13 HA CYS 13 -2.431 0.359 -7.217
73 HB2 CYS 13 1HB CYS 13 -1.616 -0.819 -5.338
74 HB3 CYS 13 2HB CYS 13 -2.990 -0.346 -4.343
75 H SER 14 H SER 14 -4.073 0.434 -8.592
76 HA SER 14 HA SER 14 -6.768 0.987 -7.622
77 HB2 SER 14 1HB SER 14 -5.673 2.129 -9.660
78 HB3 SER 14 2HB SER 14 -5.991 0.616 -10.509
79 HG SER 14 HG SER 14 -7.774 1.818 -10.860
80 H GLU 15 H GLU 15 -5.792 -1.509 -6.866
81 HA GLU 15 HA GLU 15 -7.520 -3.289 -8.451
82 HB2 GLU 15 1HB GLU 15 -4.712 -3.680 -7.547
83 HB3 GLU 15 2HB GLU 15 -5.781 -5.074 -7.498
84 HG2 GLU 15 1HG GLU 15 -4.954 -3.449 -9.877
85 HG3 GLU 15 2HG GLU 15 -4.690 -5.165 -9.574
86 H CYS 16 H CYS 16 -5.903 -2.859 -5.312
87 HA CYS 16 HA CYS 16 -8.206 -4.193 -4.044
88 HB2 CYS 16 1HB CYS 16 -6.749 -4.932 -2.277
89 HB3 CYS 16 2HB CYS 16 -6.019 -5.386 -3.814
90 H GLY 17 H GLY 17 -5.806 -1.605 -3.679
91 HA2 GLY 17 1HA GLY 17 -6.900 0.592 -3.096
92 HA3 GLY 17 2HA GLY 17 -7.645 -0.295 -1.775
93 H LYS 18 H LYS 18 -4.428 0.418 -3.125
94 HA LYS 18 HA LYS 18 -3.480 0.849 -0.375
95 HB2 LYS 18 1HB LYS 18 -2.127 -0.729 -2.560
96 HB3 LYS 18 2HB LYS 18 -1.263 -0.120 -1.155
97 HG2 LYS 18 1HG LYS 18 -3.714 -1.743 -0.715
98 HG3 LYS 18 2HG LYS 18 -2.232 -2.560 -1.219
99 HD2 LYS 18 1HD LYS 18 -2.000 -2.636 1.063
100 HD3 LYS 18 2HD LYS 18 -1.168 -1.121 0.706
101 HE2 LYS 18 1HE LYS 18 -2.896 0.173 1.526
102 HE3 LYS 18 2HE LYS 18 -4.097 -1.095 1.286
103 HZ1 LYS 18 3HZ LYS 18 -3.710 -0.906 3.601
104 HZ2 LYS 18 1HZ LYS 18 -2.030 -0.954 3.407
105 HZ3 LYS 18 2HZ LYS 18 -2.956 -2.336 3.105
106 H ALA 19 H ALA 19 -1.267 1.991 -0.431
107 HA ALA 19 HA ALA 19 -1.089 3.875 -2.673
108 HB1 ALA 19 3HB ALA 19 -0.948 5.782 -1.222
109 HB2 ALA 19 1HB ALA 19 -2.435 4.907 -0.858
110 HB3 ALA 19 2HB ALA 19 -1.039 4.756 0.209
111 H PHE 20 H PHE 20 0.962 4.679 -3.083
112 HA PHE 20 HA PHE 20 3.150 3.856 -1.331
113 HB2 PHE 20 1HB PHE 20 3.256 3.298 -4.295
114 HB3 PHE 20 2HB PHE 20 4.393 2.776 -3.057
115 HD1 PHE 20 HD1 PHE 20 1.050 2.242 -4.483
116 HD2 PHE 20 HD2 PHE 20 3.978 0.841 -1.730
117 HE1 PHE 20 HE1 PHE 20 -0.192 0.132 -4.243
118 HE2 PHE 20 HE2 PHE 20 2.742 -1.273 -1.486
119 HZ PHE 20 HZ PHE 20 0.655 -1.630 -2.744
120 H ARG 21 H ARG 21 5.016 5.109 -1.514
121 HA ARG 21 HA ARG 21 4.595 7.677 -2.847
122 HB2 ARG 21 1HB ARG 21 5.248 7.427 -0.372
123 HB3 ARG 21 2HB ARG 21 6.850 7.014 -0.969
124 HG2 ARG 21 1HG ARG 21 6.701 9.227 -2.272
125 HG3 ARG 21 2HG ARG 21 5.380 9.611 -1.167
126 HD2 ARG 21 1HD ARG 21 8.050 8.684 -0.160
127 HD3 ARG 21 2HD ARG 21 7.751 10.379 -0.543
128 HE ARG 21 HE ARG 21 5.696 9.739 1.099
129 HH11 ARG 21 1HH1 ARG 21 9.153 9.399 1.338
130 HH12 ARG 21 2HH1 ARG 21 9.180 9.554 3.063
131 HH21 ARG 21 1HH2 ARG 21 5.719 9.944 3.371
132 HH22 ARG 21 2HH2 ARG 21 7.226 9.863 4.219
133 H SER 22 H SER 22 5.566 5.023 -4.055
134 HA SER 22 HA SER 22 7.512 6.218 -5.803
135 HB2 SER 22 1HB SER 22 8.858 5.401 -3.818
136 HB3 SER 22 2HB SER 22 8.377 3.765 -4.264
137 HG SER 22 HG SER 22 9.474 5.386 -6.252
138 H LYS 23 H LYS 23 6.977 5.560 -7.766
139 HA LYS 23 HA LYS 23 5.050 3.854 -8.532
140 HB2 LYS 23 1HB LYS 23 6.393 5.287 -10.060
141 HB3 LYS 23 2HB LYS 23 7.694 4.107 -9.978
142 HG2 LYS 23 1HG LYS 23 5.788 2.463 -10.761
143 HG3 LYS 23 2HG LYS 23 5.077 3.958 -11.373
144 HD2 LYS 23 1HD LYS 23 6.355 3.133 -13.159
145 HD3 LYS 23 2HD LYS 23 7.357 4.397 -12.442
146 HE2 LYS 23 1HE LYS 23 7.677 1.600 -11.473
147 HE3 LYS 23 2HE LYS 23 8.347 2.026 -13.046
148 HZ1 LYS 23 3HZ LYS 23 9.184 2.854 -10.388
149 HZ2 LYS 23 1HZ LYS 23 9.244 4.047 -11.586
150 HZ3 LYS 23 2HZ LYS 23 10.104 2.605 -11.785
151 H SER 24 H SER 24 8.419 2.913 -7.924
152 HA SER 24 HA SER 24 8.213 0.220 -8.617
153 HB2 SER 24 1HB SER 24 10.289 1.663 -7.944
154 HB3 SER 24 2HB SER 24 9.933 1.087 -6.315
155 HG SER 24 HG SER 24 10.117 -1.042 -7.102
156 H TYR 25 H TYR 25 8.149 1.563 -5.310
157 HA TYR 25 HA TYR 25 7.578 -0.546 -3.787
158 HB2 TYR 25 1HB TYR 25 6.497 2.235 -3.735
159 HB3 TYR 25 2HB TYR 25 5.809 1.053 -2.627
160 HD1 TYR 25 HD2 TYR 25 9.276 1.840 -3.800
161 HD2 TYR 25 HD1 TYR 25 6.651 1.282 -0.499
162 HE1 TYR 25 HE2 TYR 25 11.153 2.206 -2.253
163 HE2 TYR 25 HE1 TYR 25 8.520 1.648 1.057
164 HH TYR 25 HH TYR 25 11.119 1.374 0.909
165 H LEU 26 H LEU 26 5.204 1.063 -5.865
166 HA LEU 26 HA LEU 26 2.950 -0.408 -5.128
167 HB2 LEU 26 1HB LEU 26 2.775 1.587 -6.465
168 HB3 LEU 26 2HB LEU 26 3.685 0.834 -7.773
169 HG LEU 26 HG LEU 26 1.819 -0.748 -8.116
170 HD11 LEU 26 1HD1 LEU 26 -0.350 -0.247 -7.050
171 HD12 LEU 26 2HD1 LEU 26 0.457 0.929 -6.015
172 HD13 LEU 26 3HD1 LEU 26 0.875 -0.780 -5.898
173 HD21 LEU 26 3HD2 LEU 26 0.134 1.139 -8.801
174 HD22 LEU 26 1HD2 LEU 26 1.688 0.981 -9.620
175 HD23 LEU 26 2HD2 LEU 26 1.473 2.203 -8.366
176 H ILE 27 H ILE 27 5.104 -0.944 -7.922
177 HA ILE 27 HA ILE 27 4.012 -3.239 -8.935
178 HB ILE 27 HB ILE 27 6.957 -2.610 -8.693
179 HG12 ILE 27 1HG1 ILE 27 5.170 -2.200 -11.086
180 HG13 ILE 27 2HG1 ILE 27 5.397 -0.951 -9.867
181 HG21 ILE 27 1HG2 ILE 27 7.330 -4.174 -10.467
182 HG22 ILE 27 2HG2 ILE 27 6.443 -4.997 -9.184
183 HG23 ILE 27 3HG2 ILE 27 5.599 -4.466 -10.639
184 HD11 ILE 27 3HD1 ILE 27 7.950 -1.471 -10.385
185 HD12 ILE 27 1HD1 ILE 27 7.256 -1.950 -11.933
186 HD13 ILE 27 2HD1 ILE 27 7.003 -0.315 -11.321
187 H ILE 28 H ILE 28 6.713 -3.193 -6.599
188 HA ILE 28 HA ILE 28 6.970 -5.843 -6.065
189 HB ILE 28 HB ILE 28 7.021 -3.657 -3.980
190 HG12 ILE 28 1HG1 ILE 28 9.598 -4.081 -4.513
191 HG13 ILE 28 2HG1 ILE 28 8.942 -4.550 -6.078
192 HG21 ILE 28 1HG2 ILE 28 6.927 -5.875 -2.986
193 HG22 ILE 28 2HG2 ILE 28 8.281 -6.396 -3.987
194 HG23 ILE 28 3HG2 ILE 28 8.521 -5.159 -2.754
195 HD11 ILE 28 3HD1 ILE 28 9.598 -2.007 -5.291
196 HD12 ILE 28 1HD1 ILE 28 8.576 -2.439 -6.662
197 HD13 ILE 28 2HD1 ILE 28 7.845 -2.044 -5.106
198 H HIS 29 H HIS 29 4.289 -3.824 -5.245
199 HA HIS 29 HA HIS 29 3.176 -5.826 -3.427
200 HB2 HIS 29 1HB HIS 29 2.805 -3.737 -2.496
201 HB3 HIS 29 2HB HIS 29 2.537 -2.971 -4.059
202 HD1 HIS 29 HD1 HIS 29 0.789 -5.008 -1.437
203 HD2 HIS 29 HD2 HIS 29 -0.091 -2.987 -4.958
204 HE1 HIS 29 HE1 HIS 29 -1.722 -4.927 -1.556
205 H MET 30 H MET 30 2.699 -4.447 -6.608
206 HA MET 30 HA MET 30 0.141 -5.601 -7.079
207 HB2 MET 30 1HB MET 30 2.251 -4.406 -8.855
208 HB3 MET 30 2HB MET 30 0.816 -5.162 -9.534
209 HG2 MET 30 1HG MET 30 -0.456 -3.580 -7.914
210 HG3 MET 30 2HG MET 30 1.056 -2.676 -7.908
211 HE1 MET 30 3HE MET 30 -1.613 -4.335 -9.790
212 HE2 MET 30 1HE MET 30 -2.384 -2.800 -10.190
213 HE3 MET 30 2HE MET 30 -1.557 -3.724 -11.444
214 H ARG 31 H ARG 31 3.440 -6.681 -7.515
215 HA ARG 31 HA ARG 31 3.297 -8.710 -9.297
216 HB2 ARG 31 1HB ARG 31 5.093 -9.783 -8.154
217 HB3 ARG 31 2HB ARG 31 5.290 -8.053 -7.906
218 HG2 ARG 31 1HG ARG 31 4.447 -8.210 -5.672
219 HG3 ARG 31 2HG ARG 31 4.013 -9.905 -5.909
220 HD2 ARG 31 1HD ARG 31 6.396 -10.440 -6.240
221 HD3 ARG 31 2HD ARG 31 6.800 -8.751 -5.932
222 HE ARG 31 HE ARG 31 5.410 -9.473 -3.724
223 HH11 ARG 31 1HH1 ARG 31 8.153 -10.830 -5.383
224 HH12 ARG 31 2HH1 ARG 31 8.855 -11.500 -3.947
225 HH21 ARG 31 1HH2 ARG 31 6.324 -10.350 -1.827
226 HH22 ARG 31 2HH2 ARG 31 7.813 -11.227 -1.925
227 H THR 32 H THR 32 2.120 -8.803 -5.965
228 HA THR 32 HA THR 32 1.419 -11.525 -5.896
229 HB THR 32 HB THR 32 0.050 -10.999 -3.973
230 HG1 THR 32 HG1 THR 32 0.344 -8.294 -4.825
231 HG21 THR 32 3HG2 THR 32 1.682 -9.716 -2.609
232 HG22 THR 32 1HG2 THR 32 2.554 -9.314 -4.088
233 HG23 THR 32 2HG2 THR 32 2.431 -10.994 -3.565
234 H HIS 33 H HIS 33 -0.574 -8.650 -6.575
235 HA HIS 33 HA HIS 33 -2.995 -9.910 -7.032
236 HB2 HIS 33 1HB HIS 33 -1.864 -7.458 -8.396
237 HB3 HIS 33 2HB HIS 33 -3.555 -7.945 -8.451
238 HD1 HIS 33 HD1 HIS 33 -3.877 -8.682 -5.438
239 HD2 HIS 33 HD2 HIS 33 -2.116 -5.202 -6.868
240 HE1 HIS 33 HE1 HIS 33 -4.071 -7.013 -3.568
241 H THR 34 H THR 34 -0.374 -9.258 -9.333
242 HA THR 34 HA THR 34 -1.472 -11.363 -11.062
243 HB THR 34 HB THR 34 -2.149 -9.235 -12.059
244 HG1 THR 34 HG1 THR 34 -1.758 -10.536 -13.715
245 HG21 THR 34 3HG2 THR 34 -0.453 -7.656 -12.886
246 HG22 THR 34 1HG2 THR 34 0.806 -8.608 -12.101
247 HG23 THR 34 2HG2 THR 34 -0.418 -7.792 -11.128
248 H GLY 35 H GLY 35 0.008 -12.770 -11.807
249 HA2 GLY 35 1HA GLY 35 2.523 -12.477 -12.688
250 HA3 GLY 35 2HA GLY 35 2.760 -12.422 -10.947
251 H GLU 36 H GLU 36 1.044 -14.292 -10.004
252 HA GLU 36 HA GLU 36 2.413 -16.677 -10.320
253 HB2 GLU 36 1HB GLU 36 0.675 -15.945 -8.532
254 HB3 GLU 36 2HB GLU 36 -0.508 -16.649 -9.626
255 HG2 GLU 36 1HG GLU 36 1.866 -18.261 -8.837
256 HG3 GLU 36 2HG GLU 36 0.544 -18.055 -7.689
257 H LYS 37 H LYS 37 2.709 -17.621 -12.244
258 HA LYS 37 HA LYS 37 1.342 -17.541 -14.543
259 HB2 LYS 37 1HB LYS 37 2.793 -19.806 -13.230
260 HB3 LYS 37 2HB LYS 37 1.966 -20.086 -14.756
261 HG2 LYS 37 1HG LYS 37 3.280 -18.298 -15.791
262 HG3 LYS 37 2HG LYS 37 4.119 -18.038 -14.260
263 HD2 LYS 37 1HD LYS 37 4.089 -20.707 -15.647
264 HD3 LYS 37 2HD LYS 37 5.304 -19.475 -15.996
265 HE2 LYS 37 1HE LYS 37 4.776 -20.314 -13.174
266 HE3 LYS 37 2HE LYS 37 5.795 -21.306 -14.215
267 HZ1 LYS 37 3HZ LYS 37 6.453 -18.926 -12.853
268 HZ2 LYS 37 1HZ LYS 37 6.652 -18.687 -14.516
269 HZ3 LYS 37 2HZ LYS 37 7.462 -19.953 -13.741
270 HA PRO 38 HA PRO 38 -2.715 -19.141 -13.961
271 HB2 PRO 38 1HB PRO 38 -3.269 -19.887 -16.512
272 HB3 PRO 38 2HB PRO 38 -3.220 -18.197 -15.994
273 HG2 PRO 38 1HG PRO 38 -1.129 -19.806 -17.408
274 HG3 PRO 38 2HG PRO 38 -1.654 -18.140 -17.712
275 HD2 PRO 38 1HD PRO 38 0.601 -18.727 -16.333
276 HD3 PRO 38 2HD PRO 38 -0.383 -17.291 -15.987
277 H SER 39 H SER 39 -0.055 -21.043 -14.708
278 HA SER 39 HA SER 39 -1.611 -23.488 -14.232
279 HB2 SER 39 1HB SER 39 -1.183 -23.592 -16.574
280 HB3 SER 39 2HB SER 39 0.484 -23.057 -16.365
281 HG SER 39 HG SER 39 -0.313 -25.507 -16.517
282 H GLY 40 H GLY 40 -0.942 -24.304 -12.365
283 HA2 GLY 40 1HA GLY 40 1.707 -25.106 -11.881
284 HA3 GLY 40 2HA GLY 40 1.432 -23.582 -11.050
285 HA PRO 41 HA PRO 41 0.144 -27.088 -8.272
286 HB2 PRO 41 1HB PRO 41 1.551 -26.226 -6.116
287 HB3 PRO 41 2HB PRO 41 2.244 -27.275 -7.359
288 HG2 PRO 41 1HG PRO 41 2.503 -24.312 -7.021
289 HG3 PRO 41 2HG PRO 41 3.748 -25.504 -7.438
290 HD2 PRO 41 1HD PRO 41 2.554 -23.934 -9.293
291 HD3 PRO 41 2HD PRO 41 3.110 -25.581 -9.652
292 H SER 42 H SER 42 -0.155 -23.725 -8.428
293 HA SER 42 HA SER 42 -1.838 -23.565 -6.038
294 HB2 SER 42 1HB SER 42 -0.213 -21.774 -6.290
295 HB3 SER 42 2HB SER 42 -0.819 -21.410 -7.905
296 HG SER 42 HG SER 42 -2.661 -21.375 -5.820
297 H SER 43 H SER 43 -3.885 -24.139 -6.324
298 HA SER 43 HA SER 43 -5.178 -24.125 -8.863
299 HB2 SER 43 1HB SER 43 -7.180 -24.824 -7.607
300 HB3 SER 43 2HB SER 43 -5.765 -25.763 -7.131
301 HG SER 43 HG SER 43 -6.643 -25.166 -5.239
302 H GLY 44 H GLY 44 -5.564 -22.215 -9.817
303 HA2 GLY 44 1HA GLY 44 -7.358 -20.509 -9.894
304 HA3 GLY 44 2HA GLY 44 -6.972 -20.168 -8.214
Start of MODEL 4
1 H1 GLY 1 H GLY 1 -9.035 12.908 11.962
2 HA2 GLY 1 1HA GLY 1 -8.591 12.140 14.668
3 HA3 GLY 1 2HA GLY 1 -8.735 10.726 13.635
4 H SER 2 H SER 2 -6.412 11.383 15.074
5 HA SER 2 HA SER 2 -4.566 12.186 12.922
6 HB2 SER 2 1HB SER 2 -4.482 12.567 15.894
7 HB3 SER 2 2HB SER 2 -2.972 12.486 14.988
8 HG SER 2 HG SER 2 -3.883 14.180 13.639
9 H SER 3 H SER 3 -4.493 10.073 12.046
10 HA SER 3 HA SER 3 -2.933 8.177 13.675
11 HB2 SER 3 1HB SER 3 -5.352 7.734 11.991
12 HB3 SER 3 2HB SER 3 -4.117 6.476 11.995
13 HG SER 3 HG SER 3 -4.888 7.510 14.462
14 H GLY 4 H GLY 4 -1.724 10.111 12.091
15 HA2 GLY 4 1HA GLY 4 0.285 9.776 10.825
16 HA3 GLY 4 2HA GLY 4 -0.482 8.402 10.043
17 H SER 5 H SER 5 0.800 10.274 8.526
18 HA SER 5 HA SER 5 -1.073 12.237 7.553
19 HB2 SER 5 1HB SER 5 1.346 12.699 7.550
20 HB3 SER 5 2HB SER 5 1.600 11.362 6.428
21 HG SER 5 HG SER 5 0.077 12.556 5.025
22 H SER 6 H SER 6 -2.662 11.806 6.190
23 HA SER 6 HA SER 6 -2.275 9.684 4.187
24 HB2 SER 6 1HB SER 6 -3.754 8.855 5.972
25 HB3 SER 6 2HB SER 6 -4.821 10.238 5.731
26 HG SER 6 HG SER 6 -4.724 9.322 3.398
27 H GLY 7 H GLY 7 -1.782 11.188 2.582
28 HA2 GLY 7 1HA GLY 7 -3.913 13.113 1.913
29 HA3 GLY 7 2HA GLY 7 -2.234 13.254 1.414
30 H VAL 8 H VAL 8 -2.447 13.305 -0.762
31 HA VAL 8 HA VAL 8 -3.753 10.980 -2.022
32 HB VAL 8 HB VAL 8 -3.502 13.780 -3.128
33 HG11 VAL 8 1HG1 VAL 8 -4.938 12.891 -4.963
34 HG12 VAL 8 2HG1 VAL 8 -3.311 12.208 -4.926
35 HG13 VAL 8 3HG1 VAL 8 -4.676 11.272 -4.316
36 HG21 VAL 8 3HG2 VAL 8 -5.863 13.963 -2.858
37 HG22 VAL 8 1HG2 VAL 8 -5.999 12.269 -2.386
38 HG23 VAL 8 2HG2 VAL 8 -5.202 13.422 -1.315
39 H LYS 9 H LYS 9 -2.187 9.627 -2.629
40 HA LYS 9 HA LYS 9 0.367 10.662 -3.576
41 HB2 LYS 9 1HB LYS 9 -0.616 7.886 -2.922
42 HB3 LYS 9 2HB LYS 9 0.955 8.187 -3.653
43 HG2 LYS 9 1HG LYS 9 1.557 8.109 -1.464
44 HG3 LYS 9 2HG LYS 9 1.207 9.833 -1.608
45 HD2 LYS 9 1HD LYS 9 -1.141 9.284 -0.836
46 HD3 LYS 9 2HD LYS 9 -0.536 7.675 -0.436
47 HE2 LYS 9 1HE LYS 9 0.955 10.034 0.591
48 HE3 LYS 9 2HE LYS 9 -0.588 9.634 1.345
49 HZ1 LYS 9 3HZ LYS 9 1.873 8.476 1.845
50 HZ2 LYS 9 1HZ LYS 9 0.976 7.300 1.023
51 HZ3 LYS 9 2HZ LYS 9 0.369 7.985 2.445
52 HA PRO 10 HA PRO 10 -0.500 10.183 -7.857
53 HB2 PRO 10 1HB PRO 10 1.986 9.632 -8.798
54 HB3 PRO 10 2HB PRO 10 1.503 11.239 -8.244
55 HG2 PRO 10 1HG PRO 10 3.048 9.122 -6.798
56 HG3 PRO 10 2HG PRO 10 3.339 10.870 -6.867
57 HD2 PRO 10 1HD PRO 10 2.132 9.676 -4.757
58 HD3 PRO 10 2HD PRO 10 1.735 11.327 -5.276
59 H TYR 11 H TYR 11 0.995 7.616 -6.054
60 HA TYR 11 HA TYR 11 0.276 5.696 -8.167
61 HB2 TYR 11 1HB TYR 11 2.136 5.155 -5.855
62 HB3 TYR 11 2HB TYR 11 1.946 4.221 -7.335
63 HD1 TYR 11 HD1 TYR 11 2.822 5.123 -9.482
64 HD2 TYR 11 HD2 TYR 11 3.595 7.035 -5.760
65 HE1 TYR 11 HE1 TYR 11 4.666 6.380 -10.517
66 HE2 TYR 11 HE2 TYR 11 5.440 8.298 -6.785
67 HH TYR 11 HH TYR 11 7.035 7.760 -8.990
68 H GLY 12 H GLY 12 -1.638 4.791 -7.799
69 HA2 GLY 12 1HA GLY 12 -2.224 3.871 -5.058
70 HA3 GLY 12 2HA GLY 12 -3.443 4.720 -5.998
71 H CYS 13 H CYS 13 -2.208 1.721 -5.163
72 HA CYS 13 HA CYS 13 -2.438 0.086 -7.332
73 HB2 CYS 13 1HB CYS 13 -1.791 -0.893 -5.276
74 HB3 CYS 13 2HB CYS 13 -3.262 -0.362 -4.468
75 H SER 14 H SER 14 -4.011 -0.673 -8.624
76 HA SER 14 HA SER 14 -6.751 0.254 -8.088
77 HB2 SER 14 1HB SER 14 -5.353 0.843 -10.261
78 HB3 SER 14 2HB SER 14 -5.920 -0.744 -10.781
79 HG SER 14 HG SER 14 -7.806 0.980 -9.678
80 H GLU 15 H GLU 15 -5.905 -2.012 -6.743
81 HA GLU 15 HA GLU 15 -7.572 -4.065 -8.021
82 HB2 GLU 15 1HB GLU 15 -4.764 -4.308 -7.070
83 HB3 GLU 15 2HB GLU 15 -5.842 -5.660 -6.754
84 HG2 GLU 15 1HG GLU 15 -5.531 -4.477 -9.491
85 HG3 GLU 15 2HG GLU 15 -4.462 -5.739 -8.881
86 H CYS 16 H CYS 16 -5.985 -3.020 -5.020
87 HA CYS 16 HA CYS 16 -8.306 -4.068 -3.536
88 HB2 CYS 16 1HB CYS 16 -6.845 -4.518 -1.649
89 HB3 CYS 16 2HB CYS 16 -6.226 -5.337 -3.079
90 H GLY 17 H GLY 17 -5.757 -1.594 -3.570
91 HA2 GLY 17 1HA GLY 17 -6.637 0.736 -3.379
92 HA3 GLY 17 2HA GLY 17 -7.573 0.144 -2.014
93 H LYS 18 H LYS 18 -4.353 0.921 -3.166
94 HA LYS 18 HA LYS 18 -3.552 1.610 -0.473
95 HB2 LYS 18 1HB LYS 18 -2.149 -0.569 -2.027
96 HB3 LYS 18 2HB LYS 18 -1.455 0.236 -0.626
97 HG2 LYS 18 1HG LYS 18 -3.618 -0.511 0.577
98 HG3 LYS 18 2HG LYS 18 -3.770 -1.647 -0.766
99 HD2 LYS 18 1HD LYS 18 -1.759 -2.731 -0.216
100 HD3 LYS 18 2HD LYS 18 -1.236 -1.411 0.832
101 HE2 LYS 18 1HE LYS 18 -3.082 -1.949 2.377
102 HE3 LYS 18 2HE LYS 18 -3.530 -3.304 1.343
103 HZ1 LYS 18 3HZ LYS 18 -2.213 -4.149 3.104
104 HZ2 LYS 18 1HZ LYS 18 -1.019 -2.970 2.884
105 HZ3 LYS 18 2HZ LYS 18 -1.240 -4.177 1.720
106 H ALA 19 H ALA 19 -1.462 2.730 -0.424
107 HA ALA 19 HA ALA 19 -0.805 3.938 -3.033
108 HB1 ALA 19 3HB ALA 19 -1.835 5.216 -0.779
109 HB2 ALA 19 1HB ALA 19 -0.122 5.637 -0.807
110 HB3 ALA 19 2HB ALA 19 -1.137 5.975 -2.210
111 H PHE 20 H PHE 20 1.414 4.954 -3.048
112 HA PHE 20 HA PHE 20 3.364 3.839 -1.238
113 HB2 PHE 20 1HB PHE 20 3.629 3.118 -4.154
114 HB3 PHE 20 2HB PHE 20 4.575 2.517 -2.797
115 HD1 PHE 20 HD1 PHE 20 1.370 2.304 -4.559
116 HD2 PHE 20 HD2 PHE 20 3.756 0.753 -1.393
117 HE1 PHE 20 HE1 PHE 20 -0.152 0.381 -4.359
118 HE2 PHE 20 HE2 PHE 20 2.238 -1.172 -1.189
119 HZ PHE 20 HZ PHE 20 0.282 -1.361 -2.673
120 H ARG 21 H ARG 21 4.573 5.560 -0.823
121 HA ARG 21 HA ARG 21 4.732 7.924 -2.149
122 HB2 ARG 21 1HB ARG 21 6.699 8.415 -0.924
123 HB3 ARG 21 2HB ARG 21 5.765 7.319 0.086
124 HG2 ARG 21 1HG ARG 21 7.890 6.258 -1.728
125 HG3 ARG 21 2HG ARG 21 8.309 6.959 -0.163
126 HD2 ARG 21 1HD ARG 21 6.273 4.768 -0.513
127 HD3 ARG 21 2HD ARG 21 7.978 4.464 -0.185
128 HE ARG 21 HE ARG 21 7.337 6.108 1.818
129 HH11 ARG 21 1HH1 ARG 21 5.725 3.291 0.558
130 HH12 ARG 21 2HH1 ARG 21 5.031 2.847 2.081
131 HH21 ARG 21 1HH2 ARG 21 6.428 5.533 3.829
132 HH22 ARG 21 2HH2 ARG 21 5.430 4.123 3.941
133 H SER 22 H SER 22 6.349 4.949 -2.973
134 HA SER 22 HA SER 22 7.607 6.306 -5.268
135 HB2 SER 22 1HB SER 22 8.553 3.784 -3.884
136 HB3 SER 22 2HB SER 22 9.351 4.597 -5.230
137 HG SER 22 HG SER 22 10.182 5.982 -3.884
138 H LYS 23 H LYS 23 7.684 5.143 -7.260
139 HA LYS 23 HA LYS 23 5.272 3.776 -7.861
140 HB2 LYS 23 1HB LYS 23 6.214 3.526 -10.114
141 HB3 LYS 23 2HB LYS 23 6.403 5.169 -9.517
142 HG2 LYS 23 1HG LYS 23 8.696 4.935 -9.228
143 HG3 LYS 23 2HG LYS 23 8.613 3.172 -9.226
144 HD2 LYS 23 1HD LYS 23 8.335 3.065 -11.542
145 HD3 LYS 23 2HD LYS 23 7.840 4.756 -11.653
146 HE2 LYS 23 1HE LYS 23 10.105 5.464 -11.091
147 HE3 LYS 23 2HE LYS 23 10.603 3.780 -10.935
148 HZ1 LYS 23 3HZ LYS 23 10.458 3.439 -13.201
149 HZ2 LYS 23 1HZ LYS 23 11.068 5.015 -13.123
150 HZ3 LYS 23 2HZ LYS 23 9.430 4.758 -13.455
151 H SER 24 H SER 24 8.581 2.734 -7.276
152 HA SER 24 HA SER 24 8.395 0.094 -8.151
153 HB2 SER 24 1HB SER 24 10.247 -0.350 -6.512
154 HB3 SER 24 2HB SER 24 10.542 1.025 -7.575
155 HG SER 24 HG SER 24 11.000 1.394 -5.304
156 H TYR 25 H TYR 25 7.988 1.322 -4.826
157 HA TYR 25 HA TYR 25 7.323 -0.948 -3.497
158 HB2 TYR 25 1HB TYR 25 6.455 1.886 -3.227
159 HB3 TYR 25 2HB TYR 25 5.579 0.676 -2.296
160 HD1 TYR 25 HD1 TYR 25 7.465 -1.163 -1.307
161 HD2 TYR 25 HD2 TYR 25 7.985 3.013 -1.931
162 HE1 TYR 25 HE1 TYR 25 9.234 -1.134 0.402
163 HE2 TYR 25 HE2 TYR 25 9.756 3.053 -0.225
164 HH TYR 25 HH TYR 25 11.255 0.321 0.935
165 H LEU 26 H LEU 26 5.252 0.893 -5.666
166 HA LEU 26 HA LEU 26 2.861 -0.530 -5.116
167 HB2 LEU 26 1HB LEU 26 2.541 1.540 -6.117
168 HB3 LEU 26 2HB LEU 26 3.792 1.256 -7.326
169 HG LEU 26 HG LEU 26 2.224 -0.473 -8.329
170 HD11 LEU 26 1HD1 LEU 26 0.003 0.974 -6.984
171 HD12 LEU 26 2HD1 LEU 26 0.808 -0.332 -6.114
172 HD13 LEU 26 3HD1 LEU 26 0.045 -0.649 -7.672
173 HD21 LEU 26 3HD2 LEU 26 2.579 2.129 -8.875
174 HD22 LEU 26 1HD2 LEU 26 0.854 2.137 -8.507
175 HD23 LEU 26 2HD2 LEU 26 1.478 1.090 -9.782
176 H ILE 27 H ILE 27 5.286 -0.814 -7.699
177 HA ILE 27 HA ILE 27 4.151 -2.803 -9.222
178 HB ILE 27 HB ILE 27 7.081 -2.517 -8.547
179 HG12 ILE 27 1HG1 ILE 27 5.699 -1.504 -11.021
180 HG13 ILE 27 2HG1 ILE 27 5.778 -0.527 -9.559
181 HG21 ILE 27 1HG2 ILE 27 6.068 -3.669 -11.102
182 HG22 ILE 27 2HG2 ILE 27 7.600 -3.940 -10.272
183 HG23 ILE 27 3HG2 ILE 27 6.122 -4.685 -9.662
184 HD11 ILE 27 3HD1 ILE 27 7.716 0.227 -10.318
185 HD12 ILE 27 1HD1 ILE 27 8.383 -1.363 -9.949
186 HD13 ILE 27 2HD1 ILE 27 7.788 -1.012 -11.572
187 H ILE 28 H ILE 28 6.564 -3.378 -6.654
188 HA ILE 28 HA ILE 28 6.415 -6.126 -6.565
189 HB ILE 28 HB ILE 28 6.788 -4.312 -4.179
190 HG12 ILE 28 1HG1 ILE 28 9.279 -5.014 -4.813
191 HG13 ILE 28 2HG1 ILE 28 8.574 -5.128 -6.422
192 HG21 ILE 28 1HG2 ILE 28 7.274 -6.113 -2.956
193 HG22 ILE 28 2HG2 ILE 28 6.507 -7.050 -4.237
194 HG23 ILE 28 3HG2 ILE 28 8.255 -6.821 -4.239
195 HD11 ILE 28 3HD1 ILE 28 8.419 -2.910 -6.642
196 HD12 ILE 28 1HD1 ILE 28 7.911 -2.674 -4.970
197 HD13 ILE 28 2HD1 ILE 28 9.621 -2.879 -5.353
198 H HIS 29 H HIS 29 4.227 -3.766 -5.183
199 HA HIS 29 HA HIS 29 2.770 -5.661 -3.600
200 HB2 HIS 29 1HB HIS 29 2.700 -3.421 -2.831
201 HB3 HIS 29 2HB HIS 29 2.257 -2.807 -4.421
202 HD1 HIS 29 HD1 HIS 29 0.799 -4.689 -1.496
203 HD2 HIS 29 HD2 HIS 29 -0.446 -2.712 -4.931
204 HE1 HIS 29 HE1 HIS 29 -1.705 -4.533 -1.312
205 H MET 30 H MET 30 2.714 -4.643 -6.886
206 HA MET 30 HA MET 30 0.022 -5.658 -7.338
207 HB2 MET 30 1HB MET 30 2.035 -4.403 -9.210
208 HB3 MET 30 2HB MET 30 0.430 -4.935 -9.693
209 HG2 MET 30 1HG MET 30 0.904 -2.899 -7.537
210 HG3 MET 30 2HG MET 30 0.691 -2.480 -9.236
211 HE1 MET 30 3HE MET 30 -2.857 -3.895 -9.965
212 HE2 MET 30 1HE MET 30 -1.939 -2.459 -10.419
213 HE3 MET 30 2HE MET 30 -1.178 -4.048 -10.485
214 H ARG 31 H ARG 31 3.252 -6.233 -8.747
215 HA ARG 31 HA ARG 31 2.869 -8.359 -10.323
216 HB2 ARG 31 1HB ARG 31 5.096 -9.217 -9.631
217 HB3 ARG 31 2HB ARG 31 5.085 -7.486 -9.939
218 HG2 ARG 31 1HG ARG 31 6.269 -7.509 -8.005
219 HG3 ARG 31 2HG ARG 31 4.640 -7.391 -7.335
220 HD2 ARG 31 1HD ARG 31 4.643 -9.550 -6.587
221 HD3 ARG 31 2HD ARG 31 5.736 -10.101 -7.856
222 HE ARG 31 HE ARG 31 6.917 -8.336 -5.892
223 HH11 ARG 31 1HH1 ARG 31 6.266 -11.623 -6.837
224 HH12 ARG 31 2HH1 ARG 31 7.543 -12.290 -5.876
225 HH21 ARG 31 1HH2 ARG 31 8.602 -9.203 -4.622
226 HH22 ARG 31 2HH2 ARG 31 8.871 -10.913 -4.615
227 H THR 32 H THR 32 2.687 -8.402 -6.825
228 HA THR 32 HA THR 32 2.541 -11.248 -6.584
229 HB THR 32 HB THR 32 3.299 -9.920 -4.693
230 HG1 THR 32 HG1 THR 32 1.489 -10.722 -3.176
231 HG21 THR 32 3HG2 THR 32 2.124 -8.229 -3.691
232 HG22 THR 32 1HG2 THR 32 0.558 -8.901 -4.141
233 HG23 THR 32 2HG2 THR 32 1.532 -8.055 -5.343
234 H HIS 33 H HIS 33 0.155 -8.623 -6.569
235 HA HIS 33 HA HIS 33 -2.149 -9.920 -5.937
236 HB2 HIS 33 1HB HIS 33 -1.521 -7.696 -7.816
237 HB3 HIS 33 2HB HIS 33 -3.136 -8.395 -7.890
238 HD1 HIS 33 HD1 HIS 33 -3.633 -8.847 -4.885
239 HD2 HIS 33 HD2 HIS 33 -2.019 -5.371 -6.490
240 HE1 HIS 33 HE1 HIS 33 -4.100 -7.046 -3.194
241 H THR 34 H THR 34 -0.933 -9.625 -9.281
242 HA THR 34 HA THR 34 -2.402 -12.099 -9.923
243 HB THR 34 HB THR 34 -2.333 -11.256 -12.312
244 HG1 THR 34 HG1 THR 34 -2.149 -8.854 -12.341
245 HG21 THR 34 3HG2 THR 34 -3.927 -9.182 -11.115
246 HG22 THR 34 1HG2 THR 34 -4.104 -10.685 -10.211
247 HG23 THR 34 2HG2 THR 34 -4.446 -10.650 -11.941
248 H GLY 35 H GLY 35 0.397 -10.188 -11.060
249 HA2 GLY 35 1HA GLY 35 2.407 -10.859 -11.956
250 HA3 GLY 35 2HA GLY 35 2.359 -12.080 -10.693
251 H GLU 36 H GLU 36 1.193 -11.394 -13.975
252 HA GLU 36 HA GLU 36 1.599 -14.233 -14.610
253 HB2 GLU 36 1HB GLU 36 -0.436 -14.218 -15.996
254 HB3 GLU 36 2HB GLU 36 -0.794 -13.932 -14.299
255 HG2 GLU 36 1HG GLU 36 -0.985 -11.537 -14.741
256 HG3 GLU 36 2HG GLU 36 -0.633 -11.827 -16.444
257 H LYS 37 H LYS 37 3.425 -12.190 -15.099
258 HA LYS 37 HA LYS 37 3.284 -11.975 -18.034
259 HB2 LYS 37 1HB LYS 37 2.988 -9.778 -16.933
260 HB3 LYS 37 2HB LYS 37 4.540 -9.987 -16.133
261 HG2 LYS 37 1HG LYS 37 4.889 -8.557 -17.988
262 HG3 LYS 37 2HG LYS 37 5.593 -10.123 -18.400
263 HD2 LYS 37 1HD LYS 37 4.439 -9.556 -20.332
264 HD3 LYS 37 2HD LYS 37 3.292 -10.599 -19.489
265 HE2 LYS 37 1HE LYS 37 2.241 -8.535 -18.545
266 HE3 LYS 37 2HE LYS 37 3.294 -7.586 -19.593
267 HZ1 LYS 37 3HZ LYS 37 0.850 -8.435 -20.278
268 HZ2 LYS 37 1HZ LYS 37 1.802 -9.671 -20.931
269 HZ3 LYS 37 2HZ LYS 37 2.070 -8.066 -21.391
270 HA PRO 38 HA PRO 38 7.015 -14.452 -16.900
271 HB2 PRO 38 1HB PRO 38 6.744 -16.205 -18.955
272 HB3 PRO 38 2HB PRO 38 5.915 -16.404 -17.407
273 HG2 PRO 38 1HG PRO 38 4.870 -15.300 -19.986
274 HG3 PRO 38 2HG PRO 38 4.090 -16.414 -18.848
275 HD2 PRO 38 1HD PRO 38 3.516 -13.769 -18.923
276 HD3 PRO 38 2HD PRO 38 3.461 -14.715 -17.422
277 H SER 39 H SER 39 5.945 -12.665 -19.624
278 HA SER 39 HA SER 39 7.684 -12.914 -21.626
279 HB2 SER 39 1HB SER 39 5.973 -11.043 -21.240
280 HB3 SER 39 2HB SER 39 7.274 -10.179 -20.421
281 HG SER 39 HG SER 39 7.296 -11.112 -23.103
282 H GLY 40 H GLY 40 9.786 -13.341 -21.668
283 HA2 GLY 40 1HA GLY 40 11.916 -11.894 -21.275
284 HA3 GLY 40 2HA GLY 40 11.518 -12.199 -19.591
285 HA PRO 41 HA PRO 41 12.742 -16.445 -21.606
286 HB2 PRO 41 1HB PRO 41 14.066 -16.271 -23.969
287 HB3 PRO 41 2HB PRO 41 12.309 -16.434 -23.862
288 HG2 PRO 41 1HG PRO 41 13.961 -13.976 -24.299
289 HG3 PRO 41 2HG PRO 41 12.460 -14.472 -25.103
290 HD2 PRO 41 1HD PRO 41 12.508 -12.640 -23.110
291 HD3 PRO 41 2HD PRO 41 11.138 -13.740 -23.362
292 H SER 42 H SER 42 14.780 -13.615 -22.166
293 HA SER 42 HA SER 42 17.215 -15.071 -21.609
294 HB2 SER 42 1HB SER 42 16.691 -12.123 -22.054
295 HB3 SER 42 2HB SER 42 18.293 -12.828 -21.834
296 HG SER 42 HG SER 42 16.921 -12.620 -24.072
297 H SER 43 H SER 43 15.401 -12.431 -20.052
298 HA SER 43 HA SER 43 17.019 -12.299 -17.746
299 HB2 SER 43 1HB SER 43 15.050 -11.091 -16.745
300 HB3 SER 43 2HB SER 43 15.594 -10.438 -18.290
301 HG SER 43 HG SER 43 13.187 -11.077 -17.747
302 H GLY 44 H GLY 44 13.931 -13.952 -18.367
303 HA2 GLY 44 1HA GLY 44 13.493 -15.003 -15.831
304 HA3 GLY 44 2HA GLY 44 12.948 -15.746 -17.327
Start of MODEL 5
1 H1 GLY 1 H GLY 1 -15.940 3.813 2.537
2 HA2 GLY 1 1HA GLY 1 -17.591 4.915 0.844
3 HA3 GLY 1 2HA GLY 1 -18.189 5.684 2.306
4 H SER 2 H SER 2 -15.570 5.501 0.017
5 HA SER 2 HA SER 2 -14.475 7.986 1.160
6 HB2 SER 2 1HB SER 2 -12.873 5.836 -0.244
7 HB3 SER 2 2HB SER 2 -12.243 7.292 0.524
8 HG SER 2 HG SER 2 -13.502 6.250 2.439
9 H SER 3 H SER 3 -15.375 9.458 -0.186
10 HA SER 3 HA SER 3 -14.542 9.349 -2.988
11 HB2 SER 3 1HB SER 3 -17.390 9.711 -2.043
12 HB3 SER 3 2HB SER 3 -16.848 10.161 -3.659
13 HG SER 3 HG SER 3 -17.350 8.146 -4.058
14 H GLY 4 H GLY 4 -14.279 11.362 -3.968
15 HA2 GLY 4 1HA GLY 4 -14.916 13.809 -3.728
16 HA3 GLY 4 2HA GLY 4 -14.331 13.631 -2.080
17 H SER 5 H SER 5 -12.189 13.817 -1.666
18 HA SER 5 HA SER 5 -10.532 15.138 -3.466
19 HB2 SER 5 1HB SER 5 -10.353 14.821 -0.871
20 HB3 SER 5 2HB SER 5 -9.358 13.429 -1.298
21 HG SER 5 HG SER 5 -8.802 15.843 -2.572
22 H SER 6 H SER 6 -8.892 14.517 -4.826
23 HA SER 6 HA SER 6 -9.048 11.801 -5.818
24 HB2 SER 6 1HB SER 6 -7.727 12.576 -7.672
25 HB3 SER 6 2HB SER 6 -8.936 13.813 -7.328
26 HG SER 6 HG SER 6 -7.348 15.007 -6.263
27 H GLY 7 H GLY 7 -8.126 11.443 -3.401
28 HA2 GLY 7 1HA GLY 7 -6.385 10.661 -2.120
29 HA3 GLY 7 2HA GLY 7 -5.738 10.084 -3.649
30 H VAL 8 H VAL 8 -3.882 10.668 -1.903
31 HA VAL 8 HA VAL 8 -2.823 13.258 -2.814
32 HB VAL 8 HB VAL 8 -1.757 13.582 -0.613
33 HG11 VAL 8 1HG1 VAL 8 -3.548 14.680 0.234
34 HG12 VAL 8 2HG1 VAL 8 -4.248 14.252 -1.329
35 HG13 VAL 8 3HG1 VAL 8 -4.611 13.280 0.098
36 HG21 VAL 8 3HG2 VAL 8 -2.749 10.902 -0.191
37 HG22 VAL 8 1HG2 VAL 8 -1.562 11.821 0.734
38 HG23 VAL 8 2HG2 VAL 8 -3.281 11.990 1.091
39 H LYS 9 H LYS 9 -2.357 10.613 -3.863
40 HA LYS 9 HA LYS 9 0.546 10.513 -3.480
41 HB2 LYS 9 1HB LYS 9 0.469 8.027 -3.506
42 HB3 LYS 9 2HB LYS 9 -0.274 8.733 -2.077
43 HG2 LYS 9 1HG LYS 9 -1.967 8.034 -4.433
44 HG3 LYS 9 2HG LYS 9 -1.439 6.772 -3.317
45 HD2 LYS 9 1HD LYS 9 -2.686 7.597 -1.579
46 HD3 LYS 9 2HD LYS 9 -2.634 9.254 -2.186
47 HE2 LYS 9 1HE LYS 9 -4.872 8.430 -2.423
48 HE3 LYS 9 2HE LYS 9 -4.154 8.560 -4.028
49 HZ1 LYS 9 3HZ LYS 9 -5.078 6.495 -4.145
50 HZ2 LYS 9 1HZ LYS 9 -4.870 6.165 -2.499
51 HZ3 LYS 9 2HZ LYS 9 -3.551 6.072 -3.554
52 HA PRO 10 HA PRO 10 0.592 10.418 -7.880
53 HB2 PRO 10 1HB PRO 10 3.065 9.366 -8.269
54 HB3 PRO 10 2HB PRO 10 2.802 11.027 -7.722
55 HG2 PRO 10 1HG PRO 10 3.494 8.593 -6.122
56 HG3 PRO 10 2HG PRO 10 4.143 10.238 -5.993
57 HD2 PRO 10 1HD PRO 10 2.251 9.282 -4.308
58 HD3 PRO 10 2HD PRO 10 2.334 10.991 -4.780
59 H TYR 11 H TYR 11 1.186 7.527 -6.006
60 HA TYR 11 HA TYR 11 0.187 5.921 -8.260
61 HB2 TYR 11 1HB TYR 11 2.233 4.874 -6.313
62 HB3 TYR 11 2HB TYR 11 1.755 4.198 -7.867
63 HD1 TYR 11 HD1 TYR 11 2.488 5.314 -9.971
64 HD2 TYR 11 HD2 TYR 11 3.938 6.525 -6.159
65 HE1 TYR 11 HE1 TYR 11 4.353 6.489 -11.061
66 HE2 TYR 11 HE2 TYR 11 5.807 7.704 -7.238
67 HH TYR 11 HH TYR 11 6.072 7.890 -10.765
68 H GLY 12 H GLY 12 -1.265 4.324 -7.764
69 HA2 GLY 12 1HA GLY 12 -1.757 3.579 -5.007
70 HA3 GLY 12 2HA GLY 12 -3.037 4.526 -5.750
71 H CYS 13 H CYS 13 -2.522 1.565 -4.866
72 HA CYS 13 HA CYS 13 -3.090 0.128 -7.308
73 HB2 CYS 13 1HB CYS 13 -1.716 -0.750 -5.335
74 HB3 CYS 13 2HB CYS 13 -3.254 -0.979 -4.509
75 H SER 14 H SER 14 -5.055 0.218 -8.165
76 HA SER 14 HA SER 14 -7.382 0.855 -6.615
77 HB2 SER 14 1HB SER 14 -6.954 1.490 -9.056
78 HB3 SER 14 2HB SER 14 -7.376 -0.176 -9.452
79 HG SER 14 HG SER 14 -8.985 1.896 -8.494
80 H GLU 15 H GLU 15 -6.070 -2.051 -8.130
81 HA GLU 15 HA GLU 15 -8.054 -3.855 -8.057
82 HB2 GLU 15 1HB GLU 15 -5.236 -4.236 -7.044
83 HB3 GLU 15 2HB GLU 15 -6.357 -5.563 -7.313
84 HG2 GLU 15 1HG GLU 15 -5.202 -3.687 -9.353
85 HG3 GLU 15 2HG GLU 15 -4.950 -5.426 -9.211
86 H CYS 16 H CYS 16 -6.045 -3.163 -5.190
87 HA CYS 16 HA CYS 16 -8.209 -4.235 -3.513
88 HB2 CYS 16 1HB CYS 16 -6.491 -4.466 -1.756
89 HB3 CYS 16 2HB CYS 16 -6.068 -5.361 -3.212
90 H GLY 17 H GLY 17 -5.990 -1.501 -3.872
91 HA2 GLY 17 1HA GLY 17 -6.911 0.733 -3.521
92 HA3 GLY 17 2HA GLY 17 -7.824 0.071 -2.172
93 H LYS 18 H LYS 18 -4.508 0.654 -3.295
94 HA LYS 18 HA LYS 18 -3.791 1.375 -0.544
95 HB2 LYS 18 1HB LYS 18 -2.317 -0.567 -2.320
96 HB3 LYS 18 2HB LYS 18 -1.555 0.225 -0.947
97 HG2 LYS 18 1HG LYS 18 -3.443 -0.736 0.457
98 HG3 LYS 18 2HG LYS 18 -3.817 -1.746 -0.942
99 HD2 LYS 18 1HD LYS 18 -1.531 -2.638 -0.895
100 HD3 LYS 18 2HD LYS 18 -1.175 -1.640 0.516
101 HE2 LYS 18 1HE LYS 18 -2.789 -2.827 1.834
102 HE3 LYS 18 2HE LYS 18 -3.360 -3.714 0.422
103 HZ1 LYS 18 3HZ LYS 18 -0.653 -4.191 0.552
104 HZ2 LYS 18 1HZ LYS 18 -1.894 -5.270 0.950
105 HZ3 LYS 18 2HZ LYS 18 -1.190 -4.310 2.151
106 H ALA 19 H ALA 19 -1.364 2.247 -0.658
107 HA ALA 19 HA ALA 19 -0.991 3.862 -3.071
108 HB1 ALA 19 3HB ALA 19 -2.272 5.299 -1.619
109 HB2 ALA 19 1HB ALA 19 -1.158 5.001 -0.284
110 HB3 ALA 19 2HB ALA 19 -0.613 5.890 -1.707
111 H PHE 20 H PHE 20 1.146 4.757 -3.279
112 HA PHE 20 HA PHE 20 3.178 3.807 -1.427
113 HB2 PHE 20 1HB PHE 20 3.503 3.179 -4.353
114 HB3 PHE 20 2HB PHE 20 4.418 2.548 -2.987
115 HD1 PHE 20 HD1 PHE 20 1.085 2.487 -4.603
116 HD2 PHE 20 HD2 PHE 20 3.787 0.558 -1.940
117 HE1 PHE 20 HE1 PHE 20 -0.398 0.524 -4.525
118 HE2 PHE 20 HE2 PHE 20 2.310 -1.408 -1.859
119 HZ PHE 20 HZ PHE 20 0.215 -1.427 -3.153
120 H ARG 21 H ARG 21 4.251 5.611 -0.978
121 HA ARG 21 HA ARG 21 4.282 8.006 -2.194
122 HB2 ARG 21 1HB ARG 21 5.431 7.727 -0.116
123 HB3 ARG 21 2HB ARG 21 6.582 6.607 -0.833
124 HG2 ARG 21 1HG ARG 21 7.684 8.690 -0.523
125 HG3 ARG 21 2HG ARG 21 7.410 8.481 -2.254
126 HD2 ARG 21 1HD ARG 21 6.892 10.754 -1.608
127 HD3 ARG 21 2HD ARG 21 5.417 9.916 -2.088
128 HE ARG 21 HE ARG 21 5.779 9.712 0.704
129 HH11 ARG 21 1HH1 ARG 21 4.907 12.001 -1.770
130 HH12 ARG 21 2HH1 ARG 21 3.927 12.965 -0.715
131 HH21 ARG 21 1HH2 ARG 21 4.492 10.972 2.102
132 HH22 ARG 21 2HH2 ARG 21 3.692 12.379 1.487
133 H SER 22 H SER 22 6.326 5.262 -3.091
134 HA SER 22 HA SER 22 7.160 6.748 -5.494
135 HB2 SER 22 1HB SER 22 9.172 5.489 -5.537
136 HB3 SER 22 2HB SER 22 8.945 5.949 -3.850
137 HG SER 22 HG SER 22 9.020 3.476 -4.975
138 H LYS 23 H LYS 23 7.672 5.236 -7.382
139 HA LYS 23 HA LYS 23 5.287 3.748 -7.970
140 HB2 LYS 23 1HB LYS 23 6.379 5.122 -9.683
141 HB3 LYS 23 2HB LYS 23 7.820 4.119 -9.579
142 HG2 LYS 23 1HG LYS 23 6.835 2.351 -10.673
143 HG3 LYS 23 2HG LYS 23 5.200 2.860 -10.243
144 HD2 LYS 23 1HD LYS 23 5.243 3.450 -12.458
145 HD3 LYS 23 2HD LYS 23 5.819 4.948 -11.723
146 HE2 LYS 23 1HE LYS 23 7.960 4.647 -12.461
147 HE3 LYS 23 2HE LYS 23 7.834 2.888 -12.445
148 HZ1 LYS 23 3HZ LYS 23 7.076 4.788 -14.534
149 HZ2 LYS 23 1HZ LYS 23 6.130 3.395 -14.367
150 HZ3 LYS 23 2HZ LYS 23 7.788 3.260 -14.670
151 H SER 24 H SER 24 8.749 2.911 -7.826
152 HA SER 24 HA SER 24 8.720 0.259 -8.348
153 HB2 SER 24 1HB SER 24 10.279 1.772 -6.257
154 HB3 SER 24 2HB SER 24 10.555 0.057 -6.565
155 HG SER 24 HG SER 24 10.643 0.993 -8.905
156 H TYR 25 H TYR 25 7.958 1.714 -5.197
157 HA TYR 25 HA TYR 25 7.549 -0.557 -3.698
158 HB2 TYR 25 1HB TYR 25 6.442 2.204 -3.626
159 HB3 TYR 25 2HB TYR 25 5.632 0.984 -2.649
160 HD1 TYR 25 HD1 TYR 25 7.740 -0.658 -1.603
161 HD2 TYR 25 HD2 TYR 25 7.716 3.548 -2.248
162 HE1 TYR 25 HE1 TYR 25 9.442 -0.385 0.152
163 HE2 TYR 25 HE2 TYR 25 9.419 3.832 -0.496
164 HH TYR 25 HH TYR 25 10.057 2.139 1.739
165 H LEU 26 H LEU 26 5.221 1.096 -5.807
166 HA LEU 26 HA LEU 26 2.970 -0.424 -5.295
167 HB2 LEU 26 1HB LEU 26 2.859 1.546 -6.658
168 HB3 LEU 26 2HB LEU 26 3.911 0.820 -7.871
169 HG LEU 26 HG LEU 26 2.135 -0.803 -8.405
170 HD11 LEU 26 1HD1 LEU 26 -0.083 -0.557 -7.513
171 HD12 LEU 26 2HD1 LEU 26 0.415 0.833 -6.549
172 HD13 LEU 26 3HD1 LEU 26 1.051 -0.770 -6.179
173 HD21 LEU 26 3HD2 LEU 26 1.012 0.619 -9.808
174 HD22 LEU 26 1HD2 LEU 26 2.397 1.622 -9.376
175 HD23 LEU 26 2HD2 LEU 26 0.843 1.875 -8.581
176 H ILE 27 H ILE 27 5.330 -0.965 -7.916
177 HA ILE 27 HA ILE 27 4.334 -3.293 -8.965
178 HB ILE 27 HB ILE 27 7.257 -2.652 -8.555
179 HG12 ILE 27 1HG1 ILE 27 5.644 -2.176 -11.052
180 HG13 ILE 27 2HG1 ILE 27 5.737 -0.964 -9.779
181 HG21 ILE 27 1HG2 ILE 27 6.070 -4.992 -9.504
182 HG22 ILE 27 2HG2 ILE 27 6.615 -4.129 -10.941
183 HG23 ILE 27 3HG2 ILE 27 7.761 -4.515 -9.657
184 HD11 ILE 27 3HD1 ILE 27 8.180 -2.133 -11.068
185 HD12 ILE 27 1HD1 ILE 27 7.345 -0.719 -11.710
186 HD13 ILE 27 2HD1 ILE 27 8.046 -0.670 -10.092
187 H ILE 28 H ILE 28 6.818 -3.111 -6.408
188 HA ILE 28 HA ILE 28 7.186 -5.731 -5.824
189 HB ILE 28 HB ILE 28 6.873 -3.518 -3.792
190 HG12 ILE 28 1HG1 ILE 28 9.368 -4.626 -5.096
191 HG13 ILE 28 2HG1 ILE 28 8.574 -3.130 -5.577
192 HG21 ILE 28 1HG2 ILE 28 6.742 -5.571 -2.619
193 HG22 ILE 28 2HG2 ILE 28 8.041 -6.281 -3.576
194 HG23 ILE 28 3HG2 ILE 28 8.396 -4.993 -2.426
195 HD11 ILE 28 3HD1 ILE 28 10.430 -2.589 -4.189
196 HD12 ILE 28 1HD1 ILE 28 8.955 -2.270 -3.278
197 HD13 ILE 28 2HD1 ILE 28 9.899 -3.722 -2.947
198 H HIS 29 H HIS 29 4.303 -3.894 -5.297
199 HA HIS 29 HA HIS 29 3.132 -6.001 -3.639
200 HB2 HIS 29 1HB HIS 29 2.658 -3.866 -2.750
201 HB3 HIS 29 2HB HIS 29 2.275 -3.199 -4.334
202 HD1 HIS 29 HD1 HIS 29 0.860 -5.732 -1.882
203 HD2 HIS 29 HD2 HIS 29 -0.378 -3.164 -4.904
204 HE1 HIS 29 HE1 HIS 29 -1.652 -5.858 -1.885
205 H MET 30 H MET 30 2.875 -4.524 -6.806
206 HA MET 30 HA MET 30 0.446 -5.762 -7.577
207 HB2 MET 30 1HB MET 30 2.713 -4.770 -9.315
208 HB3 MET 30 2HB MET 30 1.081 -5.132 -9.861
209 HG2 MET 30 1HG MET 30 0.463 -3.371 -7.983
210 HG3 MET 30 2HG MET 30 2.101 -2.817 -8.321
211 HE1 MET 30 3HE MET 30 -0.981 -3.517 -11.559
212 HE2 MET 30 1HE MET 30 -0.862 -4.298 -9.981
213 HE3 MET 30 2HE MET 30 -1.710 -2.760 -10.142
214 H ARG 31 H ARG 31 3.801 -6.759 -7.660
215 HA ARG 31 HA ARG 31 3.834 -8.801 -9.465
216 HB2 ARG 31 1HB ARG 31 5.588 -9.823 -8.166
217 HB3 ARG 31 2HB ARG 31 5.758 -8.075 -8.066
218 HG2 ARG 31 1HG ARG 31 4.630 -8.138 -5.862
219 HG3 ARG 31 2HG ARG 31 4.614 -9.900 -5.964
220 HD2 ARG 31 1HD ARG 31 7.172 -8.376 -6.272
221 HD3 ARG 31 2HD ARG 31 6.523 -8.720 -4.669
222 HE ARG 31 HE ARG 31 7.045 -10.949 -4.955
223 HH11 ARG 31 1HH1 ARG 31 7.481 -9.220 -7.945
224 HH12 ARG 31 2HH1 ARG 31 8.313 -10.522 -8.728
225 HH21 ARG 31 1HH2 ARG 31 8.140 -12.670 -5.975
226 HH22 ARG 31 2HH2 ARG 31 8.687 -12.484 -7.607
227 H THR 32 H THR 32 2.285 -8.764 -6.327
228 HA THR 32 HA THR 32 1.701 -11.584 -6.327
229 HB THR 32 HB THR 32 0.342 -11.110 -4.336
230 HG1 THR 32 HG1 THR 32 1.126 -8.414 -4.382
231 HG21 THR 32 3HG2 THR 32 2.114 -10.585 -2.889
232 HG22 THR 32 1HG2 THR 32 2.888 -9.534 -4.074
233 HG23 THR 32 2HG2 THR 32 2.903 -11.283 -4.303
234 H HIS 33 H HIS 33 -0.258 -8.623 -6.654
235 HA HIS 33 HA HIS 33 -2.740 -9.674 -7.052
236 HB2 HIS 33 1HB HIS 33 -1.353 -7.259 -8.106
237 HB3 HIS 33 2HB HIS 33 -2.891 -7.699 -8.843
238 HD1 HIS 33 HD1 HIS 33 -4.379 -8.636 -6.293
239 HD2 HIS 33 HD2 HIS 33 -2.146 -5.144 -6.574
240 HE1 HIS 33 HE1 HIS 33 -5.277 -7.118 -4.500
241 H THR 34 H THR 34 -0.401 -9.025 -9.668
242 HA THR 34 HA THR 34 -1.859 -10.966 -11.334
243 HB THR 34 HB THR 34 -1.842 -8.865 -12.441
244 HG1 THR 34 HG1 THR 34 0.380 -10.189 -13.605
245 HG21 THR 34 3HG2 THR 34 -0.318 -7.359 -11.801
246 HG22 THR 34 1HG2 THR 34 0.797 -8.152 -12.913
247 HG23 THR 34 2HG2 THR 34 0.776 -8.609 -11.210
248 H GLY 35 H GLY 35 -0.714 -12.533 -12.508
249 HA2 GLY 35 1HA GLY 35 1.015 -13.977 -12.995
250 HA3 GLY 35 2HA GLY 35 2.130 -12.768 -12.375
251 H GLU 36 H GLU 36 -0.532 -14.501 -10.779
252 HA GLU 36 HA GLU 36 1.451 -15.610 -8.902
253 HB2 GLU 36 1HB GLU 36 -0.609 -15.528 -7.279
254 HB3 GLU 36 2HB GLU 36 0.383 -14.099 -7.530
255 HG2 GLU 36 1HG GLU 36 -1.220 -13.090 -8.908
256 HG3 GLU 36 2HG GLU 36 -2.099 -14.601 -9.133
257 H LYS 37 H LYS 37 1.321 -17.372 -10.578
258 HA LYS 37 HA LYS 37 -0.932 -19.173 -9.964
259 HB2 LYS 37 1HB LYS 37 0.632 -18.884 -12.534
260 HB3 LYS 37 2HB LYS 37 -0.498 -20.193 -12.217
261 HG2 LYS 37 1HG LYS 37 -2.230 -18.363 -11.805
262 HG3 LYS 37 2HG LYS 37 -1.070 -17.272 -12.567
263 HD2 LYS 37 1HD LYS 37 -2.314 -17.903 -14.390
264 HD3 LYS 37 2HD LYS 37 -1.042 -19.125 -14.432
265 HE2 LYS 37 1HE LYS 37 -3.196 -20.174 -14.756
266 HE3 LYS 37 2HE LYS 37 -2.521 -20.667 -13.204
267 HZ1 LYS 37 3HZ LYS 37 -4.106 -19.554 -12.056
268 HZ2 LYS 37 1HZ LYS 37 -5.003 -19.848 -13.459
269 HZ3 LYS 37 2HZ LYS 37 -4.280 -18.338 -13.219
270 HA PRO 38 HA PRO 38 3.001 -21.116 -8.449
271 HB2 PRO 38 1HB PRO 38 1.949 -21.955 -6.091
272 HB3 PRO 38 2HB PRO 38 2.641 -20.344 -6.315
273 HG2 PRO 38 1HG PRO 38 -0.229 -21.194 -6.351
274 HG3 PRO 38 2HG PRO 38 0.507 -19.771 -5.591
275 HD2 PRO 38 1HD PRO 38 -0.794 -19.646 -7.962
276 HD3 PRO 38 2HD PRO 38 0.583 -18.595 -7.572
277 H SER 39 H SER 39 -0.108 -22.082 -9.321
278 HA SER 39 HA SER 39 0.721 -24.905 -9.302
279 HB2 SER 39 1HB SER 39 -1.658 -25.529 -8.894
280 HB3 SER 39 2HB SER 39 -0.937 -24.648 -7.547
281 HG SER 39 HG SER 39 -2.390 -23.166 -7.810
282 H GLY 40 H GLY 40 -0.786 -26.209 -10.825
283 HA2 GLY 40 1HA GLY 40 -0.997 -24.666 -13.330
284 HA3 GLY 40 2HA GLY 40 -0.669 -26.390 -13.238
285 HA PRO 41 HA PRO 41 -4.935 -27.105 -14.003
286 HB2 PRO 41 1HB PRO 41 -5.143 -29.624 -13.012
287 HB3 PRO 41 2HB PRO 41 -4.327 -29.255 -14.537
288 HG2 PRO 41 1HG PRO 41 -3.151 -29.735 -11.826
289 HG3 PRO 41 2HG PRO 41 -2.605 -30.331 -13.404
290 HD2 PRO 41 1HD PRO 41 -1.446 -28.222 -12.164
291 HD3 PRO 41 2HD PRO 41 -1.555 -28.348 -13.931
292 H SER 42 H SER 42 -6.966 -27.534 -12.927
293 HA SER 42 HA SER 42 -7.183 -27.876 -10.128
294 HB2 SER 42 1HB SER 42 -6.298 -25.594 -10.050
295 HB3 SER 42 2HB SER 42 -7.570 -25.049 -11.143
296 HG SER 42 HG SER 42 -8.063 -26.242 -8.618
297 H SER 43 H SER 43 -9.455 -27.492 -9.365
298 HA SER 43 HA SER 43 -11.367 -27.784 -11.587
299 HB2 SER 43 1HB SER 43 -12.632 -29.378 -10.176
300 HB3 SER 43 2HB SER 43 -11.006 -29.959 -10.535
301 HG SER 43 HG SER 43 -10.927 -30.189 -8.439
302 H GLY 44 H GLY 44 -11.382 -27.312 -8.045
303 HA2 GLY 44 1HA GLY 44 -12.199 -25.430 -6.897
304 HA3 GLY 44 2HA GLY 44 -12.909 -24.852 -8.397
Start of MODEL 6
1 H1 GLY 1 H GLY 1 -11.394 4.182 -4.983
2 HA2 GLY 1 1HA GLY 1 -9.698 4.613 -7.307
3 HA3 GLY 1 2HA GLY 1 -11.201 3.756 -7.612
4 H SER 2 H SER 2 -9.818 6.784 -6.463
5 HA SER 2 HA SER 2 -11.881 8.306 -7.713
6 HB2 SER 2 1HB SER 2 -13.054 7.569 -5.639
7 HB3 SER 2 2HB SER 2 -11.806 8.373 -4.687
8 HG SER 2 HG SER 2 -12.422 10.329 -5.814
9 H SER 3 H SER 3 -11.299 10.431 -7.990
10 HA SER 3 HA SER 3 -8.890 11.379 -6.607
11 HB2 SER 3 1HB SER 3 -8.389 10.397 -8.923
12 HB3 SER 3 2HB SER 3 -9.262 11.785 -9.573
13 HG SER 3 HG SER 3 -7.402 12.747 -9.396
14 H GLY 4 H GLY 4 -9.153 13.358 -5.808
15 HA2 GLY 4 1HA GLY 4 -10.463 15.463 -7.195
16 HA3 GLY 4 2HA GLY 4 -11.517 14.801 -5.954
17 H SER 5 H SER 5 -10.538 14.653 -3.736
18 HA SER 5 HA SER 5 -9.857 17.120 -2.761
19 HB2 SER 5 1HB SER 5 -9.388 14.349 -1.698
20 HB3 SER 5 2HB SER 5 -8.813 15.756 -0.804
21 HG SER 5 HG SER 5 -11.479 15.592 -1.707
22 H SER 6 H SER 6 -8.134 18.378 -2.940
23 HA SER 6 HA SER 6 -5.894 17.913 -4.407
24 HB2 SER 6 1HB SER 6 -6.201 19.660 -1.959
25 HB3 SER 6 2HB SER 6 -4.782 19.700 -3.005
26 HG SER 6 HG SER 6 -6.217 21.273 -3.688
27 H GLY 7 H GLY 7 -3.823 17.151 -4.078
28 HA2 GLY 7 1HA GLY 7 -2.077 16.062 -3.019
29 HA3 GLY 7 2HA GLY 7 -2.939 16.239 -1.497
30 H VAL 8 H VAL 8 -2.810 14.342 -4.481
31 HA VAL 8 HA VAL 8 -3.859 12.049 -2.954
32 HB VAL 8 HB VAL 8 -4.838 11.206 -5.090
33 HG11 VAL 8 1HG1 VAL 8 -6.402 13.559 -4.999
34 HG12 VAL 8 2HG1 VAL 8 -6.711 12.010 -4.212
35 HG13 VAL 8 3HG1 VAL 8 -5.799 13.263 -3.369
36 HG21 VAL 8 3HG2 VAL 8 -5.279 13.061 -6.809
37 HG22 VAL 8 1HG2 VAL 8 -3.929 13.900 -6.045
38 HG23 VAL 8 2HG2 VAL 8 -3.679 12.319 -6.787
39 H LYS 9 H LYS 9 -2.422 10.474 -2.780
40 HA LYS 9 HA LYS 9 0.096 10.308 -3.634
41 HB2 LYS 9 1HB LYS 9 -0.076 7.834 -3.580
42 HB3 LYS 9 2HB LYS 9 -0.849 8.605 -2.201
43 HG2 LYS 9 1HG LYS 9 -2.527 7.974 -4.567
44 HG3 LYS 9 2HG LYS 9 -2.006 6.645 -3.529
45 HD2 LYS 9 1HD LYS 9 -2.870 8.068 -1.585
46 HD3 LYS 9 2HD LYS 9 -3.681 9.036 -2.819
47 HE2 LYS 9 1HE LYS 9 -4.014 6.058 -2.489
48 HE3 LYS 9 2HE LYS 9 -5.113 7.263 -1.819
49 HZ1 LYS 9 3HZ LYS 9 -4.867 6.303 -4.525
50 HZ2 LYS 9 1HZ LYS 9 -4.962 7.989 -4.409
51 HZ3 LYS 9 2HZ LYS 9 -6.185 7.025 -3.748
52 HA PRO 10 HA PRO 10 0.220 10.098 -8.029
53 HB2 PRO 10 1HB PRO 10 2.666 8.960 -8.338
54 HB3 PRO 10 2HB PRO 10 2.445 10.643 -7.843
55 HG2 PRO 10 1HG PRO 10 3.028 8.235 -6.163
56 HG3 PRO 10 2HG PRO 10 3.726 9.862 -6.066
57 HD2 PRO 10 1HD PRO 10 1.772 9.012 -4.394
58 HD3 PRO 10 2HD PRO 10 1.918 10.705 -4.911
59 H TYR 11 H TYR 11 0.800 7.225 -6.094
60 HA TYR 11 HA TYR 11 -0.274 5.597 -8.299
61 HB2 TYR 11 1HB TYR 11 1.776 4.548 -6.357
62 HB3 TYR 11 2HB TYR 11 1.270 3.856 -7.895
63 HD1 TYR 11 HD1 TYR 11 2.071 4.818 -10.013
64 HD2 TYR 11 HD2 TYR 11 3.440 6.278 -6.258
65 HE1 TYR 11 HE1 TYR 11 3.946 5.942 -11.140
66 HE2 TYR 11 HE2 TYR 11 5.318 7.408 -7.375
67 HH TYR 11 HH TYR 11 5.858 7.064 -10.860
68 H GLY 12 H GLY 12 -2.261 5.056 -7.655
69 HA2 GLY 12 1HA GLY 12 -2.587 4.085 -4.882
70 HA3 GLY 12 2HA GLY 12 -3.832 4.985 -5.734
71 H CYS 13 H CYS 13 -2.101 1.930 -5.580
72 HA CYS 13 HA CYS 13 -3.056 0.423 -7.572
73 HB2 CYS 13 1HB CYS 13 -1.696 -0.391 -5.626
74 HB3 CYS 13 2HB CYS 13 -3.187 -0.497 -4.695
75 H SER 14 H SER 14 -4.926 -0.497 -8.262
76 HA SER 14 HA SER 14 -7.379 0.398 -6.925
77 HB2 SER 14 1HB SER 14 -7.013 0.955 -9.350
78 HB3 SER 14 2HB SER 14 -7.096 -0.772 -9.702
79 HG SER 14 HG SER 14 -9.163 -0.416 -9.825
80 H GLU 15 H GLU 15 -5.703 -2.471 -8.067
81 HA GLU 15 HA GLU 15 -7.579 -4.430 -7.935
82 HB2 GLU 15 1HB GLU 15 -4.707 -4.427 -7.043
83 HB3 GLU 15 2HB GLU 15 -5.688 -5.882 -6.944
84 HG2 GLU 15 1HG GLU 15 -4.290 -5.727 -8.986
85 HG3 GLU 15 2HG GLU 15 -6.013 -5.919 -9.301
86 H CYS 16 H CYS 16 -5.692 -3.273 -5.140
87 HA CYS 16 HA CYS 16 -7.740 -4.441 -3.378
88 HB2 CYS 16 1HB CYS 16 -6.031 -4.423 -1.618
89 HB3 CYS 16 2HB CYS 16 -5.480 -5.328 -3.024
90 H GLY 17 H GLY 17 -5.704 -1.572 -3.856
91 HA2 GLY 17 1HA GLY 17 -6.811 0.607 -3.702
92 HA3 GLY 17 2HA GLY 17 -7.718 -0.032 -2.339
93 H LYS 18 H LYS 18 -4.266 0.104 -3.229
94 HA LYS 18 HA LYS 18 -3.749 1.298 -0.584
95 HB2 LYS 18 1HB LYS 18 -2.193 -0.773 -2.119
96 HB3 LYS 18 2HB LYS 18 -1.442 0.193 -0.855
97 HG2 LYS 18 1HG LYS 18 -3.255 -0.629 0.689
98 HG3 LYS 18 2HG LYS 18 -3.705 -1.766 -0.584
99 HD2 LYS 18 1HD LYS 18 -2.262 -3.062 0.640
100 HD3 LYS 18 2HD LYS 18 -1.139 -2.346 -0.519
101 HE2 LYS 18 1HE LYS 18 -0.124 -2.155 1.613
102 HE3 LYS 18 2HE LYS 18 -0.705 -0.546 1.189
103 HZ1 LYS 18 3HZ LYS 18 -1.166 -1.642 3.536
104 HZ2 LYS 18 1HZ LYS 18 -2.515 -2.248 2.715
105 HZ3 LYS 18 2HZ LYS 18 -2.263 -0.579 2.810
106 H ALA 19 H ALA 19 -1.418 2.310 -0.614
107 HA ALA 19 HA ALA 19 -0.986 3.743 -3.141
108 HB1 ALA 19 3HB ALA 19 -0.570 5.822 -1.753
109 HB2 ALA 19 1HB ALA 19 -2.250 5.309 -1.915
110 HB3 ALA 19 2HB ALA 19 -1.364 4.975 -0.426
111 H PHE 20 H PHE 20 1.138 4.621 -3.400
112 HA PHE 20 HA PHE 20 3.155 3.725 -1.481
113 HB2 PHE 20 1HB PHE 20 3.445 3.189 -4.439
114 HB3 PHE 20 2HB PHE 20 4.501 2.643 -3.140
115 HD1 PHE 20 HD2 PHE 20 3.809 0.830 -1.654
116 HD2 PHE 20 HD1 PHE 20 1.405 2.052 -4.947
117 HE1 PHE 20 HE2 PHE 20 2.525 -1.262 -1.489
118 HE2 PHE 20 HE1 PHE 20 0.116 -0.038 -4.786
119 HZ PHE 20 HZ PHE 20 0.677 -1.699 -3.056
120 H ARG 21 H ARG 21 4.197 5.520 -0.940
121 HA ARG 21 HA ARG 21 4.184 7.966 -2.084
122 HB2 ARG 21 1HB ARG 21 5.291 7.324 0.080
123 HB3 ARG 21 2HB ARG 21 6.671 6.768 -0.858
124 HG2 ARG 21 1HG ARG 21 6.861 9.079 -1.792
125 HG3 ARG 21 2HG ARG 21 5.622 9.577 -0.638
126 HD2 ARG 21 1HD ARG 21 7.520 10.074 0.546
127 HD3 ARG 21 2HD ARG 21 7.222 8.424 1.093
128 HE ARG 21 HE ARG 21 8.951 8.614 -1.203
129 HH11 ARG 21 1HH1 ARG 21 8.769 8.609 2.274
130 HH12 ARG 21 2HH1 ARG 21 10.411 8.102 2.490
131 HH21 ARG 21 1HH2 ARG 21 11.115 7.946 -0.932
132 HH22 ARG 21 2HH2 ARG 21 11.745 7.726 0.666
133 H SER 22 H SER 22 6.285 5.279 -2.991
134 HA SER 22 HA SER 22 7.224 6.865 -5.290
135 HB2 SER 22 1HB SER 22 9.232 5.549 -5.311
136 HB3 SER 22 2HB SER 22 8.973 6.080 -3.650
137 HG SER 22 HG SER 22 8.354 4.063 -3.088
138 H LYS 23 H LYS 23 8.039 5.178 -7.077
139 HA LYS 23 HA LYS 23 5.634 3.757 -7.871
140 HB2 LYS 23 1HB LYS 23 6.865 5.241 -9.452
141 HB3 LYS 23 2HB LYS 23 8.224 4.126 -9.386
142 HG2 LYS 23 1HG LYS 23 6.371 2.381 -10.088
143 HG3 LYS 23 2HG LYS 23 5.587 3.833 -10.715
144 HD2 LYS 23 1HD LYS 23 8.457 3.204 -11.335
145 HD3 LYS 23 2HD LYS 23 7.136 2.526 -12.290
146 HE2 LYS 23 1HE LYS 23 6.317 4.928 -12.546
147 HE3 LYS 23 2HE LYS 23 7.895 5.412 -11.927
148 HZ1 LYS 23 3HZ LYS 23 8.964 4.364 -13.757
149 HZ2 LYS 23 1HZ LYS 23 7.732 5.336 -14.389
150 HZ3 LYS 23 2HZ LYS 23 7.522 3.660 -14.293
151 H SER 24 H SER 24 9.102 3.011 -7.534
152 HA SER 24 HA SER 24 9.163 0.366 -8.140
153 HB2 SER 24 1HB SER 24 11.200 1.434 -7.521
154 HB3 SER 24 2HB SER 24 10.585 1.836 -5.918
155 HG SER 24 HG SER 24 10.989 -0.142 -5.250
156 H TYR 25 H TYR 25 8.181 1.748 -5.022
157 HA TYR 25 HA TYR 25 7.770 -0.589 -3.597
158 HB2 TYR 25 1HB TYR 25 6.647 2.163 -3.467
159 HB3 TYR 25 2HB TYR 25 5.814 0.907 -2.559
160 HD1 TYR 25 HD2 TYR 25 9.298 2.143 -3.131
161 HD2 TYR 25 HD1 TYR 25 6.468 0.563 -0.375
162 HE1 TYR 25 HE2 TYR 25 10.945 2.370 -1.318
163 HE2 TYR 25 HE1 TYR 25 8.106 0.787 1.446
164 HH TYR 25 HH TYR 25 10.663 0.870 1.621
165 H LEU 26 H LEU 26 5.451 1.169 -5.642
166 HA LEU 26 HA LEU 26 3.215 -0.392 -5.285
167 HB2 LEU 26 1HB LEU 26 3.022 1.584 -6.558
168 HB3 LEU 26 2HB LEU 26 4.248 1.052 -7.707
169 HG LEU 26 HG LEU 26 2.675 -0.667 -8.534
170 HD11 LEU 26 1HD1 LEU 26 1.381 -0.718 -6.343
171 HD12 LEU 26 2HD1 LEU 26 0.441 -0.790 -7.834
172 HD13 LEU 26 3HD1 LEU 26 0.549 0.722 -6.933
173 HD21 LEU 26 3HD2 LEU 26 2.260 0.901 -10.049
174 HD22 LEU 26 1HD2 LEU 26 2.500 2.178 -8.856
175 HD23 LEU 26 2HD2 LEU 26 0.907 1.448 -9.058
176 H ILE 27 H ILE 27 5.671 -0.824 -7.836
177 HA ILE 27 HA ILE 27 4.687 -3.134 -8.982
178 HB ILE 27 HB ILE 27 7.596 -2.424 -8.584
179 HG12 ILE 27 1HG1 ILE 27 7.124 -1.755 -11.120
180 HG13 ILE 27 2HG1 ILE 27 5.493 -1.527 -10.498
181 HG21 ILE 27 1HG2 ILE 27 7.760 -3.772 -10.776
182 HG22 ILE 27 2HG2 ILE 27 7.615 -4.648 -9.253
183 HG23 ILE 27 3HG2 ILE 27 6.205 -4.451 -10.293
184 HD11 ILE 27 3HD1 ILE 27 7.344 -0.291 -8.721
185 HD12 ILE 27 1HD1 ILE 27 7.670 0.244 -10.369
186 HD13 ILE 27 2HD1 ILE 27 6.059 0.443 -9.680
187 H ILE 28 H ILE 28 6.923 -2.840 -6.236
188 HA ILE 28 HA ILE 28 7.420 -5.537 -5.800
189 HB ILE 28 HB ILE 28 7.181 -3.349 -3.731
190 HG12 ILE 28 1HG1 ILE 28 9.678 -4.451 -5.024
191 HG13 ILE 28 2HG1 ILE 28 8.835 -3.029 -5.631
192 HG21 ILE 28 1HG2 ILE 28 8.916 -4.984 -2.612
193 HG22 ILE 28 2HG2 ILE 28 7.180 -5.217 -2.411
194 HG23 ILE 28 3HG2 ILE 28 8.068 -6.185 -3.588
195 HD11 ILE 28 3HD1 ILE 28 10.493 -2.119 -4.320
196 HD12 ILE 28 1HD1 ILE 28 9.116 -2.141 -3.219
197 HD13 ILE 28 2HD1 ILE 28 10.364 -3.381 -3.095
198 H HIS 29 H HIS 29 4.508 -3.821 -5.444
199 HA HIS 29 HA HIS 29 3.378 -5.906 -3.705
200 HB2 HIS 29 1HB HIS 29 2.865 -3.883 -2.683
201 HB3 HIS 29 2HB HIS 29 2.646 -3.046 -4.217
202 HD1 HIS 29 HD1 HIS 29 0.873 -5.429 -1.896
203 HD2 HIS 29 HD2 HIS 29 0.069 -3.031 -5.193
204 HE1 HIS 29 HE1 HIS 29 -1.630 -5.441 -2.142
205 H MET 30 H MET 30 3.042 -4.290 -6.802
206 HA MET 30 HA MET 30 0.595 -5.495 -7.561
207 HB2 MET 30 1HB MET 30 2.834 -4.294 -9.193
208 HB3 MET 30 2HB MET 30 1.318 -4.853 -9.889
209 HG2 MET 30 1HG MET 30 1.418 -2.800 -7.705
210 HG3 MET 30 2HG MET 30 1.531 -2.375 -9.411
211 HE1 MET 30 3HE MET 30 -0.085 -3.300 -11.138
212 HE2 MET 30 1HE MET 30 -0.796 -4.795 -10.530
213 HE3 MET 30 2HE MET 30 -1.827 -3.408 -10.882
214 H ARG 31 H ARG 31 3.894 -6.566 -7.598
215 HA ARG 31 HA ARG 31 3.873 -8.520 -9.552
216 HB2 ARG 31 1HB ARG 31 5.754 -9.449 -8.501
217 HB3 ARG 31 2HB ARG 31 5.800 -7.752 -8.045
218 HG2 ARG 31 1HG ARG 31 5.066 -8.209 -5.858
219 HG3 ARG 31 2HG ARG 31 4.569 -9.847 -6.286
220 HD2 ARG 31 1HD ARG 31 7.426 -8.934 -6.476
221 HD3 ARG 31 2HD ARG 31 6.747 -9.589 -4.986
222 HE ARG 31 HE ARG 31 6.258 -11.325 -7.176
223 HH11 ARG 31 1HH1 ARG 31 8.751 -10.276 -4.984
224 HH12 ARG 31 2HH1 ARG 31 9.645 -11.756 -5.087
225 HH21 ARG 31 1HH2 ARG 31 7.426 -13.278 -7.320
226 HH22 ARG 31 2HH2 ARG 31 8.891 -13.463 -6.417
227 H THR 32 H THR 32 2.505 -8.591 -6.324
228 HA THR 32 HA THR 32 1.897 -11.404 -6.407
229 HB THR 32 HB THR 32 0.688 -11.018 -4.310
230 HG1 THR 32 HG1 THR 32 -0.066 -8.868 -4.899
231 HG21 THR 32 3HG2 THR 32 2.647 -9.886 -3.049
232 HG22 THR 32 1HG2 THR 32 3.437 -9.864 -4.624
233 HG23 THR 32 2HG2 THR 32 2.949 -11.398 -3.904
234 H HIS 33 H HIS 33 0.352 -8.465 -7.366
235 HA HIS 33 HA HIS 33 -2.328 -9.441 -7.368
236 HB2 HIS 33 1HB HIS 33 -0.923 -7.031 -8.406
237 HB3 HIS 33 2HB HIS 33 -2.482 -7.430 -9.120
238 HD1 HIS 33 HD1 HIS 33 -4.028 -8.332 -6.648
239 HD2 HIS 33 HD2 HIS 33 -1.556 -4.993 -6.729
240 HE1 HIS 33 HE1 HIS 33 -4.840 -6.848 -4.787
241 H THR 34 H THR 34 0.094 -8.962 -9.930
242 HA THR 34 HA THR 34 -1.530 -10.089 -11.980
243 HB THR 34 HB THR 34 0.545 -10.118 -13.332
244 HG1 THR 34 HG1 THR 34 1.959 -10.554 -11.496
245 HG21 THR 34 3HG2 THR 34 -0.590 -7.779 -12.006
246 HG22 THR 34 1HG2 THR 34 -0.210 -8.040 -13.707
247 HG23 THR 34 2HG2 THR 34 1.052 -7.515 -12.592
248 H GLY 35 H GLY 35 -2.177 -12.153 -11.812
249 HA2 GLY 35 1HA GLY 35 -1.278 -14.404 -12.450
250 HA3 GLY 35 2HA GLY 35 -0.126 -14.174 -11.143
251 H GLU 36 H GLU 36 -3.620 -14.318 -11.783
252 HA GLU 36 HA GLU 36 -3.939 -15.595 -9.146
253 HB2 GLU 36 1HB GLU 36 -6.285 -14.675 -9.195
254 HB3 GLU 36 2HB GLU 36 -5.012 -13.476 -9.013
255 HG2 GLU 36 1HG GLU 36 -5.171 -13.158 -11.531
256 HG3 GLU 36 2HG GLU 36 -6.672 -14.079 -11.436
257 H LYS 37 H LYS 37 -3.611 -17.645 -10.154
258 HA LYS 37 HA LYS 37 -6.065 -18.712 -11.298
259 HB2 LYS 37 1HB LYS 37 -4.952 -19.788 -13.166
260 HB3 LYS 37 2HB LYS 37 -4.701 -18.049 -13.249
261 HG2 LYS 37 1HG LYS 37 -2.590 -18.748 -13.696
262 HG3 LYS 37 2HG LYS 37 -2.492 -18.670 -11.935
263 HD2 LYS 37 1HD LYS 37 -2.476 -20.944 -11.699
264 HD3 LYS 37 2HD LYS 37 -3.421 -21.211 -13.166
265 HE2 LYS 37 1HE LYS 37 -1.464 -20.629 -14.522
266 HE3 LYS 37 2HE LYS 37 -0.524 -20.375 -13.052
267 HZ1 LYS 37 3HZ LYS 37 -0.965 -22.768 -14.435
268 HZ2 LYS 37 1HZ LYS 37 -1.694 -22.911 -12.915
269 HZ3 LYS 37 2HZ LYS 37 -0.053 -22.522 -13.032
270 HA PRO 38 HA PRO 38 -5.090 -22.120 -8.698
271 HB2 PRO 38 1HB PRO 38 -6.473 -24.086 -9.958
272 HB3 PRO 38 2HB PRO 38 -7.257 -22.809 -9.022
273 HG2 PRO 38 1HG PRO 38 -6.884 -23.028 -11.984
274 HG3 PRO 38 2HG PRO 38 -8.316 -22.517 -11.071
275 HD2 PRO 38 1HD PRO 38 -6.627 -20.753 -12.243
276 HD3 PRO 38 2HD PRO 38 -7.498 -20.387 -10.740
277 H SER 39 H SER 39 -4.122 -24.292 -8.710
278 HA SER 39 HA SER 39 -2.348 -24.682 -11.033
279 HB2 SER 39 1HB SER 39 -1.034 -23.943 -9.146
280 HB3 SER 39 2HB SER 39 -1.787 -25.142 -8.095
281 HG SER 39 HG SER 39 -0.861 -26.734 -9.598
282 H GLY 40 H GLY 40 -3.441 -26.253 -12.123
283 HA2 GLY 40 1HA GLY 40 -3.140 -28.852 -11.858
284 HA3 GLY 40 2HA GLY 40 -4.393 -28.598 -10.652
285 HA PRO 41 HA PRO 41 -6.449 -29.506 -14.705
286 HB2 PRO 41 1HB PRO 41 -8.218 -31.289 -13.674
287 HB3 PRO 41 2HB PRO 41 -6.596 -31.745 -14.210
288 HG2 PRO 41 1HG PRO 41 -7.592 -31.201 -11.440
289 HG3 PRO 41 2HG PRO 41 -6.522 -32.494 -12.010
290 HD2 PRO 41 1HD PRO 41 -5.592 -30.274 -10.771
291 HD3 PRO 41 2HD PRO 41 -4.668 -31.125 -12.026
292 H SER 42 H SER 42 -7.359 -28.320 -11.626
293 HA SER 42 HA SER 42 -10.097 -27.930 -11.877
294 HB2 SER 42 1HB SER 42 -7.933 -26.455 -10.413
295 HB3 SER 42 2HB SER 42 -9.577 -25.817 -10.423
296 HG SER 42 HG SER 42 -9.265 -27.183 -8.644
297 H SER 43 H SER 43 -7.417 -25.989 -13.103
298 HA SER 43 HA SER 43 -8.475 -23.666 -13.888
299 HB2 SER 43 1HB SER 43 -6.975 -23.619 -15.755
300 HB3 SER 43 2HB SER 43 -6.187 -24.559 -14.488
301 HG SER 43 HG SER 43 -6.727 -26.434 -15.574
302 H GLY 44 H GLY 44 -10.240 -23.006 -14.912
303 HA2 GLY 44 1HA GLY 44 -11.448 -23.105 -17.083
304 HA3 GLY 44 2HA GLY 44 -11.484 -24.848 -16.861
Start of MODEL 7
1 H1 GLY 1 H GLY 1 -14.406 12.844 0.568
2 HA2 GLY 1 1HA GLY 1 -14.184 14.777 2.393
3 HA3 GLY 1 2HA GLY 1 -13.082 13.578 3.054
4 H SER 2 H SER 2 -13.784 15.289 0.013
5 HA SER 2 HA SER 2 -10.876 15.476 -0.424
6 HB2 SER 2 1HB SER 2 -13.059 14.673 -2.284
7 HB3 SER 2 2HB SER 2 -11.745 15.646 -2.945
8 HG SER 2 HG SER 2 -11.765 13.029 -2.275
9 H SER 3 H SER 3 -10.766 17.524 0.519
10 HA SER 3 HA SER 3 -12.441 19.663 -0.482
11 HB2 SER 3 1HB SER 3 -11.113 21.079 1.089
12 HB3 SER 3 2HB SER 3 -11.872 19.694 1.874
13 HG SER 3 HG SER 3 -9.172 19.829 1.001
14 H GLY 4 H GLY 4 -9.034 18.703 -0.648
15 HA2 GLY 4 1HA GLY 4 -8.495 20.889 -2.520
16 HA3 GLY 4 2HA GLY 4 -7.293 19.850 -1.768
17 H SER 5 H SER 5 -7.264 20.452 -4.488
18 HA SER 5 HA SER 5 -8.216 17.983 -5.766
19 HB2 SER 5 1HB SER 5 -7.859 19.183 -7.904
20 HB3 SER 5 2HB SER 5 -8.979 20.037 -6.843
21 HG SER 5 HG SER 5 -7.677 21.668 -6.952
22 H SER 6 H SER 6 -6.007 17.730 -4.123
23 HA SER 6 HA SER 6 -4.081 16.680 -5.971
24 HB2 SER 6 1HB SER 6 -3.509 19.169 -5.716
25 HB3 SER 6 2HB SER 6 -3.033 18.769 -4.065
26 HG SER 6 HG SER 6 -2.013 17.174 -6.106
27 H GLY 7 H GLY 7 -2.457 15.372 -4.929
28 HA2 GLY 7 1HA GLY 7 -2.786 14.916 -2.061
29 HA3 GLY 7 2HA GLY 7 -3.177 13.576 -3.128
30 H VAL 8 H VAL 8 -1.259 13.185 -1.275
31 HA VAL 8 HA VAL 8 1.315 13.550 -2.634
32 HB VAL 8 HB VAL 8 2.370 12.935 -0.547
33 HG11 VAL 8 1HG1 VAL 8 1.317 14.725 0.955
34 HG12 VAL 8 2HG1 VAL 8 1.924 15.230 -0.623
35 HG13 VAL 8 3HG1 VAL 8 0.193 14.994 -0.377
36 HG21 VAL 8 3HG2 VAL 8 0.208 11.419 -0.035
37 HG22 VAL 8 1HG2 VAL 8 1.360 11.921 1.202
38 HG23 VAL 8 2HG2 VAL 8 -0.148 12.810 0.989
39 H LYS 9 H LYS 9 -0.838 11.556 -3.331
40 HA LYS 9 HA LYS 9 0.907 9.193 -3.311
41 HB2 LYS 9 1HB LYS 9 -1.253 7.822 -3.138
42 HB3 LYS 9 2HB LYS 9 -0.660 8.589 -1.671
43 HG2 LYS 9 1HG LYS 9 -2.641 10.048 -3.344
44 HG3 LYS 9 2HG LYS 9 -3.191 8.707 -2.337
45 HD2 LYS 9 1HD LYS 9 -2.395 9.767 -0.356
46 HD3 LYS 9 2HD LYS 9 -1.547 11.003 -1.288
47 HE2 LYS 9 1HE LYS 9 -3.691 11.853 -2.105
48 HE3 LYS 9 2HE LYS 9 -4.537 10.615 -1.178
49 HZ1 LYS 9 3HZ LYS 9 -2.731 12.568 0.115
50 HZ2 LYS 9 1HZ LYS 9 -3.924 11.605 0.831
51 HZ3 LYS 9 2HZ LYS 9 -4.367 12.907 -0.152
52 HA PRO 10 HA PRO 10 -0.408 10.237 -7.609
53 HB2 PRO 10 1HB PRO 10 2.008 9.677 -8.714
54 HB3 PRO 10 2HB PRO 10 1.615 11.250 -8.011
55 HG2 PRO 10 1HG PRO 10 3.143 8.970 -6.816
56 HG3 PRO 10 2HG PRO 10 3.498 10.707 -6.760
57 HD2 PRO 10 1HD PRO 10 2.346 9.388 -4.695
58 HD3 PRO 10 2HD PRO 10 1.989 11.088 -5.060
59 H TYR 11 H TYR 11 1.157 7.485 -6.139
60 HA TYR 11 HA TYR 11 0.093 5.766 -8.283
61 HB2 TYR 11 1HB TYR 11 2.343 4.986 -6.439
62 HB3 TYR 11 2HB TYR 11 1.885 4.256 -7.974
63 HD1 TYR 11 HD1 TYR 11 2.271 5.577 -10.100
64 HD2 TYR 11 HD2 TYR 11 3.927 6.724 -6.352
65 HE1 TYR 11 HE1 TYR 11 3.919 6.983 -11.265
66 HE2 TYR 11 HE2 TYR 11 5.579 8.134 -7.507
67 HH TYR 11 HH TYR 11 6.400 8.779 -9.467
68 H GLY 12 H GLY 12 -1.852 5.147 -7.499
69 HA2 GLY 12 1HA GLY 12 -1.828 3.734 -4.907
70 HA3 GLY 12 2HA GLY 12 -3.130 4.837 -5.327
71 H CYS 13 H CYS 13 -2.425 1.688 -5.084
72 HA CYS 13 HA CYS 13 -3.410 0.576 -7.487
73 HB2 CYS 13 1HB CYS 13 -2.074 -0.668 -5.791
74 HB3 CYS 13 2HB CYS 13 -3.471 -0.642 -4.720
75 H SER 14 H SER 14 -5.435 -0.420 -7.908
76 HA SER 14 HA SER 14 -7.659 0.756 -6.372
77 HB2 SER 14 1HB SER 14 -7.376 1.568 -8.745
78 HB3 SER 14 2HB SER 14 -7.739 -0.073 -9.279
79 HG SER 14 HG SER 14 -9.568 1.413 -9.180
80 H GLU 15 H GLU 15 -6.454 -2.107 -8.022
81 HA GLU 15 HA GLU 15 -8.567 -3.826 -7.927
82 HB2 GLU 15 1HB GLU 15 -5.673 -4.405 -7.283
83 HB3 GLU 15 2HB GLU 15 -6.885 -5.650 -7.550
84 HG2 GLU 15 1HG GLU 15 -7.249 -4.295 -9.793
85 HG3 GLU 15 2HG GLU 15 -5.579 -3.823 -9.482
86 H CYS 16 H CYS 16 -6.367 -3.053 -5.252
87 HA CYS 16 HA CYS 16 -8.275 -4.347 -3.415
88 HB2 CYS 16 1HB CYS 16 -6.416 -4.722 -1.888
89 HB3 CYS 16 2HB CYS 16 -6.047 -5.418 -3.462
90 H GLY 17 H GLY 17 -6.078 -1.593 -3.826
91 HA2 GLY 17 1HA GLY 17 -6.937 0.625 -3.289
92 HA3 GLY 17 2HA GLY 17 -7.772 -0.100 -1.924
93 H LYS 18 H LYS 18 -4.546 0.580 -3.219
94 HA LYS 18 HA LYS 18 -3.638 1.078 -0.475
95 HB2 LYS 18 1HB LYS 18 -2.237 -0.648 -2.518
96 HB3 LYS 18 2HB LYS 18 -1.444 -0.012 -1.083
97 HG2 LYS 18 1HG LYS 18 -3.064 -1.206 0.323
98 HG3 LYS 18 2HG LYS 18 -3.814 -1.871 -1.130
99 HD2 LYS 18 1HD LYS 18 -1.849 -3.097 -1.679
100 HD3 LYS 18 2HD LYS 18 -0.904 -2.256 -0.448
101 HE2 LYS 18 1HE LYS 18 -2.388 -3.261 1.280
102 HE3 LYS 18 2HE LYS 18 -3.170 -4.195 0.005
103 HZ1 LYS 18 3HZ LYS 18 -0.700 -4.682 1.345
104 HZ2 LYS 18 1HZ LYS 18 -0.495 -4.657 -0.335
105 HZ3 LYS 18 2HZ LYS 18 -1.612 -5.716 0.364
106 H ALA 19 H ALA 19 -1.185 1.939 -0.744
107 HA ALA 19 HA ALA 19 -1.106 3.847 -2.971
108 HB1 ALA 19 3HB ALA 19 -0.134 5.401 -0.990
109 HB2 ALA 19 1HB ALA 19 -1.814 5.421 -1.525
110 HB3 ALA 19 2HB ALA 19 -1.351 4.479 -0.108
111 H PHE 20 H PHE 20 1.052 4.917 -3.155
112 HA PHE 20 HA PHE 20 3.280 3.550 -1.908
113 HB2 PHE 20 1HB PHE 20 3.102 3.519 -4.919
114 HB3 PHE 20 2HB PHE 20 4.268 2.690 -3.894
115 HD1 PHE 20 HD2 PHE 20 3.609 0.695 -2.628
116 HD2 PHE 20 HD1 PHE 20 0.948 2.597 -5.352
117 HE1 PHE 20 HE2 PHE 20 2.192 -1.317 -2.644
118 HE2 PHE 20 HE1 PHE 20 -0.473 0.588 -5.371
119 HZ PHE 20 HZ PHE 20 0.149 -1.372 -4.017
120 H ARG 21 H ARG 21 4.814 4.993 -1.499
121 HA ARG 21 HA ARG 21 4.624 7.680 -2.319
122 HB2 ARG 21 1HB ARG 21 5.715 7.129 -0.245
123 HB3 ARG 21 2HB ARG 21 6.904 6.137 -1.078
124 HG2 ARG 21 1HG ARG 21 8.060 8.088 -0.612
125 HG3 ARG 21 2HG ARG 21 7.559 8.306 -2.290
126 HD2 ARG 21 1HD ARG 21 5.710 9.698 -1.598
127 HD3 ARG 21 2HD ARG 21 6.078 9.396 0.099
128 HE ARG 21 HE ARG 21 8.306 10.531 -1.247
129 HH11 ARG 21 1HH1 ARG 21 5.202 11.315 0.120
130 HH12 ARG 21 2HH1 ARG 21 5.619 12.963 0.453
131 HH21 ARG 21 1HH2 ARG 21 8.867 12.699 -0.813
132 HH22 ARG 21 2HH2 ARG 21 7.704 13.750 -0.079
133 H SER 22 H SER 22 6.210 4.922 -3.699
134 HA SER 22 HA SER 22 7.078 6.586 -5.948
135 HB2 SER 22 1HB SER 22 8.843 4.543 -4.577
136 HB3 SER 22 2HB SER 22 9.245 5.414 -6.056
137 HG SER 22 HG SER 22 8.508 6.927 -3.836
138 H LYS 23 H LYS 23 8.073 4.909 -7.673
139 HA LYS 23 HA LYS 23 5.862 3.307 -8.476
140 HB2 LYS 23 1HB LYS 23 8.563 3.933 -9.560
141 HB3 LYS 23 2HB LYS 23 7.757 2.493 -10.170
142 HG2 LYS 23 1HG LYS 23 6.215 5.028 -10.098
143 HG3 LYS 23 2HG LYS 23 7.471 4.845 -11.325
144 HD2 LYS 23 1HD LYS 23 5.705 3.955 -12.465
145 HD3 LYS 23 2HD LYS 23 6.286 2.497 -11.656
146 HE2 LYS 23 1HE LYS 23 4.567 2.529 -10.095
147 HE3 LYS 23 2HE LYS 23 4.239 4.243 -10.344
148 HZ1 LYS 23 3HZ LYS 23 2.607 2.560 -11.311
149 HZ2 LYS 23 1HZ LYS 23 3.781 2.272 -12.495
150 HZ3 LYS 23 2HZ LYS 23 3.118 3.819 -12.319
151 H SER 24 H SER 24 9.248 2.319 -7.932
152 HA SER 24 HA SER 24 9.114 -0.342 -7.959
153 HB2 SER 24 1HB SER 24 10.860 -0.440 -6.249
154 HB3 SER 24 2HB SER 24 11.143 0.926 -7.329
155 HG SER 24 HG SER 24 10.628 2.302 -5.758
156 H TYR 25 H TYR 25 8.258 1.548 -5.061
157 HA TYR 25 HA TYR 25 7.505 -0.454 -3.361
158 HB2 TYR 25 1HB TYR 25 6.497 2.336 -3.763
159 HB3 TYR 25 2HB TYR 25 5.686 1.285 -2.607
160 HD1 TYR 25 HD1 TYR 25 7.466 -0.030 -1.029
161 HD2 TYR 25 HD2 TYR 25 8.093 3.743 -2.892
162 HE1 TYR 25 HE1 TYR 25 9.162 0.518 0.666
163 HE2 TYR 25 HE2 TYR 25 9.792 4.301 -1.204
164 HH TYR 25 HH TYR 25 10.515 2.091 1.475
165 H LEU 26 H LEU 26 5.530 1.025 -5.906
166 HA LEU 26 HA LEU 26 3.158 -0.382 -5.377
167 HB2 LEU 26 1HB LEU 26 3.023 1.518 -6.764
168 HB3 LEU 26 2HB LEU 26 4.263 0.904 -7.855
169 HG LEU 26 HG LEU 26 2.698 -0.805 -8.660
170 HD11 LEU 26 1HD1 LEU 26 1.398 -0.775 -6.443
171 HD12 LEU 26 2HD1 LEU 26 0.496 -0.999 -7.941
172 HD13 LEU 26 3HD1 LEU 26 0.512 0.577 -7.149
173 HD21 LEU 26 3HD2 LEU 26 2.747 1.128 -9.986
174 HD22 LEU 26 1HD2 LEU 26 1.873 2.080 -8.786
175 HD23 LEU 26 2HD2 LEU 26 1.032 0.827 -9.700
176 H ILE 27 H ILE 27 5.663 -1.018 -7.835
177 HA ILE 27 HA ILE 27 4.682 -3.324 -8.937
178 HB ILE 27 HB ILE 27 7.560 -2.652 -8.324
179 HG12 ILE 27 1HG1 ILE 27 7.344 -2.352 -10.966
180 HG13 ILE 27 2HG1 ILE 27 5.663 -2.048 -10.541
181 HG21 ILE 27 1HG2 ILE 27 8.225 -4.353 -9.862
182 HG22 ILE 27 2HG2 ILE 27 7.156 -5.092 -8.671
183 HG23 ILE 27 3HG2 ILE 27 6.548 -4.705 -10.280
184 HD11 ILE 27 3HD1 ILE 27 7.289 -0.555 -8.770
185 HD12 ILE 27 1HD1 ILE 27 7.872 -0.285 -10.412
186 HD13 ILE 27 2HD1 ILE 27 6.183 0.030 -10.013
187 H ILE 28 H ILE 28 6.855 -3.137 -6.116
188 HA ILE 28 HA ILE 28 7.118 -5.785 -5.501
189 HB ILE 28 HB ILE 28 6.781 -3.465 -3.603
190 HG12 ILE 28 1HG1 ILE 28 9.321 -4.944 -4.229
191 HG13 ILE 28 2HG1 ILE 28 8.746 -3.663 -5.292
192 HG21 ILE 28 1HG2 ILE 28 6.221 -5.516 -2.435
193 HG22 ILE 28 2HG2 ILE 28 7.704 -6.274 -3.013
194 HG23 ILE 28 3HG2 ILE 28 7.788 -4.915 -1.892
195 HD11 ILE 28 3HD1 ILE 28 10.445 -3.090 -3.455
196 HD12 ILE 28 1HD1 ILE 28 9.061 -2.023 -3.690
197 HD13 ILE 28 2HD1 ILE 28 9.066 -3.183 -2.361
198 H HIS 29 H HIS 29 4.250 -3.907 -5.383
199 HA HIS 29 HA HIS 29 2.871 -5.930 -3.765
200 HB2 HIS 29 1HB HIS 29 2.320 -3.843 -2.890
201 HB3 HIS 29 2HB HIS 29 2.267 -3.080 -4.476
202 HD1 HIS 29 HD1 HIS 29 0.258 -5.535 -2.393
203 HD2 HIS 29 HD2 HIS 29 -0.232 -2.852 -5.527
204 HE1 HIS 29 HE1 HIS 29 -2.217 -5.463 -2.836
205 H MET 30 H MET 30 2.550 -4.158 -6.832
206 HA MET 30 HA MET 30 0.296 -5.282 -7.877
207 HB2 MET 30 1HB MET 30 2.827 -4.279 -9.073
208 HB3 MET 30 2HB MET 30 1.746 -5.188 -10.121
209 HG2 MET 30 1HG MET 30 0.601 -2.993 -8.483
210 HG3 MET 30 2HG MET 30 1.581 -2.573 -9.886
211 HE1 MET 30 3HE MET 30 -1.594 -4.427 -8.584
212 HE2 MET 30 1HE MET 30 -1.856 -2.700 -8.833
213 HE3 MET 30 2HE MET 30 -2.720 -3.874 -9.825
214 H ARG 31 H ARG 31 3.475 -6.746 -7.604
215 HA ARG 31 HA ARG 31 3.263 -8.914 -9.278
216 HB2 ARG 31 1HB ARG 31 4.858 -10.044 -7.851
217 HB3 ARG 31 2HB ARG 31 5.272 -8.338 -7.949
218 HG2 ARG 31 1HG ARG 31 4.151 -7.993 -5.763
219 HG3 ARG 31 2HG ARG 31 3.905 -9.738 -5.663
220 HD2 ARG 31 1HD ARG 31 5.991 -8.580 -4.545
221 HD3 ARG 31 2HD ARG 31 6.120 -10.168 -5.301
222 HE ARG 31 HE ARG 31 7.276 -7.687 -6.239
223 HH11 ARG 31 1HH1 ARG 31 6.388 -10.964 -7.007
224 HH12 ARG 31 2HH1 ARG 31 7.487 -11.088 -8.340
225 HH21 ARG 31 1HH2 ARG 31 8.727 -7.837 -7.993
226 HH22 ARG 31 2HH2 ARG 31 8.818 -9.309 -8.900
227 H THR 32 H THR 32 2.033 -8.613 -5.966
228 HA THR 32 HA THR 32 1.083 -11.209 -5.632
229 HB THR 32 HB THR 32 1.184 -9.227 -3.941
230 HG1 THR 32 HG1 THR 32 -0.573 -11.396 -4.089
231 HG21 THR 32 3HG2 THR 32 -0.499 -7.912 -5.345
232 HG22 THR 32 1HG2 THR 32 -0.788 -7.983 -3.607
233 HG23 THR 32 2HG2 THR 32 -1.719 -9.009 -4.699
234 H HIS 33 H HIS 33 -0.402 -8.422 -7.196
235 HA HIS 33 HA HIS 33 -2.941 -9.672 -7.590
236 HB2 HIS 33 1HB HIS 33 -1.628 -7.178 -8.611
237 HB3 HIS 33 2HB HIS 33 -3.123 -7.744 -9.349
238 HD1 HIS 33 HD1 HIS 33 -4.880 -8.479 -7.105
239 HD2 HIS 33 HD2 HIS 33 -2.285 -5.244 -6.856
240 HE1 HIS 33 HE1 HIS 33 -5.825 -6.995 -5.309
241 H THR 34 H THR 34 -0.345 -8.796 -9.877
242 HA THR 34 HA THR 34 -1.162 -11.093 -11.530
243 HB THR 34 HB THR 34 -1.883 -9.009 -12.613
244 HG1 THR 34 HG1 THR 34 -1.348 -10.496 -14.115
245 HG21 THR 34 3HG2 THR 34 0.998 -8.240 -12.945
246 HG22 THR 34 1HG2 THR 34 0.072 -7.692 -11.549
247 HG23 THR 34 2HG2 THR 34 -0.448 -7.258 -13.177
248 H GLY 35 H GLY 35 0.413 -12.557 -11.382
249 HA2 GLY 35 1HA GLY 35 3.014 -12.061 -12.350
250 HA3 GLY 35 2HA GLY 35 3.051 -12.061 -10.593
251 H GLU 36 H GLU 36 1.653 -14.018 -9.693
252 HA GLU 36 HA GLU 36 2.281 -16.422 -11.260
253 HB2 GLU 36 1HB GLU 36 3.928 -15.749 -9.298
254 HB3 GLU 36 2HB GLU 36 2.683 -16.490 -8.303
255 HG2 GLU 36 1HG GLU 36 2.889 -18.561 -9.577
256 HG3 GLU 36 2HG GLU 36 4.134 -17.819 -10.581
257 H LYS 37 H LYS 37 0.879 -18.136 -11.009
258 HA LYS 37 HA LYS 37 -1.549 -17.558 -9.445
259 HB2 LYS 37 1HB LYS 37 -1.132 -19.024 -12.039
260 HB3 LYS 37 2HB LYS 37 -2.584 -19.266 -11.077
261 HG2 LYS 37 1HG LYS 37 -1.757 -16.496 -11.803
262 HG3 LYS 37 2HG LYS 37 -2.551 -17.515 -13.006
263 HD2 LYS 37 1HD LYS 37 -4.510 -17.685 -11.734
264 HD3 LYS 37 2HD LYS 37 -3.703 -17.153 -10.257
265 HE2 LYS 37 1HE LYS 37 -4.122 -15.411 -12.682
266 HE3 LYS 37 2HE LYS 37 -5.207 -15.447 -11.293
267 HZ1 LYS 37 3HZ LYS 37 -3.643 -13.629 -11.113
268 HZ2 LYS 37 1HZ LYS 37 -2.334 -14.694 -11.239
269 HZ3 LYS 37 2HZ LYS 37 -3.351 -14.760 -9.889
270 HA PRO 38 HA PRO 38 -0.905 -21.127 -6.969
271 HB2 PRO 38 1HB PRO 38 -3.464 -21.905 -6.501
272 HB3 PRO 38 2HB PRO 38 -2.745 -20.471 -5.759
273 HG2 PRO 38 1HG PRO 38 -4.546 -20.670 -8.141
274 HG3 PRO 38 2HG PRO 38 -4.586 -19.508 -6.803
275 HD2 PRO 38 1HD PRO 38 -3.519 -18.911 -9.219
276 HD3 PRO 38 2HD PRO 38 -2.901 -18.220 -7.705
277 H SER 39 H SER 39 -1.890 -21.323 -10.104
278 HA SER 39 HA SER 39 -3.064 -23.635 -10.713
279 HB2 SER 39 1HB SER 39 -1.835 -22.034 -12.287
280 HB3 SER 39 2HB SER 39 -0.395 -23.001 -11.969
281 HG SER 39 HG SER 39 -2.332 -23.494 -13.697
282 H GLY 40 H GLY 40 -2.785 -25.787 -10.501
283 HA2 GLY 40 1HA GLY 40 -1.226 -27.681 -10.390
284 HA3 GLY 40 2HA GLY 40 -0.243 -26.707 -9.307
285 HA PRO 41 HA PRO 41 -2.204 -28.729 -5.936
286 HB2 PRO 41 1HB PRO 41 -1.708 -26.907 -3.985
287 HB3 PRO 41 2HB PRO 41 -0.458 -27.963 -4.653
288 HG2 PRO 41 1HG PRO 41 -1.067 -25.104 -5.299
289 HG3 PRO 41 2HG PRO 41 0.507 -25.886 -5.058
290 HD2 PRO 41 1HD PRO 41 -0.495 -25.356 -7.517
291 HD3 PRO 41 2HD PRO 41 0.539 -26.761 -7.190
292 H SER 42 H SER 42 -4.271 -28.873 -5.337
293 HA SER 42 HA SER 42 -6.075 -26.677 -5.838
294 HB2 SER 42 1HB SER 42 -7.831 -28.310 -5.136
295 HB3 SER 42 2HB SER 42 -6.806 -28.905 -6.441
296 HG SER 42 HG SER 42 -7.297 -30.237 -4.380
297 H SER 43 H SER 43 -5.385 -25.147 -4.286
298 HA SER 43 HA SER 43 -6.177 -25.810 -1.525
299 HB2 SER 43 1HB SER 43 -3.734 -25.462 -1.747
300 HB3 SER 43 2HB SER 43 -4.038 -23.846 -2.385
301 HG SER 43 HG SER 43 -3.880 -24.615 0.157
302 H GLY 44 H GLY 44 -5.640 -22.987 -3.649
303 HA2 GLY 44 1HA GLY 44 -7.160 -21.129 -2.304
304 HA3 GLY 44 2HA GLY 44 -6.956 -21.145 -4.049
Start of MODEL 8
1 H1 GLY 1 H GLY 1 -9.036 19.814 8.586
2 HA2 GLY 1 1HA GLY 1 -11.042 20.872 6.846
3 HA3 GLY 1 2HA GLY 1 -9.517 20.634 6.004
4 H SER 2 H SER 2 -8.550 18.433 6.184
5 HA SER 2 HA SER 2 -10.685 16.402 6.195
6 HB2 SER 2 1HB SER 2 -9.488 16.988 3.984
7 HB3 SER 2 2HB SER 2 -8.105 16.131 4.665
8 HG SER 2 HG SER 2 -10.135 15.077 3.412
9 H SER 3 H SER 3 -10.486 15.688 8.286
10 HA SER 3 HA SER 3 -8.001 15.152 9.549
11 HB2 SER 3 1HB SER 3 -10.868 14.549 10.167
12 HB3 SER 3 2HB SER 3 -9.604 13.729 11.083
13 HG SER 3 HG SER 3 -10.512 16.237 11.344
14 H GLY 4 H GLY 4 -6.688 13.750 8.488
15 HA2 GLY 4 1HA GLY 4 -7.117 10.985 8.751
16 HA3 GLY 4 2HA GLY 4 -7.504 11.449 7.101
17 H SER 5 H SER 5 -5.635 13.309 6.496
18 HA SER 5 HA SER 5 -3.496 13.558 5.764
19 HB2 SER 5 1HB SER 5 -3.165 13.457 8.341
20 HB3 SER 5 2HB SER 5 -2.526 11.842 8.034
21 HG SER 5 HG SER 5 -1.305 14.192 7.741
22 H SER 6 H SER 6 -5.000 11.483 4.647
23 HA SER 6 HA SER 6 -4.056 8.955 4.517
24 HB2 SER 6 1HB SER 6 -4.638 8.989 2.063
25 HB3 SER 6 2HB SER 6 -5.901 9.609 3.126
26 HG SER 6 HG SER 6 -5.768 11.429 2.106
27 H GLY 7 H GLY 7 -2.758 11.617 2.520
28 HA2 GLY 7 1HA GLY 7 -0.184 11.625 2.730
29 HA3 GLY 7 2HA GLY 7 -0.340 10.000 2.079
30 H VAL 8 H VAL 8 -2.655 10.908 0.397
31 HA VAL 8 HA VAL 8 -2.958 11.508 -1.781
32 HB VAL 8 HB VAL 8 -1.043 13.770 -1.245
33 HG11 VAL 8 1HG1 VAL 8 -2.218 13.180 -3.538
34 HG12 VAL 8 2HG1 VAL 8 -3.570 14.030 -2.787
35 HG13 VAL 8 3HG1 VAL 8 -2.022 14.849 -3.002
36 HG21 VAL 8 3HG2 VAL 8 -2.812 13.378 0.579
37 HG22 VAL 8 1HG2 VAL 8 -2.691 14.990 -0.128
38 HG23 VAL 8 2HG2 VAL 8 -3.978 13.898 -0.638
39 H LYS 9 H LYS 9 -1.302 9.476 -1.763
40 HA LYS 9 HA LYS 9 1.244 10.033 -2.963
41 HB2 LYS 9 1HB LYS 9 -0.312 7.544 -2.351
42 HB3 LYS 9 2HB LYS 9 1.100 7.461 -3.396
43 HG2 LYS 9 1HG LYS 9 1.804 6.927 -1.195
44 HG3 LYS 9 2HG LYS 9 2.417 8.539 -1.568
45 HD2 LYS 9 1HD LYS 9 0.717 9.571 -0.249
46 HD3 LYS 9 2HD LYS 9 -0.141 8.041 -0.054
47 HE2 LYS 9 1HE LYS 9 1.086 8.601 1.969
48 HE3 LYS 9 2HE LYS 9 1.752 7.151 1.221
49 HZ1 LYS 9 3HZ LYS 9 3.639 8.333 1.687
50 HZ2 LYS 9 1HZ LYS 9 2.916 9.839 1.418
51 HZ3 LYS 9 2HZ LYS 9 3.342 8.860 0.107
52 HA PRO 10 HA PRO 10 0.004 10.310 -7.177
53 HB2 PRO 10 1HB PRO 10 2.331 9.575 -8.367
54 HB3 PRO 10 2HB PRO 10 2.106 11.145 -7.586
55 HG2 PRO 10 1HG PRO 10 3.434 8.678 -6.531
56 HG3 PRO 10 2HG PRO 10 3.955 10.369 -6.408
57 HD2 PRO 10 1HD PRO 10 2.726 9.072 -4.374
58 HD3 PRO 10 2HD PRO 10 2.526 10.813 -4.655
59 H TYR 11 H TYR 11 1.463 7.358 -5.953
60 HA TYR 11 HA TYR 11 0.209 5.846 -8.144
61 HB2 TYR 11 1HB TYR 11 2.363 4.889 -6.253
62 HB3 TYR 11 2HB TYR 11 1.786 4.077 -7.704
63 HD1 TYR 11 HD1 TYR 11 2.276 5.089 -9.947
64 HD2 TYR 11 HD2 TYR 11 4.057 6.539 -6.365
65 HE1 TYR 11 HE1 TYR 11 4.010 6.221 -11.274
66 HE2 TYR 11 HE2 TYR 11 5.796 7.675 -7.682
67 HH TYR 11 HH TYR 11 6.037 8.570 -10.029
68 H GLY 12 H GLY 12 -1.787 5.274 -7.521
69 HA2 GLY 12 1HA GLY 12 -2.060 3.995 -4.870
70 HA3 GLY 12 2HA GLY 12 -3.311 5.020 -5.559
71 H CYS 13 H CYS 13 -2.386 1.888 -5.067
72 HA CYS 13 HA CYS 13 -3.208 0.641 -7.474
73 HB2 CYS 13 1HB CYS 13 -1.797 -0.412 -5.676
74 HB3 CYS 13 2HB CYS 13 -3.256 -0.558 -4.700
75 H SER 14 H SER 14 -5.159 -0.070 -8.161
76 HA SER 14 HA SER 14 -7.490 0.830 -6.639
77 HB2 SER 14 1HB SER 14 -7.012 1.301 -9.182
78 HB3 SER 14 2HB SER 14 -7.676 -0.318 -9.400
79 HG SER 14 HG SER 14 -8.933 2.031 -8.677
80 H GLU 15 H GLU 15 -6.115 -2.067 -8.115
81 HA GLU 15 HA GLU 15 -8.074 -3.914 -7.927
82 HB2 GLU 15 1HB GLU 15 -5.145 -4.089 -7.328
83 HB3 GLU 15 2HB GLU 15 -6.167 -5.496 -7.068
84 HG2 GLU 15 1HG GLU 15 -5.520 -5.904 -9.198
85 HG3 GLU 15 2HG GLU 15 -6.955 -4.933 -9.525
86 H CYS 16 H CYS 16 -5.907 -3.111 -5.208
87 HA CYS 16 HA CYS 16 -7.892 -4.268 -3.377
88 HB2 CYS 16 1HB CYS 16 -6.078 -4.389 -1.738
89 HB3 CYS 16 2HB CYS 16 -5.628 -5.212 -3.228
90 H GLY 17 H GLY 17 -5.851 -1.410 -3.873
91 HA2 GLY 17 1HA GLY 17 -6.890 0.774 -3.525
92 HA3 GLY 17 2HA GLY 17 -7.713 0.083 -2.134
93 H LYS 18 H LYS 18 -4.340 0.278 -3.281
94 HA LYS 18 HA LYS 18 -3.603 1.239 -0.593
95 HB2 LYS 18 1HB LYS 18 -2.232 -0.688 -2.439
96 HB3 LYS 18 2HB LYS 18 -1.295 0.232 -1.270
97 HG2 LYS 18 1HG LYS 18 -2.819 -0.674 0.510
98 HG3 LYS 18 2HG LYS 18 -3.488 -1.749 -0.721
99 HD2 LYS 18 1HD LYS 18 -1.530 -2.963 -0.912
100 HD3 LYS 18 2HD LYS 18 -0.531 -1.642 -0.300
101 HE2 LYS 18 1HE LYS 18 -1.042 -2.101 1.902
102 HE3 LYS 18 2HE LYS 18 -2.560 -2.900 1.492
103 HZ1 LYS 18 3HZ LYS 18 0.149 -3.977 1.555
104 HZ2 LYS 18 1HZ LYS 18 -0.869 -4.553 0.333
105 HZ3 LYS 18 2HZ LYS 18 -1.319 -4.715 1.955
106 H ALA 19 H ALA 19 -1.293 2.298 -0.736
107 HA ALA 19 HA ALA 19 -0.991 3.893 -3.164
108 HB1 ALA 19 3HB ALA 19 -1.953 5.692 -2.288
109 HB2 ALA 19 1HB ALA 19 -2.138 4.898 -0.723
110 HB3 ALA 19 2HB ALA 19 -0.643 5.752 -1.109
111 H PHE 20 H PHE 20 1.087 4.187 -3.679
112 HA PHE 20 HA PHE 20 3.112 3.804 -1.576
113 HB2 PHE 20 1HB PHE 20 3.495 2.929 -4.436
114 HB3 PHE 20 2HB PHE 20 4.477 2.519 -3.033
115 HD1 PHE 20 HD1 PHE 20 1.154 2.011 -4.582
116 HD2 PHE 20 HD2 PHE 20 4.010 0.619 -1.750
117 HE1 PHE 20 HE1 PHE 20 -0.162 -0.045 -4.270
118 HE2 PHE 20 HE2 PHE 20 2.699 -1.439 -1.434
119 HZ PHE 20 HZ PHE 20 0.610 -1.773 -2.695
120 H ARG 21 H ARG 21 4.053 5.708 -1.257
121 HA ARG 21 HA ARG 21 4.002 7.969 -2.734
122 HB2 ARG 21 1HB ARG 21 4.999 7.936 -0.535
123 HB3 ARG 21 2HB ARG 21 6.316 6.917 -1.102
124 HG2 ARG 21 1HG ARG 21 7.331 8.965 -1.065
125 HG3 ARG 21 2HG ARG 21 6.760 8.909 -2.734
126 HD2 ARG 21 1HD ARG 21 4.681 10.105 -1.911
127 HD3 ARG 21 2HD ARG 21 5.551 10.373 -0.401
128 HE ARG 21 HE ARG 21 7.037 11.235 -2.684
129 HH11 ARG 21 1HH1 ARG 21 4.500 12.124 -0.472
130 HH12 ARG 21 2HH1 ARG 21 4.728 13.828 -0.691
131 HH21 ARG 21 1HH2 ARG 21 7.346 13.476 -2.981
132 HH22 ARG 21 2HH2 ARG 21 6.346 14.595 -2.119
133 H SER 22 H SER 22 6.214 5.258 -3.192
134 HA SER 22 HA SER 22 7.251 6.564 -5.617
135 HB2 SER 22 1HB SER 22 8.430 4.326 -3.954
136 HB3 SER 22 2HB SER 22 9.136 4.948 -5.445
137 HG SER 22 HG SER 22 10.005 6.454 -4.287
138 H LYS 23 H LYS 23 7.588 5.237 -7.509
139 HA LYS 23 HA LYS 23 5.336 3.594 -8.087
140 HB2 LYS 23 1HB LYS 23 6.389 3.294 -10.289
141 HB3 LYS 23 2HB LYS 23 6.354 4.985 -9.809
142 HG2 LYS 23 1HG LYS 23 8.766 4.414 -8.903
143 HG3 LYS 23 2HG LYS 23 8.662 3.147 -10.127
144 HD2 LYS 23 1HD LYS 23 7.877 5.909 -10.901
145 HD3 LYS 23 2HD LYS 23 9.595 5.562 -10.690
146 HE2 LYS 23 1HE LYS 23 9.162 5.161 -12.964
147 HE3 LYS 23 2HE LYS 23 9.217 3.565 -12.219
148 HZ1 LYS 23 3HZ LYS 23 7.250 3.232 -13.167
149 HZ2 LYS 23 1HZ LYS 23 7.056 4.866 -13.561
150 HZ3 LYS 23 2HZ LYS 23 6.598 4.305 -12.032
151 H SER 24 H SER 24 8.809 2.923 -7.721
152 HA SER 24 HA SER 24 8.874 0.242 -8.287
153 HB2 SER 24 1HB SER 24 10.916 1.411 -7.805
154 HB3 SER 24 2HB SER 24 10.385 1.776 -6.164
155 HG SER 24 HG SER 24 11.826 0.009 -6.203
156 H TYR 25 H TYR 25 7.978 1.766 -5.216
157 HA TYR 25 HA TYR 25 7.683 -0.511 -3.657
158 HB2 TYR 25 1HB TYR 25 6.402 2.198 -3.614
159 HB3 TYR 25 2HB TYR 25 5.831 0.950 -2.512
160 HD1 TYR 25 HD2 TYR 25 9.078 2.421 -3.651
161 HD2 TYR 25 HD1 TYR 25 6.779 0.895 -0.413
162 HE1 TYR 25 HE2 TYR 25 10.912 2.958 -2.104
163 HE2 TYR 25 HE1 TYR 25 8.606 1.428 1.144
164 HH TYR 25 HH TYR 25 11.410 1.734 0.654
165 H LEU 26 H LEU 26 5.379 1.022 -5.861
166 HA LEU 26 HA LEU 26 3.133 -0.523 -5.275
167 HB2 LEU 26 1HB LEU 26 2.941 1.436 -6.632
168 HB3 LEU 26 2HB LEU 26 4.025 0.762 -7.848
169 HG LEU 26 HG LEU 26 2.289 -0.966 -8.332
170 HD11 LEU 26 1HD1 LEU 26 -0.047 0.160 -7.479
171 HD12 LEU 26 2HD1 LEU 26 1.005 0.380 -6.081
172 HD13 LEU 26 3HD1 LEU 26 0.743 -1.234 -6.741
173 HD21 LEU 26 3HD2 LEU 26 1.380 1.891 -8.659
174 HD22 LEU 26 1HD2 LEU 26 0.882 0.509 -9.636
175 HD23 LEU 26 2HD2 LEU 26 2.553 1.072 -9.691
176 H ILE 27 H ILE 27 5.485 -1.008 -7.915
177 HA ILE 27 HA ILE 27 4.553 -3.335 -8.990
178 HB ILE 27 HB ILE 27 7.451 -2.643 -8.499
179 HG12 ILE 27 1HG1 ILE 27 5.988 -2.305 -11.095
180 HG13 ILE 27 2HG1 ILE 27 5.845 -1.075 -9.844
181 HG21 ILE 27 1HG2 ILE 27 8.042 -4.228 -10.147
182 HG22 ILE 27 2HG2 ILE 27 6.933 -5.055 -9.053
183 HG23 ILE 27 3HG2 ILE 27 6.360 -4.476 -10.617
184 HD11 ILE 27 3HD1 ILE 27 7.559 -0.415 -11.355
185 HD12 ILE 27 1HD1 ILE 27 8.326 -0.895 -9.841
186 HD13 ILE 27 2HD1 ILE 27 8.352 -1.985 -11.228
187 H ILE 28 H ILE 28 6.977 -3.177 -6.375
188 HA ILE 28 HA ILE 28 7.310 -5.812 -5.811
189 HB ILE 28 HB ILE 28 7.010 -3.616 -3.759
190 HG12 ILE 28 1HG1 ILE 28 9.563 -4.716 -4.929
191 HG13 ILE 28 2HG1 ILE 28 8.727 -3.336 -5.632
192 HG21 ILE 28 1HG2 ILE 28 8.395 -6.285 -3.532
193 HG22 ILE 28 2HG2 ILE 28 8.326 -5.034 -2.292
194 HG23 ILE 28 3HG2 ILE 28 6.852 -5.866 -2.787
195 HD11 ILE 28 3HD1 ILE 28 9.932 -2.078 -4.265
196 HD12 ILE 28 1HD1 ILE 28 8.926 -2.694 -2.955
197 HD13 ILE 28 2HD1 ILE 28 10.464 -3.474 -3.328
198 H HIS 29 H HIS 29 4.434 -3.970 -5.377
199 HA HIS 29 HA HIS 29 3.223 -6.033 -3.689
200 HB2 HIS 29 1HB HIS 29 2.599 -4.009 -2.780
201 HB3 HIS 29 2HB HIS 29 2.559 -3.197 -4.342
202 HD1 HIS 29 HD1 HIS 29 0.529 -5.759 -2.404
203 HD2 HIS 29 HD2 HIS 29 0.060 -2.858 -5.341
204 HE1 HIS 29 HE1 HIS 29 -1.945 -5.639 -2.842
205 H MET 30 H MET 30 2.561 -4.283 -6.720
206 HA MET 30 HA MET 30 0.304 -5.559 -7.575
207 HB2 MET 30 1HB MET 30 2.679 -4.786 -9.279
208 HB3 MET 30 2HB MET 30 1.059 -5.111 -9.881
209 HG2 MET 30 1HG MET 30 1.752 -2.920 -7.940
210 HG3 MET 30 2HG MET 30 1.589 -2.707 -9.682
211 HE1 MET 30 3HE MET 30 -0.758 -2.539 -10.946
212 HE2 MET 30 1HE MET 30 -0.690 -4.277 -10.655
213 HE3 MET 30 2HE MET 30 -2.171 -3.383 -10.311
214 H ARG 31 H ARG 31 3.508 -6.863 -7.342
215 HA ARG 31 HA ARG 31 3.436 -8.978 -9.115
216 HB2 ARG 31 1HB ARG 31 5.138 -10.001 -7.809
217 HB3 ARG 31 2HB ARG 31 5.367 -8.264 -7.652
218 HG2 ARG 31 1HG ARG 31 4.455 -8.253 -5.463
219 HG3 ARG 31 2HG ARG 31 3.883 -9.915 -5.626
220 HD2 ARG 31 1HD ARG 31 6.775 -9.058 -5.641
221 HD3 ARG 31 2HD ARG 31 5.925 -9.737 -4.254
222 HE ARG 31 HE ARG 31 5.837 -11.396 -6.602
223 HH11 ARG 31 1HH1 ARG 31 7.641 -10.559 -3.745
224 HH12 ARG 31 2HH1 ARG 31 8.469 -12.079 -3.664
225 HH21 ARG 31 1HH2 ARG 31 6.920 -13.401 -6.506
226 HH22 ARG 31 2HH2 ARG 31 8.059 -13.694 -5.236
227 H THR 32 H THR 32 1.971 -8.703 -5.927
228 HA THR 32 HA THR 32 1.157 -11.438 -5.772
229 HB THR 32 HB THR 32 -0.270 -10.684 -3.884
230 HG1 THR 32 HG1 THR 32 0.421 -8.196 -4.951
231 HG21 THR 32 3HG2 THR 32 1.778 -11.247 -3.042
232 HG22 THR 32 1HG2 THR 32 1.773 -9.533 -2.630
233 HG23 THR 32 2HG2 THR 32 2.637 -10.093 -4.062
234 H HIS 33 H HIS 33 -0.149 -8.573 -7.206
235 HA HIS 33 HA HIS 33 -2.859 -9.469 -7.356
236 HB2 HIS 33 1HB HIS 33 -1.289 -7.218 -8.541
237 HB3 HIS 33 2HB HIS 33 -2.853 -7.621 -9.242
238 HD1 HIS 33 HD1 HIS 33 -4.383 -8.254 -6.621
239 HD2 HIS 33 HD2 HIS 33 -1.948 -4.937 -7.194
240 HE1 HIS 33 HE1 HIS 33 -5.180 -6.541 -4.962
241 H THR 34 H THR 34 -0.191 -9.292 -9.702
242 HA THR 34 HA THR 34 -1.542 -11.394 -11.258
243 HB THR 34 HB THR 34 -1.838 -9.297 -12.463
244 HG1 THR 34 HG1 THR 34 0.024 -11.153 -13.533
245 HG21 THR 34 3HG2 THR 34 0.731 -8.646 -13.358
246 HG22 THR 34 1HG2 THR 34 0.883 -8.847 -11.613
247 HG23 THR 34 2HG2 THR 34 -0.288 -7.704 -12.270
248 H GLY 35 H GLY 35 -0.259 -13.006 -12.053
249 HA2 GLY 35 1HA GLY 35 2.614 -12.749 -12.127
250 HA3 GLY 35 2HA GLY 35 2.034 -13.786 -10.832
251 H GLU 36 H GLU 36 1.759 -15.871 -11.283
252 HA GLU 36 HA GLU 36 1.623 -16.654 -14.120
253 HB2 GLU 36 1HB GLU 36 2.958 -17.947 -11.758
254 HB3 GLU 36 2HB GLU 36 2.543 -18.882 -13.187
255 HG2 GLU 36 1HG GLU 36 4.874 -18.101 -13.185
256 HG3 GLU 36 2HG GLU 36 3.949 -17.508 -14.563
257 H LYS 37 H LYS 37 -0.697 -16.436 -14.011
258 HA LYS 37 HA LYS 37 -1.957 -18.802 -12.802
259 HB2 LYS 37 1HB LYS 37 -2.910 -15.946 -12.700
260 HB3 LYS 37 2HB LYS 37 -4.006 -17.302 -12.469
261 HG2 LYS 37 1HG LYS 37 -3.479 -16.853 -10.304
262 HG3 LYS 37 2HG LYS 37 -2.204 -18.013 -10.683
263 HD2 LYS 37 1HD LYS 37 -0.583 -16.341 -10.885
264 HD3 LYS 37 2HD LYS 37 -1.790 -15.066 -11.068
265 HE2 LYS 37 1HE LYS 37 -1.188 -14.705 -8.899
266 HE3 LYS 37 2HE LYS 37 -2.482 -15.875 -8.647
267 HZ1 LYS 37 3HZ LYS 37 -0.022 -17.207 -9.072
268 HZ2 LYS 37 1HZ LYS 37 -1.052 -17.274 -7.731
269 HZ3 LYS 37 2HZ LYS 37 0.145 -16.083 -7.819
270 HA PRO 38 HA PRO 38 -2.875 -18.634 -17.319
271 HB2 PRO 38 1HB PRO 38 -2.662 -21.316 -17.679
272 HB3 PRO 38 2HB PRO 38 -1.270 -20.227 -17.727
273 HG2 PRO 38 1HG PRO 38 -2.240 -21.965 -15.491
274 HG3 PRO 38 2HG PRO 38 -0.582 -21.691 -16.057
275 HD2 PRO 38 1HD PRO 38 -1.598 -20.452 -13.875
276 HD3 PRO 38 2HD PRO 38 -0.393 -19.689 -14.932
277 H SER 39 H SER 39 -5.023 -18.009 -16.474
278 HA SER 39 HA SER 39 -6.912 -20.200 -16.841
279 HB2 SER 39 1HB SER 39 -6.713 -18.505 -14.363
280 HB3 SER 39 2HB SER 39 -8.252 -19.211 -14.854
281 HG SER 39 HG SER 39 -6.040 -20.899 -14.794
282 H GLY 40 H GLY 40 -8.842 -19.587 -17.757
283 HA2 GLY 40 1HA GLY 40 -8.866 -16.972 -18.988
284 HA3 GLY 40 2HA GLY 40 -10.020 -18.268 -19.264
285 HA PRO 41 HA PRO 41 -12.239 -15.000 -16.899
286 HB2 PRO 41 1HB PRO 41 -14.558 -15.269 -18.284
287 HB3 PRO 41 2HB PRO 41 -13.227 -14.241 -18.829
288 HG2 PRO 41 1HG PRO 41 -13.960 -17.010 -19.698
289 HG3 PRO 41 2HG PRO 41 -13.456 -15.625 -20.683
290 HD2 PRO 41 1HD PRO 41 -11.761 -17.626 -20.009
291 HD3 PRO 41 2HD PRO 41 -11.222 -15.948 -20.221
292 H SER 42 H SER 42 -13.518 -15.346 -15.159
293 HA SER 42 HA SER 42 -14.599 -18.063 -14.813
294 HB2 SER 42 1HB SER 42 -12.787 -16.985 -13.221
295 HB3 SER 42 2HB SER 42 -14.196 -16.205 -12.502
296 HG SER 42 HG SER 42 -13.626 -18.260 -11.553
297 H SER 43 H SER 43 -16.576 -18.232 -13.487
298 HA SER 43 HA SER 43 -18.275 -15.878 -13.392
299 HB2 SER 43 1HB SER 43 -18.775 -16.569 -15.621
300 HB3 SER 43 2HB SER 43 -18.871 -18.264 -15.146
301 HG SER 43 HG SER 43 -20.687 -16.170 -14.623
302 H GLY 44 H GLY 44 -18.993 -15.934 -11.369
303 HA2 GLY 44 1HA GLY 44 -20.826 -17.366 -10.182
304 HA3 GLY 44 2HA GLY 44 -19.510 -18.529 -10.102
Start of MODEL 9
1 H1 GLY 1 H GLY 1 -11.180 -4.270 -1.599
2 HA2 GLY 1 1HA GLY 1 -12.010 -2.948 0.246
3 HA3 GLY 1 2HA GLY 1 -11.383 -4.444 0.922
4 H SER 2 H SER 2 -9.206 -4.435 1.783
5 HA SER 2 HA SER 2 -8.646 -2.641 3.680
6 HB2 SER 2 1HB SER 2 -6.282 -3.264 3.547
7 HB3 SER 2 2HB SER 2 -7.305 -4.676 3.284
8 HG SER 2 HG SER 2 -6.987 -3.850 0.920
9 H SER 3 H SER 3 -8.503 -0.507 3.706
10 HA SER 3 HA SER 3 -6.641 0.942 2.153
11 HB2 SER 3 1HB SER 3 -7.980 2.093 0.603
12 HB3 SER 3 2HB SER 3 -8.556 0.430 0.491
13 HG SER 3 HG SER 3 -10.059 1.349 2.297
14 H GLY 4 H GLY 4 -6.254 2.924 3.035
15 HA2 GLY 4 1HA GLY 4 -7.860 4.716 4.254
16 HA3 GLY 4 2HA GLY 4 -7.621 3.517 5.516
17 H SER 5 H SER 5 -6.038 5.892 3.477
18 HA SER 5 HA SER 5 -3.955 6.168 5.512
19 HB2 SER 5 1HB SER 5 -3.522 5.462 2.636
20 HB3 SER 5 2HB SER 5 -2.345 6.495 3.448
21 HG SER 5 HG SER 5 -3.187 3.923 4.312
22 H SER 6 H SER 6 -3.186 8.232 5.767
23 HA SER 6 HA SER 6 -4.788 10.328 4.592
24 HB2 SER 6 1HB SER 6 -3.882 10.127 7.049
25 HB3 SER 6 2HB SER 6 -2.433 10.866 6.367
26 HG SER 6 HG SER 6 -4.566 12.109 7.166
27 H GLY 7 H GLY 7 -4.227 11.654 2.976
28 HA2 GLY 7 1HA GLY 7 -2.451 13.004 1.935
29 HA3 GLY 7 2HA GLY 7 -1.417 11.589 2.065
30 H VAL 8 H VAL 8 -1.725 12.887 -0.340
31 HA VAL 8 HA VAL 8 -3.382 10.993 -1.877
32 HB VAL 8 HB VAL 8 -2.672 13.836 -2.616
33 HG11 VAL 8 1HG1 VAL 8 -2.811 12.762 -4.658
34 HG12 VAL 8 2HG1 VAL 8 -4.033 11.621 -4.093
35 HG13 VAL 8 3HG1 VAL 8 -4.472 13.300 -4.411
36 HG21 VAL 8 3HG2 VAL 8 -5.263 12.583 -1.718
37 HG22 VAL 8 1HG2 VAL 8 -4.335 13.835 -0.891
38 HG23 VAL 8 2HG2 VAL 8 -5.133 14.194 -2.423
39 H LYS 9 H LYS 9 -1.727 9.494 -2.172
40 HA LYS 9 HA LYS 9 0.823 10.278 -3.247
41 HB2 LYS 9 1HB LYS 9 -0.490 7.690 -2.529
42 HB3 LYS 9 2HB LYS 9 0.916 7.661 -3.586
43 HG2 LYS 9 1HG LYS 9 1.795 7.355 -1.455
44 HG3 LYS 9 2HG LYS 9 2.070 9.066 -1.789
45 HD2 LYS 9 1HD LYS 9 -0.162 9.460 -0.589
46 HD3 LYS 9 2HD LYS 9 0.013 7.806 0.002
47 HE2 LYS 9 1HE LYS 9 2.316 9.668 0.296
48 HE3 LYS 9 2HE LYS 9 0.931 9.876 1.367
49 HZ1 LYS 9 3HZ LYS 9 1.364 7.961 2.448
50 HZ2 LYS 9 1HZ LYS 9 2.942 8.242 1.904
51 HZ3 LYS 9 2HZ LYS 9 1.940 7.163 1.071
52 HA PRO 10 HA PRO 10 -0.171 10.217 -7.531
53 HB2 PRO 10 1HB PRO 10 2.266 9.595 -8.555
54 HB3 PRO 10 2HB PRO 10 1.886 11.182 -7.875
55 HG2 PRO 10 1HG PRO 10 3.323 8.876 -6.617
56 HG3 PRO 10 2HG PRO 10 3.716 10.605 -6.561
57 HD2 PRO 10 1HD PRO 10 2.470 9.327 -4.525
58 HD3 PRO 10 2HD PRO 10 2.164 11.033 -4.912
59 H TYR 11 H TYR 11 1.470 7.450 -6.102
60 HA TYR 11 HA TYR 11 0.407 5.739 -8.247
61 HB2 TYR 11 1HB TYR 11 2.501 4.900 -6.255
62 HB3 TYR 11 2HB TYR 11 2.144 4.201 -7.830
63 HD1 TYR 11 HD1 TYR 11 2.720 5.538 -9.902
64 HD2 TYR 11 HD2 TYR 11 4.114 6.598 -6.025
65 HE1 TYR 11 HE1 TYR 11 4.482 6.918 -10.920
66 HE2 TYR 11 HE2 TYR 11 5.880 7.982 -7.032
67 HH TYR 11 HH TYR 11 7.065 7.775 -9.728
68 H GLY 12 H GLY 12 -1.615 5.216 -7.571
69 HA2 GLY 12 1HA GLY 12 -1.808 3.872 -4.946
70 HA3 GLY 12 2HA GLY 12 -3.082 4.913 -5.565
71 H CYS 13 H CYS 13 -2.230 1.785 -5.129
72 HA CYS 13 HA CYS 13 -3.058 0.581 -7.562
73 HB2 CYS 13 1HB CYS 13 -1.662 -0.575 -5.878
74 HB3 CYS 13 2HB CYS 13 -3.032 -0.592 -4.772
75 H SER 14 H SER 14 -5.010 -0.356 -8.136
76 HA SER 14 HA SER 14 -7.333 0.623 -6.621
77 HB2 SER 14 1HB SER 14 -8.581 0.264 -8.773
78 HB3 SER 14 2HB SER 14 -7.307 1.480 -8.872
79 HG SER 14 HG SER 14 -5.965 -0.153 -9.794
80 H GLU 15 H GLU 15 -5.913 -2.218 -8.132
81 HA GLU 15 HA GLU 15 -7.878 -4.078 -8.055
82 HB2 GLU 15 1HB GLU 15 -5.012 -4.415 -7.162
83 HB3 GLU 15 2HB GLU 15 -6.112 -5.755 -7.456
84 HG2 GLU 15 1HG GLU 15 -5.480 -3.703 -9.552
85 HG3 GLU 15 2HG GLU 15 -4.510 -5.156 -9.319
86 H CYS 16 H CYS 16 -5.880 -3.127 -5.270
87 HA CYS 16 HA CYS 16 -7.852 -4.426 -3.510
88 HB2 CYS 16 1HB CYS 16 -6.043 -4.460 -1.809
89 HB3 CYS 16 2HB CYS 16 -5.641 -5.383 -3.253
90 H GLY 17 H GLY 17 -5.858 -1.527 -3.930
91 HA2 GLY 17 1HA GLY 17 -6.893 0.640 -3.562
92 HA3 GLY 17 2HA GLY 17 -7.796 -0.080 -2.238
93 H LYS 18 H LYS 18 -4.376 0.237 -3.206
94 HA LYS 18 HA LYS 18 -3.810 1.274 -0.514
95 HB2 LYS 18 1HB LYS 18 -2.232 -0.827 -2.006
96 HB3 LYS 18 2HB LYS 18 -1.656 -0.004 -0.563
97 HG2 LYS 18 1HG LYS 18 -3.835 -0.869 0.519
98 HG3 LYS 18 2HG LYS 18 -3.871 -1.991 -0.844
99 HD2 LYS 18 1HD LYS 18 -1.397 -2.458 -0.159
100 HD3 LYS 18 2HD LYS 18 -1.896 -1.777 1.391
101 HE2 LYS 18 1HE LYS 18 -3.503 -3.935 0.074
102 HE3 LYS 18 2HE LYS 18 -2.069 -4.333 1.020
103 HZ1 LYS 18 3HZ LYS 18 -3.026 -3.466 2.954
104 HZ2 LYS 18 1HZ LYS 18 -4.276 -4.342 2.225
105 HZ3 LYS 18 2HZ LYS 18 -4.247 -2.655 2.110
106 H ALA 19 H ALA 19 -2.318 2.901 -0.399
107 HA ALA 19 HA ALA 19 -1.510 4.067 -2.956
108 HB1 ALA 19 3HB ALA 19 -0.933 5.530 -0.467
109 HB2 ALA 19 1HB ALA 19 -1.646 6.092 -1.979
110 HB3 ALA 19 2HB ALA 19 -2.639 5.231 -0.802
111 H PHE 20 H PHE 20 0.633 4.789 -3.336
112 HA PHE 20 HA PHE 20 2.689 3.611 -1.599
113 HB2 PHE 20 1HB PHE 20 2.686 3.487 -4.622
114 HB3 PHE 20 2HB PHE 20 3.954 2.877 -3.564
115 HD1 PHE 20 HD1 PHE 20 0.303 2.501 -4.201
116 HD2 PHE 20 HD2 PHE 20 3.932 0.656 -2.957
117 HE1 PHE 20 HE1 PHE 20 -0.844 0.327 -4.089
118 HE2 PHE 20 HE2 PHE 20 2.791 -1.521 -2.845
119 HZ PHE 20 HZ PHE 20 0.400 -1.688 -3.412
120 H ARG 21 H ARG 21 4.352 4.924 -1.147
121 HA ARG 21 HA ARG 21 4.316 7.605 -2.263
122 HB2 ARG 21 1HB ARG 21 5.912 8.154 -0.515
123 HB3 ARG 21 2HB ARG 21 4.549 7.279 0.170
124 HG2 ARG 21 1HG ARG 21 5.797 5.401 0.610
125 HG3 ARG 21 2HG ARG 21 6.991 5.774 -0.634
126 HD2 ARG 21 1HD ARG 21 8.198 6.305 1.230
127 HD3 ARG 21 2HD ARG 21 7.436 7.863 0.914
128 HE ARG 21 HE ARG 21 6.276 7.643 2.869
129 HH11 ARG 21 1HH1 ARG 21 7.502 4.524 1.928
130 HH12 ARG 21 2HH1 ARG 21 7.015 3.744 3.397
131 HH21 ARG 21 1HH2 ARG 21 5.630 6.628 4.807
132 HH22 ARG 21 2HH2 ARG 21 5.949 4.942 5.033
133 H SER 22 H SER 22 5.389 4.984 -3.569
134 HA SER 22 HA SER 22 7.536 6.277 -4.973
135 HB2 SER 22 1HB SER 22 8.787 5.458 -3.043
136 HB3 SER 22 2HB SER 22 8.137 3.837 -3.283
137 HG SER 22 HG SER 22 9.152 4.300 -5.547
138 H LYS 23 H LYS 23 7.828 5.437 -6.988
139 HA LYS 23 HA LYS 23 5.841 3.921 -8.171
140 HB2 LYS 23 1HB LYS 23 7.350 5.311 -9.472
141 HB3 LYS 23 2HB LYS 23 8.714 4.288 -9.039
142 HG2 LYS 23 1HG LYS 23 8.087 3.729 -11.253
143 HG3 LYS 23 2HG LYS 23 7.559 2.403 -10.215
144 HD2 LYS 23 1HD LYS 23 5.718 2.748 -11.587
145 HD3 LYS 23 2HD LYS 23 5.306 3.673 -10.142
146 HE2 LYS 23 1HE LYS 23 6.130 5.715 -11.242
147 HE3 LYS 23 2HE LYS 23 6.484 4.776 -12.692
148 HZ1 LYS 23 3HZ LYS 23 3.778 5.010 -11.497
149 HZ2 LYS 23 1HZ LYS 23 4.181 4.316 -12.986
150 HZ3 LYS 23 2HZ LYS 23 4.338 5.984 -12.762
151 H SER 24 H SER 24 9.178 2.712 -7.970
152 HA SER 24 HA SER 24 8.821 0.098 -8.443
153 HB2 SER 24 1HB SER 24 10.626 1.430 -6.436
154 HB3 SER 24 2HB SER 24 10.665 -0.316 -6.678
155 HG SER 24 HG SER 24 11.293 1.741 -8.503
156 H TYR 25 H TYR 25 8.394 1.579 -5.237
157 HA TYR 25 HA TYR 25 7.788 -0.576 -3.697
158 HB2 TYR 25 1HB TYR 25 7.813 1.874 -3.020
159 HB3 TYR 25 2HB TYR 25 6.150 1.958 -3.592
160 HD1 TYR 25 HD2 TYR 25 7.861 -0.761 -1.706
161 HD2 TYR 25 HD1 TYR 25 4.874 2.268 -1.667
162 HE1 TYR 25 HE2 TYR 25 7.074 -1.574 0.477
163 HE2 TYR 25 HE1 TYR 25 4.079 1.465 0.517
164 HH TYR 25 HH TYR 25 4.129 -0.625 1.839
165 H LEU 26 H LEU 26 5.581 1.098 -5.906
166 HA LEU 26 HA LEU 26 3.287 -0.424 -5.291
167 HB2 LEU 26 1HB LEU 26 3.007 1.647 -6.408
168 HB3 LEU 26 2HB LEU 26 4.088 1.166 -7.714
169 HG LEU 26 HG LEU 26 2.358 -0.564 -8.344
170 HD11 LEU 26 1HD1 LEU 26 1.204 -0.461 -6.114
171 HD12 LEU 26 2HD1 LEU 26 0.143 -0.371 -7.520
172 HD13 LEU 26 3HD1 LEU 26 0.535 1.092 -6.616
173 HD21 LEU 26 3HD2 LEU 26 1.587 2.349 -8.474
174 HD22 LEU 26 1HD2 LEU 26 0.938 1.068 -9.498
175 HD23 LEU 26 2HD2 LEU 26 2.645 1.497 -9.600
176 H ILE 27 H ILE 27 5.409 -0.623 -8.156
177 HA ILE 27 HA ILE 27 4.391 -2.827 -9.382
178 HB ILE 27 HB ILE 27 7.305 -2.114 -9.055
179 HG12 ILE 27 1HG1 ILE 27 6.742 -1.495 -11.587
180 HG13 ILE 27 2HG1 ILE 27 5.120 -1.325 -10.924
181 HG21 ILE 27 1HG2 ILE 27 7.808 -3.581 -10.870
182 HG22 ILE 27 2HG2 ILE 27 6.922 -4.507 -9.659
183 HG23 ILE 27 3HG2 ILE 27 6.101 -3.949 -11.117
184 HD11 ILE 27 3HD1 ILE 27 6.972 0.004 -9.212
185 HD12 ILE 27 1HD1 ILE 27 7.223 0.535 -10.875
186 HD13 ILE 27 2HD1 ILE 27 5.627 0.673 -10.136
187 H ILE 28 H ILE 28 6.877 -2.884 -6.829
188 HA ILE 28 HA ILE 28 7.293 -5.584 -6.607
189 HB ILE 28 HB ILE 28 7.087 -3.651 -4.295
190 HG12 ILE 28 1HG1 ILE 28 9.669 -4.464 -5.559
191 HG13 ILE 28 2HG1 ILE 28 8.689 -3.242 -6.363
192 HG21 ILE 28 1HG2 ILE 28 8.346 -5.168 -3.020
193 HG22 ILE 28 2HG2 ILE 28 7.112 -6.149 -3.809
194 HG23 ILE 28 3HG2 ILE 28 8.762 -6.139 -4.432
195 HD11 ILE 28 3HD1 ILE 28 10.558 -2.680 -4.537
196 HD12 ILE 28 1HD1 ILE 28 9.132 -1.679 -4.808
197 HD13 ILE 28 2HD1 ILE 28 9.154 -2.843 -3.483
198 H HIS 29 H HIS 29 4.515 -3.743 -5.574
199 HA HIS 29 HA HIS 29 3.387 -6.012 -4.138
200 HB2 HIS 29 1HB HIS 29 2.843 -4.104 -2.965
201 HB3 HIS 29 2HB HIS 29 2.697 -3.122 -4.420
202 HD1 HIS 29 HD1 HIS 29 0.766 -5.499 -2.261
203 HD2 HIS 29 HD2 HIS 29 0.162 -3.064 -5.572
204 HE1 HIS 29 HE1 HIS 29 -1.725 -5.432 -2.600
205 H MET 30 H MET 30 2.827 -4.125 -7.068
206 HA MET 30 HA MET 30 0.407 -5.016 -7.930
207 HB2 MET 30 1HB MET 30 2.931 -4.316 -9.353
208 HB3 MET 30 2HB MET 30 1.633 -5.048 -10.286
209 HG2 MET 30 1HG MET 30 0.969 -2.752 -8.528
210 HG3 MET 30 2HG MET 30 1.861 -2.437 -10.015
211 HE1 MET 30 3HE MET 30 -1.282 -3.926 -8.392
212 HE2 MET 30 1HE MET 30 -2.360 -4.259 -9.747
213 HE3 MET 30 2HE MET 30 -0.947 -5.278 -9.475
214 H ARG 31 H ARG 31 3.500 -6.726 -8.285
215 HA ARG 31 HA ARG 31 2.810 -8.877 -9.793
216 HB2 ARG 31 1HB ARG 31 4.556 -10.114 -8.723
217 HB3 ARG 31 2HB ARG 31 5.055 -8.429 -8.771
218 HG2 ARG 31 1HG ARG 31 4.437 -8.156 -6.438
219 HG3 ARG 31 2HG ARG 31 3.874 -9.828 -6.381
220 HD2 ARG 31 1HD ARG 31 6.006 -10.690 -6.450
221 HD3 ARG 31 2HD ARG 31 6.666 -9.271 -7.263
222 HE ARG 31 HE ARG 31 5.887 -8.403 -4.773
223 HH11 ARG 31 1HH1 ARG 31 8.075 -10.797 -6.039
224 HH12 ARG 31 2HH1 ARG 31 9.169 -10.694 -4.699
225 HH21 ARG 31 1HH2 ARG 31 7.320 -8.258 -3.004
226 HH22 ARG 31 2HH2 ARG 31 8.738 -9.250 -2.973
227 H THR 32 H THR 32 2.121 -8.426 -6.353
228 HA THR 32 HA THR 32 1.171 -10.870 -5.608
229 HB THR 32 HB THR 32 -0.272 -9.773 -4.000
230 HG1 THR 32 HG1 THR 32 -1.300 -8.144 -4.985
231 HG21 THR 32 3HG2 THR 32 1.487 -7.823 -3.387
232 HG22 THR 32 1HG2 THR 32 2.458 -8.768 -4.514
233 HG23 THR 32 2HG2 THR 32 1.783 -9.533 -3.076
234 H HIS 33 H HIS 33 -0.769 -8.309 -7.155
235 HA HIS 33 HA HIS 33 -3.124 -9.841 -7.379
236 HB2 HIS 33 1HB HIS 33 -2.157 -7.433 -8.927
237 HB3 HIS 33 2HB HIS 33 -3.766 -8.126 -9.111
238 HD1 HIS 33 HD1 HIS 33 -5.164 -8.219 -6.733
239 HD2 HIS 33 HD2 HIS 33 -2.021 -5.517 -7.022
240 HE1 HIS 33 HE1 HIS 33 -5.554 -6.536 -4.905
241 H THR 34 H THR 34 -0.431 -9.294 -9.605
242 HA THR 34 HA THR 34 -1.514 -11.430 -11.324
243 HB THR 34 HB THR 34 -1.511 -9.584 -12.733
244 HG1 THR 34 HG1 THR 34 1.165 -10.305 -13.218
245 HG21 THR 34 3HG2 THR 34 1.026 -8.749 -11.342
246 HG22 THR 34 1HG2 THR 34 -0.526 -7.912 -11.372
247 HG23 THR 34 2HG2 THR 34 0.462 -7.992 -12.831
248 H GLY 35 H GLY 35 -0.410 -12.933 -9.868
249 HA2 GLY 35 1HA GLY 35 2.515 -12.898 -10.024
250 HA3 GLY 35 2HA GLY 35 1.547 -13.925 -8.977
251 H GLU 36 H GLU 36 3.494 -15.203 -10.174
252 HA GLU 36 HA GLU 36 2.427 -16.392 -12.634
253 HB2 GLU 36 1HB GLU 36 5.165 -16.532 -11.366
254 HB3 GLU 36 2HB GLU 36 4.701 -17.447 -12.793
255 HG2 GLU 36 1HG GLU 36 4.420 -14.472 -12.729
256 HG3 GLU 36 2HG GLU 36 5.971 -15.230 -13.085
257 H LYS 37 H LYS 37 0.814 -17.676 -11.685
258 HA LYS 37 HA LYS 37 1.780 -19.866 -9.971
259 HB2 LYS 37 1HB LYS 37 -0.806 -18.406 -10.162
260 HB3 LYS 37 2HB LYS 37 -0.872 -20.115 -9.752
261 HG2 LYS 37 1HG LYS 37 0.316 -19.808 -7.767
262 HG3 LYS 37 2HG LYS 37 0.916 -18.224 -8.267
263 HD2 LYS 37 1HD LYS 37 -1.058 -17.166 -7.763
264 HD3 LYS 37 2HD LYS 37 -2.026 -18.621 -8.016
265 HE2 LYS 37 1HE LYS 37 -1.437 -19.507 -5.924
266 HE3 LYS 37 2HE LYS 37 -0.082 -18.394 -5.739
267 HZ1 LYS 37 3HZ LYS 37 -2.461 -18.046 -4.586
268 HZ2 LYS 37 1HZ LYS 37 -2.686 -17.150 -6.004
269 HZ3 LYS 37 2HZ LYS 37 -1.408 -16.776 -4.961
270 HA PRO 38 HA PRO 38 0.979 -22.902 -13.035
271 HB2 PRO 38 1HB PRO 38 -0.115 -24.927 -11.594
272 HB3 PRO 38 2HB PRO 38 1.595 -24.491 -11.494
273 HG2 PRO 38 1HG PRO 38 -0.655 -23.770 -9.655
274 HG3 PRO 38 2HG PRO 38 0.993 -24.290 -9.257
275 HD2 PRO 38 1HD PRO 38 0.229 -21.693 -9.191
276 HD3 PRO 38 2HD PRO 38 1.877 -22.192 -9.620
277 H SER 39 H SER 39 -1.551 -21.364 -11.438
278 HA SER 39 HA SER 39 -3.609 -22.760 -13.001
279 HB2 SER 39 1HB SER 39 -3.801 -20.919 -10.611
280 HB3 SER 39 2HB SER 39 -5.207 -21.470 -11.522
281 HG SER 39 HG SER 39 -3.411 -23.412 -10.654
282 H GLY 40 H GLY 40 -2.898 -19.405 -11.994
283 HA2 GLY 40 1HA GLY 40 -3.042 -17.424 -13.146
284 HA3 GLY 40 2HA GLY 40 -2.837 -18.368 -14.614
285 HA PRO 41 HA PRO 41 -7.598 -18.335 -13.861
286 HB2 PRO 41 1HB PRO 41 -8.519 -16.946 -11.718
287 HB3 PRO 41 2HB PRO 41 -8.077 -18.656 -11.636
288 HG2 PRO 41 1HG PRO 41 -6.497 -16.249 -10.815
289 HG3 PRO 41 2HG PRO 41 -6.692 -17.799 -9.976
290 HD2 PRO 41 1HD PRO 41 -4.493 -17.201 -11.438
291 HD3 PRO 41 2HD PRO 41 -5.124 -18.854 -11.295
292 H SER 42 H SER 42 -5.717 -15.490 -13.058
293 HA SER 42 HA SER 42 -7.541 -13.485 -13.700
294 HB2 SER 42 1HB SER 42 -5.388 -13.023 -12.622
295 HB3 SER 42 2HB SER 42 -4.539 -13.486 -14.096
296 HG SER 42 HG SER 42 -5.113 -11.652 -15.028
297 H SER 43 H SER 43 -8.378 -12.740 -15.544
298 HA SER 43 HA SER 43 -7.165 -13.612 -18.083
299 HB2 SER 43 1HB SER 43 -9.374 -14.779 -17.327
300 HB3 SER 43 2HB SER 43 -10.136 -13.264 -17.811
301 HG SER 43 HG SER 43 -10.053 -14.815 -19.514
302 H GLY 44 H GLY 44 -7.454 -12.201 -19.875
303 HA2 GLY 44 1HA GLY 44 -8.398 -10.135 -20.768
304 HA3 GLY 44 2HA GLY 44 -8.315 -9.472 -19.142
Start of MODEL 10
1 H1 GLY 1 H GLY 1 -12.898 -2.726 0.053
2 HA2 GLY 1 1HA GLY 1 -12.742 -0.210 0.763
3 HA3 GLY 1 2HA GLY 1 -12.346 -0.640 -0.894
4 H SER 2 H SER 2 -13.764 1.690 0.634
5 HA SER 2 HA SER 2 -16.219 1.796 -0.961
6 HB2 SER 2 1HB SER 2 -16.612 2.304 1.341
7 HB3 SER 2 2HB SER 2 -15.249 3.421 1.394
8 HG SER 2 HG SER 2 -17.813 3.783 0.391
9 H SER 3 H SER 3 -16.607 3.358 -2.477
10 HA SER 3 HA SER 3 -14.298 4.607 -3.647
11 HB2 SER 3 1HB SER 3 -15.851 5.355 -5.393
12 HB3 SER 3 2HB SER 3 -16.078 3.640 -5.052
13 HG SER 3 HG SER 3 -17.630 5.446 -3.608
14 H GLY 4 H GLY 4 -13.637 6.083 -2.033
15 HA2 GLY 4 1HA GLY 4 -14.411 8.708 -2.347
16 HA3 GLY 4 2HA GLY 4 -15.384 8.101 -1.015
17 H SER 5 H SER 5 -11.979 7.847 -2.057
18 HA SER 5 HA SER 5 -11.204 8.622 0.678
19 HB2 SER 5 1HB SER 5 -9.902 6.556 -1.109
20 HB3 SER 5 2HB SER 5 -9.214 7.135 0.408
21 HG SER 5 HG SER 5 -10.518 5.863 1.444
22 H SER 6 H SER 6 -8.908 9.439 0.774
23 HA SER 6 HA SER 6 -8.599 11.501 -1.217
24 HB2 SER 6 1HB SER 6 -8.179 11.672 1.344
25 HB3 SER 6 2HB SER 6 -6.612 10.954 0.973
26 HG SER 6 HG SER 6 -6.733 12.794 -0.751
27 H GLY 7 H GLY 7 -7.695 11.015 -3.109
28 HA2 GLY 7 1HA GLY 7 -5.451 9.102 -3.143
29 HA3 GLY 7 2HA GLY 7 -6.494 9.453 -4.512
30 H VAL 8 H VAL 8 -4.351 11.225 -2.277
31 HA VAL 8 HA VAL 8 -3.657 13.108 -4.365
32 HB VAL 8 HB VAL 8 -2.257 14.187 -2.664
33 HG11 VAL 8 1HG1 VAL 8 -4.603 13.821 -1.003
34 HG12 VAL 8 2HG1 VAL 8 -4.057 15.247 -1.887
35 HG13 VAL 8 3HG1 VAL 8 -5.024 14.019 -2.704
36 HG21 VAL 8 3HG2 VAL 8 -1.991 11.749 -1.541
37 HG22 VAL 8 1HG2 VAL 8 -1.665 13.260 -0.693
38 HG23 VAL 8 2HG2 VAL 8 -3.217 12.448 -0.485
39 H LYS 9 H LYS 9 -2.450 10.157 -3.123
40 HA LYS 9 HA LYS 9 0.303 10.489 -3.691
41 HB2 LYS 9 1HB LYS 9 -1.441 8.043 -3.424
42 HB3 LYS 9 2HB LYS 9 0.288 7.944 -3.725
43 HG2 LYS 9 1HG LYS 9 0.298 7.775 -1.464
44 HG3 LYS 9 2HG LYS 9 0.380 9.532 -1.612
45 HD2 LYS 9 1HD LYS 9 -1.944 9.760 -1.175
46 HD3 LYS 9 2HD LYS 9 -2.214 8.024 -1.344
47 HE2 LYS 9 1HE LYS 9 -0.368 9.108 0.755
48 HE3 LYS 9 2HE LYS 9 -2.109 9.043 1.025
49 HZ1 LYS 9 3HZ LYS 9 -2.112 6.774 1.064
50 HZ2 LYS 9 1HZ LYS 9 -0.575 7.063 1.708
51 HZ3 LYS 9 2HZ LYS 9 -0.742 6.626 0.083
52 HA PRO 10 HA PRO 10 0.428 10.189 -8.076
53 HB2 PRO 10 1HB PRO 10 2.919 9.159 -8.397
54 HB3 PRO 10 2HB PRO 10 2.627 10.834 -7.916
55 HG2 PRO 10 1HG PRO 10 3.333 8.472 -6.219
56 HG3 PRO 10 2HG PRO 10 3.958 10.130 -6.144
57 HD2 PRO 10 1HD PRO 10 2.060 9.211 -4.446
58 HD3 PRO 10 2HD PRO 10 2.124 10.903 -4.981
59 H TYR 11 H TYR 11 0.886 7.402 -6.059
60 HA TYR 11 HA TYR 11 -0.009 5.692 -8.273
61 HB2 TYR 11 1HB TYR 11 2.027 4.759 -6.256
62 HB3 TYR 11 2HB TYR 11 1.555 3.984 -7.764
63 HD1 TYR 11 HD1 TYR 11 2.276 4.979 -9.935
64 HD2 TYR 11 HD2 TYR 11 3.728 6.418 -6.204
65 HE1 TYR 11 HE1 TYR 11 4.135 6.095 -11.096
66 HE2 TYR 11 HE2 TYR 11 5.591 7.538 -7.354
67 HH TYR 11 HH TYR 11 5.850 7.515 -10.886
68 H GLY 12 H GLY 12 -1.808 4.642 -7.763
69 HA2 GLY 12 1HA GLY 12 -2.223 3.792 -4.981
70 HA3 GLY 12 2HA GLY 12 -3.463 4.759 -5.766
71 H CYS 13 H CYS 13 -2.539 1.674 -5.030
72 HA CYS 13 HA CYS 13 -3.376 0.289 -7.376
73 HB2 CYS 13 1HB CYS 13 -1.852 -0.662 -5.635
74 HB3 CYS 13 2HB CYS 13 -3.231 -0.762 -4.544
75 H SER 14 H SER 14 -5.399 0.539 -8.094
76 HA SER 14 HA SER 14 -7.626 1.009 -6.367
77 HB2 SER 14 1HB SER 14 -7.522 0.320 -9.314
78 HB3 SER 14 2HB SER 14 -8.970 0.836 -8.450
79 HG SER 14 HG SER 14 -7.356 2.682 -7.852
80 H GLU 15 H GLU 15 -6.293 -1.790 -8.017
81 HA GLU 15 HA GLU 15 -8.302 -3.617 -7.949
82 HB2 GLU 15 1HB GLU 15 -5.360 -3.819 -7.552
83 HB3 GLU 15 2HB GLU 15 -6.328 -5.235 -7.168
84 HG2 GLU 15 1HG GLU 15 -5.594 -5.469 -9.404
85 HG3 GLU 15 2HG GLU 15 -7.313 -5.082 -9.458
86 H CYS 16 H CYS 16 -5.989 -3.222 -5.258
87 HA CYS 16 HA CYS 16 -7.947 -4.448 -3.460
88 HB2 CYS 16 1HB CYS 16 -6.114 -4.732 -1.903
89 HB3 CYS 16 2HB CYS 16 -5.622 -5.325 -3.486
90 H GLY 17 H GLY 17 -5.984 -1.520 -3.814
91 HA2 GLY 17 1HA GLY 17 -7.058 0.607 -3.266
92 HA3 GLY 17 2HA GLY 17 -7.802 -0.202 -1.895
93 H LYS 18 H LYS 18 -4.518 0.302 -3.197
94 HA LYS 18 HA LYS 18 -3.695 1.177 -0.513
95 HB2 LYS 18 1HB LYS 18 -2.395 -0.869 -2.286
96 HB3 LYS 18 2HB LYS 18 -1.440 0.047 -1.128
97 HG2 LYS 18 1HG LYS 18 -3.314 -0.759 0.539
98 HG3 LYS 18 2HG LYS 18 -3.504 -2.037 -0.664
99 HD2 LYS 18 1HD LYS 18 -1.329 -2.821 -0.349
100 HD3 LYS 18 2HD LYS 18 -0.797 -1.318 0.408
101 HE2 LYS 18 1HE LYS 18 -0.977 -2.865 2.168
102 HE3 LYS 18 2HE LYS 18 -2.426 -1.867 2.281
103 HZ1 LYS 18 3HZ LYS 18 -3.701 -3.641 1.993
104 HZ2 LYS 18 1HZ LYS 18 -2.320 -4.609 2.131
105 HZ3 LYS 18 2HZ LYS 18 -2.860 -4.120 0.605
106 H ALA 19 H ALA 19 -1.368 2.159 -0.695
107 HA ALA 19 HA ALA 19 -1.022 3.633 -3.197
108 HB1 ALA 19 3HB ALA 19 -0.580 5.682 -1.574
109 HB2 ALA 19 1HB ALA 19 -2.185 5.323 -2.212
110 HB3 ALA 19 2HB ALA 19 -1.752 4.820 -0.577
111 H PHE 20 H PHE 20 1.077 4.517 -3.482
112 HA PHE 20 HA PHE 20 3.100 3.794 -1.501
113 HB2 PHE 20 1HB PHE 20 3.492 3.086 -4.405
114 HB3 PHE 20 2HB PHE 20 4.460 2.586 -3.022
115 HD1 PHE 20 HD1 PHE 20 1.214 2.142 -4.717
116 HD2 PHE 20 HD2 PHE 20 3.904 0.666 -1.767
117 HE1 PHE 20 HE1 PHE 20 -0.117 0.080 -4.540
118 HE2 PHE 20 HE2 PHE 20 2.579 -1.399 -1.587
119 HZ PHE 20 HZ PHE 20 0.566 -1.694 -2.975
120 H ARG 21 H ARG 21 4.138 5.622 -1.089
121 HA ARG 21 HA ARG 21 4.064 7.997 -2.369
122 HB2 ARG 21 1HB ARG 21 5.303 7.293 -0.196
123 HB3 ARG 21 2HB ARG 21 6.690 7.063 -1.252
124 HG2 ARG 21 1HG ARG 21 6.679 9.363 -1.887
125 HG3 ARG 21 2HG ARG 21 5.145 9.636 -1.058
126 HD2 ARG 21 1HD ARG 21 6.196 9.187 1.083
127 HD3 ARG 21 2HD ARG 21 7.721 8.819 0.280
128 HE ARG 21 HE ARG 21 6.721 11.398 0.940
129 HH11 ARG 21 1HH1 ARG 21 8.583 9.661 -1.434
130 HH12 ARG 21 2HH1 ARG 21 9.499 11.049 -1.922
131 HH21 ARG 21 1HH2 ARG 21 7.920 13.232 0.306
132 HH22 ARG 21 2HH2 ARG 21 9.122 13.079 -0.931
133 H SER 22 H SER 22 6.235 5.316 -3.141
134 HA SER 22 HA SER 22 7.074 6.773 -5.561
135 HB2 SER 22 1HB SER 22 8.767 5.924 -3.709
136 HB3 SER 22 2HB SER 22 8.588 4.395 -4.568
137 HG SER 22 HG SER 22 10.231 5.415 -5.581
138 H LYS 23 H LYS 23 7.612 5.319 -7.432
139 HA LYS 23 HA LYS 23 5.343 3.693 -8.030
140 HB2 LYS 23 1HB LYS 23 6.689 5.126 -9.657
141 HB3 LYS 23 2HB LYS 23 7.890 3.841 -9.637
142 HG2 LYS 23 1HG LYS 23 6.476 2.332 -10.697
143 HG3 LYS 23 2HG LYS 23 5.028 3.255 -10.288
144 HD2 LYS 23 1HD LYS 23 5.769 5.045 -11.812
145 HD3 LYS 23 2HD LYS 23 7.175 4.071 -12.248
146 HE2 LYS 23 1HE LYS 23 5.512 3.787 -13.945
147 HE3 LYS 23 2HE LYS 23 5.617 2.289 -13.021
148 HZ1 LYS 23 3HZ LYS 23 3.482 2.451 -12.514
149 HZ2 LYS 23 1HZ LYS 23 3.356 3.811 -13.513
150 HZ3 LYS 23 2HZ LYS 23 3.691 4.000 -11.866
151 H SER 24 H SER 24 8.828 2.918 -7.958
152 HA SER 24 HA SER 24 8.897 0.280 -8.331
153 HB2 SER 24 1HB SER 24 10.716 0.137 -6.599
154 HB3 SER 24 2HB SER 24 10.915 1.457 -7.752
155 HG SER 24 HG SER 24 10.634 1.557 -5.066
156 H TYR 25 H TYR 25 8.157 1.701 -5.146
157 HA TYR 25 HA TYR 25 7.715 -0.518 -3.647
158 HB2 TYR 25 1HB TYR 25 6.479 2.187 -3.685
159 HB3 TYR 25 2HB TYR 25 5.692 0.955 -2.704
160 HD1 TYR 25 HD1 TYR 25 6.792 0.039 -0.738
161 HD2 TYR 25 HD2 TYR 25 8.684 3.025 -3.106
162 HE1 TYR 25 HE1 TYR 25 8.413 0.436 1.068
163 HE2 TYR 25 HE2 TYR 25 10.311 3.429 -1.307
164 HH TYR 25 HH TYR 25 11.184 1.714 0.804
165 H LEU 26 H LEU 26 5.344 0.998 -5.820
166 HA LEU 26 HA LEU 26 3.175 -0.644 -5.355
167 HB2 LEU 26 1HB LEU 26 3.020 1.323 -6.740
168 HB3 LEU 26 2HB LEU 26 4.095 0.606 -7.938
169 HG LEU 26 HG LEU 26 2.383 -1.060 -8.476
170 HD11 LEU 26 1HD1 LEU 26 0.098 -0.762 -7.575
171 HD12 LEU 26 2HD1 LEU 26 0.734 0.423 -6.435
172 HD13 LEU 26 3HD1 LEU 26 1.270 -1.255 -6.353
173 HD21 LEU 26 3HD2 LEU 26 2.411 1.605 -9.174
174 HD22 LEU 26 1HD2 LEU 26 0.731 1.322 -8.716
175 HD23 LEU 26 2HD2 LEU 26 1.482 0.333 -9.968
176 H ILE 27 H ILE 27 5.796 -1.122 -7.712
177 HA ILE 27 HA ILE 27 4.956 -3.436 -8.927
178 HB ILE 27 HB ILE 27 7.774 -2.689 -8.142
179 HG12 ILE 27 1HG1 ILE 27 6.657 -2.516 -10.911
180 HG13 ILE 27 2HG1 ILE 27 6.241 -1.261 -9.749
181 HG21 ILE 27 1HG2 ILE 27 6.921 -4.678 -10.237
182 HG22 ILE 27 2HG2 ILE 27 8.563 -4.300 -9.718
183 HG23 ILE 27 3HG2 ILE 27 7.457 -5.122 -8.616
184 HD11 ILE 27 3HD1 ILE 27 8.614 -1.572 -11.293
185 HD12 ILE 27 1HD1 ILE 27 8.142 -0.247 -10.230
186 HD13 ILE 27 2HD1 ILE 27 9.022 -1.630 -9.579
187 H ILE 28 H ILE 28 7.240 -3.378 -6.184
188 HA ILE 28 HA ILE 28 7.353 -6.039 -5.608
189 HB ILE 28 HB ILE 28 7.208 -3.828 -3.554
190 HG12 ILE 28 1HG1 ILE 28 9.814 -4.317 -3.743
191 HG13 ILE 28 2HG1 ILE 28 9.361 -4.818 -5.369
192 HG21 ILE 28 1HG2 ILE 28 8.708 -5.479 -2.291
193 HG22 ILE 28 2HG2 ILE 28 6.981 -5.822 -2.361
194 HG23 ILE 28 3HG2 ILE 28 8.094 -6.689 -3.418
195 HD11 ILE 28 3HD1 ILE 28 10.020 -2.296 -4.657
196 HD12 ILE 28 1HD1 ILE 28 9.024 -2.716 -6.050
197 HD13 ILE 28 2HD1 ILE 28 8.262 -2.236 -4.533
198 H HIS 29 H HIS 29 4.640 -3.959 -5.236
199 HA HIS 29 HA HIS 29 3.243 -5.864 -3.511
200 HB2 HIS 29 1HB HIS 29 2.849 -3.692 -2.742
201 HB3 HIS 29 2HB HIS 29 2.704 -3.038 -4.371
202 HD1 HIS 29 HD1 HIS 29 0.772 -5.164 -1.909
203 HD2 HIS 29 HD2 HIS 29 0.147 -2.896 -5.333
204 HE1 HIS 29 HE1 HIS 29 -1.724 -5.059 -2.199
205 H MET 30 H MET 30 3.266 -4.625 -6.780
206 HA MET 30 HA MET 30 0.771 -5.818 -7.534
207 HB2 MET 30 1HB MET 30 2.980 -4.400 -8.951
208 HB3 MET 30 2HB MET 30 1.874 -5.380 -9.904
209 HG2 MET 30 1HG MET 30 0.730 -3.432 -7.977
210 HG3 MET 30 2HG MET 30 1.438 -2.824 -9.471
211 HE1 MET 30 3HE MET 30 -2.643 -3.035 -9.594
212 HE2 MET 30 1HE MET 30 -1.571 -2.740 -8.225
213 HE3 MET 30 2HE MET 30 -1.334 -1.861 -9.735
214 H ARG 31 H ARG 31 4.045 -6.875 -7.311
215 HA ARG 31 HA ARG 31 4.339 -8.831 -9.170
216 HB2 ARG 31 1HB ARG 31 5.769 -10.010 -7.607
217 HB3 ARG 31 2HB ARG 31 6.010 -8.277 -7.435
218 HG2 ARG 31 1HG ARG 31 4.603 -8.265 -5.447
219 HG3 ARG 31 2HG ARG 31 4.327 -9.999 -5.627
220 HD2 ARG 31 1HD ARG 31 7.027 -8.715 -5.234
221 HD3 ARG 31 2HD ARG 31 6.065 -9.444 -3.949
222 HE ARG 31 HE ARG 31 6.622 -11.538 -4.744
223 HH11 ARG 31 1HH1 ARG 31 7.668 -9.084 -6.981
224 HH12 ARG 31 2HH1 ARG 31 8.637 -10.170 -7.921
225 HH21 ARG 31 1HH2 ARG 31 7.894 -12.978 -5.974
226 HH22 ARG 31 2HH2 ARG 31 8.764 -12.385 -7.348
227 H THR 32 H THR 32 2.249 -8.904 -6.362
228 HA THR 32 HA THR 32 1.538 -11.689 -6.786
229 HB THR 32 HB THR 32 1.714 -10.454 -4.495
230 HG1 THR 32 HG1 THR 32 0.891 -12.327 -3.987
231 HG21 THR 32 3HG2 THR 32 -1.144 -9.823 -5.238
232 HG22 THR 32 1HG2 THR 32 0.153 -8.634 -5.132
233 HG23 THR 32 2HG2 THR 32 -0.363 -9.507 -3.689
234 H HIS 33 H HIS 33 0.134 -8.487 -7.218
235 HA HIS 33 HA HIS 33 -2.485 -9.281 -7.851
236 HB2 HIS 33 1HB HIS 33 -0.839 -6.842 -8.399
237 HB3 HIS 33 2HB HIS 33 -2.389 -7.030 -9.214
238 HD1 HIS 33 HD1 HIS 33 -3.943 -8.293 -6.809
239 HD2 HIS 33 HD2 HIS 33 -1.561 -4.895 -6.609
240 HE1 HIS 33 HE1 HIS 33 -4.776 -7.004 -4.817
241 H THR 34 H THR 34 0.418 -8.985 -9.814
242 HA THR 34 HA THR 34 -0.994 -9.537 -12.277
243 HB THR 34 HB THR 34 1.241 -9.529 -13.323
244 HG1 THR 34 HG1 THR 34 2.186 -9.019 -10.680
245 HG21 THR 34 3HG2 THR 34 -0.088 -7.413 -12.765
246 HG22 THR 34 1HG2 THR 34 1.625 -7.218 -13.132
247 HG23 THR 34 2HG2 THR 34 1.071 -7.177 -11.458
248 H GLY 35 H GLY 35 -1.502 -11.564 -10.495
249 HA2 GLY 35 1HA GLY 35 -1.507 -13.853 -10.334
250 HA3 GLY 35 2HA GLY 35 -0.870 -13.856 -11.972
251 H GLU 36 H GLU 36 -0.244 -15.605 -9.692
252 HA GLU 36 HA GLU 36 2.646 -15.057 -9.521
253 HB2 GLU 36 1HB GLU 36 1.199 -14.928 -7.364
254 HB3 GLU 36 2HB GLU 36 1.183 -16.683 -7.466
255 HG2 GLU 36 1HG GLU 36 2.943 -16.159 -6.019
256 HG3 GLU 36 2HG GLU 36 3.709 -16.565 -7.554
257 H LYS 37 H LYS 37 2.821 -16.278 -11.511
258 HA LYS 37 HA LYS 37 2.079 -19.047 -11.571
259 HB2 LYS 37 1HB LYS 37 3.119 -19.110 -13.729
260 HB3 LYS 37 2HB LYS 37 2.246 -17.589 -13.599
261 HG2 LYS 37 1HG LYS 37 4.563 -16.670 -12.810
262 HG3 LYS 37 2HG LYS 37 5.180 -18.094 -13.651
263 HD2 LYS 37 1HD LYS 37 4.316 -17.384 -15.716
264 HD3 LYS 37 2HD LYS 37 3.250 -16.198 -14.958
265 HE2 LYS 37 1HE LYS 37 5.536 -15.199 -14.107
266 HE3 LYS 37 2HE LYS 37 6.175 -16.059 -15.507
267 HZ1 LYS 37 3HZ LYS 37 3.979 -14.060 -15.583
268 HZ2 LYS 37 1HZ LYS 37 4.644 -14.859 -16.918
269 HZ3 LYS 37 2HZ LYS 37 5.583 -13.766 -16.033
270 HA PRO 38 HA PRO 38 5.590 -20.781 -9.560
271 HB2 PRO 38 1HB PRO 38 5.543 -23.260 -10.666
272 HB3 PRO 38 2HB PRO 38 4.377 -22.729 -9.448
273 HG2 PRO 38 1HG PRO 38 4.077 -22.868 -12.423
274 HG3 PRO 38 2HG PRO 38 2.926 -23.339 -11.159
275 HD2 PRO 38 1HD PRO 38 2.741 -20.992 -12.498
276 HD3 PRO 38 2HD PRO 38 2.233 -21.169 -10.806
277 H SER 39 H SER 39 7.550 -22.251 -10.217
278 HA SER 39 HA SER 39 8.544 -21.597 -12.886
279 HB2 SER 39 1HB SER 39 10.581 -20.618 -12.097
280 HB3 SER 39 2HB SER 39 9.264 -19.792 -11.265
281 HG SER 39 HG SER 39 11.144 -20.563 -9.971
282 H GLY 40 H GLY 40 8.906 -23.579 -13.665
283 HA2 GLY 40 1HA GLY 40 10.071 -25.618 -11.905
284 HA3 GLY 40 2HA GLY 40 9.297 -25.915 -13.455
285 HA PRO 41 HA PRO 41 13.968 -25.985 -13.893
286 HB2 PRO 41 1HB PRO 41 14.128 -28.520 -14.851
287 HB3 PRO 41 2HB PRO 41 14.181 -28.141 -13.126
288 HG2 PRO 41 1HG PRO 41 11.881 -29.098 -14.785
289 HG3 PRO 41 2HG PRO 41 12.380 -29.611 -13.162
290 HD2 PRO 41 1HD PRO 41 10.344 -27.874 -13.580
291 HD3 PRO 41 2HD PRO 41 11.389 -27.794 -12.147
292 H SER 42 H SER 42 11.195 -26.618 -15.843
293 HA SER 42 HA SER 42 12.253 -27.090 -18.347
294 HB2 SER 42 1HB SER 42 10.199 -25.918 -19.222
295 HB3 SER 42 2HB SER 42 9.874 -27.171 -18.024
296 HG SER 42 HG SER 42 9.896 -25.365 -16.462
297 H SER 43 H SER 43 12.429 -24.235 -16.439
298 HA SER 43 HA SER 43 13.258 -22.610 -18.731
299 HB2 SER 43 1HB SER 43 11.621 -21.630 -17.159
300 HB3 SER 43 2HB SER 43 12.792 -21.795 -15.851
301 HG SER 43 HG SER 43 13.740 -20.048 -16.520
302 H GLY 44 H GLY 44 15.233 -21.385 -18.646
303 HA2 GLY 44 1HA GLY 44 17.279 -22.609 -16.899
304 HA3 GLY 44 2HA GLY 44 17.578 -22.276 -18.598
Start of MODEL 11
1 H1 GLY 1 H GLY 1 -17.646 15.143 3.115
2 HA2 GLY 1 1HA GLY 1 -16.319 16.571 5.336
3 HA3 GLY 1 2HA GLY 1 -16.953 14.936 5.455
4 H SER 2 H SER 2 -15.696 13.235 4.869
5 HA SER 2 HA SER 2 -12.960 13.893 4.004
6 HB2 SER 2 1HB SER 2 -12.386 11.637 5.000
7 HB3 SER 2 2HB SER 2 -12.919 12.854 6.160
8 HG SER 2 HG SER 2 -14.031 10.461 5.542
9 H SER 3 H SER 3 -13.447 13.891 1.780
10 HA SER 3 HA SER 3 -14.211 11.280 0.655
11 HB2 SER 3 1HB SER 3 -14.834 12.506 -1.381
12 HB3 SER 3 2HB SER 3 -15.692 13.143 0.022
13 HG SER 3 HG SER 3 -14.899 14.987 -0.585
14 H GLY 4 H GLY 4 -12.057 14.051 0.016
15 HA2 GLY 4 1HA GLY 4 -9.924 12.205 -0.700
16 HA3 GLY 4 2HA GLY 4 -10.494 13.250 -1.993
17 H SER 5 H SER 5 -7.873 13.344 -1.188
18 HA SER 5 HA SER 5 -7.652 16.105 -0.394
19 HB2 SER 5 1HB SER 5 -7.764 14.817 1.780
20 HB3 SER 5 2HB SER 5 -6.250 14.043 1.316
21 HG SER 5 HG SER 5 -5.686 16.488 0.994
22 H SER 6 H SER 6 -6.245 16.911 -1.788
23 HA SER 6 HA SER 6 -4.608 15.469 -3.486
24 HB2 SER 6 1HB SER 6 -3.455 17.601 -3.942
25 HB3 SER 6 2HB SER 6 -5.204 17.815 -3.880
26 HG SER 6 HG SER 6 -4.947 19.124 -2.265
27 H GLY 7 H GLY 7 -3.528 13.876 -2.249
28 HA2 GLY 7 1HA GLY 7 -1.532 14.779 -0.317
29 HA3 GLY 7 2HA GLY 7 -1.979 13.112 -0.649
30 H VAL 8 H VAL 8 0.216 12.519 -0.796
31 HA VAL 8 HA VAL 8 1.503 13.377 -3.305
32 HB VAL 8 HB VAL 8 3.693 13.060 -2.249
33 HG11 VAL 8 1HG1 VAL 8 3.535 15.249 -1.911
34 HG12 VAL 8 2HG1 VAL 8 1.799 15.125 -1.618
35 HG13 VAL 8 3HG1 VAL 8 2.937 14.912 -0.287
36 HG21 VAL 8 3HG2 VAL 8 2.331 11.594 -0.369
37 HG22 VAL 8 1HG2 VAL 8 4.007 12.129 -0.240
38 HG23 VAL 8 2HG2 VAL 8 2.719 13.079 0.501
39 H LYS 9 H LYS 9 -0.192 11.255 -3.351
40 HA LYS 9 HA LYS 9 1.657 8.981 -3.623
41 HB2 LYS 9 1HB LYS 9 -0.326 7.509 -3.049
42 HB3 LYS 9 2HB LYS 9 0.366 8.425 -1.716
43 HG2 LYS 9 1HG LYS 9 -1.937 9.559 -3.234
44 HG3 LYS 9 2HG LYS 9 -2.215 8.298 -2.030
45 HD2 LYS 9 1HD LYS 9 -1.018 9.687 -0.364
46 HD3 LYS 9 2HD LYS 9 -0.871 10.962 -1.575
47 HE2 LYS 9 1HE LYS 9 -3.493 9.802 -0.644
48 HE3 LYS 9 2HE LYS 9 -2.767 11.263 0.024
49 HZ1 LYS 9 3HZ LYS 9 -4.118 12.157 -1.557
50 HZ2 LYS 9 1HZ LYS 9 -3.996 10.829 -2.599
51 HZ3 LYS 9 2HZ LYS 9 -2.725 11.940 -2.492
52 HA PRO 10 HA PRO 10 -0.422 9.883 -7.661
53 HB2 PRO 10 1HB PRO 10 1.825 9.548 -9.147
54 HB3 PRO 10 2HB PRO 10 1.397 11.085 -8.387
55 HG2 PRO 10 1HG PRO 10 3.319 8.985 -7.462
56 HG3 PRO 10 2HG PRO 10 3.504 10.749 -7.463
57 HD2 PRO 10 1HD PRO 10 2.842 9.354 -5.238
58 HD3 PRO 10 2HD PRO 10 2.262 11.006 -5.538
59 H TYR 11 H TYR 11 1.267 7.282 -6.236
60 HA TYR 11 HA TYR 11 0.374 5.466 -8.378
61 HB2 TYR 11 1HB TYR 11 2.495 4.763 -6.366
62 HB3 TYR 11 2HB TYR 11 2.190 4.042 -7.942
63 HD1 TYR 11 HD1 TYR 11 2.621 5.521 -10.009
64 HD2 TYR 11 HD2 TYR 11 4.123 6.417 -6.130
65 HE1 TYR 11 HE1 TYR 11 4.325 6.983 -11.013
66 HE2 TYR 11 HE2 TYR 11 5.830 7.883 -7.123
67 HH TYR 11 HH TYR 11 6.579 8.833 -8.993
68 H GLY 12 H GLY 12 -1.668 5.020 -7.612
69 HA2 GLY 12 1HA GLY 12 -1.776 3.686 -4.976
70 HA3 GLY 12 2HA GLY 12 -3.093 4.659 -5.615
71 H CYS 13 H CYS 13 -1.983 1.563 -5.195
72 HA CYS 13 HA CYS 13 -2.721 0.217 -7.520
73 HB2 CYS 13 1HB CYS 13 -1.493 -0.830 -5.654
74 HB3 CYS 13 2HB CYS 13 -2.947 -0.757 -4.664
75 H SER 14 H SER 14 -4.609 -0.563 -8.327
76 HA SER 14 HA SER 14 -7.060 0.467 -7.099
77 HB2 SER 14 1HB SER 14 -6.250 -0.272 -9.871
78 HB3 SER 14 2HB SER 14 -7.950 -0.455 -9.439
79 HG SER 14 HG SER 14 -6.843 1.725 -10.209
80 H GLU 15 H GLU 15 -5.447 -2.501 -7.966
81 HA GLU 15 HA GLU 15 -7.502 -4.334 -7.937
82 HB2 GLU 15 1HB GLU 15 -4.675 -4.568 -6.911
83 HB3 GLU 15 2HB GLU 15 -5.773 -5.939 -6.995
84 HG2 GLU 15 1HG GLU 15 -5.353 -4.311 -9.444
85 HG3 GLU 15 2HG GLU 15 -4.077 -5.412 -8.930
86 H CYS 16 H CYS 16 -5.527 -3.400 -5.115
87 HA CYS 16 HA CYS 16 -7.653 -4.418 -3.368
88 HB2 CYS 16 1HB CYS 16 -5.971 -4.374 -1.585
89 HB3 CYS 16 2HB CYS 16 -5.403 -5.309 -2.965
90 H GLY 17 H GLY 17 -5.589 -1.573 -3.870
91 HA2 GLY 17 1HA GLY 17 -6.710 0.611 -3.783
92 HA3 GLY 17 2HA GLY 17 -7.606 0.007 -2.397
93 H LYS 18 H LYS 18 -4.143 -0.243 -3.119
94 HA LYS 18 HA LYS 18 -3.614 1.124 -0.567
95 HB2 LYS 18 1HB LYS 18 -2.094 -0.972 -2.098
96 HB3 LYS 18 2HB LYS 18 -1.308 0.006 -0.866
97 HG2 LYS 18 1HG LYS 18 -2.861 -0.808 0.808
98 HG3 LYS 18 2HG LYS 18 -3.720 -1.741 -0.419
99 HD2 LYS 18 1HD LYS 18 -1.659 -3.029 -0.841
100 HD3 LYS 18 2HD LYS 18 -0.853 -2.127 0.444
101 HE2 LYS 18 1HE LYS 18 -2.713 -2.944 1.972
102 HE3 LYS 18 2HE LYS 18 -3.149 -4.056 0.675
103 HZ1 LYS 18 3HZ LYS 18 -1.090 -5.146 0.843
104 HZ2 LYS 18 1HZ LYS 18 -1.614 -4.946 2.439
105 HZ3 LYS 18 2HZ LYS 18 -0.416 -3.932 1.808
106 H ALA 19 H ALA 19 -1.622 2.436 -0.477
107 HA ALA 19 HA ALA 19 -1.073 3.754 -3.056
108 HB1 ALA 19 3HB ALA 19 -1.642 5.733 -2.222
109 HB2 ALA 19 1HB ALA 19 -2.284 4.885 -0.815
110 HB3 ALA 19 2HB ALA 19 -0.628 5.492 -0.799
111 H PHE 20 H PHE 20 1.034 4.630 -3.339
112 HA PHE 20 HA PHE 20 3.070 3.882 -1.388
113 HB2 PHE 20 1HB PHE 20 3.439 3.112 -4.277
114 HB3 PHE 20 2HB PHE 20 4.380 2.601 -2.881
115 HD1 PHE 20 HD1 PHE 20 1.061 2.295 -4.493
116 HD2 PHE 20 HD2 PHE 20 3.830 0.654 -1.708
117 HE1 PHE 20 HE1 PHE 20 -0.333 0.276 -4.301
118 HE2 PHE 20 HE2 PHE 20 2.441 -1.367 -1.512
119 HZ PHE 20 HZ PHE 20 0.357 -1.558 -2.810
120 H ARG 21 H ARG 21 4.144 5.700 -1.031
121 HA ARG 21 HA ARG 21 4.090 8.034 -2.424
122 HB2 ARG 21 1HB ARG 21 6.253 8.600 -1.361
123 HB3 ARG 21 2HB ARG 21 5.111 7.881 -0.233
124 HG2 ARG 21 1HG ARG 21 6.262 5.716 -0.495
125 HG3 ARG 21 2HG ARG 21 7.443 6.502 -1.545
126 HD2 ARG 21 1HD ARG 21 8.315 6.319 0.711
127 HD3 ARG 21 2HD ARG 21 8.051 8.011 0.293
128 HE ARG 21 HE ARG 21 5.752 7.156 1.563
129 HH11 ARG 21 1HH1 ARG 21 9.132 7.469 2.333
130 HH12 ARG 21 2HH1 ARG 21 8.857 7.745 4.021
131 HH21 ARG 21 1HH2 ARG 21 5.375 7.519 3.784
132 HH22 ARG 21 2HH2 ARG 21 6.719 7.773 4.845
133 H SER 22 H SER 22 6.257 5.301 -2.982
134 HA SER 22 HA SER 22 7.245 6.647 -5.409
135 HB2 SER 22 1HB SER 22 8.922 5.965 -3.623
136 HB3 SER 22 2HB SER 22 8.541 4.292 -4.030
137 HG SER 22 HG SER 22 10.225 5.933 -5.256
138 H LYS 23 H LYS 23 7.198 5.596 -7.370
139 HA LYS 23 HA LYS 23 5.097 3.830 -7.871
140 HB2 LYS 23 1HB LYS 23 6.125 3.543 -10.110
141 HB3 LYS 23 2HB LYS 23 5.998 5.228 -9.625
142 HG2 LYS 23 1HG LYS 23 8.347 5.278 -9.055
143 HG3 LYS 23 2HG LYS 23 8.498 3.560 -9.431
144 HD2 LYS 23 1HD LYS 23 7.819 4.063 -11.764
145 HD3 LYS 23 2HD LYS 23 7.818 5.781 -11.358
146 HE2 LYS 23 1HE LYS 23 10.229 4.030 -10.962
147 HE3 LYS 23 2HE LYS 23 9.906 4.859 -12.484
148 HZ1 LYS 23 3HZ LYS 23 9.973 6.962 -11.348
149 HZ2 LYS 23 1HZ LYS 23 11.397 6.111 -11.015
150 HZ3 LYS 23 2HZ LYS 23 10.174 6.203 -9.849
151 H SER 24 H SER 24 8.576 3.194 -7.561
152 HA SER 24 HA SER 24 8.682 0.532 -8.203
153 HB2 SER 24 1HB SER 24 10.603 0.371 -6.634
154 HB3 SER 24 2HB SER 24 10.683 1.806 -7.655
155 HG SER 24 HG SER 24 11.128 2.223 -5.419
156 H TYR 25 H TYR 25 7.940 1.903 -5.004
157 HA TYR 25 HA TYR 25 7.630 -0.394 -3.539
158 HB2 TYR 25 1HB TYR 25 6.375 2.306 -3.421
159 HB3 TYR 25 2HB TYR 25 5.680 1.034 -2.423
160 HD1 TYR 25 HD1 TYR 25 7.949 -0.475 -1.486
161 HD2 TYR 25 HD2 TYR 25 7.582 3.726 -2.053
162 HE1 TYR 25 HE1 TYR 25 9.689 -0.100 0.211
163 HE2 TYR 25 HE2 TYR 25 9.322 4.112 -0.358
164 HH TYR 25 HH TYR 25 10.265 1.949 1.834
165 H LEU 26 H LEU 26 5.185 1.191 -5.570
166 HA LEU 26 HA LEU 26 3.063 -0.546 -5.041
167 HB2 LEU 26 1HB LEU 26 2.579 1.472 -6.148
168 HB3 LEU 26 2HB LEU 26 3.759 1.152 -7.417
169 HG LEU 26 HG LEU 26 2.289 -0.684 -8.235
170 HD11 LEU 26 1HD1 LEU 26 1.116 -1.058 -6.084
171 HD12 LEU 26 2HD1 LEU 26 0.024 -0.856 -7.455
172 HD13 LEU 26 3HD1 LEU 26 0.270 0.472 -6.320
173 HD21 LEU 26 3HD2 LEU 26 2.227 1.893 -8.862
174 HD22 LEU 26 1HD2 LEU 26 0.593 1.752 -8.213
175 HD23 LEU 26 2HD2 LEU 26 1.097 0.732 -9.561
176 H ILE 27 H ILE 27 5.222 -0.569 -7.884
177 HA ILE 27 HA ILE 27 4.382 -2.848 -9.120
178 HB ILE 27 HB ILE 27 7.260 -1.996 -8.787
179 HG12 ILE 27 1HG1 ILE 27 5.612 -1.452 -11.221
180 HG13 ILE 27 2HG1 ILE 27 5.393 -0.426 -9.807
181 HG21 ILE 27 1HG2 ILE 27 7.464 -4.114 -9.654
182 HG22 ILE 27 2HG2 ILE 27 5.923 -4.031 -10.505
183 HG23 ILE 27 3HG2 ILE 27 7.323 -3.160 -11.131
184 HD11 ILE 27 3HD1 ILE 27 7.284 0.673 -10.193
185 HD12 ILE 27 1HD1 ILE 27 8.188 -0.811 -10.493
186 HD13 ILE 27 2HD1 ILE 27 7.250 -0.072 -11.791
187 H ILE 28 H ILE 28 6.930 -2.719 -6.627
188 HA ILE 28 HA ILE 28 7.506 -5.391 -6.402
189 HB ILE 28 HB ILE 28 7.328 -3.367 -4.169
190 HG12 ILE 28 1HG1 ILE 28 9.838 -4.355 -5.490
191 HG13 ILE 28 2HG1 ILE 28 8.904 -3.053 -6.218
192 HG21 ILE 28 1HG2 ILE 28 8.882 -5.943 -4.161
193 HG22 ILE 28 2HG2 ILE 28 8.630 -4.824 -2.822
194 HG23 ILE 28 3HG2 ILE 28 7.281 -5.776 -3.443
195 HD11 ILE 28 3HD1 ILE 28 9.208 -1.678 -4.284
196 HD12 ILE 28 1HD1 ILE 28 9.977 -3.002 -3.410
197 HD13 ILE 28 2HD1 ILE 28 10.781 -2.282 -4.805
198 H HIS 29 H HIS 29 4.672 -3.697 -5.284
199 HA HIS 29 HA HIS 29 3.738 -5.927 -3.689
200 HB2 HIS 29 1HB HIS 29 2.996 -3.974 -2.723
201 HB3 HIS 29 2HB HIS 29 2.776 -3.164 -4.271
202 HD1 HIS 29 HD1 HIS 29 1.082 -5.667 -2.011
203 HD2 HIS 29 HD2 HIS 29 0.229 -3.275 -5.299
204 HE1 HIS 29 HE1 HIS 29 -1.408 -5.823 -2.328
205 H MET 30 H MET 30 2.736 -4.277 -6.679
206 HA MET 30 HA MET 30 0.517 -5.543 -7.450
207 HB2 MET 30 1HB MET 30 2.960 -5.081 -9.167
208 HB3 MET 30 2HB MET 30 1.375 -5.499 -9.804
209 HG2 MET 30 1HG MET 30 0.628 -3.404 -8.403
210 HG3 MET 30 2HG MET 30 2.324 -2.964 -8.585
211 HE1 MET 30 3HE MET 30 -0.573 -3.796 -12.029
212 HE2 MET 30 1HE MET 30 -0.525 -4.575 -10.447
213 HE3 MET 30 2HE MET 30 -1.207 -2.956 -10.612
214 H ARG 31 H ARG 31 3.695 -7.018 -7.288
215 HA ARG 31 HA ARG 31 3.595 -9.278 -8.700
216 HB2 ARG 31 1HB ARG 31 4.309 -9.215 -5.762
217 HB3 ARG 31 2HB ARG 31 4.827 -10.428 -6.926
218 HG2 ARG 31 1HG ARG 31 5.996 -8.629 -8.185
219 HG3 ARG 31 2HG ARG 31 5.584 -7.517 -6.878
220 HD2 ARG 31 1HD ARG 31 7.296 -9.991 -6.705
221 HD3 ARG 31 2HD ARG 31 7.820 -8.317 -6.530
222 HE ARG 31 HE ARG 31 5.929 -8.672 -4.582
223 HH11 ARG 31 1HH1 ARG 31 8.931 -10.210 -5.444
224 HH12 ARG 31 2HH1 ARG 31 9.316 -10.665 -3.817
225 HH21 ARG 31 1HH2 ARG 31 6.425 -9.265 -2.436
226 HH22 ARG 31 2HH2 ARG 31 7.889 -10.128 -2.107
227 H THR 32 H THR 32 2.036 -8.996 -5.506
228 HA THR 32 HA THR 32 0.860 -11.496 -5.390
229 HB THR 32 HB THR 32 -0.833 -10.490 -3.885
230 HG1 THR 32 HG1 THR 32 -0.253 -8.101 -3.496
231 HG21 THR 32 3HG2 THR 32 0.736 -9.665 -2.194
232 HG22 THR 32 1HG2 THR 32 1.982 -9.491 -3.429
233 HG23 THR 32 2HG2 THR 32 1.373 -11.092 -3.010
234 H HIS 33 H HIS 33 -0.617 -8.488 -6.612
235 HA HIS 33 HA HIS 33 -3.010 -9.680 -7.489
236 HB2 HIS 33 1HB HIS 33 -1.629 -7.152 -8.410
237 HB3 HIS 33 2HB HIS 33 -3.267 -7.610 -8.867
238 HD1 HIS 33 HD1 HIS 33 -4.529 -8.402 -6.282
239 HD2 HIS 33 HD2 HIS 33 -1.912 -5.190 -6.580
240 HE1 HIS 33 HE1 HIS 33 -5.052 -6.924 -4.315
241 H THR 34 H THR 34 -0.267 -8.530 -9.464
242 HA THR 34 HA THR 34 -0.931 -9.357 -11.929
243 HB THR 34 HB THR 34 1.440 -9.801 -12.412
244 HG1 THR 34 HG1 THR 34 1.620 -9.805 -9.578
245 HG21 THR 34 3HG2 THR 34 2.348 -7.622 -11.368
246 HG22 THR 34 1HG2 THR 34 0.724 -7.438 -10.706
247 HG23 THR 34 2HG2 THR 34 0.961 -7.515 -12.452
248 H GLY 35 H GLY 35 -0.520 -11.256 -13.223
249 HA2 GLY 35 1HA GLY 35 -1.663 -13.573 -12.366
250 HA3 GLY 35 2HA GLY 35 -0.456 -13.524 -13.642
251 H GLU 36 H GLU 36 -1.210 -14.856 -10.710
252 HA GLU 36 HA GLU 36 1.617 -15.499 -10.184
253 HB2 GLU 36 1HB GLU 36 1.116 -15.644 -7.812
254 HB3 GLU 36 2HB GLU 36 0.677 -14.055 -8.421
255 HG2 GLU 36 1HG GLU 36 -1.582 -14.450 -8.218
256 HG3 GLU 36 2HG GLU 36 -1.388 -16.201 -8.275
257 H LYS 37 H LYS 37 1.951 -17.601 -9.116
258 HA LYS 37 HA LYS 37 1.100 -19.750 -10.485
259 HB2 LYS 37 1HB LYS 37 1.432 -21.083 -8.320
260 HB3 LYS 37 2HB LYS 37 2.790 -20.130 -8.901
261 HG2 LYS 37 1HG LYS 37 2.339 -18.408 -7.282
262 HG3 LYS 37 2HG LYS 37 0.869 -19.235 -6.762
263 HD2 LYS 37 1HD LYS 37 2.491 -21.223 -6.291
264 HD3 LYS 37 2HD LYS 37 3.730 -19.966 -6.289
265 HE2 LYS 37 1HE LYS 37 1.230 -19.787 -4.626
266 HE3 LYS 37 2HE LYS 37 2.704 -20.561 -4.044
267 HZ1 LYS 37 3HZ LYS 37 3.842 -18.570 -4.020
268 HZ2 LYS 37 1HZ LYS 37 2.298 -18.089 -3.522
269 HZ3 LYS 37 2HZ LYS 37 2.795 -17.819 -5.116
270 HA PRO 38 HA PRO 38 -3.199 -20.357 -9.761
271 HB2 PRO 38 1HB PRO 38 -3.369 -23.001 -10.352
272 HB3 PRO 38 2HB PRO 38 -3.156 -21.753 -11.586
273 HG2 PRO 38 1HG PRO 38 -1.112 -23.545 -10.331
274 HG3 PRO 38 2HG PRO 38 -1.304 -23.086 -12.033
275 HD2 PRO 38 1HD PRO 38 0.530 -21.930 -10.410
276 HD3 PRO 38 2HD PRO 38 -0.265 -21.050 -11.732
277 H SER 39 H SER 39 -1.163 -23.011 -8.508
278 HA SER 39 HA SER 39 -3.022 -23.437 -6.315
279 HB2 SER 39 1HB SER 39 -1.602 -25.362 -5.761
280 HB3 SER 39 2HB SER 39 -2.046 -25.384 -7.468
281 HG SER 39 HG SER 39 0.432 -24.908 -6.272
282 H GLY 40 H GLY 40 -2.882 -22.056 -4.664
283 HA2 GLY 40 1HA GLY 40 -0.229 -21.092 -3.840
284 HA3 GLY 40 2HA GLY 40 -1.763 -20.344 -3.423
285 HA PRO 41 HA PRO 41 -1.491 -22.291 0.505
286 HB2 PRO 41 1HB PRO 41 -4.112 -22.223 1.212
287 HB3 PRO 41 2HB PRO 41 -3.083 -20.785 1.197
288 HG2 PRO 41 1HG PRO 41 -5.053 -21.727 -0.851
289 HG3 PRO 41 2HG PRO 41 -4.777 -20.087 -0.235
290 HD2 PRO 41 1HD PRO 41 -3.788 -20.937 -2.608
291 HD3 PRO 41 2HD PRO 41 -2.945 -19.749 -1.592
292 H SER 42 H SER 42 -4.287 -23.381 -1.431
293 HA SER 42 HA SER 42 -3.460 -26.141 -1.110
294 HB2 SER 42 1HB SER 42 -5.701 -26.834 -0.240
295 HB3 SER 42 2HB SER 42 -4.772 -25.865 0.904
296 HG SER 42 HG SER 42 -6.036 -24.096 0.398
297 H SER 43 H SER 43 -4.862 -27.628 -2.377
298 HA SER 43 HA SER 43 -6.030 -26.231 -4.695
299 HB2 SER 43 1HB SER 43 -5.195 -27.937 -6.139
300 HB3 SER 43 2HB SER 43 -3.852 -27.479 -5.092
301 HG SER 43 HG SER 43 -3.924 -29.381 -4.140
302 H GLY 44 H GLY 44 -8.031 -26.806 -5.354
303 HA2 GLY 44 1HA GLY 44 -9.628 -28.714 -5.599
304 HA3 GLY 44 2HA GLY 44 -9.316 -29.035 -3.900
Start of MODEL 12
1 H1 GLY 1 H GLY 1 -12.514 6.780 5.450
2 HA2 GLY 1 1HA GLY 1 -12.160 9.564 5.121
3 HA3 GLY 1 2HA GLY 1 -10.925 8.337 4.882
4 H SER 2 H SER 2 -13.409 10.254 3.355
5 HA SER 2 HA SER 2 -12.901 9.159 0.728
6 HB2 SER 2 1HB SER 2 -15.142 10.096 1.602
7 HB3 SER 2 2HB SER 2 -14.444 11.684 1.287
8 HG SER 2 HG SER 2 -14.407 9.700 -0.706
9 H SER 3 H SER 3 -12.368 12.270 2.366
10 HA SER 3 HA SER 3 -10.017 12.717 0.711
11 HB2 SER 3 1HB SER 3 -12.483 14.427 0.630
12 HB3 SER 3 2HB SER 3 -10.897 15.155 0.371
13 HG SER 3 HG SER 3 -11.770 14.513 -1.603
14 H GLY 4 H GLY 4 -8.791 14.673 1.453
15 HA2 GLY 4 1HA GLY 4 -9.371 15.817 4.003
16 HA3 GLY 4 2HA GLY 4 -8.172 14.539 4.137
17 H SER 5 H SER 5 -6.165 15.269 4.162
18 HA SER 5 HA SER 5 -5.533 17.677 2.582
19 HB2 SER 5 1HB SER 5 -4.544 16.791 5.287
20 HB3 SER 5 2HB SER 5 -3.644 17.951 4.311
21 HG SER 5 HG SER 5 -5.908 18.988 4.222
22 H SER 6 H SER 6 -4.232 14.632 3.856
23 HA SER 6 HA SER 6 -1.860 14.722 2.275
24 HB2 SER 6 1HB SER 6 -3.206 12.553 3.880
25 HB3 SER 6 2HB SER 6 -1.751 12.240 2.934
26 HG SER 6 HG SER 6 -0.597 13.332 4.332
27 H GLY 7 H GLY 7 -1.343 13.591 0.406
28 HA2 GLY 7 1HA GLY 7 -3.142 11.811 -0.896
29 HA3 GLY 7 2HA GLY 7 -3.249 13.420 -1.594
30 H VAL 8 H VAL 8 -0.455 11.605 -0.355
31 HA VAL 8 HA VAL 8 0.948 12.180 -2.854
32 HB VAL 8 HB VAL 8 2.064 12.701 -0.700
33 HG11 VAL 8 1HG1 VAL 8 3.083 10.461 0.324
34 HG12 VAL 8 2HG1 VAL 8 1.563 11.157 0.890
35 HG13 VAL 8 3HG1 VAL 8 1.547 9.817 -0.258
36 HG21 VAL 8 3HG2 VAL 8 3.139 11.602 -2.973
37 HG22 VAL 8 1HG2 VAL 8 4.052 12.357 -1.667
38 HG23 VAL 8 2HG2 VAL 8 3.836 10.607 -1.695
39 H LYS 9 H LYS 9 -1.059 10.293 -3.125
40 HA LYS 9 HA LYS 9 0.445 7.772 -3.388
41 HB2 LYS 9 1HB LYS 9 -1.793 6.657 -3.393
42 HB3 LYS 9 2HB LYS 9 -1.394 7.457 -1.879
43 HG2 LYS 9 1HG LYS 9 -2.793 9.362 -2.526
44 HG3 LYS 9 2HG LYS 9 -3.211 8.533 -4.027
45 HD2 LYS 9 1HD LYS 9 -5.003 7.933 -2.741
46 HD3 LYS 9 2HD LYS 9 -3.904 6.607 -2.353
47 HE2 LYS 9 1HE LYS 9 -4.703 7.310 -0.275
48 HE3 LYS 9 2HE LYS 9 -3.122 8.080 -0.408
49 HZ1 LYS 9 3HZ LYS 9 -4.878 9.870 -1.516
50 HZ2 LYS 9 1HZ LYS 9 -4.164 9.977 0.014
51 HZ3 LYS 9 2HZ LYS 9 -5.694 9.277 -0.158
52 HA PRO 10 HA PRO 10 -0.516 9.417 -7.651
53 HB2 PRO 10 1HB PRO 10 2.007 9.124 -8.609
54 HB3 PRO 10 2HB PRO 10 1.459 10.583 -7.774
55 HG2 PRO 10 1HG PRO 10 3.041 8.273 -6.712
56 HG3 PRO 10 2HG PRO 10 3.276 10.009 -6.440
57 HD2 PRO 10 1HD PRO 10 2.062 8.402 -4.630
58 HD3 PRO 10 2HD PRO 10 1.622 10.109 -4.837
59 H TYR 11 H TYR 11 0.504 6.557 -6.191
60 HA TYR 11 HA TYR 11 0.072 5.068 -8.696
61 HB2 TYR 11 1HB TYR 11 1.977 4.344 -6.460
62 HB3 TYR 11 2HB TYR 11 1.653 3.360 -7.883
63 HD1 TYR 11 HD1 TYR 11 2.357 4.189 -10.133
64 HD2 TYR 11 HD2 TYR 11 3.511 6.154 -6.540
65 HE1 TYR 11 HE1 TYR 11 4.146 5.356 -11.353
66 HE2 TYR 11 HE2 TYR 11 5.302 7.327 -7.750
67 HH TYR 11 HH TYR 11 5.666 7.017 -11.248
68 H GLY 12 H GLY 12 -1.757 5.875 -6.489
69 HA2 GLY 12 1HA GLY 12 -2.429 3.982 -4.663
70 HA3 GLY 12 2HA GLY 12 -3.632 4.890 -5.566
71 H CYS 13 H CYS 13 -2.675 1.860 -4.756
72 HA CYS 13 HA CYS 13 -2.946 0.397 -7.140
73 HB2 CYS 13 1HB CYS 13 -2.005 -0.814 -5.387
74 HB3 CYS 13 2HB CYS 13 -3.218 -0.274 -4.231
75 H SER 14 H SER 14 -4.658 0.347 -8.425
76 HA SER 14 HA SER 14 -7.319 0.831 -7.335
77 HB2 SER 14 1HB SER 14 -6.346 0.588 -10.191
78 HB3 SER 14 2HB SER 14 -8.008 0.946 -9.725
79 HG SER 14 HG SER 14 -7.451 2.938 -9.370
80 H GLU 15 H GLU 15 -6.308 -1.573 -6.485
81 HA GLU 15 HA GLU 15 -8.017 -3.476 -7.935
82 HB2 GLU 15 1HB GLU 15 -5.153 -3.743 -7.179
83 HB3 GLU 15 2HB GLU 15 -6.169 -5.168 -7.010
84 HG2 GLU 15 1HG GLU 15 -5.640 -3.592 -9.514
85 HG3 GLU 15 2HG GLU 15 -5.120 -5.235 -9.148
86 H CYS 16 H CYS 16 -6.373 -2.683 -4.903
87 HA CYS 16 HA CYS 16 -8.556 -4.039 -3.463
88 HB2 CYS 16 1HB CYS 16 -7.009 -4.781 -1.769
89 HB3 CYS 16 2HB CYS 16 -6.412 -5.312 -3.337
90 H GLY 17 H GLY 17 -6.014 -1.563 -3.259
91 HA2 GLY 17 1HA GLY 17 -6.994 0.698 -2.679
92 HA3 GLY 17 2HA GLY 17 -7.695 -0.132 -1.298
93 H LYS 18 H LYS 18 -4.535 0.411 -2.848
94 HA LYS 18 HA LYS 18 -3.396 0.759 -0.154
95 HB2 LYS 18 1HB LYS 18 -2.347 -0.789 -2.497
96 HB3 LYS 18 2HB LYS 18 -1.224 -0.082 -1.343
97 HG2 LYS 18 1HG LYS 18 -2.815 -1.303 0.387
98 HG3 LYS 18 2HG LYS 18 -3.124 -2.332 -1.014
99 HD2 LYS 18 1HD LYS 18 -1.319 -3.423 -0.140
100 HD3 LYS 18 2HD LYS 18 -0.479 -2.268 -1.177
101 HE2 LYS 18 1HE LYS 18 -1.118 -1.532 1.646
102 HE3 LYS 18 2HE LYS 18 0.253 -2.589 1.312
103 HZ1 LYS 18 3HZ LYS 18 1.126 -0.879 -0.186
104 HZ2 LYS 18 1HZ LYS 18 0.965 -0.304 1.397
105 HZ3 LYS 18 2HZ LYS 18 -0.162 0.140 0.217
106 H ALA 19 H ALA 19 -1.046 1.782 -0.502
107 HA ALA 19 HA ALA 19 -1.188 3.907 -2.514
108 HB1 ALA 19 3HB ALA 19 -2.019 5.183 -0.807
109 HB2 ALA 19 1HB ALA 19 -1.174 4.266 0.440
110 HB3 ALA 19 2HB ALA 19 -0.289 5.421 -0.557
111 H PHE 20 H PHE 20 0.832 4.868 -3.026
112 HA PHE 20 HA PHE 20 3.241 3.823 -1.812
113 HB2 PHE 20 1HB PHE 20 2.806 3.369 -4.766
114 HB3 PHE 20 2HB PHE 20 4.151 2.808 -3.779
115 HD1 PHE 20 HD2 PHE 20 3.740 1.046 -2.049
116 HD2 PHE 20 HD1 PHE 20 0.836 2.110 -4.973
117 HE1 PHE 20 HE2 PHE 20 2.556 -1.072 -1.639
118 HE2 PHE 20 HE1 PHE 20 -0.353 -0.006 -4.567
119 HZ PHE 20 HZ PHE 20 0.507 -1.601 -2.899
120 H ARG 21 H ARG 21 4.923 5.213 -1.986
121 HA ARG 21 HA ARG 21 4.418 7.700 -3.449
122 HB2 ARG 21 1HB ARG 21 6.471 8.443 -2.038
123 HB3 ARG 21 2HB ARG 21 4.909 8.261 -1.252
124 HG2 ARG 21 1HG ARG 21 6.731 5.919 -1.286
125 HG3 ARG 21 2HG ARG 21 7.118 7.266 -0.213
126 HD2 ARG 21 1HD ARG 21 4.372 6.064 -0.275
127 HD3 ARG 21 2HD ARG 21 5.659 5.348 0.694
128 HE ARG 21 HE ARG 21 5.702 7.942 1.445
129 HH11 ARG 21 1HH1 ARG 21 3.164 5.570 1.213
130 HH12 ARG 21 2HH1 ARG 21 2.234 6.248 2.508
131 HH21 ARG 21 1HH2 ARG 21 4.486 8.844 3.151
132 HH22 ARG 21 2HH2 ARG 21 2.986 8.111 3.609
133 H SER 22 H SER 22 5.493 5.063 -4.526
134 HA SER 22 HA SER 22 7.392 6.198 -6.317
135 HB2 SER 22 1HB SER 22 8.371 4.593 -4.008
136 HB3 SER 22 2HB SER 22 9.120 4.297 -5.576
137 HG SER 22 HG SER 22 8.799 6.951 -4.800
138 H LYS 23 H LYS 23 7.708 4.933 -8.131
139 HA LYS 23 HA LYS 23 5.740 3.113 -8.834
140 HB2 LYS 23 1HB LYS 23 7.270 4.366 -10.391
141 HB3 LYS 23 2HB LYS 23 8.524 3.195 -10.004
142 HG2 LYS 23 1HG LYS 23 7.464 1.484 -11.128
143 HG3 LYS 23 2HG LYS 23 5.879 2.253 -11.015
144 HD2 LYS 23 1HD LYS 23 6.355 2.653 -13.217
145 HD3 LYS 23 2HD LYS 23 7.056 4.101 -12.489
146 HE2 LYS 23 1HE LYS 23 9.203 3.406 -12.845
147 HE3 LYS 23 2HE LYS 23 8.782 1.697 -12.748
148 HZ1 LYS 23 3HZ LYS 23 8.840 3.454 -15.040
149 HZ2 LYS 23 1HZ LYS 23 7.469 2.467 -14.957
150 HZ3 LYS 23 2HZ LYS 23 9.011 1.773 -14.959
151 H SER 24 H SER 24 9.013 2.502 -7.621
152 HA SER 24 HA SER 24 9.078 -0.261 -7.889
153 HB2 SER 24 1HB SER 24 10.311 1.462 -5.726
154 HB3 SER 24 2HB SER 24 10.736 -0.222 -6.033
155 HG SER 24 HG SER 24 12.122 1.376 -7.056
156 H TYR 25 H TYR 25 8.349 1.494 -4.867
157 HA TYR 25 HA TYR 25 7.545 -0.531 -3.268
158 HB2 TYR 25 1HB TYR 25 6.657 2.298 -3.534
159 HB3 TYR 25 2HB TYR 25 5.699 1.240 -2.504
160 HD1 TYR 25 HD1 TYR 25 7.741 -0.466 -1.279
161 HD2 TYR 25 HD2 TYR 25 7.810 3.710 -2.092
162 HE1 TYR 25 HE1 TYR 25 9.348 -0.141 0.555
163 HE2 TYR 25 HE2 TYR 25 9.419 4.046 -0.262
164 HH TYR 25 HH TYR 25 11.259 1.910 0.985
165 H LEU 26 H LEU 26 5.587 1.008 -5.781
166 HA LEU 26 HA LEU 26 3.175 -0.319 -5.263
167 HB2 LEU 26 1HB LEU 26 3.199 1.583 -6.699
168 HB3 LEU 26 2HB LEU 26 4.332 0.805 -7.804
169 HG LEU 26 HG LEU 26 2.557 -0.815 -8.411
170 HD11 LEU 26 1HD1 LEU 26 0.589 0.977 -7.045
171 HD12 LEU 26 2HD1 LEU 26 1.326 -0.373 -6.183
172 HD13 LEU 26 3HD1 LEU 26 0.378 -0.670 -7.640
173 HD21 LEU 26 3HD2 LEU 26 2.046 0.549 -10.089
174 HD22 LEU 26 1HD2 LEU 26 2.867 1.837 -9.207
175 HD23 LEU 26 2HD2 LEU 26 1.127 1.614 -9.024
176 H ILE 27 H ILE 27 5.674 -1.092 -7.688
177 HA ILE 27 HA ILE 27 4.590 -3.427 -8.683
178 HB ILE 27 HB ILE 27 7.527 -2.883 -8.237
179 HG12 ILE 27 1HG1 ILE 27 6.009 -2.416 -10.791
180 HG13 ILE 27 2HG1 ILE 27 6.084 -1.174 -9.546
181 HG21 ILE 27 1HG2 ILE 27 6.712 -5.255 -8.818
182 HG22 ILE 27 2HG2 ILE 27 6.358 -4.582 -10.409
183 HG23 ILE 27 3HG2 ILE 27 8.008 -4.552 -9.786
184 HD11 ILE 27 3HD1 ILE 27 8.718 -2.012 -9.912
185 HD12 ILE 27 1HD1 ILE 27 8.026 -1.895 -11.530
186 HD13 ILE 27 2HD1 ILE 27 7.984 -0.501 -10.450
187 H ILE 28 H ILE 28 6.483 -2.939 -5.753
188 HA ILE 28 HA ILE 28 6.966 -5.619 -5.106
189 HB ILE 28 HB ILE 28 6.531 -3.318 -3.198
190 HG12 ILE 28 1HG1 ILE 28 9.156 -4.390 -4.232
191 HG13 ILE 28 2HG1 ILE 28 8.316 -3.044 -4.994
192 HG21 ILE 28 1HG2 ILE 28 6.392 -5.446 -2.062
193 HG22 ILE 28 2HG2 ILE 28 7.890 -5.982 -2.821
194 HG23 ILE 28 3HG2 ILE 28 7.917 -4.658 -1.657
195 HD11 ILE 28 3HD1 ILE 28 10.113 -2.971 -2.843
196 HD12 ILE 28 1HD1 ILE 28 9.193 -1.637 -3.538
197 HD13 ILE 28 2HD1 ILE 28 8.527 -2.560 -2.190
198 H HIS 29 H HIS 29 4.077 -3.754 -4.978
199 HA HIS 29 HA HIS 29 2.757 -5.746 -3.274
200 HB2 HIS 29 1HB HIS 29 2.324 -3.536 -2.508
201 HB3 HIS 29 2HB HIS 29 1.975 -2.962 -4.136
202 HD1 HIS 29 HD1 HIS 29 0.505 -5.398 -1.612
203 HD2 HIS 29 HD2 HIS 29 -0.669 -2.900 -4.716
204 HE1 HIS 29 HE1 HIS 29 -2.007 -5.504 -1.646
205 H MET 30 H MET 30 2.548 -4.202 -6.447
206 HA MET 30 HA MET 30 0.223 -5.586 -7.298
207 HB2 MET 30 1HB MET 30 2.424 -4.288 -8.914
208 HB3 MET 30 2HB MET 30 0.888 -4.841 -9.568
209 HG2 MET 30 1HG MET 30 -0.113 -3.262 -7.740
210 HG3 MET 30 2HG MET 30 1.476 -2.505 -7.822
211 HE1 MET 30 3HE MET 30 -1.991 -2.136 -9.018
212 HE2 MET 30 1HE MET 30 -1.940 -2.169 -10.781
213 HE3 MET 30 2HE MET 30 -1.641 -3.645 -9.862
214 H ARG 31 H ARG 31 3.557 -6.444 -7.104
215 HA ARG 31 HA ARG 31 3.890 -8.324 -9.076
216 HB2 ARG 31 1HB ARG 31 5.635 -9.240 -7.790
217 HB3 ARG 31 2HB ARG 31 5.553 -7.554 -7.296
218 HG2 ARG 31 1HG ARG 31 4.470 -8.116 -5.259
219 HG3 ARG 31 2HG ARG 31 4.218 -9.782 -5.783
220 HD2 ARG 31 1HD ARG 31 6.969 -8.609 -5.536
221 HD3 ARG 31 2HD ARG 31 6.136 -9.303 -4.146
222 HE ARG 31 HE ARG 31 5.951 -11.279 -5.945
223 HH11 ARG 31 1HH1 ARG 31 8.642 -9.329 -4.907
224 HH12 ARG 31 2HH1 ARG 31 9.818 -10.569 -5.190
225 HH21 ARG 31 1HH2 ARG 31 7.490 -12.920 -6.322
226 HH22 ARG 31 2HH2 ARG 31 9.162 -12.611 -5.996
227 H THR 32 H THR 32 2.032 -8.577 -6.125
228 HA THR 32 HA THR 32 1.524 -11.414 -6.541
229 HB THR 32 HB THR 32 1.880 -10.499 -4.241
230 HG1 THR 32 HG1 THR 32 -0.748 -11.515 -4.362
231 HG21 THR 32 3HG2 THR 32 0.647 -8.837 -3.384
232 HG22 THR 32 1HG2 THR 32 -0.860 -9.550 -3.957
233 HG23 THR 32 2HG2 THR 32 0.104 -8.540 -5.035
234 H HIS 33 H HIS 33 0.109 -8.388 -7.290
235 HA HIS 33 HA HIS 33 -2.602 -9.321 -7.488
236 HB2 HIS 33 1HB HIS 33 -1.155 -6.789 -8.105
237 HB3 HIS 33 2HB HIS 33 -2.697 -7.071 -8.909
238 HD1 HIS 33 HD1 HIS 33 -4.290 -8.332 -6.622
239 HD2 HIS 33 HD2 HIS 33 -1.844 -5.004 -6.177
240 HE1 HIS 33 HE1 HIS 33 -5.152 -7.132 -4.587
241 H THR 34 H THR 34 0.073 -8.761 -9.723
242 HA THR 34 HA THR 34 -1.381 -10.329 -11.740
243 HB THR 34 HB THR 34 -1.581 -7.999 -12.422
244 HG1 THR 34 HG1 THR 34 -0.670 -8.262 -14.486
245 HG21 THR 34 3HG2 THR 34 0.977 -7.737 -11.324
246 HG22 THR 34 1HG2 THR 34 0.040 -6.490 -12.146
247 HG23 THR 34 2HG2 THR 34 1.186 -7.476 -13.055
248 H GLY 35 H GLY 35 -0.220 -12.164 -11.775
249 HA2 GLY 35 1HA GLY 35 2.456 -12.098 -12.799
250 HA3 GLY 35 2HA GLY 35 2.407 -12.577 -11.109
251 H GLU 36 H GLU 36 2.190 -14.673 -10.698
252 HA GLU 36 HA GLU 36 0.949 -16.379 -12.751
253 HB2 GLU 36 1HB GLU 36 3.553 -16.735 -11.308
254 HB3 GLU 36 2HB GLU 36 2.649 -18.144 -11.846
255 HG2 GLU 36 1HG GLU 36 4.340 -17.523 -13.466
256 HG3 GLU 36 2HG GLU 36 2.722 -17.331 -14.139
257 H LYS 37 H LYS 37 -0.427 -15.318 -10.574
258 HA LYS 37 HA LYS 37 -0.722 -17.640 -8.786
259 HB2 LYS 37 1HB LYS 37 -0.157 -15.711 -7.500
260 HB3 LYS 37 2HB LYS 37 -1.324 -14.715 -8.360
261 HG2 LYS 37 1HG LYS 37 -3.054 -16.411 -7.389
262 HG3 LYS 37 2HG LYS 37 -1.772 -16.740 -6.221
263 HD2 LYS 37 1HD LYS 37 -2.554 -13.915 -6.802
264 HD3 LYS 37 2HD LYS 37 -3.557 -14.895 -5.730
265 HE2 LYS 37 1HE LYS 37 -1.237 -15.439 -4.611
266 HE3 LYS 37 2HE LYS 37 -0.766 -13.916 -5.364
267 HZ1 LYS 37 3HZ LYS 37 -2.759 -14.401 -3.255
268 HZ2 LYS 37 1HZ LYS 37 -2.921 -13.051 -4.263
269 HZ3 LYS 37 2HZ LYS 37 -1.530 -13.240 -3.320
270 HA PRO 38 HA PRO 38 -4.680 -18.425 -10.548
271 HB2 PRO 38 1HB PRO 38 -5.804 -19.787 -8.486
272 HB3 PRO 38 2HB PRO 38 -4.558 -20.481 -9.530
273 HG2 PRO 38 1HG PRO 38 -4.287 -19.264 -6.809
274 HG3 PRO 38 2HG PRO 38 -3.537 -20.734 -7.457
275 HD2 PRO 38 1HD PRO 38 -2.211 -18.380 -7.277
276 HD3 PRO 38 2HD PRO 38 -1.894 -19.559 -8.567
277 H SER 39 H SER 39 -5.329 -16.172 -10.562
278 HA SER 39 HA SER 39 -6.734 -15.143 -8.246
279 HB2 SER 39 1HB SER 39 -5.968 -14.042 -10.926
280 HB3 SER 39 2HB SER 39 -7.226 -13.239 -9.986
281 HG SER 39 HG SER 39 -5.338 -12.307 -9.368
282 H GLY 40 H GLY 40 -7.520 -16.108 -11.574
283 HA2 GLY 40 1HA GLY 40 -9.599 -17.459 -11.775
284 HA3 GLY 40 2HA GLY 40 -10.354 -16.253 -10.744
285 HA PRO 41 HA PRO 41 -10.901 -15.250 -15.329
286 HB2 PRO 41 1HB PRO 41 -13.593 -15.586 -15.423
287 HB3 PRO 41 2HB PRO 41 -12.450 -16.895 -15.748
288 HG2 PRO 41 1HG PRO 41 -13.968 -16.284 -13.241
289 HG3 PRO 41 2HG PRO 41 -13.681 -17.850 -14.022
290 HD2 PRO 41 1HD PRO 41 -12.254 -17.005 -11.881
291 HD3 PRO 41 2HD PRO 41 -11.557 -18.038 -13.146
292 H SER 42 H SER 42 -11.722 -14.120 -12.310
293 HA SER 42 HA SER 42 -13.539 -12.038 -12.942
294 HB2 SER 42 1HB SER 42 -11.585 -12.279 -10.641
295 HB3 SER 42 2HB SER 42 -12.899 -11.108 -10.738
296 HG SER 42 HG SER 42 -13.245 -13.923 -10.821
297 H SER 43 H SER 43 -13.037 -10.573 -14.448
298 HA SER 43 HA SER 43 -10.843 -8.772 -13.976
299 HB2 SER 43 1HB SER 43 -9.688 -9.103 -16.069
300 HB3 SER 43 2HB SER 43 -9.778 -10.657 -15.241
301 HG SER 43 HG SER 43 -11.130 -11.390 -16.721
302 H GLY 44 H GLY 44 -11.640 -6.817 -14.343
303 HA2 GLY 44 1HA GLY 44 -13.530 -6.471 -16.583
304 HA3 GLY 44 2HA GLY 44 -13.872 -5.784 -15.002
Start of MODEL 13
1 H1 GLY 1 H GLY 1 -18.927 -4.350 1.577
2 HA2 GLY 1 1HA GLY 1 -16.565 -4.412 1.168
3 HA3 GLY 1 2HA GLY 1 -16.744 -6.066 0.602
4 H SER 2 H SER 2 -17.975 -2.815 -0.198
5 HA SER 2 HA SER 2 -18.325 -3.490 -2.959
6 HB2 SER 2 1HB SER 2 -19.811 -1.847 -2.101
7 HB3 SER 2 2HB SER 2 -18.489 -0.896 -1.425
8 HG SER 2 HG SER 2 -18.473 0.131 -3.245
9 H SER 3 H SER 3 -16.529 -3.952 -4.086
10 HA SER 3 HA SER 3 -13.980 -2.875 -3.651
11 HB2 SER 3 1HB SER 3 -13.383 -3.848 -5.813
12 HB3 SER 3 2HB SER 3 -14.395 -4.969 -4.901
13 HG SER 3 HG SER 3 -15.669 -3.187 -6.627
14 H GLY 4 H GLY 4 -13.408 -0.815 -3.845
15 HA2 GLY 4 1HA GLY 4 -13.287 0.638 -6.153
16 HA3 GLY 4 2HA GLY 4 -14.871 1.025 -5.497
17 H SER 5 H SER 5 -11.551 0.664 -4.239
18 HA SER 5 HA SER 5 -11.893 3.271 -2.908
19 HB2 SER 5 1HB SER 5 -10.533 2.418 -1.031
20 HB3 SER 5 2HB SER 5 -12.013 1.481 -1.239
21 HG SER 5 HG SER 5 -10.700 -0.034 -2.450
22 H SER 6 H SER 6 -10.471 4.730 -3.561
23 HA SER 6 HA SER 6 -7.776 3.860 -4.333
24 HB2 SER 6 1HB SER 6 -9.721 5.438 -5.984
25 HB3 SER 6 2HB SER 6 -7.989 5.721 -6.164
26 HG SER 6 HG SER 6 -8.618 4.138 -7.617
27 H GLY 7 H GLY 7 -6.212 5.060 -3.451
28 HA2 GLY 7 1HA GLY 7 -6.903 7.233 -1.708
29 HA3 GLY 7 2HA GLY 7 -5.286 6.618 -2.019
30 H VAL 8 H VAL 8 -4.886 9.016 -1.883
31 HA VAL 8 HA VAL 8 -5.553 10.431 -4.359
32 HB VAL 8 HB VAL 8 -4.098 11.577 -1.982
33 HG11 VAL 8 1HG1 VAL 8 -4.418 13.629 -2.928
34 HG12 VAL 8 2HG1 VAL 8 -4.308 12.649 -4.391
35 HG13 VAL 8 3HG1 VAL 8 -5.886 13.136 -3.771
36 HG21 VAL 8 3HG2 VAL 8 -6.126 10.779 -1.058
37 HG22 VAL 8 1HG2 VAL 8 -6.368 12.501 -1.356
38 HG23 VAL 8 2HG2 VAL 8 -7.058 11.310 -2.459
39 H LYS 9 H LYS 9 -2.956 8.823 -2.790
40 HA LYS 9 HA LYS 9 -0.717 10.087 -3.825
41 HB2 LYS 9 1HB LYS 9 -1.333 7.318 -2.929
42 HB3 LYS 9 2HB LYS 9 0.147 7.558 -3.847
43 HG2 LYS 9 1HG LYS 9 0.902 7.812 -1.701
44 HG3 LYS 9 2HG LYS 9 0.557 9.487 -2.139
45 HD2 LYS 9 1HD LYS 9 -1.621 7.885 -0.900
46 HD3 LYS 9 2HD LYS 9 -0.300 8.432 0.135
47 HE2 LYS 9 1HE LYS 9 -0.724 10.742 -0.937
48 HE3 LYS 9 2HE LYS 9 -2.272 10.058 -1.433
49 HZ1 LYS 9 3HZ LYS 9 -2.415 11.249 0.682
50 HZ2 LYS 9 1HZ LYS 9 -1.286 10.190 1.366
51 HZ3 LYS 9 2HZ LYS 9 -2.794 9.610 0.866
52 HA PRO 10 HA PRO 10 -0.810 9.404 -8.167
53 HB2 PRO 10 1HB PRO 10 1.851 9.430 -8.704
54 HB3 PRO 10 2HB PRO 10 0.939 10.888 -8.298
55 HG2 PRO 10 1HG PRO 10 2.679 9.194 -6.548
56 HG3 PRO 10 2HG PRO 10 2.576 10.961 -6.648
57 HD2 PRO 10 1HD PRO 10 1.358 9.539 -4.692
58 HD3 PRO 10 2HD PRO 10 0.684 11.051 -5.334
59 H TYR 11 H TYR 11 0.612 7.191 -5.991
60 HA TYR 11 HA TYR 11 0.817 5.169 -8.127
61 HB2 TYR 11 1HB TYR 11 2.338 5.263 -5.513
62 HB3 TYR 11 2HB TYR 11 2.482 4.013 -6.744
63 HD1 TYR 11 HD1 TYR 11 3.316 4.719 -9.058
64 HD2 TYR 11 HD2 TYR 11 3.673 7.182 -5.607
65 HE1 TYR 11 HE1 TYR 11 5.084 6.015 -10.174
66 HE2 TYR 11 HE2 TYR 11 5.441 8.486 -6.714
67 HH TYR 11 HH TYR 11 7.117 8.128 -8.547
68 H GLY 12 H GLY 12 -1.470 6.042 -6.358
69 HA2 GLY 12 1HA GLY 12 -2.004 4.102 -4.404
70 HA3 GLY 12 2HA GLY 12 -3.217 5.051 -5.250
71 H CYS 13 H CYS 13 -2.146 1.980 -4.655
72 HA CYS 13 HA CYS 13 -2.377 0.604 -7.046
73 HB2 CYS 13 1HB CYS 13 -1.607 -0.567 -5.119
74 HB3 CYS 13 2HB CYS 13 -3.081 -0.208 -4.227
75 H SER 14 H SER 14 -3.973 0.702 -8.474
76 HA SER 14 HA SER 14 -6.709 1.177 -7.574
77 HB2 SER 14 1HB SER 14 -5.491 1.144 -10.345
78 HB3 SER 14 2HB SER 14 -7.188 1.482 -10.003
79 HG SER 14 HG SER 14 -6.565 3.312 -8.872
80 H GLU 15 H GLU 15 -5.832 -1.301 -6.824
81 HA GLU 15 HA GLU 15 -7.426 -3.051 -8.568
82 HB2 GLU 15 1HB GLU 15 -4.656 -3.455 -7.547
83 HB3 GLU 15 2HB GLU 15 -5.713 -4.857 -7.628
84 HG2 GLU 15 1HG GLU 15 -4.945 -3.055 -9.911
85 HG3 GLU 15 2HG GLU 15 -4.389 -4.705 -9.632
86 H CYS 16 H CYS 16 -6.061 -2.529 -5.345
87 HA CYS 16 HA CYS 16 -8.368 -3.980 -4.225
88 HB2 CYS 16 1HB CYS 16 -6.991 -4.793 -2.425
89 HB3 CYS 16 2HB CYS 16 -6.204 -5.202 -3.946
90 H GLY 17 H GLY 17 -5.970 -1.423 -3.680
91 HA2 GLY 17 1HA GLY 17 -7.110 0.753 -3.062
92 HA3 GLY 17 2HA GLY 17 -7.852 -0.182 -1.772
93 H LYS 18 H LYS 18 -4.538 0.138 -3.053
94 HA LYS 18 HA LYS 18 -3.646 0.664 -0.293
95 HB2 LYS 18 1HB LYS 18 -2.496 -1.041 -2.457
96 HB3 LYS 18 2HB LYS 18 -1.390 -0.241 -1.348
97 HG2 LYS 18 1HG LYS 18 -3.670 -1.768 -0.208
98 HG3 LYS 18 2HG LYS 18 -2.303 -2.661 -0.877
99 HD2 LYS 18 1HD LYS 18 -1.886 -0.418 1.070
100 HD3 LYS 18 2HD LYS 18 -2.269 -2.049 1.627
101 HE2 LYS 18 1HE LYS 18 -0.273 -2.917 0.878
102 HE3 LYS 18 2HE LYS 18 -0.069 -1.669 -0.351
103 HZ1 LYS 18 3HZ LYS 18 0.542 -0.098 1.309
104 HZ2 LYS 18 1HZ LYS 18 1.477 -1.485 1.562
105 HZ3 LYS 18 2HZ LYS 18 0.153 -1.163 2.564
106 H ALA 19 H ALA 19 -1.606 1.927 -0.153
107 HA ALA 19 HA ALA 19 -1.367 3.863 -2.362
108 HB1 ALA 19 3HB ALA 19 -1.338 5.683 -0.912
109 HB2 ALA 19 1HB ALA 19 -2.612 4.656 -0.254
110 HB3 ALA 19 2HB ALA 19 -1.017 4.677 0.501
111 H PHE 20 H PHE 20 0.699 4.916 -2.544
112 HA PHE 20 HA PHE 20 2.923 3.919 -0.999
113 HB2 PHE 20 1HB PHE 20 2.915 3.384 -3.971
114 HB3 PHE 20 2HB PHE 20 4.120 2.876 -2.791
115 HD1 PHE 20 HD1 PHE 20 0.552 2.435 -3.721
116 HD2 PHE 20 HD2 PHE 20 3.965 0.794 -1.778
117 HE1 PHE 20 HE1 PHE 20 -0.645 0.306 -3.423
118 HE2 PHE 20 HE2 PHE 20 2.773 -1.338 -1.477
119 HZ PHE 20 HZ PHE 20 0.465 -1.584 -2.301
120 H ARG 21 H ARG 21 4.745 5.207 -1.153
121 HA ARG 21 HA ARG 21 4.335 7.739 -2.573
122 HB2 ARG 21 1HB ARG 21 4.811 7.616 -0.055
123 HB3 ARG 21 2HB ARG 21 6.455 7.190 -0.508
124 HG2 ARG 21 1HG ARG 21 6.433 9.333 -1.902
125 HG3 ARG 21 2HG ARG 21 4.990 9.759 -0.978
126 HD2 ARG 21 1HD ARG 21 7.397 8.851 0.512
127 HD3 ARG 21 2HD ARG 21 7.417 10.468 -0.192
128 HE ARG 21 HE ARG 21 5.025 10.035 1.265
129 HH11 ARG 21 1HH1 ARG 21 8.423 10.676 1.674
130 HH12 ARG 21 2HH1 ARG 21 8.223 11.464 3.203
131 HH21 ARG 21 1HH2 ARG 21 4.750 11.071 3.278
132 HH22 ARG 21 2HH2 ARG 21 6.134 11.687 4.116
133 H SER 22 H SER 22 5.413 5.089 -3.644
134 HA SER 22 HA SER 22 7.498 6.264 -5.246
135 HB2 SER 22 1HB SER 22 8.832 5.547 -3.340
136 HB3 SER 22 2HB SER 22 8.128 3.932 -3.421
137 HG SER 22 HG SER 22 9.399 4.964 -5.692
138 H LYS 23 H LYS 23 7.646 5.321 -7.223
139 HA LYS 23 HA LYS 23 5.581 3.704 -8.156
140 HB2 LYS 23 1HB LYS 23 6.941 5.128 -9.617
141 HB3 LYS 23 2HB LYS 23 8.338 4.097 -9.336
142 HG2 LYS 23 1HG LYS 23 7.513 2.390 -10.642
143 HG3 LYS 23 2HG LYS 23 5.838 2.917 -10.457
144 HD2 LYS 23 1HD LYS 23 6.344 3.512 -12.649
145 HD3 LYS 23 2HD LYS 23 6.592 5.016 -11.758
146 HE2 LYS 23 1HE LYS 23 9.034 4.333 -11.593
147 HE3 LYS 23 2HE LYS 23 8.663 3.094 -12.790
148 HZ1 LYS 23 3HZ LYS 23 7.645 5.550 -13.686
149 HZ2 LYS 23 1HZ LYS 23 8.866 4.603 -14.376
150 HZ3 LYS 23 2HZ LYS 23 9.257 5.783 -13.230
151 H SER 24 H SER 24 8.991 2.675 -8.140
152 HA SER 24 HA SER 24 8.789 0.043 -8.542
153 HB2 SER 24 1HB SER 24 10.804 -0.299 -7.279
154 HB3 SER 24 2HB SER 24 10.899 1.310 -7.996
155 HG SER 24 HG SER 24 11.312 1.861 -6.000
156 H TYR 25 H TYR 25 8.042 1.644 -5.486
157 HA TYR 25 HA TYR 25 7.650 -0.604 -3.889
158 HB2 TYR 25 1HB TYR 25 7.580 1.989 -3.365
159 HB3 TYR 25 2HB TYR 25 5.847 1.755 -3.561
160 HD1 TYR 25 HD1 TYR 25 6.370 -1.275 -2.460
161 HD2 TYR 25 HD2 TYR 25 6.983 2.679 -1.013
162 HE1 TYR 25 HE1 TYR 25 6.219 -2.104 -0.149
163 HE2 TYR 25 HE2 TYR 25 6.836 1.861 1.302
164 HH TYR 25 HH TYR 25 7.237 -1.110 2.232
165 H LEU 26 H LEU 26 5.315 1.161 -5.904
166 HA LEU 26 HA LEU 26 3.057 -0.362 -5.289
167 HB2 LEU 26 1HB LEU 26 2.847 1.724 -6.444
168 HB3 LEU 26 2HB LEU 26 3.806 1.128 -7.796
169 HG LEU 26 HG LEU 26 1.986 -0.460 -8.336
170 HD11 LEU 26 1HD1 LEU 26 0.017 -0.594 -7.185
171 HD12 LEU 26 2HD1 LEU 26 0.145 1.046 -6.550
172 HD13 LEU 26 3HD1 LEU 26 1.126 -0.246 -5.858
173 HD21 LEU 26 3HD2 LEU 26 0.304 1.733 -8.598
174 HD22 LEU 26 1HD2 LEU 26 1.516 1.187 -9.756
175 HD23 LEU 26 2HD2 LEU 26 1.927 2.423 -8.566
176 H ILE 27 H ILE 27 5.297 -0.698 -8.040
177 HA ILE 27 HA ILE 27 4.189 -2.869 -9.300
178 HB ILE 27 HB ILE 27 7.138 -2.350 -8.906
179 HG12 ILE 27 1HG1 ILE 27 5.479 -1.626 -11.311
180 HG13 ILE 27 2HG1 ILE 27 5.635 -0.530 -9.943
181 HG21 ILE 27 1HG2 ILE 27 5.811 -3.903 -11.116
182 HG22 ILE 27 2HG2 ILE 27 7.536 -3.742 -10.792
183 HG23 ILE 27 3HG2 ILE 27 6.512 -4.653 -9.683
184 HD11 ILE 27 3HD1 ILE 27 7.271 0.207 -11.388
185 HD12 ILE 27 1HD1 ILE 27 8.173 -0.840 -10.293
186 HD13 ILE 27 2HD1 ILE 27 7.709 -1.426 -11.890
187 H ILE 28 H ILE 28 6.514 -2.926 -6.609
188 HA ILE 28 HA ILE 28 6.757 -5.700 -6.386
189 HB ILE 28 HB ILE 28 6.904 -3.691 -4.137
190 HG12 ILE 28 1HG1 ILE 28 9.290 -4.753 -5.602
191 HG13 ILE 28 2HG1 ILE 28 8.371 -3.427 -6.307
192 HG21 ILE 28 1HG2 ILE 28 7.312 -6.559 -4.288
193 HG22 ILE 28 2HG2 ILE 28 8.734 -5.711 -3.682
194 HG23 ILE 28 3HG2 ILE 28 7.178 -5.509 -2.878
195 HD11 ILE 28 3HD1 ILE 28 9.236 -1.946 -4.893
196 HD12 ILE 28 1HD1 ILE 28 9.004 -3.004 -3.501
197 HD13 ILE 28 2HD1 ILE 28 10.431 -3.189 -4.522
198 H HIS 29 H HIS 29 4.151 -3.625 -5.577
199 HA HIS 29 HA HIS 29 2.922 -5.622 -3.825
200 HB2 HIS 29 1HB HIS 29 2.724 -3.464 -2.895
201 HB3 HIS 29 2HB HIS 29 2.294 -2.743 -4.443
202 HD1 HIS 29 HD1 HIS 29 0.849 -4.607 -1.552
203 HD2 HIS 29 HD2 HIS 29 -0.409 -2.987 -5.165
204 HE1 HIS 29 HE1 HIS 29 -1.664 -4.622 -1.456
205 H MET 30 H MET 30 2.776 -4.381 -7.035
206 HA MET 30 HA MET 30 0.120 -5.415 -7.558
207 HB2 MET 30 1HB MET 30 2.197 -4.129 -9.331
208 HB3 MET 30 2HB MET 30 0.645 -4.706 -9.922
209 HG2 MET 30 1HG MET 30 -0.249 -3.168 -7.960
210 HG3 MET 30 2HG MET 30 1.286 -2.351 -8.245
211 HE1 MET 30 3HE MET 30 -1.675 -3.969 -9.823
212 HE2 MET 30 1HE MET 30 -2.518 -2.424 -9.712
213 HE3 MET 30 2HE MET 30 -2.034 -3.053 -11.287
214 H ARG 31 H ARG 31 3.403 -6.075 -8.787
215 HA ARG 31 HA ARG 31 2.951 -8.200 -10.415
216 HB2 ARG 31 1HB ARG 31 5.198 -8.981 -9.902
217 HB3 ARG 31 2HB ARG 31 5.174 -7.225 -9.998
218 HG2 ARG 31 1HG ARG 31 6.412 -7.469 -8.116
219 HG3 ARG 31 2HG ARG 31 4.805 -7.456 -7.387
220 HD2 ARG 31 1HD ARG 31 5.637 -9.324 -6.388
221 HD3 ARG 31 2HD ARG 31 4.986 -10.059 -7.853
222 HE ARG 31 HE ARG 31 7.589 -9.355 -8.437
223 HH11 ARG 31 1HH1 ARG 31 5.960 -11.428 -6.164
224 HH12 ARG 31 2HH1 ARG 31 7.269 -12.557 -6.057
225 HH21 ARG 31 1HH2 ARG 31 9.320 -10.835 -8.304
226 HH22 ARG 31 2HH2 ARG 31 9.180 -12.219 -7.274
227 H THR 32 H THR 32 2.532 -8.102 -6.995
228 HA THR 32 HA THR 32 2.580 -10.950 -6.598
229 HB THR 32 HB THR 32 1.763 -10.467 -4.339
230 HG1 THR 32 HG1 THR 32 0.578 -8.729 -4.138
231 HG21 THR 32 3HG2 THR 32 3.985 -8.686 -5.332
232 HG22 THR 32 1HG2 THR 32 4.128 -10.292 -4.619
233 HG23 THR 32 2HG2 THR 32 3.620 -8.927 -3.624
234 H HIS 33 H HIS 33 0.026 -8.467 -6.640
235 HA HIS 33 HA HIS 33 -2.218 -9.848 -6.131
236 HB2 HIS 33 1HB HIS 33 -1.639 -7.724 -8.154
237 HB3 HIS 33 2HB HIS 33 -3.230 -8.478 -8.150
238 HD1 HIS 33 HD1 HIS 33 -3.816 -8.682 -5.188
239 HD2 HIS 33 HD2 HIS 33 -2.060 -5.345 -6.931
240 HE1 HIS 33 HE1 HIS 33 -4.289 -6.776 -3.618
241 H THR 34 H THR 34 -0.733 -9.739 -9.371
242 HA THR 34 HA THR 34 -2.006 -12.338 -9.931
243 HB THR 34 HB THR 34 -3.144 -10.584 -11.211
244 HG1 THR 34 HG1 THR 34 -2.609 -12.745 -12.128
245 HG21 THR 34 3HG2 THR 34 -2.006 -8.839 -11.997
246 HG22 THR 34 1HG2 THR 34 -1.199 -9.907 -13.144
247 HG23 THR 34 2HG2 THR 34 -0.479 -9.606 -11.563
248 H GLY 35 H GLY 35 -0.734 -13.895 -10.795
249 HA2 GLY 35 1HA GLY 35 1.339 -13.923 -12.443
250 HA3 GLY 35 2HA GLY 35 2.116 -13.296 -10.997
251 H GLU 36 H GLU 36 -0.046 -15.965 -11.958
252 HA GLU 36 HA GLU 36 1.751 -17.869 -10.717
253 HB2 GLU 36 1HB GLU 36 -1.016 -17.319 -9.674
254 HB3 GLU 36 2HB GLU 36 -0.254 -18.888 -9.461
255 HG2 GLU 36 1HG GLU 36 1.602 -17.820 -8.277
256 HG3 GLU 36 2HG GLU 36 0.818 -16.254 -8.475
257 H LYS 37 H LYS 37 1.000 -20.137 -11.080
258 HA LYS 37 HA LYS 37 0.555 -20.682 -13.730
259 HB2 LYS 37 1HB LYS 37 0.015 -22.294 -11.251
260 HB3 LYS 37 2HB LYS 37 -0.333 -22.946 -12.847
261 HG2 LYS 37 1HG LYS 37 2.368 -21.885 -12.068
262 HG3 LYS 37 2HG LYS 37 1.892 -23.572 -11.857
263 HD2 LYS 37 1HD LYS 37 1.767 -23.954 -14.143
264 HD3 LYS 37 2HD LYS 37 1.587 -22.239 -14.520
265 HE2 LYS 37 1HE LYS 37 4.103 -23.306 -13.286
266 HE3 LYS 37 2HE LYS 37 3.839 -23.386 -15.027
267 HZ1 LYS 37 3HZ LYS 37 3.366 -20.907 -14.845
268 HZ2 LYS 37 1HZ LYS 37 4.977 -21.400 -14.693
269 HZ3 LYS 37 2HZ LYS 37 4.085 -20.990 -13.316
270 HA PRO 38 HA PRO 38 -3.687 -19.841 -14.544
271 HB2 PRO 38 1HB PRO 38 -4.067 -21.495 -16.663
272 HB3 PRO 38 2HB PRO 38 -3.138 -19.994 -16.770
273 HG2 PRO 38 1HG PRO 38 -2.162 -22.808 -16.469
274 HG3 PRO 38 2HG PRO 38 -1.540 -21.513 -17.509
275 HD2 PRO 38 1HD PRO 38 -0.377 -22.178 -15.156
276 HD3 PRO 38 2HD PRO 38 -0.376 -20.518 -15.786
277 H SER 39 H SER 39 -5.214 -20.531 -13.179
278 HA SER 39 HA SER 39 -5.812 -23.416 -13.106
279 HB2 SER 39 1HB SER 39 -5.996 -21.450 -10.810
280 HB3 SER 39 2HB SER 39 -6.473 -23.146 -10.744
281 HG SER 39 HG SER 39 -4.473 -23.578 -10.326
282 H GLY 40 H GLY 40 -8.062 -23.928 -12.513
283 HA2 GLY 40 1HA GLY 40 -9.903 -22.598 -14.145
284 HA3 GLY 40 2HA GLY 40 -10.320 -23.736 -12.873
285 HA PRO 41 HA PRO 41 -11.253 -19.129 -11.813
286 HB2 PRO 41 1HB PRO 41 -13.748 -18.840 -12.843
287 HB3 PRO 41 2HB PRO 41 -12.284 -18.417 -13.739
288 HG2 PRO 41 1HG PRO 41 -13.962 -20.891 -13.910
289 HG3 PRO 41 2HG PRO 41 -13.240 -19.935 -15.218
290 HD2 PRO 41 1HD PRO 41 -12.143 -22.243 -14.324
291 HD3 PRO 41 2HD PRO 41 -11.164 -20.899 -14.947
292 H SER 42 H SER 42 -13.233 -18.398 -10.515
293 HA SER 42 HA SER 42 -14.487 -20.687 -9.154
294 HB2 SER 42 1HB SER 42 -12.962 -18.395 -7.962
295 HB3 SER 42 2HB SER 42 -14.275 -19.139 -7.048
296 HG SER 42 HG SER 42 -12.089 -20.036 -6.748
297 H SER 43 H SER 43 -14.578 -17.118 -9.165
298 HA SER 43 HA SER 43 -17.325 -17.097 -10.011
299 HB2 SER 43 1HB SER 43 -18.314 -16.158 -8.052
300 HB3 SER 43 2HB SER 43 -17.424 -17.584 -7.522
301 HG SER 43 HG SER 43 -16.516 -14.897 -7.376
302 H GLY 44 H GLY 44 -18.189 -14.735 -9.857
303 HA2 GLY 44 1HA GLY 44 -17.961 -12.552 -10.527
304 HA3 GLY 44 2HA GLY 44 -16.408 -12.567 -9.707
Start of MODEL 14
1 H1 GLY 1 H GLY 1 -9.805 25.507 -8.079
2 HA2 GLY 1 1HA GLY 1 -12.477 25.321 -8.712
3 HA3 GLY 1 2HA GLY 1 -11.765 26.251 -10.022
4 H SER 2 H SER 2 -10.563 23.472 -8.151
5 HA SER 2 HA SER 2 -10.775 21.728 -10.444
6 HB2 SER 2 1HB SER 2 -8.601 23.116 -10.666
7 HB3 SER 2 2HB SER 2 -8.006 22.129 -9.331
8 HG SER 2 HG SER 2 -9.094 21.035 -11.707
9 H SER 3 H SER 3 -10.106 19.510 -9.939
10 HA SER 3 HA SER 3 -11.211 18.468 -7.692
11 HB2 SER 3 1HB SER 3 -9.824 16.453 -8.054
12 HB3 SER 3 2HB SER 3 -10.478 17.078 -9.567
13 HG SER 3 HG SER 3 -8.168 16.495 -9.533
14 H GLY 4 H GLY 4 -7.742 19.205 -8.074
15 HA2 GLY 4 1HA GLY 4 -6.374 20.157 -6.407
16 HA3 GLY 4 2HA GLY 4 -7.595 19.756 -5.208
17 H SER 5 H SER 5 -5.745 18.992 -3.956
18 HA SER 5 HA SER 5 -5.103 16.209 -4.652
19 HB2 SER 5 1HB SER 5 -3.227 18.432 -3.981
20 HB3 SER 5 2HB SER 5 -2.845 16.815 -3.389
21 HG SER 5 HG SER 5 -2.619 16.103 -5.419
22 H SER 6 H SER 6 -6.543 15.348 -3.199
23 HA SER 6 HA SER 6 -6.344 16.166 -0.395
24 HB2 SER 6 1HB SER 6 -8.387 14.775 -0.090
25 HB3 SER 6 2HB SER 6 -8.603 16.057 -1.282
26 HG SER 6 HG SER 6 -9.391 13.934 -1.915
27 H GLY 7 H GLY 7 -4.337 15.195 0.087
28 HA2 GLY 7 1HA GLY 7 -2.868 13.458 0.532
29 HA3 GLY 7 2HA GLY 7 -4.275 12.835 1.380
30 H VAL 8 H VAL 8 -3.531 13.173 -2.085
31 HA VAL 8 HA VAL 8 -4.034 10.281 -2.362
32 HB VAL 8 HB VAL 8 -4.537 12.467 -4.386
33 HG11 VAL 8 1HG1 VAL 8 -5.642 9.823 -4.918
34 HG12 VAL 8 2HG1 VAL 8 -4.772 10.925 -5.987
35 HG13 VAL 8 3HG1 VAL 8 -3.879 9.852 -4.907
36 HG21 VAL 8 3HG2 VAL 8 -6.172 11.260 -2.317
37 HG22 VAL 8 1HG2 VAL 8 -6.478 12.684 -3.311
38 HG23 VAL 8 2HG2 VAL 8 -6.889 11.080 -3.918
39 H LYS 9 H LYS 9 -2.427 9.072 -3.124
40 HA LYS 9 HA LYS 9 0.034 10.362 -3.969
41 HB2 LYS 9 1HB LYS 9 -0.542 7.412 -3.656
42 HB3 LYS 9 2HB LYS 9 1.040 8.170 -3.785
43 HG2 LYS 9 1HG LYS 9 -0.740 9.025 -1.568
44 HG3 LYS 9 2HG LYS 9 0.028 7.439 -1.463
45 HD2 LYS 9 1HD LYS 9 1.650 8.705 -0.474
46 HD3 LYS 9 2HD LYS 9 2.168 8.840 -2.156
47 HE2 LYS 9 1HE LYS 9 2.201 11.045 -1.582
48 HE3 LYS 9 2HE LYS 9 0.524 10.915 -2.110
49 HZ1 LYS 9 3HZ LYS 9 0.737 12.076 0.012
50 HZ2 LYS 9 1HZ LYS 9 1.448 10.706 0.705
51 HZ3 LYS 9 2HZ LYS 9 -0.158 10.650 0.177
52 HA PRO 10 HA PRO 10 -0.501 9.803 -8.294
53 HB2 PRO 10 1HB PRO 10 2.082 9.493 -9.071
54 HB3 PRO 10 2HB PRO 10 1.413 11.046 -8.557
55 HG2 PRO 10 1HG PRO 10 3.057 9.085 -7.005
56 HG3 PRO 10 2HG PRO 10 3.184 10.853 -7.063
57 HD2 PRO 10 1HD PRO 10 1.964 9.546 -5.030
58 HD3 PRO 10 2HD PRO 10 1.445 11.152 -5.580
59 H TYR 11 H TYR 11 0.596 7.343 -6.269
60 HA TYR 11 HA TYR 11 0.243 5.369 -8.416
61 HB2 TYR 11 1HB TYR 11 2.287 5.028 -6.225
62 HB3 TYR 11 2HB TYR 11 2.091 4.063 -7.684
63 HD1 TYR 11 HD1 TYR 11 2.612 5.143 -9.919
64 HD2 TYR 11 HD2 TYR 11 3.700 6.907 -6.204
65 HE1 TYR 11 HE1 TYR 11 4.263 6.551 -11.078
66 HE2 TYR 11 HE2 TYR 11 5.353 8.321 -7.352
67 HH TYR 11 HH TYR 11 6.406 8.724 -9.282
68 H GLY 12 H GLY 12 -1.883 5.040 -7.664
69 HA2 GLY 12 1HA GLY 12 -2.050 3.729 -5.020
70 HA3 GLY 12 2HA GLY 12 -3.364 4.650 -5.738
71 H CYS 13 H CYS 13 -2.323 1.610 -5.104
72 HA CYS 13 HA CYS 13 -2.885 0.168 -7.443
73 HB2 CYS 13 1HB CYS 13 -1.736 -0.947 -5.678
74 HB3 CYS 13 2HB CYS 13 -3.019 -0.591 -4.526
75 H SER 14 H SER 14 -4.727 0.242 -8.541
76 HA SER 14 HA SER 14 -7.250 0.676 -7.143
77 HB2 SER 14 1HB SER 14 -6.484 1.865 -9.331
78 HB3 SER 14 2HB SER 14 -6.991 0.373 -10.122
79 HG SER 14 HG SER 14 -8.750 1.557 -8.307
80 H GLU 15 H GLU 15 -6.171 -1.776 -6.548
81 HA GLU 15 HA GLU 15 -8.044 -3.589 -7.912
82 HB2 GLU 15 1HB GLU 15 -5.120 -3.915 -7.456
83 HB3 GLU 15 2HB GLU 15 -6.134 -5.340 -7.284
84 HG2 GLU 15 1HG GLU 15 -6.253 -3.601 -9.722
85 HG3 GLU 15 2HG GLU 15 -5.076 -4.903 -9.557
86 H CYS 16 H CYS 16 -6.101 -2.956 -5.024
87 HA CYS 16 HA CYS 16 -8.055 -4.515 -3.462
88 HB2 CYS 16 1HB CYS 16 -6.301 -5.038 -1.877
89 HB3 CYS 16 2HB CYS 16 -5.778 -5.510 -3.491
90 H GLY 17 H GLY 17 -5.903 -1.695 -3.436
91 HA2 GLY 17 1HA GLY 17 -7.070 0.406 -2.732
92 HA3 GLY 17 2HA GLY 17 -7.636 -0.519 -1.349
93 H LYS 18 H LYS 18 -4.485 -0.016 -2.944
94 HA LYS 18 HA LYS 18 -3.417 0.881 -0.357
95 HB2 LYS 18 1HB LYS 18 -2.274 -1.218 -2.189
96 HB3 LYS 18 2HB LYS 18 -1.274 -0.358 -1.026
97 HG2 LYS 18 1HG LYS 18 -3.167 -1.140 0.643
98 HG3 LYS 18 2HG LYS 18 -3.384 -2.395 -0.580
99 HD2 LYS 18 1HD LYS 18 -0.954 -2.894 -0.416
100 HD3 LYS 18 2HD LYS 18 -0.843 -1.730 0.906
101 HE2 LYS 18 1HE LYS 18 -1.134 -3.643 2.113
102 HE3 LYS 18 2HE LYS 18 -2.822 -3.190 1.877
103 HZ1 LYS 18 3HZ LYS 18 -2.847 -5.377 1.254
104 HZ2 LYS 18 1HZ LYS 18 -1.283 -5.344 0.608
105 HZ3 LYS 18 2HZ LYS 18 -2.565 -4.647 -0.246
106 H ALA 19 H ALA 19 -1.184 1.891 -0.664
107 HA ALA 19 HA ALA 19 -0.962 3.257 -3.254
108 HB1 ALA 19 3HB ALA 19 -1.941 4.486 -0.950
109 HB2 ALA 19 1HB ALA 19 -0.274 5.044 -1.101
110 HB3 ALA 19 2HB ALA 19 -1.405 5.274 -2.434
111 H PHE 20 H PHE 20 1.164 4.623 -3.232
112 HA PHE 20 HA PHE 20 3.303 3.581 -1.624
113 HB2 PHE 20 1HB PHE 20 3.566 3.056 -4.572
114 HB3 PHE 20 2HB PHE 20 4.513 2.391 -3.245
115 HD1 PHE 20 HD1 PHE 20 1.213 2.284 -4.902
116 HD2 PHE 20 HD2 PHE 20 3.883 0.390 -2.181
117 HE1 PHE 20 HE1 PHE 20 -0.229 0.291 -4.880
118 HE2 PHE 20 HE2 PHE 20 2.446 -1.607 -2.156
119 HZ PHE 20 HZ PHE 20 0.387 -1.659 -3.507
120 H ARG 21 H ARG 21 4.322 5.414 -1.168
121 HA ARG 21 HA ARG 21 4.200 7.824 -2.422
122 HB2 ARG 21 1HB ARG 21 5.257 7.764 -0.319
123 HB3 ARG 21 2HB ARG 21 6.423 6.558 -0.844
124 HG2 ARG 21 1HG ARG 21 7.626 8.559 -0.695
125 HG3 ARG 21 2HG ARG 21 7.326 8.330 -2.419
126 HD2 ARG 21 1HD ARG 21 6.932 10.642 -1.782
127 HD3 ARG 21 2HD ARG 21 5.428 9.873 -2.286
128 HE ARG 21 HE ARG 21 5.368 9.539 0.376
129 HH11 ARG 21 1HH1 ARG 21 5.991 12.327 -1.613
130 HH12 ARG 21 2HH1 ARG 21 5.357 13.454 -0.460
131 HH21 ARG 21 1HH2 ARG 21 4.531 11.012 1.903
132 HH22 ARG 21 2HH2 ARG 21 4.528 12.705 1.540
133 H SER 22 H SER 22 6.405 5.168 -3.174
134 HA SER 22 HA SER 22 7.304 6.663 -5.548
135 HB2 SER 22 1HB SER 22 8.993 5.871 -3.743
136 HB3 SER 22 2HB SER 22 8.744 4.268 -4.435
137 HG SER 22 HG SER 22 10.476 5.849 -5.289
138 H LYS 23 H LYS 23 7.403 5.607 -7.547
139 HA LYS 23 HA LYS 23 5.300 3.872 -8.145
140 HB2 LYS 23 1HB LYS 23 6.317 3.655 -10.355
141 HB3 LYS 23 2HB LYS 23 6.364 5.327 -9.811
142 HG2 LYS 23 1HG LYS 23 8.736 4.861 -9.048
143 HG3 LYS 23 2HG LYS 23 8.625 3.358 -9.966
144 HD2 LYS 23 1HD LYS 23 7.909 5.947 -11.275
145 HD3 LYS 23 2HD LYS 23 9.608 5.509 -11.078
146 HE2 LYS 23 1HE LYS 23 9.212 4.572 -13.119
147 HE3 LYS 23 2HE LYS 23 8.758 3.217 -12.087
148 HZ1 LYS 23 3HZ LYS 23 6.943 5.159 -13.403
149 HZ2 LYS 23 1HZ LYS 23 6.431 4.049 -12.233
150 HZ3 LYS 23 2HZ LYS 23 7.063 3.499 -13.702
151 H SER 24 H SER 24 8.699 3.219 -7.472
152 HA SER 24 HA SER 24 8.840 0.552 -8.219
153 HB2 SER 24 1HB SER 24 10.773 1.942 -7.480
154 HB3 SER 24 2HB SER 24 10.198 1.801 -5.819
155 HG SER 24 HG SER 24 11.059 -0.106 -5.725
156 H TYR 25 H TYR 25 8.350 1.710 -4.879
157 HA TYR 25 HA TYR 25 7.812 -0.538 -3.539
158 HB2 TYR 25 1HB TYR 25 6.611 2.180 -3.391
159 HB3 TYR 25 2HB TYR 25 5.833 0.902 -2.464
160 HD1 TYR 25 HD2 TYR 25 9.152 2.493 -3.039
161 HD2 TYR 25 HD1 TYR 25 6.653 0.327 -0.361
162 HE1 TYR 25 HE2 TYR 25 10.827 2.772 -1.259
163 HE2 TYR 25 HE1 TYR 25 8.320 0.602 1.426
164 HH TYR 25 HH TYR 25 11.230 2.549 0.941
165 H LEU 26 H LEU 26 5.312 1.193 -5.402
166 HA LEU 26 HA LEU 26 3.164 -0.442 -5.038
167 HB2 LEU 26 1HB LEU 26 2.793 1.465 -6.315
168 HB3 LEU 26 2HB LEU 26 4.112 1.095 -7.423
169 HG LEU 26 HG LEU 26 2.700 -0.818 -8.275
170 HD11 LEU 26 1HD1 LEU 26 0.346 -0.804 -7.833
171 HD12 LEU 26 2HD1 LEU 26 0.495 0.633 -6.823
172 HD13 LEU 26 3HD1 LEU 26 1.202 -0.893 -6.294
173 HD21 LEU 26 3HD2 LEU 26 2.959 1.533 -9.281
174 HD22 LEU 26 1HD2 LEU 26 1.333 1.822 -8.663
175 HD23 LEU 26 2HD2 LEU 26 1.615 0.533 -9.834
176 H ILE 27 H ILE 27 5.585 -0.836 -7.628
177 HA ILE 27 HA ILE 27 4.664 -3.122 -8.815
178 HB ILE 27 HB ILE 27 7.548 -2.427 -8.250
179 HG12 ILE 27 1HG1 ILE 27 6.111 -2.041 -10.858
180 HG13 ILE 27 2HG1 ILE 27 5.971 -0.835 -9.583
181 HG21 ILE 27 1HG2 ILE 27 7.721 -3.830 -10.487
182 HG22 ILE 27 2HG2 ILE 27 7.775 -4.600 -8.902
183 HG23 ILE 27 3HG2 ILE 27 6.275 -4.595 -9.829
184 HD11 ILE 27 3HD1 ILE 27 8.291 -1.555 -11.274
185 HD12 ILE 27 1HD1 ILE 27 7.728 0.024 -10.727
186 HD13 ILE 27 2HD1 ILE 27 8.607 -1.031 -9.620
187 H ILE 28 H ILE 28 7.182 -3.141 -6.283
188 HA ILE 28 HA ILE 28 7.472 -5.754 -5.769
189 HB ILE 28 HB ILE 28 7.103 -3.662 -3.622
190 HG12 ILE 28 1HG1 ILE 28 9.740 -3.923 -3.772
191 HG13 ILE 28 2HG1 ILE 28 9.365 -4.411 -5.421
192 HG21 ILE 28 1HG2 ILE 28 8.360 -5.111 -2.177
193 HG22 ILE 28 2HG2 ILE 28 6.984 -6.007 -2.819
194 HG23 ILE 28 3HG2 ILE 28 8.596 -6.275 -3.480
195 HD11 ILE 28 3HD1 ILE 28 9.213 -2.291 -6.009
196 HD12 ILE 28 1HD1 ILE 28 7.903 -2.052 -4.853
197 HD13 ILE 28 2HD1 ILE 28 9.576 -1.803 -4.354
198 H HIS 29 H HIS 29 4.612 -3.886 -5.095
199 HA HIS 29 HA HIS 29 3.386 -6.046 -3.577
200 HB2 HIS 29 1HB HIS 29 2.774 -4.002 -2.655
201 HB3 HIS 29 2HB HIS 29 2.626 -3.221 -4.226
202 HD1 HIS 29 HD1 HIS 29 0.793 -5.721 -2.050
203 HD2 HIS 29 HD2 HIS 29 0.088 -3.138 -5.226
204 HE1 HIS 29 HE1 HIS 29 -1.696 -5.757 -2.406
205 H MET 30 H MET 30 2.633 -4.188 -6.529
206 HA MET 30 HA MET 30 0.446 -5.459 -7.469
207 HB2 MET 30 1HB MET 30 2.881 -4.527 -8.978
208 HB3 MET 30 2HB MET 30 1.450 -5.136 -9.799
209 HG2 MET 30 1HG MET 30 1.109 -2.980 -7.786
210 HG3 MET 30 2HG MET 30 1.807 -2.569 -9.352
211 HE1 MET 30 3HE MET 30 -0.871 -2.787 -7.240
212 HE2 MET 30 1HE MET 30 -1.663 -1.598 -8.275
213 HE3 MET 30 2HE MET 30 -2.358 -3.208 -8.091
214 H ARG 31 H ARG 31 3.642 -6.800 -7.219
215 HA ARG 31 HA ARG 31 3.814 -8.838 -8.943
216 HB2 ARG 31 1HB ARG 31 4.227 -9.212 -5.972
217 HB3 ARG 31 2HB ARG 31 4.977 -10.143 -7.262
218 HG2 ARG 31 1HG ARG 31 6.038 -7.995 -8.039
219 HG3 ARG 31 2HG ARG 31 5.464 -7.269 -6.537
220 HD2 ARG 31 1HD ARG 31 7.337 -9.616 -6.813
221 HD3 ARG 31 2HD ARG 31 7.755 -7.991 -6.273
222 HE ARG 31 HE ARG 31 5.832 -8.787 -4.524
223 HH11 ARG 31 1HH1 ARG 31 8.863 -10.131 -5.585
224 HH12 ARG 31 2HH1 ARG 31 9.184 -10.931 -4.083
225 HH21 ARG 31 1HH2 ARG 31 6.243 -9.836 -2.541
226 HH22 ARG 31 2HH2 ARG 31 7.692 -10.764 -2.352
227 H THR 32 H THR 32 2.049 -9.182 -5.859
228 HA THR 32 HA THR 32 0.957 -11.690 -6.346
229 HB THR 32 HB THR 32 -0.736 -11.152 -4.661
230 HG1 THR 32 HG1 THR 32 0.277 -8.545 -4.390
231 HG21 THR 32 3HG2 THR 32 1.503 -11.725 -3.886
232 HG22 THR 32 1HG2 THR 32 0.772 -10.527 -2.819
233 HG23 THR 32 2HG2 THR 32 1.990 -10.034 -3.995
234 H HIS 33 H HIS 33 -0.490 -8.493 -6.954
235 HA HIS 33 HA HIS 33 -2.916 -9.353 -8.006
236 HB2 HIS 33 1HB HIS 33 -1.264 -6.882 -8.476
237 HB3 HIS 33 2HB HIS 33 -2.799 -7.124 -9.303
238 HD1 HIS 33 HD1 HIS 33 -4.786 -7.853 -7.379
239 HD2 HIS 33 HD2 HIS 33 -1.617 -5.415 -6.248
240 HE1 HIS 33 HE1 HIS 33 -5.562 -6.661 -5.305
241 H THR 34 H THR 34 -0.115 -8.227 -9.911
242 HA THR 34 HA THR 34 -1.039 -9.035 -12.399
243 HB THR 34 HB THR 34 1.381 -9.095 -13.082
244 HG1 THR 34 HG1 THR 34 2.851 -8.339 -11.408
245 HG21 THR 34 3HG2 THR 34 0.452 -6.702 -11.491
246 HG22 THR 34 1HG2 THR 34 0.122 -7.019 -13.193
247 HG23 THR 34 2HG2 THR 34 1.771 -6.693 -12.660
248 H GLY 35 H GLY 35 0.688 -10.866 -9.933
249 HA2 GLY 35 1HA GLY 35 1.271 -13.138 -11.509
250 HA3 GLY 35 2HA GLY 35 1.185 -13.101 -9.754
251 H GLU 36 H GLU 36 0.319 -15.252 -11.396
252 HA GLU 36 HA GLU 36 -1.475 -16.603 -11.828
253 HB2 GLU 36 1HB GLU 36 -1.279 -16.278 -9.208
254 HB3 GLU 36 2HB GLU 36 -2.841 -15.499 -9.416
255 HG2 GLU 36 1HG GLU 36 -3.030 -17.870 -8.816
256 HG3 GLU 36 2HG GLU 36 -3.769 -17.500 -10.372
257 H LYS 37 H LYS 37 -1.644 -14.233 -13.257
258 HA LYS 37 HA LYS 37 -4.543 -13.987 -13.519
259 HB2 LYS 37 1HB LYS 37 -4.028 -12.076 -12.169
260 HB3 LYS 37 2HB LYS 37 -2.645 -11.665 -13.176
261 HG2 LYS 37 1HG LYS 37 -4.334 -11.357 -15.065
262 HG3 LYS 37 2HG LYS 37 -5.564 -11.380 -13.799
263 HD2 LYS 37 1HD LYS 37 -3.989 -9.590 -12.690
264 HD3 LYS 37 2HD LYS 37 -3.434 -9.365 -14.351
265 HE2 LYS 37 1HE LYS 37 -5.164 -7.806 -14.081
266 HE3 LYS 37 2HE LYS 37 -5.899 -9.143 -14.964
267 HZ1 LYS 37 3HZ LYS 37 -7.336 -8.381 -13.187
268 HZ2 LYS 37 1HZ LYS 37 -6.123 -8.663 -12.041
269 HZ3 LYS 37 2HZ LYS 37 -6.816 -9.960 -12.877
270 HA PRO 38 HA PRO 38 -3.524 -14.430 -17.786
271 HB2 PRO 38 1HB PRO 38 -5.875 -13.582 -18.847
272 HB3 PRO 38 2HB PRO 38 -5.686 -15.156 -18.065
273 HG2 PRO 38 1HG PRO 38 -6.820 -12.615 -16.960
274 HG3 PRO 38 2HG PRO 38 -7.421 -14.275 -16.791
275 HD2 PRO 38 1HD PRO 38 -6.011 -13.030 -14.843
276 HD3 PRO 38 2HD PRO 38 -5.919 -14.782 -15.118
277 H SER 39 H SER 39 -5.327 -11.446 -17.009
278 HA SER 39 HA SER 39 -4.065 -10.005 -19.159
279 HB2 SER 39 1HB SER 39 -5.992 -9.208 -16.978
280 HB3 SER 39 2HB SER 39 -5.315 -8.038 -18.110
281 HG SER 39 HG SER 39 -6.944 -10.281 -18.689
282 H GLY 40 H GLY 40 -3.136 -7.762 -18.619
283 HA2 GLY 40 1HA GLY 40 -1.935 -6.472 -16.903
284 HA3 GLY 40 2HA GLY 40 -1.346 -8.006 -16.280
285 HA PRO 41 HA PRO 41 1.732 -6.074 -19.276
286 HB2 PRO 41 1HB PRO 41 3.749 -5.760 -17.486
287 HB3 PRO 41 2HB PRO 41 2.525 -4.520 -17.781
288 HG2 PRO 41 1HG PRO 41 2.687 -6.534 -15.572
289 HG3 PRO 41 2HG PRO 41 2.259 -4.815 -15.490
290 HD2 PRO 41 1HD PRO 41 0.399 -6.782 -15.465
291 HD3 PRO 41 2HD PRO 41 0.096 -5.190 -16.191
292 H SER 42 H SER 42 1.443 -8.748 -17.210
293 HA SER 42 HA SER 42 3.563 -10.147 -18.689
294 HB2 SER 42 1HB SER 42 4.400 -11.210 -16.748
295 HB3 SER 42 2HB SER 42 4.214 -9.517 -16.289
296 HG SER 42 HG SER 42 3.356 -11.227 -14.816
297 H SER 43 H SER 43 2.999 -12.089 -19.482
298 HA SER 43 HA SER 43 0.251 -12.948 -19.121
299 HB2 SER 43 1HB SER 43 0.631 -14.407 -20.996
300 HB3 SER 43 2HB SER 43 1.356 -12.846 -21.379
301 HG SER 43 HG SER 43 3.127 -13.918 -21.680
302 H GLY 44 H GLY 44 -0.399 -14.965 -18.363
303 HA2 GLY 44 1HA GLY 44 1.561 -16.258 -16.596
304 HA3 GLY 44 2HA GLY 44 -0.187 -16.367 -16.443
Start of MODEL 15
1 H1 GLY 1 H GLY 1 -2.495 9.174 6.440
2 HA2 GLY 1 1HA GLY 1 -3.441 8.182 8.648
3 HA3 GLY 1 2HA GLY 1 -1.846 7.448 8.727
4 H SER 2 H SER 2 0.012 9.026 8.544
5 HA SER 2 HA SER 2 -0.368 11.071 10.521
6 HB2 SER 2 1HB SER 2 2.097 10.491 8.863
7 HB3 SER 2 2HB SER 2 2.029 11.408 10.368
8 HG SER 2 HG SER 2 2.677 9.087 10.453
9 H SER 3 H SER 3 0.621 13.287 10.142
10 HA SER 3 HA SER 3 0.504 14.321 7.457
11 HB2 SER 3 1HB SER 3 -1.925 14.151 8.431
12 HB3 SER 3 2HB SER 3 -1.453 15.581 9.348
13 HG SER 3 HG SER 3 -2.462 15.868 7.172
14 H GLY 4 H GLY 4 1.446 16.350 7.258
15 HA2 GLY 4 1HA GLY 4 1.919 18.258 9.165
16 HA3 GLY 4 2HA GLY 4 3.210 17.088 9.397
17 H SER 5 H SER 5 4.545 16.577 7.484
18 HA SER 5 HA SER 5 5.212 19.034 6.098
19 HB2 SER 5 1HB SER 5 7.185 17.745 5.293
20 HB3 SER 5 2HB SER 5 7.036 17.743 7.050
21 HG SER 5 HG SER 5 6.102 15.667 5.355
22 H SER 6 H SER 6 5.736 18.969 3.756
23 HA SER 6 HA SER 6 3.554 18.398 2.193
24 HB2 SER 6 1HB SER 6 5.341 19.857 1.419
25 HB3 SER 6 2HB SER 6 6.461 18.496 1.349
26 HG SER 6 HG SER 6 5.737 18.124 -0.575
27 H GLY 7 H GLY 7 2.982 16.755 0.750
28 HA2 GLY 7 1HA GLY 7 4.481 14.424 0.271
29 HA3 GLY 7 2HA GLY 7 3.407 14.126 1.629
30 H VAL 8 H VAL 8 3.588 13.256 -1.331
31 HA VAL 8 HA VAL 8 0.710 13.567 -1.845
32 HB VAL 8 HB VAL 8 1.177 13.697 -4.279
33 HG11 VAL 8 1HG1 VAL 8 1.315 15.716 -2.363
34 HG12 VAL 8 2HG1 VAL 8 2.643 16.049 -3.477
35 HG13 VAL 8 3HG1 VAL 8 0.994 15.905 -4.087
36 HG21 VAL 8 3HG2 VAL 8 4.030 14.267 -3.504
37 HG22 VAL 8 1HG2 VAL 8 3.478 12.692 -4.074
38 HG23 VAL 8 2HG2 VAL 8 3.358 14.102 -5.126
39 H LYS 9 H LYS 9 -0.322 11.785 -2.654
40 HA LYS 9 HA LYS 9 1.325 9.362 -2.974
41 HB2 LYS 9 1HB LYS 9 -0.707 8.110 -2.200
42 HB3 LYS 9 2HB LYS 9 0.029 9.137 -0.976
43 HG2 LYS 9 1HG LYS 9 -1.676 10.814 -1.300
44 HG3 LYS 9 2HG LYS 9 -2.381 9.880 -2.621
45 HD2 LYS 9 1HD LYS 9 -3.751 9.213 -0.921
46 HD3 LYS 9 2HD LYS 9 -2.477 8.003 -0.753
47 HE2 LYS 9 1HE LYS 9 -2.950 8.849 1.422
48 HE3 LYS 9 2HE LYS 9 -1.392 9.508 0.928
49 HZ1 LYS 9 3HZ LYS 9 -3.973 10.875 1.226
50 HZ2 LYS 9 1HZ LYS 9 -2.853 11.475 0.109
51 HZ3 LYS 9 2HZ LYS 9 -2.437 11.357 1.744
52 HA PRO 10 HA PRO 10 -0.939 10.238 -6.959
53 HB2 PRO 10 1HB PRO 10 1.240 9.949 -8.553
54 HB3 PRO 10 2HB PRO 10 0.797 11.486 -7.801
55 HG2 PRO 10 1HG PRO 10 2.837 9.474 -6.936
56 HG3 PRO 10 2HG PRO 10 2.959 11.243 -6.980
57 HD2 PRO 10 1HD PRO 10 2.460 9.872 -4.698
58 HD3 PRO 10 2HD PRO 10 1.808 11.496 -4.999
59 H TYR 11 H TYR 11 1.395 7.802 -5.961
60 HA TYR 11 HA TYR 11 0.438 5.908 -7.950
61 HB2 TYR 11 1HB TYR 11 2.407 5.323 -5.746
62 HB3 TYR 11 2HB TYR 11 2.231 4.509 -7.297
63 HD1 TYR 11 HD1 TYR 11 3.053 5.580 -9.360
64 HD2 TYR 11 HD2 TYR 11 3.692 7.337 -5.538
65 HE1 TYR 11 HE1 TYR 11 4.790 7.031 -10.324
66 HE2 TYR 11 HE2 TYR 11 5.429 8.793 -6.491
67 HH TYR 11 HH TYR 11 6.848 8.273 -9.442
68 H GLY 12 H GLY 12 -1.337 4.768 -7.572
69 HA2 GLY 12 1HA GLY 12 -1.754 3.670 -4.877
70 HA3 GLY 12 2HA GLY 12 -3.059 4.563 -5.644
71 H CYS 13 H CYS 13 -2.030 1.553 -4.992
72 HA CYS 13 HA CYS 13 -2.289 0.110 -7.366
73 HB2 CYS 13 1HB CYS 13 -1.419 -0.947 -5.380
74 HB3 CYS 13 2HB CYS 13 -2.932 -0.679 -4.519
75 H SER 14 H SER 14 -3.948 -0.044 -8.706
76 HA SER 14 HA SER 14 -6.642 0.548 -7.743
77 HB2 SER 14 1HB SER 14 -5.729 1.673 -9.797
78 HB3 SER 14 2HB SER 14 -5.733 0.100 -10.594
79 HG SER 14 HG SER 14 -7.835 0.200 -10.792
80 H GLU 15 H GLU 15 -5.666 -1.868 -6.826
81 HA GLU 15 HA GLU 15 -7.404 -3.755 -8.260
82 HB2 GLU 15 1HB GLU 15 -4.536 -4.066 -7.536
83 HB3 GLU 15 2HB GLU 15 -5.573 -5.472 -7.344
84 HG2 GLU 15 1HG GLU 15 -5.201 -3.900 -9.883
85 HG3 GLU 15 2HG GLU 15 -4.455 -5.453 -9.510
86 H CYS 16 H CYS 16 -5.798 -2.859 -5.254
87 HA CYS 16 HA CYS 16 -7.854 -4.375 -3.783
88 HB2 CYS 16 1HB CYS 16 -6.233 -4.636 -1.958
89 HB3 CYS 16 2HB CYS 16 -5.625 -5.340 -3.453
90 H GLY 17 H GLY 17 -5.734 -1.522 -3.665
91 HA2 GLY 17 1HA GLY 17 -7.006 0.607 -3.280
92 HA3 GLY 17 2HA GLY 17 -7.743 -0.233 -1.923
93 H LYS 18 H LYS 18 -4.373 -0.024 -3.048
94 HA LYS 18 HA LYS 18 -3.666 1.040 -0.391
95 HB2 LYS 18 1HB LYS 18 -2.221 -0.945 -2.137
96 HB3 LYS 18 2HB LYS 18 -1.408 -0.076 -0.842
97 HG2 LYS 18 1HG LYS 18 -3.339 -0.994 0.633
98 HG3 LYS 18 2HG LYS 18 -3.534 -2.163 -0.676
99 HD2 LYS 18 1HD LYS 18 -2.065 -3.254 0.741
100 HD3 LYS 18 2HD LYS 18 -0.970 -2.492 -0.415
101 HE2 LYS 18 1HE LYS 18 -0.853 -0.552 1.237
102 HE3 LYS 18 2HE LYS 18 -1.617 -1.640 2.394
103 HZ1 LYS 18 3HZ LYS 18 0.212 -3.079 2.343
104 HZ2 LYS 18 1HZ LYS 18 0.893 -1.532 2.418
105 HZ3 LYS 18 2HZ LYS 18 0.860 -2.372 0.950
106 H ALA 19 H ALA 19 -1.310 2.009 -0.540
107 HA ALA 19 HA ALA 19 -1.014 3.555 -3.015
108 HB1 ALA 19 3HB ALA 19 -0.581 5.600 -1.652
109 HB2 ALA 19 1HB ALA 19 -2.248 5.027 -1.596
110 HB3 ALA 19 2HB ALA 19 -1.163 4.718 -0.240
111 H PHE 20 H PHE 20 1.108 4.746 -3.055
112 HA PHE 20 HA PHE 20 3.201 3.724 -1.349
113 HB2 PHE 20 1HB PHE 20 3.522 3.202 -4.292
114 HB3 PHE 20 2HB PHE 20 4.438 2.529 -2.948
115 HD1 PHE 20 HD1 PHE 20 1.044 2.540 -4.462
116 HD2 PHE 20 HD2 PHE 20 3.899 0.439 -2.106
117 HE1 PHE 20 HE1 PHE 20 -0.413 0.557 -4.471
118 HE2 PHE 20 HE2 PHE 20 2.448 -1.547 -2.112
119 HZ PHE 20 HZ PHE 20 0.289 -1.490 -3.296
120 H ARG 21 H ARG 21 4.275 5.518 -0.879
121 HA ARG 21 HA ARG 21 4.188 7.938 -2.157
122 HB2 ARG 21 1HB ARG 21 5.138 7.759 0.042
123 HB3 ARG 21 2HB ARG 21 6.431 6.721 -0.544
124 HG2 ARG 21 1HG ARG 21 7.481 8.761 -0.305
125 HG3 ARG 21 2HG ARG 21 7.069 8.740 -2.021
126 HD2 ARG 21 1HD ARG 21 5.013 10.031 -1.477
127 HD3 ARG 21 2HD ARG 21 5.577 10.146 0.189
128 HE ARG 21 HE ARG 21 7.085 11.750 -0.461
129 HH11 ARG 21 1HH1 ARG 21 5.782 10.169 -3.276
130 HH12 ARG 21 2HH1 ARG 21 6.484 11.292 -4.393
131 HH21 ARG 21 1HH2 ARG 21 8.015 13.235 -1.921
132 HH22 ARG 21 2HH2 ARG 21 7.755 13.035 -3.621
133 H SER 22 H SER 22 6.341 5.227 -2.812
134 HA SER 22 HA SER 22 7.469 6.718 -5.085
135 HB2 SER 22 1HB SER 22 8.921 5.617 -3.173
136 HB3 SER 22 2HB SER 22 8.660 4.149 -4.115
137 HG SER 22 HG SER 22 9.629 5.133 -5.872
138 H LYS 23 H LYS 23 7.577 5.756 -7.125
139 HA LYS 23 HA LYS 23 5.377 4.204 -7.891
140 HB2 LYS 23 1HB LYS 23 6.633 5.705 -9.409
141 HB3 LYS 23 2HB LYS 23 7.986 4.581 -9.374
142 HG2 LYS 23 1HG LYS 23 6.433 2.841 -10.305
143 HG3 LYS 23 2HG LYS 23 5.251 4.131 -10.538
144 HD2 LYS 23 1HD LYS 23 7.148 5.333 -11.809
145 HD3 LYS 23 2HD LYS 23 7.910 3.742 -11.870
146 HE2 LYS 23 1HE LYS 23 6.696 3.929 -13.876
147 HE3 LYS 23 2HE LYS 23 5.717 2.897 -12.835
148 HZ1 LYS 23 3HZ LYS 23 4.503 4.703 -14.068
149 HZ2 LYS 23 1HZ LYS 23 5.272 5.817 -13.053
150 HZ3 LYS 23 2HZ LYS 23 4.236 4.651 -12.399
151 H SER 24 H SER 24 8.814 3.237 -7.946
152 HA SER 24 HA SER 24 8.641 0.621 -8.568
153 HB2 SER 24 1HB SER 24 10.778 1.681 -8.094
154 HB3 SER 24 2HB SER 24 10.367 1.812 -6.384
155 HG SER 24 HG SER 24 10.411 -0.688 -7.690
156 H TYR 25 H TYR 25 8.053 1.975 -5.344
157 HA TYR 25 HA TYR 25 7.676 -0.347 -3.903
158 HB2 TYR 25 1HB TYR 25 6.536 2.412 -3.682
159 HB3 TYR 25 2HB TYR 25 5.918 1.141 -2.633
160 HD1 TYR 25 HD2 TYR 25 9.307 2.208 -3.818
161 HD2 TYR 25 HD1 TYR 25 6.818 1.198 -0.518
162 HE1 TYR 25 HE2 TYR 25 11.202 2.556 -2.289
163 HE2 TYR 25 HE1 TYR 25 8.706 1.545 1.020
164 HH TYR 25 HH TYR 25 10.794 2.466 1.194
165 H LEU 26 H LEU 26 5.304 1.432 -5.851
166 HA LEU 26 HA LEU 26 3.055 -0.106 -5.273
167 HB2 LEU 26 1HB LEU 26 2.709 1.905 -6.424
168 HB3 LEU 26 2HB LEU 26 3.874 1.486 -7.679
169 HG LEU 26 HG LEU 26 2.260 -0.290 -8.437
170 HD11 LEU 26 1HD1 LEU 26 0.259 1.204 -6.763
171 HD12 LEU 26 2HD1 LEU 26 1.015 -0.301 -6.240
172 HD13 LEU 26 3HD1 LEU 26 0.019 -0.273 -7.695
173 HD21 LEU 26 3HD2 LEU 26 2.375 1.644 -9.758
174 HD22 LEU 26 1HD2 LEU 26 1.582 2.634 -8.533
175 HD23 LEU 26 2HD2 LEU 26 0.656 1.429 -9.428
176 H ILE 27 H ILE 27 5.182 -0.398 -8.125
177 HA ILE 27 HA ILE 27 4.109 -2.639 -9.275
178 HB ILE 27 HB ILE 27 7.045 -1.961 -9.070
179 HG12 ILE 27 1HG1 ILE 27 6.435 -1.209 -11.527
180 HG13 ILE 27 2HG1 ILE 27 4.814 -1.074 -10.854
181 HG21 ILE 27 1HG2 ILE 27 6.670 -3.256 -11.455
182 HG22 ILE 27 2HG2 ILE 27 7.337 -3.976 -9.990
183 HG23 ILE 27 3HG2 ILE 27 5.622 -4.156 -10.359
184 HD11 ILE 27 3HD1 ILE 27 6.810 0.838 -10.788
185 HD12 ILE 27 1HD1 ILE 27 5.306 0.847 -9.869
186 HD13 ILE 27 2HD1 ILE 27 6.774 0.184 -9.151
187 H ILE 28 H ILE 28 6.896 -2.708 -7.044
188 HA ILE 28 HA ILE 28 7.289 -5.342 -6.692
189 HB ILE 28 HB ILE 28 7.149 -3.340 -4.434
190 HG12 ILE 28 1HG1 ILE 28 9.692 -4.237 -5.716
191 HG13 ILE 28 2HG1 ILE 28 8.703 -3.054 -6.565
192 HG21 ILE 28 1HG2 ILE 28 7.407 -6.078 -4.248
193 HG22 ILE 28 2HG2 ILE 28 9.073 -5.505 -4.197
194 HG23 ILE 28 3HG2 ILE 28 7.898 -4.902 -3.029
195 HD11 ILE 28 3HD1 ILE 28 10.610 -2.479 -4.716
196 HD12 ILE 28 1HD1 ILE 28 9.286 -1.409 -5.177
197 HD13 ILE 28 2HD1 ILE 28 9.138 -2.431 -3.747
198 H HIS 29 H HIS 29 4.599 -3.499 -5.366
199 HA HIS 29 HA HIS 29 3.568 -5.693 -3.826
200 HB2 HIS 29 1HB HIS 29 2.961 -3.634 -2.927
201 HB3 HIS 29 2HB HIS 29 2.604 -2.937 -4.504
202 HD1 HIS 29 HD1 HIS 29 1.113 -5.073 -1.816
203 HD2 HIS 29 HD2 HIS 29 0.012 -3.372 -5.443
204 HE1 HIS 29 HE1 HIS 29 -1.384 -5.335 -1.951
205 H MET 30 H MET 30 2.580 -4.058 -6.829
206 HA MET 30 HA MET 30 0.322 -5.398 -7.500
207 HB2 MET 30 1HB MET 30 2.590 -4.771 -9.398
208 HB3 MET 30 2HB MET 30 0.919 -5.069 -9.857
209 HG2 MET 30 1HG MET 30 1.964 -2.761 -8.238
210 HG3 MET 30 2HG MET 30 1.350 -2.712 -9.889
211 HE1 MET 30 3HE MET 30 -1.604 -4.077 -9.981
212 HE2 MET 30 1HE MET 30 -2.290 -2.476 -9.697
213 HE3 MET 30 2HE MET 30 -0.803 -2.646 -10.631
214 H ARG 31 H ARG 31 3.516 -6.709 -7.316
215 HA ARG 31 HA ARG 31 3.473 -8.889 -8.963
216 HB2 ARG 31 1HB ARG 31 4.522 -8.730 -6.133
217 HB3 ARG 31 2HB ARG 31 4.894 -10.031 -7.256
218 HG2 ARG 31 1HG ARG 31 5.878 -8.340 -8.792
219 HG3 ARG 31 2HG ARG 31 5.629 -7.127 -7.535
220 HD2 ARG 31 1HD ARG 31 6.967 -8.697 -6.018
221 HD3 ARG 31 2HD ARG 31 7.444 -9.518 -7.503
222 HE ARG 31 HE ARG 31 8.338 -6.937 -6.575
223 HH11 ARG 31 1HH1 ARG 31 7.984 -9.063 -9.309
224 HH12 ARG 31 2HH1 ARG 31 9.232 -8.296 -10.233
225 HH21 ARG 31 1HH2 ARG 31 9.983 -5.918 -7.782
226 HH22 ARG 31 2HH2 ARG 31 10.369 -6.507 -9.363
227 H THR 32 H THR 32 1.830 -8.503 -5.874
228 HA THR 32 HA THR 32 0.980 -11.192 -5.606
229 HB THR 32 HB THR 32 1.023 -9.471 -3.759
230 HG1 THR 32 HG1 THR 32 -1.060 -11.251 -4.315
231 HG21 THR 32 3HG2 THR 32 -1.437 -8.540 -5.227
232 HG22 THR 32 1HG2 THR 32 -0.029 -7.591 -4.752
233 HG23 THR 32 2HG2 THR 32 -1.149 -8.182 -3.524
234 H HIS 33 H HIS 33 -0.321 -8.409 -7.279
235 HA HIS 33 HA HIS 33 -2.852 -9.700 -7.829
236 HB2 HIS 33 1HB HIS 33 -1.660 -7.080 -8.747
237 HB3 HIS 33 2HB HIS 33 -3.254 -7.648 -9.234
238 HD1 HIS 33 HD1 HIS 33 -4.774 -8.322 -6.930
239 HD2 HIS 33 HD2 HIS 33 -1.827 -5.408 -6.644
240 HE1 HIS 33 HE1 HIS 33 -5.358 -6.973 -4.890
241 H THR 34 H THR 34 -0.201 -10.782 -8.793
242 HA THR 34 HA THR 34 -1.024 -11.151 -11.587
243 HB THR 34 HB THR 34 1.342 -11.112 -12.312
244 HG1 THR 34 HG1 THR 34 1.910 -9.968 -9.770
245 HG21 THR 34 3HG2 THR 34 0.324 -9.102 -12.814
246 HG22 THR 34 1HG2 THR 34 1.667 -8.563 -11.807
247 HG23 THR 34 2HG2 THR 34 0.047 -8.697 -11.120
248 H GLY 35 H GLY 35 -0.970 -13.217 -12.270
249 HA2 GLY 35 1HA GLY 35 0.098 -15.386 -12.340
250 HA3 GLY 35 2HA GLY 35 0.537 -15.169 -10.652
251 H GLU 36 H GLU 36 -0.603 -16.346 -9.279
252 HA GLU 36 HA GLU 36 -2.903 -17.799 -10.063
253 HB2 GLU 36 1HB GLU 36 -1.589 -17.313 -7.397
254 HB3 GLU 36 2HB GLU 36 -3.052 -18.276 -7.551
255 HG2 GLU 36 1HG GLU 36 -0.386 -18.837 -8.827
256 HG3 GLU 36 2HG GLU 36 -1.126 -19.714 -7.489
257 H LYS 37 H LYS 37 -5.056 -17.595 -9.406
258 HA LYS 37 HA LYS 37 -5.893 -14.849 -8.951
259 HB2 LYS 37 1HB LYS 37 -7.027 -16.105 -10.695
260 HB3 LYS 37 2HB LYS 37 -7.471 -17.358 -9.544
261 HG2 LYS 37 1HG LYS 37 -9.423 -16.209 -9.595
262 HG3 LYS 37 2HG LYS 37 -8.609 -15.307 -8.314
263 HD2 LYS 37 1HD LYS 37 -7.760 -13.780 -10.186
264 HD3 LYS 37 2HD LYS 37 -8.984 -14.550 -11.198
265 HE2 LYS 37 1HE LYS 37 -9.659 -13.327 -8.539
266 HE3 LYS 37 2HE LYS 37 -9.614 -12.369 -10.017
267 HZ1 LYS 37 3HZ LYS 37 -11.845 -13.261 -9.404
268 HZ2 LYS 37 1HZ LYS 37 -11.258 -14.818 -9.715
269 HZ3 LYS 37 2HZ LYS 37 -11.330 -13.676 -10.961
270 HA PRO 38 HA PRO 38 -6.573 -15.369 -4.625
271 HB2 PRO 38 1HB PRO 38 -8.272 -13.287 -4.240
272 HB3 PRO 38 2HB PRO 38 -6.537 -13.075 -4.504
273 HG2 PRO 38 1HG PRO 38 -8.795 -12.805 -6.450
274 HG3 PRO 38 2HG PRO 38 -7.372 -11.769 -6.237
275 HD2 PRO 38 1HD PRO 38 -7.542 -13.622 -8.204
276 HD3 PRO 38 2HD PRO 38 -6.003 -13.187 -7.432
277 H SER 39 H SER 39 -8.310 -15.747 -3.075
278 HA SER 39 HA SER 39 -10.759 -16.778 -4.350
279 HB2 SER 39 1HB SER 39 -9.214 -17.928 -2.016
280 HB3 SER 39 2HB SER 39 -10.804 -18.494 -2.526
281 HG SER 39 HG SER 39 -9.871 -18.999 -4.562
282 H GLY 40 H GLY 40 -12.372 -15.439 -3.857
283 HA2 GLY 40 1HA GLY 40 -13.865 -15.065 -1.823
284 HA3 GLY 40 2HA GLY 40 -12.447 -14.277 -1.147
285 HA PRO 41 HA PRO 41 -13.423 -10.449 -3.043
286 HB2 PRO 41 1HB PRO 41 -11.147 -9.655 -4.292
287 HB3 PRO 41 2HB PRO 41 -11.319 -9.679 -2.533
288 HG2 PRO 41 1HG PRO 41 -10.008 -11.677 -4.337
289 HG3 PRO 41 2HG PRO 41 -9.451 -11.043 -2.777
290 HD2 PRO 41 1HD PRO 41 -10.644 -13.461 -3.024
291 HD3 PRO 41 2HD PRO 41 -10.818 -12.454 -1.572
292 H SER 42 H SER 42 -14.883 -10.440 -4.645
293 HA SER 42 HA SER 42 -14.016 -10.430 -7.373
294 HB2 SER 42 1HB SER 42 -14.201 -12.891 -6.855
295 HB3 SER 42 2HB SER 42 -15.925 -12.639 -6.582
296 HG SER 42 HG SER 42 -15.763 -13.218 -8.684
297 H SER 43 H SER 43 -15.450 -9.387 -8.693
298 HA SER 43 HA SER 43 -17.355 -7.702 -7.567
299 HB2 SER 43 1HB SER 43 -17.072 -8.646 -10.428
300 HB3 SER 43 2HB SER 43 -18.118 -7.320 -9.920
301 HG SER 43 HG SER 43 -15.295 -7.475 -9.797
302 H GLY 44 H GLY 44 -19.293 -8.106 -6.748
303 HA2 GLY 44 1HA GLY 44 -21.418 -9.335 -7.935
304 HA3 GLY 44 2HA GLY 44 -20.571 -10.653 -7.139
Start of MODEL 16
1 H1 GLY 1 H GLY 1 -19.411 -0.315 -6.833
2 HA2 GLY 1 1HA GLY 1 -18.098 1.378 -8.795
3 HA3 GLY 1 2HA GLY 1 -18.833 1.902 -7.287
4 H SER 2 H SER 2 -17.162 3.115 -6.512
5 HA SER 2 HA SER 2 -14.865 1.618 -5.524
6 HB2 SER 2 1HB SER 2 -14.299 2.654 -7.794
7 HB3 SER 2 2HB SER 2 -14.418 4.219 -6.989
8 HG SER 2 HG SER 2 -12.294 3.568 -6.896
9 H SER 3 H SER 3 -13.687 2.745 -3.850
10 HA SER 3 HA SER 3 -15.358 4.030 -2.002
11 HB2 SER 3 1HB SER 3 -12.342 3.862 -2.152
12 HB3 SER 3 2HB SER 3 -13.217 4.523 -0.771
13 HG SER 3 HG SER 3 -13.374 2.540 -0.122
14 H GLY 4 H GLY 4 -15.943 6.088 -1.731
15 HA2 GLY 4 1HA GLY 4 -15.030 8.072 -3.622
16 HA3 GLY 4 2HA GLY 4 -16.269 8.289 -2.395
17 H SER 5 H SER 5 -12.755 7.698 -2.557
18 HA SER 5 HA SER 5 -12.430 9.762 -0.478
19 HB2 SER 5 1HB SER 5 -10.533 8.527 0.403
20 HB3 SER 5 2HB SER 5 -11.939 7.465 0.348
21 HG SER 5 HG SER 5 -9.837 6.649 -0.504
22 H SER 6 H SER 6 -11.214 11.448 -1.019
23 HA SER 6 HA SER 6 -9.886 11.473 -3.592
24 HB2 SER 6 1HB SER 6 -10.118 13.670 -1.522
25 HB3 SER 6 2HB SER 6 -9.582 13.863 -3.191
26 HG SER 6 HG SER 6 -11.713 13.018 -3.772
27 H GLY 7 H GLY 7 -8.149 10.038 -3.230
28 HA2 GLY 7 1HA GLY 7 -6.278 10.429 -1.105
29 HA3 GLY 7 2HA GLY 7 -6.060 9.388 -2.504
30 H VAL 8 H VAL 8 -4.409 11.541 -1.032
31 HA VAL 8 HA VAL 8 -3.801 13.260 -3.333
32 HB VAL 8 HB VAL 8 -4.221 14.343 -1.123
33 HG11 VAL 8 1HG1 VAL 8 -2.288 12.389 -0.280
34 HG12 VAL 8 2HG1 VAL 8 -1.742 14.015 0.133
35 HG13 VAL 8 3HG1 VAL 8 -3.313 13.443 0.694
36 HG21 VAL 8 3HG2 VAL 8 -2.663 15.190 -3.024
37 HG22 VAL 8 1HG2 VAL 8 -2.639 15.997 -1.456
38 HG23 VAL 8 2HG2 VAL 8 -1.370 14.846 -1.875
39 H LYS 9 H LYS 9 -2.975 10.790 -3.850
40 HA LYS 9 HA LYS 9 -0.063 10.933 -3.451
41 HB2 LYS 9 1HB LYS 9 -0.338 8.296 -3.722
42 HB3 LYS 9 2HB LYS 9 -0.419 9.089 -2.154
43 HG2 LYS 9 1HG LYS 9 -2.898 8.629 -3.765
44 HG3 LYS 9 2HG LYS 9 -2.210 7.347 -2.765
45 HD2 LYS 9 1HD LYS 9 -2.609 10.034 -1.547
46 HD3 LYS 9 2HD LYS 9 -4.027 9.018 -1.818
47 HE2 LYS 9 1HE LYS 9 -1.557 8.108 -0.351
48 HE3 LYS 9 2HE LYS 9 -2.979 8.781 0.444
49 HZ1 LYS 9 3HZ LYS 9 -3.672 6.685 -1.360
50 HZ2 LYS 9 1HZ LYS 9 -4.027 6.846 0.287
51 HZ3 LYS 9 2HZ LYS 9 -2.563 6.152 -0.199
52 HA PRO 10 HA PRO 10 0.168 10.766 -7.844
53 HB2 PRO 10 1HB PRO 10 2.714 9.860 -8.108
54 HB3 PRO 10 2HB PRO 10 2.329 11.512 -7.609
55 HG2 PRO 10 1HG PRO 10 3.097 9.156 -5.929
56 HG3 PRO 10 2HG PRO 10 3.640 10.840 -5.810
57 HD2 PRO 10 1HD PRO 10 1.740 9.803 -4.184
58 HD3 PRO 10 2HD PRO 10 1.739 11.505 -4.689
59 H TYR 11 H TYR 11 0.764 7.963 -5.868
60 HA TYR 11 HA TYR 11 0.139 6.244 -8.179
61 HB2 TYR 11 1HB TYR 11 1.861 5.437 -5.832
62 HB3 TYR 11 2HB TYR 11 1.587 4.534 -7.318
63 HD1 TYR 11 HD1 TYR 11 2.493 5.477 -9.487
64 HD2 TYR 11 HD2 TYR 11 3.611 7.003 -5.676
65 HE1 TYR 11 HE1 TYR 11 4.478 6.524 -10.494
66 HE2 TYR 11 HE2 TYR 11 5.598 8.055 -6.673
67 HH TYR 11 HH TYR 11 6.668 7.333 -9.833
68 H GLY 12 H GLY 12 -1.122 4.375 -7.758
69 HA2 GLY 12 1HA GLY 12 -2.176 3.824 -5.157
70 HA3 GLY 12 2HA GLY 12 -3.328 4.706 -6.149
71 H CYS 13 H CYS 13 -2.870 1.785 -5.078
72 HA CYS 13 HA CYS 13 -2.931 0.228 -7.497
73 HB2 CYS 13 1HB CYS 13 -1.950 -0.789 -5.557
74 HB3 CYS 13 2HB CYS 13 -3.392 -0.479 -4.596
75 H SER 14 H SER 14 -4.655 -0.393 -8.639
76 HA SER 14 HA SER 14 -7.311 0.327 -7.603
77 HB2 SER 14 1HB SER 14 -6.492 1.364 -9.768
78 HB3 SER 14 2HB SER 14 -6.591 -0.246 -10.482
79 HG SER 14 HG SER 14 -8.492 1.207 -10.684
80 H GLU 15 H GLU 15 -6.159 -2.036 -6.679
81 HA GLU 15 HA GLU 15 -7.926 -4.028 -7.927
82 HB2 GLU 15 1HB GLU 15 -5.019 -4.237 -7.300
83 HB3 GLU 15 2HB GLU 15 -6.019 -5.665 -7.075
84 HG2 GLU 15 1HG GLU 15 -6.829 -5.191 -9.479
85 HG3 GLU 15 2HG GLU 15 -5.389 -4.182 -9.591
86 H CYS 16 H CYS 16 -6.050 -3.161 -5.043
87 HA CYS 16 HA CYS 16 -8.060 -4.569 -3.411
88 HB2 CYS 16 1HB CYS 16 -6.290 -4.752 -1.676
89 HB3 CYS 16 2HB CYS 16 -5.886 -5.605 -3.162
90 H GLY 17 H GLY 17 -5.862 -1.768 -3.442
91 HA2 GLY 17 1HA GLY 17 -7.039 0.404 -3.022
92 HA3 GLY 17 2HA GLY 17 -7.760 -0.401 -1.636
93 H LYS 18 H LYS 18 -4.576 0.384 -3.017
94 HA LYS 18 HA LYS 18 -3.708 1.299 -0.390
95 HB2 LYS 18 1HB LYS 18 -2.358 -0.905 -1.944
96 HB3 LYS 18 2HB LYS 18 -1.530 0.022 -0.701
97 HG2 LYS 18 1HG LYS 18 -3.588 -0.693 0.759
98 HG3 LYS 18 2HG LYS 18 -3.709 -1.985 -0.438
99 HD2 LYS 18 1HD LYS 18 -1.160 -2.273 0.022
100 HD3 LYS 18 2HD LYS 18 -1.519 -1.405 1.516
101 HE2 LYS 18 1HE LYS 18 -3.445 -3.155 1.729
102 HE3 LYS 18 2HE LYS 18 -2.464 -4.089 0.601
103 HZ1 LYS 18 3HZ LYS 18 -0.667 -4.110 2.123
104 HZ2 LYS 18 1HZ LYS 18 -2.045 -4.552 3.000
105 HZ3 LYS 18 2HZ LYS 18 -1.414 -2.989 3.147
106 H ALA 19 H ALA 19 -1.487 2.330 -0.546
107 HA ALA 19 HA ALA 19 -1.013 3.483 -3.208
108 HB1 ALA 19 3HB ALA 19 -0.925 5.155 -0.712
109 HB2 ALA 19 1HB ALA 19 -0.905 5.690 -2.393
110 HB3 ALA 19 2HB ALA 19 -2.376 5.003 -1.703
111 H PHE 20 H PHE 20 1.117 4.759 -3.195
112 HA PHE 20 HA PHE 20 3.099 3.748 -1.328
113 HB2 PHE 20 1HB PHE 20 3.580 3.345 -4.274
114 HB3 PHE 20 2HB PHE 20 4.483 2.678 -2.917
115 HD1 PHE 20 HD1 PHE 20 1.031 2.641 -4.330
116 HD2 PHE 20 HD2 PHE 20 4.122 0.483 -2.355
117 HE1 PHE 20 HE1 PHE 20 -0.334 0.597 -4.435
118 HE2 PHE 20 HE2 PHE 20 2.763 -1.565 -2.458
119 HZ PHE 20 HZ PHE 20 0.532 -1.510 -3.500
120 H ARG 21 H ARG 21 4.576 5.260 -0.893
121 HA ARG 21 HA ARG 21 4.403 7.843 -2.001
122 HB2 ARG 21 1HB ARG 21 5.217 7.561 0.243
123 HB3 ARG 21 2HB ARG 21 6.535 6.536 -0.309
124 HG2 ARG 21 1HG ARG 21 7.649 8.499 -0.004
125 HG3 ARG 21 2HG ARG 21 7.180 8.674 -1.696
126 HD2 ARG 21 1HD ARG 21 5.122 9.885 -0.864
127 HD3 ARG 21 2HD ARG 21 5.885 9.906 0.725
128 HE ARG 21 HE ARG 21 7.672 10.949 -1.179
129 HH11 ARG 21 1HH1 ARG 21 4.696 11.744 0.443
130 HH12 ARG 21 2HH1 ARG 21 4.949 13.455 0.347
131 HH21 ARG 21 1HH2 ARG 21 8.016 13.200 -1.312
132 HH22 ARG 21 2HH2 ARG 21 6.837 14.283 -0.652
133 H SER 22 H SER 22 6.321 5.056 -2.820
134 HA SER 22 HA SER 22 7.761 6.648 -4.837
135 HB2 SER 22 1HB SER 22 8.520 4.192 -3.287
136 HB3 SER 22 2HB SER 22 9.270 4.513 -4.850
137 HG SER 22 HG SER 22 10.095 5.450 -2.633
138 H LYS 23 H LYS 23 8.442 5.176 -6.765
139 HA LYS 23 HA LYS 23 5.978 4.146 -7.893
140 HB2 LYS 23 1HB LYS 23 7.594 5.656 -9.130
141 HB3 LYS 23 2HB LYS 23 8.689 4.282 -9.214
142 HG2 LYS 23 1HG LYS 23 6.665 3.060 -10.281
143 HG3 LYS 23 2HG LYS 23 6.063 4.693 -10.574
144 HD2 LYS 23 1HD LYS 23 7.999 5.249 -11.864
145 HD3 LYS 23 2HD LYS 23 8.798 3.742 -11.412
146 HE2 LYS 23 1HE LYS 23 7.986 3.425 -13.609
147 HE3 LYS 23 2HE LYS 23 6.892 2.537 -12.550
148 HZ1 LYS 23 3HZ LYS 23 6.230 4.489 -14.399
149 HZ2 LYS 23 1HZ LYS 23 5.976 5.188 -12.879
150 HZ3 LYS 23 2HZ LYS 23 5.202 3.739 -13.285
151 H SER 24 H SER 24 9.325 2.908 -7.906
152 HA SER 24 HA SER 24 8.921 0.343 -8.650
153 HB2 SER 24 1HB SER 24 11.139 1.288 -8.113
154 HB3 SER 24 2HB SER 24 10.752 1.200 -6.394
155 HG SER 24 HG SER 24 10.486 -1.133 -7.897
156 H TYR 25 H TYR 25 8.391 1.647 -5.407
157 HA TYR 25 HA TYR 25 7.893 -0.668 -3.997
158 HB2 TYR 25 1HB TYR 25 7.844 1.890 -3.311
159 HB3 TYR 25 2HB TYR 25 6.109 1.679 -3.521
160 HD1 TYR 25 HD1 TYR 25 5.954 -1.203 -2.567
161 HD2 TYR 25 HD2 TYR 25 7.913 2.219 -0.967
162 HE1 TYR 25 HE1 TYR 25 5.798 -2.175 -0.313
163 HE2 TYR 25 HE2 TYR 25 7.763 1.255 1.291
164 HH TYR 25 HH TYR 25 7.115 -1.917 1.898
165 H LEU 26 H LEU 26 5.462 1.335 -5.672
166 HA LEU 26 HA LEU 26 3.211 -0.146 -5.238
167 HB2 LEU 26 1HB LEU 26 2.988 1.887 -6.394
168 HB3 LEU 26 2HB LEU 26 4.113 1.388 -7.655
169 HG LEU 26 HG LEU 26 2.402 -0.273 -8.411
170 HD11 LEU 26 1HD1 LEU 26 0.438 1.268 -6.753
171 HD12 LEU 26 2HD1 LEU 26 1.215 -0.191 -6.139
172 HD13 LEU 26 3HD1 LEU 26 0.220 -0.268 -7.593
173 HD21 LEU 26 3HD2 LEU 26 1.803 1.264 -9.900
174 HD22 LEU 26 1HD2 LEU 26 2.590 2.470 -8.881
175 HD23 LEU 26 2HD2 LEU 26 0.865 2.149 -8.695
176 H ILE 27 H ILE 27 5.399 -0.567 -8.026
177 HA ILE 27 HA ILE 27 4.221 -2.729 -9.227
178 HB ILE 27 HB ILE 27 7.187 -2.253 -8.908
179 HG12 ILE 27 1HG1 ILE 27 5.432 -1.554 -11.260
180 HG13 ILE 27 2HG1 ILE 27 5.744 -0.422 -9.948
181 HG21 ILE 27 1HG2 ILE 27 7.612 -3.976 -10.272
182 HG22 ILE 27 2HG2 ILE 27 5.999 -4.533 -9.830
183 HG23 ILE 27 3HG2 ILE 27 6.237 -3.611 -11.314
184 HD11 ILE 27 3HD1 ILE 27 8.074 -1.686 -11.273
185 HD12 ILE 27 1HD1 ILE 27 7.187 -0.443 -12.153
186 HD13 ILE 27 2HD1 ILE 27 7.897 -0.074 -10.581
187 H ILE 28 H ILE 28 6.865 -2.952 -6.837
188 HA ILE 28 HA ILE 28 7.095 -5.615 -6.493
189 HB ILE 28 HB ILE 28 6.972 -3.601 -4.245
190 HG12 ILE 28 1HG1 ILE 28 9.417 -4.697 -5.633
191 HG13 ILE 28 2HG1 ILE 28 8.620 -3.217 -6.154
192 HG21 ILE 28 1HG2 ILE 28 8.705 -5.932 -3.940
193 HG22 ILE 28 2HG2 ILE 28 7.595 -5.185 -2.793
194 HG23 ILE 28 3HG2 ILE 28 6.986 -6.323 -3.995
195 HD11 ILE 28 3HD1 ILE 28 8.940 -2.420 -3.749
196 HD12 ILE 28 1HD1 ILE 28 10.073 -3.763 -3.597
197 HD13 ILE 28 2HD1 ILE 28 10.360 -2.497 -4.792
198 H HIS 29 H HIS 29 4.495 -3.605 -5.201
199 HA HIS 29 HA HIS 29 3.253 -5.719 -3.735
200 HB2 HIS 29 1HB HIS 29 2.670 -3.644 -2.890
201 HB3 HIS 29 2HB HIS 29 2.507 -2.922 -4.488
202 HD1 HIS 29 HD1 HIS 29 0.666 -5.283 -2.168
203 HD2 HIS 29 HD2 HIS 29 -0.048 -2.836 -5.450
204 HE1 HIS 29 HE1 HIS 29 -1.830 -5.282 -2.476
205 H MET 30 H MET 30 2.459 -4.076 -6.795
206 HA MET 30 HA MET 30 0.190 -5.375 -7.540
207 HB2 MET 30 1HB MET 30 2.540 -4.680 -9.309
208 HB3 MET 30 2HB MET 30 0.934 -5.086 -9.897
209 HG2 MET 30 1HG MET 30 1.718 -2.705 -8.238
210 HG3 MET 30 2HG MET 30 1.183 -2.714 -9.917
211 HE1 MET 30 3HE MET 30 -1.599 -2.239 -10.449
212 HE2 MET 30 1HE MET 30 -0.965 -3.879 -10.596
213 HE3 MET 30 2HE MET 30 -2.497 -3.597 -9.768
214 H ARG 31 H ARG 31 3.465 -6.643 -7.604
215 HA ARG 31 HA ARG 31 3.429 -8.811 -9.163
216 HB2 ARG 31 1HB ARG 31 4.326 -8.832 -6.275
217 HB3 ARG 31 2HB ARG 31 4.811 -9.996 -7.500
218 HG2 ARG 31 1HG ARG 31 5.794 -8.094 -8.795
219 HG3 ARG 31 2HG ARG 31 5.472 -7.066 -7.397
220 HD2 ARG 31 1HD ARG 31 7.661 -7.698 -7.030
221 HD3 ARG 31 2HD ARG 31 6.773 -8.894 -6.086
222 HE ARG 31 HE ARG 31 7.188 -9.882 -8.686
223 HH11 ARG 31 1HH1 ARG 31 8.945 -9.148 -5.771
224 HH12 ARG 31 2HH1 ARG 31 10.170 -10.340 -6.054
225 HH21 ARG 31 1HH2 ARG 31 8.794 -11.456 -9.069
226 HH22 ARG 31 2HH2 ARG 31 10.084 -11.652 -7.930
227 H THR 32 H THR 32 2.225 -8.999 -5.807
228 HA THR 32 HA THR 32 1.202 -11.495 -5.727
229 HB THR 32 HB THR 32 -0.583 -10.669 -4.212
230 HG1 THR 32 HG1 THR 32 0.436 -8.060 -4.658
231 HG21 THR 32 3HG2 THR 32 1.769 -11.011 -3.446
232 HG22 THR 32 1HG2 THR 32 0.879 -9.814 -2.506
233 HG23 THR 32 2HG2 THR 32 2.056 -9.292 -3.711
234 H HIS 33 H HIS 33 -0.698 -8.683 -6.839
235 HA HIS 33 HA HIS 33 -2.954 -10.058 -7.676
236 HB2 HIS 33 1HB HIS 33 -1.730 -7.535 -8.809
237 HB3 HIS 33 2HB HIS 33 -3.350 -8.110 -9.192
238 HD1 HIS 33 HD1 HIS 33 -4.501 -8.783 -6.516
239 HD2 HIS 33 HD2 HIS 33 -2.094 -5.454 -7.129
240 HE1 HIS 33 HE1 HIS 33 -5.067 -7.193 -4.652
241 H THR 34 H THR 34 -0.258 -8.966 -9.745
242 HA THR 34 HA THR 34 -1.153 -10.609 -11.935
243 HB THR 34 HB THR 34 -0.055 -8.428 -12.331
244 HG1 THR 34 HG1 THR 34 1.353 -9.241 -13.987
245 HG21 THR 34 3HG2 THR 34 2.648 -9.496 -11.896
246 HG22 THR 34 1HG2 THR 34 1.732 -9.184 -10.423
247 HG23 THR 34 2HG2 THR 34 2.002 -7.885 -11.585
248 H GLY 35 H GLY 35 -0.984 -12.759 -11.552
249 HA2 GLY 35 1HA GLY 35 0.879 -14.437 -12.037
250 HA3 GLY 35 2HA GLY 35 1.610 -13.774 -10.583
251 H GLU 36 H GLU 36 -1.738 -14.704 -11.365
252 HA GLU 36 HA GLU 36 -2.142 -15.875 -8.804
253 HB2 GLU 36 1HB GLU 36 -4.302 -16.629 -9.734
254 HB3 GLU 36 2HB GLU 36 -4.006 -14.921 -10.027
255 HG2 GLU 36 1HG GLU 36 -3.099 -15.707 -12.311
256 HG3 GLU 36 2HG GLU 36 -3.972 -17.198 -11.960
257 H LYS 37 H LYS 37 -2.734 -18.121 -8.411
258 HA LYS 37 HA LYS 37 -0.781 -19.915 -9.397
259 HB2 LYS 37 1HB LYS 37 -1.902 -20.014 -7.140
260 HB3 LYS 37 2HB LYS 37 -3.331 -20.642 -7.950
261 HG2 LYS 37 1HG LYS 37 -2.232 -22.531 -7.139
262 HG3 LYS 37 2HG LYS 37 -1.808 -22.477 -8.851
263 HD2 LYS 37 1HD LYS 37 0.288 -21.221 -8.121
264 HD3 LYS 37 2HD LYS 37 -0.116 -21.731 -6.480
265 HE2 LYS 37 1HE LYS 37 -0.190 -24.095 -7.377
266 HE3 LYS 37 2HE LYS 37 0.528 -23.462 -8.857
267 HZ1 LYS 37 3HZ LYS 37 2.278 -24.267 -7.507
268 HZ2 LYS 37 1HZ LYS 37 1.707 -23.455 -6.137
269 HZ3 LYS 37 2HZ LYS 37 2.357 -22.579 -7.430
270 HA PRO 38 HA PRO 38 -2.733 -21.312 -13.102
271 HB2 PRO 38 1HB PRO 38 -1.275 -23.573 -13.464
272 HB3 PRO 38 2HB PRO 38 -0.633 -21.956 -13.776
273 HG2 PRO 38 1HG PRO 38 -0.261 -23.713 -11.381
274 HG3 PRO 38 2HG PRO 38 0.935 -22.726 -12.241
275 HD2 PRO 38 1HD PRO 38 -0.219 -21.927 -9.925
276 HD3 PRO 38 2HD PRO 38 0.273 -20.784 -11.191
277 H SER 39 H SER 39 -2.133 -23.718 -10.546
278 HA SER 39 HA SER 39 -4.841 -24.758 -10.979
279 HB2 SER 39 1HB SER 39 -4.087 -27.057 -10.909
280 HB3 SER 39 2HB SER 39 -3.207 -26.217 -12.186
281 HG SER 39 HG SER 39 -1.591 -25.873 -10.374
282 H GLY 40 H GLY 40 -5.915 -24.679 -9.128
283 HA2 GLY 40 1HA GLY 40 -4.636 -25.541 -6.660
284 HA3 GLY 40 2HA GLY 40 -5.159 -23.864 -6.701
285 HA PRO 41 HA PRO 41 -9.149 -26.600 -7.031
286 HB2 PRO 41 1HB PRO 41 -8.831 -29.232 -6.444
287 HB3 PRO 41 2HB PRO 41 -8.694 -28.590 -8.085
288 HG2 PRO 41 1HG PRO 41 -6.531 -29.280 -6.134
289 HG3 PRO 41 2HG PRO 41 -6.616 -29.612 -7.874
290 HD2 PRO 41 1HD PRO 41 -5.170 -27.564 -6.850
291 HD3 PRO 41 2HD PRO 41 -5.953 -27.478 -8.441
292 H SER 42 H SER 42 -10.288 -26.096 -5.278
293 HA SER 42 HA SER 42 -9.707 -27.383 -2.738
294 HB2 SER 42 1HB SER 42 -9.389 -24.448 -3.232
295 HB3 SER 42 2HB SER 42 -9.987 -24.992 -1.665
296 HG SER 42 HG SER 42 -7.729 -24.831 -1.639
297 H SER 43 H SER 43 -11.542 -27.977 -1.792
298 HA SER 43 HA SER 43 -13.994 -26.459 -2.377
299 HB2 SER 43 1HB SER 43 -15.253 -28.431 -2.757
300 HB3 SER 43 2HB SER 43 -13.773 -28.644 -3.692
301 HG SER 43 HG SER 43 -13.856 -30.497 -2.622
302 H GLY 44 H GLY 44 -15.666 -26.639 -0.770
303 HA2 GLY 44 1HA GLY 44 -14.605 -27.412 1.879
304 HA3 GLY 44 2HA GLY 44 -15.623 -26.002 1.624
Start of MODEL 17
1 H1 GLY 1 H GLY 1 -9.191 19.410 7.704
2 HA2 GLY 1 1HA GLY 1 -10.746 17.007 7.096
3 HA3 GLY 1 2HA GLY 1 -11.581 18.551 7.013
4 H SER 2 H SER 2 -11.077 20.011 5.363
5 HA SER 2 HA SER 2 -10.212 18.788 2.930
6 HB2 SER 2 1HB SER 2 -10.752 21.719 3.456
7 HB3 SER 2 2HB SER 2 -10.729 20.914 1.888
8 HG SER 2 HG SER 2 -12.827 20.907 2.364
9 H SER 3 H SER 3 -8.150 18.434 2.470
10 HA SER 3 HA SER 3 -6.110 20.271 3.501
11 HB2 SER 3 1HB SER 3 -4.502 18.482 2.940
12 HB3 SER 3 2HB SER 3 -5.773 17.901 4.015
13 HG SER 3 HG SER 3 -6.117 17.647 1.247
14 H GLY 4 H GLY 4 -7.634 21.270 1.414
15 HA2 GLY 4 1HA GLY 4 -7.502 22.147 -0.710
16 HA3 GLY 4 2HA GLY 4 -5.788 22.278 -0.345
17 H SER 5 H SER 5 -4.795 21.662 -2.166
18 HA SER 5 HA SER 5 -5.659 19.146 -3.428
19 HB2 SER 5 1HB SER 5 -5.534 21.468 -4.692
20 HB3 SER 5 2HB SER 5 -3.824 21.057 -4.814
21 HG SER 5 HG SER 5 -5.131 20.300 -6.590
22 H SER 6 H SER 6 -4.469 17.878 -1.914
23 HA SER 6 HA SER 6 -1.596 18.193 -1.776
24 HB2 SER 6 1HB SER 6 -2.846 17.494 0.222
25 HB3 SER 6 2HB SER 6 -3.393 16.046 -0.622
26 HG SER 6 HG SER 6 -0.650 16.506 -0.536
27 H GLY 7 H GLY 7 -0.086 16.549 -2.385
28 HA2 GLY 7 1HA GLY 7 -1.011 14.440 -4.164
29 HA3 GLY 7 2HA GLY 7 -0.038 15.697 -4.915
30 H VAL 8 H VAL 8 0.057 13.644 -1.998
31 HA VAL 8 HA VAL 8 2.964 13.446 -2.298
32 HB VAL 8 HB VAL 8 2.933 12.439 -0.040
33 HG11 VAL 8 1HG1 VAL 8 2.400 15.119 -0.756
34 HG12 VAL 8 2HG1 VAL 8 1.463 14.768 0.698
35 HG13 VAL 8 3HG1 VAL 8 3.209 14.516 0.689
36 HG21 VAL 8 3HG2 VAL 8 0.319 11.862 -0.554
37 HG22 VAL 8 1HG2 VAL 8 1.067 11.819 1.042
38 HG23 VAL 8 2HG2 VAL 8 0.174 13.249 0.525
39 H LYS 9 H LYS 9 0.069 11.624 -2.686
40 HA LYS 9 HA LYS 9 1.632 9.149 -3.015
41 HB2 LYS 9 1HB LYS 9 -1.325 9.499 -2.487
42 HB3 LYS 9 2HB LYS 9 -0.519 7.955 -2.731
43 HG2 LYS 9 1HG LYS 9 0.714 8.187 -0.714
44 HG3 LYS 9 2HG LYS 9 0.204 9.866 -0.524
45 HD2 LYS 9 1HD LYS 9 -1.889 9.290 0.203
46 HD3 LYS 9 2HD LYS 9 -1.901 7.771 -0.695
47 HE2 LYS 9 1HE LYS 9 -0.215 6.888 0.912
48 HE3 LYS 9 2HE LYS 9 -0.393 8.372 1.847
49 HZ1 LYS 9 3HZ LYS 9 -2.128 6.076 1.697
50 HZ2 LYS 9 1HZ LYS 9 -2.943 7.553 1.562
51 HZ3 LYS 9 2HZ LYS 9 -1.976 7.241 2.914
52 HA PRO 10 HA PRO 10 0.472 10.415 -7.295
53 HB2 PRO 10 1HB PRO 10 2.793 9.554 -8.408
54 HB3 PRO 10 2HB PRO 10 2.613 11.154 -7.681
55 HG2 PRO 10 1HG PRO 10 3.819 8.672 -6.521
56 HG3 PRO 10 2HG PRO 10 4.404 10.344 -6.438
57 HD2 PRO 10 1HD PRO 10 3.081 9.160 -4.394
58 HD3 PRO 10 2HD PRO 10 2.956 10.898 -4.733
59 H TYR 11 H TYR 11 1.417 7.480 -5.754
60 HA TYR 11 HA TYR 11 0.320 5.932 -8.010
61 HB2 TYR 11 1HB TYR 11 2.285 4.946 -5.934
62 HB3 TYR 11 2HB TYR 11 1.731 4.078 -7.361
63 HD1 TYR 11 HD1 TYR 11 2.395 4.928 -9.636
64 HD2 TYR 11 HD2 TYR 11 4.112 6.439 -6.048
65 HE1 TYR 11 HE1 TYR 11 4.275 5.846 -10.929
66 HE2 TYR 11 HE2 TYR 11 5.996 7.363 -7.332
67 HH TYR 11 HH TYR 11 6.130 7.069 -10.868
68 H GLY 12 H GLY 12 -0.872 3.991 -7.447
69 HA2 GLY 12 1HA GLY 12 -1.658 3.349 -4.821
70 HA3 GLY 12 2HA GLY 12 -2.849 4.441 -5.512
71 H CYS 13 H CYS 13 -2.536 1.382 -4.833
72 HA CYS 13 HA CYS 13 -3.184 0.152 -7.360
73 HB2 CYS 13 1HB CYS 13 -1.923 -1.078 -5.641
74 HB3 CYS 13 2HB CYS 13 -3.302 -0.968 -4.551
75 H SER 14 H SER 14 -5.126 0.224 -8.253
76 HA SER 14 HA SER 14 -7.433 1.068 -6.747
77 HB2 SER 14 1HB SER 14 -7.170 1.883 -9.017
78 HB3 SER 14 2HB SER 14 -7.118 0.234 -9.641
79 HG SER 14 HG SER 14 -9.333 1.287 -8.222
80 H GLU 15 H GLU 15 -6.248 -1.913 -8.194
81 HA GLU 15 HA GLU 15 -8.376 -3.571 -8.219
82 HB2 GLU 15 1HB GLU 15 -5.569 -4.081 -7.265
83 HB3 GLU 15 2HB GLU 15 -6.763 -5.370 -7.324
84 HG2 GLU 15 1HG GLU 15 -5.771 -3.724 -9.638
85 HG3 GLU 15 2HG GLU 15 -5.417 -5.420 -9.312
86 H CYS 16 H CYS 16 -6.365 -3.134 -5.302
87 HA CYS 16 HA CYS 16 -8.635 -4.055 -3.685
88 HB2 CYS 16 1HB CYS 16 -7.023 -4.490 -1.922
89 HB3 CYS 16 2HB CYS 16 -6.483 -5.254 -3.413
90 H GLY 17 H GLY 17 -6.220 -1.465 -3.897
91 HA2 GLY 17 1HA GLY 17 -7.095 0.820 -3.567
92 HA3 GLY 17 2HA GLY 17 -7.999 0.179 -2.203
93 H LYS 18 H LYS 18 -4.624 0.285 -3.354
94 HA LYS 18 HA LYS 18 -3.832 1.018 -0.611
95 HB2 LYS 18 1HB LYS 18 -2.295 -0.701 -2.568
96 HB3 LYS 18 2HB LYS 18 -1.718 -0.196 -0.985
97 HG2 LYS 18 1HG LYS 18 -4.308 -1.626 -1.089
98 HG3 LYS 18 2HG LYS 18 -2.846 -2.560 -1.412
99 HD2 LYS 18 1HD LYS 18 -2.889 -2.786 0.848
100 HD3 LYS 18 2HD LYS 18 -2.028 -1.247 0.765
101 HE2 LYS 18 1HE LYS 18 -3.766 -1.047 2.399
102 HE3 LYS 18 2HE LYS 18 -4.220 -0.087 0.992
103 HZ1 LYS 18 3HZ LYS 18 -5.315 -2.691 1.863
104 HZ2 LYS 18 1HZ LYS 18 -5.521 -2.129 0.280
105 HZ3 LYS 18 2HZ LYS 18 -6.142 -1.243 1.580
106 H ALA 19 H ALA 19 -1.678 2.140 -0.541
107 HA ALA 19 HA ALA 19 -1.300 3.843 -2.916
108 HB1 ALA 19 3HB ALA 19 -1.348 5.765 -1.707
109 HB2 ALA 19 1HB ALA 19 -2.422 4.795 -0.699
110 HB3 ALA 19 2HB ALA 19 -0.728 4.995 -0.247
111 H PHE 20 H PHE 20 0.845 4.822 -3.084
112 HA PHE 20 HA PHE 20 2.983 3.705 -1.498
113 HB2 PHE 20 1HB PHE 20 2.902 3.105 -4.460
114 HB3 PHE 20 2HB PHE 20 4.144 2.609 -3.315
115 HD1 PHE 20 HD1 PHE 20 0.514 2.241 -4.029
116 HD2 PHE 20 HD2 PHE 20 4.004 0.544 -2.279
117 HE1 PHE 20 HE1 PHE 20 -0.716 0.151 -3.609
118 HE2 PHE 20 HE2 PHE 20 2.780 -1.548 -1.858
119 HZ PHE 20 HZ PHE 20 0.418 -1.747 -2.524
120 H ARG 21 H ARG 21 4.441 5.252 -1.222
121 HA ARG 21 HA ARG 21 4.370 7.617 -2.887
122 HB2 ARG 21 1HB ARG 21 4.593 7.663 -0.372
123 HB3 ARG 21 2HB ARG 21 6.223 7.035 -0.575
124 HG2 ARG 21 1HG ARG 21 6.937 8.998 -1.691
125 HG3 ARG 21 2HG ARG 21 5.281 9.586 -1.854
126 HD2 ARG 21 1HD ARG 21 6.120 10.829 -0.077
127 HD3 ARG 21 2HD ARG 21 5.236 9.527 0.719
128 HE ARG 21 HE ARG 21 8.099 9.948 0.716
129 HH11 ARG 21 1HH1 ARG 21 5.476 7.738 1.314
130 HH12 ARG 21 2HH1 ARG 21 6.400 6.723 2.371
131 HH21 ARG 21 1HH2 ARG 21 9.326 8.619 2.106
132 HH22 ARG 21 2HH2 ARG 21 8.590 7.225 2.821
133 H SER 22 H SER 22 5.273 5.208 -4.164
134 HA SER 22 HA SER 22 7.578 6.195 -5.468
135 HB2 SER 22 1HB SER 22 8.837 5.491 -3.560
136 HB3 SER 22 2HB SER 22 7.990 3.946 -3.492
137 HG SER 22 HG SER 22 9.803 4.829 -5.487
138 H LYS 23 H LYS 23 7.609 5.386 -7.469
139 HA LYS 23 HA LYS 23 5.650 3.771 -8.510
140 HB2 LYS 23 1HB LYS 23 7.586 5.194 -9.628
141 HB3 LYS 23 2HB LYS 23 8.369 3.622 -9.734
142 HG2 LYS 23 1HG LYS 23 5.572 3.982 -10.724
143 HG3 LYS 23 2HG LYS 23 6.948 4.472 -11.716
144 HD2 LYS 23 1HD LYS 23 7.872 2.153 -11.384
145 HD3 LYS 23 2HD LYS 23 6.325 1.722 -10.653
146 HE2 LYS 23 1HE LYS 23 5.156 2.147 -12.676
147 HE3 LYS 23 2HE LYS 23 6.564 2.919 -13.405
148 HZ1 LYS 23 3HZ LYS 23 5.865 0.355 -13.784
149 HZ2 LYS 23 1HZ LYS 23 7.001 0.198 -12.541
150 HZ3 LYS 23 2HZ LYS 23 7.433 0.957 -13.989
151 H SER 24 H SER 24 9.019 2.686 -8.048
152 HA SER 24 HA SER 24 8.711 0.020 -8.524
153 HB2 SER 24 1HB SER 24 10.437 1.240 -6.355
154 HB3 SER 24 2HB SER 24 10.646 -0.366 -7.053
155 HG SER 24 HG SER 24 12.016 0.933 -8.165
156 H TYR 25 H TYR 25 8.534 1.473 -5.269
157 HA TYR 25 HA TYR 25 7.872 -0.605 -3.714
158 HB2 TYR 25 1HB TYR 25 7.866 1.970 -3.224
159 HB3 TYR 25 2HB TYR 25 6.132 1.825 -3.491
160 HD1 TYR 25 HD2 TYR 25 8.511 -0.513 -1.822
161 HD2 TYR 25 HD1 TYR 25 5.143 2.052 -1.401
162 HE1 TYR 25 HE2 TYR 25 8.224 -1.281 0.497
163 HE2 TYR 25 HE1 TYR 25 4.846 1.292 0.919
164 HH TYR 25 HH TYR 25 6.366 -1.427 2.171
165 H LEU 26 H LEU 26 5.608 1.064 -5.870
166 HA LEU 26 HA LEU 26 3.312 -0.398 -5.169
167 HB2 LEU 26 1HB LEU 26 3.198 1.687 -6.401
168 HB3 LEU 26 2HB LEU 26 4.037 0.951 -7.765
169 HG LEU 26 HG LEU 26 2.036 -0.635 -7.911
170 HD11 LEU 26 1HD1 LEU 26 -0.044 0.150 -6.977
171 HD12 LEU 26 2HD1 LEU 26 0.767 1.538 -6.253
172 HD13 LEU 26 3HD1 LEU 26 1.130 -0.090 -5.682
173 HD21 LEU 26 3HD2 LEU 26 1.964 2.290 -8.566
174 HD22 LEU 26 1HD2 LEU 26 0.641 1.214 -9.018
175 HD23 LEU 26 2HD2 LEU 26 2.267 0.919 -9.634
176 H ILE 27 H ILE 27 5.522 -0.815 -7.936
177 HA ILE 27 HA ILE 27 4.428 -2.985 -9.163
178 HB ILE 27 HB ILE 27 7.376 -2.557 -8.660
179 HG12 ILE 27 1HG1 ILE 27 5.976 -1.876 -11.214
180 HG13 ILE 27 2HG1 ILE 27 5.837 -0.771 -9.851
181 HG21 ILE 27 1HG2 ILE 27 7.862 -4.115 -10.286
182 HG22 ILE 27 2HG2 ILE 27 6.471 -4.854 -9.494
183 HG23 ILE 27 3HG2 ILE 27 6.264 -4.001 -11.024
184 HD11 ILE 27 3HD1 ILE 27 8.545 -1.340 -10.009
185 HD12 ILE 27 1HD1 ILE 27 8.022 -1.173 -11.685
186 HD13 ILE 27 2HD1 ILE 27 7.736 0.135 -10.536
187 H ILE 28 H ILE 28 6.310 -2.960 -6.189
188 HA ILE 28 HA ILE 28 6.683 -5.733 -5.926
189 HB ILE 28 HB ILE 28 6.442 -3.641 -3.761
190 HG12 ILE 28 1HG1 ILE 28 8.952 -4.878 -4.889
191 HG13 ILE 28 2HG1 ILE 28 8.263 -3.391 -5.531
192 HG21 ILE 28 1HG2 ILE 28 8.093 -5.879 -3.076
193 HG22 ILE 28 2HG2 ILE 28 6.672 -5.246 -2.247
194 HG23 ILE 28 3HG2 ILE 28 6.484 -6.439 -3.531
195 HD11 ILE 28 3HD1 ILE 28 9.945 -2.735 -4.035
196 HD12 ILE 28 1HD1 ILE 28 8.424 -2.467 -3.185
197 HD13 ILE 28 2HD1 ILE 28 9.410 -3.880 -2.805
198 H HIS 29 H HIS 29 4.005 -3.628 -5.070
199 HA HIS 29 HA HIS 29 2.575 -5.810 -3.774
200 HB2 HIS 29 1HB HIS 29 2.341 -3.724 -2.657
201 HB3 HIS 29 2HB HIS 29 1.968 -2.880 -4.157
202 HD1 HIS 29 HD1 HIS 29 0.436 -5.386 -1.772
203 HD2 HIS 29 HD2 HIS 29 -0.694 -2.739 -4.768
204 HE1 HIS 29 HE1 HIS 29 -2.079 -5.364 -1.736
205 H MET 30 H MET 30 2.716 -4.168 -6.813
206 HA MET 30 HA MET 30 0.132 -5.108 -7.707
207 HB2 MET 30 1HB MET 30 2.384 -3.653 -9.091
208 HB3 MET 30 2HB MET 30 0.922 -4.164 -9.924
209 HG2 MET 30 1HG MET 30 0.905 -2.381 -7.506
210 HG3 MET 30 2HG MET 30 0.968 -1.778 -9.161
211 HE1 MET 30 3HE MET 30 -0.692 -2.596 -10.970
212 HE2 MET 30 1HE MET 30 -1.147 -4.226 -10.471
213 HE3 MET 30 2HE MET 30 -2.385 -2.984 -10.662
214 H ARG 31 H ARG 31 3.389 -6.219 -7.709
215 HA ARG 31 HA ARG 31 3.070 -8.050 -9.910
216 HB2 ARG 31 1HB ARG 31 5.296 -8.823 -9.350
217 HB3 ARG 31 2HB ARG 31 5.265 -7.065 -9.328
218 HG2 ARG 31 1HG ARG 31 6.417 -7.430 -7.411
219 HG3 ARG 31 2HG ARG 31 4.778 -7.473 -6.759
220 HD2 ARG 31 1HD ARG 31 5.577 -9.402 -5.850
221 HD3 ARG 31 2HD ARG 31 4.998 -10.038 -7.389
222 HE ARG 31 HE ARG 31 7.689 -9.209 -7.626
223 HH11 ARG 31 1HH1 ARG 31 5.718 -11.724 -6.244
224 HH12 ARG 31 2HH1 ARG 31 6.968 -12.922 -6.313
225 HH21 ARG 31 1HH2 ARG 31 9.343 -10.777 -7.722
226 HH22 ARG 31 2HH2 ARG 31 9.030 -12.381 -7.152
227 H THR 32 H THR 32 2.757 -8.138 -6.432
228 HA THR 32 HA THR 32 2.701 -10.979 -6.187
229 HB THR 32 HB THR 32 3.221 -9.416 -4.299
230 HG1 THR 32 HG1 THR 32 2.236 -10.761 -2.802
231 HG21 THR 32 3HG2 THR 32 1.655 -7.693 -4.420
232 HG22 THR 32 1HG2 THR 32 1.085 -8.653 -3.056
233 HG23 THR 32 2HG2 THR 32 0.303 -8.806 -4.629
234 H HIS 33 H HIS 33 0.322 -8.521 -6.862
235 HA HIS 33 HA HIS 33 -2.015 -9.932 -6.238
236 HB2 HIS 33 1HB HIS 33 -1.335 -7.630 -7.996
237 HB3 HIS 33 2HB HIS 33 -2.885 -8.420 -8.266
238 HD1 HIS 33 HD1 HIS 33 -3.612 -9.002 -5.303
239 HD2 HIS 33 HD2 HIS 33 -2.191 -5.367 -6.726
240 HE1 HIS 33 HE1 HIS 33 -4.393 -7.280 -3.645
241 H THR 34 H THR 34 -0.445 -9.544 -9.419
242 HA THR 34 HA THR 34 -1.623 -12.130 -10.202
243 HB THR 34 HB THR 34 -2.763 -10.252 -11.349
244 HG1 THR 34 HG1 THR 34 -2.024 -11.100 -13.582
245 HG21 THR 34 3HG2 THR 34 0.045 -9.620 -12.161
246 HG22 THR 34 1HG2 THR 34 -1.235 -8.535 -11.620
247 HG23 THR 34 2HG2 THR 34 -1.288 -9.221 -13.244
248 H GLY 35 H GLY 35 -0.359 -13.493 -11.460
249 HA2 GLY 35 1HA GLY 35 2.030 -12.864 -12.742
250 HA3 GLY 35 2HA GLY 35 2.443 -13.301 -11.090
251 H GLU 36 H GLU 36 -0.093 -14.629 -13.181
252 HA GLU 36 HA GLU 36 -0.640 -16.855 -13.483
253 HB2 GLU 36 1HB GLU 36 0.910 -17.933 -15.018
254 HB3 GLU 36 2HB GLU 36 0.736 -16.232 -15.426
255 HG2 GLU 36 1HG GLU 36 2.852 -15.747 -14.305
256 HG3 GLU 36 2HG GLU 36 3.028 -17.455 -13.906
257 H LYS 37 H LYS 37 0.347 -16.407 -10.843
258 HA LYS 37 HA LYS 37 2.335 -18.181 -10.018
259 HB2 LYS 37 1HB LYS 37 1.468 -17.924 -7.804
260 HB3 LYS 37 2HB LYS 37 1.271 -16.382 -8.628
261 HG2 LYS 37 1HG LYS 37 -1.035 -16.632 -8.808
262 HG3 LYS 37 2HG LYS 37 -0.963 -18.374 -8.532
263 HD2 LYS 37 1HD LYS 37 -0.094 -16.431 -6.417
264 HD3 LYS 37 2HD LYS 37 -1.795 -16.856 -6.621
265 HE2 LYS 37 1HE LYS 37 -1.482 -19.010 -5.918
266 HE3 LYS 37 2HE LYS 37 0.192 -19.062 -6.470
267 HZ1 LYS 37 3HZ LYS 37 -0.018 -17.145 -4.438
268 HZ2 LYS 37 1HZ LYS 37 0.848 -18.598 -4.424
269 HZ3 LYS 37 2HZ LYS 37 -0.757 -18.565 -3.891
270 HA PRO 38 HA PRO 38 0.554 -22.173 -10.540
271 HB2 PRO 38 1HB PRO 38 1.998 -23.537 -8.689
272 HB3 PRO 38 2HB PRO 38 2.677 -22.996 -10.229
273 HG2 PRO 38 1HG PRO 38 2.905 -21.750 -7.517
274 HG3 PRO 38 2HG PRO 38 4.155 -21.974 -8.753
275 HD2 PRO 38 1HD PRO 38 2.898 -19.607 -8.366
276 HD3 PRO 38 2HD PRO 38 3.468 -20.136 -9.962
277 H SER 39 H SER 39 -1.498 -22.430 -9.877
278 HA SER 39 HA SER 39 -2.084 -22.338 -7.000
279 HB2 SER 39 1HB SER 39 -4.428 -22.053 -7.650
280 HB3 SER 39 2HB SER 39 -3.420 -20.844 -8.444
281 HG SER 39 HG SER 39 -5.092 -22.301 -9.655
282 H GLY 40 H GLY 40 -2.723 -24.103 -5.908
283 HA2 GLY 40 1HA GLY 40 -4.196 -26.238 -6.582
284 HA3 GLY 40 2HA GLY 40 -2.645 -26.653 -7.298
285 HA PRO 41 HA PRO 41 -1.077 -28.140 -3.487
286 HB2 PRO 41 1HB PRO 41 1.373 -26.996 -3.240
287 HB3 PRO 41 2HB PRO 41 1.016 -28.254 -4.429
288 HG2 PRO 41 1HG PRO 41 1.156 -25.286 -4.796
289 HG3 PRO 41 2HG PRO 41 1.791 -26.574 -5.838
290 HD2 PRO 41 1HD PRO 41 -0.527 -25.279 -6.370
291 HD3 PRO 41 2HD PRO 41 -0.264 -26.981 -6.799
292 H SER 42 H SER 42 -2.024 -24.996 -3.740
293 HA SER 42 HA SER 42 -1.103 -23.443 -1.782
294 HB2 SER 42 1HB SER 42 -3.326 -23.309 -3.221
295 HB3 SER 42 2HB SER 42 -4.061 -23.860 -1.716
296 HG SER 42 HG SER 42 -2.905 -21.429 -2.343
297 H SER 43 H SER 43 -0.912 -23.388 0.383
298 HA SER 43 HA SER 43 -1.525 -25.806 1.852
299 HB2 SER 43 1HB SER 43 -0.087 -23.259 2.616
300 HB3 SER 43 2HB SER 43 -0.343 -24.602 3.731
301 HG SER 43 HG SER 43 1.610 -24.327 2.011
302 H GLY 44 H GLY 44 -2.728 -25.861 3.816
303 HA2 GLY 44 1HA GLY 44 -5.038 -24.095 3.736
304 HA3 GLY 44 2HA GLY 44 -4.863 -25.542 4.718
Start of MODEL 18
1 H1 GLY 1 H GLY 1 -8.972 12.391 15.912
2 HA2 GLY 1 1HA GLY 1 -6.715 11.910 17.426
3 HA3 GLY 1 2HA GLY 1 -6.160 11.930 15.758
4 H SER 2 H SER 2 -5.266 13.764 17.652
5 HA SER 2 HA SER 2 -6.639 16.181 17.781
6 HB2 SER 2 1HB SER 2 -4.481 17.206 18.295
7 HB3 SER 2 2HB SER 2 -4.624 15.653 19.119
8 HG SER 2 HG SER 2 -2.999 16.392 16.965
9 H SER 3 H SER 3 -4.231 15.095 15.402
10 HA SER 3 HA SER 3 -5.463 16.726 13.362
11 HB2 SER 3 1HB SER 3 -3.447 17.999 12.810
12 HB3 SER 3 2HB SER 3 -3.952 18.341 14.464
13 HG SER 3 HG SER 3 -2.379 16.568 14.994
14 H GLY 4 H GLY 4 -4.188 16.494 11.242
15 HA2 GLY 4 1HA GLY 4 -2.562 14.102 11.047
16 HA3 GLY 4 2HA GLY 4 -4.157 13.968 10.322
17 H SER 5 H SER 5 -1.518 13.852 9.058
18 HA SER 5 HA SER 5 -1.885 16.065 7.152
19 HB2 SER 5 1HB SER 5 0.596 16.048 6.813
20 HB3 SER 5 2HB SER 5 0.108 16.568 8.426
21 HG SER 5 HG SER 5 1.165 14.062 7.639
22 H SER 6 H SER 6 -1.827 15.546 5.022
23 HA SER 6 HA SER 6 -1.680 12.688 4.388
24 HB2 SER 6 1HB SER 6 -2.810 15.006 2.801
25 HB3 SER 6 2HB SER 6 -2.827 13.322 2.279
26 HG SER 6 HG SER 6 -4.450 12.951 3.564
27 H GLY 7 H GLY 7 -0.723 12.097 2.257
28 HA2 GLY 7 1HA GLY 7 1.523 13.862 1.524
29 HA3 GLY 7 2HA GLY 7 1.803 12.162 1.867
30 H VAL 8 H VAL 8 1.627 14.235 -0.582
31 HA VAL 8 HA VAL 8 -0.063 13.549 -2.525
32 HB VAL 8 HB VAL 8 2.931 13.672 -2.914
33 HG11 VAL 8 1HG1 VAL 8 2.599 13.370 -5.088
34 HG12 VAL 8 2HG1 VAL 8 0.906 13.007 -4.748
35 HG13 VAL 8 3HG1 VAL 8 1.397 14.660 -5.120
36 HG21 VAL 8 3HG2 VAL 8 0.867 15.701 -2.411
37 HG22 VAL 8 1HG2 VAL 8 2.610 15.763 -2.150
38 HG23 VAL 8 2HG2 VAL 8 1.948 16.056 -3.759
39 H LYS 9 H LYS 9 -0.864 11.706 -3.259
40 HA LYS 9 HA LYS 9 0.888 9.337 -3.338
41 HB2 LYS 9 1HB LYS 9 -1.248 8.010 -3.114
42 HB3 LYS 9 2HB LYS 9 -0.772 8.922 -1.688
43 HG2 LYS 9 1HG LYS 9 -2.644 10.189 -3.618
44 HG3 LYS 9 2HG LYS 9 -3.253 8.920 -2.552
45 HD2 LYS 9 1HD LYS 9 -2.065 10.299 -0.687
46 HD3 LYS 9 2HD LYS 9 -2.149 11.614 -1.862
47 HE2 LYS 9 1HE LYS 9 -4.557 9.985 -1.098
48 HE3 LYS 9 2HE LYS 9 -4.064 11.414 -0.190
49 HZ1 LYS 9 3HZ LYS 9 -5.663 11.389 -2.396
50 HZ2 LYS 9 1HZ LYS 9 -4.168 11.892 -3.009
51 HZ3 LYS 9 2HZ LYS 9 -4.895 12.748 -1.744
52 HA PRO 10 HA PRO 10 -0.329 10.322 -7.686
53 HB2 PRO 10 1HB PRO 10 2.099 9.712 -8.735
54 HB3 PRO 10 2HB PRO 10 1.711 11.304 -8.074
55 HG2 PRO 10 1HG PRO 10 3.193 9.035 -6.802
56 HG3 PRO 10 2HG PRO 10 3.566 10.768 -6.778
57 HD2 PRO 10 1HD PRO 10 2.363 9.508 -4.705
58 HD3 PRO 10 2HD PRO 10 2.032 11.204 -5.114
59 H TYR 11 H TYR 11 0.985 7.585 -6.036
60 HA TYR 11 HA TYR 11 0.042 5.831 -8.209
61 HB2 TYR 11 1HB TYR 11 2.193 5.116 -6.216
62 HB3 TYR 11 2HB TYR 11 1.750 4.246 -7.680
63 HD1 TYR 11 HD1 TYR 11 2.226 5.328 -9.918
64 HD2 TYR 11 HD2 TYR 11 3.818 6.820 -6.265
65 HE1 TYR 11 HE1 TYR 11 3.938 6.566 -11.177
66 HE2 TYR 11 HE2 TYR 11 5.534 8.063 -7.514
67 HH TYR 11 HH TYR 11 5.942 7.660 -10.973
68 H GLY 12 H GLY 12 -1.686 4.673 -7.694
69 HA2 GLY 12 1HA GLY 12 -1.953 3.616 -4.977
70 HA3 GLY 12 2HA GLY 12 -3.246 4.644 -5.577
71 H CYS 13 H CYS 13 -2.315 1.518 -5.184
72 HA CYS 13 HA CYS 13 -3.233 0.338 -7.604
73 HB2 CYS 13 1HB CYS 13 -1.691 -0.774 -5.984
74 HB3 CYS 13 2HB CYS 13 -3.042 -0.932 -4.866
75 H SER 14 H SER 14 -5.256 0.306 -8.299
76 HA SER 14 HA SER 14 -7.466 0.893 -6.570
77 HB2 SER 14 1HB SER 14 -8.834 0.581 -8.625
78 HB3 SER 14 2HB SER 14 -7.494 1.702 -8.862
79 HG SER 14 HG SER 14 -6.356 0.057 -9.898
80 H GLU 15 H GLU 15 -6.198 -1.981 -8.168
81 HA GLU 15 HA GLU 15 -8.125 -3.833 -7.988
82 HB2 GLU 15 1HB GLU 15 -5.242 -4.111 -7.144
83 HB3 GLU 15 2HB GLU 15 -6.333 -5.484 -7.270
84 HG2 GLU 15 1HG GLU 15 -5.715 -3.610 -9.539
85 HG3 GLU 15 2HG GLU 15 -4.878 -5.134 -9.252
86 H CYS 16 H CYS 16 -5.953 -3.213 -5.223
87 HA CYS 16 HA CYS 16 -8.021 -4.295 -3.444
88 HB2 CYS 16 1HB CYS 16 -6.178 -4.386 -1.758
89 HB3 CYS 16 2HB CYS 16 -5.880 -5.370 -3.186
90 H GLY 17 H GLY 17 -5.930 -1.480 -3.914
91 HA2 GLY 17 1HA GLY 17 -6.904 0.720 -3.517
92 HA3 GLY 17 2HA GLY 17 -7.739 0.028 -2.134
93 H LYS 18 H LYS 18 -4.376 0.229 -3.309
94 HA LYS 18 HA LYS 18 -3.612 1.170 -0.623
95 HB2 LYS 18 1HB LYS 18 -2.246 -0.839 -2.402
96 HB3 LYS 18 2HB LYS 18 -1.377 0.011 -1.131
97 HG2 LYS 18 1HG LYS 18 -3.230 -0.855 0.426
98 HG3 LYS 18 2HG LYS 18 -3.599 -1.978 -0.884
99 HD2 LYS 18 1HD LYS 18 -2.115 -3.163 0.478
100 HD3 LYS 18 2HD LYS 18 -1.099 -2.555 -0.831
101 HE2 LYS 18 1HE LYS 18 -0.724 -0.538 0.781
102 HE3 LYS 18 2HE LYS 18 -1.256 -1.673 2.021
103 HZ1 LYS 18 3HZ LYS 18 1.190 -1.589 1.667
104 HZ2 LYS 18 1HZ LYS 18 0.952 -2.238 0.123
105 HZ3 LYS 18 2HZ LYS 18 0.521 -3.133 1.492
106 H ALA 19 H ALA 19 -1.280 2.135 -0.746
107 HA ALA 19 HA ALA 19 -0.879 3.629 -3.232
108 HB1 ALA 19 3HB ALA 19 -2.259 4.843 -1.304
109 HB2 ALA 19 1HB ALA 19 -0.629 5.202 -0.735
110 HB3 ALA 19 2HB ALA 19 -1.130 5.705 -2.349
111 H PHE 20 H PHE 20 1.227 4.798 -3.237
112 HA PHE 20 HA PHE 20 3.221 3.910 -1.340
113 HB2 PHE 20 1HB PHE 20 3.687 3.227 -4.236
114 HB3 PHE 20 2HB PHE 20 4.586 2.680 -2.824
115 HD1 PHE 20 HD1 PHE 20 1.472 2.291 -4.738
116 HD2 PHE 20 HD2 PHE 20 3.866 0.803 -1.548
117 HE1 PHE 20 HE1 PHE 20 0.089 0.258 -4.653
118 HE2 PHE 20 HE2 PHE 20 2.487 -1.233 -1.459
119 HZ PHE 20 HZ PHE 20 0.597 -1.508 -3.013
120 H ARG 21 H ARG 21 4.335 5.687 -0.918
121 HA ARG 21 HA ARG 21 4.272 8.076 -2.241
122 HB2 ARG 21 1HB ARG 21 6.231 8.720 -1.016
123 HB3 ARG 21 2HB ARG 21 5.275 7.661 0.011
124 HG2 ARG 21 1HG ARG 21 7.324 6.765 0.375
125 HG3 ARG 21 2HG ARG 21 6.858 5.819 -1.040
126 HD2 ARG 21 1HD ARG 21 8.984 6.514 -1.611
127 HD3 ARG 21 2HD ARG 21 7.980 7.750 -2.370
128 HE ARG 21 HE ARG 21 8.846 9.303 -0.921
129 HH11 ARG 21 1HH1 ARG 21 9.640 6.104 0.201
130 HH12 ARG 21 2HH1 ARG 21 10.724 6.663 1.430
131 HH21 ARG 21 1HH2 ARG 21 10.272 10.051 0.694
132 HH22 ARG 21 2HH2 ARG 21 11.083 8.909 1.711
133 H SER 22 H SER 22 6.339 5.315 -2.908
134 HA SER 22 HA SER 22 7.497 6.772 -5.190
135 HB2 SER 22 1HB SER 22 8.570 4.695 -3.349
136 HB3 SER 22 2HB SER 22 9.096 4.629 -5.031
137 HG SER 22 HG SER 22 9.144 7.136 -3.874
138 H LYS 23 H LYS 23 8.222 5.071 -6.953
139 HA LYS 23 HA LYS 23 5.770 3.815 -7.846
140 HB2 LYS 23 1HB LYS 23 6.970 5.084 -9.487
141 HB3 LYS 23 2HB LYS 23 8.463 4.219 -9.149
142 HG2 LYS 23 1HG LYS 23 7.628 2.226 -10.144
143 HG3 LYS 23 2HG LYS 23 6.003 2.903 -10.272
144 HD2 LYS 23 1HD LYS 23 6.819 3.151 -12.427
145 HD3 LYS 23 2HD LYS 23 7.150 4.731 -11.712
146 HE2 LYS 23 1HE LYS 23 9.121 4.134 -12.850
147 HE3 LYS 23 2HE LYS 23 9.453 3.827 -11.146
148 HZ1 LYS 23 3HZ LYS 23 8.393 1.486 -12.161
149 HZ2 LYS 23 1HZ LYS 23 10.001 1.775 -11.722
150 HZ3 LYS 23 2HZ LYS 23 9.503 2.018 -13.320
151 H SER 24 H SER 24 9.162 2.761 -7.494
152 HA SER 24 HA SER 24 9.012 0.127 -8.027
153 HB2 SER 24 1HB SER 24 10.762 -0.246 -6.295
154 HB3 SER 24 2HB SER 24 11.090 1.160 -7.308
155 HG SER 24 HG SER 24 9.828 2.249 -5.449
156 H TYR 25 H TYR 25 8.119 1.582 -4.909
157 HA TYR 25 HA TYR 25 7.445 -0.692 -3.505
158 HB2 TYR 25 1HB TYR 25 6.565 2.148 -3.412
159 HB3 TYR 25 2HB TYR 25 5.595 0.975 -2.529
160 HD1 TYR 25 HD1 TYR 25 7.349 -0.835 -1.291
161 HD2 TYR 25 HD2 TYR 25 7.989 3.306 -2.027
162 HE1 TYR 25 HE1 TYR 25 8.947 -0.757 0.577
163 HE2 TYR 25 HE2 TYR 25 9.590 3.396 -0.162
164 HH TYR 25 HH TYR 25 10.868 0.632 1.299
165 H LEU 26 H LEU 26 5.467 1.146 -5.792
166 HA LEU 26 HA LEU 26 3.060 -0.233 -5.434
167 HB2 LEU 26 1HB LEU 26 3.125 1.838 -6.642
168 HB3 LEU 26 2HB LEU 26 4.200 1.148 -7.856
169 HG LEU 26 HG LEU 26 2.357 -0.347 -8.573
170 HD11 LEU 26 1HD1 LEU 26 1.188 -0.183 -6.315
171 HD12 LEU 26 2HD1 LEU 26 0.172 -0.144 -7.755
172 HD13 LEU 26 3HD1 LEU 26 0.538 1.351 -6.895
173 HD21 LEU 26 3HD2 LEU 26 2.244 2.613 -8.728
174 HD22 LEU 26 1HD2 LEU 26 0.858 1.706 -9.332
175 HD23 LEU 26 2HD2 LEU 26 2.462 1.417 -10.006
176 H ILE 27 H ILE 27 5.547 -0.720 -7.945
177 HA ILE 27 HA ILE 27 4.467 -2.908 -9.218
178 HB ILE 27 HB ILE 27 7.401 -2.452 -8.662
179 HG12 ILE 27 1HG1 ILE 27 5.867 -1.663 -11.135
180 HG13 ILE 27 2HG1 ILE 27 6.063 -0.570 -9.769
181 HG21 ILE 27 1HG2 ILE 27 7.807 -3.810 -10.625
182 HG22 ILE 27 2HG2 ILE 27 6.864 -4.723 -9.447
183 HG23 ILE 27 3HG2 ILE 27 6.073 -4.029 -10.862
184 HD11 ILE 27 3HD1 ILE 27 8.368 -1.828 -11.227
185 HD12 ILE 27 1HD1 ILE 27 7.688 -0.254 -11.637
186 HD13 ILE 27 2HD1 ILE 27 8.417 -0.514 -10.052
187 H ILE 28 H ILE 28 7.002 -3.121 -6.712
188 HA ILE 28 HA ILE 28 7.104 -5.789 -6.293
189 HB ILE 28 HB ILE 28 7.078 -3.698 -4.114
190 HG12 ILE 28 1HG1 ILE 28 9.483 -4.966 -5.416
191 HG13 ILE 28 2HG1 ILE 28 8.751 -3.495 -6.049
192 HG21 ILE 28 1HG2 ILE 28 8.305 -6.448 -4.044
193 HG22 ILE 28 2HG2 ILE 28 8.208 -5.282 -2.726
194 HG23 ILE 28 3HG2 ILE 28 6.741 -6.047 -3.336
195 HD11 ILE 28 3HD1 ILE 28 9.043 -2.691 -3.561
196 HD12 ILE 28 1HD1 ILE 28 10.298 -3.929 -3.556
197 HD13 ILE 28 2HD1 ILE 28 10.368 -2.606 -4.721
198 H HIS 29 H HIS 29 4.509 -3.650 -5.345
199 HA HIS 29 HA HIS 29 3.170 -5.699 -3.789
200 HB2 HIS 29 1HB HIS 29 2.726 -3.656 -2.825
201 HB3 HIS 29 2HB HIS 29 2.699 -2.812 -4.371
202 HD1 HIS 29 HD1 HIS 29 0.532 -4.900 -2.120
203 HD2 HIS 29 HD2 HIS 29 0.210 -2.608 -5.569
204 HE1 HIS 29 HE1 HIS 29 -1.936 -4.669 -2.545
205 H MET 30 H MET 30 2.984 -4.253 -6.969
206 HA MET 30 HA MET 30 0.486 -5.570 -7.608
207 HB2 MET 30 1HB MET 30 2.387 -3.986 -9.345
208 HB3 MET 30 2HB MET 30 0.806 -4.570 -9.847
209 HG2 MET 30 1HG MET 30 0.031 -3.224 -7.709
210 HG3 MET 30 2HG MET 30 1.521 -2.339 -8.031
211 HE1 MET 30 3HE MET 30 -2.264 -2.835 -9.243
212 HE2 MET 30 1HE MET 30 -1.977 -2.776 -10.983
213 HE3 MET 30 2HE MET 30 -1.260 -4.064 -10.014
214 H ARG 31 H ARG 31 3.165 -6.970 -6.996
215 HA ARG 31 HA ARG 31 3.637 -8.421 -9.469
216 HB2 ARG 31 1HB ARG 31 5.534 -9.320 -8.445
217 HB3 ARG 31 2HB ARG 31 5.431 -7.703 -7.762
218 HG2 ARG 31 1HG ARG 31 4.426 -8.600 -5.740
219 HG3 ARG 31 2HG ARG 31 4.468 -10.225 -6.428
220 HD2 ARG 31 1HD ARG 31 7.003 -8.674 -6.298
221 HD3 ARG 31 2HD ARG 31 6.362 -9.355 -4.803
222 HE ARG 31 HE ARG 31 7.496 -10.800 -7.033
223 HH11 ARG 31 1HH1 ARG 31 5.528 -10.960 -4.166
224 HH12 ARG 31 2HH1 ARG 31 5.765 -12.662 -3.941
225 HH21 ARG 31 1HH2 ARG 31 7.816 -13.040 -6.747
226 HH22 ARG 31 2HH2 ARG 31 7.067 -13.844 -5.409
227 H THR 32 H THR 32 2.233 -8.959 -6.283
228 HA THR 32 HA THR 32 1.757 -11.757 -6.727
229 HB THR 32 HB THR 32 2.060 -10.997 -4.452
230 HG1 THR 32 HG1 THR 32 0.408 -12.159 -3.616
231 HG21 THR 32 3HG2 THR 32 0.180 -9.612 -3.415
232 HG22 THR 32 1HG2 THR 32 -0.272 -9.200 -5.068
233 HG23 THR 32 2HG2 THR 32 1.322 -8.761 -4.454
234 H HIS 33 H HIS 33 0.023 -8.792 -7.267
235 HA HIS 33 HA HIS 33 -2.598 -9.739 -7.402
236 HB2 HIS 33 1HB HIS 33 -1.148 -7.441 -8.662
237 HB3 HIS 33 2HB HIS 33 -2.795 -7.805 -9.169
238 HD1 HIS 33 HD1 HIS 33 -3.887 -8.583 -6.329
239 HD2 HIS 33 HD2 HIS 33 -1.694 -5.169 -7.221
240 HE1 HIS 33 HE1 HIS 33 -4.465 -6.923 -4.530
241 H THR 34 H THR 34 -0.236 -9.352 -10.042
242 HA THR 34 HA THR 34 -1.908 -11.086 -11.721
243 HB THR 34 HB THR 34 -0.336 -10.319 -13.568
244 HG1 THR 34 HG1 THR 34 1.376 -9.389 -12.644
245 HG21 THR 34 3HG2 THR 34 -2.406 -9.313 -13.698
246 HG22 THR 34 1HG2 THR 34 -1.367 -7.906 -13.474
247 HG23 THR 34 2HG2 THR 34 -2.264 -8.568 -12.106
248 H GLY 35 H GLY 35 -1.331 -13.100 -10.881
249 HA2 GLY 35 1HA GLY 35 -0.075 -15.046 -11.368
250 HA3 GLY 35 2HA GLY 35 1.304 -14.029 -11.758
251 H GLU 36 H GLU 36 0.337 -16.272 -9.662
252 HA GLU 36 HA GLU 36 1.452 -15.029 -7.265
253 HB2 GLU 36 1HB GLU 36 0.698 -17.063 -6.107
254 HB3 GLU 36 2HB GLU 36 -0.613 -16.291 -6.989
255 HG2 GLU 36 1HG GLU 36 -0.094 -17.942 -8.862
256 HG3 GLU 36 2HG GLU 36 0.863 -18.810 -7.663
257 H LYS 37 H LYS 37 3.618 -15.001 -7.299
258 HA LYS 37 HA LYS 37 5.772 -15.692 -7.843
259 HB2 LYS 37 1HB LYS 37 6.347 -17.682 -6.358
260 HB3 LYS 37 2HB LYS 37 5.651 -16.277 -5.561
261 HG2 LYS 37 1HG LYS 37 4.506 -18.021 -4.586
262 HG3 LYS 37 2HG LYS 37 3.402 -17.519 -5.868
263 HD2 LYS 37 1HD LYS 37 3.912 -19.363 -7.197
264 HD3 LYS 37 2HD LYS 37 5.431 -19.671 -6.353
265 HE2 LYS 37 1HE LYS 37 2.664 -20.055 -5.213
266 HE3 LYS 37 2HE LYS 37 3.727 -21.337 -5.789
267 HZ1 LYS 37 3HZ LYS 37 5.098 -19.743 -3.912
268 HZ2 LYS 37 1HZ LYS 37 4.718 -21.389 -3.827
269 HZ3 LYS 37 2HZ LYS 37 3.625 -20.238 -3.244
270 HA PRO 38 HA PRO 38 4.358 -19.032 -10.875
271 HB2 PRO 38 1HB PRO 38 4.651 -17.558 -13.136
272 HB3 PRO 38 2HB PRO 38 3.143 -17.617 -12.217
273 HG2 PRO 38 1HG PRO 38 5.295 -15.536 -12.194
274 HG3 PRO 38 2HG PRO 38 3.534 -15.325 -12.208
275 HD2 PRO 38 1HD PRO 38 5.012 -15.093 -9.951
276 HD3 PRO 38 2HD PRO 38 3.345 -15.704 -9.942
277 H SER 39 H SER 39 6.275 -20.134 -10.415
278 HA SER 39 HA SER 39 8.848 -19.166 -11.137
279 HB2 SER 39 1HB SER 39 9.622 -21.441 -10.624
280 HB3 SER 39 2HB SER 39 8.525 -20.855 -9.373
281 HG SER 39 HG SER 39 8.309 -23.051 -10.842
282 H GLY 40 H GLY 40 8.530 -18.511 -13.335
283 HA2 GLY 40 1HA GLY 40 9.619 -19.533 -15.379
284 HA3 GLY 40 2HA GLY 40 8.372 -20.763 -15.239
285 HA PRO 41 HA PRO 41 6.998 -16.782 -17.588
286 HB2 PRO 41 1HB PRO 41 7.812 -17.338 -20.118
287 HB3 PRO 41 2HB PRO 41 8.795 -16.417 -18.973
288 HG2 PRO 41 1HG PRO 41 8.972 -19.310 -19.723
289 HG3 PRO 41 2HG PRO 41 10.277 -18.132 -19.492
290 HD2 PRO 41 1HD PRO 41 9.602 -19.948 -17.600
291 HD3 PRO 41 2HD PRO 41 10.224 -18.335 -17.197
292 H SER 42 H SER 42 6.669 -20.105 -17.629
293 HA SER 42 HA SER 42 4.192 -19.905 -19.207
294 HB2 SER 42 1HB SER 42 6.102 -22.256 -19.192
295 HB3 SER 42 2HB SER 42 4.572 -22.173 -20.066
296 HG SER 42 HG SER 42 6.651 -20.298 -20.470
297 H SER 43 H SER 43 2.755 -21.892 -18.750
298 HA SER 43 HA SER 43 1.494 -23.090 -17.282
299 HB2 SER 43 1HB SER 43 3.706 -24.198 -16.802
300 HB3 SER 43 2HB SER 43 3.906 -23.076 -15.457
301 HG SER 43 HG SER 43 2.612 -24.272 -14.327
302 H GLY 44 H GLY 44 1.188 -20.348 -17.270
303 HA2 GLY 44 1HA GLY 44 1.397 -19.031 -14.832
304 HA3 GLY 44 2HA GLY 44 0.170 -18.695 -16.045
Start of MODEL 19
1 H1 GLY 1 H GLY 1 -10.089 24.173 4.804
2 HA2 GLY 1 1HA GLY 1 -8.173 22.938 6.683
3 HA3 GLY 1 2HA GLY 1 -9.834 22.377 6.558
4 H SER 2 H SER 2 -7.484 20.796 6.171
5 HA SER 2 HA SER 2 -6.810 20.427 3.477
6 HB2 SER 2 1HB SER 2 -6.113 18.119 4.221
7 HB3 SER 2 2HB SER 2 -5.433 19.436 5.177
8 HG SER 2 HG SER 2 -6.188 18.040 6.664
9 H SER 3 H SER 3 -9.329 18.925 5.464
10 HA SER 3 HA SER 3 -10.983 17.420 4.904
11 HB2 SER 3 1HB SER 3 -12.501 18.375 3.147
12 HB3 SER 3 2HB SER 3 -12.048 19.525 4.405
13 HG SER 3 HG SER 3 -10.529 19.359 2.046
14 H GLY 4 H GLY 4 -8.557 16.487 3.917
15 HA2 GLY 4 1HA GLY 4 -9.496 14.798 1.781
16 HA3 GLY 4 2HA GLY 4 -8.239 15.917 1.275
17 H SER 5 H SER 5 -6.285 15.053 1.270
18 HA SER 5 HA SER 5 -5.551 13.201 3.429
19 HB2 SER 5 1HB SER 5 -5.464 12.719 0.487
20 HB3 SER 5 2HB SER 5 -4.144 12.078 1.466
21 HG SER 5 HG SER 5 -5.485 10.713 2.416
22 H SER 6 H SER 6 -3.663 13.665 4.358
23 HA SER 6 HA SER 6 -2.117 15.892 3.353
24 HB2 SER 6 1HB SER 6 -0.805 15.579 5.463
25 HB3 SER 6 2HB SER 6 -2.532 15.814 5.732
26 HG SER 6 HG SER 6 -1.647 13.194 5.442
27 H GLY 7 H GLY 7 -1.354 14.856 1.401
28 HA2 GLY 7 1HA GLY 7 1.190 14.220 1.157
29 HA3 GLY 7 2HA GLY 7 0.578 12.689 1.765
30 H VAL 8 H VAL 8 1.165 14.542 -0.976
31 HA VAL 8 HA VAL 8 -0.846 13.624 -2.728
32 HB VAL 8 HB VAL 8 1.974 14.504 -3.365
33 HG11 VAL 8 1HG1 VAL 8 -0.432 14.098 -5.133
34 HG12 VAL 8 2HG1 VAL 8 1.014 14.983 -5.623
35 HG13 VAL 8 3HG1 VAL 8 1.121 13.268 -5.224
36 HG21 VAL 8 3HG2 VAL 8 -0.316 16.264 -3.929
37 HG22 VAL 8 1HG2 VAL 8 0.038 16.006 -2.221
38 HG23 VAL 8 2HG2 VAL 8 1.283 16.648 -3.292
39 H LYS 9 H LYS 9 -1.211 11.473 -2.816
40 HA LYS 9 HA LYS 9 1.077 9.695 -3.315
41 HB2 LYS 9 1HB LYS 9 -1.709 9.111 -2.303
42 HB3 LYS 9 2HB LYS 9 -0.534 7.865 -2.704
43 HG2 LYS 9 1HG LYS 9 0.881 8.473 -0.936
44 HG3 LYS 9 2HG LYS 9 0.059 10.018 -0.701
45 HD2 LYS 9 1HD LYS 9 -1.493 7.491 -0.383
46 HD3 LYS 9 2HD LYS 9 -0.394 7.987 0.907
47 HE2 LYS 9 1HE LYS 9 -2.387 9.905 -0.247
48 HE3 LYS 9 2HE LYS 9 -2.859 8.754 1.001
49 HZ1 LYS 9 3HZ LYS 9 -2.174 10.958 1.860
50 HZ2 LYS 9 1HZ LYS 9 -0.610 10.669 1.283
51 HZ3 LYS 9 2HZ LYS 9 -1.263 9.679 2.488
52 HA PRO 10 HA PRO 10 -0.842 9.978 -7.466
53 HB2 PRO 10 1HB PRO 10 1.488 9.561 -8.796
54 HB3 PRO 10 2HB PRO 10 0.989 11.152 -8.208
55 HG2 PRO 10 1HG PRO 10 2.900 9.197 -6.990
56 HG3 PRO 10 2HG PRO 10 3.049 10.957 -7.148
57 HD2 PRO 10 1HD PRO 10 2.296 9.761 -4.839
58 HD3 PRO 10 2HD PRO 10 1.701 11.362 -5.323
59 H TYR 11 H TYR 11 1.339 7.609 -6.051
60 HA TYR 11 HA TYR 11 0.474 5.574 -7.961
61 HB2 TYR 11 1HB TYR 11 2.416 5.143 -5.703
62 HB3 TYR 11 2HB TYR 11 2.278 4.253 -7.216
63 HD1 TYR 11 HD1 TYR 11 2.911 5.458 -9.371
64 HD2 TYR 11 HD2 TYR 11 3.896 6.952 -5.511
65 HE1 TYR 11 HE1 TYR 11 4.651 6.880 -10.372
66 HE2 TYR 11 HE2 TYR 11 5.637 8.379 -6.501
67 HH TYR 11 HH TYR 11 6.707 8.960 -8.355
68 H GLY 12 H GLY 12 -1.601 5.055 -7.380
69 HA2 GLY 12 1HA GLY 12 -1.882 3.765 -4.742
70 HA3 GLY 12 2HA GLY 12 -3.117 4.862 -5.341
71 H CYS 13 H CYS 13 -2.016 1.663 -5.259
72 HA CYS 13 HA CYS 13 -2.914 0.524 -7.599
73 HB2 CYS 13 1HB CYS 13 -1.730 -0.713 -5.823
74 HB3 CYS 13 2HB CYS 13 -3.171 -0.632 -4.814
75 H SER 14 H SER 14 -4.852 -0.213 -8.387
76 HA SER 14 HA SER 14 -7.234 0.918 -7.109
77 HB2 SER 14 1HB SER 14 -6.548 0.137 -9.921
78 HB3 SER 14 2HB SER 14 -8.240 0.209 -9.428
79 HG SER 14 HG SER 14 -7.689 2.215 -10.196
80 H GLU 15 H GLU 15 -5.878 -2.107 -8.286
81 HA GLU 15 HA GLU 15 -7.986 -3.823 -8.235
82 HB2 GLU 15 1HB GLU 15 -5.145 -4.198 -7.322
83 HB3 GLU 15 2HB GLU 15 -6.298 -5.524 -7.272
84 HG2 GLU 15 1HG GLU 15 -5.171 -5.790 -9.294
85 HG3 GLU 15 2HG GLU 15 -6.710 -5.052 -9.735
86 H CYS 16 H CYS 16 -5.964 -3.089 -5.387
87 HA CYS 16 HA CYS 16 -8.138 -4.065 -3.672
88 HB2 CYS 16 1HB CYS 16 -6.452 -4.188 -1.897
89 HB3 CYS 16 2HB CYS 16 -5.941 -5.098 -3.315
90 H GLY 17 H GLY 17 -5.910 -1.326 -4.062
91 HA2 GLY 17 1HA GLY 17 -6.856 0.920 -3.881
92 HA3 GLY 17 2HA GLY 17 -7.854 0.319 -2.566
93 H LYS 18 H LYS 18 -4.371 0.191 -3.319
94 HA LYS 18 HA LYS 18 -3.863 1.224 -0.605
95 HB2 LYS 18 1HB LYS 18 -2.384 -0.789 -2.276
96 HB3 LYS 18 2HB LYS 18 -1.570 0.080 -0.982
97 HG2 LYS 18 1HG LYS 18 -3.353 -0.757 0.571
98 HG3 LYS 18 2HG LYS 18 -3.917 -1.785 -0.749
99 HD2 LYS 18 1HD LYS 18 -2.503 -3.247 0.289
100 HD3 LYS 18 2HD LYS 18 -1.361 -2.476 -0.814
101 HE2 LYS 18 1HE LYS 18 -0.201 -2.346 1.161
102 HE3 LYS 18 2HE LYS 18 -1.049 -0.800 1.178
103 HZ1 LYS 18 3HZ LYS 18 -1.073 -2.392 3.244
104 HZ2 LYS 18 1HZ LYS 18 -2.363 -3.105 2.413
105 HZ3 LYS 18 2HZ LYS 18 -2.432 -1.470 2.837
106 H ALA 19 H ALA 19 -1.420 2.077 -0.583
107 HA ALA 19 HA ALA 19 -0.999 3.778 -2.942
108 HB1 ALA 19 3HB ALA 19 -1.921 4.682 -0.425
109 HB2 ALA 19 1HB ALA 19 -0.261 5.248 -0.620
110 HB3 ALA 19 2HB ALA 19 -1.477 5.640 -1.837
111 H PHE 20 H PHE 20 1.190 4.808 -2.925
112 HA PHE 20 HA PHE 20 3.222 3.565 -1.300
113 HB2 PHE 20 1HB PHE 20 3.403 3.134 -4.278
114 HB3 PHE 20 2HB PHE 20 4.404 2.425 -3.015
115 HD1 PHE 20 HD1 PHE 20 1.026 2.410 -4.508
116 HD2 PHE 20 HD2 PHE 20 3.784 0.421 -1.947
117 HE1 PHE 20 HE1 PHE 20 -0.453 0.445 -4.447
118 HE2 PHE 20 HE2 PHE 20 2.310 -1.548 -1.884
119 HZ PHE 20 HZ PHE 20 0.189 -1.538 -3.135
120 H ARG 21 H ARG 21 4.234 5.380 -0.715
121 HA ARG 21 HA ARG 21 4.352 7.816 -1.837
122 HB2 ARG 21 1HB ARG 21 6.450 8.210 -0.700
123 HB3 ARG 21 2HB ARG 21 5.428 7.192 0.306
124 HG2 ARG 21 1HG ARG 21 6.684 5.219 -0.431
125 HG3 ARG 21 2HG ARG 21 7.726 6.262 -1.401
126 HD2 ARG 21 1HD ARG 21 8.289 7.492 0.718
127 HD3 ARG 21 2HD ARG 21 7.432 6.225 1.596
128 HE ARG 21 HE ARG 21 9.344 5.046 -0.091
129 HH11 ARG 21 1HH1 ARG 21 9.138 6.982 2.795
130 HH12 ARG 21 2HH1 ARG 21 10.625 6.387 3.456
131 HH21 ARG 21 1HH2 ARG 21 11.303 4.256 0.769
132 HH22 ARG 21 2HH2 ARG 21 11.856 4.838 2.303
133 H SER 22 H SER 22 6.300 5.043 -2.811
134 HA SER 22 HA SER 22 7.247 6.605 -5.124
135 HB2 SER 22 1HB SER 22 9.302 5.485 -5.082
136 HB3 SER 22 2HB SER 22 8.954 5.731 -3.370
137 HG SER 22 HG SER 22 8.694 3.368 -4.900
138 H LYS 23 H LYS 23 7.487 5.454 -7.130
139 HA LYS 23 HA LYS 23 5.268 3.827 -7.750
140 HB2 LYS 23 1HB LYS 23 6.195 5.191 -9.474
141 HB3 LYS 23 2HB LYS 23 7.791 4.481 -9.269
142 HG2 LYS 23 1HG LYS 23 6.854 2.313 -10.055
143 HG3 LYS 23 2HG LYS 23 5.342 3.154 -10.408
144 HD2 LYS 23 1HD LYS 23 7.878 4.251 -11.521
145 HD3 LYS 23 2HD LYS 23 7.187 2.807 -12.263
146 HE2 LYS 23 1HE LYS 23 6.136 4.417 -13.496
147 HE3 LYS 23 2HE LYS 23 4.977 4.247 -12.178
148 HZ1 LYS 23 3HZ LYS 23 6.543 6.108 -11.157
149 HZ2 LYS 23 1HZ LYS 23 5.218 6.479 -12.141
150 HZ3 LYS 23 2HZ LYS 23 6.777 6.453 -12.796
151 H SER 24 H SER 24 8.744 3.029 -7.673
152 HA SER 24 HA SER 24 8.802 0.422 -8.284
153 HB2 SER 24 1HB SER 24 10.186 1.609 -5.866
154 HB3 SER 24 2HB SER 24 10.653 0.123 -6.693
155 HG SER 24 HG SER 24 10.791 2.785 -7.627
156 H TYR 25 H TYR 25 8.080 1.570 -4.986
157 HA TYR 25 HA TYR 25 7.562 -0.808 -3.743
158 HB2 TYR 25 1HB TYR 25 6.524 1.958 -3.401
159 HB3 TYR 25 2HB TYR 25 5.672 0.670 -2.558
160 HD1 TYR 25 HD1 TYR 25 7.559 -1.103 -1.511
161 HD2 TYR 25 HD2 TYR 25 7.984 3.097 -2.038
162 HE1 TYR 25 HE1 TYR 25 9.248 -1.056 0.276
163 HE2 TYR 25 HE2 TYR 25 9.675 3.156 -0.254
164 HH TYR 25 HH TYR 25 11.384 1.148 0.730
165 H LEU 26 H LEU 26 5.401 1.021 -5.851
166 HA LEU 26 HA LEU 26 3.079 -0.501 -5.455
167 HB2 LEU 26 1HB LEU 26 3.120 1.683 -6.570
168 HB3 LEU 26 2HB LEU 26 3.974 0.963 -7.934
169 HG LEU 26 HG LEU 26 2.003 -0.423 -8.418
170 HD11 LEU 26 1HD1 LEU 26 -0.102 -0.012 -7.281
171 HD12 LEU 26 2HD1 LEU 26 0.684 1.145 -6.207
172 HD13 LEU 26 3HD1 LEU 26 1.122 -0.561 -6.135
173 HD21 LEU 26 3HD2 LEU 26 0.617 2.091 -8.397
174 HD22 LEU 26 1HD2 LEU 26 1.320 1.211 -9.754
175 HD23 LEU 26 2HD2 LEU 26 2.312 2.332 -8.822
176 H ILE 27 H ILE 27 5.630 -0.790 -7.916
177 HA ILE 27 HA ILE 27 4.603 -2.895 -9.384
178 HB ILE 27 HB ILE 27 7.466 -2.213 -8.731
179 HG12 ILE 27 1HG1 ILE 27 7.224 -1.710 -11.333
180 HG13 ILE 27 2HG1 ILE 27 5.527 -1.544 -10.897
181 HG21 ILE 27 1HG2 ILE 27 7.262 -4.614 -9.246
182 HG22 ILE 27 2HG2 ILE 27 6.484 -4.201 -10.773
183 HG23 ILE 27 3HG2 ILE 27 8.159 -3.732 -10.483
184 HD11 ILE 27 3HD1 ILE 27 7.020 -0.096 -8.994
185 HD12 ILE 27 1HD1 ILE 27 7.645 0.323 -10.589
186 HD13 ILE 27 2HD1 ILE 27 5.928 0.521 -10.234
187 H ILE 28 H ILE 28 7.035 -3.214 -6.788
188 HA ILE 28 HA ILE 28 7.030 -5.965 -6.582
189 HB ILE 28 HB ILE 28 7.343 -4.017 -4.295
190 HG12 ILE 28 1HG1 ILE 28 9.857 -4.685 -4.928
191 HG13 ILE 28 2HG1 ILE 28 9.128 -4.862 -6.520
192 HG21 ILE 28 1HG2 ILE 28 8.255 -6.873 -4.618
193 HG22 ILE 28 2HG2 ILE 28 8.709 -5.808 -3.288
194 HG23 ILE 28 3HG2 ILE 28 7.023 -6.278 -3.504
195 HD11 ILE 28 3HD1 ILE 28 8.382 -2.390 -5.173
196 HD12 ILE 28 1HD1 ILE 28 10.114 -2.547 -5.467
197 HD13 ILE 28 2HD1 ILE 28 8.977 -2.661 -6.811
198 H HIS 29 H HIS 29 4.525 -3.804 -5.793
199 HA HIS 29 HA HIS 29 3.220 -5.711 -3.996
200 HB2 HIS 29 1HB HIS 29 2.962 -3.618 -3.053
201 HB3 HIS 29 2HB HIS 29 2.843 -2.811 -4.614
202 HD1 HIS 29 HD1 HIS 29 0.801 -4.523 -2.015
203 HD2 HIS 29 HD2 HIS 29 0.261 -2.779 -5.747
204 HE1 HIS 29 HE1 HIS 29 -1.686 -4.267 -2.284
205 H MET 30 H MET 30 3.149 -4.576 -7.243
206 HA MET 30 HA MET 30 0.472 -5.610 -7.736
207 HB2 MET 30 1HB MET 30 2.481 -4.236 -9.523
208 HB3 MET 30 2HB MET 30 0.925 -4.830 -10.087
209 HG2 MET 30 1HG MET 30 -0.047 -3.362 -8.193
210 HG3 MET 30 2HG MET 30 1.524 -2.565 -8.237
211 HE1 MET 30 3HE MET 30 -0.458 -3.723 -11.844
212 HE2 MET 30 1HE MET 30 -1.196 -4.024 -10.271
213 HE3 MET 30 2HE MET 30 -1.786 -2.706 -11.283
214 H ARG 31 H ARG 31 3.809 -6.481 -8.207
215 HA ARG 31 HA ARG 31 3.556 -8.415 -10.202
216 HB2 ARG 31 1HB ARG 31 5.622 -9.417 -9.171
217 HB3 ARG 31 2HB ARG 31 5.739 -7.706 -9.557
218 HG2 ARG 31 1HG ARG 31 5.432 -7.110 -7.249
219 HG3 ARG 31 2HG ARG 31 5.132 -8.795 -6.818
220 HD2 ARG 31 1HD ARG 31 7.392 -8.223 -6.224
221 HD3 ARG 31 2HD ARG 31 7.421 -9.350 -7.580
222 HE ARG 31 HE ARG 31 7.497 -6.644 -8.460
223 HH11 ARG 31 1HH1 ARG 31 9.447 -9.195 -7.114
224 HH12 ARG 31 2HH1 ARG 31 10.929 -8.590 -7.777
225 HH21 ARG 31 1HH2 ARG 31 9.442 -5.838 -9.339
226 HH22 ARG 31 2HH2 ARG 31 10.925 -6.680 -9.042
227 H THR 32 H THR 32 2.664 -8.487 -6.858
228 HA THR 32 HA THR 32 2.407 -11.374 -6.773
229 HB THR 32 HB THR 32 3.074 -9.958 -4.774
230 HG1 THR 32 HG1 THR 32 2.258 -12.160 -4.654
231 HG21 THR 32 3HG2 THR 32 1.429 -8.797 -3.538
232 HG22 THR 32 1HG2 THR 32 0.117 -9.460 -4.511
233 HG23 THR 32 2HG2 THR 32 1.217 -8.271 -5.208
234 H HIS 33 H HIS 33 0.364 -8.555 -7.169
235 HA HIS 33 HA HIS 33 -2.140 -9.688 -6.717
236 HB2 HIS 33 1HB HIS 33 -1.132 -7.375 -8.297
237 HB3 HIS 33 2HB HIS 33 -2.776 -7.921 -8.614
238 HD1 HIS 33 HD1 HIS 33 -3.511 -8.636 -5.651
239 HD2 HIS 33 HD2 HIS 33 -1.745 -5.091 -6.905
240 HE1 HIS 33 HE1 HIS 33 -4.070 -6.943 -3.878
241 H THR 34 H THR 34 -0.475 -9.278 -9.846
242 HA THR 34 HA THR 34 -2.295 -10.601 -11.452
243 HB THR 34 HB THR 34 -0.443 -11.022 -13.016
244 HG1 THR 34 HG1 THR 34 1.406 -11.429 -12.054
245 HG21 THR 34 3HG2 THR 34 0.239 -8.717 -13.349
246 HG22 THR 34 1HG2 THR 34 -0.215 -8.316 -11.693
247 HG23 THR 34 2HG2 THR 34 -1.455 -8.771 -12.862
248 H GLY 35 H GLY 35 0.377 -11.945 -9.552
249 HA2 GLY 35 1HA GLY 35 0.185 -14.101 -8.523
250 HA3 GLY 35 2HA GLY 35 -0.880 -14.591 -9.832
251 H GLU 36 H GLU 36 1.341 -16.087 -8.949
252 HA GLU 36 HA GLU 36 3.134 -15.859 -11.277
253 HB2 GLU 36 1HB GLU 36 3.728 -16.814 -8.476
254 HB3 GLU 36 2HB GLU 36 4.821 -17.055 -9.831
255 HG2 GLU 36 1HG GLU 36 3.851 -14.332 -9.038
256 HG3 GLU 36 2HG GLU 36 5.266 -15.079 -8.300
257 H LYS 37 H LYS 37 1.662 -17.186 -12.476
258 HA LYS 37 HA LYS 37 0.798 -19.732 -11.702
259 HB2 LYS 37 1HB LYS 37 1.209 -18.397 -14.356
260 HB3 LYS 37 2HB LYS 37 0.771 -20.099 -14.288
261 HG2 LYS 37 1HG LYS 37 -0.832 -18.048 -12.813
262 HG3 LYS 37 2HG LYS 37 -1.090 -18.341 -14.535
263 HD2 LYS 37 1HD LYS 37 -1.270 -20.823 -13.863
264 HD3 LYS 37 2HD LYS 37 -1.490 -20.210 -12.222
265 HE2 LYS 37 1HE LYS 37 -3.503 -19.189 -12.737
266 HE3 LYS 37 2HE LYS 37 -3.140 -19.111 -14.460
267 HZ1 LYS 37 3HZ LYS 37 -4.447 -20.892 -14.615
268 HZ2 LYS 37 1HZ LYS 37 -4.406 -21.200 -12.952
269 HZ3 LYS 37 2HZ LYS 37 -3.165 -21.771 -13.949
270 HA PRO 38 HA PRO 38 4.373 -22.276 -11.937
271 HB2 PRO 38 1HB PRO 38 3.233 -24.647 -12.607
272 HB3 PRO 38 2HB PRO 38 3.089 -23.934 -10.996
273 HG2 PRO 38 1HG PRO 38 1.140 -23.892 -13.268
274 HG3 PRO 38 2HG PRO 38 0.840 -24.163 -11.541
275 HD2 PRO 38 1HD PRO 38 0.386 -21.779 -12.742
276 HD3 PRO 38 2HD PRO 38 0.902 -21.912 -11.049
277 H SER 39 H SER 39 2.424 -21.615 -14.652
278 HA SER 39 HA SER 39 3.501 -23.249 -16.628
279 HB2 SER 39 1HB SER 39 2.337 -20.473 -16.702
280 HB3 SER 39 2HB SER 39 2.930 -21.256 -18.167
281 HG SER 39 HG SER 39 1.396 -22.814 -17.962
282 H GLY 40 H GLY 40 5.705 -23.534 -16.453
283 HA2 GLY 40 1HA GLY 40 7.902 -23.098 -16.968
284 HA3 GLY 40 2HA GLY 40 7.346 -21.647 -17.789
285 HA PRO 41 HA PRO 41 9.725 -20.644 -13.829
286 HB2 PRO 41 1HB PRO 41 11.868 -19.470 -15.013
287 HB3 PRO 41 2HB PRO 41 11.800 -21.198 -14.646
288 HG2 PRO 41 1HG PRO 41 11.298 -19.792 -17.241
289 HG3 PRO 41 2HG PRO 41 12.203 -21.286 -16.934
290 HD2 PRO 41 1HD PRO 41 9.665 -21.287 -17.876
291 HD3 PRO 41 2HD PRO 41 10.292 -22.569 -16.819
292 H SER 42 H SER 42 10.788 -18.331 -13.455
293 HA SER 42 HA SER 42 8.723 -16.432 -14.187
294 HB2 SER 42 1HB SER 42 11.046 -16.348 -12.267
295 HB3 SER 42 2HB SER 42 10.086 -14.914 -12.630
296 HG SER 42 HG SER 42 9.172 -15.876 -10.859
297 H SER 43 H SER 43 12.292 -16.374 -14.218
298 HA SER 43 HA SER 43 12.155 -14.464 -16.451
299 HB2 SER 43 1HB SER 43 14.083 -14.867 -14.210
300 HB3 SER 43 2HB SER 43 14.709 -14.254 -15.740
301 HG SER 43 HG SER 43 13.932 -12.662 -14.131
302 H GLY 44 H GLY 44 14.293 -17.083 -15.296
303 HA2 GLY 44 1HA GLY 44 15.182 -18.875 -16.455
304 HA3 GLY 44 2HA GLY 44 14.191 -18.423 -17.834
Start of MODEL 20
1 H1 GLY 1 H GLY 1 -12.872 12.389 5.640
2 HA2 GLY 1 1HA GLY 1 -12.286 14.709 4.098
3 HA3 GLY 1 2HA GLY 1 -12.056 13.042 3.590
4 H SER 2 H SER 2 -15.064 14.635 4.560
5 HA SER 2 HA SER 2 -16.778 13.563 2.794
6 HB2 SER 2 1HB SER 2 -16.753 16.515 3.463
7 HB3 SER 2 2HB SER 2 -18.151 15.566 2.956
8 HG SER 2 HG SER 2 -17.536 14.241 4.923
9 H SER 3 H SER 3 -15.149 16.659 2.088
10 HA SER 3 HA SER 3 -15.864 17.161 -0.436
11 HB2 SER 3 1HB SER 3 -14.104 18.379 0.936
12 HB3 SER 3 2HB SER 3 -12.941 17.203 0.326
13 HG SER 3 HG SER 3 -12.802 18.480 -1.330
14 H GLY 4 H GLY 4 -13.169 14.953 0.346
15 HA2 GLY 4 1HA GLY 4 -13.090 12.784 -0.773
16 HA3 GLY 4 2HA GLY 4 -13.713 13.580 -2.211
17 H SER 5 H SER 5 -10.906 13.046 -0.207
18 HA SER 5 HA SER 5 -9.117 14.705 -1.653
19 HB2 SER 5 1HB SER 5 -8.539 12.274 0.059
20 HB3 SER 5 2HB SER 5 -7.342 13.449 -0.486
21 HG SER 5 HG SER 5 -8.812 13.569 1.681
22 H SER 6 H SER 6 -9.531 14.238 -3.852
23 HA SER 6 HA SER 6 -8.642 11.591 -4.775
24 HB2 SER 6 1HB SER 6 -10.473 13.663 -5.949
25 HB3 SER 6 2HB SER 6 -9.696 12.472 -6.992
26 HG SER 6 HG SER 6 -11.615 11.588 -6.367
27 H GLY 7 H GLY 7 -6.450 11.781 -4.899
28 HA2 GLY 7 1HA GLY 7 -4.802 12.250 -6.682
29 HA3 GLY 7 2HA GLY 7 -5.433 13.890 -6.705
30 H VAL 8 H VAL 8 -4.265 11.636 -4.196
31 HA VAL 8 HA VAL 8 -2.613 13.841 -3.146
32 HB VAL 8 HB VAL 8 -2.692 12.688 -0.964
33 HG11 VAL 8 1HG1 VAL 8 -5.512 13.097 -1.899
34 HG12 VAL 8 2HG1 VAL 8 -4.791 13.498 -0.339
35 HG13 VAL 8 3HG1 VAL 8 -4.382 14.444 -1.771
36 HG21 VAL 8 3HG2 VAL 8 -4.352 10.893 -0.621
37 HG22 VAL 8 1HG2 VAL 8 -4.633 10.849 -2.362
38 HG23 VAL 8 2HG2 VAL 8 -3.052 10.414 -1.712
39 H LYS 9 H LYS 9 -2.613 10.675 -4.452
40 HA LYS 9 HA LYS 9 0.281 10.481 -3.959
41 HB2 LYS 9 1HB LYS 9 0.038 8.021 -3.800
42 HB3 LYS 9 2HB LYS 9 -0.787 8.871 -2.500
43 HG2 LYS 9 1HG LYS 9 -2.346 8.166 -4.928
44 HG3 LYS 9 2HG LYS 9 -1.923 6.881 -3.794
45 HD2 LYS 9 1HD LYS 9 -2.855 8.441 -1.982
46 HD3 LYS 9 2HD LYS 9 -3.580 9.341 -3.317
47 HE2 LYS 9 1HE LYS 9 -4.766 7.348 -4.042
48 HE3 LYS 9 2HE LYS 9 -3.994 6.402 -2.770
49 HZ1 LYS 9 3HZ LYS 9 -6.370 7.374 -2.435
50 HZ2 LYS 9 1HZ LYS 9 -5.535 8.789 -2.029
51 HZ3 LYS 9 2HZ LYS 9 -5.267 7.368 -1.152
52 HA PRO 10 HA PRO 10 0.574 10.098 -8.338
53 HB2 PRO 10 1HB PRO 10 3.031 8.954 -8.493
54 HB3 PRO 10 2HB PRO 10 2.789 10.656 -8.085
55 HG2 PRO 10 1HG PRO 10 3.304 8.329 -6.274
56 HG3 PRO 10 2HG PRO 10 3.996 9.961 -6.223
57 HD2 PRO 10 1HD PRO 10 1.975 9.184 -4.596
58 HD3 PRO 10 2HD PRO 10 2.141 10.851 -5.183
59 H TYR 11 H TYR 11 1.329 7.280 -6.328
60 HA TYR 11 HA TYR 11 0.225 5.566 -8.456
61 HB2 TYR 11 1HB TYR 11 2.247 4.556 -6.480
62 HB3 TYR 11 2HB TYR 11 1.830 3.913 -8.064
63 HD1 TYR 11 HD1 TYR 11 2.747 4.916 -10.096
64 HD2 TYR 11 HD2 TYR 11 3.828 6.368 -6.246
65 HE1 TYR 11 HE1 TYR 11 4.648 6.118 -11.091
66 HE2 TYR 11 HE2 TYR 11 5.732 7.576 -7.230
67 HH TYR 11 HH TYR 11 6.993 7.829 -9.082
68 H GLY 12 H GLY 12 -1.404 4.251 -7.895
69 HA2 GLY 12 1HA GLY 12 -1.790 3.489 -5.110
70 HA3 GLY 12 2HA GLY 12 -3.046 4.498 -5.812
71 H CYS 13 H CYS 13 -2.210 1.392 -5.156
72 HA CYS 13 HA CYS 13 -3.121 0.052 -7.498
73 HB2 CYS 13 1HB CYS 13 -1.631 -1.030 -5.871
74 HB3 CYS 13 2HB CYS 13 -2.899 -0.951 -4.652
75 H SER 14 H SER 14 -5.131 -0.222 -8.187
76 HA SER 14 HA SER 14 -7.351 0.567 -6.494
77 HB2 SER 14 1HB SER 14 -7.135 1.244 -8.926
78 HB3 SER 14 2HB SER 14 -7.480 -0.434 -9.343
79 HG SER 14 HG SER 14 -9.224 1.441 -8.889
80 H GLU 15 H GLU 15 -5.988 -2.335 -7.890
81 HA GLU 15 HA GLU 15 -7.980 -4.169 -7.782
82 HB2 GLU 15 1HB GLU 15 -5.106 -4.440 -6.914
83 HB3 GLU 15 2HB GLU 15 -6.200 -5.815 -6.985
84 HG2 GLU 15 1HG GLU 15 -5.837 -4.061 -9.374
85 HG3 GLU 15 2HG GLU 15 -4.647 -5.303 -8.989
86 H CYS 16 H CYS 16 -5.883 -3.420 -4.992
87 HA CYS 16 HA CYS 16 -7.940 -4.540 -3.224
88 HB2 CYS 16 1HB CYS 16 -6.188 -4.623 -1.517
89 HB3 CYS 16 2HB CYS 16 -5.669 -5.452 -2.981
90 H GLY 17 H GLY 17 -5.891 -1.670 -3.638
91 HA2 GLY 17 1HA GLY 17 -7.017 0.501 -3.365
92 HA3 GLY 17 2HA GLY 17 -7.826 -0.189 -1.966
93 H LYS 18 H LYS 18 -4.449 0.039 -3.096
94 HA LYS 18 HA LYS 18 -3.754 1.114 -0.441
95 HB2 LYS 18 1HB LYS 18 -2.310 -0.868 -2.182
96 HB3 LYS 18 2HB LYS 18 -1.447 0.074 -0.972
97 HG2 LYS 18 1HG LYS 18 -3.276 -0.824 0.643
98 HG3 LYS 18 2HG LYS 18 -3.503 -2.055 -0.601
99 HD2 LYS 18 1HD LYS 18 -1.918 -3.081 0.694
100 HD3 LYS 18 2HD LYS 18 -0.876 -2.216 -0.439
101 HE2 LYS 18 1HE LYS 18 -1.713 -0.841 2.065
102 HE3 LYS 18 2HE LYS 18 -0.482 -2.098 2.169
103 HZ1 LYS 18 3HZ LYS 18 -0.144 0.552 1.405
104 HZ2 LYS 18 1HZ LYS 18 0.111 -0.381 0.017
105 HZ3 LYS 18 2HZ LYS 18 1.018 -0.678 1.413
106 H ALA 19 H ALA 19 -1.510 2.234 -0.553
107 HA ALA 19 HA ALA 19 -1.214 3.732 -3.059
108 HB1 ALA 19 3HB ALA 19 -2.275 5.447 -2.066
109 HB2 ALA 19 1HB ALA 19 -2.020 4.802 -0.444
110 HB3 ALA 19 2HB ALA 19 -0.729 5.692 -1.254
111 H PHE 20 H PHE 20 0.859 4.415 -3.524
112 HA PHE 20 HA PHE 20 2.959 3.764 -1.578
113 HB2 PHE 20 1HB PHE 20 3.255 3.120 -4.507
114 HB3 PHE 20 2HB PHE 20 4.266 2.590 -3.167
115 HD1 PHE 20 HD2 PHE 20 3.562 0.779 -1.716
116 HD2 PHE 20 HD1 PHE 20 1.158 2.040 -4.995
117 HE1 PHE 20 HE2 PHE 20 2.245 -1.291 -1.542
118 HE2 PHE 20 HE1 PHE 20 -0.163 -0.029 -4.825
119 HZ PHE 20 HZ PHE 20 0.380 -1.698 -3.098
120 H ARG 21 H ARG 21 4.118 5.523 -1.202
121 HA ARG 21 HA ARG 21 3.944 7.936 -2.495
122 HB2 ARG 21 1HB ARG 21 5.025 7.562 -0.291
123 HB3 ARG 21 2HB ARG 21 6.409 6.858 -1.117
124 HG2 ARG 21 1HG ARG 21 6.873 8.967 -2.208
125 HG3 ARG 21 2HG ARG 21 5.437 9.685 -1.475
126 HD2 ARG 21 1HD ARG 21 7.531 8.449 0.260
127 HD3 ARG 21 2HD ARG 21 7.789 10.061 -0.406
128 HE ARG 21 HE ARG 21 5.248 9.741 0.899
129 HH11 ARG 21 1HH1 ARG 21 8.617 10.502 1.335
130 HH12 ARG 21 2HH1 ARG 21 8.358 11.409 2.789
131 HH21 ARG 21 1HH2 ARG 21 4.894 10.932 2.811
132 HH22 ARG 21 2HH2 ARG 21 6.240 11.652 3.628
133 H SER 22 H SER 22 6.135 5.256 -3.186
134 HA SER 22 HA SER 22 7.039 6.694 -5.594
135 HB2 SER 22 1HB SER 22 8.756 6.029 -3.797
136 HB3 SER 22 2HB SER 22 8.498 4.372 -4.343
137 HG SER 22 HG SER 22 10.146 5.091 -5.571
138 H LYS 23 H LYS 23 7.821 5.041 -7.327
139 HA LYS 23 HA LYS 23 5.531 3.357 -7.918
140 HB2 LYS 23 1HB LYS 23 6.418 4.829 -9.664
141 HB3 LYS 23 2HB LYS 23 7.978 4.023 -9.567
142 HG2 LYS 23 1HG LYS 23 7.143 2.051 -10.519
143 HG3 LYS 23 2HG LYS 23 5.466 2.534 -10.256
144 HD2 LYS 23 1HD LYS 23 5.507 4.072 -12.006
145 HD3 LYS 23 2HD LYS 23 7.270 4.156 -12.016
146 HE2 LYS 23 1HE LYS 23 5.673 1.722 -12.800
147 HE3 LYS 23 2HE LYS 23 6.298 2.911 -13.942
148 HZ1 LYS 23 3HZ LYS 23 7.795 1.059 -13.812
149 HZ2 LYS 23 1HZ LYS 23 7.901 1.192 -12.129
150 HZ3 LYS 23 2HZ LYS 23 8.544 2.406 -13.114
151 H SER 24 H SER 24 9.056 2.988 -7.635
152 HA SER 24 HA SER 24 9.341 0.319 -8.176
153 HB2 SER 24 1HB SER 24 11.298 0.352 -6.650
154 HB3 SER 24 2HB SER 24 11.251 1.760 -7.711
155 HG SER 24 HG SER 24 10.203 2.855 -5.895
156 H TYR 25 H TYR 25 7.958 1.799 -5.339
157 HA TYR 25 HA TYR 25 7.983 -0.554 -3.719
158 HB2 TYR 25 1HB TYR 25 6.803 2.170 -3.529
159 HB3 TYR 25 2HB TYR 25 6.071 0.904 -2.549
160 HD1 TYR 25 HD2 TYR 25 9.088 2.910 -3.108
161 HD2 TYR 25 HD1 TYR 25 7.276 -0.095 -0.701
162 HE1 TYR 25 HE2 TYR 25 10.859 3.198 -1.426
163 HE2 TYR 25 HE1 TYR 25 9.041 0.186 0.988
164 HH TYR 25 HH TYR 25 11.887 1.588 0.459
165 H LEU 26 H LEU 26 5.563 1.043 -5.752
166 HA LEU 26 HA LEU 26 3.351 -0.515 -5.165
167 HB2 LEU 26 1HB LEU 26 3.003 1.371 -6.506
168 HB3 LEU 26 2HB LEU 26 4.237 0.882 -7.665
169 HG LEU 26 HG LEU 26 2.733 -0.969 -8.387
170 HD11 LEU 26 1HD1 LEU 26 1.405 -1.148 -6.345
171 HD12 LEU 26 2HD1 LEU 26 0.382 -0.881 -7.755
172 HD13 LEU 26 3HD1 LEU 26 0.719 0.448 -6.646
173 HD21 LEU 26 3HD2 LEU 26 2.869 1.191 -9.579
174 HD22 LEU 26 1HD2 LEU 26 1.523 1.785 -8.606
175 HD23 LEU 26 2HD2 LEU 26 1.281 0.433 -9.712
176 H ILE 27 H ILE 27 5.761 -1.049 -7.735
177 HA ILE 27 HA ILE 27 4.814 -3.320 -8.899
178 HB ILE 27 HB ILE 27 7.705 -2.815 -8.184
179 HG12 ILE 27 1HG1 ILE 27 6.541 -2.268 -10.878
180 HG13 ILE 27 2HG1 ILE 27 6.231 -1.112 -9.587
181 HG21 ILE 27 1HG2 ILE 27 8.316 -4.546 -9.492
182 HG22 ILE 27 2HG2 ILE 27 6.697 -5.135 -9.118
183 HG23 ILE 27 3HG2 ILE 27 6.998 -4.286 -10.634
184 HD11 ILE 27 3HD1 ILE 27 8.471 -1.265 -11.240
185 HD12 ILE 27 1HD1 ILE 27 8.241 -0.229 -9.831
186 HD13 ILE 27 2HD1 ILE 27 9.012 -1.805 -9.650
187 H ILE 28 H ILE 28 7.090 -3.336 -6.148
188 HA ILE 28 HA ILE 28 7.266 -5.971 -5.589
189 HB ILE 28 HB ILE 28 6.873 -3.783 -3.546
190 HG12 ILE 28 1HG1 ILE 28 9.486 -5.022 -4.364
191 HG13 ILE 28 2HG1 ILE 28 8.796 -3.693 -5.288
192 HG21 ILE 28 1HG2 ILE 28 7.952 -5.272 -1.961
193 HG22 ILE 28 2HG2 ILE 28 6.490 -6.018 -2.605
194 HG23 ILE 28 3HG2 ILE 28 8.073 -6.526 -3.194
195 HD11 ILE 28 3HD1 ILE 28 10.509 -3.287 -3.335
196 HD12 ILE 28 1HD1 ILE 28 9.179 -2.172 -3.644
197 HD13 ILE 28 2HD1 ILE 28 9.047 -3.365 -2.352
198 H HIS 29 H HIS 29 4.427 -4.024 -5.300
199 HA HIS 29 HA HIS 29 3.015 -6.110 -3.809
200 HB2 HIS 29 1HB HIS 29 2.549 -3.980 -2.908
201 HB3 HIS 29 2HB HIS 29 2.356 -3.255 -4.500
202 HD1 HIS 29 HD1 HIS 29 0.563 -5.505 -2.065
203 HD2 HIS 29 HD2 HIS 29 -0.196 -3.352 -5.537
204 HE1 HIS 29 HE1 HIS 29 -1.932 -5.579 -2.370
205 H MET 30 H MET 30 2.648 -4.201 -6.794
206 HA MET 30 HA MET 30 0.422 -5.261 -7.901
207 HB2 MET 30 1HB MET 30 3.010 -4.361 -9.075
208 HB3 MET 30 2HB MET 30 1.859 -5.165 -10.134
209 HG2 MET 30 1HG MET 30 0.859 -2.961 -8.421
210 HG3 MET 30 2HG MET 30 1.878 -2.545 -9.797
211 HE1 MET 30 3HE MET 30 -1.403 -4.613 -8.788
212 HE2 MET 30 1HE MET 30 -1.868 -5.155 -10.401
213 HE3 MET 30 2HE MET 30 -0.340 -5.687 -9.700
214 H ARG 31 H ARG 31 3.493 -6.871 -7.495
215 HA ARG 31 HA ARG 31 3.276 -8.990 -9.247
216 HB2 ARG 31 1HB ARG 31 4.766 -10.207 -7.786
217 HB3 ARG 31 2HB ARG 31 5.245 -8.516 -7.815
218 HG2 ARG 31 1HG ARG 31 4.035 -8.192 -5.672
219 HG3 ARG 31 2HG ARG 31 3.731 -9.931 -5.633
220 HD2 ARG 31 1HD ARG 31 6.488 -8.736 -5.828
221 HD3 ARG 31 2HD ARG 31 5.712 -9.130 -4.294
222 HE ARG 31 HE ARG 31 5.538 -11.446 -5.662
223 HH11 ARG 31 1HH1 ARG 31 8.182 -9.283 -4.994
224 HH12 ARG 31 2HH1 ARG 31 9.380 -10.535 -5.002
225 HH21 ARG 31 1HH2 ARG 31 7.105 -13.103 -5.676
226 HH22 ARG 31 2HH2 ARG 31 8.766 -12.708 -5.391
227 H THR 32 H THR 32 1.896 -8.676 -5.998
228 HA THR 32 HA THR 32 0.802 -11.261 -5.827
229 HB THR 32 HB THR 32 1.060 -9.443 -3.984
230 HG1 THR 32 HG1 THR 32 -0.576 -10.524 -2.799
231 HG21 THR 32 3HG2 THR 32 -0.559 -7.931 -5.349
232 HG22 THR 32 1HG2 THR 32 -0.703 -7.986 -3.592
233 HG23 THR 32 2HG2 THR 32 -1.822 -8.907 -4.598
234 H HIS 33 H HIS 33 -0.319 -8.343 -7.377
235 HA HIS 33 HA HIS 33 -2.968 -9.439 -7.855
236 HB2 HIS 33 1HB HIS 33 -1.653 -6.810 -8.513
237 HB3 HIS 33 2HB HIS 33 -3.226 -7.250 -9.172
238 HD1 HIS 33 HD1 HIS 33 -4.763 -8.304 -6.890
239 HD2 HIS 33 HD2 HIS 33 -2.096 -5.150 -6.439
240 HE1 HIS 33 HE1 HIS 33 -5.495 -7.096 -4.809
241 H THR 34 H THR 34 -2.230 -11.281 -9.089
242 HA THR 34 HA THR 34 -1.686 -12.419 -10.995
243 HB THR 34 HB THR 34 -2.886 -11.816 -12.919
244 HG1 THR 34 HG1 THR 34 -2.288 -9.817 -13.489
245 HG21 THR 34 3HG2 THR 34 -4.298 -12.161 -10.881
246 HG22 THR 34 1HG2 THR 34 -5.064 -11.188 -12.136
247 HG23 THR 34 2HG2 THR 34 -4.382 -10.408 -10.709
248 H GLY 35 H GLY 35 0.551 -11.276 -10.112
249 HA2 GLY 35 1HA GLY 35 1.762 -10.002 -12.486
250 HA3 GLY 35 2HA GLY 35 2.316 -9.746 -10.838
251 H GLU 36 H GLU 36 3.215 -11.651 -9.706
252 HA GLU 36 HA GLU 36 4.475 -13.534 -11.588
253 HB2 GLU 36 1HB GLU 36 5.694 -11.841 -9.458
254 HB3 GLU 36 2HB GLU 36 6.365 -13.444 -9.725
255 HG2 GLU 36 1HG GLU 36 7.150 -12.923 -11.811
256 HG3 GLU 36 2HG GLU 36 5.951 -11.656 -12.065
257 H LYS 37 H LYS 37 2.092 -14.043 -10.191
258 HA LYS 37 HA LYS 37 2.715 -16.514 -8.969
259 HB2 LYS 37 1HB LYS 37 3.218 -14.629 -7.188
260 HB3 LYS 37 2HB LYS 37 1.472 -14.665 -6.978
261 HG2 LYS 37 1HG LYS 37 3.052 -17.199 -6.874
262 HG3 LYS 37 2HG LYS 37 2.968 -16.135 -5.468
263 HD2 LYS 37 1HD LYS 37 0.426 -16.850 -6.836
264 HD3 LYS 37 2HD LYS 37 1.217 -18.087 -5.855
265 HE2 LYS 37 1HE LYS 37 0.669 -15.315 -4.826
266 HE3 LYS 37 2HE LYS 37 -0.510 -16.619 -4.696
267 HZ1 LYS 37 3HZ LYS 37 1.862 -16.146 -3.157
268 HZ2 LYS 37 1HZ LYS 37 1.782 -17.729 -3.750
269 HZ3 LYS 37 2HZ LYS 37 0.522 -17.116 -2.803
270 HA PRO 38 HA PRO 38 -1.447 -17.083 -10.325
271 HB2 PRO 38 1HB PRO 38 -1.879 -19.521 -9.213
272 HB3 PRO 38 2HB PRO 38 -0.872 -19.284 -10.646
273 HG2 PRO 38 1HG PRO 38 -0.048 -19.623 -7.788
274 HG3 PRO 38 2HG PRO 38 0.656 -20.341 -9.248
275 HD2 PRO 38 1HD PRO 38 1.747 -18.195 -8.009
276 HD3 PRO 38 2HD PRO 38 1.844 -18.435 -9.765
277 H SER 39 H SER 39 -3.299 -16.316 -9.534
278 HA SER 39 HA SER 39 -3.674 -15.414 -6.954
279 HB2 SER 39 1HB SER 39 -5.757 -16.269 -8.976
280 HB3 SER 39 2HB SER 39 -6.110 -15.355 -7.511
281 HG SER 39 HG SER 39 -4.812 -14.554 -9.848
282 H GLY 40 H GLY 40 -5.736 -16.208 -5.633
283 HA2 GLY 40 1HA GLY 40 -5.749 -19.127 -5.406
284 HA3 GLY 40 2HA GLY 40 -5.215 -18.206 -4.008
285 HA PRO 41 HA PRO 41 -9.441 -18.256 -2.740
286 HB2 PRO 41 1HB PRO 41 -9.241 -16.423 -0.747
287 HB3 PRO 41 2HB PRO 41 -8.632 -18.076 -0.597
288 HG2 PRO 41 1HG PRO 41 -7.141 -15.559 -1.230
289 HG3 PRO 41 2HG PRO 41 -6.687 -16.885 -0.145
290 HD2 PRO 41 1HD PRO 41 -5.676 -16.638 -2.645
291 HD3 PRO 41 2HD PRO 41 -5.945 -18.215 -1.875
292 H SER 42 H SER 42 -11.148 -16.526 -2.132
293 HA SER 42 HA SER 42 -11.022 -14.417 -4.178
294 HB2 SER 42 1HB SER 42 -13.385 -14.526 -4.350
295 HB3 SER 42 2HB SER 42 -12.850 -16.204 -4.267
296 HG SER 42 HG SER 42 -14.007 -16.405 -2.538
297 H SER 43 H SER 43 -12.667 -12.557 -3.536
298 HA SER 43 HA SER 43 -11.696 -11.543 -0.967
299 HB2 SER 43 1HB SER 43 -11.530 -10.269 -3.232
300 HB3 SER 43 2HB SER 43 -13.236 -9.909 -2.966
301 HG SER 43 HG SER 43 -11.502 -9.469 -0.835
302 H GLY 44 H GLY 44 -14.714 -11.943 -2.795
303 HA2 GLY 44 1HA GLY 44 -16.627 -10.865 -1.273
304 HA3 GLY 44 2HA GLY 44 -16.815 -12.476 -1.949