Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
28180 | 2ys0 RC | 11150 | cing | 1-original | 4 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 H1 GLY 1 H GLY 1 10.864 17.810 11.800
2 HA2 GLY 1 1HA GLY 1 11.615 18.824 9.696
3 HA3 GLY 1 2HA GLY 1 11.563 17.075 9.524
4 H SER 2 H SER 2 11.441 17.976 7.206
5 HA SER 2 HA SER 2 9.059 19.125 6.247
6 HB2 SER 2 1HB SER 2 11.124 17.421 4.839
7 HB3 SER 2 2HB SER 2 9.825 18.283 4.015
8 HG SER 2 HG SER 2 10.767 20.182 5.245
9 H SER 3 H SER 3 7.373 18.153 4.985
10 HA SER 3 HA SER 3 6.216 15.898 6.204
11 HB2 SER 3 1HB SER 3 4.880 17.631 5.091
12 HB3 SER 3 2HB SER 3 5.558 17.163 3.532
13 HG SER 3 HG SER 3 4.090 15.680 3.436
14 H GLY 4 H GLY 4 7.764 16.280 3.019
15 HA2 GLY 4 1HA GLY 4 9.306 14.246 2.633
16 HA3 GLY 4 2HA GLY 4 7.800 13.349 2.756
17 H SER 5 H SER 5 9.209 13.015 0.509
18 HA SER 5 HA SER 5 8.252 14.866 -1.521
19 HB2 SER 5 1HB SER 5 9.664 13.647 -3.059
20 HB3 SER 5 2HB SER 5 10.579 13.948 -1.583
21 HG SER 5 HG SER 5 10.920 11.854 -1.836
22 H SER 6 H SER 6 7.484 13.728 -3.630
23 HA SER 6 HA SER 6 4.971 12.601 -3.124
24 HB2 SER 6 1HB SER 6 4.842 12.222 -5.540
25 HB3 SER 6 2HB SER 6 5.534 13.809 -5.204
26 HG SER 6 HG SER 6 6.578 12.169 -6.786
27 H GLY 7 H GLY 7 4.277 10.575 -2.817
28 HA2 GLY 7 1HA GLY 7 6.155 8.370 -3.389
29 HA3 GLY 7 2HA GLY 7 5.286 8.455 -1.864
30 H TRP 8 H TRP 8 4.815 8.235 -5.370
31 HA TRP 8 HA TRP 8 2.091 7.326 -5.055
32 HB2 TRP 8 1HB TRP 8 3.888 7.682 -7.452
33 HB3 TRP 8 2HB TRP 8 2.268 6.999 -7.574
34 HD1 TRP 8 HD1 TRP 8 4.012 10.212 -7.787
35 HE1 TRP 8 HE1 TRP 8 2.353 12.175 -7.657
36 HE3 TRP 8 HE3 TRP 8 -0.108 7.681 -6.129
37 HZ2 TRP 8 HZ2 TRP 8 -0.346 12.595 -6.946
38 HZ3 TRP 8 HZ3 TRP 8 -2.189 8.937 -5.747
39 HH2 TRP 8 HH2 TRP 8 -2.304 11.343 -6.148
40 H THR 9 H THR 9 3.848 5.676 -3.676
41 HA THR 9 HA THR 9 3.415 3.155 -5.093
42 HB THR 9 HB THR 9 5.648 2.312 -4.434
43 HG1 THR 9 HG1 THR 9 5.833 4.911 -3.397
44 HG21 THR 9 3HG2 THR 9 5.525 4.729 -6.228
45 HG22 THR 9 1HG2 THR 9 5.458 3.029 -6.689
46 HG23 THR 9 2HG2 THR 9 6.963 3.719 -6.081
47 H CYS 10 H CYS 10 3.614 1.263 -3.650
48 HA CYS 10 HA CYS 10 3.033 1.958 -0.845
49 HB2 CYS 10 1HB CYS 10 1.606 0.105 -2.717
50 HB3 CYS 10 2HB CYS 10 1.614 -0.247 -0.992
51 H ASN 11 H ASN 11 3.461 0.215 0.704
52 HA ASN 11 HA ASN 11 5.696 -1.488 -0.184
53 HB2 ASN 11 1HB ASN 11 6.114 0.460 1.487
54 HB3 ASN 11 2HB ASN 11 5.339 -0.599 2.663
55 HD21 ASN 11 1HD2 ASN 11 8.219 0.393 1.696
56 HD22 ASN 11 2HD2 ASN 11 9.172 -1.016 1.997
57 H LYS 12 H LYS 12 5.851 -3.585 0.658
58 HA LYS 12 HA LYS 12 3.647 -5.144 0.779
59 HB2 LYS 12 1HB LYS 12 6.119 -5.828 0.845
60 HB3 LYS 12 2HB LYS 12 5.988 -5.698 2.594
61 HG2 LYS 12 1HG LYS 12 4.626 -7.531 2.769
62 HG3 LYS 12 2HG LYS 12 4.007 -7.365 1.125
63 HD2 LYS 12 1HD LYS 12 6.899 -7.956 1.475
64 HD3 LYS 12 2HD LYS 12 5.744 -9.255 1.782
65 HE2 LYS 12 1HE LYS 12 6.301 -9.476 -0.484
66 HE3 LYS 12 2HE LYS 12 4.738 -8.661 -0.486
67 HZ1 LYS 12 3HZ LYS 12 5.740 -6.616 -0.995
68 HZ2 LYS 12 1HZ LYS 12 6.493 -7.735 -2.017
69 HZ3 LYS 12 2HZ LYS 12 7.295 -7.178 -0.637
70 H PHE 13 H PHE 13 5.260 -3.764 3.643
71 HA PHE 13 HA PHE 13 3.419 -4.717 5.532
72 HB2 PHE 13 1HB PHE 13 5.205 -2.278 5.616
73 HB3 PHE 13 2HB PHE 13 4.333 -2.920 7.005
74 HD1 PHE 13 HD2 PHE 13 4.920 -5.158 7.898
75 HD2 PHE 13 HD1 PHE 13 7.227 -3.248 4.874
76 HE1 PHE 13 HE2 PHE 13 6.795 -6.678 8.374
77 HE2 PHE 13 HE1 PHE 13 9.106 -4.765 5.344
78 HZ PHE 13 HZ PHE 13 8.892 -6.483 7.097
79 H ARG 14 H ARG 14 3.605 -1.578 3.876
80 HA ARG 14 HA ARG 14 1.558 -0.211 5.045
81 HB2 ARG 14 1HB ARG 14 2.229 -0.325 2.098
82 HB3 ARG 14 2HB ARG 14 1.203 0.895 2.841
83 HG2 ARG 14 1HG ARG 14 4.019 0.440 3.759
84 HG3 ARG 14 2HG ARG 14 3.639 1.497 2.398
85 HD2 ARG 14 1HD ARG 14 2.402 1.784 5.128
86 HD3 ARG 14 2HD ARG 14 3.859 2.641 4.626
87 HE ARG 14 HE ARG 14 1.174 3.293 3.943
88 HH11 ARG 14 1HH1 ARG 14 4.442 3.336 2.744
89 HH12 ARG 14 2HH1 ARG 14 4.168 4.666 1.667
90 HH21 ARG 14 1HH2 ARG 14 0.801 5.043 2.530
91 HH22 ARG 14 2HH2 ARG 14 2.097 5.637 1.547
92 H CYS 15 H CYS 15 1.286 -2.729 2.579
93 HA CYS 15 HA CYS 15 -1.381 -2.559 1.931
94 HB2 CYS 15 1HB CYS 15 0.148 -5.132 2.370
95 HB3 CYS 15 2HB CYS 15 -1.280 -4.920 1.362
96 H GLY 16 H GLY 16 -3.244 -2.819 2.983
97 HA2 GLY 16 1HA GLY 16 -4.771 -3.573 4.545
98 HA3 GLY 16 2HA GLY 16 -3.544 -4.675 5.152
99 H GLU 17 H GLU 17 -3.294 -1.161 4.885
100 HA GLU 17 HA GLU 17 -2.854 -1.059 7.785
101 HB2 GLU 17 1HB GLU 17 -1.772 1.107 7.361
102 HB3 GLU 17 2HB GLU 17 -1.029 -0.186 6.429
103 HG2 GLU 17 1HG GLU 17 -1.164 1.410 4.824
104 HG3 GLU 17 2HG GLU 17 -2.727 0.629 4.588
105 H LYS 18 H LYS 18 -3.699 0.800 8.971
106 HA LYS 18 HA LYS 18 -6.131 1.954 7.794
107 HB2 LYS 18 1HB LYS 18 -5.924 0.774 10.572
108 HB3 LYS 18 2HB LYS 18 -7.328 1.604 9.914
109 HG2 LYS 18 1HG LYS 18 -6.262 -0.754 8.451
110 HG3 LYS 18 2HG LYS 18 -7.175 -1.016 9.939
111 HD2 LYS 18 1HD LYS 18 -8.958 0.490 8.928
112 HD3 LYS 18 2HD LYS 18 -8.084 0.326 7.404
113 HE2 LYS 18 1HE LYS 18 -8.248 -2.234 7.947
114 HE3 LYS 18 2HE LYS 18 -9.595 -1.721 8.962
115 HZ1 LYS 18 3HZ LYS 18 -10.730 -0.854 7.107
116 HZ2 LYS 18 1HZ LYS 18 -10.168 -2.375 6.621
117 HZ3 LYS 18 2HZ LYS 18 -9.373 -0.973 6.104
118 H ARG 19 H ARG 19 -3.538 3.124 8.106
119 HA ARG 19 HA ARG 19 -4.302 5.440 9.689
120 HB2 ARG 19 1HB ARG 19 -1.762 3.884 10.195
121 HB3 ARG 19 2HB ARG 19 -2.064 5.504 10.806
122 HG2 ARG 19 1HG ARG 19 -2.681 4.283 12.621
123 HG3 ARG 19 2HG ARG 19 -4.230 4.364 11.780
124 HD2 ARG 19 1HD ARG 19 -3.302 2.164 10.635
125 HD3 ARG 19 2HD ARG 19 -2.366 2.076 12.126
126 HE ARG 19 HE ARG 19 -5.201 2.509 12.481
127 HH11 ARG 19 1HH1 ARG 19 -2.620 0.186 12.242
128 HH12 ARG 19 2HH1 ARG 19 -3.490 -1.060 13.073
129 HH21 ARG 19 1HH2 ARG 19 -6.357 0.877 13.578
130 HH22 ARG 19 2HH2 ARG 19 -5.615 -0.667 13.832
131 H LEU 20 H LEU 20 -4.204 6.962 8.166
132 HA LEU 20 HA LEU 20 -1.672 7.371 6.774
133 HB2 LEU 20 1HB LEU 20 -2.552 7.419 4.626
134 HB3 LEU 20 2HB LEU 20 -3.311 6.007 5.360
135 HG LEU 20 HG LEU 20 -4.641 8.700 5.076
136 HD11 LEU 20 1HD1 LEU 20 -4.910 6.219 3.384
137 HD12 LEU 20 2HD1 LEU 20 -4.212 7.758 2.883
138 HD13 LEU 20 3HD1 LEU 20 -5.930 7.655 3.269
139 HD21 LEU 20 3HD2 LEU 20 -6.211 7.870 6.402
140 HD22 LEU 20 1HD2 LEU 20 -5.258 6.403 6.618
141 HD23 LEU 20 2HD2 LEU 20 -6.432 6.507 5.306
142 H THR 21 H THR 21 -1.108 9.453 6.743
143 HA THR 21 HA THR 21 -3.206 11.484 7.122
144 HB THR 21 HB THR 21 -2.084 11.195 9.262
145 HG1 THR 21 HG1 THR 21 -1.132 13.576 8.018
146 HG21 THR 21 3HG2 THR 21 0.027 10.265 8.519
147 HG22 THR 21 1HG2 THR 21 0.327 11.710 9.484
148 HG23 THR 21 2HG2 THR 21 0.449 11.783 7.726
149 H ARG 22 H ARG 22 0.086 10.799 6.021
150 HA ARG 22 HA ARG 22 -0.203 12.983 4.069
151 HB2 ARG 22 1HB ARG 22 2.311 12.245 5.578
152 HB3 ARG 22 2HB ARG 22 2.212 13.440 4.293
153 HG2 ARG 22 1HG ARG 22 0.584 13.651 6.804
154 HG3 ARG 22 2HG ARG 22 2.217 14.306 6.673
155 HD2 ARG 22 1HD ARG 22 1.593 15.887 5.094
156 HD3 ARG 22 2HD ARG 22 0.148 14.992 4.626
157 HE ARG 22 HE ARG 22 0.132 15.979 7.338
158 HH11 ARG 22 1HH1 ARG 22 -0.674 16.626 4.015
159 HH12 ARG 22 2HH1 ARG 22 -1.882 17.806 4.401
160 HH21 ARG 22 1HH2 ARG 22 -1.456 17.530 7.861
161 HH22 ARG 22 2HH2 ARG 22 -2.325 18.321 6.589
162 H SER 23 H SER 23 -0.933 11.281 2.642
163 HA SER 23 HA SER 23 1.282 10.078 1.216
164 HB2 SER 23 1HB SER 23 -0.826 8.447 2.617
165 HB3 SER 23 2HB SER 23 -0.002 7.835 1.183
166 HG SER 23 HG SER 23 0.993 7.252 3.218
167 H LEU 24 H LEU 24 0.944 10.298 -0.893
168 HA LEU 24 HA LEU 24 -1.326 11.499 -1.973
169 HB2 LEU 24 1HB LEU 24 0.875 9.880 -3.226
170 HB3 LEU 24 2HB LEU 24 -0.405 10.627 -4.179
171 HG LEU 24 HG LEU 24 1.311 12.268 -2.346
172 HD11 LEU 24 1HD1 LEU 24 2.453 10.754 -4.279
173 HD12 LEU 24 2HD1 LEU 24 3.064 12.320 -3.745
174 HD13 LEU 24 3HD1 LEU 24 2.052 12.214 -5.185
175 HD21 LEU 24 3HD2 LEU 24 -0.857 12.764 -4.109
176 HD22 LEU 24 1HD2 LEU 24 0.583 13.525 -4.785
177 HD23 LEU 24 2HD2 LEU 24 0.066 13.919 -3.146
178 H CYS 25 H CYS 25 -0.372 8.078 -1.954
179 HA CYS 25 HA CYS 25 -3.078 7.383 -2.874
180 HB2 CYS 25 1HB CYS 25 -2.196 5.324 -3.697
181 HB3 CYS 25 2HB CYS 25 -1.099 6.595 -4.229
182 H ALA 26 H ALA 26 -3.716 5.087 -2.030
183 HA ALA 26 HA ALA 26 -3.180 4.999 0.868
184 HB1 ALA 26 3HB ALA 26 -5.789 4.374 -0.511
185 HB2 ALA 26 1HB ALA 26 -5.477 4.281 1.223
186 HB3 ALA 26 2HB ALA 26 -5.431 5.841 0.401
187 H CYS 27 H CYS 27 -2.419 3.132 1.625
188 HA CYS 27 HA CYS 27 -2.415 0.807 -0.164
189 HB2 CYS 27 1HB CYS 27 -0.788 1.185 2.354
190 HB3 CYS 27 2HB CYS 27 -0.535 -0.005 1.080
191 H SER 28 H SER 28 -4.819 1.384 1.144
192 HA SER 28 HA SER 28 -4.969 -0.822 3.093
193 HB2 SER 28 1HB SER 28 -5.394 1.252 4.252
194 HB3 SER 28 2HB SER 28 -6.547 1.759 3.018
195 HG SER 28 HG SER 28 -7.994 0.315 3.752
196 H ASP 29 H ASP 29 -6.978 -2.014 3.128
197 HA ASP 29 HA ASP 29 -7.804 -2.937 0.659
198 HB2 ASP 29 1HB ASP 29 -9.097 -3.033 3.374
199 HB3 ASP 29 2HB ASP 29 -9.871 -3.764 1.970
200 H ASP 30 H ASP 30 -9.371 -0.521 2.734
201 HA ASP 30 HA ASP 30 -11.701 -0.030 1.438
202 HB2 ASP 30 1HB ASP 30 -11.066 1.211 3.422
203 HB3 ASP 30 2HB ASP 30 -9.773 2.022 2.542
204 H CYS 31 H CYS 31 -8.526 1.263 0.507
205 HA CYS 31 HA CYS 31 -9.148 2.924 -1.547
206 HB2 CYS 31 1HB CYS 31 -6.977 2.647 -2.335
207 HB3 CYS 31 2HB CYS 31 -6.837 2.118 -0.661
208 H LYS 32 H LYS 32 -9.158 -0.599 -1.625
209 HA LYS 32 HA LYS 32 -9.503 -0.967 -4.375
210 HB2 LYS 32 1HB LYS 32 -10.390 -2.617 -2.011
211 HB3 LYS 32 2HB LYS 32 -10.605 -3.146 -3.674
212 HG2 LYS 32 1HG LYS 32 -8.208 -3.097 -4.029
213 HG3 LYS 32 2HG LYS 32 -7.962 -2.487 -2.391
214 HD2 LYS 32 1HD LYS 32 -7.563 -4.749 -2.125
215 HD3 LYS 32 2HD LYS 32 -9.268 -4.626 -1.687
216 HE2 LYS 32 1HE LYS 32 -9.852 -5.259 -4.018
217 HE3 LYS 32 2HE LYS 32 -8.136 -5.502 -4.343
218 HZ1 LYS 32 3HZ LYS 32 -9.578 -6.933 -2.186
219 HZ2 LYS 32 1HZ LYS 32 -8.052 -7.285 -2.826
220 HZ3 LYS 32 2HZ LYS 32 -9.440 -7.546 -3.757
221 H ASP 33 H ASP 33 -11.956 -0.764 -1.800
222 HA ASP 33 HA ASP 33 -14.165 -0.882 -3.582
223 HB2 ASP 33 1HB ASP 33 -14.015 0.161 -0.744
224 HB3 ASP 33 2HB ASP 33 -15.501 -0.185 -1.625
225 H GLN 34 H GLN 34 -12.701 1.823 -1.780
226 HA GLN 34 HA GLN 34 -14.337 3.835 -2.848
227 HB2 GLN 34 1HB GLN 34 -11.660 3.792 -1.518
228 HB3 GLN 34 2HB GLN 34 -12.212 5.281 -2.272
229 HG2 GLN 34 1HG GLN 34 -14.042 3.871 -0.403
230 HG3 GLN 34 2HG GLN 34 -12.677 4.771 0.258
231 HE21 GLN 34 1HE2 GLN 34 -13.402 6.630 1.001
232 HE22 GLN 34 2HE2 GLN 34 -14.490 7.696 0.187
233 H GLY 35 H GLY 35 -10.936 3.134 -3.697
234 HA2 GLY 35 1HA GLY 35 -10.518 2.774 -6.135
235 HA3 GLY 35 2HA GLY 35 -11.530 4.187 -6.394
236 H ASP 36 H ASP 36 -8.971 3.641 -3.997
237 HA ASP 36 HA ASP 36 -7.360 5.710 -5.318
238 HB2 ASP 36 1HB ASP 36 -8.007 5.617 -2.363
239 HB3 ASP 36 2HB ASP 36 -6.851 6.715 -3.112
240 H CYS 37 H CYS 37 -6.943 2.973 -5.521
241 HA CYS 37 HA CYS 37 -4.926 2.195 -3.596
242 HB2 CYS 37 1HB CYS 37 -5.835 0.819 -6.133
243 HB3 CYS 37 2HB CYS 37 -4.793 0.118 -4.898
244 H CYS 38 H CYS 38 -2.799 2.465 -3.800
245 HA CYS 38 HA CYS 38 -1.569 4.159 -5.529
246 HB2 CYS 38 1HB CYS 38 -0.205 1.661 -4.524
247 HB3 CYS 38 2HB CYS 38 0.524 3.228 -4.859
248 H ILE 39 H ILE 39 -0.173 3.878 -7.365
249 HA ILE 39 HA ILE 39 -1.312 2.519 -9.493
250 HB ILE 39 HB ILE 39 0.275 4.360 -9.791
251 HG12 ILE 39 1HG1 ILE 39 1.818 3.022 -11.501
252 HG13 ILE 39 2HG1 ILE 39 0.676 1.732 -11.142
253 HG21 ILE 39 1HG2 ILE 39 1.840 3.769 -8.012
254 HG22 ILE 39 2HG2 ILE 39 2.377 2.372 -8.943
255 HG23 ILE 39 3HG2 ILE 39 2.676 4.001 -9.547
256 HD11 ILE 39 3HD1 ILE 39 -0.946 2.680 -12.342
257 HD12 ILE 39 1HD1 ILE 39 -0.577 4.300 -11.751
258 HD13 ILE 39 2HD1 ILE 39 0.362 3.608 -13.075
259 H ASN 40 H ASN 40 1.378 1.532 -7.404
260 HA ASN 40 HA ASN 40 1.300 -1.131 -8.651
261 HB2 ASN 40 1HB ASN 40 3.537 -1.427 -7.482
262 HB3 ASN 40 2HB ASN 40 3.503 -0.243 -8.786
263 HD21 ASN 40 1HD2 ASN 40 4.484 -0.810 -5.690
264 HD22 ASN 40 2HD2 ASN 40 4.705 0.820 -5.160
265 H TYR 41 H TYR 41 -0.734 -0.486 -6.872
266 HA TYR 41 HA TYR 41 -0.153 -1.333 -4.216
267 HB2 TYR 41 1HB TYR 41 -2.059 0.111 -4.663
268 HB3 TYR 41 2HB TYR 41 -2.785 -1.118 -5.693
269 HD1 TYR 41 HD2 TYR 41 -3.825 -3.100 -4.723
270 HD2 TYR 41 HD1 TYR 41 -2.129 -0.082 -2.250
271 HE1 TYR 41 HE2 TYR 41 -5.008 -4.036 -2.781
272 HE2 TYR 41 HE1 TYR 41 -3.306 -1.011 -0.300
273 HH TYR 41 HH TYR 41 -5.499 -3.782 -0.626
274 H SER 42 H SER 42 -1.635 -2.916 -7.025
275 HA SER 42 HA SER 42 -2.041 -5.404 -5.687
276 HB2 SER 42 1HB SER 42 -3.468 -4.979 -7.533
277 HB3 SER 42 2HB SER 42 -2.113 -4.575 -8.587
278 HG SER 42 HG SER 42 -2.468 -6.601 -9.164
279 H SER 43 H SER 43 0.478 -4.076 -7.757
280 HA SER 43 HA SER 43 1.917 -6.429 -8.238
281 HB2 SER 43 1HB SER 43 2.367 -4.378 -9.476
282 HB3 SER 43 2HB SER 43 2.917 -3.580 -8.003
283 HG SER 43 HG SER 43 4.801 -4.320 -8.560
284 H VAL 44 H VAL 44 2.036 -4.139 -5.555
285 HA VAL 44 HA VAL 44 4.178 -5.611 -4.256
286 HB VAL 44 HB VAL 44 2.609 -3.210 -3.303
287 HG11 VAL 44 1HG1 VAL 44 4.205 -4.988 -1.840
288 HG12 VAL 44 2HG1 VAL 44 5.192 -3.547 -2.093
289 HG13 VAL 44 3HG1 VAL 44 3.608 -3.410 -1.329
290 HG21 VAL 44 3HG2 VAL 44 3.862 -2.534 -5.183
291 HG22 VAL 44 1HG2 VAL 44 4.820 -2.054 -3.781
292 HG23 VAL 44 2HG2 VAL 44 5.259 -3.496 -4.698
293 H CYS 45 H CYS 45 0.809 -4.720 -3.511
294 HA CYS 45 HA CYS 45 0.670 -6.400 -1.210
295 HB2 CYS 45 1HB CYS 45 -1.580 -5.199 -2.837
296 HB3 CYS 45 2HB CYS 45 -1.718 -5.869 -1.215
297 H GLN 46 H GLN 46 -0.994 -6.621 -4.361
298 HA GLN 46 HA GLN 46 -1.698 -9.371 -3.896
299 HB2 GLN 46 1HB GLN 46 -2.110 -7.426 -6.139
300 HB3 GLN 46 2HB GLN 46 -2.402 -9.141 -6.401
301 HG2 GLN 46 1HG GLN 46 -3.665 -7.731 -4.091
302 HG3 GLN 46 2HG GLN 46 -4.358 -7.604 -5.707
303 HE21 GLN 46 1HE2 GLN 46 -6.182 -8.630 -4.544
304 HE22 GLN 46 2HE2 GLN 46 -6.222 -10.356 -4.468
305 H GLY 47 H GLY 47 0.989 -9.262 -3.659
306 HA2 GLY 47 1HA GLY 47 2.296 -9.868 -6.158
307 HA3 GLY 47 2HA GLY 47 3.012 -9.953 -4.555
308 H GLU 48 H GLU 48 3.932 -11.939 -4.616
309 HA GLU 48 HA GLU 48 2.109 -14.216 -5.027
310 HB2 GLU 48 1HB GLU 48 3.985 -13.757 -6.786
311 HB3 GLU 48 2HB GLU 48 5.049 -14.433 -5.562
312 HG2 GLU 48 1HG GLU 48 2.703 -15.794 -6.863
313 HG3 GLU 48 2HG GLU 48 4.411 -16.149 -7.115
314 H LYS 49 H LYS 49 1.690 -14.303 -2.788
315 HA LYS 49 HA LYS 49 3.938 -15.357 -1.202
316 HB2 LYS 49 1HB LYS 49 3.157 -13.023 -0.560
317 HB3 LYS 49 2HB LYS 49 1.647 -13.767 -0.051
318 HG2 LYS 49 1HG LYS 49 2.905 -15.172 1.534
319 HG3 LYS 49 2HG LYS 49 4.388 -14.343 1.055
320 HD2 LYS 49 1HD LYS 49 2.009 -12.813 2.053
321 HD3 LYS 49 2HD LYS 49 3.160 -13.542 3.176
322 HE2 LYS 49 1HE LYS 49 4.873 -12.143 2.535
323 HE3 LYS 49 2HE LYS 49 4.181 -11.852 0.939
324 HZ1 LYS 49 3HZ LYS 49 2.349 -10.644 2.207
325 HZ2 LYS 49 1HZ LYS 49 3.851 -9.874 2.086
326 HZ3 LYS 49 2HZ LYS 49 3.412 -10.648 3.524
327 H SER 50 H SER 50 3.489 -17.503 -1.358
328 HA SER 50 HA SER 50 1.324 -18.523 0.204
329 HB2 SER 50 1HB SER 50 0.071 -18.095 -1.844
330 HB3 SER 50 2HB SER 50 1.265 -18.985 -2.789
331 HG SER 50 HG SER 50 -0.873 -19.953 -1.635
332 H SER 51 H SER 51 2.213 -20.157 1.258
333 HA SER 51 HA SER 51 3.654 -21.835 1.827
334 HB2 SER 51 1HB SER 51 2.085 -23.050 0.360
335 HB3 SER 51 2HB SER 51 3.103 -22.675 -1.031
336 HG SER 51 HG SER 51 4.523 -24.131 -0.406
337 H GLY 52 H GLY 52 5.007 -19.527 1.129
338 HA2 GLY 52 1HA GLY 52 7.470 -20.679 0.008
339 HA3 GLY 52 2HA GLY 52 6.862 -19.163 -0.641
340 HA PRO 53 HA PRO 53 9.418 -18.715 3.422
341 HB2 PRO 53 1HB PRO 53 11.948 -18.548 2.451
342 HB3 PRO 53 2HB PRO 53 11.221 -20.069 2.985
343 HG2 PRO 53 1HG PRO 53 11.529 -18.986 0.210
344 HG3 PRO 53 2HG PRO 53 11.794 -20.636 0.804
345 HD2 PRO 53 1HD PRO 53 9.537 -19.903 -0.499
346 HD3 PRO 53 2HD PRO 53 9.547 -21.146 0.769
347 H SER 54 H SER 54 10.261 -17.401 0.218
348 HA SER 54 HA SER 54 9.723 -14.713 1.178
349 HB2 SER 54 1HB SER 54 12.074 -14.939 1.739
350 HB3 SER 54 2HB SER 54 12.439 -15.528 0.118
351 HG SER 54 HG SER 54 11.564 -12.937 0.866
352 H SER 55 H SER 55 8.818 -13.497 -0.366
353 HA SER 55 HA SER 55 8.398 -14.658 -2.973
354 HB2 SER 55 1HB SER 55 7.468 -12.010 -1.838
355 HB3 SER 55 2HB SER 55 6.917 -12.727 -3.351
356 HG SER 55 HG SER 55 6.197 -14.538 -2.047
357 H GLY 56 H GLY 56 11.054 -14.246 -2.762
358 HA2 GLY 56 1HA GLY 56 12.048 -11.751 -3.555
359 HA3 GLY 56 2HA GLY 56 12.839 -13.295 -3.842
Start of MODEL 2
1 H1 GLY 1 H GLY 1 14.715 19.977 8.241
2 HA2 GLY 1 1HA GLY 1 12.263 19.335 9.639
3 HA3 GLY 1 2HA GLY 1 12.030 19.900 7.992
4 H SER 2 H SER 2 11.478 17.273 9.213
5 HA SER 2 HA SER 2 13.409 15.406 8.276
6 HB2 SER 2 1HB SER 2 11.761 13.708 8.806
7 HB3 SER 2 2HB SER 2 11.759 14.923 10.084
8 HG SER 2 HG SER 2 9.973 15.064 7.903
9 H SER 3 H SER 3 13.725 14.616 6.302
10 HA SER 3 HA SER 3 12.590 15.642 4.011
11 HB2 SER 3 1HB SER 3 13.937 12.988 4.518
12 HB3 SER 3 2HB SER 3 13.437 13.499 2.906
13 HG SER 3 HG SER 3 15.091 14.788 2.828
14 H GLY 4 H GLY 4 11.010 14.951 2.556
15 HA2 GLY 4 1HA GLY 4 9.357 12.660 3.168
16 HA3 GLY 4 2HA GLY 4 8.569 14.206 3.451
17 H SER 5 H SER 5 10.210 12.274 0.980
18 HA SER 5 HA SER 5 9.261 13.937 -1.169
19 HB2 SER 5 1HB SER 5 10.275 12.222 -2.632
20 HB3 SER 5 2HB SER 5 11.397 12.762 -1.382
21 HG SER 5 HG SER 5 11.314 10.848 -0.455
22 H SER 6 H SER 6 7.492 13.674 -2.403
23 HA SER 6 HA SER 6 5.445 11.881 -1.506
24 HB2 SER 6 1HB SER 6 4.093 12.888 -3.317
25 HB3 SER 6 2HB SER 6 4.868 14.116 -2.316
26 HG SER 6 HG SER 6 5.980 13.171 -4.744
27 H GLY 7 H GLY 7 5.123 9.859 -2.145
28 HA2 GLY 7 1HA GLY 7 6.226 9.034 -4.761
29 HA3 GLY 7 2HA GLY 7 6.291 8.007 -3.336
30 H TRP 8 H TRP 8 5.242 6.760 -5.337
31 HA TRP 8 HA TRP 8 2.330 6.901 -4.906
32 HB2 TRP 8 1HB TRP 8 3.871 6.524 -7.460
33 HB3 TRP 8 2HB TRP 8 2.228 5.908 -7.300
34 HD1 TRP 8 HD1 TRP 8 4.185 9.208 -7.418
35 HE1 TRP 8 HE1 TRP 8 2.543 11.110 -7.971
36 HE3 TRP 8 HE3 TRP 8 -0.200 6.590 -7.175
37 HZ2 TRP 8 HZ2 TRP 8 -0.243 11.456 -8.264
38 HZ3 TRP 8 HZ3 TRP 8 -2.310 7.782 -7.606
39 HH2 TRP 8 HH2 TRP 8 -2.328 10.164 -8.138
40 H THR 9 H THR 9 5.038 4.813 -5.867
41 HA THR 9 HA THR 9 3.841 2.352 -5.878
42 HB THR 9 HB THR 9 6.001 1.387 -5.194
43 HG1 THR 9 HG1 THR 9 7.500 2.577 -4.228
44 HG21 THR 9 3HG2 THR 9 7.361 2.326 -6.994
45 HG22 THR 9 1HG2 THR 9 6.297 3.729 -7.080
46 HG23 THR 9 2HG2 THR 9 5.688 2.132 -7.512
47 H CYS 10 H CYS 10 3.975 0.596 -4.235
48 HA CYS 10 HA CYS 10 3.376 1.638 -1.543
49 HB2 CYS 10 1HB CYS 10 2.077 -0.572 -3.122
50 HB3 CYS 10 2HB CYS 10 1.946 -0.499 -1.367
51 H ASN 11 H ASN 11 4.095 0.455 0.238
52 HA ASN 11 HA ASN 11 6.249 -1.452 -0.374
53 HB2 ASN 11 1HB ASN 11 6.653 0.765 0.930
54 HB3 ASN 11 2HB ASN 11 5.916 -0.089 2.283
55 HD21 ASN 11 1HD2 ASN 11 7.332 -0.958 3.592
56 HD22 ASN 11 2HD2 ASN 11 8.872 -1.609 3.153
57 H LYS 12 H LYS 12 6.449 -3.370 0.810
58 HA LYS 12 HA LYS 12 4.305 -4.938 1.222
59 HB2 LYS 12 1HB LYS 12 6.950 -4.886 2.641
60 HB3 LYS 12 2HB LYS 12 5.736 -6.086 3.064
61 HG2 LYS 12 1HG LYS 12 5.718 -6.496 0.465
62 HG3 LYS 12 2HG LYS 12 7.334 -5.793 0.576
63 HD2 LYS 12 1HD LYS 12 7.626 -7.490 2.538
64 HD3 LYS 12 2HD LYS 12 6.277 -8.324 1.764
65 HE2 LYS 12 1HE LYS 12 8.780 -7.507 0.303
66 HE3 LYS 12 2HE LYS 12 8.576 -9.083 1.066
67 HZ1 LYS 12 3HZ LYS 12 6.466 -8.223 -0.749
68 HZ2 LYS 12 1HZ LYS 12 7.130 -9.762 -0.511
69 HZ3 LYS 12 2HZ LYS 12 7.950 -8.623 -1.455
70 H PHE 13 H PHE 13 5.800 -2.961 3.778
71 HA PHE 13 HA PHE 13 3.972 -3.611 5.802
72 HB2 PHE 13 1HB PHE 13 5.669 -1.143 5.398
73 HB3 PHE 13 2HB PHE 13 4.756 -1.472 6.868
74 HD1 PHE 13 HD2 PHE 13 5.197 -3.965 7.798
75 HD2 PHE 13 HD1 PHE 13 7.893 -1.663 5.443
76 HE1 PHE 13 HE2 PHE 13 7.081 -5.283 8.673
77 HE2 PHE 13 HE1 PHE 13 9.782 -2.977 6.313
78 HZ PHE 13 HZ PHE 13 9.377 -4.789 7.931
79 H ARG 14 H ARG 14 4.033 -0.856 3.556
80 HA ARG 14 HA ARG 14 1.909 0.613 4.405
81 HB2 ARG 14 1HB ARG 14 2.624 -0.078 1.550
82 HB3 ARG 14 2HB ARG 14 1.520 1.211 2.014
83 HG2 ARG 14 1HG ARG 14 4.381 1.084 2.930
84 HG3 ARG 14 2HG ARG 14 3.861 1.924 1.467
85 HD2 ARG 14 1HD ARG 14 3.858 3.629 3.023
86 HD3 ARG 14 2HD ARG 14 2.177 3.099 3.058
87 HE ARG 14 HE ARG 14 3.662 1.686 4.993
88 HH11 ARG 14 1HH1 ARG 14 2.373 4.854 4.345
89 HH12 ARG 14 2HH1 ARG 14 2.211 5.273 6.018
90 HH21 ARG 14 1HH2 ARG 14 3.454 2.227 7.199
91 HH22 ARG 14 2HH2 ARG 14 2.827 3.778 7.640
92 H CYS 15 H CYS 15 1.720 -2.212 2.247
93 HA CYS 15 HA CYS 15 -0.944 -2.325 1.712
94 HB2 CYS 15 1HB CYS 15 0.795 -4.683 2.473
95 HB3 CYS 15 2HB CYS 15 -0.719 -4.771 1.578
96 H GLY 16 H GLY 16 -2.406 -1.700 3.225
97 HA2 GLY 16 1HA GLY 16 -3.992 -2.667 4.795
98 HA3 GLY 16 2HA GLY 16 -2.633 -3.436 5.601
99 H GLU 17 H GLU 17 -3.366 -0.099 4.575
100 HA GLU 17 HA GLU 17 -2.637 0.774 7.291
101 HB2 GLU 17 1HB GLU 17 -1.934 2.866 6.373
102 HB3 GLU 17 2HB GLU 17 -1.205 1.595 5.402
103 HG2 GLU 17 1HG GLU 17 -2.549 2.029 3.579
104 HG3 GLU 17 2HG GLU 17 -3.792 2.814 4.552
105 H LYS 18 H LYS 18 -3.682 3.062 7.719
106 HA LYS 18 HA LYS 18 -6.521 2.611 7.759
107 HB2 LYS 18 1HB LYS 18 -4.683 4.693 8.886
108 HB3 LYS 18 2HB LYS 18 -6.416 4.990 8.846
109 HG2 LYS 18 1HG LYS 18 -6.073 4.105 10.956
110 HG3 LYS 18 2HG LYS 18 -6.619 2.711 10.021
111 HD2 LYS 18 1HD LYS 18 -4.549 1.722 10.034
112 HD3 LYS 18 2HD LYS 18 -3.696 3.261 10.178
113 HE2 LYS 18 1HE LYS 18 -4.832 3.349 12.523
114 HE3 LYS 18 2HE LYS 18 -5.010 1.609 12.296
115 HZ1 LYS 18 3HZ LYS 18 -2.571 1.547 11.865
116 HZ2 LYS 18 1HZ LYS 18 -2.987 1.983 13.446
117 HZ3 LYS 18 2HZ LYS 18 -2.487 3.167 12.346
118 H ARG 19 H ARG 19 -7.985 4.565 7.274
119 HA ARG 19 HA ARG 19 -7.738 5.143 4.492
120 HB2 ARG 19 1HB ARG 19 -9.898 4.800 5.784
121 HB3 ARG 19 2HB ARG 19 -9.670 6.422 6.423
122 HG2 ARG 19 1HG ARG 19 -9.656 5.964 3.473
123 HG3 ARG 19 2HG ARG 19 -11.182 6.054 4.355
124 HD2 ARG 19 1HD ARG 19 -9.024 8.161 4.399
125 HD3 ARG 19 2HD ARG 19 -10.483 8.227 3.410
126 HE ARG 19 HE ARG 19 -10.279 8.695 6.258
127 HH11 ARG 19 1HH1 ARG 19 -12.368 8.011 3.558
128 HH12 ARG 19 2HH1 ARG 19 -13.792 8.614 4.339
129 HH21 ARG 19 1HH2 ARG 19 -12.147 9.493 7.297
130 HH22 ARG 19 2HH2 ARG 19 -13.665 9.458 6.466
131 H LEU 20 H LEU 20 -5.944 6.396 4.105
132 HA LEU 20 HA LEU 20 -5.173 8.653 5.589
133 HB2 LEU 20 1HB LEU 20 -4.543 7.557 2.904
134 HB3 LEU 20 2HB LEU 20 -4.114 9.237 3.222
135 HG LEU 20 HG LEU 20 -3.196 6.924 4.923
136 HD11 LEU 20 1HD1 LEU 20 -1.365 8.340 3.065
137 HD12 LEU 20 2HD1 LEU 20 -2.447 7.120 2.394
138 HD13 LEU 20 3HD1 LEU 20 -1.311 6.684 3.670
139 HD21 LEU 20 3HD2 LEU 20 -1.890 8.427 6.064
140 HD22 LEU 20 1HD2 LEU 20 -3.305 9.419 5.720
141 HD23 LEU 20 2HD2 LEU 20 -1.855 9.579 4.729
142 H THR 21 H THR 21 -5.261 10.899 4.983
143 HA THR 21 HA THR 21 -7.770 11.571 3.595
144 HB THR 21 HB THR 21 -7.601 13.757 4.849
145 HG1 THR 21 HG1 THR 21 -6.196 13.765 6.652
146 HG21 THR 21 3HG2 THR 21 -7.844 11.194 6.426
147 HG22 THR 21 1HG2 THR 21 -9.140 12.061 5.603
148 HG23 THR 21 2HG2 THR 21 -8.354 12.778 7.010
149 H ARG 22 H ARG 22 -4.450 12.750 4.109
150 HA ARG 22 HA ARG 22 -4.655 14.211 1.562
151 HB2 ARG 22 1HB ARG 22 -2.871 14.645 3.958
152 HB3 ARG 22 2HB ARG 22 -2.648 15.475 2.423
153 HG2 ARG 22 1HG ARG 22 -5.235 15.592 3.940
154 HG3 ARG 22 2HG ARG 22 -3.908 16.715 4.242
155 HD2 ARG 22 1HD ARG 22 -3.955 17.363 1.863
156 HD3 ARG 22 2HD ARG 22 -5.332 16.289 1.618
157 HE ARG 22 HE ARG 22 -5.345 18.881 2.897
158 HH11 ARG 22 1HH1 ARG 22 -7.018 15.865 2.425
159 HH12 ARG 22 2HH1 ARG 22 -8.571 16.511 2.838
160 HH21 ARG 22 1HH2 ARG 22 -7.384 19.745 3.444
161 HH22 ARG 22 2HH2 ARG 22 -8.778 18.719 3.417
162 H SER 23 H SER 23 -4.198 12.362 0.290
163 HA SER 23 HA SER 23 -1.393 11.925 -0.122
164 HB2 SER 23 1HB SER 23 -2.290 10.293 1.765
165 HB3 SER 23 2HB SER 23 -2.881 9.381 0.376
166 HG SER 23 HG SER 23 -0.575 9.100 1.294
167 H LEU 24 H LEU 24 -0.941 11.126 -2.157
168 HA LEU 24 HA LEU 24 -2.808 11.535 -4.177
169 HB2 LEU 24 1HB LEU 24 -0.361 9.778 -4.276
170 HB3 LEU 24 2HB LEU 24 -1.217 10.444 -5.664
171 HG LEU 24 HG LEU 24 0.173 12.127 -3.586
172 HD11 LEU 24 1HD1 LEU 24 1.556 10.484 -5.114
173 HD12 LEU 24 2HD1 LEU 24 2.096 12.137 -4.815
174 HD13 LEU 24 3HD1 LEU 24 1.269 11.738 -6.321
175 HD21 LEU 24 3HD2 LEU 24 -1.304 12.661 -6.112
176 HD22 LEU 24 1HD2 LEU 24 0.078 13.680 -5.712
177 HD23 LEU 24 2HD2 LEU 24 -1.285 13.567 -4.598
178 H CYS 25 H CYS 25 -1.765 8.510 -2.647
179 HA CYS 25 HA CYS 25 -4.270 7.273 -3.495
180 HB2 CYS 25 1HB CYS 25 -3.043 5.208 -4.200
181 HB3 CYS 25 2HB CYS 25 -2.776 6.593 -5.254
182 H ALA 26 H ALA 26 -4.279 4.906 -2.521
183 HA ALA 26 HA ALA 26 -3.161 5.023 0.201
184 HB1 ALA 26 3HB ALA 26 -5.730 5.512 -0.170
185 HB2 ALA 26 1HB ALA 26 -5.816 3.751 -0.207
186 HB3 ALA 26 2HB ALA 26 -5.159 4.572 1.209
187 H CYS 27 H CYS 27 -2.181 3.216 0.888
188 HA CYS 27 HA CYS 27 -2.171 0.912 -0.915
189 HB2 CYS 27 1HB CYS 27 -0.366 1.581 1.420
190 HB3 CYS 27 2HB CYS 27 -0.173 0.201 0.342
191 H SER 28 H SER 28 -4.511 1.194 0.533
192 HA SER 28 HA SER 28 -4.315 -1.067 2.411
193 HB2 SER 28 1HB SER 28 -6.201 -0.030 3.684
194 HB3 SER 28 2HB SER 28 -4.721 0.929 3.721
195 HG SER 28 HG SER 28 -6.733 1.395 1.795
196 H ASP 29 H ASP 29 -6.382 -2.252 2.679
197 HA ASP 29 HA ASP 29 -7.378 -3.145 0.232
198 HB2 ASP 29 1HB ASP 29 -8.921 -4.468 1.485
199 HB3 ASP 29 2HB ASP 29 -7.441 -4.374 2.435
200 H ASP 30 H ASP 30 -8.770 -0.864 2.561
201 HA ASP 30 HA ASP 30 -11.259 -0.430 1.573
202 HB2 ASP 30 1HB ASP 30 -10.063 0.763 3.500
203 HB3 ASP 30 2HB ASP 30 -9.469 1.889 2.282
204 H CYS 31 H CYS 31 -8.259 0.973 0.302
205 HA CYS 31 HA CYS 31 -9.133 2.706 -1.583
206 HB2 CYS 31 1HB CYS 31 -7.098 2.444 -2.680
207 HB3 CYS 31 2HB CYS 31 -6.733 1.841 -1.066
208 H LYS 32 H LYS 32 -9.199 -0.811 -1.813
209 HA LYS 32 HA LYS 32 -9.880 -1.120 -4.482
210 HB2 LYS 32 1HB LYS 32 -10.541 -2.715 -2.020
211 HB3 LYS 32 2HB LYS 32 -11.153 -3.198 -3.597
212 HG2 LYS 32 1HG LYS 32 -8.898 -3.410 -4.446
213 HG3 LYS 32 2HG LYS 32 -8.243 -2.830 -2.913
214 HD2 LYS 32 1HD LYS 32 -8.823 -4.778 -1.784
215 HD3 LYS 32 2HD LYS 32 -10.032 -5.231 -2.987
216 HE2 LYS 32 1HE LYS 32 -8.455 -6.055 -4.452
217 HE3 LYS 32 2HE LYS 32 -7.164 -5.053 -3.792
218 HZ1 LYS 32 3HZ LYS 32 -6.559 -6.711 -2.478
219 HZ2 LYS 32 1HZ LYS 32 -7.730 -7.703 -3.191
220 HZ3 LYS 32 2HZ LYS 32 -8.108 -6.814 -1.803
221 H ASP 33 H ASP 33 -12.024 -0.629 -1.691
222 HA ASP 33 HA ASP 33 -14.440 -0.714 -3.149
223 HB2 ASP 33 1HB ASP 33 -13.638 0.310 -0.451
224 HB3 ASP 33 2HB ASP 33 -15.231 0.712 -1.084
225 H GLN 34 H GLN 34 -12.812 2.133 -1.738
226 HA GLN 34 HA GLN 34 -14.359 4.055 -3.030
227 HB2 GLN 34 1HB GLN 34 -11.639 4.058 -1.790
228 HB3 GLN 34 2HB GLN 34 -12.152 5.462 -2.718
229 HG2 GLN 34 1HG GLN 34 -14.248 5.421 -1.239
230 HG3 GLN 34 2HG GLN 34 -13.314 4.351 -0.195
231 HE21 GLN 34 1HE2 GLN 34 -14.013 7.535 -0.996
232 HE22 GLN 34 2HE2 GLN 34 -12.771 8.309 -0.078
233 H GLY 35 H GLY 35 -11.028 3.091 -3.900
234 HA2 GLY 35 1HA GLY 35 -10.635 2.429 -6.247
235 HA3 GLY 35 2HA GLY 35 -11.712 3.741 -6.702
236 H ASP 36 H ASP 36 -9.082 3.706 -4.322
237 HA ASP 36 HA ASP 36 -7.621 5.626 -6.003
238 HB2 ASP 36 1HB ASP 36 -7.918 5.877 -3.005
239 HB3 ASP 36 2HB ASP 36 -7.119 7.010 -4.091
240 H CYS 37 H CYS 37 -7.085 2.905 -5.908
241 HA CYS 37 HA CYS 37 -4.977 2.387 -4.014
242 HB2 CYS 37 1HB CYS 37 -5.678 0.782 -6.475
243 HB3 CYS 37 2HB CYS 37 -4.800 0.230 -5.052
244 H CYS 38 H CYS 38 -2.807 2.441 -4.342
245 HA CYS 38 HA CYS 38 -1.744 4.173 -6.265
246 HB2 CYS 38 1HB CYS 38 -0.318 2.024 -4.683
247 HB3 CYS 38 2HB CYS 38 0.457 3.370 -5.512
248 H ILE 39 H ILE 39 -0.307 3.744 -8.028
249 HA ILE 39 HA ILE 39 -1.262 1.894 -9.878
250 HB ILE 39 HB ILE 39 0.004 3.855 -10.565
251 HG12 ILE 39 1HG1 ILE 39 1.787 2.521 -12.005
252 HG13 ILE 39 2HG1 ILE 39 0.921 1.129 -11.366
253 HG21 ILE 39 1HG2 ILE 39 1.618 4.079 -8.842
254 HG22 ILE 39 2HG2 ILE 39 2.295 2.486 -9.177
255 HG23 ILE 39 3HG2 ILE 39 2.513 3.798 -10.335
256 HD11 ILE 39 3HD1 ILE 39 0.200 2.918 -13.491
257 HD12 ILE 39 1HD1 ILE 39 -0.519 1.377 -13.023
258 HD13 ILE 39 2HD1 ILE 39 -1.058 2.871 -12.257
259 H ASN 40 H ASN 40 1.319 1.631 -7.513
260 HA ASN 40 HA ASN 40 1.830 -1.125 -8.411
261 HB2 ASN 40 1HB ASN 40 3.693 0.743 -8.166
262 HB3 ASN 40 2HB ASN 40 3.634 0.259 -6.474
263 HD21 ASN 40 1HD2 ASN 40 5.374 -0.931 -6.137
264 HD22 ASN 40 2HD2 ASN 40 5.879 -2.275 -7.100
265 H TYR 41 H TYR 41 -0.463 -0.559 -6.891
266 HA TYR 41 HA TYR 41 0.067 -1.167 -4.125
267 HB2 TYR 41 1HB TYR 41 -1.820 0.198 -4.443
268 HB3 TYR 41 2HB TYR 41 -2.435 -0.802 -5.754
269 HD1 TYR 41 HD1 TYR 41 -1.768 -0.870 -2.089
270 HD2 TYR 41 HD2 TYR 41 -4.065 -2.411 -5.322
271 HE1 TYR 41 HE1 TYR 41 -3.200 -2.072 -0.491
272 HE2 TYR 41 HE2 TYR 41 -5.504 -3.616 -3.733
273 HH TYR 41 HH TYR 41 -4.963 -3.389 -0.228
274 H SER 42 H SER 42 -1.672 -2.853 -6.744
275 HA SER 42 HA SER 42 -1.887 -5.294 -5.305
276 HB2 SER 42 1HB SER 42 -2.572 -6.245 -7.514
277 HB3 SER 42 2HB SER 42 -3.473 -4.796 -7.065
278 HG SER 42 HG SER 42 -2.806 -3.977 -8.868
279 H SER 43 H SER 43 0.332 -4.115 -7.795
280 HA SER 43 HA SER 43 1.736 -6.414 -8.366
281 HB2 SER 43 1HB SER 43 2.130 -4.323 -9.557
282 HB3 SER 43 2HB SER 43 2.815 -3.597 -8.104
283 HG SER 43 HG SER 43 4.539 -5.001 -8.234
284 H VAL 44 H VAL 44 2.177 -4.195 -5.647
285 HA VAL 44 HA VAL 44 4.345 -5.796 -4.566
286 HB VAL 44 HB VAL 44 2.978 -3.353 -3.426
287 HG11 VAL 44 1HG1 VAL 44 5.218 -5.072 -2.473
288 HG12 VAL 44 2HG1 VAL 44 5.279 -3.337 -2.158
289 HG13 VAL 44 3HG1 VAL 44 3.924 -4.295 -1.561
290 HG21 VAL 44 3HG2 VAL 44 5.234 -2.316 -4.077
291 HG22 VAL 44 1HG2 VAL 44 5.428 -3.726 -5.118
292 HG23 VAL 44 2HG2 VAL 44 4.069 -2.629 -5.365
293 H CYS 45 H CYS 45 1.099 -4.768 -3.509
294 HA CYS 45 HA CYS 45 1.052 -6.413 -1.207
295 HB2 CYS 45 1HB CYS 45 -1.267 -5.268 -2.777
296 HB3 CYS 45 2HB CYS 45 -1.350 -5.909 -1.139
297 H GLN 46 H GLN 46 -0.819 -6.750 -4.229
298 HA GLN 46 HA GLN 46 -1.196 -9.583 -3.654
299 HB2 GLN 46 1HB GLN 46 -2.341 -7.783 -5.793
300 HB3 GLN 46 2HB GLN 46 -2.696 -9.501 -5.664
301 HG2 GLN 46 1HG GLN 46 -3.605 -9.098 -3.401
302 HG3 GLN 46 2HG GLN 46 -3.342 -7.371 -3.638
303 HE21 GLN 46 1HE2 GLN 46 -5.092 -6.317 -4.196
304 HE22 GLN 46 2HE2 GLN 46 -6.404 -6.931 -5.137
305 H GLY 47 H GLY 47 1.041 -10.164 -3.990
306 HA2 GLY 47 1HA GLY 47 1.654 -11.502 -6.240
307 HA3 GLY 47 2HA GLY 47 2.147 -9.866 -6.654
308 H GLU 48 H GLU 48 2.821 -12.665 -4.705
309 HA GLU 48 HA GLU 48 5.155 -11.396 -3.501
310 HB2 GLU 48 1HB GLU 48 3.820 -12.769 -2.027
311 HB3 GLU 48 2HB GLU 48 3.929 -14.132 -3.132
312 HG2 GLU 48 1HG GLU 48 5.420 -14.537 -1.334
313 HG3 GLU 48 2HG GLU 48 6.390 -14.154 -2.754
314 H LYS 49 H LYS 49 7.217 -11.791 -4.079
315 HA LYS 49 HA LYS 49 7.637 -13.535 -6.406
316 HB2 LYS 49 1HB LYS 49 8.258 -11.036 -6.418
317 HB3 LYS 49 2HB LYS 49 9.596 -11.496 -5.372
318 HG2 LYS 49 1HG LYS 49 9.229 -12.995 -7.908
319 HG3 LYS 49 2HG LYS 49 9.859 -11.349 -7.992
320 HD2 LYS 49 1HD LYS 49 11.767 -11.885 -6.775
321 HD3 LYS 49 2HD LYS 49 11.033 -13.329 -6.074
322 HE2 LYS 49 1HE LYS 49 11.233 -14.528 -8.102
323 HE3 LYS 49 2HE LYS 49 11.606 -13.067 -9.015
324 HZ1 LYS 49 3HZ LYS 49 13.537 -14.559 -8.476
325 HZ2 LYS 49 1HZ LYS 49 13.361 -14.090 -6.859
326 HZ3 LYS 49 2HZ LYS 49 13.727 -12.935 -8.040
327 H SER 50 H SER 50 7.916 -15.521 -5.440
328 HA SER 50 HA SER 50 10.311 -15.777 -3.743
329 HB2 SER 50 1HB SER 50 8.444 -16.194 -2.304
330 HB3 SER 50 2HB SER 50 7.668 -17.224 -3.507
331 HG SER 50 HG SER 50 8.715 -18.817 -2.651
332 H SER 51 H SER 51 11.604 -16.259 -5.537
333 HA SER 51 HA SER 51 10.983 -18.798 -6.895
334 HB2 SER 51 1HB SER 51 12.316 -16.288 -7.802
335 HB3 SER 51 2HB SER 51 12.875 -17.813 -8.488
336 HG SER 51 HG SER 51 10.510 -18.179 -8.862
337 H GLY 52 H GLY 52 11.874 -20.107 -5.260
338 HA2 GLY 52 1HA GLY 52 14.636 -20.674 -5.567
339 HA3 GLY 52 2HA GLY 52 14.363 -19.817 -4.057
340 HA PRO 53 HA PRO 53 13.217 -24.499 -3.934
341 HB2 PRO 53 1HB PRO 53 15.610 -25.628 -3.324
342 HB3 PRO 53 2HB PRO 53 15.028 -25.448 -4.983
343 HG2 PRO 53 1HG PRO 53 16.967 -23.748 -3.463
344 HG3 PRO 53 2HG PRO 53 17.054 -24.317 -5.141
345 HD2 PRO 53 1HD PRO 53 16.261 -21.811 -4.490
346 HD3 PRO 53 2HD PRO 53 15.622 -22.678 -5.902
347 H SER 54 H SER 54 15.889 -23.057 -2.052
348 HA SER 54 HA SER 54 14.834 -24.195 0.398
349 HB2 SER 54 1HB SER 54 16.837 -23.294 1.454
350 HB3 SER 54 2HB SER 54 17.279 -24.141 -0.028
351 HG SER 54 HG SER 54 18.021 -22.339 -0.799
352 H SER 55 H SER 55 14.745 -22.719 2.359
353 HA SER 55 HA SER 55 13.536 -20.133 1.633
354 HB2 SER 55 1HB SER 55 12.499 -22.315 3.386
355 HB3 SER 55 2HB SER 55 12.156 -20.647 3.844
356 HG SER 55 HG SER 55 10.874 -22.086 2.082
357 H GLY 56 H GLY 56 13.251 -18.784 3.778
358 HA2 GLY 56 1HA GLY 56 15.084 -19.121 5.888
359 HA3 GLY 56 2HA GLY 56 15.820 -18.100 4.661
Start of MODEL 3
1 H1 GLY 1 H GLY 1 17.654 12.957 2.125
2 HA2 GLY 1 1HA GLY 1 15.166 12.169 2.768
3 HA3 GLY 1 2HA GLY 1 15.485 13.103 1.314
4 H SER 2 H SER 2 14.319 10.191 2.552
5 HA SER 2 HA SER 2 14.806 8.548 0.254
6 HB2 SER 2 1HB SER 2 14.515 7.401 2.320
7 HB3 SER 2 2HB SER 2 13.008 8.249 2.661
8 HG SER 2 HG SER 2 12.722 6.082 1.871
9 H SER 3 H SER 3 14.029 9.946 -1.424
10 HA SER 3 HA SER 3 12.482 10.828 -2.857
11 HB2 SER 3 1HB SER 3 11.043 8.313 -1.981
12 HB3 SER 3 2HB SER 3 10.597 9.284 -3.384
13 HG SER 3 HG SER 3 13.179 8.172 -3.030
14 H GLY 4 H GLY 4 12.355 12.128 -0.463
15 HA2 GLY 4 1HA GLY 4 11.004 13.531 0.752
16 HA3 GLY 4 2HA GLY 4 9.825 13.333 -0.537
17 H SER 5 H SER 5 8.224 13.478 1.165
18 HA SER 5 HA SER 5 8.040 11.112 2.886
19 HB2 SER 5 1HB SER 5 6.028 12.532 3.809
20 HB3 SER 5 2HB SER 5 7.682 12.956 4.248
21 HG SER 5 HG SER 5 6.356 14.098 2.025
22 H SER 6 H SER 6 6.754 12.459 0.032
23 HA SER 6 HA SER 6 4.402 10.699 0.148
24 HB2 SER 6 1HB SER 6 3.373 12.085 -1.492
25 HB3 SER 6 2HB SER 6 4.115 13.183 -0.330
26 HG SER 6 HG SER 6 5.193 13.972 -1.936
27 H GLY 7 H GLY 7 3.767 9.778 -2.049
28 HA2 GLY 7 1HA GLY 7 5.598 9.370 -4.114
29 HA3 GLY 7 2HA GLY 7 5.842 8.080 -2.947
30 H TRP 8 H TRP 8 4.886 7.920 -5.700
31 HA TRP 8 HA TRP 8 2.093 7.120 -5.369
32 HB2 TRP 8 1HB TRP 8 3.855 7.544 -7.774
33 HB3 TRP 8 2HB TRP 8 2.302 6.723 -7.903
34 HD1 TRP 8 HD1 TRP 8 3.823 10.171 -7.258
35 HE1 TRP 8 HE1 TRP 8 1.977 11.946 -7.503
36 HE3 TRP 8 HE3 TRP 8 -0.222 7.076 -7.702
37 HZ2 TRP 8 HZ2 TRP 8 -0.824 12.024 -7.840
38 HZ3 TRP 8 HZ3 TRP 8 -2.450 8.081 -7.983
39 HH2 TRP 8 HH2 TRP 8 -2.743 10.505 -8.050
40 H THR 9 H THR 9 3.939 5.541 -3.999
41 HA THR 9 HA THR 9 3.616 2.997 -5.431
42 HB THR 9 HB THR 9 5.809 2.218 -4.636
43 HG1 THR 9 HG1 THR 9 5.757 4.035 -2.927
44 HG21 THR 9 3HG2 THR 9 5.577 3.245 -6.881
45 HG22 THR 9 1HG2 THR 9 7.187 3.457 -6.194
46 HG23 THR 9 2HG2 THR 9 6.042 4.799 -6.189
47 H CYS 10 H CYS 10 4.071 1.112 -3.863
48 HA CYS 10 HA CYS 10 2.997 1.776 -1.200
49 HB2 CYS 10 1HB CYS 10 2.133 -0.311 -3.161
50 HB3 CYS 10 2HB CYS 10 1.994 -0.652 -1.439
51 H ASN 11 H ASN 11 3.544 0.262 0.497
52 HA ASN 11 HA ASN 11 5.988 -1.281 -0.064
53 HB2 ASN 11 1HB ASN 11 5.439 0.746 2.052
54 HB3 ASN 11 2HB ASN 11 6.439 -0.638 2.480
55 HD21 ASN 11 1HD2 ASN 11 7.007 2.273 2.129
56 HD22 ASN 11 2HD2 ASN 11 8.346 2.329 1.037
57 H LYS 12 H LYS 12 6.359 -3.114 1.289
58 HA LYS 12 HA LYS 12 4.275 -4.834 1.640
59 HB2 LYS 12 1HB LYS 12 6.983 -4.632 2.858
60 HB3 LYS 12 2HB LYS 12 5.853 -5.769 3.580
61 HG2 LYS 12 1HG LYS 12 7.045 -7.033 2.028
62 HG3 LYS 12 2HG LYS 12 5.520 -6.672 1.216
63 HD2 LYS 12 1HD LYS 12 6.779 -4.642 0.239
64 HD3 LYS 12 2HD LYS 12 8.239 -5.501 0.735
65 HE2 LYS 12 1HE LYS 12 7.685 -7.374 -0.649
66 HE3 LYS 12 2HE LYS 12 6.093 -6.705 -1.005
67 HZ1 LYS 12 3HZ LYS 12 8.723 -5.673 -1.903
68 HZ2 LYS 12 1HZ LYS 12 7.282 -4.800 -2.065
69 HZ3 LYS 12 2HZ LYS 12 7.468 -6.280 -2.863
70 H PHE 13 H PHE 13 5.749 -2.911 4.259
71 HA PHE 13 HA PHE 13 3.983 -3.613 6.280
72 HB2 PHE 13 1HB PHE 13 6.166 -2.179 6.331
73 HB3 PHE 13 2HB PHE 13 5.066 -0.822 6.106
74 HD1 PHE 13 HD1 PHE 13 5.920 -3.635 8.339
75 HD2 PHE 13 HD2 PHE 13 3.781 0.017 7.891
76 HE1 PHE 13 HE1 PHE 13 5.474 -3.603 10.759
77 HE2 PHE 13 HE2 PHE 13 3.332 0.055 10.310
78 HZ PHE 13 HZ PHE 13 4.179 -1.756 11.748
79 H ARG 14 H ARG 14 3.790 -0.886 4.011
80 HA ARG 14 HA ARG 14 1.544 0.389 4.933
81 HB2 ARG 14 1HB ARG 14 2.207 -0.111 2.025
82 HB3 ARG 14 2HB ARG 14 1.183 1.173 2.653
83 HG2 ARG 14 1HG ARG 14 4.025 0.943 3.544
84 HG3 ARG 14 2HG ARG 14 3.626 1.697 1.998
85 HD2 ARG 14 1HD ARG 14 2.254 2.529 4.531
86 HD3 ARG 14 2HD ARG 14 3.827 3.191 4.089
87 HE ARG 14 HE ARG 14 1.792 3.367 2.041
88 HH11 ARG 14 1HH1 ARG 14 3.371 4.924 4.724
89 HH12 ARG 14 2HH1 ARG 14 2.913 6.522 4.235
90 HH21 ARG 14 1HH2 ARG 14 1.182 5.465 1.387
91 HH22 ARG 14 2HH2 ARG 14 1.667 6.828 2.338
92 H CYS 15 H CYS 15 1.608 -2.279 2.568
93 HA CYS 15 HA CYS 15 -1.021 -2.618 2.022
94 HB2 CYS 15 1HB CYS 15 0.894 -4.868 2.675
95 HB3 CYS 15 2HB CYS 15 -0.580 -5.007 1.722
96 H GLY 16 H GLY 16 -2.674 -2.439 3.400
97 HA2 GLY 16 1HA GLY 16 -4.152 -3.422 4.958
98 HA3 GLY 16 2HA GLY 16 -2.803 -4.322 5.635
99 H GLU 17 H GLU 17 -3.037 -0.840 5.030
100 HA GLU 17 HA GLU 17 -2.704 -0.419 7.928
101 HB2 GLU 17 1HB GLU 17 -1.467 1.592 7.434
102 HB3 GLU 17 2HB GLU 17 -0.752 0.254 6.546
103 HG2 GLU 17 1HG GLU 17 -1.544 1.017 4.504
104 HG3 GLU 17 2HG GLU 17 -2.775 2.033 5.251
105 H LYS 18 H LYS 18 -3.431 1.871 8.580
106 HA LYS 18 HA LYS 18 -6.212 2.077 8.022
107 HB2 LYS 18 1HB LYS 18 -4.384 4.000 9.472
108 HB3 LYS 18 2HB LYS 18 -6.141 4.052 9.494
109 HG2 LYS 18 1HG LYS 18 -4.780 1.549 10.348
110 HG3 LYS 18 2HG LYS 18 -4.784 2.934 11.441
111 HD2 LYS 18 1HD LYS 18 -7.287 1.853 10.166
112 HD3 LYS 18 2HD LYS 18 -6.682 1.280 11.721
113 HE2 LYS 18 1HE LYS 18 -7.399 4.134 11.054
114 HE3 LYS 18 2HE LYS 18 -8.398 3.015 11.981
115 HZ1 LYS 18 3HZ LYS 18 -6.450 4.704 12.958
116 HZ2 LYS 18 1HZ LYS 18 -5.781 3.153 13.063
117 HZ3 LYS 18 2HZ LYS 18 -7.263 3.488 13.809
118 H ARG 19 H ARG 19 -7.136 4.368 7.549
119 HA ARG 19 HA ARG 19 -6.340 5.043 4.898
120 HB2 ARG 19 1HB ARG 19 -8.255 6.471 6.753
121 HB3 ARG 19 2HB ARG 19 -8.114 6.736 5.020
122 HG2 ARG 19 1HG ARG 19 -8.883 4.494 4.571
123 HG3 ARG 19 2HG ARG 19 -8.918 4.132 6.298
124 HD2 ARG 19 1HD ARG 19 -10.591 6.208 4.887
125 HD3 ARG 19 2HD ARG 19 -11.153 4.631 5.439
126 HE ARG 19 HE ARG 19 -11.204 5.427 7.604
127 HH11 ARG 19 1HH1 ARG 19 -9.652 7.736 5.511
128 HH12 ARG 19 2HH1 ARG 19 -9.665 9.006 6.689
129 HH21 ARG 19 1HH2 ARG 19 -11.226 7.092 9.163
130 HH22 ARG 19 2HH2 ARG 19 -10.559 8.639 8.765
131 H LEU 20 H LEU 20 -6.131 7.477 4.332
132 HA LEU 20 HA LEU 20 -4.546 8.951 6.287
133 HB2 LEU 20 1HB LEU 20 -3.521 8.339 3.520
134 HB3 LEU 20 2HB LEU 20 -2.718 9.326 4.739
135 HG LEU 20 HG LEU 20 -3.286 6.390 5.106
136 HD11 LEU 20 1HD1 LEU 20 -1.314 7.682 3.440
137 HD12 LEU 20 2HD1 LEU 20 -1.694 5.970 3.615
138 HD13 LEU 20 3HD1 LEU 20 -0.556 6.737 4.721
139 HD21 LEU 20 3HD2 LEU 20 -1.018 7.585 6.474
140 HD22 LEU 20 1HD2 LEU 20 -2.340 6.608 7.113
141 HD23 LEU 20 2HD2 LEU 20 -2.548 8.348 6.906
142 H THR 21 H THR 21 -4.628 11.150 6.041
143 HA THR 21 HA THR 21 -6.672 12.147 4.247
144 HB THR 21 HB THR 21 -6.194 14.351 5.397
145 HG1 THR 21 HG1 THR 21 -5.027 13.801 7.525
146 HG21 THR 21 3HG2 THR 21 -7.398 13.769 7.376
147 HG22 THR 21 1HG2 THR 21 -6.849 12.096 7.291
148 HG23 THR 21 2HG2 THR 21 -7.976 12.716 6.085
149 H ARG 22 H ARG 22 -3.253 12.904 4.915
150 HA ARG 22 HA ARG 22 -3.104 14.313 2.350
151 HB2 ARG 22 1HB ARG 22 -2.251 15.568 4.225
152 HB3 ARG 22 2HB ARG 22 -1.222 14.227 4.711
153 HG2 ARG 22 1HG ARG 22 0.304 15.557 3.664
154 HG3 ARG 22 2HG ARG 22 -0.212 14.551 2.309
155 HD2 ARG 22 1HD ARG 22 -0.139 16.885 1.649
156 HD3 ARG 22 2HD ARG 22 -1.801 16.295 1.634
157 HE ARG 22 HE ARG 22 -1.101 17.543 4.110
158 HH11 ARG 22 1HH1 ARG 22 -2.131 18.143 0.839
159 HH12 ARG 22 2HH1 ARG 22 -2.874 19.662 1.212
160 HH21 ARG 22 1HH2 ARG 22 -2.076 19.542 4.615
161 HH22 ARG 22 2HH2 ARG 22 -2.840 20.459 3.360
162 H SER 23 H SER 23 -3.040 12.551 0.942
163 HA SER 23 HA SER 23 -0.436 11.404 0.568
164 HB2 SER 23 1HB SER 23 -1.786 9.938 2.290
165 HB3 SER 23 2HB SER 23 -2.599 9.351 0.840
166 HG SER 23 HG SER 23 -0.786 8.071 1.342
167 H LEU 24 H LEU 24 -0.253 10.238 -1.452
168 HA LEU 24 HA LEU 24 -2.030 11.327 -3.456
169 HB2 LEU 24 1HB LEU 24 0.415 9.580 -3.695
170 HB3 LEU 24 2HB LEU 24 -0.464 10.275 -5.055
171 HG LEU 24 HG LEU 24 0.679 12.068 -2.953
172 HD11 LEU 24 1HD1 LEU 24 2.743 12.219 -4.321
173 HD12 LEU 24 2HD1 LEU 24 2.198 10.811 -5.231
174 HD13 LEU 24 3HD1 LEU 24 2.545 10.666 -3.508
175 HD21 LEU 24 3HD2 LEU 24 -0.259 13.536 -4.340
176 HD22 LEU 24 1HD2 LEU 24 -0.537 12.306 -5.573
177 HD23 LEU 24 2HD2 LEU 24 1.019 13.131 -5.486
178 H CYS 25 H CYS 25 -1.051 8.109 -2.325
179 HA CYS 25 HA CYS 25 -3.544 7.043 -3.454
180 HB2 CYS 25 1HB CYS 25 -2.418 5.055 -4.247
181 HB3 CYS 25 2HB CYS 25 -1.638 6.469 -4.947
182 H ALA 26 H ALA 26 -3.985 4.785 -2.548
183 HA ALA 26 HA ALA 26 -3.236 4.736 0.304
184 HB1 ALA 26 3HB ALA 26 -5.594 3.340 0.165
185 HB2 ALA 26 1HB ALA 26 -5.420 5.021 0.671
186 HB3 ALA 26 2HB ALA 26 -5.841 4.641 -0.999
187 H CYS 27 H CYS 27 -2.538 2.848 1.168
188 HA CYS 27 HA CYS 27 -2.290 0.566 -0.676
189 HB2 CYS 27 1HB CYS 27 -0.611 1.240 1.749
190 HB3 CYS 27 2HB CYS 27 -0.354 -0.122 0.663
191 H SER 28 H SER 28 -4.682 0.999 0.767
192 HA SER 28 HA SER 28 -4.623 -1.321 2.581
193 HB2 SER 28 1HB SER 28 -6.364 -0.235 3.948
194 HB3 SER 28 2HB SER 28 -4.890 0.732 3.898
195 HG SER 28 HG SER 28 -6.093 1.752 1.987
196 H ASP 29 H ASP 29 -6.467 -2.650 2.585
197 HA ASP 29 HA ASP 29 -7.603 -3.300 0.198
198 HB2 ASP 29 1HB ASP 29 -8.642 -3.634 3.004
199 HB3 ASP 29 2HB ASP 29 -9.526 -4.262 1.616
200 H ASP 30 H ASP 30 -8.956 -1.083 2.617
201 HA ASP 30 HA ASP 30 -11.400 -0.495 1.615
202 HB2 ASP 30 1HB ASP 30 -9.330 1.392 2.740
203 HB3 ASP 30 2HB ASP 30 -10.983 1.889 2.388
204 H CYS 31 H CYS 31 -8.310 0.542 0.297
205 HA CYS 31 HA CYS 31 -9.110 2.481 -1.497
206 HB2 CYS 31 1HB CYS 31 -7.055 2.210 -2.532
207 HB3 CYS 31 2HB CYS 31 -6.745 1.502 -0.950
208 H LYS 32 H LYS 32 -9.156 -1.037 -1.885
209 HA LYS 32 HA LYS 32 -9.805 -1.288 -4.537
210 HB2 LYS 32 1HB LYS 32 -10.542 -2.865 -2.104
211 HB3 LYS 32 2HB LYS 32 -11.279 -3.281 -3.646
212 HG2 LYS 32 1HG LYS 32 -8.307 -3.038 -3.340
213 HG3 LYS 32 2HG LYS 32 -9.167 -4.532 -2.958
214 HD2 LYS 32 1HD LYS 32 -10.172 -4.357 -5.294
215 HD3 LYS 32 2HD LYS 32 -8.949 -3.124 -5.607
216 HE2 LYS 32 1HE LYS 32 -7.181 -4.683 -5.199
217 HE3 LYS 32 2HE LYS 32 -8.317 -5.902 -4.626
218 HZ1 LYS 32 3HZ LYS 32 -9.218 -6.111 -6.815
219 HZ2 LYS 32 1HZ LYS 32 -7.537 -6.272 -6.923
220 HZ3 LYS 32 2HZ LYS 32 -8.280 -4.828 -7.392
221 H ASP 33 H ASP 33 -11.994 -0.581 -1.843
222 HA ASP 33 HA ASP 33 -14.331 -0.510 -3.499
223 HB2 ASP 33 1HB ASP 33 -14.029 0.702 -0.749
224 HB3 ASP 33 2HB ASP 33 -15.511 0.159 -1.531
225 H GLN 34 H GLN 34 -12.699 2.057 -1.630
226 HA GLN 34 HA GLN 34 -14.023 4.227 -2.686
227 HB2 GLN 34 1HB GLN 34 -11.188 3.944 -1.705
228 HB3 GLN 34 2HB GLN 34 -11.858 5.494 -2.195
229 HG2 GLN 34 1HG GLN 34 -13.354 3.873 -0.207
230 HG3 GLN 34 2HG GLN 34 -11.889 4.704 0.312
231 HE21 GLN 34 1HE2 GLN 34 -14.950 5.243 -1.374
232 HE22 GLN 34 2HE2 GLN 34 -15.179 6.859 -0.810
233 H GLY 35 H GLY 35 -10.826 3.067 -3.786
234 HA2 GLY 35 1HA GLY 35 -10.508 2.680 -6.187
235 HA3 GLY 35 2HA GLY 35 -11.521 4.087 -6.470
236 H ASP 36 H ASP 36 -8.885 3.728 -4.136
237 HA ASP 36 HA ASP 36 -7.326 5.685 -5.681
238 HB2 ASP 36 1HB ASP 36 -7.601 5.731 -2.671
239 HB3 ASP 36 2HB ASP 36 -6.757 6.902 -3.679
240 H CYS 37 H CYS 37 -6.963 2.911 -5.739
241 HA CYS 37 HA CYS 37 -4.852 2.185 -3.916
242 HB2 CYS 37 1HB CYS 37 -5.650 0.728 -6.437
243 HB3 CYS 37 2HB CYS 37 -4.843 0.067 -5.018
244 H CYS 38 H CYS 38 -2.737 2.477 -4.185
245 HA CYS 38 HA CYS 38 -1.551 4.144 -5.951
246 HB2 CYS 38 1HB CYS 38 -0.237 1.619 -4.931
247 HB3 CYS 38 2HB CYS 38 0.571 3.103 -5.427
248 H ILE 39 H ILE 39 -0.114 3.786 -7.792
249 HA ILE 39 HA ILE 39 -1.381 2.468 -9.905
250 HB ILE 39 HB ILE 39 0.159 4.297 -10.310
251 HG12 ILE 39 1HG1 ILE 39 1.377 1.827 -11.541
252 HG13 ILE 39 2HG1 ILE 39 -0.206 2.432 -12.015
253 HG21 ILE 39 1HG2 ILE 39 2.216 2.416 -9.182
254 HG22 ILE 39 2HG2 ILE 39 2.640 3.825 -10.154
255 HG23 ILE 39 3HG2 ILE 39 1.790 4.034 -8.622
256 HD11 ILE 39 3HD1 ILE 39 2.258 3.167 -13.059
257 HD12 ILE 39 1HD1 ILE 39 0.703 3.946 -13.348
258 HD13 ILE 39 2HD1 ILE 39 1.758 4.535 -12.064
259 H ASN 40 H ASN 40 1.066 1.379 -7.657
260 HA ASN 40 HA ASN 40 0.986 -1.272 -8.942
261 HB2 ASN 40 1HB ASN 40 3.328 -1.556 -7.937
262 HB3 ASN 40 2HB ASN 40 3.180 -0.510 -9.348
263 HD21 ASN 40 1HD2 ASN 40 3.109 -0.381 -5.808
264 HD22 ASN 40 2HD2 ASN 40 3.933 1.132 -5.675
265 H TYR 41 H TYR 41 -0.851 -0.545 -7.010
266 HA TYR 41 HA TYR 41 -0.018 -1.287 -4.387
267 HB2 TYR 41 1HB TYR 41 -1.901 0.036 -4.293
268 HB3 TYR 41 2HB TYR 41 -2.623 -0.703 -5.718
269 HD1 TYR 41 HD2 TYR 41 -3.833 -2.837 -5.531
270 HD2 TYR 41 HD1 TYR 41 -2.279 -0.862 -2.098
271 HE1 TYR 41 HE2 TYR 41 -5.262 -4.229 -4.092
272 HE2 TYR 41 HE1 TYR 41 -3.703 -2.249 -0.649
273 HH TYR 41 HH TYR 41 -6.033 -3.550 -1.060
274 H SER 42 H SER 42 -1.671 -2.967 -7.024
275 HA SER 42 HA SER 42 -2.106 -5.376 -5.574
276 HB2 SER 42 1HB SER 42 -2.652 -6.348 -7.774
277 HB3 SER 42 2HB SER 42 -3.458 -4.799 -7.535
278 HG SER 42 HG SER 42 -2.382 -4.008 -9.156
279 H SER 43 H SER 43 0.433 -4.225 -7.728
280 HA SER 43 HA SER 43 1.818 -6.678 -7.967
281 HB2 SER 43 1HB SER 43 2.977 -3.888 -8.159
282 HB3 SER 43 2HB SER 43 3.653 -5.363 -8.850
283 HG SER 43 HG SER 43 1.249 -4.052 -9.582
284 H VAL 44 H VAL 44 2.083 -3.982 -5.701
285 HA VAL 44 HA VAL 44 4.330 -5.129 -4.313
286 HB VAL 44 HB VAL 44 2.529 -2.820 -3.573
287 HG11 VAL 44 1HG1 VAL 44 4.109 -2.259 -1.863
288 HG12 VAL 44 2HG1 VAL 44 3.613 -3.937 -1.624
289 HG13 VAL 44 3HG1 VAL 44 5.179 -3.573 -2.352
290 HG21 VAL 44 3HG2 VAL 44 4.318 -1.404 -4.332
291 HG22 VAL 44 1HG2 VAL 44 5.348 -2.803 -4.643
292 HG23 VAL 44 2HG2 VAL 44 3.907 -2.532 -5.623
293 H CYS 45 H CYS 45 0.905 -4.563 -3.511
294 HA CYS 45 HA CYS 45 1.094 -6.123 -1.097
295 HB2 CYS 45 1HB CYS 45 -1.309 -4.959 -2.522
296 HB3 CYS 45 2HB CYS 45 -1.344 -5.708 -0.929
297 H GLN 46 H GLN 46 -0.954 -6.462 -4.001
298 HA GLN 46 HA GLN 46 -1.421 -9.246 -3.432
299 HB2 GLN 46 1HB GLN 46 -2.184 -7.549 -5.814
300 HB3 GLN 46 2HB GLN 46 -2.719 -9.202 -5.548
301 HG2 GLN 46 1HG GLN 46 -3.436 -6.731 -4.018
302 HG3 GLN 46 2HG GLN 46 -4.499 -7.874 -4.838
303 HE21 GLN 46 1HE2 GLN 46 -3.856 -6.822 -1.934
304 HE22 GLN 46 2HE2 GLN 46 -4.018 -8.261 -0.992
305 H GLY 47 H GLY 47 1.293 -8.832 -3.687
306 HA2 GLY 47 1HA GLY 47 2.237 -9.376 -6.327
307 HA3 GLY 47 2HA GLY 47 3.171 -9.497 -4.844
308 H GLU 48 H GLU 48 2.414 -11.238 -7.386
309 HA GLU 48 HA GLU 48 1.495 -13.671 -6.138
310 HB2 GLU 48 1HB GLU 48 0.852 -13.131 -8.444
311 HB3 GLU 48 2HB GLU 48 2.542 -13.165 -8.929
312 HG2 GLU 48 1HG GLU 48 2.458 -15.596 -7.970
313 HG3 GLU 48 2HG GLU 48 0.724 -15.416 -8.233
314 H LYS 49 H LYS 49 4.514 -12.565 -7.658
315 HA LYS 49 HA LYS 49 5.902 -14.864 -6.468
316 HB2 LYS 49 1HB LYS 49 6.208 -14.600 -8.873
317 HB3 LYS 49 2HB LYS 49 6.770 -12.949 -8.642
318 HG2 LYS 49 1HG LYS 49 8.648 -13.922 -7.257
319 HG3 LYS 49 2HG LYS 49 8.148 -15.501 -7.866
320 HD2 LYS 49 1HD LYS 49 8.654 -13.266 -9.784
321 HD3 LYS 49 2HD LYS 49 10.015 -14.154 -9.098
322 HE2 LYS 49 1HE LYS 49 9.640 -15.426 -10.950
323 HE3 LYS 49 2HE LYS 49 8.550 -16.235 -9.826
324 HZ1 LYS 49 3HZ LYS 49 7.820 -14.216 -11.874
325 HZ2 LYS 49 1HZ LYS 49 6.750 -14.800 -10.701
326 HZ3 LYS 49 2HZ LYS 49 7.393 -15.854 -11.857
327 H SER 50 H SER 50 7.543 -14.621 -5.024
328 HA SER 50 HA SER 50 7.637 -12.252 -3.483
329 HB2 SER 50 1HB SER 50 8.220 -14.727 -2.846
330 HB3 SER 50 2HB SER 50 9.838 -14.289 -3.393
331 HG SER 50 HG SER 50 9.284 -12.336 -1.896
332 H SER 51 H SER 51 9.439 -10.846 -3.119
333 HA SER 51 HA SER 51 10.701 -10.031 -5.563
334 HB2 SER 51 1HB SER 51 10.757 -8.992 -2.736
335 HB3 SER 51 2HB SER 51 11.797 -8.314 -3.988
336 HG SER 51 HG SER 51 9.992 -7.704 -5.136
337 H GLY 52 H GLY 52 12.281 -11.347 -6.286
338 HA2 GLY 52 1HA GLY 52 14.719 -11.578 -6.148
339 HA3 GLY 52 2HA GLY 52 14.517 -11.876 -4.428
340 HA PRO 53 HA PRO 53 14.373 -15.839 -7.123
341 HB2 PRO 53 1HB PRO 53 16.963 -16.629 -6.929
342 HB3 PRO 53 2HB PRO 53 16.362 -15.619 -8.250
343 HG2 PRO 53 1HG PRO 53 17.830 -14.815 -5.768
344 HG3 PRO 53 2HG PRO 53 18.059 -14.253 -7.434
345 HD2 PRO 53 1HD PRO 53 16.686 -12.823 -5.589
346 HD3 PRO 53 2HD PRO 53 16.281 -12.790 -7.317
347 H SER 54 H SER 54 14.879 -18.047 -6.309
348 HA SER 54 HA SER 54 13.931 -18.626 -3.875
349 HB2 SER 54 1HB SER 54 14.698 -20.267 -5.657
350 HB3 SER 54 2HB SER 54 16.314 -20.130 -4.964
351 HG SER 54 HG SER 54 15.693 -21.531 -3.543
352 H SER 55 H SER 55 14.794 -19.144 -1.800
353 HA SER 55 HA SER 55 17.192 -17.566 -1.145
354 HB2 SER 55 1HB SER 55 16.275 -17.351 1.110
355 HB3 SER 55 2HB SER 55 15.093 -16.802 -0.077
356 HG SER 55 HG SER 55 14.270 -19.061 0.092
357 H GLY 56 H GLY 56 15.458 -20.539 -0.218
358 HA2 GLY 56 1HA GLY 56 17.141 -22.502 -0.386
359 HA3 GLY 56 2HA GLY 56 17.974 -21.600 0.870
Start of MODEL 4
1 H1 GLY 1 H GLY 1 12.313 4.174 2.049
2 HA2 GLY 1 1HA GLY 1 10.820 5.027 3.582
3 HA3 GLY 1 2HA GLY 1 11.515 3.943 4.779
4 H SER 2 H SER 2 12.655 6.766 2.916
5 HA SER 2 HA SER 2 13.375 8.047 5.459
6 HB2 SER 2 1HB SER 2 15.538 8.679 4.668
7 HB3 SER 2 2HB SER 2 15.377 6.952 4.349
8 HG SER 2 HG SER 2 14.667 7.640 2.181
9 H SER 3 H SER 3 12.700 10.086 5.603
10 HA SER 3 HA SER 3 11.536 11.976 5.044
11 HB2 SER 3 1HB SER 3 13.929 12.433 4.343
12 HB3 SER 3 2HB SER 3 13.435 12.054 2.693
13 HG SER 3 HG SER 3 12.702 14.006 2.571
14 H GLY 4 H GLY 4 10.217 9.704 4.135
15 HA2 GLY 4 1HA GLY 4 8.762 10.845 1.879
16 HA3 GLY 4 2HA GLY 4 9.476 9.260 1.623
17 H SER 5 H SER 5 6.817 10.976 2.835
18 HA SER 5 HA SER 5 5.801 8.604 4.245
19 HB2 SER 5 1HB SER 5 4.226 10.082 5.349
20 HB3 SER 5 2HB SER 5 5.849 10.752 5.514
21 HG SER 5 HG SER 5 3.657 11.746 4.184
22 H SER 6 H SER 6 4.871 11.076 1.875
23 HA SER 6 HA SER 6 2.638 9.369 1.025
24 HB2 SER 6 1HB SER 6 1.794 11.377 -0.139
25 HB3 SER 6 2HB SER 6 2.034 11.677 1.581
26 HG SER 6 HG SER 6 4.179 12.229 -0.097
27 H GLY 7 H GLY 7 2.224 9.190 -1.308
28 HA2 GLY 7 1HA GLY 7 3.656 9.841 -3.454
29 HA3 GLY 7 2HA GLY 7 4.722 8.658 -2.710
30 H TRP 8 H TRP 8 3.651 8.324 -5.263
31 HA TRP 8 HA TRP 8 1.368 6.563 -5.087
32 HB2 TRP 8 1HB TRP 8 3.172 7.100 -7.456
33 HB3 TRP 8 2HB TRP 8 1.575 6.357 -7.496
34 HD1 TRP 8 HD1 TRP 8 3.277 9.762 -7.017
35 HE1 TRP 8 HE1 TRP 8 1.524 11.610 -7.389
36 HE3 TRP 8 HE3 TRP 8 -0.904 6.847 -7.414
37 HZ2 TRP 8 HZ2 TRP 8 -1.262 11.806 -7.796
38 HZ3 TRP 8 HZ3 TRP 8 -3.074 7.943 -7.794
39 HH2 TRP 8 HH2 TRP 8 -3.248 10.371 -7.980
40 H THR 9 H THR 9 3.435 5.641 -3.483
41 HA THR 9 HA THR 9 4.077 3.114 -4.831
42 HB THR 9 HB THR 9 6.304 3.066 -3.784
43 HG1 THR 9 HG1 THR 9 5.456 4.871 -2.221
44 HG21 THR 9 3HG2 THR 9 6.716 5.569 -5.119
45 HG22 THR 9 1HG2 THR 9 5.496 4.634 -5.982
46 HG23 THR 9 2HG2 THR 9 7.087 3.939 -5.678
47 H CYS 10 H CYS 10 4.091 1.301 -3.519
48 HA CYS 10 HA CYS 10 3.336 1.719 -0.704
49 HB2 CYS 10 1HB CYS 10 2.057 -0.051 -2.767
50 HB3 CYS 10 2HB CYS 10 1.957 -0.455 -1.057
51 H ASN 11 H ASN 11 3.771 -0.138 0.697
52 HA ASN 11 HA ASN 11 6.025 -1.760 -0.290
53 HB2 ASN 11 1HB ASN 11 5.649 -0.363 2.351
54 HB3 ASN 11 2HB ASN 11 6.761 -1.719 2.180
55 HD21 ASN 11 1HD2 ASN 11 8.622 -0.607 2.506
56 HD22 ASN 11 2HD2 ASN 11 9.217 0.607 1.430
57 H LYS 12 H LYS 12 6.273 -3.858 0.655
58 HA LYS 12 HA LYS 12 3.998 -5.402 0.754
59 HB2 LYS 12 1HB LYS 12 6.545 -6.039 0.664
60 HB3 LYS 12 2HB LYS 12 6.369 -6.188 2.407
61 HG2 LYS 12 1HG LYS 12 6.052 -8.345 1.504
62 HG3 LYS 12 2HG LYS 12 4.454 -7.759 1.974
63 HD2 LYS 12 1HD LYS 12 4.367 -6.926 -0.510
64 HD3 LYS 12 2HD LYS 12 5.611 -8.155 -0.751
65 HE2 LYS 12 1HE LYS 12 3.496 -9.160 -1.211
66 HE3 LYS 12 2HE LYS 12 4.074 -9.806 0.323
67 HZ1 LYS 12 3HZ LYS 12 1.820 -9.295 0.641
68 HZ2 LYS 12 1HZ LYS 12 1.953 -7.789 -0.119
69 HZ3 LYS 12 2HZ LYS 12 2.661 -8.037 1.397
70 H PHE 13 H PHE 13 5.906 -4.315 3.567
71 HA PHE 13 HA PHE 13 4.132 -5.288 5.513
72 HB2 PHE 13 1HB PHE 13 6.226 -3.120 5.568
73 HB3 PHE 13 2HB PHE 13 5.279 -3.537 6.992
74 HD1 PHE 13 HD1 PHE 13 7.778 -4.754 4.587
75 HD2 PHE 13 HD2 PHE 13 5.710 -5.526 8.226
76 HE1 PHE 13 HE1 PHE 13 9.357 -6.571 5.095
77 HE2 PHE 13 HE2 PHE 13 7.285 -7.344 8.740
78 HZ PHE 13 HZ PHE 13 9.114 -7.868 7.175
79 H ARG 14 H ARG 14 4.364 -2.140 3.920
80 HA ARG 14 HA ARG 14 2.584 -0.656 5.393
81 HB2 ARG 14 1HB ARG 14 3.318 -0.682 2.496
82 HB3 ARG 14 2HB ARG 14 1.985 0.337 3.023
83 HG2 ARG 14 1HG ARG 14 4.643 0.465 4.391
84 HG3 ARG 14 2HG ARG 14 4.346 1.346 2.891
85 HD2 ARG 14 1HD ARG 14 3.730 2.950 4.388
86 HD3 ARG 14 2HD ARG 14 2.184 2.123 4.204
87 HE ARG 14 HE ARG 14 2.378 1.320 6.359
88 HH11 ARG 14 1HH1 ARG 14 5.357 2.822 5.365
89 HH12 ARG 14 2HH1 ARG 14 6.041 2.822 6.957
90 HH21 ARG 14 1HH2 ARG 14 3.267 1.314 8.460
91 HH22 ARG 14 2HH2 ARG 14 4.851 1.962 8.717
92 H CYS 15 H CYS 15 1.827 -2.842 2.694
93 HA CYS 15 HA CYS 15 -0.826 -2.506 2.344
94 HB2 CYS 15 1HB CYS 15 0.384 -5.254 2.671
95 HB3 CYS 15 2HB CYS 15 -0.989 -4.799 1.665
96 H GLY 16 H GLY 16 -2.316 -2.102 3.853
97 HA2 GLY 16 1HA GLY 16 -3.905 -3.159 5.358
98 HA3 GLY 16 2HA GLY 16 -2.557 -4.032 6.073
99 H GLU 17 H GLU 17 -2.869 -0.584 5.288
100 HA GLU 17 HA GLU 17 -2.337 0.001 8.124
101 HB2 GLU 17 1HB GLU 17 -1.435 2.157 7.351
102 HB3 GLU 17 2HB GLU 17 -0.578 0.794 6.646
103 HG2 GLU 17 1HG GLU 17 -1.440 1.164 4.541
104 HG3 GLU 17 2HG GLU 17 -2.830 2.058 5.154
105 H LYS 18 H LYS 18 -3.228 2.159 8.850
106 HA LYS 18 HA LYS 18 -5.904 2.607 7.698
107 HB2 LYS 18 1HB LYS 18 -6.644 3.135 10.048
108 HB3 LYS 18 2HB LYS 18 -6.261 1.444 9.747
109 HG2 LYS 18 1HG LYS 18 -5.184 1.717 11.723
110 HG3 LYS 18 2HG LYS 18 -3.886 2.203 10.632
111 HD2 LYS 18 1HD LYS 18 -3.909 3.893 12.238
112 HD3 LYS 18 2HD LYS 18 -4.838 4.581 10.905
113 HE2 LYS 18 1HE LYS 18 -6.197 3.096 13.126
114 HE3 LYS 18 2HE LYS 18 -5.754 4.793 13.313
115 HZ1 LYS 18 3HZ LYS 18 -6.980 5.005 11.038
116 HZ2 LYS 18 1HZ LYS 18 -7.859 4.973 12.482
117 HZ3 LYS 18 2HZ LYS 18 -7.744 3.579 11.532
118 H ARG 19 H ARG 19 -3.137 3.962 7.582
119 HA ARG 19 HA ARG 19 -4.124 6.667 8.202
120 HB2 ARG 19 1HB ARG 19 -1.478 5.407 8.770
121 HB3 ARG 19 2HB ARG 19 -1.525 7.121 8.380
122 HG2 ARG 19 1HG ARG 19 -3.386 6.096 10.456
123 HG3 ARG 19 2HG ARG 19 -1.677 6.270 10.860
124 HD2 ARG 19 1HD ARG 19 -1.706 8.579 10.483
125 HD3 ARG 19 2HD ARG 19 -3.211 8.499 9.569
126 HE ARG 19 HE ARG 19 -2.918 8.615 12.441
127 HH11 ARG 19 1HH1 ARG 19 -5.009 7.848 9.765
128 HH12 ARG 19 2HH1 ARG 19 -6.466 8.031 10.682
129 HH21 ARG 19 1HH2 ARG 19 -4.831 8.859 13.659
130 HH22 ARG 19 2HH2 ARG 19 -6.365 8.607 12.897
131 H LEU 20 H LEU 20 -2.505 8.299 7.005
132 HA LEU 20 HA LEU 20 -2.158 9.266 4.963
133 HB2 LEU 20 1HB LEU 20 -0.809 6.596 4.713
134 HB3 LEU 20 2HB LEU 20 -0.721 7.809 3.437
135 HG LEU 20 HG LEU 20 1.280 7.818 4.838
136 HD11 LEU 20 1HD1 LEU 20 0.199 9.924 3.822
137 HD12 LEU 20 2HD1 LEU 20 1.467 10.124 5.030
138 HD13 LEU 20 3HD1 LEU 20 -0.224 10.324 5.487
139 HD21 LEU 20 3HD2 LEU 20 -0.028 7.079 6.908
140 HD22 LEU 20 1HD2 LEU 20 -0.410 8.787 7.120
141 HD23 LEU 20 2HD2 LEU 20 1.270 8.252 7.137
142 H THR 21 H THR 21 -4.722 8.252 5.147
143 HA THR 21 HA THR 21 -5.323 6.688 2.797
144 HB THR 21 HB THR 21 -7.700 7.071 3.435
145 HG1 THR 21 HG1 THR 21 -7.645 9.033 4.467
146 HG21 THR 21 3HG2 THR 21 -6.496 6.253 5.994
147 HG22 THR 21 1HG2 THR 21 -5.896 5.398 4.575
148 HG23 THR 21 2HG2 THR 21 -7.621 5.392 4.944
149 H ARG 22 H ARG 22 -5.771 10.046 3.847
150 HA ARG 22 HA ARG 22 -7.173 10.960 1.603
151 HB2 ARG 22 1HB ARG 22 -5.529 12.239 3.732
152 HB3 ARG 22 2HB ARG 22 -5.915 13.195 2.308
153 HG2 ARG 22 1HG ARG 22 -8.318 12.708 2.699
154 HG3 ARG 22 2HG ARG 22 -7.863 11.899 4.201
155 HD2 ARG 22 1HD ARG 22 -8.566 14.166 4.668
156 HD3 ARG 22 2HD ARG 22 -6.840 13.996 4.990
157 HE ARG 22 HE ARG 22 -7.200 14.914 2.359
158 HH11 ARG 22 1HH1 ARG 22 -7.568 15.988 5.650
159 HH12 ARG 22 2HH1 ARG 22 -7.303 17.658 5.272
160 HH21 ARG 22 1HH2 ARG 22 -6.848 17.109 1.850
161 HH22 ARG 22 2HH2 ARG 22 -6.895 18.295 3.110
162 H SER 23 H SER 23 -3.721 10.607 2.202
163 HA SER 23 HA SER 23 -2.517 12.038 0.265
164 HB2 SER 23 1HB SER 23 -1.585 10.178 1.881
165 HB3 SER 23 2HB SER 23 -1.739 9.151 0.456
166 HG SER 23 HG SER 23 -0.081 11.373 0.886
167 H LEU 24 H LEU 24 -1.751 11.519 -1.908
168 HA LEU 24 HA LEU 24 -3.587 11.264 -3.821
169 HB2 LEU 24 1HB LEU 24 -0.892 9.922 -3.971
170 HB3 LEU 24 2HB LEU 24 -1.888 10.413 -5.340
171 HG LEU 24 HG LEU 24 -0.901 12.437 -3.361
172 HD11 LEU 24 1HD1 LEU 24 0.773 12.505 -5.606
173 HD12 LEU 24 2HD1 LEU 24 0.737 10.823 -5.075
174 HD13 LEU 24 3HD1 LEU 24 1.209 12.093 -3.947
175 HD21 LEU 24 3HD2 LEU 24 -2.118 12.412 -6.059
176 HD22 LEU 24 1HD2 LEU 24 -0.895 13.641 -5.741
177 HD23 LEU 24 2HD2 LEU 24 -2.333 13.546 -4.725
178 H CYS 25 H CYS 25 -1.967 8.483 -2.317
179 HA CYS 25 HA CYS 25 -4.267 6.826 -3.051
180 HB2 CYS 25 1HB CYS 25 -2.816 4.997 -3.794
181 HB3 CYS 25 2HB CYS 25 -2.576 6.431 -4.787
182 H ALA 26 H ALA 26 -4.062 4.609 -1.938
183 HA ALA 26 HA ALA 26 -2.833 4.934 0.718
184 HB1 ALA 26 3HB ALA 26 -5.080 5.313 1.193
185 HB2 ALA 26 1HB ALA 26 -5.629 4.099 0.036
186 HB3 ALA 26 2HB ALA 26 -4.870 3.599 1.548
187 H CYS 27 H CYS 27 -2.248 2.983 1.794
188 HA CYS 27 HA CYS 27 -1.863 0.720 -0.052
189 HB2 CYS 27 1HB CYS 27 -0.201 1.499 2.354
190 HB3 CYS 27 2HB CYS 27 0.114 0.139 1.282
191 H SER 28 H SER 28 -4.279 0.855 1.212
192 HA SER 28 HA SER 28 -4.059 -1.299 3.209
193 HB2 SER 28 1HB SER 28 -5.774 -0.359 4.536
194 HB3 SER 28 2HB SER 28 -4.736 1.005 4.121
195 HG SER 28 HG SER 28 -6.917 1.532 3.798
196 H ASP 29 H ASP 29 -5.999 -2.663 3.365
197 HA ASP 29 HA ASP 29 -6.950 -3.348 0.733
198 HB2 ASP 29 1HB ASP 29 -7.720 -4.583 3.384
199 HB3 ASP 29 2HB ASP 29 -7.926 -5.291 1.784
200 H ASP 30 H ASP 30 -7.851 -0.832 1.365
201 HA ASP 30 HA ASP 30 -10.745 -1.295 1.612
202 HB2 ASP 30 1HB ASP 30 -9.579 -0.229 3.674
203 HB3 ASP 30 2HB ASP 30 -9.479 1.215 2.671
204 H CYS 31 H CYS 31 -8.139 0.738 0.390
205 HA CYS 31 HA CYS 31 -9.499 2.645 -1.027
206 HB2 CYS 31 1HB CYS 31 -7.576 2.819 -2.471
207 HB3 CYS 31 2HB CYS 31 -7.015 2.453 -0.842
208 H LYS 32 H LYS 32 -8.938 -0.715 -1.931
209 HA LYS 32 HA LYS 32 -9.658 -0.799 -4.550
210 HB2 LYS 32 1HB LYS 32 -10.601 -2.738 -2.429
211 HB3 LYS 32 2HB LYS 32 -10.511 -3.062 -4.156
212 HG2 LYS 32 1HG LYS 32 -8.128 -2.943 -4.127
213 HG3 LYS 32 2HG LYS 32 -8.126 -2.369 -2.457
214 HD2 LYS 32 1HD LYS 32 -8.987 -4.481 -1.679
215 HD3 LYS 32 2HD LYS 32 -9.179 -5.055 -3.338
216 HE2 LYS 32 1HE LYS 32 -6.893 -5.295 -3.653
217 HE3 LYS 32 2HE LYS 32 -6.496 -4.179 -2.347
218 HZ1 LYS 32 3HZ LYS 32 -7.561 -5.950 -0.856
219 HZ2 LYS 32 1HZ LYS 32 -6.011 -6.249 -1.467
220 HZ3 LYS 32 2HZ LYS 32 -7.357 -6.995 -2.171
221 H ASP 33 H ASP 33 -11.853 -0.589 -1.782
222 HA ASP 33 HA ASP 33 -14.257 -0.793 -3.238
223 HB2 ASP 33 1HB ASP 33 -14.104 -1.079 -0.784
224 HB3 ASP 33 2HB ASP 33 -13.768 0.642 -0.619
225 H GLN 34 H GLN 34 -12.807 2.131 -1.788
226 HA GLN 34 HA GLN 34 -14.474 3.951 -3.111
227 HB2 GLN 34 1HB GLN 34 -11.838 4.148 -1.720
228 HB3 GLN 34 2HB GLN 34 -12.404 5.523 -2.658
229 HG2 GLN 34 1HG GLN 34 -14.262 4.289 -0.696
230 HG3 GLN 34 2HG GLN 34 -12.937 5.286 -0.095
231 HE21 GLN 34 1HE2 GLN 34 -16.041 5.454 -0.609
232 HE22 GLN 34 2HE2 GLN 34 -16.221 7.077 -1.173
233 H GLY 35 H GLY 35 -11.029 3.295 -3.804
234 HA2 GLY 35 1HA GLY 35 -10.524 2.686 -6.171
235 HA3 GLY 35 2HA GLY 35 -11.595 4.006 -6.617
236 H ASP 36 H ASP 36 -9.106 3.902 -4.095
237 HA ASP 36 HA ASP 36 -7.580 5.912 -5.607
238 HB2 ASP 36 1HB ASP 36 -8.665 6.085 -2.837
239 HB3 ASP 36 2HB ASP 36 -7.073 6.776 -3.138
240 H CYS 37 H CYS 37 -6.935 3.265 -5.700
241 HA CYS 37 HA CYS 37 -4.920 2.701 -3.691
242 HB2 CYS 37 1HB CYS 37 -5.624 1.137 -6.182
243 HB3 CYS 37 2HB CYS 37 -4.651 0.570 -4.829
244 H CYS 38 H CYS 38 -2.728 2.690 -3.998
245 HA CYS 38 HA CYS 38 -1.555 4.534 -5.675
246 HB2 CYS 38 1HB CYS 38 -0.359 2.038 -4.457
247 HB3 CYS 38 2HB CYS 38 0.589 3.306 -5.229
248 H ILE 39 H ILE 39 0.155 4.024 -7.370
249 HA ILE 39 HA ILE 39 -1.115 2.748 -9.569
250 HB ILE 39 HB ILE 39 0.379 4.656 -9.893
251 HG12 ILE 39 1HG1 ILE 39 1.827 3.623 -11.716
252 HG13 ILE 39 2HG1 ILE 39 1.204 2.061 -11.197
253 HG21 ILE 39 1HG2 ILE 39 2.214 2.967 -8.386
254 HG22 ILE 39 2HG2 ILE 39 2.941 3.669 -9.831
255 HG23 ILE 39 3HG2 ILE 39 2.210 4.717 -8.615
256 HD11 ILE 39 3HD1 ILE 39 -0.960 2.564 -11.900
257 HD12 ILE 39 1HD1 ILE 39 -0.630 4.294 -11.981
258 HD13 ILE 39 2HD1 ILE 39 0.077 3.205 -13.175
259 H ASN 40 H ASN 40 1.186 1.717 -7.183
260 HA ASN 40 HA ASN 40 1.319 -0.910 -8.507
261 HB2 ASN 40 1HB ASN 40 3.606 -1.188 -7.712
262 HB3 ASN 40 2HB ASN 40 3.485 0.269 -8.695
263 HD21 ASN 40 1HD2 ASN 40 5.383 -0.537 -6.575
264 HD22 ASN 40 2HD2 ASN 40 5.350 0.749 -5.423
265 H TYR 41 H TYR 41 -0.684 -0.830 -6.939
266 HA TYR 41 HA TYR 41 0.086 -1.466 -4.194
267 HB2 TYR 41 1HB TYR 41 -1.781 0.046 -4.413
268 HB3 TYR 41 2HB TYR 41 -2.615 -1.065 -5.494
269 HD1 TYR 41 HD2 TYR 41 -3.369 -3.307 -4.553
270 HD2 TYR 41 HD1 TYR 41 -2.087 -0.084 -2.089
271 HE1 TYR 41 HE2 TYR 41 -4.504 -4.334 -2.627
272 HE2 TYR 41 HE1 TYR 41 -3.218 -1.102 -0.157
273 HH TYR 41 HH TYR 41 -4.032 -4.080 0.136
274 H SER 42 H SER 42 -1.612 -2.918 -6.947
275 HA SER 42 HA SER 42 -2.078 -5.414 -5.659
276 HB2 SER 42 1HB SER 42 -2.750 -6.210 -7.866
277 HB3 SER 42 2HB SER 42 -3.425 -4.606 -7.577
278 HG SER 42 HG SER 42 -1.237 -4.028 -8.696
279 H SER 43 H SER 43 0.497 -4.116 -7.651
280 HA SER 43 HA SER 43 1.808 -6.594 -8.134
281 HB2 SER 43 1HB SER 43 2.317 -4.818 -9.628
282 HB3 SER 43 2HB SER 43 2.709 -3.719 -8.306
283 HG SER 43 HG SER 43 4.415 -5.083 -9.628
284 H VAL 44 H VAL 44 2.148 -4.072 -5.687
285 HA VAL 44 HA VAL 44 4.383 -5.378 -4.413
286 HB VAL 44 HB VAL 44 2.692 -3.055 -3.479
287 HG11 VAL 44 1HG1 VAL 44 4.854 -4.575 -2.215
288 HG12 VAL 44 2HG1 VAL 44 5.095 -2.827 -2.217
289 HG13 VAL 44 3HG1 VAL 44 3.639 -3.517 -1.498
290 HG21 VAL 44 3HG2 VAL 44 5.494 -2.686 -4.340
291 HG22 VAL 44 1HG2 VAL 44 4.323 -3.042 -5.611
292 HG23 VAL 44 2HG2 VAL 44 4.090 -1.643 -4.564
293 H CYS 45 H CYS 45 0.999 -4.707 -3.520
294 HA CYS 45 HA CYS 45 1.145 -6.388 -1.192
295 HB2 CYS 45 1HB CYS 45 -1.242 -5.118 -2.551
296 HB3 CYS 45 2HB CYS 45 -1.265 -5.901 -0.975
297 H GLN 46 H GLN 46 -0.939 -6.543 -4.087
298 HA GLN 46 HA GLN 46 -1.468 -9.337 -3.640
299 HB2 GLN 46 1HB GLN 46 -2.228 -7.498 -5.915
300 HB3 GLN 46 2HB GLN 46 -2.785 -9.158 -5.746
301 HG2 GLN 46 1HG GLN 46 -3.684 -8.419 -3.465
302 HG3 GLN 46 2HG GLN 46 -3.450 -6.776 -4.060
303 HE21 GLN 46 1HE2 GLN 46 -5.329 -5.970 -4.641
304 HE22 GLN 46 2HE2 GLN 46 -6.550 -6.784 -5.552
305 H GLY 47 H GLY 47 1.250 -8.983 -3.916
306 HA2 GLY 47 1HA GLY 47 2.044 -9.549 -6.637
307 HA3 GLY 47 2HA GLY 47 3.095 -9.500 -5.230
308 H GLU 48 H GLU 48 4.166 -11.392 -5.392
309 HA GLU 48 HA GLU 48 2.620 -13.847 -5.812
310 HB2 GLU 48 1HB GLU 48 4.768 -13.222 -7.128
311 HB3 GLU 48 2HB GLU 48 5.617 -13.714 -5.669
312 HG2 GLU 48 1HG GLU 48 3.723 -15.451 -7.235
313 HG3 GLU 48 2HG GLU 48 5.481 -15.499 -7.350
314 H LYS 49 H LYS 49 1.720 -14.178 -3.797
315 HA LYS 49 HA LYS 49 3.520 -14.373 -1.497
316 HB2 LYS 49 1HB LYS 49 1.149 -13.199 -1.587
317 HB3 LYS 49 2HB LYS 49 0.578 -14.833 -1.280
318 HG2 LYS 49 1HG LYS 49 2.148 -14.875 0.696
319 HG3 LYS 49 2HG LYS 49 2.366 -13.142 0.442
320 HD2 LYS 49 1HD LYS 49 0.078 -12.701 0.872
321 HD3 LYS 49 2HD LYS 49 -0.343 -14.412 0.777
322 HE2 LYS 49 1HE LYS 49 -0.321 -14.016 3.061
323 HE3 LYS 49 2HE LYS 49 1.285 -14.680 2.766
324 HZ1 LYS 49 3HZ LYS 49 1.216 -12.659 4.208
325 HZ2 LYS 49 1HZ LYS 49 0.723 -11.770 2.854
326 HZ3 LYS 49 2HZ LYS 49 2.235 -12.529 2.864
327 H SER 50 H SER 50 4.553 -16.315 -2.235
328 HA SER 50 HA SER 50 3.463 -18.661 -1.127
329 HB2 SER 50 1HB SER 50 2.167 -18.329 -3.377
330 HB3 SER 50 2HB SER 50 3.655 -18.928 -4.109
331 HG SER 50 HG SER 50 2.634 -20.366 -1.958
332 H SER 51 H SER 51 5.345 -19.234 -0.233
333 HA SER 51 HA SER 51 7.689 -19.494 -2.002
334 HB2 SER 51 1HB SER 51 9.119 -19.005 -0.136
335 HB3 SER 51 2HB SER 51 7.873 -17.759 -0.181
336 HG SER 51 HG SER 51 8.302 -18.704 1.932
337 H GLY 52 H GLY 52 5.817 -21.538 -1.863
338 HA2 GLY 52 1HA GLY 52 6.589 -23.877 -1.903
339 HA3 GLY 52 2HA GLY 52 7.301 -23.580 -0.325
340 HA PRO 53 HA PRO 53 2.488 -23.724 0.273
341 HB2 PRO 53 1HB PRO 53 1.076 -24.757 -1.803
342 HB3 PRO 53 2HB PRO 53 1.405 -23.029 -1.631
343 HG2 PRO 53 1HG PRO 53 2.801 -25.063 -3.326
344 HG3 PRO 53 2HG PRO 53 2.317 -23.407 -3.736
345 HD2 PRO 53 1HD PRO 53 4.856 -24.056 -3.055
346 HD3 PRO 53 2HD PRO 53 4.140 -22.478 -2.675
347 H SER 54 H SER 54 3.542 -26.250 -2.021
348 HA SER 54 HA SER 54 3.604 -28.248 0.029
349 HB2 SER 54 1HB SER 54 1.312 -28.162 -1.918
350 HB3 SER 54 2HB SER 54 1.878 -29.697 -1.258
351 HG SER 54 HG SER 54 0.157 -28.654 -0.049
352 H SER 55 H SER 55 4.612 -30.155 -0.637
353 HA SER 55 HA SER 55 6.314 -29.868 -2.924
354 HB2 SER 55 1HB SER 55 5.941 -32.209 -1.039
355 HB3 SER 55 2HB SER 55 7.232 -32.057 -2.229
356 HG SER 55 HG SER 55 7.468 -29.885 -0.964
357 H GLY 56 H GLY 56 6.593 -31.710 -4.495
358 HA2 GLY 56 1HA GLY 56 5.762 -33.084 -6.140
359 HA3 GLY 56 2HA GLY 56 4.442 -33.473 -5.048
Start of MODEL 5
1 H1 GLY 1 H GLY 1 17.224 15.714 -4.862
2 HA2 GLY 1 1HA GLY 1 17.932 13.539 -5.074
3 HA3 GLY 1 2HA GLY 1 16.762 13.117 -3.833
4 H SER 2 H SER 2 17.536 11.746 -6.349
5 HA SER 2 HA SER 2 15.048 11.882 -7.885
6 HB2 SER 2 1HB SER 2 17.327 11.894 -9.011
7 HB3 SER 2 2HB SER 2 17.483 10.208 -8.515
8 HG SER 2 HG SER 2 15.872 9.646 -9.857
9 H SER 3 H SER 3 17.098 9.491 -6.236
10 HA SER 3 HA SER 3 15.158 7.395 -6.523
11 HB2 SER 3 1HB SER 3 17.680 7.584 -4.860
12 HB3 SER 3 2HB SER 3 16.697 6.127 -5.010
13 HG SER 3 HG SER 3 17.512 7.371 -7.365
14 H GLY 4 H GLY 4 13.296 8.391 -5.582
15 HA2 GLY 4 1HA GLY 4 13.380 8.991 -2.730
16 HA3 GLY 4 2HA GLY 4 12.009 9.224 -3.805
17 H SER 5 H SER 5 13.145 7.434 -1.282
18 HA SER 5 HA SER 5 12.494 4.814 -1.696
19 HB2 SER 5 1HB SER 5 13.399 5.699 0.426
20 HB3 SER 5 2HB SER 5 11.829 6.418 0.785
21 HG SER 5 HG SER 5 12.130 3.653 0.278
22 H SER 6 H SER 6 10.215 7.268 -0.463
23 HA SER 6 HA SER 6 7.995 5.534 -1.272
24 HB2 SER 6 1HB SER 6 7.904 8.046 0.414
25 HB3 SER 6 2HB SER 6 6.599 6.884 0.180
26 HG SER 6 HG SER 6 8.721 6.799 1.889
27 H GLY 7 H GLY 7 5.981 6.863 -1.991
28 HA2 GLY 7 1HA GLY 7 5.473 9.058 -3.148
29 HA3 GLY 7 2HA GLY 7 6.895 8.698 -4.116
30 H TRP 8 H TRP 8 3.548 8.322 -3.817
31 HA TRP 8 HA TRP 8 1.979 7.068 -4.921
32 HB2 TRP 8 1HB TRP 8 3.959 7.663 -7.130
33 HB3 TRP 8 2HB TRP 8 2.327 7.057 -7.398
34 HD1 TRP 8 HD1 TRP 8 4.085 10.171 -7.554
35 HE1 TRP 8 HE1 TRP 8 2.528 12.192 -7.214
36 HE3 TRP 8 HE3 TRP 8 0.036 7.752 -5.581
37 HZ2 TRP 8 HZ2 TRP 8 -0.073 12.694 -6.239
38 HZ3 TRP 8 HZ3 TRP 8 -1.946 9.076 -4.971
39 HH2 TRP 8 HH2 TRP 8 -1.997 11.496 -5.293
40 H THR 9 H THR 9 3.616 5.388 -3.504
41 HA THR 9 HA THR 9 3.451 2.978 -5.109
42 HB THR 9 HB THR 9 5.769 2.258 -4.402
43 HG1 THR 9 HG1 THR 9 6.221 5.046 -4.067
44 HG21 THR 9 3HG2 THR 9 5.578 4.617 -6.278
45 HG22 THR 9 1HG2 THR 9 5.267 2.934 -6.701
46 HG23 THR 9 2HG2 THR 9 6.890 3.440 -6.232
47 H CYS 10 H CYS 10 3.256 1.099 -3.890
48 HA CYS 10 HA CYS 10 2.710 1.555 -1.046
49 HB2 CYS 10 1HB CYS 10 1.759 -0.455 -3.057
50 HB3 CYS 10 2HB CYS 10 1.687 -0.840 -1.340
51 H ASN 11 H ASN 11 3.506 0.149 0.556
52 HA ASN 11 HA ASN 11 5.883 -1.391 -0.259
53 HB2 ASN 11 1HB ASN 11 5.401 0.227 2.248
54 HB3 ASN 11 2HB ASN 11 6.754 -0.884 2.053
55 HD21 ASN 11 1HD2 ASN 11 6.427 2.130 2.313
56 HD22 ASN 11 2HD2 ASN 11 7.411 2.759 1.040
57 H LYS 12 H LYS 12 6.469 -3.157 1.268
58 HA LYS 12 HA LYS 12 4.438 -5.016 1.533
59 HB2 LYS 12 1HB LYS 12 7.166 -4.743 2.714
60 HB3 LYS 12 2HB LYS 12 6.100 -5.993 3.346
61 HG2 LYS 12 1HG LYS 12 7.245 -7.134 1.718
62 HG3 LYS 12 2HG LYS 12 5.800 -6.626 0.842
63 HD2 LYS 12 1HD LYS 12 7.113 -4.618 0.069
64 HD3 LYS 12 2HD LYS 12 8.547 -5.390 0.751
65 HE2 LYS 12 1HE LYS 12 6.798 -6.864 -1.181
66 HE3 LYS 12 2HE LYS 12 7.996 -5.711 -1.765
67 HZ1 LYS 12 3HZ LYS 12 9.734 -6.961 -0.786
68 HZ2 LYS 12 1HZ LYS 12 8.769 -8.063 -1.632
69 HZ3 LYS 12 2HZ LYS 12 8.655 -7.959 0.052
70 H PHE 13 H PHE 13 5.766 -2.831 3.993
71 HA PHE 13 HA PHE 13 4.167 -3.756 6.125
72 HB2 PHE 13 1HB PHE 13 6.281 -2.187 6.089
73 HB3 PHE 13 2HB PHE 13 5.076 -0.907 5.990
74 HD1 PHE 13 HD1 PHE 13 5.736 -4.005 7.965
75 HD2 PHE 13 HD2 PHE 13 4.376 0.029 7.959
76 HE1 PHE 13 HE1 PHE 13 5.439 -4.104 10.406
77 HE2 PHE 13 HE2 PHE 13 4.078 -0.065 10.400
78 HZ PHE 13 HZ PHE 13 4.611 -2.132 11.627
79 H ARG 14 H ARG 14 3.832 -0.819 4.126
80 HA ARG 14 HA ARG 14 1.502 0.197 5.101
81 HB2 ARG 14 1HB ARG 14 2.579 0.081 2.299
82 HB3 ARG 14 2HB ARG 14 1.042 0.865 2.639
83 HG2 ARG 14 1HG ARG 14 2.025 2.559 3.864
84 HG3 ARG 14 2HG ARG 14 3.478 1.614 4.194
85 HD2 ARG 14 1HD ARG 14 4.420 2.099 2.173
86 HD3 ARG 14 2HD ARG 14 2.860 2.253 1.363
87 HE ARG 14 HE ARG 14 2.838 4.392 2.956
88 HH11 ARG 14 1HH1 ARG 14 5.311 3.133 0.854
89 HH12 ARG 14 2HH1 ARG 14 5.999 4.688 0.516
90 HH21 ARG 14 1HH2 ARG 14 3.734 6.443 2.520
91 HH22 ARG 14 2HH2 ARG 14 5.102 6.570 1.466
92 H CYS 15 H CYS 15 1.773 -2.313 2.593
93 HA CYS 15 HA CYS 15 -0.744 -2.781 1.828
94 HB2 CYS 15 1HB CYS 15 1.197 -4.913 2.749
95 HB3 CYS 15 2HB CYS 15 -0.225 -5.208 1.753
96 H GLY 16 H GLY 16 -2.474 -2.422 3.111
97 HA2 GLY 16 1HA GLY 16 -4.149 -3.240 4.529
98 HA3 GLY 16 2HA GLY 16 -2.990 -4.374 5.208
99 H GLU 17 H GLU 17 -2.988 -0.824 4.913
100 HA GLU 17 HA GLU 17 -2.449 -0.693 7.802
101 HB2 GLU 17 1HB GLU 17 -1.465 1.518 7.355
102 HB3 GLU 17 2HB GLU 17 -0.667 0.248 6.438
103 HG2 GLU 17 1HG GLU 17 -1.837 0.890 4.436
104 HG3 GLU 17 2HG GLU 17 -2.784 2.078 5.331
105 H LYS 18 H LYS 18 -3.293 1.283 8.904
106 HA LYS 18 HA LYS 18 -5.855 2.184 7.777
107 HB2 LYS 18 1HB LYS 18 -6.914 1.961 9.971
108 HB3 LYS 18 2HB LYS 18 -6.323 0.407 9.396
109 HG2 LYS 18 1HG LYS 18 -4.610 2.059 11.196
110 HG3 LYS 18 2HG LYS 18 -5.947 1.121 11.868
111 HD2 LYS 18 1HD LYS 18 -4.050 -0.213 9.993
112 HD3 LYS 18 2HD LYS 18 -3.534 0.090 11.654
113 HE2 LYS 18 1HE LYS 18 -5.221 -1.262 12.545
114 HE3 LYS 18 2HE LYS 18 -6.157 -1.233 11.051
115 HZ1 LYS 18 3HZ LYS 18 -4.397 -3.182 11.845
116 HZ2 LYS 18 1HZ LYS 18 -3.569 -2.339 10.634
117 HZ3 LYS 18 2HZ LYS 18 -5.087 -3.012 10.310
118 H ARG 19 H ARG 19 -6.728 3.911 9.591
119 HA ARG 19 HA ARG 19 -6.472 6.180 9.944
120 HB2 ARG 19 1HB ARG 19 -5.075 6.609 11.884
121 HB3 ARG 19 2HB ARG 19 -5.934 5.088 12.091
122 HG2 ARG 19 1HG ARG 19 -3.838 3.942 11.265
123 HG3 ARG 19 2HG ARG 19 -3.034 5.504 11.440
124 HD2 ARG 19 1HD ARG 19 -2.588 4.504 13.473
125 HD3 ARG 19 2HD ARG 19 -4.029 5.452 13.839
126 HE ARG 19 HE ARG 19 -5.075 3.077 13.158
127 HH11 ARG 19 1HH1 ARG 19 -2.495 3.953 15.325
128 HH12 ARG 19 2HH1 ARG 19 -2.760 2.613 16.391
129 HH21 ARG 19 1HH2 ARG 19 -5.433 1.308 14.553
130 HH22 ARG 19 2HH2 ARG 19 -4.431 1.108 15.950
131 H LEU 20 H LEU 20 -5.317 5.666 7.532
132 HA LEU 20 HA LEU 20 -2.705 7.005 7.593
133 HB2 LEU 20 1HB LEU 20 -2.490 6.249 5.260
134 HB3 LEU 20 2HB LEU 20 -2.704 4.922 6.400
135 HG LEU 20 HG LEU 20 -5.103 5.971 4.979
136 HD11 LEU 20 1HD1 LEU 20 -4.312 3.961 3.335
137 HD12 LEU 20 2HD1 LEU 20 -2.773 4.750 3.684
138 HD13 LEU 20 3HD1 LEU 20 -4.105 5.680 2.994
139 HD21 LEU 20 3HD2 LEU 20 -4.622 3.099 5.218
140 HD22 LEU 20 1HD2 LEU 20 -6.032 4.058 5.671
141 HD23 LEU 20 2HD2 LEU 20 -4.652 3.948 6.764
142 H THR 21 H THR 21 -4.153 8.943 8.158
143 HA THR 21 HA THR 21 -5.821 10.148 6.263
144 HB THR 21 HB THR 21 -5.271 12.300 7.464
145 HG1 THR 21 HG1 THR 21 -3.914 10.769 9.385
146 HG21 THR 21 3HG2 THR 21 -5.909 10.125 9.433
147 HG22 THR 21 1HG2 THR 21 -7.033 10.544 8.140
148 HG23 THR 21 2HG2 THR 21 -6.570 11.758 9.332
149 H ARG 22 H ARG 22 -2.393 10.846 6.969
150 HA ARG 22 HA ARG 22 -2.183 12.372 4.500
151 HB2 ARG 22 1HB ARG 22 -1.145 13.134 6.668
152 HB3 ARG 22 2HB ARG 22 -0.018 11.793 6.523
153 HG2 ARG 22 1HG ARG 22 1.002 12.710 4.620
154 HG3 ARG 22 2HG ARG 22 -0.320 13.851 4.364
155 HD2 ARG 22 1HD ARG 22 0.299 14.920 6.542
156 HD3 ARG 22 2HD ARG 22 1.720 13.878 6.580
157 HE ARG 22 HE ARG 22 1.427 15.464 4.182
158 HH11 ARG 22 1HH1 ARG 22 2.773 15.257 7.385
159 HH12 ARG 22 2HH1 ARG 22 4.014 16.426 7.081
160 HH21 ARG 22 1HH2 ARG 22 3.058 17.005 3.768
161 HH22 ARG 22 2HH2 ARG 22 4.174 17.422 5.024
162 H SER 23 H SER 23 -2.204 10.963 2.807
163 HA SER 23 HA SER 23 0.193 9.506 2.273
164 HB2 SER 23 1HB SER 23 -0.879 7.276 2.019
165 HB3 SER 23 2HB SER 23 -0.864 7.834 3.692
166 HG SER 23 HG SER 23 -3.092 8.454 2.131
167 H LEU 24 H LEU 24 0.542 9.866 0.194
168 HA LEU 24 HA LEU 24 -1.147 11.048 -1.597
169 HB2 LEU 24 1HB LEU 24 1.148 9.163 -2.023
170 HB3 LEU 24 2HB LEU 24 0.288 9.893 -3.377
171 HG LEU 24 HG LEU 24 1.483 11.615 -1.238
172 HD11 LEU 24 1HD1 LEU 24 3.180 11.365 -3.550
173 HD12 LEU 24 2HD1 LEU 24 2.992 9.812 -2.738
174 HD13 LEU 24 3HD1 LEU 24 3.581 11.210 -1.840
175 HD21 LEU 24 3HD2 LEU 24 1.079 13.309 -2.659
176 HD22 LEU 24 1HD2 LEU 24 -0.079 12.188 -3.376
177 HD23 LEU 24 2HD2 LEU 24 1.529 12.365 -4.080
178 H CYS 25 H CYS 25 -0.592 7.552 -1.243
179 HA CYS 25 HA CYS 25 -3.160 7.104 -2.616
180 HB2 CYS 25 1HB CYS 25 -2.269 5.080 -3.604
181 HB3 CYS 25 2HB CYS 25 -1.223 6.435 -4.018
182 H ALA 26 H ALA 26 -4.286 5.136 -1.993
183 HA ALA 26 HA ALA 26 -3.952 4.608 0.861
184 HB1 ALA 26 3HB ALA 26 -6.208 3.312 0.297
185 HB2 ALA 26 1HB ALA 26 -6.163 5.048 0.602
186 HB3 ALA 26 2HB ALA 26 -6.203 4.444 -1.055
187 H CYS 27 H CYS 27 -2.601 2.990 1.320
188 HA CYS 27 HA CYS 27 -2.414 0.687 -0.461
189 HB2 CYS 27 1HB CYS 27 -0.797 1.557 1.937
190 HB3 CYS 27 2HB CYS 27 -0.540 0.026 1.108
191 H SER 28 H SER 28 -4.860 0.937 0.892
192 HA SER 28 HA SER 28 -4.722 -1.368 2.724
193 HB2 SER 28 1HB SER 28 -6.639 -0.424 3.949
194 HB3 SER 28 2HB SER 28 -5.263 0.679 3.969
195 HG SER 28 HG SER 28 -7.010 1.905 3.444
196 H ASP 29 H ASP 29 -7.125 -2.245 2.985
197 HA ASP 29 HA ASP 29 -7.833 -3.271 0.421
198 HB2 ASP 29 1HB ASP 29 -8.223 -4.823 2.091
199 HB3 ASP 29 2HB ASP 29 -8.852 -3.616 3.210
200 H ASP 30 H ASP 30 -9.459 -1.095 2.714
201 HA ASP 30 HA ASP 30 -11.839 -0.636 1.504
202 HB2 ASP 30 1HB ASP 30 -9.982 1.114 3.042
203 HB3 ASP 30 2HB ASP 30 -11.340 1.883 2.224
204 H CYS 31 H CYS 31 -8.730 0.768 0.563
205 HA CYS 31 HA CYS 31 -9.396 2.635 -1.276
206 HB2 CYS 31 1HB CYS 31 -7.285 2.385 -2.186
207 HB3 CYS 31 2HB CYS 31 -7.076 1.589 -0.630
208 H LYS 32 H LYS 32 -9.538 -0.861 -1.735
209 HA LYS 32 HA LYS 32 -10.034 -0.994 -4.453
210 HB2 LYS 32 1HB LYS 32 -10.791 -2.695 -2.121
211 HB3 LYS 32 2HB LYS 32 -11.538 -3.032 -3.677
212 HG2 LYS 32 1HG LYS 32 -9.737 -4.399 -3.833
213 HG3 LYS 32 2HG LYS 32 -9.024 -2.927 -4.496
214 HD2 LYS 32 1HD LYS 32 -7.818 -2.487 -2.566
215 HD3 LYS 32 2HD LYS 32 -8.886 -3.464 -1.556
216 HE2 LYS 32 1HE LYS 32 -7.984 -5.394 -3.138
217 HE3 LYS 32 2HE LYS 32 -6.620 -4.287 -3.294
218 HZ1 LYS 32 3HZ LYS 32 -7.707 -5.178 -0.682
219 HZ2 LYS 32 1HZ LYS 32 -6.264 -4.342 -0.966
220 HZ3 LYS 32 2HZ LYS 32 -6.423 -5.950 -1.467
221 H ASP 33 H ASP 33 -12.333 -0.476 -1.805
222 HA ASP 33 HA ASP 33 -14.632 -0.384 -3.481
223 HB2 ASP 33 1HB ASP 33 -14.444 -0.766 -0.902
224 HB3 ASP 33 2HB ASP 33 -14.504 0.993 -0.819
225 H GLN 34 H GLN 34 -13.043 2.234 -1.646
226 HA GLN 34 HA GLN 34 -14.386 4.352 -2.829
227 HB2 GLN 34 1HB GLN 34 -11.613 4.197 -1.654
228 HB3 GLN 34 2HB GLN 34 -12.347 5.708 -2.173
229 HG2 GLN 34 1HG GLN 34 -12.523 5.259 0.262
230 HG3 GLN 34 2HG GLN 34 -14.069 5.524 -0.544
231 HE21 GLN 34 1HE2 GLN 34 -15.591 4.232 0.168
232 HE22 GLN 34 2HE2 GLN 34 -15.390 2.597 0.684
233 H GLY 35 H GLY 35 -11.048 3.341 -3.612
234 HA2 GLY 35 1HA GLY 35 -10.579 2.878 -6.005
235 HA3 GLY 35 2HA GLY 35 -11.542 4.302 -6.364
236 H ASP 36 H ASP 36 -9.110 3.901 -3.826
237 HA ASP 36 HA ASP 36 -7.436 5.883 -5.217
238 HB2 ASP 36 1HB ASP 36 -8.136 5.774 -2.280
239 HB3 ASP 36 2HB ASP 36 -6.839 6.770 -2.936
240 H CYS 37 H CYS 37 -7.081 3.125 -5.438
241 HA CYS 37 HA CYS 37 -5.038 2.296 -3.571
242 HB2 CYS 37 1HB CYS 37 -5.828 0.931 -6.146
243 HB3 CYS 37 2HB CYS 37 -5.027 0.214 -4.752
244 H CYS 38 H CYS 38 -2.885 2.370 -3.851
245 HA CYS 38 HA CYS 38 -1.628 4.140 -5.498
246 HB2 CYS 38 1HB CYS 38 -0.353 1.521 -4.709
247 HB3 CYS 38 2HB CYS 38 0.435 3.076 -4.954
248 H ILE 39 H ILE 39 0.055 3.571 -7.227
249 HA ILE 39 HA ILE 39 -1.317 2.538 -9.480
250 HB ILE 39 HB ILE 39 0.384 4.284 -9.699
251 HG12 ILE 39 1HG1 ILE 39 1.483 1.910 -11.170
252 HG13 ILE 39 2HG1 ILE 39 -0.149 2.475 -11.508
253 HG21 ILE 39 1HG2 ILE 39 2.666 3.967 -9.289
254 HG22 ILE 39 2HG2 ILE 39 1.865 3.217 -7.910
255 HG23 ILE 39 3HG2 ILE 39 2.499 2.213 -9.213
256 HD11 ILE 39 3HD1 ILE 39 2.090 3.349 -12.756
257 HD12 ILE 39 1HD1 ILE 39 0.578 4.250 -12.651
258 HD13 ILE 39 2HD1 ILE 39 1.883 4.579 -11.510
259 H ASN 40 H ASN 40 1.355 1.282 -7.507
260 HA ASN 40 HA ASN 40 0.986 -1.335 -8.808
261 HB2 ASN 40 1HB ASN 40 3.335 -1.741 -7.743
262 HB3 ASN 40 2HB ASN 40 3.208 -0.793 -9.222
263 HD21 ASN 40 1HD2 ASN 40 3.126 -0.366 -5.703
264 HD22 ASN 40 2HD2 ASN 40 4.042 1.100 -5.689
265 H TYR 41 H TYR 41 -0.836 -0.756 -6.904
266 HA TYR 41 HA TYR 41 -0.135 -1.404 -4.260
267 HB2 TYR 41 1HB TYR 41 -2.227 -0.303 -4.706
268 HB3 TYR 41 2HB TYR 41 -2.767 -1.631 -5.726
269 HD1 TYR 41 HD2 TYR 41 -3.483 -3.755 -4.725
270 HD2 TYR 41 HD1 TYR 41 -2.352 -0.443 -2.305
271 HE1 TYR 41 HE2 TYR 41 -4.547 -4.821 -2.780
272 HE2 TYR 41 HE1 TYR 41 -3.412 -1.500 -0.354
273 HH TYR 41 HH TYR 41 -4.200 -3.524 0.443
274 H SER 42 H SER 42 -1.673 -3.425 -6.762
275 HA SER 42 HA SER 42 -1.487 -5.814 -5.225
276 HB2 SER 42 1HB SER 42 -2.120 -6.943 -7.356
277 HB3 SER 42 2HB SER 42 -3.191 -5.606 -6.940
278 HG SER 42 HG SER 42 -2.341 -5.771 -9.198
279 H SER 43 H SER 43 0.444 -4.414 -7.837
280 HA SER 43 HA SER 43 2.154 -6.524 -8.362
281 HB2 SER 43 1HB SER 43 2.200 -4.538 -9.733
282 HB3 SER 43 2HB SER 43 2.719 -3.552 -8.366
283 HG SER 43 HG SER 43 4.661 -4.771 -8.338
284 H VAL 44 H VAL 44 2.290 -4.132 -5.774
285 HA VAL 44 HA VAL 44 4.765 -5.250 -4.733
286 HB VAL 44 HB VAL 44 3.025 -3.023 -3.663
287 HG11 VAL 44 1HG1 VAL 44 5.836 -3.225 -2.828
288 HG12 VAL 44 2HG1 VAL 44 4.400 -2.793 -1.896
289 HG13 VAL 44 3HG1 VAL 44 4.775 -4.489 -2.206
290 HG21 VAL 44 3HG2 VAL 44 4.569 -1.503 -4.614
291 HG22 VAL 44 1HG2 VAL 44 5.707 -2.793 -5.006
292 HG23 VAL 44 2HG2 VAL 44 4.183 -2.664 -5.884
293 H CYS 45 H CYS 45 1.430 -4.766 -3.573
294 HA CYS 45 HA CYS 45 1.813 -6.343 -1.228
295 HB2 CYS 45 1HB CYS 45 -0.720 -5.412 -2.597
296 HB3 CYS 45 2HB CYS 45 -0.662 -6.176 -1.012
297 H GLN 46 H GLN 46 -0.286 -6.920 -4.058
298 HA GLN 46 HA GLN 46 -0.624 -9.677 -3.452
299 HB2 GLN 46 1HB GLN 46 -1.223 -8.030 -5.905
300 HB3 GLN 46 2HB GLN 46 -1.568 -9.752 -5.817
301 HG2 GLN 46 1HG GLN 46 -2.809 -9.030 -3.603
302 HG3 GLN 46 2HG GLN 46 -2.878 -7.478 -4.434
303 HE21 GLN 46 1HE2 GLN 46 -5.163 -8.850 -3.795
304 HE22 GLN 46 2HE2 GLN 46 -5.919 -9.423 -5.238
305 H GLY 47 H GLY 47 1.540 -10.439 -3.230
306 HA2 GLY 47 1HA GLY 47 2.557 -11.804 -5.422
307 HA3 GLY 47 2HA GLY 47 3.446 -10.290 -5.331
308 H GLU 48 H GLU 48 4.992 -10.013 -3.780
309 HA GLU 48 HA GLU 48 6.684 -10.738 -2.422
310 HB2 GLU 48 1HB GLU 48 4.734 -10.222 -0.871
311 HB3 GLU 48 2HB GLU 48 4.456 -11.957 -0.796
312 HG2 GLU 48 1HG GLU 48 5.722 -11.280 1.118
313 HG3 GLU 48 2HG GLU 48 6.746 -12.255 0.067
314 H LYS 49 H LYS 49 6.459 -12.434 -4.534
315 HA LYS 49 HA LYS 49 6.907 -15.076 -3.308
316 HB2 LYS 49 1HB LYS 49 5.493 -14.321 -5.837
317 HB3 LYS 49 2HB LYS 49 6.303 -15.878 -5.730
318 HG2 LYS 49 1HG LYS 49 4.938 -16.518 -3.856
319 HG3 LYS 49 2HG LYS 49 4.200 -14.915 -3.803
320 HD2 LYS 49 1HD LYS 49 2.590 -16.028 -4.978
321 HD3 LYS 49 2HD LYS 49 3.614 -15.506 -6.318
322 HE2 LYS 49 1HE LYS 49 4.214 -18.112 -5.015
323 HE3 LYS 49 2HE LYS 49 2.807 -18.014 -6.073
324 HZ1 LYS 49 3HZ LYS 49 4.768 -18.704 -7.291
325 HZ2 LYS 49 1HZ LYS 49 5.591 -17.301 -6.822
326 HZ3 LYS 49 2HZ LYS 49 4.243 -17.191 -7.837
327 H SER 50 H SER 50 8.483 -16.430 -4.388
328 HA SER 50 HA SER 50 10.660 -14.824 -5.509
329 HB2 SER 50 1HB SER 50 11.057 -16.288 -3.497
330 HB3 SER 50 2HB SER 50 10.780 -17.686 -4.536
331 HG SER 50 HG SER 50 12.901 -17.444 -4.718
332 H SER 51 H SER 51 8.537 -15.328 -7.238
333 HA SER 51 HA SER 51 9.854 -17.060 -9.212
334 HB2 SER 51 1HB SER 51 8.025 -18.378 -8.321
335 HB3 SER 51 2HB SER 51 6.899 -17.041 -8.553
336 HG SER 51 HG SER 51 7.509 -17.233 -10.857
337 H GLY 52 H GLY 52 10.067 -16.157 -11.167
338 HA2 GLY 52 1HA GLY 52 8.300 -14.552 -12.534
339 HA3 GLY 52 2HA GLY 52 9.258 -13.443 -11.565
340 HA PRO 53 HA PRO 53 11.463 -15.041 -15.545
341 HB2 PRO 53 1HB PRO 53 10.572 -13.277 -17.406
342 HB3 PRO 53 2HB PRO 53 9.797 -14.839 -17.114
343 HG2 PRO 53 1HG PRO 53 9.017 -12.123 -16.126
344 HG3 PRO 53 2HG PRO 53 7.989 -13.418 -16.767
345 HD2 PRO 53 1HD PRO 53 8.247 -12.942 -14.114
346 HD3 PRO 53 2HD PRO 53 7.978 -14.569 -14.770
347 H SER 54 H SER 54 11.179 -12.402 -13.587
348 HA SER 54 HA SER 54 12.408 -10.239 -14.551
349 HB2 SER 54 1HB SER 54 13.211 -11.630 -11.983
350 HB3 SER 54 2HB SER 54 13.538 -9.941 -12.373
351 HG SER 54 HG SER 54 11.417 -9.476 -12.207
352 H SER 55 H SER 55 14.158 -13.186 -13.602
353 HA SER 55 HA SER 55 16.138 -14.059 -14.320
354 HB2 SER 55 1HB SER 55 15.262 -13.322 -16.591
355 HB3 SER 55 2HB SER 55 16.243 -11.869 -16.397
356 HG SER 55 HG SER 55 18.055 -13.050 -16.536
357 H GLY 56 H GLY 56 16.145 -12.321 -12.173
358 HA2 GLY 56 1HA GLY 56 18.774 -11.020 -12.506
359 HA3 GLY 56 2HA GLY 56 17.471 -10.228 -11.634
Start of MODEL 6
1 H1 GLY 1 H GLY 1 18.281 3.225 -13.635
2 HA2 GLY 1 1HA GLY 1 17.330 3.035 -11.510
3 HA3 GLY 1 2HA GLY 1 16.049 4.127 -12.010
4 H SER 2 H SER 2 15.683 1.719 -10.544
5 HA SER 2 HA SER 2 14.854 -0.408 -12.225
6 HB2 SER 2 1HB SER 2 14.314 0.284 -9.343
7 HB3 SER 2 2HB SER 2 13.574 -1.121 -10.109
8 HG SER 2 HG SER 2 15.747 -1.789 -10.646
9 H SER 3 H SER 3 13.126 2.257 -10.660
10 HA SER 3 HA SER 3 11.161 2.400 -12.685
11 HB2 SER 3 1HB SER 3 10.443 0.295 -11.480
12 HB3 SER 3 2HB SER 3 10.119 1.299 -10.068
13 HG SER 3 HG SER 3 8.231 1.484 -10.997
14 H GLY 4 H GLY 4 10.543 4.457 -12.720
15 HA2 GLY 4 1HA GLY 4 11.309 6.340 -10.804
16 HA3 GLY 4 2HA GLY 4 10.099 6.606 -12.050
17 H SER 5 H SER 5 10.504 6.956 -8.913
18 HA SER 5 HA SER 5 7.798 6.039 -8.199
19 HB2 SER 5 1HB SER 5 10.295 6.420 -6.568
20 HB3 SER 5 2HB SER 5 8.709 6.439 -5.797
21 HG SER 5 HG SER 5 8.840 4.352 -5.841
22 H SER 6 H SER 6 6.927 7.942 -9.247
23 HA SER 6 HA SER 6 7.546 10.527 -8.091
24 HB2 SER 6 1HB SER 6 7.100 10.333 -10.509
25 HB3 SER 6 2HB SER 6 5.469 9.761 -10.158
26 HG SER 6 HG SER 6 6.356 12.276 -10.320
27 H GLY 7 H GLY 7 6.578 8.753 -6.181
28 HA2 GLY 7 1HA GLY 7 5.129 8.847 -4.390
29 HA3 GLY 7 2HA GLY 7 4.402 10.271 -5.117
30 H TRP 8 H TRP 8 4.668 7.186 -6.757
31 HA TRP 8 HA TRP 8 1.794 6.730 -6.349
32 HB2 TRP 8 1HB TRP 8 3.260 6.735 -8.992
33 HB3 TRP 8 2HB TRP 8 1.648 6.058 -8.772
34 HD1 TRP 8 HD1 TRP 8 3.456 9.320 -9.292
35 HE1 TRP 8 HE1 TRP 8 1.746 11.237 -9.436
36 HE3 TRP 8 HE3 TRP 8 -0.725 6.793 -7.783
37 HZ2 TRP 8 HZ2 TRP 8 -1.012 11.627 -8.972
38 HZ3 TRP 8 HZ3 TRP 8 -2.859 8.012 -7.660
39 HH2 TRP 8 HH2 TRP 8 -2.996 10.379 -8.242
40 H THR 9 H THR 9 3.220 5.303 -4.792
41 HA THR 9 HA THR 9 3.091 2.626 -5.876
42 HB THR 9 HB THR 9 5.393 2.029 -5.105
43 HG1 THR 9 HG1 THR 9 5.412 4.775 -4.580
44 HG21 THR 9 3HG2 THR 9 4.778 2.552 -7.501
45 HG22 THR 9 1HG2 THR 9 6.485 2.732 -7.096
46 HG23 THR 9 2HG2 THR 9 5.457 4.159 -7.237
47 H CYS 10 H CYS 10 3.724 0.995 -4.112
48 HA CYS 10 HA CYS 10 3.108 2.032 -1.436
49 HB2 CYS 10 1HB CYS 10 1.740 -0.290 -2.803
50 HB3 CYS 10 2HB CYS 10 1.615 0.044 -1.079
51 H ASN 11 H ASN 11 4.321 1.182 0.147
52 HA ASN 11 HA ASN 11 6.258 -0.875 -0.593
53 HB2 ASN 11 1HB ASN 11 6.771 1.401 0.609
54 HB3 ASN 11 2HB ASN 11 6.266 0.530 2.053
55 HD21 ASN 11 1HD2 ASN 11 8.831 1.552 1.676
56 HD22 ASN 11 2HD2 ASN 11 9.941 0.232 1.580
57 H LYS 12 H LYS 12 6.790 -2.559 1.019
58 HA LYS 12 HA LYS 12 4.797 -4.299 1.547
59 HB2 LYS 12 1HB LYS 12 7.374 -3.783 2.990
60 HB3 LYS 12 2HB LYS 12 6.270 -5.016 3.583
61 HG2 LYS 12 1HG LYS 12 7.692 -6.227 2.234
62 HG3 LYS 12 2HG LYS 12 6.336 -5.900 1.152
63 HD2 LYS 12 1HD LYS 12 7.530 -4.417 -0.119
64 HD3 LYS 12 2HD LYS 12 8.579 -3.948 1.221
65 HE2 LYS 12 1HE LYS 12 9.883 -5.188 -0.360
66 HE3 LYS 12 2HE LYS 12 9.658 -6.186 1.076
67 HZ1 LYS 12 3HZ LYS 12 9.012 -6.806 -1.566
68 HZ2 LYS 12 1HZ LYS 12 7.556 -6.689 -0.713
69 HZ3 LYS 12 2HZ LYS 12 8.762 -7.750 -0.184
70 H PHE 13 H PHE 13 6.083 -2.107 4.054
71 HA PHE 13 HA PHE 13 4.135 -2.630 5.974
72 HB2 PHE 13 1HB PHE 13 5.651 -0.049 5.537
73 HB3 PHE 13 2HB PHE 13 4.830 -0.521 7.021
74 HD1 PHE 13 HD2 PHE 13 5.641 -2.625 8.205
75 HD2 PHE 13 HD1 PHE 13 7.864 -0.651 5.160
76 HE1 PHE 13 HE2 PHE 13 7.692 -3.736 8.987
77 HE2 PHE 13 HE1 PHE 13 9.919 -1.761 5.935
78 HZ PHE 13 HZ PHE 13 9.836 -3.304 7.852
79 H ARG 14 H ARG 14 4.261 -0.021 3.559
80 HA ARG 14 HA ARG 14 2.002 1.384 4.190
81 HB2 ARG 14 1HB ARG 14 3.020 0.666 1.436
82 HB3 ARG 14 2HB ARG 14 1.819 1.908 1.759
83 HG2 ARG 14 1HG ARG 14 4.487 2.013 3.099
84 HG3 ARG 14 2HG ARG 14 4.294 2.578 1.438
85 HD2 ARG 14 1HD ARG 14 2.231 3.852 2.527
86 HD3 ARG 14 2HD ARG 14 3.230 3.702 3.972
87 HE ARG 14 HE ARG 14 4.576 4.755 1.637
88 HH11 ARG 14 1HH1 ARG 14 2.815 5.460 4.556
89 HH12 ARG 14 2HH1 ARG 14 3.425 7.076 4.688
90 HH21 ARG 14 1HH2 ARG 14 5.386 6.881 1.800
91 HH22 ARG 14 2HH2 ARG 14 4.886 7.884 3.119
92 H CYS 15 H CYS 15 2.142 -1.445 2.026
93 HA CYS 15 HA CYS 15 -0.508 -1.673 1.360
94 HB2 CYS 15 1HB CYS 15 1.609 -3.754 1.843
95 HB3 CYS 15 2HB CYS 15 -0.022 -4.216 1.368
96 H GLY 16 H GLY 16 -1.866 -1.052 3.054
97 HA2 GLY 16 1HA GLY 16 -3.504 -2.094 4.495
98 HA3 GLY 16 2HA GLY 16 -2.229 -3.136 5.109
99 H GLU 17 H GLU 17 -2.144 0.372 4.643
100 HA GLU 17 HA GLU 17 -1.534 0.643 7.503
101 HB2 GLU 17 1HB GLU 17 -0.497 2.763 6.942
102 HB3 GLU 17 2HB GLU 17 0.154 1.494 5.914
103 HG2 GLU 17 1HG GLU 17 -1.054 2.248 4.042
104 HG3 GLU 17 2HG GLU 17 -2.080 3.289 5.027
105 H LYS 18 H LYS 18 -2.558 2.207 8.773
106 HA LYS 18 HA LYS 18 -5.169 3.069 7.735
107 HB2 LYS 18 1HB LYS 18 -4.305 2.865 10.621
108 HB3 LYS 18 2HB LYS 18 -5.937 3.127 10.020
109 HG2 LYS 18 1HG LYS 18 -4.400 0.649 9.329
110 HG3 LYS 18 2HG LYS 18 -5.308 0.787 10.837
111 HD2 LYS 18 1HD LYS 18 -6.928 -0.121 9.511
112 HD3 LYS 18 2HD LYS 18 -7.216 1.588 9.181
113 HE2 LYS 18 1HE LYS 18 -5.409 1.133 7.291
114 HE3 LYS 18 2HE LYS 18 -6.019 -0.513 7.456
115 HZ1 LYS 18 3HZ LYS 18 -8.052 1.542 7.279
116 HZ2 LYS 18 1HZ LYS 18 -7.971 0.028 6.526
117 HZ3 LYS 18 2HZ LYS 18 -7.121 1.340 5.880
118 H ARG 19 H ARG 19 -2.960 4.584 6.998
119 HA ARG 19 HA ARG 19 -3.741 7.157 7.951
120 HB2 ARG 19 1HB ARG 19 -1.634 7.845 8.940
121 HB3 ARG 19 2HB ARG 19 -2.272 6.454 9.806
122 HG2 ARG 19 1HG ARG 19 -0.733 5.106 8.180
123 HG3 ARG 19 2HG ARG 19 0.105 6.651 8.026
124 HD2 ARG 19 1HD ARG 19 0.215 6.715 10.539
125 HD3 ARG 19 2HD ARG 19 -0.372 5.052 10.532
126 HE ARG 19 HE ARG 19 1.693 4.346 9.789
127 HH11 ARG 19 1HH1 ARG 19 1.506 7.820 9.683
128 HH12 ARG 19 2HH1 ARG 19 3.202 8.033 9.400
129 HH21 ARG 19 1HH2 ARG 19 3.928 4.613 9.416
130 HH22 ARG 19 2HH2 ARG 19 4.579 6.209 9.247
131 H LEU 20 H LEU 20 -2.596 8.904 6.839
132 HA LEU 20 HA LEU 20 -0.807 8.257 4.686
133 HB2 LEU 20 1HB LEU 20 -2.316 9.143 2.917
134 HB3 LEU 20 2HB LEU 20 -2.806 7.588 3.587
135 HG LEU 20 HG LEU 20 -4.031 10.099 4.648
136 HD11 LEU 20 1HD1 LEU 20 -4.881 8.690 2.122
137 HD12 LEU 20 2HD1 LEU 20 -4.204 10.315 2.227
138 HD13 LEU 20 3HD1 LEU 20 -5.777 9.967 2.946
139 HD21 LEU 20 3HD2 LEU 20 -5.571 7.639 4.137
140 HD22 LEU 20 1HD2 LEU 20 -5.573 8.715 5.535
141 HD23 LEU 20 2HD2 LEU 20 -4.298 7.512 5.350
142 H THR 21 H THR 21 0.599 9.867 4.781
143 HA THR 21 HA THR 21 -0.186 12.467 5.796
144 HB THR 21 HB THR 21 2.524 11.488 4.877
145 HG1 THR 21 HG1 THR 21 1.243 10.730 6.956
146 HG21 THR 21 3HG2 THR 21 2.324 13.925 4.773
147 HG22 THR 21 1HG2 THR 21 3.400 13.434 6.081
148 HG23 THR 21 2HG2 THR 21 1.753 13.954 6.441
149 H ARG 22 H ARG 22 -1.562 13.126 4.060
150 HA ARG 22 HA ARG 22 -2.074 14.155 2.093
151 HB2 ARG 22 1HB ARG 22 0.775 15.077 2.481
152 HB3 ARG 22 2HB ARG 22 -0.279 15.708 1.223
153 HG2 ARG 22 1HG ARG 22 -1.866 16.434 2.980
154 HG3 ARG 22 2HG ARG 22 -0.704 15.904 4.197
155 HD2 ARG 22 1HD ARG 22 0.037 17.861 2.044
156 HD3 ARG 22 2HD ARG 22 -0.717 18.382 3.550
157 HE ARG 22 HE ARG 22 1.987 17.413 3.193
158 HH11 ARG 22 1HH1 ARG 22 -0.593 18.103 5.428
159 HH12 ARG 22 2HH1 ARG 22 0.456 18.238 6.800
160 HH21 ARG 22 1HH2 ARG 22 3.378 17.588 4.992
161 HH22 ARG 22 2HH2 ARG 22 2.714 17.945 6.550
162 H SER 23 H SER 23 -1.356 11.466 1.814
163 HA SER 23 HA SER 23 0.513 11.143 -0.335
164 HB2 SER 23 1HB SER 23 -0.236 9.415 1.475
165 HB3 SER 23 2HB SER 23 -1.569 9.095 0.366
166 HG SER 23 HG SER 23 0.838 8.095 0.249
167 H LEU 24 H LEU 24 0.026 10.453 -2.475
168 HA LEU 24 HA LEU 24 -2.160 11.864 -3.646
169 HB2 LEU 24 1HB LEU 24 -0.087 9.987 -4.745
170 HB3 LEU 24 2HB LEU 24 -1.355 10.685 -5.752
171 HG LEU 24 HG LEU 24 0.563 12.388 -4.183
172 HD11 LEU 24 1HD1 LEU 24 0.883 11.555 -7.058
173 HD12 LEU 24 2HD1 LEU 24 1.782 10.842 -5.720
174 HD13 LEU 24 3HD1 LEU 24 1.974 12.553 -6.096
175 HD21 LEU 24 3HD2 LEU 24 -1.596 12.816 -6.133
176 HD22 LEU 24 1HD2 LEU 24 -0.126 13.751 -6.414
177 HD23 LEU 24 2HD2 LEU 24 -0.972 13.881 -4.872
178 H CYS 25 H CYS 25 -1.384 8.422 -3.238
179 HA CYS 25 HA CYS 25 -4.204 7.808 -3.836
180 HB2 CYS 25 1HB CYS 25 -3.236 5.468 -4.366
181 HB3 CYS 25 2HB CYS 25 -3.011 6.753 -5.548
182 H ALA 26 H ALA 26 -4.519 5.342 -2.928
183 HA ALA 26 HA ALA 26 -3.891 5.551 -0.057
184 HB1 ALA 26 3HB ALA 26 -5.949 4.611 0.466
185 HB2 ALA 26 1HB ALA 26 -6.326 5.655 -0.906
186 HB3 ALA 26 2HB ALA 26 -6.152 3.915 -1.141
187 H CYS 27 H CYS 27 -2.637 4.039 0.814
188 HA CYS 27 HA CYS 27 -2.116 1.596 -0.738
189 HB2 CYS 27 1HB CYS 27 -0.458 3.110 1.273
190 HB3 CYS 27 2HB CYS 27 -0.062 1.464 0.786
191 H SER 28 H SER 28 -4.457 1.711 0.777
192 HA SER 28 HA SER 28 -3.845 -0.236 2.901
193 HB2 SER 28 1HB SER 28 -5.687 0.655 4.231
194 HB3 SER 28 2HB SER 28 -4.533 1.940 3.870
195 HG SER 28 HG SER 28 -6.871 1.462 2.340
196 H ASP 29 H ASP 29 -6.094 -1.317 3.553
197 HA ASP 29 HA ASP 29 -6.880 -2.839 1.292
198 HB2 ASP 29 1HB ASP 29 -6.830 -3.717 3.621
199 HB3 ASP 29 2HB ASP 29 -8.213 -2.696 4.003
200 H ASP 30 H ASP 30 -8.088 0.042 2.761
201 HA ASP 30 HA ASP 30 -10.693 -0.139 1.513
202 HB2 ASP 30 1HB ASP 30 -9.323 1.872 3.268
203 HB3 ASP 30 2HB ASP 30 -10.786 2.316 2.394
204 H CYS 31 H CYS 31 -8.482 -0.261 -0.283
205 HA CYS 31 HA CYS 31 -8.579 2.335 -1.648
206 HB2 CYS 31 1HB CYS 31 -6.563 1.814 -2.669
207 HB3 CYS 31 2HB CYS 31 -6.386 1.017 -1.109
208 H LYS 32 H LYS 32 -9.419 -1.040 -1.985
209 HA LYS 32 HA LYS 32 -10.074 -0.922 -4.761
210 HB2 LYS 32 1HB LYS 32 -10.989 -2.894 -2.659
211 HB3 LYS 32 2HB LYS 32 -11.109 -3.112 -4.399
212 HG2 LYS 32 1HG LYS 32 -8.737 -3.231 -4.621
213 HG3 LYS 32 2HG LYS 32 -8.504 -2.763 -2.935
214 HD2 LYS 32 1HD LYS 32 -9.340 -4.821 -2.143
215 HD3 LYS 32 2HD LYS 32 -10.019 -5.240 -3.717
216 HE2 LYS 32 1HE LYS 32 -8.132 -6.523 -3.762
217 HE3 LYS 32 2HE LYS 32 -7.492 -5.036 -4.462
218 HZ1 LYS 32 3HZ LYS 32 -5.940 -5.533 -2.861
219 HZ2 LYS 32 1HZ LYS 32 -7.079 -6.145 -1.769
220 HZ3 LYS 32 2HZ LYS 32 -6.951 -4.476 -2.010
221 H ASP 33 H ASP 33 -11.967 -0.759 -1.766
222 HA ASP 33 HA ASP 33 -14.507 -0.620 -2.941
223 HB2 ASP 33 1HB ASP 33 -13.663 0.714 -0.363
224 HB3 ASP 33 2HB ASP 33 -15.286 0.201 -0.813
225 H GLN 34 H GLN 34 -12.299 1.976 -1.928
226 HA GLN 34 HA GLN 34 -14.027 4.045 -2.914
227 HB2 GLN 34 1HB GLN 34 -11.345 3.915 -1.639
228 HB3 GLN 34 2HB GLN 34 -11.714 5.344 -2.595
229 HG2 GLN 34 1HG GLN 34 -13.593 4.379 -0.477
230 HG3 GLN 34 2HG GLN 34 -12.200 5.381 -0.077
231 HE21 GLN 34 1HE2 GLN 34 -14.512 6.422 0.580
232 HE22 GLN 34 2HE2 GLN 34 -15.000 7.672 -0.509
233 H GLY 35 H GLY 35 -10.989 2.561 -4.001
234 HA2 GLY 35 1HA GLY 35 -10.571 2.152 -6.322
235 HA3 GLY 35 2HA GLY 35 -11.605 3.518 -6.712
236 H ASP 36 H ASP 36 -8.943 3.339 -4.380
237 HA ASP 36 HA ASP 36 -7.452 5.258 -6.041
238 HB2 ASP 36 1HB ASP 36 -8.702 6.118 -3.869
239 HB3 ASP 36 2HB ASP 36 -7.283 5.449 -3.066
240 H CYS 37 H CYS 37 -7.116 2.426 -5.921
241 HA CYS 37 HA CYS 37 -4.926 1.788 -4.192
242 HB2 CYS 37 1HB CYS 37 -5.801 0.295 -6.668
243 HB3 CYS 37 2HB CYS 37 -4.888 -0.341 -5.304
244 H CYS 38 H CYS 38 -2.996 2.693 -4.458
245 HA CYS 38 HA CYS 38 -1.956 4.071 -6.532
246 HB2 CYS 38 1HB CYS 38 -0.379 2.143 -4.814
247 HB3 CYS 38 2HB CYS 38 0.281 3.508 -5.710
248 H ILE 39 H ILE 39 -0.853 3.690 -8.421
249 HA ILE 39 HA ILE 39 -1.554 1.641 -10.068
250 HB ILE 39 HB ILE 39 -0.367 3.642 -10.846
251 HG12 ILE 39 1HG1 ILE 39 1.199 2.462 -12.454
252 HG13 ILE 39 2HG1 ILE 39 0.862 0.979 -11.569
253 HG21 ILE 39 1HG2 ILE 39 2.234 2.415 -10.024
254 HG22 ILE 39 2HG2 ILE 39 1.872 4.086 -10.454
255 HG23 ILE 39 3HG2 ILE 39 1.336 3.438 -8.904
256 HD11 ILE 39 3HD1 ILE 39 -0.539 1.966 -13.728
257 HD12 ILE 39 1HD1 ILE 39 -1.058 0.683 -12.635
258 HD13 ILE 39 2HD1 ILE 39 -1.564 2.349 -12.345
259 H ASN 40 H ASN 40 1.059 1.663 -7.719
260 HA ASN 40 HA ASN 40 1.727 -1.104 -8.456
261 HB2 ASN 40 1HB ASN 40 3.484 0.845 -8.291
262 HB3 ASN 40 2HB ASN 40 3.384 0.521 -6.562
263 HD21 ASN 40 1HD2 ASN 40 5.301 -0.404 -6.186
264 HD22 ASN 40 2HD2 ASN 40 5.864 -1.851 -6.945
265 H TYR 41 H TYR 41 -0.630 -0.698 -7.048
266 HA TYR 41 HA TYR 41 -0.067 -1.235 -4.243
267 HB2 TYR 41 1HB TYR 41 -1.907 0.272 -4.738
268 HB3 TYR 41 2HB TYR 41 -2.679 -0.950 -5.743
269 HD1 TYR 41 HD1 TYR 41 -1.939 0.088 -2.305
270 HD2 TYR 41 HD2 TYR 41 -3.875 -2.805 -4.750
271 HE1 TYR 41 HE1 TYR 41 -3.169 -0.740 -0.341
272 HE2 TYR 41 HE2 TYR 41 -5.110 -3.641 -2.794
273 HH TYR 41 HH TYR 41 -5.846 -2.602 -0.500
274 H SER 42 H SER 42 -1.697 -2.828 -6.973
275 HA SER 42 HA SER 42 -2.155 -5.262 -5.563
276 HB2 SER 42 1HB SER 42 -2.691 -6.170 -7.839
277 HB3 SER 42 2HB SER 42 -3.581 -4.704 -7.429
278 HG SER 42 HG SER 42 -2.779 -4.472 -9.494
279 H SER 43 H SER 43 0.419 -4.036 -7.593
280 HA SER 43 HA SER 43 1.731 -6.507 -8.043
281 HB2 SER 43 1HB SER 43 2.141 -4.483 -9.410
282 HB3 SER 43 2HB SER 43 2.909 -3.717 -8.019
283 HG SER 43 HG SER 43 3.860 -6.221 -8.771
284 H VAL 44 H VAL 44 2.079 -3.997 -5.577
285 HA VAL 44 HA VAL 44 4.220 -5.425 -4.248
286 HB VAL 44 HB VAL 44 2.713 -2.949 -3.396
287 HG11 VAL 44 1HG1 VAL 44 3.655 -3.303 -1.408
288 HG12 VAL 44 2HG1 VAL 44 4.638 -4.630 -2.030
289 HG13 VAL 44 3HG1 VAL 44 5.203 -2.966 -2.181
290 HG21 VAL 44 3HG2 VAL 44 4.377 -1.662 -4.361
291 HG22 VAL 44 1HG2 VAL 44 5.531 -2.994 -4.395
292 HG23 VAL 44 2HG2 VAL 44 4.187 -2.961 -5.537
293 H CYS 45 H CYS 45 0.889 -4.452 -3.437
294 HA CYS 45 HA CYS 45 0.815 -5.927 -1.008
295 HB2 CYS 45 1HB CYS 45 -1.542 -5.018 -2.669
296 HB3 CYS 45 2HB CYS 45 -1.533 -5.384 -0.946
297 H GLN 46 H GLN 46 -0.282 -6.586 -4.304
298 HA GLN 46 HA GLN 46 -0.773 -9.378 -3.499
299 HB2 GLN 46 1HB GLN 46 -2.099 -7.816 -5.722
300 HB3 GLN 46 2HB GLN 46 -2.391 -9.510 -5.353
301 HG2 GLN 46 1HG GLN 46 -3.152 -8.782 -3.078
302 HG3 GLN 46 2HG GLN 46 -3.062 -7.121 -3.661
303 HE21 GLN 46 1HE2 GLN 46 -5.223 -9.272 -2.926
304 HE22 GLN 46 2HE2 GLN 46 -6.413 -9.024 -4.153
305 H GLY 47 H GLY 47 -0.873 -10.681 -5.815
306 HA2 GLY 47 1HA GLY 47 1.007 -9.991 -7.785
307 HA3 GLY 47 2HA GLY 47 1.818 -10.961 -6.565
308 H GLU 48 H GLU 48 2.181 -12.567 -8.182
309 HA GLU 48 HA GLU 48 -0.230 -14.067 -8.955
310 HB2 GLU 48 1HB GLU 48 1.349 -13.165 -10.752
311 HB3 GLU 48 2HB GLU 48 2.501 -14.369 -10.191
312 HG2 GLU 48 1HG GLU 48 1.266 -16.128 -10.988
313 HG3 GLU 48 2HG GLU 48 -0.252 -15.234 -10.919
314 H LYS 49 H LYS 49 3.076 -14.428 -7.734
315 HA LYS 49 HA LYS 49 3.167 -17.169 -7.393
316 HB2 LYS 49 1HB LYS 49 4.916 -15.239 -6.904
317 HB3 LYS 49 2HB LYS 49 4.320 -15.428 -5.259
318 HG2 LYS 49 1HG LYS 49 5.124 -17.874 -6.736
319 HG3 LYS 49 2HG LYS 49 6.392 -16.790 -6.158
320 HD2 LYS 49 1HD LYS 49 5.608 -16.982 -3.897
321 HD3 LYS 49 2HD LYS 49 4.188 -17.893 -4.419
322 HE2 LYS 49 1HE LYS 49 5.583 -19.573 -3.675
323 HE3 LYS 49 2HE LYS 49 5.945 -19.543 -5.400
324 HZ1 LYS 49 3HZ LYS 49 7.544 -18.257 -3.254
325 HZ2 LYS 49 1HZ LYS 49 7.875 -18.146 -4.909
326 HZ3 LYS 49 2HZ LYS 49 7.972 -19.642 -4.127
327 H SER 50 H SER 50 2.650 -18.579 -5.721
328 HA SER 50 HA SER 50 0.222 -18.425 -4.521
329 HB2 SER 50 1HB SER 50 2.650 -19.764 -3.302
330 HB3 SER 50 2HB SER 50 0.964 -20.155 -2.960
331 HG SER 50 HG SER 50 1.183 -21.505 -4.552
332 H SER 51 H SER 51 3.262 -17.779 -2.763
333 HA SER 51 HA SER 51 2.352 -16.921 -0.377
334 HB2 SER 51 1HB SER 51 4.759 -16.972 -1.170
335 HB3 SER 51 2HB SER 51 4.477 -15.382 -1.877
336 HG SER 51 HG SER 51 3.808 -14.745 0.303
337 H GLY 52 H GLY 52 1.437 -15.121 0.534
338 HA2 GLY 52 1HA GLY 52 0.907 -12.738 0.391
339 HA3 GLY 52 2HA GLY 52 0.623 -12.976 -1.327
340 HA PRO 53 HA PRO 53 -3.661 -13.352 -0.431
341 HB2 PRO 53 1HB PRO 53 -4.460 -14.693 -2.652
342 HB3 PRO 53 2HB PRO 53 -4.012 -12.983 -2.671
343 HG2 PRO 53 1HG PRO 53 -2.391 -15.376 -3.453
344 HG3 PRO 53 2HG PRO 53 -2.536 -13.808 -4.269
345 HD2 PRO 53 1HD PRO 53 -0.424 -14.444 -2.697
346 HD3 PRO 53 2HD PRO 53 -1.044 -12.786 -2.841
347 H SER 54 H SER 54 -3.339 -14.794 1.392
348 HA SER 54 HA SER 54 -4.656 -17.294 1.036
349 HB2 SER 54 1HB SER 54 -2.901 -18.810 1.629
350 HB3 SER 54 2HB SER 54 -2.293 -17.823 0.301
351 HG SER 54 HG SER 54 -1.110 -16.622 1.766
352 H SER 55 H SER 55 -4.891 -18.473 3.113
353 HA SER 55 HA SER 55 -4.719 -16.610 5.391
354 HB2 SER 55 1HB SER 55 -6.838 -18.665 4.734
355 HB3 SER 55 2HB SER 55 -6.732 -17.835 6.285
356 HG SER 55 HG SER 55 -7.214 -15.934 5.311
357 H GLY 56 H GLY 56 -3.192 -17.233 6.765
358 HA2 GLY 56 1HA GLY 56 -2.594 -20.098 7.031
359 HA3 GLY 56 2HA GLY 56 -1.537 -18.781 7.515
Start of MODEL 7
1 H1 GLY 1 H GLY 1 23.188 6.548 0.342
2 HA2 GLY 1 1HA GLY 1 21.088 6.532 -1.695
3 HA3 GLY 1 2HA GLY 1 21.708 4.976 -1.165
4 H SER 2 H SER 2 19.084 6.611 -0.870
5 HA SER 2 HA SER 2 18.654 5.817 1.913
6 HB2 SER 2 1HB SER 2 17.915 8.529 0.787
7 HB3 SER 2 2HB SER 2 17.408 7.919 2.362
8 HG SER 2 HG SER 2 19.293 9.263 2.447
9 H SER 3 H SER 3 16.596 5.106 2.370
10 HA SER 3 HA SER 3 14.991 4.388 0.075
11 HB2 SER 3 1HB SER 3 14.576 3.807 3.018
12 HB3 SER 3 2HB SER 3 13.656 3.095 1.693
13 HG SER 3 HG SER 3 16.436 2.803 2.187
14 H GLY 4 H GLY 4 12.658 4.740 0.012
15 HA2 GLY 4 1HA GLY 4 11.118 6.364 1.565
16 HA3 GLY 4 2HA GLY 4 12.033 7.494 0.577
17 H SER 5 H SER 5 9.126 6.811 0.686
18 HA SER 5 HA SER 5 8.703 5.747 -2.010
19 HB2 SER 5 1HB SER 5 6.848 6.215 0.324
20 HB3 SER 5 2HB SER 5 6.253 5.818 -1.288
21 HG SER 5 HG SER 5 8.164 4.240 0.084
22 H SER 6 H SER 6 8.275 7.037 -3.670
23 HA SER 6 HA SER 6 8.396 9.804 -3.566
24 HB2 SER 6 1HB SER 6 7.716 9.805 -5.858
25 HB3 SER 6 2HB SER 6 8.656 8.334 -5.611
26 HG SER 6 HG SER 6 6.617 8.088 -6.780
27 H GLY 7 H GLY 7 5.549 7.690 -3.599
28 HA2 GLY 7 1HA GLY 7 3.872 8.931 -1.955
29 HA3 GLY 7 2HA GLY 7 3.775 9.991 -3.355
30 H TRP 8 H TRP 8 3.949 8.046 -5.381
31 HA TRP 8 HA TRP 8 1.296 6.830 -5.103
32 HB2 TRP 8 1HB TRP 8 2.959 7.470 -7.546
33 HB3 TRP 8 2HB TRP 8 1.414 6.624 -7.601
34 HD1 TRP 8 HD1 TRP 8 2.917 10.084 -7.194
35 HE1 TRP 8 HE1 TRP 8 1.029 11.833 -7.233
36 HE3 TRP 8 HE3 TRP 8 -1.106 6.938 -6.973
37 HZ2 TRP 8 HZ2 TRP 8 -1.793 11.873 -7.175
38 HZ3 TRP 8 HZ3 TRP 8 -3.366 7.912 -6.967
39 HH2 TRP 8 HH2 TRP 8 -3.700 10.329 -7.067
40 H THR 9 H THR 9 3.431 5.556 -3.799
41 HA THR 9 HA THR 9 3.451 3.012 -5.252
42 HB THR 9 HB THR 9 5.823 2.625 -4.569
43 HG1 THR 9 HG1 THR 9 6.165 5.394 -4.283
44 HG21 THR 9 3HG2 THR 9 4.839 4.349 -6.667
45 HG22 THR 9 1HG2 THR 9 6.126 3.145 -6.719
46 HG23 THR 9 2HG2 THR 9 6.482 4.793 -6.204
47 H CYS 10 H CYS 10 3.225 1.237 -3.977
48 HA CYS 10 HA CYS 10 2.905 1.733 -1.097
49 HB2 CYS 10 1HB CYS 10 1.656 -0.230 -2.996
50 HB3 CYS 10 2HB CYS 10 1.685 -0.563 -1.267
51 H ASN 11 H ASN 11 3.981 0.533 0.408
52 HA ASN 11 HA ASN 11 6.144 -1.167 -0.617
53 HB2 ASN 11 1HB ASN 11 6.543 0.894 0.908
54 HB3 ASN 11 2HB ASN 11 5.967 -0.148 2.205
55 HD21 ASN 11 1HD2 ASN 11 7.752 -0.562 3.331
56 HD22 ASN 11 2HD2 ASN 11 9.196 -1.261 2.687
57 H LYS 12 H LYS 12 6.742 -3.066 0.690
58 HA LYS 12 HA LYS 12 4.723 -4.906 0.941
59 HB2 LYS 12 1HB LYS 12 7.314 -4.829 2.501
60 HB3 LYS 12 2HB LYS 12 6.290 -6.245 2.302
61 HG2 LYS 12 1HG LYS 12 7.545 -4.774 0.000
62 HG3 LYS 12 2HG LYS 12 8.294 -6.152 0.810
63 HD2 LYS 12 1HD LYS 12 5.501 -6.354 -0.248
64 HD3 LYS 12 2HD LYS 12 6.880 -6.544 -1.333
65 HE2 LYS 12 1HE LYS 12 7.734 -8.360 0.035
66 HE3 LYS 12 2HE LYS 12 6.417 -8.139 1.186
67 HZ1 LYS 12 3HZ LYS 12 5.169 -9.482 -0.027
68 HZ2 LYS 12 1HZ LYS 12 6.442 -9.713 -1.118
69 HZ3 LYS 12 2HZ LYS 12 5.324 -8.470 -1.374
70 H PHE 13 H PHE 13 6.362 -3.402 3.734
71 HA PHE 13 HA PHE 13 4.552 -4.276 5.663
72 HB2 PHE 13 1HB PHE 13 6.891 -3.059 5.845
73 HB3 PHE 13 2HB PHE 13 5.886 -1.621 5.992
74 HD1 PHE 13 HD1 PHE 13 6.655 -4.899 7.503
75 HD2 PHE 13 HD2 PHE 13 4.733 -1.132 7.991
76 HE1 PHE 13 HE1 PHE 13 6.330 -5.378 9.894
77 HE2 PHE 13 HE2 PHE 13 4.406 -1.605 10.384
78 HZ PHE 13 HZ PHE 13 5.206 -3.730 11.338
79 H ARG 14 H ARG 14 4.588 -1.292 3.760
80 HA ARG 14 HA ARG 14 2.604 0.166 4.938
81 HB2 ARG 14 1HB ARG 14 3.444 -0.174 2.088
82 HB3 ARG 14 2HB ARG 14 2.009 0.777 2.445
83 HG2 ARG 14 1HG ARG 14 4.528 1.358 3.919
84 HG3 ARG 14 2HG ARG 14 4.354 1.910 2.252
85 HD2 ARG 14 1HD ARG 14 2.214 2.442 4.281
86 HD3 ARG 14 2HD ARG 14 3.636 3.480 4.177
87 HE ARG 14 HE ARG 14 2.262 3.053 1.674
88 HH11 ARG 14 1HH1 ARG 14 2.550 5.031 4.524
89 HH12 ARG 14 2HH1 ARG 14 1.837 6.427 3.787
90 HH21 ARG 14 1HH2 ARG 14 1.322 4.886 0.691
91 HH22 ARG 14 2HH2 ARG 14 1.138 6.343 1.606
92 H CYS 15 H CYS 15 2.120 -2.316 2.425
93 HA CYS 15 HA CYS 15 -0.593 -2.257 2.151
94 HB2 CYS 15 1HB CYS 15 1.179 -4.708 2.268
95 HB3 CYS 15 2HB CYS 15 -0.468 -4.692 1.644
96 H GLY 16 H GLY 16 -1.994 -2.005 3.785
97 HA2 GLY 16 1HA GLY 16 -3.412 -3.055 5.382
98 HA3 GLY 16 2HA GLY 16 -2.084 -4.119 5.817
99 H GLU 17 H GLU 17 -2.143 -0.581 5.555
100 HA GLU 17 HA GLU 17 -1.185 -0.453 8.326
101 HB2 GLU 17 1HB GLU 17 -0.391 1.801 7.761
102 HB3 GLU 17 2HB GLU 17 0.273 0.590 6.675
103 HG2 GLU 17 1HG GLU 17 -0.914 1.347 4.875
104 HG3 GLU 17 2HG GLU 17 -2.210 2.011 5.869
105 H LYS 18 H LYS 18 -1.886 1.545 9.548
106 HA LYS 18 HA LYS 18 -4.712 1.544 9.776
107 HB2 LYS 18 1HB LYS 18 -2.723 3.486 10.967
108 HB3 LYS 18 2HB LYS 18 -4.382 3.248 11.497
109 HG2 LYS 18 1HG LYS 18 -3.911 1.101 12.345
110 HG3 LYS 18 2HG LYS 18 -2.351 1.037 11.524
111 HD2 LYS 18 1HD LYS 18 -1.334 2.405 13.057
112 HD3 LYS 18 2HD LYS 18 -2.836 3.233 13.475
113 HE2 LYS 18 1HE LYS 18 -2.294 0.360 14.188
114 HE3 LYS 18 2HE LYS 18 -1.870 1.705 15.246
115 HZ1 LYS 18 3HZ LYS 18 -4.609 1.586 14.234
116 HZ2 LYS 18 1HZ LYS 18 -4.031 2.131 15.728
117 HZ3 LYS 18 2HZ LYS 18 -4.171 0.473 15.430
118 H ARG 19 H ARG 19 -5.918 3.724 9.913
119 HA ARG 19 HA ARG 19 -6.469 4.741 7.492
120 HB2 ARG 19 1HB ARG 19 -6.321 6.595 9.860
121 HB3 ARG 19 2HB ARG 19 -7.467 6.620 8.527
122 HG2 ARG 19 1HG ARG 19 -8.806 5.681 10.080
123 HG3 ARG 19 2HG ARG 19 -8.026 4.204 9.510
124 HD2 ARG 19 1HD ARG 19 -7.699 3.936 11.746
125 HD3 ARG 19 2HD ARG 19 -6.257 4.878 11.370
126 HE ARG 19 HE ARG 19 -8.581 6.422 12.140
127 HH11 ARG 19 1HH1 ARG 19 -5.655 4.841 13.172
128 HH12 ARG 19 2HH1 ARG 19 -5.505 5.778 14.622
129 HH21 ARG 19 1HH2 ARG 19 -8.395 7.661 14.046
130 HH22 ARG 19 2HH2 ARG 19 -7.064 7.381 15.118
131 H LEU 20 H LEU 20 -5.440 5.826 5.952
132 HA LEU 20 HA LEU 20 -2.755 6.665 6.239
133 HB2 LEU 20 1HB LEU 20 -2.873 7.352 3.981
134 HB3 LEU 20 2HB LEU 20 -3.858 5.897 4.126
135 HG LEU 20 HG LEU 20 -5.052 7.332 2.699
136 HD11 LEU 20 1HD1 LEU 20 -7.066 7.908 3.985
137 HD12 LEU 20 2HD1 LEU 20 -6.173 7.641 5.482
138 HD13 LEU 20 3HD1 LEU 20 -6.461 6.298 4.374
139 HD21 LEU 20 3HD2 LEU 20 -3.645 9.361 3.710
140 HD22 LEU 20 1HD2 LEU 20 -5.164 9.626 4.566
141 HD23 LEU 20 2HD2 LEU 20 -5.140 9.596 2.803
142 H THR 21 H THR 21 -1.917 8.831 5.893
143 HA THR 21 HA THR 21 -3.750 10.978 6.710
144 HB THR 21 HB THR 21 -1.908 11.924 8.134
145 HG1 THR 21 HG1 THR 21 -0.467 10.007 8.832
146 HG21 THR 21 3HG2 THR 21 -3.883 10.273 8.831
147 HG22 THR 21 1HG2 THR 21 -2.696 10.864 9.994
148 HG23 THR 21 2HG2 THR 21 -2.516 9.258 9.288
149 H ARG 22 H ARG 22 -3.798 12.154 4.880
150 HA ARG 22 HA ARG 22 -3.124 13.496 3.172
151 HB2 ARG 22 1HB ARG 22 -0.592 13.737 4.808
152 HB3 ARG 22 2HB ARG 22 -1.085 14.811 3.505
153 HG2 ARG 22 1HG ARG 22 -3.226 15.107 5.002
154 HG3 ARG 22 2HG ARG 22 -2.124 14.587 6.279
155 HD2 ARG 22 1HD ARG 22 -0.536 16.382 5.275
156 HD3 ARG 22 2HD ARG 22 -2.009 17.026 4.551
157 HE ARG 22 HE ARG 22 -2.719 17.702 6.639
158 HH11 ARG 22 1HH1 ARG 22 0.109 15.690 6.925
159 HH12 ARG 22 2HH1 ARG 22 0.366 16.063 8.598
160 HH21 ARG 22 1HH2 ARG 22 -2.392 18.201 8.842
161 HH22 ARG 22 2HH2 ARG 22 -1.058 17.491 9.687
162 H SER 23 H SER 23 -2.806 10.767 2.749
163 HA SER 23 HA SER 23 -0.264 10.592 1.276
164 HB2 SER 23 1HB SER 23 -2.050 8.485 2.478
165 HB3 SER 23 2HB SER 23 -0.848 8.082 1.252
166 HG SER 23 HG SER 23 0.757 8.668 2.616
167 H LEU 24 H LEU 24 -0.309 10.607 -0.872
168 HA LEU 24 HA LEU 24 -2.457 11.219 -2.429
169 HB2 LEU 24 1HB LEU 24 -0.132 9.489 -3.256
170 HB3 LEU 24 2HB LEU 24 -1.200 10.373 -4.344
171 HG LEU 24 HG LEU 24 0.616 11.672 -2.316
172 HD11 LEU 24 1HD1 LEU 24 2.306 11.409 -3.723
173 HD12 LEU 24 2HD1 LEU 24 1.380 12.191 -5.003
174 HD13 LEU 24 3HD1 LEU 24 1.277 10.445 -4.782
175 HD21 LEU 24 3HD2 LEU 24 -0.967 12.795 -4.627
176 HD22 LEU 24 1HD2 LEU 24 0.142 13.703 -3.599
177 HD23 LEU 24 2HD2 LEU 24 -1.328 13.011 -2.913
178 H CYS 25 H CYS 25 -1.173 7.928 -1.948
179 HA CYS 25 HA CYS 25 -3.796 6.884 -2.793
180 HB2 CYS 25 1HB CYS 25 -2.778 5.082 -3.816
181 HB3 CYS 25 2HB CYS 25 -1.575 6.338 -4.091
182 H ALA 26 H ALA 26 -4.246 4.654 -1.826
183 HA ALA 26 HA ALA 26 -3.498 4.678 1.027
184 HB1 ALA 26 3HB ALA 26 -5.703 3.706 1.504
185 HB2 ALA 26 1HB ALA 26 -5.826 5.290 0.739
186 HB3 ALA 26 2HB ALA 26 -6.116 3.830 -0.206
187 H CYS 27 H CYS 27 -2.226 3.031 1.536
188 HA CYS 27 HA CYS 27 -2.229 0.621 -0.102
189 HB2 CYS 27 1HB CYS 27 -0.426 1.441 2.185
190 HB3 CYS 27 2HB CYS 27 -0.206 0.019 1.172
191 H SER 28 H SER 28 -4.566 0.918 1.350
192 HA SER 28 HA SER 28 -4.290 -1.191 3.391
193 HB2 SER 28 1HB SER 28 -6.161 -0.200 4.600
194 HB3 SER 28 2HB SER 28 -4.894 1.006 4.375
195 HG SER 28 HG SER 28 -6.233 1.502 2.367
196 H ASP 29 H ASP 29 -6.355 -2.427 3.733
197 HA ASP 29 HA ASP 29 -7.303 -3.352 1.171
198 HB2 ASP 29 1HB ASP 29 -6.740 -4.803 3.218
199 HB3 ASP 29 2HB ASP 29 -8.300 -4.291 3.855
200 H ASP 30 H ASP 30 -8.090 -0.732 1.568
201 HA ASP 30 HA ASP 30 -11.007 -1.048 1.746
202 HB2 ASP 30 1HB ASP 30 -9.467 1.313 2.845
203 HB3 ASP 30 2HB ASP 30 -11.214 1.093 2.886
204 H CYS 31 H CYS 31 -8.242 0.653 0.428
205 HA CYS 31 HA CYS 31 -9.433 2.591 -1.118
206 HB2 CYS 31 1HB CYS 31 -7.467 2.605 -2.449
207 HB3 CYS 31 2HB CYS 31 -6.954 2.123 -0.836
208 H LYS 32 H LYS 32 -8.937 -0.826 -1.923
209 HA LYS 32 HA LYS 32 -9.702 -0.985 -4.510
210 HB2 LYS 32 1HB LYS 32 -10.178 -2.766 -2.167
211 HB3 LYS 32 2HB LYS 32 -11.006 -3.145 -3.673
212 HG2 LYS 32 1HG LYS 32 -9.122 -4.367 -3.976
213 HG3 LYS 32 2HG LYS 32 -8.572 -2.837 -4.663
214 HD2 LYS 32 1HD LYS 32 -6.823 -3.264 -3.259
215 HD3 LYS 32 2HD LYS 32 -7.873 -2.383 -2.146
216 HE2 LYS 32 1HE LYS 32 -7.693 -5.385 -2.410
217 HE3 LYS 32 2HE LYS 32 -6.971 -4.418 -1.124
218 HZ1 LYS 32 3HZ LYS 32 -9.852 -4.847 -1.669
219 HZ2 LYS 32 1HZ LYS 32 -9.288 -3.641 -0.624
220 HZ3 LYS 32 2HZ LYS 32 -8.983 -5.269 -0.281
221 H ASP 33 H ASP 33 -11.861 -0.553 -1.749
222 HA ASP 33 HA ASP 33 -14.277 -0.738 -3.223
223 HB2 ASP 33 1HB ASP 33 -14.291 -1.066 -0.825
224 HB3 ASP 33 2HB ASP 33 -13.669 0.561 -0.560
225 H GLN 34 H GLN 34 -12.401 2.046 -2.044
226 HA GLN 34 HA GLN 34 -14.108 3.979 -3.252
227 HB2 GLN 34 1HB GLN 34 -11.280 4.192 -2.208
228 HB3 GLN 34 2HB GLN 34 -12.242 5.563 -2.742
229 HG2 GLN 34 1HG GLN 34 -13.129 3.711 -0.553
230 HG3 GLN 34 2HG GLN 34 -12.156 5.150 -0.259
231 HE21 GLN 34 1HE2 GLN 34 -15.270 3.910 -0.766
232 HE22 GLN 34 2HE2 GLN 34 -16.125 5.410 -0.795
233 H GLY 35 H GLY 35 -10.699 3.212 -3.999
234 HA2 GLY 35 1HA GLY 35 -10.229 2.521 -6.344
235 HA3 GLY 35 2HA GLY 35 -11.321 3.811 -6.827
236 H ASP 36 H ASP 36 -8.776 3.833 -4.358
237 HA ASP 36 HA ASP 36 -7.275 5.756 -5.995
238 HB2 ASP 36 1HB ASP 36 -8.011 6.084 -3.080
239 HB3 ASP 36 2HB ASP 36 -6.827 7.082 -3.920
240 H CYS 37 H CYS 37 -6.663 3.073 -5.804
241 HA CYS 37 HA CYS 37 -4.589 2.768 -3.787
242 HB2 CYS 37 1HB CYS 37 -5.126 0.782 -5.973
243 HB3 CYS 37 2HB CYS 37 -4.550 0.499 -4.334
244 H CYS 38 H CYS 38 -2.451 2.927 -4.135
245 HA CYS 38 HA CYS 38 -1.300 4.400 -6.077
246 HB2 CYS 38 1HB CYS 38 -0.281 2.195 -4.357
247 HB3 CYS 38 2HB CYS 38 0.753 2.732 -5.677
248 H ILE 39 H ILE 39 0.009 3.910 -7.954
249 HA ILE 39 HA ILE 39 -1.339 2.362 -9.862
250 HB ILE 39 HB ILE 39 0.038 4.192 -10.583
251 HG12 ILE 39 1HG1 ILE 39 1.543 1.787 -11.567
252 HG13 ILE 39 2HG1 ILE 39 -0.163 1.984 -11.952
253 HG21 ILE 39 1HG2 ILE 39 1.925 3.068 -8.762
254 HG22 ILE 39 2HG2 ILE 39 2.675 3.219 -10.351
255 HG23 ILE 39 3HG2 ILE 39 1.963 4.632 -9.573
256 HD11 ILE 39 3HD1 ILE 39 1.453 2.802 -13.683
257 HD12 ILE 39 1HD1 ILE 39 0.249 3.976 -13.154
258 HD13 ILE 39 2HD1 ILE 39 1.904 4.076 -12.552
259 H ASN 40 H ASN 40 1.078 1.523 -7.548
260 HA ASN 40 HA ASN 40 1.235 -1.175 -8.722
261 HB2 ASN 40 1HB ASN 40 3.524 -1.337 -7.728
262 HB3 ASN 40 2HB ASN 40 3.392 -0.133 -9.007
263 HD21 ASN 40 1HD2 ASN 40 4.723 -0.689 -6.112
264 HD22 ASN 40 2HD2 ASN 40 4.847 0.925 -5.510
265 H TYR 41 H TYR 41 -0.769 -0.556 -6.967
266 HA TYR 41 HA TYR 41 -0.041 -1.137 -4.259
267 HB2 TYR 41 1HB TYR 41 -1.987 0.203 -4.588
268 HB3 TYR 41 2HB TYR 41 -2.696 -0.977 -5.685
269 HD1 TYR 41 HD2 TYR 41 -3.595 -3.110 -4.791
270 HD2 TYR 41 HD1 TYR 41 -2.224 -0.007 -2.222
271 HE1 TYR 41 HE2 TYR 41 -4.792 -4.146 -2.909
272 HE2 TYR 41 HE1 TYR 41 -3.416 -1.035 -0.333
273 HH TYR 41 HH TYR 41 -4.626 -2.767 0.359
274 H SER 42 H SER 42 -1.820 -2.945 -6.761
275 HA SER 42 HA SER 42 -1.924 -5.345 -5.229
276 HB2 SER 42 1HB SER 42 -2.966 -6.331 -7.116
277 HB3 SER 42 2HB SER 42 -3.493 -4.647 -7.128
278 HG SER 42 HG SER 42 -2.766 -5.463 -9.193
279 H SER 43 H SER 43 0.246 -4.063 -7.670
280 HA SER 43 HA SER 43 1.657 -6.385 -8.309
281 HB2 SER 43 1HB SER 43 2.060 -4.493 -9.667
282 HB3 SER 43 2HB SER 43 2.442 -3.474 -8.280
283 HG SER 43 HG SER 43 4.402 -4.378 -8.129
284 H VAL 44 H VAL 44 1.979 -4.172 -5.597
285 HA VAL 44 HA VAL 44 4.278 -5.660 -4.575
286 HB VAL 44 HB VAL 44 2.952 -3.137 -3.577
287 HG11 VAL 44 1HG1 VAL 44 5.204 -4.775 -2.469
288 HG12 VAL 44 2HG1 VAL 44 5.096 -3.041 -2.162
289 HG13 VAL 44 3HG1 VAL 44 3.799 -4.114 -1.636
290 HG21 VAL 44 3HG2 VAL 44 4.570 -3.393 -5.720
291 HG22 VAL 44 1HG2 VAL 44 4.504 -1.952 -4.706
292 HG23 VAL 44 2HG2 VAL 44 5.767 -3.155 -4.447
293 H CYS 45 H CYS 45 1.073 -4.589 -3.441
294 HA CYS 45 HA CYS 45 1.075 -6.022 -1.036
295 HB2 CYS 45 1HB CYS 45 -1.223 -5.124 -2.783
296 HB3 CYS 45 2HB CYS 45 -1.422 -5.789 -1.164
297 H GLN 46 H GLN 46 -0.066 -6.920 -4.265
298 HA GLN 46 HA GLN 46 -0.217 -9.712 -3.339
299 HB2 GLN 46 1HB GLN 46 -2.030 -8.260 -5.265
300 HB3 GLN 46 2HB GLN 46 -1.992 -10.012 -5.116
301 HG2 GLN 46 1HG GLN 46 -2.399 -8.400 -2.656
302 HG3 GLN 46 2HG GLN 46 -3.732 -8.542 -3.800
303 HE21 GLN 46 1HE2 GLN 46 -5.047 -10.181 -3.488
304 HE22 GLN 46 2HE2 GLN 46 -4.667 -11.653 -2.667
305 H GLY 47 H GLY 47 -0.467 -11.088 -5.598
306 HA2 GLY 47 1HA GLY 47 0.958 -10.318 -7.855
307 HA3 GLY 47 2HA GLY 47 2.134 -10.979 -6.728
308 H GLU 48 H GLU 48 2.600 -12.710 -8.121
309 HA GLU 48 HA GLU 48 0.454 -14.553 -8.798
310 HB2 GLU 48 1HB GLU 48 2.265 -13.975 -10.427
311 HB3 GLU 48 2HB GLU 48 3.409 -14.797 -9.376
312 HG2 GLU 48 1HG GLU 48 1.031 -16.073 -10.709
313 HG3 GLU 48 2HG GLU 48 2.705 -16.198 -11.248
314 H LYS 49 H LYS 49 -0.194 -15.881 -7.235
315 HA LYS 49 HA LYS 49 1.797 -17.533 -5.890
316 HB2 LYS 49 1HB LYS 49 -0.158 -15.726 -4.486
317 HB3 LYS 49 2HB LYS 49 0.469 -17.174 -3.709
318 HG2 LYS 49 1HG LYS 49 2.214 -14.990 -4.818
319 HG3 LYS 49 2HG LYS 49 1.672 -15.063 -3.140
320 HD2 LYS 49 1HD LYS 49 2.725 -17.317 -2.972
321 HD3 LYS 49 2HD LYS 49 3.378 -17.082 -4.595
322 HE2 LYS 49 1HE LYS 49 3.871 -15.040 -2.468
323 HE3 LYS 49 2HE LYS 49 4.835 -16.515 -2.513
324 HZ1 LYS 49 3HZ LYS 49 4.592 -15.208 -5.066
325 HZ2 LYS 49 1HZ LYS 49 5.968 -15.804 -4.281
326 HZ3 LYS 49 2HZ LYS 49 5.376 -14.266 -3.900
327 H SER 50 H SER 50 0.522 -19.168 -4.405
328 HA SER 50 HA SER 50 -1.797 -20.118 -5.958
329 HB2 SER 50 1HB SER 50 -1.076 -22.428 -5.249
330 HB3 SER 50 2HB SER 50 0.037 -21.618 -6.352
331 HG SER 50 HG SER 50 0.296 -21.891 -3.540
332 H SER 51 H SER 51 -3.483 -21.144 -4.824
333 HA SER 51 HA SER 51 -5.051 -21.076 -3.149
334 HB2 SER 51 1HB SER 51 -2.596 -22.313 -1.941
335 HB3 SER 51 2HB SER 51 -4.045 -22.090 -0.959
336 HG SER 51 HG SER 51 -3.788 -24.151 -2.172
337 H GLY 52 H GLY 52 -3.982 -18.548 -3.536
338 HA2 GLY 52 1HA GLY 52 -3.506 -16.536 -2.489
339 HA3 GLY 52 2HA GLY 52 -4.854 -17.043 -1.482
340 HA PRO 53 HA PRO 53 -1.274 -16.394 1.338
341 HB2 PRO 53 1HB PRO 53 -2.760 -15.284 3.320
342 HB3 PRO 53 2HB PRO 53 -2.113 -14.350 1.966
343 HG2 PRO 53 1HG PRO 53 -4.867 -15.454 2.360
344 HG3 PRO 53 2HG PRO 53 -4.377 -13.864 1.748
345 HD2 PRO 53 1HD PRO 53 -5.151 -15.878 0.112
346 HD3 PRO 53 2HD PRO 53 -3.939 -14.672 -0.366
347 H SER 54 H SER 54 -1.146 -18.692 1.564
348 HA SER 54 HA SER 54 -2.871 -19.827 3.661
349 HB2 SER 54 1HB SER 54 -2.200 -22.036 2.778
350 HB3 SER 54 2HB SER 54 -2.967 -21.042 1.540
351 HG SER 54 HG SER 54 -0.279 -21.794 1.814
352 H SER 55 H SER 55 0.496 -19.836 2.508
353 HA SER 55 HA SER 55 1.356 -20.552 5.229
354 HB2 SER 55 1HB SER 55 2.054 -22.012 3.276
355 HB3 SER 55 2HB SER 55 3.036 -20.658 2.718
356 HG SER 55 HG SER 55 3.262 -21.991 5.215
357 H GLY 56 H GLY 56 2.446 -18.538 2.486
358 HA2 GLY 56 1HA GLY 56 3.588 -16.665 4.462
359 HA3 GLY 56 2HA GLY 56 4.201 -16.881 2.829
Start of MODEL 8
1 H1 GLY 1 H GLY 1 16.204 11.222 1.094
2 HA2 GLY 1 1HA GLY 1 18.246 11.859 2.068
3 HA3 GLY 1 2HA GLY 1 19.096 11.068 0.748
4 H SER 2 H SER 2 19.918 12.303 -0.820
5 HA SER 2 HA SER 2 19.937 15.100 -0.617
6 HB2 SER 2 1HB SER 2 21.730 13.843 -1.725
7 HB3 SER 2 2HB SER 2 20.615 13.368 -3.007
8 HG SER 2 HG SER 2 20.828 15.269 -3.893
9 H SER 3 H SER 3 18.285 13.003 -2.976
10 HA SER 3 HA SER 3 16.882 15.185 -4.184
11 HB2 SER 3 1HB SER 3 16.492 12.190 -4.394
12 HB3 SER 3 2HB SER 3 15.623 13.375 -5.368
13 HG SER 3 HG SER 3 18.318 12.625 -5.449
14 H GLY 4 H GLY 4 14.685 15.694 -4.045
15 HA2 GLY 4 1HA GLY 4 13.405 14.766 -1.555
16 HA3 GLY 4 2HA GLY 4 13.135 16.338 -2.295
17 H SER 5 H SER 5 11.801 13.373 -1.804
18 HA SER 5 HA SER 5 9.639 13.877 -3.593
19 HB2 SER 5 1HB SER 5 11.674 11.792 -4.304
20 HB3 SER 5 2HB SER 5 9.979 11.527 -4.710
21 HG SER 5 HG SER 5 10.652 12.606 -6.433
22 H SER 6 H SER 6 7.811 12.802 -2.986
23 HA SER 6 HA SER 6 7.904 11.432 -0.455
24 HB2 SER 6 1HB SER 6 6.087 12.995 -0.908
25 HB3 SER 6 2HB SER 6 5.583 12.041 -2.303
26 HG SER 6 HG SER 6 5.555 10.308 -0.453
27 H GLY 7 H GLY 7 7.140 9.320 -0.032
28 HA2 GLY 7 1HA GLY 7 8.086 7.309 -1.674
29 HA3 GLY 7 2HA GLY 7 6.864 7.074 -0.433
30 H TRP 8 H TRP 8 4.605 7.568 -1.059
31 HA TRP 8 HA TRP 8 2.799 7.155 -2.377
32 HB2 TRP 8 1HB TRP 8 4.675 8.351 -4.418
33 HB3 TRP 8 2HB TRP 8 3.008 7.921 -4.792
34 HD1 TRP 8 HD1 TRP 8 4.836 10.872 -4.078
35 HE1 TRP 8 HE1 TRP 8 3.408 12.684 -2.937
36 HE3 TRP 8 HE3 TRP 8 0.908 7.972 -2.563
37 HZ2 TRP 8 HZ2 TRP 8 0.943 12.860 -1.573
38 HZ3 TRP 8 HZ3 TRP 8 -0.944 9.039 -1.344
39 HH2 TRP 8 HH2 TRP 8 -0.925 11.432 -0.861
40 H THR 9 H THR 9 4.603 4.997 -1.895
41 HA THR 9 HA THR 9 3.929 3.322 -4.203
42 HB THR 9 HB THR 9 6.115 2.175 -4.076
43 HG1 THR 9 HG1 THR 9 6.428 3.932 -1.959
44 HG21 THR 9 3HG2 THR 9 5.809 3.911 -5.748
45 HG22 THR 9 1HG2 THR 9 7.458 3.962 -5.127
46 HG23 THR 9 2HG2 THR 9 6.273 5.149 -4.581
47 H CYS 10 H CYS 10 3.090 1.400 -3.655
48 HA CYS 10 HA CYS 10 2.627 0.818 -0.884
49 HB2 CYS 10 1HB CYS 10 1.864 -0.503 -3.473
50 HB3 CYS 10 2HB CYS 10 1.585 -1.315 -1.936
51 H ASN 11 H ASN 11 3.516 -0.748 0.377
52 HA ASN 11 HA ASN 11 5.572 -2.475 -0.818
53 HB2 ASN 11 1HB ASN 11 5.861 -0.571 1.476
54 HB3 ASN 11 2HB ASN 11 6.794 -2.065 1.475
55 HD21 ASN 11 1HD2 ASN 11 7.348 0.928 1.065
56 HD22 ASN 11 2HD2 ASN 11 8.378 0.951 -0.323
57 H LYS 12 H LYS 12 6.050 -4.394 0.407
58 HA LYS 12 HA LYS 12 3.979 -5.938 1.159
59 HB2 LYS 12 1HB LYS 12 6.782 -5.920 2.271
60 HB3 LYS 12 2HB LYS 12 5.615 -7.176 2.667
61 HG2 LYS 12 1HG LYS 12 6.114 -6.574 -0.199
62 HG3 LYS 12 2HG LYS 12 7.344 -7.462 0.703
63 HD2 LYS 12 1HD LYS 12 5.963 -9.118 -0.231
64 HD3 LYS 12 2HD LYS 12 5.449 -8.996 1.453
65 HE2 LYS 12 1HE LYS 12 3.469 -7.929 0.907
66 HE3 LYS 12 2HE LYS 12 4.086 -7.358 -0.643
67 HZ1 LYS 12 3HZ LYS 12 4.124 -9.793 -1.295
68 HZ2 LYS 12 1HZ LYS 12 2.602 -9.066 -1.164
69 HZ3 LYS 12 2HZ LYS 12 3.166 -10.076 0.070
70 H PHE 13 H PHE 13 6.007 -4.282 3.587
71 HA PHE 13 HA PHE 13 4.483 -4.804 5.815
72 HB2 PHE 13 1HB PHE 13 6.342 -2.593 5.064
73 HB3 PHE 13 2HB PHE 13 5.384 -2.415 6.531
74 HD1 PHE 13 HD2 PHE 13 5.734 -3.887 8.432
75 HD2 PHE 13 HD1 PHE 13 8.096 -4.229 4.908
76 HE1 PHE 13 HE2 PHE 13 7.363 -5.260 9.661
77 HE2 PHE 13 HE1 PHE 13 9.729 -5.603 6.131
78 HZ PHE 13 HZ PHE 13 9.365 -6.120 8.512
79 H ARG 14 H ARG 14 4.259 -1.915 3.739
80 HA ARG 14 HA ARG 14 2.218 -0.576 4.974
81 HB2 ARG 14 1HB ARG 14 2.521 -0.890 1.982
82 HB3 ARG 14 2HB ARG 14 1.693 0.418 2.817
83 HG2 ARG 14 1HG ARG 14 4.548 -0.061 3.471
84 HG3 ARG 14 2HG ARG 14 4.158 0.673 1.915
85 HD2 ARG 14 1HD ARG 14 2.602 2.178 3.456
86 HD3 ARG 14 2HD ARG 14 3.804 1.732 4.665
87 HE ARG 14 HE ARG 14 4.868 2.744 2.171
88 HH11 ARG 14 1HH1 ARG 14 3.834 3.476 5.413
89 HH12 ARG 14 2HH1 ARG 14 4.745 4.948 5.511
90 HH21 ARG 14 1HH2 ARG 14 6.071 4.679 2.287
91 HH22 ARG 14 2HH2 ARG 14 6.016 5.631 3.732
92 H CYS 15 H CYS 15 1.820 -3.023 2.410
93 HA CYS 15 HA CYS 15 -0.806 -3.191 2.027
94 HB2 CYS 15 1HB CYS 15 0.836 -5.636 2.715
95 HB3 CYS 15 2HB CYS 15 -0.615 -5.588 1.720
96 H GLY 16 H GLY 16 -2.266 -2.632 3.559
97 HA2 GLY 16 1HA GLY 16 -3.833 -3.583 5.130
98 HA3 GLY 16 2HA GLY 16 -2.497 -4.457 5.863
99 H GLU 17 H GLU 17 -2.811 -1.027 4.985
100 HA GLU 17 HA GLU 17 -2.245 -0.368 7.800
101 HB2 GLU 17 1HB GLU 17 -1.215 1.681 7.025
102 HB3 GLU 17 2HB GLU 17 -0.488 0.311 6.197
103 HG2 GLU 17 1HG GLU 17 -1.947 0.769 4.253
104 HG3 GLU 17 2HG GLU 17 -2.539 2.207 5.082
105 H LYS 18 H LYS 18 -3.383 1.308 8.795
106 HA LYS 18 HA LYS 18 -6.063 1.491 8.483
107 HB2 LYS 18 1HB LYS 18 -6.028 3.519 9.767
108 HB3 LYS 18 2HB LYS 18 -4.733 2.483 10.349
109 HG2 LYS 18 1HG LYS 18 -4.080 4.484 8.257
110 HG3 LYS 18 2HG LYS 18 -4.366 5.054 9.903
111 HD2 LYS 18 1HD LYS 18 -2.644 3.570 10.747
112 HD3 LYS 18 2HD LYS 18 -2.400 2.897 9.133
113 HE2 LYS 18 1HE LYS 18 -0.706 4.422 9.158
114 HE3 LYS 18 2HE LYS 18 -1.999 5.446 8.536
115 HZ1 LYS 18 3HZ LYS 18 -2.322 5.782 11.151
116 HZ2 LYS 18 1HZ LYS 18 -1.335 6.776 10.204
117 HZ3 LYS 18 2HZ LYS 18 -0.651 5.520 11.105
118 H ARG 19 H ARG 19 -7.516 3.065 7.594
119 HA ARG 19 HA ARG 19 -6.930 3.712 4.893
120 HB2 ARG 19 1HB ARG 19 -9.153 4.884 4.976
121 HB3 ARG 19 2HB ARG 19 -9.189 3.193 5.457
122 HG2 ARG 19 1HG ARG 19 -9.371 3.761 7.755
123 HG3 ARG 19 2HG ARG 19 -9.034 5.461 7.421
124 HD2 ARG 19 1HD ARG 19 -11.122 5.599 6.127
125 HD3 ARG 19 2HD ARG 19 -11.460 3.913 6.518
126 HE ARG 19 HE ARG 19 -12.092 4.555 8.635
127 HH11 ARG 19 1HH1 ARG 19 -10.536 7.213 7.013
128 HH12 ARG 19 2HH1 ARG 19 -10.978 8.378 8.217
129 HH21 ARG 19 1HH2 ARG 19 -12.681 6.080 10.227
130 HH22 ARG 19 2HH2 ARG 19 -12.198 7.731 10.045
131 H LEU 20 H LEU 20 -5.789 5.376 4.176
132 HA LEU 20 HA LEU 20 -5.190 7.614 5.903
133 HB2 LEU 20 1HB LEU 20 -4.230 6.603 3.287
134 HB3 LEU 20 2HB LEU 20 -4.042 8.326 3.608
135 HG LEU 20 HG LEU 20 -2.006 7.114 4.142
136 HD11 LEU 20 1HD1 LEU 20 -1.590 8.091 6.222
137 HD12 LEU 20 2HD1 LEU 20 -3.256 7.879 6.759
138 HD13 LEU 20 3HD1 LEU 20 -2.873 9.083 5.528
139 HD21 LEU 20 3HD2 LEU 20 -1.989 5.124 5.129
140 HD22 LEU 20 1HD2 LEU 20 -3.752 5.142 5.071
141 HD23 LEU 20 2HD2 LEU 20 -2.911 5.734 6.503
142 H THR 21 H THR 21 -5.510 9.834 5.291
143 HA THR 21 HA THR 21 -8.146 10.330 4.322
144 HB THR 21 HB THR 21 -7.593 12.721 4.619
145 HG1 THR 21 HG1 THR 21 -5.086 12.003 5.675
146 HG21 THR 21 3HG2 THR 21 -6.583 11.128 6.970
147 HG22 THR 21 1HG2 THR 21 -8.287 11.213 6.528
148 HG23 THR 21 2HG2 THR 21 -7.423 12.679 6.990
149 H ARG 22 H ARG 22 -8.292 12.381 2.754
150 HA ARG 22 HA ARG 22 -8.001 11.599 0.198
151 HB2 ARG 22 1HB ARG 22 -8.000 14.281 1.480
152 HB3 ARG 22 2HB ARG 22 -7.536 14.201 -0.215
153 HG2 ARG 22 1HG ARG 22 -9.802 14.577 -0.345
154 HG3 ARG 22 2HG ARG 22 -9.713 12.821 -0.485
155 HD2 ARG 22 1HD ARG 22 -11.416 13.147 1.064
156 HD3 ARG 22 2HD ARG 22 -10.008 12.818 2.072
157 HE ARG 22 HE ARG 22 -10.524 15.616 1.553
158 HH11 ARG 22 1HH1 ARG 22 -11.051 12.901 3.669
159 HH12 ARG 22 2HH1 ARG 22 -11.426 13.881 5.047
160 HH21 ARG 22 1HH2 ARG 22 -11.016 16.917 3.362
161 HH22 ARG 22 2HH2 ARG 22 -11.407 16.165 4.871
162 H SER 23 H SER 23 -6.198 10.523 -0.443
163 HA SER 23 HA SER 23 -3.754 12.124 -0.703
164 HB2 SER 23 1HB SER 23 -2.340 10.409 0.109
165 HB3 SER 23 2HB SER 23 -3.660 10.495 1.276
166 HG SER 23 HG SER 23 -4.224 8.540 0.753
167 H LEU 24 H LEU 24 -2.272 11.299 -2.351
168 HA LEU 24 HA LEU 24 -3.464 10.847 -4.791
169 HB2 LEU 24 1HB LEU 24 -0.711 9.903 -4.012
170 HB3 LEU 24 2HB LEU 24 -1.283 10.279 -5.636
171 HG LEU 24 HG LEU 24 -0.958 12.293 -3.413
172 HD11 LEU 24 1HD1 LEU 24 0.757 12.409 -5.798
173 HD12 LEU 24 2HD1 LEU 24 1.081 11.074 -4.693
174 HD13 LEU 24 3HD1 LEU 24 1.133 12.736 -4.106
175 HD21 LEU 24 3HD2 LEU 24 -1.175 13.004 -6.290
176 HD22 LEU 24 1HD2 LEU 24 -1.671 13.907 -4.859
177 HD23 LEU 24 2HD2 LEU 24 -2.649 12.555 -5.429
178 H CYS 25 H CYS 25 -2.442 8.516 -2.381
179 HA CYS 25 HA CYS 25 -4.079 6.480 -3.558
180 HB2 CYS 25 1HB CYS 25 -2.484 4.960 -4.288
181 HB3 CYS 25 2HB CYS 25 -1.785 6.491 -4.807
182 H ALA 26 H ALA 26 -3.991 4.438 -2.267
183 HA ALA 26 HA ALA 26 -2.882 4.725 0.413
184 HB1 ALA 26 3HB ALA 26 -5.024 5.755 0.700
185 HB2 ALA 26 1HB ALA 26 -5.832 4.420 -0.122
186 HB3 ALA 26 2HB ALA 26 -5.076 4.159 1.451
187 H CYS 27 H CYS 27 -2.110 2.845 1.134
188 HA CYS 27 HA CYS 27 -2.738 0.421 -0.381
189 HB2 CYS 27 1HB CYS 27 -0.585 0.793 1.706
190 HB3 CYS 27 2HB CYS 27 -0.719 -0.508 0.528
191 H SER 28 H SER 28 -4.778 1.261 1.287
192 HA SER 28 HA SER 28 -4.606 -0.437 3.667
193 HB2 SER 28 1HB SER 28 -6.969 1.295 3.019
194 HB3 SER 28 2HB SER 28 -6.341 0.814 4.595
195 HG SER 28 HG SER 28 -5.666 2.946 3.014
196 H ASP 29 H ASP 29 -6.948 -1.380 4.192
197 HA ASP 29 HA ASP 29 -7.557 -3.137 1.937
198 HB2 ASP 29 1HB ASP 29 -8.004 -3.302 4.901
199 HB3 ASP 29 2HB ASP 29 -8.941 -4.317 3.807
200 H ASP 30 H ASP 30 -8.494 -0.367 2.022
201 HA ASP 30 HA ASP 30 -11.381 -0.910 1.867
202 HB2 ASP 30 1HB ASP 30 -10.014 1.495 3.075
203 HB3 ASP 30 2HB ASP 30 -11.710 1.503 2.596
204 H CYS 31 H CYS 31 -8.599 0.853 0.685
205 HA CYS 31 HA CYS 31 -9.581 2.605 -1.125
206 HB2 CYS 31 1HB CYS 31 -7.566 2.427 -2.318
207 HB3 CYS 31 2HB CYS 31 -7.142 1.914 -0.687
208 H LYS 32 H LYS 32 -9.525 -0.899 -1.454
209 HA LYS 32 HA LYS 32 -10.110 -1.307 -4.079
210 HB2 LYS 32 1HB LYS 32 -10.917 -2.687 -1.571
211 HB3 LYS 32 2HB LYS 32 -11.762 -3.139 -3.045
212 HG2 LYS 32 1HG LYS 32 -9.973 -4.652 -2.812
213 HG3 LYS 32 2HG LYS 32 -9.502 -3.527 -4.087
214 HD2 LYS 32 1HD LYS 32 -8.264 -2.223 -2.318
215 HD3 LYS 32 2HD LYS 32 -8.566 -3.575 -1.223
216 HE2 LYS 32 1HE LYS 32 -6.383 -3.850 -2.163
217 HE3 LYS 32 2HE LYS 32 -7.442 -5.069 -2.873
218 HZ1 LYS 32 3HZ LYS 32 -6.200 -2.731 -4.118
219 HZ2 LYS 32 1HZ LYS 32 -7.725 -3.201 -4.681
220 HZ3 LYS 32 2HZ LYS 32 -6.431 -4.290 -4.735
221 H ASP 33 H ASP 33 -12.387 -0.319 -1.554
222 HA ASP 33 HA ASP 33 -14.694 -0.364 -3.194
223 HB2 ASP 33 1HB ASP 33 -14.150 1.233 -0.682
224 HB3 ASP 33 2HB ASP 33 -15.735 0.982 -1.409
225 H GLN 34 H GLN 34 -12.856 2.436 -1.956
226 HA GLN 34 HA GLN 34 -14.120 4.360 -3.533
227 HB2 GLN 34 1HB GLN 34 -11.348 4.308 -2.338
228 HB3 GLN 34 2HB GLN 34 -12.041 5.726 -3.116
229 HG2 GLN 34 1HG GLN 34 -13.995 5.289 -1.410
230 HG3 GLN 34 2HG GLN 34 -12.719 4.464 -0.516
231 HE21 GLN 34 1HE2 GLN 34 -14.271 7.039 -0.150
232 HE22 GLN 34 2HE2 GLN 34 -13.051 8.222 0.159
233 H GLY 35 H GLY 35 -10.841 3.032 -4.050
234 HA2 GLY 35 1HA GLY 35 -10.314 2.094 -6.258
235 HA3 GLY 35 2HA GLY 35 -11.299 3.374 -6.950
236 H ASP 36 H ASP 36 -9.090 3.924 -4.298
237 HA ASP 36 HA ASP 36 -7.371 5.463 -6.134
238 HB2 ASP 36 1HB ASP 36 -7.881 6.014 -3.203
239 HB3 ASP 36 2HB ASP 36 -6.917 6.997 -4.301
240 H CYS 37 H CYS 37 -6.938 2.734 -5.684
241 HA CYS 37 HA CYS 37 -4.911 2.414 -3.661
242 HB2 CYS 37 1HB CYS 37 -5.513 0.496 -5.910
243 HB3 CYS 37 2HB CYS 37 -4.810 0.136 -4.336
244 H CYS 38 H CYS 38 -2.795 2.727 -3.877
245 HA CYS 38 HA CYS 38 -1.542 4.099 -5.825
246 HB2 CYS 38 1HB CYS 38 -0.163 1.767 -4.501
247 HB3 CYS 38 2HB CYS 38 0.539 3.301 -5.005
248 H ILE 39 H ILE 39 -0.671 3.777 -7.811
249 HA ILE 39 HA ILE 39 -1.658 1.936 -9.563
250 HB ILE 39 HB ILE 39 -0.385 3.883 -10.295
251 HG12 ILE 39 1HG1 ILE 39 1.036 2.725 -12.045
252 HG13 ILE 39 2HG1 ILE 39 0.658 1.209 -11.235
253 HG21 ILE 39 1HG2 ILE 39 1.434 3.266 -8.437
254 HG22 ILE 39 2HG2 ILE 39 2.229 2.575 -9.850
255 HG23 ILE 39 3HG2 ILE 39 1.797 4.284 -9.830
256 HD11 ILE 39 3HD1 ILE 39 -0.841 1.384 -13.032
257 HD12 ILE 39 1HD1 ILE 39 -1.774 1.782 -11.590
258 HD13 ILE 39 2HD1 ILE 39 -1.213 3.067 -12.661
259 H ASN 40 H ASN 40 1.200 1.601 -7.516
260 HA ASN 40 HA ASN 40 1.549 -1.152 -8.475
261 HB2 ASN 40 1HB ASN 40 3.752 -1.041 -7.325
262 HB3 ASN 40 2HB ASN 40 3.568 0.184 -8.578
263 HD21 ASN 40 1HD2 ASN 40 4.894 -0.239 -5.728
264 HD22 ASN 40 2HD2 ASN 40 4.704 1.328 -5.025
265 H TYR 41 H TYR 41 -0.656 -0.741 -6.872
266 HA TYR 41 HA TYR 41 -0.056 -1.297 -4.123
267 HB2 TYR 41 1HB TYR 41 -2.080 -0.102 -4.600
268 HB3 TYR 41 2HB TYR 41 -2.630 -1.358 -5.702
269 HD1 TYR 41 HD2 TYR 41 -3.392 -3.542 -4.805
270 HD2 TYR 41 HD1 TYR 41 -2.416 -0.287 -2.243
271 HE1 TYR 41 HE2 TYR 41 -4.591 -4.641 -2.961
272 HE2 TYR 41 HE1 TYR 41 -3.612 -1.378 -0.392
273 HH TYR 41 HH TYR 41 -4.286 -3.697 0.251
274 H SER 42 H SER 42 -1.617 -3.196 -6.707
275 HA SER 42 HA SER 42 -1.509 -5.626 -5.208
276 HB2 SER 42 1HB SER 42 -1.974 -5.249 -8.176
277 HB3 SER 42 2HB SER 42 -2.358 -6.688 -7.231
278 HG SER 42 HG SER 42 -3.714 -4.298 -7.447
279 H SER 43 H SER 43 0.381 -4.251 -7.864
280 HA SER 43 HA SER 43 1.986 -6.385 -8.522
281 HB2 SER 43 1HB SER 43 3.620 -4.771 -9.312
282 HB3 SER 43 2HB SER 43 1.999 -4.168 -9.662
283 HG SER 43 HG SER 43 3.132 -3.428 -7.231
284 H VAL 44 H VAL 44 2.232 -4.228 -5.758
285 HA VAL 44 HA VAL 44 4.679 -5.535 -4.852
286 HB VAL 44 HB VAL 44 3.126 -3.209 -3.711
287 HG11 VAL 44 1HG1 VAL 44 5.014 -4.942 -2.446
288 HG12 VAL 44 2HG1 VAL 44 5.722 -3.334 -2.620
289 HG13 VAL 44 3HG1 VAL 44 4.181 -3.536 -1.785
290 HG21 VAL 44 3HG2 VAL 44 5.655 -2.348 -4.330
291 HG22 VAL 44 1HG2 VAL 44 5.304 -3.477 -5.638
292 HG23 VAL 44 2HG2 VAL 44 4.222 -2.118 -5.331
293 H CYS 45 H CYS 45 1.340 -5.008 -3.767
294 HA CYS 45 HA CYS 45 1.633 -6.612 -1.417
295 HB2 CYS 45 1HB CYS 45 -0.787 -5.513 -2.853
296 HB3 CYS 45 2HB CYS 45 -0.893 -6.449 -1.365
297 H GLN 46 H GLN 46 -0.542 -7.118 -4.197
298 HA GLN 46 HA GLN 46 -0.512 -9.976 -3.700
299 HB2 GLN 46 1HB GLN 46 -2.087 -8.157 -5.491
300 HB3 GLN 46 2HB GLN 46 -2.084 -9.892 -5.782
301 HG2 GLN 46 1HG GLN 46 -2.723 -8.822 -3.068
302 HG3 GLN 46 2HG GLN 46 -3.947 -8.838 -4.334
303 HE21 GLN 46 1HE2 GLN 46 -4.698 -10.812 -5.123
304 HE22 GLN 46 2HE2 GLN 46 -4.464 -12.289 -4.257
305 H GLY 47 H GLY 47 1.774 -10.236 -4.223
306 HA2 GLY 47 1HA GLY 47 2.271 -10.224 -7.135
307 HA3 GLY 47 2HA GLY 47 3.527 -10.035 -5.921
308 H GLU 48 H GLU 48 4.516 -11.806 -5.107
309 HA GLU 48 HA GLU 48 3.373 -14.437 -5.737
310 HB2 GLU 48 1HB GLU 48 4.991 -14.095 -7.465
311 HB3 GLU 48 2HB GLU 48 6.183 -13.503 -6.317
312 HG2 GLU 48 1HG GLU 48 6.720 -15.594 -5.575
313 HG3 GLU 48 2HG GLU 48 5.137 -16.261 -5.969
314 H LYS 49 H LYS 49 3.448 -15.845 -4.098
315 HA LYS 49 HA LYS 49 4.476 -14.992 -1.559
316 HB2 LYS 49 1HB LYS 49 3.234 -17.613 -2.412
317 HB3 LYS 49 2HB LYS 49 3.604 -17.170 -0.751
318 HG2 LYS 49 1HG LYS 49 2.088 -15.148 -1.150
319 HG3 LYS 49 2HG LYS 49 1.530 -16.020 -2.580
320 HD2 LYS 49 1HD LYS 49 1.148 -17.988 -0.959
321 HD3 LYS 49 2HD LYS 49 1.263 -16.769 0.313
322 HE2 LYS 49 1HE LYS 49 -0.993 -16.749 -0.063
323 HE3 LYS 49 2HE LYS 49 -0.478 -15.505 -1.201
324 HZ1 LYS 49 3HZ LYS 49 -0.313 -17.943 -2.525
325 HZ2 LYS 49 1HZ LYS 49 -1.412 -16.686 -2.806
326 HZ3 LYS 49 2HZ LYS 49 -1.807 -17.931 -1.732
327 H SER 50 H SER 50 6.733 -14.817 -2.089
328 HA SER 50 HA SER 50 8.110 -17.410 -2.323
329 HB2 SER 50 1HB SER 50 8.507 -15.669 -4.121
330 HB3 SER 50 2HB SER 50 9.299 -14.689 -2.888
331 HG SER 50 HG SER 50 10.590 -16.249 -4.275
332 H SER 51 H SER 51 8.102 -17.928 -0.133
333 HA SER 51 HA SER 51 9.148 -16.076 1.817
334 HB2 SER 51 1HB SER 51 8.755 -17.855 3.433
335 HB3 SER 51 2HB SER 51 7.349 -17.694 2.380
336 HG SER 51 HG SER 51 9.370 -19.675 2.314
337 H GLY 52 H GLY 52 11.202 -15.874 2.439
338 HA2 GLY 52 1HA GLY 52 13.185 -17.370 3.099
339 HA3 GLY 52 2HA GLY 52 13.142 -17.834 1.404
340 HA PRO 53 HA PRO 53 15.459 -13.694 2.290
341 HB2 PRO 53 1HB PRO 53 17.939 -14.574 2.957
342 HB3 PRO 53 2HB PRO 53 16.689 -14.224 4.156
343 HG2 PRO 53 1HG PRO 53 17.532 -16.860 3.013
344 HG3 PRO 53 2HG PRO 53 17.158 -16.437 4.695
345 HD2 PRO 53 1HD PRO 53 15.392 -17.713 3.088
346 HD3 PRO 53 2HD PRO 53 14.883 -16.584 4.360
347 H SER 54 H SER 54 15.188 -13.619 0.006
348 HA SER 54 HA SER 54 17.064 -15.078 -1.663
349 HB2 SER 54 1HB SER 54 14.906 -13.080 -2.387
350 HB3 SER 54 2HB SER 54 15.860 -14.007 -3.544
351 HG SER 54 HG SER 54 13.949 -14.939 -1.684
352 H SER 55 H SER 55 18.680 -14.163 -2.908
353 HA SER 55 HA SER 55 19.527 -11.483 -2.051
354 HB2 SER 55 1HB SER 55 21.789 -12.186 -2.841
355 HB3 SER 55 2HB SER 55 21.160 -13.201 -1.543
356 HG SER 55 HG SER 55 21.465 -13.784 -4.276
357 H GLY 56 H GLY 56 18.807 -9.996 -3.448
358 HA2 GLY 56 1HA GLY 56 19.634 -10.221 -6.231
359 HA3 GLY 56 2HA GLY 56 17.904 -10.103 -5.950
Start of MODEL 9
1 H1 GLY 1 H GLY 1 5.090 24.001 2.625
2 HA2 GLY 1 1HA GLY 1 3.293 24.140 0.290
3 HA3 GLY 1 2HA GLY 1 5.023 24.446 0.248
4 H SER 2 H SER 2 6.444 22.752 0.046
5 HA SER 2 HA SER 2 5.222 20.098 -0.342
6 HB2 SER 2 1HB SER 2 6.001 21.186 -2.456
7 HB3 SER 2 2HB SER 2 7.637 21.197 -1.798
8 HG SER 2 HG SER 2 7.742 19.044 -1.966
9 H SER 3 H SER 3 5.677 19.676 1.902
10 HA SER 3 HA SER 3 8.523 19.089 2.395
11 HB2 SER 3 1HB SER 3 7.813 20.858 3.886
12 HB3 SER 3 2HB SER 3 6.391 19.933 4.370
13 HG SER 3 HG SER 3 7.925 18.330 5.167
14 H GLY 4 H GLY 4 8.836 16.970 2.195
15 HA2 GLY 4 1HA GLY 4 8.567 14.844 3.400
16 HA3 GLY 4 2HA GLY 4 6.839 15.165 3.414
17 H SER 5 H SER 5 9.572 14.553 1.241
18 HA SER 5 HA SER 5 8.208 14.161 -1.127
19 HB2 SER 5 1HB SER 5 10.738 14.133 -0.703
20 HB3 SER 5 2HB SER 5 10.535 12.428 -0.305
21 HG SER 5 HG SER 5 10.836 12.269 -2.405
22 H SER 6 H SER 6 6.778 12.722 -1.831
23 HA SER 6 HA SER 6 6.598 10.122 -0.463
24 HB2 SER 6 1HB SER 6 4.783 11.820 0.187
25 HB3 SER 6 2HB SER 6 4.165 11.605 -1.451
26 HG SER 6 HG SER 6 3.745 9.486 -1.015
27 H GLY 7 H GLY 7 5.273 8.526 -1.774
28 HA2 GLY 7 1HA GLY 7 5.552 8.995 -4.666
29 HA3 GLY 7 2HA GLY 7 6.282 7.568 -3.949
30 H TRP 8 H TRP 8 4.591 7.066 -5.909
31 HA TRP 8 HA TRP 8 1.911 6.666 -4.867
32 HB2 TRP 8 1HB TRP 8 3.185 6.118 -7.548
33 HB3 TRP 8 2HB TRP 8 1.535 5.633 -7.162
34 HD1 TRP 8 HD1 TRP 8 3.648 8.881 -7.325
35 HE1 TRP 8 HE1 TRP 8 2.082 10.810 -7.998
36 HE3 TRP 8 HE3 TRP 8 -0.786 6.337 -7.402
37 HZ2 TRP 8 HZ2 TRP 8 -0.668 11.201 -8.495
38 HZ3 TRP 8 HZ3 TRP 8 -2.839 7.564 -7.986
39 HH2 TRP 8 HH2 TRP 8 -2.779 9.945 -8.520
40 H THR 9 H THR 9 4.322 4.536 -6.417
41 HA THR 9 HA THR 9 3.310 2.091 -6.007
42 HB THR 9 HB THR 9 5.606 1.218 -5.640
43 HG1 THR 9 HG1 THR 9 7.125 2.509 -4.926
44 HG21 THR 9 3HG2 THR 9 6.596 2.187 -7.725
45 HG22 THR 9 1HG2 THR 9 5.273 3.352 -7.748
46 HG23 THR 9 2HG2 THR 9 4.934 1.628 -7.907
47 H CYS 10 H CYS 10 3.142 0.560 -4.383
48 HA CYS 10 HA CYS 10 3.197 1.649 -1.663
49 HB2 CYS 10 1HB CYS 10 1.747 -0.663 -2.935
50 HB3 CYS 10 2HB CYS 10 1.871 -0.509 -1.185
51 H ASN 11 H ASN 11 4.078 0.428 0.077
52 HA ASN 11 HA ASN 11 6.291 -1.312 -0.767
53 HB2 ASN 11 1HB ASN 11 5.961 0.129 1.872
54 HB3 ASN 11 2HB ASN 11 7.402 -0.704 1.294
55 HD21 ASN 11 1HD2 ASN 11 8.864 0.419 0.198
56 HD22 ASN 11 2HD2 ASN 11 8.650 2.026 -0.397
57 H LYS 12 H LYS 12 6.542 -3.337 0.055
58 HA LYS 12 HA LYS 12 4.542 -4.986 0.664
59 HB2 LYS 12 1HB LYS 12 7.034 -5.523 0.504
60 HB3 LYS 12 2HB LYS 12 7.115 -5.174 2.226
61 HG2 LYS 12 1HG LYS 12 6.902 -7.506 2.050
62 HG3 LYS 12 2HG LYS 12 5.308 -6.917 2.530
63 HD2 LYS 12 1HD LYS 12 4.766 -6.912 0.025
64 HD3 LYS 12 2HD LYS 12 6.218 -7.897 -0.161
65 HE2 LYS 12 1HE LYS 12 5.230 -9.448 1.573
66 HE3 LYS 12 2HE LYS 12 3.730 -8.537 1.410
67 HZ1 LYS 12 3HZ LYS 12 4.921 -9.473 -1.068
68 HZ2 LYS 12 1HZ LYS 12 3.298 -9.436 -0.590
69 HZ3 LYS 12 2HZ LYS 12 4.312 -10.678 -0.050
70 H PHE 13 H PHE 13 6.208 -2.977 3.063
71 HA PHE 13 HA PHE 13 4.701 -3.906 5.283
72 HB2 PHE 13 1HB PHE 13 6.170 -1.278 4.988
73 HB3 PHE 13 2HB PHE 13 5.682 -2.041 6.497
74 HD1 PHE 13 HD2 PHE 13 6.510 -4.701 6.442
75 HD2 PHE 13 HD1 PHE 13 8.427 -1.348 4.655
76 HE1 PHE 13 HE2 PHE 13 8.664 -5.886 6.539
77 HE2 PHE 13 HE1 PHE 13 10.585 -2.528 4.747
78 HZ PHE 13 HZ PHE 13 10.706 -4.799 5.692
79 H ARG 14 H ARG 14 4.512 -0.924 3.345
80 HA ARG 14 HA ARG 14 2.474 0.401 4.555
81 HB2 ARG 14 1HB ARG 14 2.867 0.032 1.579
82 HB3 ARG 14 2HB ARG 14 1.843 1.261 2.310
83 HG2 ARG 14 1HG ARG 14 4.712 1.104 3.097
84 HG3 ARG 14 2HG ARG 14 4.272 1.831 1.551
85 HD2 ARG 14 1HD ARG 14 2.516 3.097 3.092
86 HD3 ARG 14 2HD ARG 14 3.738 2.762 4.319
87 HE ARG 14 HE ARG 14 4.726 3.962 1.878
88 HH11 ARG 14 1HH1 ARG 14 3.546 4.475 5.113
89 HH12 ARG 14 2HH1 ARG 14 4.273 6.040 5.270
90 HH21 ARG 14 1HH2 ARG 14 5.689 6.021 2.073
91 HH22 ARG 14 2HH2 ARG 14 5.491 6.918 3.540
92 H CYS 15 H CYS 15 2.132 -2.291 2.269
93 HA CYS 15 HA CYS 15 -0.472 -2.478 1.748
94 HB2 CYS 15 1HB CYS 15 1.236 -4.744 2.799
95 HB3 CYS 15 2HB CYS 15 -0.305 -4.954 1.973
96 H GLY 16 H GLY 16 -2.333 -2.405 2.819
97 HA2 GLY 16 1HA GLY 16 -3.879 -2.559 4.511
98 HA3 GLY 16 2HA GLY 16 -2.836 -3.770 5.242
99 H GLU 17 H GLU 17 -2.630 -0.258 4.638
100 HA GLU 17 HA GLU 17 -1.816 0.058 7.453
101 HB2 GLU 17 1HB GLU 17 -0.628 2.105 6.723
102 HB3 GLU 17 2HB GLU 17 -0.004 0.647 5.964
103 HG2 GLU 17 1HG GLU 17 -0.897 1.183 3.894
104 HG3 GLU 17 2HG GLU 17 -2.058 2.318 4.581
105 H LYS 18 H LYS 18 -2.488 2.017 8.527
106 HA LYS 18 HA LYS 18 -4.830 3.333 7.340
107 HB2 LYS 18 1HB LYS 18 -6.111 3.109 9.352
108 HB3 LYS 18 2HB LYS 18 -5.550 1.506 8.895
109 HG2 LYS 18 1HG LYS 18 -3.910 3.080 10.809
110 HG3 LYS 18 2HG LYS 18 -5.415 2.355 11.379
111 HD2 LYS 18 1HD LYS 18 -4.665 0.163 10.668
112 HD3 LYS 18 2HD LYS 18 -3.197 0.861 9.981
113 HE2 LYS 18 1HE LYS 18 -2.640 -0.086 12.102
114 HE3 LYS 18 2HE LYS 18 -2.602 1.668 12.266
115 HZ1 LYS 18 3HZ LYS 18 -5.037 0.154 12.952
116 HZ2 LYS 18 1HZ LYS 18 -4.545 1.679 13.493
117 HZ3 LYS 18 2HZ LYS 18 -3.770 0.288 14.065
118 H ARG 19 H ARG 19 -2.192 4.322 7.494
119 HA ARG 19 HA ARG 19 -2.539 6.500 9.449
120 HB2 ARG 19 1HB ARG 19 -0.036 5.053 8.602
121 HB3 ARG 19 2HB ARG 19 0.019 6.646 9.345
122 HG2 ARG 19 1HG ARG 19 -1.281 5.663 11.268
123 HG3 ARG 19 2HG ARG 19 -0.978 4.081 10.546
124 HD2 ARG 19 1HD ARG 19 1.265 4.149 11.006
125 HD3 ARG 19 2HD ARG 19 1.329 5.910 10.968
126 HE ARG 19 HE ARG 19 0.748 5.963 13.200
127 HH11 ARG 19 1HH1 ARG 19 0.428 2.729 11.951
128 HH12 ARG 19 2HH1 ARG 19 0.233 2.005 13.513
129 HH21 ARG 19 1HH2 ARG 19 0.494 5.022 15.262
130 HH22 ARG 19 2HH2 ARG 19 0.271 3.310 15.396
131 H LEU 20 H LEU 20 -1.164 8.467 8.791
132 HA LEU 20 HA LEU 20 -0.854 10.199 7.352
133 HB2 LEU 20 1HB LEU 20 -0.393 7.929 5.427
134 HB3 LEU 20 2HB LEU 20 -0.085 9.623 5.052
135 HG LEU 20 HG LEU 20 1.266 8.409 7.416
136 HD11 LEU 20 1HD1 LEU 20 2.713 7.132 6.264
137 HD12 LEU 20 2HD1 LEU 20 2.725 8.213 4.872
138 HD13 LEU 20 3HD1 LEU 20 1.410 7.058 5.079
139 HD21 LEU 20 3HD2 LEU 20 1.701 10.657 5.510
140 HD22 LEU 20 1HD2 LEU 20 3.095 9.930 6.308
141 HD23 LEU 20 2HD2 LEU 20 1.796 10.635 7.271
142 H THR 21 H THR 21 -3.435 9.830 7.865
143 HA THR 21 HA THR 21 -5.306 9.198 6.034
144 HB THR 21 HB THR 21 -5.314 11.753 7.653
145 HG1 THR 21 HG1 THR 21 -5.111 9.980 9.009
146 HG21 THR 21 3HG2 THR 21 -7.112 12.093 6.278
147 HG22 THR 21 1HG2 THR 21 -7.883 11.110 7.522
148 HG23 THR 21 2HG2 THR 21 -7.369 10.371 6.005
149 H ARG 22 H ARG 22 -3.113 11.918 5.859
150 HA ARG 22 HA ARG 22 -4.410 12.860 3.405
151 HB2 ARG 22 1HB ARG 22 -2.994 14.853 3.643
152 HB3 ARG 22 2HB ARG 22 -3.953 14.564 5.089
153 HG2 ARG 22 1HG ARG 22 -1.786 13.295 5.871
154 HG3 ARG 22 2HG ARG 22 -1.019 14.348 4.681
155 HD2 ARG 22 1HD ARG 22 -2.923 15.564 6.610
156 HD3 ARG 22 2HD ARG 22 -1.336 15.081 7.207
157 HE ARG 22 HE ARG 22 -0.767 16.511 4.976
158 HH11 ARG 22 1HH1 ARG 22 -2.670 17.141 7.821
159 HH12 ARG 22 2HH1 ARG 22 -2.385 18.850 7.793
160 HH21 ARG 22 1HH2 ARG 22 -0.383 18.760 4.928
161 HH22 ARG 22 2HH2 ARG 22 -1.084 19.769 6.147
162 H SER 23 H SER 23 -3.260 10.485 2.973
163 HA SER 23 HA SER 23 -0.608 11.012 1.828
164 HB2 SER 23 1HB SER 23 -0.217 8.674 1.866
165 HB3 SER 23 2HB SER 23 -1.027 9.028 3.391
166 HG SER 23 HG SER 23 -1.932 7.614 1.177
167 H LEU 24 H LEU 24 -0.256 11.011 -0.315
168 HA LEU 24 HA LEU 24 -2.022 11.587 -2.219
169 HB2 LEU 24 1HB LEU 24 0.569 11.008 -2.296
170 HB3 LEU 24 2HB LEU 24 -0.043 9.524 -3.023
171 HG LEU 24 HG LEU 24 -0.568 12.306 -4.067
172 HD11 LEU 24 1HD1 LEU 24 1.799 10.923 -4.192
173 HD12 LEU 24 2HD1 LEU 24 1.278 12.182 -5.311
174 HD13 LEU 24 3HD1 LEU 24 1.006 10.485 -5.705
175 HD21 LEU 24 3HD2 LEU 24 -1.379 11.096 -6.059
176 HD22 LEU 24 1HD2 LEU 24 -2.353 10.774 -4.624
177 HD23 LEU 24 2HD2 LEU 24 -1.189 9.574 -5.186
178 H CYS 25 H CYS 25 -1.023 8.195 -1.721
179 HA CYS 25 HA CYS 25 -3.743 7.376 -2.491
180 HB2 CYS 25 1HB CYS 25 -2.805 5.469 -3.719
181 HB3 CYS 25 2HB CYS 25 -2.242 6.996 -4.392
182 H ALA 26 H ALA 26 -4.509 5.453 -1.546
183 HA ALA 26 HA ALA 26 -3.264 4.854 1.019
184 HB1 ALA 26 3HB ALA 26 -5.496 3.366 1.048
185 HB2 ALA 26 1HB ALA 26 -5.461 5.072 1.493
186 HB3 ALA 26 2HB ALA 26 -5.972 4.593 -0.125
187 H CYS 27 H CYS 27 -2.549 2.846 1.649
188 HA CYS 27 HA CYS 27 -2.281 0.852 -0.505
189 HB2 CYS 27 1HB CYS 27 -0.436 1.487 1.804
190 HB3 CYS 27 2HB CYS 27 -0.246 0.081 0.762
191 H SER 28 H SER 28 -4.586 0.902 1.052
192 HA SER 28 HA SER 28 -4.228 -1.480 2.753
193 HB2 SER 28 1HB SER 28 -6.286 -0.694 3.967
194 HB3 SER 28 2HB SER 28 -4.888 0.365 4.151
195 HG SER 28 HG SER 28 -7.222 0.749 2.623
196 H ASP 29 H ASP 29 -6.329 -2.753 2.969
197 HA ASP 29 HA ASP 29 -7.257 -3.353 0.290
198 HB2 ASP 29 1HB ASP 29 -8.594 -5.128 1.773
199 HB3 ASP 29 2HB ASP 29 -6.904 -5.356 1.333
200 H ASP 30 H ASP 30 -8.095 -0.889 1.815
201 HA ASP 30 HA ASP 30 -11.006 -1.342 1.775
202 HB2 ASP 30 1HB ASP 30 -9.352 0.681 3.291
203 HB3 ASP 30 2HB ASP 30 -11.109 0.759 3.175
204 H CYS 31 H CYS 31 -8.372 0.629 0.594
205 HA CYS 31 HA CYS 31 -9.944 2.646 -0.628
206 HB2 CYS 31 1HB CYS 31 -7.841 3.065 -1.972
207 HB3 CYS 31 2HB CYS 31 -7.650 3.135 -0.224
208 H LYS 32 H LYS 32 -9.221 -0.595 -1.478
209 HA LYS 32 HA LYS 32 -9.329 -0.551 -4.251
210 HB2 LYS 32 1HB LYS 32 -10.275 -2.624 -2.273
211 HB3 LYS 32 2HB LYS 32 -10.275 -2.895 -4.011
212 HG2 LYS 32 1HG LYS 32 -7.748 -2.139 -3.750
213 HG3 LYS 32 2HG LYS 32 -8.008 -2.737 -2.109
214 HD2 LYS 32 1HD LYS 32 -8.900 -4.422 -4.398
215 HD3 LYS 32 2HD LYS 32 -7.174 -4.335 -4.038
216 HE2 LYS 32 1HE LYS 32 -9.304 -5.045 -2.026
217 HE3 LYS 32 2HE LYS 32 -8.352 -6.225 -2.924
218 HZ1 LYS 32 3HZ LYS 32 -6.468 -5.732 -1.758
219 HZ2 LYS 32 1HZ LYS 32 -7.625 -5.441 -0.557
220 HZ3 LYS 32 2HZ LYS 32 -6.944 -4.147 -1.408
221 H ASP 33 H ASP 33 -11.942 -0.505 -1.888
222 HA ASP 33 HA ASP 33 -14.049 -0.814 -3.775
223 HB2 ASP 33 1HB ASP 33 -13.900 0.076 -0.911
224 HB3 ASP 33 2HB ASP 33 -15.404 0.240 -1.813
225 H GLN 34 H GLN 34 -12.942 2.046 -1.948
226 HA GLN 34 HA GLN 34 -14.546 3.909 -3.273
227 HB2 GLN 34 1HB GLN 34 -11.931 4.161 -1.804
228 HB3 GLN 34 2HB GLN 34 -12.725 5.557 -2.519
229 HG2 GLN 34 1HG GLN 34 -14.308 3.803 -0.720
230 HG3 GLN 34 2HG GLN 34 -13.109 4.881 -0.007
231 HE21 GLN 34 1HE2 GLN 34 -15.491 5.411 0.816
232 HE22 GLN 34 2HE2 GLN 34 -16.200 6.773 0.023
233 H GLY 35 H GLY 35 -11.053 3.335 -3.770
234 HA2 GLY 35 1HA GLY 35 -10.407 2.918 -6.153
235 HA3 GLY 35 2HA GLY 35 -11.421 4.301 -6.540
236 H ASP 36 H ASP 36 -9.023 3.805 -3.962
237 HA ASP 36 HA ASP 36 -7.538 6.111 -5.042
238 HB2 ASP 36 1HB ASP 36 -8.853 6.321 -2.776
239 HB3 ASP 36 2HB ASP 36 -7.475 5.437 -2.125
240 H CYS 37 H CYS 37 -7.439 2.886 -3.821
241 HA CYS 37 HA CYS 37 -4.976 2.367 -2.936
242 HB2 CYS 37 1HB CYS 37 -6.530 0.866 -5.039
243 HB3 CYS 37 2HB CYS 37 -5.020 0.250 -4.376
244 H CYS 38 H CYS 38 -2.907 2.513 -3.564
245 HA CYS 38 HA CYS 38 -2.105 4.108 -5.682
246 HB2 CYS 38 1HB CYS 38 -0.455 1.897 -4.445
247 HB3 CYS 38 2HB CYS 38 0.144 3.347 -5.244
248 H ILE 39 H ILE 39 -1.651 3.794 -7.787
249 HA ILE 39 HA ILE 39 -2.754 1.841 -9.311
250 HB ILE 39 HB ILE 39 -1.746 3.839 -10.282
251 HG12 ILE 39 1HG1 ILE 39 -0.369 1.430 -11.467
252 HG13 ILE 39 2HG1 ILE 39 -2.103 1.693 -11.611
253 HG21 ILE 39 1HG2 ILE 39 0.888 2.516 -9.649
254 HG22 ILE 39 2HG2 ILE 39 0.688 3.969 -10.626
255 HG23 ILE 39 3HG2 ILE 39 0.250 3.988 -8.918
256 HD11 ILE 39 3HD1 ILE 39 -0.128 3.762 -12.491
257 HD12 ILE 39 1HD1 ILE 39 -0.613 2.432 -13.541
258 HD13 ILE 39 2HD1 ILE 39 -1.820 3.576 -12.954
259 H ASN 40 H ASN 40 0.297 1.676 -7.595
260 HA ASN 40 HA ASN 40 0.728 -1.041 -8.631
261 HB2 ASN 40 1HB ASN 40 2.534 0.852 -8.727
262 HB3 ASN 40 2HB ASN 40 2.772 0.458 -7.028
263 HD21 ASN 40 1HD2 ASN 40 4.467 -0.790 -6.782
264 HD22 ASN 40 2HD2 ASN 40 4.926 -2.103 -7.807
265 H TYR 41 H TYR 41 -1.280 -0.813 -6.791
266 HA TYR 41 HA TYR 41 -0.303 -1.297 -4.128
267 HB2 TYR 41 1HB TYR 41 -2.443 -0.212 -4.374
268 HB3 TYR 41 2HB TYR 41 -3.057 -1.540 -5.352
269 HD1 TYR 41 HD1 TYR 41 -1.583 -0.954 -1.965
270 HD2 TYR 41 HD2 TYR 41 -4.401 -3.105 -4.318
271 HE1 TYR 41 HE1 TYR 41 -2.437 -2.045 0.067
272 HE2 TYR 41 HE2 TYR 41 -5.264 -4.202 -2.292
273 HH TYR 41 HH TYR 41 -5.338 -3.881 0.086
274 H SER 42 H SER 42 -1.811 -3.262 -6.676
275 HA SER 42 HA SER 42 -1.670 -5.697 -5.211
276 HB2 SER 42 1HB SER 42 -3.293 -5.669 -6.915
277 HB3 SER 42 2HB SER 42 -2.161 -5.023 -8.105
278 HG SER 42 HG SER 42 -1.711 -6.998 -8.617
279 H SER 43 H SER 43 0.129 -4.657 -8.114
280 HA SER 43 HA SER 43 1.940 -6.604 -8.423
281 HB2 SER 43 1HB SER 43 1.863 -4.455 -9.715
282 HB3 SER 43 2HB SER 43 2.745 -3.687 -8.394
283 HG SER 43 HG SER 43 3.709 -5.127 -10.422
284 H VAL 44 H VAL 44 2.001 -4.194 -5.857
285 HA VAL 44 HA VAL 44 4.489 -5.234 -4.777
286 HB VAL 44 HB VAL 44 2.649 -3.082 -3.720
287 HG11 VAL 44 1HG1 VAL 44 3.880 -2.985 -1.871
288 HG12 VAL 44 2HG1 VAL 44 4.618 -4.511 -2.361
289 HG13 VAL 44 3HG1 VAL 44 5.381 -2.981 -2.797
290 HG21 VAL 44 3HG2 VAL 44 4.114 -2.898 -5.953
291 HG22 VAL 44 1HG2 VAL 44 3.851 -1.536 -4.864
292 HG23 VAL 44 2HG2 VAL 44 5.346 -2.465 -4.768
293 H CYS 45 H CYS 45 1.111 -4.903 -3.693
294 HA CYS 45 HA CYS 45 1.572 -6.596 -1.403
295 HB2 CYS 45 1HB CYS 45 -1.022 -5.507 -2.516
296 HB3 CYS 45 2HB CYS 45 -0.808 -6.257 -0.937
297 H GLN 46 H GLN 46 -0.976 -6.856 -3.872
298 HA GLN 46 HA GLN 46 -1.030 -9.720 -3.581
299 HB2 GLN 46 1HB GLN 46 -2.524 -7.911 -5.487
300 HB3 GLN 46 2HB GLN 46 -2.843 -9.624 -5.252
301 HG2 GLN 46 1HG GLN 46 -2.957 -7.735 -2.941
302 HG3 GLN 46 2HG GLN 46 -4.317 -7.877 -4.053
303 HE21 GLN 46 1HE2 GLN 46 -5.262 -9.998 -4.328
304 HE22 GLN 46 2HE2 GLN 46 -5.237 -11.116 -3.011
305 H GLY 47 H GLY 47 1.479 -8.972 -4.429
306 HA2 GLY 47 1HA GLY 47 1.495 -9.808 -7.264
307 HA3 GLY 47 2HA GLY 47 2.720 -8.776 -6.541
308 H GLU 48 H GLU 48 3.851 -9.827 -4.591
309 HA GLU 48 HA GLU 48 4.302 -12.684 -5.139
310 HB2 GLU 48 1HB GLU 48 6.096 -10.952 -5.948
311 HB3 GLU 48 2HB GLU 48 6.547 -10.913 -4.249
312 HG2 GLU 48 1HG GLU 48 6.278 -13.562 -5.560
313 HG3 GLU 48 2HG GLU 48 7.680 -12.570 -5.957
314 H LYS 49 H LYS 49 3.135 -13.417 -3.397
315 HA LYS 49 HA LYS 49 3.893 -12.443 -0.736
316 HB2 LYS 49 1HB LYS 49 1.441 -12.649 -1.574
317 HB3 LYS 49 2HB LYS 49 1.652 -14.369 -1.275
318 HG2 LYS 49 1HG LYS 49 0.702 -13.619 0.691
319 HG3 LYS 49 2HG LYS 49 2.425 -13.628 1.076
320 HD2 LYS 49 1HD LYS 49 2.584 -11.272 0.800
321 HD3 LYS 49 2HD LYS 49 0.974 -11.182 0.082
322 HE2 LYS 49 1HE LYS 49 1.581 -11.990 2.924
323 HE3 LYS 49 2HE LYS 49 1.002 -10.405 2.416
324 HZ1 LYS 49 3HZ LYS 49 -0.457 -12.969 2.070
325 HZ2 LYS 49 1HZ LYS 49 -1.012 -11.447 1.583
326 HZ3 LYS 49 2HZ LYS 49 -0.803 -11.785 3.227
327 H SER 50 H SER 50 4.499 -13.878 0.918
328 HA SER 50 HA SER 50 5.828 -16.280 -0.064
329 HB2 SER 50 1HB SER 50 6.062 -14.599 2.407
330 HB3 SER 50 2HB SER 50 6.661 -16.258 2.426
331 HG SER 50 HG SER 50 7.401 -14.310 0.499
332 H SER 51 H SER 51 3.857 -15.451 2.793
333 HA SER 51 HA SER 51 3.133 -18.229 3.154
334 HB2 SER 51 1HB SER 51 2.189 -15.785 4.671
335 HB3 SER 51 2HB SER 51 1.978 -17.465 5.163
336 HG SER 51 HG SER 51 4.126 -15.831 5.463
337 H GLY 52 H GLY 52 1.983 -18.567 1.177
338 HA2 GLY 52 1HA GLY 52 -0.430 -17.046 0.678
339 HA3 GLY 52 2HA GLY 52 0.169 -18.399 -0.270
340 HA PRO 53 HA PRO 53 -3.565 -19.899 1.969
341 HB2 PRO 53 1HB PRO 53 -4.495 -21.363 -0.120
342 HB3 PRO 53 2HB PRO 53 -4.836 -19.639 0.072
343 HG2 PRO 53 1HG PRO 53 -2.785 -20.984 -1.644
344 HG3 PRO 53 2HG PRO 53 -3.855 -19.626 -2.037
345 HD2 PRO 53 1HD PRO 53 -1.255 -19.285 -1.361
346 HD3 PRO 53 2HD PRO 53 -2.509 -18.093 -0.963
347 H SER 54 H SER 54 -0.810 -21.296 0.527
348 HA SER 54 HA SER 54 -1.252 -24.021 0.711
349 HB2 SER 54 1HB SER 54 0.842 -22.633 -0.083
350 HB3 SER 54 2HB SER 54 1.395 -22.911 1.568
351 HG SER 54 HG SER 54 2.119 -24.666 0.559
352 H SER 55 H SER 55 -0.160 -21.779 3.232
353 HA SER 55 HA SER 55 0.091 -23.789 5.239
354 HB2 SER 55 1HB SER 55 -0.163 -20.783 5.503
355 HB3 SER 55 2HB SER 55 0.297 -21.881 6.803
356 HG SER 55 HG SER 55 1.706 -21.640 4.353
357 H GLY 56 H GLY 56 -1.309 -24.405 6.840
358 HA2 GLY 56 1HA GLY 56 -3.909 -23.095 7.045
359 HA3 GLY 56 2HA GLY 56 -3.912 -24.773 6.524
Start of MODEL 10
1 H1 GLY 1 H GLY 1 21.786 10.774 -1.103
2 HA2 GLY 1 1HA GLY 1 21.084 12.105 1.049
3 HA3 GLY 1 2HA GLY 1 21.193 13.452 -0.075
4 H SER 2 H SER 2 19.441 10.551 0.777
5 HA SER 2 HA SER 2 17.611 10.437 -1.318
6 HB2 SER 2 1HB SER 2 17.178 9.752 1.600
7 HB3 SER 2 2HB SER 2 16.129 9.251 0.273
8 HG SER 2 HG SER 2 17.517 7.755 -0.252
9 H SER 3 H SER 3 15.157 10.833 -0.895
10 HA SER 3 HA SER 3 14.876 13.685 -0.468
11 HB2 SER 3 1HB SER 3 12.594 13.366 -1.343
12 HB3 SER 3 2HB SER 3 13.799 12.649 -2.414
13 HG SER 3 HG SER 3 12.563 10.952 -2.226
14 H GLY 4 H GLY 4 13.465 10.697 0.851
15 HA2 GLY 4 1HA GLY 4 13.412 11.506 3.500
16 HA3 GLY 4 2HA GLY 4 11.881 12.021 2.808
17 H SER 5 H SER 5 10.275 10.640 3.092
18 HA SER 5 HA SER 5 10.926 7.791 3.446
19 HB2 SER 5 1HB SER 5 8.836 9.571 4.633
20 HB3 SER 5 2HB SER 5 8.478 7.855 4.444
21 HG SER 5 HG SER 5 9.504 7.715 6.280
22 H SER 6 H SER 6 8.778 6.442 2.957
23 HA SER 6 HA SER 6 8.514 6.004 0.342
24 HB2 SER 6 1HB SER 6 7.336 4.661 2.013
25 HB3 SER 6 2HB SER 6 6.203 5.982 2.300
26 HG SER 6 HG SER 6 5.339 5.683 0.303
27 H GLY 7 H GLY 7 7.625 6.886 -1.447
28 HA2 GLY 7 1HA GLY 7 6.486 9.571 -1.157
29 HA3 GLY 7 2HA GLY 7 7.145 8.882 -2.633
30 H TRP 8 H TRP 8 5.819 7.827 -4.031
31 HA TRP 8 HA TRP 8 3.011 7.493 -3.208
32 HB2 TRP 8 1HB TRP 8 4.107 8.680 -5.754
33 HB3 TRP 8 2HB TRP 8 2.460 8.068 -5.640
34 HD1 TRP 8 HD1 TRP 8 4.137 11.215 -5.516
35 HE1 TRP 8 HE1 TRP 8 2.850 12.964 -4.134
36 HE3 TRP 8 HE3 TRP 8 0.951 8.093 -3.020
37 HZ2 TRP 8 HZ2 TRP 8 0.761 13.014 -2.237
38 HZ3 TRP 8 HZ3 TRP 8 -0.661 9.071 -1.438
39 HH2 TRP 8 HH2 TRP 8 -0.751 11.481 -1.057
40 H THR 9 H THR 9 4.682 5.392 -2.961
41 HA THR 9 HA THR 9 3.649 3.565 -4.975
42 HB THR 9 HB THR 9 5.805 2.525 -5.427
43 HG1 THR 9 HG1 THR 9 7.499 2.991 -4.249
44 HG21 THR 9 3HG2 THR 9 6.912 4.480 -6.621
45 HG22 THR 9 1HG2 THR 9 5.636 5.487 -5.937
46 HG23 THR 9 2HG2 THR 9 5.226 4.164 -7.029
47 H CYS 10 H CYS 10 2.548 2.248 -3.657
48 HA CYS 10 HA CYS 10 2.995 1.694 -1.003
49 HB2 CYS 10 1HB CYS 10 1.716 0.068 -3.188
50 HB3 CYS 10 2HB CYS 10 1.800 -0.533 -1.535
51 H ASN 11 H ASN 11 3.676 -0.396 -0.010
52 HA ASN 11 HA ASN 11 5.716 -1.875 -1.453
53 HB2 ASN 11 1HB ASN 11 6.309 -0.100 0.906
54 HB3 ASN 11 2HB ASN 11 7.313 -1.500 0.538
55 HD21 ASN 11 1HD2 ASN 11 6.613 1.734 -0.192
56 HD22 ASN 11 2HD2 ASN 11 7.711 1.925 -1.511
57 H LYS 12 H LYS 12 6.308 -3.844 -0.438
58 HA LYS 12 HA LYS 12 4.353 -5.357 0.664
59 HB2 LYS 12 1HB LYS 12 7.326 -5.493 0.819
60 HB3 LYS 12 2HB LYS 12 6.398 -6.577 1.846
61 HG2 LYS 12 1HG LYS 12 5.480 -7.709 0.041
62 HG3 LYS 12 2HG LYS 12 5.822 -6.391 -1.084
63 HD2 LYS 12 1HD LYS 12 8.309 -6.907 -0.503
64 HD3 LYS 12 2HD LYS 12 7.670 -8.463 0.035
65 HE2 LYS 12 1HE LYS 12 8.139 -8.951 -2.151
66 HE3 LYS 12 2HE LYS 12 6.472 -8.401 -2.308
67 HZ1 LYS 12 3HZ LYS 12 7.814 -7.374 -3.989
68 HZ2 LYS 12 1HZ LYS 12 8.917 -6.802 -2.840
69 HZ3 LYS 12 2HZ LYS 12 7.343 -6.185 -2.880
70 H PHE 13 H PHE 13 6.625 -3.306 2.430
71 HA PHE 13 HA PHE 13 5.736 -4.090 5.018
72 HB2 PHE 13 1HB PHE 13 7.477 -1.927 3.922
73 HB3 PHE 13 2HB PHE 13 6.862 -1.750 5.563
74 HD1 PHE 13 HD1 PHE 13 8.492 -4.331 3.417
75 HD2 PHE 13 HD2 PHE 13 8.151 -2.564 7.274
76 HE1 PHE 13 HE1 PHE 13 10.290 -5.793 4.242
77 HE2 PHE 13 HE2 PHE 13 9.951 -4.022 8.104
78 HZ PHE 13 HZ PHE 13 11.024 -5.638 6.588
79 H ARG 14 H ARG 14 5.199 -1.126 3.110
80 HA ARG 14 HA ARG 14 3.475 0.184 4.814
81 HB2 ARG 14 1HB ARG 14 3.386 0.120 1.792
82 HB3 ARG 14 2HB ARG 14 2.581 1.313 2.803
83 HG2 ARG 14 1HG ARG 14 4.838 1.933 3.702
84 HG3 ARG 14 2HG ARG 14 5.536 0.891 2.460
85 HD2 ARG 14 1HD ARG 14 5.546 3.136 1.637
86 HD3 ARG 14 2HD ARG 14 4.319 2.233 0.750
87 HE ARG 14 HE ARG 14 2.750 3.661 1.582
88 HH11 ARG 14 1HH1 ARG 14 5.577 3.815 3.608
89 HH12 ARG 14 2HH1 ARG 14 4.967 5.109 4.585
90 HH21 ARG 14 1HH2 ARG 14 1.935 5.364 2.862
91 HH22 ARG 14 2HH2 ARG 14 2.894 5.989 4.161
92 H CYS 15 H CYS 15 2.689 -2.246 2.354
93 HA CYS 15 HA CYS 15 0.033 -2.304 2.201
94 HB2 CYS 15 1HB CYS 15 1.719 -4.741 2.813
95 HB3 CYS 15 2HB CYS 15 0.107 -4.767 2.106
96 H GLY 16 H GLY 16 -1.208 -1.553 3.856
97 HA2 GLY 16 1HA GLY 16 -2.668 -2.561 5.587
98 HA3 GLY 16 2HA GLY 16 -1.197 -3.172 6.331
99 H GLU 17 H GLU 17 -1.877 0.044 4.994
100 HA GLU 17 HA GLU 17 -1.097 1.187 7.580
101 HB2 GLU 17 1HB GLU 17 -0.554 3.190 6.428
102 HB3 GLU 17 2HB GLU 17 0.085 1.873 5.455
103 HG2 GLU 17 1HG GLU 17 -1.429 2.188 3.773
104 HG3 GLU 17 2HG GLU 17 -2.633 2.906 4.841
105 H LYS 18 H LYS 18 -2.285 3.002 8.435
106 HA LYS 18 HA LYS 18 -5.045 3.260 7.484
107 HB2 LYS 18 1HB LYS 18 -5.952 3.009 9.711
108 HB3 LYS 18 2HB LYS 18 -5.019 1.576 9.303
109 HG2 LYS 18 1HG LYS 18 -4.252 1.917 11.408
110 HG3 LYS 18 2HG LYS 18 -3.102 2.929 10.533
111 HD2 LYS 18 1HD LYS 18 -3.756 4.414 12.138
112 HD3 LYS 18 2HD LYS 18 -4.984 4.757 10.917
113 HE2 LYS 18 1HE LYS 18 -6.649 3.736 12.109
114 HE3 LYS 18 2HE LYS 18 -5.543 2.615 12.901
115 HZ1 LYS 18 3HZ LYS 18 -6.224 5.375 13.626
116 HZ2 LYS 18 1HZ LYS 18 -4.684 4.794 14.014
117 HZ3 LYS 18 2HZ LYS 18 -6.058 4.012 14.615
118 H ARG 19 H ARG 19 -6.179 5.076 8.765
119 HA ARG 19 HA ARG 19 -6.299 7.328 9.093
120 HB2 ARG 19 1HB ARG 19 -3.957 6.471 10.748
121 HB3 ARG 19 2HB ARG 19 -4.349 8.181 10.627
122 HG2 ARG 19 1HG ARG 19 -6.541 6.302 11.312
123 HG3 ARG 19 2HG ARG 19 -5.325 6.650 12.543
124 HD2 ARG 19 1HD ARG 19 -6.965 8.696 11.052
125 HD3 ARG 19 2HD ARG 19 -7.248 8.159 12.707
126 HE ARG 19 HE ARG 19 -4.617 9.246 12.193
127 HH11 ARG 19 1HH1 ARG 19 -7.876 9.872 13.245
128 HH12 ARG 19 2HH1 ARG 19 -7.458 11.310 14.117
129 HH21 ARG 19 1HH2 ARG 19 -4.053 11.137 13.338
130 HH22 ARG 19 2HH2 ARG 19 -5.282 12.029 14.168
131 H LEU 20 H LEU 20 -5.499 6.974 6.621
132 HA LEU 20 HA LEU 20 -3.116 8.654 6.232
133 HB2 LEU 20 1HB LEU 20 -3.240 7.783 3.866
134 HB3 LEU 20 2HB LEU 20 -2.809 6.614 5.113
135 HG LEU 20 HG LEU 20 -5.661 6.808 4.279
136 HD11 LEU 20 1HD1 LEU 20 -3.464 6.159 2.489
137 HD12 LEU 20 2HD1 LEU 20 -5.168 6.446 2.137
138 HD13 LEU 20 3HD1 LEU 20 -4.632 4.846 2.648
139 HD21 LEU 20 3HD2 LEU 20 -4.543 5.311 6.114
140 HD22 LEU 20 1HD2 LEU 20 -4.100 4.309 4.732
141 HD23 LEU 20 2HD2 LEU 20 -5.798 4.653 5.063
142 H THR 21 H THR 21 -4.002 10.684 6.417
143 HA THR 21 HA THR 21 -6.409 11.625 5.489
144 HB THR 21 HB THR 21 -5.336 13.868 5.322
145 HG1 THR 21 HG1 THR 21 -3.208 12.645 4.728
146 HG21 THR 21 3HG2 THR 21 -5.304 12.102 7.649
147 HG22 THR 21 1HG2 THR 21 -5.893 13.756 7.494
148 HG23 THR 21 2HG2 THR 21 -4.179 13.453 7.782
149 H ARG 22 H ARG 22 -6.531 13.388 3.665
150 HA ARG 22 HA ARG 22 -6.781 12.303 1.245
151 HB2 ARG 22 1HB ARG 22 -5.672 15.067 1.765
152 HB3 ARG 22 2HB ARG 22 -6.348 14.528 0.233
153 HG2 ARG 22 1HG ARG 22 -7.933 14.449 2.777
154 HG3 ARG 22 2HG ARG 22 -7.848 15.893 1.766
155 HD2 ARG 22 1HD ARG 22 -8.645 13.204 0.684
156 HD3 ARG 22 2HD ARG 22 -9.813 14.330 1.375
157 HE ARG 22 HE ARG 22 -8.551 15.848 -0.453
158 HH11 ARG 22 1HH1 ARG 22 -10.009 12.691 -0.617
159 HH12 ARG 22 2HH1 ARG 22 -10.452 12.839 -2.285
160 HH21 ARG 22 1HH2 ARG 22 -9.130 16.055 -2.649
161 HH22 ARG 22 2HH2 ARG 22 -9.950 14.753 -3.441
162 H SER 23 H SER 23 -5.382 10.832 0.444
163 HA SER 23 HA SER 23 -2.695 11.799 -0.253
164 HB2 SER 23 1HB SER 23 -3.446 9.351 1.266
165 HB3 SER 23 2HB SER 23 -2.136 9.205 0.094
166 HG SER 23 HG SER 23 -1.056 9.895 1.802
167 H LEU 24 H LEU 24 -2.164 11.504 -2.324
168 HA LEU 24 HA LEU 24 -3.775 10.968 -4.371
169 HB2 LEU 24 1HB LEU 24 -0.929 10.001 -4.161
170 HB3 LEU 24 2HB LEU 24 -1.836 10.153 -5.665
171 HG LEU 24 HG LEU 24 -1.065 12.429 -3.839
172 HD11 LEU 24 1HD1 LEU 24 0.633 11.086 -5.423
173 HD12 LEU 24 2HD1 LEU 24 0.747 12.821 -5.125
174 HD13 LEU 24 3HD1 LEU 24 -0.029 12.228 -6.594
175 HD21 LEU 24 3HD2 LEU 24 -1.815 13.184 -6.497
176 HD22 LEU 24 1HD2 LEU 24 -2.505 13.694 -4.956
177 HD23 LEU 24 2HD2 LEU 24 -3.113 12.245 -5.757
178 H CYS 25 H CYS 25 -1.938 8.420 -2.693
179 HA CYS 25 HA CYS 25 -3.928 6.480 -3.668
180 HB2 CYS 25 1HB CYS 25 -2.307 4.912 -4.212
181 HB3 CYS 25 2HB CYS 25 -1.532 6.415 -4.705
182 H ALA 26 H ALA 26 -3.878 4.421 -2.325
183 HA ALA 26 HA ALA 26 -3.232 4.967 0.487
184 HB1 ALA 26 3HB ALA 26 -5.431 3.868 1.089
185 HB2 ALA 26 1HB ALA 26 -5.530 5.492 0.410
186 HB3 ALA 26 2HB ALA 26 -5.896 4.091 -0.597
187 H CYS 27 H CYS 27 -2.029 3.387 1.288
188 HA CYS 27 HA CYS 27 -1.934 0.814 -0.080
189 HB2 CYS 27 1HB CYS 27 -0.223 1.892 2.170
190 HB3 CYS 27 2HB CYS 27 0.058 0.392 1.293
191 H SER 28 H SER 28 -4.326 1.175 1.215
192 HA SER 28 HA SER 28 -4.093 -0.705 3.471
193 HB2 SER 28 1HB SER 28 -5.820 0.417 4.662
194 HB3 SER 28 2HB SER 28 -4.718 1.681 4.115
195 HG SER 28 HG SER 28 -6.163 2.061 2.373
196 H ASP 29 H ASP 29 -6.108 -1.953 3.866
197 HA ASP 29 HA ASP 29 -7.043 -3.076 1.394
198 HB2 ASP 29 1HB ASP 29 -6.583 -4.210 3.742
199 HB3 ASP 29 2HB ASP 29 -8.273 -3.799 4.019
200 H ASP 30 H ASP 30 -7.823 -0.484 1.367
201 HA ASP 30 HA ASP 30 -10.742 -0.710 1.647
202 HB2 ASP 30 1HB ASP 30 -9.495 0.774 3.407
203 HB3 ASP 30 2HB ASP 30 -9.380 1.927 2.080
204 H CYS 31 H CYS 31 -8.000 0.799 0.032
205 HA CYS 31 HA CYS 31 -9.171 2.408 -1.825
206 HB2 CYS 31 1HB CYS 31 -7.226 2.234 -3.086
207 HB3 CYS 31 2HB CYS 31 -6.676 1.733 -1.490
208 H LYS 32 H LYS 32 -9.076 -1.104 -1.822
209 HA LYS 32 HA LYS 32 -9.797 -1.799 -4.342
210 HB2 LYS 32 1HB LYS 32 -10.594 -2.874 -1.669
211 HB3 LYS 32 2HB LYS 32 -11.357 -3.530 -3.110
212 HG2 LYS 32 1HG LYS 32 -9.575 -4.962 -2.732
213 HG3 LYS 32 2HG LYS 32 -8.966 -3.869 -3.978
214 HD2 LYS 32 1HD LYS 32 -7.543 -2.789 -2.524
215 HD3 LYS 32 2HD LYS 32 -8.509 -3.202 -1.105
216 HE2 LYS 32 1HE LYS 32 -6.428 -4.450 -1.102
217 HE3 LYS 32 2HE LYS 32 -7.795 -5.541 -1.318
218 HZ1 LYS 32 3HZ LYS 32 -7.241 -5.954 -3.490
219 HZ2 LYS 32 1HZ LYS 32 -5.703 -5.761 -2.812
220 HZ3 LYS 32 2HZ LYS 32 -6.406 -4.496 -3.686
221 H ASP 33 H ASP 33 -11.934 -0.468 -1.861
222 HA ASP 33 HA ASP 33 -14.208 -0.519 -3.671
223 HB2 ASP 33 1HB ASP 33 -14.427 -1.025 -1.219
224 HB3 ASP 33 2HB ASP 33 -14.050 0.664 -0.893
225 H GLN 34 H GLN 34 -12.469 1.974 -1.802
226 HA GLN 34 HA GLN 34 -13.685 4.215 -2.845
227 HB2 GLN 34 1HB GLN 34 -10.839 3.793 -1.942
228 HB3 GLN 34 2HB GLN 34 -11.480 5.374 -2.369
229 HG2 GLN 34 1HG GLN 34 -12.932 3.732 -0.358
230 HG3 GLN 34 2HG GLN 34 -11.443 4.548 0.115
231 HE21 GLN 34 1HE2 GLN 34 -14.543 4.865 0.459
232 HE22 GLN 34 2HE2 GLN 34 -14.751 6.575 0.320
233 H GLY 35 H GLY 35 -10.551 2.912 -3.969
234 HA2 GLY 35 1HA GLY 35 -10.206 2.488 -6.340
235 HA3 GLY 35 2HA GLY 35 -11.267 3.849 -6.676
236 H ASP 36 H ASP 36 -8.596 3.649 -4.360
237 HA ASP 36 HA ASP 36 -7.087 5.563 -6.000
238 HB2 ASP 36 1HB ASP 36 -7.890 5.857 -3.117
239 HB3 ASP 36 2HB ASP 36 -6.448 6.655 -3.740
240 H CYS 37 H CYS 37 -6.556 2.878 -5.965
241 HA CYS 37 HA CYS 37 -4.567 2.237 -3.991
242 HB2 CYS 37 1HB CYS 37 -5.039 0.789 -6.595
243 HB3 CYS 37 2HB CYS 37 -4.357 0.144 -5.107
244 H CYS 38 H CYS 38 -2.424 2.518 -4.092
245 HA CYS 38 HA CYS 38 -1.195 4.315 -5.758
246 HB2 CYS 38 1HB CYS 38 0.246 1.924 -4.613
247 HB3 CYS 38 2HB CYS 38 0.894 3.532 -4.923
248 H ILE 39 H ILE 39 0.186 4.158 -7.561
249 HA ILE 39 HA ILE 39 -0.622 2.860 -9.762
250 HB ILE 39 HB ILE 39 1.204 4.488 -9.793
251 HG12 ILE 39 1HG1 ILE 39 2.789 3.027 -11.330
252 HG13 ILE 39 2HG1 ILE 39 1.509 1.833 -11.134
253 HG21 ILE 39 1HG2 ILE 39 3.131 2.340 -9.001
254 HG22 ILE 39 2HG2 ILE 39 3.352 4.089 -9.013
255 HG23 ILE 39 3HG2 ILE 39 2.341 3.337 -7.779
256 HD11 ILE 39 3HD1 ILE 39 0.822 4.608 -11.974
257 HD12 ILE 39 1HD1 ILE 39 1.475 3.467 -13.148
258 HD13 ILE 39 2HD1 ILE 39 -0.022 3.094 -12.294
259 H ASN 40 H ASN 40 1.625 1.512 -7.372
260 HA ASN 40 HA ASN 40 1.140 -1.146 -8.550
261 HB2 ASN 40 1HB ASN 40 3.472 -1.656 -7.483
262 HB3 ASN 40 2HB ASN 40 3.389 -0.831 -9.037
263 HD21 ASN 40 1HD2 ASN 40 3.183 0.088 -5.611
264 HD22 ASN 40 2HD2 ASN 40 4.304 1.397 -5.722
265 H TYR 41 H TYR 41 -0.646 -0.461 -6.759
266 HA TYR 41 HA TYR 41 0.154 -1.035 -4.058
267 HB2 TYR 41 1HB TYR 41 -1.653 0.483 -4.280
268 HB3 TYR 41 2HB TYR 41 -2.515 -0.584 -5.383
269 HD1 TYR 41 HD2 TYR 41 -3.223 -2.901 -4.384
270 HD2 TYR 41 HD1 TYR 41 -2.251 0.516 -2.041
271 HE1 TYR 41 HE2 TYR 41 -4.480 -3.846 -2.492
272 HE2 TYR 41 HE1 TYR 41 -3.502 -0.422 -0.144
273 HH TYR 41 HH TYR 41 -5.704 -2.735 -0.355
274 H SER 42 H SER 42 -1.844 -2.696 -6.491
275 HA SER 42 HA SER 42 -2.132 -5.054 -4.897
276 HB2 SER 42 1HB SER 42 -3.223 -6.009 -6.861
277 HB3 SER 42 2HB SER 42 -3.817 -4.373 -6.579
278 HG SER 42 HG SER 42 -1.652 -4.819 -8.320
279 H SER 43 H SER 43 -0.067 -4.074 -7.582
280 HA SER 43 HA SER 43 1.110 -6.576 -8.093
281 HB2 SER 43 1HB SER 43 1.356 -4.802 -9.701
282 HB3 SER 43 2HB SER 43 2.153 -3.768 -8.516
283 HG SER 43 HG SER 43 3.381 -6.191 -8.838
284 H VAL 44 H VAL 44 1.888 -4.033 -5.792
285 HA VAL 44 HA VAL 44 4.301 -5.362 -4.902
286 HB VAL 44 HB VAL 44 2.866 -2.917 -3.862
287 HG11 VAL 44 1HG1 VAL 44 4.672 -4.561 -2.486
288 HG12 VAL 44 2HG1 VAL 44 5.593 -3.144 -2.994
289 HG13 VAL 44 3HG1 VAL 44 4.127 -2.947 -2.034
290 HG21 VAL 44 3HG2 VAL 44 4.197 -1.672 -5.185
291 HG22 VAL 44 1HG2 VAL 44 5.587 -2.735 -4.963
292 HG23 VAL 44 2HG2 VAL 44 4.330 -3.156 -6.126
293 H CYS 45 H CYS 45 1.097 -4.624 -3.547
294 HA CYS 45 HA CYS 45 1.578 -6.108 -1.143
295 HB2 CYS 45 1HB CYS 45 -0.949 -4.963 -2.341
296 HB3 CYS 45 2HB CYS 45 -0.881 -5.752 -0.769
297 H GLN 46 H GLN 46 -0.857 -6.607 -3.703
298 HA GLN 46 HA GLN 46 -1.215 -9.352 -2.968
299 HB2 GLN 46 1HB GLN 46 -2.250 -7.670 -5.242
300 HB3 GLN 46 2HB GLN 46 -2.617 -9.384 -5.102
301 HG2 GLN 46 1HG GLN 46 -3.380 -8.688 -2.687
302 HG3 GLN 46 2HG GLN 46 -3.538 -7.101 -3.439
303 HE21 GLN 46 1HE2 GLN 46 -4.792 -7.074 -5.500
304 HE22 GLN 46 2HE2 GLN 46 -6.198 -8.074 -5.586
305 H GLY 47 H GLY 47 0.416 -10.732 -3.335
306 HA2 GLY 47 1HA GLY 47 1.625 -10.711 -6.033
307 HA3 GLY 47 2HA GLY 47 2.541 -11.086 -4.581
308 H GLU 48 H GLU 48 2.187 -13.080 -3.517
309 HA GLU 48 HA GLU 48 0.343 -15.015 -4.491
310 HB2 GLU 48 1HB GLU 48 2.199 -14.880 -6.284
311 HB3 GLU 48 2HB GLU 48 3.209 -15.694 -5.095
312 HG2 GLU 48 1HG GLU 48 1.914 -17.632 -5.144
313 HG3 GLU 48 2HG GLU 48 0.552 -16.811 -5.905
314 H LYS 49 H LYS 49 0.830 -17.224 -3.527
315 HA LYS 49 HA LYS 49 1.987 -16.835 -0.849
316 HB2 LYS 49 1HB LYS 49 -0.123 -18.786 -1.792
317 HB3 LYS 49 2HB LYS 49 0.534 -18.730 -0.161
318 HG2 LYS 49 1HG LYS 49 -0.706 -16.290 -1.351
319 HG3 LYS 49 2HG LYS 49 -1.721 -17.569 -0.682
320 HD2 LYS 49 1HD LYS 49 0.548 -16.347 0.867
321 HD3 LYS 49 2HD LYS 49 -1.079 -15.664 0.882
322 HE2 LYS 49 1HE LYS 49 -0.436 -18.518 1.604
323 HE3 LYS 49 2HE LYS 49 -0.584 -17.213 2.779
324 HZ1 LYS 49 3HZ LYS 49 -2.847 -16.966 2.319
325 HZ2 LYS 49 1HZ LYS 49 -2.618 -18.641 2.377
326 HZ3 LYS 49 2HZ LYS 49 -2.761 -17.859 0.884
327 H SER 50 H SER 50 3.265 -18.482 0.071
328 HA SER 50 HA SER 50 3.953 -20.876 -1.269
329 HB2 SER 50 1HB SER 50 5.120 -19.450 -2.835
330 HB3 SER 50 2HB SER 50 5.911 -18.582 -1.520
331 HG SER 50 HG SER 50 7.197 -20.255 -2.566
332 H SER 51 H SER 51 4.985 -22.252 0.087
333 HA SER 51 HA SER 51 5.489 -21.287 2.786
334 HB2 SER 51 1HB SER 51 4.135 -23.317 2.495
335 HB3 SER 51 2HB SER 51 5.483 -24.105 1.674
336 HG SER 51 HG SER 51 5.435 -24.704 3.853
337 H GLY 52 H GLY 52 7.444 -21.128 3.728
338 HA2 GLY 52 1HA GLY 52 9.736 -22.472 3.464
339 HA3 GLY 52 2HA GLY 52 9.778 -21.467 2.024
340 HA PRO 53 HA PRO 53 11.871 -19.076 5.351
341 HB2 PRO 53 1HB PRO 53 13.788 -18.067 3.714
342 HB3 PRO 53 2HB PRO 53 13.926 -19.647 4.493
343 HG2 PRO 53 1HG PRO 53 13.091 -18.980 1.697
344 HG3 PRO 53 2HG PRO 53 14.164 -20.272 2.266
345 HD2 PRO 53 1HD PRO 53 11.576 -20.715 1.606
346 HD3 PRO 53 2HD PRO 53 12.408 -21.636 2.874
347 H SER 54 H SER 54 11.894 -16.842 5.699
348 HA SER 54 HA SER 54 10.656 -15.192 3.599
349 HB2 SER 54 1HB SER 54 10.009 -15.054 6.554
350 HB3 SER 54 2HB SER 54 9.303 -14.056 5.283
351 HG SER 54 HG SER 54 9.020 -16.854 5.650
352 H SER 55 H SER 55 11.165 -12.951 3.663
353 HA SER 55 HA SER 55 13.716 -12.193 3.832
354 HB2 SER 55 1HB SER 55 12.976 -9.874 4.244
355 HB3 SER 55 2HB SER 55 11.946 -10.684 3.065
356 HG SER 55 HG SER 55 11.399 -10.071 5.766
357 H GLY 56 H GLY 56 15.267 -12.053 5.316
358 HA2 GLY 56 1HA GLY 56 15.082 -10.992 7.860
359 HA3 GLY 56 2HA GLY 56 14.758 -12.710 8.042
Start of MODEL 11
1 H1 GLY 1 H GLY 1 15.903 9.575 -3.440
2 HA2 GLY 1 1HA GLY 1 13.667 9.082 -4.200
3 HA3 GLY 1 2HA GLY 1 14.166 7.738 -3.183
4 H SER 2 H SER 2 13.475 7.725 -0.954
5 HA SER 2 HA SER 2 10.941 9.182 -0.591
6 HB2 SER 2 1HB SER 2 10.360 7.305 0.988
7 HB3 SER 2 2HB SER 2 10.525 6.819 -0.698
8 HG SER 2 HG SER 2 11.607 5.436 0.859
9 H SER 3 H SER 3 13.314 10.468 0.049
10 HA SER 3 HA SER 3 13.988 10.154 2.804
11 HB2 SER 3 1HB SER 3 15.211 12.311 2.483
12 HB3 SER 3 2HB SER 3 15.625 11.087 1.285
13 HG SER 3 HG SER 3 13.550 12.866 0.701
14 H GLY 4 H GLY 4 12.004 10.256 3.917
15 HA2 GLY 4 1HA GLY 4 11.144 12.069 5.445
16 HA3 GLY 4 2HA GLY 4 10.758 12.934 3.965
17 H SER 5 H SER 5 8.580 13.035 4.070
18 HA SER 5 HA SER 5 7.116 10.503 4.417
19 HB2 SER 5 1HB SER 5 6.148 13.346 4.807
20 HB3 SER 5 2HB SER 5 5.174 11.895 5.036
21 HG SER 5 HG SER 5 6.547 11.294 6.722
22 H SER 6 H SER 6 8.264 11.003 1.947
23 HA SER 6 HA SER 6 5.915 11.654 0.290
24 HB2 SER 6 1HB SER 6 8.082 13.145 0.202
25 HB3 SER 6 2HB SER 6 8.699 11.833 -0.802
26 HG SER 6 HG SER 6 7.542 13.650 -1.874
27 H GLY 7 H GLY 7 5.242 9.453 0.391
28 HA2 GLY 7 1HA GLY 7 6.829 7.710 -1.385
29 HA3 GLY 7 2HA GLY 7 6.133 7.087 0.103
30 H TRP 8 H TRP 8 5.620 7.730 -3.196
31 HA TRP 8 HA TRP 8 2.737 7.205 -2.923
32 HB2 TRP 8 1HB TRP 8 4.326 8.506 -5.137
33 HB3 TRP 8 2HB TRP 8 2.641 8.026 -5.319
34 HD1 TRP 8 HD1 TRP 8 4.410 11.037 -4.819
35 HE1 TRP 8 HE1 TRP 8 3.086 12.776 -3.461
36 HE3 TRP 8 HE3 TRP 8 0.871 7.957 -2.788
37 HZ2 TRP 8 HZ2 TRP 8 0.839 12.834 -1.753
38 HZ3 TRP 8 HZ3 TRP 8 -0.830 8.933 -1.302
39 HH2 TRP 8 HH2 TRP 8 -0.843 11.322 -0.797
40 H THR 9 H THR 9 4.477 5.065 -2.608
41 HA THR 9 HA THR 9 3.686 3.417 -4.881
42 HB THR 9 HB THR 9 5.908 2.362 -5.053
43 HG1 THR 9 HG1 THR 9 6.788 2.851 -3.043
44 HG21 THR 9 3HG2 THR 9 5.786 5.339 -5.517
45 HG22 THR 9 1HG2 THR 9 5.436 4.053 -6.671
46 HG23 THR 9 2HG2 THR 9 7.090 4.314 -6.116
47 H CYS 10 H CYS 10 2.414 2.006 -3.844
48 HA CYS 10 HA CYS 10 2.403 1.231 -1.236
49 HB2 CYS 10 1HB CYS 10 1.645 -0.225 -3.747
50 HB3 CYS 10 2HB CYS 10 1.529 -1.039 -2.190
51 H ASN 11 H ASN 11 3.331 -0.375 0.017
52 HA ASN 11 HA ASN 11 5.572 -1.863 -1.162
53 HB2 ASN 11 1HB ASN 11 5.661 -0.255 1.398
54 HB3 ASN 11 2HB ASN 11 6.910 -1.388 0.893
55 HD21 ASN 11 1HD2 ASN 11 7.682 1.107 1.366
56 HD22 ASN 11 2HD2 ASN 11 8.019 1.951 -0.103
57 H LYS 12 H LYS 12 6.056 -3.838 -0.172
58 HA LYS 12 HA LYS 12 4.060 -5.462 0.641
59 HB2 LYS 12 1HB LYS 12 6.897 -5.571 1.681
60 HB3 LYS 12 2HB LYS 12 5.750 -6.903 1.698
61 HG2 LYS 12 1HG LYS 12 6.501 -5.568 -0.871
62 HG3 LYS 12 2HG LYS 12 7.530 -6.812 -0.157
63 HD2 LYS 12 1HD LYS 12 5.832 -8.446 -0.317
64 HD3 LYS 12 2HD LYS 12 4.591 -7.234 -0.642
65 HE2 LYS 12 1HE LYS 12 5.142 -8.386 -2.688
66 HE3 LYS 12 2HE LYS 12 5.709 -6.719 -2.786
67 HZ1 LYS 12 3HZ LYS 12 7.348 -8.305 -3.621
68 HZ2 LYS 12 1HZ LYS 12 7.405 -9.062 -2.111
69 HZ3 LYS 12 2HZ LYS 12 7.935 -7.464 -2.275
70 H PHE 13 H PHE 13 6.028 -3.425 2.767
71 HA PHE 13 HA PHE 13 4.835 -4.301 5.185
72 HB2 PHE 13 1HB PHE 13 6.456 -1.878 4.434
73 HB3 PHE 13 2HB PHE 13 5.800 -2.079 6.055
74 HD1 PHE 13 HD2 PHE 13 6.422 -4.210 7.321
75 HD2 PHE 13 HD1 PHE 13 8.475 -2.861 3.844
76 HE1 PHE 13 HE2 PHE 13 8.363 -5.592 7.934
77 HE2 PHE 13 HE1 PHE 13 10.418 -4.242 4.452
78 HZ PHE 13 HZ PHE 13 10.365 -5.608 6.499
79 H ARG 14 H ARG 14 4.431 -1.256 3.370
80 HA ARG 14 HA ARG 14 2.454 -0.070 4.827
81 HB2 ARG 14 1HB ARG 14 2.832 -0.143 1.835
82 HB3 ARG 14 2HB ARG 14 1.645 0.889 2.620
83 HG2 ARG 14 1HG ARG 14 3.608 1.802 3.981
84 HG3 ARG 14 2HG ARG 14 4.633 1.017 2.779
85 HD2 ARG 14 1HD ARG 14 4.332 3.283 2.102
86 HD3 ARG 14 2HD ARG 14 3.383 2.270 1.015
87 HE ARG 14 HE ARG 14 1.938 3.353 3.275
88 HH11 ARG 14 1HH1 ARG 14 2.865 3.751 -0.057
89 HH12 ARG 14 2HH1 ARG 14 1.558 4.827 -0.428
90 HH21 ARG 14 1HH2 ARG 14 0.214 4.768 2.800
91 HH22 ARG 14 2HH2 ARG 14 0.051 5.405 1.198
92 H CYS 15 H CYS 15 2.007 -2.500 2.274
93 HA CYS 15 HA CYS 15 -0.623 -2.684 1.908
94 HB2 CYS 15 1HB CYS 15 1.113 -5.062 2.610
95 HB3 CYS 15 2HB CYS 15 -0.418 -5.127 1.743
96 H GLY 16 H GLY 16 -2.131 -2.168 3.388
97 HA2 GLY 16 1HA GLY 16 -3.668 -2.957 5.018
98 HA3 GLY 16 2HA GLY 16 -2.394 -3.961 5.695
99 H GLU 17 H GLU 17 -2.730 -0.476 5.007
100 HA GLU 17 HA GLU 17 -1.986 0.031 7.814
101 HB2 GLU 17 1HB GLU 17 -0.908 2.123 7.022
102 HB3 GLU 17 2HB GLU 17 -0.143 0.670 6.394
103 HG2 GLU 17 1HG GLU 17 -1.215 0.967 4.262
104 HG3 GLU 17 2HG GLU 17 -2.134 2.340 4.878
105 H LYS 18 H LYS 18 -2.901 1.888 8.810
106 HA LYS 18 HA LYS 18 -5.203 3.070 7.423
107 HB2 LYS 18 1HB LYS 18 -6.591 2.823 9.412
108 HB3 LYS 18 2HB LYS 18 -6.040 1.251 8.849
109 HG2 LYS 18 1HG LYS 18 -4.464 2.653 10.947
110 HG3 LYS 18 2HG LYS 18 -5.985 1.877 11.392
111 HD2 LYS 18 1HD LYS 18 -5.157 -0.226 10.378
112 HD3 LYS 18 2HD LYS 18 -3.612 0.568 10.064
113 HE2 LYS 18 1HE LYS 18 -3.283 -0.608 12.066
114 HE3 LYS 18 2HE LYS 18 -3.555 1.061 12.567
115 HZ1 LYS 18 3HZ LYS 18 -5.059 -1.271 13.193
116 HZ2 LYS 18 1HZ LYS 18 -6.048 -0.085 12.502
117 HZ3 LYS 18 2HZ LYS 18 -5.138 0.271 13.883
118 H ARG 19 H ARG 19 -2.686 4.243 7.758
119 HA ARG 19 HA ARG 19 -3.231 6.298 9.800
120 HB2 ARG 19 1HB ARG 19 -1.162 4.925 10.148
121 HB3 ARG 19 2HB ARG 19 -0.541 5.569 8.633
122 HG2 ARG 19 1HG ARG 19 0.448 7.008 10.081
123 HG3 ARG 19 2HG ARG 19 -1.067 7.874 9.817
124 HD2 ARG 19 1HD ARG 19 -0.539 7.793 12.185
125 HD3 ARG 19 2HD ARG 19 -1.991 6.852 11.845
126 HE ARG 19 HE ARG 19 -0.860 4.928 12.429
127 HH11 ARG 19 1HH1 ARG 19 1.352 7.609 12.235
128 HH12 ARG 19 2HH1 ARG 19 2.659 6.754 12.984
129 HH21 ARG 19 1HH2 ARG 19 0.853 3.791 13.416
130 HH22 ARG 19 2HH2 ARG 19 2.375 4.583 13.654
131 H LEU 20 H LEU 20 -4.519 6.563 7.417
132 HA LEU 20 HA LEU 20 -3.428 9.047 6.450
133 HB2 LEU 20 1HB LEU 20 -3.164 8.471 4.181
134 HB3 LEU 20 2HB LEU 20 -2.289 7.254 5.107
135 HG LEU 20 HG LEU 20 -5.075 6.759 4.102
136 HD11 LEU 20 1HD1 LEU 20 -3.319 7.438 2.301
137 HD12 LEU 20 2HD1 LEU 20 -4.335 6.018 2.053
138 HD13 LEU 20 3HD1 LEU 20 -2.670 5.826 2.602
139 HD21 LEU 20 3HD2 LEU 20 -2.985 4.674 4.373
140 HD22 LEU 20 1HD2 LEU 20 -4.720 4.591 4.682
141 HD23 LEU 20 2HD2 LEU 20 -3.652 5.355 5.858
142 H THR 21 H THR 21 -4.986 10.387 5.661
143 HA THR 21 HA THR 21 -7.723 9.302 5.600
144 HB THR 21 HB THR 21 -6.943 12.189 6.027
145 HG1 THR 21 HG1 THR 21 -7.791 11.395 8.272
146 HG21 THR 21 3HG2 THR 21 -9.504 11.005 6.960
147 HG22 THR 21 1HG2 THR 21 -9.321 11.301 5.231
148 HG23 THR 21 2HG2 THR 21 -9.157 12.632 6.376
149 H ARG 22 H ARG 22 -5.882 12.012 4.177
150 HA ARG 22 HA ARG 22 -7.226 11.446 1.617
151 HB2 ARG 22 1HB ARG 22 -6.664 14.111 2.914
152 HB3 ARG 22 2HB ARG 22 -7.022 13.950 1.200
153 HG2 ARG 22 1HG ARG 22 -8.865 12.884 3.312
154 HG3 ARG 22 2HG ARG 22 -8.944 14.554 2.749
155 HD2 ARG 22 1HD ARG 22 -9.184 12.105 1.004
156 HD3 ARG 22 2HD ARG 22 -10.532 13.089 1.572
157 HE ARG 22 HE ARG 22 -8.862 14.844 0.295
158 HH11 ARG 22 1HH1 ARG 22 -10.526 11.911 -0.572
159 HH12 ARG 22 2HH1 ARG 22 -10.704 12.350 -2.239
160 HH21 ARG 22 1HH2 ARG 22 -9.091 15.434 -1.897
161 HH22 ARG 22 2HH2 ARG 22 -9.888 14.354 -2.991
162 H SER 23 H SER 23 -5.637 10.461 0.499
163 HA SER 23 HA SER 23 -3.228 12.021 -0.053
164 HB2 SER 23 1HB SER 23 -3.249 9.187 0.987
165 HB3 SER 23 2HB SER 23 -1.871 9.870 0.124
166 HG SER 23 HG SER 23 -1.472 10.261 2.239
167 H LEU 24 H LEU 24 -2.254 11.561 -2.053
168 HA LEU 24 HA LEU 24 -3.728 11.211 -4.244
169 HB2 LEU 24 1HB LEU 24 -0.980 10.034 -3.858
170 HB3 LEU 24 2HB LEU 24 -1.750 10.331 -5.415
171 HG LEU 24 HG LEU 24 -0.902 12.419 -3.409
172 HD11 LEU 24 1HD1 LEU 24 0.763 11.105 -4.979
173 HD12 LEU 24 2HD1 LEU 24 0.922 12.841 -4.712
174 HD13 LEU 24 3HD1 LEU 24 0.151 12.241 -6.181
175 HD21 LEU 24 3HD2 LEU 24 -2.673 12.510 -5.758
176 HD22 LEU 24 1HD2 LEU 24 -1.433 13.763 -5.689
177 HD23 LEU 24 2HD2 LEU 24 -2.578 13.583 -4.360
178 H CYS 25 H CYS 25 -2.135 8.475 -2.604
179 HA CYS 25 HA CYS 25 -4.228 6.722 -3.703
180 HB2 CYS 25 1HB CYS 25 -2.704 5.076 -4.330
181 HB3 CYS 25 2HB CYS 25 -1.869 6.558 -4.784
182 H ALA 26 H ALA 26 -4.111 4.504 -2.500
183 HA ALA 26 HA ALA 26 -3.358 4.745 0.294
184 HB1 ALA 26 3HB ALA 26 -6.223 4.513 -0.593
185 HB2 ALA 26 1HB ALA 26 -5.679 4.076 1.026
186 HB3 ALA 26 2HB ALA 26 -5.502 5.736 0.453
187 H CYS 27 H CYS 27 -2.429 2.890 0.825
188 HA CYS 27 HA CYS 27 -2.973 0.495 -0.734
189 HB2 CYS 27 1HB CYS 27 -0.974 0.874 1.503
190 HB3 CYS 27 2HB CYS 27 -1.017 -0.440 0.331
191 H SER 28 H SER 28 -5.119 1.306 0.868
192 HA SER 28 HA SER 28 -5.138 -0.763 2.967
193 HB2 SER 28 1HB SER 28 -6.951 0.597 4.032
194 HB3 SER 28 2HB SER 28 -5.395 1.424 3.962
195 HG SER 28 HG SER 28 -7.766 1.963 2.609
196 H ASP 29 H ASP 29 -6.878 -2.153 3.104
197 HA ASP 29 HA ASP 29 -8.045 -3.164 0.892
198 HB2 ASP 29 1HB ASP 29 -9.822 -4.088 2.332
199 HB3 ASP 29 2HB ASP 29 -8.233 -4.233 3.077
200 H ASP 30 H ASP 30 -9.322 -0.497 2.835
201 HA ASP 30 HA ASP 30 -11.785 -0.141 1.650
202 HB2 ASP 30 1HB ASP 30 -9.837 1.692 2.969
203 HB3 ASP 30 2HB ASP 30 -11.194 2.410 2.105
204 H CYS 31 H CYS 31 -8.630 1.023 0.551
205 HA CYS 31 HA CYS 31 -9.314 2.690 -1.501
206 HB2 CYS 31 1HB CYS 31 -7.175 2.376 -2.352
207 HB3 CYS 31 2HB CYS 31 -6.981 1.857 -0.680
208 H LYS 32 H LYS 32 -9.474 -0.816 -1.449
209 HA LYS 32 HA LYS 32 -9.824 -1.343 -4.154
210 HB2 LYS 32 1HB LYS 32 -10.948 -2.715 -1.714
211 HB3 LYS 32 2HB LYS 32 -11.158 -3.345 -3.342
212 HG2 LYS 32 1HG LYS 32 -8.469 -2.795 -2.117
213 HG3 LYS 32 2HG LYS 32 -9.283 -4.358 -2.029
214 HD2 LYS 32 1HD LYS 32 -8.984 -3.083 -4.699
215 HD3 LYS 32 2HD LYS 32 -7.548 -3.787 -3.950
216 HE2 LYS 32 1HE LYS 32 -8.346 -5.606 -5.089
217 HE3 LYS 32 2HE LYS 32 -9.166 -5.822 -3.544
218 HZ1 LYS 32 3HZ LYS 32 -10.720 -4.167 -5.213
219 HZ2 LYS 32 1HZ LYS 32 -11.109 -5.681 -4.565
220 HZ3 LYS 32 2HZ LYS 32 -10.319 -5.578 -6.058
221 H ASP 33 H ASP 33 -12.205 -0.402 -1.713
222 HA ASP 33 HA ASP 33 -14.405 -0.525 -3.563
223 HB2 ASP 33 1HB ASP 33 -14.266 0.734 -0.814
224 HB3 ASP 33 2HB ASP 33 -15.734 0.390 -1.724
225 H GLN 34 H GLN 34 -12.744 2.125 -1.849
226 HA GLN 34 HA GLN 34 -14.083 4.237 -3.080
227 HB2 GLN 34 1HB GLN 34 -11.320 4.035 -1.896
228 HB3 GLN 34 2HB GLN 34 -11.965 5.548 -2.521
229 HG2 GLN 34 1HG GLN 34 -13.958 5.039 -0.930
230 HG3 GLN 34 2HG GLN 34 -12.801 3.977 -0.129
231 HE21 GLN 34 1HE2 GLN 34 -13.964 6.188 1.102
232 HE22 GLN 34 2HE2 GLN 34 -12.732 7.355 1.422
233 H GLY 35 H GLY 35 -10.824 3.010 -3.885
234 HA2 GLY 35 1HA GLY 35 -10.306 2.484 -6.211
235 HA3 GLY 35 2HA GLY 35 -11.340 3.826 -6.676
236 H ASP 36 H ASP 36 -8.698 3.521 -4.308
237 HA ASP 36 HA ASP 36 -7.296 5.675 -5.747
238 HB2 ASP 36 1HB ASP 36 -7.915 5.404 -2.833
239 HB3 ASP 36 2HB ASP 36 -6.424 6.207 -3.318
240 H CYS 37 H CYS 37 -7.204 2.536 -4.607
241 HA CYS 37 HA CYS 37 -4.832 1.911 -3.567
242 HB2 CYS 37 1HB CYS 37 -5.812 0.534 -6.072
243 HB3 CYS 37 2HB CYS 37 -4.845 -0.165 -4.778
244 H CYS 38 H CYS 38 -2.810 2.528 -3.890
245 HA CYS 38 HA CYS 38 -1.826 4.128 -5.854
246 HB2 CYS 38 1HB CYS 38 -0.123 1.924 -4.710
247 HB3 CYS 38 2HB CYS 38 0.350 3.565 -5.138
248 H ILE 39 H ILE 39 -0.492 3.786 -7.717
249 HA ILE 39 HA ILE 39 -1.552 2.062 -9.612
250 HB ILE 39 HB ILE 39 -0.231 4.022 -10.224
251 HG12 ILE 39 1HG1 ILE 39 1.225 1.612 -11.295
252 HG13 ILE 39 2HG1 ILE 39 -0.455 1.934 -11.714
253 HG21 ILE 39 1HG2 ILE 39 2.312 3.739 -10.149
254 HG22 ILE 39 2HG2 ILE 39 1.487 4.130 -8.641
255 HG23 ILE 39 3HG2 ILE 39 2.006 2.475 -8.957
256 HD11 ILE 39 3HD1 ILE 39 2.012 3.395 -12.489
257 HD12 ILE 39 1HD1 ILE 39 0.621 2.919 -13.465
258 HD13 ILE 39 2HD1 ILE 39 0.497 4.289 -12.361
259 H ASN 40 H ASN 40 1.048 1.555 -7.323
260 HA ASN 40 HA ASN 40 1.468 -1.144 -8.421
261 HB2 ASN 40 1HB ASN 40 3.624 -1.126 -7.231
262 HB3 ASN 40 2HB ASN 40 3.498 0.223 -8.358
263 HD21 ASN 40 1HD2 ASN 40 4.837 -0.429 -5.619
264 HD22 ASN 40 2HD2 ASN 40 4.592 1.031 -4.729
265 H TYR 41 H TYR 41 -0.795 -0.612 -6.840
266 HA TYR 41 HA TYR 41 -0.379 -1.263 -4.110
267 HB2 TYR 41 1HB TYR 41 -2.400 -0.146 -4.632
268 HB3 TYR 41 2HB TYR 41 -2.807 -1.304 -5.893
269 HD1 TYR 41 HD1 TYR 41 -2.277 -1.090 -2.207
270 HD2 TYR 41 HD2 TYR 41 -4.277 -3.038 -5.418
271 HE1 TYR 41 HE1 TYR 41 -3.616 -2.371 -0.588
272 HE2 TYR 41 HE2 TYR 41 -5.623 -4.323 -3.808
273 HH TYR 41 HH TYR 41 -4.956 -4.914 -0.913
274 H SER 42 H SER 42 -1.782 -3.202 -6.757
275 HA SER 42 HA SER 42 -1.667 -5.628 -5.265
276 HB2 SER 42 1HB SER 42 -2.209 -6.686 -7.492
277 HB3 SER 42 2HB SER 42 -3.341 -5.439 -6.972
278 HG SER 42 HG SER 42 -2.515 -4.056 -8.450
279 H SER 43 H SER 43 0.274 -4.277 -7.911
280 HA SER 43 HA SER 43 1.979 -6.341 -8.452
281 HB2 SER 43 1HB SER 43 1.890 -3.858 -9.340
282 HB3 SER 43 2HB SER 43 3.162 -3.608 -8.145
283 HG SER 43 HG SER 43 4.487 -4.883 -9.256
284 H VAL 44 H VAL 44 2.055 -4.173 -5.684
285 HA VAL 44 HA VAL 44 4.464 -5.469 -4.655
286 HB VAL 44 HB VAL 44 2.884 -3.124 -3.587
287 HG11 VAL 44 1HG1 VAL 44 4.119 -3.126 -1.721
288 HG12 VAL 44 2HG1 VAL 44 4.476 -4.807 -2.123
289 HG13 VAL 44 3HG1 VAL 44 5.599 -3.529 -2.590
290 HG21 VAL 44 3HG2 VAL 44 3.958 -2.149 -5.326
291 HG22 VAL 44 1HG2 VAL 44 5.304 -2.135 -4.187
292 HG23 VAL 44 2HG2 VAL 44 5.195 -3.403 -5.407
293 H CYS 45 H CYS 45 1.151 -4.740 -3.557
294 HA CYS 45 HA CYS 45 1.326 -6.383 -1.242
295 HB2 CYS 45 1HB CYS 45 -1.073 -5.270 -2.710
296 HB3 CYS 45 2HB CYS 45 -1.150 -6.080 -1.148
297 H GLN 46 H GLN 46 -0.599 -6.804 -4.219
298 HA GLN 46 HA GLN 46 -0.873 -9.640 -3.644
299 HB2 GLN 46 1HB GLN 46 -2.137 -7.729 -5.560
300 HB3 GLN 46 2HB GLN 46 -2.166 -9.446 -5.940
301 HG2 GLN 46 1HG GLN 46 -3.083 -8.458 -3.272
302 HG3 GLN 46 2HG GLN 46 -4.150 -8.404 -4.674
303 HE21 GLN 46 1HE2 GLN 46 -4.741 -9.889 -2.417
304 HE22 GLN 46 2HE2 GLN 46 -4.686 -11.569 -2.817
305 H GLY 47 H GLY 47 1.372 -10.186 -3.919
306 HA2 GLY 47 1HA GLY 47 2.252 -10.178 -6.737
307 HA3 GLY 47 2HA GLY 47 3.339 -10.214 -5.357
308 H GLU 48 H GLU 48 4.347 -12.106 -5.295
309 HA GLU 48 HA GLU 48 2.926 -14.518 -6.147
310 HB2 GLU 48 1HB GLU 48 5.162 -14.019 -7.113
311 HB3 GLU 48 2HB GLU 48 5.857 -14.154 -5.504
312 HG2 GLU 48 1HG GLU 48 6.278 -16.209 -6.528
313 HG3 GLU 48 2HG GLU 48 4.914 -16.505 -5.452
314 H LYS 49 H LYS 49 3.057 -16.464 -4.876
315 HA LYS 49 HA LYS 49 2.840 -15.894 -2.026
316 HB2 LYS 49 1HB LYS 49 1.955 -18.248 -1.924
317 HB3 LYS 49 2HB LYS 49 1.012 -17.142 -2.913
318 HG2 LYS 49 1HG LYS 49 3.108 -18.728 -4.276
319 HG3 LYS 49 2HG LYS 49 1.666 -19.583 -3.722
320 HD2 LYS 49 1HD LYS 49 1.283 -17.030 -5.194
321 HD3 LYS 49 2HD LYS 49 1.800 -18.443 -6.118
322 HE2 LYS 49 1HE LYS 49 -0.562 -18.471 -4.253
323 HE3 LYS 49 2HE LYS 49 -0.694 -18.066 -5.963
324 HZ1 LYS 49 3HZ LYS 49 0.270 -20.250 -6.480
325 HZ2 LYS 49 1HZ LYS 49 -1.189 -20.380 -5.633
326 HZ3 LYS 49 2HZ LYS 49 0.279 -20.634 -4.833
327 H SER 50 H SER 50 3.677 -17.648 -0.518
328 HA SER 50 HA SER 50 6.342 -17.689 -0.297
329 HB2 SER 50 1HB SER 50 4.263 -19.663 0.517
330 HB3 SER 50 2HB SER 50 5.952 -20.145 0.676
331 HG SER 50 HG SER 50 6.096 -18.900 2.351
332 H SER 51 H SER 51 8.090 -18.637 -1.187
333 HA SER 51 HA SER 51 7.969 -19.728 -3.755
334 HB2 SER 51 1HB SER 51 10.204 -20.036 -1.736
335 HB3 SER 51 2HB SER 51 10.343 -20.230 -3.483
336 HG SER 51 HG SER 51 9.244 -17.837 -2.746
337 H GLY 52 H GLY 52 8.886 -21.424 -0.746
338 HA2 GLY 52 1HA GLY 52 7.259 -23.607 -0.904
339 HA3 GLY 52 2HA GLY 52 8.580 -23.998 -1.993
340 HA PRO 53 HA PRO 53 11.086 -25.371 1.323
341 HB2 PRO 53 1HB PRO 53 13.537 -24.356 0.743
342 HB3 PRO 53 2HB PRO 53 12.798 -25.671 -0.179
343 HG2 PRO 53 1HG PRO 53 12.926 -22.749 -0.817
344 HG3 PRO 53 2HG PRO 53 13.176 -24.140 -1.888
345 HD2 PRO 53 1HD PRO 53 10.852 -22.754 -1.822
346 HD3 PRO 53 2HD PRO 53 10.915 -24.494 -2.165
347 H SER 54 H SER 54 10.214 -22.205 1.101
348 HA SER 54 HA SER 54 11.680 -21.463 3.547
349 HB2 SER 54 1HB SER 54 12.208 -20.005 1.640
350 HB3 SER 54 2HB SER 54 10.494 -19.646 1.434
351 HG SER 54 HG SER 54 11.302 -17.998 2.636
352 H SER 55 H SER 55 10.521 -21.290 5.341
353 HA SER 55 HA SER 55 7.721 -20.466 5.192
354 HB2 SER 55 1HB SER 55 6.909 -22.301 6.493
355 HB3 SER 55 2HB SER 55 7.854 -22.998 5.177
356 HG SER 55 HG SER 55 9.624 -23.103 6.700
357 H GLY 56 H GLY 56 7.069 -19.231 6.884
358 HA2 GLY 56 1HA GLY 56 7.117 -18.224 8.974
359 HA3 GLY 56 2HA GLY 56 8.493 -19.235 9.395
Start of MODEL 12
1 H1 GLY 1 H GLY 1 15.475 13.337 -12.870
2 HA2 GLY 1 1HA GLY 1 12.639 13.844 -13.287
3 HA3 GLY 1 2HA GLY 1 13.580 12.535 -13.988
4 H SER 2 H SER 2 14.670 11.411 -11.691
5 HA SER 2 HA SER 2 12.327 10.045 -10.655
6 HB2 SER 2 1HB SER 2 15.271 9.509 -10.180
7 HB3 SER 2 2HB SER 2 13.940 8.460 -9.692
8 HG SER 2 HG SER 2 15.054 7.970 -11.753
9 H SER 3 H SER 3 11.447 11.680 -9.327
10 HA SER 3 HA SER 3 12.920 12.068 -6.806
11 HB2 SER 3 1HB SER 3 11.531 14.065 -8.530
12 HB3 SER 3 2HB SER 3 11.426 14.273 -6.782
13 HG SER 3 HG SER 3 13.468 14.802 -6.719
14 H GLY 4 H GLY 4 11.916 10.843 -5.344
15 HA2 GLY 4 1HA GLY 4 9.431 11.363 -4.298
16 HA3 GLY 4 2HA GLY 4 9.147 10.148 -5.534
17 H SER 5 H SER 5 9.915 10.664 -2.322
18 HA SER 5 HA SER 5 11.336 8.149 -1.967
19 HB2 SER 5 1HB SER 5 12.193 9.869 -0.588
20 HB3 SER 5 2HB SER 5 10.581 10.396 -0.104
21 HG SER 5 HG SER 5 11.293 7.773 0.494
22 H SER 6 H SER 6 9.749 6.645 -2.548
23 HA SER 6 HA SER 6 7.899 5.322 -2.321
24 HB2 SER 6 1HB SER 6 8.495 5.878 0.596
25 HB3 SER 6 2HB SER 6 7.470 4.572 0.002
26 HG SER 6 HG SER 6 10.118 4.847 -0.915
27 H GLY 7 H GLY 7 7.167 7.899 -2.942
28 HA2 GLY 7 1HA GLY 7 5.149 8.845 -1.112
29 HA3 GLY 7 2HA GLY 7 5.500 9.493 -2.708
30 H TRP 8 H TRP 8 4.942 7.776 -4.510
31 HA TRP 8 HA TRP 8 2.155 7.007 -4.006
32 HB2 TRP 8 1HB TRP 8 3.667 7.613 -6.546
33 HB3 TRP 8 2HB TRP 8 2.059 6.894 -6.548
34 HD1 TRP 8 HD1 TRP 8 3.854 10.191 -6.094
35 HE1 TRP 8 HE1 TRP 8 2.119 12.076 -5.846
36 HE3 TRP 8 HE3 TRP 8 -0.368 7.349 -5.610
37 HZ2 TRP 8 HZ2 TRP 8 -0.670 12.325 -5.491
38 HZ3 TRP 8 HZ3 TRP 8 -2.529 8.487 -5.319
39 HH2 TRP 8 HH2 TRP 8 -2.675 10.924 -5.261
40 H THR 9 H THR 9 4.063 5.302 -2.958
41 HA THR 9 HA THR 9 3.603 2.909 -4.588
42 HB THR 9 HB THR 9 5.862 2.072 -4.160
43 HG1 THR 9 HG1 THR 9 7.183 3.087 -2.840
44 HG21 THR 9 3HG2 THR 9 5.526 4.683 -5.583
45 HG22 THR 9 1HG2 THR 9 5.776 3.071 -6.252
46 HG23 THR 9 2HG2 THR 9 7.115 3.927 -5.489
47 H CYS 10 H CYS 10 2.796 1.282 -3.430
48 HA CYS 10 HA CYS 10 2.578 1.570 -0.554
49 HB2 CYS 10 1HB CYS 10 1.321 -0.175 -2.627
50 HB3 CYS 10 2HB CYS 10 1.322 -0.728 -0.955
51 H ASN 11 H ASN 11 2.985 -0.317 0.867
52 HA ASN 11 HA ASN 11 5.322 -1.866 -0.039
53 HB2 ASN 11 1HB ASN 11 5.756 0.039 1.637
54 HB3 ASN 11 2HB ASN 11 4.931 -0.981 2.813
55 HD21 ASN 11 1HD2 ASN 11 5.920 -2.821 3.564
56 HD22 ASN 11 2HD2 ASN 11 7.583 -3.181 3.264
57 H LYS 12 H LYS 12 5.488 -3.989 0.661
58 HA LYS 12 HA LYS 12 3.322 -5.583 0.807
59 HB2 LYS 12 1HB LYS 12 5.889 -6.133 0.871
60 HB3 LYS 12 2HB LYS 12 5.619 -6.263 2.604
61 HG2 LYS 12 1HG LYS 12 5.355 -8.438 1.881
62 HG3 LYS 12 2HG LYS 12 3.691 -7.852 1.950
63 HD2 LYS 12 1HD LYS 12 3.733 -7.423 -0.452
64 HD3 LYS 12 2HD LYS 12 5.410 -7.968 -0.529
65 HE2 LYS 12 1HE LYS 12 4.156 -9.817 -1.232
66 HE3 LYS 12 2HE LYS 12 4.554 -10.167 0.449
67 HZ1 LYS 12 3HZ LYS 12 2.262 -9.000 0.849
68 HZ2 LYS 12 1HZ LYS 12 2.338 -10.638 0.431
69 HZ3 LYS 12 2HZ LYS 12 1.968 -9.481 -0.745
70 H PHE 13 H PHE 13 5.027 -4.378 3.701
71 HA PHE 13 HA PHE 13 3.259 -5.398 5.598
72 HB2 PHE 13 1HB PHE 13 5.178 -3.091 5.592
73 HB3 PHE 13 2HB PHE 13 4.121 -3.353 6.976
74 HD1 PHE 13 HD2 PHE 13 4.062 -6.065 7.557
75 HD2 PHE 13 HD1 PHE 13 7.306 -3.842 5.930
76 HE1 PHE 13 HE2 PHE 13 5.642 -7.727 8.448
77 HE2 PHE 13 HE1 PHE 13 8.892 -5.501 6.819
78 HZ PHE 13 HZ PHE 13 8.061 -7.445 8.080
79 H ARG 14 H ARG 14 3.327 -2.152 4.135
80 HA ARG 14 HA ARG 14 1.244 -0.942 5.397
81 HB2 ARG 14 1HB ARG 14 2.124 -0.826 2.525
82 HB3 ARG 14 2HB ARG 14 0.775 0.144 3.100
83 HG2 ARG 14 1HG ARG 14 2.393 0.994 4.892
84 HG3 ARG 14 2HG ARG 14 3.661 0.300 3.880
85 HD2 ARG 14 1HD ARG 14 3.574 2.472 3.106
86 HD3 ARG 14 2HD ARG 14 2.505 1.641 1.976
87 HE ARG 14 HE ARG 14 0.711 2.786 2.860
88 HH11 ARG 14 1HH1 ARG 14 3.535 3.283 4.835
89 HH12 ARG 14 2HH1 ARG 14 2.819 4.556 5.767
90 HH21 ARG 14 1HH2 ARG 14 -0.242 4.461 4.080
91 HH22 ARG 14 2HH2 ARG 14 0.671 5.224 5.339
92 H CYS 15 H CYS 15 1.006 -3.189 2.661
93 HA CYS 15 HA CYS 15 -1.589 -3.134 1.972
94 HB2 CYS 15 1HB CYS 15 -0.178 -5.732 2.601
95 HB3 CYS 15 2HB CYS 15 -1.467 -5.475 1.430
96 H GLY 16 H GLY 16 -3.405 -3.004 3.105
97 HA2 GLY 16 1HA GLY 16 -5.075 -3.753 4.547
98 HA3 GLY 16 2HA GLY 16 -3.942 -4.918 5.215
99 H GLU 17 H GLU 17 -3.457 -1.433 4.933
100 HA GLU 17 HA GLU 17 -2.954 -1.319 7.800
101 HB2 GLU 17 1HB GLU 17 -2.077 0.933 7.339
102 HB3 GLU 17 2HB GLU 17 -1.314 -0.285 6.327
103 HG2 GLU 17 1HG GLU 17 -1.695 1.299 4.757
104 HG3 GLU 17 2HG GLU 17 -3.225 0.431 4.649
105 H LYS 18 H LYS 18 -3.794 0.553 9.039
106 HA LYS 18 HA LYS 18 -6.621 0.662 8.874
107 HB2 LYS 18 1HB LYS 18 -6.515 2.114 10.788
108 HB3 LYS 18 2HB LYS 18 -5.312 0.848 10.988
109 HG2 LYS 18 1HG LYS 18 -3.732 2.638 9.881
110 HG3 LYS 18 2HG LYS 18 -4.948 3.756 10.505
111 HD2 LYS 18 1HD LYS 18 -4.461 3.277 12.693
112 HD3 LYS 18 2HD LYS 18 -3.905 1.643 12.325
113 HE2 LYS 18 1HE LYS 18 -1.864 2.537 11.353
114 HE3 LYS 18 2HE LYS 18 -2.426 4.182 11.641
115 HZ1 LYS 18 3HZ LYS 18 -1.667 2.148 13.656
116 HZ2 LYS 18 1HZ LYS 18 -2.502 3.564 14.057
117 HZ3 LYS 18 2HZ LYS 18 -0.954 3.657 13.383
118 H ARG 19 H ARG 19 -7.807 2.818 8.943
119 HA ARG 19 HA ARG 19 -7.925 4.052 6.572
120 HB2 ARG 19 1HB ARG 19 -8.346 5.219 9.313
121 HB3 ARG 19 2HB ARG 19 -8.655 6.158 7.858
122 HG2 ARG 19 1HG ARG 19 -10.164 4.220 7.149
123 HG3 ARG 19 2HG ARG 19 -10.056 3.697 8.831
124 HD2 ARG 19 1HD ARG 19 -12.040 5.047 8.512
125 HD3 ARG 19 2HD ARG 19 -10.893 5.896 9.548
126 HE ARG 19 HE ARG 19 -10.287 6.904 7.153
127 HH11 ARG 19 1HH1 ARG 19 -13.355 6.406 8.720
128 HH12 ARG 19 2HH1 ARG 19 -14.121 7.748 7.937
129 HH21 ARG 19 1HH2 ARG 19 -11.285 8.674 6.114
130 HH22 ARG 19 2HH2 ARG 19 -12.943 9.037 6.454
131 H LEU 20 H LEU 20 -6.408 4.909 5.324
132 HA LEU 20 HA LEU 20 -3.871 5.671 6.006
133 HB2 LEU 20 1HB LEU 20 -3.659 6.563 3.891
134 HB3 LEU 20 2HB LEU 20 -5.000 5.436 3.698
135 HG LEU 20 HG LEU 20 -5.479 8.355 4.210
136 HD11 LEU 20 1HD1 LEU 20 -3.958 7.803 2.168
137 HD12 LEU 20 2HD1 LEU 20 -5.321 8.906 1.981
138 HD13 LEU 20 3HD1 LEU 20 -5.462 7.231 1.445
139 HD21 LEU 20 3HD2 LEU 20 -7.187 6.283 4.219
140 HD22 LEU 20 1HD2 LEU 20 -7.221 6.693 2.503
141 HD23 LEU 20 2HD2 LEU 20 -7.636 7.912 3.709
142 H THR 21 H THR 21 -3.009 8.020 5.642
143 HA THR 21 HA THR 21 -4.705 10.047 6.861
144 HB THR 21 HB THR 21 -2.029 9.373 8.095
145 HG1 THR 21 HG1 THR 21 -3.465 8.713 9.893
146 HG21 THR 21 3HG2 THR 21 -3.827 10.877 9.746
147 HG22 THR 21 1HG2 THR 21 -3.633 11.688 8.193
148 HG23 THR 21 2HG2 THR 21 -2.216 11.313 9.174
149 H ARG 22 H ARG 22 -4.522 11.684 5.481
150 HA ARG 22 HA ARG 22 -3.643 13.021 3.826
151 HB2 ARG 22 1HB ARG 22 -1.649 13.246 6.082
152 HB3 ARG 22 2HB ARG 22 -1.653 14.315 4.685
153 HG2 ARG 22 1HG ARG 22 -4.027 13.969 6.496
154 HG3 ARG 22 2HG ARG 22 -2.785 15.199 6.743
155 HD2 ARG 22 1HD ARG 22 -4.137 14.957 4.089
156 HD3 ARG 22 2HD ARG 22 -4.957 15.776 5.417
157 HE ARG 22 HE ARG 22 -2.458 16.899 5.313
158 HH11 ARG 22 1HH1 ARG 22 -5.119 16.514 3.102
159 HH12 ARG 22 2HH1 ARG 22 -4.772 17.968 2.226
160 HH21 ARG 22 1HH2 ARG 22 -1.990 18.816 4.168
161 HH22 ARG 22 2HH2 ARG 22 -2.992 19.276 2.833
162 H SER 23 H SER 23 -3.054 10.399 3.209
163 HA SER 23 HA SER 23 -0.272 10.535 2.248
164 HB2 SER 23 1HB SER 23 -1.986 8.074 2.670
165 HB3 SER 23 2HB SER 23 -0.302 8.090 2.149
166 HG SER 23 HG SER 23 -1.398 8.602 4.669
167 H LEU 24 H LEU 24 0.179 10.005 0.105
168 HA LEU 24 HA LEU 24 -1.546 10.892 -1.847
169 HB2 LEU 24 1HB LEU 24 0.591 8.795 -2.184
170 HB3 LEU 24 2HB LEU 24 -0.103 9.788 -3.463
171 HG LEU 24 HG LEU 24 1.505 10.869 -1.151
172 HD11 LEU 24 1HD1 LEU 24 2.382 9.466 -3.459
173 HD12 LEU 24 2HD1 LEU 24 3.349 10.263 -2.218
174 HD13 LEU 24 3HD1 LEU 24 2.825 11.164 -3.641
175 HD21 LEU 24 3HD2 LEU 24 -0.240 12.288 -2.468
176 HD22 LEU 24 1HD2 LEU 24 0.984 12.269 -3.738
177 HD23 LEU 24 2HD2 LEU 24 1.368 12.942 -2.153
178 H CYS 25 H CYS 25 -0.845 7.480 -1.075
179 HA CYS 25 HA CYS 25 -3.481 6.792 -2.203
180 HB2 CYS 25 1HB CYS 25 -2.596 4.715 -3.007
181 HB3 CYS 25 2HB CYS 25 -1.521 5.995 -3.560
182 H ALA 26 H ALA 26 -4.116 4.477 -1.382
183 HA ALA 26 HA ALA 26 -3.542 4.306 1.503
184 HB1 ALA 26 3HB ALA 26 -5.777 4.089 2.070
185 HB2 ALA 26 1HB ALA 26 -5.818 5.326 0.813
186 HB3 ALA 26 2HB ALA 26 -6.259 3.662 0.429
187 H CYS 27 H CYS 27 -2.525 2.451 1.858
188 HA CYS 27 HA CYS 27 -2.946 0.172 0.105
189 HB2 CYS 27 1HB CYS 27 -1.147 0.206 2.517
190 HB3 CYS 27 2HB CYS 27 -1.003 -0.760 1.052
191 H SER 28 H SER 28 -5.225 0.784 1.543
192 HA SER 28 HA SER 28 -5.352 -1.414 3.504
193 HB2 SER 28 1HB SER 28 -7.113 -0.199 4.662
194 HB3 SER 28 2HB SER 28 -5.694 0.837 4.504
195 HG SER 28 HG SER 28 -7.596 0.963 2.474
196 H ASP 29 H ASP 29 -7.789 -2.088 3.785
197 HA ASP 29 HA ASP 29 -8.580 -3.239 1.311
198 HB2 ASP 29 1HB ASP 29 -10.070 -3.100 3.940
199 HB3 ASP 29 2HB ASP 29 -10.489 -4.140 2.583
200 H ASP 30 H ASP 30 -9.819 -0.576 3.273
201 HA ASP 30 HA ASP 30 -12.205 -0.022 2.060
202 HB2 ASP 30 1HB ASP 30 -10.230 2.149 2.763
203 HB3 ASP 30 2HB ASP 30 -11.990 2.219 2.829
204 H CYS 31 H CYS 31 -8.976 0.898 0.930
205 HA CYS 31 HA CYS 31 -9.524 2.557 -1.155
206 HB2 CYS 31 1HB CYS 31 -7.417 2.089 -1.951
207 HB3 CYS 31 2HB CYS 31 -7.278 1.434 -0.323
208 H LYS 32 H LYS 32 -9.781 -0.973 -1.158
209 HA LYS 32 HA LYS 32 -10.258 -1.523 -3.787
210 HB2 LYS 32 1HB LYS 32 -11.604 -2.671 -1.340
211 HB3 LYS 32 2HB LYS 32 -11.808 -3.341 -2.953
212 HG2 LYS 32 1HG LYS 32 -9.157 -3.045 -1.561
213 HG3 LYS 32 2HG LYS 32 -10.123 -4.522 -1.579
214 HD2 LYS 32 1HD LYS 32 -9.993 -4.545 -4.041
215 HD3 LYS 32 2HD LYS 32 -8.975 -3.104 -3.985
216 HE2 LYS 32 1HE LYS 32 -7.436 -4.481 -2.472
217 HE3 LYS 32 2HE LYS 32 -8.355 -5.881 -3.023
218 HZ1 LYS 32 3HZ LYS 32 -7.768 -5.304 -5.306
219 HZ2 LYS 32 1HZ LYS 32 -6.386 -5.566 -4.365
220 HZ3 LYS 32 2HZ LYS 32 -6.857 -3.989 -4.755
221 H ASP 33 H ASP 33 -12.534 -0.167 -1.452
222 HA ASP 33 HA ASP 33 -14.789 -0.220 -3.181
223 HB2 ASP 33 1HB ASP 33 -14.351 1.651 -0.850
224 HB3 ASP 33 2HB ASP 33 -15.889 1.125 -1.528
225 H GLN 34 H GLN 34 -12.888 2.572 -2.025
226 HA GLN 34 HA GLN 34 -13.938 4.312 -4.017
227 HB2 GLN 34 1HB GLN 34 -11.853 4.491 -1.901
228 HB3 GLN 34 2HB GLN 34 -11.789 5.666 -3.207
229 HG2 GLN 34 1HG GLN 34 -14.305 6.011 -2.664
230 HG3 GLN 34 2HG GLN 34 -13.883 5.268 -1.122
231 HE21 GLN 34 1HE2 GLN 34 -12.142 6.272 0.103
232 HE22 GLN 34 2HE2 GLN 34 -11.925 7.982 0.004
233 H GLY 35 H GLY 35 -10.571 3.224 -3.512
234 HA2 GLY 35 1HA GLY 35 -9.425 2.114 -5.383
235 HA3 GLY 35 2HA GLY 35 -10.263 3.230 -6.452
236 H ASP 36 H ASP 36 -8.378 3.640 -3.455
237 HA ASP 36 HA ASP 36 -6.869 5.767 -4.809
238 HB2 ASP 36 1HB ASP 36 -8.173 6.027 -2.523
239 HB3 ASP 36 2HB ASP 36 -6.703 5.321 -1.860
240 H CYS 37 H CYS 37 -6.608 2.597 -3.586
241 HA CYS 37 HA CYS 37 -4.094 2.281 -2.633
242 HB2 CYS 37 1HB CYS 37 -5.833 0.600 -4.362
243 HB3 CYS 37 2HB CYS 37 -4.146 0.119 -4.213
244 H CYS 38 H CYS 38 -2.124 2.810 -3.285
245 HA CYS 38 HA CYS 38 -1.347 4.230 -5.405
246 HB2 CYS 38 1HB CYS 38 0.050 2.132 -3.824
247 HB3 CYS 38 2HB CYS 38 0.843 2.699 -5.290
248 H ILE 39 H ILE 39 -0.465 3.855 -7.486
249 HA ILE 39 HA ILE 39 -1.927 2.186 -9.144
250 HB ILE 39 HB ILE 39 -0.654 4.099 -9.984
251 HG12 ILE 39 1HG1 ILE 39 0.377 1.598 -11.318
252 HG13 ILE 39 2HG1 ILE 39 -1.301 2.111 -11.441
253 HG21 ILE 39 1HG2 ILE 39 1.654 4.235 -10.046
254 HG22 ILE 39 2HG2 ILE 39 1.363 3.466 -8.485
255 HG23 ILE 39 3HG2 ILE 39 1.864 2.493 -9.868
256 HD11 ILE 39 3HD1 ILE 39 -0.758 3.408 -13.140
257 HD12 ILE 39 1HD1 ILE 39 0.307 4.338 -12.086
258 HD13 ILE 39 2HD1 ILE 39 0.936 2.947 -12.970
259 H ASN 40 H ASN 40 1.222 1.629 -7.630
260 HA ASN 40 HA ASN 40 1.293 -1.077 -8.742
261 HB2 ASN 40 1HB ASN 40 3.604 -1.147 -7.873
262 HB3 ASN 40 2HB ASN 40 3.347 0.225 -8.946
263 HD21 ASN 40 1HD2 ASN 40 4.795 -0.669 -6.193
264 HD22 ASN 40 2HD2 ASN 40 4.821 0.840 -5.351
265 H TYR 41 H TYR 41 -0.721 -0.743 -6.920
266 HA TYR 41 HA TYR 41 0.140 -1.527 -4.287
267 HB2 TYR 41 1HB TYR 41 -1.832 -0.196 -4.388
268 HB3 TYR 41 2HB TYR 41 -2.573 -1.257 -5.579
269 HD1 TYR 41 HD2 TYR 41 -3.563 -3.383 -4.909
270 HD2 TYR 41 HD1 TYR 41 -1.826 -0.771 -2.034
271 HE1 TYR 41 HE2 TYR 41 -4.675 -4.635 -3.108
272 HE2 TYR 41 HE1 TYR 41 -2.933 -2.017 -0.226
273 HH TYR 41 HH TYR 41 -4.857 -3.485 0.090
274 H SER 42 H SER 42 -1.449 -3.102 -7.035
275 HA SER 42 HA SER 42 -1.739 -5.627 -5.768
276 HB2 SER 42 1HB SER 42 -2.194 -6.468 -8.058
277 HB3 SER 42 2HB SER 42 -3.129 -5.022 -7.676
278 HG SER 42 HG SER 42 -1.958 -3.873 -9.062
279 H SER 43 H SER 43 0.700 -4.248 -7.926
280 HA SER 43 HA SER 43 2.221 -6.579 -8.301
281 HB2 SER 43 1HB SER 43 2.403 -4.405 -9.598
282 HB3 SER 43 2HB SER 43 3.331 -3.769 -8.240
283 HG SER 43 HG SER 43 4.913 -5.261 -8.624
284 H VAL 44 H VAL 44 2.405 -4.028 -5.856
285 HA VAL 44 HA VAL 44 4.700 -5.143 -4.553
286 HB VAL 44 HB VAL 44 2.715 -3.088 -3.572
287 HG11 VAL 44 1HG1 VAL 44 4.737 -4.503 -2.170
288 HG12 VAL 44 2HG1 VAL 44 5.266 -2.830 -2.355
289 HG13 VAL 44 3HG1 VAL 44 3.714 -3.187 -1.594
290 HG21 VAL 44 3HG2 VAL 44 5.440 -2.270 -4.275
291 HG22 VAL 44 1HG2 VAL 44 4.471 -2.836 -5.635
292 HG23 VAL 44 2HG2 VAL 44 3.895 -1.501 -4.637
293 H CYS 45 H CYS 45 1.247 -4.932 -3.695
294 HA CYS 45 HA CYS 45 1.515 -6.589 -1.392
295 HB2 CYS 45 1HB CYS 45 -0.915 -5.732 -2.974
296 HB3 CYS 45 2HB CYS 45 -0.991 -6.629 -1.460
297 H GLN 46 H GLN 46 -0.338 -7.201 -4.379
298 HA GLN 46 HA GLN 46 -0.310 -10.034 -3.910
299 HB2 GLN 46 1HB GLN 46 -1.276 -8.385 -6.249
300 HB3 GLN 46 2HB GLN 46 -1.461 -10.130 -6.136
301 HG2 GLN 46 1HG GLN 46 -2.634 -9.610 -3.888
302 HG3 GLN 46 2HG GLN 46 -2.792 -7.983 -4.548
303 HE21 GLN 46 1HE2 GLN 46 -4.065 -7.657 -6.389
304 HE22 GLN 46 2HE2 GLN 46 -5.250 -8.810 -6.888
305 H GLY 47 H GLY 47 1.790 -10.770 -3.979
306 HA2 GLY 47 1HA GLY 47 3.418 -10.177 -6.331
307 HA3 GLY 47 2HA GLY 47 3.949 -11.023 -4.884
308 H GLU 48 H GLU 48 4.517 -13.035 -5.339
309 HA GLU 48 HA GLU 48 3.321 -14.419 -7.596
310 HB2 GLU 48 1HB GLU 48 5.811 -14.416 -7.069
311 HB3 GLU 48 2HB GLU 48 5.431 -15.483 -5.725
312 HG2 GLU 48 1HG GLU 48 4.613 -17.170 -7.204
313 HG3 GLU 48 2HG GLU 48 4.741 -16.086 -8.588
314 H LYS 49 H LYS 49 3.984 -15.275 -4.195
315 HA LYS 49 HA LYS 49 1.566 -16.958 -4.253
316 HB2 LYS 49 1HB LYS 49 4.054 -17.263 -2.561
317 HB3 LYS 49 2HB LYS 49 2.627 -18.287 -2.459
318 HG2 LYS 49 1HG LYS 49 2.992 -18.975 -4.798
319 HG3 LYS 49 2HG LYS 49 4.468 -18.009 -4.825
320 HD2 LYS 49 1HD LYS 49 5.593 -19.445 -3.426
321 HD3 LYS 49 2HD LYS 49 4.114 -20.034 -2.666
322 HE2 LYS 49 1HE LYS 49 3.572 -21.339 -4.607
323 HE3 LYS 49 2HE LYS 49 4.913 -20.635 -5.510
324 HZ1 LYS 49 3HZ LYS 49 5.034 -22.963 -4.190
325 HZ2 LYS 49 1HZ LYS 49 5.662 -21.909 -3.026
326 HZ3 LYS 49 2HZ LYS 49 6.381 -22.008 -4.554
327 H SER 50 H SER 50 0.519 -17.230 -2.084
328 HA SER 50 HA SER 50 0.708 -14.765 -0.484
329 HB2 SER 50 1HB SER 50 -1.805 -16.176 -1.405
330 HB3 SER 50 2HB SER 50 -1.780 -14.896 -0.193
331 HG SER 50 HG SER 50 -2.014 -13.689 -1.916
332 H SER 51 H SER 51 2.056 -17.097 0.166
333 HA SER 51 HA SER 51 0.526 -18.679 2.009
334 HB2 SER 51 1HB SER 51 2.778 -19.627 2.616
335 HB3 SER 51 2HB SER 51 2.380 -19.738 0.901
336 HG SER 51 HG SER 51 4.556 -18.924 1.524
337 H GLY 52 H GLY 52 0.201 -18.356 4.121
338 HA2 GLY 52 1HA GLY 52 0.967 -15.878 5.318
339 HA3 GLY 52 2HA GLY 52 0.108 -17.193 6.108
340 HA PRO 53 HA PRO 53 4.257 -16.935 8.089
341 HB2 PRO 53 1HB PRO 53 3.329 -17.409 10.596
342 HB3 PRO 53 2HB PRO 53 3.362 -15.797 9.873
343 HG2 PRO 53 1HG PRO 53 1.078 -17.716 10.119
344 HG3 PRO 53 2HG PRO 53 1.101 -15.965 10.389
345 HD2 PRO 53 1HD PRO 53 0.161 -17.074 8.104
346 HD3 PRO 53 2HD PRO 53 0.960 -15.489 8.139
347 H SER 54 H SER 54 5.055 -18.581 9.909
348 HA SER 54 HA SER 54 4.625 -21.221 8.759
349 HB2 SER 54 1HB SER 54 6.933 -20.383 9.143
350 HB3 SER 54 2HB SER 54 6.606 -20.348 10.876
351 HG SER 54 HG SER 54 6.102 -22.733 9.529
352 H SER 55 H SER 55 3.028 -22.408 9.560
353 HA SER 55 HA SER 55 2.322 -22.141 12.394
354 HB2 SER 55 1HB SER 55 0.657 -22.043 10.326
355 HB3 SER 55 2HB SER 55 0.699 -23.796 10.512
356 HG SER 55 HG SER 55 0.406 -22.821 12.924
357 H GLY 56 H GLY 56 1.554 -24.239 13.440
358 HA2 GLY 56 1HA GLY 56 1.798 -26.698 13.368
359 HA3 GLY 56 2HA GLY 56 3.395 -26.426 12.686
Start of MODEL 13
1 H1 GLY 1 H GLY 1 8.306 20.050 8.087
2 HA2 GLY 1 1HA GLY 1 7.443 22.341 9.139
3 HA3 GLY 1 2HA GLY 1 8.729 22.932 8.097
4 H SER 2 H SER 2 8.557 21.683 5.813
5 HA SER 2 HA SER 2 5.795 22.163 4.910
6 HB2 SER 2 1HB SER 2 8.321 22.338 3.253
7 HB3 SER 2 2HB SER 2 6.697 22.820 2.765
8 HG SER 2 HG SER 2 8.339 24.013 4.743
9 H SER 3 H SER 3 5.252 20.951 2.842
10 HA SER 3 HA SER 3 5.156 18.240 3.293
11 HB2 SER 3 1HB SER 3 3.655 19.155 1.696
12 HB3 SER 3 2HB SER 3 4.971 19.808 0.720
13 HG SER 3 HG SER 3 4.066 17.161 0.954
14 H GLY 4 H GLY 4 6.784 16.858 3.515
15 HA2 GLY 4 1HA GLY 4 9.200 17.236 1.875
16 HA3 GLY 4 2HA GLY 4 9.119 16.325 3.378
17 H SER 5 H SER 5 8.837 14.178 3.288
18 HA SER 5 HA SER 5 9.227 12.729 0.980
19 HB2 SER 5 1HB SER 5 8.379 10.769 2.244
20 HB3 SER 5 2HB SER 5 9.499 11.743 3.194
21 HG SER 5 HG SER 5 7.421 11.037 4.201
22 H SER 6 H SER 6 7.906 11.586 -0.438
23 HA SER 6 HA SER 6 5.225 12.711 -0.741
24 HB2 SER 6 1HB SER 6 7.132 11.309 -2.588
25 HB3 SER 6 2HB SER 6 5.416 11.380 -2.985
26 HG SER 6 HG SER 6 7.077 13.180 -3.597
27 H GLY 7 H GLY 7 6.704 9.483 -1.157
28 HA2 GLY 7 1HA GLY 7 5.958 7.406 -0.496
29 HA3 GLY 7 2HA GLY 7 4.791 8.215 0.538
30 H TRP 8 H TRP 8 5.404 7.507 -2.895
31 HA TRP 8 HA TRP 8 2.506 7.069 -3.204
32 HB2 TRP 8 1HB TRP 8 4.426 8.249 -5.222
33 HB3 TRP 8 2HB TRP 8 2.745 7.841 -5.552
34 HD1 TRP 8 HD1 TRP 8 4.605 10.790 -5.054
35 HE1 TRP 8 HE1 TRP 8 3.250 12.670 -3.934
36 HE3 TRP 8 HE3 TRP 8 0.739 8.008 -3.198
37 HZ2 TRP 8 HZ2 TRP 8 0.858 12.937 -2.458
38 HZ3 TRP 8 HZ3 TRP 8 -1.042 9.152 -1.944
39 HH2 TRP 8 HH2 TRP 8 -0.981 11.566 -1.582
40 H THR 9 H THR 9 4.257 5.039 -2.447
41 HA THR 9 HA THR 9 3.974 3.249 -4.732
42 HB THR 9 HB THR 9 6.271 2.284 -4.265
43 HG1 THR 9 HG1 THR 9 6.296 3.837 -2.260
44 HG21 THR 9 3HG2 THR 9 6.175 5.111 -5.324
45 HG22 THR 9 1HG2 THR 9 5.775 3.662 -6.245
46 HG23 THR 9 2HG2 THR 9 7.422 3.912 -5.666
47 H CYS 10 H CYS 10 2.602 1.818 -3.864
48 HA CYS 10 HA CYS 10 2.337 1.159 -1.176
49 HB2 CYS 10 1HB CYS 10 1.617 -0.329 -3.696
50 HB3 CYS 10 2HB CYS 10 1.257 -0.980 -2.100
51 H ASN 11 H ASN 11 3.269 -0.294 0.166
52 HA ASN 11 HA ASN 11 5.316 -2.087 -0.950
53 HB2 ASN 11 1HB ASN 11 6.094 0.118 0.296
54 HB3 ASN 11 2HB ASN 11 5.770 -0.852 1.730
55 HD21 ASN 11 1HD2 ASN 11 8.213 0.168 0.066
56 HD22 ASN 11 2HD2 ASN 11 9.264 -1.202 0.081
57 H LYS 12 H LYS 12 5.859 -3.907 0.457
58 HA LYS 12 HA LYS 12 3.728 -5.417 1.245
59 HB2 LYS 12 1HB LYS 12 6.184 -6.095 1.011
60 HB3 LYS 12 2HB LYS 12 6.377 -5.567 2.676
61 HG2 LYS 12 1HG LYS 12 6.040 -7.874 2.809
62 HG3 LYS 12 2HG LYS 12 4.480 -7.167 3.237
63 HD2 LYS 12 1HD LYS 12 4.015 -8.950 1.750
64 HD3 LYS 12 2HD LYS 12 3.821 -7.465 0.816
65 HE2 LYS 12 1HE LYS 12 5.032 -9.122 -0.478
66 HE3 LYS 12 2HE LYS 12 6.083 -7.760 -0.094
67 HZ1 LYS 12 3HZ LYS 12 6.490 -10.467 0.469
68 HZ2 LYS 12 1HZ LYS 12 6.317 -9.662 1.947
69 HZ3 LYS 12 2HZ LYS 12 7.496 -9.160 0.843
70 H PHE 13 H PHE 13 5.804 -3.533 3.452
71 HA PHE 13 HA PHE 13 4.357 -4.020 5.785
72 HB2 PHE 13 1HB PHE 13 6.662 -2.892 5.470
73 HB3 PHE 13 2HB PHE 13 5.745 -1.402 5.272
74 HD1 PHE 13 HD1 PHE 13 5.924 -4.311 7.602
75 HD2 PHE 13 HD2 PHE 13 5.420 -0.111 7.137
76 HE1 PHE 13 HE1 PHE 13 5.825 -4.056 10.047
77 HE2 PHE 13 HE2 PHE 13 5.321 0.151 9.581
78 HZ PHE 13 HZ PHE 13 5.525 -1.823 11.040
79 H ARG 14 H ARG 14 4.133 -1.261 3.547
80 HA ARG 14 HA ARG 14 2.208 0.240 4.783
81 HB2 ARG 14 1HB ARG 14 2.355 -0.300 1.811
82 HB3 ARG 14 2HB ARG 14 1.596 1.087 2.580
83 HG2 ARG 14 1HG ARG 14 4.495 0.521 3.026
84 HG3 ARG 14 2HG ARG 14 3.955 1.329 1.553
85 HD2 ARG 14 1HD ARG 14 2.623 2.802 3.319
86 HD3 ARG 14 2HD ARG 14 3.942 2.278 4.365
87 HE ARG 14 HE ARG 14 4.745 3.370 1.808
88 HH11 ARG 14 1HH1 ARG 14 4.103 3.989 5.174
89 HH12 ARG 14 2HH1 ARG 14 5.058 5.434 5.225
90 HH21 ARG 14 1HH2 ARG 14 6.005 5.271 1.862
91 HH22 ARG 14 2HH2 ARG 14 6.138 6.163 3.341
92 H CYS 15 H CYS 15 1.635 -2.446 2.516
93 HA CYS 15 HA CYS 15 -0.993 -2.564 2.187
94 HB2 CYS 15 1HB CYS 15 0.482 -4.982 3.237
95 HB3 CYS 15 2HB CYS 15 -0.903 -4.960 2.150
96 H GLY 16 H GLY 16 -2.255 -1.563 3.729
97 HA2 GLY 16 1HA GLY 16 -3.902 -2.207 5.399
98 HA3 GLY 16 2HA GLY 16 -2.635 -3.113 6.212
99 H GLU 17 H GLU 17 -2.824 0.225 4.976
100 HA GLU 17 HA GLU 17 -1.650 1.171 7.467
101 HB2 GLU 17 1HB GLU 17 -1.443 3.325 6.310
102 HB3 GLU 17 2HB GLU 17 -0.730 2.021 5.372
103 HG2 GLU 17 1HG GLU 17 -2.734 1.939 3.971
104 HG3 GLU 17 2HG GLU 17 -3.432 3.262 4.904
105 H LYS 18 H LYS 18 -2.590 3.526 8.020
106 HA LYS 18 HA LYS 18 -5.214 3.034 9.039
107 HB2 LYS 18 1HB LYS 18 -5.026 5.289 10.001
108 HB3 LYS 18 2HB LYS 18 -3.595 4.321 10.329
109 HG2 LYS 18 1HG LYS 18 -2.253 5.594 8.994
110 HG3 LYS 18 2HG LYS 18 -3.580 6.078 7.935
111 HD2 LYS 18 1HD LYS 18 -2.964 8.012 9.156
112 HD3 LYS 18 2HD LYS 18 -4.469 7.432 9.875
113 HE2 LYS 18 1HE LYS 18 -2.940 6.173 11.521
114 HE3 LYS 18 2HE LYS 18 -1.672 7.254 10.945
115 HZ1 LYS 18 3HZ LYS 18 -2.570 8.294 12.818
116 HZ2 LYS 18 1HZ LYS 18 -4.167 7.955 12.371
117 HZ3 LYS 18 2HZ LYS 18 -3.276 9.111 11.516
118 H ARG 19 H ARG 19 -6.861 4.937 8.851
119 HA ARG 19 HA ARG 19 -7.802 4.969 6.200
120 HB2 ARG 19 1HB ARG 19 -9.568 6.373 6.994
121 HB3 ARG 19 2HB ARG 19 -9.203 5.216 8.267
122 HG2 ARG 19 1HG ARG 19 -7.943 6.897 9.475
123 HG3 ARG 19 2HG ARG 19 -8.221 8.061 8.177
124 HD2 ARG 19 1HD ARG 19 -10.550 8.130 8.621
125 HD3 ARG 19 2HD ARG 19 -10.455 6.732 9.691
126 HE ARG 19 HE ARG 19 -9.700 8.104 11.386
127 HH11 ARG 19 1HH1 ARG 19 -9.775 9.847 8.374
128 HH12 ARG 19 2HH1 ARG 19 -9.528 11.395 9.112
129 HH21 ARG 19 1HH2 ARG 19 -9.374 10.136 12.371
130 HH22 ARG 19 2HH2 ARG 19 -9.298 11.557 11.386
131 H LEU 20 H LEU 20 -8.404 7.078 5.066
132 HA LEU 20 HA LEU 20 -6.373 9.157 5.360
133 HB2 LEU 20 1HB LEU 20 -5.625 9.068 3.145
134 HB3 LEU 20 2HB LEU 20 -5.621 7.395 3.698
135 HG LEU 20 HG LEU 20 -7.783 8.621 1.989
136 HD11 LEU 20 1HD1 LEU 20 -6.671 6.979 0.296
137 HD12 LEU 20 2HD1 LEU 20 -5.245 7.211 1.306
138 HD13 LEU 20 3HD1 LEU 20 -6.009 8.597 0.527
139 HD21 LEU 20 3HD2 LEU 20 -7.420 6.042 3.335
140 HD22 LEU 20 1HD2 LEU 20 -7.859 5.927 1.630
141 HD23 LEU 20 2HD2 LEU 20 -8.889 6.822 2.748
142 H THR 21 H THR 21 -6.896 11.128 4.209
143 HA THR 21 HA THR 21 -9.800 11.424 3.834
144 HB THR 21 HB THR 21 -9.418 13.852 4.258
145 HG1 THR 21 HG1 THR 21 -6.811 13.014 5.049
146 HG21 THR 21 3HG2 THR 21 -9.401 11.708 6.111
147 HG22 THR 21 1HG2 THR 21 -9.980 13.355 6.354
148 HG23 THR 21 2HG2 THR 21 -8.304 12.946 6.720
149 H ARG 22 H ARG 22 -6.748 12.840 2.639
150 HA ARG 22 HA ARG 22 -7.818 12.737 -0.078
151 HB2 ARG 22 1HB ARG 22 -7.092 15.207 1.427
152 HB3 ARG 22 2HB ARG 22 -6.691 15.132 -0.283
153 HG2 ARG 22 1HG ARG 22 -9.455 14.575 0.749
154 HG3 ARG 22 2HG ARG 22 -8.902 16.197 0.328
155 HD2 ARG 22 1HD ARG 22 -8.378 15.406 -1.942
156 HD3 ARG 22 2HD ARG 22 -8.981 13.807 -1.511
157 HE ARG 22 HE ARG 22 -11.101 15.334 -0.971
158 HH11 ARG 22 1HH1 ARG 22 -8.988 15.245 -3.736
159 HH12 ARG 22 2HH1 ARG 22 -10.212 15.753 -4.852
160 HH21 ARG 22 1HH2 ARG 22 -12.722 16.004 -2.430
161 HH22 ARG 22 2HH2 ARG 22 -12.335 16.185 -4.108
162 H SER 23 H SER 23 -6.370 11.579 -1.156
163 HA SER 23 HA SER 23 -3.599 12.394 -1.193
164 HB2 SER 23 1HB SER 23 -2.613 10.471 -0.326
165 HB3 SER 23 2HB SER 23 -3.997 10.684 0.746
166 HG SER 23 HG SER 23 -3.977 8.562 0.093
167 H LEU 24 H LEU 24 -2.347 11.188 -2.835
168 HA LEU 24 HA LEU 24 -3.786 10.984 -5.251
169 HB2 LEU 24 1HB LEU 24 -1.024 9.956 -4.611
170 HB3 LEU 24 2HB LEU 24 -1.687 10.216 -6.223
171 HG LEU 24 HG LEU 24 -1.210 12.405 -4.205
172 HD11 LEU 24 1HD1 LEU 24 0.749 10.999 -5.453
173 HD12 LEU 24 2HD1 LEU 24 0.882 12.686 -4.959
174 HD13 LEU 24 3HD1 LEU 24 0.447 12.286 -6.620
175 HD21 LEU 24 3HD2 LEU 24 -1.850 13.909 -5.825
176 HD22 LEU 24 1HD2 LEU 24 -2.961 12.575 -6.137
177 HD23 LEU 24 2HD2 LEU 24 -1.531 12.787 -7.148
178 H CYS 25 H CYS 25 -2.461 8.539 -3.059
179 HA CYS 25 HA CYS 25 -4.308 6.585 -4.192
180 HB2 CYS 25 1HB CYS 25 -2.680 4.933 -4.632
181 HB3 CYS 25 2HB CYS 25 -2.032 6.409 -5.339
182 H ALA 26 H ALA 26 -4.550 4.668 -2.831
183 HA ALA 26 HA ALA 26 -3.731 5.120 -0.039
184 HB1 ALA 26 3HB ALA 26 -5.827 5.144 0.727
185 HB2 ALA 26 1HB ALA 26 -6.302 5.453 -0.942
186 HB3 ALA 26 2HB ALA 26 -6.317 3.806 -0.311
187 H CYS 27 H CYS 27 -2.471 3.494 0.565
188 HA CYS 27 HA CYS 27 -2.749 0.882 -0.703
189 HB2 CYS 27 1HB CYS 27 -0.657 1.913 1.226
190 HB3 CYS 27 2HB CYS 27 -0.615 0.354 0.407
191 H SER 28 H SER 28 -4.897 1.464 0.903
192 HA SER 28 HA SER 28 -4.440 -0.243 3.263
193 HB2 SER 28 1HB SER 28 -6.352 0.928 4.317
194 HB3 SER 28 2HB SER 28 -5.035 2.032 3.923
195 HG SER 28 HG SER 28 -6.452 2.121 1.815
196 H ASP 29 H ASP 29 -6.742 -1.113 4.018
197 HA ASP 29 HA ASP 29 -7.557 -2.938 1.998
198 HB2 ASP 29 1HB ASP 29 -8.592 -2.323 4.762
199 HB3 ASP 29 2HB ASP 29 -9.354 -3.527 3.726
200 H ASP 30 H ASP 30 -8.916 0.030 3.302
201 HA ASP 30 HA ASP 30 -11.329 -0.233 1.706
202 HB2 ASP 30 1HB ASP 30 -12.193 1.542 2.921
203 HB3 ASP 30 2HB ASP 30 -11.097 0.813 4.092
204 H CYS 31 H CYS 31 -8.884 -0.128 0.247
205 HA CYS 31 HA CYS 31 -8.910 2.546 -0.956
206 HB2 CYS 31 1HB CYS 31 -6.769 2.130 -1.766
207 HB3 CYS 31 2HB CYS 31 -6.759 1.270 -0.230
208 H LYS 32 H LYS 32 -9.469 -0.846 -1.683
209 HA LYS 32 HA LYS 32 -9.794 -0.552 -4.482
210 HB2 LYS 32 1HB LYS 32 -10.727 -2.644 -2.521
211 HB3 LYS 32 2HB LYS 32 -11.062 -2.755 -4.244
212 HG2 LYS 32 1HG LYS 32 -8.888 -3.195 -4.783
213 HG3 LYS 32 2HG LYS 32 -8.250 -2.333 -3.381
214 HD2 LYS 32 1HD LYS 32 -9.091 -4.151 -1.929
215 HD3 LYS 32 2HD LYS 32 -9.621 -5.022 -3.370
216 HE2 LYS 32 1HE LYS 32 -6.792 -4.118 -3.237
217 HE3 LYS 32 2HE LYS 32 -7.272 -5.486 -2.234
218 HZ1 LYS 32 3HZ LYS 32 -8.117 -5.551 -5.020
219 HZ2 LYS 32 1HZ LYS 32 -7.578 -6.806 -4.021
220 HZ3 LYS 32 2HZ LYS 32 -6.462 -5.754 -4.733
221 H ASP 33 H ASP 33 -12.246 -1.012 -1.928
222 HA ASP 33 HA ASP 33 -14.537 -0.722 -3.363
223 HB2 ASP 33 1HB ASP 33 -14.103 0.609 -0.686
224 HB3 ASP 33 2HB ASP 33 -15.625 0.027 -1.353
225 H GLN 34 H GLN 34 -12.423 1.875 -2.235
226 HA GLN 34 HA GLN 34 -14.130 3.933 -3.322
227 HB2 GLN 34 1HB GLN 34 -11.584 3.848 -1.788
228 HB3 GLN 34 2HB GLN 34 -11.885 5.274 -2.773
229 HG2 GLN 34 1HG GLN 34 -14.230 5.169 -1.555
230 HG3 GLN 34 2HG GLN 34 -13.278 4.315 -0.341
231 HE21 GLN 34 1HE2 GLN 34 -13.853 7.332 -1.936
232 HE22 GLN 34 2HE2 GLN 34 -12.895 8.311 -0.884
233 H GLY 35 H GLY 35 -10.700 3.128 -3.919
234 HA2 GLY 35 1HA GLY 35 -10.145 2.528 -6.282
235 HA3 GLY 35 2HA GLY 35 -11.145 3.901 -6.738
236 H ASP 36 H ASP 36 -8.574 3.432 -4.313
237 HA ASP 36 HA ASP 36 -7.136 5.680 -5.563
238 HB2 ASP 36 1HB ASP 36 -7.677 5.115 -2.661
239 HB3 ASP 36 2HB ASP 36 -6.276 6.068 -3.145
240 H CYS 37 H CYS 37 -7.051 2.475 -4.392
241 HA CYS 37 HA CYS 37 -4.609 1.855 -3.537
242 HB2 CYS 37 1HB CYS 37 -5.694 0.376 -5.928
243 HB3 CYS 37 2HB CYS 37 -4.781 -0.269 -4.568
244 H CYS 38 H CYS 38 -2.652 2.570 -4.031
245 HA CYS 38 HA CYS 38 -1.865 4.013 -6.208
246 HB2 CYS 38 1HB CYS 38 0.027 2.047 -4.941
247 HB3 CYS 38 2HB CYS 38 0.362 3.670 -5.536
248 H ILE 39 H ILE 39 -0.878 3.599 -8.182
249 HA ILE 39 HA ILE 39 -1.838 1.649 -9.804
250 HB ILE 39 HB ILE 39 -0.533 3.546 -10.637
251 HG12 ILE 39 1HG1 ILE 39 0.930 1.113 -11.599
252 HG13 ILE 39 2HG1 ILE 39 -0.806 1.239 -11.856
253 HG21 ILE 39 1HG2 ILE 39 1.738 3.822 -10.345
254 HG22 ILE 39 2HG2 ILE 39 1.257 3.147 -8.789
255 HG23 ILE 39 3HG2 ILE 39 2.010 2.114 -10.003
256 HD11 ILE 39 3HD1 ILE 39 -0.598 2.916 -13.374
257 HD12 ILE 39 1HD1 ILE 39 0.887 3.537 -12.653
258 HD13 ILE 39 2HD1 ILE 39 0.930 2.079 -13.645
259 H ASN 40 H ASN 40 1.157 1.454 -7.904
260 HA ASN 40 HA ASN 40 1.454 -1.357 -8.642
261 HB2 ASN 40 1HB ASN 40 3.639 -1.189 -7.473
262 HB3 ASN 40 2HB ASN 40 3.468 -0.010 -8.771
263 HD21 ASN 40 1HD2 ASN 40 4.333 -0.464 -5.601
264 HD22 ASN 40 2HD2 ASN 40 4.292 1.179 -5.067
265 H TYR 41 H TYR 41 -0.751 -0.623 -6.980
266 HA TYR 41 HA TYR 41 -0.190 -1.141 -4.243
267 HB2 TYR 41 1HB TYR 41 -2.193 0.058 -4.806
268 HB3 TYR 41 2HB TYR 41 -2.757 -1.254 -5.834
269 HD1 TYR 41 HD2 TYR 41 -3.275 -3.499 -4.700
270 HD2 TYR 41 HD1 TYR 41 -2.820 0.147 -2.556
271 HE1 TYR 41 HE2 TYR 41 -4.497 -4.471 -2.799
272 HE2 TYR 41 HE1 TYR 41 -4.039 -0.814 -0.649
273 HH TYR 41 HH TYR 41 -5.428 -4.071 -0.810
274 H SER 42 H SER 42 -1.890 -3.148 -6.659
275 HA SER 42 HA SER 42 -1.753 -5.494 -5.050
276 HB2 SER 42 1HB SER 42 -3.531 -5.620 -6.514
277 HB3 SER 42 2HB SER 42 -2.638 -4.857 -7.830
278 HG SER 42 HG SER 42 -2.842 -7.510 -7.143
279 H SER 43 H SER 43 0.163 -4.205 -7.707
280 HA SER 43 HA SER 43 1.693 -6.435 -8.335
281 HB2 SER 43 1HB SER 43 1.785 -4.404 -9.673
282 HB3 SER 43 2HB SER 43 2.501 -3.517 -8.330
283 HG SER 43 HG SER 43 4.102 -4.189 -9.786
284 H VAL 44 H VAL 44 1.977 -4.183 -5.665
285 HA VAL 44 HA VAL 44 4.437 -5.473 -4.748
286 HB VAL 44 HB VAL 44 2.971 -3.058 -3.679
287 HG11 VAL 44 1HG1 VAL 44 5.018 -4.731 -2.502
288 HG12 VAL 44 2HG1 VAL 44 5.560 -3.061 -2.683
289 HG13 VAL 44 3HG1 VAL 44 4.084 -3.418 -1.785
290 HG21 VAL 44 3HG2 VAL 44 5.071 -1.901 -4.495
291 HG22 VAL 44 1HG2 VAL 44 5.439 -3.389 -5.366
292 HG23 VAL 44 2HG2 VAL 44 3.972 -2.486 -5.744
293 H CYS 45 H CYS 45 1.218 -4.634 -3.466
294 HA CYS 45 HA CYS 45 1.527 -6.230 -1.121
295 HB2 CYS 45 1HB CYS 45 -0.865 -4.919 -2.412
296 HB3 CYS 45 2HB CYS 45 -0.980 -5.847 -0.921
297 H GLN 46 H GLN 46 -0.913 -6.592 -3.692
298 HA GLN 46 HA GLN 46 -1.182 -9.400 -3.112
299 HB2 GLN 46 1HB GLN 46 -2.448 -7.602 -5.178
300 HB3 GLN 46 2HB GLN 46 -2.797 -9.322 -5.061
301 HG2 GLN 46 1HG GLN 46 -3.474 -8.895 -2.670
302 HG3 GLN 46 2HG GLN 46 -3.383 -7.175 -3.047
303 HE21 GLN 46 1HE2 GLN 46 -5.258 -9.992 -3.189
304 HE22 GLN 46 2HE2 GLN 46 -6.588 -9.354 -4.088
305 H GLY 47 H GLY 47 1.011 -10.049 -3.588
306 HA2 GLY 47 1HA GLY 47 2.260 -9.743 -6.076
307 HA3 GLY 47 2HA GLY 47 2.595 -11.030 -4.927
308 H GLU 48 H GLU 48 2.822 -12.651 -6.434
309 HA GLU 48 HA GLU 48 0.474 -13.241 -8.105
310 HB2 GLU 48 1HB GLU 48 2.818 -12.951 -9.122
311 HB3 GLU 48 2HB GLU 48 3.186 -14.512 -8.402
312 HG2 GLU 48 1HG GLU 48 2.522 -14.634 -10.781
313 HG3 GLU 48 2HG GLU 48 1.501 -15.589 -9.706
314 H LYS 49 H LYS 49 -0.836 -14.778 -7.404
315 HA LYS 49 HA LYS 49 0.291 -16.956 -5.768
316 HB2 LYS 49 1HB LYS 49 -1.813 -17.078 -4.566
317 HB3 LYS 49 2HB LYS 49 -1.167 -15.446 -4.466
318 HG2 LYS 49 1HG LYS 49 -2.838 -14.553 -5.723
319 HG3 LYS 49 2HG LYS 49 -3.085 -16.035 -6.650
320 HD2 LYS 49 1HD LYS 49 -3.718 -16.116 -3.752
321 HD3 LYS 49 2HD LYS 49 -4.808 -15.200 -4.795
322 HE2 LYS 49 1HE LYS 49 -5.695 -17.380 -4.717
323 HE3 LYS 49 2HE LYS 49 -4.885 -17.257 -6.278
324 HZ1 LYS 49 3HZ LYS 49 -4.358 -19.345 -5.235
325 HZ2 LYS 49 1HZ LYS 49 -3.806 -18.564 -3.840
326 HZ3 LYS 49 2HZ LYS 49 -2.964 -18.389 -5.296
327 H SER 50 H SER 50 0.243 -17.123 -8.540
328 HA SER 50 HA SER 50 -1.831 -18.096 -9.929
329 HB2 SER 50 1HB SER 50 0.602 -18.021 -10.652
330 HB3 SER 50 2HB SER 50 0.795 -19.591 -9.872
331 HG SER 50 HG SER 50 -1.274 -19.938 -11.331
332 H SER 51 H SER 51 0.068 -20.044 -7.635
333 HA SER 51 HA SER 51 -1.954 -22.155 -7.777
334 HB2 SER 51 1HB SER 51 -0.345 -23.567 -6.647
335 HB3 SER 51 2HB SER 51 0.467 -22.748 -7.982
336 HG SER 51 HG SER 51 0.910 -22.569 -5.287
337 H GLY 52 H GLY 52 -3.281 -22.673 -6.118
338 HA2 GLY 52 1HA GLY 52 -3.782 -20.765 -4.096
339 HA3 GLY 52 2HA GLY 52 -4.480 -22.375 -4.183
340 HA PRO 53 HA PRO 53 -2.123 -23.649 -0.720
341 HB2 PRO 53 1HB PRO 53 -1.562 -26.236 -1.327
342 HB3 PRO 53 2HB PRO 53 -3.179 -25.684 -0.874
343 HG2 PRO 53 1HG PRO 53 -2.052 -26.210 -3.597
344 HG3 PRO 53 2HG PRO 53 -3.643 -26.641 -2.942
345 HD2 PRO 53 1HD PRO 53 -3.264 -24.505 -4.562
346 HD3 PRO 53 2HD PRO 53 -4.495 -24.527 -3.284
347 H SER 54 H SER 54 -0.306 -22.241 -1.159
348 HA SER 54 HA SER 54 1.900 -23.201 -2.732
349 HB2 SER 54 1HB SER 54 1.480 -20.810 -0.951
350 HB3 SER 54 2HB SER 54 3.067 -21.185 -1.621
351 HG SER 54 HG SER 54 2.322 -20.822 -3.633
352 H SER 55 H SER 55 1.387 -22.609 0.744
353 HA SER 55 HA SER 55 3.782 -23.442 1.760
354 HB2 SER 55 1HB SER 55 1.882 -22.545 3.101
355 HB3 SER 55 2HB SER 55 1.084 -24.111 2.960
356 HG SER 55 HG SER 55 3.427 -23.428 4.363
357 H GLY 56 H GLY 56 1.006 -25.512 0.950
358 HA2 GLY 56 1HA GLY 56 1.896 -27.960 1.789
359 HA3 GLY 56 2HA GLY 56 0.944 -27.729 0.330
Start of MODEL 14
1 H1 GLY 1 H GLY 1 13.531 3.163 14.544
2 HA2 GLY 1 1HA GLY 1 14.950 4.239 12.838
3 HA3 GLY 1 2HA GLY 1 15.409 2.556 13.044
4 H SER 2 H SER 2 15.865 1.699 11.134
5 HA SER 2 HA SER 2 14.280 2.514 8.800
6 HB2 SER 2 1HB SER 2 16.124 1.657 7.442
7 HB3 SER 2 2HB SER 2 16.733 2.805 8.634
8 HG SER 2 HG SER 2 16.962 0.649 9.903
9 H SER 3 H SER 3 12.495 1.206 8.952
10 HA SER 3 HA SER 3 12.953 -1.697 9.031
11 HB2 SER 3 1HB SER 3 11.321 -0.391 10.641
12 HB3 SER 3 2HB SER 3 10.222 -0.493 9.266
13 HG SER 3 HG SER 3 11.184 -2.496 10.931
14 H GLY 4 H GLY 4 10.653 0.566 7.494
15 HA2 GLY 4 1HA GLY 4 10.838 -1.100 5.058
16 HA3 GLY 4 2HA GLY 4 9.343 -0.349 5.594
17 H SER 5 H SER 5 9.414 0.473 3.336
18 HA SER 5 HA SER 5 10.942 2.988 3.241
19 HB2 SER 5 1HB SER 5 10.402 1.091 0.945
20 HB3 SER 5 2HB SER 5 11.115 2.695 0.774
21 HG SER 5 HG SER 5 12.208 0.356 1.833
22 H SER 6 H SER 6 9.366 4.416 3.729
23 HA SER 6 HA SER 6 6.728 4.166 2.538
24 HB2 SER 6 1HB SER 6 7.305 4.934 4.971
25 HB3 SER 6 2HB SER 6 7.592 6.502 4.215
26 HG SER 6 HG SER 6 5.358 5.886 5.029
27 H GLY 7 H GLY 7 6.084 5.192 0.759
28 HA2 GLY 7 1HA GLY 7 6.692 7.784 -0.008
29 HA3 GLY 7 2HA GLY 7 7.898 6.759 -0.772
30 H TRP 8 H TRP 8 4.378 7.047 -0.349
31 HA TRP 8 HA TRP 8 2.651 6.359 -1.691
32 HB2 TRP 8 1HB TRP 8 4.512 7.692 -3.666
33 HB3 TRP 8 2HB TRP 8 2.841 7.268 -4.025
34 HD1 TRP 8 HD1 TRP 8 4.629 10.216 -3.305
35 HE1 TRP 8 HE1 TRP 8 3.232 11.970 -2.041
36 HE3 TRP 8 HE3 TRP 8 0.841 7.203 -1.660
37 HZ2 TRP 8 HZ2 TRP 8 0.840 12.063 -0.544
38 HZ3 TRP 8 HZ3 TRP 8 -0.963 8.203 -0.317
39 HH2 TRP 8 HH2 TRP 8 -0.961 10.583 0.228
40 H THR 9 H THR 9 4.480 4.267 -1.203
41 HA THR 9 HA THR 9 4.036 2.670 -3.617
42 HB THR 9 HB THR 9 6.275 1.606 -3.361
43 HG1 THR 9 HG1 THR 9 6.916 3.841 -1.724
44 HG21 THR 9 3HG2 THR 9 7.555 3.778 -4.099
45 HG22 THR 9 1HG2 THR 9 5.938 4.480 -4.090
46 HG23 THR 9 2HG2 THR 9 6.291 3.093 -5.120
47 H CYS 10 H CYS 10 2.616 1.220 -2.868
48 HA CYS 10 HA CYS 10 2.261 0.352 -0.275
49 HB2 CYS 10 1HB CYS 10 1.619 -0.843 -2.943
50 HB3 CYS 10 2HB CYS 10 1.353 -1.798 -1.488
51 H ASN 11 H ASN 11 2.841 -1.556 0.848
52 HA ASN 11 HA ASN 11 5.155 -3.023 -0.200
53 HB2 ASN 11 1HB ASN 11 5.003 -1.817 2.573
54 HB3 ASN 11 2HB ASN 11 6.296 -2.852 1.974
55 HD21 ASN 11 1HD2 ASN 11 5.741 0.164 2.744
56 HD22 ASN 11 2HD2 ASN 11 6.690 1.004 1.569
57 H LYS 12 H LYS 12 5.260 -5.153 0.384
58 HA LYS 12 HA LYS 12 3.126 -6.690 0.809
59 HB2 LYS 12 1HB LYS 12 4.625 -8.337 1.994
60 HB3 LYS 12 2HB LYS 12 5.232 -7.740 0.455
61 HG2 LYS 12 1HG LYS 12 6.411 -5.970 2.039
62 HG3 LYS 12 2HG LYS 12 6.240 -7.284 3.203
63 HD2 LYS 12 1HD LYS 12 7.600 -8.714 1.980
64 HD3 LYS 12 2HD LYS 12 7.356 -7.820 0.478
65 HE2 LYS 12 1HE LYS 12 9.475 -7.141 0.999
66 HE3 LYS 12 2HE LYS 12 8.546 -5.897 1.834
67 HZ1 LYS 12 3HZ LYS 12 10.415 -7.596 2.938
68 HZ2 LYS 12 1HZ LYS 12 8.922 -8.158 3.503
69 HZ3 LYS 12 2HZ LYS 12 9.375 -6.550 3.767
70 H PHE 13 H PHE 13 5.019 -5.253 3.452
71 HA PHE 13 HA PHE 13 3.457 -6.287 5.553
72 HB2 PHE 13 1HB PHE 13 5.469 -4.112 5.269
73 HB3 PHE 13 2HB PHE 13 4.441 -4.083 6.698
74 HD1 PHE 13 HD2 PHE 13 4.189 -6.569 7.774
75 HD2 PHE 13 HD1 PHE 13 7.504 -5.108 5.541
76 HE1 PHE 13 HE2 PHE 13 5.644 -8.232 8.854
77 HE2 PHE 13 HE1 PHE 13 8.966 -6.770 6.616
78 HZ PHE 13 HZ PHE 13 8.037 -8.334 8.278
79 H ARG 14 H ARG 14 3.474 -3.007 4.150
80 HA ARG 14 HA ARG 14 1.433 -1.854 5.538
81 HB2 ARG 14 1HB ARG 14 2.232 -1.584 2.650
82 HB3 ARG 14 2HB ARG 14 0.917 -0.632 3.326
83 HG2 ARG 14 1HG ARG 14 2.391 0.414 4.893
84 HG3 ARG 14 2HG ARG 14 3.714 -0.659 4.433
85 HD2 ARG 14 1HD ARG 14 4.195 1.293 3.272
86 HD3 ARG 14 2HD ARG 14 3.372 0.305 2.065
87 HE ARG 14 HE ARG 14 1.630 1.803 2.062
88 HH11 ARG 14 1HH1 ARG 14 3.725 2.449 4.767
89 HH12 ARG 14 2HH1 ARG 14 2.959 3.951 5.169
90 HH21 ARG 14 1HH2 ARG 14 0.615 3.779 2.581
91 HH22 ARG 14 2HH2 ARG 14 1.190 4.705 3.925
92 H CYS 15 H CYS 15 1.099 -3.885 2.640
93 HA CYS 15 HA CYS 15 -1.489 -3.807 2.011
94 HB2 CYS 15 1HB CYS 15 -0.232 -6.491 2.553
95 HB3 CYS 15 2HB CYS 15 -1.384 -6.061 1.293
96 H GLY 16 H GLY 16 -3.135 -3.428 3.368
97 HA2 GLY 16 1HA GLY 16 -4.865 -4.417 4.698
98 HA3 GLY 16 2HA GLY 16 -3.651 -5.444 5.446
99 H GLU 17 H GLU 17 -3.830 -1.921 4.959
100 HA GLU 17 HA GLU 17 -3.344 -1.607 7.843
101 HB2 GLU 17 1HB GLU 17 -2.440 0.601 7.310
102 HB3 GLU 17 2HB GLU 17 -1.603 -0.655 6.406
103 HG2 GLU 17 1HG GLU 17 -2.927 -0.117 4.427
104 HG3 GLU 17 2HG GLU 17 -3.767 1.140 5.332
105 H LYS 18 H LYS 18 -4.174 0.685 8.584
106 HA LYS 18 HA LYS 18 -6.986 0.569 8.570
107 HB2 LYS 18 1HB LYS 18 -4.966 2.548 9.548
108 HB3 LYS 18 2HB LYS 18 -6.665 3.001 9.519
109 HG2 LYS 18 1HG LYS 18 -7.245 1.455 11.127
110 HG3 LYS 18 2HG LYS 18 -5.834 0.442 10.811
111 HD2 LYS 18 1HD LYS 18 -5.442 1.505 12.892
112 HD3 LYS 18 2HD LYS 18 -4.427 2.337 11.712
113 HE2 LYS 18 1HE LYS 18 -7.162 3.388 12.245
114 HE3 LYS 18 2HE LYS 18 -5.901 3.673 13.442
115 HZ1 LYS 18 3HZ LYS 18 -5.531 4.325 10.579
116 HZ2 LYS 18 1HZ LYS 18 -4.619 4.859 11.900
117 HZ3 LYS 18 2HZ LYS 18 -6.195 5.429 11.676
118 H ARG 19 H ARG 19 -8.291 2.668 8.076
119 HA ARG 19 HA ARG 19 -8.091 3.088 5.244
120 HB2 ARG 19 1HB ARG 19 -10.166 4.243 5.422
121 HB3 ARG 19 2HB ARG 19 -10.249 2.880 6.530
122 HG2 ARG 19 1HG ARG 19 -9.851 4.315 8.415
123 HG3 ARG 19 2HG ARG 19 -9.577 5.696 7.350
124 HD2 ARG 19 1HD ARG 19 -11.757 6.068 7.929
125 HD3 ARG 19 2HD ARG 19 -11.987 5.077 6.487
126 HE ARG 19 HE ARG 19 -11.929 3.257 8.488
127 HH11 ARG 19 1HH1 ARG 19 -13.745 6.180 7.958
128 HH12 ARG 19 2HH1 ARG 19 -15.132 5.632 8.839
129 HH21 ARG 19 1HH2 ARG 19 -13.751 2.525 9.650
130 HH22 ARG 19 2HH2 ARG 19 -15.135 3.554 9.801
131 H LEU 20 H LEU 20 -7.734 5.039 4.159
132 HA LEU 20 HA LEU 20 -6.291 7.060 5.741
133 HB2 LEU 20 1HB LEU 20 -5.935 6.052 2.945
134 HB3 LEU 20 2HB LEU 20 -5.337 7.643 3.409
135 HG LEU 20 HG LEU 20 -3.549 6.013 3.481
136 HD11 LEU 20 1HD1 LEU 20 -4.380 6.753 6.281
137 HD12 LEU 20 2HD1 LEU 20 -3.607 7.852 5.140
138 HD13 LEU 20 3HD1 LEU 20 -2.745 6.422 5.708
139 HD21 LEU 20 3HD2 LEU 20 -4.752 3.978 3.823
140 HD22 LEU 20 1HD2 LEU 20 -5.358 4.534 5.383
141 HD23 LEU 20 2HD2 LEU 20 -3.642 4.183 5.179
142 H THR 21 H THR 21 -7.368 8.886 6.025
143 HA THR 21 HA THR 21 -9.743 9.556 4.666
144 HB THR 21 HB THR 21 -7.958 11.456 6.196
145 HG1 THR 21 HG1 THR 21 -8.828 9.338 7.202
146 HG21 THR 21 3HG2 THR 21 -10.292 12.424 6.732
147 HG22 THR 21 1HG2 THR 21 -10.831 11.505 5.328
148 HG23 THR 21 2HG2 THR 21 -9.594 12.749 5.146
149 H ARG 22 H ARG 22 -6.548 11.148 4.535
150 HA ARG 22 HA ARG 22 -7.154 11.921 1.760
151 HB2 ARG 22 1HB ARG 22 -7.415 13.844 3.334
152 HB3 ARG 22 2HB ARG 22 -5.721 13.662 3.772
153 HG2 ARG 22 1HG ARG 22 -5.561 15.307 2.205
154 HG3 ARG 22 2HG ARG 22 -5.363 13.885 1.179
155 HD2 ARG 22 1HD ARG 22 -7.512 14.051 0.319
156 HD3 ARG 22 2HD ARG 22 -8.086 15.020 1.675
157 HE ARG 22 HE ARG 22 -6.110 16.460 0.297
158 HH11 ARG 22 1HH1 ARG 22 -9.370 15.312 -0.124
159 HH12 ARG 22 2HH1 ARG 22 -9.821 16.595 -1.200
160 HH21 ARG 22 1HH2 ARG 22 -6.692 18.152 -1.118
161 HH22 ARG 22 2HH2 ARG 22 -8.296 18.208 -1.765
162 H SER 23 H SER 23 -5.800 10.769 0.547
163 HA SER 23 HA SER 23 -2.989 11.131 0.731
164 HB2 SER 23 1HB SER 23 -3.685 9.323 2.539
165 HB3 SER 23 2HB SER 23 -3.706 8.256 1.136
166 HG SER 23 HG SER 23 -1.641 8.139 1.600
167 H LEU 24 H LEU 24 -2.135 10.882 -1.239
168 HA LEU 24 HA LEU 24 -3.457 10.637 -3.549
169 HB2 LEU 24 1HB LEU 24 -0.764 9.387 -3.028
170 HB3 LEU 24 2HB LEU 24 -1.411 9.818 -4.609
171 HG LEU 24 HG LEU 24 -0.767 11.780 -2.410
172 HD11 LEU 24 1HD1 LEU 24 1.075 10.419 -3.815
173 HD12 LEU 24 2HD1 LEU 24 1.292 12.083 -3.275
174 HD13 LEU 24 3HD1 LEU 24 0.767 11.753 -4.926
175 HD21 LEU 24 3HD2 LEU 24 -1.236 13.486 -3.968
176 HD22 LEU 24 1HD2 LEU 24 -2.590 12.361 -4.072
177 HD23 LEU 24 2HD2 LEU 24 -1.332 12.345 -5.309
178 H CYS 25 H CYS 25 -2.120 7.856 -1.779
179 HA CYS 25 HA CYS 25 -4.121 6.159 -3.096
180 HB2 CYS 25 1HB CYS 25 -2.582 4.496 -3.681
181 HB3 CYS 25 2HB CYS 25 -1.746 5.987 -4.101
182 H ALA 26 H ALA 26 -4.021 3.875 -1.970
183 HA ALA 26 HA ALA 26 -3.392 3.992 0.853
184 HB1 ALA 26 3HB ALA 26 -6.021 4.638 -0.067
185 HB2 ALA 26 1HB ALA 26 -6.073 3.128 0.846
186 HB3 ALA 26 2HB ALA 26 -5.401 4.583 1.583
187 H CYS 27 H CYS 27 -2.677 2.059 1.456
188 HA CYS 27 HA CYS 27 -3.139 -0.232 -0.280
189 HB2 CYS 27 1HB CYS 27 -1.399 -0.074 2.186
190 HB3 CYS 27 2HB CYS 27 -1.352 -1.304 0.928
191 H SER 28 H SER 28 -5.434 0.558 1.056
192 HA SER 28 HA SER 28 -5.849 -1.733 2.851
193 HB2 SER 28 1HB SER 28 -5.748 0.104 4.358
194 HB3 SER 28 2HB SER 28 -6.713 1.126 3.292
195 HG SER 28 HG SER 28 -8.491 0.211 4.004
196 H ASP 29 H ASP 29 -8.022 -2.531 2.924
197 HA ASP 29 HA ASP 29 -9.248 -2.948 0.526
198 HB2 ASP 29 1HB ASP 29 -10.677 -2.770 3.188
199 HB3 ASP 29 2HB ASP 29 -11.237 -3.639 1.762
200 H ASP 30 H ASP 30 -9.852 -0.300 2.780
201 HA ASP 30 HA ASP 30 -12.113 0.845 1.776
202 HB2 ASP 30 1HB ASP 30 -11.140 1.867 3.669
203 HB3 ASP 30 2HB ASP 30 -9.598 2.107 2.850
204 H CYS 31 H CYS 31 -8.865 1.006 0.420
205 HA CYS 31 HA CYS 31 -9.401 2.932 -1.570
206 HB2 CYS 31 1HB CYS 31 -7.274 2.502 -2.357
207 HB3 CYS 31 2HB CYS 31 -7.138 1.908 -0.705
208 H LYS 32 H LYS 32 -9.565 -0.603 -1.574
209 HA LYS 32 HA LYS 32 -10.070 -1.024 -4.274
210 HB2 LYS 32 1HB LYS 32 -10.809 -2.518 -1.782
211 HB3 LYS 32 2HB LYS 32 -11.427 -3.054 -3.339
212 HG2 LYS 32 1HG LYS 32 -8.933 -2.951 -4.064
213 HG3 LYS 32 2HG LYS 32 -8.620 -3.010 -2.328
214 HD2 LYS 32 1HD LYS 32 -9.518 -5.131 -2.107
215 HD3 LYS 32 2HD LYS 32 -10.494 -4.981 -3.571
216 HE2 LYS 32 1HE LYS 32 -8.860 -6.364 -4.354
217 HE3 LYS 32 2HE LYS 32 -8.108 -4.808 -4.702
218 HZ1 LYS 32 3HZ LYS 32 -6.953 -6.793 -3.304
219 HZ2 LYS 32 1HZ LYS 32 -7.562 -5.824 -2.059
220 HZ3 LYS 32 2HZ LYS 32 -6.507 -5.165 -3.204
221 H ASP 33 H ASP 33 -12.368 -0.416 -1.635
222 HA ASP 33 HA ASP 33 -14.675 -0.525 -3.294
223 HB2 ASP 33 1HB ASP 33 -14.940 -0.919 -0.943
224 HB3 ASP 33 2HB ASP 33 -14.212 0.634 -0.543
225 H GLN 34 H GLN 34 -13.101 2.251 -1.692
226 HA GLN 34 HA GLN 34 -14.576 4.224 -3.028
227 HB2 GLN 34 1HB GLN 34 -11.917 4.239 -1.627
228 HB3 GLN 34 2HB GLN 34 -12.531 5.684 -2.419
229 HG2 GLN 34 1HG GLN 34 -14.619 5.392 -1.016
230 HG3 GLN 34 2HG GLN 34 -13.709 4.196 -0.095
231 HE21 GLN 34 1HE2 GLN 34 -14.527 6.095 1.417
232 HE22 GLN 34 2HE2 GLN 34 -13.312 7.272 1.769
233 H GLY 35 H GLY 35 -11.187 3.253 -3.619
234 HA2 GLY 35 1HA GLY 35 -10.586 2.694 -5.949
235 HA3 GLY 35 2HA GLY 35 -11.588 4.052 -6.437
236 H ASP 36 H ASP 36 -9.180 3.814 -3.840
237 HA ASP 36 HA ASP 36 -7.526 5.774 -5.277
238 HB2 ASP 36 1HB ASP 36 -8.595 5.958 -2.476
239 HB3 ASP 36 2HB ASP 36 -7.079 6.746 -2.904
240 H CYS 37 H CYS 37 -6.905 3.172 -5.411
241 HA CYS 37 HA CYS 37 -5.073 2.463 -3.276
242 HB2 CYS 37 1HB CYS 37 -5.474 1.009 -5.891
243 HB3 CYS 37 2HB CYS 37 -4.828 0.364 -4.384
244 H CYS 38 H CYS 38 -2.838 1.776 -3.814
245 HA CYS 38 HA CYS 38 -1.500 3.874 -5.241
246 HB2 CYS 38 1HB CYS 38 -0.226 1.370 -4.143
247 HB3 CYS 38 2HB CYS 38 0.524 2.940 -4.409
248 H ILE 39 H ILE 39 -0.499 3.808 -7.191
249 HA ILE 39 HA ILE 39 -1.372 2.223 -9.233
250 HB ILE 39 HB ILE 39 -0.083 4.218 -9.674
251 HG12 ILE 39 1HG1 ILE 39 1.573 1.956 -10.770
252 HG13 ILE 39 2HG1 ILE 39 -0.093 2.202 -11.282
253 HG21 ILE 39 1HG2 ILE 39 1.960 4.667 -8.859
254 HG22 ILE 39 2HG2 ILE 39 1.595 3.376 -7.716
255 HG23 ILE 39 3HG2 ILE 39 2.549 3.032 -9.160
256 HD11 ILE 39 3HD1 ILE 39 0.782 3.499 -12.861
257 HD12 ILE 39 1HD1 ILE 39 0.984 4.695 -11.580
258 HD13 ILE 39 2HD1 ILE 39 2.326 3.638 -12.020
259 H ASN 40 H ASN 40 1.168 1.518 -6.928
260 HA ASN 40 HA ASN 40 1.613 -1.075 -8.251
261 HB2 ASN 40 1HB ASN 40 3.791 -1.145 -7.205
262 HB3 ASN 40 2HB ASN 40 3.614 0.398 -8.035
263 HD21 ASN 40 1HD2 ASN 40 5.477 -0.069 -6.019
264 HD22 ASN 40 2HD2 ASN 40 5.070 0.910 -4.655
265 H TYR 41 H TYR 41 -0.652 -0.819 -6.715
266 HA TYR 41 HA TYR 41 -0.230 -1.619 -4.009
267 HB2 TYR 41 1HB TYR 41 -2.271 -0.470 -4.584
268 HB3 TYR 41 2HB TYR 41 -2.683 -1.698 -5.774
269 HD1 TYR 41 HD2 TYR 41 -3.353 -3.974 -5.012
270 HD2 TYR 41 HD1 TYR 41 -2.783 -0.763 -2.278
271 HE1 TYR 41 HE2 TYR 41 -4.611 -5.215 -3.301
272 HE2 TYR 41 HE1 TYR 41 -4.039 -1.996 -0.560
273 HH TYR 41 HH TYR 41 -6.036 -4.155 -0.936
274 H SER 42 H SER 42 -1.549 -3.376 -6.821
275 HA SER 42 HA SER 42 -1.423 -5.907 -5.519
276 HB2 SER 42 1HB SER 42 -2.257 -6.818 -7.524
277 HB3 SER 42 2HB SER 42 -2.939 -5.193 -7.480
278 HG SER 42 HG SER 42 -2.110 -5.279 -9.463
279 H SER 43 H SER 43 0.612 -4.251 -7.891
280 HA SER 43 HA SER 43 2.364 -6.264 -8.565
281 HB2 SER 43 1HB SER 43 2.366 -3.977 -9.546
282 HB3 SER 43 2HB SER 43 3.117 -3.374 -8.070
283 HG SER 43 HG SER 43 4.930 -4.567 -8.513
284 H VAL 44 H VAL 44 2.359 -4.230 -5.683
285 HA VAL 44 HA VAL 44 4.763 -5.513 -4.660
286 HB VAL 44 HB VAL 44 2.998 -3.388 -3.434
287 HG11 VAL 44 1HG1 VAL 44 5.149 -5.009 -2.334
288 HG12 VAL 44 2HG1 VAL 44 5.458 -3.277 -2.198
289 HG13 VAL 44 3HG1 VAL 44 3.985 -3.968 -1.516
290 HG21 VAL 44 3HG2 VAL 44 4.978 -1.929 -3.923
291 HG22 VAL 44 1HG2 VAL 44 5.640 -3.256 -4.875
292 HG23 VAL 44 2HG2 VAL 44 4.116 -2.507 -5.349
293 H CYS 45 H CYS 45 1.374 -5.106 -3.635
294 HA CYS 45 HA CYS 45 1.592 -6.946 -1.472
295 HB2 CYS 45 1HB CYS 45 -0.800 -5.773 -2.898
296 HB3 CYS 45 2HB CYS 45 -0.928 -6.816 -1.486
297 H GLN 46 H GLN 46 -0.281 -7.190 -4.503
298 HA GLN 46 HA GLN 46 -0.607 -10.016 -4.217
299 HB2 GLN 46 1HB GLN 46 -1.099 -8.267 -6.634
300 HB3 GLN 46 2HB GLN 46 -1.688 -9.909 -6.408
301 HG2 GLN 46 1HG GLN 46 -2.429 -7.557 -4.680
302 HG3 GLN 46 2HG GLN 46 -3.405 -8.191 -6.004
303 HE21 GLN 46 1HE2 GLN 46 -3.410 -10.802 -5.739
304 HE22 GLN 46 2HE2 GLN 46 -4.028 -11.300 -4.204
305 H GLY 47 H GLY 47 1.671 -10.582 -4.001
306 HA2 GLY 47 1HA GLY 47 2.779 -11.325 -6.575
307 HA3 GLY 47 2HA GLY 47 3.761 -10.202 -5.646
308 H GLU 48 H GLU 48 5.111 -12.316 -6.108
309 HA GLU 48 HA GLU 48 4.879 -13.980 -3.689
310 HB2 GLU 48 1HB GLU 48 4.308 -15.093 -5.949
311 HB3 GLU 48 2HB GLU 48 6.035 -15.011 -6.266
312 HG2 GLU 48 1HG GLU 48 5.854 -17.110 -5.389
313 HG3 GLU 48 2HG GLU 48 6.225 -16.178 -3.940
314 H LYS 49 H LYS 49 6.420 -13.081 -2.431
315 HA LYS 49 HA LYS 49 9.033 -12.454 -3.568
316 HB2 LYS 49 1HB LYS 49 9.503 -11.364 -1.454
317 HB3 LYS 49 2HB LYS 49 7.946 -10.821 -2.065
318 HG2 LYS 49 1HG LYS 49 6.784 -12.245 -0.514
319 HG3 LYS 49 2HG LYS 49 8.306 -12.951 0.033
320 HD2 LYS 49 1HD LYS 49 7.941 -9.996 0.201
321 HD3 LYS 49 2HD LYS 49 7.145 -11.025 1.393
322 HE2 LYS 49 1HE LYS 49 10.094 -11.070 0.761
323 HE3 LYS 49 2HE LYS 49 9.368 -10.222 2.126
324 HZ1 LYS 49 3HZ LYS 49 10.224 -12.829 2.084
325 HZ2 LYS 49 1HZ LYS 49 8.537 -12.942 2.029
326 HZ3 LYS 49 2HZ LYS 49 9.287 -12.096 3.287
327 H SER 50 H SER 50 8.451 -15.167 -3.563
328 HA SER 50 HA SER 50 9.359 -17.179 -3.010
329 HB2 SER 50 1HB SER 50 11.444 -15.272 -2.000
330 HB3 SER 50 2HB SER 50 11.601 -16.998 -1.670
331 HG SER 50 HG SER 50 12.341 -17.168 -3.617
332 H SER 51 H SER 51 7.290 -16.291 -1.405
333 HA SER 51 HA SER 51 7.941 -16.554 1.372
334 HB2 SER 51 1HB SER 51 5.912 -15.341 0.231
335 HB3 SER 51 2HB SER 51 5.160 -16.935 0.313
336 HG SER 51 HG SER 51 4.634 -16.012 2.207
337 H GLY 52 H GLY 52 8.895 -18.506 1.793
338 HA2 GLY 52 1HA GLY 52 7.450 -20.694 2.496
339 HA3 GLY 52 2HA GLY 52 7.785 -20.973 0.793
340 HA PRO 53 HA PRO 53 11.471 -21.955 3.745
341 HB2 PRO 53 1HB PRO 53 10.924 -24.514 4.464
342 HB3 PRO 53 2HB PRO 53 10.423 -23.118 5.426
343 HG2 PRO 53 1HG PRO 53 8.832 -24.749 3.484
344 HG3 PRO 53 2HG PRO 53 8.360 -24.132 5.078
345 HD2 PRO 53 1HD PRO 53 7.611 -22.930 2.770
346 HD3 PRO 53 2HD PRO 53 7.908 -22.022 4.266
347 H SER 54 H SER 54 13.017 -23.860 3.418
348 HA SER 54 HA SER 54 13.247 -24.316 0.580
349 HB2 SER 54 1HB SER 54 15.426 -25.280 1.113
350 HB3 SER 54 2HB SER 54 15.221 -23.751 1.968
351 HG SER 54 HG SER 54 14.280 -25.639 3.544
352 H SER 55 H SER 55 12.509 -26.028 -0.473
353 HA SER 55 HA SER 55 10.899 -27.983 0.358
354 HB2 SER 55 1HB SER 55 11.488 -29.281 -1.549
355 HB3 SER 55 2HB SER 55 11.768 -27.600 -2.003
356 HG SER 55 HG SER 55 14.011 -28.425 -0.955
357 H GLY 56 H GLY 56 10.934 -29.833 1.512
358 HA2 GLY 56 1HA GLY 56 13.541 -30.945 2.297
359 HA3 GLY 56 2HA GLY 56 12.382 -30.513 3.546
Start of MODEL 15
1 H1 GLY 1 H GLY 1 11.012 6.583 -13.954
2 HA2 GLY 1 1HA GLY 1 12.107 4.925 -12.062
3 HA3 GLY 1 2HA GLY 1 13.101 4.678 -13.490
4 H SER 2 H SER 2 12.398 6.721 -10.837
5 HA SER 2 HA SER 2 14.678 8.401 -11.531
6 HB2 SER 2 1HB SER 2 12.007 9.595 -10.753
7 HB3 SER 2 2HB SER 2 13.490 10.481 -11.107
8 HG SER 2 HG SER 2 12.818 10.472 -13.089
9 H SER 3 H SER 3 15.461 9.669 -9.698
10 HA SER 3 HA SER 3 15.892 8.240 -7.421
11 HB2 SER 3 1HB SER 3 15.968 11.164 -8.023
12 HB3 SER 3 2HB SER 3 16.137 10.653 -6.344
13 HG SER 3 HG SER 3 18.082 10.820 -7.892
14 H GLY 4 H GLY 4 13.296 10.599 -7.960
15 HA2 GLY 4 1HA GLY 4 12.194 10.422 -5.356
16 HA3 GLY 4 2HA GLY 4 11.374 11.038 -6.781
17 H SER 5 H SER 5 11.663 8.449 -4.585
18 HA SER 5 HA SER 5 10.075 6.659 -6.275
19 HB2 SER 5 1HB SER 5 12.186 6.008 -4.809
20 HB3 SER 5 2HB SER 5 10.975 5.879 -3.534
21 HG SER 5 HG SER 5 11.106 4.458 -5.978
22 H SER 6 H SER 6 10.043 8.025 -2.987
23 HA SER 6 HA SER 6 7.584 7.096 -2.145
24 HB2 SER 6 1HB SER 6 8.815 9.795 -1.535
25 HB3 SER 6 2HB SER 6 7.548 9.006 -0.596
26 HG SER 6 HG SER 6 10.270 8.412 -0.780
27 H GLY 7 H GLY 7 5.939 7.106 -3.615
28 HA2 GLY 7 1HA GLY 7 4.470 9.524 -3.934
29 HA3 GLY 7 2HA GLY 7 5.273 9.082 -5.432
30 H TRP 8 H TRP 8 4.455 7.460 -6.673
31 HA TRP 8 HA TRP 8 1.881 6.362 -5.795
32 HB2 TRP 8 1HB TRP 8 3.073 6.483 -8.575
33 HB3 TRP 8 2HB TRP 8 1.451 5.929 -8.167
34 HD1 TRP 8 HD1 TRP 8 3.554 9.147 -8.310
35 HE1 TRP 8 HE1 TRP 8 1.951 11.156 -8.443
36 HE3 TRP 8 HE3 TRP 8 -0.883 6.691 -7.664
37 HZ2 TRP 8 HZ2 TRP 8 -0.827 11.637 -8.294
38 HZ3 TRP 8 HZ3 TRP 8 -2.967 7.998 -7.672
39 HH2 TRP 8 HH2 TRP 8 -2.937 10.420 -7.980
40 H THR 9 H THR 9 4.160 5.199 -4.689
41 HA THR 9 HA THR 9 3.983 2.508 -5.841
42 HB THR 9 HB THR 9 6.398 2.139 -5.428
43 HG1 THR 9 HG1 THR 9 6.239 4.389 -4.113
44 HG21 THR 9 3HG2 THR 9 7.111 3.956 -7.260
45 HG22 THR 9 1HG2 THR 9 5.359 4.067 -7.425
46 HG23 THR 9 2HG2 THR 9 6.171 2.519 -7.660
47 H CYS 10 H CYS 10 3.234 1.192 -4.326
48 HA CYS 10 HA CYS 10 3.427 1.895 -1.525
49 HB2 CYS 10 1HB CYS 10 2.005 -0.250 -3.074
50 HB3 CYS 10 2HB CYS 10 2.155 -0.368 -1.324
51 H ASN 11 H ASN 11 4.070 0.227 0.083
52 HA ASN 11 HA ASN 11 6.298 -1.428 -0.906
53 HB2 ASN 11 1HB ASN 11 6.224 0.171 1.665
54 HB3 ASN 11 2HB ASN 11 7.529 -0.899 1.162
55 HD21 ASN 11 1HD2 ASN 11 8.359 1.483 1.702
56 HD22 ASN 11 2HD2 ASN 11 8.649 2.436 0.290
57 H LYS 12 H LYS 12 6.891 -3.209 0.578
58 HA LYS 12 HA LYS 12 4.777 -4.892 1.124
59 HB2 LYS 12 1HB LYS 12 7.496 -4.852 2.448
60 HB3 LYS 12 2HB LYS 12 6.372 -6.202 2.492
61 HG2 LYS 12 1HG LYS 12 7.342 -5.091 -0.112
62 HG3 LYS 12 2HG LYS 12 8.300 -6.259 0.800
63 HD2 LYS 12 1HD LYS 12 6.028 -7.585 0.854
64 HD3 LYS 12 2HD LYS 12 5.675 -6.606 -0.571
65 HE2 LYS 12 1HE LYS 12 6.646 -8.505 -1.480
66 HE3 LYS 12 2HE LYS 12 8.000 -7.381 -1.389
67 HZ1 LYS 12 3HZ LYS 12 7.495 -9.208 0.856
68 HZ2 LYS 12 1HZ LYS 12 8.952 -8.527 0.335
69 HZ3 LYS 12 2HZ LYS 12 8.258 -9.801 -0.531
70 H PHE 13 H PHE 13 6.651 -3.024 3.518
71 HA PHE 13 HA PHE 13 5.147 -3.679 5.759
72 HB2 PHE 13 1HB PHE 13 6.864 -1.330 5.041
73 HB3 PHE 13 2HB PHE 13 5.942 -1.306 6.541
74 HD1 PHE 13 HD1 PHE 13 8.320 -3.455 4.645
75 HD2 PHE 13 HD2 PHE 13 6.872 -2.207 8.448
76 HE1 PHE 13 HE1 PHE 13 10.090 -4.764 5.745
77 HE2 PHE 13 HE2 PHE 13 8.638 -3.515 9.553
78 HZ PHE 13 HZ PHE 13 10.251 -4.795 8.202
79 H ARG 14 H ARG 14 4.758 -0.928 3.543
80 HA ARG 14 HA ARG 14 2.725 0.448 4.736
81 HB2 ARG 14 1HB ARG 14 2.983 -0.156 1.784
82 HB3 ARG 14 2HB ARG 14 2.012 1.136 2.477
83 HG2 ARG 14 1HG ARG 14 4.927 1.008 3.089
84 HG3 ARG 14 2HG ARG 14 4.387 1.629 1.528
85 HD2 ARG 14 1HD ARG 14 3.285 2.640 4.135
86 HD3 ARG 14 2HD ARG 14 4.730 3.324 3.395
87 HE ARG 14 HE ARG 14 2.417 3.204 1.669
88 HH11 ARG 14 1HH1 ARG 14 4.230 5.087 3.967
89 HH12 ARG 14 2HH1 ARG 14 3.594 6.604 3.423
90 HH21 ARG 14 1HH2 ARG 14 1.572 5.195 0.944
91 HH22 ARG 14 2HH2 ARG 14 2.082 6.663 1.703
92 H CYS 15 H CYS 15 2.287 -2.244 2.436
93 HA CYS 15 HA CYS 15 -0.408 -2.474 2.344
94 HB2 CYS 15 1HB CYS 15 1.449 -4.832 2.724
95 HB3 CYS 15 2HB CYS 15 -0.134 -4.852 1.952
96 H GLY 16 H GLY 16 -1.929 -2.477 3.853
97 HA2 GLY 16 1HA GLY 16 -3.080 -3.544 5.643
98 HA3 GLY 16 2HA GLY 16 -1.535 -4.118 6.255
99 H GLU 17 H GLU 17 -2.432 -0.828 5.298
100 HA GLU 17 HA GLU 17 -2.100 -0.005 8.106
101 HB2 GLU 17 1HB GLU 17 -1.002 2.047 7.335
102 HB3 GLU 17 2HB GLU 17 -0.105 0.617 6.844
103 HG2 GLU 17 1HG GLU 17 -0.970 0.794 4.599
104 HG3 GLU 17 2HG GLU 17 -1.989 2.154 5.071
105 H LYS 18 H LYS 18 -3.246 1.905 8.734
106 HA LYS 18 HA LYS 18 -5.402 2.726 6.916
107 HB2 LYS 18 1HB LYS 18 -5.744 1.917 9.810
108 HB3 LYS 18 2HB LYS 18 -6.991 2.675 8.829
109 HG2 LYS 18 1HG LYS 18 -6.803 0.728 7.258
110 HG3 LYS 18 2HG LYS 18 -5.762 -0.043 8.458
111 HD2 LYS 18 1HD LYS 18 -7.527 -0.036 10.082
112 HD3 LYS 18 2HD LYS 18 -8.557 0.936 9.029
113 HE2 LYS 18 1HE LYS 18 -7.551 -1.812 8.314
114 HE3 LYS 18 2HE LYS 18 -9.103 -1.513 9.095
115 HZ1 LYS 18 3HZ LYS 18 -8.735 -1.609 6.442
116 HZ2 LYS 18 1HZ LYS 18 -8.621 0.057 6.716
117 HZ3 LYS 18 2HZ LYS 18 -10.007 -0.786 7.195
118 H ARG 19 H ARG 19 -2.962 4.065 7.568
119 HA ARG 19 HA ARG 19 -4.077 6.570 8.492
120 HB2 ARG 19 1HB ARG 19 -2.100 4.994 10.077
121 HB3 ARG 19 2HB ARG 19 -1.924 6.744 10.031
122 HG2 ARG 19 1HG ARG 19 -4.143 7.032 10.930
123 HG3 ARG 19 2HG ARG 19 -4.425 5.292 10.869
124 HD2 ARG 19 1HD ARG 19 -2.857 4.875 12.574
125 HD3 ARG 19 2HD ARG 19 -2.159 6.488 12.436
126 HE ARG 19 HE ARG 19 -4.536 5.733 13.898
127 HH11 ARG 19 1HH1 ARG 19 -2.702 8.325 12.469
128 HH12 ARG 19 2HH1 ARG 19 -3.419 9.552 13.461
129 HH21 ARG 19 1HH2 ARG 19 -5.486 7.340 15.208
130 HH22 ARG 19 2HH2 ARG 19 -5.001 8.991 15.019
131 H LEU 20 H LEU 20 -3.332 8.122 7.213
132 HA LEU 20 HA LEU 20 -0.568 8.148 6.347
133 HB2 LEU 20 1HB LEU 20 -1.343 8.512 3.941
134 HB3 LEU 20 2HB LEU 20 -1.322 6.863 4.563
135 HG LEU 20 HG LEU 20 -3.308 7.544 3.128
136 HD11 LEU 20 1HD1 LEU 20 -4.115 5.694 4.038
137 HD12 LEU 20 2HD1 LEU 20 -4.736 6.643 5.387
138 HD13 LEU 20 3HD1 LEU 20 -3.123 5.936 5.477
139 HD21 LEU 20 3HD2 LEU 20 -5.124 8.698 4.343
140 HD22 LEU 20 1HD2 LEU 20 -3.724 9.732 4.056
141 HD23 LEU 20 2HD2 LEU 20 -3.995 9.040 5.656
142 H THR 21 H THR 21 -0.322 10.127 4.740
143 HA THR 21 HA THR 21 -2.007 12.338 5.707
144 HB THR 21 HB THR 21 0.099 12.395 6.960
145 HG1 THR 21 HG1 THR 21 -0.046 14.442 4.978
146 HG21 THR 21 3HG2 THR 21 1.619 13.000 4.462
147 HG22 THR 21 1HG2 THR 21 1.345 11.318 4.915
148 HG23 THR 21 2HG2 THR 21 2.201 12.399 6.014
149 H ARG 22 H ARG 22 -2.992 13.222 4.022
150 HA ARG 22 HA ARG 22 -3.485 13.619 1.796
151 HB2 ARG 22 1HB ARG 22 -0.841 15.047 2.138
152 HB3 ARG 22 2HB ARG 22 -2.040 15.398 0.901
153 HG2 ARG 22 1HG ARG 22 -3.632 16.076 2.606
154 HG3 ARG 22 2HG ARG 22 -2.467 15.674 3.869
155 HD2 ARG 22 1HD ARG 22 -0.921 17.328 2.573
156 HD3 ARG 22 2HD ARG 22 -2.440 17.926 1.906
157 HE ARG 22 HE ARG 22 -1.488 18.224 4.621
158 HH11 ARG 22 1HH1 ARG 22 -4.209 18.372 2.456
159 HH12 ARG 22 2HH1 ARG 22 -5.138 19.413 3.484
160 HH21 ARG 22 1HH2 ARG 22 -2.700 19.595 5.984
161 HH22 ARG 22 2HH2 ARG 22 -4.278 20.109 5.490
162 H SER 23 H SER 23 -2.322 11.088 1.995
163 HA SER 23 HA SER 23 -0.179 10.817 0.109
164 HB2 SER 23 1HB SER 23 -0.813 9.246 2.082
165 HB3 SER 23 2HB SER 23 -1.970 8.554 0.946
166 HG SER 23 HG SER 23 0.140 8.600 -0.448
167 H LEU 24 H LEU 24 -0.312 10.689 -2.031
168 HA LEU 24 HA LEU 24 -2.562 11.196 -3.517
169 HB2 LEU 24 1HB LEU 24 -0.198 9.524 -4.357
170 HB3 LEU 24 2HB LEU 24 -1.352 10.296 -5.443
171 HG LEU 24 HG LEU 24 0.207 11.986 -3.538
172 HD11 LEU 24 1HD1 LEU 24 2.029 12.171 -5.126
173 HD12 LEU 24 2HD1 LEU 24 1.267 10.974 -6.173
174 HD13 LEU 24 3HD1 LEU 24 1.862 10.501 -4.581
175 HD21 LEU 24 3HD2 LEU 24 -1.412 12.306 -5.958
176 HD22 LEU 24 1HD2 LEU 24 0.090 13.232 -5.958
177 HD23 LEU 24 2HD2 LEU 24 -1.077 13.445 -4.653
178 H CYS 25 H CYS 25 -1.244 8.032 -2.614
179 HA CYS 25 HA CYS 25 -3.857 6.852 -3.261
180 HB2 CYS 25 1HB CYS 25 -2.710 4.828 -4.100
181 HB3 CYS 25 2HB CYS 25 -2.348 6.250 -5.073
182 H ALA 26 H ALA 26 -4.180 4.716 -2.188
183 HA ALA 26 HA ALA 26 -2.920 4.734 0.476
184 HB1 ALA 26 3HB ALA 26 -5.104 5.075 1.010
185 HB2 ALA 26 1HB ALA 26 -5.702 4.246 -0.427
186 HB3 ALA 26 2HB ALA 26 -5.113 3.312 0.950
187 H CYS 27 H CYS 27 -2.108 2.860 1.330
188 HA CYS 27 HA CYS 27 -1.853 0.615 -0.547
189 HB2 CYS 27 1HB CYS 27 -0.196 1.230 1.909
190 HB3 CYS 27 2HB CYS 27 0.123 -0.031 0.722
191 H SER 28 H SER 28 -4.265 0.861 0.849
192 HA SER 28 HA SER 28 -4.079 -1.348 2.791
193 HB2 SER 28 1HB SER 28 -6.121 -0.460 3.833
194 HB3 SER 28 2HB SER 28 -4.841 0.755 3.820
195 HG SER 28 HG SER 28 -6.558 0.726 1.636
196 H ASP 29 H ASP 29 -5.883 -2.840 2.840
197 HA ASP 29 HA ASP 29 -6.768 -3.497 0.166
198 HB2 ASP 29 1HB ASP 29 -7.921 -5.406 1.640
199 HB3 ASP 29 2HB ASP 29 -6.219 -5.463 1.192
200 H ASP 30 H ASP 30 -7.867 -1.094 1.226
201 HA ASP 30 HA ASP 30 -10.712 -1.842 1.279
202 HB2 ASP 30 1HB ASP 30 -10.073 -1.160 3.533
203 HB3 ASP 30 2HB ASP 30 -9.393 0.340 2.908
204 H CYS 31 H CYS 31 -8.271 0.552 0.444
205 HA CYS 31 HA CYS 31 -9.761 2.552 -0.685
206 HB2 CYS 31 1HB CYS 31 -7.841 3.006 -2.145
207 HB3 CYS 31 2HB CYS 31 -7.318 2.631 -0.505
208 H LYS 32 H LYS 32 -8.851 -0.536 -2.152
209 HA LYS 32 HA LYS 32 -9.578 -0.267 -4.741
210 HB2 LYS 32 1HB LYS 32 -10.156 -2.616 -4.771
211 HB3 LYS 32 2HB LYS 32 -8.784 -2.372 -3.698
212 HG2 LYS 32 1HG LYS 32 -10.298 -2.453 -1.767
213 HG3 LYS 32 2HG LYS 32 -11.652 -2.749 -2.859
214 HD2 LYS 32 1HD LYS 32 -11.131 -4.900 -2.259
215 HD3 LYS 32 2HD LYS 32 -10.115 -4.720 -3.691
216 HE2 LYS 32 1HE LYS 32 -8.182 -4.313 -2.364
217 HE3 LYS 32 2HE LYS 32 -9.146 -4.165 -0.895
218 HZ1 LYS 32 3HZ LYS 32 -9.770 -6.639 -1.844
219 HZ2 LYS 32 1HZ LYS 32 -8.690 -6.305 -0.585
220 HZ3 LYS 32 2HZ LYS 32 -8.113 -6.514 -2.163
221 H ASP 33 H ASP 33 -11.794 -0.661 -2.014
222 HA ASP 33 HA ASP 33 -14.168 -0.844 -3.521
223 HB2 ASP 33 1HB ASP 33 -13.577 -0.056 -0.678
224 HB3 ASP 33 2HB ASP 33 -15.217 0.013 -1.320
225 H GLN 34 H GLN 34 -12.529 1.927 -2.031
226 HA GLN 34 HA GLN 34 -14.479 3.815 -2.938
227 HB2 GLN 34 1HB GLN 34 -11.722 4.110 -1.756
228 HB3 GLN 34 2HB GLN 34 -12.692 5.491 -2.248
229 HG2 GLN 34 1HG GLN 34 -14.251 5.164 -0.576
230 HG3 GLN 34 2HG GLN 34 -13.821 3.467 -0.369
231 HE21 GLN 34 1HE2 GLN 34 -13.712 3.924 1.893
232 HE22 GLN 34 2HE2 GLN 34 -12.300 4.660 2.564
233 H GLY 35 H GLY 35 -11.025 3.436 -3.775
234 HA2 GLY 35 1HA GLY 35 -10.597 3.143 -6.232
235 HA3 GLY 35 2HA GLY 35 -11.688 4.503 -6.450
236 H ASP 36 H ASP 36 -9.138 4.074 -4.028
237 HA ASP 36 HA ASP 36 -7.614 6.232 -5.310
238 HB2 ASP 36 1HB ASP 36 -7.913 6.150 -2.321
239 HB3 ASP 36 2HB ASP 36 -7.414 7.492 -3.347
240 H CYS 37 H CYS 37 -7.064 3.504 -5.491
241 HA CYS 37 HA CYS 37 -4.980 2.909 -3.554
242 HB2 CYS 37 1HB CYS 37 -5.875 1.313 -5.962
243 HB3 CYS 37 2HB CYS 37 -4.827 0.747 -4.665
244 H CYS 38 H CYS 38 -2.831 2.208 -4.306
245 HA CYS 38 HA CYS 38 -1.659 4.184 -5.982
246 HB2 CYS 38 1HB CYS 38 -0.481 1.632 -4.862
247 HB3 CYS 38 2HB CYS 38 0.441 2.932 -5.610
248 H ILE 39 H ILE 39 -0.159 3.582 -7.805
249 HA ILE 39 HA ILE 39 -1.647 2.283 -9.844
250 HB ILE 39 HB ILE 39 -0.198 4.092 -10.460
251 HG12 ILE 39 1HG1 ILE 39 1.069 1.559 -11.516
252 HG13 ILE 39 2HG1 ILE 39 -0.501 2.155 -12.047
253 HG21 ILE 39 1HG2 ILE 39 1.619 2.836 -8.670
254 HG22 ILE 39 2HG2 ILE 39 2.399 2.984 -10.244
255 HG23 ILE 39 3HG2 ILE 39 1.748 4.414 -9.446
256 HD11 ILE 39 3HD1 ILE 39 0.714 4.307 -12.655
257 HD12 ILE 39 1HD1 ILE 39 2.201 3.378 -12.462
258 HD13 ILE 39 2HD1 ILE 39 1.007 2.891 -13.665
259 H ASN 40 H ASN 40 0.872 1.263 -7.667
260 HA ASN 40 HA ASN 40 0.801 -1.407 -8.908
261 HB2 ASN 40 1HB ASN 40 3.166 -1.674 -8.046
262 HB3 ASN 40 2HB ASN 40 2.972 -0.541 -9.380
263 HD21 ASN 40 1HD2 ASN 40 4.520 -0.986 -6.574
264 HD22 ASN 40 2HD2 ASN 40 4.757 0.654 -6.086
265 H TYR 41 H TYR 41 -0.972 -0.614 -6.910
266 HA TYR 41 HA TYR 41 -0.141 -1.187 -4.292
267 HB2 TYR 41 1HB TYR 41 -2.231 -0.054 -4.662
268 HB3 TYR 41 2HB TYR 41 -2.856 -1.405 -5.601
269 HD1 TYR 41 HD1 TYR 41 -1.417 -0.808 -2.197
270 HD2 TYR 41 HD2 TYR 41 -4.374 -2.771 -4.543
271 HE1 TYR 41 HE1 TYR 41 -2.389 -1.770 -0.154
272 HE2 TYR 41 HE2 TYR 41 -5.357 -3.738 -2.505
273 HH TYR 41 HH TYR 41 -4.160 -4.251 0.048
274 H SER 42 H SER 42 -1.955 -3.271 -6.551
275 HA SER 42 HA SER 42 -1.687 -5.595 -4.945
276 HB2 SER 42 1HB SER 42 -2.619 -5.028 -7.729
277 HB3 SER 42 2HB SER 42 -2.273 -6.698 -7.279
278 HG SER 42 HG SER 42 -3.978 -4.987 -5.794
279 H SER 43 H SER 43 0.111 -4.323 -7.701
280 HA SER 43 HA SER 43 1.700 -6.472 -8.350
281 HB2 SER 43 1HB SER 43 2.530 -3.561 -8.240
282 HB3 SER 43 2HB SER 43 3.370 -4.830 -9.131
283 HG SER 43 HG SER 43 1.533 -3.355 -10.097
284 H VAL 44 H VAL 44 2.148 -4.139 -5.730
285 HA VAL 44 HA VAL 44 4.548 -5.515 -4.821
286 HB VAL 44 HB VAL 44 3.142 -3.088 -3.699
287 HG11 VAL 44 1HG1 VAL 44 5.508 -2.861 -2.608
288 HG12 VAL 44 2HG1 VAL 44 4.278 -3.886 -1.863
289 HG13 VAL 44 3HG1 VAL 44 5.559 -4.610 -2.837
290 HG21 VAL 44 3HG2 VAL 44 4.151 -2.774 -5.936
291 HG22 VAL 44 1HG2 VAL 44 4.932 -1.806 -4.686
292 HG23 VAL 44 2HG2 VAL 44 5.706 -3.277 -5.275
293 H CYS 45 H CYS 45 1.362 -4.628 -3.490
294 HA CYS 45 HA CYS 45 1.651 -6.127 -1.110
295 HB2 CYS 45 1HB CYS 45 -0.796 -5.086 -2.546
296 HB3 CYS 45 2HB CYS 45 -0.857 -5.873 -0.972
297 H GLN 46 H GLN 46 -0.492 -6.784 -3.888
298 HA GLN 46 HA GLN 46 -0.694 -9.565 -3.108
299 HB2 GLN 46 1HB GLN 46 -1.903 -8.032 -5.415
300 HB3 GLN 46 2HB GLN 46 -2.226 -9.727 -5.071
301 HG2 GLN 46 1HG GLN 46 -2.963 -8.898 -2.753
302 HG3 GLN 46 2HG GLN 46 -3.023 -7.306 -3.506
303 HE21 GLN 46 1HE2 GLN 46 -4.963 -6.761 -4.159
304 HE22 GLN 46 2HE2 GLN 46 -6.181 -7.829 -4.759
305 H GLY 47 H GLY 47 1.486 -10.228 -3.417
306 HA2 GLY 47 1HA GLY 47 2.742 -10.006 -5.989
307 HA3 GLY 47 2HA GLY 47 3.327 -10.940 -4.620
308 H GLU 48 H GLU 48 3.173 -11.631 -7.482
309 HA GLU 48 HA GLU 48 1.088 -13.467 -7.951
310 HB2 GLU 48 1HB GLU 48 2.415 -12.573 -9.777
311 HB3 GLU 48 2HB GLU 48 3.867 -13.321 -9.129
312 HG2 GLU 48 1HG GLU 48 3.230 -15.440 -9.776
313 HG3 GLU 48 2HG GLU 48 1.521 -15.017 -9.844
314 H LYS 49 H LYS 49 0.690 -15.205 -6.758
315 HA LYS 49 HA LYS 49 2.711 -16.512 -5.205
316 HB2 LYS 49 1HB LYS 49 -0.082 -17.503 -5.783
317 HB3 LYS 49 2HB LYS 49 0.949 -17.950 -4.432
318 HG2 LYS 49 1HG LYS 49 0.243 -15.086 -4.748
319 HG3 LYS 49 2HG LYS 49 -1.007 -16.196 -4.182
320 HD2 LYS 49 1HD LYS 49 -0.091 -15.626 -2.173
321 HD3 LYS 49 2HD LYS 49 0.954 -16.990 -2.580
322 HE2 LYS 49 1HE LYS 49 2.328 -15.173 -1.832
323 HE3 LYS 49 2HE LYS 49 2.570 -15.380 -3.565
324 HZ1 LYS 49 3HZ LYS 49 2.149 -13.216 -3.712
325 HZ2 LYS 49 1HZ LYS 49 1.557 -13.123 -2.129
326 HZ3 LYS 49 2HZ LYS 49 0.529 -13.585 -3.391
327 H SER 50 H SER 50 0.696 -17.519 -7.967
328 HA SER 50 HA SER 50 2.313 -19.897 -8.344
329 HB2 SER 50 1HB SER 50 0.709 -20.539 -10.003
330 HB3 SER 50 2HB SER 50 -0.197 -19.854 -8.654
331 HG SER 50 HG SER 50 -1.043 -18.807 -10.329
332 H SER 51 H SER 51 4.225 -19.667 -9.296
333 HA SER 51 HA SER 51 4.463 -17.773 -11.539
334 HB2 SER 51 1HB SER 51 5.947 -17.279 -9.637
335 HB3 SER 51 2HB SER 51 6.640 -18.896 -9.757
336 HG SER 51 HG SER 51 7.198 -16.662 -11.201
337 H GLY 52 H GLY 52 5.331 -18.432 -13.479
338 HA2 GLY 52 1HA GLY 52 4.967 -21.136 -14.209
339 HA3 GLY 52 2HA GLY 52 5.734 -19.902 -15.197
340 HA PRO 53 HA PRO 53 8.818 -23.137 -13.617
341 HB2 PRO 53 1HB PRO 53 9.319 -24.341 -15.998
342 HB3 PRO 53 2HB PRO 53 8.050 -24.884 -14.896
343 HG2 PRO 53 1HG PRO 53 7.829 -23.171 -17.341
344 HG3 PRO 53 2HG PRO 53 6.787 -24.505 -16.811
345 HD2 PRO 53 1HD PRO 53 6.122 -21.905 -16.449
346 HD3 PRO 53 2HD PRO 53 5.641 -23.181 -15.313
347 H SER 54 H SER 54 10.992 -22.789 -13.731
348 HA SER 54 HA SER 54 12.213 -21.460 -15.971
349 HB2 SER 54 1HB SER 54 11.816 -20.017 -13.352
350 HB3 SER 54 2HB SER 54 13.101 -19.579 -14.479
351 HG SER 54 HG SER 54 11.328 -19.419 -16.075
352 H SER 55 H SER 55 14.590 -20.823 -15.255
353 HA SER 55 HA SER 55 16.059 -23.052 -14.865
354 HB2 SER 55 1HB SER 55 16.618 -20.203 -14.081
355 HB3 SER 55 2HB SER 55 17.806 -21.469 -13.772
356 HG SER 55 HG SER 55 18.303 -21.436 -15.806
357 H GLY 56 H GLY 56 16.098 -24.551 -13.335
358 HA2 GLY 56 1HA GLY 56 14.982 -24.099 -10.737
359 HA3 GLY 56 2HA GLY 56 15.750 -25.577 -11.298
Start of MODEL 16
1 H1 GLY 1 H GLY 1 8.488 18.236 0.461
2 HA2 GLY 1 1HA GLY 1 6.326 17.946 2.164
3 HA3 GLY 1 2HA GLY 1 5.902 19.256 1.072
4 H SER 2 H SER 2 7.467 16.063 0.771
5 HA SER 2 HA SER 2 7.297 14.503 -0.906
6 HB2 SER 2 1HB SER 2 4.347 14.975 -0.423
7 HB3 SER 2 2HB SER 2 5.095 13.499 -1.036
8 HG SER 2 HG SER 2 6.043 14.436 1.396
9 H SER 3 H SER 3 7.731 16.993 -2.021
10 HA SER 3 HA SER 3 5.857 17.182 -4.268
11 HB2 SER 3 1HB SER 3 6.981 19.337 -4.747
12 HB3 SER 3 2HB SER 3 6.327 19.280 -3.110
13 HG SER 3 HG SER 3 8.437 18.791 -2.373
14 H GLY 4 H GLY 4 9.318 16.841 -3.565
15 HA2 GLY 4 1HA GLY 4 10.228 16.724 -6.217
16 HA3 GLY 4 2HA GLY 4 11.050 16.026 -4.830
17 H SER 5 H SER 5 9.897 13.944 -4.009
18 HA SER 5 HA SER 5 9.827 12.143 -6.275
19 HB2 SER 5 1HB SER 5 10.959 11.799 -3.917
20 HB3 SER 5 2HB SER 5 9.354 11.227 -3.464
21 HG SER 5 HG SER 5 10.103 9.418 -4.265
22 H SER 6 H SER 6 8.118 10.823 -6.863
23 HA SER 6 HA SER 6 5.511 11.904 -6.428
24 HB2 SER 6 1HB SER 6 6.272 9.296 -7.764
25 HB3 SER 6 2HB SER 6 4.738 10.150 -7.927
26 HG SER 6 HG SER 6 6.115 10.591 -9.683
27 H GLY 7 H GLY 7 3.909 11.239 -5.105
28 HA2 GLY 7 1HA GLY 7 4.602 9.240 -3.093
29 HA3 GLY 7 2HA GLY 7 3.258 10.370 -3.018
30 H TRP 8 H TRP 8 4.169 8.046 -5.545
31 HA TRP 8 HA TRP 8 1.607 6.671 -5.076
32 HB2 TRP 8 1HB TRP 8 2.873 7.299 -7.752
33 HB3 TRP 8 2HB TRP 8 1.417 6.336 -7.516
34 HD1 TRP 8 HD1 TRP 8 2.550 9.842 -8.018
35 HE1 TRP 8 HE1 TRP 8 0.562 11.460 -7.784
36 HE3 TRP 8 HE3 TRP 8 -0.883 6.625 -6.018
37 HZ2 TRP 8 HZ2 TRP 8 -2.109 11.383 -6.871
38 HZ3 TRP 8 HZ3 TRP 8 -3.130 7.476 -5.492
39 HH2 TRP 8 HH2 TRP 8 -3.729 9.805 -5.910
40 H THR 9 H THR 9 3.226 5.393 -3.737
41 HA THR 9 HA THR 9 3.973 3.051 -5.265
42 HB THR 9 HB THR 9 6.286 3.003 -4.238
43 HG1 THR 9 HG1 THR 9 7.092 4.856 -3.381
44 HG21 THR 9 3HG2 THR 9 5.701 5.203 -6.224
45 HG22 THR 9 1HG2 THR 9 5.926 3.497 -6.610
46 HG23 THR 9 2HG2 THR 9 7.269 4.439 -5.963
47 H CYS 10 H CYS 10 3.260 1.377 -4.135
48 HA CYS 10 HA CYS 10 2.978 1.638 -1.228
49 HB2 CYS 10 1HB CYS 10 1.589 0.043 -3.329
50 HB3 CYS 10 2HB CYS 10 1.678 -0.634 -1.707
51 H ASN 11 H ASN 11 3.609 -0.095 0.163
52 HA ASN 11 HA ASN 11 5.597 -1.938 -0.973
53 HB2 ASN 11 1HB ASN 11 6.010 -0.560 1.677
54 HB3 ASN 11 2HB ASN 11 7.180 -1.476 0.732
55 HD21 ASN 11 1HD2 ASN 11 8.594 -0.314 -0.339
56 HD22 ASN 11 2HD2 ASN 11 8.377 1.310 -0.887
57 H LYS 12 H LYS 12 6.047 -3.808 0.390
58 HA LYS 12 HA LYS 12 3.849 -5.228 1.161
59 HB2 LYS 12 1HB LYS 12 6.740 -5.402 1.839
60 HB3 LYS 12 2HB LYS 12 5.628 -6.367 2.800
61 HG2 LYS 12 1HG LYS 12 6.321 -7.789 1.088
62 HG3 LYS 12 2HG LYS 12 4.724 -7.232 0.580
63 HD2 LYS 12 1HD LYS 12 5.974 -7.010 -1.360
64 HD3 LYS 12 2HD LYS 12 6.043 -5.385 -0.674
65 HE2 LYS 12 1HE LYS 12 8.233 -5.849 0.263
66 HE3 LYS 12 2HE LYS 12 8.157 -7.509 -0.326
67 HZ1 LYS 12 3HZ LYS 12 7.831 -6.334 -2.607
68 HZ2 LYS 12 1HZ LYS 12 9.383 -6.497 -1.955
69 HZ3 LYS 12 2HZ LYS 12 8.567 -5.021 -1.833
70 H PHE 13 H PHE 13 6.018 -3.478 3.386
71 HA PHE 13 HA PHE 13 4.593 -3.946 5.728
72 HB2 PHE 13 1HB PHE 13 6.297 -1.572 4.950
73 HB3 PHE 13 2HB PHE 13 5.719 -1.880 6.585
74 HD1 PHE 13 HD2 PHE 13 6.181 -4.510 7.256
75 HD2 PHE 13 HD1 PHE 13 8.494 -2.093 4.623
76 HE1 PHE 13 HE2 PHE 13 8.145 -5.929 7.683
77 HE2 PHE 13 HE1 PHE 13 10.461 -3.510 5.046
78 HZ PHE 13 HZ PHE 13 10.288 -5.430 6.578
79 H ARG 14 H ARG 14 4.287 -1.302 3.388
80 HA ARG 14 HA ARG 14 2.440 0.279 4.710
81 HB2 ARG 14 1HB ARG 14 2.489 -0.253 1.736
82 HB3 ARG 14 2HB ARG 14 1.829 1.164 2.540
83 HG2 ARG 14 1HG ARG 14 4.694 0.509 2.971
84 HG3 ARG 14 2HG ARG 14 4.206 1.198 1.422
85 HD2 ARG 14 1HD ARG 14 4.754 3.059 2.716
86 HD3 ARG 14 2HD ARG 14 2.995 2.975 2.815
87 HE ARG 14 HE ARG 14 3.803 1.575 4.983
88 HH11 ARG 14 1HH1 ARG 14 4.569 4.743 3.758
89 HH12 ARG 14 2HH1 ARG 14 4.862 5.421 5.325
90 HH21 ARG 14 1HH2 ARG 14 4.184 2.457 7.052
91 HH22 ARG 14 2HH2 ARG 14 4.643 4.120 7.199
92 H CYS 15 H CYS 15 1.759 -2.327 2.372
93 HA CYS 15 HA CYS 15 -0.897 -2.383 2.186
94 HB2 CYS 15 1HB CYS 15 0.624 -4.883 2.935
95 HB3 CYS 15 2HB CYS 15 -0.834 -4.771 1.955
96 H GLY 16 H GLY 16 -2.669 -2.619 3.423
97 HA2 GLY 16 1HA GLY 16 -3.990 -2.964 5.273
98 HA3 GLY 16 2HA GLY 16 -2.724 -4.014 5.894
99 H GLU 17 H GLU 17 -2.982 -0.520 5.211
100 HA GLU 17 HA GLU 17 -2.182 -0.023 8.000
101 HB2 GLU 17 1HB GLU 17 -0.775 1.816 7.288
102 HB3 GLU 17 2HB GLU 17 -0.272 0.341 6.473
103 HG2 GLU 17 1HG GLU 17 -0.938 1.073 4.425
104 HG3 GLU 17 2HG GLU 17 -2.216 2.096 5.082
105 H LYS 18 H LYS 18 -2.763 2.145 8.784
106 HA LYS 18 HA LYS 18 -5.029 3.349 7.358
107 HB2 LYS 18 1HB LYS 18 -4.986 2.604 10.288
108 HB3 LYS 18 2HB LYS 18 -6.238 3.572 9.518
109 HG2 LYS 18 1HG LYS 18 -6.862 1.703 8.112
110 HG3 LYS 18 2HG LYS 18 -5.555 0.730 8.790
111 HD2 LYS 18 1HD LYS 18 -7.293 -0.008 10.078
112 HD3 LYS 18 2HD LYS 18 -6.755 1.354 11.064
113 HE2 LYS 18 1HE LYS 18 -8.779 1.866 8.949
114 HE3 LYS 18 2HE LYS 18 -9.298 1.015 10.403
115 HZ1 LYS 18 3HZ LYS 18 -7.736 3.486 10.681
116 HZ2 LYS 18 1HZ LYS 18 -8.901 2.827 11.717
117 HZ3 LYS 18 2HZ LYS 18 -9.378 3.599 10.290
118 H ARG 19 H ARG 19 -2.448 4.344 7.341
119 HA ARG 19 HA ARG 19 -2.777 6.790 8.937
120 HB2 ARG 19 1HB ARG 19 -1.028 5.272 9.907
121 HB3 ARG 19 2HB ARG 19 -0.123 5.448 8.410
122 HG2 ARG 19 1HG ARG 19 0.121 7.821 8.791
123 HG3 ARG 19 2HG ARG 19 -0.882 7.715 10.240
124 HD2 ARG 19 1HD ARG 19 1.732 6.264 9.850
125 HD3 ARG 19 2HD ARG 19 1.556 7.793 10.713
126 HE ARG 19 HE ARG 19 0.589 6.664 12.484
127 HH11 ARG 19 1HH1 ARG 19 1.025 4.526 9.771
128 HH12 ARG 19 2HH1 ARG 19 0.701 3.089 10.684
129 HH21 ARG 19 1HH2 ARG 19 0.162 4.780 13.697
130 HH22 ARG 19 2HH2 ARG 19 0.209 3.235 12.917
131 H LEU 20 H LEU 20 -3.733 6.756 6.445
132 HA LEU 20 HA LEU 20 -1.727 7.615 4.547
133 HB2 LEU 20 1HB LEU 20 -3.787 8.055 3.117
134 HB3 LEU 20 2HB LEU 20 -3.445 6.385 3.563
135 HG LEU 20 HG LEU 20 -5.883 7.273 3.648
136 HD11 LEU 20 1HD1 LEU 20 -4.493 5.236 4.951
137 HD12 LEU 20 2HD1 LEU 20 -6.235 5.353 4.703
138 HD13 LEU 20 3HD1 LEU 20 -5.513 5.971 6.189
139 HD21 LEU 20 3HD2 LEU 20 -6.467 8.139 5.904
140 HD22 LEU 20 1HD2 LEU 20 -5.515 9.264 4.934
141 HD23 LEU 20 2HD2 LEU 20 -4.745 8.343 6.226
142 H THR 21 H THR 21 -1.883 9.212 6.891
143 HA THR 21 HA THR 21 -3.404 11.509 6.751
144 HB THR 21 HB THR 21 -0.518 11.379 7.649
145 HG1 THR 21 HG1 THR 21 -1.823 9.822 8.715
146 HG21 THR 21 3HG2 THR 21 -2.491 13.129 8.980
147 HG22 THR 21 1HG2 THR 21 -2.005 13.608 7.355
148 HG23 THR 21 2HG2 THR 21 -0.789 13.412 8.617
149 H ARG 22 H ARG 22 -3.701 12.542 4.851
150 HA ARG 22 HA ARG 22 -3.275 13.905 3.080
151 HB2 ARG 22 1HB ARG 22 -1.960 15.164 4.790
152 HB3 ARG 22 2HB ARG 22 -0.535 14.251 4.309
153 HG2 ARG 22 1HG ARG 22 -0.316 15.367 2.330
154 HG3 ARG 22 2HG ARG 22 -2.040 15.717 2.209
155 HD2 ARG 22 1HD ARG 22 -0.497 16.951 4.432
156 HD3 ARG 22 2HD ARG 22 -0.279 17.594 2.806
157 HE ARG 22 HE ARG 22 -2.625 17.827 4.471
158 HH11 ARG 22 1HH1 ARG 22 -1.333 18.003 1.244
159 HH12 ARG 22 2HH1 ARG 22 -2.605 19.017 0.650
160 HH21 ARG 22 1HH2 ARG 22 -4.306 19.162 3.701
161 HH22 ARG 22 2HH2 ARG 22 -4.296 19.676 2.049
162 H SER 23 H SER 23 -2.658 11.035 3.001
163 HA SER 23 HA SER 23 -0.374 10.864 1.200
164 HB2 SER 23 1HB SER 23 -2.038 8.916 2.713
165 HB3 SER 23 2HB SER 23 -1.301 8.352 1.214
166 HG SER 23 HG SER 23 0.208 9.715 3.170
167 H LEU 24 H LEU 24 -0.514 10.755 -0.951
168 HA LEU 24 HA LEU 24 -2.796 11.436 -2.359
169 HB2 LEU 24 1HB LEU 24 -0.351 9.924 -3.255
170 HB3 LEU 24 2HB LEU 24 -1.592 10.514 -4.358
171 HG LEU 24 HG LEU 24 0.081 12.271 -2.565
172 HD11 LEU 24 1HD1 LEU 24 0.490 11.253 -5.325
173 HD12 LEU 24 2HD1 LEU 24 1.668 11.601 -4.060
174 HD13 LEU 24 3HD1 LEU 24 0.939 12.922 -4.973
175 HD21 LEU 24 3HD2 LEU 24 -2.040 13.279 -3.088
176 HD22 LEU 24 1HD2 LEU 24 -1.854 12.879 -4.796
177 HD23 LEU 24 2HD2 LEU 24 -0.782 14.063 -4.046
178 H CYS 25 H CYS 25 -1.356 8.189 -2.041
179 HA CYS 25 HA CYS 25 -3.942 7.050 -2.863
180 HB2 CYS 25 1HB CYS 25 -2.837 5.261 -3.817
181 HB3 CYS 25 2HB CYS 25 -1.666 6.549 -4.082
182 H ALA 26 H ALA 26 -3.968 4.603 -1.917
183 HA ALA 26 HA ALA 26 -3.360 4.726 0.953
184 HB1 ALA 26 3HB ALA 26 -5.943 5.004 -0.130
185 HB2 ALA 26 1HB ALA 26 -5.862 3.393 0.584
186 HB3 ALA 26 2HB ALA 26 -5.491 4.812 1.563
187 H CYS 27 H CYS 27 -2.095 3.048 1.378
188 HA CYS 27 HA CYS 27 -2.112 0.691 -0.290
189 HB2 CYS 27 1HB CYS 27 -0.502 1.385 2.174
190 HB3 CYS 27 2HB CYS 27 -0.260 -0.057 1.195
191 H SER 28 H SER 28 -4.559 1.059 1.019
192 HA SER 28 HA SER 28 -4.583 -1.297 2.781
193 HB2 SER 28 1HB SER 28 -4.863 0.670 4.191
194 HB3 SER 28 2HB SER 28 -6.167 1.255 3.159
195 HG SER 28 HG SER 28 -7.114 -0.946 3.727
196 H ASP 29 H ASP 29 -6.563 -2.503 2.785
197 HA ASP 29 HA ASP 29 -7.615 -3.048 0.292
198 HB2 ASP 29 1HB ASP 29 -9.518 -4.139 1.584
199 HB3 ASP 29 2HB ASP 29 -7.892 -4.677 1.992
200 H ASP 30 H ASP 30 -8.995 -0.999 2.842
201 HA ASP 30 HA ASP 30 -11.421 -0.325 1.913
202 HB2 ASP 30 1HB ASP 30 -9.509 1.857 2.731
203 HB3 ASP 30 2HB ASP 30 -11.243 1.757 3.023
204 H CYS 31 H CYS 31 -8.370 0.625 0.482
205 HA CYS 31 HA CYS 31 -9.338 2.599 -1.277
206 HB2 CYS 31 1HB CYS 31 -7.235 2.543 -2.283
207 HB3 CYS 31 2HB CYS 31 -6.897 1.971 -0.653
208 H LYS 32 H LYS 32 -8.852 -0.890 -1.699
209 HA LYS 32 HA LYS 32 -9.370 -1.266 -4.331
210 HB2 LYS 32 1HB LYS 32 -10.023 -2.838 -1.891
211 HB3 LYS 32 2HB LYS 32 -10.788 -3.334 -3.396
212 HG2 LYS 32 1HG LYS 32 -7.876 -2.848 -3.491
213 HG3 LYS 32 2HG LYS 32 -8.421 -4.258 -2.581
214 HD2 LYS 32 1HD LYS 32 -8.269 -5.224 -4.633
215 HD3 LYS 32 2HD LYS 32 -9.909 -4.586 -4.771
216 HE2 LYS 32 1HE LYS 32 -8.799 -3.973 -6.764
217 HE3 LYS 32 2HE LYS 32 -8.875 -2.511 -5.781
218 HZ1 LYS 32 3HZ LYS 32 -6.586 -2.937 -5.075
219 HZ2 LYS 32 1HZ LYS 32 -6.698 -2.756 -6.754
220 HZ3 LYS 32 2HZ LYS 32 -6.521 -4.297 -6.080
221 H ASP 33 H ASP 33 -11.752 -0.569 -1.823
222 HA ASP 33 HA ASP 33 -14.001 -0.819 -3.585
223 HB2 ASP 33 1HB ASP 33 -13.701 0.345 -0.812
224 HB3 ASP 33 2HB ASP 33 -15.238 0.269 -1.669
225 H GLN 34 H GLN 34 -12.607 1.997 -1.888
226 HA GLN 34 HA GLN 34 -14.057 3.957 -3.215
227 HB2 GLN 34 1HB GLN 34 -11.323 4.010 -1.952
228 HB3 GLN 34 2HB GLN 34 -12.065 5.451 -2.635
229 HG2 GLN 34 1HG GLN 34 -14.002 5.077 -1.103
230 HG3 GLN 34 2HG GLN 34 -13.069 3.792 -0.338
231 HE21 GLN 34 1HE2 GLN 34 -13.308 5.071 1.597
232 HE22 GLN 34 2HE2 GLN 34 -12.227 6.386 1.890
233 H GLY 35 H GLY 35 -10.669 3.045 -3.898
234 HA2 GLY 35 1HA GLY 35 -10.094 2.489 -6.227
235 HA3 GLY 35 2HA GLY 35 -11.172 3.788 -6.714
236 H ASP 36 H ASP 36 -8.703 3.732 -4.167
237 HA ASP 36 HA ASP 36 -7.183 5.742 -5.682
238 HB2 ASP 36 1HB ASP 36 -7.477 5.946 -2.699
239 HB3 ASP 36 2HB ASP 36 -6.985 7.187 -3.848
240 H CYS 37 H CYS 37 -6.600 3.019 -5.604
241 HA CYS 37 HA CYS 37 -4.501 2.639 -3.627
242 HB2 CYS 37 1HB CYS 37 -5.070 0.722 -5.864
243 HB3 CYS 37 2HB CYS 37 -4.492 0.388 -4.234
244 H CYS 38 H CYS 38 -2.430 3.082 -3.975
245 HA CYS 38 HA CYS 38 -1.330 4.495 -5.961
246 HB2 CYS 38 1HB CYS 38 -0.213 2.396 -4.173
247 HB3 CYS 38 2HB CYS 38 0.800 2.945 -5.505
248 H ILE 39 H ILE 39 -0.232 4.134 -7.913
249 HA ILE 39 HA ILE 39 -1.405 2.522 -9.781
250 HB ILE 39 HB ILE 39 0.130 4.315 -10.391
251 HG12 ILE 39 1HG1 ILE 39 1.358 1.807 -11.500
252 HG13 ILE 39 2HG1 ILE 39 -0.319 2.211 -11.857
253 HG21 ILE 39 1HG2 ILE 39 2.516 2.623 -9.866
254 HG22 ILE 39 2HG2 ILE 39 2.360 4.379 -9.908
255 HG23 ILE 39 3HG2 ILE 39 1.782 3.476 -8.508
256 HD11 ILE 39 3HD1 ILE 39 1.677 2.947 -13.422
257 HD12 ILE 39 1HD1 ILE 39 0.243 3.949 -13.198
258 HD13 ILE 39 2HD1 ILE 39 1.719 4.311 -12.303
259 H ASN 40 H ASN 40 1.353 1.736 -7.714
260 HA ASN 40 HA ASN 40 1.237 -1.035 -8.703
261 HB2 ASN 40 1HB ASN 40 3.535 -1.269 -7.813
262 HB3 ASN 40 2HB ASN 40 3.420 -0.002 -9.031
263 HD21 ASN 40 1HD2 ASN 40 4.986 -0.678 -6.379
264 HD22 ASN 40 2HD2 ASN 40 5.104 0.877 -5.634
265 H TYR 41 H TYR 41 -0.743 -0.516 -7.011
266 HA TYR 41 HA TYR 41 0.053 -1.061 -4.279
267 HB2 TYR 41 1HB TYR 41 -1.769 0.393 -4.352
268 HB3 TYR 41 2HB TYR 41 -2.555 -0.498 -5.652
269 HD1 TYR 41 HD1 TYR 41 -1.822 -0.505 -2.032
270 HD2 TYR 41 HD2 TYR 41 -4.053 -2.289 -5.186
271 HE1 TYR 41 HE1 TYR 41 -3.214 -1.678 -0.377
272 HE2 TYR 41 HE2 TYR 41 -5.451 -3.466 -3.540
273 HH TYR 41 HH TYR 41 -5.038 -2.933 -0.063
274 H SER 42 H SER 42 -1.836 -2.692 -6.813
275 HA SER 42 HA SER 42 -2.265 -5.066 -5.324
276 HB2 SER 42 1HB SER 42 -2.971 -6.038 -7.483
277 HB3 SER 42 2HB SER 42 -3.704 -4.457 -7.209
278 HG SER 42 HG SER 42 -2.517 -5.096 -9.338
279 H SER 43 H SER 43 0.101 -4.167 -7.806
280 HA SER 43 HA SER 43 1.377 -6.607 -8.119
281 HB2 SER 43 1HB SER 43 3.386 -5.246 -8.771
282 HB3 SER 43 2HB SER 43 1.898 -4.768 -9.588
283 HG SER 43 HG SER 43 1.910 -2.912 -8.556
284 H VAL 44 H VAL 44 2.085 -4.021 -5.787
285 HA VAL 44 HA VAL 44 4.183 -5.499 -4.509
286 HB VAL 44 HB VAL 44 2.699 -3.011 -3.656
287 HG11 VAL 44 1HG1 VAL 44 3.678 -3.103 -1.663
288 HG12 VAL 44 2HG1 VAL 44 4.220 -4.737 -2.053
289 HG13 VAL 44 3HG1 VAL 44 5.259 -3.354 -2.401
290 HG21 VAL 44 3HG2 VAL 44 5.288 -2.308 -4.131
291 HG22 VAL 44 1HG2 VAL 44 5.027 -3.555 -5.351
292 HG23 VAL 44 2HG2 VAL 44 3.970 -2.145 -5.292
293 H CYS 45 H CYS 45 0.885 -4.558 -3.534
294 HA CYS 45 HA CYS 45 0.970 -6.226 -1.192
295 HB2 CYS 45 1HB CYS 45 -1.305 -4.715 -2.493
296 HB3 CYS 45 2HB CYS 45 -1.420 -5.558 -0.951
297 H GLN 46 H GLN 46 -1.377 -6.211 -3.874
298 HA GLN 46 HA GLN 46 -2.225 -8.859 -3.427
299 HB2 GLN 46 1HB GLN 46 -2.480 -7.014 -5.796
300 HB3 GLN 46 2HB GLN 46 -3.172 -8.630 -5.787
301 HG2 GLN 46 1HG GLN 46 -3.813 -6.491 -3.771
302 HG3 GLN 46 2HG GLN 46 -4.779 -6.843 -5.203
303 HE21 GLN 46 1HE2 GLN 46 -5.611 -9.059 -5.390
304 HE22 GLN 46 2HE2 GLN 46 -6.083 -9.883 -3.947
305 H GLY 47 H GLY 47 -0.219 -10.020 -3.255
306 HA2 GLY 47 1HA GLY 47 0.484 -11.787 -5.055
307 HA3 GLY 47 2HA GLY 47 1.271 -10.380 -5.754
308 H GLU 48 H GLU 48 1.992 -13.038 -4.173
309 HA GLU 48 HA GLU 48 3.580 -12.070 -1.998
310 HB2 GLU 48 1HB GLU 48 2.661 -14.339 -1.990
311 HB3 GLU 48 2HB GLU 48 3.610 -14.740 -3.413
312 HG2 GLU 48 1HG GLU 48 5.034 -13.754 -1.001
313 HG3 GLU 48 2HG GLU 48 4.401 -15.399 -0.996
314 H LYS 49 H LYS 49 5.650 -11.436 -1.972
315 HA LYS 49 HA LYS 49 7.192 -11.693 -4.471
316 HB2 LYS 49 1HB LYS 49 6.424 -9.358 -3.788
317 HB3 LYS 49 2HB LYS 49 7.543 -9.494 -2.439
318 HG2 LYS 49 1HG LYS 49 8.561 -10.005 -5.186
319 HG3 LYS 49 2HG LYS 49 8.247 -8.340 -4.689
320 HD2 LYS 49 1HD LYS 49 9.819 -8.449 -2.948
321 HD3 LYS 49 2HD LYS 49 9.882 -10.212 -3.000
322 HE2 LYS 49 1HE LYS 49 10.718 -9.765 -5.460
323 HE3 LYS 49 2HE LYS 49 11.172 -8.203 -4.782
324 HZ1 LYS 49 3HZ LYS 49 12.390 -10.770 -4.414
325 HZ2 LYS 49 1HZ LYS 49 12.081 -9.986 -2.946
326 HZ3 LYS 49 2HZ LYS 49 13.021 -9.226 -4.131
327 H SER 50 H SER 50 7.625 -11.176 -0.968
328 HA SER 50 HA SER 50 10.056 -12.833 -1.124
329 HB2 SER 50 1HB SER 50 10.851 -11.644 0.868
330 HB3 SER 50 2HB SER 50 10.481 -10.506 -0.427
331 HG SER 50 HG SER 50 8.513 -11.141 1.472
332 H SER 51 H SER 51 9.822 -14.801 -0.322
333 HA SER 51 HA SER 51 7.581 -15.647 1.160
334 HB2 SER 51 1HB SER 51 9.124 -17.075 -0.284
335 HB3 SER 51 2HB SER 51 10.238 -17.081 1.083
336 HG SER 51 HG SER 51 8.020 -18.557 0.694
337 H GLY 52 H GLY 52 7.194 -14.733 3.099
338 HA2 GLY 52 1HA GLY 52 9.063 -15.323 5.248
339 HA3 GLY 52 2HA GLY 52 8.762 -13.617 4.954
340 HA PRO 53 HA PRO 53 4.650 -15.704 6.513
341 HB2 PRO 53 1HB PRO 53 5.030 -17.983 7.939
342 HB3 PRO 53 2HB PRO 53 4.729 -17.979 6.197
343 HG2 PRO 53 1HG PRO 53 7.323 -18.225 7.671
344 HG3 PRO 53 2HG PRO 53 6.750 -19.129 6.257
345 HD2 PRO 53 1HD PRO 53 8.490 -17.063 6.058
346 HD3 PRO 53 2HD PRO 53 7.300 -17.435 4.794
347 H SER 54 H SER 54 7.506 -14.876 7.925
348 HA SER 54 HA SER 54 6.863 -15.154 10.692
349 HB2 SER 54 1HB SER 54 8.775 -13.534 11.001
350 HB3 SER 54 2HB SER 54 9.179 -14.994 10.096
351 HG SER 54 HG SER 54 8.884 -12.354 9.191
352 H SER 55 H SER 55 6.743 -13.208 12.151
353 HA SER 55 HA SER 55 4.654 -11.447 11.146
354 HB2 SER 55 1HB SER 55 5.748 -11.656 13.960
355 HB3 SER 55 2HB SER 55 4.244 -10.881 13.460
356 HG SER 55 HG SER 55 4.660 -13.433 14.106
357 H GLY 56 H GLY 56 7.135 -10.918 10.017
358 HA2 GLY 56 1HA GLY 56 7.408 -8.143 10.610
359 HA3 GLY 56 2HA GLY 56 8.770 -9.057 11.242
Start of MODEL 17
1 H1 GLY 1 H GLY 1 17.889 15.190 3.484
2 HA2 GLY 1 1HA GLY 1 18.656 15.327 0.787
3 HA3 GLY 1 2HA GLY 1 18.911 13.949 1.847
4 H SER 2 H SER 2 17.498 12.219 1.789
5 HA SER 2 HA SER 2 15.965 11.992 -0.654
6 HB2 SER 2 1HB SER 2 15.847 9.658 -0.190
7 HB3 SER 2 2HB SER 2 17.469 10.167 0.282
8 HG SER 2 HG SER 2 15.998 8.821 1.778
9 H SER 3 H SER 3 13.858 12.340 -0.823
10 HA SER 3 HA SER 3 12.240 12.360 1.640
11 HB2 SER 3 1HB SER 3 11.754 13.920 -0.910
12 HB3 SER 3 2HB SER 3 10.799 14.015 0.569
13 HG SER 3 HG SER 3 12.933 14.612 1.558
14 H GLY 4 H GLY 4 11.841 10.089 1.399
15 HA2 GLY 4 1HA GLY 4 9.965 9.467 -0.800
16 HA3 GLY 4 2HA GLY 4 11.054 8.286 -0.087
17 H SER 5 H SER 5 8.761 10.665 1.252
18 HA SER 5 HA SER 5 7.662 8.506 2.921
19 HB2 SER 5 1HB SER 5 8.505 10.232 4.321
20 HB3 SER 5 2HB SER 5 7.790 11.496 3.320
21 HG SER 5 HG SER 5 5.897 11.178 4.240
22 H SER 6 H SER 6 6.724 11.327 0.983
23 HA SER 6 HA SER 6 4.019 10.180 0.761
24 HB2 SER 6 1HB SER 6 4.320 12.497 1.827
25 HB3 SER 6 2HB SER 6 4.718 13.060 0.204
26 HG SER 6 HG SER 6 2.300 11.854 1.065
27 H GLY 7 H GLY 7 4.504 8.835 -0.994
28 HA2 GLY 7 1HA GLY 7 4.932 10.294 -3.525
29 HA3 GLY 7 2HA GLY 7 5.756 8.777 -3.196
30 H TRP 8 H TRP 8 4.817 7.863 -5.073
31 HA TRP 8 HA TRP 8 1.995 7.109 -4.698
32 HB2 TRP 8 1HB TRP 8 3.415 7.939 -7.223
33 HB3 TRP 8 2HB TRP 8 1.933 6.987 -7.262
34 HD1 TRP 8 HD1 TRP 8 3.221 10.485 -6.380
35 HE1 TRP 8 HE1 TRP 8 1.214 12.091 -6.252
36 HE3 TRP 8 HE3 TRP 8 -0.568 7.082 -6.821
37 HZ2 TRP 8 HZ2 TRP 8 -1.604 11.934 -6.327
38 HZ3 TRP 8 HZ3 TRP 8 -2.890 7.892 -6.783
39 HH2 TRP 8 HH2 TRP 8 -3.396 10.268 -6.540
40 H THR 9 H THR 9 4.080 5.602 -3.684
41 HA THR 9 HA THR 9 3.839 3.183 -5.321
42 HB THR 9 HB THR 9 6.201 2.586 -4.881
43 HG1 THR 9 HG1 THR 9 7.461 4.685 -4.353
44 HG21 THR 9 3HG2 THR 9 5.666 3.550 -7.026
45 HG22 THR 9 1HG2 THR 9 7.211 4.201 -6.482
46 HG23 THR 9 2HG2 THR 9 5.749 5.180 -6.359
47 H CYS 10 H CYS 10 3.098 1.559 -4.133
48 HA CYS 10 HA CYS 10 2.919 1.790 -1.274
49 HB2 CYS 10 1HB CYS 10 1.963 -0.178 -3.317
50 HB3 CYS 10 2HB CYS 10 1.978 -0.642 -1.619
51 H ASN 11 H ASN 11 3.452 -0.240 0.062
52 HA ASN 11 HA ASN 11 5.914 -1.547 -0.809
53 HB2 ASN 11 1HB ASN 11 5.795 -0.260 1.912
54 HB3 ASN 11 2HB ASN 11 7.202 -0.887 1.058
55 HD21 ASN 11 1HD2 ASN 11 5.839 1.850 2.052
56 HD22 ASN 11 2HD2 ASN 11 6.396 2.945 0.836
57 H LYS 12 H LYS 12 6.616 -3.198 0.908
58 HA LYS 12 HA LYS 12 4.598 -5.075 1.263
59 HB2 LYS 12 1HB LYS 12 7.342 -4.726 2.397
60 HB3 LYS 12 2HB LYS 12 6.295 -5.964 3.079
61 HG2 LYS 12 1HG LYS 12 7.563 -7.066 1.453
62 HG3 LYS 12 2HG LYS 12 5.990 -6.800 0.699
63 HD2 LYS 12 1HD LYS 12 6.954 -4.726 -0.343
64 HD3 LYS 12 2HD LYS 12 8.533 -5.244 0.253
65 HE2 LYS 12 1HE LYS 12 8.255 -7.363 -1.001
66 HE3 LYS 12 2HE LYS 12 6.743 -6.742 -1.660
67 HZ1 LYS 12 3HZ LYS 12 8.220 -6.195 -3.302
68 HZ2 LYS 12 1HZ LYS 12 9.500 -5.907 -2.234
69 HZ3 LYS 12 2HZ LYS 12 8.254 -4.773 -2.387
70 H PHE 13 H PHE 13 6.080 -2.958 3.718
71 HA PHE 13 HA PHE 13 4.457 -3.738 5.857
72 HB2 PHE 13 1HB PHE 13 5.650 -0.992 5.442
73 HB3 PHE 13 2HB PHE 13 5.214 -1.739 6.975
74 HD1 PHE 13 HD2 PHE 13 6.369 -4.232 7.157
75 HD2 PHE 13 HD1 PHE 13 7.897 -0.846 5.079
76 HE1 PHE 13 HE2 PHE 13 8.647 -5.138 7.362
77 HE2 PHE 13 HE1 PHE 13 10.177 -1.748 5.280
78 HZ PHE 13 HZ PHE 13 10.555 -3.896 6.423
79 H ARG 14 H ARG 14 4.053 -1.126 3.496
80 HA ARG 14 HA ARG 14 1.885 0.204 4.482
81 HB2 ARG 14 1HB ARG 14 2.398 -0.576 1.607
82 HB3 ARG 14 2HB ARG 14 1.239 0.643 2.120
83 HG2 ARG 14 1HG ARG 14 4.120 0.851 2.896
84 HG3 ARG 14 2HG ARG 14 3.561 1.394 1.313
85 HD2 ARG 14 1HD ARG 14 3.538 3.286 2.751
86 HD3 ARG 14 2HD ARG 14 1.861 2.802 2.503
87 HE ARG 14 HE ARG 14 3.126 1.718 4.868
88 HH11 ARG 14 1HH1 ARG 14 1.197 4.274 3.503
89 HH12 ARG 14 2HH1 ARG 14 0.507 4.741 5.023
90 HH21 ARG 14 1HH2 ARG 14 2.225 2.323 6.874
91 HH22 ARG 14 2HH2 ARG 14 1.093 3.632 6.939
92 H CYS 15 H CYS 15 1.841 -2.824 2.635
93 HA CYS 15 HA CYS 15 -0.814 -3.234 2.229
94 HB2 CYS 15 1HB CYS 15 0.942 -5.431 3.315
95 HB3 CYS 15 2HB CYS 15 -0.381 -5.566 2.161
96 H GLY 16 H GLY 16 -2.283 -2.539 3.704
97 HA2 GLY 16 1HA GLY 16 -3.755 -3.291 5.441
98 HA3 GLY 16 2HA GLY 16 -2.376 -4.040 6.233
99 H GLU 17 H GLU 17 -2.708 -0.749 4.952
100 HA GLU 17 HA GLU 17 -1.733 0.314 7.464
101 HB2 GLU 17 1HB GLU 17 -1.731 2.478 6.288
102 HB3 GLU 17 2HB GLU 17 -0.856 1.241 5.396
103 HG2 GLU 17 1HG GLU 17 -2.040 2.147 3.692
104 HG3 GLU 17 2HG GLU 17 -3.203 0.935 4.224
105 H LYS 18 H LYS 18 -2.851 2.469 8.159
106 HA LYS 18 HA LYS 18 -5.641 1.790 8.685
107 HB2 LYS 18 1HB LYS 18 -5.522 3.520 10.422
108 HB3 LYS 18 2HB LYS 18 -4.234 2.337 10.605
109 HG2 LYS 18 1HG LYS 18 -2.760 3.978 9.339
110 HG3 LYS 18 2HG LYS 18 -4.044 5.159 9.605
111 HD2 LYS 18 1HD LYS 18 -3.062 3.608 11.944
112 HD3 LYS 18 2HD LYS 18 -2.025 4.882 11.299
113 HE2 LYS 18 1HE LYS 18 -3.521 6.551 11.829
114 HE3 LYS 18 2HE LYS 18 -4.907 5.462 11.803
115 HZ1 LYS 18 3HZ LYS 18 -2.830 5.666 13.911
116 HZ2 LYS 18 1HZ LYS 18 -3.991 4.437 13.856
117 HZ3 LYS 18 2HZ LYS 18 -4.472 6.047 14.050
118 H ARG 19 H ARG 19 -7.063 3.886 8.963
119 HA ARG 19 HA ARG 19 -7.364 4.979 6.352
120 HB2 ARG 19 1HB ARG 19 -9.139 4.514 8.228
121 HB3 ARG 19 2HB ARG 19 -8.729 6.143 8.748
122 HG2 ARG 19 1HG ARG 19 -9.694 5.403 5.993
123 HG3 ARG 19 2HG ARG 19 -10.699 6.071 7.280
124 HD2 ARG 19 1HD ARG 19 -10.183 7.996 6.172
125 HD3 ARG 19 2HD ARG 19 -8.819 7.931 7.288
126 HE ARG 19 HE ARG 19 -7.413 7.479 5.515
127 HH11 ARG 19 1HH1 ARG 19 -10.735 7.318 4.485
128 HH12 ARG 19 2HH1 ARG 19 -10.346 7.266 2.798
129 HH21 ARG 19 1HH2 ARG 19 -6.888 7.412 3.296
130 HH22 ARG 19 2HH2 ARG 19 -8.158 7.320 2.123
131 H LEU 20 H LEU 20 -5.589 6.194 5.789
132 HA LEU 20 HA LEU 20 -4.842 8.439 7.511
133 HB2 LEU 20 1HB LEU 20 -3.525 6.933 5.322
134 HB3 LEU 20 2HB LEU 20 -3.093 8.630 5.515
135 HG LEU 20 HG LEU 20 -2.734 7.861 8.032
136 HD11 LEU 20 1HD1 LEU 20 -3.437 5.579 7.742
137 HD12 LEU 20 2HD1 LEU 20 -1.702 5.610 8.054
138 HD13 LEU 20 3HD1 LEU 20 -2.298 5.355 6.414
139 HD21 LEU 20 3HD2 LEU 20 -1.044 8.917 6.674
140 HD22 LEU 20 1HD2 LEU 20 -0.798 7.429 5.760
141 HD23 LEU 20 2HD2 LEU 20 -0.353 7.497 7.465
142 H THR 21 H THR 21 -4.472 10.556 6.511
143 HA THR 21 HA THR 21 -6.435 11.083 4.376
144 HB THR 21 HB THR 21 -6.642 13.365 5.291
145 HG1 THR 21 HG1 THR 21 -5.718 13.309 7.653
146 HG21 THR 21 3HG2 THR 21 -7.594 12.579 7.609
147 HG22 THR 21 1HG2 THR 21 -7.262 10.971 6.966
148 HG23 THR 21 2HG2 THR 21 -8.354 12.056 6.106
149 H ARG 22 H ARG 22 -3.357 12.241 5.741
150 HA ARG 22 HA ARG 22 -2.729 13.723 3.346
151 HB2 ARG 22 1HB ARG 22 -2.060 14.351 5.735
152 HB3 ARG 22 2HB ARG 22 -0.834 13.097 5.602
153 HG2 ARG 22 1HG ARG 22 0.313 15.027 5.042
154 HG3 ARG 22 2HG ARG 22 -0.102 14.338 3.471
155 HD2 ARG 22 1HD ARG 22 -1.732 15.928 3.059
156 HD3 ARG 22 2HD ARG 22 -1.939 16.305 4.768
157 HE ARG 22 HE ARG 22 -0.178 17.787 4.635
158 HH11 ARG 22 1HH1 ARG 22 -0.379 15.904 1.714
159 HH12 ARG 22 2HH1 ARG 22 0.750 16.890 0.847
160 HH21 ARG 22 1HH2 ARG 22 1.308 19.094 3.503
161 HH22 ARG 22 2HH2 ARG 22 1.710 18.704 1.864
162 H SER 23 H SER 23 -3.171 11.084 2.693
163 HA SER 23 HA SER 23 -0.466 10.190 1.945
164 HB2 SER 23 1HB SER 23 -1.113 7.892 2.198
165 HB3 SER 23 2HB SER 23 -1.556 8.728 3.686
166 HG SER 23 HG SER 23 -3.684 8.757 3.012
167 H LEU 24 H LEU 24 -0.243 10.566 -0.157
168 HA LEU 24 HA LEU 24 -2.044 11.181 -2.056
169 HB2 LEU 24 1HB LEU 24 0.451 9.527 -2.288
170 HB3 LEU 24 2HB LEU 24 -0.497 9.983 -3.703
171 HG LEU 24 HG LEU 24 0.668 11.993 -1.787
172 HD11 LEU 24 1HD1 LEU 24 2.615 11.082 -2.590
173 HD12 LEU 24 2HD1 LEU 24 2.276 12.286 -3.833
174 HD13 LEU 24 3HD1 LEU 24 1.885 10.590 -4.118
175 HD21 LEU 24 3HD2 LEU 24 0.100 12.564 -4.636
176 HD22 LEU 24 1HD2 LEU 24 -0.063 13.596 -3.216
177 HD23 LEU 24 2HD2 LEU 24 -1.287 12.374 -3.562
178 H CYS 25 H CYS 25 -1.029 7.842 -1.339
179 HA CYS 25 HA CYS 25 -3.579 6.925 -2.497
180 HB2 CYS 25 1HB CYS 25 -2.530 5.050 -3.487
181 HB3 CYS 25 2HB CYS 25 -1.496 6.419 -3.881
182 H ALA 26 H ALA 26 -3.996 4.554 -1.760
183 HA ALA 26 HA ALA 26 -3.244 4.236 1.066
184 HB1 ALA 26 3HB ALA 26 -6.024 4.112 -0.083
185 HB2 ALA 26 1HB ALA 26 -5.597 3.483 1.509
186 HB3 ALA 26 2HB ALA 26 -5.413 5.202 1.161
187 H CYS 27 H CYS 27 -2.205 2.369 1.247
188 HA CYS 27 HA CYS 27 -2.692 0.218 -0.643
189 HB2 CYS 27 1HB CYS 27 -0.768 0.147 1.675
190 HB3 CYS 27 2HB CYS 27 -0.704 -0.774 0.176
191 H SER 28 H SER 28 -4.851 0.798 1.095
192 HA SER 28 HA SER 28 -4.868 -1.559 2.862
193 HB2 SER 28 1HB SER 28 -5.222 0.557 4.053
194 HB3 SER 28 2HB SER 28 -6.577 0.938 2.992
195 HG SER 28 HG SER 28 -7.674 -0.849 3.831
196 H ASP 29 H ASP 29 -7.015 -2.622 3.097
197 HA ASP 29 HA ASP 29 -7.964 -3.518 0.621
198 HB2 ASP 29 1HB ASP 29 -8.126 -4.765 2.785
199 HB3 ASP 29 2HB ASP 29 -9.422 -3.672 3.265
200 H ASP 30 H ASP 30 -9.297 -1.147 2.887
201 HA ASP 30 HA ASP 30 -11.756 -0.647 1.810
202 HB2 ASP 30 1HB ASP 30 -9.937 1.606 2.643
203 HB3 ASP 30 2HB ASP 30 -11.685 1.488 2.826
204 H CYS 31 H CYS 31 -8.637 0.538 0.645
205 HA CYS 31 HA CYS 31 -9.336 2.390 -1.217
206 HB2 CYS 31 1HB CYS 31 -7.265 2.073 -2.168
207 HB3 CYS 31 2HB CYS 31 -7.022 1.249 -0.631
208 H LYS 32 H LYS 32 -9.473 -1.127 -1.620
209 HA LYS 32 HA LYS 32 -10.096 -1.389 -4.259
210 HB2 LYS 32 1HB LYS 32 -11.471 -2.875 -2.012
211 HB3 LYS 32 2HB LYS 32 -11.324 -3.415 -3.680
212 HG2 LYS 32 1HG LYS 32 -8.996 -2.951 -1.829
213 HG3 LYS 32 2HG LYS 32 -9.746 -4.520 -2.129
214 HD2 LYS 32 1HD LYS 32 -8.732 -2.842 -4.396
215 HD3 LYS 32 2HD LYS 32 -7.636 -3.872 -3.472
216 HE2 LYS 32 1HE LYS 32 -10.172 -5.029 -4.530
217 HE3 LYS 32 2HE LYS 32 -8.827 -4.762 -5.638
218 HZ1 LYS 32 3HZ LYS 32 -7.430 -6.067 -4.075
219 HZ2 LYS 32 1HZ LYS 32 -8.671 -6.965 -4.794
220 HZ3 LYS 32 2HZ LYS 32 -8.824 -6.442 -3.193
221 H ASP 33 H ASP 33 -12.245 -0.351 -1.665
222 HA ASP 33 HA ASP 33 -14.617 -0.326 -3.228
223 HB2 ASP 33 1HB ASP 33 -14.397 -0.315 -0.666
224 HB3 ASP 33 2HB ASP 33 -14.134 1.420 -0.821
225 H GLN 34 H GLN 34 -12.668 2.397 -1.992
226 HA GLN 34 HA GLN 34 -13.918 4.274 -3.742
227 HB2 GLN 34 1HB GLN 34 -11.657 4.354 -1.793
228 HB3 GLN 34 2HB GLN 34 -11.808 5.660 -2.961
229 HG2 GLN 34 1HG GLN 34 -14.153 4.842 -1.301
230 HG3 GLN 34 2HG GLN 34 -12.903 5.893 -0.634
231 HE21 GLN 34 1HE2 GLN 34 -12.288 7.706 -2.269
232 HE22 GLN 34 2HE2 GLN 34 -13.632 8.566 -2.931
233 H GLY 35 H GLY 35 -10.510 3.214 -3.557
234 HA2 GLY 35 1HA GLY 35 -9.456 2.321 -5.580
235 HA3 GLY 35 2HA GLY 35 -10.396 3.489 -6.496
236 H ASP 36 H ASP 36 -8.285 3.678 -3.628
237 HA ASP 36 HA ASP 36 -6.929 5.955 -4.906
238 HB2 ASP 36 1HB ASP 36 -6.778 5.259 -1.980
239 HB3 ASP 36 2HB ASP 36 -6.425 6.800 -2.756
240 H CYS 37 H CYS 37 -6.518 2.743 -3.768
241 HA CYS 37 HA CYS 37 -3.980 2.409 -2.992
242 HB2 CYS 37 1HB CYS 37 -5.722 0.832 -4.813
243 HB3 CYS 37 2HB CYS 37 -4.019 0.387 -4.750
244 H CYS 38 H CYS 38 -1.984 2.835 -3.685
245 HA CYS 38 HA CYS 38 -1.340 4.510 -5.725
246 HB2 CYS 38 1HB CYS 38 0.175 2.412 -4.257
247 HB3 CYS 38 2HB CYS 38 0.919 3.079 -5.706
248 H ILE 39 H ILE 39 0.017 3.997 -7.707
249 HA ILE 39 HA ILE 39 -1.528 2.598 -9.569
250 HB ILE 39 HB ILE 39 -0.023 4.330 -10.305
251 HG12 ILE 39 1HG1 ILE 39 1.314 2.967 -12.055
252 HG13 ILE 39 2HG1 ILE 39 0.540 1.560 -11.335
253 HG21 ILE 39 1HG2 ILE 39 2.133 4.510 -9.730
254 HG22 ILE 39 2HG2 ILE 39 1.756 3.292 -8.514
255 HG23 ILE 39 3HG2 ILE 39 2.460 2.808 -10.057
256 HD11 ILE 39 3HD1 ILE 39 -0.786 3.884 -12.701
257 HD12 ILE 39 1HD1 ILE 39 -0.730 2.205 -13.232
258 HD13 ILE 39 2HD1 ILE 39 -1.660 2.645 -11.800
259 H ASN 40 H ASN 40 1.240 1.593 -7.648
260 HA ASN 40 HA ASN 40 0.971 -1.118 -8.772
261 HB2 ASN 40 1HB ASN 40 3.346 -1.412 -7.849
262 HB3 ASN 40 2HB ASN 40 3.160 -0.400 -9.279
263 HD21 ASN 40 1HD2 ASN 40 3.292 -0.218 -5.748
264 HD22 ASN 40 2HD2 ASN 40 4.116 1.300 -5.684
265 H TYR 41 H TYR 41 -0.865 -0.697 -6.964
266 HA TYR 41 HA TYR 41 -0.024 -1.106 -4.264
267 HB2 TYR 41 1HB TYR 41 -2.091 -0.038 -4.427
268 HB3 TYR 41 2HB TYR 41 -2.669 -1.129 -5.683
269 HD1 TYR 41 HD1 TYR 41 -1.375 -1.527 -2.191
270 HD2 TYR 41 HD2 TYR 41 -4.432 -2.438 -5.006
271 HE1 TYR 41 HE1 TYR 41 -2.538 -2.865 -0.486
272 HE2 TYR 41 HE2 TYR 41 -5.605 -3.777 -3.309
273 HH TYR 41 HH TYR 41 -4.221 -4.275 -0.083
274 H SER 42 H SER 42 -1.944 -3.205 -6.422
275 HA SER 42 HA SER 42 -1.552 -5.521 -4.842
276 HB2 SER 42 1HB SER 42 -2.513 -6.734 -6.783
277 HB3 SER 42 2HB SER 42 -3.475 -5.328 -6.327
278 HG SER 42 HG SER 42 -1.488 -5.191 -8.331
279 H SER 43 H SER 43 0.102 -4.203 -7.652
280 HA SER 43 HA SER 43 1.645 -6.372 -8.409
281 HB2 SER 43 1HB SER 43 1.661 -4.401 -9.767
282 HB3 SER 43 2HB SER 43 2.279 -3.417 -8.440
283 HG SER 43 HG SER 43 3.612 -5.229 -10.094
284 H VAL 44 H VAL 44 2.065 -4.161 -5.723
285 HA VAL 44 HA VAL 44 4.621 -5.383 -5.009
286 HB VAL 44 HB VAL 44 3.131 -3.076 -3.749
287 HG11 VAL 44 1HG1 VAL 44 5.398 -2.711 -2.634
288 HG12 VAL 44 2HG1 VAL 44 4.395 -4.024 -2.012
289 HG13 VAL 44 3HG1 VAL 44 5.752 -4.381 -3.080
290 HG21 VAL 44 3HG2 VAL 44 4.346 -1.654 -5.022
291 HG22 VAL 44 1HG2 VAL 44 5.760 -2.707 -5.040
292 HG23 VAL 44 2HG2 VAL 44 4.403 -3.037 -6.117
293 H CYS 45 H CYS 45 1.435 -4.778 -3.538
294 HA CYS 45 HA CYS 45 1.987 -6.439 -1.269
295 HB2 CYS 45 1HB CYS 45 -0.505 -5.099 -2.308
296 HB3 CYS 45 2HB CYS 45 -0.532 -6.151 -0.896
297 H GLN 46 H GLN 46 -0.592 -6.747 -3.711
298 HA GLN 46 HA GLN 46 -0.708 -9.603 -3.252
299 HB2 GLN 46 1HB GLN 46 -2.285 -7.802 -5.096
300 HB3 GLN 46 2HB GLN 46 -2.581 -9.524 -4.896
301 HG2 GLN 46 1HG GLN 46 -2.979 -7.314 -2.911
302 HG3 GLN 46 2HG GLN 46 -4.163 -8.455 -3.545
303 HE21 GLN 46 1HE2 GLN 46 -4.632 -10.154 -2.343
304 HE22 GLN 46 2HE2 GLN 46 -3.695 -10.747 -1.018
305 H GLY 47 H GLY 47 1.369 -10.213 -4.037
306 HA2 GLY 47 1HA GLY 47 1.361 -10.987 -6.774
307 HA3 GLY 47 2HA GLY 47 2.455 -9.635 -6.518
308 H GLU 48 H GLU 48 2.666 -12.690 -7.079
309 HA GLU 48 HA GLU 48 3.984 -13.908 -4.937
310 HB2 GLU 48 1HB GLU 48 3.153 -14.951 -7.129
311 HB3 GLU 48 2HB GLU 48 4.678 -14.417 -7.822
312 HG2 GLU 48 1HG GLU 48 4.463 -16.201 -5.410
313 HG3 GLU 48 2HG GLU 48 4.649 -16.786 -7.062
314 H LYS 49 H LYS 49 5.547 -12.782 -3.905
315 HA LYS 49 HA LYS 49 7.827 -11.841 -5.517
316 HB2 LYS 49 1HB LYS 49 8.247 -10.156 -3.900
317 HB3 LYS 49 2HB LYS 49 6.516 -10.112 -4.212
318 HG2 LYS 49 1HG LYS 49 7.436 -11.809 -1.970
319 HG3 LYS 49 2HG LYS 49 7.539 -10.059 -1.760
320 HD2 LYS 49 1HD LYS 49 5.031 -11.411 -2.718
321 HD3 LYS 49 2HD LYS 49 5.387 -11.199 -1.002
322 HE2 LYS 49 1HE LYS 49 5.599 -8.829 -2.786
323 HE3 LYS 49 2HE LYS 49 3.989 -9.417 -2.375
324 HZ1 LYS 49 3HZ LYS 49 4.331 -8.012 -0.646
325 HZ2 LYS 49 1HZ LYS 49 6.013 -8.190 -0.663
326 HZ3 LYS 49 2HZ LYS 49 5.044 -9.391 0.027
327 H SER 50 H SER 50 9.937 -12.222 -4.746
328 HA SER 50 HA SER 50 10.140 -14.634 -3.114
329 HB2 SER 50 1HB SER 50 12.127 -13.198 -4.884
330 HB3 SER 50 2HB SER 50 12.542 -14.602 -3.900
331 HG SER 50 HG SER 50 11.897 -15.647 -5.616
332 H SER 51 H SER 51 10.984 -14.692 -1.119
333 HA SER 51 HA SER 51 11.319 -12.321 0.364
334 HB2 SER 51 1HB SER 51 10.647 -14.237 1.579
335 HB3 SER 51 2HB SER 51 11.972 -15.208 0.937
336 HG SER 51 HG SER 51 11.921 -13.740 3.158
337 H GLY 52 H GLY 52 12.876 -11.021 -0.609
338 HA2 GLY 52 1HA GLY 52 15.557 -11.468 0.249
339 HA3 GLY 52 2HA GLY 52 15.399 -11.737 -1.481
340 HA PRO 53 HA PRO 53 15.556 -7.090 -0.177
341 HB2 PRO 53 1HB PRO 53 18.227 -6.651 0.022
342 HB3 PRO 53 2HB PRO 53 17.219 -7.088 1.407
343 HG2 PRO 53 1HG PRO 53 18.996 -8.821 -0.266
344 HG3 PRO 53 2HG PRO 53 18.794 -8.796 1.495
345 HD2 PRO 53 1HD PRO 53 17.596 -10.643 -0.082
346 HD3 PRO 53 2HD PRO 53 16.858 -10.045 1.417
347 H SER 54 H SER 54 15.871 -5.519 -1.718
348 HA SER 54 HA SER 54 17.247 -6.361 -4.186
349 HB2 SER 54 1HB SER 54 14.612 -6.103 -4.107
350 HB3 SER 54 2HB SER 54 14.999 -4.392 -4.294
351 HG SER 54 HG SER 54 14.759 -5.989 -6.229
352 H SER 55 H SER 55 18.275 -4.718 -5.412
353 HA SER 55 HA SER 55 19.098 -2.425 -3.772
354 HB2 SER 55 1HB SER 55 21.120 -2.360 -5.042
355 HB3 SER 55 2HB SER 55 20.830 -4.057 -4.655
356 HG SER 55 HG SER 55 19.608 -3.494 -6.951
357 H GLY 56 H GLY 56 19.810 -0.484 -5.216
358 HA2 GLY 56 1HA GLY 56 17.436 0.406 -6.574
359 HA3 GLY 56 2HA GLY 56 18.908 1.335 -6.326
Start of MODEL 18
1 H1 GLY 1 H GLY 1 8.368 20.554 15.644
2 HA2 GLY 1 1HA GLY 1 7.609 20.464 12.907
3 HA3 GLY 1 2HA GLY 1 8.836 19.467 13.673
4 H SER 2 H SER 2 7.428 18.276 11.767
5 HA SER 2 HA SER 2 5.762 16.394 13.271
6 HB2 SER 2 1HB SER 2 4.944 17.950 10.840
7 HB3 SER 2 2HB SER 2 4.293 16.332 11.103
8 HG SER 2 HG SER 2 4.233 18.096 13.256
9 H SER 3 H SER 3 5.604 14.297 12.315
10 HA SER 3 HA SER 3 7.881 13.701 10.558
11 HB2 SER 3 1HB SER 3 7.671 12.604 12.853
12 HB3 SER 3 2HB SER 3 6.310 11.702 12.186
13 HG SER 3 HG SER 3 8.864 11.739 10.967
14 H GLY 4 H GLY 4 7.426 13.387 8.488
15 HA2 GLY 4 1HA GLY 4 4.765 12.959 7.545
16 HA3 GLY 4 2HA GLY 4 6.227 12.956 6.569
17 H SER 5 H SER 5 3.750 11.153 6.870
18 HA SER 5 HA SER 5 4.841 8.621 7.688
19 HB2 SER 5 1HB SER 5 2.674 7.709 6.873
20 HB3 SER 5 2HB SER 5 2.466 9.048 8.001
21 HG SER 5 HG SER 5 2.630 9.818 5.372
22 H SER 6 H SER 6 4.594 10.417 4.743
23 HA SER 6 HA SER 6 5.188 9.982 2.587
24 HB2 SER 6 1HB SER 6 7.075 7.983 3.854
25 HB3 SER 6 2HB SER 6 7.253 8.752 2.277
26 HG SER 6 HG SER 6 8.430 9.655 4.209
27 H GLY 7 H GLY 7 2.882 8.707 3.217
28 HA2 GLY 7 1HA GLY 7 3.097 5.907 2.452
29 HA3 GLY 7 2HA GLY 7 1.629 6.752 2.919
30 H TRP 8 H TRP 8 4.074 6.968 0.330
31 HA TRP 8 HA TRP 8 1.887 7.461 -1.569
32 HB2 TRP 8 1HB TRP 8 3.337 9.202 -1.933
33 HB3 TRP 8 2HB TRP 8 4.750 8.268 -1.455
34 HD1 TRP 8 HD1 TRP 8 6.331 8.084 -3.449
35 HE1 TRP 8 HE1 TRP 8 6.083 7.668 -5.977
36 HE3 TRP 8 HE3 TRP 8 1.230 7.892 -3.744
37 HZ2 TRP 8 HZ2 TRP 8 4.002 7.306 -7.848
38 HZ3 TRP 8 HZ3 TRP 8 0.190 7.507 -5.941
39 HH2 TRP 8 HH2 TRP 8 1.549 7.222 -7.949
40 H THR 9 H THR 9 4.847 5.551 -1.145
41 HA THR 9 HA THR 9 4.057 3.834 -3.382
42 HB THR 9 HB THR 9 6.285 2.860 -3.237
43 HG1 THR 9 HG1 THR 9 6.460 4.480 -0.914
44 HG21 THR 9 3HG2 THR 9 6.046 4.887 -4.563
45 HG22 THR 9 1HG2 THR 9 7.624 4.858 -3.776
46 HG23 THR 9 2HG2 THR 9 6.337 5.878 -3.133
47 H CYS 10 H CYS 10 2.845 2.125 -2.934
48 HA CYS 10 HA CYS 10 2.422 1.123 -0.327
49 HB2 CYS 10 1HB CYS 10 1.751 0.055 -3.066
50 HB3 CYS 10 2HB CYS 10 1.325 -0.812 -1.594
51 H ASN 11 H ASN 11 3.331 -0.519 0.786
52 HA ASN 11 HA ASN 11 5.402 -2.114 -0.568
53 HB2 ASN 11 1HB ASN 11 6.562 -0.467 0.759
54 HB3 ASN 11 2HB ASN 11 5.557 -0.822 2.162
55 HD21 ASN 11 1HD2 ASN 11 6.079 -2.488 3.472
56 HD22 ASN 11 2HD2 ASN 11 7.471 -3.489 3.258
57 H LYS 12 H LYS 12 5.937 -4.138 0.601
58 HA LYS 12 HA LYS 12 3.809 -5.806 0.937
59 HB2 LYS 12 1HB LYS 12 6.624 -5.864 1.897
60 HB3 LYS 12 2HB LYS 12 5.510 -7.033 2.596
61 HG2 LYS 12 1HG LYS 12 6.266 -8.253 0.842
62 HG3 LYS 12 2HG LYS 12 4.916 -7.438 0.049
63 HD2 LYS 12 1HD LYS 12 6.589 -7.048 -1.471
64 HD3 LYS 12 2HD LYS 12 6.740 -5.612 -0.457
65 HE2 LYS 12 1HE LYS 12 8.591 -6.537 0.716
66 HE3 LYS 12 2HE LYS 12 8.334 -8.126 -0.003
67 HZ1 LYS 12 3HZ LYS 12 10.156 -6.532 -0.926
68 HZ2 LYS 12 1HZ LYS 12 8.861 -5.842 -1.768
69 HZ3 LYS 12 2HZ LYS 12 9.235 -7.477 -1.985
70 H PHE 13 H PHE 13 5.642 -4.390 3.654
71 HA PHE 13 HA PHE 13 3.967 -5.237 5.697
72 HB2 PHE 13 1HB PHE 13 6.255 -4.135 5.894
73 HB3 PHE 13 2HB PHE 13 5.423 -2.594 5.714
74 HD1 PHE 13 HD1 PHE 13 5.113 -5.719 7.732
75 HD2 PHE 13 HD2 PHE 13 4.904 -1.469 7.638
76 HE1 PHE 13 HE1 PHE 13 4.654 -5.692 10.149
77 HE2 PHE 13 HE2 PHE 13 4.445 -1.435 10.055
78 HZ PHE 13 HZ PHE 13 4.320 -3.548 11.314
79 H ARG 14 H ARG 14 3.977 -2.037 4.121
80 HA ARG 14 HA ARG 14 1.931 -0.776 5.330
81 HB2 ARG 14 1HB ARG 14 2.312 -0.896 2.333
82 HB3 ARG 14 2HB ARG 14 1.437 0.353 3.208
83 HG2 ARG 14 1HG ARG 14 4.331 -0.216 3.744
84 HG3 ARG 14 2HG ARG 14 3.812 0.876 2.459
85 HD2 ARG 14 1HD ARG 14 2.361 1.887 4.442
86 HD3 ARG 14 2HD ARG 14 3.662 1.191 5.406
87 HE ARG 14 HE ARG 14 4.509 2.837 3.182
88 HH11 ARG 14 1HH1 ARG 14 3.731 2.686 6.572
89 HH12 ARG 14 2HH1 ARG 14 4.626 4.114 6.974
90 HH21 ARG 14 1HH2 ARG 14 5.691 4.718 3.699
91 HH22 ARG 14 2HH2 ARG 14 5.740 5.269 5.340
92 H CYS 15 H CYS 15 1.533 -3.160 2.720
93 HA CYS 15 HA CYS 15 -1.067 -3.210 2.179
94 HB2 CYS 15 1HB CYS 15 0.407 -5.717 3.010
95 HB3 CYS 15 2HB CYS 15 -0.980 -5.621 1.930
96 H GLY 16 H GLY 16 -2.440 -2.394 3.736
97 HA2 GLY 16 1HA GLY 16 -4.205 -3.192 5.192
98 HA3 GLY 16 2HA GLY 16 -3.026 -4.248 5.954
99 H GLU 17 H GLU 17 -2.939 -0.775 5.183
100 HA GLU 17 HA GLU 17 -2.488 -0.263 8.050
101 HB2 GLU 17 1HB GLU 17 -1.088 1.652 7.384
102 HB3 GLU 17 2HB GLU 17 -0.447 0.128 6.788
103 HG2 GLU 17 1HG GLU 17 -1.234 0.580 4.580
104 HG3 GLU 17 2HG GLU 17 -2.115 2.002 5.132
105 H LYS 18 H LYS 18 -3.238 1.787 8.860
106 HA LYS 18 HA LYS 18 -5.294 3.089 7.217
107 HB2 LYS 18 1HB LYS 18 -5.630 2.033 10.024
108 HB3 LYS 18 2HB LYS 18 -6.721 3.214 9.309
109 HG2 LYS 18 1HG LYS 18 -6.206 0.700 7.815
110 HG3 LYS 18 2HG LYS 18 -7.236 0.632 9.247
111 HD2 LYS 18 1HD LYS 18 -7.688 2.671 7.092
112 HD3 LYS 18 2HD LYS 18 -8.352 1.040 6.967
113 HE2 LYS 18 1HE LYS 18 -8.810 2.873 9.315
114 HE3 LYS 18 2HE LYS 18 -9.910 2.740 7.944
115 HZ1 LYS 18 3HZ LYS 18 -10.865 1.140 9.149
116 HZ2 LYS 18 1HZ LYS 18 -9.530 0.956 10.171
117 HZ3 LYS 18 2HZ LYS 18 -9.565 0.167 8.675
118 H ARG 19 H ARG 19 -3.638 4.721 6.980
119 HA ARG 19 HA ARG 19 -3.937 6.848 8.819
120 HB2 ARG 19 1HB ARG 19 -1.673 7.020 9.672
121 HB3 ARG 19 2HB ARG 19 -2.363 5.470 10.133
122 HG2 ARG 19 1HG ARG 19 -1.173 4.596 7.999
123 HG3 ARG 19 2HG ARG 19 -0.213 6.068 8.153
124 HD2 ARG 19 1HD ARG 19 1.013 4.461 9.324
125 HD3 ARG 19 2HD ARG 19 0.156 5.352 10.581
126 HE ARG 19 HE ARG 19 -1.358 3.109 9.767
127 HH11 ARG 19 1HH1 ARG 19 1.477 3.979 11.592
128 HH12 ARG 19 2HH1 ARG 19 1.391 2.597 12.632
129 HH21 ARG 19 1HH2 ARG 19 -1.483 1.285 11.131
130 HH22 ARG 19 2HH2 ARG 19 -0.292 1.064 12.370
131 H LEU 20 H LEU 20 -4.148 8.403 7.349
132 HA LEU 20 HA LEU 20 -1.975 9.297 5.791
133 HB2 LEU 20 1HB LEU 20 -2.543 8.712 3.618
134 HB3 LEU 20 2HB LEU 20 -2.796 7.226 4.530
135 HG LEU 20 HG LEU 20 -5.042 9.103 3.834
136 HD11 LEU 20 1HD1 LEU 20 -4.747 6.612 2.302
137 HD12 LEU 20 2HD1 LEU 20 -3.573 7.874 1.930
138 HD13 LEU 20 3HD1 LEU 20 -5.298 8.208 1.789
139 HD21 LEU 20 3HD2 LEU 20 -6.270 7.706 5.039
140 HD22 LEU 20 1HD2 LEU 20 -4.819 6.795 5.457
141 HD23 LEU 20 2HD2 LEU 20 -5.755 6.355 4.028
142 H THR 21 H THR 21 -2.458 11.235 4.605
143 HA THR 21 HA THR 21 -5.118 12.376 5.073
144 HB THR 21 HB THR 21 -4.022 14.555 5.715
145 HG1 THR 21 HG1 THR 21 -1.763 12.865 6.138
146 HG21 THR 21 3HG2 THR 21 -5.040 13.484 7.504
147 HG22 THR 21 1HG2 THR 21 -3.379 13.654 8.069
148 HG23 THR 21 2HG2 THR 21 -3.941 12.107 7.437
149 H ARG 22 H ARG 22 -5.785 12.653 3.028
150 HA ARG 22 HA ARG 22 -5.730 13.140 0.782
151 HB2 ARG 22 1HB ARG 22 -6.080 15.325 1.993
152 HB3 ARG 22 2HB ARG 22 -4.362 15.636 1.789
153 HG2 ARG 22 1HG ARG 22 -4.712 15.407 -0.684
154 HG3 ARG 22 2HG ARG 22 -6.447 15.367 -0.359
155 HD2 ARG 22 1HD ARG 22 -6.072 17.559 0.905
156 HD3 ARG 22 2HD ARG 22 -4.499 17.605 0.109
157 HE ARG 22 HE ARG 22 -7.041 18.181 -1.066
158 HH11 ARG 22 1HH1 ARG 22 -3.842 16.969 -1.717
159 HH12 ARG 22 2HH1 ARG 22 -3.876 17.410 -3.393
160 HH21 ARG 22 1HH2 ARG 22 -7.097 18.765 -3.270
161 HH22 ARG 22 2HH2 ARG 22 -5.727 18.431 -4.275
162 H SER 23 H SER 23 -3.695 11.432 1.224
163 HA SER 23 HA SER 23 -1.252 12.579 0.127
164 HB2 SER 23 1HB SER 23 -0.215 10.462 0.638
165 HB3 SER 23 2HB SER 23 -1.189 10.941 2.028
166 HG SER 23 HG SER 23 -2.097 9.185 -0.005
167 H LEU 24 H LEU 24 -0.138 11.372 -1.644
168 HA LEU 24 HA LEU 24 -1.382 11.480 -4.022
169 HB2 LEU 24 1HB LEU 24 0.851 9.810 -3.010
170 HB3 LEU 24 2HB LEU 24 0.186 9.404 -4.591
171 HG LEU 24 HG LEU 24 0.959 12.231 -4.085
172 HD11 LEU 24 1HD1 LEU 24 3.035 10.243 -4.921
173 HD12 LEU 24 2HD1 LEU 24 2.786 10.637 -3.221
174 HD13 LEU 24 3HD1 LEU 24 3.242 11.903 -4.361
175 HD21 LEU 24 3HD2 LEU 24 1.271 12.300 -6.386
176 HD22 LEU 24 1HD2 LEU 24 -0.108 11.215 -6.202
177 HD23 LEU 24 2HD2 LEU 24 1.500 10.555 -6.509
178 H CYS 25 H CYS 25 -1.253 8.562 -1.990
179 HA CYS 25 HA CYS 25 -3.843 7.729 -2.918
180 HB2 CYS 25 1HB CYS 25 -2.915 5.448 -3.652
181 HB3 CYS 25 2HB CYS 25 -2.734 6.797 -4.768
182 H ALA 26 H ALA 26 -4.232 5.360 -2.027
183 HA ALA 26 HA ALA 26 -3.087 5.256 0.689
184 HB1 ALA 26 3HB ALA 26 -5.873 4.375 -0.034
185 HB2 ALA 26 1HB ALA 26 -5.183 4.596 1.575
186 HB3 ALA 26 2HB ALA 26 -5.491 5.997 0.547
187 H CYS 27 H CYS 27 -2.821 3.183 1.629
188 HA CYS 27 HA CYS 27 -2.754 0.982 -0.331
189 HB2 CYS 27 1HB CYS 27 -0.876 1.452 1.994
190 HB3 CYS 27 2HB CYS 27 -0.805 0.096 0.873
191 H SER 28 H SER 28 -5.053 1.422 1.108
192 HA SER 28 HA SER 28 -5.016 -0.816 3.025
193 HB2 SER 28 1HB SER 28 -6.420 0.306 4.506
194 HB3 SER 28 2HB SER 28 -5.388 1.613 3.928
195 HG SER 28 HG SER 28 -7.143 2.538 3.276
196 H ASP 29 H ASP 29 -7.231 -1.787 3.329
197 HA ASP 29 HA ASP 29 -8.196 -2.788 0.918
198 HB2 ASP 29 1HB ASP 29 -9.360 -2.714 3.692
199 HB3 ASP 29 2HB ASP 29 -10.228 -3.461 2.354
200 H ASP 30 H ASP 30 -9.388 -0.124 2.911
201 HA ASP 30 HA ASP 30 -11.797 0.432 1.738
202 HB2 ASP 30 1HB ASP 30 -10.567 1.654 3.653
203 HB3 ASP 30 2HB ASP 30 -9.864 2.646 2.378
204 H CYS 31 H CYS 31 -8.591 1.048 0.464
205 HA CYS 31 HA CYS 31 -9.297 2.783 -1.631
206 HB2 CYS 31 1HB CYS 31 -7.124 2.553 -2.359
207 HB3 CYS 31 2HB CYS 31 -6.953 2.018 -0.692
208 H LYS 32 H LYS 32 -9.125 -0.744 -1.458
209 HA LYS 32 HA LYS 32 -9.472 -1.412 -4.108
210 HB2 LYS 32 1HB LYS 32 -10.411 -2.717 -1.568
211 HB3 LYS 32 2HB LYS 32 -10.784 -3.422 -3.136
212 HG2 LYS 32 1HG LYS 32 -7.959 -2.712 -2.565
213 HG3 LYS 32 2HG LYS 32 -8.646 -4.126 -1.762
214 HD2 LYS 32 1HD LYS 32 -9.332 -5.000 -3.973
215 HD3 LYS 32 2HD LYS 32 -8.539 -3.620 -4.736
216 HE2 LYS 32 1HE LYS 32 -6.444 -4.386 -3.458
217 HE3 LYS 32 2HE LYS 32 -7.310 -5.905 -3.229
218 HZ1 LYS 32 3HZ LYS 32 -7.057 -6.471 -5.373
219 HZ2 LYS 32 1HZ LYS 32 -5.764 -5.380 -5.334
220 HZ3 LYS 32 2HZ LYS 32 -7.264 -4.892 -5.945
221 H ASP 33 H ASP 33 -11.903 -0.415 -1.755
222 HA ASP 33 HA ASP 33 -14.083 -0.797 -3.609
223 HB2 ASP 33 1HB ASP 33 -13.949 0.450 -0.859
224 HB3 ASP 33 2HB ASP 33 -15.435 0.293 -1.791
225 H GLN 34 H GLN 34 -12.742 2.052 -1.928
226 HA GLN 34 HA GLN 34 -14.149 3.984 -3.351
227 HB2 GLN 34 1HB GLN 34 -11.556 4.001 -1.854
228 HB3 GLN 34 2HB GLN 34 -12.042 5.424 -2.763
229 HG2 GLN 34 1HG GLN 34 -14.259 5.221 -1.469
230 HG3 GLN 34 2HG GLN 34 -13.346 4.176 -0.382
231 HE21 GLN 34 1HE2 GLN 34 -14.356 6.311 0.753
232 HE22 GLN 34 2HE2 GLN 34 -13.161 7.524 1.043
233 H GLY 35 H GLY 35 -10.770 2.956 -3.895
234 HA2 GLY 35 1HA GLY 35 -10.085 2.385 -6.171
235 HA3 GLY 35 2HA GLY 35 -11.143 3.669 -6.737
236 H ASP 36 H ASP 36 -8.780 3.687 -4.092
237 HA ASP 36 HA ASP 36 -7.236 5.700 -5.585
238 HB2 ASP 36 1HB ASP 36 -8.551 6.883 -3.921
239 HB3 ASP 36 2HB ASP 36 -7.994 5.789 -2.659
240 H CYS 37 H CYS 37 -6.633 2.979 -5.540
241 HA CYS 37 HA CYS 37 -4.568 2.563 -3.543
242 HB2 CYS 37 1HB CYS 37 -5.088 0.736 -5.871
243 HB3 CYS 37 2HB CYS 37 -4.487 0.336 -4.266
244 H CYS 38 H CYS 38 -2.409 2.663 -3.873
245 HA CYS 38 HA CYS 38 -1.369 4.236 -5.934
246 HB2 CYS 38 1HB CYS 38 0.126 2.223 -4.240
247 HB3 CYS 38 2HB CYS 38 0.831 3.583 -5.110
248 H ILE 39 H ILE 39 -0.375 3.800 -7.854
249 HA ILE 39 HA ILE 39 -1.173 1.766 -9.465
250 HB ILE 39 HB ILE 39 0.029 3.661 -10.360
251 HG12 ILE 39 1HG1 ILE 39 1.630 1.158 -10.920
252 HG13 ILE 39 2HG1 ILE 39 0.035 1.475 -11.596
253 HG21 ILE 39 1HG2 ILE 39 2.603 3.580 -10.140
254 HG22 ILE 39 2HG2 ILE 39 1.653 4.226 -8.804
255 HG23 ILE 39 3HG2 ILE 39 2.287 2.583 -8.720
256 HD11 ILE 39 3HD1 ILE 39 2.640 2.799 -12.186
257 HD12 ILE 39 1HD1 ILE 39 1.437 2.138 -13.293
258 HD13 ILE 39 2HD1 ILE 39 1.127 3.661 -12.460
259 H ASN 40 H ASN 40 1.344 1.657 -7.055
260 HA ASN 40 HA ASN 40 2.028 -1.084 -7.869
261 HB2 ASN 40 1HB ASN 40 4.044 -0.816 -6.487
262 HB3 ASN 40 2HB ASN 40 3.935 0.448 -7.708
263 HD21 ASN 40 1HD2 ASN 40 5.130 0.140 -4.895
264 HD22 ASN 40 2HD2 ASN 40 4.650 1.598 -4.102
265 H TYR 41 H TYR 41 -0.419 -0.660 -6.580
266 HA TYR 41 HA TYR 41 -0.058 -1.335 -3.778
267 HB2 TYR 41 1HB TYR 41 -1.862 0.190 -4.364
268 HB3 TYR 41 2HB TYR 41 -2.557 -1.007 -5.451
269 HD1 TYR 41 HD2 TYR 41 -3.129 -3.325 -4.298
270 HD2 TYR 41 HD1 TYR 41 -2.743 0.377 -2.237
271 HE1 TYR 41 HE2 TYR 41 -4.490 -4.217 -2.454
272 HE2 TYR 41 HE1 TYR 41 -4.102 -0.505 -0.387
273 HH TYR 41 HH TYR 41 -5.929 -2.376 -0.174
274 H SER 42 H SER 42 -1.837 -2.804 -6.502
275 HA SER 42 HA SER 42 -2.075 -5.325 -5.192
276 HB2 SER 42 1HB SER 42 -3.209 -6.061 -7.127
277 HB3 SER 42 2HB SER 42 -3.600 -4.345 -7.016
278 HG SER 42 HG SER 42 -2.983 -4.915 -9.131
279 H SER 43 H SER 43 0.063 -4.014 -7.675
280 HA SER 43 HA SER 43 1.365 -6.404 -8.366
281 HB2 SER 43 1HB SER 43 2.419 -3.565 -8.417
282 HB3 SER 43 2HB SER 43 3.167 -4.939 -9.230
283 HG SER 43 HG SER 43 1.112 -3.396 -10.039
284 H VAL 44 H VAL 44 1.919 -4.095 -5.774
285 HA VAL 44 HA VAL 44 4.343 -5.423 -4.904
286 HB VAL 44 HB VAL 44 2.776 -3.195 -3.596
287 HG11 VAL 44 1HG1 VAL 44 5.463 -4.405 -2.980
288 HG12 VAL 44 2HG1 VAL 44 4.954 -2.825 -2.382
289 HG13 VAL 44 3HG1 VAL 44 4.060 -4.273 -1.918
290 HG21 VAL 44 3HG2 VAL 44 4.321 -1.676 -4.560
291 HG22 VAL 44 1HG2 VAL 44 5.359 -2.986 -5.126
292 HG23 VAL 44 2HG2 VAL 44 3.779 -2.729 -5.867
293 H CYS 45 H CYS 45 1.100 -4.841 -3.542
294 HA CYS 45 HA CYS 45 1.501 -6.551 -1.305
295 HB2 CYS 45 1HB CYS 45 -0.993 -5.386 -2.548
296 HB3 CYS 45 2HB CYS 45 -1.011 -6.356 -1.079
297 H GLN 46 H GLN 46 -0.469 -6.928 -4.254
298 HA GLN 46 HA GLN 46 -0.633 -9.803 -3.733
299 HB2 GLN 46 1HB GLN 46 -2.109 -7.995 -5.648
300 HB3 GLN 46 2HB GLN 46 -2.275 -9.746 -5.657
301 HG2 GLN 46 1HG GLN 46 -2.844 -9.420 -3.135
302 HG3 GLN 46 2HG GLN 46 -3.196 -7.766 -3.632
303 HE21 GLN 46 1HE2 GLN 46 -5.174 -7.367 -4.308
304 HE22 GLN 46 2HE2 GLN 46 -6.311 -8.539 -4.873
305 H GLY 47 H GLY 47 1.577 -10.238 -4.278
306 HA2 GLY 47 1HA GLY 47 2.009 -10.299 -7.199
307 HA3 GLY 47 2HA GLY 47 3.299 -9.849 -6.093
308 H GLU 48 H GLU 48 2.438 -12.241 -8.007
309 HA GLU 48 HA GLU 48 3.417 -14.325 -6.166
310 HB2 GLU 48 1HB GLU 48 1.004 -14.553 -6.923
311 HB3 GLU 48 2HB GLU 48 1.629 -14.825 -8.544
312 HG2 GLU 48 1HG GLU 48 1.093 -16.911 -7.377
313 HG3 GLU 48 2HG GLU 48 2.797 -16.800 -7.812
314 H LYS 49 H LYS 49 3.248 -13.319 -9.570
315 HA LYS 49 HA LYS 49 5.246 -15.117 -10.475
316 HB2 LYS 49 1HB LYS 49 3.449 -13.796 -11.816
317 HB3 LYS 49 2HB LYS 49 4.644 -12.506 -11.830
318 HG2 LYS 49 1HG LYS 49 5.332 -15.271 -12.752
319 HG3 LYS 49 2HG LYS 49 4.557 -14.105 -13.827
320 HD2 LYS 49 1HD LYS 49 7.078 -13.479 -12.309
321 HD3 LYS 49 2HD LYS 49 7.095 -14.223 -13.909
322 HE2 LYS 49 1HE LYS 49 5.513 -11.732 -13.462
323 HE3 LYS 49 2HE LYS 49 7.262 -11.624 -13.647
324 HZ1 LYS 49 3HZ LYS 49 5.376 -12.834 -15.595
325 HZ2 LYS 49 1HZ LYS 49 7.057 -12.785 -15.770
326 HZ3 LYS 49 2HZ LYS 49 6.164 -11.348 -15.765
327 H SER 50 H SER 50 6.929 -14.842 -8.915
328 HA SER 50 HA SER 50 8.246 -12.636 -8.094
329 HB2 SER 50 1HB SER 50 9.222 -15.367 -8.831
330 HB3 SER 50 2HB SER 50 10.404 -14.125 -8.420
331 HG SER 50 HG SER 50 9.958 -14.824 -6.465
332 H SER 51 H SER 51 9.618 -11.123 -8.879
333 HA SER 51 HA SER 51 10.562 -11.383 -11.645
334 HB2 SER 51 1HB SER 51 8.393 -9.972 -11.375
335 HB3 SER 51 2HB SER 51 9.463 -8.757 -10.676
336 HG SER 51 HG SER 51 10.606 -8.695 -12.597
337 H GLY 52 H GLY 52 12.615 -10.745 -11.931
338 HA2 GLY 52 1HA GLY 52 14.273 -8.947 -11.377
339 HA3 GLY 52 2HA GLY 52 13.896 -9.297 -9.697
340 HA PRO 53 HA PRO 53 17.656 -11.736 -10.879
341 HB2 PRO 53 1HB PRO 53 19.065 -11.090 -8.650
342 HB3 PRO 53 2HB PRO 53 19.059 -10.089 -10.106
343 HG2 PRO 53 1HG PRO 53 17.493 -9.762 -7.575
344 HG3 PRO 53 2HG PRO 53 18.331 -8.531 -8.540
345 HD2 PRO 53 1HD PRO 53 15.655 -8.917 -8.678
346 HD3 PRO 53 2HD PRO 53 16.616 -8.384 -10.073
347 H SER 54 H SER 54 15.178 -11.921 -8.721
348 HA SER 54 HA SER 54 15.720 -13.435 -6.598
349 HB2 SER 54 1HB SER 54 13.432 -12.914 -7.782
350 HB3 SER 54 2HB SER 54 13.634 -14.533 -8.452
351 HG SER 54 HG SER 54 13.202 -15.360 -6.563
352 H SER 55 H SER 55 17.248 -14.927 -6.351
353 HA SER 55 HA SER 55 17.757 -16.864 -8.476
354 HB2 SER 55 1HB SER 55 19.244 -16.111 -5.961
355 HB3 SER 55 2HB SER 55 19.682 -17.525 -6.920
356 HG SER 55 HG SER 55 19.390 -15.038 -8.186
357 H GLY 56 H GLY 56 17.991 -19.151 -7.959
358 HA2 GLY 56 1HA GLY 56 16.805 -20.145 -5.521
359 HA3 GLY 56 2HA GLY 56 15.796 -20.368 -6.942
Start of MODEL 19
1 H1 GLY 1 H GLY 1 19.406 8.372 5.017
2 HA2 GLY 1 1HA GLY 1 17.688 8.995 3.563
3 HA3 GLY 1 2HA GLY 1 18.042 7.584 2.578
4 H SER 2 H SER 2 17.103 8.032 5.987
5 HA SER 2 HA SER 2 15.704 5.763 6.416
6 HB2 SER 2 1HB SER 2 16.067 7.838 7.953
7 HB3 SER 2 2HB SER 2 14.495 8.352 7.342
8 HG SER 2 HG SER 2 13.624 6.403 8.121
9 H SER 3 H SER 3 14.393 8.694 4.898
10 HA SER 3 HA SER 3 12.089 7.098 3.987
11 HB2 SER 3 1HB SER 3 12.341 10.062 4.522
12 HB3 SER 3 2HB SER 3 10.962 9.344 3.692
13 HG SER 3 HG SER 3 11.555 9.398 6.348
14 H GLY 4 H GLY 4 14.157 9.829 2.987
15 HA2 GLY 4 1HA GLY 4 15.253 10.064 0.932
16 HA3 GLY 4 2HA GLY 4 14.359 8.680 0.322
17 H SER 5 H SER 5 13.084 11.617 1.832
18 HA SER 5 HA SER 5 11.335 12.940 1.133
19 HB2 SER 5 1HB SER 5 13.331 14.068 0.234
20 HB3 SER 5 2HB SER 5 13.187 13.136 -1.255
21 HG SER 5 HG SER 5 11.722 14.482 -1.914
22 H SER 6 H SER 6 10.669 10.299 0.690
23 HA SER 6 HA SER 6 8.953 10.564 -1.660
24 HB2 SER 6 1HB SER 6 9.517 8.439 -2.571
25 HB3 SER 6 2HB SER 6 11.052 9.246 -2.253
26 HG SER 6 HG SER 6 11.051 8.062 -0.216
27 H GLY 7 H GLY 7 7.227 8.866 -1.687
28 HA2 GLY 7 1HA GLY 7 6.594 7.178 0.405
29 HA3 GLY 7 2HA GLY 7 5.975 8.755 0.871
30 H TRP 8 H TRP 8 6.119 7.293 -2.353
31 HA TRP 8 HA TRP 8 3.180 7.201 -2.374
32 HB2 TRP 8 1HB TRP 8 4.990 8.386 -4.482
33 HB3 TRP 8 2HB TRP 8 3.305 7.970 -4.783
34 HD1 TRP 8 HD1 TRP 8 5.137 10.925 -4.246
35 HE1 TRP 8 HE1 TRP 8 3.796 12.749 -3.022
36 HE3 TRP 8 HE3 TRP 8 1.373 8.029 -2.352
37 HZ2 TRP 8 HZ2 TRP 8 1.453 12.934 -1.458
38 HZ3 TRP 8 HZ3 TRP 8 -0.379 9.108 -1.002
39 HH2 TRP 8 HH2 TRP 8 -0.338 11.509 -0.566
40 H THR 9 H THR 9 4.975 5.051 -1.912
41 HA THR 9 HA THR 9 4.310 3.380 -4.229
42 HB THR 9 HB THR 9 6.480 2.219 -4.081
43 HG1 THR 9 HG1 THR 9 7.635 4.290 -2.623
44 HG21 THR 9 3HG2 THR 9 7.884 4.058 -5.020
45 HG22 THR 9 1HG2 THR 9 6.619 5.196 -4.559
46 HG23 THR 9 2HG2 THR 9 6.284 3.937 -5.749
47 H CYS 10 H CYS 10 3.139 1.708 -3.582
48 HA CYS 10 HA CYS 10 2.756 1.053 -0.855
49 HB2 CYS 10 1HB CYS 10 1.934 -0.225 -3.448
50 HB3 CYS 10 2HB CYS 10 1.624 -1.031 -1.913
51 H ASN 11 H ASN 11 3.578 -0.548 0.405
52 HA ASN 11 HA ASN 11 5.587 -2.332 -0.793
53 HB2 ASN 11 1HB ASN 11 5.890 -0.436 1.481
54 HB3 ASN 11 2HB ASN 11 6.677 -2.005 1.628
55 HD21 ASN 11 1HD2 ASN 11 8.212 0.196 1.610
56 HD22 ASN 11 2HD2 ASN 11 9.081 0.324 0.122
57 H LYS 12 H LYS 12 6.225 -4.067 0.926
58 HA LYS 12 HA LYS 12 4.059 -5.719 1.370
59 HB2 LYS 12 1HB LYS 12 6.714 -5.619 2.808
60 HB3 LYS 12 2HB LYS 12 5.557 -6.932 2.983
61 HG2 LYS 12 1HG LYS 12 6.648 -6.124 0.308
62 HG3 LYS 12 2HG LYS 12 7.481 -7.274 1.358
63 HD2 LYS 12 1HD LYS 12 5.473 -8.690 1.377
64 HD3 LYS 12 2HD LYS 12 4.664 -7.546 0.303
65 HE2 LYS 12 1HE LYS 12 7.259 -8.895 -0.404
66 HE3 LYS 12 2HE LYS 12 5.687 -9.593 -0.787
67 HZ1 LYS 12 3HZ LYS 12 6.261 -8.429 -2.691
68 HZ2 LYS 12 1HZ LYS 12 6.909 -7.121 -1.836
69 HZ3 LYS 12 2HZ LYS 12 5.234 -7.349 -1.892
70 H PHE 13 H PHE 13 5.875 -4.217 4.044
71 HA PHE 13 HA PHE 13 4.076 -4.637 6.057
72 HB2 PHE 13 1HB PHE 13 6.424 -3.516 6.091
73 HB3 PHE 13 2HB PHE 13 5.528 -2.014 5.897
74 HD1 PHE 13 HD2 PHE 13 3.679 -1.527 7.610
75 HD2 PHE 13 HD1 PHE 13 6.734 -4.432 8.195
76 HE1 PHE 13 HE2 PHE 13 3.283 -1.451 10.037
77 HE2 PHE 13 HE1 PHE 13 6.341 -4.362 10.623
78 HZ PHE 13 HZ PHE 13 4.615 -2.870 11.547
79 H ARG 14 H ARG 14 4.229 -1.729 4.003
80 HA ARG 14 HA ARG 14 2.202 -0.228 4.985
81 HB2 ARG 14 1HB ARG 14 2.655 -0.767 2.044
82 HB3 ARG 14 2HB ARG 14 1.829 0.627 2.724
83 HG2 ARG 14 1HG ARG 14 4.616 0.087 3.596
84 HG3 ARG 14 2HG ARG 14 4.350 0.738 1.978
85 HD2 ARG 14 1HD ARG 14 3.141 1.963 4.443
86 HD3 ARG 14 2HD ARG 14 4.729 2.425 3.833
87 HE ARG 14 HE ARG 14 2.158 3.076 2.680
88 HH11 ARG 14 1HH1 ARG 14 5.600 2.876 2.201
89 HH12 ARG 14 2HH1 ARG 14 5.614 4.000 0.883
90 HH21 ARG 14 1HH2 ARG 14 2.163 4.558 0.946
91 HH22 ARG 14 2HH2 ARG 14 3.658 4.958 0.171
92 H CYS 15 H CYS 15 1.788 -2.889 2.653
93 HA CYS 15 HA CYS 15 -0.805 -2.923 2.074
94 HB2 CYS 15 1HB CYS 15 0.598 -5.365 3.175
95 HB3 CYS 15 2HB CYS 15 -0.784 -5.354 2.085
96 H GLY 16 H GLY 16 -2.204 -1.943 3.498
97 HA2 GLY 16 1HA GLY 16 -4.001 -2.668 5.003
98 HA3 GLY 16 2HA GLY 16 -2.768 -3.475 5.960
99 H GLU 17 H GLU 17 -2.682 -0.220 4.567
100 HA GLU 17 HA GLU 17 -2.115 0.837 7.230
101 HB2 GLU 17 1HB GLU 17 -1.435 2.884 6.045
102 HB3 GLU 17 2HB GLU 17 -0.578 1.467 5.454
103 HG2 GLU 17 1HG GLU 17 -1.919 1.384 3.485
104 HG3 GLU 17 2HG GLU 17 -3.001 2.630 4.106
105 H LYS 18 H LYS 18 -3.137 2.834 7.938
106 HA LYS 18 HA LYS 18 -5.781 3.338 6.774
107 HB2 LYS 18 1HB LYS 18 -5.301 2.962 9.735
108 HB3 LYS 18 2HB LYS 18 -6.838 3.324 8.962
109 HG2 LYS 18 1HG LYS 18 -6.989 1.185 8.012
110 HG3 LYS 18 2HG LYS 18 -5.287 0.836 8.325
111 HD2 LYS 18 1HD LYS 18 -7.042 1.443 10.648
112 HD3 LYS 18 2HD LYS 18 -7.223 -0.127 9.861
113 HE2 LYS 18 1HE LYS 18 -4.512 0.884 10.629
114 HE3 LYS 18 2HE LYS 18 -5.556 0.131 11.834
115 HZ1 LYS 18 3HZ LYS 18 -5.396 -1.388 9.412
116 HZ2 LYS 18 1HZ LYS 18 -5.140 -1.878 11.012
117 HZ3 LYS 18 2HZ LYS 18 -3.880 -1.173 10.132
118 H ARG 19 H ARG 19 -6.791 5.275 8.166
119 HA ARG 19 HA ARG 19 -6.717 7.513 8.560
120 HB2 ARG 19 1HB ARG 19 -4.015 6.724 9.651
121 HB3 ARG 19 2HB ARG 19 -4.676 8.348 9.796
122 HG2 ARG 19 1HG ARG 19 -5.335 7.504 11.795
123 HG3 ARG 19 2HG ARG 19 -6.727 7.027 10.821
124 HD2 ARG 19 1HD ARG 19 -5.973 5.175 12.202
125 HD3 ARG 19 2HD ARG 19 -5.731 4.813 10.493
126 HE ARG 19 HE ARG 19 -3.339 5.789 11.181
127 HH11 ARG 19 1HH1 ARG 19 -5.389 3.424 12.707
128 HH12 ARG 19 2HH1 ARG 19 -4.071 2.534 13.394
129 HH21 ARG 19 1HH2 ARG 19 -1.596 4.625 12.081
130 HH22 ARG 19 2HH2 ARG 19 -1.914 3.218 13.039
131 H LEU 20 H LEU 20 -6.426 7.095 5.994
132 HA LEU 20 HA LEU 20 -4.068 8.618 5.117
133 HB2 LEU 20 1HB LEU 20 -5.796 6.568 3.811
134 HB3 LEU 20 2HB LEU 20 -4.958 7.751 2.809
135 HG LEU 20 HG LEU 20 -3.736 5.634 2.956
136 HD11 LEU 20 1HD1 LEU 20 -2.547 7.789 2.674
137 HD12 LEU 20 2HD1 LEU 20 -1.576 6.551 3.471
138 HD13 LEU 20 3HD1 LEU 20 -2.306 7.845 4.421
139 HD21 LEU 20 3HD2 LEU 20 -2.603 5.156 5.182
140 HD22 LEU 20 1HD2 LEU 20 -4.319 4.762 5.061
141 HD23 LEU 20 2HD2 LEU 20 -3.806 6.226 5.902
142 H THR 21 H THR 21 -4.433 10.707 4.821
143 HA THR 21 HA THR 21 -7.045 11.537 3.732
144 HB THR 21 HB THR 21 -6.711 12.287 6.068
145 HG1 THR 21 HG1 THR 21 -6.520 14.691 4.732
146 HG21 THR 21 3HG2 THR 21 -4.168 13.245 4.924
147 HG22 THR 21 1HG2 THR 21 -4.553 12.745 6.570
148 HG23 THR 21 2HG2 THR 21 -4.982 14.364 6.017
149 H ARG 22 H ARG 22 -7.074 13.182 2.185
150 HA ARG 22 HA ARG 22 -6.247 13.883 0.128
151 HB2 ARG 22 1HB ARG 22 -4.594 15.798 0.580
152 HB3 ARG 22 2HB ARG 22 -6.192 15.907 1.305
153 HG2 ARG 22 1HG ARG 22 -4.811 16.534 3.039
154 HG3 ARG 22 2HG ARG 22 -5.069 14.819 3.364
155 HD2 ARG 22 1HD ARG 22 -2.727 15.379 3.638
156 HD3 ARG 22 2HD ARG 22 -2.939 14.303 2.256
157 HE ARG 22 HE ARG 22 -2.976 16.701 1.079
158 HH11 ARG 22 1HH1 ARG 22 -0.827 15.341 3.457
159 HH12 ARG 22 2HH1 ARG 22 0.546 16.255 2.928
160 HH21 ARG 22 1HH2 ARG 22 -1.174 17.909 0.374
161 HH22 ARG 22 2HH2 ARG 22 0.348 17.716 1.175
162 H SER 23 H SER 23 -5.024 11.432 0.768
163 HA SER 23 HA SER 23 -2.198 11.822 0.093
164 HB2 SER 23 1HB SER 23 -3.015 10.289 2.010
165 HB3 SER 23 2HB SER 23 -3.469 9.168 0.726
166 HG SER 23 HG SER 23 -1.456 8.620 0.608
167 H LEU 24 H LEU 24 -1.617 11.710 -1.962
168 HA LEU 24 HA LEU 24 -3.050 11.347 -4.175
169 HB2 LEU 24 1HB LEU 24 -0.325 10.108 -3.818
170 HB3 LEU 24 2HB LEU 24 -1.069 10.585 -5.342
171 HG LEU 24 HG LEU 24 -0.279 12.490 -3.141
172 HD11 LEU 24 1HD1 LEU 24 1.490 11.150 -4.624
173 HD12 LEU 24 2HD1 LEU 24 1.726 12.826 -4.134
174 HD13 LEU 24 3HD1 LEU 24 1.117 12.458 -5.747
175 HD21 LEU 24 3HD2 LEU 24 -0.967 14.216 -4.491
176 HD22 LEU 24 1HD2 LEU 24 -2.183 12.995 -4.868
177 HD23 LEU 24 2HD2 LEU 24 -0.830 13.262 -5.968
178 H CYS 25 H CYS 25 -1.642 8.663 -2.325
179 HA CYS 25 HA CYS 25 -3.669 6.892 -3.481
180 HB2 CYS 25 1HB CYS 25 -2.156 5.230 -4.127
181 HB3 CYS 25 2HB CYS 25 -1.367 6.717 -4.646
182 H ALA 26 H ALA 26 -3.877 4.841 -2.253
183 HA ALA 26 HA ALA 26 -2.926 5.000 0.512
184 HB1 ALA 26 3HB ALA 26 -5.323 5.986 0.086
185 HB2 ALA 26 1HB ALA 26 -5.786 4.284 0.090
186 HB3 ALA 26 2HB ALA 26 -4.993 4.988 1.501
187 H CYS 27 H CYS 27 -1.991 3.132 0.982
188 HA CYS 27 HA CYS 27 -2.585 0.755 -0.562
189 HB2 CYS 27 1HB CYS 27 -0.640 1.078 1.730
190 HB3 CYS 27 2HB CYS 27 -0.680 -0.232 0.554
191 H SER 28 H SER 28 -4.771 1.563 0.949
192 HA SER 28 HA SER 28 -4.852 -0.362 3.171
193 HB2 SER 28 1HB SER 28 -6.553 0.923 4.161
194 HB3 SER 28 2HB SER 28 -5.453 2.130 3.494
195 HG SER 28 HG SER 28 -7.035 1.742 1.551
196 H ASP 29 H ASP 29 -7.294 -1.116 3.488
197 HA ASP 29 HA ASP 29 -7.873 -2.721 1.173
198 HB2 ASP 29 1HB ASP 29 -8.099 -3.296 3.735
199 HB3 ASP 29 2HB ASP 29 -9.702 -2.592 3.537
200 H ASP 30 H ASP 30 -9.457 -0.073 2.903
201 HA ASP 30 HA ASP 30 -11.874 -0.005 1.549
202 HB2 ASP 30 1HB ASP 30 -11.636 2.576 2.000
203 HB3 ASP 30 2HB ASP 30 -11.816 1.450 3.343
204 H CYS 31 H CYS 31 -8.739 1.297 0.611
205 HA CYS 31 HA CYS 31 -9.414 2.911 -1.509
206 HB2 CYS 31 1HB CYS 31 -7.203 2.805 -2.140
207 HB3 CYS 31 2HB CYS 31 -7.082 2.193 -0.494
208 H LYS 32 H LYS 32 -9.085 -0.611 -1.475
209 HA LYS 32 HA LYS 32 -9.292 -1.183 -4.158
210 HB2 LYS 32 1HB LYS 32 -10.216 -2.617 -1.695
211 HB3 LYS 32 2HB LYS 32 -10.618 -3.266 -3.280
212 HG2 LYS 32 1HG LYS 32 -7.813 -2.642 -2.384
213 HG3 LYS 32 2HG LYS 32 -8.568 -4.232 -2.250
214 HD2 LYS 32 1HD LYS 32 -9.045 -3.867 -4.807
215 HD3 LYS 32 2HD LYS 32 -7.698 -2.734 -4.681
216 HE2 LYS 32 1HE LYS 32 -6.762 -4.809 -5.322
217 HE3 LYS 32 2HE LYS 32 -6.385 -4.606 -3.612
218 HZ1 LYS 32 3HZ LYS 32 -7.242 -6.635 -3.382
219 HZ2 LYS 32 1HZ LYS 32 -7.978 -6.612 -4.906
220 HZ3 LYS 32 2HZ LYS 32 -8.760 -5.913 -3.578
221 H ASP 33 H ASP 33 -11.920 -0.571 -1.858
222 HA ASP 33 HA ASP 33 -13.962 -0.881 -3.860
223 HB2 ASP 33 1HB ASP 33 -14.272 -1.359 -1.400
224 HB3 ASP 33 2HB ASP 33 -14.242 0.382 -1.129
225 H GLN 34 H GLN 34 -12.929 1.905 -1.881
226 HA GLN 34 HA GLN 34 -14.357 3.855 -3.243
227 HB2 GLN 34 1HB GLN 34 -11.740 4.020 -1.752
228 HB3 GLN 34 2HB GLN 34 -12.579 5.436 -2.371
229 HG2 GLN 34 1HG GLN 34 -13.940 3.493 -0.545
230 HG3 GLN 34 2HG GLN 34 -12.924 4.792 0.079
231 HE21 GLN 34 1HE2 GLN 34 -15.763 4.375 0.446
232 HE22 GLN 34 2HE2 GLN 34 -16.551 5.780 -0.179
233 H GLY 35 H GLY 35 -10.891 3.093 -3.659
234 HA2 GLY 35 1HA GLY 35 -10.099 2.723 -5.964
235 HA3 GLY 35 2HA GLY 35 -11.150 4.048 -6.444
236 H ASP 36 H ASP 36 -8.882 3.771 -3.724
237 HA ASP 36 HA ASP 36 -7.337 5.987 -4.894
238 HB2 ASP 36 1HB ASP 36 -8.568 5.761 -2.191
239 HB3 ASP 36 2HB ASP 36 -6.984 6.523 -2.304
240 H CYS 37 H CYS 37 -6.526 3.472 -5.361
241 HA CYS 37 HA CYS 37 -4.475 2.860 -3.351
242 HB2 CYS 37 1HB CYS 37 -5.041 1.111 -5.717
243 HB3 CYS 37 2HB CYS 37 -4.454 0.665 -4.118
244 H CYS 38 H CYS 38 -2.305 2.707 -3.886
245 HA CYS 38 HA CYS 38 -1.322 4.508 -5.787
246 HB2 CYS 38 1HB CYS 38 0.293 2.184 -4.764
247 HB3 CYS 38 2HB CYS 38 0.832 3.818 -5.141
248 H ILE 39 H ILE 39 0.381 3.794 -7.471
249 HA ILE 39 HA ILE 39 -0.982 2.300 -9.470
250 HB ILE 39 HB ILE 39 0.481 4.137 -10.094
251 HG12 ILE 39 1HG1 ILE 39 1.778 1.610 -11.104
252 HG13 ILE 39 2HG1 ILE 39 0.147 2.072 -11.576
253 HG21 ILE 39 1HG2 ILE 39 2.258 4.330 -8.704
254 HG22 ILE 39 2HG2 ILE 39 2.453 2.586 -8.533
255 HG23 ILE 39 3HG2 ILE 39 3.050 3.402 -9.977
256 HD11 ILE 39 3HD1 ILE 39 1.207 4.292 -12.297
257 HD12 ILE 39 1HD1 ILE 39 2.739 3.424 -12.199
258 HD13 ILE 39 2HD1 ILE 39 1.477 2.866 -13.299
259 H ASN 40 H ASN 40 1.391 1.515 -7.066
260 HA ASN 40 HA ASN 40 1.645 -1.186 -8.214
261 HB2 ASN 40 1HB ASN 40 3.802 -1.376 -7.138
262 HB3 ASN 40 2HB ASN 40 3.775 0.106 -8.089
263 HD21 ASN 40 1HD2 ASN 40 5.667 -0.028 -6.269
264 HD22 ASN 40 2HD2 ASN 40 5.312 0.956 -4.894
265 H TYR 41 H TYR 41 -0.554 -0.388 -6.606
266 HA TYR 41 HA TYR 41 -0.253 -1.044 -3.888
267 HB2 TYR 41 1HB TYR 41 -2.204 0.165 -4.722
268 HB3 TYR 41 2HB TYR 41 -2.700 -1.240 -5.658
269 HD1 TYR 41 HD2 TYR 41 -3.277 -3.377 -4.370
270 HD2 TYR 41 HD1 TYR 41 -2.926 0.435 -2.513
271 HE1 TYR 41 HE2 TYR 41 -4.586 -4.196 -2.456
272 HE2 TYR 41 HE1 TYR 41 -4.233 -0.374 -0.593
273 HH TYR 41 HH TYR 41 -5.100 -2.197 0.409
274 H SER 42 H SER 42 -1.941 -3.011 -6.337
275 HA SER 42 HA SER 42 -1.690 -5.388 -4.776
276 HB2 SER 42 1HB SER 42 -2.854 -6.487 -6.550
277 HB3 SER 42 2HB SER 42 -3.555 -4.875 -6.417
278 HG SER 42 HG SER 42 -1.511 -5.582 -8.254
279 H SER 43 H SER 43 -0.200 -4.273 -7.805
280 HA SER 43 HA SER 43 1.334 -6.392 -8.517
281 HB2 SER 43 1HB SER 43 1.402 -4.407 -9.851
282 HB3 SER 43 2HB SER 43 2.070 -3.461 -8.522
283 HG SER 43 HG SER 43 3.968 -4.715 -8.678
284 H VAL 44 H VAL 44 1.745 -4.390 -5.713
285 HA VAL 44 HA VAL 44 4.290 -5.714 -5.078
286 HB VAL 44 HB VAL 44 3.017 -3.287 -3.807
287 HG11 VAL 44 1HG1 VAL 44 4.340 -4.568 -2.205
288 HG12 VAL 44 2HG1 VAL 44 5.712 -4.550 -3.315
289 HG13 VAL 44 3HG1 VAL 44 5.131 -3.043 -2.605
290 HG21 VAL 44 3HG2 VAL 44 4.118 -2.011 -5.269
291 HG22 VAL 44 1HG2 VAL 44 5.602 -2.945 -5.082
292 HG23 VAL 44 2HG2 VAL 44 4.362 -3.478 -6.216
293 H CYS 45 H CYS 45 1.217 -4.788 -3.529
294 HA CYS 45 HA CYS 45 1.621 -6.348 -1.205
295 HB2 CYS 45 1HB CYS 45 -0.824 -5.119 -2.464
296 HB3 CYS 45 2HB CYS 45 -0.926 -6.079 -0.992
297 H GLN 46 H GLN 46 -0.705 -6.889 -3.858
298 HA GLN 46 HA GLN 46 -1.307 -9.534 -3.127
299 HB2 GLN 46 1HB GLN 46 -1.708 -7.881 -5.582
300 HB3 GLN 46 2HB GLN 46 -1.979 -9.617 -5.681
301 HG2 GLN 46 1HG GLN 46 -3.542 -9.385 -3.735
302 HG3 GLN 46 2HG GLN 46 -3.385 -7.638 -3.911
303 HE21 GLN 46 1HE2 GLN 46 -5.554 -7.374 -4.394
304 HE22 GLN 46 2HE2 GLN 46 -6.231 -7.855 -5.909
305 H GLY 47 H GLY 47 1.115 -8.184 -5.304
306 HA2 GLY 47 1HA GLY 47 2.742 -9.223 -6.586
307 HA3 GLY 47 2HA GLY 47 3.061 -10.031 -5.059
308 H GLU 48 H GLU 48 3.439 -12.100 -5.527
309 HA GLU 48 HA GLU 48 2.303 -13.469 -7.729
310 HB2 GLU 48 1HB GLU 48 4.474 -13.969 -6.390
311 HB3 GLU 48 2HB GLU 48 3.413 -14.874 -5.320
312 HG2 GLU 48 1HG GLU 48 3.633 -15.353 -8.281
313 HG3 GLU 48 2HG GLU 48 4.536 -16.244 -7.059
314 H LYS 49 H LYS 49 0.194 -13.872 -7.869
315 HA LYS 49 HA LYS 49 -1.133 -15.112 -5.554
316 HB2 LYS 49 1HB LYS 49 -1.856 -12.755 -5.810
317 HB3 LYS 49 2HB LYS 49 -2.388 -13.115 -7.446
318 HG2 LYS 49 1HG LYS 49 -4.217 -14.293 -6.745
319 HG3 LYS 49 2HG LYS 49 -3.474 -14.747 -5.210
320 HD2 LYS 49 1HD LYS 49 -3.666 -12.366 -4.494
321 HD3 LYS 49 2HD LYS 49 -4.567 -12.042 -5.976
322 HE2 LYS 49 1HE LYS 49 -6.400 -13.254 -5.285
323 HE3 LYS 49 2HE LYS 49 -5.455 -14.255 -4.184
324 HZ1 LYS 49 3HZ LYS 49 -7.005 -12.410 -3.259
325 HZ2 LYS 49 1HZ LYS 49 -5.720 -11.379 -3.642
326 HZ3 LYS 49 2HZ LYS 49 -5.485 -12.657 -2.559
327 H SER 50 H SER 50 -1.709 -17.113 -6.049
328 HA SER 50 HA SER 50 -2.207 -17.810 -8.851
329 HB2 SER 50 1HB SER 50 -1.644 -19.519 -6.420
330 HB3 SER 50 2HB SER 50 -2.041 -20.176 -8.007
331 HG SER 50 HG SER 50 0.323 -19.480 -7.139
332 H SER 51 H SER 51 -4.182 -18.253 -9.584
333 HA SER 51 HA SER 51 -6.315 -18.801 -7.627
334 HB2 SER 51 1HB SER 51 -6.483 -17.035 -10.080
335 HB3 SER 51 2HB SER 51 -7.861 -17.505 -9.088
336 HG SER 51 HG SER 51 -6.855 -16.449 -7.328
337 H GLY 52 H GLY 52 -7.483 -20.573 -8.017
338 HA2 GLY 52 1HA GLY 52 -8.030 -22.584 -9.010
339 HA3 GLY 52 2HA GLY 52 -8.486 -21.543 -10.351
340 HA PRO 53 HA PRO 53 -3.956 -22.927 -11.301
341 HB2 PRO 53 1HB PRO 53 -2.842 -24.743 -9.618
342 HB3 PRO 53 2HB PRO 53 -2.700 -22.997 -9.379
343 HG2 PRO 53 1HG PRO 53 -4.564 -24.941 -8.074
344 HG3 PRO 53 2HG PRO 53 -3.650 -23.608 -7.346
345 HD2 PRO 53 1HD PRO 53 -6.280 -23.406 -7.958
346 HD3 PRO 53 2HD PRO 53 -5.172 -22.020 -8.034
347 H SER 54 H SER 54 -2.953 -25.023 -12.084
348 HA SER 54 HA SER 54 -4.618 -26.519 -13.579
349 HB2 SER 54 1HB SER 54 -2.025 -27.297 -12.259
350 HB3 SER 54 2HB SER 54 -2.876 -28.407 -13.333
351 HG SER 54 HG SER 54 -2.857 -26.416 -14.792
352 H SER 55 H SER 55 -3.670 -27.293 -10.246
353 HA SER 55 HA SER 55 -5.484 -29.555 -10.172
354 HB2 SER 55 1HB SER 55 -3.479 -28.390 -8.262
355 HB3 SER 55 2HB SER 55 -4.678 -29.550 -7.690
356 HG SER 55 HG SER 55 -2.409 -30.084 -8.874
357 H GLY 56 H GLY 56 -7.449 -29.614 -9.226
358 HA2 GLY 56 1HA GLY 56 -8.472 -28.136 -7.175
359 HA3 GLY 56 2HA GLY 56 -8.711 -27.111 -8.582
Start of MODEL 20
1 H1 GLY 1 H GLY 1 14.807 8.927 5.646
2 HA2 GLY 1 1HA GLY 1 14.689 8.615 2.922
3 HA3 GLY 1 2HA GLY 1 13.861 7.559 4.057
4 H SER 2 H SER 2 13.546 10.295 1.918
5 HA SER 2 HA SER 2 10.802 9.743 1.430
6 HB2 SER 2 1HB SER 2 11.501 11.978 3.297
7 HB3 SER 2 2HB SER 2 10.134 12.169 2.199
8 HG SER 2 HG SER 2 9.326 11.265 4.038
9 H SER 3 H SER 3 10.238 10.496 -0.529
10 HA SER 3 HA SER 3 12.179 12.195 -1.915
11 HB2 SER 3 1HB SER 3 11.460 9.969 -2.881
12 HB3 SER 3 2HB SER 3 9.866 10.678 -3.134
13 HG SER 3 HG SER 3 11.254 10.822 -4.983
14 H GLY 4 H GLY 4 11.522 14.186 -0.987
15 HA2 GLY 4 1HA GLY 4 10.130 16.020 -0.662
16 HA3 GLY 4 2HA GLY 4 10.009 15.877 -2.409
17 H SER 5 H SER 5 7.973 16.072 -3.035
18 HA SER 5 HA SER 5 5.866 14.896 -1.349
19 HB2 SER 5 1HB SER 5 4.329 16.510 -2.361
20 HB3 SER 5 2HB SER 5 5.708 17.345 -1.645
21 HG SER 5 HG SER 5 5.925 16.613 -4.319
22 H SER 6 H SER 6 6.243 12.815 -2.323
23 HA SER 6 HA SER 6 4.481 12.244 -4.443
24 HB2 SER 6 1HB SER 6 6.454 13.302 -5.682
25 HB3 SER 6 2HB SER 6 7.368 11.863 -5.234
26 HG SER 6 HG SER 6 6.228 10.692 -6.599
27 H GLY 7 H GLY 7 4.790 9.900 -5.217
28 HA2 GLY 7 1HA GLY 7 6.356 8.037 -3.888
29 HA3 GLY 7 2HA GLY 7 4.910 8.244 -2.911
30 H TRP 8 H TRP 8 2.811 8.008 -4.109
31 HA TRP 8 HA TRP 8 1.426 6.472 -5.098
32 HB2 TRP 8 1HB TRP 8 3.266 7.189 -7.389
33 HB3 TRP 8 2HB TRP 8 1.717 6.372 -7.571
34 HD1 TRP 8 HD1 TRP 8 3.226 9.793 -6.791
35 HE1 TRP 8 HE1 TRP 8 1.377 11.573 -6.976
36 HE3 TRP 8 HE3 TRP 8 -0.815 6.712 -7.352
37 HZ2 TRP 8 HZ2 TRP 8 -1.424 11.661 -7.315
38 HZ3 TRP 8 HZ3 TRP 8 -3.044 7.723 -7.599
39 HH2 TRP 8 HH2 TRP 8 -3.341 10.148 -7.581
40 H THR 9 H THR 9 3.455 5.194 -3.655
41 HA THR 9 HA THR 9 3.638 2.694 -5.159
42 HB THR 9 HB THR 9 5.983 2.345 -4.365
43 HG1 THR 9 HG1 THR 9 6.300 3.807 -2.771
44 HG21 THR 9 3HG2 THR 9 6.950 4.163 -5.973
45 HG22 THR 9 1HG2 THR 9 5.252 4.491 -6.316
46 HG23 THR 9 2HG2 THR 9 5.917 2.885 -6.613
47 H CYS 10 H CYS 10 3.856 0.824 -3.849
48 HA CYS 10 HA CYS 10 3.190 1.282 -1.014
49 HB2 CYS 10 1HB CYS 10 2.307 -0.948 -2.856
50 HB3 CYS 10 2HB CYS 10 1.995 -0.910 -1.124
51 H ASN 11 H ASN 11 3.783 -0.570 0.428
52 HA ASN 11 HA ASN 11 6.207 -1.963 -0.476
53 HB2 ASN 11 1HB ASN 11 6.845 0.064 0.818
54 HB3 ASN 11 2HB ASN 11 5.936 -0.559 2.191
55 HD21 ASN 11 1HD2 ASN 11 6.940 -1.845 3.578
56 HD22 ASN 11 2HD2 ASN 11 8.493 -2.564 3.334
57 H LYS 12 H LYS 12 6.767 -3.838 0.820
58 HA LYS 12 HA LYS 12 4.723 -5.616 1.224
59 HB2 LYS 12 1HB LYS 12 7.519 -5.449 2.257
60 HB3 LYS 12 2HB LYS 12 6.454 -6.681 2.919
61 HG2 LYS 12 1HG LYS 12 7.558 -7.764 1.187
62 HG3 LYS 12 2HG LYS 12 5.999 -7.328 0.484
63 HD2 LYS 12 1HD LYS 12 6.945 -5.509 -0.709
64 HD3 LYS 12 2HD LYS 12 8.458 -5.615 0.195
65 HE2 LYS 12 1HE LYS 12 8.738 -6.544 -2.028
66 HE3 LYS 12 2HE LYS 12 8.889 -7.812 -0.813
67 HZ1 LYS 12 3HZ LYS 12 6.893 -8.746 -1.407
68 HZ2 LYS 12 1HZ LYS 12 7.450 -8.204 -2.911
69 HZ3 LYS 12 2HZ LYS 12 6.280 -7.316 -2.073
70 H PHE 13 H PHE 13 6.300 -3.607 3.699
71 HA PHE 13 HA PHE 13 4.770 -4.516 5.874
72 HB2 PHE 13 1HB PHE 13 6.934 -3.061 5.814
73 HB3 PHE 13 2HB PHE 13 5.814 -1.705 5.725
74 HD1 PHE 13 HD1 PHE 13 6.790 -4.628 7.773
75 HD2 PHE 13 HD2 PHE 13 4.732 -0.904 7.642
76 HE1 PHE 13 HE1 PHE 13 6.534 -4.686 10.220
77 HE2 PHE 13 HE2 PHE 13 4.475 -0.956 10.088
78 HZ PHE 13 HZ PHE 13 5.377 -2.850 11.380
79 H ARG 14 H ARG 14 4.404 -1.573 3.896
80 HA ARG 14 HA ARG 14 2.217 -0.426 5.029
81 HB2 ARG 14 1HB ARG 14 2.905 -0.718 2.105
82 HB3 ARG 14 2HB ARG 14 1.575 0.284 2.674
83 HG2 ARG 14 1HG ARG 14 3.382 1.391 4.169
84 HG3 ARG 14 2HG ARG 14 4.514 0.667 3.024
85 HD2 ARG 14 1HD ARG 14 3.995 2.928 2.344
86 HD3 ARG 14 2HD ARG 14 3.324 1.786 1.180
87 HE ARG 14 HE ARG 14 1.231 2.195 2.782
88 HH11 ARG 14 1HH1 ARG 14 3.458 4.431 1.312
89 HH12 ARG 14 2HH1 ARG 14 2.299 5.714 1.199
90 HH21 ARG 14 1HH2 ARG 14 -0.304 3.877 2.639
91 HH22 ARG 14 2HH2 ARG 14 0.160 5.398 1.955
92 H CYS 15 H CYS 15 2.137 -3.013 2.585
93 HA CYS 15 HA CYS 15 -0.447 -3.398 2.064
94 HB2 CYS 15 1HB CYS 15 1.400 -5.623 2.959
95 HB3 CYS 15 2HB CYS 15 -0.060 -5.822 1.994
96 H GLY 16 H GLY 16 -2.157 -3.106 3.343
97 HA2 GLY 16 1HA GLY 16 -3.702 -3.936 4.925
98 HA3 GLY 16 2HA GLY 16 -2.385 -4.766 5.741
99 H GLU 17 H GLU 17 -2.552 -1.361 4.791
100 HA GLU 17 HA GLU 17 -1.772 -0.554 7.442
101 HB2 GLU 17 1HB GLU 17 -1.633 1.667 6.551
102 HB3 GLU 17 2HB GLU 17 -0.955 0.564 5.360
103 HG2 GLU 17 1HG GLU 17 -2.794 0.774 3.940
104 HG3 GLU 17 2HG GLU 17 -3.809 1.457 5.209
105 H LYS 18 H LYS 18 -3.044 1.694 8.047
106 HA LYS 18 HA LYS 18 -5.824 0.824 8.452
107 HB2 LYS 18 1HB LYS 18 -5.846 2.113 10.468
108 HB3 LYS 18 2HB LYS 18 -4.375 1.149 10.474
109 HG2 LYS 18 1HG LYS 18 -4.202 3.890 9.365
110 HG3 LYS 18 2HG LYS 18 -4.395 3.722 11.112
111 HD2 LYS 18 1HD LYS 18 -2.345 2.756 11.382
112 HD3 LYS 18 2HD LYS 18 -2.364 2.012 9.781
113 HE2 LYS 18 1HE LYS 18 -0.768 3.639 9.492
114 HE3 LYS 18 2HE LYS 18 -2.216 4.492 8.959
115 HZ1 LYS 18 3HZ LYS 18 -2.080 5.923 10.649
116 HZ2 LYS 18 1HZ LYS 18 -0.483 5.391 10.820
117 HZ3 LYS 18 2HZ LYS 18 -1.702 4.723 11.781
118 H ARG 19 H ARG 19 -7.470 2.537 8.555
119 HA ARG 19 HA ARG 19 -7.887 3.934 6.326
120 HB2 ARG 19 1HB ARG 19 -9.548 3.879 8.076
121 HB3 ARG 19 2HB ARG 19 -8.537 4.863 9.126
122 HG2 ARG 19 1HG ARG 19 -9.955 6.464 8.372
123 HG3 ARG 19 2HG ARG 19 -8.725 6.563 7.111
124 HD2 ARG 19 1HD ARG 19 -10.662 6.462 5.865
125 HD3 ARG 19 2HD ARG 19 -10.188 4.765 5.925
126 HE ARG 19 HE ARG 19 -11.817 4.937 8.034
127 HH11 ARG 19 1HH1 ARG 19 -12.169 6.080 4.764
128 HH12 ARG 19 2HH1 ARG 19 -13.894 5.920 4.756
129 HH21 ARG 19 1HH2 ARG 19 -14.087 4.724 8.036
130 HH22 ARG 19 2HH2 ARG 19 -14.984 5.150 6.617
131 H LEU 20 H LEU 20 -7.424 5.930 5.427
132 HA LEU 20 HA LEU 20 -5.641 7.761 6.796
133 HB2 LEU 20 1HB LEU 20 -3.934 7.727 5.082
134 HB3 LEU 20 2HB LEU 20 -4.105 6.134 5.815
135 HG LEU 20 HG LEU 20 -5.430 6.815 3.207
136 HD11 LEU 20 1HD1 LEU 20 -3.050 7.297 2.956
137 HD12 LEU 20 2HD1 LEU 20 -3.511 5.851 2.058
138 HD13 LEU 20 3HD1 LEU 20 -2.655 5.700 3.593
139 HD21 LEU 20 3HD2 LEU 20 -5.599 4.636 4.887
140 HD22 LEU 20 1HD2 LEU 20 -4.431 4.124 3.667
141 HD23 LEU 20 2HD2 LEU 20 -6.036 4.669 3.177
142 H THR 21 H THR 21 -6.080 9.803 6.245
143 HA THR 21 HA THR 21 -7.883 10.247 3.973
144 HB THR 21 HB THR 21 -7.236 12.134 6.245
145 HG1 THR 21 HG1 THR 21 -9.454 11.486 6.867
146 HG21 THR 21 3HG2 THR 21 -9.692 12.301 4.565
147 HG22 THR 21 1HG2 THR 21 -8.175 12.904 3.900
148 HG23 THR 21 2HG2 THR 21 -8.809 13.579 5.400
149 H ARG 22 H ARG 22 -5.239 12.035 5.574
150 HA ARG 22 HA ARG 22 -4.657 13.584 3.262
151 HB2 ARG 22 1HB ARG 22 -3.358 13.173 5.925
152 HB3 ARG 22 2HB ARG 22 -2.457 13.983 4.649
153 HG2 ARG 22 1HG ARG 22 -3.409 15.767 5.716
154 HG3 ARG 22 2HG ARG 22 -4.609 15.451 4.462
155 HD2 ARG 22 1HD ARG 22 -6.000 14.259 6.018
156 HD3 ARG 22 2HD ARG 22 -4.760 14.359 7.267
157 HE ARG 22 HE ARG 22 -5.366 16.960 6.528
158 HH11 ARG 22 1HH1 ARG 22 -7.000 14.235 7.950
159 HH12 ARG 22 2HH1 ARG 22 -8.103 15.207 8.865
160 HH21 ARG 22 1HH2 ARG 22 -6.811 18.252 7.729
161 HH22 ARG 22 2HH2 ARG 22 -7.995 17.493 8.739
162 H SER 23 H SER 23 -4.428 11.922 1.653
163 HA SER 23 HA SER 23 -1.728 11.246 1.135
164 HB2 SER 23 1HB SER 23 -3.498 9.133 2.299
165 HB3 SER 23 2HB SER 23 -2.330 8.677 1.059
166 HG SER 23 HG SER 23 -0.948 8.650 2.633
167 H LEU 24 H LEU 24 -1.433 10.886 -1.001
168 HA LEU 24 HA LEU 24 -3.447 11.454 -2.831
169 HB2 LEU 24 1HB LEU 24 -0.907 9.897 -3.296
170 HB3 LEU 24 2HB LEU 24 -1.899 10.643 -4.547
171 HG LEU 24 HG LEU 24 -0.456 12.164 -2.376
172 HD11 LEU 24 1HD1 LEU 24 1.355 12.378 -3.695
173 HD12 LEU 24 2HD1 LEU 24 0.408 12.380 -5.182
174 HD13 LEU 24 3HD1 LEU 24 0.785 10.856 -4.379
175 HD21 LEU 24 3HD2 LEU 24 -2.587 12.926 -3.961
176 HD22 LEU 24 1HD2 LEU 24 -1.182 13.560 -4.817
177 HD23 LEU 24 2HD2 LEU 24 -1.462 14.004 -3.133
178 H CYS 25 H CYS 25 -1.978 8.280 -2.126
179 HA CYS 25 HA CYS 25 -4.478 7.031 -3.060
180 HB2 CYS 25 1HB CYS 25 -3.200 5.176 -3.959
181 HB3 CYS 25 2HB CYS 25 -2.614 6.680 -4.659
182 H ALA 26 H ALA 26 -4.339 4.550 -2.303
183 HA ALA 26 HA ALA 26 -3.474 4.481 0.504
184 HB1 ALA 26 3HB ALA 26 -5.667 3.211 0.944
185 HB2 ALA 26 1HB ALA 26 -5.731 4.967 0.800
186 HB3 ALA 26 2HB ALA 26 -6.228 3.952 -0.555
187 H CYS 27 H CYS 27 -2.466 2.651 1.060
188 HA CYS 27 HA CYS 27 -2.400 0.475 -0.903
189 HB2 CYS 27 1HB CYS 27 -0.580 1.089 1.435
190 HB3 CYS 27 2HB CYS 27 -0.386 -0.279 0.344
191 H SER 28 H SER 28 -4.716 0.684 0.663
192 HA SER 28 HA SER 28 -4.491 -1.767 2.276
193 HB2 SER 28 1HB SER 28 -5.834 -0.897 4.001
194 HB3 SER 28 2HB SER 28 -4.736 0.428 3.615
195 HG SER 28 HG SER 28 -7.448 0.290 3.381
196 H ASP 29 H ASP 29 -6.745 -2.710 2.696
197 HA ASP 29 HA ASP 29 -7.905 -3.434 0.271
198 HB2 ASP 29 1HB ASP 29 -9.542 -4.600 1.537
199 HB3 ASP 29 2HB ASP 29 -8.066 -4.648 2.496
200 H ASP 30 H ASP 30 -8.806 -0.918 2.566
201 HA ASP 30 HA ASP 30 -11.292 -0.175 1.758
202 HB2 ASP 30 1HB ASP 30 -9.632 0.920 3.467
203 HB3 ASP 30 2HB ASP 30 -9.236 1.976 2.115
204 H CYS 31 H CYS 31 -8.243 0.752 0.188
205 HA CYS 31 HA CYS 31 -9.079 2.478 -1.736
206 HB2 CYS 31 1HB CYS 31 -7.135 1.997 -2.897
207 HB3 CYS 31 2HB CYS 31 -6.740 1.375 -1.297
208 H LYS 32 H LYS 32 -9.513 -1.015 -1.714
209 HA LYS 32 HA LYS 32 -10.351 -1.457 -4.310
210 HB2 LYS 32 1HB LYS 32 -11.261 -2.736 -1.731
211 HB3 LYS 32 2HB LYS 32 -11.732 -3.329 -3.318
212 HG2 LYS 32 1HG LYS 32 -8.841 -2.981 -2.662
213 HG3 LYS 32 2HG LYS 32 -9.720 -4.397 -2.078
214 HD2 LYS 32 1HD LYS 32 -10.176 -5.149 -4.252
215 HD3 LYS 32 2HD LYS 32 -9.798 -3.581 -4.967
216 HE2 LYS 32 1HE LYS 32 -7.906 -4.776 -5.493
217 HE3 LYS 32 2HE LYS 32 -7.424 -4.032 -3.969
218 HZ1 LYS 32 3HZ LYS 32 -7.960 -6.823 -4.581
219 HZ2 LYS 32 1HZ LYS 32 -8.502 -6.278 -3.074
220 HZ3 LYS 32 2HZ LYS 32 -6.867 -6.145 -3.483
221 H ASP 33 H ASP 33 -12.272 -0.393 -1.525
222 HA ASP 33 HA ASP 33 -14.755 -0.329 -2.872
223 HB2 ASP 33 1HB ASP 33 -14.551 -0.342 -0.412
224 HB3 ASP 33 2HB ASP 33 -13.859 1.277 -0.468
225 H GLN 34 H GLN 34 -12.697 2.410 -1.868
226 HA GLN 34 HA GLN 34 -14.062 4.361 -3.326
227 HB2 GLN 34 1HB GLN 34 -11.217 4.217 -2.343
228 HB3 GLN 34 2HB GLN 34 -11.861 5.638 -3.155
229 HG2 GLN 34 1HG GLN 34 -13.704 5.566 -1.369
230 HG3 GLN 34 2HG GLN 34 -12.614 4.488 -0.499
231 HE21 GLN 34 1HE2 GLN 34 -11.070 5.357 0.714
232 HE22 GLN 34 2HE2 GLN 34 -10.620 7.025 0.717
233 H GLY 35 H GLY 35 -10.891 2.930 -4.149
234 HA2 GLY 35 1HA GLY 35 -10.630 1.963 -6.398
235 HA3 GLY 35 2HA GLY 35 -11.607 3.297 -6.993
236 H ASP 36 H ASP 36 -9.159 3.757 -4.552
237 HA ASP 36 HA ASP 36 -7.503 5.152 -6.552
238 HB2 ASP 36 1HB ASP 36 -8.098 5.872 -3.682
239 HB3 ASP 36 2HB ASP 36 -6.771 6.593 -4.590
240 H CYS 37 H CYS 37 -7.139 2.444 -6.050
241 HA CYS 37 HA CYS 37 -5.158 1.961 -4.066
242 HB2 CYS 37 1HB CYS 37 -5.696 0.326 -6.550
243 HB3 CYS 37 2HB CYS 37 -4.939 -0.223 -5.059
244 H CYS 38 H CYS 38 -3.102 2.548 -4.098
245 HA CYS 38 HA CYS 38 -1.793 4.003 -5.969
246 HB2 CYS 38 1HB CYS 38 -0.404 1.859 -4.359
247 HB3 CYS 38 2HB CYS 38 0.276 3.378 -4.934
248 H ILE 39 H ILE 39 -0.740 3.700 -7.859
249 HA ILE 39 HA ILE 39 -1.351 1.684 -9.592
250 HB ILE 39 HB ILE 39 -0.259 3.729 -10.329
251 HG12 ILE 39 1HG1 ILE 39 1.620 1.503 -11.078
252 HG13 ILE 39 2HG1 ILE 39 -0.067 1.462 -11.579
253 HG21 ILE 39 1HG2 ILE 39 2.451 2.825 -9.597
254 HG22 ILE 39 2HG2 ILE 39 1.772 4.451 -9.660
255 HG23 ILE 39 3HG2 ILE 39 1.445 3.411 -8.273
256 HD11 ILE 39 3HD1 ILE 39 2.066 2.732 -12.853
257 HD12 ILE 39 1HD1 ILE 39 0.354 2.830 -13.260
258 HD13 ILE 39 2HD1 ILE 39 1.071 4.022 -12.176
259 H ASN 40 H ASN 40 1.212 1.728 -7.193
260 HA ASN 40 HA ASN 40 2.037 -0.967 -8.031
261 HB2 ASN 40 1HB ASN 40 3.667 1.083 -7.661
262 HB3 ASN 40 2HB ASN 40 3.539 0.596 -5.973
263 HD21 ASN 40 1HD2 ASN 40 5.760 0.083 -6.009
264 HD22 ASN 40 2HD2 ASN 40 6.323 -1.384 -6.727
265 H TYR 41 H TYR 41 -0.398 -0.719 -6.689
266 HA TYR 41 HA TYR 41 0.051 -1.344 -3.894
267 HB2 TYR 41 1HB TYR 41 -1.887 -0.017 -4.376
268 HB3 TYR 41 2HB TYR 41 -2.451 -1.173 -5.577
269 HD1 TYR 41 HD1 TYR 41 -1.446 -1.241 -1.970
270 HD2 TYR 41 HD2 TYR 41 -4.249 -2.452 -4.933
271 HE1 TYR 41 HE1 TYR 41 -2.772 -2.381 -0.241
272 HE2 TYR 41 HE2 TYR 41 -5.584 -3.594 -3.212
273 HH TYR 41 HH TYR 41 -4.685 -3.441 0.213
274 H SER 42 H SER 42 -1.794 -3.007 -6.455
275 HA SER 42 HA SER 42 -1.691 -5.519 -5.144
276 HB2 SER 42 1HB SER 42 -2.601 -6.412 -7.277
277 HB3 SER 42 2HB SER 42 -3.488 -5.000 -6.703
278 HG SER 42 HG SER 42 -1.349 -4.644 -8.482
279 H SER 43 H SER 43 0.309 -3.962 -7.558
280 HA SER 43 HA SER 43 1.724 -6.174 -8.507
281 HB2 SER 43 1HB SER 43 2.695 -3.330 -8.132
282 HB3 SER 43 2HB SER 43 3.486 -4.553 -9.126
283 HG SER 43 HG SER 43 1.996 -3.037 -10.214
284 H VAL 44 H VAL 44 2.298 -4.119 -5.685
285 HA VAL 44 HA VAL 44 4.627 -5.686 -4.920
286 HB VAL 44 HB VAL 44 3.315 -3.344 -3.532
287 HG11 VAL 44 1HG1 VAL 44 5.013 -3.347 -1.971
288 HG12 VAL 44 2HG1 VAL 44 4.735 -5.075 -2.197
289 HG13 VAL 44 3HG1 VAL 44 6.097 -4.288 -2.996
290 HG21 VAL 44 3HG2 VAL 44 5.947 -3.298 -4.965
291 HG22 VAL 44 1HG2 VAL 44 4.434 -3.028 -5.830
292 HG23 VAL 44 2HG2 VAL 44 4.903 -1.951 -4.515
293 H CYS 45 H CYS 45 1.475 -4.818 -3.499
294 HA CYS 45 HA CYS 45 1.721 -6.631 -1.320
295 HB2 CYS 45 1HB CYS 45 -0.674 -5.207 -2.490
296 HB3 CYS 45 2HB CYS 45 -0.733 -6.174 -1.021
297 H GLN 46 H GLN 46 -0.655 -6.694 -3.980
298 HA GLN 46 HA GLN 46 -1.028 -9.536 -3.624
299 HB2 GLN 46 1HB GLN 46 -2.292 -7.437 -5.352
300 HB3 GLN 46 2HB GLN 46 -2.560 -9.141 -5.695
301 HG2 GLN 46 1HG GLN 46 -3.019 -8.114 -2.936
302 HG3 GLN 46 2HG GLN 46 -4.219 -7.811 -4.191
303 HE21 GLN 46 1HE2 GLN 46 -5.509 -9.114 -2.636
304 HE22 GLN 46 2HE2 GLN 46 -5.497 -10.831 -2.827
305 H GLY 47 H GLY 47 1.591 -9.024 -4.322
306 HA2 GLY 47 1HA GLY 47 1.724 -10.413 -6.896
307 HA3 GLY 47 2HA GLY 47 2.606 -8.900 -6.743
308 H GLU 48 H GLU 48 4.043 -8.827 -4.702
309 HA GLU 48 HA GLU 48 5.828 -9.636 -3.543
310 HB2 GLU 48 1HB GLU 48 4.081 -11.315 -2.769
311 HB3 GLU 48 2HB GLU 48 4.718 -12.404 -3.993
312 HG2 GLU 48 1HG GLU 48 5.768 -13.031 -2.003
313 HG3 GLU 48 2HG GLU 48 6.976 -12.103 -2.890
314 H LYS 49 H LYS 49 6.230 -9.071 -6.179
315 HA LYS 49 HA LYS 49 8.088 -11.196 -7.027
316 HB2 LYS 49 1HB LYS 49 5.953 -10.614 -8.461
317 HB3 LYS 49 2HB LYS 49 6.943 -9.262 -9.000
318 HG2 LYS 49 1HG LYS 49 8.629 -10.762 -9.831
319 HG3 LYS 49 2HG LYS 49 7.766 -12.154 -9.170
320 HD2 LYS 49 1HD LYS 49 6.398 -10.327 -11.103
321 HD3 LYS 49 2HD LYS 49 7.521 -11.554 -11.694
322 HE2 LYS 49 1HE LYS 49 5.271 -12.222 -9.820
323 HE3 LYS 49 2HE LYS 49 5.046 -12.177 -11.567
324 HZ1 LYS 49 3HZ LYS 49 5.900 -14.319 -10.138
325 HZ2 LYS 49 1HZ LYS 49 7.342 -13.700 -10.768
326 HZ3 LYS 49 2HZ LYS 49 6.076 -14.121 -11.808
327 H SER 50 H SER 50 9.661 -10.074 -5.685
328 HA SER 50 HA SER 50 10.569 -7.497 -6.749
329 HB2 SER 50 1HB SER 50 10.273 -7.543 -4.342
330 HB3 SER 50 2HB SER 50 11.298 -8.972 -4.208
331 HG SER 50 HG SER 50 13.057 -7.771 -4.634
332 H SER 51 H SER 51 11.422 -8.483 -8.686
333 HA SER 51 HA SER 51 13.793 -10.160 -8.312
334 HB2 SER 51 1HB SER 51 12.170 -10.942 -9.965
335 HB3 SER 51 2HB SER 51 12.287 -9.410 -10.830
336 HG SER 51 HG SER 51 14.462 -9.896 -11.268
337 H GLY 52 H GLY 52 12.807 -7.200 -10.034
338 HA2 GLY 52 1HA GLY 52 15.534 -6.174 -9.653
339 HA3 GLY 52 2HA GLY 52 14.859 -6.195 -11.275
340 HA PRO 53 HA PRO 53 13.031 -2.693 -8.418
341 HB2 PRO 53 1HB PRO 53 15.113 -1.140 -7.634
342 HB3 PRO 53 2HB PRO 53 14.479 -2.463 -6.650
343 HG2 PRO 53 1HG PRO 53 16.873 -2.418 -8.448
344 HG3 PRO 53 2HG PRO 53 16.703 -3.120 -6.828
345 HD2 PRO 53 1HD PRO 53 16.589 -4.615 -9.083
346 HD3 PRO 53 2HD PRO 53 15.664 -5.018 -7.622
347 H SER 54 H SER 54 14.903 -3.080 -11.097
348 HA SER 54 HA SER 54 15.476 -0.487 -11.970
349 HB2 SER 54 1HB SER 54 16.088 -2.836 -12.980
350 HB3 SER 54 2HB SER 54 14.617 -2.593 -13.921
351 HG SER 54 HG SER 54 16.512 -1.787 -14.967
352 H SER 55 H SER 55 13.939 1.050 -11.807
353 HA SER 55 HA SER 55 11.321 0.515 -13.043
354 HB2 SER 55 1HB SER 55 12.172 2.353 -10.818
355 HB3 SER 55 2HB SER 55 10.676 2.643 -11.706
356 HG SER 55 HG SER 55 9.989 1.334 -10.157
357 H GLY 56 H GLY 56 11.121 1.306 -15.025
358 HA2 GLY 56 1HA GLY 56 11.346 2.669 -16.860
359 HA3 GLY 56 2HA GLY 56 11.361 3.990 -15.702