Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
504777 | 2en1 RC | 10230 | cing | 1-original | 5 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 H1 GLY 1 H GLY 1 1.173 10.363 19.222
2 HA2 GLY 1 1HA GLY 1 2.266 9.710 17.201
3 HA3 GLY 1 2HA GLY 1 0.784 10.063 16.324
4 H SER 2 H SER 2 3.805 11.247 17.351
5 HA SER 2 HA SER 2 3.151 13.891 16.226
6 HB2 SER 2 1HB SER 2 4.580 14.965 17.815
7 HB3 SER 2 2HB SER 2 3.530 13.886 18.732
8 HG SER 2 HG SER 2 5.347 12.335 18.517
9 H SER 3 H SER 3 4.119 14.076 14.324
10 HA SER 3 HA SER 3 5.586 13.711 12.599
11 HB2 SER 3 1HB SER 3 6.653 15.542 13.879
12 HB3 SER 3 2HB SER 3 7.562 14.348 14.805
13 HG SER 3 HG SER 3 8.683 15.296 12.961
14 H GLY 4 H GLY 4 4.813 11.291 13.715
15 HA2 GLY 4 1HA GLY 4 6.882 9.588 14.521
16 HA3 GLY 4 2HA GLY 4 5.397 9.072 13.735
17 H SER 5 H SER 5 5.726 10.389 11.272
18 HA SER 5 HA SER 5 8.157 9.118 10.200
19 HB2 SER 5 1HB SER 5 5.313 8.803 9.341
20 HB3 SER 5 2HB SER 5 6.567 8.786 8.101
21 HG SER 5 HG SER 5 5.999 6.697 9.063
22 H SER 6 H SER 6 9.129 11.205 10.241
23 HA SER 6 HA SER 6 8.030 13.463 8.946
24 HB2 SER 6 1HB SER 6 10.272 14.425 9.123
25 HB3 SER 6 2HB SER 6 9.839 13.609 10.625
26 HG SER 6 HG SER 6 12.013 13.227 9.446
27 H GLY 7 H GLY 7 10.427 11.056 7.887
28 HA2 GLY 7 1HA GLY 7 9.849 10.439 5.433
29 HA3 GLY 7 2HA GLY 7 10.235 12.131 5.158
30 H SER 8 H SER 8 11.510 8.990 6.000
31 HA SER 8 HA SER 8 14.196 9.972 5.310
32 HB2 SER 8 1HB SER 8 13.522 8.041 7.544
33 HB3 SER 8 2HB SER 8 15.153 8.464 7.024
34 HG SER 8 HG SER 8 13.956 9.660 8.871
35 H GLY 9 H GLY 9 14.760 9.018 3.472
36 HA2 GLY 9 1HA GLY 9 15.473 7.174 2.203
37 HA3 GLY 9 2HA GLY 9 14.545 6.118 3.257
38 H GLU 10 H GLU 10 14.733 6.756 0.212
39 HA GLU 10 HA GLU 10 11.831 7.003 -0.228
40 HB2 GLU 10 1HB GLU 10 14.194 7.953 -1.780
41 HB3 GLU 10 2HB GLU 10 12.750 7.489 -2.670
42 HG2 GLU 10 1HG GLU 10 12.668 9.835 -2.293
43 HG3 GLU 10 2HG GLU 10 11.449 9.075 -1.272
44 H LYS 11 H LYS 11 10.807 5.584 -1.644
45 HA LYS 11 HA LYS 11 12.350 3.158 -2.290
46 HB2 LYS 11 1HB LYS 11 9.598 3.569 -1.231
47 HB3 LYS 11 2HB LYS 11 9.852 2.222 -2.333
48 HG2 LYS 11 1HG LYS 11 11.273 1.125 -0.876
49 HG3 LYS 11 2HG LYS 11 11.658 2.598 0.018
50 HD2 LYS 11 1HD LYS 11 9.152 2.582 0.660
51 HD3 LYS 11 2HD LYS 11 9.196 0.892 0.154
52 HE2 LYS 11 1HE LYS 11 11.023 2.126 2.212
53 HE3 LYS 11 2HE LYS 11 9.568 1.203 2.584
54 HZ1 LYS 11 3HZ LYS 11 12.073 0.241 1.340
55 HZ2 LYS 11 1HZ LYS 11 10.633 -0.643 1.249
56 HZ3 LYS 11 2HZ LYS 11 11.326 -0.308 2.755
57 HA PRO 12 HA PRO 12 11.531 4.205 -6.523
58 HB2 PRO 12 1HB PRO 12 12.492 1.908 -7.604
59 HB3 PRO 12 2HB PRO 12 13.540 3.193 -6.992
60 HG2 PRO 12 1HG PRO 12 12.710 0.638 -5.673
61 HG3 PRO 12 2HG PRO 12 14.308 1.404 -5.720
62 HD2 PRO 12 1HD PRO 12 12.665 1.592 -3.576
63 HD3 PRO 12 2HD PRO 12 13.784 2.891 -4.039
64 H PHE 13 H PHE 13 10.145 1.640 -4.736
65 HA PHE 13 HA PHE 13 8.214 1.125 -6.902
66 HB2 PHE 13 1HB PHE 13 8.950 -0.709 -4.611
67 HB3 PHE 13 2HB PHE 13 7.826 -1.074 -5.915
68 HD1 PHE 13 HD1 PHE 13 11.341 -0.688 -4.990
69 HD2 PHE 13 HD2 PHE 13 8.619 -1.625 -8.125
70 HE1 PHE 13 HE1 PHE 13 13.196 -1.602 -6.323
71 HE2 PHE 13 HE2 PHE 13 10.469 -2.541 -9.463
72 HZ PHE 13 HZ PHE 13 12.761 -2.531 -8.562
73 H LYS 14 H LYS 14 6.136 1.594 -6.543
74 HA LYS 14 HA LYS 14 5.187 1.923 -3.792
75 HB2 LYS 14 1HB LYS 14 5.832 4.160 -4.525
76 HB3 LYS 14 2HB LYS 14 4.856 3.987 -5.978
77 HG2 LYS 14 1HG LYS 14 2.870 3.688 -4.418
78 HG3 LYS 14 2HG LYS 14 3.936 4.269 -3.136
79 HD2 LYS 14 1HD LYS 14 4.353 6.314 -4.466
80 HD3 LYS 14 2HD LYS 14 3.194 5.737 -5.667
81 HE2 LYS 14 1HE LYS 14 1.391 6.106 -4.302
82 HE3 LYS 14 2HE LYS 14 2.329 5.894 -2.824
83 HZ1 LYS 14 3HZ LYS 14 1.923 8.283 -4.439
84 HZ2 LYS 14 1HZ LYS 14 3.462 8.083 -3.766
85 HZ3 LYS 14 2HZ LYS 14 2.100 8.125 -2.764
86 H CYS 15 H CYS 15 3.257 1.014 -3.481
87 HA CYS 15 HA CYS 15 1.920 -0.294 -5.642
88 HB2 CYS 15 1HB CYS 15 2.051 -1.188 -3.304
89 HB3 CYS 15 2HB CYS 15 0.944 0.087 -2.806
90 H GLU 16 H GLU 16 0.953 1.018 -7.092
91 HA GLU 16 HA GLU 16 -0.286 3.468 -6.539
92 HB2 GLU 16 1HB GLU 16 -0.885 1.575 -8.819
93 HB3 GLU 16 2HB GLU 16 -1.263 3.291 -8.769
94 HG2 GLU 16 1HG GLU 16 1.278 3.606 -8.446
95 HG3 GLU 16 2HG GLU 16 1.394 1.954 -9.052
96 H GLU 17 H GLU 17 -1.398 0.223 -6.170
97 HA GLU 17 HA GLU 17 -4.159 0.544 -6.338
98 HB2 GLU 17 1HB GLU 17 -2.714 -1.251 -4.385
99 HB3 GLU 17 2HB GLU 17 -4.341 -1.463 -5.014
100 HG2 GLU 17 1HG GLU 17 -3.152 -1.540 -7.322
101 HG3 GLU 17 2HG GLU 17 -1.719 -1.905 -6.363
102 H CYS 18 H CYS 18 -2.066 0.792 -3.465
103 HA CYS 18 HA CYS 18 -4.202 2.354 -2.165
104 HB2 CYS 18 1HB CYS 18 -3.334 1.530 -0.005
105 HB3 CYS 18 2HB CYS 18 -3.893 0.218 -1.036
106 H GLY 19 H GLY 19 -0.716 1.947 -2.584
107 HA2 GLY 19 1HA GLY 19 0.414 4.146 -3.064
108 HA3 GLY 19 2HA GLY 19 -0.356 4.705 -1.587
109 H LYS 20 H LYS 20 0.670 1.461 -1.495
110 HA LYS 20 HA LYS 20 2.473 1.916 0.625
111 HB2 LYS 20 1HB LYS 20 1.644 -0.417 -1.014
112 HB3 LYS 20 2HB LYS 20 3.176 -0.554 -0.160
113 HG2 LYS 20 1HG LYS 20 1.719 0.313 1.865
114 HG3 LYS 20 2HG LYS 20 0.412 -0.387 0.907
115 HD2 LYS 20 1HD LYS 20 1.030 -2.206 2.162
116 HD3 LYS 20 2HD LYS 20 2.063 -2.429 0.748
117 HE2 LYS 20 1HE LYS 20 3.964 -1.690 1.871
118 HE3 LYS 20 2HE LYS 20 3.025 -0.870 3.118
119 HZ1 LYS 20 3HZ LYS 20 2.597 -3.721 2.978
120 HZ2 LYS 20 1HZ LYS 20 2.858 -2.730 4.324
121 HZ3 LYS 20 2HZ LYS 20 4.171 -3.279 3.411
122 H ARG 21 H ARG 21 4.746 0.665 0.379
123 HA ARG 21 HA ARG 21 6.091 1.419 -2.089
124 HB2 ARG 21 1HB ARG 21 6.968 2.496 0.598
125 HB3 ARG 21 2HB ARG 21 7.824 2.706 -0.924
126 HG2 ARG 21 1HG ARG 21 5.561 3.768 -1.700
127 HG3 ARG 21 2HG ARG 21 5.315 3.987 0.034
128 HD2 ARG 21 1HD ARG 21 7.778 4.933 -0.097
129 HD3 ARG 21 2HD ARG 21 7.329 5.219 -1.778
130 HE ARG 21 HE ARG 21 5.437 6.194 0.178
131 HH11 ARG 21 1HH1 ARG 21 8.225 6.910 -1.780
132 HH12 ARG 21 2HH1 ARG 21 7.977 8.624 -1.737
133 HH21 ARG 21 1HH2 ARG 21 5.100 8.449 0.241
134 HH22 ARG 21 2HH2 ARG 21 6.200 9.498 -0.587
135 H PHE 22 H PHE 22 8.217 0.499 -2.292
136 HA PHE 22 HA PHE 22 9.116 -1.379 -0.288
137 HB2 PHE 22 1HB PHE 22 8.493 -2.477 -3.024
138 HB3 PHE 22 2HB PHE 22 8.904 -3.365 -1.561
139 HD1 PHE 22 HD2 PHE 22 6.278 -1.232 -3.079
140 HD2 PHE 22 HD1 PHE 22 7.236 -4.166 -0.148
141 HE1 PHE 22 HE2 PHE 22 3.884 -1.514 -2.583
142 HE2 PHE 22 HE1 PHE 22 4.844 -4.453 0.352
143 HZ PHE 22 HZ PHE 22 3.165 -3.125 -0.866
144 H THR 23 H THR 23 11.233 -2.189 -0.691
145 HA THR 23 HA THR 23 12.850 -0.360 -2.225
146 HB THR 23 HB THR 23 13.504 -1.290 0.038
147 HG1 THR 23 HG1 THR 23 15.531 -0.906 -0.526
148 HG21 THR 23 3HG2 THR 23 14.197 -3.465 0.318
149 HG22 THR 23 1HG2 THR 23 14.569 -3.682 -1.391
150 HG23 THR 23 2HG2 THR 23 12.892 -3.694 -0.845
151 H GLN 24 H GLN 24 11.270 -3.255 -2.879
152 HA GLN 24 HA GLN 24 12.763 -3.550 -5.368
153 HB2 GLN 24 1HB GLN 24 12.658 -5.548 -3.185
154 HB3 GLN 24 2HB GLN 24 12.413 -6.166 -4.813
155 HG2 GLN 24 1HG GLN 24 14.804 -4.708 -3.731
156 HG3 GLN 24 2HG GLN 24 14.717 -6.363 -4.332
157 HE21 GLN 24 1HE2 GLN 24 13.209 -5.887 -6.642
158 HE22 GLN 24 2HE2 GLN 24 14.183 -4.996 -7.756
159 H ASN 25 H ASN 25 11.608 -4.694 -7.015
160 HA ASN 25 HA ASN 25 8.845 -4.124 -7.056
161 HB2 ASN 25 1HB ASN 25 8.881 -4.828 -9.252
162 HB3 ASN 25 2HB ASN 25 10.590 -4.485 -9.003
163 HD21 ASN 25 1HD2 ASN 25 11.940 -6.336 -8.341
164 HD22 ASN 25 2HD2 ASN 25 11.580 -7.885 -9.016
165 H SER 26 H SER 26 10.622 -7.182 -6.725
166 HA SER 26 HA SER 26 8.587 -9.001 -6.731
167 HB2 SER 26 1HB SER 26 11.021 -8.941 -4.935
168 HB3 SER 26 2HB SER 26 9.975 -10.347 -5.134
169 HG SER 26 HG SER 26 10.973 -9.148 -7.443
170 H GLN 27 H GLN 27 9.458 -6.778 -4.158
171 HA GLN 27 HA GLN 27 7.746 -7.917 -2.187
172 HB2 GLN 27 1HB GLN 27 8.992 -5.173 -2.402
173 HB3 GLN 27 2HB GLN 27 8.111 -5.749 -0.994
174 HG2 GLN 27 1HG GLN 27 9.773 -7.646 -0.888
175 HG3 GLN 27 2HG GLN 27 10.714 -6.764 -2.090
176 HE21 GLN 27 1HE2 GLN 27 10.601 -4.225 -1.346
177 HE22 GLN 27 2HE2 GLN 27 11.255 -3.996 0.236
178 H LEU 28 H LEU 28 7.475 -4.975 -4.183
179 HA LEU 28 HA LEU 28 4.912 -4.234 -3.370
180 HB2 LEU 28 1HB LEU 28 6.225 -2.677 -4.575
181 HB3 LEU 28 2HB LEU 28 6.415 -3.783 -5.934
182 HG LEU 28 HG LEU 28 4.065 -3.485 -6.517
183 HD11 LEU 28 1HD1 LEU 28 3.565 -2.899 -3.988
184 HD12 LEU 28 2HD1 LEU 28 2.543 -2.311 -5.298
185 HD13 LEU 28 3HD1 LEU 28 3.760 -1.252 -4.586
186 HD21 LEU 28 3HD2 LEU 28 5.862 -1.115 -6.273
187 HD22 LEU 28 1HD2 LEU 28 4.225 -0.906 -6.896
188 HD23 LEU 28 2HD2 LEU 28 5.346 -1.995 -7.713
189 H HIS 29 H HIS 29 5.885 -6.125 -6.229
190 HA HIS 29 HA HIS 29 3.300 -6.652 -7.171
191 HB2 HIS 29 1HB HIS 29 5.983 -7.900 -7.571
192 HB3 HIS 29 2HB HIS 29 4.561 -8.775 -8.132
193 HD1 HIS 29 HD1 HIS 29 5.491 -8.419 -10.575
194 HD2 HIS 29 HD2 HIS 29 4.384 -4.949 -8.577
195 HE1 HIS 29 HE1 HIS 29 5.331 -6.644 -12.349
196 H SER 30 H SER 30 5.126 -8.054 -4.586
197 HA SER 30 HA SER 30 3.494 -10.427 -4.388
198 HB2 SER 30 1HB SER 30 5.872 -10.462 -3.720
199 HB3 SER 30 2HB SER 30 5.523 -9.297 -2.443
200 HG SER 30 HG SER 30 5.518 -11.415 -1.628
201 H HIS 31 H HIS 31 3.410 -7.202 -3.203
202 HA HIS 31 HA HIS 31 1.565 -7.854 -1.043
203 HB2 HIS 31 1HB HIS 31 2.913 -6.170 -0.263
204 HB3 HIS 31 2HB HIS 31 3.118 -5.447 -1.856
205 HD1 HIS 31 HD1 HIS 31 0.867 -5.428 1.126
206 HD2 HIS 31 HD2 HIS 31 1.191 -3.541 -2.561
207 HE1 HIS 31 HE1 HIS 31 -0.747 -3.501 1.213
208 H GLN 32 H GLN 32 1.608 -6.152 -4.141
209 HA GLN 32 HA GLN 32 -0.873 -4.997 -4.187
210 HB2 GLN 32 1HB GLN 32 0.748 -6.314 -6.345
211 HB3 GLN 32 2HB GLN 32 -0.830 -5.624 -6.703
212 HG2 GLN 32 1HG GLN 32 -0.061 -3.451 -5.885
213 HG3 GLN 32 2HG GLN 32 1.524 -4.146 -5.548
214 HE21 GLN 32 1HE2 GLN 32 1.830 -2.147 -7.049
215 HE22 GLN 32 2HE2 GLN 32 1.985 -2.524 -8.728
216 H ARG 33 H ARG 33 -0.094 -8.375 -4.296
217 HA ARG 33 HA ARG 33 -2.359 -9.472 -5.443
218 HB2 ARG 33 1HB ARG 33 -1.105 -10.697 -3.004
219 HB3 ARG 33 2HB ARG 33 -1.768 -11.497 -4.422
220 HG2 ARG 33 1HG ARG 33 0.163 -10.317 -5.684
221 HG3 ARG 33 2HG ARG 33 0.872 -10.148 -4.077
222 HD2 ARG 33 1HD ARG 33 1.765 -12.154 -4.801
223 HD3 ARG 33 2HD ARG 33 0.368 -12.682 -3.865
224 HE ARG 33 HE ARG 33 -0.108 -12.321 -6.694
225 HH11 ARG 33 1HH1 ARG 33 0.781 -14.521 -4.147
226 HH12 ARG 33 2HH1 ARG 33 0.330 -15.938 -5.036
227 HH21 ARG 33 1HH2 ARG 33 -0.705 -14.179 -7.875
228 HH22 ARG 33 2HH2 ARG 33 -0.514 -15.743 -7.156
229 H VAL 34 H VAL 34 -1.915 -8.116 -2.244
230 HA VAL 34 HA VAL 34 -4.186 -9.114 -0.968
231 HB VAL 34 HB VAL 34 -3.981 -7.332 0.600
232 HG11 VAL 34 1HG1 VAL 34 -1.258 -7.196 0.536
233 HG12 VAL 34 2HG1 VAL 34 -2.189 -8.535 1.212
234 HG13 VAL 34 3HG1 VAL 34 -1.571 -8.633 -0.438
235 HG21 VAL 34 3HG2 VAL 34 -2.510 -5.367 0.143
236 HG22 VAL 34 1HG2 VAL 34 -2.407 -5.901 -1.535
237 HG23 VAL 34 2HG2 VAL 34 -3.963 -5.428 -0.855
238 H HIS 35 H HIS 35 -3.861 -6.687 -3.417
239 HA HIS 35 HA HIS 35 -6.534 -5.632 -2.984
240 HB2 HIS 35 1HB HIS 35 -4.385 -5.001 -5.010
241 HB3 HIS 35 2HB HIS 35 -5.978 -4.250 -5.030
242 HD1 HIS 35 HD1 HIS 35 -6.583 -2.893 -2.742
243 HD2 HIS 35 HD2 HIS 35 -2.573 -3.724 -3.442
244 HE1 HIS 35 HE1 HIS 35 -5.301 -1.320 -1.257
245 H THR 36 H THR 36 -4.975 -8.052 -4.852
246 HA THR 36 HA THR 36 -7.026 -8.182 -6.888
247 HB THR 36 HB THR 36 -5.814 -10.113 -7.749
248 HG1 THR 36 HG1 THR 36 -5.037 -10.424 -5.276
249 HG21 THR 36 3HG2 THR 36 -4.587 -8.533 -8.742
250 HG22 THR 36 1HG2 THR 36 -3.392 -8.766 -7.468
251 HG23 THR 36 2HG2 THR 36 -4.622 -7.513 -7.304
252 H GLY 37 H GLY 37 -8.186 -8.395 -4.393
253 HA2 GLY 37 1HA GLY 37 -9.565 -9.716 -3.113
254 HA3 GLY 37 2HA GLY 37 -9.857 -10.571 -4.621
255 H GLU 38 H GLU 38 -8.377 -10.674 -1.536
256 HA GLU 38 HA GLU 38 -7.195 -13.297 -2.176
257 HB2 GLU 38 1HB GLU 38 -6.381 -11.243 -0.119
258 HB3 GLU 38 2HB GLU 38 -5.765 -12.890 -0.131
259 HG2 GLU 38 1HG GLU 38 -5.184 -12.263 -2.635
260 HG3 GLU 38 2HG GLU 38 -5.192 -10.633 -1.963
261 H LYS 39 H LYS 39 -9.454 -14.049 -1.836
262 HA LYS 39 HA LYS 39 -9.804 -14.796 0.968
263 HB2 LYS 39 1HB LYS 39 -12.012 -13.624 -0.735
264 HB3 LYS 39 2HB LYS 39 -12.226 -14.324 0.864
265 HG2 LYS 39 1HG LYS 39 -11.304 -12.534 1.928
266 HG3 LYS 39 2HG LYS 39 -10.262 -12.119 0.565
267 HD2 LYS 39 1HD LYS 39 -13.249 -11.820 0.428
268 HD3 LYS 39 2HD LYS 39 -12.216 -10.549 1.086
269 HE2 LYS 39 1HE LYS 39 -10.896 -10.862 -1.141
270 HE3 LYS 39 2HE LYS 39 -12.395 -11.597 -1.708
271 HZ1 LYS 39 3HZ LYS 39 -12.907 -9.148 -0.366
272 HZ2 LYS 39 1HZ LYS 39 -13.307 -9.606 -1.945
273 HZ3 LYS 39 2HZ LYS 39 -11.799 -8.912 -1.622
274 HA PRO 40 HA PRO 40 -10.528 -18.747 -0.845
275 HB2 PRO 40 1HB PRO 40 -11.711 -19.959 1.277
276 HB3 PRO 40 2HB PRO 40 -9.978 -19.618 1.208
277 HG2 PRO 40 1HG PRO 40 -12.155 -18.092 2.584
278 HG3 PRO 40 2HG PRO 40 -10.533 -18.502 3.172
279 HD2 PRO 40 1HD PRO 40 -11.150 -16.058 2.184
280 HD3 PRO 40 2HD PRO 40 -9.539 -16.781 2.005
281 H SER 41 H SER 41 -12.051 -19.169 -2.306
282 HA SER 41 HA SER 41 -14.584 -18.066 -2.418
283 HB2 SER 41 1HB SER 41 -13.230 -19.355 -4.223
284 HB3 SER 41 2HB SER 41 -14.035 -20.785 -3.579
285 HG SER 41 HG SER 41 -14.993 -19.162 -5.352
286 H GLY 42 H GLY 42 -16.353 -18.356 -1.242
287 HA2 GLY 42 1HA GLY 42 -17.488 -20.822 -0.589
288 HA3 GLY 42 2HA GLY 42 -16.543 -20.301 0.799
289 HA PRO 43 HA PRO 43 -19.964 -16.936 0.203
290 HB2 PRO 43 1HB PRO 43 -21.883 -17.460 -1.645
291 HB3 PRO 43 2HB PRO 43 -20.394 -16.587 -2.027
292 HG2 PRO 43 1HG PRO 43 -21.071 -19.467 -2.482
293 HG3 PRO 43 2HG PRO 43 -20.249 -18.327 -3.563
294 HD2 PRO 43 1HD PRO 43 -18.909 -20.163 -2.093
295 HD3 PRO 43 2HD PRO 43 -18.224 -18.574 -2.491
296 H SER 44 H SER 44 -20.941 -17.360 2.097
297 HA SER 44 HA SER 44 -23.397 -18.806 2.144
298 HB2 SER 44 1HB SER 44 -22.120 -20.791 2.320
299 HB3 SER 44 2HB SER 44 -20.958 -20.042 3.416
300 HG SER 44 HG SER 44 -22.912 -21.490 4.157
301 H SER 45 H SER 45 -24.669 -18.131 3.791
302 HA SER 45 HA SER 45 -23.605 -16.034 5.495
303 HB2 SER 45 1HB SER 45 -26.391 -17.034 4.919
304 HB3 SER 45 2HB SER 45 -26.067 -15.858 6.193
305 HG SER 45 HG SER 45 -26.540 -14.729 4.340
306 H GLY 46 H GLY 46 -25.676 -18.892 6.055
307 HA2 GLY 46 1HA GLY 46 -25.967 -20.177 7.944
308 HA3 GLY 46 2HA GLY 46 -24.212 -20.132 8.012
Start of MODEL 2
1 H1 GLY 1 H GLY 1 -8.153 9.728 14.370
2 HA2 GLY 1 1HA GLY 1 -8.160 12.093 12.689
3 HA3 GLY 1 2HA GLY 1 -6.818 11.503 13.658
4 H SER 2 H SER 2 -5.139 11.149 12.372
5 HA SER 2 HA SER 2 -5.204 9.169 10.349
6 HB2 SER 2 1HB SER 2 -6.250 10.778 8.935
7 HB3 SER 2 2HB SER 2 -5.150 12.054 9.456
8 HG SER 2 HG SER 2 -4.351 9.724 8.046
9 H SER 3 H SER 3 -3.201 8.378 10.029
10 HA SER 3 HA SER 3 -0.955 9.928 11.139
11 HB2 SER 3 1HB SER 3 0.139 7.695 11.488
12 HB3 SER 3 2HB SER 3 -1.326 7.932 12.441
13 HG SER 3 HG SER 3 -1.081 6.467 10.023
14 H GLY 4 H GLY 4 0.973 10.048 10.010
15 HA2 GLY 4 1HA GLY 4 1.724 8.594 7.770
16 HA3 GLY 4 2HA GLY 4 0.776 9.950 7.177
17 H SER 5 H SER 5 3.738 8.970 8.730
18 HA SER 5 HA SER 5 4.771 11.712 8.408
19 HB2 SER 5 1HB SER 5 4.845 11.109 10.731
20 HB3 SER 5 2HB SER 5 5.564 9.542 10.360
21 HG SER 5 HG SER 5 7.166 10.967 11.046
22 H SER 6 H SER 6 5.259 11.281 6.191
23 HA SER 6 HA SER 6 7.144 9.190 5.543
24 HB2 SER 6 1HB SER 6 5.939 11.416 3.885
25 HB3 SER 6 2HB SER 6 7.038 10.194 3.245
26 HG SER 6 HG SER 6 4.562 9.646 4.523
27 H GLY 7 H GLY 7 8.977 9.718 6.766
28 HA2 GLY 7 1HA GLY 7 10.293 12.269 6.133
29 HA3 GLY 7 2HA GLY 7 10.686 11.223 7.490
30 H SER 8 H SER 8 12.408 9.946 7.303
31 HA SER 8 HA SER 8 13.829 9.899 4.774
32 HB2 SER 8 1HB SER 8 15.653 8.873 6.064
33 HB3 SER 8 2HB SER 8 15.070 10.339 6.851
34 HG SER 8 HG SER 8 14.178 7.737 7.535
35 H GLY 9 H GLY 9 14.036 8.191 3.440
36 HA2 GLY 9 1HA GLY 9 14.224 5.671 3.418
37 HA3 GLY 9 2HA GLY 9 12.680 5.697 4.256
38 H GLU 10 H GLU 10 14.256 6.733 1.248
39 HA GLU 10 HA GLU 10 11.715 6.967 -0.112
40 HB2 GLU 10 1HB GLU 10 14.537 7.146 -1.184
41 HB3 GLU 10 2HB GLU 10 13.078 7.544 -2.080
42 HG2 GLU 10 1HG GLU 10 13.758 8.926 0.487
43 HG3 GLU 10 2HG GLU 10 14.428 9.455 -1.055
44 H LYS 11 H LYS 11 10.986 5.667 -1.801
45 HA LYS 11 HA LYS 11 12.418 3.149 -2.263
46 HB2 LYS 11 1HB LYS 11 9.654 3.497 -1.189
47 HB3 LYS 11 2HB LYS 11 9.965 2.152 -2.279
48 HG2 LYS 11 1HG LYS 11 11.439 1.131 -0.804
49 HG3 LYS 11 2HG LYS 11 11.708 2.619 0.107
50 HD2 LYS 11 1HD LYS 11 9.225 2.467 0.723
51 HD3 LYS 11 2HD LYS 11 9.315 0.804 0.138
52 HE2 LYS 11 1HE LYS 11 11.019 2.007 2.317
53 HE3 LYS 11 2HE LYS 11 9.645 0.931 2.561
54 HZ1 LYS 11 3HZ LYS 11 11.527 -0.193 0.749
55 HZ2 LYS 11 1HZ LYS 11 10.922 -0.828 2.195
56 HZ3 LYS 11 2HZ LYS 11 12.268 0.195 2.219
57 HA PRO 12 HA PRO 12 11.514 4.299 -6.450
58 HB2 PRO 12 1HB PRO 12 12.453 2.031 -7.610
59 HB3 PRO 12 2HB PRO 12 13.513 3.300 -6.985
60 HG2 PRO 12 1HG PRO 12 12.707 0.710 -5.718
61 HG3 PRO 12 2HG PRO 12 14.304 1.478 -5.776
62 HD2 PRO 12 1HD PRO 12 12.703 1.608 -3.596
63 HD3 PRO 12 2HD PRO 12 13.813 2.919 -4.045
64 H PHE 13 H PHE 13 10.258 1.551 -4.777
65 HA PHE 13 HA PHE 13 8.270 1.116 -6.904
66 HB2 PHE 13 1HB PHE 13 8.978 -0.732 -4.616
67 HB3 PHE 13 2HB PHE 13 7.903 -1.092 -5.963
68 HD1 PHE 13 HD1 PHE 13 11.377 -0.707 -4.903
69 HD2 PHE 13 HD2 PHE 13 8.780 -1.593 -8.157
70 HE1 PHE 13 HE1 PHE 13 13.285 -1.592 -6.181
71 HE2 PHE 13 HE2 PHE 13 10.684 -2.480 -9.439
72 HZ PHE 13 HZ PHE 13 12.940 -2.481 -8.451
73 H LYS 14 H LYS 14 6.207 1.628 -6.546
74 HA LYS 14 HA LYS 14 5.252 1.915 -3.791
75 HB2 LYS 14 1HB LYS 14 5.888 4.159 -4.451
76 HB3 LYS 14 2HB LYS 14 4.984 4.011 -5.952
77 HG2 LYS 14 1HG LYS 14 2.931 3.669 -4.464
78 HG3 LYS 14 2HG LYS 14 3.943 4.288 -3.157
79 HD2 LYS 14 1HD LYS 14 4.374 6.317 -4.513
80 HD3 LYS 14 2HD LYS 14 3.256 5.703 -5.733
81 HE2 LYS 14 1HE LYS 14 1.913 7.124 -4.494
82 HE3 LYS 14 2HE LYS 14 1.579 5.555 -3.764
83 HZ1 LYS 14 3HZ LYS 14 2.729 7.884 -2.589
84 HZ2 LYS 14 1HZ LYS 14 3.721 6.531 -2.368
85 HZ3 LYS 14 2HZ LYS 14 2.114 6.496 -1.842
86 H CYS 15 H CYS 15 3.279 1.080 -3.487
87 HA CYS 15 HA CYS 15 1.947 -0.209 -5.675
88 HB2 CYS 15 1HB CYS 15 2.069 -1.172 -3.377
89 HB3 CYS 15 2HB CYS 15 1.008 0.118 -2.819
90 H GLU 16 H GLU 16 0.778 0.936 -7.071
91 HA GLU 16 HA GLU 16 -0.364 3.461 -6.507
92 HB2 GLU 16 1HB GLU 16 -1.034 1.554 -8.755
93 HB3 GLU 16 2HB GLU 16 -1.416 3.269 -8.704
94 HG2 GLU 16 1HG GLU 16 1.394 2.214 -8.599
95 HG3 GLU 16 2HG GLU 16 0.567 2.619 -10.102
96 H GLU 17 H GLU 17 -1.517 0.206 -6.182
97 HA GLU 17 HA GLU 17 -4.266 0.553 -6.236
98 HB2 GLU 17 1HB GLU 17 -2.801 -1.246 -4.304
99 HB3 GLU 17 2HB GLU 17 -4.430 -1.457 -4.930
100 HG2 GLU 17 1HG GLU 17 -3.236 -1.529 -7.241
101 HG3 GLU 17 2HG GLU 17 -1.811 -1.912 -6.276
102 H CYS 18 H CYS 18 -2.120 0.738 -3.395
103 HA CYS 18 HA CYS 18 -4.204 2.327 -2.047
104 HB2 CYS 18 1HB CYS 18 -3.237 1.510 0.089
105 HB3 CYS 18 2HB CYS 18 -3.882 0.210 -0.909
106 H GLY 19 H GLY 19 -0.746 1.944 -2.628
107 HA2 GLY 19 1HA GLY 19 0.406 4.099 -3.121
108 HA3 GLY 19 2HA GLY 19 -0.368 4.713 -1.667
109 H LYS 20 H LYS 20 0.692 1.466 -1.518
110 HA LYS 20 HA LYS 20 2.469 1.984 0.617
111 HB2 LYS 20 1HB LYS 20 1.656 -0.391 -0.966
112 HB3 LYS 20 2HB LYS 20 3.190 -0.501 -0.112
113 HG2 LYS 20 1HG LYS 20 1.773 0.375 1.910
114 HG3 LYS 20 2HG LYS 20 0.427 -0.274 0.969
115 HD2 LYS 20 1HD LYS 20 1.622 -2.444 0.849
116 HD3 LYS 20 2HD LYS 20 2.873 -1.777 1.900
117 HE2 LYS 20 1HE LYS 20 -0.019 -1.787 2.702
118 HE3 LYS 20 2HE LYS 20 1.017 -3.187 2.974
119 HZ1 LYS 20 3HZ LYS 20 0.902 -1.705 4.905
120 HZ2 LYS 20 1HZ LYS 20 1.567 -0.450 3.986
121 HZ3 LYS 20 2HZ LYS 20 2.478 -1.838 4.306
122 H ARG 21 H ARG 21 4.746 0.703 0.391
123 HA ARG 21 HA ARG 21 6.099 1.445 -2.077
124 HB2 ARG 21 1HB ARG 21 6.978 2.517 0.611
125 HB3 ARG 21 2HB ARG 21 7.837 2.721 -0.910
126 HG2 ARG 21 1HG ARG 21 5.588 3.800 -1.693
127 HG3 ARG 21 2HG ARG 21 5.329 4.013 0.040
128 HD2 ARG 21 1HD ARG 21 7.819 4.931 -0.099
129 HD3 ARG 21 2HD ARG 21 7.330 5.268 -1.758
130 HE ARG 21 HE ARG 21 5.301 6.310 -0.333
131 HH11 ARG 21 1HH1 ARG 21 8.758 6.641 -0.090
132 HH12 ARG 21 2HH1 ARG 21 8.690 8.252 0.543
133 HH21 ARG 21 1HH2 ARG 21 5.199 8.431 0.500
134 HH22 ARG 21 2HH2 ARG 21 6.665 9.269 0.879
135 H PHE 22 H PHE 22 8.230 0.521 -2.265
136 HA PHE 22 HA PHE 22 9.108 -1.366 -0.263
137 HB2 PHE 22 1HB PHE 22 8.479 -2.451 -3.004
138 HB3 PHE 22 2HB PHE 22 8.901 -3.349 -1.550
139 HD1 PHE 22 HD2 PHE 22 6.255 -1.315 -3.134
140 HD2 PHE 22 HD1 PHE 22 7.251 -4.053 -0.032
141 HE1 PHE 22 HE2 PHE 22 3.865 -1.601 -2.624
142 HE2 PHE 22 HE1 PHE 22 4.863 -4.344 0.483
143 HZ PHE 22 HZ PHE 22 3.166 -3.116 -0.813
144 H THR 23 H THR 23 11.216 -2.216 -0.683
145 HA THR 23 HA THR 23 12.836 -0.396 -2.248
146 HB THR 23 HB THR 23 13.469 -1.226 0.067
147 HG1 THR 23 HG1 THR 23 15.186 -1.364 -2.182
148 HG21 THR 23 3HG2 THR 23 12.909 -3.658 -0.646
149 HG22 THR 23 1HG2 THR 23 14.301 -3.373 0.397
150 HG23 THR 23 2HG2 THR 23 14.536 -3.655 -1.328
151 H GLN 24 H GLN 24 11.241 -3.262 -2.849
152 HA GLN 24 HA GLN 24 12.825 -3.701 -5.259
153 HB2 GLN 24 1HB GLN 24 12.565 -5.607 -3.009
154 HB3 GLN 24 2HB GLN 24 12.357 -6.281 -4.620
155 HG2 GLN 24 1HG GLN 24 14.755 -4.809 -3.561
156 HG3 GLN 24 2HG GLN 24 14.642 -6.520 -3.970
157 HE21 GLN 24 1HE2 GLN 24 13.187 -6.220 -6.373
158 HE22 GLN 24 2HE2 GLN 24 14.239 -5.512 -7.545
159 H ASN 25 H ASN 25 11.697 -4.813 -6.926
160 HA ASN 25 HA ASN 25 8.965 -4.169 -7.104
161 HB2 ASN 25 1HB ASN 25 8.991 -5.328 -9.227
162 HB3 ASN 25 2HB ASN 25 10.498 -4.434 -9.053
163 HD21 ASN 25 1HD2 ASN 25 12.411 -5.587 -8.562
164 HD22 ASN 25 2HD2 ASN 25 12.551 -7.268 -8.936
165 H SER 26 H SER 26 10.573 -7.323 -6.719
166 HA SER 26 HA SER 26 8.445 -9.018 -6.688
167 HB2 SER 26 1HB SER 26 10.753 -9.141 -4.733
168 HB3 SER 26 2HB SER 26 9.739 -10.491 -5.242
169 HG SER 26 HG SER 26 11.478 -10.631 -6.536
170 H GLN 27 H GLN 27 9.439 -6.826 -4.128
171 HA GLN 27 HA GLN 27 7.698 -7.824 -2.130
172 HB2 GLN 27 1HB GLN 27 9.057 -5.157 -2.497
173 HB3 GLN 27 2HB GLN 27 8.061 -5.530 -1.097
174 HG2 GLN 27 1HG GLN 27 9.575 -7.512 -0.708
175 HG3 GLN 27 2HG GLN 27 10.642 -6.817 -1.927
176 HE21 GLN 27 1HE2 GLN 27 10.602 -4.193 -1.417
177 HE22 GLN 27 2HE2 GLN 27 11.206 -3.859 0.167
178 H LEU 28 H LEU 28 7.443 -4.933 -4.205
179 HA LEU 28 HA LEU 28 4.875 -4.177 -3.416
180 HB2 LEU 28 1HB LEU 28 6.194 -2.634 -4.629
181 HB3 LEU 28 2HB LEU 28 6.402 -3.757 -5.970
182 HG LEU 28 HG LEU 28 4.068 -3.470 -6.597
183 HD11 LEU 28 1HD1 LEU 28 3.491 -2.904 -4.094
184 HD12 LEU 28 2HD1 LEU 28 2.518 -2.271 -5.421
185 HD13 LEU 28 3HD1 LEU 28 3.729 -1.247 -4.650
186 HD21 LEU 28 3HD2 LEU 28 4.350 -0.748 -6.714
187 HD22 LEU 28 1HD2 LEU 28 5.044 -1.901 -7.854
188 HD23 LEU 28 2HD2 LEU 28 6.015 -1.297 -6.511
189 H HIS 29 H HIS 29 5.839 -6.023 -6.313
190 HA HIS 29 HA HIS 29 3.254 -6.589 -7.216
191 HB2 HIS 29 1HB HIS 29 5.879 -8.025 -7.594
192 HB3 HIS 29 2HB HIS 29 4.393 -8.561 -8.374
193 HD1 HIS 29 HD1 HIS 29 7.029 -7.390 -9.787
194 HD2 HIS 29 HD2 HIS 29 3.434 -5.404 -9.158
195 HE1 HIS 29 HE1 HIS 29 6.957 -5.567 -11.517
196 H SER 30 H SER 30 5.121 -7.981 -4.659
197 HA SER 30 HA SER 30 3.533 -10.383 -4.467
198 HB2 SER 30 1HB SER 30 5.798 -10.617 -3.777
199 HB3 SER 30 2HB SER 30 5.706 -9.192 -2.743
200 HG SER 30 HG SER 30 4.488 -10.311 -1.299
201 H HIS 31 H HIS 31 3.412 -7.170 -3.246
202 HA HIS 31 HA HIS 31 1.589 -7.869 -1.084
203 HB2 HIS 31 1HB HIS 31 2.899 -6.165 -0.291
204 HB3 HIS 31 2HB HIS 31 3.107 -5.440 -1.883
205 HD1 HIS 31 HD1 HIS 31 0.732 -5.531 1.025
206 HD2 HIS 31 HD2 HIS 31 1.271 -3.466 -2.539
207 HE1 HIS 31 HE1 HIS 31 -0.875 -3.599 1.118
208 H GLN 32 H GLN 32 1.580 -6.145 -4.169
209 HA GLN 32 HA GLN 32 -0.925 -5.037 -4.184
210 HB2 GLN 32 1HB GLN 32 0.710 -6.291 -6.370
211 HB3 GLN 32 2HB GLN 32 -0.882 -5.625 -6.709
212 HG2 GLN 32 1HG GLN 32 -0.128 -3.455 -5.812
213 HG3 GLN 32 2HG GLN 32 1.481 -4.138 -5.586
214 HE21 GLN 32 1HE2 GLN 32 1.563 -2.031 -7.044
215 HE22 GLN 32 2HE2 GLN 32 1.678 -2.366 -8.735
216 H ARG 33 H ARG 33 -0.097 -8.378 -4.198
217 HA ARG 33 HA ARG 33 -2.328 -9.528 -5.399
218 HB2 ARG 33 1HB ARG 33 -1.038 -10.716 -2.958
219 HB3 ARG 33 2HB ARG 33 -1.708 -11.541 -4.359
220 HG2 ARG 33 1HG ARG 33 0.162 -10.474 -5.699
221 HG3 ARG 33 2HG ARG 33 0.881 -10.042 -4.147
222 HD2 ARG 33 1HD ARG 33 1.838 -12.115 -4.937
223 HD3 ARG 33 2HD ARG 33 0.856 -12.421 -3.505
224 HE ARG 33 HE ARG 33 -0.506 -13.741 -4.777
225 HH11 ARG 33 1HH1 ARG 33 1.373 -11.704 -6.884
226 HH12 ARG 33 2HH1 ARG 33 0.828 -12.479 -8.334
227 HH21 ARG 33 1HH2 ARG 33 -1.230 -14.770 -6.679
228 HH22 ARG 33 2HH2 ARG 33 -0.653 -14.222 -8.217
229 H VAL 34 H VAL 34 -1.928 -8.136 -2.215
230 HA VAL 34 HA VAL 34 -4.184 -9.187 -0.943
231 HB VAL 34 HB VAL 34 -4.004 -7.422 0.639
232 HG11 VAL 34 1HG1 VAL 34 -1.288 -7.214 0.569
233 HG12 VAL 34 2HG1 VAL 34 -2.180 -8.587 1.228
234 HG13 VAL 34 3HG1 VAL 34 -1.564 -8.645 -0.424
235 HG21 VAL 34 3HG2 VAL 34 -2.292 -5.906 -1.327
236 HG22 VAL 34 1HG2 VAL 34 -3.999 -5.580 -1.027
237 HG23 VAL 34 2HG2 VAL 34 -2.819 -5.362 0.265
238 H HIS 35 H HIS 35 -3.887 -6.759 -3.390
239 HA HIS 35 HA HIS 35 -6.549 -5.697 -2.956
240 HB2 HIS 35 1HB HIS 35 -4.433 -5.147 -5.039
241 HB3 HIS 35 2HB HIS 35 -6.023 -4.389 -5.062
242 HD1 HIS 35 HD1 HIS 35 -6.577 -2.814 -2.977
243 HD2 HIS 35 HD2 HIS 35 -2.605 -3.963 -3.378
244 HE1 HIS 35 HE1 HIS 35 -5.270 -1.231 -1.525
245 H THR 36 H THR 36 -4.975 -8.071 -4.936
246 HA THR 36 HA THR 36 -7.194 -8.302 -6.785
247 HB THR 36 HB THR 36 -5.916 -10.162 -7.776
248 HG1 THR 36 HG1 THR 36 -4.903 -10.914 -5.852
249 HG21 THR 36 3HG2 THR 36 -5.242 -7.457 -7.773
250 HG22 THR 36 1HG2 THR 36 -4.746 -8.669 -8.954
251 HG23 THR 36 2HG2 THR 36 -3.708 -8.304 -7.576
252 H GLY 37 H GLY 37 -7.995 -8.689 -4.132
253 HA2 GLY 37 1HA GLY 37 -9.010 -11.421 -4.332
254 HA3 GLY 37 2HA GLY 37 -8.109 -11.015 -2.878
255 H GLU 38 H GLU 38 -8.918 -8.681 -2.045
256 HA GLU 38 HA GLU 38 -11.852 -8.890 -1.859
257 HB2 GLU 38 1HB GLU 38 -10.299 -9.394 0.204
258 HB3 GLU 38 2HB GLU 38 -10.218 -7.641 0.312
259 HG2 GLU 38 1HG GLU 38 -12.615 -7.502 0.538
260 HG3 GLU 38 2HG GLU 38 -12.764 -9.244 0.309
261 H LYS 39 H LYS 39 -12.690 -7.316 -3.067
262 HA LYS 39 HA LYS 39 -11.881 -4.568 -2.521
263 HB2 LYS 39 1HB LYS 39 -11.728 -3.994 -4.889
264 HB3 LYS 39 2HB LYS 39 -10.544 -5.226 -4.471
265 HG2 LYS 39 1HG LYS 39 -11.328 -6.115 -6.403
266 HG3 LYS 39 2HG LYS 39 -12.481 -6.839 -5.280
267 HD2 LYS 39 1HD LYS 39 -14.188 -5.400 -5.905
268 HD3 LYS 39 2HD LYS 39 -13.070 -4.186 -6.532
269 HE2 LYS 39 1HE LYS 39 -13.206 -6.875 -7.822
270 HE3 LYS 39 2HE LYS 39 -14.457 -5.682 -8.168
271 HZ1 LYS 39 3HZ LYS 39 -11.745 -5.794 -9.083
272 HZ2 LYS 39 1HZ LYS 39 -12.139 -4.285 -8.426
273 HZ3 LYS 39 2HZ LYS 39 -13.055 -4.919 -9.699
274 HA PRO 40 HA PRO 40 -16.238 -3.942 -2.605
275 HB2 PRO 40 1HB PRO 40 -16.279 -1.253 -2.976
276 HB3 PRO 40 2HB PRO 40 -15.831 -2.004 -1.440
277 HG2 PRO 40 1HG PRO 40 -14.069 -0.919 -3.603
278 HG3 PRO 40 2HG PRO 40 -13.922 -0.740 -1.845
279 HD2 PRO 40 1HD PRO 40 -12.450 -2.521 -3.256
280 HD3 PRO 40 2HD PRO 40 -12.970 -2.823 -1.586
281 H SER 41 H SER 41 -17.816 -4.007 -4.104
282 HA SER 41 HA SER 41 -17.405 -4.349 -6.769
283 HB2 SER 41 1HB SER 41 -19.775 -3.898 -7.114
284 HB3 SER 41 2HB SER 41 -19.554 -4.778 -5.602
285 HG SER 41 HG SER 41 -20.757 -3.185 -4.885
286 H GLY 42 H GLY 42 -17.307 -3.110 -8.604
287 HA2 GLY 42 1HA GLY 42 -17.796 -0.280 -8.569
288 HA3 GLY 42 2HA GLY 42 -16.082 -0.667 -8.595
289 HA PRO 43 HA PRO 43 -16.145 -1.185 -12.942
290 HB2 PRO 43 1HB PRO 43 -14.558 -3.352 -13.337
291 HB3 PRO 43 2HB PRO 43 -13.929 -1.780 -12.829
292 HG2 PRO 43 1HG PRO 43 -14.529 -4.204 -11.178
293 HG3 PRO 43 2HG PRO 43 -13.132 -3.115 -11.099
294 HD2 PRO 43 1HD PRO 43 -15.206 -2.953 -9.366
295 HD3 PRO 43 2HD PRO 43 -14.278 -1.529 -9.881
296 H SER 44 H SER 44 -18.015 -1.763 -13.878
297 HA SER 44 HA SER 44 -19.406 -4.170 -13.300
298 HB2 SER 44 1HB SER 44 -20.323 -1.918 -14.212
299 HB3 SER 44 2HB SER 44 -19.866 -2.552 -15.793
300 HG SER 44 HG SER 44 -22.042 -3.093 -14.377
301 H SER 45 H SER 45 -18.022 -5.899 -13.687
302 HA SER 45 HA SER 45 -16.945 -6.263 -16.368
303 HB2 SER 45 1HB SER 45 -15.677 -6.796 -14.197
304 HB3 SER 45 2HB SER 45 -16.709 -8.222 -14.089
305 HG SER 45 HG SER 45 -15.452 -7.766 -16.525
306 H GLY 46 H GLY 46 -18.668 -6.717 -17.689
307 HA2 GLY 46 1HA GLY 46 -20.343 -7.952 -18.658
308 HA3 GLY 46 2HA GLY 46 -19.540 -9.339 -17.938
Start of MODEL 3
1 H1 GLY 1 H GLY 1 1.970 -10.086 3.694
2 HA2 GLY 1 1HA GLY 1 2.815 -8.221 4.735
3 HA3 GLY 1 2HA GLY 1 3.257 -9.269 6.074
4 H SER 2 H SER 2 4.989 -7.400 5.816
5 HA SER 2 HA SER 2 7.218 -8.557 4.273
6 HB2 SER 2 1HB SER 2 8.097 -6.245 4.012
7 HB3 SER 2 2HB SER 2 6.535 -6.471 3.226
8 HG SER 2 HG SER 2 6.794 -4.519 4.550
9 H SER 3 H SER 3 9.331 -8.281 5.179
10 HA SER 3 HA SER 3 9.574 -8.941 7.840
11 HB2 SER 3 1HB SER 3 11.902 -8.686 7.590
12 HB3 SER 3 2HB SER 3 11.335 -9.038 5.958
13 HG SER 3 HG SER 3 12.631 -7.296 5.730
14 H GLY 4 H GLY 4 10.466 -7.760 9.659
15 HA2 GLY 4 1HA GLY 4 9.046 -5.477 10.331
16 HA3 GLY 4 2HA GLY 4 10.526 -5.993 11.125
17 H SER 5 H SER 5 10.101 -3.365 11.042
18 HA SER 5 HA SER 5 10.780 -1.829 8.898
19 HB2 SER 5 1HB SER 5 10.198 -0.933 11.132
20 HB3 SER 5 2HB SER 5 11.790 -1.410 11.723
21 HG SER 5 HG SER 5 11.072 0.794 10.340
22 H SER 6 H SER 6 12.436 -1.782 7.544
23 HA SER 6 HA SER 6 15.025 -2.857 8.449
24 HB2 SER 6 1HB SER 6 13.809 -2.777 5.679
25 HB3 SER 6 2HB SER 6 15.464 -3.284 6.018
26 HG SER 6 HG SER 6 14.719 -5.155 6.582
27 H GLY 7 H GLY 7 13.554 -0.396 6.341
28 HA2 GLY 7 1HA GLY 7 15.173 1.705 7.216
29 HA3 GLY 7 2HA GLY 7 15.946 1.004 5.802
30 H SER 8 H SER 8 12.985 2.522 6.977
31 HA SER 8 HA SER 8 11.959 2.898 4.301
32 HB2 SER 8 1HB SER 8 10.100 4.067 5.421
33 HB3 SER 8 2HB SER 8 10.404 2.493 6.156
34 HG SER 8 HG SER 8 11.892 4.033 7.534
35 H GLY 9 H GLY 9 11.600 4.929 3.301
36 HA2 GLY 9 1HA GLY 9 12.064 7.450 4.020
37 HA3 GLY 9 2HA GLY 9 13.710 6.848 3.890
38 H GLU 10 H GLU 10 13.415 5.150 1.684
39 HA GLU 10 HA GLU 10 12.326 6.755 -0.480
40 HB2 GLU 10 1HB GLU 10 14.502 6.676 -1.724
41 HB3 GLU 10 2HB GLU 10 14.499 7.739 -0.324
42 HG2 GLU 10 1HG GLU 10 15.653 6.034 0.982
43 HG3 GLU 10 2HG GLU 10 15.650 4.960 -0.415
44 H LYS 11 H LYS 11 11.282 5.405 -1.768
45 HA LYS 11 HA LYS 11 12.457 2.784 -2.355
46 HB2 LYS 11 1HB LYS 11 9.731 3.327 -1.230
47 HB3 LYS 11 2HB LYS 11 9.985 1.939 -2.279
48 HG2 LYS 11 1HG LYS 11 11.420 0.903 -0.768
49 HG3 LYS 11 2HG LYS 11 11.726 2.402 0.112
50 HD2 LYS 11 1HD LYS 11 8.946 1.329 0.007
51 HD3 LYS 11 2HD LYS 11 10.116 0.568 1.088
52 HE2 LYS 11 1HE LYS 11 10.591 3.055 1.792
53 HE3 LYS 11 2HE LYS 11 8.971 3.321 1.151
54 HZ1 LYS 11 3HZ LYS 11 9.812 1.781 3.496
55 HZ2 LYS 11 1HZ LYS 11 8.442 1.259 2.651
56 HZ3 LYS 11 2HZ LYS 11 8.489 2.818 3.305
57 HA PRO 12 HA PRO 12 11.489 4.246 -6.444
58 HB2 PRO 12 1HB PRO 12 12.369 2.038 -7.755
59 HB3 PRO 12 2HB PRO 12 13.460 3.259 -7.091
60 HG2 PRO 12 1HG PRO 12 12.662 0.610 -5.948
61 HG3 PRO 12 2HG PRO 12 14.266 1.365 -6.009
62 HD2 PRO 12 1HD PRO 12 12.729 1.389 -3.780
63 HD3 PRO 12 2HD PRO 12 13.840 2.712 -4.188
64 H PHE 13 H PHE 13 10.167 1.539 -4.817
65 HA PHE 13 HA PHE 13 8.178 1.147 -6.951
66 HB2 PHE 13 1HB PHE 13 8.843 -0.708 -4.656
67 HB3 PHE 13 2HB PHE 13 7.737 -1.043 -5.984
68 HD1 PHE 13 HD1 PHE 13 11.239 -0.752 -4.983
69 HD2 PHE 13 HD2 PHE 13 8.563 -1.597 -8.183
70 HE1 PHE 13 HE1 PHE 13 13.099 -1.706 -6.281
71 HE2 PHE 13 HE2 PHE 13 10.418 -2.553 -9.486
72 HZ PHE 13 HZ PHE 13 12.689 -2.609 -8.536
73 H LYS 14 H LYS 14 6.063 1.514 -6.564
74 HA LYS 14 HA LYS 14 5.158 1.950 -3.819
75 HB2 LYS 14 1HB LYS 14 5.812 4.165 -4.653
76 HB3 LYS 14 2HB LYS 14 4.761 3.956 -6.047
77 HG2 LYS 14 1HG LYS 14 2.844 3.748 -4.430
78 HG3 LYS 14 2HG LYS 14 3.964 4.262 -3.166
79 HD2 LYS 14 1HD LYS 14 4.407 6.329 -4.425
80 HD3 LYS 14 2HD LYS 14 3.247 5.816 -5.653
81 HE2 LYS 14 1HE LYS 14 1.436 5.971 -4.135
82 HE3 LYS 14 2HE LYS 14 2.517 6.124 -2.751
83 HZ1 LYS 14 3HZ LYS 14 3.185 8.198 -4.421
84 HZ2 LYS 14 1HZ LYS 14 2.298 8.305 -2.984
85 HZ3 LYS 14 2HZ LYS 14 1.495 8.150 -4.465
86 H CYS 15 H CYS 15 3.262 0.996 -3.469
87 HA CYS 15 HA CYS 15 1.890 -0.346 -5.579
88 HB2 CYS 15 1HB CYS 15 2.062 -1.152 -3.196
89 HB3 CYS 15 2HB CYS 15 0.910 0.104 -2.756
90 H GLU 16 H GLU 16 1.072 1.106 -7.046
91 HA GLU 16 HA GLU 16 -0.224 3.500 -6.522
92 HB2 GLU 16 1HB GLU 16 -0.818 1.589 -8.788
93 HB3 GLU 16 2HB GLU 16 -1.192 3.306 -8.753
94 HG2 GLU 16 1HG GLU 16 1.398 3.524 -8.359
95 HG3 GLU 16 2HG GLU 16 1.417 1.938 -9.129
96 H GLU 17 H GLU 17 -1.347 0.258 -6.139
97 HA GLU 17 HA GLU 17 -4.104 0.580 -6.318
98 HB2 GLU 17 1HB GLU 17 -2.660 -1.193 -4.344
99 HB3 GLU 17 2HB GLU 17 -4.294 -1.407 -4.958
100 HG2 GLU 17 1HG GLU 17 -3.105 -1.505 -7.276
101 HG3 GLU 17 2HG GLU 17 -1.684 -1.895 -6.308
102 H CYS 18 H CYS 18 -2.025 0.869 -3.440
103 HA CYS 18 HA CYS 18 -4.167 2.450 -2.173
104 HB2 CYS 18 1HB CYS 18 -3.297 1.651 0.006
105 HB3 CYS 18 2HB CYS 18 -3.892 0.339 -1.006
106 H GLY 19 H GLY 19 -0.682 2.026 -2.573
107 HA2 GLY 19 1HA GLY 19 0.444 4.232 -3.066
108 HA3 GLY 19 2HA GLY 19 -0.309 4.781 -1.576
109 H LYS 20 H LYS 20 0.653 1.545 -1.423
110 HA LYS 20 HA LYS 20 2.515 2.002 0.636
111 HB2 LYS 20 1HB LYS 20 1.631 -0.347 -0.957
112 HB3 LYS 20 2HB LYS 20 3.161 -0.490 -0.102
113 HG2 LYS 20 1HG LYS 20 1.816 0.357 1.943
114 HG3 LYS 20 2HG LYS 20 0.408 -0.136 0.999
115 HD2 LYS 20 1HD LYS 20 0.875 -2.042 2.233
116 HD3 LYS 20 2HD LYS 20 1.700 -2.368 0.707
117 HE2 LYS 20 1HE LYS 20 3.798 -1.514 1.722
118 HE3 LYS 20 2HE LYS 20 2.945 -1.344 3.256
119 HZ1 LYS 20 3HZ LYS 20 4.307 -3.503 2.642
120 HZ2 LYS 20 1HZ LYS 20 2.833 -3.949 1.944
121 HZ3 LYS 20 2HZ LYS 20 2.908 -3.570 3.590
122 H ARG 21 H ARG 21 4.765 0.729 0.383
123 HA ARG 21 HA ARG 21 6.078 1.393 -2.126
124 HB2 ARG 21 1HB ARG 21 6.961 2.572 0.515
125 HB3 ARG 21 2HB ARG 21 7.860 2.675 -0.992
126 HG2 ARG 21 1HG ARG 21 5.665 3.758 -1.895
127 HG3 ARG 21 2HG ARG 21 5.348 4.058 -0.185
128 HD2 ARG 21 1HD ARG 21 7.783 4.988 -0.186
129 HD3 ARG 21 2HD ARG 21 7.534 5.117 -1.926
130 HE ARG 21 HE ARG 21 6.040 6.837 -1.567
131 HH11 ARG 21 1HH1 ARG 21 6.888 5.333 1.456
132 HH12 ARG 21 2HH1 ARG 21 6.165 6.574 2.426
133 HH21 ARG 21 1HH2 ARG 21 5.084 8.477 -0.302
134 HH22 ARG 21 2HH2 ARG 21 5.139 8.361 1.425
135 H PHE 22 H PHE 22 8.227 0.480 -2.299
136 HA PHE 22 HA PHE 22 9.102 -1.370 -0.257
137 HB2 PHE 22 1HB PHE 22 8.463 -2.481 -2.989
138 HB3 PHE 22 2HB PHE 22 8.933 -3.370 -1.544
139 HD1 PHE 22 HD2 PHE 22 6.230 -1.242 -2.940
140 HD2 PHE 22 HD1 PHE 22 7.317 -4.239 -0.120
141 HE1 PHE 22 HE2 PHE 22 3.857 -1.567 -2.376
142 HE2 PHE 22 HE1 PHE 22 4.946 -4.569 0.448
143 HZ PHE 22 HZ PHE 22 3.212 -3.232 -0.680
144 H THR 23 H THR 23 11.221 -2.186 -0.622
145 HA THR 23 HA THR 23 12.867 -0.378 -2.141
146 HB THR 23 HB THR 23 13.614 -1.170 0.057
147 HG1 THR 23 HG1 THR 23 15.184 -1.922 -2.192
148 HG21 THR 23 3HG2 THR 23 13.253 -3.306 0.597
149 HG22 THR 23 1HG2 THR 23 14.614 -3.722 -0.442
150 HG23 THR 23 2HG2 THR 23 12.973 -3.750 -1.086
151 H GLN 24 H GLN 24 11.280 -3.271 -2.814
152 HA GLN 24 HA GLN 24 12.789 -3.559 -5.296
153 HB2 GLN 24 1HB GLN 24 12.639 -5.569 -3.126
154 HB3 GLN 24 2HB GLN 24 12.407 -6.174 -4.761
155 HG2 GLN 24 1HG GLN 24 14.799 -4.741 -3.646
156 HG3 GLN 24 2HG GLN 24 14.704 -6.396 -4.247
157 HE21 GLN 24 1HE2 GLN 24 13.233 -5.916 -6.575
158 HE22 GLN 24 2HE2 GLN 24 14.227 -5.033 -7.678
159 H ASN 25 H ASN 25 11.646 -4.752 -6.944
160 HA ASN 25 HA ASN 25 8.884 -4.133 -7.013
161 HB2 ASN 25 1HB ASN 25 8.936 -4.816 -9.215
162 HB3 ASN 25 2HB ASN 25 10.646 -4.487 -8.948
163 HD21 ASN 25 1HD2 ASN 25 11.973 -6.356 -8.282
164 HD22 ASN 25 2HD2 ASN 25 11.610 -7.895 -8.977
165 H SER 26 H SER 26 10.641 -7.204 -6.698
166 HA SER 26 HA SER 26 8.585 -9.006 -6.731
167 HB2 SER 26 1HB SER 26 11.160 -8.918 -5.196
168 HB3 SER 26 2HB SER 26 10.019 -10.232 -4.910
169 HG SER 26 HG SER 26 10.227 -9.980 -7.516
170 H GLN 27 H GLN 27 9.472 -6.810 -4.145
171 HA GLN 27 HA GLN 27 7.767 -7.963 -2.174
172 HB2 GLN 27 1HB GLN 27 8.975 -5.197 -2.353
173 HB3 GLN 27 2HB GLN 27 8.164 -5.851 -0.936
174 HG2 GLN 27 1HG GLN 27 9.877 -7.693 -0.944
175 HG3 GLN 27 2HG GLN 27 10.743 -6.768 -2.170
176 HE21 GLN 27 1HE2 GLN 27 10.642 -4.255 -1.383
177 HE22 GLN 27 2HE2 GLN 27 11.351 -4.039 0.177
178 H LEU 28 H LEU 28 7.497 -5.001 -4.141
179 HA LEU 28 HA LEU 28 4.935 -4.269 -3.311
180 HB2 LEU 28 1HB LEU 28 6.285 -2.707 -4.494
181 HB3 LEU 28 2HB LEU 28 6.410 -3.780 -5.887
182 HG LEU 28 HG LEU 28 4.044 -3.418 -6.383
183 HD11 LEU 28 1HD1 LEU 28 2.613 -2.148 -5.117
184 HD12 LEU 28 2HD1 LEU 28 3.916 -1.237 -4.356
185 HD13 LEU 28 3HD1 LEU 28 3.596 -2.898 -3.859
186 HD21 LEU 28 3HD2 LEU 28 4.321 -1.362 -7.389
187 HD22 LEU 28 1HD2 LEU 28 5.993 -1.840 -7.091
188 HD23 LEU 28 2HD2 LEU 28 5.200 -0.688 -6.016
189 H HIS 29 H HIS 29 5.903 -6.084 -6.222
190 HA HIS 29 HA HIS 29 3.336 -6.593 -7.192
191 HB2 HIS 29 1HB HIS 29 5.838 -8.273 -7.460
192 HB3 HIS 29 2HB HIS 29 4.382 -8.473 -8.429
193 HD1 HIS 29 HD1 HIS 29 5.369 -7.842 -10.666
194 HD2 HIS 29 HD2 HIS 29 5.995 -4.954 -7.746
195 HE1 HIS 29 HE1 HIS 29 6.283 -5.841 -11.885
196 H SER 30 H SER 30 5.136 -8.093 -4.624
197 HA SER 30 HA SER 30 3.449 -10.419 -4.456
198 HB2 SER 30 1HB SER 30 5.798 -9.358 -2.978
199 HB3 SER 30 2HB SER 30 4.723 -10.439 -2.090
200 HG SER 30 HG SER 30 6.570 -11.326 -3.448
201 H HIS 31 H HIS 31 3.438 -7.211 -3.192
202 HA HIS 31 HA HIS 31 1.556 -7.843 -1.069
203 HB2 HIS 31 1HB HIS 31 2.915 -6.158 -0.302
204 HB3 HIS 31 2HB HIS 31 3.106 -5.438 -1.898
205 HD1 HIS 31 HD1 HIS 31 0.756 -5.519 1.035
206 HD2 HIS 31 HD2 HIS 31 1.290 -3.441 -2.523
207 HE1 HIS 31 HE1 HIS 31 -0.833 -3.573 1.148
208 H GLN 32 H GLN 32 1.608 -6.144 -4.170
209 HA GLN 32 HA GLN 32 -0.886 -5.006 -4.214
210 HB2 GLN 32 1HB GLN 32 0.784 -6.259 -6.370
211 HB3 GLN 32 2HB GLN 32 -0.810 -5.617 -6.742
212 HG2 GLN 32 1HG GLN 32 -0.109 -3.429 -5.867
213 HG3 GLN 32 2HG GLN 32 1.500 -4.085 -5.571
214 HE21 GLN 32 1HE2 GLN 32 2.355 -2.493 -6.964
215 HE22 GLN 32 2HE2 GLN 32 2.247 -2.659 -8.680
216 H ARG 33 H ARG 33 -0.084 -8.359 -4.254
217 HA ARG 33 HA ARG 33 -2.325 -9.473 -5.469
218 HB2 ARG 33 1HB ARG 33 -1.045 -10.702 -3.042
219 HB3 ARG 33 2HB ARG 33 -1.726 -11.505 -4.451
220 HG2 ARG 33 1HG ARG 33 0.145 -10.492 -5.795
221 HG3 ARG 33 2HG ARG 33 0.866 -9.997 -4.261
222 HD2 ARG 33 1HD ARG 33 1.769 -12.135 -5.132
223 HD3 ARG 33 2HD ARG 33 1.028 -12.283 -3.539
224 HE ARG 33 HE ARG 33 -0.484 -13.732 -4.438
225 HH11 ARG 33 1HH1 ARG 33 0.925 -11.856 -7.010
226 HH12 ARG 33 2HH1 ARG 33 0.136 -12.748 -8.269
227 HH21 ARG 33 1HH2 ARG 33 -1.529 -14.914 -6.086
228 HH22 ARG 33 2HH2 ARG 33 -1.260 -14.487 -7.742
229 H VAL 34 H VAL 34 -1.916 -8.115 -2.273
230 HA VAL 34 HA VAL 34 -4.174 -9.164 -1.005
231 HB VAL 34 HB VAL 34 -3.987 -7.407 0.585
232 HG11 VAL 34 1HG1 VAL 34 -1.552 -8.630 -0.488
233 HG12 VAL 34 2HG1 VAL 34 -1.270 -7.201 0.508
234 HG13 VAL 34 3HG1 VAL 34 -2.162 -8.574 1.166
235 HG21 VAL 34 3HG2 VAL 34 -4.011 -5.523 -0.970
236 HG22 VAL 34 1HG2 VAL 34 -2.696 -5.370 0.194
237 HG23 VAL 34 2HG2 VAL 34 -2.357 -5.894 -1.455
238 H HIS 35 H HIS 35 -3.836 -6.548 -3.301
239 HA HIS 35 HA HIS 35 -6.507 -5.549 -2.902
240 HB2 HIS 35 1HB HIS 35 -4.368 -4.970 -4.949
241 HB3 HIS 35 2HB HIS 35 -5.965 -4.230 -5.014
242 HD1 HIS 35 HD1 HIS 35 -6.596 -2.679 -2.927
243 HD2 HIS 35 HD2 HIS 35 -2.598 -3.761 -3.248
244 HE1 HIS 35 HE1 HIS 35 -5.346 -1.084 -1.437
245 H THR 36 H THR 36 -4.986 -7.964 -4.840
246 HA THR 36 HA THR 36 -7.364 -8.207 -6.545
247 HB THR 36 HB THR 36 -6.021 -9.691 -7.959
248 HG1 THR 36 HG1 THR 36 -4.651 -10.457 -6.203
249 HG21 THR 36 3HG2 THR 36 -4.664 -8.042 -8.944
250 HG22 THR 36 1HG2 THR 36 -4.357 -7.249 -7.399
251 HG23 THR 36 2HG2 THR 36 -5.951 -7.139 -8.146
252 H GLY 37 H GLY 37 -7.971 -8.971 -4.066
253 HA2 GLY 37 1HA GLY 37 -7.891 -11.923 -4.195
254 HA3 GLY 37 2HA GLY 37 -7.798 -11.042 -2.677
255 H GLU 38 H GLU 38 -9.720 -13.048 -3.344
256 HA GLU 38 HA GLU 38 -12.198 -11.780 -4.027
257 HB2 GLU 38 1HB GLU 38 -11.768 -14.162 -4.500
258 HB3 GLU 38 2HB GLU 38 -11.686 -14.483 -2.773
259 HG2 GLU 38 1HG GLU 38 -13.991 -13.971 -2.487
260 HG3 GLU 38 2HG GLU 38 -14.117 -13.357 -4.135
261 H LYS 39 H LYS 39 -10.375 -12.147 -1.160
262 HA LYS 39 HA LYS 39 -12.652 -11.143 0.415
263 HB2 LYS 39 1HB LYS 39 -10.758 -13.362 1.004
264 HB3 LYS 39 2HB LYS 39 -11.241 -12.334 2.346
265 HG2 LYS 39 1HG LYS 39 -13.653 -12.805 1.407
266 HG3 LYS 39 2HG LYS 39 -12.859 -14.227 0.725
267 HD2 LYS 39 1HD LYS 39 -12.538 -13.507 3.619
268 HD3 LYS 39 2HD LYS 39 -13.938 -14.424 3.056
269 HE2 LYS 39 1HE LYS 39 -12.451 -16.124 2.124
270 HE3 LYS 39 2HE LYS 39 -11.049 -15.202 2.663
271 HZ1 LYS 39 3HZ LYS 39 -11.658 -15.552 4.925
272 HZ2 LYS 39 1HZ LYS 39 -11.678 -17.058 4.154
273 HZ3 LYS 39 2HZ LYS 39 -13.132 -16.261 4.491
274 HA PRO 40 HA PRO 40 -10.100 -7.805 1.680
275 HB2 PRO 40 1HB PRO 40 -10.912 -7.419 4.242
276 HB3 PRO 40 2HB PRO 40 -11.910 -7.001 2.845
277 HG2 PRO 40 1HG PRO 40 -12.025 -9.425 4.597
278 HG3 PRO 40 2HG PRO 40 -13.356 -8.441 3.959
279 HD2 PRO 40 1HD PRO 40 -12.633 -10.806 2.855
280 HD3 PRO 40 2HD PRO 40 -13.289 -9.464 1.895
281 H SER 41 H SER 41 -8.065 -7.558 2.388
282 HA SER 41 HA SER 41 -6.790 -9.729 3.791
283 HB2 SER 41 1HB SER 41 -5.531 -8.727 2.018
284 HB3 SER 41 2HB SER 41 -5.759 -7.111 2.686
285 HG SER 41 HG SER 41 -3.855 -8.935 3.250
286 H GLY 42 H GLY 42 -7.101 -6.223 4.395
287 HA2 GLY 42 1HA GLY 42 -7.825 -6.427 7.075
288 HA3 GLY 42 2HA GLY 42 -6.070 -6.349 7.030
289 HA PRO 43 HA PRO 43 -7.501 -1.999 7.266
290 HB2 PRO 43 1HB PRO 43 -5.423 -1.179 8.808
291 HB3 PRO 43 2HB PRO 43 -6.882 -1.921 9.477
292 HG2 PRO 43 1HG PRO 43 -4.216 -3.160 8.909
293 HG3 PRO 43 2HG PRO 43 -5.268 -3.366 10.322
294 HD2 PRO 43 1HD PRO 43 -5.146 -5.184 8.319
295 HD3 PRO 43 2HD PRO 43 -6.631 -4.880 9.244
296 H SER 44 H SER 44 -6.902 -0.404 5.909
297 HA SER 44 HA SER 44 -4.230 -0.574 4.677
298 HB2 SER 44 1HB SER 44 -6.923 -0.263 3.431
299 HB3 SER 44 2HB SER 44 -5.568 0.591 2.694
300 HG SER 44 HG SER 44 -5.728 -1.442 1.771
301 H SER 45 H SER 45 -3.651 0.931 6.415
302 HA SER 45 HA SER 45 -4.267 3.696 5.632
303 HB2 SER 45 1HB SER 45 -5.588 3.148 7.644
304 HB3 SER 45 2HB SER 45 -4.107 2.692 8.485
305 HG SER 45 HG SER 45 -5.003 4.940 8.743
306 H GLY 46 H GLY 46 -2.033 2.233 4.816
307 HA2 GLY 46 1HA GLY 46 0.221 2.659 4.557
308 HA3 GLY 46 2HA GLY 46 0.061 3.965 5.722
Start of MODEL 4
1 H1 GLY 1 H GLY 1 -0.049 9.729 16.889
2 HA2 GLY 1 1HA GLY 1 -1.380 7.398 16.865
3 HA3 GLY 1 2HA GLY 1 0.077 6.977 15.977
4 H SER 2 H SER 2 1.674 6.158 17.143
5 HA SER 2 HA SER 2 1.908 6.960 19.966
6 HB2 SER 2 1HB SER 2 2.284 4.162 18.870
7 HB3 SER 2 2HB SER 2 2.518 4.653 20.548
8 HG SER 2 HG SER 2 0.440 4.568 20.843
9 H SER 3 H SER 3 4.117 6.205 20.857
10 HA SER 3 HA SER 3 6.147 7.628 19.762
11 HB2 SER 3 1HB SER 3 7.644 6.471 21.174
12 HB3 SER 3 2HB SER 3 6.086 6.345 21.991
13 HG SER 3 HG SER 3 7.132 4.331 21.924
14 H GLY 4 H GLY 4 7.352 7.538 17.984
15 HA2 GLY 4 1HA GLY 4 7.817 4.934 16.704
16 HA3 GLY 4 2HA GLY 4 7.114 6.232 15.750
17 H SER 5 H SER 5 9.730 4.733 15.623
18 HA SER 5 HA SER 5 11.718 6.755 16.176
19 HB2 SER 5 1HB SER 5 12.188 4.315 16.426
20 HB3 SER 5 2HB SER 5 12.034 4.143 14.678
21 HG SER 5 HG SER 5 14.199 4.407 15.205
22 H SER 6 H SER 6 13.318 7.305 14.403
23 HA SER 6 HA SER 6 12.151 8.848 12.456
24 HB2 SER 6 1HB SER 6 14.849 7.505 12.182
25 HB3 SER 6 2HB SER 6 14.328 9.003 11.412
26 HG SER 6 HG SER 6 14.057 9.809 13.627
27 H GLY 7 H GLY 7 10.902 8.330 10.795
28 HA2 GLY 7 1HA GLY 7 11.271 5.695 9.525
29 HA3 GLY 7 2HA GLY 7 9.776 6.618 9.519
30 H SER 8 H SER 8 13.076 6.540 8.262
31 HA SER 8 HA SER 8 12.128 8.085 5.938
32 HB2 SER 8 1HB SER 8 14.604 8.369 7.573
33 HB3 SER 8 2HB SER 8 14.737 8.637 5.835
34 HG SER 8 HG SER 8 13.989 10.391 7.536
35 H GLY 9 H GLY 9 12.721 7.378 3.919
36 HA2 GLY 9 1HA GLY 9 14.742 5.673 3.186
37 HA3 GLY 9 2HA GLY 9 13.437 4.613 3.698
38 H GLU 10 H GLU 10 14.708 6.479 1.168
39 HA GLU 10 HA GLU 10 12.303 6.901 -0.307
40 HB2 GLU 10 1HB GLU 10 15.187 6.863 -1.214
41 HB3 GLU 10 2HB GLU 10 13.832 7.400 -2.197
42 HG2 GLU 10 1HG GLU 10 14.588 9.400 -1.421
43 HG3 GLU 10 2HG GLU 10 13.409 9.009 -0.170
44 H LYS 11 H LYS 11 11.144 5.434 -1.344
45 HA LYS 11 HA LYS 11 12.471 2.956 -2.231
46 HB2 LYS 11 1HB LYS 11 9.725 3.448 -1.114
47 HB3 LYS 11 2HB LYS 11 10.054 2.034 -2.106
48 HG2 LYS 11 1HG LYS 11 11.585 1.166 -0.543
49 HG3 LYS 11 2HG LYS 11 11.669 2.694 0.337
50 HD2 LYS 11 1HD LYS 11 9.028 1.340 0.085
51 HD3 LYS 11 2HD LYS 11 10.210 0.678 1.217
52 HE2 LYS 11 1HE LYS 11 9.332 3.561 1.178
53 HE3 LYS 11 2HE LYS 11 8.623 2.327 2.219
54 HZ1 LYS 11 3HZ LYS 11 11.441 2.298 2.449
55 HZ2 LYS 11 1HZ LYS 11 10.279 2.571 3.648
56 HZ3 LYS 11 2HZ LYS 11 10.864 3.864 2.728
57 HA PRO 12 HA PRO 12 11.423 4.398 -6.305
58 HB2 PRO 12 1HB PRO 12 12.289 2.190 -7.627
59 HB3 PRO 12 2HB PRO 12 13.387 3.417 -6.984
60 HG2 PRO 12 1HG PRO 12 12.617 0.767 -5.823
61 HG3 PRO 12 2HG PRO 12 14.217 1.527 -5.912
62 HD2 PRO 12 1HD PRO 12 12.718 1.549 -3.658
63 HD3 PRO 12 2HD PRO 12 13.817 2.875 -4.086
64 H PHE 13 H PHE 13 10.334 1.419 -4.846
65 HA PHE 13 HA PHE 13 8.255 1.100 -6.884
66 HB2 PHE 13 1HB PHE 13 8.931 -0.737 -4.580
67 HB3 PHE 13 2HB PHE 13 7.869 -1.096 -5.937
68 HD1 PHE 13 HD1 PHE 13 11.342 -0.696 -4.857
69 HD2 PHE 13 HD2 PHE 13 8.759 -1.662 -8.099
70 HE1 PHE 13 HE1 PHE 13 13.256 -1.607 -6.105
71 HE2 PHE 13 HE2 PHE 13 10.669 -2.576 -9.352
72 HZ PHE 13 HZ PHE 13 12.921 -2.550 -8.356
73 H LYS 14 H LYS 14 6.177 1.572 -6.518
74 HA LYS 14 HA LYS 14 5.231 1.904 -3.770
75 HB2 LYS 14 1HB LYS 14 5.882 4.141 -4.384
76 HB3 LYS 14 2HB LYS 14 5.045 4.013 -5.925
77 HG2 LYS 14 1HG LYS 14 2.948 3.614 -4.412
78 HG3 LYS 14 2HG LYS 14 3.937 4.422 -3.192
79 HD2 LYS 14 1HD LYS 14 4.284 6.279 -4.846
80 HD3 LYS 14 2HD LYS 14 3.084 5.497 -5.876
81 HE2 LYS 14 1HE LYS 14 1.763 6.989 -4.739
82 HE3 LYS 14 2HE LYS 14 1.625 5.572 -3.699
83 HZ1 LYS 14 3HZ LYS 14 2.322 8.023 -2.854
84 HZ2 LYS 14 1HZ LYS 14 3.842 7.312 -3.069
85 HZ3 LYS 14 2HZ LYS 14 2.708 6.589 -2.044
86 H CYS 15 H CYS 15 3.278 1.037 -3.480
87 HA CYS 15 HA CYS 15 1.924 -0.207 -5.672
88 HB2 CYS 15 1HB CYS 15 2.025 -1.169 -3.370
89 HB3 CYS 15 2HB CYS 15 0.974 0.132 -2.820
90 H GLU 16 H GLU 16 0.753 0.931 -7.068
91 HA GLU 16 HA GLU 16 -0.353 3.478 -6.512
92 HB2 GLU 16 1HB GLU 16 -1.403 1.793 -8.743
93 HB3 GLU 16 2HB GLU 16 -1.036 3.512 -8.719
94 HG2 GLU 16 1HG GLU 16 0.686 2.791 -9.999
95 HG3 GLU 16 2HG GLU 16 1.429 2.619 -8.410
96 H GLU 17 H GLU 17 -1.536 0.242 -6.160
97 HA GLU 17 HA GLU 17 -4.287 0.638 -6.222
98 HB2 GLU 17 1HB GLU 17 -2.817 -1.224 -4.351
99 HB3 GLU 17 2HB GLU 17 -4.477 -1.381 -4.909
100 HG2 GLU 17 1HG GLU 17 -3.410 -1.467 -7.268
101 HG3 GLU 17 2HG GLU 17 -1.933 -1.863 -6.391
102 H CYS 18 H CYS 18 -2.132 0.722 -3.383
103 HA CYS 18 HA CYS 18 -4.189 2.306 -1.988
104 HB2 CYS 18 1HB CYS 18 -3.260 1.454 0.113
105 HB3 CYS 18 2HB CYS 18 -3.770 0.131 -0.929
106 H GLY 19 H GLY 19 -0.728 1.943 -2.600
107 HA2 GLY 19 1HA GLY 19 0.412 4.101 -3.102
108 HA3 GLY 19 2HA GLY 19 -0.364 4.719 -1.651
109 H LYS 20 H LYS 20 0.722 1.476 -1.500
110 HA LYS 20 HA LYS 20 2.485 2.004 0.643
111 HB2 LYS 20 1HB LYS 20 1.686 -0.365 -0.943
112 HB3 LYS 20 2HB LYS 20 3.242 -0.469 -0.131
113 HG2 LYS 20 1HG LYS 20 1.797 0.422 1.912
114 HG3 LYS 20 2HG LYS 20 0.509 -0.370 1.001
115 HD2 LYS 20 1HD LYS 20 1.530 -2.467 1.157
116 HD3 LYS 20 2HD LYS 20 3.100 -1.773 1.570
117 HE2 LYS 20 1HE LYS 20 2.517 -1.420 3.764
118 HE3 LYS 20 2HE LYS 20 0.796 -1.301 3.399
119 HZ1 LYS 20 3HZ LYS 20 2.455 -3.726 3.684
120 HZ2 LYS 20 1HZ LYS 20 0.995 -3.770 2.829
121 HZ3 LYS 20 2HZ LYS 20 1.005 -3.335 4.464
122 H ARG 21 H ARG 21 4.777 0.730 0.403
123 HA ARG 21 HA ARG 21 6.131 1.526 -2.046
124 HB2 ARG 21 1HB ARG 21 6.952 2.581 0.667
125 HB3 ARG 21 2HB ARG 21 7.874 2.773 -0.818
126 HG2 ARG 21 1HG ARG 21 5.676 3.872 -1.699
127 HG3 ARG 21 2HG ARG 21 5.333 4.083 0.019
128 HD2 ARG 21 1HD ARG 21 7.950 4.927 -1.186
129 HD3 ARG 21 2HD ARG 21 6.538 5.983 -1.208
130 HE ARG 21 HE ARG 21 8.166 5.295 1.075
131 HH11 ARG 21 1HH1 ARG 21 5.112 6.540 -0.040
132 HH12 ARG 21 2HH1 ARG 21 4.768 7.381 1.435
133 HH21 ARG 21 1HH2 ARG 21 7.724 6.397 3.023
134 HH22 ARG 21 2HH2 ARG 21 6.254 7.299 3.177
135 H PHE 22 H PHE 22 8.181 0.540 -2.326
136 HA PHE 22 HA PHE 22 9.113 -1.340 -0.325
137 HB2 PHE 22 1HB PHE 22 8.418 -2.378 -3.072
138 HB3 PHE 22 2HB PHE 22 8.918 -3.306 -1.661
139 HD1 PHE 22 HD2 PHE 22 6.169 -1.336 -3.129
140 HD2 PHE 22 HD1 PHE 22 7.352 -4.016 -0.040
141 HE1 PHE 22 HE2 PHE 22 3.808 -1.675 -2.523
142 HE2 PHE 22 HE1 PHE 22 4.993 -4.360 0.569
143 HZ PHE 22 HZ PHE 22 3.217 -3.188 -0.672
144 H THR 23 H THR 23 11.214 -2.196 -0.788
145 HA THR 23 HA THR 23 12.819 -0.353 -2.343
146 HB THR 23 HB THR 23 13.475 -1.226 -0.047
147 HG1 THR 23 HG1 THR 23 15.042 -1.018 -2.325
148 HG21 THR 23 3HG2 THR 23 14.016 -3.694 -1.693
149 HG22 THR 23 1HG2 THR 23 12.997 -3.556 -0.261
150 HG23 THR 23 2HG2 THR 23 14.747 -3.396 -0.117
151 H GLN 24 H GLN 24 11.274 -3.292 -2.893
152 HA GLN 24 HA GLN 24 12.744 -3.639 -5.387
153 HB2 GLN 24 1HB GLN 24 12.727 -5.560 -3.136
154 HB3 GLN 24 2HB GLN 24 12.461 -6.244 -4.734
155 HG2 GLN 24 1HG GLN 24 14.835 -4.661 -3.792
156 HG3 GLN 24 2HG GLN 24 14.786 -6.361 -4.253
157 HE21 GLN 24 1HE2 GLN 24 13.237 -6.146 -6.561
158 HE22 GLN 24 2HE2 GLN 24 14.154 -5.314 -7.765
159 H ASN 25 H ASN 25 11.561 -4.644 -7.028
160 HA ASN 25 HA ASN 25 8.817 -4.197 -7.060
161 HB2 ASN 25 1HB ASN 25 8.836 -5.041 -9.209
162 HB3 ASN 25 2HB ASN 25 10.544 -4.667 -8.993
163 HD21 ASN 25 1HD2 ASN 25 11.883 -6.486 -8.142
164 HD22 ASN 25 2HD2 ASN 25 11.546 -8.068 -8.752
165 H SER 26 H SER 26 10.519 -7.320 -6.795
166 HA SER 26 HA SER 26 8.516 -9.099 -6.616
167 HB2 SER 26 1HB SER 26 10.973 -8.921 -4.867
168 HB3 SER 26 2HB SER 26 9.897 -10.318 -4.870
169 HG SER 26 HG SER 26 10.907 -9.362 -7.305
170 H GLN 27 H GLN 27 9.454 -6.851 -4.061
171 HA GLN 27 HA GLN 27 7.688 -7.857 -2.090
172 HB2 GLN 27 1HB GLN 27 8.984 -5.149 -2.417
173 HB3 GLN 27 2HB GLN 27 8.051 -5.619 -1.003
174 HG2 GLN 27 1HG GLN 27 9.660 -7.552 -0.750
175 HG3 GLN 27 2HG GLN 27 10.657 -6.753 -1.963
176 HE21 GLN 27 1HE2 GLN 27 10.587 -4.180 -1.353
177 HE22 GLN 27 2HE2 GLN 27 11.195 -3.885 0.237
178 H LEU 28 H LEU 28 7.452 -4.980 -4.185
179 HA LEU 28 HA LEU 28 4.868 -4.231 -3.422
180 HB2 LEU 28 1HB LEU 28 6.246 -2.695 -4.611
181 HB3 LEU 28 2HB LEU 28 6.398 -3.798 -5.977
182 HG LEU 28 HG LEU 28 4.053 -3.445 -6.541
183 HD11 LEU 28 1HD1 LEU 28 2.593 -2.104 -5.344
184 HD12 LEU 28 2HD1 LEU 28 3.891 -1.283 -4.479
185 HD13 LEU 28 3HD1 LEU 28 3.474 -2.947 -4.070
186 HD21 LEU 28 3HD2 LEU 28 4.268 -0.859 -6.890
187 HD22 LEU 28 1HD2 LEU 28 5.344 -1.970 -7.739
188 HD23 LEU 28 2HD2 LEU 28 5.910 -1.123 -6.299
189 H HIS 29 H HIS 29 5.900 -6.073 -6.297
190 HA HIS 29 HA HIS 29 3.350 -6.633 -7.282
191 HB2 HIS 29 1HB HIS 29 5.976 -8.089 -7.547
192 HB3 HIS 29 2HB HIS 29 4.516 -8.639 -8.364
193 HD1 HIS 29 HD1 HIS 29 7.082 -7.641 -9.862
194 HD2 HIS 29 HD2 HIS 29 3.702 -5.352 -9.089
195 HE1 HIS 29 HE1 HIS 29 7.098 -5.814 -11.590
196 H SER 30 H SER 30 5.123 -8.040 -4.658
197 HA SER 30 HA SER 30 3.460 -10.397 -4.493
198 HB2 SER 30 1HB SER 30 5.683 -10.749 -3.767
199 HB3 SER 30 2HB SER 30 5.682 -9.283 -2.787
200 HG SER 30 HG SER 30 5.120 -11.715 -1.997
201 H HIS 31 H HIS 31 3.431 -7.181 -3.280
202 HA HIS 31 HA HIS 31 1.604 -7.798 -1.104
203 HB2 HIS 31 1HB HIS 31 2.931 -6.073 -0.387
204 HB3 HIS 31 2HB HIS 31 3.117 -5.400 -2.003
205 HD1 HIS 31 HD1 HIS 31 0.715 -5.448 0.898
206 HD2 HIS 31 HD2 HIS 31 1.344 -3.390 -2.656
207 HE1 HIS 31 HE1 HIS 31 -0.870 -3.497 0.962
208 H GLN 32 H GLN 32 1.567 -6.118 -4.221
209 HA GLN 32 HA GLN 32 -0.942 -5.033 -4.243
210 HB2 GLN 32 1HB GLN 32 0.704 -6.303 -6.404
211 HB3 GLN 32 2HB GLN 32 -0.910 -5.705 -6.761
212 HG2 GLN 32 1HG GLN 32 -0.274 -3.481 -6.040
213 HG3 GLN 32 2HG GLN 32 1.330 -4.064 -5.600
214 HE21 GLN 32 1HE2 GLN 32 1.881 -2.256 -7.094
215 HE22 GLN 32 2HE2 GLN 32 2.029 -2.629 -8.774
216 H ARG 33 H ARG 33 -0.085 -8.387 -4.312
217 HA ARG 33 HA ARG 33 -2.330 -9.555 -5.433
218 HB2 ARG 33 1HB ARG 33 -0.984 -10.692 -2.994
219 HB3 ARG 33 2HB ARG 33 -1.705 -11.553 -4.347
220 HG2 ARG 33 1HG ARG 33 0.128 -10.480 -5.770
221 HG3 ARG 33 2HG ARG 33 0.909 -10.096 -4.235
222 HD2 ARG 33 1HD ARG 33 1.805 -12.166 -5.045
223 HD3 ARG 33 2HD ARG 33 0.794 -12.506 -3.641
224 HE ARG 33 HE ARG 33 -0.656 -13.669 -4.995
225 HH11 ARG 33 1HH1 ARG 33 1.599 -11.876 -6.951
226 HH12 ARG 33 2HH1 ARG 33 1.131 -12.649 -8.430
227 HH21 ARG 33 1HH2 ARG 33 -1.280 -14.694 -6.935
228 HH22 ARG 33 2HH2 ARG 33 -0.507 -14.251 -8.419
229 H VAL 34 H VAL 34 -1.892 -8.161 -2.248
230 HA VAL 34 HA VAL 34 -4.117 -9.193 -0.934
231 HB VAL 34 HB VAL 34 -3.966 -7.356 0.586
232 HG11 VAL 34 1HG1 VAL 34 -1.520 -8.619 -0.425
233 HG12 VAL 34 2HG1 VAL 34 -1.256 -7.164 0.538
234 HG13 VAL 34 3HG1 VAL 34 -2.154 -8.522 1.217
235 HG21 VAL 34 3HG2 VAL 34 -2.564 -5.368 0.081
236 HG22 VAL 34 1HG2 VAL 34 -2.401 -5.952 -1.575
237 HG23 VAL 34 2HG2 VAL 34 -3.988 -5.504 -0.950
238 H HIS 35 H HIS 35 -3.865 -6.611 -3.286
239 HA HIS 35 HA HIS 35 -6.567 -5.693 -2.890
240 HB2 HIS 35 1HB HIS 35 -4.492 -5.076 -4.997
241 HB3 HIS 35 2HB HIS 35 -6.092 -4.341 -4.966
242 HD1 HIS 35 HD1 HIS 35 -6.620 -2.907 -2.727
243 HD2 HIS 35 HD2 HIS 35 -2.632 -3.798 -3.476
244 HE1 HIS 35 HE1 HIS 35 -5.296 -1.306 -1.310
245 H THR 36 H THR 36 -4.938 -8.018 -4.881
246 HA THR 36 HA THR 36 -7.129 -8.287 -6.750
247 HB THR 36 HB THR 36 -5.829 -10.114 -7.734
248 HG1 THR 36 HG1 THR 36 -4.425 -11.123 -6.527
249 HG21 THR 36 3HG2 THR 36 -4.971 -8.328 -8.797
250 HG22 THR 36 1HG2 THR 36 -3.550 -8.605 -7.791
251 HG23 THR 36 2HG2 THR 36 -4.760 -7.420 -7.300
252 H GLY 37 H GLY 37 -7.905 -8.674 -4.056
253 HA2 GLY 37 1HA GLY 37 -8.789 -11.477 -4.221
254 HA3 GLY 37 2HA GLY 37 -8.117 -10.865 -2.716
255 H GLU 38 H GLU 38 -9.211 -8.693 -2.030
256 HA GLU 38 HA GLU 38 -11.971 -9.302 -1.613
257 HB2 GLU 38 1HB GLU 38 -12.015 -7.210 -0.320
258 HB3 GLU 38 2HB GLU 38 -10.661 -8.234 0.137
259 HG2 GLU 38 1HG GLU 38 -9.353 -6.787 -1.594
260 HG3 GLU 38 2HG GLU 38 -10.665 -5.641 -1.328
261 H LYS 39 H LYS 39 -13.744 -8.508 -2.589
262 HA LYS 39 HA LYS 39 -13.922 -7.662 -5.108
263 HB2 LYS 39 1HB LYS 39 -15.767 -7.982 -3.258
264 HB3 LYS 39 2HB LYS 39 -15.681 -6.228 -3.158
265 HG2 LYS 39 1HG LYS 39 -16.195 -6.070 -5.546
266 HG3 LYS 39 2HG LYS 39 -16.298 -7.830 -5.633
267 HD2 LYS 39 1HD LYS 39 -18.201 -7.872 -4.208
268 HD3 LYS 39 2HD LYS 39 -17.999 -6.171 -3.781
269 HE2 LYS 39 1HE LYS 39 -18.303 -5.744 -6.311
270 HE3 LYS 39 2HE LYS 39 -18.970 -7.376 -6.349
271 HZ1 LYS 39 3HZ LYS 39 -20.377 -5.140 -5.809
272 HZ2 LYS 39 1HZ LYS 39 -20.050 -5.721 -4.254
273 HZ3 LYS 39 2HZ LYS 39 -20.847 -6.706 -5.373
274 HA PRO 40 HA PRO 40 -11.892 -3.755 -5.449
275 HB2 PRO 40 1HB PRO 40 -12.868 -3.041 -7.880
276 HB3 PRO 40 2HB PRO 40 -11.617 -4.273 -7.671
277 HG2 PRO 40 1HG PRO 40 -14.562 -4.616 -8.089
278 HG3 PRO 40 2HG PRO 40 -13.216 -5.510 -8.820
279 HD2 PRO 40 1HD PRO 40 -14.658 -6.486 -6.747
280 HD3 PRO 40 2HD PRO 40 -12.935 -6.850 -6.966
281 H SER 41 H SER 41 -12.355 -1.734 -4.801
282 HA SER 41 HA SER 41 -15.172 -0.869 -4.877
283 HB2 SER 41 1HB SER 41 -14.709 0.381 -2.772
284 HB3 SER 41 2HB SER 41 -14.548 -1.365 -2.583
285 HG SER 41 HG SER 41 -12.436 0.497 -2.947
286 H GLY 42 H GLY 42 -15.561 1.383 -5.138
287 HA2 GLY 42 1HA GLY 42 -15.220 3.421 -6.136
288 HA3 GLY 42 2HA GLY 42 -13.603 3.352 -5.451
289 HA PRO 43 HA PRO 43 -13.352 3.278 -10.114
290 HB2 PRO 43 1HB PRO 43 -11.649 5.382 -10.320
291 HB3 PRO 43 2HB PRO 43 -13.407 5.569 -10.287
292 HG2 PRO 43 1HG PRO 43 -11.424 5.914 -8.071
293 HG3 PRO 43 2HG PRO 43 -12.822 6.922 -8.489
294 HD2 PRO 43 1HD PRO 43 -12.881 5.109 -6.478
295 HD3 PRO 43 2HD PRO 43 -14.313 5.503 -7.450
296 H SER 44 H SER 44 -12.039 1.665 -10.684
297 HA SER 44 HA SER 44 -9.360 1.513 -9.491
298 HB2 SER 44 1HB SER 44 -11.152 -0.538 -10.778
299 HB3 SER 44 2HB SER 44 -9.430 -0.840 -10.548
300 HG SER 44 HG SER 44 -10.091 -0.039 -8.252
301 H SER 45 H SER 45 -7.559 0.903 -10.869
302 HA SER 45 HA SER 45 -7.684 2.310 -13.414
303 HB2 SER 45 1HB SER 45 -5.192 1.979 -13.394
304 HB3 SER 45 2HB SER 45 -5.813 2.878 -12.010
305 HG SER 45 HG SER 45 -5.668 0.136 -11.686
306 H GLY 46 H GLY 46 -6.660 1.374 -15.341
307 HA2 GLY 46 1HA GLY 46 -6.828 -1.570 -15.413
308 HA3 GLY 46 2HA GLY 46 -7.660 -0.599 -16.618
Start of MODEL 5
1 H1 GLY 1 H GLY 1 -0.009 8.341 27.148
2 HA2 GLY 1 1HA GLY 1 1.251 10.677 26.230
3 HA3 GLY 1 2HA GLY 1 2.451 9.395 26.292
4 H SER 2 H SER 2 2.095 10.376 23.889
5 HA SER 2 HA SER 2 0.113 8.714 22.507
6 HB2 SER 2 1HB SER 2 0.368 11.262 22.116
7 HB3 SER 2 2HB SER 2 1.804 10.827 21.189
8 HG SER 2 HG SER 2 0.138 9.247 20.195
9 H SER 3 H SER 3 0.704 7.449 20.690
10 HA SER 3 HA SER 3 3.572 6.820 20.487
11 HB2 SER 3 1HB SER 3 2.687 5.033 21.793
12 HB3 SER 3 2HB SER 3 1.266 4.889 20.759
13 HG SER 3 HG SER 3 3.830 3.911 20.403
14 H GLY 4 H GLY 4 3.610 8.123 18.592
15 HA2 GLY 4 1HA GLY 4 2.698 6.661 16.231
16 HA3 GLY 4 2HA GLY 4 2.123 8.312 16.418
17 H SER 5 H SER 5 4.670 6.312 15.370
18 HA SER 5 HA SER 5 6.251 8.697 14.690
19 HB2 SER 5 1HB SER 5 7.215 6.112 15.898
20 HB3 SER 5 2HB SER 5 8.295 7.145 14.962
21 HG SER 5 HG SER 5 7.623 8.862 16.447
22 H SER 6 H SER 6 5.602 8.767 12.575
23 HA SER 6 HA SER 6 6.660 6.654 10.860
24 HB2 SER 6 1HB SER 6 4.602 6.526 9.538
25 HB3 SER 6 2HB SER 6 4.284 6.080 11.214
26 HG SER 6 HG SER 6 2.692 7.496 10.535
27 H GLY 7 H GLY 7 8.098 7.761 9.694
28 HA2 GLY 7 1HA GLY 7 7.464 10.490 8.836
29 HA3 GLY 7 2HA GLY 7 9.049 9.731 8.784
30 H SER 8 H SER 8 9.745 9.413 6.790
31 HA SER 8 HA SER 8 8.023 8.177 4.818
32 HB2 SER 8 1HB SER 8 8.418 9.921 3.112
33 HB3 SER 8 2HB SER 8 7.506 10.546 4.486
34 HG SER 8 HG SER 8 9.645 11.587 3.512
35 H GLY 9 H GLY 9 9.152 6.824 3.558
36 HA2 GLY 9 1HA GLY 9 12.096 7.075 3.609
37 HA3 GLY 9 2HA GLY 9 11.243 5.539 3.558
38 H GLU 10 H GLU 10 13.276 6.725 1.744
39 HA GLU 10 HA GLU 10 11.884 7.307 -0.708
40 HB2 GLU 10 1HB GLU 10 14.770 6.964 0.047
41 HB3 GLU 10 2HB GLU 10 14.290 7.045 -1.642
42 HG2 GLU 10 1HG GLU 10 13.203 9.230 -1.161
43 HG3 GLU 10 2HG GLU 10 13.882 9.153 0.464
44 H LYS 11 H LYS 11 10.967 5.808 -1.926
45 HA LYS 11 HA LYS 11 12.327 3.238 -2.293
46 HB2 LYS 11 1HB LYS 11 9.515 3.663 -1.341
47 HB3 LYS 11 2HB LYS 11 9.916 2.236 -2.287
48 HG2 LYS 11 1HG LYS 11 11.305 1.377 -0.641
49 HG3 LYS 11 2HG LYS 11 11.510 2.945 0.142
50 HD2 LYS 11 1HD LYS 11 9.039 2.840 0.691
51 HD3 LYS 11 2HD LYS 11 9.089 1.154 0.172
52 HE2 LYS 11 1HE LYS 11 11.001 2.212 2.227
53 HE3 LYS 11 2HE LYS 11 9.381 1.678 2.675
54 HZ1 LYS 11 3HZ LYS 11 10.086 -0.425 1.325
55 HZ2 LYS 11 1HZ LYS 11 10.559 -0.242 2.939
56 HZ3 LYS 11 2HZ LYS 11 11.651 0.103 1.693
57 HA PRO 12 HA PRO 12 11.496 4.321 -6.514
58 HB2 PRO 12 1HB PRO 12 12.413 2.015 -7.615
59 HB3 PRO 12 2HB PRO 12 13.485 3.280 -7.003
60 HG2 PRO 12 1HG PRO 12 12.624 0.730 -5.693
61 HG3 PRO 12 2HG PRO 12 14.233 1.472 -5.747
62 HD2 PRO 12 1HD PRO 12 12.608 1.673 -3.590
63 HD3 PRO 12 2HD PRO 12 13.744 2.957 -4.053
64 H PHE 13 H PHE 13 10.194 1.604 -4.813
65 HA PHE 13 HA PHE 13 8.202 1.191 -6.941
66 HB2 PHE 13 1HB PHE 13 8.930 -0.676 -4.674
67 HB3 PHE 13 2HB PHE 13 7.811 -1.019 -5.990
68 HD1 PHE 13 HD1 PHE 13 11.318 -0.685 -5.030
69 HD2 PHE 13 HD2 PHE 13 8.618 -1.516 -8.214
70 HE1 PHE 13 HE1 PHE 13 13.177 -1.587 -6.366
71 HE2 PHE 13 HE2 PHE 13 10.472 -2.421 -9.554
72 HZ PHE 13 HZ PHE 13 12.755 -2.458 -8.631
73 H LYS 14 H LYS 14 6.110 1.608 -6.555
74 HA LYS 14 HA LYS 14 5.188 1.929 -3.798
75 HB2 LYS 14 1HB LYS 14 5.820 4.175 -4.485
76 HB3 LYS 14 2HB LYS 14 4.872 4.021 -5.959
77 HG2 LYS 14 1HG LYS 14 2.867 3.671 -4.400
78 HG3 LYS 14 2HG LYS 14 3.918 4.313 -3.135
79 HD2 LYS 14 1HD LYS 14 4.276 6.337 -4.498
80 HD3 LYS 14 2HD LYS 14 3.165 5.696 -5.711
81 HE2 LYS 14 1HE LYS 14 1.424 5.590 -3.893
82 HE3 LYS 14 2HE LYS 14 2.544 6.490 -2.872
83 HZ1 LYS 14 3HZ LYS 14 2.314 7.799 -5.346
84 HZ2 LYS 14 1HZ LYS 14 1.867 8.358 -3.813
85 HZ3 LYS 14 2HZ LYS 14 0.757 7.499 -4.757
86 H CYS 15 H CYS 15 3.268 1.002 -3.487
87 HA CYS 15 HA CYS 15 1.912 -0.273 -5.653
88 HB2 CYS 15 1HB CYS 15 2.045 -1.221 -3.353
89 HB3 CYS 15 2HB CYS 15 0.993 0.074 -2.792
90 H GLU 16 H GLU 16 0.858 0.976 -7.076
91 HA GLU 16 HA GLU 16 -0.342 3.453 -6.509
92 HB2 GLU 16 1HB GLU 16 -1.351 1.756 -8.752
93 HB3 GLU 16 2HB GLU 16 -1.019 3.482 -8.720
94 HG2 GLU 16 1HG GLU 16 0.727 2.805 -9.990
95 HG3 GLU 16 2HG GLU 16 1.463 2.632 -8.397
96 H GLU 17 H GLU 17 -1.474 0.201 -6.160
97 HA GLU 17 HA GLU 17 -4.227 0.530 -6.251
98 HB2 GLU 17 1HB GLU 17 -2.786 -1.248 -4.284
99 HB3 GLU 17 2HB GLU 17 -4.395 -1.477 -4.953
100 HG2 GLU 17 1HG GLU 17 -3.145 -1.555 -7.230
101 HG3 GLU 17 2HG GLU 17 -1.736 -1.906 -6.231
102 H CYS 18 H CYS 18 -2.124 0.710 -3.376
103 HA CYS 18 HA CYS 18 -4.222 2.311 -2.063
104 HB2 CYS 18 1HB CYS 18 -3.323 1.493 0.084
105 HB3 CYS 18 2HB CYS 18 -3.887 0.174 -0.936
106 H GLY 19 H GLY 19 -0.751 1.920 -2.579
107 HA2 GLY 19 1HA GLY 19 0.385 4.098 -3.072
108 HA3 GLY 19 2HA GLY 19 -0.381 4.686 -1.603
109 H LYS 20 H LYS 20 0.668 1.440 -1.488
110 HA LYS 20 HA LYS 20 2.467 1.932 0.632
111 HB2 LYS 20 1HB LYS 20 1.632 -0.423 -0.967
112 HB3 LYS 20 2HB LYS 20 3.177 -0.547 -0.136
113 HG2 LYS 20 1HG LYS 20 1.829 0.278 1.929
114 HG3 LYS 20 2HG LYS 20 0.433 -0.277 1.001
115 HD2 LYS 20 1HD LYS 20 0.960 -2.176 2.191
116 HD3 LYS 20 2HD LYS 20 1.872 -2.444 0.704
117 HE2 LYS 20 1HE LYS 20 3.296 -2.958 2.557
118 HE3 LYS 20 2HE LYS 20 3.863 -1.456 1.830
119 HZ1 LYS 20 3HZ LYS 20 2.861 -1.937 4.471
120 HZ2 LYS 20 1HZ LYS 20 2.097 -0.628 3.720
121 HZ3 LYS 20 2HZ LYS 20 3.780 -0.643 3.885
122 H ARG 21 H ARG 21 4.743 0.670 0.388
123 HA ARG 21 HA ARG 21 6.079 1.408 -2.089
124 HB2 ARG 21 1HB ARG 21 6.942 2.517 0.589
125 HB3 ARG 21 2HB ARG 21 7.825 2.693 -0.922
126 HG2 ARG 21 1HG ARG 21 5.575 3.754 -1.751
127 HG3 ARG 21 2HG ARG 21 5.317 4.015 -0.025
128 HD2 ARG 21 1HD ARG 21 7.804 4.922 -0.175
129 HD3 ARG 21 2HD ARG 21 7.336 5.202 -1.852
130 HE ARG 21 HE ARG 21 5.309 6.245 -0.285
131 HH11 ARG 21 1HH1 ARG 21 8.713 6.787 -0.773
132 HH12 ARG 21 2HH1 ARG 21 8.634 8.473 -0.381
133 HH21 ARG 21 1HH2 ARG 21 5.192 8.463 0.233
134 HH22 ARG 21 2HH2 ARG 21 6.630 9.425 0.193
135 H PHE 22 H PHE 22 8.220 0.502 -2.277
136 HA PHE 22 HA PHE 22 9.117 -1.368 -0.266
137 HB2 PHE 22 1HB PHE 22 8.469 -2.461 -3.002
138 HB3 PHE 22 2HB PHE 22 8.938 -3.357 -1.561
139 HD1 PHE 22 HD2 PHE 22 6.224 -1.347 -3.065
140 HD2 PHE 22 HD1 PHE 22 7.333 -4.111 -0.024
141 HE1 PHE 22 HE2 PHE 22 3.851 -1.676 -2.504
142 HE2 PHE 22 HE1 PHE 22 4.962 -4.445 0.542
143 HZ PHE 22 HZ PHE 22 3.218 -3.226 -0.698
144 H THR 23 H THR 23 11.228 -2.218 -0.699
145 HA THR 23 HA THR 23 12.847 -0.378 -2.228
146 HB THR 23 HB THR 23 13.579 -1.176 0.001
147 HG1 THR 23 HG1 THR 23 15.368 -2.069 -2.023
148 HG21 THR 23 3HG2 THR 23 13.280 -3.786 -1.334
149 HG22 THR 23 1HG2 THR 23 13.148 -3.364 0.373
150 HG23 THR 23 2HG2 THR 23 14.736 -3.599 -0.357
151 H GLN 24 H GLN 24 11.289 -3.301 -2.842
152 HA GLN 24 HA GLN 24 12.807 -3.622 -5.319
153 HB2 GLN 24 1HB GLN 24 12.605 -5.604 -3.126
154 HB3 GLN 24 2HB GLN 24 12.390 -6.224 -4.757
155 HG2 GLN 24 1HG GLN 24 14.776 -4.736 -3.689
156 HG3 GLN 24 2HG GLN 24 14.689 -6.445 -4.116
157 HE21 GLN 24 1HE2 GLN 24 13.249 -6.212 -6.500
158 HE22 GLN 24 2HE2 GLN 24 14.257 -5.446 -7.676
159 H ASN 25 H ASN 25 11.670 -4.900 -6.939
160 HA ASN 25 HA ASN 25 8.925 -4.212 -7.080
161 HB2 ASN 25 1HB ASN 25 8.954 -5.615 -9.168
162 HB3 ASN 25 2HB ASN 25 10.178 -4.351 -9.120
163 HD21 ASN 25 1HD2 ASN 25 12.347 -4.926 -8.770
164 HD22 ASN 25 2HD2 ASN 25 12.909 -6.532 -9.071
165 H SER 26 H SER 26 10.592 -7.327 -6.675
166 HA SER 26 HA SER 26 8.500 -9.072 -6.654
167 HB2 SER 26 1HB SER 26 10.990 -9.546 -6.270
168 HB3 SER 26 2HB SER 26 10.670 -9.233 -4.565
169 HG SER 26 HG SER 26 10.061 -11.420 -6.083
170 H GLN 27 H GLN 27 9.466 -6.887 -4.065
171 HA GLN 27 HA GLN 27 7.687 -7.902 -2.106
172 HB2 GLN 27 1HB GLN 27 9.004 -5.198 -2.387
173 HB3 GLN 27 2HB GLN 27 8.087 -5.702 -0.974
174 HG2 GLN 27 1HG GLN 27 9.695 -7.648 -0.796
175 HG3 GLN 27 2HG GLN 27 10.681 -6.811 -1.995
176 HE21 GLN 27 1HE2 GLN 27 10.831 -4.330 -1.371
177 HE22 GLN 27 2HE2 GLN 27 11.371 -4.056 0.247
178 H LEU 28 H LEU 28 7.494 -4.993 -4.161
179 HA LEU 28 HA LEU 28 4.931 -4.202 -3.390
180 HB2 LEU 28 1HB LEU 28 6.315 -2.687 -4.589
181 HB3 LEU 28 2HB LEU 28 6.460 -3.799 -5.949
182 HG LEU 28 HG LEU 28 4.131 -3.418 -6.536
183 HD11 LEU 28 1HD1 LEU 28 2.657 -2.101 -5.340
184 HD12 LEU 28 2HD1 LEU 28 3.943 -1.266 -4.469
185 HD13 LEU 28 3HD1 LEU 28 3.539 -2.933 -4.058
186 HD21 LEU 28 3HD2 LEU 28 4.303 -1.018 -7.145
187 HD22 LEU 28 1HD2 LEU 28 5.747 -1.951 -7.542
188 HD23 LEU 28 2HD2 LEU 28 5.739 -0.899 -6.126
189 H HIS 29 H HIS 29 5.894 -6.046 -6.288
190 HA HIS 29 HA HIS 29 3.318 -6.566 -7.230
191 HB2 HIS 29 1HB HIS 29 5.945 -7.992 -7.574
192 HB3 HIS 29 2HB HIS 29 4.471 -8.609 -8.313
193 HD1 HIS 29 HD1 HIS 29 5.475 -8.167 -10.673
194 HD2 HIS 29 HD2 HIS 29 4.982 -4.762 -8.344
195 HE1 HIS 29 HE1 HIS 29 5.725 -6.229 -12.255
196 H SER 30 H SER 30 5.130 -8.022 -4.659
197 HA SER 30 HA SER 30 3.472 -10.375 -4.485
198 HB2 SER 30 1HB SER 30 5.765 -10.594 -3.785
199 HB3 SER 30 2HB SER 30 5.603 -9.247 -2.659
200 HG SER 30 HG SER 30 4.435 -10.486 -1.316
201 H HIS 31 H HIS 31 3.448 -7.165 -3.225
202 HA HIS 31 HA HIS 31 1.589 -7.810 -1.085
203 HB2 HIS 31 1HB HIS 31 2.930 -6.114 -0.320
204 HB3 HIS 31 2HB HIS 31 3.128 -5.404 -1.920
205 HD1 HIS 31 HD1 HIS 31 0.926 -5.333 1.088
206 HD2 HIS 31 HD2 HIS 31 1.152 -3.543 -2.655
207 HE1 HIS 31 HE1 HIS 31 -0.704 -3.420 1.159
208 H GLN 32 H GLN 32 1.603 -6.116 -4.188
209 HA GLN 32 HA GLN 32 -0.900 -4.995 -4.210
210 HB2 GLN 32 1HB GLN 32 0.762 -6.233 -6.380
211 HB3 GLN 32 2HB GLN 32 -0.839 -5.601 -6.739
212 HG2 GLN 32 1HG GLN 32 -0.200 -3.405 -6.043
213 HG3 GLN 32 2HG GLN 32 1.353 -3.995 -5.453
214 HE21 GLN 32 1HE2 GLN 32 1.757 -2.047 -7.008
215 HE22 GLN 32 2HE2 GLN 32 2.169 -2.495 -8.625
216 H ARG 33 H ARG 33 -0.074 -8.340 -4.246
217 HA ARG 33 HA ARG 33 -2.315 -9.471 -5.449
218 HB2 ARG 33 1HB ARG 33 -0.990 -10.684 -3.036
219 HB3 ARG 33 2HB ARG 33 -1.698 -11.499 -4.424
220 HG2 ARG 33 1HG ARG 33 0.137 -10.498 -5.818
221 HG3 ARG 33 2HG ARG 33 0.887 -9.973 -4.309
222 HD2 ARG 33 1HD ARG 33 1.026 -12.272 -3.547
223 HD3 ARG 33 2HD ARG 33 0.192 -12.825 -4.999
224 HE ARG 33 HE ARG 33 2.315 -11.571 -6.036
225 HH11 ARG 33 1HH1 ARG 33 2.037 -13.898 -3.462
226 HH12 ARG 33 2HH1 ARG 33 3.604 -14.584 -3.737
227 HH21 ARG 33 1HH2 ARG 33 4.381 -12.465 -6.407
228 HH22 ARG 33 2HH2 ARG 33 4.937 -13.768 -5.412
229 H VAL 34 H VAL 34 -1.889 -8.114 -2.255
230 HA VAL 34 HA VAL 34 -4.129 -9.181 -0.970
231 HB VAL 34 HB VAL 34 -3.949 -7.411 0.616
232 HG11 VAL 34 1HG1 VAL 34 -2.141 -8.627 1.179
233 HG12 VAL 34 2HG1 VAL 34 -1.496 -8.620 -0.464
234 HG13 VAL 34 3HG1 VAL 34 -1.248 -7.226 0.588
235 HG21 VAL 34 3HG2 VAL 34 -3.972 -5.492 -0.816
236 HG22 VAL 34 1HG2 VAL 34 -2.512 -5.419 0.171
237 HG23 VAL 34 2HG2 VAL 34 -2.413 -5.930 -1.514
238 H HIS 35 H HIS 35 -3.846 -6.653 -3.341
239 HA HIS 35 HA HIS 35 -6.510 -5.628 -2.892
240 HB2 HIS 35 1HB HIS 35 -4.395 -5.063 -4.967
241 HB3 HIS 35 2HB HIS 35 -5.999 -4.337 -5.033
242 HD1 HIS 35 HD1 HIS 35 -6.632 -2.775 -2.947
243 HD2 HIS 35 HD2 HIS 35 -2.622 -3.799 -3.315
244 HE1 HIS 35 HE1 HIS 35 -5.385 -1.143 -1.495
245 H THR 36 H THR 36 -5.007 -8.062 -4.818
246 HA THR 36 HA THR 36 -7.178 -8.245 -6.721
247 HB THR 36 HB THR 36 -5.976 -10.197 -7.613
248 HG1 THR 36 HG1 THR 36 -5.053 -11.055 -5.757
249 HG21 THR 36 3HG2 THR 36 -4.436 -8.936 -8.703
250 HG22 THR 36 1HG2 THR 36 -3.762 -8.277 -7.213
251 HG23 THR 36 2HG2 THR 36 -5.260 -7.618 -7.871
252 H GLY 37 H GLY 37 -5.990 -10.058 -3.922
253 HA2 GLY 37 1HA GLY 37 -7.882 -12.174 -4.143
254 HA3 GLY 37 2HA GLY 37 -6.919 -11.789 -2.725
255 H GLU 38 H GLU 38 -7.822 -9.161 -2.285
256 HA GLU 38 HA GLU 38 -10.645 -9.646 -1.587
257 HB2 GLU 38 1HB GLU 38 -8.443 -8.322 -0.019
258 HB3 GLU 38 2HB GLU 38 -10.138 -8.026 0.343
259 HG2 GLU 38 1HG GLU 38 -10.507 -10.242 0.989
260 HG3 GLU 38 2HG GLU 38 -9.018 -10.802 0.231
261 H LYS 39 H LYS 39 -11.200 -8.635 -3.616
262 HA LYS 39 HA LYS 39 -10.514 -6.239 -4.645
263 HB2 LYS 39 1HB LYS 39 -12.777 -6.026 -5.528
264 HB3 LYS 39 2HB LYS 39 -12.239 -7.698 -5.613
265 HG2 LYS 39 1HG LYS 39 -13.867 -6.741 -3.295
266 HG3 LYS 39 2HG LYS 39 -14.635 -7.191 -4.819
267 HD2 LYS 39 1HD LYS 39 -13.362 -9.381 -4.643
268 HD3 LYS 39 2HD LYS 39 -12.984 -8.912 -2.984
269 HE2 LYS 39 1HE LYS 39 -14.897 -10.262 -2.813
270 HE3 LYS 39 2HE LYS 39 -15.492 -8.609 -2.671
271 HZ1 LYS 39 3HZ LYS 39 -16.919 -9.787 -4.141
272 HZ2 LYS 39 1HZ LYS 39 -15.621 -10.357 -5.064
273 HZ3 LYS 39 2HZ LYS 39 -16.014 -8.712 -5.083
274 HA PRO 40 HA PRO 40 -11.367 -3.049 -1.743
275 HB2 PRO 40 1HB PRO 40 -11.827 -0.976 -3.434
276 HB3 PRO 40 2HB PRO 40 -10.216 -1.647 -3.153
277 HG2 PRO 40 1HG PRO 40 -12.110 -2.153 -5.415
278 HG3 PRO 40 2HG PRO 40 -10.357 -1.887 -5.462
279 HD2 PRO 40 1HD PRO 40 -11.461 -4.354 -5.627
280 HD3 PRO 40 2HD PRO 40 -9.884 -4.062 -4.865
281 H SER 41 H SER 41 -13.158 -2.843 -0.571
282 HA SER 41 HA SER 41 -15.769 -3.131 -1.747
283 HB2 SER 41 1HB SER 41 -14.703 -2.837 1.035
284 HB3 SER 41 2HB SER 41 -16.416 -2.536 0.740
285 HG SER 41 HG SER 41 -15.023 -4.899 0.758
286 H GLY 42 H GLY 42 -17.264 -1.585 -2.151
287 HA2 GLY 42 1HA GLY 42 -18.276 0.524 -2.037
288 HA3 GLY 42 2HA GLY 42 -16.879 1.122 -1.154
289 HA PRO 43 HA PRO 43 -16.472 1.525 -5.998
290 HB2 PRO 43 1HB PRO 43 -18.569 3.016 -6.863
291 HB3 PRO 43 2HB PRO 43 -18.579 1.248 -6.869
292 HG2 PRO 43 1HG PRO 43 -19.788 3.142 -4.892
293 HG3 PRO 43 2HG PRO 43 -20.473 1.660 -5.583
294 HD2 PRO 43 1HD PRO 43 -19.372 1.741 -3.110
295 HD3 PRO 43 2HD PRO 43 -19.301 0.296 -4.140
296 H SER 44 H SER 44 -14.796 2.859 -5.179
297 HA SER 44 HA SER 44 -15.505 5.694 -4.823
298 HB2 SER 44 1HB SER 44 -13.326 5.917 -3.674
299 HB3 SER 44 2HB SER 44 -14.361 4.721 -2.893
300 HG SER 44 HG SER 44 -13.153 3.096 -3.819
301 H SER 45 H SER 45 -13.108 3.551 -6.330
302 HA SER 45 HA SER 45 -12.632 5.650 -8.341
303 HB2 SER 45 1HB SER 45 -10.729 5.170 -6.645
304 HB3 SER 45 2HB SER 45 -10.504 3.674 -7.551
305 HG SER 45 HG SER 45 -10.701 5.970 -9.077
306 H GLY 46 H GLY 46 -11.816 4.800 -10.429
307 HA2 GLY 46 1HA GLY 46 -12.661 2.028 -10.948
308 HA3 GLY 46 2HA GLY 46 -13.314 3.332 -11.927
Start of MODEL 6
1 H1 GLY 1 H GLY 1 -0.169 12.266 16.791
2 HA2 GLY 1 1HA GLY 1 -0.751 11.813 19.481
3 HA3 GLY 1 2HA GLY 1 -0.412 10.248 18.757
4 H SER 2 H SER 2 1.648 10.368 17.270
5 HA SER 2 HA SER 2 3.730 11.847 18.740
6 HB2 SER 2 1HB SER 2 3.740 8.984 17.786
7 HB3 SER 2 2HB SER 2 5.227 9.850 18.174
8 HG SER 2 HG SER 2 3.138 9.041 19.865
9 H SER 3 H SER 3 4.965 13.115 17.525
10 HA SER 3 HA SER 3 4.533 13.461 14.774
11 HB2 SER 3 1HB SER 3 6.358 15.034 14.835
12 HB3 SER 3 2HB SER 3 5.462 15.186 16.346
13 HG SER 3 HG SER 3 8.004 14.802 16.126
14 H GLY 4 H GLY 4 5.144 12.229 13.131
15 HA2 GLY 4 1HA GLY 4 6.721 9.960 13.291
16 HA3 GLY 4 2HA GLY 4 6.398 10.837 11.803
17 H SER 5 H SER 5 8.814 9.463 12.447
18 HA SER 5 HA SER 5 10.685 11.739 12.547
19 HB2 SER 5 1HB SER 5 12.346 10.206 13.549
20 HB3 SER 5 2HB SER 5 10.912 10.370 14.561
21 HG SER 5 HG SER 5 11.107 8.285 12.679
22 H SER 6 H SER 6 12.445 11.707 11.143
23 HA SER 6 HA SER 6 12.014 10.632 8.604
24 HB2 SER 6 1HB SER 6 14.126 11.521 8.005
25 HB3 SER 6 2HB SER 6 13.525 12.590 9.273
26 HG SER 6 HG SER 6 15.686 12.022 9.659
27 H GLY 7 H GLY 7 13.710 9.232 7.450
28 HA2 GLY 7 1HA GLY 7 15.408 7.413 8.346
29 HA3 GLY 7 2HA GLY 7 13.906 6.741 8.964
30 H SER 8 H SER 8 15.080 5.051 7.428
31 HA SER 8 HA SER 8 15.192 5.027 4.766
32 HB2 SER 8 1HB SER 8 13.886 2.940 6.519
33 HB3 SER 8 2HB SER 8 14.244 2.679 4.813
34 HG SER 8 HG SER 8 16.049 1.976 5.726
35 H GLY 9 H GLY 9 13.956 5.858 3.226
36 HA2 GLY 9 1HA GLY 9 11.090 5.285 3.233
37 HA3 GLY 9 2HA GLY 9 11.564 6.977 3.228
38 H GLU 10 H GLU 10 13.910 6.556 1.567
39 HA GLU 10 HA GLU 10 12.834 7.032 -0.944
40 HB2 GLU 10 1HB GLU 10 15.280 7.298 0.041
41 HB3 GLU 10 2HB GLU 10 15.521 5.750 -0.755
42 HG2 GLU 10 1HG GLU 10 14.456 8.193 -2.145
43 HG3 GLU 10 2HG GLU 10 16.161 7.747 -2.105
44 H LYS 11 H LYS 11 11.389 5.599 -1.754
45 HA LYS 11 HA LYS 11 12.411 2.909 -2.370
46 HB2 LYS 11 1HB LYS 11 9.631 3.631 -1.429
47 HB3 LYS 11 2HB LYS 11 10.081 2.056 -2.069
48 HG2 LYS 11 1HG LYS 11 11.801 1.939 -0.224
49 HG3 LYS 11 2HG LYS 11 11.016 3.358 0.471
50 HD2 LYS 11 1HD LYS 11 8.890 2.115 0.546
51 HD3 LYS 11 2HD LYS 11 9.717 0.692 -0.091
52 HE2 LYS 11 1HE LYS 11 10.793 2.007 2.356
53 HE3 LYS 11 2HE LYS 11 9.344 1.013 2.496
54 HZ1 LYS 11 3HZ LYS 11 11.948 0.124 1.378
55 HZ2 LYS 11 1HZ LYS 11 10.558 -0.830 1.513
56 HZ3 LYS 11 2HZ LYS 11 11.342 -0.277 2.905
57 HA PRO 12 HA PRO 12 11.399 4.408 -6.458
58 HB2 PRO 12 1HB PRO 12 12.351 2.230 -7.769
59 HB3 PRO 12 2HB PRO 12 13.400 3.499 -7.127
60 HG2 PRO 12 1HG PRO 12 12.727 0.826 -5.959
61 HG3 PRO 12 2HG PRO 12 14.297 1.645 -6.046
62 HD2 PRO 12 1HD PRO 12 12.791 1.619 -3.796
63 HD3 PRO 12 2HD PRO 12 13.842 2.984 -4.226
64 H PHE 13 H PHE 13 10.198 1.678 -4.788
65 HA PHE 13 HA PHE 13 8.210 1.175 -6.900
66 HB2 PHE 13 1HB PHE 13 8.942 -0.615 -4.574
67 HB3 PHE 13 2HB PHE 13 7.863 -1.014 -5.906
68 HD1 PHE 13 HD2 PHE 13 8.736 -1.537 -8.103
69 HD2 PHE 13 HD1 PHE 13 11.336 -0.600 -4.866
70 HE1 PHE 13 HE2 PHE 13 10.639 -2.439 -9.375
71 HE2 PHE 13 HE1 PHE 13 13.243 -1.500 -6.133
72 HZ PHE 13 HZ PHE 13 12.896 -2.422 -8.390
73 H LYS 14 H LYS 14 6.154 1.708 -6.550
74 HA LYS 14 HA LYS 14 5.201 2.038 -3.797
75 HB2 LYS 14 1HB LYS 14 5.821 4.272 -4.502
76 HB3 LYS 14 2HB LYS 14 4.922 4.087 -6.002
77 HG2 LYS 14 1HG LYS 14 2.889 3.713 -4.427
78 HG3 LYS 14 2HG LYS 14 3.910 4.511 -3.228
79 HD2 LYS 14 1HD LYS 14 4.207 6.389 -4.854
80 HD3 LYS 14 2HD LYS 14 3.008 5.610 -5.888
81 HE2 LYS 14 1HE LYS 14 1.681 7.075 -4.724
82 HE3 LYS 14 2HE LYS 14 1.560 5.642 -3.703
83 HZ1 LYS 14 3HZ LYS 14 3.643 6.763 -2.579
84 HZ2 LYS 14 1HZ LYS 14 2.064 7.188 -2.140
85 HZ3 LYS 14 2HZ LYS 14 2.940 8.169 -3.204
86 H CYS 15 H CYS 15 3.297 1.088 -3.482
87 HA CYS 15 HA CYS 15 1.944 -0.203 -5.645
88 HB2 CYS 15 1HB CYS 15 2.094 -1.166 -3.359
89 HB3 CYS 15 2HB CYS 15 1.055 0.128 -2.772
90 H GLU 16 H GLU 16 0.812 0.981 -7.051
91 HA GLU 16 HA GLU 16 -0.388 3.467 -6.479
92 HB2 GLU 16 1HB GLU 16 -1.038 1.551 -8.726
93 HB3 GLU 16 2HB GLU 16 -1.439 3.262 -8.674
94 HG2 GLU 16 1HG GLU 16 1.356 2.148 -8.674
95 HG3 GLU 16 2HG GLU 16 0.508 2.763 -10.092
96 H GLU 17 H GLU 17 -1.483 0.201 -6.120
97 HA GLU 17 HA GLU 17 -4.238 0.495 -6.183
98 HB2 GLU 17 1HB GLU 17 -2.742 -1.254 -4.229
99 HB3 GLU 17 2HB GLU 17 -4.366 -1.503 -4.855
100 HG2 GLU 17 1HG GLU 17 -3.135 -1.556 -7.165
101 HG3 GLU 17 2HG GLU 17 -1.737 -1.956 -6.169
102 H CYS 18 H CYS 18 -2.092 0.767 -3.351
103 HA CYS 18 HA CYS 18 -4.206 2.334 -2.023
104 HB2 CYS 18 1HB CYS 18 -3.281 1.543 0.123
105 HB3 CYS 18 2HB CYS 18 -3.840 0.210 -0.883
106 H GLY 19 H GLY 19 -0.739 1.981 -2.577
107 HA2 GLY 19 1HA GLY 19 0.373 4.162 -3.091
108 HA3 GLY 19 2HA GLY 19 -0.390 4.757 -1.624
109 H LYS 20 H LYS 20 0.668 1.528 -1.442
110 HA LYS 20 HA LYS 20 2.502 2.080 0.635
111 HB2 LYS 20 1HB LYS 20 1.631 -0.323 -0.871
112 HB3 LYS 20 2HB LYS 20 3.186 -0.427 -0.056
113 HG2 LYS 20 1HG LYS 20 1.767 0.553 1.959
114 HG3 LYS 20 2HG LYS 20 0.455 -0.231 1.075
115 HD2 LYS 20 1HD LYS 20 1.286 -2.331 1.434
116 HD3 LYS 20 2HD LYS 20 2.959 -1.774 1.508
117 HE2 LYS 20 1HE LYS 20 2.274 -2.509 3.696
118 HE3 LYS 20 2HE LYS 20 2.477 -0.758 3.713
119 HZ1 LYS 20 3HZ LYS 20 -0.125 -2.160 3.430
120 HZ2 LYS 20 1HZ LYS 20 0.105 -0.488 3.548
121 HZ3 LYS 20 2HZ LYS 20 0.459 -1.485 4.867
122 H ARG 21 H ARG 21 4.766 0.800 0.399
123 HA ARG 21 HA ARG 21 6.068 1.428 -2.123
124 HB2 ARG 21 1HB ARG 21 6.979 2.663 0.482
125 HB3 ARG 21 2HB ARG 21 7.822 2.777 -1.057
126 HG2 ARG 21 1HG ARG 21 5.520 3.777 -1.856
127 HG3 ARG 21 2HG ARG 21 5.352 4.143 -0.138
128 HD2 ARG 21 1HD ARG 21 7.827 5.033 -0.472
129 HD3 ARG 21 2HD ARG 21 7.274 5.210 -2.137
130 HE ARG 21 HE ARG 21 5.971 6.971 -1.479
131 HH11 ARG 21 1HH1 ARG 21 6.963 5.174 1.333
132 HH12 ARG 21 2HH1 ARG 21 6.337 6.335 2.457
133 HH21 ARG 21 1HH2 ARG 21 5.142 8.507 -0.009
134 HH22 ARG 21 2HH2 ARG 21 5.301 8.230 1.692
135 H PHE 22 H PHE 22 8.139 0.448 -2.355
136 HA PHE 22 HA PHE 22 9.059 -1.326 -0.247
137 HB2 PHE 22 1HB PHE 22 8.445 -2.477 -2.968
138 HB3 PHE 22 2HB PHE 22 8.911 -3.343 -1.507
139 HD1 PHE 22 HD2 PHE 22 6.200 -1.288 -2.984
140 HD2 PHE 22 HD1 PHE 22 7.295 -4.169 -0.048
141 HE1 PHE 22 HE2 PHE 22 3.826 -1.622 -2.432
142 HE2 PHE 22 HE1 PHE 22 4.922 -4.508 0.508
143 HZ PHE 22 HZ PHE 22 3.184 -3.233 -0.683
144 H THR 23 H THR 23 11.158 -2.281 -0.720
145 HA THR 23 HA THR 23 12.805 -0.438 -2.238
146 HB THR 23 HB THR 23 13.599 -1.087 -0.038
147 HG1 THR 23 HG1 THR 23 15.000 -1.528 -2.339
148 HG21 THR 23 3HG2 THR 23 13.127 -3.153 0.677
149 HG22 THR 23 1HG2 THR 23 14.499 -3.698 -0.287
150 HG23 THR 23 2HG2 THR 23 12.872 -3.742 -0.965
151 H GLN 24 H GLN 24 11.263 -3.391 -2.780
152 HA GLN 24 HA GLN 24 12.796 -3.767 -5.241
153 HB2 GLN 24 1HB GLN 24 12.587 -5.691 -2.998
154 HB3 GLN 24 2HB GLN 24 12.384 -6.356 -4.613
155 HG2 GLN 24 1HG GLN 24 14.762 -4.881 -3.521
156 HG3 GLN 24 2HG GLN 24 14.671 -6.569 -4.019
157 HE21 GLN 24 1HE2 GLN 24 13.195 -6.151 -6.397
158 HE22 GLN 24 2HE2 GLN 24 14.236 -5.372 -7.534
159 H ASN 25 H ASN 25 11.664 -4.921 -6.888
160 HA ASN 25 HA ASN 25 8.924 -4.303 -7.041
161 HB2 ASN 25 1HB ASN 25 8.974 -5.215 -9.189
162 HB3 ASN 25 2HB ASN 25 10.647 -4.728 -8.937
163 HD21 ASN 25 1HD2 ASN 25 12.155 -6.389 -8.248
164 HD22 ASN 25 2HD2 ASN 25 11.910 -8.016 -8.776
165 H SER 26 H SER 26 10.556 -7.448 -6.677
166 HA SER 26 HA SER 26 8.464 -9.168 -6.604
167 HB2 SER 26 1HB SER 26 10.849 -9.807 -6.291
168 HB3 SER 26 2HB SER 26 10.759 -9.224 -4.629
169 HG SER 26 HG SER 26 9.179 -11.301 -5.750
170 H GLN 27 H GLN 27 9.400 -6.914 -4.078
171 HA GLN 27 HA GLN 27 7.613 -7.920 -2.103
172 HB2 GLN 27 1HB GLN 27 8.935 -5.214 -2.361
173 HB3 GLN 27 2HB GLN 27 8.071 -5.777 -0.937
174 HG2 GLN 27 1HG GLN 27 9.711 -7.700 -0.866
175 HG3 GLN 27 2HG GLN 27 10.644 -6.820 -2.076
176 HE21 GLN 27 1HE2 GLN 27 10.649 -4.308 -1.346
177 HE22 GLN 27 2HE2 GLN 27 11.296 -4.087 0.240
178 H LEU 28 H LEU 28 7.493 -5.036 -4.195
179 HA LEU 28 HA LEU 28 4.934 -4.191 -3.434
180 HB2 LEU 28 1HB LEU 28 6.376 -2.699 -4.605
181 HB3 LEU 28 2HB LEU 28 6.493 -3.798 -5.977
182 HG LEU 28 HG LEU 28 4.208 -3.335 -6.600
183 HD11 LEU 28 1HD1 LEU 28 4.000 -1.313 -4.400
184 HD12 LEU 28 2HD1 LEU 28 3.517 -2.990 -4.147
185 HD13 LEU 28 3HD1 LEU 28 2.722 -2.021 -5.388
186 HD21 LEU 28 3HD2 LEU 28 5.329 -0.627 -6.027
187 HD22 LEU 28 1HD2 LEU 28 4.545 -1.235 -7.485
188 HD23 LEU 28 2HD2 LEU 28 6.196 -1.725 -7.102
189 H HIS 29 H HIS 29 5.918 -6.056 -6.309
190 HA HIS 29 HA HIS 29 3.330 -6.525 -7.279
191 HB2 HIS 29 1HB HIS 29 5.952 -7.950 -7.657
192 HB3 HIS 29 2HB HIS 29 4.475 -8.545 -8.408
193 HD1 HIS 29 HD1 HIS 29 3.994 -7.625 -10.653
194 HD2 HIS 29 HD2 HIS 29 6.492 -5.132 -8.460
195 HE1 HIS 29 HE1 HIS 29 4.628 -5.762 -12.219
196 H SER 30 H SER 30 5.142 -8.033 -4.740
197 HA SER 30 HA SER 30 3.468 -10.381 -4.610
198 HB2 SER 30 1HB SER 30 5.739 -10.689 -3.934
199 HB3 SER 30 2HB SER 30 5.665 -9.315 -2.830
200 HG SER 30 HG SER 30 4.342 -11.811 -2.581
201 H HIS 31 H HIS 31 3.448 -7.195 -3.325
202 HA HIS 31 HA HIS 31 1.637 -7.867 -1.150
203 HB2 HIS 31 1HB HIS 31 2.977 -6.173 -0.385
204 HB3 HIS 31 2HB HIS 31 3.164 -5.455 -1.983
205 HD1 HIS 31 HD1 HIS 31 0.770 -5.567 0.923
206 HD2 HIS 31 HD2 HIS 31 1.405 -3.414 -2.573
207 HE1 HIS 31 HE1 HIS 31 -0.800 -3.606 1.047
208 H GLN 32 H GLN 32 1.593 -6.133 -4.231
209 HA GLN 32 HA GLN 32 -0.923 -5.032 -4.189
210 HB2 GLN 32 1HB GLN 32 0.733 -6.188 -6.406
211 HB3 GLN 32 2HB GLN 32 -0.886 -5.584 -6.735
212 HG2 GLN 32 1HG GLN 32 -0.249 -3.395 -5.861
213 HG3 GLN 32 2HG GLN 32 1.375 -4.000 -5.535
214 HE21 GLN 32 1HE2 GLN 32 1.664 -1.991 -6.961
215 HE22 GLN 32 2HE2 GLN 32 1.807 -2.293 -8.656
216 H ARG 33 H ARG 33 -0.090 -8.343 -4.162
217 HA ARG 33 HA ARG 33 -2.314 -9.493 -5.420
218 HB2 ARG 33 1HB ARG 33 -0.971 -10.721 -3.026
219 HB3 ARG 33 2HB ARG 33 -1.667 -11.525 -4.427
220 HG2 ARG 33 1HG ARG 33 0.155 -10.508 -5.807
221 HG3 ARG 33 2HG ARG 33 0.891 -9.949 -4.304
222 HD2 ARG 33 1HD ARG 33 1.893 -12.045 -5.051
223 HD3 ARG 33 2HD ARG 33 1.049 -12.253 -3.517
224 HE ARG 33 HE ARG 33 0.333 -13.408 -6.077
225 HH11 ARG 33 1HH1 ARG 33 -0.633 -12.699 -2.808
226 HH12 ARG 33 2HH1 ARG 33 -1.878 -13.904 -2.776
227 HH21 ARG 33 1HH2 ARG 33 -1.303 -14.998 -6.047
228 HH22 ARG 33 2HH2 ARG 33 -2.257 -15.212 -4.619
229 H VAL 34 H VAL 34 -1.897 -8.129 -2.234
230 HA VAL 34 HA VAL 34 -4.129 -9.245 -0.953
231 HB VAL 34 HB VAL 34 -3.933 -7.526 0.677
232 HG11 VAL 34 1HG1 VAL 34 -2.104 -8.730 1.188
233 HG12 VAL 34 2HG1 VAL 34 -1.482 -8.679 -0.463
234 HG13 VAL 34 3HG1 VAL 34 -1.233 -7.307 0.618
235 HG21 VAL 34 3HG2 VAL 34 -2.813 -5.443 0.356
236 HG22 VAL 34 1HG2 VAL 34 -2.214 -5.944 -1.225
237 HG23 VAL 34 2HG2 VAL 34 -3.937 -5.651 -0.987
238 H HIS 35 H HIS 35 -3.857 -6.728 -3.319
239 HA HIS 35 HA HIS 35 -6.518 -5.692 -2.831
240 HB2 HIS 35 1HB HIS 35 -4.437 -5.078 -4.933
241 HB3 HIS 35 2HB HIS 35 -6.021 -4.310 -4.887
242 HD1 HIS 35 HD1 HIS 35 -6.504 -2.776 -2.771
243 HD2 HIS 35 HD2 HIS 35 -2.563 -4.004 -3.239
244 HE1 HIS 35 HE1 HIS 35 -5.148 -1.266 -1.286
245 H THR 36 H THR 36 -4.953 -7.984 -4.921
246 HA THR 36 HA THR 36 -7.154 -8.158 -6.778
247 HB THR 36 HB THR 36 -5.920 -10.018 -7.786
248 HG1 THR 36 HG1 THR 36 -4.387 -9.765 -5.427
249 HG21 THR 36 3HG2 THR 36 -5.084 -7.356 -7.637
250 HG22 THR 36 1HG2 THR 36 -4.637 -8.542 -8.862
251 HG23 THR 36 2HG2 THR 36 -3.615 -8.312 -7.443
252 H GLY 37 H GLY 37 -5.918 -10.020 -4.041
253 HA2 GLY 37 1HA GLY 37 -8.389 -11.639 -4.151
254 HA3 GLY 37 2HA GLY 37 -6.840 -12.298 -3.645
255 H GLU 38 H GLU 38 -8.926 -9.520 -2.822
256 HA GLU 38 HA GLU 38 -8.096 -9.699 -0.049
257 HB2 GLU 38 1HB GLU 38 -8.438 -7.516 -1.276
258 HB3 GLU 38 2HB GLU 38 -10.163 -7.853 -1.245
259 HG2 GLU 38 1HG GLU 38 -9.396 -6.318 0.541
260 HG3 GLU 38 2HG GLU 38 -10.215 -7.760 1.136
261 H LYS 39 H LYS 39 -9.244 -10.542 1.589
262 HA LYS 39 HA LYS 39 -12.065 -11.195 1.190
263 HB2 LYS 39 1HB LYS 39 -9.972 -13.207 2.037
264 HB3 LYS 39 2HB LYS 39 -11.709 -13.482 2.090
265 HG2 LYS 39 1HG LYS 39 -11.738 -13.051 -0.391
266 HG3 LYS 39 2HG LYS 39 -9.974 -13.100 -0.333
267 HD2 LYS 39 1HD LYS 39 -11.559 -15.340 0.851
268 HD3 LYS 39 2HD LYS 39 -11.328 -15.261 -0.897
269 HE2 LYS 39 1HE LYS 39 -9.504 -16.508 -0.313
270 HE3 LYS 39 2HE LYS 39 -8.812 -14.890 -0.203
271 HZ1 LYS 39 3HZ LYS 39 -8.377 -16.447 1.720
272 HZ2 LYS 39 1HZ LYS 39 -10.005 -16.252 2.138
273 HZ3 LYS 39 2HZ LYS 39 -8.970 -14.914 2.120
274 HA PRO 40 HA PRO 40 -12.373 -9.738 5.333
275 HB2 PRO 40 1HB PRO 40 -14.746 -10.869 6.012
276 HB3 PRO 40 2HB PRO 40 -14.619 -9.486 4.918
277 HG2 PRO 40 1HG PRO 40 -14.958 -12.388 4.270
278 HG3 PRO 40 2HG PRO 40 -15.761 -10.980 3.551
279 HD2 PRO 40 1HD PRO 40 -13.680 -12.236 2.359
280 HD3 PRO 40 2HD PRO 40 -13.965 -10.492 2.192
281 H SER 41 H SER 41 -11.298 -10.449 7.055
282 HA SER 41 HA SER 41 -11.671 -13.238 7.910
283 HB2 SER 41 1HB SER 41 -9.454 -12.752 6.672
284 HB3 SER 41 2HB SER 41 -8.998 -11.868 8.128
285 HG SER 41 HG SER 41 -9.930 -14.141 8.981
286 H GLY 42 H GLY 42 -13.059 -11.048 8.941
287 HA2 GLY 42 1HA GLY 42 -11.829 -10.801 11.618
288 HA3 GLY 42 2HA GLY 42 -12.724 -9.489 10.865
289 HA PRO 43 HA PRO 43 -15.555 -11.989 13.623
290 HB2 PRO 43 1HB PRO 43 -16.394 -9.887 15.123
291 HB3 PRO 43 2HB PRO 43 -14.959 -10.838 15.521
292 HG2 PRO 43 1HG PRO 43 -15.153 -8.192 14.135
293 HG3 PRO 43 2HG PRO 43 -14.016 -8.716 15.390
294 HD2 PRO 43 1HD PRO 43 -13.355 -8.639 12.766
295 HD3 PRO 43 2HD PRO 43 -12.678 -9.838 13.886
296 H SER 44 H SER 44 -17.924 -11.529 14.008
297 HA SER 44 HA SER 44 -19.037 -10.287 11.597
298 HB2 SER 44 1HB SER 44 -21.041 -11.617 12.041
299 HB3 SER 44 2HB SER 44 -19.614 -12.653 12.029
300 HG SER 44 HG SER 44 -21.384 -12.209 14.016
301 H SER 45 H SER 45 -19.154 -8.137 12.138
302 HA SER 45 HA SER 45 -19.710 -6.849 14.419
303 HB2 SER 45 1HB SER 45 -19.387 -5.527 12.479
304 HB3 SER 45 2HB SER 45 -20.756 -6.267 11.650
305 HG SER 45 HG SER 45 -21.099 -4.108 12.581
306 H GLY 46 H GLY 46 -22.185 -8.302 12.322
307 HA2 GLY 46 1HA GLY 46 -24.531 -7.599 13.383
308 HA3 GLY 46 2HA GLY 46 -24.194 -9.276 12.980
Start of MODEL 7
1 H1 GLY 1 H GLY 1 -4.145 1.894 19.526
2 HA2 GLY 1 1HA GLY 1 -1.590 1.167 19.853
3 HA3 GLY 1 2HA GLY 1 -1.999 0.305 18.377
4 H SER 2 H SER 2 -3.224 1.819 16.750
5 HA SER 2 HA SER 2 -2.907 3.469 15.207
6 HB2 SER 2 1HB SER 2 -4.141 4.738 16.905
7 HB3 SER 2 2HB SER 2 -2.630 5.134 17.723
8 HG SER 2 HG SER 2 -3.718 6.604 15.978
9 H SER 3 H SER 3 -0.603 1.999 15.684
10 HA SER 3 HA SER 3 1.610 3.843 16.006
11 HB2 SER 3 1HB SER 3 1.588 1.434 16.850
12 HB3 SER 3 2HB SER 3 1.788 0.948 15.166
13 HG SER 3 HG SER 3 3.823 1.115 15.915
14 H GLY 4 H GLY 4 1.156 5.216 14.194
15 HA2 GLY 4 1HA GLY 4 1.208 4.126 11.525
16 HA3 GLY 4 2HA GLY 4 1.170 5.828 11.958
17 H SER 5 H SER 5 3.086 3.251 10.868
18 HA SER 5 HA SER 5 5.646 3.977 11.686
19 HB2 SER 5 1HB SER 5 5.122 1.864 10.518
20 HB3 SER 5 2HB SER 5 4.838 2.767 9.029
21 HG SER 5 HG SER 5 7.284 3.020 10.396
22 H SER 6 H SER 6 7.363 4.998 10.424
23 HA SER 6 HA SER 6 6.380 7.441 9.161
24 HB2 SER 6 1HB SER 6 9.161 6.688 10.093
25 HB3 SER 6 2HB SER 6 8.694 8.261 9.446
26 HG SER 6 HG SER 6 6.994 7.679 11.377
27 H GLY 7 H GLY 7 8.854 4.944 8.551
28 HA2 GLY 7 1HA GLY 7 9.710 4.117 6.589
29 HA3 GLY 7 2HA GLY 7 8.200 4.614 5.840
30 H SER 8 H SER 8 11.318 5.909 6.949
31 HA SER 8 HA SER 8 11.090 8.210 5.222
32 HB2 SER 8 1HB SER 8 13.305 7.207 7.016
33 HB3 SER 8 2HB SER 8 13.440 8.669 6.040
34 HG SER 8 HG SER 8 11.848 9.612 7.225
35 H GLY 9 H GLY 9 13.240 5.373 5.409
36 HA2 GLY 9 1HA GLY 9 14.937 5.681 3.362
37 HA3 GLY 9 2HA GLY 9 14.134 4.144 3.650
38 H GLU 10 H GLU 10 14.719 6.485 1.387
39 HA GLU 10 HA GLU 10 12.321 6.738 -0.014
40 HB2 GLU 10 1HB GLU 10 15.208 6.924 -0.768
41 HB3 GLU 10 2HB GLU 10 13.997 6.922 -2.042
42 HG2 GLU 10 1HG GLU 10 12.900 8.846 -0.947
43 HG3 GLU 10 2HG GLU 10 14.206 8.877 0.236
44 H LYS 11 H LYS 11 11.232 5.491 -1.430
45 HA LYS 11 HA LYS 11 12.432 2.914 -2.199
46 HB2 LYS 11 1HB LYS 11 9.676 3.474 -1.125
47 HB3 LYS 11 2HB LYS 11 10.018 2.035 -2.077
48 HG2 LYS 11 1HG LYS 11 11.565 1.234 -0.455
49 HG3 LYS 11 2HG LYS 11 11.510 2.759 0.433
50 HD2 LYS 11 1HD LYS 11 8.971 1.260 0.010
51 HD3 LYS 11 2HD LYS 11 10.112 0.664 1.217
52 HE2 LYS 11 1HE LYS 11 9.131 3.510 1.127
53 HE3 LYS 11 2HE LYS 11 8.339 2.245 2.065
54 HZ1 LYS 11 3HZ LYS 11 10.258 3.805 3.033
55 HZ2 LYS 11 1HZ LYS 11 11.202 2.519 2.470
56 HZ3 LYS 11 2HZ LYS 11 9.971 2.236 3.594
57 HA PRO 12 HA PRO 12 11.443 4.451 -6.255
58 HB2 PRO 12 1HB PRO 12 12.276 2.249 -7.608
59 HB3 PRO 12 2HB PRO 12 13.392 3.446 -6.939
60 HG2 PRO 12 1HG PRO 12 12.569 0.792 -5.825
61 HG3 PRO 12 2HG PRO 12 14.182 1.524 -5.893
62 HD2 PRO 12 1HD PRO 12 12.670 1.538 -3.647
63 HD3 PRO 12 2HD PRO 12 13.796 2.851 -4.048
64 H PHE 13 H PHE 13 10.293 1.467 -4.852
65 HA PHE 13 HA PHE 13 8.229 1.205 -6.911
66 HB2 PHE 13 1HB PHE 13 8.903 -0.643 -4.611
67 HB3 PHE 13 2HB PHE 13 7.760 -0.978 -5.909
68 HD1 PHE 13 HD1 PHE 13 11.292 -0.696 -5.006
69 HD2 PHE 13 HD2 PHE 13 8.522 -1.567 -8.118
70 HE1 PHE 13 HE1 PHE 13 13.110 -1.674 -6.345
71 HE2 PHE 13 HE2 PHE 13 10.335 -2.547 -9.461
72 HZ PHE 13 HZ PHE 13 12.632 -2.603 -8.575
73 H LYS 14 H LYS 14 6.097 1.527 -6.533
74 HA LYS 14 HA LYS 14 5.171 1.985 -3.803
75 HB2 LYS 14 1HB LYS 14 5.808 4.205 -4.557
76 HB3 LYS 14 2HB LYS 14 4.880 4.002 -6.037
77 HG2 LYS 14 1HG LYS 14 2.867 3.678 -4.444
78 HG3 LYS 14 2HG LYS 14 3.911 4.446 -3.245
79 HD2 LYS 14 1HD LYS 14 4.231 6.335 -4.850
80 HD3 LYS 14 2HD LYS 14 3.019 5.586 -5.891
81 HE2 LYS 14 1HE LYS 14 1.427 5.688 -3.961
82 HE3 LYS 14 2HE LYS 14 2.637 6.627 -3.088
83 HZ1 LYS 14 3HZ LYS 14 1.590 8.360 -4.012
84 HZ2 LYS 14 1HZ LYS 14 0.872 7.430 -5.230
85 HZ3 LYS 14 2HZ LYS 14 2.467 7.967 -5.405
86 H CYS 15 H CYS 15 3.275 1.025 -3.478
87 HA CYS 15 HA CYS 15 1.917 -0.292 -5.614
88 HB2 CYS 15 1HB CYS 15 2.061 -1.184 -3.288
89 HB3 CYS 15 2HB CYS 15 0.988 0.111 -2.765
90 H GLU 16 H GLU 16 0.956 1.024 -7.070
91 HA GLU 16 HA GLU 16 -0.293 3.467 -6.532
92 HB2 GLU 16 1HB GLU 16 -0.854 1.533 -8.787
93 HB3 GLU 16 2HB GLU 16 -1.329 3.225 -8.751
94 HG2 GLU 16 1HG GLU 16 1.166 3.724 -8.484
95 HG3 GLU 16 2HG GLU 16 1.416 2.055 -8.992
96 H GLU 17 H GLU 17 -1.406 0.218 -6.150
97 HA GLU 17 HA GLU 17 -4.164 0.532 -6.288
98 HB2 GLU 17 1HB GLU 17 -2.733 -1.229 -4.298
99 HB3 GLU 17 2HB GLU 17 -4.338 -1.467 -4.976
100 HG2 GLU 17 1HG GLU 17 -3.054 -1.540 -7.245
101 HG3 GLU 17 2HG GLU 17 -1.670 -1.915 -6.220
102 H CYS 18 H CYS 18 -2.065 0.801 -3.421
103 HA CYS 18 HA CYS 18 -4.194 2.383 -2.133
104 HB2 CYS 18 1HB CYS 18 -3.336 1.581 0.030
105 HB3 CYS 18 2HB CYS 18 -3.859 0.247 -0.992
106 H GLY 19 H GLY 19 -0.713 1.985 -2.587
107 HA2 GLY 19 1HA GLY 19 0.412 4.177 -3.091
108 HA3 GLY 19 2HA GLY 19 -0.353 4.753 -1.618
109 H LYS 20 H LYS 20 0.665 1.516 -1.462
110 HA LYS 20 HA LYS 20 2.491 2.015 0.629
111 HB2 LYS 20 1HB LYS 20 1.626 -0.354 -0.936
112 HB3 LYS 20 2HB LYS 20 3.170 -0.480 -0.103
113 HG2 LYS 20 1HG LYS 20 1.849 0.368 1.956
114 HG3 LYS 20 2HG LYS 20 0.430 -0.139 1.036
115 HD2 LYS 20 1HD LYS 20 0.947 -2.023 2.301
116 HD3 LYS 20 2HD LYS 20 1.696 -2.368 0.740
117 HE2 LYS 20 1HE LYS 20 3.400 -2.915 2.186
118 HE3 LYS 20 2HE LYS 20 3.786 -1.234 1.822
119 HZ1 LYS 20 3HZ LYS 20 3.376 -2.352 4.313
120 HZ2 LYS 20 1HZ LYS 20 2.015 -1.388 4.026
121 HZ3 LYS 20 2HZ LYS 20 3.562 -0.710 3.949
122 H ARG 21 H ARG 21 4.749 0.713 0.376
123 HA ARG 21 HA ARG 21 6.074 1.421 -2.116
124 HB2 ARG 21 1HB ARG 21 6.925 2.548 0.557
125 HB3 ARG 21 2HB ARG 21 7.872 2.648 -0.921
126 HG2 ARG 21 1HG ARG 21 5.770 3.796 -1.902
127 HG3 ARG 21 2HG ARG 21 5.328 4.041 -0.211
128 HD2 ARG 21 1HD ARG 21 8.083 4.763 -1.060
129 HD3 ARG 21 2HD ARG 21 6.760 5.815 -1.560
130 HE ARG 21 HE ARG 21 7.774 5.441 1.124
131 HH11 ARG 21 1HH1 ARG 21 5.177 6.612 -0.876
132 HH12 ARG 21 2HH1 ARG 21 4.555 7.685 0.333
133 HH21 ARG 21 1HH2 ARG 21 6.965 6.849 2.725
134 HH22 ARG 21 2HH2 ARG 21 5.573 7.820 2.381
135 H PHE 22 H PHE 22 8.237 0.518 -2.284
136 HA PHE 22 HA PHE 22 9.096 -1.383 -0.289
137 HB2 PHE 22 1HB PHE 22 8.434 -2.445 -3.035
138 HB3 PHE 22 2HB PHE 22 8.909 -3.361 -1.609
139 HD1 PHE 22 HD2 PHE 22 6.197 -1.300 -3.052
140 HD2 PHE 22 HD1 PHE 22 7.310 -4.141 -0.085
141 HE1 PHE 22 HE2 PHE 22 3.827 -1.622 -2.477
142 HE2 PHE 22 HE1 PHE 22 4.941 -4.468 0.495
143 HZ PHE 22 HZ PHE 22 3.196 -3.207 -0.701
144 H THR 23 H THR 23 11.212 -2.185 -0.660
145 HA THR 23 HA THR 23 12.848 -0.378 -2.198
146 HB THR 23 HB THR 23 13.535 -1.206 0.051
147 HG1 THR 23 HG1 THR 23 15.518 -2.152 -1.672
148 HG21 THR 23 3HG2 THR 23 13.525 -3.805 -1.419
149 HG22 THR 23 1HG2 THR 23 12.984 -3.439 0.219
150 HG23 THR 23 2HG2 THR 23 14.708 -3.546 -0.137
151 H GLN 24 H GLN 24 11.282 -3.295 -2.820
152 HA GLN 24 HA GLN 24 12.803 -3.619 -5.292
153 HB2 GLN 24 1HB GLN 24 12.635 -5.590 -3.090
154 HB3 GLN 24 2HB GLN 24 12.405 -6.224 -4.714
155 HG2 GLN 24 1HG GLN 24 14.795 -4.733 -3.665
156 HG3 GLN 24 2HG GLN 24 14.709 -6.432 -4.125
157 HE21 GLN 24 1HE2 GLN 24 13.217 -6.124 -6.486
158 HE22 GLN 24 2HE2 GLN 24 14.219 -5.344 -7.658
159 H ASN 25 H ASN 25 11.663 -4.756 -6.951
160 HA ASN 25 HA ASN 25 8.918 -4.144 -7.064
161 HB2 ASN 25 1HB ASN 25 8.937 -5.067 -9.227
162 HB3 ASN 25 2HB ASN 25 10.581 -4.477 -9.000
163 HD21 ASN 25 1HD2 ASN 25 12.178 -6.076 -8.263
164 HD22 ASN 25 2HD2 ASN 25 12.037 -7.697 -8.843
165 H SER 26 H SER 26 10.574 -7.285 -6.780
166 HA SER 26 HA SER 26 8.505 -9.028 -6.733
167 HB2 SER 26 1HB SER 26 10.948 -8.986 -4.955
168 HB3 SER 26 2HB SER 26 9.836 -10.353 -5.028
169 HG SER 26 HG SER 26 11.313 -9.262 -7.194
170 H GLN 27 H GLN 27 9.496 -6.923 -4.074
171 HA GLN 27 HA GLN 27 7.706 -7.943 -2.147
172 HB2 GLN 27 1HB GLN 27 9.020 -5.237 -2.408
173 HB3 GLN 27 2HB GLN 27 8.078 -5.732 -1.008
174 HG2 GLN 27 1HG GLN 27 9.670 -7.681 -0.789
175 HG3 GLN 27 2HG GLN 27 10.678 -6.868 -1.986
176 HE21 GLN 27 1HE2 GLN 27 10.538 -4.280 -1.295
177 HE22 GLN 27 2HE2 GLN 27 11.181 -4.031 0.289
178 H LEU 28 H LEU 28 7.488 -5.000 -4.151
179 HA LEU 28 HA LEU 28 4.924 -4.235 -3.380
180 HB2 LEU 28 1HB LEU 28 6.289 -2.709 -4.585
181 HB3 LEU 28 2HB LEU 28 6.441 -3.820 -5.945
182 HG LEU 28 HG LEU 28 4.111 -3.458 -6.531
183 HD11 LEU 28 1HD1 LEU 28 3.903 -1.319 -4.451
184 HD12 LEU 28 2HD1 LEU 28 3.505 -2.991 -4.058
185 HD13 LEU 28 3HD1 LEU 28 2.623 -2.152 -5.334
186 HD21 LEU 28 3HD2 LEU 28 5.710 -1.971 -7.533
187 HD22 LEU 28 1HD2 LEU 28 5.691 -0.924 -6.114
188 HD23 LEU 28 2HD2 LEU 28 4.257 -1.054 -7.133
189 H HIS 29 H HIS 29 5.905 -6.143 -6.226
190 HA HIS 29 HA HIS 29 3.319 -6.653 -7.180
191 HB2 HIS 29 1HB HIS 29 5.945 -8.082 -7.518
192 HB3 HIS 29 2HB HIS 29 4.469 -8.692 -8.261
193 HD1 HIS 29 HD1 HIS 29 4.119 -7.896 -10.568
194 HD2 HIS 29 HD2 HIS 29 6.370 -5.206 -8.341
195 HE1 HIS 29 HE1 HIS 29 4.730 -6.049 -12.161
196 H SER 30 H SER 30 5.140 -8.081 -4.601
197 HA SER 30 HA SER 30 3.492 -10.441 -4.409
198 HB2 SER 30 1HB SER 30 5.872 -10.477 -3.734
199 HB3 SER 30 2HB SER 30 5.512 -9.327 -2.446
200 HG SER 30 HG SER 30 3.896 -11.550 -2.460
201 H HIS 31 H HIS 31 3.411 -7.217 -3.228
202 HA HIS 31 HA HIS 31 1.563 -7.862 -1.068
203 HB2 HIS 31 1HB HIS 31 2.910 -6.178 -0.288
204 HB3 HIS 31 2HB HIS 31 3.122 -5.461 -1.883
205 HD1 HIS 31 HD1 HIS 31 0.809 -5.468 1.064
206 HD2 HIS 31 HD2 HIS 31 1.254 -3.510 -2.573
207 HE1 HIS 31 HE1 HIS 31 -0.787 -3.527 1.146
208 H GLN 32 H GLN 32 1.612 -6.152 -4.163
209 HA GLN 32 HA GLN 32 -0.878 -5.010 -4.205
210 HB2 GLN 32 1HB GLN 32 0.763 -6.288 -6.372
211 HB3 GLN 32 2HB GLN 32 -0.816 -5.600 -6.728
212 HG2 GLN 32 1HG GLN 32 -0.015 -3.446 -5.767
213 HG3 GLN 32 2HG GLN 32 1.589 -4.165 -5.634
214 HE21 GLN 32 1HE2 GLN 32 1.773 -2.083 -7.032
215 HE22 GLN 32 2HE2 GLN 32 1.752 -2.354 -8.738
216 H ARG 33 H ARG 33 -0.082 -8.370 -4.274
217 HA ARG 33 HA ARG 33 -2.334 -9.474 -5.470
218 HB2 ARG 33 1HB ARG 33 -1.087 -10.733 -3.048
219 HB3 ARG 33 2HB ARG 33 -1.715 -11.506 -4.498
220 HG2 ARG 33 1HG ARG 33 0.208 -10.342 -5.723
221 HG3 ARG 33 2HG ARG 33 0.884 -10.071 -4.116
222 HD2 ARG 33 1HD ARG 33 -0.021 -12.813 -4.841
223 HD3 ARG 33 2HD ARG 33 1.493 -12.217 -5.522
224 HE ARG 33 HE ARG 33 1.259 -11.897 -2.666
225 HH11 ARG 33 1HH1 ARG 33 2.263 -13.982 -5.267
226 HH12 ARG 33 2HH1 ARG 33 3.377 -14.881 -4.291
227 HH21 ARG 33 1HH2 ARG 33 2.722 -13.074 -1.370
228 HH22 ARG 33 2HH2 ARG 33 3.636 -14.365 -2.074
229 H VAL 34 H VAL 34 -1.903 -8.136 -2.266
230 HA VAL 34 HA VAL 34 -4.160 -9.175 -0.994
231 HB VAL 34 HB VAL 34 -3.954 -7.437 0.606
232 HG11 VAL 34 1HG1 VAL 34 -1.555 -8.674 -0.485
233 HG12 VAL 34 2HG1 VAL 34 -1.219 -7.200 0.426
234 HG13 VAL 34 3HG1 VAL 34 -2.094 -8.530 1.187
235 HG21 VAL 34 3HG2 VAL 34 -2.309 -5.878 -1.384
236 HG22 VAL 34 1HG2 VAL 34 -4.005 -5.567 -1.015
237 HG23 VAL 34 2HG2 VAL 34 -2.778 -5.362 0.235
238 H HIS 35 H HIS 35 -3.835 -6.599 -3.323
239 HA HIS 35 HA HIS 35 -6.512 -5.598 -2.903
240 HB2 HIS 35 1HB HIS 35 -4.379 -4.973 -4.945
241 HB3 HIS 35 2HB HIS 35 -5.974 -4.228 -4.971
242 HD1 HIS 35 HD1 HIS 35 -6.576 -2.741 -2.823
243 HD2 HIS 35 HD2 HIS 35 -2.581 -3.798 -3.254
244 HE1 HIS 35 HE1 HIS 35 -5.302 -1.183 -1.315
245 H THR 36 H THR 36 -4.943 -7.951 -4.889
246 HA THR 36 HA THR 36 -7.096 -8.104 -6.817
247 HB THR 36 HB THR 36 -5.850 -9.962 -7.800
248 HG1 THR 36 HG1 THR 36 -4.383 -11.008 -6.681
249 HG21 THR 36 3HG2 THR 36 -3.584 -8.696 -8.052
250 HG22 THR 36 1HG2 THR 36 -4.395 -7.436 -7.124
251 HG23 THR 36 2HG2 THR 36 -5.065 -7.963 -8.668
252 H GLY 37 H GLY 37 -8.053 -8.463 -4.228
253 HA2 GLY 37 1HA GLY 37 -8.428 -11.348 -3.896
254 HA3 GLY 37 2HA GLY 37 -8.894 -10.104 -2.746
255 H GLU 38 H GLU 38 -10.930 -9.292 -2.790
256 HA GLU 38 HA GLU 38 -12.673 -10.136 -5.005
257 HB2 GLU 38 1HB GLU 38 -12.898 -11.488 -2.825
258 HB3 GLU 38 2HB GLU 38 -13.625 -10.035 -2.153
259 HG2 GLU 38 1HG GLU 38 -15.250 -11.721 -2.990
260 HG3 GLU 38 2HG GLU 38 -15.423 -10.118 -3.703
261 H LYS 39 H LYS 39 -12.662 -8.113 -5.954
262 HA LYS 39 HA LYS 39 -14.182 -6.067 -4.501
263 HB2 LYS 39 1HB LYS 39 -11.606 -5.627 -6.015
264 HB3 LYS 39 2HB LYS 39 -12.696 -4.324 -5.559
265 HG2 LYS 39 1HG LYS 39 -12.246 -4.567 -3.296
266 HG3 LYS 39 2HG LYS 39 -11.631 -6.209 -3.495
267 HD2 LYS 39 1HD LYS 39 -9.665 -5.058 -3.226
268 HD3 LYS 39 2HD LYS 39 -9.827 -5.002 -4.983
269 HE2 LYS 39 1HE LYS 39 -10.566 -2.774 -4.950
270 HE3 LYS 39 2HE LYS 39 -10.918 -2.827 -3.223
271 HZ1 LYS 39 3HZ LYS 39 -8.940 -1.636 -3.388
272 HZ2 LYS 39 1HZ LYS 39 -8.285 -2.671 -4.555
273 HZ3 LYS 39 2HZ LYS 39 -8.429 -3.189 -2.951
274 HA PRO 40 HA PRO 40 -16.548 -5.743 -8.186
275 HB2 PRO 40 1HB PRO 40 -17.325 -3.144 -8.071
276 HB3 PRO 40 2HB PRO 40 -17.979 -4.391 -7.002
277 HG2 PRO 40 1HG PRO 40 -15.836 -2.370 -6.467
278 HG3 PRO 40 2HG PRO 40 -17.174 -2.884 -5.424
279 HD2 PRO 40 1HD PRO 40 -14.648 -3.808 -5.114
280 HD3 PRO 40 2HD PRO 40 -16.077 -4.794 -4.744
281 H SER 41 H SER 41 -14.774 -6.045 -9.663
282 HA SER 41 HA SER 41 -14.095 -3.573 -11.092
283 HB2 SER 41 1HB SER 41 -12.083 -3.954 -9.919
284 HB3 SER 41 2HB SER 41 -12.182 -5.700 -10.146
285 HG SER 41 HG SER 41 -12.064 -4.135 -12.441
286 H GLY 42 H GLY 42 -14.414 -3.702 -13.226
287 HA2 GLY 42 1HA GLY 42 -15.249 -4.610 -15.184
288 HA3 GLY 42 2HA GLY 42 -13.848 -5.657 -15.004
289 HA PRO 43 HA PRO 43 -16.672 -9.034 -14.933
290 HB2 PRO 43 1HB PRO 43 -14.990 -10.929 -13.958
291 HB3 PRO 43 2HB PRO 43 -14.900 -10.326 -15.617
292 HG2 PRO 43 1HG PRO 43 -13.256 -9.566 -13.233
293 HG3 PRO 43 2HG PRO 43 -12.735 -9.869 -14.901
294 HD2 PRO 43 1HD PRO 43 -13.069 -7.371 -13.910
295 HD3 PRO 43 2HD PRO 43 -13.369 -7.770 -15.614
296 H SER 44 H SER 44 -17.898 -7.927 -13.183
297 HA SER 44 HA SER 44 -17.398 -9.139 -10.546
298 HB2 SER 44 1HB SER 44 -18.628 -7.276 -9.574
299 HB3 SER 44 2HB SER 44 -17.338 -6.656 -10.605
300 HG SER 44 HG SER 44 -19.160 -5.522 -11.121
301 H SER 45 H SER 45 -19.561 -9.259 -9.242
302 HA SER 45 HA SER 45 -21.616 -10.452 -10.987
303 HB2 SER 45 1HB SER 45 -20.601 -11.428 -8.311
304 HB3 SER 45 2HB SER 45 -22.070 -12.036 -9.075
305 HG SER 45 HG SER 45 -19.391 -12.315 -9.890
306 H GLY 46 H GLY 46 -21.694 -7.774 -10.233
307 HA2 GLY 46 1HA GLY 46 -24.279 -7.589 -9.113
308 HA3 GLY 46 2HA GLY 46 -23.088 -7.191 -7.883
Start of MODEL 8
1 H1 GLY 1 H GLY 1 -5.607 11.033 19.701
2 HA2 GLY 1 1HA GLY 1 -2.899 11.050 20.414
3 HA3 GLY 1 2HA GLY 1 -3.578 10.190 19.040
4 H SER 2 H SER 2 -2.043 10.605 17.529
5 HA SER 2 HA SER 2 -2.084 13.138 16.243
6 HB2 SER 2 1HB SER 2 -0.562 13.584 18.216
7 HB3 SER 2 2HB SER 2 0.562 12.419 17.518
8 HG SER 2 HG SER 2 1.202 13.915 16.205
9 H SER 3 H SER 3 -0.926 13.144 14.250
10 HA SER 3 HA SER 3 0.382 10.669 13.444
11 HB2 SER 3 1HB SER 3 -1.042 10.343 11.498
12 HB3 SER 3 2HB SER 3 -2.033 10.334 12.956
13 HG SER 3 HG SER 3 -2.753 12.365 12.477
14 H GLY 4 H GLY 4 1.558 10.858 11.443
15 HA2 GLY 4 1HA GLY 4 1.708 13.209 9.911
16 HA3 GLY 4 2HA GLY 4 2.927 13.294 11.174
17 H SER 5 H SER 5 2.449 12.468 8.047
18 HA SER 5 HA SER 5 3.811 10.039 7.733
19 HB2 SER 5 1HB SER 5 3.759 12.361 5.791
20 HB3 SER 5 2HB SER 5 4.079 10.671 5.402
21 HG SER 5 HG SER 5 2.012 10.322 5.358
22 H SER 6 H SER 6 5.608 10.039 9.111
23 HA SER 6 HA SER 6 7.914 11.507 8.043
24 HB2 SER 6 1HB SER 6 7.132 11.318 10.959
25 HB3 SER 6 2HB SER 6 8.713 11.863 10.398
26 HG SER 6 HG SER 6 7.770 13.623 9.456
27 H GLY 7 H GLY 7 9.529 10.173 7.576
28 HA2 GLY 7 1HA GLY 7 10.319 8.031 9.294
29 HA3 GLY 7 2HA GLY 7 9.486 7.435 7.866
30 H SER 8 H SER 8 12.183 6.871 8.535
31 HA SER 8 HA SER 8 13.680 8.416 6.531
32 HB2 SER 8 1HB SER 8 14.571 6.756 8.888
33 HB3 SER 8 2HB SER 8 15.692 7.278 7.630
34 HG SER 8 HG SER 8 14.835 9.464 8.114
35 H GLY 9 H GLY 9 13.858 7.515 4.595
36 HA2 GLY 9 1HA GLY 9 15.030 5.289 3.778
37 HA3 GLY 9 2HA GLY 9 13.487 4.632 4.304
38 H GLU 10 H GLU 10 14.709 4.736 1.622
39 HA GLU 10 HA GLU 10 12.562 6.219 0.253
40 HB2 GLU 10 1HB GLU 10 14.041 6.725 -1.557
41 HB3 GLU 10 2HB GLU 10 14.843 7.204 -0.068
42 HG2 GLU 10 1HG GLU 10 16.415 5.547 -0.214
43 HG3 GLU 10 2HG GLU 10 15.376 4.495 -1.173
44 H LYS 11 H LYS 11 11.580 5.235 -1.510
45 HA LYS 11 HA LYS 11 12.417 2.539 -2.247
46 HB2 LYS 11 1HB LYS 11 9.755 3.236 -1.024
47 HB3 LYS 11 2HB LYS 11 9.963 1.818 -2.043
48 HG2 LYS 11 1HG LYS 11 11.436 0.806 -0.519
49 HG3 LYS 11 2HG LYS 11 11.670 2.310 0.375
50 HD2 LYS 11 1HD LYS 11 8.910 1.229 0.176
51 HD3 LYS 11 2HD LYS 11 10.046 0.394 1.237
52 HE2 LYS 11 1HE LYS 11 10.493 2.489 2.411
53 HE3 LYS 11 2HE LYS 11 9.377 3.335 1.340
54 HZ1 LYS 11 3HZ LYS 11 7.564 2.382 2.323
55 HZ2 LYS 11 1HZ LYS 11 8.597 2.485 3.659
56 HZ3 LYS 11 2HZ LYS 11 8.407 1.012 2.849
57 HA PRO 12 HA PRO 12 11.355 4.459 -6.138
58 HB2 PRO 12 1HB PRO 12 12.198 2.393 -7.684
59 HB3 PRO 12 2HB PRO 12 13.306 3.556 -6.947
60 HG2 PRO 12 1HG PRO 12 12.565 0.803 -6.032
61 HG3 PRO 12 2HG PRO 12 14.161 1.575 -6.080
62 HD2 PRO 12 1HD PRO 12 12.708 1.373 -3.804
63 HD3 PRO 12 2HD PRO 12 13.796 2.739 -4.124
64 H PHE 13 H PHE 13 10.256 1.403 -4.895
65 HA PHE 13 HA PHE 13 8.183 1.208 -6.952
66 HB2 PHE 13 1HB PHE 13 8.838 -0.736 -4.729
67 HB3 PHE 13 2HB PHE 13 7.759 -1.023 -6.090
68 HD1 PHE 13 HD1 PHE 13 11.249 -0.698 -5.034
69 HD2 PHE 13 HD2 PHE 13 8.618 -1.527 -8.276
70 HE1 PHE 13 HE1 PHE 13 13.140 -1.582 -6.338
71 HE2 PHE 13 HE2 PHE 13 10.504 -2.413 -9.584
72 HZ PHE 13 HZ PHE 13 12.768 -2.442 -8.616
73 H LYS 14 H LYS 14 6.098 1.656 -6.577
74 HA LYS 14 HA LYS 14 5.178 1.959 -3.809
75 HB2 LYS 14 1HB LYS 14 5.743 4.203 -4.475
76 HB3 LYS 14 2HB LYS 14 4.887 4.019 -6.000
77 HG2 LYS 14 1HG LYS 14 2.808 3.625 -4.521
78 HG3 LYS 14 2HG LYS 14 3.779 4.362 -3.245
79 HD2 LYS 14 1HD LYS 14 4.181 6.276 -4.872
80 HD3 LYS 14 2HD LYS 14 2.894 5.573 -5.853
81 HE2 LYS 14 1HE LYS 14 1.710 7.082 -4.587
82 HE3 LYS 14 2HE LYS 14 1.559 5.626 -3.605
83 HZ1 LYS 14 3HZ LYS 14 2.162 7.258 -2.094
84 HZ2 LYS 14 1HZ LYS 14 3.266 7.989 -3.147
85 HZ3 LYS 14 2HZ LYS 14 3.638 6.503 -2.430
86 H CYS 15 H CYS 15 3.255 1.044 -3.465
87 HA CYS 15 HA CYS 15 1.902 -0.289 -5.605
88 HB2 CYS 15 1HB CYS 15 2.075 -1.199 -3.286
89 HB3 CYS 15 2HB CYS 15 0.993 0.080 -2.744
90 H GLU 16 H GLU 16 0.971 1.091 -7.039
91 HA GLU 16 HA GLU 16 -0.314 3.496 -6.453
92 HB2 GLU 16 1HB GLU 16 -0.891 1.612 -8.747
93 HB3 GLU 16 2HB GLU 16 -1.321 3.316 -8.677
94 HG2 GLU 16 1HG GLU 16 1.097 3.859 -8.528
95 HG3 GLU 16 2HG GLU 16 1.450 2.149 -8.771
96 H GLU 17 H GLU 17 -1.402 0.228 -6.147
97 HA GLU 17 HA GLU 17 -4.160 0.518 -6.280
98 HB2 GLU 17 1HB GLU 17 -2.715 -1.263 -4.318
99 HB3 GLU 17 2HB GLU 17 -4.317 -1.504 -5.001
100 HG2 GLU 17 1HG GLU 17 -2.993 -1.499 -7.269
101 HG3 GLU 17 2HG GLU 17 -1.646 -1.944 -6.224
102 H CYS 18 H CYS 18 -2.076 0.747 -3.398
103 HA CYS 18 HA CYS 18 -4.223 2.288 -2.090
104 HB2 CYS 18 1HB CYS 18 -3.380 1.453 0.058
105 HB3 CYS 18 2HB CYS 18 -3.852 0.125 -0.996
106 H GLY 19 H GLY 19 -0.738 1.940 -2.551
107 HA2 GLY 19 1HA GLY 19 0.360 4.155 -3.012
108 HA3 GLY 19 2HA GLY 19 -0.410 4.692 -1.526
109 H LYS 20 H LYS 20 0.648 1.464 -1.440
110 HA LYS 20 HA LYS 20 2.490 1.964 0.648
111 HB2 LYS 20 1HB LYS 20 1.595 -0.406 -0.900
112 HB3 LYS 20 2HB LYS 20 3.149 -0.536 -0.085
113 HG2 LYS 20 1HG LYS 20 1.837 0.342 1.981
114 HG3 LYS 20 2HG LYS 20 0.422 -0.207 1.079
115 HD2 LYS 20 1HD LYS 20 0.927 -2.099 2.283
116 HD3 LYS 20 2HD LYS 20 1.838 -2.398 0.800
117 HE2 LYS 20 1HE LYS 20 3.261 -2.902 2.652
118 HE3 LYS 20 2HE LYS 20 3.837 -1.406 1.918
119 HZ1 LYS 20 3HZ LYS 20 3.822 -0.732 4.054
120 HZ2 LYS 20 1HZ LYS 20 2.648 -1.853 4.534
121 HZ3 LYS 20 2HZ LYS 20 2.186 -0.430 3.745
122 H ARG 21 H ARG 21 4.753 0.738 0.417
123 HA ARG 21 HA ARG 21 6.044 1.404 -2.112
124 HB2 ARG 21 1HB ARG 21 6.907 2.549 0.549
125 HB3 ARG 21 2HB ARG 21 7.861 2.627 -0.926
126 HG2 ARG 21 1HG ARG 21 5.758 3.770 -1.924
127 HG3 ARG 21 2HG ARG 21 5.330 4.048 -0.235
128 HD2 ARG 21 1HD ARG 21 8.084 4.732 -1.117
129 HD3 ARG 21 2HD ARG 21 6.766 5.787 -1.623
130 HE ARG 21 HE ARG 21 7.822 5.474 1.044
131 HH11 ARG 21 1HH1 ARG 21 5.138 6.536 -0.902
132 HH12 ARG 21 2HH1 ARG 21 4.517 7.610 0.308
133 HH21 ARG 21 1HH2 ARG 21 7.015 6.884 2.645
134 HH22 ARG 21 2HH2 ARG 21 5.586 7.808 2.324
135 H PHE 22 H PHE 22 8.247 0.541 -2.258
136 HA PHE 22 HA PHE 22 9.116 -1.362 -0.280
137 HB2 PHE 22 1HB PHE 22 8.435 -2.450 -3.010
138 HB3 PHE 22 2HB PHE 22 8.913 -3.350 -1.574
139 HD1 PHE 22 HD2 PHE 22 6.202 -1.279 -3.013
140 HD2 PHE 22 HD1 PHE 22 7.315 -4.133 -0.058
141 HE1 PHE 22 HE2 PHE 22 3.833 -1.592 -2.427
142 HE2 PHE 22 HE1 PHE 22 4.947 -4.451 0.532
143 HZ PHE 22 HZ PHE 22 3.203 -3.178 -0.652
144 H THR 23 H THR 23 11.228 -2.174 -0.682
145 HA THR 23 HA THR 23 12.829 -0.377 -2.284
146 HB THR 23 HB THR 23 13.520 -1.135 0.008
147 HG1 THR 23 HG1 THR 23 15.753 -1.783 -0.910
148 HG21 THR 23 3HG2 THR 23 14.018 -3.289 0.513
149 HG22 THR 23 1HG2 THR 23 14.616 -3.644 -1.108
150 HG23 THR 23 2HG2 THR 23 12.881 -3.624 -0.793
151 H GLN 24 H GLN 24 11.272 -3.301 -2.807
152 HA GLN 24 HA GLN 24 12.823 -3.735 -5.245
153 HB2 GLN 24 1HB GLN 24 12.604 -5.612 -2.972
154 HB3 GLN 24 2HB GLN 24 12.356 -6.313 -4.565
155 HG2 GLN 24 1HG GLN 24 14.710 -4.554 -4.199
156 HG3 GLN 24 2HG GLN 24 14.746 -6.143 -3.437
157 HE21 GLN 24 1HE2 GLN 24 13.403 -5.007 -6.513
158 HE22 GLN 24 2HE2 GLN 24 14.292 -6.106 -7.506
159 H ASN 25 H ASN 25 11.679 -4.789 -6.913
160 HA ASN 25 HA ASN 25 8.938 -4.192 -7.046
161 HB2 ASN 25 1HB ASN 25 9.012 -5.667 -9.124
162 HB3 ASN 25 2HB ASN 25 10.121 -4.299 -9.097
163 HD21 ASN 25 1HD2 ASN 25 12.337 -4.684 -8.708
164 HD22 ASN 25 2HD2 ASN 25 13.035 -6.235 -9.013
165 H SER 26 H SER 26 10.608 -7.310 -6.665
166 HA SER 26 HA SER 26 8.521 -9.057 -6.662
167 HB2 SER 26 1HB SER 26 10.883 -9.073 -4.768
168 HB3 SER 26 2HB SER 26 9.834 -10.454 -5.088
169 HG SER 26 HG SER 26 11.075 -9.138 -7.233
170 H GLN 27 H GLN 27 9.459 -6.875 -4.064
171 HA GLN 27 HA GLN 27 7.684 -7.913 -2.113
172 HB2 GLN 27 1HB GLN 27 8.946 -5.178 -2.367
173 HB3 GLN 27 2HB GLN 27 8.078 -5.749 -0.947
174 HG2 GLN 27 1HG GLN 27 9.750 -7.646 -0.859
175 HG3 GLN 27 2HG GLN 27 10.681 -6.747 -2.056
176 HE21 GLN 27 1HE2 GLN 27 10.648 -4.242 -1.329
177 HE22 GLN 27 2HE2 GLN 27 11.263 -4.009 0.269
178 H LEU 28 H LEU 28 7.478 -4.992 -4.150
179 HA LEU 28 HA LEU 28 4.904 -4.228 -3.386
180 HB2 LEU 28 1HB LEU 28 6.294 -2.698 -4.568
181 HB3 LEU 28 2HB LEU 28 6.434 -3.794 -5.941
182 HG LEU 28 HG LEU 28 4.078 -3.419 -6.483
183 HD11 LEU 28 1HD1 LEU 28 3.943 -1.201 -4.497
184 HD12 LEU 28 2HD1 LEU 28 3.591 -2.849 -3.979
185 HD13 LEU 28 3HD1 LEU 28 2.640 -2.108 -5.266
186 HD21 LEU 28 3HD2 LEU 28 5.664 -2.002 -7.575
187 HD22 LEU 28 1HD2 LEU 28 5.766 -0.943 -6.168
188 HD23 LEU 28 2HD2 LEU 28 4.278 -1.012 -7.114
189 H HIS 29 H HIS 29 5.901 -6.046 -6.289
190 HA HIS 29 HA HIS 29 3.335 -6.577 -7.254
191 HB2 HIS 29 1HB HIS 29 6.029 -7.786 -7.650
192 HB3 HIS 29 2HB HIS 29 4.631 -8.706 -8.201
193 HD1 HIS 29 HD1 HIS 29 5.784 -8.265 -10.607
194 HD2 HIS 29 HD2 HIS 29 4.106 -4.967 -8.718
195 HE1 HIS 29 HE1 HIS 29 5.508 -6.529 -12.405
196 H SER 30 H SER 30 5.133 -8.030 -4.674
197 HA SER 30 HA SER 30 3.480 -10.393 -4.528
198 HB2 SER 30 1HB SER 30 5.713 -10.724 -3.811
199 HB3 SER 30 2HB SER 30 5.687 -9.281 -2.798
200 HG SER 30 HG SER 30 3.806 -11.237 -2.216
201 H HIS 31 H HIS 31 3.461 -7.195 -3.240
202 HA HIS 31 HA HIS 31 1.604 -7.861 -1.103
203 HB2 HIS 31 1HB HIS 31 2.986 -6.186 -0.338
204 HB3 HIS 31 2HB HIS 31 3.124 -5.428 -1.922
205 HD1 HIS 31 HD1 HIS 31 0.888 -5.577 1.089
206 HD2 HIS 31 HD2 HIS 31 1.237 -3.465 -2.472
207 HE1 HIS 31 HE1 HIS 31 -0.727 -3.660 1.284
208 H GLN 32 H GLN 32 1.623 -6.192 -4.212
209 HA GLN 32 HA GLN 32 -0.858 -5.019 -4.229
210 HB2 GLN 32 1HB GLN 32 0.758 -6.320 -6.397
211 HB3 GLN 32 2HB GLN 32 -0.829 -5.651 -6.749
212 HG2 GLN 32 1HG GLN 32 -0.066 -3.471 -5.890
213 HG3 GLN 32 2HG GLN 32 1.538 -4.159 -5.643
214 HE21 GLN 32 1HE2 GLN 32 2.440 -2.653 -7.066
215 HE22 GLN 32 2HE2 GLN 32 2.251 -2.795 -8.778
216 H ARG 33 H ARG 33 -0.095 -8.380 -4.236
217 HA ARG 33 HA ARG 33 -2.370 -9.481 -5.405
218 HB2 ARG 33 1HB ARG 33 -1.057 -10.702 -2.992
219 HB3 ARG 33 2HB ARG 33 -1.774 -11.510 -4.380
220 HG2 ARG 33 1HG ARG 33 0.082 -10.528 -5.769
221 HG3 ARG 33 2HG ARG 33 0.838 -10.033 -4.253
222 HD2 ARG 33 1HD ARG 33 1.823 -12.100 -4.827
223 HD3 ARG 33 2HD ARG 33 0.677 -12.449 -3.533
224 HE ARG 33 HE ARG 33 -0.725 -12.851 -5.851
225 HH11 ARG 33 1HH1 ARG 33 2.208 -14.113 -4.464
226 HH12 ARG 33 2HH1 ARG 33 2.055 -15.662 -5.224
227 HH21 ARG 33 1HH2 ARG 33 -0.937 -14.887 -6.858
228 HH22 ARG 33 2HH2 ARG 33 0.267 -16.101 -6.587
229 H VAL 34 H VAL 34 -1.890 -8.087 -2.237
230 HA VAL 34 HA VAL 34 -4.149 -9.103 -0.929
231 HB VAL 34 HB VAL 34 -3.922 -7.303 0.640
232 HG11 VAL 34 1HG1 VAL 34 -1.396 -8.481 -0.432
233 HG12 VAL 34 2HG1 VAL 34 -1.327 -7.320 0.895
234 HG13 VAL 34 3HG1 VAL 34 -2.240 -8.819 1.079
235 HG21 VAL 34 3HG2 VAL 34 -3.246 -5.233 0.133
236 HG22 VAL 34 1HG2 VAL 34 -1.803 -5.818 -0.694
237 HG23 VAL 34 2HG2 VAL 34 -3.340 -5.740 -1.553
238 H HIS 35 H HIS 35 -3.847 -6.736 -3.412
239 HA HIS 35 HA HIS 35 -6.516 -5.659 -2.925
240 HB2 HIS 35 1HB HIS 35 -4.371 -4.932 -4.926
241 HB3 HIS 35 2HB HIS 35 -5.960 -4.173 -4.879
242 HD1 HIS 35 HD1 HIS 35 -6.515 -3.001 -2.449
243 HD2 HIS 35 HD2 HIS 35 -2.526 -3.686 -3.388
244 HE1 HIS 35 HE1 HIS 35 -5.197 -1.500 -0.921
245 H THR 36 H THR 36 -4.881 -7.943 -4.922
246 HA THR 36 HA THR 36 -6.766 -8.009 -7.058
247 HB THR 36 HB THR 36 -5.692 -10.122 -7.703
248 HG1 THR 36 HG1 THR 36 -4.401 -11.192 -6.353
249 HG21 THR 36 3HG2 THR 36 -3.199 -8.934 -7.230
250 HG22 THR 36 1HG2 THR 36 -4.347 -7.601 -7.331
251 HG23 THR 36 2HG2 THR 36 -4.214 -8.753 -8.660
252 H GLY 37 H GLY 37 -6.486 -9.634 -3.964
253 HA2 GLY 37 1HA GLY 37 -8.370 -11.690 -4.441
254 HA3 GLY 37 2HA GLY 37 -7.875 -11.094 -2.864
255 H GLU 38 H GLU 38 -8.779 -8.708 -2.523
256 HA GLU 38 HA GLU 38 -11.587 -8.647 -3.387
257 HB2 GLU 38 1HB GLU 38 -11.423 -9.626 -1.107
258 HB3 GLU 38 2HB GLU 38 -10.652 -8.145 -0.557
259 HG2 GLU 38 1HG GLU 38 -12.691 -6.900 -1.222
260 HG3 GLU 38 2HG GLU 38 -13.455 -8.441 -1.606
261 H LYS 39 H LYS 39 -12.593 -6.549 -3.242
262 HA LYS 39 HA LYS 39 -10.678 -4.413 -3.761
263 HB2 LYS 39 1HB LYS 39 -12.614 -3.169 -4.616
264 HB3 LYS 39 2HB LYS 39 -12.478 -4.748 -5.377
265 HG2 LYS 39 1HG LYS 39 -14.197 -5.586 -3.776
266 HG3 LYS 39 2HG LYS 39 -14.407 -3.924 -3.220
267 HD2 LYS 39 1HD LYS 39 -16.093 -4.198 -4.812
268 HD3 LYS 39 2HD LYS 39 -14.813 -3.363 -5.696
269 HE2 LYS 39 1HE LYS 39 -14.080 -5.859 -6.223
270 HE3 LYS 39 2HE LYS 39 -15.794 -6.158 -5.940
271 HZ1 LYS 39 3HZ LYS 39 -14.937 -5.555 -8.305
272 HZ2 LYS 39 1HZ LYS 39 -15.009 -3.966 -7.728
273 HZ3 LYS 39 2HZ LYS 39 -16.404 -4.922 -7.749
274 HA PRO 40 HA PRO 40 -11.204 -2.366 0.090
275 HB2 PRO 40 1HB PRO 40 -10.845 0.216 -0.668
276 HB3 PRO 40 2HB PRO 40 -9.521 -0.953 -0.580
277 HG2 PRO 40 1HG PRO 40 -11.073 -0.024 -2.966
278 HG3 PRO 40 2HG PRO 40 -9.327 -0.286 -2.799
279 HD2 PRO 40 1HD PRO 40 -10.963 -2.084 -3.992
280 HD3 PRO 40 2HD PRO 40 -9.515 -2.566 -3.085
281 H SER 41 H SER 41 -12.449 -0.574 1.150
282 HA SER 41 HA SER 41 -15.201 -0.703 0.285
283 HB2 SER 41 1HB SER 41 -13.909 0.614 2.685
284 HB3 SER 41 2HB SER 41 -15.648 0.547 2.400
285 HG SER 41 HG SER 41 -14.274 -1.863 2.277
286 H GLY 42 H GLY 42 -15.308 0.522 -1.596
287 HA2 GLY 42 1HA GLY 42 -16.215 2.970 -1.738
288 HA3 GLY 42 2HA GLY 42 -14.526 3.344 -1.427
289 HA PRO 43 HA PRO 43 -15.523 2.276 -6.022
290 HB2 PRO 43 1HB PRO 43 -16.281 4.697 -6.988
291 HB3 PRO 43 2HB PRO 43 -17.433 3.503 -6.379
292 HG2 PRO 43 1HG PRO 43 -16.300 5.911 -5.008
293 HG3 PRO 43 2HG PRO 43 -17.968 5.311 -5.019
294 HD2 PRO 43 1HD PRO 43 -16.279 4.879 -2.948
295 HD3 PRO 43 2HD PRO 43 -17.540 3.718 -3.410
296 H SER 44 H SER 44 -13.583 4.153 -4.130
297 HA SER 44 HA SER 44 -12.143 5.702 -5.994
298 HB2 SER 44 1HB SER 44 -10.333 5.653 -4.227
299 HB3 SER 44 2HB SER 44 -11.909 6.212 -3.667
300 HG SER 44 HG SER 44 -11.516 3.496 -3.454
301 H SER 45 H SER 45 -11.048 4.966 -7.679
302 HA SER 45 HA SER 45 -9.039 2.941 -7.374
303 HB2 SER 45 1HB SER 45 -9.927 1.361 -9.007
304 HB3 SER 45 2HB SER 45 -11.071 1.549 -7.678
305 HG SER 45 HG SER 45 -12.048 3.218 -9.140
306 H GLY 46 H GLY 46 -7.473 3.077 -8.933
307 HA2 GLY 46 1HA GLY 46 -7.181 5.430 -10.378
308 HA3 GLY 46 2HA GLY 46 -6.284 3.952 -10.691
Start of MODEL 9
1 H1 GLY 1 H GLY 1 13.292 13.978 24.181
2 HA2 GLY 1 1HA GLY 1 11.074 12.477 24.539
3 HA3 GLY 1 2HA GLY 1 10.403 14.040 24.098
4 H SER 2 H SER 2 10.728 14.849 22.005
5 HA SER 2 HA SER 2 10.407 13.258 19.882
6 HB2 SER 2 1HB SER 2 10.382 15.713 19.733
7 HB3 SER 2 2HB SER 2 12.141 15.742 19.869
8 HG SER 2 HG SER 2 11.237 15.845 17.678
9 H SER 3 H SER 3 11.447 11.530 19.171
10 HA SER 3 HA SER 3 14.321 11.632 18.757
11 HB2 SER 3 1HB SER 3 12.995 9.899 20.784
12 HB3 SER 3 2HB SER 3 14.296 9.185 19.831
13 HG SER 3 HG SER 3 14.400 11.084 21.812
14 H GLY 4 H GLY 4 14.885 10.632 16.920
15 HA2 GLY 4 1HA GLY 4 13.443 8.350 15.915
16 HA3 GLY 4 2HA GLY 4 13.149 9.816 14.992
17 H SER 5 H SER 5 15.331 7.250 15.646
18 HA SER 5 HA SER 5 17.748 8.222 14.715
19 HB2 SER 5 1HB SER 5 16.633 5.447 14.240
20 HB3 SER 5 2HB SER 5 18.335 5.908 14.212
21 HG SER 5 HG SER 5 18.237 5.373 16.248
22 H SER 6 H SER 6 18.371 9.035 12.836
23 HA SER 6 HA SER 6 16.758 9.401 10.629
24 HB2 SER 6 1HB SER 6 18.953 10.560 11.143
25 HB3 SER 6 2HB SER 6 19.766 9.144 10.477
26 HG SER 6 HG SER 6 18.258 11.111 9.188
27 H GLY 7 H GLY 7 15.853 7.955 9.330
28 HA2 GLY 7 1HA GLY 7 17.300 6.115 7.788
29 HA3 GLY 7 2HA GLY 7 16.622 5.254 9.162
30 H SER 8 H SER 8 15.684 7.487 6.557
31 HA SER 8 HA SER 8 12.948 6.502 6.664
32 HB2 SER 8 1HB SER 8 14.156 8.554 4.795
33 HB3 SER 8 2HB SER 8 12.439 8.253 5.064
34 HG SER 8 HG SER 8 12.524 9.333 6.889
35 H GLY 9 H GLY 9 15.585 6.709 4.277
36 HA2 GLY 9 1HA GLY 9 16.118 5.322 2.521
37 HA3 GLY 9 2HA GLY 9 15.017 4.137 3.209
38 H GLU 10 H GLU 10 15.594 5.537 0.443
39 HA GLU 10 HA GLU 10 12.875 6.366 -0.211
40 HB2 GLU 10 1HB GLU 10 13.775 7.131 -2.310
41 HB3 GLU 10 2HB GLU 10 14.817 7.696 -1.012
42 HG2 GLU 10 1HG GLU 10 16.443 6.006 -1.499
43 HG3 GLU 10 2HG GLU 10 15.373 5.259 -2.684
44 H LYS 11 H LYS 11 11.477 5.200 -1.401
45 HA LYS 11 HA LYS 11 12.410 2.590 -2.404
46 HB2 LYS 11 1HB LYS 11 9.755 3.393 -1.218
47 HB3 LYS 11 2HB LYS 11 9.994 1.885 -2.091
48 HG2 LYS 11 1HG LYS 11 11.501 1.071 -0.463
49 HG3 LYS 11 2HG LYS 11 11.634 2.654 0.306
50 HD2 LYS 11 1HD LYS 11 8.937 1.417 0.120
51 HD3 LYS 11 2HD LYS 11 10.078 0.741 1.285
52 HE2 LYS 11 1HE LYS 11 10.408 3.035 2.193
53 HE3 LYS 11 2HE LYS 11 9.137 3.601 1.110
54 HZ1 LYS 11 3HZ LYS 11 7.528 2.653 2.355
55 HZ2 LYS 11 1HZ LYS 11 8.670 2.829 3.592
56 HZ3 LYS 11 2HZ LYS 11 8.483 1.336 2.820
57 HA PRO 12 HA PRO 12 11.300 4.423 -6.334
58 HB2 PRO 12 1HB PRO 12 12.173 2.336 -7.835
59 HB3 PRO 12 2HB PRO 12 13.263 3.542 -7.140
60 HG2 PRO 12 1HG PRO 12 12.593 0.799 -6.146
61 HG3 PRO 12 2HG PRO 12 14.171 1.604 -6.230
62 HD2 PRO 12 1HD PRO 12 12.744 1.431 -3.935
63 HD3 PRO 12 2HD PRO 12 13.798 2.811 -4.302
64 H PHE 13 H PHE 13 10.219 1.457 -4.928
65 HA PHE 13 HA PHE 13 8.146 1.141 -6.980
66 HB2 PHE 13 1HB PHE 13 8.889 -0.741 -4.731
67 HB3 PHE 13 2HB PHE 13 7.774 -1.078 -6.051
68 HD1 PHE 13 HD1 PHE 13 11.284 -0.700 -5.097
69 HD2 PHE 13 HD2 PHE 13 8.581 -1.586 -8.263
70 HE1 PHE 13 HE1 PHE 13 13.149 -1.581 -6.439
71 HE2 PHE 13 HE2 PHE 13 10.441 -2.469 -9.609
72 HZ PHE 13 HZ PHE 13 12.729 -2.468 -8.697
73 H LYS 14 H LYS 14 6.092 1.666 -6.591
74 HA LYS 14 HA LYS 14 5.187 1.947 -3.814
75 HB2 LYS 14 1HB LYS 14 5.788 4.189 -4.550
76 HB3 LYS 14 2HB LYS 14 4.807 4.004 -5.997
77 HG2 LYS 14 1HG LYS 14 2.826 3.702 -4.449
78 HG3 LYS 14 2HG LYS 14 3.887 4.254 -3.151
79 HD2 LYS 14 1HD LYS 14 4.323 6.320 -4.459
80 HD3 LYS 14 2HD LYS 14 3.139 5.773 -5.649
81 HE2 LYS 14 1HE LYS 14 1.941 7.229 -4.267
82 HE3 LYS 14 2HE LYS 14 1.508 5.623 -3.683
83 HZ1 LYS 14 3HZ LYS 14 1.963 6.960 -1.803
84 HZ2 LYS 14 1HZ LYS 14 3.414 7.534 -2.456
85 HZ3 LYS 14 2HZ LYS 14 3.285 5.918 -1.974
86 H CYS 15 H CYS 15 3.260 1.044 -3.455
87 HA CYS 15 HA CYS 15 1.889 -0.285 -5.588
88 HB2 CYS 15 1HB CYS 15 2.086 -1.187 -3.260
89 HB3 CYS 15 2HB CYS 15 0.986 0.079 -2.725
90 H GLU 16 H GLU 16 0.919 1.069 -7.010
91 HA GLU 16 HA GLU 16 -0.342 3.489 -6.416
92 HB2 GLU 16 1HB GLU 16 -0.966 1.600 -8.692
93 HB3 GLU 16 2HB GLU 16 -1.378 3.307 -8.624
94 HG2 GLU 16 1HG GLU 16 1.106 3.755 -8.430
95 HG3 GLU 16 2HG GLU 16 1.341 2.063 -8.863
96 H GLU 17 H GLU 17 -1.440 0.224 -6.092
97 HA GLU 17 HA GLU 17 -4.198 0.530 -6.179
98 HB2 GLU 17 1HB GLU 17 -2.704 -1.265 -4.264
99 HB3 GLU 17 2HB GLU 17 -4.340 -1.487 -4.867
100 HG2 GLU 17 1HG GLU 17 -3.179 -1.533 -7.196
101 HG3 GLU 17 2HG GLU 17 -1.738 -1.911 -6.254
102 H CYS 18 H CYS 18 -2.067 0.740 -3.330
103 HA CYS 18 HA CYS 18 -4.186 2.282 -1.980
104 HB2 CYS 18 1HB CYS 18 -3.278 1.455 0.151
105 HB3 CYS 18 2HB CYS 18 -3.795 0.130 -0.886
106 H GLY 19 H GLY 19 -0.711 1.946 -2.512
107 HA2 GLY 19 1HA GLY 19 0.385 4.149 -2.998
108 HA3 GLY 19 2HA GLY 19 -0.377 4.709 -1.517
109 H LYS 20 H LYS 20 0.713 1.480 -1.429
110 HA LYS 20 HA LYS 20 2.551 2.007 0.659
111 HB2 LYS 20 1HB LYS 20 1.661 -0.375 -0.866
112 HB3 LYS 20 2HB LYS 20 3.228 -0.492 -0.077
113 HG2 LYS 20 1HG LYS 20 1.844 0.460 1.974
114 HG3 LYS 20 2HG LYS 20 0.515 -0.305 1.099
115 HD2 LYS 20 1HD LYS 20 1.337 -2.412 1.420
116 HD3 LYS 20 2HD LYS 20 3.016 -1.868 1.462
117 HE2 LYS 20 1HE LYS 20 2.734 -1.008 3.691
118 HE3 LYS 20 2HE LYS 20 1.006 -1.351 3.649
119 HZ1 LYS 20 3HZ LYS 20 1.591 -3.732 3.412
120 HZ2 LYS 20 1HZ LYS 20 2.089 -3.059 4.883
121 HZ3 LYS 20 2HZ LYS 20 3.217 -3.330 3.652
122 H ARG 21 H ARG 21 4.819 0.768 0.410
123 HA ARG 21 HA ARG 21 6.099 1.429 -2.121
124 HB2 ARG 21 1HB ARG 21 6.985 2.615 0.516
125 HB3 ARG 21 2HB ARG 21 7.892 2.711 -0.988
126 HG2 ARG 21 1HG ARG 21 5.697 3.786 -1.905
127 HG3 ARG 21 2HG ARG 21 5.378 4.098 -0.198
128 HD2 ARG 21 1HD ARG 21 7.875 4.977 -0.276
129 HD3 ARG 21 2HD ARG 21 7.483 5.206 -1.980
130 HE ARG 21 HE ARG 21 5.404 6.322 -0.538
131 HH11 ARG 21 1HH1 ARG 21 8.833 6.810 -0.890
132 HH12 ARG 21 2HH1 ARG 21 8.758 8.508 -0.555
133 HH21 ARG 21 1HH2 ARG 21 5.292 8.557 -0.095
134 HH22 ARG 21 2HH2 ARG 21 6.743 9.501 -0.102
135 H PHE 22 H PHE 22 8.195 0.476 -2.370
136 HA PHE 22 HA PHE 22 9.147 -1.339 -0.326
137 HB2 PHE 22 1HB PHE 22 8.423 -2.493 -3.018
138 HB3 PHE 22 2HB PHE 22 8.922 -3.357 -1.568
139 HD1 PHE 22 HD2 PHE 22 6.188 -1.333 -3.027
140 HD2 PHE 22 HD1 PHE 22 7.347 -4.093 -0.001
141 HE1 PHE 22 HE2 PHE 22 3.828 -1.631 -2.401
142 HE2 PHE 22 HE1 PHE 22 4.988 -4.397 0.629
143 HZ PHE 22 HZ PHE 22 3.225 -3.164 -0.570
144 H THR 23 H THR 23 11.268 -2.070 -0.686
145 HA THR 23 HA THR 23 12.830 -0.331 -2.366
146 HB THR 23 HB THR 23 13.611 -0.993 -0.111
147 HG1 THR 23 HG1 THR 23 15.010 -0.788 -2.292
148 HG21 THR 23 3HG2 THR 23 13.662 -3.715 -1.382
149 HG22 THR 23 1HG2 THR 23 12.952 -3.227 0.156
150 HG23 THR 23 2HG2 THR 23 14.705 -3.317 -0.017
151 H GLN 24 H GLN 24 11.287 -3.284 -2.813
152 HA GLN 24 HA GLN 24 12.815 -3.747 -5.266
153 HB2 GLN 24 1HB GLN 24 12.539 -5.610 -2.980
154 HB3 GLN 24 2HB GLN 24 12.325 -6.307 -4.580
155 HG2 GLN 24 1HG GLN 24 14.739 -4.868 -3.516
156 HG3 GLN 24 2HG GLN 24 14.604 -6.569 -3.958
157 HE21 GLN 24 1HE2 GLN 24 13.188 -6.248 -6.359
158 HE22 GLN 24 2HE2 GLN 24 14.242 -5.514 -7.515
159 H ASN 25 H ASN 25 11.663 -4.906 -6.895
160 HA ASN 25 HA ASN 25 8.924 -4.233 -7.044
161 HB2 ASN 25 1HB ASN 25 8.968 -5.688 -9.117
162 HB3 ASN 25 2HB ASN 25 10.146 -4.379 -9.086
163 HD21 ASN 25 1HD2 ASN 25 12.339 -4.887 -8.629
164 HD22 ASN 25 2HD2 ASN 25 12.958 -6.468 -8.950
165 H SER 26 H SER 26 10.567 -7.358 -6.619
166 HA SER 26 HA SER 26 8.456 -9.084 -6.600
167 HB2 SER 26 1HB SER 26 10.808 -9.125 -4.692
168 HB3 SER 26 2HB SER 26 9.759 -10.497 -5.052
169 HG SER 26 HG SER 26 11.049 -10.862 -6.657
170 H GLN 27 H GLN 27 9.451 -6.915 -4.007
171 HA GLN 27 HA GLN 27 7.662 -7.908 -2.049
172 HB2 GLN 27 1HB GLN 27 9.021 -5.227 -2.337
173 HB3 GLN 27 2HB GLN 27 8.079 -5.697 -0.929
174 HG2 GLN 27 1HG GLN 27 9.642 -7.668 -0.703
175 HG3 GLN 27 2HG GLN 27 10.655 -6.881 -1.912
176 HE21 GLN 27 1HE2 GLN 27 10.600 -4.298 -1.255
177 HE22 GLN 27 2HE2 GLN 27 11.240 -4.041 0.329
178 H LEU 28 H LEU 28 7.496 -4.997 -4.102
179 HA LEU 28 HA LEU 28 4.933 -4.194 -3.329
180 HB2 LEU 28 1HB LEU 28 6.334 -2.672 -4.500
181 HB3 LEU 28 2HB LEU 28 6.481 -3.768 -5.873
182 HG LEU 28 HG LEU 28 4.160 -3.365 -6.471
183 HD11 LEU 28 1HD1 LEU 28 3.573 -2.897 -3.978
184 HD12 LEU 28 2HD1 LEU 28 2.676 -2.086 -5.261
185 HD13 LEU 28 3HD1 LEU 28 3.952 -1.227 -4.399
186 HD21 LEU 28 3HD2 LEU 28 5.928 -1.872 -7.330
187 HD22 LEU 28 1HD2 LEU 28 5.620 -0.771 -5.988
188 HD23 LEU 28 2HD2 LEU 28 4.364 -1.069 -7.190
189 H HIS 29 H HIS 29 5.892 -5.970 -6.272
190 HA HIS 29 HA HIS 29 3.326 -6.475 -7.229
191 HB2 HIS 29 1HB HIS 29 5.972 -7.838 -7.591
192 HB3 HIS 29 2HB HIS 29 4.516 -8.557 -8.274
193 HD1 HIS 29 HD1 HIS 29 6.835 -7.487 -10.044
194 HD2 HIS 29 HD2 HIS 29 3.413 -5.345 -9.065
195 HE1 HIS 29 HE1 HIS 29 6.587 -5.755 -11.850
196 H SER 30 H SER 30 5.139 -8.022 -4.697
197 HA SER 30 HA SER 30 3.460 -10.353 -4.559
198 HB2 SER 30 1HB SER 30 5.660 -10.717 -3.797
199 HB3 SER 30 2HB SER 30 5.660 -9.246 -2.823
200 HG SER 30 HG SER 30 3.752 -11.174 -2.205
201 H HIS 31 H HIS 31 3.481 -7.173 -3.181
202 HA HIS 31 HA HIS 31 1.581 -7.840 -1.097
203 HB2 HIS 31 1HB HIS 31 2.923 -6.151 -0.310
204 HB3 HIS 31 2HB HIS 31 3.110 -5.414 -1.899
205 HD1 HIS 31 HD1 HIS 31 0.731 -5.560 1.012
206 HD2 HIS 31 HD2 HIS 31 1.307 -3.405 -2.493
207 HE1 HIS 31 HE1 HIS 31 -0.865 -3.621 1.145
208 H GLN 32 H GLN 32 1.611 -6.102 -4.176
209 HA GLN 32 HA GLN 32 -0.897 -4.992 -4.200
210 HB2 GLN 32 1HB GLN 32 0.788 -6.187 -6.376
211 HB3 GLN 32 2HB GLN 32 -0.814 -5.558 -6.738
212 HG2 GLN 32 1HG GLN 32 -0.168 -3.372 -5.908
213 HG3 GLN 32 2HG GLN 32 1.425 -3.992 -5.475
214 HE21 GLN 32 1HE2 GLN 32 1.784 -1.999 -6.935
215 HE22 GLN 32 2HE2 GLN 32 2.037 -2.349 -8.608
216 H ARG 33 H ARG 33 -0.051 -8.334 -4.299
217 HA ARG 33 HA ARG 33 -2.286 -9.450 -5.529
218 HB2 ARG 33 1HB ARG 33 -0.940 -10.701 -3.146
219 HB3 ARG 33 2HB ARG 33 -1.666 -11.498 -4.535
220 HG2 ARG 33 1HG ARG 33 0.145 -10.493 -5.943
221 HG3 ARG 33 2HG ARG 33 0.913 -9.957 -4.447
222 HD2 ARG 33 1HD ARG 33 0.240 -12.816 -5.130
223 HD3 ARG 33 2HD ARG 33 1.836 -12.085 -5.289
224 HE ARG 33 HE ARG 33 1.039 -11.680 -2.671
225 HH11 ARG 33 1HH1 ARG 33 1.689 -14.380 -4.770
226 HH12 ARG 33 2HH1 ARG 33 2.204 -15.423 -3.485
227 HH21 ARG 33 1HH2 ARG 33 1.714 -13.043 -0.971
228 HH22 ARG 33 2HH2 ARG 33 2.217 -14.661 -1.325
229 H VAL 34 H VAL 34 -1.867 -8.164 -2.305
230 HA VAL 34 HA VAL 34 -4.101 -9.272 -1.045
231 HB VAL 34 HB VAL 34 -3.934 -7.531 0.578
232 HG11 VAL 34 1HG1 VAL 34 -1.474 -8.710 -0.520
233 HG12 VAL 34 2HG1 VAL 34 -1.236 -7.343 0.570
234 HG13 VAL 34 3HG1 VAL 34 -2.128 -8.763 1.117
235 HG21 VAL 34 3HG2 VAL 34 -3.957 -5.566 -0.752
236 HG22 VAL 34 1HG2 VAL 34 -2.441 -5.545 0.148
237 HG23 VAL 34 2HG2 VAL 34 -2.449 -6.008 -1.553
238 H HIS 35 H HIS 35 -3.819 -6.619 -3.299
239 HA HIS 35 HA HIS 35 -6.478 -5.625 -2.843
240 HB2 HIS 35 1HB HIS 35 -4.382 -5.056 -4.935
241 HB3 HIS 35 2HB HIS 35 -5.984 -4.327 -4.988
242 HD1 HIS 35 HD1 HIS 35 -6.586 -2.689 -2.996
243 HD2 HIS 35 HD2 HIS 35 -2.611 -3.885 -3.184
244 HE1 HIS 35 HE1 HIS 35 -5.331 -1.087 -1.518
245 H THR 36 H THR 36 -4.976 -7.971 -4.917
246 HA THR 36 HA THR 36 -7.289 -8.174 -6.661
247 HB THR 36 HB THR 36 -6.035 -9.937 -7.817
248 HG1 THR 36 HG1 THR 36 -4.286 -9.598 -5.616
249 HG21 THR 36 3HG2 THR 36 -5.372 -7.230 -7.685
250 HG22 THR 36 1HG2 THR 36 -4.939 -8.365 -8.963
251 HG23 THR 36 2HG2 THR 36 -3.828 -8.079 -7.623
252 H GLY 37 H GLY 37 -7.863 -8.688 -3.947
253 HA2 GLY 37 1HA GLY 37 -8.944 -11.374 -4.211
254 HA3 GLY 37 2HA GLY 37 -7.824 -11.139 -2.876
255 H GLU 38 H GLU 38 -8.465 -8.688 -1.921
256 HA GLU 38 HA GLU 38 -11.002 -9.221 -0.647
257 HB2 GLU 38 1HB GLU 38 -8.879 -8.327 0.488
258 HB3 GLU 38 2HB GLU 38 -9.298 -6.777 -0.226
259 HG2 GLU 38 1HG GLU 38 -11.618 -7.245 0.907
260 HG3 GLU 38 2HG GLU 38 -10.650 -8.297 1.940
261 H LYS 39 H LYS 39 -11.312 -8.714 -3.373
262 HA LYS 39 HA LYS 39 -11.820 -6.188 -4.257
263 HB2 LYS 39 1HB LYS 39 -13.348 -7.113 -5.822
264 HB3 LYS 39 2HB LYS 39 -12.145 -8.359 -5.514
265 HG2 LYS 39 1HG LYS 39 -13.621 -9.688 -4.347
266 HG3 LYS 39 2HG LYS 39 -14.682 -8.336 -3.943
267 HD2 LYS 39 1HD LYS 39 -15.937 -9.337 -5.569
268 HD3 LYS 39 2HD LYS 39 -14.975 -8.247 -6.570
269 HE2 LYS 39 1HE LYS 39 -14.017 -11.022 -5.985
270 HE3 LYS 39 2HE LYS 39 -15.205 -10.737 -7.256
271 HZ1 LYS 39 3HZ LYS 39 -12.996 -10.727 -8.175
272 HZ2 LYS 39 1HZ LYS 39 -12.495 -9.534 -7.083
273 HZ3 LYS 39 2HZ LYS 39 -13.641 -9.166 -8.272
274 HA PRO 40 HA PRO 40 -14.983 -4.427 -1.764
275 HB2 PRO 40 1HB PRO 40 -16.092 -2.712 -3.553
276 HB3 PRO 40 2HB PRO 40 -14.510 -2.438 -2.813
277 HG2 PRO 40 1HG PRO 40 -15.171 -3.554 -5.511
278 HG3 PRO 40 2HG PRO 40 -13.921 -2.379 -5.062
279 HD2 PRO 40 1HD PRO 40 -13.374 -4.996 -5.490
280 HD3 PRO 40 2HD PRO 40 -12.476 -4.012 -4.316
281 H SER 41 H SER 41 -17.427 -3.737 -2.074
282 HA SER 41 HA SER 41 -19.574 -4.478 -2.222
283 HB2 SER 41 1HB SER 41 -18.506 -5.492 -4.863
284 HB3 SER 41 2HB SER 41 -20.211 -5.552 -4.417
285 HG SER 41 HG SER 41 -18.649 -3.183 -4.479
286 H GLY 42 H GLY 42 -17.979 -6.044 -0.626
287 HA2 GLY 42 1HA GLY 42 -18.673 -8.818 -1.323
288 HA3 GLY 42 2HA GLY 42 -17.470 -8.334 -0.137
289 HA PRO 43 HA PRO 43 -21.984 -8.028 1.698
290 HB2 PRO 43 1HB PRO 43 -23.583 -10.018 0.774
291 HB3 PRO 43 2HB PRO 43 -23.520 -8.414 0.034
292 HG2 PRO 43 1HG PRO 43 -22.163 -10.945 -0.812
293 HG3 PRO 43 2HG PRO 43 -22.989 -9.732 -1.807
294 HD2 PRO 43 1HD PRO 43 -20.293 -9.833 -1.570
295 HD3 PRO 43 2HD PRO 43 -21.175 -8.310 -1.800
296 H SER 44 H SER 44 -21.175 -8.729 3.613
297 HA SER 44 HA SER 44 -21.013 -11.645 4.012
298 HB2 SER 44 1HB SER 44 -18.783 -10.570 4.090
299 HB3 SER 44 2HB SER 44 -19.348 -9.523 5.391
300 HG SER 44 HG SER 44 -19.522 -11.276 6.723
301 H SER 45 H SER 45 -23.074 -11.895 4.817
302 HA SER 45 HA SER 45 -24.360 -10.236 6.654
303 HB2 SER 45 1HB SER 45 -24.663 -13.164 6.009
304 HB3 SER 45 2HB SER 45 -25.674 -12.374 7.218
305 HG SER 45 HG SER 45 -26.674 -11.269 5.689
306 H GLY 46 H GLY 46 -24.671 -10.381 8.903
307 HA2 GLY 46 1HA GLY 46 -23.670 -12.201 10.687
308 HA3 GLY 46 2HA GLY 46 -22.314 -11.134 10.355
Start of MODEL 10
1 H1 GLY 1 H GLY 1 5.691 -5.922 22.282
2 HA2 GLY 1 1HA GLY 1 5.160 -3.720 21.801
3 HA3 GLY 1 2HA GLY 1 6.876 -3.339 21.822
4 H SER 2 H SER 2 5.908 -1.991 19.961
5 HA SER 2 HA SER 2 5.340 -3.345 17.511
6 HB2 SER 2 1HB SER 2 4.404 -1.159 17.820
7 HB3 SER 2 2HB SER 2 5.991 -0.460 18.140
8 HG SER 2 HG SER 2 6.088 -0.113 16.080
9 H SER 3 H SER 3 6.620 -3.175 15.550
10 HA SER 3 HA SER 3 9.506 -2.882 16.012
11 HB2 SER 3 1HB SER 3 8.229 -5.178 14.506
12 HB3 SER 3 2HB SER 3 9.959 -4.914 14.723
13 HG SER 3 HG SER 3 8.282 -6.186 16.335
14 H GLY 4 H GLY 4 9.223 -0.836 14.951
15 HA2 GLY 4 1HA GLY 4 8.912 0.567 13.119
16 HA3 GLY 4 2HA GLY 4 10.080 -0.556 12.438
17 H SER 5 H SER 5 6.600 -0.040 12.881
18 HA SER 5 HA SER 5 5.883 -1.963 10.880
19 HB2 SER 5 1HB SER 5 4.285 0.183 12.291
20 HB3 SER 5 2HB SER 5 3.587 -0.971 11.153
21 HG SER 5 HG SER 5 4.992 -2.371 12.878
22 H SER 6 H SER 6 5.965 1.583 11.031
23 HA SER 6 HA SER 6 5.640 1.651 8.106
24 HB2 SER 6 1HB SER 6 3.937 2.893 9.434
25 HB3 SER 6 2HB SER 6 5.226 3.905 10.085
26 HG SER 6 HG SER 6 5.697 4.316 7.747
27 H GLY 7 H GLY 7 7.822 1.245 7.620
28 HA2 GLY 7 1HA GLY 7 10.015 2.595 8.735
29 HA3 GLY 7 2HA GLY 7 9.994 1.820 7.158
30 H SER 8 H SER 8 11.335 4.266 7.900
31 HA SER 8 HA SER 8 9.963 6.106 6.055
32 HB2 SER 8 1HB SER 8 9.759 6.953 8.353
33 HB3 SER 8 2HB SER 8 11.510 6.870 8.545
34 HG SER 8 HG SER 8 9.959 8.726 7.219
35 H GLY 9 H GLY 9 11.127 6.501 4.299
36 HA2 GLY 9 1HA GLY 9 13.808 7.299 4.283
37 HA3 GLY 9 2HA GLY 9 13.766 5.574 3.947
38 H GLU 10 H GLU 10 13.850 5.130 1.858
39 HA GLU 10 HA GLU 10 12.220 6.684 -0.002
40 HB2 GLU 10 1HB GLU 10 14.088 6.903 -1.592
41 HB3 GLU 10 2HB GLU 10 14.392 7.771 -0.094
42 HG2 GLU 10 1HG GLU 10 15.782 5.878 0.673
43 HG3 GLU 10 2HG GLU 10 15.542 5.109 -0.894
44 H LYS 11 H LYS 11 11.369 5.496 -1.631
45 HA LYS 11 HA LYS 11 12.452 2.848 -2.204
46 HB2 LYS 11 1HB LYS 11 9.693 3.387 -1.133
47 HB3 LYS 11 2HB LYS 11 10.031 1.965 -2.112
48 HG2 LYS 11 1HG LYS 11 11.518 1.090 -0.507
49 HG3 LYS 11 2HG LYS 11 11.584 2.618 0.375
50 HD2 LYS 11 1HD LYS 11 8.941 1.291 0.047
51 HD3 LYS 11 2HD LYS 11 10.084 0.602 1.202
52 HE2 LYS 11 1HE LYS 11 9.336 3.516 1.183
53 HE3 LYS 11 2HE LYS 11 8.448 2.309 2.113
54 HZ1 LYS 11 3HZ LYS 11 10.102 2.116 3.607
55 HZ2 LYS 11 1HZ LYS 11 10.514 3.669 3.076
56 HZ3 LYS 11 2HZ LYS 11 11.332 2.321 2.465
57 HA PRO 12 HA PRO 12 11.482 4.435 -6.250
58 HB2 PRO 12 1HB PRO 12 12.391 2.276 -7.623
59 HB3 PRO 12 2HB PRO 12 13.466 3.492 -6.924
60 HG2 PRO 12 1HG PRO 12 12.702 0.802 -5.857
61 HG3 PRO 12 2HG PRO 12 14.295 1.578 -5.896
62 HD2 PRO 12 1HD PRO 12 12.758 1.518 -3.668
63 HD3 PRO 12 2HD PRO 12 13.852 2.867 -4.037
64 H PHE 13 H PHE 13 10.247 1.594 -4.747
65 HA PHE 13 HA PHE 13 8.261 1.241 -6.886
66 HB2 PHE 13 1HB PHE 13 8.921 -0.624 -4.598
67 HB3 PHE 13 2HB PHE 13 7.831 -0.961 -5.938
68 HD1 PHE 13 HD1 PHE 13 11.332 -0.575 -4.932
69 HD2 PHE 13 HD2 PHE 13 8.671 -1.552 -8.106
70 HE1 PHE 13 HE1 PHE 13 13.214 -1.497 -6.221
71 HE2 PHE 13 HE2 PHE 13 10.548 -2.477 -9.400
72 HZ PHE 13 HZ PHE 13 12.823 -2.451 -8.457
73 H LYS 14 H LYS 14 6.124 1.535 -6.518
74 HA LYS 14 HA LYS 14 5.174 1.942 -3.788
75 HB2 LYS 14 1HB LYS 14 5.779 4.181 -4.489
76 HB3 LYS 14 2HB LYS 14 4.891 3.988 -5.995
77 HG2 LYS 14 1HG LYS 14 2.845 3.608 -4.455
78 HG3 LYS 14 2HG LYS 14 3.848 4.378 -3.223
79 HD2 LYS 14 1HD LYS 14 4.187 6.276 -4.844
80 HD3 LYS 14 2HD LYS 14 2.951 5.530 -5.860
81 HE2 LYS 14 1HE LYS 14 1.703 7.035 -4.640
82 HE3 LYS 14 2HE LYS 14 1.529 5.569 -3.676
83 HZ1 LYS 14 3HZ LYS 14 2.028 7.283 -2.172
84 HZ2 LYS 14 1HZ LYS 14 3.268 7.904 -3.141
85 HZ3 LYS 14 2HZ LYS 14 3.475 6.424 -2.349
86 H CYS 15 H CYS 15 3.253 1.014 -3.481
87 HA CYS 15 HA CYS 15 1.937 -0.313 -5.648
88 HB2 CYS 15 1HB CYS 15 2.081 -1.208 -3.309
89 HB3 CYS 15 2HB CYS 15 0.951 0.048 -2.812
90 H GLU 16 H GLU 16 0.953 0.991 -7.093
91 HA GLU 16 HA GLU 16 -0.318 3.423 -6.532
92 HB2 GLU 16 1HB GLU 16 -0.855 1.521 -8.820
93 HB3 GLU 16 2HB GLU 16 -1.316 3.217 -8.764
94 HG2 GLU 16 1HG GLU 16 0.883 3.950 -8.962
95 HG3 GLU 16 2HG GLU 16 1.545 2.386 -8.491
96 H GLU 17 H GLU 17 -1.392 0.160 -6.191
97 HA GLU 17 HA GLU 17 -4.155 0.449 -6.354
98 HB2 GLU 17 1HB GLU 17 -2.683 -1.342 -4.418
99 HB3 GLU 17 2HB GLU 17 -4.313 -1.567 -5.036
100 HG2 GLU 17 1HG GLU 17 -3.081 -1.575 -7.356
101 HG3 GLU 17 2HG GLU 17 -1.697 -2.033 -6.365
102 H CYS 18 H CYS 18 -2.074 0.688 -3.472
103 HA CYS 18 HA CYS 18 -4.230 2.212 -2.161
104 HB2 CYS 18 1HB CYS 18 -3.353 1.390 -0.010
105 HB3 CYS 18 2HB CYS 18 -3.864 0.067 -1.054
106 H GLY 19 H GLY 19 -0.739 1.879 -2.600
107 HA2 GLY 19 1HA GLY 19 0.359 4.090 -3.069
108 HA3 GLY 19 2HA GLY 19 -0.436 4.645 -1.603
109 H LYS 20 H LYS 20 0.678 1.418 -1.523
110 HA LYS 20 HA LYS 20 2.459 1.936 0.618
111 HB2 LYS 20 1HB LYS 20 1.644 -0.439 -0.967
112 HB3 LYS 20 2HB LYS 20 3.179 -0.545 -0.115
113 HG2 LYS 20 1HG LYS 20 1.770 0.319 1.913
114 HG3 LYS 20 2HG LYS 20 0.417 -0.315 0.972
115 HD2 LYS 20 1HD LYS 20 0.977 -2.167 2.208
116 HD3 LYS 20 2HD LYS 20 1.967 -2.428 0.770
117 HE2 LYS 20 1HE LYS 20 3.474 -2.803 2.486
118 HE3 LYS 20 2HE LYS 20 3.774 -1.113 2.084
119 HZ1 LYS 20 3HZ LYS 20 3.552 -1.689 4.522
120 HZ2 LYS 20 1HZ LYS 20 1.899 -1.901 4.231
121 HZ3 LYS 20 2HZ LYS 20 2.617 -0.393 3.968
122 H ARG 21 H ARG 21 4.737 0.666 0.376
123 HA ARG 21 HA ARG 21 6.070 1.414 -2.101
124 HB2 ARG 21 1HB ARG 21 6.946 2.488 0.587
125 HB3 ARG 21 2HB ARG 21 7.825 2.676 -0.924
126 HG2 ARG 21 1HG ARG 21 5.626 3.782 -1.759
127 HG3 ARG 21 2HG ARG 21 5.289 3.970 -0.037
128 HD2 ARG 21 1HD ARG 21 7.885 4.855 -1.263
129 HD3 ARG 21 2HD ARG 21 6.466 5.900 -1.226
130 HE ARG 21 HE ARG 21 8.219 5.341 0.935
131 HH11 ARG 21 1HH1 ARG 21 4.877 5.943 0.169
132 HH12 ARG 21 2HH1 ARG 21 4.499 6.589 1.731
133 HH21 ARG 21 1HH2 ARG 21 7.734 6.190 2.996
134 HH22 ARG 21 2HH2 ARG 21 6.126 6.730 3.338
135 H PHE 22 H PHE 22 8.249 0.540 -2.260
136 HA PHE 22 HA PHE 22 9.111 -1.380 -0.285
137 HB2 PHE 22 1HB PHE 22 8.488 -2.413 -3.051
138 HB3 PHE 22 2HB PHE 22 8.953 -3.342 -1.630
139 HD1 PHE 22 HD2 PHE 22 6.242 -1.285 -3.081
140 HD2 PHE 22 HD1 PHE 22 7.342 -4.156 -0.138
141 HE1 PHE 22 HE2 PHE 22 3.868 -1.634 -2.540
142 HE2 PHE 22 HE1 PHE 22 4.969 -4.511 0.407
143 HZ PHE 22 HZ PHE 22 3.228 -3.249 -0.794
144 H THR 23 H THR 23 11.225 -2.232 -0.718
145 HA THR 23 HA THR 23 12.874 -0.353 -2.158
146 HB THR 23 HB THR 23 13.592 -1.248 0.029
147 HG1 THR 23 HG1 THR 23 15.127 -1.548 -2.300
148 HG21 THR 23 3HG2 THR 23 13.259 -3.425 0.416
149 HG22 THR 23 1HG2 THR 23 14.683 -3.725 -0.579
150 HG23 THR 23 2HG2 THR 23 13.075 -3.777 -1.302
151 H GLN 24 H GLN 24 11.295 -3.234 -2.917
152 HA GLN 24 HA GLN 24 12.796 -3.433 -5.413
153 HB2 GLN 24 1HB GLN 24 12.699 -5.495 -3.298
154 HB3 GLN 24 2HB GLN 24 12.417 -6.072 -4.935
155 HG2 GLN 24 1HG GLN 24 14.735 -4.282 -4.497
156 HG3 GLN 24 2HG GLN 24 14.838 -5.925 -3.868
157 HE21 GLN 24 1HE2 GLN 24 13.403 -4.548 -6.804
158 HE22 GLN 24 2HE2 GLN 24 14.274 -5.552 -7.908
159 H ASN 25 H ASN 25 11.669 -4.962 -6.963
160 HA ASN 25 HA ASN 25 8.918 -4.208 -7.124
161 HB2 ASN 25 1HB ASN 25 8.904 -5.418 -9.233
162 HB3 ASN 25 2HB ASN 25 10.369 -4.447 -9.120
163 HD21 ASN 25 1HD2 ASN 25 12.353 -5.465 -8.821
164 HD22 ASN 25 2HD2 ASN 25 12.567 -7.153 -9.123
165 H SER 26 H SER 26 10.563 -7.355 -6.820
166 HA SER 26 HA SER 26 8.469 -9.073 -6.707
167 HB2 SER 26 1HB SER 26 10.880 -9.111 -4.875
168 HB3 SER 26 2HB SER 26 9.819 -10.484 -5.192
169 HG SER 26 HG SER 26 10.539 -9.603 -7.539
170 H GLN 27 H GLN 27 9.503 -6.871 -4.166
171 HA GLN 27 HA GLN 27 7.805 -7.882 -2.137
172 HB2 GLN 27 1HB GLN 27 9.035 -5.143 -2.479
173 HB3 GLN 27 2HB GLN 27 8.233 -5.703 -1.018
174 HG2 GLN 27 1HG GLN 27 9.926 -7.591 -0.989
175 HG3 GLN 27 2HG GLN 27 10.801 -6.680 -2.219
176 HE21 GLN 27 1HE2 GLN 27 10.749 -4.172 -1.488
177 HE22 GLN 27 2HE2 GLN 27 11.423 -3.930 0.084
178 H LEU 28 H LEU 28 7.507 -4.988 -4.200
179 HA LEU 28 HA LEU 28 4.955 -4.234 -3.355
180 HB2 LEU 28 1HB LEU 28 6.250 -2.684 -4.585
181 HB3 LEU 28 2HB LEU 28 6.433 -3.801 -5.936
182 HG LEU 28 HG LEU 28 4.065 -3.522 -6.487
183 HD11 LEU 28 1HD1 LEU 28 3.872 -1.279 -4.526
184 HD12 LEU 28 2HD1 LEU 28 3.530 -2.931 -4.013
185 HD13 LEU 28 3HD1 LEU 28 2.589 -2.199 -5.312
186 HD21 LEU 28 3HD2 LEU 28 6.104 -1.525 -6.670
187 HD22 LEU 28 1HD2 LEU 28 4.528 -0.746 -6.528
188 HD23 LEU 28 2HD2 LEU 28 4.821 -1.915 -7.816
189 H HIS 29 H HIS 29 5.863 -6.063 -6.280
190 HA HIS 29 HA HIS 29 3.300 -6.613 -7.195
191 HB2 HIS 29 1HB HIS 29 5.925 -8.044 -7.486
192 HB3 HIS 29 2HB HIS 29 4.455 -8.729 -8.173
193 HD1 HIS 29 HD1 HIS 29 5.591 -8.387 -10.533
194 HD2 HIS 29 HD2 HIS 29 4.724 -4.895 -8.457
195 HE1 HIS 29 HE1 HIS 29 5.745 -6.539 -12.232
196 H SER 30 H SER 30 5.101 -8.050 -4.593
197 HA SER 30 HA SER 30 3.433 -10.375 -4.352
198 HB2 SER 30 1HB SER 30 5.598 -10.708 -3.516
199 HB3 SER 30 2HB SER 30 5.613 -9.159 -2.674
200 HG SER 30 HG SER 30 4.362 -9.987 -1.095
201 H HIS 31 H HIS 31 3.455 -7.140 -3.067
202 HA HIS 31 HA HIS 31 1.488 -7.723 -1.025
203 HB2 HIS 31 1HB HIS 31 2.879 -6.023 -0.301
204 HB3 HIS 31 2HB HIS 31 2.998 -5.295 -1.900
205 HD1 HIS 31 HD1 HIS 31 0.976 -5.254 1.213
206 HD2 HIS 31 HD2 HIS 31 0.870 -3.553 -2.576
207 HE1 HIS 31 HE1 HIS 31 -0.727 -3.408 1.352
208 H GLN 32 H GLN 32 1.604 -6.157 -4.186
209 HA GLN 32 HA GLN 32 -0.889 -5.006 -4.313
210 HB2 GLN 32 1HB GLN 32 0.838 -6.315 -6.387
211 HB3 GLN 32 2HB GLN 32 -0.755 -5.707 -6.820
212 HG2 GLN 32 1HG GLN 32 -0.112 -3.480 -6.030
213 HG3 GLN 32 2HG GLN 32 1.491 -4.096 -5.628
214 HE21 GLN 32 1HE2 GLN 32 2.009 -2.253 -7.114
215 HE22 GLN 32 2HE2 GLN 32 2.133 -2.613 -8.799
216 H ARG 33 H ARG 33 -0.068 -8.368 -4.302
217 HA ARG 33 HA ARG 33 -2.328 -9.484 -5.494
218 HB2 ARG 33 1HB ARG 33 -0.991 -10.722 -3.103
219 HB3 ARG 33 2HB ARG 33 -1.703 -11.520 -4.499
220 HG2 ARG 33 1HG ARG 33 0.133 -10.497 -5.882
221 HG3 ARG 33 2HG ARG 33 0.889 -10.007 -4.364
222 HD2 ARG 33 1HD ARG 33 1.925 -12.029 -4.833
223 HD3 ARG 33 2HD ARG 33 0.649 -12.490 -3.707
224 HE ARG 33 HE ARG 33 -0.252 -12.689 -6.387
225 HH11 ARG 33 1HH1 ARG 33 1.758 -14.278 -4.031
226 HH12 ARG 33 2HH1 ARG 33 1.558 -15.851 -4.729
227 HH21 ARG 33 1HH2 ARG 33 -0.523 -14.754 -7.316
228 HH22 ARG 33 2HH2 ARG 33 0.261 -16.120 -6.599
229 H VAL 34 H VAL 34 -1.866 -8.113 -2.317
230 HA VAL 34 HA VAL 34 -4.091 -9.186 -1.001
231 HB VAL 34 HB VAL 34 -3.913 -7.365 0.560
232 HG11 VAL 34 1HG1 VAL 34 -2.196 -8.733 1.130
233 HG12 VAL 34 2HG1 VAL 34 -1.449 -8.644 -0.466
234 HG13 VAL 34 3HG1 VAL 34 -1.246 -7.318 0.679
235 HG21 VAL 34 3HG2 VAL 34 -2.053 -5.593 -0.116
236 HG22 VAL 34 1HG2 VAL 34 -2.631 -5.990 -1.735
237 HG23 VAL 34 2HG2 VAL 34 -3.753 -5.368 -0.525
238 H HIS 35 H HIS 35 -3.825 -6.640 -3.359
239 HA HIS 35 HA HIS 35 -6.449 -5.564 -2.877
240 HB2 HIS 35 1HB HIS 35 -4.365 -5.128 -5.005
241 HB3 HIS 35 2HB HIS 35 -5.971 -4.416 -5.135
242 HD1 HIS 35 HD1 HIS 35 -6.584 -2.558 -3.412
243 HD2 HIS 35 HD2 HIS 35 -2.667 -3.919 -3.168
244 HE1 HIS 35 HE1 HIS 35 -5.374 -0.872 -1.991
245 H THR 36 H THR 36 -5.125 -8.156 -4.698
246 HA THR 36 HA THR 36 -7.424 -8.345 -6.474
247 HB THR 36 HB THR 36 -6.283 -10.203 -7.524
248 HG1 THR 36 HG1 THR 36 -3.970 -10.427 -6.465
249 HG21 THR 36 3HG2 THR 36 -5.461 -7.652 -7.665
250 HG22 THR 36 1HG2 THR 36 -4.718 -8.952 -8.595
251 HG23 THR 36 2HG2 THR 36 -3.972 -8.405 -7.094
252 H GLY 37 H GLY 37 -5.885 -10.247 -3.892
253 HA2 GLY 37 1HA GLY 37 -7.758 -12.354 -3.886
254 HA3 GLY 37 2HA GLY 37 -6.701 -11.921 -2.550
255 H GLU 38 H GLU 38 -7.456 -10.560 -0.918
256 HA GLU 38 HA GLU 38 -10.364 -10.483 -0.711
257 HB2 GLU 38 1HB GLU 38 -9.975 -9.949 1.654
258 HB3 GLU 38 2HB GLU 38 -9.124 -11.410 1.173
259 HG2 GLU 38 1HG GLU 38 -7.039 -10.327 1.178
260 HG3 GLU 38 2HG GLU 38 -7.781 -8.729 1.237
261 H LYS 39 H LYS 39 -11.560 -8.632 -0.428
262 HA LYS 39 HA LYS 39 -10.149 -6.111 -1.000
263 HB2 LYS 39 1HB LYS 39 -12.298 -5.310 -1.922
264 HB3 LYS 39 2HB LYS 39 -11.688 -6.724 -2.772
265 HG2 LYS 39 1HG LYS 39 -13.870 -7.317 -2.555
266 HG3 LYS 39 2HG LYS 39 -13.234 -7.994 -1.054
267 HD2 LYS 39 1HD LYS 39 -15.196 -6.836 -0.446
268 HD3 LYS 39 2HD LYS 39 -13.860 -5.788 0.036
269 HE2 LYS 39 1HE LYS 39 -15.484 -4.405 -1.010
270 HE3 LYS 39 2HE LYS 39 -14.151 -4.584 -2.150
271 HZ1 LYS 39 3HZ LYS 39 -16.879 -5.615 -2.304
272 HZ2 LYS 39 1HZ LYS 39 -15.651 -6.580 -2.954
273 HZ3 LYS 39 2HZ LYS 39 -15.883 -5.006 -3.528
274 HA PRO 40 HA PRO 40 -11.364 -4.561 2.934
275 HB2 PRO 40 1HB PRO 40 -11.312 -1.900 2.396
276 HB3 PRO 40 2HB PRO 40 -9.847 -2.873 2.574
277 HG2 PRO 40 1HG PRO 40 -11.236 -1.980 0.077
278 HG3 PRO 40 2HG PRO 40 -9.501 -2.006 0.444
279 HD2 PRO 40 1HD PRO 40 -10.701 -3.912 -1.058
280 HD3 PRO 40 2HD PRO 40 -9.311 -4.257 -0.009
281 H SER 41 H SER 41 -12.969 -3.023 3.932
282 HA SER 41 HA SER 41 -15.555 -3.468 2.712
283 HB2 SER 41 1HB SER 41 -14.887 -2.100 5.329
284 HB3 SER 41 2HB SER 41 -16.476 -2.671 4.820
285 HG SER 41 HG SER 41 -14.457 -4.039 5.985
286 H GLY 42 H GLY 42 -13.556 -0.700 3.669
287 HA2 GLY 42 1HA GLY 42 -15.292 1.380 3.131
288 HA3 GLY 42 2HA GLY 42 -13.550 1.472 2.920
289 HA PRO 43 HA PRO 43 -15.674 2.049 -1.198
290 HB2 PRO 43 1HB PRO 43 -14.447 4.395 -1.800
291 HB3 PRO 43 2HB PRO 43 -15.957 4.307 -0.885
292 HG2 PRO 43 1HG PRO 43 -13.156 4.654 0.112
293 HG3 PRO 43 2HG PRO 43 -14.637 5.484 0.624
294 HD2 PRO 43 1HD PRO 43 -13.557 3.435 2.026
295 HD3 PRO 43 2HD PRO 43 -15.306 3.733 1.964
296 H SER 44 H SER 44 -14.765 0.936 -2.798
297 HA SER 44 HA SER 44 -12.102 0.114 -2.863
298 HB2 SER 44 1HB SER 44 -12.574 -0.827 -4.995
299 HB3 SER 44 2HB SER 44 -14.091 -0.899 -4.099
300 HG SER 44 HG SER 44 -14.916 0.218 -5.661
301 H SER 45 H SER 45 -10.766 0.503 -5.011
302 HA SER 45 HA SER 45 -9.680 3.062 -4.845
303 HB2 SER 45 1HB SER 45 -8.719 0.869 -5.886
304 HB3 SER 45 2HB SER 45 -9.466 1.453 -7.373
305 HG SER 45 HG SER 45 -7.373 2.579 -5.868
306 H GLY 46 H GLY 46 -9.386 4.395 -7.023
307 HA2 GLY 46 1HA GLY 46 -11.859 5.670 -7.490
308 HA3 GLY 46 2HA GLY 46 -10.377 5.947 -8.393
Start of MODEL 11
1 H1 GLY 1 H GLY 1 7.231 17.474 19.598
2 HA2 GLY 1 1HA GLY 1 9.214 17.615 21.710
3 HA3 GLY 1 2HA GLY 1 9.260 16.142 20.752
4 H SER 2 H SER 2 10.382 16.150 18.905
5 HA SER 2 HA SER 2 11.539 18.701 18.045
6 HB2 SER 2 1HB SER 2 12.392 15.852 17.888
7 HB3 SER 2 2HB SER 2 12.912 16.925 16.589
8 HG SER 2 HG SER 2 13.286 17.440 19.355
9 H SER 3 H SER 3 12.085 18.602 15.544
10 HA SER 3 HA SER 3 9.502 18.455 14.224
11 HB2 SER 3 1HB SER 3 10.555 19.686 12.418
12 HB3 SER 3 2HB SER 3 10.983 20.443 13.952
13 HG SER 3 HG SER 3 12.943 19.068 13.800
14 H GLY 4 H GLY 4 12.757 17.091 13.830
15 HA2 GLY 4 1HA GLY 4 12.929 14.728 13.249
16 HA3 GLY 4 2HA GLY 4 11.540 14.953 12.197
17 H SER 5 H SER 5 13.058 13.876 10.664
18 HA SER 5 HA SER 5 14.531 15.934 9.189
19 HB2 SER 5 1HB SER 5 15.657 13.179 9.742
20 HB3 SER 5 2HB SER 5 16.435 14.467 8.822
21 HG SER 5 HG SER 5 16.230 14.117 11.544
22 H SER 6 H SER 6 15.291 14.885 7.000
23 HA SER 6 HA SER 6 13.024 13.323 5.945
24 HB2 SER 6 1HB SER 6 14.447 15.718 4.850
25 HB3 SER 6 2HB SER 6 13.764 14.543 3.726
26 HG SER 6 HG SER 6 12.306 16.254 4.300
27 H GLY 7 H GLY 7 13.619 11.342 5.384
28 HA2 GLY 7 1HA GLY 7 15.172 10.394 3.504
29 HA3 GLY 7 2HA GLY 7 16.416 10.838 4.663
30 H SER 8 H SER 8 13.236 9.238 4.892
31 HA SER 8 HA SER 8 14.414 7.277 6.709
32 HB2 SER 8 1HB SER 8 11.581 8.026 6.009
33 HB3 SER 8 2HB SER 8 11.947 6.550 6.902
34 HG SER 8 HG SER 8 12.756 9.158 7.678
35 H GLY 9 H GLY 9 15.275 7.053 4.065
36 HA2 GLY 9 1HA GLY 9 15.720 5.252 2.672
37 HA3 GLY 9 2HA GLY 9 14.484 4.332 3.518
38 H GLU 10 H GLU 10 15.262 6.062 0.710
39 HA GLU 10 HA GLU 10 12.532 6.567 -0.099
40 HB2 GLU 10 1HB GLU 10 15.233 7.057 -1.268
41 HB3 GLU 10 2HB GLU 10 13.853 7.008 -2.357
42 HG2 GLU 10 1HG GLU 10 13.839 8.737 0.086
43 HG3 GLU 10 2HG GLU 10 14.590 9.273 -1.416
44 H LYS 11 H LYS 11 11.254 5.183 -1.125
45 HA LYS 11 HA LYS 11 12.441 2.721 -2.206
46 HB2 LYS 11 1HB LYS 11 9.711 3.371 -1.123
47 HB3 LYS 11 2HB LYS 11 9.980 1.948 -2.120
48 HG2 LYS 11 1HG LYS 11 11.415 0.977 -0.531
49 HG3 LYS 11 2HG LYS 11 11.584 2.492 0.358
50 HD2 LYS 11 1HD LYS 11 8.967 2.237 0.598
51 HD3 LYS 11 2HD LYS 11 9.341 0.532 0.337
52 HE2 LYS 11 1HE LYS 11 11.190 1.054 2.167
53 HE3 LYS 11 2HE LYS 11 10.039 2.314 2.610
54 HZ1 LYS 11 3HZ LYS 11 8.323 0.584 2.780
55 HZ2 LYS 11 1HZ LYS 11 9.597 0.329 3.864
56 HZ3 LYS 11 2HZ LYS 11 9.487 -0.600 2.455
57 HA PRO 12 HA PRO 12 11.538 4.386 -6.238
58 HB2 PRO 12 1HB PRO 12 12.378 2.211 -7.629
59 HB3 PRO 12 2HB PRO 12 13.492 3.385 -6.917
60 HG2 PRO 12 1HG PRO 12 12.637 0.711 -5.877
61 HG3 PRO 12 2HG PRO 12 14.256 1.436 -5.905
62 HD2 PRO 12 1HD PRO 12 12.712 1.405 -3.681
63 HD3 PRO 12 2HD PRO 12 13.851 2.721 -4.035
64 H PHE 13 H PHE 13 10.281 1.471 -4.839
65 HA PHE 13 HA PHE 13 8.251 1.261 -6.951
66 HB2 PHE 13 1HB PHE 13 8.889 -0.698 -4.736
67 HB3 PHE 13 2HB PHE 13 7.783 -0.965 -6.079
68 HD1 PHE 13 HD1 PHE 13 11.298 -0.690 -5.085
69 HD2 PHE 13 HD2 PHE 13 8.596 -1.493 -8.274
70 HE1 PHE 13 HE1 PHE 13 13.151 -1.605 -6.420
71 HE2 PHE 13 HE2 PHE 13 10.444 -2.411 -9.614
72 HZ PHE 13 HZ PHE 13 12.725 -2.468 -8.687
73 H LYS 14 H LYS 14 6.118 1.560 -6.550
74 HA LYS 14 HA LYS 14 5.214 1.922 -3.796
75 HB2 LYS 14 1HB LYS 14 5.808 4.168 -4.449
76 HB3 LYS 14 2HB LYS 14 4.935 4.005 -5.967
77 HG2 LYS 14 1HG LYS 14 2.880 3.589 -4.423
78 HG3 LYS 14 2HG LYS 14 3.878 4.389 -3.206
79 HD2 LYS 14 1HD LYS 14 4.189 6.267 -4.855
80 HD3 LYS 14 2HD LYS 14 2.956 5.492 -5.854
81 HE2 LYS 14 1HE LYS 14 1.407 5.615 -3.901
82 HE3 LYS 14 2HE LYS 14 2.633 6.553 -3.050
83 HZ1 LYS 14 3HZ LYS 14 2.128 7.635 -5.627
84 HZ2 LYS 14 1HZ LYS 14 2.008 8.379 -4.113
85 HZ3 LYS 14 2HZ LYS 14 0.692 7.521 -4.740
86 H CYS 15 H CYS 15 3.281 1.021 -3.467
87 HA CYS 15 HA CYS 15 1.927 -0.286 -5.620
88 HB2 CYS 15 1HB CYS 15 2.075 -1.198 -3.298
89 HB3 CYS 15 2HB CYS 15 0.994 0.087 -2.767
90 H GLU 16 H GLU 16 0.875 0.956 -7.052
91 HA GLU 16 HA GLU 16 -0.337 3.431 -6.490
92 HB2 GLU 16 1HB GLU 16 -1.317 1.733 -8.745
93 HB3 GLU 16 2HB GLU 16 -0.997 3.461 -8.706
94 HG2 GLU 16 1HG GLU 16 0.766 2.803 -9.960
95 HG3 GLU 16 2HG GLU 16 1.488 2.619 -8.362
96 H GLU 17 H GLU 17 -1.441 0.179 -6.121
97 HA GLU 17 HA GLU 17 -4.202 0.493 -6.243
98 HB2 GLU 17 1HB GLU 17 -2.725 -1.295 -4.308
99 HB3 GLU 17 2HB GLU 17 -4.360 -1.513 -4.913
100 HG2 GLU 17 1HG GLU 17 -3.200 -1.586 -7.239
101 HG3 GLU 17 2HG GLU 17 -1.757 -1.953 -6.296
102 H CYS 18 H CYS 18 -2.090 0.711 -3.379
103 HA CYS 18 HA CYS 18 -4.210 2.276 -2.057
104 HB2 CYS 18 1HB CYS 18 -3.326 1.455 0.087
105 HB3 CYS 18 2HB CYS 18 -3.848 0.128 -0.946
106 H GLY 19 H GLY 19 -0.729 1.903 -2.541
107 HA2 GLY 19 1HA GLY 19 0.382 4.103 -3.035
108 HA3 GLY 19 2HA GLY 19 -0.380 4.667 -1.555
109 H LYS 20 H LYS 20 0.676 1.431 -1.454
110 HA LYS 20 HA LYS 20 2.502 1.926 0.643
111 HB2 LYS 20 1HB LYS 20 1.647 -0.435 -0.940
112 HB3 LYS 20 2HB LYS 20 3.197 -0.557 -0.117
113 HG2 LYS 20 1HG LYS 20 1.876 0.266 1.956
114 HG3 LYS 20 2HG LYS 20 0.460 -0.254 1.039
115 HD2 LYS 20 1HD LYS 20 0.988 -2.150 2.261
116 HD3 LYS 20 2HD LYS 20 1.791 -2.459 0.720
117 HE2 LYS 20 1HE LYS 20 3.907 -1.743 1.632
118 HE3 LYS 20 2HE LYS 20 3.134 -1.268 3.144
119 HZ1 LYS 20 3HZ LYS 20 2.995 -3.395 3.847
120 HZ2 LYS 20 1HZ LYS 20 4.317 -3.604 2.811
121 HZ3 LYS 20 2HZ LYS 20 2.763 -4.030 2.296
122 H ARG 21 H ARG 21 4.785 0.755 0.431
123 HA ARG 21 HA ARG 21 6.090 1.446 -2.084
124 HB2 ARG 21 1HB ARG 21 6.993 2.561 0.578
125 HB3 ARG 21 2HB ARG 21 7.836 2.750 -0.954
126 HG2 ARG 21 1HG ARG 21 5.638 3.835 -1.765
127 HG3 ARG 21 2HG ARG 21 5.275 3.992 -0.045
128 HD2 ARG 21 1HD ARG 21 7.866 4.950 -1.224
129 HD3 ARG 21 2HD ARG 21 6.423 5.963 -1.193
130 HE ARG 21 HE ARG 21 8.080 5.214 1.058
131 HH11 ARG 21 1HH1 ARG 21 5.029 6.499 -0.019
132 HH12 ARG 21 2HH1 ARG 21 4.686 7.294 1.482
133 HH21 ARG 21 1HH2 ARG 21 7.640 6.255 3.038
134 HH22 ARG 21 2HH2 ARG 21 6.172 7.155 3.220
135 H PHE 22 H PHE 22 8.186 0.500 -2.330
136 HA PHE 22 HA PHE 22 9.124 -1.345 -0.305
137 HB2 PHE 22 1HB PHE 22 8.436 -2.445 -3.029
138 HB3 PHE 22 2HB PHE 22 8.932 -3.339 -1.595
139 HD1 PHE 22 HD2 PHE 22 6.186 -1.370 -3.084
140 HD2 PHE 22 HD1 PHE 22 7.359 -4.059 0.000
141 HE1 PHE 22 HE2 PHE 22 3.824 -1.703 -2.480
142 HE2 PHE 22 HE1 PHE 22 4.999 -4.397 0.608
143 HZ PHE 22 HZ PHE 22 3.228 -3.217 -0.632
144 H THR 23 H THR 23 11.240 -2.143 -0.714
145 HA THR 23 HA THR 23 12.831 -0.332 -2.299
146 HB THR 23 HB THR 23 13.576 -1.098 -0.056
147 HG1 THR 23 HG1 THR 23 15.460 -0.632 -0.877
148 HG21 THR 23 3HG2 THR 23 14.416 -3.704 -1.238
149 HG22 THR 23 1HG2 THR 23 12.760 -3.532 -0.656
150 HG23 THR 23 2HG2 THR 23 14.113 -3.276 0.446
151 H GLN 24 H GLN 24 11.283 -3.268 -2.857
152 HA GLN 24 HA GLN 24 12.787 -3.625 -5.337
153 HB2 GLN 24 1HB GLN 24 12.644 -5.552 -3.101
154 HB3 GLN 24 2HB GLN 24 12.367 -6.224 -4.702
155 HG2 GLN 24 1HG GLN 24 14.707 -4.443 -4.357
156 HG3 GLN 24 2HG GLN 24 14.781 -6.045 -3.625
157 HE21 GLN 24 1HE2 GLN 24 13.397 -4.826 -6.655
158 HE22 GLN 24 2HE2 GLN 24 14.259 -5.913 -7.685
159 H ASN 25 H ASN 25 11.639 -4.819 -6.964
160 HA ASN 25 HA ASN 25 8.885 -4.197 -7.061
161 HB2 ASN 25 1HB ASN 25 8.922 -5.631 -9.149
162 HB3 ASN 25 2HB ASN 25 10.076 -4.300 -9.124
163 HD21 ASN 25 1HD2 ASN 25 12.276 -4.748 -8.843
164 HD22 ASN 25 2HD2 ASN 25 12.922 -6.323 -9.138
165 H SER 26 H SER 26 10.608 -7.277 -6.645
166 HA SER 26 HA SER 26 8.548 -9.064 -6.630
167 HB2 SER 26 1HB SER 26 10.910 -9.699 -6.335
168 HB3 SER 26 2HB SER 26 10.881 -9.042 -4.699
169 HG SER 26 HG SER 26 9.112 -10.592 -4.336
170 H GLN 27 H GLN 27 9.472 -6.861 -4.040
171 HA GLN 27 HA GLN 27 7.706 -7.903 -2.085
172 HB2 GLN 27 1HB GLN 27 9.021 -5.202 -2.377
173 HB3 GLN 27 2HB GLN 27 8.051 -5.658 -0.982
174 HG2 GLN 27 1HG GLN 27 9.627 -7.614 -0.694
175 HG3 GLN 27 2HG GLN 27 10.662 -6.828 -1.886
176 HE21 GLN 27 1HE2 GLN 27 10.569 -4.241 -1.264
177 HE22 GLN 27 2HE2 GLN 27 11.163 -3.958 0.333
178 H LEU 28 H LEU 28 7.470 -4.992 -4.132
179 HA LEU 28 HA LEU 28 4.892 -4.245 -3.371
180 HB2 LEU 28 1HB LEU 28 6.242 -2.703 -4.566
181 HB3 LEU 28 2HB LEU 28 6.429 -3.816 -5.920
182 HG LEU 28 HG LEU 28 4.088 -3.499 -6.521
183 HD11 LEU 28 1HD1 LEU 28 3.449 -2.996 -4.077
184 HD12 LEU 28 2HD1 LEU 28 2.599 -2.144 -5.365
185 HD13 LEU 28 3HD1 LEU 28 3.880 -1.331 -4.466
186 HD21 LEU 28 3HD2 LEU 28 4.571 -1.667 -7.710
187 HD22 LEU 28 1HD2 LEU 28 6.136 -1.728 -6.901
188 HD23 LEU 28 2HD2 LEU 28 4.857 -0.691 -6.269
189 H HIS 29 H HIS 29 5.874 -6.036 -6.297
190 HA HIS 29 HA HIS 29 3.349 -6.598 -7.281
191 HB2 HIS 29 1HB HIS 29 5.895 -8.216 -7.441
192 HB3 HIS 29 2HB HIS 29 4.442 -8.600 -8.359
193 HD1 HIS 29 HD1 HIS 29 5.926 -8.201 -10.516
194 HD2 HIS 29 HD2 HIS 29 5.244 -4.840 -8.172
195 HE1 HIS 29 HE1 HIS 29 6.537 -6.237 -11.963
196 H SER 30 H SER 30 5.096 -8.091 -4.658
197 HA SER 30 HA SER 30 3.364 -10.375 -4.460
198 HB2 SER 30 1HB SER 30 5.683 -9.298 -2.942
199 HB3 SER 30 2HB SER 30 4.577 -10.355 -2.066
200 HG SER 30 HG SER 30 6.289 -11.495 -3.114
201 H HIS 31 H HIS 31 3.482 -7.165 -3.111
202 HA HIS 31 HA HIS 31 1.521 -7.708 -1.066
203 HB2 HIS 31 1HB HIS 31 2.931 -6.007 -0.383
204 HB3 HIS 31 2HB HIS 31 3.028 -5.298 -1.992
205 HD1 HIS 31 HD1 HIS 31 0.843 -5.391 1.060
206 HD2 HIS 31 HD2 HIS 31 1.110 -3.373 -2.562
207 HE1 HIS 31 HE1 HIS 31 -0.795 -3.490 1.227
208 H GLN 32 H GLN 32 1.595 -6.165 -4.241
209 HA GLN 32 HA GLN 32 -0.905 -5.018 -4.334
210 HB2 GLN 32 1HB GLN 32 0.794 -6.323 -6.435
211 HB3 GLN 32 2HB GLN 32 -0.799 -5.700 -6.842
212 HG2 GLN 32 1HG GLN 32 -0.141 -3.483 -6.088
213 HG3 GLN 32 2HG GLN 32 1.449 -4.099 -5.641
214 HE21 GLN 32 1HE2 GLN 32 1.866 -2.192 -7.167
215 HE22 GLN 32 2HE2 GLN 32 2.086 -2.600 -8.831
216 H ARG 33 H ARG 33 -0.073 -8.372 -4.310
217 HA ARG 33 HA ARG 33 -2.341 -9.497 -5.486
218 HB2 ARG 33 1HB ARG 33 -0.936 -10.717 -3.120
219 HB3 ARG 33 2HB ARG 33 -1.709 -11.534 -4.472
220 HG2 ARG 33 1HG ARG 33 0.064 -10.578 -5.954
221 HG3 ARG 33 2HG ARG 33 0.877 -10.000 -4.498
222 HD2 ARG 33 1HD ARG 33 0.102 -12.880 -4.807
223 HD3 ARG 33 2HD ARG 33 1.599 -12.261 -5.503
224 HE ARG 33 HE ARG 33 1.202 -11.681 -2.695
225 HH11 ARG 33 1HH1 ARG 33 2.564 -13.836 -5.066
226 HH12 ARG 33 2HH1 ARG 33 3.725 -14.514 -3.973
227 HH21 ARG 33 1HH2 ARG 33 2.726 -12.566 -1.247
228 HH22 ARG 33 2HH2 ARG 33 3.815 -13.792 -1.801
229 H VAL 34 H VAL 34 -1.848 -8.115 -2.322
230 HA VAL 34 HA VAL 34 -4.050 -9.205 -0.977
231 HB VAL 34 HB VAL 34 -3.855 -7.391 0.590
232 HG11 VAL 34 1HG1 VAL 34 -2.132 -8.780 1.112
233 HG12 VAL 34 2HG1 VAL 34 -1.387 -8.638 -0.482
234 HG13 VAL 34 3HG1 VAL 34 -1.198 -7.342 0.700
235 HG21 VAL 34 3HG2 VAL 34 -2.014 -5.609 -0.095
236 HG22 VAL 34 1HG2 VAL 34 -2.593 -6.005 -1.713
237 HG23 VAL 34 2HG2 VAL 34 -3.716 -5.392 -0.500
238 H HIS 35 H HIS 35 -3.824 -6.677 -3.350
239 HA HIS 35 HA HIS 35 -6.463 -5.630 -2.826
240 HB2 HIS 35 1HB HIS 35 -4.390 -5.095 -4.946
241 HB3 HIS 35 2HB HIS 35 -6.000 -4.387 -5.024
242 HD1 HIS 35 HD1 HIS 35 -6.642 -2.775 -2.982
243 HD2 HIS 35 HD2 HIS 35 -2.626 -3.782 -3.320
244 HE1 HIS 35 HE1 HIS 35 -5.408 -1.100 -1.570
245 H THR 36 H THR 36 -5.006 -8.011 -4.895
246 HA THR 36 HA THR 36 -7.343 -8.235 -6.599
247 HB THR 36 HB THR 36 -6.099 -10.122 -7.653
248 HG1 THR 36 HG1 THR 36 -4.563 -9.785 -5.417
249 HG21 THR 36 3HG2 THR 36 -5.153 -8.611 -8.996
250 HG22 THR 36 1HG2 THR 36 -4.002 -8.135 -7.750
251 HG23 THR 36 2HG2 THR 36 -5.596 -7.383 -7.811
252 H GLY 37 H GLY 37 -7.895 -8.678 -3.867
253 HA2 GLY 37 1HA GLY 37 -8.468 -11.578 -3.866
254 HA3 GLY 37 2HA GLY 37 -8.149 -10.657 -2.404
255 H GLU 38 H GLU 38 -9.689 -8.511 -2.512
256 HA GLU 38 HA GLU 38 -12.408 -9.618 -2.723
257 HB2 GLU 38 1HB GLU 38 -11.328 -7.419 -0.954
258 HB3 GLU 38 2HB GLU 38 -13.025 -7.868 -1.055
259 HG2 GLU 38 1HG GLU 38 -12.686 -9.900 -0.001
260 HG3 GLU 38 2HG GLU 38 -10.961 -9.913 -0.363
261 H LYS 39 H LYS 39 -13.805 -8.731 -4.101
262 HA LYS 39 HA LYS 39 -13.140 -6.103 -5.259
263 HB2 LYS 39 1HB LYS 39 -14.111 -8.624 -6.557
264 HB3 LYS 39 2HB LYS 39 -14.500 -7.066 -7.273
265 HG2 LYS 39 1HG LYS 39 -12.232 -6.560 -7.657
266 HG3 LYS 39 2HG LYS 39 -11.685 -7.875 -6.613
267 HD2 LYS 39 1HD LYS 39 -13.375 -8.537 -8.975
268 HD3 LYS 39 2HD LYS 39 -11.680 -8.117 -9.239
269 HE2 LYS 39 1HE LYS 39 -12.345 -10.100 -7.121
270 HE3 LYS 39 2HE LYS 39 -12.436 -10.609 -8.806
271 HZ1 LYS 39 3HZ LYS 39 -10.270 -11.090 -8.265
272 HZ2 LYS 39 1HZ LYS 39 -10.091 -9.744 -7.256
273 HZ3 LYS 39 2HZ LYS 39 -10.097 -9.547 -8.936
274 HA PRO 40 HA PRO 40 -17.109 -4.689 -4.017
275 HB2 PRO 40 1HB PRO 40 -17.622 -2.866 -5.962
276 HB3 PRO 40 2HB PRO 40 -16.431 -2.598 -4.684
277 HG2 PRO 40 1HG PRO 40 -16.008 -3.492 -7.510
278 HG3 PRO 40 2HG PRO 40 -15.084 -2.314 -6.559
279 HD2 PRO 40 1HD PRO 40 -14.242 -4.859 -6.942
280 HD3 PRO 40 2HD PRO 40 -13.892 -3.951 -5.457
281 H SER 41 H SER 41 -19.289 -3.969 -5.275
282 HA SER 41 HA SER 41 -19.966 -5.707 -7.473
283 HB2 SER 41 1HB SER 41 -21.368 -6.129 -4.824
284 HB3 SER 41 2HB SER 41 -21.666 -6.997 -6.330
285 HG SER 41 HG SER 41 -19.988 -7.661 -4.445
286 H GLY 42 H GLY 42 -22.202 -5.378 -8.212
287 HA2 GLY 42 1HA GLY 42 -24.040 -4.069 -8.673
288 HA3 GLY 42 2HA GLY 42 -23.812 -3.300 -7.110
289 HA PRO 43 HA PRO 43 -21.377 -0.934 -10.618
290 HB2 PRO 43 1HB PRO 43 -22.745 -0.930 -12.963
291 HB3 PRO 43 2HB PRO 43 -21.500 -2.125 -12.579
292 HG2 PRO 43 1HG PRO 43 -24.478 -2.366 -12.398
293 HG3 PRO 43 2HG PRO 43 -23.297 -3.536 -13.015
294 HD2 PRO 43 1HD PRO 43 -24.378 -3.724 -10.539
295 HD3 PRO 43 2HD PRO 43 -22.725 -4.261 -10.903
296 H SER 44 H SER 44 -21.683 1.215 -10.570
297 HA SER 44 HA SER 44 -24.059 2.333 -9.559
298 HB2 SER 44 1HB SER 44 -21.734 3.678 -10.957
299 HB3 SER 44 2HB SER 44 -22.994 4.520 -10.054
300 HG SER 44 HG SER 44 -20.784 3.596 -9.082
301 H SER 45 H SER 45 -22.690 2.298 -12.833
302 HA SER 45 HA SER 45 -25.371 2.909 -13.871
303 HB2 SER 45 1HB SER 45 -23.736 4.902 -13.892
304 HB3 SER 45 2HB SER 45 -22.888 4.023 -15.164
305 HG SER 45 HG SER 45 -24.956 5.581 -15.456
306 H GLY 46 H GLY 46 -25.519 0.619 -14.216
307 HA2 GLY 46 1HA GLY 46 -25.401 -1.268 -15.518
308 HA3 GLY 46 2HA GLY 46 -24.935 -0.189 -16.824
Start of MODEL 12
1 H1 GLY 1 H GLY 1 -1.928 19.378 7.680
2 HA2 GLY 1 1HA GLY 1 -1.884 16.875 7.230
3 HA3 GLY 1 2HA GLY 1 -2.422 17.325 5.618
4 H SER 2 H SER 2 0.109 18.455 7.865
5 HA SER 2 HA SER 2 1.919 19.103 5.785
6 HB2 SER 2 1HB SER 2 2.172 20.229 7.879
7 HB3 SER 2 2HB SER 2 2.300 18.705 8.757
8 HG SER 2 HG SER 2 4.359 18.803 8.415
9 H SER 3 H SER 3 2.758 17.631 4.464
10 HA SER 3 HA SER 3 3.181 14.904 5.290
11 HB2 SER 3 1HB SER 3 3.856 16.328 2.705
12 HB3 SER 3 2HB SER 3 4.013 14.592 2.969
13 HG SER 3 HG SER 3 1.998 15.381 1.956
14 H GLY 4 H GLY 4 5.118 13.849 5.590
15 HA2 GLY 4 1HA GLY 4 7.666 14.598 4.992
16 HA3 GLY 4 2HA GLY 4 7.314 15.495 6.462
17 H SER 5 H SER 5 6.988 12.182 5.184
18 HA SER 5 HA SER 5 7.714 11.185 7.857
19 HB2 SER 5 1HB SER 5 6.106 9.951 5.621
20 HB3 SER 5 2HB SER 5 6.729 8.998 6.968
21 HG SER 5 HG SER 5 4.646 10.796 6.890
22 H SER 6 H SER 6 8.295 10.712 4.393
23 HA SER 6 HA SER 6 10.038 8.676 4.265
24 HB2 SER 6 1HB SER 6 11.123 9.762 2.386
25 HB3 SER 6 2HB SER 6 9.401 10.139 2.349
26 HG SER 6 HG SER 6 9.817 12.179 2.826
27 H GLY 7 H GLY 7 11.486 8.164 5.798
28 HA2 GLY 7 1HA GLY 7 13.577 10.163 6.385
29 HA3 GLY 7 2HA GLY 7 12.852 9.207 7.670
30 H SER 8 H SER 8 14.972 9.156 4.892
31 HA SER 8 HA SER 8 16.657 7.753 4.282
32 HB2 SER 8 1HB SER 8 17.403 8.005 6.608
33 HB3 SER 8 2HB SER 8 16.341 6.686 7.099
34 HG SER 8 HG SER 8 17.637 5.255 6.134
35 H GLY 9 H GLY 9 14.118 7.045 3.466
36 HA2 GLY 9 1HA GLY 9 14.435 4.147 3.237
37 HA3 GLY 9 2HA GLY 9 12.906 4.740 3.868
38 H GLU 10 H GLU 10 15.015 5.874 1.232
39 HA GLU 10 HA GLU 10 12.880 6.562 -0.462
40 HB2 GLU 10 1HB GLU 10 15.161 7.481 -0.681
41 HB3 GLU 10 2HB GLU 10 15.735 5.907 -1.211
42 HG2 GLU 10 1HG GLU 10 14.154 6.062 -3.134
43 HG3 GLU 10 2HG GLU 10 13.804 7.717 -2.637
44 H LYS 11 H LYS 11 11.483 5.245 -1.404
45 HA LYS 11 HA LYS 11 12.412 2.582 -2.264
46 HB2 LYS 11 1HB LYS 11 9.672 3.464 -1.342
47 HB3 LYS 11 2HB LYS 11 10.014 1.888 -2.044
48 HG2 LYS 11 1HG LYS 11 11.404 1.283 -0.214
49 HG3 LYS 11 2HG LYS 11 11.374 2.926 0.429
50 HD2 LYS 11 1HD LYS 11 8.978 2.718 0.861
51 HD3 LYS 11 2HD LYS 11 8.993 1.084 0.195
52 HE2 LYS 11 1HE LYS 11 9.082 0.801 2.526
53 HE3 LYS 11 2HE LYS 11 10.735 0.546 1.967
54 HZ1 LYS 11 3HZ LYS 11 11.463 2.391 3.001
55 HZ2 LYS 11 1HZ LYS 11 10.104 2.155 3.981
56 HZ3 LYS 11 2HZ LYS 11 10.046 3.269 2.710
57 HA PRO 12 HA PRO 12 11.592 4.278 -6.319
58 HB2 PRO 12 1HB PRO 12 12.437 2.088 -7.683
59 HB3 PRO 12 2HB PRO 12 13.548 3.267 -6.977
60 HG2 PRO 12 1HG PRO 12 12.684 0.605 -5.914
61 HG3 PRO 12 2HG PRO 12 14.303 1.327 -5.941
62 HD2 PRO 12 1HD PRO 12 12.747 1.322 -3.725
63 HD3 PRO 12 2HD PRO 12 13.890 2.632 -4.086
64 H PHE 13 H PHE 13 10.238 1.497 -4.814
65 HA PHE 13 HA PHE 13 8.250 1.223 -6.965
66 HB2 PHE 13 1HB PHE 13 8.866 -0.700 -4.712
67 HB3 PHE 13 2HB PHE 13 7.752 -0.981 -6.046
68 HD1 PHE 13 HD1 PHE 13 11.277 -0.709 -5.076
69 HD2 PHE 13 HD2 PHE 13 8.548 -1.576 -8.226
70 HE1 PHE 13 HE1 PHE 13 13.115 -1.670 -6.400
71 HE2 PHE 13 HE2 PHE 13 10.382 -2.539 -9.554
72 HZ PHE 13 HZ PHE 13 12.669 -2.587 -8.641
73 H LYS 14 H LYS 14 6.091 1.451 -6.555
74 HA LYS 14 HA LYS 14 5.192 1.913 -3.821
75 HB2 LYS 14 1HB LYS 14 5.803 4.141 -4.558
76 HB3 LYS 14 2HB LYS 14 4.881 3.939 -6.042
77 HG2 LYS 14 1HG LYS 14 2.851 3.626 -4.515
78 HG3 LYS 14 2HG LYS 14 3.875 4.297 -3.243
79 HD2 LYS 14 1HD LYS 14 4.300 6.251 -4.785
80 HD3 LYS 14 2HD LYS 14 3.022 5.607 -5.818
81 HE2 LYS 14 1HE LYS 14 1.922 7.172 -4.486
82 HE3 LYS 14 2HE LYS 14 1.574 5.634 -3.698
83 HZ1 LYS 14 3HZ LYS 14 3.245 7.850 -2.791
84 HZ2 LYS 14 1HZ LYS 14 3.755 6.287 -2.391
85 HZ3 LYS 14 2HZ LYS 14 2.228 6.829 -1.905
86 H CYS 15 H CYS 15 3.255 1.028 -3.471
87 HA CYS 15 HA CYS 15 1.901 -0.321 -5.604
88 HB2 CYS 15 1HB CYS 15 2.076 -1.186 -3.253
89 HB3 CYS 15 2HB CYS 15 0.954 0.078 -2.761
90 H GLU 16 H GLU 16 1.013 1.088 -7.048
91 HA GLU 16 HA GLU 16 -0.266 3.494 -6.481
92 HB2 GLU 16 1HB GLU 16 -0.829 1.598 -8.768
93 HB3 GLU 16 2HB GLU 16 -1.281 3.296 -8.708
94 HG2 GLU 16 1HG GLU 16 1.134 3.866 -8.542
95 HG3 GLU 16 2HG GLU 16 1.502 2.160 -8.793
96 H GLU 17 H GLU 17 -1.380 0.238 -6.155
97 HA GLU 17 HA GLU 17 -4.137 0.556 -6.301
98 HB2 GLU 17 1HB GLU 17 -2.677 -1.245 -4.364
99 HB3 GLU 17 2HB GLU 17 -4.310 -1.457 -4.979
100 HG2 GLU 17 1HG GLU 17 -3.133 -1.515 -7.299
101 HG3 GLU 17 2HG GLU 17 -1.700 -1.899 -6.347
102 H CYS 18 H CYS 18 -2.050 0.772 -3.420
103 HA CYS 18 HA CYS 18 -4.189 2.320 -2.108
104 HB2 CYS 18 1HB CYS 18 -3.319 1.495 0.040
105 HB3 CYS 18 2HB CYS 18 -3.825 0.169 -1.002
106 H GLY 19 H GLY 19 -0.702 1.964 -2.564
107 HA2 GLY 19 1HA GLY 19 0.406 4.168 -3.041
108 HA3 GLY 19 2HA GLY 19 -0.375 4.728 -1.569
109 H LYS 20 H LYS 20 0.709 1.495 -1.482
110 HA LYS 20 HA LYS 20 2.522 2.016 0.634
111 HB2 LYS 20 1HB LYS 20 1.653 -0.370 -0.907
112 HB3 LYS 20 2HB LYS 20 3.191 -0.487 -0.062
113 HG2 LYS 20 1HG LYS 20 1.867 0.380 1.980
114 HG3 LYS 20 2HG LYS 20 0.445 -0.117 1.058
115 HD2 LYS 20 1HD LYS 20 0.852 -2.054 2.199
116 HD3 LYS 20 2HD LYS 20 1.856 -2.339 0.775
117 HE2 LYS 20 1HE LYS 20 3.825 -1.621 1.960
118 HE3 LYS 20 2HE LYS 20 2.858 -1.142 3.355
119 HZ1 LYS 20 3HZ LYS 20 3.743 -3.779 2.533
120 HZ2 LYS 20 1HZ LYS 20 2.154 -3.697 3.108
121 HZ3 LYS 20 2HZ LYS 20 3.434 -3.174 4.082
122 H ARG 21 H ARG 21 4.781 0.739 0.402
123 HA ARG 21 HA ARG 21 6.091 1.411 -2.112
124 HB2 ARG 21 1HB ARG 21 6.960 2.550 0.551
125 HB3 ARG 21 2HB ARG 21 7.900 2.639 -0.933
126 HG2 ARG 21 1HG ARG 21 5.772 3.777 -1.898
127 HG3 ARG 21 2HG ARG 21 5.382 4.059 -0.200
128 HD2 ARG 21 1HD ARG 21 8.108 4.745 -1.189
129 HD3 ARG 21 2HD ARG 21 6.764 5.814 -1.588
130 HE ARG 21 HE ARG 21 6.467 5.545 1.052
131 HH11 ARG 21 1HH1 ARG 21 9.278 6.222 -0.887
132 HH12 ARG 21 2HH1 ARG 21 10.062 7.158 0.343
133 HH21 ARG 21 1HH2 ARG 21 7.488 6.775 2.679
134 HH22 ARG 21 2HH2 ARG 21 9.043 7.471 2.371
135 H PHE 22 H PHE 22 8.269 0.517 -2.268
136 HA PHE 22 HA PHE 22 9.120 -1.385 -0.274
137 HB2 PHE 22 1HB PHE 22 8.459 -2.452 -3.018
138 HB3 PHE 22 2HB PHE 22 8.930 -3.365 -1.589
139 HD1 PHE 22 HD2 PHE 22 6.226 -1.285 -3.024
140 HD2 PHE 22 HD1 PHE 22 7.326 -4.158 -0.083
141 HE1 PHE 22 HE2 PHE 22 3.854 -1.602 -2.451
142 HE2 PHE 22 HE1 PHE 22 4.956 -4.480 0.494
143 HZ PHE 22 HZ PHE 22 3.216 -3.200 -0.690
144 H THR 23 H THR 23 11.235 -2.192 -0.642
145 HA THR 23 HA THR 23 12.883 -0.384 -2.158
146 HB THR 23 HB THR 23 13.537 -1.308 0.085
147 HG1 THR 23 HG1 THR 23 15.211 -0.447 -1.038
148 HG21 THR 23 3HG2 THR 23 14.634 -3.750 -1.125
149 HG22 THR 23 1HG2 THR 23 12.879 -3.734 -0.961
150 HG23 THR 23 2HG2 THR 23 13.899 -3.501 0.459
151 H GLN 24 H GLN 24 11.291 -3.278 -2.834
152 HA GLN 24 HA GLN 24 12.770 -3.544 -5.334
153 HB2 GLN 24 1HB GLN 24 12.703 -5.555 -3.165
154 HB3 GLN 24 2HB GLN 24 12.433 -6.168 -4.791
155 HG2 GLN 24 1HG GLN 24 14.831 -4.670 -3.774
156 HG3 GLN 24 2HG GLN 24 14.753 -6.349 -4.304
157 HE21 GLN 24 1HE2 GLN 24 13.253 -6.052 -6.613
158 HE22 GLN 24 2HE2 GLN 24 14.180 -5.173 -7.776
159 H ASN 25 H ASN 25 11.609 -4.663 -6.987
160 HA ASN 25 HA ASN 25 8.850 -4.109 -7.018
161 HB2 ASN 25 1HB ASN 25 8.863 -4.869 -9.208
162 HB3 ASN 25 2HB ASN 25 10.559 -4.452 -8.977
163 HD21 ASN 25 1HD2 ASN 25 12.015 -6.208 -8.386
164 HD22 ASN 25 2HD2 ASN 25 11.704 -7.791 -9.005
165 H SER 26 H SER 26 10.600 -7.196 -6.759
166 HA SER 26 HA SER 26 8.576 -9.003 -6.726
167 HB2 SER 26 1HB SER 26 11.044 -9.464 -6.402
168 HB3 SER 26 2HB SER 26 10.817 -9.074 -4.698
169 HG SER 26 HG SER 26 9.063 -10.746 -4.856
170 H GLN 27 H GLN 27 9.483 -6.830 -4.106
171 HA GLN 27 HA GLN 27 7.735 -7.940 -2.165
172 HB2 GLN 27 1HB GLN 27 8.992 -5.200 -2.371
173 HB3 GLN 27 2HB GLN 27 8.101 -5.775 -0.968
174 HG2 GLN 27 1HG GLN 27 9.758 -7.682 -0.865
175 HG3 GLN 27 2HG GLN 27 10.711 -6.787 -2.048
176 HE21 GLN 27 1HE2 GLN 27 10.676 -4.280 -1.309
177 HE22 GLN 27 2HE2 GLN 27 11.279 -4.058 0.294
178 H LEU 28 H LEU 28 7.487 -4.978 -4.136
179 HA LEU 28 HA LEU 28 4.923 -4.236 -3.344
180 HB2 LEU 28 1HB LEU 28 6.271 -2.694 -4.547
181 HB3 LEU 28 2HB LEU 28 6.418 -3.794 -5.916
182 HG LEU 28 HG LEU 28 4.068 -3.446 -6.464
183 HD11 LEU 28 1HD1 LEU 28 3.887 -1.268 -4.432
184 HD12 LEU 28 2HD1 LEU 28 3.539 -2.932 -3.966
185 HD13 LEU 28 3HD1 LEU 28 2.600 -2.159 -5.243
186 HD21 LEU 28 3HD2 LEU 28 5.743 -1.964 -7.445
187 HD22 LEU 28 1HD2 LEU 28 5.575 -0.861 -6.079
188 HD23 LEU 28 2HD2 LEU 28 4.219 -1.116 -7.178
189 H HIS 29 H HIS 29 5.893 -6.107 -6.218
190 HA HIS 29 HA HIS 29 3.317 -6.626 -7.174
191 HB2 HIS 29 1HB HIS 29 5.854 -8.247 -7.452
192 HB3 HIS 29 2HB HIS 29 4.381 -8.549 -8.369
193 HD1 HIS 29 HD1 HIS 29 7.295 -7.580 -9.429
194 HD2 HIS 29 HD2 HIS 29 3.823 -5.322 -9.099
195 HE1 HIS 29 HE1 HIS 29 7.567 -5.685 -11.060
196 H SER 30 H SER 30 5.142 -8.091 -4.605
197 HA SER 30 HA SER 30 3.470 -10.427 -4.406
198 HB2 SER 30 1HB SER 30 5.821 -9.338 -2.950
199 HB3 SER 30 2HB SER 30 4.761 -10.423 -2.051
200 HG SER 30 HG SER 30 5.637 -12.004 -3.098
201 H HIS 31 H HIS 31 3.404 -7.202 -3.225
202 HA HIS 31 HA HIS 31 1.555 -7.828 -1.065
203 HB2 HIS 31 1HB HIS 31 2.897 -6.125 -0.313
204 HB3 HIS 31 2HB HIS 31 3.094 -5.426 -1.918
205 HD1 HIS 31 HD1 HIS 31 0.868 -5.360 1.078
206 HD2 HIS 31 HD2 HIS 31 1.140 -3.554 -2.654
207 HE1 HIS 31 HE1 HIS 31 -0.760 -3.444 1.138
208 H GLN 32 H GLN 32 1.584 -6.102 -4.158
209 HA GLN 32 HA GLN 32 -0.923 -5.006 -4.202
210 HB2 GLN 32 1HB GLN 32 0.763 -6.231 -6.360
211 HB3 GLN 32 2HB GLN 32 -0.842 -5.615 -6.732
212 HG2 GLN 32 1HG GLN 32 -0.193 -3.414 -5.898
213 HG3 GLN 32 2HG GLN 32 1.415 -4.032 -5.524
214 HE21 GLN 32 1HE2 GLN 32 1.827 -2.096 -6.976
215 HE22 GLN 32 2HE2 GLN 32 1.976 -2.425 -8.666
216 H ARG 33 H ARG 33 -0.081 -8.350 -4.249
217 HA ARG 33 HA ARG 33 -2.299 -9.496 -5.469
218 HB2 ARG 33 1HB ARG 33 -1.014 -10.685 -3.023
219 HB3 ARG 33 2HB ARG 33 -1.696 -11.515 -4.416
220 HG2 ARG 33 1HG ARG 33 0.187 -10.359 -5.745
221 HG3 ARG 33 2HG ARG 33 0.926 -10.100 -4.164
222 HD2 ARG 33 1HD ARG 33 0.995 -12.449 -3.734
223 HD3 ARG 33 2HD ARG 33 0.023 -12.794 -5.164
224 HE ARG 33 HE ARG 33 2.525 -11.453 -5.693
225 HH11 ARG 33 1HH1 ARG 33 0.884 -14.505 -5.357
226 HH12 ARG 33 2HH1 ARG 33 2.047 -15.382 -6.295
227 HH21 ARG 33 1HH2 ARG 33 4.063 -12.597 -6.929
228 HH22 ARG 33 2HH2 ARG 33 3.855 -14.296 -7.188
229 H VAL 34 H VAL 34 -1.931 -8.137 -2.264
230 HA VAL 34 HA VAL 34 -4.198 -9.197 -1.025
231 HB VAL 34 HB VAL 34 -4.052 -7.418 0.559
232 HG11 VAL 34 1HG1 VAL 34 -1.364 -7.253 0.628
233 HG12 VAL 34 2HG1 VAL 34 -2.272 -8.674 1.148
234 HG13 VAL 34 3HG1 VAL 34 -1.564 -8.620 -0.468
235 HG21 VAL 34 3HG2 VAL 34 -4.017 -5.529 -0.958
236 HG22 VAL 34 1HG2 VAL 34 -2.664 -5.418 0.168
237 HG23 VAL 34 2HG2 VAL 34 -2.391 -5.953 -1.491
238 H HIS 35 H HIS 35 -3.847 -6.558 -3.297
239 HA HIS 35 HA HIS 35 -6.507 -5.547 -2.927
240 HB2 HIS 35 1HB HIS 35 -4.364 -5.047 -4.988
241 HB3 HIS 35 2HB HIS 35 -5.960 -4.312 -5.102
242 HD1 HIS 35 HD1 HIS 35 -6.585 -2.560 -3.249
243 HD2 HIS 35 HD2 HIS 35 -2.651 -3.891 -3.149
244 HE1 HIS 35 HE1 HIS 35 -5.364 -0.938 -1.766
245 H THR 36 H THR 36 -5.046 -8.045 -4.798
246 HA THR 36 HA THR 36 -7.328 -8.245 -6.606
247 HB THR 36 HB THR 36 -6.076 -10.005 -7.739
248 HG1 THR 36 HG1 THR 36 -4.287 -9.667 -5.556
249 HG21 THR 36 3HG2 THR 36 -4.042 -8.668 -8.370
250 HG22 THR 36 1HG2 THR 36 -4.488 -7.518 -7.110
251 HG23 THR 36 2HG2 THR 36 -5.568 -7.791 -8.478
252 H GLY 37 H GLY 37 -7.959 -8.685 -3.913
253 HA2 GLY 37 1HA GLY 37 -9.140 -11.300 -4.108
254 HA3 GLY 37 2HA GLY 37 -7.889 -11.207 -2.876
255 H GLU 38 H GLU 38 -8.389 -8.526 -2.055
256 HA GLU 38 HA GLU 38 -10.663 -9.021 -0.340
257 HB2 GLU 38 1HB GLU 38 -8.419 -7.961 0.347
258 HB3 GLU 38 2HB GLU 38 -9.031 -6.493 -0.402
259 HG2 GLU 38 1HG GLU 38 -10.694 -6.220 1.179
260 HG3 GLU 38 2HG GLU 38 -10.660 -7.916 1.656
261 H LYS 39 H LYS 39 -9.899 -7.107 -3.135
262 HA LYS 39 HA LYS 39 -12.687 -6.287 -3.322
263 HB2 LYS 39 1HB LYS 39 -10.384 -4.425 -2.977
264 HB3 LYS 39 2HB LYS 39 -11.669 -3.953 -4.082
265 HG2 LYS 39 1HG LYS 39 -13.301 -4.073 -2.327
266 HG3 LYS 39 2HG LYS 39 -12.107 -4.733 -1.208
267 HD2 LYS 39 1HD LYS 39 -10.834 -2.660 -1.319
268 HD3 LYS 39 2HD LYS 39 -11.984 -2.001 -2.485
269 HE2 LYS 39 1HE LYS 39 -12.457 -1.129 -0.279
270 HE3 LYS 39 2HE LYS 39 -13.766 -2.190 -0.797
271 HZ1 LYS 39 3HZ LYS 39 -13.481 -3.166 1.172
272 HZ2 LYS 39 1HZ LYS 39 -11.967 -2.455 1.428
273 HZ3 LYS 39 2HZ LYS 39 -12.093 -3.869 0.509
274 HA PRO 40 HA PRO 40 -12.170 -7.014 -7.618
275 HB2 PRO 40 1HB PRO 40 -13.762 -5.115 -8.728
276 HB3 PRO 40 2HB PRO 40 -14.400 -6.525 -7.874
277 HG2 PRO 40 1HG PRO 40 -14.033 -3.721 -6.891
278 HG3 PRO 40 2HG PRO 40 -15.403 -4.821 -6.649
279 HD2 PRO 40 1HD PRO 40 -13.513 -4.408 -4.754
280 HD3 PRO 40 2HD PRO 40 -14.347 -5.964 -4.948
281 H SER 41 H SER 41 -11.978 -5.581 -9.792
282 HA SER 41 HA SER 41 -9.427 -4.565 -9.882
283 HB2 SER 41 1HB SER 41 -11.813 -3.988 -11.639
284 HB3 SER 41 2HB SER 41 -10.198 -3.381 -12.003
285 HG SER 41 HG SER 41 -10.534 -5.343 -13.060
286 H GLY 42 H GLY 42 -12.299 -2.473 -10.210
287 HA2 GLY 42 1HA GLY 42 -11.888 -0.697 -8.179
288 HA3 GLY 42 2HA GLY 42 -10.787 -0.153 -9.436
289 HA PRO 43 HA PRO 43 -15.420 0.363 -10.876
290 HB2 PRO 43 1HB PRO 43 -17.098 0.907 -8.812
291 HB3 PRO 43 2HB PRO 43 -16.821 -0.729 -9.420
292 HG2 PRO 43 1HG PRO 43 -15.625 0.635 -7.039
293 HG3 PRO 43 2HG PRO 43 -16.240 -1.022 -7.187
294 HD2 PRO 43 1HD PRO 43 -13.599 -0.433 -7.292
295 HD3 PRO 43 2HD PRO 43 -14.314 -1.780 -8.201
296 H SER 44 H SER 44 -13.343 2.053 -8.911
297 HA SER 44 HA SER 44 -14.661 4.502 -8.509
298 HB2 SER 44 1HB SER 44 -11.715 3.886 -8.830
299 HB3 SER 44 2HB SER 44 -12.349 5.448 -8.310
300 HG SER 44 HG SER 44 -11.734 3.972 -6.585
301 H SER 45 H SER 45 -15.602 5.597 -10.109
302 HA SER 45 HA SER 45 -13.973 6.281 -12.453
303 HB2 SER 45 1HB SER 45 -16.002 6.038 -13.892
304 HB3 SER 45 2HB SER 45 -15.438 4.510 -13.216
305 HG SER 45 HG SER 45 -17.347 4.312 -12.390
306 H GLY 46 H GLY 46 -14.084 8.373 -13.055
307 HA2 GLY 46 1HA GLY 46 -16.336 10.036 -12.328
308 HA3 GLY 46 2HA GLY 46 -14.861 10.398 -11.444
Start of MODEL 13
1 H1 GLY 1 H GLY 1 3.683 19.947 21.554
2 HA2 GLY 1 1HA GLY 1 3.739 17.151 20.975
3 HA3 GLY 1 2HA GLY 1 2.131 17.820 20.739
4 H SER 2 H SER 2 5.019 17.153 19.256
5 HA SER 2 HA SER 2 4.305 18.854 16.981
6 HB2 SER 2 1HB SER 2 7.147 18.584 17.982
7 HB3 SER 2 2HB SER 2 6.587 19.573 16.634
8 HG SER 2 HG SER 2 6.796 20.288 19.147
9 H SER 3 H SER 3 4.800 18.001 14.974
10 HA SER 3 HA SER 3 5.317 15.137 14.965
11 HB2 SER 3 1HB SER 3 4.152 17.093 13.034
12 HB3 SER 3 2HB SER 3 4.869 15.616 12.389
13 HG SER 3 HG SER 3 2.848 14.999 12.803
14 H GLY 4 H GLY 4 7.568 15.258 15.513
15 HA2 GLY 4 1HA GLY 4 9.541 16.682 14.208
16 HA3 GLY 4 2HA GLY 4 9.783 15.096 14.926
17 H SER 5 H SER 5 9.114 13.218 13.559
18 HA SER 5 HA SER 5 9.428 13.782 10.690
19 HB2 SER 5 1HB SER 5 11.096 12.021 12.430
20 HB3 SER 5 2HB SER 5 10.768 11.487 10.781
21 HG SER 5 HG SER 5 11.435 14.036 10.654
22 H SER 6 H SER 6 8.379 12.381 9.293
23 HA SER 6 HA SER 6 6.304 10.743 10.549
24 HB2 SER 6 1HB SER 6 5.949 12.584 8.690
25 HB3 SER 6 2HB SER 6 6.393 11.267 7.604
26 HG SER 6 HG SER 6 4.151 11.546 9.252
27 H GLY 7 H GLY 7 8.536 10.530 7.770
28 HA2 GLY 7 1HA GLY 7 9.061 7.742 8.432
29 HA3 GLY 7 2HA GLY 7 8.283 8.032 6.884
30 H SER 8 H SER 8 11.022 7.026 7.759
31 HA SER 8 HA SER 8 12.602 8.875 6.093
32 HB2 SER 8 1HB SER 8 13.500 7.200 8.448
33 HB3 SER 8 2HB SER 8 14.598 8.069 7.377
34 HG SER 8 HG SER 8 12.698 9.749 8.184
35 H GLY 9 H GLY 9 14.056 7.982 4.609
36 HA2 GLY 9 1HA GLY 9 15.178 5.857 3.886
37 HA3 GLY 9 2HA GLY 9 13.591 5.119 4.042
38 H GLU 10 H GLU 10 14.241 4.542 1.748
39 HA GLU 10 HA GLU 10 12.851 6.348 -0.033
40 HB2 GLU 10 1HB GLU 10 14.679 6.425 -1.687
41 HB3 GLU 10 2HB GLU 10 15.107 7.233 -0.185
42 HG2 GLU 10 1HG GLU 10 16.319 5.173 0.502
43 HG3 GLU 10 2HG GLU 10 16.000 4.511 -1.101
44 H LYS 11 H LYS 11 11.636 5.202 -1.385
45 HA LYS 11 HA LYS 11 12.503 2.500 -2.145
46 HB2 LYS 11 1HB LYS 11 9.794 3.289 -1.070
47 HB3 LYS 11 2HB LYS 11 10.090 1.779 -1.922
48 HG2 LYS 11 1HG LYS 11 11.555 1.008 -0.220
49 HG3 LYS 11 2HG LYS 11 11.581 2.592 0.560
50 HD2 LYS 11 1HD LYS 11 8.950 1.256 0.207
51 HD3 LYS 11 2HD LYS 11 10.042 0.617 1.438
52 HE2 LYS 11 1HE LYS 11 10.253 3.017 2.262
53 HE3 LYS 11 2HE LYS 11 8.872 3.379 1.227
54 HZ1 LYS 11 3HZ LYS 11 8.965 1.541 3.549
55 HZ2 LYS 11 1HZ LYS 11 7.684 1.552 2.443
56 HZ3 LYS 11 2HZ LYS 11 8.020 2.931 3.362
57 HA PRO 12 HA PRO 12 11.541 4.382 -6.092
58 HB2 PRO 12 1HB PRO 12 12.484 2.319 -7.583
59 HB3 PRO 12 2HB PRO 12 13.539 3.522 -6.832
60 HG2 PRO 12 1HG PRO 12 12.846 0.763 -5.899
61 HG3 PRO 12 2HG PRO 12 14.421 1.577 -5.911
62 HD2 PRO 12 1HD PRO 12 12.907 1.367 -3.676
63 HD3 PRO 12 2HD PRO 12 13.967 2.758 -3.984
64 H PHE 13 H PHE 13 10.318 1.526 -4.667
65 HA PHE 13 HA PHE 13 8.369 1.167 -6.839
66 HB2 PHE 13 1HB PHE 13 9.018 -0.708 -4.555
67 HB3 PHE 13 2HB PHE 13 7.939 -1.045 -5.905
68 HD1 PHE 13 HD1 PHE 13 11.423 -0.689 -4.851
69 HD2 PHE 13 HD2 PHE 13 8.807 -1.571 -8.091
70 HE1 PHE 13 HE1 PHE 13 13.319 -1.593 -6.132
71 HE2 PHE 13 HE2 PHE 13 10.699 -2.477 -9.377
72 HZ PHE 13 HZ PHE 13 12.958 -2.489 -8.397
73 H LYS 14 H LYS 14 6.283 1.641 -6.534
74 HA LYS 14 HA LYS 14 5.264 1.950 -3.805
75 HB2 LYS 14 1HB LYS 14 5.871 4.193 -4.422
76 HB3 LYS 14 2HB LYS 14 5.090 4.028 -5.989
77 HG2 LYS 14 1HG LYS 14 2.941 3.629 -4.597
78 HG3 LYS 14 2HG LYS 14 3.859 4.386 -3.293
79 HD2 LYS 14 1HD LYS 14 4.305 6.303 -4.856
80 HD3 LYS 14 2HD LYS 14 3.155 5.567 -5.975
81 HE2 LYS 14 1HE LYS 14 1.358 5.864 -4.483
82 HE3 LYS 14 2HE LYS 14 2.434 6.192 -3.126
83 HZ1 LYS 14 3HZ LYS 14 1.581 7.961 -5.293
84 HZ2 LYS 14 1HZ LYS 14 3.145 8.171 -4.681
85 HZ3 LYS 14 2HZ LYS 14 1.809 8.297 -3.651
86 H CYS 15 H CYS 15 3.289 1.108 -3.536
87 HA CYS 15 HA CYS 15 2.013 -0.207 -5.745
88 HB2 CYS 15 1HB CYS 15 2.086 -1.180 -3.462
89 HB3 CYS 15 2HB CYS 15 1.046 0.123 -2.898
90 H GLU 16 H GLU 16 0.737 0.802 -7.137
91 HA GLU 16 HA GLU 16 -0.387 3.367 -6.641
92 HB2 GLU 16 1HB GLU 16 -1.055 1.412 -8.848
93 HB3 GLU 16 2HB GLU 16 -1.421 3.132 -8.836
94 HG2 GLU 16 1HG GLU 16 0.894 3.698 -8.964
95 HG3 GLU 16 2HG GLU 16 1.369 2.015 -8.738
96 H GLU 17 H GLU 17 -1.500 0.120 -6.205
97 HA GLU 17 HA GLU 17 -4.257 0.439 -6.284
98 HB2 GLU 17 1HB GLU 17 -2.746 -1.307 -4.336
99 HB3 GLU 17 2HB GLU 17 -4.398 -1.532 -4.892
100 HG2 GLU 17 1HG GLU 17 -3.272 -1.647 -7.248
101 HG3 GLU 17 2HG GLU 17 -1.833 -2.047 -6.311
102 H CYS 18 H CYS 18 -2.081 0.781 -3.486
103 HA CYS 18 HA CYS 18 -4.184 2.370 -2.168
104 HB2 CYS 18 1HB CYS 18 -3.220 1.606 -0.007
105 HB3 CYS 18 2HB CYS 18 -3.883 0.289 -0.971
106 H GLY 19 H GLY 19 -0.722 1.957 -2.712
107 HA2 GLY 19 1HA GLY 19 0.442 4.095 -3.256
108 HA3 GLY 19 2HA GLY 19 -0.340 4.751 -1.825
109 H LYS 20 H LYS 20 0.698 1.505 -1.571
110 HA LYS 20 HA LYS 20 2.463 2.074 0.559
111 HB2 LYS 20 1HB LYS 20 1.659 -0.342 -0.968
112 HB3 LYS 20 2HB LYS 20 3.180 -0.432 -0.090
113 HG2 LYS 20 1HG LYS 20 1.695 0.536 1.869
114 HG3 LYS 20 2HG LYS 20 0.403 -0.218 0.933
115 HD2 LYS 20 1HD LYS 20 1.648 -2.345 0.975
116 HD3 LYS 20 2HD LYS 20 2.893 -1.579 1.964
117 HE2 LYS 20 1HE LYS 20 -0.013 -1.865 2.725
118 HE3 LYS 20 2HE LYS 20 1.296 -2.896 3.301
119 HZ1 LYS 20 3HZ LYS 20 0.491 -0.323 4.221
120 HZ2 LYS 20 1HZ LYS 20 2.134 -0.341 3.820
121 HZ3 LYS 20 2HZ LYS 20 1.526 -1.446 4.947
122 H ARG 21 H ARG 21 4.739 0.801 0.400
123 HA ARG 21 HA ARG 21 6.114 1.475 -2.080
124 HB2 ARG 21 1HB ARG 21 6.900 2.622 0.605
125 HB3 ARG 21 2HB ARG 21 7.886 2.709 -0.849
126 HG2 ARG 21 1HG ARG 21 5.781 3.836 -1.882
127 HG3 ARG 21 2HG ARG 21 5.347 4.127 -0.196
128 HD2 ARG 21 1HD ARG 21 7.901 4.977 -1.558
129 HD3 ARG 21 2HD ARG 21 6.554 6.028 -1.122
130 HE ARG 21 HE ARG 21 8.645 5.150 0.586
131 HH11 ARG 21 1HH1 ARG 21 5.250 5.917 0.532
132 HH12 ARG 21 2HH1 ARG 21 5.188 6.354 2.207
133 HH21 ARG 21 1HH2 ARG 21 8.577 5.722 2.793
134 HH22 ARG 21 2HH2 ARG 21 7.082 6.244 3.492
135 H PHE 22 H PHE 22 8.186 0.481 -2.287
136 HA PHE 22 HA PHE 22 9.032 -1.384 -0.232
137 HB2 PHE 22 1HB PHE 22 8.426 -2.437 -2.995
138 HB3 PHE 22 2HB PHE 22 8.873 -3.359 -1.563
139 HD1 PHE 22 HD2 PHE 22 6.188 -1.350 -3.104
140 HD2 PHE 22 HD1 PHE 22 7.249 -4.081 -0.017
141 HE1 PHE 22 HE2 PHE 22 3.807 -1.671 -2.575
142 HE2 PHE 22 HE1 PHE 22 4.869 -4.407 0.517
143 HZ PHE 22 HZ PHE 22 3.145 -3.200 -0.761
144 H THR 23 H THR 23 11.149 -2.222 -0.576
145 HA THR 23 HA THR 23 12.838 -0.407 -2.043
146 HB THR 23 HB THR 23 13.510 -1.240 0.180
147 HG1 THR 23 HG1 THR 23 15.443 -0.885 -0.583
148 HG21 THR 23 3HG2 THR 23 12.859 -3.769 -0.977
149 HG22 THR 23 1HG2 THR 23 13.300 -3.398 0.690
150 HG23 THR 23 2HG2 THR 23 14.554 -3.784 -0.489
151 H GLN 24 H GLN 24 11.220 -3.248 -2.794
152 HA GLN 24 HA GLN 24 12.782 -3.544 -5.236
153 HB2 GLN 24 1HB GLN 24 12.592 -5.567 -3.082
154 HB3 GLN 24 2HB GLN 24 12.385 -6.161 -4.724
155 HG2 GLN 24 1HG GLN 24 14.754 -4.658 -3.637
156 HG3 GLN 24 2HG GLN 24 14.687 -6.367 -4.065
157 HE21 GLN 24 1HE2 GLN 24 13.223 -6.116 -6.451
158 HE22 GLN 24 2HE2 GLN 24 14.234 -5.353 -7.625
159 H ASN 25 H ASN 25 11.670 -4.873 -6.864
160 HA ASN 25 HA ASN 25 8.925 -4.177 -7.036
161 HB2 ASN 25 1HB ASN 25 8.943 -5.304 -9.168
162 HB3 ASN 25 2HB ASN 25 10.459 -4.424 -8.996
163 HD21 ASN 25 1HD2 ASN 25 12.369 -5.579 -8.606
164 HD22 ASN 25 2HD2 ASN 25 12.493 -7.264 -8.967
165 H SER 26 H SER 26 10.572 -7.314 -6.682
166 HA SER 26 HA SER 26 8.491 -9.051 -6.653
167 HB2 SER 26 1HB SER 26 10.921 -9.003 -4.858
168 HB3 SER 26 2HB SER 26 9.800 -10.364 -4.918
169 HG SER 26 HG SER 26 10.285 -10.051 -7.363
170 H GLN 27 H GLN 27 9.414 -6.857 -4.057
171 HA GLN 27 HA GLN 27 7.609 -7.876 -2.122
172 HB2 GLN 27 1HB GLN 27 8.975 -5.198 -2.391
173 HB3 GLN 27 2HB GLN 27 7.984 -5.643 -1.009
174 HG2 GLN 27 1HG GLN 27 9.521 -7.619 -0.700
175 HG3 GLN 27 2HG GLN 27 10.578 -6.865 -1.893
176 HE21 GLN 27 1HE2 GLN 27 10.735 -4.343 -1.343
177 HE22 GLN 27 2HE2 GLN 27 11.253 -4.035 0.276
178 H LEU 28 H LEU 28 7.452 -4.967 -4.180
179 HA LEU 28 HA LEU 28 4.883 -4.165 -3.445
180 HB2 LEU 28 1HB LEU 28 6.240 -2.637 -4.624
181 HB3 LEU 28 2HB LEU 28 6.485 -3.767 -5.954
182 HG LEU 28 HG LEU 28 4.227 -3.439 -6.718
183 HD11 LEU 28 1HD1 LEU 28 3.410 -3.082 -4.280
184 HD12 LEU 28 2HD1 LEU 28 2.577 -2.272 -5.606
185 HD13 LEU 28 3HD1 LEU 28 3.728 -1.379 -4.613
186 HD21 LEU 28 3HD2 LEU 28 5.427 -1.820 -7.765
187 HD22 LEU 28 1HD2 LEU 28 5.981 -1.096 -6.255
188 HD23 LEU 28 2HD2 LEU 28 4.345 -0.782 -6.835
189 H HIS 29 H HIS 29 5.866 -6.007 -6.338
190 HA HIS 29 HA HIS 29 3.288 -6.531 -7.283
191 HB2 HIS 29 1HB HIS 29 5.977 -7.744 -7.708
192 HB3 HIS 29 2HB HIS 29 4.571 -8.652 -8.256
193 HD1 HIS 29 HD1 HIS 29 5.453 -8.277 -10.710
194 HD2 HIS 29 HD2 HIS 29 4.319 -4.826 -8.695
195 HE1 HIS 29 HE1 HIS 29 5.239 -6.505 -12.481
196 H SER 30 H SER 30 5.137 -8.018 -4.749
197 HA SER 30 HA SER 30 3.474 -10.370 -4.586
198 HB2 SER 30 1HB SER 30 5.740 -10.677 -3.920
199 HB3 SER 30 2HB SER 30 5.689 -9.278 -2.848
200 HG SER 30 HG SER 30 4.177 -10.445 -1.562
201 H HIS 31 H HIS 31 3.398 -7.171 -3.374
202 HA HIS 31 HA HIS 31 1.633 -7.833 -1.155
203 HB2 HIS 31 1HB HIS 31 2.958 -6.104 -0.441
204 HB3 HIS 31 2HB HIS 31 3.105 -5.408 -2.052
205 HD1 HIS 31 HD1 HIS 31 0.843 -5.454 0.943
206 HD2 HIS 31 HD2 HIS 31 1.214 -3.478 -2.693
207 HE1 HIS 31 HE1 HIS 31 -0.783 -3.539 1.050
208 H GLN 32 H GLN 32 1.526 -6.107 -4.246
209 HA GLN 32 HA GLN 32 -1.006 -5.064 -4.201
210 HB2 GLN 32 1HB GLN 32 0.680 -6.196 -6.397
211 HB3 GLN 32 2HB GLN 32 -0.974 -5.714 -6.747
212 HG2 GLN 32 1HG GLN 32 -0.440 -3.463 -5.833
213 HG3 GLN 32 2HG GLN 32 1.240 -3.975 -5.691
214 HE21 GLN 32 1HE2 GLN 32 2.431 -3.199 -7.264
215 HE22 GLN 32 2HE2 GLN 32 1.951 -3.002 -8.912
216 H ARG 33 H ARG 33 -0.108 -8.372 -4.195
217 HA ARG 33 HA ARG 33 -2.318 -9.582 -5.389
218 HB2 ARG 33 1HB ARG 33 -0.955 -10.721 -2.961
219 HB3 ARG 33 2HB ARG 33 -1.650 -11.578 -4.331
220 HG2 ARG 33 1HG ARG 33 0.159 -10.511 -5.743
221 HG3 ARG 33 2HG ARG 33 0.911 -10.016 -4.225
222 HD2 ARG 33 1HD ARG 33 0.152 -12.871 -4.762
223 HD3 ARG 33 2HD ARG 33 1.697 -12.207 -5.292
224 HE ARG 33 HE ARG 33 1.657 -11.557 -2.685
225 HH11 ARG 33 1HH1 ARG 33 1.061 -14.547 -4.367
226 HH12 ARG 33 2HH1 ARG 33 1.625 -15.542 -3.066
227 HH21 ARG 33 1HH2 ARG 33 2.402 -12.857 -0.965
228 HH22 ARG 33 2HH2 ARG 33 2.387 -14.580 -1.131
229 H VAL 34 H VAL 34 -1.917 -8.187 -2.204
230 HA VAL 34 HA VAL 34 -4.140 -9.288 -0.917
231 HB VAL 34 HB VAL 34 -3.988 -7.514 0.666
232 HG11 VAL 34 1HG1 VAL 34 -2.159 -8.704 1.221
233 HG12 VAL 34 2HG1 VAL 34 -1.509 -8.670 -0.419
234 HG13 VAL 34 3HG1 VAL 34 -1.295 -7.279 0.646
235 HG21 VAL 34 3HG2 VAL 34 -2.874 -5.434 0.295
236 HG22 VAL 34 1HG2 VAL 34 -2.260 -5.978 -1.266
237 HG23 VAL 34 2HG2 VAL 34 -3.986 -5.689 -1.050
238 H HIS 35 H HIS 35 -3.873 -6.640 -3.192
239 HA HIS 35 HA HIS 35 -6.523 -5.644 -2.774
240 HB2 HIS 35 1HB HIS 35 -4.481 -5.207 -4.953
241 HB3 HIS 35 2HB HIS 35 -6.068 -4.443 -4.972
242 HD1 HIS 35 HD1 HIS 35 -6.543 -2.680 -3.074
243 HD2 HIS 35 HD2 HIS 35 -2.623 -4.043 -3.276
244 HE1 HIS 35 HE1 HIS 35 -5.196 -1.059 -1.702
245 H THR 36 H THR 36 -5.188 -8.270 -4.502
246 HA THR 36 HA THR 36 -7.520 -8.496 -6.258
247 HB THR 36 HB THR 36 -6.313 -10.277 -7.399
248 HG1 THR 36 HG1 THR 36 -4.296 -9.831 -5.431
249 HG21 THR 36 3HG2 THR 36 -5.830 -8.078 -8.203
250 HG22 THR 36 1HG2 THR 36 -4.307 -8.964 -8.148
251 HG23 THR 36 2HG2 THR 36 -4.688 -7.787 -6.892
252 H GLY 37 H GLY 37 -7.944 -8.870 -3.480
253 HA2 GLY 37 1HA GLY 37 -9.062 -11.550 -3.560
254 HA3 GLY 37 2HA GLY 37 -7.856 -11.279 -2.311
255 H GLU 38 H GLU 38 -8.422 -8.751 -1.458
256 HA GLU 38 HA GLU 38 -11.256 -8.777 -0.705
257 HB2 GLU 38 1HB GLU 38 -9.798 -9.898 1.053
258 HB3 GLU 38 2HB GLU 38 -9.070 -8.321 1.321
259 HG2 GLU 38 1HG GLU 38 -11.121 -7.404 2.076
260 HG3 GLU 38 2HG GLU 38 -12.022 -8.825 1.550
261 H LYS 39 H LYS 39 -12.175 -6.824 -0.763
262 HA LYS 39 HA LYS 39 -10.508 -4.534 -1.421
263 HB2 LYS 39 1HB LYS 39 -12.736 -5.222 -2.567
264 HB3 LYS 39 2HB LYS 39 -13.501 -4.465 -1.176
265 HG2 LYS 39 1HG LYS 39 -12.465 -2.353 -1.697
266 HG3 LYS 39 2HG LYS 39 -11.556 -3.091 -3.019
267 HD2 LYS 39 1HD LYS 39 -13.352 -2.061 -4.094
268 HD3 LYS 39 2HD LYS 39 -13.863 -3.745 -3.957
269 HE2 LYS 39 1HE LYS 39 -15.110 -3.139 -1.896
270 HE3 LYS 39 2HE LYS 39 -14.683 -1.452 -2.178
271 HZ1 LYS 39 3HZ LYS 39 -16.073 -1.303 -3.970
272 HZ2 LYS 39 1HZ LYS 39 -16.938 -2.405 -3.022
273 HZ3 LYS 39 2HZ LYS 39 -16.007 -2.956 -4.322
274 HA PRO 40 HA PRO 40 -10.528 -2.861 2.658
275 HB2 PRO 40 1HB PRO 40 -9.938 -0.285 2.034
276 HB3 PRO 40 2HB PRO 40 -8.743 -1.586 1.974
277 HG2 PRO 40 1HG PRO 40 -10.310 -0.351 -0.257
278 HG3 PRO 40 2HG PRO 40 -8.596 -0.801 -0.209
279 HD2 PRO 40 1HD PRO 40 -10.473 -2.341 -1.407
280 HD3 PRO 40 2HD PRO 40 -9.039 -3.026 -0.617
281 H SER 41 H SER 41 -11.576 -1.150 3.942
282 HA SER 41 HA SER 41 -14.334 -0.827 3.118
283 HB2 SER 41 1HB SER 41 -13.738 -1.527 5.433
284 HB3 SER 41 2HB SER 41 -12.993 0.051 5.686
285 HG SER 41 HG SER 41 -14.900 0.791 6.111
286 H GLY 42 H GLY 42 -15.440 1.284 3.449
287 HA2 GLY 42 1HA GLY 42 -14.244 3.751 3.661
288 HA3 GLY 42 2HA GLY 42 -14.084 3.319 1.966
289 HA PRO 43 HA PRO 43 -18.105 5.515 2.381
290 HB2 PRO 43 1HB PRO 43 -17.869 6.839 0.023
291 HB3 PRO 43 2HB PRO 43 -17.165 7.432 1.532
292 HG2 PRO 43 1HG PRO 43 -15.855 5.951 -0.716
293 HG3 PRO 43 2HG PRO 43 -15.259 7.346 0.202
294 HD2 PRO 43 1HD PRO 43 -14.434 4.815 0.698
295 HD3 PRO 43 2HD PRO 43 -14.566 6.044 1.973
296 H SER 44 H SER 44 -19.808 5.764 0.504
297 HA SER 44 HA SER 44 -20.399 3.115 -0.385
298 HB2 SER 44 1HB SER 44 -21.752 5.784 -0.741
299 HB3 SER 44 2HB SER 44 -22.350 4.333 -1.544
300 HG SER 44 HG SER 44 -23.407 4.224 0.310
301 H SER 45 H SER 45 -20.117 2.197 -2.331
302 HA SER 45 HA SER 45 -18.453 3.547 -4.255
303 HB2 SER 45 1HB SER 45 -18.375 1.422 -5.410
304 HB3 SER 45 2HB SER 45 -18.189 1.126 -3.681
305 HG SER 45 HG SER 45 -20.652 0.931 -5.076
306 H GLY 46 H GLY 46 -21.825 2.686 -3.940
307 HA2 GLY 46 1HA GLY 46 -22.836 4.553 -5.670
308 HA3 GLY 46 2HA GLY 46 -22.494 3.162 -6.688
Start of MODEL 14
1 H1 GLY 1 H GLY 1 -7.514 15.067 15.051
2 HA2 GLY 1 1HA GLY 1 -7.330 13.698 17.591
3 HA3 GLY 1 2HA GLY 1 -7.305 12.956 15.998
4 H SER 2 H SER 2 -5.450 12.068 15.405
5 HA SER 2 HA SER 2 -2.924 13.287 16.168
6 HB2 SER 2 1HB SER 2 -2.038 11.114 17.038
7 HB3 SER 2 2HB SER 2 -3.297 11.817 18.053
8 HG SER 2 HG SER 2 -4.353 10.036 17.779
9 H SER 3 H SER 3 -1.107 12.441 14.984
10 HA SER 3 HA SER 3 -1.720 10.678 12.739
11 HB2 SER 3 1HB SER 3 -0.476 13.409 12.337
12 HB3 SER 3 2HB SER 3 -0.822 12.217 11.084
13 HG SER 3 HG SER 3 -2.399 14.104 11.814
14 H GLY 4 H GLY 4 0.267 10.050 11.534
15 HA2 GLY 4 1HA GLY 4 2.598 10.039 13.352
16 HA3 GLY 4 2HA GLY 4 2.134 8.660 12.367
17 H SER 5 H SER 5 4.240 8.636 11.457
18 HA SER 5 HA SER 5 4.974 10.918 9.784
19 HB2 SER 5 1HB SER 5 7.145 9.849 9.564
20 HB3 SER 5 2HB SER 5 6.689 9.887 11.267
21 HG SER 5 HG SER 5 6.906 7.722 9.522
22 H SER 6 H SER 6 5.624 10.590 7.564
23 HA SER 6 HA SER 6 3.739 9.034 6.113
24 HB2 SER 6 1HB SER 6 4.973 9.830 4.110
25 HB3 SER 6 2HB SER 6 4.561 11.143 5.214
26 HG SER 6 HG SER 6 6.999 10.273 4.399
27 H GLY 7 H GLY 7 7.244 8.748 6.630
28 HA2 GLY 7 1HA GLY 7 7.399 6.023 6.826
29 HA3 GLY 7 2HA GLY 7 7.454 6.332 5.097
30 H SER 8 H SER 8 9.525 5.153 6.688
31 HA SER 8 HA SER 8 11.593 7.245 6.629
32 HB2 SER 8 1HB SER 8 11.667 4.543 7.994
33 HB3 SER 8 2HB SER 8 12.907 5.793 8.095
34 HG SER 8 HG SER 8 10.318 6.542 8.770
35 H GLY 9 H GLY 9 13.263 7.121 5.241
36 HA2 GLY 9 1HA GLY 9 14.818 6.093 3.820
37 HA3 GLY 9 2HA GLY 9 13.900 4.599 3.932
38 H GLU 10 H GLU 10 14.731 5.130 1.505
39 HA GLU 10 HA GLU 10 12.445 6.375 0.123
40 HB2 GLU 10 1HB GLU 10 15.367 6.316 -0.476
41 HB3 GLU 10 2HB GLU 10 14.242 6.347 -1.827
42 HG2 GLU 10 1HG GLU 10 14.697 8.581 -1.483
43 HG3 GLU 10 2HG GLU 10 13.181 8.354 -0.614
44 H LYS 11 H LYS 11 11.469 5.299 -1.569
45 HA LYS 11 HA LYS 11 12.439 2.621 -2.246
46 HB2 LYS 11 1HB LYS 11 9.714 3.280 -1.142
47 HB3 LYS 11 2HB LYS 11 10.012 1.827 -2.087
48 HG2 LYS 11 1HG LYS 11 11.463 0.941 -0.463
49 HG3 LYS 11 2HG LYS 11 11.598 2.490 0.374
50 HD2 LYS 11 1HD LYS 11 8.915 1.211 0.102
51 HD3 LYS 11 2HD LYS 11 10.045 0.589 1.307
52 HE2 LYS 11 1HE LYS 11 9.473 3.522 1.125
53 HE3 LYS 11 2HE LYS 11 8.365 2.447 1.976
54 HZ1 LYS 11 3HZ LYS 11 11.225 2.313 2.613
55 HZ2 LYS 11 1HZ LYS 11 9.887 2.013 3.603
56 HZ3 LYS 11 2HZ LYS 11 10.321 3.603 3.227
57 HA PRO 12 HA PRO 12 11.452 4.341 -6.238
58 HB2 PRO 12 1HB PRO 12 12.290 2.194 -7.673
59 HB3 PRO 12 2HB PRO 12 13.403 3.372 -6.968
60 HG2 PRO 12 1HG PRO 12 12.601 0.676 -5.945
61 HG3 PRO 12 2HG PRO 12 14.210 1.420 -5.996
62 HD2 PRO 12 1HD PRO 12 12.710 1.344 -3.742
63 HD3 PRO 12 2HD PRO 12 13.826 2.677 -4.102
64 H PHE 13 H PHE 13 10.309 1.326 -4.914
65 HA PHE 13 HA PHE 13 8.242 1.116 -6.978
66 HB2 PHE 13 1HB PHE 13 8.869 -0.812 -4.734
67 HB3 PHE 13 2HB PHE 13 7.809 -1.105 -6.109
68 HD1 PHE 13 HD2 PHE 13 8.718 -1.545 -8.310
69 HD2 PHE 13 HD1 PHE 13 11.267 -0.868 -4.970
70 HE1 PHE 13 HE2 PHE 13 10.620 -2.448 -9.583
71 HE2 PHE 13 HE1 PHE 13 13.174 -1.769 -6.238
72 HZ PHE 13 HZ PHE 13 12.851 -2.562 -8.547
73 H LYS 14 H LYS 14 6.157 1.577 -6.607
74 HA LYS 14 HA LYS 14 5.237 1.910 -3.844
75 HB2 LYS 14 1HB LYS 14 5.834 4.144 -4.557
76 HB3 LYS 14 2HB LYS 14 4.926 3.951 -6.051
77 HG2 LYS 14 1HG LYS 14 2.895 3.591 -4.499
78 HG3 LYS 14 2HG LYS 14 3.914 4.335 -3.264
79 HD2 LYS 14 1HD LYS 14 4.259 6.256 -4.840
80 HD3 LYS 14 2HD LYS 14 3.038 5.532 -5.889
81 HE2 LYS 14 1HE LYS 14 1.399 5.676 -4.082
82 HE3 LYS 14 2HE LYS 14 2.621 6.377 -3.022
83 HZ1 LYS 14 3HZ LYS 14 1.950 7.652 -5.596
84 HZ2 LYS 14 1HZ LYS 14 2.647 8.343 -4.219
85 HZ3 LYS 14 2HZ LYS 14 1.005 7.937 -4.222
86 H CYS 15 H CYS 15 3.307 1.011 -3.494
87 HA CYS 15 HA CYS 15 1.951 -0.338 -5.619
88 HB2 CYS 15 1HB CYS 15 2.105 -1.208 -3.282
89 HB3 CYS 15 2HB CYS 15 1.026 0.086 -2.771
90 H GLU 16 H GLU 16 0.883 0.864 -7.070
91 HA GLU 16 HA GLU 16 -0.338 3.348 -6.542
92 HB2 GLU 16 1HB GLU 16 -0.912 1.412 -8.793
93 HB3 GLU 16 2HB GLU 16 -1.350 3.115 -8.761
94 HG2 GLU 16 1HG GLU 16 1.101 3.632 -8.572
95 HG3 GLU 16 2HG GLU 16 1.405 1.927 -8.896
96 H GLU 17 H GLU 17 -1.409 0.101 -6.108
97 HA GLU 17 HA GLU 17 -4.175 0.385 -6.263
98 HB2 GLU 17 1HB GLU 17 -2.703 -1.353 -4.280
99 HB3 GLU 17 2HB GLU 17 -4.326 -1.601 -4.910
100 HG2 GLU 17 1HG GLU 17 -3.060 -1.655 -7.215
101 HG3 GLU 17 2HG GLU 17 -1.694 -2.097 -6.192
102 H CYS 18 H CYS 18 -2.052 0.748 -3.427
103 HA CYS 18 HA CYS 18 -4.199 2.307 -2.142
104 HB2 CYS 18 1HB CYS 18 -3.338 1.524 0.030
105 HB3 CYS 18 2HB CYS 18 -3.874 0.185 -0.980
106 H GLY 19 H GLY 19 -0.720 1.913 -2.601
107 HA2 GLY 19 1HA GLY 19 0.401 4.104 -3.112
108 HA3 GLY 19 2HA GLY 19 -0.361 4.684 -1.639
109 H LYS 20 H LYS 20 0.654 1.450 -1.464
110 HA LYS 20 HA LYS 20 2.486 1.957 0.617
111 HB2 LYS 20 1HB LYS 20 1.621 -0.417 -0.938
112 HB3 LYS 20 2HB LYS 20 3.166 -0.540 -0.108
113 HG2 LYS 20 1HG LYS 20 1.721 0.416 1.904
114 HG3 LYS 20 2HG LYS 20 0.425 -0.363 0.994
115 HD2 LYS 20 1HD LYS 20 1.663 -2.468 1.021
116 HD3 LYS 20 2HD LYS 20 2.979 -1.691 1.905
117 HE2 LYS 20 1HE LYS 20 0.145 -1.857 2.915
118 HE3 LYS 20 2HE LYS 20 1.395 -3.034 3.314
119 HZ1 LYS 20 3HZ LYS 20 1.692 -1.650 5.050
120 HZ2 LYS 20 1HZ LYS 20 1.051 -0.303 4.251
121 HZ3 LYS 20 2HZ LYS 20 2.644 -0.787 3.950
122 H ARG 21 H ARG 21 4.749 0.678 0.378
123 HA ARG 21 HA ARG 21 6.068 1.375 -2.123
124 HB2 ARG 21 1HB ARG 21 6.940 2.496 0.547
125 HB3 ARG 21 2HB ARG 21 7.858 2.618 -0.949
126 HG2 ARG 21 1HG ARG 21 5.686 3.736 -1.859
127 HG3 ARG 21 2HG ARG 21 5.346 4.006 -0.149
128 HD2 ARG 21 1HD ARG 21 7.935 4.795 -1.468
129 HD3 ARG 21 2HD ARG 21 6.548 5.876 -1.337
130 HE ARG 21 HE ARG 21 8.356 5.100 0.770
131 HH11 ARG 21 1HH1 ARG 21 5.209 6.367 -0.014
132 HH12 ARG 21 2HH1 ARG 21 4.996 7.145 1.519
133 HH21 ARG 21 1HH2 ARG 21 8.088 6.120 2.792
134 HH22 ARG 21 2HH2 ARG 21 6.635 7.005 3.115
135 H PHE 22 H PHE 22 8.264 0.506 -2.258
136 HA PHE 22 HA PHE 22 9.125 -1.393 -0.274
137 HB2 PHE 22 1HB PHE 22 8.449 -2.486 -3.004
138 HB3 PHE 22 2HB PHE 22 8.925 -3.384 -1.567
139 HD1 PHE 22 HD2 PHE 22 6.218 -1.294 -2.991
140 HD2 PHE 22 HD1 PHE 22 7.323 -4.187 -0.070
141 HE1 PHE 22 HE2 PHE 22 3.848 -1.606 -2.407
142 HE2 PHE 22 HE1 PHE 22 4.955 -4.503 0.517
143 HZ PHE 22 HZ PHE 22 3.214 -3.211 -0.651
144 H THR 23 H THR 23 11.237 -2.206 -0.665
145 HA THR 23 HA THR 23 12.875 -0.396 -2.182
146 HB THR 23 HB THR 23 13.575 -1.330 0.026
147 HG1 THR 23 HG1 THR 23 15.110 -1.424 -2.308
148 HG21 THR 23 3HG2 THR 23 14.347 -3.849 -1.393
149 HG22 THR 23 1HG2 THR 23 12.738 -3.692 -0.690
150 HG23 THR 23 2HG2 THR 23 14.166 -3.550 0.335
151 H GLN 24 H GLN 24 11.323 -3.352 -2.819
152 HA GLN 24 HA GLN 24 12.759 -3.567 -5.360
153 HB2 GLN 24 1HB GLN 24 12.651 -5.610 -3.218
154 HB3 GLN 24 2HB GLN 24 12.388 -6.191 -4.857
155 HG2 GLN 24 1HG GLN 24 14.812 -4.882 -3.692
156 HG3 GLN 24 2HG GLN 24 14.674 -6.432 -4.521
157 HE21 GLN 24 1HE2 GLN 24 13.178 -5.605 -6.730
158 HE22 GLN 24 2HE2 GLN 24 14.168 -4.587 -7.713
159 H ASN 25 H ASN 25 11.583 -4.701 -7.013
160 HA ASN 25 HA ASN 25 8.811 -4.109 -6.993
161 HB2 ASN 25 1HB ASN 25 9.019 -5.722 -9.133
162 HB3 ASN 25 2HB ASN 25 9.550 -4.043 -9.150
163 HD21 ASN 25 1HD2 ASN 25 10.770 -7.255 -8.265
164 HD22 ASN 25 2HD2 ASN 25 12.350 -7.022 -8.924
165 H SER 26 H SER 26 10.667 -7.053 -6.494
166 HA SER 26 HA SER 26 8.647 -8.949 -6.676
167 HB2 SER 26 1HB SER 26 11.127 -8.853 -4.955
168 HB3 SER 26 2HB SER 26 10.067 -10.261 -5.015
169 HG SER 26 HG SER 26 10.426 -10.227 -7.336
170 H GLN 27 H GLN 27 9.445 -6.745 -4.071
171 HA GLN 27 HA GLN 27 7.727 -7.975 -2.141
172 HB2 GLN 27 1HB GLN 27 9.038 -5.257 -2.242
173 HB3 GLN 27 2HB GLN 27 8.089 -5.831 -0.877
174 HG2 GLN 27 1HG GLN 27 9.678 -7.778 -0.738
175 HG3 GLN 27 2HG GLN 27 10.686 -6.929 -1.909
176 HE21 GLN 27 1HE2 GLN 27 10.533 -4.359 -1.107
177 HE22 GLN 27 2HE2 GLN 27 11.200 -4.177 0.476
178 H LEU 28 H LEU 28 7.499 -5.021 -4.114
179 HA LEU 28 HA LEU 28 4.951 -4.235 -3.272
180 HB2 LEU 28 1HB LEU 28 6.239 -2.660 -4.446
181 HB3 LEU 28 2HB LEU 28 6.505 -3.762 -5.795
182 HG LEU 28 HG LEU 28 4.183 -3.501 -6.486
183 HD11 LEU 28 1HD1 LEU 28 3.530 -2.964 -3.995
184 HD12 LEU 28 2HD1 LEU 28 2.586 -2.332 -5.343
185 HD13 LEU 28 3HD1 LEU 28 3.762 -1.300 -4.530
186 HD21 LEU 28 3HD2 LEU 28 4.277 -1.101 -7.114
187 HD22 LEU 28 1HD2 LEU 28 5.773 -1.976 -7.442
188 HD23 LEU 28 2HD2 LEU 28 5.663 -0.913 -6.038
189 H HIS 29 H HIS 29 5.852 -5.985 -6.249
190 HA HIS 29 HA HIS 29 3.283 -6.490 -7.175
191 HB2 HIS 29 1HB HIS 29 5.916 -7.872 -7.543
192 HB3 HIS 29 2HB HIS 29 4.454 -8.599 -8.200
193 HD1 HIS 29 HD1 HIS 29 6.763 -7.550 -10.003
194 HD2 HIS 29 HD2 HIS 29 3.338 -5.406 -9.035
195 HE1 HIS 29 HE1 HIS 29 6.496 -5.846 -11.834
196 H SER 30 H SER 30 5.094 -8.035 -4.640
197 HA SER 30 HA SER 30 3.405 -10.353 -4.475
198 HB2 SER 30 1HB SER 30 5.759 -10.434 -3.750
199 HB3 SER 30 2HB SER 30 5.408 -9.259 -2.483
200 HG SER 30 HG SER 30 4.196 -10.747 -1.426
201 H HIS 31 H HIS 31 3.419 -7.156 -3.142
202 HA HIS 31 HA HIS 31 1.496 -7.802 -1.067
203 HB2 HIS 31 1HB HIS 31 2.878 -6.135 -0.280
204 HB3 HIS 31 2HB HIS 31 3.043 -5.378 -1.861
205 HD1 HIS 31 HD1 HIS 31 0.791 -5.495 1.132
206 HD2 HIS 31 HD2 HIS 31 1.142 -3.430 -2.456
207 HE1 HIS 31 HE1 HIS 31 -0.827 -3.578 1.299
208 H GLN 32 H GLN 32 1.587 -6.130 -4.174
209 HA GLN 32 HA GLN 32 -0.907 -4.965 -4.223
210 HB2 GLN 32 1HB GLN 32 0.801 -6.177 -6.369
211 HB3 GLN 32 2HB GLN 32 -0.793 -5.548 -6.760
212 HG2 GLN 32 1HG GLN 32 -0.146 -3.360 -5.892
213 HG3 GLN 32 2HG GLN 32 1.453 -3.991 -5.498
214 HE21 GLN 32 1HE2 GLN 32 1.689 -1.940 -6.970
215 HE22 GLN 32 2HE2 GLN 32 1.945 -2.293 -8.642
216 H ARG 33 H ARG 33 -0.094 -8.318 -4.317
217 HA ARG 33 HA ARG 33 -2.364 -9.381 -5.557
218 HB2 ARG 33 1HB ARG 33 -1.039 -10.754 -3.242
219 HB3 ARG 33 2HB ARG 33 -1.703 -11.456 -4.711
220 HG2 ARG 33 1HG ARG 33 0.160 -10.312 -5.962
221 HG3 ARG 33 2HG ARG 33 0.869 -9.939 -4.390
222 HD2 ARG 33 1HD ARG 33 1.757 -12.009 -5.495
223 HD3 ARG 33 2HD ARG 33 1.125 -12.242 -3.866
224 HE ARG 33 HE ARG 33 -0.007 -13.254 -6.343
225 HH11 ARG 33 1HH1 ARG 33 -0.390 -12.727 -2.923
226 HH12 ARG 33 2HH1 ARG 33 -1.641 -13.913 -2.748
227 HH21 ARG 33 1HH2 ARG 33 -1.653 -14.818 -6.125
228 HH22 ARG 33 2HH2 ARG 33 -2.358 -15.102 -4.570
229 H VAL 34 H VAL 34 -1.870 -8.131 -2.340
230 HA VAL 34 HA VAL 34 -4.077 -9.274 -1.042
231 HB VAL 34 HB VAL 34 -3.878 -7.522 0.599
232 HG11 VAL 34 1HG1 VAL 34 -2.169 -8.925 1.099
233 HG12 VAL 34 2HG1 VAL 34 -1.438 -8.784 -0.501
234 HG13 VAL 34 3HG1 VAL 34 -1.206 -7.505 0.691
235 HG21 VAL 34 3HG2 VAL 34 -2.949 -5.988 -1.661
236 HG22 VAL 34 1HG2 VAL 34 -3.530 -5.436 -0.089
237 HG23 VAL 34 2HG2 VAL 34 -1.830 -5.857 -0.304
238 H HIS 35 H HIS 35 -3.867 -6.746 -3.384
239 HA HIS 35 HA HIS 35 -6.485 -5.662 -2.789
240 HB2 HIS 35 1HB HIS 35 -4.439 -5.092 -4.929
241 HB3 HIS 35 2HB HIS 35 -6.036 -4.349 -4.937
242 HD1 HIS 35 HD1 HIS 35 -6.585 -2.774 -2.854
243 HD2 HIS 35 HD2 HIS 35 -2.608 -3.900 -3.275
244 HE1 HIS 35 HE1 HIS 35 -5.279 -1.182 -1.410
245 H THR 36 H THR 36 -5.061 -8.001 -4.926
246 HA THR 36 HA THR 36 -7.335 -8.141 -6.693
247 HB THR 36 HB THR 36 -6.194 -9.918 -7.816
248 HG1 THR 36 HG1 THR 36 -4.147 -10.682 -6.811
249 HG21 THR 36 3HG2 THR 36 -3.899 -8.207 -6.942
250 HG22 THR 36 1HG2 THR 36 -5.242 -7.492 -7.833
251 HG23 THR 36 2HG2 THR 36 -4.302 -8.799 -8.553
252 H GLY 37 H GLY 37 -8.299 -8.425 -4.169
253 HA2 GLY 37 1HA GLY 37 -9.661 -10.915 -4.325
254 HA3 GLY 37 2HA GLY 37 -8.445 -10.961 -3.058
255 H GLU 38 H GLU 38 -8.623 -8.321 -2.144
256 HA GLU 38 HA GLU 38 -10.768 -8.524 -0.338
257 HB2 GLU 38 1HB GLU 38 -10.113 -6.357 0.461
258 HB3 GLU 38 2HB GLU 38 -8.657 -7.259 0.066
259 HG2 GLU 38 1HG GLU 38 -8.181 -5.956 -1.771
260 HG3 GLU 38 2HG GLU 38 -9.854 -5.432 -1.964
261 H LYS 39 H LYS 39 -10.589 -7.285 -3.530
262 HA LYS 39 HA LYS 39 -13.185 -5.933 -3.214
263 HB2 LYS 39 1HB LYS 39 -12.669 -4.708 -5.241
264 HB3 LYS 39 2HB LYS 39 -11.345 -4.535 -4.096
265 HG2 LYS 39 1HG LYS 39 -9.997 -6.086 -5.310
266 HG3 LYS 39 2HG LYS 39 -11.348 -6.514 -6.363
267 HD2 LYS 39 1HD LYS 39 -10.270 -5.027 -7.720
268 HD3 LYS 39 2HD LYS 39 -11.318 -3.909 -6.844
269 HE2 LYS 39 1HE LYS 39 -9.530 -3.318 -5.352
270 HE3 LYS 39 2HE LYS 39 -8.486 -4.560 -6.042
271 HZ1 LYS 39 3HZ LYS 39 -8.751 -1.913 -6.853
272 HZ2 LYS 39 1HZ LYS 39 -9.396 -2.865 -8.095
273 HZ3 LYS 39 2HZ LYS 39 -7.811 -3.126 -7.566
274 HA PRO 40 HA PRO 40 -15.118 -9.178 -5.484
275 HB2 PRO 40 1HB PRO 40 -17.332 -7.838 -6.305
276 HB3 PRO 40 2HB PRO 40 -17.100 -8.378 -4.638
277 HG2 PRO 40 1HG PRO 40 -16.665 -5.666 -5.829
278 HG3 PRO 40 2HG PRO 40 -17.422 -6.103 -4.286
279 HD2 PRO 40 1HD PRO 40 -14.869 -5.218 -4.457
280 HD3 PRO 40 2HD PRO 40 -15.394 -6.385 -3.227
281 H SER 41 H SER 41 -14.628 -6.017 -6.968
282 HA SER 41 HA SER 41 -13.811 -7.240 -9.438
283 HB2 SER 41 1HB SER 41 -16.370 -7.099 -9.530
284 HB3 SER 41 2HB SER 41 -16.156 -5.350 -9.614
285 HG SER 41 HG SER 41 -15.899 -5.678 -11.668
286 H GLY 42 H GLY 42 -13.225 -5.508 -11.085
287 HA2 GLY 42 1HA GLY 42 -12.825 -2.831 -10.168
288 HA3 GLY 42 2HA GLY 42 -11.346 -3.775 -10.066
289 HA PRO 43 HA PRO 43 -12.712 -3.130 -14.708
290 HB2 PRO 43 1HB PRO 43 -13.821 -0.684 -15.102
291 HB3 PRO 43 2HB PRO 43 -14.780 -2.131 -14.773
292 HG2 PRO 43 1HG PRO 43 -13.932 0.046 -12.901
293 HG3 PRO 43 2HG PRO 43 -15.505 -0.761 -13.039
294 HD2 PRO 43 1HD PRO 43 -13.701 -1.404 -11.125
295 HD3 PRO 43 2HD PRO 43 -14.810 -2.597 -11.830
296 H SER 44 H SER 44 -11.093 -2.470 -15.997
297 HA SER 44 HA SER 44 -9.026 -0.803 -14.934
298 HB2 SER 44 1HB SER 44 -8.539 -2.734 -16.397
299 HB3 SER 44 2HB SER 44 -9.350 -1.916 -17.732
300 HG SER 44 HG SER 44 -7.184 -0.744 -16.345
301 H SER 45 H SER 45 -9.301 1.327 -14.801
302 HA SER 45 HA SER 45 -10.493 2.725 -17.106
303 HB2 SER 45 1HB SER 45 -11.255 4.455 -15.557
304 HB3 SER 45 2HB SER 45 -11.864 2.879 -15.050
305 HG SER 45 HG SER 45 -9.689 3.006 -13.772
306 H GLY 46 H GLY 46 -9.631 4.821 -17.624
307 HA2 GLY 46 1HA GLY 46 -7.817 6.449 -16.862
308 HA3 GLY 46 2HA GLY 46 -6.779 5.032 -16.904
Start of MODEL 15
1 H1 GLY 1 H GLY 1 5.783 14.014 18.382
2 HA2 GLY 1 1HA GLY 1 3.779 13.279 16.370
3 HA3 GLY 1 2HA GLY 1 4.645 14.794 16.162
4 H SER 2 H SER 2 6.415 14.725 14.956
5 HA SER 2 HA SER 2 7.510 12.126 14.221
6 HB2 SER 2 1HB SER 2 8.745 13.397 12.488
7 HB3 SER 2 2HB SER 2 7.007 13.681 12.409
8 HG SER 2 HG SER 2 7.789 15.684 12.352
9 H SER 3 H SER 3 8.566 11.653 16.206
10 HA SER 3 HA SER 3 11.264 12.637 16.306
11 HB2 SER 3 1HB SER 3 11.252 13.625 18.459
12 HB3 SER 3 2HB SER 3 9.858 14.320 17.631
13 HG SER 3 HG SER 3 9.964 12.606 19.798
14 H GLY 4 H GLY 4 12.497 10.932 16.718
15 HA2 GLY 4 1HA GLY 4 12.936 9.253 18.572
16 HA3 GLY 4 2HA GLY 4 11.307 8.691 18.228
17 H SER 5 H SER 5 10.926 8.042 15.900
18 HA SER 5 HA SER 5 13.118 6.294 15.104
19 HB2 SER 5 1HB SER 5 11.501 5.093 13.805
20 HB3 SER 5 2HB SER 5 10.747 5.457 15.357
21 HG SER 5 HG SER 5 9.595 5.912 13.217
22 H SER 6 H SER 6 14.357 6.604 13.365
23 HA SER 6 HA SER 6 14.635 8.971 12.046
24 HB2 SER 6 1HB SER 6 15.188 6.197 10.967
25 HB3 SER 6 2HB SER 6 15.793 7.688 10.244
26 HG SER 6 HG SER 6 16.334 6.758 12.872
27 H GLY 7 H GLY 7 12.789 6.161 10.856
28 HA2 GLY 7 1HA GLY 7 10.543 6.763 9.932
29 HA3 GLY 7 2HA GLY 7 11.386 8.008 9.023
30 H SER 8 H SER 8 10.872 7.290 6.994
31 HA SER 8 HA SER 8 11.839 4.602 6.270
32 HB2 SER 8 1HB SER 8 9.759 6.272 4.838
33 HB3 SER 8 2HB SER 8 10.232 4.621 4.440
34 HG SER 8 HG SER 8 9.380 5.106 7.045
35 H GLY 9 H GLY 9 13.344 4.384 4.706
36 HA2 GLY 9 1HA GLY 9 14.831 6.674 3.898
37 HA3 GLY 9 2HA GLY 9 15.092 5.024 3.352
38 H GLU 10 H GLU 10 14.856 4.743 1.246
39 HA GLU 10 HA GLU 10 12.836 6.347 -0.169
40 HB2 GLU 10 1HB GLU 10 15.657 5.749 -1.069
41 HB3 GLU 10 2HB GLU 10 14.412 6.414 -2.118
42 HG2 GLU 10 1HG GLU 10 15.033 7.802 0.439
43 HG3 GLU 10 2HG GLU 10 16.142 7.967 -0.921
44 H LYS 11 H LYS 11 11.673 5.309 -1.735
45 HA LYS 11 HA LYS 11 12.408 2.572 -2.456
46 HB2 LYS 11 1HB LYS 11 9.709 3.347 -1.333
47 HB3 LYS 11 2HB LYS 11 10.107 1.779 -2.022
48 HG2 LYS 11 1HG LYS 11 11.849 1.525 -0.257
49 HG3 LYS 11 2HG LYS 11 11.242 3.011 0.478
50 HD2 LYS 11 1HD LYS 11 8.934 1.706 0.281
51 HD3 LYS 11 2HD LYS 11 10.012 0.310 0.341
52 HE2 LYS 11 1HE LYS 11 10.739 0.797 2.475
53 HE3 LYS 11 2HE LYS 11 10.348 2.510 2.329
54 HZ1 LYS 11 3HZ LYS 11 8.278 2.173 3.056
55 HZ2 LYS 11 1HZ LYS 11 8.854 0.693 3.640
56 HZ3 LYS 11 2HZ LYS 11 8.064 0.763 2.146
57 HA PRO 12 HA PRO 12 11.210 4.473 -6.331
58 HB2 PRO 12 1HB PRO 12 12.051 2.410 -7.883
59 HB3 PRO 12 2HB PRO 12 13.155 3.608 -7.197
60 HG2 PRO 12 1HG PRO 12 12.512 0.849 -6.229
61 HG3 PRO 12 2HG PRO 12 14.086 1.658 -6.338
62 HD2 PRO 12 1HD PRO 12 12.716 1.447 -4.013
63 HD3 PRO 12 2HD PRO 12 13.759 2.835 -4.384
64 H PHE 13 H PHE 13 10.216 1.422 -5.003
65 HA PHE 13 HA PHE 13 8.089 1.141 -6.996
66 HB2 PHE 13 1HB PHE 13 8.835 -0.748 -4.755
67 HB3 PHE 13 2HB PHE 13 7.745 -1.082 -6.097
68 HD1 PHE 13 HD1 PHE 13 11.238 -0.674 -5.087
69 HD2 PHE 13 HD2 PHE 13 8.590 -1.586 -8.292
70 HE1 PHE 13 HE1 PHE 13 13.132 -1.535 -6.402
71 HE2 PHE 13 HE2 PHE 13 10.479 -2.448 -9.611
72 HZ PHE 13 HZ PHE 13 12.753 -2.425 -8.667
73 H LYS 14 H LYS 14 6.046 1.678 -6.581
74 HA LYS 14 HA LYS 14 5.173 1.945 -3.792
75 HB2 LYS 14 1HB LYS 14 5.752 4.190 -4.508
76 HB3 LYS 14 2HB LYS 14 4.787 4.008 -5.967
77 HG2 LYS 14 1HG LYS 14 2.793 3.687 -4.431
78 HG3 LYS 14 2HG LYS 14 3.841 4.255 -3.130
79 HD2 LYS 14 1HD LYS 14 4.283 6.304 -4.510
80 HD3 LYS 14 2HD LYS 14 3.031 5.746 -5.622
81 HE2 LYS 14 1HE LYS 14 1.340 6.172 -4.147
82 HE3 LYS 14 2HE LYS 14 2.357 5.900 -2.733
83 HZ1 LYS 14 3HZ LYS 14 1.970 8.332 -4.303
84 HZ2 LYS 14 1HZ LYS 14 3.512 8.065 -3.661
85 HZ3 LYS 14 2HZ LYS 14 2.170 8.143 -2.634
86 H CYS 15 H CYS 15 3.249 1.044 -3.410
87 HA CYS 15 HA CYS 15 1.862 -0.309 -5.508
88 HB2 CYS 15 1HB CYS 15 2.045 -1.162 -3.166
89 HB3 CYS 15 2HB CYS 15 0.968 0.134 -2.653
90 H GLU 16 H GLU 16 1.005 1.123 -6.965
91 HA GLU 16 HA GLU 16 -0.288 3.521 -6.408
92 HB2 GLU 16 1HB GLU 16 -1.262 1.858 -8.684
93 HB3 GLU 16 2HB GLU 16 -0.880 3.573 -8.633
94 HG2 GLU 16 1HG GLU 16 0.871 2.851 -9.871
95 HG3 GLU 16 2HG GLU 16 1.568 2.651 -8.264
96 H GLU 17 H GLU 17 -1.382 0.275 -6.030
97 HA GLU 17 HA GLU 17 -4.149 0.598 -6.197
98 HB2 GLU 17 1HB GLU 17 -2.729 -1.224 -4.254
99 HB3 GLU 17 2HB GLU 17 -4.333 -1.437 -4.942
100 HG2 GLU 17 1HG GLU 17 -3.035 -1.445 -7.209
101 HG3 GLU 17 2HG GLU 17 -1.664 -1.870 -6.186
102 H CYS 18 H CYS 18 -2.054 0.773 -3.319
103 HA CYS 18 HA CYS 18 -4.185 2.309 -1.981
104 HB2 CYS 18 1HB CYS 18 -3.381 1.446 0.142
105 HB3 CYS 18 2HB CYS 18 -3.740 0.104 -0.941
106 H GLY 19 H GLY 19 -0.698 1.968 -2.456
107 HA2 GLY 19 1HA GLY 19 0.383 4.195 -2.926
108 HA3 GLY 19 2HA GLY 19 -0.371 4.718 -1.427
109 H LYS 20 H LYS 20 0.693 1.495 -1.367
110 HA LYS 20 HA LYS 20 2.563 1.989 0.696
111 HB2 LYS 20 1HB LYS 20 1.639 -0.373 -0.841
112 HB3 LYS 20 2HB LYS 20 3.214 -0.509 -0.071
113 HG2 LYS 20 1HG LYS 20 1.852 0.441 2.001
114 HG3 LYS 20 2HG LYS 20 0.518 -0.325 1.136
115 HD2 LYS 20 1HD LYS 20 1.368 -2.434 1.414
116 HD3 LYS 20 2HD LYS 20 3.038 -1.867 1.496
117 HE2 LYS 20 1HE LYS 20 2.241 -2.710 3.660
118 HE3 LYS 20 2HE LYS 20 2.661 -0.999 3.729
119 HZ1 LYS 20 3HZ LYS 20 -0.109 -1.994 3.356
120 HZ2 LYS 20 1HZ LYS 20 0.377 -0.405 3.676
121 HZ3 LYS 20 2HZ LYS 20 0.547 -1.597 4.864
122 H ARG 21 H ARG 21 4.823 0.753 0.422
123 HA ARG 21 HA ARG 21 6.081 1.409 -2.121
124 HB2 ARG 21 1HB ARG 21 7.038 2.579 0.498
125 HB3 ARG 21 2HB ARG 21 7.863 2.719 -1.048
126 HG2 ARG 21 1HG ARG 21 5.608 3.776 -1.829
127 HG3 ARG 21 2HG ARG 21 5.373 4.050 -0.101
128 HD2 ARG 21 1HD ARG 21 7.849 4.970 -0.289
129 HD3 ARG 21 2HD ARG 21 7.366 5.227 -1.965
130 HE ARG 21 HE ARG 21 5.530 6.251 0.023
131 HH11 ARG 21 1HH1 ARG 21 8.248 6.909 -2.051
132 HH12 ARG 21 2HH1 ARG 21 8.002 8.624 -2.047
133 HH21 ARG 21 1HH2 ARG 21 5.196 8.507 0.035
134 HH22 ARG 21 2HH2 ARG 21 6.266 9.532 -0.859
135 H PHE 22 H PHE 22 8.198 0.477 -2.364
136 HA PHE 22 HA PHE 22 9.144 -1.351 -0.330
137 HB2 PHE 22 1HB PHE 22 8.450 -2.490 -3.035
138 HB3 PHE 22 2HB PHE 22 8.928 -3.360 -1.580
139 HD1 PHE 22 HD2 PHE 22 6.215 -1.340 -3.080
140 HD2 PHE 22 HD1 PHE 22 7.331 -4.093 -0.032
141 HE1 PHE 22 HE2 PHE 22 3.846 -1.641 -2.490
142 HE2 PHE 22 HE1 PHE 22 4.963 -4.399 0.564
143 HZ PHE 22 HZ PHE 22 3.217 -3.171 -0.665
144 H THR 23 H THR 23 11.262 -2.117 -0.714
145 HA THR 23 HA THR 23 12.830 -0.348 -2.370
146 HB THR 23 HB THR 23 13.599 -1.001 -0.108
147 HG1 THR 23 HG1 THR 23 15.107 -0.395 -1.787
148 HG21 THR 23 3HG2 THR 23 13.465 -3.707 -1.333
149 HG22 THR 23 1HG2 THR 23 13.099 -3.194 0.313
150 HG23 THR 23 2HG2 THR 23 14.776 -3.379 -0.201
151 H GLN 24 H GLN 24 11.310 -3.315 -2.813
152 HA GLN 24 HA GLN 24 12.852 -3.773 -5.258
153 HB2 GLN 24 1HB GLN 24 12.594 -5.623 -2.964
154 HB3 GLN 24 2HB GLN 24 12.366 -6.337 -4.555
155 HG2 GLN 24 1HG GLN 24 14.724 -4.588 -4.165
156 HG3 GLN 24 2HG GLN 24 14.740 -6.171 -3.391
157 HE21 GLN 24 1HE2 GLN 24 13.400 -5.100 -6.487
158 HE22 GLN 24 2HE2 GLN 24 14.319 -6.192 -7.461
159 H ASN 25 H ASN 25 11.703 -4.779 -6.932
160 HA ASN 25 HA ASN 25 8.975 -4.174 -7.089
161 HB2 ASN 25 1HB ASN 25 9.058 -5.735 -9.128
162 HB3 ASN 25 2HB ASN 25 10.124 -4.333 -9.140
163 HD21 ASN 25 1HD2 ASN 25 12.351 -4.642 -8.719
164 HD22 ASN 25 2HD2 ASN 25 13.097 -6.177 -8.987
165 H SER 26 H SER 26 10.566 -7.342 -6.733
166 HA SER 26 HA SER 26 8.457 -9.038 -6.681
167 HB2 SER 26 1HB SER 26 10.643 -9.941 -6.395
168 HB3 SER 26 2HB SER 26 10.906 -9.019 -4.915
169 HG SER 26 HG SER 26 8.715 -10.703 -4.893
170 H GLN 27 H GLN 27 9.502 -6.955 -4.019
171 HA GLN 27 HA GLN 27 7.691 -7.897 -2.088
172 HB2 GLN 27 1HB GLN 27 9.015 -5.203 -2.411
173 HB3 GLN 27 2HB GLN 27 8.073 -5.662 -0.999
174 HG2 GLN 27 1HG GLN 27 9.658 -7.610 -0.735
175 HG3 GLN 27 2HG GLN 27 10.666 -6.833 -1.955
176 HE21 GLN 27 1HE2 GLN 27 10.595 -4.243 -1.348
177 HE22 GLN 27 2HE2 GLN 27 11.223 -3.951 0.234
178 H LEU 28 H LEU 28 7.486 -4.979 -4.131
179 HA LEU 28 HA LEU 28 4.913 -4.214 -3.381
180 HB2 LEU 28 1HB LEU 28 6.298 -2.694 -4.579
181 HB3 LEU 28 2HB LEU 28 6.441 -3.804 -5.940
182 HG LEU 28 HG LEU 28 4.115 -3.425 -6.526
183 HD11 LEU 28 1HD1 LEU 28 3.526 -2.955 -4.041
184 HD12 LEU 28 2HD1 LEU 28 2.629 -2.137 -5.319
185 HD13 LEU 28 3HD1 LEU 28 3.906 -1.283 -4.454
186 HD21 LEU 28 3HD2 LEU 28 4.279 -1.078 -7.195
187 HD22 LEU 28 1HD2 LEU 28 5.798 -1.933 -7.464
188 HD23 LEU 28 2HD2 LEU 28 5.627 -0.853 -6.080
189 H HIS 29 H HIS 29 5.917 -6.104 -6.232
190 HA HIS 29 HA HIS 29 3.340 -6.629 -7.197
191 HB2 HIS 29 1HB HIS 29 6.007 -7.952 -7.553
192 HB3 HIS 29 2HB HIS 29 4.560 -8.710 -8.213
193 HD1 HIS 29 HD1 HIS 29 4.626 -8.262 -10.646
194 HD2 HIS 29 HD2 HIS 29 5.624 -4.897 -8.422
195 HE1 HIS 29 HE1 HIS 29 4.899 -6.406 -12.320
196 H SER 30 H SER 30 5.151 -8.049 -4.609
197 HA SER 30 HA SER 30 3.507 -10.416 -4.433
198 HB2 SER 30 1HB SER 30 5.873 -10.494 -3.762
199 HB3 SER 30 2HB SER 30 5.556 -9.307 -2.497
200 HG SER 30 HG SER 30 5.370 -11.186 -1.448
201 H HIS 31 H HIS 31 3.426 -7.199 -3.241
202 HA HIS 31 HA HIS 31 1.586 -7.853 -1.076
203 HB2 HIS 31 1HB HIS 31 2.934 -6.170 -0.294
204 HB3 HIS 31 2HB HIS 31 3.141 -5.448 -1.887
205 HD1 HIS 31 HD1 HIS 31 0.697 -5.574 0.980
206 HD2 HIS 31 HD2 HIS 31 1.411 -3.387 -2.480
207 HE1 HIS 31 HE1 HIS 31 -0.865 -3.606 1.094
208 H GLN 32 H GLN 32 1.624 -6.147 -4.172
209 HA GLN 32 HA GLN 32 -0.866 -5.001 -4.201
210 HB2 GLN 32 1HB GLN 32 0.750 -6.287 -6.385
211 HB3 GLN 32 2HB GLN 32 -0.817 -5.562 -6.722
212 HG2 GLN 32 1HG GLN 32 0.158 -3.476 -5.557
213 HG3 GLN 32 2HG GLN 32 1.717 -4.250 -5.837
214 HE21 GLN 32 1HE2 GLN 32 1.711 -2.036 -7.029
215 HE22 GLN 32 2HE2 GLN 32 1.323 -2.121 -8.710
216 H ARG 33 H ARG 33 -0.077 -8.355 -4.234
217 HA ARG 33 HA ARG 33 -2.320 -9.469 -5.443
218 HB2 ARG 33 1HB ARG 33 -1.031 -10.677 -3.008
219 HB3 ARG 33 2HB ARG 33 -1.738 -11.496 -4.394
220 HG2 ARG 33 1HG ARG 33 0.170 -10.288 -5.709
221 HG3 ARG 33 2HG ARG 33 0.924 -10.194 -4.117
222 HD2 ARG 33 1HD ARG 33 1.697 -12.186 -5.199
223 HD3 ARG 33 2HD ARG 33 0.608 -12.652 -3.892
224 HE ARG 33 HE ARG 33 -0.922 -12.468 -6.200
225 HH11 ARG 33 1HH1 ARG 33 1.741 -14.364 -5.002
226 HH12 ARG 33 2HH1 ARG 33 1.328 -15.768 -5.929
227 HH21 ARG 33 1HH2 ARG 33 -1.475 -14.310 -7.426
228 HH22 ARG 33 2HH2 ARG 33 -0.501 -15.736 -7.309
229 H VAL 34 H VAL 34 -1.912 -8.093 -2.255
230 HA VAL 34 HA VAL 34 -4.189 -9.127 -0.997
231 HB VAL 34 HB VAL 34 -4.011 -7.326 0.578
232 HG11 VAL 34 1HG1 VAL 34 -2.311 -8.703 1.171
233 HG12 VAL 34 2HG1 VAL 34 -1.543 -8.620 -0.415
234 HG13 VAL 34 3HG1 VAL 34 -1.342 -7.296 0.734
235 HG21 VAL 34 3HG2 VAL 34 -3.870 -5.388 -0.740
236 HG22 VAL 34 1HG2 VAL 34 -2.323 -5.472 0.102
237 HG23 VAL 34 2HG2 VAL 34 -2.435 -5.964 -1.588
238 H HIS 35 H HIS 35 -3.852 -6.720 -3.448
239 HA HIS 35 HA HIS 35 -6.560 -5.711 -3.026
240 HB2 HIS 35 1HB HIS 35 -4.395 -4.884 -4.968
241 HB3 HIS 35 2HB HIS 35 -5.986 -4.135 -4.876
242 HD1 HIS 35 HD1 HIS 35 -6.530 -2.918 -2.535
243 HD2 HIS 35 HD2 HIS 35 -2.547 -3.863 -3.242
244 HE1 HIS 35 HE1 HIS 35 -5.210 -1.522 -0.912
245 H THR 36 H THR 36 -4.742 -7.794 -5.129
246 HA THR 36 HA THR 36 -6.631 -7.885 -7.259
247 HB THR 36 HB THR 36 -5.374 -9.739 -8.123
248 HG1 THR 36 HG1 THR 36 -4.432 -9.925 -5.463
249 HG21 THR 36 3HG2 THR 36 -3.499 -8.572 -8.603
250 HG22 THR 36 1HG2 THR 36 -3.104 -8.305 -6.906
251 HG23 THR 36 2HG2 THR 36 -4.306 -7.289 -7.702
252 H GLY 37 H GLY 37 -6.295 -9.549 -4.218
253 HA2 GLY 37 1HA GLY 37 -8.111 -11.683 -4.897
254 HA3 GLY 37 2HA GLY 37 -7.454 -11.335 -3.304
255 H GLU 38 H GLU 38 -9.292 -9.181 -5.429
256 HA GLU 38 HA GLU 38 -11.724 -9.477 -3.944
257 HB2 GLU 38 1HB GLU 38 -10.612 -8.138 -2.305
258 HB3 GLU 38 2HB GLU 38 -10.014 -7.027 -3.529
259 HG2 GLU 38 1HG GLU 38 -11.835 -6.033 -2.291
260 HG3 GLU 38 2HG GLU 38 -12.296 -6.283 -3.974
261 H LYS 39 H LYS 39 -13.292 -9.185 -5.370
262 HA LYS 39 HA LYS 39 -12.860 -8.165 -7.959
263 HB2 LYS 39 1HB LYS 39 -15.399 -8.728 -6.425
264 HB3 LYS 39 2HB LYS 39 -15.384 -8.234 -8.113
265 HG2 LYS 39 1HG LYS 39 -15.471 -10.482 -8.393
266 HG3 LYS 39 2HG LYS 39 -13.719 -10.281 -8.318
267 HD2 LYS 39 1HD LYS 39 -13.617 -11.043 -6.100
268 HD3 LYS 39 2HD LYS 39 -15.352 -10.825 -5.856
269 HE2 LYS 39 1HE LYS 39 -14.123 -12.831 -7.743
270 HE3 LYS 39 2HE LYS 39 -14.664 -13.200 -6.106
271 HZ1 LYS 39 3HZ LYS 39 -16.705 -11.874 -7.561
272 HZ2 LYS 39 1HZ LYS 39 -16.739 -13.392 -6.816
273 HZ3 LYS 39 2HZ LYS 39 -16.182 -13.243 -8.406
274 HA PRO 40 HA PRO 40 -13.245 -3.818 -7.336
275 HB2 PRO 40 1HB PRO 40 -13.850 -3.099 -9.883
276 HB3 PRO 40 2HB PRO 40 -12.228 -3.593 -9.384
277 HG2 PRO 40 1HG PRO 40 -14.354 -5.187 -10.762
278 HG3 PRO 40 2HG PRO 40 -12.612 -5.126 -11.090
279 HD2 PRO 40 1HD PRO 40 -13.760 -7.137 -9.686
280 HD3 PRO 40 2HD PRO 40 -12.109 -6.569 -9.364
281 H SER 41 H SER 41 -14.801 -2.053 -7.577
282 HA SER 41 HA SER 41 -17.573 -3.052 -7.633
283 HB2 SER 41 1HB SER 41 -16.913 -2.261 -5.417
284 HB3 SER 41 2HB SER 41 -16.411 -0.714 -6.098
285 HG SER 41 HG SER 41 -19.049 -1.710 -6.345
286 H GLY 42 H GLY 42 -17.587 -2.717 -9.950
287 HA2 GLY 42 1HA GLY 42 -18.859 -0.386 -10.752
288 HA3 GLY 42 2HA GLY 42 -17.153 -0.159 -11.108
289 HA PRO 43 HA PRO 43 -19.027 -2.141 -14.817
290 HB2 PRO 43 1HB PRO 43 -17.590 -0.673 -16.593
291 HB3 PRO 43 2HB PRO 43 -19.110 -0.109 -15.888
292 HG2 PRO 43 1HG PRO 43 -16.298 0.563 -15.112
293 HG3 PRO 43 2HG PRO 43 -17.703 1.634 -15.265
294 HD2 PRO 43 1HD PRO 43 -16.823 0.717 -12.874
295 HD3 PRO 43 2HD PRO 43 -18.537 1.040 -13.200
296 H SER 44 H SER 44 -18.191 -4.084 -15.224
297 HA SER 44 HA SER 44 -15.273 -4.315 -15.572
298 HB2 SER 44 1HB SER 44 -17.233 -6.326 -14.446
299 HB3 SER 44 2HB SER 44 -15.554 -6.698 -14.835
300 HG SER 44 HG SER 44 -15.525 -6.151 -12.722
301 H SER 45 H SER 45 -15.333 -3.978 -17.800
302 HA SER 45 HA SER 45 -16.981 -4.905 -19.720
303 HB2 SER 45 1HB SER 45 -13.964 -4.777 -19.756
304 HB3 SER 45 2HB SER 45 -14.918 -5.140 -21.194
305 HG SER 45 HG SER 45 -14.290 -2.822 -20.604
306 H GLY 46 H GLY 46 -14.341 -6.789 -18.259
307 HA2 GLY 46 1HA GLY 46 -15.613 -9.218 -19.367
308 HA3 GLY 46 2HA GLY 46 -13.875 -9.044 -19.172
Start of MODEL 16
1 H1 GLY 1 H GLY 1 -9.428 7.217 16.174
2 HA2 GLY 1 1HA GLY 1 -9.299 9.884 16.296
3 HA3 GLY 1 2HA GLY 1 -8.627 8.889 17.579
4 H SER 2 H SER 2 -6.345 8.197 17.297
5 HA SER 2 HA SER 2 -4.802 10.383 16.074
6 HB2 SER 2 1HB SER 2 -4.244 8.595 18.437
7 HB3 SER 2 2HB SER 2 -2.974 9.546 17.667
8 HG SER 2 HG SER 2 -4.001 10.612 19.457
9 H SER 3 H SER 3 -4.678 9.494 13.998
10 HA SER 3 HA SER 3 -3.594 6.841 13.620
11 HB2 SER 3 1HB SER 3 -4.429 9.033 11.721
12 HB3 SER 3 2HB SER 3 -3.664 7.546 11.163
13 HG SER 3 HG SER 3 -5.382 6.388 12.106
14 H GLY 4 H GLY 4 -1.613 6.354 12.598
15 HA2 GLY 4 1HA GLY 4 0.367 8.546 12.700
16 HA3 GLY 4 2HA GLY 4 0.724 6.922 13.268
17 H SER 5 H SER 5 2.497 6.817 11.822
18 HA SER 5 HA SER 5 1.698 6.013 9.131
19 HB2 SER 5 1HB SER 5 3.462 8.324 9.791
20 HB3 SER 5 2HB SER 5 3.914 7.316 8.416
21 HG SER 5 HG SER 5 2.481 9.134 7.950
22 H SER 6 H SER 6 3.595 5.002 7.952
23 HA SER 6 HA SER 6 5.611 3.851 9.718
24 HB2 SER 6 1HB SER 6 5.090 1.565 9.137
25 HB3 SER 6 2HB SER 6 3.629 2.318 9.777
26 HG SER 6 HG SER 6 4.224 1.494 7.180
27 H GLY 7 H GLY 7 7.526 3.709 8.731
28 HA2 GLY 7 1HA GLY 7 8.536 2.811 6.550
29 HA3 GLY 7 2HA GLY 7 7.577 4.084 5.809
30 H SER 8 H SER 8 10.597 3.313 6.826
31 HA SER 8 HA SER 8 11.312 6.149 7.178
32 HB2 SER 8 1HB SER 8 11.507 4.677 9.269
33 HB3 SER 8 2HB SER 8 12.851 3.886 8.446
34 HG SER 8 HG SER 8 13.660 5.552 9.699
35 H GLY 9 H GLY 9 11.686 6.243 4.902
36 HA2 GLY 9 1HA GLY 9 14.099 6.341 3.896
37 HA3 GLY 9 2HA GLY 9 13.888 4.596 3.882
38 H GLU 10 H GLU 10 14.326 6.309 1.612
39 HA GLU 10 HA GLU 10 11.838 6.666 0.238
40 HB2 GLU 10 1HB GLU 10 14.728 6.878 -0.547
41 HB3 GLU 10 2HB GLU 10 13.466 6.935 -1.769
42 HG2 GLU 10 1HG GLU 10 13.719 9.155 -1.356
43 HG3 GLU 10 2HG GLU 10 12.460 8.769 -0.184
44 H LYS 11 H LYS 11 11.222 5.572 -1.727
45 HA LYS 11 HA LYS 11 12.411 2.965 -2.229
46 HB2 LYS 11 1HB LYS 11 9.703 3.388 -1.051
47 HB3 LYS 11 2HB LYS 11 9.903 2.098 -2.230
48 HG2 LYS 11 1HG LYS 11 11.297 0.879 -0.864
49 HG3 LYS 11 2HG LYS 11 11.794 2.294 0.068
50 HD2 LYS 11 1HD LYS 11 8.940 1.427 0.149
51 HD3 LYS 11 2HD LYS 11 10.137 0.531 1.087
52 HE2 LYS 11 1HE LYS 11 10.752 2.490 2.304
53 HE3 LYS 11 2HE LYS 11 9.794 3.520 1.241
54 HZ1 LYS 11 3HZ LYS 11 7.909 1.884 2.099
55 HZ2 LYS 11 1HZ LYS 11 8.322 3.304 2.921
56 HZ3 LYS 11 2HZ LYS 11 8.936 1.816 3.441
57 HA PRO 12 HA PRO 12 11.457 4.424 -6.315
58 HB2 PRO 12 1HB PRO 12 12.370 2.234 -7.635
59 HB3 PRO 12 2HB PRO 12 13.444 3.460 -6.950
60 HG2 PRO 12 1HG PRO 12 12.656 0.795 -5.837
61 HG3 PRO 12 2HG PRO 12 14.254 1.563 -5.875
62 HD2 PRO 12 1HD PRO 12 12.693 1.556 -3.662
63 HD3 PRO 12 2HD PRO 12 13.797 2.892 -4.047
64 H PHE 13 H PHE 13 10.215 1.592 -4.787
65 HA PHE 13 HA PHE 13 8.216 1.253 -6.918
66 HB2 PHE 13 1HB PHE 13 8.945 -0.652 -4.684
67 HB3 PHE 13 2HB PHE 13 7.803 -0.970 -5.986
68 HD1 PHE 13 HD1 PHE 13 11.342 -0.583 -5.115
69 HD2 PHE 13 HD2 PHE 13 8.557 -1.526 -8.193
70 HE1 PHE 13 HE1 PHE 13 13.173 -1.477 -6.494
71 HE2 PHE 13 HE2 PHE 13 10.383 -2.422 -9.576
72 HZ PHE 13 HZ PHE 13 12.695 -2.399 -8.727
73 H LYS 14 H LYS 14 6.119 1.659 -6.541
74 HA LYS 14 HA LYS 14 5.186 1.956 -3.783
75 HB2 LYS 14 1HB LYS 14 5.797 4.208 -4.463
76 HB3 LYS 14 2HB LYS 14 4.859 4.048 -5.941
77 HG2 LYS 14 1HG LYS 14 2.860 3.651 -4.355
78 HG3 LYS 14 2HG LYS 14 3.904 4.371 -3.128
79 HD2 LYS 14 1HD LYS 14 4.212 6.327 -4.663
80 HD3 LYS 14 2HD LYS 14 2.980 5.621 -5.712
81 HE2 LYS 14 1HE LYS 14 1.284 6.021 -4.211
82 HE3 LYS 14 2HE LYS 14 2.367 6.007 -2.820
83 HZ1 LYS 14 3HZ LYS 14 2.414 8.154 -4.860
84 HZ2 LYS 14 1HZ LYS 14 3.130 8.160 -3.327
85 HZ3 LYS 14 2HZ LYS 14 1.447 8.233 -3.474
86 H CYS 15 H CYS 15 3.278 1.005 -3.477
87 HA CYS 15 HA CYS 15 1.938 -0.286 -5.639
88 HB2 CYS 15 1HB CYS 15 2.074 -1.184 -3.303
89 HB3 CYS 15 2HB CYS 15 0.958 0.082 -2.803
90 H GLU 16 H GLU 16 0.919 0.977 -7.083
91 HA GLU 16 HA GLU 16 -0.318 3.436 -6.531
92 HB2 GLU 16 1HB GLU 16 -0.893 1.530 -8.806
93 HB3 GLU 16 2HB GLU 16 -1.317 3.235 -8.757
94 HG2 GLU 16 1HG GLU 16 1.516 2.262 -8.565
95 HG3 GLU 16 2HG GLU 16 0.726 2.617 -10.100
96 H GLU 17 H GLU 17 -1.406 0.186 -6.149
97 HA GLU 17 HA GLU 17 -4.170 0.489 -6.307
98 HB2 GLU 17 1HB GLU 17 -2.701 -1.297 -4.364
99 HB3 GLU 17 2HB GLU 17 -4.333 -1.518 -4.977
100 HG2 GLU 17 1HG GLU 17 -3.167 -1.591 -7.297
101 HG3 GLU 17 2HG GLU 17 -1.722 -1.946 -6.352
102 H CYS 18 H CYS 18 -2.062 0.761 -3.449
103 HA CYS 18 HA CYS 18 -4.203 2.308 -2.139
104 HB2 CYS 18 1HB CYS 18 -3.313 1.492 0.019
105 HB3 CYS 18 2HB CYS 18 -3.882 0.178 -1.006
106 H GLY 19 H GLY 19 -0.716 1.919 -2.570
107 HA2 GLY 19 1HA GLY 19 0.404 4.120 -3.058
108 HA3 GLY 19 2HA GLY 19 -0.369 4.682 -1.583
109 H LYS 20 H LYS 20 0.687 1.442 -1.498
110 HA LYS 20 HA LYS 20 2.482 1.911 0.628
111 HB2 LYS 20 1HB LYS 20 1.674 -0.428 -1.012
112 HB3 LYS 20 2HB LYS 20 3.206 -0.552 -0.157
113 HG2 LYS 20 1HG LYS 20 1.789 0.265 1.885
114 HG3 LYS 20 2HG LYS 20 0.440 -0.349 0.926
115 HD2 LYS 20 1HD LYS 20 1.042 -2.191 2.203
116 HD3 LYS 20 2HD LYS 20 1.893 -2.477 0.684
117 HE2 LYS 20 1HE LYS 20 3.319 -2.908 2.635
118 HE3 LYS 20 2HE LYS 20 3.942 -1.594 1.638
119 HZ1 LYS 20 3HZ LYS 20 3.393 -1.531 4.349
120 HZ2 LYS 20 1HZ LYS 20 2.207 -0.571 3.619
121 HZ3 LYS 20 2HZ LYS 20 3.844 -0.232 3.364
122 H ARG 21 H ARG 21 4.762 0.657 0.370
123 HA ARG 21 HA ARG 21 6.104 1.428 -2.092
124 HB2 ARG 21 1HB ARG 21 6.957 2.525 0.594
125 HB3 ARG 21 2HB ARG 21 7.831 2.724 -0.919
126 HG2 ARG 21 1HG ARG 21 5.647 3.810 -1.768
127 HG3 ARG 21 2HG ARG 21 5.251 3.958 -0.055
128 HD2 ARG 21 1HD ARG 21 7.910 4.883 -1.056
129 HD3 ARG 21 2HD ARG 21 6.486 5.897 -1.287
130 HE ARG 21 HE ARG 21 6.906 4.958 1.416
131 HH11 ARG 21 1HH1 ARG 21 7.468 7.486 -0.911
132 HH12 ARG 21 2HH1 ARG 21 7.757 8.704 0.288
133 HH21 ARG 21 1HH2 ARG 21 7.285 6.552 3.003
134 HH22 ARG 21 2HH2 ARG 21 7.654 8.171 2.514
135 H PHE 22 H PHE 22 8.193 0.481 -2.333
136 HA PHE 22 HA PHE 22 9.125 -1.370 -0.310
137 HB2 PHE 22 1HB PHE 22 8.470 -2.463 -3.044
138 HB3 PHE 22 2HB PHE 22 8.940 -3.358 -1.603
139 HD1 PHE 22 HD2 PHE 22 6.225 -1.354 -3.110
140 HD2 PHE 22 HD1 PHE 22 7.337 -4.107 -0.060
141 HE1 PHE 22 HE2 PHE 22 3.852 -1.683 -2.547
142 HE2 PHE 22 HE1 PHE 22 4.966 -4.441 0.507
143 HZ PHE 22 HZ PHE 22 3.220 -3.227 -0.736
144 H THR 23 H THR 23 11.239 -2.198 -0.742
145 HA THR 23 HA THR 23 12.847 -0.355 -2.272
146 HB THR 23 HB THR 23 13.516 -1.284 -0.016
147 HG1 THR 23 HG1 THR 23 15.477 -0.773 -0.628
148 HG21 THR 23 3HG2 THR 23 14.181 -3.729 -1.661
149 HG22 THR 23 1HG2 THR 23 12.901 -3.628 -0.452
150 HG23 THR 23 2HG2 THR 23 14.589 -3.472 0.035
151 H GLN 24 H GLN 24 11.312 -3.306 -2.879
152 HA GLN 24 HA GLN 24 12.802 -3.588 -5.381
153 HB2 GLN 24 1HB GLN 24 12.657 -5.571 -3.194
154 HB3 GLN 24 2HB GLN 24 12.378 -6.201 -4.812
155 HG2 GLN 24 1HG GLN 24 14.720 -4.433 -4.425
156 HG3 GLN 24 2HG GLN 24 14.794 -6.052 -3.731
157 HE21 GLN 24 1HE2 GLN 24 13.421 -4.749 -6.732
158 HE22 GLN 24 2HE2 GLN 24 14.276 -5.815 -7.788
159 H ASN 25 H ASN 25 11.658 -4.870 -6.998
160 HA ASN 25 HA ASN 25 8.918 -4.180 -7.135
161 HB2 ASN 25 1HB ASN 25 8.927 -5.610 -9.202
162 HB3 ASN 25 2HB ASN 25 10.172 -4.364 -9.175
163 HD21 ASN 25 1HD2 ASN 25 12.332 -4.968 -8.823
164 HD22 ASN 25 2HD2 ASN 25 12.868 -6.587 -9.100
165 H SER 26 H SER 26 10.542 -7.326 -6.757
166 HA SER 26 HA SER 26 8.451 -9.048 -6.683
167 HB2 SER 26 1HB SER 26 10.918 -8.974 -4.947
168 HB3 SER 26 2HB SER 26 9.771 -10.312 -4.892
169 HG SER 26 HG SER 26 10.331 -10.903 -6.889
170 H GLN 27 H GLN 27 9.521 -6.991 -3.999
171 HA GLN 27 HA GLN 27 7.697 -7.914 -2.082
172 HB2 GLN 27 1HB GLN 27 8.996 -5.203 -2.389
173 HB3 GLN 27 2HB GLN 27 8.100 -5.714 -0.965
174 HG2 GLN 27 1HG GLN 27 9.734 -7.652 -0.820
175 HG3 GLN 27 2HG GLN 27 10.702 -6.779 -2.008
176 HE21 GLN 27 1HE2 GLN 27 10.592 -4.239 -1.278
177 HE22 GLN 27 2HE2 GLN 27 11.215 -4.005 0.316
178 H LEU 28 H LEU 28 7.500 -5.006 -4.140
179 HA LEU 28 HA LEU 28 4.942 -4.209 -3.383
180 HB2 LEU 28 1HB LEU 28 6.321 -2.718 -4.617
181 HB3 LEU 28 2HB LEU 28 6.457 -3.853 -5.958
182 HG LEU 28 HG LEU 28 4.121 -3.480 -6.533
183 HD11 LEU 28 1HD1 LEU 28 2.664 -2.126 -5.356
184 HD12 LEU 28 2HD1 LEU 28 3.963 -1.285 -4.511
185 HD13 LEU 28 3HD1 LEU 28 3.549 -2.940 -4.065
186 HD21 LEU 28 3HD2 LEU 28 4.900 -0.686 -6.327
187 HD22 LEU 28 1HD2 LEU 28 4.667 -1.696 -7.754
188 HD23 LEU 28 2HD2 LEU 28 6.209 -1.721 -6.900
189 H HIS 29 H HIS 29 5.878 -6.094 -6.265
190 HA HIS 29 HA HIS 29 3.292 -6.628 -7.172
191 HB2 HIS 29 1HB HIS 29 5.969 -7.869 -7.590
192 HB3 HIS 29 2HB HIS 29 4.553 -8.779 -8.106
193 HD1 HIS 29 HD1 HIS 29 5.880 -8.300 -10.487
194 HD2 HIS 29 HD2 HIS 29 3.858 -5.131 -8.718
195 HE1 HIS 29 HE1 HIS 29 5.547 -6.610 -12.319
196 H SER 30 H SER 30 5.146 -8.067 -4.615
197 HA SER 30 HA SER 30 3.496 -10.416 -4.391
198 HB2 SER 30 1HB SER 30 5.878 -10.440 -3.723
199 HB3 SER 30 2HB SER 30 5.519 -9.283 -2.442
200 HG SER 30 HG SER 30 4.929 -11.996 -2.614
201 H HIS 31 H HIS 31 3.409 -7.184 -3.232
202 HA HIS 31 HA HIS 31 1.567 -7.821 -1.065
203 HB2 HIS 31 1HB HIS 31 2.919 -6.132 -0.298
204 HB3 HIS 31 2HB HIS 31 3.117 -5.419 -1.896
205 HD1 HIS 31 HD1 HIS 31 0.901 -5.365 1.105
206 HD2 HIS 31 HD2 HIS 31 1.161 -3.539 -2.618
207 HE1 HIS 31 HE1 HIS 31 -0.721 -3.445 1.183
208 H GLN 32 H GLN 32 1.609 -6.122 -4.166
209 HA GLN 32 HA GLN 32 -0.886 -4.988 -4.207
210 HB2 GLN 32 1HB GLN 32 0.774 -6.248 -6.367
211 HB3 GLN 32 2HB GLN 32 -0.818 -5.596 -6.733
212 HG2 GLN 32 1HG GLN 32 -0.137 -3.408 -5.970
213 HG3 GLN 32 2HG GLN 32 1.436 -4.040 -5.485
214 HE21 GLN 32 1HE2 GLN 32 1.762 -2.050 -7.020
215 HE22 GLN 32 2HE2 GLN 32 2.084 -2.468 -8.665
216 H ARG 33 H ARG 33 -0.071 -8.348 -4.297
217 HA ARG 33 HA ARG 33 -2.325 -9.455 -5.485
218 HB2 ARG 33 1HB ARG 33 -1.052 -10.717 -3.076
219 HB3 ARG 33 2HB ARG 33 -1.695 -11.491 -4.519
220 HG2 ARG 33 1HG ARG 33 0.224 -10.246 -5.737
221 HG3 ARG 33 2HG ARG 33 0.921 -10.111 -4.122
222 HD2 ARG 33 1HD ARG 33 1.844 -12.079 -4.972
223 HD3 ARG 33 2HD ARG 33 0.522 -12.635 -3.947
224 HE ARG 33 HE ARG 33 -0.665 -12.490 -6.342
225 HH11 ARG 33 1HH1 ARG 33 2.358 -13.894 -5.337
226 HH12 ARG 33 2HH1 ARG 33 2.335 -15.134 -6.548
227 HH21 ARG 33 1HH2 ARG 33 -0.707 -14.117 -7.941
228 HH22 ARG 33 2HH2 ARG 33 0.592 -15.259 -8.029
229 H VAL 34 H VAL 34 -1.887 -8.120 -2.282
230 HA VAL 34 HA VAL 34 -4.136 -9.180 -1.005
231 HB VAL 34 HB VAL 34 -3.939 -7.430 0.597
232 HG11 VAL 34 1HG1 VAL 34 -2.132 -8.655 1.142
233 HG12 VAL 34 2HG1 VAL 34 -1.494 -8.636 -0.503
234 HG13 VAL 34 3HG1 VAL 34 -1.237 -7.252 0.560
235 HG21 VAL 34 3HG2 VAL 34 -2.419 -5.932 -1.531
236 HG22 VAL 34 1HG2 VAL 34 -3.963 -5.493 -0.799
237 HG23 VAL 34 2HG2 VAL 34 -2.484 -5.439 0.161
238 H HIS 35 H HIS 35 -3.849 -6.702 -3.408
239 HA HIS 35 HA HIS 35 -6.494 -5.627 -2.934
240 HB2 HIS 35 1HB HIS 35 -4.378 -5.089 -5.014
241 HB3 HIS 35 2HB HIS 35 -5.976 -4.353 -5.088
242 HD1 HIS 35 HD1 HIS 35 -6.600 -2.761 -3.029
243 HD2 HIS 35 HD2 HIS 35 -2.601 -3.840 -3.350
244 HE1 HIS 35 HE1 HIS 35 -5.346 -1.132 -1.581
245 H THR 36 H THR 36 -5.016 -8.067 -4.882
246 HA THR 36 HA THR 36 -7.302 -8.263 -6.675
247 HB THR 36 HB THR 36 -6.047 -10.044 -7.796
248 HG1 THR 36 HG1 THR 36 -3.800 -10.322 -6.982
249 HG21 THR 36 3HG2 THR 36 -5.512 -7.970 -8.703
250 HG22 THR 36 1HG2 THR 36 -3.929 -8.634 -8.300
251 HG23 THR 36 2HG2 THR 36 -4.678 -7.436 -7.244
252 H GLY 37 H GLY 37 -7.945 -8.721 -3.988
253 HA2 GLY 37 1HA GLY 37 -9.076 -11.371 -4.209
254 HA3 GLY 37 2HA GLY 37 -7.898 -11.204 -2.916
255 H GLU 38 H GLU 38 -10.061 -8.637 -3.939
256 HA GLU 38 HA GLU 38 -12.104 -9.099 -2.049
257 HB2 GLU 38 1HB GLU 38 -10.207 -8.560 -0.501
258 HB3 GLU 38 2HB GLU 38 -10.130 -6.963 -1.232
259 HG2 GLU 38 1HG GLU 38 -12.067 -6.263 -0.249
260 HG3 GLU 38 2HG GLU 38 -12.733 -7.891 -0.145
261 H LYS 39 H LYS 39 -13.714 -7.457 -2.057
262 HA LYS 39 HA LYS 39 -13.311 -5.227 -3.905
263 HB2 LYS 39 1HB LYS 39 -15.473 -5.736 -5.031
264 HB3 LYS 39 2HB LYS 39 -14.225 -6.937 -5.333
265 HG2 LYS 39 1HG LYS 39 -15.956 -8.329 -4.896
266 HG3 LYS 39 2HG LYS 39 -15.372 -8.103 -3.246
267 HD2 LYS 39 1HD LYS 39 -17.070 -6.531 -2.759
268 HD3 LYS 39 2HD LYS 39 -17.503 -6.361 -4.462
269 HE2 LYS 39 1HE LYS 39 -19.185 -7.704 -3.489
270 HE3 LYS 39 2HE LYS 39 -18.155 -8.802 -4.407
271 HZ1 LYS 39 3HZ LYS 39 -17.128 -9.556 -2.432
272 HZ2 LYS 39 1HZ LYS 39 -18.793 -9.577 -2.133
273 HZ3 LYS 39 2HZ LYS 39 -17.836 -8.337 -1.497
274 HA PRO 40 HA PRO 40 -15.601 -3.019 -0.867
275 HB2 PRO 40 1HB PRO 40 -16.475 -0.945 -2.386
276 HB3 PRO 40 2HB PRO 40 -14.796 -1.109 -1.859
277 HG2 PRO 40 1HG PRO 40 -16.030 -1.802 -4.497
278 HG3 PRO 40 2HG PRO 40 -14.489 -0.991 -4.161
279 HD2 PRO 40 1HD PRO 40 -14.643 -3.616 -4.807
280 HD3 PRO 40 2HD PRO 40 -13.398 -2.972 -3.716
281 H SER 41 H SER 41 -17.259 -4.615 -0.564
282 HA SER 41 HA SER 41 -19.626 -4.464 -2.241
283 HB2 SER 41 1HB SER 41 -20.449 -6.340 -0.950
284 HB3 SER 41 2HB SER 41 -18.768 -6.650 -1.384
285 HG SER 41 HG SER 41 -18.287 -5.727 0.770
286 H GLY 42 H GLY 42 -21.361 -3.263 -1.816
287 HA2 GLY 42 1HA GLY 42 -22.848 -2.780 0.282
288 HA3 GLY 42 2HA GLY 42 -21.449 -1.818 0.734
289 HA PRO 43 HA PRO 43 -23.850 1.350 -1.321
290 HB2 PRO 43 1HB PRO 43 -22.249 3.403 -0.554
291 HB3 PRO 43 2HB PRO 43 -23.443 2.664 0.519
292 HG2 PRO 43 1HG PRO 43 -20.491 2.196 0.363
293 HG3 PRO 43 2HG PRO 43 -21.520 2.378 1.795
294 HD2 PRO 43 1HD PRO 43 -20.693 -0.037 0.893
295 HD3 PRO 43 2HD PRO 43 -22.259 0.197 1.697
296 H SER 44 H SER 44 -23.550 2.709 -3.121
297 HA SER 44 HA SER 44 -21.609 1.825 -4.989
298 HB2 SER 44 1HB SER 44 -23.823 2.649 -5.680
299 HB3 SER 44 2HB SER 44 -23.406 4.261 -5.097
300 HG SER 44 HG SER 44 -22.609 2.939 -7.395
301 H SER 45 H SER 45 -19.549 2.186 -4.219
302 HA SER 45 HA SER 45 -18.774 4.986 -3.758
303 HB2 SER 45 1HB SER 45 -17.743 2.375 -2.730
304 HB3 SER 45 2HB SER 45 -16.616 3.723 -2.883
305 HG SER 45 HG SER 45 -17.410 4.145 -0.956
306 H GLY 46 H GLY 46 -17.358 5.981 -5.076
307 HA2 GLY 46 1HA GLY 46 -15.303 4.872 -6.547
308 HA3 GLY 46 2HA GLY 46 -16.718 4.785 -7.585
Start of MODEL 17
1 H1 GLY 1 H GLY 1 -0.940 5.812 19.301
2 HA2 GLY 1 1HA GLY 1 -1.337 6.291 21.703
3 HA3 GLY 1 2HA GLY 1 0.143 5.398 22.020
4 H SER 2 H SER 2 2.134 6.296 20.931
5 HA SER 2 HA SER 2 2.022 9.242 20.918
6 HB2 SER 2 1HB SER 2 3.998 7.372 22.193
7 HB3 SER 2 2HB SER 2 4.488 8.999 21.722
8 HG SER 2 HG SER 2 2.126 8.753 23.174
9 H SER 3 H SER 3 3.640 10.313 19.617
10 HA SER 3 HA SER 3 3.792 9.431 17.014
11 HB2 SER 3 1HB SER 3 5.425 11.404 18.583
12 HB3 SER 3 2HB SER 3 5.845 11.041 16.909
13 HG SER 3 HG SER 3 4.340 12.843 17.275
14 H GLY 4 H GLY 4 5.769 8.898 15.737
15 HA2 GLY 4 1HA GLY 4 7.908 7.541 17.137
16 HA3 GLY 4 2HA GLY 4 6.820 6.470 16.267
17 H SER 5 H SER 5 8.609 5.831 14.959
18 HA SER 5 HA SER 5 9.315 7.835 12.915
19 HB2 SER 5 1HB SER 5 11.285 7.303 14.230
20 HB3 SER 5 2HB SER 5 11.010 5.576 14.006
21 HG SER 5 HG SER 5 12.579 6.787 12.566
22 H SER 6 H SER 6 8.466 7.395 11.003
23 HA SER 6 HA SER 6 8.245 4.591 10.154
24 HB2 SER 6 1HB SER 6 6.029 5.536 10.975
25 HB3 SER 6 2HB SER 6 6.088 6.629 9.593
26 HG SER 6 HG SER 6 6.347 3.832 9.293
27 H GLY 7 H GLY 7 9.528 4.393 8.444
28 HA2 GLY 7 1HA GLY 7 9.691 4.826 6.042
29 HA3 GLY 7 2HA GLY 7 9.452 6.529 6.405
30 H SER 8 H SER 8 11.161 7.701 7.424
31 HA SER 8 HA SER 8 13.355 8.390 7.232
32 HB2 SER 8 1HB SER 8 14.742 7.335 8.866
33 HB3 SER 8 2HB SER 8 13.089 7.225 9.470
34 HG SER 8 HG SER 8 14.678 5.201 8.302
35 H GLY 9 H GLY 9 12.678 7.176 4.865
36 HA2 GLY 9 1HA GLY 9 15.227 6.426 3.859
37 HA3 GLY 9 2HA GLY 9 14.191 5.014 4.011
38 H GLU 10 H GLU 10 14.506 4.913 1.657
39 HA GLU 10 HA GLU 10 12.385 6.410 0.313
40 HB2 GLU 10 1HB GLU 10 14.661 7.514 -0.045
41 HB3 GLU 10 2HB GLU 10 15.089 6.086 -0.976
42 HG2 GLU 10 1HG GLU 10 14.373 7.843 -2.454
43 HG3 GLU 10 2HG GLU 10 13.206 6.522 -2.487
44 H LYS 11 H LYS 11 11.499 5.369 -1.499
45 HA LYS 11 HA LYS 11 12.495 2.698 -2.147
46 HB2 LYS 11 1HB LYS 11 9.701 3.298 -1.169
47 HB3 LYS 11 2HB LYS 11 10.141 1.808 -1.994
48 HG2 LYS 11 1HG LYS 11 11.635 1.195 -0.229
49 HG3 LYS 11 2HG LYS 11 11.422 2.761 0.558
50 HD2 LYS 11 1HD LYS 11 8.870 2.008 0.476
51 HD3 LYS 11 2HD LYS 11 9.614 0.407 0.472
52 HE2 LYS 11 1HE LYS 11 10.768 0.873 2.520
53 HE3 LYS 11 2HE LYS 11 10.258 2.560 2.481
54 HZ1 LYS 11 3HZ LYS 11 8.986 1.003 3.998
55 HZ2 LYS 11 1HZ LYS 11 8.303 0.344 2.597
56 HZ3 LYS 11 2HZ LYS 11 8.063 1.977 2.968
57 HA PRO 12 HA PRO 12 11.546 4.424 -6.147
58 HB2 PRO 12 1HB PRO 12 12.438 2.297 -7.578
59 HB3 PRO 12 2HB PRO 12 13.523 3.487 -6.850
60 HG2 PRO 12 1HG PRO 12 12.744 0.775 -5.852
61 HG3 PRO 12 2HG PRO 12 14.342 1.542 -5.874
62 HD2 PRO 12 1HD PRO 12 12.809 1.434 -3.645
63 HD3 PRO 12 2HD PRO 12 13.911 2.785 -3.981
64 H PHE 13 H PHE 13 10.310 1.535 -4.729
65 HA PHE 13 HA PHE 13 8.320 1.246 -6.870
66 HB2 PHE 13 1HB PHE 13 8.959 -0.660 -4.609
67 HB3 PHE 13 2HB PHE 13 7.867 -0.968 -5.956
68 HD1 PHE 13 HD1 PHE 13 11.374 -0.605 -4.950
69 HD2 PHE 13 HD2 PHE 13 8.700 -1.553 -8.123
70 HE1 PHE 13 HE1 PHE 13 13.250 -1.523 -6.251
71 HE2 PHE 13 HE2 PHE 13 10.571 -2.474 -9.429
72 HZ PHE 13 HZ PHE 13 12.849 -2.460 -8.493
73 H LYS 14 H LYS 14 6.209 1.639 -6.525
74 HA LYS 14 HA LYS 14 5.236 1.976 -3.788
75 HB2 LYS 14 1HB LYS 14 5.859 4.219 -4.403
76 HB3 LYS 14 2HB LYS 14 5.044 4.073 -5.955
77 HG2 LYS 14 1HG LYS 14 2.927 3.668 -4.496
78 HG3 LYS 14 2HG LYS 14 3.884 4.446 -3.233
79 HD2 LYS 14 1HD LYS 14 4.269 6.346 -4.819
80 HD3 LYS 14 2HD LYS 14 3.113 5.587 -5.915
81 HE2 LYS 14 1HE LYS 14 1.426 5.675 -4.083
82 HE3 LYS 14 2HE LYS 14 2.586 6.588 -3.120
83 HZ1 LYS 14 3HZ LYS 14 0.792 7.570 -5.001
84 HZ2 LYS 14 1HZ LYS 14 2.337 7.776 -5.661
85 HZ3 LYS 14 2HZ LYS 14 1.970 8.433 -4.147
86 H CYS 15 H CYS 15 3.309 1.053 -3.517
87 HA CYS 15 HA CYS 15 1.985 -0.201 -5.719
88 HB2 CYS 15 1HB CYS 15 2.097 -1.160 -3.411
89 HB3 CYS 15 2HB CYS 15 1.002 0.110 -2.876
90 H GLU 16 H GLU 16 0.729 0.855 -7.098
91 HA GLU 16 HA GLU 16 -0.403 3.405 -6.547
92 HB2 GLU 16 1HB GLU 16 -1.069 1.498 -8.796
93 HB3 GLU 16 2HB GLU 16 -1.429 3.218 -8.747
94 HG2 GLU 16 1HG GLU 16 1.308 1.971 -8.826
95 HG3 GLU 16 2HG GLU 16 0.487 2.786 -10.156
96 H GLU 17 H GLU 17 -1.497 0.155 -6.140
97 HA GLU 17 HA GLU 17 -4.261 0.469 -6.229
98 HB2 GLU 17 1HB GLU 17 -2.745 -1.316 -4.320
99 HB3 GLU 17 2HB GLU 17 -4.398 -1.529 -4.876
100 HG2 GLU 17 1HG GLU 17 -3.288 -1.602 -7.236
101 HG3 GLU 17 2HG GLU 17 -1.837 -2.003 -6.319
102 H CYS 18 H CYS 18 -2.079 0.764 -3.430
103 HA CYS 18 HA CYS 18 -4.189 2.309 -2.071
104 HB2 CYS 18 1HB CYS 18 -3.174 1.521 0.070
105 HB3 CYS 18 2HB CYS 18 -3.868 0.225 -0.900
106 H GLY 19 H GLY 19 -0.726 1.947 -2.645
107 HA2 GLY 19 1HA GLY 19 0.399 4.118 -3.160
108 HA3 GLY 19 2HA GLY 19 -0.368 4.725 -1.700
109 H LYS 20 H LYS 20 0.673 1.495 -1.484
110 HA LYS 20 HA LYS 20 2.494 2.048 0.599
111 HB2 LYS 20 1HB LYS 20 1.673 -0.364 -0.934
112 HB3 LYS 20 2HB LYS 20 3.190 -0.451 -0.049
113 HG2 LYS 20 1HG LYS 20 1.755 0.467 1.929
114 HG3 LYS 20 2HG LYS 20 0.408 -0.167 0.979
115 HD2 LYS 20 1HD LYS 20 0.880 -2.042 2.171
116 HD3 LYS 20 2HD LYS 20 2.035 -2.282 0.858
117 HE2 LYS 20 1HE LYS 20 2.671 -0.939 3.483
118 HE3 LYS 20 2HE LYS 20 3.003 -2.632 3.118
119 HZ1 LYS 20 3HZ LYS 20 4.953 -1.239 2.782
120 HZ2 LYS 20 1HZ LYS 20 4.117 -0.304 1.647
121 HZ3 LYS 20 2HZ LYS 20 4.450 -1.930 1.322
122 H ARG 21 H ARG 21 4.767 0.797 0.396
123 HA ARG 21 HA ARG 21 6.088 1.424 -2.120
124 HB2 ARG 21 1HB ARG 21 6.969 2.650 0.500
125 HB3 ARG 21 2HB ARG 21 7.834 2.766 -1.027
126 HG2 ARG 21 1HG ARG 21 5.576 3.785 -1.876
127 HG3 ARG 21 2HG ARG 21 5.326 4.111 -0.160
128 HD2 ARG 21 1HD ARG 21 7.819 5.015 -0.377
129 HD3 ARG 21 2HD ARG 21 7.310 5.250 -2.049
130 HE ARG 21 HE ARG 21 5.423 6.294 -0.173
131 HH11 ARG 21 1HH1 ARG 21 8.415 6.950 -1.827
132 HH12 ARG 21 2HH1 ARG 21 8.243 8.671 -1.731
133 HH21 ARG 21 1HH2 ARG 21 5.184 8.559 -0.039
134 HH22 ARG 21 2HH2 ARG 21 6.405 9.585 -0.712
135 H PHE 22 H PHE 22 8.126 0.413 -2.365
136 HA PHE 22 HA PHE 22 9.044 -1.359 -0.249
137 HB2 PHE 22 1HB PHE 22 8.432 -2.489 -2.980
138 HB3 PHE 22 2HB PHE 22 8.910 -3.369 -1.532
139 HD1 PHE 22 HD2 PHE 22 6.178 -1.358 -3.016
140 HD2 PHE 22 HD1 PHE 22 7.310 -4.168 -0.026
141 HE1 PHE 22 HE2 PHE 22 3.809 -1.708 -2.453
142 HE2 PHE 22 HE1 PHE 22 4.942 -4.523 0.541
143 HZ PHE 22 HZ PHE 22 3.188 -3.291 -0.671
144 H THR 23 H THR 23 11.166 -2.203 -0.612
145 HA THR 23 HA THR 23 12.825 -0.386 -2.111
146 HB THR 23 HB THR 23 13.466 -1.272 0.143
147 HG1 THR 23 HG1 THR 23 15.485 -2.111 -1.605
148 HG21 THR 23 3HG2 THR 23 14.698 -3.587 -0.140
149 HG22 THR 23 1HG2 THR 23 13.497 -3.816 -1.410
150 HG23 THR 23 2HG2 THR 23 12.980 -3.515 0.248
151 H GLN 24 H GLN 24 11.243 -3.274 -2.798
152 HA GLN 24 HA GLN 24 12.778 -3.571 -5.261
153 HB2 GLN 24 1HB GLN 24 12.620 -5.572 -3.084
154 HB3 GLN 24 2HB GLN 24 12.397 -6.186 -4.716
155 HG2 GLN 24 1HG GLN 24 14.771 -4.655 -3.680
156 HG3 GLN 24 2HG GLN 24 14.708 -6.372 -4.075
157 HE21 GLN 24 1HE2 GLN 24 13.233 -6.198 -6.448
158 HE22 GLN 24 2HE2 GLN 24 14.219 -5.441 -7.648
159 H ASN 25 H ASN 25 11.658 -4.850 -6.891
160 HA ASN 25 HA ASN 25 8.908 -4.199 -7.032
161 HB2 ASN 25 1HB ASN 25 8.916 -5.351 -9.160
162 HB3 ASN 25 2HB ASN 25 10.405 -4.422 -9.011
163 HD21 ASN 25 1HD2 ASN 25 12.354 -5.526 -8.575
164 HD22 ASN 25 2HD2 ASN 25 12.529 -7.203 -8.954
165 H SER 26 H SER 26 10.574 -7.332 -6.719
166 HA SER 26 HA SER 26 8.514 -9.083 -6.666
167 HB2 SER 26 1HB SER 26 10.838 -9.081 -4.725
168 HB3 SER 26 2HB SER 26 9.830 -10.474 -5.118
169 HG SER 26 HG SER 26 11.892 -10.242 -6.295
170 H GLN 27 H GLN 27 9.442 -6.899 -4.059
171 HA GLN 27 HA GLN 27 7.642 -7.929 -2.128
172 HB2 GLN 27 1HB GLN 27 8.926 -5.203 -2.363
173 HB3 GLN 27 2HB GLN 27 8.042 -5.771 -0.953
174 HG2 GLN 27 1HG GLN 27 9.703 -7.687 -0.872
175 HG3 GLN 27 2HG GLN 27 10.653 -6.768 -2.038
176 HE21 GLN 27 1HE2 GLN 27 10.560 -4.263 -1.251
177 HE22 GLN 27 2HE2 GLN 27 11.170 -4.063 0.353
178 H LEU 28 H LEU 28 7.473 -5.009 -4.169
179 HA LEU 28 HA LEU 28 4.906 -4.213 -3.423
180 HB2 LEU 28 1HB LEU 28 6.303 -2.704 -4.613
181 HB3 LEU 28 2HB LEU 28 6.456 -3.818 -5.970
182 HG LEU 28 HG LEU 28 4.156 -3.423 -6.604
183 HD11 LEU 28 1HD1 LEU 28 2.658 -2.065 -5.429
184 HD12 LEU 28 2HD1 LEU 28 3.931 -1.380 -4.418
185 HD13 LEU 28 3HD1 LEU 28 3.425 -3.053 -4.185
186 HD21 LEU 28 3HD2 LEU 28 5.584 -1.906 -7.651
187 HD22 LEU 28 1HD2 LEU 28 5.889 -1.016 -6.159
188 HD23 LEU 28 2HD2 LEU 28 4.323 -0.884 -6.960
189 H HIS 29 H HIS 29 5.886 -6.064 -6.311
190 HA HIS 29 HA HIS 29 3.335 -6.572 -7.300
191 HB2 HIS 29 1HB HIS 29 5.957 -8.014 -7.550
192 HB3 HIS 29 2HB HIS 29 4.499 -8.687 -8.274
193 HD1 HIS 29 HD1 HIS 29 6.876 -7.781 -10.015
194 HD2 HIS 29 HD2 HIS 29 3.594 -5.401 -9.108
195 HE1 HIS 29 HE1 HIS 29 6.770 -6.057 -11.843
196 H SER 30 H SER 30 5.083 -8.071 -4.691
197 HA SER 30 HA SER 30 3.367 -10.369 -4.507
198 HB2 SER 30 1HB SER 30 5.503 -10.789 -3.659
199 HB3 SER 30 2HB SER 30 5.583 -9.239 -2.822
200 HG SER 30 HG SER 30 4.854 -11.566 -1.830
201 H HIS 31 H HIS 31 3.497 -7.176 -3.098
202 HA HIS 31 HA HIS 31 1.534 -7.734 -1.068
203 HB2 HIS 31 1HB HIS 31 2.939 -6.020 -0.399
204 HB3 HIS 31 2HB HIS 31 3.002 -5.301 -2.005
205 HD1 HIS 31 HD1 HIS 31 0.964 -5.356 1.125
206 HD2 HIS 31 HD2 HIS 31 0.947 -3.488 -2.586
207 HE1 HIS 31 HE1 HIS 31 -0.724 -3.502 1.314
208 H GLN 32 H GLN 32 1.576 -6.191 -4.244
209 HA GLN 32 HA GLN 32 -0.930 -5.064 -4.329
210 HB2 GLN 32 1HB GLN 32 0.780 -6.357 -6.423
211 HB3 GLN 32 2HB GLN 32 -0.832 -5.790 -6.837
212 HG2 GLN 32 1HG GLN 32 -0.222 -3.542 -6.059
213 HG3 GLN 32 2HG GLN 32 1.405 -4.123 -5.710
214 HE21 GLN 32 1HE2 GLN 32 2.444 -2.813 -7.150
215 HE22 GLN 32 2HE2 GLN 32 2.284 -2.966 -8.863
216 H ARG 33 H ARG 33 -0.079 -8.415 -4.300
217 HA ARG 33 HA ARG 33 -2.347 -9.562 -5.450
218 HB2 ARG 33 1HB ARG 33 -0.901 -10.737 -3.083
219 HB3 ARG 33 2HB ARG 33 -1.713 -11.586 -4.392
220 HG2 ARG 33 1HG ARG 33 0.012 -10.711 -5.951
221 HG3 ARG 33 2HG ARG 33 0.858 -10.031 -4.559
222 HD2 ARG 33 1HD ARG 33 1.904 -12.098 -4.995
223 HD3 ARG 33 2HD ARG 33 0.866 -12.373 -3.596
224 HE ARG 33 HE ARG 33 -0.331 -13.013 -6.146
225 HH11 ARG 33 1HH1 ARG 33 1.513 -14.173 -3.430
226 HH12 ARG 33 2HH1 ARG 33 1.098 -15.835 -3.692
227 HH21 ARG 33 1HH2 ARG 33 -0.884 -15.198 -6.501
228 HH22 ARG 33 2HH2 ARG 33 -0.264 -16.417 -5.439
229 H VAL 34 H VAL 34 -1.845 -8.163 -2.292
230 HA VAL 34 HA VAL 34 -4.035 -9.247 -0.929
231 HB VAL 34 HB VAL 34 -3.859 -7.390 0.604
232 HG11 VAL 34 1HG1 VAL 34 -1.406 -8.705 -0.409
233 HG12 VAL 34 2HG1 VAL 34 -1.195 -7.369 0.725
234 HG13 VAL 34 3HG1 VAL 34 -2.156 -8.775 1.185
235 HG21 VAL 34 3HG2 VAL 34 -2.770 -6.034 -1.747
236 HG22 VAL 34 1HG2 VAL 34 -3.593 -5.373 -0.334
237 HG23 VAL 34 2HG2 VAL 34 -1.867 -5.727 -0.263
238 H HIS 35 H HIS 35 -3.828 -6.681 -3.281
239 HA HIS 35 HA HIS 35 -6.466 -5.657 -2.771
240 HB2 HIS 35 1HB HIS 35 -4.445 -5.180 -4.957
241 HB3 HIS 35 2HB HIS 35 -6.045 -4.445 -4.980
242 HD1 HIS 35 HD1 HIS 35 -6.581 -2.836 -2.886
243 HD2 HIS 35 HD2 HIS 35 -2.593 -3.844 -3.465
244 HE1 HIS 35 HE1 HIS 35 -5.264 -1.157 -1.556
245 H THR 36 H THR 36 -5.069 -8.137 -4.735
246 HA THR 36 HA THR 36 -7.502 -8.410 -6.334
247 HB THR 36 HB THR 36 -6.268 -10.093 -7.620
248 HG1 THR 36 HG1 THR 36 -4.491 -9.820 -5.491
249 HG21 THR 36 3HG2 THR 36 -4.210 -8.006 -7.512
250 HG22 THR 36 1HG2 THR 36 -5.856 -7.394 -7.659
251 HG23 THR 36 2HG2 THR 36 -5.227 -8.526 -8.856
252 H GLY 37 H GLY 37 -7.852 -8.943 -3.621
253 HA2 GLY 37 1HA GLY 37 -8.874 -11.626 -3.763
254 HA3 GLY 37 2HA GLY 37 -7.521 -11.473 -2.653
255 H GLU 38 H GLU 38 -7.729 -9.928 -0.885
256 HA GLU 38 HA GLU 38 -10.390 -10.038 0.240
257 HB2 GLU 38 1HB GLU 38 -7.700 -9.195 1.285
258 HB3 GLU 38 2HB GLU 38 -9.169 -8.861 2.192
259 HG2 GLU 38 1HG GLU 38 -9.629 -11.138 2.502
260 HG3 GLU 38 2HG GLU 38 -8.476 -11.625 1.260
261 H LYS 39 H LYS 39 -11.067 -7.996 1.539
262 HA LYS 39 HA LYS 39 -10.691 -5.613 -0.151
263 HB2 LYS 39 1HB LYS 39 -13.231 -6.805 0.925
264 HB3 LYS 39 2HB LYS 39 -13.130 -5.090 0.549
265 HG2 LYS 39 1HG LYS 39 -12.476 -7.250 -1.437
266 HG3 LYS 39 2HG LYS 39 -14.086 -6.551 -1.254
267 HD2 LYS 39 1HD LYS 39 -11.659 -4.845 -1.734
268 HD3 LYS 39 2HD LYS 39 -12.568 -5.568 -3.063
269 HE2 LYS 39 1HE LYS 39 -14.059 -4.052 -0.981
270 HE3 LYS 39 2HE LYS 39 -13.118 -3.146 -2.165
271 HZ1 LYS 39 3HZ LYS 39 -15.241 -5.127 -2.791
272 HZ2 LYS 39 1HZ LYS 39 -14.333 -4.266 -3.931
273 HZ3 LYS 39 2HZ LYS 39 -15.394 -3.446 -2.900
274 HA PRO 40 HA PRO 40 -9.726 -3.433 3.539
275 HB2 PRO 40 1HB PRO 40 -10.560 -0.937 2.872
276 HB3 PRO 40 2HB PRO 40 -9.110 -1.680 2.187
277 HG2 PRO 40 1HG PRO 40 -11.854 -1.449 1.014
278 HG3 PRO 40 2HG PRO 40 -10.281 -1.202 0.236
279 HD2 PRO 40 1HD PRO 40 -11.704 -3.488 -0.050
280 HD3 PRO 40 2HD PRO 40 -9.929 -3.461 -0.057
281 H SER 41 H SER 41 -10.645 -2.915 5.463
282 HA SER 41 HA SER 41 -13.302 -3.558 5.993
283 HB2 SER 41 1HB SER 41 -11.167 -2.105 7.505
284 HB3 SER 41 2HB SER 41 -12.815 -2.089 8.133
285 HG SER 41 HG SER 41 -12.734 -4.425 7.968
286 H GLY 42 H GLY 42 -11.804 -0.336 5.718
287 HA2 GLY 42 1HA GLY 42 -14.519 0.766 5.324
288 HA3 GLY 42 2HA GLY 42 -13.215 1.650 6.104
289 HA PRO 43 HA PRO 43 -13.452 2.434 1.419
290 HB2 PRO 43 1HB PRO 43 -14.502 4.936 1.500
291 HB3 PRO 43 2HB PRO 43 -15.497 3.479 1.389
292 HG2 PRO 43 1HG PRO 43 -14.830 5.139 3.789
293 HG3 PRO 43 2HG PRO 43 -16.385 4.431 3.316
294 HD2 PRO 43 1HD PRO 43 -14.786 3.312 5.193
295 HD3 PRO 43 2HD PRO 43 -15.826 2.347 4.125
296 H SER 44 H SER 44 -11.134 2.427 1.916
297 HA SER 44 HA SER 44 -9.887 4.803 2.923
298 HB2 SER 44 1HB SER 44 -8.744 2.367 1.538
299 HB3 SER 44 2HB SER 44 -7.768 3.665 2.225
300 HG SER 44 HG SER 44 -9.647 2.119 3.687
301 H SER 45 H SER 45 -9.847 3.221 -0.275
302 HA SER 45 HA SER 45 -9.534 5.886 -1.484
303 HB2 SER 45 1HB SER 45 -7.995 4.968 -3.135
304 HB3 SER 45 2HB SER 45 -7.374 4.662 -1.513
305 HG SER 45 HG SER 45 -8.712 2.568 -1.917
306 H GLY 46 H GLY 46 -11.925 5.592 -1.600
307 HA2 GLY 46 1HA GLY 46 -13.670 5.474 -3.132
308 HA3 GLY 46 2HA GLY 46 -12.616 4.586 -4.223
Start of MODEL 18
1 H1 GLY 1 H GLY 1 -5.241 7.875 21.297
2 HA2 GLY 1 1HA GLY 1 -4.907 10.572 20.926
3 HA3 GLY 1 2HA GLY 1 -3.562 10.102 21.955
4 H SER 2 H SER 2 -4.022 10.923 18.984
5 HA SER 2 HA SER 2 -3.203 8.785 17.362
6 HB2 SER 2 1HB SER 2 -2.767 11.757 16.978
7 HB3 SER 2 2HB SER 2 -2.560 10.533 15.726
8 HG SER 2 HG SER 2 -4.890 11.551 16.861
9 H SER 3 H SER 3 -1.279 7.879 16.952
10 HA SER 3 HA SER 3 1.208 9.224 17.402
11 HB2 SER 3 1HB SER 3 0.598 8.578 19.725
12 HB3 SER 3 2HB SER 3 0.542 6.891 19.214
13 HG SER 3 HG SER 3 2.589 7.869 20.177
14 H GLY 4 H GLY 4 2.963 8.146 16.481
15 HA2 GLY 4 1HA GLY 4 3.157 5.501 15.731
16 HA3 GLY 4 2HA GLY 4 2.291 6.288 14.420
17 H SER 5 H SER 5 4.765 5.064 14.056
18 HA SER 5 HA SER 5 6.457 7.403 13.474
19 HB2 SER 5 1HB SER 5 7.227 4.747 14.649
20 HB3 SER 5 2HB SER 5 8.397 5.684 13.720
21 HG SER 5 HG SER 5 8.564 7.048 15.318
22 H SER 6 H SER 6 7.497 7.430 11.505
23 HA SER 6 HA SER 6 6.583 5.398 9.587
24 HB2 SER 6 1HB SER 6 5.980 7.824 9.202
25 HB3 SER 6 2HB SER 6 7.697 8.136 8.948
26 HG SER 6 HG SER 6 7.121 6.082 7.440
27 H GLY 7 H GLY 7 8.021 4.439 8.140
28 HA2 GLY 7 1HA GLY 7 10.755 4.282 9.120
29 HA3 GLY 7 2HA GLY 7 10.020 3.248 7.903
30 H SER 8 H SER 8 11.124 6.589 8.413
31 HA SER 8 HA SER 8 11.141 7.668 5.967
32 HB2 SER 8 1HB SER 8 12.144 8.784 7.902
33 HB3 SER 8 2HB SER 8 13.516 7.678 7.847
34 HG SER 8 HG SER 8 14.225 9.391 6.733
35 H GLY 9 H GLY 9 12.126 7.449 4.020
36 HA2 GLY 9 1HA GLY 9 14.505 6.348 3.324
37 HA3 GLY 9 2HA GLY 9 13.461 4.944 3.496
38 H GLU 10 H GLU 10 14.745 5.810 1.092
39 HA GLU 10 HA GLU 10 12.516 6.818 -0.525
40 HB2 GLU 10 1HB GLU 10 15.479 6.755 -0.862
41 HB3 GLU 10 2HB GLU 10 14.479 6.742 -2.307
42 HG2 GLU 10 1HG GLU 10 13.308 8.776 -1.225
43 HG3 GLU 10 2HG GLU 10 14.757 8.863 -0.225
44 H LYS 11 H LYS 11 11.328 5.462 -1.678
45 HA LYS 11 HA LYS 11 12.503 2.882 -2.481
46 HB2 LYS 11 1HB LYS 11 9.696 3.403 -1.487
47 HB3 LYS 11 2HB LYS 11 10.240 1.882 -2.183
48 HG2 LYS 11 1HG LYS 11 11.953 1.767 -0.358
49 HG3 LYS 11 2HG LYS 11 11.156 3.158 0.381
50 HD2 LYS 11 1HD LYS 11 9.009 1.707 0.166
51 HD3 LYS 11 2HD LYS 11 10.145 0.364 0.014
52 HE2 LYS 11 1HE LYS 11 11.095 0.834 2.152
53 HE3 LYS 11 2HE LYS 11 10.206 2.351 2.278
54 HZ1 LYS 11 3HZ LYS 11 8.454 0.144 1.870
55 HZ2 LYS 11 1HZ LYS 11 8.458 1.295 3.110
56 HZ3 LYS 11 2HZ LYS 11 9.417 -0.092 3.241
57 HA PRO 12 HA PRO 12 11.362 4.435 -6.500
58 HB2 PRO 12 1HB PRO 12 12.256 2.280 -7.888
59 HB3 PRO 12 2HB PRO 12 13.335 3.523 -7.243
60 HG2 PRO 12 1HG PRO 12 12.664 0.829 -6.123
61 HG3 PRO 12 2HG PRO 12 14.240 1.634 -6.231
62 HD2 PRO 12 1HD PRO 12 12.792 1.568 -3.944
63 HD3 PRO 12 2HD PRO 12 13.845 2.932 -4.367
64 H PHE 13 H PHE 13 10.207 1.632 -4.895
65 HA PHE 13 HA PHE 13 8.163 1.197 -6.963
66 HB2 PHE 13 1HB PHE 13 8.941 -0.611 -4.666
67 HB3 PHE 13 2HB PHE 13 7.792 -0.991 -5.945
68 HD1 PHE 13 HD2 PHE 13 8.555 -1.499 -8.193
69 HD2 PHE 13 HD1 PHE 13 11.312 -0.663 -5.060
70 HE1 PHE 13 HE2 PHE 13 10.380 -2.431 -9.555
71 HE2 PHE 13 HE1 PHE 13 13.142 -1.592 -6.418
72 HZ PHE 13 HZ PHE 13 12.677 -2.479 -8.668
73 H LYS 14 H LYS 14 6.056 1.550 -6.548
74 HA LYS 14 HA LYS 14 5.178 1.958 -3.790
75 HB2 LYS 14 1HB LYS 14 5.774 4.190 -4.556
76 HB3 LYS 14 2HB LYS 14 4.797 3.983 -6.003
77 HG2 LYS 14 1HG LYS 14 2.856 3.608 -4.313
78 HG3 LYS 14 2HG LYS 14 3.933 4.433 -3.184
79 HD2 LYS 14 1HD LYS 14 4.078 6.338 -4.707
80 HD3 LYS 14 2HD LYS 14 3.021 5.510 -5.853
81 HE2 LYS 14 1HE LYS 14 1.157 5.740 -4.492
82 HE3 LYS 14 2HE LYS 14 2.124 5.969 -3.036
83 HZ1 LYS 14 3HZ LYS 14 1.041 8.019 -3.847
84 HZ2 LYS 14 1HZ LYS 14 1.969 7.930 -5.259
85 HZ3 LYS 14 2HZ LYS 14 2.725 8.150 -3.762
86 H CYS 15 H CYS 15 3.266 1.034 -3.420
87 HA CYS 15 HA CYS 15 1.899 -0.337 -5.519
88 HB2 CYS 15 1HB CYS 15 2.077 -1.144 -3.145
89 HB3 CYS 15 2HB CYS 15 0.945 0.126 -2.688
90 H GLU 16 H GLU 16 1.019 1.049 -6.995
91 HA GLU 16 HA GLU 16 -0.270 3.460 -6.483
92 HB2 GLU 16 1HB GLU 16 -0.824 1.509 -8.726
93 HB3 GLU 16 2HB GLU 16 -1.288 3.204 -8.706
94 HG2 GLU 16 1HG GLU 16 1.049 3.865 -8.672
95 HG3 GLU 16 2HG GLU 16 1.539 2.172 -8.637
96 H GLU 17 H GLU 17 -1.371 0.215 -6.062
97 HA GLU 17 HA GLU 17 -4.134 0.531 -6.218
98 HB2 GLU 17 1HB GLU 17 -2.669 -1.242 -4.260
99 HB3 GLU 17 2HB GLU 17 -4.305 -1.460 -4.865
100 HG2 GLU 17 1HG GLU 17 -3.117 -1.543 -7.190
101 HG3 GLU 17 2HG GLU 17 -1.701 -1.948 -6.222
102 H CYS 18 H CYS 18 -2.027 0.808 -3.359
103 HA CYS 18 HA CYS 18 -4.160 2.373 -2.060
104 HB2 CYS 18 1HB CYS 18 -3.294 1.578 0.097
105 HB3 CYS 18 2HB CYS 18 -3.790 0.234 -0.926
106 H GLY 19 H GLY 19 -0.674 1.998 -2.511
107 HA2 GLY 19 1HA GLY 19 0.426 4.204 -3.033
108 HA3 GLY 19 2HA GLY 19 -0.335 4.773 -1.554
109 H LYS 20 H LYS 20 0.713 1.544 -1.407
110 HA LYS 20 HA LYS 20 2.556 2.066 0.667
111 HB2 LYS 20 1HB LYS 20 1.683 -0.317 -0.872
112 HB3 LYS 20 2HB LYS 20 3.235 -0.432 -0.054
113 HG2 LYS 20 1HG LYS 20 1.864 0.484 1.989
114 HG3 LYS 20 2HG LYS 20 0.501 -0.182 1.087
115 HD2 LYS 20 1HD LYS 20 1.263 -2.351 1.278
116 HD3 LYS 20 2HD LYS 20 2.942 -1.852 1.495
117 HE2 LYS 20 1HE LYS 20 0.768 -1.371 3.525
118 HE3 LYS 20 2HE LYS 20 1.838 -2.771 3.548
119 HZ1 LYS 20 3HZ LYS 20 2.319 -0.185 4.538
120 HZ2 LYS 20 1HZ LYS 20 3.437 -0.505 3.309
121 HZ3 LYS 20 2HZ LYS 20 3.311 -1.551 4.633
122 H ARG 21 H ARG 21 4.817 0.780 0.405
123 HA ARG 21 HA ARG 21 6.112 1.464 -2.109
124 HB2 ARG 21 1HB ARG 21 7.100 2.578 0.522
125 HB3 ARG 21 2HB ARG 21 7.860 2.788 -1.050
126 HG2 ARG 21 1HG ARG 21 5.607 3.864 -1.727
127 HG3 ARG 21 2HG ARG 21 5.351 4.011 0.013
128 HD2 ARG 21 1HD ARG 21 7.865 4.982 -1.313
129 HD3 ARG 21 2HD ARG 21 6.422 5.990 -1.204
130 HE ARG 21 HE ARG 21 8.201 5.247 0.954
131 HH11 ARG 21 1HH1 ARG 21 5.095 6.526 0.042
132 HH12 ARG 21 2HH1 ARG 21 4.832 7.323 1.558
133 HH21 ARG 21 1HH2 ARG 21 7.867 6.291 2.955
134 HH22 ARG 21 2HH2 ARG 21 6.410 7.189 3.214
135 H PHE 22 H PHE 22 8.210 0.506 -2.351
136 HA PHE 22 HA PHE 22 9.138 -1.332 -0.318
137 HB2 PHE 22 1HB PHE 22 8.401 -2.444 -3.026
138 HB3 PHE 22 2HB PHE 22 8.931 -3.336 -1.604
139 HD1 PHE 22 HD2 PHE 22 6.166 -1.247 -2.921
140 HD2 PHE 22 HD1 PHE 22 7.383 -4.167 -0.074
141 HE1 PHE 22 HE2 PHE 22 3.819 -1.574 -2.259
142 HE2 PHE 22 HE1 PHE 22 5.038 -4.499 0.593
143 HZ PHE 22 HZ PHE 22 3.252 -3.201 -0.499
144 H THR 23 H THR 23 11.252 -2.104 -0.693
145 HA THR 23 HA THR 23 12.828 -0.355 -2.369
146 HB THR 23 HB THR 23 13.580 -0.977 -0.086
147 HG1 THR 23 HG1 THR 23 15.548 -0.704 -0.815
148 HG21 THR 23 3HG2 THR 23 14.508 -3.190 0.324
149 HG22 THR 23 1HG2 THR 23 14.052 -3.703 -1.300
150 HG23 THR 23 2HG2 THR 23 12.805 -3.317 -0.114
151 H GLN 24 H GLN 24 11.292 -3.309 -2.784
152 HA GLN 24 HA GLN 24 12.844 -3.817 -5.210
153 HB2 GLN 24 1HB GLN 24 12.592 -5.627 -2.883
154 HB3 GLN 24 2HB GLN 24 12.369 -6.368 -4.461
155 HG2 GLN 24 1HG GLN 24 14.784 -4.901 -3.444
156 HG3 GLN 24 2HG GLN 24 14.651 -6.606 -3.874
157 HE21 GLN 24 1HE2 GLN 24 13.150 -6.203 -6.262
158 HE22 GLN 24 2HE2 GLN 24 14.217 -5.513 -7.432
159 H ASN 25 H ASN 25 11.687 -4.758 -6.885
160 HA ASN 25 HA ASN 25 8.940 -4.220 -6.993
161 HB2 ASN 25 1HB ASN 25 8.968 -5.418 -9.136
162 HB3 ASN 25 2HB ASN 25 10.354 -4.340 -8.996
163 HD21 ASN 25 1HD2 ASN 25 12.407 -5.272 -8.467
164 HD22 ASN 25 2HD2 ASN 25 12.751 -6.907 -8.907
165 H SER 26 H SER 26 10.657 -7.317 -6.656
166 HA SER 26 HA SER 26 8.593 -9.095 -6.677
167 HB2 SER 26 1HB SER 26 10.971 -9.099 -4.804
168 HB3 SER 26 2HB SER 26 9.931 -10.489 -5.111
169 HG SER 26 HG SER 26 10.542 -9.954 -7.443
170 H GLN 27 H GLN 27 9.443 -6.863 -4.112
171 HA GLN 27 HA GLN 27 7.681 -7.981 -2.164
172 HB2 GLN 27 1HB GLN 27 9.022 -5.282 -2.350
173 HB3 GLN 27 2HB GLN 27 8.072 -5.808 -0.968
174 HG2 GLN 27 1HG GLN 27 9.651 -7.770 -0.792
175 HG3 GLN 27 2HG GLN 27 10.667 -6.937 -1.967
176 HE21 GLN 27 1HE2 GLN 27 10.534 -4.363 -1.211
177 HE22 GLN 27 2HE2 GLN 27 11.180 -4.157 0.378
178 H LEU 28 H LEU 28 7.522 -5.022 -4.147
179 HA LEU 28 HA LEU 28 4.971 -4.210 -3.379
180 HB2 LEU 28 1HB LEU 28 6.343 -2.697 -4.575
181 HB3 LEU 28 2HB LEU 28 6.520 -3.816 -5.925
182 HG LEU 28 HG LEU 28 4.192 -3.454 -6.549
183 HD11 LEU 28 1HD1 LEU 28 3.852 -2.660 -3.935
184 HD12 LEU 28 2HD1 LEU 28 2.668 -2.502 -5.232
185 HD13 LEU 28 3HD1 LEU 28 3.730 -1.150 -4.838
186 HD21 LEU 28 3HD2 LEU 28 5.909 -1.993 -7.490
187 HD22 LEU 28 1HD2 LEU 28 5.703 -0.875 -6.142
188 HD23 LEU 28 2HD2 LEU 28 4.382 -1.134 -7.282
189 H HIS 29 H HIS 29 5.912 -6.103 -6.251
190 HA HIS 29 HA HIS 29 3.327 -6.572 -7.207
191 HB2 HIS 29 1HB HIS 29 5.835 -8.236 -7.491
192 HB3 HIS 29 2HB HIS 29 4.356 -8.514 -8.406
193 HD1 HIS 29 HD1 HIS 29 4.828 -7.759 -10.713
194 HD2 HIS 29 HD2 HIS 29 6.314 -5.105 -7.883
195 HE1 HIS 29 HE1 HIS 29 5.753 -5.824 -12.026
196 H SER 30 H SER 30 5.126 -8.079 -4.645
197 HA SER 30 HA SER 30 3.423 -10.389 -4.452
198 HB2 SER 30 1HB SER 30 5.764 -9.318 -2.961
199 HB3 SER 30 2HB SER 30 4.690 -10.413 -2.092
200 HG SER 30 HG SER 30 6.404 -11.492 -3.211
201 H HIS 31 H HIS 31 3.403 -7.165 -3.246
202 HA HIS 31 HA HIS 31 1.535 -7.763 -1.101
203 HB2 HIS 31 1HB HIS 31 2.887 -6.052 -0.377
204 HB3 HIS 31 2HB HIS 31 3.065 -5.367 -1.989
205 HD1 HIS 31 HD1 HIS 31 0.575 -5.517 0.853
206 HD2 HIS 31 HD2 HIS 31 1.388 -3.275 -2.549
207 HE1 HIS 31 HE1 HIS 31 -0.986 -3.548 0.956
208 H GLN 32 H GLN 32 1.561 -6.093 -4.222
209 HA GLN 32 HA GLN 32 -0.970 -5.018 -4.254
210 HB2 GLN 32 1HB GLN 32 0.781 -6.148 -6.407
211 HB3 GLN 32 2HB GLN 32 -0.846 -5.606 -6.799
212 HG2 GLN 32 1HG GLN 32 -0.331 -3.383 -5.985
213 HG3 GLN 32 2HG GLN 32 1.279 -3.914 -5.503
214 HE21 GLN 32 1HE2 GLN 32 1.873 -2.074 -6.900
215 HE22 GLN 32 2HE2 GLN 32 2.073 -2.367 -8.591
216 H ARG 33 H ARG 33 -0.095 -8.314 -4.169
217 HA ARG 33 HA ARG 33 -2.278 -9.495 -5.484
218 HB2 ARG 33 1HB ARG 33 -0.932 -10.697 -3.075
219 HB3 ARG 33 2HB ARG 33 -1.629 -11.522 -4.462
220 HG2 ARG 33 1HG ARG 33 0.191 -10.388 -5.839
221 HG3 ARG 33 2HG ARG 33 0.952 -10.007 -4.293
222 HD2 ARG 33 1HD ARG 33 1.887 -12.050 -5.187
223 HD3 ARG 33 2HD ARG 33 0.954 -12.406 -3.734
224 HE ARG 33 HE ARG 33 -0.849 -12.836 -5.669
225 HH11 ARG 33 1HH1 ARG 33 2.447 -13.892 -5.289
226 HH12 ARG 33 2HH1 ARG 33 2.210 -15.373 -6.155
227 HH21 ARG 33 1HH2 ARG 33 -1.174 -14.783 -6.812
228 HH22 ARG 33 2HH2 ARG 33 0.150 -15.878 -7.022
229 H VAL 34 H VAL 34 -1.937 -8.118 -2.298
230 HA VAL 34 HA VAL 34 -4.174 -9.274 -1.056
231 HB VAL 34 HB VAL 34 -4.043 -7.526 0.571
232 HG11 VAL 34 1HG1 VAL 34 -1.553 -8.707 -0.475
233 HG12 VAL 34 2HG1 VAL 34 -1.357 -7.369 0.659
234 HG13 VAL 34 3HG1 VAL 34 -2.269 -8.803 1.134
235 HG21 VAL 34 3HG2 VAL 34 -2.496 -6.023 -1.528
236 HG22 VAL 34 1HG2 VAL 34 -4.013 -5.563 -0.754
237 HG23 VAL 34 2HG2 VAL 34 -2.512 -5.558 0.173
238 H HIS 35 H HIS 35 -3.859 -6.590 -3.274
239 HA HIS 35 HA HIS 35 -6.503 -5.573 -2.856
240 HB2 HIS 35 1HB HIS 35 -4.395 -5.090 -4.954
241 HB3 HIS 35 2HB HIS 35 -5.993 -4.358 -5.061
242 HD1 HIS 35 HD1 HIS 35 -6.572 -2.518 -3.325
243 HD2 HIS 35 HD2 HIS 35 -2.698 -3.988 -3.035
244 HE1 HIS 35 HE1 HIS 35 -5.348 -0.898 -1.842
245 H THR 36 H THR 36 -5.143 -8.133 -4.686
246 HA THR 36 HA THR 36 -7.456 -8.302 -6.466
247 HB THR 36 HB THR 36 -6.234 -10.153 -7.557
248 HG1 THR 36 HG1 THR 36 -4.268 -9.552 -5.583
249 HG21 THR 36 3HG2 THR 36 -5.782 -7.518 -7.837
250 HG22 THR 36 1HG2 THR 36 -4.964 -8.745 -8.804
251 HG23 THR 36 2HG2 THR 36 -4.160 -8.051 -7.395
252 H GLY 37 H GLY 37 -7.929 -8.734 -3.697
253 HA2 GLY 37 1HA GLY 37 -8.634 -11.604 -3.743
254 HA3 GLY 37 2HA GLY 37 -8.097 -10.795 -2.278
255 H GLU 38 H GLU 38 -9.680 -10.311 -0.926
256 HA GLU 38 HA GLU 38 -12.216 -9.314 -1.992
257 HB2 GLU 38 1HB GLU 38 -12.247 -11.853 -1.469
258 HB3 GLU 38 2HB GLU 38 -12.236 -11.351 0.216
259 HG2 GLU 38 1HG GLU 38 -14.488 -11.704 -0.340
260 HG3 GLU 38 2HG GLU 38 -14.267 -9.955 -0.310
261 H LYS 39 H LYS 39 -12.203 -7.317 -1.163
262 HA LYS 39 HA LYS 39 -12.195 -7.035 1.735
263 HB2 LYS 39 1HB LYS 39 -10.569 -5.239 1.745
264 HB3 LYS 39 2HB LYS 39 -9.844 -6.682 1.048
265 HG2 LYS 39 1HG LYS 39 -9.118 -5.161 -0.462
266 HG3 LYS 39 2HG LYS 39 -10.672 -5.550 -1.203
267 HD2 LYS 39 1HD LYS 39 -10.821 -3.273 -1.210
268 HD3 LYS 39 2HD LYS 39 -11.498 -3.595 0.388
269 HE2 LYS 39 1HE LYS 39 -8.555 -3.213 0.118
270 HE3 LYS 39 2HE LYS 39 -9.604 -1.799 0.044
271 HZ1 LYS 39 3HZ LYS 39 -10.561 -3.090 2.194
272 HZ2 LYS 39 1HZ LYS 39 -9.413 -1.848 2.258
273 HZ3 LYS 39 2HZ LYS 39 -8.914 -3.464 2.299
274 HA PRO 40 HA PRO 40 -15.479 -4.259 0.778
275 HB2 PRO 40 1HB PRO 40 -15.591 -2.921 3.138
276 HB3 PRO 40 2HB PRO 40 -16.174 -4.578 2.945
277 HG2 PRO 40 1HG PRO 40 -13.574 -3.603 4.062
278 HG3 PRO 40 2HG PRO 40 -14.639 -4.886 4.664
279 HD2 PRO 40 1HD PRO 40 -12.401 -5.404 3.231
280 HD3 PRO 40 2HD PRO 40 -13.848 -6.429 3.145
281 H SER 41 H SER 41 -15.629 -2.326 -0.199
282 HA SER 41 HA SER 41 -13.341 -0.705 -0.568
283 HB2 SER 41 1HB SER 41 -14.949 0.852 -1.716
284 HB3 SER 41 2HB SER 41 -14.998 -0.808 -2.311
285 HG SER 41 HG SER 41 -16.849 0.542 -0.666
286 H GLY 42 H GLY 42 -13.424 1.729 -0.211
287 HA2 GLY 42 1HA GLY 42 -14.915 2.661 2.070
288 HA3 GLY 42 2HA GLY 42 -13.215 2.388 2.419
289 HA PRO 43 HA PRO 43 -12.393 6.476 1.045
290 HB2 PRO 43 1HB PRO 43 -9.763 6.224 0.422
291 HB3 PRO 43 2HB PRO 43 -10.356 6.262 2.086
292 HG2 PRO 43 1HG PRO 43 -9.594 3.908 0.401
293 HG3 PRO 43 2HG PRO 43 -9.226 4.230 2.106
294 HD2 PRO 43 1HD PRO 43 -11.214 2.561 1.335
295 HD3 PRO 43 2HD PRO 43 -11.306 3.535 2.817
296 H SER 44 H SER 44 -11.422 7.673 -0.835
297 HA SER 44 HA SER 44 -12.040 6.234 -3.324
298 HB2 SER 44 1HB SER 44 -13.456 8.192 -2.881
299 HB3 SER 44 2HB SER 44 -12.022 9.212 -2.770
300 HG SER 44 HG SER 44 -11.980 7.831 -5.070
301 H SER 45 H SER 45 -10.577 6.077 -4.938
302 HA SER 45 HA SER 45 -7.886 6.123 -4.503
303 HB2 SER 45 1HB SER 45 -9.273 6.680 -7.137
304 HB3 SER 45 2HB SER 45 -7.596 6.168 -6.953
305 HG SER 45 HG SER 45 -8.507 4.282 -5.837
306 H GLY 46 H GLY 46 -6.254 7.539 -5.752
307 HA2 GLY 46 1HA GLY 46 -6.769 10.304 -4.939
308 HA3 GLY 46 2HA GLY 46 -5.197 9.605 -5.297
Start of MODEL 19
1 H1 GLY 1 H GLY 1 -1.197 10.977 21.632
2 HA2 GLY 1 1HA GLY 1 -2.156 8.873 20.644
3 HA3 GLY 1 2HA GLY 1 -2.446 9.841 19.207
4 H SER 2 H SER 2 -1.045 9.425 17.649
5 HA SER 2 HA SER 2 1.794 9.403 18.196
6 HB2 SER 2 1HB SER 2 0.277 6.932 17.484
7 HB3 SER 2 2HB SER 2 1.875 7.161 16.775
8 HG SER 2 HG SER 2 1.801 6.031 18.850
9 H SER 3 H SER 3 2.561 10.732 16.705
10 HA SER 3 HA SER 3 1.191 11.106 14.187
11 HB2 SER 3 1HB SER 3 2.819 12.897 13.805
12 HB3 SER 3 2HB SER 3 2.116 13.038 15.416
13 HG SER 3 HG SER 3 4.513 13.218 15.162
14 H GLY 4 H GLY 4 2.662 11.326 12.178
15 HA2 GLY 4 1HA GLY 4 4.694 10.469 11.104
16 HA3 GLY 4 2HA GLY 4 4.533 9.040 12.113
17 H SER 5 H SER 5 3.286 10.749 9.328
18 HA SER 5 HA SER 5 1.756 8.347 8.579
19 HB2 SER 5 1HB SER 5 1.413 11.164 7.527
20 HB3 SER 5 2HB SER 5 0.382 9.777 7.177
21 HG SER 5 HG SER 5 0.306 9.823 9.699
22 H SER 6 H SER 6 3.912 10.865 7.324
23 HA SER 6 HA SER 6 4.205 9.727 4.745
24 HB2 SER 6 1HB SER 6 4.722 12.061 5.074
25 HB3 SER 6 2HB SER 6 5.945 11.668 6.282
26 HG SER 6 HG SER 6 7.051 11.988 4.417
27 H GLY 7 H GLY 7 6.442 9.785 7.529
28 HA2 GLY 7 1HA GLY 7 7.948 8.195 8.250
29 HA3 GLY 7 2HA GLY 7 7.229 7.068 7.108
30 H SER 8 H SER 8 9.916 8.985 7.817
31 HA SER 8 HA SER 8 10.987 9.715 5.398
32 HB2 SER 8 1HB SER 8 12.016 10.178 7.617
33 HB3 SER 8 2HB SER 8 12.539 8.496 7.695
34 HG SER 8 HG SER 8 14.103 10.091 6.866
35 H GLY 9 H GLY 9 12.835 8.672 4.217
36 HA2 GLY 9 1HA GLY 9 13.920 6.471 3.773
37 HA3 GLY 9 2HA GLY 9 12.310 5.780 3.908
38 H GLU 10 H GLU 10 13.937 5.390 1.675
39 HA GLU 10 HA GLU 10 12.383 6.822 -0.372
40 HB2 GLU 10 1HB GLU 10 14.388 6.812 -1.827
41 HB3 GLU 10 2HB GLU 10 14.601 7.786 -0.378
42 HG2 GLU 10 1HG GLU 10 16.583 6.689 -0.382
43 HG3 GLU 10 2HG GLU 10 15.626 5.543 0.556
44 H LYS 11 H LYS 11 11.400 5.546 -1.803
45 HA LYS 11 HA LYS 11 12.434 2.854 -2.297
46 HB2 LYS 11 1HB LYS 11 9.640 3.501 -1.358
47 HB3 LYS 11 2HB LYS 11 10.058 1.981 -2.139
48 HG2 LYS 11 1HG LYS 11 11.433 1.317 -0.360
49 HG3 LYS 11 2HG LYS 11 11.489 2.948 0.315
50 HD2 LYS 11 1HD LYS 11 9.219 2.819 1.020
51 HD3 LYS 11 2HD LYS 11 8.955 1.329 0.111
52 HE2 LYS 11 1HE LYS 11 9.196 0.650 2.347
53 HE3 LYS 11 2HE LYS 11 10.748 0.296 1.590
54 HZ1 LYS 11 3HZ LYS 11 10.503 1.612 3.883
55 HZ2 LYS 11 1HZ LYS 11 10.499 2.920 2.810
56 HZ3 LYS 11 2HZ LYS 11 11.800 1.839 2.821
57 HA PRO 12 HA PRO 12 11.530 4.310 -6.408
58 HB2 PRO 12 1HB PRO 12 12.405 2.082 -7.690
59 HB3 PRO 12 2HB PRO 12 13.500 3.303 -7.031
60 HG2 PRO 12 1HG PRO 12 12.675 0.672 -5.865
61 HG3 PRO 12 2HG PRO 12 14.284 1.415 -5.922
62 HD2 PRO 12 1HD PRO 12 12.730 1.473 -3.705
63 HD3 PRO 12 2HD PRO 12 13.854 2.784 -4.118
64 H PHE 13 H PHE 13 10.272 1.495 -4.844
65 HA PHE 13 HA PHE 13 8.252 1.162 -6.955
66 HB2 PHE 13 1HB PHE 13 8.954 -0.723 -4.694
67 HB3 PHE 13 2HB PHE 13 7.820 -1.044 -6.002
68 HD1 PHE 13 HD2 PHE 13 8.611 -1.508 -8.250
69 HD2 PHE 13 HD1 PHE 13 11.330 -0.812 -5.050
70 HE1 PHE 13 HE2 PHE 13 10.440 -2.441 -9.606
71 HE2 PHE 13 HE1 PHE 13 13.164 -1.742 -6.402
72 HZ PHE 13 HZ PHE 13 12.720 -2.560 -8.682
73 H LYS 14 H LYS 14 6.155 1.576 -6.570
74 HA LYS 14 HA LYS 14 5.235 1.920 -3.815
75 HB2 LYS 14 1HB LYS 14 5.854 4.159 -4.443
76 HB3 LYS 14 2HB LYS 14 5.013 4.014 -5.981
77 HG2 LYS 14 1HG LYS 14 2.927 3.602 -4.456
78 HG3 LYS 14 2HG LYS 14 3.911 4.429 -3.247
79 HD2 LYS 14 1HD LYS 14 4.234 6.274 -4.928
80 HD3 LYS 14 2HD LYS 14 3.023 5.473 -5.932
81 HE2 LYS 14 1HE LYS 14 1.723 6.983 -4.786
82 HE3 LYS 14 2HE LYS 14 1.586 5.564 -3.750
83 HZ1 LYS 14 3HZ LYS 14 2.376 6.776 -2.093
84 HZ2 LYS 14 1HZ LYS 14 2.586 8.112 -3.109
85 HZ3 LYS 14 2HZ LYS 14 3.833 6.985 -2.926
86 H CYS 15 H CYS 15 3.294 1.035 -3.500
87 HA CYS 15 HA CYS 15 1.929 -0.235 -5.671
88 HB2 CYS 15 1HB CYS 15 2.076 -1.164 -3.346
89 HB3 CYS 15 2HB CYS 15 0.979 0.110 -2.821
90 H GLU 16 H GLU 16 0.707 0.862 -7.052
91 HA GLU 16 HA GLU 16 -0.421 3.406 -6.483
92 HB2 GLU 16 1HB GLU 16 -1.100 1.516 -8.742
93 HB3 GLU 16 2HB GLU 16 -1.449 3.237 -8.684
94 HG2 GLU 16 1HG GLU 16 0.981 3.686 -8.613
95 HG3 GLU 16 2HG GLU 16 1.271 1.958 -8.801
96 H GLU 17 H GLU 17 -1.523 0.162 -6.079
97 HA GLU 17 HA GLU 17 -4.290 0.501 -6.161
98 HB2 GLU 17 1HB GLU 17 -2.781 -1.335 -4.296
99 HB3 GLU 17 2HB GLU 17 -4.439 -1.522 -4.848
100 HG2 GLU 17 1HG GLU 17 -3.323 -1.548 -7.216
101 HG3 GLU 17 2HG GLU 17 -1.889 -2.010 -6.300
102 H CYS 18 H CYS 18 -2.087 0.721 -3.373
103 HA CYS 18 HA CYS 18 -4.180 2.242 -1.961
104 HB2 CYS 18 1HB CYS 18 -3.203 1.414 0.146
105 HB3 CYS 18 2HB CYS 18 -3.770 0.095 -0.874
106 H GLY 19 H GLY 19 -0.737 1.937 -2.647
107 HA2 GLY 19 1HA GLY 19 0.384 4.096 -3.130
108 HA3 GLY 19 2HA GLY 19 -0.390 4.707 -1.676
109 H LYS 20 H LYS 20 0.672 1.486 -1.436
110 HA LYS 20 HA LYS 20 2.482 2.062 0.649
111 HB2 LYS 20 1HB LYS 20 1.646 -0.352 -0.855
112 HB3 LYS 20 2HB LYS 20 3.203 -0.441 -0.041
113 HG2 LYS 20 1HG LYS 20 1.768 0.532 1.972
114 HG3 LYS 20 2HG LYS 20 0.471 -0.279 1.089
115 HD2 LYS 20 1HD LYS 20 1.364 -2.367 1.427
116 HD3 LYS 20 2HD LYS 20 3.014 -1.757 1.568
117 HE2 LYS 20 1HE LYS 20 2.189 -2.565 3.716
118 HE3 LYS 20 2HE LYS 20 2.486 -0.828 3.765
119 HZ1 LYS 20 3HZ LYS 20 -0.110 -2.239 3.656
120 HZ2 LYS 20 1HZ LYS 20 0.027 -0.602 3.252
121 HZ3 LYS 20 2HZ LYS 20 0.435 -1.126 4.807
122 H ARG 21 H ARG 21 4.759 0.774 0.425
123 HA ARG 21 HA ARG 21 6.081 1.477 -2.072
124 HB2 ARG 21 1HB ARG 21 6.951 2.596 0.599
125 HB3 ARG 21 2HB ARG 21 7.861 2.730 -0.900
126 HG2 ARG 21 1HG ARG 21 5.688 3.843 -1.801
127 HG3 ARG 21 2HG ARG 21 5.336 4.091 -0.089
128 HD2 ARG 21 1HD ARG 21 7.986 4.870 -1.250
129 HD3 ARG 21 2HD ARG 21 6.590 5.939 -1.384
130 HE ARG 21 HE ARG 21 8.097 5.326 1.007
131 HH11 ARG 21 1HH1 ARG 21 5.153 6.614 -0.331
132 HH12 ARG 21 2HH1 ARG 21 4.765 7.543 1.079
133 HH21 ARG 21 1HH2 ARG 21 7.597 6.545 2.869
134 HH22 ARG 21 2HH2 ARG 21 6.156 7.504 2.898
135 H PHE 22 H PHE 22 8.207 0.545 -2.279
136 HA PHE 22 HA PHE 22 9.089 -1.339 -0.269
137 HB2 PHE 22 1HB PHE 22 8.416 -2.395 -3.016
138 HB3 PHE 22 2HB PHE 22 8.913 -3.315 -1.601
139 HD1 PHE 22 HD2 PHE 22 6.168 -1.297 -3.030
140 HD2 PHE 22 HD1 PHE 22 7.340 -4.085 -0.035
141 HE1 PHE 22 HE2 PHE 22 3.807 -1.640 -2.430
142 HE2 PHE 22 HE1 PHE 22 4.980 -4.433 0.569
143 HZ PHE 22 HZ PHE 22 3.210 -3.209 -0.628
144 H THR 23 H THR 23 11.199 -2.179 -0.678
145 HA THR 23 HA THR 23 12.842 -0.349 -2.182
146 HB THR 23 HB THR 23 13.530 -1.237 0.046
147 HG1 THR 23 HG1 THR 23 15.549 -0.988 -0.584
148 HG21 THR 23 3HG2 THR 23 14.025 -3.803 -1.468
149 HG22 THR 23 1HG2 THR 23 12.728 -3.554 -0.300
150 HG23 THR 23 2HG2 THR 23 14.411 -3.489 0.224
151 H GLN 24 H GLN 24 11.280 -3.279 -2.828
152 HA GLN 24 HA GLN 24 12.749 -3.533 -5.339
153 HB2 GLN 24 1HB GLN 24 12.661 -5.550 -3.172
154 HB3 GLN 24 2HB GLN 24 12.416 -6.154 -4.805
155 HG2 GLN 24 1HG GLN 24 14.794 -4.636 -3.763
156 HG3 GLN 24 2HG GLN 24 14.733 -6.327 -4.256
157 HE21 GLN 24 1HE2 GLN 24 13.215 -6.025 -6.589
158 HE22 GLN 24 2HE2 GLN 24 14.175 -5.192 -7.759
159 H ASN 25 H ASN 25 11.606 -4.837 -6.943
160 HA ASN 25 HA ASN 25 8.845 -4.209 -7.018
161 HB2 ASN 25 1HB ASN 25 8.848 -5.080 -9.183
162 HB3 ASN 25 2HB ASN 25 10.520 -4.567 -8.973
163 HD21 ASN 25 1HD2 ASN 25 12.000 -6.291 -8.121
164 HD22 ASN 25 2HD2 ASN 25 11.798 -7.882 -8.765
165 H SER 26 H SER 26 10.574 -7.303 -6.690
166 HA SER 26 HA SER 26 8.550 -9.100 -6.622
167 HB2 SER 26 1HB SER 26 11.096 -8.916 -5.053
168 HB3 SER 26 2HB SER 26 9.956 -10.214 -4.697
169 HG SER 26 HG SER 26 11.228 -11.040 -6.256
170 H GLN 27 H GLN 27 9.452 -6.890 -4.024
171 HA GLN 27 HA GLN 27 7.655 -7.939 -2.096
172 HB2 GLN 27 1HB GLN 27 9.009 -5.252 -2.337
173 HB3 GLN 27 2HB GLN 27 8.023 -5.718 -0.958
174 HG2 GLN 27 1HG GLN 27 9.577 -7.701 -0.699
175 HG3 GLN 27 2HG GLN 27 10.632 -6.893 -1.857
176 HE21 GLN 27 1HE2 GLN 27 10.468 -4.300 -1.144
177 HE22 GLN 27 2HE2 GLN 27 11.073 -4.070 0.457
178 H LEU 28 H LEU 28 7.486 -5.010 -4.124
179 HA LEU 28 HA LEU 28 4.916 -4.222 -3.379
180 HB2 LEU 28 1HB LEU 28 6.325 -2.710 -4.561
181 HB3 LEU 28 2HB LEU 28 6.461 -3.813 -5.929
182 HG LEU 28 HG LEU 28 4.146 -3.405 -6.527
183 HD11 LEU 28 1HD1 LEU 28 2.673 -2.071 -5.327
184 HD12 LEU 28 2HD1 LEU 28 3.962 -1.313 -4.393
185 HD13 LEU 28 3HD1 LEU 28 3.504 -2.985 -4.067
186 HD21 LEU 28 3HD2 LEU 28 4.423 -1.275 -7.425
187 HD22 LEU 28 1HD2 LEU 28 6.077 -1.834 -7.177
188 HD23 LEU 28 2HD2 LEU 28 5.349 -0.703 -6.036
189 H HIS 29 H HIS 29 5.900 -6.040 -6.288
190 HA HIS 29 HA HIS 29 3.335 -6.558 -7.253
191 HB2 HIS 29 1HB HIS 29 5.997 -7.882 -7.607
192 HB3 HIS 29 2HB HIS 29 4.556 -8.657 -8.258
193 HD1 HIS 29 HD1 HIS 29 3.940 -7.964 -10.551
194 HD2 HIS 29 HD2 HIS 29 6.261 -5.097 -8.638
195 HE1 HIS 29 HE1 HIS 29 4.363 -6.182 -12.275
196 H SER 30 H SER 30 5.129 -8.043 -4.681
197 HA SER 30 HA SER 30 3.446 -10.381 -4.531
198 HB2 SER 30 1HB SER 30 5.671 -10.743 -3.812
199 HB3 SER 30 2HB SER 30 5.668 -9.294 -2.807
200 HG SER 30 HG SER 30 5.402 -11.364 -1.685
201 H HIS 31 H HIS 31 3.410 -7.177 -3.300
202 HA HIS 31 HA HIS 31 1.577 -7.818 -1.132
203 HB2 HIS 31 1HB HIS 31 2.943 -6.125 -0.389
204 HB3 HIS 31 2HB HIS 31 3.099 -5.403 -1.988
205 HD1 HIS 31 HD1 HIS 31 0.816 -5.492 0.994
206 HD2 HIS 31 HD2 HIS 31 1.245 -3.429 -2.587
207 HE1 HIS 31 HE1 HIS 31 -0.787 -3.560 1.135
208 H GLN 32 H GLN 32 1.576 -6.126 -4.237
209 HA GLN 32 HA GLN 32 -0.922 -4.998 -4.249
210 HB2 GLN 32 1HB GLN 32 0.740 -6.237 -6.414
211 HB3 GLN 32 2HB GLN 32 -0.876 -5.646 -6.780
212 HG2 GLN 32 1HG GLN 32 -0.214 -3.431 -5.892
213 HG3 GLN 32 2HG GLN 32 1.425 -4.047 -5.686
214 HE21 GLN 32 1HE2 GLN 32 2.241 -2.505 -7.115
215 HE22 GLN 32 2HE2 GLN 32 2.016 -2.634 -8.823
216 H ARG 33 H ARG 33 -0.092 -8.361 -4.391
217 HA ARG 33 HA ARG 33 -2.374 -9.462 -5.527
218 HB2 ARG 33 1HB ARG 33 -1.026 -10.745 -3.170
219 HB3 ARG 33 2HB ARG 33 -1.715 -11.507 -4.597
220 HG2 ARG 33 1HG ARG 33 0.170 -10.210 -5.850
221 HG3 ARG 33 2HG ARG 33 0.920 -10.163 -4.253
222 HD2 ARG 33 1HD ARG 33 0.885 -12.560 -4.106
223 HD3 ARG 33 2HD ARG 33 -0.048 -12.680 -5.597
224 HE ARG 33 HE ARG 33 2.505 -11.365 -5.875
225 HH11 ARG 33 1HH1 ARG 33 0.777 -14.385 -5.975
226 HH12 ARG 33 2HH1 ARG 33 1.947 -15.172 -6.981
227 HH21 ARG 33 1HH2 ARG 33 4.054 -12.389 -7.200
228 HH22 ARG 33 2HH2 ARG 33 3.811 -14.036 -7.677
229 H VAL 34 H VAL 34 -1.850 -8.176 -2.315
230 HA VAL 34 HA VAL 34 -4.040 -9.255 -0.974
231 HB VAL 34 HB VAL 34 -3.845 -7.466 0.601
232 HG11 VAL 34 1HG1 VAL 34 -1.436 -8.718 -0.506
233 HG12 VAL 34 2HG1 VAL 34 -1.133 -7.292 0.488
234 HG13 VAL 34 3HG1 VAL 34 -2.026 -8.659 1.155
235 HG21 VAL 34 3HG2 VAL 34 -3.883 -5.510 -0.692
236 HG22 VAL 34 1HG2 VAL 34 -2.277 -5.524 0.038
237 HG23 VAL 34 2HG2 VAL 34 -2.485 -6.008 -1.645
238 H HIS 35 H HIS 35 -3.850 -6.626 -3.271
239 HA HIS 35 HA HIS 35 -6.497 -5.642 -2.755
240 HB2 HIS 35 1HB HIS 35 -4.493 -5.127 -4.950
241 HB3 HIS 35 2HB HIS 35 -6.094 -4.392 -4.940
242 HD1 HIS 35 HD1 HIS 35 -6.583 -2.672 -3.009
243 HD2 HIS 35 HD2 HIS 35 -2.643 -3.965 -3.262
244 HE1 HIS 35 HE1 HIS 35 -5.253 -1.054 -1.617
245 H THR 36 H THR 36 -5.163 -8.208 -4.572
246 HA THR 36 HA THR 36 -7.459 -8.401 -6.360
247 HB THR 36 HB THR 36 -6.295 -10.122 -7.514
248 HG1 THR 36 HG1 THR 36 -4.064 -10.600 -6.377
249 HG21 THR 36 3HG2 THR 36 -5.365 -7.665 -7.502
250 HG22 THR 36 1HG2 THR 36 -4.486 -8.950 -8.328
251 HG23 THR 36 2HG2 THR 36 -3.973 -8.419 -6.726
252 H GLY 37 H GLY 37 -8.089 -8.682 -3.639
253 HA2 GLY 37 1HA GLY 37 -9.192 -11.385 -3.689
254 HA3 GLY 37 2HA GLY 37 -8.174 -10.974 -2.316
255 H GLU 38 H GLU 38 -8.930 -8.357 -1.848
256 HA GLU 38 HA GLU 38 -11.821 -8.299 -1.577
257 HB2 GLU 38 1HB GLU 38 -10.808 -9.566 0.412
258 HB3 GLU 38 2HB GLU 38 -10.146 -8.015 0.908
259 HG2 GLU 38 1HG GLU 38 -12.339 -7.080 1.132
260 HG3 GLU 38 2HG GLU 38 -13.073 -8.531 0.450
261 H LYS 39 H LYS 39 -12.640 -6.255 -1.419
262 HA LYS 39 HA LYS 39 -10.669 -4.064 -1.425
263 HB2 LYS 39 1HB LYS 39 -12.143 -2.822 -2.866
264 HB3 LYS 39 2HB LYS 39 -11.890 -4.414 -3.569
265 HG2 LYS 39 1HG LYS 39 -14.076 -5.075 -2.436
266 HG3 LYS 39 2HG LYS 39 -14.330 -3.345 -2.192
267 HD2 LYS 39 1HD LYS 39 -14.072 -3.009 -4.634
268 HD3 LYS 39 2HD LYS 39 -13.942 -4.759 -4.831
269 HE2 LYS 39 1HE LYS 39 -16.197 -4.125 -5.310
270 HE3 LYS 39 2HE LYS 39 -16.186 -4.971 -3.763
271 HZ1 LYS 39 3HZ LYS 39 -16.096 -2.018 -3.955
272 HZ2 LYS 39 1HZ LYS 39 -16.450 -2.965 -2.599
273 HZ3 LYS 39 2HZ LYS 39 -17.551 -2.877 -3.879
274 HA PRO 40 HA PRO 40 -12.574 -2.523 2.237
275 HB2 PRO 40 1HB PRO 40 -11.738 0.055 2.081
276 HB3 PRO 40 2HB PRO 40 -10.664 -1.279 2.522
277 HG2 PRO 40 1HG PRO 40 -11.003 0.087 -0.121
278 HG3 PRO 40 2HG PRO 40 -9.511 -0.416 0.695
279 HD2 PRO 40 1HD PRO 40 -10.631 -1.853 -1.308
280 HD3 PRO 40 2HD PRO 40 -9.735 -2.610 0.024
281 H SER 41 H SER 41 -14.142 -0.935 2.969
282 HA SER 41 HA SER 41 -15.841 0.073 0.780
283 HB2 SER 41 1HB SER 41 -16.512 -1.426 3.263
284 HB3 SER 41 2HB SER 41 -17.638 -0.170 2.748
285 HG SER 41 HG SER 41 -18.302 -1.470 1.251
286 H GLY 42 H GLY 42 -16.902 2.060 1.090
287 HA2 GLY 42 1HA GLY 42 -16.312 3.599 3.489
288 HA3 GLY 42 2HA GLY 42 -15.589 4.194 2.002
289 HA PRO 43 HA PRO 43 -20.438 4.770 2.099
290 HB2 PRO 43 1HB PRO 43 -21.188 5.808 4.493
291 HB3 PRO 43 2HB PRO 43 -21.213 4.075 4.148
292 HG2 PRO 43 1HG PRO 43 -19.160 5.684 5.616
293 HG3 PRO 43 2HG PRO 43 -19.835 4.095 6.021
294 HD2 PRO 43 1HD PRO 43 -17.416 4.393 4.841
295 HD3 PRO 43 2HD PRO 43 -18.463 2.994 4.531
296 H SER 44 H SER 44 -17.721 6.546 2.824
297 HA SER 44 HA SER 44 -18.777 9.150 3.149
298 HB2 SER 44 1HB SER 44 -16.360 8.258 3.551
299 HB3 SER 44 2HB SER 44 -16.121 8.634 1.845
300 HG SER 44 HG SER 44 -16.973 10.786 2.435
301 H SER 45 H SER 45 -17.424 7.512 0.288
302 HA SER 45 HA SER 45 -18.102 9.620 -1.498
303 HB2 SER 45 1HB SER 45 -17.441 8.086 -3.267
304 HB3 SER 45 2HB SER 45 -16.290 7.973 -1.935
305 HG SER 45 HG SER 45 -18.328 6.159 -2.667
306 H GLY 46 H GLY 46 -19.872 9.939 -2.746
307 HA2 GLY 46 1HA GLY 46 -21.866 7.861 -3.069
308 HA3 GLY 46 2HA GLY 46 -22.372 9.210 -2.064
Start of MODEL 20
1 H1 GLY 1 H GLY 1 0.852 11.479 6.918
2 HA2 GLY 1 1HA GLY 1 0.463 13.495 5.696
3 HA3 GLY 1 2HA GLY 1 -0.304 14.174 7.125
4 H SER 2 H SER 2 1.112 14.649 8.980
5 HA SER 2 HA SER 2 3.817 15.401 8.078
6 HB2 SER 2 1HB SER 2 2.030 16.863 10.037
7 HB3 SER 2 2HB SER 2 3.670 17.338 9.597
8 HG SER 2 HG SER 2 1.742 16.979 7.587
9 H SER 3 H SER 3 5.263 15.879 10.079
10 HA SER 3 HA SER 3 6.456 14.995 11.803
11 HB2 SER 3 1HB SER 3 4.170 15.643 12.900
12 HB3 SER 3 2HB SER 3 3.929 13.899 12.993
13 HG SER 3 HG SER 3 5.476 13.745 14.451
14 H GLY 4 H GLY 4 6.309 13.396 9.534
15 HA2 GLY 4 1HA GLY 4 5.862 10.667 10.507
16 HA3 GLY 4 2HA GLY 4 6.129 11.138 8.835
17 H SER 5 H SER 5 7.670 9.391 8.753
18 HA SER 5 HA SER 5 10.246 10.100 9.999
19 HB2 SER 5 1HB SER 5 9.107 7.371 9.365
20 HB3 SER 5 2HB SER 5 10.789 7.644 9.819
21 HG SER 5 HG SER 5 10.102 7.560 11.794
22 H SER 6 H SER 6 10.576 11.452 8.098
23 HA SER 6 HA SER 6 11.564 9.867 5.824
24 HB2 SER 6 1HB SER 6 9.436 10.976 5.214
25 HB3 SER 6 2HB SER 6 10.147 12.537 5.626
26 HG SER 6 HG SER 6 11.671 11.071 3.889
27 H GLY 7 H GLY 7 13.656 10.001 6.760
28 HA2 GLY 7 1HA GLY 7 14.864 12.690 6.534
29 HA3 GLY 7 2HA GLY 7 15.344 11.536 7.770
30 H SER 8 H SER 8 15.381 9.215 6.144
31 HA SER 8 HA SER 8 17.138 9.695 3.912
32 HB2 SER 8 1HB SER 8 18.829 9.904 5.569
33 HB3 SER 8 2HB SER 8 18.190 8.549 6.499
34 HG SER 8 HG SER 8 19.618 7.445 5.421
35 H GLY 9 H GLY 9 16.655 8.217 2.435
36 HA2 GLY 9 1HA GLY 9 16.664 5.827 1.871
37 HA3 GLY 9 2HA GLY 9 15.782 5.551 3.366
38 H GLU 10 H GLU 10 15.457 5.700 0.109
39 HA GLU 10 HA GLU 10 12.582 6.279 0.336
40 HB2 GLU 10 1HB GLU 10 14.436 7.154 -1.884
41 HB3 GLU 10 2HB GLU 10 12.683 7.262 -1.957
42 HG2 GLU 10 1HG GLU 10 12.648 8.819 -0.130
43 HG3 GLU 10 2HG GLU 10 14.383 8.626 0.116
44 H LYS 11 H LYS 11 11.244 5.211 -1.240
45 HA LYS 11 HA LYS 11 12.473 2.736 -2.263
46 HB2 LYS 11 1HB LYS 11 9.772 3.296 -1.081
47 HB3 LYS 11 2HB LYS 11 9.997 1.933 -2.169
48 HG2 LYS 11 1HG LYS 11 11.324 0.789 -0.687
49 HG3 LYS 11 2HG LYS 11 11.842 2.256 0.147
50 HD2 LYS 11 1HD LYS 11 8.958 1.623 0.274
51 HD3 LYS 11 2HD LYS 11 10.037 0.537 1.154
52 HE2 LYS 11 1HE LYS 11 9.333 2.279 2.643
53 HE3 LYS 11 2HE LYS 11 11.035 2.528 2.260
54 HZ1 LYS 11 3HZ LYS 11 8.707 4.017 1.190
55 HZ2 LYS 11 1HZ LYS 11 10.260 4.138 0.529
56 HZ3 LYS 11 2HZ LYS 11 9.980 4.620 2.126
57 HA PRO 12 HA PRO 12 11.464 4.428 -6.257
58 HB2 PRO 12 1HB PRO 12 12.333 2.294 -7.692
59 HB3 PRO 12 2HB PRO 12 13.430 3.483 -6.981
60 HG2 PRO 12 1HG PRO 12 12.655 0.776 -5.965
61 HG3 PRO 12 2HG PRO 12 14.255 1.539 -6.008
62 HD2 PRO 12 1HD PRO 12 12.748 1.442 -3.761
63 HD3 PRO 12 2HD PRO 12 13.850 2.789 -4.115
64 H PHE 13 H PHE 13 10.213 1.580 -4.792
65 HA PHE 13 HA PHE 13 8.205 1.277 -6.917
66 HB2 PHE 13 1HB PHE 13 8.877 -0.618 -4.657
67 HB3 PHE 13 2HB PHE 13 7.747 -0.928 -5.971
68 HD1 PHE 13 HD1 PHE 13 11.278 -0.607 -5.052
69 HD2 PHE 13 HD2 PHE 13 8.521 -1.511 -8.166
70 HE1 PHE 13 HE1 PHE 13 13.111 -1.548 -6.397
71 HE2 PHE 13 HE2 PHE 13 10.349 -2.454 -9.515
72 HZ PHE 13 HZ PHE 13 12.648 -2.474 -8.631
73 H LYS 14 H LYS 14 6.079 1.607 -6.534
74 HA LYS 14 HA LYS 14 5.157 2.005 -3.790
75 HB2 LYS 14 1HB LYS 14 5.799 4.237 -4.550
76 HB3 LYS 14 2HB LYS 14 4.805 4.051 -5.989
77 HG2 LYS 14 1HG LYS 14 2.838 3.766 -4.406
78 HG3 LYS 14 2HG LYS 14 3.919 4.350 -3.138
79 HD2 LYS 14 1HD LYS 14 4.306 6.402 -4.428
80 HD3 LYS 14 2HD LYS 14 3.208 5.817 -5.680
81 HE2 LYS 14 1HE LYS 14 1.446 5.671 -3.863
82 HE3 LYS 14 2HE LYS 14 2.560 6.580 -2.842
83 HZ1 LYS 14 3HZ LYS 14 1.752 7.572 -5.506
84 HZ2 LYS 14 1HZ LYS 14 2.412 8.440 -4.212
85 HZ3 LYS 14 2HZ LYS 14 0.818 7.881 -4.130
86 H CYS 15 H CYS 15 3.261 1.041 -3.470
87 HA CYS 15 HA CYS 15 1.903 -0.253 -5.623
88 HB2 CYS 15 1HB CYS 15 2.068 -1.168 -3.299
89 HB3 CYS 15 2HB CYS 15 0.966 0.098 -2.769
90 H GLU 16 H GLU 16 0.935 1.090 -7.051
91 HA GLU 16 HA GLU 16 -0.318 3.518 -6.476
92 HB2 GLU 16 1HB GLU 16 -0.952 1.617 -8.740
93 HB3 GLU 16 2HB GLU 16 -1.348 3.329 -8.684
94 HG2 GLU 16 1HG GLU 16 1.157 3.731 -8.466
95 HG3 GLU 16 2HG GLU 16 1.348 2.045 -8.943
96 H GLU 17 H GLU 17 -1.434 0.260 -6.135
97 HA GLU 17 HA GLU 17 -4.191 0.582 -6.227
98 HB2 GLU 17 1HB GLU 17 -2.719 -1.214 -4.296
99 HB3 GLU 17 2HB GLU 17 -4.348 -1.432 -4.920
100 HG2 GLU 17 1HG GLU 17 -3.182 -1.508 -7.232
101 HG3 GLU 17 2HG GLU 17 -1.730 -1.843 -6.292
102 H CYS 18 H CYS 18 -2.068 0.771 -3.368
103 HA CYS 18 HA CYS 18 -4.178 2.331 -2.026
104 HB2 CYS 18 1HB CYS 18 -3.249 1.515 0.108
105 HB3 CYS 18 2HB CYS 18 -3.800 0.192 -0.915
106 H GLY 19 H GLY 19 -0.703 1.988 -2.558
107 HA2 GLY 19 1HA GLY 19 0.402 4.182 -3.055
108 HA3 GLY 19 2HA GLY 19 -0.368 4.759 -1.584
109 H LYS 20 H LYS 20 0.710 1.530 -1.447
110 HA LYS 20 HA LYS 20 2.533 2.069 0.647
111 HB2 LYS 20 1HB LYS 20 1.674 -0.324 -0.885
112 HB3 LYS 20 2HB LYS 20 3.225 -0.430 -0.061
113 HG2 LYS 20 1HG LYS 20 1.790 0.528 1.953
114 HG3 LYS 20 2HG LYS 20 0.487 -0.252 1.054
115 HD2 LYS 20 1HD LYS 20 1.396 -2.364 1.316
116 HD3 LYS 20 2HD LYS 20 3.025 -1.740 1.587
117 HE2 LYS 20 1HE LYS 20 2.244 -2.541 3.677
118 HE3 LYS 20 2HE LYS 20 2.179 -0.781 3.753
119 HZ1 LYS 20 3HZ LYS 20 -0.253 -1.179 2.952
120 HZ2 LYS 20 1HZ LYS 20 0.142 -1.341 4.589
121 HZ3 LYS 20 2HZ LYS 20 -0.022 -2.717 3.619
122 H ARG 21 H ARG 21 4.791 0.734 0.366
123 HA ARG 21 HA ARG 21 6.095 1.427 -2.135
124 HB2 ARG 21 1HB ARG 21 6.980 2.608 0.505
125 HB3 ARG 21 2HB ARG 21 7.880 2.711 -1.002
126 HG2 ARG 21 1HG ARG 21 5.719 3.805 -1.925
127 HG3 ARG 21 2HG ARG 21 5.340 4.069 -0.222
128 HD2 ARG 21 1HD ARG 21 7.840 4.968 -0.208
129 HD3 ARG 21 2HD ARG 21 7.473 5.259 -1.908
130 HE ARG 21 HE ARG 21 6.213 7.036 -1.252
131 HH11 ARG 21 1HH1 ARG 21 6.461 4.821 1.422
132 HH12 ARG 21 2HH1 ARG 21 5.604 5.849 2.522
133 HH21 ARG 21 1HH2 ARG 21 5.084 8.398 0.186
134 HH22 ARG 21 2HH2 ARG 21 4.820 7.884 1.818
135 H PHE 22 H PHE 22 8.173 0.450 -2.382
136 HA PHE 22 HA PHE 22 9.097 -1.371 -0.325
137 HB2 PHE 22 1HB PHE 22 8.396 -2.482 -3.043
138 HB3 PHE 22 2HB PHE 22 8.913 -3.374 -1.616
139 HD1 PHE 22 HD2 PHE 22 6.147 -1.376 -3.040
140 HD2 PHE 22 HD1 PHE 22 7.358 -4.130 -0.029
141 HE1 PHE 22 HE2 PHE 22 3.794 -1.711 -2.405
142 HE2 PHE 22 HE1 PHE 22 5.007 -4.470 0.611
143 HZ PHE 22 HZ PHE 22 3.221 -3.259 -0.577
144 H THR 23 H THR 23 11.220 -2.126 -0.666
145 HA THR 23 HA THR 23 12.832 -0.359 -2.262
146 HB THR 23 HB THR 23 13.598 -1.085 -0.043
147 HG1 THR 23 HG1 THR 23 15.082 -0.632 -1.896
148 HG21 THR 23 3HG2 THR 23 13.258 -3.762 -1.269
149 HG22 THR 23 1HG2 THR 23 13.020 -3.242 0.399
150 HG23 THR 23 2HG2 THR 23 14.649 -3.541 -0.207
151 H GLN 24 H GLN 24 11.294 -3.320 -2.803
152 HA GLN 24 HA GLN 24 12.809 -3.676 -5.282
153 HB2 GLN 24 1HB GLN 24 12.581 -5.616 -3.057
154 HB3 GLN 24 2HB GLN 24 12.360 -6.265 -4.676
155 HG2 GLN 24 1HG GLN 24 14.761 -4.777 -3.640
156 HG3 GLN 24 2HG GLN 24 14.657 -6.495 -4.021
157 HE21 GLN 24 1HE2 GLN 24 13.185 -6.262 -6.412
158 HE22 GLN 24 2HE2 GLN 24 14.214 -5.558 -7.607
159 H ASN 25 H ASN 25 11.669 -4.923 -6.904
160 HA ASN 25 HA ASN 25 8.927 -4.232 -7.056
161 HB2 ASN 25 1HB ASN 25 8.928 -5.424 -9.177
162 HB3 ASN 25 2HB ASN 25 10.397 -4.462 -9.038
163 HD21 ASN 25 1HD2 ASN 25 12.371 -5.518 -8.614
164 HD22 ASN 25 2HD2 ASN 25 12.579 -7.195 -8.973
165 H SER 26 H SER 26 10.566 -7.370 -6.679
166 HA SER 26 HA SER 26 8.466 -9.095 -6.642
167 HB2 SER 26 1HB SER 26 10.653 -9.989 -6.379
168 HB3 SER 26 2HB SER 26 10.938 -9.056 -4.910
169 HG SER 26 HG SER 26 10.296 -11.421 -4.789
170 H GLN 27 H GLN 27 9.457 -6.933 -4.039
171 HA GLN 27 HA GLN 27 7.670 -7.929 -2.085
172 HB2 GLN 27 1HB GLN 27 8.981 -5.221 -2.366
173 HB3 GLN 27 2HB GLN 27 8.084 -5.743 -0.947
174 HG2 GLN 27 1HG GLN 27 9.707 -7.682 -0.808
175 HG3 GLN 27 2HG GLN 27 10.674 -6.822 -2.005
176 HE21 GLN 27 1HE2 GLN 27 10.744 -4.324 -1.332
177 HE22 GLN 27 2HE2 GLN 27 11.322 -4.075 0.276
178 H LEU 28 H LEU 28 7.487 -5.012 -4.130
179 HA LEU 28 HA LEU 28 4.921 -4.223 -3.362
180 HB2 LEU 28 1HB LEU 28 6.333 -2.711 -4.548
181 HB3 LEU 28 2HB LEU 28 6.441 -3.806 -5.925
182 HG LEU 28 HG LEU 28 4.120 -3.378 -6.485
183 HD11 LEU 28 1HD1 LEU 28 3.528 -2.962 -4.007
184 HD12 LEU 28 2HD1 LEU 28 2.672 -2.053 -5.252
185 HD13 LEU 28 3HD1 LEU 28 3.978 -1.291 -4.345
186 HD21 LEU 28 3HD2 LEU 28 6.061 -1.811 -7.142
187 HD22 LEU 28 1HD2 LEU 28 5.332 -0.682 -5.999
188 HD23 LEU 28 2HD2 LEU 28 4.405 -1.255 -7.385
189 H HIS 29 H HIS 29 5.896 -6.047 -6.268
190 HA HIS 29 HA HIS 29 3.320 -6.558 -7.222
191 HB2 HIS 29 1HB HIS 29 5.996 -7.819 -7.625
192 HB3 HIS 29 2HB HIS 29 4.572 -8.672 -8.213
193 HD1 HIS 29 HD1 HIS 29 4.157 -8.195 -10.590
194 HD2 HIS 29 HD2 HIS 29 5.805 -4.919 -8.638
195 HE1 HIS 29 HE1 HIS 29 4.373 -6.406 -12.345
196 H SER 30 H SER 30 5.171 -8.090 -4.706
197 HA SER 30 HA SER 30 3.492 -10.423 -4.546
198 HB2 SER 30 1HB SER 30 5.730 -10.766 -3.848
199 HB3 SER 30 2HB SER 30 5.713 -9.333 -2.821
200 HG SER 30 HG SER 30 5.367 -11.646 -1.933
201 H HIS 31 H HIS 31 3.449 -7.229 -3.286
202 HA HIS 31 HA HIS 31 1.632 -7.899 -1.113
203 HB2 HIS 31 1HB HIS 31 2.962 -6.203 -0.342
204 HB3 HIS 31 2HB HIS 31 3.165 -5.490 -1.939
205 HD1 HIS 31 HD1 HIS 31 0.808 -5.539 0.985
206 HD2 HIS 31 HD2 HIS 31 1.349 -3.499 -2.594
207 HE1 HIS 31 HE1 HIS 31 -0.776 -3.588 1.077
208 H GLN 32 H GLN 32 1.605 -6.125 -4.178
209 HA GLN 32 HA GLN 32 -0.892 -5.021 -4.174
210 HB2 GLN 32 1HB GLN 32 0.736 -6.260 -6.367
211 HB3 GLN 32 2HB GLN 32 -0.873 -5.637 -6.706
212 HG2 GLN 32 1HG GLN 32 -0.176 -3.441 -5.838
213 HG3 GLN 32 2HG GLN 32 1.449 -4.080 -5.593
214 HE21 GLN 32 1HE2 GLN 32 2.427 -2.686 -7.013
215 HE22 GLN 32 2HE2 GLN 32 2.197 -2.767 -8.723
216 H ARG 33 H ARG 33 -0.077 -8.378 -4.283
217 HA ARG 33 HA ARG 33 -2.322 -9.509 -5.441
218 HB2 ARG 33 1HB ARG 33 -1.027 -10.694 -2.998
219 HB3 ARG 33 2HB ARG 33 -1.724 -11.525 -4.382
220 HG2 ARG 33 1HG ARG 33 0.139 -10.495 -5.758
221 HG3 ARG 33 2HG ARG 33 0.883 -10.050 -4.221
222 HD2 ARG 33 1HD ARG 33 0.011 -12.868 -4.703
223 HD3 ARG 33 2HD ARG 33 1.532 -12.289 -5.381
224 HE ARG 33 HE ARG 33 1.267 -11.723 -2.586
225 HH11 ARG 33 1HH1 ARG 33 2.169 -14.145 -4.919
226 HH12 ARG 33 2HH1 ARG 33 3.218 -14.990 -3.829
227 HH21 ARG 33 1HH2 ARG 33 2.645 -12.828 -1.142
228 HH22 ARG 33 2HH2 ARG 33 3.487 -14.241 -1.681
229 H VAL 34 H VAL 34 -1.900 -8.161 -2.232
230 HA VAL 34 HA VAL 34 -4.170 -9.181 -0.973
231 HB VAL 34 HB VAL 34 -3.978 -7.417 0.612
232 HG11 VAL 34 1HG1 VAL 34 -1.550 -8.670 -0.443
233 HG12 VAL 34 2HG1 VAL 34 -1.260 -7.243 0.553
234 HG13 VAL 34 3HG1 VAL 34 -2.170 -8.605 1.206
235 HG21 VAL 34 3HG2 VAL 34 -2.845 -5.357 0.253
236 HG22 VAL 34 1HG2 VAL 34 -2.191 -5.913 -1.288
237 HG23 VAL 34 2HG2 VAL 34 -3.919 -5.598 -1.125
238 H HIS 35 H HIS 35 -3.832 -6.660 -3.346
239 HA HIS 35 HA HIS 35 -6.505 -5.631 -2.932
240 HB2 HIS 35 1HB HIS 35 -4.364 -5.027 -4.973
241 HB3 HIS 35 2HB HIS 35 -5.955 -4.272 -4.999
242 HD1 HIS 35 HD1 HIS 35 -6.541 -2.753 -2.879
243 HD2 HIS 35 HD2 HIS 35 -2.560 -3.877 -3.265
244 HE1 HIS 35 HE1 HIS 35 -5.256 -1.203 -1.373
245 H THR 36 H THR 36 -4.910 -7.962 -4.942
246 HA THR 36 HA THR 36 -7.095 -8.142 -6.835
247 HB THR 36 HB THR 36 -5.818 -9.953 -7.869
248 HG1 THR 36 HG1 THR 36 -4.657 -10.047 -5.427
249 HG21 THR 36 3HG2 THR 36 -5.178 -7.811 -8.633
250 HG22 THR 36 1HG2 THR 36 -3.669 -8.657 -8.294
251 HG23 THR 36 2HG2 THR 36 -4.287 -7.463 -7.152
252 H GLY 37 H GLY 37 -7.897 -8.585 -4.164
253 HA2 GLY 37 1HA GLY 37 -8.950 -11.300 -4.449
254 HA3 GLY 37 2HA GLY 37 -8.074 -10.927 -2.973
255 H GLU 38 H GLU 38 -8.920 -8.401 -2.384
256 HA GLU 38 HA GLU 38 -11.692 -8.912 -1.631
257 HB2 GLU 38 1HB GLU 38 -9.752 -8.107 -0.064
258 HB3 GLU 38 2HB GLU 38 -10.131 -6.522 -0.723
259 HG2 GLU 38 1HG GLU 38 -12.112 -8.330 0.641
260 HG3 GLU 38 2HG GLU 38 -11.260 -6.996 1.417
261 H LYS 39 H LYS 39 -13.386 -7.505 -2.054
262 HA LYS 39 HA LYS 39 -12.853 -5.469 -4.119
263 HB2 LYS 39 1HB LYS 39 -15.100 -5.954 -5.019
264 HB3 LYS 39 2HB LYS 39 -14.038 -7.354 -5.088
265 HG2 LYS 39 1HG LYS 39 -15.219 -8.504 -3.501
266 HG3 LYS 39 2HG LYS 39 -15.826 -7.036 -2.732
267 HD2 LYS 39 1HD LYS 39 -17.259 -6.650 -4.725
268 HD3 LYS 39 2HD LYS 39 -16.717 -8.202 -5.369
269 HE2 LYS 39 1HE LYS 39 -17.515 -9.037 -2.980
270 HE3 LYS 39 2HE LYS 39 -18.542 -7.609 -3.100
271 HZ1 LYS 39 3HZ LYS 39 -19.907 -8.964 -4.208
272 HZ2 LYS 39 1HZ LYS 39 -18.704 -10.113 -4.515
273 HZ3 LYS 39 2HZ LYS 39 -18.854 -8.759 -5.517
274 HA PRO 40 HA PRO 40 -14.630 -2.542 -1.345
275 HB2 PRO 40 1HB PRO 40 -15.275 -0.612 -3.142
276 HB3 PRO 40 2HB PRO 40 -13.613 -0.935 -2.634
277 HG2 PRO 40 1HG PRO 40 -15.044 -1.826 -5.108
278 HG3 PRO 40 2HG PRO 40 -13.393 -1.203 -4.933
279 HD2 PRO 40 1HD PRO 40 -13.937 -3.846 -5.169
280 HD3 PRO 40 2HD PRO 40 -12.569 -3.233 -4.217
281 H SER 41 H SER 41 -16.639 -1.461 -0.860
282 HA SER 41 HA SER 41 -18.916 -3.048 -1.408
283 HB2 SER 41 1HB SER 41 -20.160 -1.318 -0.150
284 HB3 SER 41 2HB SER 41 -18.692 -1.816 0.691
285 HG SER 41 HG SER 41 -19.204 0.575 -0.716
286 H GLY 42 H GLY 42 -19.629 -3.145 -3.465
287 HA2 GLY 42 1HA GLY 42 -20.902 -0.807 -4.567
288 HA3 GLY 42 2HA GLY 42 -19.496 -1.327 -5.483
289 HA PRO 43 HA PRO 43 -23.464 -3.741 -6.571
290 HB2 PRO 43 1HB PRO 43 -24.085 -2.485 -8.896
291 HB3 PRO 43 2HB PRO 43 -24.728 -1.979 -7.330
292 HG2 PRO 43 1HG PRO 43 -22.444 -0.843 -8.895
293 HG3 PRO 43 2HG PRO 43 -23.730 0.005 -8.018
294 HD2 PRO 43 1HD PRO 43 -21.244 -0.322 -6.998
295 HD3 PRO 43 2HD PRO 43 -22.695 -0.272 -5.978
296 H SER 44 H SER 44 -20.390 -3.178 -7.604
297 HA SER 44 HA SER 44 -19.935 -3.982 -10.102
298 HB2 SER 44 1HB SER 44 -18.558 -5.335 -7.772
299 HB3 SER 44 2HB SER 44 -17.903 -5.068 -9.388
300 HG SER 44 HG SER 44 -18.495 -2.710 -8.685
301 H SER 45 H SER 45 -20.649 -5.520 -11.405
302 HA SER 45 HA SER 45 -22.414 -7.516 -10.769
303 HB2 SER 45 1HB SER 45 -21.626 -6.672 -13.087
304 HB3 SER 45 2HB SER 45 -20.390 -7.923 -12.959
305 HG SER 45 HG SER 45 -23.069 -8.152 -13.468
306 H GLY 46 H GLY 46 -22.027 -9.936 -11.051
307 HA2 GLY 46 1HA GLY 46 -21.251 -11.792 -9.905
308 HA3 GLY 46 2HA GLY 46 -19.747 -11.336 -10.691