Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
503775 | 1x4s RC | 11363 | 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 1H GLY 1 -0.084 -19.572 15.866
2 HA2 GLY 1 1HA GLY 1 0.700 -18.729 13.466
3 HA3 GLY 1 2HA GLY 1 -0.864 -17.935 13.585
4 H SER 2 H SER 2 2.278 -18.261 15.179
5 HA SER 2 HA SER 2 1.956 -16.178 17.034
6 HB2 SER 2 1HB SER 2 4.350 -16.262 17.318
7 HB3 SER 2 2HB SER 2 3.772 -17.911 17.077
8 HG SER 2 HG SER 2 5.252 -16.267 15.356
9 H SER 3 H SER 3 3.268 -14.127 17.001
10 HA SER 3 HA SER 3 3.385 -12.940 14.315
11 HB2 SER 3 1HB SER 3 1.250 -12.305 15.453
12 HB3 SER 3 2HB SER 3 2.203 -11.553 16.732
13 HG SER 3 HG SER 3 2.285 -10.855 13.980
14 H GLY 4 H GLY 4 5.095 -11.626 13.945
15 HA2 GLY 4 1HA GLY 4 7.280 -11.679 15.755
16 HA3 GLY 4 2HA GLY 4 7.194 -10.747 14.268
17 H SER 5 H SER 5 8.203 -10.091 17.005
18 HA SER 5 HA SER 5 6.721 -8.458 18.547
19 HB2 SER 5 1HB SER 5 9.548 -8.103 17.569
20 HB3 SER 5 2HB SER 5 8.825 -6.974 18.714
21 HG SER 5 HG SER 5 9.711 -9.544 19.096
22 H SER 6 H SER 6 6.424 -6.119 18.639
23 HA SER 6 HA SER 6 5.572 -5.102 16.050
24 HB2 SER 6 1HB SER 6 4.491 -3.306 17.390
25 HB3 SER 6 2HB SER 6 3.993 -4.922 17.892
26 HG SER 6 HG SER 6 6.177 -3.716 19.168
27 H GLY 7 H GLY 7 6.943 -3.963 14.858
28 HA2 GLY 7 1HA GLY 7 8.168 -1.598 15.693
29 HA3 GLY 7 2HA GLY 7 9.366 -2.878 15.826
30 H MET 8 H MET 8 9.803 -4.152 13.866
31 HA MET 8 HA MET 8 9.384 -2.549 11.428
32 HB2 MET 8 1HB MET 8 11.835 -3.934 12.462
33 HB3 MET 8 2HB MET 8 11.625 -3.692 10.733
34 HG2 MET 8 1HG MET 8 11.831 -1.416 10.883
35 HG3 MET 8 2HG MET 8 11.295 -1.370 12.561
36 HE1 MET 8 3HE MET 8 13.690 -3.089 10.350
37 HE2 MET 8 1HE MET 8 15.265 -2.406 10.759
38 HE3 MET 8 2HE MET 8 14.681 -3.842 11.601
39 H GLU 9 H GLU 9 8.282 -3.558 9.891
40 HA GLU 9 HA GLU 9 8.019 -6.476 10.027
41 HB2 GLU 9 1HB GLU 9 6.371 -4.397 8.578
42 HB3 GLU 9 2HB GLU 9 6.087 -6.130 8.485
43 HG2 GLU 9 1HG GLU 9 5.569 -6.230 10.824
44 HG3 GLU 9 2HG GLU 9 6.017 -4.539 11.036
45 HA PRO 10 HA PRO 10 10.674 -6.917 6.521
46 HB2 PRO 10 1HB PRO 10 10.049 -9.491 5.925
47 HB3 PRO 10 2HB PRO 10 11.072 -9.043 7.296
48 HG2 PRO 10 1HG PRO 10 8.161 -9.743 7.254
49 HG3 PRO 10 2HG PRO 10 9.417 -10.246 8.401
50 HD2 PRO 10 1HD PRO 10 7.655 -8.262 8.945
51 HD3 PRO 10 2HD PRO 10 9.316 -8.263 9.573
52 H ALA 11 H ALA 11 10.473 -7.842 4.223
53 HA ALA 11 HA ALA 11 8.240 -6.556 2.960
54 HB1 ALA 11 3HB ALA 11 9.395 -6.773 0.985
55 HB2 ALA 11 1HB ALA 11 10.716 -6.791 2.153
56 HB3 ALA 11 2HB ALA 11 10.133 -8.304 1.458
57 H GLY 12 H GLY 12 7.243 -7.835 1.001
58 HA2 GLY 12 1HA GLY 12 6.615 -10.595 1.765
59 HA3 GLY 12 2HA GLY 12 5.287 -9.450 1.645
60 HA PRO 13 HA PRO 13 6.658 -11.337 -2.559
61 HB2 PRO 13 1HB PRO 13 5.023 -13.500 -2.693
62 HB3 PRO 13 2HB PRO 13 6.664 -13.575 -2.039
63 HG2 PRO 13 1HG PRO 13 4.053 -13.378 -0.587
64 HG3 PRO 13 2HG PRO 13 5.465 -14.386 -0.219
65 HD2 PRO 13 1HD PRO 13 4.945 -12.074 1.090
66 HD3 PRO 13 2HD PRO 13 6.597 -12.652 0.793
67 H CYS 14 H CYS 14 5.666 -9.750 -3.703
68 HA CYS 14 HA CYS 14 3.092 -8.821 -3.524
69 HB2 CYS 14 1HB CYS 14 4.799 -7.725 -4.883
70 HB3 CYS 14 2HB CYS 14 4.785 -9.069 -6.020
71 H GLY 15 H GLY 15 1.300 -10.023 -3.493
72 HA2 GLY 15 1HA GLY 15 1.080 -12.428 -5.095
73 HA3 GLY 15 2HA GLY 15 -0.113 -11.814 -3.960
74 H PHE 16 H PHE 16 -0.247 -9.170 -5.110
75 HA PHE 16 HA PHE 16 -2.372 -9.373 -6.801
76 HB2 PHE 16 1HB PHE 16 -0.261 -7.216 -6.996
77 HB3 PHE 16 2HB PHE 16 -1.947 -7.087 -7.487
78 HD1 PHE 16 1HD PHE 16 -3.436 -8.171 -5.293
79 HD2 PHE 16 2HD PHE 16 0.100 -5.803 -5.223
80 HE1 PHE 16 1HE PHE 16 -4.029 -7.358 -3.047
81 HE2 PHE 16 2HE PHE 16 -0.486 -4.988 -2.977
82 HZ PHE 16 HZ PHE 16 -2.552 -5.766 -1.886
83 H CYS 17 H CYS 17 1.013 -9.665 -7.614
84 HA CYS 17 HA CYS 17 0.845 -9.386 -10.397
85 HB2 CYS 17 1HB CYS 17 2.766 -10.636 -8.500
86 HB3 CYS 17 2HB CYS 17 2.888 -11.104 -10.192
87 HA PRO 18 HA PRO 18 -1.088 -13.041 -11.864
88 HB2 PRO 18 1HB PRO 18 0.315 -13.535 -14.135
89 HB3 PRO 18 2HB PRO 18 -0.829 -12.196 -13.985
90 HG2 PRO 18 1HG PRO 18 2.156 -12.173 -13.752
91 HG3 PRO 18 2HG PRO 18 1.090 -11.026 -14.583
92 HD2 PRO 18 1HD PRO 18 2.139 -10.530 -12.137
93 HD3 PRO 18 2HD PRO 18 0.545 -9.925 -12.633
94 H ALA 19 H ALA 19 -0.968 -15.175 -11.473
95 HA ALA 19 HA ALA 19 0.826 -16.473 -10.003
96 HB1 ALA 19 3HB ALA 19 0.241 -18.466 -11.805
97 HB2 ALA 19 1HB ALA 19 -0.751 -17.995 -10.424
98 HB3 ALA 19 2HB ALA 19 -1.090 -17.329 -12.022
99 H GLY 20 H GLY 20 2.914 -16.992 -10.071
100 HA2 GLY 20 1HA GLY 20 4.817 -17.965 -11.136
101 HA3 GLY 20 2HA GLY 20 4.194 -17.410 -12.683
102 H GLU 21 H GLU 21 3.707 -14.762 -12.217
103 HA GLU 21 HA GLU 21 6.402 -13.719 -12.159
104 HB2 GLU 21 1HB GLU 21 3.773 -12.287 -12.583
105 HB3 GLU 21 2HB GLU 21 5.370 -11.604 -12.848
106 HG2 GLU 21 1HG GLU 21 5.689 -13.551 -14.501
107 HG3 GLU 21 2HG GLU 21 3.934 -13.697 -14.426
108 H VAL 22 H VAL 22 5.825 -14.690 -9.683
109 HA VAL 22 HA VAL 22 4.833 -12.617 -7.949
110 HB VAL 22 HB VAL 22 6.249 -15.208 -7.308
111 HG11 VAL 22 1HG1 VAL 22 5.264 -14.808 -5.016
112 HG12 VAL 22 2HG1 VAL 22 6.614 -13.765 -5.466
113 HG13 VAL 22 3HG1 VAL 22 4.962 -13.149 -5.530
114 HG21 VAL 22 3HG2 VAL 22 3.706 -15.477 -6.416
115 HG22 VAL 22 1HG2 VAL 22 3.453 -14.471 -7.842
116 HG23 VAL 22 2HG2 VAL 22 4.266 -16.029 -7.994
117 H GLN 23 H GLN 23 5.968 -10.911 -7.329
118 HA GLN 23 HA GLN 23 8.903 -11.145 -7.195
119 HB2 GLN 23 1HB GLN 23 7.153 -8.813 -7.959
120 HB3 GLN 23 2HB GLN 23 8.844 -8.613 -7.517
121 HG2 GLN 23 1HG GLN 23 9.422 -10.223 -9.341
122 HG3 GLN 23 2HG GLN 23 7.733 -10.162 -9.841
123 HE21 GLN 23 1HE2 GLN 23 8.846 -9.438 -11.852
124 HE22 GLN 23 2HE2 GLN 23 9.130 -7.744 -12.039
125 HA PRO 24 HA PRO 24 8.762 -10.157 -2.920
126 HB2 PRO 24 1HB PRO 24 11.116 -8.837 -2.627
127 HB3 PRO 24 2HB PRO 24 11.020 -10.584 -2.878
128 HG2 PRO 24 1HG PRO 24 11.600 -8.416 -4.859
129 HG3 PRO 24 2HG PRO 24 12.386 -9.993 -4.665
130 HD2 PRO 24 1HD PRO 24 10.519 -9.520 -6.568
131 HD3 PRO 24 2HD PRO 24 10.713 -11.106 -5.795
132 H ALA 25 H ALA 25 7.063 -8.710 -2.698
133 HA ALA 25 HA ALA 25 7.091 -6.021 -3.525
134 HB1 ALA 25 3HB ALA 25 5.242 -7.730 -2.381
135 HB2 ALA 25 1HB ALA 25 5.470 -6.474 -1.164
136 HB3 ALA 25 2HB ALA 25 4.984 -6.037 -2.803
137 H ARG 26 H ARG 26 9.047 -5.076 -2.899
138 HA ARG 26 HA ARG 26 9.981 -5.058 -0.217
139 HB2 ARG 26 1HB ARG 26 10.641 -3.404 -2.647
140 HB3 ARG 26 2HB ARG 26 11.391 -3.100 -1.085
141 HG2 ARG 26 1HG ARG 26 12.420 -5.239 -1.067
142 HG3 ARG 26 2HG ARG 26 11.479 -5.770 -2.462
143 HD2 ARG 26 1HD ARG 26 13.523 -3.553 -2.471
144 HD3 ARG 26 2HD ARG 26 13.796 -5.193 -3.056
145 HE ARG 26 HE ARG 26 11.588 -3.779 -4.284
146 HH11 ARG 26 2HH1 ARG 26 14.959 -4.634 -4.437
147 HH12 ARG 26 1HH1 ARG 26 15.087 -4.353 -6.142
148 HH21 ARG 26 2HH2 ARG 26 11.744 -3.405 -6.529
149 HH22 ARG 26 1HH2 ARG 26 13.258 -3.653 -7.331
150 H TYR 27 H TYR 27 7.647 -3.199 -1.940
151 HA TYR 27 HA TYR 27 7.536 -1.237 0.251
152 HB2 TYR 27 1HB TYR 27 6.103 -0.879 -2.359
153 HB3 TYR 27 2HB TYR 27 6.673 0.344 -1.229
154 HD1 TYR 27 1HD TYR 27 9.325 0.345 -0.909
155 HD2 TYR 27 2HD TYR 27 7.273 -1.141 -4.328
156 HE1 TYR 27 1HE TYR 27 11.362 0.645 -2.255
157 HE2 TYR 27 2HE TYR 27 9.305 -0.846 -5.683
158 HH TYR 27 HH TYR 27 11.468 0.815 -5.417
159 H THR 28 H THR 28 5.197 -0.347 0.510
160 HA THR 28 HA THR 28 3.096 -2.286 0.120
161 HB THR 28 HB THR 28 3.441 -1.550 2.981
162 HG1 THR 28 1HG THR 28 4.914 -3.633 1.704
163 HG21 THR 28 3HG2 THR 28 2.378 -3.684 3.342
164 HG22 THR 28 1HG2 THR 28 2.566 -4.110 1.642
165 HG23 THR 28 2HG2 THR 28 1.477 -2.804 2.109
166 H CYS 29 H CYS 29 1.056 -1.406 0.309
167 HA CYS 29 HA CYS 29 0.811 1.380 0.018
168 HB2 CYS 29 1HB CYS 29 -0.780 -0.591 -0.688
169 HB3 CYS 29 2HB CYS 29 -1.513 -0.295 0.885
170 HA PRO 30 HA PRO 30 1.059 2.403 4.367
171 HB2 PRO 30 1HB PRO 30 0.940 5.089 3.996
172 HB3 PRO 30 2HB PRO 30 2.412 4.148 3.733
173 HG2 PRO 30 1HG PRO 30 0.417 5.141 1.734
174 HG3 PRO 30 2HG PRO 30 2.188 5.142 1.642
175 HD2 PRO 30 1HD PRO 30 0.664 3.290 0.385
176 HD3 PRO 30 2HD PRO 30 2.282 2.925 1.019
177 H ARG 31 H ARG 31 -1.526 2.414 2.348
178 HA ARG 31 HA ARG 31 -3.276 3.728 4.322
179 HB2 ARG 31 1HB ARG 31 -3.326 3.628 1.351
180 HB3 ARG 31 2HB ARG 31 -4.875 3.596 2.183
181 HG2 ARG 31 1HG ARG 31 -3.858 5.647 3.472
182 HG3 ARG 31 2HG ARG 31 -2.846 5.761 2.030
183 HD2 ARG 31 1HD ARG 31 -4.594 7.054 1.351
184 HD3 ARG 31 2HD ARG 31 -5.186 5.480 0.821
185 HE ARG 31 HE ARG 31 -5.973 6.288 3.490
186 HH11 ARG 31 2HH1 ARG 31 -6.788 6.159 0.108
187 HH12 ARG 31 1HH1 ARG 31 -8.491 6.335 0.378
188 HH21 ARG 31 2HH2 ARG 31 -8.212 6.520 3.859
189 HH22 ARG 31 1HH2 ARG 31 -9.299 6.541 2.512
190 H CYS 32 H CYS 32 -2.747 0.887 2.340
191 HA CYS 32 HA CYS 32 -4.771 -0.528 3.937
192 HB2 CYS 32 1HB CYS 32 -5.632 -1.668 2.056
193 HB3 CYS 32 2HB CYS 32 -5.519 0.016 1.556
194 H ASN 33 H ASN 33 -1.755 -0.264 3.939
195 HA ASN 33 HA ASN 33 0.132 -1.597 3.926
196 HB2 ASN 33 1HB ASN 33 -1.191 -1.985 6.090
197 HB3 ASN 33 2HB ASN 33 -1.677 -3.521 5.379
198 HD21 ASN 33 1HD2 ASN 33 1.061 -1.608 6.441
199 HD22 ASN 33 2HD2 ASN 33 2.132 -2.939 6.697
200 H ALA 34 H ALA 34 -0.718 -1.901 1.472
201 HA ALA 34 HA ALA 34 -0.963 -4.790 0.975
202 HB1 ALA 34 3HB ALA 34 -2.758 -3.621 -0.045
203 HB2 ALA 34 1HB ALA 34 -1.671 -2.414 -0.731
204 HB3 ALA 34 2HB ALA 34 -1.646 -4.071 -1.338
205 HA PRO 35 HA PRO 35 3.345 -4.510 -0.207
206 HB2 PRO 35 1HB PRO 35 3.640 -7.163 -0.702
207 HB3 PRO 35 2HB PRO 35 3.637 -6.485 0.930
208 HG2 PRO 35 1HG PRO 35 1.420 -7.827 -0.566
209 HG3 PRO 35 2HG PRO 35 1.905 -8.023 1.128
210 HD2 PRO 35 1HD PRO 35 -0.197 -6.487 0.383
211 HD3 PRO 35 2HD PRO 35 0.811 -6.106 1.794
212 H TYR 36 H TYR 36 3.768 -3.671 -2.152
213 HA TYR 36 HA TYR 36 2.853 -5.146 -4.534
214 HB2 TYR 36 1HB TYR 36 2.726 -2.964 -5.709
215 HB3 TYR 36 2HB TYR 36 1.592 -3.081 -4.368
216 HD1 TYR 36 2HD TYR 36 4.725 -1.531 -5.526
217 HD2 TYR 36 1HD TYR 36 1.781 -1.646 -2.456
218 HE1 TYR 36 2HE TYR 36 5.629 0.555 -4.589
219 HE2 TYR 36 1HE TYR 36 2.676 0.441 -1.511
220 HH TYR 36 HH TYR 36 4.048 2.201 -1.906
221 H CYS 37 H CYS 37 4.345 -5.602 -6.054
222 HA CYS 37 HA CYS 37 7.075 -5.491 -5.446
223 HB2 CYS 37 1HB CYS 37 7.422 -6.199 -7.801
224 HB3 CYS 37 2HB CYS 37 6.200 -7.157 -6.972
225 H SER 38 H SER 38 5.157 -3.535 -7.711
226 HA SER 38 HA SER 38 7.063 -1.354 -7.391
227 HB2 SER 38 1HB SER 38 7.536 -2.919 -9.480
228 HB3 SER 38 2HB SER 38 6.236 -1.966 -10.196
229 HG SER 38 HG SER 38 8.701 -1.279 -10.121
230 H LEU 39 H LEU 39 6.200 0.552 -8.911
231 HA LEU 39 HA LEU 39 3.821 1.448 -7.813
232 HB2 LEU 39 1HB LEU 39 5.720 2.623 -9.232
233 HB3 LEU 39 2HB LEU 39 4.566 2.370 -10.540
234 HG LEU 39 HG LEU 39 4.466 4.628 -9.492
235 HD11 LEU 39 1HD1 LEU 39 1.825 3.899 -8.817
236 HD12 LEU 39 2HD1 LEU 39 2.338 2.845 -10.133
237 HD13 LEU 39 3HD1 LEU 39 2.415 4.596 -10.325
238 HD21 LEU 39 3HD2 LEU 39 2.959 3.646 -7.179
239 HD22 LEU 39 1HD2 LEU 39 4.124 4.964 -7.302
240 HD23 LEU 39 2HD2 LEU 39 4.689 3.302 -7.125
241 H ARG 40 H ARG 40 4.379 -0.283 -10.836
242 HA ARG 40 HA ARG 40 2.001 -0.056 -12.136
243 HB2 ARG 40 1HB ARG 40 3.467 -2.671 -11.753
244 HB3 ARG 40 2HB ARG 40 2.388 -2.256 -13.078
245 HG2 ARG 40 1HG ARG 40 5.044 -0.964 -12.488
246 HG3 ARG 40 2HG ARG 40 4.713 -2.134 -13.767
247 HD2 ARG 40 1HD ARG 40 2.859 -0.364 -14.412
248 HD3 ARG 40 2HD ARG 40 3.945 0.732 -13.559
249 HE ARG 40 HE ARG 40 5.489 0.499 -15.259
250 HH11 ARG 40 2HH1 ARG 40 2.888 -1.779 -15.671
251 HH12 ARG 40 1HH1 ARG 40 3.354 -2.219 -17.281
252 HH21 ARG 40 2HH2 ARG 40 6.112 -0.072 -17.378
253 HH22 ARG 40 1HH2 ARG 40 5.189 -1.248 -18.250
254 H CYS 41 H CYS 41 2.658 -2.708 -9.837
255 HA CYS 41 HA CYS 41 -0.012 -3.557 -9.651
256 HB2 CYS 41 1HB CYS 41 2.480 -4.022 -8.092
257 HB3 CYS 41 2HB CYS 41 0.954 -4.441 -7.321
258 H TYR 42 H TYR 42 1.889 -1.377 -7.600
259 HA TYR 42 HA TYR 42 0.219 -0.922 -5.507
260 HB2 TYR 42 1HB TYR 42 2.287 0.222 -5.519
261 HB3 TYR 42 2HB TYR 42 1.940 1.003 -7.058
262 HD1 TYR 42 1HD TYR 42 0.822 0.883 -3.509
263 HD2 TYR 42 2HD TYR 42 1.028 3.151 -7.102
264 HE1 TYR 42 1HE TYR 42 -0.035 2.851 -2.308
265 HE2 TYR 42 2HE TYR 42 0.173 5.126 -5.911
266 HH TYR 42 HH TYR 42 0.263 5.653 -2.920
267 H ARG 43 H ARG 43 -0.275 0.016 -8.813
268 HA ARG 43 HA ARG 43 -2.534 1.729 -8.131
269 HB2 ARG 43 1HB ARG 43 -1.159 1.062 -10.730
270 HB3 ARG 43 2HB ARG 43 -2.655 1.984 -10.665
271 HG2 ARG 43 1HG ARG 43 -1.501 3.634 -9.203
272 HG3 ARG 43 2HG ARG 43 0.000 2.745 -9.474
273 HD2 ARG 43 1HD ARG 43 0.103 4.425 -11.069
274 HD3 ARG 43 2HD ARG 43 -0.540 3.060 -11.980
275 HE ARG 43 HE ARG 43 -2.728 4.444 -11.028
276 HH11 ARG 43 2HH1 ARG 43 -0.006 5.096 -13.098
277 HH12 ARG 43 1HH1 ARG 43 -0.849 6.266 -14.057
278 HH21 ARG 43 2HH2 ARG 43 -3.849 5.983 -12.284
279 HH22 ARG 43 1HH2 ARG 43 -3.035 6.770 -13.593
280 H THR 44 H THR 44 -1.839 -1.410 -9.525
281 HA THR 44 HA THR 44 -4.480 -1.933 -10.456
282 HB THR 44 HB THR 44 -2.245 -3.862 -9.803
283 HG1 THR 44 1HG THR 44 -2.648 -3.688 -12.389
284 HG21 THR 44 3HG2 THR 44 -4.140 -5.210 -9.833
285 HG22 THR 44 1HG2 THR 44 -3.597 -5.274 -11.509
286 HG23 THR 44 2HG2 THR 44 -4.942 -4.227 -11.058
287 H HIS 45 H HIS 45 -2.660 -3.104 -7.621
288 HA HIS 45 HA HIS 45 -4.489 -4.691 -6.402
289 HB2 HIS 45 1HB HIS 45 -3.275 -4.446 -4.463
290 HB3 HIS 45 2HB HIS 45 -2.123 -3.797 -5.626
291 HD1 HIS 45 1HD HIS 45 -1.640 -1.272 -5.534
292 HD2 HIS 45 2HD HIS 45 -4.412 -2.559 -2.720
293 HE1 HIS 45 1HE HIS 45 -1.913 0.647 -3.933
294 H GLY 46 H GLY 46 -4.298 -1.155 -5.951
295 HA2 GLY 46 1HA GLY 46 -7.171 -0.972 -5.778
296 HA3 GLY 46 2HA GLY 46 -6.360 -0.703 -4.242
297 H THR 47 H THR 47 -7.913 1.263 -5.375
298 HA THR 47 HA THR 47 -6.049 3.148 -6.618
299 HB THR 47 HB THR 47 -8.091 4.582 -6.916
300 HG1 THR 47 1HG THR 47 -10.053 2.993 -6.744
301 HG21 THR 47 3HG2 THR 47 -7.254 3.122 -8.709
302 HG22 THR 47 1HG2 THR 47 -9.011 3.262 -8.749
303 HG23 THR 47 2HG2 THR 47 -8.257 1.807 -8.098
304 H CYS 48 H CYS 48 -5.599 2.523 -3.906
305 HA CYS 48 HA CYS 48 -6.764 4.384 -2.130
306 HB2 CYS 48 1HB CYS 48 -4.011 3.182 -1.838
307 HB3 CYS 48 2HB CYS 48 -5.105 3.704 -0.561
308 H ALA 49 H ALA 49 -3.930 4.506 -4.207
309 HA ALA 49 HA ALA 49 -2.578 6.689 -3.255
310 HB1 ALA 49 3HB ALA 49 -1.847 5.335 -5.169
311 HB2 ALA 49 1HB ALA 49 -3.099 6.080 -6.163
312 HB3 ALA 49 2HB ALA 49 -1.783 7.063 -5.519
313 H GLU 50 H GLU 50 -5.559 6.647 -5.131
314 HA GLU 50 HA GLU 50 -5.818 9.245 -5.927
315 HB2 GLU 50 1HB GLU 50 -7.886 7.347 -4.832
316 HB3 GLU 50 2HB GLU 50 -8.312 8.930 -5.468
317 HG2 GLU 50 1HG GLU 50 -6.746 6.952 -7.085
318 HG3 GLU 50 2HG GLU 50 -8.508 6.925 -7.028
319 H ASN 51 H ASN 51 -6.945 7.987 -2.784
320 HA ASN 51 HA ASN 51 -7.058 10.729 -1.769
321 HB2 ASN 51 1HB ASN 51 -8.096 8.121 -0.644
322 HB3 ASN 51 2HB ASN 51 -8.211 9.667 0.192
323 HD21 ASN 51 1HD2 ASN 51 -8.939 11.414 -1.664
324 HD22 ASN 51 2HD2 ASN 51 -10.455 10.986 -2.374
325 H PHE 52 H PHE 52 -4.512 10.160 -2.124
326 HA PHE 52 HA PHE 52 -3.518 9.683 0.598
327 HB2 PHE 52 1HB PHE 52 -2.890 7.660 -0.360
328 HB3 PHE 52 2HB PHE 52 -2.618 8.378 -1.944
329 HD1 PHE 52 2HD PHE 52 -1.290 8.883 1.511
330 HD2 PHE 52 1HD PHE 52 -0.438 8.340 -2.624
331 HE1 PHE 52 2HE PHE 52 1.119 9.020 1.993
332 HE2 PHE 52 1HE PHE 52 1.973 8.475 -2.148
333 HZ PHE 52 HZ PHE 52 2.754 8.817 0.162
334 H TYR 53 H TYR 53 -2.526 10.776 -2.647
335 HA TYR 53 HA TYR 53 -0.321 12.230 -2.161
336 HB2 TYR 53 1HB TYR 53 -2.648 13.220 -3.821
337 HB3 TYR 53 2HB TYR 53 -0.977 13.754 -3.963
338 HD1 TYR 53 1HD TYR 53 0.730 11.673 -4.270
339 HD2 TYR 53 2HD TYR 53 -3.371 11.713 -5.402
340 HE1 TYR 53 1HE TYR 53 1.168 9.883 -5.900
341 HE2 TYR 53 2HE TYR 53 -2.945 9.924 -7.034
342 HH TYR 53 HH TYR 53 0.110 8.252 -7.172
343 H SER 54 H SER 54 -3.629 13.370 -1.555
344 HA SER 54 HA SER 54 -4.456 15.040 -0.250
345 HB2 SER 54 1HB SER 54 -3.001 13.717 1.426
346 HB3 SER 54 2HB SER 54 -1.855 15.048 1.269
347 HG SER 54 HG SER 54 -3.415 16.450 2.040
348 H GLY 55 H GLY 55 -3.273 15.846 -2.635
349 HA2 GLY 55 1HA GLY 55 -2.035 18.416 -1.860
350 HA3 GLY 55 2HA GLY 55 -1.631 17.559 -3.340
351 HA PRO 56 HA PRO 56 -5.292 20.611 -3.805
352 HB2 PRO 56 1HB PRO 56 -3.967 22.762 -4.799
353 HB3 PRO 56 2HB PRO 56 -4.276 22.537 -3.073
354 HG2 PRO 56 1HG PRO 56 -1.788 21.976 -4.641
355 HG3 PRO 56 2HG PRO 56 -1.959 22.736 -3.048
356 HD2 PRO 56 1HD PRO 56 -1.245 20.142 -3.356
357 HD3 PRO 56 2HD PRO 56 -2.195 20.713 -1.969
358 H SER 57 H SER 57 -2.970 19.017 -5.541
359 HA SER 57 HA SER 57 -3.455 20.069 -8.155
360 HB2 SER 57 1HB SER 57 -2.204 17.471 -7.237
361 HB3 SER 57 2HB SER 57 -2.258 18.003 -8.918
362 HG SER 57 HG SER 57 -0.928 19.687 -8.430
363 H SER 58 H SER 58 -4.389 17.014 -6.570
364 HA SER 58 HA SER 58 -5.886 15.787 -8.428
365 HB2 SER 58 1HB SER 58 -5.632 14.950 -6.127
366 HB3 SER 58 2HB SER 58 -6.751 16.186 -5.553
367 HG SER 58 HG SER 58 -7.291 13.990 -7.256
368 H GLY 59 H GLY 59 -7.986 15.853 -9.243
369 HA2 GLY 59 1HA GLY 59 -9.397 18.415 -8.808
370 HA3 GLY 59 2HA GLY 59 -9.281 17.642 -10.382
Start of MODEL 2
1 H1 GLY 1 1H GLY 1 0.283 -23.110 -2.933
2 HA2 GLY 1 1HA GLY 1 0.831 -20.558 -1.774
3 HA3 GLY 1 2HA GLY 1 -0.072 -21.583 -0.668
4 H SER 2 H SER 2 2.776 -20.504 -0.764
5 HA SER 2 HA SER 2 4.143 -23.093 -0.411
6 HB2 SER 2 1HB SER 2 5.018 -21.662 -2.280
7 HB3 SER 2 2HB SER 2 5.448 -20.445 -1.078
8 HG SER 2 HG SER 2 7.259 -21.609 -1.246
9 H SER 3 H SER 3 5.754 -23.195 1.276
10 HA SER 3 HA SER 3 5.287 -21.258 3.447
11 HB2 SER 3 1HB SER 3 4.291 -23.681 3.647
12 HB3 SER 3 2HB SER 3 5.952 -24.119 4.046
13 HG SER 3 HG SER 3 4.089 -22.785 5.536
14 H GLY 4 H GLY 4 7.048 -20.491 4.498
15 HA2 GLY 4 1HA GLY 4 9.306 -20.742 5.311
16 HA3 GLY 4 2HA GLY 4 9.651 -21.740 3.906
17 H SER 5 H SER 5 9.178 -18.472 5.065
18 HA SER 5 HA SER 5 9.964 -17.362 2.481
19 HB2 SER 5 1HB SER 5 8.087 -16.434 4.030
20 HB3 SER 5 2HB SER 5 9.419 -15.721 4.939
21 HG SER 5 HG SER 5 8.482 -14.387 3.225
22 H SER 6 H SER 6 11.485 -15.352 2.746
23 HA SER 6 HA SER 6 13.487 -15.404 4.740
24 HB2 SER 6 1HB SER 6 15.372 -16.242 3.369
25 HB3 SER 6 2HB SER 6 14.162 -17.491 3.665
26 HG SER 6 HG SER 6 13.600 -17.465 1.602
27 H GLY 7 H GLY 7 15.377 -13.991 4.133
28 HA2 GLY 7 1HA GLY 7 15.904 -12.430 2.086
29 HA3 GLY 7 2HA GLY 7 14.354 -11.747 2.554
30 H MET 8 H MET 8 17.412 -11.005 2.670
31 HA MET 8 HA MET 8 18.114 -10.575 5.333
32 HB2 MET 8 1HB MET 8 19.528 -10.281 3.209
33 HB3 MET 8 2HB MET 8 18.829 -8.670 3.113
34 HG2 MET 8 1HG MET 8 19.760 -8.093 5.261
35 HG3 MET 8 2HG MET 8 20.370 -9.733 5.468
36 HE1 MET 8 3HE MET 8 22.053 -6.218 3.320
37 HE2 MET 8 1HE MET 8 20.972 -7.025 2.184
38 HE3 MET 8 2HE MET 8 20.370 -6.513 3.761
39 H GLU 9 H GLU 9 16.420 -8.416 3.069
40 HA GLU 9 HA GLU 9 15.853 -6.561 5.251
41 HB2 GLU 9 1HB GLU 9 15.515 -6.418 2.263
42 HB3 GLU 9 2HB GLU 9 14.771 -5.236 3.331
43 HG2 GLU 9 1HG GLU 9 17.210 -5.033 4.278
44 HG3 GLU 9 2HG GLU 9 17.640 -5.679 2.695
45 HA PRO 10 HA PRO 10 11.765 -8.011 5.955
46 HB2 PRO 10 1HB PRO 10 10.590 -5.718 6.808
47 HB3 PRO 10 2HB PRO 10 11.741 -6.630 7.791
48 HG2 PRO 10 1HG PRO 10 12.194 -4.187 6.123
49 HG3 PRO 10 2HG PRO 10 12.797 -4.559 7.748
50 HD2 PRO 10 1HD PRO 10 14.324 -4.838 5.529
51 HD3 PRO 10 2HD PRO 10 14.501 -5.889 6.948
52 H ALA 11 H ALA 11 10.662 -8.573 4.159
53 HA ALA 11 HA ALA 11 8.942 -6.612 2.933
54 HB1 ALA 11 3HB ALA 11 9.700 -6.892 0.669
55 HB2 ALA 11 1HB ALA 11 11.056 -6.358 1.663
56 HB3 ALA 11 2HB ALA 11 10.927 -8.050 1.180
57 H GLY 12 H GLY 12 7.515 -7.660 1.244
58 HA2 GLY 12 1HA GLY 12 7.142 -10.528 1.840
59 HA3 GLY 12 2HA GLY 12 5.788 -9.408 1.854
60 HA PRO 13 HA PRO 13 6.760 -11.226 -2.470
61 HB2 PRO 13 1HB PRO 13 4.965 -13.262 -2.522
62 HB3 PRO 13 2HB PRO 13 6.635 -13.466 -1.978
63 HG2 PRO 13 1HG PRO 13 4.145 -13.105 -0.356
64 HG3 PRO 13 2HG PRO 13 5.499 -14.219 -0.093
65 HD2 PRO 13 1HD PRO 13 5.237 -11.898 1.275
66 HD3 PRO 13 2HD PRO 13 6.819 -12.589 0.863
67 H CYS 14 H CYS 14 5.810 -9.648 -3.629
68 HA CYS 14 HA CYS 14 3.445 -8.372 -3.297
69 HB2 CYS 14 1HB CYS 14 4.809 -7.527 -4.998
70 HB3 CYS 14 2HB CYS 14 4.951 -9.092 -5.792
71 H GLY 15 H GLY 15 1.657 -9.484 -2.672
72 HA2 GLY 15 1HA GLY 15 0.810 -11.873 -4.062
73 HA3 GLY 15 2HA GLY 15 -0.023 -11.087 -2.729
74 H PHE 16 H PHE 16 0.954 -9.787 -5.884
75 HA PHE 16 HA PHE 16 -1.886 -9.472 -6.567
76 HB2 PHE 16 1HB PHE 16 0.235 -7.333 -6.852
77 HB3 PHE 16 2HB PHE 16 -1.422 -7.208 -7.432
78 HD1 PHE 16 1HD PHE 16 -3.144 -7.989 -5.401
79 HD2 PHE 16 2HD PHE 16 0.633 -6.069 -4.992
80 HE1 PHE 16 1HE PHE 16 -3.841 -7.090 -3.220
81 HE2 PHE 16 2HE PHE 16 -0.058 -5.167 -2.810
82 HZ PHE 16 HZ PHE 16 -2.297 -5.678 -1.920
83 H CYS 17 H CYS 17 1.449 -9.712 -7.618
84 HA CYS 17 HA CYS 17 1.084 -9.546 -10.382
85 HB2 CYS 17 1HB CYS 17 3.139 -10.753 -8.594
86 HB3 CYS 17 2HB CYS 17 3.154 -11.223 -10.290
87 HA PRO 18 HA PRO 18 -0.900 -13.260 -11.615
88 HB2 PRO 18 1HB PRO 18 0.375 -13.830 -13.943
89 HB3 PRO 18 2HB PRO 18 -0.765 -12.490 -13.776
90 HG2 PRO 18 1HG PRO 18 2.228 -12.450 -13.713
91 HG3 PRO 18 2HG PRO 18 1.110 -11.336 -14.523
92 HD2 PRO 18 1HD PRO 18 2.294 -10.750 -12.159
93 HD3 PRO 18 2HD PRO 18 0.672 -10.168 -12.585
94 H ALA 19 H ALA 19 -0.735 -15.323 -10.999
95 HA ALA 19 HA ALA 19 1.223 -16.538 -9.668
96 HB1 ALA 19 3HB ALA 19 -0.122 -18.300 -9.792
97 HB2 ALA 19 1HB ALA 19 -1.084 -17.416 -10.977
98 HB3 ALA 19 2HB ALA 19 0.204 -18.495 -11.514
99 H GLY 20 H GLY 20 3.333 -16.734 -10.015
100 HA2 GLY 20 1HA GLY 20 4.996 -18.039 -11.293
101 HA3 GLY 20 2HA GLY 20 4.232 -17.415 -12.747
102 H GLU 21 H GLU 21 3.940 -14.741 -12.074
103 HA GLU 21 HA GLU 21 6.723 -13.876 -12.227
104 HB2 GLU 21 1HB GLU 21 4.097 -12.583 -12.908
105 HB3 GLU 21 2HB GLU 21 5.567 -11.629 -12.772
106 HG2 GLU 21 1HG GLU 21 5.581 -14.044 -14.508
107 HG3 GLU 21 2HG GLU 21 4.776 -12.583 -15.078
108 H VAL 22 H VAL 22 6.000 -14.720 -9.699
109 HA VAL 22 HA VAL 22 5.092 -12.631 -8.013
110 HB VAL 22 HB VAL 22 6.763 -15.054 -7.328
111 HG11 VAL 22 1HG1 VAL 22 6.490 -12.898 -5.749
112 HG12 VAL 22 2HG1 VAL 22 5.031 -13.784 -5.304
113 HG13 VAL 22 3HG1 VAL 22 6.613 -14.545 -5.131
114 HG21 VAL 22 3HG2 VAL 22 4.903 -16.228 -7.641
115 HG22 VAL 22 1HG2 VAL 22 4.114 -15.273 -6.386
116 HG23 VAL 22 2HG2 VAL 22 4.018 -14.765 -8.072
117 H GLN 23 H GLN 23 6.116 -10.882 -7.304
118 HA GLN 23 HA GLN 23 9.060 -10.842 -7.408
119 HB2 GLN 23 1HB GLN 23 7.063 -8.708 -8.121
120 HB3 GLN 23 2HB GLN 23 8.724 -8.308 -7.707
121 HG2 GLN 23 1HG GLN 23 9.256 -10.127 -9.536
122 HG3 GLN 23 2HG GLN 23 7.642 -9.693 -10.098
123 HE21 GLN 23 1HE2 GLN 23 10.634 -8.133 -8.998
124 HE22 GLN 23 2HE2 GLN 23 10.615 -6.875 -10.181
125 HA PRO 24 HA PRO 24 9.123 -9.783 -3.151
126 HB2 PRO 24 1HB PRO 24 11.295 -8.158 -3.036
127 HB3 PRO 24 2HB PRO 24 11.413 -9.906 -3.274
128 HG2 PRO 24 1HG PRO 24 11.554 -7.705 -5.299
129 HG3 PRO 24 2HG PRO 24 12.555 -9.162 -5.158
130 HD2 PRO 24 1HD PRO 24 10.508 -8.965 -6.920
131 HD3 PRO 24 2HD PRO 24 10.968 -10.502 -6.159
132 H ALA 25 H ALA 25 7.437 -8.548 -2.506
133 HA ALA 25 HA ALA 25 7.039 -5.860 -3.422
134 HB1 ALA 25 3HB ALA 25 5.550 -6.541 -1.037
135 HB2 ALA 25 1HB ALA 25 4.971 -6.153 -2.657
136 HB3 ALA 25 2HB ALA 25 5.441 -7.806 -2.261
137 H ARG 26 H ARG 26 9.242 -5.153 -2.743
138 HA ARG 26 HA ARG 26 10.024 -4.950 -0.062
139 HB2 ARG 26 1HB ARG 26 10.728 -3.356 -2.517
140 HB3 ARG 26 2HB ARG 26 11.422 -2.983 -0.944
141 HG2 ARG 26 1HG ARG 26 12.206 -5.378 -0.856
142 HG3 ARG 26 2HG ARG 26 11.735 -5.500 -2.553
143 HD2 ARG 26 1HD ARG 26 13.297 -3.818 -3.187
144 HD3 ARG 26 2HD ARG 26 13.622 -3.402 -1.505
145 HE ARG 26 HE ARG 26 14.372 -5.968 -1.584
146 HH11 ARG 26 2HH1 ARG 26 15.065 -3.295 -3.704
147 HH12 ARG 26 1HH1 ARG 26 16.620 -3.899 -4.171
148 HH21 ARG 26 2HH2 ARG 26 16.417 -6.775 -2.192
149 HH22 ARG 26 1HH2 ARG 26 17.388 -5.879 -3.312
150 H TYR 27 H TYR 27 7.727 -3.151 -1.903
151 HA TYR 27 HA TYR 27 7.517 -1.152 0.247
152 HB2 TYR 27 1HB TYR 27 6.152 -0.842 -2.400
153 HB3 TYR 27 2HB TYR 27 6.720 0.398 -1.289
154 HD1 TYR 27 1HD TYR 27 9.368 0.378 -0.934
155 HD2 TYR 27 2HD TYR 27 7.346 -1.161 -4.346
156 HE1 TYR 27 1HE TYR 27 11.425 0.627 -2.258
157 HE2 TYR 27 2HE TYR 27 9.398 -0.918 -5.680
158 HH TYR 27 HH TYR 27 12.425 -0.368 -4.311
159 H THR 28 H THR 28 5.250 -0.356 0.633
160 HA THR 28 HA THR 28 3.130 -2.263 0.111
161 HB THR 28 HB THR 28 3.476 -1.599 2.996
162 HG1 THR 28 1HG THR 28 5.013 -3.494 1.545
163 HG21 THR 28 3HG2 THR 28 2.627 -4.205 1.773
164 HG22 THR 28 1HG2 THR 28 1.512 -2.844 1.880
165 HG23 THR 28 2HG2 THR 28 2.208 -3.531 3.347
166 H CYS 29 H CYS 29 1.059 -1.423 0.435
167 HA CYS 29 HA CYS 29 0.787 1.358 0.114
168 HB2 CYS 29 1HB CYS 29 -0.825 -0.674 -0.445
169 HB3 CYS 29 2HB CYS 29 -1.509 -0.259 1.124
170 HA PRO 30 HA PRO 30 1.190 2.523 4.399
171 HB2 PRO 30 1HB PRO 30 0.828 5.183 3.989
172 HB3 PRO 30 2HB PRO 30 2.349 4.354 3.634
173 HG2 PRO 30 1HG PRO 30 0.140 5.138 1.772
174 HG3 PRO 30 2HG PRO 30 1.893 5.276 1.548
175 HD2 PRO 30 1HD PRO 30 0.436 3.279 0.442
176 HD3 PRO 30 2HD PRO 30 2.119 3.058 0.961
177 H ARG 31 H ARG 31 -1.526 2.243 2.604
178 HA ARG 31 HA ARG 31 -3.222 3.409 4.713
179 HB2 ARG 31 1HB ARG 31 -3.792 3.146 1.756
180 HB3 ARG 31 2HB ARG 31 -4.983 3.635 2.954
181 HG2 ARG 31 1HG ARG 31 -3.046 5.409 3.496
182 HG3 ARG 31 2HG ARG 31 -2.743 5.144 1.778
183 HD2 ARG 31 1HD ARG 31 -5.048 6.408 3.135
184 HD3 ARG 31 2HD ARG 31 -4.284 6.802 1.595
185 HE ARG 31 HE ARG 31 -5.470 4.464 1.043
186 HH11 ARG 31 2HH1 ARG 31 -6.640 7.350 2.598
187 HH12 ARG 31 1HH1 ARG 31 -8.274 7.132 2.065
188 HH21 ARG 31 2HH2 ARG 31 -7.617 4.165 0.335
189 HH22 ARG 31 1HH2 ARG 31 -8.829 5.319 0.778
190 H CYS 32 H CYS 32 -3.050 0.856 2.242
191 HA CYS 32 HA CYS 32 -4.796 -0.797 3.945
192 HB2 CYS 32 1HB CYS 32 -5.615 -1.886 2.024
193 HB3 CYS 32 2HB CYS 32 -5.552 -0.186 1.573
194 H ASN 33 H ASN 33 -1.805 -0.390 3.989
195 HA ASN 33 HA ASN 33 0.151 -1.632 3.879
196 HB2 ASN 33 1HB ASN 33 -1.085 -2.092 6.071
197 HB3 ASN 33 2HB ASN 33 -1.555 -3.632 5.358
198 HD21 ASN 33 1HD2 ASN 33 0.956 -1.809 6.812
199 HD22 ASN 33 2HD2 ASN 33 2.148 -3.060 6.845
200 H ALA 34 H ALA 34 -0.755 -1.951 1.441
201 HA ALA 34 HA ALA 34 -0.947 -4.834 0.911
202 HB1 ALA 34 3HB ALA 34 -1.759 -2.403 -0.623
203 HB2 ALA 34 1HB ALA 34 -1.450 -3.917 -1.474
204 HB3 ALA 34 2HB ALA 34 -2.694 -3.844 -0.224
205 HA PRO 35 HA PRO 35 3.392 -4.537 -0.173
206 HB2 PRO 35 1HB PRO 35 3.712 -7.196 -0.617
207 HB3 PRO 35 2HB PRO 35 3.676 -6.490 1.003
208 HG2 PRO 35 1HG PRO 35 1.494 -7.873 -0.509
209 HG3 PRO 35 2HG PRO 35 1.950 -8.037 1.196
210 HD2 PRO 35 1HD PRO 35 -0.147 -6.527 0.388
211 HD3 PRO 35 2HD PRO 35 0.833 -6.116 1.810
212 H TYR 36 H TYR 36 3.733 -3.657 -2.128
213 HA TYR 36 HA TYR 36 2.918 -5.208 -4.498
214 HB2 TYR 36 1HB TYR 36 2.792 -3.025 -5.702
215 HB3 TYR 36 2HB TYR 36 1.606 -3.186 -4.411
216 HD1 TYR 36 2HD TYR 36 4.746 -1.539 -5.415
217 HD2 TYR 36 1HD TYR 36 1.651 -1.741 -2.503
218 HE1 TYR 36 2HE TYR 36 5.538 0.573 -4.434
219 HE2 TYR 36 1HE TYR 36 2.434 0.370 -1.515
220 HH TYR 36 HH TYR 36 5.430 1.757 -2.279
221 H CYS 37 H CYS 37 4.433 -5.629 -6.013
222 HA CYS 37 HA CYS 37 7.161 -5.424 -5.356
223 HB2 CYS 37 1HB CYS 37 7.561 -6.234 -7.666
224 HB3 CYS 37 2HB CYS 37 6.353 -7.189 -6.812
225 H SER 38 H SER 38 5.194 -3.642 -7.722
226 HA SER 38 HA SER 38 7.068 -1.409 -7.523
227 HB2 SER 38 1HB SER 38 7.464 -3.037 -9.579
228 HB3 SER 38 2HB SER 38 6.118 -2.126 -10.264
229 HG SER 38 HG SER 38 8.637 -1.167 -9.409
230 H LEU 39 H LEU 39 6.140 0.488 -8.925
231 HA LEU 39 HA LEU 39 3.763 1.328 -7.792
232 HB2 LEU 39 1HB LEU 39 5.219 2.159 -10.276
233 HB3 LEU 39 2HB LEU 39 3.699 2.922 -9.817
234 HG LEU 39 HG LEU 39 5.603 4.268 -9.123
235 HD11 LEU 39 1HD1 LEU 39 4.988 4.596 -6.818
236 HD12 LEU 39 2HD1 LEU 39 4.266 2.989 -6.744
237 HD13 LEU 39 3HD1 LEU 39 3.541 4.235 -7.760
238 HD21 LEU 39 3HD2 LEU 39 7.231 3.505 -7.553
239 HD22 LEU 39 1HD2 LEU 39 7.177 2.343 -8.879
240 HD23 LEU 39 2HD2 LEU 39 6.391 1.967 -7.345
241 H ARG 40 H ARG 40 4.301 -0.375 -10.830
242 HA ARG 40 HA ARG 40 1.898 -0.151 -12.096
243 HB2 ARG 40 1HB ARG 40 2.293 -2.374 -13.041
244 HB3 ARG 40 2HB ARG 40 3.779 -1.435 -12.995
245 HG2 ARG 40 1HG ARG 40 4.253 -2.645 -10.790
246 HG3 ARG 40 2HG ARG 40 2.975 -3.757 -11.283
247 HD2 ARG 40 1HD ARG 40 4.953 -4.750 -12.050
248 HD3 ARG 40 2HD ARG 40 4.257 -3.984 -13.477
249 HE ARG 40 HE ARG 40 6.051 -2.212 -12.213
250 HH11 ARG 40 2HH1 ARG 40 5.994 -5.126 -14.117
251 HH12 ARG 40 1HH1 ARG 40 7.555 -4.854 -14.818
252 HH21 ARG 40 2HH2 ARG 40 8.107 -1.842 -13.130
253 HH22 ARG 40 1HH2 ARG 40 8.756 -2.986 -14.255
254 H CYS 41 H CYS 41 2.672 -2.617 -9.638
255 HA CYS 41 HA CYS 41 0.010 -3.601 -9.486
256 HB2 CYS 41 1HB CYS 41 2.491 -3.956 -7.842
257 HB3 CYS 41 2HB CYS 41 0.950 -4.554 -7.237
258 H TYR 42 H TYR 42 1.862 -1.253 -7.616
259 HA TYR 42 HA TYR 42 0.182 -0.863 -5.462
260 HB2 TYR 42 1HB TYR 42 2.285 0.243 -5.467
261 HB3 TYR 42 2HB TYR 42 1.927 1.076 -6.976
262 HD1 TYR 42 1HD TYR 42 0.264 0.736 -3.637
263 HD2 TYR 42 2HD TYR 42 1.603 3.337 -6.726
264 HE1 TYR 42 1HE TYR 42 -0.572 2.668 -2.365
265 HE2 TYR 42 2HE TYR 42 0.772 5.276 -5.462
266 HH TYR 42 HH TYR 42 -0.435 5.944 -3.699
267 H ARG 43 H ARG 43 -0.227 0.117 -8.772
268 HA ARG 43 HA ARG 43 -2.473 1.856 -8.128
269 HB2 ARG 43 1HB ARG 43 -0.994 1.191 -10.659
270 HB3 ARG 43 2HB ARG 43 -2.547 2.014 -10.711
271 HG2 ARG 43 1HG ARG 43 -1.717 3.933 -9.748
272 HG3 ARG 43 2HG ARG 43 -0.370 3.090 -8.981
273 HD2 ARG 43 1HD ARG 43 0.643 4.273 -10.711
274 HD3 ARG 43 2HD ARG 43 0.448 2.652 -11.378
275 HE ARG 43 HE ARG 43 -1.062 3.483 -12.899
276 HH11 ARG 43 2HH1 ARG 43 -0.413 5.879 -10.458
277 HH12 ARG 43 1HH1 ARG 43 -1.229 7.151 -11.304
278 HH21 ARG 43 2HH2 ARG 43 -2.139 5.150 -14.023
279 HH22 ARG 43 1HH2 ARG 43 -2.211 6.736 -13.332
280 H THR 44 H THR 44 -1.817 -1.299 -9.505
281 HA THR 44 HA THR 44 -4.483 -1.764 -10.429
282 HB THR 44 HB THR 44 -2.256 -3.734 -9.875
283 HG1 THR 44 1HG THR 44 -1.657 -3.376 -11.918
284 HG21 THR 44 3HG2 THR 44 -3.569 -5.187 -11.451
285 HG22 THR 44 1HG2 THR 44 -4.901 -4.043 -11.291
286 HG23 THR 44 2HG2 THR 44 -4.325 -4.928 -9.879
287 H HIS 45 H HIS 45 -2.617 -3.210 -7.749
288 HA HIS 45 HA HIS 45 -4.388 -4.768 -6.505
289 HB2 HIS 45 1HB HIS 45 -3.168 -4.529 -4.571
290 HB3 HIS 45 2HB HIS 45 -2.046 -3.814 -5.724
291 HD1 HIS 45 1HD HIS 45 -1.668 -1.267 -5.589
292 HD2 HIS 45 2HD HIS 45 -4.336 -2.732 -2.761
293 HE1 HIS 45 1HE HIS 45 -1.989 0.601 -3.937
294 H GLY 46 H GLY 46 -4.362 -1.225 -6.156
295 HA2 GLY 46 1HA GLY 46 -7.224 -1.182 -5.854
296 HA3 GLY 46 2HA GLY 46 -6.371 -0.821 -4.360
297 H THR 47 H THR 47 -7.754 1.192 -4.832
298 HA THR 47 HA THR 47 -6.197 3.063 -6.494
299 HB THR 47 HB THR 47 -8.239 4.447 -6.631
300 HG1 THR 47 1HG THR 47 -10.110 3.785 -5.714
301 HG21 THR 47 3HG2 THR 47 -8.435 3.329 -8.554
302 HG22 THR 47 1HG2 THR 47 -9.575 2.266 -7.729
303 HG23 THR 47 2HG2 THR 47 -7.868 1.831 -7.816
304 H CYS 48 H CYS 48 -5.301 2.506 -3.937
305 HA CYS 48 HA CYS 48 -6.287 4.527 -2.119
306 HB2 CYS 48 1HB CYS 48 -3.757 2.956 -1.716
307 HB3 CYS 48 2HB CYS 48 -4.874 3.580 -0.507
308 H ALA 49 H ALA 49 -5.308 5.552 -4.583
309 HA ALA 49 HA ALA 49 -2.956 7.059 -3.641
310 HB1 ALA 49 3HB ALA 49 -3.239 5.507 -5.992
311 HB2 ALA 49 1HB ALA 49 -3.149 7.201 -6.474
312 HB3 ALA 49 2HB ALA 49 -1.868 6.494 -5.488
313 H GLU 50 H GLU 50 -6.064 7.148 -5.247
314 HA GLU 50 HA GLU 50 -6.343 9.551 -6.358
315 HB2 GLU 50 1HB GLU 50 -8.136 7.780 -5.572
316 HB3 GLU 50 2HB GLU 50 -8.357 8.913 -4.246
317 HG2 GLU 50 1HG GLU 50 -8.769 10.701 -5.915
318 HG3 GLU 50 2HG GLU 50 -8.694 9.477 -7.181
319 H ASN 51 H ASN 51 -6.036 9.014 -2.886
320 HA ASN 51 HA ASN 51 -6.095 11.902 -2.410
321 HB2 ASN 51 1HB ASN 51 -5.894 9.725 -0.328
322 HB3 ASN 51 2HB ASN 51 -6.385 11.400 -0.096
323 HD21 ASN 51 1HD2 ASN 51 -8.394 12.075 -1.113
324 HD22 ASN 51 2HD2 ASN 51 -9.674 10.926 -1.279
325 H PHE 52 H PHE 52 -3.988 9.098 -2.170
326 HA PHE 52 HA PHE 52 -1.831 10.604 -0.980
327 HB2 PHE 52 1HB PHE 52 -2.288 7.774 -1.771
328 HB3 PHE 52 2HB PHE 52 -0.620 8.333 -1.709
329 HD1 PHE 52 2HD PHE 52 -3.609 8.996 0.423
330 HD2 PHE 52 1HD PHE 52 0.394 7.565 0.198
331 HE1 PHE 52 2HE PHE 52 -3.593 8.666 2.861
332 HE2 PHE 52 1HE PHE 52 0.415 7.232 2.635
333 HZ PHE 52 HZ PHE 52 -1.579 7.783 3.971
334 H TYR 53 H TYR 53 -1.619 12.253 -2.595
335 HA TYR 53 HA TYR 53 -0.315 11.331 -5.071
336 HB2 TYR 53 1HB TYR 53 -2.096 13.663 -4.480
337 HB3 TYR 53 2HB TYR 53 -0.910 13.795 -5.774
338 HD1 TYR 53 1HD TYR 53 -0.918 11.271 -7.102
339 HD2 TYR 53 2HD TYR 53 -4.200 13.355 -5.373
340 HE1 TYR 53 1HE TYR 53 -2.453 10.111 -8.633
341 HE2 TYR 53 2HE TYR 53 -5.744 12.200 -6.899
342 HH TYR 53 HH TYR 53 -4.595 10.225 -9.529
343 H SER 54 H SER 54 -0.314 14.105 -2.827
344 HA SER 54 HA SER 54 2.359 14.851 -3.582
345 HB2 SER 54 1HB SER 54 0.352 16.324 -2.669
346 HB3 SER 54 2HB SER 54 1.068 15.922 -1.109
347 HG SER 54 HG SER 54 3.012 16.824 -1.822
348 H GLY 55 H GLY 55 4.231 14.316 -2.627
349 HA2 GLY 55 1HA GLY 55 4.421 13.486 0.101
350 HA3 GLY 55 2HA GLY 55 4.525 12.118 -0.996
351 HA PRO 56 HA PRO 56 8.353 15.059 -1.665
352 HB2 PRO 56 1HB PRO 56 9.026 16.477 0.551
353 HB3 PRO 56 2HB PRO 56 7.959 17.111 -0.709
354 HG2 PRO 56 1HG PRO 56 7.255 15.891 1.933
355 HG3 PRO 56 2HG PRO 56 6.570 17.324 1.144
356 HD2 PRO 56 1HD PRO 56 5.338 14.913 1.107
357 HD3 PRO 56 2HD PRO 56 5.208 16.072 -0.231
358 H SER 57 H SER 57 9.925 13.586 -1.641
359 HA SER 57 HA SER 57 11.090 12.768 0.890
360 HB2 SER 57 1HB SER 57 9.985 10.759 -1.087
361 HB3 SER 57 2HB SER 57 11.018 10.355 0.284
362 HG SER 57 HG SER 57 8.500 10.372 0.389
363 H SER 58 H SER 58 12.937 11.044 0.256
364 HA SER 58 HA SER 58 14.554 12.445 -1.738
365 HB2 SER 58 1HB SER 58 16.469 11.530 -0.666
366 HB3 SER 58 2HB SER 58 15.379 12.010 0.635
367 HG SER 58 HG SER 58 16.232 9.914 0.965
368 H GLY 59 H GLY 59 16.121 11.008 -2.990
369 HA2 GLY 59 1HA GLY 59 16.403 8.678 -3.835
370 HA3 GLY 59 2HA GLY 59 14.651 8.637 -3.967
Start of MODEL 3
1 H1 GLY 1 1H GLY 1 4.919 11.930 23.513
2 HA2 GLY 1 1HA GLY 1 4.740 11.498 21.065
3 HA3 GLY 1 2HA GLY 1 6.284 12.219 21.494
4 H SER 2 H SER 2 7.044 11.225 19.503
5 HA SER 2 HA SER 2 7.936 8.475 19.995
6 HB2 SER 2 1HB SER 2 7.515 7.888 17.629
7 HB3 SER 2 2HB SER 2 6.025 8.292 18.480
8 HG SER 2 HG SER 2 6.674 10.543 17.560
9 H SER 3 H SER 3 9.878 7.890 18.899
10 HA SER 3 HA SER 3 11.328 9.912 17.426
11 HB2 SER 3 1HB SER 3 12.074 9.118 20.228
12 HB3 SER 3 2HB SER 3 13.312 9.628 19.079
13 HG SER 3 HG SER 3 11.054 11.237 19.310
14 H GLY 4 H GLY 4 13.478 9.095 16.702
15 HA2 GLY 4 1HA GLY 4 14.936 7.124 16.515
16 HA3 GLY 4 2HA GLY 4 13.476 6.145 16.525
17 H SER 5 H SER 5 15.433 8.365 14.646
18 HA SER 5 HA SER 5 13.998 8.674 12.346
19 HB2 SER 5 1HB SER 5 16.209 8.699 11.146
20 HB3 SER 5 2HB SER 5 16.149 9.727 12.577
21 HG SER 5 HG SER 5 17.368 7.187 12.299
22 H SER 6 H SER 6 16.143 5.930 13.086
23 HA SER 6 HA SER 6 15.974 4.431 10.842
24 HB2 SER 6 1HB SER 6 17.084 3.873 13.107
25 HB3 SER 6 2HB SER 6 15.545 3.116 13.518
26 HG SER 6 HG SER 6 15.853 1.952 11.437
27 H GLY 7 H GLY 7 14.571 2.957 9.908
28 HA2 GLY 7 1HA GLY 7 11.995 2.414 11.109
29 HA3 GLY 7 2HA GLY 7 11.928 3.472 9.707
30 H MET 8 H MET 8 13.313 0.350 10.721
31 HA MET 8 HA MET 8 13.267 -0.605 7.983
32 HB2 MET 8 1HB MET 8 14.125 -1.902 10.573
33 HB3 MET 8 2HB MET 8 14.197 -2.702 9.008
34 HG2 MET 8 1HG MET 8 15.805 -1.145 8.200
35 HG3 MET 8 2HG MET 8 15.604 -0.118 9.618
36 HE1 MET 8 3HE MET 8 18.126 -1.266 12.006
37 HE2 MET 8 1HE MET 8 17.240 0.041 11.219
38 HE3 MET 8 2HE MET 8 16.381 -1.125 12.227
39 H GLU 9 H GLU 9 12.171 -2.557 7.349
40 HA GLU 9 HA GLU 9 10.153 -3.711 9.014
41 HB2 GLU 9 1HB GLU 9 8.207 -3.006 7.731
42 HB3 GLU 9 2HB GLU 9 9.031 -1.609 8.408
43 HG2 GLU 9 1HG GLU 9 10.181 -1.385 6.158
44 HG3 GLU 9 2HG GLU 9 9.002 -2.551 5.562
45 HA PRO 10 HA PRO 10 11.015 -6.985 6.185
46 HB2 PRO 10 1HB PRO 10 9.006 -8.659 6.914
47 HB3 PRO 10 2HB PRO 10 10.449 -8.402 7.903
48 HG2 PRO 10 1HG PRO 10 7.724 -7.192 8.177
49 HG3 PRO 10 2HG PRO 10 8.798 -7.828 9.437
50 HD2 PRO 10 1HD PRO 10 8.559 -5.179 8.925
51 HD3 PRO 10 2HD PRO 10 10.075 -5.910 9.492
52 H ALA 11 H ALA 11 10.534 -7.202 4.096
53 HA ALA 11 HA ALA 11 8.079 -6.083 3.050
54 HB1 ALA 11 3HB ALA 11 9.997 -5.562 1.786
55 HB2 ALA 11 1HB ALA 11 10.534 -7.242 1.759
56 HB3 ALA 11 2HB ALA 11 9.114 -6.754 0.833
57 H GLY 12 H GLY 12 7.011 -7.378 1.196
58 HA2 GLY 12 1HA GLY 12 6.811 -10.228 1.910
59 HA3 GLY 12 2HA GLY 12 5.355 -9.245 1.841
60 HA PRO 13 HA PRO 13 6.671 -11.042 -2.393
61 HB2 PRO 13 1HB PRO 13 5.017 -13.192 -2.492
62 HB3 PRO 13 2HB PRO 13 6.665 -13.277 -1.859
63 HG2 PRO 13 1HG PRO 13 4.075 -13.049 -0.375
64 HG3 PRO 13 2HG PRO 13 5.483 -14.067 -0.019
65 HD2 PRO 13 1HD PRO 13 4.999 -11.743 1.283
66 HD3 PRO 13 2HD PRO 13 6.643 -12.336 0.968
67 H CYS 14 H CYS 14 5.683 -9.531 -3.613
68 HA CYS 14 HA CYS 14 3.283 -8.357 -3.471
69 HB2 CYS 14 1HB CYS 14 4.750 -7.687 -5.214
70 HB3 CYS 14 2HB CYS 14 4.742 -9.291 -5.939
71 H GLY 15 H GLY 15 1.437 -9.341 -2.886
72 HA2 GLY 15 1HA GLY 15 0.685 -11.885 -4.094
73 HA3 GLY 15 2HA GLY 15 -0.147 -11.068 -2.779
74 H PHE 16 H PHE 16 0.745 -9.604 -5.854
75 HA PHE 16 HA PHE 16 -2.114 -9.484 -6.554
76 HB2 PHE 16 1HB PHE 16 -0.065 -7.298 -6.981
77 HB3 PHE 16 2HB PHE 16 -1.763 -7.231 -7.443
78 HD1 PHE 16 1HD PHE 16 -3.242 -8.131 -5.209
79 HD2 PHE 16 2HD PHE 16 0.359 -5.862 -5.250
80 HE1 PHE 16 1HE PHE 16 -3.806 -7.202 -3.001
81 HE2 PHE 16 2HE PHE 16 -0.199 -4.930 -3.043
82 HZ PHE 16 HZ PHE 16 -2.283 -5.600 -1.915
83 H CYS 17 H CYS 17 1.209 -9.664 -7.659
84 HA CYS 17 HA CYS 17 0.793 -9.574 -10.418
85 HB2 CYS 17 1HB CYS 17 2.911 -10.632 -8.626
86 HB3 CYS 17 2HB CYS 17 2.901 -11.235 -10.280
87 HA PRO 18 HA PRO 18 -1.129 -13.361 -11.521
88 HB2 PRO 18 1HB PRO 18 0.098 -13.941 -13.872
89 HB3 PRO 18 2HB PRO 18 -1.074 -12.629 -13.699
90 HG2 PRO 18 1HG PRO 18 1.917 -12.507 -13.719
91 HG3 PRO 18 2HG PRO 18 0.749 -11.439 -14.518
92 HD2 PRO 18 1HD PRO 18 1.979 -10.776 -12.199
93 HD3 PRO 18 2HD PRO 18 0.330 -10.247 -12.591
94 H ALA 19 H ALA 19 -0.905 -15.461 -11.017
95 HA ALA 19 HA ALA 19 1.000 -16.645 -9.627
96 HB1 ALA 19 3HB ALA 19 -1.165 -17.623 -10.777
97 HB2 ALA 19 1HB ALA 19 0.023 -18.318 -11.881
98 HB3 ALA 19 2HB ALA 19 0.105 -18.677 -10.156
99 H GLY 20 H GLY 20 3.055 -17.353 -9.788
100 HA2 GLY 20 1HA GLY 20 4.969 -18.181 -10.884
101 HA3 GLY 20 2HA GLY 20 4.262 -17.712 -12.424
102 H GLU 21 H GLU 21 3.673 -15.049 -11.945
103 HA GLU 21 HA GLU 21 6.341 -13.915 -12.061
104 HB2 GLU 21 1HB GLU 21 3.592 -12.938 -12.741
105 HB3 GLU 21 2HB GLU 21 4.896 -11.779 -12.523
106 HG2 GLU 21 1HG GLU 21 4.773 -12.232 -14.831
107 HG3 GLU 21 2HG GLU 21 6.200 -13.074 -14.231
108 H VAL 22 H VAL 22 5.658 -14.840 -9.510
109 HA VAL 22 HA VAL 22 4.748 -12.662 -7.874
110 HB VAL 22 HB VAL 22 6.092 -15.256 -7.101
111 HG11 VAL 22 1HG1 VAL 22 5.540 -12.909 -5.566
112 HG12 VAL 22 2HG1 VAL 22 4.518 -14.232 -5.000
113 HG13 VAL 22 3HG1 VAL 22 6.271 -14.428 -5.049
114 HG21 VAL 22 3HG2 VAL 22 4.105 -16.053 -7.818
115 HG22 VAL 22 1HG2 VAL 22 3.543 -15.468 -6.252
116 HG23 VAL 22 2HG2 VAL 22 3.310 -14.484 -7.697
117 H GLN 23 H GLN 23 5.924 -10.990 -7.236
118 HA GLN 23 HA GLN 23 8.852 -11.294 -7.113
119 HB2 GLN 23 1HB GLN 23 7.195 -8.892 -7.886
120 HB3 GLN 23 2HB GLN 23 8.920 -8.812 -7.552
121 HG2 GLN 23 1HG GLN 23 9.271 -10.488 -9.366
122 HG3 GLN 23 2HG GLN 23 7.559 -10.332 -9.760
123 HE21 GLN 23 1HE2 GLN 23 6.882 -8.642 -10.952
124 HE22 GLN 23 2HE2 GLN 23 7.916 -7.396 -11.555
125 HA PRO 24 HA PRO 24 8.767 -10.146 -2.879
126 HB2 PRO 24 1HB PRO 24 11.107 -8.787 -2.651
127 HB3 PRO 24 2HB PRO 24 11.030 -10.542 -2.848
128 HG2 PRO 24 1HG PRO 24 11.561 -8.427 -4.899
129 HG3 PRO 24 2HG PRO 24 12.370 -9.988 -4.667
130 HD2 PRO 24 1HD PRO 24 10.477 -9.596 -6.563
131 HD3 PRO 24 2HD PRO 24 10.701 -11.156 -5.745
132 H ALA 25 H ALA 25 7.082 -8.713 -2.609
133 HA ALA 25 HA ALA 25 7.099 -6.032 -3.527
134 HB1 ALA 25 3HB ALA 25 5.190 -7.698 -2.543
135 HB2 ALA 25 1HB ALA 25 5.427 -6.597 -1.185
136 HB3 ALA 25 2HB ALA 25 4.987 -5.961 -2.771
137 H ARG 26 H ARG 26 9.065 -5.118 -2.845
138 HA ARG 26 HA ARG 26 9.948 -5.071 -0.165
139 HB2 ARG 26 1HB ARG 26 10.559 -3.317 -2.541
140 HB3 ARG 26 2HB ARG 26 11.320 -3.080 -0.973
141 HG2 ARG 26 1HG ARG 26 12.017 -5.539 -1.154
142 HG3 ARG 26 2HG ARG 26 11.594 -5.387 -2.861
143 HD2 ARG 26 1HD ARG 26 13.287 -3.870 -3.280
144 HD3 ARG 26 2HD ARG 26 13.392 -3.368 -1.594
145 HE ARG 26 HE ARG 26 14.684 -5.658 -2.821
146 HH11 ARG 26 2HH1 ARG 26 13.800 -4.007 0.114
147 HH12 ARG 26 1HH1 ARG 26 14.995 -4.809 1.079
148 HH21 ARG 26 2HH2 ARG 26 16.261 -6.720 -1.561
149 HH22 ARG 26 1HH2 ARG 26 16.395 -6.351 0.125
150 H TYR 27 H TYR 27 7.829 -2.973 -2.019
151 HA TYR 27 HA TYR 27 7.558 -1.161 0.265
152 HB2 TYR 27 1HB TYR 27 6.126 -0.749 -2.330
153 HB3 TYR 27 2HB TYR 27 6.748 0.445 -1.197
154 HD1 TYR 27 1HD TYR 27 9.309 0.665 -1.019
155 HD2 TYR 27 2HD TYR 27 7.345 -1.302 -4.240
156 HE1 TYR 27 1HE TYR 27 11.324 0.935 -2.403
157 HE2 TYR 27 2HE TYR 27 9.355 -1.039 -5.633
158 HH TYR 27 HH TYR 27 11.939 0.999 -4.765
159 H THR 28 H THR 28 5.165 -0.272 0.395
160 HA THR 28 HA THR 28 3.095 -2.208 -0.040
161 HB THR 28 HB THR 28 3.489 -1.602 2.860
162 HG1 THR 28 1HG THR 28 4.857 -3.608 1.372
163 HG21 THR 28 3HG2 THR 28 2.526 -4.169 1.656
164 HG22 THR 28 1HG2 THR 28 1.462 -2.764 1.710
165 HG23 THR 28 2HG2 THR 28 2.111 -3.437 3.206
166 H CYS 29 H CYS 29 1.039 -1.353 0.228
167 HA CYS 29 HA CYS 29 0.765 1.425 -0.012
168 HB2 CYS 29 1HB CYS 29 -0.849 -0.576 -0.627
169 HB3 CYS 29 2HB CYS 29 -1.526 -0.230 0.962
170 HA PRO 30 HA PRO 30 1.201 2.442 4.322
171 HB2 PRO 30 1HB PRO 30 1.042 5.129 3.964
172 HB3 PRO 30 2HB PRO 30 2.509 4.200 3.630
173 HG2 PRO 30 1HG PRO 30 0.414 5.180 1.730
174 HG3 PRO 30 2HG PRO 30 2.178 5.197 1.555
175 HD2 PRO 30 1HD PRO 30 0.614 3.334 0.365
176 HD3 PRO 30 2HD PRO 30 2.262 2.982 0.923
177 H ARG 31 H ARG 31 -1.477 2.352 2.477
178 HA ARG 31 HA ARG 31 -3.143 3.653 4.530
179 HB2 ARG 31 1HB ARG 31 -3.402 3.548 1.552
180 HB3 ARG 31 2HB ARG 31 -4.858 3.645 2.533
181 HG2 ARG 31 1HG ARG 31 -3.546 5.635 3.663
182 HG3 ARG 31 2HG ARG 31 -2.718 5.655 2.104
183 HD2 ARG 31 1HD ARG 31 -4.620 6.235 0.949
184 HD3 ARG 31 2HD ARG 31 -5.695 5.535 2.158
185 HE ARG 31 HE ARG 31 -4.584 8.203 2.145
186 HH11 ARG 31 2HH1 ARG 31 -6.104 5.696 4.022
187 HH12 ARG 31 1HH1 ARG 31 -6.697 6.783 5.234
188 HH21 ARG 31 2HH2 ARG 31 -5.359 9.644 3.734
189 HH22 ARG 31 1HH2 ARG 31 -6.274 9.028 5.069
190 H CYS 32 H CYS 32 -2.836 0.926 2.309
191 HA CYS 32 HA CYS 32 -4.740 -0.561 3.997
192 HB2 CYS 32 1HB CYS 32 -5.682 -1.626 2.126
193 HB3 CYS 32 2HB CYS 32 -5.526 0.056 1.628
194 H ASN 33 H ASN 33 -1.746 -0.303 3.981
195 HA ASN 33 HA ASN 33 0.149 -1.630 3.863
196 HB2 ASN 33 1HB ASN 33 -1.897 -2.980 5.579
197 HB3 ASN 33 2HB ASN 33 -0.356 -3.784 5.298
198 HD21 ASN 33 1HD2 ASN 33 1.216 -3.328 6.654
199 HD22 ASN 33 2HD2 ASN 33 1.317 -1.926 7.659
200 H ALA 34 H ALA 34 -0.762 -1.872 1.423
201 HA ALA 34 HA ALA 34 -1.048 -4.743 0.855
202 HB1 ALA 34 3HB ALA 34 -2.805 -3.720 -0.226
203 HB2 ALA 34 1HB ALA 34 -1.869 -2.276 -0.612
204 HB3 ALA 34 2HB ALA 34 -1.592 -3.772 -1.505
205 HA PRO 35 HA PRO 35 3.269 -4.483 -0.328
206 HB2 PRO 35 1HB PRO 35 3.550 -7.143 -0.792
207 HB3 PRO 35 2HB PRO 35 3.564 -6.445 0.832
208 HG2 PRO 35 1HG PRO 35 1.329 -7.797 -0.630
209 HG3 PRO 35 2HG PRO 35 1.827 -7.974 1.063
210 HD2 PRO 35 1HD PRO 35 -0.274 -6.439 0.315
211 HD3 PRO 35 2HD PRO 35 0.746 -6.045 1.713
212 H TYR 36 H TYR 36 3.832 -3.788 -2.285
213 HA TYR 36 HA TYR 36 2.849 -5.254 -4.640
214 HB2 TYR 36 1HB TYR 36 2.761 -3.066 -5.849
215 HB3 TYR 36 2HB TYR 36 1.574 -3.215 -4.558
216 HD1 TYR 36 2HD TYR 36 4.817 -1.681 -5.467
217 HD2 TYR 36 1HD TYR 36 1.556 -1.705 -2.734
218 HE1 TYR 36 2HE TYR 36 5.638 0.416 -4.479
219 HE2 TYR 36 1HE TYR 36 2.367 0.393 -1.739
220 HH TYR 36 HH TYR 36 3.832 2.382 -2.577
221 H CYS 37 H CYS 37 4.378 -5.850 -6.043
222 HA CYS 37 HA CYS 37 7.095 -5.659 -5.465
223 HB2 CYS 37 1HB CYS 37 7.462 -6.486 -7.767
224 HB3 CYS 37 2HB CYS 37 6.210 -7.393 -6.924
225 H SER 38 H SER 38 5.157 -3.803 -7.795
226 HA SER 38 HA SER 38 7.100 -1.630 -7.608
227 HB2 SER 38 1HB SER 38 6.281 -2.991 -10.176
228 HB3 SER 38 2HB SER 38 6.953 -1.361 -10.141
229 HG SER 38 HG SER 38 8.747 -2.373 -8.931
230 H LEU 39 H LEU 39 6.225 0.314 -8.949
231 HA LEU 39 HA LEU 39 3.886 1.217 -7.807
232 HB2 LEU 39 1HB LEU 39 5.333 2.005 -10.310
233 HB3 LEU 39 2HB LEU 39 3.843 2.814 -9.830
234 HG LEU 39 HG LEU 39 5.165 3.144 -7.565
235 HD11 LEU 39 1HD1 LEU 39 7.204 2.288 -9.494
236 HD12 LEU 39 2HD1 LEU 39 7.229 2.279 -7.731
237 HD13 LEU 39 3HD1 LEU 39 7.585 3.766 -8.609
238 HD21 LEU 39 3HD2 LEU 39 6.113 4.957 -9.698
239 HD22 LEU 39 1HD2 LEU 39 5.320 5.320 -8.165
240 HD23 LEU 39 2HD2 LEU 39 4.367 4.763 -9.540
241 H ARG 40 H ARG 40 4.320 -0.305 -10.981
242 HA ARG 40 HA ARG 40 1.860 -0.054 -12.104
243 HB2 ARG 40 1HB ARG 40 2.226 -2.265 -13.160
244 HB3 ARG 40 2HB ARG 40 3.648 -1.234 -13.225
245 HG2 ARG 40 1HG ARG 40 4.715 -2.462 -11.487
246 HG3 ARG 40 2HG ARG 40 3.241 -3.372 -11.152
247 HD2 ARG 40 1HD ARG 40 4.548 -3.454 -13.850
248 HD3 ARG 40 2HD ARG 40 5.090 -4.502 -12.539
249 HE ARG 40 HE ARG 40 2.476 -5.012 -12.559
250 HH11 ARG 40 2HH1 ARG 40 4.772 -4.791 -15.167
251 HH12 ARG 40 1HH1 ARG 40 3.938 -5.931 -16.171
252 HH21 ARG 40 2HH2 ARG 40 1.369 -6.514 -13.871
253 HH22 ARG 40 1HH2 ARG 40 2.002 -6.909 -15.433
254 H CYS 41 H CYS 41 2.759 -2.222 -9.477
255 HA CYS 41 HA CYS 41 0.114 -3.406 -9.379
256 HB2 CYS 41 1HB CYS 41 2.717 -3.870 -8.008
257 HB3 CYS 41 2HB CYS 41 1.253 -4.368 -7.167
258 H TYR 42 H TYR 42 2.029 -1.058 -7.602
259 HA TYR 42 HA TYR 42 0.462 -0.789 -5.318
260 HB2 TYR 42 1HB TYR 42 2.584 0.288 -5.370
261 HB3 TYR 42 2HB TYR 42 2.164 1.203 -6.813
262 HD1 TYR 42 1HD TYR 42 0.707 0.703 -3.399
263 HD2 TYR 42 2HD TYR 42 1.832 3.448 -6.449
264 HE1 TYR 42 1HE TYR 42 -0.044 2.572 -1.986
265 HE2 TYR 42 2HE TYR 42 1.085 5.324 -5.045
266 HH TYR 42 HH TYR 42 -0.036 5.897 -3.183
267 H ARG 43 H ARG 43 -0.133 0.221 -8.565
268 HA ARG 43 HA ARG 43 -2.326 1.975 -7.744
269 HB2 ARG 43 1HB ARG 43 -0.910 1.491 -10.350
270 HB3 ARG 43 2HB ARG 43 -2.470 2.300 -10.310
271 HG2 ARG 43 1HG ARG 43 -1.533 4.010 -8.822
272 HG3 ARG 43 2HG ARG 43 0.036 3.206 -8.909
273 HD2 ARG 43 1HD ARG 43 0.037 3.550 -11.354
274 HD3 ARG 43 2HD ARG 43 -1.488 4.422 -11.210
275 HE ARG 43 HE ARG 43 0.684 5.456 -9.603
276 HH11 ARG 43 2HH1 ARG 43 -1.039 5.611 -12.624
277 HH12 ARG 43 1HH1 ARG 43 -0.515 7.221 -12.990
278 HH21 ARG 43 2HH2 ARG 43 1.380 7.576 -10.074
279 HH22 ARG 43 1HH2 ARG 43 0.862 8.338 -11.540
280 H THR 44 H THR 44 -1.696 -1.048 -9.426
281 HA THR 44 HA THR 44 -4.372 -1.477 -10.295
282 HB THR 44 HB THR 44 -2.105 -3.441 -9.907
283 HG1 THR 44 1HG THR 44 -3.020 -1.851 -12.054
284 HG21 THR 44 3HG2 THR 44 -4.910 -3.779 -10.810
285 HG22 THR 44 1HG2 THR 44 -3.838 -4.917 -9.994
286 HG23 THR 44 2HG2 THR 44 -3.664 -4.627 -11.725
287 H HIS 45 H HIS 45 -2.465 -2.970 -7.673
288 HA HIS 45 HA HIS 45 -4.177 -4.653 -6.503
289 HB2 HIS 45 1HB HIS 45 -2.990 -4.425 -4.541
290 HB3 HIS 45 2HB HIS 45 -1.879 -3.656 -5.671
291 HD1 HIS 45 1HD HIS 45 -1.380 -1.199 -5.329
292 HD2 HIS 45 2HD HIS 45 -4.403 -2.605 -2.850
293 HE1 HIS 45 1HE HIS 45 -1.807 0.648 -3.676
294 H GLY 46 H GLY 46 -4.308 -1.126 -6.054
295 HA2 GLY 46 1HA GLY 46 -7.169 -1.225 -5.739
296 HA3 GLY 46 2HA GLY 46 -6.323 -0.853 -4.244
297 H THR 47 H THR 47 -8.066 0.973 -5.175
298 HA THR 47 HA THR 47 -6.497 2.991 -6.612
299 HB THR 47 HB THR 47 -8.599 4.216 -6.883
300 HG1 THR 47 1HG THR 47 -9.510 2.236 -5.114
301 HG21 THR 47 3HG2 THR 47 -8.092 2.634 -8.611
302 HG22 THR 47 1HG2 THR 47 -9.818 2.521 -8.268
303 HG23 THR 47 2HG2 THR 47 -8.713 1.297 -7.642
304 H CYS 48 H CYS 48 -5.718 2.459 -3.975
305 HA CYS 48 HA CYS 48 -6.893 4.296 -2.139
306 HB2 CYS 48 1HB CYS 48 -4.109 3.149 -1.949
307 HB3 CYS 48 2HB CYS 48 -5.161 3.666 -0.635
308 H ALA 49 H ALA 49 -4.230 4.436 -4.414
309 HA ALA 49 HA ALA 49 -3.186 6.922 -3.443
310 HB1 ALA 49 3HB ALA 49 -2.226 6.715 -5.983
311 HB2 ALA 49 1HB ALA 49 -1.485 5.985 -4.559
312 HB3 ALA 49 2HB ALA 49 -2.554 5.028 -5.585
313 H GLU 50 H GLU 50 -5.639 7.650 -3.531
314 HA GLU 50 HA GLU 50 -5.991 9.116 -6.063
315 HB2 GLU 50 1HB GLU 50 -8.427 9.028 -5.664
316 HB3 GLU 50 2HB GLU 50 -7.722 7.430 -5.864
317 HG2 GLU 50 1HG GLU 50 -7.760 7.089 -3.460
318 HG3 GLU 50 2HG GLU 50 -8.415 8.709 -3.229
319 H ASN 51 H ASN 51 -6.427 9.152 -2.560
320 HA ASN 51 HA ASN 51 -6.696 12.082 -2.673
321 HB2 ASN 51 1HB ASN 51 -7.543 10.132 -0.520
322 HB3 ASN 51 2HB ASN 51 -7.657 11.883 -0.379
323 HD21 ASN 51 1HD2 ASN 51 -8.865 12.945 -2.220
324 HD22 ASN 51 2HD2 ASN 51 -10.316 12.164 -2.739
325 H PHE 52 H PHE 52 -4.994 9.409 -1.143
326 HA PHE 52 HA PHE 52 -3.547 10.460 0.839
327 HB2 PHE 52 1HB PHE 52 -1.996 8.794 0.516
328 HB3 PHE 52 2HB PHE 52 -3.297 8.191 -0.507
329 HD1 PHE 52 1HD PHE 52 -3.205 8.931 -3.002
330 HD2 PHE 52 2HD PHE 52 0.126 8.999 -0.353
331 HE1 PHE 52 1HE PHE 52 -1.676 8.901 -4.930
332 HE2 PHE 52 2HE PHE 52 1.660 8.971 -2.277
333 HZ PHE 52 HZ PHE 52 0.760 8.922 -4.568
334 H TYR 53 H TYR 53 -2.927 11.063 -2.591
335 HA TYR 53 HA TYR 53 -0.576 12.542 -2.340
336 HB2 TYR 53 1HB TYR 53 -0.841 13.083 -4.564
337 HB3 TYR 53 2HB TYR 53 -1.904 11.685 -4.451
338 HD1 TYR 53 2HD TYR 53 -1.900 15.402 -4.356
339 HD2 TYR 53 1HD TYR 53 -4.164 11.864 -5.033
340 HE1 TYR 53 2HE TYR 53 -3.771 16.765 -5.187
341 HE2 TYR 53 1HE TYR 53 -6.041 13.217 -5.868
342 HH TYR 53 HH TYR 53 -5.901 16.759 -5.852
343 H SER 54 H SER 54 -0.138 14.730 -2.150
344 HA SER 54 HA SER 54 -2.386 16.411 -1.251
345 HB2 SER 54 1HB SER 54 0.448 16.399 -0.185
346 HB3 SER 54 2HB SER 54 -0.825 17.513 0.314
347 HG SER 54 HG SER 54 -0.619 14.737 0.764
348 H GLY 55 H GLY 55 -1.805 18.805 -1.347
349 HA2 GLY 55 1HA GLY 55 0.119 20.047 -2.752
350 HA3 GLY 55 2HA GLY 55 -0.862 19.353 -4.034
351 HA PRO 56 HA PRO 56 -3.540 22.816 -3.917
352 HB2 PRO 56 1HB PRO 56 -5.937 21.688 -4.511
353 HB3 PRO 56 2HB PRO 56 -4.647 21.886 -5.703
354 HG2 PRO 56 1HG PRO 56 -5.416 19.458 -4.130
355 HG3 PRO 56 2HG PRO 56 -4.980 19.589 -5.844
356 HD2 PRO 56 1HD PRO 56 -3.237 18.728 -3.960
357 HD3 PRO 56 2HD PRO 56 -2.720 19.635 -5.395
358 H SER 57 H SER 57 -3.561 20.540 -1.538
359 HA SER 57 HA SER 57 -5.893 21.642 -0.143
360 HB2 SER 57 1HB SER 57 -5.296 19.081 -0.391
361 HB3 SER 57 2HB SER 57 -4.245 19.415 0.985
362 HG SER 57 HG SER 57 -6.441 18.726 1.501
363 H SER 58 H SER 58 -5.476 23.388 1.034
364 HA SER 58 HA SER 58 -2.837 23.846 2.144
365 HB2 SER 58 1HB SER 58 -3.990 25.737 1.142
366 HB3 SER 58 2HB SER 58 -5.364 25.513 2.224
367 HG SER 58 HG SER 58 -4.303 26.892 3.415
368 H GLY 59 H GLY 59 -6.163 23.581 3.401
369 HA2 GLY 59 1HA GLY 59 -5.174 23.408 6.127
370 HA3 GLY 59 2HA GLY 59 -6.858 23.396 5.623
Start of MODEL 4
1 H1 GLY 1 1H GLY 1 11.900 -23.382 21.276
2 HA2 GLY 1 1HA GLY 1 9.669 -23.305 20.638
3 HA3 GLY 1 2HA GLY 1 9.213 -23.359 22.335
4 H SER 2 H SER 2 11.248 -21.062 20.539
5 HA SER 2 HA SER 2 10.229 -18.804 21.862
6 HB2 SER 2 1HB SER 2 11.509 -17.501 20.335
7 HB3 SER 2 2HB SER 2 12.418 -18.993 20.575
8 HG SER 2 HG SER 2 12.355 -19.089 18.476
9 H SER 3 H SER 3 8.428 -17.663 21.600
10 HA SER 3 HA SER 3 6.581 -18.406 19.489
11 HB2 SER 3 1HB SER 3 5.677 -18.171 21.728
12 HB3 SER 3 2HB SER 3 6.294 -16.523 21.842
13 HG SER 3 HG SER 3 4.806 -15.857 20.373
14 H GLY 4 H GLY 4 7.393 -17.544 17.601
15 HA2 GLY 4 1HA GLY 4 8.054 -15.924 16.088
16 HA3 GLY 4 2HA GLY 4 6.631 -15.104 16.714
17 H SER 5 H SER 5 9.844 -15.780 18.098
18 HA SER 5 HA SER 5 9.971 -13.102 19.169
19 HB2 SER 5 1HB SER 5 11.648 -15.570 19.390
20 HB3 SER 5 2HB SER 5 12.363 -14.015 19.815
21 HG SER 5 HG SER 5 10.794 -13.739 21.372
22 H SER 6 H SER 6 10.387 -11.516 17.763
23 HA SER 6 HA SER 6 12.922 -11.305 16.525
24 HB2 SER 6 1HB SER 6 11.597 -12.919 14.989
25 HB3 SER 6 2HB SER 6 10.698 -11.481 14.505
26 HG SER 6 HG SER 6 13.508 -11.853 14.324
27 H GLY 7 H GLY 7 13.035 -9.312 15.099
28 HA2 GLY 7 1HA GLY 7 11.046 -7.324 16.009
29 HA3 GLY 7 2HA GLY 7 12.769 -6.980 15.977
30 H MET 8 H MET 8 13.812 -7.279 13.770
31 HA MET 8 HA MET 8 12.408 -5.633 11.908
32 HB2 MET 8 1HB MET 8 14.828 -5.473 12.140
33 HB3 MET 8 2HB MET 8 15.010 -7.148 11.634
34 HG2 MET 8 1HG MET 8 15.564 -5.719 9.802
35 HG3 MET 8 2HG MET 8 14.052 -6.548 9.440
36 HE1 MET 8 3HE MET 8 13.803 -3.468 7.515
37 HE2 MET 8 1HE MET 8 13.817 -5.229 7.623
38 HE3 MET 8 2HE MET 8 12.311 -4.343 7.861
39 H GLU 9 H GLU 9 10.954 -6.278 10.474
40 HA GLU 9 HA GLU 9 10.988 -9.088 9.598
41 HB2 GLU 9 1HB GLU 9 8.791 -7.135 10.105
42 HB3 GLU 9 2HB GLU 9 8.549 -8.355 8.862
43 HG2 GLU 9 1HG GLU 9 8.979 -10.114 10.492
44 HG3 GLU 9 2HG GLU 9 9.243 -8.898 11.740
45 HA PRO 10 HA PRO 10 12.147 -7.618 5.587
46 HB2 PRO 10 1HB PRO 10 11.727 -9.941 4.245
47 HB3 PRO 10 2HB PRO 10 13.124 -9.678 5.296
48 HG2 PRO 10 1HG PRO 10 10.564 -11.119 5.873
49 HG3 PRO 10 2HG PRO 10 12.226 -11.581 6.284
50 HD2 PRO 10 1HD PRO 10 10.543 -10.450 8.078
51 HD3 PRO 10 2HD PRO 10 12.298 -10.181 8.113
52 H ALA 11 H ALA 11 11.214 -7.709 3.315
53 HA ALA 11 HA ALA 11 8.566 -6.705 3.359
54 HB1 ALA 11 3HB ALA 11 9.474 -5.766 1.551
55 HB2 ALA 11 1HB ALA 11 10.690 -7.035 1.398
56 HB3 ALA 11 2HB ALA 11 9.081 -7.268 0.715
57 H GLY 12 H GLY 12 7.093 -7.631 1.398
58 HA2 GLY 12 1HA GLY 12 6.810 -10.530 1.894
59 HA3 GLY 12 2HA GLY 12 5.427 -9.445 1.905
60 HA PRO 13 HA PRO 13 6.501 -11.161 -2.431
61 HB2 PRO 13 1HB PRO 13 4.709 -13.196 -2.559
62 HB3 PRO 13 2HB PRO 13 6.366 -13.410 -1.982
63 HG2 PRO 13 1HG PRO 13 3.840 -13.078 -0.410
64 HG3 PRO 13 2HG PRO 13 5.189 -14.196 -0.137
65 HD2 PRO 13 1HD PRO 13 4.894 -11.899 1.266
66 HD3 PRO 13 2HD PRO 13 6.485 -12.583 0.878
67 H CYS 14 H CYS 14 5.569 -9.653 -3.672
68 HA CYS 14 HA CYS 14 3.244 -8.304 -3.375
69 HB2 CYS 14 1HB CYS 14 4.635 -7.585 -5.122
70 HB3 CYS 14 2HB CYS 14 4.678 -9.179 -5.868
71 H GLY 15 H GLY 15 1.462 -9.386 -2.651
72 HA2 GLY 15 1HA GLY 15 0.520 -11.778 -3.970
73 HA3 GLY 15 2HA GLY 15 -0.257 -10.947 -2.630
74 H PHE 16 H PHE 16 0.672 -9.596 -5.764
75 HA PHE 16 HA PHE 16 -2.183 -9.276 -6.400
76 HB2 PHE 16 1HB PHE 16 -0.038 -7.191 -6.851
77 HB3 PHE 16 2HB PHE 16 -1.744 -7.034 -7.256
78 HD1 PHE 16 1HD PHE 16 -3.119 -8.003 -4.921
79 HD2 PHE 16 2HD PHE 16 0.438 -5.681 -5.184
80 HE1 PHE 16 1HE PHE 16 -3.565 -7.073 -2.687
81 HE2 PHE 16 2HE PHE 16 -0.002 -4.748 -2.950
82 HZ PHE 16 HZ PHE 16 -2.005 -5.444 -1.698
83 H CYS 17 H CYS 17 1.109 -9.644 -7.535
84 HA CYS 17 HA CYS 17 0.678 -9.492 -10.291
85 HB2 CYS 17 1HB CYS 17 2.738 -10.732 -8.537
86 HB3 CYS 17 2HB CYS 17 2.688 -11.251 -10.218
87 HA PRO 18 HA PRO 18 -1.481 -13.142 -11.416
88 HB2 PRO 18 1HB PRO 18 -0.321 -13.758 -13.792
89 HB3 PRO 18 2HB PRO 18 -1.412 -12.383 -13.583
90 HG2 PRO 18 1HG PRO 18 1.580 -12.434 -13.644
91 HG3 PRO 18 2HG PRO 18 0.465 -11.289 -14.412
92 HD2 PRO 18 1HD PRO 18 1.762 -10.732 -12.101
93 HD3 PRO 18 2HD PRO 18 0.142 -10.102 -12.462
94 H ALA 19 H ALA 19 -1.374 -15.264 -10.960
95 HA ALA 19 HA ALA 19 0.526 -16.556 -9.622
96 HB1 ALA 19 3HB ALA 19 -0.906 -17.984 -11.847
97 HB2 ALA 19 1HB ALA 19 -0.389 -18.627 -10.288
98 HB3 ALA 19 2HB ALA 19 -1.713 -17.464 -10.367
99 H GLY 20 H GLY 20 2.587 -17.123 -9.876
100 HA2 GLY 20 1HA GLY 20 4.329 -18.217 -11.109
101 HA3 GLY 20 2HA GLY 20 3.587 -17.642 -12.595
102 H GLU 21 H GLU 21 3.229 -14.948 -11.931
103 HA GLU 21 HA GLU 21 5.989 -14.036 -12.134
104 HB2 GLU 21 1HB GLU 21 3.321 -12.794 -12.728
105 HB3 GLU 21 2HB GLU 21 4.761 -11.795 -12.591
106 HG2 GLU 21 1HG GLU 21 4.716 -14.164 -14.413
107 HG3 GLU 21 2HG GLU 21 4.024 -12.622 -14.913
108 H VAL 22 H VAL 22 5.290 -14.934 -9.588
109 HA VAL 22 HA VAL 22 4.481 -12.807 -7.877
110 HB VAL 22 HB VAL 22 5.952 -15.369 -7.242
111 HG11 VAL 22 1HG1 VAL 22 4.590 -14.539 -4.978
112 HG12 VAL 22 2HG1 VAL 22 6.333 -14.461 -5.243
113 HG13 VAL 22 3HG1 VAL 22 5.321 -13.062 -5.604
114 HG21 VAL 22 3HG2 VAL 22 3.489 -15.679 -6.214
115 HG22 VAL 22 1HG2 VAL 22 3.111 -14.644 -7.592
116 HG23 VAL 22 2HG2 VAL 22 3.930 -16.186 -7.845
117 H GLN 23 H GLN 23 5.625 -11.075 -7.353
118 HA GLN 23 HA GLN 23 8.564 -11.281 -7.333
119 HB2 GLN 23 1HB GLN 23 6.774 -8.998 -8.146
120 HB3 GLN 23 2HB GLN 23 8.476 -8.767 -7.769
121 HG2 GLN 23 1HG GLN 23 7.647 -10.799 -9.793
122 HG3 GLN 23 2HG GLN 23 7.739 -9.092 -10.224
123 HE21 GLN 23 1HE2 GLN 23 9.787 -8.012 -9.909
124 HE22 GLN 23 2HE2 GLN 23 11.254 -8.913 -10.055
125 HA PRO 24 HA PRO 24 8.579 -10.079 -3.112
126 HB2 PRO 24 1HB PRO 24 10.908 -8.691 -2.977
127 HB3 PRO 24 2HB PRO 24 10.846 -10.449 -3.142
128 HG2 PRO 24 1HG PRO 24 11.291 -8.364 -5.243
129 HG3 PRO 24 2HG PRO 24 12.125 -9.911 -5.009
130 HD2 PRO 24 1HD PRO 24 10.172 -9.574 -6.854
131 HD3 PRO 24 2HD PRO 24 10.438 -11.117 -6.017
132 H ALA 25 H ALA 25 7.085 -8.635 -2.477
133 HA ALA 25 HA ALA 25 6.858 -6.011 -3.571
134 HB1 ALA 25 3HB ALA 25 5.602 -6.893 -0.993
135 HB2 ALA 25 1HB ALA 25 5.000 -5.734 -2.179
136 HB3 ALA 25 2HB ALA 25 5.009 -7.458 -2.555
137 H ARG 26 H ARG 26 9.066 -5.282 -3.192
138 HA ARG 26 HA ARG 26 10.233 -4.990 -0.673
139 HB2 ARG 26 1HB ARG 26 10.593 -3.694 -3.329
140 HB3 ARG 26 2HB ARG 26 11.315 -2.904 -1.934
141 HG2 ARG 26 1HG ARG 26 11.790 -5.814 -2.318
142 HG3 ARG 26 2HG ARG 26 12.647 -4.667 -3.351
143 HD2 ARG 26 1HD ARG 26 13.255 -3.472 -1.156
144 HD3 ARG 26 2HD ARG 26 12.761 -4.970 -0.369
145 HE ARG 26 HE ARG 26 15.132 -4.536 -1.968
146 HH11 ARG 26 2HH1 ARG 26 12.959 -6.857 -0.550
147 HH12 ARG 26 1HH1 ARG 26 14.113 -8.149 -0.578
148 HH21 ARG 26 2HH2 ARG 26 16.660 -6.229 -2.010
149 HH22 ARG 26 1HH2 ARG 26 16.218 -7.790 -1.407
150 H TYR 27 H TYR 27 7.570 -3.374 -2.052
151 HA TYR 27 HA TYR 27 7.668 -1.349 0.087
152 HB2 TYR 27 1HB TYR 27 6.198 -0.912 -2.498
153 HB3 TYR 27 2HB TYR 27 6.745 0.281 -1.325
154 HD1 TYR 27 1HD TYR 27 9.390 0.325 -0.994
155 HD2 TYR 27 2HD TYR 27 7.388 -1.110 -4.464
156 HE1 TYR 27 1HE TYR 27 11.429 0.699 -2.318
157 HE2 TYR 27 2HE TYR 27 9.422 -0.741 -5.797
158 HH TYR 27 HH TYR 27 11.471 0.169 -5.816
159 H THR 28 H THR 28 5.249 -0.357 0.177
160 HA THR 28 HA THR 28 3.155 -2.291 -0.101
161 HB THR 28 HB THR 28 3.575 -1.532 2.753
162 HG1 THR 28 1HG THR 28 5.114 -3.013 3.065
163 HG21 THR 28 3HG2 THR 28 2.245 -3.383 3.203
164 HG22 THR 28 1HG2 THR 28 2.660 -4.178 1.685
165 HG23 THR 28 2HG2 THR 28 1.569 -2.792 1.686
166 H CYS 29 H CYS 29 1.094 -1.423 0.275
167 HA CYS 29 HA CYS 29 0.882 1.379 -0.100
168 HB2 CYS 29 1HB CYS 29 -0.737 -0.568 -0.782
169 HB3 CYS 29 2HB CYS 29 -1.436 -0.289 0.810
170 HA PRO 30 HA PRO 30 1.203 2.440 4.231
171 HB2 PRO 30 1HB PRO 30 1.053 5.123 3.845
172 HB3 PRO 30 2HB PRO 30 2.527 4.192 3.554
173 HG2 PRO 30 1HG PRO 30 0.478 5.154 1.596
174 HG3 PRO 30 2HG PRO 30 2.246 5.169 1.463
175 HD2 PRO 30 1HD PRO 30 0.710 3.295 0.254
176 HD3 PRO 30 2HD PRO 30 2.344 2.948 0.853
177 H ARG 31 H ARG 31 -1.431 2.318 2.334
178 HA ARG 31 HA ARG 31 -3.144 3.669 4.315
179 HB2 ARG 31 1HB ARG 31 -3.350 3.444 1.338
180 HB3 ARG 31 2HB ARG 31 -4.822 3.577 2.292
181 HG2 ARG 31 1HG ARG 31 -3.574 5.620 3.360
182 HG3 ARG 31 2HG ARG 31 -2.660 5.570 1.851
183 HD2 ARG 31 1HD ARG 31 -4.517 7.082 1.601
184 HD3 ARG 31 2HD ARG 31 -4.795 5.654 0.604
185 HE ARG 31 HE ARG 31 -6.084 5.049 2.896
186 HH11 ARG 31 2HH1 ARG 31 -6.157 7.821 0.791
187 HH12 ARG 31 1HH1 ARG 31 -7.809 8.206 1.141
188 HH21 ARG 31 2HH2 ARG 31 -8.261 5.546 3.364
189 HH22 ARG 31 1HH2 ARG 31 -9.005 6.912 2.605
190 H CYS 32 H CYS 32 -2.732 0.845 2.247
191 HA CYS 32 HA CYS 32 -4.622 -0.604 3.976
192 HB2 CYS 32 1HB CYS 32 -5.616 -1.712 2.151
193 HB3 CYS 32 2HB CYS 32 -5.515 -0.029 1.644
194 H ASN 33 H ASN 33 -1.684 -0.370 4.000
195 HA ASN 33 HA ASN 33 0.230 -1.674 3.827
196 HB2 ASN 33 1HB ASN 33 -1.735 -3.378 5.373
197 HB3 ASN 33 2HB ASN 33 0.004 -3.659 5.335
198 HD21 ASN 33 1HD2 ASN 33 0.490 -3.252 7.415
199 HD22 ASN 33 2HD2 ASN 33 0.261 -1.725 8.189
200 H ALA 34 H ALA 34 -0.682 -1.877 1.384
201 HA ALA 34 HA ALA 34 -1.000 -4.727 0.754
202 HB1 ALA 34 3HB ALA 34 -1.347 -3.556 -1.624
203 HB2 ALA 34 1HB ALA 34 -2.653 -3.762 -0.456
204 HB3 ALA 34 2HB ALA 34 -1.813 -2.215 -0.578
205 HA PRO 35 HA PRO 35 3.375 -4.537 -0.262
206 HB2 PRO 35 1HB PRO 35 3.640 -7.213 -0.633
207 HB3 PRO 35 2HB PRO 35 3.615 -6.463 0.967
208 HG2 PRO 35 1HG PRO 35 1.407 -7.839 -0.515
209 HG3 PRO 35 2HG PRO 35 1.855 -7.967 1.196
210 HD2 PRO 35 1HD PRO 35 -0.207 -6.435 0.340
211 HD3 PRO 35 2HD PRO 35 0.778 -6.007 1.754
212 H TYR 36 H TYR 36 3.632 -3.654 -2.244
213 HA TYR 36 HA TYR 36 2.799 -5.255 -4.574
214 HB2 TYR 36 1HB TYR 36 2.783 -3.094 -5.826
215 HB3 TYR 36 2HB TYR 36 1.590 -3.171 -4.535
216 HD1 TYR 36 2HD TYR 36 4.792 -1.685 -5.580
217 HD2 TYR 36 1HD TYR 36 1.716 -1.705 -2.640
218 HE1 TYR 36 2HE TYR 36 5.684 0.405 -4.640
219 HE2 TYR 36 1HE TYR 36 2.599 0.386 -1.693
220 HH TYR 36 HH TYR 36 4.619 2.393 -3.235
221 H CYS 37 H CYS 37 4.263 -5.689 -6.161
222 HA CYS 37 HA CYS 37 7.002 -5.687 -5.504
223 HB2 CYS 37 1HB CYS 37 7.337 -6.443 -7.852
224 HB3 CYS 37 2HB CYS 37 6.104 -7.362 -6.996
225 H SER 38 H SER 38 5.080 -3.624 -7.642
226 HA SER 38 HA SER 38 7.084 -1.537 -7.422
227 HB2 SER 38 1HB SER 38 7.606 -1.324 -9.690
228 HB3 SER 38 2HB SER 38 7.589 -3.073 -9.464
229 HG SER 38 HG SER 38 5.350 -2.964 -10.200
230 H LEU 39 H LEU 39 6.316 0.492 -8.559
231 HA LEU 39 HA LEU 39 3.944 1.388 -7.570
232 HB2 LEU 39 1HB LEU 39 5.615 2.210 -9.889
233 HB3 LEU 39 2HB LEU 39 4.025 2.948 -9.703
234 HG LEU 39 HG LEU 39 5.807 4.340 -8.761
235 HD11 LEU 39 1HD1 LEU 39 4.366 3.389 -6.354
236 HD12 LEU 39 2HD1 LEU 39 3.396 3.929 -7.723
237 HD13 LEU 39 3HD1 LEU 39 4.567 5.023 -6.988
238 HD21 LEU 39 3HD2 LEU 39 6.364 1.858 -7.184
239 HD22 LEU 39 1HD2 LEU 39 6.762 3.446 -6.529
240 HD23 LEU 39 2HD2 LEU 39 7.486 2.911 -8.046
241 H ARG 40 H ARG 40 4.453 -0.441 -10.506
242 HA ARG 40 HA ARG 40 2.086 -0.023 -11.860
243 HB2 ARG 40 1HB ARG 40 3.541 -2.658 -11.567
244 HB3 ARG 40 2HB ARG 40 2.408 -2.237 -12.844
245 HG2 ARG 40 1HG ARG 40 4.844 -0.568 -12.416
246 HG3 ARG 40 2HG ARG 40 4.963 -2.105 -13.274
247 HD2 ARG 40 1HD ARG 40 3.511 -1.389 -14.978
248 HD3 ARG 40 2HD ARG 40 2.935 -0.022 -14.024
249 HE ARG 40 HE ARG 40 5.567 0.507 -14.323
250 HH11 ARG 40 2HH1 ARG 40 3.026 -0.300 -16.561
251 HH12 ARG 40 1HH1 ARG 40 3.718 0.597 -17.872
252 HH21 ARG 40 2HH2 ARG 40 6.488 1.692 -16.041
253 HH22 ARG 40 1HH2 ARG 40 5.688 1.729 -17.575
254 H CYS 41 H CYS 41 2.672 -2.810 -9.706
255 HA CYS 41 HA CYS 41 -0.031 -3.556 -9.527
256 HB2 CYS 41 1HB CYS 41 2.453 -4.210 -8.010
257 HB3 CYS 41 2HB CYS 41 0.906 -4.652 -7.295
258 H TYR 42 H TYR 42 1.893 -1.277 -7.711
259 HA TYR 42 HA TYR 42 0.309 -0.971 -5.440
260 HB2 TYR 42 1HB TYR 42 2.395 0.100 -5.378
261 HB3 TYR 42 2HB TYR 42 2.138 0.894 -6.928
262 HD1 TYR 42 1HD TYR 42 0.508 0.777 -3.559
263 HD2 TYR 42 2HD TYR 42 1.751 3.161 -6.857
264 HE1 TYR 42 1HE TYR 42 -0.274 2.793 -2.388
265 HE2 TYR 42 2HE TYR 42 0.974 5.184 -5.694
266 HH TYR 42 HH TYR 42 -0.056 5.113 -2.370
267 H ARG 43 H ARG 43 -0.154 0.165 -8.696
268 HA ARG 43 HA ARG 43 -2.342 1.923 -7.914
269 HB2 ARG 43 1HB ARG 43 -0.821 1.425 -10.437
270 HB3 ARG 43 2HB ARG 43 -2.437 2.111 -10.546
271 HG2 ARG 43 1HG ARG 43 -1.794 4.000 -9.223
272 HG3 ARG 43 2HG ARG 43 -0.218 3.282 -8.887
273 HD2 ARG 43 1HD ARG 43 0.165 4.866 -10.584
274 HD3 ARG 43 2HD ARG 43 0.162 3.300 -11.395
275 HE ARG 43 HE ARG 43 -2.387 4.652 -11.379
276 HH11 ARG 43 2HH1 ARG 43 0.623 4.168 -13.059
277 HH12 ARG 43 1HH1 ARG 43 -0.009 4.647 -14.599
278 HH21 ARG 43 2HH2 ARG 43 -3.231 5.284 -13.401
279 HH22 ARG 43 1HH2 ARG 43 -2.201 5.283 -14.793
280 H THR 44 H THR 44 -1.782 -1.176 -9.439
281 HA THR 44 HA THR 44 -4.449 -1.539 -10.388
282 HB THR 44 HB THR 44 -2.287 -3.586 -9.858
283 HG1 THR 44 1HG THR 44 -1.506 -2.598 -11.574
284 HG21 THR 44 3HG2 THR 44 -3.715 -4.843 -11.631
285 HG22 THR 44 1HG2 THR 44 -5.012 -3.780 -11.086
286 HG23 THR 44 2HG2 THR 44 -4.222 -4.866 -9.942
287 H HIS 45 H HIS 45 -2.660 -3.014 -7.674
288 HA HIS 45 HA HIS 45 -4.500 -4.576 -6.503
289 HB2 HIS 45 1HB HIS 45 -3.308 -4.406 -4.540
290 HB3 HIS 45 2HB HIS 45 -2.140 -3.731 -5.672
291 HD1 HIS 45 1HD HIS 45 -1.557 -1.258 -5.435
292 HD2 HIS 45 2HD HIS 45 -4.514 -2.522 -2.805
293 HE1 HIS 45 1HE HIS 45 -1.841 0.622 -3.789
294 H GLY 46 H GLY 46 -4.299 -1.065 -5.882
295 HA2 GLY 46 1HA GLY 46 -7.192 -0.948 -5.642
296 HA3 GLY 46 2HA GLY 46 -6.301 -0.593 -4.170
297 H THR 47 H THR 47 -7.890 1.347 -5.035
298 HA THR 47 HA THR 47 -6.251 3.197 -6.615
299 HB THR 47 HB THR 47 -8.651 2.836 -7.257
300 HG1 THR 47 1HG THR 47 -7.262 5.059 -7.138
301 HG21 THR 47 3HG2 THR 47 -9.565 2.654 -4.977
302 HG22 THR 47 1HG2 THR 47 -10.390 3.895 -5.919
303 HG23 THR 47 2HG2 THR 47 -9.198 4.357 -4.704
304 H CYS 48 H CYS 48 -6.107 2.400 -3.618
305 HA CYS 48 HA CYS 48 -6.794 4.401 -1.906
306 HB2 CYS 48 1HB CYS 48 -4.041 3.180 -1.811
307 HB3 CYS 48 2HB CYS 48 -5.064 3.674 -0.466
308 H ALA 49 H ALA 49 -4.393 4.520 -4.410
309 HA ALA 49 HA ALA 49 -3.173 6.953 -3.436
310 HB1 ALA 49 3HB ALA 49 -1.749 6.824 -5.346
311 HB2 ALA 49 1HB ALA 49 -1.917 5.194 -4.692
312 HB3 ALA 49 2HB ALA 49 -2.818 5.663 -6.134
313 H GLU 50 H GLU 50 -6.003 7.098 -3.866
314 HA GLU 50 HA GLU 50 -6.249 8.773 -6.257
315 HB2 GLU 50 1HB GLU 50 -8.666 8.626 -5.891
316 HB3 GLU 50 2HB GLU 50 -7.937 7.029 -5.972
317 HG2 GLU 50 1HG GLU 50 -8.236 6.632 -3.714
318 HG3 GLU 50 2HG GLU 50 -8.380 8.346 -3.329
319 H ASN 51 H ASN 51 -5.907 8.983 -2.874
320 HA ASN 51 HA ASN 51 -6.546 11.854 -2.983
321 HB2 ASN 51 1HB ASN 51 -7.267 9.845 -0.858
322 HB3 ASN 51 2HB ASN 51 -7.161 11.566 -0.497
323 HD21 ASN 51 1HD2 ASN 51 -9.415 11.364 0.049
324 HD22 ASN 51 2HD2 ASN 51 -10.606 11.435 -1.201
325 H PHE 52 H PHE 52 -4.674 9.288 -1.439
326 HA PHE 52 HA PHE 52 -3.057 10.791 0.228
327 HB2 PHE 52 1HB PHE 52 -3.157 8.257 -0.001
328 HB3 PHE 52 2HB PHE 52 -2.060 8.432 -1.366
329 HD1 PHE 52 2HD PHE 52 -2.417 8.951 2.268
330 HD2 PHE 52 1HD PHE 52 0.250 8.789 -1.045
331 HE1 PHE 52 2HE PHE 52 -0.503 8.950 3.814
332 HE2 PHE 52 1HE PHE 52 2.169 8.787 0.496
333 HZ PHE 52 HZ PHE 52 1.794 8.869 2.928
334 H TYR 53 H TYR 53 -2.144 12.651 -0.411
335 HA TYR 53 HA TYR 53 0.070 12.583 -2.207
336 HB2 TYR 53 1HB TYR 53 -2.500 13.867 -3.105
337 HB3 TYR 53 2HB TYR 53 -0.941 14.420 -3.707
338 HD1 TYR 53 1HD TYR 53 0.576 12.666 -4.820
339 HD2 TYR 53 2HD TYR 53 -3.575 12.058 -4.114
340 HE1 TYR 53 1HE TYR 53 0.552 10.894 -6.525
341 HE2 TYR 53 2HE TYR 53 -3.611 10.283 -5.816
342 HH TYR 53 HH TYR 53 -1.053 9.777 -7.997
343 H SER 54 H SER 54 0.829 14.964 -2.623
344 HA SER 54 HA SER 54 0.689 16.318 -0.025
345 HB2 SER 54 1HB SER 54 2.693 16.694 -2.264
346 HB3 SER 54 2HB SER 54 2.787 17.394 -0.648
347 HG SER 54 HG SER 54 3.857 15.187 -1.339
348 H GLY 55 H GLY 55 -0.258 18.244 0.201
349 HA2 GLY 55 1HA GLY 55 -1.226 20.265 -0.319
350 HA3 GLY 55 2HA GLY 55 -0.354 20.217 -1.844
351 HA PRO 56 HA PRO 56 -4.676 18.030 -2.370
352 HB2 PRO 56 1HB PRO 56 -6.564 18.914 -0.631
353 HB3 PRO 56 2HB PRO 56 -5.558 17.495 -0.317
354 HG2 PRO 56 1HG PRO 56 -5.249 20.296 0.693
355 HG3 PRO 56 2HG PRO 56 -5.066 18.765 1.568
356 HD2 PRO 56 1HD PRO 56 -2.947 20.184 0.658
357 HD3 PRO 56 2HD PRO 56 -2.936 18.412 0.760
358 H SER 57 H SER 57 -6.072 18.856 -3.849
359 HA SER 57 HA SER 57 -6.358 21.789 -3.930
360 HB2 SER 57 1HB SER 57 -6.374 21.676 -6.344
361 HB3 SER 57 2HB SER 57 -4.950 20.815 -5.759
362 HG SER 57 HG SER 57 -6.929 19.897 -7.288
363 H SER 58 H SER 58 -7.921 18.705 -4.708
364 HA SER 58 HA SER 58 -10.395 19.653 -5.534
365 HB2 SER 58 1HB SER 58 -11.277 17.434 -4.756
366 HB3 SER 58 2HB SER 58 -9.845 17.318 -5.780
367 HG SER 58 HG SER 58 -10.044 16.124 -3.595
368 H GLY 59 H GLY 59 -12.216 20.357 -4.535
369 HA2 GLY 59 1HA GLY 59 -13.581 20.276 -2.455
370 HA3 GLY 59 2HA GLY 59 -12.087 20.611 -1.592
Start of MODEL 5
1 H1 GLY 1 1H GLY 1 2.648 -23.757 14.622
2 HA2 GLY 1 1HA GLY 1 4.666 -22.465 13.988
3 HA3 GLY 1 2HA GLY 1 4.835 -23.580 12.640
4 H SER 2 H SER 2 4.504 -20.617 12.760
5 HA SER 2 HA SER 2 1.973 -20.325 11.299
6 HB2 SER 2 1HB SER 2 2.642 -18.824 13.314
7 HB3 SER 2 2HB SER 2 3.707 -18.024 12.159
8 HG SER 2 HG SER 2 1.829 -17.679 10.847
9 H SER 3 H SER 3 2.066 -20.339 9.164
10 HA SER 3 HA SER 3 4.606 -19.834 7.821
11 HB2 SER 3 1HB SER 3 3.451 -21.829 7.114
12 HB3 SER 3 2HB SER 3 1.965 -20.924 6.823
13 HG SER 3 HG SER 3 4.235 -20.064 5.471
14 H GLY 4 H GLY 4 5.041 -17.779 7.353
15 HA2 GLY 4 1HA GLY 4 2.923 -16.186 6.066
16 HA3 GLY 4 2HA GLY 4 3.857 -15.498 7.386
17 H SER 5 H SER 5 5.713 -14.484 6.927
18 HA SER 5 HA SER 5 6.413 -13.956 4.241
19 HB2 SER 5 1HB SER 5 8.108 -13.495 6.707
20 HB3 SER 5 2HB SER 5 8.264 -12.680 5.150
21 HG SER 5 HG SER 5 6.888 -11.824 7.131
22 H SER 6 H SER 6 8.718 -14.233 3.437
23 HA SER 6 HA SER 6 9.483 -17.041 3.827
24 HB2 SER 6 1HB SER 6 9.855 -15.119 1.536
25 HB3 SER 6 2HB SER 6 10.773 -16.621 1.642
26 HG SER 6 HG SER 6 8.999 -17.173 0.517
27 H GLY 7 H GLY 7 11.040 -13.887 3.209
28 HA2 GLY 7 1HA GLY 7 13.505 -14.893 4.417
29 HA3 GLY 7 2HA GLY 7 13.322 -13.385 3.533
30 H MET 8 H MET 8 14.730 -13.078 5.690
31 HA MET 8 HA MET 8 12.931 -12.279 7.867
32 HB2 MET 8 1HB MET 8 14.983 -12.122 9.235
33 HB3 MET 8 2HB MET 8 14.753 -13.725 8.550
34 HG2 MET 8 1HG MET 8 16.346 -13.079 6.732
35 HG3 MET 8 2HG MET 8 16.677 -11.605 7.639
36 HE1 MET 8 3HE MET 8 18.303 -11.253 8.785
37 HE2 MET 8 1HE MET 8 18.707 -12.114 10.270
38 HE3 MET 8 2HE MET 8 19.671 -12.366 8.815
39 H GLU 9 H GLU 9 12.876 -10.686 5.590
40 HA GLU 9 HA GLU 9 14.115 -8.219 6.608
41 HB2 GLU 9 1HB GLU 9 14.100 -9.290 3.803
42 HB3 GLU 9 2HB GLU 9 14.208 -7.561 4.098
43 HG2 GLU 9 1HG GLU 9 16.268 -7.775 5.215
44 HG3 GLU 9 2HG GLU 9 16.100 -9.524 5.349
45 HA PRO 10 HA PRO 10 10.159 -6.348 6.299
46 HB2 PRO 10 1HB PRO 10 10.799 -3.811 5.576
47 HB3 PRO 10 2HB PRO 10 11.104 -4.454 7.194
48 HG2 PRO 10 1HG PRO 10 12.990 -4.149 4.889
49 HG3 PRO 10 2HG PRO 10 13.256 -3.796 6.606
50 HD2 PRO 10 1HD PRO 10 14.154 -6.063 5.429
51 HD3 PRO 10 2HD PRO 10 13.647 -6.006 7.129
52 H ALA 11 H ALA 11 9.548 -7.678 4.432
53 HA ALA 11 HA ALA 11 8.582 -6.120 2.293
54 HB1 ALA 11 3HB ALA 11 11.012 -6.233 1.677
55 HB2 ALA 11 1HB ALA 11 10.807 -7.972 1.466
56 HB3 ALA 11 2HB ALA 11 9.901 -6.848 0.453
57 H GLY 12 H GLY 12 6.918 -7.150 1.314
58 HA2 GLY 12 1HA GLY 12 6.566 -10.003 1.984
59 HA3 GLY 12 2HA GLY 12 5.247 -8.862 1.769
60 HA PRO 13 HA PRO 13 6.554 -11.139 -2.252
61 HB2 PRO 13 1HB PRO 13 4.842 -13.245 -2.197
62 HB3 PRO 13 2HB PRO 13 6.479 -13.320 -1.534
63 HG2 PRO 13 1HG PRO 13 3.877 -12.900 -0.114
64 HG3 PRO 13 2HG PRO 13 5.251 -13.921 0.347
65 HD2 PRO 13 1HD PRO 13 4.816 -11.484 1.443
66 HD3 PRO 13 2HD PRO 13 6.445 -12.145 1.204
67 H CYS 14 H CYS 14 5.618 -9.619 -3.530
68 HA CYS 14 HA CYS 14 3.064 -8.608 -3.438
69 HB2 CYS 14 1HB CYS 14 4.769 -7.616 -4.845
70 HB3 CYS 14 2HB CYS 14 4.822 -9.056 -5.857
71 H GLY 15 H GLY 15 1.324 -9.903 -3.217
72 HA2 GLY 15 1HA GLY 15 1.038 -12.372 -4.650
73 HA3 GLY 15 2HA GLY 15 -0.175 -11.609 -3.633
74 H PHE 16 H PHE 16 -0.367 -9.136 -4.953
75 HA PHE 16 HA PHE 16 -2.365 -9.456 -6.730
76 HB2 PHE 16 1HB PHE 16 -0.232 -7.357 -7.133
77 HB3 PHE 16 2HB PHE 16 -1.936 -7.248 -7.560
78 HD1 PHE 16 1HD PHE 16 -3.393 -8.021 -5.266
79 HD2 PHE 16 2HD PHE 16 0.280 -5.879 -5.462
80 HE1 PHE 16 1HE PHE 16 -3.877 -6.998 -3.080
81 HE2 PHE 16 2HE PHE 16 -0.197 -4.854 -3.277
82 HZ PHE 16 HZ PHE 16 -2.277 -5.414 -2.082
83 H CYS 17 H CYS 17 1.072 -9.682 -7.456
84 HA CYS 17 HA CYS 17 0.833 -9.832 -10.266
85 HB2 CYS 17 1HB CYS 17 2.942 -10.442 -8.263
86 HB3 CYS 17 2HB CYS 17 3.111 -11.183 -9.851
87 HA PRO 18 HA PRO 18 -0.551 -13.922 -11.043
88 HB2 PRO 18 1HB PRO 18 0.881 -14.580 -13.253
89 HB3 PRO 18 2HB PRO 18 -0.448 -13.415 -13.282
90 HG2 PRO 18 1HG PRO 18 2.503 -12.921 -13.167
91 HG3 PRO 18 2HG PRO 18 1.267 -12.096 -14.134
92 HD2 PRO 18 1HD PRO 18 2.261 -11.050 -11.843
93 HD3 PRO 18 2HD PRO 18 0.589 -10.775 -12.372
94 H ALA 19 H ALA 19 0.049 -16.161 -11.053
95 HA ALA 19 HA ALA 19 1.871 -16.957 -9.176
96 HB1 ALA 19 3HB ALA 19 1.498 -18.813 -11.451
97 HB2 ALA 19 1HB ALA 19 1.315 -19.087 -9.718
98 HB3 ALA 19 2HB ALA 19 0.045 -18.259 -10.619
99 H GLY 20 H GLY 20 3.986 -17.692 -9.156
100 HA2 GLY 20 1HA GLY 20 6.137 -18.066 -9.934
101 HA3 GLY 20 2HA GLY 20 5.554 -17.804 -11.571
102 H GLU 21 H GLU 21 4.675 -15.326 -11.692
103 HA GLU 21 HA GLU 21 6.979 -13.750 -11.780
104 HB2 GLU 21 1HB GLU 21 4.047 -13.126 -11.925
105 HB3 GLU 21 2HB GLU 21 5.230 -11.827 -11.917
106 HG2 GLU 21 1HG GLU 21 5.140 -14.083 -13.907
107 HG3 GLU 21 2HG GLU 21 4.531 -12.451 -14.180
108 H VAL 22 H VAL 22 5.143 -14.651 -9.119
109 HA VAL 22 HA VAL 22 4.878 -12.610 -7.402
110 HB VAL 22 HB VAL 22 6.182 -15.252 -6.735
111 HG11 VAL 22 1HG1 VAL 22 6.661 -13.863 -4.908
112 HG12 VAL 22 2HG1 VAL 22 5.091 -13.063 -4.992
113 HG13 VAL 22 3HG1 VAL 22 5.202 -14.734 -4.435
114 HG21 VAL 22 3HG2 VAL 22 3.675 -15.439 -5.796
115 HG22 VAL 22 1HG2 VAL 22 3.398 -14.370 -7.171
116 HG23 VAL 22 2HG2 VAL 22 4.140 -15.951 -7.418
117 H GLN 23 H GLN 23 6.098 -10.959 -6.791
118 HA GLN 23 HA GLN 23 9.018 -11.334 -6.672
119 HB2 GLN 23 1HB GLN 23 7.377 -9.039 -7.688
120 HB3 GLN 23 2HB GLN 23 8.998 -8.756 -7.065
121 HG2 GLN 23 1HG GLN 23 8.405 -10.750 -9.231
122 HG3 GLN 23 2HG GLN 23 8.796 -9.062 -9.554
123 HE21 GLN 23 1HE2 GLN 23 10.777 -9.050 -10.356
124 HE22 GLN 23 2HE2 GLN 23 12.151 -9.836 -9.664
125 HA PRO 24 HA PRO 24 8.944 -10.073 -2.470
126 HB2 PRO 24 1HB PRO 24 11.317 -8.769 -2.264
127 HB3 PRO 24 2HB PRO 24 11.196 -10.526 -2.417
128 HG2 PRO 24 1HG PRO 24 11.791 -8.478 -4.518
129 HG3 PRO 24 2HG PRO 24 12.558 -10.053 -4.242
130 HD2 PRO 24 1HD PRO 24 10.685 -9.662 -6.158
131 HD3 PRO 24 2HD PRO 24 10.865 -11.205 -5.299
132 H ALA 25 H ALA 25 7.184 -8.592 -2.572
133 HA ALA 25 HA ALA 25 7.359 -5.932 -3.439
134 HB1 ALA 25 3HB ALA 25 5.228 -5.709 -2.696
135 HB2 ALA 25 1HB ALA 25 5.327 -7.470 -2.658
136 HB3 ALA 25 2HB ALA 25 5.552 -6.541 -1.175
137 H ARG 26 H ARG 26 9.168 -4.872 -2.699
138 HA ARG 26 HA ARG 26 9.990 -4.857 0.020
139 HB2 ARG 26 1HB ARG 26 10.688 -3.196 -2.385
140 HB3 ARG 26 2HB ARG 26 11.309 -2.782 -0.793
141 HG2 ARG 26 1HG ARG 26 12.501 -4.817 -0.625
142 HG3 ARG 26 2HG ARG 26 11.672 -5.496 -2.027
143 HD2 ARG 26 1HD ARG 26 12.712 -3.663 -3.397
144 HD3 ARG 26 2HD ARG 26 13.679 -3.250 -1.982
145 HE ARG 26 HE ARG 26 14.001 -5.552 -3.708
146 HH11 ARG 26 2HH1 ARG 26 14.767 -4.060 -0.657
147 HH12 ARG 26 1HH1 ARG 26 16.187 -5.017 -0.397
148 HH21 ARG 26 2HH2 ARG 26 15.869 -6.818 -3.377
149 HH22 ARG 26 1HH2 ARG 26 16.814 -6.585 -1.945
150 H TYR 27 H TYR 27 7.916 -2.789 -1.916
151 HA TYR 27 HA TYR 27 7.569 -0.938 0.319
152 HB2 TYR 27 1HB TYR 27 6.118 -0.655 -2.283
153 HB3 TYR 27 2HB TYR 27 6.712 0.594 -1.194
154 HD1 TYR 27 1HD TYR 27 9.246 0.937 -1.054
155 HD2 TYR 27 2HD TYR 27 7.366 -1.285 -4.158
156 HE1 TYR 27 1HE TYR 27 11.248 1.213 -2.456
157 HE2 TYR 27 2HE TYR 27 9.363 -1.016 -5.568
158 HH TYR 27 HH TYR 27 12.329 0.064 -4.369
159 H THR 28 H THR 28 5.107 -0.095 0.302
160 HA THR 28 HA THR 28 3.101 -2.088 -0.032
161 HB THR 28 HB THR 28 3.449 -1.441 2.858
162 HG1 THR 28 1HG THR 28 4.612 -3.753 2.536
163 HG21 THR 28 3HG2 THR 28 2.641 -4.062 1.650
164 HG22 THR 28 1HG2 THR 28 1.503 -2.717 1.710
165 HG23 THR 28 2HG2 THR 28 2.184 -3.363 3.203
166 H CYS 29 H CYS 29 1.032 -1.269 0.216
167 HA CYS 29 HA CYS 29 0.707 1.504 -0.044
168 HB2 CYS 29 1HB CYS 29 -0.863 -0.515 -0.679
169 HB3 CYS 29 2HB CYS 29 -1.550 -0.211 0.913
170 HA PRO 30 HA PRO 30 1.078 2.567 4.282
171 HB2 PRO 30 1HB PRO 30 0.818 5.243 3.908
172 HB3 PRO 30 2HB PRO 30 2.319 4.369 3.582
173 HG2 PRO 30 1HG PRO 30 0.192 5.259 1.672
174 HG3 PRO 30 2HG PRO 30 1.955 5.340 1.500
175 HD2 PRO 30 1HD PRO 30 0.464 3.413 0.319
176 HD3 PRO 30 2HD PRO 30 2.124 3.127 0.881
177 H ARG 31 H ARG 31 -1.592 2.393 2.415
178 HA ARG 31 HA ARG 31 -3.310 3.639 4.460
179 HB2 ARG 31 1HB ARG 31 -3.509 3.544 1.489
180 HB3 ARG 31 2HB ARG 31 -5.004 3.481 2.413
181 HG2 ARG 31 1HG ARG 31 -4.195 5.566 3.601
182 HG3 ARG 31 2HG ARG 31 -2.946 5.665 2.359
183 HD2 ARG 31 1HD ARG 31 -4.443 6.163 0.698
184 HD3 ARG 31 2HD ARG 31 -5.773 5.326 1.499
185 HE ARG 31 HE ARG 31 -5.131 8.076 1.718
186 HH11 ARG 31 2HH1 ARG 31 -6.290 5.367 3.572
187 HH12 ARG 31 1HH1 ARG 31 -7.176 6.347 4.693
188 HH21 ARG 31 2HH2 ARG 31 -6.294 9.376 3.187
189 HH22 ARG 31 1HH2 ARG 31 -7.179 8.627 4.472
190 H CYS 32 H CYS 32 -2.879 0.891 2.288
191 HA CYS 32 HA CYS 32 -4.706 -0.653 4.007
192 HB2 CYS 32 1HB CYS 32 -5.655 -1.759 2.160
193 HB3 CYS 32 2HB CYS 32 -5.591 -0.070 1.670
194 H ASN 33 H ASN 33 -1.760 -0.313 4.012
195 HA ASN 33 HA ASN 33 0.190 -1.561 3.813
196 HB2 ASN 33 1HB ASN 33 -1.706 -3.277 5.426
197 HB3 ASN 33 2HB ASN 33 0.032 -3.548 5.342
198 HD21 ASN 33 1HD2 ASN 33 0.983 -2.870 7.110
199 HD22 ASN 33 2HD2 ASN 33 0.608 -1.428 7.984
200 H ALA 34 H ALA 34 -0.758 -1.824 1.390
201 HA ALA 34 HA ALA 34 -0.993 -4.693 0.806
202 HB1 ALA 34 3HB ALA 34 -1.487 -3.654 -1.566
203 HB2 ALA 34 1HB ALA 34 -2.733 -3.733 -0.320
204 HB3 ALA 34 2HB ALA 34 -1.864 -2.224 -0.604
205 HA PRO 35 HA PRO 35 3.336 -4.393 -0.338
206 HB2 PRO 35 1HB PRO 35 3.650 -7.055 -0.773
207 HB3 PRO 35 2HB PRO 35 3.645 -6.340 0.843
208 HG2 PRO 35 1HG PRO 35 1.435 -7.732 -0.619
209 HG3 PRO 35 2HG PRO 35 1.924 -7.886 1.079
210 HD2 PRO 35 1HD PRO 35 -0.190 -6.382 0.303
211 HD3 PRO 35 2HD PRO 35 0.818 -5.963 1.703
212 H TYR 36 H TYR 36 3.927 -3.733 -2.298
213 HA TYR 36 HA TYR 36 2.989 -5.238 -4.643
214 HB2 TYR 36 1HB TYR 36 2.905 -3.019 -5.864
215 HB3 TYR 36 2HB TYR 36 1.637 -3.281 -4.671
216 HD1 TYR 36 2HD TYR 36 4.842 -1.530 -5.283
217 HD2 TYR 36 1HD TYR 36 1.381 -1.823 -2.825
218 HE1 TYR 36 2HE TYR 36 5.453 0.582 -4.181
219 HE2 TYR 36 1HE TYR 36 1.982 0.289 -1.717
220 HH TYR 36 HH TYR 36 3.792 2.483 -2.801
221 H CYS 37 H CYS 37 4.576 -5.866 -5.951
222 HA CYS 37 HA CYS 37 7.269 -5.539 -5.373
223 HB2 CYS 37 1HB CYS 37 7.690 -6.411 -7.651
224 HB3 CYS 37 2HB CYS 37 6.470 -7.344 -6.791
225 H SER 38 H SER 38 5.212 -3.717 -7.598
226 HA SER 38 HA SER 38 7.112 -1.515 -7.516
227 HB2 SER 38 1HB SER 38 6.398 -3.027 -10.015
228 HB3 SER 38 2HB SER 38 6.827 -1.318 -10.092
229 HG SER 38 HG SER 38 8.588 -2.675 -8.566
230 H LEU 39 H LEU 39 6.186 0.420 -8.744
231 HA LEU 39 HA LEU 39 3.798 1.213 -7.643
232 HB2 LEU 39 1HB LEU 39 5.657 2.474 -9.041
233 HB3 LEU 39 2HB LEU 39 4.490 2.253 -10.342
234 HG LEU 39 HG LEU 39 2.844 3.329 -8.576
235 HD11 LEU 39 1HD1 LEU 39 4.712 3.366 -6.862
236 HD12 LEU 39 2HD1 LEU 39 3.831 4.874 -7.101
237 HD13 LEU 39 3HD1 LEU 39 5.428 4.663 -7.819
238 HD21 LEU 39 3HD2 LEU 39 2.816 4.839 -10.199
239 HD22 LEU 39 1HD2 LEU 39 4.377 4.258 -10.781
240 HD23 LEU 39 2HD2 LEU 39 4.309 5.543 -9.574
241 H ARG 40 H ARG 40 4.329 -0.213 -10.848
242 HA ARG 40 HA ARG 40 1.957 -0.032 -12.081
243 HB2 ARG 40 1HB ARG 40 2.315 -2.299 -13.004
244 HB3 ARG 40 2HB ARG 40 3.778 -1.324 -13.020
245 HG2 ARG 40 1HG ARG 40 4.426 -2.477 -10.873
246 HG3 ARG 40 2HG ARG 40 3.084 -3.584 -11.169
247 HD2 ARG 40 1HD ARG 40 4.235 -3.771 -13.542
248 HD3 ARG 40 2HD ARG 40 5.658 -3.274 -12.626
249 HE ARG 40 HE ARG 40 4.219 -5.455 -11.431
250 HH11 ARG 40 2HH1 ARG 40 6.658 -4.562 -13.749
251 HH12 ARG 40 1HH1 ARG 40 7.457 -6.098 -13.695
252 HH21 ARG 40 2HH2 ARG 40 5.263 -7.482 -11.351
253 HH22 ARG 40 1HH2 ARG 40 6.663 -7.759 -12.331
254 H CYS 41 H CYS 41 2.653 -2.477 -9.584
255 HA CYS 41 HA CYS 41 -0.038 -3.430 -9.505
256 HB2 CYS 41 1HB CYS 41 2.378 -3.852 -7.759
257 HB3 CYS 41 2HB CYS 41 0.807 -4.521 -7.330
258 H TYR 42 H TYR 42 1.840 -1.109 -7.647
259 HA TYR 42 HA TYR 42 0.237 -0.722 -5.446
260 HB2 TYR 42 1HB TYR 42 2.342 0.421 -5.620
261 HB3 TYR 42 2HB TYR 42 1.810 1.298 -7.051
262 HD1 TYR 42 1HD TYR 42 0.562 0.764 -3.560
263 HD2 TYR 42 2HD TYR 42 1.353 3.523 -6.701
264 HE1 TYR 42 1HE TYR 42 -0.221 2.607 -2.131
265 HE2 TYR 42 2HE TYR 42 0.573 5.373 -5.281
266 HH TYR 42 HH TYR 42 -0.626 4.782 -1.988
267 H ARG 43 H ARG 43 -0.300 0.288 -8.742
268 HA ARG 43 HA ARG 43 -2.592 1.925 -8.004
269 HB2 ARG 43 1HB ARG 43 -1.042 1.444 -10.508
270 HB3 ARG 43 2HB ARG 43 -2.707 1.992 -10.652
271 HG2 ARG 43 1HG ARG 43 -2.247 4.002 -9.500
272 HG3 ARG 43 2HG ARG 43 -0.671 3.416 -8.964
273 HD2 ARG 43 1HD ARG 43 -0.084 3.265 -11.446
274 HD3 ARG 43 2HD ARG 43 -1.525 4.242 -11.722
275 HE ARG 43 HE ARG 43 0.991 5.132 -10.680
276 HH11 ARG 43 2HH1 ARG 43 -2.438 5.730 -10.718
277 HH12 ARG 43 1HH1 ARG 43 -2.281 7.414 -10.342
278 HH21 ARG 43 2HH2 ARG 43 1.211 7.347 -10.184
279 HH22 ARG 43 1HH2 ARG 43 -0.205 8.333 -10.039
280 H THR 44 H THR 44 -1.860 -1.158 -9.522
281 HA THR 44 HA THR 44 -4.504 -1.717 -10.404
282 HB THR 44 HB THR 44 -2.218 -3.613 -9.828
283 HG1 THR 44 1HG THR 44 -2.928 -3.186 -12.433
284 HG21 THR 44 3HG2 THR 44 -3.927 -5.114 -9.923
285 HG22 THR 44 1HG2 THR 44 -3.686 -4.901 -11.656
286 HG23 THR 44 2HG2 THR 44 -4.977 -4.027 -10.832
287 H HIS 45 H HIS 45 -2.620 -3.037 -7.673
288 HA HIS 45 HA HIS 45 -4.385 -4.648 -6.448
289 HB2 HIS 45 1HB HIS 45 -3.158 -4.410 -4.520
290 HB3 HIS 45 2HB HIS 45 -2.044 -3.677 -5.671
291 HD1 HIS 45 1HD HIS 45 -1.595 -1.174 -5.448
292 HD2 HIS 45 2HD HIS 45 -4.438 -2.590 -2.770
293 HE1 HIS 45 1HE HIS 45 -1.956 0.692 -3.801
294 H GLY 46 H GLY 46 -4.360 -1.107 -6.063
295 HA2 GLY 46 1HA GLY 46 -7.219 -1.041 -5.811
296 HA3 GLY 46 2HA GLY 46 -6.405 -0.757 -4.280
297 H THR 47 H THR 47 -8.000 1.195 -5.217
298 HA THR 47 HA THR 47 -6.238 3.153 -6.514
299 HB THR 47 HB THR 47 -8.315 4.515 -6.791
300 HG1 THR 47 1HG THR 47 -9.919 2.299 -6.300
301 HG21 THR 47 3HG2 THR 47 -9.110 3.318 -8.664
302 HG22 THR 47 1HG2 THR 47 -8.697 1.762 -7.945
303 HG23 THR 47 2HG2 THR 47 -7.420 2.846 -8.496
304 H CYS 48 H CYS 48 -5.669 2.534 -3.853
305 HA CYS 48 HA CYS 48 -6.892 4.356 -2.041
306 HB2 CYS 48 1HB CYS 48 -4.148 3.156 -1.708
307 HB3 CYS 48 2HB CYS 48 -5.291 3.624 -0.454
308 H ALA 49 H ALA 49 -3.912 4.413 -3.946
309 HA ALA 49 HA ALA 49 -2.703 6.680 -2.950
310 HB1 ALA 49 3HB ALA 49 -2.000 5.029 -4.851
311 HB2 ALA 49 1HB ALA 49 -2.729 6.244 -5.901
312 HB3 ALA 49 2HB ALA 49 -1.391 6.684 -4.839
313 H GLU 50 H GLU 50 -5.226 6.471 -5.441
314 HA GLU 50 HA GLU 50 -5.435 9.001 -6.352
315 HB2 GLU 50 1HB GLU 50 -7.500 6.961 -5.659
316 HB3 GLU 50 2HB GLU 50 -8.038 8.575 -6.100
317 HG2 GLU 50 1HG GLU 50 -8.082 7.486 -8.119
318 HG3 GLU 50 2HG GLU 50 -6.498 8.258 -8.156
319 H ASN 51 H ASN 51 -6.945 7.871 -3.328
320 HA ASN 51 HA ASN 51 -7.457 10.638 -2.553
321 HB2 ASN 51 1HB ASN 51 -9.278 9.045 -2.242
322 HB3 ASN 51 2HB ASN 51 -8.246 8.028 -1.240
323 HD21 ASN 51 1HD2 ASN 51 -8.933 11.508 -1.361
324 HD22 ASN 51 2HD2 ASN 51 -9.354 11.654 0.309
325 H PHE 52 H PHE 52 -4.742 9.851 -2.677
326 HA PHE 52 HA PHE 52 -4.017 10.012 0.173
327 HB2 PHE 52 1HB PHE 52 -3.457 7.804 -0.965
328 HB3 PHE 52 2HB PHE 52 -2.298 8.707 -1.936
329 HD1 PHE 52 2HD PHE 52 -3.202 7.884 1.567
330 HD2 PHE 52 1HD PHE 52 -0.157 9.129 -1.133
331 HE1 PHE 52 2HE PHE 52 -1.525 7.637 3.351
332 HE2 PHE 52 1HE PHE 52 1.526 8.883 0.646
333 HZ PHE 52 HZ PHE 52 0.842 8.138 2.891
334 H TYR 53 H TYR 53 -1.683 10.865 0.400
335 HA TYR 53 HA TYR 53 -0.469 12.808 0.342
336 HB2 TYR 53 1HB TYR 53 0.768 13.103 -1.709
337 HB3 TYR 53 2HB TYR 53 0.560 11.379 -1.423
338 HD1 TYR 53 1HD TYR 53 -1.061 10.087 -2.787
339 HD2 TYR 53 2HD TYR 53 -0.172 14.162 -3.631
340 HE1 TYR 53 1HE TYR 53 -2.034 9.829 -5.030
341 HE2 TYR 53 2HE TYR 53 -1.145 13.915 -5.876
342 HH TYR 53 HH TYR 53 -1.727 11.021 -7.318
343 H SER 54 H SER 54 -3.207 13.354 0.365
344 HA SER 54 HA SER 54 -3.867 15.262 -1.673
345 HB2 SER 54 1HB SER 54 -5.447 13.802 -0.166
346 HB3 SER 54 2HB SER 54 -5.290 15.147 0.963
347 HG SER 54 HG SER 54 -6.093 16.522 -0.642
348 H GLY 55 H GLY 55 -4.457 17.528 -1.148
349 HA2 GLY 55 1HA GLY 55 -3.830 19.017 1.022
350 HA3 GLY 55 2HA GLY 55 -2.265 18.780 0.259
351 HA PRO 56 HA PRO 56 -4.107 22.610 -1.543
352 HB2 PRO 56 1HB PRO 56 -1.787 24.018 -1.489
353 HB3 PRO 56 2HB PRO 56 -2.885 23.923 -0.107
354 HG2 PRO 56 1HG PRO 56 -0.370 22.389 -0.635
355 HG3 PRO 56 2HG PRO 56 -0.931 23.132 0.874
356 HD2 PRO 56 1HD PRO 56 -1.177 20.481 0.375
357 HD3 PRO 56 2HD PRO 56 -2.353 21.382 1.353
358 H SER 57 H SER 57 -2.078 20.195 -2.503
359 HA SER 57 HA SER 57 -0.711 21.234 -4.711
360 HB2 SER 57 1HB SER 57 -0.499 18.912 -3.621
361 HB3 SER 57 2HB SER 57 -1.858 18.447 -4.644
362 HG SER 57 HG SER 57 -0.323 18.072 -6.041
363 H SER 58 H SER 58 -1.211 21.434 -6.871
364 HA SER 58 HA SER 58 -3.789 22.218 -7.566
365 HB2 SER 58 1HB SER 58 -1.881 22.951 -8.862
366 HB3 SER 58 2HB SER 58 -1.512 21.291 -9.331
367 HG SER 58 HG SER 58 -2.645 22.414 -10.971
368 H GLY 59 H GLY 59 -5.187 21.250 -9.260
369 HA2 GLY 59 1HA GLY 59 -5.072 18.333 -9.428
370 HA3 GLY 59 2HA GLY 59 -6.483 19.035 -8.651
Start of MODEL 6
1 H1 GLY 1 1H GLY 1 9.410 -17.142 16.962
2 HA2 GLY 1 1HA GLY 1 11.285 -17.186 18.782
3 HA3 GLY 1 2HA GLY 1 11.278 -18.899 18.387
4 H SER 2 H SER 2 11.596 -15.694 16.887
5 HA SER 2 HA SER 2 13.664 -16.825 15.133
6 HB2 SER 2 1HB SER 2 11.198 -15.334 14.349
7 HB3 SER 2 2HB SER 2 12.675 -15.039 13.432
8 HG SER 2 HG SER 2 12.715 -17.506 13.418
9 H SER 3 H SER 3 15.441 -15.882 15.934
10 HA SER 3 HA SER 3 15.377 -12.976 16.408
11 HB2 SER 3 1HB SER 3 17.278 -13.305 17.920
12 HB3 SER 3 2HB SER 3 15.919 -14.317 18.408
13 HG SER 3 HG SER 3 18.387 -15.036 17.335
14 H GLY 4 H GLY 4 17.496 -11.862 16.002
15 HA2 GLY 4 1HA GLY 4 19.523 -11.667 14.787
16 HA3 GLY 4 2HA GLY 4 19.083 -13.102 13.873
17 H SER 5 H SER 5 19.730 -10.059 13.370
18 HA SER 5 HA SER 5 17.474 -9.538 11.558
19 HB2 SER 5 1HB SER 5 19.379 -7.784 13.036
20 HB3 SER 5 2HB SER 5 18.779 -7.214 11.479
21 HG SER 5 HG SER 5 16.883 -8.248 13.217
22 H SER 6 H SER 6 17.986 -10.658 9.735
23 HA SER 6 HA SER 6 20.479 -11.082 8.625
24 HB2 SER 6 1HB SER 6 17.791 -10.796 7.268
25 HB3 SER 6 2HB SER 6 19.245 -11.362 6.446
26 HG SER 6 HG SER 6 17.834 -13.033 7.332
27 H GLY 7 H GLY 7 18.238 -8.390 8.048
28 HA2 GLY 7 1HA GLY 7 19.785 -6.270 7.868
29 HA3 GLY 7 2HA GLY 7 20.242 -7.070 6.371
30 H MET 8 H MET 8 18.224 -7.792 5.045
31 HA MET 8 HA MET 8 16.916 -5.497 4.164
32 HB2 MET 8 1HB MET 8 16.310 -8.424 3.793
33 HB3 MET 8 2HB MET 8 15.338 -7.170 3.036
34 HG2 MET 8 1HG MET 8 16.792 -7.575 1.349
35 HG3 MET 8 2HG MET 8 17.698 -6.332 2.210
36 HE1 MET 8 3HE MET 8 17.920 -9.441 0.425
37 HE2 MET 8 1HE MET 8 19.217 -8.277 0.152
38 HE3 MET 8 2HE MET 8 19.592 -9.886 0.768
39 H GLU 9 H GLU 9 14.566 -5.083 4.134
40 HA GLU 9 HA GLU 9 13.514 -5.213 6.820
41 HB2 GLU 9 1HB GLU 9 12.782 -3.786 4.305
42 HB3 GLU 9 2HB GLU 9 11.541 -3.997 5.532
43 HG2 GLU 9 1HG GLU 9 12.379 -1.984 6.166
44 HG3 GLU 9 2HG GLU 9 13.413 -3.050 7.116
45 HA PRO 10 HA PRO 10 10.719 -8.565 6.383
46 HB2 PRO 10 1HB PRO 10 8.564 -7.695 7.787
47 HB3 PRO 10 2HB PRO 10 10.080 -8.181 8.556
48 HG2 PRO 10 1HG PRO 10 9.077 -5.435 7.914
49 HG3 PRO 10 2HG PRO 10 9.881 -6.017 9.384
50 HD2 PRO 10 1HD PRO 10 11.190 -4.638 7.456
51 HD3 PRO 10 2HD PRO 10 11.979 -5.889 8.438
52 H ALA 11 H ALA 11 10.437 -8.265 4.066
53 HA ALA 11 HA ALA 11 7.975 -6.870 3.290
54 HB1 ALA 11 3HB ALA 11 8.938 -6.414 1.321
55 HB2 ALA 11 1HB ALA 11 10.444 -6.852 2.128
56 HB3 ALA 11 2HB ALA 11 9.587 -8.045 1.151
57 H GLY 12 H GLY 12 7.090 -8.124 1.137
58 HA2 GLY 12 1HA GLY 12 6.904 -10.989 1.666
59 HA3 GLY 12 2HA GLY 12 5.417 -10.064 1.807
60 HA PRO 13 HA PRO 13 6.360 -11.415 -2.659
61 HB2 PRO 13 1HB PRO 13 4.540 -13.421 -2.854
62 HB3 PRO 13 2HB PRO 13 6.210 -13.685 -2.336
63 HG2 PRO 13 1HG PRO 13 3.732 -13.417 -0.678
64 HG3 PRO 13 2HG PRO 13 5.073 -14.564 -0.507
65 HD2 PRO 13 1HD PRO 13 4.845 -12.348 1.034
66 HD3 PRO 13 2HD PRO 13 6.417 -13.026 0.562
67 H CYS 14 H CYS 14 5.390 -9.955 -3.910
68 HA CYS 14 HA CYS 14 3.074 -8.573 -3.424
69 HB2 CYS 14 1HB CYS 14 4.412 -7.703 -5.129
70 HB3 CYS 14 2HB CYS 14 4.515 -9.247 -5.968
71 H GLY 15 H GLY 15 1.209 -9.549 -2.872
72 HA2 GLY 15 1HA GLY 15 0.301 -11.946 -4.203
73 HA3 GLY 15 2HA GLY 15 -0.538 -11.075 -2.928
74 H PHE 16 H PHE 16 0.597 -9.621 -5.917
75 HA PHE 16 HA PHE 16 -2.196 -9.394 -6.817
76 HB2 PHE 16 1HB PHE 16 -0.232 -7.181 -7.303
77 HB3 PHE 16 2HB PHE 16 -1.991 -7.119 -7.278
78 HD1 PHE 16 1HD PHE 16 -2.929 -7.988 -4.848
79 HD2 PHE 16 2HD PHE 16 0.778 -6.039 -5.605
80 HE1 PHE 16 1HE PHE 16 -2.869 -7.205 -2.516
81 HE2 PHE 16 2HE PHE 16 0.845 -5.253 -3.274
82 HZ PHE 16 HZ PHE 16 -0.980 -5.837 -1.726
83 H CYS 17 H CYS 17 0.942 -10.335 -7.512
84 HA CYS 17 HA CYS 17 0.614 -10.034 -10.407
85 HB2 CYS 17 1HB CYS 17 2.931 -10.461 -8.590
86 HB3 CYS 17 2HB CYS 17 3.036 -11.149 -10.207
87 HA PRO 18 HA PRO 18 -0.397 -14.239 -11.141
88 HB2 PRO 18 1HB PRO 18 0.980 -14.768 -13.420
89 HB3 PRO 18 2HB PRO 18 -0.450 -13.730 -13.381
90 HG2 PRO 18 1HG PRO 18 2.444 -12.967 -13.410
91 HG3 PRO 18 2HG PRO 18 1.092 -12.261 -14.314
92 HD2 PRO 18 1HD PRO 18 2.098 -11.123 -12.073
93 HD3 PRO 18 2HD PRO 18 0.383 -11.003 -12.518
94 H ALA 19 H ALA 19 0.279 -16.272 -10.641
95 HA ALA 19 HA ALA 19 2.351 -16.861 -9.060
96 HB1 ALA 19 3HB ALA 19 2.290 -19.190 -9.933
97 HB2 ALA 19 1HB ALA 19 0.699 -18.521 -9.569
98 HB3 ALA 19 2HB ALA 19 1.251 -18.626 -11.241
99 H GLY 20 H GLY 20 4.483 -17.635 -9.242
100 HA2 GLY 20 1HA GLY 20 6.564 -17.929 -10.207
101 HA3 GLY 20 2HA GLY 20 5.811 -17.762 -11.786
102 H GLU 21 H GLU 21 4.792 -15.309 -11.857
103 HA GLU 21 HA GLU 21 7.136 -13.660 -11.999
104 HB2 GLU 21 1HB GLU 21 4.232 -12.983 -12.506
105 HB3 GLU 21 2HB GLU 21 5.600 -11.952 -12.901
106 HG2 GLU 21 1HG GLU 21 4.639 -13.246 -14.812
107 HG3 GLU 21 2HG GLU 21 6.372 -13.446 -14.559
108 H VAL 22 H VAL 22 4.699 -14.231 -9.672
109 HA VAL 22 HA VAL 22 4.312 -11.884 -8.348
110 HB VAL 22 HB VAL 22 3.267 -13.913 -7.574
111 HG11 VAL 22 1HG1 VAL 22 4.348 -15.782 -6.774
112 HG12 VAL 22 2HG1 VAL 22 5.477 -15.237 -8.015
113 HG13 VAL 22 3HG1 VAL 22 5.794 -14.882 -6.317
114 HG21 VAL 22 3HG2 VAL 22 3.160 -13.306 -5.395
115 HG22 VAL 22 1HG2 VAL 22 4.912 -13.314 -5.194
116 HG23 VAL 22 2HG2 VAL 22 4.119 -11.940 -5.965
117 H GLN 23 H GLN 23 5.965 -10.424 -8.289
118 HA GLN 23 HA GLN 23 8.597 -11.153 -7.377
119 HB2 GLN 23 1HB GLN 23 7.338 -8.496 -8.059
120 HB3 GLN 23 2HB GLN 23 9.009 -8.669 -7.539
121 HG2 GLN 23 1HG GLN 23 9.196 -10.343 -9.497
122 HG3 GLN 23 2HG GLN 23 7.719 -9.574 -10.076
123 HE21 GLN 23 1HE2 GLN 23 8.181 -8.187 -11.616
124 HE22 GLN 23 2HE2 GLN 23 9.508 -7.081 -11.631
125 HA PRO 24 HA PRO 24 8.174 -10.392 -3.077
126 HB2 PRO 24 1HB PRO 24 10.609 -9.353 -2.475
127 HB3 PRO 24 2HB PRO 24 10.362 -11.059 -2.862
128 HG2 PRO 24 1HG PRO 24 11.348 -8.843 -4.616
129 HG3 PRO 24 2HG PRO 24 11.949 -10.505 -4.469
130 HD2 PRO 24 1HD PRO 24 10.334 -9.713 -6.494
131 HD3 PRO 24 2HD PRO 24 10.292 -11.358 -5.826
132 H ALA 25 H ALA 25 6.640 -8.799 -2.817
133 HA ALA 25 HA ALA 25 6.839 -6.120 -3.516
134 HB1 ALA 25 3HB ALA 25 5.101 -7.742 -1.861
135 HB2 ALA 25 1HB ALA 25 5.298 -6.112 -1.217
136 HB3 ALA 25 2HB ALA 25 4.721 -6.345 -2.867
137 H ARG 26 H ARG 26 8.801 -5.186 -3.028
138 HA ARG 26 HA ARG 26 10.022 -5.329 -0.467
139 HB2 ARG 26 1HB ARG 26 10.479 -3.801 -2.978
140 HB3 ARG 26 2HB ARG 26 11.188 -3.158 -1.502
141 HG2 ARG 26 1HG ARG 26 11.600 -6.035 -2.102
142 HG3 ARG 26 2HG ARG 26 12.487 -4.846 -3.058
143 HD2 ARG 26 1HD ARG 26 13.118 -3.808 -0.790
144 HD3 ARG 26 2HD ARG 26 12.586 -5.342 -0.102
145 HE ARG 26 HE ARG 26 14.299 -6.160 -1.984
146 HH11 ARG 26 2HH1 ARG 26 14.564 -3.694 0.459
147 HH12 ARG 26 1HH1 ARG 26 16.279 -3.864 0.630
148 HH21 ARG 26 2HH2 ARG 26 16.558 -6.393 -1.768
149 HH22 ARG 26 1HH2 ARG 26 17.413 -5.399 -0.637
150 H TYR 27 H TYR 27 7.469 -3.449 -1.745
151 HA TYR 27 HA TYR 27 7.586 -1.671 0.603
152 HB2 TYR 27 1HB TYR 27 6.101 -0.845 -1.851
153 HB3 TYR 27 2HB TYR 27 6.908 0.148 -0.642
154 HD1 TYR 27 1HD TYR 27 9.515 -0.019 -0.593
155 HD2 TYR 27 2HD TYR 27 7.115 -1.175 -3.911
156 HE1 TYR 27 1HE TYR 27 11.464 0.210 -2.075
157 HE2 TYR 27 2HE TYR 27 9.058 -0.950 -5.402
158 HH TYR 27 HH TYR 27 11.515 0.672 -4.989
159 H THR 28 H THR 28 5.217 -0.606 0.782
160 HA THR 28 HA THR 28 3.087 -2.498 0.310
161 HB THR 28 HB THR 28 3.381 -1.767 3.184
162 HG1 THR 28 1HG THR 28 4.889 -3.769 1.840
163 HG21 THR 28 3HG2 THR 28 2.557 -4.428 2.108
164 HG22 THR 28 1HG2 THR 28 1.455 -3.060 1.957
165 HG23 THR 28 2HG2 THR 28 2.003 -3.580 3.551
166 H CYS 29 H CYS 29 1.228 -1.443 0.004
167 HA CYS 29 HA CYS 29 0.977 1.263 -0.210
168 HB2 CYS 29 1HB CYS 29 -0.679 -0.741 -0.749
169 HB3 CYS 29 2HB CYS 29 -1.414 -0.232 0.767
170 HA PRO 30 HA PRO 30 1.281 2.510 4.079
171 HB2 PRO 30 1HB PRO 30 1.276 5.174 3.559
172 HB3 PRO 30 2HB PRO 30 2.707 4.158 3.352
173 HG2 PRO 30 1HG PRO 30 0.757 5.122 1.297
174 HG3 PRO 30 2HG PRO 30 2.526 5.042 1.210
175 HD2 PRO 30 1HD PRO 30 0.925 3.190 0.053
176 HD3 PRO 30 2HD PRO 30 2.525 2.792 0.711
177 H ARG 31 H ARG 31 -1.314 2.383 2.152
178 HA ARG 31 HA ARG 31 -3.000 3.949 3.993
179 HB2 ARG 31 1HB ARG 31 -3.159 3.515 1.038
180 HB3 ARG 31 2HB ARG 31 -4.645 3.768 1.945
181 HG2 ARG 31 1HG ARG 31 -2.421 5.681 2.380
182 HG3 ARG 31 2HG ARG 31 -3.302 5.765 0.853
183 HD2 ARG 31 1HD ARG 31 -5.366 6.142 1.969
184 HD3 ARG 31 2HD ARG 31 -4.663 5.747 3.537
185 HE ARG 31 HE ARG 31 -3.311 7.946 2.389
186 HH11 ARG 31 2HH1 ARG 31 -6.323 7.084 3.907
187 HH12 ARG 31 1HH1 ARG 31 -6.615 8.674 4.529
188 HH21 ARG 31 2HH2 ARG 31 -3.684 10.044 3.202
189 HH22 ARG 31 1HH2 ARG 31 -5.114 10.358 4.127
190 H CYS 32 H CYS 32 -2.869 1.032 1.976
191 HA CYS 32 HA CYS 32 -4.867 -0.194 3.762
192 HB2 CYS 32 1HB CYS 32 -5.644 -1.529 1.951
193 HB3 CYS 32 2HB CYS 32 -5.529 0.117 1.338
194 H ASN 33 H ASN 33 -1.681 -0.086 3.291
195 HA ASN 33 HA ASN 33 0.088 -1.450 3.729
196 HB2 ASN 33 1HB ASN 33 -2.114 -2.508 5.429
197 HB3 ASN 33 2HB ASN 33 -0.671 -3.504 5.267
198 HD21 ASN 33 1HD2 ASN 33 -2.054 -0.698 6.649
199 HD22 ASN 33 2HD2 ASN 33 -0.673 -0.188 7.554
200 H ALA 34 H ALA 34 -0.687 -1.872 1.254
201 HA ALA 34 HA ALA 34 -0.978 -4.779 0.912
202 HB1 ALA 34 3HB ALA 34 -1.316 -3.875 -1.577
203 HB2 ALA 34 1HB ALA 34 -2.635 -3.979 -0.410
204 HB3 ALA 34 2HB ALA 34 -1.822 -2.438 -0.689
205 HA PRO 35 HA PRO 35 3.387 -4.665 -0.081
206 HB2 PRO 35 1HB PRO 35 3.640 -7.351 -0.385
207 HB3 PRO 35 2HB PRO 35 3.583 -6.565 1.197
208 HG2 PRO 35 1HG PRO 35 1.401 -7.958 -0.307
209 HG3 PRO 35 2HG PRO 35 1.807 -8.050 1.417
210 HD2 PRO 35 1HD PRO 35 -0.223 -6.524 0.477
211 HD3 PRO 35 2HD PRO 35 0.731 -6.071 1.904
212 H TYR 36 H TYR 36 3.458 -3.717 -2.093
213 HA TYR 36 HA TYR 36 2.714 -5.380 -4.400
214 HB2 TYR 36 1HB TYR 36 2.769 -3.262 -5.690
215 HB3 TYR 36 2HB TYR 36 1.605 -3.224 -4.370
216 HD1 TYR 36 2HD TYR 36 4.797 -1.909 -5.607
217 HD2 TYR 36 1HD TYR 36 1.932 -1.767 -2.464
218 HE1 TYR 36 2HE TYR 36 5.835 0.154 -4.761
219 HE2 TYR 36 1HE TYR 36 2.962 0.298 -1.611
220 HH TYR 36 HH TYR 36 4.757 2.249 -3.198
221 H CYS 37 H CYS 37 4.135 -5.489 -6.216
222 HA CYS 37 HA CYS 37 6.894 -5.724 -5.448
223 HB2 CYS 37 1HB CYS 37 7.206 -6.501 -7.801
224 HB3 CYS 37 2HB CYS 37 5.975 -7.399 -6.919
225 H SER 38 H SER 38 5.009 -3.621 -7.573
226 HA SER 38 HA SER 38 7.058 -1.584 -7.385
227 HB2 SER 38 1HB SER 38 6.290 -2.824 -10.035
228 HB3 SER 38 2HB SER 38 7.139 -1.286 -9.881
229 HG SER 38 HG SER 38 8.822 -2.570 -9.937
230 H LEU 39 H LEU 39 6.322 0.403 -8.731
231 HA LEU 39 HA LEU 39 3.993 1.411 -7.709
232 HB2 LEU 39 1HB LEU 39 5.931 2.482 -9.134
233 HB3 LEU 39 2HB LEU 39 4.789 2.248 -10.455
234 HG LEU 39 HG LEU 39 4.732 4.526 -9.505
235 HD11 LEU 39 1HD1 LEU 39 2.542 4.699 -9.949
236 HD12 LEU 39 2HD1 LEU 39 2.095 3.512 -8.724
237 HD13 LEU 39 3HD1 LEU 39 2.653 2.976 -10.309
238 HD21 LEU 39 3HD2 LEU 39 3.256 3.758 -7.112
239 HD22 LEU 39 1HD2 LEU 39 4.530 4.959 -7.323
240 HD23 LEU 39 2HD2 LEU 39 4.950 3.264 -7.076
241 H ARG 40 H ARG 40 4.422 -0.199 -10.843
242 HA ARG 40 HA ARG 40 2.028 0.097 -12.049
243 HB2 ARG 40 1HB ARG 40 3.491 -2.533 -11.754
244 HB3 ARG 40 2HB ARG 40 2.289 -2.164 -12.983
245 HG2 ARG 40 1HG ARG 40 3.956 -0.167 -13.483
246 HG3 ARG 40 2HG ARG 40 5.110 -1.290 -12.761
247 HD2 ARG 40 1HD ARG 40 4.297 -3.029 -14.359
248 HD3 ARG 40 2HD ARG 40 3.329 -1.780 -15.141
249 HE ARG 40 HE ARG 40 6.154 -1.198 -14.914
250 HH11 ARG 40 2HH1 ARG 40 3.598 -2.528 -16.867
251 HH12 ARG 40 1HH1 ARG 40 4.464 -2.345 -18.357
252 HH21 ARG 40 2HH2 ARG 40 7.305 -0.953 -16.868
253 HH22 ARG 40 1HH2 ARG 40 6.573 -1.450 -18.356
254 H CYS 41 H CYS 41 2.639 -2.616 -9.810
255 HA CYS 41 HA CYS 41 -0.068 -3.357 -9.585
256 HB2 CYS 41 1HB CYS 41 2.445 -4.000 -8.126
257 HB3 CYS 41 2HB CYS 41 0.925 -4.373 -7.321
258 H TYR 42 H TYR 42 2.009 -1.383 -7.491
259 HA TYR 42 HA TYR 42 0.430 -0.914 -5.340
260 HB2 TYR 42 1HB TYR 42 2.560 0.124 -5.400
261 HB3 TYR 42 2HB TYR 42 2.179 1.000 -6.878
262 HD1 TYR 42 1HD TYR 42 1.244 0.744 -3.285
263 HD2 TYR 42 2HD TYR 42 1.343 3.181 -6.772
264 HE1 TYR 42 1HE TYR 42 0.536 2.681 -1.945
265 HE2 TYR 42 2HE TYR 42 0.636 5.124 -5.441
266 HH TYR 42 HH TYR 42 -0.340 5.717 -3.424
267 H ARG 43 H ARG 43 -0.149 0.133 -8.591
268 HA ARG 43 HA ARG 43 -2.331 1.890 -7.744
269 HB2 ARG 43 1HB ARG 43 -0.969 1.436 -10.394
270 HB3 ARG 43 2HB ARG 43 -2.453 2.367 -10.250
271 HG2 ARG 43 1HG ARG 43 -1.333 3.926 -8.740
272 HG3 ARG 43 2HG ARG 43 0.157 2.991 -8.884
273 HD2 ARG 43 1HD ARG 43 0.566 4.575 -10.469
274 HD3 ARG 43 2HD ARG 43 -0.279 3.391 -11.465
275 HE ARG 43 HE ARG 43 -1.955 5.413 -10.248
276 HH11 ARG 43 2HH1 ARG 43 -0.106 4.444 -13.034
277 HH12 ARG 43 1HH1 ARG 43 -0.952 5.493 -14.123
278 HH21 ARG 43 2HH2 ARG 43 -3.077 6.797 -11.672
279 HH22 ARG 43 1HH2 ARG 43 -2.642 6.831 -13.347
280 H THR 44 H THR 44 -1.707 -1.079 -9.528
281 HA THR 44 HA THR 44 -4.380 -1.465 -10.421
282 HB THR 44 HB THR 44 -2.111 -3.435 -10.099
283 HG1 THR 44 1HG THR 44 -1.501 -2.556 -11.915
284 HG21 THR 44 3HG2 THR 44 -4.874 -3.750 -11.237
285 HG22 THR 44 1HG2 THR 44 -4.035 -4.781 -10.079
286 HG23 THR 44 2HG2 THR 44 -3.533 -4.764 -11.769
287 H HIS 45 H HIS 45 -2.497 -3.039 -7.831
288 HA HIS 45 HA HIS 45 -4.180 -4.769 -6.718
289 HB2 HIS 45 1HB HIS 45 -3.063 -4.525 -4.712
290 HB3 HIS 45 2HB HIS 45 -1.940 -3.728 -5.810
291 HD1 HIS 45 1HD HIS 45 -1.417 -1.313 -5.361
292 HD2 HIS 45 2HD HIS 45 -4.642 -2.692 -3.134
293 HE1 HIS 45 1HE HIS 45 -1.947 0.529 -3.733
294 H GLY 46 H GLY 46 -4.497 -1.256 -6.370
295 HA2 GLY 46 1HA GLY 46 -7.310 -1.336 -6.217
296 HA3 GLY 46 2HA GLY 46 -6.656 -1.225 -4.589
297 H THR 47 H THR 47 -8.216 0.786 -5.289
298 HA THR 47 HA THR 47 -6.510 2.949 -6.293
299 HB THR 47 HB THR 47 -8.577 4.284 -6.424
300 HG1 THR 47 1HG THR 47 -10.581 3.123 -6.072
301 HG21 THR 47 3HG2 THR 47 -9.013 1.608 -7.739
302 HG22 THR 47 1HG2 THR 47 -7.808 2.769 -8.295
303 HG23 THR 47 2HG2 THR 47 -9.520 3.195 -8.317
304 H CYS 48 H CYS 48 -5.231 3.158 -4.396
305 HA CYS 48 HA CYS 48 -6.653 4.241 -2.057
306 HB2 CYS 48 1HB CYS 48 -3.888 3.028 -2.252
307 HB3 CYS 48 2HB CYS 48 -4.593 3.701 -0.786
308 H ALA 49 H ALA 49 -3.845 4.735 -4.160
309 HA ALA 49 HA ALA 49 -2.738 6.997 -3.088
310 HB1 ALA 49 3HB ALA 49 -2.582 7.531 -5.770
311 HB2 ALA 49 1HB ALA 49 -1.479 6.494 -4.864
312 HB3 ALA 49 2HB ALA 49 -2.837 5.786 -5.741
313 H GLU 50 H GLU 50 -5.651 6.750 -5.057
314 HA GLU 50 HA GLU 50 -6.143 9.345 -5.744
315 HB2 GLU 50 1HB GLU 50 -8.045 7.205 -4.803
316 HB3 GLU 50 2HB GLU 50 -8.605 8.767 -5.384
317 HG2 GLU 50 1HG GLU 50 -6.765 7.126 -7.064
318 HG3 GLU 50 2HG GLU 50 -8.485 6.746 -7.002
319 H ASN 51 H ASN 51 -6.816 7.826 -2.610
320 HA ASN 51 HA ASN 51 -7.372 10.495 -1.502
321 HB2 ASN 51 1HB ASN 51 -8.083 7.786 -0.352
322 HB3 ASN 51 2HB ASN 51 -8.539 9.351 0.316
323 HD21 ASN 51 1HD2 ASN 51 -9.634 6.821 -1.416
324 HD22 ASN 51 2HD2 ASN 51 -10.897 7.589 -2.309
325 H PHE 52 H PHE 52 -4.716 9.751 -1.976
326 HA PHE 52 HA PHE 52 -3.702 9.245 0.742
327 HB2 PHE 52 1HB PHE 52 -2.865 7.530 -0.653
328 HB3 PHE 52 2HB PHE 52 -2.526 8.652 -1.966
329 HD1 PHE 52 2HD PHE 52 -1.554 8.056 1.585
330 HD2 PHE 52 1HD PHE 52 -0.349 9.290 -2.306
331 HE1 PHE 52 2HE PHE 52 0.766 8.273 2.376
332 HE2 PHE 52 1HE PHE 52 1.973 9.507 -1.522
333 HZ PHE 52 HZ PHE 52 2.533 9.000 0.822
334 H TYR 53 H TYR 53 -2.938 11.049 -2.233
335 HA TYR 53 HA TYR 53 -1.195 12.861 -0.844
336 HB2 TYR 53 1HB TYR 53 -1.288 14.098 -3.087
337 HB3 TYR 53 2HB TYR 53 -0.606 12.476 -3.093
338 HD1 TYR 53 2HD TYR 53 -3.863 14.227 -3.620
339 HD2 TYR 53 1HD TYR 53 -1.346 10.966 -4.683
340 HE1 TYR 53 2HE TYR 53 -5.465 13.568 -5.366
341 HE2 TYR 53 1HE TYR 53 -2.940 10.298 -6.432
342 HH TYR 53 HH TYR 53 -4.750 11.516 -7.835
343 H SER 54 H SER 54 -1.549 15.283 -1.150
344 HA SER 54 HA SER 54 -4.370 15.943 -0.609
345 HB2 SER 54 1HB SER 54 -3.073 16.074 1.457
346 HB3 SER 54 2HB SER 54 -1.900 17.135 0.677
347 HG SER 54 HG SER 54 -4.201 18.276 0.285
348 H GLY 55 H GLY 55 -5.201 17.208 -2.125
349 HA2 GLY 55 1HA GLY 55 -3.421 19.177 -3.426
350 HA3 GLY 55 2HA GLY 55 -4.616 18.256 -4.327
351 HA PRO 56 HA PRO 56 -7.174 21.827 -3.758
352 HB2 PRO 56 1HB PRO 56 -9.419 20.788 -4.877
353 HB3 PRO 56 2HB PRO 56 -8.037 21.341 -5.831
354 HG2 PRO 56 1HG PRO 56 -8.782 18.559 -5.013
355 HG3 PRO 56 2HG PRO 56 -8.194 19.145 -6.580
356 HD2 PRO 56 1HD PRO 56 -6.584 17.905 -4.791
357 HD3 PRO 56 2HD PRO 56 -5.996 19.171 -5.887
358 H SER 57 H SER 57 -9.662 22.039 -3.098
359 HA SER 57 HA SER 57 -9.812 20.936 -0.434
360 HB2 SER 57 1HB SER 57 -11.639 22.826 -1.935
361 HB3 SER 57 2HB SER 57 -11.856 22.363 -0.247
362 HG SER 57 HG SER 57 -9.388 23.400 -1.090
363 H SER 58 H SER 58 -11.981 20.116 0.355
364 HA SER 58 HA SER 58 -13.315 18.461 -1.675
365 HB2 SER 58 1HB SER 58 -11.721 17.009 -0.542
366 HB3 SER 58 2HB SER 58 -12.338 17.514 1.031
367 HG SER 58 HG SER 58 -13.244 15.581 -0.590
368 H GLY 59 H GLY 59 -15.327 19.237 -1.726
369 HA2 GLY 59 1HA GLY 59 -16.665 20.723 0.141
370 HA3 GLY 59 2HA GLY 59 -17.473 19.665 -1.007
Start of MODEL 7
1 H1 GLY 1 1H GLY 1 8.583 -12.860 11.934
2 HA2 GLY 1 1HA GLY 1 7.513 -15.048 12.711
3 HA3 GLY 1 2HA GLY 1 6.029 -14.324 12.109
4 H SER 2 H SER 2 8.824 -16.104 11.324
5 HA SER 2 HA SER 2 7.855 -16.787 8.756
6 HB2 SER 2 1HB SER 2 9.700 -15.807 7.404
7 HB3 SER 2 2HB SER 2 8.648 -14.581 8.111
8 HG SER 2 HG SER 2 11.198 -15.397 9.052
9 H SER 3 H SER 3 9.762 -17.916 7.468
10 HA SER 3 HA SER 3 11.178 -19.588 9.435
11 HB2 SER 3 1HB SER 3 10.967 -21.430 7.976
12 HB3 SER 3 2HB SER 3 9.405 -20.618 7.879
13 HG SER 3 HG SER 3 10.941 -21.222 5.885
14 H GLY 4 H GLY 4 13.290 -19.251 9.560
15 HA2 GLY 4 1HA GLY 4 15.482 -18.991 8.887
16 HA3 GLY 4 2HA GLY 4 14.942 -19.152 7.223
17 H SER 5 H SER 5 16.858 -17.276 8.507
18 HA SER 5 HA SER 5 15.553 -14.694 8.300
19 HB2 SER 5 1HB SER 5 18.369 -15.553 8.957
20 HB3 SER 5 2HB SER 5 17.936 -13.859 8.732
21 HG SER 5 HG SER 5 17.596 -15.394 10.891
22 H SER 6 H SER 6 15.299 -13.678 6.436
23 HA SER 6 HA SER 6 17.406 -13.767 4.427
24 HB2 SER 6 1HB SER 6 16.053 -15.584 3.662
25 HB3 SER 6 2HB SER 6 14.567 -14.670 3.920
26 HG SER 6 HG SER 6 16.574 -13.840 2.106
27 H GLY 7 H GLY 7 17.847 -11.665 4.232
28 HA2 GLY 7 1HA GLY 7 17.227 -9.617 3.103
29 HA3 GLY 7 2HA GLY 7 15.590 -9.843 3.702
30 H MET 8 H MET 8 17.084 -7.460 3.980
31 HA MET 8 HA MET 8 17.642 -7.420 6.870
32 HB2 MET 8 1HB MET 8 18.897 -5.324 6.404
33 HB3 MET 8 2HB MET 8 19.565 -6.733 5.590
34 HG2 MET 8 1HG MET 8 17.631 -4.972 4.158
35 HG3 MET 8 2HG MET 8 19.315 -4.483 4.321
36 HE1 MET 8 3HE MET 8 18.511 -4.485 1.576
37 HE2 MET 8 1HE MET 8 18.541 -5.966 0.619
38 HE3 MET 8 2HE MET 8 17.176 -5.633 1.684
39 H GLU 9 H GLU 9 15.584 -6.250 4.380
40 HA GLU 9 HA GLU 9 14.345 -4.354 6.265
41 HB2 GLU 9 1HB GLU 9 14.739 -4.284 3.313
42 HB3 GLU 9 2HB GLU 9 13.278 -3.554 3.964
43 HG2 GLU 9 1HG GLU 9 14.492 -1.981 5.216
44 HG3 GLU 9 2HG GLU 9 16.006 -2.857 4.997
45 HA PRO 10 HA PRO 10 10.758 -6.898 6.355
46 HB2 PRO 10 1HB PRO 10 8.902 -5.027 7.008
47 HB3 PRO 10 2HB PRO 10 10.093 -5.641 8.161
48 HG2 PRO 10 1HG PRO 10 10.128 -3.104 6.573
49 HG3 PRO 10 2HG PRO 10 10.556 -3.366 8.274
50 HD2 PRO 10 1HD PRO 10 12.417 -3.150 6.319
51 HD3 PRO 10 2HD PRO 10 12.652 -4.171 7.752
52 H ALA 11 H ALA 11 9.928 -7.696 4.528
53 HA ALA 11 HA ALA 11 8.185 -6.019 2.915
54 HB1 ALA 11 3HB ALA 11 9.271 -6.764 0.799
55 HB2 ALA 11 1HB ALA 11 10.257 -5.672 1.771
56 HB3 ALA 11 2HB ALA 11 10.602 -7.402 1.764
57 H GLY 12 H GLY 12 7.098 -7.385 1.166
58 HA2 GLY 12 1HA GLY 12 6.885 -10.209 1.937
59 HA3 GLY 12 2HA GLY 12 5.431 -9.222 1.970
60 HA PRO 13 HA PRO 13 6.370 -11.056 -2.329
61 HB2 PRO 13 1HB PRO 13 4.549 -13.070 -2.319
62 HB3 PRO 13 2HB PRO 13 6.219 -13.281 -1.777
63 HG2 PRO 13 1HG PRO 13 3.741 -12.845 -0.154
64 HG3 PRO 13 2HG PRO 13 5.083 -13.969 0.132
65 HD2 PRO 13 1HD PRO 13 4.856 -11.609 1.439
66 HD3 PRO 13 2HD PRO 13 6.428 -12.331 1.039
67 H CYS 14 H CYS 14 5.388 -9.789 -3.764
68 HA CYS 14 HA CYS 14 3.024 -8.391 -3.376
69 HB2 CYS 14 1HB CYS 14 4.335 -7.521 -5.076
70 HB3 CYS 14 2HB CYS 14 4.641 -9.101 -5.790
71 H GLY 15 H GLY 15 1.232 -9.503 -2.769
72 HA2 GLY 15 1HA GLY 15 0.438 -11.938 -4.096
73 HA3 GLY 15 2HA GLY 15 -0.448 -11.101 -2.830
74 H PHE 16 H PHE 16 0.637 -9.653 -5.849
75 HA PHE 16 HA PHE 16 -2.173 -9.499 -6.717
76 HB2 PHE 16 1HB PHE 16 -0.116 -7.318 -7.103
77 HB3 PHE 16 2HB PHE 16 -1.833 -7.241 -7.486
78 HD1 PHE 16 1HD PHE 16 -3.372 -7.858 -5.356
79 HD2 PHE 16 2HD PHE 16 0.551 -6.213 -5.218
80 HE1 PHE 16 1HE PHE 16 -3.834 -6.954 -3.114
81 HE2 PHE 16 2HE PHE 16 0.096 -5.307 -2.977
82 HZ PHE 16 HZ PHE 16 -2.098 -5.678 -1.921
83 H CYS 17 H CYS 17 1.107 -10.125 -7.500
84 HA CYS 17 HA CYS 17 0.750 -9.979 -10.361
85 HB2 CYS 17 1HB CYS 17 2.983 -10.556 -8.500
86 HB3 CYS 17 2HB CYS 17 3.071 -11.328 -10.080
87 HA PRO 18 HA PRO 18 -0.517 -14.088 -11.226
88 HB2 PRO 18 1HB PRO 18 0.998 -14.756 -13.377
89 HB3 PRO 18 2HB PRO 18 -0.327 -13.589 -13.461
90 HG2 PRO 18 1HG PRO 18 2.617 -13.098 -13.235
91 HG3 PRO 18 2HG PRO 18 1.420 -12.275 -14.252
92 HD2 PRO 18 1HD PRO 18 2.328 -11.222 -11.929
93 HD3 PRO 18 2HD PRO 18 0.677 -10.947 -12.521
94 H ALA 19 H ALA 19 0.065 -16.320 -11.169
95 HA ALA 19 HA ALA 19 1.984 -17.009 -9.271
96 HB1 ALA 19 3HB ALA 19 -0.069 -18.314 -10.424
97 HB2 ALA 19 1HB ALA 19 1.291 -19.099 -11.228
98 HB3 ALA 19 2HB ALA 19 1.183 -19.107 -9.467
99 H GLY 20 H GLY 20 4.078 -16.471 -9.575
100 HA2 GLY 20 1HA GLY 20 6.077 -17.681 -10.551
101 HA3 GLY 20 2HA GLY 20 5.345 -17.314 -12.106
102 H GLU 21 H GLU 21 4.470 -14.675 -11.477
103 HA GLU 21 HA GLU 21 7.081 -13.321 -11.421
104 HB2 GLU 21 1HB GLU 21 4.462 -12.419 -12.631
105 HB3 GLU 21 2HB GLU 21 5.956 -11.493 -12.646
106 HG2 GLU 21 1HG GLU 21 5.571 -14.185 -13.935
107 HG3 GLU 21 2HG GLU 21 5.526 -12.634 -14.773
108 H VAL 22 H VAL 22 5.768 -14.056 -9.011
109 HA VAL 22 HA VAL 22 4.545 -11.629 -7.974
110 HB VAL 22 HB VAL 22 3.496 -13.606 -7.201
111 HG11 VAL 22 1HG1 VAL 22 5.118 -15.272 -7.668
112 HG12 VAL 22 2HG1 VAL 22 6.268 -14.568 -6.529
113 HG13 VAL 22 3HG1 VAL 22 4.802 -15.350 -5.935
114 HG21 VAL 22 3HG2 VAL 22 4.878 -13.400 -4.701
115 HG22 VAL 22 1HG2 VAL 22 4.727 -11.801 -5.431
116 HG23 VAL 22 2HG2 VAL 22 3.288 -12.780 -5.149
117 H GLN 23 H GLN 23 6.727 -10.566 -8.506
118 HA GLN 23 HA GLN 23 9.070 -11.014 -7.139
119 HB2 GLN 23 1HB GLN 23 7.815 -8.391 -7.952
120 HB3 GLN 23 2HB GLN 23 9.468 -8.542 -7.370
121 HG2 GLN 23 1HG GLN 23 9.830 -10.190 -9.260
122 HG3 GLN 23 2HG GLN 23 8.280 -9.643 -9.895
123 HE21 GLN 23 1HE2 GLN 23 11.539 -9.190 -10.021
124 HE22 GLN 23 2HE2 GLN 23 11.582 -7.593 -10.676
125 HA PRO 24 HA PRO 24 8.407 -10.126 -2.894
126 HB2 PRO 24 1HB PRO 24 10.790 -9.028 -2.198
127 HB3 PRO 24 2HB PRO 24 10.590 -10.750 -2.542
128 HG2 PRO 24 1HG PRO 24 11.635 -8.574 -4.312
129 HG3 PRO 24 2HG PRO 24 12.252 -10.220 -4.080
130 HD2 PRO 24 1HD PRO 24 10.736 -9.519 -6.211
131 HD3 PRO 24 2HD PRO 24 10.683 -11.142 -5.494
132 H ALA 25 H ALA 25 6.838 -8.552 -2.764
133 HA ALA 25 HA ALA 25 7.045 -5.889 -3.535
134 HB1 ALA 25 3HB ALA 25 4.916 -5.933 -2.922
135 HB2 ALA 25 1HB ALA 25 5.166 -7.504 -2.161
136 HB3 ALA 25 2HB ALA 25 5.394 -6.024 -1.227
137 H ARG 26 H ARG 26 8.966 -4.922 -2.948
138 HA ARG 26 HA ARG 26 10.058 -4.986 -0.341
139 HB2 ARG 26 1HB ARG 26 10.503 -3.237 -2.744
140 HB3 ARG 26 2HB ARG 26 11.303 -2.891 -1.216
141 HG2 ARG 26 1HG ARG 26 12.330 -5.108 -1.250
142 HG3 ARG 26 2HG ARG 26 11.530 -5.451 -2.785
143 HD2 ARG 26 1HD ARG 26 13.312 -3.062 -2.452
144 HD3 ARG 26 2HD ARG 26 13.975 -4.652 -2.827
145 HE ARG 26 HE ARG 26 12.122 -4.393 -4.728
146 HH11 ARG 26 2HH1 ARG 26 14.554 -2.179 -3.587
147 HH12 ARG 26 1HH1 ARG 26 14.740 -1.390 -5.119
148 HH21 ARG 26 2HH2 ARG 26 12.357 -3.363 -6.749
149 HH22 ARG 26 1HH2 ARG 26 13.490 -2.064 -6.916
150 H TYR 27 H TYR 27 7.758 -2.878 -1.928
151 HA TYR 27 HA TYR 27 7.639 -1.185 0.471
152 HB2 TYR 27 1HB TYR 27 6.133 -0.503 -2.012
153 HB3 TYR 27 2HB TYR 27 6.903 0.560 -0.839
154 HD1 TYR 27 1HD TYR 27 9.412 0.790 -0.873
155 HD2 TYR 27 2HD TYR 27 7.258 -1.164 -3.979
156 HE1 TYR 27 1HE TYR 27 11.350 1.040 -2.367
157 HE2 TYR 27 2HE TYR 27 9.191 -0.921 -5.480
158 HH TYR 27 HH TYR 27 11.174 0.538 -5.706
159 H THR 28 H THR 28 5.174 -0.191 0.456
160 HA THR 28 HA THR 28 3.148 -2.187 0.070
161 HB THR 28 HB THR 28 3.389 -1.389 2.933
162 HG1 THR 28 1HG THR 28 5.137 -2.532 3.231
163 HG21 THR 28 3HG2 THR 28 1.481 -2.714 1.810
164 HG22 THR 28 1HG2 THR 28 2.135 -3.320 3.331
165 HG23 THR 28 2HG2 THR 28 2.618 -4.062 1.806
166 H CYS 29 H CYS 29 1.065 -1.361 0.239
167 HA CYS 29 HA CYS 29 0.758 1.396 -0.195
168 HB2 CYS 29 1HB CYS 29 -0.799 -0.686 -0.728
169 HB3 CYS 29 2HB CYS 29 -1.551 -0.216 0.793
170 HA PRO 30 HA PRO 30 0.979 2.737 4.055
171 HB2 PRO 30 1HB PRO 30 0.622 5.374 3.518
172 HB3 PRO 30 2HB PRO 30 2.161 4.542 3.265
173 HG2 PRO 30 1HG PRO 30 0.031 5.233 1.278
174 HG3 PRO 30 2HG PRO 30 1.792 5.374 1.124
175 HD2 PRO 30 1HD PRO 30 0.394 3.323 0.041
176 HD3 PRO 30 2HD PRO 30 2.054 3.135 0.641
177 H ARG 31 H ARG 31 -1.658 2.447 2.101
178 HA ARG 31 HA ARG 31 -3.453 3.732 4.052
179 HB2 ARG 31 1HB ARG 31 -3.593 3.392 1.098
180 HB3 ARG 31 2HB ARG 31 -5.103 3.329 1.996
181 HG2 ARG 31 1HG ARG 31 -4.931 5.558 1.403
182 HG3 ARG 31 2HG ARG 31 -4.313 5.538 3.056
183 HD2 ARG 31 1HD ARG 31 -2.357 5.133 0.868
184 HD3 ARG 31 2HD ARG 31 -3.036 6.749 1.052
185 HE ARG 31 HE ARG 31 -1.121 5.494 2.749
186 HH11 ARG 31 2HH1 ARG 31 -3.774 7.747 2.709
187 HH12 ARG 31 1HH1 ARG 31 -3.228 8.616 4.105
188 HH21 ARG 31 2HH2 ARG 31 -0.391 6.630 4.588
189 HH22 ARG 31 1HH2 ARG 31 -1.303 7.981 5.172
190 H CYS 32 H CYS 32 -3.101 0.888 1.949
191 HA CYS 32 HA CYS 32 -4.816 -0.600 3.829
192 HB2 CYS 32 1HB CYS 32 -5.672 -1.903 2.040
193 HB3 CYS 32 2HB CYS 32 -5.738 -0.232 1.489
194 H ASN 33 H ASN 33 -1.883 -0.182 3.839
195 HA ASN 33 HA ASN 33 0.102 -1.384 3.758
196 HB2 ASN 33 1HB ASN 33 -1.649 -3.259 5.361
197 HB3 ASN 33 2HB ASN 33 0.099 -3.080 5.487
198 HD21 ASN 33 1HD2 ASN 33 -1.467 -2.860 7.700
199 HD22 ASN 33 2HD2 ASN 33 -1.484 -1.222 8.250
200 H ALA 34 H ALA 34 -0.792 -1.820 1.339
201 HA ALA 34 HA ALA 34 -0.920 -4.727 0.928
202 HB1 ALA 34 3HB ALA 34 -1.426 -3.844 -1.507
203 HB2 ALA 34 1HB ALA 34 -2.683 -3.913 -0.272
204 HB3 ALA 34 2HB ALA 34 -1.879 -2.384 -0.629
205 HA PRO 35 HA PRO 35 3.397 -4.364 -0.212
206 HB2 PRO 35 1HB PRO 35 3.778 -7.028 -0.572
207 HB3 PRO 35 2HB PRO 35 3.739 -6.271 1.025
208 HG2 PRO 35 1HG PRO 35 1.578 -7.754 -0.422
209 HG3 PRO 35 2HG PRO 35 2.052 -7.851 1.284
210 HD2 PRO 35 1HD PRO 35 -0.088 -6.419 0.446
211 HD3 PRO 35 2HD PRO 35 0.894 -5.938 1.845
212 H TYR 36 H TYR 36 3.665 -3.521 -2.199
213 HA TYR 36 HA TYR 36 2.802 -5.130 -4.512
214 HB2 TYR 36 1HB TYR 36 2.750 -3.003 -5.780
215 HB3 TYR 36 2HB TYR 36 1.629 -3.005 -4.423
216 HD1 TYR 36 2HD TYR 36 4.893 -1.728 -5.602
217 HD2 TYR 36 1HD TYR 36 1.824 -1.416 -2.671
218 HE1 TYR 36 2HE TYR 36 5.901 0.359 -4.777
219 HE2 TYR 36 1HE TYR 36 2.823 0.672 -1.839
220 HH TYR 36 HH TYR 36 5.683 2.086 -3.391
221 H CYS 37 H CYS 37 4.241 -5.562 -6.132
222 HA CYS 37 HA CYS 37 7.001 -5.540 -5.482
223 HB2 CYS 37 1HB CYS 37 7.301 -6.411 -7.804
224 HB3 CYS 37 2HB CYS 37 6.118 -7.311 -6.859
225 H SER 38 H SER 38 5.068 -3.701 -7.826
226 HA SER 38 HA SER 38 7.046 -1.563 -7.728
227 HB2 SER 38 1HB SER 38 7.886 -2.718 -9.620
228 HB3 SER 38 2HB SER 38 6.267 -3.041 -10.240
229 HG SER 38 HG SER 38 6.137 -1.043 -11.003
230 H LEU 39 H LEU 39 6.248 0.469 -8.484
231 HA LEU 39 HA LEU 39 3.869 1.324 -7.630
232 HB2 LEU 39 1HB LEU 39 5.763 2.593 -8.852
233 HB3 LEU 39 2HB LEU 39 4.804 2.305 -10.302
234 HG LEU 39 HG LEU 39 4.436 4.543 -9.370
235 HD11 LEU 39 1HD1 LEU 39 1.841 3.320 -8.784
236 HD12 LEU 39 2HD1 LEU 39 2.563 2.806 -10.308
237 HD13 LEU 39 3HD1 LEU 39 2.287 4.520 -9.998
238 HD21 LEU 39 3HD2 LEU 39 3.249 3.130 -6.986
239 HD22 LEU 39 1HD2 LEU 39 3.375 4.870 -7.244
240 HD23 LEU 39 2HD2 LEU 39 4.833 3.908 -6.999
241 H ARG 40 H ARG 40 4.402 -0.367 -10.664
242 HA ARG 40 HA ARG 40 2.014 0.024 -11.967
243 HB2 ARG 40 1HB ARG 40 2.367 -2.179 -13.004
244 HB3 ARG 40 2HB ARG 40 3.850 -1.237 -12.949
245 HG2 ARG 40 1HG ARG 40 4.446 -2.517 -10.861
246 HG3 ARG 40 2HG ARG 40 3.083 -3.576 -11.229
247 HD2 ARG 40 1HD ARG 40 4.955 -4.648 -12.155
248 HD3 ARG 40 2HD ARG 40 4.145 -3.881 -13.520
249 HE ARG 40 HE ARG 40 5.933 -2.016 -12.842
250 HH11 ARG 40 2HH1 ARG 40 6.255 -5.452 -13.298
251 HH12 ARG 40 1HH1 ARG 40 7.903 -5.359 -13.827
252 HH21 ARG 40 2HH2 ARG 40 8.101 -1.880 -13.537
253 HH22 ARG 40 1HH2 ARG 40 8.952 -3.327 -13.961
254 H CYS 41 H CYS 41 2.728 -2.568 -9.624
255 HA CYS 41 HA CYS 41 0.030 -3.489 -9.541
256 HB2 CYS 41 1HB CYS 41 2.552 -4.099 -8.085
257 HB3 CYS 41 2HB CYS 41 1.040 -4.548 -7.303
258 H TYR 42 H TYR 42 1.923 -1.208 -7.680
259 HA TYR 42 HA TYR 42 0.342 -0.951 -5.412
260 HB2 TYR 42 1HB TYR 42 2.453 0.148 -5.456
261 HB3 TYR 42 2HB TYR 42 2.027 1.065 -6.896
262 HD1 TYR 42 1HD TYR 42 0.986 0.601 -3.343
263 HD2 TYR 42 2HD TYR 42 1.253 3.240 -6.669
264 HE1 TYR 42 1HE TYR 42 0.214 2.456 -1.925
265 HE2 TYR 42 2HE TYR 42 0.482 5.103 -5.260
266 HH TYR 42 HH TYR 42 -0.789 4.610 -2.096
267 H ARG 43 H ARG 43 -0.195 0.173 -8.654
268 HA ARG 43 HA ARG 43 -2.433 1.856 -7.829
269 HB2 ARG 43 1HB ARG 43 -0.956 1.442 -10.407
270 HB3 ARG 43 2HB ARG 43 -2.550 2.184 -10.412
271 HG2 ARG 43 1HG ARG 43 -1.767 3.959 -8.968
272 HG3 ARG 43 2HG ARG 43 -0.181 3.193 -8.852
273 HD2 ARG 43 1HD ARG 43 0.058 3.441 -11.310
274 HD3 ARG 43 2HD ARG 43 -1.469 4.322 -11.334
275 HE ARG 43 HE ARG 43 0.420 5.453 -9.510
276 HH11 ARG 43 2HH1 ARG 43 -0.530 5.303 -12.856
277 HH12 ARG 43 1HH1 ARG 43 0.150 6.846 -13.254
278 HH21 ARG 43 2HH2 ARG 43 1.319 7.486 -10.022
279 HH22 ARG 43 1HH2 ARG 43 1.202 8.087 -11.641
280 H THR 44 H THR 44 -1.758 -1.140 -9.534
281 HA THR 44 HA THR 44 -4.408 -1.585 -10.461
282 HB THR 44 HB THR 44 -2.142 -3.536 -10.012
283 HG1 THR 44 1HG THR 44 -2.731 -3.163 -12.571
284 HG21 THR 44 3HG2 THR 44 -3.963 -4.955 -10.068
285 HG22 THR 44 1HG2 THR 44 -3.575 -4.828 -11.783
286 HG23 THR 44 2HG2 THR 44 -4.901 -3.883 -11.107
287 H HIS 45 H HIS 45 -2.568 -3.073 -7.789
288 HA HIS 45 HA HIS 45 -4.287 -4.762 -6.656
289 HB2 HIS 45 1HB HIS 45 -3.178 -4.492 -4.653
290 HB3 HIS 45 2HB HIS 45 -2.039 -3.721 -5.753
291 HD1 HIS 45 1HD HIS 45 -1.521 -1.292 -5.359
292 HD2 HIS 45 2HD HIS 45 -4.741 -2.633 -3.102
293 HE1 HIS 45 1HE HIS 45 -2.048 0.578 -3.762
294 H GLY 46 H GLY 46 -4.432 -1.254 -6.010
295 HA2 GLY 46 1HA GLY 46 -7.294 -1.262 -6.021
296 HA3 GLY 46 2HA GLY 46 -6.648 -1.166 -4.389
297 H THR 47 H THR 47 -8.151 0.881 -5.072
298 HA THR 47 HA THR 47 -6.383 3.006 -6.060
299 HB THR 47 HB THR 47 -8.406 4.383 -6.261
300 HG1 THR 47 1HG THR 47 -9.491 2.260 -4.842
301 HG21 THR 47 3HG2 THR 47 -8.082 1.794 -7.638
302 HG22 THR 47 1HG2 THR 47 -8.191 3.425 -8.300
303 HG23 THR 47 2HG2 THR 47 -9.657 2.567 -7.825
304 H CYS 48 H CYS 48 -5.143 3.201 -4.140
305 HA CYS 48 HA CYS 48 -6.597 4.430 -1.890
306 HB2 CYS 48 1HB CYS 48 -3.940 2.997 -1.742
307 HB3 CYS 48 2HB CYS 48 -4.907 3.583 -0.392
308 H ALA 49 H ALA 49 -4.030 4.721 -4.186
309 HA ALA 49 HA ALA 49 -2.632 6.853 -2.907
310 HB1 ALA 49 3HB ALA 49 -1.923 7.149 -5.477
311 HB2 ALA 49 1HB ALA 49 -1.228 5.925 -4.414
312 HB3 ALA 49 2HB ALA 49 -2.529 5.494 -5.525
313 H GLU 50 H GLU 50 -5.389 6.644 -5.026
314 HA GLU 50 HA GLU 50 -5.487 9.186 -6.107
315 HB2 GLU 50 1HB GLU 50 -7.535 7.158 -5.365
316 HB3 GLU 50 2HB GLU 50 -8.097 8.783 -5.732
317 HG2 GLU 50 1HG GLU 50 -6.219 7.476 -7.626
318 HG3 GLU 50 2HG GLU 50 -7.898 6.939 -7.593
319 H ASN 51 H ASN 51 -6.827 8.094 -2.995
320 HA ASN 51 HA ASN 51 -7.379 10.856 -2.244
321 HB2 ASN 51 1HB ASN 51 -8.022 8.201 -0.960
322 HB3 ASN 51 2HB ASN 51 -8.327 9.739 -0.158
323 HD21 ASN 51 1HD2 ASN 51 -10.313 10.444 -0.360
324 HD22 ASN 51 2HD2 ASN 51 -11.374 10.149 -1.691
325 H PHE 52 H PHE 52 -4.635 10.050 -2.551
326 HA PHE 52 HA PHE 52 -3.713 10.416 0.222
327 HB2 PHE 52 1HB PHE 52 -2.951 8.265 -0.241
328 HB3 PHE 52 2HB PHE 52 -2.658 8.626 -1.938
329 HD1 PHE 52 2HD PHE 52 -1.506 10.177 1.256
330 HD2 PHE 52 1HD PHE 52 -0.440 8.365 -2.445
331 HE1 PHE 52 2HE PHE 52 0.871 10.564 1.755
332 HE2 PHE 52 1HE PHE 52 1.940 8.749 -1.952
333 HZ PHE 52 HZ PHE 52 2.598 9.851 0.150
334 H TYR 53 H TYR 53 -3.825 12.701 -0.222
335 HA TYR 53 HA TYR 53 -1.425 13.647 -1.618
336 HB2 TYR 53 1HB TYR 53 -4.255 14.472 -2.124
337 HB3 TYR 53 2HB TYR 53 -2.978 15.674 -2.276
338 HD1 TYR 53 1HD TYR 53 -1.057 15.177 -3.876
339 HD2 TYR 53 2HD TYR 53 -4.687 12.958 -3.862
340 HE1 TYR 53 1HE TYR 53 -0.569 14.377 -6.150
341 HE2 TYR 53 2HE TYR 53 -4.209 12.150 -6.135
342 HH TYR 53 HH TYR 53 -2.110 13.506 -8.163
343 H SER 54 H SER 54 -0.259 14.974 -0.398
344 HA SER 54 HA SER 54 -1.567 16.254 1.911
345 HB2 SER 54 1HB SER 54 0.295 14.451 2.229
346 HB3 SER 54 2HB SER 54 1.392 15.755 1.775
347 HG SER 54 HG SER 54 0.698 16.930 3.530
348 H GLY 55 H GLY 55 -1.670 17.508 -0.563
349 HA2 GLY 55 1HA GLY 55 0.282 19.703 -0.225
350 HA3 GLY 55 2HA GLY 55 -0.350 19.202 -1.787
351 HA PRO 56 HA PRO 56 -2.840 22.795 -0.124
352 HB2 PRO 56 1HB PRO 56 -2.491 24.392 -2.291
353 HB3 PRO 56 2HB PRO 56 -1.372 24.371 -0.923
354 HG2 PRO 56 1HG PRO 56 -1.145 23.004 -3.577
355 HG3 PRO 56 2HG PRO 56 0.097 23.873 -2.656
356 HD2 PRO 56 1HD PRO 56 -0.077 21.171 -2.678
357 HD3 PRO 56 2HD PRO 56 0.500 22.079 -1.266
358 H SER 57 H SER 57 -2.891 20.603 -2.684
359 HA SER 57 HA SER 57 -5.735 20.975 -3.046
360 HB2 SER 57 1HB SER 57 -4.468 22.485 -4.730
361 HB3 SER 57 2HB SER 57 -4.063 20.976 -5.548
362 HG SER 57 HG SER 57 -6.727 21.325 -4.858
363 H SER 58 H SER 58 -6.772 19.162 -3.929
364 HA SER 58 HA SER 58 -5.077 16.822 -4.460
365 HB2 SER 58 1HB SER 58 -5.873 16.759 -2.096
366 HB3 SER 58 2HB SER 58 -7.533 16.768 -2.691
367 HG SER 58 HG SER 58 -6.953 14.816 -3.859
368 H GLY 59 H GLY 59 -5.573 17.169 -6.679
369 HA2 GLY 59 1HA GLY 59 -6.871 15.925 -8.327
370 HA3 GLY 59 2HA GLY 59 -8.305 16.295 -7.381
Start of MODEL 8
1 H1 GLY 1 1H GLY 1 8.195 -24.585 5.310
2 HA2 GLY 1 1HA GLY 1 7.608 -21.750 4.993
3 HA3 GLY 1 2HA GLY 1 7.179 -22.456 6.544
4 H SER 2 H SER 2 9.959 -22.504 4.307
5 HA SER 2 HA SER 2 11.689 -21.932 6.621
6 HB2 SER 2 1HB SER 2 12.283 -23.826 4.334
7 HB3 SER 2 2HB SER 2 13.422 -23.381 5.604
8 HG SER 2 HG SER 2 12.238 -24.478 7.070
9 H SER 3 H SER 3 13.382 -20.529 6.290
10 HA SER 3 HA SER 3 13.556 -19.293 3.621
11 HB2 SER 3 1HB SER 3 13.688 -17.121 4.567
12 HB3 SER 3 2HB SER 3 12.351 -17.910 5.404
13 HG SER 3 HG SER 3 14.893 -17.224 6.344
14 H GLY 4 H GLY 4 15.626 -17.903 3.469
15 HA2 GLY 4 1HA GLY 4 17.852 -19.108 4.952
16 HA3 GLY 4 2HA GLY 4 17.865 -19.221 3.198
17 H SER 5 H SER 5 17.390 -16.746 5.723
18 HA SER 5 HA SER 5 19.505 -15.134 4.627
19 HB2 SER 5 1HB SER 5 16.664 -14.091 4.510
20 HB3 SER 5 2HB SER 5 18.118 -13.170 4.127
21 HG SER 5 HG SER 5 16.914 -14.179 2.317
22 H SER 6 H SER 6 20.519 -14.333 6.331
23 HA SER 6 HA SER 6 19.222 -14.225 8.906
24 HB2 SER 6 1HB SER 6 22.033 -13.499 8.048
25 HB3 SER 6 2HB SER 6 21.467 -13.506 9.718
26 HG SER 6 HG SER 6 22.564 -15.473 8.859
27 H GLY 7 H GLY 7 20.803 -11.867 6.752
28 HA2 GLY 7 1HA GLY 7 19.585 -9.698 8.316
29 HA3 GLY 7 2HA GLY 7 20.911 -9.520 7.177
30 H MET 8 H MET 8 17.492 -10.526 7.246
31 HA MET 8 HA MET 8 17.172 -9.494 4.529
32 HB2 MET 8 1HB MET 8 16.300 -11.784 5.326
33 HB3 MET 8 2HB MET 8 15.039 -10.871 6.144
34 HG2 MET 8 1HG MET 8 14.349 -9.910 4.006
35 HG3 MET 8 2HG MET 8 15.609 -10.832 3.189
36 HE1 MET 8 3HE MET 8 12.863 -13.012 1.822
37 HE2 MET 8 1HE MET 8 12.698 -11.264 1.981
38 HE3 MET 8 2HE MET 8 14.255 -11.965 1.542
39 H GLU 9 H GLU 9 15.295 -8.152 4.020
40 HA GLU 9 HA GLU 9 14.819 -6.197 6.152
41 HB2 GLU 9 1HB GLU 9 14.694 -6.054 3.153
42 HB3 GLU 9 2HB GLU 9 13.913 -4.834 4.149
43 HG2 GLU 9 1HG GLU 9 16.767 -5.489 4.663
44 HG3 GLU 9 2HG GLU 9 16.353 -4.504 3.261
45 HA PRO 10 HA PRO 10 10.578 -7.222 6.618
46 HB2 PRO 10 1HB PRO 10 9.480 -4.782 7.077
47 HB3 PRO 10 2HB PRO 10 10.490 -5.619 8.262
48 HG2 PRO 10 1HG PRO 10 11.225 -3.433 6.353
49 HG3 PRO 10 2HG PRO 10 11.670 -3.626 8.059
50 HD2 PRO 10 1HD PRO 10 13.352 -4.261 6.034
51 HD3 PRO 10 2HD PRO 10 13.349 -5.132 7.581
52 H ALA 11 H ALA 11 9.422 -7.910 4.926
53 HA ALA 11 HA ALA 11 7.890 -6.126 3.350
54 HB1 ALA 11 3HB ALA 11 10.441 -6.348 2.392
55 HB2 ALA 11 1HB ALA 11 9.581 -7.569 1.454
56 HB3 ALA 11 2HB ALA 11 9.029 -5.894 1.438
57 H GLY 12 H GLY 12 7.098 -7.527 1.256
58 HA2 GLY 12 1HA GLY 12 6.696 -10.314 2.045
59 HA3 GLY 12 2HA GLY 12 5.266 -9.300 1.930
60 HA PRO 13 HA PRO 13 6.720 -11.100 -2.267
61 HB2 PRO 13 1HB PRO 13 5.121 -13.290 -2.409
62 HB3 PRO 13 2HB PRO 13 6.756 -13.336 -1.738
63 HG2 PRO 13 1HG PRO 13 4.128 -13.175 -0.314
64 HG3 PRO 13 2HG PRO 13 5.551 -14.160 0.072
65 HD2 PRO 13 1HD PRO 13 4.981 -11.851 1.367
66 HD3 PRO 13 2HD PRO 13 6.645 -12.404 1.089
67 H CYS 14 H CYS 14 5.725 -9.628 -3.524
68 HA CYS 14 HA CYS 14 3.160 -8.662 -3.360
69 HB2 CYS 14 1HB CYS 14 4.805 -7.607 -4.782
70 HB3 CYS 14 2HB CYS 14 4.882 -9.030 -5.817
71 H GLY 15 H GLY 15 1.405 -9.925 -3.180
72 HA2 GLY 15 1HA GLY 15 1.140 -12.370 -4.700
73 HA3 GLY 15 2HA GLY 15 -0.029 -11.713 -3.564
74 H PHE 16 H PHE 16 0.000 -9.083 -4.943
75 HA PHE 16 HA PHE 16 -2.231 -9.360 -6.539
76 HB2 PHE 16 1HB PHE 16 -0.141 -7.219 -6.947
77 HB3 PHE 16 2HB PHE 16 -1.870 -7.106 -7.259
78 HD1 PHE 16 1HD PHE 16 -3.137 -8.070 -4.896
79 HD2 PHE 16 2HD PHE 16 0.431 -5.777 -5.259
80 HE1 PHE 16 1HE PHE 16 -3.487 -7.173 -2.632
81 HE2 PHE 16 2HE PHE 16 0.086 -4.878 -2.995
82 HZ PHE 16 HZ PHE 16 -1.874 -5.576 -1.678
83 H CYS 17 H CYS 17 1.122 -9.791 -7.364
84 HA CYS 17 HA CYS 17 0.917 -9.607 -10.165
85 HB2 CYS 17 1HB CYS 17 2.866 -10.766 -8.241
86 HB3 CYS 17 2HB CYS 17 2.958 -11.321 -9.909
87 HA PRO 18 HA PRO 18 -1.049 -13.322 -11.422
88 HB2 PRO 18 1HB PRO 18 0.315 -13.930 -13.689
89 HB3 PRO 18 2HB PRO 18 -0.823 -12.581 -13.585
90 HG2 PRO 18 1HG PRO 18 2.165 -12.557 -13.403
91 HG3 PRO 18 2HG PRO 18 1.088 -11.448 -14.271
92 HD2 PRO 18 1HD PRO 18 2.179 -10.837 -11.869
93 HD3 PRO 18 2HD PRO 18 0.579 -10.252 -12.368
94 H ALA 19 H ALA 19 -0.928 -15.439 -10.943
95 HA ALA 19 HA ALA 19 0.900 -16.664 -9.441
96 HB1 ALA 19 3HB ALA 19 -0.444 -18.070 -11.743
97 HB2 ALA 19 1HB ALA 19 0.142 -18.799 -10.248
98 HB3 ALA 19 2HB ALA 19 -1.223 -17.683 -10.209
99 H GLY 20 H GLY 20 2.969 -17.266 -9.542
100 HA2 GLY 20 1HA GLY 20 4.824 -18.308 -10.625
101 HA3 GLY 20 2HA GLY 20 4.174 -17.785 -12.172
102 H GLU 21 H GLU 21 3.742 -15.105 -11.723
103 HA GLU 21 HA GLU 21 6.472 -14.126 -11.748
104 HB2 GLU 21 1HB GLU 21 3.901 -12.603 -12.201
105 HB3 GLU 21 2HB GLU 21 5.527 -12.052 -12.580
106 HG2 GLU 21 1HG GLU 21 5.655 -14.094 -14.117
107 HG3 GLU 21 2HG GLU 21 3.904 -14.170 -13.935
108 H VAL 22 H VAL 22 5.747 -14.999 -9.225
109 HA VAL 22 HA VAL 22 4.853 -12.810 -7.597
110 HB VAL 22 HB VAL 22 6.152 -15.425 -6.820
111 HG11 VAL 22 1HG1 VAL 22 5.234 -13.095 -5.242
112 HG12 VAL 22 2HG1 VAL 22 4.826 -14.695 -4.619
113 HG13 VAL 22 3HG1 VAL 22 6.512 -14.263 -4.905
114 HG21 VAL 22 3HG2 VAL 22 3.259 -14.665 -6.532
115 HG22 VAL 22 1HG2 VAL 22 3.885 -15.446 -7.984
116 HG23 VAL 22 2HG2 VAL 22 3.991 -16.266 -6.426
117 H GLN 23 H GLN 23 6.050 -11.135 -7.008
118 HA GLN 23 HA GLN 23 8.967 -11.494 -6.797
119 HB2 GLN 23 1HB GLN 23 7.382 -9.092 -7.707
120 HB3 GLN 23 2HB GLN 23 9.095 -9.026 -7.314
121 HG2 GLN 23 1HG GLN 23 9.423 -10.837 -9.049
122 HG3 GLN 23 2HG GLN 23 7.761 -10.524 -9.545
123 HE21 GLN 23 1HE2 GLN 23 9.866 -10.216 -11.285
124 HE22 GLN 23 2HE2 GLN 23 10.065 -8.540 -11.656
125 HA PRO 24 HA PRO 24 8.791 -10.193 -2.610
126 HB2 PRO 24 1HB PRO 24 11.147 -8.868 -2.365
127 HB3 PRO 24 2HB PRO 24 11.045 -10.627 -2.504
128 HG2 PRO 24 1HG PRO 24 11.669 -8.594 -4.611
129 HG3 PRO 24 2HG PRO 24 12.443 -10.160 -4.302
130 HD2 PRO 24 1HD PRO 24 10.609 -9.802 -6.263
131 HD3 PRO 24 2HD PRO 24 10.782 -11.336 -5.385
132 H ALA 25 H ALA 25 7.136 -8.722 -2.407
133 HA ALA 25 HA ALA 25 7.171 -6.094 -3.441
134 HB1 ALA 25 3HB ALA 25 5.281 -7.695 -2.286
135 HB2 ALA 25 1HB ALA 25 5.546 -6.472 -1.042
136 HB3 ALA 25 2HB ALA 25 5.073 -5.987 -2.671
137 H ARG 26 H ARG 26 9.083 -5.063 -2.875
138 HA ARG 26 HA ARG 26 10.045 -4.904 -0.206
139 HB2 ARG 26 1HB ARG 26 10.670 -3.453 -2.757
140 HB3 ARG 26 2HB ARG 26 11.357 -2.905 -1.233
141 HG2 ARG 26 1HG ARG 26 12.394 -5.083 -0.901
142 HG3 ARG 26 2HG ARG 26 11.686 -5.655 -2.413
143 HD2 ARG 26 1HD ARG 26 13.012 -4.199 -3.705
144 HD3 ARG 26 2HD ARG 26 13.473 -3.244 -2.296
145 HE ARG 26 HE ARG 26 14.473 -5.683 -1.723
146 HH11 ARG 26 2HH1 ARG 26 14.713 -3.615 -4.513
147 HH12 ARG 26 1HH1 ARG 26 16.288 -4.180 -4.959
148 HH21 ARG 26 2HH2 ARG 26 16.548 -6.435 -2.300
149 HH22 ARG 26 1HH2 ARG 26 17.331 -5.785 -3.700
150 H TYR 27 H TYR 27 7.674 -3.159 -2.001
151 HA TYR 27 HA TYR 27 7.550 -1.095 0.093
152 HB2 TYR 27 1HB TYR 27 6.132 -0.938 -2.557
153 HB3 TYR 27 2HB TYR 27 6.562 0.371 -1.462
154 HD1 TYR 27 1HD TYR 27 9.110 0.778 -1.111
155 HD2 TYR 27 2HD TYR 27 7.482 -1.385 -4.393
156 HE1 TYR 27 1HE TYR 27 11.174 1.176 -2.389
157 HE2 TYR 27 2HE TYR 27 9.541 -0.995 -5.680
158 HH TYR 27 HH TYR 27 12.388 0.330 -4.235
159 H THR 28 H THR 28 5.154 -0.212 0.226
160 HA THR 28 HA THR 28 3.098 -2.204 -0.004
161 HB THR 28 HB THR 28 3.510 -1.330 2.819
162 HG1 THR 28 1HG THR 28 5.542 -2.212 2.162
163 HG21 THR 28 3HG2 THR 28 2.313 -3.305 3.336
164 HG22 THR 28 1HG2 THR 28 2.581 -3.980 1.730
165 HG23 THR 28 2HG2 THR 28 1.496 -2.605 1.939
166 H CYS 29 H CYS 29 1.091 -1.308 -0.002
167 HA CYS 29 HA CYS 29 0.821 1.464 -0.320
168 HB2 CYS 29 1HB CYS 29 -0.723 -0.356 -1.191
169 HB3 CYS 29 2HB CYS 29 -1.419 -0.417 0.425
170 HA PRO 30 HA PRO 30 0.894 2.579 4.009
171 HB2 PRO 30 1HB PRO 30 0.710 5.254 3.583
172 HB3 PRO 30 2HB PRO 30 2.216 4.350 3.381
173 HG2 PRO 30 1HG PRO 30 0.253 5.249 1.307
174 HG3 PRO 30 2HG PRO 30 2.025 5.298 1.266
175 HD2 PRO 30 1HD PRO 30 0.591 3.381 0.001
176 HD3 PRO 30 2HD PRO 30 2.199 3.074 0.689
177 H ARG 31 H ARG 31 -1.634 2.403 1.965
178 HA ARG 31 HA ARG 31 -3.474 3.790 3.799
179 HB2 ARG 31 1HB ARG 31 -3.472 3.408 0.850
180 HB3 ARG 31 2HB ARG 31 -5.031 3.394 1.664
181 HG2 ARG 31 1HG ARG 31 -3.083 5.607 2.158
182 HG3 ARG 31 2HG ARG 31 -4.116 5.614 0.727
183 HD2 ARG 31 1HD ARG 31 -5.342 6.827 2.291
184 HD3 ARG 31 2HD ARG 31 -6.047 5.213 2.376
185 HE ARG 31 HE ARG 31 -3.932 5.709 4.277
186 HH11 ARG 31 2HH1 ARG 31 -7.353 5.844 3.647
187 HH12 ARG 31 1HH1 ARG 31 -7.795 5.811 5.322
188 HH21 ARG 31 2HH2 ARG 31 -4.501 5.665 6.485
189 HH22 ARG 31 1HH2 ARG 31 -6.172 5.710 6.935
190 H CYS 32 H CYS 32 -2.817 0.811 2.061
191 HA CYS 32 HA CYS 32 -4.724 -0.563 3.821
192 HB2 CYS 32 1HB CYS 32 -5.590 -1.897 2.031
193 HB3 CYS 32 2HB CYS 32 -5.709 -0.213 1.532
194 H ASN 33 H ASN 33 -1.794 -0.240 3.832
195 HA ASN 33 HA ASN 33 0.158 -1.491 3.764
196 HB2 ASN 33 1HB ASN 33 -1.534 -3.480 5.266
197 HB3 ASN 33 2HB ASN 33 0.154 -3.055 5.533
198 HD21 ASN 33 1HD2 ASN 33 0.612 -1.581 7.018
199 HD22 ASN 33 2HD2 ASN 33 -0.539 -0.559 7.804
200 H ALA 34 H ALA 34 -0.722 -1.863 1.328
201 HA ALA 34 HA ALA 34 -0.938 -4.754 0.861
202 HB1 ALA 34 3HB ALA 34 -1.272 -3.667 -1.590
203 HB2 ALA 34 1HB ALA 34 -2.588 -3.975 -0.456
204 HB3 ALA 34 2HB ALA 34 -1.880 -2.363 -0.570
205 HA PRO 35 HA PRO 35 3.437 -4.467 -0.133
206 HB2 PRO 35 1HB PRO 35 3.800 -7.149 -0.342
207 HB3 PRO 35 2HB PRO 35 3.734 -6.307 1.210
208 HG2 PRO 35 1HG PRO 35 1.590 -7.847 -0.201
209 HG3 PRO 35 2HG PRO 35 2.028 -7.856 1.517
210 HD2 PRO 35 1HD PRO 35 -0.080 -6.454 0.558
211 HD3 PRO 35 2HD PRO 35 0.876 -5.907 1.950
212 H TYR 36 H TYR 36 3.740 -3.726 -2.158
213 HA TYR 36 HA TYR 36 3.001 -5.501 -4.392
214 HB2 TYR 36 1HB TYR 36 2.878 -3.402 -5.773
215 HB3 TYR 36 2HB TYR 36 1.635 -3.540 -4.535
216 HD1 TYR 36 2HD TYR 36 4.815 -1.864 -5.403
217 HD2 TYR 36 1HD TYR 36 1.453 -1.935 -2.797
218 HE1 TYR 36 2HE TYR 36 5.464 0.336 -4.515
219 HE2 TYR 36 1HE TYR 36 2.092 0.265 -1.902
220 HH TYR 36 HH TYR 36 5.007 1.586 -2.180
221 H CYS 37 H CYS 37 4.469 -5.758 -6.070
222 HA CYS 37 HA CYS 37 7.205 -5.626 -5.368
223 HB2 CYS 37 1HB CYS 37 7.611 -6.382 -7.694
224 HB3 CYS 37 2HB CYS 37 6.388 -7.347 -6.873
225 H SER 38 H SER 38 5.264 -3.774 -7.702
226 HA SER 38 HA SER 38 7.176 -1.572 -7.454
227 HB2 SER 38 1HB SER 38 7.470 -3.150 -9.575
228 HB3 SER 38 2HB SER 38 6.150 -2.159 -10.194
229 HG SER 38 HG SER 38 8.103 -1.200 -10.736
230 H LEU 39 H LEU 39 6.175 0.270 -9.077
231 HA LEU 39 HA LEU 39 3.846 1.154 -7.766
232 HB2 LEU 39 1HB LEU 39 5.718 2.404 -9.154
233 HB3 LEU 39 2HB LEU 39 4.545 2.215 -10.455
234 HG LEU 39 HG LEU 39 2.939 3.282 -8.610
235 HD11 LEU 39 1HD1 LEU 39 4.255 5.133 -7.510
236 HD12 LEU 39 2HD1 LEU 39 5.708 4.216 -7.904
237 HD13 LEU 39 3HD1 LEU 39 4.487 3.518 -6.841
238 HD21 LEU 39 3HD2 LEU 39 3.077 4.263 -10.729
239 HD22 LEU 39 1HD2 LEU 39 4.795 4.617 -10.553
240 HD23 LEU 39 2HD2 LEU 39 3.607 5.533 -9.626
241 H ARG 40 H ARG 40 4.355 -0.386 -10.904
242 HA ARG 40 HA ARG 40 1.923 -0.104 -12.107
243 HB2 ARG 40 1HB ARG 40 2.316 -2.453 -13.021
244 HB3 ARG 40 2HB ARG 40 3.588 -1.271 -13.299
245 HG2 ARG 40 1HG ARG 40 5.033 -2.275 -11.812
246 HG3 ARG 40 2HG ARG 40 3.731 -3.063 -10.919
247 HD2 ARG 40 1HD ARG 40 4.730 -3.776 -13.673
248 HD3 ARG 40 2HD ARG 40 4.951 -4.710 -12.194
249 HE ARG 40 HE ARG 40 2.716 -5.380 -12.302
250 HH11 ARG 40 2HH1 ARG 40 3.535 -3.193 -14.883
251 HH12 ARG 40 1HH1 ARG 40 2.122 -3.559 -15.817
252 HH21 ARG 40 2HH2 ARG 40 0.852 -5.871 -13.521
253 HH22 ARG 40 1HH2 ARG 40 0.596 -5.082 -15.040
254 H CYS 41 H CYS 41 2.755 -2.289 -9.469
255 HA CYS 41 HA CYS 41 0.094 -3.447 -9.435
256 HB2 CYS 41 1HB CYS 41 2.625 -3.918 -7.891
257 HB3 CYS 41 2HB CYS 41 1.095 -4.557 -7.299
258 H TYR 42 H TYR 42 1.803 -0.870 -7.943
259 HA TYR 42 HA TYR 42 0.301 -0.685 -5.542
260 HB2 TYR 42 1HB TYR 42 2.408 0.421 -5.603
261 HB3 TYR 42 2HB TYR 42 1.982 1.306 -7.064
262 HD1 TYR 42 1HD TYR 42 0.464 0.840 -3.671
263 HD2 TYR 42 2HD TYR 42 1.668 3.556 -6.718
264 HE1 TYR 42 1HE TYR 42 -0.320 2.722 -2.295
265 HE2 TYR 42 2HE TYR 42 0.888 5.445 -5.350
266 HH TYR 42 HH TYR 42 0.287 6.045 -3.209
267 H ARG 43 H ARG 43 -0.319 0.221 -8.806
268 HA ARG 43 HA ARG 43 -2.531 1.972 -8.025
269 HB2 ARG 43 1HB ARG 43 -1.053 1.486 -10.587
270 HB3 ARG 43 2HB ARG 43 -2.664 2.191 -10.628
271 HG2 ARG 43 1HG ARG 43 -1.974 4.096 -9.429
272 HG3 ARG 43 2HG ARG 43 -0.451 3.340 -8.959
273 HD2 ARG 43 1HD ARG 43 0.053 4.882 -10.690
274 HD3 ARG 43 2HD ARG 43 0.147 3.270 -11.398
275 HE ARG 43 HE ARG 43 -2.416 4.545 -11.708
276 HH11 ARG 43 2HH1 ARG 43 0.767 4.116 -13.051
277 HH12 ARG 43 1HH1 ARG 43 0.281 4.512 -14.667
278 HH21 ARG 43 2HH2 ARG 43 -3.068 5.068 -13.830
279 HH22 ARG 43 1HH2 ARG 43 -1.901 5.054 -15.108
280 H THR 44 H THR 44 -1.848 -1.131 -9.471
281 HA THR 44 HA THR 44 -4.526 -1.602 -10.384
282 HB THR 44 HB THR 44 -2.211 -3.506 -9.992
283 HG1 THR 44 1HG THR 44 -2.463 -1.685 -11.754
284 HG21 THR 44 3HG2 THR 44 -3.599 -4.951 -11.571
285 HG22 THR 44 1HG2 THR 44 -4.962 -3.919 -11.140
286 HG23 THR 44 2HG2 THR 44 -4.139 -4.860 -9.895
287 H HIS 45 H HIS 45 -2.560 -3.018 -7.764
288 HA HIS 45 HA HIS 45 -4.204 -4.714 -6.538
289 HB2 HIS 45 1HB HIS 45 -3.034 -4.383 -4.574
290 HB3 HIS 45 2HB HIS 45 -1.942 -3.638 -5.738
291 HD1 HIS 45 1HD HIS 45 -1.545 -1.133 -5.543
292 HD2 HIS 45 2HD HIS 45 -4.424 -2.552 -2.904
293 HE1 HIS 45 1HE HIS 45 -1.991 0.762 -3.952
294 H GLY 46 H GLY 46 -4.378 -1.200 -5.923
295 HA2 GLY 46 1HA GLY 46 -7.241 -1.259 -5.826
296 HA3 GLY 46 2HA GLY 46 -6.529 -1.118 -4.225
297 H THR 47 H THR 47 -8.183 0.846 -5.263
298 HA THR 47 HA THR 47 -6.435 2.993 -6.193
299 HB THR 47 HB THR 47 -8.507 4.308 -6.449
300 HG1 THR 47 1HG THR 47 -10.439 2.654 -6.258
301 HG21 THR 47 3HG2 THR 47 -9.524 2.943 -8.248
302 HG22 THR 47 1HG2 THR 47 -8.586 1.557 -7.692
303 HG23 THR 47 2HG2 THR 47 -7.763 2.979 -8.333
304 H CYS 48 H CYS 48 -5.255 3.131 -4.174
305 HA CYS 48 HA CYS 48 -6.768 4.492 -2.043
306 HB2 CYS 48 1HB CYS 48 -4.091 3.163 -1.666
307 HB3 CYS 48 2HB CYS 48 -5.267 3.621 -0.438
308 H ALA 49 H ALA 49 -4.221 4.742 -4.329
309 HA ALA 49 HA ALA 49 -2.927 6.986 -3.036
310 HB1 ALA 49 3HB ALA 49 -1.256 6.718 -4.534
311 HB2 ALA 49 1HB ALA 49 -1.988 5.125 -4.724
312 HB3 ALA 49 2HB ALA 49 -2.358 6.409 -5.876
313 H GLU 50 H GLU 50 -5.698 7.372 -3.530
314 HA GLU 50 HA GLU 50 -5.645 9.428 -5.640
315 HB2 GLU 50 1HB GLU 50 -7.972 9.113 -5.968
316 HB3 GLU 50 2HB GLU 50 -7.268 7.503 -5.896
317 HG2 GLU 50 1HG GLU 50 -9.058 7.178 -4.547
318 HG3 GLU 50 2HG GLU 50 -7.897 7.731 -3.341
319 H ASN 51 H ASN 51 -6.225 8.770 -2.287
320 HA ASN 51 HA ASN 51 -6.646 11.643 -1.837
321 HB2 ASN 51 1HB ASN 51 -8.382 11.280 -0.270
322 HB3 ASN 51 2HB ASN 51 -8.790 10.266 -1.651
323 HD21 ASN 51 1HD2 ASN 51 -8.842 10.315 1.555
324 HD22 ASN 51 2HD2 ASN 51 -8.624 8.638 1.910
325 H PHE 52 H PHE 52 -4.246 10.045 -1.676
326 HA PHE 52 HA PHE 52 -3.734 10.123 1.224
327 HB2 PHE 52 1HB PHE 52 -3.384 7.899 0.405
328 HB3 PHE 52 2HB PHE 52 -2.438 8.487 -0.958
329 HD1 PHE 52 1HD PHE 52 -0.179 9.454 -0.555
330 HD2 PHE 52 2HD PHE 52 -2.390 7.479 2.499
331 HE1 PHE 52 1HE PHE 52 1.884 9.183 0.758
332 HE2 PHE 52 2HE PHE 52 -0.330 7.206 3.817
333 HZ PHE 52 HZ PHE 52 1.810 8.059 2.948
334 H TYR 53 H TYR 53 -2.171 10.705 -1.921
335 HA TYR 53 HA TYR 53 0.064 12.075 -0.932
336 HB2 TYR 53 1HB TYR 53 0.452 12.786 -3.185
337 HB3 TYR 53 2HB TYR 53 -0.215 11.159 -3.258
338 HD1 TYR 53 1HD TYR 53 -2.560 10.817 -3.983
339 HD2 TYR 53 2HD TYR 53 -0.713 14.647 -4.126
340 HE1 TYR 53 1HE TYR 53 -4.325 11.604 -5.504
341 HE2 TYR 53 2HE TYR 53 -2.472 15.445 -5.647
342 HH TYR 53 HH TYR 53 -4.680 13.337 -7.171
343 H SER 54 H SER 54 0.565 14.347 -1.047
344 HA SER 54 HA SER 54 -1.606 15.966 -0.045
345 HB2 SER 54 1HB SER 54 1.360 16.281 -0.276
346 HB3 SER 54 2HB SER 54 0.368 17.722 -0.057
347 HG SER 54 HG SER 54 0.851 15.603 1.688
348 H GLY 55 H GLY 55 -2.943 17.004 -1.361
349 HA2 GLY 55 1HA GLY 55 -1.853 18.064 -3.896
350 HA3 GLY 55 2HA GLY 55 -3.484 17.428 -3.741
351 HA PRO 56 HA PRO 56 -3.503 22.076 -3.192
352 HB2 PRO 56 1HB PRO 56 -5.311 22.575 -5.155
353 HB3 PRO 56 2HB PRO 56 -3.571 22.492 -5.451
354 HG2 PRO 56 1HG PRO 56 -5.670 20.407 -5.906
355 HG3 PRO 56 2HG PRO 56 -4.313 20.875 -6.947
356 HD2 PRO 56 1HD PRO 56 -4.244 18.680 -5.364
357 HD3 PRO 56 2HD PRO 56 -2.793 19.631 -5.740
358 H SER 57 H SER 57 -5.628 23.442 -3.044
359 HA SER 57 HA SER 57 -7.564 21.837 -1.518
360 HB2 SER 57 1HB SER 57 -6.619 24.679 -1.258
361 HB3 SER 57 2HB SER 57 -8.171 24.186 -0.580
362 HG SER 57 HG SER 57 -6.757 23.831 1.032
363 H SER 58 H SER 58 -7.885 21.778 -4.230
364 HA SER 58 HA SER 58 -9.916 23.766 -4.905
365 HB2 SER 58 1HB SER 58 -9.820 22.355 -7.137
366 HB3 SER 58 2HB SER 58 -8.557 23.527 -6.760
367 HG SER 58 HG SER 58 -8.480 20.714 -6.428
368 H GLY 59 H GLY 59 -9.783 20.799 -3.435
369 HA2 GLY 59 1HA GLY 59 -12.632 20.437 -3.670
370 HA3 GLY 59 2HA GLY 59 -11.704 19.174 -4.465
Start of MODEL 9
1 H1 GLY 1 1H GLY 1 11.353 -8.405 15.955
2 HA2 GLY 1 1HA GLY 1 12.193 -8.175 13.175
3 HA3 GLY 1 2HA GLY 1 12.786 -7.221 14.527
4 H SER 2 H SER 2 13.676 -9.453 12.318
5 HA SER 2 HA SER 2 15.270 -11.209 13.909
6 HB2 SER 2 1HB SER 2 15.514 -10.596 10.955
7 HB3 SER 2 2HB SER 2 16.179 -11.997 11.794
8 HG SER 2 HG SER 2 14.313 -12.753 11.017
9 H SER 3 H SER 3 16.013 -8.410 11.845
10 HA SER 3 HA SER 3 18.561 -8.135 13.301
11 HB2 SER 3 1HB SER 3 18.844 -8.874 10.920
12 HB3 SER 3 2HB SER 3 18.088 -7.364 10.412
13 HG SER 3 HG SER 3 20.510 -7.684 11.852
14 H GLY 4 H GLY 4 19.444 -5.858 13.173
15 HA2 GLY 4 1HA GLY 4 18.001 -4.034 14.493
16 HA3 GLY 4 2HA GLY 4 19.176 -3.550 13.278
17 H SER 5 H SER 5 16.566 -2.374 14.125
18 HA SER 5 HA SER 5 14.816 -2.734 11.861
19 HB2 SER 5 1HB SER 5 13.399 -1.065 12.947
20 HB3 SER 5 2HB SER 5 13.919 -2.274 14.121
21 HG SER 5 HG SER 5 15.104 -0.817 15.124
22 H SER 6 H SER 6 17.340 -1.947 11.017
23 HA SER 6 HA SER 6 16.694 0.608 9.752
24 HB2 SER 6 1HB SER 6 18.777 1.630 10.256
25 HB3 SER 6 2HB SER 6 18.194 0.975 11.786
26 HG SER 6 HG SER 6 19.540 -0.968 10.885
27 H GLY 7 H GLY 7 16.982 0.478 7.627
28 HA2 GLY 7 1HA GLY 7 18.150 0.002 5.646
29 HA3 GLY 7 2HA GLY 7 19.167 -1.118 6.540
30 H MET 8 H MET 8 17.792 -3.030 7.493
31 HA MET 8 HA MET 8 16.732 -4.418 5.234
32 HB2 MET 8 1HB MET 8 16.878 -5.149 8.161
33 HB3 MET 8 2HB MET 8 16.293 -6.237 6.910
34 HG2 MET 8 1HG MET 8 18.489 -6.055 5.787
35 HG3 MET 8 2HG MET 8 19.058 -5.076 7.138
36 HE1 MET 8 3HE MET 8 19.800 -9.276 6.726
37 HE2 MET 8 1HE MET 8 19.420 -8.026 5.541
38 HE3 MET 8 2HE MET 8 20.833 -7.853 6.582
39 H GLU 9 H GLU 9 14.781 -3.942 4.455
40 HA GLU 9 HA GLU 9 12.633 -3.201 6.300
41 HB2 GLU 9 1HB GLU 9 13.051 -2.873 3.347
42 HB3 GLU 9 2HB GLU 9 11.434 -2.763 4.029
43 HG2 GLU 9 1HG GLU 9 12.525 -1.052 5.652
44 HG3 GLU 9 2HG GLU 9 13.776 -0.958 4.414
45 HA PRO 10 HA PRO 10 10.966 -7.300 6.015
46 HB2 PRO 10 1HB PRO 10 8.622 -6.774 7.279
47 HB3 PRO 10 2HB PRO 10 10.158 -6.942 8.136
48 HG2 PRO 10 1HG PRO 10 8.713 -4.455 7.307
49 HG3 PRO 10 2HG PRO 10 9.532 -4.815 8.838
50 HD2 PRO 10 1HD PRO 10 10.669 -3.308 6.897
51 HD3 PRO 10 2HD PRO 10 11.618 -4.350 7.976
52 H ALA 11 H ALA 11 10.784 -7.050 3.650
53 HA ALA 11 HA ALA 11 8.264 -6.051 2.616
54 HB1 ALA 11 3HB ALA 11 10.516 -5.789 1.466
55 HB2 ALA 11 1HB ALA 11 10.377 -7.496 1.041
56 HB3 ALA 11 2HB ALA 11 9.172 -6.342 0.466
57 H GLY 12 H GLY 12 7.130 -7.488 0.943
58 HA2 GLY 12 1HA GLY 12 7.081 -10.296 1.830
59 HA3 GLY 12 2HA GLY 12 5.589 -9.368 1.785
60 HA PRO 13 HA PRO 13 6.652 -11.427 -2.380
61 HB2 PRO 13 1HB PRO 13 4.897 -13.495 -2.267
62 HB3 PRO 13 2HB PRO 13 6.564 -13.617 -1.691
63 HG2 PRO 13 1HG PRO 13 4.049 -13.162 -0.132
64 HG3 PRO 13 2HG PRO 13 5.421 -14.222 0.242
65 HD2 PRO 13 1HD PRO 13 5.099 -11.793 1.395
66 HD3 PRO 13 2HD PRO 13 6.699 -12.487 1.062
67 H CYS 14 H CYS 14 5.687 -9.952 -3.662
68 HA CYS 14 HA CYS 14 3.125 -8.902 -3.386
69 HB2 CYS 14 1HB CYS 14 4.810 -7.831 -4.774
70 HB3 CYS 14 2HB CYS 14 4.808 -9.200 -5.881
71 H GLY 15 H GLY 15 1.316 -10.077 -3.322
72 HA2 GLY 15 1HA GLY 15 1.047 -12.513 -4.861
73 HA3 GLY 15 2HA GLY 15 -0.141 -11.836 -3.757
74 H PHE 16 H PHE 16 -0.309 -9.253 -4.936
75 HA PHE 16 HA PHE 16 -2.391 -9.440 -6.639
76 HB2 PHE 16 1HB PHE 16 -0.229 -7.366 -7.023
77 HB3 PHE 16 2HB PHE 16 -1.948 -7.201 -7.368
78 HD1 PHE 16 1HD PHE 16 -3.223 -8.214 -4.978
79 HD2 PHE 16 2HD PHE 16 0.287 -5.840 -5.378
80 HE1 PHE 16 1HE PHE 16 -3.589 -7.299 -2.723
81 HE2 PHE 16 2HE PHE 16 -0.073 -4.921 -3.124
82 HZ PHE 16 HZ PHE 16 -2.012 -5.652 -1.793
83 H CYS 17 H CYS 17 1.006 -9.721 -7.508
84 HA CYS 17 HA CYS 17 0.743 -9.652 -10.295
85 HB2 CYS 17 1HB CYS 17 2.766 -10.716 -8.384
86 HB3 CYS 17 2HB CYS 17 2.859 -11.259 -10.056
87 HA PRO 18 HA PRO 18 -1.105 -13.466 -11.431
88 HB2 PRO 18 1HB PRO 18 0.213 -14.043 -13.732
89 HB3 PRO 18 2HB PRO 18 -0.982 -12.747 -13.609
90 HG2 PRO 18 1HG PRO 18 2.006 -12.584 -13.523
91 HG3 PRO 18 2HG PRO 18 0.852 -11.537 -14.371
92 HD2 PRO 18 1HD PRO 18 1.990 -10.843 -12.013
93 HD3 PRO 18 2HD PRO 18 0.349 -10.339 -12.467
94 H ALA 19 H ALA 19 -0.872 -15.588 -10.986
95 HA ALA 19 HA ALA 19 1.034 -16.715 -9.502
96 HB1 ALA 19 3HB ALA 19 -0.329 -18.134 -11.788
97 HB2 ALA 19 1HB ALA 19 0.421 -18.903 -10.388
98 HB3 ALA 19 2HB ALA 19 -1.003 -17.884 -10.177
99 H GLY 20 H GLY 20 3.141 -17.142 -9.624
100 HA2 GLY 20 1HA GLY 20 5.055 -18.070 -10.699
101 HA3 GLY 20 2HA GLY 20 4.344 -17.659 -12.252
102 H GLU 21 H GLU 21 3.698 -14.991 -11.830
103 HA GLU 21 HA GLU 21 6.334 -13.808 -12.021
104 HB2 GLU 21 1HB GLU 21 3.610 -12.536 -12.342
105 HB3 GLU 21 2HB GLU 21 5.150 -11.794 -12.754
106 HG2 GLU 21 1HG GLU 21 5.498 -13.687 -14.376
107 HG3 GLU 21 2HG GLU 21 3.820 -14.138 -14.078
108 H VAL 22 H VAL 22 5.881 -14.697 -9.457
109 HA VAL 22 HA VAL 22 4.901 -12.595 -7.771
110 HB VAL 22 HB VAL 22 6.536 -15.041 -7.083
111 HG11 VAL 22 1HG1 VAL 22 6.893 -13.643 -5.274
112 HG12 VAL 22 2HG1 VAL 22 5.299 -12.897 -5.404
113 HG13 VAL 22 3HG1 VAL 22 5.458 -14.539 -4.778
114 HG21 VAL 22 3HG2 VAL 22 4.140 -15.583 -6.080
115 HG22 VAL 22 1HG2 VAL 22 3.630 -14.516 -7.389
116 HG23 VAL 22 2HG2 VAL 22 4.561 -15.970 -7.748
117 H GLN 23 H GLN 23 5.954 -10.779 -7.354
118 HA GLN 23 HA GLN 23 8.899 -10.809 -7.412
119 HB2 GLN 23 1HB GLN 23 6.905 -8.681 -8.138
120 HB3 GLN 23 2HB GLN 23 8.564 -8.266 -7.731
121 HG2 GLN 23 1HG GLN 23 7.873 -10.257 -9.868
122 HG3 GLN 23 2HG GLN 23 8.025 -8.529 -10.183
123 HE21 GLN 23 1HE2 GLN 23 9.608 -11.305 -10.485
124 HE22 GLN 23 2HE2 GLN 23 11.242 -10.769 -10.321
125 HA PRO 24 HA PRO 24 9.096 -9.645 -3.187
126 HB2 PRO 24 1HB PRO 24 11.231 -7.968 -3.173
127 HB3 PRO 24 2HB PRO 24 11.383 -9.717 -3.387
128 HG2 PRO 24 1HG PRO 24 11.403 -7.547 -5.450
129 HG3 PRO 24 2HG PRO 24 12.443 -8.978 -5.320
130 HD2 PRO 24 1HD PRO 24 10.334 -8.858 -7.015
131 HD3 PRO 24 2HD PRO 24 10.856 -10.371 -6.245
132 H ALA 25 H ALA 25 7.415 -8.437 -2.489
133 HA ALA 25 HA ALA 25 6.843 -5.815 -3.454
134 HB1 ALA 25 3HB ALA 25 5.203 -7.510 -2.478
135 HB2 ALA 25 1HB ALA 25 5.775 -6.973 -0.898
136 HB3 ALA 25 2HB ALA 25 5.008 -5.825 -1.996
137 H ARG 26 H ARG 26 9.162 -5.116 -3.009
138 HA ARG 26 HA ARG 26 10.186 -4.691 -0.466
139 HB2 ARG 26 1HB ARG 26 10.594 -3.430 -3.129
140 HB3 ARG 26 2HB ARG 26 11.212 -2.570 -1.725
141 HG2 ARG 26 1HG ARG 26 11.856 -5.457 -1.993
142 HG3 ARG 26 2HG ARG 26 12.682 -4.309 -3.049
143 HD2 ARG 26 1HD ARG 26 13.041 -3.007 -0.788
144 HD3 ARG 26 2HD ARG 26 12.809 -4.608 -0.088
145 HE ARG 26 HE ARG 26 15.120 -3.666 -1.438
146 HH11 ARG 26 2HH1 ARG 26 13.164 -6.506 -0.960
147 HH12 ARG 26 1HH1 ARG 26 14.467 -7.611 -1.246
148 HH21 ARG 26 2HH2 ARG 26 16.843 -5.110 -1.818
149 HH22 ARG 26 1HH2 ARG 26 16.560 -6.816 -1.734
150 H TYR 27 H TYR 27 7.696 -2.979 -2.184
151 HA TYR 27 HA TYR 27 7.582 -0.968 -0.039
152 HB2 TYR 27 1HB TYR 27 6.101 -0.743 -2.643
153 HB3 TYR 27 2HB TYR 27 6.591 0.536 -1.539
154 HD1 TYR 27 1HD TYR 27 9.288 0.561 -1.177
155 HD2 TYR 27 2HD TYR 27 7.242 -0.834 -4.637
156 HE1 TYR 27 1HE TYR 27 11.309 0.955 -2.524
157 HE2 TYR 27 2HE TYR 27 9.257 -0.446 -5.993
158 HH TYR 27 HH TYR 27 11.279 0.825 -5.962
159 H THR 28 H THR 28 5.178 -0.114 0.145
160 HA THR 28 HA THR 28 3.152 -2.144 -0.088
161 HB THR 28 HB THR 28 3.537 -1.263 2.731
162 HG1 THR 28 1HG THR 28 4.846 -3.314 2.906
163 HG21 THR 28 3HG2 THR 28 2.454 -3.319 3.237
164 HG22 THR 28 1HG2 THR 28 2.720 -3.938 1.608
165 HG23 THR 28 2HG2 THR 28 1.583 -2.617 1.874
166 H CYS 29 H CYS 29 1.083 -1.329 0.113
167 HA CYS 29 HA CYS 29 0.742 1.436 -0.301
168 HB2 CYS 29 1HB CYS 29 -0.788 -0.635 -0.886
169 HB3 CYS 29 2HB CYS 29 -1.526 -0.255 0.667
170 HA PRO 30 HA PRO 30 1.008 2.632 4.005
171 HB2 PRO 30 1HB PRO 30 0.826 5.298 3.529
172 HB3 PRO 30 2HB PRO 30 2.317 4.380 3.292
173 HG2 PRO 30 1HG PRO 30 0.287 5.249 1.272
174 HG3 PRO 30 2HG PRO 30 2.056 5.285 1.166
175 HD2 PRO 30 1HD PRO 30 0.566 3.352 -0.006
176 HD3 PRO 30 2HD PRO 30 2.196 3.048 0.630
177 H ARG 31 H ARG 31 -1.591 2.494 2.014
178 HA ARG 31 HA ARG 31 -3.356 3.873 3.929
179 HB2 ARG 31 1HB ARG 31 -3.442 3.566 0.971
180 HB3 ARG 31 2HB ARG 31 -4.977 3.562 1.830
181 HG2 ARG 31 1HG ARG 31 -3.042 5.720 2.462
182 HG3 ARG 31 2HG ARG 31 -3.887 5.785 0.914
183 HD2 ARG 31 1HD ARG 31 -5.386 6.922 2.200
184 HD3 ARG 31 2HD ARG 31 -5.980 5.282 2.453
185 HE ARG 31 HE ARG 31 -4.113 5.755 4.436
186 HH11 ARG 31 2HH1 ARG 31 -7.161 7.089 3.414
187 HH12 ARG 31 1HH1 ARG 31 -7.622 7.595 5.006
188 HH21 ARG 31 2HH2 ARG 31 -4.708 6.416 6.537
189 HH22 ARG 31 1HH2 ARG 31 -6.226 7.212 6.781
190 H CYS 32 H CYS 32 -2.774 0.923 2.125
191 HA CYS 32 HA CYS 32 -4.697 -0.451 3.871
192 HB2 CYS 32 1HB CYS 32 -5.648 -1.683 2.100
193 HB3 CYS 32 2HB CYS 32 -5.581 -0.028 1.505
194 H ASN 33 H ASN 33 -1.741 -0.147 3.841
195 HA ASN 33 HA ASN 33 0.190 -1.425 3.775
196 HB2 ASN 33 1HB ASN 33 -1.753 -3.059 5.419
197 HB3 ASN 33 2HB ASN 33 -0.013 -3.333 5.392
198 HD21 ASN 33 1HD2 ASN 33 1.367 -1.729 6.246
199 HD22 ASN 33 2HD2 ASN 33 0.787 -0.577 7.395
200 H ALA 34 H ALA 34 -0.708 -1.790 1.346
201 HA ALA 34 HA ALA 34 -0.936 -4.684 0.891
202 HB1 ALA 34 3HB ALA 34 -1.826 -2.288 -0.622
203 HB2 ALA 34 1HB ALA 34 -1.403 -3.737 -1.535
204 HB3 ALA 34 2HB ALA 34 -2.667 -3.806 -0.306
205 HA PRO 35 HA PRO 35 3.392 -4.442 -0.241
206 HB2 PRO 35 1HB PRO 35 3.691 -7.112 -0.632
207 HB3 PRO 35 2HB PRO 35 3.674 -6.372 0.973
208 HG2 PRO 35 1HG PRO 35 1.469 -7.771 -0.491
209 HG3 PRO 35 2HG PRO 35 1.940 -7.902 1.214
210 HD2 PRO 35 1HD PRO 35 -0.155 -6.395 0.393
211 HD3 PRO 35 2HD PRO 35 0.841 -5.961 1.797
212 H TYR 36 H TYR 36 3.700 -3.592 -2.217
213 HA TYR 36 HA TYR 36 2.855 -5.187 -4.548
214 HB2 TYR 36 1HB TYR 36 2.710 -3.049 -5.798
215 HB3 TYR 36 2HB TYR 36 1.576 -3.129 -4.455
216 HD1 TYR 36 2HD TYR 36 4.650 -1.557 -5.705
217 HD2 TYR 36 1HD TYR 36 1.795 -1.663 -2.552
218 HE1 TYR 36 2HE TYR 36 5.534 0.569 -4.841
219 HE2 TYR 36 1HE TYR 36 2.671 0.464 -1.680
220 HH TYR 36 HH TYR 36 4.793 2.442 -3.452
221 H CYS 37 H CYS 37 4.374 -5.739 -5.993
222 HA CYS 37 HA CYS 37 7.097 -5.537 -5.392
223 HB2 CYS 37 1HB CYS 37 7.472 -6.393 -7.685
224 HB3 CYS 37 2HB CYS 37 6.236 -7.304 -6.822
225 H SER 38 H SER 38 5.149 -3.746 -7.766
226 HA SER 38 HA SER 38 7.065 -1.546 -7.606
227 HB2 SER 38 1HB SER 38 7.419 -3.214 -9.642
228 HB3 SER 38 2HB SER 38 6.098 -2.274 -10.336
229 HG SER 38 HG SER 38 7.647 -0.465 -9.417
230 H LEU 39 H LEU 39 6.215 0.458 -8.584
231 HA LEU 39 HA LEU 39 3.835 1.280 -7.601
232 HB2 LEU 39 1HB LEU 39 5.474 2.153 -9.914
233 HB3 LEU 39 2HB LEU 39 3.849 2.821 -9.773
234 HG LEU 39 HG LEU 39 5.540 4.307 -8.813
235 HD11 LEU 39 1HD1 LEU 39 4.321 4.891 -6.939
236 HD12 LEU 39 2HD1 LEU 39 3.993 3.215 -6.501
237 HD13 LEU 39 3HD1 LEU 39 3.154 3.949 -7.867
238 HD21 LEU 39 3HD2 LEU 39 6.229 1.850 -7.274
239 HD22 LEU 39 1HD2 LEU 39 6.438 3.426 -6.511
240 HD23 LEU 39 2HD2 LEU 39 7.286 3.056 -8.012
241 H ARG 40 H ARG 40 4.346 -0.433 -10.625
242 HA ARG 40 HA ARG 40 1.957 -0.109 -11.919
243 HB2 ARG 40 1HB ARG 40 3.444 -2.726 -11.629
244 HB3 ARG 40 2HB ARG 40 2.307 -2.312 -12.906
245 HG2 ARG 40 1HG ARG 40 3.942 -0.351 -13.371
246 HG3 ARG 40 2HG ARG 40 5.091 -1.336 -12.464
247 HD2 ARG 40 1HD ARG 40 4.420 -3.241 -14.029
248 HD3 ARG 40 2HD ARG 40 3.670 -1.996 -15.027
249 HE ARG 40 HE ARG 40 6.272 -1.175 -14.523
250 HH11 ARG 40 2HH1 ARG 40 4.651 -3.805 -16.128
251 HH12 ARG 40 1HH1 ARG 40 5.920 -4.055 -17.281
252 HH21 ARG 40 2HH2 ARG 40 7.949 -1.494 -16.036
253 HH22 ARG 40 1HH2 ARG 40 7.795 -2.740 -17.228
254 H CYS 41 H CYS 41 2.648 -2.691 -9.553
255 HA CYS 41 HA CYS 41 -0.038 -3.583 -9.412
256 HB2 CYS 41 1HB CYS 41 2.442 -4.056 -7.806
257 HB3 CYS 41 2HB CYS 41 0.892 -4.579 -7.156
258 H TYR 42 H TYR 42 1.850 -1.278 -7.540
259 HA TYR 42 HA TYR 42 0.185 -0.902 -5.361
260 HB2 TYR 42 1HB TYR 42 2.277 0.179 -5.294
261 HB3 TYR 42 2HB TYR 42 2.015 0.973 -6.843
262 HD1 TYR 42 1HD TYR 42 0.603 0.858 -3.388
263 HD2 TYR 42 2HD TYR 42 1.356 3.193 -6.863
264 HE1 TYR 42 1HE TYR 42 -0.218 2.858 -2.214
265 HE2 TYR 42 2HE TYR 42 0.539 5.200 -5.700
266 HH TYR 42 HH TYR 42 0.373 5.673 -2.743
267 H ARG 43 H ARG 43 -0.192 0.160 -8.654
268 HA ARG 43 HA ARG 43 -2.433 1.896 -7.966
269 HB2 ARG 43 1HB ARG 43 -0.821 1.403 -10.437
270 HB3 ARG 43 2HB ARG 43 -2.434 2.087 -10.592
271 HG2 ARG 43 1HG ARG 43 -1.854 4.033 -9.461
272 HG3 ARG 43 2HG ARG 43 -0.428 3.294 -8.728
273 HD2 ARG 43 1HD ARG 43 0.405 4.712 -10.407
274 HD3 ARG 43 2HD ARG 43 0.489 3.088 -11.089
275 HE ARG 43 HE ARG 43 -1.885 3.934 -11.986
276 HH11 ARG 43 2HH1 ARG 43 1.249 5.450 -11.963
277 HH12 ARG 43 1HH1 ARG 43 0.962 6.366 -13.405
278 HH21 ARG 43 2HH2 ARG 43 -2.275 5.135 -13.886
279 HH22 ARG 43 1HH2 ARG 43 -1.044 6.187 -14.497
280 H THR 44 H THR 44 -1.757 -1.191 -9.481
281 HA THR 44 HA THR 44 -4.402 -1.599 -10.486
282 HB THR 44 HB THR 44 -2.177 -3.585 -9.988
283 HG1 THR 44 1HG THR 44 -2.141 -3.393 -12.391
284 HG21 THR 44 3HG2 THR 44 -4.088 -4.915 -10.082
285 HG22 THR 44 1HG2 THR 44 -3.548 -4.883 -11.759
286 HG23 THR 44 2HG2 THR 44 -4.886 -3.857 -11.244
287 H HIS 45 H HIS 45 -2.602 -3.174 -7.834
288 HA HIS 45 HA HIS 45 -4.371 -4.796 -6.699
289 HB2 HIS 45 1HB HIS 45 -3.239 -4.585 -4.704
290 HB3 HIS 45 2HB HIS 45 -2.087 -3.825 -5.797
291 HD1 HIS 45 1HD HIS 45 -1.645 -1.333 -5.500
292 HD2 HIS 45 2HD HIS 45 -4.613 -2.794 -2.987
293 HE1 HIS 45 1HE HIS 45 -2.085 0.504 -3.840
294 H GLY 46 H GLY 46 -4.394 -1.291 -6.016
295 HA2 GLY 46 1HA GLY 46 -7.247 -1.178 -6.044
296 HA3 GLY 46 2HA GLY 46 -6.623 -1.168 -4.401
297 H THR 47 H THR 47 -8.051 0.901 -5.992
298 HA THR 47 HA THR 47 -6.122 2.979 -6.487
299 HB THR 47 HB THR 47 -8.117 4.430 -6.832
300 HG1 THR 47 1HG THR 47 -9.568 2.031 -6.306
301 HG21 THR 47 3HG2 THR 47 -7.356 2.100 -8.344
302 HG22 THR 47 1HG2 THR 47 -7.874 3.684 -8.919
303 HG23 THR 47 2HG2 THR 47 -9.073 2.441 -8.560
304 H CYS 48 H CYS 48 -5.119 2.988 -4.368
305 HA CYS 48 HA CYS 48 -6.743 4.232 -2.260
306 HB2 CYS 48 1HB CYS 48 -4.010 2.948 -2.065
307 HB3 CYS 48 2HB CYS 48 -4.966 3.559 -0.717
308 H ALA 49 H ALA 49 -3.793 4.622 -4.145
309 HA ALA 49 HA ALA 49 -2.527 6.715 -2.983
310 HB1 ALA 49 3HB ALA 49 -2.586 7.402 -5.704
311 HB2 ALA 49 1HB ALA 49 -1.352 6.476 -4.849
312 HB3 ALA 49 2HB ALA 49 -2.693 5.643 -5.636
313 H GLU 50 H GLU 50 -5.417 6.934 -5.030
314 HA GLU 50 HA GLU 50 -5.675 9.665 -5.249
315 HB2 GLU 50 1HB GLU 50 -8.089 9.291 -5.489
316 HB3 GLU 50 2HB GLU 50 -7.161 8.099 -6.388
317 HG2 GLU 50 1HG GLU 50 -7.526 6.464 -4.623
318 HG3 GLU 50 2HG GLU 50 -8.433 7.658 -3.696
319 H ASN 51 H ASN 51 -6.766 7.588 -2.587
320 HA ASN 51 HA ASN 51 -7.855 9.752 -1.069
321 HB2 ASN 51 1HB ASN 51 -7.120 6.935 -0.243
322 HB3 ASN 51 2HB ASN 51 -8.024 8.073 0.752
323 HD21 ASN 51 1HD2 ASN 51 -9.188 5.744 0.290
324 HD22 ASN 51 2HD2 ASN 51 -10.474 5.891 -0.854
325 H PHE 52 H PHE 52 -4.883 7.818 -0.847
326 HA PHE 52 HA PHE 52 -3.675 8.623 1.386
327 HB2 PHE 52 1HB PHE 52 -2.316 7.299 0.061
328 HB3 PHE 52 2HB PHE 52 -2.588 8.277 -1.378
329 HD1 PHE 52 2HD PHE 52 -1.015 8.509 1.993
330 HD2 PHE 52 1HD PHE 52 -0.909 9.669 -2.101
331 HE1 PHE 52 2HE PHE 52 1.124 9.663 2.379
332 HE2 PHE 52 1HE PHE 52 1.231 10.824 -1.722
333 HZ PHE 52 HZ PHE 52 2.249 10.823 0.521
334 H TYR 53 H TYR 53 -3.277 10.544 -1.596
335 HA TYR 53 HA TYR 53 -2.506 12.854 -0.013
336 HB2 TYR 53 1HB TYR 53 -1.791 13.841 -2.032
337 HB3 TYR 53 2HB TYR 53 -1.390 12.135 -2.201
338 HD1 TYR 53 1HD TYR 53 -2.611 10.719 -3.764
339 HD2 TYR 53 2HD TYR 53 -3.530 14.855 -3.381
340 HE1 TYR 53 1HE TYR 53 -3.881 10.625 -5.868
341 HE2 TYR 53 2HE TYR 53 -4.803 14.773 -5.484
342 HH TYR 53 HH TYR 53 -4.637 12.139 -7.630
343 H SER 54 H SER 54 -3.440 15.023 -0.769
344 HA SER 54 HA SER 54 -6.343 14.777 -1.197
345 HB2 SER 54 1HB SER 54 -4.939 16.618 0.753
346 HB3 SER 54 2HB SER 54 -6.662 16.673 0.379
347 HG SER 54 HG SER 54 -6.766 15.301 1.979
348 H GLY 55 H GLY 55 -3.517 16.917 -1.349
349 HA2 GLY 55 1HA GLY 55 -3.223 18.892 -2.548
350 HA3 GLY 55 2HA GLY 55 -3.607 17.795 -3.866
351 HA PRO 56 HA PRO 56 -6.806 20.763 -4.706
352 HB2 PRO 56 1HB PRO 56 -7.821 19.480 -6.873
353 HB3 PRO 56 2HB PRO 56 -6.326 20.421 -6.927
354 HG2 PRO 56 1HG PRO 56 -6.692 17.460 -6.685
355 HG3 PRO 56 2HG PRO 56 -5.539 18.367 -7.682
356 HD2 PRO 56 1HD PRO 56 -4.844 17.219 -5.330
357 HD3 PRO 56 2HD PRO 56 -4.099 18.720 -5.917
358 H SER 57 H SER 57 -8.216 20.522 -2.988
359 HA SER 57 HA SER 57 -9.816 18.181 -2.621
360 HB2 SER 57 1HB SER 57 -10.956 19.510 -0.876
361 HB3 SER 57 2HB SER 57 -9.202 19.587 -0.716
362 HG SER 57 HG SER 57 -9.210 21.642 -1.388
363 H SER 58 H SER 58 -11.626 17.657 -3.640
364 HA SER 58 HA SER 58 -12.810 19.412 -5.561
365 HB2 SER 58 1HB SER 58 -14.395 17.555 -5.943
366 HB3 SER 58 2HB SER 58 -12.722 16.998 -5.956
367 HG SER 58 HG SER 58 -14.165 15.668 -4.706
368 H GLY 59 H GLY 59 -13.845 18.087 -2.432
369 HA2 GLY 59 1HA GLY 59 -15.396 20.417 -1.850
370 HA3 GLY 59 2HA GLY 59 -16.416 19.056 -2.291
Start of MODEL 10
1 H1 GLY 1 1H GLY 1 21.567 -11.688 22.976
2 HA2 GLY 1 1HA GLY 1 22.131 -13.867 21.059
3 HA3 GLY 1 2HA GLY 1 20.518 -13.493 21.649
4 H SER 2 H SER 2 21.807 -13.527 18.908
5 HA SER 2 HA SER 2 21.490 -10.742 18.097
6 HB2 SER 2 1HB SER 2 22.540 -13.211 16.739
7 HB3 SER 2 2HB SER 2 22.116 -11.780 15.800
8 HG SER 2 HG SER 2 24.174 -11.397 16.293
9 H SER 3 H SER 3 19.692 -9.965 17.212
10 HA SER 3 HA SER 3 17.618 -11.882 16.377
11 HB2 SER 3 1HB SER 3 15.967 -10.212 16.952
12 HB3 SER 3 2HB SER 3 17.062 -10.406 18.321
13 HG SER 3 HG SER 3 16.456 -8.178 17.146
14 H GLY 4 H GLY 4 19.102 -8.757 15.583
15 HA2 GLY 4 1HA GLY 4 19.606 -8.841 13.024
16 HA3 GLY 4 2HA GLY 4 17.851 -8.856 12.930
17 H SER 5 H SER 5 20.392 -6.902 12.578
18 HA SER 5 HA SER 5 19.575 -4.590 14.046
19 HB2 SER 5 1HB SER 5 21.266 -3.408 12.689
20 HB3 SER 5 2HB SER 5 21.911 -4.900 13.373
21 HG SER 5 HG SER 5 21.479 -4.201 10.746
22 H SER 6 H SER 6 18.875 -2.566 13.077
23 HA SER 6 HA SER 6 16.542 -2.797 11.596
24 HB2 SER 6 1HB SER 6 18.369 -0.486 12.187
25 HB3 SER 6 2HB SER 6 16.977 -0.269 11.126
26 HG SER 6 HG SER 6 16.572 -1.553 13.572
27 H GLY 7 H GLY 7 16.080 -1.813 9.446
28 HA2 GLY 7 1HA GLY 7 16.652 -1.340 7.218
29 HA3 GLY 7 2HA GLY 7 18.299 -1.854 7.554
30 H MET 8 H MET 8 16.584 -2.580 5.316
31 HA MET 8 HA MET 8 16.101 -4.410 4.056
32 HB2 MET 8 1HB MET 8 17.869 -5.708 6.127
33 HB3 MET 8 2HB MET 8 17.220 -6.579 4.745
34 HG2 MET 8 1HG MET 8 18.383 -5.113 3.224
35 HG3 MET 8 2HG MET 8 18.959 -4.131 4.569
36 HE1 MET 8 3HE MET 8 20.355 -5.429 2.163
37 HE2 MET 8 1HE MET 8 21.717 -4.915 3.158
38 HE3 MET 8 2HE MET 8 21.623 -6.580 2.586
39 H GLU 9 H GLU 9 14.229 -3.596 6.026
40 HA GLU 9 HA GLU 9 13.163 -5.457 7.706
41 HB2 GLU 9 1HB GLU 9 11.024 -4.394 7.416
42 HB3 GLU 9 2HB GLU 9 12.275 -3.161 7.333
43 HG2 GLU 9 1HG GLU 9 12.134 -3.397 4.812
44 HG3 GLU 9 2HG GLU 9 10.660 -4.323 5.089
45 HA PRO 10 HA PRO 10 11.832 -8.933 5.378
46 HB2 PRO 10 1HB PRO 10 9.688 -9.731 6.839
47 HB3 PRO 10 2HB PRO 10 11.354 -9.937 7.389
48 HG2 PRO 10 1HG PRO 10 9.365 -7.822 8.120
49 HG3 PRO 10 2HG PRO 10 10.489 -8.710 9.165
50 HD2 PRO 10 1HD PRO 10 10.983 -6.192 8.303
51 HD3 PRO 10 2HD PRO 10 12.276 -7.372 8.593
52 H ALA 11 H ALA 11 11.085 -8.292 3.401
53 HA ALA 11 HA ALA 11 8.571 -6.914 3.101
54 HB1 ALA 11 3HB ALA 11 9.128 -7.486 0.595
55 HB2 ALA 11 1HB ALA 11 10.015 -6.232 1.462
56 HB3 ALA 11 2HB ALA 11 10.723 -7.835 1.262
57 H GLY 12 H GLY 12 7.263 -7.933 1.046
58 HA2 GLY 12 1HA GLY 12 6.754 -10.767 1.676
59 HA3 GLY 12 2HA GLY 12 5.427 -9.615 1.646
60 HA PRO 13 HA PRO 13 6.536 -11.433 -2.651
61 HB2 PRO 13 1HB PRO 13 4.752 -13.476 -2.770
62 HB3 PRO 13 2HB PRO 13 6.405 -13.677 -2.176
63 HG2 PRO 13 1HG PRO 13 3.864 -13.335 -0.629
64 HG3 PRO 13 2HG PRO 13 5.215 -14.445 -0.331
65 HD2 PRO 13 1HD PRO 13 4.900 -12.132 1.041
66 HD3 PRO 13 2HD PRO 13 6.497 -12.815 0.675
67 H CYS 14 H CYS 14 5.615 -9.857 -3.834
68 HA CYS 14 HA CYS 14 3.236 -8.590 -3.569
69 HB2 CYS 14 1HB CYS 14 4.599 -7.705 -5.229
70 HB3 CYS 14 2HB CYS 14 4.863 -9.271 -5.990
71 H GLY 15 H GLY 15 1.483 -9.793 -2.947
72 HA2 GLY 15 1HA GLY 15 0.665 -12.113 -4.476
73 HA3 GLY 15 2HA GLY 15 -0.149 -11.449 -3.068
74 H PHE 16 H PHE 16 0.723 -9.792 -6.072
75 HA PHE 16 HA PHE 16 -2.141 -9.533 -6.689
76 HB2 PHE 16 1HB PHE 16 -0.157 -7.289 -7.059
77 HB3 PHE 16 2HB PHE 16 -1.911 -7.212 -7.193
78 HD1 PHE 16 1HD PHE 16 -2.918 -8.435 -4.830
79 HD2 PHE 16 2HD PHE 16 0.543 -6.003 -5.296
80 HE1 PHE 16 1HE PHE 16 -3.070 -7.772 -2.465
81 HE2 PHE 16 2HE PHE 16 0.398 -5.337 -2.933
82 HZ PHE 16 HZ PHE 16 -1.410 -6.222 -1.513
83 H CYS 17 H CYS 17 1.135 -9.838 -7.783
84 HA CYS 17 HA CYS 17 0.612 -9.440 -10.560
85 HB2 CYS 17 1HB CYS 17 2.903 -10.360 -8.912
86 HB3 CYS 17 2HB CYS 17 2.882 -10.880 -10.594
87 HA PRO 18 HA PRO 18 -0.885 -13.349 -11.867
88 HB2 PRO 18 1HB PRO 18 0.465 -13.766 -14.186
89 HB3 PRO 18 2HB PRO 18 -0.816 -12.558 -14.023
90 HG2 PRO 18 1HG PRO 18 2.154 -12.195 -13.933
91 HG3 PRO 18 2HG PRO 18 0.930 -11.204 -14.748
92 HD2 PRO 18 1HD PRO 18 2.023 -10.506 -12.371
93 HD3 PRO 18 2HD PRO 18 0.351 -10.100 -12.809
94 H ALA 19 H ALA 19 -0.502 -15.486 -11.567
95 HA ALA 19 HA ALA 19 1.434 -16.548 -10.081
96 HB1 ALA 19 3HB ALA 19 0.052 -17.802 -12.435
97 HB2 ALA 19 1HB ALA 19 1.127 -18.713 -11.374
98 HB3 ALA 19 2HB ALA 19 -0.331 -17.964 -10.721
99 H GLY 20 H GLY 20 3.506 -17.330 -10.243
100 HA2 GLY 20 1HA GLY 20 5.547 -17.841 -11.236
101 HA3 GLY 20 2HA GLY 20 4.860 -17.423 -12.799
102 H GLU 21 H GLU 21 4.043 -14.837 -12.406
103 HA GLU 21 HA GLU 21 6.514 -13.437 -12.611
104 HB2 GLU 21 1HB GLU 21 3.630 -12.577 -12.618
105 HB3 GLU 21 2HB GLU 21 4.938 -11.403 -12.668
106 HG2 GLU 21 1HG GLU 21 4.227 -11.775 -14.896
107 HG3 GLU 21 2HG GLU 21 5.796 -12.556 -14.705
108 H VAL 22 H VAL 22 4.608 -14.336 -9.980
109 HA VAL 22 HA VAL 22 4.486 -12.420 -8.140
110 HB VAL 22 HB VAL 22 5.740 -15.124 -7.645
111 HG11 VAL 22 1HG1 VAL 22 5.407 -14.833 -5.357
112 HG12 VAL 22 2HG1 VAL 22 6.049 -13.275 -5.881
113 HG13 VAL 22 3HG1 VAL 22 4.319 -13.465 -5.592
114 HG21 VAL 22 3HG2 VAL 22 3.709 -15.947 -8.004
115 HG22 VAL 22 1HG2 VAL 22 3.092 -14.956 -6.681
116 HG23 VAL 22 2HG2 VAL 22 3.085 -14.330 -8.330
117 H GLN 23 H GLN 23 5.760 -10.861 -7.410
118 HA GLN 23 HA GLN 23 8.673 -11.305 -7.417
119 HB2 GLN 23 1HB GLN 23 7.058 -8.914 -8.224
120 HB3 GLN 23 2HB GLN 23 8.693 -8.699 -7.614
121 HG2 GLN 23 1HG GLN 23 9.307 -10.482 -9.401
122 HG3 GLN 23 2HG GLN 23 7.767 -10.017 -10.122
123 HE21 GLN 23 1HE2 GLN 23 10.929 -9.512 -10.359
124 HE22 GLN 23 2HE2 GLN 23 10.957 -7.880 -10.925
125 HA PRO 24 HA PRO 24 8.800 -10.306 -3.149
126 HB2 PRO 24 1HB PRO 24 11.134 -8.931 -2.958
127 HB3 PRO 24 2HB PRO 24 11.066 -10.675 -3.235
128 HG2 PRO 24 1HG PRO 24 11.485 -8.459 -5.204
129 HG3 PRO 24 2HG PRO 24 12.319 -10.019 -5.082
130 HD2 PRO 24 1HD PRO 24 10.341 -9.562 -6.873
131 HD3 PRO 24 2HD PRO 24 10.616 -11.155 -6.141
132 H ALA 25 H ALA 25 7.122 -8.909 -2.720
133 HA ALA 25 HA ALA 25 7.033 -6.199 -3.524
134 HB1 ALA 25 3HB ALA 25 5.552 -6.834 -1.087
135 HB2 ALA 25 1HB ALA 25 4.980 -6.218 -2.637
136 HB3 ALA 25 2HB ALA 25 5.248 -7.948 -2.419
137 H ARG 26 H ARG 26 9.059 -5.307 -2.963
138 HA ARG 26 HA ARG 26 10.062 -5.298 -0.306
139 HB2 ARG 26 1HB ARG 26 10.680 -3.686 -2.770
140 HB3 ARG 26 2HB ARG 26 11.448 -3.328 -1.229
141 HG2 ARG 26 1HG ARG 26 12.278 -5.665 -1.159
142 HG3 ARG 26 2HG ARG 26 11.613 -5.904 -2.776
143 HD2 ARG 26 1HD ARG 26 13.992 -5.394 -2.882
144 HD3 ARG 26 2HD ARG 26 13.040 -4.111 -3.628
145 HE ARG 26 HE ARG 26 13.340 -3.131 -1.185
146 HH11 ARG 26 2HH1 ARG 26 15.659 -4.667 -3.279
147 HH12 ARG 26 1HH1 ARG 26 17.009 -3.784 -2.647
148 HH21 ARG 26 2HH2 ARG 26 15.110 -1.962 -0.345
149 HH22 ARG 26 1HH2 ARG 26 16.696 -2.247 -0.978
150 H TYR 27 H TYR 27 7.758 -3.354 -2.009
151 HA TYR 27 HA TYR 27 7.704 -1.420 0.207
152 HB2 TYR 27 1HB TYR 27 6.245 -1.028 -2.387
153 HB3 TYR 27 2HB TYR 27 6.833 0.182 -1.253
154 HD1 TYR 27 1HD TYR 27 9.460 0.244 -0.973
155 HD2 TYR 27 2HD TYR 27 7.427 -1.375 -4.342
156 HE1 TYR 27 1HE TYR 27 11.490 0.535 -2.330
157 HE2 TYR 27 2HE TYR 27 9.452 -1.089 -5.708
158 HH TYR 27 HH TYR 27 12.472 -0.514 -4.422
159 H THR 28 H THR 28 5.286 -0.431 0.250
160 HA THR 28 HA THR 28 3.206 -2.393 -0.001
161 HB THR 28 HB THR 28 3.560 -1.509 2.824
162 HG1 THR 28 1HG THR 28 4.995 -3.647 1.600
163 HG21 THR 28 3HG2 THR 28 2.611 -4.124 1.657
164 HG22 THR 28 1HG2 THR 28 1.553 -2.752 1.980
165 HG23 THR 28 2HG2 THR 28 2.397 -3.546 3.309
166 H CYS 29 H CYS 29 1.188 -1.483 0.042
167 HA CYS 29 HA CYS 29 0.973 1.297 -0.330
168 HB2 CYS 29 1HB CYS 29 -0.587 -0.493 -1.218
169 HB3 CYS 29 2HB CYS 29 -1.297 -0.558 0.392
170 HA PRO 30 HA PRO 30 1.017 2.417 4.003
171 HB2 PRO 30 1HB PRO 30 0.945 5.095 3.565
172 HB3 PRO 30 2HB PRO 30 2.419 4.134 3.399
173 HG2 PRO 30 1HG PRO 30 0.538 5.099 1.280
174 HG3 PRO 30 2HG PRO 30 2.311 5.081 1.278
175 HD2 PRO 30 1HD PRO 30 0.833 3.215 -0.013
176 HD3 PRO 30 2HD PRO 30 2.412 2.849 0.711
177 H ARG 31 H ARG 31 -1.473 2.285 1.934
178 HA ARG 31 HA ARG 31 -3.297 3.795 3.687
179 HB2 ARG 31 1HB ARG 31 -3.279 3.269 0.755
180 HB3 ARG 31 2HB ARG 31 -4.840 3.369 1.558
181 HG2 ARG 31 1HG ARG 31 -2.886 5.524 2.114
182 HG3 ARG 31 2HG ARG 31 -3.633 5.486 0.515
183 HD2 ARG 31 1HD ARG 31 -5.090 5.526 3.156
184 HD3 ARG 31 2HD ARG 31 -4.900 6.894 2.059
185 HE ARG 31 HE ARG 31 -6.165 4.559 0.912
186 HH11 ARG 31 2HH1 ARG 31 -6.602 7.607 2.538
187 HH12 ARG 31 1HH1 ARG 31 -8.238 7.805 2.005
188 HH21 ARG 31 2HH2 ARG 31 -8.319 4.809 0.204
189 HH22 ARG 31 1HH2 ARG 31 -9.214 6.213 0.678
190 H CYS 32 H CYS 32 -2.731 0.730 2.059
191 HA CYS 32 HA CYS 32 -4.681 -0.515 3.868
192 HB2 CYS 32 1HB CYS 32 -5.567 -1.904 2.112
193 HB3 CYS 32 2HB CYS 32 -5.684 -0.225 1.596
194 H ASN 33 H ASN 33 -1.720 -0.285 3.804
195 HA ASN 33 HA ASN 33 0.179 -1.600 3.825
196 HB2 ASN 33 1HB ASN 33 -1.894 -2.864 5.570
197 HB3 ASN 33 2HB ASN 33 -0.356 -3.694 5.351
198 HD21 ASN 33 1HD2 ASN 33 -1.088 -2.867 7.821
199 HD22 ASN 33 2HD2 ASN 33 -0.101 -1.541 8.325
200 H ALA 34 H ALA 34 -0.679 -1.974 1.382
201 HA ALA 34 HA ALA 34 -0.931 -4.871 0.952
202 HB1 ALA 34 3HB ALA 34 -1.621 -4.262 -1.348
203 HB2 ALA 34 1HB ALA 34 -2.681 -3.601 -0.103
204 HB3 ALA 34 2HB ALA 34 -1.500 -2.561 -0.900
205 HA PRO 35 HA PRO 35 3.417 -4.642 -0.127
206 HB2 PRO 35 1HB PRO 35 3.727 -7.321 -0.434
207 HB3 PRO 35 2HB PRO 35 3.693 -6.533 1.148
208 HG2 PRO 35 1HG PRO 35 1.506 -7.983 -0.294
209 HG3 PRO 35 2HG PRO 35 1.961 -8.061 1.418
210 HD2 PRO 35 1HD PRO 35 -0.130 -6.587 0.533
211 HD3 PRO 35 2HD PRO 35 0.851 -6.108 1.932
212 H TYR 36 H TYR 36 3.724 -3.842 -2.126
213 HA TYR 36 HA TYR 36 2.902 -5.507 -4.415
214 HB2 TYR 36 1HB TYR 36 2.871 -3.348 -5.716
215 HB3 TYR 36 2HB TYR 36 1.622 -3.490 -4.484
216 HD1 TYR 36 2HD TYR 36 4.837 -1.879 -5.318
217 HD2 TYR 36 1HD TYR 36 1.530 -1.980 -2.643
218 HE1 TYR 36 2HE TYR 36 5.573 0.253 -4.338
219 HE2 TYR 36 1HE TYR 36 2.256 0.153 -1.656
220 HH TYR 36 HH TYR 36 4.029 1.597 -1.493
221 H CYS 37 H CYS 37 4.338 -5.746 -6.129
222 HA CYS 37 HA CYS 37 7.090 -5.747 -5.442
223 HB2 CYS 37 1HB CYS 37 7.448 -6.491 -7.772
224 HB3 CYS 37 2HB CYS 37 6.177 -7.408 -6.969
225 H SER 38 H SER 38 5.117 -3.694 -7.544
226 HA SER 38 HA SER 38 7.066 -1.563 -7.288
227 HB2 SER 38 1HB SER 38 6.509 -2.979 -9.870
228 HB3 SER 38 2HB SER 38 6.869 -1.253 -9.888
229 HG SER 38 HG SER 38 8.533 -3.004 -8.457
230 H LEU 39 H LEU 39 6.201 0.351 -8.811
231 HA LEU 39 HA LEU 39 3.830 1.249 -7.687
232 HB2 LEU 39 1HB LEU 39 5.721 2.457 -9.053
233 HB3 LEU 39 2HB LEU 39 4.622 2.186 -10.404
234 HG LEU 39 HG LEU 39 4.280 4.403 -9.578
235 HD11 LEU 39 1HD1 LEU 39 1.929 4.349 -9.061
236 HD12 LEU 39 2HD1 LEU 39 2.039 2.660 -8.568
237 HD13 LEU 39 3HD1 LEU 39 2.290 3.103 -10.256
238 HD21 LEU 39 3HD2 LEU 39 3.222 4.010 -6.988
239 HD22 LEU 39 1HD2 LEU 39 4.668 4.907 -7.454
240 HD23 LEU 39 2HD2 LEU 39 4.785 3.195 -7.045
241 H ARG 40 H ARG 40 4.369 -0.263 -10.852
242 HA ARG 40 HA ARG 40 1.981 -0.057 -12.082
243 HB2 ARG 40 1HB ARG 40 2.344 -2.366 -12.976
244 HB3 ARG 40 2HB ARG 40 3.748 -1.314 -13.100
245 HG2 ARG 40 1HG ARG 40 4.833 -2.402 -11.294
246 HG3 ARG 40 2HG ARG 40 3.368 -3.288 -10.866
247 HD2 ARG 40 1HD ARG 40 3.505 -4.640 -12.797
248 HD3 ARG 40 2HD ARG 40 4.715 -3.591 -13.536
249 HE ARG 40 HE ARG 40 5.980 -4.425 -11.326
250 HH11 ARG 40 2HH1 ARG 40 4.201 -6.149 -13.772
251 HH12 ARG 40 1HH1 ARG 40 5.133 -7.601 -13.611
252 HH21 ARG 40 2HH2 ARG 40 7.214 -6.330 -11.106
253 HH22 ARG 40 1HH2 ARG 40 6.846 -7.703 -12.094
254 H CYS 41 H CYS 41 2.712 -2.268 -9.414
255 HA CYS 41 HA CYS 41 0.036 -3.345 -9.381
256 HB2 CYS 41 1HB CYS 41 2.550 -3.799 -7.849
257 HB3 CYS 41 2HB CYS 41 1.033 -4.244 -7.076
258 H TYR 42 H TYR 42 1.878 -0.934 -7.623
259 HA TYR 42 HA TYR 42 0.255 -0.555 -5.407
260 HB2 TYR 42 1HB TYR 42 2.330 0.581 -5.448
261 HB3 TYR 42 2HB TYR 42 1.967 1.357 -6.986
262 HD1 TYR 42 1HD TYR 42 0.695 1.200 -3.477
263 HD2 TYR 42 2HD TYR 42 1.248 3.556 -6.976
264 HE1 TYR 42 1HE TYR 42 -0.147 3.173 -2.274
265 HE2 TYR 42 2HE TYR 42 0.409 5.536 -5.783
266 HH TYR 42 HH TYR 42 -1.340 5.502 -3.169
267 H ARG 43 H ARG 43 -0.295 0.273 -8.718
268 HA ARG 43 HA ARG 43 -2.556 1.997 -8.029
269 HB2 ARG 43 1HB ARG 43 -0.999 1.479 -10.534
270 HB3 ARG 43 2HB ARG 43 -2.629 2.130 -10.648
271 HG2 ARG 43 1HG ARG 43 -2.039 4.094 -9.501
272 HG3 ARG 43 2HG ARG 43 -0.518 3.401 -8.936
273 HD2 ARG 43 1HD ARG 43 0.521 3.684 -10.961
274 HD3 ARG 43 2HD ARG 43 -0.990 3.607 -11.867
275 HE ARG 43 HE ARG 43 0.203 5.949 -10.651
276 HH11 ARG 43 2HH1 ARG 43 -2.643 4.511 -12.050
277 HH12 ARG 43 1HH1 ARG 43 -3.380 6.031 -12.437
278 HH21 ARG 43 2HH2 ARG 43 -0.758 7.956 -11.155
279 HH22 ARG 43 1HH2 ARG 43 -2.306 7.990 -11.928
280 H THR 44 H THR 44 -1.795 -1.094 -9.506
281 HA THR 44 HA THR 44 -4.467 -1.626 -10.390
282 HB THR 44 HB THR 44 -2.110 -3.483 -10.020
283 HG1 THR 44 1HG THR 44 -2.196 -1.702 -11.711
284 HG21 THR 44 3HG2 THR 44 -3.402 -5.022 -11.488
285 HG22 THR 44 1HG2 THR 44 -4.795 -3.955 -11.318
286 HG23 THR 44 2HG2 THR 44 -4.139 -4.781 -9.904
287 H HIS 45 H HIS 45 -2.455 -3.052 -7.808
288 HA HIS 45 HA HIS 45 -4.057 -4.779 -6.581
289 HB2 HIS 45 1HB HIS 45 -2.865 -4.457 -4.635
290 HB3 HIS 45 2HB HIS 45 -1.811 -3.644 -5.788
291 HD1 HIS 45 1HD HIS 45 -1.535 -1.118 -5.559
292 HD2 HIS 45 2HD HIS 45 -4.270 -2.733 -2.881
293 HE1 HIS 45 1HE HIS 45 -2.024 0.716 -3.909
294 H GLY 46 H GLY 46 -4.336 -1.264 -6.054
295 HA2 GLY 46 1HA GLY 46 -7.185 -1.407 -5.876
296 HA3 GLY 46 2HA GLY 46 -6.450 -1.218 -4.291
297 H THR 47 H THR 47 -8.057 0.740 -4.871
298 HA THR 47 HA THR 47 -6.478 2.900 -6.083
299 HB THR 47 HB THR 47 -8.592 4.186 -6.115
300 HG1 THR 47 1HG THR 47 -10.072 1.880 -5.558
301 HG21 THR 47 3HG2 THR 47 -9.151 1.526 -7.381
302 HG22 THR 47 1HG2 THR 47 -7.820 2.532 -7.951
303 HG23 THR 47 2HG2 THR 47 -9.473 3.144 -8.004
304 H CYS 48 H CYS 48 -5.103 3.134 -4.233
305 HA CYS 48 HA CYS 48 -6.415 4.563 -2.015
306 HB2 CYS 48 1HB CYS 48 -3.862 3.031 -1.628
307 HB3 CYS 48 2HB CYS 48 -5.043 3.536 -0.424
308 H ALA 49 H ALA 49 -5.230 5.580 -4.499
309 HA ALA 49 HA ALA 49 -2.995 7.136 -3.369
310 HB1 ALA 49 3HB ALA 49 -1.948 6.198 -5.144
311 HB2 ALA 49 1HB ALA 49 -3.446 5.967 -6.047
312 HB3 ALA 49 2HB ALA 49 -2.686 7.558 -5.991
313 H GLU 50 H GLU 50 -5.947 7.276 -5.298
314 HA GLU 50 HA GLU 50 -6.059 9.868 -6.100
315 HB2 GLU 50 1HB GLU 50 -8.336 8.334 -4.835
316 HB3 GLU 50 2HB GLU 50 -8.502 9.747 -5.867
317 HG2 GLU 50 1HG GLU 50 -7.021 7.408 -6.933
318 HG3 GLU 50 2HG GLU 50 -8.775 7.296 -6.798
319 H ASN 51 H ASN 51 -6.850 8.666 -2.856
320 HA ASN 51 HA ASN 51 -7.369 11.318 -1.853
321 HB2 ASN 51 1HB ASN 51 -7.137 8.645 -0.457
322 HB3 ASN 51 2HB ASN 51 -7.577 10.147 0.349
323 HD21 ASN 51 1HD2 ASN 51 -9.596 9.450 0.944
324 HD22 ASN 51 2HD2 ASN 51 -10.875 9.199 -0.190
325 H PHE 52 H PHE 52 -4.827 8.874 -1.450
326 HA PHE 52 HA PHE 52 -3.227 10.625 0.192
327 HB2 PHE 52 1HB PHE 52 -3.341 8.034 0.272
328 HB3 PHE 52 2HB PHE 52 -2.222 8.098 -1.086
329 HD1 PHE 52 2HD PHE 52 -2.675 9.165 2.433
330 HD2 PHE 52 1HD PHE 52 0.063 8.425 -0.741
331 HE1 PHE 52 2HE PHE 52 -0.795 9.416 4.000
332 HE2 PHE 52 1HE PHE 52 1.947 8.674 0.821
333 HZ PHE 52 HZ PHE 52 1.520 9.172 3.195
334 H TYR 53 H TYR 53 -2.541 12.393 -0.903
335 HA TYR 53 HA TYR 53 -0.823 11.904 -3.241
336 HB2 TYR 53 1HB TYR 53 -3.088 13.810 -2.940
337 HB3 TYR 53 2HB TYR 53 -1.675 14.365 -3.830
338 HD1 TYR 53 1HD TYR 53 -0.778 12.269 -5.450
339 HD2 TYR 53 2HD TYR 53 -4.791 13.129 -4.326
340 HE1 TYR 53 1HE TYR 53 -1.585 11.107 -7.462
341 HE2 TYR 53 2HE TYR 53 -5.608 11.968 -6.334
342 HH TYR 53 HH TYR 53 -5.059 10.856 -8.170
343 H SER 54 H SER 54 1.162 12.712 -3.058
344 HA SER 54 HA SER 54 1.652 14.721 -0.957
345 HB2 SER 54 1HB SER 54 2.667 12.473 -0.542
346 HB3 SER 54 2HB SER 54 3.613 12.672 -2.017
347 HG SER 54 HG SER 54 4.895 14.018 -1.015
348 H GLY 55 H GLY 55 1.147 16.340 -2.604
349 HA2 GLY 55 1HA GLY 55 2.461 18.116 -3.600
350 HA3 GLY 55 2HA GLY 55 3.512 16.883 -4.281
351 HA PRO 56 HA PRO 56 0.575 18.258 -7.588
352 HB2 PRO 56 1HB PRO 56 2.479 18.479 -9.511
353 HB3 PRO 56 2HB PRO 56 2.088 19.789 -8.391
354 HG2 PRO 56 1HG PRO 56 4.337 17.817 -8.287
355 HG3 PRO 56 2HG PRO 56 4.363 19.561 -7.970
356 HD2 PRO 56 1HD PRO 56 4.308 17.719 -5.985
357 HD3 PRO 56 2HD PRO 56 3.537 19.311 -5.832
358 H SER 57 H SER 57 -0.528 16.527 -8.267
359 HA SER 57 HA SER 57 0.695 14.000 -8.786
360 HB2 SER 57 1HB SER 57 -1.628 13.400 -9.622
361 HB3 SER 57 2HB SER 57 -1.540 13.965 -7.954
362 HG SER 57 HG SER 57 -1.877 16.045 -9.625
363 H SER 58 H SER 58 -0.104 16.770 -10.699
364 HA SER 58 HA SER 58 1.391 15.893 -12.918
365 HB2 SER 58 1HB SER 58 -0.711 14.455 -13.120
366 HB3 SER 58 2HB SER 58 -1.573 15.949 -13.488
367 HG SER 58 HG SER 58 -0.436 16.165 -15.339
368 H GLY 59 H GLY 59 1.610 17.499 -14.524
369 HA2 GLY 59 1HA GLY 59 1.602 19.637 -15.365
370 HA3 GLY 59 2HA GLY 59 0.015 19.835 -14.637
Start of MODEL 11
1 H1 GLY 1 1H GLY 1 19.585 -26.231 -3.087
2 HA2 GLY 1 1HA GLY 1 17.248 -26.513 -2.620
3 HA3 GLY 1 2HA GLY 1 17.678 -27.094 -1.018
4 H SER 2 H SER 2 15.832 -25.394 -0.747
5 HA SER 2 HA SER 2 17.120 -22.992 0.259
6 HB2 SER 2 1HB SER 2 15.150 -23.009 -1.992
7 HB3 SER 2 2HB SER 2 15.095 -21.686 -0.827
8 HG SER 2 HG SER 2 17.167 -21.130 -1.366
9 H SER 3 H SER 3 16.202 -22.270 2.099
10 HA SER 3 HA SER 3 13.464 -22.711 2.772
11 HB2 SER 3 1HB SER 3 13.659 -24.324 4.487
12 HB3 SER 3 2HB SER 3 14.604 -24.982 3.151
13 HG SER 3 HG SER 3 15.728 -25.115 5.138
14 H GLY 4 H GLY 4 13.167 -22.202 5.246
15 HA2 GLY 4 1HA GLY 4 13.588 -20.815 7.056
16 HA3 GLY 4 2HA GLY 4 15.167 -20.455 6.373
17 H SER 5 H SER 5 15.473 -18.505 5.509
18 HA SER 5 HA SER 5 13.130 -16.966 4.632
19 HB2 SER 5 1HB SER 5 14.134 -16.424 7.026
20 HB3 SER 5 2HB SER 5 15.316 -15.527 6.073
21 HG SER 5 HG SER 5 13.142 -14.773 5.022
22 H SER 6 H SER 6 13.442 -16.609 2.541
23 HA SER 6 HA SER 6 16.008 -16.625 1.310
24 HB2 SER 6 1HB SER 6 13.220 -16.032 0.368
25 HB3 SER 6 2HB SER 6 14.597 -15.683 -0.677
26 HG SER 6 HG SER 6 13.816 -17.777 -1.056
27 H GLY 7 H GLY 7 13.729 -14.071 2.210
28 HA2 GLY 7 1HA GLY 7 15.717 -12.061 1.389
29 HA3 GLY 7 2HA GLY 7 14.006 -11.752 1.642
30 H MET 8 H MET 8 16.076 -10.206 2.769
31 HA MET 8 HA MET 8 15.927 -10.937 5.616
32 HB2 MET 8 1HB MET 8 18.198 -10.627 4.479
33 HB3 MET 8 2HB MET 8 17.811 -8.913 4.420
34 HG2 MET 8 1HG MET 8 17.758 -8.754 6.783
35 HG3 MET 8 2HG MET 8 17.819 -10.505 6.965
36 HE1 MET 8 3HE MET 8 19.668 -11.753 5.483
37 HE2 MET 8 1HE MET 8 21.371 -11.382 5.753
38 HE3 MET 8 2HE MET 8 20.345 -11.850 7.109
39 H GLU 9 H GLU 9 16.061 -7.992 3.599
40 HA GLU 9 HA GLU 9 15.117 -6.172 5.422
41 HB2 GLU 9 1HB GLU 9 14.554 -6.286 2.455
42 HB3 GLU 9 2HB GLU 9 14.264 -4.880 3.469
43 HG2 GLU 9 1HG GLU 9 16.552 -4.534 3.838
44 HG3 GLU 9 2HG GLU 9 16.974 -6.142 3.253
45 HA PRO 10 HA PRO 10 10.927 -7.155 6.298
46 HB2 PRO 10 1HB PRO 10 9.941 -4.678 6.811
47 HB3 PRO 10 2HB PRO 10 11.025 -5.529 7.918
48 HG2 PRO 10 1HG PRO 10 11.655 -3.391 5.920
49 HG3 PRO 10 2HG PRO 10 12.239 -3.574 7.584
50 HD2 PRO 10 1HD PRO 10 13.722 -4.285 5.433
51 HD3 PRO 10 2HD PRO 10 13.827 -5.135 6.989
52 H ALA 11 H ALA 11 10.372 -7.874 4.155
53 HA ALA 11 HA ALA 11 8.482 -6.070 2.858
54 HB1 ALA 11 3HB ALA 11 9.406 -6.753 0.603
55 HB2 ALA 11 1HB ALA 11 10.382 -5.617 1.534
56 HB3 ALA 11 2HB ALA 11 10.835 -7.321 1.466
57 H GLY 12 H GLY 12 7.259 -7.295 1.080
58 HA2 GLY 12 1HA GLY 12 6.988 -10.144 1.781
59 HA3 GLY 12 2HA GLY 12 5.572 -9.104 1.759
60 HA PRO 13 HA PRO 13 6.703 -10.933 -2.520
61 HB2 PRO 13 1HB PRO 13 5.019 -13.062 -2.562
62 HB3 PRO 13 2HB PRO 13 6.689 -13.169 -1.992
63 HG2 PRO 13 1HG PRO 13 4.160 -12.914 -0.411
64 HG3 PRO 13 2HG PRO 13 5.567 -13.950 -0.111
65 HD2 PRO 13 1HD PRO 13 5.162 -11.624 1.214
66 HD3 PRO 13 2HD PRO 13 6.784 -12.237 0.836
67 H CYS 14 H CYS 14 5.687 -9.353 -3.644
68 HA CYS 14 HA CYS 14 3.283 -8.198 -3.405
69 HB2 CYS 14 1HB CYS 14 4.584 -7.373 -5.155
70 HB3 CYS 14 2HB CYS 14 4.816 -8.967 -5.866
71 H GLY 15 H GLY 15 1.456 -9.216 -2.823
72 HA2 GLY 15 1HA GLY 15 0.698 -11.725 -4.089
73 HA3 GLY 15 2HA GLY 15 -0.131 -10.937 -2.755
74 H PHE 16 H PHE 16 0.746 -9.607 -5.921
75 HA PHE 16 HA PHE 16 -2.115 -9.423 -6.571
76 HB2 PHE 16 1HB PHE 16 -0.070 -7.214 -6.871
77 HB3 PHE 16 2HB PHE 16 -1.715 -7.154 -7.496
78 HD1 PHE 16 1HD PHE 16 -3.486 -7.914 -5.532
79 HD2 PHE 16 2HD PHE 16 0.261 -5.969 -4.987
80 HE1 PHE 16 1HE PHE 16 -4.271 -7.011 -3.381
81 HE2 PHE 16 2HE PHE 16 -0.517 -5.064 -2.836
82 HZ PHE 16 HZ PHE 16 -2.785 -5.586 -2.030
83 H CYS 17 H CYS 17 1.204 -9.605 -7.660
84 HA CYS 17 HA CYS 17 0.840 -9.441 -10.415
85 HB2 CYS 17 1HB CYS 17 2.880 -10.650 -8.623
86 HB3 CYS 17 2HB CYS 17 2.881 -11.175 -10.303
87 HA PRO 18 HA PRO 18 -1.174 -13.125 -11.688
88 HB2 PRO 18 1HB PRO 18 0.139 -13.733 -13.985
89 HB3 PRO 18 2HB PRO 18 -0.976 -12.368 -13.849
90 HG2 PRO 18 1HG PRO 18 2.015 -12.391 -13.721
91 HG3 PRO 18 2HG PRO 18 0.939 -11.257 -14.560
92 HD2 PRO 18 1HD PRO 18 2.083 -10.685 -12.173
93 HD3 PRO 18 2HD PRO 18 0.484 -10.071 -12.637
94 H ALA 19 H ALA 19 -1.076 -15.239 -11.205
95 HA ALA 19 HA ALA 19 0.775 -16.501 -9.760
96 HB1 ALA 19 3HB ALA 19 -1.414 -17.335 -11.327
97 HB2 ALA 19 1HB ALA 19 -0.080 -18.434 -11.679
98 HB3 ALA 19 2HB ALA 19 -0.620 -18.206 -10.015
99 H GLY 20 H GLY 20 2.890 -16.810 -9.943
100 HA2 GLY 20 1HA GLY 20 4.667 -18.013 -11.097
101 HA3 GLY 20 2HA GLY 20 3.981 -17.444 -12.612
102 H GLU 21 H GLU 21 3.593 -14.760 -12.031
103 HA GLU 21 HA GLU 21 6.349 -13.830 -12.103
104 HB2 GLU 21 1HB GLU 21 3.794 -12.276 -12.547
105 HB3 GLU 21 2HB GLU 21 5.426 -11.728 -12.905
106 HG2 GLU 21 1HG GLU 21 5.573 -13.716 -14.485
107 HG3 GLU 21 2HG GLU 21 3.827 -13.851 -14.290
108 H VAL 22 H VAL 22 5.656 -14.707 -9.589
109 HA VAL 22 HA VAL 22 4.763 -12.544 -7.930
110 HB VAL 22 HB VAL 22 6.080 -15.169 -7.228
111 HG11 VAL 22 1HG1 VAL 22 4.808 -14.377 -4.968
112 HG12 VAL 22 2HG1 VAL 22 6.529 -14.141 -5.278
113 HG13 VAL 22 3HG1 VAL 22 5.388 -12.832 -5.588
114 HG21 VAL 22 3HG2 VAL 22 3.834 -15.829 -6.525
115 HG22 VAL 22 1HG2 VAL 22 3.209 -14.261 -7.036
116 HG23 VAL 22 2HG2 VAL 22 3.860 -15.383 -8.231
117 H GLN 23 H GLN 23 5.962 -10.816 -7.515
118 HA GLN 23 HA GLN 23 8.883 -11.135 -7.330
119 HB2 GLN 23 1HB GLN 23 7.183 -8.788 -8.152
120 HB3 GLN 23 2HB GLN 23 8.879 -8.611 -7.725
121 HG2 GLN 23 1HG GLN 23 8.157 -10.647 -9.759
122 HG3 GLN 23 2HG GLN 23 8.093 -8.946 -10.218
123 HE21 GLN 23 1HE2 GLN 23 9.855 -10.944 -11.250
124 HE22 GLN 23 2HE2 GLN 23 11.467 -10.447 -10.876
125 HA PRO 24 HA PRO 24 8.840 -9.984 -3.096
126 HB2 PRO 24 1HB PRO 24 11.182 -8.624 -2.894
127 HB3 PRO 24 2HB PRO 24 11.104 -10.379 -3.089
128 HG2 PRO 24 1HG PRO 24 11.612 -8.266 -5.147
129 HG3 PRO 24 2HG PRO 24 12.424 -9.826 -4.922
130 HD2 PRO 24 1HD PRO 24 10.511 -9.438 -6.798
131 HD3 PRO 24 2HD PRO 24 10.744 -10.996 -5.981
132 H ALA 25 H ALA 25 7.239 -8.547 -2.645
133 HA ALA 25 HA ALA 25 7.195 -5.870 -3.624
134 HB1 ALA 25 3HB ALA 25 5.593 -6.339 -1.241
135 HB2 ALA 25 1HB ALA 25 5.098 -5.858 -2.864
136 HB3 ALA 25 2HB ALA 25 5.348 -7.563 -2.487
137 H ARG 26 H ARG 26 9.143 -4.900 -3.020
138 HA ARG 26 HA ARG 26 10.144 -4.863 -0.376
139 HB2 ARG 26 1HB ARG 26 10.667 -3.253 -2.848
140 HB3 ARG 26 2HB ARG 26 11.351 -2.737 -1.313
141 HG2 ARG 26 1HG ARG 26 12.451 -4.922 -1.088
142 HG3 ARG 26 2HG ARG 26 11.798 -5.393 -2.658
143 HD2 ARG 26 1HD ARG 26 12.989 -3.482 -3.681
144 HD3 ARG 26 2HD ARG 26 13.699 -3.118 -2.109
145 HE ARG 26 HE ARG 26 14.420 -5.677 -2.478
146 HH11 ARG 26 2HH1 ARG 26 14.623 -2.873 -4.531
147 HH12 ARG 26 1HH1 ARG 26 16.043 -3.420 -5.359
148 HH21 ARG 26 2HH2 ARG 26 16.290 -6.408 -3.561
149 HH22 ARG 26 1HH2 ARG 26 16.990 -5.432 -4.807
150 H TYR 27 H TYR 27 7.872 -2.842 -2.109
151 HA TYR 27 HA TYR 27 7.684 -1.027 0.187
152 HB2 TYR 27 1HB TYR 27 6.171 -0.614 -2.364
153 HB3 TYR 27 2HB TYR 27 6.793 0.581 -1.231
154 HD1 TYR 27 1HD TYR 27 9.297 0.978 -1.155
155 HD2 TYR 27 2HD TYR 27 7.413 -1.240 -4.259
156 HE1 TYR 27 1HE TYR 27 11.273 1.308 -2.582
157 HE2 TYR 27 2HE TYR 27 9.385 -0.917 -5.694
158 HH TYR 27 HH TYR 27 11.269 0.557 -5.929
159 H THR 28 H THR 28 5.216 -0.136 0.227
160 HA THR 28 HA THR 28 3.219 -2.170 -0.060
161 HB THR 28 HB THR 28 3.566 -1.357 2.790
162 HG1 THR 28 1HG THR 28 4.775 -3.554 2.809
163 HG21 THR 28 3HG2 THR 28 2.333 -3.289 3.247
164 HG22 THR 28 1HG2 THR 28 2.750 -4.034 1.705
165 HG23 THR 28 2HG2 THR 28 1.612 -2.688 1.754
166 H CYS 29 H CYS 29 1.136 -1.370 0.146
167 HA CYS 29 HA CYS 29 0.811 1.415 -0.201
168 HB2 CYS 29 1HB CYS 29 -0.692 -0.476 -1.054
169 HB3 CYS 29 2HB CYS 29 -1.398 -0.490 0.559
170 HA PRO 30 HA PRO 30 0.901 2.468 4.143
171 HB2 PRO 30 1HB PRO 30 0.652 5.144 3.758
172 HB3 PRO 30 2HB PRO 30 2.176 4.278 3.529
173 HG2 PRO 30 1HG PRO 30 0.173 5.161 1.486
174 HG3 PRO 30 2HG PRO 30 1.944 5.252 1.430
175 HD2 PRO 30 1HD PRO 30 0.543 3.320 0.150
176 HD3 PRO 30 2HD PRO 30 2.163 3.041 0.819
177 H ARG 31 H ARG 31 -1.639 2.398 2.041
178 HA ARG 31 HA ARG 31 -3.493 3.688 3.925
179 HB2 ARG 31 1HB ARG 31 -3.491 3.312 0.979
180 HB3 ARG 31 2HB ARG 31 -5.049 3.228 1.789
181 HG2 ARG 31 1HG ARG 31 -4.889 5.455 1.203
182 HG3 ARG 31 2HG ARG 31 -4.346 5.456 2.883
183 HD2 ARG 31 1HD ARG 31 -2.284 5.069 0.791
184 HD3 ARG 31 2HD ARG 31 -3.001 6.674 0.925
185 HE ARG 31 HE ARG 31 -1.183 5.435 2.763
186 HH11 ARG 31 2HH1 ARG 31 -3.733 7.781 2.429
187 HH12 ARG 31 1HH1 ARG 31 -3.236 8.710 3.805
188 HH21 ARG 31 2HH2 ARG 31 -0.519 6.649 4.576
189 HH22 ARG 31 1HH2 ARG 31 -1.407 8.065 5.025
190 H CYS 32 H CYS 32 -2.801 0.715 2.187
191 HA CYS 32 HA CYS 32 -4.668 -0.686 3.970
192 HB2 CYS 32 1HB CYS 32 -5.537 -2.030 2.204
193 HB3 CYS 32 2HB CYS 32 -5.643 -0.359 1.660
194 H ASN 33 H ASN 33 -1.732 -0.297 3.934
195 HA ASN 33 HA ASN 33 0.240 -1.514 3.866
196 HB2 ASN 33 1HB ASN 33 -0.688 -1.873 6.103
197 HB3 ASN 33 2HB ASN 33 -1.601 -3.260 5.517
198 HD21 ASN 33 1HD2 ASN 33 1.640 -2.006 6.038
199 HD22 ASN 33 2HD2 ASN 33 2.407 -3.544 6.208
200 H ALA 34 H ALA 34 -0.678 -1.944 1.448
201 HA ALA 34 HA ALA 34 -0.795 -4.853 1.040
202 HB1 ALA 34 3HB ALA 34 -1.593 -2.556 -0.734
203 HB2 ALA 34 1HB ALA 34 -1.524 -4.231 -1.283
204 HB3 ALA 34 2HB ALA 34 -2.637 -3.770 0.005
205 HA PRO 35 HA PRO 35 3.493 -4.455 -0.187
206 HB2 PRO 35 1HB PRO 35 3.883 -7.112 -0.585
207 HB3 PRO 35 2HB PRO 35 3.869 -6.373 1.021
208 HG2 PRO 35 1HG PRO 35 1.690 -7.853 -0.403
209 HG3 PRO 35 2HG PRO 35 2.197 -7.966 1.293
210 HD2 PRO 35 1HD PRO 35 0.033 -6.538 0.512
211 HD3 PRO 35 2HD PRO 35 1.038 -6.068 1.898
212 H TYR 36 H TYR 36 3.798 -3.631 -2.167
213 HA TYR 36 HA TYR 36 2.912 -5.226 -4.483
214 HB2 TYR 36 1HB TYR 36 2.755 -3.087 -5.731
215 HB3 TYR 36 2HB TYR 36 1.642 -3.163 -4.370
216 HD1 TYR 36 2HD TYR 36 4.841 -1.716 -5.534
217 HD2 TYR 36 1HD TYR 36 1.757 -1.584 -2.606
218 HE1 TYR 36 2HE TYR 36 5.747 0.407 -4.683
219 HE2 TYR 36 1HE TYR 36 2.653 0.540 -1.748
220 HH TYR 36 HH TYR 36 4.574 1.861 -1.748
221 H CYS 37 H CYS 37 4.336 -5.540 -6.154
222 HA CYS 37 HA CYS 37 7.097 -5.462 -5.547
223 HB2 CYS 37 1HB CYS 37 7.390 -6.186 -7.922
224 HB3 CYS 37 2HB CYS 37 6.252 -7.175 -7.012
225 H SER 38 H SER 38 5.108 -3.569 -7.805
226 HA SER 38 HA SER 38 7.033 -1.383 -7.598
227 HB2 SER 38 1HB SER 38 7.418 -1.156 -9.897
228 HB3 SER 38 2HB SER 38 7.489 -2.902 -9.654
229 HG SER 38 HG SER 38 5.413 -3.074 -10.462
230 H LEU 39 H LEU 39 6.163 0.631 -8.662
231 HA LEU 39 HA LEU 39 3.811 1.454 -7.570
232 HB2 LEU 39 1HB LEU 39 5.336 2.342 -9.971
233 HB3 LEU 39 2HB LEU 39 3.759 3.060 -9.648
234 HG LEU 39 HG LEU 39 5.550 4.466 -8.797
235 HD11 LEU 39 1HD1 LEU 39 3.285 3.787 -7.481
236 HD12 LEU 39 2HD1 LEU 39 4.400 5.049 -6.960
237 HD13 LEU 39 3HD1 LEU 39 4.503 3.436 -6.254
238 HD21 LEU 39 3HD2 LEU 39 7.191 3.784 -7.324
239 HD22 LEU 39 1HD2 LEU 39 7.033 2.372 -8.369
240 HD23 LEU 39 2HD2 LEU 39 6.269 2.382 -6.779
241 H ARG 40 H ARG 40 4.252 -0.253 -10.604
242 HA ARG 40 HA ARG 40 1.820 0.098 -11.833
243 HB2 ARG 40 1HB ARG 40 3.377 -2.488 -11.652
244 HB3 ARG 40 2HB ARG 40 2.158 -2.103 -12.860
245 HG2 ARG 40 1HG ARG 40 3.720 -0.066 -13.356
246 HG3 ARG 40 2HG ARG 40 4.939 -1.079 -12.579
247 HD2 ARG 40 1HD ARG 40 4.959 -1.416 -14.984
248 HD3 ARG 40 2HD ARG 40 4.434 -2.883 -14.160
249 HE ARG 40 HE ARG 40 2.097 -1.709 -14.737
250 HH11 ARG 40 2HH1 ARG 40 4.921 -2.326 -16.677
251 HH12 ARG 40 1HH1 ARG 40 4.031 -2.484 -18.155
252 HH21 ARG 40 2HH2 ARG 40 0.915 -1.914 -16.676
253 HH22 ARG 40 1HH2 ARG 40 1.752 -2.248 -18.154
254 H CYS 41 H CYS 41 2.576 -2.691 -9.736
255 HA CYS 41 HA CYS 41 -0.087 -3.543 -9.476
256 HB2 CYS 41 1HB CYS 41 2.476 -4.117 -8.076
257 HB3 CYS 41 2HB CYS 41 0.988 -4.581 -7.258
258 H TYR 42 H TYR 42 1.798 -1.197 -7.705
259 HA TYR 42 HA TYR 42 0.219 -0.969 -5.405
260 HB2 TYR 42 1HB TYR 42 2.326 0.092 -5.352
261 HB3 TYR 42 2HB TYR 42 2.018 0.968 -6.847
262 HD1 TYR 42 1HD TYR 42 0.585 0.654 -3.406
263 HD2 TYR 42 2HD TYR 42 1.501 3.209 -6.683
264 HE1 TYR 42 1HE TYR 42 -0.189 2.591 -2.104
265 HE2 TYR 42 2HE TYR 42 0.731 5.154 -5.389
266 HH TYR 42 HH TYR 42 -0.137 4.882 -2.004
267 H ARG 43 H ARG 43 -0.237 0.224 -8.640
268 HA ARG 43 HA ARG 43 -2.431 1.963 -7.831
269 HB2 ARG 43 1HB ARG 43 -1.036 1.451 -10.448
270 HB3 ARG 43 2HB ARG 43 -2.540 2.358 -10.370
271 HG2 ARG 43 1HG ARG 43 -1.399 3.888 -8.727
272 HG3 ARG 43 2HG ARG 43 0.107 3.067 -9.142
273 HD2 ARG 43 1HD ARG 43 0.015 3.805 -11.375
274 HD3 ARG 43 2HD ARG 43 -1.677 4.280 -11.231
275 HE ARG 43 HE ARG 43 -1.019 6.263 -10.251
276 HH11 ARG 43 2HH1 ARG 43 1.703 4.115 -10.565
277 HH12 ARG 43 1HH1 ARG 43 2.874 5.333 -10.183
278 HH21 ARG 43 2HH2 ARG 43 0.514 7.875 -9.746
279 HH22 ARG 43 1HH2 ARG 43 2.197 7.471 -9.716
280 H THR 44 H THR 44 -1.855 -1.087 -9.462
281 HA THR 44 HA THR 44 -4.516 -1.441 -10.414
282 HB THR 44 HB THR 44 -2.335 -3.479 -9.930
283 HG1 THR 44 1HG THR 44 -1.797 -1.985 -11.548
284 HG21 THR 44 3HG2 THR 44 -4.516 -4.559 -9.950
285 HG22 THR 44 1HG2 THR 44 -3.643 -4.927 -11.436
286 HG23 THR 44 2HG2 THR 44 -4.935 -3.728 -11.447
287 H HIS 45 H HIS 45 -2.736 -2.964 -7.721
288 HA HIS 45 HA HIS 45 -4.569 -4.564 -6.594
289 HB2 HIS 45 1HB HIS 45 -3.389 -4.424 -4.624
290 HB3 HIS 45 2HB HIS 45 -2.224 -3.699 -5.728
291 HD1 HIS 45 1HD HIS 45 -1.672 -1.232 -5.405
292 HD2 HIS 45 2HD HIS 45 -4.664 -2.598 -2.867
293 HE1 HIS 45 1HE HIS 45 -2.011 0.601 -3.717
294 H GLY 46 H GLY 46 -4.411 -1.065 -5.901
295 HA2 GLY 46 1HA GLY 46 -7.310 -0.992 -5.674
296 HA3 GLY 46 2HA GLY 46 -6.424 -0.635 -4.199
297 H THR 47 H THR 47 -7.864 1.367 -4.725
298 HA THR 47 HA THR 47 -6.326 3.230 -6.410
299 HB THR 47 HB THR 47 -8.743 2.866 -7.009
300 HG1 THR 47 1HG THR 47 -8.938 4.978 -7.542
301 HG21 THR 47 3HG2 THR 47 -9.832 2.636 -4.934
302 HG22 THR 47 1HG2 THR 47 -10.350 4.207 -5.543
303 HG23 THR 47 2HG2 THR 47 -9.108 4.111 -4.295
304 H CYS 48 H CYS 48 -6.072 2.372 -3.459
305 HA CYS 48 HA CYS 48 -6.753 4.424 -1.736
306 HB2 CYS 48 1HB CYS 48 -4.106 3.024 -1.494
307 HB3 CYS 48 2HB CYS 48 -5.216 3.517 -0.219
308 H ALA 49 H ALA 49 -4.235 4.298 -4.131
309 HA ALA 49 HA ALA 49 -2.649 6.436 -3.170
310 HB1 ALA 49 3HB ALA 49 -2.970 5.254 -5.920
311 HB2 ALA 49 1HB ALA 49 -1.804 6.520 -5.533
312 HB3 ALA 49 2HB ALA 49 -1.687 4.944 -4.750
313 H GLU 50 H GLU 50 -4.913 6.390 -5.933
314 HA GLU 50 HA GLU 50 -5.001 8.960 -6.674
315 HB2 GLU 50 1HB GLU 50 -7.233 6.988 -6.331
316 HB3 GLU 50 2HB GLU 50 -7.581 8.621 -6.881
317 HG2 GLU 50 1HG GLU 50 -5.623 6.774 -8.222
318 HG3 GLU 50 2HG GLU 50 -7.310 6.951 -8.700
319 H ASN 51 H ASN 51 -6.209 7.705 -3.651
320 HA ASN 51 HA ASN 51 -6.762 10.463 -2.789
321 HB2 ASN 51 1HB ASN 51 -8.611 9.532 -1.362
322 HB3 ASN 51 2HB ASN 51 -8.921 9.459 -3.094
323 HD21 ASN 51 1HD2 ASN 51 -9.165 7.787 -0.305
324 HD22 ASN 51 2HD2 ASN 51 -9.171 6.173 -0.922
325 H PHE 52 H PHE 52 -4.328 9.568 -2.330
326 HA PHE 52 HA PHE 52 -4.138 8.142 0.173
327 HB2 PHE 52 1HB PHE 52 -1.659 8.735 -0.098
328 HB3 PHE 52 2HB PHE 52 -2.369 7.681 -1.317
329 HD1 PHE 52 2HD PHE 52 -2.223 11.379 -0.812
330 HD2 PHE 52 1HD PHE 52 -1.508 8.074 -3.398
331 HE1 PHE 52 2HE PHE 52 -1.478 12.924 -2.575
332 HE2 PHE 52 1HE PHE 52 -0.761 9.615 -5.165
333 HZ PHE 52 HZ PHE 52 -0.746 12.043 -4.755
334 H TYR 53 H TYR 53 -5.332 10.986 -0.256
335 HA TYR 53 HA TYR 53 -3.808 12.303 1.894
336 HB2 TYR 53 1HB TYR 53 -5.174 14.361 0.965
337 HB3 TYR 53 2HB TYR 53 -3.689 13.837 0.179
338 HD1 TYR 53 1HD TYR 53 -3.905 12.278 -1.841
339 HD2 TYR 53 2HD TYR 53 -7.177 14.476 -0.238
340 HE1 TYR 53 1HE TYR 53 -5.119 12.007 -3.963
341 HE2 TYR 53 2HE TYR 53 -8.400 14.210 -2.355
342 HH TYR 53 HH TYR 53 -7.934 13.774 -4.708
343 H SER 54 H SER 54 -4.999 11.039 3.453
344 HA SER 54 HA SER 54 -7.852 11.585 3.683
345 HB2 SER 54 1HB SER 54 -7.865 9.910 5.429
346 HB3 SER 54 2HB SER 54 -6.947 9.282 4.060
347 HG SER 54 HG SER 54 -6.132 9.813 6.608
348 H GLY 55 H GLY 55 -8.790 12.412 5.640
349 HA2 GLY 55 1HA GLY 55 -8.556 13.462 7.794
350 HA3 GLY 55 2HA GLY 55 -6.938 13.963 7.326
351 HA PRO 56 HA PRO 56 -9.024 17.863 6.715
352 HB2 PRO 56 1HB PRO 56 -6.768 19.277 6.183
353 HB3 PRO 56 2HB PRO 56 -7.253 18.821 7.821
354 HG2 PRO 56 1HG PRO 56 -5.252 17.528 6.008
355 HG3 PRO 56 2HG PRO 56 -5.133 17.867 7.744
356 HD2 PRO 56 1HD PRO 56 -5.740 15.411 6.778
357 HD3 PRO 56 2HD PRO 56 -6.381 16.016 8.319
358 H SER 57 H SER 57 -9.296 19.367 4.961
359 HA SER 57 HA SER 57 -8.956 18.088 2.369
360 HB2 SER 57 1HB SER 57 -11.158 18.940 2.797
361 HB3 SER 57 2HB SER 57 -10.520 20.517 3.260
362 HG SER 57 HG SER 57 -10.355 21.051 1.224
363 H SER 58 H SER 58 -6.846 18.365 1.772
364 HA SER 58 HA SER 58 -5.696 21.049 1.827
365 HB2 SER 58 1HB SER 58 -3.607 19.871 1.086
366 HB3 SER 58 2HB SER 58 -4.239 19.304 2.632
367 HG SER 58 HG SER 58 -4.545 18.059 0.099
368 H GLY 59 H GLY 59 -6.796 22.109 0.188
369 HA2 GLY 59 1HA GLY 59 -5.788 21.657 -2.459
370 HA3 GLY 59 2HA GLY 59 -7.487 21.233 -2.313
Start of MODEL 12
1 H1 GLY 1 1H GLY 1 -2.080 -19.993 14.942
2 HA2 GLY 1 1HA GLY 1 -1.921 -18.594 17.435
3 HA3 GLY 1 2HA GLY 1 -0.566 -19.167 16.474
4 H SER 2 H SER 2 0.301 -17.054 17.297
5 HA SER 2 HA SER 2 0.282 -15.151 15.195
6 HB2 SER 2 1HB SER 2 -1.898 -14.665 16.472
7 HB3 SER 2 2HB SER 2 -0.860 -14.072 17.768
8 HG SER 2 HG SER 2 -1.566 -12.867 15.457
9 H SER 3 H SER 3 2.073 -13.879 15.265
10 HA SER 3 HA SER 3 3.478 -13.269 17.671
11 HB2 SER 3 1HB SER 3 5.497 -14.574 17.265
12 HB3 SER 3 2HB SER 3 4.111 -15.655 17.405
13 HG SER 3 HG SER 3 4.735 -14.755 14.853
14 H GLY 4 H GLY 4 5.387 -11.966 17.289
15 HA2 GLY 4 1HA GLY 4 6.649 -11.212 15.058
16 HA3 GLY 4 2HA GLY 4 5.101 -10.406 14.850
17 H SER 5 H SER 5 8.018 -9.575 15.461
18 HA SER 5 HA SER 5 7.574 -8.047 17.914
19 HB2 SER 5 1HB SER 5 9.703 -9.189 17.792
20 HB3 SER 5 2HB SER 5 10.051 -8.460 16.224
21 HG SER 5 HG SER 5 10.610 -7.500 18.624
22 H SER 6 H SER 6 7.967 -5.767 17.989
23 HA SER 6 HA SER 6 6.892 -4.401 15.694
24 HB2 SER 6 1HB SER 6 6.312 -3.834 18.082
25 HB3 SER 6 2HB SER 6 7.937 -3.172 18.253
26 HG SER 6 HG SER 6 5.770 -2.225 16.751
27 H GLY 7 H GLY 7 7.900 -2.477 14.758
28 HA2 GLY 7 1HA GLY 7 9.901 -1.146 14.426
29 HA3 GLY 7 2HA GLY 7 10.848 -2.565 14.849
30 H MET 8 H MET 8 12.014 -2.986 13.073
31 HA MET 8 HA MET 8 11.386 -2.458 10.446
32 HB2 MET 8 1HB MET 8 13.019 -4.771 11.504
33 HB3 MET 8 2HB MET 8 13.047 -4.183 9.848
34 HG2 MET 8 1HG MET 8 14.145 -2.226 10.425
35 HG3 MET 8 2HG MET 8 13.679 -2.349 12.119
36 HE1 MET 8 3HE MET 8 17.012 -4.734 10.032
37 HE2 MET 8 1HE MET 8 15.334 -5.230 9.809
38 HE3 MET 8 2HE MET 8 15.863 -3.639 9.262
39 H GLU 9 H GLU 9 10.088 -3.321 8.944
40 HA GLU 9 HA GLU 9 8.688 -5.822 9.625
41 HB2 GLU 9 1HB GLU 9 7.735 -3.497 7.945
42 HB3 GLU 9 2HB GLU 9 6.843 -4.990 8.195
43 HG2 GLU 9 1HG GLU 9 6.753 -4.520 10.600
44 HG3 GLU 9 2HG GLU 9 7.606 -3.002 10.321
45 HA PRO 10 HA PRO 10 10.833 -7.465 6.089
46 HB2 PRO 10 1HB PRO 10 9.674 -9.918 6.171
47 HB3 PRO 10 2HB PRO 10 10.961 -9.427 7.277
48 HG2 PRO 10 1HG PRO 10 8.003 -9.501 7.727
49 HG3 PRO 10 2HG PRO 10 9.312 -10.012 8.809
50 HD2 PRO 10 1HD PRO 10 8.039 -7.638 9.083
51 HD3 PRO 10 2HD PRO 10 9.751 -7.858 9.502
52 H ALA 11 H ALA 11 10.350 -7.235 4.001
53 HA ALA 11 HA ALA 11 7.831 -6.511 3.050
54 HB1 ALA 11 3HB ALA 11 9.145 -5.917 1.363
55 HB2 ALA 11 1HB ALA 11 10.445 -6.956 1.948
56 HB3 ALA 11 2HB ALA 11 9.208 -7.610 0.873
57 H GLY 12 H GLY 12 6.795 -7.760 1.116
58 HA2 GLY 12 1HA GLY 12 6.650 -10.635 1.726
59 HA3 GLY 12 2HA GLY 12 5.174 -9.681 1.711
60 HA PRO 13 HA PRO 13 6.410 -11.322 -2.593
61 HB2 PRO 13 1HB PRO 13 4.648 -13.380 -2.767
62 HB3 PRO 13 2HB PRO 13 6.288 -13.570 -2.137
63 HG2 PRO 13 1HG PRO 13 3.711 -13.262 -0.646
64 HG3 PRO 13 2HG PRO 13 5.064 -14.362 -0.325
65 HD2 PRO 13 1HD PRO 13 4.697 -12.062 1.056
66 HD3 PRO 13 2HD PRO 13 6.308 -12.728 0.721
67 H CYS 14 H CYS 14 5.503 -9.720 -3.759
68 HA CYS 14 HA CYS 14 3.160 -8.435 -3.574
69 HB2 CYS 14 1HB CYS 14 4.659 -7.758 -5.282
70 HB3 CYS 14 2HB CYS 14 4.597 -9.333 -6.067
71 H GLY 15 H GLY 15 1.333 -9.471 -2.938
72 HA2 GLY 15 1HA GLY 15 0.449 -11.879 -4.298
73 HA3 GLY 15 2HA GLY 15 -0.343 -11.096 -2.939
74 H PHE 16 H PHE 16 0.590 -9.616 -6.008
75 HA PHE 16 HA PHE 16 -2.263 -9.322 -6.664
76 HB2 PHE 16 1HB PHE 16 -0.139 -7.187 -6.958
77 HB3 PHE 16 2HB PHE 16 -1.819 -7.039 -7.461
78 HD1 PHE 16 1HD PHE 16 -3.366 -8.036 -5.291
79 HD2 PHE 16 2HD PHE 16 0.260 -5.810 -5.170
80 HE1 PHE 16 1HE PHE 16 -3.961 -7.194 -3.057
81 HE2 PHE 16 2HE PHE 16 -0.328 -4.966 -2.935
82 HZ PHE 16 HZ PHE 16 -2.441 -5.658 -1.875
83 H CYS 17 H CYS 17 1.046 -9.588 -7.774
84 HA CYS 17 HA CYS 17 0.668 -9.320 -10.522
85 HB2 CYS 17 1HB CYS 17 2.690 -10.617 -8.780
86 HB3 CYS 17 2HB CYS 17 2.659 -11.127 -10.464
87 HA PRO 18 HA PRO 18 -1.451 -12.906 -11.898
88 HB2 PRO 18 1HB PRO 18 -0.164 -13.482 -14.218
89 HB3 PRO 18 2HB PRO 18 -1.240 -12.090 -14.036
90 HG2 PRO 18 1HG PRO 18 1.750 -12.202 -13.923
91 HG3 PRO 18 2HG PRO 18 0.704 -11.013 -14.722
92 HD2 PRO 18 1HD PRO 18 1.873 -10.546 -12.324
93 HD3 PRO 18 2HD PRO 18 0.289 -9.873 -12.762
94 H ALA 19 H ALA 19 -1.412 -15.043 -11.502
95 HA ALA 19 HA ALA 19 0.372 -16.412 -10.088
96 HB1 ALA 19 3HB ALA 19 -0.332 -18.455 -11.651
97 HB2 ALA 19 1HB ALA 19 -1.437 -17.718 -10.491
98 HB3 ALA 19 2HB ALA 19 -1.520 -17.270 -12.195
99 H GLY 20 H GLY 20 2.442 -16.981 -10.221
100 HA2 GLY 20 1HA GLY 20 4.250 -18.070 -11.362
101 HA3 GLY 20 2HA GLY 20 3.612 -17.456 -12.880
102 H GLU 21 H GLU 21 3.280 -14.795 -12.356
103 HA GLU 21 HA GLU 21 6.036 -13.903 -12.325
104 HB2 GLU 21 1HB GLU 21 3.537 -12.248 -12.698
105 HB3 GLU 21 2HB GLU 21 5.183 -11.787 -13.107
106 HG2 GLU 21 1HG GLU 21 5.083 -13.889 -14.648
107 HG3 GLU 21 2HG GLU 21 3.340 -13.667 -14.499
108 H VAL 22 H VAL 22 5.276 -14.851 -9.839
109 HA VAL 22 HA VAL 22 4.448 -12.702 -8.126
110 HB VAL 22 HB VAL 22 5.651 -15.395 -7.471
111 HG11 VAL 22 1HG1 VAL 22 6.094 -14.358 -5.508
112 HG12 VAL 22 2HG1 VAL 22 4.893 -13.094 -5.777
113 HG13 VAL 22 3HG1 VAL 22 4.387 -14.689 -5.218
114 HG21 VAL 22 3HG2 VAL 22 3.618 -16.150 -7.982
115 HG22 VAL 22 1HG2 VAL 22 3.017 -15.258 -6.585
116 HG23 VAL 22 2HG2 VAL 22 2.991 -14.514 -8.184
117 H GLN 23 H GLN 23 5.693 -11.086 -7.479
118 HA GLN 23 HA GLN 23 8.598 -11.538 -7.280
119 HB2 GLN 23 1HB GLN 23 7.110 -9.020 -8.038
120 HB3 GLN 23 2HB GLN 23 8.841 -9.094 -7.737
121 HG2 GLN 23 1HG GLN 23 8.904 -10.871 -9.567
122 HG3 GLN 23 2HG GLN 23 7.278 -10.326 -9.975
123 HE21 GLN 23 1HE2 GLN 23 9.720 -10.198 -11.547
124 HE22 GLN 23 2HE2 GLN 23 9.969 -8.530 -11.920
125 HA PRO 24 HA PRO 24 8.427 -10.430 -3.036
126 HB2 PRO 24 1HB PRO 24 10.859 -9.268 -2.712
127 HB3 PRO 24 2HB PRO 24 10.647 -11.010 -2.925
128 HG2 PRO 24 1HG PRO 24 11.425 -8.936 -4.938
129 HG3 PRO 24 2HG PRO 24 12.095 -10.559 -4.687
130 HD2 PRO 24 1HD PRO 24 10.313 -10.005 -6.650
131 HD3 PRO 24 2HD PRO 24 10.378 -11.582 -5.836
132 H ALA 25 H ALA 25 6.924 -8.868 -2.659
133 HA ALA 25 HA ALA 25 7.081 -6.213 -3.632
134 HB1 ALA 25 3HB ALA 25 5.160 -7.767 -2.367
135 HB2 ALA 25 1HB ALA 25 5.489 -6.459 -1.230
136 HB3 ALA 25 2HB ALA 25 4.990 -6.089 -2.881
137 H ARG 26 H ARG 26 8.949 -5.166 -3.094
138 HA ARG 26 HA ARG 26 10.062 -5.213 -0.465
139 HB2 ARG 26 1HB ARG 26 10.620 -3.663 -2.971
140 HB3 ARG 26 2HB ARG 26 11.376 -3.186 -1.457
141 HG2 ARG 26 1HG ARG 26 12.657 -5.092 -1.337
142 HG3 ARG 26 2HG ARG 26 11.555 -6.023 -2.353
143 HD2 ARG 26 1HD ARG 26 12.923 -3.672 -3.551
144 HD3 ARG 26 2HD ARG 26 13.876 -5.127 -3.259
145 HE ARG 26 HE ARG 26 11.385 -5.549 -4.666
146 HH11 ARG 26 2HH1 ARG 26 14.802 -4.931 -4.916
147 HH12 ARG 26 1HH1 ARG 26 14.927 -5.545 -6.531
148 HH21 ARG 26 2HH2 ARG 26 11.537 -6.360 -6.792
149 HH22 ARG 26 1HH2 ARG 26 13.069 -6.357 -7.598
150 H TYR 27 H TYR 27 7.655 -3.325 -2.047
151 HA TYR 27 HA TYR 27 7.683 -1.375 0.159
152 HB2 TYR 27 1HB TYR 27 6.142 -0.986 -2.388
153 HB3 TYR 27 2HB TYR 27 6.748 0.226 -1.264
154 HD1 TYR 27 1HD TYR 27 9.321 0.473 -1.105
155 HD2 TYR 27 2HD TYR 27 7.334 -1.468 -4.328
156 HE1 TYR 27 1HE TYR 27 11.310 0.792 -2.516
157 HE2 TYR 27 2HE TYR 27 9.317 -1.155 -5.747
158 HH TYR 27 HH TYR 27 11.545 0.908 -5.364
159 H THR 28 H THR 28 5.219 -0.389 0.175
160 HA THR 28 HA THR 28 3.157 -2.359 0.015
161 HB THR 28 HB THR 28 3.546 -1.508 2.837
162 HG1 THR 28 1HG THR 28 5.545 -2.322 2.650
163 HG21 THR 28 3HG2 THR 28 2.708 -4.159 1.669
164 HG22 THR 28 1HG2 THR 28 1.587 -2.834 1.976
165 HG23 THR 28 2HG2 THR 28 2.459 -3.579 3.315
166 H CYS 29 H CYS 29 1.192 -1.411 -0.053
167 HA CYS 29 HA CYS 29 0.967 1.369 -0.299
168 HB2 CYS 29 1HB CYS 29 -0.592 -0.288 -1.311
169 HB3 CYS 29 2HB CYS 29 -1.254 -0.598 0.290
170 HA PRO 30 HA PRO 30 0.977 2.338 4.073
171 HB2 PRO 30 1HB PRO 30 0.945 5.030 3.725
172 HB3 PRO 30 2HB PRO 30 2.409 4.056 3.547
173 HG2 PRO 30 1HG PRO 30 0.570 5.116 1.436
174 HG3 PRO 30 2HG PRO 30 2.343 5.074 1.457
175 HD2 PRO 30 1HD PRO 30 0.860 3.272 0.084
176 HD3 PRO 30 2HD PRO 30 2.424 2.862 0.817
177 H ARG 31 H ARG 31 -1.480 2.361 1.934
178 HA ARG 31 HA ARG 31 -3.308 3.854 3.691
179 HB2 ARG 31 1HB ARG 31 -3.238 3.335 0.769
180 HB3 ARG 31 2HB ARG 31 -4.824 3.373 1.528
181 HG2 ARG 31 1HG ARG 31 -2.955 5.588 2.147
182 HG3 ARG 31 2HG ARG 31 -3.676 5.540 0.537
183 HD2 ARG 31 1HD ARG 31 -5.066 5.698 3.199
184 HD3 ARG 31 2HD ARG 31 -5.114 6.861 1.875
185 HE ARG 31 HE ARG 31 -6.175 4.705 0.718
186 HH11 ARG 31 2HH1 ARG 31 -6.798 6.183 3.808
187 HH12 ARG 31 1HH1 ARG 31 -8.459 5.689 3.855
188 HH21 ARG 31 2HH2 ARG 31 -8.359 4.049 0.768
189 HH22 ARG 31 1HH2 ARG 31 -9.345 4.475 2.126
190 H CYS 32 H CYS 32 -2.722 0.757 2.150
191 HA CYS 32 HA CYS 32 -4.736 -0.436 3.923
192 HB2 CYS 32 1HB CYS 32 -5.597 -1.841 2.191
193 HB3 CYS 32 2HB CYS 32 -5.617 -0.193 1.573
194 H ASN 33 H ASN 33 -1.661 -0.203 3.585
195 HA ASN 33 HA ASN 33 0.194 -1.521 3.811
196 HB2 ASN 33 1HB ASN 33 -1.832 -3.031 5.472
197 HB3 ASN 33 2HB ASN 33 -0.102 -3.364 5.497
198 HD21 ASN 33 1HD2 ASN 33 1.159 -1.122 5.657
199 HD22 ASN 33 2HD2 ASN 33 0.654 -0.153 6.996
200 H ALA 34 H ALA 34 -0.641 -1.978 1.374
201 HA ALA 34 HA ALA 34 -0.837 -4.898 1.055
202 HB1 ALA 34 3HB ALA 34 -1.371 -4.041 -1.409
203 HB2 ALA 34 1HB ALA 34 -2.611 -4.175 -0.162
204 HB3 ALA 34 2HB ALA 34 -1.877 -2.610 -0.512
205 HA PRO 35 HA PRO 35 3.444 -4.604 -0.203
206 HB2 PRO 35 1HB PRO 35 3.778 -7.270 -0.594
207 HB3 PRO 35 2HB PRO 35 3.780 -6.527 1.010
208 HG2 PRO 35 1HG PRO 35 1.570 -7.964 -0.408
209 HG3 PRO 35 2HG PRO 35 2.075 -8.083 1.287
210 HD2 PRO 35 1HD PRO 35 -0.058 -6.612 0.503
211 HD3 PRO 35 2HD PRO 35 0.957 -6.159 1.887
212 H TYR 36 H TYR 36 3.789 -3.807 -2.185
213 HA TYR 36 HA TYR 36 2.857 -5.383 -4.496
214 HB2 TYR 36 1HB TYR 36 2.743 -3.251 -5.753
215 HB3 TYR 36 2HB TYR 36 1.641 -3.283 -4.380
216 HD1 TYR 36 2HD TYR 36 4.885 -1.953 -5.570
217 HD2 TYR 36 1HD TYR 36 1.803 -1.678 -2.650
218 HE1 TYR 36 2HE TYR 36 5.860 0.150 -4.748
219 HE2 TYR 36 1HE TYR 36 2.769 0.426 -1.820
220 HH TYR 36 HH TYR 36 4.571 2.327 -3.287
221 H CYS 37 H CYS 37 4.276 -5.749 -6.157
222 HA CYS 37 HA CYS 37 7.036 -5.734 -5.552
223 HB2 CYS 37 1HB CYS 37 7.344 -6.557 -7.845
224 HB3 CYS 37 2HB CYS 37 6.033 -7.407 -7.033
225 H SER 38 H SER 38 5.088 -3.784 -7.794
226 HA SER 38 HA SER 38 7.098 -1.669 -7.620
227 HB2 SER 38 1HB SER 38 6.287 -3.109 -10.114
228 HB3 SER 38 2HB SER 38 6.652 -1.387 -10.207
229 HG SER 38 HG SER 38 8.369 -3.341 -10.241
230 H LEU 39 H LEU 39 6.225 0.321 -8.920
231 HA LEU 39 HA LEU 39 3.920 1.226 -7.662
232 HB2 LEU 39 1HB LEU 39 5.402 2.134 -10.101
233 HB3 LEU 39 2HB LEU 39 3.924 2.946 -9.589
234 HG LEU 39 HG LEU 39 6.015 4.074 -8.859
235 HD11 LEU 39 1HD1 LEU 39 4.382 4.820 -7.499
236 HD12 LEU 39 2HD1 LEU 39 5.247 3.876 -6.287
237 HD13 LEU 39 3HD1 LEU 39 3.831 3.196 -7.088
238 HD21 LEU 39 3HD2 LEU 39 6.334 1.699 -7.031
239 HD22 LEU 39 1HD2 LEU 39 7.375 3.120 -7.130
240 HD23 LEU 39 2HD2 LEU 39 7.305 1.982 -8.476
241 H ARG 40 H ARG 40 4.326 -0.312 -10.805
242 HA ARG 40 HA ARG 40 1.864 0.139 -11.954
243 HB2 ARG 40 1HB ARG 40 2.185 -2.072 -13.089
244 HB3 ARG 40 2HB ARG 40 3.569 -0.992 -13.196
245 HG2 ARG 40 1HG ARG 40 4.832 -2.258 -11.714
246 HG3 ARG 40 2HG ARG 40 3.414 -3.072 -11.052
247 HD2 ARG 40 1HD ARG 40 4.189 -4.744 -12.385
248 HD3 ARG 40 2HD ARG 40 3.189 -3.896 -13.564
249 HE ARG 40 HE ARG 40 5.968 -3.075 -13.424
250 HH11 ARG 40 2HH1 ARG 40 3.562 -5.046 -14.987
251 HH12 ARG 40 1HH1 ARG 40 4.485 -5.253 -16.438
252 HH21 ARG 40 2HH2 ARG 40 7.195 -3.341 -15.329
253 HH22 ARG 40 1HH2 ARG 40 6.552 -4.283 -16.631
254 H CYS 41 H CYS 41 2.732 -2.178 -9.449
255 HA CYS 41 HA CYS 41 0.071 -3.330 -9.414
256 HB2 CYS 41 1HB CYS 41 2.668 -3.904 -8.075
257 HB3 CYS 41 2HB CYS 41 1.199 -4.422 -7.256
258 H TYR 42 H TYR 42 1.938 -0.971 -7.660
259 HA TYR 42 HA TYR 42 0.412 -0.839 -5.307
260 HB2 TYR 42 1HB TYR 42 2.502 0.250 -5.258
261 HB3 TYR 42 2HB TYR 42 2.166 1.149 -6.733
262 HD1 TYR 42 1HD TYR 42 0.800 0.761 -3.273
263 HD2 TYR 42 2HD TYR 42 1.609 3.378 -6.528
264 HE1 TYR 42 1HE TYR 42 0.023 2.666 -1.926
265 HE2 TYR 42 2HE TYR 42 0.835 5.291 -5.190
266 HH TYR 42 HH TYR 42 -0.227 5.909 -3.304
267 H ARG 43 H ARG 43 -0.144 0.390 -8.504
268 HA ARG 43 HA ARG 43 -2.347 2.081 -7.602
269 HB2 ARG 43 1HB ARG 43 -0.869 1.746 -10.184
270 HB3 ARG 43 2HB ARG 43 -2.478 2.456 -10.195
271 HG2 ARG 43 1HG ARG 43 -1.795 4.288 -8.891
272 HG3 ARG 43 2HG ARG 43 -0.286 3.497 -8.430
273 HD2 ARG 43 1HD ARG 43 0.284 5.113 -10.059
274 HD3 ARG 43 2HD ARG 43 0.344 3.550 -10.873
275 HE ARG 43 HE ARG 43 -2.140 4.342 -11.437
276 HH11 ARG 43 2HH1 ARG 43 0.896 6.038 -11.603
277 HH12 ARG 43 1HH1 ARG 43 0.404 7.057 -12.914
278 HH21 ARG 43 2HH2 ARG 43 -2.799 5.678 -13.164
279 HH22 ARG 43 1HH2 ARG 43 -1.698 6.853 -13.801
280 H THR 44 H THR 44 -1.730 -0.887 -9.368
281 HA THR 44 HA THR 44 -4.393 -1.262 -10.299
282 HB THR 44 HB THR 44 -2.149 -3.253 -9.923
283 HG1 THR 44 1HG THR 44 -3.158 -1.923 -12.237
284 HG21 THR 44 3HG2 THR 44 -3.811 -4.768 -10.119
285 HG22 THR 44 1HG2 THR 44 -3.765 -4.322 -11.824
286 HG23 THR 44 2HG2 THR 44 -4.954 -3.583 -10.751
287 H HIS 45 H HIS 45 -2.555 -2.825 -7.670
288 HA HIS 45 HA HIS 45 -4.315 -4.519 -6.580
289 HB2 HIS 45 1HB HIS 45 -3.161 -4.360 -4.589
290 HB3 HIS 45 2HB HIS 45 -2.015 -3.592 -5.684
291 HD1 HIS 45 1HD HIS 45 -1.446 -1.168 -5.261
292 HD2 HIS 45 2HD HIS 45 -4.583 -2.530 -2.902
293 HE1 HIS 45 1HE HIS 45 -1.864 0.655 -3.581
294 H GLY 46 H GLY 46 -4.317 -1.035 -5.795
295 HA2 GLY 46 1HA GLY 46 -7.214 -1.077 -5.611
296 HA3 GLY 46 2HA GLY 46 -6.376 -0.771 -4.097
297 H THR 47 H THR 47 -8.101 1.099 -5.068
298 HA THR 47 HA THR 47 -6.478 3.136 -6.401
299 HB THR 47 HB THR 47 -8.590 4.426 -6.560
300 HG1 THR 47 1HG THR 47 -10.395 2.593 -6.062
301 HG21 THR 47 3HG2 THR 47 -8.354 1.665 -7.674
302 HG22 THR 47 1HG2 THR 47 -8.247 3.220 -8.497
303 HG23 THR 47 2HG2 THR 47 -9.817 2.599 -7.986
304 H CYS 48 H CYS 48 -5.725 2.499 -3.772
305 HA CYS 48 HA CYS 48 -6.856 4.304 -1.883
306 HB2 CYS 48 1HB CYS 48 -4.099 3.079 -1.757
307 HB3 CYS 48 2HB CYS 48 -5.100 3.619 -0.413
308 H ALA 49 H ALA 49 -4.179 4.465 -4.144
309 HA ALA 49 HA ALA 49 -2.875 6.734 -3.162
310 HB1 ALA 49 3HB ALA 49 -2.545 6.935 -5.871
311 HB2 ALA 49 1HB ALA 49 -1.562 5.947 -4.790
312 HB3 ALA 49 2HB ALA 49 -2.916 5.224 -5.660
313 H GLU 50 H GLU 50 -5.369 6.521 -5.705
314 HA GLU 50 HA GLU 50 -5.690 9.085 -6.452
315 HB2 GLU 50 1HB GLU 50 -7.141 6.911 -6.894
316 HB3 GLU 50 2HB GLU 50 -8.195 7.652 -5.698
317 HG2 GLU 50 1HG GLU 50 -8.359 9.659 -7.063
318 HG3 GLU 50 2HG GLU 50 -7.275 8.944 -8.256
319 H ASN 51 H ASN 51 -6.883 7.692 -3.427
320 HA ASN 51 HA ASN 51 -8.065 10.171 -2.560
321 HB2 ASN 51 1HB ASN 51 -9.214 8.387 -1.648
322 HB3 ASN 51 2HB ASN 51 -7.753 7.433 -1.406
323 HD21 ASN 51 1HD2 ASN 51 -8.548 7.006 0.713
324 HD22 ASN 51 2HD2 ASN 51 -8.346 8.171 1.972
325 H PHE 52 H PHE 52 -5.320 8.188 -1.445
326 HA PHE 52 HA PHE 52 -4.319 9.694 0.569
327 HB2 PHE 52 1HB PHE 52 -3.196 7.676 0.022
328 HB3 PHE 52 2HB PHE 52 -2.852 8.223 -1.616
329 HD1 PHE 52 2HD PHE 52 -2.124 9.073 1.935
330 HD2 PHE 52 1HD PHE 52 -0.778 9.103 -2.103
331 HE1 PHE 52 2HE PHE 52 0.073 9.895 2.677
332 HE2 PHE 52 1HE PHE 52 1.422 9.923 -1.367
333 HZ PHE 52 HZ PHE 52 1.849 10.322 1.026
334 H TYR 53 H TYR 53 -3.207 10.102 -2.798
335 HA TYR 53 HA TYR 53 -2.274 12.785 -2.138
336 HB2 TYR 53 1HB TYR 53 -0.929 12.678 -4.029
337 HB3 TYR 53 2HB TYR 53 -0.979 10.993 -3.521
338 HD1 TYR 53 2HD TYR 53 -2.221 13.422 -5.994
339 HD2 TYR 53 1HD TYR 53 -2.047 9.322 -4.870
340 HE1 TYR 53 2HE TYR 53 -3.053 12.784 -8.218
341 HE2 TYR 53 1HE TYR 53 -2.878 8.672 -7.092
342 HH TYR 53 HH TYR 53 -2.788 9.866 -9.512
343 H SER 54 H SER 54 -2.958 14.647 -3.196
344 HA SER 54 HA SER 54 -5.641 14.453 -4.353
345 HB2 SER 54 1HB SER 54 -4.097 16.802 -3.234
346 HB3 SER 54 2HB SER 54 -5.694 16.935 -3.970
347 HG SER 54 HG SER 54 -5.515 16.656 -1.571
348 H GLY 55 H GLY 55 -5.610 14.184 -6.497
349 HA2 GLY 55 1HA GLY 55 -3.516 15.378 -8.117
350 HA3 GLY 55 2HA GLY 55 -4.793 14.310 -8.681
351 HA PRO 56 HA PRO 56 -5.648 18.774 -9.897
352 HB2 PRO 56 1HB PRO 56 -5.604 18.371 -12.581
353 HB3 PRO 56 2HB PRO 56 -4.162 18.790 -11.649
354 HG2 PRO 56 1HG PRO 56 -5.078 16.111 -12.621
355 HG3 PRO 56 2HG PRO 56 -3.447 16.808 -12.634
356 HD2 PRO 56 1HD PRO 56 -4.252 15.020 -10.767
357 HD3 PRO 56 2HD PRO 56 -3.078 16.304 -10.415
358 H SER 57 H SER 57 -6.979 15.689 -10.244
359 HA SER 57 HA SER 57 -9.161 16.000 -11.898
360 HB2 SER 57 1HB SER 57 -8.390 13.913 -10.616
361 HB3 SER 57 2HB SER 57 -9.347 14.531 -9.270
362 HG SER 57 HG SER 57 -10.804 14.628 -11.513
363 H SER 58 H SER 58 -10.618 17.569 -11.918
364 HA SER 58 HA SER 58 -11.768 18.448 -9.354
365 HB2 SER 58 1HB SER 58 -11.857 20.734 -10.141
366 HB3 SER 58 2HB SER 58 -10.199 20.154 -10.296
367 HG SER 58 HG SER 58 -12.133 20.329 -12.368
368 H GLY 59 H GLY 59 -12.231 18.298 -12.874
369 HA2 GLY 59 1HA GLY 59 -14.813 19.018 -13.212
370 HA3 GLY 59 2HA GLY 59 -14.110 17.647 -14.059
Start of MODEL 13
1 H1 GLY 1 1H GLY 1 6.733 -17.328 13.963
2 HA2 GLY 1 1HA GLY 1 8.602 -17.246 15.848
3 HA3 GLY 1 2HA GLY 1 9.155 -18.636 14.925
4 H SER 2 H SER 2 8.197 -15.236 14.505
5 HA SER 2 HA SER 2 9.752 -15.025 12.073
6 HB2 SER 2 1HB SER 2 8.831 -12.855 11.838
7 HB3 SER 2 2HB SER 2 7.533 -13.830 12.526
8 HG SER 2 HG SER 2 7.667 -11.924 13.679
9 H SER 3 H SER 3 11.292 -13.164 11.833
10 HA SER 3 HA SER 3 12.615 -12.131 14.136
11 HB2 SER 3 1HB SER 3 13.581 -14.301 14.368
12 HB3 SER 3 2HB SER 3 13.903 -14.417 12.638
13 HG SER 3 HG SER 3 15.070 -12.424 14.274
14 H GLY 4 H GLY 4 13.706 -10.322 13.613
15 HA2 GLY 4 1HA GLY 4 15.339 -9.383 11.921
16 HA3 GLY 4 2HA GLY 4 14.114 -9.805 10.734
17 H SER 5 H SER 5 13.819 -8.295 13.938
18 HA SER 5 HA SER 5 12.196 -6.190 12.729
19 HB2 SER 5 1HB SER 5 11.533 -5.640 15.013
20 HB3 SER 5 2HB SER 5 11.337 -7.370 14.731
21 HG SER 5 HG SER 5 13.622 -7.406 15.654
22 H SER 6 H SER 6 14.863 -6.010 12.050
23 HA SER 6 HA SER 6 15.799 -3.728 13.663
24 HB2 SER 6 1HB SER 6 17.419 -5.692 12.024
25 HB3 SER 6 2HB SER 6 18.081 -4.277 12.843
26 HG SER 6 HG SER 6 17.593 -6.697 13.846
27 H GLY 7 H GLY 7 14.671 -2.162 12.497
28 HA2 GLY 7 1HA GLY 7 15.532 -0.518 10.776
29 HA3 GLY 7 2HA GLY 7 15.458 -1.878 9.665
30 H MET 8 H MET 8 13.409 -2.703 9.042
31 HA MET 8 HA MET 8 11.007 -1.360 9.895
32 HB2 MET 8 1HB MET 8 12.278 0.016 8.012
33 HB3 MET 8 2HB MET 8 11.493 -1.154 6.961
34 HG2 MET 8 1HG MET 8 9.955 0.538 6.979
35 HG3 MET 8 2HG MET 8 9.351 -0.490 8.277
36 HE1 MET 8 3HE MET 8 9.324 -0.221 10.403
37 HE2 MET 8 1HE MET 8 10.321 0.850 11.389
38 HE3 MET 8 2HE MET 8 8.703 1.354 10.900
39 H GLU 9 H GLU 9 9.079 -2.333 9.033
40 HA GLU 9 HA GLU 9 8.845 -4.981 9.081
41 HB2 GLU 9 1HB GLU 9 6.861 -3.719 8.827
42 HB3 GLU 9 2HB GLU 9 7.391 -3.045 7.292
43 HG2 GLU 9 1HG GLU 9 7.203 -5.277 6.275
44 HG3 GLU 9 2HG GLU 9 6.600 -5.902 7.808
45 HA PRO 10 HA PRO 10 11.248 -6.686 5.792
46 HB2 PRO 10 1HB PRO 10 10.247 -9.208 5.880
47 HB3 PRO 10 2HB PRO 10 11.377 -8.580 7.086
48 HG2 PRO 10 1HG PRO 10 8.398 -8.838 7.235
49 HG3 PRO 10 2HG PRO 10 9.616 -9.209 8.469
50 HD2 PRO 10 1HD PRO 10 8.172 -6.919 8.490
51 HD3 PRO 10 2HD PRO 10 9.840 -7.001 9.091
52 H ALA 11 H ALA 11 11.029 -7.385 3.646
53 HA ALA 11 HA ALA 11 8.776 -6.443 2.251
54 HB1 ALA 11 3HB ALA 11 10.917 -8.339 1.294
55 HB2 ALA 11 1HB ALA 11 9.803 -7.430 0.273
56 HB3 ALA 11 2HB ALA 11 11.002 -6.578 1.248
57 H GLY 12 H GLY 12 7.396 -7.734 0.785
58 HA2 GLY 12 1HA GLY 12 6.866 -10.452 1.780
59 HA3 GLY 12 2HA GLY 12 5.557 -9.281 1.730
60 HA PRO 13 HA PRO 13 6.173 -11.610 -2.386
61 HB2 PRO 13 1HB PRO 13 4.118 -13.372 -2.173
62 HB3 PRO 13 2HB PRO 13 5.759 -13.740 -1.629
63 HG2 PRO 13 1HG PRO 13 3.389 -12.852 -0.031
64 HG3 PRO 13 2HG PRO 13 4.587 -14.104 0.346
65 HD2 PRO 13 1HD PRO 13 4.680 -11.625 1.431
66 HD3 PRO 13 2HD PRO 13 6.142 -12.571 1.084
67 H CYS 14 H CYS 14 5.320 -10.380 -3.931
68 HA CYS 14 HA CYS 14 2.902 -8.896 -3.540
69 HB2 CYS 14 1HB CYS 14 4.717 -7.917 -4.819
70 HB3 CYS 14 2HB CYS 14 4.663 -9.245 -5.974
71 H GLY 15 H GLY 15 1.410 -10.651 -3.188
72 HA2 GLY 15 1HA GLY 15 0.871 -12.731 -4.946
73 HA3 GLY 15 2HA GLY 15 -0.318 -11.992 -3.885
74 H PHE 16 H PHE 16 -0.256 -9.388 -5.048
75 HA PHE 16 HA PHE 16 -2.267 -9.496 -6.885
76 HB2 PHE 16 1HB PHE 16 -0.095 -7.410 -7.045
77 HB3 PHE 16 2HB PHE 16 -1.804 -7.226 -7.424
78 HD1 PHE 16 1HD PHE 16 -3.205 -8.265 -5.174
79 HD2 PHE 16 2HD PHE 16 0.447 -6.081 -5.258
80 HE1 PHE 16 1HE PHE 16 -3.629 -7.476 -2.882
81 HE2 PHE 16 2HE PHE 16 0.030 -5.289 -2.966
82 HZ PHE 16 HZ PHE 16 -2.009 -5.987 -1.775
83 H CYS 17 H CYS 17 1.039 -10.263 -7.394
84 HA CYS 17 HA CYS 17 0.879 -10.020 -10.285
85 HB2 CYS 17 1HB CYS 17 3.022 -10.561 -8.301
86 HB3 CYS 17 2HB CYS 17 3.229 -11.263 -9.902
87 HA PRO 18 HA PRO 18 -0.271 -14.156 -11.194
88 HB2 PRO 18 1HB PRO 18 1.206 -14.669 -13.414
89 HB3 PRO 18 2HB PRO 18 -0.184 -13.577 -13.416
90 HG2 PRO 18 1HG PRO 18 2.734 -12.927 -13.268
91 HG3 PRO 18 2HG PRO 18 1.460 -12.142 -14.219
92 HD2 PRO 18 1HD PRO 18 2.385 -11.112 -11.892
93 HD3 PRO 18 2HD PRO 18 0.702 -10.913 -12.422
94 H ALA 19 H ALA 19 0.272 -16.113 -10.445
95 HA ALA 19 HA ALA 19 2.336 -16.788 -8.903
96 HB1 ALA 19 3HB ALA 19 1.802 -19.013 -9.188
97 HB2 ALA 19 1HB ALA 19 0.336 -18.216 -9.758
98 HB3 ALA 19 2HB ALA 19 1.513 -18.833 -10.919
99 H GLY 20 H GLY 20 4.479 -17.034 -9.027
100 HA2 GLY 20 1HA GLY 20 6.460 -17.848 -10.094
101 HA3 GLY 20 2HA GLY 20 5.694 -17.568 -11.651
102 H GLU 21 H GLU 21 4.849 -14.998 -11.496
103 HA GLU 21 HA GLU 21 7.359 -13.569 -11.645
104 HB2 GLU 21 1HB GLU 21 4.521 -12.930 -12.391
105 HB3 GLU 21 2HB GLU 21 5.736 -11.661 -12.332
106 HG2 GLU 21 1HG GLU 21 5.729 -14.103 -14.083
107 HG3 GLU 21 2HG GLU 21 5.555 -12.421 -14.580
108 H VAL 22 H VAL 22 4.922 -14.052 -9.337
109 HA VAL 22 HA VAL 22 4.609 -11.715 -7.977
110 HB VAL 22 HB VAL 22 3.501 -13.681 -7.189
111 HG11 VAL 22 1HG1 VAL 22 5.779 -15.025 -7.710
112 HG12 VAL 22 2HG1 VAL 22 5.866 -14.927 -5.951
113 HG13 VAL 22 3HG1 VAL 22 4.464 -15.666 -6.725
114 HG21 VAL 22 3HG2 VAL 22 5.088 -13.473 -4.787
115 HG22 VAL 22 1HG2 VAL 22 4.819 -11.888 -5.513
116 HG23 VAL 22 2HG2 VAL 22 3.445 -12.914 -5.100
117 H GLN 23 H GLN 23 6.331 -10.316 -7.970
118 HA GLN 23 HA GLN 23 8.941 -11.117 -7.084
119 HB2 GLN 23 1HB GLN 23 7.690 -8.495 -7.848
120 HB3 GLN 23 2HB GLN 23 9.288 -8.548 -7.115
121 HG2 GLN 23 1HG GLN 23 8.581 -10.112 -9.578
122 HG3 GLN 23 2HG GLN 23 9.201 -8.463 -9.634
123 HE21 GLN 23 1HE2 GLN 23 10.153 -11.414 -10.188
124 HE22 GLN 23 2HE2 GLN 23 11.782 -11.377 -9.613
125 HA PRO 24 HA PRO 24 8.646 -10.394 -2.769
126 HB2 PRO 24 1HB PRO 24 11.069 -9.304 -2.213
127 HB3 PRO 24 2HB PRO 24 10.854 -11.010 -2.620
128 HG2 PRO 24 1HG PRO 24 11.740 -8.744 -4.363
129 HG3 PRO 24 2HG PRO 24 12.385 -10.392 -4.258
130 HD2 PRO 24 1HD PRO 24 10.700 -9.610 -6.228
131 HD3 PRO 24 2HD PRO 24 10.715 -11.265 -5.585
132 H ALA 25 H ALA 25 6.968 -8.736 -3.058
133 HA ALA 25 HA ALA 25 7.096 -6.113 -3.535
134 HB1 ALA 25 3HB ALA 25 5.774 -6.807 -0.966
135 HB2 ALA 25 1HB ALA 25 5.183 -5.845 -2.321
136 HB3 ALA 25 2HB ALA 25 5.215 -7.605 -2.436
137 H ARG 26 H ARG 26 8.779 -4.815 -3.114
138 HA ARG 26 HA ARG 26 10.229 -4.944 -0.631
139 HB2 ARG 26 1HB ARG 26 10.414 -3.116 -3.025
140 HB3 ARG 26 2HB ARG 26 11.443 -2.946 -1.609
141 HG2 ARG 26 1HG ARG 26 12.826 -4.234 -2.833
142 HG3 ARG 26 2HG ARG 26 11.858 -5.536 -2.137
143 HD2 ARG 26 1HD ARG 26 11.953 -6.006 -4.436
144 HD3 ARG 26 2HD ARG 26 10.359 -5.300 -4.177
145 HE ARG 26 HE ARG 26 11.767 -3.150 -4.875
146 HH11 ARG 26 2HH1 ARG 26 11.639 -6.337 -6.270
147 HH12 ARG 26 1HH1 ARG 26 11.981 -5.789 -7.877
148 HH21 ARG 26 2HH2 ARG 26 12.217 -2.416 -6.987
149 HH22 ARG 26 1HH2 ARG 26 12.310 -3.559 -8.284
150 H TYR 27 H TYR 27 7.693 -2.987 -2.005
151 HA TYR 27 HA TYR 27 7.731 -1.279 0.395
152 HB2 TYR 27 1HB TYR 27 6.175 -0.520 -2.038
153 HB3 TYR 27 2HB TYR 27 6.964 0.508 -0.847
154 HD1 TYR 27 1HD TYR 27 9.439 0.817 -0.938
155 HD2 TYR 27 2HD TYR 27 7.305 -1.208 -4.012
156 HE1 TYR 27 1HE TYR 27 11.356 1.108 -2.452
157 HE2 TYR 27 2HE TYR 27 9.216 -0.924 -5.534
158 HH TYR 27 HH TYR 27 11.794 1.173 -4.875
159 H THR 28 H THR 28 5.272 -0.253 0.454
160 HA THR 28 HA THR 28 3.224 -2.235 0.090
161 HB THR 28 HB THR 28 3.524 -1.454 2.951
162 HG1 THR 28 1HG THR 28 4.883 -3.284 3.278
163 HG21 THR 28 3HG2 THR 28 2.742 -4.132 1.859
164 HG22 THR 28 1HG2 THR 28 1.603 -2.787 1.822
165 HG23 THR 28 2HG2 THR 28 2.249 -3.353 3.363
166 H CYS 29 H CYS 29 1.186 -1.366 0.159
167 HA CYS 29 HA CYS 29 0.915 1.412 -0.146
168 HB2 CYS 29 1HB CYS 29 -0.626 -0.411 -1.029
169 HB3 CYS 29 2HB CYS 29 -1.326 -0.473 0.586
170 HA PRO 30 HA PRO 30 0.994 2.472 4.200
171 HB2 PRO 30 1HB PRO 30 0.843 5.153 3.804
172 HB3 PRO 30 2HB PRO 30 2.339 4.234 3.598
173 HG2 PRO 30 1HG PRO 30 0.397 5.180 1.526
174 HG3 PRO 30 2HG PRO 30 2.169 5.209 1.494
175 HD2 PRO 30 1HD PRO 30 0.719 3.323 0.200
176 HD3 PRO 30 2HD PRO 30 2.320 2.989 0.892
177 H ARG 31 H ARG 31 -1.525 2.367 2.130
178 HA ARG 31 HA ARG 31 -3.358 3.741 3.983
179 HB2 ARG 31 1HB ARG 31 -3.375 3.379 1.021
180 HB3 ARG 31 2HB ARG 31 -4.920 3.452 1.859
181 HG2 ARG 31 1HG ARG 31 -2.894 5.556 2.421
182 HG3 ARG 31 2HG ARG 31 -3.786 5.613 0.899
183 HD2 ARG 31 1HD ARG 31 -5.212 6.826 2.192
184 HD3 ARG 31 2HD ARG 31 -5.841 5.213 2.528
185 HE ARG 31 HE ARG 31 -3.950 5.604 4.447
186 HH11 ARG 31 2HH1 ARG 31 -6.765 7.361 3.395
187 HH12 ARG 31 1HH1 ARG 31 -7.097 8.025 4.960
188 HH21 ARG 31 2HH2 ARG 31 -4.375 6.473 6.513
189 HH22 ARG 31 1HH2 ARG 31 -5.736 7.521 6.733
190 H CYS 32 H CYS 32 -2.733 0.790 2.185
191 HA CYS 32 HA CYS 32 -4.689 -0.587 3.891
192 HB2 CYS 32 1HB CYS 32 -5.563 -1.853 2.082
193 HB3 CYS 32 2HB CYS 32 -5.562 -0.178 1.541
194 H ASN 33 H ASN 33 -1.750 -0.292 3.969
195 HA ASN 33 HA ASN 33 0.189 -1.569 3.921
196 HB2 ASN 33 1HB ASN 33 -1.793 -3.178 5.542
197 HB3 ASN 33 2HB ASN 33 -0.057 -3.478 5.540
198 HD21 ASN 33 1HD2 ASN 33 1.333 -1.929 6.442
199 HD22 ASN 33 2HD2 ASN 33 0.756 -0.748 7.563
200 H ALA 34 H ALA 34 -0.671 -1.946 1.477
201 HA ALA 34 HA ALA 34 -0.836 -4.852 1.045
202 HB1 ALA 34 3HB ALA 34 -2.667 -3.875 -0.024
203 HB2 ALA 34 1HB ALA 34 -1.714 -2.512 -0.613
204 HB3 ALA 34 2HB ALA 34 -1.496 -4.113 -1.321
205 HA PRO 35 HA PRO 35 3.453 -4.444 -0.182
206 HB2 PRO 35 1HB PRO 35 3.848 -7.101 -0.575
207 HB3 PRO 35 2HB PRO 35 3.836 -6.358 1.029
208 HG2 PRO 35 1HG PRO 35 1.657 -7.846 -0.386
209 HG3 PRO 35 2HG PRO 35 2.168 -7.954 1.309
210 HD2 PRO 35 1HD PRO 35 -0.001 -6.533 0.529
211 HD3 PRO 35 2HD PRO 35 1.006 -6.057 1.911
212 H TYR 36 H TYR 36 3.901 -3.721 -2.162
213 HA TYR 36 HA TYR 36 2.955 -5.286 -4.473
214 HB2 TYR 36 1HB TYR 36 2.817 -3.159 -5.737
215 HB3 TYR 36 2HB TYR 36 1.707 -3.204 -4.371
216 HD1 TYR 36 2HD TYR 36 4.988 -1.873 -5.485
217 HD2 TYR 36 1HD TYR 36 1.785 -1.548 -2.703
218 HE1 TYR 36 2HE TYR 36 5.925 0.246 -4.661
219 HE2 TYR 36 1HE TYR 36 2.713 0.573 -1.872
220 HH TYR 36 HH TYR 36 5.082 2.303 -3.498
221 H CYS 37 H CYS 37 4.410 -5.733 -6.053
222 HA CYS 37 HA CYS 37 7.160 -5.614 -5.451
223 HB2 CYS 37 1HB CYS 37 7.502 -6.515 -7.705
224 HB3 CYS 37 2HB CYS 37 6.192 -7.356 -6.883
225 H SER 38 H SER 38 5.170 -3.771 -7.742
226 HA SER 38 HA SER 38 7.079 -1.578 -7.597
227 HB2 SER 38 1HB SER 38 8.013 -2.609 -9.492
228 HB3 SER 38 2HB SER 38 6.437 -3.092 -10.118
229 HG SER 38 HG SER 38 7.471 -0.452 -9.975
230 H LEU 39 H LEU 39 6.229 0.430 -8.435
231 HA LEU 39 HA LEU 39 3.810 1.203 -7.579
232 HB2 LEU 39 1HB LEU 39 5.526 2.129 -9.808
233 HB3 LEU 39 2HB LEU 39 3.880 2.758 -9.751
234 HG LEU 39 HG LEU 39 5.967 3.029 -7.588
235 HD11 LEU 39 1HD1 LEU 39 6.425 5.099 -8.355
236 HD12 LEU 39 2HD1 LEU 39 4.776 5.378 -8.913
237 HD13 LEU 39 3HD1 LEU 39 5.886 4.415 -9.888
238 HD21 LEU 39 3HD2 LEU 39 3.057 3.679 -7.707
239 HD22 LEU 39 1HD2 LEU 39 4.144 4.722 -6.789
240 HD23 LEU 39 2HD2 LEU 39 4.010 3.011 -6.380
241 H ARG 40 H ARG 40 4.439 -0.469 -10.604
242 HA ARG 40 HA ARG 40 2.113 -0.163 -11.993
243 HB2 ARG 40 1HB ARG 40 3.495 -2.824 -11.621
244 HB3 ARG 40 2HB ARG 40 2.514 -2.321 -12.991
245 HG2 ARG 40 1HG ARG 40 4.273 -0.456 -13.276
246 HG3 ARG 40 2HG ARG 40 5.278 -1.470 -12.239
247 HD2 ARG 40 1HD ARG 40 3.934 -2.480 -14.736
248 HD3 ARG 40 2HD ARG 40 5.563 -1.806 -14.724
249 HE ARG 40 HE ARG 40 6.316 -3.688 -13.569
250 HH11 ARG 40 2HH1 ARG 40 2.876 -3.797 -14.091
251 HH12 ARG 40 1HH1 ARG 40 2.739 -5.480 -13.704
252 HH21 ARG 40 2HH2 ARG 40 6.149 -5.904 -13.058
253 HH22 ARG 40 1HH2 ARG 40 4.601 -6.678 -13.116
254 H CYS 41 H CYS 41 2.683 -2.614 -9.468
255 HA CYS 41 HA CYS 41 -0.042 -3.485 -9.466
256 HB2 CYS 41 1HB CYS 41 2.330 -4.025 -7.695
257 HB3 CYS 41 2HB CYS 41 0.729 -4.633 -7.288
258 H TYR 42 H TYR 42 1.770 -1.045 -7.807
259 HA TYR 42 HA TYR 42 0.178 -0.694 -5.530
260 HB2 TYR 42 1HB TYR 42 2.359 0.364 -5.741
261 HB3 TYR 42 2HB TYR 42 1.786 1.339 -7.090
262 HD1 TYR 42 1HD TYR 42 0.730 0.607 -3.573
263 HD2 TYR 42 2HD TYR 42 1.320 3.537 -6.601
264 HE1 TYR 42 1HE TYR 42 0.036 2.365 -1.999
265 HE2 TYR 42 2HE TYR 42 0.630 5.303 -5.035
266 HH TYR 42 HH TYR 42 0.675 5.421 -2.257
267 H ARG 43 H ARG 43 -0.248 0.338 -8.838
268 HA ARG 43 HA ARG 43 -2.490 2.061 -8.161
269 HB2 ARG 43 1HB ARG 43 -0.931 1.470 -10.636
270 HB3 ARG 43 2HB ARG 43 -2.568 2.088 -10.809
271 HG2 ARG 43 1HG ARG 43 -2.036 4.100 -9.708
272 HG3 ARG 43 2HG ARG 43 -0.508 3.453 -9.106
273 HD2 ARG 43 1HD ARG 43 0.071 4.868 -10.895
274 HD3 ARG 43 2HD ARG 43 0.187 3.230 -11.534
275 HE ARG 43 HE ARG 43 -2.342 4.573 -11.972
276 HH11 ARG 43 2HH1 ARG 43 0.810 3.786 -13.223
277 HH12 ARG 43 1HH1 ARG 43 0.362 4.045 -14.877
278 HH21 ARG 43 2HH2 ARG 43 -2.945 4.917 -14.145
279 HH22 ARG 43 1HH2 ARG 43 -1.774 4.689 -15.400
280 H THR 44 H THR 44 -1.867 -1.118 -9.464
281 HA THR 44 HA THR 44 -4.560 -1.558 -10.367
282 HB THR 44 HB THR 44 -2.313 -3.530 -9.911
283 HG1 THR 44 1HG THR 44 -1.706 -3.030 -11.889
284 HG21 THR 44 3HG2 THR 44 -4.254 -4.833 -9.892
285 HG22 THR 44 1HG2 THR 44 -3.742 -4.879 -11.579
286 HG23 THR 44 2HG2 THR 44 -5.061 -3.817 -11.086
287 H HIS 45 H HIS 45 -2.614 -3.062 -7.778
288 HA HIS 45 HA HIS 45 -4.339 -4.631 -6.497
289 HB2 HIS 45 1HB HIS 45 -3.065 -4.411 -4.596
290 HB3 HIS 45 2HB HIS 45 -1.980 -3.676 -5.772
291 HD1 HIS 45 1HD HIS 45 -1.670 -1.104 -5.654
292 HD2 HIS 45 2HD HIS 45 -4.125 -2.670 -2.691
293 HE1 HIS 45 1HE HIS 45 -1.935 0.735 -3.959
294 H GLY 46 H GLY 46 -4.332 -1.092 -6.134
295 HA2 GLY 46 1HA GLY 46 -7.171 -1.029 -5.788
296 HA3 GLY 46 2HA GLY 46 -6.325 -0.771 -4.269
297 H THR 47 H THR 47 -7.977 1.170 -5.274
298 HA THR 47 HA THR 47 -6.224 3.156 -6.527
299 HB THR 47 HB THR 47 -8.307 4.516 -6.760
300 HG1 THR 47 1HG THR 47 -10.255 3.623 -6.198
301 HG21 THR 47 3HG2 THR 47 -7.440 2.397 -8.278
302 HG22 THR 47 1HG2 THR 47 -8.678 3.558 -8.755
303 HG23 THR 47 2HG2 THR 47 -9.145 2.021 -8.028
304 H CYS 48 H CYS 48 -5.605 2.517 -3.885
305 HA CYS 48 HA CYS 48 -6.807 4.321 -2.038
306 HB2 CYS 48 1HB CYS 48 -4.056 3.135 -1.735
307 HB3 CYS 48 2HB CYS 48 -5.211 3.557 -0.475
308 H ALA 49 H ALA 49 -4.245 4.566 -4.352
309 HA ALA 49 HA ALA 49 -3.077 6.936 -3.192
310 HB1 ALA 49 3HB ALA 49 -1.927 6.949 -5.538
311 HB2 ALA 49 1HB ALA 49 -1.480 5.739 -4.335
312 HB3 ALA 49 2HB ALA 49 -2.581 5.314 -5.646
313 H GLU 50 H GLU 50 -5.844 7.221 -3.619
314 HA GLU 50 HA GLU 50 -5.992 9.049 -5.916
315 HB2 GLU 50 1HB GLU 50 -8.009 7.405 -4.455
316 HB3 GLU 50 2HB GLU 50 -8.541 8.899 -5.213
317 HG2 GLU 50 1HG GLU 50 -7.015 6.794 -6.709
318 HG3 GLU 50 2HG GLU 50 -8.772 6.773 -6.567
319 H ASN 51 H ASN 51 -6.531 8.808 -2.446
320 HA ASN 51 HA ASN 51 -7.007 11.709 -2.343
321 HB2 ASN 51 1HB ASN 51 -8.672 10.023 -1.317
322 HB3 ASN 51 2HB ASN 51 -7.464 9.808 -0.054
323 HD21 ASN 51 1HD2 ASN 51 -7.208 11.349 1.479
324 HD22 ASN 51 2HD2 ASN 51 -8.192 12.765 1.595
325 H PHE 52 H PHE 52 -4.996 9.105 -1.128
326 HA PHE 52 HA PHE 52 -3.602 10.088 0.927
327 HB2 PHE 52 1HB PHE 52 -2.798 8.048 0.180
328 HB3 PHE 52 2HB PHE 52 -2.689 8.586 -1.493
329 HD1 PHE 52 2HD PHE 52 -1.151 9.145 1.848
330 HD2 PHE 52 1HD PHE 52 -0.636 9.165 -2.377
331 HE1 PHE 52 2HE PHE 52 1.255 9.567 2.147
332 HE2 PHE 52 1HE PHE 52 1.771 9.586 -2.085
333 HZ PHE 52 HZ PHE 52 2.719 9.789 0.179
334 H TYR 53 H TYR 53 -2.839 10.929 -2.451
335 HA TYR 53 HA TYR 53 -1.036 13.024 -1.595
336 HB2 TYR 53 1HB TYR 53 -0.423 13.238 -3.854
337 HB3 TYR 53 2HB TYR 53 -0.745 11.519 -3.658
338 HD1 TYR 53 1HD TYR 53 -2.825 10.538 -4.578
339 HD2 TYR 53 2HD TYR 53 -1.758 14.593 -5.301
340 HE1 TYR 53 1HE TYR 53 -4.433 10.624 -6.437
341 HE2 TYR 53 2HE TYR 53 -3.364 14.691 -7.160
342 HH TYR 53 HH TYR 53 -5.063 11.826 -8.273
343 H SER 54 H SER 54 -1.283 15.242 -2.087
344 HA SER 54 HA SER 54 -3.627 16.443 -1.400
345 HB2 SER 54 1HB SER 54 -1.312 17.369 -3.062
346 HB3 SER 54 2HB SER 54 -2.725 18.411 -2.895
347 HG SER 54 HG SER 54 -1.375 18.933 -1.236
348 H GLY 55 H GLY 55 -5.562 16.777 -2.294
349 HA2 GLY 55 1HA GLY 55 -5.933 17.059 -5.125
350 HA3 GLY 55 2HA GLY 55 -6.500 15.506 -4.530
351 HA PRO 56 HA PRO 56 -9.192 19.104 -2.638
352 HB2 PRO 56 1HB PRO 56 -9.351 21.281 -4.253
353 HB3 PRO 56 2HB PRO 56 -8.153 21.128 -2.962
354 HG2 PRO 56 1HG PRO 56 -7.843 20.646 -5.900
355 HG3 PRO 56 2HG PRO 56 -6.746 21.476 -4.781
356 HD2 PRO 56 1HD PRO 56 -6.348 18.921 -5.584
357 HD3 PRO 56 2HD PRO 56 -5.872 19.501 -3.975
358 H SER 57 H SER 57 -9.020 19.157 -6.204
359 HA SER 57 HA SER 57 -11.719 19.397 -6.747
360 HB2 SER 57 1HB SER 57 -10.030 19.567 -8.496
361 HB3 SER 57 2HB SER 57 -9.624 17.862 -8.305
362 HG SER 57 HG SER 57 -12.013 17.594 -8.790
363 H SER 58 H SER 58 -13.389 18.178 -6.205
364 HA SER 58 HA SER 58 -12.949 15.314 -5.698
365 HB2 SER 58 1HB SER 58 -14.769 15.361 -4.181
366 HB3 SER 58 2HB SER 58 -13.860 16.836 -3.853
367 HG SER 58 HG SER 58 -15.492 17.639 -5.605
368 H GLY 59 H GLY 59 -14.008 13.797 -6.849
369 HA2 GLY 59 1HA GLY 59 -16.471 14.067 -8.126
370 HA3 GLY 59 2HA GLY 59 -15.236 14.500 -9.299
Start of MODEL 14
1 H1 GLY 1 1H GLY 1 1.447 -4.097 10.007
2 HA2 GLY 1 1HA GLY 1 -0.564 -3.764 12.048
3 HA3 GLY 1 2HA GLY 1 0.315 -5.280 12.170
4 H SER 2 H SER 2 1.747 -5.124 13.759
5 HA SER 2 HA SER 2 3.387 -2.679 13.909
6 HB2 SER 2 1HB SER 2 1.745 -3.006 15.814
7 HB3 SER 2 2HB SER 2 2.679 -4.433 16.266
8 HG SER 2 HG SER 2 3.151 -1.988 16.996
9 H SER 3 H SER 3 5.514 -2.956 13.730
10 HA SER 3 HA SER 3 6.694 -5.553 14.391
11 HB2 SER 3 1HB SER 3 7.238 -4.113 11.784
12 HB3 SER 3 2HB SER 3 7.942 -5.644 12.305
13 HG SER 3 HG SER 3 5.802 -5.375 10.900
14 H GLY 4 H GLY 4 8.512 -5.347 15.533
15 HA2 GLY 4 1HA GLY 4 9.706 -2.667 15.729
16 HA3 GLY 4 2HA GLY 4 9.857 -3.944 16.926
17 H SER 5 H SER 5 10.397 -4.013 13.417
18 HA SER 5 HA SER 5 12.681 -5.612 13.553
19 HB2 SER 5 1HB SER 5 11.438 -5.385 11.483
20 HB3 SER 5 2HB SER 5 11.812 -3.664 11.405
21 HG SER 5 HG SER 5 13.444 -5.873 10.890
22 H SER 6 H SER 6 14.890 -5.154 13.328
23 HA SER 6 HA SER 6 15.643 -2.435 14.178
24 HB2 SER 6 1HB SER 6 16.112 -4.590 15.632
25 HB3 SER 6 2HB SER 6 17.480 -4.770 14.534
26 HG SER 6 HG SER 6 16.896 -2.454 16.069
27 H GLY 7 H GLY 7 16.757 -1.246 12.782
28 HA2 GLY 7 1HA GLY 7 18.515 -0.817 11.270
29 HA3 GLY 7 2HA GLY 7 18.608 -2.538 10.926
30 H MET 8 H MET 8 17.693 -3.276 9.111
31 HA MET 8 HA MET 8 16.189 -1.362 7.487
32 HB2 MET 8 1HB MET 8 17.766 -3.836 6.882
33 HB3 MET 8 2HB MET 8 16.554 -3.276 5.738
34 HG2 MET 8 1HG MET 8 18.535 -1.308 6.736
35 HG3 MET 8 2HG MET 8 19.081 -2.530 5.590
36 HE1 MET 8 3HE MET 8 18.951 0.891 4.798
37 HE2 MET 8 1HE MET 8 17.251 1.347 4.691
38 HE3 MET 8 2HE MET 8 17.898 0.705 6.201
39 H GLU 9 H GLU 9 14.390 -2.267 6.141
40 HA GLU 9 HA GLU 9 12.717 -4.000 7.821
41 HB2 GLU 9 1HB GLU 9 10.807 -3.001 6.781
42 HB3 GLU 9 2HB GLU 9 11.893 -1.703 7.257
43 HG2 GLU 9 1HG GLU 9 12.648 -1.426 5.000
44 HG3 GLU 9 2HG GLU 9 11.736 -2.842 4.478
45 HA PRO 10 HA PRO 10 13.033 -7.255 4.863
46 HB2 PRO 10 1HB PRO 10 10.851 -8.683 5.619
47 HB3 PRO 10 2HB PRO 10 12.347 -8.646 6.558
48 HG2 PRO 10 1HG PRO 10 9.813 -7.108 6.973
49 HG3 PRO 10 2HG PRO 10 10.838 -7.919 8.171
50 HD2 PRO 10 1HD PRO 10 10.926 -5.246 7.748
51 HD3 PRO 10 2HD PRO 10 12.353 -6.183 8.234
52 H ALA 11 H ALA 11 11.434 -8.514 3.374
53 HA ALA 11 HA ALA 11 9.474 -6.640 2.228
54 HB1 ALA 11 3HB ALA 11 10.331 -7.967 0.026
55 HB2 ALA 11 1HB ALA 11 10.937 -6.393 0.542
56 HB3 ALA 11 2HB ALA 11 11.824 -7.860 0.959
57 H GLY 12 H GLY 12 7.844 -7.688 0.848
58 HA2 GLY 12 1HA GLY 12 7.342 -10.472 1.707
59 HA3 GLY 12 2HA GLY 12 6.066 -9.269 1.585
60 HA PRO 13 HA PRO 13 6.931 -11.637 -2.501
61 HB2 PRO 13 1HB PRO 13 5.113 -13.643 -2.290
62 HB3 PRO 13 2HB PRO 13 6.790 -13.805 -1.754
63 HG2 PRO 13 1HG PRO 13 4.333 -13.228 -0.144
64 HG3 PRO 13 2HG PRO 13 5.679 -14.323 0.223
65 HD2 PRO 13 1HD PRO 13 5.467 -11.857 1.320
66 HD3 PRO 13 2HD PRO 13 7.034 -12.612 0.964
67 H CYS 14 H CYS 14 5.985 -10.112 -3.753
68 HA CYS 14 HA CYS 14 3.414 -9.057 -3.433
69 HB2 CYS 14 1HB CYS 14 5.126 -7.932 -4.759
70 HB3 CYS 14 2HB CYS 14 5.109 -9.245 -5.932
71 H GLY 15 H GLY 15 1.653 -10.319 -3.380
72 HA2 GLY 15 1HA GLY 15 1.404 -12.670 -5.027
73 HA3 GLY 15 2HA GLY 15 0.192 -12.031 -3.927
74 H PHE 16 H PHE 16 -0.127 -9.469 -4.951
75 HA PHE 16 HA PHE 16 -2.117 -9.613 -6.727
76 HB2 PHE 16 1HB PHE 16 0.045 -7.500 -6.851
77 HB3 PHE 16 2HB PHE 16 -1.596 -7.339 -7.467
78 HD1 PHE 16 1HD PHE 16 -3.296 -8.315 -5.407
79 HD2 PHE 16 2HD PHE 16 0.334 -6.122 -5.042
80 HE1 PHE 16 1HE PHE 16 -4.035 -7.462 -3.220
81 HE2 PHE 16 2HE PHE 16 -0.399 -5.266 -2.855
82 HZ PHE 16 HZ PHE 16 -2.585 -5.937 -1.941
83 H CYS 17 H CYS 17 1.270 -9.976 -7.496
84 HA CYS 17 HA CYS 17 1.014 -9.789 -10.318
85 HB2 CYS 17 1HB CYS 17 3.112 -10.723 -8.418
86 HB3 CYS 17 2HB CYS 17 3.239 -11.235 -10.098
87 HA PRO 18 HA PRO 18 -0.577 -13.720 -11.450
88 HB2 PRO 18 1HB PRO 18 0.743 -14.180 -13.777
89 HB3 PRO 18 2HB PRO 18 -0.544 -12.977 -13.624
90 HG2 PRO 18 1HG PRO 18 2.425 -12.591 -13.585
91 HG3 PRO 18 2HG PRO 18 1.182 -11.628 -14.404
92 HD2 PRO 18 1HD PRO 18 2.303 -10.869 -12.059
93 HD3 PRO 18 2HD PRO 18 0.622 -10.485 -12.482
94 H ALA 19 H ALA 19 -0.176 -15.769 -10.876
95 HA ALA 19 HA ALA 19 1.844 -16.763 -9.488
96 HB1 ALA 19 3HB ALA 19 -0.211 -17.910 -11.038
97 HB2 ALA 19 1HB ALA 19 1.265 -18.806 -11.398
98 HB3 ALA 19 2HB ALA 19 0.710 -18.653 -9.731
99 H GLY 20 H GLY 20 3.938 -17.345 -9.684
100 HA2 GLY 20 1HA GLY 20 5.871 -18.075 -10.822
101 HA3 GLY 20 2HA GLY 20 5.106 -17.652 -12.346
102 H GLU 21 H GLU 21 4.439 -15.071 -12.101
103 HA GLU 21 HA GLU 21 7.014 -13.776 -12.171
104 HB2 GLU 21 1HB GLU 21 4.206 -12.866 -12.766
105 HB3 GLU 21 2HB GLU 21 5.560 -11.744 -12.755
106 HG2 GLU 21 1HG GLU 21 5.230 -14.148 -14.534
107 HG3 GLU 21 2HG GLU 21 5.103 -12.455 -15.006
108 H VAL 22 H VAL 22 6.569 -14.637 -9.616
109 HA VAL 22 HA VAL 22 5.415 -12.603 -7.966
110 HB VAL 22 HB VAL 22 7.235 -14.908 -7.259
111 HG11 VAL 22 1HG1 VAL 22 5.953 -12.787 -5.605
112 HG12 VAL 22 2HG1 VAL 22 6.097 -14.417 -4.945
113 HG13 VAL 22 3HG1 VAL 22 7.541 -13.536 -5.445
114 HG21 VAL 22 3HG2 VAL 22 4.897 -15.591 -6.206
115 HG22 VAL 22 1HG2 VAL 22 4.296 -14.575 -7.516
116 HG23 VAL 22 2HG2 VAL 22 5.313 -15.970 -7.877
117 H GLN 23 H GLN 23 6.301 -10.705 -7.523
118 HA GLN 23 HA GLN 23 9.233 -10.458 -7.622
119 HB2 GLN 23 1HB GLN 23 7.027 -8.518 -8.250
120 HB3 GLN 23 2HB GLN 23 8.643 -7.948 -7.857
121 HG2 GLN 23 1HG GLN 23 9.312 -9.706 -9.720
122 HG3 GLN 23 2HG GLN 23 7.664 -9.382 -10.256
123 HE21 GLN 23 1HE2 GLN 23 9.090 -8.641 -12.121
124 HE22 GLN 23 2HE2 GLN 23 9.526 -6.969 -12.126
125 HA PRO 24 HA PRO 24 9.419 -9.394 -3.370
126 HB2 PRO 24 1HB PRO 24 11.391 -7.528 -3.353
127 HB3 PRO 24 2HB PRO 24 11.698 -9.248 -3.619
128 HG2 PRO 24 1HG PRO 24 11.470 -7.033 -5.620
129 HG3 PRO 24 2HG PRO 24 12.640 -8.364 -5.553
130 HD2 PRO 24 1HD PRO 24 10.490 -8.397 -7.198
131 HD3 PRO 24 2HD PRO 24 11.167 -9.873 -6.482
132 H ALA 25 H ALA 25 7.617 -8.375 -2.651
133 HA ALA 25 HA ALA 25 6.872 -5.742 -3.499
134 HB1 ALA 25 3HB ALA 25 5.584 -6.595 -1.059
135 HB2 ALA 25 1HB ALA 25 4.892 -6.294 -2.653
136 HB3 ALA 25 2HB ALA 25 5.577 -7.875 -2.272
137 H ARG 26 H ARG 26 9.284 -5.197 -2.768
138 HA ARG 26 HA ARG 26 9.956 -4.783 -0.118
139 HB2 ARG 26 1HB ARG 26 10.683 -3.259 -2.613
140 HB3 ARG 26 2HB ARG 26 11.355 -2.848 -1.041
141 HG2 ARG 26 1HG ARG 26 12.513 -4.871 -0.877
142 HG3 ARG 26 2HG ARG 26 11.551 -5.625 -2.151
143 HD2 ARG 26 1HD ARG 26 13.628 -5.147 -3.143
144 HD3 ARG 26 2HD ARG 26 12.539 -3.883 -3.714
145 HE ARG 26 HE ARG 26 13.641 -2.713 -1.582
146 HH11 ARG 26 2HH1 ARG 26 15.062 -4.493 -4.215
147 HH12 ARG 26 1HH1 ARG 26 16.557 -3.618 -4.172
148 HH21 ARG 26 2HH2 ARG 26 15.604 -1.553 -1.515
149 HH22 ARG 26 1HH2 ARG 26 16.864 -1.947 -2.635
150 H TYR 27 H TYR 27 7.731 -3.037 -2.123
151 HA TYR 27 HA TYR 27 7.429 -0.973 -0.050
152 HB2 TYR 27 1HB TYR 27 6.113 -0.801 -2.736
153 HB3 TYR 27 2HB TYR 27 6.642 0.496 -1.670
154 HD1 TYR 27 1HD TYR 27 9.224 0.697 -1.324
155 HD2 TYR 27 2HD TYR 27 7.409 -1.359 -4.577
156 HE1 TYR 27 1HE TYR 27 11.306 0.916 -2.616
157 HE2 TYR 27 2HE TYR 27 9.486 -1.147 -5.877
158 HH TYR 27 HH TYR 27 12.215 0.731 -4.687
159 H THR 28 H THR 28 5.348 -0.414 0.703
160 HA THR 28 HA THR 28 3.191 -2.308 0.094
161 HB THR 28 HB THR 28 3.499 -1.478 2.937
162 HG1 THR 28 1HG THR 28 5.437 -2.353 2.962
163 HG21 THR 28 3HG2 THR 28 1.559 -2.791 2.081
164 HG22 THR 28 1HG2 THR 28 2.457 -3.606 3.360
165 HG23 THR 28 2HG2 THR 28 2.675 -4.096 1.680
166 H CYS 29 H CYS 29 1.174 -1.438 0.062
167 HA CYS 29 HA CYS 29 0.848 1.315 -0.250
168 HB2 CYS 29 1HB CYS 29 -0.676 -0.631 -1.008
169 HB3 CYS 29 2HB CYS 29 -1.406 -0.493 0.589
170 HA PRO 30 HA PRO 30 0.982 2.446 4.082
171 HB2 PRO 30 1HB PRO 30 0.868 5.122 3.636
172 HB3 PRO 30 2HB PRO 30 2.350 4.178 3.444
173 HG2 PRO 30 1HG PRO 30 0.416 5.112 1.359
174 HG3 PRO 30 2HG PRO 30 2.189 5.115 1.322
175 HD2 PRO 30 1HD PRO 30 0.709 3.226 0.068
176 HD3 PRO 30 2HD PRO 30 2.306 2.883 0.762
177 H ARG 31 H ARG 31 -1.546 2.306 2.043
178 HA ARG 31 HA ARG 31 -3.353 3.770 3.851
179 HB2 ARG 31 1HB ARG 31 -3.352 3.336 0.911
180 HB3 ARG 31 2HB ARG 31 -4.915 3.351 1.717
181 HG2 ARG 31 1HG ARG 31 -3.070 5.553 2.394
182 HG3 ARG 31 2HG ARG 31 -3.731 5.546 0.757
183 HD2 ARG 31 1HD ARG 31 -5.253 6.812 2.013
184 HD3 ARG 31 2HD ARG 31 -6.007 5.226 1.856
185 HE ARG 31 HE ARG 31 -4.743 4.985 4.195
186 HH11 ARG 31 2HH1 ARG 31 -6.767 7.519 2.930
187 HH12 ARG 31 1HH1 ARG 31 -7.367 7.995 4.484
188 HH21 ARG 31 2HH2 ARG 31 -5.525 5.602 6.247
189 HH22 ARG 31 1HH2 ARG 31 -6.659 6.905 6.370
190 H CYS 32 H CYS 32 -2.783 0.744 2.158
191 HA CYS 32 HA CYS 32 -4.742 -0.541 3.934
192 HB2 CYS 32 1HB CYS 32 -5.556 -1.937 2.155
193 HB3 CYS 32 2HB CYS 32 -5.669 -0.263 1.623
194 H ASN 33 H ASN 33 -1.699 -0.241 3.690
195 HA ASN 33 HA ASN 33 0.191 -1.533 3.828
196 HB2 ASN 33 1HB ASN 33 -1.786 -3.137 5.462
197 HB3 ASN 33 2HB ASN 33 -0.043 -3.387 5.492
198 HD21 ASN 33 1HD2 ASN 33 -0.969 -2.915 7.837
199 HD22 ASN 33 2HD2 ASN 33 -0.722 -1.286 8.358
200 H ALA 34 H ALA 34 -0.653 -1.958 1.389
201 HA ALA 34 HA ALA 34 -0.851 -4.867 1.007
202 HB1 ALA 34 3HB ALA 34 -1.463 -2.616 -0.904
203 HB2 ALA 34 1HB ALA 34 -1.593 -4.334 -1.280
204 HB3 ALA 34 2HB ALA 34 -2.635 -3.619 -0.050
205 HA PRO 35 HA PRO 35 3.475 -4.591 -0.118
206 HB2 PRO 35 1HB PRO 35 3.808 -7.262 -0.471
207 HB3 PRO 35 2HB PRO 35 3.774 -6.501 1.124
208 HG2 PRO 35 1HG PRO 35 1.594 -7.946 -0.332
209 HG3 PRO 35 2HG PRO 35 2.057 -8.048 1.377
210 HD2 PRO 35 1HD PRO 35 -0.051 -6.579 0.524
211 HD3 PRO 35 2HD PRO 35 0.932 -6.114 1.928
212 H TYR 36 H TYR 36 3.780 -3.763 -2.104
213 HA TYR 36 HA TYR 36 2.993 -5.414 -4.415
214 HB2 TYR 36 1HB TYR 36 2.725 -3.332 -5.701
215 HB3 TYR 36 2HB TYR 36 1.643 -3.378 -4.313
216 HD1 TYR 36 2HD TYR 36 4.597 -1.776 -5.775
217 HD2 TYR 36 1HD TYR 36 1.943 -1.855 -2.451
218 HE1 TYR 36 2HE TYR 36 5.470 0.401 -5.033
219 HE2 TYR 36 1HE TYR 36 2.807 0.322 -1.701
220 HH TYR 36 HH TYR 36 4.920 1.658 -1.978
221 H CYS 37 H CYS 37 4.451 -5.639 -6.087
222 HA CYS 37 HA CYS 37 7.198 -5.453 -5.413
223 HB2 CYS 37 1HB CYS 37 7.598 -6.245 -7.716
224 HB3 CYS 37 2HB CYS 37 6.371 -7.205 -6.895
225 H SER 38 H SER 38 5.175 -3.668 -7.727
226 HA SER 38 HA SER 38 6.980 -1.389 -7.490
227 HB2 SER 38 1HB SER 38 7.965 -2.293 -9.410
228 HB3 SER 38 2HB SER 38 6.427 -2.884 -10.038
229 HG SER 38 HG SER 38 7.600 -0.404 -10.281
230 H LEU 39 H LEU 39 6.044 0.536 -8.732
231 HA LEU 39 HA LEU 39 3.608 1.260 -7.712
232 HB2 LEU 39 1HB LEU 39 5.276 2.205 -9.964
233 HB3 LEU 39 2HB LEU 39 3.603 2.758 -9.935
234 HG LEU 39 HG LEU 39 5.185 4.358 -8.913
235 HD11 LEU 39 1HD1 LEU 39 2.810 3.236 -7.649
236 HD12 LEU 39 2HD1 LEU 39 3.248 4.916 -7.955
237 HD13 LEU 39 3HD1 LEU 39 3.867 4.091 -6.524
238 HD21 LEU 39 3HD2 LEU 39 6.871 3.164 -7.896
239 HD22 LEU 39 1HD2 LEU 39 5.760 1.996 -7.180
240 HD23 LEU 39 2HD2 LEU 39 5.884 3.621 -6.507
241 H ARG 40 H ARG 40 4.272 -0.435 -10.719
242 HA ARG 40 HA ARG 40 1.860 -0.248 -12.025
243 HB2 ARG 40 1HB ARG 40 2.382 -2.436 -13.027
244 HB3 ARG 40 2HB ARG 40 3.784 -1.376 -12.995
245 HG2 ARG 40 1HG ARG 40 4.619 -2.556 -11.015
246 HG3 ARG 40 2HG ARG 40 3.225 -3.635 -11.085
247 HD2 ARG 40 1HD ARG 40 5.188 -3.295 -13.344
248 HD3 ARG 40 2HD ARG 40 5.338 -4.538 -12.102
249 HE ARG 40 HE ARG 40 2.780 -4.564 -13.380
250 HH11 ARG 40 2HH1 ARG 40 6.093 -5.596 -13.669
251 HH12 ARG 40 1HH1 ARG 40 5.721 -6.939 -14.699
252 HH21 ARG 40 2HH2 ARG 40 2.278 -6.329 -14.734
253 HH22 ARG 40 1HH2 ARG 40 3.551 -7.355 -15.305
254 H CYS 41 H CYS 41 2.738 -2.397 -9.358
255 HA CYS 41 HA CYS 41 0.144 -3.671 -9.347
256 HB2 CYS 41 1HB CYS 41 2.689 -3.974 -7.832
257 HB3 CYS 41 2HB CYS 41 1.209 -4.520 -7.050
258 H TYR 42 H TYR 42 1.816 -1.152 -7.576
259 HA TYR 42 HA TYR 42 0.087 -0.928 -5.383
260 HB2 TYR 42 1HB TYR 42 2.155 0.215 -5.251
261 HB3 TYR 42 2HB TYR 42 1.878 1.058 -6.771
262 HD1 TYR 42 1HD TYR 42 0.803 0.854 -3.234
263 HD2 TYR 42 2HD TYR 42 0.746 3.136 -6.825
264 HE1 TYR 42 1HE TYR 42 -0.121 2.768 -1.996
265 HE2 TYR 42 2HE TYR 42 -0.176 5.057 -5.596
266 HH TYR 42 HH TYR 42 -1.618 5.270 -3.330
267 H ARG 43 H ARG 43 -0.169 0.229 -8.667
268 HA ARG 43 HA ARG 43 -2.480 1.883 -8.059
269 HB2 ARG 43 1HB ARG 43 -0.770 1.407 -10.455
270 HB3 ARG 43 2HB ARG 43 -2.412 1.983 -10.712
271 HG2 ARG 43 1HG ARG 43 -2.003 3.962 -9.466
272 HG3 ARG 43 2HG ARG 43 -0.453 3.349 -8.887
273 HD2 ARG 43 1HD ARG 43 -0.030 4.933 -10.632
274 HD3 ARG 43 2HD ARG 43 0.343 3.322 -11.245
275 HE ARG 43 HE ARG 43 -2.188 3.650 -12.058
276 HH11 ARG 43 2HH1 ARG 43 0.602 5.721 -12.270
277 HH12 ARG 43 1HH1 ARG 43 0.088 6.481 -13.739
278 HH21 ARG 43 2HH2 ARG 43 -2.876 4.643 -13.992
279 HH22 ARG 43 1HH2 ARG 43 -1.891 5.868 -14.718
280 H THR 44 H THR 44 -1.731 -1.242 -9.420
281 HA THR 44 HA THR 44 -4.335 -1.707 -10.520
282 HB THR 44 HB THR 44 -2.133 -3.676 -9.870
283 HG1 THR 44 1HG THR 44 -2.858 -2.675 -12.425
284 HG21 THR 44 3HG2 THR 44 -4.817 -3.957 -11.116
285 HG22 THR 44 1HG2 THR 44 -3.909 -5.094 -10.119
286 HG23 THR 44 2HG2 THR 44 -3.486 -4.877 -11.818
287 H HIS 45 H HIS 45 -2.609 -3.186 -7.765
288 HA HIS 45 HA HIS 45 -4.478 -4.760 -6.661
289 HB2 HIS 45 1HB HIS 45 -3.332 -4.621 -4.668
290 HB3 HIS 45 2HB HIS 45 -2.137 -3.930 -5.761
291 HD1 HIS 45 1HD HIS 45 -1.712 -1.376 -5.590
292 HD2 HIS 45 2HD HIS 45 -4.428 -2.849 -2.813
293 HE1 HIS 45 1HE HIS 45 -1.998 0.456 -3.892
294 H GLY 46 H GLY 46 -4.284 -1.263 -5.961
295 HA2 GLY 46 1HA GLY 46 -7.168 -1.088 -5.873
296 HA3 GLY 46 2HA GLY 46 -6.390 -0.887 -4.309
297 H THR 47 H THR 47 -7.921 1.129 -5.368
298 HA THR 47 HA THR 47 -6.058 3.066 -6.524
299 HB THR 47 HB THR 47 -8.065 4.519 -6.772
300 HG1 THR 47 1HG THR 47 -9.469 3.821 -5.232
301 HG21 THR 47 3HG2 THR 47 -7.329 2.311 -8.268
302 HG22 THR 47 1HG2 THR 47 -8.426 3.593 -8.777
303 HG23 THR 47 2HG2 THR 47 -9.069 2.114 -8.064
304 H CYS 48 H CYS 48 -5.205 2.582 -4.075
305 HA CYS 48 HA CYS 48 -6.426 4.434 -2.191
306 HB2 CYS 48 1HB CYS 48 -3.887 2.904 -1.697
307 HB3 CYS 48 2HB CYS 48 -5.092 3.448 -0.534
308 H ALA 49 H ALA 49 -5.251 5.527 -4.582
309 HA ALA 49 HA ALA 49 -2.912 6.948 -3.500
310 HB1 ALA 49 3HB ALA 49 -2.947 5.650 -5.791
311 HB2 ALA 49 1HB ALA 49 -3.671 7.150 -6.370
312 HB3 ALA 49 2HB ALA 49 -2.076 7.173 -5.617
313 H GLU 50 H GLU 50 -5.994 7.429 -5.185
314 HA GLU 50 HA GLU 50 -5.956 10.189 -5.432
315 HB2 GLU 50 1HB GLU 50 -8.162 8.187 -5.114
316 HB3 GLU 50 2HB GLU 50 -8.539 9.904 -5.123
317 HG2 GLU 50 1HG GLU 50 -6.971 8.568 -7.307
318 HG3 GLU 50 2HG GLU 50 -8.729 8.706 -7.328
319 H ASN 51 H ASN 51 -6.983 8.207 -2.683
320 HA ASN 51 HA ASN 51 -7.862 10.371 -1.078
321 HB2 ASN 51 1HB ASN 51 -6.840 7.737 -0.023
322 HB3 ASN 51 2HB ASN 51 -8.058 8.794 0.684
323 HD21 ASN 51 1HD2 ASN 51 -10.138 8.808 -0.162
324 HD22 ASN 51 2HD2 ASN 51 -10.713 7.553 -1.201
325 H PHE 52 H PHE 52 -4.914 8.372 -0.845
326 HA PHE 52 HA PHE 52 -3.678 10.132 1.031
327 HB2 PHE 52 1HB PHE 52 -3.156 7.721 0.932
328 HB3 PHE 52 2HB PHE 52 -2.441 7.950 -0.661
329 HD1 PHE 52 2HD PHE 52 -2.137 9.086 2.866
330 HD2 PHE 52 1HD PHE 52 -0.185 8.422 -0.858
331 HE1 PHE 52 2HE PHE 52 0.031 9.585 3.917
332 HE2 PHE 52 1HE PHE 52 1.986 8.919 0.188
333 HZ PHE 52 HZ PHE 52 2.096 9.503 2.578
334 H TYR 53 H TYR 53 -3.694 12.179 0.057
335 HA TYR 53 HA TYR 53 -2.298 12.564 -2.456
336 HB2 TYR 53 1HB TYR 53 -3.890 14.312 -0.621
337 HB3 TYR 53 2HB TYR 53 -2.796 15.058 -1.781
338 HD1 TYR 53 1HD TYR 53 -3.044 13.579 -4.190
339 HD2 TYR 53 2HD TYR 53 -6.072 14.484 -1.341
340 HE1 TYR 53 1HE TYR 53 -4.753 13.364 -5.946
341 HE2 TYR 53 2HE TYR 53 -7.789 14.270 -3.089
342 HH TYR 53 HH TYR 53 -8.200 13.619 -5.196
343 H SER 54 H SER 54 -1.942 13.697 0.903
344 HA SER 54 HA SER 54 -0.167 14.758 1.924
345 HB2 SER 54 1HB SER 54 1.792 13.279 2.079
346 HB3 SER 54 2HB SER 54 0.294 12.360 2.223
347 HG SER 54 HG SER 54 2.002 12.568 -0.027
348 H GLY 55 H GLY 55 -0.624 16.045 -0.456
349 HA2 GLY 55 1HA GLY 55 2.043 17.017 -1.057
350 HA3 GLY 55 2HA GLY 55 1.199 16.287 -2.414
351 HA PRO 56 HA PRO 56 0.164 20.812 -2.283
352 HB2 PRO 56 1HB PRO 56 0.632 21.241 -4.923
353 HB3 PRO 56 2HB PRO 56 1.899 21.339 -3.694
354 HG2 PRO 56 1HG PRO 56 1.237 19.092 -5.559
355 HG3 PRO 56 2HG PRO 56 2.825 19.739 -5.106
356 HD2 PRO 56 1HD PRO 56 1.807 17.480 -4.014
357 HD3 PRO 56 2HD PRO 56 2.868 18.582 -3.113
358 H SER 57 H SER 57 -1.029 17.992 -3.653
359 HA SER 57 HA SER 57 -3.040 19.057 -5.361
360 HB2 SER 57 1HB SER 57 -3.053 16.377 -3.958
361 HB3 SER 57 2HB SER 57 -3.940 16.818 -5.417
362 HG SER 57 HG SER 57 -1.177 17.145 -5.463
363 H SER 58 H SER 58 -4.447 20.478 -4.519
364 HA SER 58 HA SER 58 -5.404 20.402 -1.853
365 HB2 SER 58 1HB SER 58 -7.093 22.088 -2.727
366 HB3 SER 58 2HB SER 58 -5.397 22.516 -2.958
367 HG SER 58 HG SER 58 -5.556 21.989 -5.095
368 H GLY 59 H GLY 59 -7.102 19.780 -4.934
369 HA2 GLY 59 1HA GLY 59 -8.544 17.941 -5.319
370 HA3 GLY 59 2HA GLY 59 -8.675 17.713 -3.581
Start of MODEL 15
1 H1 GLY 1 1H GLY 1 9.084 -25.884 22.611
2 HA2 GLY 1 1HA GLY 1 6.839 -25.160 21.238
3 HA3 GLY 1 2HA GLY 1 6.881 -24.037 22.589
4 H SER 2 H SER 2 7.483 -24.099 19.484
5 HA SER 2 HA SER 2 9.376 -21.943 19.603
6 HB2 SER 2 1HB SER 2 10.181 -24.568 18.334
7 HB3 SER 2 2HB SER 2 11.014 -23.041 18.045
8 HG SER 2 HG SER 2 11.134 -24.719 20.201
9 H SER 3 H SER 3 9.243 -20.625 17.839
10 HA SER 3 HA SER 3 7.354 -21.464 15.741
11 HB2 SER 3 1HB SER 3 6.977 -18.994 15.418
12 HB3 SER 3 2HB SER 3 6.450 -19.615 16.982
13 HG SER 3 HG SER 3 9.026 -18.517 16.639
14 H GLY 4 H GLY 4 7.845 -21.126 13.594
15 HA2 GLY 4 1HA GLY 4 10.636 -21.037 12.947
16 HA3 GLY 4 2HA GLY 4 9.305 -21.164 11.807
17 H SER 5 H SER 5 11.533 -19.058 13.380
18 HA SER 5 HA SER 5 10.275 -16.626 12.465
19 HB2 SER 5 1HB SER 5 12.965 -17.156 13.747
20 HB3 SER 5 2HB SER 5 12.367 -15.548 13.337
21 HG SER 5 HG SER 5 11.707 -17.181 15.431
22 H SER 6 H SER 6 10.194 -16.525 10.277
23 HA SER 6 HA SER 6 12.772 -16.620 8.853
24 HB2 SER 6 1HB SER 6 11.452 -18.539 8.178
25 HB3 SER 6 2HB SER 6 10.055 -17.511 7.860
26 HG SER 6 HG SER 6 10.834 -17.366 5.921
27 H GLY 7 H GLY 7 13.140 -14.416 8.947
28 HA2 GLY 7 1HA GLY 7 11.800 -12.848 6.964
29 HA3 GLY 7 2HA GLY 7 11.371 -12.343 8.592
30 H MET 8 H MET 8 13.889 -12.493 6.198
31 HA MET 8 HA MET 8 15.935 -11.390 7.872
32 HB2 MET 8 1HB MET 8 15.674 -11.880 4.919
33 HB3 MET 8 2HB MET 8 17.034 -10.971 5.565
34 HG2 MET 8 1HG MET 8 17.211 -13.075 7.157
35 HG3 MET 8 2HG MET 8 16.384 -13.851 5.809
36 HE1 MET 8 3HE MET 8 19.151 -11.681 6.988
37 HE2 MET 8 1HE MET 8 20.569 -12.143 6.046
38 HE3 MET 8 2HE MET 8 19.435 -10.955 5.405
39 H GLU 9 H GLU 9 14.230 -10.059 5.030
40 HA GLU 9 HA GLU 9 14.520 -7.388 6.242
41 HB2 GLU 9 1HB GLU 9 14.829 -8.279 3.390
42 HB3 GLU 9 2HB GLU 9 14.399 -6.617 3.769
43 HG2 GLU 9 1HG GLU 9 16.784 -7.901 5.033
44 HG3 GLU 9 2HG GLU 9 16.874 -7.222 3.408
45 HA PRO 10 HA PRO 10 10.173 -6.856 5.977
46 HB2 PRO 10 1HB PRO 10 9.978 -4.209 5.405
47 HB3 PRO 10 2HB PRO 10 10.474 -4.815 6.990
48 HG2 PRO 10 1HG PRO 10 12.163 -3.799 4.738
49 HG3 PRO 10 2HG PRO 10 12.306 -3.479 6.476
50 HD2 PRO 10 1HD PRO 10 13.873 -5.276 5.192
51 HD3 PRO 10 2HD PRO 10 13.376 -5.479 6.884
52 H ALA 11 H ALA 11 9.873 -8.173 4.077
53 HA ALA 11 HA ALA 11 8.687 -6.724 1.917
54 HB1 ALA 11 3HB ALA 11 10.116 -7.241 0.148
55 HB2 ALA 11 1HB ALA 11 11.209 -6.737 1.437
56 HB3 ALA 11 2HB ALA 11 10.992 -8.452 1.085
57 H GLY 12 H GLY 12 7.239 -7.963 0.782
58 HA2 GLY 12 1HA GLY 12 7.191 -10.845 1.427
59 HA3 GLY 12 2HA GLY 12 5.735 -9.863 1.483
60 HA PRO 13 HA PRO 13 6.535 -11.759 -2.805
61 HB2 PRO 13 1HB PRO 13 4.627 -13.690 -2.736
62 HB3 PRO 13 2HB PRO 13 6.293 -13.966 -2.213
63 HG2 PRO 13 1HG PRO 13 3.860 -13.393 -0.565
64 HG3 PRO 13 2HG PRO 13 5.155 -14.570 -0.277
65 HD2 PRO 13 1HD PRO 13 5.051 -12.181 0.992
66 HD3 PRO 13 2HD PRO 13 6.583 -12.979 0.583
67 H CYS 14 H CYS 14 5.645 -10.229 -4.059
68 HA CYS 14 HA CYS 14 3.123 -9.044 -3.631
69 HB2 CYS 14 1HB CYS 14 4.877 -7.892 -4.867
70 HB3 CYS 14 2HB CYS 14 4.839 -9.127 -6.121
71 H GLY 15 H GLY 15 1.516 -10.595 -3.480
72 HA2 GLY 15 1HA GLY 15 1.137 -12.663 -5.393
73 HA3 GLY 15 2HA GLY 15 -0.037 -12.130 -4.199
74 H PHE 16 H PHE 16 -0.206 -9.416 -5.051
75 HA PHE 16 HA PHE 16 -2.313 -9.389 -6.734
76 HB2 PHE 16 1HB PHE 16 -0.161 -7.283 -6.926
77 HB3 PHE 16 2HB PHE 16 -1.894 -7.081 -7.162
78 HD1 PHE 16 1HD PHE 16 -3.139 -8.256 -4.901
79 HD2 PHE 16 2HD PHE 16 0.531 -6.107 -5.086
80 HE1 PHE 16 1HE PHE 16 -3.388 -7.632 -2.534
81 HE2 PHE 16 2HE PHE 16 0.287 -5.481 -2.720
82 HZ PHE 16 HZ PHE 16 -1.674 -6.244 -1.440
83 H CYS 17 H CYS 17 1.041 -9.744 -7.647
84 HA CYS 17 HA CYS 17 0.751 -9.282 -10.418
85 HB2 CYS 17 1HB CYS 17 2.799 -10.524 -8.659
86 HB3 CYS 17 2HB CYS 17 2.858 -10.940 -10.368
87 HA PRO 18 HA PRO 18 -1.129 -12.938 -11.952
88 HB2 PRO 18 1HB PRO 18 0.159 -13.260 -14.320
89 HB3 PRO 18 2HB PRO 18 -1.027 -11.980 -14.038
90 HG2 PRO 18 1HG PRO 18 1.962 -11.840 -13.971
91 HG3 PRO 18 2HG PRO 18 0.804 -10.700 -14.682
92 HD2 PRO 18 1HD PRO 18 1.973 -10.279 -12.276
93 HD3 PRO 18 2HD PRO 18 0.330 -9.720 -12.650
94 H ALA 19 H ALA 19 -0.880 -15.014 -11.434
95 HA ALA 19 HA ALA 19 1.068 -16.298 -10.224
96 HB1 ALA 19 3HB ALA 19 -0.890 -17.226 -12.225
97 HB2 ALA 19 1HB ALA 19 0.438 -18.330 -11.865
98 HB3 ALA 19 2HB ALA 19 -0.615 -17.763 -10.568
99 H GLY 20 H GLY 20 3.130 -16.901 -10.497
100 HA2 GLY 20 1HA GLY 20 4.958 -17.752 -11.756
101 HA3 GLY 20 2HA GLY 20 4.204 -17.130 -13.217
102 H GLU 21 H GLU 21 3.714 -14.510 -12.517
103 HA GLU 21 HA GLU 21 6.416 -13.443 -12.585
104 HB2 GLU 21 1HB GLU 21 3.694 -12.343 -13.185
105 HB3 GLU 21 2HB GLU 21 5.040 -11.245 -12.913
106 HG2 GLU 21 1HG GLU 21 5.227 -13.470 -14.907
107 HG3 GLU 21 2HG GLU 21 4.486 -11.924 -15.316
108 H VAL 22 H VAL 22 6.035 -14.446 -10.131
109 HA VAL 22 HA VAL 22 4.979 -12.510 -8.291
110 HB VAL 22 HB VAL 22 6.649 -14.984 -7.834
111 HG11 VAL 22 1HG1 VAL 22 5.264 -13.235 -5.804
112 HG12 VAL 22 2HG1 VAL 22 6.106 -14.750 -5.471
113 HG13 VAL 22 3HG1 VAL 22 7.007 -13.347 -6.047
114 HG21 VAL 22 3HG2 VAL 22 3.919 -14.626 -8.438
115 HG22 VAL 22 1HG2 VAL 22 4.740 -16.111 -7.958
116 HG23 VAL 22 2HG2 VAL 22 4.011 -15.072 -6.734
117 H GLN 23 H GLN 23 5.980 -10.669 -7.838
118 HA GLN 23 HA GLN 23 8.923 -10.613 -7.873
119 HB2 GLN 23 1HB GLN 23 6.866 -8.478 -8.393
120 HB3 GLN 23 2HB GLN 23 8.540 -8.080 -8.031
121 HG2 GLN 23 1HG GLN 23 9.039 -9.759 -9.975
122 HG3 GLN 23 2HG GLN 23 7.378 -9.390 -10.435
123 HE21 GLN 23 1HE2 GLN 23 10.543 -8.500 -10.790
124 HE22 GLN 23 2HE2 GLN 23 10.317 -6.893 -11.383
125 HA PRO 24 HA PRO 24 9.110 -9.766 -3.573
126 HB2 PRO 24 1HB PRO 24 11.213 -8.054 -3.444
127 HB3 PRO 24 2HB PRO 24 11.398 -9.778 -3.784
128 HG2 PRO 24 1HG PRO 24 11.367 -7.466 -5.684
129 HG3 PRO 24 2HG PRO 24 12.434 -8.881 -5.662
130 HD2 PRO 24 1HD PRO 24 10.316 -8.681 -7.337
131 HD3 PRO 24 2HD PRO 24 10.871 -10.234 -6.680
132 H ALA 25 H ALA 25 7.441 -8.640 -2.743
133 HA ALA 25 HA ALA 25 6.888 -5.921 -3.506
134 HB1 ALA 25 3HB ALA 25 4.856 -6.346 -2.703
135 HB2 ALA 25 1HB ALA 25 5.402 -8.000 -2.429
136 HB3 ALA 25 2HB ALA 25 5.499 -6.812 -1.129
137 H ARG 26 H ARG 26 9.221 -5.398 -2.785
138 HA ARG 26 HA ARG 26 9.963 -5.249 -0.106
139 HB2 ARG 26 1HB ARG 26 10.728 -3.685 -2.548
140 HB3 ARG 26 2HB ARG 26 11.342 -3.207 -0.970
141 HG2 ARG 26 1HG ARG 26 12.178 -5.578 -0.720
142 HG3 ARG 26 2HG ARG 26 11.800 -5.790 -2.431
143 HD2 ARG 26 1HD ARG 26 14.124 -5.218 -2.214
144 HD3 ARG 26 2HD ARG 26 13.269 -3.859 -2.942
145 HE ARG 26 HE ARG 26 13.362 -3.479 -0.168
146 HH11 ARG 26 2HH1 ARG 26 15.489 -3.541 -2.924
147 HH12 ARG 26 1HH1 ARG 26 16.631 -2.436 -2.232
148 HH21 ARG 26 2HH2 ARG 26 14.857 -2.023 0.753
149 HH22 ARG 26 1HH2 ARG 26 16.271 -1.574 -0.140
150 H TYR 27 H TYR 27 7.844 -3.217 -1.984
151 HA TYR 27 HA TYR 27 7.653 -1.281 0.206
152 HB2 TYR 27 1HB TYR 27 6.179 -1.037 -2.397
153 HB3 TYR 27 2HB TYR 27 6.733 0.235 -1.314
154 HD1 TYR 27 1HD TYR 27 9.414 0.219 -0.997
155 HD2 TYR 27 2HD TYR 27 7.312 -1.263 -4.387
156 HE1 TYR 27 1HE TYR 27 11.433 0.513 -2.371
157 HE2 TYR 27 2HE TYR 27 9.325 -0.974 -5.769
158 HH TYR 27 HH TYR 27 12.273 -0.724 -4.697
159 H THR 28 H THR 28 5.237 -0.370 0.293
160 HA THR 28 HA THR 28 3.170 -2.335 0.057
161 HB THR 28 HB THR 28 3.594 -1.547 2.901
162 HG1 THR 28 1HG THR 28 4.892 -3.789 1.713
163 HG21 THR 28 3HG2 THR 28 2.394 -3.537 3.361
164 HG22 THR 28 1HG2 THR 28 2.653 -4.159 1.732
165 HG23 THR 28 2HG2 THR 28 1.575 -2.787 1.992
166 H CYS 29 H CYS 29 1.225 -1.368 -0.056
167 HA CYS 29 HA CYS 29 0.986 1.402 -0.234
168 HB2 CYS 29 1HB CYS 29 -0.576 -0.337 -1.202
169 HB3 CYS 29 2HB CYS 29 -1.279 -0.492 0.405
170 HA PRO 30 HA PRO 30 1.042 2.309 4.156
171 HB2 PRO 30 1HB PRO 30 1.065 5.005 3.841
172 HB3 PRO 30 2HB PRO 30 2.508 4.003 3.648
173 HG2 PRO 30 1HG PRO 30 0.688 5.127 1.553
174 HG3 PRO 30 2HG PRO 30 2.460 5.049 1.571
175 HD2 PRO 30 1HD PRO 30 0.938 3.295 0.179
176 HD3 PRO 30 2HD PRO 30 2.495 2.843 0.904
177 H ARG 31 H ARG 31 -1.424 2.357 2.053
178 HA ARG 31 HA ARG 31 -3.218 3.857 3.842
179 HB2 ARG 31 1HB ARG 31 -3.184 3.425 0.896
180 HB3 ARG 31 2HB ARG 31 -4.752 3.546 1.685
181 HG2 ARG 31 1HG ARG 31 -3.590 5.687 2.762
182 HG3 ARG 31 2HG ARG 31 -2.678 5.606 1.253
183 HD2 ARG 31 1HD ARG 31 -4.625 7.032 0.991
184 HD3 ARG 31 2HD ARG 31 -4.782 5.586 -0.006
185 HE ARG 31 HE ARG 31 -6.602 4.966 1.237
186 HH11 ARG 31 2HH1 ARG 31 -4.866 7.473 2.917
187 HH12 ARG 31 1HH1 ARG 31 -6.085 7.685 4.130
188 HH21 ARG 31 2HH2 ARG 31 -8.215 5.236 2.828
189 HH22 ARG 31 1HH2 ARG 31 -7.989 6.411 4.079
190 H CYS 32 H CYS 32 -2.698 0.818 2.166
191 HA CYS 32 HA CYS 32 -4.750 -0.404 3.876
192 HB2 CYS 32 1HB CYS 32 -5.564 -1.768 2.057
193 HB3 CYS 32 2HB CYS 32 -5.653 -0.077 1.577
194 H ASN 33 H ASN 33 -1.697 -0.221 3.694
195 HA ASN 33 HA ASN 33 0.139 -1.585 3.854
196 HB2 ASN 33 1HB ASN 33 -0.192 -3.452 5.478
197 HB3 ASN 33 2HB ASN 33 -0.834 -1.912 6.041
198 HD21 ASN 33 1HD2 ASN 33 -3.019 -1.658 6.301
199 HD22 ASN 33 2HD2 ASN 33 -4.136 -2.974 6.218
200 H ALA 34 H ALA 34 -0.661 -1.929 1.387
201 HA ALA 34 HA ALA 34 -0.944 -4.823 0.942
202 HB1 ALA 34 3HB ALA 34 -1.418 -2.550 -0.983
203 HB2 ALA 34 1HB ALA 34 -1.686 -4.263 -1.309
204 HB3 ALA 34 2HB ALA 34 -2.665 -3.430 -0.100
205 HA PRO 35 HA PRO 35 3.411 -4.624 -0.099
206 HB2 PRO 35 1HB PRO 35 3.698 -7.301 -0.446
207 HB3 PRO 35 2HB PRO 35 3.655 -6.539 1.148
208 HG2 PRO 35 1HG PRO 35 1.469 -7.942 -0.340
209 HG3 PRO 35 2HG PRO 35 1.905 -8.053 1.376
210 HD2 PRO 35 1HD PRO 35 -0.162 -6.543 0.492
211 HD3 PRO 35 2HD PRO 35 0.809 -6.097 1.910
212 H TYR 36 H TYR 36 3.713 -3.775 -2.084
213 HA TYR 36 HA TYR 36 2.931 -5.414 -4.406
214 HB2 TYR 36 1HB TYR 36 2.830 -3.271 -5.683
215 HB3 TYR 36 2HB TYR 36 1.630 -3.385 -4.400
216 HD1 TYR 36 2HD TYR 36 4.824 -1.815 -5.383
217 HD2 TYR 36 1HD TYR 36 1.625 -1.851 -2.577
218 HE1 TYR 36 2HE TYR 36 5.616 0.324 -4.461
219 HE2 TYR 36 1HE TYR 36 2.407 0.288 -1.649
220 HH TYR 36 HH TYR 36 3.977 1.858 -1.709
221 H CYS 37 H CYS 37 4.371 -5.524 -6.159
222 HA CYS 37 HA CYS 37 7.129 -5.491 -5.425
223 HB2 CYS 37 1HB CYS 37 7.526 -6.272 -7.725
224 HB3 CYS 37 2HB CYS 37 6.246 -7.193 -6.942
225 H SER 38 H SER 38 5.176 -3.612 -7.725
226 HA SER 38 HA SER 38 7.043 -1.390 -7.439
227 HB2 SER 38 1HB SER 38 7.032 -1.080 -9.960
228 HB3 SER 38 2HB SER 38 7.980 -2.442 -9.364
229 HG SER 38 HG SER 38 5.332 -2.587 -10.381
230 H LEU 39 H LEU 39 6.181 0.600 -8.558
231 HA LEU 39 HA LEU 39 3.761 1.373 -7.589
232 HB2 LEU 39 1HB LEU 39 5.454 2.292 -9.837
233 HB3 LEU 39 2HB LEU 39 3.802 2.903 -9.781
234 HG LEU 39 HG LEU 39 5.890 3.221 -7.625
235 HD11 LEU 39 1HD1 LEU 39 6.438 5.180 -8.532
236 HD12 LEU 39 2HD1 LEU 39 4.754 5.610 -8.828
237 HD13 LEU 39 3HD1 LEU 39 5.626 4.610 -9.990
238 HD21 LEU 39 3HD2 LEU 39 2.973 3.805 -7.743
239 HD22 LEU 39 1HD2 LEU 39 4.030 4.928 -6.885
240 HD23 LEU 39 2HD2 LEU 39 3.959 3.235 -6.396
241 H ARG 40 H ARG 40 4.384 -0.365 -10.570
242 HA ARG 40 HA ARG 40 2.050 -0.087 -11.963
243 HB2 ARG 40 1HB ARG 40 3.511 -2.699 -11.540
244 HB3 ARG 40 2HB ARG 40 2.441 -2.309 -12.879
245 HG2 ARG 40 1HG ARG 40 4.769 -0.533 -12.434
246 HG3 ARG 40 2HG ARG 40 5.078 -2.149 -13.071
247 HD2 ARG 40 1HD ARG 40 3.687 -1.764 -14.956
248 HD3 ARG 40 2HD ARG 40 3.042 -0.279 -14.258
249 HE ARG 40 HE ARG 40 5.634 0.315 -14.446
250 HH11 ARG 40 2HH1 ARG 40 3.454 -1.146 -16.734
251 HH12 ARG 40 1HH1 ARG 40 4.279 -0.515 -18.121
252 HH21 ARG 40 2HH2 ARG 40 6.728 1.152 -16.264
253 HH22 ARG 40 1HH2 ARG 40 6.142 0.791 -17.852
254 H CYS 41 H CYS 41 2.648 -2.483 -9.392
255 HA CYS 41 HA CYS 41 -0.074 -3.369 -9.363
256 HB2 CYS 41 1HB CYS 41 2.329 -3.884 -7.633
257 HB3 CYS 41 2HB CYS 41 0.735 -4.455 -7.148
258 H TYR 42 H TYR 42 1.720 -0.871 -7.789
259 HA TYR 42 HA TYR 42 0.140 -0.498 -5.496
260 HB2 TYR 42 1HB TYR 42 2.310 0.562 -5.704
261 HB3 TYR 42 2HB TYR 42 1.763 1.492 -7.095
262 HD1 TYR 42 1HD TYR 42 0.674 0.889 -3.563
263 HD2 TYR 42 2HD TYR 42 1.273 3.704 -6.697
264 HE1 TYR 42 1HE TYR 42 -0.037 2.702 -2.062
265 HE2 TYR 42 2HE TYR 42 0.565 5.525 -5.204
266 HH TYR 42 HH TYR 42 0.197 6.071 -3.011
267 H ARG 43 H ARG 43 -0.407 0.271 -8.817
268 HA ARG 43 HA ARG 43 -2.626 2.060 -8.160
269 HB2 ARG 43 1HB ARG 43 -1.083 1.453 -10.650
270 HB3 ARG 43 2HB ARG 43 -2.709 2.107 -10.790
271 HG2 ARG 43 1HG ARG 43 -2.082 4.066 -9.540
272 HG3 ARG 43 2HG ARG 43 -0.479 3.395 -9.231
273 HD2 ARG 43 1HD ARG 43 -0.317 4.992 -11.017
274 HD3 ARG 43 2HD ARG 43 -0.073 3.376 -11.678
275 HE ARG 43 HE ARG 43 -2.684 3.727 -12.098
276 HH11 ARG 43 2HH1 ARG 43 0.032 5.823 -12.690
277 HH12 ARG 43 1HH1 ARG 43 -0.705 6.611 -14.046
278 HH21 ARG 43 2HH2 ARG 43 -3.665 4.756 -13.881
279 HH22 ARG 43 1HH2 ARG 43 -2.808 6.004 -14.722
280 H THR 44 H THR 44 -1.943 -1.097 -9.514
281 HA THR 44 HA THR 44 -4.637 -1.589 -10.374
282 HB THR 44 HB THR 44 -2.323 -3.496 -9.985
283 HG1 THR 44 1HG THR 44 -3.434 -2.448 -12.389
284 HG21 THR 44 3HG2 THR 44 -3.765 -4.894 -11.607
285 HG22 THR 44 1HG2 THR 44 -5.101 -3.887 -11.050
286 HG23 THR 44 2HG2 THR 44 -4.204 -4.877 -9.899
287 H HIS 45 H HIS 45 -2.616 -2.955 -7.769
288 HA HIS 45 HA HIS 45 -4.271 -4.625 -6.493
289 HB2 HIS 45 1HB HIS 45 -3.005 -4.343 -4.590
290 HB3 HIS 45 2HB HIS 45 -1.947 -3.596 -5.783
291 HD1 HIS 45 1HD HIS 45 -1.661 -1.032 -5.674
292 HD2 HIS 45 2HD HIS 45 -4.147 -2.587 -2.731
293 HE1 HIS 45 1HE HIS 45 -1.978 0.827 -4.011
294 H GLY 46 H GLY 46 -4.370 -1.091 -6.058
295 HA2 GLY 46 1HA GLY 46 -7.226 -1.190 -5.646
296 HA3 GLY 46 2HA GLY 46 -6.316 -0.773 -4.201
297 H THR 47 H THR 47 -7.965 1.104 -4.814
298 HA THR 47 HA THR 47 -6.529 3.061 -6.481
299 HB THR 47 HB THR 47 -8.719 4.328 -6.443
300 HG1 THR 47 1HG THR 47 -9.401 2.725 -4.607
301 HG21 THR 47 3HG2 THR 47 -9.599 3.148 -8.273
302 HG22 THR 47 1HG2 THR 47 -9.045 1.595 -7.650
303 HG23 THR 47 2HG2 THR 47 -7.880 2.757 -8.285
304 H CYS 48 H CYS 48 -5.655 2.518 -3.844
305 HA CYS 48 HA CYS 48 -6.688 4.507 -2.054
306 HB2 CYS 48 1HB CYS 48 -4.006 3.216 -1.699
307 HB3 CYS 48 2HB CYS 48 -5.193 3.669 -0.480
308 H ALA 49 H ALA 49 -4.023 4.279 -4.314
309 HA ALA 49 HA ALA 49 -2.371 6.323 -3.551
310 HB1 ALA 49 3HB ALA 49 -2.940 4.921 -6.001
311 HB2 ALA 49 1HB ALA 49 -2.570 6.616 -6.319
312 HB3 ALA 49 2HB ALA 49 -1.422 5.615 -5.430
313 H GLU 50 H GLU 50 -5.442 6.583 -5.289
314 HA GLU 50 HA GLU 50 -5.235 9.470 -5.439
315 HB2 GLU 50 1HB GLU 50 -7.216 7.437 -6.400
316 HB3 GLU 50 2HB GLU 50 -7.672 9.133 -6.324
317 HG2 GLU 50 1HG GLU 50 -6.897 8.502 -8.545
318 HG3 GLU 50 2HG GLU 50 -5.853 9.718 -7.812
319 H ASN 51 H ASN 51 -5.297 8.186 -2.810
320 HA ASN 51 HA ASN 51 -7.679 9.546 -1.745
321 HB2 ASN 51 1HB ASN 51 -7.678 6.930 -1.738
322 HB3 ASN 51 2HB ASN 51 -6.565 7.115 -0.386
323 HD21 ASN 51 1HD2 ASN 51 -7.295 8.057 1.528
324 HD22 ASN 51 2HD2 ASN 51 -8.979 8.188 1.892
325 H PHE 52 H PHE 52 -4.364 8.486 -1.221
326 HA PHE 52 HA PHE 52 -4.148 10.183 1.150
327 HB2 PHE 52 1HB PHE 52 -3.064 8.220 1.666
328 HB3 PHE 52 2HB PHE 52 -2.546 7.945 0.006
329 HD1 PHE 52 2HD PHE 52 -1.946 10.229 2.884
330 HD2 PHE 52 1HD PHE 52 -0.347 8.323 -0.569
331 HE1 PHE 52 2HE PHE 52 0.287 11.098 3.443
332 HE2 PHE 52 1HE PHE 52 1.889 9.188 -0.015
333 HZ PHE 52 HZ PHE 52 2.208 10.579 1.992
334 H TYR 53 H TYR 53 -3.512 12.214 0.938
335 HA TYR 53 HA TYR 53 -2.047 13.013 -1.469
336 HB2 TYR 53 1HB TYR 53 -3.303 14.801 0.618
337 HB3 TYR 53 2HB TYR 53 -2.739 15.265 -0.984
338 HD1 TYR 53 1HD TYR 53 -3.869 13.304 -2.758
339 HD2 TYR 53 2HD TYR 53 -5.595 15.080 0.701
340 HE1 TYR 53 1HE TYR 53 -6.114 12.889 -3.673
341 HE2 TYR 53 2HE TYR 53 -7.845 14.668 -0.203
342 HH TYR 53 HH TYR 53 -8.859 14.350 -2.540
343 H SER 54 H SER 54 0.090 12.950 -1.274
344 HA SER 54 HA SER 54 1.344 13.443 1.312
345 HB2 SER 54 1HB SER 54 3.400 12.638 0.248
346 HB3 SER 54 2HB SER 54 2.081 11.497 -0.013
347 HG SER 54 HG SER 54 3.490 12.179 -1.881
348 H GLY 55 H GLY 55 3.015 14.984 1.608
349 HA2 GLY 55 1HA GLY 55 3.855 17.118 1.469
350 HA3 GLY 55 2HA GLY 55 4.005 16.778 -0.248
351 HA PRO 56 HA PRO 56 -0.131 19.185 0.714
352 HB2 PRO 56 1HB PRO 56 0.190 20.988 2.718
353 HB3 PRO 56 2HB PRO 56 -0.418 19.351 2.988
354 HG2 PRO 56 1HG PRO 56 2.343 20.435 3.389
355 HG3 PRO 56 2HG PRO 56 1.406 19.348 4.430
356 HD2 PRO 56 1HD PRO 56 3.343 18.457 2.762
357 HD3 PRO 56 2HD PRO 56 1.905 17.493 3.156
358 H SER 57 H SER 57 -0.571 21.074 -0.357
359 HA SER 57 HA SER 57 1.632 22.983 -0.729
360 HB2 SER 57 1HB SER 57 -0.019 21.660 -2.881
361 HB3 SER 57 2HB SER 57 0.864 23.161 -3.158
362 HG SER 57 HG SER 57 2.759 21.963 -2.403
363 H SER 58 H SER 58 1.052 25.090 -0.735
364 HA SER 58 HA SER 58 -1.723 25.693 -0.101
365 HB2 SER 58 1HB SER 58 -0.130 26.722 1.357
366 HB3 SER 58 2HB SER 58 0.810 27.337 -0.001
367 HG SER 58 HG SER 58 -1.860 28.105 0.145
368 H GLY 59 H GLY 59 -3.123 26.672 -1.432
369 HA2 GLY 59 1HA GLY 59 -3.786 28.128 -3.165
370 HA3 GLY 59 2HA GLY 59 -2.134 28.133 -3.762
Start of MODEL 16
1 H1 GLY 1 1H GLY 1 17.638 -10.767 16.291
2 HA2 GLY 1 1HA GLY 1 19.094 -10.083 18.382
3 HA3 GLY 1 2HA GLY 1 20.287 -11.026 17.501
4 H SER 2 H SER 2 18.324 -8.124 17.469
5 HA SER 2 HA SER 2 20.322 -6.784 15.863
6 HB2 SER 2 1HB SER 2 18.776 -6.028 14.133
7 HB3 SER 2 2HB SER 2 18.830 -7.790 14.159
8 HG SER 2 HG SER 2 16.914 -7.539 15.621
9 H SER 3 H SER 3 20.403 -4.616 16.246
10 HA SER 3 HA SER 3 18.193 -3.272 17.562
11 HB2 SER 3 1HB SER 3 20.887 -3.613 18.900
12 HB3 SER 3 2HB SER 3 19.645 -2.482 19.437
13 HG SER 3 HG SER 3 18.308 -4.588 19.364
14 H GLY 4 H GLY 4 18.204 -1.069 17.274
15 HA2 GLY 4 1HA GLY 4 19.577 0.959 16.894
16 HA3 GLY 4 2HA GLY 4 20.481 0.007 15.725
17 H SER 5 H SER 5 19.051 -0.968 13.945
18 HA SER 5 HA SER 5 17.914 1.125 12.479
19 HB2 SER 5 1HB SER 5 18.769 -0.789 11.313
20 HB3 SER 5 2HB SER 5 17.671 -1.873 12.168
21 HG SER 5 HG SER 5 16.115 -1.348 10.840
22 H SER 6 H SER 6 15.709 1.373 11.733
23 HA SER 6 HA SER 6 13.828 1.062 13.920
24 HB2 SER 6 1HB SER 6 13.614 2.476 11.253
25 HB3 SER 6 2HB SER 6 12.333 2.454 12.465
26 HG SER 6 HG SER 6 13.868 4.302 12.461
27 H GLY 7 H GLY 7 14.572 -1.377 12.745
28 HA2 GLY 7 1HA GLY 7 13.340 -3.323 12.349
29 HA3 GLY 7 2HA GLY 7 11.946 -2.332 11.946
30 H MET 8 H MET 8 14.590 -4.121 10.742
31 HA MET 8 HA MET 8 14.250 -3.054 8.037
32 HB2 MET 8 1HB MET 8 16.374 -4.604 9.431
33 HB3 MET 8 2HB MET 8 16.186 -4.860 7.702
34 HG2 MET 8 1HG MET 8 16.323 -2.067 8.692
35 HG3 MET 8 2HG MET 8 17.803 -3.022 8.678
36 HE1 MET 8 3HE MET 8 19.164 -3.533 6.086
37 HE2 MET 8 1HE MET 8 19.090 -1.853 5.553
38 HE3 MET 8 2HE MET 8 19.234 -2.227 7.270
39 H GLU 9 H GLU 9 12.093 -4.512 9.093
40 HA GLU 9 HA GLU 9 11.869 -7.176 8.711
41 HB2 GLU 9 1HB GLU 9 10.027 -5.547 9.303
42 HB3 GLU 9 2HB GLU 9 9.849 -5.240 7.581
43 HG2 GLU 9 1HG GLU 9 9.390 -7.654 7.251
44 HG3 GLU 9 2HG GLU 9 9.430 -7.858 9.001
45 HA PRO 10 HA PRO 10 13.006 -8.070 4.548
46 HB2 PRO 10 1HB PRO 10 11.844 -10.514 4.334
47 HB3 PRO 10 2HB PRO 10 13.320 -10.230 5.265
48 HG2 PRO 10 1HG PRO 10 10.492 -10.462 6.221
49 HG3 PRO 10 2HG PRO 10 11.970 -11.153 6.918
50 HD2 PRO 10 1HD PRO 10 10.805 -8.915 7.900
51 HD3 PRO 10 2HD PRO 10 12.560 -9.177 7.946
52 H ALA 11 H ALA 11 12.099 -8.370 2.448
53 HA ALA 11 HA ALA 11 9.623 -7.030 2.060
54 HB1 ALA 11 3HB ALA 11 11.704 -7.174 0.513
55 HB2 ALA 11 1HB ALA 11 10.932 -8.640 -0.091
56 HB3 ALA 11 2HB ALA 11 10.093 -7.092 -0.201
57 H GLY 12 H GLY 12 7.823 -7.927 0.743
58 HA2 GLY 12 1HA GLY 12 7.301 -10.732 1.514
59 HA3 GLY 12 2HA GLY 12 6.060 -9.488 1.465
60 HA PRO 13 HA PRO 13 6.626 -11.833 -2.674
61 HB2 PRO 13 1HB PRO 13 4.662 -13.690 -2.422
62 HB3 PRO 13 2HB PRO 13 6.335 -13.990 -1.937
63 HG2 PRO 13 1HG PRO 13 3.980 -13.234 -0.250
64 HG3 PRO 13 2HG PRO 13 5.245 -14.435 0.069
65 HD2 PRO 13 1HD PRO 13 5.262 -11.970 1.188
66 HD3 PRO 13 2HD PRO 13 6.753 -12.843 0.781
67 H CYS 14 H CYS 14 5.750 -10.320 -3.965
68 HA CYS 14 HA CYS 14 3.278 -9.042 -3.537
69 HB2 CYS 14 1HB CYS 14 5.033 -8.026 -4.893
70 HB3 CYS 14 2HB CYS 14 4.900 -9.323 -6.076
71 H GLY 15 H GLY 15 1.473 -10.257 -3.398
72 HA2 GLY 15 1HA GLY 15 1.007 -12.537 -5.077
73 HA3 GLY 15 2HA GLY 15 -0.133 -11.824 -3.944
74 H PHE 16 H PHE 16 -0.313 -9.244 -4.938
75 HA PHE 16 HA PHE 16 -2.345 -9.225 -6.661
76 HB2 PHE 16 1HB PHE 16 -0.025 -7.290 -6.829
77 HB3 PHE 16 2HB PHE 16 -1.652 -7.000 -7.436
78 HD1 PHE 16 1HD PHE 16 -3.379 -7.897 -5.324
79 HD2 PHE 16 2HD PHE 16 0.354 -5.869 -5.064
80 HE1 PHE 16 1HE PHE 16 -4.032 -6.982 -3.135
81 HE2 PHE 16 2HE PHE 16 -0.293 -4.952 -2.875
82 HZ PHE 16 HZ PHE 16 -2.488 -5.508 -1.907
83 H CYS 17 H CYS 17 1.028 -9.632 -7.593
84 HA CYS 17 HA CYS 17 0.693 -9.484 -10.377
85 HB2 CYS 17 1HB CYS 17 2.752 -10.620 -8.546
86 HB3 CYS 17 2HB CYS 17 2.793 -11.115 -10.235
87 HA PRO 18 HA PRO 18 -1.256 -13.247 -11.516
88 HB2 PRO 18 1HB PRO 18 -0.046 -13.776 -13.888
89 HB3 PRO 18 2HB PRO 18 -1.222 -12.473 -13.679
90 HG2 PRO 18 1HG PRO 18 1.768 -12.336 -13.723
91 HG3 PRO 18 2HG PRO 18 0.587 -11.258 -14.490
92 HD2 PRO 18 1HD PRO 18 1.834 -10.635 -12.169
93 HD3 PRO 18 2HD PRO 18 0.180 -10.106 -12.536
94 H ALA 19 H ALA 19 -0.996 -15.288 -10.868
95 HA ALA 19 HA ALA 19 0.977 -16.473 -9.598
96 HB1 ALA 19 3HB ALA 19 0.300 -18.596 -11.172
97 HB2 ALA 19 1HB ALA 19 -0.624 -18.028 -9.780
98 HB3 ALA 19 2HB ALA 19 -1.073 -17.515 -11.407
99 H GLY 20 H GLY 20 3.020 -17.164 -9.867
100 HA2 GLY 20 1HA GLY 20 4.836 -18.073 -11.082
101 HA3 GLY 20 2HA GLY 20 4.052 -17.579 -12.576
102 H GLU 21 H GLU 21 3.572 -14.920 -12.138
103 HA GLU 21 HA GLU 21 6.256 -13.849 -12.354
104 HB2 GLU 21 1HB GLU 21 3.510 -12.864 -12.986
105 HB3 GLU 21 2HB GLU 21 4.787 -11.681 -12.739
106 HG2 GLU 21 1HG GLU 21 4.792 -13.910 -14.761
107 HG3 GLU 21 2HG GLU 21 4.536 -12.197 -15.088
108 H VAL 22 H VAL 22 5.765 -14.716 -9.783
109 HA VAL 22 HA VAL 22 4.847 -12.626 -8.075
110 HB VAL 22 HB VAL 22 6.511 -15.076 -7.489
111 HG11 VAL 22 1HG1 VAL 22 5.717 -12.805 -5.788
112 HG12 VAL 22 2HG1 VAL 22 5.444 -14.410 -5.106
113 HG13 VAL 22 3HG1 VAL 22 7.062 -13.933 -5.623
114 HG21 VAL 22 3HG2 VAL 22 3.913 -15.048 -6.296
115 HG22 VAL 22 1HG2 VAL 22 3.767 -14.727 -8.024
116 HG23 VAL 22 2HG2 VAL 22 4.586 -16.185 -7.464
117 H GLN 23 H GLN 23 5.873 -10.833 -7.510
118 HA GLN 23 HA GLN 23 8.811 -10.766 -7.735
119 HB2 GLN 23 1HB GLN 23 6.732 -8.683 -8.338
120 HB3 GLN 23 2HB GLN 23 8.387 -8.220 -7.965
121 HG2 GLN 23 1HG GLN 23 9.215 -9.461 -9.846
122 HG3 GLN 23 2HG GLN 23 7.609 -10.108 -10.174
123 HE21 GLN 23 1HE2 GLN 23 6.563 -9.146 -11.748
124 HE22 GLN 23 2HE2 GLN 23 6.764 -7.509 -12.260
125 HA PRO 24 HA PRO 24 9.134 -9.715 -3.488
126 HB2 PRO 24 1HB PRO 24 11.241 -8.004 -3.505
127 HB3 PRO 24 2HB PRO 24 11.414 -9.743 -3.769
128 HG2 PRO 24 1HG PRO 24 11.325 -7.522 -5.774
129 HG3 PRO 24 2HG PRO 24 12.392 -8.938 -5.718
130 HD2 PRO 24 1HD PRO 24 10.223 -8.811 -7.334
131 HD3 PRO 24 2HD PRO 24 10.796 -10.333 -6.623
132 H ALA 25 H ALA 25 7.348 -8.573 -2.855
133 HA ALA 25 HA ALA 25 6.886 -5.858 -3.650
134 HB1 ALA 25 3HB ALA 25 5.228 -6.237 -1.529
135 HB2 ALA 25 1HB ALA 25 4.852 -6.685 -3.193
136 HB3 ALA 25 2HB ALA 25 5.484 -7.894 -2.074
137 H ARG 26 H ARG 26 9.162 -5.281 -2.886
138 HA ARG 26 HA ARG 26 9.827 -5.112 -0.175
139 HB2 ARG 26 1HB ARG 26 10.688 -3.512 -2.577
140 HB3 ARG 26 2HB ARG 26 11.333 -3.197 -0.972
141 HG2 ARG 26 1HG ARG 26 12.429 -5.243 -0.873
142 HG3 ARG 26 2HG ARG 26 11.435 -5.944 -2.151
143 HD2 ARG 26 1HD ARG 26 13.396 -5.545 -3.283
144 HD3 ARG 26 2HD ARG 26 12.505 -4.059 -3.611
145 HE ARG 26 HE ARG 26 14.205 -3.951 -1.283
146 HH11 ARG 26 2HH1 ARG 26 13.970 -3.446 -4.719
147 HH12 ARG 26 1HH1 ARG 26 15.296 -2.332 -4.778
148 HH21 ARG 26 2HH2 ARG 26 15.952 -2.486 -1.347
149 HH22 ARG 26 1HH2 ARG 26 16.423 -1.787 -2.859
150 H TYR 27 H TYR 27 7.700 -3.199 -2.118
151 HA TYR 27 HA TYR 27 7.499 -1.166 -0.009
152 HB2 TYR 27 1HB TYR 27 6.142 -1.002 -2.687
153 HB3 TYR 27 2HB TYR 27 6.595 0.307 -1.600
154 HD1 TYR 27 1HD TYR 27 9.242 0.395 -1.126
155 HD2 TYR 27 2HD TYR 27 7.410 -1.263 -4.590
156 HE1 TYR 27 1HE TYR 27 11.334 0.716 -2.379
157 HE2 TYR 27 2HE TYR 27 9.498 -0.949 -5.852
158 HH TYR 27 HH TYR 27 12.179 -0.755 -4.956
159 H THR 28 H THR 28 5.239 -0.322 0.368
160 HA THR 28 HA THR 28 3.110 -2.262 0.003
161 HB THR 28 HB THR 28 3.441 -1.367 2.819
162 HG1 THR 28 1HG THR 28 5.524 -2.291 1.919
163 HG21 THR 28 3HG2 THR 28 2.372 -3.458 3.302
164 HG22 THR 28 1HG2 THR 28 2.619 -4.026 1.651
165 HG23 THR 28 2HG2 THR 28 1.499 -2.702 1.970
166 H CYS 29 H CYS 29 1.080 -1.370 0.089
167 HA CYS 29 HA CYS 29 0.855 1.418 -0.290
168 HB2 CYS 29 1HB CYS 29 -0.694 -0.322 -1.228
169 HB3 CYS 29 2HB CYS 29 -1.376 -0.508 0.385
170 HA PRO 30 HA PRO 30 0.868 2.530 4.040
171 HB2 PRO 30 1HB PRO 30 0.710 5.206 3.613
172 HB3 PRO 30 2HB PRO 30 2.212 4.292 3.433
173 HG2 PRO 30 1HG PRO 30 0.288 5.206 1.330
174 HG3 PRO 30 2HG PRO 30 2.060 5.243 1.317
175 HD2 PRO 30 1HD PRO 30 0.633 3.336 0.028
176 HD3 PRO 30 2HD PRO 30 2.228 3.017 0.741
177 H ARG 31 H ARG 31 -1.628 2.400 1.939
178 HA ARG 31 HA ARG 31 -3.486 3.831 3.718
179 HB2 ARG 31 1HB ARG 31 -3.450 3.310 0.791
180 HB3 ARG 31 2HB ARG 31 -5.020 3.320 1.585
181 HG2 ARG 31 1HG ARG 31 -3.174 5.574 2.144
182 HG3 ARG 31 2HG ARG 31 -3.947 5.505 0.559
183 HD2 ARG 31 1HD ARG 31 -5.295 5.564 3.253
184 HD3 ARG 31 2HD ARG 31 -5.318 6.823 2.019
185 HE ARG 31 HE ARG 31 -6.362 4.469 0.917
186 HH11 ARG 31 2HH1 ARG 31 -7.155 6.869 3.310
187 HH12 ARG 31 1HH1 ARG 31 -8.867 6.673 3.128
188 HH21 ARG 31 2HH2 ARG 31 -8.614 4.202 0.668
189 HH22 ARG 31 1HH2 ARG 31 -9.695 5.155 1.626
190 H CYS 32 H CYS 32 -2.852 0.774 2.095
191 HA CYS 32 HA CYS 32 -4.755 -0.514 3.924
192 HB2 CYS 32 1HB CYS 32 -5.622 -1.927 2.191
193 HB3 CYS 32 2HB CYS 32 -5.750 -0.262 1.632
194 H ASN 33 H ASN 33 -1.777 -0.189 3.777
195 HA ASN 33 HA ASN 33 0.151 -1.454 3.811
196 HB2 ASN 33 1HB ASN 33 -1.686 -3.224 5.439
197 HB3 ASN 33 2HB ASN 33 0.070 -3.153 5.553
198 HD21 ASN 33 1HD2 ASN 33 -0.206 -2.688 7.785
199 HD22 ASN 33 2HD2 ASN 33 -0.605 -1.090 8.305
200 H ALA 34 H ALA 34 -0.734 -1.906 1.391
201 HA ALA 34 HA ALA 34 -0.899 -4.820 1.033
202 HB1 ALA 34 3HB ALA 34 -2.657 -4.099 -0.198
203 HB2 ALA 34 1HB ALA 34 -1.947 -2.510 -0.485
204 HB3 ALA 34 2HB ALA 34 -1.407 -3.901 -1.427
205 HA PRO 35 HA PRO 35 3.395 -4.494 -0.191
206 HB2 PRO 35 1HB PRO 35 3.752 -7.161 -0.552
207 HB3 PRO 35 2HB PRO 35 3.744 -6.400 1.044
208 HG2 PRO 35 1HG PRO 35 1.550 -7.871 -0.365
209 HG3 PRO 35 2HG PRO 35 2.051 -7.968 1.333
210 HD2 PRO 35 1HD PRO 35 -0.093 -6.524 0.527
211 HD3 PRO 35 2HD PRO 35 0.915 -6.047 1.909
212 H TYR 36 H TYR 36 3.879 -3.812 -2.176
213 HA TYR 36 HA TYR 36 2.941 -5.399 -4.473
214 HB2 TYR 36 1HB TYR 36 2.785 -3.289 -5.764
215 HB3 TYR 36 2HB TYR 36 1.664 -3.336 -4.408
216 HD1 TYR 36 2HD TYR 36 4.709 -1.785 -5.741
217 HD2 TYR 36 1HD TYR 36 1.926 -1.844 -2.523
218 HE1 TYR 36 2HE TYR 36 5.607 0.357 -4.932
219 HE2 TYR 36 1HE TYR 36 2.815 0.298 -1.706
220 HH TYR 36 HH TYR 36 5.050 1.559 -1.905
221 H CYS 37 H CYS 37 4.345 -5.561 -6.240
222 HA CYS 37 HA CYS 37 7.118 -5.524 -5.572
223 HB2 CYS 37 1HB CYS 37 7.461 -6.349 -7.863
224 HB3 CYS 37 2HB CYS 37 6.188 -7.245 -7.041
225 H SER 38 H SER 38 5.115 -3.667 -7.846
226 HA SER 38 HA SER 38 7.015 -1.460 -7.655
227 HB2 SER 38 1HB SER 38 6.457 -3.034 -10.121
228 HB3 SER 38 2HB SER 38 6.598 -1.285 -10.290
229 HG SER 38 HG SER 38 8.530 -2.822 -8.913
230 H LEU 39 H LEU 39 6.100 0.463 -9.012
231 HA LEU 39 HA LEU 39 3.753 1.332 -7.875
232 HB2 LEU 39 1HB LEU 39 5.188 2.104 -10.383
233 HB3 LEU 39 2HB LEU 39 3.654 2.865 -9.967
234 HG LEU 39 HG LEU 39 5.607 4.216 -9.312
235 HD11 LEU 39 1HD1 LEU 39 4.878 4.689 -7.042
236 HD12 LEU 39 2HD1 LEU 39 4.020 3.150 -6.981
237 HD13 LEU 39 3HD1 LEU 39 3.492 4.410 -8.096
238 HD21 LEU 39 3HD2 LEU 39 7.117 2.313 -8.831
239 HD22 LEU 39 1HD2 LEU 39 6.189 1.986 -7.368
240 HD23 LEU 39 2HD2 LEU 39 7.067 3.506 -7.533
241 H ARG 40 H ARG 40 4.191 -0.332 -10.966
242 HA ARG 40 HA ARG 40 1.706 -0.129 -12.084
243 HB2 ARG 40 1HB ARG 40 2.114 -2.426 -13.024
244 HB3 ARG 40 2HB ARG 40 3.428 -1.283 -13.263
245 HG2 ARG 40 1HG ARG 40 4.733 -2.298 -11.557
246 HG3 ARG 40 2HG ARG 40 3.374 -3.291 -11.026
247 HD2 ARG 40 1HD ARG 40 4.607 -4.786 -12.285
248 HD3 ARG 40 2HD ARG 40 3.423 -4.202 -13.455
249 HE ARG 40 HE ARG 40 5.420 -2.535 -13.933
250 HH11 ARG 40 2HH1 ARG 40 5.477 -5.976 -13.404
251 HH12 ARG 40 1HH1 ARG 40 6.872 -6.237 -14.397
252 HH21 ARG 40 2HH2 ARG 40 7.257 -2.866 -15.243
253 HH22 ARG 40 1HH2 ARG 40 7.885 -4.468 -15.442
254 H CYS 41 H CYS 41 2.703 -2.261 -9.453
255 HA CYS 41 HA CYS 41 0.090 -3.494 -9.282
256 HB2 CYS 41 1HB CYS 41 2.724 -3.858 -7.946
257 HB3 CYS 41 2HB CYS 41 1.291 -4.361 -7.056
258 H TYR 42 H TYR 42 2.006 -1.143 -7.475
259 HA TYR 42 HA TYR 42 0.394 -0.848 -5.234
260 HB2 TYR 42 1HB TYR 42 2.513 0.220 -5.227
261 HB3 TYR 42 2HB TYR 42 2.155 1.112 -6.701
262 HD1 TYR 42 1HD TYR 42 0.732 0.713 -3.262
263 HD2 TYR 42 2HD TYR 42 1.681 3.351 -6.462
264 HE1 TYR 42 1HE TYR 42 -0.044 2.618 -1.914
265 HE2 TYR 42 2HE TYR 42 0.910 5.264 -5.122
266 HH TYR 42 HH TYR 42 -0.374 4.809 -1.840
267 H ARG 43 H ARG 43 -0.090 0.241 -8.491
268 HA ARG 43 HA ARG 43 -2.307 1.974 -7.706
269 HB2 ARG 43 1HB ARG 43 -0.911 1.477 -10.332
270 HB3 ARG 43 2HB ARG 43 -2.393 2.417 -10.216
271 HG2 ARG 43 1HG ARG 43 -1.303 4.021 -8.770
272 HG3 ARG 43 2HG ARG 43 0.174 3.055 -8.778
273 HD2 ARG 43 1HD ARG 43 0.464 4.843 -10.331
274 HD3 ARG 43 2HD ARG 43 0.263 3.355 -11.255
275 HE ARG 43 HE ARG 43 -2.163 4.866 -10.832
276 HH11 ARG 43 2HH1 ARG 43 0.578 4.289 -12.900
277 HH12 ARG 43 1HH1 ARG 43 -0.194 4.920 -14.317
278 HH21 ARG 43 2HH2 ARG 43 -3.190 5.699 -12.691
279 HH22 ARG 43 1HH2 ARG 43 -2.336 5.722 -14.197
280 H THR 44 H THR 44 -1.651 -1.029 -9.415
281 HA THR 44 HA THR 44 -4.293 -1.439 -10.371
282 HB THR 44 HB THR 44 -2.071 -3.430 -9.884
283 HG1 THR 44 1HG THR 44 -2.911 -2.630 -12.432
284 HG21 THR 44 3HG2 THR 44 -3.385 -4.822 -11.533
285 HG22 THR 44 1HG2 THR 44 -4.733 -3.716 -11.269
286 HG23 THR 44 2HG2 THR 44 -4.100 -4.670 -9.928
287 H HIS 45 H HIS 45 -2.514 -2.931 -7.662
288 HA HIS 45 HA HIS 45 -4.295 -4.595 -6.563
289 HB2 HIS 45 1HB HIS 45 -3.185 -4.378 -4.555
290 HB3 HIS 45 2HB HIS 45 -2.019 -3.629 -5.642
291 HD1 HIS 45 1HD HIS 45 -1.479 -1.190 -5.269
292 HD2 HIS 45 2HD HIS 45 -4.654 -2.520 -2.943
293 HE1 HIS 45 1HE HIS 45 -1.948 0.671 -3.644
294 H GLY 46 H GLY 46 -4.334 -1.083 -5.922
295 HA2 GLY 46 1HA GLY 46 -7.226 -1.114 -5.812
296 HA3 GLY 46 2HA GLY 46 -6.447 -0.800 -4.268
297 H THR 47 H THR 47 -8.018 1.140 -5.010
298 HA THR 47 HA THR 47 -6.357 3.143 -6.384
299 HB THR 47 HB THR 47 -9.291 3.453 -5.776
300 HG1 THR 47 1HG THR 47 -9.000 1.564 -7.056
301 HG21 THR 47 3HG2 THR 47 -8.797 5.495 -6.565
302 HG22 THR 47 1HG2 THR 47 -8.711 4.717 -8.144
303 HG23 THR 47 2HG2 THR 47 -7.240 4.969 -7.204
304 H CYS 48 H CYS 48 -5.642 2.564 -3.788
305 HA CYS 48 HA CYS 48 -6.893 4.353 -1.932
306 HB2 CYS 48 1HB CYS 48 -4.162 3.112 -1.628
307 HB3 CYS 48 2HB CYS 48 -5.275 3.612 -0.359
308 H ALA 49 H ALA 49 -3.969 4.405 -3.908
309 HA ALA 49 HA ALA 49 -2.702 6.643 -2.904
310 HB1 ALA 49 3HB ALA 49 -2.793 5.337 -5.568
311 HB2 ALA 49 1HB ALA 49 -2.074 6.944 -5.459
312 HB3 ALA 49 2HB ALA 49 -1.426 5.620 -4.490
313 H GLU 50 H GLU 50 -5.341 6.474 -5.262
314 HA GLU 50 HA GLU 50 -5.595 8.927 -6.268
315 HB2 GLU 50 1HB GLU 50 -7.283 6.937 -6.231
316 HB3 GLU 50 2HB GLU 50 -8.011 7.808 -4.888
317 HG2 GLU 50 1HG GLU 50 -7.901 9.819 -6.591
318 HG3 GLU 50 2HG GLU 50 -7.898 8.508 -7.769
319 H ASN 51 H ASN 51 -6.981 8.165 -3.066
320 HA ASN 51 HA ASN 51 -7.451 10.881 -2.404
321 HB2 ASN 51 1HB ASN 51 -8.324 10.094 -0.419
322 HB3 ASN 51 2HB ASN 51 -8.452 8.648 -1.417
323 HD21 ASN 51 1HD2 ASN 51 -6.484 10.263 1.005
324 HD22 ASN 51 2HD2 ASN 51 -5.781 8.826 1.658
325 H PHE 52 H PHE 52 -4.841 8.620 -1.668
326 HA PHE 52 HA PHE 52 -3.408 9.882 0.250
327 HB2 PHE 52 1HB PHE 52 -2.852 7.770 -1.182
328 HB3 PHE 52 2HB PHE 52 -1.948 8.903 -2.182
329 HD1 PHE 52 2HD PHE 52 -2.278 7.624 1.281
330 HD2 PHE 52 1HD PHE 52 0.196 9.588 -1.572
331 HE1 PHE 52 2HE PHE 52 -0.370 7.458 2.826
332 HE2 PHE 52 1HE PHE 52 2.108 9.424 -0.033
333 HZ PHE 52 HZ PHE 52 1.826 8.359 2.170
334 H TYR 53 H TYR 53 -3.178 10.610 -3.229
335 HA TYR 53 HA TYR 53 -2.007 13.217 -2.508
336 HB2 TYR 53 1HB TYR 53 -0.680 13.178 -4.441
337 HB3 TYR 53 2HB TYR 53 -0.591 11.526 -3.841
338 HD1 TYR 53 1HD TYR 53 -2.288 9.842 -4.872
339 HD2 TYR 53 2HD TYR 53 -1.257 13.564 -6.657
340 HE1 TYR 53 1HE TYR 53 -3.064 9.005 -7.051
341 HE2 TYR 53 2HE TYR 53 -2.031 12.738 -8.840
342 HH TYR 53 HH TYR 53 -3.288 11.098 -9.848
343 H SER 54 H SER 54 -2.352 14.855 -4.375
344 HA SER 54 HA SER 54 -3.890 16.274 -5.293
345 HB2 SER 54 1HB SER 54 -4.339 13.623 -6.592
346 HB3 SER 54 2HB SER 54 -5.477 14.924 -6.940
347 HG SER 54 HG SER 54 -2.675 14.909 -7.361
348 H GLY 55 H GLY 55 -4.600 15.494 -2.709
349 HA2 GLY 55 1HA GLY 55 -7.529 15.659 -2.922
350 HA3 GLY 55 2HA GLY 55 -6.813 14.461 -1.853
351 HA PRO 56 HA PRO 56 -7.221 18.835 0.087
352 HB2 PRO 56 1HB PRO 56 -9.640 18.607 1.298
353 HB3 PRO 56 2HB PRO 56 -9.439 19.266 -0.329
354 HG2 PRO 56 1HG PRO 56 -10.267 16.515 0.511
355 HG3 PRO 56 2HG PRO 56 -10.934 17.541 -0.773
356 HD2 PRO 56 1HD PRO 56 -9.205 15.518 -1.275
357 HD3 PRO 56 2HD PRO 56 -9.251 16.999 -2.252
358 H SER 57 H SER 57 -5.528 17.794 1.324
359 HA SER 57 HA SER 57 -6.524 16.623 3.838
360 HB2 SER 57 1HB SER 57 -4.370 15.367 3.957
361 HB3 SER 57 2HB SER 57 -5.372 14.898 2.584
362 HG SER 57 HG SER 57 -3.887 16.837 1.698
363 H SER 58 H SER 58 -6.036 17.722 5.617
364 HA SER 58 HA SER 58 -5.054 19.179 7.064
365 HB2 SER 58 1HB SER 58 -2.679 19.101 5.188
366 HB3 SER 58 2HB SER 58 -2.676 19.632 6.870
367 HG SER 58 HG SER 58 -3.200 17.506 7.477
368 H GLY 59 H GLY 59 -6.781 20.200 5.145
369 HA2 GLY 59 1HA GLY 59 -7.290 22.587 5.061
370 HA3 GLY 59 2HA GLY 59 -5.594 22.867 4.693
Start of MODEL 17
1 H1 GLY 1 1H GLY 1 1.789 -28.127 7.876
2 HA2 GLY 1 1HA GLY 1 1.276 -26.535 6.218
3 HA3 GLY 1 2HA GLY 1 -0.410 -27.024 6.303
4 H SER 2 H SER 2 2.121 -25.317 8.103
5 HA SER 2 HA SER 2 0.124 -23.369 8.959
6 HB2 SER 2 1HB SER 2 0.875 -23.444 11.296
7 HB3 SER 2 2HB SER 2 0.228 -25.006 10.796
8 HG SER 2 HG SER 2 2.098 -25.851 11.204
9 H SER 3 H SER 3 0.867 -21.373 8.690
10 HA SER 3 HA SER 3 3.363 -20.784 7.620
11 HB2 SER 3 1HB SER 3 1.272 -19.329 7.610
12 HB3 SER 3 2HB SER 3 1.728 -18.826 9.238
13 HG SER 3 HG SER 3 2.615 -17.876 6.936
14 H GLY 4 H GLY 4 5.092 -19.445 8.553
15 HA2 GLY 4 1HA GLY 4 5.519 -20.075 11.410
16 HA3 GLY 4 2HA GLY 4 6.801 -20.183 10.214
17 H SER 5 H SER 5 7.865 -18.737 11.815
18 HA SER 5 HA SER 5 6.944 -15.963 11.708
19 HB2 SER 5 1HB SER 5 9.129 -17.277 13.339
20 HB3 SER 5 2HB SER 5 8.712 -15.566 13.420
21 HG SER 5 HG SER 5 7.676 -17.387 14.874
22 H SER 6 H SER 6 7.482 -15.366 9.616
23 HA SER 6 HA SER 6 9.835 -15.883 8.254
24 HB2 SER 6 1HB SER 6 9.232 -14.139 6.771
25 HB3 SER 6 2HB SER 6 7.701 -14.749 7.398
26 HG SER 6 HG SER 6 7.614 -12.997 8.798
27 H GLY 7 H GLY 7 11.627 -14.408 7.742
28 HA2 GLY 7 1HA GLY 7 12.298 -12.167 9.282
29 HA3 GLY 7 2HA GLY 7 12.984 -13.582 10.067
30 H MET 8 H MET 8 12.608 -12.793 6.621
31 HA MET 8 HA MET 8 15.509 -13.193 6.324
32 HB2 MET 8 1HB MET 8 15.020 -13.707 3.957
33 HB3 MET 8 2HB MET 8 14.202 -14.802 5.064
34 HG2 MET 8 1HG MET 8 12.119 -13.655 4.747
35 HG3 MET 8 2HG MET 8 12.906 -12.414 3.775
36 HE1 MET 8 3HE MET 8 10.704 -14.968 3.868
37 HE2 MET 8 1HE MET 8 10.259 -14.217 2.335
38 HE3 MET 8 2HE MET 8 10.755 -15.909 2.377
39 H GLU 9 H GLU 9 12.795 -11.174 5.264
40 HA GLU 9 HA GLU 9 14.515 -8.867 5.137
41 HB2 GLU 9 1HB GLU 9 13.408 -10.141 2.657
42 HB3 GLU 9 2HB GLU 9 13.652 -8.402 2.726
43 HG2 GLU 9 1HG GLU 9 16.043 -8.935 3.425
44 HG3 GLU 9 2HG GLU 9 15.700 -10.581 2.898
45 HA PRO 10 HA PRO 10 10.744 -6.953 6.353
46 HB2 PRO 10 1HB PRO 10 11.366 -4.372 5.783
47 HB3 PRO 10 2HB PRO 10 12.048 -5.243 7.162
48 HG2 PRO 10 1HG PRO 10 13.251 -4.713 4.472
49 HG3 PRO 10 2HG PRO 10 14.003 -4.608 6.075
50 HD2 PRO 10 1HD PRO 10 14.359 -6.733 4.434
51 HD3 PRO 10 2HD PRO 10 14.342 -6.885 6.203
52 H ALA 11 H ALA 11 9.620 -8.036 4.522
53 HA ALA 11 HA ALA 11 8.163 -6.177 2.990
54 HB1 ALA 11 3HB ALA 11 9.960 -5.903 1.524
55 HB2 ALA 11 1HB ALA 11 10.380 -7.615 1.571
56 HB3 ALA 11 2HB ALA 11 8.930 -7.086 0.718
57 H GLY 12 H GLY 12 6.849 -7.405 1.208
58 HA2 GLY 12 1HA GLY 12 6.288 -10.147 2.137
59 HA3 GLY 12 2HA GLY 12 4.984 -8.981 1.967
60 HA PRO 13 HA PRO 13 6.021 -11.314 -2.078
61 HB2 PRO 13 1HB PRO 13 4.080 -13.211 -2.002
62 HB3 PRO 13 2HB PRO 13 5.702 -13.469 -1.348
63 HG2 PRO 13 1HG PRO 13 3.174 -12.749 0.085
64 HG3 PRO 13 2HG PRO 13 4.426 -13.919 0.543
65 HD2 PRO 13 1HD PRO 13 4.278 -11.443 1.629
66 HD3 PRO 13 2HD PRO 13 5.820 -12.287 1.384
67 H CYS 14 H CYS 14 5.219 -10.022 -3.606
68 HA CYS 14 HA CYS 14 2.761 -8.653 -3.422
69 HB2 CYS 14 1HB CYS 14 4.567 -7.762 -4.764
70 HB3 CYS 14 2HB CYS 14 4.550 -9.185 -5.800
71 H GLY 15 H GLY 15 1.131 -10.179 -3.031
72 HA2 GLY 15 1HA GLY 15 0.649 -12.447 -4.643
73 HA3 GLY 15 2HA GLY 15 -0.521 -11.675 -3.584
74 H PHE 16 H PHE 16 -0.475 -9.114 -4.870
75 HA PHE 16 HA PHE 16 -2.550 -9.249 -6.605
76 HB2 PHE 16 1HB PHE 16 -0.316 -7.289 -7.092
77 HB3 PHE 16 2HB PHE 16 -2.048 -7.048 -7.296
78 HD1 PHE 16 1HD PHE 16 -3.181 -7.943 -4.804
79 HD2 PHE 16 2HD PHE 16 0.424 -5.794 -5.510
80 HE1 PHE 16 1HE PHE 16 -3.314 -6.983 -2.542
81 HE2 PHE 16 2HE PHE 16 0.298 -4.831 -3.250
82 HZ PHE 16 HZ PHE 16 -1.573 -5.426 -1.762
83 H CYS 17 H CYS 17 0.874 -9.544 -7.445
84 HA CYS 17 HA CYS 17 0.669 -9.593 -10.212
85 HB2 CYS 17 1HB CYS 17 2.600 -10.681 -8.228
86 HB3 CYS 17 2HB CYS 17 2.701 -11.304 -9.871
87 HA PRO 18 HA PRO 18 -1.316 -13.345 -11.323
88 HB2 PRO 18 1HB PRO 18 0.038 -14.033 -13.573
89 HB3 PRO 18 2HB PRO 18 -1.099 -12.681 -13.511
90 HG2 PRO 18 1HG PRO 18 1.890 -12.652 -13.343
91 HG3 PRO 18 2HG PRO 18 0.809 -11.573 -14.245
92 HD2 PRO 18 1HD PRO 18 1.911 -10.879 -11.871
93 HD3 PRO 18 2HD PRO 18 0.309 -10.311 -12.382
94 H ALA 19 H ALA 19 -1.190 -15.393 -10.642
95 HA ALA 19 HA ALA 19 0.670 -16.565 -9.157
96 HB1 ALA 19 3HB ALA 19 -0.362 -18.568 -9.506
97 HB2 ALA 19 1HB ALA 19 -1.571 -17.494 -10.212
98 HB3 ALA 19 2HB ALA 19 -0.436 -18.353 -11.255
99 H GLY 20 H GLY 20 2.678 -17.397 -9.290
100 HA2 GLY 20 1HA GLY 20 4.502 -18.449 -10.365
101 HA3 GLY 20 2HA GLY 20 3.815 -17.998 -11.919
102 H GLU 21 H GLU 21 3.390 -15.231 -11.275
103 HA GLU 21 HA GLU 21 6.160 -14.322 -11.520
104 HB2 GLU 21 1HB GLU 21 3.517 -13.274 -12.407
105 HB3 GLU 21 2HB GLU 21 4.792 -12.109 -12.081
106 HG2 GLU 21 1HG GLU 21 4.846 -14.362 -14.070
107 HG3 GLU 21 2HG GLU 21 4.818 -12.631 -14.406
108 H VAL 22 H VAL 22 5.299 -15.059 -8.944
109 HA VAL 22 HA VAL 22 4.489 -12.766 -7.442
110 HB VAL 22 HB VAL 22 5.727 -15.365 -6.527
111 HG11 VAL 22 1HG1 VAL 22 6.106 -14.175 -4.649
112 HG12 VAL 22 2HG1 VAL 22 4.938 -12.923 -5.078
113 HG13 VAL 22 3HG1 VAL 22 4.385 -14.446 -4.379
114 HG21 VAL 22 3HG2 VAL 22 3.173 -14.803 -7.536
115 HG22 VAL 22 1HG2 VAL 22 3.706 -16.270 -6.713
116 HG23 VAL 22 2HG2 VAL 22 2.980 -14.955 -5.789
117 H GLN 23 H GLN 23 5.717 -11.078 -6.968
118 HA GLN 23 HA GLN 23 8.630 -11.468 -6.763
119 HB2 GLN 23 1HB GLN 23 7.033 -9.081 -7.682
120 HB3 GLN 23 2HB GLN 23 8.746 -8.993 -7.296
121 HG2 GLN 23 1HG GLN 23 7.784 -11.018 -9.260
122 HG3 GLN 23 2HG GLN 23 7.962 -9.334 -9.752
123 HE21 GLN 23 1HE2 GLN 23 9.633 -9.762 -11.163
124 HE22 GLN 23 2HE2 GLN 23 11.218 -10.195 -10.629
125 HA PRO 24 HA PRO 24 8.550 -10.128 -2.585
126 HB2 PRO 24 1HB PRO 24 10.933 -8.840 -2.399
127 HB3 PRO 24 2HB PRO 24 10.798 -10.599 -2.517
128 HG2 PRO 24 1HG PRO 24 11.415 -8.599 -4.657
129 HG3 PRO 24 2HG PRO 24 12.169 -10.174 -4.347
130 HD2 PRO 24 1HD PRO 24 10.304 -9.807 -6.275
131 HD3 PRO 24 2HD PRO 24 10.469 -11.334 -5.385
132 H ALA 25 H ALA 25 6.935 -8.627 -2.343
133 HA ALA 25 HA ALA 25 6.864 -6.056 -3.435
134 HB1 ALA 25 3HB ALA 25 5.031 -5.642 -2.049
135 HB2 ALA 25 1HB ALA 25 4.995 -7.388 -2.298
136 HB3 ALA 25 2HB ALA 25 5.622 -6.724 -0.788
137 H ARG 26 H ARG 26 8.976 -5.187 -3.178
138 HA ARG 26 HA ARG 26 10.369 -4.863 -0.807
139 HB2 ARG 26 1HB ARG 26 10.329 -3.478 -3.429
140 HB3 ARG 26 2HB ARG 26 11.086 -2.614 -2.096
141 HG2 ARG 26 1HG ARG 26 11.864 -5.443 -2.506
142 HG3 ARG 26 2HG ARG 26 12.436 -4.254 -3.678
143 HD2 ARG 26 1HD ARG 26 12.709 -3.604 -0.793
144 HD3 ARG 26 2HD ARG 26 13.787 -4.827 -1.464
145 HE ARG 26 HE ARG 26 13.823 -1.993 -1.996
146 HH11 ARG 26 2HH1 ARG 26 14.775 -5.154 -3.103
147 HH12 ARG 26 1HH1 ARG 26 16.081 -4.563 -4.076
148 HH21 ARG 26 2HH2 ARG 26 15.540 -1.203 -3.274
149 HH22 ARG 26 1HH2 ARG 26 16.515 -2.315 -4.172
150 H TYR 27 H TYR 27 7.651 -3.063 -2.064
151 HA TYR 27 HA TYR 27 7.704 -1.378 0.354
152 HB2 TYR 27 1HB TYR 27 6.185 -0.513 -2.062
153 HB3 TYR 27 2HB TYR 27 6.990 0.459 -0.835
154 HD1 TYR 27 1HD TYR 27 9.583 0.398 -0.835
155 HD2 TYR 27 2HD TYR 27 7.192 -0.825 -4.135
156 HE1 TYR 27 1HE TYR 27 11.508 0.705 -2.336
157 HE2 TYR 27 2HE TYR 27 9.110 -0.523 -5.644
158 HH TYR 27 HH TYR 27 12.283 -0.105 -4.525
159 H THR 28 H THR 28 5.256 -0.346 0.428
160 HA THR 28 HA THR 28 3.189 -2.270 -0.070
161 HB THR 28 HB THR 28 3.529 -1.694 2.843
162 HG1 THR 28 1HG THR 28 4.905 -3.705 1.368
163 HG21 THR 28 3HG2 THR 28 1.515 -2.827 1.656
164 HG22 THR 28 1HG2 THR 28 2.142 -3.534 3.144
165 HG23 THR 28 2HG2 THR 28 2.570 -4.238 1.585
166 H CYS 29 H CYS 29 1.138 -1.403 0.133
167 HA CYS 29 HA CYS 29 0.880 1.377 -0.069
168 HB2 CYS 29 1HB CYS 29 -0.725 -0.607 -0.756
169 HB3 CYS 29 2HB CYS 29 -1.442 -0.282 0.818
170 HA PRO 30 HA PRO 30 1.201 2.335 4.288
171 HB2 PRO 30 1HB PRO 30 1.059 5.026 3.962
172 HB3 PRO 30 2HB PRO 30 2.532 4.098 3.655
173 HG2 PRO 30 1HG PRO 30 0.492 5.110 1.713
174 HG3 PRO 30 2HG PRO 30 2.260 5.123 1.586
175 HD2 PRO 30 1HD PRO 30 0.723 3.282 0.329
176 HD3 PRO 30 2HD PRO 30 2.355 2.917 0.926
177 H ARG 31 H ARG 31 -1.426 2.290 2.363
178 HA ARG 31 HA ARG 31 -3.142 3.612 4.360
179 HB2 ARG 31 1HB ARG 31 -3.437 3.301 1.384
180 HB3 ARG 31 2HB ARG 31 -4.832 3.616 2.408
181 HG2 ARG 31 1HG ARG 31 -4.300 5.748 1.851
182 HG3 ARG 31 2HG ARG 31 -3.284 5.576 3.284
183 HD2 ARG 31 1HD ARG 31 -1.562 4.666 1.481
184 HD3 ARG 31 2HD ARG 31 -2.532 5.679 0.413
185 HE ARG 31 HE ARG 31 -1.779 7.085 2.764
186 HH11 ARG 31 2HH1 ARG 31 -0.576 5.968 -0.306
187 HH12 ARG 31 1HH1 ARG 31 0.624 7.210 -0.435
188 HH21 ARG 31 2HH2 ARG 31 -0.203 8.726 2.605
189 HH22 ARG 31 1HH2 ARG 31 0.836 8.778 1.222
190 H CYS 32 H CYS 32 -2.817 0.820 2.213
191 HA CYS 32 HA CYS 32 -4.681 -0.640 3.966
192 HB2 CYS 32 1HB CYS 32 -5.638 -1.772 2.118
193 HB3 CYS 32 2HB CYS 32 -5.590 -0.074 1.656
194 H ASN 33 H ASN 33 -1.711 -0.395 3.918
195 HA ASN 33 HA ASN 33 0.188 -1.709 3.788
196 HB2 ASN 33 1HB ASN 33 -1.722 -3.541 5.256
197 HB3 ASN 33 2HB ASN 33 0.036 -3.598 5.339
198 HD21 ASN 33 1HD2 ASN 33 -2.830 -1.973 6.362
199 HD22 ASN 33 2HD2 ASN 33 -2.083 -0.941 7.530
200 H ALA 34 H ALA 34 -0.712 -1.895 1.338
201 HA ALA 34 HA ALA 34 -1.051 -4.734 0.683
202 HB1 ALA 34 3HB ALA 34 -2.632 -3.801 -0.612
203 HB2 ALA 34 1HB ALA 34 -1.865 -2.213 -0.583
204 HB3 ALA 34 2HB ALA 34 -1.284 -3.454 -1.695
205 HA PRO 35 HA PRO 35 3.340 -4.640 -0.256
206 HB2 PRO 35 1HB PRO 35 3.542 -7.312 -0.692
207 HB3 PRO 35 2HB PRO 35 3.502 -6.603 0.927
208 HG2 PRO 35 1HG PRO 35 1.291 -7.880 -0.636
209 HG3 PRO 35 2HG PRO 35 1.699 -8.064 1.080
210 HD2 PRO 35 1HD PRO 35 -0.303 -6.456 0.222
211 HD3 PRO 35 2HD PRO 35 0.662 -6.091 1.667
212 H TYR 36 H TYR 36 3.564 -3.661 -2.214
213 HA TYR 36 HA TYR 36 2.784 -5.205 -4.599
214 HB2 TYR 36 1HB TYR 36 2.852 -2.987 -5.783
215 HB3 TYR 36 2HB TYR 36 1.591 -3.129 -4.564
216 HD1 TYR 36 2HD TYR 36 4.847 -1.596 -5.349
217 HD2 TYR 36 1HD TYR 36 1.594 -1.742 -2.612
218 HE1 TYR 36 2HE TYR 36 5.675 0.451 -4.265
219 HE2 TYR 36 1HE TYR 36 2.411 0.305 -1.521
220 HH TYR 36 HH TYR 36 4.074 2.405 -2.562
221 H CYS 37 H CYS 37 4.297 -5.745 -6.068
222 HA CYS 37 HA CYS 37 7.022 -5.688 -5.381
223 HB2 CYS 37 1HB CYS 37 7.416 -6.578 -7.639
224 HB3 CYS 37 2HB CYS 37 6.077 -7.402 -6.848
225 H SER 38 H SER 38 5.069 -3.619 -7.449
226 HA SER 38 HA SER 38 7.115 -1.573 -7.351
227 HB2 SER 38 1HB SER 38 7.409 -3.200 -9.433
228 HB3 SER 38 2HB SER 38 6.135 -2.182 -10.105
229 HG SER 38 HG SER 38 7.915 -0.582 -8.987
230 H LEU 39 H LEU 39 6.284 0.368 -8.800
231 HA LEU 39 HA LEU 39 3.942 1.318 -7.639
232 HB2 LEU 39 1HB LEU 39 5.904 2.454 -9.039
233 HB3 LEU 39 2HB LEU 39 4.694 2.352 -10.315
234 HG LEU 39 HG LEU 39 4.819 4.538 -9.053
235 HD11 LEU 39 1HD1 LEU 39 2.916 4.123 -10.394
236 HD12 LEU 39 2HD1 LEU 39 2.313 4.685 -8.835
237 HD13 LEU 39 3HD1 LEU 39 2.260 2.968 -9.233
238 HD21 LEU 39 3HD2 LEU 39 4.127 4.724 -6.867
239 HD22 LEU 39 1HD2 LEU 39 4.998 3.191 -6.822
240 HD23 LEU 39 2HD2 LEU 39 3.236 3.202 -6.905
241 H ARG 40 H ARG 40 4.452 -0.294 -10.737
242 HA ARG 40 HA ARG 40 2.051 0.090 -11.992
243 HB2 ARG 40 1HB ARG 40 2.397 -2.073 -13.086
244 HB3 ARG 40 2HB ARG 40 3.901 -1.167 -12.984
245 HG2 ARG 40 1HG ARG 40 4.311 -2.540 -10.836
246 HG3 ARG 40 2HG ARG 40 3.065 -3.610 -11.482
247 HD2 ARG 40 1HD ARG 40 4.465 -3.554 -13.649
248 HD3 ARG 40 2HD ARG 40 5.757 -2.942 -12.617
249 HE ARG 40 HE ARG 40 5.984 -5.037 -11.706
250 HH11 ARG 40 2HH1 ARG 40 3.020 -4.876 -13.525
251 HH12 ARG 40 1HH1 ARG 40 2.714 -6.578 -13.426
252 HH21 ARG 40 2HH2 ARG 40 5.592 -7.279 -11.567
253 HH22 ARG 40 1HH2 ARG 40 4.177 -7.944 -12.311
254 H CYS 41 H CYS 41 2.781 -2.537 -9.694
255 HA CYS 41 HA CYS 41 0.105 -3.489 -9.605
256 HB2 CYS 41 1HB CYS 41 2.589 -3.988 -8.010
257 HB3 CYS 41 2HB CYS 41 1.043 -4.569 -7.399
258 H TYR 42 H TYR 42 1.950 -1.194 -7.694
259 HA TYR 42 HA TYR 42 0.330 -0.929 -5.469
260 HB2 TYR 42 1HB TYR 42 2.334 0.259 -5.366
261 HB3 TYR 42 2HB TYR 42 2.099 0.990 -6.949
262 HD1 TYR 42 1HD TYR 42 0.729 1.004 -3.486
263 HD2 TYR 42 2HD TYR 42 1.253 3.155 -7.119
264 HE1 TYR 42 1HE TYR 42 -0.169 3.026 -2.411
265 HE2 TYR 42 2HE TYR 42 0.357 5.183 -6.054
266 HH TYR 42 HH TYR 42 -0.679 5.169 -2.655
267 H ARG 43 H ARG 43 -0.214 0.123 -8.729
268 HA ARG 43 HA ARG 43 -2.474 1.797 -7.955
269 HB2 ARG 43 1HB ARG 43 -0.952 1.339 -10.487
270 HB3 ARG 43 2HB ARG 43 -2.592 1.966 -10.581
271 HG2 ARG 43 1HG ARG 43 -2.030 3.927 -9.431
272 HG3 ARG 43 2HG ARG 43 -0.510 3.247 -8.846
273 HD2 ARG 43 1HD ARG 43 0.300 3.175 -11.188
274 HD3 ARG 43 2HD ARG 43 -1.188 3.974 -11.693
275 HE ARG 43 HE ARG 43 1.034 5.169 -10.236
276 HH11 ARG 43 2HH1 ARG 43 -2.191 5.480 -11.512
277 HH12 ARG 43 1HH1 ARG 43 -2.190 7.211 -11.447
278 HH21 ARG 43 2HH2 ARG 43 1.047 7.448 -10.147
279 HH22 ARG 43 1HH2 ARG 43 -0.347 8.330 -10.672
280 H THR 44 H THR 44 -1.771 -1.304 -9.396
281 HA THR 44 HA THR 44 -4.414 -1.805 -10.358
282 HB THR 44 HB THR 44 -2.149 -3.725 -9.785
283 HG1 THR 44 1HG THR 44 -2.505 -1.945 -11.718
284 HG21 THR 44 3HG2 THR 44 -4.786 -4.127 -11.193
285 HG22 THR 44 1HG2 THR 44 -4.196 -4.968 -9.760
286 HG23 THR 44 2HG2 THR 44 -3.425 -5.240 -11.323
287 H HIS 45 H HIS 45 -2.571 -3.103 -7.591
288 HA HIS 45 HA HIS 45 -4.331 -4.738 -6.392
289 HB2 HIS 45 1HB HIS 45 -3.178 -4.435 -4.417
290 HB3 HIS 45 2HB HIS 45 -2.031 -3.753 -5.566
291 HD1 HIS 45 1HD HIS 45 -1.521 -1.270 -5.386
292 HD2 HIS 45 2HD HIS 45 -4.528 -2.519 -2.805
293 HE1 HIS 45 1HE HIS 45 -1.916 0.664 -3.828
294 H GLY 46 H GLY 46 -4.331 -1.207 -5.857
295 HA2 GLY 46 1HA GLY 46 -7.229 -1.240 -5.660
296 HA3 GLY 46 2HA GLY 46 -6.383 -0.813 -4.180
297 H THR 47 H THR 47 -7.759 1.167 -4.605
298 HA THR 47 HA THR 47 -6.284 3.036 -6.345
299 HB THR 47 HB THR 47 -8.389 4.363 -6.478
300 HG1 THR 47 1HG THR 47 -9.168 2.636 -4.598
301 HG21 THR 47 3HG2 THR 47 -8.236 3.206 -8.423
302 HG22 THR 47 1HG2 THR 47 -9.640 2.363 -7.771
303 HG23 THR 47 2HG2 THR 47 -8.034 1.654 -7.610
304 H CYS 48 H CYS 48 -5.342 2.604 -3.808
305 HA CYS 48 HA CYS 48 -6.418 4.635 -2.040
306 HB2 CYS 48 1HB CYS 48 -3.857 3.162 -1.527
307 HB3 CYS 48 2HB CYS 48 -5.059 3.735 -0.376
308 H ALA 49 H ALA 49 -5.401 5.581 -4.533
309 HA ALA 49 HA ALA 49 -3.100 7.169 -3.595
310 HB1 ALA 49 3HB ALA 49 -2.033 6.966 -5.584
311 HB2 ALA 49 1HB ALA 49 -2.944 5.457 -5.638
312 HB3 ALA 49 2HB ALA 49 -3.532 6.874 -6.507
313 H GLU 50 H GLU 50 -6.150 7.145 -5.333
314 HA GLU 50 HA GLU 50 -6.253 9.699 -6.350
315 HB2 GLU 50 1HB GLU 50 -8.002 7.729 -6.348
316 HB3 GLU 50 2HB GLU 50 -8.671 8.600 -4.975
317 HG2 GLU 50 1HG GLU 50 -9.194 10.472 -6.264
318 HG3 GLU 50 2HG GLU 50 -8.128 9.977 -7.578
319 H ASN 51 H ASN 51 -6.649 8.646 -3.029
320 HA ASN 51 HA ASN 51 -6.649 11.467 -2.203
321 HB2 ASN 51 1HB ASN 51 -8.370 9.263 -1.046
322 HB3 ASN 51 2HB ASN 51 -8.195 10.869 -0.343
323 HD21 ASN 51 1HD2 ASN 51 -10.274 9.097 -1.963
324 HD22 ASN 51 2HD2 ASN 51 -11.036 10.287 -2.956
325 H PHE 52 H PHE 52 -4.319 10.913 -2.049
326 HA PHE 52 HA PHE 52 -3.745 9.703 0.572
327 HB2 PHE 52 1HB PHE 52 -2.027 8.415 -0.233
328 HB3 PHE 52 2HB PHE 52 -3.066 8.418 -1.654
329 HD1 PHE 52 2HD PHE 52 -0.318 10.437 -0.140
330 HD2 PHE 52 1HD PHE 52 -2.115 8.907 -3.682
331 HE1 PHE 52 2HE PHE 52 1.519 11.381 -1.475
332 HE2 PHE 52 1HE PHE 52 -0.280 9.849 -5.024
333 HZ PHE 52 HZ PHE 52 1.540 11.089 -3.921
334 H TYR 53 H TYR 53 -2.767 11.993 -1.923
335 HA TYR 53 HA TYR 53 -0.828 13.245 -0.160
336 HB2 TYR 53 1HB TYR 53 -0.263 14.639 -2.048
337 HB3 TYR 53 2HB TYR 53 -0.385 12.971 -2.599
338 HD1 TYR 53 1HD TYR 53 -2.451 12.248 -3.840
339 HD2 TYR 53 2HD TYR 53 -1.628 16.331 -2.974
340 HE1 TYR 53 1HE TYR 53 -4.055 12.933 -5.574
341 HE2 TYR 53 2HE TYR 53 -3.231 17.028 -4.704
342 HH TYR 53 HH TYR 53 -5.508 15.509 -5.821
343 H SER 54 H SER 54 -0.890 15.723 -0.102
344 HA SER 54 HA SER 54 -3.656 16.631 0.351
345 HB2 SER 54 1HB SER 54 -1.212 17.183 2.048
346 HB3 SER 54 2HB SER 54 -2.763 17.997 2.250
347 HG SER 54 HG SER 54 -3.687 15.923 2.635
348 H GLY 55 H GLY 55 -3.727 17.656 -1.670
349 HA2 GLY 55 1HA GLY 55 -1.794 19.361 -2.736
350 HA3 GLY 55 2HA GLY 55 -3.513 19.441 -3.095
351 HA PRO 56 HA PRO 56 -2.282 23.395 -1.014
352 HB2 PRO 56 1HB PRO 56 -3.591 24.999 -2.770
353 HB3 PRO 56 2HB PRO 56 -1.937 24.434 -3.034
354 HG2 PRO 56 1HG PRO 56 -4.502 23.380 -4.162
355 HG3 PRO 56 2HG PRO 56 -2.949 23.649 -4.975
356 HD2 PRO 56 1HD PRO 56 -3.755 21.200 -4.146
357 HD3 PRO 56 2HD PRO 56 -2.047 21.685 -4.174
358 H SER 57 H SER 57 -3.606 22.938 0.763
359 HA SER 57 HA SER 57 -6.482 23.439 0.428
360 HB2 SER 57 1HB SER 57 -5.929 21.299 1.477
361 HB3 SER 57 2HB SER 57 -4.981 22.131 2.711
362 HG SER 57 HG SER 57 -7.758 22.522 2.271
363 H SER 58 H SER 58 -3.921 24.085 2.828
364 HA SER 58 HA SER 58 -5.384 26.326 3.900
365 HB2 SER 58 1HB SER 58 -2.777 24.989 4.542
366 HB3 SER 58 2HB SER 58 -3.122 26.589 5.198
367 HG SER 58 HG SER 58 -4.762 24.290 5.498
368 H GLY 59 H GLY 59 -5.532 27.712 2.085
369 HA2 GLY 59 1HA GLY 59 -3.788 29.807 1.938
370 HA3 GLY 59 2HA GLY 59 -3.168 28.663 0.757
Start of MODEL 18
1 H1 GLY 1 1H GLY 1 23.674 -1.933 18.022
2 HA2 GLY 1 1HA GLY 1 25.622 -3.338 17.004
3 HA3 GLY 1 2HA GLY 1 25.829 -3.813 18.684
4 H SER 2 H SER 2 23.403 -3.702 16.091
5 HA SER 2 HA SER 2 21.469 -4.939 15.830
6 HB2 SER 2 1HB SER 2 21.975 -7.231 15.296
7 HB3 SER 2 2HB SER 2 23.355 -6.250 14.804
8 HG SER 2 HG SER 2 24.000 -6.861 17.167
9 H SER 3 H SER 3 21.537 -4.049 18.439
10 HA SER 3 HA SER 3 20.061 -6.170 19.764
11 HB2 SER 3 1HB SER 3 22.521 -6.319 20.467
12 HB3 SER 3 2HB SER 3 22.262 -4.783 21.293
13 HG SER 3 HG SER 3 21.127 -7.303 21.824
14 H GLY 4 H GLY 4 18.211 -5.274 20.367
15 HA2 GLY 4 1HA GLY 4 17.616 -3.430 22.158
16 HA3 GLY 4 2HA GLY 4 18.093 -2.389 20.824
17 H SER 5 H SER 5 16.264 -1.502 20.098
18 HA SER 5 HA SER 5 13.718 -2.656 20.209
19 HB2 SER 5 1HB SER 5 14.775 -0.489 18.378
20 HB3 SER 5 2HB SER 5 13.068 -0.881 18.584
21 HG SER 5 HG SER 5 13.225 0.559 20.122
22 H SER 6 H SER 6 15.841 -2.248 17.371
23 HA SER 6 HA SER 6 15.986 -3.379 15.403
24 HB2 SER 6 1HB SER 6 16.263 -5.264 17.202
25 HB3 SER 6 2HB SER 6 14.664 -5.765 16.651
26 HG SER 6 HG SER 6 15.707 -5.609 14.459
27 H GLY 7 H GLY 7 13.770 -1.743 15.654
28 HA2 GLY 7 1HA GLY 7 11.349 -3.087 14.951
29 HA3 GLY 7 2HA GLY 7 11.648 -1.359 14.843
30 H MET 8 H MET 8 12.640 -4.379 13.227
31 HA MET 8 HA MET 8 12.156 -3.045 10.655
32 HB2 MET 8 1HB MET 8 14.655 -4.355 11.608
33 HB3 MET 8 2HB MET 8 14.202 -4.587 9.925
34 HG2 MET 8 1HG MET 8 14.516 -2.387 9.388
35 HG3 MET 8 2HG MET 8 14.208 -1.829 11.031
36 HE1 MET 8 3HE MET 8 16.975 -0.290 11.421
37 HE2 MET 8 1HE MET 8 15.564 -0.928 12.266
38 HE3 MET 8 2HE MET 8 17.183 -1.442 12.741
39 H GLU 9 H GLU 9 11.324 -4.332 9.041
40 HA GLU 9 HA GLU 9 10.870 -7.163 9.684
41 HB2 GLU 9 1HB GLU 9 8.851 -5.077 8.958
42 HB3 GLU 9 2HB GLU 9 8.586 -6.742 8.462
43 HG2 GLU 9 1HG GLU 9 9.075 -5.879 11.301
44 HG3 GLU 9 2HG GLU 9 7.480 -6.121 10.592
45 HA PRO 10 HA PRO 10 12.334 -7.886 5.598
46 HB2 PRO 10 1HB PRO 10 11.248 -10.338 5.177
47 HB3 PRO 10 2HB PRO 10 12.626 -10.070 6.251
48 HG2 PRO 10 1HG PRO 10 9.728 -10.391 6.931
49 HG3 PRO 10 2HG PRO 10 11.150 -11.086 7.732
50 HD2 PRO 10 1HD PRO 10 9.852 -8.913 8.694
51 HD3 PRO 10 2HD PRO 10 11.601 -9.146 8.891
52 H ALA 11 H ALA 11 11.635 -8.085 3.416
53 HA ALA 11 HA ALA 11 9.191 -6.768 2.846
54 HB1 ALA 11 3HB ALA 11 10.760 -6.337 1.235
55 HB2 ALA 11 1HB ALA 11 11.363 -7.994 1.221
56 HB3 ALA 11 2HB ALA 11 9.831 -7.607 0.437
57 H GLY 12 H GLY 12 7.723 -7.756 1.039
58 HA2 GLY 12 1HA GLY 12 7.097 -10.551 1.756
59 HA3 GLY 12 2HA GLY 12 5.840 -9.324 1.688
60 HA PRO 13 HA PRO 13 6.871 -11.348 -2.555
61 HB2 PRO 13 1HB PRO 13 5.150 -13.448 -2.553
62 HB3 PRO 13 2HB PRO 13 6.824 -13.577 -1.999
63 HG2 PRO 13 1HG PRO 13 4.317 -13.259 -0.394
64 HG3 PRO 13 2HG PRO 13 5.710 -14.316 -0.097
65 HD2 PRO 13 1HD PRO 13 5.359 -11.967 1.204
66 HD3 PRO 13 2HD PRO 13 6.967 -12.613 0.816
67 H CYS 14 H CYS 14 5.863 -9.931 -3.844
68 HA CYS 14 HA CYS 14 3.305 -8.875 -3.459
69 HB2 CYS 14 1HB CYS 14 4.925 -7.733 -4.846
70 HB3 CYS 14 2HB CYS 14 4.967 -9.083 -5.976
71 H GLY 15 H GLY 15 1.524 -10.098 -3.362
72 HA2 GLY 15 1HA GLY 15 1.228 -12.478 -4.968
73 HA3 GLY 15 2HA GLY 15 0.055 -11.832 -3.830
74 H PHE 16 H PHE 16 -0.197 -9.240 -4.914
75 HA PHE 16 HA PHE 16 -2.284 -9.411 -6.607
76 HB2 PHE 16 1HB PHE 16 -0.161 -7.281 -6.904
77 HB3 PHE 16 2HB PHE 16 -1.873 -7.138 -7.288
78 HD1 PHE 16 1HD PHE 16 -3.188 -8.251 -4.966
79 HD2 PHE 16 2HD PHE 16 0.285 -5.802 -5.197
80 HE1 PHE 16 1HE PHE 16 -3.629 -7.417 -2.693
81 HE2 PHE 16 2HE PHE 16 -0.149 -4.966 -2.924
82 HZ PHE 16 HZ PHE 16 -2.107 -5.774 -1.669
83 H CYS 17 H CYS 17 1.095 -9.691 -7.488
84 HA CYS 17 HA CYS 17 0.868 -9.465 -10.267
85 HB2 CYS 17 1HB CYS 17 2.827 -10.683 -8.392
86 HB3 CYS 17 2HB CYS 17 2.914 -11.183 -10.077
87 HA PRO 18 HA PRO 18 -1.087 -13.140 -11.653
88 HB2 PRO 18 1HB PRO 18 0.284 -13.672 -13.935
89 HB3 PRO 18 2HB PRO 18 -0.856 -12.329 -13.790
90 HG2 PRO 18 1HG PRO 18 2.131 -12.307 -13.600
91 HG3 PRO 18 2HG PRO 18 1.055 -11.171 -14.434
92 HD2 PRO 18 1HD PRO 18 2.140 -10.639 -12.011
93 HD3 PRO 18 2HD PRO 18 0.541 -10.039 -12.493
94 H ALA 19 H ALA 19 -0.955 -15.198 -11.023
95 HA ALA 19 HA ALA 19 0.973 -16.439 -9.663
96 HB1 ALA 19 3HB ALA 19 0.103 -18.589 -10.404
97 HB2 ALA 19 1HB ALA 19 -1.210 -17.443 -10.131
98 HB3 ALA 19 2HB ALA 19 -0.688 -17.810 -11.775
99 H GLY 20 H GLY 20 3.064 -16.811 -9.966
100 HA2 GLY 20 1HA GLY 20 4.724 -18.089 -11.230
101 HA3 GLY 20 2HA GLY 20 3.982 -17.467 -12.696
102 H GLU 21 H GLU 21 3.733 -14.786 -12.082
103 HA GLU 21 HA GLU 21 6.526 -13.966 -12.225
104 HB2 GLU 21 1HB GLU 21 3.953 -12.484 -12.778
105 HB3 GLU 21 2HB GLU 21 5.548 -11.754 -12.896
106 HG2 GLU 21 1HG GLU 21 4.504 -14.053 -14.532
107 HG3 GLU 21 2HG GLU 21 4.763 -12.398 -15.081
108 H VAL 22 H VAL 22 5.905 -14.776 -9.700
109 HA VAL 22 HA VAL 22 4.990 -12.693 -8.002
110 HB VAL 22 HB VAL 22 6.670 -15.123 -7.370
111 HG11 VAL 22 1HG1 VAL 22 5.813 -14.698 -5.023
112 HG12 VAL 22 2HG1 VAL 22 7.058 -13.595 -5.612
113 HG13 VAL 22 3HG1 VAL 22 5.369 -13.086 -5.581
114 HG21 VAL 22 3HG2 VAL 22 3.811 -14.667 -7.777
115 HG22 VAL 22 1HG2 VAL 22 4.736 -16.169 -7.798
116 HG23 VAL 22 2HG2 VAL 22 4.192 -15.490 -6.264
117 H GLN 23 H GLN 23 6.002 -10.880 -7.478
118 HA GLN 23 HA GLN 23 8.943 -10.819 -7.618
119 HB2 GLN 23 1HB GLN 23 6.881 -8.708 -8.203
120 HB3 GLN 23 2HB GLN 23 8.554 -8.287 -7.860
121 HG2 GLN 23 1HG GLN 23 9.259 -9.721 -9.744
122 HG3 GLN 23 2HG GLN 23 7.561 -10.014 -10.115
123 HE21 GLN 23 1HE2 GLN 23 8.599 -9.089 -12.182
124 HE22 GLN 23 2HE2 GLN 23 8.419 -7.385 -12.400
125 HA PRO 24 HA PRO 24 9.189 -9.812 -3.355
126 HB2 PRO 24 1HB PRO 24 11.309 -8.117 -3.318
127 HB3 PRO 24 2HB PRO 24 11.474 -9.855 -3.592
128 HG2 PRO 24 1HG PRO 24 11.441 -7.619 -5.582
129 HG3 PRO 24 2HG PRO 24 12.495 -9.043 -5.517
130 HD2 PRO 24 1HD PRO 24 10.358 -8.887 -7.173
131 HD3 PRO 24 2HD PRO 24 10.906 -10.419 -6.462
132 H ALA 25 H ALA 25 7.434 -8.656 -2.695
133 HA ALA 25 HA ALA 25 6.939 -5.961 -3.512
134 HB1 ALA 25 3HB ALA 25 5.395 -7.945 -2.457
135 HB2 ALA 25 1HB ALA 25 5.590 -6.864 -1.077
136 HB3 ALA 25 2HB ALA 25 4.918 -6.252 -2.590
137 H ARG 26 H ARG 26 9.122 -5.172 -2.894
138 HA ARG 26 HA ARG 26 9.935 -4.991 -0.198
139 HB2 ARG 26 1HB ARG 26 10.687 -3.571 -2.724
140 HB3 ARG 26 2HB ARG 26 11.277 -2.963 -1.183
141 HG2 ARG 26 1HG ARG 26 12.026 -5.438 -0.823
142 HG3 ARG 26 2HG ARG 26 11.911 -5.514 -2.583
143 HD2 ARG 26 1HD ARG 26 13.483 -3.715 -2.818
144 HD3 ARG 26 2HD ARG 26 13.492 -3.437 -1.077
145 HE ARG 26 HE ARG 26 14.277 -6.075 -1.530
146 HH11 ARG 26 2HH1 ARG 26 15.427 -2.846 -2.139
147 HH12 ARG 26 1HH1 ARG 26 17.100 -3.294 -2.098
148 HH21 ARG 26 2HH2 ARG 26 16.476 -6.677 -1.473
149 HH22 ARG 26 1HH2 ARG 26 17.695 -5.474 -1.720
150 H TYR 27 H TYR 27 7.647 -3.215 -2.064
151 HA TYR 27 HA TYR 27 7.466 -1.160 0.035
152 HB2 TYR 27 1HB TYR 27 6.100 -0.962 -2.633
153 HB3 TYR 27 2HB TYR 27 6.582 0.330 -1.539
154 HD1 TYR 27 1HD TYR 27 9.196 0.501 -1.135
155 HD2 TYR 27 2HD TYR 27 7.381 -1.332 -4.519
156 HE1 TYR 27 1HE TYR 27 11.275 0.812 -2.412
157 HE2 TYR 27 2HE TYR 27 9.455 -1.026 -5.805
158 HH TYR 27 HH TYR 27 11.443 0.454 -5.764
159 H THR 28 H THR 28 5.226 -0.367 0.480
160 HA THR 28 HA THR 28 3.105 -2.314 0.058
161 HB THR 28 HB THR 28 3.478 -1.451 2.889
162 HG1 THR 28 1HG THR 28 5.526 -2.326 2.219
163 HG21 THR 28 3HG2 THR 28 2.550 -4.074 1.725
164 HG22 THR 28 1HG2 THR 28 1.475 -2.712 2.033
165 HG23 THR 28 2HG2 THR 28 2.323 -3.484 3.372
166 H CYS 29 H CYS 29 1.046 -1.460 0.242
167 HA CYS 29 HA CYS 29 0.765 1.309 -0.180
168 HB2 CYS 29 1HB CYS 29 -0.802 -0.731 -0.774
169 HB3 CYS 29 2HB CYS 29 -1.544 -0.335 0.773
170 HA PRO 30 HA PRO 30 1.005 2.541 4.111
171 HB2 PRO 30 1HB PRO 30 0.804 5.203 3.619
172 HB3 PRO 30 2HB PRO 30 2.301 4.294 3.384
173 HG2 PRO 30 1HG PRO 30 0.260 5.137 1.363
174 HG3 PRO 30 2HG PRO 30 2.029 5.184 1.253
175 HD2 PRO 30 1HD PRO 30 0.549 3.233 0.097
176 HD3 PRO 30 2HD PRO 30 2.182 2.944 0.731
177 H ARG 31 H ARG 31 -1.598 2.363 2.135
178 HA ARG 31 HA ARG 31 -3.367 3.734 4.052
179 HB2 ARG 31 1HB ARG 31 -3.462 3.440 1.090
180 HB3 ARG 31 2HB ARG 31 -4.992 3.444 1.958
181 HG2 ARG 31 1HG ARG 31 -4.024 5.593 3.077
182 HG3 ARG 31 2HG ARG 31 -2.980 5.619 1.654
183 HD2 ARG 31 1HD ARG 31 -4.846 6.938 1.088
184 HD3 ARG 31 2HD ARG 31 -5.099 5.393 0.277
185 HE ARG 31 HE ARG 31 -6.966 5.075 1.556
186 HH11 ARG 31 2HH1 ARG 31 -5.002 7.550 3.019
187 HH12 ARG 31 1HH1 ARG 31 -6.184 7.963 4.217
188 HH21 ARG 31 2HH2 ARG 31 -8.529 5.609 3.129
189 HH22 ARG 31 1HH2 ARG 31 -8.189 6.857 4.279
190 H CYS 32 H CYS 32 -2.861 0.825 2.131
191 HA CYS 32 HA CYS 32 -4.760 -0.577 3.888
192 HB2 CYS 32 1HB CYS 32 -5.626 -1.852 2.070
193 HB3 CYS 32 2HB CYS 32 -5.672 -0.166 1.565
194 H ASN 33 H ASN 33 -1.801 -0.265 3.891
195 HA ASN 33 HA ASN 33 0.132 -1.541 3.840
196 HB2 ASN 33 1HB ASN 33 -1.723 -3.358 5.392
197 HB3 ASN 33 2HB ASN 33 0.031 -3.288 5.526
198 HD21 ASN 33 1HD2 ASN 33 0.978 -1.688 6.710
199 HD22 ASN 33 2HD2 ASN 33 0.088 -0.578 7.690
200 H ALA 34 H ALA 34 -0.744 -1.901 1.401
201 HA ALA 34 HA ALA 34 -0.967 -4.794 0.936
202 HB1 ALA 34 3HB ALA 34 -2.675 -3.940 -0.295
203 HB2 ALA 34 1HB ALA 34 -1.865 -2.395 -0.555
204 HB3 ALA 34 2HB ALA 34 -1.391 -3.809 -1.497
205 HA PRO 35 HA PRO 35 3.382 -4.517 -0.134
206 HB2 PRO 35 1HB PRO 35 3.719 -7.192 -0.447
207 HB3 PRO 35 2HB PRO 35 3.678 -6.408 1.137
208 HG2 PRO 35 1HG PRO 35 1.505 -7.876 -0.307
209 HG3 PRO 35 2HG PRO 35 1.961 -7.953 1.405
210 HD2 PRO 35 1HD PRO 35 -0.145 -6.498 0.523
211 HD3 PRO 35 2HD PRO 35 0.832 -6.012 1.924
212 H TYR 36 H TYR 36 3.748 -3.749 -2.128
213 HA TYR 36 HA TYR 36 2.936 -5.414 -4.420
214 HB2 TYR 36 1HB TYR 36 2.776 -3.309 -5.734
215 HB3 TYR 36 2HB TYR 36 1.612 -3.389 -4.417
216 HD1 TYR 36 2HD TYR 36 4.694 -1.779 -5.610
217 HD2 TYR 36 1HD TYR 36 1.728 -1.862 -2.560
218 HE1 TYR 36 2HE TYR 36 5.502 0.388 -4.773
219 HE2 TYR 36 1HE TYR 36 2.527 0.305 -1.716
220 HH TYR 36 HH TYR 36 5.311 1.940 -3.195
221 H CYS 37 H CYS 37 4.382 -5.610 -6.133
222 HA CYS 37 HA CYS 37 7.131 -5.536 -5.438
223 HB2 CYS 37 1HB CYS 37 7.509 -6.256 -7.781
224 HB3 CYS 37 2HB CYS 37 6.290 -7.227 -6.962
225 H SER 38 H SER 38 5.185 -3.634 -7.728
226 HA SER 38 HA SER 38 7.076 -1.429 -7.431
227 HB2 SER 38 1HB SER 38 7.479 -2.987 -9.544
228 HB3 SER 38 2HB SER 38 6.158 -2.027 -10.210
229 HG SER 38 HG SER 38 8.208 -1.098 -10.643
230 H LEU 39 H LEU 39 6.123 0.427 -9.042
231 HA LEU 39 HA LEU 39 3.761 1.300 -7.822
232 HB2 LEU 39 1HB LEU 39 5.268 2.152 -10.263
233 HB3 LEU 39 2HB LEU 39 3.721 2.896 -9.866
234 HG LEU 39 HG LEU 39 4.931 3.262 -7.529
235 HD11 LEU 39 1HD1 LEU 39 7.107 2.720 -9.474
236 HD12 LEU 39 2HD1 LEU 39 7.026 2.395 -7.743
237 HD13 LEU 39 3HD1 LEU 39 7.332 4.034 -8.318
238 HD21 LEU 39 3HD2 LEU 39 5.542 5.501 -8.306
239 HD22 LEU 39 1HD2 LEU 39 3.965 5.008 -8.924
240 HD23 LEU 39 2HD2 LEU 39 5.378 4.964 -9.979
241 H ARG 40 H ARG 40 4.315 -0.365 -10.881
242 HA ARG 40 HA ARG 40 1.895 -0.118 -12.132
243 HB2 ARG 40 1HB ARG 40 2.330 -2.264 -13.189
244 HB3 ARG 40 2HB ARG 40 3.822 -1.343 -13.060
245 HG2 ARG 40 1HG ARG 40 4.540 -2.674 -11.188
246 HG3 ARG 40 2HG ARG 40 2.996 -3.528 -11.162
247 HD2 ARG 40 1HD ARG 40 4.869 -3.537 -13.521
248 HD3 ARG 40 2HD ARG 40 4.893 -4.763 -12.254
249 HE ARG 40 HE ARG 40 2.388 -4.292 -13.685
250 HH11 ARG 40 2HH1 ARG 40 5.152 -6.314 -13.065
251 HH12 ARG 40 1HH1 ARG 40 4.449 -7.722 -13.791
252 HH21 ARG 40 2HH2 ARG 40 1.451 -6.138 -14.643
253 HH22 ARG 40 1HH2 ARG 40 2.344 -7.620 -14.689
254 H CYS 41 H CYS 41 2.731 -2.368 -9.524
255 HA CYS 41 HA CYS 41 0.088 -3.512 -9.456
256 HB2 CYS 41 1HB CYS 41 2.635 -3.902 -7.961
257 HB3 CYS 41 2HB CYS 41 1.141 -4.403 -7.174
258 H TYR 42 H TYR 42 1.931 -1.171 -7.567
259 HA TYR 42 HA TYR 42 0.275 -0.841 -5.386
260 HB2 TYR 42 1HB TYR 42 2.325 0.319 -5.347
261 HB3 TYR 42 2HB TYR 42 2.013 1.102 -6.892
262 HD1 TYR 42 1HD TYR 42 0.568 0.916 -3.448
263 HD2 TYR 42 2HD TYR 42 1.356 3.315 -6.873
264 HE1 TYR 42 1HE TYR 42 -0.312 2.885 -2.265
265 HE2 TYR 42 2HE TYR 42 0.479 5.290 -5.699
266 HH TYR 42 HH TYR 42 -0.388 6.081 -3.819
267 H ARG 43 H ARG 43 -0.246 0.096 -8.675
268 HA ARG 43 HA ARG 43 -2.518 1.791 -7.958
269 HB2 ARG 43 1HB ARG 43 -1.063 1.260 -10.540
270 HB3 ARG 43 2HB ARG 43 -2.609 2.097 -10.506
271 HG2 ARG 43 1HG ARG 43 -1.657 3.825 -9.079
272 HG3 ARG 43 2HG ARG 43 -0.108 2.979 -9.080
273 HD2 ARG 43 1HD ARG 43 -0.149 3.194 -11.602
274 HD3 ARG 43 2HD ARG 43 -1.506 4.300 -11.394
275 HE ARG 43 HE ARG 43 0.349 5.377 -9.783
276 HH11 ARG 43 2HH1 ARG 43 0.485 4.270 -13.081
277 HH12 ARG 43 1HH1 ARG 43 1.706 5.406 -13.549
278 HH21 ARG 43 2HH2 ARG 43 1.957 6.877 -10.387
279 HH22 ARG 43 1HH2 ARG 43 2.543 6.888 -12.016
280 H THR 44 H THR 44 -1.755 -1.248 -9.557
281 HA THR 44 HA THR 44 -4.394 -1.779 -10.479
282 HB THR 44 HB THR 44 -2.086 -3.669 -9.984
283 HG1 THR 44 1HG THR 44 -3.055 -2.793 -12.494
284 HG21 THR 44 3HG2 THR 44 -3.825 -5.160 -10.063
285 HG22 THR 44 1HG2 THR 44 -3.517 -4.974 -11.788
286 HG23 THR 44 2HG2 THR 44 -4.842 -4.092 -11.029
287 H HIS 45 H HIS 45 -2.513 -3.165 -7.780
288 HA HIS 45 HA HIS 45 -4.211 -4.864 -6.615
289 HB2 HIS 45 1HB HIS 45 -3.073 -4.570 -4.633
290 HB3 HIS 45 2HB HIS 45 -1.958 -3.792 -5.752
291 HD1 HIS 45 1HD HIS 45 -1.553 -1.305 -5.464
292 HD2 HIS 45 2HD HIS 45 -4.551 -2.770 -2.988
293 HE1 HIS 45 1HE HIS 45 -2.061 0.555 -3.850
294 H GLY 46 H GLY 46 -4.390 -1.340 -6.097
295 HA2 GLY 46 1HA GLY 46 -7.251 -1.399 -6.012
296 HA3 GLY 46 2HA GLY 46 -6.553 -1.204 -4.411
297 H THR 47 H THR 47 -8.057 0.797 -4.989
298 HA THR 47 HA THR 47 -6.406 2.889 -6.229
299 HB THR 47 HB THR 47 -8.543 4.243 -6.170
300 HG1 THR 47 1HG THR 47 -9.822 3.181 -4.731
301 HG21 THR 47 3HG2 THR 47 -7.741 2.141 -7.925
302 HG22 THR 47 1HG2 THR 47 -8.613 3.624 -8.308
303 HG23 THR 47 2HG2 THR 47 -9.502 2.172 -7.848
304 H CYS 48 H CYS 48 -5.049 3.066 -4.346
305 HA CYS 48 HA CYS 48 -6.339 4.564 -2.161
306 HB2 CYS 48 1HB CYS 48 -3.837 2.934 -1.789
307 HB3 CYS 48 2HB CYS 48 -4.938 3.550 -0.561
308 H ALA 49 H ALA 49 -5.139 5.556 -4.636
309 HA ALA 49 HA ALA 49 -2.769 6.952 -3.598
310 HB1 ALA 49 3HB ALA 49 -2.659 5.646 -5.777
311 HB2 ALA 49 1HB ALA 49 -3.663 6.923 -6.466
312 HB3 ALA 49 2HB ALA 49 -2.069 7.307 -5.814
313 H GLU 50 H GLU 50 -5.912 7.458 -5.124
314 HA GLU 50 HA GLU 50 -5.924 10.137 -5.620
315 HB2 GLU 50 1HB GLU 50 -8.338 10.114 -5.168
316 HB3 GLU 50 2HB GLU 50 -7.838 8.702 -6.088
317 HG2 GLU 50 1HG GLU 50 -8.078 7.276 -4.247
318 HG3 GLU 50 2HG GLU 50 -8.131 8.620 -3.107
319 H ASN 51 H ASN 51 -6.093 8.554 -2.495
320 HA ASN 51 HA ASN 51 -5.995 11.205 -1.211
321 HB2 ASN 51 1HB ASN 51 -6.945 9.893 0.817
322 HB3 ASN 51 2HB ASN 51 -8.040 10.337 -0.489
323 HD21 ASN 51 1HD2 ASN 51 -9.464 8.683 0.022
324 HD22 ASN 51 2HD2 ASN 51 -9.114 7.027 -0.324
325 H PHE 52 H PHE 52 -3.676 10.003 -2.103
326 HA PHE 52 HA PHE 52 -2.441 8.998 0.375
327 HB2 PHE 52 1HB PHE 52 -2.187 7.313 -1.259
328 HB3 PHE 52 2HB PHE 52 -1.808 8.479 -2.522
329 HD1 PHE 52 2HD PHE 52 -0.448 7.755 0.880
330 HD2 PHE 52 1HD PHE 52 0.342 8.272 -3.270
331 HE1 PHE 52 2HE PHE 52 1.953 7.421 1.299
332 HE2 PHE 52 1HE PHE 52 2.745 7.937 -2.858
333 HZ PHE 52 HZ PHE 52 3.553 7.512 -0.571
334 H TYR 53 H TYR 53 -1.706 10.927 -2.529
335 HA TYR 53 HA TYR 53 0.491 12.240 -1.171
336 HB2 TYR 53 1HB TYR 53 0.424 13.579 -3.444
337 HB3 TYR 53 2HB TYR 53 1.066 11.941 -3.381
338 HD1 TYR 53 1HD TYR 53 -0.236 10.061 -4.283
339 HD2 TYR 53 2HD TYR 53 -1.625 14.070 -4.604
340 HE1 TYR 53 1HE TYR 53 -1.850 9.359 -6.001
341 HE2 TYR 53 2HE TYR 53 -3.243 13.379 -6.322
342 HH TYR 53 HH TYR 53 -3.219 10.156 -7.677
343 H SER 54 H SER 54 -0.316 13.529 0.426
344 HA SER 54 HA SER 54 -1.661 15.121 1.436
345 HB2 SER 54 1HB SER 54 -1.084 17.322 0.656
346 HB3 SER 54 2HB SER 54 0.325 16.289 0.422
347 HG SER 54 HG SER 54 -0.791 16.012 -1.796
348 H GLY 55 H GLY 55 -3.407 13.534 0.162
349 HA2 GLY 55 1HA GLY 55 -5.057 15.117 -1.636
350 HA3 GLY 55 2HA GLY 55 -5.344 13.453 -1.147
351 HA PRO 56 HA PRO 56 -7.370 16.752 1.822
352 HB2 PRO 56 1HB PRO 56 -9.001 18.314 0.315
353 HB3 PRO 56 2HB PRO 56 -7.338 18.764 0.713
354 HG2 PRO 56 1HG PRO 56 -8.422 17.546 -1.798
355 HG3 PRO 56 2HG PRO 56 -7.238 18.852 -1.609
356 HD2 PRO 56 1HD PRO 56 -6.518 16.301 -2.161
357 HD3 PRO 56 2HD PRO 56 -5.505 17.390 -1.192
358 H SER 57 H SER 57 -9.928 17.247 1.918
359 HA SER 57 HA SER 57 -11.163 14.650 1.579
360 HB2 SER 57 1HB SER 57 -12.207 17.205 2.824
361 HB3 SER 57 2HB SER 57 -13.048 15.655 2.846
362 HG SER 57 HG SER 57 -11.966 15.573 4.695
363 H SER 58 H SER 58 -10.638 15.690 -0.884
364 HA SER 58 HA SER 58 -13.186 16.772 -1.858
365 HB2 SER 58 1HB SER 58 -10.460 16.619 -3.161
366 HB3 SER 58 2HB SER 58 -11.908 17.224 -3.965
367 HG SER 58 HG SER 58 -10.523 18.844 -2.945
368 H GLY 59 H GLY 59 -14.530 15.600 -3.091
369 HA2 GLY 59 1HA GLY 59 -14.414 13.874 -5.003
370 HA3 GLY 59 2HA GLY 59 -13.682 12.862 -3.766
Start of MODEL 19
1 H1 GLY 1 1H GLY 1 8.553 -10.113 10.057
2 HA2 GLY 1 1HA GLY 1 7.951 -9.697 12.403
3 HA3 GLY 1 2HA GLY 1 7.813 -11.438 12.593
4 H SER 2 H SER 2 9.573 -9.148 13.731
5 HA SER 2 HA SER 2 11.908 -10.783 14.068
6 HB2 SER 2 1HB SER 2 12.063 -8.239 12.450
7 HB3 SER 2 2HB SER 2 13.468 -8.933 13.259
8 HG SER 2 HG SER 2 13.292 -9.641 11.091
9 H SER 3 H SER 3 12.645 -10.488 16.066
10 HA SER 3 HA SER 3 11.500 -8.959 17.990
11 HB2 SER 3 1HB SER 3 14.432 -9.693 17.815
12 HB3 SER 3 2HB SER 3 13.604 -9.173 19.282
13 HG SER 3 HG SER 3 12.815 -11.423 17.747
14 H GLY 4 H GLY 4 12.222 -7.037 19.158
15 HA2 GLY 4 1HA GLY 4 13.255 -4.934 19.295
16 HA3 GLY 4 2HA GLY 4 13.876 -5.157 17.666
17 H SER 5 H SER 5 12.074 -5.238 15.947
18 HA SER 5 HA SER 5 10.340 -4.232 14.858
19 HB2 SER 5 1HB SER 5 9.096 -4.858 17.020
20 HB3 SER 5 2HB SER 5 9.330 -3.176 17.496
21 HG SER 5 HG SER 5 8.094 -2.521 15.796
22 H SER 6 H SER 6 12.785 -2.937 15.067
23 HA SER 6 HA SER 6 11.956 -0.198 14.634
24 HB2 SER 6 1HB SER 6 12.592 -0.518 17.129
25 HB3 SER 6 2HB SER 6 14.249 -0.618 16.535
26 HG SER 6 HG SER 6 12.435 1.543 16.325
27 H GLY 7 H GLY 7 12.945 0.519 12.868
28 HA2 GLY 7 1HA GLY 7 15.343 0.906 12.031
29 HA3 GLY 7 2HA GLY 7 15.409 -0.850 12.009
30 H MET 8 H MET 8 14.859 -1.846 10.181
31 HA MET 8 HA MET 8 13.545 -0.245 8.098
32 HB2 MET 8 1HB MET 8 15.352 -2.656 7.947
33 HB3 MET 8 2HB MET 8 14.459 -2.047 6.560
34 HG2 MET 8 1HG MET 8 16.252 -0.239 8.123
35 HG3 MET 8 2HG MET 8 16.911 -1.330 6.906
36 HE1 MET 8 3HE MET 8 17.798 -0.257 5.285
37 HE2 MET 8 1HE MET 8 17.040 0.766 4.064
38 HE3 MET 8 2HE MET 8 17.683 1.485 5.540
39 H GLU 9 H GLU 9 11.779 -1.030 6.968
40 HA GLU 9 HA GLU 9 10.195 -2.995 8.391
41 HB2 GLU 9 1HB GLU 9 9.561 -1.299 5.970
42 HB3 GLU 9 2HB GLU 9 8.414 -2.355 6.783
43 HG2 GLU 9 1HG GLU 9 8.390 -1.024 8.715
44 HG3 GLU 9 2HG GLU 9 9.836 -0.143 8.223
45 HA PRO 10 HA PRO 10 11.214 -6.400 5.787
46 HB2 PRO 10 1HB PRO 10 9.057 -7.965 6.305
47 HB3 PRO 10 2HB PRO 10 10.373 -7.729 7.462
48 HG2 PRO 10 1HG PRO 10 7.692 -6.402 7.348
49 HG3 PRO 10 2HG PRO 10 8.569 -7.034 8.754
50 HD2 PRO 10 1HD PRO 10 8.515 -4.398 8.133
51 HD3 PRO 10 2HD PRO 10 9.913 -5.168 8.911
52 H ALA 11 H ALA 11 10.089 -7.841 4.114
53 HA ALA 11 HA ALA 11 8.194 -6.232 2.529
54 HB1 ALA 11 3HB ALA 11 10.553 -7.839 1.571
55 HB2 ALA 11 1HB ALA 11 9.292 -7.220 0.505
56 HB3 ALA 11 2HB ALA 11 10.299 -6.100 1.424
57 H GLY 12 H GLY 12 6.932 -7.537 0.943
58 HA2 GLY 12 1HA GLY 12 6.513 -10.309 1.845
59 HA3 GLY 12 2HA GLY 12 5.148 -9.207 1.741
60 HA PRO 13 HA PRO 13 6.165 -11.399 -2.385
61 HB2 PRO 13 1HB PRO 13 4.298 -13.368 -2.301
62 HB3 PRO 13 2HB PRO 13 5.945 -13.580 -1.696
63 HG2 PRO 13 1HG PRO 13 3.432 -12.986 -0.181
64 HG3 PRO 13 2HG PRO 13 4.738 -14.117 0.218
65 HD2 PRO 13 1HD PRO 13 4.528 -11.672 1.363
66 HD3 PRO 13 2HD PRO 13 6.093 -12.453 1.058
67 H CYS 14 H CYS 14 5.302 -9.896 -3.703
68 HA CYS 14 HA CYS 14 2.801 -8.696 -3.470
69 HB2 CYS 14 1HB CYS 14 4.551 -7.724 -4.841
70 HB3 CYS 14 2HB CYS 14 4.514 -9.108 -5.928
71 H GLY 15 H GLY 15 1.162 -10.182 -3.125
72 HA2 GLY 15 1HA GLY 15 0.708 -12.463 -4.738
73 HA3 GLY 15 2HA GLY 15 -0.464 -11.712 -3.666
74 H PHE 16 H PHE 16 -0.433 -9.138 -4.950
75 HA PHE 16 HA PHE 16 -2.526 -9.307 -6.678
76 HB2 PHE 16 1HB PHE 16 -0.345 -7.279 -7.123
77 HB3 PHE 16 2HB PHE 16 -2.081 -7.082 -7.335
78 HD1 PHE 16 1HD PHE 16 -3.194 -8.063 -4.858
79 HD2 PHE 16 2HD PHE 16 0.333 -5.774 -5.520
80 HE1 PHE 16 1HE PHE 16 -3.368 -7.144 -2.582
81 HE2 PHE 16 2HE PHE 16 0.165 -4.852 -3.245
82 HZ PHE 16 HZ PHE 16 -1.686 -5.537 -1.772
83 H CYS 17 H CYS 17 0.863 -9.789 -7.415
84 HA CYS 17 HA CYS 17 0.569 -9.784 -10.249
85 HB2 CYS 17 1HB CYS 17 2.714 -10.494 -8.314
86 HB3 CYS 17 2HB CYS 17 2.829 -11.181 -9.931
87 HA PRO 18 HA PRO 18 -0.916 -13.827 -11.083
88 HB2 PRO 18 1HB PRO 18 0.446 -14.460 -13.344
89 HB3 PRO 18 2HB PRO 18 -0.860 -13.270 -13.312
90 HG2 PRO 18 1HG PRO 18 2.102 -12.835 -13.262
91 HG3 PRO 18 2HG PRO 18 0.858 -11.964 -14.178
92 HD2 PRO 18 1HD PRO 18 1.931 -10.992 -11.890
93 HD3 PRO 18 2HD PRO 18 0.251 -10.672 -12.368
94 H ALA 19 H ALA 19 -0.382 -16.065 -11.096
95 HA ALA 19 HA ALA 19 1.503 -16.924 -9.312
96 HB1 ALA 19 3HB ALA 19 -0.353 -18.296 -10.203
97 HB2 ALA 19 1HB ALA 19 0.560 -18.510 -11.697
98 HB3 ALA 19 2HB ALA 19 1.189 -19.151 -10.178
99 H GLY 20 H GLY 20 3.594 -17.718 -9.392
100 HA2 GLY 20 1HA GLY 20 5.686 -18.174 -10.288
101 HA3 GLY 20 2HA GLY 20 5.040 -17.844 -11.888
102 H GLU 21 H GLU 21 4.249 -15.330 -11.894
103 HA GLU 21 HA GLU 21 6.632 -13.849 -12.006
104 HB2 GLU 21 1HB GLU 21 3.726 -13.098 -12.128
105 HB3 GLU 21 2HB GLU 21 4.975 -11.861 -12.148
106 HG2 GLU 21 1HG GLU 21 4.670 -14.107 -14.128
107 HG3 GLU 21 2HG GLU 21 4.259 -12.414 -14.396
108 H VAL 22 H VAL 22 4.825 -14.746 -9.346
109 HA VAL 22 HA VAL 22 4.569 -12.748 -7.591
110 HB VAL 22 HB VAL 22 5.949 -15.369 -7.000
111 HG11 VAL 22 1HG1 VAL 22 4.527 -13.624 -5.011
112 HG12 VAL 22 2HG1 VAL 22 5.576 -15.009 -4.707
113 HG13 VAL 22 3HG1 VAL 22 6.261 -13.497 -5.303
114 HG21 VAL 22 3HG2 VAL 22 3.840 -15.924 -7.799
115 HG22 VAL 22 1HG2 VAL 22 3.585 -15.830 -6.057
116 HG23 VAL 22 2HG2 VAL 22 3.086 -14.494 -7.094
117 H GLN 23 H GLN 23 5.760 -11.071 -6.997
118 HA GLN 23 HA GLN 23 8.691 -11.370 -6.953
119 HB2 GLN 23 1HB GLN 23 7.056 -8.921 -7.636
120 HB3 GLN 23 2HB GLN 23 8.805 -8.938 -7.462
121 HG2 GLN 23 1HG GLN 23 8.655 -10.829 -9.268
122 HG3 GLN 23 2HG GLN 23 7.102 -10.073 -9.619
123 HE21 GLN 23 1HE2 GLN 23 7.174 -8.616 -11.157
124 HE22 GLN 23 2HE2 GLN 23 8.523 -7.615 -11.558
125 HA PRO 24 HA PRO 24 8.661 -10.235 -2.713
126 HB2 PRO 24 1HB PRO 24 11.059 -8.978 -2.508
127 HB3 PRO 24 2HB PRO 24 10.904 -10.729 -2.696
128 HG2 PRO 24 1HG PRO 24 11.512 -8.649 -4.761
129 HG3 PRO 24 2HG PRO 24 12.253 -10.243 -4.526
130 HD2 PRO 24 1HD PRO 24 10.366 -9.777 -6.411
131 HD3 PRO 24 2HD PRO 24 10.527 -11.341 -5.587
132 H ALA 25 H ALA 25 6.967 -8.726 -2.626
133 HA ALA 25 HA ALA 25 7.013 -6.097 -3.524
134 HB1 ALA 25 3HB ALA 25 5.087 -7.515 -2.511
135 HB2 ALA 25 1HB ALA 25 5.610 -6.806 -0.982
136 HB3 ALA 25 2HB ALA 25 5.080 -5.763 -2.302
137 H ARG 26 H ARG 26 8.916 -5.017 -3.125
138 HA ARG 26 HA ARG 26 10.171 -4.911 -0.581
139 HB2 ARG 26 1HB ARG 26 10.499 -3.526 -3.192
140 HB3 ARG 26 2HB ARG 26 11.182 -2.742 -1.773
141 HG2 ARG 26 1HG ARG 26 11.773 -5.619 -2.182
142 HG3 ARG 26 2HG ARG 26 12.564 -4.449 -3.239
143 HD2 ARG 26 1HD ARG 26 13.490 -3.290 -1.342
144 HD3 ARG 26 2HD ARG 26 12.588 -4.317 -0.228
145 HE ARG 26 HE ARG 26 15.025 -4.982 -1.631
146 HH11 ARG 26 2HH1 ARG 26 12.253 -6.175 0.105
147 HH12 ARG 26 1HH1 ARG 26 13.005 -7.674 0.537
148 HH21 ARG 26 2HH2 ARG 26 16.026 -6.953 -1.068
149 HH22 ARG 26 1HH2 ARG 26 15.152 -8.116 -0.130
150 H TYR 27 H TYR 27 7.681 -3.031 -2.133
151 HA TYR 27 HA TYR 27 7.661 -1.173 0.149
152 HB2 TYR 27 1HB TYR 27 6.120 -0.673 -2.370
153 HB3 TYR 27 2HB TYR 27 6.782 0.485 -1.222
154 HD1 TYR 27 1HD TYR 27 9.417 0.511 -1.074
155 HD2 TYR 27 2HD TYR 27 7.203 -0.974 -4.390
156 HE1 TYR 27 1HE TYR 27 11.382 0.825 -2.519
157 HE2 TYR 27 2HE TYR 27 9.162 -0.665 -5.844
158 HH TYR 27 HH TYR 27 11.423 1.120 -5.529
159 H THR 28 H THR 28 5.193 -0.207 0.179
160 HA THR 28 HA THR 28 3.148 -2.185 -0.088
161 HB THR 28 HB THR 28 3.563 -1.434 2.771
162 HG1 THR 28 1HG THR 28 4.769 -3.515 2.897
163 HG21 THR 28 3HG2 THR 28 2.652 -4.073 1.684
164 HG22 THR 28 1HG2 THR 28 1.556 -2.693 1.714
165 HG23 THR 28 2HG2 THR 28 2.250 -3.301 3.217
166 H CYS 29 H CYS 29 1.079 -1.347 0.226
167 HA CYS 29 HA CYS 29 0.798 1.436 -0.134
168 HB2 CYS 29 1HB CYS 29 -0.794 -0.578 -0.737
169 HB3 CYS 29 2HB CYS 29 -1.485 -0.232 0.845
170 HA PRO 30 HA PRO 30 1.160 2.579 4.170
171 HB2 PRO 30 1HB PRO 30 0.907 5.249 3.747
172 HB3 PRO 30 2HB PRO 30 2.406 4.365 3.438
173 HG2 PRO 30 1HG PRO 30 0.281 5.225 1.512
174 HG3 PRO 30 2HG PRO 30 2.045 5.299 1.339
175 HD2 PRO 30 1HD PRO 30 0.549 3.355 0.192
176 HD3 PRO 30 2HD PRO 30 2.208 3.074 0.760
177 H ARG 31 H ARG 31 -1.508 2.320 2.344
178 HA ARG 31 HA ARG 31 -3.224 3.643 4.342
179 HB2 ARG 31 1HB ARG 31 -3.473 3.390 1.374
180 HB3 ARG 31 2HB ARG 31 -4.938 3.446 2.345
181 HG2 ARG 31 1HG ARG 31 -3.938 5.565 3.383
182 HG3 ARG 31 2HG ARG 31 -2.828 5.543 2.011
183 HD2 ARG 31 1HD ARG 31 -4.499 5.951 0.480
184 HD3 ARG 31 2HD ARG 31 -5.757 5.281 1.519
185 HE ARG 31 HE ARG 31 -4.719 7.988 1.552
186 HH11 ARG 31 2HH1 ARG 31 -6.599 5.548 3.175
187 HH12 ARG 31 1HH1 ARG 31 -7.472 6.683 4.149
188 HH21 ARG 31 2HH2 ARG 31 -5.862 9.493 2.830
189 HH22 ARG 31 1HH2 ARG 31 -7.053 8.927 3.952
190 H CYS 32 H CYS 32 -2.893 0.850 2.188
191 HA CYS 32 HA CYS 32 -4.652 -0.654 4.010
192 HB2 CYS 32 1HB CYS 32 -5.625 -1.825 2.203
193 HB3 CYS 32 2HB CYS 32 -5.614 -0.138 1.702
194 H ASN 33 H ASN 33 -1.703 -0.320 3.926
195 HA ASN 33 HA ASN 33 0.238 -1.573 3.755
196 HB2 ASN 33 1HB ASN 33 0.033 -3.619 5.249
197 HB3 ASN 33 2HB ASN 33 -0.449 -2.087 5.971
198 HD21 ASN 33 1HD2 ASN 33 -2.368 -1.983 6.901
199 HD22 ASN 33 2HD2 ASN 33 -3.642 -3.135 6.715
200 H ALA 34 H ALA 34 -0.712 -1.827 1.331
201 HA ALA 34 HA ALA 34 -1.016 -4.676 0.720
202 HB1 ALA 34 3HB ALA 34 -1.208 -3.353 -1.676
203 HB2 ALA 34 1HB ALA 34 -2.562 -3.826 -0.649
204 HB3 ALA 34 2HB ALA 34 -1.896 -2.197 -0.535
205 HA PRO 35 HA PRO 35 3.387 -4.559 -0.197
206 HB2 PRO 35 1HB PRO 35 3.626 -7.247 -0.498
207 HB3 PRO 35 2HB PRO 35 3.579 -6.458 1.082
208 HG2 PRO 35 1HG PRO 35 1.385 -7.843 -0.410
209 HG3 PRO 35 2HG PRO 35 1.797 -7.934 1.313
210 HD2 PRO 35 1HD PRO 35 -0.229 -6.400 0.379
211 HD3 PRO 35 2HD PRO 35 0.733 -5.949 1.801
212 H TYR 36 H TYR 36 3.459 -3.617 -2.211
213 HA TYR 36 HA TYR 36 2.748 -5.313 -4.509
214 HB2 TYR 36 1HB TYR 36 2.707 -3.185 -5.808
215 HB3 TYR 36 2HB TYR 36 1.516 -3.237 -4.513
216 HD1 TYR 36 2HD TYR 36 4.792 -1.832 -5.504
217 HD2 TYR 36 1HD TYR 36 1.549 -1.646 -2.756
218 HE1 TYR 36 2HE TYR 36 5.670 0.288 -4.620
219 HE2 TYR 36 1HE TYR 36 2.417 0.476 -1.865
220 HH TYR 36 HH TYR 36 4.683 2.327 -3.411
221 H CYS 37 H CYS 37 4.208 -5.648 -6.161
222 HA CYS 37 HA CYS 37 6.952 -5.644 -5.457
223 HB2 CYS 37 1HB CYS 37 7.320 -6.449 -7.768
224 HB3 CYS 37 2HB CYS 37 6.046 -7.341 -6.944
225 H SER 38 H SER 38 5.029 -3.654 -7.667
226 HA SER 38 HA SER 38 7.021 -1.543 -7.463
227 HB2 SER 38 1HB SER 38 6.198 -2.779 -10.099
228 HB3 SER 38 2HB SER 38 7.025 -1.227 -9.958
229 HG SER 38 HG SER 38 8.805 -2.312 -9.823
230 H LEU 39 H LEU 39 6.201 0.428 -8.805
231 HA LEU 39 HA LEU 39 3.875 1.377 -7.699
232 HB2 LEU 39 1HB LEU 39 5.397 2.106 -10.162
233 HB3 LEU 39 2HB LEU 39 3.860 2.899 -9.822
234 HG LEU 39 HG LEU 39 5.733 4.260 -9.077
235 HD11 LEU 39 1HD1 LEU 39 4.660 3.329 -6.491
236 HD12 LEU 39 2HD1 LEU 39 3.476 3.797 -7.710
237 HD13 LEU 39 3HD1 LEU 39 4.706 4.948 -7.188
238 HD21 LEU 39 3HD2 LEU 39 6.423 2.264 -6.972
239 HD22 LEU 39 1HD2 LEU 39 7.399 3.563 -7.658
240 HD23 LEU 39 2HD2 LEU 39 7.114 2.090 -8.586
241 H ARG 40 H ARG 40 4.273 -0.165 -10.873
242 HA ARG 40 HA ARG 40 1.849 0.092 -12.021
243 HB2 ARG 40 1HB ARG 40 3.366 -2.515 -11.799
244 HB3 ARG 40 2HB ARG 40 2.142 -2.140 -13.004
245 HG2 ARG 40 1HG ARG 40 3.770 -0.108 -13.487
246 HG3 ARG 40 2HG ARG 40 4.952 -1.224 -12.800
247 HD2 ARG 40 1HD ARG 40 4.918 -1.536 -15.173
248 HD3 ARG 40 2HD ARG 40 4.172 -2.945 -14.420
249 HE ARG 40 HE ARG 40 2.043 -1.410 -14.957
250 HH11 ARG 40 2HH1 ARG 40 4.764 -2.371 -16.904
251 HH12 ARG 40 1HH1 ARG 40 3.878 -2.335 -18.392
252 HH21 ARG 40 2HH2 ARG 40 0.865 -1.359 -16.909
253 HH22 ARG 40 1HH2 ARG 40 1.661 -1.758 -18.394
254 H CYS 41 H CYS 41 2.607 -2.462 -9.648
255 HA CYS 41 HA CYS 41 -0.086 -3.348 -9.439
256 HB2 CYS 41 1HB CYS 41 2.446 -3.866 -7.932
257 HB3 CYS 41 2HB CYS 41 0.915 -4.376 -7.228
258 H TYR 42 H TYR 42 1.960 -1.273 -7.417
259 HA TYR 42 HA TYR 42 0.347 -0.847 -5.253
260 HB2 TYR 42 1HB TYR 42 2.469 0.178 -5.220
261 HB3 TYR 42 2HB TYR 42 2.181 1.023 -6.737
262 HD1 TYR 42 1HD TYR 42 0.575 0.806 -3.360
263 HD2 TYR 42 2HD TYR 42 1.873 3.295 -6.558
264 HE1 TYR 42 1HE TYR 42 -0.160 2.790 -2.106
265 HE2 TYR 42 2HE TYR 42 1.142 5.286 -5.313
266 HH TYR 42 HH TYR 42 -0.852 5.509 -3.208
267 H ARG 43 H ARG 43 -0.164 0.206 -8.508
268 HA ARG 43 HA ARG 43 -2.320 2.012 -7.705
269 HB2 ARG 43 1HB ARG 43 -0.921 1.495 -10.321
270 HB3 ARG 43 2HB ARG 43 -2.415 2.419 -10.239
271 HG2 ARG 43 1HG ARG 43 -1.423 4.160 -9.065
272 HG3 ARG 43 2HG ARG 43 -0.062 3.162 -8.548
273 HD2 ARG 43 1HD ARG 43 0.999 3.317 -10.591
274 HD3 ARG 43 2HD ARG 43 -0.497 3.660 -11.458
275 HE ARG 43 HE ARG 43 1.286 5.561 -10.358
276 HH11 ARG 43 2HH1 ARG 43 -2.108 4.933 -10.819
277 HH12 ARG 43 1HH1 ARG 43 -2.549 6.608 -10.836
278 HH21 ARG 43 2HH2 ARG 43 0.718 7.770 -10.380
279 HH22 ARG 43 1HH2 ARG 43 -0.941 8.221 -10.588
280 H THR 44 H THR 44 -1.751 -0.981 -9.477
281 HA THR 44 HA THR 44 -4.426 -1.328 -10.366
282 HB THR 44 HB THR 44 -2.230 -3.373 -9.984
283 HG1 THR 44 1HG THR 44 -2.940 -1.597 -12.022
284 HG21 THR 44 3HG2 THR 44 -3.620 -4.667 -11.671
285 HG22 THR 44 1HG2 THR 44 -4.937 -3.559 -11.290
286 HG23 THR 44 2HG2 THR 44 -4.260 -4.590 -10.029
287 H HIS 45 H HIS 45 -2.593 -2.909 -7.743
288 HA HIS 45 HA HIS 45 -4.383 -4.566 -6.635
289 HB2 HIS 45 1HB HIS 45 -3.192 -4.446 -4.669
290 HB3 HIS 45 2HB HIS 45 -2.048 -3.683 -5.770
291 HD1 HIS 45 1HD HIS 45 -1.484 -1.243 -5.368
292 HD2 HIS 45 2HD HIS 45 -4.521 -2.645 -2.903
293 HE1 HIS 45 1HE HIS 45 -1.843 0.560 -3.652
294 H GLY 46 H GLY 46 -4.280 -1.086 -5.838
295 HA2 GLY 46 1HA GLY 46 -7.175 -1.044 -5.629
296 HA3 GLY 46 2HA GLY 46 -6.317 -0.775 -4.119
297 H THR 47 H THR 47 -8.044 1.108 -5.272
298 HA THR 47 HA THR 47 -6.329 3.124 -6.501
299 HB THR 47 HB THR 47 -8.437 4.459 -6.677
300 HG1 THR 47 1HG THR 47 -9.522 3.392 -4.904
301 HG21 THR 47 3HG2 THR 47 -9.124 1.840 -7.879
302 HG22 THR 47 1HG2 THR 47 -7.551 2.518 -8.296
303 HG23 THR 47 2HG2 THR 47 -9.021 3.436 -8.623
304 H CYS 48 H CYS 48 -5.659 2.488 -3.855
305 HA CYS 48 HA CYS 48 -6.820 4.318 -2.005
306 HB2 CYS 48 1HB CYS 48 -4.078 3.096 -1.743
307 HB3 CYS 48 2HB CYS 48 -5.192 3.563 -0.462
308 H ALA 49 H ALA 49 -4.053 4.408 -4.165
309 HA ALA 49 HA ALA 49 -2.793 6.698 -3.131
310 HB1 ALA 49 3HB ALA 49 -1.902 5.022 -4.837
311 HB2 ALA 49 1HB ALA 49 -2.782 5.963 -6.042
312 HB3 ALA 49 2HB ALA 49 -1.506 6.722 -5.090
313 H GLU 50 H GLU 50 -5.321 6.313 -5.581
314 HA GLU 50 HA GLU 50 -5.474 8.904 -6.532
315 HB2 GLU 50 1HB GLU 50 -7.785 7.023 -6.024
316 HB3 GLU 50 2HB GLU 50 -7.806 8.412 -7.101
317 HG2 GLU 50 1HG GLU 50 -5.796 6.248 -7.512
318 HG3 GLU 50 2HG GLU 50 -7.457 6.026 -8.058
319 H ASN 51 H ASN 51 -6.925 7.518 -3.622
320 HA ASN 51 HA ASN 51 -7.852 10.198 -2.848
321 HB2 ASN 51 1HB ASN 51 -9.603 8.494 -2.872
322 HB3 ASN 51 2HB ASN 51 -8.655 7.478 -1.790
323 HD21 ASN 51 1HD2 ASN 51 -10.058 7.424 -0.112
324 HD22 ASN 51 2HD2 ASN 51 -10.499 8.809 0.821
325 H PHE 52 H PHE 52 -5.103 9.546 -2.660
326 HA PHE 52 HA PHE 52 -4.736 9.376 0.258
327 HB2 PHE 52 1HB PHE 52 -3.502 7.581 -0.498
328 HB3 PHE 52 2HB PHE 52 -3.113 8.357 -2.030
329 HD1 PHE 52 2HD PHE 52 -2.335 8.383 1.591
330 HD2 PHE 52 1HD PHE 52 -1.085 9.480 -2.327
331 HE1 PHE 52 2HE PHE 52 -0.125 9.006 2.474
332 HE2 PHE 52 1HE PHE 52 1.127 10.104 -1.451
333 HZ PHE 52 HZ PHE 52 1.610 9.869 0.953
334 H TYR 53 H TYR 53 -3.371 10.863 -2.674
335 HA TYR 53 HA TYR 53 -2.044 12.910 -1.124
336 HB2 TYR 53 1HB TYR 53 -1.416 13.793 -3.406
337 HB3 TYR 53 2HB TYR 53 -0.869 12.157 -3.058
338 HD1 TYR 53 1HD TYR 53 -1.998 10.223 -4.121
339 HD2 TYR 53 2HD TYR 53 -2.965 14.232 -5.170
340 HE1 TYR 53 1HE TYR 53 -3.086 9.417 -6.174
341 HE2 TYR 53 2HE TYR 53 -4.057 13.436 -7.226
342 HH TYR 53 HH TYR 53 -3.984 10.022 -8.142
343 H SER 54 H SER 54 -3.094 14.617 -0.375
344 HA SER 54 HA SER 54 -5.686 15.362 -0.954
345 HB2 SER 54 1HB SER 54 -4.563 16.200 1.019
346 HB3 SER 54 2HB SER 54 -3.393 17.075 0.031
347 HG SER 54 HG SER 54 -6.042 17.686 0.623
348 H GLY 55 H GLY 55 -6.614 17.046 -2.185
349 HA2 GLY 55 1HA GLY 55 -4.974 17.839 -4.512
350 HA3 GLY 55 2HA GLY 55 -6.696 17.499 -4.599
351 HA PRO 56 HA PRO 56 -7.027 21.931 -4.410
352 HB2 PRO 56 1HB PRO 56 -9.735 22.015 -4.579
353 HB3 PRO 56 2HB PRO 56 -8.694 21.719 -5.977
354 HG2 PRO 56 1HG PRO 56 -10.207 19.760 -4.293
355 HG3 PRO 56 2HG PRO 56 -10.031 19.818 -6.057
356 HD2 PRO 56 1HD PRO 56 -8.582 18.140 -4.502
357 HD3 PRO 56 2HD PRO 56 -7.946 18.836 -6.006
358 H SER 57 H SER 57 -6.302 22.056 -2.206
359 HA SER 57 HA SER 57 -8.025 21.510 -0.011
360 HB2 SER 57 1HB SER 57 -5.520 21.600 0.117
361 HB3 SER 57 2HB SER 57 -5.625 23.352 -0.049
362 HG SER 57 HG SER 57 -6.126 23.473 1.981
363 H SER 58 H SER 58 -6.978 24.553 -1.536
364 HA SER 58 HA SER 58 -7.854 26.655 -1.502
365 HB2 SER 58 1HB SER 58 -9.709 25.274 -2.612
366 HB3 SER 58 2HB SER 58 -10.543 25.361 -1.060
367 HG SER 58 HG SER 58 -10.166 27.302 -2.974
368 H GLY 59 H GLY 59 -6.839 25.831 0.944
369 HA2 GLY 59 1HA GLY 59 -7.479 27.702 2.735
370 HA3 GLY 59 2HA GLY 59 -8.773 26.543 2.998
Start of MODEL 20
1 H1 GLY 1 1H GLY 1 21.046 -18.690 17.948
2 HA2 GLY 1 1HA GLY 1 18.300 -18.807 18.596
3 HA3 GLY 1 2HA GLY 1 19.200 -18.240 19.995
4 H SER 2 H SER 2 17.459 -16.494 19.185
5 HA SER 2 HA SER 2 19.072 -14.351 18.099
6 HB2 SER 2 1HB SER 2 17.554 -13.769 16.300
7 HB3 SER 2 2HB SER 2 18.078 -15.439 16.084
8 HG SER 2 HG SER 2 15.705 -14.847 17.481
9 H SER 3 H SER 3 18.759 -12.729 19.455
10 HA SER 3 HA SER 3 16.050 -12.295 20.533
11 HB2 SER 3 1HB SER 3 17.391 -13.097 22.350
12 HB3 SER 3 2HB SER 3 18.715 -12.011 21.930
13 HG SER 3 HG SER 3 17.063 -11.461 23.704
14 H GLY 4 H GLY 4 15.308 -10.612 19.378
15 HA2 GLY 4 1HA GLY 4 15.333 -8.129 19.529
16 HA3 GLY 4 2HA GLY 4 17.053 -8.233 19.185
17 H SER 5 H SER 5 14.283 -9.888 17.695
18 HA SER 5 HA SER 5 15.289 -9.101 15.074
19 HB2 SER 5 1HB SER 5 14.548 -11.485 15.694
20 HB3 SER 5 2HB SER 5 12.900 -10.866 15.588
21 HG SER 5 HG SER 5 14.446 -11.683 13.615
22 H SER 6 H SER 6 14.711 -6.861 15.268
23 HA SER 6 HA SER 6 12.069 -6.334 14.253
24 HB2 SER 6 1HB SER 6 12.878 -5.462 17.017
25 HB3 SER 6 2HB SER 6 11.708 -4.534 16.079
26 HG SER 6 HG SER 6 11.262 -6.691 17.520
27 H GLY 7 H GLY 7 11.816 -3.780 14.132
28 HA2 GLY 7 1HA GLY 7 13.154 -1.713 13.942
29 HA3 GLY 7 2HA GLY 7 14.428 -2.709 13.255
30 H MET 8 H MET 8 13.741 -3.947 11.232
31 HA MET 8 HA MET 8 12.037 -2.206 9.572
32 HB2 MET 8 1HB MET 8 14.691 -3.477 8.991
33 HB3 MET 8 2HB MET 8 13.577 -3.126 7.676
34 HG2 MET 8 1HG MET 8 13.698 -0.827 8.024
35 HG3 MET 8 2HG MET 8 14.352 -1.015 9.649
36 HE1 MET 8 3HE MET 8 17.756 0.145 8.840
37 HE2 MET 8 1HE MET 8 16.196 0.967 8.808
38 HE3 MET 8 2HE MET 8 16.541 -0.220 10.065
39 H GLU 9 H GLU 9 10.221 -3.538 9.954
40 HA GLU 9 HA GLU 9 9.908 -6.212 9.861
41 HB2 GLU 9 1HB GLU 9 7.670 -5.842 8.849
42 HB3 GLU 9 2HB GLU 9 8.017 -4.752 10.185
43 HG2 GLU 9 1HG GLU 9 8.641 -3.827 7.437
44 HG3 GLU 9 2HG GLU 9 6.949 -3.907 7.926
45 HA PRO 10 HA PRO 10 11.393 -7.624 5.954
46 HB2 PRO 10 1HB PRO 10 10.227 -10.076 5.966
47 HB3 PRO 10 2HB PRO 10 11.629 -9.673 6.965
48 HG2 PRO 10 1HG PRO 10 8.734 -9.781 7.719
49 HG3 PRO 10 2HG PRO 10 10.145 -10.376 8.612
50 HD2 PRO 10 1HD PRO 10 8.929 -8.030 9.204
51 HD3 PRO 10 2HD PRO 10 10.673 -8.283 9.420
52 H ALA 11 H ALA 11 10.674 -7.102 3.994
53 HA ALA 11 HA ALA 11 8.072 -6.363 3.374
54 HB1 ALA 11 3HB ALA 11 9.702 -7.445 1.159
55 HB2 ALA 11 1HB ALA 11 8.855 -5.904 1.301
56 HB3 ALA 11 2HB ALA 11 10.412 -6.133 2.099
57 H GLY 12 H GLY 12 6.968 -7.478 1.315
58 HA2 GLY 12 1HA GLY 12 6.784 -10.374 1.828
59 HA3 GLY 12 2HA GLY 12 5.329 -9.388 1.811
60 HA PRO 13 HA PRO 13 6.691 -10.904 -2.521
61 HB2 PRO 13 1HB PRO 13 5.077 -13.073 -2.765
62 HB3 PRO 13 2HB PRO 13 6.724 -13.168 -2.131
63 HG2 PRO 13 1HG PRO 13 4.126 -13.084 -0.648
64 HG3 PRO 13 2HG PRO 13 5.551 -14.097 -0.351
65 HD2 PRO 13 1HD PRO 13 5.020 -11.870 1.095
66 HD3 PRO 13 2HD PRO 13 6.675 -12.412 0.750
67 H CYS 14 H CYS 14 5.684 -9.436 -3.753
68 HA CYS 14 HA CYS 14 3.250 -8.288 -3.513
69 HB2 CYS 14 1HB CYS 14 4.607 -7.401 -5.195
70 HB3 CYS 14 2HB CYS 14 4.858 -8.970 -5.954
71 H GLY 15 H GLY 15 1.446 -9.390 -2.986
72 HA2 GLY 15 1HA GLY 15 0.768 -11.855 -4.377
73 HA3 GLY 15 2HA GLY 15 -0.100 -11.148 -3.022
74 H PHE 16 H PHE 16 0.792 -9.629 -6.094
75 HA PHE 16 HA PHE 16 -2.065 -9.479 -6.777
76 HB2 PHE 16 1HB PHE 16 -0.049 -7.234 -6.997
77 HB3 PHE 16 2HB PHE 16 -1.702 -7.173 -7.600
78 HD1 PHE 16 1HD PHE 16 -3.375 -8.159 -5.575
79 HD2 PHE 16 2HD PHE 16 0.223 -5.927 -5.141
80 HE1 PHE 16 1HE PHE 16 -4.146 -7.349 -3.383
81 HE2 PHE 16 2HE PHE 16 -0.541 -5.114 -2.949
82 HZ PHE 16 HZ PHE 16 -2.728 -5.826 -2.066
83 H CYS 17 H CYS 17 1.269 -9.544 -7.849
84 HA CYS 17 HA CYS 17 0.913 -9.300 -10.599
85 HB2 CYS 17 1HB CYS 17 2.977 -10.512 -8.836
86 HB3 CYS 17 2HB CYS 17 2.999 -10.985 -10.532
87 HA PRO 18 HA PRO 18 -0.987 -12.992 -12.014
88 HB2 PRO 18 1HB PRO 18 0.374 -13.504 -14.307
89 HB3 PRO 18 2HB PRO 18 -0.774 -12.169 -14.148
90 HG2 PRO 18 1HG PRO 18 2.214 -12.128 -13.976
91 HG3 PRO 18 2HG PRO 18 1.125 -10.995 -14.798
92 HD2 PRO 18 1HD PRO 18 2.221 -10.467 -12.379
93 HD3 PRO 18 2HD PRO 18 0.614 -9.876 -12.849
94 H ALA 19 H ALA 19 -0.844 -15.083 -11.482
95 HA ALA 19 HA ALA 19 1.011 -16.350 -10.081
96 HB1 ALA 19 3HB ALA 19 0.377 -18.459 -11.580
97 HB2 ALA 19 1HB ALA 19 -0.752 -17.734 -10.435
98 HB3 ALA 19 2HB ALA 19 -0.861 -17.340 -12.152
99 H GLY 20 H GLY 20 3.031 -17.148 -10.251
100 HA2 GLY 20 1HA GLY 20 4.884 -18.086 -11.379
101 HA3 GLY 20 2HA GLY 20 4.211 -17.526 -12.902
102 H GLU 21 H GLU 21 3.752 -14.829 -12.158
103 HA GLU 21 HA GLU 21 6.513 -13.872 -12.229
104 HB2 GLU 21 1HB GLU 21 3.875 -12.660 -13.010
105 HB3 GLU 21 2HB GLU 21 5.312 -11.665 -12.821
106 HG2 GLU 21 1HG GLU 21 5.289 -14.071 -14.606
107 HG3 GLU 21 2HG GLU 21 4.728 -12.494 -15.160
108 H VAL 22 H VAL 22 5.636 -14.759 -9.733
109 HA VAL 22 HA VAL 22 4.722 -12.561 -8.135
110 HB VAL 22 HB VAL 22 5.953 -15.194 -7.309
111 HG11 VAL 22 1HG1 VAL 22 6.032 -13.180 -5.684
112 HG12 VAL 22 2HG1 VAL 22 4.293 -13.445 -5.535
113 HG13 VAL 22 3HG1 VAL 22 5.423 -14.729 -5.100
114 HG21 VAL 22 3HG2 VAL 22 3.187 -14.930 -6.665
115 HG22 VAL 22 1HG2 VAL 22 3.413 -14.573 -8.377
116 HG23 VAL 22 2HG2 VAL 22 3.971 -16.109 -7.716
117 H GLN 23 H GLN 23 5.917 -10.907 -7.485
118 HA GLN 23 HA GLN 23 8.824 -11.295 -7.203
119 HB2 GLN 23 1HB GLN 23 7.283 -8.816 -7.983
120 HB3 GLN 23 2HB GLN 23 9.009 -8.841 -7.645
121 HG2 GLN 23 1HG GLN 23 9.090 -10.668 -9.477
122 HG3 GLN 23 2HG GLN 23 7.517 -10.023 -9.944
123 HE21 GLN 23 1HE2 GLN 23 8.182 -9.204 -11.888
124 HE22 GLN 23 2HE2 GLN 23 9.256 -7.859 -12.032
125 HA PRO 24 HA PRO 24 8.567 -10.189 -2.964
126 HB2 PRO 24 1HB PRO 24 10.938 -8.914 -2.610
127 HB3 PRO 24 2HB PRO 24 10.811 -10.663 -2.829
128 HG2 PRO 24 1HG PRO 24 11.513 -8.550 -4.829
129 HG3 PRO 24 2HG PRO 24 12.255 -10.140 -4.575
130 HD2 PRO 24 1HD PRO 24 10.471 -9.666 -6.556
131 HD3 PRO 24 2HD PRO 24 10.602 -11.240 -5.744
132 H ALA 25 H ALA 25 6.974 -8.701 -2.632
133 HA ALA 25 HA ALA 25 6.998 -6.047 -3.594
134 HB1 ALA 25 3HB ALA 25 5.451 -6.421 -1.159
135 HB2 ALA 25 1HB ALA 25 4.922 -5.978 -2.782
136 HB3 ALA 25 2HB ALA 25 5.153 -7.676 -2.362
137 H ARG 26 H ARG 26 9.071 -5.226 -3.049
138 HA ARG 26 HA ARG 26 10.122 -5.102 -0.454
139 HB2 ARG 26 1HB ARG 26 10.601 -3.641 -3.004
140 HB3 ARG 26 2HB ARG 26 11.246 -2.939 -1.527
141 HG2 ARG 26 1HG ARG 26 11.766 -5.815 -2.038
142 HG3 ARG 26 2HG ARG 26 12.641 -4.623 -3.003
143 HD2 ARG 26 1HD ARG 26 12.521 -4.215 -0.064
144 HD3 ARG 26 2HD ARG 26 13.557 -5.506 -0.673
145 HE ARG 26 HE ARG 26 14.335 -3.463 -2.192
146 HH11 ARG 26 2HH1 ARG 26 13.772 -3.660 1.238
147 HH12 ARG 26 1HH1 ARG 26 14.951 -2.454 1.633
148 HH21 ARG 26 2HH2 ARG 26 15.890 -1.873 -1.685
149 HH22 ARG 26 1HH2 ARG 26 16.155 -1.437 -0.031
150 H TYR 27 H TYR 27 7.719 -3.175 -2.065
151 HA TYR 27 HA TYR 27 7.639 -1.336 0.231
152 HB2 TYR 27 1HB TYR 27 6.150 -0.798 -2.306
153 HB3 TYR 27 2HB TYR 27 6.836 0.339 -1.151
154 HD1 TYR 27 1HD TYR 27 9.611 -0.487 -0.942
155 HD2 TYR 27 2HD TYR 27 7.094 -0.331 -4.370
156 HE1 TYR 27 1HE TYR 27 11.591 -0.218 -2.377
157 HE2 TYR 27 2HE TYR 27 9.067 -0.064 -5.813
158 HH TYR 27 HH TYR 27 11.357 0.653 -5.687
159 H THR 28 H THR 28 5.241 -0.394 0.385
160 HA THR 28 HA THR 28 3.164 -2.341 -0.016
161 HB THR 28 HB THR 28 3.551 -1.647 2.863
162 HG1 THR 28 1HG THR 28 5.564 -2.548 2.162
163 HG21 THR 28 3HG2 THR 28 2.223 -3.523 3.258
164 HG22 THR 28 1HG2 THR 28 2.604 -4.243 1.695
165 HG23 THR 28 2HG2 THR 28 1.531 -2.846 1.784
166 H CYS 29 H CYS 29 1.103 -1.487 0.245
167 HA CYS 29 HA CYS 29 0.837 1.295 -0.063
168 HB2 CYS 29 1HB CYS 29 -0.765 -0.737 -0.661
169 HB3 CYS 29 2HB CYS 29 -1.481 -0.324 0.894
170 HA PRO 30 HA PRO 30 1.208 2.325 4.283
171 HB2 PRO 30 1HB PRO 30 1.159 5.011 3.897
172 HB3 PRO 30 2HB PRO 30 2.601 4.027 3.619
173 HG2 PRO 30 1HG PRO 30 0.606 5.064 1.643
174 HG3 PRO 30 2HG PRO 30 2.375 5.015 1.526
175 HD2 PRO 30 1HD PRO 30 0.782 3.199 0.302
176 HD3 PRO 30 2HD PRO 30 2.397 2.792 0.916
177 H ARG 31 H ARG 31 -1.411 2.289 2.368
178 HA ARG 31 HA ARG 31 -3.091 3.732 4.313
179 HB2 ARG 31 1HB ARG 31 -3.270 3.445 1.345
180 HB3 ARG 31 2HB ARG 31 -4.760 3.597 2.267
181 HG2 ARG 31 1HG ARG 31 -3.947 5.705 3.218
182 HG3 ARG 31 2HG ARG 31 -2.473 5.555 2.259
183 HD2 ARG 31 1HD ARG 31 -3.535 6.053 0.299
184 HD3 ARG 31 2HD ARG 31 -5.077 5.393 0.841
185 HE ARG 31 HE ARG 31 -4.119 8.092 1.188
186 HH11 ARG 31 2HH1 ARG 31 -6.346 5.649 2.280
187 HH12 ARG 31 1HH1 ARG 31 -7.461 6.786 2.963
188 HH21 ARG 31 2HH2 ARG 31 -5.579 9.598 2.083
189 HH22 ARG 31 1HH2 ARG 31 -7.024 9.032 2.850
190 H CYS 32 H CYS 32 -2.924 0.897 2.188
191 HA CYS 32 HA CYS 32 -4.895 -0.428 3.934
192 HB2 CYS 32 1HB CYS 32 -5.657 -1.710 2.074
193 HB3 CYS 32 2HB CYS 32 -5.585 -0.036 1.532
194 H ASN 33 H ASN 33 -1.721 -0.243 3.491
195 HA ASN 33 HA ASN 33 0.076 -1.598 3.841
196 HB2 ASN 33 1HB ASN 33 -2.046 -3.086 5.395
197 HB3 ASN 33 2HB ASN 33 -0.339 -3.517 5.438
198 HD21 ASN 33 1HD2 ASN 33 -2.468 -0.714 5.849
199 HD22 ASN 33 2HD2 ASN 33 -1.584 -0.019 7.159
200 H ALA 34 H ALA 34 -0.720 -1.953 1.362
201 HA ALA 34 HA ALA 34 -0.939 -4.858 0.938
202 HB1 ALA 34 3HB ALA 34 -1.686 -4.291 -1.343
203 HB2 ALA 34 1HB ALA 34 -2.735 -3.616 -0.095
204 HB3 ALA 34 2HB ALA 34 -1.577 -2.580 -0.931
205 HA PRO 35 HA PRO 35 3.378 -4.554 -0.203
206 HB2 PRO 35 1HB PRO 35 3.710 -7.215 -0.631
207 HB3 PRO 35 2HB PRO 35 3.680 -6.498 0.984
208 HG2 PRO 35 1HG PRO 35 1.496 -7.902 -0.506
209 HG3 PRO 35 2HG PRO 35 1.964 -8.052 1.198
210 HD2 PRO 35 1HD PRO 35 -0.147 -6.559 0.393
211 HD3 PRO 35 2HD PRO 35 0.840 -6.134 1.806
212 H TYR 36 H TYR 36 3.639 -3.649 -2.167
213 HA TYR 36 HA TYR 36 2.831 -5.228 -4.522
214 HB2 TYR 36 1HB TYR 36 2.782 -2.993 -5.717
215 HB3 TYR 36 2HB TYR 36 1.513 -3.249 -4.524
216 HD1 TYR 36 2HD TYR 36 4.709 -1.508 -5.166
217 HD2 TYR 36 1HD TYR 36 1.320 -1.845 -2.616
218 HE1 TYR 36 2HE TYR 36 5.355 0.581 -4.040
219 HE2 TYR 36 1HE TYR 36 1.956 0.243 -1.483
220 HH TYR 36 HH TYR 36 4.237 1.528 -1.137
221 H CYS 37 H CYS 37 4.308 -5.576 -6.115
222 HA CYS 37 HA CYS 37 7.039 -5.489 -5.489
223 HB2 CYS 37 1HB CYS 37 7.382 -6.086 -7.891
224 HB3 CYS 37 2HB CYS 37 6.210 -7.109 -7.068
225 H SER 38 H SER 38 5.115 -3.455 -7.680
226 HA SER 38 HA SER 38 7.005 -1.277 -7.276
227 HB2 SER 38 1HB SER 38 6.560 -2.672 -9.882
228 HB3 SER 38 2HB SER 38 6.808 -0.926 -9.893
229 HG SER 38 HG SER 38 8.572 -2.423 -8.357
230 H LEU 39 H LEU 39 6.144 0.661 -8.771
231 HA LEU 39 HA LEU 39 3.764 1.530 -7.671
232 HB2 LEU 39 1HB LEU 39 5.362 2.336 -10.050
233 HB3 LEU 39 2HB LEU 39 3.757 3.033 -9.837
234 HG LEU 39 HG LEU 39 5.443 4.534 -8.971
235 HD11 LEU 39 1HD1 LEU 39 3.174 3.940 -7.740
236 HD12 LEU 39 2HD1 LEU 39 4.326 5.097 -7.072
237 HD13 LEU 39 3HD1 LEU 39 4.288 3.441 -6.466
238 HD21 LEU 39 3HD2 LEU 39 7.101 3.976 -7.486
239 HD22 LEU 39 1HD2 LEU 39 6.980 2.483 -8.417
240 HD23 LEU 39 2HD2 LEU 39 6.208 2.601 -6.835
241 H ARG 40 H ARG 40 4.314 -0.110 -10.756
242 HA ARG 40 HA ARG 40 1.915 0.098 -12.009
243 HB2 ARG 40 1HB ARG 40 3.465 -2.481 -11.712
244 HB3 ARG 40 2HB ARG 40 2.319 -2.097 -12.989
245 HG2 ARG 40 1HG ARG 40 3.864 -0.149 -13.555
246 HG3 ARG 40 2HG ARG 40 5.047 -0.949 -12.519
247 HD2 ARG 40 1HD ARG 40 5.614 -1.884 -14.519
248 HD3 ARG 40 2HD ARG 40 4.387 -3.039 -14.001
249 HE ARG 40 HE ARG 40 3.589 -0.798 -15.708
250 HH11 ARG 40 2HH1 ARG 40 4.136 -4.209 -15.279
251 HH12 ARG 40 1HH1 ARG 40 3.279 -4.659 -16.716
252 HH21 ARG 40 2HH2 ARG 40 2.458 -1.378 -17.601
253 HH22 ARG 40 1HH2 ARG 40 2.326 -3.048 -18.037
254 H CYS 41 H CYS 41 2.638 -2.646 -9.843
255 HA CYS 41 HA CYS 41 -0.021 -3.511 -9.626
256 HB2 CYS 41 1HB CYS 41 2.499 -4.015 -8.112
257 HB3 CYS 41 2HB CYS 41 0.979 -4.516 -7.377
258 H TYR 42 H TYR 42 1.908 -1.377 -7.561
259 HA TYR 42 HA TYR 42 0.254 -1.038 -5.410
260 HB2 TYR 42 1HB TYR 42 2.267 0.108 -5.246
261 HB3 TYR 42 2HB TYR 42 2.108 0.826 -6.845
262 HD1 TYR 42 1HD TYR 42 0.458 0.892 -3.494
263 HD2 TYR 42 2HD TYR 42 1.510 3.054 -7.004
264 HE1 TYR 42 1HE TYR 42 -0.408 2.955 -2.474
265 HE2 TYR 42 2HE TYR 42 0.647 5.125 -5.993
266 HH TYR 42 HH TYR 42 -0.884 5.108 -2.794
267 H ARG 43 H ARG 43 -0.210 0.104 -8.660
268 HA ARG 43 HA ARG 43 -2.444 1.808 -7.885
269 HB2 ARG 43 1HB ARG 43 -0.968 1.317 -10.452
270 HB3 ARG 43 2HB ARG 43 -2.541 2.102 -10.466
271 HG2 ARG 43 1HG ARG 43 -1.752 3.941 -9.229
272 HG3 ARG 43 2HG ARG 43 -0.268 3.097 -8.779
273 HD2 ARG 43 1HD ARG 43 0.606 3.261 -10.963
274 HD3 ARG 43 2HD ARG 43 -0.958 3.719 -11.636
275 HE ARG 43 HE ARG 43 -0.351 5.696 -9.841
276 HH11 ARG 43 2HH1 ARG 43 1.176 4.331 -12.655
277 HH12 ARG 43 1HH1 ARG 43 1.970 5.805 -13.101
278 HH21 ARG 43 2HH2 ARG 43 0.688 7.643 -10.416
279 HH22 ARG 43 1HH2 ARG 43 1.692 7.689 -11.826
280 H THR 44 H THR 44 -1.798 -1.259 -9.447
281 HA THR 44 HA THR 44 -4.447 -1.679 -10.413
282 HB THR 44 HB THR 44 -2.232 -3.671 -9.887
283 HG1 THR 44 1HG THR 44 -1.977 -3.490 -12.178
284 HG21 THR 44 3HG2 THR 44 -3.618 -4.974 -11.651
285 HG22 THR 44 1HG2 THR 44 -4.949 -3.944 -11.125
286 HG23 THR 44 2HG2 THR 44 -4.140 -5.000 -9.966
287 H HIS 45 H HIS 45 -2.647 -3.147 -7.702
288 HA HIS 45 HA HIS 45 -4.454 -4.759 -6.557
289 HB2 HIS 45 1HB HIS 45 -3.287 -4.570 -4.580
290 HB3 HIS 45 2HB HIS 45 -2.127 -3.855 -5.696
291 HD1 HIS 45 1HD HIS 45 -1.598 -1.378 -5.419
292 HD2 HIS 45 2HD HIS 45 -4.583 -2.722 -2.861
293 HE1 HIS 45 1HE HIS 45 -1.956 0.484 -3.768
294 H GLY 46 H GLY 46 -4.357 -1.250 -5.904
295 HA2 GLY 46 1HA GLY 46 -7.252 -1.202 -5.716
296 HA3 GLY 46 2HA GLY 46 -6.405 -0.866 -4.213
297 H THR 47 H THR 47 -7.997 1.072 -5.029
298 HA THR 47 HA THR 47 -6.347 2.997 -6.513
299 HB THR 47 HB THR 47 -9.255 3.305 -5.756
300 HG1 THR 47 1HG THR 47 -8.385 2.623 -8.351
301 HG21 THR 47 3HG2 THR 47 -7.356 5.087 -6.835
302 HG22 THR 47 1HG2 THR 47 -9.095 5.329 -6.675
303 HG23 THR 47 2HG2 THR 47 -8.433 4.639 -8.157
304 H CYS 48 H CYS 48 -5.476 2.488 -3.958
305 HA CYS 48 HA CYS 48 -6.568 4.393 -2.101
306 HB2 CYS 48 1HB CYS 48 -3.899 3.009 -1.870
307 HB3 CYS 48 2HB CYS 48 -4.920 3.621 -0.573
308 H ALA 49 H ALA 49 -4.382 4.538 -4.684
309 HA ALA 49 HA ALA 49 -2.847 6.766 -3.638
310 HB1 ALA 49 3HB ALA 49 -1.411 6.434 -5.358
311 HB2 ALA 49 1HB ALA 49 -2.166 4.840 -5.357
312 HB3 ALA 49 2HB ALA 49 -2.696 6.068 -6.508
313 H GLU 50 H GLU 50 -5.659 7.198 -3.775
314 HA GLU 50 HA GLU 50 -6.200 8.815 -6.102
315 HB2 GLU 50 1HB GLU 50 -7.716 7.944 -3.696
316 HB3 GLU 50 2HB GLU 50 -8.243 9.422 -4.489
317 HG2 GLU 50 1HG GLU 50 -7.953 6.732 -5.807
318 HG3 GLU 50 2HG GLU 50 -9.467 7.471 -5.290
319 H ASN 51 H ASN 51 -5.523 9.360 -2.673
320 HA ASN 51 HA ASN 51 -5.207 12.229 -3.263
321 HB2 ASN 51 1HB ASN 51 -6.996 11.468 -1.572
322 HB3 ASN 51 2HB ASN 51 -5.644 11.100 -0.505
323 HD21 ASN 51 1HD2 ASN 51 -7.317 12.842 0.469
324 HD22 ASN 51 2HD2 ASN 51 -6.717 14.460 0.375
325 H PHE 52 H PHE 52 -3.820 9.418 -1.677
326 HA PHE 52 HA PHE 52 -1.618 10.669 -0.466
327 HB2 PHE 52 1HB PHE 52 -2.245 8.409 0.136
328 HB3 PHE 52 2HB PHE 52 -1.936 7.847 -1.504
329 HD1 PHE 52 2HD PHE 52 -0.379 9.036 1.606
330 HD2 PHE 52 1HD PHE 52 0.269 7.352 -2.249
331 HE1 PHE 52 2HE PHE 52 1.944 8.518 2.227
332 HE2 PHE 52 1HE PHE 52 2.594 6.830 -1.633
333 HZ PHE 52 HZ PHE 52 3.434 7.414 0.607
334 H TYR 53 H TYR 53 -0.422 12.046 -1.664
335 HA TYR 53 HA TYR 53 0.994 10.905 -3.972
336 HB2 TYR 53 1HB TYR 53 -0.625 13.403 -3.854
337 HB3 TYR 53 2HB TYR 53 0.860 13.434 -4.799
338 HD1 TYR 53 1HD TYR 53 1.130 11.306 -6.406
339 HD2 TYR 53 2HD TYR 53 -2.566 12.837 -4.957
340 HE1 TYR 53 1HE TYR 53 -0.042 10.244 -8.290
341 HE2 TYR 53 2HE TYR 53 -3.748 11.778 -6.836
342 HH TYR 53 HH TYR 53 -2.792 11.009 -9.411
343 H SER 54 H SER 54 3.053 11.866 -4.416
344 HA SER 54 HA SER 54 4.318 12.902 -1.990
345 HB2 SER 54 1HB SER 54 6.448 12.324 -3.134
346 HB3 SER 54 2HB SER 54 5.366 10.940 -2.978
347 HG SER 54 HG SER 54 4.806 11.172 -5.135
348 H GLY 55 H GLY 55 3.411 15.042 -2.261
349 HA2 GLY 55 1HA GLY 55 3.931 17.270 -2.672
350 HA3 GLY 55 2HA GLY 55 5.191 16.743 -3.778
351 HA PRO 56 HA PRO 56 1.061 16.645 -6.300
352 HB2 PRO 56 1HB PRO 56 -1.113 17.747 -5.106
353 HB3 PRO 56 2HB PRO 56 -0.705 16.034 -4.963
354 HG2 PRO 56 1HG PRO 56 -0.192 18.270 -3.040
355 HG3 PRO 56 2HG PRO 56 -0.767 16.624 -2.714
356 HD2 PRO 56 1HD PRO 56 1.809 17.369 -2.337
357 HD3 PRO 56 2HD PRO 56 1.353 15.726 -2.830
358 H SER 57 H SER 57 0.305 18.249 -7.705
359 HA SER 57 HA SER 57 1.257 20.958 -7.072
360 HB2 SER 57 1HB SER 57 1.021 19.406 -9.625
361 HB3 SER 57 2HB SER 57 0.975 21.169 -9.677
362 HG SER 57 HG SER 57 2.980 20.468 -8.099
363 H SER 58 H SER 58 -0.040 22.749 -7.428
364 HA SER 58 HA SER 58 -2.899 22.199 -7.393
365 HB2 SER 58 1HB SER 58 -1.884 23.735 -5.714
366 HB3 SER 58 2HB SER 58 -1.455 24.835 -7.023
367 HG SER 58 HG SER 58 -3.782 24.607 -5.732
368 H GLY 59 H GLY 59 -4.241 22.559 -9.047
369 HA2 GLY 59 1HA GLY 59 -5.075 23.519 -10.993
370 HA3 GLY 59 2HA GLY 59 -3.623 24.502 -11.098