NMR Restraints Grid
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NMR Restraints Grid |
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Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
535729 |
2lld   |
18043 | cing | 1-original | 3 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 H1 ALA 1 H1 ALA 1 1.764 0.508 -9.239
2 H2 ALA 1 H2 ALA 1 2.281 -1.060 -9.283
3 H3 ALA 1 H3 ALA 1 0.740 -0.716 -8.809
4 HA ALA 1 HA ALA 1 3.198 0.047 -7.364
5 HB1 ALA 1 HB1 ALA 1 1.417 1.744 -7.052
6 HB2 ALA 1 HB2 ALA 1 0.239 0.473 -6.653
7 HB3 ALA 1 HB3 ALA 1 1.602 0.803 -5.557
8 H THR 2 H THR 2 2.682 -0.943 -4.893
9 HA THR 2 HA THR 2 2.015 -3.810 -5.411
10 HB THR 2 HB THR 2 4.458 -3.515 -5.030
11 HG1 THR 2 HG1 THR 2 4.516 -5.193 -3.561
12 HG21 THR 2 HG21 THR 2 5.266 -2.879 -2.786
13 HG22 THR 2 HG22 THR 2 3.611 -2.482 -2.279
14 HG23 THR 2 HG23 THR 2 4.415 -1.523 -3.548
15 H CYS 3 H CYS 3 1.342 -5.018 -3.565
16 HA CYS 3 HA CYS 3 -0.451 -3.437 -1.755
17 HB2 CYS 3 HB2 CYS 3 -1.383 -5.128 -3.439
18 HB3 CYS 3 HB3 CYS 3 -0.535 -6.378 -2.532
19 H ASP 4 H ASP 4 2.540 -4.845 -1.896
20 HA ASP 4 HA ASP 4 2.633 -6.578 0.356
21 HB2 ASP 4 HB2 ASP 4 4.761 -4.872 -0.985
22 HB3 ASP 4 HB3 ASP 4 5.105 -6.029 0.306
23 H LEU 5 H LEU 5 3.551 -6.360 2.364
24 HA LEU 5 HA LEU 5 3.657 -3.596 3.484
25 HB2 LEU 5 HB2 LEU 5 3.357 -4.751 5.701
26 HB3 LEU 5 HB3 LEU 5 1.965 -4.897 4.636
27 HG LEU 5 HG LEU 5 3.819 -7.144 4.312
28 HD11 LEU 5 HD11 LEU 5 3.406 -8.229 6.438
29 HD12 LEU 5 HD12 LEU 5 2.506 -6.813 7.022
30 HD13 LEU 5 HD13 LEU 5 4.250 -6.687 6.701
31 HD21 LEU 5 HD21 LEU 5 1.763 -8.437 4.524
32 HD22 LEU 5 HD22 LEU 5 1.489 -7.035 3.464
33 HD23 LEU 5 HD23 LEU 5 0.888 -7.011 5.137
34 H LEU 6 H LEU 6 5.525 -4.411 1.896
35 HA LEU 6 HA LEU 6 7.735 -5.820 3.140
36 HB2 LEU 6 HB2 LEU 6 7.363 -5.620 0.675
37 HB3 LEU 6 HB3 LEU 6 7.677 -3.893 0.785
38 HG LEU 6 HG LEU 6 10.013 -4.363 1.469
39 HD11 LEU 6 HD11 LEU 6 10.903 -6.674 1.147
40 HD12 LEU 6 HD12 LEU 6 9.236 -7.270 0.970
41 HD13 LEU 6 HD13 LEU 6 9.779 -6.558 2.511
42 HD21 LEU 6 HD21 LEU 6 10.758 -5.140 -0.748
43 HD22 LEU 6 HD22 LEU 6 9.421 -3.982 -0.889
44 HD23 LEU 6 HD23 LEU 6 9.115 -5.723 -1.104
45 H SER 7 H SER 7 6.576 -2.558 2.951
46 HA SER 7 HA SER 7 9.033 -1.337 3.891
47 HB2 SER 7 HB2 SER 7 6.236 -0.218 3.672
48 HB3 SER 7 HB3 SER 7 7.744 0.724 3.741
49 HG SER 7 HG SER 7 8.334 -0.299 1.748
50 H GLY 8 H GLY 8 7.163 -3.190 5.651
51 HA2 GLY 8 HA2 GLY 8 7.136 -3.176 8.070
52 HA3 GLY 8 HA3 GLY 8 7.344 -1.399 8.027
53 H THR 9 H THR 9 5.593 -0.323 8.387
54 HA THR 9 HA THR 9 3.038 -1.280 8.708
55 HB THR 9 HB THR 9 3.136 0.710 9.583
56 HG1 THR 9 HG1 THR 9 2.590 2.485 7.949
57 HG21 THR 9 HG21 THR 9 4.509 2.679 8.698
58 HG22 THR 9 HG22 THR 9 5.115 1.575 7.448
59 HG23 THR 9 HG23 THR 9 5.452 1.262 9.178
60 H GLY 10 H GLY 10 1.147 -0.604 7.684
61 HA2 GLY 10 HA2 GLY 10 -0.151 -0.467 5.625
62 HA3 GLY 10 HA3 GLY 10 1.291 -0.935 4.701
63 H VAL 11 H VAL 11 0.843 -2.653 7.607
64 HA VAL 11 HA VAL 11 0.713 -5.182 6.493
65 HB VAL 11 HB VAL 11 -0.369 -4.290 9.154
66 HG11 VAL 11 HG11 VAL 11 0.206 -6.600 9.919
67 HG12 VAL 11 HG12 VAL 11 -1.047 -6.597 8.663
68 HG13 VAL 11 HG13 VAL 11 0.628 -7.022 8.246
69 HG21 VAL 11 HG21 VAL 11 1.941 -4.953 10.005
70 HG22 VAL 11 HG22 VAL 11 2.462 -5.002 8.309
71 HG23 VAL 11 HG23 VAL 11 1.889 -3.483 9.021
72 H LYS 12 H LYS 12 -1.916 -3.050 7.377
73 HA LYS 12 HA LYS 12 -3.987 -4.933 6.576
74 HB2 LYS 12 HB2 LYS 12 -3.867 -1.938 7.016
75 HB3 LYS 12 HB3 LYS 12 -5.356 -2.777 6.555
76 HG2 LYS 12 HG2 LYS 12 -3.788 -3.333 9.109
77 HG3 LYS 12 HG3 LYS 12 -5.169 -2.232 9.003
78 HD2 LYS 12 HD2 LYS 12 -6.595 -4.132 8.221
79 HD3 LYS 12 HD3 LYS 12 -5.217 -5.229 8.458
80 HE2 LYS 12 HE2 LYS 12 -5.132 -4.595 10.858
81 HE3 LYS 12 HE3 LYS 12 -6.514 -3.509 10.618
82 HZ1 LYS 12 HZ1 LYS 12 -7.210 -5.635 11.530
83 HZ2 LYS 12 HZ2 LYS 12 -6.570 -6.456 10.251
84 HZ3 LYS 12 HZ3 LYS 12 -7.853 -5.445 10.024
85 H HIS 13 H HIS 13 -4.025 -5.546 4.466
86 HA HIS 13 HA HIS 13 -2.575 -4.296 2.417
87 HB2 HIS 13 HB2 HIS 13 -4.814 -6.307 2.436
88 HB3 HIS 13 HB3 HIS 13 -4.173 -5.696 0.909
89 HD1 HIS 13 HD1 HIS 13 -3.839 -8.706 1.589
90 HD2 HIS 13 HD2 HIS 13 -0.970 -5.763 2.437
91 HE1 HIS 13 HE1 HIS 13 -1.586 -9.888 1.762
92 HE2 HIS 13 HE2 HIS 13 0.121 -8.095 2.271
93 H SER 14 H SER 14 -5.438 -3.103 3.671
94 HA SER 14 HA SER 14 -6.551 -1.829 1.384
95 HB2 SER 14 HB2 SER 14 -6.580 -0.375 3.963
96 HB3 SER 14 HB3 SER 14 -7.936 -0.854 2.914
97 HG SER 14 HG SER 14 -8.081 -2.127 4.708
98 H ALA 15 H ALA 15 -3.603 -1.390 2.988
99 HA ALA 15 HA ALA 15 -3.059 1.282 2.644
100 HB1 ALA 15 HB1 ALA 15 -1.630 -0.258 3.903
101 HB2 ALA 15 HB2 ALA 15 -1.176 -1.082 2.394
102 HB3 ALA 15 HB3 ALA 15 -0.687 0.608 2.669
103 H CYS 16 H CYS 16 -3.099 -1.318 0.260
104 HA CYS 16 HA CYS 16 -1.723 0.077 -1.812
105 HB2 CYS 16 HB2 CYS 16 -1.963 -2.111 -2.411
106 HB3 CYS 16 HB3 CYS 16 -3.511 -2.259 -1.583
107 H ALA 17 H ALA 17 -5.098 -0.111 -0.950
108 HA ALA 17 HA ALA 17 -6.058 1.497 -3.087
109 HB1 ALA 17 HB1 ALA 17 -7.548 0.040 -1.726
110 HB2 ALA 17 HB2 ALA 17 -7.278 1.101 -0.323
111 HB3 ALA 17 HB3 ALA 17 -8.126 1.722 -1.754
112 H ALA 18 H ALA 18 -5.001 2.199 0.176
113 HA ALA 18 HA ALA 18 -5.570 4.990 0.101
114 HB1 ALA 18 HB1 ALA 18 -5.162 3.726 2.200
115 HB2 ALA 18 HB2 ALA 18 -3.456 3.526 1.731
116 HB3 ALA 18 HB3 ALA 18 -4.103 5.149 2.063
117 H HIS 19 H HIS 19 -2.698 3.151 -0.852
118 HA HIS 19 HA HIS 19 -1.033 5.339 -1.261
119 HB2 HIS 19 HB2 HIS 19 -0.470 2.828 -1.261
120 HB3 HIS 19 HB3 HIS 19 -0.909 2.865 -2.973
121 HD1 HIS 19 HD1 HIS 19 2.046 2.403 -1.569
122 HD2 HIS 19 HD2 HIS 19 0.663 5.834 -3.550
123 HE1 HIS 19 HE1 HIS 19 4.101 3.699 -2.358
124 HE2 HIS 19 HE2 HIS 19 3.245 5.762 -3.533
125 H CYS 20 H CYS 20 -3.482 3.833 -3.298
126 HA CYS 20 HA CYS 20 -2.880 5.446 -5.636
127 HB2 CYS 20 HB2 CYS 20 -5.397 3.968 -4.824
128 HB3 CYS 20 HB3 CYS 20 -5.076 4.635 -6.427
129 H LEU 21 H LEU 21 -5.218 5.672 -2.925
130 HA LEU 21 HA LEU 21 -6.638 7.962 -3.834
131 HB2 LEU 21 HB2 LEU 21 -5.977 6.890 -1.097
132 HB3 LEU 21 HB3 LEU 21 -6.939 8.336 -1.304
133 HG LEU 21 HG LEU 21 -7.719 5.593 -2.299
134 HD11 LEU 21 HD11 LEU 21 -9.284 5.584 -0.391
135 HD12 LEU 21 HD12 LEU 21 -8.600 7.124 0.176
136 HD13 LEU 21 HD13 LEU 21 -7.597 5.656 0.149
137 HD21 LEU 21 HD21 LEU 21 -9.974 6.595 -2.507
138 HD22 LEU 21 HD22 LEU 21 -8.803 7.415 -3.549
139 HD23 LEU 21 HD23 LEU 21 -9.310 8.175 -2.029
140 H LEU 22 H LEU 22 -3.552 7.652 -2.103
141 HA LEU 22 HA LEU 22 -3.189 10.441 -1.545
142 HB2 LEU 22 HB2 LEU 22 -1.294 8.107 -1.850
143 HB3 LEU 22 HB3 LEU 22 -0.714 9.725 -1.487
144 HG LEU 22 HG LEU 22 -2.683 8.236 0.273
145 HD11 LEU 22 HD11 LEU 22 -0.554 7.009 0.136
146 HD12 LEU 22 HD12 LEU 22 -0.742 7.771 1.726
147 HD13 LEU 22 HD13 LEU 22 0.342 8.500 0.519
148 HD21 LEU 22 HD21 LEU 22 -1.943 9.892 1.975
149 HD22 LEU 22 HD22 LEU 22 -2.735 10.664 0.589
150 HD23 LEU 22 HD23 LEU 22 -0.963 10.709 0.734
151 H ARG 23 H ARG 23 -3.230 8.909 -4.574
152 HA ARG 23 HA ARG 23 -1.466 11.042 -5.745
153 HB2 ARG 23 HB2 ARG 23 -2.564 8.563 -7.095
154 HB3 ARG 23 HB3 ARG 23 -1.362 9.686 -7.741
155 HG2 ARG 23 HG2 ARG 23 0.105 8.967 -5.737
156 HG3 ARG 23 HG3 ARG 23 -1.050 7.630 -5.563
157 HD2 ARG 23 HD2 ARG 23 0.697 8.283 -7.945
158 HD3 ARG 23 HD3 ARG 23 0.736 6.818 -6.938
159 HE ARG 23 HE ARG 23 -1.858 6.938 -7.990
160 HH11 ARG 23 HH11 ARG 23 1.365 6.813 -9.446
161 HH12 ARG 23 HH12 ARG 23 0.773 6.039 -10.889
162 HH21 ARG 23 HH21 ARG 23 -2.527 5.972 -9.821
163 HH22 ARG 23 HH22 ARG 23 -1.404 5.564 -11.103
164 H GLY 24 H GLY 24 -4.545 10.738 -4.844
165 HA2 GLY 24 HA2 GLY 24 -6.368 12.004 -5.534
166 HA3 GLY 24 HA3 GLY 24 -5.503 12.458 -7.010
167 H ASN 25 H ASN 25 -5.390 9.083 -6.586
168 HA ASN 25 HA ASN 25 -7.327 8.710 -8.771
169 HB2 ASN 25 HB2 ASN 25 -5.821 6.666 -7.084
170 HB3 ASN 25 HB3 ASN 25 -6.793 6.301 -8.503
171 HD21 ASN 25 HD21 ASN 25 -6.074 8.195 -10.316
172 HD22 ASN 25 HD22 ASN 25 -4.366 8.058 -10.662
173 H ARG 26 H ARG 26 -9.137 7.202 -8.535
174 HA ARG 26 HA ARG 26 -10.774 7.771 -6.279
175 HB2 ARG 26 HB2 ARG 26 -10.901 6.082 -8.703
176 HB3 ARG 26 HB3 ARG 26 -11.971 5.636 -7.388
177 HG2 ARG 26 HG2 ARG 26 -12.827 7.234 -9.291
178 HG3 ARG 26 HG3 ARG 26 -13.316 7.484 -7.617
179 HD2 ARG 26 HD2 ARG 26 -12.830 9.622 -8.629
180 HD3 ARG 26 HD3 ARG 26 -11.629 9.290 -7.380
181 HE ARG 26 HE ARG 26 -10.628 8.450 -9.946
182 HH11 ARG 26 HH11 ARG 26 -11.275 11.401 -8.102
183 HH12 ARG 26 HH12 ARG 26 -10.017 12.286 -8.919
184 HH21 ARG 26 HH21 ARG 26 -9.034 9.652 -10.922
185 HH22 ARG 26 HH22 ARG 26 -8.799 11.327 -10.486
186 H GLY 27 H GLY 27 -8.265 5.465 -6.573
187 HA2 GLY 27 HA2 GLY 27 -7.851 4.603 -4.151
188 HA3 GLY 27 HA3 GLY 27 -9.433 3.799 -4.388
189 H GLY 28 H GLY 28 -8.029 1.747 -4.135
190 HA2 GLY 28 HA2 GLY 28 -7.411 0.818 -6.848
191 HA3 GLY 28 HA3 GLY 28 -6.027 0.870 -5.741
192 H TYR 29 H TYR 29 -6.579 -1.579 -6.685
193 HA TYR 29 HA TYR 29 -7.627 -2.895 -4.313
194 HB2 TYR 29 HB2 TYR 29 -8.828 -4.582 -5.619
195 HB3 TYR 29 HB3 TYR 29 -9.512 -2.971 -5.857
196 HD1 TYR 29 HD2 TYR 29 -9.302 -1.815 -8.037
197 HD2 TYR 29 HD1 TYR 29 -7.658 -5.753 -7.450
198 HE1 TYR 29 HE2 TYR 29 -9.096 -2.107 -10.506
199 HE2 TYR 29 HE1 TYR 29 -7.457 -6.029 -9.918
200 HH TYR 29 HH TYR 29 -8.508 -3.509 -12.211
201 H CYS 30 H CYS 30 -6.827 -5.206 -4.200
202 HA CYS 30 HA CYS 30 -4.108 -5.268 -5.397
203 HB2 CYS 30 HB2 CYS 30 -5.251 -6.861 -3.082
204 HB3 CYS 30 HB3 CYS 30 -3.583 -6.911 -3.665
205 H ASN 31 H ASN 31 -3.492 -6.785 -6.774
206 HA ASN 31 HA ASN 31 -5.409 -8.840 -7.704
207 HB2 ASN 31 HB2 ASN 31 -2.518 -8.160 -8.416
208 HB3 ASN 31 HB3 ASN 31 -3.389 -9.530 -9.114
209 HD21 ASN 31 HD21 ASN 31 -2.320 -7.558 -10.706
210 HD22 ASN 31 HD22 ASN 31 -3.634 -6.674 -11.441
211 H GLY 32 H GLY 32 -4.692 -11.154 -7.677
212 HA2 GLY 32 HA2 GLY 32 -3.888 -11.970 -5.074
213 HA3 GLY 32 HA3 GLY 32 -4.067 -13.012 -6.483
214 H ARG 33 H ARG 33 -1.809 -10.695 -7.310
215 HA ARG 33 HA ARG 33 0.397 -12.351 -6.384
216 HB2 ARG 33 HB2 ARG 33 0.218 -10.692 -8.903
217 HB3 ARG 33 HB3 ARG 33 1.680 -11.517 -8.342
218 HG2 ARG 33 HG2 ARG 33 0.408 -13.686 -8.426
219 HG3 ARG 33 HG3 ARG 33 -0.917 -12.813 -9.222
220 HD2 ARG 33 HD2 ARG 33 0.627 -12.135 -11.031
221 HD3 ARG 33 HD3 ARG 33 1.951 -13.001 -10.222
222 HE ARG 33 HE ARG 33 -0.227 -14.793 -10.621
223 HH11 ARG 33 HH11 ARG 33 2.273 -13.163 -12.509
224 HH12 ARG 33 HH12 ARG 33 2.285 -14.403 -13.732
225 HH21 ARG 33 HH21 ARG 33 -0.149 -16.337 -12.220
226 HH22 ARG 33 HH22 ARG 33 0.937 -16.163 -13.571
227 H ALA 34 H ALA 34 -1.013 -10.052 -5.138
228 HA ALA 34 HA ALA 34 -0.541 -8.332 -3.788
229 HB1 ALA 34 HB1 ALA 34 1.656 -8.167 -2.747
230 HB2 ALA 34 HB2 ALA 34 1.248 -9.885 -2.946
231 HB3 ALA 34 HB3 ALA 34 2.396 -9.104 -4.059
232 H ILE 35 H ILE 35 -0.549 -8.024 -6.658
233 HA ILE 35 HA ILE 35 1.082 -5.543 -6.984
234 HB ILE 35 HB ILE 35 -0.809 -6.826 -8.976
235 HG12 ILE 35 HG12 ILE 35 2.217 -7.001 -8.725
236 HG13 ILE 35 HG13 ILE 35 1.077 -8.323 -8.459
237 HG21 ILE 35 HG21 ILE 35 -0.454 -4.387 -9.379
238 HG22 ILE 35 HG22 ILE 35 1.308 -4.640 -9.354
239 HG23 ILE 35 HG23 ILE 35 0.307 -5.336 -10.650
240 HD11 ILE 35 HD11 ILE 35 1.756 -6.963 -11.060
241 HD12 ILE 35 HD12 ILE 35 2.034 -8.654 -10.594
242 HD13 ILE 35 HD13 ILE 35 0.373 -8.072 -10.869
243 H CYS 36 H CYS 36 0.136 -3.589 -7.115
244 HA CYS 36 HA CYS 36 -2.704 -3.425 -6.143
245 HB2 CYS 36 HB2 CYS 36 -1.025 -2.436 -4.637
246 HB3 CYS 36 HB3 CYS 36 -0.437 -1.430 -5.957
247 H VAL 37 H VAL 37 -4.196 -2.561 -7.472
248 HA VAL 37 HA VAL 37 -3.235 -1.286 -9.984
249 HB VAL 37 HB VAL 37 -5.697 -3.031 -9.535
250 HG11 VAL 37 HG11 VAL 37 -5.902 -2.909 -12.029
251 HG12 VAL 37 HG12 VAL 37 -6.075 -1.317 -11.265
252 HG13 VAL 37 HG13 VAL 37 -4.547 -1.757 -12.069
253 HG21 VAL 37 HG21 VAL 37 -3.705 -4.424 -9.495
254 HG22 VAL 37 HG22 VAL 37 -4.553 -4.656 -11.032
255 HG23 VAL 37 HG23 VAL 37 -3.086 -3.647 -10.974
256 H CYS 38 H CYS 38 -3.519 0.747 -9.581
257 HA CYS 38 HA CYS 38 -5.629 1.838 -7.947
258 HB2 CYS 38 HB2 CYS 38 -3.839 3.197 -9.993
259 HB3 CYS 38 HB3 CYS 38 -4.851 4.017 -8.801
260 H ARG 39 H ARG 39 -7.403 3.058 -8.584
261 HA ARG 39 HA ARG 39 -8.556 2.416 -11.221
262 HB2 ARG 39 HB2 ARG 39 -9.571 3.971 -8.804
263 HB3 ARG 39 HB3 ARG 39 -10.508 3.709 -10.282
264 HG2 ARG 39 HG2 ARG 39 -10.480 1.289 -9.908
265 HG3 ARG 39 HG3 ARG 39 -9.480 1.502 -8.458
266 HD2 ARG 39 HD2 ARG 39 -11.279 2.773 -7.370
267 HD3 ARG 39 HD3 ARG 39 -12.268 2.656 -8.837
268 HE ARG 39 HE ARG 39 -12.778 0.442 -8.354
269 HH11 ARG 39 HH11 ARG 39 -10.329 1.534 -6.059
270 HH12 ARG 39 HH12 ARG 39 -10.502 0.117 -5.055
271 HH21 ARG 39 HH21 ARG 39 -12.954 -1.325 -7.021
272 HH22 ARG 39 HH22 ARG 39 -11.978 -1.456 -5.584
273 H ASN 40 H ASN 40 -9.546 4.591 -12.255
274 HA ASN 40 HA ASN 40 -7.478 6.312 -12.874
275 HB2 ASN 40 HB2 ASN 40 -9.107 7.727 -13.958
276 HB3 ASN 40 HB3 ASN 40 -9.543 6.042 -14.262
277 HD21 ASN 40 HD21 ASN 40 -11.564 5.425 -13.808
278 HD22 ASN 40 HD22 ASN 40 -12.709 6.354 -12.873
Start of MODEL 2
1 H1 ALA 1 H1 ALA 1 2.770 0.027 -9.090
2 H2 ALA 1 H2 ALA 1 3.260 -1.544 -8.952
3 H3 ALA 1 H3 ALA 1 1.654 -1.176 -8.903
4 HA ALA 1 HA ALA 1 3.663 -0.383 -6.894
5 HB1 ALA 1 HB1 ALA 1 1.897 1.331 -7.089
6 HB2 ALA 1 HB2 ALA 1 0.631 0.082 -7.002
7 HB3 ALA 1 HB3 ALA 1 1.656 0.414 -5.584
8 H THR 2 H THR 2 3.024 -1.397 -4.675
9 HA THR 2 HA THR 2 2.163 -4.203 -5.219
10 HB THR 2 HB THR 2 4.610 -3.997 -4.730
11 HG1 THR 2 HG1 THR 2 4.543 -5.699 -3.254
12 HG21 THR 2 HG21 THR 2 5.325 -3.468 -2.428
13 HG22 THR 2 HG22 THR 2 3.662 -3.035 -1.986
14 HG23 THR 2 HG23 THR 2 4.553 -2.057 -3.177
15 H CYS 3 H CYS 3 1.398 -5.389 -3.379
16 HA CYS 3 HA CYS 3 -0.351 -3.725 -1.594
17 HB2 CYS 3 HB2 CYS 3 -1.362 -5.317 -3.327
18 HB3 CYS 3 HB3 CYS 3 -0.637 -6.643 -2.418
19 H ASP 4 H ASP 4 2.566 -5.197 -1.660
20 HA ASP 4 HA ASP 4 2.567 -7.058 0.483
21 HB2 ASP 4 HB2 ASP 4 4.745 -5.243 -0.620
22 HB3 ASP 4 HB3 ASP 4 5.033 -6.485 0.603
23 H LEU 5 H LEU 5 3.398 -6.956 2.543
24 HA LEU 5 HA LEU 5 3.480 -4.266 3.828
25 HB2 LEU 5 HB2 LEU 5 3.040 -5.520 5.961
26 HB3 LEU 5 HB3 LEU 5 1.697 -5.555 4.826
27 HG LEU 5 HG LEU 5 3.488 -7.854 4.482
28 HD11 LEU 5 HD11 LEU 5 2.906 -9.026 6.523
29 HD12 LEU 5 HD12 LEU 5 2.021 -7.607 7.125
30 HD13 LEU 5 HD13 LEU 5 3.787 -7.535 6.914
31 HD21 LEU 5 HD21 LEU 5 1.366 -9.073 4.525
32 HD22 LEU 5 HD22 LEU 5 1.228 -7.629 3.494
33 HD23 LEU 5 HD23 LEU 5 0.518 -7.626 5.127
34 H LEU 6 H LEU 6 5.400 -5.043 2.290
35 HA LEU 6 HA LEU 6 7.502 -6.618 3.499
36 HB2 LEU 6 HB2 LEU 6 7.268 -6.182 1.059
37 HB3 LEU 6 HB3 LEU 6 7.589 -4.476 1.339
38 HG LEU 6 HG LEU 6 9.890 -5.035 2.079
39 HD11 LEU 6 HD11 LEU 6 10.778 -7.311 1.576
40 HD12 LEU 6 HD12 LEU 6 9.117 -7.869 1.260
41 HD13 LEU 6 HD13 LEU 6 9.588 -7.319 2.890
42 HD21 LEU 6 HD21 LEU 6 10.724 -5.601 -0.170
43 HD22 LEU 6 HD22 LEU 6 9.403 -4.417 -0.251
44 HD23 LEU 6 HD23 LEU 6 9.092 -6.126 -0.651
45 H SER 7 H SER 7 6.527 -3.274 3.523
46 HA SER 7 HA SER 7 8.995 -2.303 4.690
47 HB2 SER 7 HB2 SER 7 6.300 -0.973 4.406
48 HB3 SER 7 HB3 SER 7 7.864 -0.150 4.610
49 HG SER 7 HG SER 7 8.484 -1.046 2.580
50 H GLY 8 H GLY 8 6.905 -4.129 6.211
51 HA2 GLY 8 HA2 GLY 8 6.690 -4.250 8.621
52 HA3 GLY 8 HA3 GLY 8 7.037 -2.494 8.701
53 H THR 9 H THR 9 5.341 -1.316 9.003
54 HA THR 9 HA THR 9 2.713 -2.083 9.056
55 HB THR 9 HB THR 9 2.873 -0.156 10.050
56 HG1 THR 9 HG1 THR 9 2.900 1.272 7.648
57 HG21 THR 9 HG21 THR 9 4.486 1.728 9.430
58 HG22 THR 9 HG22 THR 9 5.133 0.642 8.184
59 HG23 THR 9 HG23 THR 9 5.252 0.209 9.916
60 H GLY 10 H GLY 10 0.961 -1.237 7.950
61 HA2 GLY 10 HA2 GLY 10 -0.177 -0.876 5.821
62 HA3 GLY 10 HA3 GLY 10 1.292 -1.397 4.968
63 H VAL 11 H VAL 11 0.570 -3.214 7.745
64 HA VAL 11 HA VAL 11 0.253 -5.676 6.481
65 HB VAL 11 HB VAL 11 -0.791 -4.839 9.176
66 HG11 VAL 11 HG11 VAL 11 -0.424 -7.231 9.808
67 HG12 VAL 11 HG12 VAL 11 -1.649 -7.046 8.539
68 HG13 VAL 11 HG13 VAL 11 -0.010 -7.586 8.116
69 HG21 VAL 11 HG21 VAL 11 1.441 -5.748 10.016
70 HG22 VAL 11 HG22 VAL 11 1.988 -5.730 8.325
71 HG23 VAL 11 HG23 VAL 11 1.528 -4.219 9.130
72 H LYS 12 H LYS 12 -2.133 -3.307 7.436
73 HA LYS 12 HA LYS 12 -4.410 -4.877 6.536
74 HB2 LYS 12 HB2 LYS 12 -3.896 -1.942 7.089
75 HB3 LYS 12 HB3 LYS 12 -5.456 -2.523 6.490
76 HG2 LYS 12 HG2 LYS 12 -4.200 -3.473 9.095
77 HG3 LYS 12 HG3 LYS 12 -5.326 -2.109 8.981
78 HD2 LYS 12 HD2 LYS 12 -7.031 -3.642 7.970
79 HD3 LYS 12 HD3 LYS 12 -5.922 -5.003 8.240
80 HE2 LYS 12 HE2 LYS 12 -5.922 -4.520 10.673
81 HE3 LYS 12 HE3 LYS 12 -7.029 -3.158 10.401
82 HZ1 LYS 12 HZ1 LYS 12 -8.219 -5.134 11.116
83 HZ2 LYS 12 HZ2 LYS 12 -7.652 -6.008 9.840
84 HZ3 LYS 12 HZ3 LYS 12 -8.678 -4.742 9.582
85 H HIS 13 H HIS 13 -4.375 -5.486 4.432
86 HA HIS 13 HA HIS 13 -2.785 -4.301 2.435
87 HB2 HIS 13 HB2 HIS 13 -5.200 -6.118 2.281
88 HB3 HIS 13 HB3 HIS 13 -4.274 -5.635 0.859
89 HD1 HIS 13 HD1 HIS 13 -4.533 -8.613 2.365
90 HD2 HIS 13 HD2 HIS 13 -1.232 -6.030 2.151
91 HE1 HIS 13 HE1 HIS 13 -2.446 -10.035 2.718
92 HE2 HIS 13 HE2 HIS 13 -0.476 -8.456 2.584
93 H SER 14 H SER 14 -5.596 -2.985 3.677
94 HA SER 14 HA SER 14 -6.624 -1.616 1.413
95 HB2 SER 14 HB2 SER 14 -6.591 -0.204 4.011
96 HB3 SER 14 HB3 SER 14 -7.967 -0.606 2.955
97 HG SER 14 HG SER 14 -8.187 -1.899 4.718
98 H ALA 15 H ALA 15 -3.664 -1.353 3.034
99 HA ALA 15 HA ALA 15 -2.997 1.296 2.753
100 HB1 ALA 15 HB1 ALA 15 -1.629 -0.319 3.986
101 HB2 ALA 15 HB2 ALA 15 -1.217 -1.143 2.464
102 HB3 ALA 15 HB3 ALA 15 -0.648 0.517 2.762
103 H CYS 16 H CYS 16 -3.015 -1.283 0.340
104 HA CYS 16 HA CYS 16 -1.664 0.148 -1.714
105 HB2 CYS 16 HB2 CYS 16 -1.860 -2.072 -2.277
106 HB3 CYS 16 HB3 CYS 16 -3.445 -2.213 -1.516
107 H ALA 17 H ALA 17 -5.037 -0.097 -0.874
108 HA ALA 17 HA ALA 17 -6.015 1.480 -3.026
109 HB1 ALA 17 HB1 ALA 17 -7.486 0.011 -1.655
110 HB2 ALA 17 HB2 ALA 17 -7.244 1.095 -0.264
111 HB3 ALA 17 HB3 ALA 17 -8.092 1.682 -1.708
112 H ALA 18 H ALA 18 -4.988 2.235 0.235
113 HA ALA 18 HA ALA 18 -5.606 5.013 0.128
114 HB1 ALA 18 HB1 ALA 18 -5.212 3.781 2.245
115 HB2 ALA 18 HB2 ALA 18 -3.499 3.590 1.801
116 HB3 ALA 18 HB3 ALA 18 -4.163 5.211 2.109
117 H HIS 19 H HIS 19 -2.692 3.216 -0.776
118 HA HIS 19 HA HIS 19 -1.067 5.433 -1.178
119 HB2 HIS 19 HB2 HIS 19 -0.298 3.053 -1.134
120 HB3 HIS 19 HB3 HIS 19 -0.968 2.864 -2.760
121 HD1 HIS 19 HD1 HIS 19 1.862 4.551 -0.861
122 HD2 HIS 19 HD2 HIS 19 0.561 4.055 -4.816
123 HE1 HIS 19 HE1 HIS 19 3.747 5.371 -2.370
124 HE2 HIS 19 HE2 HIS 19 2.946 5.064 -4.747
125 H CYS 20 H CYS 20 -3.451 3.869 -3.237
126 HA CYS 20 HA CYS 20 -2.847 5.472 -5.579
127 HB2 CYS 20 HB2 CYS 20 -5.344 3.942 -4.794
128 HB3 CYS 20 HB3 CYS 20 -5.003 4.596 -6.401
129 H LEU 21 H LEU 21 -5.226 5.671 -2.897
130 HA LEU 21 HA LEU 21 -6.684 7.921 -3.846
131 HB2 LEU 21 HB2 LEU 21 -6.018 6.895 -1.095
132 HB3 LEU 21 HB3 LEU 21 -6.985 8.334 -1.317
133 HG LEU 21 HG LEU 21 -7.758 5.577 -2.279
134 HD11 LEU 21 HD11 LEU 21 -9.325 5.592 -0.372
135 HD12 LEU 21 HD12 LEU 21 -8.642 7.141 0.175
136 HD13 LEU 21 HD13 LEU 21 -7.637 5.674 0.169
137 HD21 LEU 21 HD21 LEU 21 -10.014 6.583 -2.494
138 HD22 LEU 21 HD22 LEU 21 -8.842 7.378 -3.553
139 HD23 LEU 21 HD23 LEU 21 -9.342 8.168 -2.047
140 H LEU 22 H LEU 22 -3.611 7.698 -2.076
141 HA LEU 22 HA LEU 22 -3.324 10.508 -1.578
142 HB2 LEU 22 HB2 LEU 22 -1.355 8.225 -1.790
143 HB3 LEU 22 HB3 LEU 22 -0.842 9.868 -1.435
144 HG LEU 22 HG LEU 22 -2.825 8.345 0.282
145 HD11 LEU 22 HD11 LEU 22 -0.665 7.172 0.238
146 HD12 LEU 22 HD12 LEU 22 -0.927 7.952 1.810
147 HD13 LEU 22 HD13 LEU 22 0.181 8.690 0.629
148 HD21 LEU 22 HD21 LEU 22 -2.191 10.043 1.984
149 HD22 LEU 22 HD22 LEU 22 -2.953 10.775 0.561
150 HD23 LEU 22 HD23 LEU 22 -1.189 10.868 0.769
151 H ARG 23 H ARG 23 -3.088 8.782 -4.556
152 HA ARG 23 HA ARG 23 -1.386 10.923 -5.766
153 HB2 ARG 23 HB2 ARG 23 -2.671 8.507 -7.075
154 HB3 ARG 23 HB3 ARG 23 -1.500 9.605 -7.806
155 HG2 ARG 23 HG2 ARG 23 0.074 8.822 -5.877
156 HG3 ARG 23 HG3 ARG 23 -1.066 7.462 -5.755
157 HD2 ARG 23 HD2 ARG 23 0.507 8.347 -8.197
158 HD3 ARG 23 HD3 ARG 23 0.707 6.833 -7.290
159 HE ARG 23 HE ARG 23 -1.973 6.884 -8.142
160 HH11 ARG 23 HH11 ARG 23 1.159 6.924 -9.796
161 HH12 ARG 23 HH12 ARG 23 0.506 6.170 -11.226
162 HH21 ARG 23 HH21 ARG 23 -2.716 5.944 -9.959
163 HH22 ARG 23 HH22 ARG 23 -1.661 5.617 -11.318
164 H GLY 24 H GLY 24 -4.512 10.671 -4.832
165 HA2 GLY 24 HA2 GLY 24 -6.307 12.004 -5.474
166 HA3 GLY 24 HA3 GLY 24 -5.433 12.492 -6.937
167 H ASN 25 H ASN 25 -5.439 9.083 -6.478
168 HA ASN 25 HA ASN 25 -7.324 8.769 -8.732
169 HB2 ASN 25 HB2 ASN 25 -5.895 6.677 -7.034
170 HB3 ASN 25 HB3 ASN 25 -6.858 6.347 -8.467
171 HD21 ASN 25 HD21 ASN 25 -6.056 8.269 -10.237
172 HD22 ASN 25 HD22 ASN 25 -4.351 8.073 -10.570
173 H ARG 26 H ARG 26 -9.122 7.217 -8.535
174 HA ARG 26 HA ARG 26 -10.837 7.774 -6.332
175 HB2 ARG 26 HB2 ARG 26 -10.844 5.973 -8.703
176 HB3 ARG 26 HB3 ARG 26 -11.977 5.620 -7.410
177 HG2 ARG 26 HG2 ARG 26 -12.671 7.139 -9.488
178 HG3 ARG 26 HG3 ARG 26 -13.338 7.385 -7.877
179 HD2 ARG 26 HD2 ARG 26 -12.831 9.535 -8.810
180 HD3 ARG 26 HD3 ARG 26 -11.695 9.233 -7.494
181 HE ARG 26 HE ARG 26 -10.582 8.453 -10.058
182 HH11 ARG 26 HH11 ARG 26 -11.217 11.295 -8.046
183 HH12 ARG 26 HH12 ARG 26 -9.896 12.189 -8.744
184 HH21 ARG 26 HH21 ARG 26 -8.921 9.670 -10.892
185 HH22 ARG 26 HH22 ARG 26 -8.652 11.303 -10.329
186 H GLY 27 H GLY 27 -8.306 5.433 -6.657
187 HA2 GLY 27 HA2 GLY 27 -7.873 4.657 -4.181
188 HA3 GLY 27 HA3 GLY 27 -9.427 3.808 -4.431
189 H GLY 28 H GLY 28 -7.979 1.809 -4.112
190 HA2 GLY 28 HA2 GLY 28 -7.237 0.858 -6.794
191 HA3 GLY 28 HA3 GLY 28 -5.919 0.924 -5.611
192 H TYR 29 H TYR 29 -6.480 -1.541 -6.618
193 HA TYR 29 HA TYR 29 -7.600 -2.841 -4.275
194 HB2 TYR 29 HB2 TYR 29 -8.843 -4.479 -5.572
195 HB3 TYR 29 HB3 TYR 29 -9.454 -2.852 -5.879
196 HD1 TYR 29 HD2 TYR 29 -8.991 -1.726 -8.081
197 HD2 TYR 29 HD1 TYR 29 -7.801 -5.800 -7.333
198 HE1 TYR 29 HE2 TYR 29 -8.725 -2.108 -10.531
199 HE2 TYR 29 HE1 TYR 29 -7.544 -6.163 -9.783
200 HH TYR 29 HH TYR 29 -8.225 -3.616 -12.177
201 H CYS 30 H CYS 30 -6.849 -5.170 -4.158
202 HA CYS 30 HA CYS 30 -4.126 -5.289 -5.349
203 HB2 CYS 30 HB2 CYS 30 -5.308 -6.830 -3.018
204 HB3 CYS 30 HB3 CYS 30 -3.649 -6.953 -3.616
205 H ASN 31 H ASN 31 -3.528 -6.860 -6.686
206 HA ASN 31 HA ASN 31 -5.532 -8.868 -7.582
207 HB2 ASN 31 HB2 ASN 31 -2.729 -8.067 -8.461
208 HB3 ASN 31 HB3 ASN 31 -3.465 -9.575 -9.014
209 HD21 ASN 31 HD21 ASN 31 -2.688 -7.546 -10.755
210 HD22 ASN 31 HD22 ASN 31 -4.134 -6.925 -11.510
211 H GLY 32 H GLY 32 -4.842 -11.179 -7.616
212 HA2 GLY 32 HA2 GLY 32 -3.939 -12.037 -5.057
213 HA3 GLY 32 HA3 GLY 32 -4.204 -13.059 -6.469
214 H ARG 33 H ARG 33 -1.933 -10.741 -7.315
215 HA ARG 33 HA ARG 33 0.274 -12.499 -6.612
216 HB2 ARG 33 HB2 ARG 33 0.034 -10.550 -8.908
217 HB3 ARG 33 HB3 ARG 33 1.502 -11.447 -8.505
218 HG2 ARG 33 HG2 ARG 33 0.183 -13.579 -8.820
219 HG3 ARG 33 HG3 ARG 33 -1.126 -12.581 -9.491
220 HD2 ARG 33 HD2 ARG 33 0.448 -11.689 -11.189
221 HD3 ARG 33 HD3 ARG 33 1.740 -12.703 -10.514
222 HE ARG 33 HE ARG 33 -0.474 -14.362 -11.174
223 HH11 ARG 33 HH11 ARG 33 2.043 -12.503 -12.812
224 HH12 ARG 33 HH12 ARG 33 2.021 -13.537 -14.214
225 HH21 ARG 33 HH21 ARG 33 -0.443 -15.634 -12.999
226 HH22 ARG 33 HH22 ARG 33 0.639 -15.272 -14.317
227 H ALA 34 H ALA 34 -1.093 -10.243 -5.129
228 HA ALA 34 HA ALA 34 -0.574 -8.591 -3.709
229 HB1 ALA 34 HB1 ALA 34 1.636 -8.514 -2.682
230 HB2 ALA 34 HB2 ALA 34 1.185 -10.215 -2.937
231 HB3 ALA 34 HB3 ALA 34 2.343 -9.422 -4.032
232 H ILE 35 H ILE 35 -0.645 -8.154 -6.555
233 HA ILE 35 HA ILE 35 1.090 -5.735 -6.827
234 HB ILE 35 HB ILE 35 -0.815 -6.930 -8.865
235 HG12 ILE 35 HG12 ILE 35 2.209 -7.150 -8.607
236 HG13 ILE 35 HG13 ILE 35 1.057 -8.459 -8.350
237 HG21 ILE 35 HG21 ILE 35 -0.413 -4.493 -9.223
238 HG22 ILE 35 HG22 ILE 35 1.345 -4.778 -9.184
239 HG23 ILE 35 HG23 ILE 35 0.348 -5.435 -10.502
240 HD11 ILE 35 HD11 ILE 35 1.745 -7.091 -10.945
241 HD12 ILE 35 HD12 ILE 35 2.007 -8.786 -10.489
242 HD13 ILE 35 HD13 ILE 35 0.353 -8.186 -10.759
243 H CYS 36 H CYS 36 0.224 -3.757 -6.953
244 HA CYS 36 HA CYS 36 -2.600 -3.470 -5.961
245 HB2 CYS 36 HB2 CYS 36 -0.857 -2.514 -4.502
246 HB3 CYS 36 HB3 CYS 36 -0.237 -1.573 -5.855
247 H VAL 37 H VAL 37 -4.077 -2.558 -7.303
248 HA VAL 37 HA VAL 37 -3.066 -1.353 -9.833
249 HB VAL 37 HB VAL 37 -5.554 -3.058 -9.383
250 HG11 VAL 37 HG11 VAL 37 -5.722 -2.980 -11.883
251 HG12 VAL 37 HG12 VAL 37 -5.881 -1.371 -11.154
252 HG13 VAL 37 HG13 VAL 37 -4.351 -1.851 -11.926
253 HG21 VAL 37 HG21 VAL 37 -3.596 -4.489 -9.288
254 HG22 VAL 37 HG22 VAL 37 -4.399 -4.719 -10.849
255 HG23 VAL 37 HG23 VAL 37 -2.920 -3.734 -10.754
256 H CYS 38 H CYS 38 -3.328 0.703 -9.452
257 HA CYS 38 HA CYS 38 -5.468 1.835 -7.883
258 HB2 CYS 38 HB2 CYS 38 -3.626 3.146 -9.914
259 HB3 CYS 38 HB3 CYS 38 -4.668 3.995 -8.768
260 H ARG 39 H ARG 39 -7.235 3.035 -8.582
261 HA ARG 39 HA ARG 39 -8.280 2.352 -11.254
262 HB2 ARG 39 HB2 ARG 39 -9.484 3.778 -8.847
263 HB3 ARG 39 HB3 ARG 39 -10.343 3.486 -10.367
264 HG2 ARG 39 HG2 ARG 39 -10.119 1.055 -10.046
265 HG3 ARG 39 HG3 ARG 39 -9.241 1.324 -8.529
266 HD2 ARG 39 HD2 ARG 39 -11.214 2.418 -7.554
267 HD3 ARG 39 HD3 ARG 39 -12.087 2.232 -9.085
268 HE ARG 39 HE ARG 39 -12.408 -0.035 -8.662
269 HH11 ARG 39 HH11 ARG 39 -10.267 1.268 -6.176
270 HH12 ARG 39 HH12 ARG 39 -10.379 -0.168 -5.191
271 HH21 ARG 39 HH21 ARG 39 -12.514 -1.825 -7.353
272 HH22 ARG 39 HH22 ARG 39 -11.648 -1.874 -5.843
273 H ASN 40 H ASN 40 -9.370 4.498 -12.264
274 HA ASN 40 HA ASN 40 -7.360 6.290 -12.843
275 HB2 ASN 40 HB2 ASN 40 -9.012 7.649 -13.947
276 HB3 ASN 40 HB3 ASN 40 -9.419 5.953 -14.240
277 HD21 ASN 40 HD21 ASN 40 -11.423 5.291 -13.756
278 HD22 ASN 40 HD22 ASN 40 -12.588 6.216 -12.842
Start of MODEL 3
1 H1 ALA 1 H1 ALA 1 2.870 0.074 -8.760
2 H2 ALA 1 H2 ALA 1 3.229 -1.537 -8.792
3 H3 ALA 1 H3 ALA 1 1.675 -1.047 -8.552
4 HA ALA 1 HA ALA 1 3.933 -0.593 -6.707
5 HB1 ALA 1 HB1 ALA 1 2.324 1.277 -6.591
6 HB2 ALA 1 HB2 ALA 1 0.961 0.139 -6.459
7 HB3 ALA 1 HB3 ALA 1 2.147 0.267 -5.139
8 H THR 2 H THR 2 3.265 -1.677 -4.461
9 HA THR 2 HA THR 2 2.233 -4.387 -5.173
10 HB THR 2 HB THR 2 4.680 -4.344 -4.622
11 HG1 THR 2 HG1 THR 2 4.439 -6.196 -3.461
12 HG21 THR 2 HG21 THR 2 5.361 -4.007 -2.279
13 HG22 THR 2 HG22 THR 2 3.704 -3.557 -1.828
14 HG23 THR 2 HG23 THR 2 4.652 -2.512 -2.918
15 H CYS 3 H CYS 3 1.280 -5.613 -3.519
16 HA CYS 3 HA CYS 3 -0.264 -3.994 -1.526
17 HB2 CYS 3 HB2 CYS 3 -1.472 -5.217 -3.415
18 HB3 CYS 3 HB3 CYS 3 -0.910 -6.729 -2.695
19 H ASP 4 H ASP 4 2.451 -5.834 -1.869
20 HA ASP 4 HA ASP 4 2.220 -7.908 0.059
21 HB2 ASP 4 HB2 ASP 4 4.577 -6.323 -1.005
22 HB3 ASP 4 HB3 ASP 4 4.768 -7.612 0.185
23 H LEU 5 H LEU 5 3.097 -8.157 2.092
24 HA LEU 5 HA LEU 5 3.356 -5.667 3.705
25 HB2 LEU 5 HB2 LEU 5 3.296 -7.467 5.619
26 HB3 LEU 5 HB3 LEU 5 1.812 -6.988 4.825
27 HG LEU 5 HG LEU 5 1.867 -9.051 3.439
28 HD11 LEU 5 HD11 LEU 5 3.308 -10.948 4.149
29 HD12 LEU 5 HD12 LEU 5 4.213 -9.844 5.213
30 HD13 LEU 5 HD13 LEU 5 4.252 -9.619 3.454
31 HD21 LEU 5 HD21 LEU 5 1.207 -10.564 5.249
32 HD22 LEU 5 HD22 LEU 5 0.571 -8.930 5.508
33 HD23 LEU 5 HD23 LEU 5 1.980 -9.495 6.440
34 H LEU 6 H LEU 6 5.180 -6.088 1.933
35 HA LEU 6 HA LEU 6 7.446 -7.679 2.808
36 HB2 LEU 6 HB2 LEU 6 6.964 -7.112 0.434
37 HB3 LEU 6 HB3 LEU 6 7.232 -5.413 0.791
38 HG LEU 6 HG LEU 6 9.616 -5.902 1.282
39 HD11 LEU 6 HD11 LEU 6 10.548 -8.096 0.544
40 HD12 LEU 6 HD12 LEU 6 8.890 -8.711 0.344
41 HD13 LEU 6 HD13 LEU 6 9.489 -8.247 1.956
42 HD21 LEU 6 HD21 LEU 6 10.255 -6.281 -1.070
43 HD22 LEU 6 HD22 LEU 6 8.886 -5.159 -0.945
44 HD23 LEU 6 HD23 LEU 6 8.608 -6.850 -1.433
45 H SER 7 H SER 7 6.348 -4.383 3.085
46 HA SER 7 HA SER 7 8.871 -3.395 4.138
47 HB2 SER 7 HB2 SER 7 6.146 -2.100 4.035
48 HB3 SER 7 HB3 SER 7 7.712 -1.265 4.166
49 HG SER 7 HG SER 7 6.993 -1.211 2.028
50 H GLY 8 H GLY 8 6.878 -5.326 5.651
51 HA2 GLY 8 HA2 GLY 8 6.592 -5.507 8.052
52 HA3 GLY 8 HA3 GLY 8 6.923 -3.745 8.184
53 H THR 9 H THR 9 5.185 -2.584 8.429
54 HA THR 9 HA THR 9 2.565 -3.393 8.288
55 HB THR 9 HB THR 9 2.651 -1.494 9.362
56 HG1 THR 9 HG1 THR 9 2.451 0.433 7.770
57 HG21 THR 9 HG21 THR 9 4.214 0.464 8.822
58 HG22 THR 9 HG22 THR 9 4.926 -0.575 7.570
59 HG23 THR 9 HG23 THR 9 5.021 -1.037 9.296
60 H GLY 10 H GLY 10 0.895 -2.540 7.112
61 HA2 GLY 10 HA2 GLY 10 -0.033 -2.082 4.848
62 HA3 GLY 10 HA3 GLY 10 1.401 -2.874 4.157
63 H VAL 11 H VAL 11 0.658 -4.487 6.922
64 HA VAL 11 HA VAL 11 -0.275 -6.866 5.789
65 HB VAL 11 HB VAL 11 -0.742 -5.837 8.579
66 HG11 VAL 11 HG11 VAL 11 -0.820 -8.234 9.244
67 HG12 VAL 11 HG12 VAL 11 -2.123 -7.818 8.113
68 HG13 VAL 11 HG13 VAL 11 -0.690 -8.696 7.532
69 HG21 VAL 11 HG21 VAL 11 1.335 -7.079 9.196
70 HG22 VAL 11 HG22 VAL 11 1.612 -7.417 7.477
71 HG23 VAL 11 HG23 VAL 11 1.654 -5.748 8.074
72 H LYS 12 H LYS 12 -1.975 -4.125 7.117
73 HA LYS 12 HA LYS 12 -4.596 -5.136 6.338
74 HB2 LYS 12 HB2 LYS 12 -3.487 -2.464 7.213
75 HB3 LYS 12 HB3 LYS 12 -5.180 -2.676 6.741
76 HG2 LYS 12 HG2 LYS 12 -3.818 -4.123 9.054
77 HG3 LYS 12 HG3 LYS 12 -4.825 -2.675 9.215
78 HD2 LYS 12 HD2 LYS 12 -6.747 -3.942 8.218
79 HD3 LYS 12 HD3 LYS 12 -5.738 -5.403 8.206
80 HE2 LYS 12 HE2 LYS 12 -5.455 -5.215 10.669
81 HE3 LYS 12 HE3 LYS 12 -6.498 -3.778 10.670
82 HZ1 LYS 12 HZ1 LYS 12 -7.733 -5.772 11.262
83 HZ2 LYS 12 HZ2 LYS 12 -7.338 -6.504 9.839
84 HZ3 LYS 12 HZ3 LYS 12 -8.307 -5.170 9.838
85 H HIS 13 H HIS 13 -4.535 -5.598 4.193
86 HA HIS 13 HA HIS 13 -2.904 -4.309 2.299
87 HB2 HIS 13 HB2 HIS 13 -5.349 -6.065 2.058
88 HB3 HIS 13 HB3 HIS 13 -4.483 -5.468 0.642
89 HD1 HIS 13 HD1 HIS 13 -4.535 -8.507 1.055
90 HD2 HIS 13 HD2 HIS 13 -1.533 -6.019 2.604
91 HE1 HIS 13 HE1 HIS 13 -2.473 -9.962 1.420
92 HE2 HIS 13 HE2 HIS 13 -0.680 -8.436 2.345
93 H SER 14 H SER 14 -5.619 -2.923 3.660
94 HA SER 14 HA SER 14 -6.630 -1.417 1.482
95 HB2 SER 14 HB2 SER 14 -6.506 -0.023 4.054
96 HB3 SER 14 HB3 SER 14 -7.929 -0.516 3.104
97 HG SER 14 HG SER 14 -7.933 -1.713 4.978
98 H ALA 15 H ALA 15 -3.644 -1.333 3.078
99 HA ALA 15 HA ALA 15 -2.881 1.294 2.827
100 HB1 ALA 15 HB1 ALA 15 -1.573 -0.373 4.059
101 HB2 ALA 15 HB2 ALA 15 -1.182 -1.200 2.533
102 HB3 ALA 15 HB3 ALA 15 -0.557 0.438 2.846
103 H CYS 16 H CYS 16 -2.881 -1.278 0.405
104 HA CYS 16 HA CYS 16 -1.516 0.167 -1.630
105 HB2 CYS 16 HB2 CYS 16 -1.695 -2.065 -2.192
106 HB3 CYS 16 HB3 CYS 16 -3.297 -2.207 -1.464
107 H ALA 17 H ALA 17 -4.893 -0.089 -0.811
108 HA ALA 17 HA ALA 17 -5.854 1.472 -2.977
109 HB1 ALA 17 HB1 ALA 17 -7.942 1.691 -1.672
110 HB2 ALA 17 HB2 ALA 17 -7.342 0.018 -1.621
111 HB3 ALA 17 HB3 ALA 17 -7.102 1.097 -0.225
112 H ALA 18 H ALA 18 -4.838 2.276 0.275
113 HA ALA 18 HA ALA 18 -5.481 5.048 0.133
114 HB1 ALA 18 HB1 ALA 18 -5.058 3.855 2.264
115 HB2 ALA 18 HB2 ALA 18 -3.347 3.666 1.807
116 HB3 ALA 18 HB3 ALA 18 -4.018 5.288 2.097
117 H HIS 19 H HIS 19 -2.567 3.251 -0.772
118 HA HIS 19 HA HIS 19 -0.960 5.477 -1.198
119 HB2 HIS 19 HB2 HIS 19 -0.256 3.040 -1.117
120 HB3 HIS 19 HB3 HIS 19 -0.774 2.937 -2.806
121 HD1 HIS 19 HD1 HIS 19 1.852 4.558 -0.567
122 HD2 HIS 19 HD2 HIS 19 0.985 4.138 -4.646
123 HE1 HIS 19 HE1 HIS 19 3.885 5.412 -1.848
124 HE2 HIS 19 HE2 HIS 19 3.346 5.150 -4.302
125 H CYS 20 H CYS 20 -3.433 4.009 -3.167
126 HA CYS 20 HA CYS 20 -2.781 5.568 -5.539
127 HB2 CYS 20 HB2 CYS 20 -5.235 3.959 -4.798
128 HB3 CYS 20 HB3 CYS 20 -4.896 4.635 -6.397
129 H LEU 21 H LEU 21 -5.160 5.704 -2.871
130 HA LEU 21 HA LEU 21 -6.721 7.883 -3.834
131 HB2 LEU 21 HB2 LEU 21 -5.988 6.909 -1.074
132 HB3 LEU 21 HB3 LEU 21 -7.020 8.304 -1.304
133 HG LEU 21 HG LEU 21 -7.684 5.512 -2.247
134 HD11 LEU 21 HD11 LEU 21 -8.611 7.044 0.212
135 HD12 LEU 21 HD12 LEU 21 -7.547 5.619 0.201
136 HD13 LEU 21 HD13 LEU 21 -9.233 5.466 -0.327
137 HD21 LEU 21 HD21 LEU 21 -9.979 6.420 -2.451
138 HD22 LEU 21 HD22 LEU 21 -8.850 7.268 -3.517
139 HD23 LEU 21 HD23 LEU 21 -9.374 8.033 -2.005
140 H LEU 22 H LEU 22 -3.608 7.782 -2.127
141 HA LEU 22 HA LEU 22 -3.401 10.586 -1.592
142 HB2 LEU 22 HB2 LEU 22 -1.378 8.366 -1.947
143 HB3 LEU 22 HB3 LEU 22 -0.885 10.018 -1.598
144 HG LEU 22 HG LEU 22 -2.725 8.419 0.208
145 HD11 LEU 22 HD11 LEU 22 -0.529 7.325 0.017
146 HD12 LEU 22 HD12 LEU 22 -0.732 8.066 1.615
147 HD13 LEU 22 HD13 LEU 22 0.283 8.865 0.392
148 HD21 LEU 22 HD21 LEU 22 -2.045 10.120 1.891
149 HD22 LEU 22 HD22 LEU 22 -2.915 10.839 0.527
150 HD23 LEU 22 HD23 LEU 22 -1.146 10.992 0.629
151 H ARG 23 H ARG 23 -3.392 9.038 -4.625
152 HA ARG 23 HA ARG 23 -1.768 11.257 -5.829
153 HB2 ARG 23 HB2 ARG 23 -2.821 8.748 -7.162
154 HB3 ARG 23 HB3 ARG 23 -1.680 9.914 -7.835
155 HG2 ARG 23 HG2 ARG 23 -0.146 9.230 -5.853
156 HG3 ARG 23 HG3 ARG 23 -1.234 7.830 -5.710
157 HD2 ARG 23 HD2 ARG 23 0.394 8.672 -8.126
158 HD3 ARG 23 HD3 ARG 23 0.602 7.201 -7.152
159 HE ARG 23 HE ARG 23 -2.037 7.126 -8.101
160 HH11 ARG 23 HH11 ARG 23 1.140 7.244 -9.658
161 HH12 ARG 23 HH12 ARG 23 0.562 6.428 -11.085
162 HH21 ARG 23 HH21 ARG 23 -2.688 6.111 -9.913
163 HH22 ARG 23 HH22 ARG 23 -1.578 5.788 -11.229
164 H GLY 24 H GLY 24 -4.828 10.815 -4.871
165 HA2 GLY 24 HA2 GLY 24 -6.722 11.996 -5.525
166 HA3 GLY 24 HA3 GLY 24 -5.897 12.513 -7.004
167 H ASN 25 H ASN 25 -5.618 9.140 -6.571
168 HA ASN 25 HA ASN 25 -7.516 8.657 -8.768
169 HB2 ASN 25 HB2 ASN 25 -5.937 6.704 -7.035
170 HB3 ASN 25 HB3 ASN 25 -6.901 6.268 -8.442
171 HD21 ASN 25 HD21 ASN 25 -6.262 8.173 -10.289
172 HD22 ASN 25 HD22 ASN 25 -4.554 8.082 -10.650
173 H ARG 26 H ARG 26 -9.250 7.069 -8.539
174 HA ARG 26 HA ARG 26 -10.975 7.572 -6.337
175 HB2 ARG 26 HB2 ARG 26 -10.903 5.743 -8.679
176 HB3 ARG 26 HB3 ARG 26 -12.003 5.337 -7.373
177 HG2 ARG 26 HG2 ARG 26 -12.814 6.779 -9.451
178 HG3 ARG 26 HG3 ARG 26 -13.457 7.033 -7.831
179 HD2 ARG 26 HD2 ARG 26 -13.073 9.178 -8.838
180 HD3 ARG 26 HD3 ARG 26 -11.915 8.968 -7.524
181 HE ARG 26 HE ARG 26 -10.758 8.169 -10.051
182 HH11 ARG 26 HH11 ARG 26 -11.607 11.059 -8.193
183 HH12 ARG 26 HH12 ARG 26 -10.357 12.012 -8.941
184 HH21 ARG 26 HH21 ARG 26 -9.182 9.459 -10.947
185 HH22 ARG 26 HH22 ARG 26 -9.040 11.136 -10.473
186 H GLY 27 H GLY 27 -8.336 5.357 -6.622
187 HA2 GLY 27 HA2 GLY 27 -7.866 4.647 -4.134
188 HA3 GLY 27 HA3 GLY 27 -9.371 3.710 -4.373
189 H GLY 28 H GLY 28 -7.820 1.807 -4.033
190 HA2 GLY 28 HA2 GLY 28 -6.954 0.921 -6.717
191 HA3 GLY 28 HA3 GLY 28 -5.727 0.940 -5.434
192 H TYR 29 H TYR 29 -6.316 -1.474 -6.622
193 HA TYR 29 HA TYR 29 -7.574 -2.851 -4.396
194 HB2 TYR 29 HB2 TYR 29 -8.782 -4.393 -5.867
195 HB3 TYR 29 HB3 TYR 29 -9.372 -2.740 -6.028
196 HD1 TYR 29 HD2 TYR 29 -8.915 -1.428 -8.105
197 HD2 TYR 29 HD1 TYR 29 -7.665 -5.533 -7.724
198 HE1 TYR 29 HE2 TYR 29 -8.611 -1.573 -10.575
199 HE2 TYR 29 HE1 TYR 29 -7.366 -5.662 -10.192
200 HH TYR 29 HH TYR 29 -8.051 -2.906 -12.347
201 H CYS 30 H CYS 30 -6.916 -5.198 -4.386
202 HA CYS 30 HA CYS 30 -4.148 -5.341 -5.458
203 HB2 CYS 30 HB2 CYS 30 -5.428 -6.853 -3.164
204 HB3 CYS 30 HB3 CYS 30 -3.748 -6.998 -3.703
205 H ASN 31 H ASN 31 -3.621 -6.807 -6.908
206 HA ASN 31 HA ASN 31 -5.615 -8.730 -7.909
207 HB2 ASN 31 HB2 ASN 31 -2.675 -8.199 -8.535
208 HB3 ASN 31 HB3 ASN 31 -3.586 -9.520 -9.275
209 HD21 ASN 31 HD21 ASN 31 -2.460 -7.716 -10.910
210 HD22 ASN 31 HD22 ASN 31 -3.697 -6.709 -11.621
211 H GLY 32 H GLY 32 -5.062 -11.090 -7.970
212 HA2 GLY 32 HA2 GLY 32 -4.422 -12.075 -5.379
213 HA3 GLY 32 HA3 GLY 32 -4.603 -13.039 -6.844
214 H ARG 33 H ARG 33 -2.184 -10.873 -7.523
215 HA ARG 33 HA ARG 33 -0.116 -12.684 -6.583
216 HB2 ARG 33 HB2 ARG 33 -0.102 -10.847 -8.981
217 HB3 ARG 33 HB3 ARG 33 1.306 -11.750 -8.405
218 HG2 ARG 33 HG2 ARG 33 -0.023 -13.870 -8.706
219 HG3 ARG 33 HG3 ARG 33 -1.262 -12.898 -9.528
220 HD2 ARG 33 HD2 ARG 33 0.429 -12.144 -11.168
221 HD3 ARG 33 HD3 ARG 33 1.667 -13.101 -10.330
222 HE ARG 33 HE ARG 33 -0.514 -14.797 -11.032
223 HH11 ARG 33 HH11 ARG 33 2.186 -13.115 -12.569
224 HH12 ARG 33 HH12 ARG 33 2.278 -14.266 -13.875
225 HH21 ARG 33 HH21 ARG 33 -0.331 -16.225 -12.730
226 HH22 ARG 33 HH22 ARG 33 0.878 -15.990 -13.962
227 H ALA 34 H ALA 34 -1.490 -10.328 -5.289
228 HA ALA 34 HA ALA 34 -0.989 -8.718 -3.816
229 HB1 ALA 34 HB1 ALA 34 1.120 -8.784 -2.625
230 HB2 ALA 34 HB2 ALA 34 0.609 -10.455 -2.950
231 HB3 ALA 34 HB3 ALA 34 1.890 -9.705 -3.930
232 H ILE 35 H ILE 35 -0.873 -8.229 -6.643
233 HA ILE 35 HA ILE 35 1.047 -5.938 -6.761
234 HB ILE 35 HB ILE 35 -0.844 -6.916 -8.913
235 HG12 ILE 35 HG12 ILE 35 2.120 -7.440 -8.487
236 HG13 ILE 35 HG13 ILE 35 0.829 -8.636 -8.377
237 HG21 ILE 35 HG21 ILE 35 -0.202 -4.513 -9.164
238 HG22 ILE 35 HG22 ILE 35 1.519 -4.965 -9.063
239 HG23 ILE 35 HG23 ILE 35 0.522 -5.483 -10.443
240 HD11 ILE 35 HD11 ILE 35 1.842 -7.228 -10.839
241 HD12 ILE 35 HD12 ILE 35 1.896 -8.963 -10.458
242 HD13 ILE 35 HD13 ILE 35 0.335 -8.179 -10.810
243 H CYS 36 H CYS 36 0.332 -3.897 -6.835
244 HA CYS 36 HA CYS 36 -2.490 -3.449 -5.909
245 HB2 CYS 36 HB2 CYS 36 -0.689 -2.593 -4.442
246 HB3 CYS 36 HB3 CYS 36 -0.037 -1.666 -5.791
247 H VAL 37 H VAL 37 -3.914 -2.499 -7.296
248 HA VAL 37 HA VAL 37 -2.809 -1.238 -9.750
249 HB VAL 37 HB VAL 37 -5.275 -3.001 -9.456
250 HG11 VAL 37 HG11 VAL 37 -5.344 -2.839 -11.961
251 HG12 VAL 37 HG12 VAL 37 -5.577 -1.264 -11.178
252 HG13 VAL 37 HG13 VAL 37 -4.004 -1.674 -11.905
253 HG21 VAL 37 HG21 VAL 37 -3.296 -4.400 -9.342
254 HG22 VAL 37 HG22 VAL 37 -4.032 -4.584 -10.942
255 HG23 VAL 37 HG23 VAL 37 -2.577 -3.577 -10.751
256 H CYS 38 H CYS 38 -3.166 0.792 -9.408
257 HA CYS 38 HA CYS 38 -5.321 1.868 -7.828
258 HB2 CYS 38 HB2 CYS 38 -3.564 3.220 -9.907
259 HB3 CYS 38 HB3 CYS 38 -4.607 4.043 -8.744
260 H ARG 39 H ARG 39 -7.158 2.975 -8.500
261 HA ARG 39 HA ARG 39 -8.238 2.204 -11.134
262 HB2 ARG 39 HB2 ARG 39 -9.411 3.705 -8.755
263 HB3 ARG 39 HB3 ARG 39 -10.298 3.343 -10.243
264 HG2 ARG 39 HG2 ARG 39 -10.029 0.927 -9.826
265 HG3 ARG 39 HG3 ARG 39 -9.145 1.278 -8.330
266 HD2 ARG 39 HD2 ARG 39 -11.107 2.360 -7.366
267 HD3 ARG 39 HD3 ARG 39 -11.988 2.188 -8.894
268 HE ARG 39 HE ARG 39 -12.372 -0.061 -8.458
269 HH11 ARG 39 HH11 ARG 39 -10.163 1.184 -6.005
270 HH12 ARG 39 HH12 ARG 39 -10.303 -0.241 -5.012
271 HH21 ARG 39 HH21 ARG 39 -12.520 -1.840 -7.139
272 HH22 ARG 39 HH22 ARG 39 -11.637 -1.912 -5.639
273 H ASN 40 H ASN 40 -9.399 4.267 -12.194
274 HA ASN 40 HA ASN 40 -7.485 6.135 -12.856
275 HB2 ASN 40 HB2 ASN 40 -9.250 7.400 -13.941
276 HB3 ASN 40 HB3 ASN 40 -9.502 5.677 -14.241
277 HD21 ASN 40 HD21 ASN 40 -11.458 4.876 -13.843
278 HD22 ASN 40 HD22 ASN 40 -12.697 5.662 -12.896
Start of MODEL 4
1 H1 ALA 1 H1 ALA 1 2.392 0.081 -9.235
2 H2 ALA 1 H2 ALA 1 2.889 -1.490 -9.137
3 H3 ALA 1 H3 ALA 1 1.295 -1.117 -8.935
4 HA ALA 1 HA ALA 1 3.491 -0.313 -7.136
5 HB1 ALA 1 HB1 ALA 1 1.717 1.400 -7.163
6 HB2 ALA 1 HB2 ALA 1 0.462 0.154 -6.958
7 HB3 ALA 1 HB3 ALA 1 1.612 0.487 -5.639
8 H THR 2 H THR 2 2.917 -1.274 -4.810
9 HA THR 2 HA THR 2 2.135 -4.119 -5.282
10 HB THR 2 HB THR 2 4.568 -3.862 -4.789
11 HG1 THR 2 HG1 THR 2 4.529 -5.502 -3.261
12 HG21 THR 2 HG21 THR 2 5.275 -3.213 -2.513
13 HG22 THR 2 HG22 THR 2 3.605 -2.772 -2.099
14 HG23 THR 2 HG23 THR 2 4.493 -1.850 -3.338
15 H CYS 3 H CYS 3 1.378 -5.271 -3.419
16 HA CYS 3 HA CYS 3 -0.445 -3.604 -1.715
17 HB2 CYS 3 HB2 CYS 3 -1.373 -5.294 -3.400
18 HB3 CYS 3 HB3 CYS 3 -0.599 -6.556 -2.443
19 H ASP 4 H ASP 4 2.513 -5.043 -1.688
20 HA ASP 4 HA ASP 4 2.485 -6.797 0.545
21 HB2 ASP 4 HB2 ASP 4 4.681 -5.059 -0.638
22 HB3 ASP 4 HB3 ASP 4 4.955 -6.241 0.647
23 H LEU 5 H LEU 5 3.271 -6.607 2.612
24 HA LEU 5 HA LEU 5 3.356 -3.855 3.760
25 HB2 LEU 5 HB2 LEU 5 2.803 -4.971 5.937
26 HB3 LEU 5 HB3 LEU 5 1.507 -5.075 4.748
27 HG LEU 5 HG LEU 5 3.262 -7.401 4.566
28 HD11 LEU 5 HD11 LEU 5 2.685 -8.441 6.695
29 HD12 LEU 5 HD12 LEU 5 1.893 -6.944 7.230
30 HD13 LEU 5 HD13 LEU 5 3.646 -6.969 6.952
31 HD21 LEU 5 HD21 LEU 5 1.140 -8.593 4.717
32 HD22 LEU 5 HD22 LEU 5 0.976 -7.194 3.629
33 HD23 LEU 5 HD23 LEU 5 0.317 -7.119 5.278
34 H LEU 6 H LEU 6 5.327 -4.751 2.355
35 HA LEU 6 HA LEU 6 7.357 -6.231 3.807
36 HB2 LEU 6 HB2 LEU 6 7.244 -5.992 1.314
37 HB3 LEU 6 HB3 LEU 6 7.611 -4.280 1.485
38 HG LEU 6 HG LEU 6 9.839 -4.859 2.415
39 HD11 LEU 6 HD11 LEU 6 10.665 -7.200 2.138
40 HD12 LEU 6 HD12 LEU 6 9.005 -7.721 1.765
41 HD13 LEU 6 HD13 LEU 6 9.402 -7.063 3.373
42 HD21 LEU 6 HD21 LEU 6 10.792 -5.626 0.276
43 HD22 LEU 6 HD22 LEU 6 9.528 -4.408 0.018
44 HD23 LEU 6 HD23 LEU 6 9.176 -6.130 -0.273
45 H SER 7 H SER 7 6.305 -2.941 3.519
46 HA SER 7 HA SER 7 8.641 -1.721 4.635
47 HB2 SER 7 HB2 SER 7 5.860 -0.578 4.542
48 HB3 SER 7 HB3 SER 7 7.401 0.298 4.393
49 HG SER 7 HG SER 7 6.414 0.019 2.358
50 H GLY 8 H GLY 8 6.768 -3.646 6.323
51 HA2 GLY 8 HA2 GLY 8 6.588 -3.709 8.717
52 HA3 GLY 8 HA3 GLY 8 6.937 -1.950 8.750
53 H THR 9 H THR 9 5.268 -0.777 9.105
54 HA THR 9 HA THR 9 2.632 -1.510 9.259
55 HB THR 9 HB THR 9 2.842 0.415 10.223
56 HG1 THR 9 HG1 THR 9 2.821 1.840 7.825
57 HG21 THR 9 HG21 THR 9 4.458 2.276 9.552
58 HG22 THR 9 HG22 THR 9 5.059 1.174 8.294
59 HG23 THR 9 HG23 THR 9 5.219 0.750 10.026
60 H GLY 10 H GLY 10 0.852 -0.673 8.194
61 HA2 GLY 10 HA2 GLY 10 -0.364 -0.374 6.107
62 HA3 GLY 10 HA3 GLY 10 1.104 -0.818 5.206
63 H VAL 11 H VAL 11 0.520 -2.694 7.975
64 HA VAL 11 HA VAL 11 0.438 -5.156 6.777
65 HB VAL 11 HB VAL 11 -0.845 -4.342 9.372
66 HG11 VAL 11 HG11 VAL 11 -0.399 -6.698 10.099
67 HG12 VAL 11 HG12 VAL 11 -1.583 -6.596 8.783
68 HG13 VAL 11 HG13 VAL 11 0.088 -7.085 8.436
69 HG21 VAL 11 HG21 VAL 11 1.356 -5.097 10.379
70 HG22 VAL 11 HG22 VAL 11 2.008 -5.189 8.726
71 HG23 VAL 11 HG23 VAL 11 1.469 -3.633 9.390
72 H LYS 12 H LYS 12 -2.312 -3.108 7.469
73 HA LYS 12 HA LYS 12 -4.218 -5.081 6.497
74 HB2 LYS 12 HB2 LYS 12 -4.314 -2.112 7.047
75 HB3 LYS 12 HB3 LYS 12 -5.723 -3.034 6.499
76 HG2 LYS 12 HG2 LYS 12 -4.210 -3.504 9.107
77 HG3 LYS 12 HG3 LYS 12 -5.730 -2.611 8.954
78 HD2 LYS 12 HD2 LYS 12 -6.825 -4.684 8.064
79 HD3 LYS 12 HD3 LYS 12 -5.311 -5.571 8.352
80 HE2 LYS 12 HE2 LYS 12 -5.435 -4.977 10.765
81 HE3 LYS 12 HE3 LYS 12 -6.968 -4.134 10.469
82 HZ1 LYS 12 HZ1 LYS 12 -6.502 -7.038 10.050
83 HZ2 LYS 12 HZ2 LYS 12 -7.927 -6.254 9.773
84 HZ3 LYS 12 HZ3 LYS 12 -7.336 -6.372 11.306
85 H HIS 13 H HIS 13 -4.337 -5.567 4.384
86 HA HIS 13 HA HIS 13 -2.798 -4.320 2.398
87 HB2 HIS 13 HB2 HIS 13 -5.164 -6.189 2.280
88 HB3 HIS 13 HB3 HIS 13 -4.377 -5.606 0.813
89 HD1 HIS 13 HD1 HIS 13 -4.368 -8.669 1.736
90 HD2 HIS 13 HD2 HIS 13 -1.248 -5.912 2.265
91 HE1 HIS 13 HE1 HIS 13 -2.210 -10.012 1.952
92 HE2 HIS 13 HE2 HIS 13 -0.350 -8.329 2.270
93 H SER 14 H SER 14 -5.596 -3.004 3.670
94 HA SER 14 HA SER 14 -6.645 -1.636 1.414
95 HB2 SER 14 HB2 SER 14 -6.594 -0.220 4.009
96 HB3 SER 14 HB3 SER 14 -7.977 -0.631 2.967
97 HG SER 14 HG SER 14 -8.146 -1.901 4.773
98 H ALA 15 H ALA 15 -3.675 -1.376 3.019
99 HA ALA 15 HA ALA 15 -2.995 1.267 2.717
100 HB1 ALA 15 HB1 ALA 15 -1.639 -0.375 3.947
101 HB2 ALA 15 HB2 ALA 15 -1.223 -1.180 2.416
102 HB3 ALA 15 HB3 ALA 15 -0.656 0.478 2.735
103 H CYS 16 H CYS 16 -3.096 -1.312 0.311
104 HA CYS 16 HA CYS 16 -1.707 0.075 -1.758
105 HB2 CYS 16 HB2 CYS 16 -1.961 -2.130 -2.326
106 HB3 CYS 16 HB3 CYS 16 -3.537 -2.241 -1.546
107 H ALA 17 H ALA 17 -5.081 -0.091 -0.898
108 HA ALA 17 HA ALA 17 -6.032 1.511 -3.043
109 HB1 ALA 17 HB1 ALA 17 -7.535 0.079 -1.670
110 HB2 ALA 17 HB2 ALA 17 -7.253 1.147 -0.274
111 HB3 ALA 17 HB3 ALA 17 -8.096 1.767 -1.708
112 H ALA 18 H ALA 18 -4.968 2.239 0.212
113 HA ALA 18 HA ALA 18 -5.520 5.030 0.115
114 HB1 ALA 18 HB1 ALA 18 -5.118 3.785 2.225
115 HB2 ALA 18 HB2 ALA 18 -3.416 3.560 1.753
116 HB3 ALA 18 HB3 ALA 18 -4.042 5.193 2.074
117 H HIS 19 H HIS 19 -2.664 3.166 -0.837
118 HA HIS 19 HA HIS 19 -0.982 5.338 -1.262
119 HB2 HIS 19 HB2 HIS 19 -0.348 2.887 -1.244
120 HB3 HIS 19 HB3 HIS 19 -0.955 2.807 -2.903
121 HD1 HIS 19 HD1 HIS 19 1.940 4.029 -0.825
122 HD2 HIS 19 HD2 HIS 19 0.647 4.247 -4.806
123 HE1 HIS 19 HE1 HIS 19 3.908 4.893 -2.196
124 HE2 HIS 19 HE2 HIS 19 3.110 5.020 -4.591
125 H CYS 20 H CYS 20 -3.482 3.899 -3.258
126 HA CYS 20 HA CYS 20 -2.847 5.488 -5.607
127 HB2 CYS 20 HB2 CYS 20 -5.382 4.022 -4.827
128 HB3 CYS 20 HB3 CYS 20 -5.005 4.649 -6.435
129 H LEU 21 H LEU 21 -5.201 5.679 -2.911
130 HA LEU 21 HA LEU 21 -6.646 7.959 -3.806
131 HB2 LEU 21 HB2 LEU 21 -5.962 6.877 -1.078
132 HB3 LEU 21 HB3 LEU 21 -6.938 8.317 -1.270
133 HG LEU 21 HG LEU 21 -7.701 5.571 -2.272
134 HD11 LEU 21 HD11 LEU 21 -9.257 5.547 -0.355
135 HD12 LEU 21 HD12 LEU 21 -8.579 7.091 0.212
136 HD13 LEU 21 HD13 LEU 21 -7.567 5.629 0.177
137 HD21 LEU 21 HD21 LEU 21 -9.964 6.560 -2.457
138 HD22 LEU 21 HD22 LEU 21 -8.805 7.377 -3.513
139 HD23 LEU 21 HD23 LEU 21 -9.301 8.145 -1.993
140 H LEU 22 H LEU 22 -3.544 7.673 -2.097
141 HA LEU 22 HA LEU 22 -3.222 10.460 -1.510
142 HB2 LEU 22 HB2 LEU 22 -1.304 8.148 -1.846
143 HB3 LEU 22 HB3 LEU 22 -0.729 9.773 -1.495
144 HG LEU 22 HG LEU 22 -2.678 8.285 0.292
145 HD11 LEU 22 HD11 LEU 22 -0.556 7.055 0.137
146 HD12 LEU 22 HD12 LEU 22 -0.726 7.821 1.728
147 HD13 LEU 22 HD13 LEU 22 0.350 8.542 0.507
148 HD21 LEU 22 HD21 LEU 22 -1.920 9.945 1.982
149 HD22 LEU 22 HD22 LEU 22 -2.721 10.714 0.601
150 HD23 LEU 22 HD23 LEU 22 -0.948 10.756 0.731
151 H ARG 23 H ARG 23 -3.199 8.926 -4.561
152 HA ARG 23 HA ARG 23 -1.492 11.105 -5.721
153 HB2 ARG 23 HB2 ARG 23 -2.674 8.669 -7.087
154 HB3 ARG 23 HB3 ARG 23 -1.526 9.816 -7.777
155 HG2 ARG 23 HG2 ARG 23 0.056 9.051 -5.864
156 HG3 ARG 23 HG3 ARG 23 -1.057 7.672 -5.726
157 HD2 ARG 23 HD2 ARG 23 0.489 8.561 -8.183
158 HD3 ARG 23 HD3 ARG 23 0.729 7.064 -7.257
159 HE ARG 23 HE ARG 23 -1.955 7.043 -8.097
160 HH11 ARG 23 HH11 ARG 23 1.169 7.128 -9.764
161 HH12 ARG 23 HH12 ARG 23 0.527 6.339 -11.179
162 HH21 ARG 23 HH21 ARG 23 -2.684 6.059 -9.896
163 HH22 ARG 23 HH22 ARG 23 -1.626 5.736 -11.256
164 H GLY 24 H GLY 24 -4.567 10.770 -4.751
165 HA2 GLY 24 HA2 GLY 24 -6.419 12.037 -5.356
166 HA3 GLY 24 HA3 GLY 24 -5.583 12.569 -6.824
167 H ASN 25 H ASN 25 -5.455 9.164 -6.450
168 HA ASN 25 HA ASN 25 -7.350 8.822 -8.679
169 HB2 ASN 25 HB2 ASN 25 -5.890 6.745 -6.992
170 HB3 ASN 25 HB3 ASN 25 -6.835 6.409 -8.436
171 HD21 ASN 25 HD21 ASN 25 -6.046 8.406 -10.158
172 HD22 ASN 25 HD22 ASN 25 -4.339 8.228 -10.490
173 H ARG 26 H ARG 26 -9.124 7.257 -8.506
174 HA ARG 26 HA ARG 26 -10.861 7.759 -6.309
175 HB2 ARG 26 HB2 ARG 26 -10.813 6.007 -8.704
176 HB3 ARG 26 HB3 ARG 26 -11.932 5.575 -7.423
177 HG2 ARG 26 HG2 ARG 26 -12.696 7.110 -9.452
178 HG3 ARG 26 HG3 ARG 26 -13.347 7.319 -7.829
179 HD2 ARG 26 HD2 ARG 26 -12.904 9.490 -8.760
180 HD3 ARG 26 HD3 ARG 26 -11.768 9.208 -7.441
181 HE ARG 26 HE ARG 26 -10.614 8.480 -10.000
182 HH11 ARG 26 HH11 ARG 26 -11.354 11.288 -7.976
183 HH12 ARG 26 HH12 ARG 26 -10.055 12.227 -8.658
184 HH21 ARG 26 HH21 ARG 26 -8.981 9.754 -10.812
185 HH22 ARG 26 HH22 ARG 26 -8.770 11.390 -10.236
186 H GLY 27 H GLY 27 -8.292 5.458 -6.623
187 HA2 GLY 27 HA2 GLY 27 -7.840 4.646 -4.175
188 HA3 GLY 27 HA3 GLY 27 -9.412 3.820 -4.399
189 H GLY 28 H GLY 28 -7.993 1.792 -4.121
190 HA2 GLY 28 HA2 GLY 28 -7.331 0.841 -6.821
191 HA3 GLY 28 HA3 GLY 28 -5.976 0.896 -5.680
192 H TYR 29 H TYR 29 -6.563 -1.560 -6.659
193 HA TYR 29 HA TYR 29 -7.639 -2.864 -4.295
194 HB2 TYR 29 HB2 TYR 29 -8.926 -4.483 -5.545
195 HB3 TYR 29 HB3 TYR 29 -9.512 -2.857 -5.904
196 HD1 TYR 29 HD2 TYR 29 -9.079 -1.831 -8.150
197 HD2 TYR 29 HD1 TYR 29 -7.857 -5.865 -7.251
198 HE1 TYR 29 HE2 TYR 29 -8.810 -2.302 -10.584
199 HE2 TYR 29 HE1 TYR 29 -7.597 -6.318 -9.685
200 HH TYR 29 HH TYR 29 -8.303 -3.869 -12.174
201 H CYS 30 H CYS 30 -6.875 -5.199 -4.198
202 HA CYS 30 HA CYS 30 -4.168 -5.286 -5.423
203 HB2 CYS 30 HB2 CYS 30 -5.298 -6.859 -3.089
204 HB3 CYS 30 HB3 CYS 30 -3.640 -6.942 -3.702
205 H ASN 31 H ASN 31 -3.521 -6.860 -6.726
206 HA ASN 31 HA ASN 31 -5.470 -8.907 -7.652
207 HB2 ASN 31 HB2 ASN 31 -2.610 -8.178 -8.434
208 HB3 ASN 31 HB3 ASN 31 -3.444 -9.598 -9.076
209 HD21 ASN 31 HD21 ASN 31 -2.464 -7.569 -10.702
210 HD22 ASN 31 HD22 ASN 31 -3.832 -6.788 -11.454
211 H GLY 32 H GLY 32 -4.754 -11.210 -7.640
212 HA2 GLY 32 HA2 GLY 32 -3.883 -12.026 -5.056
213 HA3 GLY 32 HA3 GLY 32 -4.114 -13.068 -6.458
214 H ARG 33 H ARG 33 -1.843 -10.745 -7.301
215 HA ARG 33 HA ARG 33 0.360 -12.457 -6.475
216 HB2 ARG 33 HB2 ARG 33 0.153 -10.700 -8.923
217 HB3 ARG 33 HB3 ARG 33 1.620 -11.546 -8.417
218 HG2 ARG 33 HG2 ARG 33 0.328 -13.709 -8.568
219 HG3 ARG 33 HG3 ARG 33 -0.981 -12.792 -9.343
220 HD2 ARG 33 HD2 ARG 33 0.595 -12.054 -11.105
221 HD3 ARG 33 HD3 ARG 33 1.899 -12.964 -10.314
222 HE ARG 33 HE ARG 33 -0.303 -14.706 -10.843
223 HH11 ARG 33 HH11 ARG 33 2.313 -13.065 -12.558
224 HH12 ARG 33 HH12 ARG 33 2.351 -14.259 -13.827
225 HH21 ARG 33 HH21 ARG 33 -0.194 -16.187 -12.500
226 HH22 ARG 33 HH22 ARG 33 0.956 -15.989 -13.794
227 H ALA 34 H ALA 34 -1.009 -10.196 -5.117
228 HA ALA 34 HA ALA 34 -0.508 -8.503 -3.735
229 HB1 ALA 34 HB1 ALA 34 1.717 -8.358 -2.745
230 HB2 ALA 34 HB2 ALA 34 1.297 -10.072 -2.959
231 HB3 ALA 34 HB3 ALA 34 2.422 -9.278 -4.089
232 H ILE 35 H ILE 35 -0.611 -8.125 -6.590
233 HA ILE 35 HA ILE 35 1.057 -5.670 -6.927
234 HB ILE 35 HB ILE 35 -0.878 -6.916 -8.902
235 HG12 ILE 35 HG12 ILE 35 2.150 -7.120 -8.701
236 HG13 ILE 35 HG13 ILE 35 1.003 -8.433 -8.424
237 HG21 ILE 35 HG21 ILE 35 -0.504 -4.478 -9.295
238 HG22 ILE 35 HG22 ILE 35 1.256 -4.750 -9.301
239 HG23 ILE 35 HG23 ILE 35 0.229 -5.430 -10.584
240 HD11 ILE 35 HD11 ILE 35 1.650 -7.069 -11.029
241 HD12 ILE 35 HD12 ILE 35 1.920 -8.764 -10.575
242 HD13 ILE 35 HD13 ILE 35 0.262 -8.163 -10.821
243 H CYS 36 H CYS 36 0.149 -3.707 -7.043
244 HA CYS 36 HA CYS 36 -2.678 -3.476 -6.039
245 HB2 CYS 36 HB2 CYS 36 -0.966 -2.511 -4.559
246 HB3 CYS 36 HB3 CYS 36 -0.347 -1.543 -5.894
247 H VAL 37 H VAL 37 -4.165 -2.573 -7.363
248 HA VAL 37 HA VAL 37 -3.185 -1.366 -9.905
249 HB VAL 37 HB VAL 37 -5.697 -3.024 -9.410
250 HG11 VAL 37 HG11 VAL 37 -5.904 -2.959 -11.904
251 HG12 VAL 37 HG12 VAL 37 -6.013 -1.339 -11.186
252 HG13 VAL 37 HG13 VAL 37 -4.508 -1.863 -11.979
253 HG21 VAL 37 HG21 VAL 37 -3.756 -4.483 -9.331
254 HG22 VAL 37 HG22 VAL 37 -4.605 -4.722 -10.867
255 HG23 VAL 37 HG23 VAL 37 -3.105 -3.762 -10.825
256 H CYS 38 H CYS 38 -3.389 0.699 -9.487
257 HA CYS 38 HA CYS 38 -5.516 1.862 -7.917
258 HB2 CYS 38 HB2 CYS 38 -3.619 3.149 -9.912
259 HB3 CYS 38 HB3 CYS 38 -4.657 4.014 -8.776
260 H ARG 39 H ARG 39 -7.254 3.098 -8.604
261 HA ARG 39 HA ARG 39 -8.296 2.506 -11.299
262 HB2 ARG 39 HB2 ARG 39 -9.446 3.943 -8.873
263 HB3 ARG 39 HB3 ARG 39 -10.309 3.738 -10.406
264 HG2 ARG 39 HG2 ARG 39 -10.236 1.299 -10.147
265 HG3 ARG 39 HG3 ARG 39 -9.342 1.470 -8.626
266 HD2 ARG 39 HD2 ARG 39 -11.235 2.650 -7.607
267 HD3 ARG 39 HD3 ARG 39 -12.118 2.589 -9.144
268 HE ARG 39 HE ARG 39 -12.617 0.345 -8.806
269 HH11 ARG 39 HH11 ARG 39 -10.355 1.363 -6.291
270 HH12 ARG 39 HH12 ARG 39 -10.575 -0.101 -5.368
271 HH21 ARG 39 HH21 ARG 39 -12.851 -1.485 -7.577
272 HH22 ARG 39 HH22 ARG 39 -11.978 -1.674 -6.082
273 H ASN 40 H ASN 40 -9.300 4.682 -12.296
274 HA ASN 40 HA ASN 40 -7.253 6.466 -12.785
275 HB2 ASN 40 HB2 ASN 40 -8.880 7.862 -13.913
276 HB3 ASN 40 HB3 ASN 40 -9.221 6.169 -14.286
277 HD21 ASN 40 HD21 ASN 40 -11.258 5.537 -14.088
278 HD22 ASN 40 HD22 ASN 40 -12.486 6.348 -13.147
Start of MODEL 5
1 H1 ALA 1 H1 ALA 1 2.569 0.668 -8.746
2 H2 ALA 1 H2 ALA 1 3.096 -0.897 -8.764
3 H3 ALA 1 H3 ALA 1 1.485 -0.573 -8.639
4 HA ALA 1 HA ALA 1 3.539 0.075 -6.623
5 HB1 ALA 1 HB1 ALA 1 1.744 1.775 -6.612
6 HB2 ALA 1 HB2 ALA 1 0.496 0.504 -6.596
7 HB3 ALA 1 HB3 ALA 1 1.562 0.726 -5.186
8 H THR 2 H THR 2 2.927 -1.123 -4.475
9 HA THR 2 HA THR 2 2.104 -3.892 -5.236
10 HB THR 2 HB THR 2 4.553 -3.692 -4.742
11 HG1 THR 2 HG1 THR 2 4.509 -5.493 -3.355
12 HG21 THR 2 HG21 THR 2 5.269 -3.341 -2.407
13 HG22 THR 2 HG22 THR 2 3.602 -2.959 -1.929
14 HG23 THR 2 HG23 THR 2 4.483 -1.883 -3.042
15 H CYS 3 H CYS 3 1.408 -5.214 -3.412
16 HA CYS 3 HA CYS 3 -0.403 -3.671 -1.581
17 HB2 CYS 3 HB2 CYS 3 -1.327 -5.271 -3.374
18 HB3 CYS 3 HB3 CYS 3 -0.572 -6.575 -2.457
19 H ASP 4 H ASP 4 2.556 -5.103 -1.725
20 HA ASP 4 HA ASP 4 2.609 -6.949 0.440
21 HB2 ASP 4 HB2 ASP 4 4.773 -5.121 -0.675
22 HB3 ASP 4 HB3 ASP 4 5.062 -6.408 0.502
23 H LEU 5 H LEU 5 3.382 -6.772 2.526
24 HA LEU 5 HA LEU 5 3.346 -4.036 3.715
25 HB2 LEU 5 HB2 LEU 5 3.074 -5.285 5.890
26 HB3 LEU 5 HB3 LEU 5 1.710 -5.428 4.786
27 HG LEU 5 HG LEU 5 3.625 -7.610 4.411
28 HD11 LEU 5 HD11 LEU 5 3.211 -8.788 6.489
29 HD12 LEU 5 HD12 LEU 5 2.268 -7.418 7.116
30 HD13 LEU 5 HD13 LEU 5 4.013 -7.239 6.823
31 HD21 LEU 5 HD21 LEU 5 1.589 -8.963 4.554
32 HD22 LEU 5 HD22 LEU 5 1.302 -7.541 3.525
33 HD23 LEU 5 HD23 LEU 5 0.676 -7.572 5.190
34 H LEU 6 H LEU 6 5.314 -4.676 2.171
35 HA LEU 6 HA LEU 6 7.585 -5.926 3.479
36 HB2 LEU 6 HB2 LEU 6 7.282 -5.777 1.008
37 HB3 LEU 6 HB3 LEU 6 7.428 -4.026 1.108
38 HG LEU 6 HG LEU 6 9.774 -4.263 1.861
39 HD11 LEU 6 HD11 LEU 6 10.896 -6.477 1.598
40 HD12 LEU 6 HD12 LEU 6 9.300 -7.236 1.378
41 HD13 LEU 6 HD13 LEU 6 9.723 -6.459 2.925
42 HD21 LEU 6 HD21 LEU 6 10.655 -4.987 -0.324
43 HD22 LEU 6 HD22 LEU 6 9.216 -3.966 -0.516
44 HD23 LEU 6 HD23 LEU 6 9.086 -5.730 -0.719
45 H SER 7 H SER 7 6.171 -2.763 3.238
46 HA SER 7 HA SER 7 8.497 -1.341 4.214
47 HB2 SER 7 HB2 SER 7 5.615 -0.469 3.965
48 HB3 SER 7 HB3 SER 7 7.033 0.601 4.054
49 HG SER 7 HG SER 7 7.738 -0.385 2.069
50 H GLY 8 H GLY 8 6.769 -3.350 5.948
51 HA2 GLY 8 HA2 GLY 8 6.661 -3.367 8.356
52 HA3 GLY 8 HA3 GLY 8 6.798 -1.578 8.336
53 H THR 9 H THR 9 4.995 -0.604 8.685
54 HA THR 9 HA THR 9 2.463 -1.658 8.854
55 HB THR 9 HB THR 9 2.452 0.305 9.797
56 HG1 THR 9 HG1 THR 9 1.932 2.112 8.170
57 HG21 THR 9 HG21 THR 9 3.790 2.349 9.036
58 HG22 THR 9 HG22 THR 9 4.494 1.307 7.783
59 HG23 THR 9 HG23 THR 9 4.762 0.951 9.516
60 H GLY 10 H GLY 10 0.611 -1.036 7.769
61 HA2 GLY 10 HA2 GLY 10 -0.588 -0.826 5.660
62 HA3 GLY 10 HA3 GLY 10 0.903 -1.224 4.787
63 H VAL 11 H VAL 11 0.354 -3.098 7.580
64 HA VAL 11 HA VAL 11 0.254 -5.567 6.311
65 HB VAL 11 HB VAL 11 -0.889 -4.831 8.992
66 HG11 VAL 11 HG11 VAL 11 -0.332 -7.186 9.623
67 HG12 VAL 11 HG12 VAL 11 -1.552 -7.101 8.337
68 HG13 VAL 11 HG13 VAL 11 0.133 -7.499 7.935
69 HG21 VAL 11 HG21 VAL 11 1.402 -5.554 9.854
70 HG22 VAL 11 HG22 VAL 11 1.963 -5.484 8.170
71 HG23 VAL 11 HG23 VAL 11 1.369 -4.019 8.974
72 H LYS 12 H LYS 12 -2.375 -3.462 7.285
73 HA LYS 12 HA LYS 12 -4.436 -5.250 6.271
74 HB2 LYS 12 HB2 LYS 12 -4.292 -2.336 7.056
75 HB3 LYS 12 HB3 LYS 12 -5.756 -3.029 6.343
76 HG2 LYS 12 HG2 LYS 12 -4.482 -4.054 8.910
77 HG3 LYS 12 HG3 LYS 12 -5.772 -2.841 8.861
78 HD2 LYS 12 HD2 LYS 12 -7.229 -4.479 7.649
79 HD3 LYS 12 HD3 LYS 12 -5.959 -5.707 7.839
80 HE2 LYS 12 HE2 LYS 12 -6.099 -5.463 10.305
81 HE3 LYS 12 HE3 LYS 12 -7.372 -4.243 10.110
82 HZ1 LYS 12 HZ1 LYS 12 -8.301 -6.421 10.590
83 HZ2 LYS 12 HZ2 LYS 12 -7.578 -7.083 9.264
84 HZ3 LYS 12 HZ3 LYS 12 -8.760 -5.948 9.078
85 H HIS 13 H HIS 13 -4.513 -5.659 4.152
86 HA HIS 13 HA HIS 13 -2.953 -4.356 2.222
87 HB2 HIS 13 HB2 HIS 13 -5.359 -6.175 2.009
88 HB3 HIS 13 HB3 HIS 13 -4.478 -5.606 0.592
89 HD1 HIS 13 HD1 HIS 13 -4.563 -8.661 1.297
90 HD2 HIS 13 HD2 HIS 13 -1.486 -6.030 2.408
91 HE1 HIS 13 HE1 HIS 13 -2.476 -10.074 1.695
92 HE2 HIS 13 HE2 HIS 13 -0.641 -8.466 2.362
93 H SER 14 H SER 14 -5.739 -3.051 3.528
94 HA SER 14 HA SER 14 -6.767 -1.613 1.304
95 HB2 SER 14 HB2 SER 14 -6.717 -0.277 3.945
96 HB3 SER 14 HB3 SER 14 -8.096 -0.624 2.875
97 HG SER 14 HG SER 14 -8.311 -1.953 4.629
98 H ALA 15 H ALA 15 -3.814 -1.406 2.952
99 HA ALA 15 HA ALA 15 -3.137 1.248 2.713
100 HB1 ALA 15 HB1 ALA 15 -1.823 -0.394 3.950
101 HB2 ALA 15 HB2 ALA 15 -1.361 -1.186 2.427
102 HB3 ALA 15 HB3 ALA 15 -0.806 0.468 2.775
103 H CYS 16 H CYS 16 -3.145 -1.304 0.276
104 HA CYS 16 HA CYS 16 -1.697 0.121 -1.726
105 HB2 CYS 16 HB2 CYS 16 -1.895 -2.065 -2.360
106 HB3 CYS 16 HB3 CYS 16 -3.466 -2.239 -1.576
107 H ALA 17 H ALA 17 -5.089 -0.090 -0.950
108 HA ALA 17 HA ALA 17 -6.017 1.536 -3.083
109 HB1 ALA 17 HB1 ALA 17 -7.515 0.064 -1.726
110 HB2 ALA 17 HB2 ALA 17 -7.289 1.159 -0.342
111 HB3 ALA 17 HB3 ALA 17 -8.106 1.738 -1.804
112 H ALA 18 H ALA 18 -5.003 2.236 0.194
113 HA ALA 18 HA ALA 18 -5.585 5.022 0.114
114 HB1 ALA 18 HB1 ALA 18 -5.202 3.763 2.219
115 HB2 ALA 18 HB2 ALA 18 -3.490 3.564 1.772
116 HB3 ALA 18 HB3 ALA 18 -4.142 5.186 2.097
117 H HIS 19 H HIS 19 -2.686 3.199 -0.789
118 HA HIS 19 HA HIS 19 -1.064 5.422 -1.194
119 HB2 HIS 19 HB2 HIS 19 -0.353 2.986 -1.121
120 HB3 HIS 19 HB3 HIS 19 -0.870 2.889 -2.811
121 HD1 HIS 19 HD1 HIS 19 1.859 4.227 -0.576
122 HD2 HIS 19 HD2 HIS 19 0.778 4.390 -4.622
123 HE1 HIS 19 HE1 HIS 19 3.855 5.190 -1.841
124 HE2 HIS 19 HE2 HIS 19 3.186 5.282 -4.272
125 H CYS 20 H CYS 20 -3.457 3.864 -3.243
126 HA CYS 20 HA CYS 20 -2.825 5.440 -5.598
127 HB2 CYS 20 HB2 CYS 20 -5.330 3.931 -4.808
128 HB3 CYS 20 HB3 CYS 20 -5.009 4.604 -6.409
129 H LEU 21 H LEU 21 -5.182 5.681 -2.906
130 HA LEU 21 HA LEU 21 -6.629 7.938 -3.852
131 HB2 LEU 21 HB2 LEU 21 -5.947 6.904 -1.109
132 HB3 LEU 21 HB3 LEU 21 -6.876 8.370 -1.310
133 HG LEU 21 HG LEU 21 -7.743 5.641 -2.274
134 HD11 LEU 21 HD11 LEU 21 -9.273 5.686 -0.334
135 HD12 LEU 21 HD12 LEU 21 -8.533 7.208 0.212
136 HD13 LEU 21 HD13 LEU 21 -7.575 5.713 0.173
137 HD21 LEU 21 HD21 LEU 21 -9.975 6.709 -2.430
138 HD22 LEU 21 HD22 LEU 21 -8.804 7.478 -3.509
139 HD23 LEU 21 HD23 LEU 21 -9.248 8.273 -1.988
140 H LEU 22 H LEU 22 -3.543 7.695 -2.103
141 HA LEU 22 HA LEU 22 -3.208 10.497 -1.617
142 HB2 LEU 22 HB2 LEU 22 -1.257 8.205 -1.908
143 HB3 LEU 22 HB3 LEU 22 -0.732 9.844 -1.550
144 HG LEU 22 HG LEU 22 -2.650 8.289 0.211
145 HD11 LEU 22 HD11 LEU 22 -0.467 7.155 0.081
146 HD12 LEU 22 HD12 LEU 22 -0.706 7.900 1.674
147 HD13 LEU 22 HD13 LEU 22 0.359 8.681 0.480
148 HD21 LEU 22 HD21 LEU 22 -1.984 9.980 1.910
149 HD22 LEU 22 HD22 LEU 22 -2.805 10.712 0.520
150 HD23 LEU 22 HD23 LEU 22 -1.037 10.832 0.669
151 H ARG 23 H ARG 23 -2.928 8.698 -4.588
152 HA ARG 23 HA ARG 23 -1.273 10.827 -5.847
153 HB2 ARG 23 HB2 ARG 23 -2.642 8.446 -7.132
154 HB3 ARG 23 HB3 ARG 23 -1.436 9.500 -7.869
155 HG2 ARG 23 HG2 ARG 23 0.113 8.664 -5.938
156 HG3 ARG 23 HG3 ARG 23 -1.075 7.348 -5.817
157 HD2 ARG 23 HD2 ARG 23 0.564 8.158 -8.235
158 HD3 ARG 23 HD3 ARG 23 0.651 6.626 -7.342
159 HE ARG 23 HE ARG 23 -2.000 6.827 -8.226
160 HH11 ARG 23 HH11 ARG 23 1.131 6.799 -9.880
161 HH12 ARG 23 HH12 ARG 23 0.447 6.128 -11.337
162 HH21 ARG 23 HH21 ARG 23 -2.780 5.988 -10.076
163 HH22 ARG 23 HH22 ARG 23 -1.738 5.668 -11.447
164 H GLY 24 H GLY 24 -4.406 10.633 -4.883
165 HA2 GLY 24 HA2 GLY 24 -6.169 12.019 -5.509
166 HA3 GLY 24 HA3 GLY 24 -5.298 12.478 -6.981
167 H ASN 25 H ASN 25 -5.423 9.070 -6.476
168 HA ASN 25 HA ASN 25 -7.355 8.799 -8.707
169 HB2 ASN 25 HB2 ASN 25 -5.884 6.686 -7.074
170 HB3 ASN 25 HB3 ASN 25 -6.906 6.369 -8.470
171 HD21 ASN 25 HD21 ASN 25 -6.183 8.241 -10.291
172 HD22 ASN 25 HD22 ASN 25 -4.491 8.058 -10.685
173 H ARG 26 H ARG 26 -9.154 7.239 -8.468
174 HA ARG 26 HA ARG 26 -10.822 7.802 -6.230
175 HB2 ARG 26 HB2 ARG 26 -10.875 6.036 -8.610
176 HB3 ARG 26 HB3 ARG 26 -11.936 5.600 -7.283
177 HG2 ARG 26 HG2 ARG 26 -12.810 7.115 -9.270
178 HG3 ARG 26 HG3 ARG 26 -13.369 7.353 -7.617
179 HD2 ARG 26 HD2 ARG 26 -12.957 9.504 -8.639
180 HD3 ARG 26 HD3 ARG 26 -11.792 9.242 -7.340
181 HE ARG 26 HE ARG 26 -10.809 8.494 -10.005
182 HH11 ARG 26 HH11 ARG 26 -11.095 11.147 -7.675
183 HH12 ARG 26 HH12 ARG 26 -9.719 11.986 -8.339
184 HH21 ARG 26 HH21 ARG 26 -9.069 9.644 -10.783
185 HH22 ARG 26 HH22 ARG 26 -8.630 11.176 -10.061
186 H GLY 27 H GLY 27 -8.312 5.436 -6.608
187 HA2 GLY 27 HA2 GLY 27 -7.837 4.641 -4.141
188 HA3 GLY 27 HA3 GLY 27 -9.409 3.816 -4.369
189 H GLY 28 H GLY 28 -7.990 1.789 -4.107
190 HA2 GLY 28 HA2 GLY 28 -7.315 0.856 -6.811
191 HA3 GLY 28 HA3 GLY 28 -5.962 0.911 -5.667
192 H TYR 29 H TYR 29 -6.525 -1.545 -6.648
193 HA TYR 29 HA TYR 29 -7.610 -2.856 -4.293
194 HB2 TYR 29 HB2 TYR 29 -8.851 -4.506 -5.582
195 HB3 TYR 29 HB3 TYR 29 -9.486 -2.884 -5.866
196 HD1 TYR 29 HD2 TYR 29 -9.102 -1.747 -8.068
197 HD2 TYR 29 HD1 TYR 29 -7.794 -5.792 -7.369
198 HE1 TYR 29 HE2 TYR 29 -8.875 -2.106 -10.524
199 HE2 TYR 29 HE1 TYR 29 -7.577 -6.135 -9.825
200 HH TYR 29 HH TYR 29 -8.360 -3.587 -12.190
201 H CYS 30 H CYS 30 -6.830 -5.181 -4.193
202 HA CYS 30 HA CYS 30 -4.116 -5.251 -5.406
203 HB2 CYS 30 HB2 CYS 30 -5.266 -6.845 -3.096
204 HB3 CYS 30 HB3 CYS 30 -3.606 -6.934 -3.702
205 H ASN 31 H ASN 31 -3.504 -6.784 -6.777
206 HA ASN 31 HA ASN 31 -5.472 -8.796 -7.718
207 HB2 ASN 31 HB2 ASN 31 -2.633 -8.017 -8.502
208 HB3 ASN 31 HB3 ASN 31 -3.381 -9.501 -9.103
209 HD21 ASN 31 HD21 ASN 31 -2.548 -7.630 -10.881
210 HD22 ASN 31 HD22 ASN 31 -3.946 -6.895 -11.625
211 H GLY 32 H GLY 32 -4.784 -11.113 -7.747
212 HA2 GLY 32 HA2 GLY 32 -3.985 -11.985 -5.160
213 HA3 GLY 32 HA3 GLY 32 -4.195 -13.000 -6.585
214 H ARG 33 H ARG 33 -1.886 -10.693 -7.342
215 HA ARG 33 HA ARG 33 0.287 -12.447 -6.528
216 HB2 ARG 33 HB2 ARG 33 0.143 -10.562 -8.885
217 HB3 ARG 33 HB3 ARG 33 1.587 -11.467 -8.405
218 HG2 ARG 33 HG2 ARG 33 0.244 -13.589 -8.690
219 HG3 ARG 33 HG3 ARG 33 -1.030 -12.599 -9.431
220 HD2 ARG 33 HD2 ARG 33 0.597 -11.799 -11.123
221 HD3 ARG 33 HD3 ARG 33 1.853 -12.810 -10.377
222 HE ARG 33 HE ARG 33 -0.372 -14.458 -11.005
223 HH11 ARG 33 HH11 ARG 33 2.180 -12.697 -12.696
224 HH12 ARG 33 HH12 ARG 33 2.158 -13.786 -14.055
225 HH21 ARG 33 HH21 ARG 33 -0.339 -15.806 -12.775
226 HH22 ARG 33 HH22 ARG 33 0.757 -15.511 -14.097
227 H ALA 34 H ALA 34 -1.125 -10.164 -5.162
228 HA ALA 34 HA ALA 34 -0.651 -8.519 -3.717
229 HB1 ALA 34 HB1 ALA 34 1.517 -8.455 -2.604
230 HB2 ALA 34 HB2 ALA 34 1.071 -10.153 -2.886
231 HB3 ALA 34 HB3 ALA 34 2.274 -9.358 -3.930
232 H ILE 35 H ILE 35 -0.609 -8.067 -6.561
233 HA ILE 35 HA ILE 35 1.130 -5.640 -6.740
234 HB ILE 35 HB ILE 35 -0.668 -6.837 -8.875
235 HG12 ILE 35 HG12 ILE 35 2.335 -7.072 -8.445
236 HG13 ILE 35 HG13 ILE 35 1.160 -8.376 -8.274
237 HG21 ILE 35 HG21 ILE 35 -0.242 -4.398 -9.209
238 HG22 ILE 35 HG22 ILE 35 1.511 -4.682 -9.068
239 HG23 ILE 35 HG23 ILE 35 0.593 -5.338 -10.443
240 HD11 ILE 35 HD11 ILE 35 2.021 -6.990 -10.806
241 HD12 ILE 35 HD12 ILE 35 2.234 -8.694 -10.352
242 HD13 ILE 35 HD13 ILE 35 0.607 -8.070 -10.719
243 H CYS 36 H CYS 36 0.237 -3.639 -6.936
244 HA CYS 36 HA CYS 36 -2.605 -3.415 -5.994
245 HB2 CYS 36 HB2 CYS 36 -0.873 -2.380 -4.561
246 HB3 CYS 36 HB3 CYS 36 -0.321 -1.421 -5.935
247 H VAL 37 H VAL 37 -4.113 -2.540 -7.334
248 HA VAL 37 HA VAL 37 -3.146 -1.360 -9.891
249 HB VAL 37 HB VAL 37 -5.622 -3.065 -9.383
250 HG11 VAL 37 HG11 VAL 37 -5.818 -3.027 -11.883
251 HG12 VAL 37 HG12 VAL 37 -5.977 -1.409 -11.174
252 HG13 VAL 37 HG13 VAL 37 -4.453 -1.892 -11.955
253 HG21 VAL 37 HG21 VAL 37 -3.656 -4.488 -9.290
254 HG22 VAL 37 HG22 VAL 37 -4.491 -4.752 -10.831
255 HG23 VAL 37 HG23 VAL 37 -3.010 -3.762 -10.786
256 H CYS 38 H CYS 38 -3.412 0.705 -9.520
257 HA CYS 38 HA CYS 38 -5.522 1.826 -7.904
258 HB2 CYS 38 HB2 CYS 38 -3.731 3.149 -9.973
259 HB3 CYS 38 HB3 CYS 38 -4.753 3.992 -8.803
260 H ARG 39 H ARG 39 -7.302 3.033 -8.559
261 HA ARG 39 HA ARG 39 -8.420 2.338 -11.200
262 HB2 ARG 39 HB2 ARG 39 -9.571 3.758 -8.763
263 HB3 ARG 39 HB3 ARG 39 -10.466 3.456 -10.261
264 HG2 ARG 39 HG2 ARG 39 -10.195 1.022 -9.940
265 HG3 ARG 39 HG3 ARG 39 -9.309 1.316 -8.433
266 HD2 ARG 39 HD2 ARG 39 -11.280 2.359 -7.430
267 HD3 ARG 39 HD3 ARG 39 -12.164 2.210 -8.959
268 HE ARG 39 HE ARG 39 -12.488 -0.065 -8.585
269 HH11 ARG 39 HH11 ARG 39 -10.330 1.180 -6.085
270 HH12 ARG 39 HH12 ARG 39 -10.438 -0.276 -5.130
271 HH21 ARG 39 HH21 ARG 39 -12.590 -1.881 -7.315
272 HH22 ARG 39 HH22 ARG 39 -11.715 -1.967 -5.812
273 H ASN 40 H ASN 40 -9.565 4.461 -12.169
274 HA ASN 40 HA ASN 40 -7.610 6.265 -12.872
275 HB2 ASN 40 HB2 ASN 40 -9.364 7.633 -13.837
276 HB3 ASN 40 HB3 ASN 40 -9.726 5.930 -14.144
277 HD21 ASN 40 HD21 ASN 40 -11.701 5.238 -13.654
278 HD22 ASN 40 HD22 ASN 40 -12.839 6.071 -12.626
Start of MODEL 6
1 H1 ALA 1 H1 ALA 1 2.864 0.076 -8.816
2 H2 ALA 1 H2 ALA 1 3.226 -1.534 -8.815
3 H3 ALA 1 H3 ALA 1 1.673 -1.042 -8.569
4 HA ALA 1 HA ALA 1 3.947 -0.536 -6.757
5 HB1 ALA 1 HB1 ALA 1 0.974 0.185 -6.497
6 HB2 ALA 1 HB2 ALA 1 2.173 0.350 -5.192
7 HB3 ALA 1 HB3 ALA 1 2.328 1.327 -6.670
8 H THR 2 H THR 2 3.313 -1.568 -4.485
9 HA THR 2 HA THR 2 2.346 -4.321 -5.116
10 HB THR 2 HB THR 2 4.765 -4.191 -4.473
11 HG1 THR 2 HG1 THR 2 4.537 -5.976 -3.206
12 HG21 THR 2 HG21 THR 2 5.349 -3.708 -2.124
13 HG22 THR 2 HG22 THR 2 3.667 -3.261 -1.769
14 HG23 THR 2 HG23 THR 2 4.643 -2.268 -2.883
15 H CYS 3 H CYS 3 1.365 -5.508 -3.435
16 HA CYS 3 HA CYS 3 -0.285 -3.841 -1.569
17 HB2 CYS 3 HB2 CYS 3 -1.399 -5.203 -3.427
18 HB3 CYS 3 HB3 CYS 3 -0.820 -6.649 -2.593
19 H ASP 4 H ASP 4 2.499 -5.570 -1.678
20 HA ASP 4 HA ASP 4 2.229 -7.591 0.299
21 HB2 ASP 4 HB2 ASP 4 4.585 -5.970 -0.707
22 HB3 ASP 4 HB3 ASP 4 4.761 -7.207 0.544
23 H LEU 5 H LEU 5 2.952 -7.759 2.388
24 HA LEU 5 HA LEU 5 3.247 -5.203 3.905
25 HB2 LEU 5 HB2 LEU 5 2.396 -6.514 5.872
26 HB3 LEU 5 HB3 LEU 5 1.194 -6.311 4.603
27 HG LEU 5 HG LEU 5 2.743 -8.806 4.337
28 HD11 LEU 5 HD11 LEU 5 1.700 -9.990 6.172
29 HD12 LEU 5 HD12 LEU 5 0.888 -8.507 6.718
30 HD13 LEU 5 HD13 LEU 5 2.662 -8.639 6.805
31 HD21 LEU 5 HD21 LEU 5 0.513 -9.746 3.975
32 HD22 LEU 5 HD22 LEU 5 0.729 -8.262 3.019
33 HD23 LEU 5 HD23 LEU 5 -0.240 -8.222 4.513
34 H LEU 6 H LEU 6 5.197 -6.162 2.516
35 HA LEU 6 HA LEU 6 6.887 -8.045 3.954
36 HB2 LEU 6 HB2 LEU 6 6.890 -7.762 1.472
37 HB3 LEU 6 HB3 LEU 6 7.509 -6.127 1.679
38 HG LEU 6 HG LEU 6 9.599 -7.046 2.650
39 HD11 LEU 6 HD11 LEU 6 10.074 -9.480 2.357
40 HD12 LEU 6 HD12 LEU 6 8.365 -9.742 1.933
41 HD13 LEU 6 HD13 LEU 6 8.811 -9.171 3.562
42 HD21 LEU 6 HD21 LEU 6 10.480 -7.919 0.520
43 HD22 LEU 6 HD22 LEU 6 9.417 -6.523 0.254
44 HD23 LEU 6 HD23 LEU 6 8.820 -8.168 -0.072
45 H SER 7 H SER 7 6.451 -4.606 3.678
46 HA SER 7 HA SER 7 8.947 -3.928 4.999
47 HB2 SER 7 HB2 SER 7 6.557 -2.207 4.347
48 HB3 SER 7 HB3 SER 7 8.235 -1.661 4.570
49 HG SER 7 HG SER 7 7.822 -1.800 2.373
50 H GLY 8 H GLY 8 6.452 -5.259 6.408
51 HA2 GLY 8 HA2 GLY 8 5.972 -5.016 8.801
52 HA3 GLY 8 HA3 GLY 8 6.392 -3.284 8.656
53 H THR 9 H THR 9 4.729 -2.017 8.550
54 HA THR 9 HA THR 9 2.088 -2.724 8.443
55 HB THR 9 HB THR 9 2.224 -0.655 9.146
56 HG1 THR 9 HG1 THR 9 2.193 0.967 7.262
57 HG21 THR 9 HG21 THR 9 4.633 -0.197 7.346
58 HG22 THR 9 HG22 THR 9 4.625 -0.354 9.130
59 HG23 THR 9 HG23 THR 9 3.932 1.082 8.362
60 H GLY 10 H GLY 10 0.478 -2.031 7.075
61 HA2 GLY 10 HA2 GLY 10 -0.422 -1.922 4.800
62 HA3 GLY 10 HA3 GLY 10 1.041 -2.733 4.204
63 H VAL 11 H VAL 11 0.148 -4.049 7.131
64 HA VAL 11 HA VAL 11 -0.518 -6.586 6.206
65 HB VAL 11 HB VAL 11 -1.350 -5.290 8.790
66 HG11 VAL 11 HG11 VAL 11 -1.324 -7.603 9.720
67 HG12 VAL 11 HG12 VAL 11 -2.530 -7.420 8.432
68 HG13 VAL 11 HG13 VAL 11 -0.986 -8.234 8.094
69 HG21 VAL 11 HG21 VAL 11 0.739 -6.322 9.738
70 HG22 VAL 11 HG22 VAL 11 1.227 -6.744 8.085
71 HG23 VAL 11 HG23 VAL 11 1.056 -5.044 8.556
72 H LYS 12 H LYS 12 -2.589 -3.910 7.117
73 HA LYS 12 HA LYS 12 -4.969 -5.260 6.104
74 HB2 LYS 12 HB2 LYS 12 -4.297 -2.491 7.088
75 HB3 LYS 12 HB3 LYS 12 -5.869 -2.856 6.360
76 HG2 LYS 12 HG2 LYS 12 -4.754 -4.207 8.855
77 HG3 LYS 12 HG3 LYS 12 -5.902 -2.859 8.860
78 HD2 LYS 12 HD2 LYS 12 -7.522 -4.278 7.569
79 HD3 LYS 12 HD3 LYS 12 -6.393 -5.643 7.714
80 HE2 LYS 12 HE2 LYS 12 -6.520 -5.468 10.192
81 HE3 LYS 12 HE3 LYS 12 -7.679 -4.135 10.030
82 HZ1 LYS 12 HZ1 LYS 12 -8.802 -6.242 10.418
83 HZ2 LYS 12 HZ2 LYS 12 -8.121 -6.913 9.075
84 HZ3 LYS 12 HZ3 LYS 12 -9.199 -5.673 8.922
85 H HIS 13 H HIS 13 -4.917 -5.610 3.970
86 HA HIS 13 HA HIS 13 -3.160 -4.325 2.180
87 HB2 HIS 13 HB2 HIS 13 -5.625 -6.028 1.793
88 HB3 HIS 13 HB3 HIS 13 -4.690 -5.414 0.429
89 HD1 HIS 13 HD1 HIS 13 -4.783 -8.441 0.695
90 HD2 HIS 13 HD2 HIS 13 -1.857 -6.079 2.563
91 HE1 HIS 13 HE1 HIS 13 -2.772 -9.946 1.132
92 HE2 HIS 13 HE2 HIS 13 -1.029 -8.500 2.254
93 H SER 14 H SER 14 -5.907 -2.913 3.446
94 HA SER 14 HA SER 14 -6.805 -1.370 1.246
95 HB2 SER 14 HB2 SER 14 -6.709 -0.182 3.978
96 HB3 SER 14 HB3 SER 14 -8.058 -0.251 2.820
97 HG SER 14 HG SER 14 -8.568 -1.702 4.385
98 H ALA 15 H ALA 15 -3.871 -1.340 2.941
99 HA ALA 15 HA ALA 15 -3.084 1.288 2.752
100 HB1 ALA 15 HB1 ALA 15 -1.839 -0.382 4.011
101 HB2 ALA 15 HB2 ALA 15 -1.407 -1.218 2.499
102 HB3 ALA 15 HB3 ALA 15 -0.775 0.415 2.830
103 H CYS 16 H CYS 16 -3.044 -1.266 0.313
104 HA CYS 16 HA CYS 16 -1.589 0.162 -1.674
105 HB2 CYS 16 HB2 CYS 16 -1.777 -2.051 -2.266
106 HB3 CYS 16 HB3 CYS 16 -3.391 -2.189 -1.567
107 H ALA 17 H ALA 17 -4.990 -0.064 -0.954
108 HA ALA 17 HA ALA 17 -5.886 1.543 -3.113
109 HB1 ALA 17 HB1 ALA 17 -7.408 0.080 -1.788
110 HB2 ALA 17 HB2 ALA 17 -7.204 1.166 -0.393
111 HB3 ALA 17 HB3 ALA 17 -7.999 1.756 -1.865
112 H ALA 18 H ALA 18 -4.931 2.286 0.172
113 HA ALA 18 HA ALA 18 -5.531 5.065 0.064
114 HB1 ALA 18 HB1 ALA 18 -5.162 3.825 2.181
115 HB2 ALA 18 HB2 ALA 18 -3.443 3.636 1.755
116 HB3 ALA 18 HB3 ALA 18 -4.112 5.257 2.060
117 H HIS 19 H HIS 19 -2.624 3.252 -0.822
118 HA HIS 19 HA HIS 19 -0.986 5.464 -1.206
119 HB2 HIS 19 HB2 HIS 19 -0.299 3.024 -1.158
120 HB3 HIS 19 HB3 HIS 19 -0.827 2.941 -2.845
121 HD1 HIS 19 HD1 HIS 19 1.861 4.428 -0.608
122 HD2 HIS 19 HD2 HIS 19 0.896 4.231 -4.682
123 HE1 HIS 19 HE1 HIS 19 3.884 5.303 -1.893
124 HE2 HIS 19 HE2 HIS 19 3.284 5.178 -4.343
125 H CYS 20 H CYS 20 -3.429 3.999 -3.240
126 HA CYS 20 HA CYS 20 -2.766 5.601 -5.577
127 HB2 CYS 20 HB2 CYS 20 -5.264 4.038 -4.875
128 HB3 CYS 20 HB3 CYS 20 -4.869 4.691 -6.470
129 H LEU 21 H LEU 21 -5.160 5.714 -2.921
130 HA LEU 21 HA LEU 21 -6.684 7.935 -3.831
131 HB2 LEU 21 HB2 LEU 21 -5.982 6.853 -1.114
132 HB3 LEU 21 HB3 LEU 21 -6.959 8.294 -1.275
133 HG LEU 21 HG LEU 21 -7.730 5.565 -2.315
134 HD11 LEU 21 HD11 LEU 21 -9.270 5.511 -0.381
135 HD12 LEU 21 HD12 LEU 21 -8.575 7.037 0.210
136 HD13 LEU 21 HD13 LEU 21 -7.575 5.570 0.131
137 HD21 LEU 21 HD21 LEU 21 -9.996 6.554 -2.456
138 HD22 LEU 21 HD22 LEU 21 -8.851 7.399 -3.505
139 HD23 LEU 21 HD23 LEU 21 -9.332 8.130 -1.964
140 H LEU 22 H LEU 22 -3.582 7.764 -2.110
141 HA LEU 22 HA LEU 22 -3.352 10.560 -1.532
142 HB2 LEU 22 HB2 LEU 22 -1.351 8.321 -1.876
143 HB3 LEU 22 HB3 LEU 22 -0.842 9.963 -1.510
144 HG LEU 22 HG LEU 22 -2.727 8.381 0.262
145 HD11 LEU 22 HD11 LEU 22 -0.547 7.251 0.096
146 HD12 LEU 22 HD12 LEU 22 -0.759 7.990 1.695
147 HD13 LEU 22 HD13 LEU 22 0.284 8.777 0.487
148 HD21 LEU 22 HD21 LEU 22 -2.047 10.060 1.965
149 HD22 LEU 22 HD22 LEU 22 -2.883 10.802 0.591
150 HD23 LEU 22 HD23 LEU 22 -1.114 10.925 0.722
151 H ARG 23 H ARG 23 -3.284 9.022 -4.580
152 HA ARG 23 HA ARG 23 -1.642 11.246 -5.746
153 HB2 ARG 23 HB2 ARG 23 -2.740 8.771 -7.111
154 HB3 ARG 23 HB3 ARG 23 -1.603 9.941 -7.786
155 HG2 ARG 23 HG2 ARG 23 -0.038 9.218 -5.845
156 HG3 ARG 23 HG3 ARG 23 -1.128 7.819 -5.708
157 HD2 ARG 23 HD2 ARG 23 0.451 8.704 -8.143
158 HD3 ARG 23 HD3 ARG 23 0.685 7.219 -7.199
159 HE ARG 23 HE ARG 23 -1.980 7.167 -8.100
160 HH11 ARG 23 HH11 ARG 23 1.183 7.250 -9.689
161 HH12 ARG 23 HH12 ARG 23 0.582 6.437 -11.109
162 HH21 ARG 23 HH21 ARG 23 -2.658 6.156 -9.904
163 HH22 ARG 23 HH22 ARG 23 -1.565 5.820 -11.231
164 H GLY 24 H GLY 24 -4.717 10.802 -4.799
165 HA2 GLY 24 HA2 GLY 24 -6.598 12.020 -5.426
166 HA3 GLY 24 HA3 GLY 24 -5.771 12.555 -6.898
167 H ASN 25 H ASN 25 -5.535 9.163 -6.504
168 HA ASN 25 HA ASN 25 -7.453 8.739 -8.703
169 HB2 ASN 25 HB2 ASN 25 -5.882 6.738 -7.023
170 HB3 ASN 25 HB3 ASN 25 -6.857 6.343 -8.431
171 HD21 ASN 25 HD21 ASN 25 -6.215 8.246 -10.256
172 HD22 ASN 25 HD22 ASN 25 -4.508 8.159 -10.623
173 H ARG 26 H ARG 26 -9.190 7.133 -8.471
174 HA ARG 26 HA ARG 26 -10.873 7.642 -6.231
175 HB2 ARG 26 HB2 ARG 26 -10.889 5.873 -8.619
176 HB3 ARG 26 HB3 ARG 26 -11.969 5.454 -7.303
177 HG2 ARG 26 HG2 ARG 26 -12.803 6.965 -9.314
178 HG3 ARG 26 HG3 ARG 26 -13.392 7.201 -7.672
179 HD2 ARG 26 HD2 ARG 26 -12.977 9.356 -8.652
180 HD3 ARG 26 HD3 ARG 26 -11.794 9.090 -7.370
181 HE ARG 26 HE ARG 26 -10.715 8.305 -9.934
182 HH11 ARG 26 HH11 ARG 26 -11.457 11.188 -8.020
183 HH12 ARG 26 HH12 ARG 26 -10.201 12.122 -8.783
184 HH21 ARG 26 HH21 ARG 26 -9.131 9.570 -10.848
185 HH22 ARG 26 HH22 ARG 26 -8.939 11.237 -10.356
186 H GLY 27 H GLY 27 -8.286 5.365 -6.597
187 HA2 GLY 27 HA2 GLY 27 -7.853 4.554 -4.123
188 HA3 GLY 27 HA3 GLY 27 -9.381 3.665 -4.419
189 H GLY 28 H GLY 28 -7.902 1.703 -4.153
190 HA2 GLY 28 HA2 GLY 28 -7.059 0.867 -6.841
191 HA3 GLY 28 HA3 GLY 28 -5.783 0.901 -5.606
192 H TYR 29 H TYR 29 -6.351 -1.543 -6.721
193 HA TYR 29 HA TYR 29 -7.560 -2.888 -4.446
194 HB2 TYR 29 HB2 TYR 29 -8.856 -4.411 -5.760
195 HB3 TYR 29 HB3 TYR 29 -9.333 -2.769 -6.198
196 HD1 TYR 29 HD2 TYR 29 -8.674 -1.828 -8.433
197 HD2 TYR 29 HD1 TYR 29 -7.749 -5.894 -7.348
198 HE1 TYR 29 HE2 TYR 29 -8.264 -2.384 -10.829
199 HE2 TYR 29 HE1 TYR 29 -7.322 -6.426 -9.742
200 HH TYR 29 HH TYR 29 -7.717 -4.017 -12.336
201 H CYS 30 H CYS 30 -6.868 -5.231 -4.393
202 HA CYS 30 HA CYS 30 -4.107 -5.344 -5.486
203 HB2 CYS 30 HB2 CYS 30 -5.336 -6.827 -3.149
204 HB3 CYS 30 HB3 CYS 30 -3.657 -6.948 -3.698
205 H ASN 31 H ASN 31 -3.490 -6.871 -6.827
206 HA ASN 31 HA ASN 31 -5.399 -8.916 -7.775
207 HB2 ASN 31 HB2 ASN 31 -2.451 -8.342 -8.338
208 HB3 ASN 31 HB3 ASN 31 -3.320 -9.711 -9.042
209 HD21 ASN 31 HD21 ASN 31 -2.057 -7.542 -10.445
210 HD22 ASN 31 HD22 ASN 31 -3.327 -6.762 -11.354
211 H GLY 32 H GLY 32 -4.841 -11.244 -7.591
212 HA2 GLY 32 HA2 GLY 32 -4.043 -11.995 -4.947
213 HA3 GLY 32 HA3 GLY 32 -4.308 -13.085 -6.312
214 H ARG 33 H ARG 33 -2.038 -10.905 -7.331
215 HA ARG 33 HA ARG 33 0.172 -12.625 -6.558
216 HB2 ARG 33 HB2 ARG 33 -0.079 -10.732 -8.902
217 HB3 ARG 33 HB3 ARG 33 1.361 -11.685 -8.519
218 HG2 ARG 33 HG2 ARG 33 0.011 -13.768 -8.774
219 HG3 ARG 33 HG3 ARG 33 -1.366 -12.774 -9.293
220 HD2 ARG 33 HD2 ARG 33 0.006 -11.887 -11.162
221 HD3 ARG 33 HD3 ARG 33 1.348 -12.936 -10.653
222 HE ARG 33 HE ARG 33 -0.957 -14.550 -11.001
223 HH11 ARG 33 HH11 ARG 33 1.289 -12.704 -13.008
224 HH12 ARG 33 HH12 ARG 33 1.027 -13.724 -14.396
225 HH21 ARG 33 HH21 ARG 33 -1.235 -15.805 -12.815
226 HH22 ARG 33 HH22 ARG 33 -0.378 -15.443 -14.287
227 H ALA 34 H ALA 34 -1.177 -10.285 -5.177
228 HA ALA 34 HA ALA 34 -0.626 -8.649 -3.750
229 HB1 ALA 34 HB1 ALA 34 1.561 -8.635 -2.701
230 HB2 ALA 34 HB2 ALA 34 1.081 -10.323 -2.975
231 HB3 ALA 34 HB3 ALA 34 2.270 -9.546 -4.047
232 H ILE 35 H ILE 35 -0.665 -8.196 -6.591
233 HA ILE 35 HA ILE 35 1.140 -5.823 -6.823
234 HB ILE 35 HB ILE 35 -0.786 -6.924 -8.881
235 HG12 ILE 35 HG12 ILE 35 2.215 -7.303 -8.584
236 HG13 ILE 35 HG13 ILE 35 0.988 -8.554 -8.377
237 HG21 ILE 35 HG21 ILE 35 -0.269 -4.504 -9.211
238 HG22 ILE 35 HG22 ILE 35 1.473 -4.867 -9.155
239 HG23 ILE 35 HG23 ILE 35 0.463 -5.464 -10.492
240 HD11 ILE 35 HD11 ILE 35 0.349 -8.189 -10.790
241 HD12 ILE 35 HD12 ILE 35 1.803 -7.169 -10.923
242 HD13 ILE 35 HD13 ILE 35 1.961 -8.887 -10.502
243 H CYS 36 H CYS 36 0.350 -3.822 -6.905
244 HA CYS 36 HA CYS 36 -2.473 -3.440 -5.948
245 HB2 CYS 36 HB2 CYS 36 -0.691 -2.525 -4.496
246 HB3 CYS 36 HB3 CYS 36 -0.058 -1.603 -5.859
247 H VAL 37 H VAL 37 -3.923 -2.542 -7.334
248 HA VAL 37 HA VAL 37 -2.862 -1.318 -9.833
249 HB VAL 37 HB VAL 37 -5.347 -3.042 -9.449
250 HG11 VAL 37 HG11 VAL 37 -5.475 -2.945 -11.949
251 HG12 VAL 37 HG12 VAL 37 -5.645 -1.339 -11.215
252 HG13 VAL 37 HG13 VAL 37 -4.102 -1.816 -11.963
253 HG21 VAL 37 HG21 VAL 37 -3.376 -4.457 -9.327
254 HG22 VAL 37 HG22 VAL 37 -4.163 -4.692 -10.896
255 HG23 VAL 37 HG23 VAL 37 -2.690 -3.697 -10.787
256 H CYS 38 H CYS 38 -3.153 0.741 -9.442
257 HA CYS 38 HA CYS 38 -5.294 1.852 -7.876
258 HB2 CYS 38 HB2 CYS 38 -3.492 3.167 -9.938
259 HB3 CYS 38 HB3 CYS 38 -4.550 4.019 -8.810
260 H ARG 39 H ARG 39 -7.082 3.042 -8.539
261 HA ARG 39 HA ARG 39 -8.198 2.279 -11.160
262 HB2 ARG 39 HB2 ARG 39 -9.370 3.676 -8.723
263 HB3 ARG 39 HB3 ARG 39 -10.283 3.288 -10.191
264 HG2 ARG 39 HG2 ARG 39 -9.974 0.902 -9.816
265 HG3 ARG 39 HG3 ARG 39 -8.912 1.214 -8.433
266 HD2 ARG 39 HD2 ARG 39 -10.763 2.265 -7.217
267 HD3 ARG 39 HD3 ARG 39 -11.844 1.971 -8.598
268 HE ARG 39 HE ARG 39 -10.694 -0.505 -7.916
269 HH11 ARG 39 HH11 ARG 39 -12.858 1.811 -6.358
270 HH12 ARG 39 HH12 ARG 39 -13.672 0.571 -5.443
271 HH21 ARG 39 HH21 ARG 39 -11.775 -2.027 -6.715
272 HH22 ARG 39 HH22 ARG 39 -13.055 -1.559 -5.630
273 H ASN 40 H ASN 40 -9.430 4.357 -12.138
274 HA ASN 40 HA ASN 40 -7.535 6.235 -12.819
275 HB2 ASN 40 HB2 ASN 40 -9.304 7.508 -13.857
276 HB3 ASN 40 HB3 ASN 40 -9.621 5.790 -14.132
277 HD21 ASN 40 HD21 ASN 40 -11.557 5.003 -13.559
278 HD22 ASN 40 HD22 ASN 40 -12.742 5.863 -12.607
Start of MODEL 7
1 H1 ALA 1 H1 ALA 1 2.431 0.145 -9.226
2 H2 ALA 1 H2 ALA 1 2.932 -1.426 -9.130
3 H3 ALA 1 H3 ALA 1 1.331 -1.061 -8.976
4 HA ALA 1 HA ALA 1 3.464 -0.273 -7.096
5 HB1 ALA 1 HB1 ALA 1 1.683 1.435 -7.170
6 HB2 ALA 1 HB2 ALA 1 0.430 0.182 -7.004
7 HB3 ALA 1 HB3 ALA 1 1.544 0.514 -5.654
8 H THR 2 H THR 2 2.848 -1.274 -4.808
9 HA THR 2 HA THR 2 2.017 -4.093 -5.341
10 HB THR 2 HB THR 2 4.462 -3.890 -4.877
11 HG1 THR 2 HG1 THR 2 4.392 -5.617 -3.462
12 HG21 THR 2 HG21 THR 2 5.207 -3.355 -2.591
13 HG22 THR 2 HG22 THR 2 3.548 -2.928 -2.122
14 HG23 THR 2 HG23 THR 2 4.420 -1.944 -3.324
15 H CYS 3 H CYS 3 1.220 -5.280 -3.561
16 HA CYS 3 HA CYS 3 -0.481 -3.650 -1.707
17 HB2 CYS 3 HB2 CYS 3 -1.549 -5.145 -3.482
18 HB3 CYS 3 HB3 CYS 3 -0.821 -6.523 -2.658
19 H ASP 4 H ASP 4 2.397 -5.232 -1.874
20 HA ASP 4 HA ASP 4 2.357 -7.181 0.173
21 HB2 ASP 4 HB2 ASP 4 4.567 -5.375 -0.871
22 HB3 ASP 4 HB3 ASP 4 4.840 -6.642 0.329
23 H LEU 5 H LEU 5 3.174 -7.237 2.227
24 HA LEU 5 HA LEU 5 3.204 -4.666 3.733
25 HB2 LEU 5 HB2 LEU 5 3.157 -6.204 5.747
26 HB3 LEU 5 HB3 LEU 5 1.709 -6.266 4.752
27 HG LEU 5 HG LEU 5 3.664 -8.282 3.925
28 HD11 LEU 5 HD11 LEU 5 3.524 -9.740 5.839
29 HD12 LEU 5 HD12 LEU 5 2.543 -8.560 6.731
30 HD13 LEU 5 HD13 LEU 5 4.241 -8.196 6.342
31 HD21 LEU 5 HD21 LEU 5 1.698 -9.740 4.074
32 HD22 LEU 5 HD22 LEU 5 1.282 -8.221 3.255
33 HD23 LEU 5 HD23 LEU 5 0.798 -8.476 4.949
34 H LEU 6 H LEU 6 5.057 -5.012 1.974
35 HA LEU 6 HA LEU 6 7.447 -6.410 2.847
36 HB2 LEU 6 HB2 LEU 6 6.924 -5.841 0.481
37 HB3 LEU 6 HB3 LEU 6 7.047 -4.131 0.867
38 HG LEU 6 HG LEU 6 9.462 -4.420 1.343
39 HD11 LEU 6 HD11 LEU 6 8.983 -7.266 0.361
40 HD12 LEU 6 HD12 LEU 6 9.541 -6.776 1.981
41 HD13 LEU 6 HD13 LEU 6 10.580 -6.511 0.570
42 HD21 LEU 6 HD21 LEU 6 10.120 -4.703 -1.018
43 HD22 LEU 6 HD22 LEU 6 8.654 -3.712 -0.870
44 HD23 LEU 6 HD23 LEU 6 8.529 -5.413 -1.381
45 H SER 7 H SER 7 6.083 -3.228 3.209
46 HA SER 7 HA SER 7 8.543 -2.042 4.226
47 HB2 SER 7 HB2 SER 7 5.712 -0.997 4.146
48 HB3 SER 7 HB3 SER 7 7.187 -0.018 4.317
49 HG SER 7 HG SER 7 7.798 -0.821 2.217
50 H GLY 8 H GLY 8 6.760 -4.137 5.782
51 HA2 GLY 8 HA2 GLY 8 6.597 -4.319 8.211
52 HA3 GLY 8 HA3 GLY 8 6.694 -2.526 8.306
53 H THR 9 H THR 9 4.790 -1.596 8.564
54 HA THR 9 HA THR 9 2.311 -2.771 8.430
55 HB THR 9 HB THR 9 2.112 -0.855 9.448
56 HG1 THR 9 HG1 THR 9 1.916 0.874 7.410
57 HG21 THR 9 HG21 THR 9 3.402 1.287 8.891
58 HG22 THR 9 HG22 THR 9 4.276 0.330 7.675
59 HG23 THR 9 HG23 THR 9 4.399 -0.078 9.412
60 H GLY 10 H GLY 10 0.553 -2.206 7.213
61 HA2 GLY 10 HA2 GLY 10 -0.345 -1.836 4.902
62 HA3 GLY 10 HA3 GLY 10 1.160 -2.542 4.275
63 H VAL 11 H VAL 11 0.393 -4.135 7.072
64 HA VAL 11 HA VAL 11 -0.351 -6.587 5.924
65 HB VAL 11 HB VAL 11 -0.969 -5.575 8.688
66 HG11 VAL 11 HG11 VAL 11 -0.876 -7.971 9.356
67 HG12 VAL 11 HG12 VAL 11 -2.159 -7.672 8.167
68 HG13 VAL 11 HG13 VAL 11 -0.629 -8.420 7.653
69 HG21 VAL 11 HG21 VAL 11 1.188 -6.704 9.350
70 HG22 VAL 11 HG22 VAL 11 1.547 -6.892 7.623
71 HG23 VAL 11 HG23 VAL 11 1.406 -5.272 8.329
72 H LYS 12 H LYS 12 -2.194 -3.899 7.164
73 HA LYS 12 HA LYS 12 -4.767 -4.991 6.343
74 HB2 LYS 12 HB2 LYS 12 -3.727 -2.258 7.131
75 HB3 LYS 12 HB3 LYS 12 -5.395 -2.510 6.593
76 HG2 LYS 12 HG2 LYS 12 -4.163 -3.893 9.011
77 HG3 LYS 12 HG3 LYS 12 -5.083 -2.381 9.092
78 HD2 LYS 12 HD2 LYS 12 -7.049 -3.556 8.076
79 HD3 LYS 12 HD3 LYS 12 -6.134 -5.078 8.136
80 HE2 LYS 12 HE2 LYS 12 -5.915 -4.844 10.599
81 HE3 LYS 12 HE3 LYS 12 -6.843 -3.332 10.533
82 HZ1 LYS 12 HZ1 LYS 12 -8.735 -4.601 9.695
83 HZ2 LYS 12 HZ2 LYS 12 -8.243 -5.203 11.148
84 HZ3 LYS 12 HZ3 LYS 12 -7.875 -6.007 9.758
85 H HIS 13 H HIS 13 -4.631 -5.537 4.206
86 HA HIS 13 HA HIS 13 -2.975 -4.264 2.312
87 HB2 HIS 13 HB2 HIS 13 -5.379 -6.077 2.035
88 HB3 HIS 13 HB3 HIS 13 -4.424 -5.537 0.653
89 HD1 HIS 13 HD1 HIS 13 -4.666 -8.589 1.823
90 HD2 HIS 13 HD2 HIS 13 -1.437 -5.937 2.228
91 HE1 HIS 13 HE1 HIS 13 -2.586 -10.002 2.244
92 HE2 HIS 13 HE2 HIS 13 -0.660 -8.382 2.483
93 H SER 14 H SER 14 -5.746 -2.917 3.586
94 HA SER 14 HA SER 14 -6.760 -1.476 1.365
95 HB2 SER 14 HB2 SER 14 -6.667 -0.011 3.893
96 HB3 SER 14 HB3 SER 14 -8.081 -0.570 2.965
97 HG SER 14 HG SER 14 -8.049 -1.696 4.882
98 H ALA 15 H ALA 15 -3.787 -1.333 2.979
99 HA ALA 15 HA ALA 15 -3.021 1.286 2.681
100 HB1 ALA 15 HB1 ALA 15 -1.721 -0.346 3.939
101 HB2 ALA 15 HB2 ALA 15 -1.337 -1.221 2.437
102 HB3 ALA 15 HB3 ALA 15 -0.703 0.421 2.701
103 H CYS 16 H CYS 16 -3.131 -1.300 0.280
104 HA CYS 16 HA CYS 16 -1.687 0.070 -1.765
105 HB2 CYS 16 HB2 CYS 16 -1.934 -2.120 -2.368
106 HB3 CYS 16 HB3 CYS 16 -3.497 -2.255 -1.567
107 H ALA 17 H ALA 17 -5.071 -0.076 -0.950
108 HA ALA 17 HA ALA 17 -5.983 1.546 -3.095
109 HB1 ALA 17 HB1 ALA 17 -7.511 0.114 -1.748
110 HB2 ALA 17 HB2 ALA 17 -7.245 1.178 -0.347
111 HB3 ALA 17 HB3 ALA 17 -8.063 1.803 -1.790
112 H ALA 18 H ALA 18 -4.935 2.255 0.169
113 HA ALA 18 HA ALA 18 -5.478 5.049 0.078
114 HB1 ALA 18 HB1 ALA 18 -5.091 3.795 2.185
115 HB2 ALA 18 HB2 ALA 18 -3.387 3.570 1.722
116 HB3 ALA 18 HB3 ALA 18 -4.013 5.204 2.044
117 H HIS 19 H HIS 19 -2.631 3.173 -0.864
118 HA HIS 19 HA HIS 19 -0.943 5.340 -1.282
119 HB2 HIS 19 HB2 HIS 19 -0.336 2.871 -1.260
120 HB3 HIS 19 HB3 HIS 19 -0.890 2.823 -2.939
121 HD1 HIS 19 HD1 HIS 19 1.947 3.981 -0.749
122 HD2 HIS 19 HD2 HIS 19 0.779 4.291 -4.763
123 HE1 HIS 19 HE1 HIS 19 3.959 4.870 -2.043
124 HE2 HIS 19 HE2 HIS 19 3.237 5.051 -4.455
125 H CYS 20 H CYS 20 -3.449 3.915 -3.280
126 HA CYS 20 HA CYS 20 -2.809 5.506 -5.628
127 HB2 CYS 20 HB2 CYS 20 -5.334 4.023 -4.851
128 HB3 CYS 20 HB3 CYS 20 -4.973 4.672 -6.454
129 H LEU 21 H LEU 21 -5.142 5.698 -2.917
130 HA LEU 21 HA LEU 21 -6.612 7.964 -3.806
131 HB2 LEU 21 HB2 LEU 21 -5.896 6.872 -1.095
132 HB3 LEU 21 HB3 LEU 21 -6.839 8.337 -1.251
133 HG LEU 21 HG LEU 21 -7.695 5.625 -2.267
134 HD11 LEU 21 HD11 LEU 21 -8.468 7.129 0.261
135 HD12 LEU 21 HD12 LEU 21 -7.506 5.637 0.178
136 HD13 LEU 21 HD13 LEU 21 -9.208 5.618 -0.313
137 HD21 LEU 21 HD21 LEU 21 -8.783 7.482 -3.452
138 HD22 LEU 21 HD22 LEU 21 -9.223 8.232 -1.908
139 HD23 LEU 21 HD23 LEU 21 -9.936 6.673 -2.384
140 H LEU 22 H LEU 22 -3.499 7.704 -2.115
141 HA LEU 22 HA LEU 22 -3.185 10.501 -1.568
142 HB2 LEU 22 HB2 LEU 22 -1.247 8.199 -1.875
143 HB3 LEU 22 HB3 LEU 22 -0.701 9.831 -1.509
144 HG LEU 22 HG LEU 22 -2.655 8.311 0.242
145 HD11 LEU 22 HD11 LEU 22 -0.513 7.110 0.115
146 HD12 LEU 22 HD12 LEU 22 -0.720 7.868 1.707
147 HD13 LEU 22 HD13 LEU 22 0.363 8.610 0.506
148 HD21 LEU 22 HD21 LEU 22 -1.947 9.975 1.949
149 HD22 LEU 22 HD22 LEU 22 -2.741 10.737 0.560
150 HD23 LEU 22 HD23 LEU 22 -0.971 10.806 0.715
151 H ARG 23 H ARG 23 -3.168 8.925 -4.594
152 HA ARG 23 HA ARG 23 -1.449 11.076 -5.787
153 HB2 ARG 23 HB2 ARG 23 -2.660 8.644 -7.132
154 HB3 ARG 23 HB3 ARG 23 -1.483 9.763 -7.820
155 HG2 ARG 23 HG2 ARG 23 0.065 8.978 -5.885
156 HG3 ARG 23 HG3 ARG 23 -1.079 7.623 -5.752
157 HD2 ARG 23 HD2 ARG 23 0.541 8.458 -8.176
158 HD3 ARG 23 HD3 ARG 23 0.689 6.946 -7.253
159 HE ARG 23 HE ARG 23 -1.964 7.023 -8.149
160 HH11 ARG 23 HH11 ARG 23 1.173 7.088 -9.788
161 HH12 ARG 23 HH12 ARG 23 0.526 6.360 -11.233
162 HH21 ARG 23 HH21 ARG 23 -2.701 6.118 -9.987
163 HH22 ARG 23 HH22 ARG 23 -1.640 5.813 -11.346
164 H GLY 24 H GLY 24 -4.529 10.766 -4.810
165 HA2 GLY 24 HA2 GLY 24 -6.365 12.053 -5.426
166 HA3 GLY 24 HA3 GLY 24 -5.531 12.547 -6.908
167 H ASN 25 H ASN 25 -5.442 9.146 -6.485
168 HA ASN 25 HA ASN 25 -7.397 8.801 -8.670
169 HB2 ASN 25 HB2 ASN 25 -5.866 6.737 -7.030
170 HB3 ASN 25 HB3 ASN 25 -6.872 6.387 -8.430
171 HD21 ASN 25 HD21 ASN 25 -6.186 8.302 -10.237
172 HD22 ASN 25 HD22 ASN 25 -4.488 8.159 -10.627
173 H ARG 26 H ARG 26 -9.174 7.233 -8.419
174 HA ARG 26 HA ARG 26 -10.815 7.774 -6.158
175 HB2 ARG 26 HB2 ARG 26 -10.896 6.008 -8.543
176 HB3 ARG 26 HB3 ARG 26 -11.966 5.605 -7.212
177 HG2 ARG 26 HG2 ARG 26 -12.796 7.136 -9.214
178 HG3 ARG 26 HG3 ARG 26 -13.366 7.373 -7.565
179 HD2 ARG 26 HD2 ARG 26 -12.926 9.525 -8.540
180 HD3 ARG 26 HD3 ARG 26 -11.738 9.236 -7.270
181 HE ARG 26 HE ARG 26 -10.715 8.456 -9.869
182 HH11 ARG 26 HH11 ARG 26 -11.309 11.302 -7.850
183 HH12 ARG 26 HH12 ARG 26 -10.022 12.206 -8.599
184 HH21 ARG 26 HH21 ARG 26 -9.094 9.686 -10.766
185 HH22 ARG 26 HH22 ARG 26 -8.824 11.325 -10.221
186 H GLY 27 H GLY 27 -8.292 5.436 -6.558
187 HA2 GLY 27 HA2 GLY 27 -7.799 4.616 -4.109
188 HA3 GLY 27 HA3 GLY 27 -9.373 3.792 -4.324
189 H GLY 28 H GLY 28 -7.953 1.764 -4.090
190 HA2 GLY 28 HA2 GLY 28 -7.286 0.865 -6.813
191 HA3 GLY 28 HA3 GLY 28 -5.947 0.871 -5.650
192 H TYR 29 H TYR 29 -6.551 -1.553 -6.692
193 HA TYR 29 HA TYR 29 -7.690 -2.891 -4.379
194 HB2 TYR 29 HB2 TYR 29 -8.966 -4.471 -5.695
195 HB3 TYR 29 HB3 TYR 29 -9.535 -2.830 -6.009
196 HD1 TYR 29 HD2 TYR 29 -9.117 -1.752 -8.217
197 HD2 TYR 29 HD1 TYR 29 -7.841 -5.791 -7.430
198 HE1 TYR 29 HE2 TYR 29 -8.833 -2.149 -10.663
199 HE2 TYR 29 HE1 TYR 29 -7.557 -6.169 -9.873
200 HH TYR 29 HH TYR 29 -8.290 -3.659 -12.294
201 H CYS 30 H CYS 30 -6.974 -5.237 -4.327
202 HA CYS 30 HA CYS 30 -4.234 -5.326 -5.471
203 HB2 CYS 30 HB2 CYS 30 -5.429 -6.888 -3.165
204 HB3 CYS 30 HB3 CYS 30 -3.751 -6.960 -3.722
205 H ASN 31 H ASN 31 -3.582 -6.873 -6.791
206 HA ASN 31 HA ASN 31 -5.515 -8.888 -7.786
207 HB2 ASN 31 HB2 ASN 31 -2.605 -8.239 -8.441
208 HB3 ASN 31 HB3 ASN 31 -3.477 -9.595 -9.162
209 HD21 ASN 31 HD21 ASN 31 -2.361 -7.604 -10.709
210 HD22 ASN 31 HD22 ASN 31 -3.657 -6.713 -11.465
211 H GLY 32 H GLY 32 -4.808 -11.213 -7.816
212 HA2 GLY 32 HA2 GLY 32 -4.095 -12.111 -5.212
213 HA3 GLY 32 HA3 GLY 32 -4.233 -13.110 -6.658
214 H ARG 33 H ARG 33 -1.937 -10.824 -7.389
215 HA ARG 33 HA ARG 33 0.231 -12.515 -6.448
216 HB2 ARG 33 HB2 ARG 33 0.121 -10.683 -8.847
217 HB3 ARG 33 HB3 ARG 33 1.594 -11.473 -8.271
218 HG2 ARG 33 HG2 ARG 33 0.430 -13.690 -8.573
219 HG3 ARG 33 HG3 ARG 33 -0.863 -12.810 -9.421
220 HD2 ARG 33 HD2 ARG 33 0.803 -11.920 -11.020
221 HD3 ARG 33 HD3 ARG 33 2.094 -12.775 -10.152
222 HE ARG 33 HE ARG 33 0.074 -14.635 -10.937
223 HH11 ARG 33 HH11 ARG 33 2.704 -12.745 -12.347
224 HH12 ARG 33 HH12 ARG 33 2.938 -13.873 -13.653
225 HH21 ARG 33 HH21 ARG 33 0.436 -16.031 -12.634
226 HH22 ARG 33 HH22 ARG 33 1.675 -15.695 -13.812
227 H ALA 34 H ALA 34 -1.266 -10.228 -5.161
228 HA ALA 34 HA ALA 34 -0.856 -8.534 -3.743
229 HB1 ALA 34 HB1 ALA 34 1.265 -8.432 -2.561
230 HB2 ALA 34 HB2 ALA 34 0.843 -10.140 -2.814
231 HB3 ALA 34 HB3 ALA 34 2.077 -9.364 -3.833
232 H ILE 35 H ILE 35 -0.762 -8.152 -6.590
233 HA ILE 35 HA ILE 35 1.013 -5.757 -6.824
234 HB ILE 35 HB ILE 35 -0.836 -6.967 -8.909
235 HG12 ILE 35 HG12 ILE 35 2.176 -7.196 -8.557
236 HG13 ILE 35 HG13 ILE 35 1.011 -8.494 -8.302
237 HG21 ILE 35 HG21 ILE 35 -0.410 -4.536 -9.288
238 HG22 ILE 35 HG22 ILE 35 1.344 -4.830 -9.192
239 HG23 ILE 35 HG23 ILE 35 0.383 -5.503 -10.529
240 HD11 ILE 35 HD11 ILE 35 1.767 -7.183 -10.905
241 HD12 ILE 35 HD12 ILE 35 2.015 -8.869 -10.408
242 HD13 ILE 35 HD13 ILE 35 0.370 -8.271 -10.731
243 H CYS 36 H CYS 36 0.138 -3.751 -7.041
244 HA CYS 36 HA CYS 36 -2.698 -3.481 -6.078
245 HB2 CYS 36 HB2 CYS 36 -0.975 -2.517 -4.596
246 HB3 CYS 36 HB3 CYS 36 -0.366 -1.551 -5.935
247 H VAL 37 H VAL 37 -4.167 -2.575 -7.416
248 HA VAL 37 HA VAL 37 -3.165 -1.331 -9.929
249 HB VAL 37 HB VAL 37 -5.656 -3.035 -9.492
250 HG11 VAL 37 HG11 VAL 37 -5.841 -2.913 -11.992
251 HG12 VAL 37 HG12 VAL 37 -5.995 -1.319 -11.231
252 HG13 VAL 37 HG13 VAL 37 -4.469 -1.784 -12.022
253 HG21 VAL 37 HG21 VAL 37 -3.693 -4.465 -9.437
254 HG22 VAL 37 HG22 VAL 37 -4.530 -4.681 -10.984
255 HG23 VAL 37 HG23 VAL 37 -3.046 -3.697 -10.910
256 H CYS 38 H CYS 38 -3.423 0.716 -9.522
257 HA CYS 38 HA CYS 38 -5.523 1.843 -7.905
258 HB2 CYS 38 HB2 CYS 38 -3.729 3.159 -9.975
259 HB3 CYS 38 HB3 CYS 38 -4.743 4.007 -8.803
260 H ARG 39 H ARG 39 -7.302 3.058 -8.540
261 HA ARG 39 HA ARG 39 -8.439 2.392 -11.183
262 HB2 ARG 39 HB2 ARG 39 -9.548 3.834 -8.738
263 HB3 ARG 39 HB3 ARG 39 -10.460 3.540 -10.227
264 HG2 ARG 39 HG2 ARG 39 -10.242 1.109 -9.895
265 HG3 ARG 39 HG3 ARG 39 -9.321 1.386 -8.406
266 HD2 ARG 39 HD2 ARG 39 -11.245 2.470 -7.365
267 HD3 ARG 39 HD3 ARG 39 -12.161 2.354 -8.879
268 HE ARG 39 HE ARG 39 -12.547 0.089 -8.506
269 HH11 ARG 39 HH11 ARG 39 -10.295 1.253 -6.051
270 HH12 ARG 39 HH12 ARG 39 -10.421 -0.206 -5.103
271 HH21 ARG 39 HH21 ARG 39 -12.672 -1.734 -7.243
272 HH22 ARG 39 HH22 ARG 39 -11.765 -1.852 -5.762
273 H ASN 40 H ASN 40 -9.548 4.536 -12.150
274 HA ASN 40 HA ASN 40 -7.568 6.338 -12.789
275 HB2 ASN 40 HB2 ASN 40 -9.280 7.707 -13.813
276 HB3 ASN 40 HB3 ASN 40 -9.648 6.007 -14.132
277 HD21 ASN 40 HD21 ASN 40 -11.637 5.320 -13.682
278 HD22 ASN 40 HD22 ASN 40 -12.800 6.170 -12.696
Start of MODEL 8
1 H1 ALA 1 H1 ALA 1 1.808 0.024 -9.544
2 H2 ALA 1 H2 ALA 1 2.270 -1.560 -9.544
3 H3 ALA 1 H3 ALA 1 0.773 -1.141 -8.995
4 HA ALA 1 HA ALA 1 3.339 -0.395 -7.740
5 HB1 ALA 1 HB1 ALA 1 1.617 1.361 -7.406
6 HB2 ALA 1 HB2 ALA 1 0.445 0.142 -6.858
7 HB3 ALA 1 HB3 ALA 1 1.890 0.494 -5.879
8 H THR 2 H THR 2 2.912 -1.260 -5.184
9 HA THR 2 HA THR 2 2.213 -4.138 -5.576
10 HB THR 2 HB THR 2 4.660 -3.781 -5.210
11 HG1 THR 2 HG1 THR 2 4.731 -5.435 -3.684
12 HG21 THR 2 HG21 THR 2 5.443 -3.127 -2.965
13 HG22 THR 2 HG22 THR 2 3.778 -2.782 -2.454
14 HG23 THR 2 HG23 THR 2 4.552 -1.787 -3.714
15 H CYS 3 H CYS 3 1.464 -5.289 -3.773
16 HA CYS 3 HA CYS 3 -0.171 -3.628 -1.883
17 HB2 CYS 3 HB2 CYS 3 -1.311 -5.139 -3.592
18 HB3 CYS 3 HB3 CYS 3 -0.568 -6.510 -2.766
19 H ASP 4 H ASP 4 2.729 -5.021 -2.044
20 HA ASP 4 HA ASP 4 2.836 -7.014 -0.040
21 HB2 ASP 4 HB2 ASP 4 4.903 -5.020 -1.038
22 HB3 ASP 4 HB3 ASP 4 5.273 -6.287 0.137
23 H LEU 5 H LEU 5 3.654 -7.039 2.020
24 HA LEU 5 HA LEU 5 3.554 -4.464 3.530
25 HB2 LEU 5 HB2 LEU 5 3.286 -5.949 5.548
26 HB3 LEU 5 HB3 LEU 5 1.925 -6.014 4.438
27 HG LEU 5 HG LEU 5 3.948 -8.087 3.896
28 HD11 LEU 5 HD11 LEU 5 3.465 -9.488 5.802
29 HD12 LEU 5 HD12 LEU 5 2.394 -8.252 6.496
30 HD13 LEU 5 HD13 LEU 5 4.144 -7.949 6.368
31 HD21 LEU 5 HD21 LEU 5 1.952 -9.511 3.789
32 HD22 LEU 5 HD22 LEU 5 1.710 -8.015 2.859
33 HD23 LEU 5 HD23 LEU 5 0.958 -8.195 4.467
34 H LEU 6 H LEU 6 5.496 -4.912 1.897
35 HA LEU 6 HA LEU 6 7.767 -6.391 2.911
36 HB2 LEU 6 HB2 LEU 6 7.427 -5.760 0.527
37 HB3 LEU 6 HB3 LEU 6 7.590 -4.064 0.957
38 HG LEU 6 HG LEU 6 9.956 -4.459 1.593
39 HD11 LEU 6 HD11 LEU 6 11.041 -6.579 0.852
40 HD12 LEU 6 HD12 LEU 6 9.432 -7.264 0.520
41 HD13 LEU 6 HD13 LEU 6 9.897 -6.829 2.184
42 HD21 LEU 6 HD21 LEU 6 10.766 -4.726 -0.721
43 HD22 LEU 6 HD22 LEU 6 9.337 -3.676 -0.655
44 HD23 LEU 6 HD23 LEU 6 9.177 -5.360 -1.212
45 H SER 7 H SER 7 6.511 -3.158 3.243
46 HA SER 7 HA SER 7 8.925 -2.082 4.441
47 HB2 SER 7 HB2 SER 7 6.130 -0.956 4.277
48 HB3 SER 7 HB3 SER 7 7.625 -0.026 4.531
49 HG SER 7 HG SER 7 8.291 -0.733 2.436
50 H GLY 8 H GLY 8 7.015 -4.175 5.846
51 HA2 GLY 8 HA2 GLY 8 6.790 -4.454 8.250
52 HA3 GLY 8 HA3 GLY 8 6.971 -2.679 8.432
53 H THR 9 H THR 9 5.157 -1.653 8.722
54 HA THR 9 HA THR 9 2.613 -2.679 8.664
55 HB THR 9 HB THR 9 2.571 -0.785 9.746
56 HG1 THR 9 HG1 THR 9 2.387 1.032 7.802
57 HG21 THR 9 HG21 THR 9 3.966 1.290 9.197
58 HG22 THR 9 HG22 THR 9 4.729 0.323 7.916
59 HG23 THR 9 HG23 THR 9 4.896 -0.150 9.633
60 H GLY 10 H GLY 10 0.827 -1.942 7.542
61 HA2 GLY 10 HA2 GLY 10 -0.265 -1.597 5.375
62 HA3 GLY 10 HA3 GLY 10 1.249 -2.056 4.563
63 H VAL 11 H VAL 11 0.677 -3.932 7.295
64 HA VAL 11 HA VAL 11 0.298 -6.375 5.978
65 HB VAL 11 HB VAL 11 -0.548 -5.632 8.765
66 HG11 VAL 11 HG11 VAL 11 -0.123 -8.027 9.301
67 HG12 VAL 11 HG12 VAL 11 -1.394 -7.844 8.077
68 HG13 VAL 11 HG13 VAL 11 0.244 -8.327 7.587
69 HG21 VAL 11 HG21 VAL 11 1.748 -6.515 9.435
70 HG22 VAL 11 HG22 VAL 11 2.184 -6.431 7.716
71 HG23 VAL 11 HG23 VAL 11 1.744 -4.958 8.594
72 H LYS 12 H LYS 12 -1.933 -4.040 7.276
73 HA LYS 12 HA LYS 12 -4.291 -5.454 6.309
74 HB2 LYS 12 HB2 LYS 12 -3.721 -2.652 7.296
75 HB3 LYS 12 HB3 LYS 12 -5.329 -3.168 6.759
76 HG2 LYS 12 HG2 LYS 12 -3.786 -4.373 9.101
77 HG3 LYS 12 HG3 LYS 12 -5.069 -3.162 9.241
78 HD2 LYS 12 HD2 LYS 12 -6.663 -4.769 8.163
79 HD3 LYS 12 HD3 LYS 12 -5.377 -5.997 8.162
80 HE2 LYS 12 HE2 LYS 12 -5.212 -5.807 10.638
81 HE3 LYS 12 HE3 LYS 12 -6.525 -4.613 10.626
82 HZ1 LYS 12 HZ1 LYS 12 -7.345 -6.826 11.151
83 HZ2 LYS 12 HZ2 LYS 12 -6.769 -7.436 9.731
84 HZ3 LYS 12 HZ3 LYS 12 -7.989 -6.326 9.716
85 H HIS 13 H HIS 13 -4.222 -5.758 4.160
86 HA HIS 13 HA HIS 13 -2.616 -4.298 2.377
87 HB2 HIS 13 HB2 HIS 13 -4.943 -6.183 1.971
88 HB3 HIS 13 HB3 HIS 13 -4.019 -5.516 0.629
89 HD1 HIS 13 HD1 HIS 13 -3.978 -8.574 1.054
90 HD2 HIS 13 HD2 HIS 13 -1.152 -5.947 2.706
91 HE1 HIS 13 HE1 HIS 13 -1.879 -9.939 1.533
92 HE2 HIS 13 HE2 HIS 13 -0.196 -8.335 2.527
93 H SER 14 H SER 14 -5.418 -3.042 3.673
94 HA SER 14 HA SER 14 -6.494 -1.644 1.452
95 HB2 SER 14 HB2 SER 14 -6.402 -0.295 4.094
96 HB3 SER 14 HB3 SER 14 -7.794 -0.624 3.035
97 HG SER 14 HG SER 14 -7.997 -1.964 4.786
98 H ALA 15 H ALA 15 -3.517 -1.383 3.041
99 HA ALA 15 HA ALA 15 -2.878 1.273 2.774
100 HB1 ALA 15 HB1 ALA 15 -1.492 -0.319 3.999
101 HB2 ALA 15 HB2 ALA 15 -1.077 -1.145 2.478
102 HB3 ALA 15 HB3 ALA 15 -0.520 0.520 2.770
103 H CYS 16 H CYS 16 -2.799 -1.283 0.334
104 HA CYS 16 HA CYS 16 -1.474 0.223 -1.683
105 HB2 CYS 16 HB2 CYS 16 -1.560 -1.942 -2.376
106 HB3 CYS 16 HB3 CYS 16 -3.055 -2.248 -1.493
107 H ALA 17 H ALA 17 -4.842 -0.143 -0.875
108 HA ALA 17 HA ALA 17 -5.852 1.405 -3.035
109 HB1 ALA 17 HB1 ALA 17 -7.286 -0.119 -1.691
110 HB2 ALA 17 HB2 ALA 17 -7.091 0.960 -0.287
111 HB3 ALA 17 HB3 ALA 17 -7.947 1.533 -1.733
112 H ALA 18 H ALA 18 -4.884 2.185 0.237
113 HA ALA 18 HA ALA 18 -5.603 4.940 0.135
114 HB1 ALA 18 HB1 ALA 18 -5.180 3.716 2.250
115 HB2 ALA 18 HB2 ALA 18 -3.459 3.587 1.817
116 HB3 ALA 18 HB3 ALA 18 -4.182 5.183 2.126
117 H HIS 19 H HIS 19 -2.621 3.251 -0.755
118 HA HIS 19 HA HIS 19 -1.074 5.529 -1.125
119 HB2 HIS 19 HB2 HIS 19 -0.220 3.183 -1.069
120 HB3 HIS 19 HB3 HIS 19 -0.855 2.967 -2.706
121 HD1 HIS 19 HD1 HIS 19 1.796 4.935 -0.774
122 HD2 HIS 19 HD2 HIS 19 0.748 4.035 -4.731
123 HE1 HIS 19 HE1 HIS 19 3.701 5.767 -2.252
124 HE2 HIS 19 HE2 HIS 19 3.053 5.213 -4.630
125 H CYS 20 H CYS 20 -3.399 3.920 -3.207
126 HA CYS 20 HA CYS 20 -2.813 5.556 -5.533
127 HB2 CYS 20 HB2 CYS 20 -5.286 3.963 -4.803
128 HB3 CYS 20 HB3 CYS 20 -4.920 4.622 -6.401
129 H LEU 21 H LEU 21 -5.234 5.644 -2.883
130 HA LEU 21 HA LEU 21 -6.765 7.845 -3.833
131 HB2 LEU 21 HB2 LEU 21 -6.103 6.839 -1.066
132 HB3 LEU 21 HB3 LEU 21 -7.147 8.220 -1.317
133 HG LEU 21 HG LEU 21 -7.741 5.428 -2.300
134 HD11 LEU 21 HD11 LEU 21 -9.345 5.343 -0.429
135 HD12 LEU 21 HD12 LEU 21 -8.766 6.926 0.139
136 HD13 LEU 21 HD13 LEU 21 -7.679 5.518 0.151
137 HD21 LEU 21 HD21 LEU 21 -10.042 6.304 -2.574
138 HD22 LEU 21 HD22 LEU 21 -8.891 7.182 -3.591
139 HD23 LEU 21 HD23 LEU 21 -9.478 7.921 -2.090
140 H LEU 22 H LEU 22 -3.709 7.727 -2.024
141 HA LEU 22 HA LEU 22 -3.565 10.530 -1.447
142 HB2 LEU 22 HB2 LEU 22 -1.498 8.337 -1.692
143 HB3 LEU 22 HB3 LEU 22 -1.049 9.992 -1.301
144 HG LEU 22 HG LEU 22 -2.994 8.369 0.369
145 HD11 LEU 22 HD11 LEU 22 -0.799 7.268 0.324
146 HD12 LEU 22 HD12 LEU 22 -1.098 8.010 1.906
147 HD13 LEU 22 HD13 LEU 22 -0.003 8.805 0.748
148 HD21 LEU 22 HD21 LEU 22 -2.430 10.055 2.107
149 HD22 LEU 22 HD22 LEU 22 -3.202 10.789 0.691
150 HD23 LEU 22 HD23 LEU 22 -1.444 10.936 0.917
151 H ARG 23 H ARG 23 -3.329 8.977 -4.482
152 HA ARG 23 HA ARG 23 -1.684 11.225 -5.590
153 HB2 ARG 23 HB2 ARG 23 -2.756 8.762 -6.994
154 HB3 ARG 23 HB3 ARG 23 -1.628 9.949 -7.652
155 HG2 ARG 23 HG2 ARG 23 -0.082 9.222 -5.683
156 HG3 ARG 23 HG3 ARG 23 -1.144 7.796 -5.618
157 HD2 ARG 23 HD2 ARG 23 0.463 8.803 -7.989
158 HD3 ARG 23 HD3 ARG 23 0.711 7.287 -7.095
159 HE ARG 23 HE ARG 23 -1.930 7.200 -8.039
160 HH11 ARG 23 HH11 ARG 23 1.240 7.471 -9.592
161 HH12 ARG 23 HH12 ARG 23 0.679 6.716 -11.059
162 HH21 ARG 23 HH21 ARG 23 -2.561 6.263 -9.901
163 HH22 ARG 23 HH22 ARG 23 -1.447 6.036 -11.235
164 H GLY 24 H GLY 24 -4.786 10.775 -4.724
165 HA2 GLY 24 HA2 GLY 24 -6.653 11.996 -5.384
166 HA3 GLY 24 HA3 GLY 24 -5.785 12.563 -6.820
167 H ASN 25 H ASN 25 -5.557 9.163 -6.458
168 HA ASN 25 HA ASN 25 -7.379 8.770 -8.742
169 HB2 ASN 25 HB2 ASN 25 -5.871 6.741 -7.037
170 HB3 ASN 25 HB3 ASN 25 -6.788 6.372 -8.490
171 HD21 ASN 25 HD21 ASN 25 -6.067 8.354 -10.230
172 HD22 ASN 25 HD22 ASN 25 -4.351 8.258 -10.539
173 H ARG 26 H ARG 26 -9.112 7.168 -8.621
174 HA ARG 26 HA ARG 26 -10.913 7.609 -6.465
175 HB2 ARG 26 HB2 ARG 26 -10.769 5.907 -8.884
176 HB3 ARG 26 HB3 ARG 26 -11.892 5.404 -7.633
177 HG2 ARG 26 HG2 ARG 26 -12.710 6.935 -9.618
178 HG3 ARG 26 HG3 ARG 26 -13.344 7.143 -7.988
179 HD2 ARG 26 HD2 ARG 26 -12.935 9.313 -8.960
180 HD3 ARG 26 HD3 ARG 26 -11.813 9.062 -7.622
181 HE ARG 26 HE ARG 26 -10.613 8.325 -10.159
182 HH11 ARG 26 HH11 ARG 26 -11.431 11.145 -8.181
183 HH12 ARG 26 HH12 ARG 26 -10.137 12.097 -8.851
184 HH21 ARG 26 HH21 ARG 26 -8.984 9.616 -10.955
185 HH22 ARG 26 HH22 ARG 26 -8.811 11.263 -10.396
186 H GLY 27 H GLY 27 -8.254 5.433 -6.669
187 HA2 GLY 27 HA2 GLY 27 -7.880 4.629 -4.218
188 HA3 GLY 27 HA3 GLY 27 -9.400 3.732 -4.505
189 H GLY 28 H GLY 28 -7.902 1.790 -4.140
190 HA2 GLY 28 HA2 GLY 28 -7.063 0.871 -6.812
191 HA3 GLY 28 HA3 GLY 28 -5.801 0.915 -5.564
192 H TYR 29 H TYR 29 -6.395 -1.530 -6.666
193 HA TYR 29 HA TYR 29 -7.563 -2.849 -4.357
194 HB2 TYR 29 HB2 TYR 29 -8.800 -4.458 -5.716
195 HB3 TYR 29 HB3 TYR 29 -9.405 -2.820 -5.965
196 HD1 TYR 29 HD2 TYR 29 -9.011 -1.643 -8.130
197 HD2 TYR 29 HD1 TYR 29 -7.688 -5.698 -7.515
198 HE1 TYR 29 HE2 TYR 29 -8.747 -1.941 -10.592
199 HE2 TYR 29 HE1 TYR 29 -7.437 -5.979 -9.976
200 HH TYR 29 HH TYR 29 -8.215 -3.382 -12.288
201 H CYS 30 H CYS 30 -6.848 -5.188 -4.276
202 HA CYS 30 HA CYS 30 -4.122 -5.330 -5.463
203 HB2 CYS 30 HB2 CYS 30 -5.266 -6.765 -3.049
204 HB3 CYS 30 HB3 CYS 30 -3.621 -6.935 -3.677
205 H ASN 31 H ASN 31 -3.568 -6.894 -6.790
206 HA ASN 31 HA ASN 31 -5.550 -8.938 -7.607
207 HB2 ASN 31 HB2 ASN 31 -2.670 -8.347 -8.429
208 HB3 ASN 31 HB3 ASN 31 -3.617 -9.687 -9.085
209 HD21 ASN 31 HD21 ASN 31 -2.492 -7.618 -10.631
210 HD22 ASN 31 HD22 ASN 31 -3.818 -6.745 -11.356
211 H GLY 32 H GLY 32 -4.910 -11.258 -7.535
212 HA2 GLY 32 HA2 GLY 32 -3.995 -12.030 -4.949
213 HA3 GLY 32 HA3 GLY 32 -4.297 -13.102 -6.316
214 H ARG 33 H ARG 33 -1.988 -10.854 -7.266
215 HA ARG 33 HA ARG 33 0.190 -12.608 -6.479
216 HB2 ARG 33 HB2 ARG 33 -0.044 -10.908 -8.965
217 HB3 ARG 33 HB3 ARG 33 1.398 -11.821 -8.497
218 HG2 ARG 33 HG2 ARG 33 -0.031 -13.911 -8.525
219 HG3 ARG 33 HG3 ARG 33 -1.309 -12.938 -9.283
220 HD2 ARG 33 HD2 ARG 33 0.250 -12.356 -11.122
221 HD3 ARG 33 HD3 ARG 33 1.509 -13.347 -10.356
222 HE ARG 33 HE ARG 33 -0.812 -14.946 -10.714
223 HH11 ARG 33 HH11 ARG 33 1.722 -13.470 -12.681
224 HH12 ARG 33 HH12 ARG 33 1.587 -14.681 -13.927
225 HH21 ARG 33 HH21 ARG 33 -0.925 -16.454 -12.345
226 HH22 ARG 33 HH22 ARG 33 0.113 -16.334 -13.739
227 H ALA 34 H ALA 34 -1.055 -10.280 -5.131
228 HA ALA 34 HA ALA 34 -0.447 -8.590 -3.790
229 HB1 ALA 34 HB1 ALA 34 1.819 -8.496 -2.897
230 HB2 ALA 34 HB2 ALA 34 1.348 -10.201 -3.077
231 HB3 ALA 34 HB3 ALA 34 2.443 -9.444 -4.258
232 H ILE 35 H ILE 35 -0.667 -8.233 -6.642
233 HA ILE 35 HA ILE 35 1.049 -5.820 -7.057
234 HB ILE 35 HB ILE 35 -0.973 -7.030 -8.953
235 HG12 ILE 35 HG12 ILE 35 2.046 -7.345 -8.818
236 HG13 ILE 35 HG13 ILE 35 0.853 -8.613 -8.529
237 HG21 ILE 35 HG21 ILE 35 -0.528 -4.606 -9.374
238 HG22 ILE 35 HG22 ILE 35 1.218 -4.946 -9.447
239 HG23 ILE 35 HG23 ILE 35 0.116 -5.593 -10.683
240 HD11 ILE 35 HD11 ILE 35 1.517 -7.262 -11.135
241 HD12 ILE 35 HD12 ILE 35 1.726 -8.969 -10.693
242 HD13 ILE 35 HD13 ILE 35 0.090 -8.302 -10.912
243 H CYS 36 H CYS 36 0.209 -3.857 -7.117
244 HA CYS 36 HA CYS 36 -2.607 -3.524 -6.113
245 HB2 CYS 36 HB2 CYS 36 -0.879 -2.639 -4.607
246 HB3 CYS 36 HB3 CYS 36 -0.213 -1.682 -5.925
247 H VAL 37 H VAL 37 -4.048 -2.590 -7.452
248 HA VAL 37 HA VAL 37 -3.002 -1.306 -9.926
249 HB VAL 37 HB VAL 37 -5.526 -2.974 -9.553
250 HG11 VAL 37 HG11 VAL 37 -5.679 -2.796 -12.051
251 HG12 VAL 37 HG12 VAL 37 -5.816 -1.216 -11.257
252 HG13 VAL 37 HG13 VAL 37 -4.289 -1.689 -12.041
253 HG21 VAL 37 HG21 VAL 37 -3.590 -4.444 -9.509
254 HG22 VAL 37 HG22 VAL 37 -4.407 -4.606 -11.073
255 HG23 VAL 37 HG23 VAL 37 -2.907 -3.653 -10.954
256 H CYS 38 H CYS 38 -3.219 0.737 -9.469
257 HA CYS 38 HA CYS 38 -5.353 1.875 -7.893
258 HB2 CYS 38 HB2 CYS 38 -3.473 3.192 -9.888
259 HB3 CYS 38 HB3 CYS 38 -4.527 4.042 -8.755
260 H ARG 39 H ARG 39 -7.122 3.066 -8.589
261 HA ARG 39 HA ARG 39 -8.167 2.402 -11.265
262 HB2 ARG 39 HB2 ARG 39 -9.318 3.919 -8.885
263 HB3 ARG 39 HB3 ARG 39 -10.194 3.608 -10.392
264 HG2 ARG 39 HG2 ARG 39 -10.051 1.185 -9.994
265 HG3 ARG 39 HG3 ARG 39 -9.144 1.469 -8.497
266 HD2 ARG 39 HD2 ARG 39 -11.066 2.669 -7.537
267 HD3 ARG 39 HD3 ARG 39 -11.964 2.460 -9.050
268 HE ARG 39 HE ARG 39 -12.356 0.223 -8.543
269 HH11 ARG 39 HH11 ARG 39 -10.161 1.547 -6.119
270 HH12 ARG 39 HH12 ARG 39 -10.310 0.152 -5.082
271 HH21 ARG 39 HH21 ARG 39 -12.512 -1.512 -7.164
272 HH22 ARG 39 HH22 ARG 39 -11.636 -1.532 -5.660
273 H ASN 40 H ASN 40 -9.211 4.527 -12.318
274 HA ASN 40 HA ASN 40 -7.199 6.324 -12.886
275 HB2 ASN 40 HB2 ASN 40 -8.870 7.664 -14.034
276 HB3 ASN 40 HB3 ASN 40 -9.153 5.952 -14.368
277 HD21 ASN 40 HD21 ASN 40 -11.179 5.300 -14.218
278 HD22 ASN 40 HD22 ASN 40 -12.431 6.066 -13.270
Start of MODEL 9
1 H1 ALA 1 H1 ALA 1 2.458 0.219 -9.011
2 H2 ALA 1 H2 ALA 1 2.891 -1.374 -9.014
3 H3 ALA 1 H3 ALA 1 1.325 -0.950 -8.731
4 HA ALA 1 HA ALA 1 3.619 -0.337 -6.977
5 HB1 ALA 1 HB1 ALA 1 1.836 0.467 -5.370
6 HB2 ALA 1 HB2 ALA 1 1.928 1.453 -6.847
7 HB3 ALA 1 HB3 ALA 1 0.624 0.258 -6.657
8 H THR 2 H THR 2 3.013 -1.382 -4.660
9 HA THR 2 HA THR 2 2.158 -4.173 -5.294
10 HB THR 2 HB THR 2 4.599 -3.993 -4.836
11 HG1 THR 2 HG1 THR 2 4.506 -5.801 -3.594
12 HG21 THR 2 HG21 THR 2 5.354 -3.523 -2.532
13 HG22 THR 2 HG22 THR 2 3.696 -3.107 -2.046
14 HG23 THR 2 HG23 THR 2 4.567 -2.089 -3.221
15 H CYS 3 H CYS 3 1.273 -5.426 -3.667
16 HA CYS 3 HA CYS 3 -0.255 -3.907 -1.587
17 HB2 CYS 3 HB2 CYS 3 -1.470 -5.135 -3.488
18 HB3 CYS 3 HB3 CYS 3 -0.887 -6.637 -2.761
19 H ASP 4 H ASP 4 2.532 -5.527 -1.959
20 HA ASP 4 HA ASP 4 2.447 -7.748 -0.195
21 HB2 ASP 4 HB2 ASP 4 4.669 -5.895 -1.110
22 HB3 ASP 4 HB3 ASP 4 4.967 -7.217 0.024
23 H LEU 5 H LEU 5 3.353 -8.073 1.832
24 HA LEU 5 HA LEU 5 3.457 -5.673 3.608
25 HB2 LEU 5 HB2 LEU 5 3.045 -7.353 5.460
26 HB3 LEU 5 HB3 LEU 5 1.686 -7.130 4.363
27 HG LEU 5 HG LEU 5 3.355 -9.313 3.427
28 HD11 LEU 5 HD11 LEU 5 3.012 -10.908 5.208
29 HD12 LEU 5 HD12 LEU 5 2.215 -9.684 6.217
30 HD13 LEU 5 HD13 LEU 5 3.944 -9.533 5.829
31 HD21 LEU 5 HD21 LEU 5 1.216 -10.503 3.459
32 HD22 LEU 5 HD22 LEU 5 1.001 -8.871 2.793
33 HD23 LEU 5 HD23 LEU 5 0.490 -9.224 4.464
34 H LEU 6 H LEU 6 5.396 -6.141 1.971
35 HA LEU 6 HA LEU 6 7.489 -7.837 3.074
36 HB2 LEU 6 HB2 LEU 6 7.203 -7.399 0.639
37 HB3 LEU 6 HB3 LEU 6 7.560 -5.699 0.918
38 HG LEU 6 HG LEU 6 9.864 -6.297 1.605
39 HD11 LEU 6 HD11 LEU 6 10.704 -8.592 1.094
40 HD12 LEU 6 HD12 LEU 6 9.027 -9.122 0.820
41 HD13 LEU 6 HD13 LEU 6 9.545 -8.571 2.434
42 HD21 LEU 6 HD21 LEU 6 10.643 -6.887 -0.657
43 HD22 LEU 6 HD22 LEU 6 9.339 -5.684 -0.719
44 HD23 LEU 6 HD23 LEU 6 8.994 -7.388 -1.102
45 H SER 7 H SER 7 6.479 -4.516 3.183
46 HA SER 7 HA SER 7 9.000 -3.578 4.353
47 HB2 SER 7 HB2 SER 7 6.386 -2.162 3.826
48 HB3 SER 7 HB3 SER 7 7.967 -1.390 4.094
49 HG SER 7 HG SER 7 8.670 -2.471 2.154
50 H GLY 8 H GLY 8 6.752 -5.275 5.776
51 HA2 GLY 8 HA2 GLY 8 6.271 -5.200 8.182
52 HA3 GLY 8 HA3 GLY 8 6.486 -3.418 8.113
53 H THR 9 H THR 9 4.639 -2.356 8.026
54 HA THR 9 HA THR 9 2.128 -3.389 7.723
55 HB THR 9 HB THR 9 1.932 -1.362 8.474
56 HG1 THR 9 HG1 THR 9 2.255 -0.302 5.892
57 HG21 THR 9 HG21 THR 9 3.452 0.610 7.893
58 HG22 THR 9 HG22 THR 9 4.407 -0.529 6.921
59 HG23 THR 9 HG23 THR 9 4.256 -0.749 8.690
60 H GLY 10 H GLY 10 0.551 -2.969 6.297
61 HA2 GLY 10 HA2 GLY 10 -0.001 -2.711 3.809
62 HA3 GLY 10 HA3 GLY 10 1.425 -3.737 3.518
63 H VAL 11 H VAL 11 0.566 -5.003 6.257
64 HA VAL 11 HA VAL 11 -0.695 -7.324 5.362
65 HB VAL 11 HB VAL 11 -0.888 -6.052 8.082
66 HG11 VAL 11 HG11 VAL 11 -1.204 -8.384 8.923
67 HG12 VAL 11 HG12 VAL 11 -2.519 -7.882 7.841
68 HG13 VAL 11 HG13 VAL 11 -1.238 -8.962 7.242
69 HG21 VAL 11 HG21 VAL 11 1.047 -7.477 8.700
70 HG22 VAL 11 HG22 VAL 11 1.173 -7.995 7.008
71 HG23 VAL 11 HG23 VAL 11 1.462 -6.300 7.442
72 H LYS 12 H LYS 12 -2.046 -4.393 6.715
73 HA LYS 12 HA LYS 12 -4.787 -5.133 6.064
74 HB2 LYS 12 HB2 LYS 12 -3.358 -2.605 6.898
75 HB3 LYS 12 HB3 LYS 12 -5.076 -2.607 6.474
76 HG2 LYS 12 HG2 LYS 12 -3.869 -4.269 8.723
77 HG3 LYS 12 HG3 LYS 12 -4.596 -2.670 8.945
78 HD2 LYS 12 HD2 LYS 12 -6.751 -3.548 8.024
79 HD3 LYS 12 HD3 LYS 12 -6.021 -5.166 7.930
80 HE2 LYS 12 HE2 LYS 12 -5.606 -5.113 10.380
81 HE3 LYS 12 HE3 LYS 12 -6.353 -3.507 10.467
82 HZ1 LYS 12 HZ1 LYS 12 -7.915 -5.246 11.084
83 HZ2 LYS 12 HZ2 LYS 12 -7.739 -5.996 9.626
84 HZ3 LYS 12 HZ3 LYS 12 -8.434 -4.501 9.707
85 H HIS 13 H HIS 13 -4.804 -5.621 3.895
86 HA HIS 13 HA HIS 13 -3.174 -4.397 1.952
87 HB2 HIS 13 HB2 HIS 13 -5.752 -5.964 1.745
88 HB3 HIS 13 HB3 HIS 13 -4.837 -5.438 0.330
89 HD1 HIS 13 HD1 HIS 13 -5.283 -8.515 1.192
90 HD2 HIS 13 HD2 HIS 13 -1.829 -6.216 1.823
91 HE1 HIS 13 HE1 HIS 13 -3.333 -10.141 1.424
92 HE2 HIS 13 HE2 HIS 13 -1.266 -8.729 1.802
93 H SER 14 H SER 14 -5.804 -2.984 3.455
94 HA SER 14 HA SER 14 -6.794 -1.307 1.402
95 HB2 SER 14 HB2 SER 14 -6.643 0.000 3.977
96 HB3 SER 14 HB3 SER 14 -8.080 -0.597 3.112
97 HG SER 14 HG SER 14 -7.879 -1.747 5.018
98 H ALA 15 H ALA 15 -3.802 -1.373 3.005
99 HA ALA 15 HA ALA 15 -3.007 1.256 2.858
100 HB1 ALA 15 HB1 ALA 15 -0.692 0.382 2.912
101 HB2 ALA 15 HB2 ALA 15 -1.741 -0.458 4.075
102 HB3 ALA 15 HB3 ALA 15 -1.318 -1.241 2.533
103 H CYS 16 H CYS 16 -2.944 -1.269 0.389
104 HA CYS 16 HA CYS 16 -1.546 0.217 -1.589
105 HB2 CYS 16 HB2 CYS 16 -1.668 -1.962 -2.264
106 HB3 CYS 16 HB3 CYS 16 -3.211 -2.214 -1.449
107 H ALA 17 H ALA 17 -4.931 -0.083 -0.827
108 HA ALA 17 HA ALA 17 -5.891 1.493 -2.979
109 HB1 ALA 17 HB1 ALA 17 -7.359 0.006 -1.624
110 HB2 ALA 17 HB2 ALA 17 -7.162 1.106 -0.240
111 HB3 ALA 17 HB3 ALA 17 -7.991 1.667 -1.706
112 H ALA 18 H ALA 18 -4.913 2.290 0.287
113 HA ALA 18 HA ALA 18 -5.579 5.059 0.139
114 HB1 ALA 18 HB1 ALA 18 -5.197 3.868 2.279
115 HB2 ALA 18 HB2 ALA 18 -3.478 3.680 1.857
116 HB3 ALA 18 HB3 ALA 18 -4.153 5.301 2.133
117 H HIS 19 H HIS 19 -2.635 3.277 -0.689
118 HA HIS 19 HA HIS 19 -1.055 5.524 -1.108
119 HB2 HIS 19 HB2 HIS 19 -0.314 3.099 -0.957
120 HB3 HIS 19 HB3 HIS 19 -0.758 2.966 -2.664
121 HD1 HIS 19 HD1 HIS 19 1.700 4.745 -0.338
122 HD2 HIS 19 HD2 HIS 19 1.088 4.110 -4.436
123 HE1 HIS 19 HE1 HIS 19 3.778 5.607 -1.539
124 HE2 HIS 19 HE2 HIS 19 3.394 5.214 -4.002
125 H CYS 20 H CYS 20 -3.425 3.939 -3.138
126 HA CYS 20 HA CYS 20 -2.759 5.464 -5.522
127 HB2 CYS 20 HB2 CYS 20 -5.248 3.924 -4.744
128 HB3 CYS 20 HB3 CYS 20 -4.925 4.587 -6.349
129 H LEU 21 H LEU 21 -5.160 5.712 -2.873
130 HA LEU 21 HA LEU 21 -6.652 7.907 -3.893
131 HB2 LEU 21 HB2 LEU 21 -5.987 6.959 -1.111
132 HB3 LEU 21 HB3 LEU 21 -6.961 8.388 -1.369
133 HG LEU 21 HG LEU 21 -7.719 5.609 -2.280
134 HD11 LEU 21 HD11 LEU 21 -9.283 5.647 -0.372
135 HD12 LEU 21 HD12 LEU 21 -8.611 7.209 0.149
136 HD13 LEU 21 HD13 LEU 21 -7.598 5.748 0.168
137 HD21 LEU 21 HD21 LEU 21 -9.979 6.594 -2.515
138 HD22 LEU 21 HD22 LEU 21 -8.812 7.386 -3.583
139 HD23 LEU 21 HD23 LEU 21 -9.322 8.192 -2.087
140 H LEU 22 H LEU 22 -3.572 7.778 -2.130
141 HA LEU 22 HA LEU 22 -3.323 10.594 -1.669
142 HB2 LEU 22 HB2 LEU 22 -1.314 8.345 -1.911
143 HB3 LEU 22 HB3 LEU 22 -0.830 9.998 -1.558
144 HG LEU 22 HG LEU 22 -2.737 8.412 0.189
145 HD11 LEU 22 HD11 LEU 22 -0.523 7.334 0.094
146 HD12 LEU 22 HD12 LEU 22 -0.803 8.083 1.678
147 HD13 LEU 22 HD13 LEU 22 0.257 8.884 0.494
148 HD21 LEU 22 HD21 LEU 22 -2.136 10.133 1.883
149 HD22 LEU 22 HD22 LEU 22 -2.960 10.831 0.476
150 HD23 LEU 22 HD23 LEU 22 -1.196 11.001 0.645
151 H ARG 23 H ARG 23 -3.262 8.952 -4.652
152 HA ARG 23 HA ARG 23 -1.554 11.091 -5.880
153 HB2 ARG 23 HB2 ARG 23 -2.685 8.597 -7.174
154 HB3 ARG 23 HB3 ARG 23 -1.498 9.709 -7.860
155 HG2 ARG 23 HG2 ARG 23 -0.012 9.010 -5.841
156 HG3 ARG 23 HG3 ARG 23 -1.143 7.645 -5.702
157 HD2 ARG 23 HD2 ARG 23 0.556 8.415 -8.093
158 HD3 ARG 23 HD3 ARG 23 0.690 6.941 -7.110
159 HE ARG 23 HE ARG 23 -1.932 6.959 -8.113
160 HH11 ARG 23 HH11 ARG 23 1.278 6.954 -9.604
161 HH12 ARG 23 HH12 ARG 23 0.702 6.155 -11.041
162 HH21 ARG 23 HH21 ARG 23 -2.582 5.961 -9.936
163 HH22 ARG 23 HH22 ARG 23 -1.458 5.593 -11.228
164 H GLY 24 H GLY 24 -4.649 10.770 -4.964
165 HA2 GLY 24 HA2 GLY 24 -6.486 12.012 -5.670
166 HA3 GLY 24 HA3 GLY 24 -5.626 12.456 -7.152
167 H ASN 25 H ASN 25 -5.453 9.095 -6.649
168 HA ASN 25 HA ASN 25 -7.376 8.622 -8.829
169 HB2 ASN 25 HB2 ASN 25 -5.823 6.664 -7.082
170 HB3 ASN 25 HB3 ASN 25 -6.807 6.227 -8.471
171 HD21 ASN 25 HD21 ASN 25 -6.150 8.082 -10.358
172 HD22 ASN 25 HD22 ASN 25 -4.446 7.953 -10.729
173 H ARG 26 H ARG 26 -9.150 7.089 -8.559
174 HA ARG 26 HA ARG 26 -10.819 7.679 -6.332
175 HB2 ARG 26 HB2 ARG 26 -10.878 5.891 -8.694
176 HB3 ARG 26 HB3 ARG 26 -11.960 5.490 -7.371
177 HG2 ARG 26 HG2 ARG 26 -12.800 6.993 -9.369
178 HG3 ARG 26 HG3 ARG 26 -13.338 7.287 -7.719
179 HD2 ARG 26 HD2 ARG 26 -12.883 9.402 -8.776
180 HD3 ARG 26 HD3 ARG 26 -11.691 9.139 -7.504
181 HE ARG 26 HE ARG 26 -10.642 8.248 -10.032
182 HH11 ARG 26 HH11 ARG 26 -11.378 11.234 -8.281
183 HH12 ARG 26 HH12 ARG 26 -10.135 12.128 -9.109
184 HH21 ARG 26 HH21 ARG 26 -9.065 9.464 -11.027
185 HH22 ARG 26 HH22 ARG 26 -8.876 11.157 -10.634
186 H GLY 27 H GLY 27 -8.262 5.397 -6.584
187 HA2 GLY 27 HA2 GLY 27 -7.850 4.636 -4.110
188 HA3 GLY 27 HA3 GLY 27 -9.388 3.760 -4.367
189 H GLY 28 H GLY 28 -7.910 1.790 -4.019
190 HA2 GLY 28 HA2 GLY 28 -7.108 0.861 -6.699
191 HA3 GLY 28 HA3 GLY 28 -5.840 0.885 -5.461
192 H TYR 29 H TYR 29 -6.470 -1.539 -6.592
193 HA TYR 29 HA TYR 29 -7.639 -2.888 -4.303
194 HB2 TYR 29 HB2 TYR 29 -8.936 -4.433 -5.646
195 HB3 TYR 29 HB3 TYR 29 -9.491 -2.780 -5.916
196 HD1 TYR 29 HD2 TYR 29 -9.011 -1.629 -8.093
197 HD2 TYR 29 HD1 TYR 29 -7.912 -5.742 -7.429
198 HE1 TYR 29 HE2 TYR 29 -8.755 -1.967 -10.550
199 HE2 TYR 29 HE1 TYR 29 -7.670 -6.064 -9.885
200 HH TYR 29 HH TYR 29 -8.286 -3.452 -12.228
201 H CYS 30 H CYS 30 -6.942 -5.248 -4.300
202 HA CYS 30 HA CYS 30 -4.211 -5.327 -5.469
203 HB2 CYS 30 HB2 CYS 30 -5.366 -6.866 -3.131
204 HB3 CYS 30 HB3 CYS 30 -3.699 -6.954 -3.723
205 H ASN 31 H ASN 31 -3.627 -6.820 -6.873
206 HA ASN 31 HA ASN 31 -5.586 -8.830 -7.810
207 HB2 ASN 31 HB2 ASN 31 -2.741 -8.072 -8.594
208 HB3 ASN 31 HB3 ASN 31 -3.529 -9.517 -9.235
209 HD21 ASN 31 HD21 ASN 31 -2.708 -7.731 -11.027
210 HD22 ASN 31 HD22 ASN 31 -4.079 -6.888 -11.706
211 H GLY 32 H GLY 32 -4.915 -11.143 -7.907
212 HA2 GLY 32 HA2 GLY 32 -4.114 -12.097 -5.352
213 HA3 GLY 32 HA3 GLY 32 -4.327 -13.067 -6.809
214 H ARG 33 H ARG 33 -2.001 -10.785 -7.539
215 HA ARG 33 HA ARG 33 0.154 -12.547 -6.702
216 HB2 ARG 33 HB2 ARG 33 0.025 -10.691 -9.083
217 HB3 ARG 33 HB3 ARG 33 1.488 -11.535 -8.555
218 HG2 ARG 33 HG2 ARG 33 0.235 -13.709 -8.831
219 HG3 ARG 33 HG3 ARG 33 -1.052 -12.782 -9.632
220 HD2 ARG 33 HD2 ARG 33 0.585 -11.958 -11.295
221 HD3 ARG 33 HD3 ARG 33 1.874 -12.859 -10.471
222 HE ARG 33 HE ARG 33 -0.244 -14.646 -11.160
223 HH11 ARG 33 HH11 ARG 33 2.391 -12.863 -12.698
224 HH12 ARG 33 HH12 ARG 33 2.529 -14.012 -14.001
225 HH21 ARG 33 HH21 ARG 33 -0.004 -16.067 -12.858
226 HH22 ARG 33 HH22 ARG 33 1.195 -15.786 -14.089
227 H ALA 34 H ALA 34 -1.247 -10.284 -5.316
228 HA ALA 34 HA ALA 34 -0.760 -8.655 -3.854
229 HB1 ALA 34 HB1 ALA 34 1.403 -8.625 -2.756
230 HB2 ALA 34 HB2 ALA 34 0.953 -10.317 -3.064
231 HB3 ALA 34 HB3 ALA 34 2.156 -9.510 -4.098
232 H ILE 35 H ILE 35 -0.783 -8.154 -6.681
233 HA ILE 35 HA ILE 35 1.023 -5.779 -6.874
234 HB ILE 35 HB ILE 35 -0.905 -6.849 -8.952
235 HG12 ILE 35 HG12 ILE 35 2.101 -7.218 -8.660
236 HG13 ILE 35 HG13 ILE 35 0.880 -8.479 -8.480
237 HG21 ILE 35 HG21 ILE 35 -0.394 -4.419 -9.230
238 HG22 ILE 35 HG22 ILE 35 1.349 -4.783 -9.196
239 HG23 ILE 35 HG23 ILE 35 0.327 -5.354 -10.536
240 HD11 ILE 35 HD11 ILE 35 1.859 -8.766 -10.610
241 HD12 ILE 35 HD12 ILE 35 0.243 -8.070 -10.888
242 HD13 ILE 35 HD13 ILE 35 1.693 -7.041 -10.998
243 H CYS 36 H CYS 36 0.222 -3.779 -6.921
244 HA CYS 36 HA CYS 36 -2.589 -3.436 -5.915
245 HB2 CYS 36 HB2 CYS 36 -0.791 -2.500 -4.495
246 HB3 CYS 36 HB3 CYS 36 -0.203 -1.563 -5.867
247 H VAL 37 H VAL 37 -4.072 -2.571 -7.275
248 HA VAL 37 HA VAL 37 -3.069 -1.364 -9.805
249 HB VAL 37 HB VAL 37 -5.564 -3.056 -9.344
250 HG11 VAL 37 HG11 VAL 37 -5.727 -2.995 -11.845
251 HG12 VAL 37 HG12 VAL 37 -5.874 -1.379 -11.126
252 HG13 VAL 37 HG13 VAL 37 -4.346 -1.875 -11.892
253 HG21 VAL 37 HG21 VAL 37 -3.611 -4.496 -9.234
254 HG22 VAL 37 HG22 VAL 37 -4.422 -4.738 -10.790
255 HG23 VAL 37 HG23 VAL 37 -2.935 -3.762 -10.711
256 H CYS 38 H CYS 38 -3.314 0.697 -9.406
257 HA CYS 38 HA CYS 38 -5.431 1.827 -7.813
258 HB2 CYS 38 HB2 CYS 38 -3.644 3.140 -9.890
259 HB3 CYS 38 HB3 CYS 38 -4.662 3.986 -8.722
260 H ARG 39 H ARG 39 -7.250 2.954 -8.475
261 HA ARG 39 HA ARG 39 -8.364 2.208 -11.101
262 HB2 ARG 39 HB2 ARG 39 -9.461 3.761 -8.720
263 HB3 ARG 39 HB3 ARG 39 -10.375 3.433 -10.200
264 HG2 ARG 39 HG2 ARG 39 -10.209 1.015 -9.791
265 HG3 ARG 39 HG3 ARG 39 -9.271 1.315 -8.315
266 HD2 ARG 39 HD2 ARG 39 -11.174 2.500 -7.313
267 HD3 ARG 39 HD3 ARG 39 -12.102 2.306 -8.810
268 HE ARG 39 HE ARG 39 -12.510 0.074 -8.305
269 HH11 ARG 39 HH11 ARG 39 -10.209 1.339 -5.949
270 HH12 ARG 39 HH12 ARG 39 -10.336 -0.067 -4.924
271 HH21 ARG 39 HH21 ARG 39 -12.639 -1.676 -6.946
272 HH22 ARG 39 HH22 ARG 39 -11.710 -1.728 -5.473
273 H ASN 40 H ASN 40 -9.461 4.296 -12.181
274 HA ASN 40 HA ASN 40 -7.481 6.080 -12.883
275 HB2 ASN 40 HB2 ASN 40 -9.200 7.396 -13.977
276 HB3 ASN 40 HB3 ASN 40 -9.530 5.680 -14.243
277 HD21 ASN 40 HD21 ASN 40 -11.512 4.967 -13.801
278 HD22 ASN 40 HD22 ASN 40 -12.706 5.828 -12.863
Start of MODEL 10
1 H1 ALA 1 H1 ALA 1 2.276 -0.037 -9.242
2 H2 ALA 1 H2 ALA 1 2.672 -1.639 -9.217
3 H3 ALA 1 H3 ALA 1 1.152 -1.160 -8.791
4 HA ALA 1 HA ALA 1 3.632 -0.528 -7.318
5 HB1 ALA 1 HB1 ALA 1 1.976 1.297 -7.100
6 HB2 ALA 1 HB2 ALA 1 0.698 0.130 -6.691
7 HB3 ALA 1 HB3 ALA 1 2.057 0.394 -5.572
8 H THR 2 H THR 2 3.128 -1.421 -4.863
9 HA THR 2 HA THR 2 2.282 -4.253 -5.296
10 HB THR 2 HB THR 2 4.712 -4.021 -4.769
11 HG1 THR 2 HG1 THR 2 4.578 -5.732 -3.431
12 HG21 THR 2 HG21 THR 2 5.391 -3.342 -2.495
13 HG22 THR 2 HG22 THR 2 3.718 -2.894 -2.102
14 HG23 THR 2 HG23 THR 2 4.623 -1.983 -3.338
15 H CYS 3 H CYS 3 1.408 -5.365 -3.504
16 HA CYS 3 HA CYS 3 -0.311 -3.640 -1.750
17 HB2 CYS 3 HB2 CYS 3 -1.382 -5.173 -3.479
18 HB3 CYS 3 HB3 CYS 3 -0.669 -6.537 -2.617
19 H ASP 4 H ASP 4 2.547 -5.271 -1.792
20 HA ASP 4 HA ASP 4 2.347 -7.052 0.447
21 HB2 ASP 4 HB2 ASP 4 4.679 -5.690 -0.938
22 HB3 ASP 4 HB3 ASP 4 4.889 -6.797 0.421
23 H LEU 5 H LEU 5 3.359 -6.961 2.430
24 HA LEU 5 HA LEU 5 3.676 -4.246 3.604
25 HB2 LEU 5 HB2 LEU 5 3.602 -5.490 5.784
26 HB3 LEU 5 HB3 LEU 5 2.122 -5.618 4.846
27 HG LEU 5 HG LEU 5 3.994 -7.826 4.321
28 HD11 LEU 5 HD11 LEU 5 3.685 -8.983 6.430
29 HD12 LEU 5 HD12 LEU 5 2.786 -7.603 7.096
30 HD13 LEU 5 HD13 LEU 5 4.514 -7.437 6.707
31 HD21 LEU 5 HD21 LEU 5 1.958 -9.161 4.603
32 HD22 LEU 5 HD22 LEU 5 1.640 -7.757 3.564
33 HD23 LEU 5 HD23 LEU 5 1.093 -7.748 5.257
34 H LEU 6 H LEU 6 5.389 -4.961 1.812
35 HA LEU 6 HA LEU 6 7.738 -6.378 2.761
36 HB2 LEU 6 HB2 LEU 6 7.138 -6.077 0.360
37 HB3 LEU 6 HB3 LEU 6 7.377 -4.343 0.524
38 HG LEU 6 HG LEU 6 9.791 -4.725 0.958
39 HD11 LEU 6 HD11 LEU 6 10.751 -6.963 0.413
40 HD12 LEU 6 HD12 LEU 6 9.103 -7.633 0.354
41 HD13 LEU 6 HD13 LEU 6 9.757 -6.985 1.880
42 HD21 LEU 6 HD21 LEU 6 10.344 -5.333 -1.366
43 HD22 LEU 6 HD22 LEU 6 8.945 -4.241 -1.302
44 HD23 LEU 6 HD23 LEU 6 8.702 -5.981 -1.595
45 H SER 7 H SER 7 6.506 -3.138 2.790
46 HA SER 7 HA SER 7 9.020 -1.917 3.597
47 HB2 SER 7 HB2 SER 7 6.211 -0.810 3.545
48 HB3 SER 7 HB3 SER 7 7.713 0.142 3.567
49 HG SER 7 HG SER 7 8.217 -0.837 1.526
50 H GLY 8 H GLY 8 7.256 -3.807 5.425
51 HA2 GLY 8 HA2 GLY 8 7.301 -3.832 7.841
52 HA3 GLY 8 HA3 GLY 8 7.549 -2.054 7.815
53 H THR 9 H THR 9 5.817 -0.964 8.258
54 HA THR 9 HA THR 9 3.250 -1.868 8.577
55 HB THR 9 HB THR 9 3.384 0.104 9.478
56 HG1 THR 9 HG1 THR 9 3.136 1.431 7.032
57 HG21 THR 9 HG21 THR 9 4.835 2.040 8.660
58 HG22 THR 9 HG22 THR 9 5.435 0.940 7.401
59 HG23 THR 9 HG23 THR 9 5.720 0.583 9.132
60 H GLY 10 H GLY 10 1.361 -1.163 7.593
61 HA2 GLY 10 HA2 GLY 10 0.053 -0.899 5.545
62 HA3 GLY 10 HA3 GLY 10 1.466 -1.407 4.599
63 H VAL 11 H VAL 11 0.983 -3.168 7.479
64 HA VAL 11 HA VAL 11 0.685 -5.659 6.291
65 HB VAL 11 HB VAL 11 -0.250 -4.803 9.015
66 HG11 VAL 11 HG11 VAL 11 0.234 -7.164 9.675
67 HG12 VAL 11 HG12 VAL 11 -1.047 -7.062 8.451
68 HG13 VAL 11 HG13 VAL 11 0.599 -7.540 7.975
69 HG21 VAL 11 HG21 VAL 11 2.059 -5.613 9.752
70 HG22 VAL 11 HG22 VAL 11 2.512 -5.602 8.035
71 HG23 VAL 11 HG23 VAL 11 2.034 -4.095 8.840
72 H LYS 12 H LYS 12 -1.761 -3.400 7.366
73 HA LYS 12 HA LYS 12 -3.974 -5.089 6.511
74 HB2 LYS 12 HB2 LYS 12 -3.634 -2.153 7.159
75 HB3 LYS 12 HB3 LYS 12 -5.184 -2.835 6.643
76 HG2 LYS 12 HG2 LYS 12 -3.661 -3.704 9.135
77 HG3 LYS 12 HG3 LYS 12 -4.969 -2.512 9.123
78 HD2 LYS 12 HD2 LYS 12 -6.511 -4.248 8.191
79 HD3 LYS 12 HD3 LYS 12 -5.207 -5.447 8.339
80 HE2 LYS 12 HE2 LYS 12 -5.093 -5.012 10.782
81 HE3 LYS 12 HE3 LYS 12 -6.412 -3.834 10.629
82 HZ1 LYS 12 HZ1 LYS 12 -7.231 -5.987 11.361
83 HZ2 LYS 12 HZ2 LYS 12 -6.628 -6.733 10.020
84 HZ3 LYS 12 HZ3 LYS 12 -7.852 -5.637 9.874
85 H HIS 13 H HIS 13 -4.014 -5.602 4.393
86 HA HIS 13 HA HIS 13 -2.510 -4.283 2.408
87 HB2 HIS 13 HB2 HIS 13 -4.762 -6.286 2.322
88 HB3 HIS 13 HB3 HIS 13 -4.052 -5.645 0.841
89 HD1 HIS 13 HD1 HIS 13 -3.288 -8.215 0.403
90 HD2 HIS 13 HD2 HIS 13 -1.381 -6.211 3.557
91 HE1 HIS 13 HE1 HIS 13 -1.180 -9.537 0.960
92 HE2 HIS 13 HE2 HIS 13 -0.055 -8.315 2.863
93 H SER 14 H SER 14 -5.340 -3.092 3.725
94 HA SER 14 HA SER 14 -6.495 -1.773 1.490
95 HB2 SER 14 HB2 SER 14 -6.462 -0.302 4.037
96 HB3 SER 14 HB3 SER 14 -7.848 -0.882 3.081
97 HG SER 14 HG SER 14 -7.815 -2.067 4.955
98 H ALA 15 H ALA 15 -3.513 -1.389 3.048
99 HA ALA 15 HA ALA 15 -2.941 1.278 2.735
100 HB1 ALA 15 HB1 ALA 15 -1.507 -0.284 3.955
101 HB2 ALA 15 HB2 ALA 15 -1.087 -1.104 2.432
102 HB3 ALA 15 HB3 ALA 15 -0.571 0.577 2.712
103 H CYS 16 H CYS 16 -2.953 -1.300 0.323
104 HA CYS 16 HA CYS 16 -1.642 0.137 -1.752
105 HB2 CYS 16 HB2 CYS 16 -1.851 -2.092 -2.292
106 HB3 CYS 16 HB3 CYS 16 -3.446 -2.211 -1.549
107 H ALA 17 H ALA 17 -5.003 -0.111 -0.862
108 HA ALA 17 HA ALA 17 -6.005 1.461 -3.010
109 HB1 ALA 17 HB1 ALA 17 -7.471 -0.003 -1.640
110 HB2 ALA 17 HB2 ALA 17 -7.202 1.058 -0.236
111 HB3 ALA 17 HB3 ALA 17 -8.068 1.672 -1.660
112 H ALA 18 H ALA 18 -4.955 2.217 0.243
113 HA ALA 18 HA ALA 18 -5.572 4.995 0.141
114 HB1 ALA 18 HB1 ALA 18 -5.160 3.764 2.254
115 HB2 ALA 18 HB2 ALA 18 -3.450 3.571 1.795
116 HB3 ALA 18 HB3 ALA 18 -4.110 5.192 2.109
117 H HIS 19 H HIS 19 -2.669 3.196 -0.792
118 HA HIS 19 HA HIS 19 -1.016 5.392 -1.198
119 HB2 HIS 19 HB2 HIS 19 -0.274 3.013 -1.187
120 HB3 HIS 19 HB3 HIS 19 -1.007 2.820 -2.784
121 HD1 HIS 19 HD1 HIS 19 1.923 4.473 -1.015
122 HD2 HIS 19 HD2 HIS 19 0.462 3.956 -4.909
123 HE1 HIS 19 HE1 HIS 19 3.765 5.237 -2.604
124 HE2 HIS 19 HE2 HIS 19 2.866 4.920 -4.945
125 H CYS 20 H CYS 20 -3.454 3.892 -3.235
126 HA CYS 20 HA CYS 20 -2.848 5.523 -5.562
127 HB2 CYS 20 HB2 CYS 20 -5.331 3.959 -4.812
128 HB3 CYS 20 HB3 CYS 20 -4.979 4.626 -6.411
129 H LEU 21 H LEU 21 -5.230 5.662 -2.882
130 HA LEU 21 HA LEU 21 -6.718 7.905 -3.807
131 HB2 LEU 21 HB2 LEU 21 -6.034 6.866 -1.060
132 HB3 LEU 21 HB3 LEU 21 -7.035 8.285 -1.280
133 HG LEU 21 HG LEU 21 -7.741 5.517 -2.261
134 HD11 LEU 21 HD11 LEU 21 -9.314 5.483 -0.360
135 HD12 LEU 21 HD12 LEU 21 -8.671 7.045 0.198
136 HD13 LEU 21 HD13 LEU 21 -7.632 5.601 0.190
137 HD21 LEU 21 HD21 LEU 21 -10.016 6.469 -2.484
138 HD22 LEU 21 HD22 LEU 21 -8.857 7.300 -3.532
139 HD23 LEU 21 HD23 LEU 21 -9.385 8.067 -2.021
140 H LEU 22 H LEU 22 -3.633 7.692 -2.055
141 HA LEU 22 HA LEU 22 -3.377 10.492 -1.501
142 HB2 LEU 22 HB2 LEU 22 -1.398 8.224 -1.765
143 HB3 LEU 22 HB3 LEU 22 -0.880 9.865 -1.400
144 HG LEU 22 HG LEU 22 -2.848 8.332 0.327
145 HD11 LEU 22 HD11 LEU 22 -0.700 7.144 0.243
146 HD12 LEU 22 HD12 LEU 22 -0.933 7.911 1.825
147 HD13 LEU 22 HD13 LEU 22 0.165 8.651 0.636
148 HD21 LEU 22 HD21 LEU 22 -2.182 10.008 2.037
149 HD22 LEU 22 HD22 LEU 22 -2.951 10.762 0.629
150 HD23 LEU 22 HD23 LEU 22 -1.185 10.838 0.818
151 H ARG 23 H ARG 23 -3.231 8.893 -4.525
152 HA ARG 23 HA ARG 23 -1.536 11.075 -5.687
153 HB2 ARG 23 HB2 ARG 23 -2.739 8.645 -7.046
154 HB3 ARG 23 HB3 ARG 23 -1.591 9.788 -7.745
155 HG2 ARG 23 HG2 ARG 23 -0.016 9.011 -5.814
156 HG3 ARG 23 HG3 ARG 23 -1.121 7.621 -5.726
157 HD2 ARG 23 HD2 ARG 23 0.457 8.587 -8.133
158 HD3 ARG 23 HD3 ARG 23 0.675 7.058 -7.256
159 HE ARG 23 HE ARG 23 -1.989 7.062 -8.132
160 HH11 ARG 23 HH11 ARG 23 1.141 7.258 -9.774
161 HH12 ARG 23 HH12 ARG 23 0.515 6.536 -11.231
162 HH21 ARG 23 HH21 ARG 23 -2.700 6.164 -9.982
163 HH22 ARG 23 HH22 ARG 23 -1.632 5.919 -11.350
164 H GLY 24 H GLY 24 -4.640 10.734 -4.752
165 HA2 GLY 24 HA2 GLY 24 -6.479 12.013 -5.377
166 HA3 GLY 24 HA3 GLY 24 -5.618 12.553 -6.828
167 H ASN 25 H ASN 25 -5.521 9.139 -6.441
168 HA ASN 25 HA ASN 25 -7.389 8.810 -8.704
169 HB2 ASN 25 HB2 ASN 25 -5.911 6.734 -7.029
170 HB3 ASN 25 HB3 ASN 25 -6.868 6.395 -8.465
171 HD21 ASN 25 HD21 ASN 25 -6.126 8.348 -10.220
172 HD22 ASN 25 HD22 ASN 25 -4.418 8.203 -10.561
173 H ARG 26 H ARG 26 -9.152 7.227 -8.547
174 HA ARG 26 HA ARG 26 -10.914 7.718 -6.367
175 HB2 ARG 26 HB2 ARG 26 -10.826 5.942 -8.750
176 HB3 ARG 26 HB3 ARG 26 -11.959 5.523 -7.476
177 HG2 ARG 26 HG2 ARG 26 -12.701 7.033 -9.537
178 HG3 ARG 26 HG3 ARG 26 -13.379 7.251 -7.927
179 HD2 ARG 26 HD2 ARG 26 -12.937 9.417 -8.867
180 HD3 ARG 26 HD3 ARG 26 -11.818 9.153 -7.529
181 HE ARG 26 HE ARG 26 -10.651 8.421 -10.093
182 HH11 ARG 26 HH11 ARG 26 -11.344 11.200 -8.011
183 HH12 ARG 26 HH12 ARG 26 -10.021 12.126 -8.664
184 HH21 ARG 26 HH21 ARG 26 -8.985 9.680 -10.866
185 HH22 ARG 26 HH22 ARG 26 -8.745 11.299 -10.251
186 H GLY 27 H GLY 27 -8.320 5.442 -6.661
187 HA2 GLY 27 HA2 GLY 27 -7.894 4.668 -4.185
188 HA3 GLY 27 HA3 GLY 27 -9.429 3.787 -4.450
189 H GLY 28 H GLY 28 -7.945 1.823 -4.120
190 HA2 GLY 28 HA2 GLY 28 -7.143 0.904 -6.801
191 HA3 GLY 28 HA3 GLY 28 -5.861 0.953 -5.576
192 H TYR 29 H TYR 29 -6.432 -1.495 -6.659
193 HA TYR 29 HA TYR 29 -7.607 -2.827 -4.358
194 HB2 TYR 29 HB2 TYR 29 -8.836 -4.430 -5.724
195 HB3 TYR 29 HB3 TYR 29 -9.441 -2.792 -5.971
196 HD1 TYR 29 HD2 TYR 29 -9.028 -1.603 -8.129
197 HD2 TYR 29 HD1 TYR 29 -7.725 -5.664 -7.523
198 HE1 TYR 29 HE2 TYR 29 -8.755 -1.891 -10.592
199 HE2 TYR 29 HE1 TYR 29 -7.452 -5.935 -9.984
200 HH TYR 29 HH TYR 29 -8.205 -3.322 -12.289
201 H CYS 30 H CYS 30 -6.894 -5.166 -4.285
202 HA CYS 30 HA CYS 30 -4.158 -5.292 -5.440
203 HB2 CYS 30 HB2 CYS 30 -5.344 -6.785 -3.085
204 HB3 CYS 30 HB3 CYS 30 -3.683 -6.926 -3.680
205 H ASN 31 H ASN 31 -3.561 -6.844 -6.770
206 HA ASN 31 HA ASN 31 -5.527 -8.865 -7.677
207 HB2 ASN 31 HB2 ASN 31 -2.621 -8.277 -8.407
208 HB3 ASN 31 HB3 ASN 31 -3.552 -9.607 -9.105
209 HD21 ASN 31 HD21 ASN 31 -2.411 -7.649 -10.681
210 HD22 ASN 31 HD22 ASN 31 -3.696 -6.713 -11.403
211 H GLY 32 H GLY 32 -4.882 -11.192 -7.629
212 HA2 GLY 32 HA2 GLY 32 -4.058 -12.008 -5.026
213 HA3 GLY 32 HA3 GLY 32 -4.303 -13.057 -6.422
214 H ARG 33 H ARG 33 -1.982 -10.809 -7.292
215 HA ARG 33 HA ARG 33 0.183 -12.556 -6.445
216 HB2 ARG 33 HB2 ARG 33 0.018 -10.786 -8.887
217 HB3 ARG 33 HB3 ARG 33 1.467 -11.663 -8.380
218 HG2 ARG 33 HG2 ARG 33 0.143 -13.800 -8.552
219 HG3 ARG 33 HG3 ARG 33 -1.155 -12.856 -9.313
220 HD2 ARG 33 HD2 ARG 33 0.424 -12.120 -11.071
221 HD3 ARG 33 HD3 ARG 33 1.719 -13.057 -10.296
222 HE ARG 33 HE ARG 33 -0.492 -14.776 -10.825
223 HH11 ARG 33 HH11 ARG 33 2.075 -13.097 -12.576
224 HH12 ARG 33 HH12 ARG 33 2.080 -14.263 -13.870
225 HH21 ARG 33 HH21 ARG 33 -0.426 -16.222 -12.516
226 HH22 ARG 33 HH22 ARG 33 0.687 -15.995 -13.836
227 H ALA 34 H ALA 34 -1.153 -10.246 -5.108
228 HA ALA 34 HA ALA 34 -0.617 -8.560 -3.727
229 HB1 ALA 34 HB1 ALA 34 1.586 -8.483 -2.709
230 HB2 ALA 34 HB2 ALA 34 1.131 -10.185 -2.934
231 HB3 ALA 34 HB3 ALA 34 2.290 -9.416 -4.043
232 H ILE 35 H ILE 35 -0.701 -8.183 -6.579
233 HA ILE 35 HA ILE 35 1.058 -5.791 -6.913
234 HB ILE 35 HB ILE 35 -0.920 -6.964 -8.889
235 HG12 ILE 35 HG12 ILE 35 2.097 -7.284 -8.684
236 HG13 ILE 35 HG13 ILE 35 0.901 -8.552 -8.408
237 HG21 ILE 35 HG21 ILE 35 -0.451 -4.542 -9.276
238 HG22 ILE 35 HG22 ILE 35 1.298 -4.884 -9.286
239 HG23 ILE 35 HG23 ILE 35 0.240 -5.520 -10.568
240 HD11 ILE 35 HD11 ILE 35 1.602 -7.210 -11.012
241 HD12 ILE 35 HD12 ILE 35 1.807 -8.915 -10.559
242 HD13 ILE 35 HD13 ILE 35 0.174 -8.254 -10.805
243 H CYS 36 H CYS 36 0.224 -3.804 -7.012
244 HA CYS 36 HA CYS 36 -2.594 -3.466 -6.017
245 HB2 CYS 36 HB2 CYS 36 -0.856 -2.575 -4.525
246 HB3 CYS 36 HB3 CYS 36 -0.188 -1.632 -5.855
247 H VAL 37 H VAL 37 -4.043 -2.529 -7.365
248 HA VAL 37 HA VAL 37 -2.993 -1.280 -9.856
249 HB VAL 37 HB VAL 37 -5.493 -2.983 -9.473
250 HG11 VAL 37 HG11 VAL 37 -5.629 -2.847 -11.976
251 HG12 VAL 37 HG12 VAL 37 -5.800 -1.258 -11.206
252 HG13 VAL 37 HG13 VAL 37 -4.259 -1.715 -11.971
253 HG21 VAL 37 HG21 VAL 37 -3.535 -4.420 -9.393
254 HG22 VAL 37 HG22 VAL 37 -4.337 -4.619 -10.961
255 HG23 VAL 37 HG23 VAL 37 -2.853 -3.641 -10.845
256 H CYS 38 H CYS 38 -3.265 0.765 -9.463
257 HA CYS 38 HA CYS 38 -5.410 1.888 -7.892
258 HB2 CYS 38 HB2 CYS 38 -3.562 3.208 -9.913
259 HB3 CYS 38 HB3 CYS 38 -4.611 4.053 -8.771
260 H ARG 39 H ARG 39 -7.185 3.074 -8.583
261 HA ARG 39 HA ARG 39 -8.229 2.397 -11.258
262 HB2 ARG 39 HB2 ARG 39 -9.422 3.826 -8.847
263 HB3 ARG 39 HB3 ARG 39 -10.286 3.545 -10.367
264 HG2 ARG 39 HG2 ARG 39 -10.083 1.114 -10.055
265 HG3 ARG 39 HG3 ARG 39 -9.197 1.369 -8.540
266 HD2 ARG 39 HD2 ARG 39 -11.153 2.473 -7.549
267 HD3 ARG 39 HD3 ARG 39 -12.032 2.320 -9.081
268 HE ARG 39 HE ARG 39 -12.399 0.060 -8.683
269 HH11 ARG 39 HH11 ARG 39 -10.215 1.281 -6.195
270 HH12 ARG 39 HH12 ARG 39 -10.349 -0.166 -5.230
271 HH21 ARG 39 HH21 ARG 39 -12.534 -1.745 -7.401
272 HH22 ARG 39 HH22 ARG 39 -11.658 -1.837 -5.899
273 H ASN 40 H ASN 40 -9.329 4.521 -12.271
274 HA ASN 40 HA ASN 40 -7.347 6.343 -12.860
275 HB2 ASN 40 HB2 ASN 40 -9.052 7.686 -13.945
276 HB3 ASN 40 HB3 ASN 40 -9.357 5.977 -14.281
277 HD21 ASN 40 HD21 ASN 40 -11.363 5.285 -13.997
278 HD22 ASN 40 HD22 ASN 40 -12.583 6.074 -13.028
Start of MODEL 11
1 H1 ALA 1 H1 ALA 1 1.371 0.346 -9.280
2 H2 ALA 1 H2 ALA 1 1.843 -1.234 -9.367
3 H3 ALA 1 H3 ALA 1 0.388 -0.848 -8.698
4 HA ALA 1 HA ALA 1 3.037 -0.131 -7.609
5 HB1 ALA 1 HB1 ALA 1 0.229 0.371 -6.462
6 HB2 ALA 1 HB2 ALA 1 1.761 0.739 -5.634
7 HB3 ALA 1 HB3 ALA 1 1.319 1.612 -7.116
8 H THR 2 H THR 2 2.627 -1.038 -4.997
9 HA THR 2 HA THR 2 2.036 -3.930 -5.464
10 HB THR 2 HB THR 2 4.460 -3.528 -5.079
11 HG1 THR 2 HG1 THR 2 4.572 -5.195 -3.598
12 HG21 THR 2 HG21 THR 2 5.226 -2.849 -2.832
13 HG22 THR 2 HG22 THR 2 3.552 -2.525 -2.335
14 HG23 THR 2 HG23 THR 2 4.320 -1.531 -3.600
15 H CYS 3 H CYS 3 1.335 -5.148 -3.666
16 HA CYS 3 HA CYS 3 -0.393 -3.591 -1.772
17 HB2 CYS 3 HB2 CYS 3 -1.426 -5.165 -3.519
18 HB3 CYS 3 HB3 CYS 3 -0.641 -6.489 -2.657
19 H ASP 4 H ASP 4 2.569 -4.920 -1.964
20 HA ASP 4 HA ASP 4 2.708 -6.893 0.068
21 HB2 ASP 4 HB2 ASP 4 4.754 -4.916 -1.002
22 HB3 ASP 4 HB3 ASP 4 5.147 -6.156 0.197
23 H LEU 5 H LEU 5 3.448 -6.887 2.139
24 HA LEU 5 HA LEU 5 3.520 -4.264 3.562
25 HB2 LEU 5 HB2 LEU 5 2.855 -5.594 5.599
26 HB3 LEU 5 HB3 LEU 5 1.597 -5.490 4.373
27 HG LEU 5 HG LEU 5 3.265 -7.869 3.998
28 HD11 LEU 5 HD11 LEU 5 2.513 -9.119 5.936
29 HD12 LEU 5 HD12 LEU 5 1.703 -7.679 6.586
30 HD13 LEU 5 HD13 LEU 5 3.474 -7.716 6.449
31 HD21 LEU 5 HD21 LEU 5 1.083 -8.959 3.870
32 HD22 LEU 5 HD22 LEU 5 1.071 -7.447 2.931
33 HD23 LEU 5 HD23 LEU 5 0.287 -7.507 4.529
34 H LEU 6 H LEU 6 5.505 -5.099 2.139
35 HA LEU 6 HA LEU 6 7.398 -6.833 3.490
36 HB2 LEU 6 HB2 LEU 6 7.352 -6.391 1.030
37 HB3 LEU 6 HB3 LEU 6 7.817 -4.723 1.337
38 HG LEU 6 HG LEU 6 9.993 -5.499 2.238
39 HD11 LEU 6 HD11 LEU 6 10.688 -7.858 1.803
40 HD12 LEU 6 HD12 LEU 6 9.006 -8.253 1.378
41 HD13 LEU 6 HD13 LEU 6 9.417 -7.736 3.032
42 HD21 LEU 6 HD21 LEU 6 10.930 -6.165 0.058
43 HD22 LEU 6 HD22 LEU 6 9.737 -4.862 -0.125
44 HD23 LEU 6 HD23 LEU 6 9.294 -6.537 -0.540
45 H SER 7 H SER 7 6.620 -3.441 3.468
46 HA SER 7 HA SER 7 9.066 -2.610 4.787
47 HB2 SER 7 HB2 SER 7 6.479 -1.125 4.328
48 HB3 SER 7 HB3 SER 7 8.076 -0.398 4.620
49 HG SER 7 HG SER 7 8.756 -1.346 2.634
50 H GLY 8 H GLY 8 6.777 -4.314 6.153
51 HA2 GLY 8 HA2 GLY 8 6.428 -4.413 8.553
52 HA3 GLY 8 HA3 GLY 8 6.797 -2.665 8.639
53 H THR 9 H THR 9 5.122 -1.443 8.826
54 HA THR 9 HA THR 9 2.493 -2.183 8.849
55 HB THR 9 HB THR 9 2.647 -0.228 9.792
56 HG1 THR 9 HG1 THR 9 2.737 1.121 7.342
57 HG21 THR 9 HG21 THR 9 4.293 1.619 9.155
58 HG22 THR 9 HG22 THR 9 4.951 0.495 7.947
59 HG23 THR 9 HG23 THR 9 5.034 0.104 9.693
60 H GLY 10 H GLY 10 0.755 -1.376 7.712
61 HA2 GLY 10 HA2 GLY 10 -0.387 -1.057 5.597
62 HA3 GLY 10 HA3 GLY 10 1.096 -1.524 4.738
63 H VAL 11 H VAL 11 0.426 -3.398 7.482
64 HA VAL 11 HA VAL 11 0.193 -5.847 6.196
65 HB VAL 11 HB VAL 11 -0.905 -5.066 8.887
66 HG11 VAL 11 HG11 VAL 11 -0.541 -7.461 9.500
67 HG12 VAL 11 HG12 VAL 11 -1.759 -7.263 8.225
68 HG13 VAL 11 HG13 VAL 11 -0.118 -7.803 7.809
69 HG21 VAL 11 HG21 VAL 11 1.303 -5.940 9.763
70 HG22 VAL 11 HG22 VAL 11 1.879 -5.997 8.084
71 HG23 VAL 11 HG23 VAL 11 1.433 -4.447 8.821
72 H LYS 12 H LYS 12 -2.318 -3.639 7.223
73 HA LYS 12 HA LYS 12 -4.458 -5.321 6.188
74 HB2 LYS 12 HB2 LYS 12 -4.216 -2.431 7.041
75 HB3 LYS 12 HB3 LYS 12 -5.729 -3.114 6.426
76 HG2 LYS 12 HG2 LYS 12 -4.263 -4.079 8.920
77 HG3 LYS 12 HG3 LYS 12 -5.646 -2.973 8.918
78 HD2 LYS 12 HD2 LYS 12 -7.025 -4.753 7.808
79 HD3 LYS 12 HD3 LYS 12 -5.650 -5.869 7.957
80 HE2 LYS 12 HE2 LYS 12 -5.683 -5.560 10.425
81 HE3 LYS 12 HE3 LYS 12 -7.082 -4.480 10.262
82 HZ1 LYS 12 HZ1 LYS 12 -7.762 -6.728 10.836
83 HZ2 LYS 12 HZ2 LYS 12 -7.034 -7.348 9.492
84 HZ3 LYS 12 HZ3 LYS 12 -8.335 -6.344 9.339
85 H HIS 13 H HIS 13 -4.586 -5.643 4.058
86 HA HIS 13 HA HIS 13 -2.998 -4.285 2.168
87 HB2 HIS 13 HB2 HIS 13 -5.385 -6.121 1.916
88 HB3 HIS 13 HB3 HIS 13 -4.549 -5.472 0.503
89 HD1 HIS 13 HD1 HIS 13 -4.510 -8.523 0.906
90 HD2 HIS 13 HD2 HIS 13 -1.551 -5.943 2.394
91 HE1 HIS 13 HE1 HIS 13 -2.396 -9.914 1.227
92 HE2 HIS 13 HE2 HIS 13 -0.633 -8.336 2.124
93 H SER 14 H SER 14 -5.724 -2.956 3.562
94 HA SER 14 HA SER 14 -6.788 -1.475 1.382
95 HB2 SER 14 HB2 SER 14 -6.656 -0.074 3.952
96 HB3 SER 14 HB3 SER 14 -8.081 -0.582 3.013
97 HG SER 14 HG SER 14 -8.040 -1.761 4.911
98 H ALA 15 H ALA 15 -3.794 -1.372 2.968
99 HA ALA 15 HA ALA 15 -3.016 1.250 2.699
100 HB1 ALA 15 HB1 ALA 15 -1.726 -0.435 3.919
101 HB2 ALA 15 HB2 ALA 15 -1.343 -1.260 2.390
102 HB3 ALA 15 HB3 ALA 15 -0.708 0.374 2.706
103 H CYS 16 H CYS 16 -3.139 -1.317 0.278
104 HA CYS 16 HA CYS 16 -1.713 0.057 -1.769
105 HB2 CYS 16 HB2 CYS 16 -1.964 -2.111 -2.407
106 HB3 CYS 16 HB3 CYS 16 -3.490 -2.276 -1.543
107 H ALA 17 H ALA 17 -5.094 -0.078 -0.932
108 HA ALA 17 HA ALA 17 -6.017 1.524 -3.088
109 HB1 ALA 17 HB1 ALA 17 -7.536 0.109 -1.715
110 HB2 ALA 17 HB2 ALA 17 -7.261 1.187 -0.327
111 HB3 ALA 17 HB3 ALA 17 -8.089 1.798 -1.774
112 H ALA 18 H ALA 18 -4.974 2.261 0.173
113 HA ALA 18 HA ALA 18 -5.502 5.056 0.055
114 HB1 ALA 18 HB1 ALA 18 -5.128 3.822 2.175
115 HB2 ALA 18 HB2 ALA 18 -3.424 3.576 1.717
116 HB3 ALA 18 HB3 ALA 18 -4.035 5.218 2.024
117 H HIS 19 H HIS 19 -2.666 3.158 -0.878
118 HA HIS 19 HA HIS 19 -0.953 5.305 -1.297
119 HB2 HIS 19 HB2 HIS 19 -0.377 2.829 -1.276
120 HB3 HIS 19 HB3 HIS 19 -0.931 2.789 -2.956
121 HD1 HIS 19 HD1 HIS 19 1.934 3.858 -0.770
122 HD2 HIS 19 HD2 HIS 19 0.744 4.284 -4.767
123 HE1 HIS 19 HE1 HIS 19 3.956 4.732 -2.058
124 HE2 HIS 19 HE2 HIS 19 3.222 4.983 -4.460
125 H CYS 20 H CYS 20 -3.489 3.931 -3.286
126 HA CYS 20 HA CYS 20 -2.818 5.510 -5.635
127 HB2 CYS 20 HB2 CYS 20 -5.398 4.110 -4.886
128 HB3 CYS 20 HB3 CYS 20 -4.959 4.692 -6.495
129 H LEU 21 H LEU 21 -5.177 5.695 -2.949
130 HA LEU 21 HA LEU 21 -6.611 7.988 -3.815
131 HB2 LEU 21 HB2 LEU 21 -5.945 6.856 -1.106
132 HB3 LEU 21 HB3 LEU 21 -6.911 8.305 -1.273
133 HG LEU 21 HG LEU 21 -7.685 5.587 -2.334
134 HD11 LEU 21 HD11 LEU 21 -9.252 5.532 -0.426
135 HD12 LEU 21 HD12 LEU 21 -8.560 7.055 0.181
136 HD13 LEU 21 HD13 LEU 21 -7.564 5.585 0.113
137 HD21 LEU 21 HD21 LEU 21 -9.942 6.587 -2.512
138 HD22 LEU 21 HD22 LEU 21 -8.775 7.433 -3.538
139 HD23 LEU 21 HD23 LEU 21 -9.279 8.159 -2.001
140 H LEU 22 H LEU 22 -3.516 7.691 -2.099
141 HA LEU 22 HA LEU 22 -3.208 10.455 -1.436
142 HB2 LEU 22 HB2 LEU 22 -1.276 8.176 -1.885
143 HB3 LEU 22 HB3 LEU 22 -0.706 9.795 -1.500
144 HG LEU 22 HG LEU 22 -2.595 8.237 0.289
145 HD11 LEU 22 HD11 LEU 22 -0.458 7.041 0.042
146 HD12 LEU 22 HD12 LEU 22 -0.603 7.753 1.661
147 HD13 LEU 22 HD13 LEU 22 0.434 8.529 0.441
148 HD21 LEU 22 HD21 LEU 22 -1.813 9.857 2.008
149 HD22 LEU 22 HD22 LEU 22 -2.660 10.656 0.670
150 HD23 LEU 22 HD23 LEU 22 -0.884 10.716 0.757
151 H ARG 23 H ARG 23 -3.131 8.967 -4.535
152 HA ARG 23 HA ARG 23 -1.505 11.231 -5.640
153 HB2 ARG 23 HB2 ARG 23 -2.581 8.783 -7.064
154 HB3 ARG 23 HB3 ARG 23 -1.444 9.970 -7.703
155 HG2 ARG 23 HG2 ARG 23 0.096 9.210 -5.743
156 HG3 ARG 23 HG3 ARG 23 -0.980 7.794 -5.683
157 HD2 ARG 23 HD2 ARG 23 0.676 8.786 -8.020
158 HD3 ARG 23 HD3 ARG 23 0.837 7.239 -7.162
159 HE ARG 23 HE ARG 23 -1.772 7.232 -8.128
160 HH11 ARG 23 HH11 ARG 23 1.366 7.643 -9.718
161 HH12 ARG 23 HH12 ARG 23 0.777 7.001 -11.227
162 HH21 ARG 23 HH21 ARG 23 -2.436 6.437 -10.043
163 HH22 ARG 23 HH22 ARG 23 -1.348 6.323 -11.412
164 H GLY 24 H GLY 24 -4.585 10.784 -4.731
165 HA2 GLY 24 HA2 GLY 24 -6.462 12.002 -5.359
166 HA3 GLY 24 HA3 GLY 24 -5.615 12.573 -6.807
167 H ASN 25 H ASN 25 -5.376 9.174 -6.499
168 HA ASN 25 HA ASN 25 -7.268 8.805 -8.730
169 HB2 ASN 25 HB2 ASN 25 -5.717 6.760 -7.084
170 HB3 ASN 25 HB3 ASN 25 -6.673 6.403 -8.516
171 HD21 ASN 25 HD21 ASN 25 -6.003 8.355 -10.279
172 HD22 ASN 25 HD22 ASN 25 -4.292 8.278 -10.624
173 H ARG 26 H ARG 26 -9.034 7.223 -8.547
174 HA ARG 26 HA ARG 26 -10.739 7.742 -6.332
175 HB2 ARG 26 HB2 ARG 26 -10.746 5.994 -8.729
176 HB3 ARG 26 HB3 ARG 26 -11.854 5.575 -7.434
177 HG2 ARG 26 HG2 ARG 26 -12.633 7.123 -9.439
178 HG3 ARG 26 HG3 ARG 26 -13.240 7.353 -7.804
179 HD2 ARG 26 HD2 ARG 26 -12.776 9.509 -8.759
180 HD3 ARG 26 HD3 ARG 26 -11.617 9.213 -7.461
181 HE ARG 26 HE ARG 26 -10.498 8.431 -10.005
182 HH11 ARG 26 HH11 ARG 26 -11.266 11.324 -8.115
183 HH12 ARG 26 HH12 ARG 26 -9.995 12.252 -8.862
184 HH21 ARG 26 HH21 ARG 26 -8.897 9.685 -10.897
185 HH22 ARG 26 HH22 ARG 26 -8.707 11.354 -10.409
186 H GLY 27 H GLY 27 -8.202 5.417 -6.623
187 HA2 GLY 27 HA2 GLY 27 -7.771 4.583 -4.186
188 HA3 GLY 27 HA3 GLY 27 -9.365 3.799 -4.403
189 H GLY 28 H GLY 28 -7.999 1.733 -4.128
190 HA2 GLY 28 HA2 GLY 28 -7.381 0.758 -6.825
191 HA3 GLY 28 HA3 GLY 28 -6.009 0.795 -5.704
192 H TYR 29 H TYR 29 -6.635 -1.655 -6.651
193 HA TYR 29 HA TYR 29 -7.697 -2.927 -4.264
194 HB2 TYR 29 HB2 TYR 29 -9.015 -4.543 -5.473
195 HB3 TYR 29 HB3 TYR 29 -9.585 -2.920 -5.867
196 HD1 TYR 29 HD2 TYR 29 -9.170 -1.958 -8.139
197 HD2 TYR 29 HD1 TYR 29 -7.954 -5.972 -7.150
198 HE1 TYR 29 HE2 TYR 29 -8.922 -2.492 -10.564
199 HE2 TYR 29 HE1 TYR 29 -7.708 -6.486 -9.573
200 HH TYR 29 HH TYR 29 -8.431 -4.101 -12.117
201 H CYS 30 H CYS 30 -6.939 -5.271 -4.163
202 HA CYS 30 HA CYS 30 -4.245 -5.359 -5.419
203 HB2 CYS 30 HB2 CYS 30 -5.325 -6.877 -3.028
204 HB3 CYS 30 HB3 CYS 30 -3.676 -6.966 -3.666
205 H ASN 31 H ASN 31 -3.573 -6.973 -6.650
206 HA ASN 31 HA ASN 31 -5.506 -9.088 -7.469
207 HB2 ASN 31 HB2 ASN 31 -2.700 -8.297 -8.378
208 HB3 ASN 31 HB3 ASN 31 -3.514 -9.758 -8.948
209 HD21 ASN 31 HD21 ASN 31 -2.644 -7.669 -10.620
210 HD22 ASN 31 HD22 ASN 31 -4.069 -6.981 -11.356
211 H GLY 32 H GLY 32 -4.712 -11.375 -7.391
212 HA2 GLY 32 HA2 GLY 32 -3.731 -12.052 -4.803
213 HA3 GLY 32 HA3 GLY 32 -3.963 -13.161 -6.155
214 H ARG 33 H ARG 33 -1.860 -10.862 -7.278
215 HA ARG 33 HA ARG 33 0.464 -12.459 -6.580
216 HB2 ARG 33 HB2 ARG 33 0.033 -10.467 -8.814
217 HB3 ARG 33 HB3 ARG 33 1.575 -11.259 -8.473
218 HG2 ARG 33 HG2 ARG 33 0.417 -13.475 -8.822
219 HG3 ARG 33 HG3 ARG 33 -0.979 -12.560 -9.436
220 HD2 ARG 33 HD2 ARG 33 0.483 -11.490 -11.128
221 HD3 ARG 33 HD3 ARG 33 1.866 -12.413 -10.508
222 HE ARG 33 HE ARG 33 -0.212 -14.229 -11.201
223 HH11 ARG 33 HH11 ARG 33 2.125 -12.109 -12.790
224 HH12 ARG 33 HH12 ARG 33 2.177 -13.092 -14.228
225 HH21 ARG 33 HH21 ARG 33 -0.093 -15.431 -13.072
226 HH22 ARG 33 HH22 ARG 33 0.941 -14.933 -14.384
227 H ALA 34 H ALA 34 -1.020 -10.234 -5.110
228 HA ALA 34 HA ALA 34 -0.574 -8.538 -3.694
229 HB1 ALA 34 HB1 ALA 34 1.614 -8.375 -2.637
230 HB2 ALA 34 HB2 ALA 34 1.228 -10.094 -2.874
231 HB3 ALA 34 HB3 ALA 34 2.374 -9.276 -3.962
232 H ILE 35 H ILE 35 -0.660 -8.134 -6.539
233 HA ILE 35 HA ILE 35 1.004 -5.671 -6.843
234 HB ILE 35 HB ILE 35 -0.829 -6.997 -8.867
235 HG12 ILE 35 HG12 ILE 35 2.202 -7.038 -8.606
236 HG13 ILE 35 HG13 ILE 35 1.128 -8.402 -8.300
237 HG21 ILE 35 HG21 ILE 35 -0.556 -4.550 -9.280
238 HG22 ILE 35 HG22 ILE 35 1.214 -4.741 -9.233
239 HG23 ILE 35 HG23 ILE 35 0.256 -5.482 -10.536
240 HD11 ILE 35 HD11 ILE 35 1.725 -7.084 -10.943
241 HD12 ILE 35 HD12 ILE 35 2.091 -8.745 -10.433
242 HD13 ILE 35 HD13 ILE 35 0.402 -8.254 -10.713
243 H CYS 36 H CYS 36 0.055 -3.730 -7.029
244 HA CYS 36 HA CYS 36 -2.783 -3.539 -6.055
245 HB2 CYS 36 HB2 CYS 36 -1.102 -2.517 -4.577
246 HB3 CYS 36 HB3 CYS 36 -0.496 -1.557 -5.923
247 H VAL 37 H VAL 37 -4.271 -2.713 -7.399
248 HA VAL 37 HA VAL 37 -3.313 -1.502 -9.948
249 HB VAL 37 HB VAL 37 -5.853 -3.110 -9.414
250 HG11 VAL 37 HG11 VAL 37 -6.084 -3.065 -11.900
251 HG12 VAL 37 HG12 VAL 37 -6.137 -1.433 -11.204
252 HG13 VAL 37 HG13 VAL 37 -4.656 -2.011 -12.006
253 HG21 VAL 37 HG21 VAL 37 -3.939 -4.608 -9.330
254 HG22 VAL 37 HG22 VAL 37 -4.807 -4.849 -10.854
255 HG23 VAL 37 HG23 VAL 37 -3.287 -3.921 -10.839
256 H CYS 38 H CYS 38 -3.452 0.568 -9.491
257 HA CYS 38 HA CYS 38 -5.551 1.774 -7.916
258 HB2 CYS 38 HB2 CYS 38 -3.633 3.016 -9.924
259 HB3 CYS 38 HB3 CYS 38 -4.670 3.910 -8.811
260 H ARG 39 H ARG 39 -7.278 3.019 -8.617
261 HA ARG 39 HA ARG 39 -8.316 2.404 -11.308
262 HB2 ARG 39 HB2 ARG 39 -9.495 3.832 -8.892
263 HB3 ARG 39 HB3 ARG 39 -10.353 3.585 -10.423
264 HG2 ARG 39 HG2 ARG 39 -10.212 1.149 -10.135
265 HG3 ARG 39 HG3 ARG 39 -9.321 1.361 -8.618
266 HD2 ARG 39 HD2 ARG 39 -11.253 2.499 -7.612
267 HD3 ARG 39 HD3 ARG 39 -12.137 2.369 -9.143
268 HE ARG 39 HE ARG 39 -12.530 0.109 -8.761
269 HH11 ARG 39 HH11 ARG 39 -10.336 1.292 -6.260
270 HH12 ARG 39 HH12 ARG 39 -10.490 -0.159 -5.305
271 HH21 ARG 39 HH21 ARG 39 -12.687 -1.701 -7.488
272 HH22 ARG 39 HH22 ARG 39 -11.816 -1.811 -5.984
273 H ASN 40 H ASN 40 -9.340 4.578 -12.306
274 HA ASN 40 HA ASN 40 -7.286 6.335 -12.842
275 HB2 ASN 40 HB2 ASN 40 -8.911 7.738 -13.956
276 HB3 ASN 40 HB3 ASN 40 -9.302 6.047 -14.291
277 HD21 ASN 40 HD21 ASN 40 -11.328 5.407 -13.944
278 HD22 ASN 40 HD22 ASN 40 -12.517 6.289 -13.018
Start of MODEL 12
1 H1 ALA 1 H1 ALA 1 2.055 -0.128 -9.402
2 H2 ALA 1 H2 ALA 1 2.420 -1.738 -9.397
3 H3 ALA 1 H3 ALA 1 0.943 -1.227 -8.872
4 HA ALA 1 HA ALA 1 3.528 -0.634 -7.575
5 HB1 ALA 1 HB1 ALA 1 1.909 1.218 -7.263
6 HB2 ALA 1 HB2 ALA 1 0.657 0.070 -6.737
7 HB3 ALA 1 HB3 ALA 1 2.104 0.335 -5.734
8 H THR 2 H THR 2 2.941 -1.457 -5.006
9 HA THR 2 HA THR 2 2.152 -4.307 -5.425
10 HB THR 2 HB THR 2 4.608 -4.055 -5.041
11 HG1 THR 2 HG1 THR 2 4.600 -5.734 -3.566
12 HG21 THR 2 HG21 THR 2 5.400 -3.438 -2.788
13 HG22 THR 2 HG22 THR 2 3.747 -3.019 -2.292
14 HG23 THR 2 HG23 THR 2 4.575 -2.062 -3.546
15 H CYS 3 H CYS 3 1.378 -5.441 -3.622
16 HA CYS 3 HA CYS 3 -0.223 -3.755 -1.733
17 HB2 CYS 3 HB2 CYS 3 -1.356 -5.268 -3.470
18 HB3 CYS 3 HB3 CYS 3 -0.696 -6.635 -2.569
19 H ASP 4 H ASP 4 2.649 -5.197 -1.880
20 HA ASP 4 HA ASP 4 2.676 -7.183 0.162
21 HB2 ASP 4 HB2 ASP 4 4.827 -5.367 -0.979
22 HB3 ASP 4 HB3 ASP 4 5.160 -6.608 0.234
23 H LEU 5 H LEU 5 3.689 -7.195 2.175
24 HA LEU 5 HA LEU 5 3.774 -4.574 3.612
25 HB2 LEU 5 HB2 LEU 5 3.342 -5.954 5.687
26 HB3 LEU 5 HB3 LEU 5 1.982 -5.943 4.570
27 HG LEU 5 HG LEU 5 3.834 -8.192 4.116
28 HD11 LEU 5 HD11 LEU 5 3.219 -9.493 6.048
29 HD12 LEU 5 HD12 LEU 5 2.236 -8.160 6.689
30 HD13 LEU 5 HD13 LEU 5 4.005 -7.994 6.583
31 HD21 LEU 5 HD21 LEU 5 1.732 -9.452 4.023
32 HD22 LEU 5 HD22 LEU 5 1.633 -7.975 3.039
33 HD23 LEU 5 HD23 LEU 5 0.839 -8.034 4.635
34 H LEU 6 H LEU 6 5.672 -5.247 2.031
35 HA LEU 6 HA LEU 6 7.698 -6.946 3.227
36 HB2 LEU 6 HB2 LEU 6 7.351 -6.681 0.776
37 HB3 LEU 6 HB3 LEU 6 7.855 -5.001 0.899
38 HG LEU 6 HG LEU 6 10.127 -5.739 1.575
39 HD11 LEU 6 HD11 LEU 6 10.748 -8.132 1.232
40 HD12 LEU 6 HD12 LEU 6 9.023 -8.533 1.051
41 HD13 LEU 6 HD13 LEU 6 9.643 -7.904 2.598
42 HD21 LEU 6 HD21 LEU 6 10.771 -6.578 -0.654
43 HD22 LEU 6 HD22 LEU 6 9.575 -5.272 -0.777
44 HD23 LEU 6 HD23 LEU 6 9.069 -6.963 -1.007
45 H SER 7 H SER 7 7.050 -3.503 2.994
46 HA SER 7 HA SER 7 9.673 -2.791 4.072
47 HB2 SER 7 HB2 SER 7 7.268 -1.070 3.468
48 HB3 SER 7 HB3 SER 7 8.945 -0.511 3.662
49 HG SER 7 HG SER 7 9.461 -1.802 1.805
50 H GLY 8 H GLY 8 7.212 -4.032 5.586
51 HA2 GLY 8 HA2 GLY 8 7.227 -3.908 8.076
52 HA3 GLY 8 HA3 GLY 8 7.315 -2.137 7.878
53 H THR 9 H THR 9 5.461 -1.240 8.251
54 HA THR 9 HA THR 9 2.997 -2.397 8.415
55 HB THR 9 HB THR 9 2.911 -0.458 9.356
56 HG1 THR 9 HG1 THR 9 2.519 0.915 6.964
57 HG21 THR 9 HG21 THR 9 4.115 1.660 8.591
58 HG22 THR 9 HG22 THR 9 4.876 0.656 7.339
59 HG23 THR 9 HG23 THR 9 5.162 0.317 9.073
60 H GLY 10 H GLY 10 1.098 -1.833 7.393
61 HA2 GLY 10 HA2 GLY 10 -0.136 -1.567 5.284
62 HA3 GLY 10 HA3 GLY 10 1.299 -2.122 4.401
63 H VAL 11 H VAL 11 0.747 -3.811 7.297
64 HA VAL 11 HA VAL 11 0.282 -6.305 6.130
65 HB VAL 11 HB VAL 11 -0.515 -5.382 8.866
66 HG11 VAL 11 HG11 VAL 11 -0.148 -7.752 9.540
67 HG12 VAL 11 HG12 VAL 11 -1.429 -7.603 8.322
68 HG13 VAL 11 HG13 VAL 11 0.190 -8.162 7.843
69 HG21 VAL 11 HG21 VAL 11 1.765 -6.293 9.568
70 HG22 VAL 11 HG22 VAL 11 2.188 -6.304 7.844
71 HG23 VAL 11 HG23 VAL 11 1.789 -4.777 8.654
72 H LYS 12 H LYS 12 -1.866 -3.857 7.330
73 HA LYS 12 HA LYS 12 -4.275 -5.232 6.467
74 HB2 LYS 12 HB2 LYS 12 -3.562 -2.420 7.297
75 HB3 LYS 12 HB3 LYS 12 -5.201 -2.873 6.801
76 HG2 LYS 12 HG2 LYS 12 -3.699 -4.048 9.183
77 HG3 LYS 12 HG3 LYS 12 -4.905 -2.756 9.280
78 HD2 LYS 12 HD2 LYS 12 -6.609 -4.315 8.305
79 HD3 LYS 12 HD3 LYS 12 -5.398 -5.617 8.351
80 HE2 LYS 12 HE2 LYS 12 -5.180 -5.310 10.810
81 HE3 LYS 12 HE3 LYS 12 -6.417 -4.038 10.755
82 HZ1 LYS 12 HZ1 LYS 12 -7.362 -6.164 11.410
83 HZ2 LYS 12 HZ2 LYS 12 -6.852 -6.882 10.017
84 HZ3 LYS 12 HZ3 LYS 12 -8.000 -5.700 9.964
85 H HIS 13 H HIS 13 -4.229 -5.659 4.315
86 HA HIS 13 HA HIS 13 -2.641 -4.281 2.440
87 HB2 HIS 13 HB2 HIS 13 -4.959 -6.195 2.183
88 HB3 HIS 13 HB3 HIS 13 -4.146 -5.529 0.767
89 HD1 HIS 13 HD1 HIS 13 -3.916 -8.514 0.995
90 HD2 HIS 13 HD2 HIS 13 -1.210 -5.916 2.876
91 HE1 HIS 13 HE1 HIS 13 -1.770 -9.832 1.397
92 HE2 HIS 13 HE2 HIS 13 -0.161 -8.246 2.526
93 H SER 14 H SER 14 -5.420 -2.998 3.754
94 HA SER 14 HA SER 14 -6.526 -1.625 1.535
95 HB2 SER 14 HB2 SER 14 -6.456 -0.096 4.013
96 HB3 SER 14 HB3 SER 14 -7.858 -0.783 3.157
97 HG SER 14 HG SER 14 -7.651 -1.799 5.149
98 H ALA 15 H ALA 15 -3.550 -1.356 3.096
99 HA ALA 15 HA ALA 15 -2.883 1.266 2.790
100 HB1 ALA 15 HB1 ALA 15 -1.511 -0.319 4.029
101 HB2 ALA 15 HB2 ALA 15 -1.102 -1.162 2.514
102 HB3 ALA 15 HB3 ALA 15 -0.531 0.501 2.795
103 H CYS 16 H CYS 16 -2.794 -1.295 0.366
104 HA CYS 16 HA CYS 16 -1.471 0.210 -1.647
105 HB2 CYS 16 HB2 CYS 16 -1.544 -1.966 -2.321
106 HB3 CYS 16 HB3 CYS 16 -3.066 -2.257 -1.477
107 H ALA 17 H ALA 17 -4.820 -0.159 -0.848
108 HA ALA 17 HA ALA 17 -5.839 1.368 -3.018
109 HB1 ALA 17 HB1 ALA 17 -7.269 -0.158 -1.676
110 HB2 ALA 17 HB2 ALA 17 -7.088 0.927 -0.276
111 HB3 ALA 17 HB3 ALA 17 -7.940 1.488 -1.729
112 H ALA 18 H ALA 18 -4.872 2.170 0.236
113 HA ALA 18 HA ALA 18 -5.605 4.924 0.114
114 HB1 ALA 18 HB1 ALA 18 -5.201 3.721 2.244
115 HB2 ALA 18 HB2 ALA 18 -3.475 3.586 1.826
116 HB3 ALA 18 HB3 ALA 18 -4.200 5.185 2.117
117 H HIS 19 H HIS 19 -2.626 3.231 -0.720
118 HA HIS 19 HA HIS 19 -1.067 5.472 -1.092
119 HB2 HIS 19 HB2 HIS 19 -0.297 3.073 -1.008
120 HB3 HIS 19 HB3 HIS 19 -0.810 2.935 -2.695
121 HD1 HIS 19 HD1 HIS 19 1.707 4.798 -0.487
122 HD2 HIS 19 HD2 HIS 19 0.998 3.985 -4.538
123 HE1 HIS 19 HE1 HIS 19 3.750 5.616 -1.775
124 HE2 HIS 19 HE2 HIS 19 3.308 5.118 -4.210
125 H CYS 20 H CYS 20 -3.374 3.872 -3.182
126 HA CYS 20 HA CYS 20 -2.769 5.495 -5.510
127 HB2 CYS 20 HB2 CYS 20 -5.191 3.829 -4.788
128 HB3 CYS 20 HB3 CYS 20 -4.890 4.547 -6.374
129 H LEU 21 H LEU 21 -5.193 5.599 -2.868
130 HA LEU 21 HA LEU 21 -6.768 7.748 -3.866
131 HB2 LEU 21 HB2 LEU 21 -6.078 6.792 -1.093
132 HB3 LEU 21 HB3 LEU 21 -7.091 8.197 -1.334
133 HG LEU 21 HG LEU 21 -7.780 5.414 -2.279
134 HD11 LEU 21 HD11 LEU 21 -9.348 5.391 -0.373
135 HD12 LEU 21 HD12 LEU 21 -8.707 6.959 0.170
136 HD13 LEU 21 HD13 LEU 21 -7.663 5.520 0.168
137 HD21 LEU 21 HD21 LEU 21 -10.059 6.351 -2.510
138 HD22 LEU 21 HD22 LEU 21 -8.909 7.192 -3.559
139 HD23 LEU 21 HD23 LEU 21 -9.442 7.956 -2.050
140 H LEU 22 H LEU 22 -3.713 7.722 -2.056
141 HA LEU 22 HA LEU 22 -3.592 10.529 -1.528
142 HB2 LEU 22 HB2 LEU 22 -1.473 8.392 -1.846
143 HB3 LEU 22 HB3 LEU 22 -1.071 10.057 -1.448
144 HG LEU 22 HG LEU 22 -2.897 8.336 0.259
145 HD11 LEU 22 HD11 LEU 22 -0.646 7.347 0.126
146 HD12 LEU 22 HD12 LEU 22 -0.946 8.039 1.732
147 HD13 LEU 22 HD13 LEU 22 0.077 8.913 0.568
148 HD21 LEU 22 HD21 LEU 22 -2.362 10.027 2.002
149 HD22 LEU 22 HD22 LEU 22 -3.211 10.738 0.618
150 HD23 LEU 22 HD23 LEU 22 -1.456 10.966 0.793
151 H ARG 23 H ARG 23 -3.118 8.803 -4.526
152 HA ARG 23 HA ARG 23 -1.586 11.047 -5.719
153 HB2 ARG 23 HB2 ARG 23 -2.845 8.643 -7.074
154 HB3 ARG 23 HB3 ARG 23 -1.673 9.763 -7.773
155 HG2 ARG 23 HG2 ARG 23 -0.127 8.941 -5.818
156 HG3 ARG 23 HG3 ARG 23 -1.252 7.564 -5.780
157 HD2 ARG 23 HD2 ARG 23 0.413 8.554 -8.116
158 HD3 ARG 23 HD3 ARG 23 0.543 6.988 -7.288
159 HE ARG 23 HE ARG 23 -2.088 7.127 -8.255
160 HH11 ARG 23 HH11 ARG 23 1.105 7.248 -9.778
161 HH12 ARG 23 HH12 ARG 23 0.503 6.600 -11.280
162 HH21 ARG 23 HH21 ARG 23 -2.768 6.322 -10.160
163 HH22 ARG 23 HH22 ARG 23 -1.661 6.078 -11.496
164 H GLY 24 H GLY 24 -4.725 10.699 -4.800
165 HA2 GLY 24 HA2 GLY 24 -6.539 12.024 -5.418
166 HA3 GLY 24 HA3 GLY 24 -5.665 12.565 -6.861
167 H ASN 25 H ASN 25 -5.628 9.148 -6.444
168 HA ASN 25 HA ASN 25 -7.500 8.838 -8.718
169 HB2 ASN 25 HB2 ASN 25 -5.914 6.775 -7.130
170 HB3 ASN 25 HB3 ASN 25 -6.924 6.419 -8.528
171 HD21 ASN 25 HD21 ASN 25 -6.328 8.389 -10.305
172 HD22 ASN 25 HD22 ASN 25 -4.633 8.306 -10.719
173 H ARG 26 H ARG 26 -9.202 7.177 -8.568
174 HA ARG 26 HA ARG 26 -10.983 7.568 -6.398
175 HB2 ARG 26 HB2 ARG 26 -10.814 5.880 -8.797
176 HB3 ARG 26 HB3 ARG 26 -11.864 5.307 -7.515
177 HG2 ARG 26 HG2 ARG 26 -12.842 6.777 -9.469
178 HG3 ARG 26 HG3 ARG 26 -13.434 6.950 -7.818
179 HD2 ARG 26 HD2 ARG 26 -13.172 9.138 -8.843
180 HD3 ARG 26 HD3 ARG 26 -12.045 8.957 -7.497
181 HE ARG 26 HE ARG 26 -10.946 8.338 -10.165
182 HH11 ARG 26 HH11 ARG 26 -11.358 10.824 -7.674
183 HH12 ARG 26 HH12 ARG 26 -9.986 11.739 -8.241
184 HH21 ARG 26 HH21 ARG 26 -9.212 9.590 -10.821
185 HH22 ARG 26 HH22 ARG 26 -8.836 11.079 -9.981
186 H GLY 27 H GLY 27 -8.279 5.441 -6.661
187 HA2 GLY 27 HA2 GLY 27 -7.822 4.665 -4.210
188 HA3 GLY 27 HA3 GLY 27 -9.328 3.737 -4.456
189 H GLY 28 H GLY 28 -7.793 1.833 -4.128
190 HA2 GLY 28 HA2 GLY 28 -6.961 0.942 -6.820
191 HA3 GLY 28 HA3 GLY 28 -5.714 0.955 -5.554
192 H TYR 29 H TYR 29 -6.311 -1.474 -6.683
193 HA TYR 29 HA TYR 29 -7.551 -2.794 -4.438
194 HB2 TYR 29 HB2 TYR 29 -8.737 -4.390 -5.880
195 HB3 TYR 29 HB3 TYR 29 -9.353 -2.746 -6.045
196 HD1 TYR 29 HD2 TYR 29 -8.941 -1.437 -8.131
197 HD2 TYR 29 HD1 TYR 29 -7.607 -5.516 -7.747
198 HE1 TYR 29 HE2 TYR 29 -8.651 -1.582 -10.605
199 HE2 TYR 29 HE1 TYR 29 -7.332 -5.647 -10.219
200 HH TYR 29 HH TYR 29 -8.081 -2.909 -12.376
201 H CYS 30 H CYS 30 -6.884 -5.131 -4.342
202 HA CYS 30 HA CYS 30 -4.133 -5.335 -5.454
203 HB2 CYS 30 HB2 CYS 30 -5.355 -6.712 -3.048
204 HB3 CYS 30 HB3 CYS 30 -3.701 -6.926 -3.642
205 H ASN 31 H ASN 31 -3.670 -6.839 -6.862
206 HA ASN 31 HA ASN 31 -5.665 -8.878 -7.627
207 HB2 ASN 31 HB2 ASN 31 -2.810 -8.286 -8.522
208 HB3 ASN 31 HB3 ASN 31 -3.767 -9.630 -9.154
209 HD21 ASN 31 HD21 ASN 31 -2.695 -7.526 -10.712
210 HD22 ASN 31 HD22 ASN 31 -4.052 -6.668 -11.400
211 H GLY 32 H GLY 32 -5.026 -11.207 -7.621
212 HA2 GLY 32 HA2 GLY 32 -4.162 -12.029 -5.044
213 HA3 GLY 32 HA3 GLY 32 -4.426 -13.076 -6.436
214 H ARG 33 H ARG 33 -2.072 -10.874 -7.335
215 HA ARG 33 HA ARG 33 0.047 -12.612 -6.456
216 HB2 ARG 33 HB2 ARG 33 -0.101 -10.941 -8.957
217 HB3 ARG 33 HB3 ARG 33 1.356 -11.783 -8.412
218 HG2 ARG 33 HG2 ARG 33 0.046 -13.936 -8.485
219 HG3 ARG 33 HG3 ARG 33 -1.251 -13.040 -9.304
220 HD2 ARG 33 HD2 ARG 33 0.331 -12.392 -11.089
221 HD3 ARG 33 HD3 ARG 33 1.635 -13.258 -10.249
222 HE ARG 33 HE ARG 33 -0.548 -15.040 -10.703
223 HH11 ARG 33 HH11 ARG 33 2.040 -13.443 -12.500
224 HH12 ARG 33 HH12 ARG 33 2.091 -14.691 -13.715
225 HH21 ARG 33 HH21 ARG 33 -0.420 -16.595 -12.291
226 HH22 ARG 33 HH22 ARG 33 0.721 -16.438 -13.598
227 H ALA 34 H ALA 34 -1.244 -10.273 -5.163
228 HA ALA 34 HA ALA 34 -0.683 -8.585 -3.802
229 HB1 ALA 34 HB1 ALA 34 1.540 -8.510 -2.805
230 HB2 ALA 34 HB2 ALA 34 1.062 -10.211 -2.998
231 HB3 ALA 34 HB3 ALA 34 2.219 -9.472 -4.131
232 H ILE 35 H ILE 35 -0.801 -8.242 -6.653
233 HA ILE 35 HA ILE 35 0.987 -5.880 -7.034
234 HB ILE 35 HB ILE 35 -1.039 -7.018 -8.958
235 HG12 ILE 35 HG12 ILE 35 1.955 -7.456 -8.714
236 HG13 ILE 35 HG13 ILE 35 0.692 -8.679 -8.547
237 HG21 ILE 35 HG21 ILE 35 -0.504 -4.605 -9.357
238 HG22 ILE 35 HG22 ILE 35 1.228 -5.009 -9.423
239 HG23 ILE 35 HG23 ILE 35 0.108 -5.607 -10.669
240 HD11 ILE 35 HD11 ILE 35 1.679 -8.993 -10.663
241 HD12 ILE 35 HD12 ILE 35 0.093 -8.236 -10.954
242 HD13 ILE 35 HD13 ILE 35 1.580 -7.260 -11.043
243 H CYS 36 H CYS 36 0.227 -3.913 -7.091
244 HA CYS 36 HA CYS 36 -2.591 -3.476 -6.118
245 HB2 CYS 36 HB2 CYS 36 -0.828 -2.670 -4.589
246 HB3 CYS 36 HB3 CYS 36 -0.139 -1.704 -5.891
247 H VAL 37 H VAL 37 -3.974 -2.513 -7.498
248 HA VAL 37 HA VAL 37 -2.853 -1.176 -9.901
249 HB VAL 37 HB VAL 37 -5.334 -2.926 -9.667
250 HG11 VAL 37 HG11 VAL 37 -5.414 -2.668 -12.166
251 HG12 VAL 37 HG12 VAL 37 -5.633 -1.123 -11.324
252 HG13 VAL 37 HG13 VAL 37 -4.066 -1.513 -12.071
253 HG21 VAL 37 HG21 VAL 37 -3.364 -4.341 -9.617
254 HG22 VAL 37 HG22 VAL 37 -4.100 -4.457 -11.224
255 HG23 VAL 37 HG23 VAL 37 -2.641 -3.465 -10.991
256 H CYS 38 H CYS 38 -3.161 0.827 -9.465
257 HA CYS 38 HA CYS 38 -5.311 1.928 -7.900
258 HB2 CYS 38 HB2 CYS 38 -3.501 3.286 -9.931
259 HB3 CYS 38 HB3 CYS 38 -4.531 4.104 -8.754
260 H ARG 39 H ARG 39 -7.108 3.121 -8.604
261 HA ARG 39 HA ARG 39 -8.176 2.367 -11.234
262 HB2 ARG 39 HB2 ARG 39 -9.346 3.897 -8.889
263 HB3 ARG 39 HB3 ARG 39 -10.232 3.496 -10.369
264 HG2 ARG 39 HG2 ARG 39 -9.956 1.093 -9.893
265 HG3 ARG 39 HG3 ARG 39 -9.075 1.483 -8.402
266 HD2 ARG 39 HD2 ARG 39 -11.047 2.603 -7.483
267 HD3 ARG 39 HD3 ARG 39 -11.926 2.352 -9.002
268 HE ARG 39 HE ARG 39 -12.260 0.109 -8.473
269 HH11 ARG 39 HH11 ARG 39 -10.128 1.526 -6.049
270 HH12 ARG 39 HH12 ARG 39 -10.243 0.141 -4.996
271 HH21 ARG 39 HH21 ARG 39 -12.382 -1.612 -7.073
272 HH22 ARG 39 HH22 ARG 39 -11.520 -1.586 -5.558
273 H ASN 40 H ASN 40 -9.423 4.475 -12.190
274 HA ASN 40 HA ASN 40 -7.548 6.293 -12.980
275 HB2 ASN 40 HB2 ASN 40 -9.394 7.603 -13.924
276 HB3 ASN 40 HB3 ASN 40 -9.582 5.881 -14.279
277 HD21 ASN 40 HD21 ASN 40 -11.595 5.223 -14.125
278 HD22 ASN 40 HD22 ASN 40 -12.788 5.815 -12.996
Start of MODEL 13
1 H1 ALA 1 H1 ALA 1 1.853 -0.033 -9.601
2 H2 ALA 1 H2 ALA 1 2.293 -1.624 -9.577
3 H3 ALA 1 H3 ALA 1 0.789 -1.179 -9.070
4 HA ALA 1 HA ALA 1 3.329 -0.453 -7.755
5 HB1 ALA 1 HB1 ALA 1 1.625 1.322 -7.472
6 HB2 ALA 1 HB2 ALA 1 0.419 0.121 -6.957
7 HB3 ALA 1 HB3 ALA 1 1.837 0.457 -5.935
8 H THR 2 H THR 2 2.815 -1.293 -5.200
9 HA THR 2 HA THR 2 2.098 -4.167 -5.589
10 HB THR 2 HB THR 2 4.556 -3.834 -5.259
11 HG1 THR 2 HG1 THR 2 4.632 -5.503 -3.751
12 HG21 THR 2 HG21 THR 2 5.376 -3.207 -3.020
13 HG22 THR 2 HG22 THR 2 3.720 -2.855 -2.482
14 HG23 THR 2 HG23 THR 2 4.484 -1.853 -3.742
15 H CYS 3 H CYS 3 1.382 -5.313 -3.774
16 HA CYS 3 HA CYS 3 -0.214 -3.665 -1.852
17 HB2 CYS 3 HB2 CYS 3 -1.333 -5.221 -3.582
18 HB3 CYS 3 HB3 CYS 3 -0.642 -6.558 -2.663
19 H ASP 4 H ASP 4 2.689 -5.008 -2.043
20 HA ASP 4 HA ASP 4 2.817 -7.031 -0.054
21 HB2 ASP 4 HB2 ASP 4 4.875 -5.069 -1.125
22 HB3 ASP 4 HB3 ASP 4 5.270 -6.329 0.050
23 H LEU 5 H LEU 5 3.764 -7.068 1.974
24 HA LEU 5 HA LEU 5 3.771 -4.473 3.475
25 HB2 LEU 5 HB2 LEU 5 3.314 -5.939 5.503
26 HB3 LEU 5 HB3 LEU 5 1.973 -5.875 4.364
27 HG LEU 5 HG LEU 5 3.810 -8.123 3.842
28 HD11 LEU 5 HD11 LEU 5 3.181 -9.502 5.712
29 HD12 LEU 5 HD12 LEU 5 2.207 -8.192 6.411
30 HD13 LEU 5 HD13 LEU 5 3.978 -8.036 6.315
31 HD21 LEU 5 HD21 LEU 5 1.710 -9.366 3.675
32 HD22 LEU 5 HD22 LEU 5 1.606 -7.837 2.771
33 HD23 LEU 5 HD23 LEU 5 0.813 -7.985 4.362
34 H LEU 6 H LEU 6 5.709 -5.119 1.933
35 HA LEU 6 HA LEU 6 7.725 -6.833 3.125
36 HB2 LEU 6 HB2 LEU 6 7.439 -6.472 0.673
37 HB3 LEU 6 HB3 LEU 6 7.930 -4.795 0.878
38 HG LEU 6 HG LEU 6 10.182 -5.545 1.586
39 HD11 LEU 6 HD11 LEU 6 10.834 -7.919 1.168
40 HD12 LEU 6 HD12 LEU 6 9.118 -8.326 0.927
41 HD13 LEU 6 HD13 LEU 6 9.692 -7.750 2.513
42 HD21 LEU 6 HD21 LEU 6 10.895 -6.295 -0.652
43 HD22 LEU 6 HD22 LEU 6 9.694 -4.992 -0.760
44 HD23 LEU 6 HD23 LEU 6 9.208 -6.677 -1.069
45 H SER 7 H SER 7 7.041 -3.391 3.016
46 HA SER 7 HA SER 7 9.635 -2.692 4.175
47 HB2 SER 7 HB2 SER 7 7.206 -0.977 3.617
48 HB3 SER 7 HB3 SER 7 8.876 -0.407 3.856
49 HG SER 7 HG SER 7 9.434 -1.593 1.950
50 H GLY 8 H GLY 8 7.166 -4.032 5.593
51 HA2 GLY 8 HA2 GLY 8 7.146 -4.025 8.078
52 HA3 GLY 8 HA3 GLY 8 7.222 -2.250 7.979
53 H THR 9 H THR 9 5.371 -1.391 8.383
54 HA THR 9 HA THR 9 2.912 -2.561 8.453
55 HB THR 9 HB THR 9 2.818 -0.688 9.528
56 HG1 THR 9 HG1 THR 9 2.429 0.835 7.228
57 HG21 THR 9 HG21 THR 9 4.019 1.481 8.898
58 HG22 THR 9 HG22 THR 9 4.784 0.557 7.586
59 HG23 THR 9 HG23 THR 9 5.066 0.111 9.295
60 H GLY 10 H GLY 10 1.007 -1.922 7.470
61 HA2 GLY 10 HA2 GLY 10 -0.223 -1.555 5.384
62 HA3 GLY 10 HA3 GLY 10 1.226 -2.026 4.475
63 H VAL 11 H VAL 11 0.672 -3.902 7.254
64 HA VAL 11 HA VAL 11 0.280 -6.332 5.933
65 HB VAL 11 HB VAL 11 -0.575 -5.590 8.707
66 HG11 VAL 11 HG11 VAL 11 -0.164 -7.991 9.242
67 HG12 VAL 11 HG12 VAL 11 -1.440 -7.791 8.024
68 HG13 VAL 11 HG13 VAL 11 0.192 -8.292 7.526
69 HG21 VAL 11 HG21 VAL 11 1.714 -6.501 9.383
70 HG22 VAL 11 HG22 VAL 11 2.158 -6.395 7.668
71 HG23 VAL 11 HG23 VAL 11 1.719 -4.931 8.566
72 H LYS 12 H LYS 12 -1.950 -4.001 7.223
73 HA LYS 12 HA LYS 12 -4.313 -5.402 6.278
74 HB2 LYS 12 HB2 LYS 12 -3.678 -2.605 7.221
75 HB3 LYS 12 HB3 LYS 12 -5.297 -3.067 6.670
76 HG2 LYS 12 HG2 LYS 12 -3.831 -4.316 9.036
77 HG3 LYS 12 HG3 LYS 12 -5.056 -3.045 9.160
78 HD2 LYS 12 HD2 LYS 12 -6.714 -4.582 8.075
79 HD3 LYS 12 HD3 LYS 12 -5.489 -5.870 8.099
80 HE2 LYS 12 HE2 LYS 12 -5.339 -5.668 10.573
81 HE3 LYS 12 HE3 LYS 12 -6.589 -4.409 10.539
82 HZ1 LYS 12 HZ1 LYS 12 -7.525 -6.574 11.074
83 HZ2 LYS 12 HZ2 LYS 12 -6.968 -7.223 9.665
84 HZ3 LYS 12 HZ3 LYS 12 -8.131 -6.052 9.632
85 H HIS 13 H HIS 13 -4.277 -5.745 4.126
86 HA HIS 13 HA HIS 13 -2.698 -4.314 2.293
87 HB2 HIS 13 HB2 HIS 13 -5.010 -6.228 1.997
88 HB3 HIS 13 HB3 HIS 13 -4.219 -5.518 0.591
89 HD1 HIS 13 HD1 HIS 13 -3.991 -8.530 0.803
90 HD2 HIS 13 HD2 HIS 13 -1.229 -5.919 2.582
91 HE1 HIS 13 HE1 HIS 13 -1.825 -9.836 1.120
92 HE2 HIS 13 HE2 HIS 13 -0.181 -8.240 2.190
93 H SER 14 H SER 14 -5.468 -3.047 3.638
94 HA SER 14 HA SER 14 -6.564 -1.620 1.448
95 HB2 SER 14 HB2 SER 14 -6.493 -0.146 3.956
96 HB3 SER 14 HB3 SER 14 -7.898 -0.809 3.083
97 HG SER 14 HG SER 14 -7.697 -1.865 5.057
98 H ALA 15 H ALA 15 -3.593 -1.402 3.024
99 HA ALA 15 HA ALA 15 -2.907 1.221 2.767
100 HB1 ALA 15 HB1 ALA 15 -1.552 -0.398 3.985
101 HB2 ALA 15 HB2 ALA 15 -1.141 -1.215 2.458
102 HB3 ALA 15 HB3 ALA 15 -0.560 0.440 2.770
103 H CYS 16 H CYS 16 -2.817 -1.305 0.309
104 HA CYS 16 HA CYS 16 -1.480 0.219 -1.681
105 HB2 CYS 16 HB2 CYS 16 -1.550 -1.927 -2.419
106 HB3 CYS 16 HB3 CYS 16 -3.036 -2.261 -1.530
107 H ALA 17 H ALA 17 -4.831 -0.147 -0.887
108 HA ALA 17 HA ALA 17 -5.844 1.402 -3.042
109 HB1 ALA 17 HB1 ALA 17 -7.276 -0.135 -1.709
110 HB2 ALA 17 HB2 ALA 17 -7.100 0.949 -0.307
111 HB3 ALA 17 HB3 ALA 17 -7.947 1.511 -1.761
112 H ALA 18 H ALA 18 -4.877 2.176 0.217
113 HA ALA 18 HA ALA 18 -5.603 4.934 0.114
114 HB1 ALA 18 HB1 ALA 18 -5.204 3.717 2.236
115 HB2 ALA 18 HB2 ALA 18 -3.480 3.576 1.818
116 HB3 ALA 18 HB3 ALA 18 -4.196 5.177 2.118
117 H HIS 19 H HIS 19 -2.631 3.230 -0.730
118 HA HIS 19 HA HIS 19 -1.061 5.464 -1.099
119 HB2 HIS 19 HB2 HIS 19 -0.311 3.053 -1.019
120 HB3 HIS 19 HB3 HIS 19 -0.819 2.931 -2.710
121 HD1 HIS 19 HD1 HIS 19 1.705 4.752 -0.478
122 HD2 HIS 19 HD2 HIS 19 1.005 3.983 -4.539
123 HE1 HIS 19 HE1 HIS 19 3.761 5.563 -1.751
124 HE2 HIS 19 HE2 HIS 19 3.323 5.090 -4.192
125 H CYS 20 H CYS 20 -3.378 3.876 -3.192
126 HA CYS 20 HA CYS 20 -2.771 5.502 -5.519
127 HB2 CYS 20 HB2 CYS 20 -5.219 3.874 -4.789
128 HB3 CYS 20 HB3 CYS 20 -4.904 4.581 -6.377
129 H LEU 21 H LEU 21 -5.189 5.616 -2.870
130 HA LEU 21 HA LEU 21 -6.742 7.787 -3.850
131 HB2 LEU 21 HB2 LEU 21 -6.063 6.802 -1.086
132 HB3 LEU 21 HB3 LEU 21 -7.064 8.217 -1.315
133 HG LEU 21 HG LEU 21 -7.774 5.445 -2.280
134 HD11 LEU 21 HD11 LEU 21 -9.343 5.423 -0.376
135 HD12 LEU 21 HD12 LEU 21 -8.692 6.983 0.177
136 HD13 LEU 21 HD13 LEU 21 -7.659 5.537 0.168
137 HD21 LEU 21 HD21 LEU 21 -10.047 6.398 -2.507
138 HD22 LEU 21 HD22 LEU 21 -8.890 7.236 -3.551
139 HD23 LEU 21 HD23 LEU 21 -9.419 7.997 -2.040
140 H LEU 22 H LEU 22 -3.689 7.726 -2.038
141 HA LEU 22 HA LEU 22 -3.550 10.527 -1.488
142 HB2 LEU 22 HB2 LEU 22 -1.448 8.377 -1.820
143 HB3 LEU 22 HB3 LEU 22 -1.032 10.037 -1.415
144 HG LEU 22 HG LEU 22 -2.868 8.326 0.286
145 HD11 LEU 22 HD11 LEU 22 -0.628 7.317 0.146
146 HD12 LEU 22 HD12 LEU 22 -0.919 8.005 1.755
147 HD13 LEU 22 HD13 LEU 22 0.111 8.874 0.592
148 HD21 LEU 22 HD21 LEU 22 -2.315 10.003 2.036
149 HD22 LEU 22 HD22 LEU 22 -3.160 10.728 0.657
150 HD23 LEU 22 HD23 LEU 22 -1.402 10.941 0.830
151 H ARG 23 H ARG 23 -3.081 8.821 -4.498
152 HA ARG 23 HA ARG 23 -1.544 11.070 -5.672
153 HB2 ARG 23 HB2 ARG 23 -2.797 8.676 -7.046
154 HB3 ARG 23 HB3 ARG 23 -1.625 9.801 -7.732
155 HG2 ARG 23 HG2 ARG 23 -0.085 8.967 -5.775
156 HG3 ARG 23 HG3 ARG 23 -1.208 7.586 -5.758
157 HD2 ARG 23 HD2 ARG 23 0.474 8.602 -8.069
158 HD3 ARG 23 HD3 ARG 23 0.592 7.023 -7.264
159 HE ARG 23 HE ARG 23 -2.031 7.176 -8.243
160 HH11 ARG 23 HH11 ARG 23 1.166 7.350 -9.755
161 HH12 ARG 23 HH12 ARG 23 0.571 6.736 -11.274
162 HH21 ARG 23 HH21 ARG 23 -2.701 6.415 -10.170
163 HH22 ARG 23 HH22 ARG 23 -1.590 6.208 -11.508
164 H GLY 24 H GLY 24 -4.686 10.714 -4.770
165 HA2 GLY 24 HA2 GLY 24 -6.499 12.040 -5.389
166 HA3 GLY 24 HA3 GLY 24 -5.620 12.588 -6.824
167 H ASN 25 H ASN 25 -5.581 9.168 -6.425
168 HA ASN 25 HA ASN 25 -7.459 8.871 -8.699
169 HB2 ASN 25 HB2 ASN 25 -5.859 6.800 -7.135
170 HB3 ASN 25 HB3 ASN 25 -6.876 6.452 -8.531
171 HD21 ASN 25 HD21 ASN 25 -6.298 8.415 -10.309
172 HD22 ASN 25 HD22 ASN 25 -4.605 8.350 -10.727
173 H ARG 26 H ARG 26 -9.161 7.207 -8.547
174 HA ARG 26 HA ARG 26 -10.921 7.601 -6.360
175 HB2 ARG 26 HB2 ARG 26 -10.796 5.950 -8.781
176 HB3 ARG 26 HB3 ARG 26 -11.831 5.358 -7.496
177 HG2 ARG 26 HG2 ARG 26 -12.840 6.859 -9.399
178 HG3 ARG 26 HG3 ARG 26 -13.390 7.030 -7.733
179 HD2 ARG 26 HD2 ARG 26 -13.120 9.220 -8.761
180 HD3 ARG 26 HD3 ARG 26 -11.972 9.018 -7.435
181 HE ARG 26 HE ARG 26 -10.913 8.386 -10.113
182 HH11 ARG 26 HH11 ARG 26 -11.301 10.903 -7.647
183 HH12 ARG 26 HH12 ARG 26 -9.934 11.809 -8.239
184 HH21 ARG 26 HH21 ARG 26 -9.185 9.627 -10.800
185 HH22 ARG 26 HH22 ARG 26 -8.801 11.128 -9.983
186 H GLY 27 H GLY 27 -8.230 5.472 -6.617
187 HA2 GLY 27 HA2 GLY 27 -7.778 4.649 -4.190
188 HA3 GLY 27 HA3 GLY 27 -9.312 3.763 -4.422
189 H GLY 28 H GLY 28 -7.816 1.812 -4.124
190 HA2 GLY 28 HA2 GLY 28 -7.048 0.916 -6.828
191 HA3 GLY 28 HA3 GLY 28 -5.772 0.914 -5.596
192 H TYR 29 H TYR 29 -6.394 -1.496 -6.702
193 HA TYR 29 HA TYR 29 -7.584 -2.828 -4.438
194 HB2 TYR 29 HB2 TYR 29 -8.806 -4.422 -5.833
195 HB3 TYR 29 HB3 TYR 29 -9.417 -2.780 -6.028
196 HD1 TYR 29 HD2 TYR 29 -9.032 -1.527 -8.153
197 HD2 TYR 29 HD1 TYR 29 -7.687 -5.594 -7.680
198 HE1 TYR 29 HE2 TYR 29 -8.766 -1.737 -10.624
199 HE2 TYR 29 HE1 TYR 29 -7.436 -5.788 -10.149
200 HH TYR 29 HH TYR 29 -8.221 -3.112 -12.369
201 H CYS 30 H CYS 30 -6.902 -5.170 -4.354
202 HA CYS 30 HA CYS 30 -4.167 -5.344 -5.512
203 HB2 CYS 30 HB2 CYS 30 -5.322 -6.710 -3.066
204 HB3 CYS 30 HB3 CYS 30 -3.679 -6.912 -3.690
205 H ASN 31 H ASN 31 -3.683 -6.859 -6.896
206 HA ASN 31 HA ASN 31 -5.648 -8.941 -7.627
207 HB2 ASN 31 HB2 ASN 31 -2.800 -8.328 -8.534
208 HB3 ASN 31 HB3 ASN 31 -3.757 -9.675 -9.161
209 HD21 ASN 31 HD21 ASN 31 -2.690 -7.552 -10.712
210 HD22 ASN 31 HD22 ASN 31 -4.051 -6.705 -11.403
211 H GLY 32 H GLY 32 -4.964 -11.260 -7.607
212 HA2 GLY 32 HA2 GLY 32 -4.086 -12.049 -5.027
213 HA3 GLY 32 HA3 GLY 32 -4.330 -13.109 -6.411
214 H ARG 33 H ARG 33 -2.009 -10.896 -7.348
215 HA ARG 33 HA ARG 33 0.135 -12.578 -6.419
216 HB2 ARG 33 HB2 ARG 33 -0.043 -10.999 -8.979
217 HB3 ARG 33 HB3 ARG 33 1.439 -11.770 -8.394
218 HG2 ARG 33 HG2 ARG 33 0.176 -13.964 -8.372
219 HG3 ARG 33 HG3 ARG 33 -1.115 -13.140 -9.270
220 HD2 ARG 33 HD2 ARG 33 0.495 -12.552 -11.046
221 HD3 ARG 33 HD3 ARG 33 1.803 -13.319 -10.121
222 HE ARG 33 HE ARG 33 -0.310 -15.199 -10.538
223 HH11 ARG 33 HH11 ARG 33 2.315 -13.642 -12.317
224 HH12 ARG 33 HH12 ARG 33 2.456 -14.962 -13.445
225 HH21 ARG 33 HH21 ARG 33 -0.067 -16.845 -12.016
226 HH22 ARG 33 HH22 ARG 33 1.129 -16.737 -13.277
227 H ALA 34 H ALA 34 -1.190 -10.246 -5.187
228 HA ALA 34 HA ALA 34 -0.652 -8.531 -3.846
229 HB1 ALA 34 HB1 ALA 34 1.578 -8.402 -2.861
230 HB2 ALA 34 HB2 ALA 34 1.126 -10.114 -3.027
231 HB3 ALA 34 HB3 ALA 34 2.264 -9.373 -4.178
232 H ILE 35 H ILE 35 -0.797 -8.219 -6.698
233 HA ILE 35 HA ILE 35 0.950 -5.832 -7.118
234 HB ILE 35 HB ILE 35 -1.077 -7.013 -9.008
235 HG12 ILE 35 HG12 ILE 35 1.920 -7.423 -8.782
236 HG13 ILE 35 HG13 ILE 35 0.669 -8.656 -8.603
237 HG21 ILE 35 HG21 ILE 35 -0.576 -4.598 -9.435
238 HG22 ILE 35 HG22 ILE 35 1.160 -4.982 -9.514
239 HG23 ILE 35 HG23 ILE 35 0.034 -5.604 -10.742
240 HD11 ILE 35 HD11 ILE 35 1.535 -7.237 -11.111
241 HD12 ILE 35 HD12 ILE 35 1.651 -8.967 -10.727
242 HD13 ILE 35 HD13 ILE 35 0.057 -8.227 -11.016
243 H CYS 36 H CYS 36 0.158 -3.870 -7.186
244 HA CYS 36 HA CYS 36 -2.653 -3.479 -6.185
245 HB2 CYS 36 HB2 CYS 36 -0.903 -2.638 -4.670
246 HB3 CYS 36 HB3 CYS 36 -0.233 -1.668 -5.976
247 H VAL 37 H VAL 37 -4.069 -2.542 -7.539
248 HA VAL 37 HA VAL 37 -2.996 -1.215 -9.973
249 HB VAL 37 HB VAL 37 -5.497 -2.926 -9.671
250 HG11 VAL 37 HG11 VAL 37 -5.623 -2.691 -12.168
251 HG12 VAL 37 HG12 VAL 37 -5.800 -1.133 -11.337
252 HG13 VAL 37 HG13 VAL 37 -4.255 -1.559 -12.112
253 HG21 VAL 37 HG21 VAL 37 -3.542 -4.369 -9.641
254 HG22 VAL 37 HG22 VAL 37 -4.328 -4.499 -11.224
255 HG23 VAL 37 HG23 VAL 37 -2.847 -3.526 -11.049
256 H CYS 38 H CYS 38 -3.244 0.801 -9.494
257 HA CYS 38 HA CYS 38 -5.369 1.922 -7.909
258 HB2 CYS 38 HB2 CYS 38 -3.544 3.265 -9.936
259 HB3 CYS 38 HB3 CYS 38 -4.566 4.094 -8.761
260 H ARG 39 H ARG 39 -7.150 3.139 -8.596
261 HA ARG 39 HA ARG 39 -8.242 2.410 -11.223
262 HB2 ARG 39 HB2 ARG 39 -9.377 3.959 -8.865
263 HB3 ARG 39 HB3 ARG 39 -10.277 3.573 -10.339
264 HG2 ARG 39 HG2 ARG 39 -10.038 1.164 -9.861
265 HG3 ARG 39 HG3 ARG 39 -9.133 1.540 -8.383
266 HD2 ARG 39 HD2 ARG 39 -11.079 2.688 -7.439
267 HD3 ARG 39 HD3 ARG 39 -11.978 2.450 -8.948
268 HE ARG 39 HE ARG 39 -12.332 0.208 -8.418
269 HH11 ARG 39 HH11 ARG 39 -10.171 1.607 -6.006
270 HH12 ARG 39 HH12 ARG 39 -10.295 0.224 -4.951
271 HH21 ARG 39 HH21 ARG 39 -12.462 -1.509 -7.014
272 HH22 ARG 39 HH22 ARG 39 -11.592 -1.491 -5.505
273 H ASN 40 H ASN 40 -9.467 4.540 -12.171
274 HA ASN 40 HA ASN 40 -7.565 6.325 -12.972
275 HB2 ASN 40 HB2 ASN 40 -9.402 7.670 -13.895
276 HB3 ASN 40 HB3 ASN 40 -9.612 5.954 -14.259
277 HD21 ASN 40 HD21 ASN 40 -11.632 5.320 -14.096
278 HD22 ASN 40 HD22 ASN 40 -12.811 5.916 -12.955
Start of MODEL 14
1 H1 ALA 1 H1 ALA 1 2.173 -0.260 -9.255
2 H2 ALA 1 H2 ALA 1 2.413 -1.893 -9.287
3 H3 ALA 1 H3 ALA 1 1.016 -1.278 -8.664
4 HA ALA 1 HA ALA 1 3.716 -0.903 -7.534
5 HB1 ALA 1 HB1 ALA 1 2.234 1.061 -7.119
6 HB2 ALA 1 HB2 ALA 1 0.978 -0.011 -6.460
7 HB3 ALA 1 HB3 ALA 1 2.531 0.174 -5.609
8 H THR 2 H THR 2 3.132 -1.672 -4.912
9 HA THR 2 HA THR 2 2.220 -4.491 -5.314
10 HB THR 2 HB THR 2 4.656 -4.356 -4.813
11 HG1 THR 2 HG1 THR 2 4.474 -6.017 -3.410
12 HG21 THR 2 HG21 THR 2 5.391 -3.649 -2.560
13 HG22 THR 2 HG22 THR 2 3.746 -3.105 -2.173
14 HG23 THR 2 HG23 THR 2 4.687 -2.281 -3.444
15 H CYS 3 H CYS 3 1.330 -5.551 -3.487
16 HA CYS 3 HA CYS 3 -0.340 -3.736 -1.773
17 HB2 CYS 3 HB2 CYS 3 -1.423 -5.291 -3.488
18 HB3 CYS 3 HB3 CYS 3 -0.790 -6.647 -2.556
19 H ASP 4 H ASP 4 2.468 -5.440 -1.763
20 HA ASP 4 HA ASP 4 2.218 -7.153 0.530
21 HB2 ASP 4 HB2 ASP 4 4.599 -5.890 -0.871
22 HB3 ASP 4 HB3 ASP 4 4.755 -7.006 0.489
23 H LEU 5 H LEU 5 3.305 -7.029 2.506
24 HA LEU 5 HA LEU 5 3.641 -4.253 3.578
25 HB2 LEU 5 HB2 LEU 5 3.577 -5.421 5.809
26 HB3 LEU 5 HB3 LEU 5 2.088 -5.604 4.892
27 HG LEU 5 HG LEU 5 3.988 -7.809 4.429
28 HD11 LEU 5 HD11 LEU 5 3.739 -8.893 6.575
29 HD12 LEU 5 HD12 LEU 5 2.804 -7.524 7.206
30 HD13 LEU 5 HD13 LEU 5 4.524 -7.317 6.797
31 HD21 LEU 5 HD21 LEU 5 1.974 -9.164 4.811
32 HD22 LEU 5 HD22 LEU 5 1.648 -7.829 3.687
33 HD23 LEU 5 HD23 LEU 5 1.094 -7.723 5.377
34 H LEU 6 H LEU 6 5.336 -5.018 1.816
35 HA LEU 6 HA LEU 6 7.667 -6.404 2.856
36 HB2 LEU 6 HB2 LEU 6 7.022 -6.350 0.443
37 HB3 LEU 6 HB3 LEU 6 7.330 -4.618 0.418
38 HG LEU 6 HG LEU 6 9.731 -5.044 0.865
39 HD11 LEU 6 HD11 LEU 6 10.600 -7.368 0.577
40 HD12 LEU 6 HD12 LEU 6 8.929 -7.976 0.618
41 HD13 LEU 6 HD13 LEU 6 9.631 -7.179 2.048
42 HD21 LEU 6 HD21 LEU 6 10.230 -5.945 -1.376
43 HD22 LEU 6 HD22 LEU 6 8.878 -4.798 -1.428
44 HD23 LEU 6 HD23 LEU 6 8.562 -6.549 -1.512
45 H SER 7 H SER 7 6.499 -3.148 2.526
46 HA SER 7 HA SER 7 9.036 -1.899 3.167
47 HB2 SER 7 HB2 SER 7 6.266 -0.701 3.142
48 HB3 SER 7 HB3 SER 7 7.802 0.167 2.950
49 HG SER 7 HG SER 7 6.905 -0.163 0.923
50 H GLY 8 H GLY 8 7.244 -3.562 5.153
51 HA2 GLY 8 HA2 GLY 8 7.540 -3.494 7.556
52 HA3 GLY 8 HA3 GLY 8 7.635 -1.709 7.436
53 H THR 9 H THR 9 5.889 -0.837 8.114
54 HA THR 9 HA THR 9 3.408 -1.938 8.520
55 HB THR 9 HB THR 9 3.535 -0.095 9.616
56 HG1 THR 9 HG1 THR 9 2.700 1.836 8.372
57 HG21 THR 9 HG21 THR 9 4.702 2.057 8.876
58 HG22 THR 9 HG22 THR 9 5.238 1.149 7.446
59 HG23 THR 9 HG23 THR 9 5.754 0.652 9.086
60 H GLY 10 H GLY 10 1.428 -1.167 7.749
61 HA2 GLY 10 HA2 GLY 10 -0.001 -0.791 5.776
62 HA3 GLY 10 HA3 GLY 10 1.346 -1.302 4.741
63 H VAL 11 H VAL 11 0.956 -3.149 7.586
64 HA VAL 11 HA VAL 11 0.617 -5.586 6.337
65 HB VAL 11 HB VAL 11 -0.272 -4.809 9.088
66 HG11 VAL 11 HG11 VAL 11 0.248 -7.179 9.686
67 HG12 VAL 11 HG12 VAL 11 -1.053 -7.064 8.485
68 HG13 VAL 11 HG13 VAL 11 0.590 -7.510 7.974
69 HG21 VAL 11 HG21 VAL 11 2.069 -5.641 9.752
70 HG22 VAL 11 HG22 VAL 11 2.483 -5.501 8.029
71 HG23 VAL 11 HG23 VAL 11 1.982 -4.068 8.947
72 H LYS 12 H LYS 12 -1.816 -3.370 7.488
73 HA LYS 12 HA LYS 12 -4.040 -5.027 6.622
74 HB2 LYS 12 HB2 LYS 12 -3.653 -2.109 7.303
75 HB3 LYS 12 HB3 LYS 12 -5.216 -2.753 6.781
76 HG2 LYS 12 HG2 LYS 12 -3.707 -3.688 9.259
77 HG3 LYS 12 HG3 LYS 12 -4.984 -2.463 9.268
78 HD2 LYS 12 HD2 LYS 12 -6.576 -4.145 8.328
79 HD3 LYS 12 HD3 LYS 12 -5.302 -5.379 8.439
80 HE2 LYS 12 HE2 LYS 12 -5.152 -4.992 10.889
81 HE3 LYS 12 HE3 LYS 12 -6.439 -3.776 10.772
82 HZ1 LYS 12 HZ1 LYS 12 -7.308 -5.919 11.476
83 HZ2 LYS 12 HZ2 LYS 12 -6.741 -6.658 10.114
84 HZ3 LYS 12 HZ3 LYS 12 -7.937 -5.527 10.003
85 H HIS 13 H HIS 13 -3.997 -5.543 4.490
86 HA HIS 13 HA HIS 13 -2.489 -4.205 2.541
87 HB2 HIS 13 HB2 HIS 13 -4.778 -6.171 2.345
88 HB3 HIS 13 HB3 HIS 13 -3.927 -5.569 0.924
89 HD1 HIS 13 HD1 HIS 13 -3.559 -8.438 1.018
90 HD2 HIS 13 HD2 HIS 13 -1.180 -5.936 3.402
91 HE1 HIS 13 HE1 HIS 13 -1.465 -9.759 1.627
92 HE2 HIS 13 HE2 HIS 13 -0.055 -8.234 3.063
93 H SER 14 H SER 14 -5.328 -2.971 3.778
94 HA SER 14 HA SER 14 -6.428 -1.686 1.500
95 HB2 SER 14 HB2 SER 14 -6.413 -0.141 3.995
96 HB3 SER 14 HB3 SER 14 -7.797 -0.760 3.058
97 HG SER 14 HG SER 14 -7.750 -1.853 4.998
98 H ALA 15 H ALA 15 -3.477 -1.330 3.089
99 HA ALA 15 HA ALA 15 -2.832 1.294 2.753
100 HB1 ALA 15 HB1 ALA 15 -1.451 -0.298 3.991
101 HB2 ALA 15 HB2 ALA 15 -1.030 -1.121 2.471
102 HB3 ALA 15 HB3 ALA 15 -0.480 0.546 2.764
103 H CYS 16 H CYS 16 -2.800 -1.284 0.348
104 HA CYS 16 HA CYS 16 -1.465 0.189 -1.690
105 HB2 CYS 16 HB2 CYS 16 -1.572 -2.008 -2.318
106 HB3 CYS 16 HB3 CYS 16 -3.120 -2.249 -1.509
107 H ALA 17 H ALA 17 -4.816 -0.150 -0.880
108 HA ALA 17 HA ALA 17 -5.822 1.389 -3.048
109 HB1 ALA 17 HB1 ALA 17 -7.271 -0.127 -1.720
110 HB2 ALA 17 HB2 ALA 17 -7.069 0.937 -0.307
111 HB3 ALA 17 HB3 ALA 17 -7.923 1.528 -1.748
112 H ALA 18 H ALA 18 -4.845 2.166 0.209
113 HA ALA 18 HA ALA 18 -5.551 4.923 0.116
114 HB1 ALA 18 HB1 ALA 18 -5.131 3.694 2.229
115 HB2 ALA 18 HB2 ALA 18 -3.410 3.563 1.792
116 HB3 ALA 18 HB3 ALA 18 -4.129 5.159 2.105
117 H HIS 19 H HIS 19 -2.587 3.223 -0.768
118 HA HIS 19 HA HIS 19 -1.026 5.466 -1.137
119 HB2 HIS 19 HB2 HIS 19 -0.255 3.068 -1.083
120 HB3 HIS 19 HB3 HIS 19 -0.796 2.938 -2.762
121 HD1 HIS 19 HD1 HIS 19 1.751 4.803 -0.589
122 HD2 HIS 19 HD2 HIS 19 0.990 3.980 -4.628
123 HE1 HIS 19 HE1 HIS 19 3.775 5.626 -1.906
124 HE2 HIS 19 HE2 HIS 19 3.300 5.121 -4.334
125 H CYS 20 H CYS 20 -3.369 3.902 -3.210
126 HA CYS 20 HA CYS 20 -2.779 5.545 -5.530
127 HB2 CYS 20 HB2 CYS 20 -5.199 3.876 -4.808
128 HB3 CYS 20 HB3 CYS 20 -4.892 4.595 -6.394
129 H LEU 21 H LEU 21 -5.176 5.612 -2.862
130 HA LEU 21 HA LEU 21 -6.764 7.773 -3.814
131 HB2 LEU 21 HB2 LEU 21 -6.040 6.777 -1.065
132 HB3 LEU 21 HB3 LEU 21 -7.055 8.186 -1.272
133 HG LEU 21 HG LEU 21 -7.758 5.417 -2.249
134 HD11 LEU 21 HD11 LEU 21 -9.299 5.365 -0.321
135 HD12 LEU 21 HD12 LEU 21 -8.648 6.923 0.239
136 HD13 LEU 21 HD13 LEU 21 -7.608 5.482 0.198
137 HD21 LEU 21 HD21 LEU 21 -10.042 6.358 -2.427
138 HD22 LEU 21 HD22 LEU 21 -8.907 7.209 -3.484
139 HD23 LEU 21 HD23 LEU 21 -9.415 7.955 -1.956
140 H LEU 22 H LEU 22 -3.681 7.727 -2.054
141 HA LEU 22 HA LEU 22 -3.553 10.525 -1.486
142 HB2 LEU 22 HB2 LEU 22 -1.441 8.393 -1.877
143 HB3 LEU 22 HB3 LEU 22 -1.029 10.056 -1.470
144 HG LEU 22 HG LEU 22 -2.815 8.316 0.259
145 HD11 LEU 22 HD11 LEU 22 -0.568 7.332 0.062
146 HD12 LEU 22 HD12 LEU 22 -0.832 8.004 1.683
147 HD13 LEU 22 HD13 LEU 22 0.163 8.893 0.506
148 HD21 LEU 22 HD21 LEU 22 -1.364 10.941 0.788
149 HD22 LEU 22 HD22 LEU 22 -2.241 9.988 2.007
150 HD23 LEU 22 HD23 LEU 22 -3.122 10.713 0.651
151 H ARG 23 H ARG 23 -3.137 8.845 -4.518
152 HA ARG 23 HA ARG 23 -1.640 11.116 -5.708
153 HB2 ARG 23 HB2 ARG 23 -2.891 8.714 -7.070
154 HB3 ARG 23 HB3 ARG 23 -1.743 9.854 -7.773
155 HG2 ARG 23 HG2 ARG 23 -0.154 9.031 -5.857
156 HG3 ARG 23 HG3 ARG 23 -1.265 7.642 -5.806
157 HD2 ARG 23 HD2 ARG 23 0.336 8.666 -8.174
158 HD3 ARG 23 HD3 ARG 23 0.514 7.101 -7.354
159 HE ARG 23 HE ARG 23 -2.144 7.198 -8.259
160 HH11 ARG 23 HH11 ARG 23 1.016 7.366 -9.851
161 HH12 ARG 23 HH12 ARG 23 0.392 6.710 -11.340
162 HH21 ARG 23 HH21 ARG 23 -2.851 6.382 -10.149
163 HH22 ARG 23 HH22 ARG 23 -1.771 6.153 -11.508
164 H GLY 24 H GLY 24 -4.753 10.734 -4.738
165 HA2 GLY 24 HA2 GLY 24 -6.594 12.039 -5.315
166 HA3 GLY 24 HA3 GLY 24 -5.751 12.604 -6.766
167 H ASN 25 H ASN 25 -5.667 9.184 -6.389
168 HA ASN 25 HA ASN 25 -7.565 8.875 -8.637
169 HB2 ASN 25 HB2 ASN 25 -5.960 6.806 -7.076
170 HB3 ASN 25 HB3 ASN 25 -6.974 6.459 -8.473
171 HD21 ASN 25 HD21 ASN 25 -6.388 8.462 -10.227
172 HD22 ASN 25 HD22 ASN 25 -4.696 8.384 -10.650
173 H ARG 26 H ARG 26 -9.256 7.206 -8.483
174 HA ARG 26 HA ARG 26 -11.018 7.566 -6.291
175 HB2 ARG 26 HB2 ARG 26 -10.857 5.882 -8.701
176 HB3 ARG 26 HB3 ARG 26 -11.894 5.306 -7.412
177 HG2 ARG 26 HG2 ARG 26 -12.886 6.777 -9.363
178 HG3 ARG 26 HG3 ARG 26 -13.480 6.930 -7.709
179 HD2 ARG 26 HD2 ARG 26 -13.242 9.128 -8.713
180 HD3 ARG 26 HD3 ARG 26 -12.106 8.947 -7.374
181 HE ARG 26 HE ARG 26 -11.015 8.362 -10.054
182 HH11 ARG 26 HH11 ARG 26 -11.443 10.826 -7.543
183 HH12 ARG 26 HH12 ARG 26 -10.085 11.762 -8.112
184 HH21 ARG 26 HH21 ARG 26 -9.299 9.640 -10.711
185 HH22 ARG 26 HH22 ARG 26 -8.938 11.128 -9.863
186 H GLY 27 H GLY 27 -8.309 5.436 -6.626
187 HA2 GLY 27 HA2 GLY 27 -7.803 4.657 -4.179
188 HA3 GLY 27 HA3 GLY 27 -9.313 3.728 -4.406
189 H GLY 28 H GLY 28 -7.755 1.831 -4.117
190 HA2 GLY 28 HA2 GLY 28 -6.941 0.974 -6.832
191 HA3 GLY 28 HA3 GLY 28 -5.702 0.960 -5.559
192 H TYR 29 H TYR 29 -6.305 -1.439 -6.732
193 HA TYR 29 HA TYR 29 -7.570 -2.792 -4.520
194 HB2 TYR 29 HB2 TYR 29 -8.771 -4.352 -6.001
195 HB3 TYR 29 HB3 TYR 29 -9.364 -2.699 -6.158
196 HD1 TYR 29 HD2 TYR 29 -8.931 -1.379 -8.224
197 HD2 TYR 29 HD1 TYR 29 -7.612 -5.467 -7.860
198 HE1 TYR 29 HE2 TYR 29 -8.611 -1.507 -10.698
199 HE2 TYR 29 HE1 TYR 29 -7.306 -5.579 -10.330
200 HH TYR 29 HH TYR 29 -8.023 -2.821 -12.471
201 H CYS 30 H CYS 30 -6.941 -5.145 -4.481
202 HA CYS 30 HA CYS 30 -4.176 -5.331 -5.555
203 HB2 CYS 30 HB2 CYS 30 -5.418 -6.743 -3.177
204 HB3 CYS 30 HB3 CYS 30 -3.756 -6.930 -3.751
205 H ASN 31 H ASN 31 -3.692 -6.818 -6.971
206 HA ASN 31 HA ASN 31 -5.674 -8.827 -7.825
207 HB2 ASN 31 HB2 ASN 31 -2.764 -8.311 -8.578
208 HB3 ASN 31 HB3 ASN 31 -3.746 -9.597 -9.286
209 HD21 ASN 31 HD21 ASN 31 -2.529 -7.549 -10.773
210 HD22 ASN 31 HD22 ASN 31 -3.807 -6.597 -11.487
211 H GLY 32 H GLY 32 -5.074 -11.169 -7.817
212 HA2 GLY 32 HA2 GLY 32 -4.351 -12.039 -5.217
213 HA3 GLY 32 HA3 GLY 32 -4.563 -13.063 -6.634
214 H ARG 33 H ARG 33 -2.117 -10.887 -7.365
215 HA ARG 33 HA ARG 33 -0.082 -12.654 -6.343
216 HB2 ARG 33 HB2 ARG 33 -0.078 -11.112 -8.931
217 HB3 ARG 33 HB3 ARG 33 1.347 -11.916 -8.260
218 HG2 ARG 33 HG2 ARG 33 0.008 -14.070 -8.256
219 HG3 ARG 33 HG3 ARG 33 -1.195 -13.222 -9.252
220 HD2 ARG 33 HD2 ARG 33 0.536 -12.745 -10.942
221 HD3 ARG 33 HD3 ARG 33 1.760 -13.521 -9.916
222 HE ARG 33 HE ARG 33 -0.382 -15.349 -10.406
223 HH11 ARG 33 HH11 ARG 33 2.400 -13.933 -12.059
224 HH12 ARG 33 HH12 ARG 33 2.569 -15.293 -13.135
225 HH21 ARG 33 HH21 ARG 33 -0.097 -17.051 -11.812
226 HH22 ARG 33 HH22 ARG 33 1.180 -17.021 -12.997
227 H ALA 34 H ALA 34 -1.368 -10.281 -5.166
228 HA ALA 34 HA ALA 34 -0.818 -8.590 -3.804
229 HB1 ALA 34 HB1 ALA 34 1.375 -8.539 -2.751
230 HB2 ALA 34 HB2 ALA 34 0.883 -10.235 -2.948
231 HB3 ALA 34 HB3 ALA 34 2.077 -9.518 -4.054
232 H ILE 35 H ILE 35 -0.868 -8.261 -6.656
233 HA ILE 35 HA ILE 35 0.970 -5.933 -7.011
234 HB ILE 35 HB ILE 35 -1.031 -7.044 -8.973
235 HG12 ILE 35 HG12 ILE 35 1.943 -7.545 -8.655
236 HG13 ILE 35 HG13 ILE 35 0.649 -8.739 -8.515
237 HG21 ILE 35 HG21 ILE 35 -0.443 -4.643 -9.372
238 HG22 ILE 35 HG22 ILE 35 1.284 -5.082 -9.395
239 HG23 ILE 35 HG23 ILE 35 0.179 -5.666 -10.663
240 HD11 ILE 35 HD11 ILE 35 1.632 -7.347 -10.995
241 HD12 ILE 35 HD12 ILE 35 1.685 -9.079 -10.610
242 HD13 ILE 35 HD13 ILE 35 0.123 -8.291 -10.943
243 H CYS 36 H CYS 36 0.240 -3.948 -7.093
244 HA CYS 36 HA CYS 36 -2.572 -3.467 -6.139
245 HB2 CYS 36 HB2 CYS 36 -0.793 -2.693 -4.614
246 HB3 CYS 36 HB3 CYS 36 -0.099 -1.734 -5.918
247 H VAL 37 H VAL 37 -3.954 -2.477 -7.516
248 HA VAL 37 HA VAL 37 -2.814 -1.134 -9.906
249 HB VAL 37 HB VAL 37 -5.291 -2.891 -9.701
250 HG11 VAL 37 HG11 VAL 37 -5.355 -2.618 -12.199
251 HG12 VAL 37 HG12 VAL 37 -5.587 -1.082 -11.347
252 HG13 VAL 37 HG13 VAL 37 -4.013 -1.458 -12.087
253 HG21 VAL 37 HG21 VAL 37 -3.317 -4.302 -9.647
254 HG22 VAL 37 HG22 VAL 37 -4.051 -4.413 -11.256
255 HG23 VAL 37 HG23 VAL 37 -2.593 -3.419 -11.015
256 H CYS 38 H CYS 38 -3.154 0.868 -9.486
257 HA CYS 38 HA CYS 38 -5.306 1.949 -7.911
258 HB2 CYS 38 HB2 CYS 38 -3.516 3.324 -9.944
259 HB3 CYS 38 HB3 CYS 38 -4.549 4.133 -8.764
260 H ARG 39 H ARG 39 -7.105 3.154 -8.592
261 HA ARG 39 HA ARG 39 -8.191 2.416 -11.222
262 HB2 ARG 39 HB2 ARG 39 -9.357 3.912 -8.847
263 HB3 ARG 39 HB3 ARG 39 -10.243 3.530 -10.331
264 HG2 ARG 39 HG2 ARG 39 -9.960 1.121 -9.884
265 HG3 ARG 39 HG3 ARG 39 -9.080 1.498 -8.390
266 HD2 ARG 39 HD2 ARG 39 -11.059 2.608 -7.465
267 HD3 ARG 39 HD3 ARG 39 -11.934 2.359 -8.986
268 HE ARG 39 HE ARG 39 -12.261 0.112 -8.464
269 HH11 ARG 39 HH11 ARG 39 -10.133 1.532 -6.036
270 HH12 ARG 39 HH12 ARG 39 -10.241 0.141 -4.987
271 HH21 ARG 39 HH21 ARG 39 -12.375 -1.613 -7.068
272 HH22 ARG 39 HH22 ARG 39 -11.514 -1.587 -5.552
273 H ASN 40 H ASN 40 -9.461 4.530 -12.140
274 HA ASN 40 HA ASN 40 -7.605 6.383 -12.907
275 HB2 ASN 40 HB2 ASN 40 -9.462 7.683 -13.833
276 HB3 ASN 40 HB3 ASN 40 -9.639 5.964 -14.206
277 HD21 ASN 40 HD21 ASN 40 -11.645 5.289 -14.052
278 HD22 ASN 40 HD22 ASN 40 -12.841 5.857 -12.915
Start of MODEL 15
1 H1 ALA 1 H1 ALA 1 2.144 -0.148 -9.312
2 H2 ALA 1 H2 ALA 1 2.491 -1.762 -9.313
3 H3 ALA 1 H3 ALA 1 1.015 -1.238 -8.796
4 HA ALA 1 HA ALA 1 3.597 -0.684 -7.476
5 HB1 ALA 1 HB1 ALA 1 1.996 1.185 -7.165
6 HB2 ALA 1 HB2 ALA 1 0.730 0.049 -6.653
7 HB3 ALA 1 HB3 ALA 1 2.174 0.292 -5.641
8 H THR 2 H THR 2 3.006 -1.520 -4.923
9 HA THR 2 HA THR 2 2.180 -4.358 -5.371
10 HB THR 2 HB THR 2 4.628 -4.131 -4.934
11 HG1 THR 2 HG1 THR 2 4.569 -5.825 -3.488
12 HG21 THR 2 HG21 THR 2 5.385 -3.531 -2.665
13 HG22 THR 2 HG22 THR 2 3.725 -3.103 -2.196
14 HG23 THR 2 HG23 THR 2 4.583 -2.144 -3.428
15 H CYS 3 H CYS 3 1.316 -5.490 -3.635
16 HA CYS 3 HA CYS 3 -0.248 -3.817 -1.714
17 HB2 CYS 3 HB2 CYS 3 -1.429 -5.210 -3.497
18 HB3 CYS 3 HB3 CYS 3 -0.808 -6.643 -2.676
19 H ASP 4 H ASP 4 2.583 -5.339 -1.862
20 HA ASP 4 HA ASP 4 2.523 -7.401 0.094
21 HB2 ASP 4 HB2 ASP 4 4.729 -5.566 -0.901
22 HB3 ASP 4 HB3 ASP 4 5.012 -6.843 0.285
23 H LEU 5 H LEU 5 3.454 -7.522 2.141
24 HA LEU 5 HA LEU 5 3.483 -4.951 3.684
25 HB2 LEU 5 HB2 LEU 5 3.075 -6.415 5.693
26 HB3 LEU 5 HB3 LEU 5 1.731 -6.420 4.558
27 HG LEU 5 HG LEU 5 3.669 -8.598 4.076
28 HD11 LEU 5 HD11 LEU 5 3.073 -9.965 5.973
29 HD12 LEU 5 HD12 LEU 5 2.042 -8.680 6.635
30 HD13 LEU 5 HD13 LEU 5 3.805 -8.457 6.553
31 HD21 LEU 5 HD21 LEU 5 1.602 -9.938 3.959
32 HD22 LEU 5 HD22 LEU 5 1.491 -8.475 2.960
33 HD23 LEU 5 HD23 LEU 5 0.657 -8.540 4.536
34 H LEU 6 H LEU 6 5.415 -5.510 2.103
35 HA LEU 6 HA LEU 6 7.508 -7.173 3.228
36 HB2 LEU 6 HB2 LEU 6 7.192 -6.751 0.793
37 HB3 LEU 6 HB3 LEU 6 7.605 -5.060 1.045
38 HG LEU 6 HG LEU 6 9.897 -5.725 1.715
39 HD11 LEU 6 HD11 LEU 6 10.656 -8.053 1.219
40 HD12 LEU 6 HD12 LEU 6 8.960 -8.532 0.976
41 HD13 LEU 6 HD13 LEU 6 9.518 -7.979 2.576
42 HD21 LEU 6 HD21 LEU 6 10.630 -6.370 -0.548
43 HD22 LEU 6 HD22 LEU 6 9.368 -5.124 -0.611
44 HD23 LEU 6 HD23 LEU 6 8.960 -6.819 -0.969
45 H SER 7 H SER 7 6.681 -3.761 3.221
46 HA SER 7 HA SER 7 9.241 -2.975 4.379
47 HB2 SER 7 HB2 SER 7 6.725 -1.371 3.916
48 HB3 SER 7 HB3 SER 7 8.363 -0.718 4.162
49 HG SER 7 HG SER 7 8.964 -1.800 2.211
50 H GLY 8 H GLY 8 6.872 -4.496 5.785
51 HA2 GLY 8 HA2 GLY 8 6.802 -4.625 8.237
52 HA3 GLY 8 HA3 GLY 8 6.940 -2.843 8.255
53 H THR 9 H THR 9 5.123 -1.945 8.686
54 HA THR 9 HA THR 9 2.616 -3.023 8.682
55 HB THR 9 HB THR 9 2.589 -1.203 9.857
56 HG1 THR 9 HG1 THR 9 2.272 0.479 7.667
57 HG21 THR 9 HG21 THR 9 3.873 0.951 9.355
58 HG22 THR 9 HG22 THR 9 4.612 0.070 7.999
59 HG23 THR 9 HG23 THR 9 4.866 -0.477 9.683
60 H GLY 10 H GLY 10 0.754 -2.242 7.714
61 HA2 GLY 10 HA2 GLY 10 -0.444 -1.738 5.633
62 HA3 GLY 10 HA3 GLY 10 1.002 -2.205 4.715
63 H VAL 11 H VAL 11 0.395 -4.201 7.390
64 HA VAL 11 HA VAL 11 -0.107 -6.550 5.948
65 HB VAL 11 HB VAL 11 -0.898 -5.918 8.768
66 HG11 VAL 11 HG11 VAL 11 -0.563 -8.357 9.174
67 HG12 VAL 11 HG12 VAL 11 -1.834 -8.056 7.972
68 HG13 VAL 11 HG13 VAL 11 -0.217 -8.576 7.443
69 HG21 VAL 11 HG21 VAL 11 1.369 -6.942 9.364
70 HG22 VAL 11 HG22 VAL 11 1.796 -6.742 7.654
71 HG23 VAL 11 HG23 VAL 11 1.410 -5.325 8.647
72 H LYS 12 H LYS 12 -2.189 -4.169 7.384
73 HA LYS 12 HA LYS 12 -4.648 -5.358 6.396
74 HB2 LYS 12 HB2 LYS 12 -3.814 -2.639 7.417
75 HB3 LYS 12 HB3 LYS 12 -5.464 -2.978 6.871
76 HG2 LYS 12 HG2 LYS 12 -4.069 -4.387 9.188
77 HG3 LYS 12 HG3 LYS 12 -5.193 -3.031 9.358
78 HD2 LYS 12 HD2 LYS 12 -6.972 -4.414 8.255
79 HD3 LYS 12 HD3 LYS 12 -5.847 -5.789 8.237
80 HE2 LYS 12 HE2 LYS 12 -5.663 -5.657 10.714
81 HE3 LYS 12 HE3 LYS 12 -6.806 -4.302 10.721
82 HZ1 LYS 12 HZ1 LYS 12 -7.908 -6.393 11.224
83 HZ2 LYS 12 HZ2 LYS 12 -7.422 -7.056 9.795
84 HZ3 LYS 12 HZ3 LYS 12 -8.487 -5.795 9.801
85 H HIS 13 H HIS 13 -4.495 -5.684 4.227
86 HA HIS 13 HA HIS 13 -2.814 -4.224 2.501
87 HB2 HIS 13 HB2 HIS 13 -5.099 -6.141 2.053
88 HB3 HIS 13 HB3 HIS 13 -4.223 -5.416 0.706
89 HD1 HIS 13 HD1 HIS 13 -3.977 -8.412 0.858
90 HD2 HIS 13 HD2 HIS 13 -1.385 -5.842 2.924
91 HE1 HIS 13 HE1 HIS 13 -1.835 -9.718 1.313
92 HE2 HIS 13 HE2 HIS 13 -0.294 -8.144 2.552
93 H SER 14 H SER 14 -5.561 -2.898 3.760
94 HA SER 14 HA SER 14 -6.615 -1.484 1.539
95 HB2 SER 14 HB2 SER 14 -6.500 0.031 4.022
96 HB3 SER 14 HB3 SER 14 -7.924 -0.600 3.159
97 HG SER 14 HG SER 14 -7.747 -1.621 5.161
98 H ALA 15 H ALA 15 -3.640 -1.332 3.114
99 HA ALA 15 HA ALA 15 -2.875 1.263 2.818
100 HB1 ALA 15 HB1 ALA 15 -1.566 -0.383 4.063
101 HB2 ALA 15 HB2 ALA 15 -1.173 -1.226 2.544
102 HB3 ALA 15 HB3 ALA 15 -0.550 0.415 2.843
103 H CYS 16 H CYS 16 -2.822 -1.299 0.397
104 HA CYS 16 HA CYS 16 -1.467 0.188 -1.612
105 HB2 CYS 16 HB2 CYS 16 -1.558 -1.996 -2.275
106 HB3 CYS 16 HB3 CYS 16 -3.094 -2.264 -1.450
107 H ALA 17 H ALA 17 -4.823 -0.147 -0.825
108 HA ALA 17 HA ALA 17 -5.814 1.388 -2.999
109 HB1 ALA 17 HB1 ALA 17 -7.268 -0.119 -1.664
110 HB2 ALA 17 HB2 ALA 17 -7.081 0.964 -0.265
111 HB3 ALA 17 HB3 ALA 17 -7.921 1.534 -1.721
112 H ALA 18 H ALA 18 -4.836 2.192 0.251
113 HA ALA 18 HA ALA 18 -5.552 4.950 0.123
114 HB1 ALA 18 HB1 ALA 18 -5.146 3.750 2.254
115 HB2 ALA 18 HB2 ALA 18 -3.423 3.605 1.830
116 HB3 ALA 18 HB3 ALA 18 -4.136 5.209 2.118
117 H HIS 19 H HIS 19 -2.586 3.233 -0.722
118 HA HIS 19 HA HIS 19 -1.018 5.464 -1.108
119 HB2 HIS 19 HB2 HIS 19 -0.254 3.066 -1.030
120 HB3 HIS 19 HB3 HIS 19 -0.791 2.923 -2.709
121 HD1 HIS 19 HD1 HIS 19 1.779 4.756 -0.543
122 HD2 HIS 19 HD2 HIS 19 0.982 3.990 -4.586
123 HE1 HIS 19 HE1 HIS 19 3.800 5.574 -1.865
124 HE2 HIS 19 HE2 HIS 19 3.304 5.102 -4.295
125 H CYS 20 H CYS 20 -3.356 3.887 -3.175
126 HA CYS 20 HA CYS 20 -2.756 5.508 -5.508
127 HB2 CYS 20 HB2 CYS 20 -5.164 3.828 -4.779
128 HB3 CYS 20 HB3 CYS 20 -4.875 4.552 -6.367
129 H LEU 21 H LEU 21 -5.163 5.609 -2.854
130 HA LEU 21 HA LEU 21 -6.758 7.745 -3.851
131 HB2 LEU 21 HB2 LEU 21 -6.041 6.798 -1.082
132 HB3 LEU 21 HB3 LEU 21 -7.058 8.202 -1.314
133 HG LEU 21 HG LEU 21 -7.753 5.417 -2.251
134 HD11 LEU 21 HD11 LEU 21 -9.303 5.396 -0.329
135 HD12 LEU 21 HD12 LEU 21 -8.658 6.963 0.206
136 HD13 LEU 21 HD13 LEU 21 -7.614 5.525 0.196
137 HD21 LEU 21 HD21 LEU 21 -10.037 6.352 -2.461
138 HD22 LEU 21 HD22 LEU 21 -8.896 7.192 -3.522
139 HD23 LEU 21 HD23 LEU 21 -9.416 7.957 -2.009
140 H LEU 22 H LEU 22 -3.685 7.742 -2.071
141 HA LEU 22 HA LEU 22 -3.571 10.548 -1.547
142 HB2 LEU 22 HB2 LEU 22 -1.447 8.423 -1.899
143 HB3 LEU 22 HB3 LEU 22 -1.048 10.092 -1.504
144 HG LEU 22 HG LEU 22 -2.836 8.357 0.227
145 HD11 LEU 22 HD11 LEU 22 -0.583 7.383 0.056
146 HD12 LEU 22 HD12 LEU 22 -0.862 8.068 1.669
147 HD13 LEU 22 HD13 LEU 22 0.138 8.951 0.490
148 HD21 LEU 22 HD21 LEU 22 -2.284 10.050 1.964
149 HD22 LEU 22 HD22 LEU 22 -3.158 10.758 0.595
150 HD23 LEU 22 HD23 LEU 22 -1.402 10.996 0.743
151 H ARG 23 H ARG 23 -3.128 8.824 -4.550
152 HA ARG 23 HA ARG 23 -1.627 11.073 -5.765
153 HB2 ARG 23 HB2 ARG 23 -2.878 8.659 -7.103
154 HB3 ARG 23 HB3 ARG 23 -1.712 9.779 -7.808
155 HG2 ARG 23 HG2 ARG 23 -0.156 8.971 -5.858
156 HG3 ARG 23 HG3 ARG 23 -1.280 7.594 -5.800
157 HD2 ARG 23 HD2 ARG 23 0.374 8.559 -8.155
158 HD3 ARG 23 HD3 ARG 23 0.508 7.002 -7.310
159 HE ARG 23 HE ARG 23 -2.129 7.131 -8.266
160 HH11 ARG 23 HH11 ARG 23 1.060 7.226 -9.802
161 HH12 ARG 23 HH12 ARG 23 0.452 6.560 -11.293
162 HH21 ARG 23 HH21 ARG 23 -2.815 6.303 -10.158
163 HH22 ARG 23 HH22 ARG 23 -1.715 6.037 -11.494
164 H GLY 24 H GLY 24 -4.752 10.710 -4.816
165 HA2 GLY 24 HA2 GLY 24 -6.582 12.021 -5.420
166 HA3 GLY 24 HA3 GLY 24 -5.725 12.560 -6.874
167 H ASN 25 H ASN 25 -5.658 9.147 -6.450
168 HA ASN 25 HA ASN 25 -7.548 8.815 -8.703
169 HB2 ASN 25 HB2 ASN 25 -5.939 6.769 -7.115
170 HB3 ASN 25 HB3 ASN 25 -6.959 6.400 -8.503
171 HD21 ASN 25 HD21 ASN 25 -6.388 8.361 -10.298
172 HD22 ASN 25 HD22 ASN 25 -4.697 8.285 -10.724
173 H ARG 26 H ARG 26 -9.242 7.149 -8.535
174 HA ARG 26 HA ARG 26 -11.009 7.536 -6.352
175 HB2 ARG 26 HB2 ARG 26 -10.843 5.829 -8.740
176 HB3 ARG 26 HB3 ARG 26 -11.881 5.262 -7.445
177 HG2 ARG 26 HG2 ARG 26 -12.878 6.707 -9.409
178 HG3 ARG 26 HG3 ARG 26 -13.466 6.884 -7.757
179 HD2 ARG 26 HD2 ARG 26 -13.230 9.068 -8.796
180 HD3 ARG 26 HD3 ARG 26 -12.096 8.907 -7.453
181 HE ARG 26 HE ARG 26 -11.003 8.282 -10.123
182 HH11 ARG 26 HH11 ARG 26 -11.424 10.777 -7.643
183 HH12 ARG 26 HH12 ARG 26 -10.062 11.701 -8.221
184 HH21 ARG 26 HH21 ARG 26 -9.282 9.546 -10.794
185 HH22 ARG 26 HH22 ARG 26 -8.916 11.044 -9.963
186 H GLY 27 H GLY 27 -8.295 5.419 -6.637
187 HA2 GLY 27 HA2 GLY 27 -7.807 4.660 -4.179
188 HA3 GLY 27 HA3 GLY 27 -9.309 3.720 -4.410
189 H GLY 28 H GLY 28 -7.746 1.835 -4.092
190 HA2 GLY 28 HA2 GLY 28 -6.903 0.963 -6.789
191 HA3 GLY 28 HA3 GLY 28 -5.678 0.956 -5.504
192 H TYR 29 H TYR 29 -6.286 -1.446 -6.684
193 HA TYR 29 HA TYR 29 -7.557 -2.796 -4.476
194 HB2 TYR 29 HB2 TYR 29 -8.747 -4.358 -5.967
195 HB3 TYR 29 HB3 TYR 29 -9.348 -2.706 -6.096
196 HD1 TYR 29 HD2 TYR 29 -8.936 -1.356 -8.142
197 HD2 TYR 29 HD1 TYR 29 -7.583 -5.436 -7.846
198 HE1 TYR 29 HE2 TYR 29 -8.630 -1.440 -10.616
199 HE2 TYR 29 HE1 TYR 29 -7.290 -5.508 -10.319
200 HH TYR 29 HH TYR 29 -8.039 -2.721 -12.418
201 H CYS 30 H CYS 30 -6.925 -5.146 -4.425
202 HA CYS 30 HA CYS 30 -4.156 -5.344 -5.491
203 HB2 CYS 30 HB2 CYS 30 -5.417 -6.750 -3.123
204 HB3 CYS 30 HB3 CYS 30 -3.751 -6.946 -3.689
205 H ASN 31 H ASN 31 -3.674 -6.827 -6.909
206 HA ASN 31 HA ASN 31 -5.669 -8.833 -7.754
207 HB2 ASN 31 HB2 ASN 31 -2.780 -8.278 -8.563
208 HB3 ASN 31 HB3 ASN 31 -3.756 -9.581 -9.253
209 HD21 ASN 31 HD21 ASN 31 -2.625 -7.573 -10.809
210 HD22 ASN 31 HD22 ASN 31 -3.924 -6.618 -11.476
211 H GLY 32 H GLY 32 -5.056 -11.170 -7.776
212 HA2 GLY 32 HA2 GLY 32 -4.277 -12.051 -5.193
213 HA3 GLY 32 HA3 GLY 32 -4.512 -13.068 -6.612
214 H ARG 33 H ARG 33 -2.102 -10.880 -7.394
215 HA ARG 33 HA ARG 33 -0.032 -12.651 -6.461
216 HB2 ARG 33 HB2 ARG 33 -0.086 -10.995 -8.977
217 HB3 ARG 33 HB3 ARG 33 1.348 -11.841 -8.377
218 HG2 ARG 33 HG2 ARG 33 0.014 -13.984 -8.464
219 HG3 ARG 33 HG3 ARG 33 -1.233 -13.084 -9.354
220 HD2 ARG 33 HD2 ARG 33 0.432 -12.487 -11.077
221 HD3 ARG 33 HD3 ARG 33 1.691 -13.344 -10.163
222 HE ARG 33 HE ARG 33 -0.485 -15.117 -10.687
223 HH11 ARG 33 HH11 ARG 33 2.218 -13.590 -12.369
224 HH12 ARG 33 HH12 ARG 33 2.323 -14.866 -13.553
225 HH21 ARG 33 HH21 ARG 33 -0.286 -16.709 -12.230
226 HH22 ARG 33 HH22 ARG 33 0.928 -16.595 -13.473
227 H ALA 34 H ALA 34 -1.324 -10.305 -5.197
228 HA ALA 34 HA ALA 34 -0.769 -8.636 -3.808
229 HB1 ALA 34 HB1 ALA 34 1.432 -8.596 -2.767
230 HB2 ALA 34 HB2 ALA 34 0.940 -10.289 -2.986
231 HB3 ALA 34 HB3 ALA 34 2.127 -9.553 -4.088
232 H ILE 35 H ILE 35 -0.842 -8.258 -6.654
233 HA ILE 35 HA ILE 35 0.989 -5.921 -6.986
234 HB ILE 35 HB ILE 35 -1.020 -7.014 -8.953
235 HG12 ILE 35 HG12 ILE 35 1.963 -7.496 -8.659
236 HG13 ILE 35 HG13 ILE 35 0.679 -8.701 -8.526
237 HG21 ILE 35 HG21 ILE 35 -0.445 -4.603 -9.322
238 HG22 ILE 35 HG22 ILE 35 1.283 -5.032 -9.360
239 HG23 ILE 35 HG23 ILE 35 0.176 -5.604 -10.630
240 HD11 ILE 35 HD11 ILE 35 1.633 -7.272 -10.995
241 HD12 ILE 35 HD12 ILE 35 1.700 -9.011 -10.632
242 HD13 ILE 35 HD13 ILE 35 0.131 -8.226 -10.944
243 H CYS 36 H CYS 36 0.249 -3.934 -7.048
244 HA CYS 36 HA CYS 36 -2.565 -3.474 -6.099
245 HB2 CYS 36 HB2 CYS 36 -0.815 -2.697 -4.549
246 HB3 CYS 36 HB3 CYS 36 -0.108 -1.730 -5.841
247 H VAL 37 H VAL 37 -3.944 -2.492 -7.479
248 HA VAL 37 HA VAL 37 -2.790 -1.146 -9.862
249 HB VAL 37 HB VAL 37 -5.262 -2.912 -9.674
250 HG11 VAL 37 HG11 VAL 37 -5.311 -2.641 -12.172
251 HG12 VAL 37 HG12 VAL 37 -5.550 -1.102 -11.322
252 HG13 VAL 37 HG13 VAL 37 -3.971 -1.480 -12.052
253 HG21 VAL 37 HG21 VAL 37 -3.286 -4.319 -9.606
254 HG22 VAL 37 HG22 VAL 37 -4.000 -4.427 -11.225
255 HG23 VAL 37 HG23 VAL 37 -2.549 -3.429 -10.963
256 H CYS 38 H CYS 38 -3.135 0.849 -9.451
257 HA CYS 38 HA CYS 38 -5.290 1.932 -7.882
258 HB2 CYS 38 HB2 CYS 38 -3.511 3.303 -9.928
259 HB3 CYS 38 HB3 CYS 38 -4.536 4.113 -8.743
260 H ARG 39 H ARG 39 -7.106 3.104 -8.572
261 HA ARG 39 HA ARG 39 -8.185 2.331 -11.192
262 HB2 ARG 39 HB2 ARG 39 -9.350 3.866 -8.844
263 HB3 ARG 39 HB3 ARG 39 -10.240 3.456 -10.316
264 HG2 ARG 39 HG2 ARG 39 -9.952 1.054 -9.834
265 HG3 ARG 39 HG3 ARG 39 -9.071 1.457 -8.346
266 HD2 ARG 39 HD2 ARG 39 -11.048 2.577 -7.433
267 HD3 ARG 39 HD3 ARG 39 -11.925 2.314 -8.950
268 HE ARG 39 HE ARG 39 -12.258 0.076 -8.406
269 HH11 ARG 39 HH11 ARG 39 -10.122 1.511 -5.995
270 HH12 ARG 39 HH12 ARG 39 -10.235 0.133 -4.930
271 HH21 ARG 39 HH21 ARG 39 -12.380 -1.633 -6.991
272 HH22 ARG 39 HH22 ARG 39 -11.517 -1.597 -5.478
273 H ASN 40 H ASN 40 -9.457 4.421 -12.151
274 HA ASN 40 HA ASN 40 -7.609 6.260 -12.956
275 HB2 ASN 40 HB2 ASN 40 -9.478 7.545 -13.887
276 HB3 ASN 40 HB3 ASN 40 -9.647 5.822 -14.237
277 HD21 ASN 40 HD21 ASN 40 -11.650 5.137 -14.068
278 HD22 ASN 40 HD22 ASN 40 -12.842 5.713 -12.930
Start of MODEL 16
1 H1 ALA 1 H1 ALA 1 1.804 0.089 -9.636
2 H2 ALA 1 H2 ALA 1 2.324 -1.477 -9.584
3 H3 ALA 1 H3 ALA 1 0.786 -1.106 -9.120
4 HA ALA 1 HA ALA 1 3.253 -0.237 -7.748
5 HB1 ALA 1 HB1 ALA 1 1.452 1.449 -7.521
6 HB2 ALA 1 HB2 ALA 1 0.296 0.190 -7.034
7 HB3 ALA 1 HB3 ALA 1 1.665 0.603 -5.973
8 H THR 2 H THR 2 2.761 -1.093 -5.208
9 HA THR 2 HA THR 2 2.169 -3.997 -5.594
10 HB THR 2 HB THR 2 4.611 -3.546 -5.259
11 HG1 THR 2 HG1 THR 2 4.753 -5.232 -3.775
12 HG21 THR 2 HG21 THR 2 5.390 -2.909 -3.010
13 HG22 THR 2 HG22 THR 2 3.719 -2.651 -2.467
14 HG23 THR 2 HG23 THR 2 4.430 -1.591 -3.711
15 H CYS 3 H CYS 3 1.487 -5.180 -3.801
16 HA CYS 3 HA CYS 3 -0.150 -3.605 -1.842
17 HB2 CYS 3 HB2 CYS 3 -1.239 -5.173 -3.580
18 HB3 CYS 3 HB3 CYS 3 -0.487 -6.498 -2.690
19 H ASP 4 H ASP 4 2.793 -4.861 -2.083
20 HA ASP 4 HA ASP 4 3.022 -6.948 -0.193
21 HB2 ASP 4 HB2 ASP 4 4.975 -4.824 -1.139
22 HB3 ASP 4 HB3 ASP 4 5.433 -6.106 -0.012
23 H LEU 5 H LEU 5 3.930 -7.064 1.824
24 HA LEU 5 HA LEU 5 3.730 -4.615 3.522
25 HB2 LEU 5 HB2 LEU 5 3.451 -6.277 5.417
26 HB3 LEU 5 HB3 LEU 5 2.094 -6.208 4.299
27 HG LEU 5 HG LEU 5 4.061 -8.261 3.549
28 HD11 LEU 5 HD11 LEU 5 3.586 -9.835 5.311
29 HD12 LEU 5 HD12 LEU 5 2.535 -8.668 6.141
30 HD13 LEU 5 HD13 LEU 5 4.288 -8.368 6.025
31 HD21 LEU 5 HD21 LEU 5 2.031 -9.617 3.314
32 HD22 LEU 5 HD22 LEU 5 1.793 -8.022 2.567
33 HD23 LEU 5 HD23 LEU 5 1.075 -8.375 4.160
34 H LEU 6 H LEU 6 5.724 -4.946 1.919
35 HA LEU 6 HA LEU 6 7.954 -6.476 2.971
36 HB2 LEU 6 HB2 LEU 6 7.668 -5.870 0.575
37 HB3 LEU 6 HB3 LEU 6 7.840 -4.170 0.991
38 HG LEU 6 HG LEU 6 10.186 -4.585 1.690
39 HD11 LEU 6 HD11 LEU 6 11.265 -6.723 0.993
40 HD12 LEU 6 HD12 LEU 6 9.659 -7.394 0.626
41 HD13 LEU 6 HD13 LEU 6 10.088 -6.950 2.297
42 HD21 LEU 6 HD21 LEU 6 11.052 -4.878 -0.599
43 HD22 LEU 6 HD22 LEU 6 9.636 -3.809 -0.575
44 HD23 LEU 6 HD23 LEU 6 9.467 -5.496 -1.127
45 H SER 7 H SER 7 6.756 -3.199 3.214
46 HA SER 7 HA SER 7 9.171 -2.174 4.465
47 HB2 SER 7 HB2 SER 7 6.439 -0.929 4.168
48 HB3 SER 7 HB3 SER 7 7.983 -0.070 4.385
49 HG SER 7 HG SER 7 7.487 -0.017 2.217
50 H GLY 8 H GLY 8 7.125 -4.138 5.853
51 HA2 GLY 8 HA2 GLY 8 6.718 -4.245 8.269
52 HA3 GLY 8 HA3 GLY 8 6.817 -2.456 8.314
53 H THR 9 H THR 9 4.915 -1.507 8.351
54 HA THR 9 HA THR 9 2.455 -2.688 8.080
55 HB THR 9 HB THR 9 2.185 -0.732 9.010
56 HG1 THR 9 HG1 THR 9 1.904 1.039 7.224
57 HG21 THR 9 HG21 THR 9 3.510 1.389 8.454
58 HG22 THR 9 HG22 THR 9 4.459 0.390 7.332
59 HG23 THR 9 HG23 THR 9 4.473 0.047 9.089
60 H GLY 10 H GLY 10 0.783 -2.193 6.742
61 HA2 GLY 10 HA2 GLY 10 0.003 -1.977 4.378
62 HA3 GLY 10 HA3 GLY 10 1.562 -2.659 3.864
63 H VAL 11 H VAL 11 0.904 -4.183 6.653
64 HA VAL 11 HA VAL 11 0.240 -6.689 5.612
65 HB VAL 11 HB VAL 11 -0.358 -5.617 8.357
66 HG11 VAL 11 HG11 VAL 11 -0.117 -7.981 9.107
67 HG12 VAL 11 HG12 VAL 11 -1.447 -7.793 7.947
68 HG13 VAL 11 HG13 VAL 11 0.106 -8.478 7.413
69 HG21 VAL 11 HG21 VAL 11 1.860 -6.561 9.029
70 HG22 VAL 11 HG22 VAL 11 2.202 -6.873 7.319
71 HG23 VAL 11 HG23 VAL 11 1.996 -5.212 7.892
72 H LYS 12 H LYS 12 -1.720 -4.112 6.878
73 HA LYS 12 HA LYS 12 -4.224 -5.423 6.161
74 HB2 LYS 12 HB2 LYS 12 -3.433 -2.631 7.006
75 HB3 LYS 12 HB3 LYS 12 -5.106 -3.101 6.662
76 HG2 LYS 12 HG2 LYS 12 -3.349 -4.254 8.875
77 HG3 LYS 12 HG3 LYS 12 -4.613 -3.037 9.098
78 HD2 LYS 12 HD2 LYS 12 -6.308 -4.682 8.263
79 HD3 LYS 12 HD3 LYS 12 -5.026 -5.909 8.158
80 HE2 LYS 12 HE2 LYS 12 -4.582 -5.632 10.593
81 HE3 LYS 12 HE3 LYS 12 -5.902 -4.451 10.689
82 HZ1 LYS 12 HZ1 LYS 12 -6.629 -6.653 11.373
83 HZ2 LYS 12 HZ2 LYS 12 -6.208 -7.304 9.917
84 HZ3 LYS 12 HZ3 LYS 12 -7.436 -6.206 10.005
85 H HIS 13 H HIS 13 -4.243 -5.815 4.014
86 HA HIS 13 HA HIS 13 -2.734 -4.401 2.109
87 HB2 HIS 13 HB2 HIS 13 -5.063 -6.309 1.880
88 HB3 HIS 13 HB3 HIS 13 -4.223 -5.671 0.467
89 HD1 HIS 13 HD1 HIS 13 -4.182 -8.755 1.197
90 HD2 HIS 13 HD2 HIS 13 -1.180 -5.987 2.174
91 HE1 HIS 13 HE1 HIS 13 -2.028 -10.076 1.532
92 HE2 HIS 13 HE2 HIS 13 -0.238 -8.385 2.120
93 H SER 14 H SER 14 -5.509 -3.199 3.518
94 HA SER 14 HA SER 14 -6.658 -1.752 1.365
95 HB2 SER 14 HB2 SER 14 -6.598 -0.305 3.881
96 HB3 SER 14 HB3 SER 14 -7.991 -1.029 3.037
97 HG SER 14 HG SER 14 -7.707 -2.080 5.002
98 H ALA 15 H ALA 15 -3.666 -1.493 2.931
99 HA ALA 15 HA ALA 15 -3.047 1.170 2.697
100 HB1 ALA 15 HB1 ALA 15 -1.650 -0.431 3.895
101 HB2 ALA 15 HB2 ALA 15 -1.223 -1.220 2.356
102 HB3 ALA 15 HB3 ALA 15 -0.689 0.446 2.684
103 H CYS 16 H CYS 16 -2.968 -1.345 0.217
104 HA CYS 16 HA CYS 16 -1.639 0.171 -1.785
105 HB2 CYS 16 HB2 CYS 16 -1.762 -2.010 -2.450
106 HB3 CYS 16 HB3 CYS 16 -3.312 -2.252 -1.643
107 H ALA 17 H ALA 17 -5.010 -0.170 -0.974
108 HA ALA 17 HA ALA 17 -6.021 1.422 -3.097
109 HB1 ALA 17 HB1 ALA 17 -7.449 -0.100 -1.724
110 HB2 ALA 17 HB2 ALA 17 -7.243 0.997 -0.339
111 HB3 ALA 17 HB3 ALA 17 -8.101 1.552 -1.791
112 H ALA 18 H ALA 18 -5.038 2.157 0.181
113 HA ALA 18 HA ALA 18 -5.700 4.928 0.094
114 HB1 ALA 18 HB1 ALA 18 -5.321 3.683 2.206
115 HB2 ALA 18 HB2 ALA 18 -3.598 3.514 1.786
116 HB3 ALA 18 HB3 ALA 18 -4.285 5.125 2.099
117 H HIS 19 H HIS 19 -2.744 3.182 -0.769
118 HA HIS 19 HA HIS 19 -1.132 5.416 -1.126
119 HB2 HIS 19 HB2 HIS 19 -0.357 3.033 -1.084
120 HB3 HIS 19 HB3 HIS 19 -0.988 2.858 -2.727
121 HD1 HIS 19 HD1 HIS 19 1.800 4.511 -0.745
122 HD2 HIS 19 HD2 HIS 19 0.584 4.083 -4.733
123 HE1 HIS 19 HE1 HIS 19 3.723 5.344 -2.199
124 HE2 HIS 19 HE2 HIS 19 2.972 5.078 -4.597
125 H CYS 20 H CYS 20 -3.450 3.827 -3.249
126 HA CYS 20 HA CYS 20 -2.827 5.467 -5.560
127 HB2 CYS 20 HB2 CYS 20 -5.308 3.879 -4.842
128 HB3 CYS 20 HB3 CYS 20 -4.962 4.572 -6.430
129 H LEU 21 H LEU 21 -5.273 5.594 -2.932
130 HA LEU 21 HA LEU 21 -6.753 7.821 -3.896
131 HB2 LEU 21 HB2 LEU 21 -6.140 6.789 -1.135
132 HB3 LEU 21 HB3 LEU 21 -7.128 8.213 -1.375
133 HG LEU 21 HG LEU 21 -7.824 5.443 -2.347
134 HD11 LEU 21 HD11 LEU 21 -9.439 5.440 -0.484
135 HD12 LEU 21 HD12 LEU 21 -8.806 7.009 0.066
136 HD13 LEU 21 HD13 LEU 21 -7.770 5.564 0.101
137 HD21 LEU 21 HD21 LEU 21 -10.092 6.395 -2.641
138 HD22 LEU 21 HD22 LEU 21 -8.908 7.213 -3.671
139 HD23 LEU 21 HD23 LEU 21 -9.471 8.000 -2.184
140 H LEU 22 H LEU 22 -3.724 7.657 -2.046
141 HA LEU 22 HA LEU 22 -3.521 10.463 -1.503
142 HB2 LEU 22 HB2 LEU 22 -1.492 8.232 -1.710
143 HB3 LEU 22 HB3 LEU 22 -1.024 9.885 -1.327
144 HG LEU 22 HG LEU 22 -3.007 8.305 0.336
145 HD11 LEU 22 HD11 LEU 22 -0.830 7.167 0.321
146 HD12 LEU 22 HD12 LEU 22 -1.133 7.926 1.896
147 HD13 LEU 22 HD13 LEU 22 -0.015 8.692 0.744
148 HD21 LEU 22 HD21 LEU 22 -2.436 9.993 2.068
149 HD22 LEU 22 HD22 LEU 22 -3.179 10.729 0.638
150 HD23 LEU 22 HD23 LEU 22 -1.422 10.848 0.883
151 H ARG 23 H ARG 23 -3.108 8.758 -4.493
152 HA ARG 23 HA ARG 23 -1.458 10.966 -5.637
153 HB2 ARG 23 HB2 ARG 23 -2.672 8.547 -7.011
154 HB3 ARG 23 HB3 ARG 23 -1.506 9.678 -7.698
155 HG2 ARG 23 HG2 ARG 23 0.031 8.892 -5.733
156 HG3 ARG 23 HG3 ARG 23 -1.080 7.505 -5.682
157 HD2 ARG 23 HD2 ARG 23 0.552 8.486 -8.046
158 HD3 ARG 23 HD3 ARG 23 0.749 6.950 -7.175
159 HE ARG 23 HE ARG 23 -1.900 6.979 -8.117
160 HH11 ARG 23 HH11 ARG 23 1.283 7.121 -9.661
161 HH12 ARG 23 HH12 ARG 23 0.693 6.397 -11.132
162 HH21 ARG 23 HH21 ARG 23 -2.564 6.077 -9.983
163 HH22 ARG 23 HH22 ARG 23 -1.458 5.809 -11.315
164 H GLY 24 H GLY 24 -4.606 10.636 -4.790
165 HA2 GLY 24 HA2 GLY 24 -6.409 11.951 -5.461
166 HA3 GLY 24 HA3 GLY 24 -5.509 12.467 -6.898
167 H ASN 25 H ASN 25 -5.427 9.059 -6.500
168 HA ASN 25 HA ASN 25 -7.282 8.734 -8.776
169 HB2 ASN 25 HB2 ASN 25 -5.816 6.651 -7.101
170 HB3 ASN 25 HB3 ASN 25 -6.770 6.318 -8.539
171 HD21 ASN 25 HD21 ASN 25 -6.024 8.239 -10.309
172 HD22 ASN 25 HD22 ASN 25 -4.315 8.103 -10.636
173 H ARG 26 H ARG 26 -9.052 7.168 -8.627
174 HA ARG 26 HA ARG 26 -10.765 7.707 -6.418
175 HB2 ARG 26 HB2 ARG 26 -10.841 6.181 -8.935
176 HB3 ARG 26 HB3 ARG 26 -11.957 5.651 -7.691
177 HG2 ARG 26 HG2 ARG 26 -12.798 7.346 -9.459
178 HG3 ARG 26 HG3 ARG 26 -13.234 7.580 -7.768
179 HD2 ARG 26 HD2 ARG 26 -12.686 9.713 -8.779
180 HD3 ARG 26 HD3 ARG 26 -11.500 9.322 -7.533
181 HE ARG 26 HE ARG 26 -10.520 8.471 -10.098
182 HH11 ARG 26 HH11 ARG 26 -11.095 11.434 -8.250
183 HH12 ARG 26 HH12 ARG 26 -9.803 12.285 -9.048
184 HH21 ARG 26 HH21 ARG 26 -8.876 9.633 -11.055
185 HH22 ARG 26 HH22 ARG 26 -8.600 11.299 -10.608
186 H GLY 27 H GLY 27 -8.213 5.487 -6.538
187 HA2 GLY 27 HA2 GLY 27 -8.060 4.509 -4.143
188 HA3 GLY 27 HA3 GLY 27 -9.573 3.669 -4.596
189 H GLY 28 H GLY 28 -8.157 1.652 -4.243
190 HA2 GLY 28 HA2 GLY 28 -7.239 0.793 -6.870
191 HA3 GLY 28 HA3 GLY 28 -5.936 0.921 -5.671
192 H TYR 29 H TYR 29 -6.446 -1.582 -6.718
193 HA TYR 29 HA TYR 29 -7.516 -2.922 -4.371
194 HB2 TYR 29 HB2 TYR 29 -8.767 -4.546 -5.638
195 HB3 TYR 29 HB3 TYR 29 -9.359 -2.927 -6.017
196 HD1 TYR 29 HD2 TYR 29 -8.945 -1.930 -8.263
197 HD2 TYR 29 HD1 TYR 29 -7.608 -5.914 -7.316
198 HE1 TYR 29 HE2 TYR 29 -8.630 -2.410 -10.688
199 HE2 TYR 29 HE1 TYR 29 -7.302 -6.377 -9.744
200 HH TYR 29 HH TYR 29 -8.069 -3.975 -12.260
201 H CYS 30 H CYS 30 -6.765 -5.241 -4.263
202 HA CYS 30 HA CYS 30 -4.045 -5.362 -5.461
203 HB2 CYS 30 HB2 CYS 30 -5.167 -6.798 -3.039
204 HB3 CYS 30 HB3 CYS 30 -3.518 -6.943 -3.664
205 H ASN 31 H ASN 31 -3.490 -6.885 -6.819
206 HA ASN 31 HA ASN 31 -5.378 -9.021 -7.597
207 HB2 ASN 31 HB2 ASN 31 -2.506 -8.340 -8.376
208 HB3 ASN 31 HB3 ASN 31 -3.367 -9.751 -9.000
209 HD21 ASN 31 HD21 ASN 31 -2.285 -7.395 -10.398
210 HD22 ASN 31 HD22 ASN 31 -3.651 -6.742 -11.268
211 H GLY 32 H GLY 32 -4.693 -11.317 -7.451
212 HA2 GLY 32 HA2 GLY 32 -3.757 -12.012 -4.849
213 HA3 GLY 32 HA3 GLY 32 -4.029 -13.121 -6.192
214 H ARG 33 H ARG 33 -1.822 -10.875 -7.278
215 HA ARG 33 HA ARG 33 0.432 -12.527 -6.484
216 HB2 ARG 33 HB2 ARG 33 0.100 -10.787 -8.931
217 HB3 ARG 33 HB3 ARG 33 1.591 -11.633 -8.493
218 HG2 ARG 33 HG2 ARG 33 0.285 -13.795 -8.570
219 HG3 ARG 33 HG3 ARG 33 -1.059 -12.876 -9.281
220 HD2 ARG 33 HD2 ARG 33 0.430 -12.146 -11.120
221 HD3 ARG 33 HD3 ARG 33 1.764 -13.070 -10.400
222 HE ARG 33 HE ARG 33 -0.441 -14.819 -10.782
223 HH11 ARG 33 HH11 ARG 33 1.940 -13.091 -12.737
224 HH12 ARG 33 HH12 ARG 33 1.868 -14.262 -14.024
225 HH21 ARG 33 HH21 ARG 33 -0.474 -16.272 -12.468
226 HH22 ARG 33 HH22 ARG 33 0.525 -16.026 -13.873
227 H ALA 34 H ALA 34 -0.926 -10.218 -5.150
228 HA ALA 34 HA ALA 34 -0.393 -8.499 -3.809
229 HB1 ALA 34 HB1 ALA 34 1.850 -8.335 -2.862
230 HB2 ALA 34 HB2 ALA 34 1.423 -10.054 -3.030
231 HB3 ALA 34 HB3 ALA 34 2.529 -9.288 -4.195
232 H ILE 35 H ILE 35 -0.570 -8.168 -6.663
233 HA ILE 35 HA ILE 35 1.106 -5.726 -7.073
234 HB ILE 35 HB ILE 35 -0.858 -6.992 -8.990
235 HG12 ILE 35 HG12 ILE 35 2.167 -7.225 -8.825
236 HG13 ILE 35 HG13 ILE 35 1.009 -8.521 -8.518
237 HG21 ILE 35 HG21 ILE 35 -0.467 -4.563 -9.425
238 HG22 ILE 35 HG22 ILE 35 1.289 -4.859 -9.468
239 HG23 ILE 35 HG23 ILE 35 0.221 -5.543 -10.715
240 HD11 ILE 35 HD11 ILE 35 1.642 -7.193 -11.143
241 HD12 ILE 35 HD12 ILE 35 1.898 -8.887 -10.673
242 HD13 ILE 35 HD13 ILE 35 0.244 -8.271 -10.907
243 H CYS 36 H CYS 36 0.222 -3.777 -7.169
244 HA CYS 36 HA CYS 36 -2.605 -3.504 -6.174
245 HB2 CYS 36 HB2 CYS 36 -0.911 -2.577 -4.664
246 HB3 CYS 36 HB3 CYS 36 -0.245 -1.620 -5.982
247 H VAL 37 H VAL 37 -4.072 -2.593 -7.492
248 HA VAL 37 HA VAL 37 -3.089 -1.298 -9.986
249 HB VAL 37 HB VAL 37 -5.563 -3.029 -9.571
250 HG11 VAL 37 HG11 VAL 37 -5.777 -2.858 -12.060
251 HG12 VAL 37 HG12 VAL 37 -5.924 -1.276 -11.271
252 HG13 VAL 37 HG13 VAL 37 -4.407 -1.727 -12.088
253 HG21 VAL 37 HG21 VAL 37 -3.587 -4.443 -9.558
254 HG22 VAL 37 HG22 VAL 37 -4.431 -4.635 -11.104
255 HG23 VAL 37 HG23 VAL 37 -2.956 -3.641 -11.020
256 H CYS 38 H CYS 38 -3.354 0.733 -9.555
257 HA CYS 38 HA CYS 38 -5.443 1.846 -7.911
258 HB2 CYS 38 HB2 CYS 38 -3.646 3.181 -9.968
259 HB3 CYS 38 HB3 CYS 38 -4.663 4.018 -8.792
260 H ARG 39 H ARG 39 -7.209 3.101 -8.517
261 HA ARG 39 HA ARG 39 -8.470 2.421 -11.090
262 HB2 ARG 39 HB2 ARG 39 -9.294 4.213 -8.768
263 HB3 ARG 39 HB3 ARG 39 -10.316 3.847 -10.159
264 HG2 ARG 39 HG2 ARG 39 -10.541 1.546 -9.502
265 HG3 ARG 39 HG3 ARG 39 -9.284 1.713 -8.258
266 HD2 ARG 39 HD2 ARG 39 -10.680 3.332 -7.047
267 HD3 ARG 39 HD3 ARG 39 -11.944 3.185 -8.278
268 HE ARG 39 HE ARG 39 -11.593 0.601 -7.443
269 HH11 ARG 39 HH11 ARG 39 -12.238 3.596 -5.644
270 HH12 ARG 39 HH12 ARG 39 -13.152 2.752 -4.423
271 HH21 ARG 39 HH21 ARG 39 -12.754 -0.381 -5.824
272 HH22 ARG 39 HH22 ARG 39 -13.426 0.554 -4.516
273 H ASN 40 H ASN 40 -9.408 4.558 -12.205
274 HA ASN 40 HA ASN 40 -7.338 6.217 -12.960
275 HB2 ASN 40 HB2 ASN 40 -9.013 7.615 -14.049
276 HB3 ASN 40 HB3 ASN 40 -9.375 5.907 -14.325
277 HD21 ASN 40 HD21 ASN 40 -11.428 5.386 -14.120
278 HD22 ASN 40 HD22 ASN 40 -12.596 6.196 -13.107
Start of MODEL 17
1 H1 ALA 1 H1 ALA 1 1.522 -0.010 -9.435
2 H2 ALA 1 H2 ALA 1 2.064 -1.567 -9.339
3 H3 ALA 1 H3 ALA 1 0.532 -1.197 -8.853
4 HA ALA 1 HA ALA 1 3.013 -0.238 -7.576
5 HB1 ALA 1 HB1 ALA 1 0.065 0.159 -6.806
6 HB2 ALA 1 HB2 ALA 1 1.447 0.620 -5.782
7 HB3 ALA 1 HB3 ALA 1 1.195 1.420 -7.347
8 H THR 2 H THR 2 2.575 -0.991 -5.002
9 HA THR 2 HA THR 2 2.313 -3.960 -5.247
10 HB THR 2 HB THR 2 4.608 -3.415 -4.736
11 HG1 THR 2 HG1 THR 2 4.229 -5.030 -3.361
12 HG21 THR 2 HG21 THR 2 5.182 -2.046 -2.703
13 HG22 THR 2 HG22 THR 2 3.475 -1.574 -2.577
14 HG23 THR 2 HG23 THR 2 4.439 -1.096 -4.001
15 H CYS 3 H CYS 3 1.339 -5.131 -3.648
16 HA CYS 3 HA CYS 3 -0.413 -3.609 -1.746
17 HB2 CYS 3 HB2 CYS 3 -1.497 -5.020 -3.546
18 HB3 CYS 3 HB3 CYS 3 -0.711 -6.433 -2.841
19 H ASP 4 H ASP 4 2.507 -5.089 -1.895
20 HA ASP 4 HA ASP 4 2.371 -7.141 0.089
21 HB2 ASP 4 HB2 ASP 4 4.684 -5.460 -0.932
22 HB3 ASP 4 HB3 ASP 4 4.864 -6.858 0.134
23 H LEU 5 H LEU 5 3.277 -7.239 2.143
24 HA LEU 5 HA LEU 5 3.319 -4.657 3.628
25 HB2 LEU 5 HB2 LEU 5 3.320 -6.348 5.637
26 HB3 LEU 5 HB3 LEU 5 1.831 -6.023 4.775
27 HG LEU 5 HG LEU 5 2.087 -8.149 3.504
28 HD11 LEU 5 HD11 LEU 5 3.629 -9.894 4.373
29 HD12 LEU 5 HD12 LEU 5 4.408 -8.670 5.407
30 HD13 LEU 5 HD13 LEU 5 4.504 -8.537 3.639
31 HD21 LEU 5 HD21 LEU 5 1.494 -9.617 5.392
32 HD22 LEU 5 HD22 LEU 5 0.687 -8.041 5.489
33 HD23 LEU 5 HD23 LEU 5 2.091 -8.387 6.528
34 H LEU 6 H LEU 6 5.211 -5.045 1.921
35 HA LEU 6 HA LEU 6 7.558 -6.386 3.003
36 HB2 LEU 6 HB2 LEU 6 7.091 -6.142 0.566
37 HB3 LEU 6 HB3 LEU 6 7.248 -4.397 0.726
38 HG LEU 6 HG LEU 6 9.640 -4.668 1.321
39 HD11 LEU 6 HD11 LEU 6 10.731 -6.872 0.883
40 HD12 LEU 6 HD12 LEU 6 9.121 -7.615 0.731
41 HD13 LEU 6 HD13 LEU 6 9.646 -6.913 2.282
42 HD21 LEU 6 HD21 LEU 6 10.378 -5.288 -0.947
43 HD22 LEU 6 HD22 LEU 6 8.931 -4.261 -0.999
44 HD23 LEU 6 HD23 LEU 6 8.786 -6.015 -1.275
45 H SER 7 H SER 7 6.178 -3.197 2.893
46 HA SER 7 HA SER 7 8.559 -1.835 3.824
47 HB2 SER 7 HB2 SER 7 5.692 -0.897 3.717
48 HB3 SER 7 HB3 SER 7 7.144 0.130 3.719
49 HG SER 7 HG SER 7 6.336 -0.106 1.612
50 H GLY 8 H GLY 8 6.862 -3.865 5.556
51 HA2 GLY 8 HA2 GLY 8 6.708 -3.907 7.966
52 HA3 GLY 8 HA3 GLY 8 6.853 -2.117 7.969
53 H THR 9 H THR 9 5.042 -1.112 8.245
54 HA THR 9 HA THR 9 2.519 -2.176 8.419
55 HB THR 9 HB THR 9 2.497 -0.186 9.324
56 HG1 THR 9 HG1 THR 9 1.935 1.573 7.677
57 HG21 THR 9 HG21 THR 9 3.810 1.851 8.498
58 HG22 THR 9 HG22 THR 9 4.517 0.779 7.269
59 HG23 THR 9 HG23 THR 9 4.799 0.475 9.010
60 H GLY 10 H GLY 10 0.668 -1.604 7.348
61 HA2 GLY 10 HA2 GLY 10 -0.545 -1.422 5.230
62 HA3 GLY 10 HA3 GLY 10 0.920 -1.938 4.370
63 H VAL 11 H VAL 11 0.496 -3.623 7.252
64 HA VAL 11 HA VAL 11 0.045 -6.143 6.132
65 HB VAL 11 HB VAL 11 -0.646 -5.196 8.903
66 HG11 VAL 11 HG11 VAL 11 -0.350 -7.571 9.583
67 HG12 VAL 11 HG12 VAL 11 -1.690 -7.373 8.434
68 HG13 VAL 11 HG13 VAL 11 -0.128 -8.014 7.877
69 HG21 VAL 11 HG21 VAL 11 1.940 -6.383 7.816
70 HG22 VAL 11 HG22 VAL 11 1.711 -4.732 8.425
71 HG23 VAL 11 HG23 VAL 11 1.601 -6.106 9.537
72 H LYS 12 H LYS 12 -2.197 -3.773 7.397
73 HA LYS 12 HA LYS 12 -4.523 -5.255 6.443
74 HB2 LYS 12 HB2 LYS 12 -4.008 -2.463 7.467
75 HB3 LYS 12 HB3 LYS 12 -5.584 -2.939 6.815
76 HG2 LYS 12 HG2 LYS 12 -4.232 -4.253 9.211
77 HG3 LYS 12 HG3 LYS 12 -5.469 -2.991 9.317
78 HD2 LYS 12 HD2 LYS 12 -7.056 -4.494 8.077
79 HD3 LYS 12 HD3 LYS 12 -5.829 -5.777 8.129
80 HE2 LYS 12 HE2 LYS 12 -5.834 -5.669 10.613
81 HE3 LYS 12 HE3 LYS 12 -7.083 -4.410 10.548
82 HZ1 LYS 12 HZ1 LYS 12 -8.045 -6.593 10.943
83 HZ2 LYS 12 HZ2 LYS 12 -7.401 -7.190 9.547
84 HZ3 LYS 12 HZ3 LYS 12 -8.561 -6.019 9.486
85 H HIS 13 H HIS 13 -4.381 -5.599 4.301
86 HA HIS 13 HA HIS 13 -2.783 -4.075 2.550
87 HB2 HIS 13 HB2 HIS 13 -4.958 -6.120 2.073
88 HB3 HIS 13 HB3 HIS 13 -3.984 -5.432 0.776
89 HD1 HIS 13 HD1 HIS 13 -3.879 -8.512 1.517
90 HD2 HIS 13 HD2 HIS 13 -1.162 -5.598 2.831
91 HE1 HIS 13 HE1 HIS 13 -1.715 -9.722 2.113
92 HE2 HIS 13 HE2 HIS 13 -0.097 -7.945 2.896
93 H SER 14 H SER 14 -5.616 -2.896 3.755
94 HA SER 14 HA SER 14 -6.733 -1.606 1.479
95 HB2 SER 14 HB2 SER 14 -6.614 -0.230 4.129
96 HB3 SER 14 HB3 SER 14 -7.994 -0.438 3.025
97 HG SER 14 HG SER 14 -8.365 -1.814 4.699
98 H ALA 15 H ALA 15 -3.771 -1.256 3.080
99 HA ALA 15 HA ALA 15 -3.124 1.381 2.678
100 HB1 ALA 15 HB1 ALA 15 -1.764 -0.130 4.001
101 HB2 ALA 15 HB2 ALA 15 -1.342 -1.058 2.540
102 HB3 ALA 15 HB3 ALA 15 -0.774 0.619 2.728
103 H CYS 16 H CYS 16 -3.185 -1.272 0.351
104 HA CYS 16 HA CYS 16 -1.761 0.037 -1.733
105 HB2 CYS 16 HB2 CYS 16 -2.063 -2.165 -2.274
106 HB3 CYS 16 HB3 CYS 16 -3.631 -2.235 -1.475
107 H ALA 17 H ALA 17 -5.145 -0.019 -0.894
108 HA ALA 17 HA ALA 17 -6.018 1.582 -3.081
109 HB1 ALA 17 HB1 ALA 17 -8.102 1.902 -1.782
110 HB2 ALA 17 HB2 ALA 17 -7.590 0.198 -1.747
111 HB3 ALA 17 HB3 ALA 17 -7.302 1.247 -0.338
112 H ALA 18 H ALA 18 -4.970 2.304 0.181
113 HA ALA 18 HA ALA 18 -5.464 5.106 0.059
114 HB1 ALA 18 HB1 ALA 18 -3.391 3.622 1.722
115 HB2 ALA 18 HB2 ALA 18 -4.008 5.262 2.027
116 HB3 ALA 18 HB3 ALA 18 -5.096 3.863 2.180
117 H HIS 19 H HIS 19 -2.661 3.168 -0.890
118 HA HIS 19 HA HIS 19 -0.912 5.284 -1.320
119 HB2 HIS 19 HB2 HIS 19 -0.392 2.792 -1.310
120 HB3 HIS 19 HB3 HIS 19 -0.960 2.773 -2.986
121 HD1 HIS 19 HD1 HIS 19 1.959 3.725 -0.829
122 HD2 HIS 19 HD2 HIS 19 0.726 4.270 -4.798
123 HE1 HIS 19 HE1 HIS 19 3.988 4.566 -2.129
124 HE2 HIS 19 HE2 HIS 19 3.226 4.889 -4.514
125 H CYS 20 H CYS 20 -3.516 3.999 -3.265
126 HA CYS 20 HA CYS 20 -2.824 5.568 -5.618
127 HB2 CYS 20 HB2 CYS 20 -5.388 4.144 -4.871
128 HB3 CYS 20 HB3 CYS 20 -4.968 4.749 -6.477
129 H LEU 21 H LEU 21 -5.152 5.754 -2.914
130 HA LEU 21 HA LEU 21 -6.599 8.046 -3.764
131 HB2 LEU 21 HB2 LEU 21 -5.886 6.894 -1.079
132 HB3 LEU 21 HB3 LEU 21 -6.818 8.370 -1.200
133 HG LEU 21 HG LEU 21 -7.691 5.686 -2.277
134 HD11 LEU 21 HD11 LEU 21 -9.207 5.644 -0.322
135 HD12 LEU 21 HD12 LEU 21 -8.450 7.133 0.289
136 HD13 LEU 21 HD13 LEU 21 -7.503 5.634 0.165
137 HD21 LEU 21 HD21 LEU 21 -9.926 6.748 -2.368
138 HD22 LEU 21 HD22 LEU 21 -8.771 7.583 -3.413
139 HD23 LEU 21 HD23 LEU 21 -9.210 8.292 -1.848
140 H LEU 22 H LEU 22 -3.476 7.731 -2.104
141 HA LEU 22 HA LEU 22 -3.116 10.504 -1.492
142 HB2 LEU 22 HB2 LEU 22 -1.230 8.181 -1.917
143 HB3 LEU 22 HB3 LEU 22 -0.630 9.795 -1.553
144 HG LEU 22 HG LEU 22 -2.543 8.292 0.259
145 HD11 LEU 22 HD11 LEU 22 -0.434 7.050 0.023
146 HD12 LEU 22 HD12 LEU 22 -0.556 7.786 1.632
147 HD13 LEU 22 HD13 LEU 22 0.491 8.523 0.398
148 HD21 LEU 22 HD21 LEU 22 -1.725 9.916 1.956
149 HD22 LEU 22 HD22 LEU 22 -2.559 10.717 0.613
150 HD23 LEU 22 HD23 LEU 22 -0.782 10.742 0.694
151 H ARG 23 H ARG 23 -3.210 9.032 -4.563
152 HA ARG 23 HA ARG 23 -1.513 11.221 -5.725
153 HB2 ARG 23 HB2 ARG 23 -2.630 8.771 -7.109
154 HB3 ARG 23 HB3 ARG 23 -1.455 9.920 -7.754
155 HG2 ARG 23 HG2 ARG 23 0.059 9.150 -5.792
156 HG3 ARG 23 HG3 ARG 23 -1.071 7.782 -5.669
157 HD2 ARG 23 HD2 ARG 23 0.604 8.608 -8.057
158 HD3 ARG 23 HD3 ARG 23 0.723 7.099 -7.124
159 HE ARG 23 HE ARG 23 -1.900 7.157 -8.086
160 HH11 ARG 23 HH11 ARG 23 1.266 7.282 -9.665
161 HH12 ARG 23 HH12 ARG 23 0.655 6.566 -11.131
162 HH21 ARG 23 HH21 ARG 23 -2.593 6.268 -9.948
163 HH22 ARG 23 HH22 ARG 23 -1.503 5.995 -11.293
164 H GLY 24 H GLY 24 -4.570 10.865 -4.756
165 HA2 GLY 24 HA2 GLY 24 -6.432 12.111 -5.381
166 HA3 GLY 24 HA3 GLY 24 -5.606 12.610 -6.865
167 H ASN 25 H ASN 25 -5.412 9.233 -6.497
168 HA ASN 25 HA ASN 25 -7.378 8.844 -8.654
169 HB2 ASN 25 HB2 ASN 25 -5.814 6.809 -7.010
170 HB3 ASN 25 HB3 ASN 25 -6.800 6.444 -8.419
171 HD21 ASN 25 HD21 ASN 25 -6.123 8.420 -10.191
172 HD22 ASN 25 HD22 ASN 25 -4.421 8.293 -10.575
173 H ARG 26 H ARG 26 -9.155 7.291 -8.404
174 HA ARG 26 HA ARG 26 -10.774 7.815 -6.124
175 HB2 ARG 26 HB2 ARG 26 -10.881 6.059 -8.517
176 HB3 ARG 26 HB3 ARG 26 -11.941 5.657 -7.178
177 HG2 ARG 26 HG2 ARG 26 -12.779 7.203 -9.165
178 HG3 ARG 26 HG3 ARG 26 -13.333 7.435 -7.510
179 HD2 ARG 26 HD2 ARG 26 -12.895 9.591 -8.470
180 HD3 ARG 26 HD3 ARG 26 -11.684 9.288 -7.224
181 HE ARG 26 HE ARG 26 -10.647 8.503 -9.787
182 HH11 ARG 26 HH11 ARG 26 -11.423 11.425 -7.947
183 HH12 ARG 26 HH12 ARG 26 -10.211 12.367 -8.768
184 HH21 ARG 26 HH21 ARG 26 -9.114 9.775 -10.770
185 HH22 ARG 26 HH22 ARG 26 -8.952 11.460 -10.336
186 H GLY 27 H GLY 27 -8.272 5.458 -6.566
187 HA2 GLY 27 HA2 GLY 27 -7.746 4.625 -4.128
188 HA3 GLY 27 HA3 GLY 27 -9.337 3.826 -4.313
189 H GLY 28 H GLY 28 -7.950 1.772 -4.112
190 HA2 GLY 28 HA2 GLY 28 -7.352 0.862 -6.845
191 HA3 GLY 28 HA3 GLY 28 -5.985 0.856 -5.717
192 H TYR 29 H TYR 29 -6.574 -1.566 -6.692
193 HA TYR 29 HA TYR 29 -7.731 -2.877 -4.372
194 HB2 TYR 29 HB2 TYR 29 -9.002 -4.462 -5.660
195 HB3 TYR 29 HB3 TYR 29 -9.530 -2.835 -6.093
196 HD1 TYR 29 HD2 TYR 29 -8.980 -1.889 -8.342
197 HD2 TYR 29 HD1 TYR 29 -7.837 -5.902 -7.263
198 HE1 TYR 29 HE2 TYR 29 -8.568 -2.428 -10.742
199 HE2 TYR 29 HE1 TYR 29 -7.422 -6.422 -9.662
200 HH TYR 29 HH TYR 29 -7.970 -4.040 -12.256
201 H CYS 30 H CYS 30 -6.987 -5.209 -4.262
202 HA CYS 30 HA CYS 30 -4.258 -5.339 -5.436
203 HB2 CYS 30 HB2 CYS 30 -5.448 -6.855 -3.096
204 HB3 CYS 30 HB3 CYS 30 -3.789 -6.994 -3.693
205 H ASN 31 H ASN 31 -3.640 -6.920 -6.733
206 HA ASN 31 HA ASN 31 -5.621 -9.016 -7.514
207 HB2 ASN 31 HB2 ASN 31 -3.095 -7.873 -8.693
208 HB3 ASN 31 HB3 ASN 31 -3.496 -9.556 -9.058
209 HD21 ASN 31 HD21 ASN 31 -3.485 -6.980 -10.672
210 HD22 ASN 31 HD22 ASN 31 -5.048 -7.010 -11.451
211 H GLY 32 H GLY 32 -4.772 -11.272 -7.653
212 HA2 GLY 32 HA2 GLY 32 -3.814 -12.079 -5.119
213 HA3 GLY 32 HA3 GLY 32 -4.022 -13.114 -6.525
214 H ARG 33 H ARG 33 -1.773 -10.763 -7.367
215 HA ARG 33 HA ARG 33 0.438 -12.435 -6.481
216 HB2 ARG 33 HB2 ARG 33 0.225 -10.727 -8.962
217 HB3 ARG 33 HB3 ARG 33 1.728 -11.468 -8.397
218 HG2 ARG 33 HG2 ARG 33 0.570 -13.709 -8.522
219 HG3 ARG 33 HG3 ARG 33 -0.755 -12.892 -9.378
220 HD2 ARG 33 HD2 ARG 33 0.836 -12.118 -11.099
221 HD3 ARG 33 HD3 ARG 33 2.172 -12.885 -10.215
222 HE ARG 33 HE ARG 33 0.150 -14.826 -10.769
223 HH11 ARG 33 HH11 ARG 33 2.699 -13.031 -12.429
224 HH12 ARG 33 HH12 ARG 33 2.905 -14.264 -13.643
225 HH21 ARG 33 HH21 ARG 33 0.473 -16.357 -12.352
226 HH22 ARG 33 HH22 ARG 33 1.664 -16.108 -13.598
227 H ALA 34 H ALA 34 -1.003 -10.231 -5.154
228 HA ALA 34 HA ALA 34 -0.588 -8.510 -3.774
229 HB1 ALA 34 HB1 ALA 34 1.587 -8.302 -2.736
230 HB2 ALA 34 HB2 ALA 34 1.249 -10.030 -2.979
231 HB3 ALA 34 HB3 ALA 34 2.367 -9.176 -4.069
232 H ILE 35 H ILE 35 -0.677 -8.153 -6.628
233 HA ILE 35 HA ILE 35 0.946 -5.676 -6.981
234 HB ILE 35 HB ILE 35 -1.008 -6.927 -8.921
235 HG12 ILE 35 HG12 ILE 35 2.021 -7.142 -8.753
236 HG13 ILE 35 HG13 ILE 35 0.870 -8.452 -8.478
237 HG21 ILE 35 HG21 ILE 35 -0.626 -4.483 -9.302
238 HG22 ILE 35 HG22 ILE 35 1.131 -4.774 -9.356
239 HG23 ILE 35 HG23 ILE 35 0.064 -5.436 -10.614
240 HD11 ILE 35 HD11 ILE 35 1.503 -7.065 -11.072
241 HD12 ILE 35 HD12 ILE 35 1.769 -8.766 -10.638
242 HD13 ILE 35 HD13 ILE 35 0.112 -8.155 -10.864
243 H CYS 36 H CYS 36 0.056 -3.760 -7.001
244 HA CYS 36 HA CYS 36 -2.792 -3.522 -6.064
245 HB2 CYS 36 HB2 CYS 36 -1.141 -2.613 -4.488
246 HB3 CYS 36 HB3 CYS 36 -0.441 -1.632 -5.770
247 H VAL 37 H VAL 37 -4.213 -2.627 -7.440
248 HA VAL 37 HA VAL 37 -3.137 -1.292 -9.874
249 HB VAL 37 HB VAL 37 -5.606 -3.053 -9.589
250 HG11 VAL 37 HG11 VAL 37 -5.723 -2.849 -12.076
251 HG12 VAL 37 HG12 VAL 37 -5.916 -1.278 -11.277
252 HG13 VAL 37 HG13 VAL 37 -4.364 -1.703 -12.038
253 HG21 VAL 37 HG21 VAL 37 -3.631 -4.454 -9.512
254 HG22 VAL 37 HG22 VAL 37 -4.357 -4.600 -11.123
255 HG23 VAL 37 HG23 VAL 37 -2.908 -3.593 -10.897
256 H CYS 38 H CYS 38 -3.417 0.717 -9.454
257 HA CYS 38 HA CYS 38 -5.555 1.857 -7.903
258 HB2 CYS 38 HB2 CYS 38 -3.698 3.158 -9.925
259 HB3 CYS 38 HB3 CYS 38 -4.728 4.012 -8.773
260 H ARG 39 H ARG 39 -7.299 3.103 -8.591
261 HA ARG 39 HA ARG 39 -8.340 2.487 -11.285
262 HB2 ARG 39 HB2 ARG 39 -9.566 3.822 -8.839
263 HB3 ARG 39 HB3 ARG 39 -10.415 3.574 -10.375
264 HG2 ARG 39 HG2 ARG 39 -10.179 1.136 -10.130
265 HG3 ARG 39 HG3 ARG 39 -9.314 1.361 -8.598
266 HD2 ARG 39 HD2 ARG 39 -11.300 2.422 -7.609
267 HD3 ARG 39 HD3 ARG 39 -12.161 2.270 -9.152
268 HE ARG 39 HE ARG 39 -12.470 -0.006 -8.788
269 HH11 ARG 39 HH11 ARG 39 -10.356 1.246 -6.254
270 HH12 ARG 39 HH12 ARG 39 -10.465 -0.214 -5.308
271 HH21 ARG 39 HH21 ARG 39 -12.576 -1.829 -7.525
272 HH22 ARG 39 HH22 ARG 39 -11.720 -1.912 -6.011
273 H ASN 40 H ASN 40 -9.439 4.656 -12.229
274 HA ASN 40 HA ASN 40 -7.440 6.490 -12.716
275 HB2 ASN 40 HB2 ASN 40 -9.067 7.850 -13.823
276 HB3 ASN 40 HB3 ASN 40 -9.507 6.168 -14.136
277 HD21 ASN 40 HD21 ASN 40 -11.511 5.497 -13.579
278 HD22 ASN 40 HD22 ASN 40 -12.663 6.460 -12.689
Start of MODEL 18
1 H1 ALA 1 H1 ALA 1 2.127 -0.191 -9.198
2 H2 ALA 1 H2 ALA 1 2.415 -1.815 -9.227
3 H3 ALA 1 H3 ALA 1 0.997 -1.244 -8.612
4 HA ALA 1 HA ALA 1 3.679 -0.786 -7.466
5 HB1 ALA 1 HB1 ALA 1 2.151 1.133 -7.052
6 HB2 ALA 1 HB2 ALA 1 0.906 0.030 -6.427
7 HB3 ALA 1 HB3 ALA 1 2.436 0.243 -5.543
8 H THR 2 H THR 2 3.155 -1.586 -4.861
9 HA THR 2 HA THR 2 2.316 -4.429 -5.262
10 HB THR 2 HB THR 2 4.743 -4.225 -4.747
11 HG1 THR 2 HG1 THR 2 4.540 -5.932 -3.466
12 HG21 THR 2 HG21 THR 2 5.451 -3.461 -2.502
13 HG22 THR 2 HG22 THR 2 3.790 -2.953 -2.131
14 HG23 THR 2 HG23 THR 2 4.715 -2.129 -3.414
15 H CYS 3 H CYS 3 1.405 -5.503 -3.469
16 HA CYS 3 HA CYS 3 -0.273 -3.722 -1.737
17 HB2 CYS 3 HB2 CYS 3 -1.392 -5.211 -3.442
18 HB3 CYS 3 HB3 CYS 3 -0.714 -6.611 -2.609
19 H ASP 4 H ASP 4 2.545 -5.423 -1.734
20 HA ASP 4 HA ASP 4 2.252 -7.132 0.572
21 HB2 ASP 4 HB2 ASP 4 4.646 -5.995 -0.901
22 HB3 ASP 4 HB3 ASP 4 4.791 -7.100 0.468
23 H LEU 5 H LEU 5 3.449 -7.019 2.499
24 HA LEU 5 HA LEU 5 3.848 -4.288 3.575
25 HB2 LEU 5 HB2 LEU 5 3.977 -5.476 5.786
26 HB3 LEU 5 HB3 LEU 5 2.445 -5.752 4.981
27 HG LEU 5 HG LEU 5 4.493 -7.828 4.448
28 HD11 LEU 5 HD11 LEU 5 4.329 -8.914 6.596
29 HD12 LEU 5 HD12 LEU 5 3.268 -7.633 7.218
30 HD13 LEU 5 HD13 LEU 5 4.968 -7.275 6.823
31 HD21 LEU 5 HD21 LEU 5 2.568 -9.331 4.914
32 HD22 LEU 5 HD22 LEU 5 2.207 -8.114 3.680
33 HD23 LEU 5 HD23 LEU 5 1.581 -7.912 5.338
34 H LEU 6 H LEU 6 5.429 -4.954 1.673
35 HA LEU 6 HA LEU 6 7.860 -6.284 2.538
36 HB2 LEU 6 HB2 LEU 6 7.016 -6.341 0.194
37 HB3 LEU 6 HB3 LEU 6 7.252 -4.601 0.076
38 HG LEU 6 HG LEU 6 9.698 -4.923 0.307
39 HD11 LEU 6 HD11 LEU 6 10.626 -7.225 0.034
40 HD12 LEU 6 HD12 LEU 6 8.990 -7.888 0.257
41 HD13 LEU 6 HD13 LEU 6 9.792 -7.004 1.580
42 HD21 LEU 6 HD21 LEU 6 10.023 -5.903 -1.931
43 HD22 LEU 6 HD22 LEU 6 8.625 -4.808 -1.902
44 HD23 LEU 6 HD23 LEU 6 8.373 -6.571 -1.884
45 H SER 7 H SER 7 6.604 -3.055 2.194
46 HA SER 7 HA SER 7 9.202 -1.781 2.623
47 HB2 SER 7 HB2 SER 7 6.421 -0.604 2.530
48 HB3 SER 7 HB3 SER 7 7.949 0.290 2.347
49 HG SER 7 HG SER 7 8.335 -1.059 0.474
50 H GLY 8 H GLY 8 7.443 -3.323 4.731
51 HA2 GLY 8 HA2 GLY 8 7.895 -3.093 7.124
52 HA3 GLY 8 HA3 GLY 8 7.824 -1.318 6.890
53 H THR 9 H THR 9 6.019 -0.563 7.624
54 HA THR 9 HA THR 9 3.667 -1.869 8.162
55 HB THR 9 HB THR 9 3.655 0.034 9.171
56 HG1 THR 9 HG1 THR 9 2.572 1.802 7.916
57 HG21 THR 9 HG21 THR 9 4.578 2.246 8.277
58 HG22 THR 9 HG22 THR 9 5.151 1.319 6.876
59 HG23 THR 9 HG23 THR 9 5.769 0.962 8.516
60 H GLY 10 H GLY 10 1.604 -1.314 7.428
61 HA2 GLY 10 HA2 GLY 10 0.114 -1.087 5.462
62 HA3 GLY 10 HA3 GLY 10 1.444 -1.648 4.434
63 H VAL 11 H VAL 11 1.178 -3.285 7.425
64 HA VAL 11 HA VAL 11 0.746 -5.809 6.338
65 HB VAL 11 HB VAL 11 0.052 -4.859 9.092
66 HG11 VAL 11 HG11 VAL 11 0.575 -7.193 9.791
67 HG12 VAL 11 HG12 VAL 11 -0.768 -7.146 8.633
68 HG13 VAL 11 HG13 VAL 11 0.857 -7.624 8.089
69 HG21 VAL 11 HG21 VAL 11 2.730 -5.632 7.911
70 HG22 VAL 11 HG22 VAL 11 2.295 -4.144 8.774
71 HG23 VAL 11 HG23 VAL 11 2.423 -5.671 9.658
72 H LYS 12 H LYS 12 -1.502 -3.439 7.548
73 HA LYS 12 HA LYS 12 -3.845 -4.983 6.787
74 HB2 LYS 12 HB2 LYS 12 -3.275 -2.106 7.496
75 HB3 LYS 12 HB3 LYS 12 -4.890 -2.649 7.010
76 HG2 LYS 12 HG2 LYS 12 -3.362 -3.689 9.436
77 HG3 LYS 12 HG3 LYS 12 -4.594 -2.419 9.486
78 HD2 LYS 12 HD2 LYS 12 -6.259 -4.041 8.553
79 HD3 LYS 12 HD3 LYS 12 -5.027 -5.317 8.651
80 HE2 LYS 12 HE2 LYS 12 -4.836 -4.933 11.099
81 HE3 LYS 12 HE3 LYS 12 -6.087 -3.676 10.994
82 HZ1 LYS 12 HZ1 LYS 12 -7.013 -5.792 11.707
83 HZ2 LYS 12 HZ2 LYS 12 -6.484 -6.547 10.341
84 HZ3 LYS 12 HZ3 LYS 12 -7.646 -5.379 10.243
85 H HIS 13 H HIS 13 -3.721 -5.525 4.642
86 HA HIS 13 HA HIS 13 -2.239 -4.096 2.718
87 HB2 HIS 13 HB2 HIS 13 -4.348 -6.243 2.530
88 HB3 HIS 13 HB3 HIS 13 -3.616 -5.544 1.088
89 HD1 HIS 13 HD1 HIS 13 -2.635 -8.022 0.642
90 HD2 HIS 13 HD2 HIS 13 -1.056 -5.964 3.936
91 HE1 HIS 13 HE1 HIS 13 -0.476 -9.210 1.297
92 HE2 HIS 13 HE2 HIS 13 0.443 -7.961 3.292
93 H SER 14 H SER 14 -5.134 -2.990 3.942
94 HA SER 14 HA SER 14 -6.323 -1.804 1.654
95 HB2 SER 14 HB2 SER 14 -6.352 -0.171 4.073
96 HB3 SER 14 HB3 SER 14 -7.710 -0.954 3.230
97 HG SER 14 HG SER 14 -7.496 -1.911 5.237
98 H ALA 15 H ALA 15 -3.375 -1.288 3.201
99 HA ALA 15 HA ALA 15 -2.832 1.347 2.791
100 HB1 ALA 15 HB1 ALA 15 -1.382 -0.143 4.061
101 HB2 ALA 15 HB2 ALA 15 -0.949 -1.007 2.566
102 HB3 ALA 15 HB3 ALA 15 -0.453 0.688 2.792
103 H CYS 16 H CYS 16 -2.768 -1.272 0.432
104 HA CYS 16 HA CYS 16 -1.473 0.181 -1.639
105 HB2 CYS 16 HB2 CYS 16 -1.577 -2.030 -2.225
106 HB3 CYS 16 HB3 CYS 16 -3.128 -2.256 -1.414
107 H ALA 17 H ALA 17 -4.816 -0.167 -0.810
108 HA ALA 17 HA ALA 17 -5.848 1.340 -2.988
109 HB1 ALA 17 HB1 ALA 17 -7.068 0.926 -0.228
110 HB2 ALA 17 HB2 ALA 17 -7.936 1.486 -1.673
111 HB3 ALA 17 HB3 ALA 17 -7.274 -0.164 -1.621
112 H ALA 18 H ALA 18 -4.859 2.162 0.254
113 HA ALA 18 HA ALA 18 -5.576 4.915 0.119
114 HB1 ALA 18 HB1 ALA 18 -5.161 3.720 2.252
115 HB2 ALA 18 HB2 ALA 18 -3.437 3.586 1.825
116 HB3 ALA 18 HB3 ALA 18 -4.162 5.185 2.112
117 H HIS 19 H HIS 19 -2.603 3.216 -0.731
118 HA HIS 19 HA HIS 19 -1.041 5.452 -1.123
119 HB2 HIS 19 HB2 HIS 19 -0.277 3.049 -1.053
120 HB3 HIS 19 HB3 HIS 19 -0.816 2.913 -2.732
121 HD1 HIS 19 HD1 HIS 19 1.776 4.684 -0.554
122 HD2 HIS 19 HD2 HIS 19 0.933 4.035 -4.607
123 HE1 HIS 19 HE1 HIS 19 3.792 5.520 -1.873
124 HE2 HIS 19 HE2 HIS 19 3.269 5.120 -4.310
125 H CYS 20 H CYS 20 -3.379 3.861 -3.183
126 HA CYS 20 HA CYS 20 -2.788 5.476 -5.521
127 HB2 CYS 20 HB2 CYS 20 -5.196 3.798 -4.785
128 HB3 CYS 20 HB3 CYS 20 -4.886 4.494 -6.380
129 H LEU 21 H LEU 21 -5.192 5.571 -2.866
130 HA LEU 21 HA LEU 21 -6.779 7.720 -3.847
131 HB2 LEU 21 HB2 LEU 21 -6.062 6.743 -1.092
132 HB3 LEU 21 HB3 LEU 21 -7.063 8.160 -1.304
133 HG LEU 21 HG LEU 21 -7.787 5.388 -2.248
134 HD11 LEU 21 HD11 LEU 21 -9.337 5.383 -0.327
135 HD12 LEU 21 HD12 LEU 21 -8.678 6.946 0.207
136 HD13 LEU 21 HD13 LEU 21 -7.647 5.497 0.198
137 HD21 LEU 21 HD21 LEU 21 -10.060 6.346 -2.463
138 HD22 LEU 21 HD22 LEU 21 -8.910 7.177 -3.522
139 HD23 LEU 21 HD23 LEU 21 -9.425 7.944 -2.007
140 H LEU 22 H LEU 22 -3.701 7.687 -2.078
141 HA LEU 22 HA LEU 22 -3.563 10.495 -1.558
142 HB2 LEU 22 HB2 LEU 22 -1.462 8.345 -1.889
143 HB3 LEU 22 HB3 LEU 22 -1.042 10.013 -1.515
144 HG LEU 22 HG LEU 22 -2.849 8.321 0.239
145 HD11 LEU 22 HD11 LEU 22 -0.605 7.320 0.079
146 HD12 LEU 22 HD12 LEU 22 -0.874 8.029 1.683
147 HD13 LEU 22 HD13 LEU 22 0.133 8.886 0.492
148 HD21 LEU 22 HD21 LEU 22 -2.276 10.027 1.954
149 HD22 LEU 22 HD22 LEU 22 -3.144 10.728 0.578
150 HD23 LEU 22 HD23 LEU 22 -1.385 10.950 0.721
151 H ARG 23 H ARG 23 -3.123 8.746 -4.548
152 HA ARG 23 HA ARG 23 -1.621 10.988 -5.781
153 HB2 ARG 23 HB2 ARG 23 -2.876 8.564 -7.101
154 HB3 ARG 23 HB3 ARG 23 -1.722 9.685 -7.821
155 HG2 ARG 23 HG2 ARG 23 -0.142 8.893 -5.884
156 HG3 ARG 23 HG3 ARG 23 -1.262 7.512 -5.807
157 HD2 ARG 23 HD2 ARG 23 0.354 8.471 -8.191
158 HD3 ARG 23 HD3 ARG 23 0.522 6.926 -7.330
159 HE ARG 23 HE ARG 23 -2.130 7.008 -8.247
160 HH11 ARG 23 HH11 ARG 23 1.033 7.132 -9.834
161 HH12 ARG 23 HH12 ARG 23 0.411 6.442 -11.308
162 HH21 ARG 23 HH21 ARG 23 -2.835 6.151 -10.119
163 HH22 ARG 23 HH22 ARG 23 -1.751 5.888 -11.470
164 H GLY 24 H GLY 24 -4.740 10.606 -4.813
165 HA2 GLY 24 HA2 GLY 24 -6.570 11.919 -5.389
166 HA3 GLY 24 HA3 GLY 24 -5.730 12.466 -6.850
167 H ASN 25 H ASN 25 -5.644 9.055 -6.497
168 HA ASN 25 HA ASN 25 -7.548 8.726 -8.737
169 HB2 ASN 25 HB2 ASN 25 -5.990 6.674 -7.104
170 HB3 ASN 25 HB3 ASN 25 -6.958 6.320 -8.531
171 HD21 ASN 25 HD21 ASN 25 -6.273 8.407 -10.224
172 HD22 ASN 25 HD22 ASN 25 -4.574 8.277 -10.606
173 H ARG 26 H ARG 26 -9.285 7.075 -8.573
174 HA ARG 26 HA ARG 26 -10.979 7.594 -6.358
175 HB2 ARG 26 HB2 ARG 26 -11.222 5.119 -8.067
176 HB3 ARG 26 HB3 ARG 26 -12.493 5.954 -7.194
177 HG2 ARG 26 HG2 ARG 26 -11.230 6.636 -9.833
178 HG3 ARG 26 HG3 ARG 26 -12.925 6.438 -9.431
179 HD2 ARG 26 HD2 ARG 26 -13.078 8.670 -9.379
180 HD3 ARG 26 HD3 ARG 26 -12.087 8.652 -7.905
181 HE ARG 26 HE ARG 26 -10.728 8.538 -10.555
182 HH11 ARG 26 HH11 ARG 26 -11.443 10.479 -7.675
183 HH12 ARG 26 HH12 ARG 26 -10.128 11.577 -8.000
184 HH21 ARG 26 HH21 ARG 26 -9.100 9.971 -10.882
185 HH22 ARG 26 HH22 ARG 26 -8.859 11.317 -9.786
186 H GLY 27 H GLY 27 -8.347 5.384 -6.629
187 HA2 GLY 27 HA2 GLY 27 -7.890 4.616 -4.151
188 HA3 GLY 27 HA3 GLY 27 -9.387 3.676 -4.433
189 H GLY 28 H GLY 28 -7.840 1.774 -4.141
190 HA2 GLY 28 HA2 GLY 28 -6.986 0.928 -6.826
191 HA3 GLY 28 HA3 GLY 28 -5.715 0.989 -5.586
192 H TYR 29 H TYR 29 -6.299 -1.474 -6.699
193 HA TYR 29 HA TYR 29 -7.498 -2.792 -4.430
194 HB2 TYR 29 HB2 TYR 29 -8.722 -4.379 -5.862
195 HB3 TYR 29 HB3 TYR 29 -9.315 -2.731 -6.050
196 HD1 TYR 29 HD2 TYR 29 -8.839 -1.443 -8.146
197 HD2 TYR 29 HD1 TYR 29 -7.633 -5.556 -7.715
198 HE1 TYR 29 HE2 TYR 29 -8.547 -1.626 -10.617
199 HE2 TYR 29 HE1 TYR 29 -7.346 -5.721 -10.184
200 HH TYR 29 HH TYR 29 -8.015 -2.988 -12.375
201 H CYS 30 H CYS 30 -6.871 -5.141 -4.354
202 HA CYS 30 HA CYS 30 -4.115 -5.358 -5.439
203 HB2 CYS 30 HB2 CYS 30 -5.391 -6.771 -3.083
204 HB3 CYS 30 HB3 CYS 30 -3.724 -6.972 -3.639
205 H ASN 31 H ASN 31 -3.629 -6.844 -6.859
206 HA ASN 31 HA ASN 31 -5.616 -8.865 -7.693
207 HB2 ASN 31 HB2 ASN 31 -2.736 -8.277 -8.511
208 HB3 ASN 31 HB3 ASN 31 -3.679 -9.615 -9.175
209 HD21 ASN 31 HD21 ASN 31 -2.580 -7.564 -10.735
210 HD22 ASN 31 HD22 ASN 31 -3.908 -6.677 -11.439
211 H GLY 32 H GLY 32 -4.990 -11.196 -7.684
212 HA2 GLY 32 HA2 GLY 32 -4.159 -12.042 -5.102
213 HA3 GLY 32 HA3 GLY 32 -4.416 -13.076 -6.504
214 H ARG 33 H ARG 33 -2.050 -10.850 -7.333
215 HA ARG 33 HA ARG 33 0.064 -12.607 -6.473
216 HB2 ARG 33 HB2 ARG 33 -0.062 -10.888 -8.945
217 HB3 ARG 33 HB3 ARG 33 1.389 -11.742 -8.402
218 HG2 ARG 33 HG2 ARG 33 0.077 -13.892 -8.536
219 HG3 ARG 33 HG3 ARG 33 -1.209 -12.975 -9.351
220 HD2 ARG 33 HD2 ARG 33 0.397 -12.283 -11.097
221 HD3 ARG 33 HD3 ARG 33 1.689 -13.172 -10.263
222 HE ARG 33 HE ARG 33 -0.489 -14.938 -10.794
223 HH11 ARG 33 HH11 ARG 33 2.133 -13.302 -12.504
224 HH12 ARG 33 HH12 ARG 33 2.201 -14.516 -13.752
225 HH21 ARG 33 HH21 ARG 33 -0.339 -16.450 -12.422
226 HH22 ARG 33 HH22 ARG 33 0.824 -16.260 -13.706
227 H ALA 34 H ALA 34 -1.237 -10.273 -5.149
228 HA ALA 34 HA ALA 34 -0.678 -8.601 -3.774
229 HB1 ALA 34 HB1 ALA 34 1.527 -8.551 -2.760
230 HB2 ALA 34 HB2 ALA 34 1.045 -10.246 -2.977
231 HB3 ALA 34 HB3 ALA 34 2.216 -9.501 -4.090
232 H ILE 35 H ILE 35 -0.765 -8.237 -6.622
233 HA ILE 35 HA ILE 35 1.028 -5.873 -6.968
234 HB ILE 35 HB ILE 35 -0.971 -7.006 -8.927
235 HG12 ILE 35 HG12 ILE 35 2.024 -7.422 -8.661
236 HG13 ILE 35 HG13 ILE 35 0.772 -8.656 -8.498
237 HG21 ILE 35 HG21 ILE 35 -0.448 -4.587 -9.303
238 HG22 ILE 35 HG22 ILE 35 1.289 -4.979 -9.347
239 HG23 ILE 35 HG23 ILE 35 0.189 -5.577 -10.612
240 HD11 ILE 35 HD11 ILE 35 1.658 -7.223 -10.991
241 HD12 ILE 35 HD12 ILE 35 1.769 -8.958 -10.615
242 HD13 ILE 35 HD13 ILE 35 0.176 -8.213 -10.913
243 H CYS 36 H CYS 36 0.261 -3.910 -7.024
244 HA CYS 36 HA CYS 36 -2.550 -3.478 -6.063
245 HB2 CYS 36 HB2 CYS 36 -0.783 -2.684 -4.533
246 HB3 CYS 36 HB3 CYS 36 -0.100 -1.710 -5.833
247 H VAL 37 H VAL 37 -3.939 -2.513 -7.444
248 HA VAL 37 HA VAL 37 -2.807 -1.197 -9.853
249 HB VAL 37 HB VAL 37 -5.304 -2.926 -9.610
250 HG11 VAL 37 HG11 VAL 37 -5.374 -2.699 -12.110
251 HG12 VAL 37 HG12 VAL 37 -5.578 -1.140 -11.288
252 HG13 VAL 37 HG13 VAL 37 -4.013 -1.558 -12.026
253 HG21 VAL 37 HG21 VAL 37 -4.081 -4.490 -11.136
254 HG22 VAL 37 HG22 VAL 37 -2.614 -3.507 -10.917
255 HG23 VAL 37 HG23 VAL 37 -3.345 -4.355 -9.530
256 H CYS 38 H CYS 38 -3.097 0.816 -9.416
257 HA CYS 38 HA CYS 38 -5.258 1.934 -7.875
258 HB2 CYS 38 HB2 CYS 38 -3.402 3.268 -9.879
259 HB3 CYS 38 HB3 CYS 38 -4.436 4.101 -8.717
260 H ARG 39 H ARG 39 -7.036 3.147 -8.582
261 HA ARG 39 HA ARG 39 -8.080 2.424 -11.229
262 HB2 ARG 39 HB2 ARG 39 -9.200 4.045 -8.911
263 HB3 ARG 39 HB3 ARG 39 -10.097 3.672 -10.388
264 HG2 ARG 39 HG2 ARG 39 -10.049 1.290 -9.879
265 HG3 ARG 39 HG3 ARG 39 -9.017 1.574 -8.464
266 HD2 ARG 39 HD2 ARG 39 -10.783 2.893 -7.401
267 HD3 ARG 39 HD3 ARG 39 -11.822 2.678 -8.826
268 HE ARG 39 HE ARG 39 -11.093 0.108 -7.952
269 HH11 ARG 39 HH11 ARG 39 -12.959 2.818 -6.660
270 HH12 ARG 39 HH12 ARG 39 -13.998 1.775 -5.730
271 HH21 ARG 39 HH21 ARG 39 -12.467 -1.156 -6.740
272 HH22 ARG 39 HH22 ARG 39 -13.716 -0.431 -5.769
273 H ASN 40 H ASN 40 -9.198 4.589 -12.262
274 HA ASN 40 HA ASN 40 -7.219 6.377 -12.862
275 HB2 ASN 40 HB2 ASN 40 -8.899 7.668 -14.056
276 HB3 ASN 40 HB3 ASN 40 -9.109 5.942 -14.382
277 HD21 ASN 40 HD21 ASN 40 -11.145 5.343 -14.422
278 HD22 ASN 40 HD22 ASN 40 -12.435 6.016 -13.457
Start of MODEL 19
1 H1 ALA 1 H1 ALA 1 1.722 0.252 -9.127
2 H2 ALA 1 H2 ALA 1 2.126 -1.345 -9.215
3 H3 ALA 1 H3 ALA 1 0.671 -0.900 -8.582
4 HA ALA 1 HA ALA 1 3.317 -0.304 -7.416
5 HB1 ALA 1 HB1 ALA 1 1.657 1.501 -6.951
6 HB2 ALA 1 HB2 ALA 1 0.501 0.297 -6.340
7 HB3 ALA 1 HB3 ALA 1 2.022 0.596 -5.467
8 H THR 2 H THR 2 2.791 -1.215 -4.823
9 HA THR 2 HA THR 2 2.111 -4.081 -5.329
10 HB THR 2 HB THR 2 4.532 -3.794 -4.854
11 HG1 THR 2 HG1 THR 2 4.488 -5.500 -3.489
12 HG21 THR 2 HG21 THR 2 5.254 -3.103 -2.594
13 HG22 THR 2 HG22 THR 2 3.583 -2.683 -2.166
14 HG23 THR 2 HG23 THR 2 4.444 -1.762 -3.427
15 H CYS 3 H CYS 3 1.291 -5.269 -3.567
16 HA CYS 3 HA CYS 3 -0.455 -3.645 -1.746
17 HB2 CYS 3 HB2 CYS 3 -1.485 -5.161 -3.520
18 HB3 CYS 3 HB3 CYS 3 -0.739 -6.525 -2.688
19 H ASP 4 H ASP 4 2.440 -5.209 -1.861
20 HA ASP 4 HA ASP 4 2.354 -7.100 0.269
21 HB2 ASP 4 HB2 ASP 4 4.598 -5.460 -0.954
22 HB3 ASP 4 HB3 ASP 4 4.869 -6.652 0.319
23 H LEU 5 H LEU 5 3.355 -7.070 2.279
24 HA LEU 5 HA LEU 5 3.536 -4.399 3.598
25 HB2 LEU 5 HB2 LEU 5 3.217 -5.688 5.728
26 HB3 LEU 5 HB3 LEU 5 1.821 -5.744 4.659
27 HG LEU 5 HG LEU 5 3.615 -8.004 4.182
28 HD11 LEU 5 HD11 LEU 5 3.229 -9.204 6.251
29 HD12 LEU 5 HD12 LEU 5 2.371 -7.812 6.940
30 HD13 LEU 5 HD13 LEU 5 4.109 -7.699 6.585
31 HD21 LEU 5 HD21 LEU 5 1.531 -9.264 4.385
32 HD22 LEU 5 HD22 LEU 5 1.277 -7.814 3.391
33 HD23 LEU 5 HD23 LEU 5 0.708 -7.844 5.076
34 H LEU 6 H LEU 6 5.366 -5.138 1.938
35 HA LEU 6 HA LEU 6 7.551 -6.695 3.039
36 HB2 LEU 6 HB2 LEU 6 7.168 -6.308 0.607
37 HB3 LEU 6 HB3 LEU 6 7.490 -4.592 0.839
38 HG LEU 6 HG LEU 6 9.834 -5.120 1.454
39 HD11 LEU 6 HD11 LEU 6 10.713 -7.399 0.944
40 HD12 LEU 6 HD12 LEU 6 9.041 -7.976 0.737
41 HD13 LEU 6 HD13 LEU 6 9.603 -7.389 2.324
42 HD21 LEU 6 HD21 LEU 6 10.545 -5.721 -0.827
43 HD22 LEU 6 HD22 LEU 6 9.208 -4.553 -0.856
44 HD23 LEU 6 HD23 LEU 6 8.895 -6.271 -1.205
45 H SER 7 H SER 7 6.528 -3.370 3.063
46 HA SER 7 HA SER 7 9.051 -2.349 4.078
47 HB2 SER 7 HB2 SER 7 6.338 -1.042 3.856
48 HB3 SER 7 HB3 SER 7 7.902 -0.204 3.979
49 HG SER 7 HG SER 7 8.455 -1.182 1.958
50 H GLY 8 H GLY 8 7.034 -4.141 5.730
51 HA2 GLY 8 HA2 GLY 8 6.900 -4.180 8.152
52 HA3 GLY 8 HA3 GLY 8 7.210 -2.414 8.156
53 H THR 9 H THR 9 5.493 -1.262 8.463
54 HA THR 9 HA THR 9 2.892 -2.095 8.638
55 HB THR 9 HB THR 9 3.033 -0.120 9.544
56 HG1 THR 9 HG1 THR 9 2.940 1.205 7.087
57 HG21 THR 9 HG21 THR 9 4.570 1.776 8.789
58 HG22 THR 9 HG22 THR 9 5.203 0.653 7.566
59 HG23 THR 9 HG23 THR 9 5.395 0.298 9.310
60 H GLY 10 H GLY 10 1.077 -1.355 7.574
61 HA2 GLY 10 HA2 GLY 10 -0.158 -1.101 5.493
62 HA3 GLY 10 HA3 GLY 10 1.290 -1.592 4.588
63 H VAL 11 H VAL 11 0.751 -3.366 7.436
64 HA VAL 11 HA VAL 11 0.434 -5.858 6.236
65 HB VAL 11 HB VAL 11 -0.484 -4.999 8.967
66 HG11 VAL 11 HG11 VAL 11 -0.031 -7.369 9.620
67 HG12 VAL 11 HG12 VAL 11 -1.321 -7.238 8.409
68 HG13 VAL 11 HG13 VAL 11 0.309 -7.747 7.917
69 HG21 VAL 11 HG21 VAL 11 1.804 -5.831 9.713
70 HG22 VAL 11 HG22 VAL 11 2.267 -5.856 7.997
71 HG23 VAL 11 HG23 VAL 11 1.817 -4.329 8.779
72 H LYS 12 H LYS 12 -1.928 -3.547 7.305
73 HA LYS 12 HA LYS 12 -4.183 -5.186 6.461
74 HB2 LYS 12 HB2 LYS 12 -3.826 -2.263 7.154
75 HB3 LYS 12 HB3 LYS 12 -5.393 -2.991 6.765
76 HG2 LYS 12 HG2 LYS 12 -3.627 -3.721 9.145
77 HG3 LYS 12 HG3 LYS 12 -5.066 -2.695 9.208
78 HD2 LYS 12 HD2 LYS 12 -6.447 -4.630 8.418
79 HD3 LYS 12 HD3 LYS 12 -4.995 -5.654 8.474
80 HE2 LYS 12 HE2 LYS 12 -4.745 -5.145 10.899
81 HE3 LYS 12 HE3 LYS 12 -6.227 -4.172 10.835
82 HZ1 LYS 12 HZ1 LYS 12 -6.667 -6.404 11.653
83 HZ2 LYS 12 HZ2 LYS 12 -6.065 -7.085 10.277
84 HZ3 LYS 12 HZ3 LYS 12 -7.445 -6.180 10.217
85 H HIS 13 H HIS 13 -4.234 -5.625 4.335
86 HA HIS 13 HA HIS 13 -2.708 -4.307 2.393
87 HB2 HIS 13 HB2 HIS 13 -5.133 -6.102 2.117
88 HB3 HIS 13 HB3 HIS 13 -4.117 -5.609 0.765
89 HD1 HIS 13 HD1 HIS 13 -1.337 -6.186 1.261
90 HD2 HIS 13 HD2 HIS 13 -4.312 -8.511 3.123
91 HE1 HIS 13 HE1 HIS 13 -0.253 -8.375 1.961
92 HE2 HIS 13 HE2 HIS 13 -2.044 -9.756 3.089
93 H SER 14 H SER 14 -5.496 -3.028 3.715
94 HA SER 14 HA SER 14 -6.630 -1.665 1.504
95 HB2 SER 14 HB2 SER 14 -6.572 -0.137 3.984
96 HB3 SER 14 HB3 SER 14 -7.967 -0.844 3.131
97 HG SER 14 HG SER 14 -7.746 -1.867 5.113
98 H ALA 15 H ALA 15 -3.643 -1.345 3.067
99 HA ALA 15 HA ALA 15 -2.997 1.298 2.709
100 HB1 ALA 15 HB1 ALA 15 -1.613 -0.275 3.966
101 HB2 ALA 15 HB2 ALA 15 -1.205 -1.134 2.462
102 HB3 ALA 15 HB3 ALA 15 -0.647 0.538 2.714
103 H CYS 16 H CYS 16 -3.100 -1.303 0.330
104 HA CYS 16 HA CYS 16 -1.706 0.058 -1.751
105 HB2 CYS 16 HB2 CYS 16 -1.970 -2.149 -2.306
106 HB3 CYS 16 HB3 CYS 16 -3.546 -2.248 -1.522
107 H ALA 17 H ALA 17 -5.078 -0.073 -0.882
108 HA ALA 17 HA ALA 17 -6.010 1.521 -3.046
109 HB1 ALA 17 HB1 ALA 17 -7.539 0.108 -1.696
110 HB2 ALA 17 HB2 ALA 17 -7.245 1.154 -0.285
111 HB3 ALA 17 HB3 ALA 17 -8.079 1.804 -1.713
112 H ALA 18 H ALA 18 -4.945 2.253 0.206
113 HA ALA 18 HA ALA 18 -5.485 5.047 0.100
114 HB1 ALA 18 HB1 ALA 18 -5.087 3.808 2.213
115 HB2 ALA 18 HB2 ALA 18 -3.385 3.576 1.742
116 HB3 ALA 18 HB3 ALA 18 -4.007 5.213 2.056
117 H HIS 19 H HIS 19 -2.646 3.165 -0.857
118 HA HIS 19 HA HIS 19 -0.940 5.315 -1.284
119 HB2 HIS 19 HB2 HIS 19 -0.359 2.841 -1.278
120 HB3 HIS 19 HB3 HIS 19 -0.942 2.801 -2.948
121 HD1 HIS 19 HD1 HIS 19 1.975 3.828 -0.826
122 HD2 HIS 19 HD2 HIS 19 0.688 4.331 -4.783
123 HE1 HIS 19 HE1 HIS 19 3.969 4.712 -2.150
124 HE2 HIS 19 HE2 HIS 19 3.176 5.011 -4.527
125 H CYS 20 H CYS 20 -3.498 3.960 -3.245
126 HA CYS 20 HA CYS 20 -2.837 5.548 -5.593
127 HB2 CYS 20 HB2 CYS 20 -5.353 4.040 -4.843
128 HB3 CYS 20 HB3 CYS 20 -4.983 4.697 -6.443
129 H LEU 21 H LEU 21 -5.179 5.709 -2.893
130 HA LEU 21 HA LEU 21 -6.665 7.967 -3.774
131 HB2 LEU 21 HB2 LEU 21 -5.940 6.876 -1.063
132 HB3 LEU 21 HB3 LEU 21 -6.913 8.322 -1.225
133 HG LEU 21 HG LEU 21 -7.706 5.593 -2.247
134 HD11 LEU 21 HD11 LEU 21 -9.233 5.554 -0.306
135 HD12 LEU 21 HD12 LEU 21 -8.532 7.081 0.274
136 HD13 LEU 21 HD13 LEU 21 -7.534 5.612 0.200
137 HD21 LEU 21 HD21 LEU 21 -9.966 6.599 -2.383
138 HD22 LEU 21 HD22 LEU 21 -8.821 7.430 -3.441
139 HD23 LEU 21 HD23 LEU 21 -9.288 8.172 -1.900
140 H LEU 22 H LEU 22 -3.545 7.717 -2.098
141 HA LEU 22 HA LEU 22 -3.237 10.502 -1.510
142 HB2 LEU 22 HB2 LEU 22 -1.302 8.210 -1.896
143 HB3 LEU 22 HB3 LEU 22 -0.741 9.836 -1.528
144 HG LEU 22 HG LEU 22 -2.652 8.305 0.261
145 HD11 LEU 22 HD11 LEU 22 -0.517 7.100 0.061
146 HD12 LEU 22 HD12 LEU 22 -0.678 7.840 1.666
147 HD13 LEU 22 HD13 LEU 22 0.375 8.593 0.444
148 HD21 LEU 22 HD21 LEU 22 -1.891 9.950 1.963
149 HD22 LEU 22 HD22 LEU 22 -2.720 10.729 0.603
150 HD23 LEU 22 HD23 LEU 22 -0.946 10.788 0.711
151 H ARG 23 H ARG 23 -3.292 9.011 -4.568
152 HA ARG 23 HA ARG 23 -1.597 11.195 -5.738
153 HB2 ARG 23 HB2 ARG 23 -2.738 8.748 -7.114
154 HB3 ARG 23 HB3 ARG 23 -1.567 9.894 -7.772
155 HG2 ARG 23 HG2 ARG 23 -0.041 9.118 -5.814
156 HG3 ARG 23 HG3 ARG 23 -1.165 7.745 -5.707
157 HD2 ARG 23 HD2 ARG 23 0.498 8.611 -8.090
158 HD3 ARG 23 HD3 ARG 23 0.630 7.091 -7.177
159 HE ARG 23 HE ARG 23 -1.997 7.140 -8.126
160 HH11 ARG 23 HH11 ARG 23 1.157 7.327 -9.726
161 HH12 ARG 23 HH12 ARG 23 0.540 6.630 -11.201
162 HH21 ARG 23 HH21 ARG 23 -2.693 6.275 -9.999
163 HH22 ARG 23 HH22 ARG 23 -1.612 6.038 -11.355
164 H GLY 24 H GLY 24 -4.661 10.836 -4.765
165 HA2 GLY 24 HA2 GLY 24 -6.522 12.086 -5.385
166 HA3 GLY 24 HA3 GLY 24 -5.696 12.594 -6.867
167 H ASN 25 H ASN 25 -5.503 9.212 -6.498
168 HA ASN 25 HA ASN 25 -7.455 8.823 -8.666
169 HB2 ASN 25 HB2 ASN 25 -5.889 6.793 -7.014
170 HB3 ASN 25 HB3 ASN 25 -6.882 6.420 -8.416
171 HD21 ASN 25 HD21 ASN 25 -6.217 8.385 -10.205
172 HD22 ASN 25 HD22 ASN 25 -4.518 8.258 -10.596
173 H ARG 26 H ARG 26 -9.222 7.265 -8.430
174 HA ARG 26 HA ARG 26 -10.867 7.770 -6.164
175 HB2 ARG 26 HB2 ARG 26 -10.937 6.016 -8.562
176 HB3 ARG 26 HB3 ARG 26 -12.014 5.613 -7.238
177 HG2 ARG 26 HG2 ARG 26 -12.825 7.157 -9.241
178 HG3 ARG 26 HG3 ARG 26 -13.407 7.384 -7.595
179 HD2 ARG 26 HD2 ARG 26 -12.964 9.545 -8.537
180 HD3 ARG 26 HD3 ARG 26 -11.765 9.243 -7.280
181 HE ARG 26 HE ARG 26 -10.711 8.474 -9.847
182 HH11 ARG 26 HH11 ARG 26 -11.481 11.374 -7.970
183 HH12 ARG 26 HH12 ARG 26 -10.254 12.319 -8.768
184 HH21 ARG 26 HH21 ARG 26 -9.161 9.749 -10.799
185 HH22 ARG 26 HH22 ARG 26 -8.991 11.427 -10.338
186 H GLY 27 H GLY 27 -8.324 5.460 -6.582
187 HA2 GLY 27 HA2 GLY 27 -7.824 4.646 -4.132
188 HA3 GLY 27 HA3 GLY 27 -9.383 3.795 -4.353
189 H GLY 28 H GLY 28 -7.931 1.796 -4.107
190 HA2 GLY 28 HA2 GLY 28 -7.222 0.905 -6.825
191 HA3 GLY 28 HA3 GLY 28 -5.906 0.917 -5.637
192 H TYR 29 H TYR 29 -6.495 -1.504 -6.712
193 HA TYR 29 HA TYR 29 -7.662 -2.862 -4.424
194 HB2 TYR 29 HB2 TYR 29 -8.930 -4.419 -5.764
195 HB3 TYR 29 HB3 TYR 29 -9.472 -2.777 -6.109
196 HD1 TYR 29 HD2 TYR 29 -8.951 -1.716 -8.314
197 HD2 TYR 29 HD1 TYR 29 -7.792 -5.776 -7.453
198 HE1 TYR 29 HE2 TYR 29 -8.591 -2.139 -10.745
199 HE2 TYR 29 HE1 TYR 29 -7.436 -6.180 -9.883
200 HH TYR 29 HH TYR 29 -8.023 -3.676 -12.346
201 H CYS 30 H CYS 30 -6.945 -5.207 -4.378
202 HA CYS 30 HA CYS 30 -4.199 -5.303 -5.510
203 HB2 CYS 30 HB2 CYS 30 -5.412 -6.865 -3.212
204 HB3 CYS 30 HB3 CYS 30 -3.739 -6.967 -3.777
205 H ASN 31 H ASN 31 -3.559 -6.836 -6.844
206 HA ASN 31 HA ASN 31 -5.484 -8.838 -7.865
207 HB2 ASN 31 HB2 ASN 31 -2.541 -8.255 -8.443
208 HB3 ASN 31 HB3 ASN 31 -3.443 -9.566 -9.209
209 HD21 ASN 31 HD21 ASN 31 -2.189 -7.504 -10.628
210 HD22 ASN 31 HD22 ASN 31 -3.441 -6.583 -11.422
211 H GLY 32 H GLY 32 -4.850 -11.169 -7.831
212 HA2 GLY 32 HA2 GLY 32 -4.143 -12.042 -5.215
213 HA3 GLY 32 HA3 GLY 32 -4.321 -13.060 -6.643
214 H ARG 33 H ARG 33 -1.962 -10.815 -7.386
215 HA ARG 33 HA ARG 33 0.159 -12.543 -6.399
216 HB2 ARG 33 HB2 ARG 33 0.098 -10.903 -8.935
217 HB3 ARG 33 HB3 ARG 33 1.535 -11.727 -8.310
218 HG2 ARG 33 HG2 ARG 33 0.216 -13.886 -8.388
219 HG3 ARG 33 HG3 ARG 33 -1.021 -13.006 -9.311
220 HD2 ARG 33 HD2 ARG 33 0.671 -12.424 -11.015
221 HD3 ARG 33 HD3 ARG 33 1.914 -13.271 -10.070
222 HE ARG 33 HE ARG 33 -0.260 -15.047 -10.601
223 HH11 ARG 33 HH11 ARG 33 2.476 -13.555 -12.266
224 HH12 ARG 33 HH12 ARG 33 2.594 -14.850 -13.426
225 HH21 ARG 33 HH21 ARG 33 -0.042 -16.663 -12.116
226 HH22 ARG 33 HH22 ARG 33 1.193 -16.574 -13.340
227 H ALA 34 H ALA 34 -1.212 -10.222 -5.183
228 HA ALA 34 HA ALA 34 -0.719 -8.543 -3.780
229 HB1 ALA 34 HB1 ALA 34 1.452 -8.467 -2.698
230 HB2 ALA 34 HB2 ALA 34 1.008 -10.169 -2.950
231 HB3 ALA 34 HB3 ALA 34 2.198 -9.389 -4.018
232 H ILE 35 H ILE 35 -0.712 -8.152 -6.631
233 HA ILE 35 HA ILE 35 1.031 -5.734 -6.886
234 HB ILE 35 HB ILE 35 -0.861 -6.912 -8.937
235 HG12 ILE 35 HG12 ILE 35 2.146 -7.218 -8.615
236 HG13 ILE 35 HG13 ILE 35 0.945 -8.494 -8.411
237 HG21 ILE 35 HG21 ILE 35 -0.401 -4.481 -9.290
238 HG22 ILE 35 HG22 ILE 35 1.349 -4.810 -9.244
239 HG23 ILE 35 HG23 ILE 35 0.341 -5.444 -10.564
240 HD11 ILE 35 HD11 ILE 35 1.755 -7.109 -10.958
241 HD12 ILE 35 HD12 ILE 35 1.948 -8.819 -10.523
242 HD13 ILE 35 HD13 ILE 35 0.324 -8.162 -10.832
243 H CYS 36 H CYS 36 0.165 -3.745 -7.008
244 HA CYS 36 HA CYS 36 -2.689 -3.474 -6.097
245 HB2 CYS 36 HB2 CYS 36 -1.014 -2.567 -4.539
246 HB3 CYS 36 HB3 CYS 36 -0.343 -1.579 -5.834
247 H VAL 37 H VAL 37 -4.117 -2.532 -7.452
248 HA VAL 37 HA VAL 37 -3.049 -1.225 -9.902
249 HB VAL 37 HB VAL 37 -5.533 -2.967 -9.585
250 HG11 VAL 37 HG11 VAL 37 -5.662 -2.774 -12.078
251 HG12 VAL 37 HG12 VAL 37 -5.845 -1.201 -11.280
252 HG13 VAL 37 HG13 VAL 37 -4.298 -1.633 -12.048
253 HG21 VAL 37 HG21 VAL 37 -3.549 -4.371 -9.521
254 HG22 VAL 37 HG22 VAL 37 -4.346 -4.555 -11.092
255 HG23 VAL 37 HG23 VAL 37 -2.878 -3.555 -10.957
256 H CYS 38 H CYS 38 -3.355 0.797 -9.504
257 HA CYS 38 HA CYS 38 -5.487 1.900 -7.913
258 HB2 CYS 38 HB2 CYS 38 -3.672 3.242 -9.947
259 HB3 CYS 38 HB3 CYS 38 -4.703 4.074 -8.779
260 H ARG 39 H ARG 39 -7.261 3.119 -8.576
261 HA ARG 39 HA ARG 39 -8.343 2.462 -11.240
262 HB2 ARG 39 HB2 ARG 39 -9.526 3.859 -8.805
263 HB3 ARG 39 HB3 ARG 39 -10.404 3.551 -10.312
264 HG2 ARG 39 HG2 ARG 39 -10.131 1.121 -9.987
265 HG3 ARG 39 HG3 ARG 39 -9.251 1.416 -8.476
266 HD2 ARG 39 HD2 ARG 39 -11.228 2.465 -7.486
267 HD3 ARG 39 HD3 ARG 39 -12.106 2.305 -9.018
268 HE ARG 39 HE ARG 39 -12.427 0.033 -8.631
269 HH11 ARG 39 HH11 ARG 39 -10.279 1.296 -6.132
270 HH12 ARG 39 HH12 ARG 39 -10.386 -0.154 -5.169
271 HH21 ARG 39 HH21 ARG 39 -12.530 -1.778 -7.348
272 HH22 ARG 39 HH22 ARG 39 -11.659 -1.850 -5.841
273 H ASN 40 H ASN 40 -9.478 4.596 -12.204
274 HA ASN 40 HA ASN 40 -7.522 6.452 -12.769
275 HB2 ASN 40 HB2 ASN 40 -9.216 7.781 -13.841
276 HB3 ASN 40 HB3 ASN 40 -9.587 6.080 -14.153
277 HD21 ASN 40 HD21 ASN 40 -11.564 5.349 -13.629
278 HD22 ASN 40 HD22 ASN 40 -12.742 6.243 -12.701
Start of MODEL 20
1 H1 ALA 1 H1 ALA 1 2.179 -0.307 -9.285
2 H2 ALA 1 H2 ALA 1 2.440 -1.937 -9.288
3 H3 ALA 1 H3 ALA 1 1.024 -1.332 -8.698
4 HA ALA 1 HA ALA 1 3.701 -0.901 -7.528
5 HB1 ALA 1 HB1 ALA 1 2.198 1.047 -7.159
6 HB2 ALA 1 HB2 ALA 1 0.929 -0.027 -6.531
7 HB3 ALA 1 HB3 ALA 1 2.452 0.175 -5.632
8 H THR 2 H THR 2 3.115 -1.652 -4.911
9 HA THR 2 HA THR 2 2.252 -4.489 -5.289
10 HB THR 2 HB THR 2 4.681 -4.312 -4.791
11 HG1 THR 2 HG1 THR 2 4.492 -5.989 -3.446
12 HG21 THR 2 HG21 THR 2 5.410 -3.551 -2.553
13 HG22 THR 2 HG22 THR 2 3.760 -3.019 -2.176
14 HG23 THR 2 HG23 THR 2 4.689 -2.213 -3.465
15 H CYS 3 H CYS 3 1.340 -5.551 -3.496
16 HA CYS 3 HA CYS 3 -0.310 -3.750 -1.747
17 HB2 CYS 3 HB2 CYS 3 -1.420 -5.266 -3.468
18 HB3 CYS 3 HB3 CYS 3 -0.786 -6.646 -2.571
19 H ASP 4 H ASP 4 2.507 -5.421 -1.739
20 HA ASP 4 HA ASP 4 2.228 -7.182 0.525
21 HB2 ASP 4 HB2 ASP 4 4.616 -5.972 -0.905
22 HB3 ASP 4 HB3 ASP 4 4.772 -7.087 0.456
23 H LEU 5 H LEU 5 3.388 -7.099 2.478
24 HA LEU 5 HA LEU 5 3.776 -4.352 3.575
25 HB2 LEU 5 HB2 LEU 5 3.633 -5.534 5.807
26 HB3 LEU 5 HB3 LEU 5 2.152 -5.672 4.876
27 HG LEU 5 HG LEU 5 4.029 -7.920 4.457
28 HD11 LEU 5 HD11 LEU 5 3.658 -9.012 6.567
29 HD12 LEU 5 HD12 LEU 5 2.690 -7.646 7.160
30 HD13 LEU 5 HD13 LEU 5 4.431 -7.443 6.858
31 HD21 LEU 5 HD21 LEU 5 1.974 -9.242 4.723
32 HD22 LEU 5 HD22 LEU 5 1.732 -7.900 3.587
33 HD23 LEU 5 HD23 LEU 5 1.090 -7.783 5.242
34 H LEU 6 H LEU 6 5.470 -5.168 1.838
35 HA LEU 6 HA LEU 6 7.698 -6.666 2.943
36 HB2 LEU 6 HB2 LEU 6 7.065 -6.687 0.528
37 HB3 LEU 6 HB3 LEU 6 7.483 -4.982 0.419
38 HG LEU 6 HG LEU 6 9.852 -5.539 0.904
39 HD11 LEU 6 HD11 LEU 6 10.569 -7.928 0.738
40 HD12 LEU 6 HD12 LEU 6 8.861 -8.421 0.804
41 HD13 LEU 6 HD13 LEU 6 9.613 -7.597 2.193
42 HD21 LEU 6 HD21 LEU 6 10.304 -6.585 -1.283
43 HD22 LEU 6 HD22 LEU 6 9.029 -5.357 -1.406
44 HD23 LEU 6 HD23 LEU 6 8.600 -7.086 -1.402
45 H SER 7 H SER 7 6.789 -3.332 2.408
46 HA SER 7 HA SER 7 9.426 -2.291 3.062
47 HB2 SER 7 HB2 SER 7 6.794 -0.839 2.767
48 HB3 SER 7 HB3 SER 7 8.419 -0.131 2.631
49 HG SER 7 HG SER 7 7.793 -0.509 0.566
50 H GLY 8 H GLY 8 7.379 -3.625 5.045
51 HA2 GLY 8 HA2 GLY 8 7.687 -3.334 7.468
52 HA3 GLY 8 HA3 GLY 8 7.697 -1.573 7.172
53 H THR 9 H THR 9 5.884 -0.714 7.745
54 HA THR 9 HA THR 9 3.468 -1.919 8.217
55 HB THR 9 HB THR 9 3.471 0.029 9.145
56 HG1 THR 9 HG1 THR 9 2.507 1.772 7.768
57 HG21 THR 9 HG21 THR 9 4.511 2.169 8.204
58 HG22 THR 9 HG22 THR 9 5.120 1.162 6.873
59 HG23 THR 9 HG23 THR 9 5.644 0.858 8.556
60 H GLY 10 H GLY 10 1.465 -1.338 7.367
61 HA2 GLY 10 HA2 GLY 10 0.060 -1.140 5.340
62 HA3 GLY 10 HA3 GLY 10 1.416 -1.764 4.384
63 H VAL 11 H VAL 11 1.001 -3.310 7.399
64 HA VAL 11 HA VAL 11 0.572 -5.852 6.377
65 HB VAL 11 HB VAL 11 -0.242 -4.798 9.060
66 HG11 VAL 11 HG11 VAL 11 0.198 -7.122 9.863
67 HG12 VAL 11 HG12 VAL 11 -1.099 -7.077 8.651
68 HG13 VAL 11 HG13 VAL 11 0.532 -7.616 8.188
69 HG21 VAL 11 HG21 VAL 11 2.076 -5.638 9.776
70 HG22 VAL 11 HG22 VAL 11 2.475 -5.674 8.047
71 HG23 VAL 11 HG23 VAL 11 2.032 -4.145 8.828
72 H LYS 12 H LYS 12 -1.714 -3.450 7.445
73 HA LYS 12 HA LYS 12 -4.023 -5.018 6.639
74 HB2 LYS 12 HB2 LYS 12 -3.490 -2.135 7.341
75 HB3 LYS 12 HB3 LYS 12 -5.092 -2.696 6.833
76 HG2 LYS 12 HG2 LYS 12 -3.587 -3.692 9.292
77 HG3 LYS 12 HG3 LYS 12 -4.856 -2.459 9.312
78 HD2 LYS 12 HD2 LYS 12 -6.458 -4.137 8.362
79 HD3 LYS 12 HD3 LYS 12 -5.189 -5.375 8.490
80 HE2 LYS 12 HE2 LYS 12 -5.047 -4.962 10.939
81 HE3 LYS 12 HE3 LYS 12 -6.341 -3.755 10.802
82 HZ1 LYS 12 HZ1 LYS 12 -6.621 -6.644 10.170
83 HZ2 LYS 12 HZ2 LYS 12 -7.824 -5.521 10.042
84 HZ3 LYS 12 HZ3 LYS 12 -7.200 -5.897 11.521
85 H HIS 13 H HIS 13 -3.982 -5.538 4.507
86 HA HIS 13 HA HIS 13 -2.443 -4.202 2.565
87 HB2 HIS 13 HB2 HIS 13 -4.692 -6.207 2.403
88 HB3 HIS 13 HB3 HIS 13 -3.925 -5.564 0.953
89 HD1 HIS 13 HD1 HIS 13 -3.144 -8.126 0.531
90 HD2 HIS 13 HD2 HIS 13 -1.364 -6.143 3.770
91 HE1 HIS 13 HE1 HIS 13 -1.065 -9.457 1.168
92 HE2 HIS 13 HE2 HIS 13 -0.020 -8.250 3.124
93 H SER 14 H SER 14 -5.279 -2.978 3.817
94 HA SER 14 HA SER 14 -6.416 -1.710 1.548
95 HB2 SER 14 HB2 SER 14 -6.405 -0.128 4.003
96 HB3 SER 14 HB3 SER 14 -7.783 -0.838 3.127
97 HG SER 14 HG SER 14 -7.625 -1.853 5.113
98 H ALA 15 H ALA 15 -3.459 -1.308 3.112
99 HA ALA 15 HA ALA 15 -2.854 1.321 2.755
100 HB1 ALA 15 HB1 ALA 15 -1.446 -0.219 4.007
101 HB2 ALA 15 HB2 ALA 15 -1.024 -1.072 2.502
102 HB3 ALA 15 HB3 ALA 15 -0.490 0.607 2.757
103 H CYS 16 H CYS 16 -2.793 -1.271 0.367
104 HA CYS 16 HA CYS 16 -1.474 0.199 -1.680
105 HB2 CYS 16 HB2 CYS 16 -1.574 -2.004 -2.294
106 HB3 CYS 16 HB3 CYS 16 -3.125 -2.242 -1.486
107 H ALA 17 H ALA 17 -4.821 -0.147 -0.865
108 HA ALA 17 HA ALA 17 -5.835 1.378 -3.041
109 HB1 ALA 17 HB1 ALA 17 -7.277 -0.134 -1.701
110 HB2 ALA 17 HB2 ALA 17 -7.078 0.940 -0.296
111 HB3 ALA 17 HB3 ALA 17 -7.935 1.518 -1.740
112 H ALA 18 H ALA 18 -4.864 2.174 0.213
113 HA ALA 18 HA ALA 18 -5.576 4.930 0.101
114 HB1 ALA 18 HB1 ALA 18 -5.162 3.714 2.222
115 HB2 ALA 18 HB2 ALA 18 -3.439 3.582 1.794
116 HB3 ALA 18 HB3 ALA 18 -4.164 5.180 2.095
117 H HIS 19 H HIS 19 -2.609 3.230 -0.766
118 HA HIS 19 HA HIS 19 -1.043 5.468 -1.130
119 HB2 HIS 19 HB2 HIS 19 -0.284 3.066 -1.075
120 HB3 HIS 19 HB3 HIS 19 -0.814 2.942 -2.757
121 HD1 HIS 19 HD1 HIS 19 1.728 4.789 -0.563
122 HD2 HIS 19 HD2 HIS 19 0.990 3.982 -4.609
123 HE1 HIS 19 HE1 HIS 19 3.765 5.603 -1.863
124 HE2 HIS 19 HE2 HIS 19 3.305 5.106 -4.297
125 H CYS 20 H CYS 20 -3.378 3.908 -3.212
126 HA CYS 20 HA CYS 20 -2.780 5.550 -5.531
127 HB2 CYS 20 HB2 CYS 20 -5.205 3.885 -4.820
128 HB3 CYS 20 HB3 CYS 20 -4.884 4.595 -6.406
129 H LEU 21 H LEU 21 -5.190 5.615 -2.876
130 HA LEU 21 HA LEU 21 -6.777 7.772 -3.837
131 HB2 LEU 21 HB2 LEU 21 -6.067 6.780 -1.083
132 HB3 LEU 21 HB3 LEU 21 -7.084 8.186 -1.297
133 HG LEU 21 HG LEU 21 -7.774 5.414 -2.274
134 HD11 LEU 21 HD11 LEU 21 -9.327 5.362 -0.356
135 HD12 LEU 21 HD12 LEU 21 -8.683 6.923 0.203
136 HD13 LEU 21 HD13 LEU 21 -7.639 5.486 0.174
137 HD21 LEU 21 HD21 LEU 21 -10.059 6.349 -2.472
138 HD22 LEU 21 HD22 LEU 21 -8.917 7.203 -3.521
139 HD23 LEU 21 HD23 LEU 21 -9.439 7.949 -1.999
140 H LEU 22 H LEU 22 -3.706 7.736 -2.054
141 HA LEU 22 HA LEU 22 -3.591 10.534 -1.488
142 HB2 LEU 22 HB2 LEU 22 -1.471 8.408 -1.861
143 HB3 LEU 22 HB3 LEU 22 -1.067 10.070 -1.450
144 HG LEU 22 HG LEU 22 -2.865 8.330 0.265
145 HD11 LEU 22 HD11 LEU 22 -0.617 7.343 0.086
146 HD12 LEU 22 HD12 LEU 22 -0.893 8.016 1.705
147 HD13 LEU 22 HD13 LEU 22 0.113 8.903 0.535
148 HD21 LEU 22 HD21 LEU 22 -2.304 10.000 2.016
149 HD22 LEU 22 HD22 LEU 22 -3.173 10.727 0.653
150 HD23 LEU 22 HD23 LEU 22 -1.415 10.954 0.806
151 H ARG 23 H ARG 23 -3.142 8.853 -4.514
152 HA ARG 23 HA ARG 23 -1.642 11.128 -5.693
153 HB2 ARG 23 HB2 ARG 23 -2.875 8.721 -7.063
154 HB3 ARG 23 HB3 ARG 23 -1.725 9.865 -7.759
155 HG2 ARG 23 HG2 ARG 23 -0.150 9.049 -5.827
156 HG3 ARG 23 HG3 ARG 23 -1.257 7.657 -5.786
157 HD2 ARG 23 HD2 ARG 23 0.363 8.683 -8.140
158 HD3 ARG 23 HD3 ARG 23 0.539 7.119 -7.316
159 HE ARG 23 HE ARG 23 -2.111 7.211 -8.247
160 HH11 ARG 23 HH11 ARG 23 1.066 7.369 -9.802
161 HH12 ARG 23 HH12 ARG 23 0.459 6.702 -11.293
162 HH21 ARG 23 HH21 ARG 23 -2.797 6.383 -10.139
163 HH22 ARG 23 HH22 ARG 23 -1.700 6.145 -11.485
164 H GLY 24 H GLY 24 -4.768 10.731 -4.755
165 HA2 GLY 24 HA2 GLY 24 -6.607 12.031 -5.348
166 HA3 GLY 24 HA3 GLY 24 -5.751 12.598 -6.793
167 H ASN 25 H ASN 25 -5.661 9.177 -6.410
168 HA ASN 25 HA ASN 25 -7.540 8.863 -8.675
169 HB2 ASN 25 HB2 ASN 25 -5.936 6.801 -7.101
170 HB3 ASN 25 HB3 ASN 25 -6.942 6.447 -8.503
171 HD21 ASN 25 HD21 ASN 25 -6.358 8.432 -10.267
172 HD22 ASN 25 HD22 ASN 25 -4.662 8.366 -10.678
173 H ARG 26 H ARG 26 -9.228 7.188 -8.531
174 HA ARG 26 HA ARG 26 -11.006 7.554 -6.352
175 HB2 ARG 26 HB2 ARG 26 -10.828 5.863 -8.753
176 HB3 ARG 26 HB3 ARG 26 -11.874 5.291 -7.467
177 HG2 ARG 26 HG2 ARG 26 -12.855 6.756 -9.429
178 HG3 ARG 26 HG3 ARG 26 -13.456 6.917 -7.781
179 HD2 ARG 26 HD2 ARG 26 -13.210 9.109 -8.792
180 HD3 ARG 26 HD3 ARG 26 -12.081 8.935 -7.448
181 HE ARG 26 HE ARG 26 -10.973 8.332 -10.115
182 HH11 ARG 26 HH11 ARG 26 -11.424 10.818 -7.629
183 HH12 ARG 26 HH12 ARG 26 -10.064 11.751 -8.197
184 HH21 ARG 26 HH21 ARG 26 -9.255 9.606 -10.770
185 HH22 ARG 26 HH22 ARG 26 -8.903 11.103 -9.933
186 H GLY 27 H GLY 27 -8.292 5.429 -6.653
187 HA2 GLY 27 HA2 GLY 27 -7.805 4.660 -4.199
188 HA3 GLY 27 HA3 GLY 27 -9.312 3.728 -4.434
189 H GLY 28 H GLY 28 -7.760 1.827 -4.125
190 HA2 GLY 28 HA2 GLY 28 -6.933 0.957 -6.828
191 HA3 GLY 28 HA3 GLY 28 -5.695 0.952 -5.554
192 H TYR 29 H TYR 29 -6.299 -1.457 -6.710
193 HA TYR 29 HA TYR 29 -7.570 -2.806 -4.502
194 HB2 TYR 29 HB2 TYR 29 -8.767 -4.362 -5.959
195 HB3 TYR 29 HB3 TYR 29 -9.359 -2.709 -6.139
196 HD1 TYR 29 HD2 TYR 29 -8.902 -1.418 -8.224
197 HD2 TYR 29 HD1 TYR 29 -7.620 -5.511 -7.802
198 HE1 TYR 29 HE2 TYR 29 -8.573 -1.578 -10.691
199 HE2 TYR 29 HE1 TYR 29 -7.305 -5.657 -10.269
200 HH TYR 29 HH TYR 29 -7.989 -2.921 -12.450
201 H CYS 30 H CYS 30 -6.931 -5.146 -4.433
202 HA CYS 30 HA CYS 30 -4.168 -5.342 -5.510
203 HB2 CYS 30 HB2 CYS 30 -5.419 -6.736 -3.129
204 HB3 CYS 30 HB3 CYS 30 -3.756 -6.937 -3.702
205 H ASN 31 H ASN 31 -3.686 -6.833 -6.923
206 HA ASN 31 HA ASN 31 -5.665 -8.855 -7.752
207 HB2 ASN 31 HB2 ASN 31 -2.763 -8.317 -8.529
208 HB3 ASN 31 HB3 ASN 31 -3.731 -9.627 -9.213
209 HD21 ASN 31 HD21 ASN 31 -2.547 -7.561 -10.720
210 HD22 ASN 31 HD22 ASN 31 -3.846 -6.648 -11.446
211 H GLY 32 H GLY 32 -5.065 -11.193 -7.720
212 HA2 GLY 32 HA2 GLY 32 -4.288 -12.028 -5.119
213 HA3 GLY 32 HA3 GLY 32 -4.533 -13.069 -6.518
214 H ARG 33 H ARG 33 -2.119 -10.893 -7.331
215 HA ARG 33 HA ARG 33 -0.049 -12.657 -6.389
216 HB2 ARG 33 HB2 ARG 33 -0.110 -11.027 -8.923
217 HB3 ARG 33 HB3 ARG 33 1.324 -11.870 -8.322
218 HG2 ARG 33 HG2 ARG 33 -0.011 -14.013 -8.388
219 HG3 ARG 33 HG3 ARG 33 -1.267 -13.120 -9.270
220 HD2 ARG 33 HD2 ARG 33 0.383 -12.531 -11.012
221 HD3 ARG 33 HD3 ARG 33 1.649 -13.387 -10.108
222 HE ARG 33 HE ARG 33 -0.533 -15.161 -10.598
223 HH11 ARG 33 HH11 ARG 33 2.140 -13.632 -12.330
224 HH12 ARG 33 HH12 ARG 33 2.227 -14.910 -13.513
225 HH21 ARG 33 HH21 ARG 33 -0.357 -16.756 -12.142
226 HH22 ARG 33 HH22 ARG 33 0.837 -16.641 -13.405
227 H ALA 34 H ALA 34 -1.332 -10.295 -5.144
228 HA ALA 34 HA ALA 34 -0.768 -8.614 -3.777
229 HB1 ALA 34 HB1 ALA 34 1.433 -8.569 -2.749
230 HB2 ALA 34 HB2 ALA 34 0.941 -10.265 -2.953
231 HB3 ALA 34 HB3 ALA 34 2.123 -9.535 -4.067
232 H ILE 35 H ILE 35 -0.845 -8.269 -6.627
233 HA ILE 35 HA ILE 35 0.982 -5.934 -6.986
234 HB ILE 35 HB ILE 35 -1.029 -7.051 -8.941
235 HG12 ILE 35 HG12 ILE 35 1.957 -7.527 -8.645
236 HG13 ILE 35 HG13 ILE 35 0.674 -8.732 -8.498
237 HG21 ILE 35 HG21 ILE 35 -0.455 -4.643 -9.335
238 HG22 ILE 35 HG22 ILE 35 1.273 -5.071 -9.372
239 HG23 ILE 35 HG23 ILE 35 0.163 -5.657 -10.634
240 HD11 ILE 35 HD11 ILE 35 1.622 -7.326 -10.982
241 HD12 ILE 35 HD12 ILE 35 1.693 -9.060 -10.599
242 HD13 ILE 35 HD13 ILE 35 0.121 -8.283 -10.916
243 H CYS 36 H CYS 36 0.241 -3.954 -7.065
244 HA CYS 36 HA CYS 36 -2.567 -3.481 -6.105
245 HB2 CYS 36 HB2 CYS 36 -0.788 -2.690 -4.581
246 HB3 CYS 36 HB3 CYS 36 -0.097 -1.739 -5.891
247 H VAL 37 H VAL 37 -3.947 -2.494 -7.487
248 HA VAL 37 HA VAL 37 -2.806 -1.167 -9.884
249 HB VAL 37 HB VAL 37 -5.286 -2.920 -9.666
250 HG11 VAL 37 HG11 VAL 37 -5.349 -2.663 -12.168
251 HG12 VAL 37 HG12 VAL 37 -5.580 -1.121 -11.326
252 HG13 VAL 37 HG13 VAL 37 -4.007 -1.504 -12.062
253 HG21 VAL 37 HG21 VAL 37 -3.314 -4.334 -9.606
254 HG22 VAL 37 HG22 VAL 37 -4.046 -4.453 -11.215
255 HG23 VAL 37 HG23 VAL 37 -2.589 -3.459 -10.980
256 H CYS 38 H CYS 38 -3.135 0.839 -9.466
257 HA CYS 38 HA CYS 38 -5.293 1.934 -7.907
258 HB2 CYS 38 HB2 CYS 38 -3.488 3.290 -9.942
259 HB3 CYS 38 HB3 CYS 38 -4.528 4.110 -8.774
260 H ARG 39 H ARG 39 -7.088 3.132 -8.602
261 HA ARG 39 HA ARG 39 -8.156 2.382 -11.234
262 HB2 ARG 39 HB2 ARG 39 -9.339 3.895 -8.874
263 HB3 ARG 39 HB3 ARG 39 -10.218 3.501 -10.358
264 HG2 ARG 39 HG2 ARG 39 -9.937 1.094 -9.892
265 HG3 ARG 39 HG3 ARG 39 -9.061 1.483 -8.399
266 HD2 ARG 39 HD2 ARG 39 -11.041 2.600 -7.486
267 HD3 ARG 39 HD3 ARG 39 -11.914 2.343 -9.008
268 HE ARG 39 HE ARG 39 -12.241 0.100 -8.475
269 HH11 ARG 39 HH11 ARG 39 -10.124 1.531 -6.046
270 HH12 ARG 39 HH12 ARG 39 -10.239 0.148 -4.989
271 HH21 ARG 39 HH21 ARG 39 -12.364 -1.617 -7.070
272 HH22 ARG 39 HH22 ARG 39 -11.511 -1.584 -5.551
273 H ASN 40 H ASN 40 -9.423 4.491 -12.171
274 HA ASN 40 HA ASN 40 -7.561 6.332 -12.943
275 HB2 ASN 40 HB2 ASN 40 -9.416 7.633 -13.879
276 HB3 ASN 40 HB3 ASN 40 -9.592 5.913 -14.245
277 HD21 ASN 40 HD21 ASN 40 -11.599 5.238 -14.098
278 HD22 ASN 40 HD22 ASN 40 -12.798 5.811 -12.966
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