Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
497467 | 2kv4 RC | 16768 | cing | 1-original | 3 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 H1 ASN 1 H1 ASN 1 13.519 -8.867 4.793
2 H2 ASN 1 H2 ASN 1 13.811 -9.635 6.281
3 H3 ASN 1 H3 ASN 1 15.007 -9.634 5.081
4 HA ASN 1 HA ASN 1 15.500 -8.064 6.849
5 HB2 ASN 1 HB2 ASN 1 14.808 -6.735 4.219
6 HB3 ASN 1 HB3 ASN 1 15.918 -6.103 5.427
7 HD21 ASN 1 HD21 ASN 1 17.662 -6.067 4.037
8 HD22 ASN 1 HD22 ASN 1 18.436 -7.502 3.460
9 H SER 2 HN SER 2 12.363 -7.739 5.377
10 HA SER 2 HA SER 2 10.506 -6.587 5.847
11 HB2 SER 2 HB2 SER 2 9.981 -6.036 8.207
12 HB3 SER 2 HB3 SER 2 10.539 -7.691 8.014
13 HG SER 2 HG SER 2 12.683 -6.271 8.501
14 H ASP 3 HN ASP 3 12.096 -5.245 4.431
15 HA ASP 3 HA ASP 3 12.961 -2.775 5.685
16 HB2 ASP 3 HB2 ASP 3 14.276 -4.023 3.916
17 HB3 ASP 3 HB3 ASP 3 13.047 -3.533 2.758
18 H SER 4 HN SER 4 11.403 -1.390 6.143
19 HA SER 4 HA SER 4 9.603 -0.553 3.969
20 HB2 SER 4 HB2 SER 4 8.786 -0.838 6.875
21 HB3 SER 4 HB3 SER 4 7.748 -0.388 5.523
22 HG SER 4 HG SER 4 9.001 -2.720 5.026
23 H GLU 5 HN GLU 5 12.130 0.508 4.931
24 HA GLU 5 HA GLU 5 11.343 2.804 6.548
25 HB2 GLU 5 HB2 GLU 5 13.341 1.372 7.164
26 HB3 GLU 5 HB3 GLU 5 14.150 2.042 5.751
27 HG2 GLU 5 HG2 GLU 5 13.792 4.308 6.690
28 HG3 GLU 5 HG3 GLU 5 13.138 3.558 8.143
29 H CYS 6 HN CYS 6 10.226 3.879 4.817
30 HA CYS 6 HA CYS 6 12.163 5.699 3.620
31 HB2 CYS 6 HB2 CYS 6 11.063 5.835 1.504
32 HB3 CYS 6 HB3 CYS 6 11.321 4.128 1.823
33 HA PRO 7 HA PRO 7 9.479 7.252 7.021
34 HB2 PRO 7 HB2 PRO 7 11.060 9.654 6.200
35 HB3 PRO 7 HB3 PRO 7 10.622 9.098 7.819
36 HG2 PRO 7 HG2 PRO 7 13.049 8.621 6.754
37 HG3 PRO 7 HG3 PRO 7 12.254 7.482 7.853
38 HD2 PRO 7 HD2 PRO 7 12.790 7.223 4.985
39 HD3 PRO 7 HD3 PRO 7 12.347 5.975 6.164
40 H LEU 8 HN LEU 8 10.009 10.198 5.280
41 HA LEU 8 HA LEU 8 7.181 10.706 5.313
42 HB2 LEU 8 HB2 LEU 8 9.465 12.352 4.238
43 HB3 LEU 8 HB3 LEU 8 7.819 12.906 4.448
44 HG LEU 8 HG LEU 8 9.670 12.034 6.669
45 HD11 LEU 8 HD11 LEU 8 9.658 14.395 7.305
46 HD12 LEU 8 HD12 LEU 8 10.344 14.157 5.698
47 HD13 LEU 8 HD13 LEU 8 8.700 14.774 5.874
48 HD21 LEU 8 HD21 LEU 8 7.336 11.542 7.175
49 HD22 LEU 8 HD22 LEU 8 7.926 12.877 8.167
50 HD23 LEU 8 HD23 LEU 8 6.889 13.201 6.777
51 H SER 9 HN SER 9 8.947 8.978 3.310
52 HA SER 9 HA SER 9 7.922 10.024 0.798
53 HB2 SER 9 HB2 SER 9 9.951 7.828 1.276
54 HB3 SER 9 HB3 SER 9 9.554 8.573 -0.273
55 HG SER 9 HG SER 9 10.286 10.590 0.654
56 H HIS 10 HN HIS 10 7.548 7.410 3.060
57 HA HIS 10 HA HIS 10 6.425 5.524 1.262
58 HB2 HIS 10 HB2 HIS 10 5.959 4.199 3.122
59 HB3 HIS 10 HB3 HIS 10 7.288 5.181 3.706
60 HD1 HIS 10 HD1 HIS 10 6.029 7.595 4.933
61 HD2 HIS 10 HD2 HIS 10 4.256 3.844 5.133
62 HE1 HIS 10 HE1 HIS 10 4.451 7.694 6.876
63 HE2 HIS 10 HE2 HIS 10 3.226 5.493 6.824
64 H ASP 11 HN ASP 11 5.196 8.193 3.041
65 HA ASP 11 HA ASP 11 2.443 7.664 2.247
66 HB2 ASP 11 HB2 ASP 11 1.931 9.493 3.797
67 HB3 ASP 11 HB3 ASP 11 2.978 8.283 4.549
68 H GLY 12 HN GLY 12 5.121 9.057 1.007
69 HA2 GLY 12 HA1 GLY 12 3.773 11.351 -0.222
70 HA3 GLY 12 HA2 GLY 12 5.508 11.050 -0.231
71 H TYR 13 HN TYR 13 5.579 8.429 -1.054
72 HA TYR 13 HA TYR 13 5.398 8.585 -3.831
73 HB2 TYR 13 HB2 TYR 13 5.704 6.370 -1.907
74 HB3 TYR 13 HB3 TYR 13 5.363 5.964 -3.577
75 HD1 TYR 13 HD2 TYR 13 6.991 6.783 -5.357
76 HD2 TYR 13 HD1 TYR 13 7.875 6.917 -1.196
77 HE1 TYR 13 HE2 TYR 13 9.392 6.952 -5.874
78 HE2 TYR 13 HE1 TYR 13 10.272 7.086 -1.704
79 HH TYR 13 HH TYR 13 11.469 7.792 -4.783
80 H CYS 14 HN CYS 14 2.986 7.857 -1.491
81 HA CYS 14 HA CYS 14 1.175 6.992 -3.625
82 HB2 CYS 14 HB2 CYS 14 1.579 5.857 -0.885
83 HB3 CYS 14 HB3 CYS 14 0.065 5.604 -1.764
84 H LEU 15 HN LEU 15 -1.032 6.812 -1.483
85 HA LEU 15 HA LEU 15 -1.702 9.625 -2.022
86 HB2 LEU 15 HB2 LEU 15 -3.570 7.267 -2.096
87 HB3 LEU 15 HB3 LEU 15 -3.966 8.926 -2.508
88 HG LEU 15 HG LEU 15 -2.064 7.128 -4.007
89 HD11 LEU 15 HD11 LEU 15 -4.396 6.519 -4.315
90 HD12 LEU 15 HD12 LEU 15 -4.796 8.189 -4.717
91 HD13 LEU 15 HD13 LEU 15 -3.750 7.252 -5.784
92 HD21 LEU 15 HD21 LEU 15 -1.339 9.464 -4.073
93 HD22 LEU 15 HD22 LEU 15 -1.945 8.939 -5.644
94 HD23 LEU 15 HD23 LEU 15 -2.947 9.953 -4.606
95 H HIS 16 HN HIS 16 -3.470 7.122 -0.204
96 HA HIS 16 HA HIS 16 -4.162 9.327 1.611
97 HB2 HIS 16 HB2 HIS 16 -5.797 7.107 0.476
98 HB3 HIS 16 HB3 HIS 16 -6.243 7.791 2.038
99 HD1 HIS 16 HD1 HIS 16 -7.653 9.824 1.976
100 HD2 HIS 16 HD2 HIS 16 -5.689 9.188 -1.630
101 HE1 HIS 16 HE1 HIS 16 -8.534 11.578 0.409
102 HE2 HIS 16 HE2 HIS 16 -7.138 11.333 -1.673
103 H ASP 17 HN ASP 17 -1.961 7.582 1.851
104 HA ASP 17 HA ASP 17 -1.731 7.585 4.543
105 HB2 ASP 17 HB2 ASP 17 -3.447 5.686 4.448
106 HB3 ASP 17 HB3 ASP 17 -2.178 4.717 3.699
107 H GLY 18 HN GLY 18 -1.054 5.513 1.773
108 HA2 GLY 18 HA1 GLY 18 0.894 4.803 0.819
109 HA3 GLY 18 HA2 GLY 18 1.586 6.301 1.411
110 H VAL 19 HN VAL 19 2.134 3.173 1.309
111 HA VAL 19 HA VAL 19 3.954 3.230 3.567
112 HB VAL 19 HB VAL 19 1.909 1.009 3.246
113 HG11 VAL 19 HG11 VAL 19 3.029 -0.096 5.114
114 HG12 VAL 19 HG12 VAL 19 4.114 0.085 3.735
115 HG13 VAL 19 HG13 VAL 19 4.265 1.161 5.123
116 HG21 VAL 19 HG21 VAL 19 1.031 2.913 4.472
117 HG22 VAL 19 HG22 VAL 19 1.294 1.552 5.563
118 HG23 VAL 19 HG23 VAL 19 2.433 2.898 5.540
119 H CYS 20 HN CYS 20 5.891 2.290 2.966
120 HA CYS 20 HA CYS 20 5.898 0.931 0.360
121 HB2 CYS 20 HB2 CYS 20 8.215 1.675 0.101
122 HB3 CYS 20 HB3 CYS 20 7.154 3.046 0.384
123 H MET 21 HN MET 21 6.020 -1.229 0.578
124 HA MET 21 HA MET 21 8.117 -2.357 2.208
125 HB2 MET 21 HB2 MET 21 6.518 -3.762 3.541
126 HB3 MET 21 HB3 MET 21 6.527 -2.061 3.951
127 HG2 MET 21 HG2 MET 21 4.477 -1.702 2.756
128 HG3 MET 21 HG3 MET 21 4.498 -3.357 2.150
129 HE1 MET 21 HE1 MET 21 3.801 -5.476 5.320
130 HE2 MET 21 HE2 MET 21 4.002 -5.474 3.566
131 HE3 MET 21 HE3 MET 21 5.366 -5.079 4.610
132 H TYR 22 HN TYR 22 8.950 -3.576 0.596
133 HA TYR 22 HA TYR 22 8.001 -6.124 0.285
134 HB2 TYR 22 HB2 TYR 22 6.329 -4.880 -1.210
135 HB3 TYR 22 HB3 TYR 22 7.677 -4.713 -2.320
136 HD1 TYR 22 HD1 TYR 22 7.591 -7.752 -0.362
137 HD2 TYR 22 HD2 TYR 22 6.257 -5.942 -3.976
138 HE1 TYR 22 HE1 TYR 22 7.101 -9.976 -1.290
139 HE2 TYR 22 HE2 TYR 22 5.770 -8.162 -4.914
140 HH TYR 22 HH TYR 22 5.709 -10.994 -3.017
141 H ILE 23 HN ILE 23 9.901 -3.564 -1.011
142 HA ILE 23 HA ILE 23 11.789 -4.288 -2.600
143 HB ILE 23 HB ILE 23 13.484 -3.321 -0.735
144 HG12 ILE 23 HG12 ILE 23 10.681 -2.499 0.053
145 HG13 ILE 23 HG13 ILE 23 11.860 -3.337 1.063
146 HG21 ILE 23 HG21 ILE 23 11.496 -1.747 -2.352
147 HG22 ILE 23 HG22 ILE 23 12.975 -1.105 -1.637
148 HG23 ILE 23 HG23 ILE 23 13.067 -2.335 -2.899
149 HD11 ILE 23 HD11 ILE 23 13.274 -1.330 1.029
150 HD12 ILE 23 HD12 ILE 23 12.067 -0.505 0.043
151 HD13 ILE 23 HD13 ILE 23 11.671 -1.001 1.688
152 H GLU 24 HN GLU 24 13.285 -4.657 0.384
153 HA GLU 24 HA GLU 24 14.165 -6.346 1.630
154 HB2 GLU 24 HB2 GLU 24 12.416 -7.774 -0.272
155 HB3 GLU 24 HB3 GLU 24 13.371 -8.676 0.909
156 HG2 GLU 24 HG2 GLU 24 11.389 -6.506 1.551
157 HG3 GLU 24 HG3 GLU 24 11.037 -8.242 1.639
158 H ALA 25 HN ALA 25 15.464 -5.143 -0.482
159 HA ALA 25 HA ALA 25 17.286 -5.258 -1.817
160 HB1 ALA 25 HB1 ALA 25 18.832 -7.155 -1.613
161 HB2 ALA 25 HB2 ALA 25 18.357 -6.528 -0.034
162 HB3 ALA 25 HB3 ALA 25 17.638 -8.017 -0.643
163 H LEU 26 HN LEU 26 14.507 -6.503 -2.378
164 HA LEU 26 HA LEU 26 15.304 -7.895 -4.774
165 HB2 LEU 26 HB2 LEU 26 12.613 -7.955 -3.462
166 HB3 LEU 26 HB3 LEU 26 13.088 -8.876 -4.875
167 HG LEU 26 HG LEU 26 14.206 -9.231 -2.094
168 HD11 LEU 26 HD11 LEU 26 13.009 -11.355 -2.125
169 HD12 LEU 26 HD12 LEU 26 11.899 -9.995 -2.298
170 HD13 LEU 26 HD13 LEU 26 12.336 -10.962 -3.708
171 HD21 LEU 26 HD21 LEU 26 14.699 -10.814 -4.614
172 HD22 LEU 26 HD22 LEU 26 15.847 -9.718 -3.844
173 HD23 LEU 26 HD23 LEU 26 15.331 -11.185 -3.009
174 H ASP 27 HN ASP 27 14.363 -5.068 -3.548
175 HA ASP 27 HA ASP 27 13.917 -3.060 -4.523
176 HB2 ASP 27 HB2 ASP 27 15.593 -3.865 -6.227
177 HB3 ASP 27 HB3 ASP 27 14.243 -4.458 -7.188
178 H LYS 28 HN LYS 28 11.970 -4.784 -3.718
179 HA LYS 28 HA LYS 28 9.836 -4.589 -5.718
180 HB2 LYS 28 HB2 LYS 28 9.775 -5.851 -2.971
181 HB3 LYS 28 HB3 LYS 28 8.579 -6.043 -4.250
182 HG2 LYS 28 HG2 LYS 28 11.434 -7.020 -4.353
183 HG3 LYS 28 HG3 LYS 28 9.989 -8.009 -4.089
184 HD2 LYS 28 HD2 LYS 28 10.637 -6.417 -6.568
185 HD3 LYS 28 HD3 LYS 28 10.673 -8.174 -6.408
186 HE2 LYS 28 HE2 LYS 28 8.317 -8.282 -6.127
187 HE3 LYS 28 HE3 LYS 28 8.192 -6.533 -5.942
188 HZ1 LYS 28 HZ1 LYS 28 8.832 -8.055 -8.403
189 HZ2 LYS 28 HZ2 LYS 28 9.029 -6.375 -8.278
190 HZ3 LYS 28 HZ3 LYS 28 7.489 -7.058 -8.116
191 H TYR 29 HN TYR 29 7.628 -3.941 -4.818
192 HA TYR 29 HA TYR 29 7.656 -2.101 -2.643
193 HB2 TYR 29 HB2 TYR 29 6.977 -0.105 -3.962
194 HB3 TYR 29 HB3 TYR 29 8.629 -0.612 -4.271
195 HD1 TYR 29 HD2 TYR 29 9.126 -1.857 -6.430
196 HD2 TYR 29 HD1 TYR 29 5.408 0.081 -5.705
197 HE1 TYR 29 HE2 TYR 29 8.655 -1.869 -8.843
198 HE2 TYR 29 HE1 TYR 29 4.932 0.080 -8.116
199 HH TYR 29 HH TYR 29 6.847 -1.704 -10.375
200 H ALA 30 HN ALA 30 5.974 -3.068 -1.735
201 HA ALA 30 HA ALA 30 3.428 -2.916 -3.178
202 HB1 ALA 30 HB1 ALA 30 3.833 -5.073 -2.104
203 HB2 ALA 30 HB2 ALA 30 4.107 -4.268 -0.559
204 HB3 ALA 30 HB3 ALA 30 2.507 -4.231 -1.302
205 H CYS 31 HN CYS 31 2.130 -1.243 -2.722
206 HA CYS 31 HA CYS 31 2.896 0.407 -0.436
207 HB2 CYS 31 HB2 CYS 31 3.439 1.447 -2.673
208 HB3 CYS 31 HB3 CYS 31 1.703 1.492 -2.988
209 H ASN 32 HN ASN 32 1.484 0.291 1.021
210 HA ASN 32 HA ASN 32 -1.284 -0.299 0.276
211 HB2 ASN 32 HB2 ASN 32 -0.476 -2.313 1.115
212 HB3 ASN 32 HB3 ASN 32 0.554 -1.521 2.294
213 HD21 ASN 32 HD21 ASN 32 -0.226 -2.737 4.006
214 HD22 ASN 32 HD22 ASN 32 -1.819 -2.546 4.642
215 H CYS 33 HN CYS 33 -2.239 1.539 0.557
216 HA CYS 33 HA CYS 33 -1.571 3.454 2.537
217 HB2 CYS 33 HB2 CYS 33 -3.818 3.151 0.572
218 HB3 CYS 33 HB3 CYS 33 -3.815 4.463 1.745
219 H VAL 34 HN VAL 34 -4.805 2.053 2.054
220 HA VAL 34 HA VAL 34 -5.115 1.543 4.882
221 HB VAL 34 HB VAL 34 -5.358 4.090 4.401
222 HG11 VAL 34 HG11 VAL 34 -6.714 3.943 2.418
223 HG12 VAL 34 HG12 VAL 34 -7.987 3.107 3.308
224 HG13 VAL 34 HG13 VAL 34 -7.599 4.784 3.689
225 HG21 VAL 34 HG21 VAL 34 -7.206 4.283 6.034
226 HG22 VAL 34 HG22 VAL 34 -7.525 2.558 5.847
227 HG23 VAL 34 HG23 VAL 34 -5.988 3.102 6.518
228 H VAL 35 HN VAL 35 -7.267 0.572 5.316
229 HA VAL 35 HA VAL 35 -8.128 -1.044 3.140
230 HB VAL 35 HB VAL 35 -9.782 -2.010 4.629
231 HG11 VAL 35 HG11 VAL 35 -7.509 -2.803 4.831
232 HG12 VAL 35 HG12 VAL 35 -7.132 -1.527 5.991
233 HG13 VAL 35 HG13 VAL 35 -8.279 -2.796 6.418
234 HG21 VAL 35 HG21 VAL 35 -10.044 -1.231 6.954
235 HG22 VAL 35 HG22 VAL 35 -8.980 0.135 6.618
236 HG23 VAL 35 HG23 VAL 35 -10.541 0.009 5.804
237 H GLY 36 HN GLY 36 -8.641 0.445 1.589
238 HA2 GLY 36 HA1 GLY 36 -11.196 1.208 1.065
239 HA3 GLY 36 HA2 GLY 36 -10.559 2.544 2.025
240 H TYR 37 HN TYR 37 -7.851 1.720 0.882
241 HA TYR 37 HA TYR 37 -8.151 2.469 -1.931
242 HB2 TYR 37 HB2 TYR 37 -6.211 3.766 0.003
243 HB3 TYR 37 HB3 TYR 37 -6.171 3.973 -1.740
244 HD1 TYR 37 HD2 TYR 37 -8.001 4.781 1.337
245 HD2 TYR 37 HD1 TYR 37 -7.719 5.441 -2.853
246 HE1 TYR 37 HE2 TYR 37 -9.505 6.709 1.547
247 HE2 TYR 37 HE1 TYR 37 -9.221 7.379 -2.652
248 HH TYR 37 HH TYR 37 -10.069 8.735 0.391
249 H ILE 38 HN ILE 38 -7.483 0.463 -2.730
250 HA ILE 38 HA ILE 38 -4.612 0.135 -2.566
251 HB ILE 38 HB ILE 38 -5.897 -1.414 -0.868
252 HG12 ILE 38 HG12 ILE 38 -3.487 -1.315 -1.180
253 HG13 ILE 38 HG13 ILE 38 -4.025 -2.975 -0.965
254 HG21 ILE 38 HG21 ILE 38 -6.257 -3.672 -1.734
255 HG22 ILE 38 HG22 ILE 38 -7.368 -2.502 -2.443
256 HG23 ILE 38 HG23 ILE 38 -5.984 -3.078 -3.371
257 HD11 ILE 38 HD11 ILE 38 -3.823 -3.353 -3.365
258 HD12 ILE 38 HD12 ILE 38 -3.300 -1.683 -3.584
259 HD13 ILE 38 HD13 ILE 38 -2.299 -2.806 -2.665
260 H GLY 39 HN GLY 39 -3.962 0.237 -4.605
261 HA2 GLY 39 HA1 GLY 39 -4.797 -1.717 -6.490
262 HA3 GLY 39 HA2 GLY 39 -5.430 -0.125 -6.906
263 H GLU 40 HN GLU 40 -2.696 -2.179 -6.947
264 HA GLU 40 HA GLU 40 -0.644 -2.003 -7.909
265 HB2 GLU 40 HB2 GLU 40 -1.739 -0.661 -9.690
266 HB3 GLU 40 HB3 GLU 40 -1.499 0.788 -8.724
267 HG2 GLU 40 HG2 GLU 40 0.966 0.307 -8.811
268 HG3 GLU 40 HG3 GLU 40 0.601 -0.935 -10.005
269 H ARG 41 HN ARG 41 -1.659 1.028 -6.443
270 HA ARG 41 HA ARG 41 0.401 0.881 -4.435
271 HB2 ARG 41 HB2 ARG 41 1.127 3.276 -5.087
272 HB3 ARG 41 HB3 ARG 41 1.739 1.908 -6.012
273 HG2 ARG 41 HG2 ARG 41 1.181 3.416 -7.666
274 HG3 ARG 41 HG3 ARG 41 -0.231 2.361 -7.588
275 HD2 ARG 41 HD2 ARG 41 -1.427 3.983 -6.270
276 HD3 ARG 41 HD3 ARG 41 -0.006 5.033 -6.223
277 HE ARG 41 HE ARG 41 -0.847 4.405 -8.893
278 HH11 ARG 41 HH12 ARG 41 -1.323 6.570 -6.191
279 HH12 ARG 41 HH11 ARG 41 -2.006 7.839 -7.167
280 HH21 ARG 41 HH22 ARG 41 -1.757 6.055 -10.165
281 HH22 ARG 41 HH21 ARG 41 -2.278 7.533 -9.419
282 H CYS 42 HN CYS 42 -2.163 0.570 -4.150
283 HA CYS 42 HA CYS 42 -3.946 1.090 -2.961
284 HB2 CYS 42 HB2 CYS 42 -3.716 2.686 -1.052
285 HB3 CYS 42 HB3 CYS 42 -2.572 1.359 -1.084
286 H GLN 43 HN GLN 43 -5.427 1.716 -4.441
287 HA GLN 43 HA GLN 43 -6.365 4.383 -4.153
288 HB2 GLN 43 HB2 GLN 43 -6.143 5.107 -6.490
289 HB3 GLN 43 HB3 GLN 43 -4.580 4.887 -5.716
290 HG2 GLN 43 HG2 GLN 43 -4.259 2.787 -6.850
291 HG3 GLN 43 HG3 GLN 43 -5.878 2.878 -7.543
292 HE21 GLN 43 HE21 GLN 43 -5.688 5.734 -8.065
293 HE22 GLN 43 HE22 GLN 43 -4.624 5.918 -9.417
294 H TYR 44 HN TYR 44 -7.041 1.293 -4.393
295 HA TYR 44 HA TYR 44 -9.624 1.806 -5.664
296 HB2 TYR 44 HB2 TYR 44 -7.713 -0.442 -6.265
297 HB3 TYR 44 HB3 TYR 44 -9.442 -0.624 -6.519
298 HD1 TYR 44 HD1 TYR 44 -10.570 0.658 -8.292
299 HD2 TYR 44 HD2 TYR 44 -6.356 0.846 -7.754
300 HE1 TYR 44 HE1 TYR 44 -10.326 1.561 -10.567
301 HE2 TYR 44 HE2 TYR 44 -6.101 1.757 -10.018
302 HH TYR 44 HH TYR 44 -8.775 2.826 -11.901
303 H ARG 45 HN ARG 45 -10.865 1.709 -3.845
304 HA ARG 45 HA ARG 45 -12.419 0.390 -2.777
305 HB2 ARG 45 HB2 ARG 45 -10.658 -1.817 -3.795
306 HB3 ARG 45 HB3 ARG 45 -12.268 -2.047 -3.099
307 HG2 ARG 45 HG2 ARG 45 -13.261 -1.579 -5.044
308 HG3 ARG 45 HG3 ARG 45 -12.237 -0.162 -5.317
309 HD2 ARG 45 HD2 ARG 45 -10.510 -1.441 -6.262
310 HD3 ARG 45 HD3 ARG 45 -11.188 -2.953 -5.641
311 HE ARG 45 HE ARG 45 -11.927 -1.598 -8.071
312 HH11 ARG 45 HH12 ARG 45 -13.116 -3.727 -5.542
313 HH12 ARG 45 HH11 ARG 45 -14.188 -4.588 -6.604
314 HH21 ARG 45 HH22 ARG 45 -13.351 -2.740 -9.461
315 HH22 ARG 45 HH21 ARG 45 -14.303 -4.055 -8.811
316 H ASP 46 HN ASP 46 -12.575 -1.397 -1.146
317 HA ASP 46 HA ASP 46 -10.306 -1.294 0.709
318 HB2 ASP 46 HB2 ASP 46 -12.085 -1.726 2.511
319 HB3 ASP 46 HB3 ASP 46 -11.983 -0.109 1.839
320 H LEU 47 HN LEU 47 -10.300 -2.971 -1.276
321 HA LEU 47 HA LEU 47 -11.373 -5.480 -1.145
322 HB2 LEU 47 HB2 LEU 47 -8.503 -4.814 -1.801
323 HB3 LEU 47 HB3 LEU 47 -9.395 -6.221 -2.345
324 HG LEU 47 HG LEU 47 -10.002 -3.368 -3.137
325 HD11 LEU 47 HD11 LEU 47 -9.102 -4.012 -5.321
326 HD12 LEU 47 HD12 LEU 47 -7.880 -4.124 -4.054
327 HD13 LEU 47 HD13 LEU 47 -8.649 -5.587 -4.669
328 HD21 LEU 47 HD21 LEU 47 -11.979 -4.776 -3.163
329 HD22 LEU 47 HD22 LEU 47 -11.465 -4.412 -4.810
330 HD23 LEU 47 HD23 LEU 47 -11.126 -5.995 -4.110
331 H LYS 48 HN LYS 48 -8.594 -4.218 0.573
332 HA LYS 48 HA LYS 48 -7.471 -6.589 1.465
333 HB2 LYS 48 HB2 LYS 48 -6.486 -5.067 3.279
334 HB3 LYS 48 HB3 LYS 48 -6.140 -4.673 1.600
335 HG2 LYS 48 HG2 LYS 48 -8.556 -3.416 2.631
336 HG3 LYS 48 HG3 LYS 48 -7.082 -2.936 3.476
337 HD2 LYS 48 HD2 LYS 48 -7.408 -2.870 0.479
338 HD3 LYS 48 HD3 LYS 48 -7.711 -1.486 1.532
339 HE2 LYS 48 HE2 LYS 48 -5.107 -2.935 1.090
340 HE3 LYS 48 HE3 LYS 48 -5.504 -1.264 0.657
341 HZ1 LYS 48 HZ1 LYS 48 -5.291 -2.361 3.420
342 HZ2 LYS 48 HZ2 LYS 48 -5.715 -0.768 3.026
343 HZ3 LYS 48 HZ3 LYS 48 -4.168 -1.346 2.659
344 H TRP 49 HN TRP 49 -9.764 -4.471 3.194
345 HA TRP 49 HA TRP 49 -9.929 -6.484 5.299
346 HB2 TRP 49 HB2 TRP 49 -9.456 -4.247 6.068
347 HB3 TRP 49 HB3 TRP 49 -10.855 -3.611 5.207
348 HD1 TRP 49 HD1 TRP 49 -10.376 -6.415 7.877
349 HE1 TRP 49 HE1 TRP 49 -12.210 -6.117 9.658
350 HE3 TRP 49 HE3 TRP 49 -12.744 -2.322 5.930
351 HZ2 TRP 49 HZ2 TRP 49 -14.368 -4.373 10.171
352 HZ3 TRP 49 HZ3 TRP 49 -14.685 -1.403 7.129
353 HH2 TRP 49 HH2 TRP 49 -15.480 -2.409 9.205
354 H TRP 50 HN TRP 50 -12.138 -4.474 3.313
355 HA TRP 50 HA TRP 50 -14.319 -6.068 4.439
356 HB2 TRP 50 HB2 TRP 50 -14.368 -3.598 4.693
357 HB3 TRP 50 HB3 TRP 50 -14.516 -3.459 2.944
358 HD1 TRP 50 HD1 TRP 50 -16.469 -4.887 5.958
359 HE1 TRP 50 HE1 TRP 50 -18.977 -4.861 5.377
360 HE3 TRP 50 HE3 TRP 50 -16.149 -3.312 1.105
361 HZ2 TRP 50 HZ2 TRP 50 -20.600 -4.250 3.141
362 HZ3 TRP 50 HZ3 TRP 50 -18.222 -3.034 -0.187
363 HH2 TRP 50 HH2 TRP 50 -20.404 -3.494 0.812
364 H GLU 51 HN GLU 51 -13.191 -4.901 1.256
365 HA GLU 51 HA GLU 51 -15.512 -5.837 -0.070
366 HB2 GLU 51 HB2 GLU 51 -12.846 -4.892 -1.093
367 HB3 GLU 51 HB3 GLU 51 -14.118 -5.461 -2.173
368 HG2 GLU 51 HG2 GLU 51 -15.557 -3.716 -0.863
369 HG3 GLU 51 HG3 GLU 51 -13.970 -3.035 -0.485
370 H LEU 52 HN LEU 52 -12.201 -7.119 0.076
371 HA LEU 52 HA LEU 52 -13.176 -9.496 -1.347
372 HB2 LEU 52 HB2 LEU 52 -10.357 -8.777 -0.602
373 HB3 LEU 52 HB3 LEU 52 -10.856 -10.077 -1.677
374 HG LEU 52 HG LEU 52 -11.035 -7.120 -2.131
375 HD11 LEU 52 HD11 LEU 52 -9.597 -7.639 -4.066
376 HD12 LEU 52 HD12 LEU 52 -8.850 -8.115 -2.541
377 HD13 LEU 52 HD13 LEU 52 -9.577 -9.336 -3.587
378 HD21 LEU 52 HD21 LEU 52 -12.063 -7.645 -4.304
379 HD22 LEU 52 HD22 LEU 52 -12.139 -9.348 -3.855
380 HD23 LEU 52 HD23 LEU 52 -13.082 -8.155 -2.958
381 H ARG 53 HN ARG 53 -11.797 -8.455 1.665
382 HA ARG 53 HA ARG 53 -11.499 -11.250 2.509
383 HB2 ARG 53 HB2 ARG 53 -9.802 -9.350 2.955
384 HB3 ARG 53 HB3 ARG 53 -10.900 -8.880 4.246
385 HG2 ARG 53 HG2 ARG 53 -10.613 -11.545 4.720
386 HG3 ARG 53 HG3 ARG 53 -9.018 -11.115 4.092
387 HD2 ARG 53 HD2 ARG 53 -9.031 -10.861 6.494
388 HD3 ARG 53 HD3 ARG 53 -8.915 -9.269 5.737
389 HE ARG 53 HE ARG 53 -11.554 -9.488 6.079
390 HH11 ARG 53 HH12 ARG 53 -8.926 -10.195 8.277
391 HH12 ARG 53 HH11 ARG 53 -9.823 -9.766 9.701
392 HH21 ARG 53 HH22 ARG 53 -12.765 -8.977 7.941
393 HH22 ARG 53 HH21 ARG 53 -12.020 -9.080 9.511
Start of MODEL 2
1 H1 ASN 1 H1 ASN 1 19.285 -1.960 1.904
2 H2 ASN 1 H2 ASN 1 19.130 -1.575 0.258
3 H3 ASN 1 H3 ASN 1 18.273 -2.886 0.911
4 HA ASN 1 HA ASN 1 17.892 -0.063 1.719
5 HB2 ASN 1 HB2 ASN 1 16.157 -1.794 -0.061
6 HB3 ASN 1 HB3 ASN 1 15.742 -0.183 0.510
7 HD21 ASN 1 HD21 ASN 1 16.833 1.609 -0.349
8 HD22 ASN 1 HD22 ASN 1 17.693 1.502 -1.852
9 H SER 2 HN SER 2 16.023 -3.076 1.451
10 HA SER 2 HA SER 2 14.603 -4.137 2.815
11 HB2 SER 2 HB2 SER 2 15.320 -4.488 5.176
12 HB3 SER 2 HB3 SER 2 16.581 -4.831 3.997
13 HG SER 2 HG SER 2 16.755 -2.262 4.737
14 H ASP 3 HN ASP 3 13.052 -2.537 2.237
15 HA ASP 3 HA ASP 3 11.386 -1.042 2.645
16 HB2 ASP 3 HB2 ASP 3 11.620 -2.241 5.411
17 HB3 ASP 3 HB3 ASP 3 10.229 -1.355 4.797
18 H SER 4 HN SER 4 13.893 0.221 2.784
19 HA SER 4 HA SER 4 13.788 1.934 5.139
20 HB2 SER 4 HB2 SER 4 15.970 2.801 4.274
21 HB3 SER 4 HB3 SER 4 15.969 1.065 4.584
22 HG SER 4 HG SER 4 15.961 2.454 2.124
23 H GLU 5 HN GLU 5 13.476 2.121 1.639
24 HA GLU 5 HA GLU 5 13.365 4.989 1.558
25 HB2 GLU 5 HB2 GLU 5 12.371 3.158 -0.618
26 HB3 GLU 5 HB3 GLU 5 13.068 4.762 -0.775
27 HG2 GLU 5 HG2 GLU 5 14.525 2.232 -0.048
28 HG3 GLU 5 HG3 GLU 5 14.617 3.105 -1.576
29 H CYS 6 HN CYS 6 11.661 5.333 3.126
30 HA CYS 6 HA CYS 6 9.095 4.149 2.487
31 HB2 CYS 6 HB2 CYS 6 10.293 4.504 4.869
32 HB3 CYS 6 HB3 CYS 6 9.277 5.945 4.819
33 HA PRO 7 HA PRO 7 7.615 8.680 2.534
34 HB2 PRO 7 HB2 PRO 7 9.979 10.403 2.282
35 HB3 PRO 7 HB3 PRO 7 8.638 10.493 3.424
36 HG2 PRO 7 HG2 PRO 7 11.103 9.732 4.185
37 HG3 PRO 7 HG3 PRO 7 9.637 9.058 4.923
38 HD2 PRO 7 HD2 PRO 7 11.417 7.869 2.822
39 HD3 PRO 7 HD3 PRO 7 10.682 7.093 4.242
40 H LEU 8 HN LEU 8 10.592 9.570 0.777
41 HA LEU 8 HA LEU 8 9.172 10.727 -1.320
42 HB2 LEU 8 HB2 LEU 8 11.515 11.219 -0.760
43 HB3 LEU 8 HB3 LEU 8 11.986 9.641 -1.360
44 HG LEU 8 HG LEU 8 11.181 10.312 -3.621
45 HD11 LEU 8 HD11 LEU 8 10.807 12.698 -4.060
46 HD12 LEU 8 HD12 LEU 8 9.592 12.036 -2.963
47 HD13 LEU 8 HD13 LEU 8 10.906 13.025 -2.329
48 HD21 LEU 8 HD21 LEU 8 13.285 12.088 -2.394
49 HD22 LEU 8 HD22 LEU 8 13.541 10.458 -3.015
50 HD23 LEU 8 HD23 LEU 8 13.081 11.759 -4.113
51 H SER 9 HN SER 9 9.869 7.430 -0.787
52 HA SER 9 HA SER 9 9.559 6.757 -3.604
53 HB2 SER 9 HB2 SER 9 11.412 5.682 -2.396
54 HB3 SER 9 HB3 SER 9 10.269 5.005 -1.239
55 HG SER 9 HG SER 9 10.574 4.394 -3.981
56 H HIS 10 HN HIS 10 8.095 5.975 -0.422
57 HA HIS 10 HA HIS 10 5.989 4.613 -1.941
58 HB2 HIS 10 HB2 HIS 10 7.163 4.014 0.726
59 HB3 HIS 10 HB3 HIS 10 5.479 3.583 0.425
60 HD1 HIS 10 HD1 HIS 10 5.273 1.250 -0.340
61 HD2 HIS 10 HD2 HIS 10 8.788 3.009 -1.694
62 HE1 HIS 10 HE1 HIS 10 6.416 -0.505 -1.732
63 HE2 HIS 10 HE2 HIS 10 8.450 0.640 -2.676
64 H ASP 11 HN ASP 11 6.228 6.317 1.173
65 HA ASP 11 HA ASP 11 3.627 7.153 1.446
66 HB2 ASP 11 HB2 ASP 11 5.304 7.529 3.149
67 HB3 ASP 11 HB3 ASP 11 6.176 8.640 2.102
68 H GLY 12 HN GLY 12 5.990 8.303 -0.810
69 HA2 GLY 12 HA1 GLY 12 4.423 10.645 -1.547
70 HA3 GLY 12 HA2 GLY 12 5.982 10.183 -2.213
71 H TYR 13 HN TYR 13 4.931 7.402 -2.615
72 HA TYR 13 HA TYR 13 3.717 7.870 -5.223
73 HB2 TYR 13 HB2 TYR 13 5.631 6.255 -4.812
74 HB3 TYR 13 HB3 TYR 13 4.488 5.244 -3.942
75 HD1 TYR 13 HD2 TYR 13 4.404 7.061 -7.216
76 HD2 TYR 13 HD1 TYR 13 3.912 3.379 -5.146
77 HE1 TYR 13 HE2 TYR 13 3.805 5.959 -9.331
78 HE2 TYR 13 HE1 TYR 13 3.309 2.265 -7.253
79 HH TYR 13 HH TYR 13 2.492 2.759 -9.437
80 H CYS 14 HN CYS 14 2.972 6.591 -2.086
81 HA CYS 14 HA CYS 14 0.347 5.649 -2.909
82 HB2 CYS 14 HB2 CYS 14 1.698 5.603 -0.189
83 HB3 CYS 14 HB3 CYS 14 0.240 4.718 -0.657
84 H LEU 15 HN LEU 15 -1.376 6.305 -0.898
85 HA LEU 15 HA LEU 15 -1.389 9.218 -1.284
86 HB2 LEU 15 HB2 LEU 15 -3.788 7.425 -1.554
87 HB3 LEU 15 HB3 LEU 15 -3.726 9.151 -1.853
88 HG LEU 15 HG LEU 15 -2.327 7.020 -3.456
89 HD11 LEU 15 HD11 LEU 15 -4.686 8.796 -4.098
90 HD12 LEU 15 HD12 LEU 15 -3.889 7.707 -5.234
91 HD13 LEU 15 HD13 LEU 15 -4.732 7.053 -3.831
92 HD21 LEU 15 HD21 LEU 15 -1.752 8.848 -4.996
93 HD22 LEU 15 HD22 LEU 15 -2.447 10.011 -3.868
94 HD23 LEU 15 HD23 LEU 15 -1.021 9.081 -3.408
95 H HIS 16 HN HIS 16 -3.425 6.790 0.422
96 HA HIS 16 HA HIS 16 -4.013 9.044 2.230
97 HB2 HIS 16 HB2 HIS 16 -5.680 6.915 1.097
98 HB3 HIS 16 HB3 HIS 16 -5.965 7.234 2.808
99 HD1 HIS 16 HD1 HIS 16 -6.625 9.737 3.426
100 HD2 HIS 16 HD2 HIS 16 -6.741 8.784 -0.623
101 HE1 HIS 16 HE1 HIS 16 -7.970 11.558 2.338
102 HE2 HIS 16 HE2 HIS 16 -7.823 11.082 -0.131
103 H ASP 17 HN ASP 17 -1.763 7.302 2.459
104 HA ASP 17 HA ASP 17 -1.459 7.183 5.148
105 HB2 ASP 17 HB2 ASP 17 -3.287 5.428 5.065
106 HB3 ASP 17 HB3 ASP 17 -2.153 4.395 4.197
107 H GLY 18 HN GLY 18 -0.910 5.177 2.291
108 HA2 GLY 18 HA1 GLY 18 0.984 4.247 1.405
109 HA3 GLY 18 HA2 GLY 18 1.663 5.837 1.712
110 H VAL 19 HN VAL 19 1.985 2.597 2.218
111 HA VAL 19 HA VAL 19 3.933 3.023 4.387
112 HB VAL 19 HB VAL 19 2.025 0.687 4.118
113 HG11 VAL 19 HG11 VAL 19 4.253 -0.175 4.656
114 HG12 VAL 19 HG12 VAL 19 4.373 0.960 6.000
115 HG13 VAL 19 HG13 VAL 19 3.166 -0.326 6.037
116 HG21 VAL 19 HG21 VAL 19 1.356 1.307 6.380
117 HG22 VAL 19 HG22 VAL 19 2.523 2.630 6.372
118 HG23 VAL 19 HG23 VAL 19 1.148 2.660 5.269
119 H CYS 20 HN CYS 20 5.831 1.730 4.275
120 HA CYS 20 HA CYS 20 6.415 1.003 1.490
121 HB2 CYS 20 HB2 CYS 20 8.782 1.476 2.129
122 HB3 CYS 20 HB3 CYS 20 7.720 2.868 2.320
123 H MET 21 HN MET 21 6.776 -1.070 0.995
124 HA MET 21 HA MET 21 8.549 -2.636 2.641
125 HB2 MET 21 HB2 MET 21 6.985 -4.587 2.763
126 HB3 MET 21 HB3 MET 21 6.507 -3.219 3.757
127 HG2 MET 21 HG2 MET 21 4.957 -2.541 1.916
128 HG3 MET 21 HG3 MET 21 5.333 -4.071 1.128
129 HE1 MET 21 HE1 MET 21 3.730 -2.325 4.241
130 HE2 MET 21 HE2 MET 21 3.242 -3.706 5.224
131 HE3 MET 21 HE3 MET 21 4.954 -3.357 4.984
132 H TYR 22 HN TYR 22 9.363 -4.526 1.504
133 HA TYR 22 HA TYR 22 9.537 -6.083 -0.086
134 HB2 TYR 22 HB2 TYR 22 7.560 -4.363 -1.452
135 HB3 TYR 22 HB3 TYR 22 8.412 -5.607 -2.358
136 HD1 TYR 22 HD1 TYR 22 6.901 -5.494 1.067
137 HD2 TYR 22 HD2 TYR 22 7.041 -7.458 -2.704
138 HE1 TYR 22 HE1 TYR 22 5.326 -7.185 1.899
139 HE2 TYR 22 HE2 TYR 22 5.458 -9.151 -1.880
140 HH TYR 22 HH TYR 22 4.866 -10.077 0.575
141 H ILE 23 HN ILE 23 9.938 -2.766 -0.412
142 HA ILE 23 HA ILE 23 12.005 -2.772 -2.351
143 HB ILE 23 HB ILE 23 12.589 -0.529 -1.362
144 HG12 ILE 23 HG12 ILE 23 10.278 -1.283 0.417
145 HG13 ILE 23 HG13 ILE 23 11.907 -0.860 0.907
146 HG21 ILE 23 HG21 ILE 23 9.728 -0.999 -2.170
147 HG22 ILE 23 HG22 ILE 23 10.557 0.556 -2.196
148 HG23 ILE 23 HG23 ILE 23 11.089 -0.747 -3.261
149 HD11 ILE 23 HD11 ILE 23 10.355 0.937 1.371
150 HD12 ILE 23 HD12 ILE 23 11.552 1.428 0.175
151 HD13 ILE 23 HD13 ILE 23 9.915 1.016 -0.336
152 H GLU 24 HN GLU 24 12.851 -4.807 -1.137
153 HA GLU 24 HA GLU 24 14.748 -4.092 0.999
154 HB2 GLU 24 HB2 GLU 24 13.748 -6.755 0.032
155 HB3 GLU 24 HB3 GLU 24 14.790 -6.503 1.433
156 HG2 GLU 24 HG2 GLU 24 13.069 -5.369 2.609
157 HG3 GLU 24 HG3 GLU 24 12.047 -5.295 1.173
158 H ALA 25 HN ALA 25 15.210 -3.490 -1.764
159 HA ALA 25 HA ALA 25 16.905 -3.478 -3.268
160 HB1 ALA 25 HB1 ALA 25 19.030 -4.589 -2.793
161 HB2 ALA 25 HB2 ALA 25 18.479 -3.638 -1.415
162 HB3 ALA 25 HB3 ALA 25 18.302 -5.391 -1.401
163 H LEU 26 HN LEU 26 14.792 -5.739 -2.735
164 HA LEU 26 HA LEU 26 15.713 -7.533 -4.821
165 HB2 LEU 26 HB2 LEU 26 13.291 -7.700 -3.037
166 HB3 LEU 26 HB3 LEU 26 13.702 -8.868 -4.278
167 HG LEU 26 HG LEU 26 15.285 -8.307 -1.768
168 HD11 LEU 26 HD11 LEU 26 13.646 -10.688 -2.624
169 HD12 LEU 26 HD12 LEU 26 14.640 -10.597 -1.171
170 HD13 LEU 26 HD13 LEU 26 13.239 -9.541 -1.348
171 HD21 LEU 26 HD21 LEU 26 16.692 -10.182 -2.468
172 HD22 LEU 26 HD22 LEU 26 15.791 -10.299 -3.980
173 HD23 LEU 26 HD23 LEU 26 16.756 -8.863 -3.637
174 H ASP 27 HN ASP 27 14.351 -4.711 -4.357
175 HA ASP 27 HA ASP 27 13.153 -3.261 -5.586
176 HB2 ASP 27 HB2 ASP 27 14.393 -5.086 -7.516
177 HB3 ASP 27 HB3 ASP 27 13.007 -4.188 -8.146
178 H LYS 28 HN LYS 28 11.806 -5.016 -4.096
179 HA LYS 28 HA LYS 28 9.495 -5.805 -5.696
180 HB2 LYS 28 HB2 LYS 28 9.872 -6.140 -2.681
181 HB3 LYS 28 HB3 LYS 28 8.697 -6.957 -3.739
182 HG2 LYS 28 HG2 LYS 28 11.686 -7.361 -3.758
183 HG3 LYS 28 HG3 LYS 28 10.458 -8.498 -3.187
184 HD2 LYS 28 HD2 LYS 28 10.835 -7.544 -6.028
185 HD3 LYS 28 HD3 LYS 28 11.232 -9.142 -5.400
186 HE2 LYS 28 HE2 LYS 28 8.452 -7.977 -5.398
187 HE3 LYS 28 HE3 LYS 28 9.084 -9.009 -6.679
188 HZ1 LYS 28 HZ1 LYS 28 7.761 -10.199 -4.992
189 HZ2 LYS 28 HZ2 LYS 28 8.931 -9.814 -3.825
190 HZ3 LYS 28 HZ3 LYS 28 9.337 -10.793 -5.149
191 H TYR 29 HN TYR 29 7.344 -5.138 -4.939
192 HA TYR 29 HA TYR 29 7.392 -2.443 -3.794
193 HB2 TYR 29 HB2 TYR 29 6.176 -3.206 -6.456
194 HB3 TYR 29 HB3 TYR 29 5.829 -1.700 -5.619
195 HD1 TYR 29 HD2 TYR 29 8.354 -3.586 -7.506
196 HD2 TYR 29 HD1 TYR 29 7.466 0.082 -5.535
197 HE1 TYR 29 HE2 TYR 29 10.296 -2.539 -8.588
198 HE2 TYR 29 HE1 TYR 29 9.406 1.135 -6.616
199 HH TYR 29 HH TYR 29 11.213 -0.463 -9.124
200 H ALA 30 HN ALA 30 6.274 -3.003 -1.971
201 HA ALA 30 HA ALA 30 3.416 -3.335 -2.555
202 HB1 ALA 30 HB1 ALA 30 4.816 -4.571 -0.190
203 HB2 ALA 30 HB2 ALA 30 3.090 -4.650 -0.545
204 HB3 ALA 30 HB3 ALA 30 4.247 -5.446 -1.613
205 H CYS 31 HN CYS 31 2.048 -2.123 -1.294
206 HA CYS 31 HA CYS 31 3.226 -0.292 0.633
207 HB2 CYS 31 HB2 CYS 31 3.257 0.903 -1.520
208 HB3 CYS 31 HB3 CYS 31 1.538 0.583 -1.727
209 H ASN 32 HN ASN 32 1.736 0.473 2.140
210 HA ASN 32 HA ASN 32 -0.892 -0.852 2.013
211 HB2 ASN 32 HB2 ASN 32 0.722 -1.887 3.639
212 HB3 ASN 32 HB3 ASN 32 0.730 -0.361 4.517
213 HD21 ASN 32 HD21 ASN 32 -0.995 -3.251 3.824
214 HD22 ASN 32 HD22 ASN 32 -2.286 -3.006 4.953
215 H CYS 33 HN CYS 33 -2.140 0.831 1.423
216 HA CYS 33 HA CYS 33 -1.815 3.384 2.683
217 HB2 CYS 33 HB2 CYS 33 -2.231 3.084 0.283
218 HB3 CYS 33 HB3 CYS 33 -3.792 2.378 0.651
219 H VAL 34 HN VAL 34 -5.094 2.477 1.991
220 HA VAL 34 HA VAL 34 -5.641 2.045 4.831
221 HB VAL 34 HB VAL 34 -5.790 4.501 4.340
222 HG11 VAL 34 HG11 VAL 34 -6.577 4.392 2.051
223 HG12 VAL 34 HG12 VAL 34 -8.100 3.691 2.597
224 HG13 VAL 34 HG13 VAL 34 -7.678 5.344 3.047
225 HG21 VAL 34 HG21 VAL 34 -8.354 3.131 5.123
226 HG22 VAL 34 HG22 VAL 34 -7.025 3.562 6.200
227 HG23 VAL 34 HG23 VAL 34 -7.979 4.827 5.423
228 H VAL 35 HN VAL 35 -7.568 0.878 5.178
229 HA VAL 35 HA VAL 35 -8.496 -0.680 3.040
230 HB VAL 35 HB VAL 35 -10.203 -1.554 4.515
231 HG11 VAL 35 HG11 VAL 35 -8.779 -2.300 6.377
232 HG12 VAL 35 HG12 VAL 35 -7.944 -2.364 4.824
233 HG13 VAL 35 HG13 VAL 35 -7.598 -1.060 5.958
234 HG21 VAL 35 HG21 VAL 35 -9.439 0.663 6.439
235 HG22 VAL 35 HG22 VAL 35 -10.974 0.513 5.586
236 HG23 VAL 35 HG23 VAL 35 -10.522 -0.681 6.801
237 H GLY 36 HN GLY 36 -9.106 0.455 1.371
238 HA2 GLY 36 HA1 GLY 36 -11.547 1.231 0.715
239 HA3 GLY 36 HA2 GLY 36 -10.993 2.648 1.606
240 H TYR 37 HN TYR 37 -8.176 2.083 0.727
241 HA TYR 37 HA TYR 37 -8.347 2.483 -2.167
242 HB2 TYR 37 HB2 TYR 37 -6.878 4.357 -0.294
243 HB3 TYR 37 HB3 TYR 37 -6.727 4.366 -2.046
244 HD1 TYR 37 HD1 TYR 37 -8.552 5.212 -3.439
245 HD2 TYR 37 HD2 TYR 37 -8.811 5.281 0.807
246 HE1 TYR 37 HE1 TYR 37 -10.420 6.802 -3.582
247 HE2 TYR 37 HE2 TYR 37 -10.680 6.871 0.673
248 HH TYR 37 HH TYR 37 -12.347 7.492 -2.207
249 H ILE 38 HN ILE 38 -7.253 0.528 -2.591
250 HA ILE 38 HA ILE 38 -4.413 0.955 -2.340
251 HB ILE 38 HB ILE 38 -5.524 -0.643 -0.396
252 HG12 ILE 38 HG12 ILE 38 -3.319 0.468 -0.386
253 HG13 ILE 38 HG13 ILE 38 -3.222 -1.200 0.165
254 HG21 ILE 38 HG21 ILE 38 -4.321 -2.461 -2.478
255 HG22 ILE 38 HG22 ILE 38 -4.734 -2.919 -0.826
256 HG23 ILE 38 HG23 ILE 38 -6.006 -2.447 -1.952
257 HD11 ILE 38 HD11 ILE 38 -2.387 -1.864 -2.035
258 HD12 ILE 38 HD12 ILE 38 -2.464 -0.183 -2.565
259 HD13 ILE 38 HD13 ILE 38 -1.357 -0.652 -1.272
260 H GLY 39 HN GLY 39 -3.498 0.505 -4.144
261 HA2 GLY 39 HA1 GLY 39 -3.961 -1.939 -5.537
262 HA3 GLY 39 HA2 GLY 39 -4.586 -0.550 -6.425
263 H GLU 40 HN GLU 40 -1.848 -2.342 -5.603
264 HA GLU 40 HA GLU 40 0.321 -2.249 -6.165
265 HB2 GLU 40 HB2 GLU 40 -0.311 -1.481 -8.384
266 HB3 GLU 40 HB3 GLU 40 -0.494 0.162 -7.783
267 HG2 GLU 40 HG2 GLU 40 1.944 0.125 -7.214
268 HG3 GLU 40 HG3 GLU 40 2.049 -1.415 -8.068
269 H ARG 41 HN ARG 41 -1.159 0.767 -5.329
270 HA ARG 41 HA ARG 41 0.998 1.305 -3.466
271 HB2 ARG 41 HB2 ARG 41 0.744 3.770 -4.314
272 HB3 ARG 41 HB3 ARG 41 1.739 2.612 -5.191
273 HG2 ARG 41 HG2 ARG 41 0.607 3.187 -7.007
274 HG3 ARG 41 HG3 ARG 41 -0.736 2.272 -6.335
275 HD2 ARG 41 HD2 ARG 41 -1.743 4.277 -6.797
276 HD3 ARG 41 HD3 ARG 41 -1.276 4.513 -5.114
277 HE ARG 41 HE ARG 41 0.323 6.059 -5.776
278 HH11 ARG 41 HH12 ARG 41 -1.086 4.511 -8.597
279 HH12 ARG 41 HH11 ARG 41 -0.500 5.713 -9.707
280 HH21 ARG 41 HH22 ARG 41 1.097 7.642 -7.243
281 HH22 ARG 41 HH21 ARG 41 0.759 7.468 -8.944
282 H CYS 42 HN CYS 42 -2.220 2.105 -4.561
283 HA CYS 42 HA CYS 42 -3.753 2.155 -2.406
284 HB2 CYS 42 HB2 CYS 42 -2.244 3.435 -1.027
285 HB3 CYS 42 HB3 CYS 42 -2.028 4.645 -2.286
286 H GLN 43 HN GLN 43 -5.133 2.030 -4.391
287 HA GLN 43 HA GLN 43 -6.798 4.233 -4.295
288 HB2 GLN 43 HB2 GLN 43 -6.528 5.366 -6.425
289 HB3 GLN 43 HB3 GLN 43 -5.057 5.466 -5.453
290 HG2 GLN 43 HG2 GLN 43 -3.890 4.026 -6.842
291 HG3 GLN 43 HG3 GLN 43 -5.358 3.355 -7.552
292 HE21 GLN 43 HE21 GLN 43 -3.187 6.094 -7.521
293 HE22 GLN 43 HE22 GLN 43 -3.709 6.761 -9.030
294 H TYR 44 HN TYR 44 -6.662 1.231 -4.661
295 HA TYR 44 HA TYR 44 -8.784 1.219 -6.668
296 HB2 TYR 44 HB2 TYR 44 -6.569 -0.826 -6.469
297 HB3 TYR 44 HB3 TYR 44 -8.019 -1.024 -7.451
298 HD1 TYR 44 HD1 TYR 44 -8.480 0.893 -9.182
299 HD2 TYR 44 HD2 TYR 44 -4.681 0.134 -7.431
300 HE1 TYR 44 HE1 TYR 44 -7.393 2.061 -11.051
301 HE2 TYR 44 HE2 TYR 44 -3.582 1.305 -9.293
302 HH TYR 44 HH TYR 44 -5.324 3.181 -11.585
303 H ARG 45 HN ARG 45 -10.167 1.423 -4.967
304 HA ARG 45 HA ARG 45 -11.833 0.541 -3.688
305 HB2 ARG 45 HB2 ARG 45 -10.787 -2.170 -4.443
306 HB3 ARG 45 HB3 ARG 45 -12.440 -1.726 -4.026
307 HG2 ARG 45 HG2 ARG 45 -12.838 -1.630 -6.213
308 HG3 ARG 45 HG3 ARG 45 -11.861 -0.158 -6.233
309 HD2 ARG 45 HD2 ARG 45 -11.065 -1.743 -7.910
310 HD3 ARG 45 HD3 ARG 45 -9.842 -1.489 -6.644
311 HE ARG 45 HE ARG 45 -11.381 -3.676 -5.869
312 HH11 ARG 45 HH12 ARG 45 -9.268 -2.879 -8.562
313 HH12 ARG 45 HH11 ARG 45 -8.764 -4.525 -8.799
314 HH21 ARG 45 HH22 ARG 45 -10.721 -5.826 -6.194
315 HH22 ARG 45 HH21 ARG 45 -9.572 -6.195 -7.454
316 H ASP 46 HN ASP 46 -11.831 -1.953 -2.322
317 HA ASP 46 HA ASP 46 -9.719 -1.552 -0.330
318 HB2 ASP 46 HB2 ASP 46 -11.783 -0.416 0.467
319 HB3 ASP 46 HB3 ASP 46 -12.647 -1.946 0.337
320 H LEU 47 HN LEU 47 -9.041 -3.348 -1.775
321 HA LEU 47 HA LEU 47 -10.353 -5.834 -1.651
322 HB2 LEU 47 HB2 LEU 47 -8.285 -6.749 -2.585
323 HB3 LEU 47 HB3 LEU 47 -8.808 -5.301 -3.421
324 HG LEU 47 HG LEU 47 -7.086 -4.085 -1.902
325 HD11 LEU 47 HD11 LEU 47 -5.137 -5.461 -1.335
326 HD12 LEU 47 HD12 LEU 47 -6.570 -5.946 -0.428
327 HD13 LEU 47 HD13 LEU 47 -6.029 -6.908 -1.805
328 HD21 LEU 47 HD21 LEU 47 -6.947 -4.307 -4.332
329 HD22 LEU 47 HD22 LEU 47 -5.360 -4.459 -3.574
330 HD23 LEU 47 HD23 LEU 47 -6.207 -5.898 -4.144
331 H LYS 48 HN LYS 48 -8.903 -4.200 0.859
332 HA LYS 48 HA LYS 48 -7.912 -6.647 2.086
333 HB2 LYS 48 HB2 LYS 48 -7.149 -5.051 3.953
334 HB3 LYS 48 HB3 LYS 48 -6.259 -5.106 2.444
335 HG2 LYS 48 HG2 LYS 48 -8.402 -3.077 2.755
336 HG3 LYS 48 HG3 LYS 48 -6.884 -2.849 3.621
337 HD2 LYS 48 HD2 LYS 48 -5.863 -3.403 1.243
338 HD3 LYS 48 HD3 LYS 48 -7.437 -2.811 0.701
339 HE2 LYS 48 HE2 LYS 48 -5.942 -0.936 0.740
340 HE3 LYS 48 HE3 LYS 48 -7.057 -0.777 2.101
341 HZ1 LYS 48 HZ1 LYS 48 -4.229 -1.675 2.187
342 HZ2 LYS 48 HZ2 LYS 48 -5.288 -1.844 3.497
343 HZ3 LYS 48 HZ3 LYS 48 -4.906 -0.302 2.918
344 H TRP 49 HN TRP 49 -10.056 -3.945 3.086
345 HA TRP 49 HA TRP 49 -11.045 -5.757 5.167
346 HB2 TRP 49 HB2 TRP 49 -10.315 -3.593 5.957
347 HB3 TRP 49 HB3 TRP 49 -11.396 -2.779 4.834
348 HD1 TRP 49 HD1 TRP 49 -13.642 -2.057 5.826
349 HE1 TRP 49 HE1 TRP 49 -15.031 -2.682 7.905
350 HE3 TRP 49 HE3 TRP 49 -10.752 -5.883 7.612
351 HZ2 TRP 49 HZ2 TRP 49 -14.913 -4.558 10.013
352 HZ3 TRP 49 HZ3 TRP 49 -11.462 -7.037 9.663
353 HH2 TRP 49 HH2 TRP 49 -13.498 -6.387 10.838
354 H TRP 50 HN TRP 50 -12.290 -3.768 2.504
355 HA TRP 50 HA TRP 50 -15.006 -4.381 3.367
356 HB2 TRP 50 HB2 TRP 50 -14.158 -2.056 2.739
357 HB3 TRP 50 HB3 TRP 50 -14.221 -2.607 1.070
358 HD1 TRP 50 HD1 TRP 50 -16.402 -2.024 -0.122
359 HE1 TRP 50 HE1 TRP 50 -18.822 -1.501 0.592
360 HE3 TRP 50 HE3 TRP 50 -15.937 -2.786 4.912
361 HZ2 TRP 50 HZ2 TRP 50 -20.326 -1.433 2.980
362 HZ3 TRP 50 HZ3 TRP 50 -17.914 -2.474 6.340
363 HH2 TRP 50 HH2 TRP 50 -20.064 -1.810 5.392
364 H GLU 51 HN GLU 51 -13.033 -4.725 0.431
365 HA GLU 51 HA GLU 51 -15.250 -5.850 -1.008
366 HB2 GLU 51 HB2 GLU 51 -12.359 -5.410 -1.741
367 HB3 GLU 51 HB3 GLU 51 -13.528 -6.156 -2.831
368 HG2 GLU 51 HG2 GLU 51 -14.852 -3.926 -2.167
369 HG3 GLU 51 HG3 GLU 51 -13.183 -3.368 -1.987
370 H LEU 52 HN LEU 52 -12.047 -7.110 -0.071
371 HA LEU 52 HA LEU 52 -13.033 -9.791 -0.701
372 HB2 LEU 52 HB2 LEU 52 -10.228 -9.004 0.023
373 HB3 LEU 52 HB3 LEU 52 -10.757 -10.489 -0.746
374 HG LEU 52 HG LEU 52 -10.791 -7.732 -1.965
375 HD11 LEU 52 HD11 LEU 52 -9.097 -8.652 -3.479
376 HD12 LEU 52 HD12 LEU 52 -8.558 -8.726 -1.803
377 HD13 LEU 52 HD13 LEU 52 -9.141 -10.184 -2.608
378 HD21 LEU 52 HD21 LEU 52 -11.607 -10.391 -3.156
379 HD22 LEU 52 HD22 LEU 52 -12.695 -9.070 -2.733
380 HD23 LEU 52 HD23 LEU 52 -11.512 -8.858 -4.023
381 H ARG 53 HN ARG 53 -11.703 -7.888 1.891
382 HA ARG 53 HA ARG 53 -11.468 -8.219 4.130
383 HB2 ARG 53 HB2 ARG 53 -13.901 -8.495 4.037
384 HB3 ARG 53 HB3 ARG 53 -13.708 -10.207 3.690
385 HG2 ARG 53 HG2 ARG 53 -12.624 -10.480 5.902
386 HG3 ARG 53 HG3 ARG 53 -12.976 -8.781 6.239
387 HD2 ARG 53 HD2 ARG 53 -15.346 -9.189 6.039
388 HD3 ARG 53 HD3 ARG 53 -15.053 -10.856 5.548
389 HE ARG 53 HE ARG 53 -13.946 -10.236 8.119
390 HH11 ARG 53 HH12 ARG 53 -16.826 -11.229 6.402
391 HH12 ARG 53 HH11 ARG 53 -17.567 -11.962 7.795
392 HH21 ARG 53 HH22 ARG 53 -14.897 -11.216 9.961
393 HH22 ARG 53 HH21 ARG 53 -16.464 -11.952 9.818
Start of MODEL 3
1 H1 ASN 1 H1 ASN 1 15.772 -7.045 4.766
2 H2 ASN 1 H2 ASN 1 14.656 -5.817 4.430
3 H3 ASN 1 H3 ASN 1 16.190 -5.784 3.706
4 HA ASN 1 HA ASN 1 14.591 -6.507 2.106
5 HB2 ASN 1 HB2 ASN 1 16.397 -8.684 3.172
6 HB3 ASN 1 HB3 ASN 1 15.501 -8.839 1.664
7 HD21 ASN 1 HD21 ASN 1 18.406 -8.734 2.243
8 HD22 ASN 1 HD22 ASN 1 19.021 -7.448 1.253
9 H SER 2 HN SER 2 12.990 -8.010 1.444
10 HA SER 2 HA SER 2 11.105 -9.238 1.657
11 HB2 SER 2 HB2 SER 2 12.349 -10.347 4.188
12 HB3 SER 2 HB3 SER 2 11.097 -11.099 3.199
13 HG SER 2 HG SER 2 12.603 -11.871 1.951
14 H ASP 3 HN ASP 3 10.077 -7.176 2.020
15 HA ASP 3 HA ASP 3 8.698 -5.707 3.087
16 HB2 ASP 3 HB2 ASP 3 8.217 -8.283 4.505
17 HB3 ASP 3 HB3 ASP 3 7.414 -6.829 5.083
18 H SER 4 HN SER 4 10.683 -4.529 3.797
19 HA SER 4 HA SER 4 10.704 -4.345 6.700
20 HB2 SER 4 HB2 SER 4 13.190 -4.378 6.753
21 HB3 SER 4 HB3 SER 4 12.495 -5.916 6.243
22 HG SER 4 HG SER 4 13.790 -3.940 4.687
23 H GLU 5 HN GLU 5 10.987 -2.360 7.464
24 HA GLU 5 HA GLU 5 11.160 -0.105 7.562
25 HB2 GLU 5 HB2 GLU 5 13.522 -0.960 7.597
26 HB3 GLU 5 HB3 GLU 5 13.631 -0.525 5.896
27 HG2 GLU 5 HG2 GLU 5 13.111 1.812 6.494
28 HG3 GLU 5 HG3 GLU 5 13.111 1.345 8.194
29 H CYS 6 HN CYS 6 12.848 -0.011 4.511
30 HA CYS 6 HA CYS 6 12.463 1.028 2.536
31 HB2 CYS 6 HB2 CYS 6 10.327 -0.140 2.381
32 HB3 CYS 6 HB3 CYS 6 9.564 1.061 3.413
33 HA PRO 7 HA PRO 7 12.997 5.169 4.032
34 HB2 PRO 7 HB2 PRO 7 13.738 6.313 1.697
35 HB3 PRO 7 HB3 PRO 7 14.811 5.247 2.610
36 HG2 PRO 7 HG2 PRO 7 13.123 4.639 0.218
37 HG3 PRO 7 HG3 PRO 7 14.787 4.141 0.567
38 HD2 PRO 7 HD2 PRO 7 12.640 2.515 0.934
39 HD3 PRO 7 HD3 PRO 7 14.115 2.402 1.916
40 H LEU 8 HN LEU 8 12.022 7.204 3.875
41 HA LEU 8 HA LEU 8 9.242 7.089 3.504
42 HB2 LEU 8 HB2 LEU 8 10.560 8.513 5.088
43 HB3 LEU 8 HB3 LEU 8 10.907 9.578 3.747
44 HG LEU 8 HG LEU 8 8.493 10.013 3.476
45 HD11 LEU 8 HD11 LEU 8 8.221 8.327 5.959
46 HD12 LEU 8 HD12 LEU 8 6.940 9.299 5.233
47 HD13 LEU 8 HD13 LEU 8 7.618 7.929 4.350
48 HD21 LEU 8 HD21 LEU 8 9.824 11.522 4.832
49 HD22 LEU 8 HD22 LEU 8 8.202 11.355 5.505
50 HD23 LEU 8 HD23 LEU 8 9.556 10.509 6.252
51 H SER 9 HN SER 9 11.405 7.299 1.093
52 HA SER 9 HA SER 9 10.367 9.441 -0.471
53 HB2 SER 9 HB2 SER 9 12.057 7.106 -1.395
54 HB3 SER 9 HB3 SER 9 11.894 8.681 -2.173
55 HG SER 9 HG SER 9 12.859 9.597 -0.270
56 H HIS 10 HN HIS 10 9.751 6.072 0.002
57 HA HIS 10 HA HIS 10 7.979 6.003 -2.306
58 HB2 HIS 10 HB2 HIS 10 8.678 3.744 -0.425
59 HB3 HIS 10 HB3 HIS 10 7.812 3.603 -1.951
60 HD1 HIS 10 HD1 HIS 10 9.263 4.163 -4.150
61 HD2 HIS 10 HD2 HIS 10 11.391 3.578 -0.620
62 HE1 HIS 10 HE1 HIS 10 11.653 3.775 -4.846
63 HE2 HIS 10 HE2 HIS 10 12.935 3.483 -2.690
64 H ASP 11 HN ASP 11 7.900 5.338 1.163
65 HA ASP 11 HA ASP 11 5.214 5.081 1.639
66 HB2 ASP 11 HB2 ASP 11 7.019 4.854 3.340
67 HB3 ASP 11 HB3 ASP 11 7.209 6.602 3.336
68 H GLY 12 HN GLY 12 7.117 8.075 1.551
69 HA2 GLY 12 HA1 GLY 12 4.902 9.819 1.861
70 HA3 GLY 12 HA2 GLY 12 6.506 10.267 1.295
71 H TYR 13 HN TYR 13 6.311 8.199 -0.885
72 HA TYR 13 HA TYR 13 5.048 9.863 -2.850
73 HB2 TYR 13 HB2 TYR 13 7.007 8.424 -3.361
74 HB3 TYR 13 HB3 TYR 13 5.995 7.001 -3.135
75 HD1 TYR 13 HD2 TYR 13 6.227 10.118 -5.182
76 HD2 TYR 13 HD1 TYR 13 4.872 6.089 -4.948
77 HE1 TYR 13 HE2 TYR 13 5.559 10.208 -7.548
78 HE2 TYR 13 HE1 TYR 13 4.204 6.172 -7.310
79 HH TYR 13 HH TYR 13 5.190 8.638 -9.411
80 H CYS 14 HN CYS 14 4.096 7.095 -0.965
81 HA CYS 14 HA CYS 14 1.790 6.317 -2.350
82 HB2 CYS 14 HB2 CYS 14 2.560 6.173 0.563
83 HB3 CYS 14 HB3 CYS 14 1.037 5.526 -0.036
84 H LEU 15 HN LEU 15 -0.491 6.702 -1.659
85 HA LEU 15 HA LEU 15 -0.742 9.623 -1.591
86 HB2 LEU 15 HB2 LEU 15 -2.792 7.673 -2.597
87 HB3 LEU 15 HB3 LEU 15 -2.701 9.397 -2.905
88 HG LEU 15 HG LEU 15 -0.736 7.360 -3.914
89 HD11 LEU 15 HD11 LEU 15 -1.781 7.742 -6.094
90 HD12 LEU 15 HD12 LEU 15 -2.938 7.094 -4.931
91 HD13 LEU 15 HD13 LEU 15 -2.965 8.810 -5.338
92 HD21 LEU 15 HD21 LEU 15 -1.056 10.297 -4.535
93 HD22 LEU 15 HD22 LEU 15 0.257 9.565 -3.613
94 HD23 LEU 15 HD23 LEU 15 0.073 9.197 -5.328
95 H HIS 16 HN HIS 16 -3.203 7.143 -1.029
96 HA HIS 16 HA HIS 16 -4.304 8.942 0.968
97 HB2 HIS 16 HB2 HIS 16 -5.448 6.484 -0.358
98 HB3 HIS 16 HB3 HIS 16 -6.300 7.425 0.862
99 HD1 HIS 16 HD1 HIS 16 -6.831 9.976 0.171
100 HD2 HIS 16 HD2 HIS 16 -5.659 7.437 -2.913
101 HE1 HIS 16 HE1 HIS 16 -7.490 11.139 -1.962
102 HE2 HIS 16 HE2 HIS 16 -6.756 9.602 -3.819
103 H ASP 17 HN ASP 17 -2.151 8.076 2.030
104 HA ASP 17 HA ASP 17 -1.633 7.647 4.223
105 HB2 ASP 17 HB2 ASP 17 -4.083 7.458 4.700
106 HB3 ASP 17 HB3 ASP 17 -3.973 5.752 4.290
107 H GLY 18 HN GLY 18 -1.275 5.993 1.608
108 HA2 GLY 18 HA1 GLY 18 -0.522 3.449 2.078
109 HA3 GLY 18 HA2 GLY 18 0.293 4.513 0.956
110 H VAL 19 HN VAL 19 1.730 2.706 1.787
111 HA VAL 19 HA VAL 19 3.737 3.638 3.586
112 HB VAL 19 HB VAL 19 1.791 1.477 4.417
113 HG11 VAL 19 HG11 VAL 19 3.378 0.670 6.098
114 HG12 VAL 19 HG12 VAL 19 4.007 0.421 4.469
115 HG13 VAL 19 HG13 VAL 19 4.617 1.749 5.457
116 HG21 VAL 19 HG21 VAL 19 3.088 3.739 5.924
117 HG22 VAL 19 HG22 VAL 19 1.422 3.674 5.348
118 HG23 VAL 19 HG23 VAL 19 1.964 2.568 6.612
119 H CYS 20 HN CYS 20 5.655 2.186 3.285
120 HA CYS 20 HA CYS 20 5.245 0.495 0.913
121 HB2 CYS 20 HB2 CYS 20 7.389 1.275 0.024
122 HB3 CYS 20 HB3 CYS 20 6.267 2.613 0.235
123 H MET 21 HN MET 21 5.942 -1.504 1.115
124 HA MET 21 HA MET 21 8.448 -2.082 2.339
125 HB2 MET 21 HB2 MET 21 7.631 -3.563 4.109
126 HB3 MET 21 HB3 MET 21 7.108 -1.913 4.369
127 HG2 MET 21 HG2 MET 21 4.892 -2.458 3.554
128 HG3 MET 21 HG3 MET 21 5.408 -4.108 3.212
129 HE1 MET 21 HE1 MET 21 4.761 -1.431 5.998
130 HE2 MET 21 HE2 MET 21 5.126 -2.334 7.467
131 HE3 MET 21 HE3 MET 21 6.421 -1.919 6.344
132 H TYR 22 HN TYR 22 9.136 -3.273 0.594
133 HA TYR 22 HA TYR 22 8.270 -5.983 0.765
134 HB2 TYR 22 HB2 TYR 22 7.213 -4.502 -1.330
135 HB3 TYR 22 HB3 TYR 22 8.543 -5.414 -2.034
136 HD1 TYR 22 HD1 TYR 22 5.557 -5.853 0.134
137 HD2 TYR 22 HD2 TYR 22 8.188 -7.631 -2.690
138 HE1 TYR 22 HE1 TYR 22 4.114 -7.836 0.059
139 HE2 TYR 22 HE2 TYR 22 6.752 -9.625 -2.775
140 HH TYR 22 HH TYR 22 3.609 -9.674 -1.509
141 H ILE 23 HN ILE 23 10.244 -3.731 -0.962
142 HA ILE 23 HA ILE 23 12.337 -4.425 -2.024
143 HB ILE 23 HB ILE 23 13.972 -3.370 -0.420
144 HG12 ILE 23 HG12 ILE 23 11.459 -2.851 1.189
145 HG13 ILE 23 HG13 ILE 23 12.758 -3.942 1.667
146 HG21 ILE 23 HG21 ILE 23 11.470 -1.854 -1.144
147 HG22 ILE 23 HG22 ILE 23 13.028 -1.134 -0.738
148 HG23 ILE 23 HG23 ILE 23 12.866 -2.129 -2.185
149 HD11 ILE 23 HD11 ILE 23 13.031 -0.973 1.248
150 HD12 ILE 23 HD12 ILE 23 12.915 -1.795 2.805
151 HD13 ILE 23 HD13 ILE 23 14.309 -2.074 1.762
152 H GLU 24 HN GLU 24 12.392 -6.642 -2.150
153 HA GLU 24 HA GLU 24 13.540 -8.202 0.028
154 HB2 GLU 24 HB2 GLU 24 12.402 -8.826 -2.674
155 HB3 GLU 24 HB3 GLU 24 13.097 -10.067 -1.636
156 HG2 GLU 24 HG2 GLU 24 11.381 -9.805 -0.041
157 HG3 GLU 24 HG3 GLU 24 10.824 -8.296 -0.777
158 H ALA 25 HN ALA 25 15.087 -6.197 -1.423
159 HA ALA 25 HA ALA 25 17.107 -5.851 -2.396
160 HB1 ALA 25 HB1 ALA 25 18.721 -7.653 -2.651
161 HB2 ALA 25 HB2 ALA 25 17.979 -7.718 -1.054
162 HB3 ALA 25 HB3 ALA 25 17.472 -8.850 -2.307
163 H LEU 26 HN LEU 26 14.506 -6.820 -3.631
164 HA LEU 26 HA LEU 26 15.481 -7.236 -6.363
165 HB2 LEU 26 HB2 LEU 26 12.811 -8.007 -5.191
166 HB3 LEU 26 HB3 LEU 26 13.313 -8.269 -6.849
167 HG LEU 26 HG LEU 26 14.639 -9.543 -4.457
168 HD11 LEU 26 HD11 LEU 26 12.640 -10.681 -6.402
169 HD12 LEU 26 HD12 LEU 26 13.487 -11.579 -5.143
170 HD13 LEU 26 HD13 LEU 26 12.342 -10.316 -4.703
171 HD21 LEU 26 HD21 LEU 26 15.669 -10.996 -6.127
172 HD22 LEU 26 HD22 LEU 26 14.878 -10.083 -7.413
173 HD23 LEU 26 HD23 LEU 26 16.094 -9.305 -6.402
174 H ASP 27 HN ASP 27 14.449 -5.038 -4.308
175 HA ASP 27 HA ASP 27 13.727 -2.905 -4.498
176 HB2 ASP 27 HB2 ASP 27 15.174 -3.190 -6.661
177 HB3 ASP 27 HB3 ASP 27 13.618 -3.123 -7.483
178 H LYS 28 HN LYS 28 11.904 -4.468 -3.765
179 HA LYS 28 HA LYS 28 9.562 -4.324 -5.523
180 HB2 LYS 28 HB2 LYS 28 9.814 -5.732 -2.861
181 HB3 LYS 28 HB3 LYS 28 8.566 -5.965 -4.076
182 HG2 LYS 28 HG2 LYS 28 11.444 -6.581 -4.656
183 HG3 LYS 28 HG3 LYS 28 10.368 -7.754 -3.894
184 HD2 LYS 28 HD2 LYS 28 9.744 -6.393 -6.511
185 HD3 LYS 28 HD3 LYS 28 10.591 -7.937 -6.402
186 HE2 LYS 28 HE2 LYS 28 7.872 -7.417 -5.205
187 HE3 LYS 28 HE3 LYS 28 8.124 -8.116 -6.803
188 HZ1 LYS 28 HZ1 LYS 28 9.086 -9.294 -4.238
189 HZ2 LYS 28 HZ2 LYS 28 9.281 -9.969 -5.785
190 HZ3 LYS 28 HZ3 LYS 28 7.732 -9.816 -5.122
191 H TYR 29 HN TYR 29 7.581 -3.521 -4.738
192 HA TYR 29 HA TYR 29 7.679 -1.799 -2.378
193 HB2 TYR 29 HB2 TYR 29 6.506 -0.831 -4.986
194 HB3 TYR 29 HB3 TYR 29 6.743 0.088 -3.513
195 HD1 TYR 29 HD2 TYR 29 9.498 -0.423 -2.832
196 HD2 TYR 29 HD1 TYR 29 7.753 0.200 -6.662
197 HE1 TYR 29 HE2 TYR 29 11.656 0.384 -3.672
198 HE2 TYR 29 HE1 TYR 29 9.917 1.003 -7.517
199 HH TYR 29 HH TYR 29 12.090 2.146 -6.251
200 H ALA 30 HN ALA 30 6.102 -2.861 -1.213
201 HA ALA 30 HA ALA 30 3.462 -3.015 -2.486
202 HB1 ALA 30 HB1 ALA 30 4.139 -5.022 -1.256
203 HB2 ALA 30 HB2 ALA 30 4.349 -4.059 0.205
204 HB3 ALA 30 HB3 ALA 30 2.745 -4.249 -0.501
205 H CYS 31 HN CYS 31 2.290 -1.227 -2.313
206 HA CYS 31 HA CYS 31 2.734 0.520 0.003
207 HB2 CYS 31 HB2 CYS 31 3.181 1.683 -2.068
208 HB3 CYS 31 HB3 CYS 31 1.643 1.156 -2.745
209 H ASN 32 HN ASN 32 1.150 0.826 1.406
210 HA ASN 32 HA ASN 32 -1.518 -0.148 0.696
211 HB2 ASN 32 HB2 ASN 32 -0.256 -1.838 2.020
212 HB3 ASN 32 HB3 ASN 32 -0.071 -0.650 3.305
213 HD21 ASN 32 HD21 ASN 32 -1.152 -1.801 4.831
214 HD22 ASN 32 HD22 ASN 32 -2.850 -2.104 4.774
215 H CYS 33 HN CYS 33 -2.654 1.600 0.574
216 HA CYS 33 HA CYS 33 -2.138 3.817 2.322
217 HB2 CYS 33 HB2 CYS 33 -3.979 3.412 -0.013
218 HB3 CYS 33 HB3 CYS 33 -4.089 4.846 1.001
219 H VAL 34 HN VAL 34 -5.469 2.985 1.467
220 HA VAL 34 HA VAL 34 -6.010 2.670 4.331
221 HB VAL 34 HB VAL 34 -6.350 5.062 3.651
222 HG11 VAL 34 HG11 VAL 34 -8.561 3.927 1.950
223 HG12 VAL 34 HG12 VAL 34 -8.286 5.639 2.277
224 HG13 VAL 34 HG13 VAL 34 -7.089 4.710 1.371
225 HG21 VAL 34 HG21 VAL 34 -8.828 3.568 4.507
226 HG22 VAL 34 HG22 VAL 34 -7.538 4.139 5.563
227 HG23 VAL 34 HG23 VAL 34 -8.555 5.298 4.707
228 H VAL 35 HN VAL 35 -7.929 1.509 4.762
229 HA VAL 35 HA VAL 35 -8.518 -0.490 2.873
230 HB VAL 35 HB VAL 35 -10.213 -1.274 4.469
231 HG11 VAL 35 HG11 VAL 35 -8.672 -1.733 6.319
232 HG12 VAL 35 HG12 VAL 35 -7.877 -1.903 4.755
233 HG13 VAL 35 HG13 VAL 35 -7.595 -0.466 5.734
234 HG21 VAL 35 HG21 VAL 35 -10.500 -0.130 6.627
235 HG22 VAL 35 HG22 VAL 35 -9.474 1.189 6.067
236 HG23 VAL 35 HG23 VAL 35 -11.030 0.892 5.291
237 H GLY 36 HN GLY 36 -9.057 0.760 1.081
238 HA2 GLY 36 HA1 GLY 36 -11.671 0.912 0.317
239 HA3 GLY 36 HA2 GLY 36 -11.336 2.494 1.021
240 H TYR 37 HN TYR 37 -8.441 1.907 0.150
241 HA TYR 37 HA TYR 37 -8.707 2.148 -2.750
242 HB2 TYR 37 HB2 TYR 37 -7.029 4.008 -1.047
243 HB3 TYR 37 HB3 TYR 37 -7.018 3.954 -2.802
244 HD1 TYR 37 HD1 TYR 37 -9.358 4.345 -3.931
245 HD2 TYR 37 HD2 TYR 37 -8.358 5.581 0.011
246 HE1 TYR 37 HE1 TYR 37 -11.178 5.992 -3.996
247 HE2 TYR 37 HE2 TYR 37 -10.177 7.237 -0.045
248 HH TYR 37 HH TYR 37 -11.474 8.498 -1.791
249 H ILE 38 HN ILE 38 -7.642 0.254 -3.323
250 HA ILE 38 HA ILE 38 -4.779 0.545 -3.007
251 HB ILE 38 HB ILE 38 -5.904 -1.252 -1.369
252 HG12 ILE 38 HG12 ILE 38 -3.592 -0.375 -1.410
253 HG13 ILE 38 HG13 ILE 38 -3.676 -2.094 -1.023
254 HG21 ILE 38 HG21 ILE 38 -5.439 -3.509 -2.174
255 HG22 ILE 38 HG22 ILE 38 -6.684 -2.722 -3.145
256 HG23 ILE 38 HG23 ILE 38 -5.038 -2.857 -3.764
257 HD11 ILE 38 HD11 ILE 38 -1.826 -1.651 -2.510
258 HD12 ILE 38 HD12 ILE 38 -3.046 -2.612 -3.348
259 HD13 ILE 38 HD13 ILE 38 -2.908 -0.883 -3.673
260 H GLY 39 HN GLY 39 -3.901 0.562 -4.916
261 HA2 GLY 39 HA1 GLY 39 -4.420 -1.440 -6.883
262 HA3 GLY 39 HA2 GLY 39 -5.121 0.114 -7.343
263 H GLU 40 HN GLU 40 -2.294 -1.752 -7.168
264 HA GLU 40 HA GLU 40 -0.173 -1.426 -7.880
265 HB2 GLU 40 HB2 GLU 40 -0.711 0.017 -9.692
266 HB3 GLU 40 HB3 GLU 40 -1.213 1.308 -8.609
267 HG2 GLU 40 HG2 GLU 40 1.176 1.464 -7.844
268 HG3 GLU 40 HG3 GLU 40 1.583 0.357 -9.161
269 H ARG 41 HN ARG 41 -1.574 1.233 -6.180
270 HA ARG 41 HA ARG 41 0.177 0.755 -3.967
271 HB2 ARG 41 HB2 ARG 41 0.383 3.469 -4.038
272 HB3 ARG 41 HB3 ARG 41 1.575 2.315 -4.618
273 HG2 ARG 41 HG2 ARG 41 1.380 3.862 -6.337
274 HG3 ARG 41 HG3 ARG 41 0.479 2.446 -6.858
275 HD2 ARG 41 HD2 ARG 41 -1.590 3.659 -5.998
276 HD3 ARG 41 HD3 ARG 41 -0.572 5.101 -5.953
277 HE ARG 41 HE ARG 41 -0.882 3.506 -8.416
278 HH11 ARG 41 HH12 ARG 41 -1.055 6.599 -6.773
279 HH12 ARG 41 HH11 ARG 41 -1.258 7.499 -8.241
280 HH21 ARG 41 HH22 ARG 41 -1.129 4.676 -10.317
281 HH22 ARG 41 HH21 ARG 41 -1.325 6.408 -10.262
282 H CYS 42 HN CYS 42 -2.691 2.259 -5.224
283 HA CYS 42 HA CYS 42 -4.413 1.613 -3.393
284 HB2 CYS 42 HB2 CYS 42 -4.691 3.439 -1.774
285 HB3 CYS 42 HB3 CYS 42 -3.197 2.543 -1.546
286 H GLN 43 HN GLN 43 -5.902 1.783 -4.898
287 HA GLN 43 HA GLN 43 -7.331 4.201 -4.947
288 HB2 GLN 43 HB2 GLN 43 -7.054 4.968 -7.229
289 HB3 GLN 43 HB3 GLN 43 -5.511 4.985 -6.375
290 HG2 GLN 43 HG2 GLN 43 -4.870 2.911 -7.496
291 HG3 GLN 43 HG3 GLN 43 -6.418 2.882 -8.339
292 HE21 GLN 43 HE21 GLN 43 -3.783 2.938 -9.492
293 HE22 GLN 43 HE22 GLN 43 -3.688 4.381 -10.439
294 H TYR 44 HN TYR 44 -7.422 1.100 -4.986
295 HA TYR 44 HA TYR 44 -9.942 1.004 -6.434
296 HB2 TYR 44 HB2 TYR 44 -7.590 -0.832 -6.882
297 HB3 TYR 44 HB3 TYR 44 -9.238 -1.326 -7.257
298 HD1 TYR 44 HD1 TYR 44 -10.517 0.034 -8.990
299 HD2 TYR 44 HD2 TYR 44 -6.317 0.412 -8.411
300 HE1 TYR 44 HE1 TYR 44 -10.309 1.080 -11.202
301 HE2 TYR 44 HE2 TYR 44 -6.102 1.461 -10.623
302 HH TYR 44 HH TYR 44 -7.321 1.552 -12.750
303 H ARG 45 HN ARG 45 -11.256 0.635 -4.788
304 HA ARG 45 HA ARG 45 -12.456 -0.794 -3.482
305 HB2 ARG 45 HB2 ARG 45 -10.289 -2.752 -4.203
306 HB3 ARG 45 HB3 ARG 45 -11.849 -3.176 -3.488
307 HG2 ARG 45 HG2 ARG 45 -12.712 -3.383 -5.519
308 HG3 ARG 45 HG3 ARG 45 -12.322 -1.695 -5.870
309 HD2 ARG 45 HD2 ARG 45 -10.030 -2.391 -6.493
310 HD3 ARG 45 HD3 ARG 45 -10.500 -4.073 -6.233
311 HE ARG 45 HE ARG 45 -12.332 -3.130 -8.018
312 HH11 ARG 45 HH12 ARG 45 -8.833 -3.427 -7.935
313 HH12 ARG 45 HH11 ARG 45 -8.672 -3.455 -9.667
314 HH21 ARG 45 HH22 ARG 45 -12.124 -3.192 -10.279
315 HH22 ARG 45 HH21 ARG 45 -10.543 -3.343 -11.003
316 H ASP 46 HN ASP 46 -12.241 -2.295 -1.605
317 HA ASP 46 HA ASP 46 -10.042 -1.479 0.153
318 HB2 ASP 46 HB2 ASP 46 -11.867 -2.030 1.975
319 HB3 ASP 46 HB3 ASP 46 -11.817 -0.451 1.204
320 H LEU 47 HN LEU 47 -9.547 -3.534 -1.367
321 HA LEU 47 HA LEU 47 -10.315 -6.088 -0.827
322 HB2 LEU 47 HB2 LEU 47 -7.517 -5.060 -1.291
323 HB3 LEU 47 HB3 LEU 47 -7.935 -6.759 -1.296
324 HG LEU 47 HG LEU 47 -9.567 -6.157 -3.195
325 HD11 LEU 47 HD11 LEU 47 -9.507 -3.744 -2.919
326 HD12 LEU 47 HD12 LEU 47 -7.777 -3.737 -3.265
327 HD13 LEU 47 HD13 LEU 47 -8.925 -4.208 -4.517
328 HD21 LEU 47 HD21 LEU 47 -6.591 -5.956 -3.643
329 HD22 LEU 47 HD22 LEU 47 -7.519 -7.451 -3.509
330 HD23 LEU 47 HD23 LEU 47 -7.798 -6.356 -4.864
331 H LYS 48 HN LYS 48 -8.262 -4.053 1.093
332 HA LYS 48 HA LYS 48 -7.050 -6.058 2.650
333 HB2 LYS 48 HB2 LYS 48 -6.790 -3.881 4.209
334 HB3 LYS 48 HB3 LYS 48 -5.787 -4.185 2.797
335 HG2 LYS 48 HG2 LYS 48 -8.344 -2.725 2.425
336 HG3 LYS 48 HG3 LYS 48 -6.983 -1.857 3.167
337 HD2 LYS 48 HD2 LYS 48 -5.809 -3.118 1.013
338 HD3 LYS 48 HD3 LYS 48 -7.403 -2.699 0.394
339 HE2 LYS 48 HE2 LYS 48 -5.536 -1.017 0.034
340 HE3 LYS 48 HE3 LYS 48 -7.034 -0.374 0.694
341 HZ1 LYS 48 HZ1 LYS 48 -5.193 0.515 1.899
342 HZ2 LYS 48 HZ2 LYS 48 -4.532 -1.013 2.172
343 HZ3 LYS 48 HZ3 LYS 48 -5.979 -0.568 2.929
344 H TRP 49 HN TRP 49 -9.716 -3.817 3.427
345 HA TRP 49 HA TRP 49 -10.213 -5.392 5.835
346 HB2 TRP 49 HB2 TRP 49 -10.006 -3.044 6.269
347 HB3 TRP 49 HB3 TRP 49 -11.189 -2.656 5.026
348 HD1 TRP 49 HD1 TRP 49 -11.232 -4.835 8.261
349 HE1 TRP 49 HE1 TRP 49 -13.452 -4.370 9.482
350 HE3 TRP 49 HE3 TRP 49 -13.265 -1.467 4.987
351 HZ2 TRP 49 HZ2 TRP 49 -15.755 -2.789 9.098
352 HZ3 TRP 49 HZ3 TRP 49 -15.483 -0.528 5.492
353 HH2 TRP 49 HH2 TRP 49 -16.699 -1.176 7.506
354 H TRP 50 HN TRP 50 -12.080 -4.054 3.086
355 HA TRP 50 HA TRP 50 -14.385 -5.458 4.219
356 HB2 TRP 50 HB2 TRP 50 -14.447 -2.973 3.937
357 HB3 TRP 50 HB3 TRP 50 -14.442 -3.236 2.197
358 HD1 TRP 50 HD1 TRP 50 -16.789 -3.068 1.216
359 HE1 TRP 50 HE1 TRP 50 -19.179 -3.606 2.012
360 HE3 TRP 50 HE3 TRP 50 -15.705 -4.861 5.884
361 HZ2 TRP 50 HZ2 TRP 50 -20.430 -4.657 4.309
362 HZ3 TRP 50 HZ3 TRP 50 -17.559 -5.610 7.317
363 HH2 TRP 50 HH2 TRP 50 -19.872 -5.509 6.545
364 H GLU 51 HN GLU 51 -12.662 -5.052 1.135
365 HA GLU 51 HA GLU 51 -14.671 -6.398 -0.371
366 HB2 GLU 51 HB2 GLU 51 -11.833 -5.621 -0.999
367 HB3 GLU 51 HB3 GLU 51 -12.816 -6.540 -2.133
368 HG2 GLU 51 HG2 GLU 51 -13.487 -3.852 -0.998
369 HG3 GLU 51 HG3 GLU 51 -12.812 -4.145 -2.601
370 H LEU 52 HN LEU 52 -11.395 -7.386 0.578
371 HA LEU 52 HA LEU 52 -12.056 -10.110 -0.230
372 HB2 LEU 52 HB2 LEU 52 -9.425 -9.054 0.749
373 HB3 LEU 52 HB3 LEU 52 -9.711 -10.579 -0.072
374 HG LEU 52 HG LEU 52 -9.877 -7.810 -1.233
375 HD11 LEU 52 HD11 LEU 52 -7.622 -8.689 -0.966
376 HD12 LEU 52 HD12 LEU 52 -8.082 -10.173 -1.803
377 HD13 LEU 52 HD13 LEU 52 -8.062 -8.640 -2.674
378 HD21 LEU 52 HD21 LEU 52 -11.665 -9.174 -2.174
379 HD22 LEU 52 HD22 LEU 52 -10.398 -8.914 -3.372
380 HD23 LEU 52 HD23 LEU 52 -10.518 -10.463 -2.536
381 H ARG 53 HN ARG 53 -11.068 -8.254 2.588
382 HA ARG 53 HA ARG 53 -10.717 -10.625 4.190
383 HB2 ARG 53 HB2 ARG 53 -9.534 -8.546 4.715
384 HB3 ARG 53 HB3 ARG 53 -11.064 -7.766 5.087
385 HG2 ARG 53 HG2 ARG 53 -9.901 -8.416 7.111
386 HG3 ARG 53 HG3 ARG 53 -11.412 -9.311 6.941
387 HD2 ARG 53 HD2 ARG 53 -9.720 -10.835 7.673
388 HD3 ARG 53 HD3 ARG 53 -10.106 -11.208 5.995
389 HE ARG 53 HE ARG 53 -7.971 -9.513 5.838
390 HH11 ARG 53 HH12 ARG 53 -8.581 -12.550 7.485
391 HH12 ARG 53 HH11 ARG 53 -6.919 -13.065 7.409
392 HH21 ARG 53 HH22 ARG 53 -5.795 -10.199 5.721
393 HH22 ARG 53 HH21 ARG 53 -5.333 -11.728 6.419
Start of MODEL 4
1 H1 ASN 1 H1 ASN 1 14.305 -11.917 3.384
2 H2 ASN 1 H2 ASN 1 13.588 -12.730 4.686
3 H3 ASN 1 H3 ASN 1 15.205 -12.246 4.781
4 HA ASN 1 HA ASN 1 13.807 -10.795 6.078
5 HB2 ASN 1 HB2 ASN 1 14.985 -9.582 3.571
6 HB3 ASN 1 HB3 ASN 1 14.414 -8.623 4.932
7 HD21 ASN 1 HD21 ASN 1 16.388 -7.777 5.432
8 HD22 ASN 1 HD22 ASN 1 17.679 -8.717 6.104
9 H SER 2 HN SER 2 12.551 -8.549 5.426
10 HA SER 2 HA SER 2 10.489 -8.887 3.498
11 HB2 SER 2 HB2 SER 2 9.854 -10.567 5.308
12 HB3 SER 2 HB3 SER 2 9.626 -9.187 6.382
13 HG SER 2 HG SER 2 8.286 -9.583 3.896
14 H ASP 3 HN ASP 3 11.369 -6.809 3.090
15 HA ASP 3 HA ASP 3 11.592 -4.561 3.204
16 HB2 ASP 3 HB2 ASP 3 9.104 -4.690 3.328
17 HB3 ASP 3 HB3 ASP 3 9.226 -4.645 5.084
18 H SER 4 HN SER 4 13.534 -4.316 4.178
19 HA SER 4 HA SER 4 13.697 -4.460 7.085
20 HB2 SER 4 HB2 SER 4 15.897 -4.108 5.036
21 HB3 SER 4 HB3 SER 4 16.119 -4.421 6.758
22 HG SER 4 HG SER 4 14.583 -6.341 6.050
23 H GLU 5 HN GLU 5 13.168 -2.121 4.762
24 HA GLU 5 HA GLU 5 13.350 0.068 6.507
25 HB2 GLU 5 HB2 GLU 5 15.772 -0.222 6.306
26 HB3 GLU 5 HB3 GLU 5 15.648 -0.213 4.552
27 HG2 GLU 5 HG2 GLU 5 16.479 1.907 5.350
28 HG3 GLU 5 HG3 GLU 5 14.890 2.109 4.618
29 H CYS 6 HN CYS 6 12.573 1.988 5.523
30 HA CYS 6 HA CYS 6 12.148 2.013 2.671
31 HB2 CYS 6 HB2 CYS 6 9.711 2.247 2.791
32 HB3 CYS 6 HB3 CYS 6 10.239 0.683 3.396
33 HA PRO 7 HA PRO 7 12.700 6.385 3.706
34 HB2 PRO 7 HB2 PRO 7 12.434 6.509 0.757
35 HB3 PRO 7 HB3 PRO 7 13.700 7.169 1.797
36 HG2 PRO 7 HG2 PRO 7 14.157 5.033 0.261
37 HG3 PRO 7 HG3 PRO 7 14.860 5.168 1.883
38 HD2 PRO 7 HD2 PRO 7 12.504 3.570 0.965
39 HD3 PRO 7 HD3 PRO 7 13.782 3.133 2.117
40 H LEU 8 HN LEU 8 11.247 8.144 3.536
41 HA LEU 8 HA LEU 8 8.526 7.376 3.587
42 HB2 LEU 8 HB2 LEU 8 8.072 9.786 3.880
43 HB3 LEU 8 HB3 LEU 8 9.218 9.124 5.022
44 HG LEU 8 HG LEU 8 11.005 10.095 3.382
45 HD11 LEU 8 HD11 LEU 8 8.602 11.784 2.699
46 HD12 LEU 8 HD12 LEU 8 10.271 12.123 2.238
47 HD13 LEU 8 HD13 LEU 8 9.454 10.698 1.599
48 HD21 LEU 8 HD21 LEU 8 10.942 12.220 4.601
49 HD22 LEU 8 HD22 LEU 8 9.314 11.840 5.168
50 HD23 LEU 8 HD23 LEU 8 10.678 10.841 5.669
51 H SER 9 HN SER 9 10.382 7.829 0.965
52 HA SER 9 HA SER 9 8.637 9.337 -0.705
53 HB2 SER 9 HB2 SER 9 10.921 7.508 -1.500
54 HB3 SER 9 HB3 SER 9 10.186 8.770 -2.487
55 HG SER 9 HG SER 9 11.973 9.704 -1.644
56 H HIS 10 HN HIS 10 9.006 6.058 0.304
57 HA HIS 10 HA HIS 10 7.344 5.013 -1.813
58 HB2 HIS 10 HB2 HIS 10 9.183 3.684 -0.703
59 HB3 HIS 10 HB3 HIS 10 8.181 3.628 0.741
60 HD1 HIS 10 HD1 HIS 10 8.712 1.989 -2.527
61 HD2 HIS 10 HD2 HIS 10 5.761 2.080 0.416
62 HE1 HIS 10 HE1 HIS 10 7.231 0.012 -2.982
63 HE2 HIS 10 HE2 HIS 10 5.504 0.029 -1.143
64 H ASP 11 HN ASP 11 7.074 6.170 1.418
65 HA ASP 11 HA ASP 11 4.383 5.331 1.919
66 HB2 ASP 11 HB2 ASP 11 5.914 5.844 3.760
67 HB3 ASP 11 HB3 ASP 11 6.108 7.489 3.174
68 H GLY 12 HN GLY 12 5.980 8.290 0.887
69 HA2 GLY 12 HA1 GLY 12 3.580 9.765 0.416
70 HA3 GLY 12 HA2 GLY 12 5.201 10.216 -0.094
71 H TYR 13 HN TYR 13 5.423 7.478 -1.407
72 HA TYR 13 HA TYR 13 4.373 8.091 -3.973
73 HB2 TYR 13 HB2 TYR 13 6.279 6.540 -3.616
74 HB3 TYR 13 HB3 TYR 13 5.181 5.380 -2.882
75 HD1 TYR 13 HD2 TYR 13 5.955 7.139 -6.060
76 HD2 TYR 13 HD1 TYR 13 3.945 3.875 -4.217
77 HE1 TYR 13 HE2 TYR 13 5.473 6.187 -8.276
78 HE2 TYR 13 HE1 TYR 13 3.456 2.923 -6.425
79 HH TYR 13 HH TYR 13 4.970 3.934 -9.248
80 H CYS 14 HN CYS 14 2.992 6.772 -1.156
81 HA CYS 14 HA CYS 14 0.673 5.732 -2.583
82 HB2 CYS 14 HB2 CYS 14 1.897 5.312 0.009
83 HB3 CYS 14 HB3 CYS 14 0.169 5.649 0.154
84 H LEU 15 HN LEU 15 -1.472 6.385 -1.128
85 HA LEU 15 HA LEU 15 -1.476 9.287 -1.575
86 HB2 LEU 15 HB2 LEU 15 -3.805 7.448 -2.037
87 HB3 LEU 15 HB3 LEU 15 -3.668 9.133 -2.501
88 HG LEU 15 HG LEU 15 -2.147 6.807 -3.673
89 HD11 LEU 15 HD11 LEU 15 -4.222 8.666 -4.847
90 HD12 LEU 15 HD12 LEU 15 -3.375 7.384 -5.712
91 HD13 LEU 15 HD13 LEU 15 -4.478 6.980 -4.398
92 HD21 LEU 15 HD21 LEU 15 -1.990 9.746 -4.352
93 HD22 LEU 15 HD22 LEU 15 -0.725 8.788 -3.583
94 HD23 LEU 15 HD23 LEU 15 -1.211 8.438 -5.242
95 H HIS 16 HN HIS 16 -3.345 6.730 0.125
96 HA HIS 16 HA HIS 16 -4.156 8.925 1.935
97 HB2 HIS 16 HB2 HIS 16 -5.833 6.811 0.658
98 HB3 HIS 16 HB3 HIS 16 -6.301 7.451 2.229
99 HD1 HIS 16 HD1 HIS 16 -6.650 10.127 2.312
100 HD2 HIS 16 HD2 HIS 16 -6.571 8.377 -1.467
101 HE1 HIS 16 HE1 HIS 16 -7.700 11.806 0.757
102 HE2 HIS 16 HE2 HIS 16 -7.695 10.712 -1.514
103 H ASP 17 HN ASP 17 -1.996 7.082 2.230
104 HA ASP 17 HA ASP 17 -2.035 6.739 4.934
105 HB2 ASP 17 HB2 ASP 17 -3.842 5.001 4.381
106 HB3 ASP 17 HB3 ASP 17 -2.538 4.033 3.699
107 H GLY 18 HN GLY 18 -1.117 4.814 2.096
108 HA2 GLY 18 HA1 GLY 18 0.869 3.850 1.497
109 HA3 GLY 18 HA2 GLY 18 1.622 5.252 2.229
110 H VAL 19 HN VAL 19 2.001 2.178 2.061
111 HA VAL 19 HA VAL 19 3.374 2.019 4.615
112 HB VAL 19 HB VAL 19 1.253 0.005 3.821
113 HG11 VAL 19 HG11 VAL 19 3.283 -1.277 4.255
114 HG12 VAL 19 HG12 VAL 19 3.502 -0.432 5.788
115 HG13 VAL 19 HG13 VAL 19 2.116 -1.499 5.561
116 HG21 VAL 19 HG21 VAL 19 0.540 0.255 6.140
117 HG22 VAL 19 HG22 VAL 19 1.866 1.379 6.435
118 HG23 VAL 19 HG23 VAL 19 0.572 1.815 5.319
119 H CYS 20 HN CYS 20 5.170 0.534 4.512
120 HA CYS 20 HA CYS 20 5.972 0.135 1.718
121 HB2 CYS 20 HB2 CYS 20 8.303 0.160 2.717
122 HB3 CYS 20 HB3 CYS 20 7.404 1.672 2.789
123 H MET 21 HN MET 21 5.759 -1.886 1.034
124 HA MET 21 HA MET 21 7.292 -3.937 2.459
125 HB2 MET 21 HB2 MET 21 4.608 -4.455 1.200
126 HB3 MET 21 HB3 MET 21 5.629 -5.649 1.968
127 HG2 MET 21 HG2 MET 21 4.424 -3.307 3.411
128 HG3 MET 21 HG3 MET 21 3.673 -4.901 3.323
129 HE1 MET 21 HE1 MET 21 6.419 -7.110 5.113
130 HE2 MET 21 HE2 MET 21 4.872 -7.131 4.268
131 HE3 MET 21 HE3 MET 21 6.346 -6.730 3.392
132 H TYR 22 HN TYR 22 8.902 -4.165 0.951
133 HA TYR 22 HA TYR 22 8.267 -5.057 -1.630
134 HB2 TYR 22 HB2 TYR 22 9.512 -3.311 -2.761
135 HB3 TYR 22 HB3 TYR 22 8.039 -2.731 -2.045
136 HD1 TYR 22 HD1 TYR 22 8.445 -1.809 0.466
137 HD2 TYR 22 HD2 TYR 22 11.367 -1.920 -2.621
138 HE1 TYR 22 HE1 TYR 22 9.689 -0.008 1.582
139 HE2 TYR 22 HE2 TYR 22 12.612 -0.119 -1.512
140 HH TYR 22 HH TYR 22 11.976 1.815 0.100
141 H ILE 23 HN ILE 23 11.134 -3.520 -0.349
142 HA ILE 23 HA ILE 23 12.901 -5.435 -1.410
143 HB ILE 23 HB ILE 23 14.562 -4.492 0.265
144 HG12 ILE 23 HG12 ILE 23 12.568 -2.317 0.693
145 HG13 ILE 23 HG13 ILE 23 12.472 -3.786 1.669
146 HG21 ILE 23 HG21 ILE 23 13.156 -2.606 -1.614
147 HG22 ILE 23 HG22 ILE 23 14.772 -2.372 -0.951
148 HG23 ILE 23 HG23 ILE 23 14.451 -3.724 -2.036
149 HD11 ILE 23 HD11 ILE 23 14.861 -1.957 1.438
150 HD12 ILE 23 HD12 ILE 23 13.741 -2.031 2.798
151 HD13 ILE 23 HD13 ILE 23 14.772 -3.415 2.426
152 H GLU 24 HN GLU 24 12.293 -7.463 -0.850
153 HA GLU 24 HA GLU 24 12.455 -8.194 2.003
154 HB2 GLU 24 HB2 GLU 24 10.822 -9.338 -0.268
155 HB3 GLU 24 HB3 GLU 24 10.959 -10.109 1.320
156 HG2 GLU 24 HG2 GLU 24 10.108 -7.918 2.291
157 HG3 GLU 24 HG3 GLU 24 9.680 -7.478 0.645
158 H ALA 25 HN ALA 25 14.141 -8.254 -0.742
159 HA ALA 25 HA ALA 25 15.604 -9.584 -1.845
160 HB1 ALA 25 HB1 ALA 25 16.632 -11.511 -0.703
161 HB2 ALA 25 HB2 ALA 25 16.655 -10.060 0.299
162 HB3 ALA 25 HB3 ALA 25 15.478 -11.330 0.617
163 H LEU 26 HN LEU 26 12.522 -10.168 -1.270
164 HA LEU 26 HA LEU 26 12.385 -12.631 -2.835
165 HB2 LEU 26 HB2 LEU 26 10.138 -11.135 -1.475
166 HB3 LEU 26 HB3 LEU 26 10.040 -12.721 -2.213
167 HG LEU 26 HG LEU 26 11.594 -12.031 0.283
168 HD11 LEU 26 HD11 LEU 26 9.926 -13.439 1.406
169 HD12 LEU 26 HD12 LEU 26 9.196 -12.021 0.655
170 HD13 LEU 26 HD13 LEU 26 9.051 -13.602 -0.117
171 HD21 LEU 26 HD21 LEU 26 11.998 -14.419 0.470
172 HD22 LEU 26 HD22 LEU 26 11.153 -14.698 -1.054
173 HD23 LEU 26 HD23 LEU 26 12.668 -13.795 -1.039
174 H ASP 27 HN ASP 27 12.406 -9.360 -2.901
175 HA ASP 27 HA ASP 27 12.563 -7.957 -4.687
176 HB2 ASP 27 HB2 ASP 27 13.291 -10.007 -5.990
177 HB3 ASP 27 HB3 ASP 27 11.610 -10.205 -6.475
178 H LYS 28 HN LYS 28 10.689 -7.552 -3.125
179 HA LYS 28 HA LYS 28 8.128 -7.807 -4.537
180 HB2 LYS 28 HB2 LYS 28 8.689 -7.223 -1.629
181 HB3 LYS 28 HB3 LYS 28 7.094 -7.427 -2.341
182 HG2 LYS 28 HG2 LYS 28 9.116 -9.624 -2.588
183 HG3 LYS 28 HG3 LYS 28 8.240 -9.392 -1.074
184 HD2 LYS 28 HD2 LYS 28 7.041 -11.003 -2.379
185 HD3 LYS 28 HD3 LYS 28 6.100 -9.516 -2.338
186 HE2 LYS 28 HE2 LYS 28 5.978 -10.269 -4.559
187 HE3 LYS 28 HE3 LYS 28 7.163 -8.963 -4.576
188 HZ1 LYS 28 HZ1 LYS 28 7.934 -10.833 -5.868
189 HZ2 LYS 28 HZ2 LYS 28 7.764 -11.875 -4.539
190 HZ3 LYS 28 HZ3 LYS 28 8.924 -10.641 -4.507
191 H TYR 29 HN TYR 29 6.595 -5.998 -3.886
192 HA TYR 29 HA TYR 29 7.490 -3.350 -3.710
193 HB2 TYR 29 HB2 TYR 29 6.667 -2.686 -6.060
194 HB3 TYR 29 HB3 TYR 29 8.283 -3.401 -5.948
195 HD1 TYR 29 HD2 TYR 29 8.525 -5.879 -6.532
196 HD2 TYR 29 HD1 TYR 29 5.027 -3.639 -7.445
197 HE1 TYR 29 HE2 TYR 29 7.887 -7.560 -8.205
198 HE2 TYR 29 HE1 TYR 29 4.381 -5.319 -9.119
199 HH TYR 29 HH TYR 29 5.658 -7.059 -10.564
200 H ALA 30 HN ALA 30 5.863 -2.948 -2.362
201 HA ALA 30 HA ALA 30 3.192 -2.873 -3.458
202 HB1 ALA 30 HB1 ALA 30 3.309 -5.153 -2.591
203 HB2 ALA 30 HB2 ALA 30 3.825 -4.539 -1.020
204 HB3 ALA 30 HB3 ALA 30 2.207 -4.171 -1.622
205 H CYS 31 HN CYS 31 1.775 -1.664 -2.188
206 HA CYS 31 HA CYS 31 2.916 -0.251 0.084
207 HB2 CYS 31 HB2 CYS 31 3.149 1.149 -2.024
208 HB3 CYS 31 HB3 CYS 31 1.390 1.168 -2.111
209 H ASN 32 HN ASN 32 1.435 0.027 1.677
210 HA ASN 32 HA ASN 32 -1.197 -1.110 1.098
211 HB2 ASN 32 HB2 ASN 32 0.225 -2.495 2.602
212 HB3 ASN 32 HB3 ASN 32 0.305 -1.149 3.732
213 HD21 ASN 32 HD21 ASN 32 -0.686 -2.266 5.377
214 HD22 ASN 32 HD22 ASN 32 -2.367 -2.665 5.356
215 H CYS 33 HN CYS 33 -2.319 0.638 0.721
216 HA CYS 33 HA CYS 33 -1.991 3.028 2.216
217 HB2 CYS 33 HB2 CYS 33 -2.413 2.711 -0.242
218 HB3 CYS 33 HB3 CYS 33 -4.041 2.238 0.172
219 H VAL 34 HN VAL 34 -5.209 2.987 1.659
220 HA VAL 34 HA VAL 34 -5.716 2.051 4.406
221 HB VAL 34 HB VAL 34 -5.858 4.529 4.157
222 HG11 VAL 34 HG11 VAL 34 -8.133 3.905 2.291
223 HG12 VAL 34 HG12 VAL 34 -7.736 5.503 2.922
224 HG13 VAL 34 HG13 VAL 34 -6.599 4.665 1.868
225 HG21 VAL 34 HG21 VAL 34 -7.145 3.425 5.894
226 HG22 VAL 34 HG22 VAL 34 -8.042 4.798 5.244
227 HG23 VAL 34 HG23 VAL 34 -8.473 3.156 4.767
228 H VAL 35 HN VAL 35 -7.704 0.951 4.745
229 HA VAL 35 HA VAL 35 -8.718 -0.523 2.584
230 HB VAL 35 HB VAL 35 -9.078 -1.495 4.665
231 HG11 VAL 35 HG11 VAL 35 -8.875 0.501 6.057
232 HG12 VAL 35 HG12 VAL 35 -10.488 1.015 5.562
233 HG13 VAL 35 HG13 VAL 35 -10.287 -0.449 6.522
234 HG21 VAL 35 HG21 VAL 35 -10.960 -1.832 3.179
235 HG22 VAL 35 HG22 VAL 35 -11.503 -1.772 4.855
236 HG23 VAL 35 HG23 VAL 35 -11.735 -0.377 3.803
237 H GLY 36 HN GLY 36 -9.186 0.747 0.932
238 HA2 GLY 36 HA1 GLY 36 -11.622 1.571 0.279
239 HA3 GLY 36 HA2 GLY 36 -11.081 2.935 1.257
240 H TYR 37 HN TYR 37 -8.257 2.156 0.293
241 HA TYR 37 HA TYR 37 -8.489 2.867 -2.533
242 HB2 TYR 37 HB2 TYR 37 -6.692 4.371 -0.610
243 HB3 TYR 37 HB3 TYR 37 -6.725 4.576 -2.352
244 HD1 TYR 37 HD1 TYR 37 -8.520 5.801 -3.431
245 HD2 TYR 37 HD2 TYR 37 -8.440 5.315 0.793
246 HE1 TYR 37 HE1 TYR 37 -10.229 7.546 -3.206
247 HE2 TYR 37 HE2 TYR 37 -10.155 7.062 1.032
248 HH TYR 37 HH TYR 37 -11.105 8.900 -0.148
249 H ILE 38 HN ILE 38 -7.649 0.827 -3.134
250 HA ILE 38 HA ILE 38 -4.762 1.068 -3.084
251 HB ILE 38 HB ILE 38 -5.684 -0.782 -1.422
252 HG12 ILE 38 HG12 ILE 38 -3.276 -0.496 -3.126
253 HG13 ILE 38 HG13 ILE 38 -3.463 -0.399 -1.377
254 HG21 ILE 38 HG21 ILE 38 -5.427 -2.273 -4.029
255 HG22 ILE 38 HG22 ILE 38 -5.561 -3.011 -2.432
256 HG23 ILE 38 HG23 ILE 38 -6.903 -2.072 -3.085
257 HD11 ILE 38 HD11 ILE 38 -3.402 -2.929 -3.010
258 HD12 ILE 38 HD12 ILE 38 -2.078 -2.289 -2.038
259 HD13 ILE 38 HD13 ILE 38 -3.564 -2.833 -1.257
260 H GLY 39 HN GLY 39 -3.919 0.914 -4.997
261 HA2 GLY 39 HA1 GLY 39 -4.995 -0.792 -7.048
262 HA3 GLY 39 HA2 GLY 39 -5.241 0.930 -7.358
263 H GLU 40 HN GLU 40 -3.121 -1.658 -7.513
264 HA GLU 40 HA GLU 40 -0.976 -1.920 -8.170
265 HB2 GLU 40 HB2 GLU 40 -1.342 -0.059 -9.776
266 HB3 GLU 40 HB3 GLU 40 -0.909 1.082 -8.505
267 HG2 GLU 40 HG2 GLU 40 0.985 0.781 -9.928
268 HG3 GLU 40 HG3 GLU 40 1.325 -0.003 -8.380
269 H ARG 41 HN ARG 41 -1.444 0.968 -6.285
270 HA ARG 41 HA ARG 41 0.158 -0.148 -4.153
271 HB2 ARG 41 HB2 ARG 41 1.341 2.135 -3.982
272 HB3 ARG 41 HB3 ARG 41 1.841 1.018 -5.265
273 HG2 ARG 41 HG2 ARG 41 1.715 3.099 -6.319
274 HG3 ARG 41 HG3 ARG 41 0.211 2.299 -6.769
275 HD2 ARG 41 HD2 ARG 41 -0.765 3.549 -4.708
276 HD3 ARG 41 HD3 ARG 41 0.658 4.577 -4.873
277 HE ARG 41 HE ARG 41 -1.438 4.235 -6.927
278 HH11 ARG 41 HH12 ARG 41 1.182 6.112 -5.540
279 HH12 ARG 41 HH11 ARG 41 0.833 7.523 -6.492
280 HH21 ARG 41 HH22 ARG 41 -1.909 6.103 -8.149
281 HH22 ARG 41 HH21 ARG 41 -0.929 7.532 -7.955
282 H CYS 42 HN CYS 42 -2.335 2.050 -5.176
283 HA CYS 42 HA CYS 42 -3.892 2.019 -2.943
284 HB2 CYS 42 HB2 CYS 42 -2.275 3.004 -1.502
285 HB3 CYS 42 HB3 CYS 42 -1.765 4.155 -2.731
286 H GLN 43 HN GLN 43 -5.534 2.282 -4.613
287 HA GLN 43 HA GLN 43 -6.584 4.842 -4.250
288 HB2 GLN 43 HB2 GLN 43 -6.533 5.833 -6.473
289 HB3 GLN 43 HB3 GLN 43 -4.916 5.623 -5.805
290 HG2 GLN 43 HG2 GLN 43 -4.737 3.523 -7.168
291 HG3 GLN 43 HG3 GLN 43 -6.254 3.976 -7.943
292 HE21 GLN 43 HE21 GLN 43 -6.298 5.834 -9.269
293 HE22 GLN 43 HE22 GLN 43 -4.846 6.500 -9.936
294 H TYR 44 HN TYR 44 -7.201 1.830 -4.634
295 HA TYR 44 HA TYR 44 -9.800 2.317 -5.859
296 HB2 TYR 44 HB2 TYR 44 -7.832 0.253 -6.837
297 HB3 TYR 44 HB3 TYR 44 -9.553 0.143 -7.162
298 HD1 TYR 44 HD1 TYR 44 -10.615 2.228 -8.325
299 HD2 TYR 44 HD2 TYR 44 -6.456 1.354 -8.337
300 HE1 TYR 44 HE1 TYR 44 -10.329 3.654 -10.305
301 HE2 TYR 44 HE2 TYR 44 -6.157 2.775 -10.322
302 HH TYR 44 HH TYR 44 -7.370 3.720 -12.109
303 H ARG 45 HN ARG 45 -11.145 1.788 -4.312
304 HA ARG 45 HA ARG 45 -12.541 0.255 -3.368
305 HB2 ARG 45 HB2 ARG 45 -10.488 -1.666 -4.438
306 HB3 ARG 45 HB3 ARG 45 -11.943 -2.200 -3.585
307 HG2 ARG 45 HG2 ARG 45 -12.752 -2.362 -5.685
308 HG3 ARG 45 HG3 ARG 45 -13.066 -0.641 -5.466
309 HD2 ARG 45 HD2 ARG 45 -11.989 -1.012 -7.599
310 HD3 ARG 45 HD3 ARG 45 -10.892 -0.134 -6.521
311 HE ARG 45 HE ARG 45 -9.924 -2.460 -6.087
312 HH11 ARG 45 HH12 ARG 45 -11.341 -1.491 -9.138
313 HH12 ARG 45 HH11 ARG 45 -10.318 -2.525 -10.091
314 HH21 ARG 45 HH22 ARG 45 -8.560 -3.813 -7.336
315 HH22 ARG 45 HH21 ARG 45 -8.718 -3.833 -9.066
316 H ASP 46 HN ASP 46 -12.658 -1.391 -1.680
317 HA ASP 46 HA ASP 46 -10.850 -0.683 0.510
318 HB2 ASP 46 HB2 ASP 46 -13.450 -2.237 0.601
319 HB3 ASP 46 HB3 ASP 46 -12.550 -1.629 1.982
320 H LEU 47 HN LEU 47 -9.996 -2.408 -1.595
321 HA LEU 47 HA LEU 47 -10.517 -5.081 -1.424
322 HB2 LEU 47 HB2 LEU 47 -7.875 -3.820 -2.137
323 HB3 LEU 47 HB3 LEU 47 -8.354 -5.463 -2.515
324 HG LEU 47 HG LEU 47 -9.623 -2.947 -3.603
325 HD11 LEU 47 HD11 LEU 47 -7.978 -5.084 -4.952
326 HD12 LEU 47 HD12 LEU 47 -8.714 -3.687 -5.735
327 HD13 LEU 47 HD13 LEU 47 -7.424 -3.458 -4.553
328 HD21 LEU 47 HD21 LEU 47 -10.268 -5.843 -4.131
329 HD22 LEU 47 HD22 LEU 47 -11.302 -4.670 -3.317
330 HD23 LEU 47 HD23 LEU 47 -10.918 -4.472 -5.028
331 H LYS 48 HN LYS 48 -8.052 -3.328 0.397
332 HA LYS 48 HA LYS 48 -6.631 -5.593 1.228
333 HB2 LYS 48 HB2 LYS 48 -5.855 -3.958 3.094
334 HB3 LYS 48 HB3 LYS 48 -5.391 -3.698 1.420
335 HG2 LYS 48 HG2 LYS 48 -7.251 -2.095 1.194
336 HG3 LYS 48 HG3 LYS 48 -7.601 -2.300 2.911
337 HD2 LYS 48 HD2 LYS 48 -6.253 -0.405 2.872
338 HD3 LYS 48 HD3 LYS 48 -5.127 -1.711 3.253
339 HE2 LYS 48 HE2 LYS 48 -5.566 -0.532 0.497
340 HE3 LYS 48 HE3 LYS 48 -4.229 -0.143 1.581
341 HZ1 LYS 48 HZ1 LYS 48 -3.563 -2.488 1.527
342 HZ2 LYS 48 HZ2 LYS 48 -3.521 -1.779 -0.008
343 HZ3 LYS 48 HZ3 LYS 48 -4.791 -2.818 0.401
344 H TRP 49 HN TRP 49 -8.948 -3.663 3.131
345 HA TRP 49 HA TRP 49 -8.897 -5.783 5.130
346 HB2 TRP 49 HB2 TRP 49 -8.495 -3.460 5.866
347 HB3 TRP 49 HB3 TRP 49 -10.101 -3.014 5.301
348 HD1 TRP 49 HD1 TRP 49 -8.455 -5.325 7.939
349 HE1 TRP 49 HE1 TRP 49 -10.064 -5.538 9.941
350 HE3 TRP 49 HE3 TRP 49 -12.424 -2.687 6.070
351 HZ2 TRP 49 HZ2 TRP 49 -12.666 -4.700 10.630
352 HZ3 TRP 49 HZ3 TRP 49 -14.435 -2.443 7.469
353 HH2 TRP 49 HH2 TRP 49 -14.550 -3.430 9.700
354 H TRP 50 HN TRP 50 -11.232 -3.985 3.117
355 HA TRP 50 HA TRP 50 -13.360 -5.511 4.429
356 HB2 TRP 50 HB2 TRP 50 -13.360 -2.955 4.304
357 HB3 TRP 50 HB3 TRP 50 -13.798 -3.161 2.610
358 HD1 TRP 50 HD1 TRP 50 -15.111 -4.759 5.897
359 HE1 TRP 50 HE1 TRP 50 -17.682 -4.656 5.863
360 HE3 TRP 50 HE3 TRP 50 -15.748 -2.400 1.413
361 HZ2 TRP 50 HZ2 TRP 50 -19.712 -3.690 4.147
362 HZ3 TRP 50 HZ3 TRP 50 -18.035 -1.919 0.648
363 HH2 TRP 50 HH2 TRP 50 -19.975 -2.552 1.988
364 H GLU 51 HN GLU 51 -12.329 -4.592 1.136
365 HA GLU 51 HA GLU 51 -14.539 -5.874 -0.103
366 HB2 GLU 51 HB2 GLU 51 -11.936 -4.779 -1.142
367 HB3 GLU 51 HB3 GLU 51 -13.045 -5.642 -2.199
368 HG2 GLU 51 HG2 GLU 51 -13.627 -3.152 -0.632
369 HG3 GLU 51 HG3 GLU 51 -13.300 -3.240 -2.362
370 H LEU 52 HN LEU 52 -11.130 -6.770 0.240
371 HA LEU 52 HA LEU 52 -11.835 -9.473 -0.695
372 HB2 LEU 52 HB2 LEU 52 -9.120 -8.203 -0.605
373 HB3 LEU 52 HB3 LEU 52 -9.551 -9.709 -1.401
374 HG LEU 52 HG LEU 52 -10.411 -6.934 -2.192
375 HD11 LEU 52 HD11 LEU 52 -8.082 -7.439 -2.728
376 HD12 LEU 52 HD12 LEU 52 -8.576 -8.930 -3.532
377 HD13 LEU 52 HD13 LEU 52 -9.057 -7.368 -4.197
378 HD21 LEU 52 HD21 LEU 52 -12.191 -8.530 -2.641
379 HD22 LEU 52 HD22 LEU 52 -11.432 -8.017 -4.150
380 HD23 LEU 52 HD23 LEU 52 -11.053 -9.598 -3.466
381 H ARG 53 HN ARG 53 -10.120 -7.622 1.701
382 HA ARG 53 HA ARG 53 -9.236 -8.099 3.745
383 HB2 ARG 53 HB2 ARG 53 -11.437 -9.163 4.208
384 HB3 ARG 53 HB3 ARG 53 -10.809 -10.685 3.592
385 HG2 ARG 53 HG2 ARG 53 -9.071 -10.615 5.373
386 HG3 ARG 53 HG3 ARG 53 -9.868 -9.185 6.027
387 HD2 ARG 53 HD2 ARG 53 -11.925 -10.488 6.333
388 HD3 ARG 53 HD3 ARG 53 -11.110 -11.917 5.703
389 HE ARG 53 HE ARG 53 -9.908 -10.619 8.018
390 HH11 ARG 53 HH12 ARG 53 -11.917 -13.251 6.821
391 HH12 ARG 53 HH11 ARG 53 -11.679 -14.225 8.246
392 HH21 ARG 53 HH22 ARG 53 -9.600 -11.903 9.850
393 HH22 ARG 53 HH21 ARG 53 -10.355 -13.468 9.956
Start of MODEL 5
1 H1 ASN 1 H1 ASN 1 9.025 -9.120 2.171
2 H2 ASN 1 H2 ASN 1 8.642 -8.048 0.908
3 H3 ASN 1 H3 ASN 1 7.640 -9.373 1.229
4 HA ASN 1 HA ASN 1 6.706 -7.287 2.041
5 HB2 ASN 1 HB2 ASN 1 7.470 -9.438 4.004
6 HB3 ASN 1 HB3 ASN 1 6.438 -8.090 4.469
7 HD21 ASN 1 HD21 ASN 1 4.356 -8.000 3.746
8 HD22 ASN 1 HD22 ASN 1 3.583 -9.303 2.906
9 H SER 2 HN SER 2 8.659 -5.851 1.571
10 HA SER 2 HA SER 2 9.896 -4.077 2.251
11 HB2 SER 2 HB2 SER 2 7.877 -3.629 3.657
12 HB3 SER 2 HB3 SER 2 8.638 -4.517 4.974
13 HG SER 2 HG SER 2 9.191 -1.986 3.963
14 H ASP 3 HN ASP 3 11.698 -5.640 1.906
15 HA ASP 3 HA ASP 3 13.036 -6.720 4.156
16 HB2 ASP 3 HB2 ASP 3 13.541 -7.677 2.015
17 HB3 ASP 3 HB3 ASP 3 14.030 -6.108 1.383
18 H SER 4 HN SER 4 13.008 -3.759 2.603
19 HA SER 4 HA SER 4 14.983 -2.667 4.486
20 HB2 SER 4 HB2 SER 4 14.140 -1.499 1.819
21 HB3 SER 4 HB3 SER 4 15.424 -0.900 2.872
22 HG SER 4 HG SER 4 16.359 -3.102 2.566
23 H GLU 5 HN GLU 5 13.927 -1.778 6.148
24 HA GLU 5 HA GLU 5 11.270 -0.872 6.052
25 HB2 GLU 5 HB2 GLU 5 11.716 0.170 8.234
26 HB3 GLU 5 HB3 GLU 5 12.295 -1.486 8.160
27 HG2 GLU 5 HG2 GLU 5 14.567 -0.725 7.899
28 HG3 GLU 5 HG3 GLU 5 14.026 0.954 7.821
29 H CYS 6 HN CYS 6 10.464 0.820 5.106
30 HA CYS 6 HA CYS 6 12.184 2.750 3.878
31 HB2 CYS 6 HB2 CYS 6 9.164 2.683 3.990
32 HB3 CYS 6 HB3 CYS 6 10.159 3.579 2.846
33 HA PRO 7 HA PRO 7 11.687 5.980 6.983
34 HB2 PRO 7 HB2 PRO 7 12.515 7.769 4.804
35 HB3 PRO 7 HB3 PRO 7 13.305 7.460 6.353
36 HG2 PRO 7 HG2 PRO 7 14.342 6.599 4.026
37 HG3 PRO 7 HG3 PRO 7 14.511 5.675 5.531
38 HD2 PRO 7 HD2 PRO 7 12.617 5.246 3.247
39 HD3 PRO 7 HD3 PRO 7 13.540 4.052 4.187
40 H LEU 8 HN LEU 8 10.296 7.815 7.179
41 HA LEU 8 HA LEU 8 7.739 7.240 6.405
42 HB2 LEU 8 HB2 LEU 8 7.056 9.329 7.318
43 HB3 LEU 8 HB3 LEU 8 8.357 8.683 8.295
44 HG LEU 8 HG LEU 8 8.801 10.804 6.195
45 HD11 LEU 8 HD11 LEU 8 8.236 11.142 9.136
46 HD12 LEU 8 HD12 LEU 8 8.792 12.419 8.055
47 HD13 LEU 8 HD13 LEU 8 7.213 11.674 7.802
48 HD21 LEU 8 HD21 LEU 8 10.780 9.534 6.939
49 HD22 LEU 8 HD22 LEU 8 10.852 11.230 7.420
50 HD23 LEU 8 HD23 LEU 8 10.429 9.994 8.605
51 H SER 9 HN SER 9 9.992 8.866 4.401
52 HA SER 9 HA SER 9 8.112 10.491 3.001
53 HB2 SER 9 HB2 SER 9 10.919 9.730 2.168
54 HB3 SER 9 HB3 SER 9 9.980 11.118 1.616
55 HG SER 9 HG SER 9 10.146 12.023 3.640
56 H HIS 10 HN HIS 10 9.504 7.303 2.705
57 HA HIS 10 HA HIS 10 8.632 7.002 -0.020
58 HB2 HIS 10 HB2 HIS 10 10.124 5.294 1.911
59 HB3 HIS 10 HB3 HIS 10 9.323 4.509 0.554
60 HD1 HIS 10 HD1 HIS 10 12.000 7.095 1.273
61 HD2 HIS 10 HD2 HIS 10 10.610 4.733 -1.858
62 HE1 HIS 10 HE1 HIS 10 13.689 7.343 -0.570
63 HE2 HIS 10 HE2 HIS 10 12.937 5.747 -2.362
64 H ASP 11 HN ASP 11 7.263 6.652 3.026
65 HA ASP 11 HA ASP 11 5.161 4.832 2.141
66 HB2 ASP 11 HB2 ASP 11 5.517 6.211 4.818
67 HB3 ASP 11 HB3 ASP 11 4.360 4.940 4.455
68 H GLY 12 HN GLY 12 5.690 8.087 3.325
69 HA2 GLY 12 HA1 GLY 12 2.988 8.948 3.095
70 HA3 GLY 12 HA2 GLY 12 4.389 9.973 3.363
71 H TYR 13 HN TYR 13 5.693 8.839 0.904
72 HA TYR 13 HA TYR 13 4.748 10.718 -0.990
73 HB2 TYR 13 HB2 TYR 13 7.036 9.735 -0.975
74 HB3 TYR 13 HB3 TYR 13 6.355 8.218 -1.550
75 HD1 TYR 13 HD1 TYR 13 6.216 11.838 -2.459
76 HD2 TYR 13 HD2 TYR 13 6.548 7.819 -3.815
77 HE1 TYR 13 HE1 TYR 13 6.417 12.643 -4.771
78 HE2 TYR 13 HE2 TYR 13 6.746 8.614 -6.132
79 HH TYR 13 HH TYR 13 7.220 11.949 -6.901
80 H CYS 14 HN CYS 14 3.512 7.717 -0.078
81 HA CYS 14 HA CYS 14 2.431 6.866 -2.563
82 HB2 CYS 14 HB2 CYS 14 2.804 5.641 -0.212
83 HB3 CYS 14 HB3 CYS 14 1.118 6.103 -0.015
84 H LEU 15 HN LEU 15 -0.345 6.357 -1.706
85 HA LEU 15 HA LEU 15 -1.174 8.919 -2.807
86 HB2 LEU 15 HB2 LEU 15 -2.650 6.304 -2.807
87 HB3 LEU 15 HB3 LEU 15 -3.152 7.769 -3.631
88 HG LEU 15 HG LEU 15 -0.759 6.050 -4.251
89 HD11 LEU 15 HD11 LEU 15 -1.856 5.864 -6.446
90 HD12 LEU 15 HD12 LEU 15 -2.861 5.233 -5.140
91 HD13 LEU 15 HD13 LEU 15 -3.208 6.817 -5.834
92 HD21 LEU 15 HD21 LEU 15 -1.518 8.722 -5.438
93 HD22 LEU 15 HD22 LEU 15 -0.094 8.384 -4.454
94 HD23 LEU 15 HD23 LEU 15 -0.258 7.651 -6.050
95 H HIS 16 HN HIS 16 -3.190 6.630 -0.895
96 HA HIS 16 HA HIS 16 -4.357 9.113 0.197
97 HB2 HIS 16 HB2 HIS 16 -5.573 6.419 -0.344
98 HB3 HIS 16 HB3 HIS 16 -6.351 7.565 0.739
99 HD1 HIS 16 HD1 HIS 16 -8.082 8.903 -0.372
100 HD2 HIS 16 HD2 HIS 16 -5.052 7.802 -3.006
101 HE1 HIS 16 HE1 HIS 16 -8.773 9.799 -2.618
102 HE2 HIS 16 HE2 HIS 16 -6.844 9.281 -4.156
103 H ASP 17 HN ASP 17 -2.072 7.630 1.203
104 HA ASP 17 HA ASP 17 -2.199 7.913 3.895
105 HB2 ASP 17 HB2 ASP 17 -4.071 6.122 3.665
106 HB3 ASP 17 HB3 ASP 17 -2.754 4.993 3.370
107 H GLY 18 HN GLY 18 -1.389 5.218 1.757
108 HA2 GLY 18 HA1 GLY 18 0.582 4.320 1.104
109 HA3 GLY 18 HA2 GLY 18 1.311 5.855 1.511
110 H VAL 19 HN VAL 19 1.623 2.749 1.889
111 HA VAL 19 HA VAL 19 3.480 3.134 4.105
112 HB VAL 19 HB VAL 19 1.512 0.826 3.947
113 HG11 VAL 19 HG11 VAL 19 3.785 -0.047 4.317
114 HG12 VAL 19 HG12 VAL 19 3.956 1.023 5.711
115 HG13 VAL 19 HG13 VAL 19 2.751 -0.265 5.729
116 HG21 VAL 19 HG21 VAL 19 2.178 2.764 6.165
117 HG22 VAL 19 HG22 VAL 19 0.710 2.761 5.184
118 HG23 VAL 19 HG23 VAL 19 1.040 1.422 6.285
119 H CYS 20 HN CYS 20 5.423 1.985 3.726
120 HA CYS 20 HA CYS 20 5.612 1.405 0.857
121 HB2 CYS 20 HB2 CYS 20 6.929 3.260 1.487
122 HB3 CYS 20 HB3 CYS 20 7.575 2.428 2.895
123 H MET 21 HN MET 21 5.930 -0.577 0.159
124 HA MET 21 HA MET 21 8.089 -2.100 1.288
125 HB2 MET 21 HB2 MET 21 6.750 -4.223 1.378
126 HB3 MET 21 HB3 MET 21 6.415 -3.057 2.637
127 HG2 MET 21 HG2 MET 21 4.390 -2.360 1.481
128 HG3 MET 21 HG3 MET 21 4.738 -3.499 0.181
129 HE1 MET 21 HE1 MET 21 1.942 -3.448 1.712
130 HE2 MET 21 HE2 MET 21 2.341 -4.569 0.410
131 HE3 MET 21 HE3 MET 21 1.673 -5.178 1.925
132 H TYR 22 HN TYR 22 9.215 -2.180 -0.490
133 HA TYR 22 HA TYR 22 8.376 -3.660 -2.691
134 HB2 TYR 22 HB2 TYR 22 9.165 -1.694 -4.202
135 HB3 TYR 22 HB3 TYR 22 7.491 -1.879 -3.759
136 HD1 TYR 22 HD1 TYR 22 10.571 0.054 -3.216
137 HD2 TYR 22 HD2 TYR 22 6.396 -0.188 -2.443
138 HE1 TYR 22 HE1 TYR 22 10.617 2.331 -2.297
139 HE2 TYR 22 HE2 TYR 22 6.427 2.095 -1.536
140 HH TYR 22 HH TYR 22 9.057 4.201 -1.924
141 H ILE 23 HN ILE 23 10.754 -1.280 -1.814
142 HA ILE 23 HA ILE 23 12.989 -2.509 -2.944
143 HB ILE 23 HB ILE 23 14.203 -1.321 -0.982
144 HG12 ILE 23 HG12 ILE 23 11.563 0.105 -0.818
145 HG13 ILE 23 HG13 ILE 23 11.951 -1.242 0.248
146 HG21 ILE 23 HG21 ILE 23 13.986 0.833 -2.143
147 HG22 ILE 23 HG22 ILE 23 14.171 -0.506 -3.274
148 HG23 ILE 23 HG23 ILE 23 12.581 0.212 -3.011
149 HD11 ILE 23 HD11 ILE 23 13.897 0.013 1.075
150 HD12 ILE 23 HD12 ILE 23 13.470 1.354 0.011
151 HD13 ILE 23 HD13 ILE 23 12.388 0.894 1.326
152 H GLU 24 HN GLU 24 13.239 -4.630 -2.631
153 HA GLU 24 HA GLU 24 13.544 -5.640 0.111
154 HB2 GLU 24 HB2 GLU 24 11.936 -6.854 -2.138
155 HB3 GLU 24 HB3 GLU 24 12.307 -7.682 -0.616
156 HG2 GLU 24 HG2 GLU 24 11.155 -5.869 0.607
157 HG3 GLU 24 HG3 GLU 24 10.700 -5.166 -0.940
158 H ALA 25 HN ALA 25 15.237 -5.046 -2.433
159 HA ALA 25 HA ALA 25 16.975 -5.920 -3.591
160 HB1 ALA 25 HB1 ALA 25 17.792 -6.760 -1.441
161 HB2 ALA 25 HB2 ALA 25 16.832 -8.224 -1.649
162 HB3 ALA 25 HB3 ALA 25 18.162 -7.877 -2.755
163 H LEU 26 HN LEU 26 14.027 -7.544 -3.231
164 HA LEU 26 HA LEU 26 14.488 -9.387 -5.419
165 HB2 LEU 26 HB2 LEU 26 11.942 -8.794 -3.907
166 HB3 LEU 26 HB3 LEU 26 12.179 -10.104 -5.045
167 HG LEU 26 HG LEU 26 13.575 -9.842 -2.380
168 HD11 LEU 26 HD11 LEU 26 11.197 -10.290 -2.133
169 HD12 LEU 26 HD12 LEU 26 11.321 -11.640 -3.263
170 HD13 LEU 26 HD13 LEU 26 12.151 -11.712 -1.708
171 HD21 LEU 26 HD21 LEU 26 13.562 -12.087 -4.394
172 HD22 LEU 26 HD22 LEU 26 14.920 -11.019 -4.044
173 HD23 LEU 26 HD23 LEU 26 14.328 -12.126 -2.806
174 H ASP 27 HN ASP 27 13.505 -6.321 -4.681
175 HA ASP 27 HA ASP 27 13.108 -4.508 -5.976
176 HB2 ASP 27 HB2 ASP 27 14.610 -5.701 -7.655
177 HB3 ASP 27 HB3 ASP 27 13.130 -6.263 -8.431
178 H LYS 28 HN LYS 28 11.276 -5.057 -4.687
179 HA LYS 28 HA LYS 28 8.940 -6.047 -6.143
180 HB2 LYS 28 HB2 LYS 28 9.315 -5.447 -3.198
181 HB3 LYS 28 HB3 LYS 28 7.902 -6.207 -3.925
182 HG2 LYS 28 HG2 LYS 28 10.589 -7.432 -4.322
183 HG3 LYS 28 HG3 LYS 28 9.736 -7.665 -2.795
184 HD2 LYS 28 HD2 LYS 28 8.456 -8.213 -5.458
185 HD3 LYS 28 HD3 LYS 28 9.390 -9.435 -4.591
186 HE2 LYS 28 HE2 LYS 28 7.022 -7.960 -3.443
187 HE3 LYS 28 HE3 LYS 28 6.940 -9.562 -4.175
188 HZ1 LYS 28 HZ1 LYS 28 7.132 -9.550 -1.703
189 HZ2 LYS 28 HZ2 LYS 28 8.699 -8.912 -1.869
190 HZ3 LYS 28 HZ3 LYS 28 8.331 -10.447 -2.497
191 H TYR 29 HN TYR 29 6.863 -4.858 -5.108
192 HA TYR 29 HA TYR 29 7.042 -2.050 -4.958
193 HB2 TYR 29 HB2 TYR 29 5.819 -1.455 -7.011
194 HB3 TYR 29 HB3 TYR 29 7.388 -2.171 -7.376
195 HD1 TYR 29 HD2 TYR 29 7.429 -4.633 -8.068
196 HD2 TYR 29 HD1 TYR 29 3.858 -2.322 -7.982
197 HE1 TYR 29 HE2 TYR 29 6.354 -6.255 -9.563
198 HE2 TYR 29 HE1 TYR 29 2.768 -3.942 -9.480
199 HH TYR 29 HH TYR 29 3.296 -5.642 -11.058
200 H ALA 30 HN ALA 30 5.729 -2.004 -3.254
201 HA ALA 30 HA ALA 30 2.925 -2.375 -3.769
202 HB1 ALA 30 HB1 ALA 30 2.504 -3.870 -1.896
203 HB2 ALA 30 HB2 ALA 30 3.593 -4.631 -3.058
204 HB3 ALA 30 HB3 ALA 30 4.235 -3.960 -1.558
205 H CYS 31 HN CYS 31 1.627 -1.380 -2.183
206 HA CYS 31 HA CYS 31 2.947 0.129 -0.096
207 HB2 CYS 31 HB2 CYS 31 3.073 1.671 -1.993
208 HB3 CYS 31 HB3 CYS 31 1.357 1.453 -2.315
209 H ASN 32 HN ASN 32 1.665 0.181 1.658
210 HA ASN 32 HA ASN 32 -1.067 -0.815 1.271
211 HB2 ASN 32 HB2 ASN 32 0.566 -2.072 2.760
212 HB3 ASN 32 HB3 ASN 32 0.460 -0.708 3.871
213 HD21 ASN 32 HD21 ASN 32 -1.217 -3.411 2.487
214 HD22 ASN 32 HD22 ASN 32 -2.547 -3.424 3.595
215 H CYS 33 HN CYS 33 -2.321 0.814 0.978
216 HA CYS 33 HA CYS 33 -1.731 3.352 2.146
217 HB2 CYS 33 HB2 CYS 33 -2.128 3.098 -0.221
218 HB3 CYS 33 HB3 CYS 33 -3.699 2.386 0.093
219 H VAL 34 HN VAL 34 -5.046 2.692 1.418
220 HA VAL 34 HA VAL 34 -5.678 2.690 4.289
221 HB VAL 34 HB VAL 34 -5.911 4.995 3.381
222 HG11 VAL 34 HG11 VAL 34 -6.440 4.464 1.073
223 HG12 VAL 34 HG12 VAL 34 -7.995 3.795 1.572
224 HG13 VAL 34 HG13 VAL 34 -7.671 5.517 1.774
225 HG21 VAL 34 HG21 VAL 34 -8.519 3.669 4.101
226 HG22 VAL 34 HG22 VAL 34 -7.326 4.315 5.227
227 HG23 VAL 34 HG23 VAL 34 -8.207 5.404 4.154
228 H VAL 35 HN VAL 35 -7.620 1.541 4.765
229 HA VAL 35 HA VAL 35 -7.968 -0.676 3.043
230 HB VAL 35 HB VAL 35 -9.651 -1.457 4.615
231 HG11 VAL 35 HG11 VAL 35 -8.169 -1.652 6.560
232 HG12 VAL 35 HG12 VAL 35 -7.282 -1.857 5.050
233 HG13 VAL 35 HG13 VAL 35 -7.177 -0.335 5.933
234 HG21 VAL 35 HG21 VAL 35 -10.715 0.654 5.199
235 HG22 VAL 35 HG22 VAL 35 -10.134 -0.152 6.656
236 HG23 VAL 35 HG23 VAL 35 -9.235 1.207 5.983
237 H GLY 36 HN GLY 36 -8.674 1.663 1.692
238 HA2 GLY 36 HA1 GLY 36 -11.362 0.899 0.813
239 HA3 GLY 36 HA2 GLY 36 -11.061 2.593 1.198
240 H TYR 37 HN TYR 37 -8.193 2.010 0.277
241 HA TYR 37 HA TYR 37 -8.602 1.759 -2.608
242 HB2 TYR 37 HB2 TYR 37 -7.249 4.114 -1.275
243 HB3 TYR 37 HB3 TYR 37 -7.053 3.721 -2.977
244 HD1 TYR 37 HD1 TYR 37 -9.200 3.632 -4.398
245 HD2 TYR 37 HD2 TYR 37 -8.988 5.487 -0.575
246 HE1 TYR 37 HE1 TYR 37 -11.213 4.941 -4.928
247 HE2 TYR 37 HE2 TYR 37 -11.005 6.798 -1.093
248 HH TYR 37 HH TYR 37 -12.191 7.620 -3.161
249 H ILE 38 HN ILE 38 -7.328 0.005 -3.023
250 HA ILE 38 HA ILE 38 -4.504 0.477 -2.600
251 HB ILE 38 HB ILE 38 -5.633 -1.009 -0.684
252 HG12 ILE 38 HG12 ILE 38 -3.335 -0.162 -0.814
253 HG13 ILE 38 HG13 ILE 38 -3.413 -1.797 -0.160
254 HG21 ILE 38 HG21 ILE 38 -5.149 -3.380 -1.020
255 HG22 ILE 38 HG22 ILE 38 -6.390 -2.803 -2.132
256 HG23 ILE 38 HG23 ILE 38 -4.741 -3.057 -2.705
257 HD11 ILE 38 HD11 ILE 38 -2.612 -1.030 -2.959
258 HD12 ILE 38 HD12 ILE 38 -1.544 -1.585 -1.670
259 HD13 ILE 38 HD13 ILE 38 -2.744 -2.682 -2.354
260 H GLY 39 HN GLY 39 -3.535 0.141 -4.434
261 HA2 GLY 39 HA1 GLY 39 -3.929 -2.233 -5.973
262 HA3 GLY 39 HA2 GLY 39 -4.613 -0.816 -6.768
263 H GLU 40 HN GLU 40 -1.843 -2.584 -6.109
264 HA GLU 40 HA GLU 40 0.346 -2.404 -6.578
265 HB2 GLU 40 HB2 GLU 40 -0.394 -1.515 -8.778
266 HB3 GLU 40 HB3 GLU 40 -0.372 0.105 -8.096
267 HG2 GLU 40 HG2 GLU 40 2.041 -0.147 -7.662
268 HG3 GLU 40 HG3 GLU 40 1.987 -1.725 -8.449
269 H ARG 41 HN ARG 41 -1.164 0.625 -5.846
270 HA ARG 41 HA ARG 41 0.869 1.173 -3.814
271 HB2 ARG 41 HB2 ARG 41 0.760 3.555 -4.509
272 HB3 ARG 41 HB3 ARG 41 1.370 2.494 -5.788
273 HG2 ARG 41 HG2 ARG 41 -1.523 2.798 -5.841
274 HG3 ARG 41 HG3 ARG 41 -0.668 4.334 -6.040
275 HD2 ARG 41 HD2 ARG 41 0.094 1.915 -7.631
276 HD3 ARG 41 HD3 ARG 41 -1.281 2.917 -8.109
277 HE ARG 41 HE ARG 41 1.134 4.421 -7.625
278 HH11 ARG 41 HH12 ARG 41 -0.673 2.588 -10.026
279 HH12 ARG 41 HH11 ARG 41 0.122 3.347 -11.368
280 HH21 ARG 41 HH22 ARG 41 2.162 5.413 -9.399
281 HH22 ARG 41 HH21 ARG 41 1.740 4.946 -11.016
282 H CYS 42 HN CYS 42 -2.439 1.733 -5.002
283 HA CYS 42 HA CYS 42 -3.931 1.858 -2.764
284 HB2 CYS 42 HB2 CYS 42 -2.371 3.400 -1.710
285 HB3 CYS 42 HB3 CYS 42 -2.484 4.502 -3.072
286 H GLN 43 HN GLN 43 -5.073 1.375 -5.080
287 HA GLN 43 HA GLN 43 -7.030 3.402 -5.200
288 HB2 GLN 43 HB2 GLN 43 -6.691 4.303 -7.421
289 HB3 GLN 43 HB3 GLN 43 -5.278 4.607 -6.406
290 HG2 GLN 43 HG2 GLN 43 -4.098 2.767 -7.494
291 HG3 GLN 43 HG3 GLN 43 -5.515 2.440 -8.493
292 HE21 GLN 43 HE21 GLN 43 -2.833 4.561 -7.934
293 HE22 GLN 43 HE22 GLN 43 -2.968 5.456 -9.405
294 H TYR 44 HN TYR 44 -6.605 0.431 -5.128
295 HA TYR 44 HA TYR 44 -8.629 -0.150 -7.165
296 HB2 TYR 44 HB2 TYR 44 -6.349 -1.062 -7.782
297 HB3 TYR 44 HB3 TYR 44 -6.447 -2.084 -6.356
298 HD1 TYR 44 HD1 TYR 44 -7.876 -1.445 -9.695
299 HD2 TYR 44 HD2 TYR 44 -7.779 -4.068 -6.346
300 HE1 TYR 44 HE1 TYR 44 -9.065 -3.152 -11.004
301 HE2 TYR 44 HE2 TYR 44 -8.966 -5.781 -7.648
302 HH TYR 44 HH TYR 44 -9.285 -5.662 -10.978
303 H ARG 45 HN ARG 45 -9.984 0.410 -5.464
304 HA ARG 45 HA ARG 45 -11.660 -0.232 -4.092
305 HB2 ARG 45 HB2 ARG 45 -10.630 -2.971 -4.814
306 HB3 ARG 45 HB3 ARG 45 -12.130 -2.686 -3.935
307 HG2 ARG 45 HG2 ARG 45 -12.826 -2.979 -6.135
308 HG3 ARG 45 HG3 ARG 45 -12.804 -1.228 -5.936
309 HD2 ARG 45 HD2 ARG 45 -10.362 -1.434 -6.855
310 HD3 ARG 45 HD3 ARG 45 -10.938 -2.991 -7.470
311 HE ARG 45 HE ARG 45 -11.989 -0.346 -8.237
312 HH11 ARG 45 HH12 ARG 45 -11.782 -3.804 -8.811
313 HH12 ARG 45 HH11 ARG 45 -12.356 -3.684 -10.452
314 HH21 ARG 45 HH22 ARG 45 -12.746 -0.193 -10.358
315 HH22 ARG 45 HH21 ARG 45 -12.921 -1.628 -11.328
316 H ASP 46 HN ASP 46 -11.824 -2.438 -2.344
317 HA ASP 46 HA ASP 46 -10.039 -1.414 -0.250
318 HB2 ASP 46 HB2 ASP 46 -12.225 -1.841 1.204
319 HB3 ASP 46 HB3 ASP 46 -11.943 -0.308 0.388
320 H LEU 47 HN LEU 47 -9.586 -3.646 -1.723
321 HA LEU 47 HA LEU 47 -10.444 -6.099 -1.091
322 HB2 LEU 47 HB2 LEU 47 -7.536 -5.331 -1.261
323 HB3 LEU 47 HB3 LEU 47 -8.199 -6.931 -1.533
324 HG LEU 47 HG LEU 47 -8.755 -4.499 -3.233
325 HD11 LEU 47 HD11 LEU 47 -6.463 -5.306 -3.465
326 HD12 LEU 47 HD12 LEU 47 -7.065 -6.933 -3.784
327 HD13 LEU 47 HD13 LEU 47 -7.408 -5.627 -4.919
328 HD21 LEU 47 HD21 LEU 47 -10.642 -6.047 -3.188
329 HD22 LEU 47 HD22 LEU 47 -9.834 -6.078 -4.757
330 HD23 LEU 47 HD23 LEU 47 -9.566 -7.382 -3.601
331 H LYS 48 HN LYS 48 -8.228 -4.245 0.972
332 HA LYS 48 HA LYS 48 -7.437 -6.429 2.547
333 HB2 LYS 48 HB2 LYS 48 -6.911 -4.462 4.245
334 HB3 LYS 48 HB3 LYS 48 -5.937 -4.735 2.806
335 HG2 LYS 48 HG2 LYS 48 -8.222 -2.963 2.385
336 HG3 LYS 48 HG3 LYS 48 -7.038 -2.362 3.548
337 HD2 LYS 48 HD2 LYS 48 -5.256 -2.696 1.900
338 HD3 LYS 48 HD3 LYS 48 -6.446 -3.285 0.736
339 HE2 LYS 48 HE2 LYS 48 -6.594 -0.568 2.011
340 HE3 LYS 48 HE3 LYS 48 -5.749 -0.858 0.491
341 HZ1 LYS 48 HZ1 LYS 48 -8.011 -0.068 0.149
342 HZ2 LYS 48 HZ2 LYS 48 -8.631 -1.399 0.983
343 HZ3 LYS 48 HZ3 LYS 48 -7.814 -1.623 -0.480
344 H TRP 49 HN TRP 49 -9.633 -3.774 3.498
345 HA TRP 49 HA TRP 49 -10.436 -5.419 5.762
346 HB2 TRP 49 HB2 TRP 49 -9.671 -3.174 6.272
347 HB3 TRP 49 HB3 TRP 49 -10.876 -2.486 5.189
348 HD1 TRP 49 HD1 TRP 49 -11.023 -4.869 8.267
349 HE1 TRP 49 HE1 TRP 49 -12.948 -4.081 9.783
350 HE3 TRP 49 HE3 TRP 49 -12.659 -0.901 5.484
351 HZ2 TRP 49 HZ2 TRP 49 -14.903 -2.037 9.791
352 HZ3 TRP 49 HZ3 TRP 49 -14.561 0.420 6.317
353 HH2 TRP 49 HH2 TRP 49 -15.660 -0.137 8.425
354 H TRP 50 HN TRP 50 -11.880 -3.777 2.963
355 HA TRP 50 HA TRP 50 -14.508 -4.475 4.035
356 HB2 TRP 50 HB2 TRP 50 -13.863 -2.092 3.374
357 HB3 TRP 50 HB3 TRP 50 -14.019 -2.639 1.708
358 HD1 TRP 50 HD1 TRP 50 -16.303 -2.143 0.722
359 HE1 TRP 50 HE1 TRP 50 -18.693 -1.873 1.617
360 HE3 TRP 50 HE3 TRP 50 -15.425 -3.107 5.659
361 HZ2 TRP 50 HZ2 TRP 50 -20.036 -2.048 4.097
362 HZ3 TRP 50 HZ3 TRP 50 -17.314 -3.039 7.228
363 HH2 TRP 50 HH2 TRP 50 -19.574 -2.518 6.462
364 H GLU 51 HN GLU 51 -12.662 -4.735 0.989
365 HA GLU 51 HA GLU 51 -14.756 -6.035 -0.428
366 HB2 GLU 51 HB2 GLU 51 -11.828 -5.625 -0.924
367 HB3 GLU 51 HB3 GLU 51 -12.744 -6.722 -1.950
368 HG2 GLU 51 HG2 GLU 51 -13.365 -3.829 -1.471
369 HG3 GLU 51 HG3 GLU 51 -12.501 -4.466 -2.868
370 H LEU 52 HN LEU 52 -11.618 -7.295 0.602
371 HA LEU 52 HA LEU 52 -12.622 -10.007 0.331
372 HB2 LEU 52 HB2 LEU 52 -9.911 -9.083 1.250
373 HB3 LEU 52 HB3 LEU 52 -10.336 -10.684 0.668
374 HG LEU 52 HG LEU 52 -10.277 -8.148 -0.978
375 HD11 LEU 52 HD11 LEU 52 -8.458 -10.562 -0.969
376 HD12 LEU 52 HD12 LEU 52 -8.370 -9.209 -2.096
377 HD13 LEU 52 HD13 LEU 52 -8.051 -8.949 -0.380
378 HD21 LEU 52 HD21 LEU 52 -10.844 -11.003 -1.795
379 HD22 LEU 52 HD22 LEU 52 -12.004 -9.675 -1.770
380 HD23 LEU 52 HD23 LEU 52 -10.647 -9.639 -2.895
381 H ARG 53 HN ARG 53 -11.423 -7.826 2.761
382 HA ARG 53 HA ARG 53 -11.434 -7.795 5.023
383 HB2 ARG 53 HB2 ARG 53 -13.871 -7.854 4.656
384 HB3 ARG 53 HB3 ARG 53 -13.830 -9.610 4.717
385 HG2 ARG 53 HG2 ARG 53 -13.197 -9.588 7.015
386 HG3 ARG 53 HG3 ARG 53 -12.956 -7.840 6.984
387 HD2 ARG 53 HD2 ARG 53 -15.302 -7.460 6.665
388 HD3 ARG 53 HD3 ARG 53 -15.602 -9.186 6.460
389 HE ARG 53 HE ARG 53 -14.696 -9.292 8.877
390 HH11 ARG 53 HH12 ARG 53 -16.552 -6.615 7.583
391 HH12 ARG 53 HH11 ARG 53 -17.362 -6.276 9.085
392 HH21 ARG 53 HH22 ARG 53 -15.741 -8.839 10.856
393 HH22 ARG 53 HH21 ARG 53 -16.897 -7.544 10.953
Start of MODEL 6
1 H1 ASN 1 H1 ASN 1 17.495 -3.627 3.609
2 H2 ASN 1 H2 ASN 1 18.737 -3.319 2.502
3 H3 ASN 1 H3 ASN 1 18.780 -4.717 3.456
4 HA ASN 1 HA ASN 1 16.787 -4.096 1.359
5 HB2 ASN 1 HB2 ASN 1 17.814 -5.901 0.088
6 HB3 ASN 1 HB3 ASN 1 19.048 -4.716 0.498
7 HD21 ASN 1 HD21 ASN 1 19.416 -7.479 -0.224
8 HD22 ASN 1 HD22 ASN 1 20.183 -8.251 1.120
9 H SER 2 HN SER 2 15.379 -5.919 0.889
10 HA SER 2 HA SER 2 13.985 -7.635 1.381
11 HB2 SER 2 HB2 SER 2 16.085 -8.861 2.028
12 HB3 SER 2 HB3 SER 2 15.827 -8.316 3.684
13 HG SER 2 HG SER 2 13.722 -9.609 2.350
14 H ASP 3 HN ASP 3 12.270 -6.409 1.899
15 HA ASP 3 HA ASP 3 10.722 -5.259 3.103
16 HB2 ASP 3 HB2 ASP 3 10.466 -7.572 3.982
17 HB3 ASP 3 HB3 ASP 3 11.540 -7.159 5.309
18 H SER 4 HN SER 4 12.665 -3.684 2.923
19 HA SER 4 HA SER 4 13.857 -2.904 5.427
20 HB2 SER 4 HB2 SER 4 13.938 -1.597 2.697
21 HB3 SER 4 HB3 SER 4 14.945 -1.155 4.076
22 HG SER 4 HG SER 4 15.614 -3.447 4.034
23 H GLU 5 HN GLU 5 13.671 -0.781 6.316
24 HA GLU 5 HA GLU 5 10.988 0.047 6.686
25 HB2 GLU 5 HB2 GLU 5 13.575 1.431 7.400
26 HB3 GLU 5 HB3 GLU 5 11.988 1.899 7.987
27 HG2 GLU 5 HG2 GLU 5 11.759 -0.177 9.172
28 HG3 GLU 5 HG3 GLU 5 13.275 -0.771 8.490
29 H CYS 6 HN CYS 6 9.874 1.767 5.913
30 HA CYS 6 HA CYS 6 11.164 3.358 3.797
31 HB2 CYS 6 HB2 CYS 6 9.316 1.579 3.200
32 HB3 CYS 6 HB3 CYS 6 8.216 2.803 3.818
33 HA PRO 7 HA PRO 7 10.204 6.368 6.951
34 HB2 PRO 7 HB2 PRO 7 11.437 8.479 5.786
35 HB3 PRO 7 HB3 PRO 7 12.319 7.176 6.589
36 HG2 PRO 7 HG2 PRO 7 11.805 7.598 3.672
37 HG3 PRO 7 HG3 PRO 7 13.299 7.091 4.483
38 HD2 PRO 7 HD2 PRO 7 11.626 5.347 3.250
39 HD3 PRO 7 HD3 PRO 7 12.605 4.905 4.662
40 H LEU 8 HN LEU 8 9.875 9.108 6.288
41 HA LEU 8 HA LEU 8 7.135 9.294 6.167
42 HB2 LEU 8 HB2 LEU 8 8.696 11.053 6.924
43 HB3 LEU 8 HB3 LEU 8 9.109 11.382 5.254
44 HG LEU 8 HG LEU 8 6.757 12.050 4.834
45 HD11 LEU 8 HD11 LEU 8 5.286 12.456 6.752
46 HD12 LEU 8 HD12 LEU 8 5.671 10.744 6.565
47 HD13 LEU 8 HD13 LEU 8 6.472 11.697 7.814
48 HD21 LEU 8 HD21 LEU 8 8.416 13.737 5.327
49 HD22 LEU 8 HD22 LEU 8 6.879 14.176 6.070
50 HD23 LEU 8 HD23 LEU 8 8.178 13.507 7.058
51 H SER 9 HN SER 9 9.185 8.745 3.543
52 HA SER 9 HA SER 9 7.776 10.030 1.467
53 HB2 SER 9 HB2 SER 9 9.698 7.697 1.270
54 HB3 SER 9 HB3 SER 9 9.287 8.845 -0.005
55 HG SER 9 HG SER 9 10.728 10.169 0.760
56 H HIS 10 HN HIS 10 7.358 7.146 3.277
57 HA HIS 10 HA HIS 10 5.991 5.586 1.403
58 HB2 HIS 10 HB2 HIS 10 4.982 4.392 3.285
59 HB3 HIS 10 HB3 HIS 10 6.676 4.699 3.619
60 HD1 HIS 10 HD1 HIS 10 3.246 6.067 4.600
61 HD2 HIS 10 HD2 HIS 10 7.124 5.801 6.071
62 HE1 HIS 10 HE1 HIS 10 3.146 6.950 6.947
63 HE2 HIS 10 HE2 HIS 10 5.449 6.573 7.880
64 H ASP 11 HN ASP 11 5.143 8.369 3.139
65 HA ASP 11 HA ASP 11 2.278 8.097 2.683
66 HB2 ASP 11 HB2 ASP 11 3.173 8.644 4.866
67 HB3 ASP 11 HB3 ASP 11 3.978 10.067 4.214
68 H GLY 12 HN GLY 12 5.042 9.498 1.370
69 HA2 GLY 12 HA1 GLY 12 3.612 11.673 0.017
70 HA3 GLY 12 HA2 GLY 12 5.360 11.453 0.074
71 H TYR 13 HN TYR 13 5.339 8.683 -0.566
72 HA TYR 13 HA TYR 13 5.360 8.782 -3.396
73 HB2 TYR 13 HB2 TYR 13 6.529 7.154 -1.624
74 HB3 TYR 13 HB3 TYR 13 5.103 6.179 -1.951
75 HD1 TYR 13 HD2 TYR 13 4.582 5.662 -4.440
76 HD2 TYR 13 HD1 TYR 13 8.375 6.995 -3.045
77 HE1 TYR 13 HE2 TYR 13 5.639 4.757 -6.467
78 HE2 TYR 13 HE1 TYR 13 9.441 6.089 -5.065
79 HH TYR 13 HH TYR 13 7.723 5.201 -7.801
80 H CYS 14 HN CYS 14 2.976 7.847 -1.047
81 HA CYS 14 HA CYS 14 1.310 6.674 -3.152
82 HB2 CYS 14 HB2 CYS 14 1.535 6.083 -0.215
83 HB3 CYS 14 HB3 CYS 14 0.242 5.430 -1.231
84 H LEU 15 HN LEU 15 -1.048 6.623 -1.265
85 HA LEU 15 HA LEU 15 -1.816 9.323 -2.117
86 HB2 LEU 15 HB2 LEU 15 -3.529 6.857 -1.954
87 HB3 LEU 15 HB3 LEU 15 -4.061 8.439 -2.493
88 HG LEU 15 HG LEU 15 -2.062 6.642 -3.857
89 HD11 LEU 15 HD11 LEU 15 -3.716 6.619 -5.650
90 HD12 LEU 15 HD12 LEU 15 -4.398 5.998 -4.147
91 HD13 LEU 15 HD13 LEU 15 -4.788 7.632 -4.683
92 HD21 LEU 15 HD21 LEU 15 -2.998 9.396 -4.666
93 HD22 LEU 15 HD22 LEU 15 -1.399 9.003 -4.033
94 HD23 LEU 15 HD23 LEU 15 -1.919 8.346 -5.583
95 H HIS 16 HN HIS 16 -3.706 7.111 -0.061
96 HA HIS 16 HA HIS 16 -4.352 9.581 1.387
97 HB2 HIS 16 HB2 HIS 16 -6.093 8.112 0.021
98 HB3 HIS 16 HB3 HIS 16 -6.159 7.219 1.539
99 HD1 HIS 16 HD1 HIS 16 -8.519 7.979 2.219
100 HD2 HIS 16 HD2 HIS 16 -5.906 11.136 1.463
101 HE1 HIS 16 HE1 HIS 16 -9.702 10.056 3.006
102 HE2 HIS 16 HE2 HIS 16 -8.067 11.938 2.624
103 H ASP 17 HN ASP 17 -2.249 7.663 1.868
104 HA ASP 17 HA ASP 17 -2.007 8.008 4.579
105 HB2 ASP 17 HB2 ASP 17 -3.804 6.233 4.697
106 HB3 ASP 17 HB3 ASP 17 -2.659 5.112 3.962
107 H GLY 18 HN GLY 18 -1.357 5.591 2.082
108 HA2 GLY 18 HA1 GLY 18 0.584 4.743 1.238
109 HA3 GLY 18 HA2 GLY 18 1.288 6.299 1.630
110 H VAL 19 HN VAL 19 2.043 3.363 1.774
111 HA VAL 19 HA VAL 19 3.878 3.482 3.934
112 HB VAL 19 HB VAL 19 1.557 1.540 4.170
113 HG11 VAL 19 HG11 VAL 19 3.629 0.266 4.358
114 HG12 VAL 19 HG12 VAL 19 4.215 1.385 5.587
115 HG13 VAL 19 HG13 VAL 19 2.811 0.373 5.916
116 HG21 VAL 19 HG21 VAL 19 1.520 2.304 6.519
117 HG22 VAL 19 HG22 VAL 19 2.806 3.451 6.144
118 HG23 VAL 19 HG23 VAL 19 1.227 3.611 5.373
119 H CYS 20 HN CYS 20 5.679 2.506 3.004
120 HA CYS 20 HA CYS 20 5.118 0.653 0.797
121 HB2 CYS 20 HB2 CYS 20 7.701 1.434 0.370
122 HB3 CYS 20 HB3 CYS 20 6.294 2.156 -0.397
123 H MET 21 HN MET 21 5.728 -1.387 1.011
124 HA MET 21 HA MET 21 8.166 -2.072 2.348
125 HB2 MET 21 HB2 MET 21 7.165 -3.415 4.134
126 HB3 MET 21 HB3 MET 21 6.766 -1.723 4.297
127 HG2 MET 21 HG2 MET 21 4.550 -2.095 3.479
128 HG3 MET 21 HG3 MET 21 4.921 -3.775 3.103
129 HE1 MET 21 HE1 MET 21 4.763 -2.118 7.412
130 HE2 MET 21 HE2 MET 21 6.092 -1.795 6.299
131 HE3 MET 21 HE3 MET 21 4.491 -1.124 5.982
132 H TYR 22 HN TYR 22 8.879 -3.356 0.780
133 HA TYR 22 HA TYR 22 8.118 -6.010 0.801
134 HB2 TYR 22 HB2 TYR 22 6.453 -4.767 -0.865
135 HB3 TYR 22 HB3 TYR 22 7.822 -4.959 -1.945
136 HD1 TYR 22 HD1 TYR 22 8.215 -7.684 0.030
137 HD2 TYR 22 HD2 TYR 22 5.479 -6.175 -2.856
138 HE1 TYR 22 HE1 TYR 22 7.493 -9.980 -0.477
139 HE2 TYR 22 HE2 TYR 22 4.750 -8.465 -3.370
140 HH TYR 22 HH TYR 22 5.600 -11.156 -1.433
141 H ILE 23 HN ILE 23 9.626 -3.445 -0.953
142 HA ILE 23 HA ILE 23 11.679 -3.990 -2.298
143 HB ILE 23 HB ILE 23 13.227 -2.581 -0.775
144 HG12 ILE 23 HG12 ILE 23 10.567 -2.323 0.628
145 HG13 ILE 23 HG13 ILE 23 12.059 -2.943 1.322
146 HG21 ILE 23 HG21 ILE 23 12.051 -0.538 -1.465
147 HG22 ILE 23 HG22 ILE 23 12.107 -1.734 -2.760
148 HG23 ILE 23 HG23 ILE 23 10.619 -1.497 -1.840
149 HD11 ILE 23 HD11 ILE 23 11.605 -0.115 0.399
150 HD12 ILE 23 HD12 ILE 23 11.572 -0.675 2.073
151 HD13 ILE 23 HD13 ILE 23 13.072 -0.746 1.149
152 H GLU 24 HN GLU 24 12.378 -6.003 -2.406
153 HA GLU 24 HA GLU 24 13.830 -7.190 -0.156
154 HB2 GLU 24 HB2 GLU 24 12.549 -8.228 -2.661
155 HB3 GLU 24 HB3 GLU 24 13.752 -9.198 -1.811
156 HG2 GLU 24 HG2 GLU 24 11.320 -8.085 -0.469
157 HG3 GLU 24 HG3 GLU 24 11.325 -9.654 -1.281
158 H ALA 25 HN ALA 25 14.530 -5.243 -2.674
159 HA ALA 25 HA ALA 25 16.243 -4.871 -4.108
160 HB1 ALA 25 HB1 ALA 25 18.404 -5.993 -3.827
161 HB2 ALA 25 HB2 ALA 25 17.801 -5.386 -2.286
162 HB3 ALA 25 HB3 ALA 25 17.681 -7.103 -2.662
163 H LEU 26 HN LEU 26 14.168 -7.097 -4.066
164 HA LEU 26 HA LEU 26 15.021 -8.482 -6.488
165 HB2 LEU 26 HB2 LEU 26 12.823 -9.231 -4.554
166 HB3 LEU 26 HB3 LEU 26 13.280 -10.140 -5.983
167 HG LEU 26 HG LEU 26 15.017 -9.727 -3.548
168 HD11 LEU 26 HD11 LEU 26 13.533 -12.163 -4.527
169 HD12 LEU 26 HD12 LEU 26 14.654 -12.120 -3.168
170 HD13 LEU 26 HD13 LEU 26 13.145 -11.212 -3.094
171 HD21 LEU 26 HD21 LEU 26 16.334 -9.913 -5.593
172 HD22 LEU 26 HD22 LEU 26 16.506 -11.360 -4.598
173 HD23 LEU 26 HD23 LEU 26 15.469 -11.388 -6.026
174 H ASP 27 HN ASP 27 13.726 -5.863 -5.530
175 HA ASP 27 HA ASP 27 12.691 -4.233 -6.729
176 HB2 ASP 27 HB2 ASP 27 13.427 -5.768 -8.691
177 HB3 ASP 27 HB3 ASP 27 11.718 -6.197 -8.765
178 H LYS 28 HN LYS 28 11.655 -5.180 -4.647
179 HA LYS 28 HA LYS 28 8.843 -5.856 -5.151
180 HB2 LYS 28 HB2 LYS 28 10.685 -6.097 -2.797
181 HB3 LYS 28 HB3 LYS 28 8.951 -6.260 -2.594
182 HG2 LYS 28 HG2 LYS 28 10.728 -7.955 -4.356
183 HG3 LYS 28 HG3 LYS 28 10.098 -8.423 -2.784
184 HD2 LYS 28 HD2 LYS 28 8.663 -9.497 -4.254
185 HD3 LYS 28 HD3 LYS 28 7.776 -8.034 -3.838
186 HE2 LYS 28 HE2 LYS 28 7.593 -8.433 -6.204
187 HE3 LYS 28 HE3 LYS 28 8.579 -6.999 -5.937
188 HZ1 LYS 28 HZ1 LYS 28 9.692 -9.704 -6.475
189 HZ2 LYS 28 HZ2 LYS 28 10.546 -8.244 -6.410
190 HZ3 LYS 28 HZ3 LYS 28 9.446 -8.521 -7.663
191 H TYR 29 HN TYR 29 7.191 -4.588 -4.344
192 HA TYR 29 HA TYR 29 7.638 -2.410 -2.575
193 HB2 TYR 29 HB2 TYR 29 8.518 -1.496 -4.766
194 HB3 TYR 29 HB3 TYR 29 6.881 -1.647 -5.398
195 HD1 TYR 29 HD1 TYR 29 5.103 -0.163 -4.624
196 HD2 TYR 29 HD2 TYR 29 9.069 0.197 -3.128
197 HE1 TYR 29 HE1 TYR 29 4.540 2.036 -3.679
198 HE2 TYR 29 HE2 TYR 29 8.516 2.396 -2.180
199 HH TYR 29 HH TYR 29 6.900 4.182 -2.497
200 H ALA 30 HN ALA 30 5.910 -3.049 -1.378
201 HA ALA 30 HA ALA 30 3.291 -2.882 -2.709
202 HB1 ALA 30 HB1 ALA 30 4.044 -4.290 -0.141
203 HB2 ALA 30 HB2 ALA 30 2.407 -4.156 -0.782
204 HB3 ALA 30 HB3 ALA 30 3.630 -5.058 -1.674
205 H CYS 31 HN CYS 31 1.852 -1.347 -1.947
206 HA CYS 31 HA CYS 31 2.825 0.269 0.292
207 HB2 CYS 31 HB2 CYS 31 3.140 1.476 -1.847
208 HB3 CYS 31 HB3 CYS 31 1.402 1.364 -2.136
209 H ASN 32 HN ASN 32 1.385 0.993 1.731
210 HA ASN 32 HA ASN 32 -1.298 -0.195 1.537
211 HB2 ASN 32 HB2 ASN 32 0.430 -1.402 2.950
212 HB3 ASN 32 HB3 ASN 32 0.364 -0.026 4.041
213 HD21 ASN 32 HD21 ASN 32 -0.378 -1.417 5.691
214 HD22 ASN 32 HD22 ASN 32 -2.031 -1.947 5.730
215 H CYS 33 HN CYS 33 -2.612 1.499 1.350
216 HA CYS 33 HA CYS 33 -2.140 3.913 2.898
217 HB2 CYS 33 HB2 CYS 33 -4.068 3.209 0.693
218 HB3 CYS 33 HB3 CYS 33 -4.261 4.674 1.647
219 H VAL 34 HN VAL 34 -5.247 2.434 2.135
220 HA VAL 34 HA VAL 34 -5.925 2.202 4.946
221 HB VAL 34 HB VAL 34 -6.219 4.625 4.221
222 HG11 VAL 34 HG11 VAL 34 -7.030 4.275 1.982
223 HG12 VAL 34 HG12 VAL 34 -8.458 3.440 2.594
224 HG13 VAL 34 HG13 VAL 34 -8.234 5.158 2.921
225 HG21 VAL 34 HG21 VAL 34 -7.348 3.725 6.189
226 HG22 VAL 34 HG22 VAL 34 -8.388 4.875 5.348
227 HG23 VAL 34 HG23 VAL 34 -8.671 3.143 5.180
228 H VAL 35 HN VAL 35 -7.970 1.086 5.228
229 HA VAL 35 HA VAL 35 -8.526 -0.808 3.207
230 HB VAL 35 HB VAL 35 -10.342 -1.616 4.621
231 HG11 VAL 35 HG11 VAL 35 -8.075 -2.330 5.111
232 HG12 VAL 35 HG12 VAL 35 -7.837 -0.930 6.156
233 HG13 VAL 35 HG13 VAL 35 -9.000 -2.176 6.605
234 HG21 VAL 35 HG21 VAL 35 -9.717 0.748 6.405
235 HG22 VAL 35 HG22 VAL 35 -11.196 0.525 5.471
236 HG23 VAL 35 HG23 VAL 35 -10.814 -0.577 6.796
237 H GLY 36 HN GLY 36 -8.922 0.402 1.422
238 HA2 GLY 36 HA1 GLY 36 -11.433 0.964 0.523
239 HA3 GLY 36 HA2 GLY 36 -10.935 2.451 1.333
240 H TYR 37 HN TYR 37 -8.092 1.689 0.654
241 HA TYR 37 HA TYR 37 -8.082 1.975 -2.262
242 HB2 TYR 37 HB2 TYR 37 -6.630 3.758 -0.305
243 HB3 TYR 37 HB3 TYR 37 -6.154 3.615 -1.991
244 HD1 TYR 37 HD1 TYR 37 -7.814 4.306 -3.772
245 HD2 TYR 37 HD2 TYR 37 -8.384 5.177 0.353
246 HE1 TYR 37 HE1 TYR 37 -9.454 6.036 -4.368
247 HE2 TYR 37 HE2 TYR 37 -10.022 6.916 -0.235
248 HH TYR 37 HH TYR 37 -11.396 7.176 -3.303
249 H ILE 38 HN ILE 38 -7.216 -0.051 -2.673
250 HA ILE 38 HA ILE 38 -4.369 -0.114 -2.150
251 HB ILE 38 HB ILE 38 -5.744 -1.541 -0.413
252 HG12 ILE 38 HG12 ILE 38 -3.330 -1.253 -0.460
253 HG13 ILE 38 HG13 ILE 38 -3.758 -2.915 -0.074
254 HG21 ILE 38 HG21 ILE 38 -5.851 -3.898 -0.980
255 HG22 ILE 38 HG22 ILE 38 -6.905 -2.943 -2.025
256 HG23 ILE 38 HG23 ILE 38 -5.357 -3.532 -2.634
257 HD11 ILE 38 HD11 ILE 38 -3.214 -3.594 -2.344
258 HD12 ILE 38 HD12 ILE 38 -2.832 -1.924 -2.760
259 HD13 ILE 38 HD13 ILE 38 -1.846 -2.786 -1.580
260 H GLY 39 HN GLY 39 -3.532 -0.135 -4.103
261 HA2 GLY 39 HA1 GLY 39 -3.966 -2.308 -5.875
262 HA3 GLY 39 HA2 GLY 39 -4.717 -0.837 -6.486
263 H GLU 40 HN GLU 40 -1.846 -2.601 -6.222
264 HA GLU 40 HA GLU 40 0.263 -2.315 -6.974
265 HB2 GLU 40 HB2 GLU 40 -0.692 -1.285 -8.955
266 HB3 GLU 40 HB3 GLU 40 -0.842 0.255 -8.122
267 HG2 GLU 40 HG2 GLU 40 1.579 0.427 -7.978
268 HG3 GLU 40 HG3 GLU 40 1.746 -1.139 -8.773
269 H ARG 41 HN ARG 41 -1.084 0.702 -5.753
270 HA ARG 41 HA ARG 41 0.995 0.895 -3.758
271 HB2 ARG 41 HB2 ARG 41 1.546 3.242 -4.486
272 HB3 ARG 41 HB3 ARG 41 2.090 1.967 -5.569
273 HG2 ARG 41 HG2 ARG 41 1.260 3.505 -7.058
274 HG3 ARG 41 HG3 ARG 41 -0.139 2.443 -6.823
275 HD2 ARG 41 HD2 ARG 41 -1.157 3.974 -5.330
276 HD3 ARG 41 HD3 ARG 41 0.305 4.956 -5.223
277 HE ARG 41 HE ARG 41 -1.579 4.873 -7.477
278 HH11 ARG 41 HH12 ARG 41 1.243 6.237 -5.939
279 HH12 ARG 41 HH11 ARG 41 1.237 7.684 -6.895
280 HH21 ARG 41 HH22 ARG 41 -1.622 6.787 -8.735
281 HH22 ARG 41 HH21 ARG 41 -0.389 7.994 -8.500
282 H CYS 42 HN CYS 42 -1.549 0.296 -3.447
283 HA CYS 42 HA CYS 42 -3.488 0.689 -2.445
284 HB2 CYS 42 HB2 CYS 42 -3.544 2.371 -0.601
285 HB3 CYS 42 HB3 CYS 42 -2.299 1.143 -0.483
286 H GLN 43 HN GLN 43 -4.849 1.164 -4.136
287 HA GLN 43 HA GLN 43 -6.064 3.708 -4.082
288 HB2 GLN 43 HB2 GLN 43 -5.498 4.585 -6.235
289 HB3 GLN 43 HB3 GLN 43 -4.004 4.285 -5.362
290 HG2 GLN 43 HG2 GLN 43 -3.561 2.324 -6.638
291 HG3 GLN 43 HG3 GLN 43 -5.159 2.384 -7.383
292 HE21 GLN 43 HE21 GLN 43 -4.329 2.473 -9.464
293 HE22 GLN 43 HE22 GLN 43 -3.564 3.888 -10.092
294 H TYR 44 HN TYR 44 -6.371 0.529 -4.474
295 HA TYR 44 HA TYR 44 -8.554 0.877 -6.387
296 HB2 TYR 44 HB2 TYR 44 -6.446 -1.253 -6.438
297 HB3 TYR 44 HB3 TYR 44 -8.053 -1.568 -7.088
298 HD1 TYR 44 HD1 TYR 44 -8.873 0.666 -8.554
299 HD2 TYR 44 HD2 TYR 44 -4.911 -0.794 -8.056
300 HE1 TYR 44 HE1 TYR 44 -8.222 1.726 -10.675
301 HE2 TYR 44 HE2 TYR 44 -4.247 0.262 -10.169
302 HH TYR 44 HH TYR 44 -5.268 1.022 -12.237
303 H ARG 45 HN ARG 45 -9.890 1.144 -4.701
304 HA ARG 45 HA ARG 45 -11.601 0.414 -3.422
305 HB2 ARG 45 HB2 ARG 45 -10.814 -2.282 -4.519
306 HB3 ARG 45 HB3 ARG 45 -12.325 -1.932 -3.683
307 HG2 ARG 45 HG2 ARG 45 -13.044 -1.778 -5.839
308 HG3 ARG 45 HG3 ARG 45 -12.540 -0.106 -5.586
309 HD2 ARG 45 HD2 ARG 45 -11.619 -0.704 -7.662
310 HD3 ARG 45 HD3 ARG 45 -10.265 -0.829 -6.520
311 HE ARG 45 HE ARG 45 -11.127 -3.331 -6.500
312 HH11 ARG 45 HH12 ARG 45 -10.743 -1.189 -9.256
313 HH12 ARG 45 HH11 ARG 45 -10.404 -2.489 -10.364
314 HH21 ARG 45 HH22 ARG 45 -10.685 -5.015 -7.957
315 HH22 ARG 45 HH21 ARG 45 -10.361 -4.660 -9.626
316 H ASP 46 HN ASP 46 -11.943 -1.907 -2.000
317 HA ASP 46 HA ASP 46 -9.915 -1.480 0.077
318 HB2 ASP 46 HB2 ASP 46 -12.147 -2.327 1.428
319 HB3 ASP 46 HB3 ASP 46 -11.656 -0.647 1.244
320 H LEU 47 HN LEU 47 -9.370 -3.312 -1.715
321 HA LEU 47 HA LEU 47 -10.311 -5.895 -1.451
322 HB2 LEU 47 HB2 LEU 47 -7.455 -5.035 -1.920
323 HB3 LEU 47 HB3 LEU 47 -8.118 -6.616 -2.276
324 HG LEU 47 HG LEU 47 -8.960 -4.046 -3.618
325 HD11 LEU 47 HD11 LEU 47 -7.794 -4.953 -5.575
326 HD12 LEU 47 HD12 LEU 47 -6.693 -4.671 -4.225
327 HD13 LEU 47 HD13 LEU 47 -7.228 -6.308 -4.598
328 HD21 LEU 47 HD21 LEU 47 -10.177 -5.482 -5.147
329 HD22 LEU 47 HD22 LEU 47 -9.660 -6.909 -4.246
330 HD23 LEU 47 HD23 LEU 47 -10.737 -5.734 -3.492
331 H LYS 48 HN LYS 48 -8.601 -4.054 0.862
332 HA LYS 48 HA LYS 48 -7.403 -6.287 2.191
333 HB2 LYS 48 HB2 LYS 48 -7.105 -4.507 4.060
334 HB3 LYS 48 HB3 LYS 48 -6.166 -4.382 2.581
335 HG2 LYS 48 HG2 LYS 48 -8.745 -2.947 2.617
336 HG3 LYS 48 HG3 LYS 48 -7.486 -2.334 3.684
337 HD2 LYS 48 HD2 LYS 48 -6.802 -2.952 0.856
338 HD3 LYS 48 HD3 LYS 48 -7.719 -1.490 1.202
339 HE2 LYS 48 HE2 LYS 48 -5.311 -1.055 1.103
340 HE3 LYS 48 HE3 LYS 48 -5.980 -0.718 2.698
341 HZ1 LYS 48 HZ1 LYS 48 -4.576 -3.255 2.018
342 HZ2 LYS 48 HZ2 LYS 48 -5.069 -2.728 3.554
343 HZ3 LYS 48 HZ3 LYS 48 -3.825 -1.917 2.744
344 H TRP 49 HN TRP 49 -9.948 -3.994 3.266
345 HA TRP 49 HA TRP 49 -10.704 -6.033 5.201
346 HB2 TRP 49 HB2 TRP 49 -10.086 -3.667 5.906
347 HB3 TRP 49 HB3 TRP 49 -11.652 -3.182 5.251
348 HD1 TRP 49 HD1 TRP 49 -10.576 -6.152 7.511
349 HE1 TRP 49 HE1 TRP 49 -12.164 -6.249 9.534
350 HE3 TRP 49 HE3 TRP 49 -13.482 -2.086 6.451
351 HZ2 TRP 49 HZ2 TRP 49 -14.344 -4.792 10.544
352 HZ3 TRP 49 HZ3 TRP 49 -15.299 -1.508 8.003
353 HH2 TRP 49 HH2 TRP 49 -15.720 -2.830 10.004
354 H TRP 50 HN TRP 50 -12.164 -4.056 2.634
355 HA TRP 50 HA TRP 50 -14.796 -5.087 3.409
356 HB2 TRP 50 HB2 TRP 50 -14.049 -2.919 1.447
357 HB3 TRP 50 HB3 TRP 50 -15.693 -3.428 1.794
358 HD1 TRP 50 HD1 TRP 50 -12.772 -1.488 3.331
359 HE1 TRP 50 HE1 TRP 50 -13.688 -0.024 5.242
360 HE3 TRP 50 HE3 TRP 50 -17.547 -3.294 3.508
361 HZ2 TRP 50 HZ2 TRP 50 -16.114 0.310 6.643
362 HZ3 TRP 50 HZ3 TRP 50 -19.109 -2.344 5.160
363 HH2 TRP 50 HH2 TRP 50 -18.405 -0.582 6.693
364 H GLU 51 HN GLU 51 -13.104 -4.515 0.318
365 HA GLU 51 HA GLU 51 -14.869 -5.818 -1.335
366 HB2 GLU 51 HB2 GLU 51 -11.917 -5.306 -1.520
367 HB3 GLU 51 HB3 GLU 51 -12.741 -6.208 -2.787
368 HG2 GLU 51 HG2 GLU 51 -13.484 -3.448 -1.870
369 HG3 GLU 51 HG3 GLU 51 -12.461 -3.804 -3.260
370 H LEU 52 HN LEU 52 -11.842 -7.193 -0.106
371 HA LEU 52 HA LEU 52 -12.762 -9.839 -0.915
372 HB2 LEU 52 HB2 LEU 52 -10.083 -9.020 0.185
373 HB3 LEU 52 HB3 LEU 52 -10.471 -10.525 -0.639
374 HG LEU 52 HG LEU 52 -10.444 -7.766 -1.865
375 HD11 LEU 52 HD11 LEU 52 -8.535 -8.636 -3.155
376 HD12 LEU 52 HD12 LEU 52 -8.211 -8.592 -1.422
377 HD13 LEU 52 HD13 LEU 52 -8.591 -10.123 -2.209
378 HD21 LEU 52 HD21 LEU 52 -11.007 -10.457 -3.113
379 HD22 LEU 52 HD22 LEU 52 -12.147 -9.127 -2.916
380 HD23 LEU 52 HD23 LEU 52 -10.771 -8.954 -4.006
381 H ARG 53 HN ARG 53 -11.899 -7.961 1.855
382 HA ARG 53 HA ARG 53 -12.103 -8.228 4.095
383 HB2 ARG 53 HB2 ARG 53 -14.417 -8.901 3.635
384 HB3 ARG 53 HB3 ARG 53 -13.897 -10.557 3.364
385 HG2 ARG 53 HG2 ARG 53 -14.809 -10.498 5.537
386 HG3 ARG 53 HG3 ARG 53 -13.059 -10.563 5.745
387 HD2 ARG 53 HD2 ARG 53 -13.322 -8.823 7.116
388 HD3 ARG 53 HD3 ARG 53 -13.549 -7.871 5.651
389 HE ARG 53 HE ARG 53 -15.900 -9.110 6.882
390 HH11 ARG 53 HH12 ARG 53 -14.109 -6.223 6.046
391 HH12 ARG 53 HH11 ARG 53 -15.356 -5.145 6.585
392 HH21 ARG 53 HH22 ARG 53 -17.538 -7.704 7.583
393 HH22 ARG 53 HH21 ARG 53 -17.308 -5.979 7.470
Start of MODEL 7
1 H1 ASN 1 H1 ASN 1 17.996 -8.586 1.466
2 H2 ASN 1 H2 ASN 1 17.854 -8.912 3.117
3 H3 ASN 1 H3 ASN 1 18.572 -7.466 2.609
4 HA ASN 1 HA ASN 1 16.338 -7.080 3.401
5 HB2 ASN 1 HB2 ASN 1 16.830 -6.739 0.448
6 HB3 ASN 1 HB3 ASN 1 15.387 -6.102 1.231
7 HD21 ASN 1 HD21 ASN 1 17.515 -4.660 -0.099
8 HD22 ASN 1 HD22 ASN 1 18.187 -3.581 1.078
9 H SER 2 HN SER 2 14.137 -7.417 3.256
10 HA SER 2 HA SER 2 12.750 -9.141 1.587
11 HB2 SER 2 HB2 SER 2 12.462 -11.109 3.162
12 HB3 SER 2 HB3 SER 2 14.046 -11.003 2.394
13 HG SER 2 HG SER 2 14.226 -9.622 4.622
14 H ASP 3 HN ASP 3 10.966 -7.926 1.786
15 HA ASP 3 HA ASP 3 9.271 -6.697 2.653
16 HB2 ASP 3 HB2 ASP 3 8.853 -8.971 3.762
17 HB3 ASP 3 HB3 ASP 3 9.545 -8.264 5.218
18 H SER 4 HN SER 4 11.550 -5.454 2.670
19 HA SER 4 HA SER 4 12.182 -4.432 5.301
20 HB2 SER 4 HB2 SER 4 13.303 -3.712 2.584
21 HB3 SER 4 HB3 SER 4 13.969 -3.219 4.143
22 HG SER 4 HG SER 4 14.541 -5.292 4.577
23 H GLU 5 HN GLU 5 12.185 -2.140 5.752
24 HA GLU 5 HA GLU 5 9.791 -0.866 4.700
25 HB2 GLU 5 HB2 GLU 5 10.190 0.736 6.603
26 HB3 GLU 5 HB3 GLU 5 9.900 -0.931 7.079
27 HG2 GLU 5 HG2 GLU 5 12.384 -1.217 7.249
28 HG3 GLU 5 HG3 GLU 5 12.533 0.521 6.999
29 H CYS 6 HN CYS 6 9.768 1.041 3.602
30 HA CYS 6 HA CYS 6 12.370 2.053 2.707
31 HB2 CYS 6 HB2 CYS 6 10.383 3.348 1.235
32 HB3 CYS 6 HB3 CYS 6 11.382 2.004 0.698
33 HA PRO 7 HA PRO 7 12.183 5.774 5.093
34 HB2 PRO 7 HB2 PRO 7 13.123 7.051 2.571
35 HB3 PRO 7 HB3 PRO 7 13.791 7.157 4.204
36 HG2 PRO 7 HG2 PRO 7 14.984 5.661 2.368
37 HG3 PRO 7 HG3 PRO 7 14.846 5.089 4.042
38 HD2 PRO 7 HD2 PRO 7 13.272 4.288 1.629
39 HD3 PRO 7 HD3 PRO 7 13.854 3.289 2.976
40 H LEU 8 HN LEU 8 11.278 7.996 4.989
41 HA LEU 8 HA LEU 8 8.533 7.658 4.632
42 HB2 LEU 8 HB2 LEU 8 10.219 10.019 5.314
43 HB3 LEU 8 HB3 LEU 8 8.493 10.183 5.081
44 HG LEU 8 HG LEU 8 8.107 8.541 6.889
45 HD11 LEU 8 HD11 LEU 8 11.086 8.731 7.313
46 HD12 LEU 8 HD12 LEU 8 9.936 7.916 8.373
47 HD13 LEU 8 HD13 LEU 8 10.214 7.310 6.740
48 HD21 LEU 8 HD21 LEU 8 8.077 10.932 7.339
49 HD22 LEU 8 HD22 LEU 8 8.721 10.038 8.717
50 HD23 LEU 8 HD23 LEU 8 9.815 10.907 7.641
51 H SER 9 HN SER 9 10.642 8.400 2.186
52 HA SER 9 HA SER 9 8.910 10.287 0.840
53 HB2 SER 9 HB2 SER 9 10.757 10.014 -0.971
54 HB3 SER 9 HB3 SER 9 11.150 10.867 0.524
55 HG SER 9 HG SER 9 12.353 9.215 1.191
56 H HIS 10 HN HIS 10 9.453 6.922 1.017
57 HA HIS 10 HA HIS 10 8.317 6.449 -1.631
58 HB2 HIS 10 HB2 HIS 10 9.686 4.694 0.374
59 HB3 HIS 10 HB3 HIS 10 8.668 3.976 -0.872
60 HD1 HIS 10 HD1 HIS 10 11.890 5.886 -0.436
61 HD2 HIS 10 HD2 HIS 10 9.717 3.995 -3.439
62 HE1 HIS 10 HE1 HIS 10 13.430 5.771 -2.414
63 HE2 HIS 10 HE2 HIS 10 12.030 4.813 -4.277
64 H ASP 11 HN ASP 11 7.437 6.211 1.747
65 HA ASP 11 HA ASP 11 4.884 5.012 1.129
66 HB2 ASP 11 HB2 ASP 11 4.415 5.147 3.485
67 HB3 ASP 11 HB3 ASP 11 6.079 4.602 3.304
68 H GLY 12 HN GLY 12 6.275 8.151 1.794
69 HA2 GLY 12 HA1 GLY 12 3.854 9.628 1.623
70 HA3 GLY 12 HA2 GLY 12 5.478 10.269 1.387
71 H TYR 13 HN TYR 13 6.099 8.308 -0.705
72 HA TYR 13 HA TYR 13 5.073 9.615 -2.994
73 HB2 TYR 13 HB2 TYR 13 7.227 8.325 -2.866
74 HB3 TYR 13 HB3 TYR 13 6.274 6.845 -2.890
75 HD1 TYR 13 HD2 TYR 13 6.536 10.026 -4.860
76 HD2 TYR 13 HD1 TYR 13 6.073 5.795 -4.920
77 HE1 TYR 13 HE2 TYR 13 6.524 10.065 -7.319
78 HE2 TYR 13 HE1 TYR 13 6.061 5.825 -7.379
79 HH TYR 13 HH TYR 13 6.905 8.644 -9.187
80 H CYS 14 HN CYS 14 3.759 7.159 -0.994
81 HA CYS 14 HA CYS 14 1.954 6.090 -2.941
82 HB2 CYS 14 HB2 CYS 14 2.091 5.906 0.063
83 HB3 CYS 14 HB3 CYS 14 0.726 5.257 -0.842
84 H LEU 15 HN LEU 15 -0.550 6.317 -1.339
85 HA LEU 15 HA LEU 15 -1.088 8.976 -2.463
86 HB2 LEU 15 HB2 LEU 15 -2.942 6.615 -2.370
87 HB3 LEU 15 HB3 LEU 15 -3.310 8.184 -3.062
88 HG LEU 15 HG LEU 15 -1.260 6.211 -4.057
89 HD11 LEU 15 HD11 LEU 15 -3.529 5.598 -4.621
90 HD12 LEU 15 HD12 LEU 15 -3.844 7.222 -5.236
91 HD13 LEU 15 HD13 LEU 15 -2.690 6.175 -6.059
92 HD21 LEU 15 HD21 LEU 15 -0.417 8.472 -4.337
93 HD22 LEU 15 HD22 LEU 15 -0.890 7.796 -5.896
94 HD23 LEU 15 HD23 LEU 15 -1.936 8.965 -5.088
95 H HIS 16 HN HIS 16 -3.284 6.961 -0.510
96 HA HIS 16 HA HIS 16 -3.987 9.534 0.731
97 HB2 HIS 16 HB2 HIS 16 -5.588 7.759 -0.650
98 HB3 HIS 16 HB3 HIS 16 -5.973 7.416 1.033
99 HD1 HIS 16 HD1 HIS 16 -7.958 8.717 1.758
100 HD2 HIS 16 HD2 HIS 16 -5.593 10.842 -0.930
101 HE1 HIS 16 HE1 HIS 16 -9.118 10.923 1.419
102 HE2 HIS 16 HE2 HIS 16 -7.748 12.134 -0.316
103 H ASP 17 HN ASP 17 -1.989 7.648 1.601
104 HA ASP 17 HA ASP 17 -2.085 8.067 4.308
105 HB2 ASP 17 HB2 ASP 17 -3.930 6.408 4.348
106 HB3 ASP 17 HB3 ASP 17 -2.850 5.210 3.641
107 H GLY 18 HN GLY 18 -1.229 5.581 1.977
108 HA2 GLY 18 HA1 GLY 18 0.757 4.710 1.302
109 HA3 GLY 18 HA2 GLY 18 1.418 6.284 1.682
110 H VAL 19 HN VAL 19 1.352 2.988 2.448
111 HA VAL 19 HA VAL 19 3.622 3.454 4.249
112 HB VAL 19 HB VAL 19 1.485 1.363 4.787
113 HG11 VAL 19 HG11 VAL 19 4.019 2.026 6.284
114 HG12 VAL 19 HG12 VAL 19 2.784 0.885 6.819
115 HG13 VAL 19 HG13 VAL 19 3.705 0.565 5.348
116 HG21 VAL 19 HG21 VAL 19 1.058 2.595 6.868
117 HG22 VAL 19 HG22 VAL 19 2.190 3.845 6.351
118 HG23 VAL 19 HG23 VAL 19 0.703 3.569 5.442
119 H CYS 20 HN CYS 20 5.384 2.194 3.549
120 HA CYS 20 HA CYS 20 4.711 0.206 1.487
121 HB2 CYS 20 HB2 CYS 20 6.519 0.987 0.087
122 HB3 CYS 20 HB3 CYS 20 5.464 2.344 0.461
123 H MET 21 HN MET 21 5.631 -1.718 1.745
124 HA MET 21 HA MET 21 8.352 -1.965 2.532
125 HB2 MET 21 HB2 MET 21 8.004 -3.275 4.585
126 HB3 MET 21 HB3 MET 21 7.452 -1.625 4.749
127 HG2 MET 21 HG2 MET 21 5.137 -2.405 4.367
128 HG3 MET 21 HG3 MET 21 5.737 -4.063 4.351
129 HE1 MET 21 HE1 MET 21 6.024 -1.275 8.021
130 HE2 MET 21 HE2 MET 21 7.063 -1.118 6.604
131 HE3 MET 21 HE3 MET 21 5.336 -0.791 6.470
132 H TYR 22 HN TYR 22 9.005 -3.446 1.095
133 HA TYR 22 HA TYR 22 8.273 -6.128 1.426
134 HB2 TYR 22 HB2 TYR 22 6.546 -4.872 -0.286
135 HB3 TYR 22 HB3 TYR 22 7.742 -5.578 -1.370
136 HD1 TYR 22 HD1 TYR 22 5.776 -6.595 1.669
137 HD2 TYR 22 HD2 TYR 22 7.304 -7.696 -2.144
138 HE1 TYR 22 HE1 TYR 22 4.670 -8.787 1.859
139 HE2 TYR 22 HE2 TYR 22 6.203 -9.883 -1.965
140 HH TYR 22 HH TYR 22 5.325 -11.374 -0.311
141 H ILE 23 HN ILE 23 9.819 -3.768 -0.579
142 HA ILE 23 HA ILE 23 11.620 -4.732 -2.119
143 HB ILE 23 HB ILE 23 13.513 -3.449 -0.804
144 HG12 ILE 23 HG12 ILE 23 11.882 -3.312 1.223
145 HG13 ILE 23 HG13 ILE 23 12.846 -1.904 0.792
146 HG21 ILE 23 HG21 ILE 23 12.563 -2.790 -2.932
147 HG22 ILE 23 HG22 ILE 23 11.167 -2.090 -2.113
148 HG23 ILE 23 HG23 ILE 23 12.769 -1.390 -1.879
149 HD11 ILE 23 HD11 ILE 23 10.583 -1.255 1.333
150 HD12 ILE 23 HD12 ILE 23 10.907 -0.954 -0.374
151 HD13 ILE 23 HD13 ILE 23 9.948 -2.354 0.108
152 H GLU 24 HN GLU 24 12.340 -6.682 -2.207
153 HA GLU 24 HA GLU 24 13.707 -7.934 0.089
154 HB2 GLU 24 HB2 GLU 24 12.203 -9.004 -2.279
155 HB3 GLU 24 HB3 GLU 24 13.188 -10.046 -1.257
156 HG2 GLU 24 HG2 GLU 24 11.757 -9.594 0.615
157 HG3 GLU 24 HG3 GLU 24 10.863 -8.393 -0.319
158 H ALA 25 HN ALA 25 14.726 -6.076 -2.093
159 HA ALA 25 HA ALA 25 16.455 -5.837 -3.546
160 HB1 ALA 25 HB1 ALA 25 17.829 -7.132 -1.969
161 HB2 ALA 25 HB2 ALA 25 17.279 -8.630 -2.722
162 HB3 ALA 25 HB3 ALA 25 18.257 -7.485 -3.643
163 H LEU 26 HN LEU 26 13.846 -7.198 -3.955
164 HA LEU 26 HA LEU 26 14.343 -8.288 -6.626
165 HB2 LEU 26 HB2 LEU 26 12.090 -8.935 -4.723
166 HB3 LEU 26 HB3 LEU 26 12.179 -9.488 -6.385
167 HG LEU 26 HG LEU 26 14.160 -10.214 -4.224
168 HD11 LEU 26 HD11 LEU 26 11.963 -11.179 -3.785
169 HD12 LEU 26 HD12 LEU 26 11.904 -11.811 -5.432
170 HD13 LEU 26 HD13 LEU 26 13.107 -12.421 -4.297
171 HD21 LEU 26 HD21 LEU 26 14.959 -11.852 -5.841
172 HD22 LEU 26 HD22 LEU 26 13.789 -11.270 -7.026
173 HD23 LEU 26 HD23 LEU 26 15.097 -10.217 -6.489
174 H ASP 27 HN ASP 27 13.571 -5.724 -4.993
175 HA ASP 27 HA ASP 27 12.649 -3.730 -5.488
176 HB2 ASP 27 HB2 ASP 27 13.582 -4.255 -7.764
177 HB3 ASP 27 HB3 ASP 27 11.985 -4.848 -8.214
178 H LYS 28 HN LYS 28 11.250 -5.074 -3.948
179 HA LYS 28 HA LYS 28 8.532 -5.427 -4.983
180 HB2 LYS 28 HB2 LYS 28 9.549 -6.146 -2.230
181 HB3 LYS 28 HB3 LYS 28 8.080 -6.708 -3.022
182 HG2 LYS 28 HG2 LYS 28 10.857 -7.371 -3.977
183 HG3 LYS 28 HG3 LYS 28 9.874 -8.413 -2.944
184 HD2 LYS 28 HD2 LYS 28 8.953 -7.423 -5.637
185 HD3 LYS 28 HD3 LYS 28 9.830 -8.939 -5.421
186 HE2 LYS 28 HE2 LYS 28 7.270 -8.279 -3.973
187 HE3 LYS 28 HE3 LYS 28 7.322 -9.130 -5.517
188 HZ1 LYS 28 HZ1 LYS 28 8.628 -10.050 -3.001
189 HZ2 LYS 28 HZ2 LYS 28 8.634 -10.867 -4.489
190 HZ3 LYS 28 HZ3 LYS 28 7.179 -10.662 -3.645
191 H TYR 29 HN TYR 29 6.791 -4.488 -3.927
192 HA TYR 29 HA TYR 29 7.236 -2.429 -1.949
193 HB2 TYR 29 HB2 TYR 29 6.258 -1.798 -4.743
194 HB3 TYR 29 HB3 TYR 29 6.012 -0.723 -3.373
195 HD1 TYR 29 HD1 TYR 29 8.097 0.157 -2.167
196 HD2 TYR 29 HD2 TYR 29 8.241 -1.722 -5.985
197 HE1 TYR 29 HE1 TYR 29 10.300 1.176 -2.583
198 HE2 TYR 29 HE2 TYR 29 10.440 -0.711 -6.405
199 HH TYR 29 HH TYR 29 11.726 1.255 -5.644
200 H ALA 30 HN ALA 30 5.812 -3.339 -0.558
201 HA ALA 30 HA ALA 30 3.049 -3.616 -1.504
202 HB1 ALA 30 HB1 ALA 30 2.613 -4.777 0.612
203 HB2 ALA 30 HB2 ALA 30 3.915 -5.553 -0.289
204 HB3 ALA 30 HB3 ALA 30 4.290 -4.527 1.097
205 H CYS 31 HN CYS 31 2.094 -1.695 -1.445
206 HA CYS 31 HA CYS 31 2.644 0.051 0.837
207 HB2 CYS 31 HB2 CYS 31 3.145 1.121 -1.292
208 HB3 CYS 31 HB3 CYS 31 1.538 0.724 -1.900
209 H ASN 32 HN ASN 32 0.981 0.781 2.074
210 HA ASN 32 HA ASN 32 -1.691 -0.144 1.349
211 HB2 ASN 32 HB2 ASN 32 -2.088 -0.983 3.594
212 HB3 ASN 32 HB3 ASN 32 -0.679 -1.751 2.876
213 HD21 ASN 32 HD21 ASN 32 -1.835 0.247 5.434
214 HD22 ASN 32 HD22 ASN 32 -0.346 0.332 6.311
215 H CYS 33 HN CYS 33 -2.652 1.700 0.938
216 HA CYS 33 HA CYS 33 -2.298 3.983 2.658
217 HB2 CYS 33 HB2 CYS 33 -3.927 3.533 0.153
218 HB3 CYS 33 HB3 CYS 33 -4.040 5.014 1.107
219 H VAL 34 HN VAL 34 -5.446 2.820 1.434
220 HA VAL 34 HA VAL 34 -6.342 2.575 4.189
221 HB VAL 34 HB VAL 34 -6.489 5.005 3.462
222 HG11 VAL 34 HG11 VAL 34 -8.368 5.647 2.039
223 HG12 VAL 34 HG12 VAL 34 -7.178 4.679 1.170
224 HG13 VAL 34 HG13 VAL 34 -8.691 3.945 1.702
225 HG21 VAL 34 HG21 VAL 34 -7.757 4.171 5.351
226 HG22 VAL 34 HG22 VAL 34 -8.734 5.319 4.437
227 HG23 VAL 34 HG23 VAL 34 -9.029 3.588 4.276
228 H VAL 35 HN VAL 35 -8.216 1.351 4.380
229 HA VAL 35 HA VAL 35 -8.901 -0.357 2.250
230 HB VAL 35 HB VAL 35 -9.320 -1.208 4.378
231 HG11 VAL 35 HG11 VAL 35 -10.755 -0.164 6.055
232 HG12 VAL 35 HG12 VAL 35 -9.457 0.933 5.585
233 HG13 VAL 35 HG13 VAL 35 -11.089 1.172 4.954
234 HG21 VAL 35 HG21 VAL 35 -11.954 -0.448 3.149
235 HG22 VAL 35 HG22 VAL 35 -11.013 -1.907 2.845
236 HG23 VAL 35 HG23 VAL 35 -11.761 -1.655 4.421
237 H GLY 36 HN GLY 36 -9.389 0.670 0.478
238 HA2 GLY 36 HA1 GLY 36 -11.793 1.343 -0.420
239 HA3 GLY 36 HA2 GLY 36 -11.367 2.816 0.455
240 H TYR 37 HN TYR 37 -8.488 2.178 -0.135
241 HA TYR 37 HA TYR 37 -8.439 2.477 -3.048
242 HB2 TYR 37 HB2 TYR 37 -6.747 4.081 -1.098
243 HB3 TYR 37 HB3 TYR 37 -6.547 4.083 -2.841
244 HD1 TYR 37 HD2 TYR 37 -9.048 4.882 -0.194
245 HD2 TYR 37 HD1 TYR 37 -7.628 5.706 -4.114
246 HE1 TYR 37 HE2 TYR 37 -10.647 6.746 -0.376
247 HE2 TYR 37 HE1 TYR 37 -9.217 7.563 -4.309
248 HH TYR 37 HH TYR 37 -11.117 8.675 -1.599
249 H ILE 38 HN ILE 38 -7.684 0.403 -3.407
250 HA ILE 38 HA ILE 38 -4.872 0.111 -2.715
251 HB ILE 38 HB ILE 38 -6.356 -1.281 -1.198
252 HG12 ILE 38 HG12 ILE 38 -3.925 -1.561 -1.535
253 HG13 ILE 38 HG13 ILE 38 -4.756 -3.035 -1.059
254 HG21 ILE 38 HG21 ILE 38 -7.938 -2.161 -2.767
255 HG22 ILE 38 HG22 ILE 38 -6.649 -2.943 -3.685
256 HG23 ILE 38 HG23 ILE 38 -7.025 -3.489 -2.051
257 HD11 ILE 38 HD11 ILE 38 -4.684 -3.803 -3.396
258 HD12 ILE 38 HD12 ILE 38 -3.797 -2.343 -3.828
259 HD13 ILE 38 HD13 ILE 38 -3.079 -3.516 -2.726
260 H GLY 39 HN GLY 39 -3.785 0.142 -4.587
261 HA2 GLY 39 HA1 GLY 39 -4.460 -1.704 -6.684
262 HA3 GLY 39 HA2 GLY 39 -4.802 -0.034 -7.126
263 H GLU 40 HN GLU 40 -2.487 -2.409 -6.770
264 HA GLU 40 HA GLU 40 -0.291 -2.646 -7.072
265 HB2 GLU 40 HB2 GLU 40 -0.525 -1.365 -9.149
266 HB3 GLU 40 HB3 GLU 40 -0.369 0.140 -8.244
267 HG2 GLU 40 HG2 GLU 40 1.889 -0.392 -7.631
268 HG3 GLU 40 HG3 GLU 40 1.751 -1.999 -8.348
269 H ARG 41 HN ARG 41 -1.110 0.545 -5.978
270 HA ARG 41 HA ARG 41 0.795 0.259 -3.786
271 HB2 ARG 41 HB2 ARG 41 0.988 2.695 -3.808
272 HB3 ARG 41 HB3 ARG 41 1.375 2.024 -5.392
273 HG2 ARG 41 HG2 ARG 41 -1.435 2.731 -5.020
274 HG3 ARG 41 HG3 ARG 41 -0.319 4.109 -4.974
275 HD2 ARG 41 HD2 ARG 41 -0.769 2.103 -7.172
276 HD3 ARG 41 HD3 ARG 41 -1.071 3.838 -7.213
277 HE ARG 41 HE ARG 41 1.599 3.687 -6.763
278 HH11 ARG 41 HH12 ARG 41 -0.573 2.366 -9.163
279 HH12 ARG 41 HH11 ARG 41 0.635 2.238 -10.404
280 HH21 ARG 41 HH22 ARG 41 3.208 3.542 -8.401
281 HH22 ARG 41 HH21 ARG 41 2.794 2.890 -9.952
282 H CYS 42 HN CYS 42 -2.370 1.483 -4.758
283 HA CYS 42 HA CYS 42 -4.003 0.986 -2.743
284 HB2 CYS 42 HB2 CYS 42 -3.828 2.798 -1.068
285 HB3 CYS 42 HB3 CYS 42 -2.410 1.757 -1.063
286 H GLN 43 HN GLN 43 -5.164 1.473 -4.875
287 HA GLN 43 HA GLN 43 -6.188 4.184 -4.700
288 HB2 GLN 43 HB2 GLN 43 -5.728 4.662 -7.122
289 HB3 GLN 43 HB3 GLN 43 -4.328 4.678 -6.057
290 HG2 GLN 43 HG2 GLN 43 -3.749 2.420 -6.804
291 HG3 GLN 43 HG3 GLN 43 -5.131 2.431 -7.894
292 HE21 GLN 43 HE21 GLN 43 -3.211 5.284 -7.348
293 HE22 GLN 43 HE22 GLN 43 -2.448 5.310 -8.908
294 H TYR 44 HN TYR 44 -6.895 1.057 -5.025
295 HA TYR 44 HA TYR 44 -9.387 1.692 -6.407
296 HB2 TYR 44 HB2 TYR 44 -7.478 -0.485 -7.246
297 HB3 TYR 44 HB3 TYR 44 -9.177 -0.485 -7.697
298 HD1 TYR 44 HD1 TYR 44 -9.987 1.760 -8.857
299 HD2 TYR 44 HD2 TYR 44 -5.951 0.426 -8.710
300 HE1 TYR 44 HE1 TYR 44 -9.461 3.158 -10.808
301 HE2 TYR 44 HE2 TYR 44 -5.410 1.827 -10.659
302 HH TYR 44 HH TYR 44 -7.495 4.247 -11.806
303 H ARG 45 HN ARG 45 -10.986 1.066 -5.191
304 HA ARG 45 HA ARG 45 -12.331 -0.363 -4.047
305 HB2 ARG 45 HB2 ARG 45 -10.200 -2.361 -4.800
306 HB3 ARG 45 HB3 ARG 45 -11.755 -2.797 -4.076
307 HG2 ARG 45 HG2 ARG 45 -12.446 -3.079 -6.180
308 HG3 ARG 45 HG3 ARG 45 -12.503 -1.320 -6.266
309 HD2 ARG 45 HD2 ARG 45 -10.197 -1.289 -7.127
310 HD3 ARG 45 HD3 ARG 45 -10.156 -3.052 -7.040
311 HE ARG 45 HE ARG 45 -12.336 -2.531 -8.593
312 HH11 ARG 45 HH12 ARG 45 -8.938 -1.741 -8.778
313 HH12 ARG 45 HH11 ARG 45 -8.924 -1.610 -10.511
314 HH21 ARG 45 HH22 ARG 45 -12.322 -2.395 -10.877
315 HH22 ARG 45 HH21 ARG 45 -10.848 -1.986 -11.697
316 H ASP 46 HN ASP 46 -12.247 -2.094 -2.230
317 HA ASP 46 HA ASP 46 -10.302 -1.128 -0.260
318 HB2 ASP 46 HB2 ASP 46 -12.215 -1.776 1.396
319 HB3 ASP 46 HB3 ASP 46 -12.273 -0.230 0.566
320 H LEU 47 HN LEU 47 -9.887 -3.173 -2.016
321 HA LEU 47 HA LEU 47 -10.557 -5.749 -1.260
322 HB2 LEU 47 HB2 LEU 47 -7.985 -4.831 -2.535
323 HB3 LEU 47 HB3 LEU 47 -8.613 -6.468 -2.551
324 HG LEU 47 HG LEU 47 -9.982 -4.108 -3.850
325 HD11 LEU 47 HD11 LEU 47 -9.219 -5.062 -5.964
326 HD12 LEU 47 HD12 LEU 47 -7.856 -4.596 -4.947
327 HD13 LEU 47 HD13 LEU 47 -8.311 -6.294 -5.088
328 HD21 LEU 47 HD21 LEU 47 -11.507 -5.894 -3.201
329 HD22 LEU 47 HD22 LEU 47 -11.327 -5.820 -4.954
330 HD23 LEU 47 HD23 LEU 47 -10.494 -7.074 -4.034
331 H LYS 48 HN LYS 48 -8.347 -3.586 0.301
332 HA LYS 48 HA LYS 48 -6.640 -5.630 1.313
333 HB2 LYS 48 HB2 LYS 48 -5.980 -3.745 2.960
334 HB3 LYS 48 HB3 LYS 48 -5.514 -3.655 1.270
335 HG2 LYS 48 HG2 LYS 48 -7.263 -2.078 0.817
336 HG3 LYS 48 HG3 LYS 48 -7.903 -2.263 2.452
337 HD2 LYS 48 HD2 LYS 48 -6.632 -0.274 2.495
338 HD3 LYS 48 HD3 LYS 48 -5.658 -1.510 3.287
339 HE2 LYS 48 HE2 LYS 48 -5.320 -0.696 0.393
340 HE3 LYS 48 HE3 LYS 48 -4.382 -0.021 1.731
341 HZ1 LYS 48 HZ1 LYS 48 -3.608 -2.291 2.261
342 HZ2 LYS 48 HZ2 LYS 48 -3.138 -1.805 0.704
343 HZ3 LYS 48 HZ3 LYS 48 -4.426 -2.877 0.901
344 H TRP 49 HN TRP 49 -8.949 -3.532 3.055
345 HA TRP 49 HA TRP 49 -8.927 -5.538 5.169
346 HB2 TRP 49 HB2 TRP 49 -9.923 -2.689 5.242
347 HB3 TRP 49 HB3 TRP 49 -9.799 -3.783 6.622
348 HD1 TRP 49 HD1 TRP 49 -8.012 -0.990 5.322
349 HE1 TRP 49 HE1 TRP 49 -5.500 -1.042 5.887
350 HE3 TRP 49 HE3 TRP 49 -7.590 -5.904 6.692
351 HZ2 TRP 49 HZ2 TRP 49 -3.597 -2.921 6.787
352 HZ3 TRP 49 HZ3 TRP 49 -5.387 -6.747 7.386
353 HH2 TRP 49 HH2 TRP 49 -3.429 -5.286 7.433
354 H TRP 50 HN TRP 50 -11.186 -3.952 2.965
355 HA TRP 50 HA TRP 50 -13.409 -5.125 4.471
356 HB2 TRP 50 HB2 TRP 50 -13.221 -2.623 3.760
357 HB3 TRP 50 HB3 TRP 50 -13.804 -3.216 2.208
358 HD1 TRP 50 HD1 TRP 50 -16.309 -4.337 2.208
359 HE1 TRP 50 HE1 TRP 50 -18.334 -3.874 3.735
360 HE3 TRP 50 HE3 TRP 50 -13.886 -2.007 6.060
361 HZ2 TRP 50 HZ2 TRP 50 -18.822 -2.671 6.241
362 HZ3 TRP 50 HZ3 TRP 50 -15.206 -1.232 7.986
363 HH2 TRP 50 HH2 TRP 50 -17.624 -1.559 8.072
364 H GLU 51 HN GLU 51 -12.383 -4.781 1.054
365 HA GLU 51 HA GLU 51 -14.547 -6.279 0.042
366 HB2 GLU 51 HB2 GLU 51 -11.932 -5.358 -1.100
367 HB3 GLU 51 HB3 GLU 51 -12.912 -6.505 -2.004
368 HG2 GLU 51 HG2 GLU 51 -13.644 -3.725 -1.139
369 HG3 GLU 51 HG3 GLU 51 -13.347 -4.303 -2.777
370 H LEU 52 HN LEU 52 -11.146 -7.137 0.493
371 HA LEU 52 HA LEU 52 -11.862 -9.956 0.108
372 HB2 LEU 52 HB2 LEU 52 -9.137 -8.695 0.250
373 HB3 LEU 52 HB3 LEU 52 -9.506 -10.332 -0.275
374 HG LEU 52 HG LEU 52 -10.233 -7.771 -1.688
375 HD11 LEU 52 HD11 LEU 52 -8.701 -8.631 -3.426
376 HD12 LEU 52 HD12 LEU 52 -7.881 -8.326 -1.894
377 HD13 LEU 52 HD13 LEU 52 -8.283 -9.978 -2.367
378 HD21 LEU 52 HD21 LEU 52 -10.781 -10.637 -2.470
379 HD22 LEU 52 HD22 LEU 52 -11.983 -9.440 -1.982
380 HD23 LEU 52 HD23 LEU 52 -11.077 -9.222 -3.480
381 H ARG 53 HN ARG 53 -10.424 -7.699 2.307
382 HA ARG 53 HA ARG 53 -9.793 -7.774 4.492
383 HB2 ARG 53 HB2 ARG 53 -12.138 -8.527 4.807
384 HB3 ARG 53 HB3 ARG 53 -11.606 -10.197 4.652
385 HG2 ARG 53 HG2 ARG 53 -10.112 -9.803 6.632
386 HG3 ARG 53 HG3 ARG 53 -10.914 -8.244 6.834
387 HD2 ARG 53 HD2 ARG 53 -13.073 -9.414 7.037
388 HD3 ARG 53 HD3 ARG 53 -12.227 -10.957 6.904
389 HE ARG 53 HE ARG 53 -11.586 -9.069 9.067
390 HH11 ARG 53 HH12 ARG 53 -12.680 -12.225 7.998
391 HH12 ARG 53 HH11 ARG 53 -12.613 -12.925 9.592
392 HH21 ARG 53 HH22 ARG 53 -11.485 -9.985 11.150
393 HH22 ARG 53 HH21 ARG 53 -11.907 -11.656 11.384
Start of MODEL 8
1 H1 ASN 1 H1 ASN 1 9.705 -11.976 2.336
2 H2 ASN 1 H2 ASN 1 8.727 -10.616 2.078
3 H3 ASN 1 H3 ASN 1 8.513 -11.556 3.469
4 HA ASN 1 HA ASN 1 10.695 -10.952 4.261
5 HB2 ASN 1 HB2 ASN 1 10.760 -9.385 1.690
6 HB3 ASN 1 HB3 ASN 1 11.736 -8.914 3.075
7 HD21 ASN 1 HD21 ASN 1 13.644 -9.272 2.015
8 HD22 ASN 1 HD22 ASN 1 14.233 -10.860 1.653
9 H SER 2 HN SER 2 9.014 -8.334 2.506
10 HA SER 2 HA SER 2 8.373 -6.279 3.206
11 HB2 SER 2 HB2 SER 2 7.571 -7.816 5.697
12 HB3 SER 2 HB3 SER 2 7.103 -6.151 5.354
13 HG SER 2 HG SER 2 5.444 -7.439 4.657
14 H ASP 3 HN ASP 3 10.655 -5.796 3.088
15 HA ASP 3 HA ASP 3 12.350 -6.235 5.364
16 HB2 ASP 3 HB2 ASP 3 12.925 -6.125 2.823
17 HB3 ASP 3 HB3 ASP 3 13.044 -4.390 3.101
18 H SER 4 HN SER 4 13.865 -3.718 5.139
19 HA SER 4 HA SER 4 12.051 -1.707 6.190
20 HB2 SER 4 HB2 SER 4 14.297 -2.797 7.913
21 HB3 SER 4 HB3 SER 4 13.143 -1.536 8.353
22 HG SER 4 HG SER 4 11.625 -3.488 7.681
23 H GLU 5 HN GLU 5 13.059 -0.967 4.046
24 HA GLU 5 HA GLU 5 15.391 0.676 4.741
25 HB2 GLU 5 HB2 GLU 5 16.345 -1.212 3.547
26 HB3 GLU 5 HB3 GLU 5 15.193 -1.004 2.233
27 HG2 GLU 5 HG2 GLU 5 16.171 1.135 1.665
28 HG3 GLU 5 HG3 GLU 5 17.274 1.021 3.033
29 H CYS 6 HN CYS 6 12.485 0.187 2.895
30 HA CYS 6 HA CYS 6 12.767 2.013 0.851
31 HB2 CYS 6 HB2 CYS 6 10.880 0.447 1.024
32 HB3 CYS 6 HB3 CYS 6 10.217 1.397 2.352
33 HA PRO 7 HA PRO 7 13.003 5.932 3.005
34 HB2 PRO 7 HB2 PRO 7 12.903 6.944 0.233
35 HB3 PRO 7 HB3 PRO 7 14.138 7.190 1.472
36 HG2 PRO 7 HG2 PRO 7 14.591 5.620 -0.644
37 HG3 PRO 7 HG3 PRO 7 15.232 5.217 0.961
38 HD2 PRO 7 HD2 PRO 7 12.840 4.098 -0.457
39 HD3 PRO 7 HD3 PRO 7 14.082 3.255 0.494
40 H LEU 8 HN LEU 8 11.706 7.862 3.055
41 HA LEU 8 HA LEU 8 8.957 7.197 3.093
42 HB2 LEU 8 HB2 LEU 8 10.381 9.814 3.501
43 HB3 LEU 8 HB3 LEU 8 8.659 9.597 3.734
44 HG LEU 8 HG LEU 8 10.823 8.168 5.279
45 HD11 LEU 8 HD11 LEU 8 8.960 10.390 6.108
46 HD12 LEU 8 HD12 LEU 8 10.101 9.548 7.154
47 HD13 LEU 8 HD13 LEU 8 10.693 10.542 5.825
48 HD21 LEU 8 HD21 LEU 8 7.823 8.145 5.597
49 HD22 LEU 8 HD22 LEU 8 8.826 6.806 5.040
50 HD23 LEU 8 HD23 LEU 8 8.980 7.395 6.696
51 H SER 9 HN SER 9 10.704 8.006 0.459
52 HA SER 9 HA SER 9 8.913 9.890 -0.760
53 HB2 SER 9 HB2 SER 9 11.368 9.947 -1.185
54 HB3 SER 9 HB3 SER 9 11.245 8.371 -1.964
55 HG SER 9 HG SER 9 11.053 9.696 -3.642
56 H HIS 10 HN HIS 10 9.502 6.443 -0.714
57 HA HIS 10 HA HIS 10 7.602 6.038 -2.879
58 HB2 HIS 10 HB2 HIS 10 9.346 4.142 -1.326
59 HB3 HIS 10 HB3 HIS 10 8.078 3.569 -2.401
60 HD1 HIS 10 HD1 HIS 10 8.520 3.669 -4.912
61 HD2 HIS 10 HD2 HIS 10 11.546 5.374 -2.630
62 HE1 HIS 10 HE1 HIS 10 10.429 4.052 -6.498
63 HE2 HIS 10 HE2 HIS 10 12.316 4.885 -5.053
64 H ASP 11 HN ASP 11 7.584 6.441 0.401
65 HA ASP 11 HA ASP 11 5.159 4.900 0.894
66 HB2 ASP 11 HB2 ASP 11 6.975 5.029 2.621
67 HB3 ASP 11 HB3 ASP 11 6.689 6.761 2.740
68 H GLY 12 HN GLY 12 6.357 8.195 0.791
69 HA2 GLY 12 HA1 GLY 12 3.810 9.467 0.965
70 HA3 GLY 12 HA2 GLY 12 5.321 10.213 0.451
71 H TYR 13 HN TYR 13 5.659 8.003 -1.575
72 HA TYR 13 HA TYR 13 4.335 9.044 -3.822
73 HB2 TYR 13 HB2 TYR 13 6.300 7.507 -3.894
74 HB3 TYR 13 HB3 TYR 13 5.254 6.188 -3.389
75 HD1 TYR 13 HD1 TYR 13 5.851 8.624 -6.135
76 HD2 TYR 13 HD2 TYR 13 3.998 4.975 -4.968
77 HE1 TYR 13 HE1 TYR 13 5.296 8.157 -8.487
78 HE2 TYR 13 HE2 TYR 13 3.443 4.498 -7.316
79 HH TYR 13 HH TYR 13 4.790 6.235 -9.917
80 H CYS 14 HN CYS 14 3.328 6.864 -1.343
81 HA CYS 14 HA CYS 14 0.956 5.955 -2.676
82 HB2 CYS 14 HB2 CYS 14 1.850 5.776 0.219
83 HB3 CYS 14 HB3 CYS 14 0.437 4.957 -0.460
84 H LEU 15 HN LEU 15 -1.179 6.324 -0.986
85 HA LEU 15 HA LEU 15 -1.437 9.218 -1.429
86 HB2 LEU 15 HB2 LEU 15 -3.593 7.180 -1.874
87 HB3 LEU 15 HB3 LEU 15 -3.650 8.885 -2.277
88 HG LEU 15 HG LEU 15 -1.925 6.781 -3.566
89 HD11 LEU 15 HD11 LEU 15 -4.256 6.709 -4.255
90 HD12 LEU 15 HD12 LEU 15 -4.232 8.437 -4.601
91 HD13 LEU 15 HD13 LEU 15 -3.255 7.331 -5.566
92 HD21 LEU 15 HD21 LEU 15 -1.176 8.558 -5.078
93 HD22 LEU 15 HD22 LEU 15 -2.079 9.747 -4.137
94 HD23 LEU 15 HD23 LEU 15 -0.712 8.899 -3.411
95 H HIS 16 HN HIS 16 -3.360 6.639 0.193
96 HA HIS 16 HA HIS 16 -4.261 8.848 1.935
97 HB2 HIS 16 HB2 HIS 16 -5.750 6.822 0.478
98 HB3 HIS 16 HB3 HIS 16 -6.187 6.876 2.185
99 HD1 HIS 16 HD1 HIS 16 -7.537 8.860 2.993
100 HD2 HIS 16 HD2 HIS 16 -6.238 9.264 -0.938
101 HE1 HIS 16 HE1 HIS 16 -8.731 10.881 2.089
102 HE2 HIS 16 HE2 HIS 16 -7.726 11.246 -0.197
103 H ASP 17 HN ASP 17 -1.991 7.194 2.345
104 HA ASP 17 HA ASP 17 -1.922 6.975 5.030
105 HB2 ASP 17 HB2 ASP 17 -3.739 5.173 4.627
106 HB3 ASP 17 HB3 ASP 17 -2.416 4.174 4.040
107 H GLY 18 HN GLY 18 -1.184 4.868 2.281
108 HA2 GLY 18 HA1 GLY 18 0.754 3.958 1.514
109 HA3 GLY 18 HA2 GLY 18 1.507 5.451 2.047
110 H VAL 19 HN VAL 19 1.956 2.370 2.063
111 HA VAL 19 HA VAL 19 3.748 2.497 4.347
112 HB VAL 19 HB VAL 19 1.692 0.278 4.073
113 HG11 VAL 19 HG11 VAL 19 2.893 -0.877 5.884
114 HG12 VAL 19 HG12 VAL 19 3.878 -0.729 4.428
115 HG13 VAL 19 HG13 VAL 19 4.170 0.340 5.800
116 HG21 VAL 19 HG21 VAL 19 0.961 2.203 5.395
117 HG22 VAL 19 HG22 VAL 19 1.184 0.779 6.409
118 HG23 VAL 19 HG23 VAL 19 2.399 2.057 6.406
119 H CYS 20 HN CYS 20 5.697 1.839 3.549
120 HA CYS 20 HA CYS 20 5.595 0.461 0.953
121 HB2 CYS 20 HB2 CYS 20 6.447 2.762 0.856
122 HB3 CYS 20 HB3 CYS 20 7.694 2.352 2.032
123 H MET 21 HN MET 21 6.073 -1.635 1.183
124 HA MET 21 HA MET 21 8.663 -2.390 2.132
125 HB2 MET 21 HB2 MET 21 7.905 -3.877 3.940
126 HB3 MET 21 HB3 MET 21 7.563 -2.197 4.292
127 HG2 MET 21 HG2 MET 21 5.245 -2.496 3.761
128 HG3 MET 21 HG3 MET 21 5.543 -4.142 3.206
129 HE1 MET 21 HE1 MET 21 6.131 -2.894 7.608
130 HE2 MET 21 HE2 MET 21 7.233 -2.484 6.294
131 HE3 MET 21 HE3 MET 21 5.631 -1.752 6.358
132 H TYR 22 HN TYR 22 9.295 -4.056 0.725
133 HA TYR 22 HA TYR 22 7.511 -6.280 0.679
134 HB2 TYR 22 HB2 TYR 22 7.302 -4.771 -1.471
135 HB3 TYR 22 HB3 TYR 22 8.746 -5.665 -1.921
136 HD1 TYR 22 HD1 TYR 22 5.824 -6.947 -0.016
137 HD2 TYR 22 HD2 TYR 22 7.971 -6.994 -3.687
138 HE1 TYR 22 HE1 TYR 22 4.445 -8.832 -0.796
139 HE2 TYR 22 HE2 TYR 22 6.602 -8.873 -4.474
140 HH TYR 22 HH TYR 22 5.274 -10.680 -3.543
141 H ILE 23 HN ILE 23 10.460 -5.279 -0.803
142 HA ILE 23 HA ILE 23 11.866 -7.411 0.579
143 HB ILE 23 HB ILE 23 12.252 -6.919 -2.359
144 HG12 ILE 23 HG12 ILE 23 10.014 -7.904 -1.349
145 HG13 ILE 23 HG13 ILE 23 10.710 -8.560 -2.852
146 HG21 ILE 23 HG21 ILE 23 13.505 -9.034 -2.274
147 HG22 ILE 23 HG22 ILE 23 14.210 -7.812 -1.216
148 HG23 ILE 23 HG23 ILE 23 13.235 -9.113 -0.532
149 HD11 ILE 23 HD11 ILE 23 9.975 -10.344 -1.371
150 HD12 ILE 23 HD12 ILE 23 11.731 -10.378 -1.533
151 HD13 ILE 23 HD13 ILE 23 10.993 -9.714 -0.077
152 H GLU 24 HN GLU 24 11.944 -4.636 -1.381
153 HA GLU 24 HA GLU 24 12.765 -2.581 -1.035
154 HB2 GLU 24 HB2 GLU 24 13.087 -3.939 1.565
155 HB3 GLU 24 HB3 GLU 24 13.529 -2.232 1.396
156 HG2 GLU 24 HG2 GLU 24 11.196 -1.856 0.544
157 HG3 GLU 24 HG3 GLU 24 10.837 -3.543 0.959
158 H ALA 25 HN ALA 25 15.092 -5.018 0.131
159 HA ALA 25 HA ALA 25 17.370 -3.395 -0.609
160 HB1 ALA 25 HB1 ALA 25 17.178 -6.307 0.192
161 HB2 ALA 25 HB2 ALA 25 18.678 -5.406 -0.032
162 HB3 ALA 25 HB3 ALA 25 17.567 -4.958 1.262
163 H LEU 26 HN LEU 26 15.092 -5.263 -2.045
164 HA LEU 26 HA LEU 26 16.669 -5.729 -4.471
165 HB2 LEU 26 HB2 LEU 26 14.842 -7.348 -3.091
166 HB3 LEU 26 HB3 LEU 26 13.973 -6.753 -4.487
167 HG LEU 26 HG LEU 26 16.578 -8.266 -4.551
168 HD11 LEU 26 HD11 LEU 26 13.778 -9.114 -5.271
169 HD12 LEU 26 HD12 LEU 26 15.237 -10.067 -5.542
170 HD13 LEU 26 HD13 LEU 26 14.727 -9.683 -3.898
171 HD21 LEU 26 HD21 LEU 26 14.814 -7.317 -6.808
172 HD22 LEU 26 HD22 LEU 26 16.417 -6.698 -6.404
173 HD23 LEU 26 HD23 LEU 26 16.229 -8.358 -6.973
174 H ASP 27 HN ASP 27 15.145 -3.537 -2.993
175 HA ASP 27 HA ASP 27 13.861 -1.756 -3.318
176 HB2 ASP 27 HB2 ASP 27 14.302 -0.446 -5.267
177 HB3 ASP 27 HB3 ASP 27 15.769 -1.253 -4.727
178 H LYS 28 HN LYS 28 12.619 -4.127 -3.403
179 HA LYS 28 HA LYS 28 10.327 -3.700 -5.184
180 HB2 LYS 28 HB2 LYS 28 10.553 -5.802 -3.045
181 HB3 LYS 28 HB3 LYS 28 9.555 -5.823 -4.495
182 HG2 LYS 28 HG2 LYS 28 12.562 -5.983 -4.540
183 HG3 LYS 28 HG3 LYS 28 11.486 -7.388 -4.573
184 HD2 LYS 28 HD2 LYS 28 11.616 -5.174 -6.621
185 HD3 LYS 28 HD3 LYS 28 12.173 -6.835 -6.831
186 HE2 LYS 28 HE2 LYS 28 9.839 -7.607 -6.472
187 HE3 LYS 28 HE3 LYS 28 9.326 -5.922 -6.401
188 HZ1 LYS 28 HZ1 LYS 28 10.504 -7.350 -8.718
189 HZ2 LYS 28 HZ2 LYS 28 10.268 -5.675 -8.682
190 HZ3 LYS 28 HZ3 LYS 28 8.933 -6.722 -8.589
191 H TYR 29 HN TYR 29 8.351 -3.119 -4.366
192 HA TYR 29 HA TYR 29 8.085 -2.705 -1.520
193 HB2 TYR 29 HB2 TYR 29 7.415 -0.333 -1.780
194 HB3 TYR 29 HB3 TYR 29 9.110 -0.620 -2.148
195 HD1 TYR 29 HD2 TYR 29 9.857 -0.605 -4.542
196 HD2 TYR 29 HD1 TYR 29 5.940 0.584 -3.380
197 HE1 TYR 29 HE2 TYR 29 9.579 0.563 -6.687
198 HE2 TYR 29 HE1 TYR 29 5.654 1.756 -5.519
199 HH TYR 29 HH TYR 29 7.835 1.374 -8.137
200 H ALA 30 HN ALA 30 6.223 -3.501 -0.991
201 HA ALA 30 HA ALA 30 3.914 -3.051 -2.744
202 HB1 ALA 30 HB1 ALA 30 4.193 -4.855 -0.330
203 HB2 ALA 30 HB2 ALA 30 2.745 -4.679 -1.321
204 HB3 ALA 30 HB3 ALA 30 4.208 -5.377 -2.016
205 H CYS 31 HN CYS 31 2.265 -1.740 -2.006
206 HA CYS 31 HA CYS 31 2.963 -0.241 0.404
207 HB2 CYS 31 HB2 CYS 31 3.294 1.187 -1.503
208 HB3 CYS 31 HB3 CYS 31 1.710 0.763 -2.149
209 H ASN 32 HN ASN 32 1.494 0.008 1.891
210 HA ASN 32 HA ASN 32 -1.156 -1.119 1.332
211 HB2 ASN 32 HB2 ASN 32 0.406 -2.443 2.799
212 HB3 ASN 32 HB3 ASN 32 0.298 -1.136 3.974
213 HD21 ASN 32 HD21 ASN 32 -1.389 -3.738 2.430
214 HD22 ASN 32 HD22 ASN 32 -2.729 -3.792 3.529
215 H CYS 33 HN CYS 33 -2.345 0.585 1.012
216 HA CYS 33 HA CYS 33 -1.844 3.026 2.372
217 HB2 CYS 33 HB2 CYS 33 -2.252 2.777 -0.041
218 HB3 CYS 33 HB3 CYS 33 -3.882 2.238 0.302
219 H VAL 34 HN VAL 34 -5.178 2.245 1.649
220 HA VAL 34 HA VAL 34 -5.739 2.146 4.519
221 HB VAL 34 HB VAL 34 -5.794 4.538 3.710
222 HG11 VAL 34 HG11 VAL 34 -7.706 5.268 2.376
223 HG12 VAL 34 HG12 VAL 34 -6.677 4.149 1.480
224 HG13 VAL 34 HG13 VAL 34 -8.202 3.587 2.166
225 HG21 VAL 34 HG21 VAL 34 -6.995 3.876 5.714
226 HG22 VAL 34 HG22 VAL 34 -7.922 5.081 4.820
227 HG23 VAL 34 HG23 VAL 34 -8.382 3.380 4.743
228 H VAL 35 HN VAL 35 -7.927 1.391 4.959
229 HA VAL 35 HA VAL 35 -8.665 -0.646 3.120
230 HB VAL 35 HB VAL 35 -10.431 -1.254 4.668
231 HG11 VAL 35 HG11 VAL 35 -9.043 -1.735 6.632
232 HG12 VAL 35 HG12 VAL 35 -8.170 -2.022 5.127
233 HG13 VAL 35 HG13 VAL 35 -7.844 -0.570 6.073
234 HG21 VAL 35 HG21 VAL 35 -9.636 1.210 6.246
235 HG22 VAL 35 HG22 VAL 35 -11.155 0.989 5.381
236 HG23 VAL 35 HG23 VAL 35 -10.778 -0.027 6.771
237 H GLY 36 HN GLY 36 -9.012 0.605 1.280
238 HA2 GLY 36 HA1 GLY 36 -11.533 0.981 0.390
239 HA3 GLY 36 HA2 GLY 36 -11.186 2.505 1.203
240 H TYR 37 HN TYR 37 -8.266 1.981 0.509
241 HA TYR 37 HA TYR 37 -8.364 2.422 -2.380
242 HB2 TYR 37 HB2 TYR 37 -6.963 4.251 -0.419
243 HB3 TYR 37 HB3 TYR 37 -6.736 4.300 -2.162
244 HD1 TYR 37 HD1 TYR 37 -8.811 4.777 -3.602
245 HD2 TYR 37 HD2 TYR 37 -8.662 5.493 0.589
246 HE1 TYR 37 HE1 TYR 37 -10.710 6.325 -3.802
247 HE2 TYR 37 HE2 TYR 37 -10.555 7.045 0.398
248 HH TYR 37 HH TYR 37 -11.654 8.404 -1.240
249 H ILE 38 HN ILE 38 -7.320 0.502 -2.839
250 HA ILE 38 HA ILE 38 -4.469 0.881 -2.616
251 HB ILE 38 HB ILE 38 -5.452 -0.832 -0.786
252 HG12 ILE 38 HG12 ILE 38 -2.861 -0.866 -2.315
253 HG13 ILE 38 HG13 ILE 38 -3.231 -0.036 -0.807
254 HG21 ILE 38 HG21 ILE 38 -5.046 -3.133 -1.477
255 HG22 ILE 38 HG22 ILE 38 -6.350 -2.412 -2.420
256 HG23 ILE 38 HG23 ILE 38 -4.746 -2.593 -3.128
257 HD11 ILE 38 HD11 ILE 38 -1.803 -1.978 -0.455
258 HD12 ILE 38 HD12 ILE 38 -3.362 -2.166 0.348
259 HD13 ILE 38 HD13 ILE 38 -3.039 -3.018 -1.162
260 H GLY 39 HN GLY 39 -3.568 0.580 -4.502
261 HA2 GLY 39 HA1 GLY 39 -4.437 -1.398 -6.386
262 HA3 GLY 39 HA2 GLY 39 -4.922 0.234 -6.850
263 H GLU 40 HN GLU 40 -2.478 -2.037 -6.960
264 HA GLU 40 HA GLU 40 -0.303 -2.036 -7.585
265 HB2 GLU 40 HB2 GLU 40 -0.682 -0.362 -9.287
266 HB3 GLU 40 HB3 GLU 40 -0.778 0.910 -8.072
267 HG2 GLU 40 HG2 GLU 40 1.613 0.423 -7.506
268 HG3 GLU 40 HG3 GLU 40 1.657 -0.651 -8.908
269 H ARG 41 HN ARG 41 -1.170 0.805 -5.802
270 HA ARG 41 HA ARG 41 0.316 -0.119 -3.525
271 HB2 ARG 41 HB2 ARG 41 1.293 2.351 -3.443
272 HB3 ARG 41 HB3 ARG 41 2.097 1.014 -4.259
273 HG2 ARG 41 HG2 ARG 41 2.225 2.843 -5.723
274 HG3 ARG 41 HG3 ARG 41 1.009 1.750 -6.373
275 HD2 ARG 41 HD2 ARG 41 -0.752 3.194 -5.406
276 HD3 ARG 41 HD3 ARG 41 0.508 4.314 -4.877
277 HE ARG 41 HE ARG 41 0.854 3.825 -7.614
278 HH11 ARG 41 HH12 ARG 41 -1.512 5.375 -5.528
279 HH12 ARG 41 HH11 ARG 41 -1.944 6.566 -6.705
280 HH21 ARG 41 HH22 ARG 41 0.292 5.401 -9.141
281 HH22 ARG 41 HH21 ARG 41 -0.929 6.586 -8.760
282 H CYS 42 HN CYS 42 -2.143 1.952 -4.859
283 HA CYS 42 HA CYS 42 -3.763 1.968 -2.659
284 HB2 CYS 42 HB2 CYS 42 -2.148 3.185 -1.352
285 HB3 CYS 42 HB3 CYS 42 -1.880 4.335 -2.655
286 H GLN 43 HN GLN 43 -5.430 1.964 -4.296
287 HA GLN 43 HA GLN 43 -6.815 4.302 -4.141
288 HB2 GLN 43 HB2 GLN 43 -6.717 5.429 -6.260
289 HB3 GLN 43 HB3 GLN 43 -5.100 5.353 -5.565
290 HG2 GLN 43 HG2 GLN 43 -4.485 3.576 -7.064
291 HG3 GLN 43 HG3 GLN 43 -6.134 3.474 -7.682
292 HE21 GLN 43 HE21 GLN 43 -6.919 5.125 -9.010
293 HE22 GLN 43 HE22 GLN 43 -5.845 6.201 -9.843
294 H TYR 44 HN TYR 44 -6.979 1.297 -4.486
295 HA TYR 44 HA TYR 44 -9.168 1.334 -6.398
296 HB2 TYR 44 HB2 TYR 44 -6.859 0.617 -7.406
297 HB3 TYR 44 HB3 TYR 44 -7.161 -0.889 -6.551
298 HD1 TYR 44 HD2 TYR 44 -8.754 1.442 -8.980
299 HD2 TYR 44 HD1 TYR 44 -8.366 -2.570 -7.620
300 HE1 TYR 44 HE2 TYR 44 -10.096 0.674 -10.890
301 HE2 TYR 44 HE1 TYR 44 -9.700 -3.351 -9.531
302 HH TYR 44 HH TYR 44 -10.421 -1.366 -12.194
303 H ARG 45 HN ARG 45 -10.358 1.278 -4.506
304 HA ARG 45 HA ARG 45 -12.074 0.001 -3.686
305 HB2 ARG 45 HB2 ARG 45 -10.346 -2.134 -4.841
306 HB3 ARG 45 HB3 ARG 45 -11.727 -2.570 -3.825
307 HG2 ARG 45 HG2 ARG 45 -12.281 -2.670 -6.212
308 HG3 ARG 45 HG3 ARG 45 -13.248 -1.466 -5.366
309 HD2 ARG 45 HD2 ARG 45 -10.747 -0.440 -6.532
310 HD3 ARG 45 HD3 ARG 45 -11.930 -1.040 -7.710
311 HE ARG 45 HE ARG 45 -12.584 1.009 -5.671
312 HH11 ARG 45 HH12 ARG 45 -12.824 -0.291 -8.914
313 HH12 ARG 45 HH11 ARG 45 -13.736 1.057 -9.526
314 HH21 ARG 45 HH22 ARG 45 -13.785 2.790 -6.470
315 HH22 ARG 45 HH21 ARG 45 -14.273 2.812 -8.141
316 H ASP 46 HN ASP 46 -12.449 -1.723 -2.057
317 HA ASP 46 HA ASP 46 -10.726 -1.160 0.234
318 HB2 ASP 46 HB2 ASP 46 -13.456 -2.474 0.144
319 HB3 ASP 46 HB3 ASP 46 -12.599 -1.954 1.587
320 H LEU 47 HN LEU 47 -9.694 -2.917 -1.649
321 HA LEU 47 HA LEU 47 -10.343 -5.593 -1.508
322 HB2 LEU 47 HB2 LEU 47 -7.613 -4.376 -1.911
323 HB3 LEU 47 HB3 LEU 47 -8.047 -6.030 -2.298
324 HG LEU 47 HG LEU 47 -9.193 -3.557 -3.596
325 HD11 LEU 47 HD11 LEU 47 -8.002 -4.371 -5.590
326 HD12 LEU 47 HD12 LEU 47 -6.904 -3.954 -4.275
327 HD13 LEU 47 HD13 LEU 47 -7.270 -5.645 -4.614
328 HD21 LEU 47 HD21 LEU 47 -10.838 -5.354 -3.485
329 HD22 LEU 47 HD22 LEU 47 -10.272 -5.124 -5.139
330 HD23 LEU 47 HD23 LEU 47 -9.673 -6.479 -4.182
331 H LYS 48 HN LYS 48 -8.950 -3.771 0.987
332 HA LYS 48 HA LYS 48 -7.706 -6.098 2.207
333 HB2 LYS 48 HB2 LYS 48 -6.941 -4.452 3.942
334 HB3 LYS 48 HB3 LYS 48 -6.276 -4.278 2.328
335 HG2 LYS 48 HG2 LYS 48 -8.227 -2.558 2.045
336 HG3 LYS 48 HG3 LYS 48 -8.178 -2.545 3.799
337 HD2 LYS 48 HD2 LYS 48 -6.720 -0.813 3.137
338 HD3 LYS 48 HD3 LYS 48 -5.710 -2.158 3.651
339 HE2 LYS 48 HE2 LYS 48 -6.275 -1.280 0.796
340 HE3 LYS 48 HE3 LYS 48 -4.759 -1.168 1.689
341 HZ1 LYS 48 HZ1 LYS 48 -6.080 -3.699 0.877
342 HZ2 LYS 48 HZ2 LYS 48 -4.683 -3.607 1.822
343 HZ3 LYS 48 HZ3 LYS 48 -4.664 -3.051 0.221
344 H TRP 49 HN TRP 49 -10.021 -3.578 3.177
345 HA TRP 49 HA TRP 49 -10.799 -5.336 5.380
346 HB2 TRP 49 HB2 TRP 49 -10.329 -2.996 5.904
347 HB3 TRP 49 HB3 TRP 49 -11.634 -2.491 4.835
348 HD1 TRP 49 HD1 TRP 49 -11.275 -4.804 7.936
349 HE1 TRP 49 HE1 TRP 49 -13.352 -4.469 9.415
350 HE3 TRP 49 HE3 TRP 49 -13.788 -1.420 5.042
351 HZ2 TRP 49 HZ2 TRP 49 -15.732 -2.961 9.367
352 HZ3 TRP 49 HZ3 TRP 49 -15.959 -0.574 5.837
353 HH2 TRP 49 HH2 TRP 49 -16.908 -1.329 7.953
354 H TRP 50 HN TRP 50 -12.449 -3.617 2.708
355 HA TRP 50 HA TRP 50 -14.925 -4.847 3.658
356 HB2 TRP 50 HB2 TRP 50 -14.969 -2.439 3.372
357 HB3 TRP 50 HB3 TRP 50 -14.500 -2.602 1.685
358 HD1 TRP 50 HD1 TRP 50 -16.382 -3.343 -0.049
359 HE1 TRP 50 HE1 TRP 50 -18.949 -3.401 0.097
360 HE3 TRP 50 HE3 TRP 50 -16.914 -2.862 5.012
361 HZ2 TRP 50 HZ2 TRP 50 -20.934 -3.249 2.084
362 HZ3 TRP 50 HZ3 TRP 50 -19.188 -2.825 5.954
363 HH2 TRP 50 HH2 TRP 50 -21.156 -3.014 4.517
364 H GLU 51 HN GLU 51 -13.033 -4.611 0.650
365 HA GLU 51 HA GLU 51 -15.093 -5.860 -0.886
366 HB2 GLU 51 HB2 GLU 51 -12.243 -5.103 -1.505
367 HB3 GLU 51 HB3 GLU 51 -13.266 -5.939 -2.670
368 HG2 GLU 51 HG2 GLU 51 -13.837 -3.287 -1.390
369 HG3 GLU 51 HG3 GLU 51 -13.232 -3.533 -3.032
370 H LEU 52 HN LEU 52 -12.005 -6.944 0.431
371 HA LEU 52 HA LEU 52 -12.737 -9.679 -0.355
372 HB2 LEU 52 HB2 LEU 52 -9.988 -8.641 0.271
373 HB3 LEU 52 HB3 LEU 52 -10.400 -10.196 -0.438
374 HG LEU 52 HG LEU 52 -10.761 -7.495 -1.737
375 HD11 LEU 52 HD11 LEU 52 -8.415 -8.205 -1.580
376 HD12 LEU 52 HD12 LEU 52 -8.826 -9.741 -2.338
377 HD13 LEU 52 HD13 LEU 52 -8.983 -8.240 -3.249
378 HD21 LEU 52 HD21 LEU 52 -11.270 -10.275 -2.816
379 HD22 LEU 52 HD22 LEU 52 -12.495 -9.063 -2.440
380 HD23 LEU 52 HD23 LEU 52 -11.348 -8.782 -3.750
381 H ARG 53 HN ARG 53 -11.385 -7.673 2.152
382 HA ARG 53 HA ARG 53 -11.067 -7.907 4.382
383 HB2 ARG 53 HB2 ARG 53 -13.552 -8.850 4.043
384 HB3 ARG 53 HB3 ARG 53 -12.785 -10.328 4.608
385 HG2 ARG 53 HG2 ARG 53 -12.927 -7.687 6.054
386 HG3 ARG 53 HG3 ARG 53 -13.755 -9.187 6.481
387 HD2 ARG 53 HD2 ARG 53 -11.679 -10.252 7.014
388 HD3 ARG 53 HD3 ARG 53 -10.759 -8.886 6.390
389 HE ARG 53 HE ARG 53 -12.435 -8.797 8.825
390 HH11 ARG 53 HH12 ARG 53 -9.695 -7.719 6.941
391 HH12 ARG 53 HH11 ARG 53 -8.998 -6.788 8.234
392 HH21 ARG 53 HH22 ARG 53 -11.504 -7.605 10.555
393 HH22 ARG 53 HH21 ARG 53 -10.027 -6.725 10.286
Start of MODEL 9
1 H1 ASN 1 H1 ASN 1 14.376 -8.740 1.801
2 H2 ASN 1 H2 ASN 1 15.830 -7.943 2.139
3 H3 ASN 1 H3 ASN 1 14.627 -7.164 1.236
4 HA ASN 1 HA ASN 1 14.310 -8.027 4.048
5 HB2 ASN 1 HB2 ASN 1 14.880 -5.264 2.934
6 HB3 ASN 1 HB3 ASN 1 14.514 -5.628 4.618
7 HD21 ASN 1 HD21 ASN 1 16.480 -4.859 5.380
8 HD22 ASN 1 HD22 ASN 1 17.972 -5.696 5.090
9 H SER 2 HN SER 2 12.494 -8.868 2.442
10 HA SER 2 HA SER 2 10.533 -7.351 1.329
11 HB2 SER 2 HB2 SER 2 9.877 -9.836 2.881
12 HB3 SER 2 HB3 SER 2 9.227 -9.292 1.335
13 HG SER 2 HG SER 2 10.655 -10.720 0.646
14 H ASP 3 HN ASP 3 9.037 -6.030 1.978
15 HA ASP 3 HA ASP 3 7.900 -4.608 3.389
16 HB2 ASP 3 HB2 ASP 3 6.399 -6.474 2.849
17 HB3 ASP 3 HB3 ASP 3 6.896 -7.297 4.321
18 H SER 4 HN SER 4 9.980 -4.099 4.528
19 HA SER 4 HA SER 4 9.578 -4.424 7.383
20 HB2 SER 4 HB2 SER 4 12.147 -5.276 6.029
21 HB3 SER 4 HB3 SER 4 11.945 -5.095 7.773
22 HG SER 4 HG SER 4 10.255 -6.760 6.230
23 H GLU 5 HN GLU 5 12.197 -3.275 5.233
24 HA GLU 5 HA GLU 5 12.261 -0.799 6.812
25 HB2 GLU 5 HB2 GLU 5 14.333 -2.023 4.983
26 HB3 GLU 5 HB3 GLU 5 14.512 -0.480 5.807
27 HG2 GLU 5 HG2 GLU 5 14.414 -1.598 7.957
28 HG3 GLU 5 HG3 GLU 5 14.185 -3.153 7.150
29 H CYS 6 HN CYS 6 12.394 1.209 5.802
30 HA CYS 6 HA CYS 6 12.651 1.798 3.135
31 HB2 CYS 6 HB2 CYS 6 10.334 2.222 2.389
32 HB3 CYS 6 HB3 CYS 6 10.630 0.514 2.679
33 HA PRO 7 HA PRO 7 12.855 5.688 5.323
34 HB2 PRO 7 HB2 PRO 7 12.989 6.739 2.549
35 HB3 PRO 7 HB3 PRO 7 14.093 6.994 3.904
36 HG2 PRO 7 HG2 PRO 7 14.765 5.408 1.876
37 HG3 PRO 7 HG3 PRO 7 15.208 4.994 3.544
38 HD2 PRO 7 HD2 PRO 7 13.015 3.890 1.834
39 HD3 PRO 7 HD3 PRO 7 14.087 3.049 2.974
40 H LEU 8 HN LEU 8 11.533 7.450 5.667
41 HA LEU 8 HA LEU 8 8.785 7.052 5.264
42 HB2 LEU 8 HB2 LEU 8 10.301 9.474 6.207
43 HB3 LEU 8 HB3 LEU 8 8.554 9.376 6.188
44 HG LEU 8 HG LEU 8 8.844 7.299 7.679
45 HD11 LEU 8 HD11 LEU 8 11.233 6.983 7.375
46 HD12 LEU 8 HD12 LEU 8 11.548 8.579 8.057
47 HD13 LEU 8 HD13 LEU 8 10.861 7.307 9.068
48 HD21 LEU 8 HD21 LEU 8 8.945 8.693 9.682
49 HD22 LEU 8 HD22 LEU 8 9.518 10.046 8.708
50 HD23 LEU 8 HD23 LEU 8 7.901 9.395 8.446
51 H SER 9 HN SER 9 10.878 8.045 3.016
52 HA SER 9 HA SER 9 9.462 10.291 1.919
53 HB2 SER 9 HB2 SER 9 11.280 10.076 0.145
54 HB3 SER 9 HB3 SER 9 11.838 10.407 1.785
55 HG SER 9 HG SER 9 13.095 8.753 1.178
56 H HIS 10 HN HIS 10 9.688 6.869 1.489
57 HA HIS 10 HA HIS 10 8.634 6.975 -1.214
58 HB2 HIS 10 HB2 HIS 10 9.620 4.745 0.544
59 HB3 HIS 10 HB3 HIS 10 8.762 4.417 -0.957
60 HD1 HIS 10 HD1 HIS 10 11.679 6.717 -0.030
61 HD2 HIS 10 HD2 HIS 10 10.514 3.986 -2.936
62 HE1 HIS 10 HE1 HIS 10 13.598 6.593 -1.641
63 HE2 HIS 10 HE2 HIS 10 12.763 5.119 -3.516
64 H ASP 11 HN ASP 11 7.593 6.156 2.021
65 HA ASP 11 HA ASP 11 5.007 5.243 1.079
66 HB2 ASP 11 HB2 ASP 11 4.510 4.777 3.388
67 HB3 ASP 11 HB3 ASP 11 6.155 4.232 3.069
68 H GLY 12 HN GLY 12 6.506 8.040 2.505
69 HA2 GLY 12 HA1 GLY 12 4.110 9.550 2.848
70 HA3 GLY 12 HA2 GLY 12 5.750 10.185 2.849
71 H TYR 13 HN TYR 13 6.351 9.001 0.213
72 HA TYR 13 HA TYR 13 5.315 11.043 -1.493
73 HB2 TYR 13 HB2 TYR 13 7.497 10.022 -1.925
74 HB3 TYR 13 HB3 TYR 13 6.735 8.462 -2.185
75 HD1 TYR 13 HD1 TYR 13 6.765 11.938 -3.502
76 HD2 TYR 13 HD2 TYR 13 6.134 7.818 -4.332
77 HE1 TYR 13 HE1 TYR 13 6.555 12.462 -5.892
78 HE2 TYR 13 HE2 TYR 13 5.922 8.327 -6.729
79 HH TYR 13 HH TYR 13 5.365 10.219 -8.170
80 H CYS 14 HN CYS 14 4.170 7.980 -0.515
81 HA CYS 14 HA CYS 14 2.708 7.345 -2.869
82 HB2 CYS 14 HB2 CYS 14 3.476 5.614 -1.317
83 HB3 CYS 14 HB3 CYS 14 2.413 6.238 -0.061
84 H LEU 15 HN LEU 15 0.095 6.694 -1.954
85 HA LEU 15 HA LEU 15 -0.775 9.421 -2.492
86 HB2 LEU 15 HB2 LEU 15 -2.186 6.816 -3.029
87 HB3 LEU 15 HB3 LEU 15 -2.696 8.402 -3.583
88 HG LEU 15 HG LEU 15 -0.084 7.112 -4.373
89 HD11 LEU 15 HD11 LEU 15 -1.152 6.648 -6.521
90 HD12 LEU 15 HD12 LEU 15 -1.944 5.783 -5.203
91 HD13 LEU 15 HD13 LEU 15 -2.690 7.230 -5.883
92 HD21 LEU 15 HD21 LEU 15 -0.107 8.828 -6.137
93 HD22 LEU 15 HD22 LEU 15 -1.580 9.507 -5.443
94 HD23 LEU 15 HD23 LEU 15 -0.075 9.536 -4.522
95 H HIS 16 HN HIS 16 -2.745 6.744 -1.221
96 HA HIS 16 HA HIS 16 -4.101 8.839 0.322
97 HB2 HIS 16 HB2 HIS 16 -5.255 7.262 -1.425
98 HB3 HIS 16 HB3 HIS 16 -5.265 6.110 -0.096
99 HD1 HIS 16 HD1 HIS 16 -7.572 8.108 -1.615
100 HD2 HIS 16 HD2 HIS 16 -6.321 7.903 2.351
101 HE1 HIS 16 HE1 HIS 16 -9.445 9.090 -0.254
102 HE2 HIS 16 HE2 HIS 16 -8.735 8.810 2.145
103 H ASP 17 HN ASP 17 -1.696 7.530 1.154
104 HA ASP 17 HA ASP 17 -1.830 7.616 3.812
105 HB2 ASP 17 HB2 ASP 17 -3.513 5.677 3.586
106 HB3 ASP 17 HB3 ASP 17 -2.118 4.681 3.187
107 H GLY 18 HN GLY 18 -0.758 5.359 1.352
108 HA2 GLY 18 HA1 GLY 18 1.294 4.602 0.745
109 HA3 GLY 18 HA2 GLY 18 1.933 6.084 1.432
110 H VAL 19 HN VAL 19 1.975 2.807 1.541
111 HA VAL 19 HA VAL 19 3.776 2.901 3.859
112 HB VAL 19 HB VAL 19 1.727 0.723 3.343
113 HG11 VAL 19 HG11 VAL 19 2.743 -0.502 5.207
114 HG12 VAL 19 HG12 VAL 19 3.887 -0.299 3.881
115 HG13 VAL 19 HG13 VAL 19 4.013 0.716 5.319
116 HG21 VAL 19 HG21 VAL 19 1.029 1.201 5.656
117 HG22 VAL 19 HG22 VAL 19 2.222 2.497 5.736
118 HG23 VAL 19 HG23 VAL 19 0.867 2.613 4.612
119 H CYS 20 HN CYS 20 5.689 1.569 3.486
120 HA CYS 20 HA CYS 20 5.958 1.355 0.579
121 HB2 CYS 20 HB2 CYS 20 8.513 1.568 1.429
122 HB3 CYS 20 HB3 CYS 20 7.487 2.944 1.032
123 H MET 21 HN MET 21 6.166 -0.499 -0.305
124 HA MET 21 HA MET 21 7.814 -2.599 0.946
125 HB2 MET 21 HB2 MET 21 5.241 -2.962 -0.601
126 HB3 MET 21 HB3 MET 21 6.279 -4.274 -0.065
127 HG2 MET 21 HG2 MET 21 5.810 -3.766 2.232
128 HG3 MET 21 HG3 MET 21 4.901 -2.329 1.763
129 HE1 MET 21 HE1 MET 21 1.817 -3.918 -0.087
130 HE2 MET 21 HE2 MET 21 2.572 -2.418 0.450
131 HE3 MET 21 HE3 MET 21 3.337 -3.388 -0.806
132 H TYR 22 HN TYR 22 9.350 -3.400 -0.529
133 HA TYR 22 HA TYR 22 9.216 -3.162 -3.247
134 HB2 TYR 22 HB2 TYR 22 9.616 -1.078 -3.601
135 HB3 TYR 22 HB3 TYR 22 9.581 -0.756 -1.903
136 HD1 TYR 22 HD2 TYR 22 11.918 -1.885 -4.556
137 HD2 TYR 22 HD1 TYR 22 11.437 0.330 -0.953
138 HE1 TYR 22 HE2 TYR 22 14.269 -1.197 -4.676
139 HE2 TYR 22 HE1 TYR 22 13.797 1.018 -1.060
140 HH TYR 22 HH TYR 22 15.743 0.421 -3.879
141 H ILE 23 HN ILE 23 11.607 -2.846 -0.713
142 HA ILE 23 HA ILE 23 13.597 -4.311 -2.175
143 HB ILE 23 HB ILE 23 14.822 -4.384 -0.015
144 HG12 ILE 23 HG12 ILE 23 12.313 -3.001 0.850
145 HG13 ILE 23 HG13 ILE 23 13.089 -4.398 1.578
146 HG21 ILE 23 HG21 ILE 23 15.265 -1.947 0.043
147 HG22 ILE 23 HG22 ILE 23 15.265 -2.624 -1.587
148 HG23 ILE 23 HG23 ILE 23 13.870 -1.709 -1.010
149 HD11 ILE 23 HD11 ILE 23 14.138 -1.579 1.654
150 HD12 ILE 23 HD12 ILE 23 13.374 -2.449 2.984
151 HD13 ILE 23 HD13 ILE 23 14.932 -2.989 2.356
152 H GLU 24 HN GLU 24 11.686 -5.945 -2.406
153 HA GLU 24 HA GLU 24 11.245 -7.766 -0.214
154 HB2 GLU 24 HB2 GLU 24 10.402 -7.724 -3.106
155 HB3 GLU 24 HB3 GLU 24 9.762 -8.839 -1.887
156 HG2 GLU 24 HG2 GLU 24 9.608 -5.994 -1.157
157 HG3 GLU 24 HG3 GLU 24 8.620 -6.466 -2.546
158 H ALA 25 HN ALA 25 13.834 -7.452 -2.072
159 HA ALA 25 HA ALA 25 15.460 -8.758 -2.958
160 HB1 ALA 25 HB1 ALA 25 14.064 -11.036 -1.557
161 HB2 ALA 25 HB2 ALA 25 15.689 -11.075 -2.239
162 HB3 ALA 25 HB3 ALA 25 15.332 -10.024 -0.868
163 H LEU 26 HN LEU 26 12.395 -8.725 -3.850
164 HA LEU 26 HA LEU 26 12.851 -10.433 -6.185
165 HB2 LEU 26 HB2 LEU 26 10.240 -9.487 -4.997
166 HB3 LEU 26 HB3 LEU 26 10.386 -10.384 -6.496
167 HG LEU 26 HG LEU 26 11.153 -11.415 -3.763
168 HD11 LEU 26 HD11 LEU 26 8.796 -12.061 -5.531
169 HD12 LEU 26 HD12 LEU 26 9.200 -12.865 -4.014
170 HD13 LEU 26 HD13 LEU 26 8.745 -11.161 -4.015
171 HD21 LEU 26 HD21 LEU 26 12.523 -12.371 -5.554
172 HD22 LEU 26 HD22 LEU 26 11.415 -13.570 -4.888
173 HD23 LEU 26 HD23 LEU 26 11.062 -12.811 -6.439
174 H ASP 27 HN ASP 27 12.846 -7.423 -4.966
175 HA ASP 27 HA ASP 27 13.432 -5.450 -5.929
176 HB2 ASP 27 HB2 ASP 27 14.536 -6.923 -7.710
177 HB3 ASP 27 HB3 ASP 27 13.074 -6.686 -8.665
178 H LYS 28 HN LYS 28 11.266 -5.403 -4.888
179 HA LYS 28 HA LYS 28 9.123 -5.065 -6.884
180 HB2 LYS 28 HB2 LYS 28 9.032 -5.731 -3.949
181 HB3 LYS 28 HB3 LYS 28 7.599 -5.264 -4.860
182 HG2 LYS 28 HG2 LYS 28 7.910 -7.149 -6.360
183 HG3 LYS 28 HG3 LYS 28 9.390 -7.598 -5.512
184 HD2 LYS 28 HD2 LYS 28 7.519 -9.001 -4.822
185 HD3 LYS 28 HD3 LYS 28 8.107 -8.018 -3.480
186 HE2 LYS 28 HE2 LYS 28 6.266 -6.410 -3.917
187 HE3 LYS 28 HE3 LYS 28 5.653 -7.503 -5.161
188 HZ1 LYS 28 HZ1 LYS 28 5.971 -8.164 -2.276
189 HZ2 LYS 28 HZ2 LYS 28 5.370 -9.213 -3.473
190 HZ3 LYS 28 HZ3 LYS 28 4.502 -7.814 -3.059
191 H TYR 29 HN TYR 29 7.362 -3.519 -5.891
192 HA TYR 29 HA TYR 29 8.310 -1.043 -4.919
193 HB2 TYR 29 HB2 TYR 29 8.525 -1.545 -7.788
194 HB3 TYR 29 HB3 TYR 29 7.511 -0.154 -7.429
195 HD1 TYR 29 HD1 TYR 29 8.510 1.665 -5.898
196 HD2 TYR 29 HD2 TYR 29 10.846 -1.337 -7.801
197 HE1 TYR 29 HE1 TYR 29 10.516 3.062 -5.630
198 HE2 TYR 29 HE2 TYR 29 12.858 0.049 -7.534
199 HH TYR 29 HH TYR 29 13.469 2.365 -7.216
200 H ALA 30 HN ALA 30 6.549 -0.826 -3.703
201 HA ALA 30 HA ALA 30 4.049 -0.192 -4.942
202 HB1 ALA 30 HB1 ALA 30 2.719 -1.916 -3.849
203 HB2 ALA 30 HB2 ALA 30 3.911 -2.649 -4.921
204 HB3 ALA 30 HB3 ALA 30 4.180 -2.641 -3.177
205 H CYS 31 HN CYS 31 2.420 0.385 -3.237
206 HA CYS 31 HA CYS 31 3.529 0.888 -0.630
207 HB2 CYS 31 HB2 CYS 31 3.045 3.281 -0.648
208 HB3 CYS 31 HB3 CYS 31 4.232 2.875 -1.880
209 H ASN 32 HN ASN 32 1.993 0.708 0.894
210 HA ASN 32 HA ASN 32 -0.611 -0.125 -0.140
211 HB2 ASN 32 HB2 ASN 32 0.862 -1.750 1.118
212 HB3 ASN 32 HB3 ASN 32 0.640 -0.744 2.546
213 HD21 ASN 32 HD21 ASN 32 -0.062 -3.464 2.289
214 HD22 ASN 32 HD22 ASN 32 -1.776 -3.598 2.484
215 H CYS 33 HN CYS 33 -1.947 1.457 -0.053
216 HA CYS 33 HA CYS 33 -1.682 3.653 1.729
217 HB2 CYS 33 HB2 CYS 33 -3.507 2.880 -0.503
218 HB3 CYS 33 HB3 CYS 33 -3.904 4.275 0.518
219 H VAL 34 HN VAL 34 -4.893 2.508 1.057
220 HA VAL 34 HA VAL 34 -5.321 2.369 3.960
221 HB VAL 34 HB VAL 34 -5.926 4.612 3.046
222 HG11 VAL 34 HG11 VAL 34 -7.951 3.079 1.426
223 HG12 VAL 34 HG12 VAL 34 -7.888 4.833 1.590
224 HG13 VAL 34 HG13 VAL 34 -6.564 3.971 0.802
225 HG21 VAL 34 HG21 VAL 34 -8.275 2.979 4.006
226 HG22 VAL 34 HG22 VAL 34 -7.077 3.783 5.023
227 HG23 VAL 34 HG23 VAL 34 -8.172 4.739 4.023
228 H VAL 35 HN VAL 35 -7.228 1.167 4.548
229 HA VAL 35 HA VAL 35 -7.456 -1.227 3.058
230 HB VAL 35 HB VAL 35 -9.208 -1.842 4.697
231 HG11 VAL 35 HG11 VAL 35 -6.657 -0.686 5.826
232 HG12 VAL 35 HG12 VAL 35 -7.704 -1.841 6.652
233 HG13 VAL 35 HG13 VAL 35 -6.876 -2.308 5.165
234 HG21 VAL 35 HG21 VAL 35 -8.687 0.915 5.818
235 HG22 VAL 35 HG22 VAL 35 -10.184 0.365 5.062
236 HG23 VAL 35 HG23 VAL 35 -9.652 -0.347 6.587
237 H GLY 36 HN GLY 36 -8.278 1.047 1.500
238 HA2 GLY 36 HA1 GLY 36 -10.937 0.158 0.692
239 HA3 GLY 36 HA2 GLY 36 -10.793 1.834 1.215
240 H TYR 37 HN TYR 37 -7.898 1.033 -0.003
241 HA TYR 37 HA TYR 37 -8.446 1.404 -2.797
242 HB2 TYR 37 HB2 TYR 37 -7.078 3.528 -1.134
243 HB3 TYR 37 HB3 TYR 37 -6.858 3.400 -2.876
244 HD1 TYR 37 HD1 TYR 37 -8.988 3.555 -4.328
245 HD2 TYR 37 HD2 TYR 37 -8.842 4.768 -0.251
246 HE1 TYR 37 HE1 TYR 37 -11.000 4.927 -4.670
247 HE2 TYR 37 HE2 TYR 37 -10.853 6.139 -0.581
248 HH TYR 37 HH TYR 37 -12.044 7.256 -2.444
249 H ILE 38 HN ILE 38 -7.288 -0.476 -3.195
250 HA ILE 38 HA ILE 38 -4.449 0.155 -3.300
251 HB ILE 38 HB ILE 38 -5.372 -1.936 -1.723
252 HG12 ILE 38 HG12 ILE 38 -2.648 -1.573 -2.960
253 HG13 ILE 38 HG13 ILE 38 -3.264 -0.656 -1.589
254 HG21 ILE 38 HG21 ILE 38 -4.493 -3.973 -2.736
255 HG22 ILE 38 HG22 ILE 38 -5.827 -3.319 -3.687
256 HG23 ILE 38 HG23 ILE 38 -4.163 -3.094 -4.231
257 HD11 ILE 38 HD11 ILE 38 -2.809 -3.635 -1.657
258 HD12 ILE 38 HD12 ILE 38 -1.760 -2.444 -0.888
259 HD13 ILE 38 HD13 ILE 38 -3.390 -2.710 -0.274
260 H GLY 39 HN GLY 39 -3.684 0.014 -5.362
261 HA2 GLY 39 HA1 GLY 39 -5.008 -1.669 -7.314
262 HA3 GLY 39 HA2 GLY 39 -5.245 0.061 -7.557
263 H GLU 40 HN GLU 40 -3.248 -2.574 -8.053
264 HA GLU 40 HA GLU 40 -1.212 -2.898 -8.991
265 HB2 GLU 40 HB2 GLU 40 -1.583 -1.075 -10.555
266 HB3 GLU 40 HB3 GLU 40 -1.216 0.110 -9.303
267 HG2 GLU 40 HG2 GLU 40 0.640 -0.148 -10.858
268 HG3 GLU 40 HG3 GLU 40 1.093 -0.662 -9.229
269 H ARG 41 HN ARG 41 -1.356 -0.055 -7.023
270 HA ARG 41 HA ARG 41 0.233 -1.382 -5.010
271 HB2 ARG 41 HB2 ARG 41 1.510 0.842 -4.725
272 HB3 ARG 41 HB3 ARG 41 1.964 -0.250 -6.029
273 HG2 ARG 41 HG2 ARG 41 1.977 1.773 -7.096
274 HG3 ARG 41 HG3 ARG 41 0.357 1.180 -7.463
275 HD2 ARG 41 HD2 ARG 41 -0.530 2.545 -5.613
276 HD3 ARG 41 HD3 ARG 41 1.096 3.175 -5.322
277 HE ARG 41 HE ARG 41 -0.564 3.685 -7.706
278 HH11 ARG 41 HH12 ARG 41 2.202 4.484 -5.692
279 HH12 ARG 41 HH11 ARG 41 2.589 5.926 -6.583
280 HH21 ARG 41 HH22 ARG 41 -0.049 5.599 -8.853
281 HH22 ARG 41 HH21 ARG 41 1.312 6.554 -8.359
282 H CYS 42 HN CYS 42 -2.144 1.089 -5.862
283 HA CYS 42 HA CYS 42 -3.315 1.219 -3.367
284 HB2 CYS 42 HB2 CYS 42 -1.549 2.322 -2.364
285 HB3 CYS 42 HB3 CYS 42 -1.051 3.106 -3.858
286 H GLN 43 HN GLN 43 -5.199 1.215 -4.743
287 HA GLN 43 HA GLN 43 -6.683 3.162 -4.005
288 HB2 GLN 43 HB2 GLN 43 -5.232 4.337 -6.304
289 HB3 GLN 43 HB3 GLN 43 -6.932 4.747 -6.086
290 HG2 GLN 43 HG2 GLN 43 -6.487 5.496 -3.837
291 HG3 GLN 43 HG3 GLN 43 -4.808 4.985 -3.993
292 HE21 GLN 43 HE21 GLN 43 -4.768 5.978 -6.809
293 HE22 GLN 43 HE22 GLN 43 -4.617 7.699 -6.681
294 H TYR 44 HN TYR 44 -7.103 0.699 -4.613
295 HA TYR 44 HA TYR 44 -9.687 1.083 -5.818
296 HB2 TYR 44 HB2 TYR 44 -7.588 -0.151 -7.375
297 HB3 TYR 44 HB3 TYR 44 -8.877 -1.312 -7.063
298 HD1 TYR 44 HD1 TYR 44 -11.324 -0.325 -7.455
299 HD2 TYR 44 HD2 TYR 44 -7.771 1.188 -9.233
300 HE1 TYR 44 HE1 TYR 44 -12.659 0.671 -9.266
301 HE2 TYR 44 HE2 TYR 44 -9.091 2.186 -11.048
302 HH TYR 44 HH TYR 44 -11.333 1.753 -12.145
303 H ARG 45 HN ARG 45 -11.131 -0.009 -4.679
304 HA ARG 45 HA ARG 45 -12.116 -1.725 -3.609
305 HB2 ARG 45 HB2 ARG 45 -9.573 -3.197 -4.232
306 HB3 ARG 45 HB3 ARG 45 -10.953 -3.950 -3.429
307 HG2 ARG 45 HG2 ARG 45 -11.440 -4.580 -5.537
308 HG3 ARG 45 HG3 ARG 45 -12.177 -2.977 -5.606
309 HD2 ARG 45 HD2 ARG 45 -10.820 -3.261 -7.555
310 HD3 ARG 45 HD3 ARG 45 -10.029 -2.095 -6.490
311 HE ARG 45 HE ARG 45 -8.700 -4.190 -5.752
312 HH11 ARG 45 HH12 ARG 45 -9.858 -3.542 -8.997
313 HH12 ARG 45 HH11 ARG 45 -8.528 -4.358 -9.762
314 HH21 ARG 45 HH22 ARG 45 -6.965 -5.275 -6.745
315 HH22 ARG 45 HH21 ARG 45 -6.883 -5.366 -8.487
316 H ASP 46 HN ASP 46 -12.473 -2.459 -1.699
317 HA ASP 46 HA ASP 46 -10.625 -1.671 0.432
318 HB2 ASP 46 HB2 ASP 46 -13.515 -2.589 0.583
319 HB3 ASP 46 HB3 ASP 46 -12.567 -1.899 1.897
320 H LEU 47 HN LEU 47 -10.167 -3.912 -1.297
321 HA LEU 47 HA LEU 47 -11.243 -6.340 -0.527
322 HB2 LEU 47 HB2 LEU 47 -9.558 -7.359 -1.887
323 HB3 LEU 47 HB3 LEU 47 -10.099 -5.883 -2.652
324 HG LEU 47 HG LEU 47 -7.809 -5.981 -3.058
325 HD11 LEU 47 HD11 LEU 47 -8.479 -3.769 -2.378
326 HD12 LEU 47 HD12 LEU 47 -8.108 -4.152 -0.699
327 HD13 LEU 47 HD13 LEU 47 -6.815 -4.096 -1.896
328 HD21 LEU 47 HD21 LEU 47 -7.184 -7.723 -1.504
329 HD22 LEU 47 HD22 LEU 47 -6.082 -6.351 -1.370
330 HD23 LEU 47 HD23 LEU 47 -7.333 -6.598 -0.153
331 H LYS 48 HN LYS 48 -9.057 -4.507 1.203
332 HA LYS 48 HA LYS 48 -7.750 -6.741 2.506
333 HB2 LYS 48 HB2 LYS 48 -7.127 -4.351 3.846
334 HB3 LYS 48 HB3 LYS 48 -6.131 -5.201 2.664
335 HG2 LYS 48 HG2 LYS 48 -7.322 -3.984 0.869
336 HG3 LYS 48 HG3 LYS 48 -8.169 -3.070 2.120
337 HD2 LYS 48 HD2 LYS 48 -6.300 -1.844 2.650
338 HD3 LYS 48 HD3 LYS 48 -5.190 -3.141 2.190
339 HE2 LYS 48 HE2 LYS 48 -5.231 -1.095 0.671
340 HE3 LYS 48 HE3 LYS 48 -5.422 -2.664 -0.108
341 HZ1 LYS 48 HZ1 LYS 48 -6.978 -0.976 -0.923
342 HZ2 LYS 48 HZ2 LYS 48 -7.652 -0.852 0.621
343 HZ3 LYS 48 HZ3 LYS 48 -7.776 -2.298 -0.242
344 H TRP 49 HN TRP 49 -9.639 -3.904 3.625
345 HA TRP 49 HA TRP 49 -10.270 -5.434 6.036
346 HB2 TRP 49 HB2 TRP 49 -9.392 -3.215 6.419
347 HB3 TRP 49 HB3 TRP 49 -10.671 -2.505 5.438
348 HD1 TRP 49 HD1 TRP 49 -12.467 -1.435 6.886
349 HE1 TRP 49 HE1 TRP 49 -13.527 -1.902 9.189
350 HE3 TRP 49 HE3 TRP 49 -9.808 -5.604 8.158
351 HZ2 TRP 49 HZ2 TRP 49 -13.263 -3.791 11.260
352 HZ3 TRP 49 HZ3 TRP 49 -10.273 -6.684 10.320
353 HH2 TRP 49 HH2 TRP 49 -11.964 -5.796 11.836
354 H TRP 50 HN TRP 50 -12.015 -3.751 3.417
355 HA TRP 50 HA TRP 50 -14.505 -4.305 4.861
356 HB2 TRP 50 HB2 TRP 50 -13.931 -1.981 4.110
357 HB3 TRP 50 HB3 TRP 50 -14.124 -2.531 2.450
358 HD1 TRP 50 HD1 TRP 50 -16.613 -2.940 1.573
359 HE1 TRP 50 HE1 TRP 50 -18.916 -2.233 2.498
360 HE3 TRP 50 HE3 TRP 50 -15.201 -1.619 6.306
361 HZ2 TRP 50 HZ2 TRP 50 -19.975 -1.244 4.924
362 HZ3 TRP 50 HZ3 TRP 50 -16.920 -0.801 7.866
363 HH2 TRP 50 HH2 TRP 50 -19.255 -0.619 7.187
364 H GLU 51 HN GLU 51 -13.045 -4.832 1.668
365 HA GLU 51 HA GLU 51 -15.478 -5.858 0.552
366 HB2 GLU 51 HB2 GLU 51 -12.648 -5.648 -0.434
367 HB3 GLU 51 HB3 GLU 51 -13.848 -6.566 -1.334
368 HG2 GLU 51 HG2 GLU 51 -14.035 -3.663 -0.593
369 HG3 GLU 51 HG3 GLU 51 -13.573 -4.294 -2.173
370 H LEU 52 HN LEU 52 -12.391 -7.299 1.505
371 HA LEU 52 HA LEU 52 -13.634 -9.946 1.242
372 HB2 LEU 52 HB2 LEU 52 -10.705 -9.285 1.356
373 HB3 LEU 52 HB3 LEU 52 -11.427 -10.826 0.913
374 HG LEU 52 HG LEU 52 -11.563 -8.258 -0.662
375 HD11 LEU 52 HD11 LEU 52 -10.235 -9.540 -2.314
376 HD12 LEU 52 HD12 LEU 52 -9.385 -9.299 -0.788
377 HD13 LEU 52 HD13 LEU 52 -10.115 -10.862 -1.152
378 HD21 LEU 52 HD21 LEU 52 -12.688 -10.987 -1.301
379 HD22 LEU 52 HD22 LEU 52 -13.621 -9.545 -0.898
380 HD23 LEU 52 HD23 LEU 52 -12.675 -9.597 -2.385
381 H ARG 53 HN ARG 53 -11.804 -7.819 3.304
382 HA ARG 53 HA ARG 53 -11.365 -7.815 5.542
383 HB2 ARG 53 HB2 ARG 53 -13.328 -10.112 5.760
384 HB3 ARG 53 HB3 ARG 53 -12.725 -9.131 7.089
385 HG2 ARG 53 HG2 ARG 53 -13.813 -7.155 6.026
386 HG3 ARG 53 HG3 ARG 53 -14.530 -8.253 4.847
387 HD2 ARG 53 HD2 ARG 53 -16.136 -7.835 6.577
388 HD3 ARG 53 HD3 ARG 53 -15.570 -9.498 6.722
389 HE ARG 53 HE ARG 53 -14.239 -7.506 8.379
390 HH11 ARG 53 HH12 ARG 53 -16.592 -10.078 8.139
391 HH12 ARG 53 HH11 ARG 53 -16.696 -10.314 9.862
392 HH21 ARG 53 HH22 ARG 53 -14.388 -7.818 10.664
393 HH22 ARG 53 HH21 ARG 53 -15.424 -9.067 11.273
Start of MODEL 10
1 H1 ASN 1 H1 ASN 1 9.941 -11.696 3.916
2 H2 ASN 1 H2 ASN 1 10.799 -11.281 5.317
3 H3 ASN 1 H3 ASN 1 11.555 -12.188 4.102
4 HA ASN 1 HA ASN 1 12.306 -9.921 4.038
5 HB2 ASN 1 HB2 ASN 1 10.550 -10.825 1.758
6 HB3 ASN 1 HB3 ASN 1 11.534 -9.367 1.662
7 HD21 ASN 1 HD21 ASN 1 13.753 -9.543 1.475
8 HD22 ASN 1 HD22 ASN 1 14.548 -11.050 1.162
9 H SER 2 HN SER 2 10.242 -8.481 2.042
10 HA SER 2 HA SER 2 9.049 -6.557 2.213
11 HB2 SER 2 HB2 SER 2 8.035 -7.800 4.791
12 HB3 SER 2 HB3 SER 2 7.308 -6.420 3.960
13 HG SER 2 HG SER 2 6.827 -8.972 3.540
14 H ASP 3 HN ASP 3 11.300 -5.835 2.484
15 HA ASP 3 HA ASP 3 12.004 -5.141 5.262
16 HB2 ASP 3 HB2 ASP 3 14.373 -5.501 4.553
17 HB3 ASP 3 HB3 ASP 3 13.388 -6.957 4.486
18 H SER 4 HN SER 4 14.272 -3.638 4.733
19 HA SER 4 HA SER 4 14.894 -1.496 4.349
20 HB2 SER 4 HB2 SER 4 14.813 -1.945 2.012
21 HB3 SER 4 HB3 SER 4 13.054 -1.897 1.984
22 HG SER 4 HG SER 4 13.203 0.121 1.536
23 H GLU 5 HN GLU 5 13.673 0.840 3.886
24 HA GLU 5 HA GLU 5 11.240 0.878 5.501
25 HB2 GLU 5 HB2 GLU 5 13.754 2.404 6.200
26 HB3 GLU 5 HB3 GLU 5 12.189 2.662 6.954
27 HG2 GLU 5 HG2 GLU 5 12.216 0.471 7.911
28 HG3 GLU 5 HG3 GLU 5 13.670 0.046 7.005
29 H CYS 6 HN CYS 6 9.823 2.314 4.776
30 HA CYS 6 HA CYS 6 10.689 4.315 2.826
31 HB2 CYS 6 HB2 CYS 6 8.040 3.133 3.586
32 HB3 CYS 6 HB3 CYS 6 8.113 4.661 2.717
33 HA PRO 7 HA PRO 7 10.081 7.381 6.041
34 HB2 PRO 7 HB2 PRO 7 11.629 9.261 4.692
35 HB3 PRO 7 HB3 PRO 7 12.220 8.091 5.872
36 HG2 PRO 7 HG2 PRO 7 12.801 8.178 3.089
37 HG3 PRO 7 HG3 PRO 7 13.280 6.932 4.249
38 HD2 PRO 7 HD2 PRO 7 11.038 6.944 2.306
39 HD3 PRO 7 HD3 PRO 7 11.949 5.574 2.978
40 H LEU 8 HN LEU 8 9.888 9.997 5.634
41 HA LEU 8 HA LEU 8 7.279 10.402 4.736
42 HB2 LEU 8 HB2 LEU 8 8.631 11.795 6.328
43 HB3 LEU 8 HB3 LEU 8 9.434 12.496 4.940
44 HG LEU 8 HG LEU 8 7.227 13.331 4.141
45 HD11 LEU 8 HD11 LEU 8 5.358 13.382 5.712
46 HD12 LEU 8 HD12 LEU 8 5.795 11.727 5.288
47 HD13 LEU 8 HD13 LEU 8 6.278 12.394 6.846
48 HD21 LEU 8 HD21 LEU 8 7.073 15.149 5.765
49 HD22 LEU 8 HD22 LEU 8 8.052 14.222 6.902
50 HD23 LEU 8 HD23 LEU 8 8.754 14.775 5.381
51 H SER 9 HN SER 9 9.935 9.861 2.850
52 HA SER 9 HA SER 9 9.217 11.698 0.704
53 HB2 SER 9 HB2 SER 9 11.373 10.733 -0.300
54 HB3 SER 9 HB3 SER 9 11.540 11.711 1.160
55 HG SER 9 HG SER 9 12.545 10.023 1.914
56 H HIS 10 HN HIS 10 9.516 8.226 1.378
57 HA HIS 10 HA HIS 10 8.763 7.630 -1.379
58 HB2 HIS 10 HB2 HIS 10 9.820 5.893 0.847
59 HB3 HIS 10 HB3 HIS 10 9.238 5.232 -0.677
60 HD1 HIS 10 HD1 HIS 10 10.874 5.158 -2.572
61 HD2 HIS 10 HD2 HIS 10 12.128 7.643 0.524
62 HE1 HIS 10 HE1 HIS 10 13.227 5.843 -3.158
63 HE2 HIS 10 HE2 HIS 10 14.024 7.212 -1.188
64 H ASP 11 HN ASP 11 7.812 6.082 1.709
65 HA ASP 11 HA ASP 11 5.230 5.415 0.897
66 HB2 ASP 11 HB2 ASP 11 4.854 4.743 3.074
67 HB3 ASP 11 HB3 ASP 11 6.611 4.808 3.078
68 H GLY 12 HN GLY 12 6.572 8.343 2.211
69 HA2 GLY 12 HA1 GLY 12 4.167 9.780 2.547
70 HA3 GLY 12 HA2 GLY 12 5.755 10.487 2.292
71 H TYR 13 HN TYR 13 5.874 8.832 -0.295
72 HA TYR 13 HA TYR 13 4.482 10.785 -1.948
73 HB2 TYR 13 HB2 TYR 13 6.877 10.081 -2.395
74 HB3 TYR 13 HB3 TYR 13 6.242 8.516 -2.892
75 HD1 TYR 13 HD1 TYR 13 6.201 12.135 -3.691
76 HD2 TYR 13 HD2 TYR 13 5.335 8.197 -5.049
77 HE1 TYR 13 HE1 TYR 13 5.861 13.001 -5.968
78 HE2 TYR 13 HE2 TYR 13 4.993 9.051 -7.327
79 HH TYR 13 HH TYR 13 5.973 12.113 -8.313
80 H CYS 14 HN CYS 14 4.074 7.582 -0.794
81 HA CYS 14 HA CYS 14 2.310 6.619 -2.782
82 HB2 CYS 14 HB2 CYS 14 2.433 5.970 0.175
83 HB3 CYS 14 HB3 CYS 14 1.507 5.055 -1.017
84 H LEU 15 HN LEU 15 -0.278 6.192 -1.630
85 HA LEU 15 HA LEU 15 -0.946 8.928 -2.383
86 HB2 LEU 15 HB2 LEU 15 -2.583 6.433 -2.679
87 HB3 LEU 15 HB3 LEU 15 -3.048 8.029 -3.239
88 HG LEU 15 HG LEU 15 -0.752 6.358 -4.239
89 HD11 LEU 15 HD11 LEU 15 -1.975 6.467 -6.362
90 HD12 LEU 15 HD12 LEU 15 -2.922 5.687 -5.095
91 HD13 LEU 15 HD13 LEU 15 -3.272 7.351 -5.561
92 HD21 LEU 15 HD21 LEU 15 -0.063 8.684 -4.169
93 HD22 LEU 15 HD22 LEU 15 -0.350 8.183 -5.836
94 HD23 LEU 15 HD23 LEU 15 -1.545 9.169 -4.994
95 H HIS 16 HN HIS 16 -3.171 6.632 -0.832
96 HA HIS 16 HA HIS 16 -4.220 9.032 0.486
97 HB2 HIS 16 HB2 HIS 16 -5.507 7.174 -1.066
98 HB3 HIS 16 HB3 HIS 16 -5.920 6.648 0.562
99 HD1 HIS 16 HD1 HIS 16 -5.482 10.274 0.369
100 HD2 HIS 16 HD2 HIS 16 -8.572 7.562 -0.265
101 HE1 HIS 16 HE1 HIS 16 -7.596 11.635 0.397
102 HE2 HIS 16 HE2 HIS 16 -9.415 10.014 -0.239
103 H ASP 17 HN ASP 17 -2.054 7.422 1.409
104 HA ASP 17 HA ASP 17 -2.144 7.885 4.046
105 HB2 ASP 17 HB2 ASP 17 -3.946 6.141 4.215
106 HB3 ASP 17 HB3 ASP 17 -2.783 4.952 3.635
107 H GLY 18 HN GLY 18 -1.300 5.412 1.757
108 HA2 GLY 18 HA1 GLY 18 0.653 4.629 0.959
109 HA3 GLY 18 HA2 GLY 18 1.247 6.249 1.268
110 H VAL 19 HN VAL 19 1.391 2.965 2.099
111 HA VAL 19 HA VAL 19 3.862 3.587 3.542
112 HB VAL 19 HB VAL 19 1.898 1.426 4.365
113 HG11 VAL 19 HG11 VAL 19 3.521 0.836 6.094
114 HG12 VAL 19 HG12 VAL 19 4.213 0.637 4.483
115 HG13 VAL 19 HG13 VAL 19 4.643 2.041 5.459
116 HG21 VAL 19 HG21 VAL 19 1.290 3.634 5.198
117 HG22 VAL 19 HG22 VAL 19 1.847 2.599 6.513
118 HG23 VAL 19 HG23 VAL 19 2.912 3.841 5.856
119 H CYS 20 HN CYS 20 5.533 2.635 2.426
120 HA CYS 20 HA CYS 20 4.754 0.521 0.566
121 HB2 CYS 20 HB2 CYS 20 6.998 1.233 -0.590
122 HB3 CYS 20 HB3 CYS 20 5.513 2.127 -0.885
123 H MET 21 HN MET 21 5.523 -1.362 0.810
124 HA MET 21 HA MET 21 8.204 -1.864 1.565
125 HB2 MET 21 HB2 MET 21 7.825 -3.027 3.644
126 HB3 MET 21 HB3 MET 21 7.197 -1.405 3.793
127 HG2 MET 21 HG2 MET 21 4.939 -2.208 3.485
128 HG3 MET 21 HG3 MET 21 5.533 -3.848 3.239
129 HE1 MET 21 HE1 MET 21 5.919 -1.591 7.243
130 HE2 MET 21 HE2 MET 21 6.853 -1.192 5.800
131 HE3 MET 21 HE3 MET 21 5.113 -0.907 5.832
132 H TYR 22 HN TYR 22 8.753 -3.615 0.340
133 HA TYR 22 HA TYR 22 7.647 -6.072 0.745
134 HB2 TYR 22 HB2 TYR 22 6.349 -4.587 -1.384
135 HB3 TYR 22 HB3 TYR 22 7.168 -6.026 -1.968
136 HD1 TYR 22 HD1 TYR 22 6.676 -7.487 0.798
137 HD2 TYR 22 HD2 TYR 22 4.170 -5.523 -2.020
138 HE1 TYR 22 HE1 TYR 22 4.782 -8.878 1.522
139 HE2 TYR 22 HE2 TYR 22 2.269 -6.907 -1.304
140 HH TYR 22 HH TYR 22 2.325 -8.789 1.524
141 H ILE 23 HN ILE 23 9.460 -7.096 0.661
142 HA ILE 23 HA ILE 23 11.656 -7.610 0.133
143 HB ILE 23 HB ILE 23 10.869 -8.044 -2.624
144 HG12 ILE 23 HG12 ILE 23 8.740 -7.870 -1.099
145 HG13 ILE 23 HG13 ILE 23 8.851 -9.124 -2.353
146 HG21 ILE 23 HG21 ILE 23 12.686 -9.259 -1.550
147 HG22 ILE 23 HG22 ILE 23 11.562 -9.901 -0.353
148 HG23 ILE 23 HG23 ILE 23 11.414 -10.372 -2.048
149 HD11 ILE 23 HD11 ILE 23 9.405 -9.484 0.590
150 HD12 ILE 23 HD12 ILE 23 7.962 -10.017 -0.272
151 HD13 ILE 23 HD13 ILE 23 9.527 -10.742 -0.639
152 H GLU 24 HN GLU 24 12.314 -5.308 0.246
153 HA GLU 24 HA GLU 24 12.250 -3.709 -2.155
154 HB2 GLU 24 HB2 GLU 24 13.018 -3.228 0.679
155 HB3 GLU 24 HB3 GLU 24 13.103 -1.964 -0.545
156 HG2 GLU 24 HG2 GLU 24 10.621 -2.434 -0.922
157 HG3 GLU 24 HG3 GLU 24 10.693 -3.361 0.587
158 H ALA 25 HN ALA 25 14.380 -5.607 -0.331
159 HA ALA 25 HA ALA 25 16.803 -4.578 -1.507
160 HB1 ALA 25 HB1 ALA 25 16.304 -7.174 -0.037
161 HB2 ALA 25 HB2 ALA 25 17.881 -6.539 -0.503
162 HB3 ALA 25 HB3 ALA 25 16.904 -5.681 0.687
163 H LEU 26 HN LEU 26 14.128 -6.220 -2.458
164 HA LEU 26 HA LEU 26 15.583 -7.345 -4.708
165 HB2 LEU 26 HB2 LEU 26 12.908 -8.142 -3.625
166 HB3 LEU 26 HB3 LEU 26 13.489 -8.652 -5.198
167 HG LEU 26 HG LEU 26 14.578 -9.409 -2.494
168 HD11 LEU 26 HD11 LEU 26 14.205 -11.692 -3.358
169 HD12 LEU 26 HD12 LEU 26 12.720 -10.746 -3.250
170 HD13 LEU 26 HD13 LEU 26 13.494 -10.997 -4.813
171 HD21 LEU 26 HD21 LEU 26 16.469 -8.871 -3.948
172 HD22 LEU 26 HD22 LEU 26 16.365 -10.604 -3.638
173 HD23 LEU 26 HD23 LEU 26 15.826 -9.951 -5.185
174 H ASP 27 HN ASP 27 14.275 -4.756 -3.688
175 HA ASP 27 HA ASP 27 13.639 -2.844 -4.687
176 HB2 ASP 27 HB2 ASP 27 15.451 -3.476 -6.181
177 HB3 ASP 27 HB3 ASP 27 14.326 -4.364 -7.203
178 H LYS 28 HN LYS 28 11.799 -4.781 -3.952
179 HA LYS 28 HA LYS 28 9.622 -4.391 -5.903
180 HB2 LYS 28 HB2 LYS 28 9.459 -5.872 -3.275
181 HB3 LYS 28 HB3 LYS 28 8.421 -6.047 -4.691
182 HG2 LYS 28 HG2 LYS 28 11.338 -6.741 -4.891
183 HG3 LYS 28 HG3 LYS 28 10.199 -7.864 -4.143
184 HD2 LYS 28 HD2 LYS 28 10.484 -8.404 -6.502
185 HD3 LYS 28 HD3 LYS 28 8.833 -7.893 -6.172
186 HE2 LYS 28 HE2 LYS 28 9.339 -6.812 -8.157
187 HE3 LYS 28 HE3 LYS 28 9.636 -5.569 -6.947
188 HZ1 LYS 28 HZ1 LYS 28 11.387 -5.698 -8.644
189 HZ2 LYS 28 HZ2 LYS 28 11.738 -7.286 -8.161
190 HZ3 LYS 28 HZ3 LYS 28 11.985 -6.000 -7.088
191 H TYR 29 HN TYR 29 7.460 -3.694 -4.880
192 HA TYR 29 HA TYR 29 7.539 -2.248 -2.445
193 HB2 TYR 29 HB2 TYR 29 7.345 0.025 -3.253
194 HB3 TYR 29 HB3 TYR 29 8.848 -0.671 -3.846
195 HD1 TYR 29 HD2 TYR 29 8.929 -1.442 -6.281
196 HD2 TYR 29 HD1 TYR 29 5.754 0.917 -4.713
197 HE1 TYR 29 HE2 TYR 29 8.299 -0.775 -8.564
198 HE2 TYR 29 HE1 TYR 29 5.111 1.584 -6.988
199 HH TYR 29 HH TYR 29 6.119 1.773 -9.210
200 H ALA 30 HN ALA 30 5.545 -2.454 -1.662
201 HA ALA 30 HA ALA 30 3.344 -1.726 -3.484
202 HB1 ALA 30 HB1 ALA 30 1.843 -3.080 -2.096
203 HB2 ALA 30 HB2 ALA 30 3.136 -4.058 -2.794
204 HB3 ALA 30 HB3 ALA 30 3.214 -3.573 -1.101
205 H CYS 31 HN CYS 31 1.899 -0.172 -2.744
206 HA CYS 31 HA CYS 31 2.662 1.186 -0.254
207 HB2 CYS 31 HB2 CYS 31 1.080 2.259 -2.612
208 HB3 CYS 31 HB3 CYS 31 1.328 3.131 -1.110
209 H ASN 32 HN ASN 32 1.469 0.551 1.354
210 HA ASN 32 HA ASN 32 -1.259 -0.358 0.823
211 HB2 ASN 32 HB2 ASN 32 0.342 -1.929 1.903
212 HB3 ASN 32 HB3 ASN 32 0.478 -0.814 3.264
213 HD21 ASN 32 HD21 ASN 32 -0.341 -2.245 4.764
214 HD22 ASN 32 HD22 ASN 32 -1.999 -2.742 4.782
215 H CYS 33 HN CYS 33 -2.546 1.294 0.955
216 HA CYS 33 HA CYS 33 -2.018 3.488 2.752
217 HB2 CYS 33 HB2 CYS 33 -3.949 3.059 0.483
218 HB3 CYS 33 HB3 CYS 33 -4.001 4.500 1.512
219 H VAL 34 HN VAL 34 -5.242 2.257 1.871
220 HA VAL 34 HA VAL 34 -5.877 2.178 4.719
221 HB VAL 34 HB VAL 34 -6.151 4.542 3.820
222 HG11 VAL 34 HG11 VAL 34 -8.395 3.262 2.269
223 HG12 VAL 34 HG12 VAL 34 -8.164 4.998 2.483
224 HG13 VAL 34 HG13 VAL 34 -6.959 4.048 1.614
225 HG21 VAL 34 HG21 VAL 34 -8.638 3.183 4.865
226 HG22 VAL 34 HG22 VAL 34 -7.295 3.780 5.840
227 HG23 VAL 34 HG23 VAL 34 -8.296 4.911 4.927
228 H VAL 35 HN VAL 35 -7.982 1.168 5.080
229 HA VAL 35 HA VAL 35 -8.252 -1.068 3.330
230 HB VAL 35 HB VAL 35 -9.864 -1.929 4.900
231 HG11 VAL 35 HG11 VAL 35 -7.503 -2.137 5.433
232 HG12 VAL 35 HG12 VAL 35 -7.533 -0.577 6.256
233 HG13 VAL 35 HG13 VAL 35 -8.447 -1.936 6.910
234 HG21 VAL 35 HG21 VAL 35 -9.698 0.766 6.259
235 HG22 VAL 35 HG22 VAL 35 -11.101 0.120 5.404
236 HG23 VAL 35 HG23 VAL 35 -10.539 -0.652 6.887
237 H GLY 36 HN GLY 36 -8.758 0.938 1.789
238 HA2 GLY 36 HA1 GLY 36 -11.418 0.534 0.823
239 HA3 GLY 36 HA2 GLY 36 -11.212 2.129 1.541
240 H TYR 37 HN TYR 37 -8.307 1.073 0.408
241 HA TYR 37 HA TYR 37 -8.576 1.922 -2.297
242 HB2 TYR 37 HB2 TYR 37 -7.078 3.631 -0.287
243 HB3 TYR 37 HB3 TYR 37 -6.738 3.687 -2.009
244 HD1 TYR 37 HD1 TYR 37 -8.375 4.644 -3.561
245 HD2 TYR 37 HD2 TYR 37 -9.053 4.644 0.637
246 HE1 TYR 37 HE1 TYR 37 -10.160 6.302 -3.857
247 HE2 TYR 37 HE2 TYR 37 -10.843 6.305 0.353
248 HH TYR 37 HH TYR 37 -11.526 8.031 -1.284
249 H ILE 38 HN ILE 38 -7.683 0.006 -2.872
250 HA ILE 38 HA ILE 38 -4.795 0.078 -2.739
251 HB ILE 38 HB ILE 38 -6.117 -1.823 -1.284
252 HG12 ILE 38 HG12 ILE 38 -3.780 -1.216 -1.079
253 HG13 ILE 38 HG13 ILE 38 -3.946 -2.965 -1.186
254 HG21 ILE 38 HG21 ILE 38 -6.994 -2.941 -3.269
255 HG22 ILE 38 HG22 ILE 38 -5.351 -3.150 -3.879
256 HG23 ILE 38 HG23 ILE 38 -5.854 -3.969 -2.400
257 HD11 ILE 38 HD11 ILE 38 -3.272 -2.884 -3.531
258 HD12 ILE 38 HD12 ILE 38 -3.095 -1.133 -3.416
259 HD13 ILE 38 HD13 ILE 38 -2.047 -2.190 -2.469
260 H GLY 39 HN GLY 39 -4.006 0.048 -4.727
261 HA2 GLY 39 HA1 GLY 39 -4.936 -1.760 -6.720
262 HA3 GLY 39 HA2 GLY 39 -5.348 -0.089 -7.111
263 H GLU 40 HN GLU 40 -2.905 -2.450 -7.068
264 HA GLU 40 HA GLU 40 -0.751 -2.533 -7.737
265 HB2 GLU 40 HB2 GLU 40 -1.421 -1.070 -9.611
266 HB3 GLU 40 HB3 GLU 40 -1.159 0.344 -8.596
267 HG2 GLU 40 HG2 GLU 40 0.716 0.082 -10.045
268 HG3 GLU 40 HG3 GLU 40 1.225 -0.301 -8.402
269 H ARG 41 HN ARG 41 -1.492 0.610 -6.329
270 HA ARG 41 HA ARG 41 0.371 0.175 -4.160
271 HB2 ARG 41 HB2 ARG 41 1.415 2.469 -4.706
272 HB3 ARG 41 HB3 ARG 41 1.905 1.063 -5.650
273 HG2 ARG 41 HG2 ARG 41 1.608 2.766 -7.226
274 HG3 ARG 41 HG3 ARG 41 0.168 1.754 -7.345
275 HD2 ARG 41 HD2 ARG 41 -1.057 3.367 -5.945
276 HD3 ARG 41 HD3 ARG 41 0.380 4.395 -5.904
277 HE ARG 41 HE ARG 41 -1.146 3.754 -8.348
278 HH11 ARG 41 HH12 ARG 41 0.827 5.924 -6.450
279 HH12 ARG 41 HH11 ARG 41 0.810 7.195 -7.634
280 HH21 ARG 41 HH22 ARG 41 -1.171 5.394 -9.914
281 HH22 ARG 41 HH21 ARG 41 -0.320 6.887 -9.623
282 H CYS 42 HN CYS 42 -2.339 0.281 -4.257
283 HA CYS 42 HA CYS 42 -4.094 1.038 -3.114
284 HB2 CYS 42 HB2 CYS 42 -3.780 2.136 -1.174
285 HB3 CYS 42 HB3 CYS 42 -2.079 1.895 -1.537
286 H GLN 43 HN GLN 43 -5.517 1.655 -4.634
287 HA GLN 43 HA GLN 43 -6.237 4.376 -4.446
288 HB2 GLN 43 HB2 GLN 43 -6.041 5.085 -6.787
289 HB3 GLN 43 HB3 GLN 43 -4.478 4.797 -6.044
290 HG2 GLN 43 HG2 GLN 43 -4.342 2.630 -7.169
291 HG3 GLN 43 HG3 GLN 43 -5.906 2.935 -7.928
292 HE21 GLN 43 HE21 GLN 43 -5.046 2.855 -10.011
293 HE22 GLN 43 HE22 GLN 43 -4.042 4.110 -10.642
294 H TYR 44 HN TYR 44 -7.196 1.439 -4.504
295 HA TYR 44 HA TYR 44 -9.712 2.001 -5.901
296 HB2 TYR 44 HB2 TYR 44 -7.894 -0.321 -6.506
297 HB3 TYR 44 HB3 TYR 44 -9.613 -0.319 -6.895
298 HD1 TYR 44 HD1 TYR 44 -10.335 1.948 -8.203
299 HD2 TYR 44 HD2 TYR 44 -6.466 0.183 -8.227
300 HE1 TYR 44 HE1 TYR 44 -9.852 3.051 -10.343
301 HE2 TYR 44 HE2 TYR 44 -5.971 1.283 -10.370
302 HH TYR 44 HH TYR 44 -7.256 2.187 -12.314
303 H ARG 45 HN ARG 45 -10.969 -0.013 -5.680
304 HA ARG 45 HA ARG 45 -12.144 -1.151 -3.941
305 HB2 ARG 45 HB2 ARG 45 -9.817 -2.812 -4.846
306 HB3 ARG 45 HB3 ARG 45 -11.390 -3.428 -4.328
307 HG2 ARG 45 HG2 ARG 45 -12.251 -3.163 -6.365
308 HG3 ARG 45 HG3 ARG 45 -11.651 -1.507 -6.477
309 HD2 ARG 45 HD2 ARG 45 -10.628 -2.712 -8.243
310 HD3 ARG 45 HD3 ARG 45 -9.387 -2.480 -7.003
311 HE ARG 45 HE ARG 45 -10.652 -4.948 -6.555
312 HH11 ARG 45 HH12 ARG 45 -8.588 -3.433 -8.954
313 HH12 ARG 45 HH11 ARG 45 -7.838 -4.933 -9.424
314 HH21 ARG 45 HH22 ARG 45 -9.662 -6.910 -7.188
315 HH22 ARG 45 HH21 ARG 45 -8.427 -6.891 -8.410
316 H ASP 46 HN ASP 46 -12.429 -1.958 -2.056
317 HA ASP 46 HA ASP 46 -10.515 -1.200 -0.015
318 HB2 ASP 46 HB2 ASP 46 -13.196 -2.497 0.463
319 HB3 ASP 46 HB3 ASP 46 -12.323 -1.382 1.503
320 H LEU 47 HN LEU 47 -9.716 -3.317 -1.645
321 HA LEU 47 HA LEU 47 -10.637 -5.853 -1.183
322 HB2 LEU 47 HB2 LEU 47 -7.800 -5.034 -1.789
323 HB3 LEU 47 HB3 LEU 47 -8.450 -6.648 -1.991
324 HG LEU 47 HG LEU 47 -9.269 -4.185 -3.529
325 HD11 LEU 47 HD11 LEU 47 -7.110 -5.095 -4.192
326 HD12 LEU 47 HD12 LEU 47 -7.830 -6.695 -4.373
327 HD13 LEU 47 HD13 LEU 47 -8.326 -5.379 -5.438
328 HD21 LEU 47 HD21 LEU 47 -10.282 -7.017 -3.737
329 HD22 LEU 47 HD22 LEU 47 -11.194 -5.629 -3.143
330 HD23 LEU 47 HD23 LEU 47 -10.686 -5.694 -4.831
331 H LYS 48 HN LYS 48 -8.419 -4.034 0.823
332 HA LYS 48 HA LYS 48 -7.143 -6.267 1.964
333 HB2 LYS 48 HB2 LYS 48 -6.629 -4.411 3.787
334 HB3 LYS 48 HB3 LYS 48 -5.829 -4.447 2.222
335 HG2 LYS 48 HG2 LYS 48 -7.547 -2.839 1.393
336 HG3 LYS 48 HG3 LYS 48 -8.143 -2.712 3.050
337 HD2 LYS 48 HD2 LYS 48 -6.689 -0.956 3.048
338 HD3 LYS 48 HD3 LYS 48 -5.593 -2.245 3.543
339 HE2 LYS 48 HE2 LYS 48 -5.930 -1.223 0.695
340 HE3 LYS 48 HE3 LYS 48 -4.627 -0.789 1.814
341 HZ1 LYS 48 HZ1 LYS 48 -5.153 -3.604 1.022
342 HZ2 LYS 48 HZ2 LYS 48 -3.810 -2.988 1.850
343 HZ3 LYS 48 HZ3 LYS 48 -4.051 -2.600 0.227
344 H TRP 49 HN TRP 49 -9.360 -4.007 3.653
345 HA TRP 49 HA TRP 49 -9.981 -6.225 5.451
346 HB2 TRP 49 HB2 TRP 49 -10.077 -3.258 5.758
347 HB3 TRP 49 HB3 TRP 49 -11.055 -4.282 6.812
348 HD1 TRP 49 HD1 TRP 49 -7.424 -4.959 5.624
349 HE1 TRP 49 HE1 TRP 49 -5.941 -5.240 7.707
350 HE3 TRP 49 HE3 TRP 49 -10.904 -3.917 9.235
351 HZ2 TRP 49 HZ2 TRP 49 -6.219 -5.040 10.516
352 HZ3 TRP 49 HZ3 TRP 49 -10.206 -3.982 11.594
353 HH2 TRP 49 HH2 TRP 49 -7.916 -4.531 12.217
354 H TRP 50 HN TRP 50 -11.546 -4.168 3.094
355 HA TRP 50 HA TRP 50 -14.124 -4.770 4.320
356 HB2 TRP 50 HB2 TRP 50 -13.574 -2.404 3.876
357 HB3 TRP 50 HB3 TRP 50 -13.512 -2.762 2.152
358 HD1 TRP 50 HD1 TRP 50 -15.792 -2.835 0.854
359 HE1 TRP 50 HE1 TRP 50 -18.244 -2.409 1.522
360 HE3 TRP 50 HE3 TRP 50 -15.233 -2.682 5.936
361 HZ2 TRP 50 HZ2 TRP 50 -19.731 -2.048 3.886
362 HZ3 TRP 50 HZ3 TRP 50 -17.223 -2.291 7.328
363 HH2 TRP 50 HH2 TRP 50 -19.424 -1.980 6.324
364 H GLU 51 HN GLU 51 -12.643 -4.778 1.073
365 HA GLU 51 HA GLU 51 -15.009 -5.881 -0.106
366 HB2 GLU 51 HB2 GLU 51 -12.235 -5.350 -1.175
367 HB3 GLU 51 HB3 GLU 51 -13.512 -6.067 -2.153
368 HG2 GLU 51 HG2 GLU 51 -13.667 -3.408 -0.776
369 HG3 GLU 51 HG3 GLU 51 -13.220 -3.640 -2.463
370 H LEU 52 HN LEU 52 -11.737 -7.131 0.463
371 HA LEU 52 HA LEU 52 -12.747 -9.824 -0.123
372 HB2 LEU 52 HB2 LEU 52 -9.895 -8.921 0.201
373 HB3 LEU 52 HB3 LEU 52 -10.441 -10.470 -0.422
374 HG LEU 52 HG LEU 52 -10.766 -7.778 -1.748
375 HD11 LEU 52 HD11 LEU 52 -9.102 -10.191 -2.467
376 HD12 LEU 52 HD12 LEU 52 -9.267 -8.730 -3.442
377 HD13 LEU 52 HD13 LEU 52 -8.499 -8.650 -1.856
378 HD21 LEU 52 HD21 LEU 52 -11.633 -10.512 -2.691
379 HD22 LEU 52 HD22 LEU 52 -12.700 -9.199 -2.192
380 HD23 LEU 52 HD23 LEU 52 -11.702 -9.025 -3.635
381 H ARG 53 HN ARG 53 -10.837 -8.007 2.179
382 HA ARG 53 HA ARG 53 -10.311 -8.292 4.368
383 HB2 ARG 53 HB2 ARG 53 -12.796 -8.418 4.595
384 HB3 ARG 53 HB3 ARG 53 -12.682 -10.167 4.466
385 HG2 ARG 53 HG2 ARG 53 -11.298 -10.215 6.495
386 HG3 ARG 53 HG3 ARG 53 -11.466 -8.464 6.632
387 HD2 ARG 53 HD2 ARG 53 -13.910 -8.739 6.786
388 HD3 ARG 53 HD3 ARG 53 -13.700 -10.488 6.726
389 HE ARG 53 HE ARG 53 -12.270 -9.116 8.843
390 HH11 ARG 53 HH12 ARG 53 -15.156 -10.859 7.908
391 HH12 ARG 53 HH11 ARG 53 -15.572 -11.298 9.541
392 HH21 ARG 53 HH22 ARG 53 -12.809 -9.678 10.983
393 HH22 ARG 53 HH21 ARG 53 -14.259 -10.593 11.299