NMR Restraints Grid
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NMR Restraints Grid |
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Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
548989 |
2lr3   |
18345 | cing | 1-original | 4 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 H1 ARG 1 HT1 ARG 1 6.805 -2.823 2.026
2 H2 ARG 1 HT2 ARG 1 7.359 -1.226 2.041
3 H3 ARG 1 HT3 ARG 1 8.006 -2.337 0.943
4 HA ARG 1 HA ARG 1 5.213 -1.347 0.977
5 HB2 ARG 1 HB2 ARG 1 7.478 -0.862 -0.982
6 HB3 ARG 1 HB1 ARG 1 5.819 -0.321 -1.201
7 HG2 ARG 1 HG2 ARG 1 6.006 1.155 0.704
8 HG3 ARG 1 HG1 ARG 1 7.630 0.554 1.048
9 HD2 ARG 1 HD2 ARG 1 6.771 2.042 -1.440
10 HD3 ARG 1 HD1 ARG 1 7.718 2.705 -0.106
11 HE ARG 1 HE ARG 1 8.910 0.373 -1.268
12 HH11 ARG 1 HH11 ARG 1 8.624 3.859 -1.594
13 HH12 ARG 1 HH12 ARG 1 10.103 4.002 -2.494
14 HH21 ARG 1 HH21 ARG 1 10.835 0.585 -2.435
15 HH22 ARG 1 HH22 ARG 1 11.350 2.158 -2.971
16 H THR 2 HN THR 2 3.771 -2.538 -0.205
17 HA THR 2 HA THR 2 4.491 -5.014 -1.381
18 HB THR 2 HB THR 2 1.994 -3.377 -1.914
19 HG1 THR 2 HG1 THR 2 1.887 -5.543 -0.178
20 HG21 THR 2 HG21 THR 2 2.549 -6.339 -2.229
21 HG22 THR 2 HG22 THR 2 2.367 -5.177 -3.545
22 HG23 THR 2 HG23 THR 2 0.993 -5.548 -2.499
23 H CYS 3 HN CYS 3 5.651 -5.216 -3.139
24 HA CYS 3 HA CYS 3 5.564 -3.126 -5.217
25 HB2 CYS 3 HB2 CYS 3 7.646 -3.026 -4.045
26 HB3 CYS 3 HB1 CYS 3 7.833 -4.771 -4.088
27 H GLU 4 HN GLU 4 5.132 -3.792 -7.250
28 HA GLU 4 HA GLU 4 5.105 -6.697 -7.747
29 HB2 GLU 4 HB2 GLU 4 3.312 -6.335 -9.375
30 HB3 GLU 4 HB1 GLU 4 2.839 -5.788 -7.777
31 HG2 GLU 4 HG2 GLU 4 3.835 -3.937 -9.935
32 HG3 GLU 4 HG1 GLU 4 2.135 -4.323 -9.687
33 H SER 5 HN SER 5 5.754 -7.430 -9.763
34 HA SER 5 HA SER 5 7.180 -5.602 -11.535
35 HB2 SER 5 HB2 SER 5 9.193 -7.154 -11.432
36 HB3 SER 5 HB1 SER 5 8.920 -6.193 -9.981
37 HG SER 5 HG SER 5 7.788 -8.084 -9.144
38 H GLN 6 HN GLN 6 8.308 -7.271 -13.261
39 HA GLN 6 HA GLN 6 6.062 -8.939 -14.208
40 HB2 GLN 6 HB2 GLN 6 6.332 -6.984 -15.611
41 HB3 GLN 6 HB1 GLN 6 8.064 -7.251 -15.736
42 HG2 GLN 6 HG2 GLN 6 6.871 -7.865 -17.787
43 HG3 GLN 6 HG1 GLN 6 7.706 -9.239 -17.066
44 HE21 GLN 6 HE21 GLN 6 4.686 -7.954 -15.833
45 HE22 GLN 6 HE22 GLN 6 3.724 -9.320 -16.260
46 H SER 7 HN SER 7 6.540 -10.939 -15.165
47 HA SER 7 HA SER 7 9.301 -11.883 -14.702
48 HB2 SER 7 HB2 SER 7 7.595 -12.988 -13.276
49 HB3 SER 7 HB1 SER 7 6.743 -13.513 -14.727
50 HG SER 7 HG SER 7 8.475 -14.909 -13.567
51 H HIS 8 HN HIS 8 10.225 -11.563 -16.612
52 HA HIS 8 HA HIS 8 8.970 -12.518 -19.083
53 HB2 HIS 8 HB2 HIS 8 10.104 -10.245 -18.891
54 HB3 HIS 8 HB1 HIS 8 11.631 -11.098 -18.726
55 HD1 HIS 8 HD1 HIS 8 11.975 -9.457 -20.927
56 HD2 HIS 8 HD2 HIS 8 9.671 -12.881 -21.406
57 HE1 HIS 8 HE1 HIS 8 11.905 -9.880 -23.403
58 HE2 HIS 8 HE2 HIS 8 10.696 -12.073 -23.642
59 H LYS 9 HN LYS 9 10.547 -13.829 -16.635
60 HA LYS 9 HA LYS 9 12.560 -15.389 -18.008
61 HB2 LYS 9 HB2 LYS 9 12.718 -14.530 -15.608
62 HB3 LYS 9 HB1 LYS 9 11.514 -15.734 -15.181
63 HG2 LYS 9 HG2 LYS 9 14.107 -16.501 -16.502
64 HG3 LYS 9 HG1 LYS 9 13.976 -16.277 -14.756
65 HD2 LYS 9 HD2 LYS 9 12.090 -17.953 -14.789
66 HD3 LYS 9 HD1 LYS 9 12.507 -18.279 -16.473
67 HE2 LYS 9 HE2 LYS 9 13.529 -19.894 -14.907
68 HE3 LYS 9 HE1 LYS 9 14.730 -18.985 -15.824
69 HZ1 LYS 9 HZ1 LYS 9 15.183 -17.625 -13.960
70 HZ2 LYS 9 HZ2 LYS 9 15.207 -19.220 -13.404
71 HZ3 LYS 9 HZ3 LYS 9 13.866 -18.235 -13.090
72 H PHE 10 HN PHE 10 9.326 -15.776 -16.677
73 HA PHE 10 HA PHE 10 9.069 -18.555 -17.002
74 HB2 PHE 10 HB2 PHE 10 7.549 -17.059 -15.661
75 HB3 PHE 10 HB1 PHE 10 6.851 -16.497 -17.176
76 HD1 PHE 10 HD2 PHE 10 7.538 -19.652 -15.304
77 HD2 PHE 10 HD1 PHE 10 4.981 -17.585 -18.016
78 HE1 PHE 10 HE2 PHE 10 5.963 -21.543 -15.251
79 HE2 PHE 10 HE1 PHE 10 3.405 -19.472 -17.967
80 HZ PHE 10 HZ PHE 10 3.890 -21.454 -16.585
81 H LYS 11 HN LYS 11 8.228 -19.790 -18.684
82 HA LYS 11 HA LYS 11 8.889 -18.745 -21.289
83 HB2 LYS 11 HB2 LYS 11 8.040 -21.507 -20.386
84 HB3 LYS 11 HB1 LYS 11 8.536 -21.103 -22.024
85 HG2 LYS 11 HG2 LYS 11 10.754 -20.548 -21.276
86 HG3 LYS 11 HG1 LYS 11 10.281 -20.753 -19.592
87 HD2 LYS 11 HD2 LYS 11 11.540 -22.685 -20.377
88 HD3 LYS 11 HD1 LYS 11 9.883 -23.140 -19.986
89 HE2 LYS 11 HE2 LYS 11 10.657 -22.442 -22.803
90 HE3 LYS 11 HE1 LYS 11 10.973 -24.050 -22.157
91 HZ1 LYS 11 HZ1 LYS 11 8.886 -24.061 -23.286
92 HZ2 LYS 11 HZ2 LYS 11 8.320 -22.732 -22.411
93 HZ3 LYS 11 HZ3 LYS 11 8.578 -24.212 -21.632
94 H GLY 12 HN GLY 12 7.356 -17.481 -22.185
95 HA2 GLY 12 HA2 GLY 12 5.569 -17.290 -23.667
96 HA3 GLY 12 HA1 GLY 12 4.961 -18.839 -23.106
97 HA PRO 13 HA PRO 13 2.111 -15.813 -21.177
98 HB2 PRO 13 HB2 PRO 13 -0.156 -17.179 -21.614
99 HB3 PRO 13 HB1 PRO 13 0.618 -16.261 -22.913
100 HG2 PRO 13 HG2 PRO 13 0.727 -19.208 -22.357
101 HG3 PRO 13 HG1 PRO 13 0.508 -18.371 -23.906
102 HD2 PRO 13 HD2 PRO 13 2.918 -19.370 -23.040
103 HD3 PRO 13 HD1 PRO 13 2.764 -18.008 -24.167
104 H CYS 14 HN CYS 14 0.247 -16.413 -19.513
105 HA CYS 14 HA CYS 14 1.582 -17.843 -17.412
106 HB2 CYS 14 HB2 CYS 14 -1.288 -16.946 -17.275
107 HB3 CYS 14 HB1 CYS 14 -0.107 -17.067 -15.977
108 H ALA 15 HN ALA 15 1.705 -20.007 -18.208
109 HA ALA 15 HA ALA 15 -0.405 -21.633 -18.974
110 HB1 ALA 15 HB1 ALA 15 1.963 -22.403 -17.255
111 HB2 ALA 15 HB2 ALA 15 1.934 -22.362 -19.018
112 HB3 ALA 15 HB3 ALA 15 0.930 -23.521 -18.149
113 H SER 16 HN SER 16 0.829 -21.056 -15.697
114 HA SER 16 HA SER 16 -1.813 -21.028 -14.584
115 HB2 SER 16 HB2 SER 16 0.103 -23.225 -13.731
116 HB3 SER 16 HB1 SER 16 -1.438 -22.854 -12.957
117 HG SER 16 HG SER 16 -2.159 -23.168 -15.359
118 H ASP 17 HN ASP 17 -1.879 -19.882 -12.688
119 HA ASP 17 HA ASP 17 0.117 -18.064 -12.090
120 HB2 ASP 17 HB2 ASP 17 -2.098 -19.108 -10.300
121 HB3 ASP 17 HB1 ASP 17 -1.111 -17.699 -9.937
122 H HIS 18 HN HIS 18 -0.704 -21.068 -10.390
123 HA HIS 18 HA HIS 18 1.216 -20.891 -8.361
124 HB2 HIS 18 HB2 HIS 18 -0.772 -22.521 -8.587
125 HB3 HIS 18 HB1 HIS 18 0.322 -23.508 -9.565
126 HD1 HIS 18 HD1 HIS 18 -0.562 -22.701 -6.088
127 HD2 HIS 18 HD2 HIS 18 2.600 -24.522 -8.081
128 HE1 HIS 18 HE1 HIS 18 0.726 -23.936 -4.322
129 HE2 HIS 18 HE2 HIS 18 2.718 -24.894 -5.523
130 H ASN 19 HN ASN 19 1.453 -21.972 -11.677
131 HA ASN 19 HA ASN 19 3.941 -23.346 -11.361
132 HB2 ASN 19 HB2 ASN 19 2.499 -22.324 -13.819
133 HB3 ASN 19 HB1 ASN 19 4.019 -23.204 -13.895
134 HD21 ASN 19 HD21 ASN 19 1.440 -23.935 -11.602
135 HD22 ASN 19 HD22 ASN 19 1.011 -25.451 -12.299
136 H CYS 20 HN CYS 20 3.036 -20.193 -12.755
137 HA CYS 20 HA CYS 20 5.711 -19.360 -13.201
138 HB2 CYS 20 HB2 CYS 20 3.691 -18.317 -14.261
139 HB3 CYS 20 HB1 CYS 20 3.323 -17.565 -12.710
140 H ALA 21 HN ALA 21 3.551 -19.184 -10.455
141 HA ALA 21 HA ALA 21 5.058 -17.475 -8.802
142 HB1 ALA 21 HB1 ALA 21 2.718 -18.080 -8.331
143 HB2 ALA 21 HB2 ALA 21 3.766 -18.408 -6.951
144 HB3 ALA 21 HB3 ALA 21 3.220 -19.735 -7.978
145 H SER 22 HN SER 22 4.945 -21.029 -9.021
146 HA SER 22 HA SER 22 6.851 -21.617 -7.091
147 HB2 SER 22 HB2 SER 22 5.386 -23.307 -8.180
148 HB3 SER 22 HB1 SER 22 6.330 -23.144 -9.661
149 HG SER 22 HG SER 22 7.640 -23.760 -7.254
150 H VAL 23 HN VAL 23 7.285 -21.175 -10.593
151 HA VAL 23 HA VAL 23 10.048 -21.401 -10.755
152 HB VAL 23 HB VAL 23 8.047 -19.797 -12.355
153 HG11 VAL 23 HG11 VAL 23 9.814 -19.417 -14.052
154 HG12 VAL 23 HG12 VAL 23 11.012 -20.076 -12.938
155 HG13 VAL 23 HG13 VAL 23 10.166 -18.581 -12.540
156 HG21 VAL 23 HG21 VAL 23 9.641 -22.290 -12.974
157 HG22 VAL 23 HG22 VAL 23 8.504 -21.495 -14.066
158 HG23 VAL 23 HG23 VAL 23 7.926 -22.214 -12.562
159 H CYS 24 HN CYS 24 8.127 -18.435 -10.376
160 HA CYS 24 HA CYS 24 10.262 -16.644 -10.152
161 HB2 CYS 24 HB2 CYS 24 7.841 -16.084 -10.615
162 HB3 CYS 24 HB1 CYS 24 7.518 -16.324 -8.901
163 H GLN 25 HN GLN 25 8.839 -18.805 -7.832
164 HA GLN 25 HA GLN 25 10.091 -17.487 -5.555
165 HB2 GLN 25 HB2 GLN 25 8.341 -19.938 -5.789
166 HB3 GLN 25 HB1 GLN 25 9.065 -19.418 -4.273
167 HG2 GLN 25 HG2 GLN 25 7.847 -17.326 -4.366
168 HG3 GLN 25 HG1 GLN 25 7.188 -17.753 -5.945
169 HE21 GLN 25 HE21 GLN 25 5.080 -17.609 -5.214
170 HE22 GLN 25 HE22 GLN 25 4.370 -18.788 -4.172
171 H THR 26 HN THR 26 10.708 -20.158 -7.705
172 HA THR 26 HA THR 26 12.628 -21.407 -5.958
173 HB THR 26 HB THR 26 13.261 -22.737 -8.010
174 HG1 THR 26 HG1 THR 26 12.191 -20.875 -9.357
175 HG21 THR 26 HG21 THR 26 11.173 -24.032 -8.060
176 HG22 THR 26 HG22 THR 26 10.338 -22.708 -7.246
177 HG23 THR 26 HG23 THR 26 11.624 -23.585 -6.416
178 H GLU 27 HN GLU 27 12.658 -19.026 -8.537
179 HA GLU 27 HA GLU 27 15.573 -18.975 -8.562
180 HB2 GLU 27 HB2 GLU 27 15.349 -17.184 -10.223
181 HB3 GLU 27 HB1 GLU 27 14.422 -18.609 -10.667
182 HG2 GLU 27 HG2 GLU 27 12.367 -17.542 -9.974
183 HG3 GLU 27 HG1 GLU 27 13.265 -16.137 -9.392
184 H ARG 28 HN ARG 28 12.925 -16.918 -7.368
185 HA ARG 28 HA ARG 28 14.845 -15.480 -5.683
186 HB2 ARG 28 HB2 ARG 28 14.128 -13.301 -6.404
187 HB3 ARG 28 HB1 ARG 28 14.575 -14.205 -7.845
188 HG2 ARG 28 HG2 ARG 28 12.170 -14.699 -8.226
189 HG3 ARG 28 HG1 ARG 28 11.776 -13.670 -6.849
190 HD2 ARG 28 HD2 ARG 28 11.483 -12.256 -8.672
191 HD3 ARG 28 HD1 ARG 28 13.105 -11.847 -8.115
192 HE ARG 28 HE ARG 28 13.192 -13.876 -10.106
193 HH11 ARG 28 HH11 ARG 28 12.761 -10.425 -9.699
194 HH12 ARG 28 HH12 ARG 28 13.259 -10.039 -11.315
195 HH21 ARG 28 HH21 ARG 28 13.810 -13.386 -12.233
196 HH22 ARG 28 HH22 ARG 28 13.838 -11.730 -12.768
197 H PHE 29 HN PHE 29 13.433 -13.782 -4.316
198 HA PHE 29 HA PHE 29 11.118 -15.283 -3.291
199 HB2 PHE 29 HB2 PHE 29 12.747 -13.078 -1.993
200 HB3 PHE 29 HB1 PHE 29 11.363 -13.876 -1.254
201 HD1 PHE 29 HD2 PHE 29 11.513 -16.452 -1.009
202 HD2 PHE 29 HD1 PHE 29 14.886 -13.926 -1.636
203 HE1 PHE 29 HE2 PHE 29 12.991 -18.203 -0.105
204 HE2 PHE 29 HE1 PHE 29 16.368 -15.674 -0.740
205 HZ PHE 29 HZ PHE 29 15.423 -17.816 0.027
206 H SER 30 HN SER 30 9.550 -14.669 -4.698
207 HA SER 30 HA SER 30 8.260 -12.194 -4.217
208 HB2 SER 30 HB2 SER 30 8.316 -11.404 -6.606
209 HB3 SER 30 HB1 SER 30 9.869 -11.289 -5.779
210 HG SER 30 HG SER 30 9.164 -13.531 -7.359
211 H GLY 31 HN GLY 31 6.258 -12.823 -4.107
212 HA2 GLY 31 HA2 GLY 31 5.345 -15.343 -5.123
213 HA3 GLY 31 HA1 GLY 31 4.357 -14.123 -4.331
214 H GLY 32 HN GLY 32 4.368 -15.819 -7.047
215 HA2 GLY 32 HA2 GLY 32 3.927 -13.509 -8.841
216 HA3 GLY 32 HA1 GLY 32 4.573 -15.055 -9.362
217 H ARG 33 HN ARG 33 2.234 -13.425 -10.163
218 HA ARG 33 HA ARG 33 0.416 -15.643 -10.524
219 HB2 ARG 33 HB2 ARG 33 -0.419 -13.107 -9.105
220 HB3 ARG 33 HB1 ARG 33 -1.574 -14.080 -10.003
221 HG2 ARG 33 HG2 ARG 33 -0.739 -16.032 -8.519
222 HG3 ARG 33 HG1 ARG 33 -0.097 -14.752 -7.485
223 HD2 ARG 33 HD2 ARG 33 -2.325 -15.450 -6.758
224 HD3 ARG 33 HD1 ARG 33 -2.326 -13.771 -7.302
225 HE ARG 33 HE ARG 33 -3.010 -15.475 -9.455
226 HH11 ARG 33 HH11 ARG 33 -4.338 -14.238 -6.455
227 HH12 ARG 33 HH12 ARG 33 -5.982 -14.336 -7.002
228 HH21 ARG 33 HH21 ARG 33 -5.175 -15.623 -10.163
229 HH22 ARG 33 HH22 ARG 33 -6.458 -15.126 -9.104
230 H CYS 34 HN CYS 34 -1.559 -14.580 -11.925
231 HA CYS 34 HA CYS 34 -0.156 -13.101 -14.061
232 HB2 CYS 34 HB2 CYS 34 -0.794 -15.481 -14.567
233 HB3 CYS 34 HB1 CYS 34 -2.481 -15.009 -14.387
234 H ARG 35 HN ARG 35 -1.136 -11.384 -15.006
235 HA ARG 35 HA ARG 35 -3.104 -9.907 -13.667
236 HB2 ARG 35 HB2 ARG 35 -1.355 -9.352 -15.651
237 HB3 ARG 35 HB1 ARG 35 -2.812 -9.539 -16.609
238 HG2 ARG 35 HG2 ARG 35 -2.570 -7.656 -14.268
239 HG3 ARG 35 HG1 ARG 35 -2.272 -7.193 -15.942
240 HD2 ARG 35 HD2 ARG 35 -4.614 -7.906 -16.471
241 HD3 ARG 35 HD1 ARG 35 -4.872 -8.149 -14.741
242 HE ARG 35 HE ARG 35 -3.899 -5.582 -14.999
243 HH11 ARG 35 HH11 ARG 35 -6.711 -7.347 -16.129
244 HH12 ARG 35 HH12 ARG 35 -7.707 -5.931 -16.234
245 HH21 ARG 35 HH21 ARG 35 -5.199 -3.720 -15.160
246 HH22 ARG 35 HH22 ARG 35 -6.849 -3.864 -15.682
247 H GLY 36 HN GLY 36 -5.081 -10.647 -13.362
248 HA2 GLY 36 HA2 GLY 36 -7.187 -11.492 -13.772
249 HA3 GLY 36 HA1 GLY 36 -6.830 -11.397 -15.494
250 H PHE 37 HN PHE 37 -5.568 -13.106 -16.448
251 HA PHE 37 HA PHE 37 -4.681 -15.425 -15.214
252 HB2 PHE 37 HB2 PHE 37 -7.104 -15.774 -14.663
253 HB3 PHE 37 HB1 PHE 37 -7.464 -15.786 -16.385
254 HD1 PHE 37 HD1 PHE 37 -4.847 -17.436 -14.270
255 HD2 PHE 37 HD2 PHE 37 -8.009 -17.914 -17.089
256 HE1 PHE 37 HE1 PHE 37 -4.438 -19.863 -14.315
257 HE2 PHE 37 HE2 PHE 37 -7.602 -20.341 -17.136
258 HZ PHE 37 HZ PHE 37 -5.815 -21.320 -15.750
259 H ARG 38 HN ARG 38 -3.496 -16.556 -16.680
260 HA ARG 38 HA ARG 38 -2.667 -17.372 -18.635
261 HB2 ARG 38 HB2 ARG 38 -5.246 -16.300 -19.783
262 HB3 ARG 38 HB1 ARG 38 -4.044 -17.141 -20.748
263 HG2 ARG 38 HG2 ARG 38 -5.394 -18.333 -18.331
264 HG3 ARG 38 HG1 ARG 38 -5.947 -18.558 -19.992
265 HD2 ARG 38 HD2 ARG 38 -3.252 -19.367 -18.888
266 HD3 ARG 38 HD1 ARG 38 -4.592 -20.455 -19.245
267 HE ARG 38 HE ARG 38 -3.616 -18.837 -21.459
268 HH11 ARG 38 HH11 ARG 38 -3.554 -21.940 -19.833
269 HH12 ARG 38 HH12 ARG 38 -2.920 -22.790 -21.203
270 HH21 ARG 38 HH21 ARG 38 -2.780 -19.952 -23.260
271 HH22 ARG 38 HH22 ARG 38 -2.475 -21.658 -23.155
272 H ARG 39 HN ARG 39 -3.542 -14.033 -18.396
273 HA ARG 39 HA ARG 39 -2.630 -13.182 -20.927
274 HB2 ARG 39 HB2 ARG 39 -3.042 -11.549 -18.415
275 HB3 ARG 39 HB1 ARG 39 -2.874 -10.904 -20.046
276 HG2 ARG 39 HG2 ARG 39 -5.105 -12.659 -19.021
277 HG3 ARG 39 HG1 ARG 39 -5.205 -10.945 -19.430
278 HD2 ARG 39 HD2 ARG 39 -4.892 -11.387 -21.744
279 HD3 ARG 39 HD1 ARG 39 -4.413 -13.055 -21.434
280 HE ARG 39 HE ARG 39 -7.026 -12.633 -20.472
281 HH11 ARG 39 HH11 ARG 39 -5.287 -12.879 -23.497
282 HH12 ARG 39 HH12 ARG 39 -6.629 -13.540 -24.371
283 HH21 ARG 39 HH21 ARG 39 -8.798 -13.517 -21.614
284 HH22 ARG 39 HH22 ARG 39 -8.627 -13.904 -23.296
285 H ARG 40 HN ARG 40 -1.140 -12.364 -17.753
286 HA ARG 40 HA ARG 40 1.502 -12.765 -18.824
287 HB2 ARG 40 HB2 ARG 40 0.728 -10.537 -19.775
288 HB3 ARG 40 HB1 ARG 40 0.720 -9.922 -18.129
289 HG2 ARG 40 HG2 ARG 40 2.755 -9.339 -19.415
290 HG3 ARG 40 HG1 ARG 40 3.089 -10.239 -17.933
291 HD2 ARG 40 HD2 ARG 40 4.404 -10.972 -19.946
292 HD3 ARG 40 HD1 ARG 40 3.495 -12.249 -19.142
293 HE ARG 40 HE ARG 40 2.027 -11.071 -21.299
294 HH11 ARG 40 HH11 ARG 40 4.544 -13.393 -20.571
295 HH12 ARG 40 HH12 ARG 40 4.245 -14.354 -21.980
296 HH21 ARG 40 HH21 ARG 40 1.615 -12.346 -23.150
297 HH22 ARG 40 HH22 ARG 40 2.581 -13.758 -23.449
298 H CYS 41 HN CYS 41 3.065 -12.873 -17.204
299 HA CYS 41 HA CYS 41 1.889 -13.209 -14.557
300 HB2 CYS 41 HB2 CYS 41 3.069 -15.109 -15.584
301 HB3 CYS 41 HB1 CYS 41 4.550 -14.160 -15.631
302 H PHE 42 HN PHE 42 2.262 -11.916 -12.941
303 HA PHE 42 HA PHE 42 4.603 -10.127 -12.960
304 HB2 PHE 42 HB2 PHE 42 1.816 -9.670 -11.846
305 HB3 PHE 42 HB1 PHE 42 3.183 -8.611 -11.517
306 HD1 PHE 42 HD2 PHE 42 1.255 -10.061 -14.373
307 HD2 PHE 42 HD1 PHE 42 3.571 -6.797 -12.908
308 HE1 PHE 42 HE2 PHE 42 0.773 -8.799 -16.427
309 HE2 PHE 42 HE1 PHE 42 3.087 -5.531 -14.960
310 HZ PHE 42 HZ PHE 42 1.685 -6.529 -16.723
311 H CYS 43 HN CYS 43 5.744 -9.912 -11.021
312 HA CYS 43 HA CYS 43 5.090 -11.906 -8.941
313 HB2 CYS 43 HB2 CYS 43 7.781 -10.931 -9.929
314 HB3 CYS 43 HB1 CYS 43 7.586 -11.822 -8.424
315 H THR 44 HN THR 44 5.170 -11.290 -6.815
316 HA THR 44 HA THR 44 5.357 -8.399 -6.311
317 HB THR 44 HB THR 44 3.704 -8.794 -4.454
318 HG1 THR 44 HG1 THR 44 3.325 -11.312 -5.751
319 HG21 THR 44 HG21 THR 44 2.946 -7.865 -6.584
320 HG22 THR 44 HG22 THR 44 1.725 -8.949 -5.917
321 HG23 THR 44 HG23 THR 44 2.753 -9.491 -7.244
322 H THR 45 HN THR 45 6.448 -7.711 -4.576
323 HA THR 45 HA THR 45 7.638 -9.458 -2.629
324 HB THR 45 HB THR 45 9.119 -9.877 -4.569
325 HG1 THR 45 HG1 THR 45 10.414 -10.028 -2.889
326 HG21 THR 45 HG21 THR 45 9.689 -6.907 -4.477
327 HG22 THR 45 HG22 THR 45 8.803 -7.743 -5.752
328 HG23 THR 45 HG23 THR 45 10.512 -8.090 -5.493
329 H HIS 46 HN HIS 46 9.491 -7.981 -1.521
330 HA HIS 46 HA HIS 46 8.132 -5.438 -0.956
331 HB2 HIS 46 HB2 HIS 46 9.552 -5.456 1.148
332 HB3 HIS 46 HB1 HIS 46 8.314 -6.698 1.040
333 HD1 HIS 46 HD1 HIS 46 11.940 -6.220 1.450
334 HD2 HIS 46 HD2 HIS 46 9.352 -9.336 0.520
335 HE1 HIS 46 HE1 HIS 46 13.272 -8.323 1.774
336 HE2 HIS 46 HE2 HIS 46 11.731 -10.185 1.061
337 H CYS 47 HN CYS 47 8.913 -4.008 -2.385
338 HA CYS 47 HA CYS 47 11.797 -3.679 -2.729
339 HB2 CYS 47 HB2 CYS 47 9.470 -2.205 -4.005
340 HB3 CYS 47 HB1 CYS 47 11.165 -1.917 -4.375
Start of MODEL 2
1 H1 ARG 1 HT1 ARG 1 2.081 0.291 0.953
2 H2 ARG 1 HT2 ARG 1 2.607 -1.307 1.135
3 H3 ARG 1 HT3 ARG 1 1.216 -0.972 0.235
4 HA ARG 1 HA ARG 1 2.476 0.165 -1.427
5 HB2 ARG 1 HB2 ARG 1 4.218 1.017 0.145
6 HB3 ARG 1 HB1 ARG 1 4.894 -0.605 0.232
7 HG2 ARG 1 HG2 ARG 1 6.247 0.555 -1.295
8 HG3 ARG 1 HG1 ARG 1 5.201 -0.464 -2.286
9 HD2 ARG 1 HD2 ARG 1 5.354 1.749 -3.262
10 HD3 ARG 1 HD1 ARG 1 3.714 1.479 -2.665
11 HE ARG 1 HE ARG 1 5.307 2.742 -0.687
12 HH11 ARG 1 HH11 ARG 1 3.660 3.420 -3.706
13 HH12 ARG 1 HH12 ARG 1 3.419 5.099 -3.330
14 HH21 ARG 1 HH21 ARG 1 4.996 4.942 -0.201
15 HH22 ARG 1 HH22 ARG 1 4.183 5.963 -1.344
16 H THR 2 HN THR 2 2.154 -1.265 -3.031
17 HA THR 2 HA THR 2 3.031 -4.032 -2.719
18 HB THR 2 HB THR 2 1.572 -2.791 -5.069
19 HG1 THR 2 HG1 THR 2 0.208 -4.433 -3.277
20 HG21 THR 2 HG21 THR 2 0.957 -5.130 -5.566
21 HG22 THR 2 HG22 THR 2 1.936 -5.674 -4.200
22 HG23 THR 2 HG23 THR 2 2.709 -4.904 -5.586
23 H CYS 3 HN CYS 3 4.890 -4.718 -3.531
24 HA CYS 3 HA CYS 3 6.278 -3.082 -5.556
25 HB2 CYS 3 HB2 CYS 3 7.409 -3.172 -3.363
26 HB3 CYS 3 HB1 CYS 3 7.404 -4.927 -3.428
27 H GLU 4 HN GLU 4 5.706 -4.078 -7.472
28 HA GLU 4 HA GLU 4 6.000 -7.009 -7.539
29 HB2 GLU 4 HB2 GLU 4 4.259 -7.136 -9.222
30 HB3 GLU 4 HB1 GLU 4 3.659 -6.324 -7.785
31 HG2 GLU 4 HG2 GLU 4 3.944 -4.153 -8.916
32 HG3 GLU 4 HG1 GLU 4 4.479 -5.003 -10.366
33 H SER 5 HN SER 5 7.110 -7.950 -9.078
34 HA SER 5 HA SER 5 8.355 -6.327 -11.198
35 HB2 SER 5 HB2 SER 5 9.424 -8.913 -10.017
36 HB3 SER 5 HB1 SER 5 10.273 -7.782 -11.074
37 HG SER 5 HG SER 5 9.659 -6.283 -9.123
38 H GLN 6 HN GLN 6 9.226 -8.336 -12.843
39 HA GLN 6 HA GLN 6 6.748 -9.774 -13.582
40 HB2 GLN 6 HB2 GLN 6 7.447 -7.969 -15.164
41 HB3 GLN 6 HB1 GLN 6 8.977 -8.801 -15.400
42 HG2 GLN 6 HG2 GLN 6 7.811 -10.704 -16.379
43 HG3 GLN 6 HG1 GLN 6 6.260 -9.915 -16.090
44 HE21 GLN 6 HE21 GLN 6 7.492 -10.799 -18.603
45 HE22 GLN 6 HE22 GLN 6 7.560 -9.396 -19.609
46 H SER 7 HN SER 7 7.134 -11.869 -14.715
47 HA SER 7 HA SER 7 9.637 -13.146 -13.797
48 HB2 SER 7 HB2 SER 7 7.597 -14.126 -12.769
49 HB3 SER 7 HB1 SER 7 6.970 -14.477 -14.378
50 HG SER 7 HG SER 7 9.307 -15.555 -13.176
51 H HIS 8 HN HIS 8 10.812 -14.322 -15.208
52 HA HIS 8 HA HIS 8 9.933 -14.469 -18.003
53 HB2 HIS 8 HB2 HIS 8 12.197 -13.647 -18.731
54 HB3 HIS 8 HB1 HIS 8 11.191 -12.424 -17.959
55 HD1 HIS 8 HD1 HIS 8 14.501 -13.924 -17.793
56 HD2 HIS 8 HD2 HIS 8 11.961 -11.945 -15.168
57 HE1 HIS 8 HE1 HIS 8 15.949 -13.182 -15.880
58 HE2 HIS 8 HE2 HIS 8 14.361 -12.139 -14.232
59 H LYS 9 HN LYS 9 10.947 -16.101 -15.414
60 HA LYS 9 HA LYS 9 12.705 -17.950 -16.838
61 HB2 LYS 9 HB2 LYS 9 13.214 -17.287 -14.482
62 HB3 LYS 9 HB1 LYS 9 11.718 -18.057 -13.977
63 HG2 LYS 9 HG2 LYS 9 13.568 -19.526 -13.530
64 HG3 LYS 9 HG1 LYS 9 12.572 -20.216 -14.814
65 HD2 LYS 9 HD2 LYS 9 14.161 -19.350 -16.488
66 HD3 LYS 9 HD1 LYS 9 15.167 -18.706 -15.190
67 HE2 LYS 9 HE2 LYS 9 16.059 -20.821 -15.975
68 HE3 LYS 9 HE1 LYS 9 15.483 -20.981 -14.316
69 HZ1 LYS 9 HZ1 LYS 9 14.805 -22.866 -15.621
70 HZ2 LYS 9 HZ2 LYS 9 14.055 -21.870 -16.763
71 HZ3 LYS 9 HZ3 LYS 9 13.436 -21.970 -15.194
72 H PHE 10 HN PHE 10 9.441 -17.666 -15.550
73 HA PHE 10 HA PHE 10 8.698 -20.377 -15.757
74 HB2 PHE 10 HB2 PHE 10 7.398 -18.761 -14.454
75 HB3 PHE 10 HB1 PHE 10 6.978 -17.884 -15.925
76 HD1 PHE 10 HD2 PHE 10 6.885 -21.424 -14.739
77 HD2 PHE 10 HD1 PHE 10 4.818 -18.238 -16.665
78 HE1 PHE 10 HE2 PHE 10 4.915 -22.870 -15.011
79 HE2 PHE 10 HE1 PHE 10 2.845 -19.684 -16.944
80 HZ PHE 10 HZ PHE 10 2.892 -22.003 -16.116
81 H LYS 11 HN LYS 11 7.878 -21.571 -17.382
82 HA LYS 11 HA LYS 11 8.202 -20.545 -20.084
83 HB2 LYS 11 HB2 LYS 11 7.584 -23.330 -19.054
84 HB3 LYS 11 HB1 LYS 11 7.831 -22.924 -20.747
85 HG2 LYS 11 HG2 LYS 11 9.890 -22.590 -18.565
86 HG3 LYS 11 HG1 LYS 11 9.822 -23.935 -19.704
87 HD2 LYS 11 HD2 LYS 11 10.235 -21.020 -20.405
88 HD3 LYS 11 HD1 LYS 11 11.473 -22.277 -20.408
89 HE2 LYS 11 HE2 LYS 11 10.169 -23.481 -22.151
90 HE3 LYS 11 HE1 LYS 11 9.040 -22.125 -22.191
91 HZ1 LYS 11 HZ1 LYS 11 10.934 -20.691 -22.802
92 HZ2 LYS 11 HZ2 LYS 11 10.621 -21.887 -23.948
93 HZ3 LYS 11 HZ3 LYS 11 11.923 -22.060 -22.889
94 H GLY 12 HN GLY 12 6.556 -19.811 -21.255
95 HA2 GLY 12 HA2 GLY 12 4.454 -19.984 -22.290
96 HA3 GLY 12 HA1 GLY 12 3.902 -21.006 -20.972
97 HA PRO 13 HA PRO 13 2.983 -16.323 -20.267
98 HB2 PRO 13 HB2 PRO 13 0.813 -15.797 -21.816
99 HB3 PRO 13 HB1 PRO 13 2.469 -15.539 -22.377
100 HG2 PRO 13 HG2 PRO 13 0.622 -17.837 -22.920
101 HG3 PRO 13 HG1 PRO 13 1.698 -16.982 -24.043
102 HD2 PRO 13 HD2 PRO 13 2.331 -19.381 -22.916
103 HD3 PRO 13 HD1 PRO 13 3.553 -18.176 -23.365
104 H CYS 14 HN CYS 14 2.471 -17.503 -18.323
105 HA CYS 14 HA CYS 14 1.087 -17.925 -16.571
106 HB2 CYS 14 HB2 CYS 14 -1.113 -16.820 -18.340
107 HB3 CYS 14 HB1 CYS 14 -1.168 -16.996 -16.587
108 H ALA 15 HN ALA 15 1.647 -19.958 -18.489
109 HA ALA 15 HA ALA 15 -0.463 -21.506 -19.366
110 HB1 ALA 15 HB1 ALA 15 1.889 -21.968 -19.895
111 HB2 ALA 15 HB2 ALA 15 1.064 -23.408 -19.306
112 HB3 ALA 15 HB3 ALA 15 2.154 -22.519 -18.242
113 H SER 16 HN SER 16 1.063 -21.529 -16.168
114 HA SER 16 HA SER 16 -1.457 -22.390 -15.002
115 HB2 SER 16 HB2 SER 16 1.145 -23.873 -14.480
116 HB3 SER 16 HB1 SER 16 -0.375 -24.148 -13.630
117 HG SER 16 HG SER 16 -0.791 -24.289 -16.282
118 H ASP 17 HN ASP 17 -1.851 -21.192 -13.208
119 HA ASP 17 HA ASP 17 -0.144 -19.022 -12.660
120 HB2 ASP 17 HB2 ASP 17 -1.740 -18.425 -10.911
121 HB3 ASP 17 HB1 ASP 17 -2.562 -18.826 -12.411
122 H HIS 18 HN HIS 18 -0.816 -21.993 -10.814
123 HA HIS 18 HA HIS 18 0.669 -21.255 -8.535
124 HB2 HIS 18 HB2 HIS 18 -0.941 -23.209 -8.669
125 HB3 HIS 18 HB1 HIS 18 0.305 -24.082 -9.567
126 HD1 HIS 18 HD1 HIS 18 2.021 -25.303 -8.212
127 HD2 HIS 18 HD2 HIS 18 -0.121 -22.559 -5.938
128 HE1 HIS 18 HE1 HIS 18 2.749 -25.676 -5.839
129 HE2 HIS 18 HE2 HIS 18 1.334 -24.111 -4.472
130 H ASN 19 HN ASN 19 1.484 -23.227 -11.348
131 HA ASN 19 HA ASN 19 4.145 -23.773 -10.792
132 HB2 ASN 19 HB2 ASN 19 2.783 -23.319 -13.463
133 HB3 ASN 19 HB1 ASN 19 4.409 -23.973 -13.294
134 HD21 ASN 19 HD21 ASN 19 3.804 -25.910 -14.301
135 HD22 ASN 19 HD22 ASN 19 2.836 -27.091 -13.493
136 H CYS 20 HN CYS 20 2.711 -21.062 -12.527
137 HA CYS 20 HA CYS 20 4.957 -19.594 -13.182
138 HB2 CYS 20 HB2 CYS 20 2.880 -18.857 -14.046
139 HB3 CYS 20 HB1 CYS 20 2.141 -18.797 -12.449
140 H ALA 21 HN ALA 21 3.042 -19.502 -10.199
141 HA ALA 21 HA ALA 21 4.494 -17.516 -8.866
142 HB1 ALA 21 HB1 ALA 21 2.937 -19.828 -7.701
143 HB2 ALA 21 HB2 ALA 21 2.290 -18.243 -8.126
144 HB3 ALA 21 HB3 ALA 21 3.462 -18.395 -6.816
145 H SER 22 HN SER 22 4.826 -21.051 -8.799
146 HA SER 22 HA SER 22 6.811 -21.191 -6.829
147 HB2 SER 22 HB2 SER 22 5.442 -23.119 -7.667
148 HB3 SER 22 HB1 SER 22 6.411 -23.116 -9.139
149 HG SER 22 HG SER 22 7.248 -23.649 -6.485
150 H VAL 23 HN VAL 23 7.131 -21.252 -10.378
151 HA VAL 23 HA VAL 23 9.942 -21.396 -10.431
152 HB VAL 23 HB VAL 23 8.055 -20.313 -12.539
153 HG11 VAL 23 HG11 VAL 23 10.922 -21.242 -12.787
154 HG12 VAL 23 HG12 VAL 23 10.354 -19.579 -12.941
155 HG13 VAL 23 HG13 VAL 23 9.869 -20.791 -14.130
156 HG21 VAL 23 HG21 VAL 23 7.526 -22.610 -11.923
157 HG22 VAL 23 HG22 VAL 23 9.212 -23.082 -12.147
158 HG23 VAL 23 HG23 VAL 23 8.250 -22.564 -13.531
159 H CYS 24 HN CYS 24 7.714 -18.645 -10.467
160 HA CYS 24 HA CYS 24 9.675 -16.660 -10.920
161 HB2 CYS 24 HB2 CYS 24 7.248 -16.261 -11.219
162 HB3 CYS 24 HB1 CYS 24 7.029 -16.362 -9.476
163 H GLN 25 HN GLN 25 8.392 -18.140 -7.975
164 HA GLN 25 HA GLN 25 9.799 -16.431 -6.182
165 HB2 GLN 25 HB2 GLN 25 8.556 -19.157 -5.792
166 HB3 GLN 25 HB1 GLN 25 9.283 -18.229 -4.486
167 HG2 GLN 25 HG2 GLN 25 7.653 -16.481 -4.741
168 HG3 GLN 25 HG1 GLN 25 6.995 -17.247 -6.187
169 HE21 GLN 25 HE21 GLN 25 5.785 -19.146 -5.967
170 HE22 GLN 25 HE22 GLN 25 5.056 -19.594 -4.465
171 H THR 26 HN THR 26 10.584 -19.428 -7.840
172 HA THR 26 HA THR 26 12.933 -19.940 -6.299
173 HB THR 26 HB THR 26 13.550 -21.509 -8.170
174 HG1 THR 26 HG1 THR 26 12.373 -20.356 -9.841
175 HG21 THR 26 HG21 THR 26 10.766 -21.788 -7.029
176 HG22 THR 26 HG22 THR 26 12.265 -22.268 -6.233
177 HG23 THR 26 HG23 THR 26 11.738 -23.098 -7.698
178 H GLU 27 HN GLU 27 12.273 -18.164 -9.319
179 HA GLU 27 HA GLU 27 15.063 -17.612 -9.734
180 HB2 GLU 27 HB2 GLU 27 14.433 -16.102 -11.495
181 HB3 GLU 27 HB1 GLU 27 13.457 -17.553 -11.628
182 HG2 GLU 27 HG2 GLU 27 11.520 -16.436 -10.854
183 HG3 GLU 27 HG1 GLU 27 12.452 -15.044 -10.307
184 H ARG 28 HN ARG 28 12.348 -15.668 -8.452
185 HA ARG 28 HA ARG 28 14.277 -14.146 -6.842
186 HB2 ARG 28 HB2 ARG 28 12.056 -12.855 -8.463
187 HB3 ARG 28 HB1 ARG 28 13.142 -12.023 -7.361
188 HG2 ARG 28 HG2 ARG 28 13.939 -13.399 -9.923
189 HG3 ARG 28 HG1 ARG 28 13.755 -11.662 -9.691
190 HD2 ARG 28 HD2 ARG 28 15.740 -13.418 -8.239
191 HD3 ARG 28 HD1 ARG 28 16.110 -12.387 -9.620
192 HE ARG 28 HE ARG 28 14.948 -10.794 -7.633
193 HH11 ARG 28 HH11 ARG 28 17.874 -12.649 -8.189
194 HH12 ARG 28 HH12 ARG 28 18.850 -11.662 -7.145
195 HH21 ARG 28 HH21 ARG 28 16.230 -9.485 -6.270
196 HH22 ARG 28 HH22 ARG 28 17.917 -9.854 -6.066
197 H PHE 29 HN PHE 29 13.526 -13.704 -4.791
198 HA PHE 29 HA PHE 29 11.180 -14.980 -3.845
199 HB2 PHE 29 HB2 PHE 29 12.920 -12.849 -2.581
200 HB3 PHE 29 HB1 PHE 29 11.590 -13.642 -1.743
201 HD1 PHE 29 HD2 PHE 29 11.669 -16.216 -1.608
202 HD2 PHE 29 HD1 PHE 29 15.056 -13.796 -2.513
203 HE1 PHE 29 HE2 PHE 29 13.158 -18.055 -0.940
204 HE2 PHE 29 HE1 PHE 29 16.549 -15.634 -1.849
205 HZ PHE 29 HZ PHE 29 15.603 -17.768 -1.060
206 H SER 30 HN SER 30 9.445 -14.394 -4.953
207 HA SER 30 HA SER 30 8.036 -12.074 -4.194
208 HB2 SER 30 HB2 SER 30 7.816 -11.183 -6.581
209 HB3 SER 30 HB1 SER 30 9.358 -10.874 -5.786
210 HG SER 30 HG SER 30 9.540 -13.215 -7.026
211 H GLY 31 HN GLY 31 6.094 -12.844 -3.996
212 HA2 GLY 31 HA2 GLY 31 5.218 -15.356 -4.946
213 HA3 GLY 31 HA1 GLY 31 4.173 -14.106 -4.283
214 H GLY 32 HN GLY 32 3.862 -15.951 -6.715
215 HA2 GLY 32 HA2 GLY 32 4.036 -13.900 -8.841
216 HA3 GLY 32 HA1 GLY 32 4.322 -15.611 -9.098
217 H ARG 33 HN ARG 33 2.302 -13.303 -9.851
218 HA ARG 33 HA ARG 33 0.034 -15.155 -10.139
219 HB2 ARG 33 HB2 ARG 33 -0.146 -12.222 -9.367
220 HB3 ARG 33 HB1 ARG 33 -1.520 -13.217 -9.827
221 HG2 ARG 33 HG2 ARG 33 0.251 -13.691 -7.431
222 HG3 ARG 33 HG1 ARG 33 -1.340 -12.929 -7.397
223 HD2 ARG 33 HD2 ARG 33 -0.760 -15.753 -8.311
224 HD3 ARG 33 HD1 ARG 33 -1.431 -15.304 -6.744
225 HE ARG 33 HE ARG 33 -3.210 -14.200 -8.394
226 HH11 ARG 33 HH11 ARG 33 -1.762 -17.389 -8.449
227 HH12 ARG 33 HH12 ARG 33 -3.160 -18.152 -9.135
228 HH21 ARG 33 HH21 ARG 33 -5.047 -15.201 -9.302
229 HH22 ARG 33 HH22 ARG 33 -5.031 -16.907 -9.627
230 H CYS 34 HN CYS 34 -1.499 -14.181 -11.888
231 HA CYS 34 HA CYS 34 0.177 -13.012 -14.019
232 HB2 CYS 34 HB2 CYS 34 -0.523 -15.319 -14.520
233 HB3 CYS 34 HB1 CYS 34 -2.208 -14.868 -14.285
234 H ARG 35 HN ARG 35 -0.522 -11.182 -15.000
235 HA ARG 35 HA ARG 35 -2.933 -9.884 -14.053
236 HB2 ARG 35 HB2 ARG 35 -0.713 -9.163 -15.917
237 HB3 ARG 35 HB1 ARG 35 -2.257 -8.369 -16.176
238 HG2 ARG 35 HG2 ARG 35 -0.868 -6.962 -14.827
239 HG3 ARG 35 HG1 ARG 35 -2.204 -7.554 -13.845
240 HD2 ARG 35 HD2 ARG 35 0.428 -8.988 -13.823
241 HD3 ARG 35 HD1 ARG 35 0.224 -7.515 -12.880
242 HE ARG 35 HE ARG 35 -1.566 -9.834 -12.520
243 HH11 ARG 35 HH11 ARG 35 0.653 -7.437 -11.213
244 HH12 ARG 35 HH12 ARG 35 0.321 -7.858 -9.564
245 HH21 ARG 35 HH21 ARG 35 -1.989 -10.387 -10.336
246 HH22 ARG 35 HH22 ARG 35 -1.162 -9.539 -9.070
247 H GLY 36 HN GLY 36 -4.910 -9.972 -14.988
248 HA2 GLY 36 HA2 GLY 36 -5.600 -12.130 -16.571
249 HA3 GLY 36 HA1 GLY 36 -6.616 -10.734 -16.314
250 H PHE 37 HN PHE 37 -6.022 -8.811 -17.704
251 HA PHE 37 HA PHE 37 -6.345 -9.694 -20.402
252 HB2 PHE 37 HB2 PHE 37 -6.014 -6.883 -19.322
253 HB3 PHE 37 HB1 PHE 37 -6.578 -7.302 -20.937
254 HD1 PHE 37 HD2 PHE 37 -7.429 -7.305 -17.350
255 HD2 PHE 37 HD1 PHE 37 -8.828 -8.061 -21.308
256 HE1 PHE 37 HE2 PHE 37 -9.739 -7.414 -16.514
257 HE2 PHE 37 HE1 PHE 37 -11.138 -8.171 -20.470
258 HZ PHE 37 HZ PHE 37 -11.596 -7.851 -18.070
259 H ARG 38 HN ARG 38 -3.713 -8.399 -18.525
260 HA ARG 38 HA ARG 38 -1.946 -7.819 -20.680
261 HB2 ARG 38 HB2 ARG 38 -1.692 -6.894 -18.391
262 HB3 ARG 38 HB1 ARG 38 -1.338 -8.503 -17.794
263 HG2 ARG 38 HG2 ARG 38 0.733 -7.416 -17.974
264 HG3 ARG 38 HG1 ARG 38 0.654 -8.516 -19.352
265 HD2 ARG 38 HD2 ARG 38 0.141 -6.718 -20.846
266 HD3 ARG 38 HD1 ARG 38 -0.079 -5.591 -19.505
267 HE ARG 38 HE ARG 38 2.527 -6.800 -20.206
268 HH11 ARG 38 HH11 ARG 38 0.597 -4.048 -19.218
269 HH12 ARG 38 HH12 ARG 38 1.968 -3.004 -19.022
270 HH21 ARG 38 HH21 ARG 38 4.340 -5.408 -19.916
271 HH22 ARG 38 HH22 ARG 38 4.073 -3.769 -19.405
272 H ARG 39 HN ARG 39 -2.843 -10.671 -18.927
273 HA ARG 39 HA ARG 39 -2.179 -12.834 -18.931
274 HB2 ARG 39 HB2 ARG 39 -3.285 -12.637 -21.128
275 HB3 ARG 39 HB1 ARG 39 -1.741 -12.238 -21.871
276 HG2 ARG 39 HG2 ARG 39 -0.879 -14.428 -21.406
277 HG3 ARG 39 HG1 ARG 39 -2.300 -14.836 -20.443
278 HD2 ARG 39 HD2 ARG 39 -2.299 -14.236 -23.404
279 HD3 ARG 39 HD1 ARG 39 -2.385 -15.844 -22.683
280 HE ARG 39 HE ARG 39 -4.476 -13.773 -22.549
281 HH11 ARG 39 HH11 ARG 39 -3.473 -17.108 -22.135
282 HH12 ARG 39 HH12 ARG 39 -5.087 -17.695 -21.894
283 HH21 ARG 39 HH21 ARG 39 -6.586 -14.539 -22.237
284 HH22 ARG 39 HH22 ARG 39 -6.864 -16.225 -21.937
285 H ARG 40 HN ARG 40 -0.284 -11.837 -17.684
286 HA ARG 40 HA ARG 40 2.075 -13.212 -18.573
287 HB2 ARG 40 HB2 ARG 40 2.313 -11.006 -19.724
288 HB3 ARG 40 HB1 ARG 40 2.257 -10.214 -18.155
289 HG2 ARG 40 HG2 ARG 40 4.547 -10.377 -18.845
290 HG3 ARG 40 HG1 ARG 40 4.293 -11.481 -17.492
291 HD2 ARG 40 HD2 ARG 40 3.922 -13.296 -19.257
292 HD3 ARG 40 HD1 ARG 40 4.578 -12.144 -20.419
293 HE ARG 40 HE ARG 40 6.132 -12.927 -18.039
294 HH11 ARG 40 HH11 ARG 40 5.830 -12.726 -21.533
295 HH12 ARG 40 HH12 ARG 40 7.458 -13.255 -21.820
296 HH21 ARG 40 HH21 ARG 40 8.248 -13.659 -18.434
297 HH22 ARG 40 HH22 ARG 40 8.824 -13.800 -20.067
298 H CYS 41 HN CYS 41 3.498 -13.628 -16.921
299 HA CYS 41 HA CYS 41 2.433 -13.583 -14.284
300 HB2 CYS 41 HB2 CYS 41 5.015 -14.560 -15.485
301 HB3 CYS 41 HB1 CYS 41 4.767 -14.564 -13.745
302 H PHE 42 HN PHE 42 2.426 -11.831 -13.086
303 HA PHE 42 HA PHE 42 4.939 -10.326 -12.759
304 HB2 PHE 42 HB2 PHE 42 2.077 -9.357 -12.554
305 HB3 PHE 42 HB1 PHE 42 3.429 -8.465 -11.864
306 HD1 PHE 42 HD2 PHE 42 1.949 -9.688 -15.030
307 HD2 PHE 42 HD1 PHE 42 4.867 -7.160 -13.221
308 HE1 PHE 42 HE2 PHE 42 2.349 -8.598 -17.199
309 HE2 PHE 42 HE1 PHE 42 5.268 -6.071 -15.390
310 HZ PHE 42 HZ PHE 42 4.009 -6.787 -17.383
311 H CYS 43 HN CYS 43 5.647 -10.057 -10.668
312 HA CYS 43 HA CYS 43 4.271 -11.737 -8.675
313 HB2 CYS 43 HB2 CYS 43 7.252 -11.536 -9.180
314 HB3 CYS 43 HB1 CYS 43 6.474 -12.541 -7.958
315 H THR 44 HN THR 44 4.566 -11.154 -6.472
316 HA THR 44 HA THR 44 5.262 -8.323 -6.105
317 HB THR 44 HB THR 44 3.602 -8.370 -4.216
318 HG1 THR 44 HG1 THR 44 2.860 -10.872 -5.380
319 HG21 THR 44 HG21 THR 44 2.519 -9.072 -6.951
320 HG22 THR 44 HG22 THR 44 2.969 -7.458 -6.396
321 HG23 THR 44 HG23 THR 44 1.605 -8.298 -5.658
322 H THR 45 HN THR 45 6.366 -7.731 -4.279
323 HA THR 45 HA THR 45 7.410 -9.808 -2.514
324 HB THR 45 HB THR 45 9.021 -9.682 -4.405
325 HG1 THR 45 HG1 THR 45 10.527 -10.017 -2.966
326 HG21 THR 45 HG21 THR 45 8.664 -7.311 -5.005
327 HG22 THR 45 HG22 THR 45 10.371 -7.682 -4.752
328 HG23 THR 45 HG23 THR 45 9.463 -6.827 -3.506
329 H HIS 46 HN HIS 46 9.154 -8.483 -1.044
330 HA HIS 46 HA HIS 46 7.416 -6.473 0.210
331 HB2 HIS 46 HB2 HIS 46 9.732 -7.925 1.506
332 HB3 HIS 46 HB1 HIS 46 8.405 -7.079 2.297
333 HD1 HIS 46 HD1 HIS 46 6.057 -8.302 2.282
334 HD2 HIS 46 HD2 HIS 46 9.235 -10.558 0.830
335 HE1 HIS 46 HE1 HIS 46 5.220 -10.673 2.185
336 HE2 HIS 46 HE2 HIS 46 7.193 -12.034 1.410
337 H CYS 47 HN CYS 47 7.992 -4.549 -0.666
338 HA CYS 47 HA CYS 47 10.803 -3.706 -0.344
339 HB2 CYS 47 HB2 CYS 47 8.754 -2.694 -2.338
340 HB3 CYS 47 HB1 CYS 47 10.388 -2.061 -2.150
Start of MODEL 3
1 H1 ARG 1 HT1 ARG 1 8.746 -1.258 2.436
2 H2 ARG 1 HT2 ARG 1 9.367 -2.177 1.160
3 H3 ARG 1 HT3 ARG 1 8.513 -2.933 2.405
4 HA ARG 1 HA ARG 1 6.491 -1.879 1.785
5 HB2 ARG 1 HB2 ARG 1 8.177 -0.549 -0.354
6 HB3 ARG 1 HB1 ARG 1 6.421 -0.527 -0.325
7 HG2 ARG 1 HG2 ARG 1 6.542 0.633 1.884
8 HG3 ARG 1 HG1 ARG 1 8.293 0.742 1.667
9 HD2 ARG 1 HD2 ARG 1 7.138 2.806 0.971
10 HD3 ARG 1 HD1 ARG 1 7.982 2.033 -0.374
11 HE ARG 1 HE ARG 1 5.188 1.319 -0.093
12 HH11 ARG 1 HH11 ARG 1 7.476 3.506 -1.608
13 HH12 ARG 1 HH12 ARG 1 6.404 3.908 -2.916
14 HH21 ARG 1 HH21 ARG 1 3.803 1.836 -1.824
15 HH22 ARG 1 HH22 ARG 1 4.317 2.974 -3.030
16 H THR 2 HN THR 2 5.098 -2.811 0.189
17 HA THR 2 HA THR 2 6.097 -5.164 -1.086
18 HB THR 2 HB THR 2 3.408 -3.797 -1.412
19 HG1 THR 2 HG1 THR 2 3.022 -4.623 0.490
20 HG21 THR 2 HG21 THR 2 2.630 -5.997 -2.203
21 HG22 THR 2 HG22 THR 2 4.282 -6.609 -2.115
22 HG23 THR 2 HG23 THR 2 3.876 -5.332 -3.263
23 H CYS 3 HN CYS 3 6.995 -5.312 -3.011
24 HA CYS 3 HA CYS 3 6.705 -3.085 -4.919
25 HB2 CYS 3 HB2 CYS 3 9.045 -4.985 -4.544
26 HB3 CYS 3 HB1 CYS 3 8.947 -3.708 -5.757
27 H GLU 4 HN GLU 4 6.492 -3.623 -7.119
28 HA GLU 4 HA GLU 4 5.662 -6.405 -7.608
29 HB2 GLU 4 HB2 GLU 4 4.144 -5.552 -9.351
30 HB3 GLU 4 HB1 GLU 4 3.745 -4.914 -7.764
31 HG2 GLU 4 HG2 GLU 4 5.365 -3.383 -9.790
32 HG3 GLU 4 HG1 GLU 4 3.608 -3.296 -9.693
33 H SER 5 HN SER 5 6.154 -7.316 -9.610
34 HA SER 5 HA SER 5 7.994 -5.979 -11.405
35 HB2 SER 5 HB2 SER 5 8.843 -8.477 -9.887
36 HB3 SER 5 HB1 SER 5 9.773 -7.650 -11.136
37 HG SER 5 HG SER 5 9.300 -5.775 -9.464
38 H GLN 6 HN GLN 6 8.852 -8.112 -12.867
39 HA GLN 6 HA GLN 6 6.460 -9.715 -13.480
40 HB2 GLN 6 HB2 GLN 6 6.608 -7.718 -15.003
41 HB3 GLN 6 HB1 GLN 6 8.164 -8.317 -15.561
42 HG2 GLN 6 HG2 GLN 6 7.033 -10.386 -16.337
43 HG3 GLN 6 HG1 GLN 6 5.490 -9.666 -15.880
44 HE21 GLN 6 HE21 GLN 6 4.685 -9.662 -17.941
45 HE22 GLN 6 HE22 GLN 6 5.276 -8.627 -19.191
46 H SER 7 HN SER 7 6.954 -11.666 -14.688
47 HA SER 7 HA SER 7 9.748 -12.535 -14.331
48 HB2 SER 7 HB2 SER 7 8.163 -13.747 -12.874
49 HB3 SER 7 HB1 SER 7 7.231 -14.232 -14.290
50 HG SER 7 HG SER 7 9.676 -15.174 -13.344
51 H HIS 8 HN HIS 8 10.803 -12.780 -16.111
52 HA HIS 8 HA HIS 8 9.397 -13.464 -18.618
53 HB2 HIS 8 HB2 HIS 8 11.501 -12.529 -19.713
54 HB3 HIS 8 HB1 HIS 8 10.466 -11.356 -18.907
55 HD1 HIS 8 HD1 HIS 8 13.793 -13.102 -18.515
56 HD2 HIS 8 HD2 HIS 8 11.612 -10.017 -16.781
57 HE1 HIS 8 HE1 HIS 8 15.380 -11.943 -16.955
58 HE2 HIS 8 HE2 HIS 8 13.975 -10.226 -15.768
59 H LYS 9 HN LYS 9 11.193 -14.717 -16.189
60 HA LYS 9 HA LYS 9 12.956 -16.454 -17.651
61 HB2 LYS 9 HB2 LYS 9 13.443 -15.701 -15.358
62 HB3 LYS 9 HB1 LYS 9 11.998 -16.516 -14.776
63 HG2 LYS 9 HG2 LYS 9 12.941 -18.670 -15.307
64 HG3 LYS 9 HG1 LYS 9 14.354 -17.908 -16.042
65 HD2 LYS 9 HD2 LYS 9 15.074 -17.042 -13.921
66 HD3 LYS 9 HD1 LYS 9 13.569 -17.539 -13.148
67 HE2 LYS 9 HE2 LYS 9 15.624 -19.412 -14.335
68 HE3 LYS 9 HE1 LYS 9 15.442 -19.053 -12.618
69 HZ1 LYS 9 HZ1 LYS 9 14.339 -21.115 -13.215
70 HZ2 LYS 9 HZ2 LYS 9 13.377 -20.303 -14.343
71 HZ3 LYS 9 HZ3 LYS 9 13.213 -19.964 -12.697
72 H PHE 10 HN PHE 10 9.691 -16.509 -16.525
73 HA PHE 10 HA PHE 10 9.235 -19.305 -16.658
74 HB2 PHE 10 HB2 PHE 10 7.799 -17.706 -15.395
75 HB3 PHE 10 HB1 PHE 10 7.242 -17.031 -16.923
76 HD1 PHE 10 HD2 PHE 10 7.447 -20.276 -15.101
77 HD2 PHE 10 HD1 PHE 10 5.298 -17.878 -17.887
78 HE1 PHE 10 HE2 PHE 10 5.663 -21.975 -15.182
79 HE2 PHE 10 HE1 PHE 10 3.516 -19.572 -17.970
80 HZ PHE 10 HZ PHE 10 3.697 -21.621 -16.617
81 H LYS 11 HN LYS 11 7.776 -20.348 -18.249
82 HA LYS 11 HA LYS 11 8.642 -19.637 -20.948
83 HB2 LYS 11 HB2 LYS 11 7.291 -22.154 -19.935
84 HB3 LYS 11 HB1 LYS 11 7.944 -21.913 -21.550
85 HG2 LYS 11 HG2 LYS 11 9.523 -21.983 -18.979
86 HG3 LYS 11 HG1 LYS 11 9.455 -23.253 -20.202
87 HD2 LYS 11 HD2 LYS 11 10.534 -20.457 -20.624
88 HD3 LYS 11 HD1 LYS 11 11.512 -21.905 -20.379
89 HE2 LYS 11 HE2 LYS 11 10.651 -22.866 -22.444
90 HE3 LYS 11 HE1 LYS 11 9.584 -21.479 -22.667
91 HZ1 LYS 11 HZ1 LYS 11 11.494 -20.062 -22.926
92 HZ2 LYS 11 HZ2 LYS 11 11.604 -21.348 -24.020
93 HZ3 LYS 11 HZ3 LYS 11 12.550 -21.346 -22.620
94 H GLY 12 HN GLY 12 7.302 -18.257 -21.942
95 HA2 GLY 12 HA2 GLY 12 5.423 -17.642 -23.127
96 HA3 GLY 12 HA1 GLY 12 4.628 -19.105 -22.567
97 HA PRO 13 HA PRO 13 2.613 -15.712 -20.199
98 HB2 PRO 13 HB2 PRO 13 0.074 -16.232 -20.868
99 HB3 PRO 13 HB1 PRO 13 1.146 -15.370 -21.980
100 HG2 PRO 13 HG2 PRO 13 0.317 -18.250 -22.002
101 HG3 PRO 13 HG1 PRO 13 0.486 -17.123 -23.361
102 HD2 PRO 13 HD2 PRO 13 2.393 -18.992 -22.613
103 HD3 PRO 13 HD1 PRO 13 2.727 -17.532 -23.565
104 H CYS 14 HN CYS 14 0.575 -16.055 -18.697
105 HA CYS 14 HA CYS 14 1.255 -18.050 -16.814
106 HB2 CYS 14 HB2 CYS 14 0.229 -15.985 -16.083
107 HB3 CYS 14 HB1 CYS 14 -1.209 -16.310 -17.046
108 H ALA 15 HN ALA 15 1.208 -20.008 -17.925
109 HA ALA 15 HA ALA 15 -1.287 -21.048 -18.954
110 HB1 ALA 15 HB1 ALA 15 0.867 -21.674 -19.976
111 HB2 ALA 15 HB2 ALA 15 -0.027 -23.082 -19.403
112 HB3 ALA 15 HB3 ALA 15 1.340 -22.465 -18.474
113 H SER 16 HN SER 16 0.645 -21.298 -16.037
114 HA SER 16 HA SER 16 -1.598 -22.576 -14.673
115 HB2 SER 16 HB2 SER 16 1.229 -23.679 -14.564
116 HB3 SER 16 HB1 SER 16 -0.145 -24.268 -13.629
117 HG SER 16 HG SER 16 -1.123 -24.511 -15.872
118 H ASP 17 HN ASP 17 -1.930 -21.718 -12.734
119 HA ASP 17 HA ASP 17 -0.621 -19.389 -11.911
120 HB2 ASP 17 HB2 ASP 17 -2.322 -21.223 -10.196
121 HB3 ASP 17 HB1 ASP 17 -2.011 -19.512 -9.920
122 H HIS 18 HN HIS 18 -0.605 -22.601 -10.370
123 HA HIS 18 HA HIS 18 1.222 -22.052 -8.331
124 HB2 HIS 18 HB2 HIS 18 -0.239 -24.102 -8.522
125 HB3 HIS 18 HB1 HIS 18 0.869 -24.708 -9.748
126 HD1 HIS 18 HD1 HIS 18 0.262 -24.790 -6.191
127 HD2 HIS 18 HD2 HIS 18 3.599 -25.102 -8.649
128 HE1 HIS 18 HE1 HIS 18 2.043 -25.861 -4.779
129 HE2 HIS 18 HE2 HIS 18 3.961 -26.259 -6.368
130 H ASN 19 HN ASN 19 1.738 -23.332 -11.585
131 HA ASN 19 HA ASN 19 4.476 -23.897 -11.368
132 HB2 ASN 19 HB2 ASN 19 2.885 -24.650 -13.198
133 HB3 ASN 19 HB1 ASN 19 3.039 -23.043 -13.896
134 HD21 ASN 19 HD21 ASN 19 3.729 -25.616 -15.037
135 HD22 ASN 19 HD22 ASN 19 5.414 -25.544 -15.422
136 H CYS 20 HN CYS 20 2.861 -21.019 -12.716
137 HA CYS 20 HA CYS 20 5.190 -19.604 -13.358
138 HB2 CYS 20 HB2 CYS 20 2.518 -19.178 -13.724
139 HB3 CYS 20 HB1 CYS 20 2.879 -17.966 -12.501
140 H ALA 21 HN ALA 21 3.183 -19.568 -10.444
141 HA ALA 21 HA ALA 21 4.568 -17.594 -9.020
142 HB1 ALA 21 HB1 ALA 21 3.064 -19.967 -7.900
143 HB2 ALA 21 HB2 ALA 21 2.338 -18.436 -8.392
144 HB3 ALA 21 HB3 ALA 21 3.468 -18.479 -7.039
145 H SER 22 HN SER 22 4.990 -21.113 -9.125
146 HA SER 22 HA SER 22 6.955 -21.302 -7.122
147 HB2 SER 22 HB2 SER 22 5.635 -23.222 -8.076
148 HB3 SER 22 HB1 SER 22 6.640 -23.131 -9.522
149 HG SER 22 HG SER 22 7.460 -23.726 -6.868
150 H VAL 23 HN VAL 23 7.209 -21.010 -10.647
151 HA VAL 23 HA VAL 23 9.991 -21.106 -10.872
152 HB VAL 23 HB VAL 23 7.888 -19.737 -12.563
153 HG11 VAL 23 HG11 VAL 23 10.830 -20.073 -13.203
154 HG12 VAL 23 HG12 VAL 23 9.993 -18.547 -12.916
155 HG13 VAL 23 HG13 VAL 23 9.591 -19.516 -14.331
156 HG21 VAL 23 HG21 VAL 23 9.478 -22.281 -12.955
157 HG22 VAL 23 HG22 VAL 23 8.318 -21.613 -14.101
158 HG23 VAL 23 HG23 VAL 23 7.772 -22.168 -12.520
159 H CYS 24 HN CYS 24 7.849 -18.268 -10.512
160 HA CYS 24 HA CYS 24 9.906 -16.345 -10.450
161 HB2 CYS 24 HB2 CYS 24 7.538 -15.754 -10.796
162 HB3 CYS 24 HB1 CYS 24 7.177 -16.213 -9.134
163 H GLN 25 HN GLN 25 8.334 -18.175 -7.839
164 HA GLN 25 HA GLN 25 9.621 -16.844 -5.703
165 HB2 GLN 25 HB2 GLN 25 8.374 -19.596 -5.861
166 HB3 GLN 25 HB1 GLN 25 8.993 -18.898 -4.369
167 HG2 GLN 25 HG2 GLN 25 7.386 -17.081 -4.524
168 HG3 GLN 25 HG1 GLN 25 6.786 -17.717 -6.056
169 HE21 GLN 25 HE21 GLN 25 5.364 -17.253 -3.549
170 HE22 GLN 25 HE22 GLN 25 4.690 -18.778 -3.095
171 H THR 26 HN THR 26 10.566 -19.555 -7.722
172 HA THR 26 HA THR 26 12.733 -20.369 -6.038
173 HB THR 26 HB THR 26 13.472 -21.710 -8.059
174 HG1 THR 26 HG1 THR 26 10.958 -20.991 -9.158
175 HG21 THR 26 HG21 THR 26 12.064 -22.691 -6.313
176 HG22 THR 26 HG22 THR 26 11.622 -23.315 -7.903
177 HG23 THR 26 HG23 THR 26 10.620 -22.088 -7.128
178 H GLU 27 HN GLU 27 12.456 -18.384 -9.005
179 HA GLU 27 HA GLU 27 15.275 -17.933 -9.163
180 HB2 GLU 27 HB2 GLU 27 14.819 -16.271 -10.827
181 HB3 GLU 27 HB1 GLU 27 13.753 -17.636 -11.104
182 HG2 GLU 27 HG2 GLU 27 11.879 -16.435 -10.211
183 HG3 GLU 27 HG1 GLU 27 12.921 -15.102 -9.708
184 H ARG 28 HN ARG 28 12.615 -16.202 -7.606
185 HA ARG 28 HA ARG 28 14.307 -15.269 -5.538
186 HB2 ARG 28 HB2 ARG 28 14.972 -13.621 -7.288
187 HB3 ARG 28 HB1 ARG 28 13.294 -13.102 -7.406
188 HG2 ARG 28 HG2 ARG 28 13.343 -12.380 -5.067
189 HG3 ARG 28 HG1 ARG 28 15.018 -12.914 -4.934
190 HD2 ARG 28 HD2 ARG 28 14.988 -10.533 -5.248
191 HD3 ARG 28 HD1 ARG 28 15.620 -11.280 -6.714
192 HE ARG 28 HE ARG 28 13.808 -10.489 -7.871
193 HH11 ARG 28 HH11 ARG 28 13.147 -10.238 -4.440
194 HH12 ARG 28 HH12 ARG 28 11.733 -9.259 -4.648
195 HH21 ARG 28 HH21 ARG 28 11.965 -9.153 -8.156
196 HH22 ARG 28 HH22 ARG 28 11.055 -8.656 -6.771
197 H PHE 29 HN PHE 29 13.046 -15.256 -3.798
198 HA PHE 29 HA PHE 29 10.406 -15.906 -3.713
199 HB2 PHE 29 HB2 PHE 29 11.981 -14.265 -1.719
200 HB3 PHE 29 HB1 PHE 29 10.375 -14.912 -1.392
201 HD1 PHE 29 HD2 PHE 29 10.025 -17.312 -1.133
202 HD2 PHE 29 HD1 PHE 29 13.912 -15.706 -1.803
203 HE1 PHE 29 HE2 PHE 29 11.027 -19.443 -0.419
204 HE2 PHE 29 HE1 PHE 29 14.918 -17.833 -1.092
205 HZ PHE 29 HZ PHE 29 13.475 -19.706 -0.396
206 H SER 30 HN SER 30 8.901 -14.977 -4.860
207 HA SER 30 HA SER 30 7.925 -12.369 -4.226
208 HB2 SER 30 HB2 SER 30 8.851 -12.940 -7.068
209 HB3 SER 30 HB1 SER 30 8.047 -11.474 -6.504
210 HG SER 30 HG SER 30 10.645 -12.409 -5.894
211 H GLY 31 HN GLY 31 5.861 -12.810 -4.024
212 HA2 GLY 31 HA2 GLY 31 4.464 -15.058 -4.782
213 HA3 GLY 31 HA1 GLY 31 3.706 -13.492 -4.526
214 H GLY 32 HN GLY 32 3.014 -15.580 -6.489
215 HA2 GLY 32 HA2 GLY 32 3.785 -14.234 -9.013
216 HA3 GLY 32 HA1 GLY 32 3.499 -15.961 -8.865
217 H ARG 33 HN ARG 33 2.229 -13.187 -9.969
218 HA ARG 33 HA ARG 33 -0.563 -14.119 -9.723
219 HB2 ARG 33 HB2 ARG 33 0.240 -11.211 -9.986
220 HB3 ARG 33 HB1 ARG 33 -1.323 -11.867 -9.507
221 HG2 ARG 33 HG2 ARG 33 -0.381 -12.631 -7.396
222 HG3 ARG 33 HG1 ARG 33 1.214 -12.060 -7.882
223 HD2 ARG 33 HD2 ARG 33 0.492 -10.335 -6.535
224 HD3 ARG 33 HD1 ARG 33 0.018 -9.755 -8.129
225 HE ARG 33 HE ARG 33 -2.175 -11.113 -7.173
226 HH11 ARG 33 HH11 ARG 33 -0.290 -8.333 -6.223
227 HH12 ARG 33 HH12 ARG 33 -1.552 -7.628 -5.272
228 HH21 ARG 33 HH21 ARG 33 -3.861 -10.190 -5.923
229 HH22 ARG 33 HH22 ARG 33 -3.590 -8.680 -5.108
230 H CYS 34 HN CYS 34 -1.902 -13.572 -11.589
231 HA CYS 34 HA CYS 34 -0.287 -13.373 -14.050
232 HB2 CYS 34 HB2 CYS 34 -2.897 -14.863 -13.650
233 HB3 CYS 34 HB1 CYS 34 -1.944 -14.811 -15.132
234 H ARG 35 HN ARG 35 -0.516 -11.410 -14.871
235 HA ARG 35 HA ARG 35 -3.201 -10.242 -15.124
236 HB2 ARG 35 HB2 ARG 35 -1.892 -9.319 -13.121
237 HB3 ARG 35 HB1 ARG 35 -0.777 -8.632 -14.290
238 HG2 ARG 35 HG2 ARG 35 -2.231 -6.887 -13.703
239 HG3 ARG 35 HG1 ARG 35 -2.772 -7.427 -15.290
240 HD2 ARG 35 HD2 ARG 35 -4.014 -8.411 -12.723
241 HD3 ARG 35 HD1 ARG 35 -4.584 -6.971 -13.563
242 HE ARG 35 HE ARG 35 -4.980 -8.506 -15.510
243 HH11 ARG 35 HH11 ARG 35 -5.043 -9.687 -12.213
244 HH12 ARG 35 HH12 ARG 35 -6.118 -11.003 -12.569
245 HH21 ARG 35 HH21 ARG 35 -6.437 -10.219 -15.965
246 HH22 ARG 35 HH22 ARG 35 -6.924 -11.293 -14.693
247 H GLY 36 HN GLY 36 -3.452 -8.973 -17.005
248 HA2 GLY 36 HA2 GLY 36 -2.187 -7.691 -18.767
249 HA3 GLY 36 HA1 GLY 36 -1.203 -9.142 -18.922
250 H PHE 37 HN PHE 37 -2.423 -8.129 -21.119
251 HA PHE 37 HA PHE 37 -5.001 -8.937 -21.738
252 HB2 PHE 37 HB2 PHE 37 -3.693 -7.460 -23.182
253 HB3 PHE 37 HB1 PHE 37 -2.584 -8.772 -23.562
254 HD1 PHE 37 HD1 PHE 37 -6.152 -7.751 -23.854
255 HD2 PHE 37 HD2 PHE 37 -2.983 -10.145 -25.412
256 HE1 PHE 37 HE1 PHE 37 -7.554 -8.361 -25.778
257 HE2 PHE 37 HE2 PHE 37 -4.387 -10.755 -27.335
258 HZ PHE 37 HZ PHE 37 -6.675 -9.861 -27.521
259 H ARG 38 HN ARG 38 -1.992 -10.785 -21.949
260 HA ARG 38 HA ARG 38 -3.547 -13.211 -22.609
261 HB2 ARG 38 HB2 ARG 38 -0.576 -12.700 -22.937
262 HB3 ARG 38 HB1 ARG 38 -1.418 -14.177 -23.383
263 HG2 ARG 38 HG2 ARG 38 -2.728 -12.885 -25.042
264 HG3 ARG 38 HG1 ARG 38 -1.772 -11.455 -24.637
265 HD2 ARG 38 HD2 ARG 38 0.276 -12.686 -25.282
266 HD3 ARG 38 HD1 ARG 38 -0.725 -14.056 -25.762
267 HE ARG 38 HE ARG 38 -1.363 -11.533 -27.044
268 HH11 ARG 38 HH11 ARG 38 0.401 -14.550 -27.232
269 HH12 ARG 38 HH12 ARG 38 0.663 -14.437 -28.943
270 HH21 ARG 38 HH21 ARG 38 -1.041 -11.385 -29.289
271 HH22 ARG 38 HH22 ARG 38 -0.164 -12.635 -30.119
272 H ARG 39 HN ARG 39 -3.099 -11.899 -19.962
273 HA ARG 39 HA ARG 39 -2.514 -12.360 -17.816
274 HB2 ARG 39 HB2 ARG 39 -2.433 -15.265 -18.658
275 HB3 ARG 39 HB1 ARG 39 -2.733 -14.626 -17.048
276 HG2 ARG 39 HG2 ARG 39 -4.872 -13.701 -17.828
277 HG3 ARG 39 HG1 ARG 39 -4.565 -14.378 -19.431
278 HD2 ARG 39 HD2 ARG 39 -4.993 -15.868 -16.843
279 HD3 ARG 39 HD1 ARG 39 -6.006 -15.903 -18.285
280 HE ARG 39 HE ARG 39 -3.411 -17.232 -17.929
281 HH11 ARG 39 HH11 ARG 39 -6.239 -16.650 -19.920
282 HH12 ARG 39 HH12 ARG 39 -5.907 -17.975 -20.990
283 HH21 ARG 39 HH21 ARG 39 -2.982 -18.972 -19.323
284 HH22 ARG 39 HH22 ARG 39 -4.043 -19.281 -20.664
285 H ARG 40 HN ARG 40 -0.416 -11.334 -18.270
286 HA ARG 40 HA ARG 40 1.846 -13.099 -18.637
287 HB2 ARG 40 HB2 ARG 40 1.437 -10.165 -18.541
288 HB3 ARG 40 HB1 ARG 40 2.983 -10.732 -17.922
289 HG2 ARG 40 HG2 ARG 40 1.879 -11.383 -20.653
290 HG3 ARG 40 HG1 ARG 40 3.061 -10.121 -20.307
291 HD2 ARG 40 HD2 ARG 40 4.616 -11.810 -19.445
292 HD3 ARG 40 HD1 ARG 40 3.435 -13.075 -19.782
293 HE ARG 40 HE ARG 40 3.679 -12.436 -22.178
294 HH11 ARG 40 HH11 ARG 40 6.261 -11.695 -19.924
295 HH12 ARG 40 HH12 ARG 40 7.500 -11.731 -21.132
296 HH21 ARG 40 HH21 ARG 40 5.317 -12.498 -23.768
297 HH22 ARG 40 HH22 ARG 40 6.963 -12.188 -23.318
298 H CYS 41 HN CYS 41 3.593 -13.197 -17.084
299 HA CYS 41 HA CYS 41 2.511 -13.696 -14.441
300 HB2 CYS 41 HB2 CYS 41 4.267 -15.096 -15.936
301 HB3 CYS 41 HB1 CYS 41 5.407 -14.132 -15.006
302 H PHE 42 HN PHE 42 2.395 -12.006 -13.114
303 HA PHE 42 HA PHE 42 4.703 -10.179 -12.937
304 HB2 PHE 42 HB2 PHE 42 1.756 -9.687 -12.462
305 HB3 PHE 42 HB1 PHE 42 2.994 -8.606 -11.832
306 HD1 PHE 42 HD2 PHE 42 1.428 -9.911 -14.910
307 HD2 PHE 42 HD1 PHE 42 4.173 -7.101 -13.257
308 HE1 PHE 42 HE2 PHE 42 1.505 -8.718 -17.061
309 HE2 PHE 42 HE1 PHE 42 4.252 -5.909 -15.406
310 HZ PHE 42 HZ PHE 42 2.917 -6.718 -17.311
311 H CYS 43 HN CYS 43 5.567 -9.782 -10.931
312 HA CYS 43 HA CYS 43 4.761 -11.742 -8.888
313 HB2 CYS 43 HB2 CYS 43 7.519 -10.721 -9.600
314 HB3 CYS 43 HB1 CYS 43 7.167 -11.778 -8.238
315 H THR 44 HN THR 44 4.662 -11.143 -6.786
316 HA THR 44 HA THR 44 5.116 -8.303 -6.157
317 HB THR 44 HB THR 44 3.460 -8.737 -4.259
318 HG1 THR 44 HG1 THR 44 3.569 -11.077 -4.495
319 HG21 THR 44 HG21 THR 44 1.493 -8.437 -5.693
320 HG22 THR 44 HG22 THR 44 2.419 -8.975 -7.094
321 HG23 THR 44 HG23 THR 44 2.845 -7.467 -6.280
322 H THR 45 HN THR 45 6.762 -7.951 -4.913
323 HA THR 45 HA THR 45 7.703 -10.017 -3.038
324 HB THR 45 HB THR 45 9.148 -9.807 -5.086
325 HG1 THR 45 HG1 THR 45 10.363 -10.541 -3.482
326 HG21 THR 45 HG21 THR 45 10.547 -7.817 -5.357
327 HG22 THR 45 HG22 THR 45 9.727 -7.043 -4.001
328 HG23 THR 45 HG23 THR 45 8.838 -7.396 -5.484
329 H HIS 46 HN HIS 46 9.458 -8.769 -1.538
330 HA HIS 46 HA HIS 46 8.229 -6.216 -0.711
331 HB2 HIS 46 HB2 HIS 46 9.009 -8.567 1.016
332 HB3 HIS 46 HB1 HIS 46 8.847 -6.944 1.681
333 HD1 HIS 46 HD1 HIS 46 6.941 -9.923 1.173
334 HD2 HIS 46 HD2 HIS 46 6.128 -5.850 1.016
335 HE1 HIS 46 HE1 HIS 46 4.441 -9.723 1.353
336 HE2 HIS 46 HE2 HIS 46 3.978 -7.244 1.331
337 H CYS 47 HN CYS 47 9.621 -4.648 -0.975
338 HA CYS 47 HA CYS 47 12.465 -5.093 -1.057
339 HB2 CYS 47 HB2 CYS 47 10.880 -2.512 -1.217
340 HB3 CYS 47 HB1 CYS 47 12.599 -2.681 -1.558
Start of MODEL 4
1 H1 ARG 1 HT1 ARG 1 3.913 1.816 0.739
2 H2 ARG 1 HT2 ARG 1 4.830 0.493 1.247
3 H3 ARG 1 HT3 ARG 1 3.203 0.285 0.836
4 HA ARG 1 HA ARG 1 3.660 0.852 -1.446
5 HB2 ARG 1 HB2 ARG 1 6.497 1.102 -0.427
6 HB3 ARG 1 HB1 ARG 1 6.105 0.924 -2.131
7 HG2 ARG 1 HG2 ARG 1 5.126 3.178 -0.386
8 HG3 ARG 1 HG1 ARG 1 6.546 3.257 -1.427
9 HD2 ARG 1 HD2 ARG 1 4.784 4.263 -2.651
10 HD3 ARG 1 HD1 ARG 1 5.019 2.666 -3.359
11 HE ARG 1 HE ARG 1 2.947 2.933 -1.317
12 HH11 ARG 1 HH11 ARG 1 3.736 2.699 -4.721
13 HH12 ARG 1 HH12 ARG 1 2.107 2.346 -5.204
14 HH21 ARG 1 HH21 ARG 1 0.814 2.433 -1.946
15 HH22 ARG 1 HH22 ARG 1 0.449 2.172 -3.623
16 H THR 2 HN THR 2 3.666 -0.893 -2.741
17 HA THR 2 HA THR 2 4.651 -3.427 -1.667
18 HB THR 2 HB THR 2 3.136 -2.945 -4.258
19 HG1 THR 2 HG1 THR 2 2.253 -2.686 -1.746
20 HG21 THR 2 HG21 THR 2 4.299 -5.117 -4.103
21 HG22 THR 2 HG22 THR 2 2.547 -5.316 -4.082
22 HG23 THR 2 HG23 THR 2 3.466 -5.451 -2.581
23 H CYS 3 HN CYS 3 6.056 -4.782 -3.026
24 HA CYS 3 HA CYS 3 7.593 -3.254 -5.033
25 HB2 CYS 3 HB2 CYS 3 8.905 -3.920 -3.024
26 HB3 CYS 3 HB1 CYS 3 8.524 -5.602 -3.357
27 H GLU 4 HN GLU 4 6.656 -3.782 -6.910
28 HA GLU 4 HA GLU 4 6.080 -6.624 -7.450
29 HB2 GLU 4 HB2 GLU 4 4.164 -5.909 -8.826
30 HB3 GLU 4 HB1 GLU 4 3.983 -5.413 -7.149
31 HG2 GLU 4 HG2 GLU 4 4.926 -3.588 -9.363
32 HG3 GLU 4 HG1 GLU 4 3.256 -3.710 -8.812
33 H SER 5 HN SER 5 6.299 -7.322 -9.604
34 HA SER 5 HA SER 5 7.446 -5.584 -11.598
35 HB2 SER 5 HB2 SER 5 9.409 -6.177 -10.136
36 HB3 SER 5 HB1 SER 5 9.139 -7.872 -10.536
37 HG SER 5 HG SER 5 9.800 -5.766 -12.330
38 H GLN 6 HN GLN 6 8.448 -7.442 -13.345
39 HA GLN 6 HA GLN 6 6.207 -9.314 -13.774
40 HB2 GLN 6 HB2 GLN 6 5.980 -7.518 -15.356
41 HB3 GLN 6 HB1 GLN 6 7.687 -7.584 -15.767
42 HG2 GLN 6 HG2 GLN 6 7.376 -9.760 -16.810
43 HG3 GLN 6 HG1 GLN 6 5.674 -9.755 -16.352
44 HE21 GLN 6 HE21 GLN 6 7.061 -9.844 -18.987
45 HE22 GLN 6 HE22 GLN 6 6.368 -8.554 -19.904
46 H SER 7 HN SER 7 6.724 -11.352 -14.594
47 HA SER 7 HA SER 7 9.605 -12.006 -14.579
48 HB2 SER 7 HB2 SER 7 8.713 -14.354 -13.970
49 HB3 SER 7 HB1 SER 7 8.661 -13.114 -12.721
50 HG SER 7 HG SER 7 6.633 -13.669 -12.620
51 H HIS 8 HN HIS 8 10.450 -13.082 -16.278
52 HA HIS 8 HA HIS 8 8.617 -13.958 -18.421
53 HB2 HIS 8 HB2 HIS 8 10.191 -13.105 -20.104
54 HB3 HIS 8 HB1 HIS 8 9.608 -11.807 -19.068
55 HD1 HIS 8 HD1 HIS 8 12.677 -13.329 -20.327
56 HD2 HIS 8 HD2 HIS 8 11.572 -10.978 -17.078
57 HE1 HIS 8 HE1 HIS 8 14.819 -12.394 -19.408
58 HE2 HIS 8 HE2 HIS 8 14.109 -10.852 -17.546
59 H LYS 9 HN LYS 9 10.717 -14.996 -16.200
60 HA LYS 9 HA LYS 9 12.358 -16.817 -17.645
61 HB2 LYS 9 HB2 LYS 9 12.759 -16.206 -15.271
62 HB3 LYS 9 HB1 LYS 9 11.275 -17.029 -14.815
63 HG2 LYS 9 HG2 LYS 9 12.981 -18.537 -14.280
64 HG3 LYS 9 HG1 LYS 9 12.323 -19.134 -15.801
65 HD2 LYS 9 HD2 LYS 9 14.599 -19.272 -16.197
66 HD3 LYS 9 HD1 LYS 9 14.226 -17.689 -16.877
67 HE2 LYS 9 HE2 LYS 9 15.347 -18.201 -14.114
68 HE3 LYS 9 HE1 LYS 9 16.270 -17.655 -15.510
69 HZ1 LYS 9 HZ1 LYS 9 15.708 -15.824 -14.051
70 HZ2 LYS 9 HZ2 LYS 9 14.062 -16.161 -14.198
71 HZ3 LYS 9 HZ3 LYS 9 14.938 -15.633 -15.541
72 H PHE 10 HN PHE 10 9.097 -16.829 -16.460
73 HA PHE 10 HA PHE 10 8.472 -19.546 -16.655
74 HB2 PHE 10 HB2 PHE 10 7.065 -17.842 -15.514
75 HB3 PHE 10 HB1 PHE 10 6.616 -17.186 -17.087
76 HD1 PHE 10 HD2 PHE 10 6.548 -20.336 -15.111
77 HD2 PHE 10 HD1 PHE 10 4.708 -18.006 -18.165
78 HE1 PHE 10 HE2 PHE 10 4.691 -21.935 -15.210
79 HE2 PHE 10 HE1 PHE 10 2.845 -19.609 -18.268
80 HZ PHE 10 HZ PHE 10 2.833 -21.579 -16.786
81 H LYS 11 HN LYS 11 7.519 -20.773 -18.282
82 HA LYS 11 HA LYS 11 8.427 -20.045 -20.931
83 HB2 LYS 11 HB2 LYS 11 8.846 -22.280 -19.964
84 HB3 LYS 11 HB1 LYS 11 7.117 -22.581 -19.941
85 HG2 LYS 11 HG2 LYS 11 7.057 -22.432 -22.386
86 HG3 LYS 11 HG1 LYS 11 8.794 -22.117 -22.406
87 HD2 LYS 11 HD2 LYS 11 7.436 -24.626 -21.400
88 HD3 LYS 11 HD1 LYS 11 8.343 -24.463 -22.905
89 HE2 LYS 11 HE2 LYS 11 10.385 -24.048 -21.683
90 HE3 LYS 11 HE1 LYS 11 9.513 -24.026 -20.151
91 HZ1 LYS 11 HZ1 LYS 11 8.923 -26.365 -20.552
92 HZ2 LYS 11 HZ2 LYS 11 10.591 -26.126 -20.427
93 HZ3 LYS 11 HZ3 LYS 11 9.883 -26.360 -21.944
94 H GLY 12 HN GLY 12 7.189 -18.954 -22.226
95 HA2 GLY 12 HA2 GLY 12 5.408 -18.339 -23.533
96 HA3 GLY 12 HA1 GLY 12 4.656 -19.859 -23.084
97 HA PRO 13 HA PRO 13 2.022 -16.556 -21.222
98 HB2 PRO 13 HB2 PRO 13 -0.350 -17.630 -21.962
99 HB3 PRO 13 HB1 PRO 13 0.611 -16.622 -23.053
100 HG2 PRO 13 HG2 PRO 13 0.390 -19.610 -22.937
101 HG3 PRO 13 HG1 PRO 13 0.401 -18.546 -24.357
102 HD2 PRO 13 HD2 PRO 13 2.601 -19.920 -23.498
103 HD3 PRO 13 HD1 PRO 13 2.702 -18.373 -24.360
104 H CYS 14 HN CYS 14 0.357 -16.790 -19.540
105 HA CYS 14 HA CYS 14 1.190 -18.594 -17.558
106 HB2 CYS 14 HB2 CYS 14 0.175 -16.412 -17.064
107 HB3 CYS 14 HB1 CYS 14 -1.365 -16.980 -17.695
108 H ALA 15 HN ALA 15 1.031 -20.675 -18.557
109 HA ALA 15 HA ALA 15 -1.504 -21.839 -19.189
110 HB1 ALA 15 HB1 ALA 15 1.128 -23.170 -18.513
111 HB2 ALA 15 HB2 ALA 15 0.581 -22.722 -20.127
112 HB3 ALA 15 HB3 ALA 15 -0.279 -23.968 -19.221
113 H SER 16 HN SER 16 0.593 -21.749 -16.364
114 HA SER 16 HA SER 16 -1.672 -22.516 -14.678
115 HB2 SER 16 HB2 SER 16 -0.460 -24.598 -14.920
116 HB3 SER 16 HB1 SER 16 1.076 -23.800 -14.593
117 HG SER 16 HG SER 16 -1.084 -24.209 -12.792
118 H ASP 17 HN ASP 17 -1.945 -20.882 -13.312
119 HA ASP 17 HA ASP 17 -0.070 -18.879 -12.728
120 HB2 ASP 17 HB2 ASP 17 -1.604 -18.326 -10.811
121 HB3 ASP 17 HB1 ASP 17 -2.412 -18.442 -12.371
122 H HIS 18 HN HIS 18 -0.791 -21.941 -11.164
123 HA HIS 18 HA HIS 18 0.663 -21.491 -8.780
124 HB2 HIS 18 HB2 HIS 18 -1.052 -23.368 -9.302
125 HB3 HIS 18 HB1 HIS 18 0.313 -24.218 -10.030
126 HD1 HIS 18 HD1 HIS 18 -1.280 -23.475 -6.800
127 HD2 HIS 18 HD2 HIS 18 2.391 -24.908 -8.132
128 HE1 HIS 18 HE1 HIS 18 -0.190 -24.520 -4.789
129 HE2 HIS 18 HE2 HIS 18 2.071 -25.281 -5.591
130 H ASN 19 HN ASN 19 1.501 -22.952 -11.894
131 HA ASN 19 HA ASN 19 4.146 -23.691 -11.194
132 HB2 ASN 19 HB2 ASN 19 2.935 -24.616 -13.162
133 HB3 ASN 19 HB1 ASN 19 3.047 -23.044 -13.947
134 HD21 ASN 19 HD21 ASN 19 4.217 -23.832 -15.665
135 HD22 ASN 19 HD22 ASN 19 5.869 -24.323 -15.531
136 H CYS 20 HN CYS 20 2.784 -20.869 -12.828
137 HA CYS 20 HA CYS 20 5.112 -19.411 -13.276
138 HB2 CYS 20 HB2 CYS 20 2.984 -18.718 -14.214
139 HB3 CYS 20 HB1 CYS 20 2.314 -18.456 -12.607
140 H ALA 21 HN ALA 21 3.049 -19.590 -10.408
141 HA ALA 21 HA ALA 21 4.343 -17.678 -8.826
142 HB1 ALA 21 HB1 ALA 21 2.155 -18.593 -8.258
143 HB2 ALA 21 HB2 ALA 21 3.284 -18.807 -6.920
144 HB3 ALA 21 HB3 ALA 21 2.876 -20.173 -7.960
145 H SER 22 HN SER 22 4.763 -21.211 -8.918
146 HA SER 22 HA SER 22 6.764 -21.419 -6.993
147 HB2 SER 22 HB2 SER 22 5.519 -23.345 -7.923
148 HB3 SER 22 HB1 SER 22 6.372 -23.150 -9.454
149 HG SER 22 HG SER 22 7.885 -23.424 -7.108
150 H VAL 23 HN VAL 23 7.056 -21.048 -10.513
151 HA VAL 23 HA VAL 23 9.841 -21.067 -10.729
152 HB VAL 23 HB VAL 23 7.730 -19.683 -12.399
153 HG11 VAL 23 HG11 VAL 23 10.675 -20.008 -13.023
154 HG12 VAL 23 HG12 VAL 23 9.831 -18.487 -12.733
155 HG13 VAL 23 HG13 VAL 23 9.448 -19.448 -14.161
156 HG21 VAL 23 HG21 VAL 23 7.653 -22.139 -12.354
157 HG22 VAL 23 HG22 VAL 23 9.330 -22.201 -12.895
158 HG23 VAL 23 HG23 VAL 23 8.086 -21.529 -13.950
159 H CYS 24 HN CYS 24 7.640 -18.294 -10.395
160 HA CYS 24 HA CYS 24 9.590 -16.294 -10.313
161 HB2 CYS 24 HB2 CYS 24 7.253 -15.758 -10.656
162 HB3 CYS 24 HB1 CYS 24 6.835 -16.379 -9.062
163 H GLN 25 HN GLN 25 8.310 -18.372 -7.778
164 HA GLN 25 HA GLN 25 9.519 -16.953 -5.612
165 HB2 GLN 25 HB2 GLN 25 8.380 -19.745 -5.797
166 HB3 GLN 25 HB1 GLN 25 8.991 -19.043 -4.304
167 HG2 GLN 25 HG2 GLN 25 7.316 -17.247 -4.484
168 HG3 GLN 25 HG1 GLN 25 6.688 -18.002 -5.947
169 HE21 GLN 25 HE21 GLN 25 4.659 -18.297 -5.046
170 HE22 GLN 25 HE22 GLN 25 4.345 -19.483 -3.832
171 H THR 26 HN THR 26 10.514 -19.616 -7.693
172 HA THR 26 HA THR 26 12.858 -20.216 -6.158
173 HB THR 26 HB THR 26 13.614 -21.480 -8.186
174 HG1 THR 26 HG1 THR 26 12.139 -19.945 -9.552
175 HG21 THR 26 HG21 THR 26 10.771 -22.040 -7.313
176 HG22 THR 26 HG22 THR 26 12.234 -22.570 -6.477
177 HG23 THR 26 HG23 THR 26 11.863 -23.189 -8.087
178 H GLU 27 HN GLU 27 12.047 -17.989 -8.744
179 HA GLU 27 HA GLU 27 14.684 -17.209 -9.415
180 HB2 GLU 27 HB2 GLU 27 12.121 -15.600 -9.538
181 HB3 GLU 27 HB1 GLU 27 13.649 -15.097 -10.245
182 HG2 GLU 27 HG2 GLU 27 13.561 -17.275 -11.573
183 HG3 GLU 27 HG1 GLU 27 11.877 -17.377 -11.063
184 H ARG 28 HN ARG 28 12.418 -15.104 -7.636
185 HA ARG 28 HA ARG 28 14.388 -14.549 -5.577
186 HB2 ARG 28 HB2 ARG 28 13.682 -12.535 -7.705
187 HB3 ARG 28 HB1 ARG 28 14.161 -12.012 -6.101
188 HG2 ARG 28 HG2 ARG 28 16.311 -13.195 -6.384
189 HG3 ARG 28 HG1 ARG 28 15.825 -13.626 -8.026
190 HD2 ARG 28 HD2 ARG 28 15.731 -11.311 -8.671
191 HD3 ARG 28 HD1 ARG 28 15.994 -10.787 -7.010
192 HE ARG 28 HE ARG 28 18.099 -12.403 -8.206
193 HH11 ARG 28 HH11 ARG 28 16.910 -9.210 -7.401
194 HH12 ARG 28 HH12 ARG 28 18.453 -8.437 -7.563
195 HH21 ARG 28 HH21 ARG 28 20.159 -11.396 -8.423
196 HH22 ARG 28 HH22 ARG 28 20.308 -9.695 -8.131
197 H PHE 29 HN PHE 29 11.266 -13.822 -7.036
198 HA PHE 29 HA PHE 29 10.432 -12.101 -4.901
199 HB2 PHE 29 HB2 PHE 29 8.779 -13.321 -7.124
200 HB3 PHE 29 HB1 PHE 29 8.337 -11.939 -6.126
201 HD1 PHE 29 HD1 PHE 29 10.520 -13.117 -8.840
202 HD2 PHE 29 HD2 PHE 29 9.255 -9.755 -6.551
203 HE1 PHE 29 HE1 PHE 29 11.585 -11.611 -10.466
204 HE2 PHE 29 HE2 PHE 29 10.319 -8.248 -8.176
205 HZ PHE 29 HZ PHE 29 11.486 -9.172 -10.139
206 H SER 30 HN SER 30 8.684 -12.456 -3.459
207 HA SER 30 HA SER 30 8.575 -15.169 -2.464
208 HB2 SER 30 HB2 SER 30 7.215 -12.679 -1.399
209 HB3 SER 30 HB1 SER 30 7.470 -14.192 -0.532
210 HG SER 30 HG SER 30 9.758 -13.802 -0.821
211 H GLY 31 HN GLY 31 6.621 -13.046 -4.363
212 HA2 GLY 31 HA2 GLY 31 4.498 -15.096 -4.409
213 HA3 GLY 31 HA1 GLY 31 4.099 -13.389 -4.263
214 H GLY 32 HN GLY 32 3.444 -15.363 -6.355
215 HA2 GLY 32 HA2 GLY 32 4.053 -13.636 -8.605
216 HA3 GLY 32 HA1 GLY 32 4.699 -15.271 -8.720
217 H ARG 33 HN ARG 33 2.459 -13.683 -10.115
218 HA ARG 33 HA ARG 33 0.769 -15.920 -10.545
219 HB2 ARG 33 HB2 ARG 33 -0.088 -14.887 -8.332
220 HB3 ARG 33 HB1 ARG 33 -0.691 -13.570 -9.334
221 HG2 ARG 33 HG2 ARG 33 -2.171 -15.004 -10.501
222 HG3 ARG 33 HG1 ARG 33 -1.391 -16.450 -9.860
223 HD2 ARG 33 HD2 ARG 33 -3.530 -16.055 -8.766
224 HD3 ARG 33 HD1 ARG 33 -2.203 -15.899 -7.623
225 HE ARG 33 HE ARG 33 -2.682 -13.662 -7.382
226 HH11 ARG 33 HH11 ARG 33 -4.486 -14.922 -10.105
227 HH12 ARG 33 HH12 ARG 33 -5.616 -13.607 -10.136
228 HH21 ARG 33 HH21 ARG 33 -4.150 -11.915 -7.413
229 HH22 ARG 33 HH22 ARG 33 -5.419 -11.880 -8.596
230 H CYS 34 HN CYS 34 -1.354 -14.824 -11.856
231 HA CYS 34 HA CYS 34 0.091 -13.415 -14.005
232 HB2 CYS 34 HB2 CYS 34 -2.223 -15.331 -14.341
233 HB3 CYS 34 HB1 CYS 34 -1.127 -14.734 -15.585
234 H ARG 35 HN ARG 35 -0.870 -11.720 -14.989
235 HA ARG 35 HA ARG 35 -2.739 -10.268 -13.412
236 HB2 ARG 35 HB2 ARG 35 -0.857 -9.272 -14.705
237 HB3 ARG 35 HB1 ARG 35 -1.740 -9.619 -16.178
238 HG2 ARG 35 HG2 ARG 35 -2.053 -7.312 -15.639
239 HG3 ARG 35 HG1 ARG 35 -3.577 -8.155 -15.364
240 HD2 ARG 35 HD2 ARG 35 -3.159 -8.208 -12.975
241 HD3 ARG 35 HD1 ARG 35 -1.566 -7.486 -13.211
242 HE ARG 35 HE ARG 35 -3.868 -5.957 -14.149
243 HH11 ARG 35 HH11 ARG 35 -1.460 -6.439 -11.647
244 HH12 ARG 35 HH12 ARG 35 -1.654 -4.853 -10.978
245 HH21 ARG 35 HH21 ARG 35 -4.115 -3.866 -13.280
246 HH22 ARG 35 HH22 ARG 35 -3.161 -3.381 -11.913
247 H GLY 36 HN GLY 36 -4.772 -10.705 -13.389
248 HA2 GLY 36 HA2 GLY 36 -6.926 -11.271 -14.018
249 HA3 GLY 36 HA1 GLY 36 -6.642 -9.968 -15.155
250 H PHE 37 HN PHE 37 -6.991 -10.419 -17.201
251 HA PHE 37 HA PHE 37 -7.084 -13.228 -18.059
252 HB2 PHE 37 HB2 PHE 37 -8.248 -10.716 -19.289
253 HB3 PHE 37 HB1 PHE 37 -8.355 -12.315 -20.014
254 HD1 PHE 37 HD2 PHE 37 -9.399 -10.256 -17.130
255 HD2 PHE 37 HD1 PHE 37 -9.973 -13.890 -19.283
256 HE1 PHE 37 HE2 PHE 37 -11.448 -10.692 -15.845
257 HE2 PHE 37 HE1 PHE 37 -12.026 -14.324 -17.999
258 HZ PHE 37 HZ PHE 37 -12.764 -12.725 -16.279
259 H ARG 38 HN ARG 38 -4.941 -10.761 -18.018
260 HA ARG 38 HA ARG 38 -4.042 -10.608 -20.705
261 HB2 ARG 38 HB2 ARG 38 -3.535 -8.902 -18.955
262 HB3 ARG 38 HB1 ARG 38 -2.460 -10.055 -18.181
263 HG2 ARG 38 HG2 ARG 38 -1.157 -8.512 -19.490
264 HG3 ARG 38 HG1 ARG 38 -1.083 -10.110 -20.237
265 HD2 ARG 38 HD2 ARG 38 -2.889 -9.393 -21.797
266 HD3 ARG 38 HD1 ARG 38 -2.797 -7.775 -21.097
267 HE ARG 38 HE ARG 38 -0.351 -8.902 -22.222
268 HH11 ARG 38 HH11 ARG 38 -3.023 -6.667 -22.550
269 HH12 ARG 38 HH12 ARG 38 -2.294 -5.798 -23.863
270 HH21 ARG 38 HH21 ARG 38 0.595 -7.791 -23.957
271 HH22 ARG 38 HH22 ARG 38 -0.232 -6.441 -24.673
272 H ARG 39 HN ARG 39 -3.450 -12.814 -18.091
273 HA ARG 39 HA ARG 39 -2.370 -14.798 -17.946
274 HB2 ARG 39 HB2 ARG 39 -2.334 -14.567 -20.965
275 HB3 ARG 39 HB1 ARG 39 -1.858 -16.014 -20.080
276 HG2 ARG 39 HG2 ARG 39 -4.076 -16.333 -19.248
277 HG3 ARG 39 HG1 ARG 39 -4.585 -14.750 -19.845
278 HD2 ARG 39 HD2 ARG 39 -3.710 -17.064 -21.583
279 HD3 ARG 39 HD1 ARG 39 -5.384 -16.607 -21.266
280 HE ARG 39 HE ARG 39 -3.665 -14.545 -22.394
281 HH11 ARG 39 HH11 ARG 39 -6.085 -17.012 -23.005
282 HH12 ARG 39 HH12 ARG 39 -6.563 -16.336 -24.530
283 HH21 ARG 39 HH21 ARG 39 -4.284 -13.664 -24.381
284 HH22 ARG 39 HH22 ARG 39 -5.542 -14.417 -25.309
285 H ARG 40 HN ARG 40 -0.930 -12.139 -18.164
286 HA ARG 40 HA ARG 40 1.769 -13.072 -18.853
287 HB2 ARG 40 HB2 ARG 40 1.070 -10.872 -19.735
288 HB3 ARG 40 HB1 ARG 40 0.772 -10.307 -18.099
289 HG2 ARG 40 HG2 ARG 40 2.840 -9.391 -18.583
290 HG3 ARG 40 HG1 ARG 40 3.266 -10.845 -17.683
291 HD2 ARG 40 HD2 ARG 40 3.299 -10.528 -20.689
292 HD3 ARG 40 HD1 ARG 40 4.708 -10.549 -19.632
293 HE ARG 40 HE ARG 40 3.159 -12.818 -20.546
294 HH11 ARG 40 HH11 ARG 40 5.400 -11.683 -18.103
295 HH12 ARG 40 HH12 ARG 40 6.098 -13.245 -17.827
296 HH21 ARG 40 HH21 ARG 40 4.063 -14.879 -20.200
297 HH22 ARG 40 HH22 ARG 40 5.338 -15.079 -19.038
298 H CYS 41 HN CYS 41 3.279 -13.468 -17.320
299 HA CYS 41 HA CYS 41 2.452 -13.730 -14.596
300 HB2 CYS 41 HB2 CYS 41 4.954 -14.366 -16.120
301 HB3 CYS 41 HB1 CYS 41 4.983 -14.377 -14.360
302 H PHE 42 HN PHE 42 2.429 -12.168 -13.174
303 HA PHE 42 HA PHE 42 4.668 -10.247 -13.101
304 HB2 PHE 42 HB2 PHE 42 1.782 -9.890 -12.245
305 HB3 PHE 42 HB1 PHE 42 3.068 -8.815 -11.696
306 HD1 PHE 42 HD2 PHE 42 1.248 -10.022 -14.691
307 HD2 PHE 42 HD1 PHE 42 3.904 -7.095 -13.096
308 HE1 PHE 42 HE2 PHE 42 0.998 -8.685 -16.738
309 HE2 PHE 42 HE1 PHE 42 3.656 -5.752 -15.148
310 HZ PHE 42 HZ PHE 42 2.201 -6.550 -16.971
311 H CYS 43 HN CYS 43 5.279 -9.616 -10.879
312 HA CYS 43 HA CYS 43 4.934 -11.847 -8.995
313 HB2 CYS 43 HB2 CYS 43 7.500 -10.619 -9.988
314 HB3 CYS 43 HB1 CYS 43 7.421 -11.522 -8.479
315 H THR 44 HN THR 44 5.077 -11.369 -6.842
316 HA THR 44 HA THR 44 5.166 -8.514 -6.122
317 HB THR 44 HB THR 44 3.600 -9.190 -4.224
318 HG1 THR 44 HG1 THR 44 2.782 -11.183 -4.209
319 HG21 THR 44 HG21 THR 44 2.564 -9.475 -7.057
320 HG22 THR 44 HG22 THR 44 2.788 -7.958 -6.186
321 HG23 THR 44 HG23 THR 44 1.583 -9.119 -5.634
322 H THR 45 HN THR 45 6.376 -7.948 -4.397
323 HA THR 45 HA THR 45 7.321 -9.840 -2.447
324 HB THR 45 HB THR 45 8.955 -10.192 -4.284
325 HG1 THR 45 HG1 THR 45 10.841 -9.308 -2.874
326 HG21 THR 45 HG21 THR 45 10.514 -8.417 -4.911
327 HG22 THR 45 HG22 THR 45 9.642 -7.276 -3.885
328 HG23 THR 45 HG23 THR 45 8.856 -7.962 -5.308
329 H HIS 46 HN HIS 46 9.072 -8.517 -1.048
330 HA HIS 46 HA HIS 46 7.975 -5.794 -0.695
331 HB2 HIS 46 HB2 HIS 46 9.061 -7.695 1.402
332 HB3 HIS 46 HB1 HIS 46 8.600 -6.022 1.709
333 HD1 HIS 46 HD1 HIS 46 7.248 -9.404 1.576
334 HD2 HIS 46 HD2 HIS 46 5.745 -5.540 1.276
335 HE1 HIS 46 HE1 HIS 46 4.771 -9.613 1.949
336 HE2 HIS 46 HE2 HIS 46 3.909 -7.245 1.905
337 H CYS 47 HN CYS 47 9.348 -4.140 -0.802
338 HA CYS 47 HA CYS 47 12.238 -4.648 -0.612
339 HB2 CYS 47 HB2 CYS 47 10.894 -3.010 -2.784
340 HB3 CYS 47 HB1 CYS 47 12.631 -3.180 -2.558
Start of MODEL 5
1 H1 ARG 1 HT1 ARG 1 2.613 -1.206 0.805
2 H2 ARG 1 HT2 ARG 1 2.974 -0.014 1.946
3 H3 ARG 1 HT3 ARG 1 3.311 -1.635 2.284
4 HA ARG 1 HA ARG 1 4.590 -0.002 0.178
5 HB2 ARG 1 HB2 ARG 1 5.635 -1.047 2.821
6 HB3 ARG 1 HB1 ARG 1 6.640 -0.309 1.581
7 HG2 ARG 1 HG2 ARG 1 4.301 1.206 2.672
8 HG3 ARG 1 HG1 ARG 1 5.784 1.092 3.618
9 HD2 ARG 1 HD2 ARG 1 5.774 3.128 2.297
10 HD3 ARG 1 HD1 ARG 1 7.051 2.049 1.750
11 HE ARG 1 HE ARG 1 4.795 1.597 0.156
12 HH11 ARG 1 HH11 ARG 1 7.006 4.229 0.823
13 HH12 ARG 1 HH12 ARG 1 6.955 4.848 -0.798
14 HH21 ARG 1 HH21 ARG 1 4.722 2.415 -1.979
15 HH22 ARG 1 HH22 ARG 1 5.652 3.825 -2.384
16 H THR 2 HN THR 2 4.205 -1.540 -1.401
17 HA THR 2 HA THR 2 5.924 -3.909 -1.255
18 HB THR 2 HB THR 2 3.093 -4.029 -2.340
19 HG1 THR 2 HG1 THR 2 2.994 -5.533 -0.367
20 HG21 THR 2 HG21 THR 2 3.474 -6.454 -2.373
21 HG22 THR 2 HG22 THR 2 5.114 -6.213 -1.771
22 HG23 THR 2 HG23 THR 2 4.665 -5.622 -3.372
23 H CYS 3 HN CYS 3 6.819 -4.480 -3.218
24 HA CYS 3 HA CYS 3 6.280 -2.675 -5.486
25 HB2 CYS 3 HB2 CYS 3 8.857 -4.059 -4.691
26 HB3 CYS 3 HB1 CYS 3 8.631 -3.156 -6.188
27 H GLU 4 HN GLU 4 6.028 -3.562 -7.514
28 HA GLU 4 HA GLU 4 5.972 -6.502 -7.677
29 HB2 GLU 4 HB2 GLU 4 3.926 -6.369 -9.037
30 HB3 GLU 4 HB1 GLU 4 3.669 -5.739 -7.418
31 HG2 GLU 4 HG2 GLU 4 4.166 -4.029 -9.853
32 HG3 GLU 4 HG1 GLU 4 2.571 -4.431 -9.228
33 H SER 5 HN SER 5 6.410 -7.378 -9.701
34 HA SER 5 HA SER 5 7.160 -5.566 -11.875
35 HB2 SER 5 HB2 SER 5 9.246 -6.034 -10.562
36 HB3 SER 5 HB1 SER 5 9.020 -7.754 -10.872
37 HG SER 5 HG SER 5 10.355 -6.168 -12.358
38 H GLN 6 HN GLN 6 8.039 -7.292 -13.730
39 HA GLN 6 HA GLN 6 5.740 -9.126 -14.024
40 HB2 GLN 6 HB2 GLN 6 5.756 -7.106 -15.542
41 HB3 GLN 6 HB1 GLN 6 7.242 -7.719 -16.254
42 HG2 GLN 6 HG2 GLN 6 6.055 -9.740 -16.985
43 HG3 GLN 6 HG1 GLN 6 4.563 -9.115 -16.282
44 HE21 GLN 6 HE21 GLN 6 5.003 -9.816 -19.037
45 HE22 GLN 6 HE22 GLN 6 4.785 -8.378 -19.965
46 H SER 7 HN SER 7 6.136 -11.131 -15.041
47 HA SER 7 HA SER 7 8.950 -11.972 -14.809
48 HB2 SER 7 HB2 SER 7 6.479 -13.675 -14.367
49 HB3 SER 7 HB1 SER 7 8.152 -14.103 -13.996
50 HG SER 7 HG SER 7 7.536 -13.368 -12.088
51 H HIS 8 HN HIS 8 9.638 -11.929 -16.847
52 HA HIS 8 HA HIS 8 8.123 -13.424 -18.890
53 HB2 HIS 8 HB2 HIS 8 9.499 -12.035 -20.543
54 HB3 HIS 8 HB1 HIS 8 8.246 -11.187 -19.651
55 HD1 HIS 8 HD1 HIS 8 11.725 -10.946 -20.547
56 HD2 HIS 8 HD2 HIS 8 9.373 -9.674 -17.365
57 HE1 HIS 8 HE1 HIS 8 13.043 -9.129 -19.415
58 HE2 HIS 8 HE2 HIS 8 11.511 -8.247 -17.620
59 H LYS 9 HN LYS 9 10.190 -14.194 -16.804
60 HA LYS 9 HA LYS 9 12.307 -15.357 -18.415
61 HB2 LYS 9 HB2 LYS 9 12.700 -14.620 -16.067
62 HB3 LYS 9 HB1 LYS 9 11.567 -15.845 -15.510
63 HG2 LYS 9 HG2 LYS 9 13.031 -17.604 -16.359
64 HG3 LYS 9 HG1 LYS 9 14.160 -16.388 -16.965
65 HD2 LYS 9 HD2 LYS 9 13.393 -16.814 -14.067
66 HD3 LYS 9 HD1 LYS 9 14.908 -17.320 -14.819
67 HE2 LYS 9 HE2 LYS 9 15.516 -15.016 -15.241
68 HE3 LYS 9 HE1 LYS 9 13.952 -14.460 -14.648
69 HZ1 LYS 9 HZ1 LYS 9 15.710 -14.206 -13.002
70 HZ2 LYS 9 HZ2 LYS 9 15.979 -15.875 -13.013
71 HZ3 LYS 9 HZ3 LYS 9 14.506 -15.260 -12.466
72 H PHE 10 HN PHE 10 9.220 -16.164 -17.092
73 HA PHE 10 HA PHE 10 9.299 -18.973 -17.412
74 HB2 PHE 10 HB2 PHE 10 7.662 -17.752 -15.977
75 HB3 PHE 10 HB1 PHE 10 6.907 -17.105 -17.429
76 HD1 PHE 10 HD2 PHE 10 7.659 -20.247 -15.620
77 HD2 PHE 10 HD1 PHE 10 5.259 -18.332 -18.575
78 HE1 PHE 10 HE2 PHE 10 6.196 -22.221 -15.714
79 HE2 PHE 10 HE1 PHE 10 3.802 -20.307 -18.676
80 HZ PHE 10 HZ PHE 10 4.263 -22.248 -17.247
81 H LYS 11 HN LYS 11 8.576 -20.245 -19.105
82 HA LYS 11 HA LYS 11 8.917 -19.099 -21.715
83 HB2 LYS 11 HB2 LYS 11 8.163 -21.921 -20.899
84 HB3 LYS 11 HB1 LYS 11 8.672 -21.417 -22.507
85 HG2 LYS 11 HG2 LYS 11 10.867 -20.802 -21.640
86 HG3 LYS 11 HG1 LYS 11 10.360 -21.257 -20.012
87 HD2 LYS 11 HD2 LYS 11 10.003 -23.577 -20.806
88 HD3 LYS 11 HD1 LYS 11 10.605 -23.099 -22.397
89 HE2 LYS 11 HE2 LYS 11 12.333 -24.205 -21.028
90 HE3 LYS 11 HE1 LYS 11 12.766 -22.548 -21.451
91 HZ1 LYS 11 HZ1 LYS 11 13.238 -23.097 -19.125
92 HZ2 LYS 11 HZ2 LYS 11 11.593 -23.379 -18.848
93 HZ3 LYS 11 HZ3 LYS 11 12.130 -21.828 -19.263
94 H GLY 12 HN GLY 12 7.321 -17.987 -22.618
95 HA2 GLY 12 HA2 GLY 12 5.316 -18.045 -23.911
96 HA3 GLY 12 HA1 GLY 12 4.662 -19.238 -22.797
97 HA PRO 13 HA PRO 13 3.197 -14.875 -21.700
98 HB2 PRO 13 HB2 PRO 13 0.658 -14.970 -22.568
99 HB3 PRO 13 HB1 PRO 13 1.993 -14.623 -23.678
100 HG2 PRO 13 HG2 PRO 13 0.565 -17.226 -23.198
101 HG3 PRO 13 HG1 PRO 13 0.988 -16.457 -24.740
102 HD2 PRO 13 HD2 PRO 13 2.484 -18.442 -23.617
103 HD3 PRO 13 HD1 PRO 13 3.182 -17.168 -24.639
104 H CYS 14 HN CYS 14 3.507 -17.144 -20.046
105 HA CYS 14 HA CYS 14 2.819 -18.059 -18.094
106 HB2 CYS 14 HB2 CYS 14 2.346 -15.717 -17.457
107 HB3 CYS 14 HB1 CYS 14 0.725 -15.862 -18.130
108 H ALA 15 HN ALA 15 2.047 -20.027 -18.391
109 HA ALA 15 HA ALA 15 -0.556 -20.442 -19.653
110 HB1 ALA 15 HB1 ALA 15 0.069 -22.817 -19.670
111 HB2 ALA 15 HB2 ALA 15 1.550 -22.433 -18.790
112 HB3 ALA 15 HB3 ALA 15 1.306 -21.812 -20.422
113 H SER 16 HN SER 16 1.154 -21.470 -16.699
114 HA SER 16 HA SER 16 -1.462 -21.787 -15.387
115 HB2 SER 16 HB2 SER 16 1.049 -23.392 -14.868
116 HB3 SER 16 HB1 SER 16 -0.519 -23.629 -14.097
117 HG SER 16 HG SER 16 0.066 -25.016 -15.974
118 H ASP 17 HN ASP 17 -1.804 -20.508 -13.753
119 HA ASP 17 HA ASP 17 -0.225 -18.492 -12.800
120 HB2 ASP 17 HB2 ASP 17 -2.653 -18.751 -12.361
121 HB3 ASP 17 HB1 ASP 17 -2.301 -20.044 -11.221
122 H HIS 18 HN HIS 18 -0.749 -21.583 -11.114
123 HA HIS 18 HA HIS 18 0.989 -21.190 -8.991
124 HB2 HIS 18 HB2 HIS 18 -0.636 -23.064 -9.142
125 HB3 HIS 18 HB1 HIS 18 0.397 -23.824 -10.354
126 HD1 HIS 18 HD1 HIS 18 1.347 -25.809 -9.205
127 HD2 HIS 18 HD2 HIS 18 1.516 -22.407 -6.820
128 HE1 HIS 18 HE1 HIS 18 2.651 -26.480 -7.163
129 HE2 HIS 18 HE2 HIS 18 2.841 -24.377 -5.791
130 H ASN 19 HN ASN 19 1.657 -22.469 -12.216
131 HA ASN 19 HA ASN 19 4.240 -23.435 -11.565
132 HB2 ASN 19 HB2 ASN 19 2.926 -22.868 -14.222
133 HB3 ASN 19 HB1 ASN 19 4.553 -23.531 -14.084
134 HD21 ASN 19 HD21 ASN 19 4.826 -25.642 -13.346
135 HD22 ASN 19 HD22 ASN 19 3.510 -26.759 -13.264
136 H CYS 20 HN CYS 20 3.134 -20.464 -13.211
137 HA CYS 20 HA CYS 20 5.742 -19.429 -13.616
138 HB2 CYS 20 HB2 CYS 20 3.598 -18.578 -14.704
139 HB3 CYS 20 HB1 CYS 20 3.263 -17.742 -13.189
140 H ALA 21 HN ALA 21 3.415 -19.128 -10.994
141 HA ALA 21 HA ALA 21 4.786 -17.310 -9.365
142 HB1 ALA 21 HB1 ALA 21 2.960 -19.574 -8.533
143 HB2 ALA 21 HB2 ALA 21 2.448 -17.950 -8.991
144 HB3 ALA 21 HB3 ALA 21 3.413 -18.191 -7.535
145 H SER 22 HN SER 22 4.863 -20.872 -9.415
146 HA SER 22 HA SER 22 6.612 -21.190 -7.240
147 HB2 SER 22 HB2 SER 22 5.182 -23.004 -8.229
148 HB3 SER 22 HB1 SER 22 6.299 -23.085 -9.591
149 HG SER 22 HG SER 22 7.208 -23.355 -6.926
150 H VAL 23 HN VAL 23 7.220 -20.951 -10.734
151 HA VAL 23 HA VAL 23 9.991 -21.290 -10.736
152 HB VAL 23 HB VAL 23 8.150 -19.663 -12.501
153 HG11 VAL 23 HG11 VAL 23 11.125 -20.092 -12.897
154 HG12 VAL 23 HG12 VAL 23 10.335 -18.551 -12.561
155 HG13 VAL 23 HG13 VAL 23 10.028 -19.383 -14.086
156 HG21 VAL 23 HG21 VAL 23 7.949 -22.093 -12.647
157 HG22 VAL 23 HG22 VAL 23 9.678 -22.230 -12.972
158 HG23 VAL 23 HG23 VAL 23 8.623 -21.430 -14.137
159 H CYS 24 HN CYS 24 8.110 -18.283 -10.477
160 HA CYS 24 HA CYS 24 10.228 -16.509 -10.071
161 HB2 CYS 24 HB2 CYS 24 7.858 -15.887 -10.559
162 HB3 CYS 24 HB1 CYS 24 7.436 -16.325 -8.905
163 H GLN 25 HN GLN 25 8.543 -18.637 -7.861
164 HA GLN 25 HA GLN 25 9.688 -17.547 -5.465
165 HB2 GLN 25 HB2 GLN 25 8.165 -20.101 -6.016
166 HB3 GLN 25 HB1 GLN 25 8.718 -19.633 -4.414
167 HG2 GLN 25 HG2 GLN 25 7.306 -17.716 -4.399
168 HG3 GLN 25 HG1 GLN 25 6.895 -17.932 -6.100
169 HE21 GLN 25 HE21 GLN 25 4.692 -18.016 -5.636
170 HE22 GLN 25 HE22 GLN 25 3.956 -19.395 -4.900
171 H THR 26 HN THR 26 10.548 -20.096 -7.713
172 HA THR 26 HA THR 26 12.448 -21.317 -5.942
173 HB THR 26 HB THR 26 13.206 -22.558 -8.009
174 HG1 THR 26 HG1 THR 26 12.105 -20.686 -9.336
175 HG21 THR 26 HG21 THR 26 11.169 -23.916 -8.179
176 HG22 THR 26 HG22 THR 26 10.258 -22.647 -7.363
177 HG23 THR 26 HG23 THR 26 11.536 -23.506 -6.504
178 H GLU 27 HN GLU 27 12.557 -18.893 -8.507
179 HA GLU 27 HA GLU 27 15.442 -18.783 -8.478
180 HB2 GLU 27 HB2 GLU 27 15.202 -16.791 -9.904
181 HB3 GLU 27 HB1 GLU 27 14.277 -18.155 -10.508
182 HG2 GLU 27 HG2 GLU 27 12.224 -17.186 -9.703
183 HG3 GLU 27 HG1 GLU 27 13.109 -15.872 -8.929
184 H ARG 28 HN ARG 28 12.861 -16.664 -7.208
185 HA ARG 28 HA ARG 28 14.686 -15.778 -5.097
186 HB2 ARG 28 HB2 ARG 28 13.244 -13.909 -6.987
187 HB3 ARG 28 HB1 ARG 28 13.833 -13.399 -5.412
188 HG2 ARG 28 HG2 ARG 28 16.129 -14.252 -6.227
189 HG3 ARG 28 HG1 ARG 28 15.406 -14.209 -7.837
190 HD2 ARG 28 HD2 ARG 28 16.632 -12.129 -7.291
191 HD3 ARG 28 HD1 ARG 28 14.917 -11.844 -7.593
192 HE ARG 28 HE ARG 28 14.704 -11.893 -5.069
193 HH11 ARG 28 HH11 ARG 28 17.596 -10.741 -6.683
194 HH12 ARG 28 HH12 ARG 28 18.129 -9.816 -5.315
195 HH21 ARG 28 HH21 ARG 28 15.393 -10.658 -3.300
196 HH22 ARG 28 HH22 ARG 28 16.867 -9.745 -3.405
197 H PHE 29 HN PHE 29 13.210 -14.030 -3.749
198 HA PHE 29 HA PHE 29 10.748 -15.509 -3.104
199 HB2 PHE 29 HB2 PHE 29 12.392 -13.614 -1.398
200 HB3 PHE 29 HB1 PHE 29 10.894 -14.389 -0.887
201 HD1 PHE 29 HD2 PHE 29 10.812 -16.879 -0.665
202 HD2 PHE 29 HD1 PHE 29 14.463 -14.781 -1.315
203 HE1 PHE 29 HE2 PHE 29 12.081 -18.850 0.097
204 HE2 PHE 29 HE1 PHE 29 15.731 -16.749 -0.564
205 HZ PHE 29 HZ PHE 29 14.543 -18.785 0.144
206 H SER 30 HN SER 30 9.218 -14.686 -4.310
207 HA SER 30 HA SER 30 8.260 -12.038 -3.867
208 HB2 SER 30 HB2 SER 30 10.118 -11.706 -5.574
209 HB3 SER 30 HB1 SER 30 9.179 -12.702 -6.686
210 HG SER 30 HG SER 30 8.931 -10.283 -6.714
211 H GLY 31 HN GLY 31 6.183 -12.475 -3.658
212 HA2 GLY 31 HA2 GLY 31 4.945 -14.877 -4.465
213 HA3 GLY 31 HA1 GLY 31 4.105 -13.437 -3.905
214 H GLY 32 HN GLY 32 4.103 -15.499 -6.378
215 HA2 GLY 32 HA2 GLY 32 3.882 -13.414 -8.464
216 HA3 GLY 32 HA1 GLY 32 4.438 -15.054 -8.760
217 H ARG 33 HN ARG 33 2.270 -13.533 -9.984
218 HA ARG 33 HA ARG 33 0.190 -15.569 -9.755
219 HB2 ARG 33 HB2 ARG 33 -0.237 -12.613 -9.305
220 HB3 ARG 33 HB1 ARG 33 -1.536 -13.639 -9.898
221 HG2 ARG 33 HG2 ARG 33 -0.073 -13.955 -7.276
222 HG3 ARG 33 HG1 ARG 33 -1.705 -13.322 -7.503
223 HD2 ARG 33 HD2 ARG 33 -2.255 -15.556 -8.595
224 HD3 ARG 33 HD1 ARG 33 -0.717 -16.130 -7.950
225 HE ARG 33 HE ARG 33 -2.343 -14.928 -5.935
226 HH11 ARG 33 HH11 ARG 33 -1.839 -17.881 -7.760
227 HH12 ARG 33 HH12 ARG 33 -2.606 -18.892 -6.573
228 HH21 ARG 33 HH21 ARG 33 -3.379 -16.260 -4.377
229 HH22 ARG 33 HH22 ARG 33 -3.511 -17.968 -4.672
230 H CYS 34 HN CYS 34 -1.456 -15.240 -11.545
231 HA CYS 34 HA CYS 34 -0.070 -14.322 -13.986
232 HB2 CYS 34 HB2 CYS 34 -0.578 -16.838 -13.639
233 HB3 CYS 34 HB1 CYS 34 -2.260 -16.406 -13.920
234 H ARG 35 HN ARG 35 -0.865 -12.359 -14.385
235 HA ARG 35 HA ARG 35 -3.705 -11.945 -14.788
236 HB2 ARG 35 HB2 ARG 35 -3.420 -11.567 -12.343
237 HB3 ARG 35 HB1 ARG 35 -2.189 -10.363 -12.684
238 HG2 ARG 35 HG2 ARG 35 -4.121 -9.136 -12.206
239 HG3 ARG 35 HG1 ARG 35 -3.992 -9.098 -13.964
240 HD2 ARG 35 HD2 ARG 35 -5.752 -10.996 -12.406
241 HD3 ARG 35 HD1 ARG 35 -6.302 -9.487 -13.128
242 HE ARG 35 HE ARG 35 -5.227 -11.740 -14.713
243 HH11 ARG 35 HH11 ARG 35 -7.583 -9.195 -14.216
244 HH12 ARG 35 HH12 ARG 35 -8.461 -9.558 -15.669
245 HH21 ARG 35 HH21 ARG 35 -6.369 -12.200 -16.625
246 HH22 ARG 35 HH22 ARG 35 -7.759 -11.248 -17.049
247 H GLY 36 HN GLY 36 -4.115 -9.862 -15.843
248 HA2 GLY 36 HA2 GLY 36 -2.397 -7.859 -16.470
249 HA3 GLY 36 HA1 GLY 36 -1.944 -9.127 -17.604
250 H PHE 37 HN PHE 37 -2.628 -7.851 -19.379
251 HA PHE 37 HA PHE 37 -5.255 -6.872 -19.710
252 HB2 PHE 37 HB2 PHE 37 -3.261 -7.799 -21.806
253 HB3 PHE 37 HB1 PHE 37 -4.731 -6.896 -22.150
254 HD1 PHE 37 HD2 PHE 37 -4.955 -4.546 -21.290
255 HD2 PHE 37 HD1 PHE 37 -1.285 -6.705 -21.116
256 HE1 PHE 37 HE2 PHE 37 -3.733 -2.434 -20.977
257 HE2 PHE 37 HE1 PHE 37 -0.057 -4.595 -20.804
258 HZ PHE 37 HZ PHE 37 -1.283 -2.461 -20.735
259 H ARG 38 HN ARG 38 -3.749 -9.776 -21.108
260 HA ARG 38 HA ARG 38 -6.327 -11.172 -20.915
261 HB2 ARG 38 HB2 ARG 38 -5.561 -10.817 -23.221
262 HB3 ARG 38 HB1 ARG 38 -4.009 -11.547 -22.830
263 HG2 ARG 38 HG2 ARG 38 -5.209 -13.178 -23.954
264 HG3 ARG 38 HG1 ARG 38 -5.283 -13.648 -22.263
265 HD2 ARG 38 HD2 ARG 38 -7.464 -13.953 -23.223
266 HD3 ARG 38 HD1 ARG 38 -7.530 -12.575 -22.122
267 HE ARG 38 HE ARG 38 -7.002 -11.858 -24.863
268 HH11 ARG 38 HH11 ARG 38 -9.512 -12.498 -22.504
269 HH12 ARG 38 HH12 ARG 38 -10.723 -11.605 -23.365
270 HH21 ARG 38 HH21 ARG 38 -8.595 -10.697 -26.005
271 HH22 ARG 38 HH22 ARG 38 -10.202 -10.583 -25.362
272 H ARG 39 HN ARG 39 -2.825 -11.834 -21.102
273 HA ARG 39 HA ARG 39 -2.895 -13.402 -18.663
274 HB2 ARG 39 HB2 ARG 39 -2.466 -14.618 -21.380
275 HB3 ARG 39 HB1 ARG 39 -1.632 -15.293 -19.988
276 HG2 ARG 39 HG2 ARG 39 -3.702 -15.827 -18.914
277 HG3 ARG 39 HG1 ARG 39 -4.622 -14.948 -20.136
278 HD2 ARG 39 HD2 ARG 39 -4.650 -17.429 -20.416
279 HD3 ARG 39 HD1 ARG 39 -4.053 -16.545 -21.821
280 HE ARG 39 HE ARG 39 -1.902 -17.324 -20.131
281 HH11 ARG 39 HH11 ARG 39 -4.226 -18.683 -22.380
282 HH12 ARG 39 HH12 ARG 39 -3.133 -19.893 -22.972
283 HH21 ARG 39 HH21 ARG 39 -0.488 -18.935 -20.876
284 HH22 ARG 39 HH22 ARG 39 -1.011 -20.057 -22.096
285 H ARG 40 HN ARG 40 -1.314 -12.447 -17.610
286 HA ARG 40 HA ARG 40 1.389 -12.573 -18.711
287 HB2 ARG 40 HB2 ARG 40 0.037 -10.075 -17.836
288 HB3 ARG 40 HB1 ARG 40 1.732 -10.305 -17.404
289 HG2 ARG 40 HG2 ARG 40 2.053 -10.904 -19.896
290 HG3 ARG 40 HG1 ARG 40 0.511 -10.109 -20.115
291 HD2 ARG 40 HD2 ARG 40 2.923 -8.930 -18.844
292 HD3 ARG 40 HD1 ARG 40 2.372 -8.598 -20.484
293 HE ARG 40 HE ARG 40 0.340 -8.017 -18.582
294 HH11 ARG 40 HH11 ARG 40 3.316 -6.734 -19.914
295 HH12 ARG 40 HH12 ARG 40 2.924 -5.092 -19.523
296 HH21 ARG 40 HH21 ARG 40 -0.159 -5.840 -18.061
297 HH22 ARG 40 HH22 ARG 40 0.969 -4.590 -18.468
298 H CYS 41 HN CYS 41 2.932 -11.938 -16.799
299 HA CYS 41 HA CYS 41 1.930 -13.267 -14.363
300 HB2 CYS 41 HB2 CYS 41 3.295 -14.794 -15.869
301 HB3 CYS 41 HB1 CYS 41 4.673 -13.746 -15.560
302 H PHE 42 HN PHE 42 2.514 -12.293 -12.489
303 HA PHE 42 HA PHE 42 4.568 -10.190 -12.565
304 HB2 PHE 42 HB2 PHE 42 1.721 -9.875 -11.574
305 HB3 PHE 42 HB1 PHE 42 3.016 -8.771 -11.125
306 HD1 PHE 42 HD2 PHE 42 0.904 -9.960 -13.895
307 HD2 PHE 42 HD1 PHE 42 3.868 -7.152 -12.677
308 HE1 PHE 42 HE2 PHE 42 0.501 -8.646 -15.934
309 HE2 PHE 42 HE1 PHE 42 3.465 -5.835 -14.714
310 HZ PHE 42 HZ PHE 42 1.781 -6.582 -16.346
311 H CYS 43 HN CYS 43 5.725 -9.944 -10.701
312 HA CYS 43 HA CYS 43 5.078 -11.784 -8.477
313 HB2 CYS 43 HB2 CYS 43 7.791 -10.857 -9.467
314 HB3 CYS 43 HB1 CYS 43 7.534 -11.812 -8.009
315 H THR 44 HN THR 44 5.520 -11.050 -6.339
316 HA THR 44 HA THR 44 5.704 -8.129 -6.040
317 HB THR 44 HB THR 44 3.903 -8.307 -4.264
318 HG1 THR 44 HG1 THR 44 3.532 -10.853 -5.506
319 HG21 THR 44 HG21 THR 44 3.394 -7.369 -6.461
320 HG22 THR 44 HG22 THR 44 2.032 -8.324 -5.875
321 HG23 THR 44 HG23 THR 44 3.108 -8.987 -7.105
322 H THR 45 HN THR 45 7.057 -7.506 -4.498
323 HA THR 45 HA THR 45 7.532 -9.193 -2.155
324 HB THR 45 HB THR 45 9.354 -9.747 -3.752
325 HG1 THR 45 HG1 THR 45 10.615 -9.881 -2.068
326 HG21 THR 45 HG21 THR 45 11.036 -8.071 -4.330
327 HG22 THR 45 HG22 THR 45 10.096 -6.826 -3.508
328 HG23 THR 45 HG23 THR 45 9.453 -7.605 -4.955
329 H HIS 46 HN HIS 46 8.833 -7.881 -0.482
330 HA HIS 46 HA HIS 46 7.414 -5.353 -0.252
331 HB2 HIS 46 HB2 HIS 46 7.370 -6.827 1.680
332 HB3 HIS 46 HB1 HIS 46 9.129 -6.872 1.733
333 HD1 HIS 46 HD1 HIS 46 6.225 -4.558 2.397
334 HD2 HIS 46 HD2 HIS 46 10.326 -4.748 3.058
335 HE1 HIS 46 HE1 HIS 46 6.751 -2.637 3.926
336 HE2 HIS 46 HE2 HIS 46 9.265 -2.631 4.097
337 H CYS 47 HN CYS 47 8.293 -3.367 -0.236
338 HA CYS 47 HA CYS 47 11.206 -3.116 -0.555
339 HB2 CYS 47 HB2 CYS 47 8.930 -1.368 -1.487
340 HB3 CYS 47 HB1 CYS 47 10.573 -0.744 -1.356
Start of MODEL 6
1 H1 ARG 1 HT1 ARG 1 6.793 0.885 1.624
2 H2 ARG 1 HT2 ARG 1 7.345 0.374 0.111
3 H3 ARG 1 HT3 ARG 1 7.655 -0.561 1.484
4 HA ARG 1 HA ARG 1 5.313 -0.997 1.767
5 HB2 ARG 1 HB2 ARG 1 5.031 0.514 -0.848
6 HB3 ARG 1 HB1 ARG 1 3.741 -0.352 -0.026
7 HG2 ARG 1 HG2 ARG 1 5.186 2.091 0.992
8 HG3 ARG 1 HG1 ARG 1 3.545 2.028 0.350
9 HD2 ARG 1 HD2 ARG 1 3.042 0.373 2.223
10 HD3 ARG 1 HD1 ARG 1 4.590 0.853 2.921
11 HE ARG 1 HE ARG 1 2.246 2.592 2.540
12 HH11 ARG 1 HH11 ARG 1 5.369 2.019 4.036
13 HH12 ARG 1 HH12 ARG 1 5.229 3.369 5.119
14 HH21 ARG 1 HH21 ARG 1 2.076 4.365 3.956
15 HH22 ARG 1 HH22 ARG 1 3.362 4.699 5.071
16 H THR 2 HN THR 2 3.986 -2.374 -0.025
17 HA THR 2 HA THR 2 5.825 -4.350 -1.030
18 HB THR 2 HB THR 2 2.817 -4.144 -1.400
19 HG1 THR 2 HG1 THR 2 2.744 -5.570 0.388
20 HG21 THR 2 HG21 THR 2 3.877 -5.675 -3.004
21 HG22 THR 2 HG22 THR 2 2.914 -6.559 -1.820
22 HG23 THR 2 HG23 THR 2 4.672 -6.523 -1.678
23 H CYS 3 HN CYS 3 6.530 -4.593 -3.084
24 HA CYS 3 HA CYS 3 5.519 -2.739 -5.155
25 HB2 CYS 3 HB2 CYS 3 8.317 -3.882 -4.884
26 HB3 CYS 3 HB1 CYS 3 7.776 -2.716 -6.089
27 H GLU 4 HN GLU 4 5.625 -3.576 -7.376
28 HA GLU 4 HA GLU 4 5.648 -6.522 -7.489
29 HB2 GLU 4 HB2 GLU 4 3.803 -6.534 -9.033
30 HB3 GLU 4 HB1 GLU 4 3.322 -5.628 -7.607
31 HG2 GLU 4 HG2 GLU 4 4.274 -4.358 -10.172
32 HG3 GLU 4 HG1 GLU 4 2.582 -4.650 -9.781
33 H SER 5 HN SER 5 6.000 -7.377 -9.654
34 HA SER 5 HA SER 5 7.427 -5.663 -11.530
35 HB2 SER 5 HB2 SER 5 9.289 -7.364 -11.642
36 HB3 SER 5 HB1 SER 5 9.224 -6.481 -10.117
37 HG SER 5 HG SER 5 9.434 -8.606 -9.583
38 H GLN 6 HN GLN 6 8.089 -7.213 -13.471
39 HA GLN 6 HA GLN 6 5.692 -8.830 -14.066
40 HB2 GLN 6 HB2 GLN 6 5.845 -6.748 -15.390
41 HB3 GLN 6 HB1 GLN 6 7.440 -7.226 -15.958
42 HG2 GLN 6 HG2 GLN 6 6.449 -9.172 -17.081
43 HG3 GLN 6 HG1 GLN 6 4.853 -8.672 -16.521
44 HE21 GLN 6 HE21 GLN 6 5.862 -9.011 -19.246
45 HE22 GLN 6 HE22 GLN 6 5.632 -7.489 -20.033
46 H SER 7 HN SER 7 5.985 -10.796 -15.131
47 HA SER 7 HA SER 7 8.764 -11.783 -15.148
48 HB2 SER 7 HB2 SER 7 7.317 -12.845 -13.425
49 HB3 SER 7 HB1 SER 7 6.228 -13.383 -14.703
50 HG SER 7 HG SER 7 7.804 -14.960 -14.009
51 H HIS 8 HN HIS 8 9.413 -11.689 -17.173
52 HA HIS 8 HA HIS 8 7.782 -13.049 -19.218
53 HB2 HIS 8 HB2 HIS 8 9.461 -11.863 -20.827
54 HB3 HIS 8 HB1 HIS 8 8.134 -10.940 -20.139
55 HD1 HIS 8 HD1 HIS 8 8.799 -8.743 -19.297
56 HD2 HIS 8 HD2 HIS 8 11.961 -11.437 -19.144
57 HE1 HIS 8 HE1 HIS 8 10.751 -7.440 -18.405
58 HE2 HIS 8 HE2 HIS 8 12.697 -9.028 -18.540
59 H LYS 9 HN LYS 9 9.930 -13.755 -17.041
60 HA LYS 9 HA LYS 9 11.847 -15.267 -18.555
61 HB2 LYS 9 HB2 LYS 9 11.943 -14.390 -16.064
62 HB3 LYS 9 HB1 LYS 9 11.119 -15.899 -15.697
63 HG2 LYS 9 HG2 LYS 9 13.780 -15.669 -17.109
64 HG3 LYS 9 HG1 LYS 9 13.568 -16.014 -15.392
65 HD2 LYS 9 HD2 LYS 9 12.333 -18.073 -15.986
66 HD3 LYS 9 HD1 LYS 9 12.615 -17.734 -17.696
67 HE2 LYS 9 HE2 LYS 9 14.220 -19.368 -16.854
68 HE3 LYS 9 HE1 LYS 9 15.032 -17.877 -17.328
69 HZ1 LYS 9 HZ1 LYS 9 15.746 -18.889 -15.163
70 HZ2 LYS 9 HZ2 LYS 9 14.240 -18.443 -14.536
71 HZ3 LYS 9 HZ3 LYS 9 15.305 -17.257 -15.093
72 H PHE 10 HN PHE 10 8.842 -15.918 -16.800
73 HA PHE 10 HA PHE 10 8.581 -18.642 -17.424
74 HB2 PHE 10 HB2 PHE 10 7.192 -17.468 -15.741
75 HB3 PHE 10 HB1 PHE 10 6.394 -16.574 -17.032
76 HD1 PHE 10 HD2 PHE 10 6.998 -20.013 -15.762
77 HD2 PHE 10 HD1 PHE 10 4.486 -17.460 -18.073
78 HE1 PHE 10 HE2 PHE 10 5.347 -21.820 -15.952
79 HE2 PHE 10 HE1 PHE 10 2.827 -19.269 -18.263
80 HZ PHE 10 HZ PHE 10 3.252 -21.447 -17.206
81 H LYS 11 HN LYS 11 7.960 -19.683 -19.236
82 HA LYS 11 HA LYS 11 7.213 -18.039 -21.565
83 HB2 LYS 11 HB2 LYS 11 9.033 -20.459 -21.472
84 HB3 LYS 11 HB1 LYS 11 8.485 -19.681 -22.952
85 HG2 LYS 11 HG2 LYS 11 9.631 -17.625 -22.317
86 HG3 LYS 11 HG1 LYS 11 10.140 -18.363 -20.800
87 HD2 LYS 11 HD2 LYS 11 12.003 -18.461 -22.284
88 HD3 LYS 11 HD1 LYS 11 11.362 -20.097 -22.156
89 HE2 LYS 11 HE2 LYS 11 10.714 -18.195 -24.415
90 HE3 LYS 11 HE1 LYS 11 12.002 -19.393 -24.478
91 HZ1 LYS 11 HZ1 LYS 11 10.124 -20.312 -25.541
92 HZ2 LYS 11 HZ2 LYS 11 9.088 -19.887 -24.280
93 HZ3 LYS 11 HZ3 LYS 11 10.246 -21.098 -24.048
94 H GLY 12 HN GLY 12 5.601 -18.784 -22.866
95 HA2 GLY 12 HA2 GLY 12 4.320 -20.646 -23.777
96 HA3 GLY 12 HA1 GLY 12 4.393 -21.395 -22.188
97 HA PRO 13 HA PRO 13 0.344 -19.202 -22.344
98 HB2 PRO 13 HB2 PRO 13 -1.177 -21.261 -21.503
99 HB3 PRO 13 HB1 PRO 13 -0.670 -21.112 -23.190
100 HG2 PRO 13 HG2 PRO 13 0.472 -22.832 -21.014
101 HG3 PRO 13 HG1 PRO 13 0.151 -23.239 -22.711
102 HD2 PRO 13 HD2 PRO 13 2.628 -22.553 -21.747
103 HD3 PRO 13 HD1 PRO 13 2.123 -22.308 -23.431
104 H CYS 14 HN CYS 14 0.266 -17.857 -20.627
105 HA CYS 14 HA CYS 14 1.043 -18.743 -17.995
106 HB2 CYS 14 HB2 CYS 14 1.594 -16.455 -18.937
107 HB3 CYS 14 HB1 CYS 14 -0.106 -16.042 -18.741
108 H ALA 15 HN ALA 15 -0.733 -20.387 -18.162
109 HA ALA 15 HA ALA 15 -3.279 -19.290 -17.139
110 HB1 ALA 15 HB1 ALA 15 -2.712 -22.047 -18.251
111 HB2 ALA 15 HB2 ALA 15 -3.500 -20.728 -19.119
112 HB3 ALA 15 HB3 ALA 15 -4.279 -21.442 -17.707
113 H SER 16 HN SER 16 -0.750 -21.697 -16.570
114 HA SER 16 HA SER 16 -1.743 -22.377 -13.966
115 HB2 SER 16 HB2 SER 16 0.954 -22.990 -15.210
116 HB3 SER 16 HB1 SER 16 0.230 -23.791 -13.813
117 HG SER 16 HG SER 16 -1.333 -24.671 -15.130
118 H ASP 17 HN ASP 17 -1.875 -20.270 -13.059
119 HA ASP 17 HA ASP 17 0.228 -18.461 -12.774
120 HB2 ASP 17 HB2 ASP 17 -1.023 -17.559 -10.854
121 HB3 ASP 17 HB1 ASP 17 -2.058 -17.808 -12.253
122 H HIS 18 HN HIS 18 -0.658 -21.296 -10.919
123 HA HIS 18 HA HIS 18 1.078 -20.826 -8.739
124 HB2 HIS 18 HB2 HIS 18 -0.834 -22.543 -8.876
125 HB3 HIS 18 HB1 HIS 18 0.299 -23.558 -9.772
126 HD1 HIS 18 HD1 HIS 18 -0.680 -22.623 -6.360
127 HD2 HIS 18 HD2 HIS 18 2.600 -24.395 -8.204
128 HE1 HIS 18 HE1 HIS 18 0.618 -23.727 -4.514
129 HE2 HIS 18 HE2 HIS 18 2.638 -24.723 -5.639
130 H ASN 19 HN ASN 19 1.431 -22.343 -11.875
131 HA ASN 19 HA ASN 19 3.971 -23.508 -11.473
132 HB2 ASN 19 HB2 ASN 19 2.388 -24.043 -13.385
133 HB3 ASN 19 HB1 ASN 19 2.848 -22.507 -14.107
134 HD21 ASN 19 HD21 ASN 19 3.674 -23.552 -15.935
135 HD22 ASN 19 HD22 ASN 19 5.180 -24.404 -15.902
136 H CYS 20 HN CYS 20 2.983 -20.445 -13.020
137 HA CYS 20 HA CYS 20 5.615 -19.488 -13.410
138 HB2 CYS 20 HB2 CYS 20 3.623 -18.461 -14.484
139 HB3 CYS 20 HB1 CYS 20 3.137 -17.812 -12.919
140 H ALA 21 HN ALA 21 3.416 -19.266 -10.669
141 HA ALA 21 HA ALA 21 4.916 -17.518 -9.066
142 HB1 ALA 21 HB1 ALA 21 3.611 -18.393 -7.189
143 HB2 ALA 21 HB2 ALA 21 3.058 -19.737 -8.188
144 HB3 ALA 21 HB3 ALA 21 2.578 -18.088 -8.586
145 H SER 22 HN SER 22 4.861 -21.062 -9.219
146 HA SER 22 HA SER 22 6.707 -21.623 -7.220
147 HB2 SER 22 HB2 SER 22 5.289 -23.314 -8.401
148 HB3 SER 22 HB1 SER 22 6.316 -23.142 -9.822
149 HG SER 22 HG SER 22 7.000 -24.165 -7.266
150 H VAL 23 HN VAL 23 7.226 -21.202 -10.705
151 HA VAL 23 HA VAL 23 9.985 -21.392 -10.816
152 HB VAL 23 HB VAL 23 7.976 -19.846 -12.453
153 HG11 VAL 23 HG11 VAL 23 10.953 -20.048 -12.990
154 HG12 VAL 23 HG12 VAL 23 10.061 -18.576 -12.610
155 HG13 VAL 23 HG13 VAL 23 9.754 -19.423 -14.126
156 HG21 VAL 23 HG21 VAL 23 8.474 -21.551 -14.145
157 HG22 VAL 23 HG22 VAL 23 7.938 -22.282 -12.631
158 HG23 VAL 23 HG23 VAL 23 9.652 -22.290 -13.056
159 H CYS 24 HN CYS 24 8.023 -18.444 -10.414
160 HA CYS 24 HA CYS 24 10.138 -16.632 -10.169
161 HB2 CYS 24 HB2 CYS 24 7.762 -16.005 -10.587
162 HB3 CYS 24 HB1 CYS 24 7.382 -16.413 -8.919
163 H GLN 25 HN GLN 25 8.554 -18.680 -7.800
164 HA GLN 25 HA GLN 25 9.800 -17.459 -5.516
165 HB2 GLN 25 HB2 GLN 25 8.281 -20.058 -5.827
166 HB3 GLN 25 HB1 GLN 25 8.867 -19.442 -4.289
167 HG2 GLN 25 HG2 GLN 25 7.435 -17.513 -4.460
168 HG3 GLN 25 HG1 GLN 25 6.927 -17.988 -6.080
169 HE21 GLN 25 HE21 GLN 25 4.766 -18.117 -5.537
170 HE22 GLN 25 HE22 GLN 25 4.128 -19.369 -4.533
171 H THR 26 HN THR 26 10.553 -20.154 -7.651
172 HA THR 26 HA THR 26 12.603 -21.212 -5.934
173 HB THR 26 HB THR 26 13.294 -22.536 -7.966
174 HG1 THR 26 HG1 THR 26 12.088 -20.743 -9.327
175 HG21 THR 26 HG21 THR 26 11.675 -23.429 -6.345
176 HG22 THR 26 HG22 THR 26 11.310 -23.969 -7.984
177 HG23 THR 26 HG23 THR 26 10.359 -22.678 -7.250
178 H GLU 27 HN GLU 27 12.393 -18.834 -8.478
179 HA GLU 27 HA GLU 27 15.259 -18.587 -8.724
180 HB2 GLU 27 HB2 GLU 27 13.002 -16.898 -9.806
181 HB3 GLU 27 HB1 GLU 27 14.704 -16.580 -10.125
182 HG2 GLU 27 HG2 GLU 27 14.844 -18.924 -11.056
183 HG3 GLU 27 HG1 GLU 27 13.084 -18.973 -10.962
184 H ARG 28 HN ARG 28 12.728 -16.328 -7.515
185 HA ARG 28 HA ARG 28 14.801 -15.149 -5.776
186 HB2 ARG 28 HB2 ARG 28 12.775 -13.608 -7.424
187 HB3 ARG 28 HB1 ARG 28 13.874 -12.899 -6.250
188 HG2 ARG 28 HG2 ARG 28 14.614 -14.250 -8.841
189 HG3 ARG 28 HG1 ARG 28 14.734 -12.530 -8.459
190 HD2 ARG 28 HD2 ARG 28 16.300 -14.771 -7.163
191 HD3 ARG 28 HD1 ARG 28 16.919 -13.602 -8.329
192 HE ARG 28 HE ARG 28 16.080 -11.960 -6.425
193 HH11 ARG 28 HH11 ARG 28 17.912 -14.940 -6.162
194 HH12 ARG 28 HH12 ARG 28 18.741 -14.447 -4.717
195 HH21 ARG 28 HH21 ARG 28 17.186 -11.317 -4.523
196 HH22 ARG 28 HH22 ARG 28 18.343 -12.397 -3.800
197 H PHE 29 HN PHE 29 13.649 -13.489 -4.239
198 HA PHE 29 HA PHE 29 11.398 -14.858 -2.970
199 HB2 PHE 29 HB2 PHE 29 13.175 -12.592 -2.019
200 HB3 PHE 29 HB1 PHE 29 11.802 -13.215 -1.106
201 HD1 PHE 29 HD2 PHE 29 11.812 -15.690 -0.480
202 HD2 PHE 29 HD1 PHE 29 15.281 -13.612 -1.826
203 HE1 PHE 29 HE2 PHE 29 13.236 -17.433 0.507
204 HE2 PHE 29 HE1 PHE 29 16.708 -15.356 -0.842
205 HZ PHE 29 HZ PHE 29 15.686 -17.270 0.328
206 H SER 30 HN SER 30 9.785 -14.391 -4.330
207 HA SER 30 HA SER 30 8.475 -11.893 -4.104
208 HB2 SER 30 HB2 SER 30 8.488 -11.485 -6.633
209 HB3 SER 30 HB1 SER 30 9.990 -11.115 -5.788
210 HG SER 30 HG SER 30 9.447 -13.546 -7.160
211 H GLY 31 HN GLY 31 6.483 -12.540 -3.878
212 HA2 GLY 31 HA2 GLY 31 5.470 -15.088 -4.509
213 HA3 GLY 31 HA1 GLY 31 4.496 -13.676 -4.122
214 H GLY 32 HN GLY 32 3.895 -15.717 -6.102
215 HA2 GLY 32 HA2 GLY 32 4.281 -14.206 -8.619
216 HA3 GLY 32 HA1 GLY 32 4.205 -15.956 -8.525
217 H ARG 33 HN ARG 33 2.630 -13.938 -10.017
218 HA ARG 33 HA ARG 33 0.061 -15.175 -9.684
219 HB2 ARG 33 HB2 ARG 33 -1.149 -12.984 -9.363
220 HB3 ARG 33 HB1 ARG 33 -0.228 -13.518 -7.963
221 HG2 ARG 33 HG2 ARG 33 1.577 -11.963 -8.552
222 HG3 ARG 33 HG1 ARG 33 0.654 -11.431 -9.960
223 HD2 ARG 33 HD2 ARG 33 -1.095 -10.565 -8.531
224 HD3 ARG 33 HD1 ARG 33 -0.284 -11.197 -7.097
225 HE ARG 33 HE ARG 33 1.611 -9.618 -7.946
226 HH11 ARG 33 HH11 ARG 33 -1.835 -8.979 -7.978
227 HH12 ARG 33 HH12 ARG 33 -1.645 -7.259 -7.835
228 HH21 ARG 33 HH21 ARG 33 1.866 -7.367 -7.756
229 HH22 ARG 33 HH22 ARG 33 0.470 -6.337 -7.694
230 H CYS 34 HN CYS 34 -1.183 -14.952 -11.583
231 HA CYS 34 HA CYS 34 0.167 -13.498 -13.774
232 HB2 CYS 34 HB2 CYS 34 0.171 -15.995 -13.977
233 HB3 CYS 34 HB1 CYS 34 -1.589 -15.961 -14.001
234 H ARG 35 HN ARG 35 -0.963 -11.881 -14.677
235 HA ARG 35 HA ARG 35 -3.591 -11.338 -13.583
236 HB2 ARG 35 HB2 ARG 35 -1.728 -9.609 -13.873
237 HB3 ARG 35 HB1 ARG 35 -2.114 -9.630 -15.589
238 HG2 ARG 35 HG2 ARG 35 -3.214 -7.776 -14.417
239 HG3 ARG 35 HG1 ARG 35 -4.385 -8.903 -15.113
240 HD2 ARG 35 HD2 ARG 35 -4.658 -9.967 -12.916
241 HD3 ARG 35 HD1 ARG 35 -3.493 -8.840 -12.224
242 HE ARG 35 HE ARG 35 -5.217 -7.098 -13.070
243 HH11 ARG 35 HH11 ARG 35 -6.003 -10.255 -11.778
244 HH12 ARG 35 HH12 ARG 35 -7.485 -9.728 -11.043
245 HH21 ARG 35 HH21 ARG 35 -7.168 -6.400 -12.115
246 HH22 ARG 35 HH22 ARG 35 -8.145 -7.525 -11.227
247 H GLY 36 HN GLY 36 -5.476 -11.577 -14.583
248 HA2 GLY 36 HA2 GLY 36 -5.447 -13.240 -16.939
249 HA3 GLY 36 HA1 GLY 36 -6.826 -12.856 -15.943
250 H PHE 37 HN PHE 37 -4.612 -11.104 -18.083
251 HA PHE 37 HA PHE 37 -6.898 -9.828 -19.386
252 HB2 PHE 37 HB2 PHE 37 -3.911 -9.508 -19.815
253 HB3 PHE 37 HB1 PHE 37 -5.132 -8.673 -20.762
254 HD1 PHE 37 HD1 PHE 37 -6.943 -7.394 -19.256
255 HD2 PHE 37 HD2 PHE 37 -2.959 -8.337 -18.061
256 HE1 PHE 37 HE1 PHE 37 -7.006 -5.570 -17.610
257 HE2 PHE 37 HE2 PHE 37 -3.026 -6.514 -16.410
258 HZ PHE 37 HZ PHE 37 -5.053 -5.127 -16.183
259 H ARG 38 HN ARG 38 -4.045 -10.839 -21.160
260 HA ARG 38 HA ARG 38 -5.561 -13.002 -22.432
261 HB2 ARG 38 HB2 ARG 38 -4.789 -11.324 -24.000
262 HB3 ARG 38 HB1 ARG 38 -3.164 -11.390 -23.338
263 HG2 ARG 38 HG2 ARG 38 -3.244 -12.515 -25.438
264 HG3 ARG 38 HG1 ARG 38 -2.927 -13.684 -24.167
265 HD2 ARG 38 HD2 ARG 38 -5.685 -13.197 -25.292
266 HD3 ARG 38 HD1 ARG 38 -4.580 -14.397 -25.961
267 HE ARG 38 HE ARG 38 -4.649 -15.060 -23.347
268 HH11 ARG 38 HH11 ARG 38 -7.166 -14.515 -25.712
269 HH12 ARG 38 HH12 ARG 38 -8.302 -15.563 -24.929
270 HH21 ARG 38 HH21 ARG 38 -6.135 -16.487 -22.336
271 HH22 ARG 38 HH22 ARG 38 -7.709 -16.707 -23.034
272 H ARG 39 HN ARG 39 -2.228 -12.152 -21.490
273 HA ARG 39 HA ARG 39 -1.946 -14.167 -19.586
274 HB2 ARG 39 HB2 ARG 39 -0.283 -15.642 -20.729
275 HB3 ARG 39 HB1 ARG 39 -1.915 -15.795 -21.363
276 HG2 ARG 39 HG2 ARG 39 -1.344 -14.516 -23.315
277 HG3 ARG 39 HG1 ARG 39 0.248 -14.139 -22.652
278 HD2 ARG 39 HD2 ARG 39 0.896 -16.469 -22.769
279 HD3 ARG 39 HD1 ARG 39 -0.726 -16.928 -23.289
280 HE ARG 39 HE ARG 39 -0.027 -15.215 -25.211
281 HH11 ARG 39 HH11 ARG 39 1.836 -17.826 -23.779
282 HH12 ARG 39 HH12 ARG 39 2.604 -18.262 -25.270
283 HH21 ARG 39 HH21 ARG 39 0.987 -15.787 -27.165
284 HH22 ARG 39 HH22 ARG 39 2.138 -17.082 -27.193
285 H ARG 40 HN ARG 40 -0.753 -12.974 -18.251
286 HA ARG 40 HA ARG 40 1.956 -12.356 -18.975
287 HB2 ARG 40 HB2 ARG 40 0.686 -10.343 -19.793
288 HB3 ARG 40 HB1 ARG 40 0.187 -10.045 -18.130
289 HG2 ARG 40 HG2 ARG 40 2.264 -9.340 -17.481
290 HG3 ARG 40 HG1 ARG 40 3.101 -10.342 -18.665
291 HD2 ARG 40 HD2 ARG 40 3.334 -8.000 -19.236
292 HD3 ARG 40 HD1 ARG 40 2.373 -8.836 -20.452
293 HE ARG 40 HE ARG 40 0.838 -7.505 -18.386
294 HH11 ARG 40 HH11 ARG 40 2.291 -7.261 -21.565
295 HH12 ARG 40 HH12 ARG 40 1.349 -5.882 -22.033
296 HH21 ARG 40 HH21 ARG 40 -0.447 -5.716 -19.023
297 HH22 ARG 40 HH22 ARG 40 -0.248 -5.036 -20.608
298 H CYS 41 HN CYS 41 3.121 -12.909 -17.288
299 HA CYS 41 HA CYS 41 1.792 -13.280 -14.722
300 HB2 CYS 41 HB2 CYS 41 3.160 -15.096 -15.804
301 HB3 CYS 41 HB1 CYS 41 4.588 -14.108 -15.525
302 H PHE 42 HN PHE 42 2.729 -12.562 -12.768
303 HA PHE 42 HA PHE 42 4.610 -10.335 -12.895
304 HB2 PHE 42 HB2 PHE 42 1.791 -10.181 -11.801
305 HB3 PHE 42 HB1 PHE 42 3.050 -9.044 -11.334
306 HD1 PHE 42 HD2 PHE 42 0.873 -10.167 -14.097
307 HD2 PHE 42 HD1 PHE 42 3.821 -7.340 -12.858
308 HE1 PHE 42 HE2 PHE 42 0.374 -8.778 -16.052
309 HE2 PHE 42 HE1 PHE 42 3.304 -5.946 -14.817
310 HZ PHE 42 HZ PHE 42 1.578 -6.663 -16.419
311 H CYS 43 HN CYS 43 5.636 -9.918 -10.887
312 HA CYS 43 HA CYS 43 5.152 -11.918 -8.773
313 HB2 CYS 43 HB2 CYS 43 7.814 -10.881 -9.783
314 HB3 CYS 43 HB1 CYS 43 7.625 -11.815 -8.304
315 H THR 44 HN THR 44 5.056 -11.130 -6.705
316 HA THR 44 HA THR 44 5.401 -8.235 -6.374
317 HB THR 44 HB THR 44 3.690 -9.856 -4.526
318 HG1 THR 44 HG1 THR 44 2.188 -10.201 -6.000
319 HG21 THR 44 HG21 THR 44 3.455 -7.097 -5.706
320 HG22 THR 44 HG22 THR 44 4.072 -7.486 -4.102
321 HG23 THR 44 HG23 THR 44 2.380 -7.795 -4.495
322 H THR 45 HN THR 45 6.485 -7.490 -4.588
323 HA THR 45 HA THR 45 7.635 -9.351 -2.674
324 HB THR 45 HB THR 45 9.224 -9.377 -4.586
325 HG1 THR 45 HG1 THR 45 10.637 -9.629 -3.049
326 HG21 THR 45 HG21 THR 45 9.569 -6.428 -3.993
327 HG22 THR 45 HG22 THR 45 8.819 -7.105 -5.438
328 HG23 THR 45 HG23 THR 45 10.533 -7.378 -5.125
329 H HIS 46 HN HIS 46 9.337 -7.851 -1.311
330 HA HIS 46 HA HIS 46 7.661 -5.577 -0.434
331 HB2 HIS 46 HB2 HIS 46 7.655 -7.396 1.173
332 HB3 HIS 46 HB1 HIS 46 9.412 -7.467 1.162
333 HD1 HIS 46 HD1 HIS 46 9.389 -7.117 3.741
334 HD2 HIS 46 HD2 HIS 46 7.812 -3.940 1.564
335 HE1 HIS 46 HE1 HIS 46 9.238 -5.194 5.356
336 HE2 HIS 46 HE2 HIS 46 8.141 -3.337 4.056
337 H CYS 47 HN CYS 47 8.559 -3.651 -0.817
338 HA CYS 47 HA CYS 47 11.420 -3.361 -1.178
339 HB2 CYS 47 HB2 CYS 47 9.125 -1.398 -1.367
340 HB3 CYS 47 HB1 CYS 47 10.810 -0.929 -1.569
Start of MODEL 7
1 H1 ARG 1 HT1 ARG 1 5.585 -2.686 2.857
2 H2 ARG 1 HT2 ARG 1 4.217 -2.398 1.912
3 H3 ARG 1 HT3 ARG 1 4.873 -1.149 2.851
4 HA ARG 1 HA ARG 1 5.430 -0.845 0.551
5 HB2 ARG 1 HB2 ARG 1 7.054 -0.351 2.509
6 HB3 ARG 1 HB1 ARG 1 7.934 -1.773 1.967
7 HG2 ARG 1 HG2 ARG 1 8.274 -0.750 -0.219
8 HG3 ARG 1 HG1 ARG 1 7.357 0.668 0.290
9 HD2 ARG 1 HD2 ARG 1 9.683 1.194 0.473
10 HD3 ARG 1 HD1 ARG 1 9.042 1.016 2.104
11 HE ARG 1 HE ARG 1 10.281 -1.351 0.962
12 HH11 ARG 1 HH11 ARG 1 10.722 1.484 2.998
13 HH12 ARG 1 HH12 ARG 1 12.136 0.845 3.775
14 HH21 ARG 1 HH21 ARG 1 12.147 -2.153 1.949
15 HH22 ARG 1 HH22 ARG 1 12.935 -1.230 3.198
16 H THR 2 HN THR 2 4.484 -2.549 -0.668
17 HA THR 2 HA THR 2 6.313 -4.774 -1.319
18 HB THR 2 HB THR 2 3.285 -4.720 -1.510
19 HG1 THR 2 HG1 THR 2 4.951 -6.227 0.247
20 HG21 THR 2 HG21 THR 2 4.283 -6.146 -3.237
21 HG22 THR 2 HG22 THR 2 3.479 -7.124 -2.010
22 HG23 THR 2 HG23 THR 2 5.236 -6.983 -2.010
23 H CYS 3 HN CYS 3 6.886 -5.032 -3.414
24 HA CYS 3 HA CYS 3 5.731 -3.174 -5.395
25 HB2 CYS 3 HB2 CYS 3 8.531 -4.315 -5.189
26 HB3 CYS 3 HB1 CYS 3 7.946 -3.375 -6.558
27 H GLU 4 HN GLU 4 4.950 -3.998 -7.278
28 HA GLU 4 HA GLU 4 5.279 -6.899 -7.695
29 HB2 GLU 4 HB2 GLU 4 3.098 -6.861 -8.864
30 HB3 GLU 4 HB1 GLU 4 2.984 -6.398 -7.176
31 HG2 GLU 4 HG2 GLU 4 2.920 -4.016 -7.886
32 HG3 GLU 4 HG1 GLU 4 2.893 -4.558 -9.564
33 H SER 5 HN SER 5 6.703 -7.232 -9.168
34 HA SER 5 HA SER 5 6.940 -5.452 -11.499
35 HB2 SER 5 HB2 SER 5 8.840 -7.595 -10.487
36 HB3 SER 5 HB1 SER 5 9.150 -6.481 -11.819
37 HG SER 5 HG SER 5 8.473 -4.984 -9.776
38 H GLN 6 HN GLN 6 8.055 -7.178 -13.328
39 HA GLN 6 HA GLN 6 5.847 -9.073 -13.830
40 HB2 GLN 6 HB2 GLN 6 5.914 -7.117 -15.356
41 HB3 GLN 6 HB1 GLN 6 7.546 -7.561 -15.840
42 HG2 GLN 6 HG2 GLN 6 6.649 -9.706 -16.717
43 HG3 GLN 6 HG1 GLN 6 5.025 -9.146 -16.316
44 HE21 GLN 6 HE21 GLN 6 4.320 -9.182 -18.430
45 HE22 GLN 6 HE22 GLN 6 4.865 -8.058 -19.623
46 H SER 7 HN SER 7 6.486 -10.970 -15.172
47 HA SER 7 HA SER 7 9.171 -11.873 -14.342
48 HB2 SER 7 HB2 SER 7 6.723 -13.592 -14.819
49 HB3 SER 7 HB1 SER 7 8.243 -14.078 -14.065
50 HG SER 7 HG SER 7 7.428 -13.432 -12.251
51 H HIS 8 HN HIS 8 10.544 -12.371 -15.893
52 HA HIS 8 HA HIS 8 9.525 -13.097 -18.565
53 HB2 HIS 8 HB2 HIS 8 11.432 -11.825 -19.564
54 HB3 HIS 8 HB1 HIS 8 10.244 -10.807 -18.763
55 HD1 HIS 8 HD1 HIS 8 11.115 -9.218 -17.044
56 HD2 HIS 8 HD2 HIS 8 13.876 -12.183 -17.986
57 HE1 HIS 8 HE1 HIS 8 13.231 -8.581 -15.842
58 HE2 HIS 8 HE2 HIS 8 14.847 -10.446 -16.337
59 H LYS 9 HN LYS 9 11.189 -14.141 -15.958
60 HA LYS 9 HA LYS 9 13.151 -15.759 -17.381
61 HB2 LYS 9 HB2 LYS 9 12.206 -15.899 -14.500
62 HB3 LYS 9 HB1 LYS 9 13.575 -16.772 -15.167
63 HG2 LYS 9 HG2 LYS 9 13.644 -13.828 -15.465
64 HG3 LYS 9 HG1 LYS 9 13.784 -14.448 -13.824
65 HD2 LYS 9 HD2 LYS 9 15.998 -14.186 -14.670
66 HD3 LYS 9 HD1 LYS 9 15.661 -15.915 -14.622
67 HE2 LYS 9 HE2 LYS 9 15.301 -15.969 -17.000
68 HE3 LYS 9 HE1 LYS 9 15.402 -14.210 -17.101
69 HZ1 LYS 9 HZ1 LYS 9 17.609 -16.058 -16.365
70 HZ2 LYS 9 HZ2 LYS 9 17.717 -14.373 -16.346
71 HZ3 LYS 9 HZ3 LYS 9 17.462 -15.184 -17.806
72 H PHE 10 HN PHE 10 9.873 -15.777 -16.741
73 HA PHE 10 HA PHE 10 9.429 -18.615 -16.630
74 HB2 PHE 10 HB2 PHE 10 7.974 -16.913 -15.517
75 HB3 PHE 10 HB1 PHE 10 7.490 -16.330 -17.103
76 HD1 PHE 10 HD2 PHE 10 7.704 -19.581 -15.284
77 HD2 PHE 10 HD1 PHE 10 5.427 -17.061 -17.857
78 HE1 PHE 10 HE2 PHE 10 5.884 -21.236 -15.293
79 HE2 PHE 10 HE1 PHE 10 3.603 -18.712 -17.856
80 HZ PHE 10 HZ PHE 10 3.832 -20.804 -16.580
81 H LYS 11 HN LYS 11 8.415 -19.852 -18.294
82 HA LYS 11 HA LYS 11 8.994 -18.832 -20.995
83 HB2 LYS 11 HB2 LYS 11 8.952 -21.635 -19.871
84 HB3 LYS 11 HB1 LYS 11 9.010 -21.311 -21.597
85 HG2 LYS 11 HG2 LYS 11 11.060 -20.349 -19.607
86 HG3 LYS 11 HG1 LYS 11 11.224 -21.797 -20.604
87 HD2 LYS 11 HD2 LYS 11 11.053 -20.404 -22.631
88 HD3 LYS 11 HD1 LYS 11 10.922 -18.962 -21.624
89 HE2 LYS 11 HE2 LYS 11 13.151 -19.345 -20.743
90 HE3 LYS 11 HE1 LYS 11 13.277 -20.851 -21.651
91 HZ1 LYS 11 HZ1 LYS 11 13.170 -19.596 -23.699
92 HZ2 LYS 11 HZ2 LYS 11 14.441 -19.029 -22.745
93 HZ3 LYS 11 HZ3 LYS 11 13.002 -18.144 -22.850
94 H GLY 12 HN GLY 12 7.371 -18.490 -22.346
95 HA2 GLY 12 HA2 GLY 12 5.440 -18.918 -23.535
96 HA3 GLY 12 HA1 GLY 12 5.098 -20.260 -22.455
97 HA PRO 13 HA PRO 13 2.136 -16.818 -21.407
98 HB2 PRO 13 HB2 PRO 13 -0.147 -18.204 -21.807
99 HB3 PRO 13 HB1 PRO 13 0.695 -17.393 -23.134
100 HG2 PRO 13 HG2 PRO 13 0.767 -20.286 -22.338
101 HG3 PRO 13 HG1 PRO 13 0.605 -19.580 -23.957
102 HD2 PRO 13 HD2 PRO 13 2.970 -20.510 -22.983
103 HD3 PRO 13 HD1 PRO 13 2.872 -19.168 -24.142
104 H CYS 14 HN CYS 14 0.259 -17.090 -19.744
105 HA CYS 14 HA CYS 14 1.412 -18.367 -17.465
106 HB2 CYS 14 HB2 CYS 14 0.200 -16.254 -17.227
107 HB3 CYS 14 HB1 CYS 14 -1.282 -17.022 -17.785
108 H ALA 15 HN ALA 15 1.483 -20.553 -18.112
109 HA ALA 15 HA ALA 15 -0.740 -22.133 -18.772
110 HB1 ALA 15 HB1 ALA 15 1.774 -22.934 -17.295
111 HB2 ALA 15 HB2 ALA 15 1.562 -22.914 -19.046
112 HB3 ALA 15 HB3 ALA 15 0.633 -24.042 -18.058
113 H SER 16 HN SER 16 0.444 -20.926 -15.736
114 HA SER 16 HA SER 16 -2.003 -21.305 -14.407
115 HB2 SER 16 HB2 SER 16 -1.365 -23.660 -14.276
116 HB3 SER 16 HB1 SER 16 0.216 -23.228 -13.623
117 HG SER 16 HG SER 16 -2.324 -23.085 -12.397
118 H ASP 17 HN ASP 17 -2.111 -19.915 -12.732
119 HA ASP 17 HA ASP 17 -0.147 -18.038 -12.148
120 HB2 ASP 17 HB2 ASP 17 -1.460 -17.543 -10.116
121 HB3 ASP 17 HB1 ASP 17 -2.497 -17.711 -11.527
122 H HIS 18 HN HIS 18 -0.824 -21.177 -10.737
123 HA HIS 18 HA HIS 18 0.897 -20.919 -8.514
124 HB2 HIS 18 HB2 HIS 18 -0.943 -22.664 -8.816
125 HB3 HIS 18 HB1 HIS 18 0.186 -23.515 -9.882
126 HD1 HIS 18 HD1 HIS 18 1.548 -25.227 -8.755
127 HD2 HIS 18 HD2 HIS 18 0.317 -22.266 -6.116
128 HE1 HIS 18 HE1 HIS 18 2.404 -25.938 -6.501
129 HE2 HIS 18 HE2 HIS 18 1.514 -24.209 -4.898
130 H ASN 19 HN ASN 19 1.316 -22.018 -11.816
131 HA ASN 19 HA ASN 19 3.890 -23.134 -11.474
132 HB2 ASN 19 HB2 ASN 19 2.428 -23.625 -13.436
133 HB3 ASN 19 HB1 ASN 19 2.679 -21.979 -14.008
134 HD21 ASN 19 HD21 ASN 19 3.598 -22.720 -15.933
135 HD22 ASN 19 HD22 ASN 19 5.189 -23.387 -15.994
136 H CYS 20 HN CYS 20 2.724 -19.966 -12.556
137 HA CYS 20 HA CYS 20 5.180 -18.653 -12.815
138 HB2 CYS 20 HB2 CYS 20 2.376 -17.822 -12.321
139 HB3 CYS 20 HB1 CYS 20 3.602 -16.667 -11.812
140 H ALA 21 HN ALA 21 3.183 -19.245 -9.952
141 HA ALA 21 HA ALA 21 4.669 -17.801 -8.084
142 HB1 ALA 21 HB1 ALA 21 2.429 -18.769 -7.655
143 HB2 ALA 21 HB2 ALA 21 3.595 -19.145 -6.385
144 HB3 ALA 21 HB3 ALA 21 3.162 -20.371 -7.579
145 H SER 22 HN SER 22 4.855 -21.293 -8.807
146 HA SER 22 HA SER 22 6.956 -21.923 -7.117
147 HB2 SER 22 HB2 SER 22 5.532 -23.574 -8.322
148 HB3 SER 22 HB1 SER 22 6.376 -23.179 -9.818
149 HG SER 22 HG SER 22 8.250 -24.027 -8.969
150 H VAL 23 HN VAL 23 7.062 -20.897 -10.519
151 HA VAL 23 HA VAL 23 9.848 -21.089 -10.857
152 HB VAL 23 HB VAL 23 7.811 -19.343 -12.262
153 HG11 VAL 23 HG11 VAL 23 10.691 -19.870 -13.054
154 HG12 VAL 23 HG12 VAL 23 10.034 -18.329 -12.501
155 HG13 VAL 23 HG13 VAL 23 9.496 -19.017 -14.032
156 HG21 VAL 23 HG21 VAL 23 9.130 -21.948 -13.047
157 HG22 VAL 23 HG22 VAL 23 8.024 -21.017 -14.060
158 HG23 VAL 23 HG23 VAL 23 7.452 -21.727 -12.550
159 H CYS 24 HN CYS 24 7.830 -18.266 -10.030
160 HA CYS 24 HA CYS 24 9.972 -16.442 -9.834
161 HB2 CYS 24 HB2 CYS 24 7.505 -15.905 -10.088
162 HB3 CYS 24 HB1 CYS 24 7.334 -16.239 -8.369
163 H GLN 25 HN GLN 25 8.532 -18.677 -7.553
164 HA GLN 25 HA GLN 25 9.827 -17.652 -5.223
165 HB2 GLN 25 HB2 GLN 25 8.523 -20.322 -5.808
166 HB3 GLN 25 HB1 GLN 25 9.225 -19.922 -4.246
167 HG2 GLN 25 HG2 GLN 25 7.654 -18.061 -4.010
168 HG3 GLN 25 HG1 GLN 25 6.952 -18.453 -5.579
169 HE21 GLN 25 HE21 GLN 25 5.718 -18.379 -2.933
170 HE22 GLN 25 HE22 GLN 25 5.042 -19.947 -2.671
171 H THR 26 HN THR 26 10.647 -20.063 -7.668
172 HA THR 26 HA THR 26 12.996 -20.929 -6.250
173 HB THR 26 HB THR 26 13.574 -22.154 -8.334
174 HG1 THR 26 HG1 THR 26 11.947 -20.398 -9.471
175 HG21 THR 26 HG21 THR 26 12.123 -23.194 -6.654
176 HG22 THR 26 HG22 THR 26 11.668 -23.700 -8.282
177 HG23 THR 26 HG23 THR 26 10.708 -22.489 -7.435
178 H GLU 27 HN GLU 27 12.217 -18.392 -8.505
179 HA GLU 27 HA GLU 27 14.806 -17.720 -9.358
180 HB2 GLU 27 HB2 GLU 27 12.395 -15.980 -8.822
181 HB3 GLU 27 HB1 GLU 27 13.897 -15.342 -9.476
182 HG2 GLU 27 HG2 GLU 27 13.654 -17.043 -11.340
183 HG3 GLU 27 HG1 GLU 27 12.020 -17.323 -10.739
184 H ARG 28 HN ARG 28 13.003 -16.458 -6.526
185 HA ARG 28 HA ARG 28 15.283 -16.698 -4.850
186 HB2 ARG 28 HB2 ARG 28 15.783 -14.584 -6.232
187 HB3 ARG 28 HB1 ARG 28 14.474 -13.830 -5.332
188 HG2 ARG 28 HG2 ARG 28 15.701 -14.421 -3.222
189 HG3 ARG 28 HG1 ARG 28 17.054 -14.939 -4.229
190 HD2 ARG 28 HD2 ARG 28 15.893 -12.176 -3.934
191 HD3 ARG 28 HD1 ARG 28 17.532 -12.716 -3.568
192 HE ARG 28 HE ARG 28 17.309 -13.199 -6.223
193 HH11 ARG 28 HH11 ARG 28 16.846 -10.377 -4.222
194 HH12 ARG 28 HH12 ARG 28 17.140 -9.250 -5.508
195 HH21 ARG 28 HH21 ARG 28 17.700 -11.730 -7.927
196 HH22 ARG 28 HH22 ARG 28 17.615 -10.022 -7.621
197 H PHE 29 HN PHE 29 13.070 -13.986 -4.509
198 HA PHE 29 HA PHE 29 11.244 -15.477 -2.801
199 HB2 PHE 29 HB2 PHE 29 12.874 -13.131 -1.761
200 HB3 PHE 29 HB1 PHE 29 11.488 -13.831 -0.930
201 HD1 PHE 29 HD2 PHE 29 11.643 -16.389 -0.446
202 HD2 PHE 29 HD1 PHE 29 15.003 -13.895 -1.242
203 HE1 PHE 29 HE2 PHE 29 13.117 -18.020 0.663
204 HE2 PHE 29 HE1 PHE 29 16.479 -15.524 -0.146
205 HZ PHE 29 HZ PHE 29 15.538 -17.588 0.812
206 H SER 30 HN SER 30 9.722 -15.020 -4.333
207 HA SER 30 HA SER 30 8.515 -12.430 -4.298
208 HB2 SER 30 HB2 SER 30 9.690 -13.455 -6.911
209 HB3 SER 30 HB1 SER 30 8.723 -11.996 -6.712
210 HG SER 30 HG SER 30 11.088 -11.747 -6.788
211 H GLY 31 HN GLY 31 6.478 -13.019 -4.076
212 HA2 GLY 31 HA2 GLY 31 5.323 -15.479 -4.823
213 HA3 GLY 31 HA1 GLY 31 4.429 -13.997 -4.494
214 H GLY 32 HN GLY 32 4.235 -16.160 -6.658
215 HA2 GLY 32 HA2 GLY 32 4.545 -14.383 -9.003
216 HA3 GLY 32 HA1 GLY 32 4.724 -16.130 -9.070
217 H ARG 33 HN ARG 33 2.837 -13.896 -10.169
218 HA ARG 33 HA ARG 33 0.421 -15.540 -10.102
219 HB2 ARG 33 HB2 ARG 33 0.370 -12.556 -9.521
220 HB3 ARG 33 HB1 ARG 33 -1.030 -13.608 -9.659
221 HG2 ARG 33 HG2 ARG 33 -0.316 -14.828 -7.655
222 HG3 ARG 33 HG1 ARG 33 1.086 -13.763 -7.517
223 HD2 ARG 33 HD2 ARG 33 -0.640 -13.008 -6.005
224 HD3 ARG 33 HD1 ARG 33 -0.453 -11.828 -7.302
225 HE ARG 33 HE ARG 33 -2.576 -13.867 -7.435
226 HH11 ARG 33 HH11 ARG 33 -1.620 -10.481 -7.353
227 HH12 ARG 33 HH12 ARG 33 -3.229 -9.908 -7.658
228 HH21 ARG 33 HH21 ARG 33 -4.671 -13.084 -7.847
229 HH22 ARG 33 HH22 ARG 33 -4.948 -11.370 -7.946
230 H CYS 34 HN CYS 34 -1.241 -14.333 -11.663
231 HA CYS 34 HA CYS 34 0.216 -13.167 -13.941
232 HB2 CYS 34 HB2 CYS 34 -2.043 -15.184 -14.146
233 HB3 CYS 34 HB1 CYS 34 -1.159 -14.457 -15.487
234 H ARG 35 HN ARG 35 -0.776 -11.362 -14.825
235 HA ARG 35 HA ARG 35 -3.395 -10.672 -13.621
236 HB2 ARG 35 HB2 ARG 35 -1.172 -8.750 -14.347
237 HB3 ARG 35 HB1 ARG 35 -2.757 -8.295 -13.729
238 HG2 ARG 35 HG2 ARG 35 -2.110 -9.866 -11.733
239 HG3 ARG 35 HG1 ARG 35 -0.466 -9.592 -12.311
240 HD2 ARG 35 HD2 ARG 35 -0.933 -7.970 -10.607
241 HD3 ARG 35 HD1 ARG 35 -0.904 -7.130 -12.159
242 HE ARG 35 HE ARG 35 -3.533 -7.783 -11.792
243 HH11 ARG 35 HH11 ARG 35 -1.181 -5.966 -9.921
244 HH12 ARG 35 HH12 ARG 35 -2.383 -4.964 -9.172
245 HH21 ARG 35 HH21 ARG 35 -5.086 -6.470 -10.829
246 HH22 ARG 35 HH22 ARG 35 -4.616 -5.256 -9.680
247 H GLY 36 HN GLY 36 -2.327 -11.849 -16.275
248 HA2 GLY 36 HA2 GLY 36 -4.278 -10.340 -17.907
249 HA3 GLY 36 HA1 GLY 36 -2.807 -11.029 -18.596
250 H PHE 37 HN PHE 37 -5.553 -11.665 -19.336
251 HA PHE 37 HA PHE 37 -6.410 -14.066 -18.118
252 HB2 PHE 37 HB2 PHE 37 -7.010 -12.966 -20.874
253 HB3 PHE 37 HB1 PHE 37 -7.856 -14.323 -20.135
254 HD1 PHE 37 HD2 PHE 37 -9.200 -13.941 -18.051
255 HD2 PHE 37 HD1 PHE 37 -7.575 -10.734 -20.336
256 HE1 PHE 37 HE2 PHE 37 -10.744 -12.378 -16.947
257 HE2 PHE 37 HE1 PHE 37 -9.112 -9.166 -19.231
258 HZ PHE 37 HZ PHE 37 -10.701 -9.987 -17.533
259 H ARG 38 HN ARG 38 -4.810 -15.542 -17.932
260 HA ARG 38 HA ARG 38 -3.455 -17.283 -18.465
261 HB2 ARG 38 HB2 ARG 38 -4.710 -17.071 -21.221
262 HB3 ARG 38 HB1 ARG 38 -3.769 -18.432 -20.621
263 HG2 ARG 38 HG2 ARG 38 -5.463 -18.848 -18.899
264 HG3 ARG 38 HG1 ARG 38 -6.412 -17.491 -19.508
265 HD2 ARG 38 HD2 ARG 38 -6.615 -18.632 -21.684
266 HD3 ARG 38 HD1 ARG 38 -5.696 -19.996 -21.040
267 HE ARG 38 HE ARG 38 -8.226 -19.171 -19.777
268 HH11 ARG 38 HH11 ARG 38 -6.322 -21.597 -21.434
269 HH12 ARG 38 HH12 ARG 38 -7.461 -22.870 -21.149
270 HH21 ARG 38 HH21 ARG 38 -9.746 -20.826 -19.439
271 HH22 ARG 38 HH22 ARG 38 -9.433 -22.422 -20.036
272 H ARG 39 HN ARG 39 -2.730 -14.450 -18.860
273 HA ARG 39 HA ARG 39 -0.319 -14.794 -20.463
274 HB2 ARG 39 HB2 ARG 39 -2.193 -13.988 -21.977
275 HB3 ARG 39 HB1 ARG 39 -2.256 -12.525 -21.008
276 HG2 ARG 39 HG2 ARG 39 -0.991 -11.983 -22.909
277 HG3 ARG 39 HG1 ARG 39 0.183 -12.183 -21.607
278 HD2 ARG 39 HD2 ARG 39 0.720 -14.422 -22.397
279 HD3 ARG 39 HD1 ARG 39 -0.516 -14.300 -23.650
280 HE ARG 39 HE ARG 39 2.126 -13.133 -23.682
281 HH11 ARG 39 HH11 ARG 39 -1.106 -12.971 -25.033
282 HH12 ARG 39 HH12 ARG 39 -0.601 -12.139 -26.470
283 HH21 ARG 39 HH21 ARG 39 2.793 -12.038 -25.561
284 HH22 ARG 39 HH22 ARG 39 1.626 -11.613 -26.775
285 H ARG 40 HN ARG 40 1.190 -12.986 -20.145
286 HA ARG 40 HA ARG 40 2.290 -11.383 -18.995
287 HB2 ARG 40 HB2 ARG 40 0.187 -10.177 -19.743
288 HB3 ARG 40 HB1 ARG 40 -0.370 -10.352 -18.081
289 HG2 ARG 40 HG2 ARG 40 1.255 -8.934 -17.248
290 HG3 ARG 40 HG1 ARG 40 2.313 -9.151 -18.644
291 HD2 ARG 40 HD2 ARG 40 0.903 -7.859 -20.022
292 HD3 ARG 40 HD1 ARG 40 -0.377 -7.824 -18.812
293 HE ARG 40 HE ARG 40 2.143 -6.598 -18.030
294 HH11 ARG 40 HH11 ARG 40 -1.041 -6.117 -19.409
295 HH12 ARG 40 HH12 ARG 40 -1.111 -4.437 -18.978
296 HH21 ARG 40 HH21 ARG 40 2.034 -4.372 -17.443
297 HH22 ARG 40 HH22 ARG 40 0.618 -3.456 -17.857
298 H CYS 41 HN CYS 41 3.335 -12.555 -17.474
299 HA CYS 41 HA CYS 41 2.040 -13.247 -14.954
300 HB2 CYS 41 HB2 CYS 41 3.417 -14.925 -16.176
301 HB3 CYS 41 HB1 CYS 41 4.823 -13.889 -15.965
302 H PHE 42 HN PHE 42 2.553 -12.345 -13.017
303 HA PHE 42 HA PHE 42 4.566 -10.187 -12.953
304 HB2 PHE 42 HB2 PHE 42 1.724 -10.165 -11.936
305 HB3 PHE 42 HB1 PHE 42 2.946 -9.146 -11.190
306 HD1 PHE 42 HD2 PHE 42 0.972 -9.719 -14.254
307 HD2 PHE 42 HD1 PHE 42 3.797 -7.199 -12.290
308 HE1 PHE 42 HE2 PHE 42 0.559 -7.954 -15.912
309 HE2 PHE 42 HE1 PHE 42 3.391 -5.440 -13.955
310 HZ PHE 42 HZ PHE 42 1.771 -5.813 -15.771
311 H CYS 43 HN CYS 43 5.583 -9.855 -10.935
312 HA CYS 43 HA CYS 43 5.228 -12.009 -8.952
313 HB2 CYS 43 HB2 CYS 43 7.758 -10.738 -9.990
314 HB3 CYS 43 HB1 CYS 43 7.711 -11.532 -8.421
315 H THR 44 HN THR 44 5.078 -11.426 -6.856
316 HA THR 44 HA THR 44 5.207 -8.555 -6.200
317 HB THR 44 HB THR 44 3.620 -9.165 -4.324
318 HG1 THR 44 HG1 THR 44 4.141 -11.505 -4.562
319 HG21 THR 44 HG21 THR 44 2.623 -9.691 -7.134
320 HG22 THR 44 HG22 THR 44 2.791 -8.105 -6.377
321 HG23 THR 44 HG23 THR 44 1.622 -9.265 -5.745
322 H THR 45 HN THR 45 6.692 -7.969 -4.746
323 HA THR 45 HA THR 45 7.650 -9.856 -2.746
324 HB THR 45 HB THR 45 9.130 -10.246 -4.681
325 HG1 THR 45 HG1 THR 45 10.700 -10.466 -3.293
326 HG21 THR 45 HG21 THR 45 9.894 -7.331 -4.394
327 HG22 THR 45 HG22 THR 45 8.965 -8.018 -5.727
328 HG23 THR 45 HG23 THR 45 10.644 -8.500 -5.480
329 H HIS 46 HN HIS 46 9.343 -8.722 -1.338
330 HA HIS 46 HA HIS 46 8.220 -6.262 -0.385
331 HB2 HIS 46 HB2 HIS 46 10.062 -6.401 1.315
332 HB3 HIS 46 HB1 HIS 46 9.055 -7.842 1.237
333 HD1 HIS 46 HD1 HIS 46 10.166 -10.032 0.515
334 HD2 HIS 46 HD2 HIS 46 12.723 -6.757 0.383
335 HE1 HIS 46 HE1 HIS 46 12.464 -10.985 0.169
336 HE2 HIS 46 HE2 HIS 46 14.006 -8.993 0.192
337 H CYS 47 HN CYS 47 8.939 -4.224 -0.677
338 HA CYS 47 HA CYS 47 10.847 -3.722 -2.767
339 HB2 CYS 47 HB2 CYS 47 9.530 -1.694 -0.947
340 HB3 CYS 47 HB1 CYS 47 10.223 -1.406 -2.540
Start of MODEL 8
1 H1 ARG 1 HT1 ARG 1 4.735 -1.128 -0.891
2 H2 ARG 1 HT2 ARG 1 4.300 -0.367 0.552
3 H3 ARG 1 HT3 ARG 1 3.232 -1.443 -0.192
4 HA ARG 1 HA ARG 1 5.856 -2.116 0.992
5 HB2 ARG 1 HB2 ARG 1 4.560 -3.337 2.677
6 HB3 ARG 1 HB1 ARG 1 4.133 -1.630 2.669
7 HG2 ARG 1 HG2 ARG 1 2.137 -2.235 1.263
8 HG3 ARG 1 HG1 ARG 1 2.532 -3.930 1.558
9 HD2 ARG 1 HD2 ARG 1 0.851 -3.224 3.132
10 HD3 ARG 1 HD1 ARG 1 2.365 -3.503 3.993
11 HE ARG 1 HE ARG 1 1.286 -0.842 3.292
12 HH11 ARG 1 HH11 ARG 1 3.206 -2.909 5.362
13 HH12 ARG 1 HH12 ARG 1 3.579 -1.644 6.489
14 HH21 ARG 1 HH21 ARG 1 1.764 0.816 4.782
15 HH22 ARG 1 HH22 ARG 1 2.736 0.458 6.178
16 H THR 2 HN THR 2 2.973 -3.251 -0.734
17 HA THR 2 HA THR 2 4.388 -5.742 -1.404
18 HB THR 2 HB THR 2 1.469 -5.049 -1.857
19 HG1 THR 2 HG1 THR 2 2.833 -6.277 0.296
20 HG21 THR 2 HG21 THR 2 2.946 -7.688 -1.988
21 HG22 THR 2 HG22 THR 2 2.289 -6.797 -3.360
22 HG23 THR 2 HG23 THR 2 1.203 -7.484 -2.155
23 H CYS 3 HN CYS 3 5.434 -5.711 -3.293
24 HA CYS 3 HA CYS 3 4.505 -3.844 -5.384
25 HB2 CYS 3 HB2 CYS 3 7.325 -4.780 -4.769
26 HB3 CYS 3 HB1 CYS 3 6.875 -3.748 -6.124
27 H GLU 4 HN GLU 4 4.141 -4.605 -7.396
28 HA GLU 4 HA GLU 4 4.762 -7.440 -7.882
29 HB2 GLU 4 HB2 GLU 4 2.813 -7.471 -9.416
30 HB3 GLU 4 HB1 GLU 4 2.385 -7.179 -7.742
31 HG2 GLU 4 HG2 GLU 4 2.284 -4.730 -8.296
32 HG3 GLU 4 HG1 GLU 4 2.470 -5.178 -9.989
33 H SER 5 HN SER 5 6.426 -7.606 -9.125
34 HA SER 5 HA SER 5 6.988 -5.622 -11.205
35 HB2 SER 5 HB2 SER 5 8.774 -6.268 -9.559
36 HB3 SER 5 HB1 SER 5 8.717 -7.909 -10.199
37 HG SER 5 HG SER 5 10.141 -5.884 -11.087
38 H GLN 6 HN GLN 6 8.415 -7.156 -12.981
39 HA GLN 6 HA GLN 6 6.320 -8.908 -14.113
40 HB2 GLN 6 HB2 GLN 6 6.510 -6.950 -15.474
41 HB3 GLN 6 HB1 GLN 6 8.267 -6.996 -15.429
42 HG2 GLN 6 HG2 GLN 6 7.396 -7.680 -17.602
43 HG3 GLN 6 HG1 GLN 6 8.273 -8.992 -16.816
44 HE21 GLN 6 HE21 GLN 6 7.284 -10.643 -17.858
45 HE22 GLN 6 HE22 GLN 6 5.623 -11.043 -17.647
46 H SER 7 HN SER 7 6.989 -10.829 -15.170
47 HA SER 7 HA SER 7 9.718 -11.676 -14.417
48 HB2 SER 7 HB2 SER 7 7.949 -12.899 -13.207
49 HB3 SER 7 HB1 SER 7 7.226 -13.381 -14.746
50 HG SER 7 HG SER 7 8.913 -14.775 -13.488
51 H HIS 8 HN HIS 8 11.039 -11.915 -16.023
52 HA HIS 8 HA HIS 8 10.034 -12.610 -18.709
53 HB2 HIS 8 HB2 HIS 8 12.293 -11.756 -19.484
54 HB3 HIS 8 HB1 HIS 8 11.232 -10.532 -18.797
55 HD1 HIS 8 HD1 HIS 8 14.315 -12.557 -17.928
56 HD2 HIS 8 HD2 HIS 8 12.254 -9.178 -16.645
57 HE1 HIS 8 HE1 HIS 8 15.797 -11.464 -16.222
58 HE2 HIS 8 HE2 HIS 8 14.577 -9.371 -15.530
59 H LYS 9 HN LYS 9 10.676 -14.308 -16.284
60 HA LYS 9 HA LYS 9 12.718 -16.074 -17.481
61 HB2 LYS 9 HB2 LYS 9 13.218 -15.132 -15.223
62 HB3 LYS 9 HB1 LYS 9 11.772 -15.913 -14.605
63 HG2 LYS 9 HG2 LYS 9 13.750 -17.176 -14.018
64 HG3 LYS 9 HG1 LYS 9 12.736 -18.108 -15.120
65 HD2 LYS 9 HD2 LYS 9 14.192 -17.686 -16.956
66 HD3 LYS 9 HD1 LYS 9 15.089 -16.464 -16.049
67 HE2 LYS 9 HE2 LYS 9 16.316 -18.596 -16.231
68 HE3 LYS 9 HE1 LYS 9 15.968 -18.163 -14.559
69 HZ1 LYS 9 HZ1 LYS 9 14.322 -20.057 -16.140
70 HZ2 LYS 9 HZ2 LYS 9 14.229 -19.757 -14.477
71 HZ3 LYS 9 HZ3 LYS 9 15.585 -20.528 -15.124
72 H PHE 10 HN PHE 10 9.426 -15.713 -16.795
73 HA PHE 10 HA PHE 10 8.786 -18.500 -16.446
74 HB2 PHE 10 HB2 PHE 10 7.489 -16.612 -15.401
75 HB3 PHE 10 HB1 PHE 10 6.909 -16.188 -17.008
76 HD1 PHE 10 HD2 PHE 10 7.134 -19.158 -14.762
77 HD2 PHE 10 HD1 PHE 10 4.844 -17.022 -17.646
78 HE1 PHE 10 HE2 PHE 10 5.291 -20.757 -14.479
79 HE2 PHE 10 HE1 PHE 10 2.999 -18.623 -17.367
80 HZ PHE 10 HZ PHE 10 3.220 -20.492 -15.782
81 H LYS 11 HN LYS 11 7.108 -19.499 -17.906
82 HA LYS 11 HA LYS 11 8.118 -19.377 -20.614
83 HB2 LYS 11 HB2 LYS 11 6.745 -21.428 -20.946
84 HB3 LYS 11 HB1 LYS 11 7.909 -21.560 -19.636
85 HG2 LYS 11 HG2 LYS 11 6.074 -21.092 -18.022
86 HG3 LYS 11 HG1 LYS 11 4.939 -21.121 -19.371
87 HD2 LYS 11 HD2 LYS 11 6.701 -23.407 -18.469
88 HD3 LYS 11 HD1 LYS 11 4.964 -23.266 -18.202
89 HE2 LYS 11 HE2 LYS 11 6.348 -23.502 -20.879
90 HE3 LYS 11 HE1 LYS 11 5.437 -24.770 -20.063
91 HZ1 LYS 11 HZ1 LYS 11 3.456 -23.369 -20.235
92 HZ2 LYS 11 HZ2 LYS 11 4.098 -23.734 -21.753
93 HZ3 LYS 11 HZ3 LYS 11 4.341 -22.203 -21.080
94 H GLY 12 HN GLY 12 7.293 -17.719 -21.760
95 HA2 GLY 12 HA2 GLY 12 5.775 -16.791 -23.219
96 HA3 GLY 12 HA1 GLY 12 4.609 -18.004 -22.713
97 HA PRO 13 HA PRO 13 2.919 -14.061 -21.122
98 HB2 PRO 13 HB2 PRO 13 0.341 -15.401 -21.464
99 HB3 PRO 13 HB1 PRO 13 0.914 -13.892 -22.178
100 HG2 PRO 13 HG2 PRO 13 0.577 -16.133 -23.649
101 HG3 PRO 13 HG1 PRO 13 1.850 -14.949 -24.003
102 HD2 PRO 13 HD2 PRO 13 2.061 -17.579 -22.569
103 HD3 PRO 13 HD1 PRO 13 3.145 -16.868 -23.787
104 H CYS 14 HN CYS 14 1.032 -16.884 -20.463
105 HA CYS 14 HA CYS 14 1.746 -16.961 -17.666
106 HB2 CYS 14 HB2 CYS 14 0.036 -15.309 -17.467
107 HB3 CYS 14 HB1 CYS 14 -1.013 -16.149 -18.601
108 H ALA 15 HN ALA 15 0.406 -18.707 -16.559
109 HA ALA 15 HA ALA 15 -0.662 -20.785 -18.266
110 HB1 ALA 15 HB1 ALA 15 0.840 -22.533 -17.404
111 HB2 ALA 15 HB2 ALA 15 1.772 -21.308 -16.542
112 HB3 ALA 15 HB3 ALA 15 1.735 -21.310 -18.305
113 H SER 16 HN SER 16 0.360 -19.724 -15.074
114 HA SER 16 HA SER 16 -2.182 -19.920 -13.914
115 HB2 SER 16 HB2 SER 16 -1.885 -22.329 -13.922
116 HB3 SER 16 HB1 SER 16 -0.265 -22.179 -13.243
117 HG SER 16 HG SER 16 -2.619 -22.332 -11.974
118 H ASP 17 HN ASP 17 -2.184 -18.852 -11.922
119 HA ASP 17 HA ASP 17 -0.016 -17.251 -11.176
120 HB2 ASP 17 HB2 ASP 17 -2.285 -18.231 -9.410
121 HB3 ASP 17 HB1 ASP 17 -1.244 -16.857 -9.081
122 H HIS 18 HN HIS 18 -1.037 -20.447 -10.217
123 HA HIS 18 HA HIS 18 0.707 -20.978 -8.100
124 HB2 HIS 18 HB2 HIS 18 -1.175 -22.448 -8.834
125 HB3 HIS 18 HB1 HIS 18 -0.229 -22.879 -10.262
126 HD1 HIS 18 HD1 HIS 18 0.688 -25.143 -9.998
127 HD2 HIS 18 HD2 HIS 18 0.680 -23.058 -6.399
128 HE1 HIS 18 HE1 HIS 18 1.741 -26.685 -8.320
129 HE2 HIS 18 HE2 HIS 18 1.545 -25.479 -6.120
130 H ASN 19 HN ASN 19 1.084 -21.535 -11.580
131 HA ASN 19 HA ASN 19 3.638 -22.699 -11.438
132 HB2 ASN 19 HB2 ASN 19 2.219 -21.318 -13.726
133 HB3 ASN 19 HB1 ASN 19 3.763 -22.144 -13.905
134 HD21 ASN 19 HD21 ASN 19 3.149 -24.306 -12.100
135 HD22 ASN 19 HD22 ASN 19 1.985 -25.304 -12.891
136 H CYS 20 HN CYS 20 2.613 -19.386 -12.216
137 HA CYS 20 HA CYS 20 5.154 -18.271 -12.535
138 HB2 CYS 20 HB2 CYS 20 2.476 -17.148 -11.786
139 HB3 CYS 20 HB1 CYS 20 3.900 -16.115 -11.699
140 H ALA 21 HN ALA 21 3.224 -18.783 -9.617
141 HA ALA 21 HA ALA 21 4.877 -17.451 -7.788
142 HB1 ALA 21 HB1 ALA 21 2.627 -18.266 -7.235
143 HB2 ALA 21 HB2 ALA 21 3.829 -18.836 -6.077
144 HB3 ALA 21 HB3 ALA 21 3.213 -19.929 -7.318
145 H SER 22 HN SER 22 4.774 -20.913 -8.578
146 HA SER 22 HA SER 22 6.903 -21.805 -7.076
147 HB2 SER 22 HB2 SER 22 5.289 -23.238 -8.326
148 HB3 SER 22 HB1 SER 22 6.096 -22.783 -9.826
149 HG SER 22 HG SER 22 7.065 -24.639 -9.290
150 H VAL 23 HN VAL 23 6.995 -20.842 -10.513
151 HA VAL 23 HA VAL 23 9.741 -21.212 -10.889
152 HB VAL 23 HB VAL 23 7.873 -19.297 -12.322
153 HG11 VAL 23 HG11 VAL 23 10.218 -18.670 -12.675
154 HG12 VAL 23 HG12 VAL 23 9.514 -19.337 -14.149
155 HG13 VAL 23 HG13 VAL 23 10.593 -20.326 -13.163
156 HG21 VAL 23 HG21 VAL 23 8.743 -22.111 -13.008
157 HG22 VAL 23 HG22 VAL 23 7.747 -21.072 -14.027
158 HG23 VAL 23 HG23 VAL 23 7.139 -21.618 -12.464
159 H CYS 24 HN CYS 24 7.962 -18.188 -10.185
160 HA CYS 24 HA CYS 24 10.242 -16.550 -10.179
161 HB2 CYS 24 HB2 CYS 24 7.810 -15.801 -10.305
162 HB3 CYS 24 HB1 CYS 24 7.751 -16.010 -8.557
163 H GLN 25 HN GLN 25 8.712 -18.461 -7.631
164 HA GLN 25 HA GLN 25 10.241 -17.354 -5.486
165 HB2 GLN 25 HB2 GLN 25 8.641 -19.905 -5.716
166 HB3 GLN 25 HB1 GLN 25 9.469 -19.428 -4.240
167 HG2 GLN 25 HG2 GLN 25 8.116 -17.424 -4.086
168 HG3 GLN 25 HG1 GLN 25 7.341 -17.799 -5.624
169 HE21 GLN 25 HE21 GLN 25 5.283 -17.868 -4.729
170 HE22 GLN 25 HE22 GLN 25 4.758 -19.148 -3.694
171 H THR 26 HN THR 26 10.684 -20.071 -7.669
172 HA THR 26 HA THR 26 12.969 -21.112 -6.286
173 HB THR 26 HB THR 26 13.357 -22.425 -8.395
174 HG1 THR 26 HG1 THR 26 10.945 -21.158 -9.236
175 HG21 THR 26 HG21 THR 26 11.946 -23.341 -6.612
176 HG22 THR 26 HG22 THR 26 11.340 -23.811 -8.198
177 HG23 THR 26 HG23 THR 26 10.539 -22.525 -7.297
178 H GLU 27 HN GLU 27 12.417 -18.693 -8.743
179 HA GLU 27 HA GLU 27 15.194 -18.439 -9.456
180 HB2 GLU 27 HB2 GLU 27 12.866 -16.582 -9.992
181 HB3 GLU 27 HB1 GLU 27 14.475 -16.407 -10.678
182 HG2 GLU 27 HG2 GLU 27 12.554 -18.676 -11.154
183 HG3 GLU 27 HG1 GLU 27 12.973 -17.398 -12.290
184 H ARG 28 HN ARG 28 12.982 -16.816 -7.240
185 HA ARG 28 HA ARG 28 15.095 -15.661 -5.706
186 HB2 ARG 28 HB2 ARG 28 15.094 -14.138 -7.668
187 HB3 ARG 28 HB1 ARG 28 13.393 -13.792 -7.390
188 HG2 ARG 28 HG2 ARG 28 14.763 -11.981 -6.570
189 HG3 ARG 28 HG1 ARG 28 13.974 -12.793 -5.215
190 HD2 ARG 28 HD2 ARG 28 16.025 -13.994 -4.707
191 HD3 ARG 28 HD1 ARG 28 16.818 -13.287 -6.116
192 HE ARG 28 HE ARG 28 15.953 -11.156 -4.593
193 HH11 ARG 28 HH11 ARG 28 18.094 -13.884 -4.110
194 HH12 ARG 28 HH12 ARG 28 19.136 -13.026 -3.018
195 HH21 ARG 28 HH21 ARG 28 17.316 -10.028 -3.181
196 HH22 ARG 28 HH22 ARG 28 18.714 -10.816 -2.513
197 H PHE 29 HN PHE 29 14.238 -14.522 -3.805
198 HA PHE 29 HA PHE 29 11.764 -15.529 -2.852
199 HB2 PHE 29 HB2 PHE 29 13.457 -13.230 -1.821
200 HB3 PHE 29 HB1 PHE 29 12.103 -13.951 -0.953
201 HD1 PHE 29 HD2 PHE 29 12.254 -16.544 -0.628
202 HD2 PHE 29 HD1 PHE 29 15.590 -14.008 -1.378
203 HE1 PHE 29 HE2 PHE 29 13.758 -18.234 0.348
204 HE2 PHE 29 HE1 PHE 29 17.097 -15.697 -0.416
205 HZ PHE 29 HZ PHE 29 16.181 -17.812 0.451
206 H SER 30 HN SER 30 10.276 -15.020 -4.425
207 HA SER 30 HA SER 30 8.913 -12.528 -4.182
208 HB2 SER 30 HB2 SER 30 10.351 -13.169 -6.783
209 HB3 SER 30 HB1 SER 30 9.076 -11.959 -6.639
210 HG SER 30 HG SER 30 11.418 -11.897 -5.044
211 H GLY 31 HN GLY 31 6.909 -13.244 -4.109
212 HA2 GLY 31 HA2 GLY 31 5.972 -15.725 -5.083
213 HA3 GLY 31 HA1 GLY 31 4.958 -14.376 -4.587
214 H GLY 32 HN GLY 32 3.856 -15.645 -6.573
215 HA2 GLY 32 HA2 GLY 32 4.515 -14.049 -8.970
216 HA3 GLY 32 HA1 GLY 32 4.341 -15.791 -9.095
217 H ARG 33 HN ARG 33 2.858 -14.017 -10.595
218 HA ARG 33 HA ARG 33 0.232 -15.027 -10.105
219 HB2 ARG 33 HB2 ARG 33 -0.907 -12.816 -10.022
220 HB3 ARG 33 HB1 ARG 33 0.070 -13.120 -8.593
221 HG2 ARG 33 HG2 ARG 33 1.652 -11.522 -9.168
222 HG3 ARG 33 HG1 ARG 33 1.232 -11.574 -10.879
223 HD2 ARG 33 HD2 ARG 33 0.508 -9.484 -9.765
224 HD3 ARG 33 HD1 ARG 33 -0.827 -10.395 -10.466
225 HE ARG 33 HE ARG 33 -0.868 -11.246 -7.927
226 HH11 ARG 33 HH11 ARG 33 -0.631 -8.004 -9.251
227 HH12 ARG 33 HH12 ARG 33 -1.505 -7.273 -7.940
228 HH21 ARG 33 HH21 ARG 33 -2.041 -10.271 -6.209
229 HH22 ARG 33 HH22 ARG 33 -2.305 -8.552 -6.227
230 H CYS 34 HN CYS 34 -1.281 -14.234 -11.856
231 HA CYS 34 HA CYS 34 0.186 -13.351 -14.263
232 HB2 CYS 34 HB2 CYS 34 -2.343 -15.011 -14.044
233 HB3 CYS 34 HB1 CYS 34 -1.707 -14.372 -15.557
234 H ARG 35 HN ARG 35 -0.291 -11.358 -14.942
235 HA ARG 35 HA ARG 35 -2.776 -10.063 -14.034
236 HB2 ARG 35 HB2 ARG 35 -0.932 -9.640 -12.402
237 HB3 ARG 35 HB1 ARG 35 0.016 -8.926 -13.693
238 HG2 ARG 35 HG2 ARG 35 -0.949 -7.200 -12.332
239 HG3 ARG 35 HG1 ARG 35 -1.692 -7.161 -13.935
240 HD2 ARG 35 HD2 ARG 35 -3.707 -8.054 -13.144
241 HD3 ARG 35 HD1 ARG 35 -2.963 -8.665 -11.662
242 HE ARG 35 HE ARG 35 -2.651 -5.950 -11.525
243 HH11 ARG 35 HH11 ARG 35 -5.410 -8.049 -11.972
244 HH12 ARG 35 HH12 ARG 35 -6.485 -7.047 -11.046
245 HH21 ARG 35 HH21 ARG 35 -4.066 -4.616 -10.321
246 HH22 ARG 35 HH22 ARG 35 -5.728 -5.093 -10.118
247 H GLY 36 HN GLY 36 -3.286 -8.105 -15.235
248 HA2 GLY 36 HA2 GLY 36 -2.938 -6.513 -16.933
249 HA3 GLY 36 HA1 GLY 36 -1.634 -7.502 -17.572
250 H PHE 37 HN PHE 37 -3.541 -6.378 -19.201
251 HA PHE 37 HA PHE 37 -5.767 -8.028 -19.777
252 HB2 PHE 37 HB2 PHE 37 -4.315 -6.202 -21.711
253 HB3 PHE 37 HB1 PHE 37 -5.997 -6.718 -21.793
254 HD1 PHE 37 HD2 PHE 37 -7.595 -5.915 -19.994
255 HD2 PHE 37 HD1 PHE 37 -3.701 -4.268 -20.516
256 HE1 PHE 37 HE2 PHE 37 -8.262 -3.927 -18.708
257 HE2 PHE 37 HE1 PHE 37 -4.364 -2.281 -19.226
258 HZ PHE 37 HZ PHE 37 -6.650 -2.110 -18.323
259 H ARG 38 HN ARG 38 -2.427 -8.074 -20.724
260 HA ARG 38 HA ARG 38 -2.717 -9.948 -22.881
261 HB2 ARG 38 HB2 ARG 38 -0.837 -8.308 -22.705
262 HB3 ARG 38 HB1 ARG 38 -0.237 -9.185 -21.308
263 HG2 ARG 38 HG2 ARG 38 1.060 -9.829 -23.207
264 HG3 ARG 38 HG1 ARG 38 0.034 -11.195 -22.760
265 HD2 ARG 38 HD2 ARG 38 0.075 -10.877 -25.185
266 HD3 ARG 38 HD1 ARG 38 -1.541 -10.603 -24.532
267 HE ARG 38 HE ARG 38 0.076 -8.220 -24.823
268 HH11 ARG 38 HH11 ARG 38 -2.207 -10.362 -26.406
269 HH12 ARG 38 HH12 ARG 38 -2.801 -9.131 -27.478
270 HH21 ARG 38 HH21 ARG 38 -0.657 -6.633 -26.261
271 HH22 ARG 38 HH22 ARG 38 -1.887 -7.021 -27.426
272 H ARG 39 HN ARG 39 -2.915 -10.245 -19.545
273 HA ARG 39 HA ARG 39 -2.622 -11.867 -17.986
274 HB2 ARG 39 HB2 ARG 39 -3.053 -13.578 -20.441
275 HB3 ARG 39 HB1 ARG 39 -2.769 -14.291 -18.863
276 HG2 ARG 39 HG2 ARG 39 -5.107 -14.286 -19.227
277 HG3 ARG 39 HG1 ARG 39 -4.771 -13.040 -18.026
278 HD2 ARG 39 HD2 ARG 39 -5.046 -11.302 -19.643
279 HD3 ARG 39 HD1 ARG 39 -5.107 -12.467 -20.970
280 HE ARG 39 HE ARG 39 -7.160 -13.013 -19.100
281 HH11 ARG 39 HH11 ARG 39 -6.319 -10.682 -21.568
282 HH12 ARG 39 HH12 ARG 39 -7.968 -10.324 -21.968
283 HH21 ARG 39 HH21 ARG 39 -9.317 -12.557 -19.623
284 HH22 ARG 39 HH22 ARG 39 -9.681 -11.393 -20.858
285 H ARG 40 HN ARG 40 -0.367 -10.803 -18.112
286 HA ARG 40 HA ARG 40 1.646 -12.720 -19.062
287 HB2 ARG 40 HB2 ARG 40 1.699 -10.188 -19.656
288 HB3 ARG 40 HB1 ARG 40 2.277 -9.967 -18.011
289 HG2 ARG 40 HG2 ARG 40 4.200 -10.068 -19.379
290 HG3 ARG 40 HG1 ARG 40 4.104 -11.624 -18.547
291 HD2 ARG 40 HD2 ARG 40 2.741 -12.288 -20.725
292 HD3 ARG 40 HD1 ARG 40 3.676 -10.968 -21.418
293 HE ARG 40 HE ARG 40 4.912 -13.312 -20.105
294 HH11 ARG 40 HH11 ARG 40 4.852 -10.929 -22.672
295 HH12 ARG 40 HH12 ARG 40 6.192 -11.635 -23.521
296 HH21 ARG 40 HH21 ARG 40 6.657 -14.247 -21.233
297 HH22 ARG 40 HH22 ARG 40 7.216 -13.516 -22.705
298 H CYS 41 HN CYS 41 3.525 -13.093 -17.665
299 HA CYS 41 HA CYS 41 2.656 -13.793 -15.012
300 HB2 CYS 41 HB2 CYS 41 4.038 -15.280 -16.501
301 HB3 CYS 41 HB1 CYS 41 5.386 -14.174 -16.260
302 H PHE 42 HN PHE 42 2.762 -12.417 -13.395
303 HA PHE 42 HA PHE 42 4.977 -10.472 -13.239
304 HB2 PHE 42 HB2 PHE 42 2.102 -10.297 -12.300
305 HB3 PHE 42 HB1 PHE 42 3.348 -9.224 -11.678
306 HD1 PHE 42 HD2 PHE 42 1.876 -10.365 -14.921
307 HD2 PHE 42 HD1 PHE 42 3.724 -7.206 -12.740
308 HE1 PHE 42 HE2 PHE 42 1.518 -8.840 -16.821
309 HE2 PHE 42 HE1 PHE 42 3.364 -5.679 -14.634
310 HZ PHE 42 HZ PHE 42 2.259 -6.500 -16.680
311 H CYS 43 HN CYS 43 5.814 -10.050 -11.116
312 HA CYS 43 HA CYS 43 5.499 -12.335 -9.271
313 HB2 CYS 43 HB2 CYS 43 7.931 -10.674 -9.946
314 HB3 CYS 43 HB1 CYS 43 7.855 -11.696 -8.517
315 H THR 44 HN THR 44 5.282 -11.937 -7.089
316 HA THR 44 HA THR 44 4.849 -9.120 -6.322
317 HB THR 44 HB THR 44 3.298 -10.042 -4.571
318 HG1 THR 44 HG1 THR 44 4.034 -12.192 -4.520
319 HG21 THR 44 HG21 THR 44 2.422 -9.112 -6.669
320 HG22 THR 44 HG22 THR 44 1.427 -10.453 -6.102
321 HG23 THR 44 HG23 THR 44 2.561 -10.697 -7.431
322 H THR 45 HN THR 45 6.386 -8.382 -5.029
323 HA THR 45 HA THR 45 7.522 -10.160 -2.978
324 HB THR 45 HB THR 45 9.136 -9.923 -4.865
325 HG1 THR 45 HG1 THR 45 10.576 -10.073 -3.328
326 HG21 THR 45 HG21 THR 45 8.515 -7.658 -5.596
327 HG22 THR 45 HG22 THR 45 10.241 -7.763 -5.243
328 HG23 THR 45 HG23 THR 45 9.149 -6.996 -4.089
329 H HIS 46 HN HIS 46 9.002 -8.547 -1.524
330 HA HIS 46 HA HIS 46 7.041 -6.601 -0.513
331 HB2 HIS 46 HB2 HIS 46 7.593 -8.367 1.061
332 HB3 HIS 46 HB1 HIS 46 9.314 -8.050 0.875
333 HD1 HIS 46 HD1 HIS 46 10.293 -6.025 2.135
334 HD2 HIS 46 HD2 HIS 46 6.212 -6.559 2.716
335 HE1 HIS 46 HE1 HIS 46 9.693 -4.551 4.074
336 HE2 HIS 46 HE2 HIS 46 7.262 -5.032 4.518
337 H CYS 47 HN CYS 47 7.470 -4.505 -0.605
338 HA CYS 47 HA CYS 47 10.221 -3.590 -1.035
339 HB2 CYS 47 HB2 CYS 47 7.559 -2.189 -1.374
340 HB3 CYS 47 HB1 CYS 47 9.109 -1.356 -1.477
Start of MODEL 9
1 H1 ARG 1 HT1 ARG 1 5.171 -2.507 2.609
2 H2 ARG 1 HT2 ARG 1 3.634 -3.216 2.647
3 H3 ARG 1 HT3 ARG 1 3.812 -1.565 2.957
4 HA ARG 1 HA ARG 1 2.938 -1.888 0.772
5 HB2 ARG 1 HB2 ARG 1 4.411 0.024 1.117
6 HB3 ARG 1 HB1 ARG 1 5.825 -0.974 0.796
7 HG2 ARG 1 HG2 ARG 1 5.033 -1.316 -1.513
8 HG3 ARG 1 HG1 ARG 1 3.655 -0.266 -1.180
9 HD2 ARG 1 HD2 ARG 1 5.156 1.596 -0.738
10 HD3 ARG 1 HD1 ARG 1 6.555 0.551 -0.995
11 HE ARG 1 HE ARG 1 4.714 0.696 -3.221
12 HH11 ARG 1 HH11 ARG 1 7.594 2.006 -1.746
13 HH12 ARG 1 HH12 ARG 1 8.177 2.715 -3.214
14 HH21 ARG 1 HH21 ARG 1 5.463 1.635 -5.149
15 HH22 ARG 1 HH22 ARG 1 6.955 2.526 -5.152
16 H THR 2 HN THR 2 2.715 -3.159 -0.926
17 HA THR 2 HA THR 2 4.737 -5.242 -1.416
18 HB THR 2 HB THR 2 1.804 -5.224 -2.194
19 HG1 THR 2 HG1 THR 2 1.732 -6.854 -0.478
20 HG21 THR 2 HG21 THR 2 2.168 -7.638 -2.630
21 HG22 THR 2 HG22 THR 2 3.890 -7.423 -2.313
22 HG23 THR 2 HG23 THR 2 3.141 -6.624 -3.695
23 H CYS 3 HN CYS 3 5.757 -5.295 -3.317
24 HA CYS 3 HA CYS 3 4.937 -3.386 -5.410
25 HB2 CYS 3 HB2 CYS 3 7.724 -4.362 -4.695
26 HB3 CYS 3 HB1 CYS 3 7.335 -3.241 -6.002
27 H GLU 4 HN GLU 4 5.373 -4.060 -7.626
28 HA GLU 4 HA GLU 4 5.174 -6.997 -7.897
29 HB2 GLU 4 HB2 GLU 4 3.185 -5.293 -8.500
30 HB3 GLU 4 HB1 GLU 4 4.071 -5.194 -10.012
31 HG2 GLU 4 HG2 GLU 4 3.792 -7.525 -10.424
32 HG3 GLU 4 HG1 GLU 4 3.118 -7.783 -8.811
33 H SER 5 HN SER 5 6.129 -7.940 -9.737
34 HA SER 5 HA SER 5 7.909 -6.309 -11.385
35 HB2 SER 5 HB2 SER 5 9.260 -7.120 -9.441
36 HB3 SER 5 HB1 SER 5 8.847 -8.778 -9.878
37 HG SER 5 HG SER 5 10.241 -6.924 -11.526
38 H GLN 6 HN GLN 6 8.863 -7.846 -13.170
39 HA GLN 6 HA GLN 6 6.697 -9.697 -13.955
40 HB2 GLN 6 HB2 GLN 6 6.923 -7.647 -15.376
41 HB3 GLN 6 HB1 GLN 6 8.548 -8.167 -15.804
42 HG2 GLN 6 HG2 GLN 6 7.660 -10.179 -16.846
43 HG3 GLN 6 HG1 GLN 6 6.026 -9.728 -16.362
44 HE21 GLN 6 HE21 GLN 6 7.044 -10.228 -19.024
45 HE22 GLN 6 HE22 GLN 6 6.759 -8.784 -19.930
46 H SER 7 HN SER 7 7.206 -11.725 -14.546
47 HA SER 7 HA SER 7 10.054 -12.469 -14.471
48 HB2 SER 7 HB2 SER 7 9.075 -14.773 -13.835
49 HB3 SER 7 HB1 SER 7 9.018 -13.500 -12.614
50 HG SER 7 HG SER 7 7.000 -14.302 -12.629
51 H HIS 8 HN HIS 8 10.618 -12.445 -16.571
52 HA HIS 8 HA HIS 8 8.908 -13.641 -18.598
53 HB2 HIS 8 HB2 HIS 8 10.199 -11.549 -19.053
54 HB3 HIS 8 HB1 HIS 8 11.692 -12.462 -18.888
55 HD1 HIS 8 HD1 HIS 8 12.525 -12.300 -21.269
56 HD2 HIS 8 HD2 HIS 8 8.606 -13.670 -21.028
57 HE1 HIS 8 HE1 HIS 8 11.912 -13.015 -23.600
58 HE2 HIS 8 HE2 HIS 8 9.486 -13.664 -23.457
59 H LYS 9 HN LYS 9 10.941 -14.802 -16.331
60 HA LYS 9 HA LYS 9 12.368 -16.825 -17.695
61 HB2 LYS 9 HB2 LYS 9 12.675 -16.078 -15.284
62 HB3 LYS 9 HB1 LYS 9 11.223 -16.987 -14.897
63 HG2 LYS 9 HG2 LYS 9 12.334 -19.045 -15.696
64 HG3 LYS 9 HG1 LYS 9 13.803 -18.110 -15.988
65 HD2 LYS 9 HD2 LYS 9 13.705 -17.446 -13.537
66 HD3 LYS 9 HD1 LYS 9 12.452 -18.675 -13.349
67 HE2 LYS 9 HE2 LYS 9 14.620 -19.573 -12.717
68 HE3 LYS 9 HE1 LYS 9 14.027 -20.378 -14.170
69 HZ1 LYS 9 HZ1 LYS 9 15.953 -18.120 -14.200
70 HZ2 LYS 9 HZ2 LYS 9 15.496 -19.087 -15.507
71 HZ3 LYS 9 HZ3 LYS 9 16.408 -19.746 -14.249
72 H PHE 10 HN PHE 10 9.122 -16.541 -16.416
73 HA PHE 10 HA PHE 10 8.323 -19.199 -17.216
74 HB2 PHE 10 HB2 PHE 10 7.353 -17.925 -15.240
75 HB3 PHE 10 HB1 PHE 10 6.553 -16.873 -16.405
76 HD1 PHE 10 HD2 PHE 10 6.862 -20.420 -15.364
77 HD2 PHE 10 HD1 PHE 10 4.464 -17.478 -17.296
78 HE1 PHE 10 HE2 PHE 10 5.003 -22.019 -15.483
79 HE2 PHE 10 HE1 PHE 10 2.601 -19.081 -17.417
80 HZ PHE 10 HZ PHE 10 2.870 -21.355 -16.514
81 H LYS 11 HN LYS 11 7.877 -19.684 -19.260
82 HA LYS 11 HA LYS 11 7.866 -17.601 -21.240
83 HB2 LYS 11 HB2 LYS 11 7.864 -19.471 -22.869
84 HB3 LYS 11 HB1 LYS 11 9.152 -19.589 -21.679
85 HG2 LYS 11 HG2 LYS 11 7.748 -21.226 -20.415
86 HG3 LYS 11 HG1 LYS 11 6.590 -21.185 -21.743
87 HD2 LYS 11 HD2 LYS 11 9.495 -21.984 -22.015
88 HD3 LYS 11 HD1 LYS 11 8.160 -23.118 -21.834
89 HE2 LYS 11 HE2 LYS 11 8.698 -23.009 -24.152
90 HE3 LYS 11 HE1 LYS 11 7.172 -22.163 -23.930
91 HZ1 LYS 11 HZ1 LYS 11 9.797 -20.789 -24.078
92 HZ2 LYS 11 HZ2 LYS 11 8.264 -20.078 -24.127
93 HZ3 LYS 11 HZ3 LYS 11 8.794 -21.032 -25.416
94 H GLY 12 HN GLY 12 6.104 -16.537 -21.794
95 HA2 GLY 12 HA2 GLY 12 4.094 -16.444 -23.034
96 HA3 GLY 12 HA1 GLY 12 3.690 -18.058 -22.467
97 HA PRO 13 HA PRO 13 1.166 -15.311 -19.789
98 HB2 PRO 13 HB2 PRO 13 -1.179 -16.547 -20.127
99 HB3 PRO 13 HB1 PRO 13 -0.536 -15.485 -21.386
100 HG2 PRO 13 HG2 PRO 13 -0.509 -18.478 -21.243
101 HG3 PRO 13 HG1 PRO 13 -0.837 -17.427 -22.633
102 HD2 PRO 13 HD2 PRO 13 1.601 -18.640 -22.105
103 HD3 PRO 13 HD1 PRO 13 1.387 -17.204 -23.127
104 H CYS 14 HN CYS 14 -0.001 -15.880 -17.770
105 HA CYS 14 HA CYS 14 1.277 -18.069 -16.424
106 HB2 CYS 14 HB2 CYS 14 -0.068 -17.357 -14.458
107 HB3 CYS 14 HB1 CYS 14 0.839 -16.034 -15.180
108 H ALA 15 HN ALA 15 0.520 -19.735 -17.866
109 HA ALA 15 HA ALA 15 -2.139 -20.468 -18.250
110 HB1 ALA 15 HB1 ALA 15 0.280 -22.273 -18.138
111 HB2 ALA 15 HB2 ALA 15 -0.288 -21.391 -19.554
112 HB3 ALA 15 HB3 ALA 15 -1.278 -22.673 -18.859
113 H SER 16 HN SER 16 -0.020 -21.012 -15.534
114 HA SER 16 HA SER 16 -2.269 -22.026 -13.994
115 HB2 SER 16 HB2 SER 16 0.358 -23.533 -14.194
116 HB3 SER 16 HB1 SER 16 -0.972 -23.929 -13.105
117 HG SER 16 HG SER 16 -2.048 -23.769 -15.484
118 H ASP 17 HN ASP 17 -2.272 -21.339 -11.968
119 HA ASP 17 HA ASP 17 -0.738 -19.160 -11.159
120 HB2 ASP 17 HB2 ASP 17 -2.219 -21.089 -9.344
121 HB3 ASP 17 HB1 ASP 17 -1.801 -19.418 -8.982
122 H HIS 18 HN HIS 18 -0.640 -22.513 -10.001
123 HA HIS 18 HA HIS 18 1.439 -22.350 -8.186
124 HB2 HIS 18 HB2 HIS 18 0.002 -24.361 -8.552
125 HB3 HIS 18 HB1 HIS 18 0.869 -24.659 -10.058
126 HD1 HIS 18 HD1 HIS 18 2.595 -26.390 -9.828
127 HD2 HIS 18 HD2 HIS 18 2.043 -24.308 -6.275
128 HE1 HIS 18 HE1 HIS 18 4.193 -27.422 -8.187
129 HE2 HIS 18 HE2 HIS 18 3.709 -26.268 -6.005
130 H ASN 19 HN ASN 19 1.571 -22.938 -11.667
131 HA ASN 19 HA ASN 19 4.318 -23.476 -11.805
132 HB2 ASN 19 HB2 ASN 19 2.414 -22.484 -13.934
133 HB3 ASN 19 HB1 ASN 19 4.072 -22.976 -14.259
134 HD21 ASN 19 HD21 ASN 19 3.470 -24.675 -15.590
135 HD22 ASN 19 HD22 ASN 19 2.719 -26.108 -14.991
136 H CYS 20 HN CYS 20 2.553 -20.479 -12.672
137 HA CYS 20 HA CYS 20 4.787 -18.911 -13.279
138 HB2 CYS 20 HB2 CYS 20 2.628 -18.105 -13.894
139 HB3 CYS 20 HB1 CYS 20 2.032 -18.209 -12.245
140 H ALA 21 HN ALA 21 3.022 -19.210 -10.212
141 HA ALA 21 HA ALA 21 4.528 -17.455 -8.670
142 HB1 ALA 21 HB1 ALA 21 3.607 -18.627 -6.728
143 HB2 ALA 21 HB2 ALA 21 3.094 -19.957 -7.769
144 HB3 ALA 21 HB3 ALA 21 2.370 -18.362 -7.956
145 H SER 22 HN SER 22 4.870 -20.990 -8.985
146 HA SER 22 HA SER 22 6.965 -21.276 -7.158
147 HB2 SER 22 HB2 SER 22 5.536 -23.135 -8.021
148 HB3 SER 22 HB1 SER 22 6.391 -23.029 -9.558
149 HG SER 22 HG SER 22 7.917 -23.313 -7.227
150 H VAL 23 HN VAL 23 7.043 -20.847 -10.695
151 HA VAL 23 HA VAL 23 9.824 -21.055 -11.027
152 HB VAL 23 HB VAL 23 7.817 -19.435 -12.620
153 HG11 VAL 23 HG11 VAL 23 10.047 -18.512 -12.975
154 HG12 VAL 23 HG12 VAL 23 9.517 -19.387 -14.411
155 HG13 VAL 23 HG13 VAL 23 10.683 -20.124 -13.312
156 HG21 VAL 23 HG21 VAL 23 8.005 -21.302 -14.231
157 HG22 VAL 23 HG22 VAL 23 7.370 -21.819 -12.670
158 HG23 VAL 23 HG23 VAL 23 9.048 -22.157 -13.094
159 H CYS 24 HN CYS 24 7.774 -18.178 -10.520
160 HA CYS 24 HA CYS 24 9.845 -16.303 -10.421
161 HB2 CYS 24 HB2 CYS 24 7.519 -15.601 -10.558
162 HB3 CYS 24 HB1 CYS 24 7.198 -16.258 -8.954
163 H GLN 25 HN GLN 25 8.410 -18.222 -7.791
164 HA GLN 25 HA GLN 25 9.831 -16.988 -5.689
165 HB2 GLN 25 HB2 GLN 25 8.627 -19.760 -5.848
166 HB3 GLN 25 HB1 GLN 25 9.224 -19.019 -4.369
167 HG2 GLN 25 HG2 GLN 25 7.543 -17.255 -4.571
168 HG3 GLN 25 HG1 GLN 25 6.950 -17.988 -6.059
169 HE21 GLN 25 HE21 GLN 25 5.555 -17.478 -3.567
170 HE22 GLN 25 HE22 GLN 25 4.959 -19.000 -3.010
171 H THR 26 HN THR 26 10.627 -19.638 -7.847
172 HA THR 26 HA THR 26 12.914 -20.476 -6.327
173 HB THR 26 HB THR 26 13.502 -21.822 -8.360
174 HG1 THR 26 HG1 THR 26 11.010 -20.879 -9.370
175 HG21 THR 26 HG21 THR 26 11.587 -23.359 -8.196
176 HG22 THR 26 HG22 THR 26 10.664 -22.112 -7.355
177 HG23 THR 26 HG23 THR 26 12.112 -22.792 -6.609
178 H GLU 27 HN GLU 27 12.363 -18.312 -9.091
179 HA GLU 27 HA GLU 27 15.186 -17.877 -9.505
180 HB2 GLU 27 HB2 GLU 27 14.545 -16.155 -11.082
181 HB3 GLU 27 HB1 GLU 27 13.561 -17.590 -11.338
182 HG2 GLU 27 HG2 GLU 27 11.675 -16.576 -10.297
183 HG3 GLU 27 HG1 GLU 27 12.635 -15.198 -9.758
184 H ARG 28 HN ARG 28 12.714 -16.433 -7.514
185 HA ARG 28 HA ARG 28 14.582 -14.980 -5.937
186 HB2 ARG 28 HB2 ARG 28 14.538 -13.494 -7.919
187 HB3 ARG 28 HB1 ARG 28 12.795 -13.351 -7.772
188 HG2 ARG 28 HG2 ARG 28 13.699 -11.372 -6.873
189 HG3 ARG 28 HG1 ARG 28 13.176 -12.337 -5.494
190 HD2 ARG 28 HD2 ARG 28 16.017 -12.345 -6.496
191 HD3 ARG 28 HD1 ARG 28 15.436 -11.182 -5.308
192 HE ARG 28 HE ARG 28 15.442 -14.109 -4.868
193 HH11 ARG 28 HH11 ARG 28 15.977 -10.835 -3.743
194 HH12 ARG 28 HH12 ARG 28 16.357 -11.320 -2.123
195 HH21 ARG 28 HH21 ARG 28 15.946 -14.740 -2.710
196 HH22 ARG 28 HH22 ARG 28 16.315 -13.522 -1.529
197 H PHE 29 HN PHE 29 13.643 -14.406 -3.964
198 HA PHE 29 HA PHE 29 11.125 -15.393 -3.253
199 HB2 PHE 29 HB2 PHE 29 12.984 -14.834 -1.671
200 HB3 PHE 29 HB1 PHE 29 12.584 -13.139 -1.891
201 HD1 PHE 29 HD1 PHE 29 11.429 -16.340 -0.533
202 HD2 PHE 29 HD2 PHE 29 10.652 -12.164 -0.825
203 HE1 PHE 29 HE1 PHE 29 9.722 -16.536 1.235
204 HE2 PHE 29 HE2 PHE 29 8.951 -12.351 0.948
205 HZ PHE 29 HZ PHE 29 8.483 -14.538 1.975
206 H SER 30 HN SER 30 9.508 -14.809 -4.336
207 HA SER 30 HA SER 30 8.250 -12.291 -4.104
208 HB2 SER 30 HB2 SER 30 9.392 -13.041 -6.820
209 HB3 SER 30 HB1 SER 30 8.175 -11.793 -6.571
210 HG SER 30 HG SER 30 10.204 -11.338 -4.906
211 H GLY 31 HN GLY 31 6.234 -12.915 -3.855
212 HA2 GLY 31 HA2 GLY 31 5.075 -15.355 -4.564
213 HA3 GLY 31 HA1 GLY 31 4.176 -13.879 -4.238
214 H GLY 32 HN GLY 32 2.898 -15.251 -6.006
215 HA2 GLY 32 HA2 GLY 32 3.904 -14.509 -8.695
216 HA3 GLY 32 HA1 GLY 32 2.961 -15.953 -8.359
217 H ARG 33 HN ARG 33 2.490 -13.731 -10.235
218 HA ARG 33 HA ARG 33 -0.238 -13.028 -9.467
219 HB2 ARG 33 HB2 ARG 33 1.053 -11.203 -8.520
220 HB3 ARG 33 HB1 ARG 33 1.955 -11.004 -10.013
221 HG2 ARG 33 HG2 ARG 33 0.345 -9.236 -9.798
222 HG3 ARG 33 HG1 ARG 33 -0.115 -10.283 -11.140
223 HD2 ARG 33 HD2 ARG 33 -1.737 -11.418 -9.654
224 HD3 ARG 33 HD1 ARG 33 -1.306 -10.292 -8.363
225 HE ARG 33 HE ARG 33 -2.008 -8.649 -10.387
226 HH11 ARG 33 HH11 ARG 33 -3.604 -11.363 -8.849
227 HH12 ARG 33 HH12 ARG 33 -5.201 -10.787 -9.202
228 HH21 ARG 33 HH21 ARG 33 -4.117 -7.887 -10.846
229 HH22 ARG 33 HH22 ARG 33 -5.491 -8.819 -10.343
230 H CYS 34 HN CYS 34 -1.516 -12.356 -11.274
231 HA CYS 34 HA CYS 34 -0.266 -12.758 -13.917
232 HB2 CYS 34 HB2 CYS 34 -3.120 -13.217 -13.010
233 HB3 CYS 34 HB1 CYS 34 -2.620 -13.241 -14.698
234 H ARG 35 HN ARG 35 0.127 -10.866 -14.862
235 HA ARG 35 HA ARG 35 -1.942 -8.780 -14.793
236 HB2 ARG 35 HB2 ARG 35 -0.247 -8.304 -13.001
237 HB3 ARG 35 HB1 ARG 35 0.990 -8.223 -14.242
238 HG2 ARG 35 HG2 ARG 35 0.198 -6.007 -13.482
239 HG3 ARG 35 HG1 ARG 35 -0.027 -6.269 -15.213
240 HD2 ARG 35 HD2 ARG 35 -2.350 -6.616 -14.962
241 HD3 ARG 35 HD1 ARG 35 -2.214 -6.791 -13.214
242 HE ARG 35 HE ARG 35 -2.508 -4.554 -13.058
243 HH11 ARG 35 HH11 ARG 35 -0.972 -5.109 -16.173
244 HH12 ARG 35 HH12 ARG 35 -1.164 -3.466 -16.685
245 HH21 ARG 35 HH21 ARG 35 -2.742 -2.407 -13.749
246 HH22 ARG 35 HH22 ARG 35 -2.152 -1.928 -15.309
247 H GLY 36 HN GLY 36 -2.091 -7.611 -16.658
248 HA2 GLY 36 HA2 GLY 36 -0.908 -6.765 -18.674
249 HA3 GLY 36 HA1 GLY 36 -0.250 -8.389 -18.841
250 H PHE 37 HN PHE 37 -1.568 -7.317 -20.956
251 HA PHE 37 HA PHE 37 -4.370 -7.727 -20.986
252 HB2 PHE 37 HB2 PHE 37 -2.389 -7.617 -23.277
253 HB3 PHE 37 HB1 PHE 37 -4.140 -7.567 -23.461
254 HD1 PHE 37 HD1 PHE 37 -5.412 -5.590 -22.771
255 HD2 PHE 37 HD2 PHE 37 -1.159 -5.694 -22.470
256 HE1 PHE 37 HE1 PHE 37 -5.368 -3.147 -22.499
257 HE2 PHE 37 HE2 PHE 37 -1.119 -3.250 -22.199
258 HZ PHE 37 HZ PHE 37 -3.220 -1.971 -22.215
259 H ARG 38 HN ARG 38 -1.630 -9.765 -21.919
260 HA ARG 38 HA ARG 38 -3.446 -11.979 -22.524
261 HB2 ARG 38 HB2 ARG 38 -1.492 -11.247 -24.013
262 HB3 ARG 38 HB1 ARG 38 -0.436 -11.922 -22.783
263 HG2 ARG 38 HG2 ARG 38 -0.730 -13.503 -24.541
264 HG3 ARG 38 HG1 ARG 38 -1.529 -14.113 -23.094
265 HD2 ARG 38 HD2 ARG 38 -3.694 -13.400 -23.966
266 HD3 ARG 38 HD1 ARG 38 -2.914 -12.708 -25.389
267 HE ARG 38 HE ARG 38 -2.198 -15.404 -25.244
268 HH11 ARG 38 HH11 ARG 38 -5.096 -13.489 -25.770
269 HH12 ARG 38 HH12 ARG 38 -5.866 -14.699 -26.748
270 HH21 ARG 38 HH21 ARG 38 -3.209 -16.985 -26.520
271 HH22 ARG 38 HH22 ARG 38 -4.797 -16.696 -27.160
272 H ARG 39 HN ARG 39 -2.608 -10.789 -19.805
273 HA ARG 39 HA ARG 39 -2.104 -11.458 -17.706
274 HB2 ARG 39 HB2 ARG 39 -3.066 -14.110 -18.806
275 HB3 ARG 39 HB1 ARG 39 -2.688 -13.844 -17.111
276 HG2 ARG 39 HG2 ARG 39 -5.038 -13.655 -17.334
277 HG3 ARG 39 HG1 ARG 39 -4.411 -12.024 -17.098
278 HD2 ARG 39 HD2 ARG 39 -4.547 -11.633 -19.521
279 HD3 ARG 39 HD1 ARG 39 -5.197 -13.259 -19.741
280 HE ARG 39 HE ARG 39 -6.611 -11.293 -18.061
281 HH11 ARG 39 HH11 ARG 39 -6.545 -13.462 -20.804
282 HH12 ARG 39 HH12 ARG 39 -8.227 -13.250 -21.176
283 HH21 ARG 39 HH21 ARG 39 -8.817 -10.975 -18.567
284 HH22 ARG 39 HH22 ARG 39 -9.524 -11.848 -19.890
285 H ARG 40 HN ARG 40 0.123 -10.962 -18.139
286 HA ARG 40 HA ARG 40 1.945 -13.155 -18.709
287 HB2 ARG 40 HB2 ARG 40 2.257 -10.766 -19.547
288 HB3 ARG 40 HB1 ARG 40 2.627 -10.321 -17.891
289 HG2 ARG 40 HG2 ARG 40 4.752 -10.659 -18.577
290 HG3 ARG 40 HG1 ARG 40 4.380 -12.339 -18.198
291 HD2 ARG 40 HD2 ARG 40 4.319 -11.003 -20.905
292 HD3 ARG 40 HD1 ARG 40 5.431 -12.253 -20.357
293 HE ARG 40 HE ARG 40 3.345 -13.702 -20.221
294 HH11 ARG 40 HH11 ARG 40 3.744 -11.095 -22.532
295 HH12 ARG 40 HH12 ARG 40 2.665 -11.794 -23.698
296 HH21 ARG 40 HH21 ARG 40 1.900 -14.606 -21.775
297 HH22 ARG 40 HH22 ARG 40 1.627 -13.770 -23.271
298 H CYS 41 HN CYS 41 3.579 -13.832 -17.226
299 HA CYS 41 HA CYS 41 2.691 -14.113 -14.535
300 HB2 CYS 41 HB2 CYS 41 3.977 -15.852 -15.779
301 HB3 CYS 41 HB1 CYS 41 5.388 -14.808 -15.743
302 H PHE 42 HN PHE 42 2.776 -12.499 -13.133
303 HA PHE 42 HA PHE 42 5.194 -10.821 -12.995
304 HB2 PHE 42 HB2 PHE 42 2.302 -10.163 -12.457
305 HB3 PHE 42 HB1 PHE 42 3.563 -9.271 -11.593
306 HD1 PHE 42 HD2 PHE 42 2.812 -10.334 -15.122
307 HD2 PHE 42 HD1 PHE 42 4.198 -7.277 -12.500
308 HE1 PHE 42 HE2 PHE 42 3.073 -8.802 -17.035
309 HE2 PHE 42 HE1 PHE 42 4.455 -5.753 -14.409
310 HZ PHE 42 HZ PHE 42 3.891 -6.513 -16.681
311 H CYS 43 HN CYS 43 5.420 -9.941 -10.657
312 HA CYS 43 HA CYS 43 5.155 -12.191 -8.788
313 HB2 CYS 43 HB2 CYS 43 7.646 -10.574 -9.379
314 HB3 CYS 43 HB1 CYS 43 7.491 -11.720 -8.052
315 H THR 44 HN THR 44 4.957 -11.642 -6.630
316 HA THR 44 HA THR 44 4.646 -8.763 -6.053
317 HB THR 44 HB THR 44 3.107 -9.525 -4.194
318 HG1 THR 44 HG1 THR 44 3.608 -11.685 -4.004
319 HG21 THR 44 HG21 THR 44 2.204 -8.613 -6.275
320 HG22 THR 44 HG22 THR 44 1.175 -9.915 -5.676
321 HG23 THR 44 HG23 THR 44 2.276 -10.208 -7.024
322 H THR 45 HN THR 45 6.269 -8.023 -4.915
323 HA THR 45 HA THR 45 7.569 -9.738 -2.896
324 HB THR 45 HB THR 45 9.058 -9.256 -4.821
325 HG1 THR 45 HG1 THR 45 10.772 -8.254 -3.520
326 HG21 THR 45 HG21 THR 45 8.106 -7.084 -5.474
327 HG22 THR 45 HG22 THR 45 9.851 -6.984 -5.238
328 HG23 THR 45 HG23 THR 45 8.758 -6.363 -4.001
329 H HIS 46 HN HIS 46 8.686 -8.366 -1.162
330 HA HIS 46 HA HIS 46 6.773 -6.306 -0.293
331 HB2 HIS 46 HB2 HIS 46 7.049 -8.194 1.242
332 HB3 HIS 46 HB1 HIS 46 8.787 -7.921 1.300
333 HD1 HIS 46 HD1 HIS 46 5.529 -6.389 2.430
334 HD2 HIS 46 HD2 HIS 46 9.615 -5.997 3.105
335 HE1 HIS 46 HE1 HIS 46 5.746 -4.850 4.408
336 HE2 HIS 46 HE2 HIS 46 8.225 -4.548 4.732
337 H CYS 47 HN CYS 47 7.358 -4.235 -0.304
338 HA CYS 47 HA CYS 47 10.193 -3.545 -0.578
339 HB2 CYS 47 HB2 CYS 47 7.658 -1.993 -1.098
340 HB3 CYS 47 HB1 CYS 47 9.232 -1.209 -1.025
Start of MODEL 10
1 H1 ARG 1 HT1 ARG 1 5.491 -1.817 2.897
2 H2 ARG 1 HT2 ARG 1 6.414 -3.053 2.203
3 H3 ARG 1 HT3 ARG 1 4.825 -3.356 2.688
4 HA ARG 1 HA ARG 1 3.953 -1.922 1.022
5 HB2 ARG 1 HB2 ARG 1 5.728 -0.246 0.983
6 HB3 ARG 1 HB1 ARG 1 6.869 -1.426 0.350
7 HG2 ARG 1 HG2 ARG 1 6.121 0.057 -1.413
8 HG3 ARG 1 HG1 ARG 1 5.557 -1.585 -1.719
9 HD2 ARG 1 HD2 ARG 1 3.384 -0.861 -0.573
10 HD3 ARG 1 HD1 ARG 1 3.982 0.787 -0.755
11 HE ARG 1 HE ARG 1 4.163 -0.377 -3.253
12 HH11 ARG 1 HH11 ARG 1 1.633 0.329 -0.934
13 HH12 ARG 1 HH12 ARG 1 0.398 0.503 -2.144
14 HH21 ARG 1 HH21 ARG 1 2.524 -0.160 -4.852
15 HH22 ARG 1 HH22 ARG 1 0.905 0.240 -4.359
16 H THR 2 HN THR 2 3.209 -3.004 -0.740
17 HA THR 2 HA THR 2 4.648 -5.421 -1.560
18 HB THR 2 HB THR 2 1.841 -4.519 -2.279
19 HG1 THR 2 HG1 THR 2 1.155 -5.860 -0.638
20 HG21 THR 2 HG21 THR 2 1.508 -6.868 -2.944
21 HG22 THR 2 HG22 THR 2 3.202 -7.207 -2.593
22 HG23 THR 2 HG23 THR 2 2.775 -6.102 -3.902
23 H CYS 3 HN CYS 3 5.889 -5.348 -3.337
24 HA CYS 3 HA CYS 3 5.202 -3.398 -5.444
25 HB2 CYS 3 HB2 CYS 3 7.887 -4.393 -4.504
26 HB3 CYS 3 HB1 CYS 3 7.687 -3.757 -6.132
27 H GLU 4 HN GLU 4 4.930 -4.083 -7.472
28 HA GLU 4 HA GLU 4 5.103 -6.983 -7.975
29 HB2 GLU 4 HB2 GLU 4 2.796 -6.077 -7.890
30 HB3 GLU 4 HB1 GLU 4 3.199 -4.957 -9.177
31 HG2 GLU 4 HG2 GLU 4 3.543 -6.818 -10.712
32 HG3 GLU 4 HG1 GLU 4 3.176 -7.960 -9.417
33 H SER 5 HN SER 5 6.296 -7.623 -9.616
34 HA SER 5 HA SER 5 7.165 -5.703 -11.677
35 HB2 SER 5 HB2 SER 5 8.998 -6.105 -10.007
36 HB3 SER 5 HB1 SER 5 8.921 -7.824 -10.385
37 HG SER 5 HG SER 5 10.180 -5.825 -11.701
38 H GLN 6 HN GLN 6 8.515 -7.451 -13.317
39 HA GLN 6 HA GLN 6 6.429 -9.445 -13.967
40 HB2 GLN 6 HB2 GLN 6 6.576 -7.611 -15.618
41 HB3 GLN 6 HB1 GLN 6 8.282 -7.960 -15.857
42 HG2 GLN 6 HG2 GLN 6 7.732 -10.154 -16.760
43 HG3 GLN 6 HG1 GLN 6 6.019 -9.863 -16.466
44 HE21 GLN 6 HE21 GLN 6 6.188 -7.058 -17.300
45 HE22 GLN 6 HE22 GLN 6 6.315 -7.083 -19.022
46 H SER 7 HN SER 7 7.139 -11.469 -14.834
47 HA SER 7 HA SER 7 9.952 -12.094 -14.181
48 HB2 SER 7 HB2 SER 7 9.036 -14.482 -13.909
49 HB3 SER 7 HB1 SER 7 8.615 -13.315 -12.657
50 HG SER 7 HG SER 7 6.674 -14.032 -13.091
51 H HIS 8 HN HIS 8 10.990 -11.930 -16.085
52 HA HIS 8 HA HIS 8 9.768 -12.949 -18.522
53 HB2 HIS 8 HB2 HIS 8 11.564 -11.901 -19.721
54 HB3 HIS 8 HB1 HIS 8 10.999 -10.766 -18.505
55 HD1 HIS 8 HD1 HIS 8 12.665 -10.019 -16.728
56 HD2 HIS 8 HD2 HIS 8 14.164 -12.962 -19.254
57 HE1 HIS 8 HE1 HIS 8 15.135 -10.102 -16.280
58 HE2 HIS 8 HE2 HIS 8 16.036 -11.760 -17.944
59 H LYS 9 HN LYS 9 11.654 -14.172 -16.052
60 HA LYS 9 HA LYS 9 13.221 -16.061 -17.518
61 HB2 LYS 9 HB2 LYS 9 13.671 -15.407 -15.153
62 HB3 LYS 9 HB1 LYS 9 12.192 -16.218 -14.670
63 HG2 LYS 9 HG2 LYS 9 14.089 -17.618 -14.181
64 HG3 LYS 9 HG1 LYS 9 13.123 -18.356 -15.459
65 HD2 LYS 9 HD2 LYS 9 14.702 -17.767 -17.126
66 HD3 LYS 9 HD1 LYS 9 15.535 -16.644 -16.047
67 HE2 LYS 9 HE2 LYS 9 15.421 -19.639 -15.650
68 HE3 LYS 9 HE1 LYS 9 16.765 -18.778 -16.401
69 HZ1 LYS 9 HZ1 LYS 9 17.240 -19.188 -14.091
70 HZ2 LYS 9 HZ2 LYS 9 15.803 -18.430 -13.609
71 HZ3 LYS 9 HZ3 LYS 9 17.037 -17.524 -14.329
72 H PHE 10 HN PHE 10 9.930 -15.790 -16.613
73 HA PHE 10 HA PHE 10 9.294 -18.567 -17.194
74 HB2 PHE 10 HB2 PHE 10 8.180 -17.151 -15.370
75 HB3 PHE 10 HB1 PHE 10 7.365 -16.292 -16.668
76 HD1 PHE 10 HD2 PHE 10 7.795 -19.589 -15.086
77 HD2 PHE 10 HD1 PHE 10 5.444 -17.212 -17.721
78 HE1 PHE 10 HE2 PHE 10 6.051 -21.328 -15.089
79 HE2 PHE 10 HE1 PHE 10 3.700 -18.948 -17.728
80 HZ PHE 10 HZ PHE 10 3.996 -21.000 -16.408
81 H LYS 11 HN LYS 11 9.331 -19.076 -19.329
82 HA LYS 11 HA LYS 11 8.674 -17.156 -21.381
83 HB2 LYS 11 HB2 LYS 11 9.447 -20.063 -21.409
84 HB3 LYS 11 HB1 LYS 11 8.793 -19.314 -22.852
85 HG2 LYS 11 HG2 LYS 11 11.104 -19.224 -23.135
86 HG3 LYS 11 HG1 LYS 11 10.663 -17.595 -22.630
87 HD2 LYS 11 HD2 LYS 11 11.417 -19.488 -20.470
88 HD3 LYS 11 HD1 LYS 11 12.709 -18.999 -21.564
89 HE2 LYS 11 HE2 LYS 11 10.917 -17.096 -20.052
90 HE3 LYS 11 HE1 LYS 11 12.538 -17.574 -19.549
91 HZ1 LYS 11 HZ1 LYS 11 11.865 -16.156 -22.072
92 HZ2 LYS 11 HZ2 LYS 11 13.419 -16.585 -21.564
93 HZ3 LYS 11 HZ3 LYS 11 12.528 -15.444 -20.692
94 H GLY 12 HN GLY 12 6.580 -16.553 -21.464
95 HA2 GLY 12 HA2 GLY 12 4.559 -17.320 -22.721
96 HA3 GLY 12 HA1 GLY 12 4.536 -18.691 -21.621
97 HA PRO 13 HA PRO 13 1.952 -15.260 -19.771
98 HB2 PRO 13 HB2 PRO 13 -0.518 -16.186 -20.250
99 HB3 PRO 13 HB1 PRO 13 0.375 -15.289 -21.487
100 HG2 PRO 13 HG2 PRO 13 -0.036 -18.245 -21.212
101 HG3 PRO 13 HG1 PRO 13 -0.095 -17.239 -22.671
102 HD2 PRO 13 HD2 PRO 13 2.092 -18.743 -21.902
103 HD3 PRO 13 HD1 PRO 13 2.175 -17.320 -22.959
104 H CYS 14 HN CYS 14 0.060 -15.692 -18.104
105 HA CYS 14 HA CYS 14 1.077 -17.575 -16.199
106 HB2 CYS 14 HB2 CYS 14 -0.750 -16.761 -14.751
107 HB3 CYS 14 HB1 CYS 14 0.135 -15.422 -15.475
108 H ALA 15 HN ALA 15 0.813 -19.453 -17.653
109 HA ALA 15 HA ALA 15 -1.783 -20.431 -18.317
110 HB1 ALA 15 HB1 ALA 15 -0.635 -22.461 -19.002
111 HB2 ALA 15 HB2 ALA 15 0.831 -21.942 -18.167
112 HB3 ALA 15 HB3 ALA 15 0.250 -21.044 -19.571
113 H SER 16 HN SER 16 0.300 -20.702 -15.555
114 HA SER 16 HA SER 16 -1.841 -21.970 -14.050
115 HB2 SER 16 HB2 SER 16 0.947 -23.165 -14.202
116 HB3 SER 16 HB1 SER 16 -0.333 -23.701 -13.119
117 HG SER 16 HG SER 16 -1.492 -23.819 -15.370
118 H ASP 17 HN ASP 17 -2.033 -20.946 -12.159
119 HA ASP 17 HA ASP 17 -0.404 -18.777 -11.442
120 HB2 ASP 17 HB2 ASP 17 -2.440 -20.332 -9.832
121 HB3 ASP 17 HB1 ASP 17 -1.676 -18.855 -9.260
122 H HIS 18 HN HIS 18 -0.751 -21.932 -9.805
123 HA HIS 18 HA HIS 18 1.191 -21.609 -7.844
124 HB2 HIS 18 HB2 HIS 18 -0.414 -23.541 -8.017
125 HB3 HIS 18 HB1 HIS 18 0.597 -24.187 -9.314
126 HD1 HIS 18 HD1 HIS 18 2.040 -25.994 -8.504
127 HD2 HIS 18 HD2 HIS 18 1.429 -23.117 -5.567
128 HE1 HIS 18 HE1 HIS 18 3.319 -26.797 -6.493
129 HE2 HIS 18 HE2 HIS 18 3.073 -24.957 -4.793
130 H ASN 19 HN ASN 19 1.515 -22.770 -11.158
131 HA ASN 19 HA ASN 19 4.217 -23.516 -11.007
132 HB2 ASN 19 HB2 ASN 19 2.697 -24.215 -12.846
133 HB3 ASN 19 HB1 ASN 19 2.700 -22.562 -13.452
134 HD21 ASN 19 HD21 ASN 19 3.631 -23.040 -15.412
135 HD22 ASN 19 HD22 ASN 19 5.268 -23.566 -15.572
136 H CYS 20 HN CYS 20 2.677 -20.537 -12.150
137 HA CYS 20 HA CYS 20 4.968 -19.154 -12.945
138 HB2 CYS 20 HB2 CYS 20 2.672 -18.442 -13.502
139 HB3 CYS 20 HB1 CYS 20 2.377 -18.045 -11.814
140 H ALA 21 HN ALA 21 3.281 -19.180 -9.822
141 HA ALA 21 HA ALA 21 5.010 -17.418 -8.467
142 HB1 ALA 21 HB1 ALA 21 4.021 -18.349 -6.414
143 HB2 ALA 21 HB2 ALA 21 3.286 -19.644 -7.362
144 HB3 ALA 21 HB3 ALA 21 2.792 -17.970 -7.620
145 H SER 22 HN SER 22 5.003 -20.941 -8.809
146 HA SER 22 HA SER 22 7.040 -21.522 -6.980
147 HB2 SER 22 HB2 SER 22 5.464 -23.185 -8.022
148 HB3 SER 22 HB1 SER 22 6.398 -23.070 -9.513
149 HG SER 22 HG SER 22 6.846 -24.738 -7.651
150 H VAL 23 HN VAL 23 7.182 -20.947 -10.483
151 HA VAL 23 HA VAL 23 9.970 -21.273 -10.774
152 HB VAL 23 HB VAL 23 7.964 -19.740 -12.449
153 HG11 VAL 23 HG11 VAL 23 9.656 -19.734 -14.240
154 HG12 VAL 23 HG12 VAL 23 10.831 -20.438 -13.128
155 HG13 VAL 23 HG13 VAL 23 10.203 -18.816 -12.835
156 HG21 VAL 23 HG21 VAL 23 7.568 -22.140 -12.355
157 HG22 VAL 23 HG22 VAL 23 9.241 -22.454 -12.823
158 HG23 VAL 23 HG23 VAL 23 8.140 -21.671 -13.957
159 H CYS 24 HN CYS 24 7.966 -18.351 -10.377
160 HA CYS 24 HA CYS 24 10.027 -16.478 -10.441
161 HB2 CYS 24 HB2 CYS 24 7.577 -15.949 -10.478
162 HB3 CYS 24 HB1 CYS 24 7.523 -16.279 -8.748
163 H GLN 25 HN GLN 25 8.901 -18.564 -7.860
164 HA GLN 25 HA GLN 25 10.595 -17.305 -5.881
165 HB2 GLN 25 HB2 GLN 25 8.772 -19.708 -5.764
166 HB3 GLN 25 HB1 GLN 25 9.754 -19.176 -4.402
167 HG2 GLN 25 HG2 GLN 25 8.626 -16.991 -4.461
168 HG3 GLN 25 HG1 GLN 25 7.618 -17.562 -5.787
169 HE21 GLN 25 HE21 GLN 25 5.748 -17.241 -4.633
170 HE22 GLN 25 HE22 GLN 25 5.272 -18.257 -3.319
171 H THR 26 HN THR 26 10.876 -19.994 -8.111
172 HA THR 26 HA THR 26 13.174 -21.123 -6.826
173 HB THR 26 HB THR 26 13.729 -22.156 -9.011
174 HG1 THR 26 HG1 THR 26 12.465 -20.183 -10.071
175 HG21 THR 26 HG21 THR 26 10.806 -22.403 -8.303
176 HG22 THR 26 HG22 THR 26 12.128 -23.279 -7.534
177 HG23 THR 26 HG23 THR 26 11.746 -23.569 -9.232
178 H GLU 27 HN GLU 27 12.548 -18.449 -8.990
179 HA GLU 27 HA GLU 27 15.289 -17.712 -9.346
180 HB2 GLU 27 HB2 GLU 27 12.823 -15.952 -9.405
181 HB3 GLU 27 HB1 GLU 27 14.409 -15.521 -10.031
182 HG2 GLU 27 HG2 GLU 27 12.559 -17.657 -11.079
183 HG3 GLU 27 HG1 GLU 27 12.991 -16.137 -11.861
184 H ARG 28 HN ARG 28 12.857 -15.888 -7.480
185 HA ARG 28 HA ARG 28 14.433 -16.038 -5.047
186 HB2 ARG 28 HB2 ARG 28 13.751 -13.323 -6.226
187 HB3 ARG 28 HB1 ARG 28 14.528 -13.620 -4.678
188 HG2 ARG 28 HG2 ARG 28 16.423 -14.686 -5.974
189 HG3 ARG 28 HG1 ARG 28 15.666 -14.041 -7.431
190 HD2 ARG 28 HD2 ARG 28 17.293 -12.447 -6.835
191 HD3 ARG 28 HD1 ARG 28 15.764 -11.764 -6.290
192 HE ARG 28 HE ARG 28 16.493 -11.917 -4.120
193 HH11 ARG 28 HH11 ARG 28 18.644 -13.767 -6.176
194 HH12 ARG 28 HH12 ARG 28 19.803 -14.051 -4.916
195 HH21 ARG 28 HH21 ARG 28 18.028 -12.306 -2.461
196 HH22 ARG 28 HH22 ARG 28 19.458 -13.220 -2.825
197 H PHE 29 HN PHE 29 13.192 -15.193 -3.179
198 HA PHE 29 HA PHE 29 10.546 -16.080 -3.188
199 HB2 PHE 29 HB2 PHE 29 11.888 -14.157 -1.264
200 HB3 PHE 29 HB1 PHE 29 10.341 -14.950 -0.976
201 HD1 PHE 29 HD2 PHE 29 10.264 -17.453 -0.762
202 HD2 PHE 29 HD1 PHE 29 13.933 -15.285 -0.869
203 HE1 PHE 29 HE2 PHE 29 11.437 -19.400 0.183
204 HE2 PHE 29 HE1 PHE 29 15.111 -17.232 0.072
205 HZ PHE 29 HZ PHE 29 13.861 -19.289 0.601
206 H SER 30 HN SER 30 9.101 -15.280 -4.536
207 HA SER 30 HA SER 30 8.108 -12.616 -4.240
208 HB2 SER 30 HB2 SER 30 9.289 -13.507 -6.899
209 HB3 SER 30 HB1 SER 30 8.356 -12.032 -6.643
210 HG SER 30 HG SER 30 10.815 -12.679 -5.384
211 H GLY 31 HN GLY 31 6.031 -13.049 -4.083
212 HA2 GLY 31 HA2 GLY 31 4.684 -15.358 -4.855
213 HA3 GLY 31 HA1 GLY 31 3.909 -13.809 -4.560
214 H GLY 32 HN GLY 32 3.071 -15.710 -6.528
215 HA2 GLY 32 HA2 GLY 32 3.929 -14.427 -9.059
216 HA3 GLY 32 HA1 GLY 32 3.490 -16.121 -8.916
217 H ARG 33 HN ARG 33 2.425 -13.098 -9.774
218 HA ARG 33 HA ARG 33 -0.372 -14.015 -9.776
219 HB2 ARG 33 HB2 ARG 33 0.630 -11.166 -9.495
220 HB3 ARG 33 HB1 ARG 33 -1.055 -11.623 -9.701
221 HG2 ARG 33 HG2 ARG 33 0.732 -12.185 -7.345
222 HG3 ARG 33 HG1 ARG 33 -0.725 -11.190 -7.394
223 HD2 ARG 33 HD2 ARG 33 -0.534 -14.193 -7.651
224 HD3 ARG 33 HD1 ARG 33 -1.269 -13.276 -6.337
225 HE ARG 33 HE ARG 33 -2.964 -12.541 -8.004
226 HH11 ARG 33 HH11 ARG 33 -1.131 -15.477 -8.571
227 HH12 ARG 33 HH12 ARG 33 -2.361 -16.213 -9.553
228 HH21 ARG 33 HH21 ARG 33 -4.598 -13.516 -9.298
229 HH22 ARG 33 HH22 ARG 33 -4.331 -15.095 -9.969
230 H CYS 34 HN CYS 34 -1.614 -12.562 -11.484
231 HA CYS 34 HA CYS 34 -0.004 -12.578 -13.962
232 HB2 CYS 34 HB2 CYS 34 -1.628 -14.494 -13.731
233 HB3 CYS 34 HB1 CYS 34 -2.935 -13.316 -13.731
234 H ARG 35 HN ARG 35 -0.138 -10.769 -15.212
235 HA ARG 35 HA ARG 35 -2.251 -8.812 -14.700
236 HB2 ARG 35 HB2 ARG 35 -0.217 -8.411 -13.170
237 HB3 ARG 35 HB1 ARG 35 0.656 -7.982 -14.632
238 HG2 ARG 35 HG2 ARG 35 -0.052 -5.948 -13.694
239 HG3 ARG 35 HG1 ARG 35 -1.152 -6.246 -15.042
240 HD2 ARG 35 HD2 ARG 35 -2.401 -5.481 -13.108
241 HD3 ARG 35 HD1 ARG 35 -2.811 -7.161 -13.460
242 HE ARG 35 HE ARG 35 -0.715 -6.720 -11.483
243 HH11 ARG 35 HH11 ARG 35 -4.087 -7.501 -12.094
244 HH12 ARG 35 HH12 ARG 35 -4.376 -8.035 -10.468
245 HH21 ARG 35 HH21 ARG 35 -1.100 -7.471 -9.376
246 HH22 ARG 35 HH22 ARG 35 -2.686 -8.024 -8.932
247 H GLY 36 HN GLY 36 -2.317 -7.125 -16.348
248 HA2 GLY 36 HA2 GLY 36 -1.722 -6.142 -18.387
249 HA3 GLY 36 HA1 GLY 36 -0.609 -7.466 -18.687
250 H PHE 37 HN PHE 37 -2.396 -6.427 -20.590
251 HA PHE 37 HA PHE 37 -4.773 -8.011 -20.777
252 HB2 PHE 37 HB2 PHE 37 -3.341 -6.421 -22.925
253 HB3 PHE 37 HB1 PHE 37 -4.986 -7.041 -23.025
254 HD1 PHE 37 HD2 PHE 37 -6.706 -6.166 -21.368
255 HD2 PHE 37 HD1 PHE 37 -2.904 -4.324 -21.950
256 HE1 PHE 37 HE2 PHE 37 -7.552 -4.096 -20.346
257 HE2 PHE 37 HE1 PHE 37 -3.751 -2.254 -20.923
258 HZ PHE 37 HZ PHE 37 -6.076 -2.138 -20.122
259 H ARG 38 HN ARG 38 -1.491 -8.507 -21.496
260 HA ARG 38 HA ARG 38 -1.996 -10.648 -23.416
261 HB2 ARG 38 HB2 ARG 38 -0.147 -8.934 -23.686
262 HB3 ARG 38 HB1 ARG 38 0.663 -9.696 -22.325
263 HG2 ARG 38 HG2 ARG 38 1.002 -11.712 -23.537
264 HG3 ARG 38 HG1 ARG 38 -0.095 -11.203 -24.825
265 HD2 ARG 38 HD2 ARG 38 2.577 -9.973 -24.138
266 HD3 ARG 38 HD1 ARG 38 2.204 -10.957 -25.555
267 HE ARG 38 HE ARG 38 0.428 -8.844 -25.617
268 HH11 ARG 38 HH11 ARG 38 3.911 -9.225 -25.702
269 HH12 ARG 38 HH12 ARG 38 4.173 -7.775 -26.616
270 HH21 ARG 38 HH21 ARG 38 0.780 -6.924 -26.804
271 HH22 ARG 38 HH22 ARG 38 2.399 -6.471 -27.235
272 H ARG 39 HN ARG 39 -2.275 -10.428 -20.236
273 HA ARG 39 HA ARG 39 -2.455 -11.947 -18.560
274 HB2 ARG 39 HB2 ARG 39 -3.480 -13.189 -20.608
275 HB3 ARG 39 HB1 ARG 39 -2.000 -14.137 -20.583
276 HG2 ARG 39 HG2 ARG 39 -3.737 -15.312 -19.405
277 HG3 ARG 39 HG1 ARG 39 -2.498 -14.803 -18.257
278 HD2 ARG 39 HD2 ARG 39 -4.689 -14.401 -17.312
279 HD3 ARG 39 HD1 ARG 39 -3.908 -12.855 -17.649
280 HE ARG 39 HE ARG 39 -6.029 -14.073 -19.307
281 HH11 ARG 39 HH11 ARG 39 -4.385 -11.235 -18.070
282 HH12 ARG 39 HH12 ARG 39 -5.469 -10.121 -18.836
283 HH21 ARG 39 HH21 ARG 39 -7.460 -12.602 -20.303
284 HH22 ARG 39 HH22 ARG 39 -7.217 -10.898 -20.094
285 H ARG 40 HN ARG 40 -0.002 -10.821 -18.772
286 HA ARG 40 HA ARG 40 2.091 -12.808 -19.007
287 HB2 ARG 40 HB2 ARG 40 2.287 -10.492 -19.919
288 HB3 ARG 40 HB1 ARG 40 2.269 -9.876 -18.273
289 HG2 ARG 40 HG2 ARG 40 4.532 -9.953 -19.152
290 HG3 ARG 40 HG1 ARG 40 4.351 -11.069 -17.796
291 HD2 ARG 40 HD2 ARG 40 4.230 -12.953 -19.286
292 HD3 ARG 40 HD1 ARG 40 4.165 -11.896 -20.697
293 HE ARG 40 HE ARG 40 6.489 -11.168 -19.910
294 HH11 ARG 40 HH11 ARG 40 5.222 -14.416 -19.469
295 HH12 ARG 40 HH12 ARG 40 6.785 -15.157 -19.498
296 HH21 ARG 40 HH21 ARG 40 8.529 -12.167 -20.033
297 HH22 ARG 40 HH22 ARG 40 8.660 -13.886 -19.859
298 H CYS 41 HN CYS 41 3.579 -13.350 -17.357
299 HA CYS 41 HA CYS 41 2.464 -13.525 -14.727
300 HB2 CYS 41 HB2 CYS 41 4.808 -14.644 -16.138
301 HB3 CYS 41 HB1 CYS 41 5.022 -14.408 -14.410
302 H PHE 42 HN PHE 42 2.519 -11.976 -13.297
303 HA PHE 42 HA PHE 42 4.920 -10.275 -13.064
304 HB2 PHE 42 HB2 PHE 42 2.005 -9.671 -12.566
305 HB3 PHE 42 HB1 PHE 42 3.259 -8.741 -11.747
306 HD1 PHE 42 HD2 PHE 42 2.558 -9.959 -15.235
307 HD2 PHE 42 HD1 PHE 42 3.788 -6.739 -12.723
308 HE1 PHE 42 HE2 PHE 42 2.778 -8.500 -17.208
309 HE2 PHE 42 HE1 PHE 42 4.009 -5.283 -14.690
310 HZ PHE 42 HZ PHE 42 3.504 -6.165 -16.936
311 H CYS 43 HN CYS 43 5.722 -9.930 -10.964
312 HA CYS 43 HA CYS 43 4.887 -12.000 -9.042
313 HB2 CYS 43 HB2 CYS 43 7.638 -10.867 -9.589
314 HB3 CYS 43 HB1 CYS 43 7.262 -11.933 -8.239
315 H THR 44 HN THR 44 4.639 -11.459 -6.934
316 HA THR 44 HA THR 44 4.874 -8.606 -6.224
317 HB THR 44 HB THR 44 3.100 -9.117 -4.505
318 HG1 THR 44 HG1 THR 44 3.521 -11.479 -4.668
319 HG21 THR 44 HG21 THR 44 2.331 -9.616 -7.388
320 HG22 THR 44 HG22 THR 44 2.496 -8.038 -6.616
321 HG23 THR 44 HG23 THR 44 1.224 -9.145 -6.099
322 H THR 45 HN THR 45 6.521 -8.230 -4.872
323 HA THR 45 HA THR 45 7.280 -10.386 -2.995
324 HB THR 45 HB THR 45 8.928 -10.140 -4.853
325 HG1 THR 45 HG1 THR 45 10.218 -10.814 -3.339
326 HG21 THR 45 HG21 THR 45 9.371 -7.394 -3.655
327 HG22 THR 45 HG22 THR 45 8.742 -7.742 -5.267
328 HG23 THR 45 HG23 THR 45 10.407 -8.160 -4.862
329 H HIS 46 HN HIS 46 8.685 -9.500 -1.183
330 HA HIS 46 HA HIS 46 7.181 -7.438 0.135
331 HB2 HIS 46 HB2 HIS 46 9.648 -8.972 1.010
332 HB3 HIS 46 HB1 HIS 46 8.746 -7.860 2.037
333 HD1 HIS 46 HD1 HIS 46 9.124 -11.204 2.019
334 HD2 HIS 46 HD2 HIS 46 5.722 -8.885 1.453
335 HE1 HIS 46 HE1 HIS 46 7.182 -12.713 2.540
336 HE2 HIS 46 HE2 HIS 46 5.137 -11.332 2.026
337 H CYS 47 HN CYS 47 7.469 -5.424 -0.355
338 HA CYS 47 HA CYS 47 9.978 -4.533 -1.560
339 HB2 CYS 47 HB2 CYS 47 7.681 -4.241 -2.625
340 HB3 CYS 47 HB1 CYS 47 7.349 -3.054 -1.374
Start of MODEL 11
1 H1 ARG 1 HT1 ARG 1 2.619 -2.233 0.992
2 H2 ARG 1 HT2 ARG 1 2.962 -1.190 -0.293
3 H3 ARG 1 HT3 ARG 1 2.897 -0.591 1.284
4 HA ARG 1 HA ARG 1 5.163 -0.806 0.483
5 HB2 ARG 1 HB2 ARG 1 6.095 -1.888 2.413
6 HB3 ARG 1 HB1 ARG 1 4.634 -1.048 2.909
7 HG2 ARG 1 HG2 ARG 1 4.694 -3.995 2.286
8 HG3 ARG 1 HG1 ARG 1 5.008 -3.345 3.894
9 HD2 ARG 1 HD2 ARG 1 2.465 -3.046 2.285
10 HD3 ARG 1 HD1 ARG 1 2.692 -4.044 3.721
11 HE ARG 1 HE ARG 1 2.181 -1.224 3.628
12 HH11 ARG 1 HH11 ARG 1 3.677 -3.763 5.530
13 HH12 ARG 1 HH12 ARG 1 3.517 -2.894 7.028
14 HH21 ARG 1 HH21 ARG 1 1.959 -0.107 5.609
15 HH22 ARG 1 HH22 ARG 1 2.543 -0.838 7.072
16 H THR 2 HN THR 2 3.179 -3.326 -0.444
17 HA THR 2 HA THR 2 5.345 -5.147 -1.117
18 HB THR 2 HB THR 2 2.388 -5.302 -1.783
19 HG1 THR 2 HG1 THR 2 3.935 -6.550 0.273
20 HG21 THR 2 HG21 THR 2 2.839 -7.668 -2.274
21 HG22 THR 2 HG22 THR 2 4.558 -7.407 -1.974
22 HG23 THR 2 HG23 THR 2 3.770 -6.610 -3.334
23 H CYS 3 HN CYS 3 6.279 -5.261 -3.088
24 HA CYS 3 HA CYS 3 5.390 -3.292 -5.094
25 HB2 CYS 3 HB2 CYS 3 8.178 -4.255 -4.388
26 HB3 CYS 3 HB1 CYS 3 7.809 -3.216 -5.760
27 H GLU 4 HN GLU 4 5.068 -3.965 -7.144
28 HA GLU 4 HA GLU 4 5.583 -6.816 -7.687
29 HB2 GLU 4 HB2 GLU 4 3.632 -6.817 -9.140
30 HB3 GLU 4 HB1 GLU 4 3.184 -6.261 -7.534
31 HG2 GLU 4 HG2 GLU 4 3.197 -3.950 -8.325
32 HG3 GLU 4 HG1 GLU 4 3.666 -4.497 -9.932
33 H SER 5 HN SER 5 6.011 -7.393 -9.857
34 HA SER 5 HA SER 5 6.823 -5.316 -11.716
35 HB2 SER 5 HB2 SER 5 8.864 -5.865 -10.371
36 HB3 SER 5 HB1 SER 5 8.706 -7.548 -10.874
37 HG SER 5 HG SER 5 9.477 -5.297 -12.351
38 H GLN 6 HN GLN 6 7.847 -6.837 -13.694
39 HA GLN 6 HA GLN 6 5.558 -8.600 -14.310
40 HB2 GLN 6 HB2 GLN 6 5.479 -6.523 -15.592
41 HB3 GLN 6 HB1 GLN 6 7.132 -6.761 -16.136
42 HG2 GLN 6 HG2 GLN 6 6.491 -8.652 -17.466
43 HG3 GLN 6 HG1 GLN 6 4.860 -8.629 -16.794
44 HE21 GLN 6 HE21 GLN 6 5.817 -8.392 -19.580
45 HE22 GLN 6 HE22 GLN 6 5.128 -6.921 -20.174
46 H SER 7 HN SER 7 5.981 -10.555 -15.259
47 HA SER 7 HA SER 7 8.799 -11.360 -14.994
48 HB2 SER 7 HB2 SER 7 6.336 -13.031 -14.429
49 HB3 SER 7 HB1 SER 7 8.013 -13.461 -14.089
50 HG SER 7 HG SER 7 6.968 -12.675 -12.230
51 H HIS 8 HN HIS 8 9.411 -11.309 -17.092
52 HA HIS 8 HA HIS 8 8.125 -13.211 -18.924
53 HB2 HIS 8 HB2 HIS 8 9.769 -12.349 -20.606
54 HB3 HIS 8 HB1 HIS 8 8.700 -11.102 -19.979
55 HD1 HIS 8 HD1 HIS 8 9.892 -8.995 -19.568
56 HD2 HIS 8 HD2 HIS 8 12.360 -12.283 -18.950
57 HE1 HIS 8 HE1 HIS 8 12.134 -8.049 -18.943
58 HE2 HIS 8 HE2 HIS 8 13.581 -10.054 -18.470
59 H LYS 9 HN LYS 9 9.950 -13.437 -16.387
60 HA LYS 9 HA LYS 9 12.193 -14.978 -17.113
61 HB2 LYS 9 HB2 LYS 9 10.513 -15.138 -14.590
62 HB3 LYS 9 HB1 LYS 9 12.145 -15.771 -14.779
63 HG2 LYS 9 HG2 LYS 9 11.363 -12.863 -14.956
64 HG3 LYS 9 HG1 LYS 9 12.095 -13.644 -13.553
65 HD2 LYS 9 HD2 LYS 9 13.365 -13.464 -16.292
66 HD3 LYS 9 HD1 LYS 9 13.724 -12.389 -14.940
67 HE2 LYS 9 HE2 LYS 9 14.146 -15.379 -14.987
68 HE3 LYS 9 HE1 LYS 9 15.404 -14.154 -15.153
69 HZ1 LYS 9 HZ1 LYS 9 14.853 -13.367 -12.929
70 HZ2 LYS 9 HZ2 LYS 9 15.321 -14.986 -12.908
71 HZ3 LYS 9 HZ3 LYS 9 13.686 -14.580 -12.766
72 H PHE 10 HN PHE 10 8.846 -15.799 -16.335
73 HA PHE 10 HA PHE 10 9.058 -18.567 -16.907
74 HB2 PHE 10 HB2 PHE 10 7.182 -17.515 -15.608
75 HB3 PHE 10 HB1 PHE 10 6.605 -16.783 -17.101
76 HD1 PHE 10 HD2 PHE 10 7.203 -20.006 -15.388
77 HD2 PHE 10 HD1 PHE 10 5.271 -18.027 -18.637
78 HE1 PHE 10 HE2 PHE 10 5.903 -22.046 -15.859
79 HE2 PHE 10 HE1 PHE 10 3.976 -20.065 -19.106
80 HZ PHE 10 HZ PHE 10 4.285 -22.074 -17.717
81 H LYS 11 HN LYS 11 9.537 -19.363 -18.838
82 HA LYS 11 HA LYS 11 9.772 -17.824 -21.156
83 HB2 LYS 11 HB2 LYS 11 10.065 -20.046 -22.312
84 HB3 LYS 11 HB1 LYS 11 11.123 -19.771 -20.935
85 HG2 LYS 11 HG2 LYS 11 9.469 -21.106 -19.553
86 HG3 LYS 11 HG1 LYS 11 8.698 -21.555 -21.076
87 HD2 LYS 11 HD2 LYS 11 11.571 -22.091 -20.300
88 HD3 LYS 11 HD1 LYS 11 10.269 -23.279 -20.341
89 HE2 LYS 11 HE2 LYS 11 11.296 -21.737 -22.725
90 HE3 LYS 11 HE1 LYS 11 11.736 -23.394 -22.321
91 HZ1 LYS 11 HZ1 LYS 11 9.013 -22.427 -22.997
92 HZ2 LYS 11 HZ2 LYS 11 9.399 -24.008 -22.549
93 HZ3 LYS 11 HZ3 LYS 11 10.018 -23.364 -23.980
94 H GLY 12 HN GLY 12 7.976 -16.770 -21.803
95 HA2 GLY 12 HA2 GLY 12 6.318 -16.812 -23.532
96 HA3 GLY 12 HA1 GLY 12 5.864 -18.430 -23.018
97 HA PRO 13 HA PRO 13 2.844 -15.442 -21.045
98 HB2 PRO 13 HB2 PRO 13 0.594 -16.673 -21.989
99 HB3 PRO 13 HB1 PRO 13 1.406 -15.359 -22.850
100 HG2 PRO 13 HG2 PRO 13 1.592 -18.317 -23.306
101 HG3 PRO 13 HG1 PRO 13 1.466 -17.005 -24.496
102 HD2 PRO 13 HD2 PRO 13 3.824 -18.212 -23.903
103 HD3 PRO 13 HD1 PRO 13 3.722 -16.501 -24.362
104 H CYS 14 HN CYS 14 1.625 -15.961 -19.215
105 HA CYS 14 HA CYS 14 2.524 -18.154 -17.729
106 HB2 CYS 14 HB2 CYS 14 1.716 -16.050 -16.718
107 HB3 CYS 14 HB1 CYS 14 0.080 -16.429 -17.239
108 H ALA 15 HN ALA 15 2.119 -20.153 -18.564
109 HA ALA 15 HA ALA 15 -0.344 -21.007 -19.661
110 HB1 ALA 15 HB1 ALA 15 1.722 -22.175 -20.166
111 HB2 ALA 15 HB2 ALA 15 0.588 -23.290 -19.407
112 HB3 ALA 15 HB3 ALA 15 1.922 -22.618 -18.470
113 H SER 16 HN SER 16 1.001 -21.090 -16.409
114 HA SER 16 HA SER 16 -1.630 -21.491 -15.274
115 HB2 SER 16 HB2 SER 16 0.603 -23.471 -14.702
116 HB3 SER 16 HB1 SER 16 -0.970 -23.435 -13.903
117 HG SER 16 HG SER 16 -1.563 -23.502 -16.413
118 H ASP 17 HN ASP 17 -1.850 -20.370 -13.478
119 HA ASP 17 HA ASP 17 -0.042 -18.453 -12.654
120 HB2 ASP 17 HB2 ASP 17 -2.409 -18.277 -12.132
121 HB3 ASP 17 HB1 ASP 17 -2.330 -19.702 -11.102
122 H HIS 18 HN HIS 18 -0.845 -21.478 -10.936
123 HA HIS 18 HA HIS 18 0.895 -21.170 -8.790
124 HB2 HIS 18 HB2 HIS 18 -0.907 -22.958 -9.117
125 HB3 HIS 18 HB1 HIS 18 0.294 -23.841 -10.061
126 HD1 HIS 18 HD1 HIS 18 1.559 -25.512 -8.740
127 HD2 HIS 18 HD2 HIS 18 0.230 -22.359 -6.375
128 HE1 HIS 18 HE1 HIS 18 2.253 -26.084 -6.397
129 HE2 HIS 18 HE2 HIS 18 1.274 -24.263 -4.967
130 H ASN 19 HN ASN 19 1.518 -22.299 -12.038
131 HA ASN 19 HA ASN 19 4.069 -23.446 -11.458
132 HB2 ASN 19 HB2 ASN 19 2.638 -24.134 -13.404
133 HB3 ASN 19 HB1 ASN 19 2.987 -22.585 -14.160
134 HD21 ASN 19 HD21 ASN 19 3.590 -25.417 -14.912
135 HD22 ASN 19 HD22 ASN 19 5.294 -25.445 -15.211
136 H CYS 20 HN CYS 20 3.063 -20.427 -13.125
137 HA CYS 20 HA CYS 20 5.685 -19.412 -13.389
138 HB2 CYS 20 HB2 CYS 20 3.640 -18.507 -14.572
139 HB3 CYS 20 HB1 CYS 20 3.195 -17.717 -13.060
140 H ALA 21 HN ALA 21 3.354 -19.289 -10.787
141 HA ALA 21 HA ALA 21 4.658 -17.451 -9.108
142 HB1 ALA 21 HB1 ALA 21 2.868 -19.769 -8.352
143 HB2 ALA 21 HB2 ALA 21 2.332 -18.138 -8.755
144 HB3 ALA 21 HB3 ALA 21 3.299 -18.417 -7.307
145 H SER 22 HN SER 22 4.727 -21.006 -9.171
146 HA SER 22 HA SER 22 6.525 -21.418 -7.093
147 HB2 SER 22 HB2 SER 22 5.188 -23.208 -8.189
148 HB3 SER 22 HB1 SER 22 6.226 -23.094 -9.608
149 HG SER 22 HG SER 22 7.372 -23.531 -7.079
150 H VAL 23 HN VAL 23 7.138 -21.037 -10.561
151 HA VAL 23 HA VAL 23 9.912 -21.283 -10.564
152 HB VAL 23 HB VAL 23 8.033 -19.715 -12.339
153 HG11 VAL 23 HG11 VAL 23 10.228 -18.646 -12.495
154 HG12 VAL 23 HG12 VAL 23 9.881 -19.545 -13.970
155 HG13 VAL 23 HG13 VAL 23 10.992 -20.211 -12.772
156 HG21 VAL 23 HG21 VAL 23 9.484 -22.341 -12.721
157 HG22 VAL 23 HG22 VAL 23 8.471 -21.549 -13.931
158 HG23 VAL 23 HG23 VAL 23 7.758 -22.127 -12.423
159 H CYS 24 HN CYS 24 7.912 -18.361 -10.227
160 HA CYS 24 HA CYS 24 10.018 -16.515 -9.972
161 HB2 CYS 24 HB2 CYS 24 7.674 -15.886 -10.460
162 HB3 CYS 24 HB1 CYS 24 7.214 -16.349 -8.827
163 H GLN 25 HN GLN 25 8.394 -18.571 -7.643
164 HA GLN 25 HA GLN 25 9.568 -17.336 -5.331
165 HB2 GLN 25 HB2 GLN 25 8.150 -19.995 -5.652
166 HB3 GLN 25 HB1 GLN 25 8.625 -19.293 -4.111
167 HG2 GLN 25 HG2 GLN 25 7.133 -17.423 -4.453
168 HG3 GLN 25 HG1 GLN 25 6.715 -18.010 -6.061
169 HE21 GLN 25 HE21 GLN 25 4.968 -17.468 -3.832
170 HE22 GLN 25 HE22 GLN 25 4.147 -18.944 -3.466
171 H THR 26 HN THR 26 10.416 -19.964 -7.486
172 HA THR 26 HA THR 26 12.395 -21.077 -5.738
173 HB THR 26 HB THR 26 13.141 -22.335 -7.808
174 HG1 THR 26 HG1 THR 26 12.187 -20.656 -9.255
175 HG21 THR 26 HG21 THR 26 11.574 -23.327 -6.231
176 HG22 THR 26 HG22 THR 26 11.130 -23.764 -7.884
177 HG23 THR 26 HG23 THR 26 10.228 -22.512 -7.030
178 H GLU 27 HN GLU 27 12.437 -18.790 -8.467
179 HA GLU 27 HA GLU 27 15.288 -18.759 -8.627
180 HB2 GLU 27 HB2 GLU 27 15.045 -16.770 -10.047
181 HB3 GLU 27 HB1 GLU 27 14.002 -18.086 -10.558
182 HG2 GLU 27 HG2 GLU 27 12.065 -16.998 -9.729
183 HG3 GLU 27 HG1 GLU 27 13.031 -15.796 -8.866
184 H ARG 28 HN ARG 28 12.950 -16.631 -6.966
185 HA ARG 28 HA ARG 28 15.037 -15.770 -5.150
186 HB2 ARG 28 HB2 ARG 28 15.163 -14.287 -7.254
187 HB3 ARG 28 HB1 ARG 28 13.619 -13.622 -6.740
188 HG2 ARG 28 HG2 ARG 28 15.426 -12.177 -6.029
189 HG3 ARG 28 HG1 ARG 28 14.652 -12.905 -4.619
190 HD2 ARG 28 HD2 ARG 28 16.456 -14.652 -4.645
191 HD3 ARG 28 HD1 ARG 28 17.268 -13.705 -5.891
192 HE ARG 28 HE ARG 28 16.770 -12.009 -3.738
193 HH11 ARG 28 HH11 ARG 28 18.664 -14.862 -4.448
194 HH12 ARG 28 HH12 ARG 28 19.888 -14.504 -3.273
195 HH21 ARG 28 HH21 ARG 28 18.356 -11.556 -2.147
196 HH22 ARG 28 HH22 ARG 28 19.715 -12.620 -1.967
197 H PHE 29 HN PHE 29 14.068 -14.031 -3.576
198 HA PHE 29 HA PHE 29 11.542 -14.936 -2.609
199 HB2 PHE 29 HB2 PHE 29 13.041 -14.186 -0.964
200 HB3 PHE 29 HB1 PHE 29 13.348 -12.674 -1.803
201 HD1 PHE 29 HD2 PHE 29 10.487 -14.554 -0.297
202 HD2 PHE 29 HD1 PHE 29 12.327 -10.775 -0.981
203 HE1 PHE 29 HE2 PHE 29 8.741 -13.461 1.050
204 HE2 PHE 29 HE1 PHE 29 10.586 -9.679 0.366
205 HZ PHE 29 HZ PHE 29 8.790 -11.020 1.383
206 H SER 30 HN SER 30 9.902 -14.592 -3.782
207 HA SER 30 HA SER 30 8.690 -12.101 -4.168
208 HB2 SER 30 HB2 SER 30 8.843 -12.076 -6.731
209 HB3 SER 30 HB1 SER 30 10.294 -11.579 -5.856
210 HG SER 30 HG SER 30 9.842 -14.212 -6.838
211 H GLY 31 HN GLY 31 6.664 -12.732 -3.892
212 HA2 GLY 31 HA2 GLY 31 5.679 -15.321 -4.615
213 HA3 GLY 31 HA1 GLY 31 4.719 -13.956 -4.048
214 H GLY 32 HN GLY 32 4.242 -15.861 -6.305
215 HA2 GLY 32 HA2 GLY 32 4.401 -13.958 -8.568
216 HA3 GLY 32 HA1 GLY 32 4.494 -15.700 -8.740
217 H ARG 33 HN ARG 33 2.715 -13.767 -9.972
218 HA ARG 33 HA ARG 33 0.221 -15.154 -9.612
219 HB2 ARG 33 HB2 ARG 33 0.022 -13.529 -7.801
220 HB3 ARG 33 HB1 ARG 33 0.477 -12.219 -8.875
221 HG2 ARG 33 HG2 ARG 33 -1.920 -12.225 -8.382
222 HG3 ARG 33 HG1 ARG 33 -1.600 -12.450 -10.101
223 HD2 ARG 33 HD2 ARG 33 -3.412 -13.906 -9.091
224 HD3 ARG 33 HD1 ARG 33 -2.161 -14.742 -10.006
225 HE ARG 33 HE ARG 33 -1.196 -15.461 -7.917
226 HH11 ARG 33 HH11 ARG 33 -4.419 -14.103 -7.683
227 HH12 ARG 33 HH12 ARG 33 -4.784 -14.928 -6.202
228 HH21 ARG 33 HH21 ARG 33 -1.678 -16.543 -5.992
229 HH22 ARG 33 HH22 ARG 33 -3.226 -16.325 -5.239
230 H CYS 34 HN CYS 34 -1.064 -14.938 -11.455
231 HA CYS 34 HA CYS 34 0.183 -13.403 -13.650
232 HB2 CYS 34 HB2 CYS 34 -1.458 -15.956 -13.774
233 HB3 CYS 34 HB1 CYS 34 -0.776 -15.114 -15.162
234 H ARG 35 HN ARG 35 -1.033 -11.971 -14.764
235 HA ARG 35 HA ARG 35 -3.371 -10.974 -13.530
236 HB2 ARG 35 HB2 ARG 35 -1.578 -9.907 -15.239
237 HB3 ARG 35 HB1 ARG 35 -2.858 -10.277 -16.380
238 HG2 ARG 35 HG2 ARG 35 -3.108 -8.531 -13.931
239 HG3 ARG 35 HG1 ARG 35 -3.012 -7.979 -15.602
240 HD2 ARG 35 HD2 ARG 35 -5.131 -9.217 -16.061
241 HD3 ARG 35 HD1 ARG 35 -5.239 -9.588 -14.340
242 HE ARG 35 HE ARG 35 -5.633 -6.986 -15.613
243 HH11 ARG 35 HH11 ARG 35 -5.477 -8.853 -12.651
244 HH12 ARG 35 HH12 ARG 35 -6.262 -7.640 -11.696
245 HH21 ARG 35 HH21 ARG 35 -6.652 -5.376 -14.348
246 HH22 ARG 35 HH22 ARG 35 -6.916 -5.657 -12.658
247 H GLY 36 HN GLY 36 -5.245 -11.998 -13.526
248 HA2 GLY 36 HA2 GLY 36 -7.132 -13.090 -14.283
249 HA3 GLY 36 HA1 GLY 36 -6.515 -12.951 -15.927
250 H PHE 37 HN PHE 37 -5.617 -14.717 -16.862
251 HA PHE 37 HA PHE 37 -4.810 -16.959 -15.165
252 HB2 PHE 37 HB2 PHE 37 -6.583 -16.958 -17.606
253 HB3 PHE 37 HB1 PHE 37 -5.766 -18.393 -17.036
254 HD1 PHE 37 HD1 PHE 37 -6.359 -19.393 -14.855
255 HD2 PHE 37 HD2 PHE 37 -8.498 -16.078 -16.471
256 HE1 PHE 37 HE1 PHE 37 -8.189 -19.805 -13.270
257 HE2 PHE 37 HE2 PHE 37 -10.332 -16.491 -14.884
258 HZ PHE 37 HZ PHE 37 -10.180 -18.352 -13.282
259 H ARG 38 HN ARG 38 -4.864 -16.098 -18.644
260 HA ARG 38 HA ARG 38 -1.970 -16.557 -18.723
261 HB2 ARG 38 HB2 ARG 38 -2.297 -17.841 -20.881
262 HB3 ARG 38 HB1 ARG 38 -2.753 -18.671 -19.400
263 HG2 ARG 38 HG2 ARG 38 -5.111 -18.169 -19.844
264 HG3 ARG 38 HG1 ARG 38 -4.650 -17.331 -21.328
265 HD2 ARG 38 HD2 ARG 38 -5.432 -19.655 -21.720
266 HD3 ARG 38 HD1 ARG 38 -3.779 -19.373 -22.272
267 HE ARG 38 HE ARG 38 -3.888 -20.408 -19.598
268 HH11 ARG 38 HH11 ARG 38 -4.029 -21.345 -22.973
269 HH12 ARG 38 HH12 ARG 38 -3.388 -22.933 -22.683
270 HH21 ARG 38 HH21 ARG 38 -3.052 -22.501 -19.225
271 HH22 ARG 38 HH22 ARG 38 -2.868 -23.598 -20.561
272 H ARG 39 HN ARG 39 -1.741 -14.340 -18.917
273 HA ARG 39 HA ARG 39 -1.747 -13.531 -21.706
274 HB2 ARG 39 HB2 ARG 39 -2.624 -11.271 -21.225
275 HB3 ARG 39 HB1 ARG 39 -3.827 -12.519 -20.942
276 HG2 ARG 39 HG2 ARG 39 -3.534 -12.345 -18.563
277 HG3 ARG 39 HG1 ARG 39 -2.178 -11.235 -18.769
278 HD2 ARG 39 HD2 ARG 39 -4.274 -10.083 -18.151
279 HD3 ARG 39 HD1 ARG 39 -3.636 -9.555 -19.708
280 HE ARG 39 HE ARG 39 -5.381 -10.727 -20.794
281 HH11 ARG 39 HH11 ARG 39 -5.665 -10.794 -17.308
282 HH12 ARG 39 HH12 ARG 39 -7.364 -11.133 -17.315
283 HH21 ARG 39 HH21 ARG 39 -7.618 -11.203 -20.818
284 HH22 ARG 39 HH22 ARG 39 -8.465 -11.400 -19.319
285 H ARG 40 HN ARG 40 -0.912 -12.685 -18.367
286 HA ARG 40 HA ARG 40 1.846 -12.306 -19.091
287 HB2 ARG 40 HB2 ARG 40 0.608 -10.086 -19.573
288 HB3 ARG 40 HB1 ARG 40 0.444 -9.943 -17.828
289 HG2 ARG 40 HG2 ARG 40 2.341 -8.665 -18.487
290 HG3 ARG 40 HG1 ARG 40 2.939 -10.104 -17.655
291 HD2 ARG 40 HD2 ARG 40 4.263 -9.653 -19.655
292 HD3 ARG 40 HD1 ARG 40 3.376 -11.170 -19.827
293 HE ARG 40 HE ARG 40 2.139 -8.766 -20.934
294 HH11 ARG 40 HH11 ARG 40 3.935 -11.717 -21.555
295 HH12 ARG 40 HH12 ARG 40 3.574 -11.715 -23.252
296 HH21 ARG 40 HH21 ARG 40 1.654 -8.797 -23.160
297 HH22 ARG 40 HH22 ARG 40 2.293 -10.057 -24.167
298 H CYS 41 HN CYS 41 3.176 -12.594 -17.326
299 HA CYS 41 HA CYS 41 1.842 -13.265 -14.789
300 HB2 CYS 41 HB2 CYS 41 3.187 -15.044 -15.937
301 HB3 CYS 41 HB1 CYS 41 4.617 -14.036 -15.735
302 H PHE 42 HN PHE 42 2.696 -12.484 -12.830
303 HA PHE 42 HA PHE 42 4.634 -10.284 -12.993
304 HB2 PHE 42 HB2 PHE 42 1.904 -10.176 -11.673
305 HB3 PHE 42 HB1 PHE 42 3.181 -9.010 -11.354
306 HD1 PHE 42 HD2 PHE 42 0.985 -10.357 -14.033
307 HD2 PHE 42 HD1 PHE 42 3.524 -7.166 -12.778
308 HE1 PHE 42 HE2 PHE 42 0.244 -9.014 -15.954
309 HE2 PHE 42 HE1 PHE 42 2.777 -5.821 -14.703
310 HZ PHE 42 HZ PHE 42 1.136 -6.743 -16.292
311 H CYS 43 HN CYS 43 5.678 -9.803 -10.986
312 HA CYS 43 HA CYS 43 5.437 -11.916 -8.928
313 HB2 CYS 43 HB2 CYS 43 7.942 -10.713 -10.108
314 HB3 CYS 43 HB1 CYS 43 7.943 -11.521 -8.543
315 H THR 44 HN THR 44 5.885 -11.270 -6.775
316 HA THR 44 HA THR 44 5.793 -8.372 -6.292
317 HB THR 44 HB THR 44 4.148 -8.871 -4.419
318 HG1 THR 44 HG1 THR 44 4.215 -11.375 -5.727
319 HG21 THR 44 HG21 THR 44 3.412 -7.808 -6.500
320 HG22 THR 44 HG22 THR 44 2.179 -8.915 -5.893
321 HG23 THR 44 HG23 THR 44 3.204 -9.394 -7.247
322 H THR 45 HN THR 45 7.160 -7.722 -4.755
323 HA THR 45 HA THR 45 8.183 -9.670 -2.810
324 HB THR 45 HB THR 45 9.851 -9.359 -4.619
325 HG1 THR 45 HG1 THR 45 11.071 -9.748 -2.947
326 HG21 THR 45 HG21 THR 45 9.306 -7.073 -5.287
327 HG22 THR 45 HG22 THR 45 11.011 -7.202 -4.852
328 HG23 THR 45 HG23 THR 45 9.867 -6.467 -3.728
329 H HIS 46 HN HIS 46 9.645 -8.213 -1.189
330 HA HIS 46 HA HIS 46 7.644 -6.399 -0.043
331 HB2 HIS 46 HB2 HIS 46 8.324 -8.280 1.353
332 HB3 HIS 46 HB1 HIS 46 10.016 -7.818 1.204
333 HD1 HIS 46 HD1 HIS 46 6.904 -7.075 3.080
334 HD2 HIS 46 HD2 HIS 46 10.765 -5.556 2.765
335 HE1 HIS 46 HE1 HIS 46 7.196 -5.546 5.052
336 HE2 HIS 46 HE2 HIS 46 9.590 -4.779 4.934
337 H CYS 47 HN CYS 47 7.976 -4.264 0.016
338 HA CYS 47 HA CYS 47 10.700 -3.228 -0.350
339 HB2 CYS 47 HB2 CYS 47 8.000 -1.996 -0.887
340 HB3 CYS 47 HB1 CYS 47 9.464 -1.020 -0.781
Start of MODEL 12
1 H1 ARG 1 HT1 ARG 1 9.100 -1.368 0.946
2 H2 ARG 1 HT2 ARG 1 8.272 -2.041 2.253
3 H3 ARG 1 HT3 ARG 1 8.464 -0.366 2.151
4 HA ARG 1 HA ARG 1 6.231 -0.960 1.544
5 HB2 ARG 1 HB2 ARG 1 7.957 -0.128 -0.810
6 HB3 ARG 1 HB1 ARG 1 6.202 -0.014 -0.785
7 HG2 ARG 1 HG2 ARG 1 8.071 1.437 1.088
8 HG3 ARG 1 HG1 ARG 1 7.289 2.136 -0.331
9 HD2 ARG 1 HD2 ARG 1 5.931 1.062 2.145
10 HD3 ARG 1 HD1 ARG 1 6.057 2.751 1.653
11 HE ARG 1 HE ARG 1 4.768 1.153 -0.335
12 HH11 ARG 1 HH11 ARG 1 4.244 2.878 2.669
13 HH12 ARG 1 HH12 ARG 1 2.527 3.013 2.431
14 HH21 ARG 1 HH21 ARG 1 2.507 1.350 -0.646
15 HH22 ARG 1 HH22 ARG 1 1.546 2.159 0.555
16 H THR 2 HN THR 2 4.954 -1.815 -0.444
17 HA THR 2 HA THR 2 5.975 -4.474 -1.184
18 HB THR 2 HB THR 2 3.155 -3.373 -1.444
19 HG1 THR 2 HG1 THR 2 2.961 -5.116 0.326
20 HG21 THR 2 HG21 THR 2 2.529 -5.739 -1.780
21 HG22 THR 2 HG22 THR 2 4.233 -6.189 -1.753
22 HG23 THR 2 HG23 THR 2 3.612 -5.162 -3.046
23 H CYS 3 HN CYS 3 6.587 -4.848 -3.237
24 HA CYS 3 HA CYS 3 5.779 -2.933 -5.326
25 HB2 CYS 3 HB2 CYS 3 8.545 -4.022 -4.783
26 HB3 CYS 3 HB1 CYS 3 8.099 -3.254 -6.304
27 H GLU 4 HN GLU 4 5.438 -3.739 -7.342
28 HA GLU 4 HA GLU 4 5.486 -6.670 -7.619
29 HB2 GLU 4 HB2 GLU 4 3.560 -6.449 -9.151
30 HB3 GLU 4 HB1 GLU 4 3.189 -5.875 -7.535
31 HG2 GLU 4 HG2 GLU 4 3.966 -4.025 -9.778
32 HG3 GLU 4 HG1 GLU 4 2.303 -4.507 -9.468
33 H SER 5 HN SER 5 6.797 -7.407 -9.125
34 HA SER 5 HA SER 5 7.574 -5.667 -11.371
35 HB2 SER 5 HB2 SER 5 9.460 -6.316 -9.893
36 HB3 SER 5 HB1 SER 5 9.086 -8.016 -10.173
37 HG SER 5 HG SER 5 10.775 -6.833 -11.524
38 H GLN 6 HN GLN 6 8.474 -7.411 -13.181
39 HA GLN 6 HA GLN 6 6.167 -9.186 -13.683
40 HB2 GLN 6 HB2 GLN 6 6.180 -7.214 -15.168
41 HB3 GLN 6 HB1 GLN 6 7.800 -7.635 -15.710
42 HG2 GLN 6 HG2 GLN 6 6.948 -9.726 -16.650
43 HG3 GLN 6 HG1 GLN 6 5.326 -9.311 -16.098
44 HE21 GLN 6 HE21 GLN 6 4.485 -9.340 -18.160
45 HE22 GLN 6 HE22 GLN 6 4.827 -8.109 -19.325
46 H SER 7 HN SER 7 6.565 -11.210 -14.435
47 HA SER 7 HA SER 7 9.393 -12.023 -14.625
48 HB2 SER 7 HB2 SER 7 8.341 -14.348 -14.020
49 HB3 SER 7 HB1 SER 7 8.597 -13.157 -12.746
50 HG SER 7 HG SER 7 6.549 -13.658 -12.413
51 H HIS 8 HN HIS 8 9.927 -12.236 -16.674
52 HA HIS 8 HA HIS 8 7.962 -13.275 -18.610
53 HB2 HIS 8 HB2 HIS 8 9.084 -11.015 -18.987
54 HB3 HIS 8 HB1 HIS 8 10.592 -11.888 -19.215
55 HD1 HIS 8 HD1 HIS 8 7.568 -10.799 -20.961
56 HD2 HIS 8 HD2 HIS 8 10.598 -13.571 -21.581
57 HE1 HIS 8 HE1 HIS 8 7.397 -11.447 -23.377
58 HE2 HIS 8 HE2 HIS 8 9.394 -12.926 -23.774
59 H LYS 9 HN LYS 9 10.447 -14.271 -16.698
60 HA LYS 9 HA LYS 9 11.942 -15.990 -18.368
61 HB2 LYS 9 HB2 LYS 9 11.385 -15.974 -15.399
62 HB3 LYS 9 HB1 LYS 9 12.438 -17.165 -16.153
63 HG2 LYS 9 HG2 LYS 9 12.889 -14.199 -16.420
64 HG3 LYS 9 HG1 LYS 9 13.577 -15.163 -15.113
65 HD2 LYS 9 HD2 LYS 9 14.038 -15.619 -18.067
66 HD3 LYS 9 HD1 LYS 9 15.175 -14.851 -16.956
67 HE2 LYS 9 HE2 LYS 9 14.183 -17.701 -16.842
68 HE3 LYS 9 HE1 LYS 9 15.803 -17.168 -17.292
69 HZ1 LYS 9 HZ1 LYS 9 15.794 -17.932 -15.029
70 HZ2 LYS 9 HZ2 LYS 9 14.532 -16.890 -14.619
71 HZ3 LYS 9 HZ3 LYS 9 16.042 -16.262 -15.031
72 H PHE 10 HN PHE 10 8.852 -16.304 -16.806
73 HA PHE 10 HA PHE 10 8.570 -19.108 -16.987
74 HB2 PHE 10 HB2 PHE 10 7.144 -17.597 -15.594
75 HB3 PHE 10 HB1 PHE 10 6.392 -16.997 -17.071
76 HD1 PHE 10 HD2 PHE 10 7.027 -20.177 -15.228
77 HD2 PHE 10 HD1 PHE 10 4.458 -18.021 -17.857
78 HE1 PHE 10 HE2 PHE 10 5.389 -22.004 -15.116
79 HE2 PHE 10 HE1 PHE 10 2.809 -19.848 -17.739
80 HZ PHE 10 HZ PHE 10 3.272 -21.841 -16.373
81 H LYS 11 HN LYS 11 8.906 -20.096 -18.883
82 HA LYS 11 HA LYS 11 8.538 -18.753 -21.385
83 HB2 LYS 11 HB2 LYS 11 10.410 -20.360 -20.841
84 HB3 LYS 11 HB1 LYS 11 9.233 -21.662 -20.920
85 HG2 LYS 11 HG2 LYS 11 10.434 -21.555 -22.996
86 HG3 LYS 11 HG1 LYS 11 8.766 -21.051 -23.276
87 HD2 LYS 11 HD2 LYS 11 10.309 -19.582 -24.465
88 HD3 LYS 11 HD1 LYS 11 9.475 -18.694 -23.188
89 HE2 LYS 11 HE2 LYS 11 11.459 -18.986 -21.737
90 HE3 LYS 11 HE1 LYS 11 12.284 -19.806 -23.062
91 HZ1 LYS 11 HZ1 LYS 11 12.949 -17.516 -22.965
92 HZ2 LYS 11 HZ2 LYS 11 11.345 -16.988 -23.048
93 HZ3 LYS 11 HZ3 LYS 11 12.051 -17.768 -24.376
94 H GLY 12 HN GLY 12 7.063 -19.153 -22.994
95 HA2 GLY 12 HA2 GLY 12 5.300 -20.260 -24.078
96 HA3 GLY 12 HA1 GLY 12 5.059 -21.249 -22.644
97 HA PRO 13 HA PRO 13 1.756 -18.062 -22.307
98 HB2 PRO 13 HB2 PRO 13 -0.373 -19.675 -22.339
99 HB3 PRO 13 HB1 PRO 13 0.459 -19.259 -23.843
100 HG2 PRO 13 HG2 PRO 13 0.611 -21.777 -22.231
101 HG3 PRO 13 HG1 PRO 13 0.587 -21.570 -23.993
102 HD2 PRO 13 HD2 PRO 13 2.877 -21.964 -22.432
103 HD3 PRO 13 HD1 PRO 13 2.856 -21.335 -24.091
104 H CYS 14 HN CYS 14 -0.069 -18.079 -20.553
105 HA CYS 14 HA CYS 14 1.117 -18.853 -18.051
106 HB2 CYS 14 HB2 CYS 14 -0.230 -16.770 -18.310
107 HB3 CYS 14 HB1 CYS 14 -1.661 -17.756 -18.578
108 H ALA 15 HN ALA 15 1.259 -21.133 -18.595
109 HA ALA 15 HA ALA 15 -0.976 -22.771 -19.077
110 HB1 ALA 15 HB1 ALA 15 1.323 -23.460 -19.573
111 HB2 ALA 15 HB2 ALA 15 0.504 -24.642 -18.552
112 HB3 ALA 15 HB3 ALA 15 1.676 -23.527 -17.847
113 H SER 16 HN SER 16 0.548 -21.695 -16.099
114 HA SER 16 HA SER 16 -1.758 -22.429 -14.555
115 HB2 SER 16 HB2 SER 16 -0.697 -24.600 -14.543
116 HB3 SER 16 HB1 SER 16 0.871 -23.890 -14.166
117 HG SER 16 HG SER 16 -1.262 -24.474 -12.508
118 H ASP 17 HN ASP 17 -2.002 -20.986 -12.964
119 HA ASP 17 HA ASP 17 -0.211 -18.845 -12.549
120 HB2 ASP 17 HB2 ASP 17 -1.662 -18.207 -10.708
121 HB3 ASP 17 HB1 ASP 17 -2.665 -18.762 -12.051
122 H HIS 18 HN HIS 18 -0.789 -21.864 -10.842
123 HA HIS 18 HA HIS 18 0.713 -21.272 -8.543
124 HB2 HIS 18 HB2 HIS 18 -0.975 -23.218 -8.993
125 HB3 HIS 18 HB1 HIS 18 0.434 -24.076 -9.620
126 HD1 HIS 18 HD1 HIS 18 2.578 -23.768 -7.643
127 HD2 HIS 18 HD2 HIS 18 -1.404 -23.973 -6.449
128 HE1 HIS 18 HE1 HIS 18 2.623 -24.505 -5.243
129 HE2 HIS 18 HE2 HIS 18 0.211 -24.798 -4.608
130 H ASN 19 HN ASN 19 1.519 -22.693 -11.648
131 HA ASN 19 HA ASN 19 4.198 -23.387 -10.921
132 HB2 ASN 19 HB2 ASN 19 2.683 -23.363 -13.519
133 HB3 ASN 19 HB1 ASN 19 4.427 -23.609 -13.509
134 HD21 ASN 19 HD21 ASN 19 1.341 -24.942 -12.575
135 HD22 ASN 19 HD22 ASN 19 1.906 -26.543 -12.272
136 H CYS 20 HN CYS 20 2.676 -20.684 -12.647
137 HA CYS 20 HA CYS 20 4.971 -19.270 -13.355
138 HB2 CYS 20 HB2 CYS 20 2.876 -18.444 -14.145
139 HB3 CYS 20 HB1 CYS 20 2.224 -18.327 -12.516
140 H ALA 21 HN ALA 21 3.106 -19.191 -10.339
141 HA ALA 21 HA ALA 21 4.733 -17.418 -8.903
142 HB1 ALA 21 HB1 ALA 21 3.041 -19.684 -7.836
143 HB2 ALA 21 HB2 ALA 21 2.471 -18.053 -8.190
144 HB3 ALA 21 HB3 ALA 21 3.649 -18.317 -6.904
145 H SER 22 HN SER 22 4.749 -20.957 -9.082
146 HA SER 22 HA SER 22 6.740 -21.510 -7.236
147 HB2 SER 22 HB2 SER 22 5.269 -23.207 -8.321
148 HB3 SER 22 HB1 SER 22 6.192 -23.018 -9.811
149 HG SER 22 HG SER 22 7.300 -24.598 -8.936
150 H VAL 23 HN VAL 23 7.088 -21.110 -10.757
151 HA VAL 23 HA VAL 23 9.859 -21.327 -10.923
152 HB VAL 23 HB VAL 23 7.942 -19.738 -12.651
153 HG11 VAL 23 HG11 VAL 23 10.183 -18.849 -12.969
154 HG12 VAL 23 HG12 VAL 23 9.724 -19.805 -14.377
155 HG13 VAL 23 HG13 VAL 23 10.831 -20.477 -13.179
156 HG21 VAL 23 HG21 VAL 23 7.499 -22.143 -12.602
157 HG22 VAL 23 HG22 VAL 23 9.179 -22.471 -13.030
158 HG23 VAL 23 HG23 VAL 23 8.120 -21.650 -14.180
159 H CYS 24 HN CYS 24 7.857 -18.382 -10.661
160 HA CYS 24 HA CYS 24 9.942 -16.532 -10.628
161 HB2 CYS 24 HB2 CYS 24 7.560 -15.916 -10.873
162 HB3 CYS 24 HB1 CYS 24 7.287 -16.327 -9.183
163 H GLN 25 HN GLN 25 8.482 -18.367 -7.969
164 HA GLN 25 HA GLN 25 9.944 -17.018 -5.925
165 HB2 GLN 25 HB2 GLN 25 8.397 -19.613 -5.892
166 HB3 GLN 25 HB1 GLN 25 9.171 -18.930 -4.468
167 HG2 GLN 25 HG2 GLN 25 7.794 -16.873 -4.786
168 HG3 GLN 25 HG1 GLN 25 6.941 -17.708 -6.084
169 HE21 GLN 25 HE21 GLN 25 4.973 -17.611 -5.020
170 HE22 GLN 25 HE22 GLN 25 4.616 -18.568 -3.624
171 H THR 26 HN THR 26 10.466 -20.008 -7.759
172 HA THR 26 HA THR 26 12.687 -20.872 -6.213
173 HB THR 26 HB THR 26 13.271 -22.300 -8.190
174 HG1 THR 26 HG1 THR 26 11.815 -20.560 -9.525
175 HG21 THR 26 HG21 THR 26 11.762 -23.146 -6.475
176 HG22 THR 26 HG22 THR 26 11.257 -23.722 -8.064
177 HG23 THR 26 HG23 THR 26 10.384 -22.397 -7.290
178 H GLU 27 HN GLU 27 12.293 -18.617 -8.850
179 HA GLU 27 HA GLU 27 15.104 -18.226 -9.285
180 HB2 GLU 27 HB2 GLU 27 12.731 -16.463 -9.946
181 HB3 GLU 27 HB1 GLU 27 14.381 -16.150 -10.471
182 HG2 GLU 27 HG2 GLU 27 14.360 -18.313 -11.677
183 HG3 GLU 27 HG1 GLU 27 12.664 -18.509 -11.229
184 H ARG 28 HN ARG 28 12.599 -16.334 -7.598
185 HA ARG 28 HA ARG 28 14.493 -15.469 -5.588
186 HB2 ARG 28 HB2 ARG 28 14.758 -13.849 -7.517
187 HB3 ARG 28 HB1 ARG 28 13.077 -13.396 -7.286
188 HG2 ARG 28 HG2 ARG 28 14.097 -11.750 -6.084
189 HG3 ARG 28 HG1 ARG 28 13.868 -12.952 -4.813
190 HD2 ARG 28 HD2 ARG 28 16.384 -12.287 -6.331
191 HD3 ARG 28 HD1 ARG 28 16.092 -12.151 -4.601
192 HE ARG 28 HE ARG 28 16.676 -14.594 -6.101
193 HH11 ARG 28 HH11 ARG 28 15.860 -13.133 -3.021
194 HH12 ARG 28 HH12 ARG 28 16.499 -14.451 -2.093
195 HH21 ARG 28 HH21 ARG 28 17.521 -16.304 -4.892
196 HH22 ARG 28 HH22 ARG 28 17.448 -16.258 -3.157
197 H PHE 29 HN PHE 29 13.430 -14.684 -3.700
198 HA PHE 29 HA PHE 29 10.821 -15.654 -3.263
199 HB2 PHE 29 HB2 PHE 29 12.585 -15.208 -1.508
200 HB3 PHE 29 HB1 PHE 29 12.164 -13.508 -1.637
201 HD1 PHE 29 HD1 PHE 29 11.074 -16.800 -0.488
202 HD2 PHE 29 HD2 PHE 29 10.041 -12.678 -0.779
203 HE1 PHE 29 HE1 PHE 29 9.262 -17.140 1.138
204 HE2 PHE 29 HE2 PHE 29 8.228 -13.016 0.847
205 HZ PHE 29 HZ PHE 29 7.839 -15.249 1.812
206 H SER 30 HN SER 30 9.238 -14.926 -4.366
207 HA SER 30 HA SER 30 8.258 -12.254 -4.176
208 HB2 SER 30 HB2 SER 30 9.195 -13.234 -6.899
209 HB3 SER 30 HB1 SER 30 8.288 -11.753 -6.600
210 HG SER 30 HG SER 30 10.903 -12.376 -5.704
211 H GLY 31 HN GLY 31 6.196 -12.709 -3.789
212 HA2 GLY 31 HA2 GLY 31 4.860 -15.086 -4.583
213 HA3 GLY 31 HA1 GLY 31 4.088 -13.639 -3.948
214 H GLY 32 HN GLY 32 4.062 -15.613 -6.575
215 HA2 GLY 32 HA2 GLY 32 3.885 -13.385 -8.522
216 HA3 GLY 32 HA1 GLY 32 4.484 -14.989 -8.912
217 H ARG 33 HN ARG 33 2.116 -13.098 -9.628
218 HA ARG 33 HA ARG 33 0.073 -15.221 -9.700
219 HB2 ARG 33 HB2 ARG 33 -0.332 -12.219 -9.561
220 HB3 ARG 33 HB1 ARG 33 -1.620 -13.392 -9.786
221 HG2 ARG 33 HG2 ARG 33 0.180 -13.359 -7.366
222 HG3 ARG 33 HG1 ARG 33 -1.351 -12.492 -7.450
223 HD2 ARG 33 HD2 ARG 33 -1.673 -14.611 -6.325
224 HD3 ARG 33 HD1 ARG 33 -2.514 -14.628 -7.874
225 HE ARG 33 HE ARG 33 0.136 -15.751 -7.976
226 HH11 ARG 33 HH11 ARG 33 -3.201 -16.464 -7.197
227 HH12 ARG 33 HH12 ARG 33 -3.077 -18.134 -7.656
228 HH21 ARG 33 HH21 ARG 33 0.296 -17.965 -8.555
229 HH22 ARG 33 HH22 ARG 33 -1.109 -18.981 -8.423
230 H CYS 34 HN CYS 34 -1.570 -14.559 -11.575
231 HA CYS 34 HA CYS 34 0.119 -14.184 -13.968
232 HB2 CYS 34 HB2 CYS 34 -0.682 -16.488 -13.741
233 HB3 CYS 34 HB1 CYS 34 -2.342 -15.920 -13.602
234 H ARG 35 HN ARG 35 -0.758 -13.096 -15.739
235 HA ARG 35 HA ARG 35 -3.118 -11.413 -15.156
236 HB2 ARG 35 HB2 ARG 35 -1.062 -10.107 -14.940
237 HB3 ARG 35 HB1 ARG 35 -0.533 -10.639 -16.525
238 HG2 ARG 35 HG2 ARG 35 -1.321 -8.390 -16.692
239 HG3 ARG 35 HG1 ARG 35 -2.464 -9.445 -17.522
240 HD2 ARG 35 HD2 ARG 35 -3.086 -8.982 -14.688
241 HD3 ARG 35 HD1 ARG 35 -3.125 -7.528 -15.682
242 HE ARG 35 HE ARG 35 -4.667 -8.898 -17.175
243 HH11 ARG 35 HH11 ARG 35 -4.449 -9.371 -13.712
244 HH12 ARG 35 HH12 ARG 35 -6.114 -9.827 -13.543
245 HH21 ARG 35 HH21 ARG 35 -6.870 -9.491 -16.951
246 HH22 ARG 35 HH22 ARG 35 -7.487 -9.902 -15.381
247 H GLY 36 HN GLY 36 -4.682 -11.709 -16.587
248 HA2 GLY 36 HA2 GLY 36 -5.786 -12.193 -18.552
249 HA3 GLY 36 HA1 GLY 36 -4.250 -12.037 -19.394
250 H PHE 37 HN PHE 37 -3.273 -13.837 -20.111
251 HA PHE 37 HA PHE 37 -3.161 -16.314 -18.876
252 HB2 PHE 37 HB2 PHE 37 -5.620 -16.392 -19.349
253 HB3 PHE 37 HB1 PHE 37 -5.260 -16.293 -21.069
254 HD1 PHE 37 HD1 PHE 37 -5.146 -18.422 -18.081
255 HD2 PHE 37 HD2 PHE 37 -4.336 -18.199 -22.261
256 HE1 PHE 37 HE1 PHE 37 -4.926 -20.868 -18.165
257 HE2 PHE 37 HE2 PHE 37 -4.118 -20.648 -22.346
258 HZ PHE 37 HZ PHE 37 -4.412 -21.984 -20.299
259 H ARG 38 HN ARG 38 -3.268 -14.520 -21.877
260 HA ARG 38 HA ARG 38 -2.159 -16.317 -23.650
261 HB2 ARG 38 HB2 ARG 38 -3.104 -14.120 -24.280
262 HB3 ARG 38 HB1 ARG 38 -1.710 -13.322 -23.565
263 HG2 ARG 38 HG2 ARG 38 -1.539 -13.444 -25.998
264 HG3 ARG 38 HG1 ARG 38 -0.242 -14.342 -25.210
265 HD2 ARG 38 HD2 ARG 38 -1.163 -15.560 -27.133
266 HD3 ARG 38 HD1 ARG 38 -1.409 -16.436 -25.624
267 HE ARG 38 HE ARG 38 -3.747 -15.506 -25.696
268 HH11 ARG 38 HH11 ARG 38 -1.881 -16.002 -28.620
269 HH12 ARG 38 HH12 ARG 38 -3.278 -16.197 -29.627
270 HH21 ARG 38 HH21 ARG 38 -5.589 -15.802 -27.028
271 HH22 ARG 38 HH22 ARG 38 -5.382 -16.105 -28.724
272 H ARG 39 HN ARG 39 -0.393 -13.883 -21.717
273 HA ARG 39 HA ARG 39 1.712 -15.543 -20.969
274 HB2 ARG 39 HB2 ARG 39 2.275 -15.575 -23.392
275 HB3 ARG 39 HB1 ARG 39 2.415 -13.824 -23.371
276 HG2 ARG 39 HG2 ARG 39 4.279 -14.010 -21.767
277 HG3 ARG 39 HG1 ARG 39 4.155 -15.769 -21.856
278 HD2 ARG 39 HD2 ARG 39 4.797 -13.904 -24.148
279 HD3 ARG 39 HD1 ARG 39 5.941 -14.951 -23.310
280 HE ARG 39 HE ARG 39 4.077 -16.693 -24.186
281 HH11 ARG 39 HH11 ARG 39 5.926 -14.185 -25.787
282 HH12 ARG 39 HH12 ARG 39 5.922 -14.986 -27.326
283 HH21 ARG 39 HH21 ARG 39 4.045 -17.733 -26.240
284 HH22 ARG 39 HH22 ARG 39 4.834 -16.983 -27.589
285 H ARG 40 HN ARG 40 1.171 -14.320 -19.090
286 HA ARG 40 HA ARG 40 2.808 -11.976 -18.779
287 HB2 ARG 40 HB2 ARG 40 0.121 -11.551 -19.497
288 HB3 ARG 40 HB1 ARG 40 0.167 -11.278 -17.765
289 HG2 ARG 40 HG2 ARG 40 0.560 -9.171 -18.647
290 HG3 ARG 40 HG1 ARG 40 2.181 -9.746 -18.267
291 HD2 ARG 40 HD2 ARG 40 2.616 -10.278 -20.550
292 HD3 ARG 40 HD1 ARG 40 0.928 -10.026 -20.997
293 HE ARG 40 HE ARG 40 1.913 -7.637 -19.932
294 HH11 ARG 40 HH11 ARG 40 2.444 -9.685 -22.717
295 HH12 ARG 40 HH12 ARG 40 2.874 -8.378 -23.771
296 HH21 ARG 40 HH21 ARG 40 2.456 -5.888 -21.319
297 HH22 ARG 40 HH22 ARG 40 2.868 -6.209 -22.977
298 H CYS 41 HN CYS 41 3.591 -11.911 -16.785
299 HA CYS 41 HA CYS 41 2.170 -13.157 -14.559
300 HB2 CYS 41 HB2 CYS 41 4.769 -14.085 -15.699
301 HB3 CYS 41 HB1 CYS 41 4.632 -14.045 -13.946
302 H PHE 42 HN PHE 42 2.479 -12.115 -12.650
303 HA PHE 42 HA PHE 42 4.531 -10.003 -12.541
304 HB2 PHE 42 HB2 PHE 42 1.603 -9.765 -11.819
305 HB3 PHE 42 HB1 PHE 42 2.816 -8.640 -11.216
306 HD1 PHE 42 HD2 PHE 42 0.975 -9.781 -14.171
307 HD2 PHE 42 HD1 PHE 42 3.862 -7.028 -12.682
308 HE1 PHE 42 HE2 PHE 42 0.763 -8.446 -16.226
309 HE2 PHE 42 HE1 PHE 42 3.650 -5.691 -14.732
310 HZ PHE 42 HZ PHE 42 2.098 -6.399 -16.506
311 H CYS 43 HN CYS 43 5.643 -9.906 -10.690
312 HA CYS 43 HA CYS 43 4.851 -11.768 -8.546
313 HB2 CYS 43 HB2 CYS 43 7.627 -10.950 -9.437
314 HB3 CYS 43 HB1 CYS 43 7.265 -12.013 -8.079
315 H THR 44 HN THR 44 5.096 -11.106 -6.420
316 HA THR 44 HA THR 44 5.549 -8.226 -6.011
317 HB THR 44 HB THR 44 3.862 -8.446 -4.104
318 HG1 THR 44 HG1 THR 44 3.472 -10.928 -5.427
319 HG21 THR 44 HG21 THR 44 3.282 -7.294 -6.172
320 HG22 THR 44 HG22 THR 44 1.904 -8.235 -5.594
321 HG23 THR 44 HG23 THR 44 2.879 -8.832 -6.937
322 H THR 45 HN THR 45 6.858 -7.662 -4.372
323 HA THR 45 HA THR 45 7.622 -9.601 -2.333
324 HB THR 45 HB THR 45 9.241 -10.006 -4.149
325 HG1 THR 45 HG1 THR 45 10.696 -10.259 -2.641
326 HG21 THR 45 HG21 THR 45 10.843 -8.263 -4.807
327 HG22 THR 45 HG22 THR 45 9.981 -7.091 -3.810
328 HG23 THR 45 HG23 THR 45 9.192 -7.800 -5.219
329 H HIS 46 HN HIS 46 9.179 -8.533 -0.760
330 HA HIS 46 HA HIS 46 8.059 -5.973 -0.009
331 HB2 HIS 46 HB2 HIS 46 9.251 -6.253 2.086
332 HB3 HIS 46 HB1 HIS 46 8.442 -7.762 1.682
333 HD1 HIS 46 HD1 HIS 46 11.653 -6.436 2.685
334 HD2 HIS 46 HD2 HIS 46 10.334 -9.727 0.515
335 HE1 HIS 46 HE1 HIS 46 13.585 -8.041 2.651
336 HE2 HIS 46 HE2 HIS 46 12.794 -9.991 1.261
337 H CYS 47 HN CYS 47 8.840 -4.236 -1.003
338 HA CYS 47 HA CYS 47 11.725 -4.016 -1.505
339 HB2 CYS 47 HB2 CYS 47 11.057 -1.995 -2.856
340 HB3 CYS 47 HB1 CYS 47 10.383 -3.510 -3.450
Start of MODEL 13
1 H1 ARG 1 HT1 ARG 1 3.040 -0.601 1.002
2 H2 ARG 1 HT2 ARG 1 1.379 -0.710 0.719
3 H3 ARG 1 HT3 ARG 1 2.128 0.802 0.760
4 HA ARG 1 HA ARG 1 1.623 0.089 -1.497
5 HB2 ARG 1 HB2 ARG 1 3.828 0.552 -2.450
6 HB3 ARG 1 HB1 ARG 1 3.526 1.603 -1.074
7 HG2 ARG 1 HG2 ARG 1 4.945 0.214 0.337
8 HG3 ARG 1 HG1 ARG 1 5.218 -0.896 -1.007
9 HD2 ARG 1 HD2 ARG 1 6.321 0.880 -2.268
10 HD3 ARG 1 HD1 ARG 1 6.005 2.021 -0.957
11 HE ARG 1 HE ARG 1 7.829 -0.306 -0.790
12 HH11 ARG 1 HH11 ARG 1 6.855 2.902 0.244
13 HH12 ARG 1 HH12 ARG 1 8.160 3.071 1.374
14 HH21 ARG 1 HH21 ARG 1 9.554 -0.074 0.666
15 HH22 ARG 1 HH22 ARG 1 9.693 1.373 1.622
16 H THR 2 HN THR 2 1.516 -1.531 -2.962
17 HA THR 2 HA THR 2 2.813 -4.083 -2.340
18 HB THR 2 HB THR 2 0.807 -3.434 -4.525
19 HG1 THR 2 HG1 THR 2 -0.673 -4.511 -3.097
20 HG21 THR 2 HG21 THR 2 0.516 -5.882 -4.643
21 HG22 THR 2 HG22 THR 2 1.804 -6.088 -3.458
22 HG23 THR 2 HG23 THR 2 2.165 -5.399 -5.041
23 H CYS 3 HN CYS 3 4.470 -4.881 -3.567
24 HA CYS 3 HA CYS 3 5.452 -3.143 -5.740
25 HB2 CYS 3 HB2 CYS 3 7.192 -4.961 -4.062
26 HB3 CYS 3 HB1 CYS 3 7.677 -3.581 -5.045
27 H GLU 4 HN GLU 4 5.086 -4.059 -7.641
28 HA GLU 4 HA GLU 4 5.304 -6.991 -7.899
29 HB2 GLU 4 HB2 GLU 4 2.982 -6.511 -7.913
30 HB3 GLU 4 HB1 GLU 4 3.190 -5.137 -8.978
31 HG2 GLU 4 HG2 GLU 4 3.965 -6.843 -10.722
32 HG3 GLU 4 HG1 GLU 4 3.298 -8.062 -9.633
33 H SER 5 HN SER 5 6.658 -7.593 -9.349
34 HA SER 5 HA SER 5 7.523 -5.769 -11.499
35 HB2 SER 5 HB2 SER 5 9.341 -6.598 -10.036
36 HB3 SER 5 HB1 SER 5 8.871 -8.260 -10.385
37 HG SER 5 HG SER 5 10.262 -8.066 -11.955
38 H GLN 6 HN GLN 6 8.250 -7.248 -13.496
39 HA GLN 6 HA GLN 6 5.973 -9.041 -14.050
40 HB2 GLN 6 HB2 GLN 6 6.039 -6.884 -15.362
41 HB3 GLN 6 HB1 GLN 6 7.554 -7.420 -16.070
42 HG2 GLN 6 HG2 GLN 6 5.015 -9.017 -16.296
43 HG3 GLN 6 HG1 GLN 6 5.440 -7.751 -17.442
44 HE21 GLN 6 HE21 GLN 6 5.100 -10.668 -17.771
45 HE22 GLN 6 HE22 GLN 6 6.567 -11.231 -18.483
46 H SER 7 HN SER 7 6.412 -11.052 -14.832
47 HA SER 7 HA SER 7 9.278 -11.741 -14.962
48 HB2 SER 7 HB2 SER 7 8.065 -12.663 -12.979
49 HB3 SER 7 HB1 SER 7 6.992 -13.529 -14.077
50 HG SER 7 HG SER 7 8.629 -14.909 -13.455
51 H HIS 8 HN HIS 8 9.595 -11.640 -17.108
52 HA HIS 8 HA HIS 8 7.987 -13.348 -18.858
53 HB2 HIS 8 HB2 HIS 8 9.295 -12.366 -20.701
54 HB3 HIS 8 HB1 HIS 8 8.520 -11.122 -19.728
55 HD1 HIS 8 HD1 HIS 8 11.739 -12.139 -21.067
56 HD2 HIS 8 HD2 HIS 8 10.394 -9.769 -17.933
57 HE1 HIS 8 HE1 HIS 8 13.698 -10.706 -20.418
58 HE2 HIS 8 HE2 HIS 8 12.799 -9.156 -18.646
59 H LYS 9 HN LYS 9 10.263 -13.818 -16.686
60 HA LYS 9 HA LYS 9 12.033 -15.641 -17.973
61 HB2 LYS 9 HB2 LYS 9 11.115 -15.313 -15.105
62 HB3 LYS 9 HB1 LYS 9 12.227 -16.586 -15.588
63 HG2 LYS 9 HG2 LYS 9 12.729 -13.637 -15.969
64 HG3 LYS 9 HG1 LYS 9 13.357 -14.607 -14.635
65 HD2 LYS 9 HD2 LYS 9 14.502 -16.063 -16.299
66 HD3 LYS 9 HD1 LYS 9 13.948 -14.981 -17.578
67 HE2 LYS 9 HE2 LYS 9 15.189 -13.137 -16.564
68 HE3 LYS 9 HE1 LYS 9 15.722 -14.198 -15.261
69 HZ1 LYS 9 HZ1 LYS 9 17.415 -13.934 -16.968
70 HZ2 LYS 9 HZ2 LYS 9 16.365 -14.552 -18.139
71 HZ3 LYS 9 HZ3 LYS 9 16.901 -15.540 -16.875
72 H PHE 10 HN PHE 10 8.794 -15.752 -16.753
73 HA PHE 10 HA PHE 10 8.427 -18.570 -17.020
74 HB2 PHE 10 HB2 PHE 10 6.993 -17.083 -15.584
75 HB3 PHE 10 HB1 PHE 10 6.332 -16.372 -17.053
76 HD1 PHE 10 HD2 PHE 10 6.736 -19.605 -15.271
77 HD2 PHE 10 HD1 PHE 10 4.464 -17.349 -18.085
78 HE1 PHE 10 HE2 PHE 10 5.051 -21.394 -15.343
79 HE2 PHE 10 HE1 PHE 10 2.778 -19.139 -18.156
80 HZ PHE 10 HZ PHE 10 3.069 -21.161 -16.785
81 H LYS 11 HN LYS 11 7.078 -19.557 -18.687
82 HA LYS 11 HA LYS 11 8.072 -18.734 -21.248
83 HB2 LYS 11 HB2 LYS 11 6.244 -21.046 -20.581
84 HB3 LYS 11 HB1 LYS 11 7.170 -20.831 -22.061
85 HG2 LYS 11 HG2 LYS 11 9.251 -21.038 -20.833
86 HG3 LYS 11 HG1 LYS 11 8.364 -21.156 -19.312
87 HD2 LYS 11 HD2 LYS 11 7.281 -23.227 -20.175
88 HD3 LYS 11 HD1 LYS 11 8.320 -23.130 -21.599
89 HE2 LYS 11 HE2 LYS 11 10.303 -23.272 -20.149
90 HE3 LYS 11 HE1 LYS 11 9.256 -23.389 -18.735
91 HZ1 LYS 11 HZ1 LYS 11 9.443 -25.338 -20.963
92 HZ2 LYS 11 HZ2 LYS 11 8.334 -25.444 -19.692
93 HZ3 LYS 11 HZ3 LYS 11 9.991 -25.560 -19.380
94 H GLY 12 HN GLY 12 6.932 -16.712 -21.368
95 HA2 GLY 12 HA2 GLY 12 5.465 -15.514 -22.692
96 HA3 GLY 12 HA1 GLY 12 4.613 -17.005 -23.056
97 HA PRO 13 HA PRO 13 1.560 -14.809 -20.511
98 HB2 PRO 13 HB2 PRO 13 -0.296 -16.819 -21.592
99 HB3 PRO 13 HB1 PRO 13 -0.328 -15.062 -21.763
100 HG2 PRO 13 HG2 PRO 13 0.269 -16.690 -23.833
101 HG3 PRO 13 HG1 PRO 13 1.004 -15.086 -23.648
102 HD2 PRO 13 HD2 PRO 13 2.156 -17.781 -22.979
103 HD3 PRO 13 HD1 PRO 13 2.922 -16.396 -23.789
104 H CYS 14 HN CYS 14 0.001 -15.533 -18.851
105 HA CYS 14 HA CYS 14 1.223 -17.490 -17.164
106 HB2 CYS 14 HB2 CYS 14 0.258 -15.494 -16.171
107 HB3 CYS 14 HB1 CYS 14 -1.321 -15.881 -16.841
108 H ALA 15 HN ALA 15 1.024 -19.389 -18.442
109 HA ALA 15 HA ALA 15 -1.507 -20.562 -19.036
110 HB1 ALA 15 HB1 ALA 15 -0.222 -22.599 -19.479
111 HB2 ALA 15 HB2 ALA 15 1.206 -21.869 -18.746
112 HB3 ALA 15 HB3 ALA 15 0.535 -21.197 -20.232
113 H SER 16 HN SER 16 0.306 -20.176 -16.198
114 HA SER 16 HA SER 16 -1.666 -21.464 -14.591
115 HB2 SER 16 HB2 SER 16 -0.441 -23.480 -15.135
116 HB3 SER 16 HB1 SER 16 1.098 -22.698 -14.786
117 HG SER 16 HG SER 16 -0.792 -23.764 -13.060
118 H ASP 17 HN ASP 17 -1.887 -20.076 -12.975
119 HA ASP 17 HA ASP 17 -0.009 -18.104 -12.252
120 HB2 ASP 17 HB2 ASP 17 -1.468 -17.827 -10.207
121 HB3 ASP 17 HB1 ASP 17 -2.326 -17.729 -11.742
122 H HIS 18 HN HIS 18 -0.732 -21.296 -10.950
123 HA HIS 18 HA HIS 18 0.907 -21.183 -8.674
124 HB2 HIS 18 HB2 HIS 18 -0.826 -22.959 -9.190
125 HB3 HIS 18 HB1 HIS 18 0.337 -23.657 -10.318
126 HD1 HIS 18 HD1 HIS 18 1.432 -25.617 -9.301
127 HD2 HIS 18 HD2 HIS 18 0.671 -22.663 -6.477
128 HE1 HIS 18 HE1 HIS 18 2.318 -26.517 -7.129
129 HE2 HIS 18 HE2 HIS 18 1.662 -24.799 -5.409
130 H ASN 19 HN ASN 19 1.538 -22.176 -12.008
131 HA ASN 19 HA ASN 19 4.163 -23.122 -11.522
132 HB2 ASN 19 HB2 ASN 19 2.701 -23.711 -13.517
133 HB3 ASN 19 HB1 ASN 19 3.094 -22.130 -14.179
134 HD21 ASN 19 HD21 ASN 19 3.661 -24.776 -15.249
135 HD22 ASN 19 HD22 ASN 19 5.375 -24.868 -15.444
136 H CYS 20 HN CYS 20 2.926 -20.084 -12.923
137 HA CYS 20 HA CYS 20 5.271 -18.668 -13.290
138 HB2 CYS 20 HB2 CYS 20 3.296 -17.627 -14.047
139 HB3 CYS 20 HB1 CYS 20 2.478 -17.838 -12.507
140 H ALA 21 HN ALA 21 3.297 -18.889 -10.345
141 HA ALA 21 HA ALA 21 4.899 -17.344 -8.667
142 HB1 ALA 21 HB1 ALA 21 3.163 -19.700 -7.919
143 HB2 ALA 21 HB2 ALA 21 2.623 -18.032 -8.082
144 HB3 ALA 21 HB3 ALA 21 3.767 -18.465 -6.814
145 H SER 22 HN SER 22 4.865 -20.886 -9.067
146 HA SER 22 HA SER 22 6.840 -21.458 -7.186
147 HB2 SER 22 HB2 SER 22 5.304 -23.126 -8.287
148 HB3 SER 22 HB1 SER 22 6.335 -23.048 -9.716
149 HG SER 22 HG SER 22 7.574 -23.523 -7.256
150 H VAL 23 HN VAL 23 7.143 -20.784 -10.655
151 HA VAL 23 HA VAL 23 9.911 -21.211 -10.880
152 HB VAL 23 HB VAL 23 8.077 -19.365 -12.443
153 HG11 VAL 23 HG11 VAL 23 9.853 -19.245 -14.145
154 HG12 VAL 23 HG12 VAL 23 10.933 -20.145 -13.079
155 HG13 VAL 23 HG13 VAL 23 10.376 -18.538 -12.615
156 HG21 VAL 23 HG21 VAL 23 9.233 -22.080 -13.112
157 HG22 VAL 23 HG22 VAL 23 8.205 -21.110 -14.168
158 HG23 VAL 23 HG23 VAL 23 7.565 -21.747 -12.653
159 H CYS 24 HN CYS 24 8.115 -18.153 -10.398
160 HA CYS 24 HA CYS 24 10.402 -16.538 -10.129
161 HB2 CYS 24 HB2 CYS 24 8.077 -15.710 -10.547
162 HB3 CYS 24 HB1 CYS 24 7.696 -16.049 -8.861
163 H GLN 25 HN GLN 25 8.684 -18.533 -7.824
164 HA GLN 25 HA GLN 25 9.943 -17.469 -5.483
165 HB2 GLN 25 HB2 GLN 25 8.351 -19.988 -5.984
166 HB3 GLN 25 HB1 GLN 25 9.034 -19.600 -4.412
167 HG2 GLN 25 HG2 GLN 25 7.705 -17.562 -4.315
168 HG3 GLN 25 HG1 GLN 25 7.045 -17.906 -5.913
169 HE21 GLN 25 HE21 GLN 25 5.715 -17.616 -3.300
170 HE22 GLN 25 HE22 GLN 25 4.817 -19.073 -3.065
171 H THR 26 HN THR 26 10.655 -20.100 -7.714
172 HA THR 26 HA THR 26 12.645 -21.278 -6.014
173 HB THR 26 HB THR 26 13.299 -22.564 -8.093
174 HG1 THR 26 HG1 THR 26 10.925 -21.716 -9.312
175 HG21 THR 26 HG21 THR 26 11.262 -23.933 -8.119
176 HG22 THR 26 HG22 THR 26 10.383 -22.644 -7.298
177 HG23 THR 26 HG23 THR 26 11.703 -23.475 -6.474
178 H GLU 27 HN GLU 27 12.627 -18.945 -8.675
179 HA GLU 27 HA GLU 27 15.430 -18.715 -8.941
180 HB2 GLU 27 HB2 GLU 27 13.337 -16.560 -9.361
181 HB3 GLU 27 HB1 GLU 27 14.993 -16.515 -9.957
182 HG2 GLU 27 HG2 GLU 27 14.481 -18.615 -11.247
183 HG3 GLU 27 HG1 GLU 27 12.795 -18.400 -10.787
184 H ARG 28 HN ARG 28 13.148 -16.835 -6.953
185 HA ARG 28 HA ARG 28 14.926 -16.798 -4.716
186 HB2 ARG 28 HB2 ARG 28 14.634 -14.299 -6.355
187 HB3 ARG 28 HB1 ARG 28 14.695 -14.154 -4.607
188 HG2 ARG 28 HG2 ARG 28 16.855 -15.577 -4.805
189 HG3 ARG 28 HG1 ARG 28 16.819 -15.077 -6.498
190 HD2 ARG 28 HD2 ARG 28 18.195 -13.538 -5.254
191 HD3 ARG 28 HD1 ARG 28 16.718 -12.714 -5.755
192 HE ARG 28 HE ARG 28 17.176 -13.762 -3.025
193 HH11 ARG 28 HH11 ARG 28 15.870 -11.339 -5.186
194 HH12 ARG 28 HH12 ARG 28 15.254 -10.353 -3.900
195 HH21 ARG 28 HH21 ARG 28 16.331 -12.454 -1.328
196 HH22 ARG 28 HH22 ARG 28 15.506 -10.979 -1.732
197 H PHE 29 HN PHE 29 13.892 -15.220 -2.966
198 HA PHE 29 HA PHE 29 11.193 -16.037 -2.634
199 HB2 PHE 29 HB2 PHE 29 12.510 -15.737 -0.684
200 HB3 PHE 29 HB1 PHE 29 12.918 -14.089 -1.127
201 HD1 PHE 29 HD2 PHE 29 10.031 -16.246 -0.179
202 HD2 PHE 29 HD1 PHE 29 11.667 -12.315 -0.319
203 HE1 PHE 29 HE2 PHE 29 8.130 -15.408 1.142
204 HE2 PHE 29 HE1 PHE 29 9.766 -11.474 1.003
205 HZ PHE 29 HZ PHE 29 7.991 -13.020 1.733
206 H SER 30 HN SER 30 9.814 -15.330 -3.964
207 HA SER 30 HA SER 30 8.969 -12.615 -4.109
208 HB2 SER 30 HB2 SER 30 10.166 -13.872 -6.610
209 HB3 SER 30 HB1 SER 30 9.246 -12.369 -6.578
210 HG SER 30 HG SER 30 11.168 -12.155 -4.773
211 H GLY 31 HN GLY 31 6.849 -12.928 -3.964
212 HA2 GLY 31 HA2 GLY 31 5.513 -15.341 -4.514
213 HA3 GLY 31 HA1 GLY 31 4.742 -13.781 -4.264
214 H GLY 32 HN GLY 32 3.585 -15.450 -6.032
215 HA2 GLY 32 HA2 GLY 32 4.466 -14.489 -8.686
216 HA3 GLY 32 HA1 GLY 32 3.692 -16.041 -8.405
217 H ARG 33 HN ARG 33 2.869 -14.006 -10.228
218 HA ARG 33 HA ARG 33 0.130 -13.648 -9.321
219 HB2 ARG 33 HB2 ARG 33 1.523 -11.636 -8.566
220 HB3 ARG 33 HB1 ARG 33 1.742 -11.261 -10.267
221 HG2 ARG 33 HG2 ARG 33 -0.012 -9.895 -9.416
222 HG3 ARG 33 HG1 ARG 33 -0.736 -11.099 -10.484
223 HD2 ARG 33 HD2 ARG 33 -1.462 -12.413 -8.596
224 HD3 ARG 33 HD1 ARG 33 -0.594 -11.358 -7.480
225 HE ARG 33 HE ARG 33 -2.451 -9.840 -8.964
226 HH11 ARG 33 HH11 ARG 33 -2.324 -12.226 -6.402
227 HH12 ARG 33 HH12 ARG 33 -3.786 -11.679 -5.643
228 HH21 ARG 33 HH21 ARG 33 -4.374 -9.113 -7.957
229 HH22 ARG 33 HH22 ARG 33 -4.955 -9.926 -6.537
230 H CYS 34 HN CYS 34 -1.285 -13.087 -11.099
231 HA CYS 34 HA CYS 34 -0.060 -12.972 -13.752
232 HB2 CYS 34 HB2 CYS 34 -2.410 -14.745 -13.034
233 HB3 CYS 34 HB1 CYS 34 -1.800 -14.474 -14.666
234 H ARG 35 HN ARG 35 -0.524 -10.951 -14.282
235 HA ARG 35 HA ARG 35 -2.891 -9.688 -13.126
236 HB2 ARG 35 HB2 ARG 35 -0.679 -8.649 -12.797
237 HB3 ARG 35 HB1 ARG 35 -0.501 -8.475 -14.536
238 HG2 ARG 35 HG2 ARG 35 -2.385 -6.931 -14.599
239 HG3 ARG 35 HG1 ARG 35 -2.627 -7.137 -12.863
240 HD2 ARG 35 HD2 ARG 35 -0.394 -6.215 -12.449
241 HD3 ARG 35 HD1 ARG 35 -0.156 -6.002 -14.182
242 HE ARG 35 HE ARG 35 -2.440 -4.613 -13.668
243 HH11 ARG 35 HH11 ARG 35 0.774 -4.575 -12.278
244 HH12 ARG 35 HH12 ARG 35 0.750 -2.867 -11.952
245 HH21 ARG 35 HH21 ARG 35 -2.489 -2.377 -13.194
246 HH22 ARG 35 HH22 ARG 35 -1.117 -1.629 -12.445
247 H GLY 36 HN GLY 36 -4.321 -8.413 -14.313
248 HA2 GLY 36 HA2 GLY 36 -5.548 -7.695 -16.106
249 HA3 GLY 36 HA1 GLY 36 -4.188 -8.100 -17.134
250 H PHE 37 HN PHE 37 -6.671 -9.714 -15.209
251 HA PHE 37 HA PHE 37 -8.053 -11.456 -15.613
252 HB2 PHE 37 HB2 PHE 37 -8.658 -10.092 -17.598
253 HB3 PHE 37 HB1 PHE 37 -7.383 -10.874 -18.520
254 HD1 PHE 37 HD1 PHE 37 -10.611 -11.486 -16.785
255 HD2 PHE 37 HD2 PHE 37 -7.750 -12.893 -19.589
256 HE1 PHE 37 HE1 PHE 37 -12.190 -13.229 -17.505
257 HE2 PHE 37 HE2 PHE 37 -9.324 -14.649 -20.325
258 HZ PHE 37 HZ PHE 37 -11.548 -14.816 -19.278
259 H ARG 38 HN ARG 38 -5.310 -11.853 -15.026
260 HA ARG 38 HA ARG 38 -3.843 -13.565 -14.749
261 HB2 ARG 38 HB2 ARG 38 -6.080 -15.177 -16.000
262 HB3 ARG 38 HB1 ARG 38 -4.658 -15.881 -15.247
263 HG2 ARG 38 HG2 ARG 38 -6.599 -14.081 -13.800
264 HG3 ARG 38 HG1 ARG 38 -6.710 -15.842 -13.812
265 HD2 ARG 38 HD2 ARG 38 -4.561 -16.035 -12.736
266 HD3 ARG 38 HD1 ARG 38 -4.298 -14.298 -12.856
267 HE ARG 38 HE ARG 38 -6.344 -14.152 -11.344
268 HH11 ARG 38 HH11 ARG 38 -4.186 -16.908 -11.287
269 HH12 ARG 38 HH12 ARG 38 -4.363 -17.177 -9.582
270 HH21 ARG 38 HH21 ARG 38 -6.586 -14.519 -9.093
271 HH22 ARG 38 HH22 ARG 38 -5.715 -15.814 -8.339
272 H ARG 39 HN ARG 39 -4.010 -12.034 -17.381
273 HA ARG 39 HA ARG 39 -3.301 -13.868 -19.442
274 HB2 ARG 39 HB2 ARG 39 -3.110 -10.866 -19.246
275 HB3 ARG 39 HB1 ARG 39 -2.560 -11.747 -20.663
276 HG2 ARG 39 HG2 ARG 39 -5.374 -11.734 -19.571
277 HG3 ARG 39 HG1 ARG 39 -4.800 -10.846 -20.981
278 HD2 ARG 39 HD2 ARG 39 -4.151 -13.083 -21.971
279 HD3 ARG 39 HD1 ARG 39 -5.039 -13.831 -20.643
280 HE ARG 39 HE ARG 39 -6.419 -11.889 -22.347
281 HH11 ARG 39 HH11 ARG 39 -6.000 -15.228 -21.362
282 HH12 ARG 39 HH12 ARG 39 -7.487 -15.749 -22.088
283 HH21 ARG 39 HH21 ARG 39 -8.337 -12.590 -23.327
284 HH22 ARG 39 HH22 ARG 39 -8.803 -14.258 -23.230
285 H ARG 40 HN ARG 40 -1.326 -11.675 -17.401
286 HA ARG 40 HA ARG 40 1.069 -12.950 -18.589
287 HB2 ARG 40 HB2 ARG 40 0.640 -10.578 -19.315
288 HB3 ARG 40 HB1 ARG 40 0.873 -10.083 -17.647
289 HG2 ARG 40 HG2 ARG 40 2.911 -9.675 -18.783
290 HG3 ARG 40 HG1 ARG 40 3.176 -11.094 -17.770
291 HD2 ARG 40 HD2 ARG 40 4.150 -11.440 -19.973
292 HD3 ARG 40 HD1 ARG 40 2.796 -12.545 -19.726
293 HE ARG 40 HE ARG 40 1.735 -10.324 -20.977
294 HH11 ARG 40 HH11 ARG 40 4.195 -12.699 -21.746
295 HH12 ARG 40 HH12 ARG 40 3.952 -12.587 -23.457
296 HH21 ARG 40 HH21 ARG 40 1.406 -10.171 -23.209
297 HH22 ARG 40 HH22 ARG 40 2.353 -11.138 -24.296
298 H CYS 41 HN CYS 41 2.768 -13.457 -17.278
299 HA CYS 41 HA CYS 41 2.211 -13.837 -14.481
300 HB2 CYS 41 HB2 CYS 41 3.310 -15.636 -15.602
301 HB3 CYS 41 HB1 CYS 41 4.535 -14.571 -16.274
302 H PHE 42 HN PHE 42 2.842 -12.648 -12.840
303 HA PHE 42 HA PHE 42 4.979 -10.644 -13.126
304 HB2 PHE 42 HB2 PHE 42 2.211 -10.284 -11.943
305 HB3 PHE 42 HB1 PHE 42 3.546 -9.238 -11.464
306 HD1 PHE 42 HD2 PHE 42 1.555 -10.351 -14.410
307 HD2 PHE 42 HD1 PHE 42 4.126 -7.388 -12.765
308 HE1 PHE 42 HE2 PHE 42 1.091 -8.879 -16.326
309 HE2 PHE 42 HE1 PHE 42 3.664 -5.919 -14.677
310 HZ PHE 42 HZ PHE 42 2.143 -6.660 -16.463
311 H CYS 43 HN CYS 43 5.940 -10.060 -11.018
312 HA CYS 43 HA CYS 43 5.709 -12.241 -9.036
313 HB2 CYS 43 HB2 CYS 43 8.120 -10.572 -9.812
314 HB3 CYS 43 HB1 CYS 43 8.074 -11.622 -8.399
315 H THR 44 HN THR 44 5.302 -11.688 -6.954
316 HA THR 44 HA THR 44 4.976 -8.812 -6.370
317 HB THR 44 HB THR 44 3.239 -9.551 -4.719
318 HG1 THR 44 HG1 THR 44 4.103 -11.785 -4.660
319 HG21 THR 44 HG21 THR 44 2.558 -8.772 -6.942
320 HG22 THR 44 HG22 THR 44 1.500 -10.068 -6.381
321 HG23 THR 44 HG23 THR 44 2.749 -10.409 -7.579
322 H THR 45 HN THR 45 6.041 -7.997 -4.668
323 HA THR 45 HA THR 45 6.801 -9.623 -2.411
324 HB THR 45 HB THR 45 8.676 -10.025 -3.997
325 HG1 THR 45 HG1 THR 45 10.147 -9.825 -2.417
326 HG21 THR 45 HG21 THR 45 9.138 -7.038 -3.772
327 HG22 THR 45 HG22 THR 45 8.621 -7.900 -5.222
328 HG23 THR 45 HG23 THR 45 10.224 -8.196 -4.549
329 H HIS 46 HN HIS 46 8.295 -8.057 -0.957
330 HA HIS 46 HA HIS 46 6.849 -5.489 -0.858
331 HB2 HIS 46 HB2 HIS 46 6.546 -6.945 1.125
332 HB3 HIS 46 HB1 HIS 46 8.288 -6.951 1.380
333 HD1 HIS 46 HD1 HIS 46 5.256 -4.803 1.754
334 HD2 HIS 46 HD2 HIS 46 9.336 -4.585 2.508
335 HE1 HIS 46 HE1 HIS 46 5.567 -2.760 3.173
336 HE2 HIS 46 HE2 HIS 46 8.058 -2.537 3.451
337 H CYS 47 HN CYS 47 8.022 -3.940 -1.763
338 HA CYS 47 HA CYS 47 10.910 -4.039 -1.774
339 HB2 CYS 47 HB2 CYS 47 10.723 -1.965 -3.147
340 HB3 CYS 47 HB1 CYS 47 9.847 -3.332 -3.821
Start of MODEL 14
1 H1 ARG 1 HT1 ARG 1 5.803 -1.849 2.213
2 H2 ARG 1 HT2 ARG 1 4.158 -2.241 2.232
3 H3 ARG 1 HT3 ARG 1 4.650 -0.658 2.559
4 HA ARG 1 HA ARG 1 3.729 -0.861 0.346
5 HB2 ARG 1 HB2 ARG 1 5.438 0.837 0.785
6 HB3 ARG 1 HB1 ARG 1 6.713 -0.324 0.439
7 HG2 ARG 1 HG2 ARG 1 6.011 -0.450 -1.886
8 HG3 ARG 1 HG1 ARG 1 4.654 0.631 -1.553
9 HD2 ARG 1 HD2 ARG 1 7.578 1.338 -1.256
10 HD3 ARG 1 HD1 ARG 1 6.538 1.815 -2.601
11 HE ARG 1 HE ARG 1 5.161 2.828 -0.587
12 HH11 ARG 1 HH11 ARG 1 8.624 2.905 -1.133
13 HH12 ARG 1 HH12 ARG 1 8.846 4.413 -0.306
14 HH21 ARG 1 HH21 ARG 1 5.457 4.800 0.512
15 HH22 ARG 1 HH22 ARG 1 7.045 5.490 0.628
16 H THR 2 HN THR 2 3.158 -2.494 -0.931
17 HA THR 2 HA THR 2 4.963 -4.658 -1.569
18 HB THR 2 HB THR 2 2.157 -4.031 -2.522
19 HG1 THR 2 HG1 THR 2 2.516 -4.740 -0.282
20 HG21 THR 2 HG21 THR 2 2.138 -6.337 -3.426
21 HG22 THR 2 HG22 THR 2 3.860 -6.475 -3.067
22 HG23 THR 2 HG23 THR 2 3.295 -5.302 -4.260
23 H CYS 3 HN CYS 3 6.221 -4.791 -3.319
24 HA CYS 3 HA CYS 3 5.861 -2.819 -5.483
25 HB2 CYS 3 HB2 CYS 3 8.386 -4.168 -4.465
26 HB3 CYS 3 HB1 CYS 3 8.312 -3.146 -5.901
27 H GLU 4 HN GLU 4 5.719 -3.577 -7.555
28 HA GLU 4 HA GLU 4 5.580 -6.509 -7.826
29 HB2 GLU 4 HB2 GLU 4 3.868 -6.075 -9.604
30 HB3 GLU 4 HB1 GLU 4 3.371 -5.599 -7.985
31 HG2 GLU 4 HG2 GLU 4 3.797 -3.276 -8.486
32 HG3 GLU 4 HG1 GLU 4 4.449 -3.703 -10.068
33 H SER 5 HN SER 5 6.998 -7.365 -9.118
34 HA SER 5 HA SER 5 8.151 -5.802 -11.323
35 HB2 SER 5 HB2 SER 5 9.859 -7.687 -11.332
36 HB3 SER 5 HB1 SER 5 9.852 -6.694 -9.874
37 HG SER 5 HG SER 5 9.848 -9.131 -9.701
38 H GLN 6 HN GLN 6 8.700 -7.352 -13.260
39 HA GLN 6 HA GLN 6 6.391 -9.141 -13.706
40 HB2 GLN 6 HB2 GLN 6 6.546 -7.132 -15.232
41 HB3 GLN 6 HB1 GLN 6 8.064 -7.786 -15.840
42 HG2 GLN 6 HG2 GLN 6 6.812 -9.860 -16.500
43 HG3 GLN 6 HG1 GLN 6 5.324 -9.028 -16.054
44 HE21 GLN 6 HE21 GLN 6 7.913 -9.238 -18.341
45 HE22 GLN 6 HE22 GLN 6 7.192 -8.246 -19.550
46 H SER 7 HN SER 7 6.851 -11.113 -14.867
47 HA SER 7 HA SER 7 9.654 -11.954 -14.537
48 HB2 SER 7 HB2 SER 7 8.031 -13.082 -13.008
49 HB3 SER 7 HB1 SER 7 7.182 -13.710 -14.422
50 HG SER 7 HG SER 7 9.349 -14.686 -13.198
51 H HIS 8 HN HIS 8 10.394 -11.532 -16.536
52 HA HIS 8 HA HIS 8 9.173 -12.797 -18.855
53 HB2 HIS 8 HB2 HIS 8 10.323 -10.603 -19.097
54 HB3 HIS 8 HB1 HIS 8 11.831 -11.349 -18.578
55 HD1 HIS 8 HD1 HIS 8 13.218 -12.477 -20.350
56 HD2 HIS 8 HD2 HIS 8 9.391 -11.540 -21.681
57 HE1 HIS 8 HE1 HIS 8 13.212 -12.988 -22.813
58 HE2 HIS 8 HE2 HIS 8 10.853 -12.543 -23.564
59 H LYS 9 HN LYS 9 11.036 -13.626 -16.258
60 HA LYS 9 HA LYS 9 12.798 -15.588 -17.182
61 HB2 LYS 9 HB2 LYS 9 11.116 -15.827 -14.673
62 HB3 LYS 9 HB1 LYS 9 12.724 -16.478 -14.953
63 HG2 LYS 9 HG2 LYS 9 12.108 -13.529 -14.816
64 HG3 LYS 9 HG1 LYS 9 12.636 -14.491 -13.437
65 HD2 LYS 9 HD2 LYS 9 14.743 -14.959 -14.481
66 HD3 LYS 9 HD1 LYS 9 14.208 -14.240 -16.001
67 HE2 LYS 9 HE2 LYS 9 15.727 -12.778 -14.666
68 HE3 LYS 9 HE1 LYS 9 14.167 -12.049 -15.030
69 HZ1 LYS 9 HZ1 LYS 9 14.902 -13.321 -12.445
70 HZ2 LYS 9 HZ2 LYS 9 13.427 -12.583 -12.795
71 HZ3 LYS 9 HZ3 LYS 9 14.840 -11.658 -12.738
72 H PHE 10 HN PHE 10 9.399 -15.794 -16.207
73 HA PHE 10 HA PHE 10 8.973 -18.448 -17.124
74 HB2 PHE 10 HB2 PHE 10 7.531 -17.246 -15.449
75 HB3 PHE 10 HB1 PHE 10 6.918 -16.244 -16.764
76 HD1 PHE 10 HD2 PHE 10 6.931 -19.583 -15.277
77 HD2 PHE 10 HD1 PHE 10 5.372 -17.157 -18.411
78 HE1 PHE 10 HE2 PHE 10 5.227 -21.298 -15.755
79 HE2 PHE 10 HE1 PHE 10 3.673 -18.867 -18.894
80 HZ PHE 10 HZ PHE 10 3.599 -20.939 -17.566
81 H LYS 11 HN LYS 11 8.421 -19.168 -19.116
82 HA LYS 11 HA LYS 11 8.658 -17.193 -21.277
83 HB2 LYS 11 HB2 LYS 11 9.152 -20.179 -21.286
84 HB3 LYS 11 HB1 LYS 11 9.439 -19.084 -22.639
85 HG2 LYS 11 HG2 LYS 11 11.209 -17.992 -21.523
86 HG3 LYS 11 HG1 LYS 11 10.767 -18.694 -19.967
87 HD2 LYS 11 HD2 LYS 11 11.392 -20.931 -20.857
88 HD3 LYS 11 HD1 LYS 11 11.944 -20.147 -22.341
89 HE2 LYS 11 HE2 LYS 11 13.798 -20.599 -20.777
90 HE3 LYS 11 HE1 LYS 11 13.598 -18.877 -21.094
91 HZ1 LYS 11 HZ1 LYS 11 12.383 -18.695 -18.983
92 HZ2 LYS 11 HZ2 LYS 11 13.960 -19.250 -18.757
93 HZ3 LYS 11 HZ3 LYS 11 12.664 -20.333 -18.675
94 H GLY 12 HN GLY 12 6.678 -16.544 -21.824
95 HA2 GLY 12 HA2 GLY 12 4.872 -17.013 -23.380
96 HA3 GLY 12 HA1 GLY 12 4.733 -18.608 -22.653
97 HA PRO 13 HA PRO 13 1.626 -15.874 -20.472
98 HB2 PRO 13 HB2 PRO 13 -0.385 -17.786 -21.406
99 HB3 PRO 13 HB1 PRO 13 -0.328 -16.037 -21.635
100 HG2 PRO 13 HG2 PRO 13 0.026 -17.806 -23.667
101 HG3 PRO 13 HG1 PRO 13 0.780 -16.200 -23.640
102 HD2 PRO 13 HD2 PRO 13 1.981 -18.874 -22.967
103 HD3 PRO 13 HD1 PRO 13 2.684 -17.517 -23.876
104 H CYS 14 HN CYS 14 0.794 -16.464 -18.434
105 HA CYS 14 HA CYS 14 1.925 -18.834 -17.317
106 HB2 CYS 14 HB2 CYS 14 0.860 -18.135 -15.222
107 HB3 CYS 14 HB1 CYS 14 1.694 -16.788 -15.986
108 H ALA 15 HN ALA 15 0.943 -20.386 -18.744
109 HA ALA 15 HA ALA 15 -1.849 -20.832 -18.874
110 HB1 ALA 15 HB1 ALA 15 -1.249 -22.983 -19.900
111 HB2 ALA 15 HB2 ALA 15 0.430 -22.743 -19.416
112 HB3 ALA 15 HB3 ALA 15 -0.315 -21.653 -20.585
113 H SER 16 HN SER 16 0.590 -21.787 -16.593
114 HA SER 16 HA SER 16 -1.468 -23.204 -15.032
115 HB2 SER 16 HB2 SER 16 1.489 -23.881 -15.143
116 HB3 SER 16 HB1 SER 16 0.257 -24.729 -14.205
117 HG SER 16 HG SER 16 -0.606 -24.622 -16.695
118 H ASP 17 HN ASP 17 -1.961 -22.067 -13.298
119 HA ASP 17 HA ASP 17 -0.621 -19.777 -12.441
120 HB2 ASP 17 HB2 ASP 17 -2.100 -19.923 -10.416
121 HB3 ASP 17 HB1 ASP 17 -2.957 -20.031 -11.949
122 H HIS 18 HN HIS 18 -0.677 -23.014 -10.929
123 HA HIS 18 HA HIS 18 0.969 -22.417 -8.750
124 HB2 HIS 18 HB2 HIS 18 -0.374 -24.525 -9.056
125 HB3 HIS 18 HB1 HIS 18 0.854 -25.066 -10.204
126 HD1 HIS 18 HD1 HIS 18 2.909 -26.166 -9.258
127 HD2 HIS 18 HD2 HIS 18 0.593 -24.318 -6.345
128 HE1 HIS 18 HE1 HIS 18 3.898 -26.876 -7.062
129 HE2 HIS 18 HE2 HIS 18 2.377 -25.881 -5.317
130 H ASN 19 HN ASN 19 1.761 -23.526 -12.005
131 HA ASN 19 HA ASN 19 4.497 -23.982 -11.581
132 HB2 ASN 19 HB2 ASN 19 3.241 -24.828 -13.559
133 HB3 ASN 19 HB1 ASN 19 3.145 -23.182 -14.170
134 HD21 ASN 19 HD21 ASN 19 5.262 -25.884 -13.555
135 HD22 ASN 19 HD22 ASN 19 6.581 -25.322 -14.520
136 H CYS 20 HN CYS 20 2.919 -21.217 -13.181
137 HA CYS 20 HA CYS 20 5.137 -19.599 -13.524
138 HB2 CYS 20 HB2 CYS 20 3.114 -18.950 -14.577
139 HB3 CYS 20 HB1 CYS 20 2.228 -18.943 -13.056
140 H ALA 21 HN ALA 21 2.891 -19.687 -10.776
141 HA ALA 21 HA ALA 21 4.045 -17.733 -9.181
142 HB1 ALA 21 HB1 ALA 21 1.884 -18.755 -8.680
143 HB2 ALA 21 HB2 ALA 21 2.961 -18.870 -7.289
144 HB3 ALA 21 HB3 ALA 21 2.682 -20.283 -8.306
145 H SER 22 HN SER 22 4.646 -21.247 -9.105
146 HA SER 22 HA SER 22 6.612 -21.212 -7.126
147 HB2 SER 22 HB2 SER 22 5.480 -23.274 -7.892
148 HB3 SER 22 HB1 SER 22 6.338 -23.168 -9.431
149 HG SER 22 HG SER 22 8.256 -23.548 -8.390
150 H VAL 23 HN VAL 23 6.899 -20.929 -10.649
151 HA VAL 23 HA VAL 23 9.670 -20.936 -10.880
152 HB VAL 23 HB VAL 23 7.565 -19.506 -12.519
153 HG11 VAL 23 HG11 VAL 23 10.504 -19.821 -13.173
154 HG12 VAL 23 HG12 VAL 23 9.696 -18.305 -12.770
155 HG13 VAL 23 HG13 VAL 23 9.271 -19.164 -14.251
156 HG21 VAL 23 HG21 VAL 23 7.489 -21.951 -12.569
157 HG22 VAL 23 HG22 VAL 23 9.183 -22.000 -13.058
158 HG23 VAL 23 HG23 VAL 23 7.975 -21.294 -14.132
159 H CYS 24 HN CYS 24 7.451 -18.198 -10.328
160 HA CYS 24 HA CYS 24 9.427 -16.206 -10.133
161 HB2 CYS 24 HB2 CYS 24 7.066 -15.644 -10.356
162 HB3 CYS 24 HB1 CYS 24 6.721 -16.365 -8.788
163 H GLN 25 HN GLN 25 7.938 -18.240 -7.600
164 HA GLN 25 HA GLN 25 9.365 -17.151 -5.433
165 HB2 GLN 25 HB2 GLN 25 7.925 -19.742 -5.872
166 HB3 GLN 25 HB1 GLN 25 8.933 -19.561 -4.445
167 HG2 GLN 25 HG2 GLN 25 6.799 -18.989 -3.720
168 HG3 GLN 25 HG1 GLN 25 7.597 -17.442 -3.968
169 HE21 GLN 25 HE21 GLN 25 5.121 -19.601 -5.073
170 HE22 GLN 25 HE22 GLN 25 4.338 -18.484 -6.129
171 H THR 26 HN THR 26 10.277 -19.568 -7.808
172 HA THR 26 HA THR 26 12.577 -20.431 -6.275
173 HB THR 26 HB THR 26 13.138 -21.776 -8.312
174 HG1 THR 26 HG1 THR 26 11.708 -20.128 -9.612
175 HG21 THR 26 HG21 THR 26 11.227 -23.315 -8.112
176 HG22 THR 26 HG22 THR 26 10.323 -22.060 -7.262
177 HG23 THR 26 HG23 THR 26 11.780 -22.742 -6.537
178 H GLU 27 HN GLU 27 11.869 -18.098 -8.767
179 HA GLU 27 HA GLU 27 14.618 -17.783 -9.557
180 HB2 GLU 27 HB2 GLU 27 13.868 -16.362 -11.183
181 HB3 GLU 27 HB1 GLU 27 12.381 -17.232 -10.870
182 HG2 GLU 27 HG2 GLU 27 11.379 -15.274 -10.571
183 HG3 GLU 27 HG1 GLU 27 12.320 -15.069 -9.097
184 H ARG 28 HN ARG 28 12.405 -16.074 -7.369
185 HA ARG 28 HA ARG 28 14.640 -14.997 -5.879
186 HB2 ARG 28 HB2 ARG 28 12.852 -13.226 -7.527
187 HB3 ARG 28 HB1 ARG 28 13.480 -12.635 -5.997
188 HG2 ARG 28 HG2 ARG 28 15.152 -13.572 -8.330
189 HG3 ARG 28 HG1 ARG 28 14.819 -11.893 -7.907
190 HD2 ARG 28 HD2 ARG 28 16.923 -12.251 -6.978
191 HD3 ARG 28 HD1 ARG 28 15.844 -12.504 -5.607
192 HE ARG 28 HE ARG 28 16.525 -14.902 -7.069
193 HH11 ARG 28 HH11 ARG 28 17.364 -12.819 -4.377
194 HH12 ARG 28 HH12 ARG 28 18.371 -14.009 -3.617
195 HH21 ARG 28 HH21 ARG 28 17.840 -16.461 -6.064
196 HH22 ARG 28 HH22 ARG 28 18.630 -16.083 -4.566
197 H PHE 29 HN PHE 29 13.481 -13.240 -4.241
198 HA PHE 29 HA PHE 29 11.345 -14.749 -2.905
199 HB2 PHE 29 HB2 PHE 29 12.951 -12.374 -1.905
200 HB3 PHE 29 HB1 PHE 29 11.825 -13.343 -0.957
201 HD1 PHE 29 HD2 PHE 29 12.367 -15.961 -1.016
202 HD2 PHE 29 HD1 PHE 29 15.208 -12.843 -1.673
203 HE1 PHE 29 HE2 PHE 29 14.191 -17.490 -0.398
204 HE2 PHE 29 HE1 PHE 29 17.028 -14.376 -1.055
205 HZ PHE 29 HZ PHE 29 16.525 -16.698 -0.415
206 H SER 30 HN SER 30 9.726 -14.254 -4.296
207 HA SER 30 HA SER 30 8.337 -11.806 -3.924
208 HB2 SER 30 HB2 SER 30 9.465 -12.414 -6.685
209 HB3 SER 30 HB1 SER 30 8.295 -11.147 -6.316
210 HG SER 30 HG SER 30 11.007 -11.323 -5.544
211 H GLY 31 HN GLY 31 6.368 -12.522 -3.728
212 HA2 GLY 31 HA2 GLY 31 5.385 -15.040 -4.535
213 HA3 GLY 31 HA1 GLY 31 4.388 -13.667 -4.072
214 H GLY 32 HN GLY 32 4.247 -15.736 -6.346
215 HA2 GLY 32 HA2 GLY 32 4.356 -13.862 -8.636
216 HA3 GLY 32 HA1 GLY 32 4.653 -15.589 -8.754
217 H ARG 33 HN ARG 33 2.653 -13.536 -9.851
218 HA ARG 33 HA ARG 33 0.307 -15.259 -9.751
219 HB2 ARG 33 HB2 ARG 33 0.259 -12.338 -8.939
220 HB3 ARG 33 HB1 ARG 33 -1.180 -13.250 -9.364
221 HG2 ARG 33 HG2 ARG 33 -0.763 -14.784 -7.500
222 HG3 ARG 33 HG1 ARG 33 0.681 -13.865 -7.070
223 HD2 ARG 33 HD2 ARG 33 -0.689 -11.889 -6.642
224 HD3 ARG 33 HD1 ARG 33 -2.138 -12.778 -7.118
225 HE ARG 33 HE ARG 33 -0.825 -14.167 -5.045
226 HH11 ARG 33 HH11 ARG 33 -2.633 -11.210 -5.557
227 HH12 ARG 33 HH12 ARG 33 -3.277 -11.184 -3.942
228 HH21 ARG 33 HH21 ARG 33 -1.686 -14.126 -2.922
229 HH22 ARG 33 HH22 ARG 33 -2.758 -12.839 -2.460
230 H CYS 34 HN CYS 34 -1.450 -13.995 -11.241
231 HA CYS 34 HA CYS 34 0.027 -13.326 -13.711
232 HB2 CYS 34 HB2 CYS 34 -2.670 -14.678 -13.381
233 HB3 CYS 34 HB1 CYS 34 -1.951 -14.230 -14.923
234 H ARG 35 HN ARG 35 -0.366 -11.437 -14.636
235 HA ARG 35 HA ARG 35 -2.820 -9.950 -14.005
236 HB2 ARG 35 HB2 ARG 35 -0.722 -9.323 -12.551
237 HB3 ARG 35 HB1 ARG 35 -0.140 -8.551 -14.014
238 HG2 ARG 35 HG2 ARG 35 -2.729 -7.887 -12.610
239 HG3 ARG 35 HG1 ARG 35 -1.222 -6.987 -12.449
240 HD2 ARG 35 HD2 ARG 35 -1.298 -6.554 -14.907
241 HD3 ARG 35 HD1 ARG 35 -2.883 -7.324 -14.951
242 HE ARG 35 HE ARG 35 -2.213 -4.748 -13.705
243 HH11 ARG 35 HH11 ARG 35 -4.644 -7.144 -14.509
244 HH12 ARG 35 HH12 ARG 35 -5.971 -6.048 -14.310
245 HH21 ARG 35 HH21 ARG 35 -3.959 -3.309 -13.426
246 HH22 ARG 35 HH22 ARG 35 -5.585 -3.863 -13.700
247 H GLY 36 HN GLY 36 -3.676 -9.076 -15.814
248 HA2 GLY 36 HA2 GLY 36 -3.260 -7.692 -17.819
249 HA3 GLY 36 HA1 GLY 36 -1.932 -8.783 -18.191
250 H PHE 37 HN PHE 37 -3.922 -8.257 -20.042
251 HA PHE 37 HA PHE 37 -6.061 -10.137 -19.973
252 HB2 PHE 37 HB2 PHE 37 -4.858 -8.779 -22.402
253 HB3 PHE 37 HB1 PHE 37 -6.471 -9.473 -22.275
254 HD1 PHE 37 HD1 PHE 37 -8.163 -8.375 -20.773
255 HD2 PHE 37 HD2 PHE 37 -4.415 -6.570 -21.687
256 HE1 PHE 37 HE1 PHE 37 -9.034 -6.195 -20.043
257 HE2 PHE 37 HE2 PHE 37 -5.286 -4.385 -20.956
258 HZ PHE 37 HZ PHE 37 -7.598 -4.199 -20.129
259 H ARG 38 HN ARG 38 -2.781 -10.196 -21.144
260 HA ARG 38 HA ARG 38 -3.119 -12.736 -22.506
261 HB2 ARG 38 HB2 ARG 38 -1.668 -10.807 -23.336
262 HB3 ARG 38 HB1 ARG 38 -0.550 -11.209 -22.039
263 HG2 ARG 38 HG2 ARG 38 0.161 -12.196 -24.136
264 HG3 ARG 38 HG1 ARG 38 -0.268 -13.454 -22.977
265 HD2 ARG 38 HD2 ARG 38 -2.538 -13.537 -24.061
266 HD3 ARG 38 HD1 ARG 38 -1.905 -12.470 -25.313
267 HE ARG 38 HE ARG 38 -0.213 -14.297 -25.709
268 HH11 ARG 38 HH11 ARG 38 -3.387 -14.969 -24.384
269 HH12 ARG 38 HH12 ARG 38 -3.444 -16.586 -25.015
270 HH21 ARG 38 HH21 ARG 38 -0.283 -16.414 -26.538
271 HH22 ARG 38 HH22 ARG 38 -1.677 -17.411 -26.254
272 H ARG 39 HN ARG 39 -3.020 -12.000 -19.393
273 HA ARG 39 HA ARG 39 -2.315 -12.939 -17.457
274 HB2 ARG 39 HB2 ARG 39 -2.342 -15.356 -19.270
275 HB3 ARG 39 HB1 ARG 39 -1.954 -15.478 -17.559
276 HG2 ARG 39 HG2 ARG 39 -4.141 -14.526 -16.993
277 HG3 ARG 39 HG1 ARG 39 -4.535 -14.423 -18.708
278 HD2 ARG 39 HD2 ARG 39 -5.522 -16.401 -17.585
279 HD3 ARG 39 HD1 ARG 39 -4.460 -16.822 -18.926
280 HE ARG 39 HE ARG 39 -2.729 -17.173 -17.067
281 HH11 ARG 39 HH11 ARG 39 -6.162 -17.708 -16.623
282 HH12 ARG 39 HH12 ARG 39 -5.944 -18.990 -15.477
283 HH21 ARG 39 HH21 ARG 39 -2.436 -18.868 -15.569
284 HH22 ARG 39 HH22 ARG 39 -3.818 -19.664 -14.880
285 H ARG 40 HN ARG 40 -0.415 -11.500 -17.965
286 HA ARG 40 HA ARG 40 2.088 -12.847 -18.545
287 HB2 ARG 40 HB2 ARG 40 1.537 -10.460 -19.231
288 HB3 ARG 40 HB1 ARG 40 1.656 -10.021 -17.536
289 HG2 ARG 40 HG2 ARG 40 3.750 -9.450 -18.294
290 HG3 ARG 40 HG1 ARG 40 4.048 -11.083 -17.716
291 HD2 ARG 40 HD2 ARG 40 3.517 -10.288 -20.582
292 HD3 ARG 40 HD1 ARG 40 5.088 -10.691 -19.897
293 HE ARG 40 HE ARG 40 3.859 -12.943 -19.410
294 HH11 ARG 40 HH11 ARG 40 3.627 -10.959 -22.283
295 HH12 ARG 40 HH12 ARG 40 3.252 -12.295 -23.329
296 HH21 ARG 40 HH21 ARG 40 3.403 -14.713 -20.800
297 HH22 ARG 40 HH22 ARG 40 3.134 -14.417 -22.489
298 H CYS 41 HN CYS 41 3.483 -13.618 -17.020
299 HA CYS 41 HA CYS 41 2.696 -13.847 -14.315
300 HB2 CYS 41 HB2 CYS 41 5.275 -14.436 -15.765
301 HB3 CYS 41 HB1 CYS 41 5.121 -14.665 -14.027
302 H PHE 42 HN PHE 42 2.694 -12.281 -12.869
303 HA PHE 42 HA PHE 42 4.890 -10.308 -12.855
304 HB2 PHE 42 HB2 PHE 42 1.972 -10.027 -12.182
305 HB3 PHE 42 HB1 PHE 42 3.145 -8.988 -11.382
306 HD1 PHE 42 HD2 PHE 42 1.853 -9.985 -14.720
307 HD2 PHE 42 HD1 PHE 42 4.003 -7.086 -12.453
308 HE1 PHE 42 HE2 PHE 42 1.820 -8.455 -16.645
309 HE2 PHE 42 HE1 PHE 42 3.972 -5.556 -14.378
310 HZ PHE 42 HZ PHE 42 2.879 -6.242 -16.479
311 H CYS 43 HN CYS 43 5.835 -9.811 -10.886
312 HA CYS 43 HA CYS 43 5.361 -11.783 -8.747
313 HB2 CYS 43 HB2 CYS 43 7.930 -10.516 -9.714
314 HB3 CYS 43 HB1 CYS 43 7.806 -11.393 -8.192
315 H THR 44 HN THR 44 5.687 -11.070 -6.581
316 HA THR 44 HA THR 44 5.498 -8.170 -6.161
317 HB THR 44 HB THR 44 3.686 -8.690 -4.415
318 HG1 THR 44 HG1 THR 44 3.802 -11.136 -5.840
319 HG21 THR 44 HG21 THR 44 3.163 -7.520 -6.496
320 HG22 THR 44 HG22 THR 44 1.869 -8.644 -6.082
321 HG23 THR 44 HG23 THR 44 3.026 -9.062 -7.344
322 H THR 45 HN THR 45 6.738 -7.489 -4.570
323 HA THR 45 HA THR 45 7.536 -9.314 -2.416
324 HB THR 45 HB THR 45 9.344 -9.296 -4.138
325 HG1 THR 45 HG1 THR 45 10.221 -9.670 -2.202
326 HG21 THR 45 HG21 THR 45 9.537 -6.356 -3.456
327 HG22 THR 45 HG22 THR 45 9.037 -7.029 -5.008
328 HG23 THR 45 HG23 THR 45 10.691 -7.258 -4.441
329 H HIS 46 HN HIS 46 8.975 -7.813 -0.821
330 HA HIS 46 HA HIS 46 7.226 -5.520 -0.207
331 HB2 HIS 46 HB2 HIS 46 9.080 -7.111 1.589
332 HB3 HIS 46 HB1 HIS 46 8.110 -5.736 2.108
333 HD1 HIS 46 HD1 HIS 46 7.794 -9.319 1.007
334 HD2 HIS 46 HD2 HIS 46 5.455 -6.301 2.643
335 HE1 HIS 46 HE1 HIS 46 5.646 -10.428 1.681
336 HE2 HIS 46 HE2 HIS 46 4.309 -8.614 2.809
337 H CYS 47 HN CYS 47 8.052 -3.484 0.003
338 HA CYS 47 HA CYS 47 10.946 -3.156 -0.425
339 HB2 CYS 47 HB2 CYS 47 8.631 -1.367 -1.158
340 HB3 CYS 47 HB1 CYS 47 10.297 -0.796 -1.145
Start of MODEL 15
1 H1 ARG 1 HT1 ARG 1 2.959 -0.117 1.533
2 H2 ARG 1 HT2 ARG 1 3.590 -1.649 1.869
3 H3 ARG 1 HT3 ARG 1 2.296 -1.483 0.794
4 HA ARG 1 HA ARG 1 3.667 -0.286 -0.758
5 HB2 ARG 1 HB2 ARG 1 5.856 -0.838 1.266
6 HB3 ARG 1 HB1 ARG 1 6.137 -0.245 -0.361
7 HG2 ARG 1 HG2 ARG 1 4.531 1.218 1.728
8 HG3 ARG 1 HG1 ARG 1 6.239 1.503 1.395
9 HD2 ARG 1 HD2 ARG 1 5.557 1.989 -1.000
10 HD3 ARG 1 HD1 ARG 1 3.886 1.987 -0.433
11 HE ARG 1 HE ARG 1 5.477 3.708 1.158
12 HH11 ARG 1 HH11 ARG 1 3.935 3.557 -1.986
13 HH12 ARG 1 HH12 ARG 1 3.855 5.281 -2.166
14 HH21 ARG 1 HH21 ARG 1 5.350 5.960 0.931
15 HH22 ARG 1 HH22 ARG 1 4.629 6.647 -0.492
16 H THR 2 HN THR 2 3.161 -1.941 -2.106
17 HA THR 2 HA THR 2 4.657 -4.460 -1.811
18 HB THR 2 HB THR 2 2.183 -3.870 -3.468
19 HG1 THR 2 HG1 THR 2 1.517 -4.049 -1.397
20 HG21 THR 2 HG21 THR 2 3.629 -6.492 -2.993
21 HG22 THR 2 HG22 THR 2 3.578 -5.606 -4.517
22 HG23 THR 2 HG23 THR 2 2.101 -6.298 -3.850
23 H CYS 3 HN CYS 3 5.871 -5.244 -3.507
24 HA CYS 3 HA CYS 3 6.465 -3.342 -5.682
25 HB2 CYS 3 HB2 CYS 3 8.305 -5.468 -4.543
26 HB3 CYS 3 HB1 CYS 3 8.728 -4.215 -5.704
27 H GLU 4 HN GLU 4 5.590 -4.053 -7.547
28 HA GLU 4 HA GLU 4 5.521 -6.963 -8.054
29 HB2 GLU 4 HB2 GLU 4 3.275 -5.993 -7.944
30 HB3 GLU 4 HB1 GLU 4 3.709 -4.805 -9.162
31 HG2 GLU 4 HG2 GLU 4 4.098 -6.696 -10.748
32 HG3 GLU 4 HG1 GLU 4 3.440 -7.780 -9.524
33 H SER 5 HN SER 5 6.674 -7.680 -9.645
34 HA SER 5 HA SER 5 7.546 -5.856 -11.797
35 HB2 SER 5 HB2 SER 5 9.188 -8.089 -10.544
36 HB3 SER 5 HB1 SER 5 9.703 -7.020 -11.850
37 HG SER 5 HG SER 5 9.021 -5.350 -10.065
38 H GLN 6 HN GLN 6 8.490 -7.475 -13.636
39 HA GLN 6 HA GLN 6 6.287 -9.394 -14.077
40 HB2 GLN 6 HB2 GLN 6 6.339 -7.285 -15.516
41 HB3 GLN 6 HB1 GLN 6 7.821 -7.902 -16.229
42 HG2 GLN 6 HG2 GLN 6 5.298 -9.530 -16.244
43 HG3 GLN 6 HG1 GLN 6 5.588 -8.287 -17.457
44 HE21 GLN 6 HE21 GLN 6 5.374 -11.264 -17.600
45 HE22 GLN 6 HE22 GLN 6 6.800 -11.769 -18.435
46 H SER 7 HN SER 7 6.832 -11.305 -15.301
47 HA SER 7 HA SER 7 9.617 -12.108 -14.738
48 HB2 SER 7 HB2 SER 7 7.258 -13.991 -14.896
49 HB3 SER 7 HB1 SER 7 8.813 -14.239 -14.097
50 HG SER 7 HG SER 7 7.533 -13.714 -12.443
51 H HIS 8 HN HIS 8 10.582 -11.854 -16.661
52 HA HIS 8 HA HIS 8 9.360 -12.923 -19.089
53 HB2 HIS 8 HB2 HIS 8 10.479 -10.649 -19.026
54 HB3 HIS 8 HB1 HIS 8 12.013 -11.481 -18.801
55 HD1 HIS 8 HD1 HIS 8 13.017 -10.748 -21.040
56 HD2 HIS 8 HD2 HIS 8 9.385 -12.737 -21.426
57 HE1 HIS 8 HE1 HIS 8 12.742 -11.191 -23.499
58 HE2 HIS 8 HE2 HIS 8 10.502 -12.315 -23.719
59 H LYS 9 HN LYS 9 11.071 -14.111 -16.592
60 HA LYS 9 HA LYS 9 12.849 -15.907 -17.936
61 HB2 LYS 9 HB2 LYS 9 11.580 -16.100 -15.185
62 HB3 LYS 9 HB1 LYS 9 12.907 -17.099 -15.762
63 HG2 LYS 9 HG2 LYS 9 13.010 -14.102 -15.431
64 HG3 LYS 9 HG1 LYS 9 13.641 -15.275 -14.274
65 HD2 LYS 9 HD2 LYS 9 14.560 -15.042 -17.146
66 HD3 LYS 9 HD1 LYS 9 15.377 -14.294 -15.773
67 HE2 LYS 9 HE2 LYS 9 14.890 -17.259 -16.072
68 HE3 LYS 9 HE1 LYS 9 16.394 -16.444 -16.493
69 HZ1 LYS 9 HZ1 LYS 9 16.676 -15.796 -14.214
70 HZ2 LYS 9 HZ2 LYS 9 16.445 -17.469 -14.284
71 HZ3 LYS 9 HZ3 LYS 9 15.185 -16.460 -13.778
72 H PHE 10 HN PHE 10 9.489 -15.905 -16.982
73 HA PHE 10 HA PHE 10 9.001 -18.652 -17.679
74 HB2 PHE 10 HB2 PHE 10 7.686 -17.284 -15.968
75 HB3 PHE 10 HB1 PHE 10 6.960 -16.433 -17.327
76 HD1 PHE 10 HD2 PHE 10 7.140 -19.589 -15.493
77 HD2 PHE 10 HD1 PHE 10 5.320 -17.541 -18.757
78 HE1 PHE 10 HE2 PHE 10 5.425 -21.351 -15.643
79 HE2 PHE 10 HE1 PHE 10 3.603 -19.296 -18.903
80 HZ PHE 10 HZ PHE 10 3.654 -21.206 -17.347
81 H LYS 11 HN LYS 11 8.846 -19.335 -19.727
82 HA LYS 11 HA LYS 11 8.680 -17.394 -21.876
83 HB2 LYS 11 HB2 LYS 11 10.356 -19.199 -21.933
84 HB3 LYS 11 HB1 LYS 11 9.063 -20.387 -21.977
85 HG2 LYS 11 HG2 LYS 11 8.336 -19.573 -24.139
86 HG3 LYS 11 HG1 LYS 11 9.545 -18.288 -24.089
87 HD2 LYS 11 HD2 LYS 11 11.333 -19.952 -24.094
88 HD3 LYS 11 HD1 LYS 11 10.142 -21.253 -24.096
89 HE2 LYS 11 HE2 LYS 11 11.016 -20.900 -26.337
90 HE3 LYS 11 HE1 LYS 11 9.307 -20.469 -26.274
91 HZ1 LYS 11 HZ1 LYS 11 9.968 -18.131 -26.076
92 HZ2 LYS 11 HZ2 LYS 11 10.535 -18.825 -27.508
93 HZ3 LYS 11 HZ3 LYS 11 11.594 -18.571 -26.215
94 H GLY 12 HN GLY 12 6.803 -16.787 -22.586
95 HA2 GLY 12 HA2 GLY 12 4.772 -17.111 -23.746
96 HA3 GLY 12 HA1 GLY 12 4.670 -18.735 -23.079
97 HA PRO 13 HA PRO 13 1.977 -15.795 -20.537
98 HB2 PRO 13 HB2 PRO 13 -0.455 -16.767 -21.254
99 HB3 PRO 13 HB1 PRO 13 0.350 -15.472 -22.149
100 HG2 PRO 13 HG2 PRO 13 0.215 -18.403 -22.772
101 HG3 PRO 13 HG1 PRO 13 0.019 -17.018 -23.865
102 HD2 PRO 13 HD2 PRO 13 2.340 -18.427 -23.671
103 HD3 PRO 13 HD1 PRO 13 2.296 -16.697 -24.064
104 H CYS 14 HN CYS 14 0.574 -16.486 -18.759
105 HA CYS 14 HA CYS 14 1.587 -18.721 -17.416
106 HB2 CYS 14 HB2 CYS 14 -0.924 -17.117 -16.895
107 HB3 CYS 14 HB1 CYS 14 -0.278 -18.329 -15.792
108 H ALA 15 HN ALA 15 1.365 -20.560 -18.707
109 HA ALA 15 HA ALA 15 -1.122 -21.692 -19.439
110 HB1 ALA 15 HB1 ALA 15 0.107 -23.815 -19.588
111 HB2 ALA 15 HB2 ALA 15 1.479 -23.081 -18.756
112 HB3 ALA 15 HB3 ALA 15 1.005 -22.504 -20.352
113 H SER 16 HN SER 16 0.686 -21.515 -16.486
114 HA SER 16 HA SER 16 -1.588 -22.516 -14.982
115 HB2 SER 16 HB2 SER 16 -0.338 -24.563 -15.216
116 HB3 SER 16 HB1 SER 16 1.178 -23.749 -14.825
117 HG SER 16 HG SER 16 0.128 -24.994 -13.086
118 H ASP 17 HN ASP 17 -1.964 -21.093 -13.419
119 HA ASP 17 HA ASP 17 -0.279 -18.986 -12.667
120 HB2 ASP 17 HB2 ASP 17 -2.600 -20.277 -11.207
121 HB3 ASP 17 HB1 ASP 17 -1.799 -18.818 -10.644
122 H HIS 18 HN HIS 18 -0.628 -22.245 -11.462
123 HA HIS 18 HA HIS 18 0.831 -21.990 -9.057
124 HB2 HIS 18 HB2 HIS 18 -0.607 -23.956 -9.669
125 HB3 HIS 18 HB1 HIS 18 0.628 -24.428 -10.841
126 HD1 HIS 18 HD1 HIS 18 0.156 -24.044 -7.100
127 HD2 HIS 18 HD2 HIS 18 2.703 -25.900 -9.812
128 HE1 HIS 18 HE1 HIS 18 1.645 -25.527 -5.724
129 HE2 HIS 18 HE2 HIS 18 3.034 -26.782 -7.407
130 H ASN 19 HN ASN 19 1.784 -23.117 -12.282
131 HA ASN 19 HA ASN 19 4.482 -23.583 -11.732
132 HB2 ASN 19 HB2 ASN 19 3.240 -24.377 -13.774
133 HB3 ASN 19 HB1 ASN 19 3.310 -22.736 -14.401
134 HD21 ASN 19 HD21 ASN 19 4.405 -25.213 -15.506
135 HD22 ASN 19 HD22 ASN 19 6.098 -24.922 -15.714
136 H CYS 20 HN CYS 20 2.871 -20.720 -13.050
137 HA CYS 20 HA CYS 20 5.127 -19.121 -13.448
138 HB2 CYS 20 HB2 CYS 20 2.950 -18.528 -14.364
139 HB3 CYS 20 HB1 CYS 20 2.288 -18.330 -12.746
140 H ALA 21 HN ALA 21 2.960 -19.310 -10.623
141 HA ALA 21 HA ALA 21 4.287 -17.425 -9.027
142 HB1 ALA 21 HB1 ALA 21 2.025 -18.223 -8.538
143 HB2 ALA 21 HB2 ALA 21 3.086 -18.445 -7.145
144 HB3 ALA 21 HB3 ALA 21 2.664 -19.824 -8.162
145 H SER 22 HN SER 22 4.627 -20.935 -9.265
146 HA SER 22 HA SER 22 6.549 -21.337 -7.291
147 HB2 SER 22 HB2 SER 22 5.298 -23.151 -8.474
148 HB3 SER 22 HB1 SER 22 6.275 -22.851 -9.910
149 HG SER 22 HG SER 22 7.018 -23.959 -7.432
150 H VAL 23 HN VAL 23 6.856 -20.416 -10.674
151 HA VAL 23 HA VAL 23 9.662 -20.473 -10.871
152 HB VAL 23 HB VAL 23 7.513 -19.026 -12.418
153 HG11 VAL 23 HG11 VAL 23 9.458 -17.544 -12.488
154 HG12 VAL 23 HG12 VAL 23 9.243 -18.331 -14.050
155 HG13 VAL 23 HG13 VAL 23 10.496 -18.897 -12.946
156 HG21 VAL 23 HG21 VAL 23 8.170 -20.559 -14.198
157 HG22 VAL 23 HG22 VAL 23 7.739 -21.441 -12.734
158 HG23 VAL 23 HG23 VAL 23 9.437 -21.233 -13.167
159 H CYS 24 HN CYS 24 7.432 -17.762 -10.114
160 HA CYS 24 HA CYS 24 9.338 -15.786 -9.651
161 HB2 CYS 24 HB2 CYS 24 6.660 -16.276 -8.330
162 HB3 CYS 24 HB1 CYS 24 7.647 -14.862 -7.965
163 H GLN 25 HN GLN 25 8.152 -18.326 -7.502
164 HA GLN 25 HA GLN 25 9.535 -17.507 -5.176
165 HB2 GLN 25 HB2 GLN 25 8.628 -20.287 -5.965
166 HB3 GLN 25 HB1 GLN 25 9.090 -19.781 -4.346
167 HG2 GLN 25 HG2 GLN 25 7.204 -18.276 -4.230
168 HG3 GLN 25 HG1 GLN 25 6.770 -18.646 -5.898
169 HE21 GLN 25 HE21 GLN 25 5.176 -18.959 -3.494
170 HE22 GLN 25 HE22 GLN 25 4.751 -20.631 -3.404
171 H THR 26 HN THR 26 10.385 -19.763 -7.777
172 HA THR 26 HA THR 26 12.782 -20.686 -6.572
173 HB THR 26 HB THR 26 13.352 -21.494 -8.901
174 HG1 THR 26 HG1 THR 26 11.973 -19.767 -9.897
175 HG21 THR 26 HG21 THR 26 12.152 -22.919 -7.316
176 HG22 THR 26 HG22 THR 26 11.566 -23.181 -8.959
177 HG23 THR 26 HG23 THR 26 10.617 -22.214 -7.829
178 H GLU 27 HN GLU 27 12.011 -17.982 -8.666
179 HA GLU 27 HA GLU 27 14.648 -17.246 -9.345
180 HB2 GLU 27 HB2 GLU 27 12.120 -15.607 -9.071
181 HB3 GLU 27 HB1 GLU 27 13.641 -14.932 -9.640
182 HG2 GLU 27 HG2 GLU 27 12.155 -17.209 -10.946
183 HG3 GLU 27 HG1 GLU 27 12.113 -15.527 -11.474
184 H ARG 28 HN ARG 28 12.538 -15.671 -6.914
185 HA ARG 28 HA ARG 28 14.673 -15.611 -4.965
186 HB2 ARG 28 HB2 ARG 28 13.677 -13.050 -6.243
187 HB3 ARG 28 HB1 ARG 28 14.486 -13.089 -4.681
188 HG2 ARG 28 HG2 ARG 28 16.450 -14.144 -5.801
189 HG3 ARG 28 HG1 ARG 28 15.640 -13.883 -7.346
190 HD2 ARG 28 HD2 ARG 28 15.631 -11.475 -6.950
191 HD3 ARG 28 HD1 ARG 28 16.383 -11.724 -5.371
192 HE ARG 28 HE ARG 28 17.780 -12.684 -7.760
193 HH11 ARG 28 HH11 ARG 28 17.590 -10.370 -5.134
194 HH12 ARG 28 HH12 ARG 28 19.237 -9.848 -5.321
195 HH21 ARG 28 HH21 ARG 28 19.936 -11.999 -7.988
196 HH22 ARG 28 HH22 ARG 28 20.574 -10.791 -6.916
197 H PHE 29 HN PHE 29 13.773 -13.940 -3.109
198 HA PHE 29 HA PHE 29 11.325 -15.094 -2.198
199 HB2 PHE 29 HB2 PHE 29 12.875 -12.731 -1.093
200 HB3 PHE 29 HB1 PHE 29 11.576 -13.584 -0.261
201 HD1 PHE 29 HD2 PHE 29 11.928 -16.175 -0.013
202 HD2 PHE 29 HD1 PHE 29 15.064 -13.370 -0.682
203 HE1 PHE 29 HE2 PHE 29 13.561 -17.786 0.887
204 HE2 PHE 29 HE1 PHE 29 16.698 -14.978 0.207
205 HZ PHE 29 HZ PHE 29 15.949 -17.186 0.993
206 H SER 30 HN SER 30 9.833 -14.640 -3.743
207 HA SER 30 HA SER 30 8.539 -12.093 -3.686
208 HB2 SER 30 HB2 SER 30 9.808 -13.075 -6.274
209 HB3 SER 30 HB1 SER 30 8.704 -11.709 -6.138
210 HG SER 30 HG SER 30 10.708 -11.382 -4.399
211 H GLY 31 HN GLY 31 6.518 -12.748 -3.490
212 HA2 GLY 31 HA2 GLY 31 5.449 -15.250 -4.180
213 HA3 GLY 31 HA1 GLY 31 4.505 -13.792 -3.901
214 H GLY 32 HN GLY 32 3.489 -15.407 -5.772
215 HA2 GLY 32 HA2 GLY 32 4.298 -14.141 -8.320
216 HA3 GLY 32 HA1 GLY 32 3.954 -15.860 -8.213
217 H ARG 33 HN ARG 33 2.723 -13.735 -9.811
218 HA ARG 33 HA ARG 33 -0.012 -14.565 -9.391
219 HB2 ARG 33 HB2 ARG 33 -0.899 -12.228 -9.456
220 HB3 ARG 33 HB1 ARG 33 -0.036 -12.605 -7.972
221 HG2 ARG 33 HG2 ARG 33 1.770 -11.245 -8.515
222 HG3 ARG 33 HG1 ARG 33 1.396 -11.265 -10.238
223 HD2 ARG 33 HD2 ARG 33 0.922 -9.093 -9.148
224 HD3 ARG 33 HD1 ARG 33 -0.493 -9.816 -9.908
225 HE ARG 33 HE ARG 33 -0.586 -10.624 -7.282
226 HH11 ARG 33 HH11 ARG 33 -0.429 -7.530 -8.912
227 HH12 ARG 33 HH12 ARG 33 -1.450 -6.730 -7.753
228 HH21 ARG 33 HH21 ARG 33 -1.911 -9.560 -5.749
229 HH22 ARG 33 HH22 ARG 33 -2.292 -7.880 -5.967
230 H CYS 34 HN CYS 34 -1.234 -14.380 -11.280
231 HA CYS 34 HA CYS 34 0.207 -13.382 -13.655
232 HB2 CYS 34 HB2 CYS 34 -1.849 -15.594 -13.412
233 HB3 CYS 34 HB1 CYS 34 -1.265 -14.958 -14.947
234 H ARG 35 HN ARG 35 -0.571 -11.459 -14.278
235 HA ARG 35 HA ARG 35 -3.463 -11.009 -13.995
236 HB2 ARG 35 HB2 ARG 35 -3.189 -8.876 -12.941
237 HB3 ARG 35 HB1 ARG 35 -2.305 -10.075 -12.022
238 HG2 ARG 35 HG2 ARG 35 -0.759 -8.451 -11.974
239 HG3 ARG 35 HG1 ARG 35 -0.306 -9.172 -13.516
240 HD2 ARG 35 HD2 ARG 35 -1.383 -7.471 -14.749
241 HD3 ARG 35 HD1 ARG 35 -2.271 -6.898 -13.336
242 HE ARG 35 HE ARG 35 0.509 -6.657 -12.882
243 HH11 ARG 35 HH11 ARG 35 -2.091 -5.184 -14.724
244 HH12 ARG 35 HH12 ARG 35 -1.329 -3.624 -14.780
245 HH21 ARG 35 HH21 ARG 35 1.503 -4.628 -12.945
246 HH22 ARG 35 HH22 ARG 35 0.720 -3.304 -13.755
247 H GLY 36 HN GLY 36 -4.425 -9.950 -15.574
248 HA2 GLY 36 HA2 GLY 36 -4.246 -8.335 -17.459
249 HA3 GLY 36 HA1 GLY 36 -2.731 -9.140 -17.863
250 H PHE 37 HN PHE 37 -4.970 -8.889 -19.621
251 HA PHE 37 HA PHE 37 -6.627 -11.202 -19.558
252 HB2 PHE 37 HB2 PHE 37 -6.032 -9.359 -21.891
253 HB3 PHE 37 HB1 PHE 37 -7.384 -10.482 -21.775
254 HD1 PHE 37 HD1 PHE 37 -9.077 -10.116 -19.896
255 HD2 PHE 37 HD2 PHE 37 -6.224 -7.174 -21.061
256 HE1 PHE 37 HE1 PHE 37 -10.431 -8.373 -18.811
257 HE2 PHE 37 HE2 PHE 37 -7.579 -5.432 -19.980
258 HZ PHE 37 HZ PHE 37 -9.684 -6.031 -18.854
259 H ARG 38 HN ARG 38 -3.490 -10.538 -20.809
260 HA ARG 38 HA ARG 38 -3.382 -12.869 -22.528
261 HB2 ARG 38 HB2 ARG 38 -2.139 -10.777 -23.050
262 HB3 ARG 38 HB1 ARG 38 -1.177 -11.003 -21.600
263 HG2 ARG 38 HG2 ARG 38 0.069 -11.697 -23.555
264 HG3 ARG 38 HG1 ARG 38 -0.269 -13.090 -22.525
265 HD2 ARG 38 HD2 ARG 38 -0.617 -13.652 -24.872
266 HD3 ARG 38 HD1 ARG 38 -2.143 -13.712 -23.989
267 HE ARG 38 HE ARG 38 -1.444 -11.281 -25.485
268 HH11 ARG 38 HH11 ARG 38 -3.474 -14.104 -25.100
269 HH12 ARG 38 HH12 ARG 38 -4.659 -13.569 -26.247
270 HH21 ARG 38 HH21 ARG 38 -2.997 -10.566 -27.005
271 HH22 ARG 38 HH22 ARG 38 -4.375 -11.563 -27.351
272 H ARG 39 HN ARG 39 -3.473 -12.566 -19.296
273 HA ARG 39 HA ARG 39 -2.657 -13.603 -17.454
274 HB2 ARG 39 HB2 ARG 39 -2.057 -15.843 -19.406
275 HB3 ARG 39 HB1 ARG 39 -1.976 -15.993 -17.662
276 HG2 ARG 39 HG2 ARG 39 -4.027 -16.922 -18.138
277 HG3 ARG 39 HG1 ARG 39 -4.465 -15.266 -17.717
278 HD2 ARG 39 HD2 ARG 39 -5.623 -16.154 -19.746
279 HD3 ARG 39 HD1 ARG 39 -4.710 -14.671 -20.024
280 HE ARG 39 HE ARG 39 -3.515 -15.804 -21.580
281 HH11 ARG 39 HH11 ARG 39 -4.643 -18.187 -19.253
282 HH12 ARG 39 HH12 ARG 39 -3.968 -19.527 -20.121
283 HH21 ARG 39 HH21 ARG 39 -2.646 -17.574 -22.714
284 HH22 ARG 39 HH22 ARG 39 -2.831 -19.180 -22.083
285 H ARG 40 HN ARG 40 -1.003 -11.879 -17.600
286 HA ARG 40 HA ARG 40 1.632 -12.771 -18.494
287 HB2 ARG 40 HB2 ARG 40 0.812 -10.553 -19.183
288 HB3 ARG 40 HB1 ARG 40 0.756 -10.057 -17.497
289 HG2 ARG 40 HG2 ARG 40 3.043 -9.901 -17.321
290 HG3 ARG 40 HG1 ARG 40 3.333 -11.100 -18.581
291 HD2 ARG 40 HD2 ARG 40 3.966 -8.867 -19.332
292 HD3 ARG 40 HD1 ARG 40 2.625 -9.514 -20.279
293 HE ARG 40 HE ARG 40 1.596 -7.964 -18.165
294 HH11 ARG 40 HH11 ARG 40 3.270 -7.611 -21.222
295 HH12 ARG 40 HH12 ARG 40 2.702 -5.994 -21.486
296 HH21 ARG 40 HH21 ARG 40 0.815 -5.853 -18.539
297 HH22 ARG 40 HH22 ARG 40 1.318 -4.988 -19.957
298 H CYS 41 HN CYS 41 3.247 -13.282 -17.169
299 HA CYS 41 HA CYS 41 2.738 -13.774 -14.415
300 HB2 CYS 41 HB2 CYS 41 5.071 -14.168 -16.245
301 HB3 CYS 41 HB1 CYS 41 5.318 -14.294 -14.508
302 H PHE 42 HN PHE 42 2.954 -12.482 -12.778
303 HA PHE 42 HA PHE 42 5.074 -10.447 -12.773
304 HB2 PHE 42 HB2 PHE 42 2.245 -10.182 -11.717
305 HB3 PHE 42 HB1 PHE 42 3.547 -9.079 -11.255
306 HD1 PHE 42 HD1 PHE 42 4.484 -7.520 -12.867
307 HD2 PHE 42 HD2 PHE 42 1.262 -10.110 -13.920
308 HE1 PHE 42 HE1 PHE 42 4.075 -6.184 -14.891
309 HE2 PHE 42 HE2 PHE 42 0.876 -8.785 -15.943
310 HZ PHE 42 HZ PHE 42 2.266 -6.817 -16.435
311 H CYS 43 HN CYS 43 6.211 -10.281 -10.831
312 HA CYS 43 HA CYS 43 5.521 -12.279 -8.765
313 HB2 CYS 43 HB2 CYS 43 8.271 -11.119 -9.317
314 HB3 CYS 43 HB1 CYS 43 7.877 -12.425 -8.206
315 H THR 44 HN THR 44 5.289 -11.576 -6.692
316 HA THR 44 HA THR 44 5.456 -8.657 -6.285
317 HB THR 44 HB THR 44 3.605 -8.994 -4.619
318 HG1 THR 44 HG1 THR 44 3.950 -11.279 -4.349
319 HG21 THR 44 HG21 THR 44 3.001 -9.837 -7.460
320 HG22 THR 44 HG22 THR 44 3.104 -8.179 -6.867
321 HG23 THR 44 HG23 THR 44 1.817 -9.241 -6.293
322 H THR 45 HN THR 45 7.041 -8.125 -4.997
323 HA THR 45 HA THR 45 7.506 -9.675 -2.528
324 HB THR 45 HB THR 45 9.472 -9.846 -3.983
325 HG1 THR 45 HG1 THR 45 10.429 -9.733 -2.104
326 HG21 THR 45 HG21 THR 45 10.767 -7.838 -4.606
327 HG22 THR 45 HG22 THR 45 9.489 -6.818 -3.947
328 HG23 THR 45 HG23 THR 45 9.167 -7.842 -5.345
329 H HIS 46 HN HIS 46 8.754 -8.002 -0.930
330 HA HIS 46 HA HIS 46 7.202 -5.490 -1.013
331 HB2 HIS 46 HB2 HIS 46 8.010 -7.133 1.399
332 HB3 HIS 46 HB1 HIS 46 7.359 -5.501 1.506
333 HD1 HIS 46 HD1 HIS 46 6.291 -8.874 1.735
334 HD2 HIS 46 HD2 HIS 46 4.683 -5.432 0.047
335 HE1 HIS 46 HE1 HIS 46 3.834 -9.326 1.487
336 HE2 HIS 46 HE2 HIS 46 2.905 -7.286 0.339
337 H CYS 47 HN CYS 47 9.973 -6.397 -1.872
338 HA CYS 47 HA CYS 47 12.047 -5.516 -2.078
339 HB2 CYS 47 HB2 CYS 47 10.540 -3.025 -1.249
340 HB3 CYS 47 HB1 CYS 47 12.210 -3.009 -1.808
Start of MODEL 16
1 H1 ARG 1 HT1 ARG 1 4.109 -2.840 2.968
2 H2 ARG 1 HT2 ARG 1 2.916 -2.308 1.897
3 H3 ARG 1 HT3 ARG 1 3.629 -1.219 2.974
4 HA ARG 1 HA ARG 1 4.490 -0.928 0.745
5 HB2 ARG 1 HB2 ARG 1 6.508 -2.129 2.664
6 HB3 ARG 1 HB1 ARG 1 6.903 -1.130 1.274
7 HG2 ARG 1 HG2 ARG 1 5.338 -0.253 3.697
8 HG3 ARG 1 HG1 ARG 1 7.024 0.138 3.349
9 HD2 ARG 1 HD2 ARG 1 6.270 1.290 1.275
10 HD3 ARG 1 HD1 ARG 1 4.597 0.989 1.757
11 HE ARG 1 HE ARG 1 6.160 2.334 3.766
12 HH11 ARG 1 HH11 ARG 1 4.183 2.807 0.911
13 HH12 ARG 1 HH12 ARG 1 3.768 4.442 1.310
14 HH21 ARG 1 HH21 ARG 1 5.643 4.484 4.284
15 HH22 ARG 1 HH22 ARG 1 4.598 5.398 3.240
16 H THR 2 HN THR 2 4.583 -1.937 -1.164
17 HA THR 2 HA THR 2 5.746 -4.606 -1.369
18 HB THR 2 HB THR 2 2.943 -4.040 -2.387
19 HG1 THR 2 HG1 THR 2 3.916 -5.205 -0.008
20 HG21 THR 2 HG21 THR 2 2.873 -6.461 -2.825
21 HG22 THR 2 HG22 THR 2 4.543 -6.610 -2.280
22 HG23 THR 2 HG23 THR 2 4.169 -5.687 -3.736
23 H CYS 3 HN CYS 3 6.506 -5.090 -3.417
24 HA CYS 3 HA CYS 3 6.147 -3.070 -5.525
25 HB2 CYS 3 HB2 CYS 3 8.725 -4.445 -4.705
26 HB3 CYS 3 HB1 CYS 3 8.536 -3.502 -6.183
27 H GLU 4 HN GLU 4 5.481 -3.914 -7.399
28 HA GLU 4 HA GLU 4 5.839 -6.796 -7.859
29 HB2 GLU 4 HB2 GLU 4 3.550 -6.907 -8.762
30 HB3 GLU 4 HB1 GLU 4 3.571 -6.460 -7.064
31 HG2 GLU 4 HG2 GLU 4 3.427 -4.030 -7.946
32 HG3 GLU 4 HG1 GLU 4 2.901 -4.784 -9.450
33 H SER 5 HN SER 5 6.685 -7.259 -9.752
34 HA SER 5 HA SER 5 6.603 -5.254 -11.914
35 HB2 SER 5 HB2 SER 5 8.843 -5.349 -10.838
36 HB3 SER 5 HB1 SER 5 8.932 -7.072 -11.203
37 HG SER 5 HG SER 5 10.012 -5.934 -12.797
38 H GLN 6 HN GLN 6 7.646 -6.627 -13.961
39 HA GLN 6 HA GLN 6 5.736 -8.855 -14.283
40 HB2 GLN 6 HB2 GLN 6 5.142 -6.834 -15.572
41 HB3 GLN 6 HB1 GLN 6 6.718 -6.865 -16.349
42 HG2 GLN 6 HG2 GLN 6 6.170 -8.986 -17.411
43 HG3 GLN 6 HG1 GLN 6 4.612 -9.014 -16.589
44 HE21 GLN 6 HE21 GLN 6 4.243 -6.110 -16.944
45 HE22 GLN 6 HE22 GLN 6 3.796 -5.906 -18.600
46 H SER 7 HN SER 7 6.481 -10.753 -15.067
47 HA SER 7 HA SER 7 9.383 -10.904 -15.613
48 HB2 SER 7 HB2 SER 7 8.704 -11.986 -13.483
49 HB3 SER 7 HB1 SER 7 7.599 -13.029 -14.378
50 HG SER 7 HG SER 7 9.815 -13.843 -13.852
51 H HIS 8 HN HIS 8 9.847 -11.393 -17.633
52 HA HIS 8 HA HIS 8 7.934 -12.962 -19.229
53 HB2 HIS 8 HB2 HIS 8 8.839 -10.693 -20.034
54 HB3 HIS 8 HB1 HIS 8 10.378 -11.512 -20.273
55 HD1 HIS 8 HD1 HIS 8 6.977 -11.137 -21.720
56 HD2 HIS 8 HD2 HIS 8 10.420 -13.341 -22.450
57 HE1 HIS 8 HE1 HIS 8 6.667 -12.131 -24.004
58 HE2 HIS 8 HE2 HIS 8 8.821 -13.342 -24.482
59 H LYS 9 HN LYS 9 10.233 -13.639 -17.172
60 HA LYS 9 HA LYS 9 12.054 -15.318 -18.563
61 HB2 LYS 9 HB2 LYS 9 11.129 -15.575 -15.689
62 HB3 LYS 9 HB1 LYS 9 12.622 -16.207 -16.373
63 HG2 LYS 9 HG2 LYS 9 13.451 -13.945 -16.719
64 HG3 LYS 9 HG1 LYS 9 11.932 -13.278 -16.116
65 HD2 LYS 9 HD2 LYS 9 12.374 -14.485 -13.948
66 HD3 LYS 9 HD1 LYS 9 13.978 -14.878 -14.573
67 HE2 LYS 9 HE2 LYS 9 14.515 -12.512 -14.749
68 HE3 LYS 9 HE1 LYS 9 12.885 -12.079 -14.232
69 HZ1 LYS 9 HZ1 LYS 9 15.088 -13.217 -12.649
70 HZ2 LYS 9 HZ2 LYS 9 13.494 -13.488 -12.171
71 HZ3 LYS 9 HZ3 LYS 9 14.079 -11.903 -12.295
72 H PHE 10 HN PHE 10 8.918 -15.787 -17.077
73 HA PHE 10 HA PHE 10 8.691 -18.576 -17.552
74 HB2 PHE 10 HB2 PHE 10 7.330 -17.201 -15.916
75 HB3 PHE 10 HB1 PHE 10 6.452 -16.540 -17.287
76 HD1 PHE 10 HD2 PHE 10 7.337 -19.801 -15.695
77 HD2 PHE 10 HD1 PHE 10 4.503 -17.602 -18.003
78 HE1 PHE 10 HE2 PHE 10 5.777 -21.696 -15.587
79 HE2 PHE 10 HE1 PHE 10 2.941 -19.502 -17.893
80 HZ PHE 10 HZ PHE 10 3.580 -21.551 -16.685
81 H LYS 11 HN LYS 11 6.535 -19.135 -19.023
82 HA LYS 11 HA LYS 11 7.512 -18.655 -21.684
83 HB2 LYS 11 HB2 LYS 11 5.100 -20.231 -20.768
84 HB3 LYS 11 HB1 LYS 11 5.802 -20.269 -22.379
85 HG2 LYS 11 HG2 LYS 11 6.993 -21.313 -19.816
86 HG3 LYS 11 HG1 LYS 11 6.549 -22.220 -21.263
87 HD2 LYS 11 HD2 LYS 11 8.787 -20.194 -21.042
88 HD3 LYS 11 HD1 LYS 11 8.977 -21.944 -21.117
89 HE2 LYS 11 HE2 LYS 11 8.128 -21.995 -23.368
90 HE3 LYS 11 HE1 LYS 11 7.704 -20.285 -23.293
91 HZ1 LYS 11 HZ1 LYS 11 10.066 -19.763 -23.066
92 HZ2 LYS 11 HZ2 LYS 11 9.754 -20.595 -24.502
93 HZ3 LYS 11 HZ3 LYS 11 10.455 -21.404 -23.194
94 H GLY 12 HN GLY 12 6.477 -16.297 -20.440
95 HA2 GLY 12 HA2 GLY 12 5.353 -14.425 -21.154
96 HA3 GLY 12 HA1 GLY 12 4.899 -15.318 -22.597
97 HA PRO 13 HA PRO 13 0.686 -15.074 -21.044
98 HB2 PRO 13 HB2 PRO 13 0.383 -17.435 -22.846
99 HB3 PRO 13 HB1 PRO 13 -0.577 -15.953 -22.764
100 HG2 PRO 13 HG2 PRO 13 1.168 -16.333 -24.743
101 HG3 PRO 13 HG1 PRO 13 0.958 -14.729 -24.011
102 HD2 PRO 13 HD2 PRO 13 3.159 -16.722 -23.625
103 HD3 PRO 13 HD1 PRO 13 3.239 -14.949 -23.697
104 H CYS 14 HN CYS 14 0.870 -15.754 -18.972
105 HA CYS 14 HA CYS 14 1.826 -18.074 -17.914
106 HB2 CYS 14 HB2 CYS 14 1.234 -16.211 -16.505
107 HB3 CYS 14 HB1 CYS 14 -0.469 -16.373 -16.926
108 H ALA 15 HN ALA 15 1.351 -20.051 -18.617
109 HA ALA 15 HA ALA 15 -1.242 -20.929 -19.393
110 HB1 ALA 15 HB1 ALA 15 -0.243 -23.169 -19.435
111 HB2 ALA 15 HB2 ALA 15 1.195 -22.544 -18.625
112 HB3 ALA 15 HB3 ALA 15 0.789 -21.992 -20.250
113 H SER 16 HN SER 16 0.659 -21.120 -16.429
114 HA SER 16 HA SER 16 -1.749 -21.832 -14.936
115 HB2 SER 16 HB2 SER 16 0.854 -23.368 -14.697
116 HB3 SER 16 HB1 SER 16 -0.595 -23.624 -13.724
117 HG SER 16 HG SER 16 -0.102 -24.268 -16.410
118 H ASP 17 HN ASP 17 -1.952 -20.509 -13.301
119 HA ASP 17 HA ASP 17 -0.148 -18.538 -12.541
120 HB2 ASP 17 HB2 ASP 17 -2.565 -18.456 -12.069
121 HB3 ASP 17 HB1 ASP 17 -2.391 -19.766 -10.908
122 H HIS 18 HN HIS 18 -0.784 -21.696 -11.090
123 HA HIS 18 HA HIS 18 0.893 -21.533 -8.869
124 HB2 HIS 18 HB2 HIS 18 -0.775 -23.377 -9.404
125 HB3 HIS 18 HB1 HIS 18 0.437 -24.040 -10.498
126 HD1 HIS 18 HD1 HIS 18 -0.753 -24.467 -7.177
127 HD2 HIS 18 HD2 HIS 18 3.016 -24.517 -8.940
128 HE1 HIS 18 HE1 HIS 18 0.736 -25.699 -5.567
129 HE2 HIS 18 HE2 HIS 18 2.980 -25.814 -6.704
130 H ASN 19 HN ASN 19 1.606 -22.445 -12.208
131 HA ASN 19 HA ASN 19 4.246 -23.364 -11.653
132 HB2 ASN 19 HB2 ASN 19 2.984 -22.566 -14.289
133 HB3 ASN 19 HB1 ASN 19 4.543 -23.364 -14.122
134 HD21 ASN 19 HD21 ASN 19 3.900 -25.169 -15.288
135 HD22 ASN 19 HD22 ASN 19 2.788 -26.330 -14.657
136 H CYS 20 HN CYS 20 2.929 -20.356 -13.005
137 HA CYS 20 HA CYS 20 5.393 -19.050 -13.392
138 HB2 CYS 20 HB2 CYS 20 3.182 -18.237 -14.256
139 HB3 CYS 20 HB1 CYS 20 2.753 -17.761 -12.616
140 H ALA 21 HN ALA 21 3.250 -19.276 -10.594
141 HA ALA 21 HA ALA 21 4.637 -17.591 -8.837
142 HB1 ALA 21 HB1 ALA 21 2.995 -20.035 -8.159
143 HB2 ALA 21 HB2 ALA 21 2.360 -18.410 -8.419
144 HB3 ALA 21 HB3 ALA 21 3.428 -18.730 -7.053
145 H SER 22 HN SER 22 4.828 -21.120 -9.240
146 HA SER 22 HA SER 22 6.735 -21.655 -7.290
147 HB2 SER 22 HB2 SER 22 5.395 -23.381 -8.490
148 HB3 SER 22 HB1 SER 22 6.369 -23.105 -9.930
149 HG SER 22 HG SER 22 7.260 -24.090 -7.418
150 H VAL 23 HN VAL 23 7.176 -20.880 -10.724
151 HA VAL 23 HA VAL 23 9.959 -21.061 -10.852
152 HB VAL 23 HB VAL 23 7.978 -19.373 -12.395
153 HG11 VAL 23 HG11 VAL 23 10.138 -18.206 -12.461
154 HG12 VAL 23 HG12 VAL 23 9.774 -18.923 -14.032
155 HG13 VAL 23 HG13 VAL 23 10.941 -19.694 -12.959
156 HG21 VAL 23 HG21 VAL 23 7.809 -21.776 -12.728
157 HG22 VAL 23 HG22 VAL 23 9.530 -21.869 -13.109
158 HG23 VAL 23 HG23 VAL 23 8.435 -21.002 -14.185
159 H CYS 24 HN CYS 24 7.980 -18.116 -10.375
160 HA CYS 24 HA CYS 24 10.148 -16.386 -9.968
161 HB2 CYS 24 HB2 CYS 24 7.835 -15.655 -10.496
162 HB3 CYS 24 HB1 CYS 24 7.344 -16.100 -8.865
163 H GLN 25 HN GLN 25 8.463 -18.511 -7.749
164 HA GLN 25 HA GLN 25 9.591 -17.329 -5.375
165 HB2 GLN 25 HB2 GLN 25 8.048 -19.890 -5.818
166 HB3 GLN 25 HB1 GLN 25 8.612 -19.357 -4.239
167 HG2 GLN 25 HG2 GLN 25 7.267 -17.317 -4.452
168 HG3 GLN 25 HG1 GLN 25 6.684 -17.871 -6.023
169 HE21 GLN 25 HE21 GLN 25 5.194 -17.274 -3.571
170 HE22 GLN 25 HE22 GLN 25 4.326 -18.717 -3.178
171 H THR 26 HN THR 26 10.382 -20.036 -7.490
172 HA THR 26 HA THR 26 12.339 -21.166 -5.758
173 HB THR 26 HB THR 26 13.236 -22.275 -7.853
174 HG1 THR 26 HG1 THR 26 10.952 -21.059 -9.042
175 HG21 THR 26 HG21 THR 26 11.588 -23.386 -6.415
176 HG22 THR 26 HG22 THR 26 11.322 -23.778 -8.113
177 HG23 THR 26 HG23 THR 26 10.280 -22.606 -7.309
178 H GLU 27 HN GLU 27 12.399 -18.769 -8.360
179 HA GLU 27 HA GLU 27 15.140 -18.267 -8.468
180 HB2 GLU 27 HB2 GLU 27 12.803 -16.369 -8.726
181 HB3 GLU 27 HB1 GLU 27 14.464 -15.881 -9.027
182 HG2 GLU 27 HG2 GLU 27 14.575 -17.685 -10.769
183 HG3 GLU 27 HG1 GLU 27 12.837 -17.898 -10.554
184 H ARG 28 HN ARG 28 12.792 -16.369 -6.566
185 HA ARG 28 HA ARG 28 14.705 -15.990 -4.403
186 HB2 ARG 28 HB2 ARG 28 13.864 -13.832 -6.324
187 HB3 ARG 28 HB1 ARG 28 14.214 -13.417 -4.653
188 HG2 ARG 28 HG2 ARG 28 16.442 -13.726 -4.890
189 HG3 ARG 28 HG1 ARG 28 16.254 -15.046 -6.043
190 HD2 ARG 28 HD2 ARG 28 15.583 -12.221 -6.810
191 HD3 ARG 28 HD1 ARG 28 17.248 -12.804 -6.858
192 HE ARG 28 HE ARG 28 15.027 -13.714 -8.545
193 HH11 ARG 28 HH11 ARG 28 18.412 -13.878 -7.657
194 HH12 ARG 28 HH12 ARG 28 18.885 -14.710 -9.103
195 HH21 ARG 28 HH21 ARG 28 15.653 -14.817 -10.475
196 HH22 ARG 28 HH22 ARG 28 17.324 -15.249 -10.693
197 H PHE 29 HN PHE 29 13.575 -14.193 -2.845
198 HA PHE 29 HA PHE 29 10.978 -15.264 -2.219
199 HB2 PHE 29 HB2 PHE 29 12.341 -14.659 -0.362
200 HB3 PHE 29 HB1 PHE 29 12.586 -13.034 -0.984
201 HD1 PHE 29 HD2 PHE 29 9.951 -15.338 0.286
202 HD2 PHE 29 HD1 PHE 29 11.168 -11.304 -0.340
203 HE1 PHE 29 HE2 PHE 29 7.989 -14.551 1.549
204 HE2 PHE 29 HE1 PHE 29 9.209 -10.510 0.921
205 HZ PHE 29 HZ PHE 29 7.615 -12.136 1.867
206 H SER 30 HN SER 30 9.536 -14.818 -3.578
207 HA SER 30 HA SER 30 8.357 -12.281 -3.875
208 HB2 SER 30 HB2 SER 30 8.782 -12.148 -6.417
209 HB3 SER 30 HB1 SER 30 10.097 -11.655 -5.354
210 HG SER 30 HG SER 30 9.849 -14.246 -6.504
211 H GLY 31 HN GLY 31 6.307 -12.869 -3.883
212 HA2 GLY 31 HA2 GLY 31 5.398 -15.444 -4.727
213 HA3 GLY 31 HA1 GLY 31 4.386 -14.079 -4.268
214 H GLY 32 HN GLY 32 4.152 -15.988 -6.555
215 HA2 GLY 32 HA2 GLY 32 4.448 -14.057 -8.782
216 HA3 GLY 32 HA1 GLY 32 4.548 -15.802 -8.966
217 H ARG 33 HN ARG 33 2.757 -13.696 -10.136
218 HA ARG 33 HA ARG 33 0.218 -15.068 -9.635
219 HB2 ARG 33 HB2 ARG 33 0.693 -12.796 -8.279
220 HB3 ARG 33 HB1 ARG 33 0.127 -12.086 -9.775
221 HG2 ARG 33 HG2 ARG 33 -1.705 -12.268 -8.237
222 HG3 ARG 33 HG1 ARG 33 -1.960 -13.406 -9.564
223 HD2 ARG 33 HD2 ARG 33 -1.556 -15.252 -8.233
224 HD3 ARG 33 HD1 ARG 33 -0.564 -14.349 -7.090
225 HE ARG 33 HE ARG 33 -3.253 -13.453 -7.011
226 HH11 ARG 33 HH11 ARG 33 -1.238 -16.138 -6.051
227 HH12 ARG 33 HH12 ARG 33 -2.175 -16.507 -4.638
228 HH21 ARG 33 HH21 ARG 33 -4.483 -13.911 -5.144
229 HH22 ARG 33 HH22 ARG 33 -4.025 -15.238 -4.121
230 H CYS 34 HN CYS 34 -1.218 -14.885 -11.364
231 HA CYS 34 HA CYS 34 -0.062 -13.744 -13.827
232 HB2 CYS 34 HB2 CYS 34 -2.005 -16.059 -13.586
233 HB3 CYS 34 HB1 CYS 34 -1.243 -15.475 -15.067
234 H ARG 35 HN ARG 35 -0.968 -11.823 -14.070
235 HA ARG 35 HA ARG 35 -3.797 -11.454 -13.325
236 HB2 ARG 35 HB2 ARG 35 -1.939 -10.297 -11.972
237 HB3 ARG 35 HB1 ARG 35 -1.677 -9.299 -13.393
238 HG2 ARG 35 HG2 ARG 35 -3.052 -8.039 -11.954
239 HG3 ARG 35 HG1 ARG 35 -4.116 -8.634 -13.228
240 HD2 ARG 35 HD2 ARG 35 -3.798 -9.981 -10.541
241 HD3 ARG 35 HD1 ARG 35 -5.043 -8.785 -10.892
242 HE ARG 35 HE ARG 35 -5.911 -10.333 -12.577
243 HH11 ARG 35 HH11 ARG 35 -3.796 -11.655 -10.119
244 HH12 ARG 35 HH12 ARG 35 -4.400 -13.274 -10.293
245 HH21 ARG 35 HH21 ARG 35 -6.722 -12.427 -12.791
246 HH22 ARG 35 HH22 ARG 35 -6.090 -13.711 -11.806
247 H GLY 36 HN GLY 36 -5.060 -10.016 -14.600
248 HA2 GLY 36 HA2 GLY 36 -5.612 -8.742 -16.455
249 HA3 GLY 36 HA1 GLY 36 -3.975 -8.935 -17.059
250 H PHE 37 HN PHE 37 -6.580 -9.248 -18.413
251 HA PHE 37 HA PHE 37 -7.220 -11.922 -18.917
252 HB2 PHE 37 HB2 PHE 37 -7.360 -9.611 -20.876
253 HB3 PHE 37 HB1 PHE 37 -8.249 -11.127 -20.993
254 HD1 PHE 37 HD2 PHE 37 -9.864 -11.688 -19.051
255 HD2 PHE 37 HD1 PHE 37 -8.323 -7.779 -19.787
256 HE1 PHE 37 HE2 PHE 37 -11.716 -10.713 -17.760
257 HE2 PHE 37 HE1 PHE 37 -10.179 -6.806 -18.492
258 HZ PHE 37 HZ PHE 37 -11.875 -8.270 -17.479
259 H ARG 38 HN ARG 38 -4.514 -10.050 -19.895
260 HA ARG 38 HA ARG 38 -3.765 -11.621 -22.170
261 HB2 ARG 38 HB2 ARG 38 -3.130 -9.228 -21.872
262 HB3 ARG 38 HB1 ARG 38 -2.092 -9.695 -20.533
263 HG2 ARG 38 HG2 ARG 38 -0.793 -9.346 -22.558
264 HG3 ARG 38 HG1 ARG 38 -0.720 -11.037 -22.060
265 HD2 ARG 38 HD2 ARG 38 -2.564 -11.498 -23.706
266 HD3 ARG 38 HD1 ARG 38 -2.368 -9.846 -24.290
267 HE ARG 38 HE ARG 38 0.138 -11.048 -24.357
268 HH11 ARG 38 HH11 ARG 38 -2.979 -11.372 -25.928
269 HH12 ARG 38 HH12 ARG 38 -2.331 -12.149 -27.341
270 HH21 ARG 38 HH21 ARG 38 1.003 -12.043 -26.219
271 HH22 ARG 38 HH22 ARG 38 -0.051 -12.503 -27.521
272 H ARG 39 HN ARG 39 -3.842 -12.425 -18.999
273 HA ARG 39 HA ARG 39 -2.924 -14.088 -17.738
274 HB2 ARG 39 HB2 ARG 39 -1.579 -15.080 -20.263
275 HB3 ARG 39 HB1 ARG 39 -2.025 -16.016 -18.845
276 HG2 ARG 39 HG2 ARG 39 -3.960 -14.754 -20.787
277 HG3 ARG 39 HG1 ARG 39 -3.493 -16.454 -20.759
278 HD2 ARG 39 HD2 ARG 39 -4.421 -16.638 -18.476
279 HD3 ARG 39 HD1 ARG 39 -4.941 -14.954 -18.573
280 HE ARG 39 HE ARG 39 -6.331 -15.679 -20.517
281 HH11 ARG 39 HH11 ARG 39 -5.419 -17.965 -18.029
282 HH12 ARG 39 HH12 ARG 39 -6.752 -19.029 -18.347
283 HH21 ARG 39 HH21 ARG 39 -8.065 -17.084 -20.952
284 HH22 ARG 39 HH22 ARG 39 -8.257 -18.532 -20.013
285 H ARG 40 HN ARG 40 -1.592 -11.710 -17.616
286 HA ARG 40 HA ARG 40 1.162 -11.955 -18.444
287 HB2 ARG 40 HB2 ARG 40 -0.333 -9.828 -18.362
288 HB3 ARG 40 HB1 ARG 40 0.081 -9.791 -16.654
289 HG2 ARG 40 HG2 ARG 40 1.661 -8.390 -17.590
290 HG3 ARG 40 HG1 ARG 40 2.530 -9.923 -17.483
291 HD2 ARG 40 HD2 ARG 40 2.961 -9.010 -19.645
292 HD3 ARG 40 HD1 ARG 40 1.856 -10.367 -19.862
293 HE ARG 40 HE ARG 40 0.059 -8.775 -20.157
294 HH11 ARG 40 HH11 ARG 40 3.302 -7.462 -20.298
295 HH12 ARG 40 HH12 ARG 40 2.819 -6.020 -21.132
296 HH21 ARG 40 HH21 ARG 40 -0.582 -6.874 -21.280
297 HH22 ARG 40 HH22 ARG 40 0.624 -5.705 -21.720
298 H CYS 41 HN CYS 41 2.850 -12.610 -17.223
299 HA CYS 41 HA CYS 41 2.425 -13.498 -14.511
300 HB2 CYS 41 HB2 CYS 41 4.566 -13.791 -16.546
301 HB3 CYS 41 HB1 CYS 41 5.081 -13.849 -14.865
302 H PHE 42 HN PHE 42 2.737 -12.337 -12.761
303 HA PHE 42 HA PHE 42 4.634 -10.083 -12.804
304 HB2 PHE 42 HB2 PHE 42 1.939 -10.277 -11.444
305 HB3 PHE 42 HB1 PHE 42 3.146 -9.088 -10.971
306 HD1 PHE 42 HD1 PHE 42 3.701 -7.221 -12.422
307 HD2 PHE 42 HD2 PHE 42 0.768 -10.097 -13.557
308 HE1 PHE 42 HE1 PHE 42 2.899 -5.703 -14.180
309 HE2 PHE 42 HE2 PHE 42 -0.028 -8.581 -15.317
310 HZ PHE 42 HZ PHE 42 1.029 -6.380 -15.635
311 H CYS 43 HN CYS 43 5.925 -9.806 -11.007
312 HA CYS 43 HA CYS 43 5.870 -11.951 -8.984
313 HB2 CYS 43 HB2 CYS 43 8.181 -10.485 -10.251
314 HB3 CYS 43 HB1 CYS 43 8.353 -11.265 -8.683
315 H THR 44 HN THR 44 5.768 -11.371 -6.890
316 HA THR 44 HA THR 44 5.593 -8.494 -6.274
317 HB THR 44 HB THR 44 3.824 -9.172 -4.592
318 HG1 THR 44 HG1 THR 44 3.975 -11.605 -6.078
319 HG21 THR 44 HG21 THR 44 3.190 -8.112 -6.702
320 HG22 THR 44 HG22 THR 44 2.003 -9.332 -6.242
321 HG23 THR 44 HG23 THR 44 3.181 -9.683 -7.506
322 H THR 45 HN THR 45 7.013 -7.883 -4.783
323 HA THR 45 HA THR 45 7.685 -9.716 -2.588
324 HB THR 45 HB THR 45 9.514 -9.830 -4.297
325 HG1 THR 45 HG1 THR 45 10.621 -10.219 -2.550
326 HG21 THR 45 HG21 THR 45 11.007 -7.906 -4.572
327 HG22 THR 45 HG22 THR 45 9.933 -6.922 -3.578
328 HG23 THR 45 HG23 THR 45 9.380 -7.527 -5.139
329 H HIS 46 HN HIS 46 9.149 -8.307 -0.965
330 HA HIS 46 HA HIS 46 7.474 -5.955 -0.405
331 HB2 HIS 46 HB2 HIS 46 7.360 -7.497 1.399
332 HB3 HIS 46 HB1 HIS 46 9.102 -7.751 1.396
333 HD1 HIS 46 HD1 HIS 46 6.542 -5.103 2.300
334 HD2 HIS 46 HD2 HIS 46 10.527 -6.049 3.017
335 HE1 HIS 46 HE1 HIS 46 7.335 -3.445 4.009
336 HE2 HIS 46 HE2 HIS 46 9.787 -3.934 4.299
337 H CYS 47 HN CYS 47 8.303 -4.018 -0.723
338 HA CYS 47 HA CYS 47 11.189 -3.598 -0.603
339 HB2 CYS 47 HB2 CYS 47 8.919 -1.796 -1.474
340 HB3 CYS 47 HB1 CYS 47 10.588 -1.251 -1.331
Start of MODEL 17
1 H1 ARG 1 HT1 ARG 1 5.209 -2.568 3.078
2 H2 ARG 1 HT2 ARG 1 3.652 -2.960 2.557
3 H3 ARG 1 HT3 ARG 1 3.963 -1.432 3.204
4 HA ARG 1 HA ARG 1 3.772 -1.309 0.824
5 HB2 ARG 1 HB2 ARG 1 6.564 -0.913 1.928
6 HB3 ARG 1 HB1 ARG 1 6.049 -0.317 0.356
7 HG2 ARG 1 HG2 ARG 1 4.780 0.454 2.984
8 HG3 ARG 1 HG1 ARG 1 5.993 1.408 2.126
9 HD2 ARG 1 HD2 ARG 1 4.495 1.639 0.216
10 HD3 ARG 1 HD1 ARG 1 3.296 0.622 1.014
11 HE ARG 1 HE ARG 1 3.179 2.424 2.744
12 HH11 ARG 1 HH11 ARG 1 4.247 3.158 -0.505
13 HH12 ARG 1 HH12 ARG 1 3.708 4.808 -0.447
14 HH21 ARG 1 HH21 ARG 1 2.463 4.589 2.825
15 HH22 ARG 1 HH22 ARG 1 2.673 5.615 1.438
16 H THR 2 HN THR 2 3.712 -2.565 -0.900
17 HA THR 2 HA THR 2 5.596 -4.824 -1.094
18 HB THR 2 HB THR 2 2.889 -4.549 -2.429
19 HG1 THR 2 HG1 THR 2 3.061 -6.405 -0.438
20 HG21 THR 2 HG21 THR 2 4.398 -6.130 -3.543
21 HG22 THR 2 HG22 THR 2 3.079 -6.983 -2.740
22 HG23 THR 2 HG23 THR 2 4.684 -6.951 -2.010
23 H CYS 3 HN CYS 3 6.607 -5.264 -3.032
24 HA CYS 3 HA CYS 3 6.492 -3.165 -5.104
25 HB2 CYS 3 HB2 CYS 3 8.800 -5.003 -4.381
26 HB3 CYS 3 HB1 CYS 3 8.830 -3.738 -5.606
27 H GLU 4 HN GLU 4 6.538 -3.895 -7.311
28 HA GLU 4 HA GLU 4 5.703 -6.713 -7.589
29 HB2 GLU 4 HB2 GLU 4 4.292 -6.019 -9.468
30 HB3 GLU 4 HB1 GLU 4 3.848 -5.176 -7.995
31 HG2 GLU 4 HG2 GLU 4 3.747 -3.481 -9.524
32 HG3 GLU 4 HG1 GLU 4 5.392 -3.289 -8.927
33 H SER 5 HN SER 5 6.000 -7.533 -9.868
34 HA SER 5 HA SER 5 8.108 -6.365 -11.439
35 HB2 SER 5 HB2 SER 5 9.358 -7.559 -9.597
36 HB3 SER 5 HB1 SER 5 8.635 -9.068 -10.152
37 HG SER 5 HG SER 5 10.362 -7.346 -11.616
38 H GLN 6 HN GLN 6 8.654 -7.981 -13.286
39 HA GLN 6 HA GLN 6 6.128 -9.246 -14.127
40 HB2 GLN 6 HB2 GLN 6 6.422 -7.245 -15.387
41 HB3 GLN 6 HB1 GLN 6 8.112 -7.613 -15.715
42 HG2 GLN 6 HG2 GLN 6 6.756 -7.963 -17.695
43 HG3 GLN 6 HG1 GLN 6 7.428 -9.491 -17.132
44 HE21 GLN 6 HE21 GLN 6 4.704 -7.917 -15.594
45 HE22 GLN 6 HE22 GLN 6 3.531 -9.096 -16.055
46 H SER 7 HN SER 7 6.223 -11.297 -14.796
47 HA SER 7 HA SER 7 8.888 -12.520 -15.031
48 HB2 SER 7 HB2 SER 7 6.304 -13.733 -14.020
49 HB3 SER 7 HB1 SER 7 7.821 -14.612 -14.223
50 HG SER 7 HG SER 7 7.177 -13.529 -12.069
51 H HIS 8 HN HIS 8 9.143 -12.400 -17.241
52 HA HIS 8 HA HIS 8 7.339 -14.137 -18.796
53 HB2 HIS 8 HB2 HIS 8 8.056 -11.857 -19.735
54 HB3 HIS 8 HB1 HIS 8 9.668 -12.544 -19.907
55 HD1 HIS 8 HD1 HIS 8 9.977 -13.050 -22.333
56 HD2 HIS 8 HD2 HIS 8 6.167 -14.040 -21.003
57 HE1 HIS 8 HE1 HIS 8 8.827 -14.109 -24.302
58 HE2 HIS 8 HE2 HIS 8 6.587 -14.850 -23.417
59 H LYS 9 HN LYS 9 9.512 -14.607 -16.682
60 HA LYS 9 HA LYS 9 11.593 -16.154 -17.754
61 HB2 LYS 9 HB2 LYS 9 10.135 -16.368 -15.102
62 HB3 LYS 9 HB1 LYS 9 11.574 -17.292 -15.494
63 HG2 LYS 9 HG2 LYS 9 12.143 -15.408 -14.105
64 HG3 LYS 9 HG1 LYS 9 12.853 -15.214 -15.704
65 HD2 LYS 9 HD2 LYS 9 11.365 -13.501 -16.289
66 HD3 LYS 9 HD1 LYS 9 10.213 -13.944 -15.028
67 HE2 LYS 9 HE2 LYS 9 11.589 -11.833 -14.640
68 HE3 LYS 9 HE1 LYS 9 11.547 -13.007 -13.327
69 HZ1 LYS 9 HZ1 LYS 9 13.737 -12.834 -15.319
70 HZ2 LYS 9 HZ2 LYS 9 13.700 -13.784 -13.919
71 HZ3 LYS 9 HZ3 LYS 9 13.774 -12.100 -13.800
72 H PHE 10 HN PHE 10 8.254 -16.701 -17.216
73 HA PHE 10 HA PHE 10 8.310 -19.564 -17.537
74 HB2 PHE 10 HB2 PHE 10 6.671 -18.205 -16.110
75 HB3 PHE 10 HB1 PHE 10 5.911 -17.713 -17.615
76 HD1 PHE 10 HD2 PHE 10 6.638 -20.569 -15.405
77 HD2 PHE 10 HD1 PHE 10 4.447 -19.182 -18.788
78 HE1 PHE 10 HE2 PHE 10 5.238 -22.592 -15.326
79 HE2 PHE 10 HE1 PHE 10 3.048 -21.202 -18.716
80 HZ PHE 10 HZ PHE 10 3.441 -22.911 -16.987
81 H LYS 11 HN LYS 11 8.900 -20.229 -19.539
82 HA LYS 11 HA LYS 11 8.443 -18.665 -21.892
83 HB2 LYS 11 HB2 LYS 11 9.393 -21.534 -21.650
84 HB3 LYS 11 HB1 LYS 11 9.399 -20.589 -23.129
85 HG2 LYS 11 HG2 LYS 11 11.603 -20.492 -22.385
86 HG3 LYS 11 HG1 LYS 11 10.919 -18.949 -21.872
87 HD2 LYS 11 HD2 LYS 11 12.281 -19.905 -20.094
88 HD3 LYS 11 HD1 LYS 11 10.585 -19.873 -19.610
89 HE2 LYS 11 HE2 LYS 11 10.398 -22.261 -20.275
90 HE3 LYS 11 HE1 LYS 11 12.127 -22.266 -20.623
91 HZ1 LYS 11 HZ1 LYS 11 10.919 -21.687 -17.969
92 HZ2 LYS 11 HZ2 LYS 11 12.571 -21.762 -18.317
93 HZ3 LYS 11 HZ3 LYS 11 11.624 -23.154 -18.423
94 H GLY 12 HN GLY 12 6.706 -18.618 -23.119
95 HA2 GLY 12 HA2 GLY 12 5.034 -19.686 -24.458
96 HA3 GLY 12 HA1 GLY 12 4.946 -20.976 -23.265
97 HA PRO 13 HA PRO 13 1.370 -18.020 -22.532
98 HB2 PRO 13 HB2 PRO 13 -0.082 -20.608 -22.404
99 HB3 PRO 13 HB1 PRO 13 -0.514 -19.118 -23.252
100 HG2 PRO 13 HG2 PRO 13 0.339 -21.276 -24.589
101 HG3 PRO 13 HG1 PRO 13 0.793 -19.639 -25.100
102 HD2 PRO 13 HD2 PRO 13 2.405 -21.662 -23.576
103 HD3 PRO 13 HD1 PRO 13 2.911 -20.577 -24.890
104 H CYS 14 HN CYS 14 0.797 -17.514 -20.471
105 HA CYS 14 HA CYS 14 1.939 -18.864 -18.267
106 HB2 CYS 14 HB2 CYS 14 1.524 -16.517 -18.081
107 HB3 CYS 14 HB1 CYS 14 -0.177 -16.717 -18.472
108 H ALA 15 HN ALA 15 1.290 -21.000 -18.384
109 HA ALA 15 HA ALA 15 -1.302 -21.959 -18.718
110 HB1 ALA 15 HB1 ALA 15 0.956 -23.294 -17.225
111 HB2 ALA 15 HB2 ALA 15 0.731 -23.318 -18.973
112 HB3 ALA 15 HB3 ALA 15 -0.456 -24.088 -17.920
113 H SER 16 HN SER 16 0.502 -21.577 -15.643
114 HA SER 16 HA SER 16 -2.032 -21.298 -14.230
115 HB2 SER 16 HB2 SER 16 -0.019 -23.451 -13.507
116 HB3 SER 16 HB1 SER 16 -1.511 -23.086 -12.637
117 HG SER 16 HG SER 16 -2.451 -23.485 -14.912
118 H ASP 17 HN ASP 17 -1.919 -20.109 -12.399
119 HA ASP 17 HA ASP 17 0.209 -18.366 -11.908
120 HB2 ASP 17 HB2 ASP 17 -1.893 -19.270 -9.914
121 HB3 ASP 17 HB1 ASP 17 -0.944 -17.794 -9.831
122 H HIS 18 HN HIS 18 -0.718 -21.418 -10.417
123 HA HIS 18 HA HIS 18 1.047 -21.602 -8.303
124 HB2 HIS 18 HB2 HIS 18 -0.744 -23.273 -8.934
125 HB3 HIS 18 HB1 HIS 18 0.340 -23.871 -10.184
126 HD1 HIS 18 HD1 HIS 18 -0.452 -24.206 -6.616
127 HD2 HIS 18 HD2 HIS 18 2.705 -25.174 -9.148
128 HE1 HIS 18 HE1 HIS 18 0.943 -25.879 -5.357
129 HE2 HIS 18 HE2 HIS 18 2.755 -26.562 -6.968
130 H ASN 19 HN ASN 19 1.568 -22.440 -11.688
131 HA ASN 19 HA ASN 19 4.194 -23.477 -11.316
132 HB2 ASN 19 HB2 ASN 19 2.870 -22.555 -13.883
133 HB3 ASN 19 HB1 ASN 19 4.285 -23.597 -13.754
134 HD21 ASN 19 HD21 ASN 19 3.304 -25.282 -14.876
135 HD22 ASN 19 HD22 ASN 19 2.043 -26.239 -14.180
136 H CYS 20 HN CYS 20 2.942 -20.450 -12.726
137 HA CYS 20 HA CYS 20 5.472 -19.359 -13.316
138 HB2 CYS 20 HB2 CYS 20 3.316 -18.469 -14.212
139 HB3 CYS 20 HB1 CYS 20 2.959 -17.805 -12.620
140 H ALA 21 HN ALA 21 3.479 -19.249 -10.414
141 HA ALA 21 HA ALA 21 5.029 -17.382 -8.959
142 HB1 ALA 21 HB1 ALA 21 2.720 -17.907 -8.351
143 HB2 ALA 21 HB2 ALA 21 3.808 -18.197 -6.993
144 HB3 ALA 21 HB3 ALA 21 3.191 -19.555 -7.937
145 H SER 22 HN SER 22 4.982 -20.935 -9.028
146 HA SER 22 HA SER 22 6.909 -21.448 -7.089
147 HB2 SER 22 HB2 SER 22 5.510 -23.195 -8.150
148 HB3 SER 22 HB1 SER 22 6.400 -22.988 -9.658
149 HG SER 22 HG SER 22 8.115 -23.966 -8.806
150 H VAL 23 HN VAL 23 7.300 -20.984 -10.581
151 HA VAL 23 HA VAL 23 10.099 -21.178 -10.706
152 HB VAL 23 HB VAL 23 8.085 -19.740 -12.453
153 HG11 VAL 23 HG11 VAL 23 11.019 -20.203 -13.038
154 HG12 VAL 23 HG12 VAL 23 10.251 -18.640 -12.761
155 HG13 VAL 23 HG13 VAL 23 9.824 -19.591 -14.184
156 HG21 VAL 23 HG21 VAL 23 9.572 -22.344 -12.808
157 HG22 VAL 23 HG22 VAL 23 8.461 -21.628 -13.976
158 HG23 VAL 23 HG23 VAL 23 7.867 -22.157 -12.402
159 H CYS 24 HN CYS 24 8.003 -18.327 -10.426
160 HA CYS 24 HA CYS 24 9.976 -16.363 -10.324
161 HB2 CYS 24 HB2 CYS 24 7.540 -15.941 -10.578
162 HB3 CYS 24 HB1 CYS 24 7.308 -16.362 -8.887
163 H GLN 25 HN GLN 25 8.678 -18.456 -7.824
164 HA GLN 25 HA GLN 25 10.032 -17.155 -5.656
165 HB2 GLN 25 HB2 GLN 25 8.583 -19.800 -5.856
166 HB3 GLN 25 HB1 GLN 25 9.320 -19.216 -4.370
167 HG2 GLN 25 HG2 GLN 25 7.850 -17.284 -4.361
168 HG3 GLN 25 HG1 GLN 25 7.145 -17.787 -5.896
169 HE21 GLN 25 HE21 GLN 25 5.084 -17.899 -5.004
170 HE22 GLN 25 HE22 GLN 25 4.606 -19.171 -3.933
171 H THR 26 HN THR 26 10.766 -19.813 -7.845
172 HA THR 26 HA THR 26 12.979 -20.781 -6.319
173 HB THR 26 HB THR 26 13.708 -21.910 -8.442
174 HG1 THR 26 HG1 THR 26 12.424 -20.157 -9.706
175 HG21 THR 26 HG21 THR 26 11.825 -23.481 -8.526
176 HG22 THR 26 HG22 THR 26 10.815 -22.322 -7.665
177 HG23 THR 26 HG23 THR 26 12.214 -23.039 -6.866
178 H GLU 27 HN GLU 27 12.539 -18.285 -8.782
179 HA GLU 27 HA GLU 27 15.306 -17.603 -8.919
180 HB2 GLU 27 HB2 GLU 27 12.802 -16.023 -9.476
181 HB3 GLU 27 HB1 GLU 27 14.387 -15.264 -9.529
182 HG2 GLU 27 HG2 GLU 27 14.875 -17.366 -11.114
183 HG3 GLU 27 HG1 GLU 27 13.141 -17.197 -11.393
184 H ARG 28 HN ARG 28 12.781 -15.648 -7.299
185 HA ARG 28 HA ARG 28 14.480 -15.440 -4.914
186 HB2 ARG 28 HB2 ARG 28 13.395 -13.028 -6.409
187 HB3 ARG 28 HB1 ARG 28 14.065 -12.971 -4.789
188 HG2 ARG 28 HG2 ARG 28 15.869 -12.282 -6.000
189 HG3 ARG 28 HG1 ARG 28 16.175 -14.018 -5.957
190 HD2 ARG 28 HD2 ARG 28 16.531 -13.139 -8.197
191 HD3 ARG 28 HD1 ARG 28 15.160 -14.247 -8.180
192 HE ARG 28 HE ARG 28 14.121 -11.708 -7.806
193 HH11 ARG 28 HH11 ARG 28 15.940 -13.386 -10.285
194 HH12 ARG 28 HH12 ARG 28 15.258 -12.461 -11.583
195 HH21 ARG 28 HH21 ARG 28 13.238 -10.465 -9.536
196 HH22 ARG 28 HH22 ARG 28 13.744 -10.805 -11.160
197 H PHE 29 HN PHE 29 13.214 -14.144 -3.171
198 HA PHE 29 HA PHE 29 10.645 -15.236 -2.767
199 HB2 PHE 29 HB2 PHE 29 12.184 -14.426 -0.971
200 HB3 PHE 29 HB1 PHE 29 11.828 -12.778 -1.472
201 HD1 PHE 29 HD1 PHE 29 10.363 -15.855 -0.110
202 HD2 PHE 29 HD2 PHE 29 9.860 -11.679 -0.733
203 HE1 PHE 29 HE1 PHE 29 8.394 -15.876 1.374
204 HE2 PHE 29 HE2 PHE 29 7.893 -11.686 0.748
205 HZ PHE 29 HZ PHE 29 7.157 -13.786 1.804
206 H SER 30 HN SER 30 9.008 -14.764 -3.958
207 HA SER 30 HA SER 30 7.849 -12.216 -4.139
208 HB2 SER 30 HB2 SER 30 8.037 -12.120 -6.745
209 HB3 SER 30 HB1 SER 30 9.380 -11.526 -5.770
210 HG SER 30 HG SER 30 9.178 -14.082 -7.004
211 H GLY 31 HN GLY 31 5.820 -12.821 -3.887
212 HA2 GLY 31 HA2 GLY 31 4.712 -15.300 -4.696
213 HA3 GLY 31 HA1 GLY 31 3.801 -13.886 -4.183
214 H GLY 32 HN GLY 32 3.149 -15.741 -6.365
215 HA2 GLY 32 HA2 GLY 32 3.626 -14.024 -8.729
216 HA3 GLY 32 HA1 GLY 32 3.514 -15.774 -8.795
217 H ARG 33 HN ARG 33 2.030 -13.723 -10.230
218 HA ARG 33 HA ARG 33 -0.632 -14.820 -9.842
219 HB2 ARG 33 HB2 ARG 33 -0.430 -12.700 -8.411
220 HB3 ARG 33 HB1 ARG 33 -0.228 -11.814 -9.912
221 HG2 ARG 33 HG2 ARG 33 -2.483 -11.551 -9.339
222 HG3 ARG 33 HG1 ARG 33 -2.479 -12.771 -10.614
223 HD2 ARG 33 HD2 ARG 33 -2.304 -13.798 -7.838
224 HD3 ARG 33 HD1 ARG 33 -3.824 -13.024 -8.278
225 HE ARG 33 HE ARG 33 -2.850 -15.059 -10.114
226 HH11 ARG 33 HH11 ARG 33 -4.858 -14.386 -7.329
227 HH12 ARG 33 HH12 ARG 33 -5.961 -15.688 -7.649
228 HH21 ARG 33 HH21 ARG 33 -4.290 -16.788 -10.524
229 HH22 ARG 33 HH22 ARG 33 -5.643 -17.050 -9.468
230 H CYS 34 HN CYS 34 -1.905 -14.550 -11.804
231 HA CYS 34 HA CYS 34 -0.159 -14.002 -14.124
232 HB2 CYS 34 HB2 CYS 34 -0.774 -16.394 -13.737
233 HB3 CYS 34 HB1 CYS 34 -2.465 -15.958 -13.939
234 H ARG 35 HN ARG 35 -0.712 -12.243 -15.184
235 HA ARG 35 HA ARG 35 -3.525 -11.338 -15.176
236 HB2 ARG 35 HB2 ARG 35 -1.020 -9.632 -15.291
237 HB3 ARG 35 HB1 ARG 35 -2.677 -9.050 -15.203
238 HG2 ARG 35 HG2 ARG 35 -1.312 -10.668 -13.052
239 HG3 ARG 35 HG1 ARG 35 -1.462 -8.909 -13.053
240 HD2 ARG 35 HD2 ARG 35 -3.795 -10.828 -13.116
241 HD3 ARG 35 HD1 ARG 35 -3.168 -10.062 -11.655
242 HE ARG 35 HE ARG 35 -3.663 -7.963 -13.295
243 HH11 ARG 35 HH11 ARG 35 -5.623 -10.653 -12.202
244 HH12 ARG 35 HH12 ARG 35 -7.111 -9.760 -12.279
245 HH21 ARG 35 HH21 ARG 35 -5.594 -6.791 -13.376
246 HH22 ARG 35 HH22 ARG 35 -7.094 -7.557 -12.950
247 H GLY 36 HN GLY 36 -3.378 -9.331 -17.029
248 HA2 GLY 36 HA2 GLY 36 -3.413 -8.892 -19.283
249 HA3 GLY 36 HA1 GLY 36 -1.944 -9.851 -19.393
250 H PHE 37 HN PHE 37 -5.028 -10.996 -18.245
251 HA PHE 37 HA PHE 37 -6.222 -12.827 -18.720
252 HB2 PHE 37 HB2 PHE 37 -6.843 -11.312 -20.657
253 HB3 PHE 37 HB1 PHE 37 -5.672 -12.199 -21.629
254 HD1 PHE 37 HD2 PHE 37 -8.909 -12.394 -19.887
255 HD2 PHE 37 HD1 PHE 37 -6.120 -14.436 -22.361
256 HE1 PHE 37 HE2 PHE 37 -10.607 -14.103 -20.384
257 HE2 PHE 37 HE1 PHE 37 -7.813 -16.151 -22.872
258 HZ PHE 37 HZ PHE 37 -10.062 -15.986 -21.877
259 H ARG 38 HN ARG 38 -3.939 -13.572 -17.852
260 HA ARG 38 HA ARG 38 -2.607 -15.388 -17.634
261 HB2 ARG 38 HB2 ARG 38 -4.416 -16.525 -19.782
262 HB3 ARG 38 HB1 ARG 38 -3.304 -17.469 -18.795
263 HG2 ARG 38 HG2 ARG 38 -4.535 -16.908 -16.789
264 HG3 ARG 38 HG1 ARG 38 -5.585 -15.822 -17.700
265 HD2 ARG 38 HD2 ARG 38 -6.419 -17.753 -18.998
266 HD3 ARG 38 HD1 ARG 38 -5.405 -18.823 -18.022
267 HE ARG 38 HE ARG 38 -6.772 -17.693 -16.096
268 HH11 ARG 38 HH11 ARG 38 -7.960 -18.849 -19.181
269 HH12 ARG 38 HH12 ARG 38 -9.577 -19.082 -18.604
270 HH21 ARG 38 HH21 ARG 38 -8.877 -17.995 -15.340
271 HH22 ARG 38 HH22 ARG 38 -10.109 -18.582 -16.414
272 H ARG 39 HN ARG 39 -1.944 -13.279 -19.565
273 HA ARG 39 HA ARG 39 -0.010 -14.802 -21.198
274 HB2 ARG 39 HB2 ARG 39 -1.523 -12.307 -21.997
275 HB3 ARG 39 HB1 ARG 39 -0.208 -13.016 -22.926
276 HG2 ARG 39 HG2 ARG 39 -1.487 -14.997 -23.354
277 HG3 ARG 39 HG1 ARG 39 -2.762 -14.468 -22.254
278 HD2 ARG 39 HD2 ARG 39 -1.961 -13.081 -24.812
279 HD3 ARG 39 HD1 ARG 39 -3.371 -14.122 -24.604
280 HE ARG 39 HE ARG 39 -3.334 -11.975 -22.718
281 HH11 ARG 39 HH11 ARG 39 -4.151 -12.813 -26.022
282 HH12 ARG 39 HH12 ARG 39 -5.311 -11.533 -26.197
283 HH21 ARG 39 HH21 ARG 39 -4.872 -10.301 -22.937
284 HH22 ARG 39 HH22 ARG 39 -5.718 -10.095 -24.437
285 H ARG 40 HN ARG 40 -0.433 -12.563 -18.761
286 HA ARG 40 HA ARG 40 2.344 -11.647 -19.023
287 HB2 ARG 40 HB2 ARG 40 0.769 -9.893 -19.884
288 HB3 ARG 40 HB1 ARG 40 0.092 -9.792 -18.261
289 HG2 ARG 40 HG2 ARG 40 1.988 -8.823 -17.380
290 HG3 ARG 40 HG1 ARG 40 3.037 -9.465 -18.645
291 HD2 ARG 40 HD2 ARG 40 2.165 -7.938 -20.240
292 HD3 ARG 40 HD1 ARG 40 0.908 -7.398 -19.130
293 HE ARG 40 HE ARG 40 3.528 -6.962 -18.078
294 HH11 ARG 40 HH11 ARG 40 1.162 -5.660 -20.305
295 HH12 ARG 40 HH12 ARG 40 1.731 -4.029 -20.153
296 HH21 ARG 40 HH21 ARG 40 4.262 -4.813 -17.859
297 HH22 ARG 40 HH22 ARG 40 3.506 -3.551 -18.773
298 H CYS 41 HN CYS 41 3.143 -12.779 -17.313
299 HA CYS 41 HA CYS 41 1.585 -13.039 -14.863
300 HB2 CYS 41 HB2 CYS 41 2.779 -14.994 -15.889
301 HB3 CYS 41 HB1 CYS 41 4.305 -14.196 -15.529
302 H PHE 42 HN PHE 42 1.989 -11.934 -13.020
303 HA PHE 42 HA PHE 42 4.395 -10.224 -12.914
304 HB2 PHE 42 HB2 PHE 42 1.605 -9.703 -11.856
305 HB3 PHE 42 HB1 PHE 42 3.013 -8.783 -11.340
306 HD1 PHE 42 HD2 PHE 42 0.829 -9.531 -14.238
307 HD2 PHE 42 HD1 PHE 42 3.932 -7.065 -12.652
308 HE1 PHE 42 HE2 PHE 42 0.526 -7.947 -16.091
309 HE2 PHE 42 HE1 PHE 42 3.626 -5.486 -14.505
310 HZ PHE 42 HZ PHE 42 1.923 -5.923 -16.232
311 H CYS 43 HN CYS 43 5.287 -9.856 -10.817
312 HA CYS 43 HA CYS 43 4.596 -11.868 -8.783
313 HB2 CYS 43 HB2 CYS 43 7.347 -10.927 -9.627
314 HB3 CYS 43 HB1 CYS 43 7.041 -11.848 -8.159
315 H THR 44 HN THR 44 5.104 -11.250 -6.596
316 HA THR 44 HA THR 44 5.329 -8.358 -6.136
317 HB THR 44 HB THR 44 3.647 -8.728 -4.216
318 HG1 THR 44 HG1 THR 44 3.243 -11.072 -5.769
319 HG21 THR 44 HG21 THR 44 3.085 -7.415 -6.200
320 HG22 THR 44 HG22 THR 44 1.701 -8.387 -5.693
321 HG23 THR 44 HG23 THR 44 2.674 -8.891 -7.076
322 H THR 45 HN THR 45 6.883 -7.924 -4.722
323 HA THR 45 HA THR 45 7.707 -9.992 -2.797
324 HB THR 45 HB THR 45 9.337 -9.894 -4.639
325 HG1 THR 45 HG1 THR 45 10.727 -10.267 -3.110
326 HG21 THR 45 HG21 THR 45 8.997 -7.583 -5.362
327 HG22 THR 45 HG22 THR 45 10.698 -7.875 -4.999
328 HG23 THR 45 HG23 THR 45 9.691 -6.993 -3.850
329 H HIS 46 HN HIS 46 8.927 -9.094 -0.958
330 HA HIS 46 HA HIS 46 7.744 -6.555 -0.079
331 HB2 HIS 46 HB2 HIS 46 7.398 -8.514 1.377
332 HB3 HIS 46 HB1 HIS 46 9.135 -8.755 1.488
333 HD1 HIS 46 HD1 HIS 46 6.386 -7.187 3.209
334 HD2 HIS 46 HD2 HIS 46 10.459 -6.454 2.845
335 HE1 HIS 46 HE1 HIS 46 6.973 -5.668 5.124
336 HE2 HIS 46 HE2 HIS 46 9.395 -5.085 4.756
337 H CYS 47 HN CYS 47 8.996 -4.807 -0.404
338 HA CYS 47 HA CYS 47 11.873 -5.042 -0.578
339 HB2 CYS 47 HB2 CYS 47 10.027 -2.654 -0.798
340 HB3 CYS 47 HB1 CYS 47 11.777 -2.554 -0.956
Start of MODEL 18
1 H1 ARG 1 HT1 ARG 1 3.502 -2.696 3.195
2 H2 ARG 1 HT2 ARG 1 4.450 -4.085 3.018
3 H3 ARG 1 HT3 ARG 1 2.808 -4.131 2.630
4 HA ARG 1 HA ARG 1 3.174 -2.531 0.846
5 HB2 ARG 1 HB2 ARG 1 6.101 -2.983 1.505
6 HB3 ARG 1 HB1 ARG 1 5.486 -2.059 0.140
7 HG2 ARG 1 HG2 ARG 1 4.460 -0.461 1.714
8 HG3 ARG 1 HG1 ARG 1 5.146 -1.376 3.059
9 HD2 ARG 1 HD2 ARG 1 6.705 0.010 0.872
10 HD3 ARG 1 HD1 ARG 1 6.505 0.588 2.524
11 HE ARG 1 HE ARG 1 8.070 -1.775 1.701
12 HH11 ARG 1 HH11 ARG 1 7.244 0.641 4.101
13 HH12 ARG 1 HH12 ARG 1 8.566 0.237 5.147
14 HH21 ARG 1 HH21 ARG 1 9.813 -2.301 3.069
15 HH22 ARG 1 HH22 ARG 1 10.012 -1.455 4.575
16 H THR 2 HN THR 2 3.646 -3.318 -1.296
17 HA THR 2 HA THR 2 4.634 -6.063 -1.503
18 HB THR 2 HB THR 2 1.929 -5.246 -2.622
19 HG1 THR 2 HG1 THR 2 2.720 -6.513 -0.244
20 HG21 THR 2 HG21 THR 2 3.129 -6.927 -3.986
21 HG22 THR 2 HG22 THR 2 1.705 -7.615 -3.206
22 HG23 THR 2 HG23 THR 2 3.311 -7.946 -2.554
23 H CYS 3 HN CYS 3 5.981 -6.198 -3.177
24 HA CYS 3 HA CYS 3 5.767 -4.198 -5.335
25 HB2 CYS 3 HB2 CYS 3 8.216 -5.596 -4.209
26 HB3 CYS 3 HB1 CYS 3 8.232 -4.548 -5.629
27 H GLU 4 HN GLU 4 4.822 -5.140 -7.039
28 HA GLU 4 HA GLU 4 5.698 -7.853 -7.766
29 HB2 GLU 4 HB2 GLU 4 3.523 -8.089 -8.950
30 HB3 GLU 4 HB1 GLU 4 3.367 -7.909 -7.208
31 HG2 GLU 4 HG2 GLU 4 2.832 -5.508 -7.566
32 HG3 GLU 4 HG1 GLU 4 2.847 -5.805 -9.298
33 H SER 5 HN SER 5 7.119 -7.758 -9.280
34 HA SER 5 HA SER 5 6.986 -5.811 -11.459
35 HB2 SER 5 HB2 SER 5 9.075 -7.908 -10.769
36 HB3 SER 5 HB1 SER 5 9.217 -6.697 -12.045
37 HG SER 5 HG SER 5 9.374 -5.116 -10.550
38 H GLN 6 HN GLN 6 8.110 -7.347 -13.464
39 HA GLN 6 HA GLN 6 5.950 -9.286 -14.020
40 HB2 GLN 6 HB2 GLN 6 6.115 -7.105 -15.396
41 HB3 GLN 6 HB1 GLN 6 7.578 -7.776 -16.093
42 HG2 GLN 6 HG2 GLN 6 4.973 -9.263 -16.189
43 HG3 GLN 6 HG1 GLN 6 5.373 -8.029 -17.378
44 HE21 GLN 6 HE21 GLN 6 5.016 -11.023 -17.453
45 HE22 GLN 6 HE22 GLN 6 6.422 -11.606 -18.275
46 H SER 7 HN SER 7 6.667 -11.104 -15.500
47 HA SER 7 HA SER 7 9.313 -11.981 -14.515
48 HB2 SER 7 HB2 SER 7 7.075 -13.849 -15.277
49 HB3 SER 7 HB1 SER 7 8.416 -14.124 -14.166
50 HG SER 7 HG SER 7 6.844 -13.690 -12.779
51 H HIS 8 HN HIS 8 10.614 -11.573 -16.203
52 HA HIS 8 HA HIS 8 9.901 -12.391 -18.904
53 HB2 HIS 8 HB2 HIS 8 12.439 -11.144 -17.812
54 HB3 HIS 8 HB1 HIS 8 12.073 -11.385 -19.516
55 HD1 HIS 8 HD1 HIS 8 11.654 -8.999 -16.777
56 HD2 HIS 8 HD2 HIS 8 9.847 -9.747 -20.444
57 HE1 HIS 8 HE1 HIS 8 10.357 -6.921 -17.322
58 HE2 HIS 8 HE2 HIS 8 9.155 -7.457 -19.466
59 H LYS 9 HN LYS 9 11.085 -13.881 -16.217
60 HA LYS 9 HA LYS 9 13.002 -15.613 -17.542
61 HB2 LYS 9 HB2 LYS 9 12.022 -15.367 -14.706
62 HB3 LYS 9 HB1 LYS 9 13.016 -16.722 -15.216
63 HG2 LYS 9 HG2 LYS 9 13.966 -13.935 -15.751
64 HG3 LYS 9 HG1 LYS 9 14.099 -14.603 -14.126
65 HD2 LYS 9 HD2 LYS 9 16.171 -15.057 -15.181
66 HD3 LYS 9 HD1 LYS 9 15.295 -16.584 -15.157
67 HE2 LYS 9 HE2 LYS 9 16.333 -16.371 -17.300
68 HE3 LYS 9 HE1 LYS 9 14.603 -16.129 -17.527
69 HZ1 LYS 9 HZ1 LYS 9 16.667 -13.998 -17.379
70 HZ2 LYS 9 HZ2 LYS 9 15.007 -13.728 -17.543
71 HZ3 LYS 9 HZ3 LYS 9 15.859 -14.510 -18.775
72 H PHE 10 HN PHE 10 9.646 -15.624 -16.757
73 HA PHE 10 HA PHE 10 9.343 -18.483 -16.840
74 HB2 PHE 10 HB2 PHE 10 7.804 -16.933 -15.568
75 HB3 PHE 10 HB1 PHE 10 7.171 -16.383 -17.119
76 HD1 PHE 10 HD2 PHE 10 7.650 -19.418 -15.042
77 HD2 PHE 10 HD1 PHE 10 5.429 -17.577 -18.177
78 HE1 PHE 10 HE2 PHE 10 6.081 -21.319 -15.040
79 HE2 PHE 10 HE1 PHE 10 3.862 -19.477 -18.183
80 HZ PHE 10 HZ PHE 10 4.185 -21.348 -16.613
81 H LYS 11 HN LYS 11 8.220 -19.627 -18.515
82 HA LYS 11 HA LYS 11 9.129 -18.780 -21.112
83 HB2 LYS 11 HB2 LYS 11 9.182 -21.142 -20.179
84 HB3 LYS 11 HB1 LYS 11 7.463 -21.189 -20.510
85 HG2 LYS 11 HG2 LYS 11 8.704 -22.270 -22.289
86 HG3 LYS 11 HG1 LYS 11 7.904 -20.815 -22.885
87 HD2 LYS 11 HD2 LYS 11 9.965 -19.584 -22.853
88 HD3 LYS 11 HD1 LYS 11 10.797 -20.898 -22.017
89 HE2 LYS 11 HE2 LYS 11 11.394 -20.893 -24.367
90 HE3 LYS 11 HE1 LYS 11 10.459 -22.338 -23.990
91 HZ1 LYS 11 HZ1 LYS 11 9.534 -19.904 -25.407
92 HZ2 LYS 11 HZ2 LYS 11 8.478 -21.098 -24.851
93 HZ3 LYS 11 HZ3 LYS 11 9.645 -21.476 -26.014
94 H GLY 12 HN GLY 12 7.961 -17.100 -21.647
95 HA2 GLY 12 HA2 GLY 12 6.290 -16.031 -22.852
96 HA3 GLY 12 HA1 GLY 12 5.372 -17.527 -22.823
97 HA PRO 13 HA PRO 13 3.102 -14.854 -19.863
98 HB2 PRO 13 HB2 PRO 13 0.624 -15.438 -20.711
99 HB3 PRO 13 HB1 PRO 13 1.642 -14.286 -21.587
100 HG2 PRO 13 HG2 PRO 13 1.070 -17.161 -22.208
101 HG3 PRO 13 HG1 PRO 13 1.163 -15.775 -23.310
102 HD2 PRO 13 HD2 PRO 13 3.213 -17.585 -22.903
103 HD3 PRO 13 HD1 PRO 13 3.443 -15.926 -23.489
104 H CYS 14 HN CYS 14 0.936 -15.697 -18.593
105 HA CYS 14 HA CYS 14 1.855 -17.927 -17.090
106 HB2 CYS 14 HB2 CYS 14 -0.713 -16.349 -17.018
107 HB3 CYS 14 HB1 CYS 14 -0.421 -17.721 -15.953
108 H ALA 15 HN ALA 15 2.040 -19.544 -18.735
109 HA ALA 15 HA ALA 15 -0.245 -20.731 -19.944
110 HB1 ALA 15 HB1 ALA 15 2.430 -21.975 -19.275
111 HB2 ALA 15 HB2 ALA 15 2.032 -21.127 -20.769
112 HB3 ALA 15 HB3 ALA 15 1.221 -22.643 -20.374
113 H SER 16 HN SER 16 1.236 -20.925 -16.827
114 HA SER 16 HA SER 16 -1.085 -22.308 -15.778
115 HB2 SER 16 HB2 SER 16 1.707 -23.389 -15.259
116 HB3 SER 16 HB1 SER 16 0.191 -24.031 -14.622
117 HG SER 16 HG SER 16 -0.367 -24.255 -16.977
118 H ASP 17 HN ASP 17 -1.698 -20.954 -14.224
119 HA ASP 17 HA ASP 17 -0.223 -18.793 -13.290
120 HB2 ASP 17 HB2 ASP 17 -2.513 -20.106 -11.801
121 HB3 ASP 17 HB1 ASP 17 -1.998 -18.424 -11.690
122 H HIS 18 HN HIS 18 -0.855 -21.903 -11.699
123 HA HIS 18 HA HIS 18 0.434 -21.354 -9.263
124 HB2 HIS 18 HB2 HIS 18 -1.076 -23.331 -9.784
125 HB3 HIS 18 HB1 HIS 18 0.307 -24.065 -10.601
126 HD1 HIS 18 HD1 HIS 18 1.764 -25.481 -9.186
127 HD2 HIS 18 HD2 HIS 18 -0.474 -22.811 -6.924
128 HE1 HIS 18 HE1 HIS 18 2.270 -26.038 -6.790
129 HE2 HIS 18 HE2 HIS 18 1.066 -24.278 -5.456
130 H ASN 19 HN ASN 19 1.628 -22.714 -12.283
131 HA ASN 19 HA ASN 19 4.213 -23.398 -11.405
132 HB2 ASN 19 HB2 ASN 19 3.094 -24.225 -13.499
133 HB3 ASN 19 HB1 ASN 19 3.351 -22.639 -14.210
134 HD21 ASN 19 HD21 ASN 19 4.298 -25.242 -15.064
135 HD22 ASN 19 HD22 ASN 19 6.021 -25.133 -15.132
136 H CYS 20 HN CYS 20 2.965 -20.565 -13.115
137 HA CYS 20 HA CYS 20 5.347 -19.138 -13.362
138 HB2 CYS 20 HB2 CYS 20 3.262 -18.562 -14.549
139 HB3 CYS 20 HB1 CYS 20 2.538 -18.050 -13.027
140 H ALA 21 HN ALA 21 2.917 -19.128 -10.773
141 HA ALA 21 HA ALA 21 4.084 -17.176 -9.140
142 HB1 ALA 21 HB1 ALA 21 2.465 -19.590 -8.316
143 HB2 ALA 21 HB2 ALA 21 1.816 -18.021 -8.797
144 HB3 ALA 21 HB3 ALA 21 2.775 -18.165 -7.323
145 H SER 22 HN SER 22 4.493 -20.716 -9.131
146 HA SER 22 HA SER 22 6.264 -20.896 -6.967
147 HB2 SER 22 HB2 SER 22 5.057 -22.809 -8.043
148 HB3 SER 22 HB1 SER 22 6.169 -22.698 -9.406
149 HG SER 22 HG SER 22 7.593 -23.750 -8.288
150 H VAL 23 HN VAL 23 6.889 -20.561 -10.434
151 HA VAL 23 HA VAL 23 9.678 -20.557 -10.388
152 HB VAL 23 HB VAL 23 7.701 -19.208 -12.237
153 HG11 VAL 23 HG11 VAL 23 9.769 -17.914 -12.355
154 HG12 VAL 23 HG12 VAL 23 9.581 -18.875 -13.821
155 HG13 VAL 23 HG13 VAL 23 10.707 -19.393 -12.566
156 HG21 VAL 23 HG21 VAL 23 7.690 -21.637 -12.279
157 HG22 VAL 23 HG22 VAL 23 9.433 -21.662 -12.548
158 HG23 VAL 23 HG23 VAL 23 8.361 -21.002 -13.783
159 H CYS 24 HN CYS 24 7.371 -17.867 -10.023
160 HA CYS 24 HA CYS 24 9.376 -15.886 -9.644
161 HB2 CYS 24 HB2 CYS 24 6.440 -15.929 -8.947
162 HB3 CYS 24 HB1 CYS 24 7.471 -14.534 -8.658
163 H GLN 25 HN GLN 25 7.947 -18.245 -7.513
164 HA GLN 25 HA GLN 25 8.790 -17.007 -5.076
165 HB2 GLN 25 HB2 GLN 25 8.193 -19.918 -5.670
166 HB3 GLN 25 HB1 GLN 25 8.471 -19.262 -4.062
167 HG2 GLN 25 HG2 GLN 25 6.490 -17.811 -4.358
168 HG3 GLN 25 HG1 GLN 25 6.199 -18.577 -5.918
169 HE21 GLN 25 HE21 GLN 25 4.215 -19.405 -5.325
170 HE22 GLN 25 HE22 GLN 25 4.040 -20.698 -4.194
171 H THR 26 HN THR 26 10.231 -19.318 -7.330
172 HA THR 26 HA THR 26 12.614 -19.679 -5.755
173 HB THR 26 HB THR 26 13.501 -20.794 -7.834
174 HG1 THR 26 HG1 THR 26 11.978 -19.468 -9.222
175 HG21 THR 26 HG21 THR 26 10.782 -21.703 -6.868
176 HG22 THR 26 HG22 THR 26 12.332 -22.076 -6.110
177 HG23 THR 26 HG23 THR 26 11.961 -22.706 -7.714
178 H GLU 27 HN GLU 27 11.560 -17.457 -8.203
179 HA GLU 27 HA GLU 27 14.189 -16.304 -8.603
180 HB2 GLU 27 HB2 GLU 27 11.419 -15.658 -9.583
181 HB3 GLU 27 HB1 GLU 27 12.748 -14.533 -9.834
182 HG2 GLU 27 HG2 GLU 27 12.756 -17.404 -10.747
183 HG3 GLU 27 HG1 GLU 27 12.302 -16.030 -11.757
184 H ARG 28 HN ARG 28 11.126 -14.834 -7.547
185 HA ARG 28 HA ARG 28 12.570 -12.731 -6.167
186 HB2 ARG 28 HB2 ARG 28 9.771 -13.151 -7.107
187 HB3 ARG 28 HB1 ARG 28 10.007 -12.075 -5.740
188 HG2 ARG 28 HG2 ARG 28 9.902 -10.970 -7.993
189 HG3 ARG 28 HG1 ARG 28 11.307 -10.567 -7.014
190 HD2 ARG 28 HD2 ARG 28 11.482 -12.779 -9.029
191 HD3 ARG 28 HD1 ARG 28 11.577 -11.098 -9.558
192 HE ARG 28 HE ARG 28 13.380 -11.309 -7.487
193 HH11 ARG 28 HH11 ARG 28 12.936 -12.883 -10.589
194 HH12 ARG 28 HH12 ARG 28 14.625 -13.181 -10.833
195 HH21 ARG 28 HH21 ARG 28 15.614 -11.659 -7.822
196 HH22 ARG 28 HH22 ARG 28 16.147 -12.496 -9.247
197 H PHE 29 HN PHE 29 11.170 -12.001 -4.094
198 HA PHE 29 HA PHE 29 11.830 -14.055 -2.182
199 HB2 PHE 29 HB2 PHE 29 12.480 -11.589 -2.047
200 HB3 PHE 29 HB1 PHE 29 10.809 -11.277 -1.589
201 HD1 PHE 29 HD1 PHE 29 13.861 -13.111 -0.634
202 HD2 PHE 29 HD2 PHE 29 10.102 -11.587 0.652
203 HE1 PHE 29 HE1 PHE 29 14.461 -13.612 1.702
204 HE2 PHE 29 HE2 PHE 29 10.691 -12.081 2.990
205 HZ PHE 29 HZ PHE 29 12.874 -13.096 3.519
206 H SER 30 HN SER 30 8.945 -12.122 -2.958
207 HA SER 30 HA SER 30 7.477 -13.374 -0.791
208 HB2 SER 30 HB2 SER 30 6.550 -11.257 -2.746
209 HB3 SER 30 HB1 SER 30 5.769 -11.709 -1.228
210 HG SER 30 HG SER 30 7.565 -10.926 -0.112
211 H GLY 31 HN GLY 31 7.647 -13.655 -4.275
212 HA2 GLY 31 HA2 GLY 31 6.784 -16.036 -4.778
213 HA3 GLY 31 HA1 GLY 31 5.249 -15.390 -4.223
214 H GLY 32 HN GLY 32 4.018 -15.323 -6.024
215 HA2 GLY 32 HA2 GLY 32 4.996 -13.776 -8.315
216 HA3 GLY 32 HA1 GLY 32 4.533 -15.449 -8.600
217 H ARG 33 HN ARG 33 3.197 -13.963 -10.122
218 HA ARG 33 HA ARG 33 0.495 -13.810 -9.113
219 HB2 ARG 33 HB2 ARG 33 1.592 -11.620 -8.451
220 HB3 ARG 33 HB1 ARG 33 1.834 -11.297 -10.161
221 HG2 ARG 33 HG2 ARG 33 -0.101 -10.158 -9.894
222 HG3 ARG 33 HG1 ARG 33 -0.802 -11.747 -10.202
223 HD2 ARG 33 HD2 ARG 33 -1.917 -10.892 -8.297
224 HD3 ARG 33 HD1 ARG 33 -0.784 -12.101 -7.690
225 HE ARG 33 HE ARG 33 -0.021 -9.256 -7.700
226 HH11 ARG 33 HH11 ARG 33 -0.662 -12.206 -5.897
227 HH12 ARG 33 HH12 ARG 33 -0.165 -11.519 -4.384
228 HH21 ARG 33 HH21 ARG 33 0.620 -8.374 -5.732
229 HH22 ARG 33 HH22 ARG 33 0.555 -9.344 -4.284
230 H CYS 34 HN CYS 34 -0.996 -13.882 -10.816
231 HA CYS 34 HA CYS 34 0.035 -13.535 -13.558
232 HB2 CYS 34 HB2 CYS 34 -1.830 -15.668 -12.506
233 HB3 CYS 34 HB1 CYS 34 -1.786 -15.237 -14.213
234 H ARG 35 HN ARG 35 -0.980 -11.925 -14.617
235 HA ARG 35 HA ARG 35 -3.691 -11.157 -14.122
236 HB2 ARG 35 HB2 ARG 35 -2.580 -10.551 -11.967
237 HB3 ARG 35 HB1 ARG 35 -1.509 -9.480 -12.849
238 HG2 ARG 35 HG2 ARG 35 -3.225 -8.199 -11.800
239 HG3 ARG 35 HG1 ARG 35 -3.465 -8.148 -13.547
240 HD2 ARG 35 HD2 ARG 35 -5.580 -8.464 -12.275
241 HD3 ARG 35 HD1 ARG 35 -5.245 -9.776 -13.403
242 HE ARG 35 HE ARG 35 -4.258 -10.334 -10.777
243 HH11 ARG 35 HH11 ARG 35 -7.189 -10.320 -12.697
244 HH12 ARG 35 HH12 ARG 35 -7.940 -11.586 -11.780
245 HH21 ARG 35 HH21 ARG 35 -5.263 -12.002 -9.570
246 HH22 ARG 35 HH22 ARG 35 -6.843 -12.558 -10.028
247 H GLY 36 HN GLY 36 -4.340 -9.318 -15.356
248 HA2 GLY 36 HA2 GLY 36 -4.112 -7.393 -16.583
249 HA3 GLY 36 HA1 GLY 36 -2.373 -7.510 -16.394
250 H PHE 37 HN PHE 37 -1.413 -7.526 -18.258
251 HA PHE 37 HA PHE 37 -2.736 -7.623 -20.698
252 HB2 PHE 37 HB2 PHE 37 0.225 -8.107 -20.298
253 HB3 PHE 37 HB1 PHE 37 -0.564 -7.444 -21.725
254 HD1 PHE 37 HD2 PHE 37 -1.784 -5.198 -21.463
255 HD2 PHE 37 HD1 PHE 37 1.020 -6.694 -18.623
256 HE1 PHE 37 HE2 PHE 37 -1.473 -2.927 -20.572
257 HE2 PHE 37 HE1 PHE 37 1.330 -4.424 -17.730
258 HZ PHE 37 HZ PHE 37 0.084 -2.537 -18.705
259 H ARG 38 HN ARG 38 -3.839 -9.410 -21.257
260 HA ARG 38 HA ARG 38 -4.241 -11.476 -22.115
261 HB2 ARG 38 HB2 ARG 38 -1.256 -11.375 -22.635
262 HB3 ARG 38 HB1 ARG 38 -2.361 -12.544 -23.350
263 HG2 ARG 38 HG2 ARG 38 -3.531 -10.785 -24.523
264 HG3 ARG 38 HG1 ARG 38 -2.541 -9.556 -23.731
265 HD2 ARG 38 HD2 ARG 38 -1.800 -10.041 -26.044
266 HD3 ARG 38 HD1 ARG 38 -0.555 -10.380 -24.840
267 HE ARG 38 HE ARG 38 -1.064 -12.742 -25.094
268 HH11 ARG 38 HH11 ARG 38 -2.264 -10.605 -27.599
269 HH12 ARG 38 HH12 ARG 38 -2.436 -11.876 -28.768
270 HH21 ARG 38 HH21 ARG 38 -1.252 -14.393 -26.630
271 HH22 ARG 38 HH22 ARG 38 -1.862 -14.037 -28.216
272 H ARG 39 HN ARG 39 -3.581 -11.219 -19.268
273 HA ARG 39 HA ARG 39 -3.289 -12.525 -17.432
274 HB2 ARG 39 HB2 ARG 39 -4.666 -14.147 -18.835
275 HB3 ARG 39 HB1 ARG 39 -3.152 -14.893 -19.320
276 HG2 ARG 39 HG2 ARG 39 -2.687 -15.537 -17.032
277 HG3 ARG 39 HG1 ARG 39 -4.132 -14.689 -16.469
278 HD2 ARG 39 HD2 ARG 39 -5.504 -16.179 -17.912
279 HD3 ARG 39 HD1 ARG 39 -4.038 -17.070 -18.321
280 HE ARG 39 HE ARG 39 -3.979 -17.305 -15.691
281 HH11 ARG 39 HH11 ARG 39 -6.760 -17.553 -17.832
282 HH12 ARG 39 HH12 ARG 39 -7.566 -18.727 -16.844
283 HH21 ARG 39 HH21 ARG 39 -5.050 -18.847 -14.413
284 HH22 ARG 39 HH22 ARG 39 -6.602 -19.454 -14.897
285 H ARG 40 HN ARG 40 -1.242 -11.273 -17.619
286 HA ARG 40 HA ARG 40 1.053 -12.638 -18.742
287 HB2 ARG 40 HB2 ARG 40 0.563 -10.141 -19.003
288 HB3 ARG 40 HB1 ARG 40 1.049 -9.969 -17.322
289 HG2 ARG 40 HG2 ARG 40 2.924 -9.435 -18.717
290 HG3 ARG 40 HG1 ARG 40 3.248 -10.973 -17.909
291 HD2 ARG 40 HD2 ARG 40 2.283 -12.068 -20.020
292 HD3 ARG 40 HD1 ARG 40 2.466 -10.484 -20.770
293 HE ARG 40 HE ARG 40 4.853 -11.507 -19.499
294 HH11 ARG 40 HH11 ARG 40 3.019 -11.250 -22.470
295 HH12 ARG 40 HH12 ARG 40 4.354 -11.704 -23.478
296 HH21 ARG 40 HH21 ARG 40 6.607 -12.117 -20.827
297 HH22 ARG 40 HH22 ARG 40 6.394 -12.194 -22.547
298 H CYS 41 HN CYS 41 2.967 -13.069 -17.612
299 HA CYS 41 HA CYS 41 2.650 -13.912 -14.887
300 HB2 CYS 41 HB2 CYS 41 4.684 -14.230 -17.019
301 HB3 CYS 41 HB1 CYS 41 5.298 -14.251 -15.368
302 H PHE 42 HN PHE 42 2.987 -12.755 -13.182
303 HA PHE 42 HA PHE 42 4.938 -10.541 -13.215
304 HB2 PHE 42 HB2 PHE 42 2.232 -10.708 -11.850
305 HB3 PHE 42 HB1 PHE 42 3.469 -9.565 -11.337
306 HD1 PHE 42 HD2 PHE 42 1.210 -10.500 -14.123
307 HD2 PHE 42 HD1 PHE 42 3.898 -7.575 -12.556
308 HE1 PHE 42 HE2 PHE 42 0.507 -8.920 -15.867
309 HE2 PHE 42 HE1 PHE 42 3.175 -5.987 -14.291
310 HZ PHE 42 HZ PHE 42 1.478 -6.657 -15.945
311 H CYS 43 HN CYS 43 6.245 -10.381 -11.331
312 HA CYS 43 HA CYS 43 6.063 -12.688 -9.479
313 HB2 CYS 43 HB2 CYS 43 8.540 -11.178 -10.361
314 HB3 CYS 43 HB1 CYS 43 8.516 -12.401 -9.102
315 H THR 44 HN THR 44 6.276 -12.273 -7.271
316 HA THR 44 HA THR 44 6.110 -9.420 -6.522
317 HB THR 44 HB THR 44 4.766 -10.135 -4.572
318 HG1 THR 44 HG1 THR 44 5.744 -12.449 -4.928
319 HG21 THR 44 HG21 THR 44 2.712 -10.751 -5.751
320 HG22 THR 44 HG22 THR 44 3.647 -11.167 -7.186
321 HG23 THR 44 HG23 THR 44 3.585 -9.495 -6.628
322 H THR 45 HN THR 45 7.472 -8.672 -4.989
323 HA THR 45 HA THR 45 9.087 -10.554 -3.441
324 HB THR 45 HB THR 45 10.332 -9.922 -5.556
325 HG1 THR 45 HG1 THR 45 12.014 -8.877 -3.707
326 HG21 THR 45 HG21 THR 45 9.595 -7.574 -5.703
327 HG22 THR 45 HG22 THR 45 11.353 -7.706 -5.679
328 HG23 THR 45 HG23 THR 45 10.488 -7.206 -4.226
329 H HIS 46 HN HIS 46 10.487 -9.248 -1.867
330 HA HIS 46 HA HIS 46 8.680 -7.436 -0.470
331 HB2 HIS 46 HB2 HIS 46 9.591 -9.273 0.831
332 HB3 HIS 46 HB1 HIS 46 11.233 -8.831 0.376
333 HD1 HIS 46 HD1 HIS 46 12.378 -7.003 1.717
334 HD2 HIS 46 HD2 HIS 46 8.394 -7.548 2.768
335 HE1 HIS 46 HE1 HIS 46 12.045 -5.675 3.821
336 HE2 HIS 46 HE2 HIS 46 9.666 -6.116 4.501
337 H CYS 47 HN CYS 47 9.042 -5.324 -0.196
338 HA CYS 47 HA CYS 47 11.679 -4.234 -0.935
339 HB2 CYS 47 HB2 CYS 47 8.957 -2.917 -1.045
340 HB3 CYS 47 HB1 CYS 47 10.473 -2.049 -1.260
Start of MODEL 19
1 H1 ARG 1 HT1 ARG 1 6.174 -3.629 3.318
2 H2 ARG 1 HT2 ARG 1 4.867 -3.008 2.441
3 H3 ARG 1 HT3 ARG 1 5.798 -1.982 3.408
4 HA ARG 1 HA ARG 1 6.306 -1.724 1.063
5 HB2 ARG 1 HB2 ARG 1 8.542 -2.949 2.708
6 HB3 ARG 1 HB1 ARG 1 8.765 -1.962 1.266
7 HG2 ARG 1 HG2 ARG 1 7.743 -0.057 2.389
8 HG3 ARG 1 HG1 ARG 1 7.459 -1.042 3.823
9 HD2 ARG 1 HD2 ARG 1 9.903 -1.353 4.051
10 HD3 ARG 1 HD1 ARG 1 10.142 -0.285 2.666
11 HE ARG 1 HE ARG 1 8.557 1.034 4.581
12 HH11 ARG 1 HH11 ARG 1 11.873 -0.010 4.078
13 HH12 ARG 1 HH12 ARG 1 12.533 1.195 5.138
14 HH21 ARG 1 HH21 ARG 1 9.441 2.601 5.982
15 HH22 ARG 1 HH22 ARG 1 11.160 2.674 6.218
16 H THR 2 HN THR 2 5.099 -3.224 -0.175
17 HA THR 2 HA THR 2 6.676 -5.556 -1.069
18 HB THR 2 HB THR 2 3.646 -5.417 -1.058
19 HG1 THR 2 HG1 THR 2 3.717 -6.036 0.954
20 HG21 THR 2 HG21 THR 2 4.629 -6.951 -2.714
21 HG22 THR 2 HG22 THR 2 3.799 -7.843 -1.437
22 HG23 THR 2 HG23 THR 2 5.560 -7.733 -1.438
23 H CYS 3 HN CYS 3 7.191 -5.453 -3.181
24 HA CYS 3 HA CYS 3 5.767 -3.489 -4.875
25 HB2 CYS 3 HB2 CYS 3 8.663 -4.401 -5.022
26 HB3 CYS 3 HB1 CYS 3 7.902 -3.236 -6.099
27 H GLU 4 HN GLU 4 5.524 -4.025 -7.126
28 HA GLU 4 HA GLU 4 5.674 -6.917 -7.664
29 HB2 GLU 4 HB2 GLU 4 3.779 -6.574 -9.268
30 HB3 GLU 4 HB1 GLU 4 3.364 -6.330 -7.582
31 HG2 GLU 4 HG2 GLU 4 2.254 -4.629 -8.712
32 HG3 GLU 4 HG1 GLU 4 3.670 -3.840 -8.031
33 H SER 5 HN SER 5 6.015 -7.518 -9.905
34 HA SER 5 HA SER 5 7.324 -5.574 -11.613
35 HB2 SER 5 HB2 SER 5 8.839 -7.957 -10.492
36 HB3 SER 5 HB1 SER 5 9.447 -6.826 -11.703
37 HG SER 5 HG SER 5 8.600 -5.393 -9.648
38 H GLN 6 HN GLN 6 8.330 -6.932 -13.557
39 HA GLN 6 HA GLN 6 6.218 -8.805 -14.427
40 HB2 GLN 6 HB2 GLN 6 6.122 -6.739 -15.675
41 HB3 GLN 6 HB1 GLN 6 7.855 -6.768 -15.967
42 HG2 GLN 6 HG2 GLN 6 6.769 -7.385 -17.989
43 HG3 GLN 6 HG1 GLN 6 7.519 -8.838 -17.330
44 HE21 GLN 6 HE21 GLN 6 4.550 -7.235 -18.075
45 HE22 GLN 6 HE22 GLN 6 3.500 -8.555 -17.746
46 H SER 7 HN SER 7 6.832 -10.760 -15.265
47 HA SER 7 HA SER 7 9.730 -11.235 -15.569
48 HB2 SER 7 HB2 SER 7 8.894 -12.234 -13.444
49 HB3 SER 7 HB1 SER 7 7.742 -13.195 -14.374
50 HG SER 7 HG SER 7 10.020 -14.045 -13.748
51 H HIS 8 HN HIS 8 10.086 -11.578 -17.649
52 HA HIS 8 HA HIS 8 8.225 -13.225 -19.209
53 HB2 HIS 8 HB2 HIS 8 9.594 -12.587 -21.166
54 HB3 HIS 8 HB1 HIS 8 8.996 -11.174 -20.306
55 HD1 HIS 8 HD1 HIS 8 10.700 -9.448 -19.748
56 HD2 HIS 8 HD2 HIS 8 12.418 -13.151 -20.548
57 HE1 HIS 8 HE1 HIS 8 13.185 -9.064 -19.714
58 HE2 HIS 8 HE2 HIS 8 14.198 -11.287 -20.323
59 H LYS 9 HN LYS 9 10.332 -13.862 -17.016
60 HA LYS 9 HA LYS 9 12.241 -15.606 -18.193
61 HB2 LYS 9 HB2 LYS 9 12.493 -14.595 -15.950
62 HB3 LYS 9 HB1 LYS 9 11.127 -15.540 -15.376
63 HG2 LYS 9 HG2 LYS 9 13.076 -16.637 -14.625
64 HG3 LYS 9 HG1 LYS 9 12.444 -17.602 -15.959
65 HD2 LYS 9 HD2 LYS 9 14.128 -16.840 -17.440
66 HD3 LYS 9 HD1 LYS 9 14.599 -15.528 -16.353
67 HE2 LYS 9 HE2 LYS 9 14.934 -18.478 -15.797
68 HE3 LYS 9 HE1 LYS 9 16.214 -17.379 -16.311
69 HZ1 LYS 9 HZ1 LYS 9 16.055 -17.848 -13.854
70 HZ2 LYS 9 HZ2 LYS 9 14.639 -16.923 -13.841
71 HZ3 LYS 9 HZ3 LYS 9 16.106 -16.218 -14.288
72 H PHE 10 HN PHE 10 9.047 -16.048 -16.729
73 HA PHE 10 HA PHE 10 8.922 -18.853 -17.039
74 HB2 PHE 10 HB2 PHE 10 7.378 -17.502 -15.587
75 HB3 PHE 10 HB1 PHE 10 6.596 -16.897 -17.041
76 HD1 PHE 10 HD2 PHE 10 7.106 -19.804 -14.882
77 HD2 PHE 10 HD1 PHE 10 5.126 -18.331 -18.351
78 HE1 PHE 10 HE2 PHE 10 5.630 -21.775 -14.873
79 HE2 PHE 10 HE1 PHE 10 3.652 -20.300 -18.351
80 HZ PHE 10 HZ PHE 10 3.902 -22.025 -16.613
81 H LYS 11 HN LYS 11 9.146 -19.836 -18.931
82 HA LYS 11 HA LYS 11 8.866 -18.377 -21.379
83 HB2 LYS 11 HB2 LYS 11 10.630 -20.145 -20.750
84 HB3 LYS 11 HB1 LYS 11 9.403 -21.326 -21.177
85 HG2 LYS 11 HG2 LYS 11 9.350 -20.574 -23.439
86 HG3 LYS 11 HG1 LYS 11 10.346 -19.167 -23.057
87 HD2 LYS 11 HD2 LYS 11 11.200 -22.067 -22.996
88 HD3 LYS 11 HD1 LYS 11 11.709 -20.837 -24.155
89 HE2 LYS 11 HE2 LYS 11 12.332 -20.923 -21.202
90 HE3 LYS 11 HE1 LYS 11 13.463 -21.181 -22.529
91 HZ1 LYS 11 HZ1 LYS 11 12.028 -18.636 -21.982
92 HZ2 LYS 11 HZ2 LYS 11 13.180 -18.892 -23.193
93 HZ3 LYS 11 HZ3 LYS 11 13.634 -18.954 -21.569
94 H GLY 12 HN GLY 12 6.985 -18.067 -22.266
95 HA2 GLY 12 HA2 GLY 12 5.129 -18.821 -23.549
96 HA3 GLY 12 HA1 GLY 12 5.111 -20.307 -22.605
97 HA PRO 13 HA PRO 13 2.020 -16.990 -20.962
98 HB2 PRO 13 HB2 PRO 13 -0.270 -18.337 -21.719
99 HB3 PRO 13 HB1 PRO 13 0.455 -17.015 -22.642
100 HG2 PRO 13 HG2 PRO 13 0.705 -19.971 -23.051
101 HG3 PRO 13 HG1 PRO 13 0.498 -18.686 -24.258
102 HD2 PRO 13 HD2 PRO 13 2.900 -19.807 -23.798
103 HD3 PRO 13 HD1 PRO 13 2.741 -18.080 -24.182
104 H CYS 14 HN CYS 14 1.248 -17.314 -18.901
105 HA CYS 14 HA CYS 14 1.966 -19.744 -17.629
106 HB2 CYS 14 HB2 CYS 14 1.150 -18.755 -15.579
107 HB3 CYS 14 HB1 CYS 14 2.062 -17.555 -16.482
108 H ALA 15 HN ALA 15 0.892 -21.462 -18.376
109 HA ALA 15 HA ALA 15 -1.882 -21.661 -18.796
110 HB1 ALA 15 HB1 ALA 15 -1.507 -24.093 -18.797
111 HB2 ALA 15 HB2 ALA 15 0.121 -23.836 -18.166
112 HB3 ALA 15 HB3 ALA 15 -0.308 -23.241 -19.769
113 H SER 16 HN SER 16 0.091 -21.950 -15.943
114 HA SER 16 HA SER 16 -2.310 -22.190 -14.305
115 HB2 SER 16 HB2 SER 16 0.059 -24.052 -13.953
116 HB3 SER 16 HB1 SER 16 -1.420 -24.031 -12.990
117 HG SER 16 HG SER 16 -2.287 -24.265 -15.398
118 H ASP 17 HN ASP 17 -2.243 -20.803 -12.688
119 HA ASP 17 HA ASP 17 -0.140 -19.051 -12.161
120 HB2 ASP 17 HB2 ASP 17 -2.378 -19.872 -10.283
121 HB3 ASP 17 HB1 ASP 17 -1.382 -18.429 -10.131
122 H HIS 18 HN HIS 18 -0.889 -22.203 -10.862
123 HA HIS 18 HA HIS 18 0.832 -22.424 -8.714
124 HB2 HIS 18 HB2 HIS 18 -0.672 -24.241 -9.543
125 HB3 HIS 18 HB1 HIS 18 0.431 -24.479 -10.897
126 HD1 HIS 18 HD1 HIS 18 -0.064 -25.364 -7.338
127 HD2 HIS 18 HD2 HIS 18 2.934 -25.654 -10.203
128 HE1 HIS 18 HE1 HIS 18 1.603 -27.000 -6.413
129 HE2 HIS 18 HE2 HIS 18 3.265 -27.340 -8.277
130 H ASN 19 HN ASN 19 1.576 -23.144 -12.113
131 HA ASN 19 HA ASN 19 4.309 -23.653 -11.696
132 HB2 ASN 19 HB2 ASN 19 2.926 -22.802 -14.260
133 HB3 ASN 19 HB1 ASN 19 4.536 -23.512 -14.152
134 HD21 ASN 19 HD21 ASN 19 4.031 -25.294 -15.400
135 HD22 ASN 19 HD22 ASN 19 2.971 -26.548 -14.861
136 H CYS 20 HN CYS 20 2.575 -20.800 -12.859
137 HA CYS 20 HA CYS 20 4.754 -19.131 -13.356
138 HB2 CYS 20 HB2 CYS 20 2.458 -18.573 -14.015
139 HB3 CYS 20 HB1 CYS 20 2.000 -18.386 -12.326
140 H ALA 21 HN ALA 21 2.924 -19.605 -10.358
141 HA ALA 21 HA ALA 21 4.347 -17.748 -8.786
142 HB1 ALA 21 HB1 ALA 21 2.149 -18.542 -8.135
143 HB2 ALA 21 HB2 ALA 21 3.315 -18.916 -6.867
144 HB3 ALA 21 HB3 ALA 21 2.763 -20.186 -7.959
145 H SER 22 HN SER 22 4.727 -21.253 -9.248
146 HA SER 22 HA SER 22 6.671 -21.690 -7.290
147 HB2 SER 22 HB2 SER 22 5.425 -23.493 -8.474
148 HB3 SER 22 HB1 SER 22 6.370 -23.161 -9.926
149 HG SER 22 HG SER 22 8.220 -23.800 -8.818
150 H VAL 23 HN VAL 23 7.068 -20.995 -10.765
151 HA VAL 23 HA VAL 23 9.887 -20.901 -10.757
152 HB VAL 23 HB VAL 23 7.872 -19.543 -12.561
153 HG11 VAL 23 HG11 VAL 23 10.860 -19.813 -12.980
154 HG12 VAL 23 HG12 VAL 23 9.987 -18.314 -12.667
155 HG13 VAL 23 HG13 VAL 23 9.701 -19.200 -14.163
156 HG21 VAL 23 HG21 VAL 23 9.517 -22.051 -12.913
157 HG22 VAL 23 HG22 VAL 23 8.466 -21.338 -14.137
158 HG23 VAL 23 HG23 VAL 23 7.776 -21.959 -12.638
159 H CYS 24 HN CYS 24 7.469 -18.311 -10.512
160 HA CYS 24 HA CYS 24 9.190 -16.153 -10.206
161 HB2 CYS 24 HB2 CYS 24 6.832 -15.827 -10.615
162 HB3 CYS 24 HB1 CYS 24 6.414 -16.605 -9.091
163 H GLN 25 HN GLN 25 8.189 -18.573 -7.881
164 HA GLN 25 HA GLN 25 9.191 -17.180 -5.586
165 HB2 GLN 25 HB2 GLN 25 8.337 -20.033 -6.053
166 HB3 GLN 25 HB1 GLN 25 9.042 -19.523 -4.524
167 HG2 GLN 25 HG2 GLN 25 7.238 -17.907 -4.228
168 HG3 GLN 25 HG1 GLN 25 6.538 -18.402 -5.769
169 HE21 GLN 25 HE21 GLN 25 4.603 -18.993 -4.732
170 HE22 GLN 25 HE22 GLN 25 4.482 -20.439 -3.793
171 H THR 26 HN THR 26 10.414 -19.875 -7.594
172 HA THR 26 HA THR 26 12.792 -20.255 -6.158
173 HB THR 26 HB THR 26 13.704 -21.321 -8.211
174 HG1 THR 26 HG1 THR 26 11.701 -19.875 -9.380
175 HG21 THR 26 HG21 THR 26 12.287 -22.612 -6.675
176 HG22 THR 26 HG22 THR 26 12.058 -23.131 -8.345
177 HG23 THR 26 HG23 THR 26 10.852 -22.105 -7.571
178 H GLU 27 HN GLU 27 11.925 -17.890 -8.627
179 HA GLU 27 HA GLU 27 14.606 -16.794 -8.746
180 HB2 GLU 27 HB2 GLU 27 11.964 -15.618 -9.647
181 HB3 GLU 27 HB1 GLU 27 13.548 -14.929 -9.984
182 HG2 GLU 27 HG2 GLU 27 14.087 -17.142 -11.130
183 HG3 GLU 27 HG1 GLU 27 12.356 -17.475 -11.038
184 H ARG 28 HN ARG 28 11.512 -15.676 -7.416
185 HA ARG 28 HA ARG 28 12.958 -14.045 -5.431
186 HB2 ARG 28 HB2 ARG 28 10.436 -13.328 -6.952
187 HB3 ARG 28 HB1 ARG 28 11.072 -12.403 -5.600
188 HG2 ARG 28 HG2 ARG 28 12.533 -12.879 -8.199
189 HG3 ARG 28 HG1 ARG 28 11.615 -11.424 -7.804
190 HD2 ARG 28 HD2 ARG 28 14.034 -12.465 -6.324
191 HD3 ARG 28 HD1 ARG 28 14.001 -11.082 -7.420
192 HE ARG 28 HE ARG 28 12.098 -10.664 -5.402
193 HH11 ARG 28 HH11 ARG 28 15.573 -10.827 -5.777
194 HH12 ARG 28 HH12 ARG 28 15.886 -9.763 -4.442
195 HH21 ARG 28 HH21 ARG 28 12.508 -9.312 -3.623
196 HH22 ARG 28 HH22 ARG 28 14.150 -8.917 -3.207
197 H PHE 29 HN PHE 29 12.706 -15.558 -3.783
198 HA PHE 29 HA PHE 29 10.345 -16.964 -3.224
199 HB2 PHE 29 HB2 PHE 29 12.679 -16.235 -1.447
200 HB3 PHE 29 HB1 PHE 29 11.366 -17.289 -0.932
201 HD1 PHE 29 HD2 PHE 29 10.908 -19.379 -2.348
202 HD2 PHE 29 HD1 PHE 29 14.524 -17.137 -2.594
203 HE1 PHE 29 HE2 PHE 29 12.041 -21.319 -3.358
204 HE2 PHE 29 HE1 PHE 29 15.657 -19.073 -3.608
205 HZ PHE 29 HZ PHE 29 14.417 -21.166 -3.989
206 H SER 30 HN SER 30 8.625 -15.573 -3.323
207 HA SER 30 HA SER 30 7.889 -14.277 -0.899
208 HB2 SER 30 HB2 SER 30 7.528 -11.997 -2.107
209 HB3 SER 30 HB1 SER 30 9.150 -12.408 -1.547
210 HG SER 30 HG SER 30 9.033 -13.399 -3.940
211 H GLY 31 HN GLY 31 6.730 -13.085 -4.041
212 HA2 GLY 31 HA2 GLY 31 4.565 -15.081 -4.010
213 HA3 GLY 31 HA1 GLY 31 4.122 -13.384 -3.892
214 H GLY 32 HN GLY 32 3.476 -15.351 -5.962
215 HA2 GLY 32 HA2 GLY 32 4.299 -13.738 -8.267
216 HA3 GLY 32 HA1 GLY 32 4.636 -15.467 -8.318
217 H ARG 33 HN ARG 33 2.842 -13.812 -10.009
218 HA ARG 33 HA ARG 33 0.549 -15.547 -9.982
219 HB2 ARG 33 HB2 ARG 33 0.090 -13.804 -8.163
220 HB3 ARG 33 HB1 ARG 33 0.027 -12.609 -9.449
221 HG2 ARG 33 HG2 ARG 33 -2.206 -13.277 -8.853
222 HG3 ARG 33 HG1 ARG 33 -1.840 -13.857 -10.479
223 HD2 ARG 33 HD2 ARG 33 -1.276 -16.077 -9.499
224 HD3 ARG 33 HD1 ARG 33 -1.815 -15.476 -7.930
225 HE ARG 33 HE ARG 33 -3.486 -16.068 -10.260
226 HH11 ARG 33 HH11 ARG 33 -3.260 -15.018 -6.919
227 HH12 ARG 33 HH12 ARG 33 -4.962 -15.196 -6.620
228 HH21 ARG 33 HH21 ARG 33 -5.718 -16.301 -9.867
229 HH22 ARG 33 HH22 ARG 33 -6.362 -15.916 -8.301
230 H CYS 34 HN CYS 34 -1.147 -14.522 -11.674
231 HA CYS 34 HA CYS 34 0.411 -13.448 -13.937
232 HB2 CYS 34 HB2 CYS 34 -2.133 -15.108 -13.982
233 HB3 CYS 34 HB1 CYS 34 -1.264 -14.520 -15.397
234 H ARG 35 HN ARG 35 -0.025 -11.375 -14.341
235 HA ARG 35 HA ARG 35 -2.692 -10.323 -13.621
236 HB2 ARG 35 HB2 ARG 35 -0.903 -9.387 -12.239
237 HB3 ARG 35 HB1 ARG 35 -0.035 -8.887 -13.676
238 HG2 ARG 35 HG2 ARG 35 -1.067 -6.953 -12.785
239 HG3 ARG 35 HG1 ARG 35 -1.984 -7.395 -14.225
240 HD2 ARG 35 HD2 ARG 35 -2.788 -8.153 -11.411
241 HD3 ARG 35 HD1 ARG 35 -3.370 -6.716 -12.243
242 HE ARG 35 HE ARG 35 -4.113 -9.483 -12.776
243 HH11 ARG 35 HH11 ARG 35 -4.311 -6.125 -13.760
244 HH12 ARG 35 HH12 ARG 35 -5.709 -6.368 -14.759
245 HH21 ARG 35 HH21 ARG 35 -5.947 -9.810 -14.090
246 HH22 ARG 35 HH22 ARG 35 -6.657 -8.466 -14.937
247 H GLY 36 HN GLY 36 -3.861 -9.954 -15.311
248 HA2 GLY 36 HA2 GLY 36 -4.191 -8.474 -17.244
249 HA3 GLY 36 HA1 GLY 36 -2.597 -8.969 -17.792
250 H PHE 37 HN PHE 37 -5.040 -9.126 -19.255
251 HA PHE 37 HA PHE 37 -6.255 -11.653 -19.215
252 HB2 PHE 37 HB2 PHE 37 -7.241 -9.697 -20.326
253 HB3 PHE 37 HB1 PHE 37 -5.942 -9.699 -21.513
254 HD1 PHE 37 HD2 PHE 37 -8.888 -11.577 -20.292
255 HD2 PHE 37 HD1 PHE 37 -6.031 -11.115 -23.421
256 HE1 PHE 37 HE2 PHE 37 -10.216 -13.074 -21.725
257 HE2 PHE 37 HE1 PHE 37 -7.357 -12.609 -24.852
258 HZ PHE 37 HZ PHE 37 -9.450 -13.592 -24.009
259 H ARG 38 HN ARG 38 -3.278 -10.549 -20.657
260 HA ARG 38 HA ARG 38 -3.080 -12.775 -22.491
261 HB2 ARG 38 HB2 ARG 38 -1.055 -10.642 -21.788
262 HB3 ARG 38 HB1 ARG 38 -0.900 -11.801 -23.099
263 HG2 ARG 38 HG2 ARG 38 -2.898 -9.560 -22.858
264 HG3 ARG 38 HG1 ARG 38 -1.593 -9.722 -24.031
265 HD2 ARG 38 HD2 ARG 38 -4.119 -11.363 -23.845
266 HD3 ARG 38 HD1 ARG 38 -3.637 -10.269 -25.138
267 HE ARG 38 HE ARG 38 -2.444 -12.905 -24.574
268 HH11 ARG 38 HH11 ARG 38 -2.922 -10.202 -26.752
269 HH12 ARG 38 HH12 ARG 38 -2.289 -11.041 -28.132
270 HH21 ARG 38 HH21 ARG 38 -1.636 -14.017 -26.382
271 HH22 ARG 38 HH22 ARG 38 -1.567 -13.221 -27.926
272 H ARG 39 HN ARG 39 -2.945 -12.998 -19.367
273 HA ARG 39 HA ARG 39 -2.060 -14.527 -17.919
274 HB2 ARG 39 HB2 ARG 39 -0.996 -15.749 -20.479
275 HB3 ARG 39 HB1 ARG 39 -0.925 -16.528 -18.904
276 HG2 ARG 39 HG2 ARG 39 -3.475 -15.724 -20.302
277 HG3 ARG 39 HG1 ARG 39 -2.769 -17.341 -20.334
278 HD2 ARG 39 HD2 ARG 39 -2.921 -17.375 -17.837
279 HD3 ARG 39 HD1 ARG 39 -3.800 -15.847 -17.921
280 HE ARG 39 HE ARG 39 -5.631 -16.952 -18.847
281 HH11 ARG 39 HH11 ARG 39 -2.967 -19.148 -18.240
282 HH12 ARG 39 HH12 ARG 39 -3.913 -20.575 -18.524
283 HH21 ARG 39 HH21 ARG 39 -6.888 -18.839 -19.165
284 HH22 ARG 39 HH22 ARG 39 -6.139 -20.400 -19.031
285 H ARG 40 HN ARG 40 -0.535 -12.121 -18.610
286 HA ARG 40 HA ARG 40 2.225 -12.849 -18.806
287 HB2 ARG 40 HB2 ARG 40 0.890 -10.608 -19.416
288 HB3 ARG 40 HB1 ARG 40 1.513 -10.147 -17.835
289 HG2 ARG 40 HG2 ARG 40 3.698 -10.172 -18.532
290 HG3 ARG 40 HG1 ARG 40 3.408 -11.387 -19.766
291 HD2 ARG 40 HD2 ARG 40 2.005 -9.594 -20.922
292 HD3 ARG 40 HD1 ARG 40 2.836 -8.453 -19.865
293 HE ARG 40 HE ARG 40 4.290 -10.275 -21.679
294 HH11 ARG 40 HH11 ARG 40 3.769 -7.062 -20.374
295 HH12 ARG 40 HH12 ARG 40 5.038 -6.343 -21.315
296 HH21 ARG 40 HH21 ARG 40 5.919 -9.339 -22.934
297 HH22 ARG 40 HH22 ARG 40 6.245 -7.635 -22.805
298 H CYS 41 HN CYS 41 3.565 -13.391 -17.200
299 HA CYS 41 HA CYS 41 2.546 -13.655 -14.536
300 HB2 CYS 41 HB2 CYS 41 5.064 -14.477 -15.934
301 HB3 CYS 41 HB1 CYS 41 5.028 -14.474 -14.173
302 H PHE 42 HN PHE 42 2.618 -12.183 -13.023
303 HA PHE 42 HA PHE 42 4.840 -10.241 -12.978
304 HB2 PHE 42 HB2 PHE 42 1.970 -9.954 -12.053
305 HB3 PHE 42 HB1 PHE 42 3.248 -8.883 -11.492
306 HD1 PHE 42 HD2 PHE 42 1.834 -10.180 -14.704
307 HD2 PHE 42 HD1 PHE 42 3.572 -6.899 -12.609
308 HE1 PHE 42 HE2 PHE 42 1.483 -8.743 -16.665
309 HE2 PHE 42 HE1 PHE 42 3.221 -5.460 -14.575
310 HZ PHE 42 HZ PHE 42 2.178 -6.382 -16.603
311 H CYS 43 HN CYS 43 5.823 -9.855 -10.989
312 HA CYS 43 HA CYS 43 5.375 -11.968 -8.984
313 HB2 CYS 43 HB2 CYS 43 7.912 -10.702 -10.003
314 HB3 CYS 43 HB1 CYS 43 7.861 -11.502 -8.435
315 H THR 44 HN THR 44 5.241 -11.437 -6.886
316 HA THR 44 HA THR 44 5.452 -8.589 -6.147
317 HB THR 44 HB THR 44 3.888 -9.171 -4.267
318 HG1 THR 44 HG1 THR 44 4.398 -11.532 -4.563
319 HG21 THR 44 HG21 THR 44 2.843 -9.688 -7.059
320 HG22 THR 44 HG22 THR 44 3.005 -8.115 -6.279
321 HG23 THR 44 HG23 THR 44 1.850 -9.294 -5.656
322 H THR 45 HN THR 45 7.193 -8.190 -4.971
323 HA THR 45 HA THR 45 8.296 -10.303 -3.246
324 HB THR 45 HB THR 45 9.548 -10.141 -5.409
325 HG1 THR 45 HG1 THR 45 10.570 -10.763 -3.390
326 HG21 THR 45 HG21 THR 45 10.291 -7.383 -4.415
327 HG22 THR 45 HG22 THR 45 9.279 -7.734 -5.817
328 HG23 THR 45 HG23 THR 45 10.982 -8.198 -5.818
329 H HIS 46 HN HIS 46 9.741 -9.457 -1.559
330 HA HIS 46 HA HIS 46 8.624 -7.161 -0.278
331 HB2 HIS 46 HB2 HIS 46 9.557 -9.166 0.923
332 HB3 HIS 46 HB1 HIS 46 11.167 -8.658 0.427
333 HD1 HIS 46 HD1 HIS 46 12.355 -7.223 2.065
334 HD2 HIS 46 HD2 HIS 46 8.238 -7.088 2.582
335 HE1 HIS 46 HE1 HIS 46 11.985 -5.834 4.122
336 HE2 HIS 46 HE2 HIS 46 9.505 -5.969 4.536
337 H CYS 47 HN CYS 47 9.277 -5.082 -0.425
338 HA CYS 47 HA CYS 47 11.180 -4.380 -2.437
339 HB2 CYS 47 HB2 CYS 47 9.905 -2.510 -0.436
340 HB3 CYS 47 HB1 CYS 47 10.509 -2.121 -2.044
Start of MODEL 20
1 H1 ARG 1 HT1 ARG 1 4.194 -1.206 2.897
2 H2 ARG 1 HT2 ARG 1 4.679 -2.807 2.641
3 H3 ARG 1 HT3 ARG 1 3.251 -2.237 1.942
4 HA ARG 1 HA ARG 1 4.486 -0.709 0.568
5 HB2 ARG 1 HB2 ARG 1 6.941 -2.071 1.717
6 HB3 ARG 1 HB1 ARG 1 6.923 -0.808 0.492
7 HG2 ARG 1 HG2 ARG 1 6.023 0.774 2.137
8 HG3 ARG 1 HG1 ARG 1 6.039 -0.497 3.362
9 HD2 ARG 1 HD2 ARG 1 8.399 0.767 1.976
10 HD3 ARG 1 HD1 ARG 1 7.997 0.820 3.694
11 HE ARG 1 HE ARG 1 8.816 -1.642 2.279
12 HH11 ARG 1 HH11 ARG 1 8.896 0.405 5.124
13 HH12 ARG 1 HH12 ARG 1 9.952 -0.659 5.999
14 HH21 ARG 1 HH21 ARG 1 10.175 -3.030 3.430
15 HH22 ARG 1 HH22 ARG 1 10.683 -2.602 5.038
16 H THR 2 HN THR 2 3.640 -1.754 -1.144
17 HA THR 2 HA THR 2 4.557 -4.494 -1.725
18 HB THR 2 HB THR 2 2.206 -3.007 -2.914
19 HG1 THR 2 HG1 THR 2 2.244 -3.686 -0.535
20 HG21 THR 2 HG21 THR 2 1.497 -5.232 -3.693
21 HG22 THR 2 HG22 THR 2 2.967 -5.937 -3.020
22 HG23 THR 2 HG23 THR 2 3.069 -4.794 -4.360
23 H CYS 3 HN CYS 3 6.166 -4.608 -3.117
24 HA CYS 3 HA CYS 3 6.203 -2.781 -5.429
25 HB2 CYS 3 HB2 CYS 3 8.518 -4.056 -3.950
26 HB3 CYS 3 HB1 CYS 3 8.689 -3.289 -5.525
27 H GLU 4 HN GLU 4 5.898 -3.707 -7.345
28 HA GLU 4 HA GLU 4 6.134 -6.641 -7.517
29 HB2 GLU 4 HB2 GLU 4 4.169 -6.755 -8.873
30 HB3 GLU 4 HB1 GLU 4 3.760 -5.813 -7.450
31 HG2 GLU 4 HG2 GLU 4 4.483 -4.584 -10.106
32 HG3 GLU 4 HG1 GLU 4 2.835 -4.972 -9.624
33 H SER 5 HN SER 5 6.377 -7.463 -9.705
34 HA SER 5 HA SER 5 7.471 -5.656 -11.698
35 HB2 SER 5 HB2 SER 5 9.387 -6.378 -10.187
36 HB3 SER 5 HB1 SER 5 9.097 -8.030 -10.732
37 HG SER 5 HG SER 5 10.508 -7.399 -12.201
38 H GLN 6 HN GLN 6 8.363 -7.429 -13.538
39 HA GLN 6 HA GLN 6 5.971 -9.095 -14.038
40 HB2 GLN 6 HB2 GLN 6 6.228 -7.098 -15.516
41 HB3 GLN 6 HB1 GLN 6 7.779 -7.724 -16.053
42 HG2 GLN 6 HG2 GLN 6 6.610 -9.719 -16.948
43 HG3 GLN 6 HG1 GLN 6 5.074 -8.974 -16.499
44 HE21 GLN 6 HE21 GLN 6 4.374 -7.120 -17.632
45 HE22 GLN 6 HE22 GLN 6 5.029 -6.702 -19.175
46 H SER 7 HN SER 7 6.282 -11.169 -14.890
47 HA SER 7 HA SER 7 9.058 -12.160 -14.731
48 HB2 SER 7 HB2 SER 7 7.881 -14.388 -14.180
49 HB3 SER 7 HB1 SER 7 7.888 -13.142 -12.933
50 HG SER 7 HG SER 7 5.806 -14.301 -13.563
51 H HIS 8 HN HIS 8 9.750 -12.247 -16.753
52 HA HIS 8 HA HIS 8 8.038 -13.448 -18.831
53 HB2 HIS 8 HB2 HIS 8 8.770 -11.172 -19.337
54 HB3 HIS 8 HB1 HIS 8 10.450 -11.635 -19.098
55 HD1 HIS 8 HD1 HIS 8 11.676 -12.364 -21.127
56 HD2 HIS 8 HD2 HIS 8 7.558 -12.567 -21.653
57 HE1 HIS 8 HE1 HIS 8 11.335 -12.964 -23.539
58 HE2 HIS 8 HE2 HIS 8 8.845 -12.869 -23.876
59 H LYS 9 HN LYS 9 10.546 -14.193 -16.775
60 HA LYS 9 HA LYS 9 12.203 -15.796 -18.439
61 HB2 LYS 9 HB2 LYS 9 11.642 -15.892 -15.472
62 HB3 LYS 9 HB1 LYS 9 12.797 -16.956 -16.267
63 HG2 LYS 9 HG2 LYS 9 14.040 -14.941 -17.041
64 HG3 LYS 9 HG1 LYS 9 12.942 -13.948 -16.079
65 HD2 LYS 9 HD2 LYS 9 15.039 -14.400 -14.882
66 HD3 LYS 9 HD1 LYS 9 13.654 -15.105 -14.046
67 HE2 LYS 9 HE2 LYS 9 14.182 -17.293 -15.021
68 HE3 LYS 9 HE1 LYS 9 15.561 -16.588 -15.865
69 HZ1 LYS 9 HZ1 LYS 9 16.553 -16.062 -13.735
70 HZ2 LYS 9 HZ2 LYS 9 16.228 -17.720 -13.844
71 HZ3 LYS 9 HZ3 LYS 9 15.225 -16.718 -12.920
72 H PHE 10 HN PHE 10 9.158 -16.284 -16.872
73 HA PHE 10 HA PHE 10 9.039 -19.063 -16.818
74 HB2 PHE 10 HB2 PHE 10 7.439 -17.568 -15.680
75 HB3 PHE 10 HB1 PHE 10 6.762 -17.111 -17.241
76 HD1 PHE 10 HD2 PHE 10 7.477 -20.155 -15.209
77 HD2 PHE 10 HD1 PHE 10 4.895 -18.255 -18.014
78 HE1 PHE 10 HE2 PHE 10 5.939 -22.068 -15.086
79 HE2 PHE 10 HE1 PHE 10 3.361 -20.172 -17.897
80 HZ PHE 10 HZ PHE 10 3.877 -22.083 -16.433
81 H LYS 11 HN LYS 11 8.480 -20.596 -18.285
82 HA LYS 11 HA LYS 11 9.094 -20.005 -20.992
83 HB2 LYS 11 HB2 LYS 11 7.957 -22.552 -19.818
84 HB3 LYS 11 HB1 LYS 11 8.723 -22.391 -21.394
85 HG2 LYS 11 HG2 LYS 11 10.066 -21.982 -18.722
86 HG3 LYS 11 HG1 LYS 11 10.218 -23.404 -19.753
87 HD2 LYS 11 HD2 LYS 11 11.067 -20.601 -20.496
88 HD3 LYS 11 HD1 LYS 11 12.144 -21.885 -19.951
89 HE2 LYS 11 HE2 LYS 11 10.478 -21.880 -22.471
90 HE3 LYS 11 HE1 LYS 11 12.228 -21.702 -22.367
91 HZ1 LYS 11 HZ1 LYS 11 12.252 -23.955 -21.317
92 HZ2 LYS 11 HZ2 LYS 11 11.797 -23.930 -22.943
93 HZ3 LYS 11 HZ3 LYS 11 10.621 -24.111 -21.744
94 H GLY 12 HN GLY 12 7.498 -18.477 -21.577
95 HA2 GLY 12 HA2 GLY 12 5.759 -18.200 -23.136
96 HA3 GLY 12 HA1 GLY 12 5.113 -19.770 -22.676
97 HA PRO 13 HA PRO 13 2.518 -16.336 -20.748
98 HB2 PRO 13 HB2 PRO 13 0.357 -18.068 -21.830
99 HB3 PRO 13 HB1 PRO 13 0.542 -16.312 -21.915
100 HG2 PRO 13 HG2 PRO 13 0.937 -17.840 -24.070
101 HG3 PRO 13 HG1 PRO 13 1.952 -16.416 -23.760
102 HD2 PRO 13 HD2 PRO 13 2.560 -19.323 -23.294
103 HD3 PRO 13 HD1 PRO 13 3.605 -18.045 -23.956
104 H CYS 14 HN CYS 14 0.983 -16.606 -18.994
105 HA CYS 14 HA CYS 14 1.742 -18.523 -17.126
106 HB2 CYS 14 HB2 CYS 14 0.758 -16.499 -16.337
107 HB3 CYS 14 HB1 CYS 14 -0.706 -16.758 -17.280
108 H ALA 15 HN ALA 15 1.622 -20.591 -18.053
109 HA ALA 15 HA ALA 15 -0.752 -21.829 -18.931
110 HB1 ALA 15 HB1 ALA 15 0.405 -23.943 -18.483
111 HB2 ALA 15 HB2 ALA 15 1.647 -23.082 -17.570
112 HB3 ALA 15 HB3 ALA 15 1.470 -22.801 -19.302
113 H SER 16 HN SER 16 0.768 -21.538 -15.762
114 HA SER 16 HA SER 16 -1.812 -21.706 -14.462
115 HB2 SER 16 HB2 SER 16 0.411 -23.624 -13.681
116 HB3 SER 16 HB1 SER 16 -1.162 -23.476 -12.902
117 HG SER 16 HG SER 16 -1.777 -23.911 -15.357
118 H ASP 17 HN ASP 17 -1.866 -20.395 -12.702
119 HA ASP 17 HA ASP 17 0.145 -18.550 -12.170
120 HB2 ASP 17 HB2 ASP 17 -1.075 -18.040 -10.101
121 HB3 ASP 17 HB1 ASP 17 -2.177 -18.173 -11.465
122 H HIS 18 HN HIS 18 -0.637 -21.615 -10.612
123 HA HIS 18 HA HIS 18 1.152 -21.510 -8.498
124 HB2 HIS 18 HB2 HIS 18 -0.625 -23.285 -8.974
125 HB3 HIS 18 HB1 HIS 18 0.525 -24.008 -10.094
126 HD1 HIS 18 HD1 HIS 18 -0.260 -25.882 -8.040
127 HD2 HIS 18 HD2 HIS 18 2.729 -23.090 -7.288
128 HE1 HIS 18 HE1 HIS 18 1.074 -26.817 -6.128
129 HE2 HIS 18 HE2 HIS 18 2.983 -25.210 -5.825
130 H ASN 19 HN ASN 19 1.613 -22.402 -11.868
131 HA ASN 19 HA ASN 19 4.239 -23.450 -11.596
132 HB2 ASN 19 HB2 ASN 19 2.713 -22.411 -13.990
133 HB3 ASN 19 HB1 ASN 19 4.357 -23.019 -14.116
134 HD21 ASN 19 HD21 ASN 19 1.977 -24.411 -11.950
135 HD22 ASN 19 HD22 ASN 19 1.788 -25.888 -12.822
136 H CYS 20 HN CYS 20 3.020 -20.335 -12.841
137 HA CYS 20 HA CYS 20 5.580 -19.233 -13.299
138 HB2 CYS 20 HB2 CYS 20 3.413 -18.343 -14.233
139 HB3 CYS 20 HB1 CYS 20 3.076 -17.656 -12.645
140 H ALA 21 HN ALA 21 3.437 -19.114 -10.503
141 HA ALA 21 HA ALA 21 4.948 -17.372 -8.898
142 HB1 ALA 21 HB1 ALA 21 2.617 -17.973 -8.406
143 HB2 ALA 21 HB2 ALA 21 3.669 -18.262 -7.021
144 HB3 ALA 21 HB3 ALA 21 3.125 -19.617 -8.011
145 H SER 22 HN SER 22 4.899 -20.921 -9.089
146 HA SER 22 HA SER 22 6.755 -21.464 -7.085
147 HB2 SER 22 HB2 SER 22 5.291 -23.148 -8.243
148 HB3 SER 22 HB1 SER 22 6.369 -23.064 -9.633
149 HG SER 22 HG SER 22 7.397 -23.626 -7.068
150 H VAL 23 HN VAL 23 7.263 -21.006 -10.572
151 HA VAL 23 HA VAL 23 10.051 -21.282 -10.596
152 HB VAL 23 HB VAL 23 8.203 -19.706 -12.405
153 HG11 VAL 23 HG11 VAL 23 11.131 -20.356 -12.834
154 HG12 VAL 23 HG12 VAL 23 10.457 -18.749 -12.553
155 HG13 VAL 23 HG13 VAL 23 10.053 -19.629 -14.027
156 HG21 VAL 23 HG21 VAL 23 7.830 -22.107 -12.425
157 HG22 VAL 23 HG22 VAL 23 9.543 -22.394 -12.727
158 HG23 VAL 23 HG23 VAL 23 8.554 -21.591 -13.949
159 H CYS 24 HN CYS 24 8.038 -18.359 -10.341
160 HA CYS 24 HA CYS 24 10.115 -16.499 -10.124
161 HB2 CYS 24 HB2 CYS 24 7.704 -15.948 -10.532
162 HB3 CYS 24 HB1 CYS 24 7.375 -16.311 -8.840
163 H GLN 25 HN GLN 25 8.713 -18.682 -7.794
164 HA GLN 25 HA GLN 25 10.048 -17.429 -5.545
165 HB2 GLN 25 HB2 GLN 25 8.348 -19.914 -5.756
166 HB3 GLN 25 HB1 GLN 25 9.097 -19.378 -4.256
167 HG2 GLN 25 HG2 GLN 25 7.845 -17.269 -4.395
168 HG3 GLN 25 HG1 GLN 25 7.080 -17.830 -5.881
169 HE21 GLN 25 HE21 GLN 25 5.865 -17.084 -3.325
170 HE22 GLN 25 HE22 GLN 25 4.965 -18.468 -2.810
171 H THR 26 HN THR 26 10.708 -19.972 -7.826
172 HA THR 26 HA THR 26 12.757 -21.200 -6.212
173 HB THR 26 HB THR 26 13.470 -22.342 -8.330
174 HG1 THR 26 HG1 THR 26 12.288 -20.437 -9.559
175 HG21 THR 26 HG21 THR 26 10.527 -22.550 -7.665
176 HG22 THR 26 HG22 THR 26 11.842 -23.409 -6.864
177 HG23 THR 26 HG23 THR 26 11.468 -23.751 -8.552
178 H GLU 27 HN GLU 27 12.548 -18.612 -8.564
179 HA GLU 27 HA GLU 27 15.451 -18.320 -8.618
180 HB2 GLU 27 HB2 GLU 27 15.039 -16.463 -10.183
181 HB3 GLU 27 HB1 GLU 27 14.279 -17.959 -10.705
182 HG2 GLU 27 HG2 GLU 27 12.115 -17.160 -9.965
183 HG3 GLU 27 HG1 GLU 27 12.851 -15.695 -9.317
184 H ARG 28 HN ARG 28 12.636 -16.644 -7.258
185 HA ARG 28 HA ARG 28 14.418 -14.995 -5.604
186 HB2 ARG 28 HB2 ARG 28 12.225 -13.947 -7.411
187 HB3 ARG 28 HB1 ARG 28 12.932 -13.006 -6.110
188 HG2 ARG 28 HG2 ARG 28 14.701 -14.175 -8.221
189 HG3 ARG 28 HG1 ARG 28 13.778 -12.710 -8.554
190 HD2 ARG 28 HD2 ARG 28 16.071 -12.245 -7.756
191 HD3 ARG 28 HD1 ARG 28 14.826 -11.565 -6.715
192 HE ARG 28 HE ARG 28 15.318 -13.234 -5.093
193 HH11 ARG 28 HH11 ARG 28 17.529 -13.209 -7.804
194 HH12 ARG 28 HH12 ARG 28 18.811 -13.984 -6.927
195 HH21 ARG 28 HH21 ARG 28 16.995 -14.257 -3.941
196 HH22 ARG 28 HH22 ARG 28 18.498 -14.601 -4.731
197 H PHE 29 HN PHE 29 13.043 -13.717 -3.971
198 HA PHE 29 HA PHE 29 10.742 -15.317 -3.064
199 HB2 PHE 29 HB2 PHE 29 12.396 -13.222 -1.616
200 HB3 PHE 29 HB1 PHE 29 10.965 -13.998 -0.940
201 HD1 PHE 29 HD2 PHE 29 10.994 -16.526 -0.662
202 HD2 PHE 29 HD1 PHE 29 14.507 -14.240 -1.424
203 HE1 PHE 29 HE2 PHE 29 12.380 -18.376 0.178
204 HE2 PHE 29 HE1 PHE 29 15.897 -16.088 -0.588
205 HZ PHE 29 HZ PHE 29 14.835 -18.161 0.217
206 H SER 30 HN SER 30 9.200 -14.651 -4.390
207 HA SER 30 HA SER 30 7.938 -12.152 -3.948
208 HB2 SER 30 HB2 SER 30 8.110 -11.487 -6.444
209 HB3 SER 30 HB1 SER 30 9.520 -11.177 -5.432
210 HG SER 30 HG SER 30 9.188 -13.504 -7.029
211 H GLY 31 HN GLY 31 5.925 -12.763 -3.912
212 HA2 GLY 31 HA2 GLY 31 4.951 -15.235 -4.825
213 HA3 GLY 31 HA1 GLY 31 3.947 -13.865 -4.364
214 H GLY 32 HN GLY 32 3.683 -15.824 -6.610
215 HA2 GLY 32 HA2 GLY 32 3.931 -13.959 -8.893
216 HA3 GLY 32 HA1 GLY 32 4.067 -15.707 -9.023
217 H ARG 33 HN ARG 33 2.201 -13.437 -10.007
218 HA ARG 33 HA ARG 33 -0.293 -14.973 -9.712
219 HB2 ARG 33 HB2 ARG 33 -0.140 -12.845 -8.230
220 HB3 ARG 33 HB1 ARG 33 -0.232 -11.946 -9.735
221 HG2 ARG 33 HG2 ARG 33 -2.429 -11.954 -9.053
222 HG3 ARG 33 HG1 ARG 33 -2.399 -13.349 -10.131
223 HD2 ARG 33 HD2 ARG 33 -2.028 -13.547 -7.141
224 HD3 ARG 33 HD1 ARG 33 -3.595 -13.683 -7.930
225 HE ARG 33 HE ARG 33 -2.758 -15.683 -9.041
226 HH11 ARG 33 HH11 ARG 33 -0.928 -14.537 -6.285
227 HH12 ARG 33 HH12 ARG 33 -0.277 -16.096 -5.913
228 HH21 ARG 33 HH21 ARG 33 -1.907 -17.761 -8.517
229 HH22 ARG 33 HH22 ARG 33 -0.814 -17.919 -7.183
230 H CYS 34 HN CYS 34 -1.832 -14.406 -11.555
231 HA CYS 34 HA CYS 34 -0.239 -13.782 -13.961
232 HB2 CYS 34 HB2 CYS 34 -2.604 -15.661 -13.709
233 HB3 CYS 34 HB1 CYS 34 -1.725 -15.312 -15.197
234 H ARG 35 HN ARG 35 -1.061 -12.433 -15.485
235 HA ARG 35 HA ARG 35 -3.593 -11.047 -14.929
236 HB2 ARG 35 HB2 ARG 35 -0.873 -9.751 -15.303
237 HB3 ARG 35 HB1 ARG 35 -2.391 -8.869 -15.354
238 HG2 ARG 35 HG2 ARG 35 -1.785 -10.516 -12.940
239 HG3 ARG 35 HG1 ARG 35 -0.937 -8.986 -13.158
240 HD2 ARG 35 HD2 ARG 35 -3.937 -9.184 -13.346
241 HD3 ARG 35 HD1 ARG 35 -3.108 -8.953 -11.804
242 HE ARG 35 HE ARG 35 -2.114 -6.907 -12.860
243 HH11 ARG 35 HH11 ARG 35 -5.216 -8.143 -13.913
244 HH12 ARG 35 HH12 ARG 35 -5.767 -6.606 -14.496
245 HH21 ARG 35 HH21 ARG 35 -2.852 -4.887 -13.593
246 HH22 ARG 35 HH22 ARG 35 -4.432 -4.753 -14.303
247 H GLY 36 HN GLY 36 -4.102 -9.524 -16.817
248 HA2 GLY 36 HA2 GLY 36 -4.553 -9.252 -19.045
249 HA3 GLY 36 HA1 GLY 36 -2.909 -9.798 -19.340
250 H PHE 37 HN PHE 37 -5.366 -11.719 -17.744
251 HA PHE 37 HA PHE 37 -6.244 -13.763 -18.191
252 HB2 PHE 37 HB2 PHE 37 -7.501 -12.214 -19.774
253 HB3 PHE 37 HB1 PHE 37 -6.436 -12.786 -21.050
254 HD1 PHE 37 HD1 PHE 37 -6.591 -15.112 -21.846
255 HD2 PHE 37 HD2 PHE 37 -9.268 -13.581 -18.909
256 HE1 PHE 37 HE1 PHE 37 -8.105 -17.010 -22.242
257 HE2 PHE 37 HE2 PHE 37 -10.782 -15.480 -19.303
258 HZ PHE 37 HZ PHE 37 -10.206 -17.198 -20.968
259 H ARG 38 HN ARG 38 -4.229 -14.827 -17.770
260 HA ARG 38 HA ARG 38 -2.610 -16.342 -18.147
261 HB2 ARG 38 HB2 ARG 38 -4.283 -16.578 -20.579
262 HB3 ARG 38 HB1 ARG 38 -2.668 -17.258 -20.691
263 HG2 ARG 38 HG2 ARG 38 -4.348 -18.904 -20.033
264 HG3 ARG 38 HG1 ARG 38 -3.095 -18.715 -18.816
265 HD2 ARG 38 HD2 ARG 38 -4.623 -17.305 -17.500
266 HD3 ARG 38 HD1 ARG 38 -5.870 -17.523 -18.732
267 HE ARG 38 HE ARG 38 -4.862 -20.014 -17.748
268 HH11 ARG 38 HH11 ARG 38 -7.108 -17.433 -17.009
269 HH12 ARG 38 HH12 ARG 38 -8.143 -18.447 -16.051
270 HH21 ARG 38 HH21 ARG 38 -6.235 -21.340 -16.518
271 HH22 ARG 38 HH22 ARG 38 -7.653 -20.663 -15.777
272 H ARG 39 HN ARG 39 -2.793 -13.683 -20.444
273 HA ARG 39 HA ARG 39 -0.486 -14.329 -21.920
274 HB2 ARG 39 HB2 ARG 39 -2.390 -12.730 -22.549
275 HB3 ARG 39 HB1 ARG 39 -1.552 -11.529 -21.574
276 HG2 ARG 39 HG2 ARG 39 -0.992 -11.273 -23.920
277 HG3 ARG 39 HG1 ARG 39 0.432 -11.757 -22.997
278 HD2 ARG 39 HD2 ARG 39 0.101 -14.084 -23.713
279 HD3 ARG 39 HD1 ARG 39 -1.318 -13.593 -24.640
280 HE ARG 39 HE ARG 39 0.968 -12.110 -25.432
281 HH11 ARG 39 HH11 ARG 39 -0.513 -15.276 -25.706
282 HH12 ARG 39 HH12 ARG 39 0.229 -15.637 -27.232
283 HH21 ARG 39 HH21 ARG 39 1.943 -12.587 -27.469
284 HH22 ARG 39 HH22 ARG 39 1.617 -14.114 -28.229
285 H ARG 40 HN ARG 40 -0.913 -12.331 -19.026
286 HA ARG 40 HA ARG 40 2.006 -11.863 -18.992
287 HB2 ARG 40 HB2 ARG 40 -0.273 -10.185 -17.973
288 HB3 ARG 40 HB1 ARG 40 1.338 -10.008 -17.297
289 HG2 ARG 40 HG2 ARG 40 1.176 -8.337 -18.915
290 HG3 ARG 40 HG1 ARG 40 2.136 -9.603 -19.673
291 HD2 ARG 40 HD2 ARG 40 0.237 -10.346 -20.957
292 HD3 ARG 40 HD1 ARG 40 -0.831 -9.232 -20.097
293 HE ARG 40 HE ARG 40 1.420 -8.069 -21.536
294 HH11 ARG 40 HH11 ARG 40 -2.011 -8.792 -21.541
295 HH12 ARG 40 HH12 ARG 40 -2.382 -7.573 -22.714
296 HH21 ARG 40 HH21 ARG 40 0.922 -6.455 -23.038
297 HH22 ARG 40 HH22 ARG 40 -0.723 -6.232 -23.555
298 H CYS 41 HN CYS 41 3.083 -11.893 -16.971
299 HA CYS 41 HA CYS 41 1.629 -12.974 -14.671
300 HB2 CYS 41 HB2 CYS 41 2.843 -14.869 -15.810
301 HB3 CYS 41 HB1 CYS 41 4.351 -14.005 -15.531
302 H PHE 42 HN PHE 42 2.331 -12.128 -12.726
303 HA PHE 42 HA PHE 42 4.561 -10.211 -12.814
304 HB2 PHE 42 HB2 PHE 42 1.753 -9.679 -11.822
305 HB3 PHE 42 HB1 PHE 42 3.127 -8.690 -11.345
306 HD1 PHE 42 HD2 PHE 42 0.989 -9.695 -14.173
307 HD2 PHE 42 HD1 PHE 42 4.089 -7.093 -12.847
308 HE1 PHE 42 HE2 PHE 42 0.703 -8.327 -16.196
309 HE2 PHE 42 HE1 PHE 42 3.806 -5.723 -14.872
310 HZ PHE 42 HZ PHE 42 2.114 -6.337 -16.547
311 H CYS 43 HN CYS 43 5.656 -9.934 -10.896
312 HA CYS 43 HA CYS 43 5.007 -11.853 -8.758
313 HB2 CYS 43 HB2 CYS 43 7.697 -10.841 -9.703
314 HB3 CYS 43 HB1 CYS 43 7.468 -11.781 -8.232
315 H THR 44 HN THR 44 4.755 -11.090 -6.746
316 HA THR 44 HA THR 44 5.370 -8.259 -6.217
317 HB THR 44 HB THR 44 3.592 -8.462 -4.419
318 HG1 THR 44 HG1 THR 44 3.644 -10.867 -4.532
319 HG21 THR 44 HG21 THR 44 3.128 -7.354 -6.554
320 HG22 THR 44 HG22 THR 44 1.710 -8.234 -5.984
321 HG23 THR 44 HG23 THR 44 2.703 -8.908 -7.275
322 H THR 45 HN THR 45 6.838 -7.854 -4.704
323 HA THR 45 HA THR 45 7.650 -10.047 -2.894
324 HB THR 45 HB THR 45 9.352 -9.531 -4.626
325 HG1 THR 45 HG1 THR 45 10.216 -10.246 -2.718
326 HG21 THR 45 HG21 THR 45 8.848 -7.163 -4.986
327 HG22 THR 45 HG22 THR 45 10.549 -7.393 -4.582
328 HG23 THR 45 HG23 THR 45 9.431 -6.784 -3.364
329 H HIS 46 HN HIS 46 8.281 -9.456 -0.779
330 HA HIS 46 HA HIS 46 6.914 -7.251 0.373
331 HB2 HIS 46 HB2 HIS 46 7.396 -9.293 1.663
332 HB3 HIS 46 HB1 HIS 46 9.122 -8.973 1.537
333 HD1 HIS 46 HD1 HIS 46 10.106 -7.156 3.085
334 HD2 HIS 46 HD2 HIS 46 6.001 -7.664 3.472
335 HE1 HIS 46 HE1 HIS 46 9.461 -5.891 5.163
336 HE2 HIS 46 HE2 HIS 46 7.018 -6.419 5.490
337 H CYS 47 HN CYS 47 7.538 -5.319 -0.413
338 HA CYS 47 HA CYS 47 10.130 -4.651 -1.236
339 HB2 CYS 47 HB2 CYS 47 7.796 -3.566 -1.753
340 HB3 CYS 47 HB1 CYS 47 8.162 -2.557 -0.359
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