Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
26703 | 2o10 RC | 15059 | cing | 1-original | 3 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 H1 GLY 7 1H GLY 7 -20.114 2.472 7.419
2 HA2 GLY 7 2HA GLY 7 -18.778 0.428 7.358
3 HA3 GLY 7 1HA GLY 7 -18.484 0.756 5.655
4 H ALA 8 H ALA 8 -16.347 1.011 5.563
5 HA ALA 8 HA ALA 8 -15.141 3.072 7.299
6 HB1 ALA 8 3HB ALA 8 -13.031 1.827 7.138
7 HB2 ALA 8 1HB ALA 8 -13.840 0.578 6.194
8 HB3 ALA 8 2HB ALA 8 -14.302 0.851 7.874
9 H LYS 9 H LYS 9 -12.766 3.461 6.028
10 HA LYS 9 HA LYS 9 -13.446 3.929 3.219
11 HB2 LYS 9 2HB LYS 9 -12.332 6.098 3.241
12 HB3 LYS 9 1HB LYS 9 -13.674 6.083 4.375
13 HG2 LYS 9 2HG LYS 9 -12.235 6.018 6.236
14 HG3 LYS 9 1HG LYS 9 -10.840 5.601 5.235
15 HD2 LYS 9 2HD LYS 9 -12.355 8.207 5.049
16 HD3 LYS 9 1HD LYS 9 -10.874 7.982 5.984
17 HE2 LYS 9 2HE LYS 9 -9.677 7.357 3.945
18 HE3 LYS 9 1HE LYS 9 -11.155 7.556 3.006
19 HZ1 LYS 9 3HZ LYS 9 -10.037 9.777 4.603
20 HZ2 LYS 9 1HZ LYS 9 -11.134 9.849 3.312
21 HZ3 LYS 9 2HZ LYS 9 -9.503 9.472 3.020
22 H CYS 10 H CYS 10 -11.697 3.907 1.822
23 HA CYS 10 HA CYS 10 -9.915 1.816 2.370
24 HB2 CYS 10 2HB CYS 10 -10.865 2.585 0.154
25 HB3 CYS 10 1HB CYS 10 -9.671 3.872 0.186
26 H GLY 11 H GLY 11 -7.894 1.768 3.094
27 HA2 GLY 11 2HA GLY 11 -6.548 4.031 4.131
28 HA3 GLY 11 1HA GLY 11 -5.826 2.454 3.835
29 H ALA 12 H ALA 12 -6.917 2.935 0.938
30 HA ALA 12 HA ALA 12 -4.628 4.561 0.043
31 HB1 ALA 12 3HB ALA 12 -4.602 2.237 -0.747
32 HB2 ALA 12 1HB ALA 12 -4.788 3.376 -2.081
33 HB3 ALA 12 2HB ALA 12 -6.185 2.476 -1.490
34 H CYS 13 H CYS 13 -7.985 3.754 -0.847
35 HA CYS 13 HA CYS 13 -8.290 6.048 -2.529
36 HB2 CYS 13 2HB CYS 13 -10.394 4.232 -1.334
37 HB3 CYS 13 1HB CYS 13 -10.677 5.423 -2.592
38 H GLU 14 H GLU 14 -9.883 7.703 -2.216
39 HA GLU 14 HA GLU 14 -10.408 8.453 0.571
40 HB2 GLU 14 2HB GLU 14 -11.637 10.316 -1.121
41 HB3 GLU 14 1HB GLU 14 -10.110 10.524 -0.278
42 HG2 GLU 14 2HG GLU 14 -9.782 11.077 -2.570
43 HG3 GLU 14 1HG GLU 14 -8.952 9.560 -2.242
44 H LYS 15 H LYS 15 -11.496 6.339 -1.398
45 HA LYS 15 HA LYS 15 -14.353 6.871 -1.352
46 HB2 LYS 15 2HB LYS 15 -12.996 4.376 -2.360
47 HB3 LYS 15 1HB LYS 15 -14.551 5.044 -2.841
48 HG2 LYS 15 2HG LYS 15 -13.520 6.788 -4.074
49 HG3 LYS 15 1HG LYS 15 -11.932 6.413 -3.400
50 HD2 LYS 15 2HD LYS 15 -12.226 4.108 -4.479
51 HD3 LYS 15 1HD LYS 15 -13.543 4.843 -5.393
52 HE2 LYS 15 2HE LYS 15 -11.448 4.885 -6.655
53 HE3 LYS 15 1HE LYS 15 -12.014 6.514 -6.285
54 HZ1 LYS 15 3HZ LYS 15 -10.406 6.720 -4.563
55 HZ2 LYS 15 1HZ LYS 15 -9.591 6.155 -5.941
56 HZ3 LYS 15 2HZ LYS 15 -9.964 5.080 -4.677
57 H THR 16 H THR 16 -15.720 4.937 -0.710
58 HA THR 16 HA THR 16 -14.996 4.217 1.987
59 HB THR 16 HB THR 16 -17.367 3.007 1.563
60 HG1 THR 16 HG1 THR 16 -18.225 3.697 -0.239
61 HG21 THR 16 3HG2 THR 16 -18.396 5.020 2.531
62 HG22 THR 16 1HG2 THR 16 -16.941 5.942 2.146
63 HG23 THR 16 2HG2 THR 16 -16.870 4.632 3.326
64 H VAL 17 H VAL 17 -14.720 2.192 2.798
65 HA VAL 17 HA VAL 17 -14.512 -0.028 0.871
66 HB VAL 17 HB VAL 17 -13.191 0.373 3.560
67 HG11 VAL 17 1HG1 VAL 17 -13.920 -1.960 3.355
68 HG12 VAL 17 2HG1 VAL 17 -12.165 -1.820 3.278
69 HG13 VAL 17 3HG1 VAL 17 -13.093 -2.077 1.802
70 HG21 VAL 17 3HG2 VAL 17 -12.077 0.005 0.795
71 HG22 VAL 17 1HG2 VAL 17 -11.125 0.145 2.272
72 HG23 VAL 17 2HG2 VAL 17 -12.105 1.506 1.722
73 H TYR 18 H TYR 18 -15.749 -1.826 1.163
74 HA TYR 18 HA TYR 18 -17.541 -1.782 3.504
75 HD1 TYR 18 HD1 TYR 18 -19.803 -0.072 2.445
76 HD2 TYR 18 HD2 TYR 18 -17.613 -1.634 -0.853
77 HE1 TYR 18 HE1 TYR 18 -20.113 2.046 1.242
78 HE2 TYR 18 HE2 TYR 18 -17.924 0.480 -2.066
79 HH TYR 18 HH TYR 18 -19.268 2.417 -2.106
80 HB2 TYR 18 2HB TYR 18 -18.350 -3.101 0.925
81 HB3 TYR 18 1HB TYR 18 -19.361 -2.479 2.226
82 H HIS 19 H HIS 19 -18.547 -4.111 3.706
83 HA HIS 19 HA HIS 19 -16.430 -5.898 4.235
84 HD1 HIS 19 HD1 HIS 19 -17.349 -8.015 6.588
85 HD2 HIS 19 HD2 HIS 19 -19.149 -8.924 2.951
86 HE1 HIS 19 HE1 HIS 19 -17.340 -10.533 6.445
87 HE2 HIS 19 HE2 HIS 19 -18.506 -11.072 4.272
88 HB2 HIS 19 2HB HIS 19 -18.506 -6.040 5.469
89 HB3 HIS 19 1HB HIS 19 -19.414 -6.347 3.993
90 H ALA 20 H ALA 20 -18.140 -5.125 1.397
91 HA ALA 20 HA ALA 20 -18.125 -7.385 -0.163
92 HB1 ALA 20 3HB ALA 20 -18.005 -5.893 -2.091
93 HB2 ALA 20 1HB ALA 20 -17.473 -4.575 -1.045
94 HB3 ALA 20 2HB ALA 20 -19.093 -5.252 -0.858
95 H GLU 21 H GLU 21 -15.449 -5.064 0.248
96 HA GLU 21 HA GLU 21 -13.612 -7.213 -0.424
97 HB2 GLU 21 2HB GLU 21 -12.344 -5.869 -1.982
98 HB3 GLU 21 1HB GLU 21 -13.989 -6.062 -2.545
99 HG2 GLU 21 2HG GLU 21 -14.485 -3.764 -1.811
100 HG3 GLU 21 1HG GLU 21 -12.820 -3.611 -1.246
101 H GLU 22 H GLU 22 -14.056 -6.348 2.083
102 HA GLU 22 HA GLU 22 -12.070 -4.337 2.748
103 HB2 GLU 22 2HB GLU 22 -14.176 -4.239 3.947
104 HB3 GLU 22 1HB GLU 22 -13.975 -5.900 4.495
105 HG2 GLU 22 2HG GLU 22 -11.899 -5.169 5.678
106 HG3 GLU 22 1HG GLU 22 -12.322 -3.508 5.269
107 H ILE 23 H ILE 23 -10.020 -4.982 2.826
108 HA ILE 23 HA ILE 23 -9.443 -7.369 4.452
109 HB ILE 23 HB ILE 23 -7.669 -5.823 2.549
110 HG12 ILE 23 2HG1 ILE 23 -8.287 -8.768 2.559
111 HG13 ILE 23 1HG1 ILE 23 -9.306 -7.612 1.704
112 HG21 ILE 23 1HG2 ILE 23 -6.395 -6.393 4.542
113 HG22 ILE 23 2HG2 ILE 23 -5.873 -7.368 3.168
114 HG23 ILE 23 3HG2 ILE 23 -6.911 -8.074 4.407
115 HD11 ILE 23 3HD1 ILE 23 -6.380 -8.105 1.208
116 HD12 ILE 23 1HD1 ILE 23 -7.395 -6.956 0.338
117 HD13 ILE 23 2HD1 ILE 23 -7.715 -8.687 0.213
118 H GLN 24 H GLN 24 -9.008 -6.978 6.505
119 HA GLN 24 HA GLN 24 -8.364 -4.256 7.323
120 HB2 GLN 24 2HB GLN 24 -9.080 -6.714 8.935
121 HB3 GLN 24 1HB GLN 24 -8.748 -5.131 9.623
122 HG2 GLN 24 2HG GLN 24 -10.655 -4.197 8.450
123 HG3 GLN 24 1HG GLN 24 -10.976 -5.760 7.701
124 HE21 GLN 24 1HE2 GLN 24 -13.055 -5.832 8.612
125 HE22 GLN 24 2HE2 GLN 24 -13.285 -6.177 10.295
126 H CYS 25 H CYS 25 -6.259 -3.854 7.043
127 HA CYS 25 HA CYS 25 -4.319 -5.799 8.099
128 HG CYS 25 HG CYS 25 -1.569 -5.780 5.863
129 HB2 CYS 25 2HB CYS 25 -4.048 -5.186 5.706
130 HB3 CYS 25 1HB CYS 25 -3.861 -3.500 6.178
131 H ASN 26 H ASN 26 -3.318 -5.315 9.917
132 HA ASN 26 HA ASN 26 -2.526 -4.223 11.734
133 HB2 ASN 26 2HB ASN 26 -1.287 -2.803 10.155
134 HB3 ASN 26 1HB ASN 26 -2.688 -1.751 9.994
135 HD21 ASN 26 1HD2 ASN 26 -1.693 0.058 10.740
136 HD22 ASN 26 2HD2 ASN 26 -1.199 0.268 12.382
137 H GLY 27 H GLY 27 -4.572 -1.643 10.429
138 HA2 GLY 27 2HA GLY 27 -6.745 -2.226 12.212
139 HA3 GLY 27 1HA GLY 27 -5.801 -0.829 12.720
140 H ARG 28 H ARG 28 -6.038 -1.539 9.352
141 HA ARG 28 HA ARG 28 -8.029 0.596 9.009
142 HE ARG 28 HE ARG 28 -8.574 3.344 5.412
143 HB2 ARG 28 2HB ARG 28 -5.806 1.563 8.668
144 HB3 ARG 28 1HB ARG 28 -5.413 0.295 7.519
145 HG2 ARG 28 2HG ARG 28 -5.910 2.255 6.286
146 HG3 ARG 28 1HG ARG 28 -7.255 1.136 6.069
147 HD2 ARG 28 2HD ARG 28 -8.588 2.358 7.666
148 HD3 ARG 28 1HD ARG 28 -7.227 3.415 8.045
149 HH11 ARG 28 1HH1 ARG 28 -7.042 5.083 8.034
150 HH12 ARG 28 2HH1 ARG 28 -7.061 6.610 7.199
151 HH21 ARG 28 1HH2 ARG 28 -8.585 5.368 4.303
152 HH22 ARG 28 2HH2 ARG 28 -7.936 6.777 5.099
153 H SER 29 H SER 29 -9.469 0.259 7.389
154 HA SER 29 HA SER 29 -9.513 -2.346 6.149
155 HG SER 29 HG SER 29 -12.403 -2.062 7.316
156 HB2 SER 29 2HB SER 29 -11.450 -0.036 5.868
157 HB3 SER 29 1HB SER 29 -11.733 -1.702 5.366
158 H PHE 30 H PHE 30 -8.616 -2.772 4.267
159 HA PHE 30 HA PHE 30 -8.293 -0.592 2.302
160 HD1 PHE 30 HD2 PHE 30 -5.515 0.241 1.875
161 HD2 PHE 30 HD1 PHE 30 -5.864 -2.802 4.828
162 HE1 PHE 30 HE2 PHE 30 -3.906 1.440 3.298
163 HE2 PHE 30 HE1 PHE 30 -4.257 -1.607 6.257
164 HZ PHE 30 HZ PHE 30 -3.274 0.516 5.489
165 HB2 PHE 30 2HB PHE 30 -6.701 -3.147 2.624
166 HB3 PHE 30 1HB PHE 30 -6.456 -1.959 1.352
167 H HIS 31 H HIS 31 -8.937 -0.991 0.173
168 HA HIS 31 HA HIS 31 -10.860 -3.021 -0.324
169 HD2 HIS 31 HD2 HIS 31 -12.831 -1.813 -0.634
170 HE1 HIS 31 HE1 HIS 31 -12.587 2.080 -2.238
171 HE2 HIS 31 HE2 HIS 31 -13.958 0.522 -0.822
172 HB2 HIS 31 2HB HIS 31 -9.275 -1.227 -2.164
173 HB3 HIS 31 1HB HIS 31 -10.405 -2.426 -2.775
174 H LYS 32 H LYS 32 -10.628 -5.005 -1.384
175 HA LYS 32 HA LYS 32 -8.180 -6.363 -1.254
176 HB2 LYS 32 2HB LYS 32 -10.235 -7.611 -1.368
177 HB3 LYS 32 1HB LYS 32 -10.640 -6.906 -2.925
178 HG2 LYS 32 2HG LYS 32 -8.915 -8.124 -4.020
179 HG3 LYS 32 1HG LYS 32 -8.227 -8.647 -2.481
180 HD2 LYS 32 2HD LYS 32 -11.024 -9.366 -3.325
181 HD3 LYS 32 1HD LYS 32 -9.624 -10.353 -3.750
182 HE2 LYS 32 2HE LYS 32 -10.337 -9.580 -0.927
183 HE3 LYS 32 1HE LYS 32 -10.849 -11.086 -1.688
184 HZ1 LYS 32 3HZ LYS 32 -8.614 -11.790 -1.891
185 HZ2 LYS 32 1HZ LYS 32 -8.791 -11.242 -0.296
186 HZ3 LYS 32 2HZ LYS 32 -8.003 -10.275 -1.446
187 H THR 33 H THR 33 -9.551 -4.276 -3.640
188 HA THR 33 HA THR 33 -7.600 -4.900 -5.664
189 HB THR 33 HB THR 33 -8.604 -2.772 -6.714
190 HG1 THR 33 HG1 THR 33 -10.613 -3.292 -4.738
191 HG21 THR 33 3HG2 THR 33 -10.352 -5.180 -6.205
192 HG22 THR 33 1HG2 THR 33 -9.130 -5.035 -7.468
193 HG23 THR 33 2HG2 THR 33 -10.565 -4.010 -7.507
194 H CYS 34 H CYS 34 -7.452 -3.162 -2.827
195 HA CYS 34 HA CYS 34 -5.321 -1.422 -3.894
196 HB2 CYS 34 2HB CYS 34 -7.138 -0.776 -1.568
197 HB3 CYS 34 1HB CYS 34 -5.935 0.283 -2.300
198 H PHE 35 H PHE 35 -5.633 -4.135 -2.291
199 HA PHE 35 HA PHE 35 -4.269 -3.525 0.169
200 HD1 PHE 35 HD2 PHE 35 -4.556 -4.665 2.310
201 HD2 PHE 35 HD1 PHE 35 -3.716 -7.928 -0.294
202 HE1 PHE 35 HE2 PHE 35 -3.353 -5.802 4.126
203 HE2 PHE 35 HE1 PHE 35 -2.507 -9.066 1.521
204 HZ PHE 35 HZ PHE 35 -2.330 -8.000 3.731
205 HB2 PHE 35 2HB PHE 35 -5.951 -5.301 0.113
206 HB3 PHE 35 1HB PHE 35 -4.997 -6.186 -1.073
207 H HIS 36 H HIS 36 -3.235 -3.901 -2.956
208 HA HIS 36 HA HIS 36 -0.828 -5.358 -2.300
209 HD1 HIS 36 HD1 HIS 36 -3.851 -4.896 -5.379
210 HD2 HIS 36 HD2 HIS 36 -0.527 -2.437 -5.792
211 HE1 HIS 36 HE1 HIS 36 -4.540 -3.088 -6.973
212 HE2 HIS 36 HE2 HIS 36 -2.457 -1.756 -7.389
213 HB2 HIS 36 2HB HIS 36 -0.255 -5.074 -4.705
214 HB3 HIS 36 1HB HIS 36 -1.785 -5.888 -4.411
215 H CYS 37 H CYS 37 1.238 -4.318 -3.483
216 HA CYS 37 HA CYS 37 2.122 -2.658 -1.474
217 HB2 CYS 37 2HB CYS 37 3.494 -4.095 -3.009
218 HB3 CYS 37 1HB CYS 37 3.361 -2.817 -4.211
219 H MET 38 H MET 38 2.026 -0.644 -1.031
220 HA MET 38 HA MET 38 0.750 1.279 -2.709
221 HB2 MET 38 2HB MET 38 2.251 1.616 -0.106
222 HB3 MET 38 1HB MET 38 1.268 2.853 -0.877
223 HG2 MET 38 2HG MET 38 0.244 0.194 0.092
224 HG3 MET 38 1HG MET 38 0.119 1.713 0.978
225 HE1 MET 38 3HE MET 38 -2.516 1.255 1.172
226 HE2 MET 38 1HE MET 38 -2.323 -0.227 0.234
227 HE3 MET 38 2HE MET 38 -3.548 0.955 -0.227
228 H ALA 39 H ALA 39 4.010 0.252 -2.251
229 HA ALA 39 HA ALA 39 5.133 2.812 -3.030
230 HB1 ALA 39 3HB ALA 39 6.230 1.527 -1.293
231 HB2 ALA 39 1HB ALA 39 7.297 1.767 -2.674
232 HB3 ALA 39 2HB ALA 39 6.511 0.207 -2.429
233 H CYS 40 H CYS 40 5.261 -0.528 -4.371
234 HA CYS 40 HA CYS 40 5.877 0.720 -6.952
235 HB2 CYS 40 2HB CYS 40 6.465 -1.541 -7.764
236 HB3 CYS 40 1HB CYS 40 7.429 -1.059 -6.379
237 H ARG 41 H ARG 41 4.298 -2.354 -6.569
238 HA ARG 41 HA ARG 41 1.644 -1.599 -6.458
239 HE ARG 41 HE ARG 41 0.644 1.254 -8.907
240 HB2 ARG 41 2HB ARG 41 2.403 -0.691 -8.819
241 HB3 ARG 41 1HB ARG 41 2.153 -2.363 -9.302
242 HG2 ARG 41 2HG ARG 41 0.172 -0.991 -9.714
243 HG3 ARG 41 1HG ARG 41 -0.149 -2.273 -8.543
244 HD2 ARG 41 2HD ARG 41 -1.173 -0.246 -7.757
245 HD3 ARG 41 1HD ARG 41 0.200 -0.627 -6.719
246 HH11 ARG 41 1HH1 ARG 41 0.266 0.701 -5.454
247 HH12 ARG 41 2HH1 ARG 41 0.773 2.301 -5.028
248 HH21 ARG 41 1HH2 ARG 41 1.313 3.346 -8.319
249 HH22 ARG 41 2HH2 ARG 41 1.355 3.807 -6.640
250 H LYS 42 H LYS 42 3.946 -3.794 -6.286
251 HA LYS 42 HA LYS 42 3.026 -6.131 -7.486
252 HB2 LYS 42 2HB LYS 42 5.271 -5.927 -6.544
253 HB3 LYS 42 1HB LYS 42 4.598 -5.793 -4.923
254 HG2 LYS 42 2HG LYS 42 3.741 -8.057 -5.062
255 HG3 LYS 42 1HG LYS 42 4.336 -8.199 -6.715
256 HD2 LYS 42 2HD LYS 42 6.634 -7.910 -5.899
257 HD3 LYS 42 1HD LYS 42 6.023 -7.792 -4.245
258 HE2 LYS 42 2HE LYS 42 5.174 -10.041 -4.350
259 HE3 LYS 42 1HE LYS 42 5.597 -10.165 -6.055
260 HZ1 LYS 42 3HZ LYS 42 7.237 -11.294 -4.802
261 HZ2 LYS 42 1HZ LYS 42 7.462 -9.982 -3.754
262 HZ3 LYS 42 2HZ LYS 42 7.949 -9.866 -5.374
263 H ALA 43 H ALA 43 1.600 -7.693 -6.937
264 HA ALA 43 HA ALA 43 -0.426 -7.097 -5.003
265 HB1 ALA 43 3HB ALA 43 -0.945 -8.253 -7.101
266 HB2 ALA 43 1HB ALA 43 -1.432 -9.209 -5.701
267 HB3 ALA 43 2HB ALA 43 0.035 -9.626 -6.586
268 H LEU 44 H LEU 44 -0.316 -7.499 -2.892
269 HA LEU 44 HA LEU 44 1.749 -9.283 -1.877
270 HG LEU 44 HG LEU 44 2.226 -6.474 0.412
271 HB2 LEU 44 2HB LEU 44 0.088 -7.104 -0.705
272 HB3 LEU 44 1HB LEU 44 0.734 -8.329 0.367
273 HD11 LEU 44 1HD1 LEU 44 3.307 -8.646 0.408
274 HD12 LEU 44 2HD1 LEU 44 4.301 -7.463 -0.441
275 HD13 LEU 44 3HD1 LEU 44 3.356 -8.636 -1.355
276 HD21 LEU 44 3HD2 LEU 44 2.293 -6.656 -2.592
277 HD22 LEU 44 1HD2 LEU 44 3.306 -5.600 -1.606
278 HD23 LEU 44 2HD2 LEU 44 1.556 -5.372 -1.633
279 H ASP 45 H ASP 45 1.381 -10.884 -0.359
280 HA ASP 45 HA ASP 45 -1.382 -11.897 -0.181
281 HB2 ASP 45 2HB ASP 45 0.020 -13.441 -1.438
282 HB3 ASP 45 1HB ASP 45 1.251 -13.402 -0.182
283 H SER 46 H SER 46 -1.682 -13.225 1.906
284 HA SER 46 HA SER 46 -1.668 -11.571 4.055
285 HG SER 46 HG SER 46 -3.931 -13.946 4.339
286 HB2 SER 46 2HB SER 46 -1.437 -14.579 4.230
287 HB3 SER 46 1HB SER 46 -2.176 -13.502 5.415
288 H THR 47 H THR 47 0.890 -13.931 3.291
289 HA THR 47 HA THR 47 2.268 -13.155 5.756
290 HB THR 47 HB THR 47 3.029 -15.418 3.911
291 HG1 THR 47 HG1 THR 47 1.108 -16.168 4.516
292 HG21 THR 47 3HG2 THR 47 4.702 -14.740 5.581
293 HG22 THR 47 1HG2 THR 47 4.054 -16.340 5.926
294 HG23 THR 47 2HG2 THR 47 3.501 -14.948 6.857
295 H THR 48 H THR 48 2.333 -12.279 2.522
296 HA THR 48 HA THR 48 5.245 -11.990 2.500
297 HB THR 48 HB THR 48 4.909 -11.372 0.058
298 HG1 THR 48 HG1 THR 48 2.660 -12.689 -0.339
299 HG21 THR 48 3HG2 THR 48 4.123 -14.122 1.037
300 HG22 THR 48 1HG2 THR 48 5.757 -13.546 0.703
301 HG23 THR 48 2HG2 THR 48 4.604 -13.744 -0.617
302 H VAL 49 H VAL 49 2.378 -10.126 2.849
303 HA VAL 49 HA VAL 49 3.492 -7.617 2.067
304 HB VAL 49 HB VAL 49 1.154 -7.629 2.058
305 HG11 VAL 49 1HG1 VAL 49 0.789 -9.577 3.489
306 HG12 VAL 49 2HG1 VAL 49 -0.238 -8.231 3.986
307 HG13 VAL 49 3HG1 VAL 49 1.213 -8.621 4.910
308 HG21 VAL 49 3HG2 VAL 49 1.993 -6.203 4.573
309 HG22 VAL 49 1HG2 VAL 49 0.491 -5.926 3.690
310 HG23 VAL 49 2HG2 VAL 49 2.040 -5.560 2.932
311 H ALA 50 H ALA 50 4.709 -6.224 3.152
312 HA ALA 50 HA ALA 50 5.360 -6.854 5.951
313 HB1 ALA 50 3HB ALA 50 7.260 -6.874 4.426
314 HB2 ALA 50 1HB ALA 50 7.403 -5.552 5.584
315 HB3 ALA 50 2HB ALA 50 6.893 -5.224 3.927
316 H ALA 51 H ALA 51 4.094 -5.725 7.264
317 HA ALA 51 HA ALA 51 3.523 -2.924 6.616
318 HB1 ALA 51 3HB ALA 51 1.552 -4.348 6.881
319 HB2 ALA 51 1HB ALA 51 1.627 -3.100 8.125
320 HB3 ALA 51 2HB ALA 51 2.074 -4.760 8.515
321 H HIS 52 H HIS 52 4.191 -1.334 7.894
322 HA HIS 52 HA HIS 52 5.200 -1.967 10.571
323 HD1 HIS 52 HD1 HIS 52 8.595 1.069 9.587
324 HD2 HIS 52 HD2 HIS 52 7.044 -1.731 12.246
325 HE1 HIS 52 HE1 HIS 52 9.752 1.495 11.781
326 HE2 HIS 52 HE2 HIS 52 8.936 -0.336 13.318
327 HB2 HIS 52 2HB HIS 52 7.142 -1.934 9.019
328 HB3 HIS 52 1HB HIS 52 6.734 -0.278 8.578
329 H GLU 53 H GLU 53 4.152 -0.739 11.942
330 HA GLU 53 HA GLU 53 3.172 1.009 12.967
331 HB2 GLU 53 2HB GLU 53 4.515 2.682 10.838
332 HB3 GLU 53 1HB GLU 53 3.736 3.311 12.280
333 HG2 GLU 53 2HG GLU 53 6.164 1.542 12.183
334 HG3 GLU 53 1HG GLU 53 6.119 3.257 12.592
335 H SER 54 H SER 54 2.967 2.462 9.746
336 HA SER 54 HA SER 54 0.111 1.798 9.670
337 HG SER 54 HG SER 54 1.718 4.882 8.359
338 HB2 SER 54 2HB SER 54 -0.317 4.158 8.867
339 HB3 SER 54 1HB SER 54 0.143 4.025 10.564
340 H GLU 55 H GLU 55 2.936 1.434 8.181
341 HA GLU 55 HA GLU 55 1.911 1.999 5.481
342 HB2 GLU 55 2HB GLU 55 4.787 1.597 6.299
343 HB3 GLU 55 1HB GLU 55 4.198 2.149 4.738
344 HG2 GLU 55 2HG GLU 55 4.167 3.618 7.356
345 HG3 GLU 55 1HG GLU 55 5.025 4.044 5.876
346 H ILE 56 H ILE 56 1.894 0.435 3.947
347 HA ILE 56 HA ILE 56 2.880 -2.241 4.657
348 HB ILE 56 HB ILE 56 0.736 -2.901 4.875
349 HG12 ILE 56 2HG1 ILE 56 0.711 -2.491 1.875
350 HG13 ILE 56 1HG1 ILE 56 1.260 -3.927 2.731
351 HG21 ILE 56 1HG2 ILE 56 -0.145 -0.484 3.313
352 HG22 ILE 56 2HG2 ILE 56 -0.073 -0.636 5.069
353 HG23 ILE 56 3HG2 ILE 56 -1.210 -1.617 4.146
354 HD11 ILE 56 3HD1 ILE 56 -1.558 -2.871 2.655
355 HD12 ILE 56 1HD1 ILE 56 -1.019 -4.296 3.546
356 HD13 ILE 56 2HD1 ILE 56 -0.936 -4.274 1.784
357 H TYR 57 H TYR 57 4.174 -3.077 3.152
358 HA TYR 57 HA TYR 57 3.802 -2.357 0.346
359 HD1 TYR 57 HD2 TYR 57 4.509 0.346 -0.160
360 HD2 TYR 57 HD1 TYR 57 6.698 -0.734 3.320
361 HE1 TYR 57 HE2 TYR 57 4.302 2.649 0.681
362 HE2 TYR 57 HE1 TYR 57 6.497 1.558 4.171
363 HH TYR 57 HH TYR 57 4.362 3.819 2.882
364 HB2 TYR 57 2HB TYR 57 6.563 -2.230 1.562
365 HB3 TYR 57 1HB TYR 57 6.061 -1.703 -0.034
366 H CYS 58 H CYS 58 5.391 -3.647 -1.040
367 HA CYS 58 HA CYS 58 5.446 -6.389 -0.229
368 HB2 CYS 58 2HB CYS 58 6.385 -6.848 -2.370
369 HB3 CYS 58 1HB CYS 58 5.236 -5.540 -2.626
370 H LYS 59 H LYS 59 7.608 -7.613 -0.380
371 HA LYS 59 HA LYS 59 9.301 -6.555 1.648
372 HB2 LYS 59 2HB LYS 59 9.699 -8.971 -0.126
373 HB3 LYS 59 1HB LYS 59 10.638 -8.601 1.315
374 HG2 LYS 59 2HG LYS 59 8.581 -8.771 2.663
375 HG3 LYS 59 1HG LYS 59 7.691 -9.220 1.208
376 HD2 LYS 59 2HD LYS 59 9.240 -11.153 0.938
377 HD3 LYS 59 1HD LYS 59 9.954 -10.743 2.499
378 HE2 LYS 59 2HE LYS 59 7.050 -11.398 2.036
379 HE3 LYS 59 1HE LYS 59 8.251 -12.535 2.643
380 HZ1 LYS 59 3HZ LYS 59 6.843 -11.442 4.371
381 HZ2 LYS 59 1HZ LYS 59 7.610 -9.976 4.010
382 HZ3 LYS 59 2HZ LYS 59 8.508 -11.277 4.618
383 H VAL 60 H VAL 60 9.215 -6.107 -1.690
384 HA VAL 60 HA VAL 60 12.051 -5.776 -2.093
385 HB VAL 60 HB VAL 60 9.762 -4.901 -3.870
386 HG11 VAL 60 1HG1 VAL 60 11.811 -3.705 -4.388
387 HG12 VAL 60 2HG1 VAL 60 11.465 -4.884 -5.654
388 HG13 VAL 60 3HG1 VAL 60 12.708 -5.220 -4.449
389 HG21 VAL 60 3HG2 VAL 60 9.710 -7.299 -3.518
390 HG22 VAL 60 1HG2 VAL 60 11.423 -7.418 -3.921
391 HG23 VAL 60 2HG2 VAL 60 10.258 -6.941 -5.155
392 H CYS 61 H CYS 61 9.236 -3.585 -1.959
393 HA CYS 61 HA CYS 61 10.847 -1.231 -1.949
394 HB2 CYS 61 2HB CYS 61 7.969 -1.600 -1.107
395 HB3 CYS 61 1HB CYS 61 8.764 -0.055 -1.397
396 H TYR 62 H TYR 62 9.440 -3.277 0.533
397 HA TYR 62 HA TYR 62 10.060 -1.684 2.763
398 HD1 TYR 62 HD2 TYR 62 8.038 -2.614 4.801
399 HD2 TYR 62 HD1 TYR 62 11.617 -4.904 4.579
400 HE1 TYR 62 HE2 TYR 62 8.204 -2.578 7.255
401 HE2 TYR 62 HE1 TYR 62 11.797 -4.875 7.033
402 HH TYR 62 HH TYR 62 9.270 -4.025 9.051
403 HB2 TYR 62 2HB TYR 62 8.652 -3.784 2.755
404 HB3 TYR 62 1HB TYR 62 10.145 -4.707 2.655
405 H GLY 63 H GLY 63 11.933 -4.100 0.982
406 HA2 GLY 63 2HA GLY 63 14.298 -3.749 2.573
407 HA3 GLY 63 1HA GLY 63 14.171 -4.647 1.067
408 H ARG 64 H ARG 64 12.859 -1.907 0.167
409 HA ARG 64 HA ARG 64 15.322 -0.718 -0.800
410 HE ARG 64 HE ARG 64 13.312 0.316 -4.784
411 HB2 ARG 64 2HB ARG 64 13.383 -0.888 -2.300
412 HB3 ARG 64 1HB ARG 64 12.429 0.095 -1.198
413 HG2 ARG 64 2HG ARG 64 14.106 1.938 -1.565
414 HG3 ARG 64 1HG ARG 64 14.794 0.943 -2.849
415 HD2 ARG 64 2HD ARG 64 11.936 1.892 -2.716
416 HD3 ARG 64 1HD ARG 64 13.203 2.612 -3.707
417 HH11 ARG 64 1HH1 ARG 64 10.389 1.640 -3.394
418 HH12 ARG 64 2HH1 ARG 64 9.324 0.715 -4.402
419 HH21 ARG 64 1HH2 ARG 64 11.902 -0.859 -6.185
420 HH22 ARG 64 2HH2 ARG 64 10.186 -0.678 -6.019
421 H ARG 65 H ARG 65 12.476 0.371 1.050
422 HA ARG 65 HA ARG 65 13.656 2.857 1.774
423 HE ARG 65 HE ARG 65 10.820 5.192 5.197
424 HB2 ARG 65 2HB ARG 65 11.237 2.599 1.657
425 HB3 ARG 65 1HB ARG 65 11.284 1.408 2.952
426 HG2 ARG 65 2HG ARG 65 12.129 3.130 4.485
427 HG3 ARG 65 1HG ARG 65 12.026 4.316 3.184
428 HD2 ARG 65 2HD ARG 65 9.625 3.989 3.042
429 HD3 ARG 65 1HD ARG 65 9.703 2.741 4.287
430 HH11 ARG 65 1HH1 ARG 65 7.739 3.678 4.522
431 HH12 ARG 65 2HH1 ARG 65 6.898 4.539 5.769
432 HH21 ARG 65 1HH2 ARG 65 9.729 6.331 6.828
433 HH22 ARG 65 2HH2 ARG 65 8.033 6.038 7.103
434 H TYR 66 H TYR 66 13.177 -0.202 3.511
435 HA TYR 66 HA TYR 66 14.803 0.840 5.720
436 HD1 TYR 66 HD1 TYR 66 13.555 0.875 8.166
437 HD2 TYR 66 HD2 TYR 66 10.920 -0.788 5.272
438 HE1 TYR 66 HE1 TYR 66 11.694 2.150 9.137
439 HE2 TYR 66 HE2 TYR 66 9.049 0.490 6.234
440 HH TYR 66 HH TYR 66 9.509 3.016 8.492
441 HB2 TYR 66 2HB TYR 66 13.097 -1.651 5.491
442 HB3 TYR 66 1HB TYR 66 14.083 -1.260 6.895
Start of MODEL 2
1 H1 GLY 7 1H GLY 7 -19.491 4.581 5.131
2 HA2 GLY 7 2HA GLY 7 -19.582 2.341 6.804
3 HA3 GLY 7 1HA GLY 7 -19.049 1.796 5.218
4 H ALA 8 H ALA 8 -16.937 1.380 5.519
5 HA ALA 8 HA ALA 8 -15.251 3.301 6.935
6 HB1 ALA 8 3HB ALA 8 -13.493 1.610 6.673
7 HB2 ALA 8 1HB ALA 8 -14.585 0.624 5.701
8 HB3 ALA 8 2HB ALA 8 -14.943 0.919 7.402
9 H LYS 9 H LYS 9 -12.963 3.501 5.726
10 HA LYS 9 HA LYS 9 -13.509 4.080 2.900
11 HB2 LYS 9 2HB LYS 9 -12.192 6.114 3.031
12 HB3 LYS 9 1HB LYS 9 -13.508 6.189 4.193
13 HG2 LYS 9 2HG LYS 9 -12.020 5.739 6.006
14 HG3 LYS 9 1HG LYS 9 -10.689 5.412 4.896
15 HD2 LYS 9 2HD LYS 9 -12.100 8.062 5.196
16 HD3 LYS 9 1HD LYS 9 -10.543 7.655 5.915
17 HE2 LYS 9 2HE LYS 9 -11.166 7.742 2.960
18 HE3 LYS 9 1HE LYS 9 -10.267 8.957 3.867
19 HZ1 LYS 9 3HZ LYS 9 -8.656 7.636 2.845
20 HZ2 LYS 9 1HZ LYS 9 -9.450 6.186 3.214
21 HZ3 LYS 9 2HZ LYS 9 -8.693 7.067 4.442
22 H CYS 10 H CYS 10 -11.906 3.614 1.494
23 HA CYS 10 HA CYS 10 -9.940 1.719 2.228
24 HB2 CYS 10 2HB CYS 10 -10.954 2.050 -0.049
25 HB3 CYS 10 1HB CYS 10 -9.966 3.490 -0.220
26 H GLY 11 H GLY 11 -7.976 1.966 3.032
27 HA2 GLY 11 2HA GLY 11 -6.864 4.520 3.634
28 HA3 GLY 11 1HA GLY 11 -6.055 2.969 3.814
29 H ALA 12 H ALA 12 -6.821 2.591 0.822
30 HA ALA 12 HA ALA 12 -4.415 3.900 -0.214
31 HB1 ALA 12 3HB ALA 12 -6.145 1.778 -1.481
32 HB2 ALA 12 1HB ALA 12 -4.647 1.488 -0.595
33 HB3 ALA 12 2HB ALA 12 -4.616 2.387 -2.111
34 H CYS 13 H CYS 13 -7.860 3.531 -0.925
35 HA CYS 13 HA CYS 13 -7.759 5.650 -2.927
36 HB2 CYS 13 2HB CYS 13 -10.112 4.067 -1.863
37 HB3 CYS 13 1HB CYS 13 -10.146 5.162 -3.234
38 H GLU 14 H GLU 14 -9.931 7.052 -2.701
39 HA GLU 14 HA GLU 14 -10.234 7.968 0.081
40 HB2 GLU 14 2HB GLU 14 -11.045 10.080 -0.794
41 HB3 GLU 14 1HB GLU 14 -9.466 9.735 -1.490
42 HG2 GLU 14 2HG GLU 14 -12.040 9.090 -2.849
43 HG3 GLU 14 1HG GLU 14 -11.203 10.626 -3.070
44 H LYS 15 H LYS 15 -11.360 5.905 -1.971
45 HA LYS 15 HA LYS 15 -14.182 6.532 -1.987
46 HB2 LYS 15 2HB LYS 15 -12.694 4.119 -3.053
47 HB3 LYS 15 1HB LYS 15 -14.371 4.539 -3.392
48 HG2 LYS 15 2HG LYS 15 -13.710 6.502 -4.589
49 HG3 LYS 15 1HG LYS 15 -12.029 6.288 -4.108
50 HD2 LYS 15 2HD LYS 15 -11.929 4.203 -5.390
51 HD3 LYS 15 1HD LYS 15 -13.615 4.420 -5.868
52 HE2 LYS 15 2HE LYS 15 -12.163 5.158 -7.656
53 HE3 LYS 15 1HE LYS 15 -13.009 6.539 -6.966
54 HZ1 LYS 15 3HZ LYS 15 -10.709 7.086 -7.337
55 HZ2 LYS 15 1HZ LYS 15 -10.193 5.755 -6.430
56 HZ3 LYS 15 2HZ LYS 15 -10.992 7.040 -5.667
57 H THR 16 H THR 16 -15.664 4.614 -1.503
58 HA THR 16 HA THR 16 -15.283 4.187 1.321
59 HB THR 16 HB THR 16 -17.656 3.348 -0.283
60 HG1 THR 16 HG1 THR 16 -18.050 5.379 -0.710
61 HG21 THR 16 3HG2 THR 16 -17.352 4.322 2.554
62 HG22 THR 16 1HG2 THR 16 -17.627 2.652 2.055
63 HG23 THR 16 2HG2 THR 16 -18.876 3.869 1.790
64 H VAL 17 H VAL 17 -15.318 2.287 2.395
65 HA VAL 17 HA VAL 17 -15.165 -0.214 0.843
66 HB VAL 17 HB VAL 17 -13.479 0.739 3.146
67 HG11 VAL 17 1HG1 VAL 17 -14.373 -1.438 3.835
68 HG12 VAL 17 2HG1 VAL 17 -12.650 -1.539 3.471
69 HG13 VAL 17 3HG1 VAL 17 -13.831 -2.139 2.309
70 HG21 VAL 17 3HG2 VAL 17 -11.655 -0.112 1.769
71 HG22 VAL 17 1HG2 VAL 17 -12.623 1.093 0.917
72 HG23 VAL 17 2HG2 VAL 17 -12.826 -0.621 0.552
73 H TYR 18 H TYR 18 -16.508 -1.822 1.537
74 HA TYR 18 HA TYR 18 -18.115 -1.230 3.933
75 HD1 TYR 18 HD2 TYR 18 -18.378 -1.112 -0.151
76 HD2 TYR 18 HD1 TYR 18 -20.930 -0.315 3.163
77 HE1 TYR 18 HE2 TYR 18 -19.162 0.942 -1.253
78 HE2 TYR 18 HE1 TYR 18 -21.717 1.740 2.069
79 HH TYR 18 HH TYR 18 -21.079 3.300 0.401
80 HB2 TYR 18 2HB TYR 18 -18.886 -2.850 1.491
81 HB3 TYR 18 1HB TYR 18 -19.924 -2.508 2.873
82 H HIS 19 H HIS 19 -19.325 -3.760 4.196
83 HA HIS 19 HA HIS 19 -17.256 -5.190 5.538
84 HD1 HIS 19 HD1 HIS 19 -19.978 -8.581 4.938
85 HD2 HIS 19 HD2 HIS 19 -21.449 -4.848 3.824
86 HE1 HIS 19 HE1 HIS 19 -21.899 -9.041 3.380
87 HE2 HIS 19 HE2 HIS 19 -22.675 -6.777 2.602
88 HB2 HIS 19 2HB HIS 19 -18.929 -6.717 6.238
89 HB3 HIS 19 1HB HIS 19 -19.719 -5.148 6.174
90 H ALA 20 H ALA 20 -18.069 -5.113 2.292
91 HA ALA 20 HA ALA 20 -17.775 -7.948 1.757
92 HB1 ALA 20 3HB ALA 20 -19.404 -6.560 0.534
93 HB2 ALA 20 1HB ALA 20 -18.259 -7.371 -0.534
94 HB3 ALA 20 2HB ALA 20 -18.062 -5.656 -0.173
95 H GLU 21 H GLU 21 -16.081 -4.967 0.845
96 HA GLU 21 HA GLU 21 -13.868 -6.622 -0.162
97 HB2 GLU 21 2HB GLU 21 -13.323 -4.672 -1.608
98 HB3 GLU 21 1HB GLU 21 -14.908 -5.359 -1.927
99 HG2 GLU 21 2HG GLU 21 -14.424 -2.888 -0.268
100 HG3 GLU 21 1HG GLU 21 -14.836 -2.878 -1.980
101 H GLU 22 H GLU 22 -13.938 -6.134 2.556
102 HA GLU 22 HA GLU 22 -11.949 -4.010 2.937
103 HB2 GLU 22 2HB GLU 22 -13.900 -3.705 4.337
104 HB3 GLU 22 1HB GLU 22 -13.762 -5.349 4.944
105 HG2 GLU 22 2HG GLU 22 -11.596 -4.771 5.958
106 HG3 GLU 22 1HG GLU 22 -11.797 -3.114 5.400
107 H ILE 23 H ILE 23 -9.931 -4.577 3.186
108 HA ILE 23 HA ILE 23 -9.368 -6.940 4.866
109 HB ILE 23 HB ILE 23 -7.730 -5.816 2.583
110 HG12 ILE 23 2HG1 ILE 23 -8.339 -8.701 3.122
111 HG13 ILE 23 1HG1 ILE 23 -9.542 -7.681 2.330
112 HG21 ILE 23 1HG2 ILE 23 -6.240 -6.127 4.480
113 HG22 ILE 23 2HG2 ILE 23 -5.939 -7.360 3.257
114 HG23 ILE 23 3HG2 ILE 23 -6.847 -7.765 4.712
115 HD11 ILE 23 3HD1 ILE 23 -6.744 -8.224 1.359
116 HD12 ILE 23 1HD1 ILE 23 -7.940 -7.215 0.547
117 HD13 ILE 23 2HD1 ILE 23 -8.225 -8.946 0.730
118 H GLN 24 H GLN 24 -8.662 -6.344 6.823
119 HA GLN 24 HA GLN 24 -7.573 -3.642 7.140
120 HB2 GLN 24 2HB GLN 24 -8.514 -5.647 9.190
121 HB3 GLN 24 1HB GLN 24 -7.813 -4.086 9.584
122 HG2 GLN 24 2HG GLN 24 -9.679 -3.104 8.127
123 HG3 GLN 24 1HG GLN 24 -10.433 -4.692 8.283
124 HE21 GLN 24 1HE2 GLN 24 -11.342 -2.112 9.275
125 HE22 GLN 24 2HE2 GLN 24 -11.504 -2.284 10.990
126 H CYS 25 H CYS 25 -5.488 -3.630 6.665
127 HA CYS 25 HA CYS 25 -3.739 -5.738 7.622
128 HG CYS 25 HG CYS 25 -0.731 -4.673 5.191
129 HB2 CYS 25 2HB CYS 25 -3.387 -4.664 5.392
130 HB3 CYS 25 1HB CYS 25 -3.024 -3.154 6.220
131 H ASN 26 H ASN 26 -3.615 -5.673 9.767
132 HA ASN 26 HA ASN 26 -2.958 -5.056 11.842
133 HB2 ASN 26 2HB ASN 26 -0.945 -4.095 10.813
134 HB3 ASN 26 1HB ASN 26 -1.814 -2.593 10.510
135 HD21 ASN 26 1HD2 ASN 26 -0.301 -1.444 11.709
136 HD22 ASN 26 2HD2 ASN 26 -0.289 -1.485 13.444
137 H GLY 27 H GLY 27 -4.082 -2.114 10.136
138 HA2 GLY 27 2HA GLY 27 -6.217 -1.886 12.125
139 HA3 GLY 27 1HA GLY 27 -5.073 -0.560 12.032
140 H ARG 28 H ARG 28 -4.790 -0.656 9.124
141 HA ARG 28 HA ARG 28 -7.098 1.022 8.619
142 HE ARG 28 HE ARG 28 -3.422 4.278 8.933
143 HB2 ARG 28 2HB ARG 28 -4.616 0.475 6.986
144 HB3 ARG 28 1HB ARG 28 -5.895 1.576 6.492
145 HG2 ARG 28 2HG ARG 28 -5.492 2.918 8.510
146 HG3 ARG 28 1HG ARG 28 -4.168 1.836 8.942
147 HD2 ARG 28 2HD ARG 28 -3.045 2.408 6.824
148 HD3 ARG 28 1HD ARG 28 -4.355 3.528 6.452
149 HH11 ARG 28 1HH1 ARG 28 -2.114 4.022 5.689
150 HH12 ARG 28 2HH1 ARG 28 -0.895 5.234 5.951
151 HH21 ARG 28 1HH2 ARG 28 -1.825 5.883 9.272
152 HH22 ARG 28 2HH2 ARG 28 -0.726 6.281 7.985
153 H SER 29 H SER 29 -8.609 0.774 7.024
154 HA SER 29 HA SER 29 -8.959 -1.943 6.010
155 HG SER 29 HG SER 29 -11.850 -1.543 7.336
156 HB2 SER 29 2HB SER 29 -10.814 0.455 6.011
157 HB3 SER 29 1HB SER 29 -11.232 -1.135 5.376
158 H PHE 30 H PHE 30 -8.377 -2.449 4.018
159 HA PHE 30 HA PHE 30 -8.313 -0.323 1.973
160 HD1 PHE 30 HD2 PHE 30 -5.711 0.684 1.548
161 HD2 PHE 30 HD1 PHE 30 -5.463 -2.727 4.080
162 HE1 PHE 30 HE2 PHE 30 -4.010 1.824 2.910
163 HE2 PHE 30 HE1 PHE 30 -3.770 -1.586 5.452
164 HZ PHE 30 HZ PHE 30 -3.011 0.663 4.853
165 HB2 PHE 30 2HB PHE 30 -6.644 -2.852 2.055
166 HB3 PHE 30 1HB PHE 30 -6.539 -1.570 0.854
167 H HIS 31 H HIS 31 -9.022 -0.946 -0.157
168 HA HIS 31 HA HIS 31 -11.140 -2.795 -0.309
169 HD2 HIS 31 HD2 HIS 31 -13.173 -1.693 -1.218
170 HE1 HIS 31 HE1 HIS 31 -12.265 2.147 -2.735
171 HE2 HIS 31 HE2 HIS 31 -13.975 0.764 -1.484
172 HB2 HIS 31 2HB HIS 31 -9.423 -1.546 -2.456
173 HB3 HIS 31 1HB HIS 31 -10.670 -2.725 -2.848
174 H LYS 32 H LYS 32 -11.243 -4.873 -0.993
175 HA LYS 32 HA LYS 32 -9.134 -6.623 -0.522
176 HB2 LYS 32 2HB LYS 32 -11.558 -7.183 -0.547
177 HB3 LYS 32 1HB LYS 32 -11.542 -7.049 -2.297
178 HG2 LYS 32 2HG LYS 32 -10.320 -9.003 -2.564
179 HG3 LYS 32 1HG LYS 32 -9.726 -8.967 -0.901
180 HD2 LYS 32 2HD LYS 32 -11.520 -10.678 -1.373
181 HD3 LYS 32 1HD LYS 32 -11.851 -9.580 -0.031
182 HE2 LYS 32 2HE LYS 32 -13.062 -8.151 -1.794
183 HE3 LYS 32 1HE LYS 32 -13.038 -9.608 -2.784
184 HZ1 LYS 32 3HZ LYS 32 -14.244 -10.773 -1.058
185 HZ2 LYS 32 1HZ LYS 32 -15.091 -9.378 -1.525
186 HZ3 LYS 32 2HZ LYS 32 -14.228 -9.392 -0.071
187 H THR 33 H THR 33 -10.047 -4.854 -3.364
188 HA THR 33 HA THR 33 -8.203 -6.203 -5.124
189 HB THR 33 HB THR 33 -9.508 -3.527 -5.600
190 HG1 THR 33 HG1 THR 33 -10.619 -6.143 -5.696
191 HG21 THR 33 3HG2 THR 33 -8.732 -5.777 -7.461
192 HG22 THR 33 1HG2 THR 33 -7.842 -4.269 -7.247
193 HG23 THR 33 2HG2 THR 33 -9.464 -4.246 -7.939
194 H CYS 34 H CYS 34 -8.094 -3.599 -2.862
195 HA CYS 34 HA CYS 34 -5.763 -2.348 -4.074
196 HB2 CYS 34 2HB CYS 34 -7.479 -1.599 -1.701
197 HB3 CYS 34 1HB CYS 34 -6.029 -0.711 -2.165
198 H PHE 35 H PHE 35 -6.104 -5.013 -2.335
199 HA PHE 35 HA PHE 35 -4.203 -4.514 -0.238
200 HD1 PHE 35 HD2 PHE 35 -4.652 -5.409 1.973
201 HD2 PHE 35 HD1 PHE 35 -3.663 -8.794 -0.404
202 HE1 PHE 35 HE2 PHE 35 -3.357 -6.336 3.842
203 HE2 PHE 35 HE1 PHE 35 -2.363 -9.730 1.467
204 HZ PHE 35 HZ PHE 35 -2.222 -8.497 3.592
205 HB2 PHE 35 2HB PHE 35 -6.040 -6.232 -0.094
206 HB3 PHE 35 1HB PHE 35 -5.128 -7.206 -1.245
207 H HIS 36 H HIS 36 -2.673 -3.595 -1.804
208 HA HIS 36 HA HIS 36 -0.581 -5.496 -2.202
209 HD1 HIS 36 HD1 HIS 36 -3.659 -5.048 -5.506
210 HD2 HIS 36 HD2 HIS 36 -0.796 -2.090 -4.976
211 HE1 HIS 36 HE1 HIS 36 -4.535 -3.038 -6.728
212 HE2 HIS 36 HE2 HIS 36 -2.906 -1.193 -6.192
213 HB2 HIS 36 2HB HIS 36 -0.193 -4.966 -4.608
214 HB3 HIS 36 1HB HIS 36 -1.661 -5.888 -4.324
215 H CYS 37 H CYS 37 1.313 -4.125 -3.420
216 HA CYS 37 HA CYS 37 1.997 -2.428 -1.295
217 HB2 CYS 37 2HB CYS 37 3.572 -3.777 -2.705
218 HB3 CYS 37 1HB CYS 37 3.365 -2.575 -3.975
219 H MET 38 H MET 38 1.365 -0.491 -0.918
220 HA MET 38 HA MET 38 0.239 1.244 -2.879
221 HB2 MET 38 2HB MET 38 0.797 2.852 -0.699
222 HB3 MET 38 1HB MET 38 -0.705 2.000 -0.997
223 HG2 MET 38 2HG MET 38 1.584 0.802 0.535
224 HG3 MET 38 1HG MET 38 0.296 1.727 1.297
225 HE1 MET 38 3HE MET 38 -2.835 -0.518 0.332
226 HE2 MET 38 1HE MET 38 -2.163 0.818 -0.601
227 HE3 MET 38 2HE MET 38 -2.330 0.962 1.149
228 H ALA 39 H ALA 39 3.439 0.533 -2.084
229 HA ALA 39 HA ALA 39 4.437 3.223 -2.554
230 HB1 ALA 39 3HB ALA 39 5.987 0.683 -2.098
231 HB2 ALA 39 1HB ALA 39 5.502 1.827 -0.847
232 HB3 ALA 39 2HB ALA 39 6.635 2.324 -2.102
233 H CYS 40 H CYS 40 4.726 0.027 -4.149
234 HA CYS 40 HA CYS 40 5.533 1.509 -6.552
235 HB2 CYS 40 2HB CYS 40 6.480 -0.612 -7.406
236 HB3 CYS 40 1HB CYS 40 7.238 -0.089 -5.911
237 H ARG 41 H ARG 41 4.357 -1.753 -6.556
238 HA ARG 41 HA ARG 41 1.607 -1.302 -6.572
239 HE ARG 41 HE ARG 41 1.003 1.250 -8.421
240 HB2 ARG 41 2HB ARG 41 2.397 -0.261 -8.859
241 HB3 ARG 41 1HB ARG 41 2.432 -1.940 -9.382
242 HG2 ARG 41 2HG ARG 41 0.320 -0.755 -9.907
243 HG3 ARG 41 1HG ARG 41 0.104 -2.203 -8.920
244 HD2 ARG 41 2HD ARG 41 -1.259 -0.250 -8.176
245 HD3 ARG 41 1HD ARG 41 -0.176 -0.884 -6.937
246 HH11 ARG 41 1HH1 ARG 41 -1.218 0.585 -5.786
247 HH12 ARG 41 2HH1 ARG 41 -0.897 2.088 -4.977
248 HH21 ARG 41 1HH2 ARG 41 1.432 3.202 -7.357
249 HH22 ARG 41 2HH2 ARG 41 0.616 3.576 -5.867
250 H LYS 42 H LYS 42 3.983 -3.112 -5.985
251 HA LYS 42 HA LYS 42 3.736 -5.599 -7.209
252 HB2 LYS 42 2HB LYS 42 5.566 -4.764 -5.678
253 HB3 LYS 42 1HB LYS 42 4.480 -5.057 -4.331
254 HG2 LYS 42 2HG LYS 42 5.887 -6.919 -4.394
255 HG3 LYS 42 1HG LYS 42 4.383 -7.469 -5.137
256 HD2 LYS 42 2HD LYS 42 5.306 -7.346 -7.315
257 HD3 LYS 42 1HD LYS 42 6.702 -6.423 -6.749
258 HE2 LYS 42 2HE LYS 42 7.422 -8.388 -5.439
259 HE3 LYS 42 1HE LYS 42 6.067 -9.302 -6.101
260 HZ1 LYS 42 3HZ LYS 42 8.106 -9.749 -7.305
261 HZ2 LYS 42 1HZ LYS 42 8.285 -8.103 -7.675
262 HZ3 LYS 42 2HZ LYS 42 6.979 -8.979 -8.314
263 H ALA 43 H ALA 43 2.284 -7.242 -6.987
264 HA ALA 43 HA ALA 43 -0.040 -6.814 -5.328
265 HB1 ALA 43 3HB ALA 43 -0.866 -8.901 -6.297
266 HB2 ALA 43 1HB ALA 43 0.712 -9.203 -7.027
267 HB3 ALA 43 2HB ALA 43 -0.256 -7.827 -7.554
268 H LEU 44 H LEU 44 -0.090 -7.340 -3.237
269 HA LEU 44 HA LEU 44 2.027 -8.999 -2.155
270 HG LEU 44 HG LEU 44 2.073 -6.350 0.328
271 HB2 LEU 44 2HB LEU 44 0.125 -7.015 -1.045
272 HB3 LEU 44 1HB LEU 44 0.679 -8.281 0.033
273 HD11 LEU 44 1HD1 LEU 44 3.184 -8.519 0.452
274 HD12 LEU 44 2HD1 LEU 44 4.273 -7.282 -0.177
275 HD13 LEU 44 3HD1 LEU 44 3.532 -8.444 -1.276
276 HD21 LEU 44 3HD2 LEU 44 2.618 -6.508 -2.627
277 HD22 LEU 44 1HD2 LEU 44 3.399 -5.411 -1.486
278 HD23 LEU 44 2HD2 LEU 44 1.670 -5.271 -1.803
279 H ASP 45 H ASP 45 1.723 -10.691 -0.732
280 HA ASP 45 HA ASP 45 -0.935 -11.968 -0.751
281 HB2 ASP 45 2HB ASP 45 0.602 -13.412 -1.899
282 HB3 ASP 45 1HB ASP 45 1.834 -13.183 -0.666
283 H SER 46 H SER 46 -1.432 -13.154 1.316
284 HA SER 46 HA SER 46 -1.263 -11.488 3.506
285 HG SER 46 HG SER 46 -3.531 -14.282 2.915
286 HB2 SER 46 2HB SER 46 -1.555 -14.495 3.638
287 HB3 SER 46 1HB SER 46 -2.147 -13.315 4.809
288 H THR 47 H THR 47 0.970 -14.022 2.509
289 HA THR 47 HA THR 47 2.408 -13.793 5.051
290 HB THR 47 HB THR 47 3.668 -15.791 4.281
291 HG1 THR 47 HG1 THR 47 1.866 -15.617 2.060
292 HG21 THR 47 3HG2 THR 47 0.665 -16.091 4.181
293 HG22 THR 47 1HG2 THR 47 1.641 -16.031 5.647
294 HG23 THR 47 2HG2 THR 47 1.824 -17.376 4.519
295 H THR 48 H THR 48 2.535 -12.070 2.315
296 HA THR 48 HA THR 48 5.483 -11.936 2.377
297 HB THR 48 HB THR 48 5.347 -11.183 -0.036
298 HG1 THR 48 HG1 THR 48 3.085 -12.537 -0.585
299 HG21 THR 48 3HG2 THR 48 6.132 -13.406 0.578
300 HG22 THR 48 1HG2 THR 48 5.183 -13.475 -0.907
301 HG23 THR 48 2HG2 THR 48 4.470 -13.994 0.622
302 H VAL 49 H VAL 49 2.730 -10.260 3.100
303 HA VAL 49 HA VAL 49 3.590 -7.679 2.144
304 HB VAL 49 HB VAL 49 1.275 -7.798 2.181
305 HG11 VAL 49 1HG1 VAL 49 1.038 -9.818 3.527
306 HG12 VAL 49 2HG1 VAL 49 -0.054 -8.561 4.111
307 HG13 VAL 49 3HG1 VAL 49 1.436 -8.911 4.986
308 HG21 VAL 49 3HG2 VAL 49 2.006 -5.703 3.120
309 HG22 VAL 49 1HG2 VAL 49 2.065 -6.407 4.735
310 HG23 VAL 49 2HG2 VAL 49 0.517 -6.216 3.912
311 H ALA 50 H ALA 50 4.828 -6.270 3.137
312 HA ALA 50 HA ALA 50 5.640 -6.811 5.898
313 HB1 ALA 50 3HB ALA 50 6.802 -4.855 3.914
314 HB2 ALA 50 1HB ALA 50 7.402 -6.493 4.190
315 HB3 ALA 50 2HB ALA 50 7.480 -5.296 5.481
316 H ALA 51 H ALA 51 4.318 -5.900 7.328
317 HA ALA 51 HA ALA 51 3.341 -3.180 6.772
318 HB1 ALA 51 3HB ALA 51 2.168 -5.228 8.645
319 HB2 ALA 51 1HB ALA 51 1.586 -4.894 7.014
320 HB3 ALA 51 2HB ALA 51 1.493 -3.646 8.257
321 H HIS 52 H HIS 52 4.750 -1.841 7.653
322 HA HIS 52 HA HIS 52 5.690 -2.330 10.387
323 HD1 HIS 52 HD1 HIS 52 8.913 -2.082 10.573
324 HD2 HIS 52 HD2 HIS 52 6.957 1.594 10.675
325 HE1 HIS 52 HE1 HIS 52 10.061 -0.746 12.370
326 HE2 HIS 52 HE2 HIS 52 8.900 1.494 12.386
327 HB2 HIS 52 2HB HIS 52 7.344 -1.700 8.595
328 HB3 HIS 52 1HB HIS 52 6.536 -0.141 8.470
329 H GLU 53 H GLU 53 4.098 -1.748 11.744
330 HA GLU 53 HA GLU 53 2.518 -0.531 12.806
331 HB2 GLU 53 2HB GLU 53 3.917 1.805 11.491
332 HB3 GLU 53 1HB GLU 53 2.666 1.957 12.717
333 HG2 GLU 53 2HG GLU 53 5.344 0.632 13.071
334 HG3 GLU 53 1HG GLU 53 4.877 2.222 13.678
335 H SER 54 H SER 54 2.243 2.075 10.639
336 HA SER 54 HA SER 54 -0.280 0.946 9.670
337 HG SER 54 HG SER 54 1.010 4.668 9.673
338 HB2 SER 54 2HB SER 54 -0.619 3.479 9.083
339 HB3 SER 54 1HB SER 54 -0.785 2.934 10.753
340 H GLU 55 H GLU 55 2.603 0.714 8.569
341 HA GLU 55 HA GLU 55 1.993 1.674 5.853
342 HB2 GLU 55 2HB GLU 55 4.662 1.481 7.241
343 HB3 GLU 55 1HB GLU 55 4.472 1.812 5.524
344 HG2 GLU 55 2HG GLU 55 3.121 3.810 6.130
345 HG3 GLU 55 1HG GLU 55 3.524 3.506 7.820
346 H ILE 56 H ILE 56 1.256 -0.052 4.840
347 HA ILE 56 HA ILE 56 2.699 -2.602 5.006
348 HB ILE 56 HB ILE 56 0.590 -3.381 5.087
349 HG12 ILE 56 2HG1 ILE 56 0.562 -2.578 2.169
350 HG13 ILE 56 1HG1 ILE 56 1.210 -4.075 2.826
351 HG21 ILE 56 1HG2 ILE 56 -0.306 -1.161 5.538
352 HG22 ILE 56 2HG2 ILE 56 -1.410 -2.117 4.551
353 HG23 ILE 56 3HG2 ILE 56 -0.431 -0.856 3.804
354 HD11 ILE 56 3HD1 ILE 56 -0.978 -4.389 1.786
355 HD12 ILE 56 1HD1 ILE 56 -1.678 -3.229 2.918
356 HD13 ILE 56 2HD1 ILE 56 -1.019 -4.753 3.512
357 H TYR 57 H TYR 57 4.054 -3.206 3.423
358 HA TYR 57 HA TYR 57 3.595 -2.296 0.691
359 HD1 TYR 57 HD2 TYR 57 4.136 0.245 -0.092
360 HD2 TYR 57 HD1 TYR 57 6.018 -0.258 3.675
361 HE1 TYR 57 HE2 TYR 57 3.439 2.517 0.542
362 HE2 TYR 57 HE1 TYR 57 5.338 2.005 4.331
363 HH TYR 57 HH TYR 57 4.666 4.092 3.353
364 HB2 TYR 57 2HB TYR 57 6.277 -1.886 2.050
365 HB3 TYR 57 1HB TYR 57 5.905 -1.535 0.367
366 H CYS 58 H CYS 58 5.282 -3.306 -0.805
367 HA CYS 58 HA CYS 58 5.527 -6.105 -0.279
368 HB2 CYS 58 2HB CYS 58 6.497 -6.260 -2.444
369 HB3 CYS 58 1HB CYS 58 5.287 -4.990 -2.572
370 H LYS 59 H LYS 59 7.714 -7.196 -0.418
371 HA LYS 59 HA LYS 59 9.408 -6.036 1.584
372 HB2 LYS 59 2HB LYS 59 9.684 -8.566 -0.038
373 HB3 LYS 59 1HB LYS 59 10.789 -8.095 1.248
374 HG2 LYS 59 2HG LYS 59 8.825 -8.053 2.799
375 HG3 LYS 59 1HG LYS 59 7.861 -8.745 1.496
376 HD2 LYS 59 2HD LYS 59 10.332 -9.991 2.686
377 HD3 LYS 59 1HD LYS 59 8.674 -10.439 3.087
378 HE2 LYS 59 2HE LYS 59 8.333 -10.987 0.667
379 HE3 LYS 59 1HE LYS 59 10.060 -10.725 0.423
380 HZ1 LYS 59 3HZ LYS 59 10.500 -12.474 2.056
381 HZ2 LYS 59 1HZ LYS 59 9.590 -13.061 0.749
382 HZ3 LYS 59 2HZ LYS 59 8.834 -12.740 2.231
383 H VAL 60 H VAL 60 9.171 -5.552 -1.679
384 HA VAL 60 HA VAL 60 11.969 -5.140 -2.241
385 HB VAL 60 HB VAL 60 9.526 -4.228 -3.777
386 HG11 VAL 60 1HG1 VAL 60 11.454 -2.860 -4.309
387 HG12 VAL 60 2HG1 VAL 60 11.076 -3.932 -5.658
388 HG13 VAL 60 3HG1 VAL 60 12.428 -4.303 -4.588
389 HG21 VAL 60 3HG2 VAL 60 9.659 -6.654 -3.625
390 HG22 VAL 60 1HG2 VAL 60 11.325 -6.612 -4.198
391 HG23 VAL 60 2HG2 VAL 60 10.014 -6.114 -5.266
392 H CYS 61 H CYS 61 9.128 -3.033 -1.770
393 HA CYS 61 HA CYS 61 10.694 -0.653 -1.620
394 HB2 CYS 61 2HB CYS 61 7.864 -1.167 -0.718
395 HB3 CYS 61 1HB CYS 61 8.622 0.420 -0.821
396 H TYR 62 H TYR 62 9.447 -2.938 0.741
397 HA TYR 62 HA TYR 62 10.181 -1.433 3.035
398 HD1 TYR 62 HD2 TYR 62 7.978 -2.124 4.826
399 HD2 TYR 62 HD1 TYR 62 11.364 -4.696 4.985
400 HE1 TYR 62 HE2 TYR 62 7.986 -1.952 7.274
401 HE2 TYR 62 HE1 TYR 62 11.375 -4.533 7.440
402 HH TYR 62 HH TYR 62 10.606 -3.083 9.192
403 HB2 TYR 62 2HB TYR 62 8.639 -3.498 2.891
404 HB3 TYR 62 1HB TYR 62 10.122 -4.443 2.939
405 H GLY 63 H GLY 63 11.835 -3.878 1.082
406 HA2 GLY 63 2HA GLY 63 14.233 -3.812 2.672
407 HA3 GLY 63 1HA GLY 63 14.031 -4.607 1.116
408 H ARG 64 H ARG 64 12.913 -1.752 0.374
409 HA ARG 64 HA ARG 64 15.447 -0.705 -0.568
410 HE ARG 64 HE ARG 64 13.909 0.521 -4.668
411 HB2 ARG 64 2HB ARG 64 13.512 -0.736 -2.071
412 HB3 ARG 64 1HB ARG 64 12.607 0.264 -0.949
413 HG2 ARG 64 2HG ARG 64 14.205 2.090 -1.301
414 HG3 ARG 64 1HG ARG 64 15.079 1.084 -2.459
415 HD2 ARG 64 2HD ARG 64 12.185 1.890 -2.703
416 HD3 ARG 64 1HD ARG 64 13.523 2.686 -3.529
417 HH11 ARG 64 1HH1 ARG 64 10.777 1.150 -3.250
418 HH12 ARG 64 2HH1 ARG 64 9.919 0.112 -4.336
419 HH21 ARG 64 1HH2 ARG 64 12.781 -0.832 -6.143
420 HH22 ARG 64 2HH2 ARG 64 11.051 -0.999 -6.001
421 H ARG 65 H ARG 65 12.832 0.190 1.628
422 HA ARG 65 HA ARG 65 14.069 2.684 2.376
423 HE ARG 65 HE ARG 65 10.861 4.225 4.126
424 HB2 ARG 65 2HB ARG 65 11.738 1.175 3.569
425 HB3 ARG 65 1HB ARG 65 12.246 2.784 4.063
426 HG2 ARG 65 2HG ARG 65 11.768 3.620 1.812
427 HG3 ARG 65 1HG ARG 65 11.238 2.005 1.334
428 HD2 ARG 65 2HD ARG 65 9.347 3.464 1.911
429 HD3 ARG 65 1HD ARG 65 9.461 2.066 2.980
430 HH11 ARG 65 1HH1 ARG 65 7.573 3.211 3.454
431 HH12 ARG 65 2HH1 ARG 65 6.886 4.122 4.769
432 HH21 ARG 65 1HH2 ARG 65 9.973 5.421 5.818
433 HH22 ARG 65 2HH2 ARG 65 8.257 5.416 6.092
434 H TYR 66 H TYR 66 13.995 -0.593 3.550
435 HA TYR 66 HA TYR 66 15.637 0.202 5.866
436 HD1 TYR 66 HD2 TYR 66 11.922 -0.588 5.062
437 HD2 TYR 66 HD1 TYR 66 14.134 -0.522 8.694
438 HE1 TYR 66 HE2 TYR 66 10.111 0.685 6.136
439 HE2 TYR 66 HE1 TYR 66 12.330 0.747 9.776
440 HH TYR 66 HH TYR 66 10.470 2.032 9.355
441 HB2 TYR 66 2HB TYR 66 13.821 -2.200 5.541
442 HB3 TYR 66 1HB TYR 66 14.851 -1.900 6.935
Start of MODEL 3
1 H1 GLY 7 1H GLY 7 -18.898 3.592 7.621
2 HA2 GLY 7 2HA GLY 7 -17.914 1.043 7.052
3 HA3 GLY 7 1HA GLY 7 -18.117 1.875 5.517
4 H ALA 8 H ALA 8 -15.675 1.286 5.779
5 HA ALA 8 HA ALA 8 -14.263 3.500 7.110
6 HB1 ALA 8 3HB ALA 8 -12.247 2.118 6.845
7 HB2 ALA 8 1HB ALA 8 -13.208 0.881 6.033
8 HB3 ALA 8 2HB ALA 8 -13.511 1.263 7.730
9 H LYS 9 H LYS 9 -12.007 3.810 5.664
10 HA LYS 9 HA LYS 9 -12.941 4.252 2.913
11 HB2 LYS 9 2HB LYS 9 -11.859 6.367 2.777
12 HB3 LYS 9 1HB LYS 9 -12.801 6.400 4.263
13 HG2 LYS 9 2HG LYS 9 -10.844 6.085 5.596
14 HG3 LYS 9 1HG LYS 9 -9.857 5.782 4.165
15 HD2 LYS 9 2HD LYS 9 -11.248 8.376 4.832
16 HD3 LYS 9 1HD LYS 9 -9.528 8.051 5.036
17 HE2 LYS 9 2HE LYS 9 -10.985 7.927 2.396
18 HE3 LYS 9 1HE LYS 9 -10.094 9.333 2.975
19 HZ1 LYS 9 3HZ LYS 9 -8.995 6.659 2.277
20 HZ2 LYS 9 1HZ LYS 9 -8.103 7.845 3.105
21 HZ3 LYS 9 2HZ LYS 9 -8.667 8.151 1.535
22 H CYS 10 H CYS 10 -11.479 3.865 1.335
23 HA CYS 10 HA CYS 10 -9.415 2.023 1.894
24 HB2 CYS 10 2HB CYS 10 -10.647 2.202 -0.252
25 HB3 CYS 10 1HB CYS 10 -9.812 3.712 -0.573
26 H GLY 11 H GLY 11 -7.299 2.278 2.229
27 HA2 GLY 11 2HA GLY 11 -6.142 4.900 2.504
28 HA3 GLY 11 1HA GLY 11 -5.306 3.366 2.704
29 H ALA 12 H ALA 12 -6.762 2.989 -0.160
30 HA ALA 12 HA ALA 12 -4.507 4.166 -1.654
31 HB1 ALA 12 3HB ALA 12 -6.194 1.763 -2.367
32 HB2 ALA 12 1HB ALA 12 -4.544 1.727 -1.743
33 HB3 ALA 12 2HB ALA 12 -4.870 2.419 -3.333
34 H CYS 13 H CYS 13 -7.977 3.560 -1.680
35 HA CYS 13 HA CYS 13 -8.357 5.527 -3.825
36 HB2 CYS 13 2HB CYS 13 -10.461 3.904 -2.376
37 HB3 CYS 13 1HB CYS 13 -10.670 4.817 -3.860
38 H GLU 14 H GLU 14 -9.957 7.243 -3.466
39 HA GLU 14 HA GLU 14 -10.351 7.935 -0.645
40 HB2 GLU 14 2HB GLU 14 -10.660 9.472 -3.215
41 HB3 GLU 14 1HB GLU 14 -11.450 10.013 -1.748
42 HG2 GLU 14 2HG GLU 14 -8.517 9.576 -2.076
43 HG3 GLU 14 1HG GLU 14 -9.326 11.138 -2.073
44 H LYS 15 H LYS 15 -11.532 5.773 -2.372
45 HA LYS 15 HA LYS 15 -14.372 6.309 -2.309
46 HB2 LYS 15 2HB LYS 15 -12.984 3.654 -2.722
47 HB3 LYS 15 1HB LYS 15 -14.640 4.063 -3.146
48 HG2 LYS 15 2HG LYS 15 -13.764 5.646 -4.834
49 HG3 LYS 15 1HG LYS 15 -12.130 5.093 -4.452
50 HD2 LYS 15 2HD LYS 15 -12.953 2.750 -4.953
51 HD3 LYS 15 1HD LYS 15 -14.401 3.501 -5.622
52 HE2 LYS 15 2HE LYS 15 -12.932 3.067 -7.435
53 HE3 LYS 15 1HE LYS 15 -12.910 4.806 -7.152
54 HZ1 LYS 15 3HZ LYS 15 -10.794 4.706 -6.218
55 HZ2 LYS 15 1HZ LYS 15 -10.696 3.630 -7.524
56 HZ3 LYS 15 2HZ LYS 15 -10.869 3.037 -5.941
57 H THR 16 H THR 16 -15.677 4.443 -1.266
58 HA THR 16 HA THR 16 -14.829 4.226 1.518
59 HB THR 16 HB THR 16 -17.454 3.425 0.357
60 HG1 THR 16 HG1 THR 16 -17.803 5.468 -0.051
61 HG21 THR 16 3HG2 THR 16 -16.645 4.350 3.109
62 HG22 THR 16 1HG2 THR 16 -17.047 2.696 2.640
63 HG23 THR 16 2HG2 THR 16 -18.289 3.949 2.616
64 H VAL 17 H VAL 17 -14.529 2.270 2.531
65 HA VAL 17 HA VAL 17 -14.734 -0.128 0.832
66 HB VAL 17 HB VAL 17 -12.874 0.478 3.132
67 HG11 VAL 17 1HG1 VAL 17 -12.059 -1.818 2.945
68 HG12 VAL 17 2HG1 VAL 17 -13.329 -2.179 1.774
69 HG13 VAL 17 3HG1 VAL 17 -13.750 -1.784 3.442
70 HG21 VAL 17 3HG2 VAL 17 -12.160 1.257 0.949
71 HG22 VAL 17 1HG2 VAL 17 -12.428 -0.349 0.272
72 HG23 VAL 17 2HG2 VAL 17 -11.159 -0.099 1.473
73 H TYR 18 H TYR 18 -16.329 -1.428 1.306
74 HA TYR 18 HA TYR 18 -17.583 -1.255 3.952
75 HD1 TYR 18 HD2 TYR 18 -18.192 -0.614 -0.049
76 HD2 TYR 18 HD1 TYR 18 -20.425 -0.155 3.539
77 HE1 TYR 18 HE2 TYR 18 -18.990 1.576 -0.831
78 HE2 TYR 18 HE1 TYR 18 -21.231 2.031 2.774
79 HH TYR 18 HH TYR 18 -20.606 3.781 1.241
80 HB2 TYR 18 2HB TYR 18 -18.647 -2.519 1.411
81 HB3 TYR 18 1HB TYR 18 -19.533 -2.308 2.918
82 H HIS 19 H HIS 19 -18.620 -3.484 4.585
83 HA HIS 19 HA HIS 19 -16.595 -5.281 5.191
84 HD1 HIS 19 HD1 HIS 19 -20.027 -7.882 4.113
85 HD2 HIS 19 HD2 HIS 19 -20.889 -3.960 5.210
86 HE1 HIS 19 HE1 HIS 19 -22.360 -7.432 3.275
87 HE2 HIS 19 HE2 HIS 19 -22.772 -4.996 3.774
88 HB2 HIS 19 2HB HIS 19 -18.365 -6.887 5.798
89 HB3 HIS 19 1HB HIS 19 -18.693 -5.276 6.417
90 H ALA 20 H ALA 20 -18.453 -5.019 2.295
91 HA ALA 20 HA ALA 20 -18.220 -7.573 1.207
92 HB1 ALA 20 3HB ALA 20 -18.158 -4.939 -0.258
93 HB2 ALA 20 1HB ALA 20 -19.618 -5.771 0.282
94 HB3 ALA 20 2HB ALA 20 -18.584 -6.511 -0.941
95 H GLU 21 H GLU 21 -15.975 -4.845 1.140
96 HA GLU 21 HA GLU 21 -13.991 -6.570 -0.181
97 HB2 GLU 21 2HB GLU 21 -13.252 -4.525 -1.440
98 HB3 GLU 21 1HB GLU 21 -14.830 -5.147 -1.897
99 HG2 GLU 21 2HG GLU 21 -15.409 -3.284 0.062
100 HG3 GLU 21 1HG GLU 21 -14.087 -2.553 -0.826
101 H GLU 22 H GLU 22 -14.175 -6.191 2.551
102 HA GLU 22 HA GLU 22 -12.255 -4.098 3.262
103 HB2 GLU 22 2HB GLU 22 -14.356 -4.129 4.499
104 HB3 GLU 22 1HB GLU 22 -14.076 -5.797 4.975
105 HG2 GLU 22 2HG GLU 22 -11.932 -4.913 6.071
106 HG3 GLU 22 1HG GLU 22 -12.668 -3.319 5.888
107 H ILE 23 H ILE 23 -10.183 -4.686 3.373
108 HA ILE 23 HA ILE 23 -9.569 -7.210 4.765
109 HB ILE 23 HB ILE 23 -8.062 -5.731 2.641
110 HG12 ILE 23 2HG1 ILE 23 -8.345 -8.676 3.252
111 HG13 ILE 23 1HG1 ILE 23 -9.404 -7.784 2.158
112 HG21 ILE 23 1HG2 ILE 23 -5.981 -6.884 3.252
113 HG22 ILE 23 2HG2 ILE 23 -6.750 -7.476 4.724
114 HG23 ILE 23 3HG2 ILE 23 -6.492 -5.746 4.499
115 HD11 ILE 23 3HD1 ILE 23 -7.775 -8.997 0.887
116 HD12 ILE 23 1HD1 ILE 23 -6.456 -8.306 1.831
117 HD13 ILE 23 2HD1 ILE 23 -7.409 -7.275 0.765
118 H GLN 24 H GLN 24 -8.908 -6.998 6.788
119 HA GLN 24 HA GLN 24 -8.091 -4.377 7.755
120 HB2 GLN 24 2HB GLN 24 -8.556 -6.982 9.223
121 HB3 GLN 24 1HB GLN 24 -8.178 -5.442 9.982
122 HG2 GLN 24 2HG GLN 24 -10.590 -5.844 8.245
123 HG3 GLN 24 1HG GLN 24 -10.600 -6.143 9.982
124 HE21 GLN 24 1HE2 GLN 24 -12.150 -4.525 10.261
125 HE22 GLN 24 2HE2 GLN 24 -11.734 -2.851 10.198
126 H CYS 25 H CYS 25 -6.025 -3.935 7.259
127 HA CYS 25 HA CYS 25 -4.012 -6.034 7.603
128 HG CYS 25 HG CYS 25 -1.611 -5.113 4.907
129 HB2 CYS 25 2HB CYS 25 -4.074 -4.705 5.472
130 HB3 CYS 25 1HB CYS 25 -3.665 -3.275 6.407
131 H ASN 26 H ASN 26 -3.561 -6.174 9.692
132 HA ASN 26 HA ASN 26 -2.755 -5.720 11.743
133 HB2 ASN 26 2HB ASN 26 -0.902 -4.620 10.515
134 HB3 ASN 26 1HB ASN 26 -1.788 -3.099 10.591
135 HD21 ASN 26 1HD2 ASN 26 -0.184 -2.081 11.798
136 HD22 ASN 26 2HD2 ASN 26 0.096 -2.471 13.463
137 H GLY 27 H GLY 27 -3.615 -2.402 10.770
138 HA2 GLY 27 2HA GLY 27 -5.859 -2.486 12.650
139 HA3 GLY 27 1HA GLY 27 -4.594 -1.300 12.934
140 H ARG 28 H ARG 28 -4.962 -1.865 9.641
141 HA ARG 28 HA ARG 28 -6.788 0.433 9.410
142 HE ARG 28 HE ARG 28 -6.242 2.791 7.952
143 HB2 ARG 28 2HB ARG 28 -4.327 -0.155 7.767
144 HB3 ARG 28 1HB ARG 28 -5.510 1.077 7.358
145 HG2 ARG 28 2HG ARG 28 -3.711 0.996 9.767
146 HG3 ARG 28 1HG ARG 28 -3.656 2.132 8.417
147 HD2 ARG 28 2HD ARG 28 -5.794 1.883 10.524
148 HD3 ARG 28 1HD ARG 28 -4.686 3.231 10.276
149 HH11 ARG 28 1HH1 ARG 28 -6.425 4.121 11.183
150 HH12 ARG 28 2HH1 ARG 28 -7.758 5.177 10.815
151 HH21 ARG 28 1HH2 ARG 28 -7.996 4.165 7.451
152 HH22 ARG 28 2HH2 ARG 28 -8.633 5.229 8.678
153 H SER 29 H SER 29 -8.413 0.274 7.978
154 HA SER 29 HA SER 29 -8.850 -2.280 6.690
155 HG SER 29 HG SER 29 -10.325 -1.807 8.610
156 HB2 SER 29 2HB SER 29 -10.624 0.164 6.594
157 HB3 SER 29 1HB SER 29 -11.090 -1.521 6.355
158 H PHE 30 H PHE 30 -8.531 -2.684 4.586
159 HA PHE 30 HA PHE 30 -8.343 -0.413 2.711
160 HD1 PHE 30 HD2 PHE 30 -5.972 0.785 2.161
161 HD2 PHE 30 HD1 PHE 30 -5.210 -2.551 4.688
162 HE1 PHE 30 HE2 PHE 30 -4.335 2.121 3.419
163 HE2 PHE 30 HE1 PHE 30 -3.569 -1.224 5.953
164 HZ PHE 30 HZ PHE 30 -3.129 1.115 5.319
165 HB2 PHE 30 2HB PHE 30 -6.516 -2.827 2.782
166 HB3 PHE 30 1HB PHE 30 -6.525 -1.610 1.513
167 H HIS 31 H HIS 31 -8.589 -1.145 0.410
168 HA HIS 31 HA HIS 31 -10.774 -2.922 0.034
169 HD2 HIS 31 HD2 HIS 31 -12.651 -2.725 -1.978
170 HE1 HIS 31 HE1 HIS 31 -12.515 1.440 -2.685
171 HE2 HIS 31 HE2 HIS 31 -14.027 -0.580 -2.473
172 HB2 HIS 31 2HB HIS 31 -8.937 -1.384 -1.714
173 HB3 HIS 31 1HB HIS 31 -9.646 -2.827 -2.431
174 H LYS 32 H LYS 32 -10.803 -5.030 -0.678
175 HA LYS 32 HA LYS 32 -8.582 -6.719 -0.306
176 HB2 LYS 32 2HB LYS 32 -11.025 -7.385 -0.350
177 HB3 LYS 32 1HB LYS 32 -10.954 -7.247 -2.101
178 HG2 LYS 32 2HG LYS 32 -9.391 -9.034 -2.257
179 HG3 LYS 32 1HG LYS 32 -9.174 -9.068 -0.506
180 HD2 LYS 32 2HD LYS 32 -11.560 -9.692 -0.266
181 HD3 LYS 32 1HD LYS 32 -11.686 -9.762 -2.026
182 HE2 LYS 32 2HE LYS 32 -10.057 -11.538 -2.111
183 HE3 LYS 32 1HE LYS 32 -9.781 -11.413 -0.374
184 HZ1 LYS 32 3HZ LYS 32 -12.070 -12.093 0.001
185 HZ2 LYS 32 1HZ LYS 32 -11.235 -13.259 -0.901
186 HZ3 LYS 32 2HZ LYS 32 -12.331 -12.220 -1.667
187 H THR 33 H THR 33 -9.693 -4.801 -2.960
188 HA THR 33 HA THR 33 -7.953 -5.998 -4.918
189 HB THR 33 HB THR 33 -8.719 -4.024 -6.310
190 HG1 THR 33 HG1 THR 33 -9.455 -2.474 -5.018
191 HG21 THR 33 3HG2 THR 33 -10.820 -5.813 -5.079
192 HG22 THR 33 1HG2 THR 33 -9.826 -6.182 -6.488
193 HG23 THR 33 2HG2 THR 33 -11.022 -4.887 -6.566
194 H CYS 34 H CYS 34 -7.754 -3.490 -2.564
195 HA CYS 34 HA CYS 34 -5.394 -2.330 -3.877
196 HB2 CYS 34 2HB CYS 34 -7.061 -1.152 -1.642
197 HB3 CYS 34 1HB CYS 34 -5.789 -0.341 -2.556
198 H PHE 35 H PHE 35 -5.430 -4.809 -2.359
199 HA PHE 35 HA PHE 35 -4.121 -4.190 0.152
200 HD1 PHE 35 HD2 PHE 35 -4.441 -5.266 2.209
201 HD2 PHE 35 HD1 PHE 35 -3.446 -8.578 -0.270
202 HE1 PHE 35 HE2 PHE 35 -3.317 -6.347 4.111
203 HE2 PHE 35 HE1 PHE 35 -2.314 -9.662 1.626
204 HZ PHE 35 HZ PHE 35 -2.249 -8.530 3.819
205 HB2 PHE 35 2HB PHE 35 -5.747 -6.055 -0.048
206 HB3 PHE 35 1HB PHE 35 -4.651 -6.864 -1.162
207 H HIS 36 H HIS 36 -3.061 -3.939 -2.824
208 HA HIS 36 HA HIS 36 -0.600 -5.460 -2.524
209 HD1 HIS 36 HD1 HIS 36 -3.638 -4.711 -5.701
210 HD2 HIS 36 HD2 HIS 36 -0.685 -1.848 -5.101
211 HE1 HIS 36 HE1 HIS 36 -4.517 -2.605 -6.746
212 HE2 HIS 36 HE2 HIS 36 -2.832 -0.832 -6.154
213 HB2 HIS 36 2HB HIS 36 -0.130 -4.718 -4.861
214 HB3 HIS 36 1HB HIS 36 -1.603 -5.661 -4.681
215 H CYS 37 H CYS 37 1.386 -4.155 -3.545
216 HA CYS 37 HA CYS 37 2.218 -2.593 -1.404
217 HB2 CYS 37 2HB CYS 37 3.678 -3.847 -3.026
218 HB3 CYS 37 1HB CYS 37 3.427 -2.535 -4.171
219 H MET 38 H MET 38 2.037 -0.564 -0.871
220 HA MET 38 HA MET 38 0.570 1.289 -2.472
221 HB2 MET 38 2HB MET 38 2.088 1.697 0.108
222 HB3 MET 38 1HB MET 38 1.000 2.871 -0.623
223 HG2 MET 38 2HG MET 38 0.254 0.134 0.379
224 HG3 MET 38 1HG MET 38 -0.106 1.670 1.169
225 HE1 MET 38 3HE MET 38 -2.669 0.817 1.293
226 HE2 MET 38 1HE MET 38 -2.227 -0.655 0.428
227 HE3 MET 38 2HE MET 38 -3.589 0.319 -0.127
228 H ALA 39 H ALA 39 3.805 0.362 -2.455
229 HA ALA 39 HA ALA 39 4.742 3.017 -3.263
230 HB1 ALA 39 3HB ALA 39 6.986 2.157 -2.985
231 HB2 ALA 39 1HB ALA 39 6.353 0.542 -2.676
232 HB3 ALA 39 2HB ALA 39 6.027 1.851 -1.538
233 H CYS 40 H CYS 40 5.318 -0.338 -4.402
234 HA CYS 40 HA CYS 40 5.888 0.796 -7.046
235 HB2 CYS 40 2HB CYS 40 7.037 -1.290 -7.529
236 HB3 CYS 40 1HB CYS 40 7.617 -0.636 -6.000
237 H ARG 41 H ARG 41 3.368 -0.584 -5.436
238 HA ARG 41 HA ARG 41 1.345 -1.368 -6.065
239 HE ARG 41 HE ARG 41 -1.106 2.243 -7.168
240 HB2 ARG 41 2HB ARG 41 2.332 -0.128 -8.484
241 HB3 ARG 41 1HB ARG 41 1.316 -1.517 -8.850
242 HG2 ARG 41 2HG ARG 41 0.116 0.672 -8.715
243 HG3 ARG 41 1HG ARG 41 -0.520 -0.598 -7.669
244 HD2 ARG 41 2HD ARG 41 0.683 0.363 -5.768
245 HD3 ARG 41 1HD ARG 41 1.327 1.628 -6.816
246 HH11 ARG 41 1HH1 ARG 41 -0.001 0.685 -4.225
247 HH12 ARG 41 2HH1 ARG 41 -1.196 1.454 -3.225
248 HH21 ARG 41 1HH2 ARG 41 -2.663 3.245 -5.864
249 HH22 ARG 41 2HH2 ARG 41 -2.694 2.935 -4.152
250 H LYS 42 H LYS 42 3.984 -3.004 -6.133
251 HA LYS 42 HA LYS 42 3.501 -5.358 -7.567
252 HB2 LYS 42 2HB LYS 42 5.599 -4.939 -6.372
253 HB3 LYS 42 1HB LYS 42 4.752 -4.968 -4.833
254 HG2 LYS 42 2HG LYS 42 5.956 -7.031 -5.187
255 HG3 LYS 42 1HG LYS 42 4.217 -7.327 -5.178
256 HD2 LYS 42 2HD LYS 42 4.192 -7.403 -7.603
257 HD3 LYS 42 1HD LYS 42 5.917 -7.031 -7.648
258 HE2 LYS 42 2HE LYS 42 6.428 -9.108 -6.522
259 HE3 LYS 42 1HE LYS 42 4.710 -9.469 -6.350
260 HZ1 LYS 42 3HZ LYS 42 4.510 -9.618 -8.729
261 HZ2 LYS 42 1HZ LYS 42 5.745 -10.659 -8.209
262 HZ3 LYS 42 2HZ LYS 42 6.134 -9.176 -8.939
263 H ALA 43 H ALA 43 2.072 -7.017 -7.280
264 HA ALA 43 HA ALA 43 -0.140 -6.611 -5.542
265 HB1 ALA 43 3HB ALA 43 -0.918 -8.786 -6.370
266 HB2 ALA 43 1HB ALA 43 0.656 -9.061 -7.118
267 HB3 ALA 43 2HB ALA 43 -0.375 -7.750 -7.690
268 H LEU 44 H LEU 44 -0.491 -7.371 -3.503
269 HA LEU 44 HA LEU 44 1.660 -9.012 -2.334
270 HG LEU 44 HG LEU 44 2.159 -6.460 0.176
271 HB2 LEU 44 2HB LEU 44 0.155 -6.686 -1.325
272 HB3 LEU 44 1HB LEU 44 0.399 -7.978 -0.167
273 HD11 LEU 44 1HD1 LEU 44 3.206 -8.688 -1.560
274 HD12 LEU 44 2HD1 LEU 44 2.870 -8.780 0.170
275 HD13 LEU 44 3HD1 LEU 44 4.158 -7.730 -0.426
276 HD21 LEU 44 3HD2 LEU 44 2.652 -6.524 -2.798
277 HD22 LEU 44 1HD2 LEU 44 3.628 -5.657 -1.608
278 HD23 LEU 44 2HD2 LEU 44 1.950 -5.188 -1.885
279 H ASP 45 H ASP 45 1.198 -10.688 -0.989
280 HA ASP 45 HA ASP 45 -1.637 -11.432 -0.692
281 HB2 ASP 45 2HB ASP 45 -0.429 -13.095 -2.020
282 HB3 ASP 45 1HB ASP 45 0.818 -13.210 -0.783
283 H SER 46 H SER 46 -2.108 -12.531 1.427
284 HA SER 46 HA SER 46 -1.289 -11.020 3.605
285 HG SER 46 HG SER 46 -3.834 -12.783 2.609
286 HB2 SER 46 2HB SER 46 -2.278 -13.878 3.664
287 HB3 SER 46 1HB SER 46 -2.338 -12.725 4.997
288 H THR 47 H THR 47 0.217 -13.793 2.158
289 HA THR 47 HA THR 47 1.892 -14.439 4.393
290 HB THR 47 HB THR 47 2.441 -15.246 1.548
291 HG1 THR 47 HG1 THR 47 0.288 -15.732 1.732
292 HG21 THR 47 3HG2 THR 47 2.759 -16.655 4.198
293 HG22 THR 47 1HG2 THR 47 4.050 -15.920 3.251
294 HG23 THR 47 2HG2 THR 47 3.186 -17.322 2.622
295 H THR 48 H THR 48 2.123 -12.202 1.727
296 HA THR 48 HA THR 48 5.050 -12.128 2.017
297 HB THR 48 HB THR 48 4.985 -11.065 -0.290
298 HG1 THR 48 HG1 THR 48 3.079 -11.438 -1.487
299 HG21 THR 48 3HG2 THR 48 5.670 -13.380 0.073
300 HG22 THR 48 1HG2 THR 48 4.746 -13.230 -1.421
301 HG23 THR 48 2HG2 THR 48 3.986 -13.898 0.024
302 H VAL 49 H VAL 49 2.224 -10.193 2.431
303 HA VAL 49 HA VAL 49 3.377 -7.675 1.849
304 HB VAL 49 HB VAL 49 1.031 -7.714 1.828
305 HG11 VAL 49 1HG1 VAL 49 1.122 -8.719 4.674
306 HG12 VAL 49 2HG1 VAL 49 0.666 -9.660 3.253
307 HG13 VAL 49 3HG1 VAL 49 -0.343 -8.312 3.780
308 HG21 VAL 49 3HG2 VAL 49 0.371 -5.999 3.419
309 HG22 VAL 49 1HG2 VAL 49 1.957 -5.647 2.735
310 HG23 VAL 49 2HG2 VAL 49 1.825 -6.302 4.367
311 H ALA 50 H ALA 50 4.524 -6.274 2.985
312 HA ALA 50 HA ALA 50 5.173 -6.935 5.772
313 HB1 ALA 50 3HB ALA 50 7.086 -6.705 4.231
314 HB2 ALA 50 1HB ALA 50 7.110 -5.487 5.508
315 HB3 ALA 50 2HB ALA 50 6.586 -5.048 3.883
316 H ALA 51 H ALA 51 3.721 -5.975 7.058
317 HA ALA 51 HA ALA 51 2.823 -3.272 6.486
318 HB1 ALA 51 3HB ALA 51 1.263 -3.619 8.330
319 HB2 ALA 51 1HB ALA 51 2.011 -5.176 8.682
320 HB3 ALA 51 2HB ALA 51 1.157 -4.932 7.158
321 H HIS 52 H HIS 52 3.629 -1.539 7.454
322 HA HIS 52 HA HIS 52 5.356 -1.940 9.807
323 HD1 HIS 52 HD1 HIS 52 8.437 -1.090 9.653
324 HD2 HIS 52 HD2 HIS 52 5.953 2.249 9.681
325 HE1 HIS 52 HE1 HIS 52 9.527 0.559 11.215
326 HE2 HIS 52 HE2 HIS 52 7.854 2.435 11.417
327 HB2 HIS 52 2HB HIS 52 6.616 -1.141 7.841
328 HB3 HIS 52 1HB HIS 52 5.543 0.251 7.719
329 H GLU 53 H GLU 53 3.832 -1.660 11.361
330 HA GLU 53 HA GLU 53 2.562 -0.562 12.869
331 HB2 GLU 53 2HB GLU 53 3.704 1.938 11.612
332 HB3 GLU 53 1HB GLU 53 2.933 1.827 13.190
333 HG2 GLU 53 2HG GLU 53 4.699 0.284 13.924
334 HG3 GLU 53 1HG GLU 53 5.489 0.470 12.360
335 H SER 54 H SER 54 2.230 1.932 10.339
336 HA SER 54 HA SER 54 -0.592 1.127 10.112
337 HG SER 54 HG SER 54 1.540 3.797 9.998
338 HB2 SER 54 2HB SER 54 -1.131 3.582 9.838
339 HB3 SER 54 1HB SER 54 -0.620 3.103 11.455
340 H GLU 55 H GLU 55 1.766 0.521 8.491
341 HA GLU 55 HA GLU 55 0.791 1.569 5.922
342 HB2 GLU 55 2HB GLU 55 3.676 1.336 6.784
343 HB3 GLU 55 1HB GLU 55 3.153 1.669 5.140
344 HG2 GLU 55 2HG GLU 55 2.252 3.771 5.761
345 HG3 GLU 55 1HG GLU 55 2.442 3.410 7.479
346 H ILE 56 H ILE 56 1.490 0.225 4.074
347 HA ILE 56 HA ILE 56 2.320 -2.490 4.693
348 HB ILE 56 HB ILE 56 0.204 -3.242 4.687
349 HG12 ILE 56 2HG1 ILE 56 0.408 -2.604 1.738
350 HG13 ILE 56 1HG1 ILE 56 0.964 -4.078 2.528
351 HG21 ILE 56 1HG2 ILE 56 -1.742 -1.993 3.891
352 HG22 ILE 56 2HG2 ILE 56 -0.668 -0.761 3.226
353 HG23 ILE 56 3HG2 ILE 56 -0.728 -1.034 4.968
354 HD11 ILE 56 3HD1 ILE 56 -1.340 -4.639 3.101
355 HD12 ILE 56 1HD1 ILE 56 -1.137 -4.433 1.360
356 HD13 ILE 56 2HD1 ILE 56 -1.896 -3.160 2.316
357 H TYR 57 H TYR 57 3.736 -3.184 3.238
358 HA TYR 57 HA TYR 57 3.580 -2.274 0.471
359 HD1 TYR 57 HD1 TYR 57 5.320 -0.608 3.837
360 HD2 TYR 57 HD2 TYR 57 4.934 0.458 -0.261
361 HE1 TYR 57 HE1 TYR 57 4.847 1.705 4.493
362 HE2 TYR 57 HE2 TYR 57 4.455 2.782 0.385
363 HH TYR 57 HH TYR 57 4.719 3.863 3.736
364 HB2 TYR 57 2HB TYR 57 6.147 -2.059 2.070
365 HB3 TYR 57 1HB TYR 57 5.935 -1.637 0.378
366 H CYS 58 H CYS 58 5.330 -3.425 -0.849
367 HA CYS 58 HA CYS 58 5.449 -6.206 -0.140
368 HB2 CYS 58 2HB CYS 58 6.501 -6.535 -2.235
369 HB3 CYS 58 1HB CYS 58 5.363 -5.222 -2.510
370 H LYS 59 H LYS 59 7.580 -7.337 -0.015
371 HA LYS 59 HA LYS 59 9.139 -6.101 2.026
372 HB2 LYS 59 2HB LYS 59 9.499 -8.709 0.552
373 HB3 LYS 59 1HB LYS 59 10.479 -8.203 1.923
374 HG2 LYS 59 2HG LYS 59 8.494 -8.149 3.336
375 HG3 LYS 59 1HG LYS 59 7.494 -8.623 1.964
376 HD2 LYS 59 2HD LYS 59 9.739 -10.262 3.134
377 HD3 LYS 59 1HD LYS 59 8.022 -10.517 3.449
378 HE2 LYS 59 2HE LYS 59 7.659 -10.921 1.053
379 HE3 LYS 59 1HE LYS 59 9.383 -10.696 0.761
380 HZ1 LYS 59 3HZ LYS 59 9.806 -12.591 2.245
381 HZ2 LYS 59 1HZ LYS 59 8.878 -13.027 0.890
382 HZ3 LYS 59 2HZ LYS 59 8.134 -12.834 2.402
383 H VAL 60 H VAL 60 9.231 -5.835 -1.291
384 HA VAL 60 HA VAL 60 12.086 -5.571 -1.582
385 HB VAL 60 HB VAL 60 9.875 -4.714 -3.462
386 HG11 VAL 60 1HG1 VAL 60 11.620 -4.665 -5.168
387 HG12 VAL 60 2HG1 VAL 60 12.832 -5.064 -3.950
388 HG13 VAL 60 3HG1 VAL 60 11.970 -3.526 -3.870
389 HG21 VAL 60 3HG2 VAL 60 10.407 -6.761 -4.693
390 HG22 VAL 60 1HG2 VAL 60 9.849 -7.117 -3.058
391 HG23 VAL 60 2HG2 VAL 60 11.567 -7.213 -3.445
392 H CYS 61 H CYS 61 9.305 -3.330 -1.668
393 HA CYS 61 HA CYS 61 10.913 -0.992 -1.604
394 HB2 CYS 61 2HB CYS 61 8.017 -1.358 -0.827
395 HB3 CYS 61 1HB CYS 61 8.817 0.193 -1.059
396 H TYR 62 H TYR 62 9.479 -3.011 0.885
397 HA TYR 62 HA TYR 62 10.035 -1.320 3.077
398 HD1 TYR 62 HD1 TYR 62 11.381 -4.141 5.325
399 HD2 TYR 62 HD2 TYR 62 7.633 -2.186 4.822
400 HE1 TYR 62 HE1 TYR 62 11.246 -3.785 7.752
401 HE2 TYR 62 HE2 TYR 62 7.493 -1.827 7.247
402 HH TYR 62 HH TYR 62 10.186 -2.414 9.357
403 HB2 TYR 62 2HB TYR 62 8.599 -3.465 3.019
404 HB3 TYR 62 1HB TYR 62 10.120 -4.331 3.225
405 H GLY 63 H GLY 63 11.931 -3.722 1.343
406 HA2 GLY 63 2HA GLY 63 14.216 -3.522 3.062
407 HA3 GLY 63 1HA GLY 63 14.159 -4.296 1.486
408 H ARG 64 H ARG 64 13.039 -1.697 0.380
409 HA ARG 64 HA ARG 64 15.587 -0.500 -0.233
410 HE ARG 64 HE ARG 64 14.192 -2.154 -4.622
411 HB2 ARG 64 2HB ARG 64 12.770 0.169 -1.101
412 HB3 ARG 64 1HB ARG 64 14.190 1.047 -1.651
413 HG2 ARG 64 2HG ARG 64 15.073 -0.966 -2.667
414 HG3 ARG 64 1HG ARG 64 13.694 -1.890 -2.067
415 HD2 ARG 64 2HD ARG 64 12.183 -0.545 -3.412
416 HD3 ARG 64 1HD ARG 64 13.534 0.438 -3.976
417 HH11 ARG 64 1HH1 ARG 64 11.528 0.008 -5.359
418 HH12 ARG 64 2HH1 ARG 64 11.273 -0.652 -6.943
419 HH21 ARG 64 1HH2 ARG 64 13.834 -3.031 -6.704
420 HH22 ARG 64 2HH2 ARG 64 12.578 -2.366 -7.711
421 H ARG 65 H ARG 65 12.568 0.609 1.269
422 HA ARG 65 HA ARG 65 13.512 3.177 1.946
423 HE ARG 65 HE ARG 65 10.355 5.082 5.542
424 HB2 ARG 65 2HB ARG 65 11.137 2.691 1.856
425 HB3 ARG 65 1HB ARG 65 11.290 1.515 3.153
426 HG2 ARG 65 2HG ARG 65 11.864 3.284 4.718
427 HG3 ARG 65 1HG ARG 65 11.777 4.478 3.421
428 HD2 ARG 65 2HD ARG 65 9.430 4.076 3.127
429 HD3 ARG 65 1HD ARG 65 9.475 2.721 4.253
430 HH11 ARG 65 1HH1 ARG 65 7.454 3.552 4.333
431 HH12 ARG 65 2HH1 ARG 65 6.392 4.338 5.461
432 HH21 ARG 65 1HH2 ARG 65 8.982 6.127 7.035
433 HH22 ARG 65 2HH2 ARG 65 7.273 5.811 7.010
434 H TYR 66 H TYR 66 13.301 0.180 3.847
435 HA TYR 66 HA TYR 66 14.816 1.487 5.993
436 HD1 TYR 66 HD1 TYR 66 13.338 1.748 8.339
437 HD2 TYR 66 HD2 TYR 66 11.086 -0.412 5.445
438 HE1 TYR 66 HE1 TYR 66 11.329 3.018 8.964
439 HE2 TYR 66 HE2 TYR 66 9.071 0.854 6.062
440 HH TYR 66 HH TYR 66 9.179 3.659 7.970
441 HB2 TYR 66 2HB TYR 66 13.273 -1.113 5.980
442 HB3 TYR 66 1HB TYR 66 14.126 -0.453 7.371
Start of MODEL 4
1 H1 GLY 7 1H GLY 7 -20.237 0.393 7.527
2 HA2 GLY 7 2HA GLY 7 -19.261 0.962 4.829
3 HA3 GLY 7 1HA GLY 7 -20.434 1.910 5.733
4 H ALA 8 H ALA 8 -17.030 1.058 5.526
5 HA ALA 8 HA ALA 8 -16.349 3.464 7.085
6 HB1 ALA 8 3HB ALA 8 -15.475 1.359 7.980
7 HB2 ALA 8 1HB ALA 8 -14.166 2.405 7.431
8 HB3 ALA 8 2HB ALA 8 -14.672 1.034 6.443
9 H LYS 9 H LYS 9 -13.826 3.984 6.269
10 HA LYS 9 HA LYS 9 -14.028 4.279 3.347
11 HB2 LYS 9 2HB LYS 9 -12.785 6.368 3.495
12 HB3 LYS 9 1HB LYS 9 -14.252 6.472 4.456
13 HG2 LYS 9 2HG LYS 9 -13.055 6.305 6.485
14 HG3 LYS 9 1HG LYS 9 -11.579 5.807 5.655
15 HD2 LYS 9 2HD LYS 9 -12.900 8.502 5.358
16 HD3 LYS 9 1HD LYS 9 -11.515 8.164 6.398
17 HE2 LYS 9 2HE LYS 9 -10.181 7.536 4.474
18 HE3 LYS 9 1HE LYS 9 -11.568 7.750 3.406
19 HZ1 LYS 9 3HZ LYS 9 -11.577 10.086 3.876
20 HZ2 LYS 9 1HZ LYS 9 -10.018 9.644 3.374
21 HZ3 LYS 9 2HZ LYS 9 -10.343 9.925 5.019
22 H CYS 10 H CYS 10 -12.249 3.724 2.182
23 HA CYS 10 HA CYS 10 -10.504 1.850 3.135
24 HB2 CYS 10 2HB CYS 10 -11.064 2.372 0.750
25 HB3 CYS 10 1HB CYS 10 -9.987 3.759 0.858
26 H GLY 11 H GLY 11 -8.690 1.880 4.241
27 HA2 GLY 11 2HA GLY 11 -7.454 4.347 5.076
28 HA3 GLY 11 1HA GLY 11 -6.891 2.720 5.438
29 H ALA 12 H ALA 12 -7.561 3.696 2.188
30 HA ALA 12 HA ALA 12 -4.807 4.429 1.628
31 HB1 ALA 12 3HB ALA 12 -4.573 2.832 -0.196
32 HB2 ALA 12 1HB ALA 12 -6.157 2.149 0.179
33 HB3 ALA 12 2HB ALA 12 -4.831 1.990 1.331
34 H CYS 13 H CYS 13 -7.820 3.504 -0.031
35 HA CYS 13 HA CYS 13 -7.620 5.750 -1.850
36 HB2 CYS 13 2HB CYS 13 -10.045 3.996 -1.469
37 HB3 CYS 13 1HB CYS 13 -9.559 4.881 -2.905
38 H GLU 14 H GLU 14 -9.299 7.394 -1.991
39 HA GLU 14 HA GLU 14 -10.611 7.995 0.536
40 HB2 GLU 14 2HB GLU 14 -10.333 9.482 -2.068
41 HB3 GLU 14 1HB GLU 14 -11.495 9.982 -0.857
42 HG2 GLU 14 2HG GLU 14 -8.556 9.734 -0.411
43 HG3 GLU 14 1HG GLU 14 -9.416 11.237 -0.712
44 H LYS 15 H LYS 15 -11.238 5.660 -1.099
45 HA LYS 15 HA LYS 15 -13.997 6.162 -1.934
46 HB2 LYS 15 2HB LYS 15 -12.386 3.622 -2.239
47 HB3 LYS 15 1HB LYS 15 -13.905 4.012 -3.027
48 HG2 LYS 15 2HG LYS 15 -11.228 5.295 -3.535
49 HG3 LYS 15 1HG LYS 15 -12.091 4.189 -4.601
50 HD2 LYS 15 2HD LYS 15 -13.952 5.908 -4.652
51 HD3 LYS 15 1HD LYS 15 -12.827 7.012 -3.860
52 HE2 LYS 15 2HE LYS 15 -12.445 5.668 -6.532
53 HE3 LYS 15 1HE LYS 15 -12.808 7.369 -6.261
54 HZ1 LYS 15 3HZ LYS 15 -10.454 6.952 -6.727
55 HZ2 LYS 15 1HZ LYS 15 -10.335 5.999 -5.333
56 HZ3 LYS 15 2HZ LYS 15 -10.681 7.658 -5.207
57 H THR 16 H THR 16 -15.675 4.795 -1.156
58 HA THR 16 HA THR 16 -15.470 4.266 1.647
59 HB THR 16 HB THR 16 -17.718 3.586 -0.216
60 HG1 THR 16 HG1 THR 16 -17.758 5.890 1.381
61 HG21 THR 16 3HG2 THR 16 -17.707 4.115 2.749
62 HG22 THR 16 1HG2 THR 16 -17.856 2.528 1.996
63 HG23 THR 16 2HG2 THR 16 -19.123 3.732 1.769
64 H VAL 17 H VAL 17 -15.063 2.382 2.652
65 HA VAL 17 HA VAL 17 -14.726 -0.024 1.022
66 HB VAL 17 HB VAL 17 -13.913 0.626 3.862
67 HG11 VAL 17 1HG1 VAL 17 -13.034 -1.642 4.063
68 HG12 VAL 17 2HG1 VAL 17 -13.697 -2.051 2.480
69 HG13 VAL 17 3HG1 VAL 17 -14.782 -1.677 3.820
70 HG21 VAL 17 3HG2 VAL 17 -12.436 1.400 2.086
71 HG22 VAL 17 1HG2 VAL 17 -12.365 -0.233 1.423
72 HG23 VAL 17 2HG2 VAL 17 -11.677 0.106 3.014
73 H TYR 18 H TYR 18 -15.983 -1.800 1.211
74 HA TYR 18 HA TYR 18 -18.182 -1.664 3.168
75 HD1 TYR 18 HD1 TYR 18 -20.744 -0.810 2.378
76 HD2 TYR 18 HD2 TYR 18 -18.066 -0.675 -0.924
77 HE1 TYR 18 HE1 TYR 18 -21.658 1.376 1.734
78 HE2 TYR 18 HE2 TYR 18 -18.971 1.515 -1.576
79 HH TYR 18 HH TYR 18 -21.046 2.829 -1.267
80 HB2 TYR 18 2HB TYR 18 -18.300 -2.668 0.311
81 HB3 TYR 18 1HB TYR 18 -19.590 -2.864 1.490
82 H HIS 19 H HIS 19 -19.159 -3.893 3.497
83 HA HIS 19 HA HIS 19 -17.216 -5.819 4.157
84 HD1 HIS 19 HD1 HIS 19 -20.555 -8.339 2.782
85 HD2 HIS 19 HD2 HIS 19 -21.538 -4.416 3.755
86 HE1 HIS 19 HE1 HIS 19 -22.778 -7.903 1.686
87 HE2 HIS 19 HE2 HIS 19 -23.457 -5.615 2.496
88 HB2 HIS 19 2HB HIS 19 -19.062 -7.345 4.578
89 HB3 HIS 19 1HB HIS 19 -19.463 -5.749 5.193
90 H ALA 20 H ALA 20 -18.410 -4.890 1.196
91 HA ALA 20 HA ALA 20 -18.399 -7.226 -0.332
92 HB1 ALA 20 3HB ALA 20 -18.095 -5.750 -2.243
93 HB2 ALA 20 1HB ALA 20 -17.640 -4.430 -1.167
94 HB3 ALA 20 2HB ALA 20 -19.278 -5.083 -1.119
95 H GLU 21 H GLU 21 -15.707 -4.944 0.377
96 HA GLU 21 HA GLU 21 -13.869 -7.080 -0.321
97 HB2 GLU 21 2HB GLU 21 -12.611 -5.842 -1.914
98 HB3 GLU 21 1HB GLU 21 -14.279 -5.865 -2.437
99 HG2 GLU 21 2HG GLU 21 -14.474 -3.496 -1.563
100 HG3 GLU 21 1HG GLU 21 -12.740 -3.565 -1.255
101 H GLU 22 H GLU 22 -14.188 -6.342 2.204
102 HA GLU 22 HA GLU 22 -12.224 -4.294 2.864
103 HB2 GLU 22 2HB GLU 22 -14.218 -4.248 4.200
104 HB3 GLU 22 1HB GLU 22 -14.062 -5.958 4.586
105 HG2 GLU 22 2HG GLU 22 -11.962 -5.457 5.786
106 HG3 GLU 22 1HG GLU 22 -12.222 -3.745 5.470
107 H ILE 23 H ILE 23 -10.174 -4.705 3.321
108 HA ILE 23 HA ILE 23 -9.538 -7.238 4.700
109 HB ILE 23 HB ILE 23 -7.812 -5.753 2.702
110 HG12 ILE 23 2HG1 ILE 23 -8.608 -8.657 2.700
111 HG13 ILE 23 1HG1 ILE 23 -9.559 -7.423 1.874
112 HG21 ILE 23 1HG2 ILE 23 -6.081 -7.432 3.197
113 HG22 ILE 23 2HG2 ILE 23 -7.088 -8.062 4.502
114 HG23 ILE 23 3HG2 ILE 23 -6.450 -6.419 4.594
115 HD11 ILE 23 3HD1 ILE 23 -6.687 -8.142 1.314
116 HD12 ILE 23 1HD1 ILE 23 -7.613 -6.891 0.484
117 HD13 ILE 23 2HD1 ILE 23 -8.087 -8.582 0.333
118 H GLN 24 H GLN 24 -8.978 -6.790 6.753
119 HA GLN 24 HA GLN 24 -8.022 -4.090 7.353
120 HB2 GLN 24 2HB GLN 24 -9.177 -6.267 9.085
121 HB3 GLN 24 1HB GLN 24 -8.385 -4.850 9.765
122 HG2 GLN 24 2HG GLN 24 -10.000 -3.409 8.603
123 HG3 GLN 24 1HG GLN 24 -10.811 -4.848 7.983
124 HE21 GLN 24 1HE2 GLN 24 -12.741 -4.223 9.017
125 HE22 GLN 24 2HE2 GLN 24 -12.936 -4.419 10.728
126 H CYS 25 H CYS 25 -5.926 -3.918 7.112
127 HA CYS 25 HA CYS 25 -4.192 -6.091 8.045
128 HG CYS 25 HG CYS 25 -1.307 -5.700 5.540
129 HB2 CYS 25 2HB CYS 25 -3.856 -5.360 5.718
130 HB3 CYS 25 1HB CYS 25 -3.554 -3.720 6.276
131 H ASN 26 H ASN 26 -3.728 -5.848 10.110
132 HA ASN 26 HA ASN 26 -2.758 -5.063 11.996
133 HB2 ASN 26 2HB ASN 26 -0.959 -4.248 10.512
134 HB3 ASN 26 1HB ASN 26 -1.824 -2.727 10.316
135 HD21 ASN 26 1HD2 ASN 26 -0.089 -1.572 11.160
136 HD22 ASN 26 2HD2 ASN 26 0.280 -1.563 12.851
137 H GLY 27 H GLY 27 -3.788 -2.036 10.407
138 HA2 GLY 27 2HA GLY 27 -5.932 -1.742 12.345
139 HA3 GLY 27 1HA GLY 27 -4.630 -0.571 12.489
140 H ARG 28 H ARG 28 -5.158 -1.626 9.294
141 HA ARG 28 HA ARG 28 -6.823 0.744 8.746
142 HE ARG 28 HE ARG 28 -4.100 2.602 5.703
143 HB2 ARG 28 2HB ARG 28 -4.482 -0.244 7.103
144 HB3 ARG 28 1HB ARG 28 -5.553 1.074 6.653
145 HG2 ARG 28 2HG ARG 28 -4.796 2.404 8.489
146 HG3 ARG 28 1HG ARG 28 -3.859 1.058 9.136
147 HD2 ARG 28 2HD ARG 28 -2.316 2.471 8.048
148 HD3 ARG 28 1HD ARG 28 -2.550 1.089 6.986
149 HH11 ARG 28 1HH1 ARG 28 -1.520 3.891 7.688
150 HH12 ARG 28 2HH1 ARG 28 -1.303 5.311 6.705
151 HH21 ARG 28 1HH2 ARG 28 -3.808 4.477 4.410
152 HH22 ARG 28 2HH2 ARG 28 -2.600 5.642 4.857
153 H SER 29 H SER 29 -8.492 0.439 7.363
154 HA SER 29 HA SER 29 -8.916 -2.284 6.393
155 HG SER 29 HG SER 29 -12.160 -2.195 6.611
156 HB2 SER 29 2HB SER 29 -10.692 -1.211 7.759
157 HB3 SER 29 1HB SER 29 -10.861 0.038 6.529
158 H PHE 30 H PHE 30 -8.324 -2.698 4.402
159 HA PHE 30 HA PHE 30 -8.292 -0.532 2.398
160 HD1 PHE 30 HD2 PHE 30 -5.535 0.236 1.700
161 HD2 PHE 30 HD1 PHE 30 -5.613 -2.976 4.489
162 HE1 PHE 30 HE2 PHE 30 -3.722 1.300 2.975
163 HE2 PHE 30 HE1 PHE 30 -3.804 -1.912 5.773
164 HZ PHE 30 HZ PHE 30 -2.789 0.202 4.944
165 HB2 PHE 30 2HB PHE 30 -6.763 -3.150 2.426
166 HB3 PHE 30 1HB PHE 30 -6.643 -1.905 1.194
167 H HIS 31 H HIS 31 -8.883 -1.157 0.192
168 HA HIS 31 HA HIS 31 -10.970 -3.163 0.039
169 HD2 HIS 31 HD2 HIS 31 -13.217 -1.628 -0.597
170 HE1 HIS 31 HE1 HIS 31 -12.010 2.298 -1.527
171 HE2 HIS 31 HE2 HIS 31 -13.946 0.854 -0.794
172 HB2 HIS 31 2HB HIS 31 -9.602 -1.621 -2.183
173 HB3 HIS 31 1HB HIS 31 -11.020 -2.642 -2.375
174 H LYS 32 H LYS 32 -10.850 -5.014 -1.432
175 HA LYS 32 HA LYS 32 -8.392 -6.427 -1.336
176 HB2 LYS 32 2HB LYS 32 -10.831 -6.939 -3.051
177 HB3 LYS 32 1HB LYS 32 -9.493 -8.058 -2.838
178 HG2 LYS 32 2HG LYS 32 -10.029 -8.009 -0.367
179 HG3 LYS 32 1HG LYS 32 -11.510 -7.169 -0.801
180 HD2 LYS 32 2HD LYS 32 -10.668 -9.876 -1.824
181 HD3 LYS 32 1HD LYS 32 -11.856 -9.587 -0.551
182 HE2 LYS 32 2HE LYS 32 -13.189 -8.289 -2.164
183 HE3 LYS 32 1HE LYS 32 -12.041 -8.719 -3.429
184 HZ1 LYS 32 3HZ LYS 32 -12.559 -11.088 -2.941
185 HZ2 LYS 32 1HZ LYS 32 -13.879 -10.215 -3.550
186 HZ3 LYS 32 2HZ LYS 32 -13.793 -10.571 -1.896
187 H THR 33 H THR 33 -9.789 -4.216 -3.591
188 HA THR 33 HA THR 33 -8.237 -4.912 -5.863
189 HB THR 33 HB THR 33 -9.455 -2.213 -5.256
190 HG1 THR 33 HG1 THR 33 -11.100 -3.733 -5.051
191 HG21 THR 33 3HG2 THR 33 -7.953 -2.258 -7.189
192 HG22 THR 33 1HG2 THR 33 -9.626 -2.041 -7.701
193 HG23 THR 33 2HG2 THR 33 -8.849 -3.615 -7.866
194 H CYS 34 H CYS 34 -7.805 -2.525 -3.264
195 HA CYS 34 HA CYS 34 -5.438 -1.441 -4.560
196 HB2 CYS 34 2HB CYS 34 -5.579 0.086 -2.471
197 HB3 CYS 34 1HB CYS 34 -6.843 0.230 -3.696
198 H PHE 35 H PHE 35 -6.127 -3.890 -2.358
199 HA PHE 35 HA PHE 35 -4.035 -3.547 -0.476
200 HD1 PHE 35 HD2 PHE 35 -4.845 -4.443 2.006
201 HD2 PHE 35 HD1 PHE 35 -3.886 -7.742 -0.500
202 HE1 PHE 35 HE2 PHE 35 -3.694 -5.532 3.887
203 HE2 PHE 35 HE1 PHE 35 -2.733 -8.841 1.376
204 HZ PHE 35 HZ PHE 35 -2.644 -7.736 3.572
205 HB2 PHE 35 2HB PHE 35 -6.090 -4.943 -0.133
206 HB3 PHE 35 1HB PHE 35 -5.414 -6.126 -1.242
207 H HIS 36 H HIS 36 -2.309 -3.052 -1.971
208 HA HIS 36 HA HIS 36 -0.586 -5.292 -2.207
209 HD1 HIS 36 HD1 HIS 36 -3.664 -4.562 -5.225
210 HD2 HIS 36 HD2 HIS 36 -0.195 -2.312 -5.640
211 HE1 HIS 36 HE1 HIS 36 -4.271 -2.670 -6.746
212 HE2 HIS 36 HE2 HIS 36 -2.108 -1.477 -7.178
213 HB2 HIS 36 2HB HIS 36 -0.078 -5.007 -4.645
214 HB3 HIS 36 1HB HIS 36 -1.648 -5.715 -4.302
215 H CYS 37 H CYS 37 1.515 -4.360 -3.531
216 HA CYS 37 HA CYS 37 2.550 -2.641 -1.596
217 HB2 CYS 37 2HB CYS 37 3.837 -4.242 -3.060
218 HB3 CYS 37 1HB CYS 37 3.722 -3.041 -4.343
219 H MET 38 H MET 38 2.361 -0.601 -1.294
220 HA MET 38 HA MET 38 1.188 1.193 -3.186
221 HB2 MET 38 2HB MET 38 2.492 1.720 -0.504
222 HB3 MET 38 1HB MET 38 1.537 2.882 -1.418
223 HG2 MET 38 2HG MET 38 0.476 0.240 -0.457
224 HG3 MET 38 1HG MET 38 0.326 1.742 0.450
225 HE1 MET 38 3HE MET 38 -2.349 1.190 0.475
226 HE2 MET 38 1HE MET 38 -2.067 -0.229 -0.531
227 HE3 MET 38 2HE MET 38 -3.287 0.953 -1.001
228 H ALA 39 H ALA 39 4.320 0.051 -2.741
229 HA ALA 39 HA ALA 39 5.609 2.554 -3.484
230 HB1 ALA 39 3HB ALA 39 7.705 1.413 -3.067
231 HB2 ALA 39 1HB ALA 39 6.849 -0.112 -2.842
232 HB3 ALA 39 2HB ALA 39 6.602 1.214 -1.704
233 H CYS 40 H CYS 40 5.746 -0.827 -4.703
234 HA CYS 40 HA CYS 40 6.498 0.308 -7.288
235 HB2 CYS 40 2HB CYS 40 7.059 -2.005 -7.971
236 HB3 CYS 40 1HB CYS 40 7.965 -1.483 -6.561
237 H ARG 41 H ARG 41 4.828 -2.703 -6.899
238 HA ARG 41 HA ARG 41 2.180 -1.901 -7.044
239 HE ARG 41 HE ARG 41 1.448 0.570 -9.525
240 HB2 ARG 41 2HB ARG 41 3.044 -1.088 -9.349
241 HB3 ARG 41 1HB ARG 41 3.068 -2.792 -9.782
242 HG2 ARG 41 2HG ARG 41 1.019 -1.669 -10.516
243 HG3 ARG 41 1HG ARG 41 0.690 -2.967 -9.364
244 HD2 ARG 41 2HD ARG 41 -0.653 -0.997 -8.862
245 HD3 ARG 41 1HD ARG 41 0.497 -1.318 -7.566
246 HH11 ARG 41 1HH1 ARG 41 -0.339 0.170 -6.544
247 HH12 ARG 41 2HH1 ARG 41 -0.158 1.822 -6.044
248 HH21 ARG 41 1HH2 ARG 41 1.739 2.730 -8.872
249 HH22 ARG 41 2HH2 ARG 41 1.045 3.284 -7.377
250 H LYS 42 H LYS 42 4.224 -3.933 -6.170
251 HA LYS 42 HA LYS 42 3.645 -6.461 -7.255
252 HB2 LYS 42 2HB LYS 42 5.608 -5.907 -5.835
253 HB3 LYS 42 1HB LYS 42 4.532 -5.798 -4.448
254 HG2 LYS 42 2HG LYS 42 5.548 -7.916 -4.369
255 HG3 LYS 42 1HG LYS 42 3.888 -8.179 -4.880
256 HD2 LYS 42 2HD LYS 42 5.228 -9.572 -6.243
257 HD3 LYS 42 1HD LYS 42 4.756 -8.204 -7.251
258 HE2 LYS 42 2HE LYS 42 7.384 -8.318 -5.783
259 HE3 LYS 42 1HE LYS 42 7.177 -8.951 -7.413
260 HZ1 LYS 42 3HZ LYS 42 8.048 -6.706 -7.460
261 HZ2 LYS 42 1HZ LYS 42 6.722 -6.140 -6.574
262 HZ3 LYS 42 2HZ LYS 42 6.490 -6.740 -8.138
263 H ALA 43 H ALA 43 1.895 -7.726 -7.045
264 HA ALA 43 HA ALA 43 -0.300 -7.026 -5.372
265 HB1 ALA 43 3HB ALA 43 -0.618 -8.262 -7.458
266 HB2 ALA 43 1HB ALA 43 -1.260 -9.167 -6.085
267 HB3 ALA 43 2HB ALA 43 0.287 -9.626 -6.798
268 H LEU 44 H LEU 44 -0.454 -7.367 -3.245
269 HA LEU 44 HA LEU 44 1.539 -9.092 -1.989
270 HG LEU 44 HG LEU 44 2.067 -6.335 0.285
271 HB2 LEU 44 2HB LEU 44 0.084 -6.671 -1.185
272 HB3 LEU 44 1HB LEU 44 0.263 -7.868 0.083
273 HD11 LEU 44 1HD1 LEU 44 3.026 -8.855 -1.052
274 HD12 LEU 44 2HD1 LEU 44 2.679 -8.640 0.663
275 HD13 LEU 44 3HD1 LEU 44 4.023 -7.774 -0.081
276 HD21 LEU 44 3HD2 LEU 44 3.660 -5.937 -1.552
277 HD22 LEU 44 1HD2 LEU 44 2.039 -5.336 -1.893
278 HD23 LEU 44 2HD2 LEU 44 2.595 -6.835 -2.635
279 H ASP 45 H ASP 45 1.037 -10.523 -0.348
280 HA ASP 45 HA ASP 45 -1.749 -11.473 -0.269
281 HB2 ASP 45 2HB ASP 45 0.719 -12.967 0.661
282 HB3 ASP 45 1HB ASP 45 -0.898 -13.617 0.426
283 H SER 46 H SER 46 -2.384 -12.293 1.972
284 HA SER 46 HA SER 46 -1.822 -10.338 3.952
285 HG SER 46 HG SER 46 -4.789 -12.354 3.554
286 HB2 SER 46 2HB SER 46 -2.991 -13.108 4.345
287 HB3 SER 46 1HB SER 46 -3.133 -11.744 5.453
288 H THR 47 H THR 47 -0.172 -13.113 2.918
289 HA THR 47 HA THR 47 1.261 -13.548 5.405
290 HB THR 47 HB THR 47 1.983 -14.867 2.816
291 HG1 THR 47 HG1 THR 47 -0.142 -15.848 4.431
292 HG21 THR 47 3HG2 THR 47 2.412 -16.774 4.278
293 HG22 THR 47 1HG2 THR 47 1.800 -15.865 5.662
294 HG23 THR 47 2HG2 THR 47 3.276 -15.348 4.850
295 H THR 48 H THR 48 1.802 -12.042 2.254
296 HA THR 48 HA THR 48 4.684 -12.022 2.731
297 HB THR 48 HB THR 48 4.812 -11.227 0.339
298 HG1 THR 48 HG1 THR 48 2.506 -12.103 -0.572
299 HG21 THR 48 3HG2 THR 48 3.430 -13.864 0.855
300 HG22 THR 48 1HG2 THR 48 5.167 -13.564 0.949
301 HG23 THR 48 2HG2 THR 48 4.332 -13.439 -0.600
302 H VAL 49 H VAL 49 2.083 -9.902 3.131
303 HA VAL 49 HA VAL 49 3.236 -7.482 2.265
304 HB VAL 49 HB VAL 49 0.963 -7.277 2.580
305 HG11 VAL 49 1HG1 VAL 49 1.256 -8.486 5.341
306 HG12 VAL 49 2HG1 VAL 49 0.626 -9.307 3.913
307 HG13 VAL 49 3HG1 VAL 49 -0.254 -7.946 4.607
308 HG21 VAL 49 3HG2 VAL 49 2.144 -6.109 5.098
309 HG22 VAL 49 1HG2 VAL 49 0.598 -5.659 4.378
310 HG23 VAL 49 2HG2 VAL 49 2.099 -5.342 3.510
311 H ALA 50 H ALA 50 4.746 -6.239 3.051
312 HA ALA 50 HA ALA 50 5.739 -6.699 5.765
313 HB1 ALA 50 3HB ALA 50 6.929 -5.048 3.533
314 HB2 ALA 50 1HB ALA 50 7.383 -6.709 3.923
315 HB3 ALA 50 2HB ALA 50 7.689 -5.415 5.082
316 H ALA 51 H ALA 51 4.713 -5.512 7.239
317 HA ALA 51 HA ALA 51 3.848 -2.802 6.489
318 HB1 ALA 51 3HB ALA 51 2.011 -4.298 7.066
319 HB2 ALA 51 1HB ALA 51 2.166 -2.992 8.244
320 HB3 ALA 51 2HB ALA 51 2.749 -4.609 8.638
321 H HIS 52 H HIS 52 4.548 -1.103 7.593
322 HA HIS 52 HA HIS 52 5.957 -1.546 10.142
323 HD1 HIS 52 HD1 HIS 52 9.407 -1.078 9.840
324 HD2 HIS 52 HD2 HIS 52 6.980 2.238 10.499
325 HE1 HIS 52 HE1 HIS 52 10.593 0.301 11.581
326 HE2 HIS 52 HE2 HIS 52 9.199 2.390 11.826
327 HB2 HIS 52 2HB HIS 52 7.506 -0.961 8.234
328 HB3 HIS 52 1HB HIS 52 6.671 0.580 8.103
329 H GLU 53 H GLU 53 4.405 -0.960 11.506
330 HA GLU 53 HA GLU 53 3.131 0.386 12.797
331 HB2 GLU 53 2HB GLU 53 5.004 2.052 12.333
332 HB3 GLU 53 1HB GLU 53 3.950 2.741 11.104
333 HG2 GLU 53 2HG GLU 53 3.769 4.000 13.146
334 HG3 GLU 53 1HG GLU 53 2.250 3.166 12.820
335 H SER 54 H SER 54 2.816 2.042 9.643
336 HA SER 54 HA SER 54 0.030 1.163 9.533
337 HG SER 54 HG SER 54 -1.744 3.353 10.158
338 HB2 SER 54 2HB SER 54 0.263 3.399 10.773
339 HB3 SER 54 1HB SER 54 0.725 4.083 9.218
340 H GLU 55 H GLU 55 2.803 1.151 8.040
341 HA GLU 55 HA GLU 55 1.697 1.841 5.397
342 HB2 GLU 55 2HB GLU 55 4.555 2.111 6.340
343 HB3 GLU 55 1HB GLU 55 4.004 2.400 4.694
344 HG2 GLU 55 2HG GLU 55 2.568 4.209 5.485
345 HG3 GLU 55 1HG GLU 55 3.114 3.923 7.137
346 H ILE 56 H ILE 56 1.712 0.299 3.892
347 HA ILE 56 HA ILE 56 3.062 -2.230 4.561
348 HB ILE 56 HB ILE 56 1.049 -3.180 4.632
349 HG12 ILE 56 2HG1 ILE 56 0.860 -2.395 1.715
350 HG13 ILE 56 1HG1 ILE 56 1.582 -3.869 2.358
351 HG21 ILE 56 1HG2 ILE 56 0.029 -1.064 5.154
352 HG22 ILE 56 2HG2 ILE 56 -1.044 -1.993 4.108
353 HG23 ILE 56 3HG2 ILE 56 -0.096 -0.664 3.441
354 HD11 ILE 56 3HD1 ILE 56 -0.624 -4.285 1.419
355 HD12 ILE 56 1HD1 ILE 56 -1.326 -3.108 2.530
356 HD13 ILE 56 2HD1 ILE 56 -0.605 -4.589 3.156
357 H TYR 57 H TYR 57 4.321 -3.140 3.057
358 HA TYR 57 HA TYR 57 4.002 -2.440 0.241
359 HD1 TYR 57 HD2 TYR 57 4.810 -0.040 -0.712
360 HD2 TYR 57 HD1 TYR 57 6.669 -0.431 3.089
361 HE1 TYR 57 HE2 TYR 57 4.497 2.365 -0.319
362 HE2 TYR 57 HE1 TYR 57 6.366 1.970 3.493
363 HH TYR 57 HH TYR 57 6.114 4.076 1.948
364 HB2 TYR 57 2HB TYR 57 6.681 -2.226 1.643
365 HB3 TYR 57 1HB TYR 57 6.388 -1.987 -0.073
366 H CYS 58 H CYS 58 5.598 -3.771 -1.112
367 HA CYS 58 HA CYS 58 5.578 -6.498 -0.233
368 HB2 CYS 58 2HB CYS 58 6.521 -7.058 -2.332
369 HB3 CYS 58 1HB CYS 58 5.456 -5.702 -2.668
370 H LYS 59 H LYS 59 7.701 -7.765 -0.241
371 HA LYS 59 HA LYS 59 9.246 -6.724 1.882
372 HB2 LYS 59 2HB LYS 59 9.821 -9.121 0.129
373 HB3 LYS 59 1HB LYS 59 10.539 -8.792 1.701
374 HG2 LYS 59 2HG LYS 59 8.251 -8.885 2.686
375 HG3 LYS 59 1HG LYS 59 7.656 -9.407 1.114
376 HD2 LYS 59 2HD LYS 59 9.759 -10.858 2.717
377 HD3 LYS 59 1HD LYS 59 8.048 -11.269 2.715
378 HE2 LYS 59 2HE LYS 59 8.877 -12.756 1.173
379 HE3 LYS 59 1HE LYS 59 8.374 -11.423 0.132
380 HZ1 LYS 59 3HZ LYS 59 10.595 -12.301 -0.416
381 HZ2 LYS 59 1HZ LYS 59 11.148 -11.856 1.125
382 HZ3 LYS 59 2HZ LYS 59 10.653 -10.667 0.024
383 H VAL 60 H VAL 60 9.547 -6.465 -1.523
384 HA VAL 60 HA VAL 60 12.393 -6.114 -1.621
385 HB VAL 60 HB VAL 60 10.330 -5.295 -3.674
386 HG11 VAL 60 1HG1 VAL 60 12.199 -5.428 -5.255
387 HG12 VAL 60 2HG1 VAL 60 13.293 -5.796 -3.922
388 HG13 VAL 60 3HG1 VAL 60 12.492 -4.227 -3.998
389 HG21 VAL 60 3HG2 VAL 60 11.873 -7.878 -3.422
390 HG22 VAL 60 1HG2 VAL 60 10.817 -7.435 -4.764
391 HG23 VAL 60 2HG2 VAL 60 10.142 -7.671 -3.152
392 H CYS 61 H CYS 61 9.598 -3.911 -1.881
393 HA CYS 61 HA CYS 61 11.213 -1.574 -1.959
394 HB2 CYS 61 2HB CYS 61 8.287 -1.856 -1.282
395 HB3 CYS 61 1HB CYS 61 9.115 -0.338 -1.611
396 H TYR 62 H TYR 62 9.699 -3.377 0.657
397 HA TYR 62 HA TYR 62 10.080 -1.504 2.707
398 HD1 TYR 62 HD1 TYR 62 11.778 -4.040 5.037
399 HD2 TYR 62 HD2 TYR 62 7.811 -2.551 4.684
400 HE1 TYR 62 HE1 TYR 62 11.725 -3.626 7.462
401 HE2 TYR 62 HE2 TYR 62 7.746 -2.135 7.103
402 HH TYR 62 HH TYR 62 10.278 -1.892 9.013
403 HB2 TYR 62 2HB TYR 62 8.822 -3.708 2.856
404 HB3 TYR 62 1HB TYR 62 10.386 -4.496 3.028
405 H GLY 63 H GLY 63 12.232 -3.953 1.345
406 HA2 GLY 63 2HA GLY 63 14.423 -3.411 3.075
407 HA3 GLY 63 1HA GLY 63 14.497 -4.262 1.541
408 H ARG 64 H ARG 64 13.320 -1.988 0.072
409 HA ARG 64 HA ARG 64 15.753 -0.578 -0.469
410 HE ARG 64 HE ARG 64 12.330 2.553 -3.060
411 HB2 ARG 64 2HB ARG 64 14.102 -1.134 -2.232
412 HB3 ARG 64 1HB ARG 64 12.958 -0.031 -1.482
413 HG2 ARG 64 2HG ARG 64 14.562 1.822 -1.884
414 HG3 ARG 64 1HG ARG 64 15.588 0.685 -2.760
415 HD2 ARG 64 2HD ARG 64 14.262 1.880 -4.362
416 HD3 ARG 64 1HD ARG 64 13.674 0.219 -4.281
417 HH11 ARG 64 1HH1 ARG 64 12.233 -0.648 -4.502
418 HH12 ARG 64 2HH1 ARG 64 10.502 -0.798 -4.344
419 HH21 ARG 64 1HH2 ARG 64 10.042 2.374 -2.945
420 HH22 ARG 64 2HH2 ARG 64 9.277 0.914 -3.494
421 H ARG 65 H ARG 65 12.710 0.196 1.129
422 HA ARG 65 HA ARG 65 13.239 2.947 1.527
423 HE ARG 65 HE ARG 65 10.107 3.851 5.762
424 HB2 ARG 65 2HB ARG 65 10.986 2.121 1.685
425 HB3 ARG 65 1HB ARG 65 11.430 1.013 2.972
426 HG2 ARG 65 2HG ARG 65 11.771 2.824 4.505
427 HG3 ARG 65 1HG ARG 65 11.531 4.011 3.221
428 HD2 ARG 65 2HD ARG 65 9.246 3.484 3.016
429 HD3 ARG 65 1HD ARG 65 9.425 2.002 3.954
430 HH11 ARG 65 1HH1 ARG 65 7.485 3.871 3.457
431 HH12 ARG 65 2HH1 ARG 65 6.341 4.610 4.549
432 HH21 ARG 65 1HH2 ARG 65 8.606 4.812 7.223
433 HH22 ARG 65 2HH2 ARG 65 6.970 5.115 6.690
434 H TYR 66 H TYR 66 13.781 0.079 3.530
435 HA TYR 66 HA TYR 66 15.309 1.710 5.428
436 HD1 TYR 66 HD1 TYR 66 14.222 1.524 8.147
437 HD2 TYR 66 HD2 TYR 66 11.992 -0.625 5.235
438 HE1 TYR 66 HE1 TYR 66 12.144 2.501 9.025
439 HE2 TYR 66 HE2 TYR 66 9.907 0.337 6.113
440 HH TYR 66 HH TYR 66 9.850 2.973 8.253
441 HB2 TYR 66 2HB TYR 66 14.322 -1.147 5.629
442 HB3 TYR 66 1HB TYR 66 15.238 -0.307 6.881
Start of MODEL 5
1 H1 GLY 7 1H GLY 7 -18.213 0.192 4.985
2 HA2 GLY 7 2HA GLY 7 -19.238 2.299 5.286
3 HA3 GLY 7 1HA GLY 7 -19.394 1.946 7.004
4 H ALA 8 H ALA 8 -16.387 1.040 6.004
5 HA ALA 8 HA ALA 8 -15.160 3.361 7.257
6 HB1 ALA 8 3HB ALA 8 -14.457 1.110 7.945
7 HB2 ALA 8 1HB ALA 8 -13.117 2.014 7.236
8 HB3 ALA 8 2HB ALA 8 -13.938 0.771 6.294
9 H LYS 9 H LYS 9 -12.896 3.893 6.132
10 HA LYS 9 HA LYS 9 -13.464 4.227 3.271
11 HB2 LYS 9 2HB LYS 9 -12.298 6.342 3.298
12 HB3 LYS 9 1HB LYS 9 -13.560 6.367 4.515
13 HG2 LYS 9 2HG LYS 9 -11.881 7.331 5.689
14 HG3 LYS 9 1HG LYS 9 -11.565 5.643 6.092
15 HD2 LYS 9 2HD LYS 9 -9.494 6.772 5.484
16 HD3 LYS 9 1HD LYS 9 -9.893 5.535 4.291
17 HE2 LYS 9 2HE LYS 9 -10.945 7.374 2.916
18 HE3 LYS 9 1HE LYS 9 -10.218 8.522 4.040
19 HZ1 LYS 9 3HZ LYS 9 -8.801 8.242 2.125
20 HZ2 LYS 9 1HZ LYS 9 -8.779 6.557 2.337
21 HZ3 LYS 9 2HZ LYS 9 -8.032 7.563 3.478
22 H CYS 10 H CYS 10 -11.901 3.720 1.851
23 HA CYS 10 HA CYS 10 -9.993 1.802 2.498
24 HB2 CYS 10 2HB CYS 10 -10.894 2.331 0.220
25 HB3 CYS 10 1HB CYS 10 -9.854 3.745 0.189
26 H GLY 11 H GLY 11 -8.055 1.874 3.398
27 HA2 GLY 11 2HA GLY 11 -6.777 4.144 4.375
28 HA3 GLY 11 1HA GLY 11 -5.970 2.617 4.039
29 H ALA 12 H ALA 12 -6.938 3.018 1.135
30 HA ALA 12 HA ALA 12 -4.772 4.843 0.343
31 HB1 ALA 12 3HB ALA 12 -4.539 2.538 -0.455
32 HB2 ALA 12 1HB ALA 12 -4.751 3.668 -1.791
33 HB3 ALA 12 2HB ALA 12 -6.103 2.663 -1.266
34 H CYS 13 H CYS 13 -8.083 3.875 -0.571
35 HA CYS 13 HA CYS 13 -8.371 6.269 -2.212
36 HB2 CYS 13 2HB CYS 13 -10.467 4.181 -1.623
37 HB3 CYS 13 1HB CYS 13 -10.452 5.338 -2.944
38 H GLU 14 H GLU 14 -9.870 7.915 -1.808
39 HA GLU 14 HA GLU 14 -11.060 8.063 0.825
40 HB2 GLU 14 2HB GLU 14 -11.063 9.845 -1.590
41 HB3 GLU 14 1HB GLU 14 -12.272 10.083 -0.334
42 HG2 GLU 14 2HG GLU 14 -10.373 11.551 -0.006
43 HG3 GLU 14 1HG GLU 14 -10.516 10.396 1.317
44 H LYS 15 H LYS 15 -11.641 6.210 -1.666
45 HA LYS 15 HA LYS 15 -14.502 6.328 -1.877
46 HB2 LYS 15 2HB LYS 15 -12.745 3.976 -2.585
47 HB3 LYS 15 1HB LYS 15 -14.305 4.403 -3.268
48 HG2 LYS 15 2HG LYS 15 -11.734 5.921 -3.664
49 HG3 LYS 15 1HG LYS 15 -12.491 4.839 -4.831
50 HD2 LYS 15 2HD LYS 15 -13.799 7.323 -3.734
51 HD3 LYS 15 1HD LYS 15 -12.891 7.267 -5.247
52 HE2 LYS 15 2HE LYS 15 -14.443 5.576 -6.108
53 HE3 LYS 15 1HE LYS 15 -15.357 5.652 -4.600
54 HZ1 LYS 15 3HZ LYS 15 -16.385 7.000 -6.315
55 HZ2 LYS 15 1HZ LYS 15 -14.958 7.903 -6.497
56 HZ3 LYS 15 2HZ LYS 15 -15.830 7.978 -5.044
57 H THR 16 H THR 16 -15.872 4.551 -1.136
58 HA THR 16 HA THR 16 -15.322 4.059 1.640
59 HB THR 16 HB THR 16 -17.663 2.816 0.387
60 HG1 THR 16 HG1 THR 16 -18.188 4.560 -0.694
61 HG21 THR 16 3HG2 THR 16 -18.802 3.881 2.307
62 HG22 THR 16 1HG2 THR 16 -17.275 4.634 2.760
63 HG23 THR 16 2HG2 THR 16 -17.438 2.878 2.800
64 H VAL 17 H VAL 17 -15.139 2.139 2.664
65 HA VAL 17 HA VAL 17 -14.829 -0.263 0.987
66 HB VAL 17 HB VAL 17 -13.292 0.591 3.434
67 HG11 VAL 17 1HG1 VAL 17 -13.373 -2.152 2.183
68 HG12 VAL 17 2HG1 VAL 17 -13.948 -1.726 3.794
69 HG13 VAL 17 3HG1 VAL 17 -12.228 -1.628 3.419
70 HG21 VAL 17 3HG2 VAL 17 -12.440 1.346 1.297
71 HG22 VAL 17 1HG2 VAL 17 -12.443 -0.312 0.702
72 HG23 VAL 17 2HG2 VAL 17 -11.361 0.150 2.018
73 H TYR 18 H TYR 18 -16.242 -1.814 1.383
74 HA TYR 18 HA TYR 18 -17.566 -1.882 4.018
75 HD1 TYR 18 HD1 TYR 18 -20.130 -0.727 3.788
76 HD2 TYR 18 HD2 TYR 18 -18.613 -1.333 -0.137
77 HE1 TYR 18 HE1 TYR 18 -21.100 1.418 3.092
78 HE2 TYR 18 HE2 TYR 18 -19.579 0.815 -0.845
79 HH TYR 18 HH TYR 18 -20.608 3.154 1.265
80 HB2 TYR 18 2HB TYR 18 -18.559 -3.111 1.430
81 HB3 TYR 18 1HB TYR 18 -19.437 -2.997 2.954
82 H HIS 19 H HIS 19 -18.276 -4.347 4.464
83 HA HIS 19 HA HIS 19 -15.812 -5.710 4.757
84 HD1 HIS 19 HD1 HIS 19 -18.267 -9.276 4.754
85 HD2 HIS 19 HD2 HIS 19 -20.388 -5.703 4.936
86 HE1 HIS 19 HE1 HIS 19 -20.614 -9.845 4.057
87 HE2 HIS 19 HE2 HIS 19 -21.822 -7.637 3.979
88 HB2 HIS 19 2HB HIS 19 -16.983 -7.428 5.870
89 HB3 HIS 19 1HB HIS 19 -17.845 -5.949 6.261
90 H ALA 20 H ALA 20 -17.918 -5.497 2.165
91 HA ALA 20 HA ALA 20 -17.770 -7.952 0.876
92 HB1 ALA 20 3HB ALA 20 -17.761 -5.196 -0.359
93 HB2 ALA 20 1HB ALA 20 -19.195 -6.100 0.138
94 HB3 ALA 20 2HB ALA 20 -18.188 -6.700 -1.179
95 H GLU 21 H GLU 21 -15.613 -5.131 0.481
96 HA GLU 21 HA GLU 21 -13.537 -7.013 -0.426
97 HB2 GLU 21 2HB GLU 21 -12.679 -5.273 -1.938
98 HB3 GLU 21 1HB GLU 21 -14.314 -5.755 -2.353
99 HG2 GLU 21 2HG GLU 21 -13.717 -3.304 -0.720
100 HG3 GLU 21 1HG GLU 21 -13.782 -3.294 -2.480
101 H GLU 22 H GLU 22 -13.995 -6.105 2.243
102 HA GLU 22 HA GLU 22 -11.950 -4.101 2.742
103 HB2 GLU 22 2HB GLU 22 -13.996 -3.998 4.075
104 HB3 GLU 22 1HB GLU 22 -13.716 -5.634 4.658
105 HG2 GLU 22 2HG GLU 22 -11.551 -4.797 5.632
106 HG3 GLU 22 1HG GLU 22 -12.104 -3.169 5.252
107 H ILE 23 H ILE 23 -9.894 -4.621 3.033
108 HA ILE 23 HA ILE 23 -9.356 -7.042 4.634
109 HB ILE 23 HB ILE 23 -7.544 -5.716 2.599
110 HG12 ILE 23 2HG1 ILE 23 -8.492 -8.576 2.710
111 HG13 ILE 23 1HG1 ILE 23 -9.362 -7.328 1.818
112 HG21 ILE 23 1HG2 ILE 23 -5.889 -7.413 3.202
113 HG22 ILE 23 2HG2 ILE 23 -6.958 -8.007 4.473
114 HG23 ILE 23 3HG2 ILE 23 -6.278 -6.383 4.579
115 HD11 ILE 23 3HD1 ILE 23 -6.532 -8.230 1.330
116 HD12 ILE 23 1HD1 ILE 23 -7.376 -6.967 0.434
117 HD13 ILE 23 2HD1 ILE 23 -7.944 -8.635 0.353
118 H GLN 24 H GLN 24 -8.828 -6.531 6.645
119 HA GLN 24 HA GLN 24 -7.804 -3.840 7.177
120 HB2 GLN 24 2HB GLN 24 -9.420 -5.773 8.729
121 HB3 GLN 24 1HB GLN 24 -8.285 -4.786 9.642
122 HG2 GLN 24 2HG GLN 24 -9.293 -2.770 8.631
123 HG3 GLN 24 1HG GLN 24 -10.481 -3.803 7.840
124 HE21 GLN 24 1HE2 GLN 24 -12.157 -4.644 9.013
125 HE22 GLN 24 2HE2 GLN 24 -12.491 -4.174 10.647
126 H CYS 25 H CYS 25 -5.698 -3.814 6.989
127 HA CYS 25 HA CYS 25 -4.149 -5.812 8.495
128 HG CYS 25 HG CYS 25 -3.182 -4.508 4.209
129 HB2 CYS 25 2HB CYS 25 -2.268 -4.736 6.935
130 HB3 CYS 25 1HB CYS 25 -3.268 -6.083 6.401
131 H ASN 26 H ASN 26 -2.918 -5.141 10.119
132 HA ASN 26 HA ASN 26 -1.888 -3.826 11.652
133 HB2 ASN 26 2HB ASN 26 -0.786 -2.740 9.706
134 HB3 ASN 26 1HB ASN 26 -2.107 -1.578 9.640
135 HD21 ASN 26 1HD2 ASN 26 -1.061 0.234 10.141
136 HD22 ASN 26 2HD2 ASN 26 -0.208 0.519 11.620
137 H GLY 27 H GLY 27 -4.840 -2.756 10.209
138 HA2 GLY 27 2HA GLY 27 -6.555 -2.428 12.085
139 HA3 GLY 27 1HA GLY 27 -5.460 -1.152 12.599
140 H ARG 28 H ARG 28 -5.687 -1.574 9.207
141 HA ARG 28 HA ARG 28 -7.692 0.571 9.038
142 HE ARG 28 HE ARG 28 -4.499 3.752 10.401
143 HB2 ARG 28 2HB ARG 28 -5.182 0.338 7.366
144 HB3 ARG 28 1HB ARG 28 -6.439 1.547 7.156
145 HG2 ARG 28 2HG ARG 28 -4.672 1.237 9.573
146 HG3 ARG 28 1HG ARG 28 -4.504 2.458 8.310
147 HD2 ARG 28 2HD ARG 28 -6.712 3.353 8.893
148 HD3 ARG 28 1HD ARG 28 -6.868 2.135 10.159
149 HH11 ARG 28 1HH1 ARG 28 -7.916 3.535 11.190
150 HH12 ARG 28 2HH1 ARG 28 -7.798 4.615 12.545
151 HH21 ARG 28 1HH2 ARG 28 -4.363 5.190 12.178
152 HH22 ARG 28 2HH2 ARG 28 -5.793 5.543 13.110
153 H SER 29 H SER 29 -9.109 0.463 7.306
154 HA SER 29 HA SER 29 -9.308 -2.130 6.029
155 HG SER 29 HG SER 29 -12.158 -1.845 7.232
156 HB2 SER 29 2HB SER 29 -11.171 0.251 5.917
157 HB3 SER 29 1HB SER 29 -11.522 -1.365 5.306
158 H PHE 30 H PHE 30 -8.373 -2.483 4.146
159 HA PHE 30 HA PHE 30 -8.259 -0.276 2.189
160 HD1 PHE 30 HD1 PHE 30 -5.467 0.644 1.560
161 HD2 PHE 30 HD2 PHE 30 -5.649 -2.351 4.574
162 HE1 PHE 30 HE1 PHE 30 -3.832 1.900 2.903
163 HE2 PHE 30 HE2 PHE 30 -4.021 -1.098 5.925
164 HZ PHE 30 HZ PHE 30 -3.111 1.030 5.090
165 HB2 PHE 30 2HB PHE 30 -6.524 -2.760 2.375
166 HB3 PHE 30 1HB PHE 30 -6.421 -1.544 1.109
167 H HIS 31 H HIS 31 -8.811 -0.816 -0.014
168 HA HIS 31 HA HIS 31 -10.848 -2.765 -0.336
169 HD2 HIS 31 HD2 HIS 31 -12.911 -1.632 -1.054
170 HE1 HIS 31 HE1 HIS 31 -12.242 2.334 -2.345
171 HE2 HIS 31 HE2 HIS 31 -13.845 0.789 -1.150
172 HB2 HIS 31 2HB HIS 31 -9.214 -1.225 -2.359
173 HB3 HIS 31 1HB HIS 31 -10.414 -2.415 -2.841
174 H LYS 32 H LYS 32 -10.788 -4.756 -1.312
175 HA LYS 32 HA LYS 32 -8.556 -6.393 -1.039
176 HB2 LYS 32 2HB LYS 32 -10.859 -7.207 -1.182
177 HB3 LYS 32 1HB LYS 32 -10.955 -6.686 -2.855
178 HG2 LYS 32 2HG LYS 32 -9.544 -8.386 -3.586
179 HG3 LYS 32 1HG LYS 32 -8.926 -8.692 -1.960
180 HD2 LYS 32 2HD LYS 32 -10.882 -9.771 -1.288
181 HD3 LYS 32 1HD LYS 32 -11.827 -9.078 -2.609
182 HE2 LYS 32 2HE LYS 32 -9.548 -10.980 -3.079
183 HE3 LYS 32 1HE LYS 32 -11.197 -11.538 -2.800
184 HZ1 LYS 32 3HZ LYS 32 -10.552 -11.283 -5.181
185 HZ2 LYS 32 1HZ LYS 32 -10.475 -9.605 -4.933
186 HZ3 LYS 32 2HZ LYS 32 -11.947 -10.426 -4.733
187 H THR 33 H THR 33 -9.530 -4.269 -3.599
188 HA THR 33 HA THR 33 -7.553 -5.228 -5.476
189 HB THR 33 HB THR 33 -8.286 -3.169 -6.768
190 HG1 THR 33 HG1 THR 33 -9.348 -1.786 -5.569
191 HG21 THR 33 3HG2 THR 33 -10.404 -5.170 -5.970
192 HG22 THR 33 1HG2 THR 33 -9.208 -5.377 -7.247
193 HG23 THR 33 2HG2 THR 33 -10.455 -4.140 -7.403
194 H CYS 34 H CYS 34 -7.505 -3.251 -2.778
195 HA CYS 34 HA CYS 34 -5.242 -1.652 -3.775
196 HB2 CYS 34 2HB CYS 34 -7.097 -1.094 -1.445
197 HB3 CYS 34 1HB CYS 34 -5.778 -0.056 -1.980
198 H PHE 35 H PHE 35 -5.372 -4.446 -2.573
199 HA PHE 35 HA PHE 35 -4.028 -4.056 -0.035
200 HD1 PHE 35 HD2 PHE 35 -4.484 -5.049 1.927
201 HD2 PHE 35 HD1 PHE 35 -3.594 -8.440 -0.481
202 HE1 PHE 35 HE2 PHE 35 -3.430 -6.134 3.860
203 HE2 PHE 35 HE1 PHE 35 -2.531 -9.532 1.449
204 HZ PHE 35 HZ PHE 35 -2.452 -8.373 3.618
205 HB2 PHE 35 2HB PHE 35 -5.778 -5.810 -0.339
206 HB3 PHE 35 1HB PHE 35 -4.677 -6.654 -1.424
207 H HIS 36 H HIS 36 -3.061 -4.218 -3.221
208 HA HIS 36 HA HIS 36 -0.576 -5.584 -2.568
209 HD1 HIS 36 HD1 HIS 36 -3.428 -5.996 -5.909
210 HD2 HIS 36 HD2 HIS 36 -0.992 -2.629 -5.925
211 HE1 HIS 36 HE1 HIS 36 -4.538 -4.361 -7.470
212 HE2 HIS 36 HE2 HIS 36 -2.944 -2.424 -7.621
213 HB2 HIS 36 2HB HIS 36 -0.035 -5.262 -5.022
214 HB3 HIS 36 1HB HIS 36 -1.364 -6.339 -4.633
215 H CYS 37 H CYS 37 1.464 -4.517 -3.643
216 HA CYS 37 HA CYS 37 2.175 -2.784 -1.651
217 HB2 CYS 37 2HB CYS 37 3.690 -4.158 -3.091
218 HB3 CYS 37 1HB CYS 37 3.543 -2.918 -4.329
219 H MET 38 H MET 38 1.998 -0.761 -1.223
220 HA MET 38 HA MET 38 0.752 1.113 -2.980
221 HB2 MET 38 2HB MET 38 2.139 1.544 -0.329
222 HB3 MET 38 1HB MET 38 1.118 2.716 -1.150
223 HG2 MET 38 2HG MET 38 0.242 0.045 -0.082
224 HG3 MET 38 1HG MET 38 -0.074 1.614 0.651
225 HE1 MET 38 3HE MET 38 -2.649 1.083 0.776
226 HE2 MET 38 1HE MET 38 -2.336 -0.503 0.074
227 HE3 MET 38 2HE MET 38 -3.605 0.523 -0.599
228 H ALA 39 H ALA 39 4.021 0.213 -2.264
229 HA ALA 39 HA ALA 39 5.127 2.784 -2.986
230 HB1 ALA 39 3HB ALA 39 6.543 0.205 -2.370
231 HB2 ALA 39 1HB ALA 39 6.136 1.458 -1.198
232 HB3 ALA 39 2HB ALA 39 7.281 1.801 -2.497
233 H CYS 40 H CYS 40 5.291 -0.520 -4.372
234 HA CYS 40 HA CYS 40 5.968 0.792 -6.908
235 HB2 CYS 40 2HB CYS 40 6.766 -1.400 -7.712
236 HB3 CYS 40 1HB CYS 40 7.639 -0.876 -6.283
237 H ARG 41 H ARG 41 4.667 -2.397 -6.698
238 HA ARG 41 HA ARG 41 1.975 -1.947 -6.395
239 HE ARG 41 HE ARG 41 -1.604 0.053 -7.967
240 HB2 ARG 41 2HB ARG 41 2.605 -0.875 -8.833
241 HB3 ARG 41 1HB ARG 41 2.140 -2.512 -9.281
242 HG2 ARG 41 2HG ARG 41 0.265 -0.897 -9.347
243 HG3 ARG 41 1HG ARG 41 -0.013 -2.249 -8.246
244 HD2 ARG 41 2HD ARG 41 0.668 -0.839 -6.358
245 HD3 ARG 41 1HD ARG 41 0.935 0.507 -7.460
246 HH11 ARG 41 1HH1 ARG 41 0.002 -0.030 -4.842
247 HH12 ARG 41 2HH1 ARG 41 -1.396 0.513 -3.967
248 HH21 ARG 41 1HH2 ARG 41 -3.442 0.744 -6.817
249 HH22 ARG 41 2HH2 ARG 41 -3.352 0.973 -5.099
250 H LYS 42 H LYS 42 4.309 -3.796 -6.114
251 HA LYS 42 HA LYS 42 3.866 -6.246 -7.374
252 HB2 LYS 42 2HB LYS 42 5.844 -5.681 -5.978
253 HB3 LYS 42 1HB LYS 42 4.829 -5.738 -4.545
254 HG2 LYS 42 2HG LYS 42 6.059 -7.771 -4.676
255 HG3 LYS 42 1HG LYS 42 4.370 -8.131 -5.042
256 HD2 LYS 42 2HD LYS 42 4.872 -8.146 -7.422
257 HD3 LYS 42 1HD LYS 42 6.550 -7.717 -7.088
258 HE2 LYS 42 2HE LYS 42 6.863 -9.807 -5.890
259 HE3 LYS 42 1HE LYS 42 5.171 -10.227 -6.155
260 HZ1 LYS 42 3HZ LYS 42 5.594 -10.222 -8.537
261 HZ2 LYS 42 1HZ LYS 42 6.591 -11.340 -7.740
262 HZ3 LYS 42 2HZ LYS 42 7.225 -9.854 -8.264
263 H ALA 43 H ALA 43 2.477 -7.948 -6.975
264 HA ALA 43 HA ALA 43 0.091 -7.297 -5.522
265 HB1 ALA 43 3HB ALA 43 0.035 -8.550 -7.643
266 HB2 ALA 43 1HB ALA 43 -0.761 -9.418 -6.330
267 HB3 ALA 43 2HB ALA 43 0.853 -9.897 -6.854
268 H LEU 44 H LEU 44 0.085 -7.415 -3.363
269 HA LEU 44 HA LEU 44 1.647 -9.450 -1.985
270 HG LEU 44 HG LEU 44 2.254 -6.597 0.244
271 HB2 LEU 44 2HB LEU 44 0.162 -7.002 -1.092
272 HB3 LEU 44 1HB LEU 44 0.582 -8.244 0.069
273 HD11 LEU 44 1HD1 LEU 44 3.128 -8.874 0.228
274 HD12 LEU 44 2HD1 LEU 44 4.292 -7.740 -0.462
275 HD13 LEU 44 3HD1 LEU 44 3.345 -8.786 -1.520
276 HD21 LEU 44 3HD2 LEU 44 2.509 -6.701 -2.753
277 HD22 LEU 44 1HD2 LEU 44 3.542 -5.771 -1.669
278 HD23 LEU 44 2HD2 LEU 44 1.827 -5.383 -1.799
279 H ASP 45 H ASP 45 0.780 -11.022 -0.686
280 HA ASP 45 HA ASP 45 -2.150 -11.311 -0.743
281 HB2 ASP 45 2HB ASP 45 -1.937 -13.643 -0.616
282 HB3 ASP 45 1HB ASP 45 -0.616 -13.195 -1.690
283 H SER 46 H SER 46 -2.608 -12.863 1.442
284 HA SER 46 HA SER 46 -2.432 -10.998 3.529
285 HG SER 46 HG SER 46 -3.200 -14.891 4.030
286 HB2 SER 46 2HB SER 46 -3.181 -13.010 4.945
287 HB3 SER 46 1HB SER 46 -4.229 -12.514 3.617
288 H THR 47 H THR 47 -0.210 -13.426 2.484
289 HA THR 47 HA THR 47 1.157 -13.559 5.054
290 HB THR 47 HB THR 47 2.132 -14.871 2.540
291 HG1 THR 47 HG1 THR 47 -0.046 -15.418 2.593
292 HG21 THR 47 3HG2 THR 47 2.111 -15.732 5.434
293 HG22 THR 47 1HG2 THR 47 3.484 -15.018 4.588
294 HG23 THR 47 2HG2 THR 47 2.870 -16.595 4.096
295 H THR 48 H THR 48 1.924 -12.574 1.697
296 HA THR 48 HA THR 48 4.665 -12.085 2.326
297 HB THR 48 HB THR 48 4.668 -11.045 -0.025
298 HG1 THR 48 HG1 THR 48 2.167 -12.388 -0.223
299 HG21 THR 48 3HG2 THR 48 4.598 -13.264 -1.077
300 HG22 THR 48 1HG2 THR 48 3.810 -13.918 0.360
301 HG23 THR 48 2HG2 THR 48 5.462 -13.310 0.459
302 H VAL 49 H VAL 49 1.873 -10.079 2.558
303 HA VAL 49 HA VAL 49 3.079 -7.595 1.963
304 HB VAL 49 HB VAL 49 0.751 -7.509 1.951
305 HG11 VAL 49 1HG1 VAL 49 0.755 -8.651 4.747
306 HG12 VAL 49 2HG1 VAL 49 0.329 -9.526 3.277
307 HG13 VAL 49 3HG1 VAL 49 -0.675 -8.186 3.829
308 HG21 VAL 49 3HG2 VAL 49 1.678 -5.512 2.946
309 HG22 VAL 49 1HG2 VAL 49 1.623 -6.252 4.547
310 HG23 VAL 49 2HG2 VAL 49 0.125 -5.889 3.690
311 H ALA 50 H ALA 50 4.492 -6.425 3.010
312 HA ALA 50 HA ALA 50 5.046 -7.015 5.820
313 HB1 ALA 50 3HB ALA 50 6.963 -6.974 4.299
314 HB2 ALA 50 1HB ALA 50 7.082 -5.692 5.504
315 HB3 ALA 50 2HB ALA 50 6.580 -5.311 3.854
316 H ALA 51 H ALA 51 3.729 -5.917 7.134
317 HA ALA 51 HA ALA 51 3.144 -3.110 6.527
318 HB1 ALA 51 3HB ALA 51 1.762 -4.996 8.432
319 HB2 ALA 51 1HB ALA 51 1.185 -4.525 6.833
320 HB3 ALA 51 2HB ALA 51 1.298 -3.323 8.119
321 H HIS 52 H HIS 52 4.090 -1.578 7.671
322 HA HIS 52 HA HIS 52 5.062 -2.180 10.368
323 HD1 HIS 52 HD1 HIS 52 8.331 -2.831 10.886
324 HD2 HIS 52 HD2 HIS 52 7.421 1.173 10.239
325 HE1 HIS 52 HE1 HIS 52 9.665 -1.551 12.590
326 HE2 HIS 52 HE2 HIS 52 8.915 0.847 12.324
327 HB2 HIS 52 2HB HIS 52 6.979 -2.451 8.785
328 HB3 HIS 52 1HB HIS 52 6.740 -0.790 8.258
329 H GLU 53 H GLU 53 4.632 -0.607 11.768
330 HA GLU 53 HA GLU 53 4.063 1.389 12.675
331 HB2 GLU 53 2HB GLU 53 5.898 2.213 11.064
332 HB3 GLU 53 1HB GLU 53 4.573 2.749 10.041
333 HG2 GLU 53 2HG GLU 53 5.327 4.593 11.348
334 HG3 GLU 53 1HG GLU 53 3.729 4.112 11.926
335 H SER 54 H SER 54 3.074 2.278 9.415
336 HA SER 54 HA SER 54 0.311 1.602 9.992
337 HG SER 54 HG SER 54 1.524 4.610 8.327
338 HB2 SER 54 2HB SER 54 -0.427 3.902 9.268
339 HB3 SER 54 1HB SER 54 0.388 3.853 10.831
340 H GLU 55 H GLU 55 2.750 1.183 8.052
341 HA GLU 55 HA GLU 55 1.323 1.768 5.539
342 HB2 GLU 55 2HB GLU 55 4.303 1.442 5.871
343 HB3 GLU 55 1HB GLU 55 3.444 2.068 4.473
344 HG2 GLU 55 2HG GLU 55 3.700 3.389 7.159
345 HG3 GLU 55 1HG GLU 55 4.513 3.863 5.671
346 H ILE 56 H ILE 56 1.621 0.271 3.794
347 HA ILE 56 HA ILE 56 2.560 -2.410 4.534
348 HB ILE 56 HB ILE 56 0.448 -3.161 4.529
349 HG12 ILE 56 2HG1 ILE 56 0.599 -2.529 1.575
350 HG13 ILE 56 1HG1 ILE 56 1.102 -4.023 2.360
351 HG21 ILE 56 1HG2 ILE 56 -1.498 -1.880 3.782
352 HG22 ILE 56 2HG2 ILE 56 -0.420 -0.650 3.121
353 HG23 ILE 56 3HG2 ILE 56 -0.451 -0.954 4.858
354 HD11 ILE 56 3HD1 ILE 56 -1.216 -4.478 2.973
355 HD12 ILE 56 1HD1 ILE 56 -1.027 -4.291 1.229
356 HD13 ILE 56 2HD1 ILE 56 -1.718 -2.980 2.186
357 H TYR 57 H TYR 57 3.971 -3.205 3.099
358 HA TYR 57 HA TYR 57 3.788 -2.397 0.296
359 HD1 TYR 57 HD1 TYR 57 4.557 0.221 -0.195
360 HD2 TYR 57 HD2 TYR 57 6.423 -0.760 3.496
361 HE1 TYR 57 HE1 TYR 57 4.207 2.523 0.582
362 HE2 TYR 57 HE2 TYR 57 6.087 1.545 4.286
363 HH TYR 57 HH TYR 57 5.730 3.778 3.366
364 HB2 TYR 57 2HB TYR 57 6.434 -2.311 1.758
365 HB3 TYR 57 1HB TYR 57 6.110 -1.801 0.110
366 H CYS 58 H CYS 58 5.486 -3.638 -1.015
367 HA CYS 58 HA CYS 58 5.429 -6.412 -0.311
368 HB2 CYS 58 2HB CYS 58 6.510 -6.818 -2.399
369 HB3 CYS 58 1HB CYS 58 5.370 -5.507 -2.679
370 H LYS 59 H LYS 59 7.634 -7.661 -0.449
371 HA LYS 59 HA LYS 59 9.210 -6.793 1.729
372 HB2 LYS 59 2HB LYS 59 9.748 -8.920 -0.346
373 HB3 LYS 59 1HB LYS 59 10.730 -8.671 1.090
374 HG2 LYS 59 2HG LYS 59 8.782 -9.161 2.498
375 HG3 LYS 59 1HG LYS 59 7.815 -9.439 1.049
376 HD2 LYS 59 2HD LYS 59 9.382 -11.249 0.406
377 HD3 LYS 59 1HD LYS 59 10.248 -10.999 1.921
378 HE2 LYS 59 2HE LYS 59 7.345 -11.782 1.678
379 HE3 LYS 59 1HE LYS 59 8.669 -12.888 2.028
380 HZ1 LYS 59 3HZ LYS 59 7.752 -10.630 3.726
381 HZ2 LYS 59 1HZ LYS 59 9.123 -11.574 4.049
382 HZ3 LYS 59 2HZ LYS 59 7.580 -12.282 4.059
383 H VAL 60 H VAL 60 9.462 -6.314 -1.703
384 HA VAL 60 HA VAL 60 12.236 -5.744 -1.818
385 HB VAL 60 HB VAL 60 10.057 -4.818 -3.699
386 HG11 VAL 60 1HG1 VAL 60 13.035 -5.058 -4.114
387 HG12 VAL 60 2HG1 VAL 60 12.126 -3.555 -3.965
388 HG13 VAL 60 3HG1 VAL 60 11.855 -4.615 -5.348
389 HG21 VAL 60 3HG2 VAL 60 10.056 -7.237 -3.469
390 HG22 VAL 60 1HG2 VAL 60 11.791 -7.285 -3.777
391 HG23 VAL 60 2HG2 VAL 60 10.684 -6.774 -5.053
392 H CYS 61 H CYS 61 9.384 -3.597 -1.792
393 HA CYS 61 HA CYS 61 10.924 -1.217 -1.692
394 HB2 CYS 61 2HB CYS 61 8.036 -1.676 -0.950
395 HB3 CYS 61 1HB CYS 61 8.798 -0.098 -1.129
396 H TYR 62 H TYR 62 9.617 -3.323 0.774
397 HA TYR 62 HA TYR 62 9.955 -1.656 2.993
398 HD1 TYR 62 HD1 TYR 62 11.795 -4.478 5.035
399 HD2 TYR 62 HD2 TYR 62 7.868 -2.853 4.841
400 HE1 TYR 62 HE1 TYR 62 11.752 -4.298 7.488
401 HE2 TYR 62 HE2 TYR 62 7.814 -2.669 7.289
402 HH TYR 62 HH TYR 62 10.543 -2.896 9.211
403 HB2 TYR 62 2HB TYR 62 8.845 -3.947 2.919
404 HB3 TYR 62 1HB TYR 62 10.466 -4.633 2.989
405 H GLY 63 H GLY 63 12.207 -3.956 1.476
406 HA2 GLY 63 2HA GLY 63 14.403 -3.377 3.166
407 HA3 GLY 63 1HA GLY 63 14.495 -4.130 1.581
408 H ARG 64 H ARG 64 13.364 -2.032 0.071
409 HA ARG 64 HA ARG 64 15.590 -0.479 -0.537
410 HE ARG 64 HE ARG 64 13.704 1.031 -4.236
411 HB2 ARG 64 2HB ARG 64 12.661 0.023 -1.080
412 HB3 ARG 64 1HB ARG 64 13.955 0.995 -1.764
413 HG2 ARG 64 2HG ARG 64 14.801 -0.851 -3.000
414 HG3 ARG 64 1HG ARG 64 13.732 -1.976 -2.160
415 HD2 ARG 64 2HD ARG 64 12.900 -1.475 -4.402
416 HD3 ARG 64 1HD ARG 64 11.790 -0.894 -3.169
417 HH11 ARG 64 1HH1 ARG 64 10.401 -0.205 -4.208
418 HH12 ARG 64 2HH1 ARG 64 9.749 1.187 -5.018
419 HH21 ARG 64 1HH2 ARG 64 12.801 2.869 -5.287
420 HH22 ARG 64 2HH2 ARG 64 11.098 2.909 -5.625
421 H ARG 65 H ARG 65 12.800 0.299 1.502
422 HA ARG 65 HA ARG 65 13.732 2.991 1.961
423 HE ARG 65 HE ARG 65 9.135 2.874 -0.260
424 HB2 ARG 65 2HB ARG 65 11.428 1.465 3.172
425 HB3 ARG 65 1HB ARG 65 11.744 3.178 3.421
426 HG2 ARG 65 2HG ARG 65 11.475 3.561 1.010
427 HG3 ARG 65 1HG ARG 65 11.105 1.849 0.794
428 HD2 ARG 65 2HD ARG 65 9.163 2.083 2.255
429 HD3 ARG 65 1HD ARG 65 9.536 3.793 2.482
430 HH11 ARG 65 1HH1 ARG 65 7.865 4.541 2.550
431 HH12 ARG 65 2HH1 ARG 65 6.570 5.296 1.677
432 HH21 ARG 65 1HH2 ARG 65 7.442 3.894 -1.411
433 HH22 ARG 65 2HH2 ARG 65 6.308 4.906 -0.567
434 H TYR 66 H TYR 66 13.785 -0.061 3.726
435 HA TYR 66 HA TYR 66 14.838 1.368 6.071
436 HD1 TYR 66 HD2 TYR 66 13.240 1.419 8.269
437 HD2 TYR 66 HD1 TYR 66 11.376 -0.927 5.252
438 HE1 TYR 66 HE2 TYR 66 11.080 2.473 8.793
439 HE2 TYR 66 HE1 TYR 66 9.214 0.122 5.763
440 HH TYR 66 HH TYR 66 8.148 1.273 7.781
441 HB2 TYR 66 2HB TYR 66 13.597 -1.379 5.858
442 HB3 TYR 66 1HB TYR 66 14.282 -0.711 7.335
Start of MODEL 6
1 H1 GLY 7 1H GLY 7 -20.031 0.717 7.366
2 HA2 GLY 7 2HA GLY 7 -18.582 0.389 5.453
3 HA3 GLY 7 1HA GLY 7 -19.254 1.859 4.757
4 H ALA 8 H ALA 8 -16.521 1.380 5.027
5 HA ALA 8 HA ALA 8 -15.797 3.525 6.918
6 HB1 ALA 8 3HB ALA 8 -13.654 2.405 7.295
7 HB2 ALA 8 1HB ALA 8 -14.145 1.088 6.231
8 HB3 ALA 8 2HB ALA 8 -14.996 1.356 7.752
9 H LYS 9 H LYS 9 -13.181 3.913 6.107
10 HA LYS 9 HA LYS 9 -13.498 4.548 3.257
11 HB2 LYS 9 2HB LYS 9 -12.072 6.504 3.587
12 HB3 LYS 9 1HB LYS 9 -13.493 6.590 4.622
13 HG2 LYS 9 2HG LYS 9 -12.255 6.135 6.550
14 HG3 LYS 9 1HG LYS 9 -10.874 5.537 5.629
15 HD2 LYS 9 2HD LYS 9 -11.845 8.393 5.631
16 HD3 LYS 9 1HD LYS 9 -10.493 7.782 6.589
17 HE2 LYS 9 2HE LYS 9 -9.401 7.067 4.467
18 HE3 LYS 9 1HE LYS 9 -10.703 7.858 3.576
19 HZ1 LYS 9 3HZ LYS 9 -10.065 9.958 4.453
20 HZ2 LYS 9 1HZ LYS 9 -8.667 9.223 3.839
21 HZ3 LYS 9 2HZ LYS 9 -8.941 9.257 5.509
22 H CYS 10 H CYS 10 -11.830 4.152 1.923
23 HA CYS 10 HA CYS 10 -9.967 2.143 2.666
24 HB2 CYS 10 2HB CYS 10 -10.949 2.418 0.406
25 HB3 CYS 10 1HB CYS 10 -10.055 3.919 0.222
26 H GLY 11 H GLY 11 -8.051 2.383 3.565
27 HA2 GLY 11 2HA GLY 11 -6.857 4.854 4.184
28 HA3 GLY 11 1HA GLY 11 -6.042 3.295 4.210
29 H ALA 12 H ALA 12 -6.819 3.020 1.247
30 HA ALA 12 HA ALA 12 -4.435 4.417 0.275
31 HB1 ALA 12 3HB ALA 12 -4.544 2.008 -0.102
32 HB2 ALA 12 1HB ALA 12 -4.538 2.891 -1.628
33 HB3 ALA 12 2HB ALA 12 -6.043 2.213 -1.010
34 H CYS 13 H CYS 13 -7.897 4.221 -0.213
35 HA CYS 13 HA CYS 13 -7.736 6.222 -2.368
36 HB2 CYS 13 2HB CYS 13 -10.090 4.573 -1.414
37 HB3 CYS 13 1HB CYS 13 -10.113 5.696 -2.765
38 H GLU 14 H GLU 14 -9.902 7.622 -2.270
39 HA GLU 14 HA GLU 14 -10.424 8.513 0.489
40 HB2 GLU 14 2HB GLU 14 -11.514 9.712 -2.067
41 HB3 GLU 14 1HB GLU 14 -11.486 10.433 -0.464
42 HG2 GLU 14 2HG GLU 14 -9.198 10.879 -0.577
43 HG3 GLU 14 1HG GLU 14 -8.965 9.784 -1.943
44 H LYS 15 H LYS 15 -11.295 6.212 -1.529
45 HA LYS 15 HA LYS 15 -14.152 6.542 -1.660
46 HB2 LYS 15 2HB LYS 15 -12.410 4.212 -2.489
47 HB3 LYS 15 1HB LYS 15 -14.112 4.409 -2.877
48 HG2 LYS 15 2HG LYS 15 -11.849 6.158 -3.813
49 HG3 LYS 15 1HG LYS 15 -12.750 4.989 -4.780
50 HD2 LYS 15 2HD LYS 15 -14.809 6.299 -4.368
51 HD3 LYS 15 1HD LYS 15 -13.839 7.496 -3.508
52 HE2 LYS 15 2HE LYS 15 -12.511 7.840 -5.562
53 HE3 LYS 15 1HE LYS 15 -13.577 6.717 -6.410
54 HZ1 LYS 15 3HZ LYS 15 -14.323 9.324 -5.198
55 HZ2 LYS 15 1HZ LYS 15 -15.442 8.214 -5.831
56 HZ3 LYS 15 2HZ LYS 15 -14.295 8.933 -6.846
57 H THR 16 H THR 16 -15.541 4.668 -1.085
58 HA THR 16 HA THR 16 -15.161 4.151 1.723
59 HB THR 16 HB THR 16 -17.471 2.989 1.229
60 HG1 THR 16 HG1 THR 16 -17.464 3.163 -0.990
61 HG21 THR 16 3HG2 THR 16 -18.588 5.145 1.622
62 HG22 THR 16 1HG2 THR 16 -17.089 5.984 1.222
63 HG23 THR 16 2HG2 THR 16 -17.170 4.957 2.653
64 H VAL 17 H VAL 17 -14.796 2.247 2.668
65 HA VAL 17 HA VAL 17 -14.604 -0.159 0.972
66 HB VAL 17 HB VAL 17 -13.198 0.586 3.535
67 HG11 VAL 17 1HG1 VAL 17 -13.992 -1.712 3.795
68 HG12 VAL 17 2HG1 VAL 17 -12.240 -1.668 3.593
69 HG13 VAL 17 3HG1 VAL 17 -13.273 -2.143 2.244
70 HG21 VAL 17 3HG2 VAL 17 -12.155 1.337 1.490
71 HG22 VAL 17 1HG2 VAL 17 -12.219 -0.299 0.835
72 HG23 VAL 17 2HG2 VAL 17 -11.193 0.055 2.226
73 H TYR 18 H TYR 18 -15.990 -1.782 1.337
74 HA TYR 18 HA TYR 18 -17.511 -1.719 3.857
75 HD1 TYR 18 HD2 TYR 18 -18.076 0.140 0.851
76 HD2 TYR 18 HD1 TYR 18 -20.876 -1.622 3.522
77 HE1 TYR 18 HE2 TYR 18 -19.300 2.263 0.957
78 HE2 TYR 18 HE1 TYR 18 -22.114 0.496 3.631
79 HH TYR 18 HH TYR 18 -21.596 3.017 1.436
80 HB2 TYR 18 2HB TYR 18 -18.405 -2.378 1.059
81 HB3 TYR 18 1HB TYR 18 -19.285 -2.979 2.461
82 H HIS 19 H HIS 19 -18.507 -3.962 4.270
83 HA HIS 19 HA HIS 19 -16.553 -5.847 4.749
84 HD1 HIS 19 HD1 HIS 19 -20.365 -8.525 4.251
85 HD2 HIS 19 HD2 HIS 19 -20.374 -4.428 3.543
86 HE1 HIS 19 HE1 HIS 19 -22.465 -8.068 2.934
87 HE2 HIS 19 HE2 HIS 19 -22.521 -5.556 2.651
88 HB2 HIS 19 2HB HIS 19 -18.351 -7.440 5.167
89 HB3 HIS 19 1HB HIS 19 -18.773 -5.861 5.813
90 H ALA 20 H ALA 20 -18.085 -5.135 1.787
91 HA ALA 20 HA ALA 20 -18.071 -7.614 0.473
92 HB1 ALA 20 3HB ALA 20 -18.282 -6.296 -1.567
93 HB2 ALA 20 1HB ALA 20 -17.792 -4.844 -0.690
94 HB3 ALA 20 2HB ALA 20 -19.316 -5.645 -0.296
95 H GLU 21 H GLU 21 -15.768 -4.913 0.240
96 HA GLU 21 HA GLU 21 -13.782 -6.817 -0.820
97 HB2 GLU 21 2HB GLU 21 -12.875 -4.972 -2.170
98 HB3 GLU 21 1HB GLU 21 -14.551 -5.305 -2.574
99 HG2 GLU 21 2HG GLU 21 -13.660 -3.085 -0.752
100 HG3 GLU 21 1HG GLU 21 -13.958 -2.894 -2.477
101 H GLU 22 H GLU 22 -14.230 -6.124 1.919
102 HA GLU 22 HA GLU 22 -12.250 -4.193 2.710
103 HB2 GLU 22 2HB GLU 22 -14.305 -4.449 4.006
104 HB3 GLU 22 1HB GLU 22 -13.905 -6.128 4.341
105 HG2 GLU 22 2HG GLU 22 -11.763 -5.168 5.406
106 HG3 GLU 22 1HG GLU 22 -12.641 -3.641 5.410
107 H ILE 23 H ILE 23 -10.150 -4.642 2.822
108 HA ILE 23 HA ILE 23 -9.478 -7.055 4.377
109 HB ILE 23 HB ILE 23 -7.760 -5.701 2.276
110 HG12 ILE 23 2HG1 ILE 23 -8.224 -8.638 2.461
111 HG13 ILE 23 1HG1 ILE 23 -9.510 -7.634 1.781
112 HG21 ILE 23 1HG2 ILE 23 -7.000 -7.847 4.256
113 HG22 ILE 23 2HG2 ILE 23 -6.449 -6.171 4.284
114 HG23 ILE 23 3HG2 ILE 23 -5.982 -7.231 2.955
115 HD11 ILE 23 3HD1 ILE 23 -6.668 -7.824 0.798
116 HD12 ILE 23 1HD1 ILE 23 -7.927 -6.797 0.109
117 HD13 ILE 23 2HD1 ILE 23 -8.087 -8.552 0.044
118 H GLN 24 H GLN 24 -8.986 -6.438 6.385
119 HA GLN 24 HA GLN 24 -7.903 -3.761 6.798
120 HB2 GLN 24 2HB GLN 24 -8.995 -5.829 8.700
121 HB3 GLN 24 1HB GLN 24 -8.189 -4.365 9.250
122 HG2 GLN 24 2HG GLN 24 -9.851 -3.005 8.121
123 HG3 GLN 24 1HG GLN 24 -10.649 -4.460 7.523
124 HE21 GLN 24 1HE2 GLN 24 -11.868 -5.693 8.908
125 HE22 GLN 24 2HE2 GLN 24 -12.338 -5.149 10.481
126 H CYS 25 H CYS 25 -5.811 -3.703 6.392
127 HA CYS 25 HA CYS 25 -4.093 -5.894 7.276
128 HG CYS 25 HG CYS 25 -1.186 -5.041 4.606
129 HB2 CYS 25 2HB CYS 25 -3.837 -5.003 4.965
130 HB3 CYS 25 1HB CYS 25 -3.401 -3.441 5.640
131 H ASN 26 H ASN 26 -3.552 -5.755 9.329
132 HA ASN 26 HA ASN 26 -2.793 -4.999 11.316
133 HB2 ASN 26 2HB ASN 26 -0.846 -4.427 9.754
134 HB3 ASN 26 1HB ASN 26 -1.433 -2.768 9.798
135 HD21 ASN 26 1HD2 ASN 26 -1.143 -1.557 11.627
136 HD22 ASN 26 2HD2 ASN 26 -0.137 -2.052 12.943
137 H GLY 27 H GLY 27 -5.313 -4.318 10.935
138 HA2 GLY 27 2HA GLY 27 -6.922 -3.018 11.922
139 HA3 GLY 27 1HA GLY 27 -5.626 -2.152 12.730
140 H ARG 28 H ARG 28 -6.117 -2.409 9.234
141 HA ARG 28 HA ARG 28 -7.227 0.279 9.133
142 HE ARG 28 HE ARG 28 -5.115 3.952 6.494
143 HB2 ARG 28 2HB ARG 28 -4.665 0.386 9.118
144 HB3 ARG 28 1HB ARG 28 -4.755 -0.353 7.528
145 HG2 ARG 28 2HG ARG 28 -5.980 1.530 6.665
146 HG3 ARG 28 1HG ARG 28 -6.065 2.256 8.275
147 HD2 ARG 28 2HD ARG 28 -3.587 2.330 8.309
148 HD3 ARG 28 1HD ARG 28 -3.579 1.735 6.651
149 HH11 ARG 28 1HH1 ARG 28 -1.968 3.332 7.889
150 HH12 ARG 28 2HH1 ARG 28 -1.352 4.920 7.544
151 HH21 ARG 28 1HH2 ARG 28 -4.314 6.072 6.042
152 HH22 ARG 28 2HH2 ARG 28 -2.680 6.476 6.504
153 H SER 29 H SER 29 -8.682 0.447 7.506
154 HA SER 29 HA SER 29 -9.210 -1.982 6.030
155 HG SER 29 HG SER 29 -12.041 -1.218 7.392
156 HB2 SER 29 2HB SER 29 -10.766 0.609 6.040
157 HB3 SER 29 1HB SER 29 -11.324 -0.949 5.436
158 H PHE 30 H PHE 30 -8.628 -2.369 4.017
159 HA PHE 30 HA PHE 30 -8.333 -0.113 2.147
160 HD1 PHE 30 HD2 PHE 30 -5.957 1.038 2.042
161 HD2 PHE 30 HD1 PHE 30 -5.295 -2.658 4.045
162 HE1 PHE 30 HE2 PHE 30 -4.304 2.129 3.503
163 HE2 PHE 30 HE1 PHE 30 -3.641 -1.574 5.508
164 HZ PHE 30 HZ PHE 30 -3.140 0.821 5.236
165 HB2 PHE 30 2HB PHE 30 -6.625 -2.621 2.178
166 HB3 PHE 30 1HB PHE 30 -6.499 -1.291 1.032
167 H HIS 31 H HIS 31 -8.833 -0.682 -0.079
168 HA HIS 31 HA HIS 31 -10.886 -2.646 -0.399
169 HD2 HIS 31 HD2 HIS 31 -12.940 -1.408 -0.992
170 HE1 HIS 31 HE1 HIS 31 -12.241 2.600 -2.108
171 HE2 HIS 31 HE2 HIS 31 -13.919 0.980 -1.132
172 HB2 HIS 31 2HB HIS 31 -9.294 -1.049 -2.423
173 HB3 HIS 31 1HB HIS 31 -10.557 -2.184 -2.883
174 H LYS 32 H LYS 32 -10.757 -4.588 -1.709
175 HA LYS 32 HA LYS 32 -8.461 -6.163 -1.392
176 HB2 LYS 32 2HB LYS 32 -10.779 -6.388 -3.312
177 HB3 LYS 32 1HB LYS 32 -9.500 -7.593 -3.227
178 HG2 LYS 32 2HG LYS 32 -10.039 -8.071 -0.928
179 HG3 LYS 32 1HG LYS 32 -11.245 -6.782 -0.910
180 HD2 LYS 32 2HD LYS 32 -12.601 -7.958 -2.514
181 HD3 LYS 32 1HD LYS 32 -11.356 -9.192 -2.722
182 HE2 LYS 32 2HE LYS 32 -12.728 -8.627 -0.098
183 HE3 LYS 32 1HE LYS 32 -13.276 -9.850 -1.243
184 HZ1 LYS 32 3HZ LYS 32 -11.775 -10.627 0.621
185 HZ2 LYS 32 1HZ LYS 32 -10.512 -9.827 -0.177
186 HZ3 LYS 32 2HZ LYS 32 -11.328 -11.094 -0.946
187 H THR 33 H THR 33 -9.382 -3.878 -3.820
188 HA THR 33 HA THR 33 -7.237 -4.499 -5.635
189 HB THR 33 HB THR 33 -8.033 -2.129 -6.501
190 HG1 THR 33 HG1 THR 33 -9.634 -1.368 -5.351
191 HG21 THR 33 3HG2 THR 33 -8.333 -4.194 -7.737
192 HG22 THR 33 1HG2 THR 33 -9.824 -3.252 -7.781
193 HG23 THR 33 2HG2 THR 33 -9.691 -4.647 -6.707
194 H CYS 34 H CYS 34 -7.324 -3.033 -2.664
195 HA CYS 34 HA CYS 34 -5.081 -1.250 -3.346
196 HB2 CYS 34 2HB CYS 34 -7.140 -0.834 -1.169
197 HB3 CYS 34 1HB CYS 34 -5.847 0.280 -1.630
198 H PHE 35 H PHE 35 -5.744 -4.083 -1.929
199 HA PHE 35 HA PHE 35 -4.210 -3.837 0.470
200 HD1 PHE 35 HD2 PHE 35 -4.586 -5.306 2.480
201 HD2 PHE 35 HD1 PHE 35 -3.476 -8.029 -0.597
202 HE1 PHE 35 HE2 PHE 35 -3.302 -6.619 4.108
203 HE2 PHE 35 HE1 PHE 35 -2.193 -9.346 1.033
204 HZ PHE 35 HZ PHE 35 -2.115 -8.638 3.383
205 HB2 PHE 35 2HB PHE 35 -5.903 -5.599 0.260
206 HB3 PHE 35 1HB PHE 35 -4.995 -6.317 -1.071
207 H HIS 36 H HIS 36 -3.489 -4.172 -2.816
208 HA HIS 36 HA HIS 36 -0.951 -5.437 -2.278
209 HD1 HIS 36 HD1 HIS 36 -4.004 -5.507 -5.691
210 HD2 HIS 36 HD2 HIS 36 -1.006 -2.626 -5.649
211 HE1 HIS 36 HE1 HIS 36 -4.699 -3.780 -7.375
212 HE2 HIS 36 HE2 HIS 36 -2.781 -2.156 -7.481
213 HB2 HIS 36 2HB HIS 36 -0.568 -5.402 -4.700
214 HB3 HIS 36 1HB HIS 36 -2.085 -6.174 -4.281
215 H CYS 37 H CYS 37 0.985 -4.398 -3.488
216 HA CYS 37 HA CYS 37 1.931 -2.690 -1.630
217 HB2 CYS 37 2HB CYS 37 3.254 -3.955 -3.229
218 HB3 CYS 37 1HB CYS 37 2.756 -2.861 -4.516
219 H MET 38 H MET 38 1.917 -0.637 -1.155
220 HA MET 38 HA MET 38 0.266 1.218 -2.567
221 HB2 MET 38 2HB MET 38 2.198 1.676 -0.286
222 HB3 MET 38 1HB MET 38 0.976 2.814 -0.841
223 HG2 MET 38 2HG MET 38 0.443 0.092 0.319
224 HG3 MET 38 1HG MET 38 0.269 1.626 1.168
225 HE1 MET 38 3HE MET 38 -2.001 -0.655 0.871
226 HE2 MET 38 1HE MET 38 -3.423 0.358 0.615
227 HE3 MET 38 2HE MET 38 -2.213 0.822 1.810
228 H ALA 39 H ALA 39 3.513 0.248 -2.835
229 HA ALA 39 HA ALA 39 4.357 2.808 -3.989
230 HB1 ALA 39 3HB ALA 39 5.826 1.806 -2.306
231 HB2 ALA 39 1HB ALA 39 6.621 1.930 -3.874
232 HB3 ALA 39 2HB ALA 39 6.004 0.374 -3.319
233 H CYS 40 H CYS 40 5.107 -0.586 -4.819
234 HA CYS 40 HA CYS 40 5.282 0.251 -7.600
235 HB2 CYS 40 2HB CYS 40 6.481 -1.746 -8.022
236 HB3 CYS 40 1HB CYS 40 7.066 -1.155 -6.475
237 H ARG 41 H ARG 41 3.042 -1.101 -5.550
238 HA ARG 41 HA ARG 41 0.925 -1.798 -5.826
239 HE ARG 41 HE ARG 41 -1.410 2.029 -6.442
240 HB2 ARG 41 2HB ARG 41 1.473 -0.952 -8.649
241 HB3 ARG 41 1HB ARG 41 -0.040 -1.741 -8.222
242 HG2 ARG 41 2HG ARG 41 1.012 0.794 -6.977
243 HG3 ARG 41 1HG ARG 41 -0.232 0.704 -8.228
244 HD2 ARG 41 2HD ARG 41 -1.657 -0.584 -6.722
245 HD3 ARG 41 1HD ARG 41 -0.408 -0.532 -5.483
246 HH11 ARG 41 1HH1 ARG 41 -1.389 -0.421 -3.935
247 HH12 ARG 41 2HH1 ARG 41 -2.180 0.580 -2.761
248 HH21 ARG 41 1HH2 ARG 41 -2.470 3.358 -4.901
249 HH22 ARG 41 2HH2 ARG 41 -2.795 2.737 -3.315
250 H LYS 42 H LYS 42 3.366 -3.577 -6.253
251 HA LYS 42 HA LYS 42 2.482 -5.834 -7.716
252 HB2 LYS 42 2HB LYS 42 4.803 -5.660 -6.999
253 HB3 LYS 42 1HB LYS 42 4.309 -5.624 -5.310
254 HG2 LYS 42 2HG LYS 42 3.398 -7.919 -5.582
255 HG3 LYS 42 1HG LYS 42 4.069 -7.943 -7.213
256 HD2 LYS 42 2HD LYS 42 6.311 -7.655 -6.300
257 HD3 LYS 42 1HD LYS 42 5.643 -7.582 -4.665
258 HE2 LYS 42 2HE LYS 42 5.375 -9.922 -6.544
259 HE3 LYS 42 1HE LYS 42 6.559 -9.811 -5.242
260 HZ1 LYS 42 3HZ LYS 42 3.612 -9.711 -4.855
261 HZ2 LYS 42 1HZ LYS 42 4.791 -9.767 -3.641
262 HZ3 LYS 42 2HZ LYS 42 4.556 -11.103 -4.651
263 H ALA 43 H ALA 43 1.351 -7.678 -7.015
264 HA ALA 43 HA ALA 43 -0.528 -7.293 -4.896
265 HB1 ALA 43 3HB ALA 43 -1.287 -9.557 -5.426
266 HB2 ALA 43 1HB ALA 43 0.118 -9.789 -6.467
267 HB3 ALA 43 2HB ALA 43 -1.104 -8.589 -6.890
268 H LEU 44 H LEU 44 -0.338 -7.828 -2.815
269 HA LEU 44 HA LEU 44 2.040 -9.316 -1.965
270 HG LEU 44 HG LEU 44 2.429 -6.344 0.186
271 HB2 LEU 44 2HB LEU 44 0.320 -7.257 -0.643
272 HB3 LEU 44 1HB LEU 44 1.204 -8.396 0.348
273 HD11 LEU 44 1HD1 LEU 44 3.674 -8.563 -1.420
274 HD12 LEU 44 2HD1 LEU 44 3.818 -8.278 0.316
275 HD13 LEU 44 3HD1 LEU 44 4.558 -7.153 -0.830
276 HD21 LEU 44 3HD2 LEU 44 3.295 -5.504 -1.935
277 HD22 LEU 44 1HD2 LEU 44 1.534 -5.476 -1.876
278 HD23 LEU 44 2HD2 LEU 44 2.366 -6.733 -2.792
279 H ASP 45 H ASP 45 1.884 -10.978 -0.469
280 HA ASP 45 HA ASP 45 -0.725 -12.299 -0.353
281 HB2 ASP 45 2HB ASP 45 1.935 -13.365 0.631
282 HB3 ASP 45 1HB ASP 45 0.455 -14.278 0.359
283 H SER 46 H SER 46 -1.127 -13.427 1.836
284 HA SER 46 HA SER 46 -1.277 -11.441 3.856
285 HG SER 46 HG SER 46 -3.953 -13.631 3.782
286 HB2 SER 46 2HB SER 46 -1.635 -14.417 4.244
287 HB3 SER 46 1HB SER 46 -2.384 -13.109 5.160
288 H THR 47 H THR 47 1.114 -13.683 2.938
289 HA THR 47 HA THR 47 2.389 -13.696 5.573
290 HB THR 47 HB THR 47 3.430 -15.209 3.200
291 HG1 THR 47 HG1 THR 47 1.691 -16.404 3.153
292 HG21 THR 47 3HG2 THR 47 4.724 -15.205 5.283
293 HG22 THR 47 1HG2 THR 47 4.103 -16.816 4.919
294 HG23 THR 47 2HG2 THR 47 3.324 -15.826 6.156
295 H THR 48 H THR 48 2.743 -12.262 2.416
296 HA THR 48 HA THR 48 5.617 -11.888 2.841
297 HB THR 48 HB THR 48 5.621 -11.196 0.410
298 HG1 THR 48 HG1 THR 48 3.577 -12.327 -0.583
299 HG21 THR 48 3HG2 THR 48 6.323 -13.427 1.156
300 HG22 THR 48 1HG2 THR 48 5.510 -13.497 -0.406
301 HG23 THR 48 2HG2 THR 48 4.653 -13.985 1.056
302 H VAL 49 H VAL 49 2.813 -10.143 3.283
303 HA VAL 49 HA VAL 49 3.716 -7.599 2.349
304 HB VAL 49 HB VAL 49 1.396 -7.717 2.456
305 HG11 VAL 49 1HG1 VAL 49 0.122 -8.434 4.439
306 HG12 VAL 49 2HG1 VAL 49 1.637 -8.769 5.279
307 HG13 VAL 49 3HG1 VAL 49 1.194 -9.708 3.853
308 HG21 VAL 49 3HG2 VAL 49 2.184 -5.610 3.358
309 HG22 VAL 49 1HG2 VAL 49 2.228 -6.297 4.981
310 HG23 VAL 49 2HG2 VAL 49 0.685 -6.095 4.151
311 H ALA 50 H ALA 50 4.875 -6.089 3.319
312 HA ALA 50 HA ALA 50 5.683 -6.508 6.113
313 HB1 ALA 50 3HB ALA 50 7.496 -6.318 4.451
314 HB2 ALA 50 1HB ALA 50 7.535 -5.009 5.633
315 HB3 ALA 50 2HB ALA 50 6.903 -4.713 4.014
316 H ALA 51 H ALA 51 4.366 -5.469 7.470
317 HA ALA 51 HA ALA 51 3.367 -2.818 6.692
318 HB1 ALA 51 3HB ALA 51 1.638 -4.519 7.088
319 HB2 ALA 51 1HB ALA 51 1.531 -3.176 8.227
320 HB3 ALA 51 2HB ALA 51 2.228 -4.713 8.739
321 H HIS 52 H HIS 52 4.707 -1.332 7.490
322 HA HIS 52 HA HIS 52 5.769 -1.644 10.211
323 HD1 HIS 52 HD1 HIS 52 9.151 -1.294 9.905
324 HD2 HIS 52 HD2 HIS 52 6.900 2.145 10.550
325 HE1 HIS 52 HE1 HIS 52 10.382 0.004 11.666
326 HE2 HIS 52 HE2 HIS 52 8.888 1.958 12.200
327 HB2 HIS 52 2HB HIS 52 7.280 -1.033 8.256
328 HB3 HIS 52 1HB HIS 52 6.451 0.517 8.204
329 H GLU 53 H GLU 53 4.616 -0.784 11.788
330 HA GLU 53 HA GLU 53 3.190 0.502 12.980
331 HB2 GLU 53 2HB GLU 53 3.790 2.626 10.914
332 HB3 GLU 53 1HB GLU 53 2.937 2.898 12.426
333 HG2 GLU 53 2HG GLU 53 5.801 2.070 12.076
334 HG3 GLU 53 1HG GLU 53 5.198 3.620 12.658
335 H SER 54 H SER 54 2.361 1.940 9.842
336 HA SER 54 HA SER 54 -0.043 0.309 9.675
337 HG SER 54 HG SER 54 -2.337 1.521 10.129
338 HB2 SER 54 2HB SER 54 -0.578 2.359 11.074
339 HB3 SER 54 1HB SER 54 -0.242 3.331 9.643
340 H GLU 55 H GLU 55 2.485 0.708 8.213
341 HA GLU 55 HA GLU 55 1.398 1.559 5.603
342 HB2 GLU 55 2HB GLU 55 4.197 1.867 6.701
343 HB3 GLU 55 1HB GLU 55 3.779 2.129 5.012
344 HG2 GLU 55 2HG GLU 55 2.403 3.979 5.547
345 HG3 GLU 55 1HG GLU 55 2.474 3.617 7.272
346 H ILE 56 H ILE 56 1.251 -0.026 4.176
347 HA ILE 56 HA ILE 56 2.746 -2.507 4.668
348 HB ILE 56 HB ILE 56 0.696 -3.407 4.665
349 HG12 ILE 56 2HG1 ILE 56 0.720 -2.754 1.711
350 HG13 ILE 56 1HG1 ILE 56 1.513 -4.137 2.457
351 HG21 ILE 56 1HG2 ILE 56 -0.366 -1.254 4.955
352 HG22 ILE 56 2HG2 ILE 56 -1.332 -2.271 3.886
353 HG23 ILE 56 3HG2 ILE 56 -0.337 -0.979 3.211
354 HD11 ILE 56 3HD1 ILE 56 -0.599 -4.761 1.415
355 HD12 ILE 56 1HD1 ILE 56 -1.451 -3.610 2.444
356 HD13 ILE 56 2HD1 ILE 56 -0.651 -5.008 3.160
357 H TYR 57 H TYR 57 4.145 -3.266 3.219
358 HA TYR 57 HA TYR 57 3.929 -2.535 0.406
359 HD1 TYR 57 HD2 TYR 57 5.082 -0.106 -0.764
360 HD2 TYR 57 HD1 TYR 57 5.777 -0.309 3.429
361 HE1 TYR 57 HE2 TYR 57 4.536 2.279 -0.562
362 HE2 TYR 57 HE1 TYR 57 5.234 2.075 3.639
363 HH TYR 57 HH TYR 57 4.071 3.946 0.868
364 HB2 TYR 57 2HB TYR 57 6.460 -2.090 2.012
365 HB3 TYR 57 1HB TYR 57 6.344 -1.973 0.264
366 H CYS 58 H CYS 58 5.632 -3.749 -0.900
367 HA CYS 58 HA CYS 58 5.866 -6.478 -0.329
368 HB2 CYS 58 2HB CYS 58 7.813 -4.809 -1.907
369 HB3 CYS 58 1HB CYS 58 7.569 -6.536 -2.057
370 H LYS 59 H LYS 59 7.933 -7.652 0.162
371 HA LYS 59 HA LYS 59 9.392 -6.462 2.329
372 HB2 LYS 59 2HB LYS 59 9.851 -9.011 0.777
373 HB3 LYS 59 1HB LYS 59 10.816 -8.519 2.162
374 HG2 LYS 59 2HG LYS 59 8.703 -8.497 3.504
375 HG3 LYS 59 1HG LYS 59 7.898 -9.236 2.114
376 HD2 LYS 59 2HD LYS 59 9.492 -11.092 2.194
377 HD3 LYS 59 1HD LYS 59 10.270 -10.360 3.596
378 HE2 LYS 59 2HE LYS 59 8.114 -10.517 4.811
379 HE3 LYS 59 1HE LYS 59 7.441 -11.376 3.423
380 HZ1 LYS 59 3HZ LYS 59 8.160 -12.959 5.043
381 HZ2 LYS 59 1HZ LYS 59 9.702 -12.255 5.131
382 HZ3 LYS 59 2HZ LYS 59 9.208 -13.047 3.715
383 H VAL 60 H VAL 60 9.829 -6.928 -1.096
384 HA VAL 60 HA VAL 60 12.530 -6.060 -1.245
385 HB VAL 60 HB VAL 60 10.351 -5.877 -3.347
386 HG11 VAL 60 1HG1 VAL 60 12.286 -4.394 -3.784
387 HG12 VAL 60 2HG1 VAL 60 12.132 -5.690 -4.969
388 HG13 VAL 60 3HG1 VAL 60 13.350 -5.800 -3.699
389 HG21 VAL 60 3HG2 VAL 60 12.434 -7.996 -2.831
390 HG22 VAL 60 1HG2 VAL 60 11.363 -7.942 -4.233
391 HG23 VAL 60 2HG2 VAL 60 10.690 -8.159 -2.617
392 H CYS 61 H CYS 61 9.420 -4.410 -1.479
393 HA CYS 61 HA CYS 61 10.524 -1.839 -1.958
394 HB2 CYS 61 2HB CYS 61 7.778 -2.815 -1.175
395 HB3 CYS 61 1HB CYS 61 8.144 -1.100 -1.379
396 H TYR 62 H TYR 62 9.328 -3.484 0.943
397 HA TYR 62 HA TYR 62 9.780 -1.374 2.756
398 HD1 TYR 62 HD2 TYR 62 8.101 -1.711 5.048
399 HD2 TYR 62 HD1 TYR 62 11.369 -4.434 5.145
400 HE1 TYR 62 HE2 TYR 62 8.414 -1.244 7.441
401 HE2 TYR 62 HE1 TYR 62 11.687 -3.970 7.536
402 HH TYR 62 HH TYR 62 9.385 -2.202 9.397
403 HB2 TYR 62 2HB TYR 62 8.463 -3.418 3.261
404 HB3 TYR 62 1HB TYR 62 9.947 -4.359 3.245
405 H GLY 63 H GLY 63 11.819 -4.006 1.588
406 HA2 GLY 63 2HA GLY 63 14.075 -3.326 3.203
407 HA3 GLY 63 1HA GLY 63 14.056 -4.447 1.849
408 H ARG 64 H ARG 64 12.811 -1.973 0.346
409 HA ARG 64 HA ARG 64 15.355 -0.896 -0.528
410 HE ARG 64 HE ARG 64 14.789 2.205 -4.458
411 HB2 ARG 64 2HB ARG 64 13.526 -1.401 -2.146
412 HB3 ARG 64 1HB ARG 64 12.557 -0.140 -1.395
413 HG2 ARG 64 2HG ARG 64 14.253 1.518 -2.016
414 HG3 ARG 64 1HG ARG 64 15.192 0.247 -2.801
415 HD2 ARG 64 2HD ARG 64 13.155 -0.198 -4.229
416 HD3 ARG 64 1HD ARG 64 12.478 1.291 -3.570
417 HH11 ARG 64 1HH1 ARG 64 12.442 0.112 -5.991
418 HH12 ARG 64 2HH1 ARG 64 12.990 0.461 -7.608
419 HH21 ARG 64 1HH2 ARG 64 15.490 2.707 -6.584
420 HH22 ARG 64 2HH2 ARG 64 14.706 1.967 -7.948
421 H ARG 65 H ARG 65 12.359 0.291 0.919
422 HA ARG 65 HA ARG 65 13.134 2.925 1.407
423 HE ARG 65 HE ARG 65 10.150 4.327 5.527
424 HB2 ARG 65 2HB ARG 65 10.832 2.212 1.624
425 HB3 ARG 65 1HB ARG 65 11.253 1.106 2.919
426 HG2 ARG 65 2HG ARG 65 11.728 2.939 4.402
427 HG3 ARG 65 1HG ARG 65 11.486 4.103 3.095
428 HD2 ARG 65 2HD ARG 65 9.170 3.573 2.946
429 HD3 ARG 65 1HD ARG 65 9.355 2.186 4.019
430 HH11 ARG 65 1HH1 ARG 65 7.257 3.576 3.702
431 HH12 ARG 65 2HH1 ARG 65 6.190 4.392 4.810
432 HH21 ARG 65 1HH2 ARG 65 8.751 5.388 6.983
433 HH22 ARG 65 2HH2 ARG 65 7.041 5.416 6.668
434 H TYR 66 H TYR 66 13.567 -0.003 3.315
435 HA TYR 66 HA TYR 66 15.305 1.464 5.175
436 HD1 TYR 66 HD2 TYR 66 11.737 -0.164 5.198
437 HD2 TYR 66 HD1 TYR 66 14.549 1.026 8.168
438 HE1 TYR 66 HE2 TYR 66 9.949 0.988 6.430
439 HE2 TYR 66 HE1 TYR 66 12.764 2.173 9.405
440 HH TYR 66 HH TYR 66 10.560 3.170 8.950
441 HB2 TYR 66 2HB TYR 66 13.959 -1.235 5.380
442 HB3 TYR 66 1HB TYR 66 15.135 -0.649 6.551
Start of MODEL 7
1 H1 GLY 7 1H GLY 7 -20.393 4.196 4.802
2 HA2 GLY 7 2HA GLY 7 -20.019 1.850 6.247
3 HA3 GLY 7 1HA GLY 7 -19.378 1.559 4.635
4 H ALA 8 H ALA 8 -17.277 1.358 5.380
5 HA ALA 8 HA ALA 8 -16.055 3.626 6.763
6 HB1 ALA 8 3HB ALA 8 -15.609 1.359 7.595
7 HB2 ALA 8 1HB ALA 8 -14.130 2.146 7.040
8 HB3 ALA 8 2HB ALA 8 -14.913 0.928 6.035
9 H LYS 9 H LYS 9 -13.492 3.625 5.835
10 HA LYS 9 HA LYS 9 -13.783 4.111 2.955
11 HB2 LYS 9 2HB LYS 9 -12.565 6.135 3.054
12 HB3 LYS 9 1HB LYS 9 -13.760 6.249 4.335
13 HG2 LYS 9 2HG LYS 9 -12.116 5.818 6.004
14 HG3 LYS 9 1HG LYS 9 -10.905 5.409 4.785
15 HD2 LYS 9 2HD LYS 9 -12.198 8.119 5.120
16 HD3 LYS 9 1HD LYS 9 -10.597 7.677 5.719
17 HE2 LYS 9 2HE LYS 9 -11.409 7.538 2.816
18 HE3 LYS 9 1HE LYS 9 -10.612 8.930 3.545
19 HZ1 LYS 9 3HZ LYS 9 -9.481 6.181 3.463
20 HZ2 LYS 9 1HZ LYS 9 -8.705 7.566 4.055
21 HZ3 LYS 9 2HZ LYS 9 -9.062 7.426 2.405
22 H CYS 10 H CYS 10 -11.875 3.885 1.753
23 HA CYS 10 HA CYS 10 -10.238 1.720 2.570
24 HB2 CYS 10 2HB CYS 10 -10.926 2.217 0.239
25 HB3 CYS 10 1HB CYS 10 -9.916 3.650 0.267
26 H GLY 11 H GLY 11 -8.361 1.731 3.580
27 HA2 GLY 11 2HA GLY 11 -7.109 4.101 4.519
28 HA3 GLY 11 1HA GLY 11 -6.431 2.480 4.583
29 H ALA 12 H ALA 12 -7.093 2.718 1.459
30 HA ALA 12 HA ALA 12 -4.530 4.008 0.803
31 HB1 ALA 12 3HB ALA 12 -4.642 1.628 0.216
32 HB2 ALA 12 1HB ALA 12 -4.492 2.645 -1.218
33 HB3 ALA 12 2HB ALA 12 -6.055 1.949 -0.789
34 H CYS 13 H CYS 13 -7.867 3.583 -0.336
35 HA CYS 13 HA CYS 13 -7.638 5.808 -2.188
36 HB2 CYS 13 2HB CYS 13 -10.058 4.184 -1.362
37 HB3 CYS 13 1HB CYS 13 -10.013 5.352 -2.673
38 H GLU 14 H GLU 14 -9.522 7.406 -2.136
39 HA GLU 14 HA GLU 14 -10.235 8.159 0.618
40 HB2 GLU 14 2HB GLU 14 -10.673 9.723 -1.936
41 HB3 GLU 14 1HB GLU 14 -10.897 10.304 -0.292
42 HG2 GLU 14 2HG GLU 14 -8.478 10.013 0.101
43 HG3 GLU 14 1HG GLU 14 -8.289 9.548 -1.587
44 H LYS 15 H LYS 15 -11.131 6.057 -1.439
45 HA LYS 15 HA LYS 15 -13.955 6.633 -1.762
46 HB2 LYS 15 2HB LYS 15 -12.387 4.150 -2.505
47 HB3 LYS 15 1HB LYS 15 -14.019 4.545 -3.027
48 HG2 LYS 15 2HG LYS 15 -11.498 6.021 -3.758
49 HG3 LYS 15 1HG LYS 15 -12.446 4.966 -4.809
50 HD2 LYS 15 2HD LYS 15 -14.339 6.499 -4.644
51 HD3 LYS 15 1HD LYS 15 -13.411 7.540 -3.563
52 HE2 LYS 15 2HE LYS 15 -13.359 8.465 -5.784
53 HE3 LYS 15 1HE LYS 15 -11.754 7.863 -5.374
54 HZ1 LYS 15 3HZ LYS 15 -13.730 6.326 -6.966
55 HZ2 LYS 15 1HZ LYS 15 -12.096 5.948 -6.721
56 HZ3 LYS 15 2HZ LYS 15 -12.523 7.299 -7.653
57 H THR 16 H THR 16 -15.278 4.437 -1.401
58 HA THR 16 HA THR 16 -15.159 4.094 1.488
59 HB THR 16 HB THR 16 -17.449 2.956 0.882
60 HG1 THR 16 HG1 THR 16 -18.283 3.538 -1.021
61 HG21 THR 16 3HG2 THR 16 -17.198 4.946 2.279
62 HG22 THR 16 1HG2 THR 16 -18.549 5.138 1.163
63 HG23 THR 16 2HG2 THR 16 -17.015 5.944 0.836
64 H VAL 17 H VAL 17 -15.073 2.175 2.515
65 HA VAL 17 HA VAL 17 -14.719 -0.256 0.882
66 HB VAL 17 HB VAL 17 -13.392 0.608 3.439
67 HG11 VAL 17 1HG1 VAL 17 -13.622 -2.242 2.471
68 HG12 VAL 17 2HG1 VAL 17 -14.306 -1.592 3.961
69 HG13 VAL 17 3HG1 VAL 17 -12.556 -1.686 3.761
70 HG21 VAL 17 3HG2 VAL 17 -12.256 1.035 1.344
71 HG22 VAL 17 1HG2 VAL 17 -12.389 -0.671 0.911
72 HG23 VAL 17 2HG2 VAL 17 -11.391 -0.182 2.283
73 H TYR 18 H TYR 18 -15.988 -2.004 1.341
74 HA TYR 18 HA TYR 18 -17.953 -1.652 3.509
75 HD1 TYR 18 HD1 TYR 18 -20.111 -0.214 2.472
76 HD2 TYR 18 HD2 TYR 18 -17.914 -1.697 -0.856
77 HE1 TYR 18 HE1 TYR 18 -20.526 1.890 1.266
78 HE2 TYR 18 HE2 TYR 18 -18.326 0.400 -2.074
79 HH TYR 18 HH TYR 18 -19.962 2.251 -2.061
80 HB2 TYR 18 2HB TYR 18 -18.421 -3.143 0.920
81 HB3 TYR 18 1HB TYR 18 -19.619 -2.698 2.132
82 H HIS 19 H HIS 19 -19.095 -4.157 3.526
83 HA HIS 19 HA HIS 19 -17.095 -5.676 4.861
84 HD1 HIS 19 HD1 HIS 19 -20.191 -8.964 4.273
85 HD2 HIS 19 HD2 HIS 19 -20.836 -5.189 2.648
86 HE1 HIS 19 HE1 HIS 19 -21.970 -9.271 2.518
87 HE2 HIS 19 HE2 HIS 19 -22.125 -7.032 1.378
88 HB2 HIS 19 2HB HIS 19 -18.795 -7.258 5.363
89 HB3 HIS 19 1HB HIS 19 -19.566 -5.678 5.401
90 H ALA 20 H ALA 20 -17.941 -5.454 1.599
91 HA ALA 20 HA ALA 20 -17.585 -8.169 0.809
92 HB1 ALA 20 3HB ALA 20 -17.662 -7.288 -1.461
93 HB2 ALA 20 1HB ALA 20 -17.500 -5.645 -0.836
94 HB3 ALA 20 2HB ALA 20 -18.945 -6.592 -0.472
95 H GLU 21 H GLU 21 -15.612 -5.250 0.379
96 HA GLU 21 HA GLU 21 -13.370 -6.980 -0.425
97 HB2 GLU 21 2HB GLU 21 -12.554 -5.029 -1.698
98 HB3 GLU 21 1HB GLU 21 -14.149 -5.532 -2.219
99 HG2 GLU 21 2HG GLU 21 -13.683 -3.275 -0.291
100 HG3 GLU 21 1HG GLU 21 -13.767 -3.054 -2.035
101 H GLU 22 H GLU 22 -13.934 -6.499 2.287
102 HA GLU 22 HA GLU 22 -12.177 -4.370 3.186
103 HB2 GLU 22 2HB GLU 22 -14.304 -4.672 4.319
104 HB3 GLU 22 1HB GLU 22 -13.892 -6.335 4.712
105 HG2 GLU 22 2HG GLU 22 -12.034 -5.521 6.107
106 HG3 GLU 22 1HG GLU 22 -12.515 -3.864 5.742
107 H ILE 23 H ILE 23 -10.060 -4.765 3.242
108 HA ILE 23 HA ILE 23 -9.236 -7.149 4.778
109 HB ILE 23 HB ILE 23 -7.755 -5.743 2.551
110 HG12 ILE 23 2HG1 ILE 23 -8.125 -8.698 2.975
111 HG13 ILE 23 1HG1 ILE 23 -9.358 -7.730 2.160
112 HG21 ILE 23 1HG2 ILE 23 -6.222 -5.996 4.437
113 HG22 ILE 23 2HG2 ILE 23 -5.792 -7.092 3.124
114 HG23 ILE 23 3HG2 ILE 23 -6.629 -7.709 4.548
115 HD11 ILE 23 3HD1 ILE 23 -6.504 -8.138 1.295
116 HD12 ILE 23 1HD1 ILE 23 -7.657 -7.066 0.500
117 HD13 ILE 23 2HD1 ILE 23 -7.952 -8.805 0.537
118 H GLN 24 H GLN 24 -8.530 -6.619 6.750
119 HA GLN 24 HA GLN 24 -7.691 -3.841 7.174
120 HB2 GLN 24 2HB GLN 24 -8.837 -5.842 9.116
121 HB3 GLN 24 1HB GLN 24 -8.239 -4.254 9.576
122 HG2 GLN 24 2HG GLN 24 -9.908 -3.267 8.001
123 HG3 GLN 24 1HG GLN 24 -10.569 -4.886 7.788
124 HE21 GLN 24 1HE2 GLN 24 -10.061 -5.615 10.567
125 HE22 GLN 24 2HE2 GLN 24 -11.277 -4.811 11.493
126 H CYS 25 H CYS 25 -5.625 -3.532 7.337
127 HA CYS 25 HA CYS 25 -3.952 -5.671 8.457
128 HG CYS 25 HG CYS 25 -0.626 -3.699 7.054
129 HB2 CYS 25 2HB CYS 25 -3.398 -4.955 6.147
130 HB3 CYS 25 1HB CYS 25 -3.130 -3.321 6.737
131 H ASN 26 H ASN 26 -3.976 -5.313 10.581
132 HA ASN 26 HA ASN 26 -3.256 -4.479 12.552
133 HB2 ASN 26 2HB ASN 26 -1.226 -3.760 11.318
134 HB3 ASN 26 1HB ASN 26 -2.009 -2.220 10.981
135 HD21 ASN 26 1HD2 ASN 26 -0.492 -1.030 12.079
136 HD22 ASN 26 2HD2 ASN 26 -0.341 -1.058 13.803
137 H GLY 27 H GLY 27 -3.944 -1.484 10.699
138 HA2 GLY 27 2HA GLY 27 -6.256 -1.016 12.421
139 HA3 GLY 27 1HA GLY 27 -4.941 0.139 12.542
140 H ARG 28 H ARG 28 -5.252 -1.122 9.402
141 HA ARG 28 HA ARG 28 -6.972 1.133 8.625
142 HE ARG 28 HE ARG 28 -4.098 3.075 5.656
143 HB2 ARG 28 2HB ARG 28 -4.381 0.320 7.292
144 HB3 ARG 28 1HB ARG 28 -5.538 1.447 6.595
145 HG2 ARG 28 2HG ARG 28 -5.208 2.994 8.392
146 HG3 ARG 28 1HG ARG 28 -4.192 1.841 9.259
147 HD2 ARG 28 2HD ARG 28 -2.722 3.390 8.248
148 HD3 ARG 28 1HD ARG 28 -2.628 1.924 7.280
149 HH11 ARG 28 1HH1 ARG 28 -2.433 5.021 8.022
150 HH12 ARG 28 2HH1 ARG 28 -2.252 6.396 6.969
151 HH21 ARG 28 1HH2 ARG 28 -3.906 4.901 4.254
152 HH22 ARG 28 2HH2 ARG 28 -3.094 6.331 4.831
153 H SER 29 H SER 29 -8.570 0.632 7.284
154 HA SER 29 HA SER 29 -8.746 -2.107 6.299
155 HG SER 29 HG SER 29 -11.197 -1.800 8.156
156 HB2 SER 29 2HB SER 29 -10.871 0.042 6.198
157 HB3 SER 29 1HB SER 29 -11.096 -1.701 6.063
158 H PHE 30 H PHE 30 -8.030 -2.489 4.300
159 HA PHE 30 HA PHE 30 -8.172 -0.326 2.304
160 HD1 PHE 30 HD2 PHE 30 -5.555 0.725 1.972
161 HD2 PHE 30 HD1 PHE 30 -5.282 -2.868 4.232
162 HE1 PHE 30 HE2 PHE 30 -3.825 1.751 3.388
163 HE2 PHE 30 HE1 PHE 30 -3.555 -1.846 5.655
164 HZ PHE 30 HZ PHE 30 -2.822 0.462 5.231
165 HB2 PHE 30 2HB PHE 30 -6.482 -2.839 2.219
166 HB3 PHE 30 1HB PHE 30 -6.391 -1.473 1.116
167 H HIS 31 H HIS 31 -8.700 -0.970 0.092
168 HA HIS 31 HA HIS 31 -10.815 -2.855 -0.142
169 HD2 HIS 31 HD2 HIS 31 -12.834 -1.732 -0.906
170 HE1 HIS 31 HE1 HIS 31 -12.153 2.188 -2.299
171 HE2 HIS 31 HE2 HIS 31 -13.782 0.665 -1.132
172 HB2 HIS 31 2HB HIS 31 -9.140 -1.422 -2.211
173 HB3 HIS 31 1HB HIS 31 -10.363 -2.601 -2.663
174 H LYS 32 H LYS 32 -10.777 -4.879 -1.291
175 HA LYS 32 HA LYS 32 -8.656 -6.606 -0.808
176 HB2 LYS 32 2HB LYS 32 -10.958 -7.320 -1.437
177 HB3 LYS 32 1HB LYS 32 -10.648 -6.784 -3.082
178 HG2 LYS 32 2HG LYS 32 -8.814 -8.429 -3.235
179 HG3 LYS 32 1HG LYS 32 -9.234 -9.004 -1.619
180 HD2 LYS 32 2HD LYS 32 -11.489 -9.568 -2.430
181 HD3 LYS 32 1HD LYS 32 -11.025 -9.030 -4.046
182 HE2 LYS 32 2HE LYS 32 -10.852 -11.425 -3.940
183 HE3 LYS 32 1HE LYS 32 -9.232 -10.741 -4.053
184 HZ1 LYS 32 3HZ LYS 32 -10.554 -11.723 -1.578
185 HZ2 LYS 32 1HZ LYS 32 -9.009 -11.024 -1.648
186 HZ3 LYS 32 2HZ LYS 32 -9.305 -12.502 -2.422
187 H THR 33 H THR 33 -9.394 -4.626 -3.620
188 HA THR 33 HA THR 33 -7.177 -5.439 -5.196
189 HB THR 33 HB THR 33 -8.630 -2.790 -5.336
190 HG1 THR 33 HG1 THR 33 -10.193 -4.400 -5.450
191 HG21 THR 33 3HG2 THR 33 -8.062 -2.902 -7.719
192 HG22 THR 33 1HG2 THR 33 -7.202 -4.416 -7.444
193 HG23 THR 33 2HG2 THR 33 -6.614 -2.922 -6.712
194 H CYS 34 H CYS 34 -7.573 -3.167 -2.596
195 HA CYS 34 HA CYS 34 -5.100 -1.766 -3.240
196 HB2 CYS 34 2HB CYS 34 -7.172 -1.228 -1.106
197 HB3 CYS 34 1HB CYS 34 -5.793 -0.194 -1.488
198 H PHE 35 H PHE 35 -5.234 -4.569 -2.167
199 HA PHE 35 HA PHE 35 -3.893 -4.189 0.392
200 HD1 PHE 35 HD2 PHE 35 -4.174 -5.226 2.381
201 HD2 PHE 35 HD1 PHE 35 -3.437 -8.566 -0.145
202 HE1 PHE 35 HE2 PHE 35 -3.027 -6.372 4.234
203 HE2 PHE 35 HE1 PHE 35 -2.288 -9.716 1.696
204 HZ PHE 35 HZ PHE 35 -2.053 -8.525 3.917
205 HB2 PHE 35 2HB PHE 35 -5.616 -5.977 0.157
206 HB3 PHE 35 1HB PHE 35 -4.559 -6.791 -0.995
207 H HIS 36 H HIS 36 -3.039 -4.192 -2.797
208 HA HIS 36 HA HIS 36 -0.509 -5.561 -2.351
209 HD1 HIS 36 HD1 HIS 36 -3.403 -5.197 -5.893
210 HD2 HIS 36 HD2 HIS 36 -0.496 -2.307 -5.251
211 HE1 HIS 36 HE1 HIS 36 -4.086 -3.239 -7.309
212 HE2 HIS 36 HE2 HIS 36 -2.386 -1.453 -6.804
213 HB2 HIS 36 2HB HIS 36 -0.052 -5.221 -4.735
214 HB3 HIS 36 1HB HIS 36 -1.584 -6.032 -4.472
215 H CYS 37 H CYS 37 1.414 -4.271 -3.569
216 HA CYS 37 HA CYS 37 2.177 -2.584 -1.501
217 HB2 CYS 37 2HB CYS 37 3.670 -3.892 -3.029
218 HB3 CYS 37 1HB CYS 37 3.420 -2.644 -4.242
219 H MET 38 H MET 38 1.987 -0.569 -1.069
220 HA MET 38 HA MET 38 0.572 1.277 -2.732
221 HB2 MET 38 2HB MET 38 2.150 1.810 -0.208
222 HB3 MET 38 1HB MET 38 0.926 2.855 -0.918
223 HG2 MET 38 2HG MET 38 0.452 0.107 0.210
224 HG3 MET 38 1HG MET 38 0.071 1.632 1.005
225 HE1 MET 38 3HE MET 38 -1.928 -0.869 0.400
226 HE2 MET 38 1HE MET 38 -3.399 0.026 0.007
227 HE3 MET 38 2HE MET 38 -2.378 0.552 1.344
228 H ALA 39 H ALA 39 3.915 0.533 -2.129
229 HA ALA 39 HA ALA 39 4.914 3.115 -2.901
230 HB1 ALA 39 3HB ALA 39 6.390 0.534 -2.418
231 HB2 ALA 39 1HB ALA 39 6.082 1.800 -1.229
232 HB3 ALA 39 2HB ALA 39 7.127 2.125 -2.613
233 H CYS 40 H CYS 40 5.182 -0.157 -4.348
234 HA CYS 40 HA CYS 40 5.727 1.204 -6.879
235 HB2 CYS 40 2HB CYS 40 6.541 -0.957 -7.731
236 HB3 CYS 40 1HB CYS 40 7.424 -0.447 -6.302
237 H ARG 41 H ARG 41 4.448 -2.004 -6.657
238 HA ARG 41 HA ARG 41 1.749 -1.595 -6.375
239 HE ARG 41 HE ARG 41 -1.827 0.508 -8.023
240 HB2 ARG 41 2HB ARG 41 2.384 -0.478 -8.791
241 HB3 ARG 41 1HB ARG 41 1.935 -2.109 -9.270
242 HG2 ARG 41 2HG ARG 41 0.035 -0.562 -9.359
243 HG3 ARG 41 1HG ARG 41 -0.225 -1.864 -8.195
244 HD2 ARG 41 2HD ARG 41 0.444 -0.361 -6.373
245 HD3 ARG 41 1HD ARG 41 0.690 0.937 -7.537
246 HH11 ARG 41 1HH1 ARG 41 -0.293 0.275 -4.868
247 HH12 ARG 41 2HH1 ARG 41 -1.713 0.774 -4.003
248 HH21 ARG 41 1HH2 ARG 41 -3.694 1.157 -6.878
249 HH22 ARG 41 2HH2 ARG 41 -3.654 1.283 -5.143
250 H LYS 42 H LYS 42 4.128 -3.436 -6.165
251 HA LYS 42 HA LYS 42 3.654 -5.864 -7.475
252 HB2 LYS 42 2HB LYS 42 5.714 -5.353 -6.222
253 HB3 LYS 42 1HB LYS 42 4.804 -5.329 -4.721
254 HG2 LYS 42 2HG LYS 42 5.931 -7.395 -4.804
255 HG3 LYS 42 1HG LYS 42 4.236 -7.739 -5.149
256 HD2 LYS 42 2HD LYS 42 4.807 -7.685 -7.581
257 HD3 LYS 42 1HD LYS 42 6.506 -7.554 -7.119
258 HE2 LYS 42 2HE LYS 42 5.956 -9.861 -7.605
259 HE3 LYS 42 1HE LYS 42 6.310 -9.671 -5.887
260 HZ1 LYS 42 3HZ LYS 42 4.337 -11.062 -6.354
261 HZ2 LYS 42 1HZ LYS 42 3.568 -9.706 -7.020
262 HZ3 LYS 42 2HZ LYS 42 3.998 -9.722 -5.378
263 H ALA 43 H ALA 43 2.218 -7.500 -7.115
264 HA ALA 43 HA ALA 43 -0.033 -7.024 -5.431
265 HB1 ALA 43 3HB ALA 43 -0.769 -9.247 -6.157
266 HB2 ALA 43 1HB ALA 43 0.810 -9.529 -6.888
267 HB3 ALA 43 2HB ALA 43 -0.242 -8.262 -7.522
268 H LEU 44 H LEU 44 -0.251 -7.480 -3.335
269 HA LEU 44 HA LEU 44 1.734 -9.237 -2.078
270 HG LEU 44 HG LEU 44 2.293 -6.457 0.220
271 HB2 LEU 44 2HB LEU 44 0.213 -6.868 -1.111
272 HB3 LEU 44 1HB LEU 44 0.615 -8.117 0.050
273 HD11 LEU 44 1HD1 LEU 44 3.370 -8.728 -1.454
274 HD12 LEU 44 2HD1 LEU 44 3.134 -8.745 0.292
275 HD13 LEU 44 3HD1 LEU 44 4.325 -7.661 -0.426
276 HD21 LEU 44 3HD2 LEU 44 1.915 -5.311 -1.883
277 HD22 LEU 44 1HD2 LEU 44 2.618 -6.660 -2.772
278 HD23 LEU 44 2HD2 LEU 44 3.625 -5.699 -1.690
279 H ASP 45 H ASP 45 1.160 -10.999 -1.040
280 HA ASP 45 HA ASP 45 -1.686 -11.505 -0.500
281 HB2 ASP 45 2HB ASP 45 0.700 -13.375 -0.607
282 HB3 ASP 45 1HB ASP 45 -0.896 -13.864 -0.051
283 H SER 46 H SER 46 -2.095 -12.537 1.664
284 HA SER 46 HA SER 46 -1.117 -10.791 3.665
285 HG SER 46 HG SER 46 -1.597 -12.118 5.873
286 HB2 SER 46 2HB SER 46 -3.372 -11.819 3.718
287 HB3 SER 46 1HB SER 46 -2.632 -13.392 4.006
288 H THR 47 H THR 47 0.208 -13.604 2.368
289 HA THR 47 HA THR 47 1.736 -14.228 4.780
290 HB THR 47 HB THR 47 2.022 -15.745 2.216
291 HG1 THR 47 HG1 THR 47 0.087 -16.723 2.462
292 HG21 THR 47 3HG2 THR 47 3.388 -16.370 4.156
293 HG22 THR 47 1HG2 THR 47 2.242 -17.648 3.752
294 HG23 THR 47 2HG2 THR 47 1.928 -16.584 5.122
295 H THR 48 H THR 48 2.031 -12.026 2.428
296 HA THR 48 HA THR 48 4.950 -12.362 2.226
297 HB THR 48 HB THR 48 4.806 -11.445 -0.118
298 HG1 THR 48 HG1 THR 48 2.197 -11.328 0.557
299 HG21 THR 48 3HG2 THR 48 5.223 -13.814 0.310
300 HG22 THR 48 1HG2 THR 48 4.215 -13.604 -1.123
301 HG23 THR 48 2HG2 THR 48 3.487 -14.112 0.401
302 H VAL 49 H VAL 49 2.281 -10.204 2.666
303 HA VAL 49 HA VAL 49 3.563 -7.800 1.906
304 HB VAL 49 HB VAL 49 1.241 -7.636 1.964
305 HG11 VAL 49 1HG1 VAL 49 0.786 -9.598 3.347
306 HG12 VAL 49 2HG1 VAL 49 -0.146 -8.215 3.917
307 HG13 VAL 49 3HG1 VAL 49 1.303 -8.721 4.789
308 HG21 VAL 49 3HG2 VAL 49 2.181 -6.331 4.515
309 HG22 VAL 49 1HG2 VAL 49 0.709 -5.929 3.631
310 HG23 VAL 49 2HG2 VAL 49 2.285 -5.647 2.894
311 H ALA 50 H ALA 50 4.775 -6.370 2.972
312 HA ALA 50 HA ALA 50 5.542 -7.017 5.733
313 HB1 ALA 50 3HB ALA 50 6.938 -5.239 3.733
314 HB2 ALA 50 1HB ALA 50 7.387 -6.904 4.109
315 HB3 ALA 50 2HB ALA 50 7.520 -5.653 5.345
316 H ALA 51 H ALA 51 4.274 -5.958 7.114
317 HA ALA 51 HA ALA 51 3.388 -3.252 6.456
318 HB1 ALA 51 3HB ALA 51 1.660 -4.922 7.006
319 HB2 ALA 51 1HB ALA 51 1.673 -3.565 8.133
320 HB3 ALA 51 2HB ALA 51 2.379 -5.111 8.606
321 H HIS 52 H HIS 52 3.453 -1.619 8.010
322 HA HIS 52 HA HIS 52 5.016 -2.018 10.438
323 HD1 HIS 52 HD1 HIS 52 6.380 2.213 9.228
324 HD2 HIS 52 HD2 HIS 52 7.184 -0.890 11.889
325 HE1 HIS 52 HE1 HIS 52 7.465 3.289 11.231
326 HE2 HIS 52 HE2 HIS 52 7.739 1.423 12.900
327 HB2 HIS 52 2HB HIS 52 6.734 -1.296 8.890
328 HB3 HIS 52 1HB HIS 52 5.720 0.019 8.307
329 H GLU 53 H GLU 53 3.061 -1.723 11.495
330 HA GLU 53 HA GLU 53 1.498 -0.569 12.637
331 HB2 GLU 53 2HB GLU 53 3.204 1.815 11.907
332 HB3 GLU 53 1HB GLU 53 1.919 1.825 13.104
333 HG2 GLU 53 2HG GLU 53 3.127 0.157 14.422
334 HG3 GLU 53 1HG GLU 53 4.420 0.159 13.225
335 H SER 54 H SER 54 1.986 2.195 10.504
336 HA SER 54 HA SER 54 -0.769 1.807 9.562
337 HG SER 54 HG SER 54 0.387 4.136 11.608
338 HB2 SER 54 2HB SER 54 0.942 4.305 9.554
339 HB3 SER 54 1HB SER 54 -0.749 4.211 9.056
340 H GLU 55 H GLU 55 2.066 0.875 8.552
341 HA GLU 55 HA GLU 55 1.687 1.764 5.764
342 HB2 GLU 55 2HB GLU 55 4.282 0.992 7.107
343 HB3 GLU 55 1HB GLU 55 4.096 1.572 5.458
344 HG2 GLU 55 2HG GLU 55 3.326 3.727 6.288
345 HG3 GLU 55 1HG GLU 55 3.477 3.149 7.948
346 H ILE 56 H ILE 56 2.045 0.260 4.109
347 HA ILE 56 HA ILE 56 2.805 -2.464 4.733
348 HB ILE 56 HB ILE 56 0.695 -3.229 4.865
349 HG12 ILE 56 2HG1 ILE 56 0.658 -2.563 1.918
350 HG13 ILE 56 1HG1 ILE 56 1.312 -4.027 2.644
351 HG21 ILE 56 1HG2 ILE 56 -0.280 -0.731 3.506
352 HG22 ILE 56 2HG2 ILE 56 -0.250 -1.054 5.241
353 HG23 ILE 56 3HG2 ILE 56 -1.308 -1.992 4.187
354 HD11 ILE 56 3HD1 ILE 56 -0.943 -4.615 3.424
355 HD12 ILE 56 1HD1 ILE 56 -0.849 -4.466 1.670
356 HD13 ILE 56 2HD1 ILE 56 -1.575 -3.174 2.628
357 H TYR 57 H TYR 57 4.108 -3.185 3.183
358 HA TYR 57 HA TYR 57 3.762 -2.234 0.440
359 HD1 TYR 57 HD2 TYR 57 4.819 0.451 -0.194
360 HD2 TYR 57 HD1 TYR 57 6.111 -0.714 3.682
361 HE1 TYR 57 HE2 TYR 57 4.468 2.747 0.603
362 HE2 TYR 57 HE1 TYR 57 5.766 1.582 4.494
363 HH TYR 57 HH TYR 57 4.128 3.974 2.622
364 HB2 TYR 57 2HB TYR 57 6.461 -2.157 1.818
365 HB3 TYR 57 1HB TYR 57 6.100 -1.637 0.179
366 H CYS 58 H CYS 58 5.310 -3.422 -1.044
367 HA CYS 58 HA CYS 58 5.428 -6.206 -0.413
368 HB2 CYS 58 2HB CYS 58 6.388 -6.504 -2.564
369 HB3 CYS 58 1HB CYS 58 5.256 -5.173 -2.758
370 H LYS 59 H LYS 59 7.418 -7.416 -0.164
371 HA LYS 59 HA LYS 59 9.132 -6.156 1.706
372 HB2 LYS 59 2HB LYS 59 9.224 -8.871 0.410
373 HB3 LYS 59 1HB LYS 59 10.390 -8.343 1.618
374 HG2 LYS 59 2HG LYS 59 8.574 -7.994 3.220
375 HG3 LYS 59 1HG LYS 59 7.409 -8.539 2.015
376 HD2 LYS 59 2HD LYS 59 9.688 -10.213 3.059
377 HD3 LYS 59 1HD LYS 59 8.041 -10.270 3.688
378 HE2 LYS 59 2HE LYS 59 7.260 -10.843 1.388
379 HE3 LYS 59 1HE LYS 59 8.951 -10.966 0.899
380 HZ1 LYS 59 3HZ LYS 59 7.593 -12.608 2.970
381 HZ2 LYS 59 1HZ LYS 59 9.245 -12.693 2.593
382 HZ3 LYS 59 2HZ LYS 59 8.085 -13.131 1.433
383 H VAL 60 H VAL 60 9.095 -5.994 -1.589
384 HA VAL 60 HA VAL 60 11.936 -5.801 -2.024
385 HB VAL 60 HB VAL 60 9.672 -4.825 -3.779
386 HG11 VAL 60 1HG1 VAL 60 12.593 -5.283 -4.383
387 HG12 VAL 60 2HG1 VAL 60 11.775 -3.723 -4.291
388 HG13 VAL 60 3HG1 VAL 60 11.360 -4.864 -5.572
389 HG21 VAL 60 3HG2 VAL 60 11.236 -7.404 -3.899
390 HG22 VAL 60 1HG2 VAL 60 10.010 -6.881 -5.057
391 HG23 VAL 60 2HG2 VAL 60 9.556 -7.238 -3.391
392 H CYS 61 H CYS 61 9.218 -3.462 -1.947
393 HA CYS 61 HA CYS 61 10.900 -1.182 -1.872
394 HB2 CYS 61 2HB CYS 61 8.024 -1.485 -1.013
395 HB3 CYS 61 1HB CYS 61 8.872 0.052 -1.130
396 H TYR 62 H TYR 62 9.576 -3.256 0.613
397 HA TYR 62 HA TYR 62 10.146 -1.684 2.852
398 HD1 TYR 62 HD2 TYR 62 8.062 -2.746 4.725
399 HD2 TYR 62 HD1 TYR 62 11.841 -4.697 4.785
400 HE1 TYR 62 HE2 TYR 62 8.089 -2.604 7.181
401 HE2 TYR 62 HE1 TYR 62 11.876 -4.566 7.238
402 HH TYR 62 HH TYR 62 9.211 -3.931 9.091
403 HB2 TYR 62 2HB TYR 62 8.922 -3.939 2.747
404 HB3 TYR 62 1HB TYR 62 10.519 -4.677 2.779
405 H GLY 63 H GLY 63 12.192 -4.239 1.384
406 HA2 GLY 63 2HA GLY 63 14.520 -3.540 2.858
407 HA3 GLY 63 1HA GLY 63 14.480 -4.516 1.397
408 H ARG 64 H ARG 64 13.050 -2.242 0.047
409 HA ARG 64 HA ARG 64 15.299 -0.993 -1.132
410 HE ARG 64 HE ARG 64 12.666 2.924 -3.918
411 HB2 ARG 64 2HB ARG 64 13.465 -1.293 -2.536
412 HB3 ARG 64 1HB ARG 64 12.326 -0.692 -1.346
413 HG2 ARG 64 2HG ARG 64 13.261 1.588 -1.697
414 HG3 ARG 64 1HG ARG 64 14.246 0.921 -3.006
415 HD2 ARG 64 2HD ARG 64 12.360 0.377 -4.297
416 HD3 ARG 64 1HD ARG 64 11.268 0.540 -2.923
417 HH11 ARG 64 1HH1 ARG 64 9.687 1.089 -3.558
418 HH12 ARG 64 2HH1 ARG 64 8.674 2.447 -3.923
419 HH21 ARG 64 1HH2 ARG 64 11.311 4.702 -4.395
420 HH22 ARG 64 2HH2 ARG 64 9.581 4.499 -4.370
421 H ARG 65 H ARG 65 12.716 0.298 0.993
422 HA ARG 65 HA ARG 65 14.109 2.824 1.172
423 HE ARG 65 HE ARG 65 10.210 1.358 5.321
424 HB2 ARG 65 2HB ARG 65 12.260 3.644 2.378
425 HB3 ARG 65 1HB ARG 65 11.575 2.546 1.191
426 HG2 ARG 65 2HG ARG 65 11.250 0.854 2.845
427 HG3 ARG 65 1HG ARG 65 12.128 1.801 4.049
428 HD2 ARG 65 2HD ARG 65 10.362 3.607 3.644
429 HD3 ARG 65 1HD ARG 65 9.438 2.340 2.836
430 HH11 ARG 65 1HH1 ARG 65 8.185 3.907 4.037
431 HH12 ARG 65 2HH1 ARG 65 7.107 3.912 5.412
432 HH21 ARG 65 1HH2 ARG 65 8.842 1.403 7.152
433 HH22 ARG 65 2HH2 ARG 65 7.484 2.499 7.181
434 H TYR 66 H TYR 66 14.320 -0.141 2.772
435 HA TYR 66 HA TYR 66 15.646 1.143 5.057
436 HD1 TYR 66 HD1 TYR 66 14.975 0.544 7.685
437 HD2 TYR 66 HD2 TYR 66 12.184 -1.050 4.900
438 HE1 TYR 66 HE1 TYR 66 13.124 1.384 9.069
439 HE2 TYR 66 HE2 TYR 66 10.331 -0.218 6.276
440 HH TYR 66 HH TYR 66 10.833 1.940 8.942
441 HB2 TYR 66 2HB TYR 66 14.478 -1.615 4.717
442 HB3 TYR 66 1HB TYR 66 15.603 -1.240 6.016
Start of MODEL 8
1 H1 GLY 7 1H GLY 7 -17.619 0.452 7.849
2 HA2 GLY 7 2HA GLY 7 -18.302 2.129 5.566
3 HA3 GLY 7 1HA GLY 7 -18.898 2.654 7.133
4 H ALA 8 H ALA 8 -16.027 1.985 5.245
5 HA ALA 8 HA ALA 8 -14.557 3.913 6.906
6 HB1 ALA 8 3HB ALA 8 -13.464 1.261 5.952
7 HB2 ALA 8 1HB ALA 8 -13.878 1.666 7.619
8 HB3 ALA 8 2HB ALA 8 -12.557 2.508 6.808
9 H LYS 9 H LYS 9 -12.307 4.300 5.624
10 HA LYS 9 HA LYS 9 -12.976 4.482 2.773
11 HB2 LYS 9 2HB LYS 9 -11.856 6.628 2.611
12 HB3 LYS 9 1HB LYS 9 -13.130 6.720 3.821
13 HG2 LYS 9 2HG LYS 9 -11.477 6.536 5.602
14 HG3 LYS 9 1HG LYS 9 -10.190 6.396 4.399
15 HD2 LYS 9 2HD LYS 9 -12.022 8.767 4.791
16 HD3 LYS 9 1HD LYS 9 -10.321 8.675 5.253
17 HE2 LYS 9 2HE LYS 9 -9.689 8.408 2.906
18 HE3 LYS 9 1HE LYS 9 -11.388 8.456 2.437
19 HZ1 LYS 9 3HZ LYS 9 -9.823 10.660 3.665
20 HZ2 LYS 9 1HZ LYS 9 -11.497 10.719 3.382
21 HZ3 LYS 9 2HZ LYS 9 -10.413 10.595 2.081
22 H CYS 10 H CYS 10 -11.256 4.282 1.358
23 HA CYS 10 HA CYS 10 -9.381 2.319 2.192
24 HB2 CYS 10 2HB CYS 10 -10.529 2.479 -0.023
25 HB3 CYS 10 1HB CYS 10 -9.521 3.864 -0.391
26 H GLY 11 H GLY 11 -7.362 2.553 2.849
27 HA2 GLY 11 2HA GLY 11 -6.070 5.073 3.123
28 HA3 GLY 11 1HA GLY 11 -5.326 3.498 3.356
29 H ALA 12 H ALA 12 -6.634 3.339 0.376
30 HA ALA 12 HA ALA 12 -4.266 4.499 -0.941
31 HB1 ALA 12 3HB ALA 12 -5.895 2.128 -1.858
32 HB2 ALA 12 1HB ALA 12 -4.326 2.037 -1.054
33 HB3 ALA 12 2HB ALA 12 -4.460 2.784 -2.647
34 H CYS 13 H CYS 13 -7.732 3.852 -1.211
35 HA CYS 13 HA CYS 13 -7.979 5.652 -3.489
36 HB2 CYS 13 2HB CYS 13 -10.077 4.081 -1.982
37 HB3 CYS 13 1HB CYS 13 -10.371 5.030 -3.429
38 H GLU 14 H GLU 14 -9.813 7.222 -3.441
39 HA GLU 14 HA GLU 14 -10.309 8.369 -0.772
40 HB2 GLU 14 2HB GLU 14 -10.966 9.437 -3.536
41 HB3 GLU 14 1HB GLU 14 -11.293 10.268 -2.020
42 HG2 GLU 14 2HG GLU 14 -8.980 10.555 -1.584
43 HG3 GLU 14 1HG GLU 14 -8.530 9.486 -2.912
44 H LYS 15 H LYS 15 -11.279 5.978 -2.526
45 HA LYS 15 HA LYS 15 -14.145 6.329 -2.523
46 HB2 LYS 15 2HB LYS 15 -12.564 3.801 -3.030
47 HB3 LYS 15 1HB LYS 15 -14.224 4.132 -3.504
48 HG2 LYS 15 2HG LYS 15 -11.767 5.493 -4.593
49 HG3 LYS 15 1HG LYS 15 -12.712 4.244 -5.402
50 HD2 LYS 15 2HD LYS 15 -14.666 5.735 -5.395
51 HD3 LYS 15 1HD LYS 15 -13.697 6.982 -4.611
52 HE2 LYS 15 2HE LYS 15 -13.800 7.443 -6.966
53 HE3 LYS 15 1HE LYS 15 -12.161 6.948 -6.550
54 HZ1 LYS 15 3HZ LYS 15 -12.739 4.694 -7.341
55 HZ2 LYS 15 1HZ LYS 15 -12.822 5.872 -8.561
56 HZ3 LYS 15 2HZ LYS 15 -14.245 5.282 -7.852
57 H THR 16 H THR 16 -15.406 4.441 -1.540
58 HA THR 16 HA THR 16 -14.586 4.349 1.252
59 HB THR 16 HB THR 16 -17.048 3.263 1.262
60 HG1 THR 16 HG1 THR 16 -16.893 4.969 -1.016
61 HG21 THR 16 3HG2 THR 16 -16.345 5.133 2.637
62 HG22 THR 16 1HG2 THR 16 -17.878 5.516 1.851
63 HG23 THR 16 2HG2 THR 16 -16.376 6.204 1.237
64 H VAL 17 H VAL 17 -14.307 2.561 2.410
65 HA VAL 17 HA VAL 17 -14.204 -0.006 0.989
66 HB VAL 17 HB VAL 17 -12.951 0.886 3.589
67 HG11 VAL 17 1HG1 VAL 17 -11.865 -1.294 3.677
68 HG12 VAL 17 2HG1 VAL 17 -12.740 -1.796 2.232
69 HG13 VAL 17 3HG1 VAL 17 -13.620 -1.467 3.724
70 HG21 VAL 17 3HG2 VAL 17 -11.713 0.112 0.963
71 HG22 VAL 17 1HG2 VAL 17 -10.838 0.563 2.428
72 HG23 VAL 17 2HG2 VAL 17 -11.851 1.750 1.604
73 H TYR 18 H TYR 18 -15.629 -1.578 1.493
74 HA TYR 18 HA TYR 18 -17.349 -1.136 3.849
75 HD1 TYR 18 HD2 TYR 18 -19.151 0.597 2.859
76 HD2 TYR 18 HD1 TYR 18 -18.094 -1.646 -0.596
77 HE1 TYR 18 HE2 TYR 18 -19.592 2.565 1.454
78 HE2 TYR 18 HE1 TYR 18 -18.526 0.315 -2.011
79 HH TYR 18 HH TYR 18 -18.806 3.405 -0.815
80 HB2 TYR 18 2HB TYR 18 -18.208 -2.720 1.431
81 HB3 TYR 18 1HB TYR 18 -19.208 -2.032 2.703
82 H HIS 19 H HIS 19 -18.503 -3.347 4.359
83 HA HIS 19 HA HIS 19 -16.614 -5.256 5.175
84 HD1 HIS 19 HD1 HIS 19 -17.853 -7.266 7.456
85 HD2 HIS 19 HD2 HIS 19 -19.884 -7.972 3.896
86 HE1 HIS 19 HE1 HIS 19 -18.366 -9.730 7.445
87 HE2 HIS 19 HE2 HIS 19 -19.782 -10.081 5.383
88 HB2 HIS 19 2HB HIS 19 -18.732 -5.139 6.278
89 HB3 HIS 19 1HB HIS 19 -19.606 -5.344 4.768
90 H ALA 20 H ALA 20 -18.120 -4.656 2.180
91 HA ALA 20 HA ALA 20 -18.204 -7.064 0.852
92 HB1 ALA 20 3HB ALA 20 -19.036 -4.936 -0.039
93 HB2 ALA 20 1HB ALA 20 -17.994 -5.766 -1.197
94 HB3 ALA 20 2HB ALA 20 -17.374 -4.392 -0.277
95 H GLU 21 H GLU 21 -15.423 -4.793 0.873
96 HA GLU 21 HA GLU 21 -13.693 -7.086 0.328
97 HB2 GLU 21 2HB GLU 21 -12.477 -5.898 -1.397
98 HB3 GLU 21 1HB GLU 21 -14.167 -6.050 -1.839
99 HG2 GLU 21 2HG GLU 21 -14.518 -3.692 -1.176
100 HG3 GLU 21 1HG GLU 21 -12.802 -3.578 -0.790
101 H GLU 22 H GLU 22 -14.043 -5.890 2.778
102 HA GLU 22 HA GLU 22 -11.819 -4.064 3.170
103 HB2 GLU 22 2HB GLU 22 -13.894 -3.618 4.390
104 HB3 GLU 22 1HB GLU 22 -13.791 -5.197 5.159
105 HG2 GLU 22 2HG GLU 22 -11.688 -4.532 6.222
106 HG3 GLU 22 1HG GLU 22 -11.834 -2.939 5.479
107 H ILE 23 H ILE 23 -9.856 -4.893 3.335
108 HA ILE 23 HA ILE 23 -9.519 -7.145 5.207
109 HB ILE 23 HB ILE 23 -7.649 -6.115 3.064
110 HG12 ILE 23 2HG1 ILE 23 -7.806 -8.838 2.817
111 HG13 ILE 23 1HG1 ILE 23 -9.434 -8.424 3.350
112 HG21 ILE 23 1HG2 ILE 23 -6.014 -7.753 3.818
113 HG22 ILE 23 2HG2 ILE 23 -7.060 -8.185 5.172
114 HG23 ILE 23 3HG2 ILE 23 -6.357 -6.569 5.079
115 HD11 ILE 23 3HD1 ILE 23 -9.638 -6.852 1.505
116 HD12 ILE 23 1HD1 ILE 23 -9.281 -8.483 0.936
117 HD13 ILE 23 2HD1 ILE 23 -8.006 -7.265 0.977
118 H GLN 24 H GLN 24 -8.926 -6.569 7.176
119 HA GLN 24 HA GLN 24 -7.836 -3.900 7.588
120 HB2 GLN 24 2HB GLN 24 -9.489 -5.673 9.102
121 HB3 GLN 24 1HB GLN 24 -8.039 -5.324 10.033
122 HG2 GLN 24 2HG GLN 24 -8.449 -2.976 9.921
123 HG3 GLN 24 1HG GLN 24 -9.788 -3.220 8.798
124 HE21 GLN 24 1HE2 GLN 24 -11.752 -3.902 9.548
125 HE22 GLN 24 2HE2 GLN 24 -12.137 -3.978 11.238
126 H CYS 25 H CYS 25 -5.746 -3.843 7.135
127 HA CYS 25 HA CYS 25 -4.026 -6.079 7.858
128 HG CYS 25 HG CYS 25 -1.471 -5.733 5.127
129 HB2 CYS 25 2HB CYS 25 -3.887 -5.004 5.592
130 HB3 CYS 25 1HB CYS 25 -3.317 -3.537 6.374
131 H ASN 26 H ASN 26 -3.314 -6.103 9.834
132 HA ASN 26 HA ASN 26 -2.298 -5.546 11.770
133 HB2 ASN 26 2HB ASN 26 -0.668 -4.310 10.318
134 HB3 ASN 26 1HB ASN 26 -1.643 -2.861 10.550
135 HD21 ASN 26 1HD2 ASN 26 -0.099 -1.703 11.635
136 HD22 ASN 26 2HD2 ASN 26 0.452 -2.117 13.220
137 H GLY 27 H GLY 27 -3.834 -2.537 10.585
138 HA2 GLY 27 2HA GLY 27 -5.918 -2.691 12.523
139 HA3 GLY 27 1HA GLY 27 -4.684 -1.546 13.024
140 H ARG 28 H ARG 28 -5.380 -2.020 9.636
141 HA ARG 28 HA ARG 28 -7.171 0.285 9.595
142 HE ARG 28 HE ARG 28 -4.673 4.281 10.144
143 HB2 ARG 28 2HB ARG 28 -4.478 0.187 8.313
144 HB3 ARG 28 1HB ARG 28 -5.782 1.009 7.466
145 HG2 ARG 28 2HG ARG 28 -6.141 2.386 9.515
146 HG3 ARG 28 1HG ARG 28 -4.686 1.651 10.191
147 HD2 ARG 28 2HD ARG 28 -3.329 2.558 8.452
148 HD3 ARG 28 1HD ARG 28 -4.746 3.105 7.558
149 HH11 ARG 28 1HH1 ARG 28 -3.170 4.455 6.991
150 HH12 ARG 28 2HH1 ARG 28 -2.776 6.143 7.109
151 HH21 ARG 28 1HH2 ARG 28 -4.151 6.513 10.328
152 HH22 ARG 28 2HH2 ARG 28 -3.317 7.310 9.024
153 H SER 29 H SER 29 -8.533 0.388 7.848
154 HA SER 29 HA SER 29 -9.038 -2.183 6.601
155 HG SER 29 HG SER 29 -11.479 -1.660 8.108
156 HB2 SER 29 2HB SER 29 -10.650 0.374 6.416
157 HB3 SER 29 1HB SER 29 -11.200 -1.257 6.045
158 H PHE 30 H PHE 30 -8.517 -2.680 4.570
159 HA PHE 30 HA PHE 30 -8.164 -0.518 2.603
160 HD1 PHE 30 HD2 PHE 30 -5.886 0.724 2.431
161 HD2 PHE 30 HD1 PHE 30 -5.116 -2.691 4.853
162 HE1 PHE 30 HE2 PHE 30 -4.399 2.070 3.854
163 HE2 PHE 30 HE1 PHE 30 -3.628 -1.347 6.278
164 HZ PHE 30 HZ PHE 30 -3.241 1.022 5.762
165 HB2 PHE 30 2HB PHE 30 -6.362 -2.934 2.924
166 HB3 PHE 30 1HB PHE 30 -6.237 -1.727 1.650
167 H HIS 31 H HIS 31 -8.657 -1.101 0.441
168 HA HIS 31 HA HIS 31 -10.705 -3.014 0.077
169 HD2 HIS 31 HD2 HIS 31 -12.516 -1.755 -0.248
170 HE1 HIS 31 HE1 HIS 31 -12.258 1.881 -2.374
171 HE2 HIS 31 HE2 HIS 31 -13.736 0.427 -0.939
172 HB2 HIS 31 2HB HIS 31 -8.984 -1.464 -1.845
173 HB3 HIS 31 1HB HIS 31 -10.133 -2.664 -2.423
174 H LYS 32 H LYS 32 -10.719 -5.023 -0.917
175 HA LYS 32 HA LYS 32 -8.436 -6.678 -0.873
176 HB2 LYS 32 2HB LYS 32 -10.824 -7.470 -0.858
177 HB3 LYS 32 1HB LYS 32 -10.942 -7.022 -2.553
178 HG2 LYS 32 2HG LYS 32 -8.850 -8.961 -1.639
179 HG3 LYS 32 1HG LYS 32 -10.511 -9.489 -1.902
180 HD2 LYS 32 2HD LYS 32 -10.418 -8.702 -4.205
181 HD3 LYS 32 1HD LYS 32 -8.779 -8.103 -3.948
182 HE2 LYS 32 2HE LYS 32 -8.739 -10.242 -5.106
183 HE3 LYS 32 1HE LYS 32 -8.016 -10.385 -3.506
184 HZ1 LYS 32 3HZ LYS 32 -9.929 -11.465 -2.683
185 HZ2 LYS 32 1HZ LYS 32 -9.565 -12.215 -4.158
186 HZ3 LYS 32 2HZ LYS 32 -10.839 -11.095 -4.065
187 H THR 33 H THR 33 -9.812 -4.514 -3.176
188 HA THR 33 HA THR 33 -8.157 -5.300 -5.392
189 HB THR 33 HB THR 33 -9.670 -2.701 -5.123
190 HG1 THR 33 HG1 THR 33 -11.234 -4.184 -4.635
191 HG21 THR 33 3HG2 THR 33 -9.049 -4.470 -7.495
192 HG22 THR 33 1HG2 THR 33 -8.242 -2.954 -7.100
193 HG23 THR 33 2HG2 THR 33 -9.947 -2.952 -7.550
194 H CYS 34 H CYS 34 -7.504 -3.732 -2.551
195 HA CYS 34 HA CYS 34 -5.314 -2.176 -3.743
196 HB2 CYS 34 2HB CYS 34 -7.093 -1.251 -1.475
197 HB3 CYS 34 1HB CYS 34 -5.727 -0.366 -2.156
198 H PHE 35 H PHE 35 -5.638 -4.825 -2.204
199 HA PHE 35 HA PHE 35 -4.320 -4.346 0.291
200 HD1 PHE 35 HD2 PHE 35 -4.870 -5.761 2.336
201 HD2 PHE 35 HD1 PHE 35 -3.183 -8.473 -0.476
202 HE1 PHE 35 HE2 PHE 35 -3.640 -6.870 4.149
203 HE2 PHE 35 HE1 PHE 35 -1.939 -9.581 1.335
204 HZ PHE 35 HZ PHE 35 -2.161 -8.774 3.651
205 HB2 PHE 35 2HB PHE 35 -5.874 -6.239 0.001
206 HB3 PHE 35 1HB PHE 35 -4.779 -6.952 -1.181
207 H HIS 36 H HIS 36 -3.264 -4.460 -2.867
208 HA HIS 36 HA HIS 36 -0.711 -5.674 -2.267
209 HD1 HIS 36 HD1 HIS 36 -3.881 -5.525 -5.061
210 HD2 HIS 36 HD2 HIS 36 -0.886 -2.758 -5.898
211 HE1 HIS 36 HE1 HIS 36 -4.905 -3.871 -6.656
212 HE2 HIS 36 HE2 HIS 36 -3.054 -2.268 -7.237
213 HB2 HIS 36 2HB HIS 36 -0.194 -5.192 -4.688
214 HB3 HIS 36 1HB HIS 36 -1.534 -6.287 -4.386
215 H CYS 37 H CYS 37 1.231 -4.386 -3.457
216 HA CYS 37 HA CYS 37 2.007 -2.737 -1.397
217 HB2 CYS 37 2HB CYS 37 3.489 -3.921 -3.035
218 HB3 CYS 37 1HB CYS 37 3.149 -2.634 -4.187
219 H MET 38 H MET 38 1.673 -0.752 -0.838
220 HA MET 38 HA MET 38 0.108 1.053 -2.401
221 HB2 MET 38 2HB MET 38 1.618 1.476 0.181
222 HB3 MET 38 1HB MET 38 0.454 2.601 -0.501
223 HG2 MET 38 2HG MET 38 -0.131 -0.205 0.403
224 HG3 MET 38 1HG MET 38 -0.507 1.266 1.295
225 HE1 MET 38 3HE MET 38 -4.032 0.008 0.201
226 HE2 MET 38 1HE MET 38 -3.009 0.508 1.550
227 HE3 MET 38 2HE MET 38 -2.652 -0.982 0.672
228 H ALA 39 H ALA 39 3.457 0.414 -2.184
229 HA ALA 39 HA ALA 39 4.247 3.122 -2.884
230 HB1 ALA 39 3HB ALA 39 5.610 1.801 -1.315
231 HB2 ALA 39 1HB ALA 39 6.519 2.341 -2.728
232 HB3 ALA 39 2HB ALA 39 5.972 0.667 -2.618
233 H CYS 40 H CYS 40 5.240 0.002 -4.325
234 HA CYS 40 HA CYS 40 5.364 1.304 -6.895
235 HB2 CYS 40 2HB CYS 40 6.220 -0.840 -7.751
236 HB3 CYS 40 1HB CYS 40 7.115 -0.317 -6.335
237 H ARG 41 H ARG 41 4.097 -1.905 -6.410
238 HA ARG 41 HA ARG 41 1.446 -1.577 -6.023
239 HE ARG 41 HE ARG 41 -2.363 0.288 -7.177
240 HB2 ARG 41 2HB ARG 41 1.822 -0.371 -8.433
241 HB3 ARG 41 1HB ARG 41 1.425 -2.007 -8.948
242 HG2 ARG 41 2HG ARG 41 -0.542 -0.501 -8.786
243 HG3 ARG 41 1HG ARG 41 -0.667 -1.941 -7.773
244 HD2 ARG 41 2HD ARG 41 0.096 -0.609 -5.834
245 HD3 ARG 41 1HD ARG 41 0.134 0.827 -6.855
246 HH11 ARG 41 1HH1 ARG 41 -0.561 -0.286 -4.222
247 HH12 ARG 41 2HH1 ARG 41 -1.944 -0.081 -3.191
248 HH21 ARG 41 1HH2 ARG 41 -4.194 0.519 -5.812
249 HH22 ARG 41 2HH2 ARG 41 -3.995 0.396 -4.094
250 H LYS 42 H LYS 42 3.926 -3.405 -6.203
251 HA LYS 42 HA LYS 42 3.402 -5.780 -7.510
252 HB2 LYS 42 2HB LYS 42 5.493 -5.383 -6.358
253 HB3 LYS 42 1HB LYS 42 4.670 -5.279 -4.811
254 HG2 LYS 42 2HG LYS 42 5.750 -7.383 -4.904
255 HG3 LYS 42 1HG LYS 42 4.020 -7.682 -5.092
256 HD2 LYS 42 2HD LYS 42 4.332 -7.820 -7.527
257 HD3 LYS 42 1HD LYS 42 6.067 -7.578 -7.305
258 HE2 LYS 42 2HE LYS 42 5.727 -9.915 -7.549
259 HE3 LYS 42 1HE LYS 42 6.064 -9.618 -5.847
260 HZ1 LYS 42 3HZ LYS 42 3.676 -9.725 -5.406
261 HZ2 LYS 42 1HZ LYS 42 4.243 -11.161 -6.099
262 HZ3 LYS 42 2HZ LYS 42 3.379 -10.050 -7.041
263 H ALA 43 H ALA 43 2.055 -7.494 -7.181
264 HA ALA 43 HA ALA 43 -0.140 -7.232 -5.392
265 HB1 ALA 43 3HB ALA 43 0.781 -9.633 -6.960
266 HB2 ALA 43 1HB ALA 43 -0.352 -8.404 -7.519
267 HB3 ALA 43 2HB ALA 43 -0.788 -9.456 -6.170
268 H LEU 44 H LEU 44 -0.162 -7.682 -3.290
269 HA LEU 44 HA LEU 44 1.962 -9.364 -2.186
270 HG LEU 44 HG LEU 44 2.336 -6.643 0.201
271 HB2 LEU 44 2HB LEU 44 0.259 -7.186 -1.082
272 HB3 LEU 44 1HB LEU 44 0.808 -8.434 0.016
273 HD11 LEU 44 1HD1 LEU 44 3.393 -8.821 0.176
274 HD12 LEU 44 2HD1 LEU 44 4.447 -7.625 -0.581
275 HD13 LEU 44 3HD1 LEU 44 3.538 -8.761 -1.580
276 HD21 LEU 44 3HD2 LEU 44 1.787 -5.448 -1.823
277 HD22 LEU 44 1HD2 LEU 44 2.569 -6.692 -2.800
278 HD23 LEU 44 2HD2 LEU 44 3.528 -5.694 -1.707
279 H ASP 45 H ASP 45 1.545 -11.095 -0.904
280 HA ASP 45 HA ASP 45 -1.254 -11.979 -0.780
281 HB2 ASP 45 2HB ASP 45 1.275 -13.636 -0.954
282 HB3 ASP 45 1HB ASP 45 -0.312 -14.309 -0.596
283 H SER 46 H SER 46 -1.552 -13.561 1.149
284 HA SER 46 HA SER 46 -1.479 -12.044 3.426
285 HG SER 46 HG SER 46 -3.886 -14.445 3.305
286 HB2 SER 46 2HB SER 46 -1.460 -15.057 3.430
287 HB3 SER 46 1HB SER 46 -2.235 -13.981 4.596
288 H THR 47 H THR 47 0.955 -14.378 2.384
289 HA THR 47 HA THR 47 2.329 -14.223 4.932
290 HB THR 47 HB THR 47 3.287 -15.702 2.488
291 HG1 THR 47 HG1 THR 47 2.061 -17.498 3.654
292 HG21 THR 47 3HG2 THR 47 3.571 -16.228 5.451
293 HG22 THR 47 1HG2 THR 47 4.823 -15.566 4.396
294 HG23 THR 47 2HG2 THR 47 4.248 -17.216 4.156
295 H THR 48 H THR 48 2.545 -12.655 1.852
296 HA THR 48 HA THR 48 5.428 -12.228 2.132
297 HB THR 48 HB THR 48 5.184 -11.267 -0.224
298 HG1 THR 48 HG1 THR 48 3.281 -12.002 -1.318
299 HG21 THR 48 3HG2 THR 48 4.513 -14.170 0.272
300 HG22 THR 48 1HG2 THR 48 6.132 -13.475 0.220
301 HG23 THR 48 2HG2 THR 48 5.139 -13.507 -1.237
302 H VAL 49 H VAL 49 2.458 -10.477 2.446
303 HA VAL 49 HA VAL 49 3.423 -7.906 1.795
304 HB VAL 49 HB VAL 49 1.094 -8.022 1.835
305 HG11 VAL 49 1HG1 VAL 49 1.272 -9.136 4.643
306 HG12 VAL 49 2HG1 VAL 49 0.839 -10.040 3.194
307 HG13 VAL 49 3HG1 VAL 49 -0.224 -8.765 3.788
308 HG21 VAL 49 3HG2 VAL 49 1.861 -6.665 4.414
309 HG22 VAL 49 1HG2 VAL 49 0.371 -6.405 3.509
310 HG23 VAL 49 2HG2 VAL 49 1.920 -5.946 2.805
311 H ALA 50 H ALA 50 4.558 -6.441 2.842
312 HA ALA 50 HA ALA 50 5.342 -6.995 5.616
313 HB1 ALA 50 3HB ALA 50 7.182 -5.439 5.212
314 HB2 ALA 50 1HB ALA 50 6.561 -5.114 3.592
315 HB3 ALA 50 2HB ALA 50 7.166 -6.721 3.999
316 H ALA 51 H ALA 51 3.966 -6.073 6.987
317 HA ALA 51 HA ALA 51 2.970 -3.377 6.396
318 HB1 ALA 51 3HB ALA 51 1.194 -3.832 7.996
319 HB2 ALA 51 1HB ALA 51 1.897 -5.411 8.350
320 HB3 ALA 51 2HB ALA 51 1.244 -5.075 6.746
321 H HIS 52 H HIS 52 3.250 -1.716 7.825
322 HA HIS 52 HA HIS 52 4.516 -2.233 10.394
323 HD1 HIS 52 HD1 HIS 52 7.520 -2.616 10.827
324 HD2 HIS 52 HD2 HIS 52 6.545 1.419 10.614
325 HE1 HIS 52 HE1 HIS 52 8.822 -1.509 12.667
326 HE2 HIS 52 HE2 HIS 52 8.018 0.881 12.670
327 HB2 HIS 52 2HB HIS 52 6.339 -1.914 8.626
328 HB3 HIS 52 1HB HIS 52 5.784 -0.251 8.500
329 H GLU 53 H GLU 53 3.268 -1.190 11.761
330 HA GLU 53 HA GLU 53 1.969 0.352 12.771
331 HB2 GLU 53 2HB GLU 53 3.221 2.339 10.869
332 HB3 GLU 53 1HB GLU 53 2.382 2.715 12.368
333 HG2 GLU 53 2HG GLU 53 5.022 1.319 12.028
334 HG3 GLU 53 1HG GLU 53 4.707 2.878 12.790
335 H SER 54 H SER 54 1.822 2.246 9.834
336 HA SER 54 HA SER 54 -0.964 1.356 9.472
337 HG SER 54 HG SER 54 -0.858 2.789 11.348
338 HB2 SER 54 2HB SER 54 0.071 4.191 9.203
339 HB3 SER 54 1HB SER 54 -1.601 3.665 8.991
340 H GLU 55 H GLU 55 1.769 0.877 8.162
341 HA GLU 55 HA GLU 55 0.968 1.566 5.413
342 HB2 GLU 55 2HB GLU 55 3.760 1.396 6.556
343 HB3 GLU 55 1HB GLU 55 3.377 1.669 4.862
344 HG2 GLU 55 2HG GLU 55 2.235 3.757 5.477
345 HG3 GLU 55 1HG GLU 55 2.683 3.483 7.160
346 H ILE 56 H ILE 56 1.424 0.032 3.795
347 HA ILE 56 HA ILE 56 2.430 -2.585 4.587
348 HB ILE 56 HB ILE 56 0.348 -3.407 4.812
349 HG12 ILE 56 2HG1 ILE 56 0.266 -3.021 1.814
350 HG13 ILE 56 1HG1 ILE 56 0.968 -4.392 2.667
351 HG21 ILE 56 1HG2 ILE 56 -1.700 -2.294 4.051
352 HG22 ILE 56 2HG2 ILE 56 -0.719 -1.079 3.230
353 HG23 ILE 56 3HG2 ILE 56 -0.654 -1.225 4.987
354 HD11 ILE 56 3HD1 ILE 56 -1.230 -5.003 3.509
355 HD12 ILE 56 1HD1 ILE 56 -1.215 -4.934 1.746
356 HD13 ILE 56 2HD1 ILE 56 -1.938 -3.620 2.674
357 H TYR 57 H TYR 57 3.740 -3.389 3.044
358 HA TYR 57 HA TYR 57 3.418 -2.515 0.279
359 HD1 TYR 57 HD2 TYR 57 4.330 0.172 -0.524
360 HD2 TYR 57 HD1 TYR 57 5.420 -0.651 3.499
361 HE1 TYR 57 HE2 TYR 57 3.678 2.454 0.112
362 HE2 TYR 57 HE1 TYR 57 4.780 1.627 4.145
363 HH TYR 57 HH TYR 57 4.247 3.689 3.369
364 HB2 TYR 57 2HB TYR 57 6.035 -2.151 1.756
365 HB3 TYR 57 1HB TYR 57 5.732 -1.770 0.067
366 H CYS 58 H CYS 58 5.141 -3.509 -1.131
367 HA CYS 58 HA CYS 58 5.397 -6.308 -0.598
368 HB2 CYS 58 2HB CYS 58 6.412 -6.465 -2.737
369 HB3 CYS 58 1HB CYS 58 5.200 -5.201 -2.900
370 H LYS 59 H LYS 59 7.567 -7.377 -0.624
371 HA LYS 59 HA LYS 59 9.126 -6.331 1.499
372 HB2 LYS 59 2HB LYS 59 9.618 -8.661 -0.356
373 HB3 LYS 59 1HB LYS 59 10.622 -8.285 1.039
374 HG2 LYS 59 2HG LYS 59 8.696 -8.579 2.511
375 HG3 LYS 59 1HG LYS 59 7.686 -8.958 1.114
376 HD2 LYS 59 2HD LYS 59 10.128 -10.515 1.960
377 HD3 LYS 59 1HD LYS 59 8.461 -10.970 2.320
378 HE2 LYS 59 2HE LYS 59 7.976 -11.154 -0.057
379 HE3 LYS 59 1HE LYS 59 9.615 -10.632 -0.443
380 HZ1 LYS 59 3HZ LYS 59 9.353 -13.046 -0.579
381 HZ2 LYS 59 1HZ LYS 59 8.924 -13.098 1.061
382 HZ3 LYS 59 2HZ LYS 59 10.479 -12.605 0.609
383 H VAL 60 H VAL 60 9.172 -5.686 -1.806
384 HA VAL 60 HA VAL 60 12.005 -5.214 -2.041
385 HB VAL 60 HB VAL 60 9.774 -4.298 -3.867
386 HG11 VAL 60 1HG1 VAL 60 11.848 -3.067 -4.193
387 HG12 VAL 60 2HG1 VAL 60 11.532 -4.138 -5.558
388 HG13 VAL 60 3HG1 VAL 60 12.738 -4.581 -4.350
389 HG21 VAL 60 3HG2 VAL 60 9.748 -6.716 -3.636
390 HG22 VAL 60 1HG2 VAL 60 11.474 -6.790 -3.995
391 HG23 VAL 60 2HG2 VAL 60 10.335 -6.256 -5.233
392 H CYS 61 H CYS 61 9.096 -3.121 -1.980
393 HA CYS 61 HA CYS 61 10.591 -0.715 -1.796
394 HB2 CYS 61 2HB CYS 61 7.715 -1.249 -1.047
395 HB3 CYS 61 1HB CYS 61 8.441 0.347 -1.201
396 H TYR 62 H TYR 62 9.245 -2.916 0.573
397 HA TYR 62 HA TYR 62 9.587 -1.314 2.858
398 HD1 TYR 62 HD2 TYR 62 7.355 -2.359 4.610
399 HD2 TYR 62 HD1 TYR 62 11.068 -4.423 4.856
400 HE1 TYR 62 HE2 TYR 62 7.232 -2.281 7.065
401 HE2 TYR 62 HE1 TYR 62 10.954 -4.349 7.308
402 HH TYR 62 HH TYR 62 9.816 -2.845 9.056
403 HB2 TYR 62 2HB TYR 62 8.303 -3.508 2.660
404 HB3 TYR 62 1HB TYR 62 9.856 -4.322 2.767
405 H GLY 63 H GLY 63 11.729 -3.705 1.331
406 HA2 GLY 63 2HA GLY 63 13.835 -3.452 3.210
407 HA3 GLY 63 1HA GLY 63 13.960 -4.158 1.607
408 H ARG 64 H ARG 64 12.925 -1.553 0.460
409 HA ARG 64 HA ARG 64 15.480 -0.305 0.109
410 HE ARG 64 HE ARG 64 14.697 1.478 -3.532
411 HB2 ARG 64 2HB ARG 64 12.719 0.479 -0.828
412 HB3 ARG 64 1HB ARG 64 14.181 1.351 -1.262
413 HG2 ARG 64 2HG ARG 64 15.056 -0.627 -2.364
414 HG3 ARG 64 1HG ARG 64 13.619 -1.538 -1.889
415 HD2 ARG 64 2HD ARG 64 13.361 -0.839 -4.167
416 HD3 ARG 64 1HD ARG 64 12.239 0.075 -3.161
417 HH11 ARG 64 1HH1 ARG 64 11.656 0.687 -5.092
418 HH12 ARG 64 2HH1 ARG 64 11.679 2.087 -6.128
419 HH21 ARG 64 1HH2 ARG 64 14.751 3.278 -4.895
420 HH22 ARG 64 2HH2 ARG 64 13.460 3.561 -6.024
421 H ARG 65 H ARG 65 12.420 0.711 1.629
422 HA ARG 65 HA ARG 65 13.503 3.225 2.459
423 HE ARG 65 HE ARG 65 9.552 4.475 2.016
424 HB2 ARG 65 2HB ARG 65 11.088 2.865 2.012
425 HB3 ARG 65 1HB ARG 65 11.001 1.834 3.433
426 HG2 ARG 65 2HG ARG 65 11.720 3.761 4.812
427 HG3 ARG 65 1HG ARG 65 11.656 4.770 3.370
428 HD2 ARG 65 2HD ARG 65 9.332 3.231 4.512
429 HD3 ARG 65 1HD ARG 65 9.634 4.942 4.781
430 HH11 ARG 65 1HH1 ARG 65 7.452 4.500 4.804
431 HH12 ARG 65 2HH1 ARG 65 6.020 4.888 3.900
432 HH21 ARG 65 1HH2 ARG 65 7.697 5.015 0.799
433 HH22 ARG 65 2HH2 ARG 65 6.164 5.227 1.608
434 H TYR 66 H TYR 66 12.898 0.123 4.062
435 HA TYR 66 HA TYR 66 13.986 1.180 6.562
436 HD1 TYR 66 HD2 TYR 66 12.347 0.526 8.938
437 HD2 TYR 66 HD1 TYR 66 10.608 -0.443 5.181
438 HE1 TYR 66 HE2 TYR 66 10.232 1.557 9.657
439 HE2 TYR 66 HE1 TYR 66 8.494 0.589 5.883
440 HH TYR 66 HH TYR 66 7.332 1.075 8.077
441 HB2 TYR 66 2HB TYR 66 12.679 -1.452 5.858
442 HB3 TYR 66 1HB TYR 66 13.383 -1.119 7.436
Start of MODEL 9
1 H1 GLY 7 1H GLY 7 -18.996 1.826 7.682
2 HA2 GLY 7 2HA GLY 7 -17.278 0.157 6.489
3 HA3 GLY 7 1HA GLY 7 -17.874 1.084 5.116
4 H ALA 8 H ALA 8 -15.494 1.569 5.074
5 HA ALA 8 HA ALA 8 -14.991 4.024 6.614
6 HB1 ALA 8 3HB ALA 8 -12.996 1.796 6.188
7 HB2 ALA 8 1HB ALA 8 -13.774 2.203 7.718
8 HB3 ALA 8 2HB ALA 8 -12.662 3.343 6.962
9 H LYS 9 H LYS 9 -12.425 4.482 5.527
10 HA LYS 9 HA LYS 9 -12.925 4.516 2.643
11 HB2 LYS 9 2HB LYS 9 -11.750 6.711 2.517
12 HB3 LYS 9 1HB LYS 9 -13.303 6.784 3.332
13 HG2 LYS 9 2HG LYS 9 -12.298 7.034 5.445
14 HG3 LYS 9 1HG LYS 9 -10.710 6.569 4.829
15 HD2 LYS 9 2HD LYS 9 -10.937 9.004 5.211
16 HD3 LYS 9 1HD LYS 9 -10.554 8.595 3.540
17 HE2 LYS 9 2HE LYS 9 -12.253 10.367 3.707
18 HE3 LYS 9 1HE LYS 9 -12.874 8.931 2.893
19 HZ1 LYS 9 3HZ LYS 9 -13.343 9.660 5.744
20 HZ2 LYS 9 1HZ LYS 9 -13.956 8.282 4.968
21 HZ3 LYS 9 2HZ LYS 9 -14.470 9.822 4.485
22 H CYS 10 H CYS 10 -11.160 4.246 1.384
23 HA CYS 10 HA CYS 10 -9.348 2.367 2.360
24 HB2 CYS 10 2HB CYS 10 -10.231 2.638 0.037
25 HB3 CYS 10 1HB CYS 10 -9.155 4.008 -0.158
26 H GLY 11 H GLY 11 -7.342 2.485 3.099
27 HA2 GLY 11 2HA GLY 11 -6.030 4.964 3.612
28 HA3 GLY 11 1HA GLY 11 -5.319 3.367 3.787
29 H ALA 12 H ALA 12 -6.439 3.319 0.749
30 HA ALA 12 HA ALA 12 -3.976 4.498 -0.372
31 HB1 ALA 12 3HB ALA 12 -5.510 2.113 -1.401
32 HB2 ALA 12 1HB ALA 12 -3.981 2.054 -0.525
33 HB3 ALA 12 2HB ALA 12 -4.054 2.799 -2.122
34 H CYS 13 H CYS 13 -7.422 4.271 -0.535
35 HA CYS 13 HA CYS 13 -7.482 6.010 -2.924
36 HB2 CYS 13 2HB CYS 13 -9.685 4.291 -1.749
37 HB3 CYS 13 1HB CYS 13 -9.834 5.301 -3.177
38 H GLU 14 H GLU 14 -9.177 7.718 -2.903
39 HA GLU 14 HA GLU 14 -10.081 8.479 -0.217
40 HB2 GLU 14 2HB GLU 14 -10.365 9.814 -2.914
41 HB3 GLU 14 1HB GLU 14 -11.293 10.333 -1.514
42 HG2 GLU 14 2HG GLU 14 -9.403 11.767 -1.761
43 HG3 GLU 14 1HG GLU 14 -9.177 10.779 -0.321
44 H LYS 15 H LYS 15 -10.769 6.269 -2.357
45 HA LYS 15 HA LYS 15 -13.632 6.420 -2.554
46 HB2 LYS 15 2HB LYS 15 -11.768 4.095 -3.106
47 HB3 LYS 15 1HB LYS 15 -13.434 4.252 -3.649
48 HG2 LYS 15 2HG LYS 15 -12.873 6.019 -5.135
49 HG3 LYS 15 1HG LYS 15 -11.252 6.161 -4.450
50 HD2 LYS 15 2HD LYS 15 -10.779 3.849 -5.246
51 HD3 LYS 15 1HD LYS 15 -12.357 3.842 -6.037
52 HE2 LYS 15 2HE LYS 15 -11.697 5.752 -7.395
53 HE3 LYS 15 1HE LYS 15 -10.133 5.800 -6.583
54 HZ1 LYS 15 3HZ LYS 15 -9.606 3.648 -7.502
55 HZ2 LYS 15 1HZ LYS 15 -10.036 4.708 -8.751
56 HZ3 LYS 15 2HZ LYS 15 -11.136 3.530 -8.225
57 H THR 16 H THR 16 -15.005 4.693 -1.691
58 HA THR 16 HA THR 16 -14.462 4.429 1.124
59 HB THR 16 HB THR 16 -16.820 3.183 0.787
60 HG1 THR 16 HG1 THR 16 -16.700 3.535 -1.529
61 HG21 THR 16 3HG2 THR 16 -16.396 5.114 2.241
62 HG22 THR 16 1HG2 THR 16 -17.882 5.328 1.314
63 HG23 THR 16 2HG2 THR 16 -16.412 6.176 0.833
64 H VAL 17 H VAL 17 -14.172 2.613 2.277
65 HA VAL 17 HA VAL 17 -13.861 0.087 0.802
66 HB VAL 17 HB VAL 17 -12.724 1.016 3.437
67 HG11 VAL 17 1HG1 VAL 17 -13.477 -1.306 3.684
68 HG12 VAL 17 2HG1 VAL 17 -11.717 -1.194 3.688
69 HG13 VAL 17 3HG1 VAL 17 -12.561 -1.749 2.243
70 HG21 VAL 17 3HG2 VAL 17 -11.448 0.064 0.893
71 HG22 VAL 17 1HG2 VAL 17 -10.586 0.525 2.361
72 HG23 VAL 17 2HG2 VAL 17 -11.515 1.731 1.470
73 H TYR 18 H TYR 18 -15.446 -1.342 1.007
74 HA TYR 18 HA TYR 18 -17.143 -1.195 3.414
75 HD1 TYR 18 HD1 TYR 18 -18.484 0.534 3.018
76 HD2 TYR 18 HD2 TYR 18 -18.692 -0.978 -0.955
77 HE1 TYR 18 HE1 TYR 18 -19.184 2.748 2.216
78 HE2 TYR 18 HE2 TYR 18 -19.387 1.235 -1.767
79 HH TYR 18 HH TYR 18 -19.010 4.004 -0.119
80 HB2 TYR 18 2HB TYR 18 -17.875 -2.343 0.710
81 HB3 TYR 18 1HB TYR 18 -18.942 -2.185 2.100
82 H HIS 19 H HIS 19 -18.129 -3.383 3.969
83 HA HIS 19 HA HIS 19 -16.164 -5.307 4.437
84 HD1 HIS 19 HD1 HIS 19 -20.461 -7.419 5.286
85 HD2 HIS 19 HD2 HIS 19 -19.691 -4.218 2.742
86 HE1 HIS 19 HE1 HIS 19 -22.599 -7.020 4.018
87 HE2 HIS 19 HE2 HIS 19 -22.035 -5.228 2.344
88 HB2 HIS 19 2HB HIS 19 -17.972 -6.807 5.108
89 HB3 HIS 19 1HB HIS 19 -18.259 -5.185 5.723
90 H ALA 20 H ALA 20 -17.795 -4.602 1.577
91 HA ALA 20 HA ALA 20 -17.942 -6.979 0.179
92 HB1 ALA 20 3HB ALA 20 -17.130 -4.254 -0.837
93 HB2 ALA 20 1HB ALA 20 -18.784 -4.844 -0.661
94 HB3 ALA 20 2HB ALA 20 -17.701 -5.596 -1.832
95 H GLU 21 H GLU 21 -15.186 -4.739 0.450
96 HA GLU 21 HA GLU 21 -13.405 -6.969 -0.166
97 HB2 GLU 21 2HB GLU 21 -12.116 -5.658 -1.734
98 HB3 GLU 21 1HB GLU 21 -13.781 -5.752 -2.272
99 HG2 GLU 21 2HG GLU 21 -14.170 -3.473 -1.537
100 HG3 GLU 21 1HG GLU 21 -12.537 -3.395 -0.872
101 H GLU 22 H GLU 22 -13.898 -6.008 2.350
102 HA GLU 22 HA GLU 22 -11.762 -4.144 3.002
103 HB2 GLU 22 2HB GLU 22 -13.882 -3.776 4.122
104 HB3 GLU 22 1HB GLU 22 -13.869 -5.422 4.747
105 HG2 GLU 22 2HG GLU 22 -11.773 -4.871 5.966
106 HG3 GLU 22 1HG GLU 22 -11.970 -3.199 5.445
107 H ILE 23 H ILE 23 -9.803 -4.922 3.295
108 HA ILE 23 HA ILE 23 -9.529 -7.386 4.885
109 HB ILE 23 HB ILE 23 -7.602 -6.065 2.966
110 HG12 ILE 23 2HG1 ILE 23 -8.341 -8.970 3.075
111 HG13 ILE 23 1HG1 ILE 23 -9.425 -7.821 2.290
112 HG21 ILE 23 1HG2 ILE 23 -5.936 -7.732 3.651
113 HG22 ILE 23 2HG2 ILE 23 -7.023 -8.291 4.922
114 HG23 ILE 23 3HG2 ILE 23 -6.365 -6.656 4.981
115 HD11 ILE 23 3HD1 ILE 23 -6.560 -8.382 1.562
116 HD12 ILE 23 1HD1 ILE 23 -7.593 -7.187 0.780
117 HD13 ILE 23 2HD1 ILE 23 -7.993 -8.902 0.676
118 H GLN 24 H GLN 24 -9.018 -7.095 6.942
119 HA GLN 24 HA GLN 24 -8.201 -4.479 7.866
120 HB2 GLN 24 2HB GLN 24 -8.477 -7.000 9.513
121 HB3 GLN 24 1HB GLN 24 -8.484 -5.342 10.092
122 HG2 GLN 24 2HG GLN 24 -10.712 -5.996 10.185
123 HG3 GLN 24 1HG GLN 24 -10.608 -5.049 8.703
124 HE21 GLN 24 1HE2 GLN 24 -12.443 -6.063 7.819
125 HE22 GLN 24 2HE2 GLN 24 -12.379 -7.700 7.245
126 H CYS 25 H CYS 25 -6.120 -4.007 7.425
127 HA CYS 25 HA CYS 25 -4.116 -6.102 7.879
128 HG CYS 25 HG CYS 25 -1.682 -5.275 5.020
129 HB2 CYS 25 2HB CYS 25 -4.188 -5.070 5.619
130 HB3 CYS 25 1HB CYS 25 -3.813 -3.515 6.345
131 H ASN 26 H ASN 26 -3.429 -6.038 9.870
132 HA ASN 26 HA ASN 26 -2.214 -5.424 11.669
133 HB2 ASN 26 2HB ASN 26 -0.773 -4.203 10.031
134 HB3 ASN 26 1HB ASN 26 -1.744 -2.763 10.314
135 HD21 ASN 26 1HD2 ASN 26 -1.448 -1.591 12.162
136 HD22 ASN 26 2HD2 ASN 26 -0.205 -1.926 13.320
137 H GLY 27 H GLY 27 -4.273 -2.739 10.543
138 HA2 GLY 27 2HA GLY 27 -6.011 -2.910 12.739
139 HA3 GLY 27 1HA GLY 27 -4.805 -1.686 13.105
140 H ARG 28 H ARG 28 -5.824 -2.211 9.811
141 HA ARG 28 HA ARG 28 -7.762 -0.062 9.932
142 HE ARG 28 HE ARG 28 -6.088 3.180 10.058
143 HB2 ARG 28 2HB ARG 28 -5.560 1.065 9.707
144 HB3 ARG 28 1HB ARG 28 -5.294 0.194 8.203
145 HG2 ARG 28 2HG ARG 28 -7.011 1.360 7.099
146 HG3 ARG 28 1HG ARG 28 -7.678 1.970 8.613
147 HD2 ARG 28 2HD ARG 28 -5.003 2.712 7.445
148 HD3 ARG 28 1HD ARG 28 -6.456 3.708 7.405
149 HH11 ARG 28 1HH1 ARG 28 -4.105 4.585 7.533
150 HH12 ARG 28 2HH1 ARG 28 -3.191 5.571 8.628
151 HH21 ARG 28 1HH2 ARG 28 -4.884 4.499 11.488
152 HH22 ARG 28 2HH2 ARG 28 -3.642 5.541 10.858
153 H SER 29 H SER 29 -9.149 -0.007 8.200
154 HA SER 29 HA SER 29 -9.397 -2.428 6.691
155 HG SER 29 HG SER 29 -12.337 -1.805 7.758
156 HB2 SER 29 2HB SER 29 -11.017 0.127 6.558
157 HB3 SER 29 1HB SER 29 -11.486 -1.434 5.884
158 H PHE 30 H PHE 30 -8.633 -2.816 4.725
159 HA PHE 30 HA PHE 30 -8.139 -0.551 2.909
160 HD1 PHE 30 HD2 PHE 30 -5.819 0.660 2.799
161 HD2 PHE 30 HD1 PHE 30 -5.303 -2.717 5.333
162 HE1 PHE 30 HE2 PHE 30 -4.432 2.017 4.308
163 HE2 PHE 30 HE1 PHE 30 -3.919 -1.365 6.855
164 HZ PHE 30 HZ PHE 30 -3.443 0.976 6.334
165 HB2 PHE 30 2HB PHE 30 -6.366 -2.977 3.297
166 HB3 PHE 30 1HB PHE 30 -6.158 -1.774 2.030
167 H HIS 31 H HIS 31 -8.330 -1.048 0.662
168 HA HIS 31 HA HIS 31 -10.429 -2.827 -0.001
169 HD2 HIS 31 HD2 HIS 31 -12.146 -1.586 -0.444
170 HE1 HIS 31 HE1 HIS 31 -11.739 2.068 -2.503
171 HE2 HIS 31 HE2 HIS 31 -13.227 0.702 -1.008
172 HB2 HIS 31 2HB HIS 31 -8.483 -1.219 -1.623
173 HB3 HIS 31 1HB HIS 31 -9.517 -2.396 -2.413
174 H LYS 32 H LYS 32 -10.444 -4.781 -1.025
175 HA LYS 32 HA LYS 32 -8.227 -6.527 -0.989
176 HB2 LYS 32 2HB LYS 32 -10.555 -7.317 -1.090
177 HB3 LYS 32 1HB LYS 32 -10.752 -6.575 -2.668
178 HG2 LYS 32 2HG LYS 32 -9.076 -8.115 -3.587
179 HG3 LYS 32 1HG LYS 32 -8.935 -8.882 -2.001
180 HD2 LYS 32 2HD LYS 32 -11.290 -9.497 -2.075
181 HD3 LYS 32 1HD LYS 32 -11.467 -8.687 -3.630
182 HE2 LYS 32 2HE LYS 32 -9.886 -10.254 -4.633
183 HE3 LYS 32 1HE LYS 32 -9.684 -11.055 -3.074
184 HZ1 LYS 32 3HZ LYS 32 -12.035 -11.632 -3.109
185 HZ2 LYS 32 1HZ LYS 32 -11.243 -12.252 -4.475
186 HZ3 LYS 32 2HZ LYS 32 -12.220 -10.874 -4.615
187 H THR 33 H THR 33 -9.484 -4.210 -3.248
188 HA THR 33 HA THR 33 -7.723 -4.871 -5.417
189 HB THR 33 HB THR 33 -9.132 -2.232 -5.020
190 HG1 THR 33 HG1 THR 33 -10.732 -3.772 -4.705
191 HG21 THR 33 3HG2 THR 33 -7.610 -2.391 -6.933
192 HG22 THR 33 1HG2 THR 33 -9.288 -2.278 -7.466
193 HG23 THR 33 2HG2 THR 33 -8.458 -3.835 -7.493
194 H CYS 34 H CYS 34 -7.183 -3.494 -2.442
195 HA CYS 34 HA CYS 34 -4.847 -2.009 -3.424
196 HB2 CYS 34 2HB CYS 34 -6.742 -1.088 -1.252
197 HB3 CYS 34 1HB CYS 34 -5.256 -0.271 -1.730
198 H PHE 35 H PHE 35 -5.534 -4.687 -1.944
199 HA PHE 35 HA PHE 35 -4.090 -4.357 0.513
200 HD1 PHE 35 HD2 PHE 35 -4.599 -5.518 2.565
201 HD2 PHE 35 HD1 PHE 35 -3.520 -8.626 -0.130
202 HE1 PHE 35 HE2 PHE 35 -3.486 -6.722 4.402
203 HE2 PHE 35 HE1 PHE 35 -2.411 -9.836 1.696
204 HZ PHE 35 HZ PHE 35 -2.276 -8.732 3.980
205 HB2 PHE 35 2HB PHE 35 -5.851 -6.092 0.281
206 HB3 PHE 35 1HB PHE 35 -4.829 -6.935 -0.886
207 H HIS 36 H HIS 36 -3.306 -4.853 -2.723
208 HA HIS 36 HA HIS 36 -0.680 -5.884 -2.114
209 HD1 HIS 36 HD1 HIS 36 -3.841 -6.432 -4.935
210 HD2 HIS 36 HD2 HIS 36 -1.357 -3.215 -5.826
211 HE1 HIS 36 HE1 HIS 36 -5.129 -5.009 -6.565
212 HE2 HIS 36 HE2 HIS 36 -3.679 -2.983 -6.955
213 HB2 HIS 36 2HB HIS 36 -0.284 -5.547 -4.605
214 HB3 HIS 36 1HB HIS 36 -1.475 -6.754 -4.143
215 H CYS 37 H CYS 37 1.170 -4.600 -3.340
216 HA CYS 37 HA CYS 37 1.833 -2.862 -1.363
217 HB2 CYS 37 2HB CYS 37 3.374 -3.950 -2.982
218 HB3 CYS 37 1HB CYS 37 2.918 -2.737 -4.168
219 H MET 38 H MET 38 1.610 -0.831 -0.848
220 HA MET 38 HA MET 38 -0.208 0.860 -2.255
221 HB2 MET 38 2HB MET 38 1.651 1.505 0.041
222 HB3 MET 38 1HB MET 38 0.313 2.504 -0.505
223 HG2 MET 38 2HG MET 38 0.047 -0.279 0.600
224 HG3 MET 38 1HG MET 38 -0.192 1.206 1.520
225 HE1 MET 38 3HE MET 38 -2.603 0.245 2.236
226 HE2 MET 38 1HE MET 38 -2.292 -1.195 1.264
227 HE3 MET 38 2HE MET 38 -3.803 -0.305 1.069
228 H ALA 39 H ALA 39 3.154 0.292 -2.457
229 HA ALA 39 HA ALA 39 3.710 2.979 -3.470
230 HB1 ALA 39 3HB ALA 39 6.063 2.385 -3.276
231 HB2 ALA 39 1HB ALA 39 5.618 0.742 -2.815
232 HB3 ALA 39 2HB ALA 39 5.210 2.094 -1.759
233 H CYS 40 H CYS 40 4.253 -0.425 -4.470
234 HA CYS 40 HA CYS 40 4.543 0.614 -7.213
235 HB2 CYS 40 2HB CYS 40 6.034 -1.208 -7.711
236 HB3 CYS 40 1HB CYS 40 6.604 -0.398 -6.256
237 H ARG 41 H ARG 41 2.416 -0.870 -5.296
238 HA ARG 41 HA ARG 41 0.552 -2.105 -5.562
239 HE ARG 41 HE ARG 41 -1.709 1.702 -6.491
240 HB2 ARG 41 2HB ARG 41 1.029 -1.460 -8.471
241 HB3 ARG 41 1HB ARG 41 -0.400 -2.302 -7.887
242 HG2 ARG 41 2HG ARG 41 0.449 0.467 -7.049
243 HG3 ARG 41 1HG ARG 41 -0.797 0.096 -8.241
244 HD2 ARG 41 2HD ARG 41 -2.060 -1.115 -6.495
245 HD3 ARG 41 1HD ARG 41 -0.835 -0.647 -5.317
246 HH11 ARG 41 1HH1 ARG 41 -3.104 -0.863 -4.551
247 HH12 ARG 41 2HH1 ARG 41 -4.348 0.141 -3.884
248 HH21 ARG 41 1HH2 ARG 41 -3.341 3.025 -5.603
249 HH22 ARG 41 2HH2 ARG 41 -4.477 2.349 -4.478
250 H LYS 42 H LYS 42 3.338 -3.280 -5.822
251 HA LYS 42 HA LYS 42 3.369 -5.679 -7.194
252 HB2 LYS 42 2HB LYS 42 5.229 -4.814 -5.813
253 HB3 LYS 42 1HB LYS 42 4.303 -5.152 -4.360
254 HG2 LYS 42 2HG LYS 42 5.824 -6.910 -4.540
255 HG3 LYS 42 1HG LYS 42 4.289 -7.572 -5.108
256 HD2 LYS 42 2HD LYS 42 4.972 -7.298 -7.405
257 HD3 LYS 42 1HD LYS 42 6.457 -6.491 -6.899
258 HE2 LYS 42 2HE LYS 42 7.043 -8.609 -5.660
259 HE3 LYS 42 1HE LYS 42 5.684 -9.371 -6.489
260 HZ1 LYS 42 3HZ LYS 42 7.699 -9.793 -7.691
261 HZ2 LYS 42 1HZ LYS 42 8.064 -8.136 -7.759
262 HZ3 LYS 42 2HZ LYS 42 6.733 -8.749 -8.607
263 H ALA 43 H ALA 43 2.300 -7.599 -6.996
264 HA ALA 43 HA ALA 43 -0.057 -7.741 -5.444
265 HB1 ALA 43 3HB ALA 43 0.246 -8.959 -7.567
266 HB2 ALA 43 1HB ALA 43 -0.255 -10.020 -6.249
267 HB3 ALA 43 2HB ALA 43 1.426 -10.003 -6.779
268 H LEU 44 H LEU 44 0.046 -7.751 -3.280
269 HA LEU 44 HA LEU 44 2.048 -9.365 -1.915
270 HG LEU 44 HG LEU 44 2.125 -6.575 0.419
271 HB2 LEU 44 2HB LEU 44 0.194 -7.197 -1.078
272 HB3 LEU 44 1HB LEU 44 0.648 -8.385 0.126
273 HD11 LEU 44 1HD1 LEU 44 3.577 -8.618 -1.264
274 HD12 LEU 44 2HD1 LEU 44 3.223 -8.759 0.459
275 HD13 LEU 44 3HD1 LEU 44 4.312 -7.498 -0.116
276 HD21 LEU 44 3HD2 LEU 44 1.793 -5.343 -1.574
277 HD22 LEU 44 1HD2 LEU 44 2.494 -6.627 -2.562
278 HD23 LEU 44 2HD2 LEU 44 3.514 -5.708 -1.455
279 H ASP 45 H ASP 45 1.647 -11.173 -0.860
280 HA ASP 45 HA ASP 45 -1.130 -12.125 -0.714
281 HB2 ASP 45 2HB ASP 45 0.588 -13.536 -1.949
282 HB3 ASP 45 1HB ASP 45 1.408 -13.757 -0.407
283 H SER 46 H SER 46 -1.291 -13.681 1.377
284 HA SER 46 HA SER 46 -1.235 -11.959 3.570
285 HG SER 46 HG SER 46 -3.386 -13.072 3.338
286 HB2 SER 46 2HB SER 46 -1.298 -14.983 3.612
287 HB3 SER 46 1HB SER 46 -1.861 -13.907 4.889
288 H THR 47 H THR 47 1.133 -14.280 2.434
289 HA THR 47 HA THR 47 2.624 -14.257 4.900
290 HB THR 47 HB THR 47 4.245 -15.657 3.506
291 HG1 THR 47 HG1 THR 47 3.269 -16.491 1.557
292 HG21 THR 47 3HG2 THR 47 2.801 -17.637 3.604
293 HG22 THR 47 1HG2 THR 47 1.388 -16.598 3.799
294 HG23 THR 47 2HG2 THR 47 2.627 -16.645 5.052
295 H THR 48 H THR 48 2.637 -12.314 2.061
296 HA THR 48 HA THR 48 5.520 -11.835 2.301
297 HB THR 48 HB THR 48 5.307 -10.765 0.044
298 HG1 THR 48 HG1 THR 48 3.204 -10.275 -0.210
299 HG21 THR 48 3HG2 THR 48 6.069 -13.077 0.290
300 HG22 THR 48 1HG2 THR 48 5.086 -12.893 -1.164
301 HG23 THR 48 2HG2 THR 48 4.397 -13.639 0.278
302 H VAL 49 H VAL 49 2.471 -10.207 2.725
303 HA VAL 49 HA VAL 49 3.361 -7.591 2.174
304 HB VAL 49 HB VAL 49 1.048 -7.806 2.134
305 HG11 VAL 49 1HG1 VAL 49 -0.311 -8.625 4.022
306 HG12 VAL 49 2HG1 VAL 49 1.168 -8.968 4.919
307 HG13 VAL 49 3HG1 VAL 49 0.815 -9.852 3.435
308 HG21 VAL 49 3HG2 VAL 49 1.717 -6.451 4.738
309 HG22 VAL 49 1HG2 VAL 49 0.198 -6.278 3.857
310 HG23 VAL 49 2HG2 VAL 49 1.706 -5.712 3.137
311 H ALA 50 H ALA 50 4.535 -6.217 3.222
312 HA ALA 50 HA ALA 50 5.229 -6.731 6.022
313 HB1 ALA 50 3HB ALA 50 7.068 -5.157 5.662
314 HB2 ALA 50 1HB ALA 50 6.496 -4.862 4.020
315 HB3 ALA 50 2HB ALA 50 7.103 -6.457 4.468
316 H ALA 51 H ALA 51 3.846 -5.784 7.366
317 HA ALA 51 HA ALA 51 2.843 -3.111 6.705
318 HB1 ALA 51 3HB ALA 51 1.787 -5.123 8.691
319 HB2 ALA 51 1HB ALA 51 1.122 -4.792 7.092
320 HB3 ALA 51 2HB ALA 51 1.080 -3.546 8.339
321 H HIS 52 H HIS 52 3.031 -1.441 8.122
322 HA HIS 52 HA HIS 52 4.490 -1.871 10.619
323 HD1 HIS 52 HD1 HIS 52 7.698 -1.109 11.037
324 HD2 HIS 52 HD2 HIS 52 5.310 2.246 10.463
325 HE1 HIS 52 HE1 HIS 52 8.556 0.615 12.646
326 HE2 HIS 52 HE2 HIS 52 6.866 2.480 12.509
327 HB2 HIS 52 2HB HIS 52 6.208 -1.271 8.975
328 HB3 HIS 52 1HB HIS 52 5.294 0.160 8.515
329 H GLU 53 H GLU 53 2.636 -1.454 11.735
330 HA GLU 53 HA GLU 53 1.219 -0.221 12.968
331 HB2 GLU 53 2HB GLU 53 2.890 2.076 11.954
332 HB3 GLU 53 1HB GLU 53 1.680 2.214 13.225
333 HG2 GLU 53 2HG GLU 53 2.909 0.647 14.607
334 HG3 GLU 53 1HG GLU 53 4.093 0.412 13.324
335 H SER 54 H SER 54 1.622 1.960 10.143
336 HA SER 54 HA SER 54 -1.244 1.558 9.616
337 HG SER 54 HG SER 54 -1.017 2.833 11.598
338 HB2 SER 54 2HB SER 54 0.158 4.241 9.650
339 HB3 SER 54 1HB SER 54 -1.531 3.964 9.224
340 H GLU 55 H GLU 55 1.648 1.030 8.430
341 HA GLU 55 HA GLU 55 0.901 1.752 5.670
342 HB2 GLU 55 2HB GLU 55 3.668 1.447 6.852
343 HB3 GLU 55 1HB GLU 55 3.326 1.737 5.153
344 HG2 GLU 55 2HG GLU 55 2.279 3.880 5.759
345 HG3 GLU 55 1HG GLU 55 2.715 3.589 7.444
346 H ILE 56 H ILE 56 1.342 0.215 4.036
347 HA ILE 56 HA ILE 56 2.314 -2.421 4.808
348 HB ILE 56 HB ILE 56 0.250 -3.303 4.949
349 HG12 ILE 56 2HG1 ILE 56 0.199 -2.750 1.977
350 HG13 ILE 56 1HG1 ILE 56 0.883 -4.168 2.766
351 HG21 ILE 56 1HG2 ILE 56 -0.771 -1.124 5.228
352 HG22 ILE 56 2HG2 ILE 56 -1.808 -2.184 4.273
353 HG23 ILE 56 3HG2 ILE 56 -0.864 -0.924 3.478
354 HD11 ILE 56 3HD1 ILE 56 -1.277 -4.652 1.775
355 HD12 ILE 56 1HD1 ILE 56 -2.018 -3.383 2.750
356 HD13 ILE 56 2HD1 ILE 56 -1.338 -4.811 3.531
357 H TYR 57 H TYR 57 3.681 -3.155 3.303
358 HA TYR 57 HA TYR 57 3.338 -2.332 0.527
359 HD1 TYR 57 HD2 TYR 57 4.274 0.330 -0.365
360 HD2 TYR 57 HD1 TYR 57 5.339 -0.401 3.683
361 HE1 TYR 57 HE2 TYR 57 3.640 2.636 0.209
362 HE2 TYR 57 HE1 TYR 57 4.716 1.895 4.273
363 HH TYR 57 HH TYR 57 4.321 4.004 3.352
364 HB2 TYR 57 2HB TYR 57 5.969 -1.940 1.983
365 HB3 TYR 57 1HB TYR 57 5.661 -1.609 0.283
366 H CYS 58 H CYS 58 5.094 -3.380 -0.850
367 HA CYS 58 HA CYS 58 5.181 -6.180 -0.321
368 HB2 CYS 58 2HB CYS 58 6.301 -6.355 -2.438
369 HB3 CYS 58 1HB CYS 58 5.060 -5.121 -2.611
370 H LYS 59 H LYS 59 7.509 -7.231 -0.755
371 HA LYS 59 HA LYS 59 9.142 -6.348 1.447
372 HB2 LYS 59 2HB LYS 59 9.479 -8.577 -0.561
373 HB3 LYS 59 1HB LYS 59 10.630 -8.254 0.727
374 HG2 LYS 59 2HG LYS 59 8.853 -8.626 2.385
375 HG3 LYS 59 1HG LYS 59 7.736 -9.012 1.073
376 HD2 LYS 59 2HD LYS 59 9.108 -10.897 0.419
377 HD3 LYS 59 1HD LYS 59 10.308 -10.482 1.644
378 HE2 LYS 59 2HE LYS 59 7.448 -11.251 2.205
379 HE3 LYS 59 1HE LYS 59 8.826 -12.344 2.318
380 HZ1 LYS 59 3HZ LYS 59 9.762 -10.878 4.034
381 HZ2 LYS 59 1HZ LYS 59 8.252 -11.503 4.482
382 HZ3 LYS 59 2HZ LYS 59 8.377 -9.898 3.958
383 H VAL 60 H VAL 60 8.931 -5.590 -1.835
384 HA VAL 60 HA VAL 60 11.740 -5.106 -2.275
385 HB VAL 60 HB VAL 60 9.376 -4.237 -3.951
386 HG11 VAL 60 1HG1 VAL 60 11.365 -2.927 -4.417
387 HG12 VAL 60 2HG1 VAL 60 11.027 -4.024 -5.756
388 HG13 VAL 60 3HG1 VAL 60 12.315 -4.398 -4.609
389 HG21 VAL 60 3HG2 VAL 60 11.147 -6.666 -4.212
390 HG22 VAL 60 1HG2 VAL 60 9.899 -6.173 -5.357
391 HG23 VAL 60 2HG2 VAL 60 9.453 -6.660 -3.722
392 H CYS 61 H CYS 61 8.831 -3.035 -1.991
393 HA CYS 61 HA CYS 61 10.350 -0.626 -1.924
394 HB2 CYS 61 2HB CYS 61 7.518 -1.122 -0.995
395 HB3 CYS 61 1HB CYS 61 8.255 0.462 -1.233
396 H TYR 62 H TYR 62 8.991 -2.713 0.588
397 HA TYR 62 HA TYR 62 9.769 -1.079 2.776
398 HD1 TYR 62 HD1 TYR 62 10.993 -4.095 4.854
399 HD2 TYR 62 HD2 TYR 62 7.393 -1.829 4.694
400 HE1 TYR 62 HE1 TYR 62 11.024 -3.875 7.301
401 HE2 TYR 62 HE2 TYR 62 7.421 -1.600 7.139
402 HH TYR 62 HH TYR 62 8.341 -2.717 9.079
403 HB2 TYR 62 2HB TYR 62 8.140 -3.072 2.768
404 HB3 TYR 62 1HB TYR 62 9.568 -4.094 2.844
405 H GLY 63 H GLY 63 11.389 -3.384 0.742
406 HA2 GLY 63 2HA GLY 63 13.696 -3.681 2.437
407 HA3 GLY 63 1HA GLY 63 13.503 -4.309 0.809
408 H ARG 64 H ARG 64 12.794 -1.513 -0.162
409 HA ARG 64 HA ARG 64 15.555 -0.645 -0.442
410 HE ARG 64 HE ARG 64 10.297 0.184 -3.224
411 HB2 ARG 64 2HB ARG 64 14.660 0.967 -2.131
412 HB3 ARG 64 1HB ARG 64 14.376 -0.723 -2.508
413 HG2 ARG 64 2HG ARG 64 12.061 -0.502 -1.756
414 HG3 ARG 64 1HG ARG 64 12.348 1.198 -1.375
415 HD2 ARG 64 2HD ARG 64 12.740 1.721 -3.663
416 HD3 ARG 64 1HD ARG 64 12.771 0.018 -4.111
417 HH11 ARG 64 1HH1 ARG 64 12.039 2.563 -5.107
418 HH12 ARG 64 2HH1 ARG 64 10.645 3.039 -6.023
419 HH21 ARG 64 1HH2 ARG 64 8.461 0.804 -4.412
420 HH22 ARG 64 2HH2 ARG 64 8.609 2.033 -5.644
421 H ARG 65 H ARG 65 12.500 0.629 0.817
422 HA ARG 65 HA ARG 65 13.485 3.166 1.545
423 HE ARG 65 HE ARG 65 10.094 3.626 5.676
424 HB2 ARG 65 2HB ARG 65 11.119 2.821 1.457
425 HB3 ARG 65 1HB ARG 65 11.205 1.504 2.613
426 HG2 ARG 65 2HG ARG 65 11.691 3.000 4.402
427 HG3 ARG 65 1HG ARG 65 11.902 4.352 3.288
428 HD2 ARG 65 2HD ARG 65 9.694 4.726 3.141
429 HD3 ARG 65 1HD ARG 65 9.318 3.006 3.053
430 HH11 ARG 65 1HH1 ARG 65 7.504 4.433 3.468
431 HH12 ARG 65 2HH1 ARG 65 6.271 4.422 4.705
432 HH21 ARG 65 1HH2 ARG 65 8.499 3.633 7.309
433 HH22 ARG 65 2HH2 ARG 65 6.837 3.975 6.887
434 H TYR 66 H TYR 66 13.368 0.085 3.271
435 HA TYR 66 HA TYR 66 15.120 1.239 5.337
436 HD1 TYR 66 HD1 TYR 66 14.063 1.710 7.580
437 HD2 TYR 66 HD2 TYR 66 11.193 -0.715 5.584
438 HE1 TYR 66 HE1 TYR 66 12.254 3.014 8.614
439 HE2 TYR 66 HE2 TYR 66 9.375 0.588 6.605
440 HH TYR 66 HH TYR 66 9.208 2.027 8.857
441 HB2 TYR 66 2HB TYR 66 13.425 -1.265 5.408
442 HB3 TYR 66 1HB TYR 66 14.512 -0.756 6.694
Start of MODEL 10
1 H1 GLY 7 1H GLY 7 -19.678 2.746 7.481
2 HA2 GLY 7 2HA GLY 7 -18.012 0.565 6.552
3 HA3 GLY 7 1HA GLY 7 -18.465 1.725 5.312
4 H ALA 8 H ALA 8 -16.057 1.871 5.284
5 HA ALA 8 HA ALA 8 -15.252 4.163 6.925
6 HB1 ALA 8 3HB ALA 8 -13.580 1.673 6.551
7 HB2 ALA 8 1HB ALA 8 -14.315 2.216 8.058
8 HB3 ALA 8 2HB ALA 8 -13.031 3.169 7.308
9 H LYS 9 H LYS 9 -12.685 4.458 5.933
10 HA LYS 9 HA LYS 9 -13.147 4.679 3.038
11 HB2 LYS 9 2HB LYS 9 -11.613 6.630 3.060
12 HB3 LYS 9 1HB LYS 9 -13.076 6.899 3.998
13 HG2 LYS 9 2HG LYS 9 -11.880 6.561 6.057
14 HG3 LYS 9 1HG LYS 9 -10.418 6.114 5.174
15 HD2 LYS 9 2HD LYS 9 -11.784 8.802 5.021
16 HD3 LYS 9 1HD LYS 9 -10.369 8.443 6.015
17 HE2 LYS 9 2HE LYS 9 -9.128 7.831 3.976
18 HE3 LYS 9 1HE LYS 9 -10.537 8.258 3.007
19 HZ1 LYS 9 3HZ LYS 9 -8.869 10.027 3.092
20 HZ2 LYS 9 1HZ LYS 9 -9.059 10.136 4.772
21 HZ3 LYS 9 2HZ LYS 9 -10.351 10.528 3.745
22 H CYS 10 H CYS 10 -11.586 3.996 1.703
23 HA CYS 10 HA CYS 10 -9.923 1.916 2.520
24 HB2 CYS 10 2HB CYS 10 -10.889 2.509 0.225
25 HB3 CYS 10 1HB CYS 10 -9.523 3.594 0.059
26 H GLY 11 H GLY 11 -7.994 1.907 3.446
27 HA2 GLY 11 2HA GLY 11 -6.436 4.261 3.841
28 HA3 GLY 11 1HA GLY 11 -5.926 2.612 4.179
29 H ALA 12 H ALA 12 -6.885 2.336 1.147
30 HA ALA 12 HA ALA 12 -4.197 2.868 0.091
31 HB1 ALA 12 3HB ALA 12 -4.951 0.552 -0.035
32 HB2 ALA 12 1HB ALA 12 -4.739 1.246 -1.642
33 HB3 ALA 12 2HB ALA 12 -6.357 1.057 -0.970
34 H CYS 13 H CYS 13 -7.584 2.928 -1.091
35 HA CYS 13 HA CYS 13 -6.801 5.234 -2.745
36 HB2 CYS 13 2HB CYS 13 -8.503 4.677 -4.308
37 HB3 CYS 13 1HB CYS 13 -7.694 3.164 -3.924
38 H GLU 14 H GLU 14 -8.994 6.612 -3.168
39 HA GLU 14 HA GLU 14 -9.718 7.418 -0.447
40 HB2 GLU 14 2HB GLU 14 -9.955 8.918 -3.067
41 HB3 GLU 14 1HB GLU 14 -10.382 9.562 -1.486
42 HG2 GLU 14 2HG GLU 14 -8.088 9.386 -0.753
43 HG3 GLU 14 1HG GLU 14 -7.631 8.637 -2.282
44 H LYS 15 H LYS 15 -10.964 5.188 -2.005
45 HA LYS 15 HA LYS 15 -13.712 6.188 -2.218
46 HB2 LYS 15 2HB LYS 15 -12.547 3.516 -3.030
47 HB3 LYS 15 1HB LYS 15 -14.218 4.015 -3.274
48 HG2 LYS 15 2HG LYS 15 -13.314 5.938 -4.638
49 HG3 LYS 15 1HG LYS 15 -11.747 5.135 -4.565
50 HD2 LYS 15 2HD LYS 15 -14.273 3.918 -5.679
51 HD3 LYS 15 1HD LYS 15 -12.981 4.636 -6.640
52 HE2 LYS 15 2HE LYS 15 -12.709 2.256 -4.810
53 HE3 LYS 15 1HE LYS 15 -12.808 2.196 -6.569
54 HZ1 LYS 15 3HZ LYS 15 -10.542 2.049 -6.056
55 HZ2 LYS 15 1HZ LYS 15 -10.619 3.280 -4.891
56 HZ3 LYS 15 2HZ LYS 15 -10.757 3.663 -6.534
57 H THR 16 H THR 16 -15.424 4.740 -1.330
58 HA THR 16 HA THR 16 -14.879 4.356 1.454
59 HB THR 16 HB THR 16 -17.376 3.540 1.298
60 HG1 THR 16 HG1 THR 16 -17.569 3.427 -0.921
61 HG21 THR 16 3HG2 THR 16 -18.120 5.892 1.413
62 HG22 THR 16 1HG2 THR 16 -16.535 6.405 0.838
63 HG23 THR 16 2HG2 THR 16 -16.689 5.605 2.401
64 H VAL 17 H VAL 17 -14.810 2.519 2.605
65 HA VAL 17 HA VAL 17 -14.876 -0.016 1.110
66 HB VAL 17 HB VAL 17 -13.322 0.727 3.594
67 HG11 VAL 17 1HG1 VAL 17 -13.525 -1.953 2.224
68 HG12 VAL 17 2HG1 VAL 17 -14.192 -1.549 3.804
69 HG13 VAL 17 3HG1 VAL 17 -12.446 -1.555 3.561
70 HG21 VAL 17 3HG2 VAL 17 -12.447 -0.152 0.854
71 HG22 VAL 17 1HG2 VAL 17 -11.380 0.197 2.216
72 HG23 VAL 17 2HG2 VAL 17 -12.346 1.488 1.497
73 H TYR 18 H TYR 18 -16.444 -1.363 1.577
74 HA TYR 18 HA TYR 18 -17.631 -1.297 4.266
75 HD1 TYR 18 HD1 TYR 18 -20.323 -0.114 4.370
76 HD2 TYR 18 HD2 TYR 18 -18.741 -0.164 0.424
77 HE1 TYR 18 HE1 TYR 18 -21.153 2.169 4.016
78 HE2 TYR 18 HE2 TYR 18 -19.568 2.120 0.056
79 HH TYR 18 HH TYR 18 -21.315 3.610 0.944
80 HB2 TYR 18 2HB TYR 18 -18.925 -2.197 1.679
81 HB3 TYR 18 1HB TYR 18 -19.681 -2.220 3.270
82 H HIS 19 H HIS 19 -18.732 -3.669 4.585
83 HA HIS 19 HA HIS 19 -16.564 -5.350 5.031
84 HD1 HIS 19 HD1 HIS 19 -19.575 -8.279 3.891
85 HD2 HIS 19 HD2 HIS 19 -21.074 -4.559 5.007
86 HE1 HIS 19 HE1 HIS 19 -21.922 -8.194 2.986
87 HE2 HIS 19 HE2 HIS 19 -22.847 -5.977 3.750
88 HB2 HIS 19 2HB HIS 19 -18.149 -7.085 5.626
89 HB3 HIS 19 1HB HIS 19 -18.707 -5.534 6.238
90 H ALA 20 H ALA 20 -18.514 -5.031 2.182
91 HA ALA 20 HA ALA 20 -18.284 -7.488 0.944
92 HB1 ALA 20 3HB ALA 20 -18.193 -4.769 -0.355
93 HB2 ALA 20 1HB ALA 20 -19.656 -5.630 0.132
94 HB3 ALA 20 2HB ALA 20 -18.631 -6.289 -1.145
95 H GLU 21 H GLU 21 -16.133 -4.700 0.459
96 HA GLU 21 HA GLU 21 -14.220 -6.480 -0.897
97 HB2 GLU 21 2HB GLU 21 -15.239 -4.678 -2.262
98 HB3 GLU 21 1HB GLU 21 -14.637 -3.486 -1.129
99 HG2 GLU 21 2HG GLU 21 -13.244 -3.440 -3.038
100 HG3 GLU 21 1HG GLU 21 -12.325 -4.177 -1.731
101 H GLU 22 H GLU 22 -14.538 -5.930 2.026
102 HA GLU 22 HA GLU 22 -12.398 -4.129 2.732
103 HB2 GLU 22 2HB GLU 22 -14.381 -4.156 4.115
104 HB3 GLU 22 1HB GLU 22 -14.186 -5.877 4.425
105 HG2 GLU 22 2HG GLU 22 -11.971 -5.313 5.489
106 HG3 GLU 22 1HG GLU 22 -12.449 -3.619 5.382
107 H ILE 23 H ILE 23 -10.395 -4.615 3.260
108 HA ILE 23 HA ILE 23 -9.831 -7.268 4.365
109 HB ILE 23 HB ILE 23 -8.952 -6.993 1.970
110 HG12 ILE 23 2HG1 ILE 23 -6.911 -7.576 4.120
111 HG13 ILE 23 1HG1 ILE 23 -8.170 -8.695 3.612
112 HG21 ILE 23 1HG2 ILE 23 -6.805 -5.824 1.733
113 HG22 ILE 23 2HG2 ILE 23 -7.039 -5.139 3.341
114 HG23 ILE 23 3HG2 ILE 23 -8.166 -4.745 2.040
115 HD11 ILE 23 3HD1 ILE 23 -6.040 -9.246 2.603
116 HD12 ILE 23 1HD1 ILE 23 -5.945 -7.637 1.887
117 HD13 ILE 23 2HD1 ILE 23 -7.207 -8.759 1.376
118 H GLN 24 H GLN 24 -8.824 -7.132 6.326
119 HA GLN 24 HA GLN 24 -8.174 -4.399 7.183
120 HB2 GLN 24 2HB GLN 24 -8.949 -6.812 8.816
121 HB3 GLN 24 1HB GLN 24 -8.475 -5.262 9.498
122 HG2 GLN 24 2HG GLN 24 -10.354 -4.230 8.200
123 HG3 GLN 24 1HG GLN 24 -10.884 -5.864 7.809
124 HE21 GLN 24 1HE2 GLN 24 -12.247 -3.784 9.311
125 HE22 GLN 24 2HE2 GLN 24 -12.573 -4.446 10.878
126 H CYS 25 H CYS 25 -6.150 -3.907 7.177
127 HA CYS 25 HA CYS 25 -4.199 -5.882 8.158
128 HG CYS 25 HG CYS 25 -1.167 -4.532 5.638
129 HB2 CYS 25 2HB CYS 25 -3.831 -5.320 5.782
130 HB3 CYS 25 1HB CYS 25 -3.744 -3.612 6.199
131 H ASN 26 H ASN 26 -3.421 -5.398 10.077
132 HA ASN 26 HA ASN 26 -2.531 -4.286 11.831
133 HB2 ASN 26 2HB ASN 26 -1.174 -2.967 10.371
134 HB3 ASN 26 1HB ASN 26 -2.538 -1.948 9.924
135 HD21 ASN 26 1HD2 ASN 26 -0.264 -2.751 12.445
136 HD22 ASN 26 2HD2 ASN 26 -0.488 -1.302 13.362
137 H GLY 27 H GLY 27 -4.655 -1.803 10.407
138 HA2 GLY 27 2HA GLY 27 -6.682 -2.201 12.390
139 HA3 GLY 27 1HA GLY 27 -5.681 -0.799 12.742
140 H ARG 28 H ARG 28 -6.138 -1.647 9.438
141 HA ARG 28 HA ARG 28 -8.104 0.519 9.148
142 HE ARG 28 HE ARG 28 -4.231 3.646 9.636
143 HB2 ARG 28 2HB ARG 28 -5.652 0.070 7.435
144 HB3 ARG 28 1HB ARG 28 -6.915 1.243 7.096
145 HG2 ARG 28 2HG ARG 28 -6.371 2.431 9.157
146 HG3 ARG 28 1HG ARG 28 -5.113 1.245 9.510
147 HD2 ARG 28 2HD ARG 28 -3.948 1.875 7.452
148 HD3 ARG 28 1HD ARG 28 -5.203 3.064 7.103
149 HH11 ARG 28 1HH1 ARG 28 -3.012 3.560 6.356
150 HH12 ARG 28 2HH1 ARG 28 -1.804 4.775 6.623
151 HH21 ARG 28 1HH2 ARG 28 -2.629 5.252 10.002
152 HH22 ARG 28 2HH2 ARG 28 -1.604 5.748 8.690
153 H SER 29 H SER 29 -9.653 0.225 7.597
154 HA SER 29 HA SER 29 -9.801 -2.408 6.366
155 HG SER 29 HG SER 29 -12.624 -2.454 7.545
156 HB2 SER 29 2HB SER 29 -11.790 -0.127 6.504
157 HB3 SER 29 1HB SER 29 -12.098 -1.656 5.685
158 H PHE 30 H PHE 30 -8.889 -2.696 4.479
159 HA PHE 30 HA PHE 30 -8.751 -0.477 2.541
160 HD1 PHE 30 HD1 PHE 30 -6.448 -2.953 4.874
161 HD2 PHE 30 HD2 PHE 30 -5.755 0.176 2.079
162 HE1 PHE 30 HE1 PHE 30 -4.733 -2.010 6.364
163 HE2 PHE 30 HE2 PHE 30 -4.037 1.124 3.562
164 HZ PHE 30 HZ PHE 30 -3.523 0.031 5.711
165 HB2 PHE 30 2HB PHE 30 -7.238 -3.108 2.572
166 HB3 PHE 30 1HB PHE 30 -6.986 -1.777 1.446
167 H HIS 31 H HIS 31 -9.008 -1.223 0.215
168 HA HIS 31 HA HIS 31 -11.039 -3.277 -0.091
169 HD2 HIS 31 HD2 HIS 31 -13.124 -2.077 -0.567
170 HE1 HIS 31 HE1 HIS 31 -12.759 1.778 -2.277
171 HE2 HIS 31 HE2 HIS 31 -14.340 0.144 -1.156
172 HB2 HIS 31 2HB HIS 31 -9.532 -1.603 -2.116
173 HB3 HIS 31 1HB HIS 31 -10.701 -2.837 -2.563
174 H LYS 32 H LYS 32 -10.670 -5.340 -0.868
175 HA LYS 32 HA LYS 32 -8.131 -6.498 -0.576
176 HB2 LYS 32 2HB LYS 32 -10.139 -7.861 -0.477
177 HB3 LYS 32 1HB LYS 32 -10.527 -7.471 -2.148
178 HG2 LYS 32 2HG LYS 32 -8.470 -8.629 -2.865
179 HG3 LYS 32 1HG LYS 32 -8.167 -9.073 -1.183
180 HD2 LYS 32 2HD LYS 32 -10.204 -10.360 -1.110
181 HD3 LYS 32 1HD LYS 32 -10.640 -9.825 -2.737
182 HE2 LYS 32 2HE LYS 32 -8.668 -10.935 -3.639
183 HE3 LYS 32 1HE LYS 32 -8.206 -11.450 -2.019
184 HZ1 LYS 32 3HZ LYS 32 -10.101 -12.847 -1.881
185 HZ2 LYS 32 1HZ LYS 32 -9.355 -13.169 -3.373
186 HZ3 LYS 32 2HZ LYS 32 -10.762 -12.221 -3.311
187 H THR 33 H THR 33 -9.816 -5.198 -3.355
188 HA THR 33 HA THR 33 -7.927 -5.891 -5.332
189 HB THR 33 HB THR 33 -9.769 -3.492 -5.315
190 HG1 THR 33 HG1 THR 33 -10.819 -5.576 -4.878
191 HG21 THR 33 3HG2 THR 33 -8.629 -5.111 -7.598
192 HG22 THR 33 1HG2 THR 33 -8.097 -3.498 -7.119
193 HG23 THR 33 2HG2 THR 33 -9.729 -3.739 -7.744
194 H CYS 34 H CYS 34 -8.053 -3.321 -2.976
195 HA CYS 34 HA CYS 34 -5.885 -1.850 -4.230
196 HB2 CYS 34 2HB CYS 34 -7.486 -1.345 -1.715
197 HB3 CYS 34 1HB CYS 34 -6.195 -0.298 -2.291
198 H PHE 35 H PHE 35 -6.055 -4.546 -2.389
199 HA PHE 35 HA PHE 35 -3.987 -3.924 -0.478
200 HD1 PHE 35 HD2 PHE 35 -4.577 -4.744 1.955
201 HD2 PHE 35 HD1 PHE 35 -3.361 -8.086 -0.383
202 HE1 PHE 35 HE2 PHE 35 -3.212 -5.558 3.833
203 HE2 PHE 35 HE1 PHE 35 -1.998 -8.908 1.492
204 HZ PHE 35 HZ PHE 35 -1.921 -7.641 3.604
205 HB2 PHE 35 2HB PHE 35 -5.871 -5.581 -0.086
206 HB3 PHE 35 1HB PHE 35 -5.031 -6.668 -1.186
207 H HIS 36 H HIS 36 -2.824 -3.177 -2.576
208 HA HIS 36 HA HIS 36 -0.884 -5.300 -3.188
209 HD1 HIS 36 HD1 HIS 36 -2.676 -6.431 -4.022
210 HD2 HIS 36 HD2 HIS 36 -2.910 -4.027 -7.391
211 HE1 HIS 36 HE1 HIS 36 -4.379 -7.524 -5.515
212 HE2 HIS 36 HE2 HIS 36 -4.669 -5.923 -7.442
213 HB2 HIS 36 2HB HIS 36 -1.691 -3.022 -5.012
214 HB3 HIS 36 1HB HIS 36 -0.454 -4.225 -5.352
215 H CYS 37 H CYS 37 1.264 -4.014 -4.020
216 HA CYS 37 HA CYS 37 2.232 -2.862 -1.704
217 HB2 CYS 37 2HB CYS 37 3.716 -3.751 -3.460
218 HB3 CYS 37 1HB CYS 37 3.352 -2.341 -4.453
219 H MET 38 H MET 38 1.967 -1.129 -0.790
220 HA MET 38 HA MET 38 0.459 1.036 -1.799
221 HB2 MET 38 2HB MET 38 0.354 0.177 0.493
222 HB3 MET 38 1HB MET 38 2.033 0.609 0.746
223 HG2 MET 38 2HG MET 38 0.386 2.107 1.777
224 HG3 MET 38 1HG MET 38 1.531 2.891 0.707
225 HE1 MET 38 3HE MET 38 -2.764 1.865 -0.631
226 HE2 MET 38 1HE MET 38 -2.105 1.381 0.931
227 HE3 MET 38 2HE MET 38 -1.437 0.705 -0.553
228 H ALA 39 H ALA 39 3.562 0.183 -2.404
229 HA ALA 39 HA ALA 39 4.452 2.981 -2.630
230 HB1 ALA 39 3HB ALA 39 6.175 0.526 -2.362
231 HB2 ALA 39 1HB ALA 39 5.845 1.703 -1.092
232 HB3 ALA 39 2HB ALA 39 6.747 2.186 -2.529
233 H CYS 40 H CYS 40 4.996 -0.216 -4.229
234 HA CYS 40 HA CYS 40 5.375 1.316 -6.698
235 HB2 CYS 40 2HB CYS 40 6.485 -0.663 -7.644
236 HB3 CYS 40 1HB CYS 40 7.280 -0.106 -6.183
237 H ARG 41 H ARG 41 4.495 -2.057 -6.611
238 HA ARG 41 HA ARG 41 1.708 -1.747 -6.886
239 HE ARG 41 HE ARG 41 0.423 -3.684 -9.311
240 HB2 ARG 41 2HB ARG 41 3.206 -1.274 -9.292
241 HB3 ARG 41 1HB ARG 41 2.278 -2.752 -9.483
242 HG2 ARG 41 2HG ARG 41 1.163 -0.065 -8.707
243 HG3 ARG 41 1HG ARG 41 1.061 -0.807 -10.304
244 HD2 ARG 41 2HD ARG 41 -0.152 -1.855 -7.751
245 HD3 ARG 41 1HD ARG 41 -1.019 -1.113 -9.094
246 HH11 ARG 41 1HH1 ARG 41 -2.303 -1.601 -10.070
247 HH12 ARG 41 2HH1 ARG 41 -3.109 -2.806 -11.040
248 HH21 ARG 41 1HH2 ARG 41 -0.653 -5.274 -10.561
249 HH22 ARG 41 2HH2 ARG 41 -2.185 -4.894 -11.286
250 H LYS 42 H LYS 42 4.254 -3.524 -6.171
251 HA LYS 42 HA LYS 42 3.937 -6.071 -7.184
252 HB2 LYS 42 2HB LYS 42 5.784 -5.439 -5.730
253 HB3 LYS 42 1HB LYS 42 4.684 -5.214 -4.380
254 HG2 LYS 42 2HG LYS 42 5.799 -7.280 -4.055
255 HG3 LYS 42 1HG LYS 42 4.143 -7.655 -4.527
256 HD2 LYS 42 2HD LYS 42 4.905 -8.030 -6.831
257 HD3 LYS 42 1HD LYS 42 6.563 -7.701 -6.321
258 HE2 LYS 42 2HE LYS 42 6.259 -10.075 -6.391
259 HE3 LYS 42 1HE LYS 42 6.369 -9.575 -4.705
260 HZ1 LYS 42 3HZ LYS 42 3.945 -9.670 -4.569
261 HZ2 LYS 42 1HZ LYS 42 4.604 -11.171 -4.998
262 HZ3 LYS 42 2HZ LYS 42 3.867 -10.196 -6.178
263 H ALA 43 H ALA 43 2.577 -7.778 -6.783
264 HA ALA 43 HA ALA 43 0.099 -7.224 -5.415
265 HB1 ALA 43 3HB ALA 43 1.133 -9.780 -6.657
266 HB2 ALA 43 1HB ALA 43 0.106 -8.581 -7.444
267 HB3 ALA 43 2HB ALA 43 -0.510 -9.509 -6.076
268 H LEU 44 H LEU 44 0.128 -7.212 -3.237
269 HA LEU 44 HA LEU 44 1.849 -9.071 -1.791
270 HG LEU 44 HG LEU 44 2.372 -6.013 0.205
271 HB2 LEU 44 2HB LEU 44 0.259 -6.658 -0.973
272 HB3 LEU 44 1HB LEU 44 0.810 -7.803 0.231
273 HD11 LEU 44 1HD1 LEU 44 3.368 -8.233 0.383
274 HD12 LEU 44 2HD1 LEU 44 4.447 -7.124 -0.464
275 HD13 LEU 44 3HD1 LEU 44 3.522 -8.319 -1.371
276 HD21 LEU 44 3HD2 LEU 44 1.815 -5.042 -1.939
277 HD22 LEU 44 1HD2 LEU 44 2.549 -6.410 -2.777
278 HD23 LEU 44 2HD2 LEU 44 3.554 -5.317 -1.824
279 H ASP 45 H ASP 45 1.131 -10.744 -0.618
280 HA ASP 45 HA ASP 45 -1.782 -11.152 -0.499
281 HB2 ASP 45 2HB ASP 45 -1.439 -13.536 -0.557
282 HB3 ASP 45 1HB ASP 45 -0.567 -12.830 -1.913
283 H SER 46 H SER 46 -1.781 -13.243 1.327
284 HA SER 46 HA SER 46 -2.015 -11.839 3.697
285 HG SER 46 HG SER 46 -4.136 -14.210 3.558
286 HB2 SER 46 2HB SER 46 -1.572 -14.816 3.449
287 HB3 SER 46 1HB SER 46 -2.428 -13.966 4.737
288 H THR 47 H THR 47 0.777 -13.685 2.511
289 HA THR 47 HA THR 47 2.023 -13.358 5.149
290 HB THR 47 HB THR 47 1.918 -15.653 4.253
291 HG1 THR 47 HG1 THR 47 3.610 -15.247 5.652
292 HG21 THR 47 3HG2 THR 47 2.136 -15.166 1.864
293 HG22 THR 47 1HG2 THR 47 3.372 -16.308 2.392
294 HG23 THR 47 2HG2 THR 47 3.792 -14.616 2.124
295 H THR 48 H THR 48 2.261 -12.129 1.927
296 HA THR 48 HA THR 48 5.116 -11.684 2.143
297 HB THR 48 HB THR 48 4.778 -10.639 -0.174
298 HG1 THR 48 HG1 THR 48 2.535 -12.160 -0.576
299 HG21 THR 48 3HG2 THR 48 5.767 -12.843 0.197
300 HG22 THR 48 1HG2 THR 48 4.724 -12.855 -1.227
301 HG23 THR 48 2HG2 THR 48 4.157 -13.559 0.288
302 H VAL 49 H VAL 49 2.217 -9.780 2.538
303 HA VAL 49 HA VAL 49 3.350 -7.264 1.951
304 HB VAL 49 HB VAL 49 1.029 -7.215 2.018
305 HG11 VAL 49 1HG1 VAL 49 -0.325 -7.960 3.942
306 HG12 VAL 49 2HG1 VAL 49 1.149 -8.451 4.777
307 HG13 VAL 49 3HG1 VAL 49 0.660 -9.271 3.293
308 HG21 VAL 49 3HG2 VAL 49 1.949 -5.227 3.050
309 HG22 VAL 49 1HG2 VAL 49 1.929 -6.012 4.629
310 HG23 VAL 49 2HG2 VAL 49 0.413 -5.647 3.806
311 H ALA 50 H ALA 50 4.579 -5.903 3.029
312 HA ALA 50 HA ALA 50 5.400 -6.667 5.724
313 HB1 ALA 50 3HB ALA 50 7.203 -6.513 4.069
314 HB2 ALA 50 1HB ALA 50 7.393 -5.315 5.349
315 HB3 ALA 50 2HB ALA 50 6.771 -4.828 3.772
316 H ALA 51 H ALA 51 4.235 -5.704 7.214
317 HA ALA 51 HA ALA 51 3.531 -2.881 6.787
318 HB1 ALA 51 3HB ALA 51 2.254 -4.878 8.648
319 HB2 ALA 51 1HB ALA 51 1.617 -4.369 7.085
320 HB3 ALA 51 2HB ALA 51 1.744 -3.206 8.407
321 H HIS 52 H HIS 52 4.904 -1.568 7.721
322 HA HIS 52 HA HIS 52 5.864 -2.170 10.421
323 HD1 HIS 52 HD1 HIS 52 8.443 -1.368 11.484
324 HD2 HIS 52 HD2 HIS 52 6.811 2.242 10.217
325 HE1 HIS 52 HE1 HIS 52 9.138 0.335 13.199
326 HE2 HIS 52 HE2 HIS 52 7.880 2.422 12.558
327 HB2 HIS 52 2HB HIS 52 7.577 -1.276 8.927
328 HB3 HIS 52 1HB HIS 52 6.558 0.105 8.534
329 H GLU 53 H GLU 53 4.041 -1.984 11.594
330 HA GLU 53 HA GLU 53 2.310 -1.057 12.699
331 HB2 GLU 53 2HB GLU 53 3.703 1.556 12.081
332 HB3 GLU 53 1HB GLU 53 2.504 1.286 13.344
333 HG2 GLU 53 2HG GLU 53 3.990 -0.232 14.485
334 HG3 GLU 53 1HG GLU 53 5.178 -0.084 13.194
335 H SER 54 H SER 54 2.322 1.955 10.984
336 HA SER 54 HA SER 54 -0.274 1.187 9.865
337 HG SER 54 HG SER 54 0.637 3.582 12.156
338 HB2 SER 54 2HB SER 54 0.926 3.953 10.095
339 HB3 SER 54 1HB SER 54 -0.759 3.546 9.765
340 H GLU 55 H GLU 55 2.669 0.895 8.712
341 HA GLU 55 HA GLU 55 1.960 1.935 6.045
342 HB2 GLU 55 2HB GLU 55 4.656 1.835 7.382
343 HB3 GLU 55 1HB GLU 55 4.465 2.066 5.651
344 HG2 GLU 55 2HG GLU 55 3.102 4.078 6.122
345 HG3 GLU 55 1HG GLU 55 3.451 3.865 7.837
346 H ILE 56 H ILE 56 1.479 0.352 4.726
347 HA ILE 56 HA ILE 56 2.862 -2.236 4.965
348 HB ILE 56 HB ILE 56 0.854 -3.159 4.688
349 HG12 ILE 56 2HG1 ILE 56 0.620 -1.662 2.071
350 HG13 ILE 56 1HG1 ILE 56 1.567 -3.132 2.296
351 HG21 ILE 56 1HG2 ILE 56 -0.143 -1.170 5.661
352 HG22 ILE 56 2HG2 ILE 56 -1.199 -1.845 4.422
353 HG23 ILE 56 3HG2 ILE 56 -0.229 -0.414 4.070
354 HD11 ILE 56 3HD1 ILE 56 -0.570 -3.639 1.276
355 HD12 ILE 56 1HD1 ILE 56 -1.421 -2.848 2.601
356 HD13 ILE 56 2HD1 ILE 56 -0.508 -4.327 2.898
357 H TYR 57 H TYR 57 4.157 -2.971 3.353
358 HA TYR 57 HA TYR 57 3.898 -1.895 0.667
359 HD1 TYR 57 HD2 TYR 57 4.941 0.715 -0.057
360 HD2 TYR 57 HD1 TYR 57 6.135 -0.267 3.900
361 HE1 TYR 57 HE2 TYR 57 4.438 3.009 0.654
362 HE2 TYR 57 HE1 TYR 57 5.639 2.025 4.626
363 HH TYR 57 HH TYR 57 5.237 4.169 3.868
364 HB2 TYR 57 2HB TYR 57 6.562 -1.773 2.120
365 HB3 TYR 57 1HB TYR 57 6.276 -1.318 0.445
366 H CYS 58 H CYS 58 5.528 -3.060 -0.830
367 HA CYS 58 HA CYS 58 5.515 -5.870 -0.218
368 HB2 CYS 58 2HB CYS 58 6.348 -6.229 -2.403
369 HB3 CYS 58 1HB CYS 58 5.260 -4.860 -2.554
370 H LYS 59 H LYS 59 7.563 -7.157 -0.350
371 HA LYS 59 HA LYS 59 9.367 -6.150 1.603
372 HB2 LYS 59 2HB LYS 59 9.464 -8.640 -0.099
373 HB3 LYS 59 1HB LYS 59 10.597 -8.291 1.201
374 HG2 LYS 59 2HG LYS 59 8.768 -8.254 2.803
375 HG3 LYS 59 1HG LYS 59 7.618 -8.578 1.507
376 HD2 LYS 59 2HD LYS 59 8.717 -10.724 1.079
377 HD3 LYS 59 1HD LYS 59 9.859 -10.397 2.384
378 HE2 LYS 59 2HE LYS 59 6.866 -10.590 2.702
379 HE3 LYS 59 1HE LYS 59 8.008 -11.884 3.073
380 HZ1 LYS 59 3HZ LYS 59 8.816 -10.776 4.901
381 HZ2 LYS 59 1HZ LYS 59 7.186 -10.314 4.947
382 HZ3 LYS 59 2HZ LYS 59 8.354 -9.243 4.343
383 H VAL 60 H VAL 60 9.199 -5.750 -1.728
384 HA VAL 60 HA VAL 60 12.025 -5.436 -2.188
385 HB VAL 60 HB VAL 60 9.712 -4.489 -3.888
386 HG11 VAL 60 1HG1 VAL 60 11.347 -4.407 -5.699
387 HG12 VAL 60 2HG1 VAL 60 12.621 -4.879 -4.575
388 HG13 VAL 60 3HG1 VAL 60 11.802 -3.329 -4.379
389 HG21 VAL 60 3HG2 VAL 60 11.332 -7.022 -4.109
390 HG22 VAL 60 1HG2 VAL 60 10.075 -6.498 -5.226
391 HG23 VAL 60 2HG2 VAL 60 9.660 -6.916 -3.561
392 H CYS 61 H CYS 61 9.219 -3.264 -1.836
393 HA CYS 61 HA CYS 61 10.831 -0.906 -1.825
394 HB2 CYS 61 2HB CYS 61 7.974 -1.339 -0.950
395 HB3 CYS 61 1HB CYS 61 8.760 0.235 -1.033
396 H TYR 62 H TYR 62 9.619 -3.071 0.661
397 HA TYR 62 HA TYR 62 10.231 -1.465 2.888
398 HD1 TYR 62 HD2 TYR 62 8.199 -2.426 4.823
399 HD2 TYR 62 HD1 TYR 62 11.901 -4.524 4.788
400 HE1 TYR 62 HE2 TYR 62 8.296 -2.285 7.274
401 HE2 TYR 62 HE1 TYR 62 12.008 -4.393 7.242
402 HH TYR 62 HH TYR 62 11.070 -2.905 9.047
403 HB2 TYR 62 2HB TYR 62 8.940 -3.672 2.846
404 HB3 TYR 62 1HB TYR 62 10.510 -4.469 2.827
405 H GLY 63 H GLY 63 12.185 -3.871 1.132
406 HA2 GLY 63 2HA GLY 63 14.573 -3.236 2.621
407 HA3 GLY 63 1HA GLY 63 14.472 -4.268 1.200
408 H ARG 64 H ARG 64 12.926 -1.739 0.132
409 HA ARG 64 HA ARG 64 15.191 -0.522 -1.168
410 HE ARG 64 HE ARG 64 12.829 3.115 -4.402
411 HB2 ARG 64 2HB ARG 64 13.219 -0.885 -2.470
412 HB3 ARG 64 1HB ARG 64 12.204 -0.101 -1.275
413 HG2 ARG 64 2HG ARG 64 13.243 2.053 -1.838
414 HG3 ARG 64 1HG ARG 64 14.210 1.241 -3.078
415 HD2 ARG 64 2HD ARG 64 12.268 0.620 -4.301
416 HD3 ARG 64 1HD ARG 64 11.203 1.104 -2.987
417 HH11 ARG 64 1HH1 ARG 64 9.704 1.820 -3.447
418 HH12 ARG 64 2HH1 ARG 64 8.826 3.223 -3.980
419 HH21 ARG 64 1HH2 ARG 64 11.658 4.941 -5.131
420 HH22 ARG 64 2HH2 ARG 64 9.927 4.982 -4.939
421 H ARG 65 H ARG 65 12.733 0.377 1.203
422 HA ARG 65 HA ARG 65 13.887 2.977 1.679
423 HE ARG 65 HE ARG 65 10.978 4.083 4.111
424 HB2 ARG 65 2HB ARG 65 11.675 1.415 3.002
425 HB3 ARG 65 1HB ARG 65 12.239 2.953 3.636
426 HG2 ARG 65 2HG ARG 65 11.661 4.020 1.493
427 HG3 ARG 65 1HG ARG 65 11.027 2.474 0.925
428 HD2 ARG 65 2HD ARG 65 9.310 4.072 1.833
429 HD3 ARG 65 1HD ARG 65 9.317 2.473 2.577
430 HH11 ARG 65 1HH1 ARG 65 7.604 4.126 3.186
431 HH12 ARG 65 2HH1 ARG 65 7.055 4.746 4.717
432 HH21 ARG 65 1HH2 ARG 65 10.295 4.934 6.082
433 HH22 ARG 65 2HH2 ARG 65 8.603 5.247 6.366
434 H TYR 66 H TYR 66 13.526 -0.000 3.614
435 HA TYR 66 HA TYR 66 15.403 1.097 5.573
436 HD1 TYR 66 HD1 TYR 66 14.231 1.167 8.298
437 HD2 TYR 66 HD2 TYR 66 11.538 -0.129 5.272
438 HE1 TYR 66 HE1 TYR 66 12.492 2.640 9.223
439 HE2 TYR 66 HE2 TYR 66 9.790 1.334 6.188
440 HH TYR 66 HH TYR 66 9.217 2.416 8.308
441 HB2 TYR 66 2HB TYR 66 13.581 -1.317 5.663
442 HB3 TYR 66 1HB TYR 66 14.675 -0.853 6.962
Start of MODEL 11
1 H1 GLY 7 1H GLY 7 -19.511 5.187 7.359
2 HA2 GLY 7 2HA GLY 7 -19.699 2.633 6.874
3 HA3 GLY 7 1HA GLY 7 -19.321 3.166 5.238
4 H ALA 8 H ALA 8 -17.338 1.956 5.293
5 HA ALA 8 HA ALA 8 -15.291 3.184 7.013
6 HB1 ALA 8 3HB ALA 8 -15.392 0.741 7.098
7 HB2 ALA 8 1HB ALA 8 -13.875 1.286 6.380
8 HB3 ALA 8 2HB ALA 8 -15.166 0.666 5.350
9 H LYS 9 H LYS 9 -13.139 3.541 5.870
10 HA LYS 9 HA LYS 9 -13.557 4.240 3.052
11 HB2 LYS 9 2HB LYS 9 -12.392 6.347 3.312
12 HB3 LYS 9 1HB LYS 9 -13.769 6.299 4.399
13 HG2 LYS 9 2HG LYS 9 -12.212 7.183 5.788
14 HG3 LYS 9 1HG LYS 9 -11.935 5.472 6.111
15 HD2 LYS 9 2HD LYS 9 -9.819 6.648 5.776
16 HD3 LYS 9 1HD LYS 9 -10.091 5.464 4.496
17 HE2 LYS 9 2HE LYS 9 -10.952 7.311 3.058
18 HE3 LYS 9 1HE LYS 9 -10.505 8.452 4.323
19 HZ1 LYS 9 3HZ LYS 9 -8.673 6.696 2.779
20 HZ2 LYS 9 1HZ LYS 9 -8.193 7.639 4.108
21 HZ3 LYS 9 2HZ LYS 9 -8.770 8.390 2.701
22 H CYS 10 H CYS 10 -11.827 3.941 1.734
23 HA CYS 10 HA CYS 10 -9.948 1.978 2.524
24 HB2 CYS 10 2HB CYS 10 -10.830 2.327 0.225
25 HB3 CYS 10 1HB CYS 10 -9.887 3.805 0.123
26 H GLY 11 H GLY 11 -8.004 2.174 3.432
27 HA2 GLY 11 2HA GLY 11 -6.882 4.674 4.166
28 HA3 GLY 11 1HA GLY 11 -6.083 3.111 4.266
29 H ALA 12 H ALA 12 -6.814 2.931 1.235
30 HA ALA 12 HA ALA 12 -4.379 4.301 0.338
31 HB1 ALA 12 3HB ALA 12 -5.986 2.133 -1.017
32 HB2 ALA 12 1HB ALA 12 -4.493 1.898 -0.105
33 HB3 ALA 12 2HB ALA 12 -4.474 2.821 -1.607
34 H CYS 13 H CYS 13 -7.812 3.899 -0.452
35 HA CYS 13 HA CYS 13 -7.646 6.031 -2.451
36 HB2 CYS 13 2HB CYS 13 -10.014 4.357 -1.580
37 HB3 CYS 13 1HB CYS 13 -9.981 5.468 -2.939
38 H GLU 14 H GLU 14 -9.674 7.528 -2.395
39 HA GLU 14 HA GLU 14 -10.414 8.232 0.368
40 HB2 GLU 14 2HB GLU 14 -10.916 9.691 -2.241
41 HB3 GLU 14 1HB GLU 14 -11.489 10.225 -0.669
42 HG2 GLU 14 2HG GLU 14 -9.216 10.503 0.105
43 HG3 GLU 14 1HG GLU 14 -8.601 9.889 -1.428
44 H LYS 15 H LYS 15 -11.166 6.154 -1.886
45 HA LYS 15 HA LYS 15 -13.999 6.421 -2.185
46 HB2 LYS 15 2HB LYS 15 -12.306 3.959 -2.637
47 HB3 LYS 15 1HB LYS 15 -13.876 4.314 -3.343
48 HG2 LYS 15 2HG LYS 15 -12.925 6.087 -4.672
49 HG3 LYS 15 1HG LYS 15 -11.357 5.868 -3.892
50 HD2 LYS 15 2HD LYS 15 -11.409 3.488 -4.752
51 HD3 LYS 15 1HD LYS 15 -12.796 3.967 -5.731
52 HE2 LYS 15 2HE LYS 15 -10.778 4.086 -7.055
53 HE3 LYS 15 1HE LYS 15 -11.404 5.713 -6.787
54 HZ1 LYS 15 3HZ LYS 15 -9.293 4.525 -5.077
55 HZ2 LYS 15 1HZ LYS 15 -9.739 6.156 -5.207
56 HZ3 LYS 15 2HZ LYS 15 -8.932 5.393 -6.492
57 H THR 16 H THR 16 -15.555 5.000 -1.329
58 HA THR 16 HA THR 16 -15.197 4.469 1.437
59 HB THR 16 HB THR 16 -17.519 3.195 0.409
60 HG1 THR 16 HG1 THR 16 -18.324 4.626 -0.990
61 HG21 THR 16 3HG2 THR 16 -18.684 4.960 1.681
62 HG22 THR 16 1HG2 THR 16 -17.157 5.819 1.859
63 HG23 THR 16 2HG2 THR 16 -17.370 4.238 2.608
64 H VAL 17 H VAL 17 -15.142 2.549 2.507
65 HA VAL 17 HA VAL 17 -14.737 0.143 0.868
66 HB VAL 17 HB VAL 17 -13.458 1.042 3.416
67 HG11 VAL 17 1HG1 VAL 17 -13.609 -1.854 2.561
68 HG12 VAL 17 2HG1 VAL 17 -14.463 -1.165 3.942
69 HG13 VAL 17 3HG1 VAL 17 -12.700 -1.206 3.928
70 HG21 VAL 17 3HG2 VAL 17 -12.287 1.385 1.349
71 HG22 VAL 17 1HG2 VAL 17 -12.485 -0.317 0.920
72 HG23 VAL 17 2HG2 VAL 17 -11.466 0.137 2.289
73 H TYR 18 H TYR 18 -16.049 -1.486 1.108
74 HA TYR 18 HA TYR 18 -17.951 -1.504 3.358
75 HD1 TYR 18 HD1 TYR 18 -20.277 -0.080 2.433
76 HD2 TYR 18 HD2 TYR 18 -17.959 -1.067 -0.990
77 HE1 TYR 18 HE1 TYR 18 -20.868 2.080 1.423
78 HE2 TYR 18 HE2 TYR 18 -18.531 1.097 -2.009
79 HH TYR 18 HH TYR 18 -19.890 3.638 -0.276
80 HB2 TYR 18 2HB TYR 18 -18.426 -2.725 0.628
81 HB3 TYR 18 1HB TYR 18 -19.607 -2.441 1.901
82 H HIS 19 H HIS 19 -18.774 -3.922 3.668
83 HA HIS 19 HA HIS 19 -16.432 -5.372 4.366
84 HD1 HIS 19 HD1 HIS 19 -18.850 -8.763 3.759
85 HD2 HIS 19 HD2 HIS 19 -21.141 -5.327 4.232
86 HE1 HIS 19 HE1 HIS 19 -21.130 -9.347 2.881
87 HE2 HIS 19 HE2 HIS 19 -22.442 -7.196 2.997
88 HB2 HIS 19 2HB HIS 19 -17.822 -6.991 5.357
89 HB3 HIS 19 1HB HIS 19 -18.686 -5.475 5.553
90 H ALA 20 H ALA 20 -18.195 -5.176 1.509
91 HA ALA 20 HA ALA 20 -17.747 -7.689 0.327
92 HB1 ALA 20 3HB ALA 20 -19.296 -5.970 -0.547
93 HB2 ALA 20 1HB ALA 20 -18.173 -6.555 -1.776
94 HB3 ALA 20 2HB ALA 20 -17.902 -4.987 -1.011
95 H GLU 21 H GLU 21 -15.761 -4.812 0.588
96 HA GLU 21 HA GLU 21 -13.643 -6.111 -0.989
97 HB2 GLU 21 2HB GLU 21 -14.981 -4.469 -2.328
98 HB3 GLU 21 1HB GLU 21 -14.536 -3.220 -1.181
99 HG2 GLU 21 2HG GLU 21 -13.186 -2.982 -3.114
100 HG3 GLU 21 1HG GLU 21 -12.162 -3.563 -1.806
101 H GLU 22 H GLU 22 -13.789 -6.103 1.804
102 HA GLU 22 HA GLU 22 -12.001 -3.920 2.626
103 HB2 GLU 22 2HB GLU 22 -14.153 -3.934 3.784
104 HB3 GLU 22 1HB GLU 22 -13.875 -5.591 4.305
105 HG2 GLU 22 2HG GLU 22 -11.890 -4.820 5.555
106 HG3 GLU 22 1HG GLU 22 -12.289 -3.161 5.111
107 H ILE 23 H ILE 23 -9.991 -4.403 3.062
108 HA ILE 23 HA ILE 23 -9.457 -6.893 4.547
109 HB ILE 23 HB ILE 23 -7.818 -5.645 2.351
110 HG12 ILE 23 2HG1 ILE 23 -8.239 -8.546 3.058
111 HG13 ILE 23 1HG1 ILE 23 -9.353 -7.655 2.020
112 HG21 ILE 23 1HG2 ILE 23 -6.746 -7.375 4.575
113 HG22 ILE 23 2HG2 ILE 23 -6.337 -5.686 4.270
114 HG23 ILE 23 3HG2 ILE 23 -5.868 -6.930 3.111
115 HD11 ILE 23 3HD1 ILE 23 -6.431 -8.163 1.499
116 HD12 ILE 23 1HD1 ILE 23 -7.509 -7.240 0.457
117 HD13 ILE 23 2HD1 ILE 23 -7.792 -8.962 0.711
118 H GLN 24 H GLN 24 -8.489 -6.583 6.481
119 HA GLN 24 HA GLN 24 -7.635 -3.828 7.086
120 HB2 GLN 24 2HB GLN 24 -9.059 -5.821 8.849
121 HB3 GLN 24 1HB GLN 24 -8.312 -4.350 9.461
122 HG2 GLN 24 2HG GLN 24 -9.766 -3.016 8.033
123 HG3 GLN 24 1HG GLN 24 -10.515 -4.486 7.415
124 HE21 GLN 24 1HE2 GLN 24 -10.498 -5.821 9.997
125 HE22 GLN 24 2HE2 GLN 24 -11.744 -5.069 10.929
126 H CYS 25 H CYS 25 -5.503 -3.874 7.004
127 HA CYS 25 HA CYS 25 -4.065 -6.150 8.141
128 HG CYS 25 HG CYS 25 -1.488 -6.522 7.881
129 HB2 CYS 25 2HB CYS 25 -3.456 -5.328 5.859
130 HB3 CYS 25 1HB CYS 25 -2.977 -3.797 6.577
131 H ASN 26 H ASN 26 -3.306 -6.041 10.107
132 HA ASN 26 HA ASN 26 -2.570 -5.319 12.115
133 HB2 ASN 26 2HB ASN 26 -0.879 -4.029 10.904
134 HB3 ASN 26 1HB ASN 26 -2.021 -2.709 10.685
135 HD21 ASN 26 1HD2 ASN 26 -0.664 -1.267 11.715
136 HD22 ASN 26 2HD2 ASN 26 -0.422 -1.277 13.428
137 H GLY 27 H GLY 27 -4.093 -2.365 10.812
138 HA2 GLY 27 2HA GLY 27 -6.465 -2.720 12.371
139 HA3 GLY 27 1HA GLY 27 -5.378 -1.554 13.113
140 H ARG 28 H ARG 28 -5.489 -1.923 9.663
141 HA ARG 28 HA ARG 28 -7.005 0.586 9.433
142 HE ARG 28 HE ARG 28 -5.186 4.292 6.717
143 HB2 ARG 28 2HB ARG 28 -4.477 0.889 9.328
144 HB3 ARG 28 1HB ARG 28 -4.516 -0.038 7.838
145 HG2 ARG 28 2HG ARG 28 -5.884 1.640 6.777
146 HG3 ARG 28 1HG ARG 28 -5.988 2.549 8.291
147 HD2 ARG 28 2HD ARG 28 -3.556 2.853 8.265
148 HD3 ARG 28 1HD ARG 28 -3.461 1.959 6.748
149 HH11 ARG 28 1HH1 ARG 28 -1.947 3.057 6.167
150 HH12 ARG 28 2HH1 ARG 28 -1.516 4.327 5.051
151 HH21 ARG 28 1HH2 ARG 28 -4.598 5.976 5.287
152 HH22 ARG 28 2HH2 ARG 28 -3.023 5.974 4.559
153 H SER 29 H SER 29 -8.406 0.660 7.714
154 HA SER 29 HA SER 29 -8.855 -1.894 6.370
155 HG SER 29 HG SER 29 -11.095 -1.660 7.965
156 HB2 SER 29 2HB SER 29 -10.596 0.581 6.345
157 HB3 SER 29 1HB SER 29 -11.063 -1.055 5.882
158 H PHE 30 H PHE 30 -8.532 -2.239 4.273
159 HA PHE 30 HA PHE 30 -8.320 0.055 2.439
160 HD1 PHE 30 HD2 PHE 30 -5.658 1.096 2.096
161 HD2 PHE 30 HD1 PHE 30 -5.450 -2.518 4.332
162 HE1 PHE 30 HE2 PHE 30 -3.943 2.101 3.547
163 HE2 PHE 30 HE1 PHE 30 -3.739 -1.520 5.793
164 HZ PHE 30 HZ PHE 30 -2.931 0.750 5.368
165 HB2 PHE 30 2HB PHE 30 -6.624 -2.455 2.289
166 HB3 PHE 30 1HB PHE 30 -6.534 -1.063 1.217
167 H HIS 31 H HIS 31 -8.653 -0.738 0.112
168 HA HIS 31 HA HIS 31 -10.829 -2.608 -0.057
169 HD2 HIS 31 HD2 HIS 31 -12.853 -1.449 -0.852
170 HE1 HIS 31 HE1 HIS 31 -12.074 2.415 -2.377
171 HE2 HIS 31 HE2 HIS 31 -13.730 0.981 -1.123
172 HB2 HIS 31 2HB HIS 31 -9.147 -1.250 -2.182
173 HB3 HIS 31 1HB HIS 31 -10.393 -2.425 -2.576
174 H LYS 32 H LYS 32 -10.730 -4.690 -1.158
175 HA LYS 32 HA LYS 32 -8.432 -6.216 -0.535
176 HB2 LYS 32 2HB LYS 32 -10.662 -7.234 -0.763
177 HB3 LYS 32 1HB LYS 32 -10.659 -6.861 -2.483
178 HG2 LYS 32 2HG LYS 32 -8.789 -8.356 -2.837
179 HG3 LYS 32 1HG LYS 32 -8.695 -8.683 -1.106
180 HD2 LYS 32 2HD LYS 32 -10.917 -9.679 -1.160
181 HD3 LYS 32 1HD LYS 32 -11.050 -9.313 -2.880
182 HE2 LYS 32 2HE LYS 32 -10.447 -11.646 -2.522
183 HE3 LYS 32 1HE LYS 32 -9.159 -10.777 -3.350
184 HZ1 LYS 32 3HZ LYS 32 -7.904 -10.669 -1.341
185 HZ2 LYS 32 1HZ LYS 32 -8.391 -12.276 -1.557
186 HZ3 LYS 32 2HZ LYS 32 -9.189 -11.299 -0.425
187 H THR 33 H THR 33 -9.465 -4.455 -3.335
188 HA THR 33 HA THR 33 -7.351 -5.367 -5.054
189 HB THR 33 HB THR 33 -9.023 -2.870 -5.392
190 HG1 THR 33 HG1 THR 33 -10.367 -4.734 -5.011
191 HG21 THR 33 3HG2 THR 33 -8.677 -3.271 -7.774
192 HG22 THR 33 1HG2 THR 33 -7.763 -4.734 -7.413
193 HG23 THR 33 2HG2 THR 33 -7.122 -3.160 -6.948
194 H CYS 34 H CYS 34 -7.459 -3.322 -2.416
195 HA CYS 34 HA CYS 34 -5.122 -1.793 -3.340
196 HB2 CYS 34 2HB CYS 34 -7.099 -1.088 -1.152
197 HB3 CYS 34 1HB CYS 34 -5.724 -0.107 -1.652
198 H PHE 35 H PHE 35 -5.353 -4.535 -2.141
199 HA PHE 35 HA PHE 35 -4.015 -4.200 0.414
200 HD1 PHE 35 HD2 PHE 35 -4.313 -5.492 2.411
201 HD2 PHE 35 HD1 PHE 35 -3.489 -8.536 -0.444
202 HE1 PHE 35 HE2 PHE 35 -3.140 -6.784 4.139
203 HE2 PHE 35 HE1 PHE 35 -2.309 -9.835 1.280
204 HZ PHE 35 HZ PHE 35 -2.139 -8.955 3.575
205 HB2 PHE 35 2HB PHE 35 -5.721 -5.962 0.182
206 HB3 PHE 35 1HB PHE 35 -4.754 -6.725 -1.076
207 H HIS 36 H HIS 36 -3.203 -4.561 -2.847
208 HA HIS 36 HA HIS 36 -0.655 -5.784 -2.236
209 HD1 HIS 36 HD1 HIS 36 -3.883 -5.666 -5.157
210 HD2 HIS 36 HD2 HIS 36 -0.547 -3.402 -6.161
211 HE1 HIS 36 HE1 HIS 36 -4.615 -4.174 -7.040
212 HE2 HIS 36 HE2 HIS 36 -2.510 -3.032 -7.810
213 HB2 HIS 36 2HB HIS 36 -0.211 -5.747 -4.659
214 HB3 HIS 36 1HB HIS 36 -1.688 -6.593 -4.245
215 H CYS 37 H CYS 37 1.302 -4.693 -3.463
216 HA CYS 37 HA CYS 37 2.063 -2.938 -1.537
217 HB2 CYS 37 2HB CYS 37 3.536 -4.213 -3.111
218 HB3 CYS 37 1HB CYS 37 3.256 -2.947 -4.300
219 H MET 38 H MET 38 1.981 -0.895 -1.085
220 HA MET 38 HA MET 38 0.289 0.879 -2.541
221 HB2 MET 38 2HB MET 38 2.145 1.492 -0.237
222 HB3 MET 38 1HB MET 38 0.798 2.476 -0.785
223 HG2 MET 38 2HG MET 38 0.583 -0.285 0.383
224 HG3 MET 38 1HG MET 38 0.270 1.222 1.239
225 HE1 MET 38 3HE MET 38 -2.118 0.144 1.936
226 HE2 MET 38 1HE MET 38 -1.711 -1.291 1.000
227 HE3 MET 38 2HE MET 38 -3.262 -0.488 0.751
228 H ALA 39 H ALA 39 3.504 0.031 -2.938
229 HA ALA 39 HA ALA 39 4.213 2.684 -3.989
230 HB1 ALA 39 3HB ALA 39 5.671 1.836 -2.209
231 HB2 ALA 39 1HB ALA 39 6.534 2.049 -3.732
232 HB3 ALA 39 2HB ALA 39 6.058 0.434 -3.207
233 H CYS 40 H CYS 40 5.017 -0.731 -4.743
234 HA CYS 40 HA CYS 40 5.334 0.099 -7.532
235 HB2 CYS 40 2HB CYS 40 6.588 -1.941 -7.854
236 HB3 CYS 40 1HB CYS 40 7.203 -1.104 -6.433
237 H ARG 41 H ARG 41 3.082 -1.336 -5.548
238 HA ARG 41 HA ARG 41 1.071 -2.277 -5.892
239 HE ARG 41 HE ARG 41 -0.908 1.419 -6.111
240 HB2 ARG 41 2HB ARG 41 1.701 -1.555 -8.739
241 HB3 ARG 41 1HB ARG 41 0.225 -2.407 -8.311
242 HG2 ARG 41 2HG ARG 41 1.040 0.233 -7.126
243 HG3 ARG 41 1HG ARG 41 -0.032 0.058 -8.515
244 HD2 ARG 41 2HD ARG 41 -1.597 -1.227 -7.172
245 HD3 ARG 41 1HD ARG 41 -0.517 -1.127 -5.785
246 HH11 ARG 41 1HH1 ARG 41 -3.301 -1.098 -6.634
247 HH12 ARG 41 2HH1 ARG 41 -4.635 -0.107 -6.150
248 HH21 ARG 41 1HH2 ARG 41 -2.662 2.718 -5.465
249 HH22 ARG 41 2HH2 ARG 41 -4.271 2.072 -5.485
250 H LYS 42 H LYS 42 3.713 -3.799 -6.101
251 HA LYS 42 HA LYS 42 3.252 -6.212 -7.463
252 HB2 LYS 42 2HB LYS 42 5.405 -5.658 -6.428
253 HB3 LYS 42 1HB LYS 42 4.667 -5.687 -4.835
254 HG2 LYS 42 2HG LYS 42 4.223 -8.101 -5.120
255 HG3 LYS 42 1HG LYS 42 5.064 -8.041 -6.672
256 HD2 LYS 42 2HD LYS 42 7.106 -7.323 -5.563
257 HD3 LYS 42 1HD LYS 42 6.272 -7.285 -4.011
258 HE2 LYS 42 2HE LYS 42 7.602 -9.302 -4.204
259 HE3 LYS 42 1HE LYS 42 5.885 -9.702 -4.174
260 HZ1 LYS 42 3HZ LYS 42 7.264 -10.905 -5.865
261 HZ2 LYS 42 1HZ LYS 42 7.427 -9.434 -6.688
262 HZ3 LYS 42 2HZ LYS 42 5.890 -10.121 -6.476
263 H ALA 43 H ALA 43 2.168 -8.117 -6.858
264 HA ALA 43 HA ALA 43 -0.114 -7.702 -5.171
265 HB1 ALA 43 3HB ALA 43 0.809 -10.226 -6.538
266 HB2 ALA 43 1HB ALA 43 -0.263 -9.014 -7.235
267 HB3 ALA 43 2HB ALA 43 -0.781 -9.944 -5.831
268 H LEU 44 H LEU 44 -0.009 -7.811 -3.035
269 HA LEU 44 HA LEU 44 1.918 -9.591 -1.758
270 HG LEU 44 HG LEU 44 2.426 -6.671 0.368
271 HB2 LEU 44 2HB LEU 44 0.297 -7.263 -0.810
272 HB3 LEU 44 1HB LEU 44 0.878 -8.436 0.353
273 HD11 LEU 44 1HD1 LEU 44 4.489 -7.713 -0.425
274 HD12 LEU 44 2HD1 LEU 44 3.549 -8.861 -1.378
275 HD13 LEU 44 3HD1 LEU 44 3.444 -8.879 0.384
276 HD21 LEU 44 3HD2 LEU 44 1.794 -5.569 -1.679
277 HD22 LEU 44 1HD2 LEU 44 2.503 -6.868 -2.638
278 HD23 LEU 44 2HD2 LEU 44 3.536 -5.835 -1.648
279 H ASP 45 H ASP 45 1.379 -11.342 -0.618
280 HA ASP 45 HA ASP 45 -1.467 -11.758 0.020
281 HB2 ASP 45 2HB ASP 45 -1.206 -14.105 -0.126
282 HB3 ASP 45 1HB ASP 45 -0.353 -13.485 -1.535
283 H SER 46 H SER 46 -1.420 -13.459 2.059
284 HA SER 46 HA SER 46 -0.677 -11.859 4.212
285 HG SER 46 HG SER 46 -0.965 -15.721 4.229
286 HB2 SER 46 2HB SER 46 -1.043 -14.056 5.526
287 HB3 SER 46 1HB SER 46 -2.396 -13.392 4.611
288 H THR 47 H THR 47 1.118 -14.345 2.536
289 HA THR 47 HA THR 47 3.037 -14.719 4.652
290 HB THR 47 HB THR 47 3.549 -15.582 1.831
291 HG1 THR 47 HG1 THR 47 1.426 -16.191 2.024
292 HG21 THR 47 3HG2 THR 47 5.186 -16.109 3.568
293 HG22 THR 47 1HG2 THR 47 4.426 -17.578 2.963
294 HG23 THR 47 2HG2 THR 47 3.935 -16.910 4.520
295 H THR 48 H THR 48 2.769 -12.647 1.854
296 HA THR 48 HA THR 48 5.667 -12.229 1.829
297 HB THR 48 HB THR 48 5.111 -11.001 -0.366
298 HG1 THR 48 HG1 THR 48 2.858 -12.667 -0.501
299 HG21 THR 48 3HG2 THR 48 4.714 -13.984 -0.089
300 HG22 THR 48 1HG2 THR 48 6.253 -13.145 -0.292
301 HG23 THR 48 2HG2 THR 48 5.067 -13.142 -1.598
302 H VAL 49 H VAL 49 2.717 -10.534 2.594
303 HA VAL 49 HA VAL 49 3.614 -7.924 2.036
304 HB VAL 49 HB VAL 49 1.306 -8.066 2.274
305 HG11 VAL 49 1HG1 VAL 49 0.157 -8.951 4.256
306 HG12 VAL 49 2HG1 VAL 49 1.715 -9.321 4.994
307 HG13 VAL 49 3HG1 VAL 49 1.208 -10.169 3.533
308 HG21 VAL 49 3HG2 VAL 49 2.325 -6.844 4.834
309 HG22 VAL 49 1HG2 VAL 49 0.723 -6.587 4.142
310 HG23 VAL 49 2HG2 VAL 49 2.155 -6.036 3.275
311 H ALA 50 H ALA 50 4.918 -6.592 3.001
312 HA ALA 50 HA ALA 50 5.794 -7.150 5.751
313 HB1 ALA 50 3HB ALA 50 7.588 -6.952 4.075
314 HB2 ALA 50 1HB ALA 50 7.674 -5.660 5.273
315 HB3 ALA 50 2HB ALA 50 7.020 -5.331 3.667
316 H ALA 51 H ALA 51 4.527 -6.119 7.156
317 HA ALA 51 HA ALA 51 3.432 -3.506 6.414
318 HB1 ALA 51 3HB ALA 51 1.768 -3.893 8.165
319 HB2 ALA 51 1HB ALA 51 2.541 -5.430 8.560
320 HB3 ALA 51 2HB ALA 51 1.779 -5.203 6.986
321 H HIS 52 H HIS 52 3.610 -1.756 7.762
322 HA HIS 52 HA HIS 52 5.120 -2.086 10.245
323 HD1 HIS 52 HD1 HIS 52 8.234 -1.285 10.605
324 HD2 HIS 52 HD2 HIS 52 5.789 2.054 10.231
325 HE1 HIS 52 HE1 HIS 52 9.081 0.364 12.296
326 HE2 HIS 52 HE2 HIS 52 7.467 2.291 12.179
327 HB2 HIS 52 2HB HIS 52 6.746 -1.341 8.522
328 HB3 HIS 52 1HB HIS 52 5.736 0.066 8.202
329 H GLU 53 H GLU 53 3.226 -1.846 11.325
330 HA GLU 53 HA GLU 53 1.579 -0.794 12.442
331 HB2 GLU 53 2HB GLU 53 3.532 0.564 13.138
332 HB3 GLU 53 1HB GLU 53 3.173 1.698 11.842
333 HG2 GLU 53 2HG GLU 53 1.044 2.233 12.864
334 HG3 GLU 53 1HG GLU 53 1.329 1.039 14.131
335 H SER 54 H SER 54 2.127 2.025 10.369
336 HA SER 54 HA SER 54 -0.746 2.133 10.025
337 HG SER 54 HG SER 54 2.406 3.943 9.916
338 HB2 SER 54 2HB SER 54 -0.259 4.399 9.065
339 HB3 SER 54 1HB SER 54 0.348 4.166 10.704
340 H GLU 55 H GLU 55 1.850 0.936 8.198
341 HA GLU 55 HA GLU 55 0.243 1.072 5.758
342 HB2 GLU 55 2HB GLU 55 3.072 2.073 5.979
343 HB3 GLU 55 1HB GLU 55 2.328 1.656 4.441
344 HG2 GLU 55 2HG GLU 55 0.529 3.305 4.946
345 HG3 GLU 55 1HG GLU 55 1.450 3.796 6.366
346 H ILE 56 H ILE 56 1.188 -0.217 3.971
347 HA ILE 56 HA ILE 56 2.635 -2.602 4.856
348 HB ILE 56 HB ILE 56 0.783 -3.859 4.886
349 HG12 ILE 56 2HG1 ILE 56 0.512 -3.087 1.974
350 HG13 ILE 56 1HG1 ILE 56 1.417 -4.454 2.617
351 HG21 ILE 56 1HG2 ILE 56 -0.730 -1.552 3.674
352 HG22 ILE 56 2HG2 ILE 56 -0.542 -1.897 5.394
353 HG23 ILE 56 3HG2 ILE 56 -1.455 -3.004 4.368
354 HD11 ILE 56 3HD1 ILE 56 -1.564 -4.087 2.759
355 HD12 ILE 56 1HD1 ILE 56 -0.659 -5.458 3.400
356 HD13 ILE 56 2HD1 ILE 56 -0.694 -5.160 1.662
357 H TYR 57 H TYR 57 3.955 -3.450 3.295
358 HA TYR 57 HA TYR 57 3.607 -2.605 0.522
359 HD1 TYR 57 HD2 TYR 57 4.535 0.035 -0.262
360 HD2 TYR 57 HD1 TYR 57 5.947 -0.794 3.662
361 HE1 TYR 57 HE2 TYR 57 4.071 2.356 0.383
362 HE2 TYR 57 HE1 TYR 57 5.479 1.529 4.328
363 HH TYR 57 HH TYR 57 5.286 3.845 2.986
364 HB2 TYR 57 2HB TYR 57 6.287 -2.361 1.908
365 HB3 TYR 57 1HB TYR 57 5.926 -1.956 0.239
366 H CYS 58 H CYS 58 5.289 -3.731 -0.888
367 HA CYS 58 HA CYS 58 5.497 -6.505 -0.229
368 HB2 CYS 58 2HB CYS 58 6.598 -6.761 -2.325
369 HB3 CYS 58 1HB CYS 58 5.376 -5.518 -2.581
370 H LYS 59 H LYS 59 7.988 -7.349 -0.719
371 HA LYS 59 HA LYS 59 9.431 -6.284 1.559
372 HB2 LYS 59 2HB LYS 59 10.048 -8.663 -0.195
373 HB3 LYS 59 1HB LYS 59 10.906 -8.233 1.281
374 HG2 LYS 59 2HG LYS 59 8.726 -8.466 2.501
375 HG3 LYS 59 1HG LYS 59 8.046 -9.119 1.010
376 HD2 LYS 59 2HD LYS 59 9.739 -10.900 1.038
377 HD3 LYS 59 1HD LYS 59 10.372 -10.259 2.556
378 HE2 LYS 59 2HE LYS 59 7.612 -11.375 2.079
379 HE3 LYS 59 1HE LYS 59 8.910 -12.138 2.992
380 HZ1 LYS 59 3HZ LYS 59 7.421 -11.144 4.533
381 HZ2 LYS 59 1HZ LYS 59 7.428 -9.667 3.700
382 HZ3 LYS 59 2HZ LYS 59 8.821 -10.184 4.519
383 H VAL 60 H VAL 60 9.365 -5.768 -1.752
384 HA VAL 60 HA VAL 60 12.187 -5.272 -2.112
385 HB VAL 60 HB VAL 60 9.885 -4.468 -3.907
386 HG11 VAL 60 1HG1 VAL 60 11.597 -4.335 -5.657
387 HG12 VAL 60 2HG1 VAL 60 12.839 -4.723 -4.465
388 HG13 VAL 60 3HG1 VAL 60 11.933 -3.215 -4.336
389 HG21 VAL 60 3HG2 VAL 60 11.626 -6.935 -3.989
390 HG22 VAL 60 1HG2 VAL 60 10.444 -6.474 -5.213
391 HG23 VAL 60 2HG2 VAL 60 9.910 -6.880 -3.582
392 H CYS 61 H CYS 61 9.245 -3.262 -2.022
393 HA CYS 61 HA CYS 61 10.673 -0.808 -2.006
394 HB2 CYS 61 2HB CYS 61 7.835 -1.368 -1.140
395 HB3 CYS 61 1HB CYS 61 8.514 0.221 -1.487
396 H TYR 62 H TYR 62 9.468 -2.933 0.510
397 HA TYR 62 HA TYR 62 9.936 -1.310 2.737
398 HD1 TYR 62 HD1 TYR 62 12.048 -4.463 4.193
399 HD2 TYR 62 HD2 TYR 62 8.332 -2.575 5.035
400 HE1 TYR 62 HE1 TYR 62 12.538 -4.586 6.601
401 HE2 TYR 62 HE2 TYR 62 8.814 -2.687 7.443
402 HH TYR 62 HH TYR 62 10.190 -4.063 8.981
403 HB2 TYR 62 2HB TYR 62 8.780 -3.494 2.840
404 HB3 TYR 62 1HB TYR 62 10.302 -4.308 2.490
405 H GLY 63 H GLY 63 12.092 -3.528 1.003
406 HA2 GLY 63 2HA GLY 63 14.375 -3.057 2.594
407 HA3 GLY 63 1HA GLY 63 14.375 -3.720 0.968
408 H ARG 64 H ARG 64 12.966 -1.232 -0.014
409 HA ARG 64 HA ARG 64 15.305 0.290 -0.610
410 HE ARG 64 HE ARG 64 14.261 1.906 -3.991
411 HB2 ARG 64 2HB ARG 64 12.396 0.964 -1.071
412 HB3 ARG 64 1HB ARG 64 13.757 1.841 -1.750
413 HG2 ARG 64 2HG ARG 64 14.432 -0.256 -2.915
414 HG3 ARG 64 1HG ARG 64 12.930 -0.990 -2.342
415 HD2 ARG 64 2HD ARG 64 12.585 -0.185 -4.580
416 HD3 ARG 64 1HD ARG 64 11.673 0.835 -3.468
417 HH11 ARG 64 1HH1 ARG 64 10.988 1.695 -5.230
418 HH12 ARG 64 2HH1 ARG 64 11.186 3.044 -6.314
419 HH21 ARG 64 1HH2 ARG 64 14.516 3.681 -5.378
420 HH22 ARG 64 2HH2 ARG 64 13.189 4.194 -6.382
421 H ARG 65 H ARG 65 12.455 0.847 1.419
422 HA ARG 65 HA ARG 65 13.116 3.489 2.163
423 HE ARG 65 HE ARG 65 9.232 4.550 3.578
424 HB2 ARG 65 2HB ARG 65 11.408 1.471 3.630
425 HB3 ARG 65 1HB ARG 65 11.453 3.194 3.964
426 HG2 ARG 65 2HG ARG 65 10.576 3.652 1.732
427 HG3 ARG 65 1HG ARG 65 10.525 1.918 1.401
428 HD2 ARG 65 2HD ARG 65 8.325 2.676 2.039
429 HD3 ARG 65 1HD ARG 65 8.973 1.637 3.307
430 HH11 ARG 65 1HH1 ARG 65 7.829 1.534 4.696
431 HH12 ARG 65 2HH1 ARG 65 7.188 2.232 6.146
432 HH21 ARG 65 1HH2 ARG 65 8.377 5.456 5.495
433 HH22 ARG 65 2HH2 ARG 65 7.468 4.448 6.588
434 H TYR 66 H TYR 66 13.695 0.371 3.756
435 HA TYR 66 HA TYR 66 14.972 1.764 5.979
436 HD1 TYR 66 HD2 TYR 66 11.855 -0.559 5.136
437 HD2 TYR 66 HD1 TYR 66 13.805 0.923 8.616
438 HE1 TYR 66 HE2 TYR 66 9.674 0.054 6.092
439 HE2 TYR 66 HE1 TYR 66 11.629 1.534 9.582
440 HH TYR 66 HH TYR 66 8.682 0.422 8.328
441 HB2 TYR 66 2HB TYR 66 14.185 -1.127 5.609
442 HB3 TYR 66 1HB TYR 66 14.992 -0.500 7.046
Start of MODEL 12
1 H1 GLY 7 1H GLY 7 -18.952 4.088 6.434
2 HA2 GLY 7 2HA GLY 7 -18.111 1.315 6.896
3 HA3 GLY 7 1HA GLY 7 -17.948 1.983 5.279
4 H ALA 8 H ALA 8 -15.662 1.321 5.832
5 HA ALA 8 HA ALA 8 -14.260 3.287 7.493
6 HB1 ALA 8 3HB ALA 8 -13.687 0.966 7.890
7 HB2 ALA 8 1HB ALA 8 -12.307 1.802 7.179
8 HB3 ALA 8 2HB ALA 8 -13.303 0.742 6.184
9 H LYS 9 H LYS 9 -11.869 3.639 6.358
10 HA LYS 9 HA LYS 9 -12.474 4.584 3.646
11 HB2 LYS 9 2HB LYS 9 -11.071 6.544 4.013
12 HB3 LYS 9 1HB LYS 9 -12.385 6.505 5.177
13 HG2 LYS 9 2HG LYS 9 -10.914 5.819 6.925
14 HG3 LYS 9 1HG LYS 9 -9.590 5.577 5.783
15 HD2 LYS 9 2HD LYS 9 -10.920 8.220 6.375
16 HD3 LYS 9 1HD LYS 9 -9.375 7.691 7.039
17 HE2 LYS 9 2HE LYS 9 -8.411 7.613 4.817
18 HE3 LYS 9 1HE LYS 9 -9.966 8.028 4.098
19 HZ1 LYS 9 3HZ LYS 9 -9.877 10.172 5.159
20 HZ2 LYS 9 1HZ LYS 9 -8.461 9.941 4.259
21 HZ3 LYS 9 2HZ LYS 9 -8.427 9.778 5.946
22 H CYS 10 H CYS 10 -11.099 4.017 2.131
23 HA CYS 10 HA CYS 10 -9.264 1.953 2.556
24 HB2 CYS 10 2HB CYS 10 -10.429 2.517 0.422
25 HB3 CYS 10 1HB CYS 10 -9.346 3.887 0.242
26 H GLY 11 H GLY 11 -7.203 1.900 3.081
27 HA2 GLY 11 2HA GLY 11 -5.670 4.137 3.817
28 HA3 GLY 11 1HA GLY 11 -5.030 2.535 3.482
29 H ALA 12 H ALA 12 -6.251 2.710 0.704
30 HA ALA 12 HA ALA 12 -4.035 4.223 -0.495
31 HB1 ALA 12 3HB ALA 12 -4.476 2.952 -2.521
32 HB2 ALA 12 1HB ALA 12 -5.891 2.213 -1.772
33 HB3 ALA 12 2HB ALA 12 -4.279 1.863 -1.149
34 H CYS 13 H CYS 13 -7.506 3.655 -1.050
35 HA CYS 13 HA CYS 13 -7.813 6.008 -2.674
36 HB2 CYS 13 2HB CYS 13 -9.939 4.343 -1.300
37 HB3 CYS 13 1HB CYS 13 -10.204 5.491 -2.601
38 H GLU 14 H GLU 14 -9.500 7.695 -2.008
39 HA GLU 14 HA GLU 14 -9.706 7.950 0.922
40 HB2 GLU 14 2HB GLU 14 -10.175 9.991 -1.262
41 HB3 GLU 14 1HB GLU 14 -10.599 10.258 0.424
42 HG2 GLU 14 2HG GLU 14 -8.231 9.907 1.033
43 HG3 GLU 14 1HG GLU 14 -7.844 9.777 -0.682
44 H LYS 15 H LYS 15 -10.971 6.366 -1.343
45 HA LYS 15 HA LYS 15 -13.786 6.918 -1.128
46 HB2 LYS 15 2HB LYS 15 -12.326 4.540 -2.308
47 HB3 LYS 15 1HB LYS 15 -14.023 4.934 -2.547
48 HG2 LYS 15 2HG LYS 15 -13.516 6.804 -3.875
49 HG3 LYS 15 1HG LYS 15 -11.830 6.811 -3.360
50 HD2 LYS 15 2HD LYS 15 -12.014 5.963 -5.625
51 HD3 LYS 15 1HD LYS 15 -11.473 4.685 -4.535
52 HE2 LYS 15 2HE LYS 15 -13.735 3.786 -4.454
53 HE3 LYS 15 1HE LYS 15 -14.303 5.079 -5.508
54 HZ1 LYS 15 3HZ LYS 15 -12.375 2.925 -6.202
55 HZ2 LYS 15 1HZ LYS 15 -12.742 4.239 -7.215
56 HZ3 LYS 15 2HZ LYS 15 -13.948 3.120 -6.802
57 H THR 16 H THR 16 -15.235 5.105 -0.447
58 HA THR 16 HA THR 16 -14.474 4.364 2.219
59 HB THR 16 HB THR 16 -16.927 3.217 1.755
60 HG1 THR 16 HG1 THR 16 -17.881 4.202 0.135
61 HG21 THR 16 3HG2 THR 16 -16.330 4.664 3.640
62 HG22 THR 16 1HG2 THR 16 -17.841 5.190 2.897
63 HG23 THR 16 2HG2 THR 16 -16.345 6.068 2.573
64 H VAL 17 H VAL 17 -13.936 2.433 2.968
65 HA VAL 17 HA VAL 17 -13.849 0.150 1.148
66 HB VAL 17 HB VAL 17 -12.622 0.674 3.849
67 HG11 VAL 17 1HG1 VAL 17 -12.722 -1.974 2.407
68 HG12 VAL 17 2HG1 VAL 17 -13.499 -1.602 3.946
69 HG13 VAL 17 3HG1 VAL 17 -11.739 -1.618 3.827
70 HG21 VAL 17 3HG2 VAL 17 -10.556 0.137 2.658
71 HG22 VAL 17 1HG2 VAL 17 -11.422 1.473 1.899
72 HG23 VAL 17 2HG2 VAL 17 -11.490 -0.141 1.186
73 H TYR 18 H TYR 18 -15.271 -1.461 1.237
74 HA TYR 18 HA TYR 18 -17.164 -1.458 3.501
75 HD1 TYR 18 HD2 TYR 18 -19.066 0.140 2.937
76 HD2 TYR 18 HD1 TYR 18 -17.624 -0.874 -0.933
77 HE1 TYR 18 HE2 TYR 18 -19.648 2.391 2.136
78 HE2 TYR 18 HE1 TYR 18 -18.200 1.372 -1.744
79 HH TYR 18 HH TYR 18 -19.791 3.186 -1.132
80 HB2 TYR 18 2HB TYR 18 -17.642 -2.497 0.700
81 HB3 TYR 18 1HB TYR 18 -18.832 -2.349 1.987
82 H HIS 19 H HIS 19 -17.990 -3.638 4.078
83 HA HIS 19 HA HIS 19 -15.923 -5.527 4.342
84 HD1 HIS 19 HD1 HIS 19 -19.958 -4.371 5.917
85 HD2 HIS 19 HD2 HIS 19 -19.768 -7.523 3.211
86 HE1 HIS 19 HE1 HIS 19 -22.302 -4.673 5.062
87 HE2 HIS 19 HE2 HIS 19 -22.198 -6.735 3.617
88 HB2 HIS 19 2HB HIS 19 -17.660 -7.088 5.156
89 HB3 HIS 19 1HB HIS 19 -17.738 -5.515 5.931
90 H ALA 20 H ALA 20 -17.899 -4.797 1.725
91 HA ALA 20 HA ALA 20 -18.091 -7.076 0.206
92 HB1 ALA 20 3HB ALA 20 -18.927 -4.911 -0.515
93 HB2 ALA 20 1HB ALA 20 -17.862 -5.588 -1.747
94 HB3 ALA 20 2HB ALA 20 -17.277 -4.306 -0.682
95 H GLU 21 H GLU 21 -15.256 -4.928 0.519
96 HA GLU 21 HA GLU 21 -13.567 -7.194 -0.181
97 HB2 GLU 21 2HB GLU 21 -12.250 -5.930 -1.759
98 HB3 GLU 21 1HB GLU 21 -13.911 -6.011 -2.298
99 HG2 GLU 21 2HG GLU 21 -14.247 -3.698 -1.611
100 HG3 GLU 21 1HG GLU 21 -12.601 -3.644 -0.976
101 H GLU 22 H GLU 22 -13.993 -6.152 2.319
102 HA GLU 22 HA GLU 22 -11.861 -4.310 2.953
103 HB2 GLU 22 2HB GLU 22 -13.916 -4.103 4.210
104 HB3 GLU 22 1HB GLU 22 -13.828 -5.793 4.702
105 HG2 GLU 22 2HG GLU 22 -11.755 -5.298 5.932
106 HG3 GLU 22 1HG GLU 22 -11.926 -3.600 5.484
107 H ILE 23 H ILE 23 -9.844 -4.943 3.204
108 HA ILE 23 HA ILE 23 -9.367 -7.523 4.542
109 HB ILE 23 HB ILE 23 -7.550 -5.949 2.701
110 HG12 ILE 23 2HG1 ILE 23 -8.494 -8.803 2.467
111 HG13 ILE 23 1HG1 ILE 23 -9.368 -7.455 1.740
112 HG21 ILE 23 1HG2 ILE 23 -5.900 -7.730 3.068
113 HG22 ILE 23 2HG2 ILE 23 -6.949 -8.437 4.297
114 HG23 ILE 23 3HG2 ILE 23 -6.244 -6.839 4.550
115 HD11 ILE 23 3HD1 ILE 23 -7.940 -8.584 0.129
116 HD12 ILE 23 1HD1 ILE 23 -6.531 -8.260 1.139
117 HD13 ILE 23 2HD1 ILE 23 -7.408 -6.923 0.394
118 H GLN 24 H GLN 24 -8.802 -7.372 6.590
119 HA GLN 24 HA GLN 24 -7.882 -4.778 7.609
120 HB2 GLN 24 2HB GLN 24 -8.899 -7.195 9.114
121 HB3 GLN 24 1HB GLN 24 -8.489 -5.639 9.820
122 HG2 GLN 24 2HG GLN 24 -10.293 -4.589 8.539
123 HG3 GLN 24 1HG GLN 24 -10.710 -6.159 7.854
124 HE21 GLN 24 1HE2 GLN 24 -12.344 -4.381 9.448
125 HE22 GLN 24 2HE2 GLN 24 -12.800 -5.263 10.862
126 H CYS 25 H CYS 25 -5.724 -4.648 7.477
127 HA CYS 25 HA CYS 25 -4.178 -6.879 8.612
128 HG CYS 25 HG CYS 25 -4.304 -6.784 4.749
129 HB2 CYS 25 2HB CYS 25 -3.443 -4.997 6.377
130 HB3 CYS 25 1HB CYS 25 -2.263 -6.011 7.206
131 H ASN 26 H ASN 26 -3.112 -6.495 10.372
132 HA ASN 26 HA ASN 26 -1.990 -5.492 12.065
133 HB2 ASN 26 2HB ASN 26 -0.735 -4.359 10.192
134 HB3 ASN 26 1HB ASN 26 -1.833 -2.995 10.375
135 HD21 ASN 26 1HD2 ASN 26 -0.372 -1.527 11.055
136 HD22 ASN 26 2HD2 ASN 26 0.492 -1.633 12.554
137 H GLY 27 H GLY 27 -4.732 -3.946 10.672
138 HA2 GLY 27 2HA GLY 27 -6.371 -3.488 12.641
139 HA3 GLY 27 1HA GLY 27 -5.152 -2.285 13.045
140 H ARG 28 H ARG 28 -4.973 -2.380 9.832
141 HA ARG 28 HA ARG 28 -6.892 -0.172 9.522
142 HE ARG 28 HE ARG 28 -5.614 0.734 11.387
143 HB2 ARG 28 2HB ARG 28 -4.496 -0.897 7.824
144 HB3 ARG 28 1HB ARG 28 -5.521 0.512 7.608
145 HG2 ARG 28 2HG ARG 28 -3.918 0.010 10.100
146 HG3 ARG 28 1HG ARG 28 -3.303 0.914 8.717
147 HD2 ARG 28 2HD ARG 28 -4.103 2.620 10.028
148 HD3 ARG 28 1HD ARG 28 -5.513 2.287 9.026
149 HH11 ARG 28 1HH1 ARG 28 -6.013 4.025 10.245
150 HH12 ARG 28 2HH1 ARG 28 -7.071 4.483 11.552
151 HH21 ARG 28 1HH2 ARG 28 -6.954 1.325 13.112
152 HH22 ARG 28 2HH2 ARG 28 -7.579 2.947 13.217
153 H SER 29 H SER 29 -8.399 -0.199 7.878
154 HA SER 29 HA SER 29 -8.809 -2.748 6.520
155 HG SER 29 HG SER 29 -11.754 -2.388 7.760
156 HB2 SER 29 2HB SER 29 -10.583 -0.304 6.754
157 HB3 SER 29 1HB SER 29 -11.021 -1.777 5.892
158 H PHE 30 H PHE 30 -8.270 -3.051 4.469
159 HA PHE 30 HA PHE 30 -7.982 -0.699 2.707
160 HD1 PHE 30 HD1 PHE 30 -5.354 0.319 2.435
161 HD2 PHE 30 HD2 PHE 30 -5.268 -3.243 4.761
162 HE1 PHE 30 HE1 PHE 30 -3.734 1.360 3.962
163 HE2 PHE 30 HE2 PHE 30 -3.643 -2.209 6.292
164 HZ PHE 30 HZ PHE 30 -2.860 0.074 5.893
165 HB2 PHE 30 2HB PHE 30 -6.316 -3.231 2.651
166 HB3 PHE 30 1HB PHE 30 -6.154 -1.865 1.555
167 H HIS 31 H HIS 31 -8.450 -1.106 0.452
168 HA HIS 31 HA HIS 31 -10.556 -2.974 -0.026
169 HD2 HIS 31 HD2 HIS 31 -12.424 -1.705 -0.207
170 HE1 HIS 31 HE1 HIS 31 -12.270 2.092 -2.045
171 HE2 HIS 31 HE2 HIS 31 -13.687 0.515 -0.683
172 HB2 HIS 31 2HB HIS 31 -8.922 -1.200 -1.835
173 HB3 HIS 31 1HB HIS 31 -10.047 -2.374 -2.496
174 H LYS 32 H LYS 32 -10.506 -4.928 -1.017
175 HA LYS 32 HA LYS 32 -8.202 -6.488 -1.176
176 HB2 LYS 32 2HB LYS 32 -10.262 -7.621 -1.137
177 HB3 LYS 32 1HB LYS 32 -10.927 -6.654 -2.442
178 HG2 LYS 32 2HG LYS 32 -8.632 -8.478 -2.989
179 HG3 LYS 32 1HG LYS 32 -10.258 -9.141 -2.832
180 HD2 LYS 32 2HD LYS 32 -9.342 -7.021 -4.778
181 HD3 LYS 32 1HD LYS 32 -9.802 -8.682 -5.161
182 HE2 LYS 32 2HE LYS 32 -12.066 -8.284 -4.587
183 HE3 LYS 32 1HE LYS 32 -11.667 -6.740 -3.839
184 HZ1 LYS 32 3HZ LYS 32 -12.713 -6.544 -6.058
185 HZ2 LYS 32 1HZ LYS 32 -11.365 -7.316 -6.737
186 HZ3 LYS 32 2HZ LYS 32 -11.187 -5.808 -5.975
187 H THR 33 H THR 33 -9.618 -4.223 -3.399
188 HA THR 33 HA THR 33 -7.881 -4.945 -5.596
189 HB THR 33 HB THR 33 -9.526 -2.427 -5.433
190 HG1 THR 33 HG1 THR 33 -11.057 -3.902 -4.912
191 HG21 THR 33 3HG2 THR 33 -9.790 -2.828 -7.848
192 HG22 THR 33 1HG2 THR 33 -8.808 -4.287 -7.707
193 HG23 THR 33 2HG2 THR 33 -8.089 -2.707 -7.397
194 H CYS 34 H CYS 34 -7.416 -3.268 -2.768
195 HA CYS 34 HA CYS 34 -5.267 -1.645 -3.968
196 HB2 CYS 34 2HB CYS 34 -6.931 -0.906 -1.554
197 HB3 CYS 34 1HB CYS 34 -5.675 0.074 -2.304
198 H PHE 35 H PHE 35 -5.541 -4.360 -2.565
199 HA PHE 35 HA PHE 35 -4.162 -3.986 -0.061
200 HD1 PHE 35 HD1 PHE 35 -4.518 -5.237 1.937
201 HD2 PHE 35 HD2 PHE 35 -3.725 -8.347 -0.847
202 HE1 PHE 35 HE1 PHE 35 -3.397 -6.522 3.700
203 HE2 PHE 35 HE2 PHE 35 -2.610 -9.643 0.915
204 HZ PHE 35 HZ PHE 35 -2.441 -8.723 3.187
205 HB2 PHE 35 2HB PHE 35 -5.895 -5.711 -0.310
206 HB3 PHE 35 1HB PHE 35 -4.919 -6.516 -1.535
207 H HIS 36 H HIS 36 -3.125 -4.005 -3.177
208 HA HIS 36 HA HIS 36 -0.712 -5.513 -2.555
209 HD1 HIS 36 HD1 HIS 36 -3.906 -5.862 -5.058
210 HD2 HIS 36 HD2 HIS 36 -1.287 -2.977 -6.498
211 HE1 HIS 36 HE1 HIS 36 -5.246 -4.485 -6.686
212 HE2 HIS 36 HE2 HIS 36 -3.686 -2.645 -7.430
213 HB2 HIS 36 2HB HIS 36 -0.257 -5.112 -5.082
214 HB3 HIS 36 1HB HIS 36 -1.427 -6.318 -4.572
215 H CYS 37 H CYS 37 1.333 -4.545 -3.707
216 HA CYS 37 HA CYS 37 2.161 -2.797 -1.770
217 HB2 CYS 37 2HB CYS 37 3.581 -4.261 -3.216
218 HB3 CYS 37 1HB CYS 37 3.439 -3.055 -4.489
219 H MET 38 H MET 38 2.089 -0.742 -1.392
220 HA MET 38 HA MET 38 0.726 1.078 -3.130
221 HB2 MET 38 2HB MET 38 2.280 1.637 -0.597
222 HB3 MET 38 1HB MET 38 1.158 2.740 -1.381
223 HG2 MET 38 2HG MET 38 0.464 0.079 -0.157
224 HG3 MET 38 1HG MET 38 0.156 1.662 0.555
225 HE1 MET 38 3HE MET 38 -2.355 0.961 0.914
226 HE2 MET 38 1HE MET 38 -2.077 -0.606 0.156
227 HE3 MET 38 2HE MET 38 -3.424 0.405 -0.373
228 H ALA 39 H ALA 39 3.996 0.128 -2.772
229 HA ALA 39 HA ALA 39 5.029 2.673 -3.729
230 HB1 ALA 39 3HB ALA 39 6.545 0.162 -3.061
231 HB2 ALA 39 1HB ALA 39 6.215 1.487 -1.942
232 HB3 ALA 39 2HB ALA 39 7.224 1.763 -3.361
233 H CYS 40 H CYS 40 5.310 -0.755 -4.794
234 HA CYS 40 HA CYS 40 5.753 0.271 -7.495
235 HB2 CYS 40 2HB CYS 40 6.421 -2.024 -8.102
236 HB3 CYS 40 1HB CYS 40 7.386 -1.396 -6.779
237 H ARG 41 H ARG 41 4.321 -2.807 -6.840
238 HA ARG 41 HA ARG 41 1.685 -2.228 -6.418
239 HE ARG 41 HE ARG 41 -1.884 -0.046 -7.821
240 HB2 ARG 41 2HB ARG 41 2.172 -1.388 -8.985
241 HB3 ARG 41 1HB ARG 41 1.579 -3.025 -9.245
242 HG2 ARG 41 2HG ARG 41 -0.213 -1.318 -9.304
243 HG3 ARG 41 1HG ARG 41 -0.457 -2.536 -8.050
244 HD2 ARG 41 2HD ARG 41 0.508 -0.984 -6.392
245 HD3 ARG 41 1HD ARG 41 0.670 0.238 -7.650
246 HH11 ARG 41 1HH1 ARG 41 -0.053 -0.407 -4.853
247 HH12 ARG 41 2HH1 ARG 41 -1.322 0.207 -3.841
248 HH21 ARG 41 1HH2 ARG 41 -3.568 0.784 -6.482
249 HH22 ARG 41 2HH2 ARG 41 -3.311 0.883 -4.765
250 H LYS 42 H LYS 42 3.925 -4.131 -6.116
251 HA LYS 42 HA LYS 42 3.587 -6.653 -7.118
252 HB2 LYS 42 2HB LYS 42 4.928 -5.469 -4.976
253 HB3 LYS 42 1HB LYS 42 3.908 -6.685 -4.227
254 HG2 LYS 42 2HG LYS 42 5.960 -7.151 -6.374
255 HG3 LYS 42 1HG LYS 42 6.093 -7.552 -4.661
256 HD2 LYS 42 2HD LYS 42 3.944 -8.691 -6.427
257 HD3 LYS 42 1HD LYS 42 5.520 -9.458 -6.233
258 HE2 LYS 42 2HE LYS 42 5.076 -9.418 -3.736
259 HE3 LYS 42 1HE LYS 42 3.418 -8.970 -4.137
260 HZ1 LYS 42 3HZ LYS 42 3.289 -11.016 -5.494
261 HZ2 LYS 42 1HZ LYS 42 3.545 -11.334 -3.845
262 HZ3 LYS 42 2HZ LYS 42 4.830 -11.451 -4.941
263 H ALA 43 H ALA 43 2.008 -8.183 -7.001
264 HA ALA 43 HA ALA 43 -0.426 -7.612 -5.618
265 HB1 ALA 43 3HB ALA 43 -0.379 -8.836 -7.749
266 HB2 ALA 43 1HB ALA 43 -1.198 -9.750 -6.481
267 HB3 ALA 43 2HB ALA 43 0.448 -10.175 -6.952
268 H LEU 44 H LEU 44 0.144 -7.445 -3.430
269 HA LEU 44 HA LEU 44 1.537 -9.522 -2.050
270 HG LEU 44 HG LEU 44 2.267 -6.617 0.041
271 HB2 LEU 44 2HB LEU 44 0.145 -7.014 -1.217
272 HB3 LEU 44 1HB LEU 44 0.537 -8.212 -0.004
273 HD11 LEU 44 1HD1 LEU 44 4.251 -7.898 -0.639
274 HD12 LEU 44 2HD1 LEU 44 3.207 -9.002 -1.537
275 HD13 LEU 44 3HD1 LEU 44 3.067 -8.887 0.217
276 HD21 LEU 44 3HD2 LEU 44 3.586 -6.013 -1.946
277 HD22 LEU 44 1HD2 LEU 44 1.901 -5.502 -2.034
278 HD23 LEU 44 2HD2 LEU 44 2.442 -6.914 -2.942
279 H ASP 45 H ASP 45 0.778 -10.969 -0.560
280 HA ASP 45 HA ASP 45 -2.145 -11.303 -0.402
281 HB2 ASP 45 2HB ASP 45 -1.779 -13.683 0.061
282 HB3 ASP 45 1HB ASP 45 -1.076 -13.234 -1.492
283 H SER 46 H SER 46 -2.124 -13.067 1.824
284 HA SER 46 HA SER 46 -2.189 -11.075 3.818
285 HG SER 46 HG SER 46 -2.336 -12.145 5.951
286 HB2 SER 46 2HB SER 46 -3.696 -13.024 3.776
287 HB3 SER 46 1HB SER 46 -2.332 -14.077 4.147
288 H THR 47 H THR 47 0.315 -13.453 3.016
289 HA THR 47 HA THR 47 1.610 -12.876 5.587
290 HB THR 47 HB THR 47 3.124 -14.835 4.856
291 HG1 THR 47 HG1 THR 47 2.626 -15.652 2.975
292 HG21 THR 47 3HG2 THR 47 1.517 -16.452 5.746
293 HG22 THR 47 1HG2 THR 47 0.213 -15.288 5.508
294 HG23 THR 47 2HG2 THR 47 1.493 -14.950 6.672
295 H THR 48 H THR 48 2.017 -12.288 2.203
296 HA THR 48 HA THR 48 4.883 -11.949 2.394
297 HB THR 48 HB THR 48 4.594 -11.110 -0.011
298 HG1 THR 48 HG1 THR 48 2.203 -12.456 -0.218
299 HG21 THR 48 3HG2 THR 48 3.770 -13.907 0.769
300 HG22 THR 48 1HG2 THR 48 5.413 -13.332 0.492
301 HG23 THR 48 2HG2 THR 48 4.271 -13.423 -0.851
302 H VAL 49 H VAL 49 2.181 -9.972 2.943
303 HA VAL 49 HA VAL 49 3.299 -7.501 2.043
304 HB VAL 49 HB VAL 49 0.963 -7.478 2.105
305 HG11 VAL 49 1HG1 VAL 49 0.651 -9.431 3.572
306 HG12 VAL 49 2HG1 VAL 49 -0.385 -8.089 4.060
307 HG13 VAL 49 3HG1 VAL 49 1.085 -8.445 4.968
308 HG21 VAL 49 3HG2 VAL 49 1.852 -6.071 4.618
309 HG22 VAL 49 1HG2 VAL 49 0.350 -5.769 3.745
310 HG23 VAL 49 2HG2 VAL 49 1.900 -5.411 2.983
311 H ALA 50 H ALA 50 4.458 -6.005 3.084
312 HA ALA 50 HA ALA 50 5.009 -6.430 5.941
313 HB1 ALA 50 3HB ALA 50 7.019 -6.561 4.549
314 HB2 ALA 50 1HB ALA 50 7.075 -5.147 5.603
315 HB3 ALA 50 2HB ALA 50 6.675 -4.960 3.895
316 H ALA 51 H ALA 51 3.863 -5.109 7.202
317 HA ALA 51 HA ALA 51 2.969 -2.553 6.045
318 HB1 ALA 51 3HB ALA 51 1.572 -4.248 8.109
319 HB2 ALA 51 1HB ALA 51 1.156 -4.162 6.397
320 HB3 ALA 51 2HB ALA 51 0.977 -2.738 7.423
321 H HIS 52 H HIS 52 3.889 -0.847 6.892
322 HA HIS 52 HA HIS 52 4.694 -0.823 9.711
323 HD1 HIS 52 HD1 HIS 52 5.356 3.493 8.267
324 HD2 HIS 52 HD2 HIS 52 6.570 0.747 11.157
325 HE1 HIS 52 HE1 HIS 52 6.096 4.858 10.246
326 HE2 HIS 52 HE2 HIS 52 6.606 3.171 12.053
327 HB2 HIS 52 2HB HIS 52 6.357 0.078 8.180
328 HB3 HIS 52 1HB HIS 52 5.166 1.156 7.461
329 H GLU 53 H GLU 53 2.819 -0.617 10.836
330 HA GLU 53 HA GLU 53 1.059 0.403 11.830
331 HB2 GLU 53 2HB GLU 53 1.835 2.924 10.358
332 HB3 GLU 53 1HB GLU 53 0.904 2.796 11.840
333 HG2 GLU 53 2HG GLU 53 3.813 2.117 11.522
334 HG3 GLU 53 1HG GLU 53 3.163 3.573 12.267
335 H SER 54 H SER 54 0.921 2.450 8.958
336 HA SER 54 HA SER 54 -1.551 1.071 8.144
337 HG SER 54 HG SER 54 -0.696 4.769 7.338
338 HB2 SER 54 2HB SER 54 -2.263 3.356 7.282
339 HB3 SER 54 1HB SER 54 -2.190 3.202 9.037
340 H GLU 55 H GLU 55 1.515 1.304 7.347
341 HA GLU 55 HA GLU 55 1.086 1.912 4.491
342 HB2 GLU 55 2HB GLU 55 3.682 2.005 6.037
343 HB3 GLU 55 1HB GLU 55 3.411 2.553 4.388
344 HG2 GLU 55 2HG GLU 55 2.028 4.347 5.135
345 HG3 GLU 55 1HG GLU 55 2.044 3.737 6.789
346 H ILE 56 H ILE 56 0.601 -0.093 3.690
347 HA ILE 56 HA ILE 56 2.407 -2.309 4.300
348 HB ILE 56 HB ILE 56 0.608 -3.601 4.208
349 HG12 ILE 56 2HG1 ILE 56 0.239 -2.584 1.382
350 HG13 ILE 56 1HG1 ILE 56 1.107 -4.035 1.894
351 HG21 ILE 56 1HG2 ILE 56 -1.000 -1.246 3.238
352 HG22 ILE 56 2HG2 ILE 56 -0.612 -1.591 4.923
353 HG23 ILE 56 3HG2 ILE 56 -1.619 -2.711 4.005
354 HD11 ILE 56 3HD1 ILE 56 -1.064 -4.585 0.963
355 HD12 ILE 56 1HD1 ILE 56 -1.854 -3.560 2.162
356 HD13 ILE 56 2HD1 ILE 56 -0.988 -5.009 2.674
357 H TYR 57 H TYR 57 3.852 -3.089 2.915
358 HA TYR 57 HA TYR 57 3.662 -2.373 0.073
359 HD1 TYR 57 HD1 TYR 57 4.943 0.282 -0.723
360 HD2 TYR 57 HD2 TYR 57 5.679 -0.631 3.367
361 HE1 TYR 57 HE1 TYR 57 4.645 2.654 -0.143
362 HE2 TYR 57 HE2 TYR 57 5.383 1.734 3.955
363 HH TYR 57 HH TYR 57 4.242 4.084 1.641
364 HB2 TYR 57 2HB TYR 57 6.246 -2.194 1.645
365 HB3 TYR 57 1HB TYR 57 6.022 -1.815 -0.053
366 H CYS 58 H CYS 58 5.338 -3.656 -1.200
367 HA CYS 58 HA CYS 58 5.464 -6.381 -0.272
368 HB2 CYS 58 2HB CYS 58 6.354 -6.923 -2.382
369 HB3 CYS 58 1HB CYS 58 5.235 -5.612 -2.719
370 H LYS 59 H LYS 59 7.631 -7.502 -0.251
371 HA LYS 59 HA LYS 59 9.078 -6.337 1.867
372 HB2 LYS 59 2HB LYS 59 9.710 -8.756 0.171
373 HB3 LYS 59 1HB LYS 59 10.524 -8.338 1.675
374 HG2 LYS 59 2HG LYS 59 8.403 -8.540 2.876
375 HG3 LYS 59 1HG LYS 59 7.596 -8.971 1.367
376 HD2 LYS 59 2HD LYS 59 8.977 -10.967 1.177
377 HD3 LYS 59 1HD LYS 59 9.847 -10.522 2.648
378 HE2 LYS 59 2HE LYS 59 7.736 -10.662 3.910
379 HE3 LYS 59 1HE LYS 59 6.909 -11.171 2.439
380 HZ1 LYS 59 3HZ LYS 59 8.221 -13.160 2.377
381 HZ2 LYS 59 1HZ LYS 59 7.524 -13.025 3.918
382 HZ3 LYS 59 2HZ LYS 59 9.167 -12.647 3.689
383 H VAL 60 H VAL 60 9.437 -6.039 -1.511
384 HA VAL 60 HA VAL 60 12.264 -5.487 -1.481
385 HB VAL 60 HB VAL 60 10.200 -5.007 -3.637
386 HG11 VAL 60 1HG1 VAL 60 13.209 -4.843 -3.773
387 HG12 VAL 60 2HG1 VAL 60 12.085 -3.492 -3.914
388 HG13 VAL 60 3HG1 VAL 60 12.117 -4.748 -5.153
389 HG21 VAL 60 3HG2 VAL 60 10.505 -7.361 -3.129
390 HG22 VAL 60 1HG2 VAL 60 12.253 -7.184 -3.282
391 HG23 VAL 60 2HG2 VAL 60 11.221 -6.979 -4.696
392 H CYS 61 H CYS 61 9.325 -3.514 -1.965
393 HA CYS 61 HA CYS 61 10.756 -1.059 -2.020
394 HB2 CYS 61 2HB CYS 61 7.829 -1.531 -1.448
395 HB3 CYS 61 1HB CYS 61 8.563 0.008 -1.881
396 H TYR 62 H TYR 62 9.008 -2.809 0.515
397 HA TYR 62 HA TYR 62 9.262 -0.784 2.482
398 HD1 TYR 62 HD2 TYR 62 7.121 -0.867 4.260
399 HD2 TYR 62 HD1 TYR 62 9.915 -3.958 5.127
400 HE1 TYR 62 HE2 TYR 62 6.929 -0.358 6.658
401 HE2 TYR 62 HE1 TYR 62 9.731 -3.458 7.529
402 HH TYR 62 HH TYR 62 9.084 -1.649 8.990
403 HB2 TYR 62 2HB TYR 62 7.652 -2.690 2.620
404 HB3 TYR 62 1HB TYR 62 9.009 -3.763 2.942
405 H GLY 63 H GLY 63 11.237 -3.577 1.610
406 HA2 GLY 63 2HA GLY 63 13.158 -3.265 3.669
407 HA3 GLY 63 1HA GLY 63 13.381 -4.158 2.170
408 H ARG 64 H ARG 64 12.642 -1.604 0.689
409 HA ARG 64 HA ARG 64 15.293 -0.502 0.539
410 HE ARG 64 HE ARG 64 12.974 1.501 -3.468
411 HB2 ARG 64 2HB ARG 64 12.708 -0.008 -0.891
412 HB3 ARG 64 1HB ARG 64 14.021 1.154 -1.039
413 HG2 ARG 64 2HG ARG 64 15.487 -0.591 -1.895
414 HG3 ARG 64 1HG ARG 64 14.191 -1.775 -1.717
415 HD2 ARG 64 2HD ARG 64 14.551 -0.825 -4.041
416 HD3 ARG 64 1HD ARG 64 12.904 -0.781 -3.414
417 HH11 ARG 64 1HH1 ARG 64 16.270 0.313 -3.694
418 HH12 ARG 64 2HH1 ARG 64 16.933 1.878 -4.069
419 HH21 ARG 64 1HH2 ARG 64 13.830 3.535 -4.016
420 HH22 ARG 64 2HH2 ARG 64 15.542 3.697 -4.297
421 H ARG 65 H ARG 65 12.104 0.718 1.526
422 HA ARG 65 HA ARG 65 12.904 3.365 1.978
423 HE ARG 65 HE ARG 65 9.459 5.950 4.512
424 HB2 ARG 65 2HB ARG 65 10.557 2.689 1.726
425 HB3 ARG 65 1HB ARG 65 10.627 1.852 3.270
426 HG2 ARG 65 2HG ARG 65 11.000 3.946 4.426
427 HG3 ARG 65 1HG ARG 65 11.031 4.813 2.893
428 HD2 ARG 65 2HD ARG 65 8.710 4.241 2.487
429 HD3 ARG 65 1HD ARG 65 8.668 3.275 3.965
430 HH11 ARG 65 1HH1 ARG 65 6.611 4.077 3.681
431 HH12 ARG 65 2HH1 ARG 65 5.525 5.098 4.578
432 HH21 ARG 65 1HH2 ARG 65 8.038 7.289 5.657
433 HH22 ARG 65 2HH2 ARG 65 6.342 6.925 5.701
434 H TYR 66 H TYR 66 12.684 0.647 4.277
435 HA TYR 66 HA TYR 66 13.882 2.411 6.302
436 HD1 TYR 66 HD1 TYR 66 12.623 2.942 8.708
437 HD2 TYR 66 HD2 TYR 66 10.122 0.897 5.940
438 HE1 TYR 66 HE1 TYR 66 10.791 4.510 9.205
439 HE2 TYR 66 HE2 TYR 66 8.292 2.456 6.428
440 HH TYR 66 HH TYR 66 7.577 3.955 8.205
441 HB2 TYR 66 2HB TYR 66 12.175 -0.053 6.561
442 HB3 TYR 66 1HB TYR 66 13.099 0.583 7.917
Start of MODEL 13
1 H1 GLY 7 1H GLY 7 -19.454 0.857 8.078
2 HA2 GLY 7 2HA GLY 7 -18.468 0.407 5.405
3 HA3 GLY 7 1HA GLY 7 -19.494 1.827 5.553
4 H ALA 8 H ALA 8 -16.528 1.313 5.081
5 HA ALA 8 HA ALA 8 -15.589 3.345 6.998
6 HB1 ALA 8 3HB ALA 8 -13.401 2.191 7.070
7 HB2 ALA 8 1HB ALA 8 -14.085 0.870 6.118
8 HB3 ALA 8 2HB ALA 8 -14.704 1.207 7.736
9 H LYS 9 H LYS 9 -13.037 3.698 5.942
10 HA LYS 9 HA LYS 9 -13.517 4.230 3.100
11 HB2 LYS 9 2HB LYS 9 -12.459 6.391 3.235
12 HB3 LYS 9 1HB LYS 9 -13.778 6.345 4.393
13 HG2 LYS 9 2HG LYS 9 -12.168 5.957 6.198
14 HG3 LYS 9 1HG LYS 9 -10.850 6.034 5.028
15 HD2 LYS 9 2HD LYS 9 -12.796 8.257 5.652
16 HD3 LYS 9 1HD LYS 9 -11.125 8.162 6.207
17 HE2 LYS 9 2HE LYS 9 -10.365 8.210 3.869
18 HE3 LYS 9 1HE LYS 9 -12.040 8.349 3.338
19 HZ1 LYS 9 3HZ LYS 9 -12.213 10.449 4.506
20 HZ2 LYS 9 1HZ LYS 9 -10.928 10.505 3.399
21 HZ3 LYS 9 2HZ LYS 9 -10.614 10.314 5.055
22 H CYS 10 H CYS 10 -11.807 3.955 1.790
23 HA CYS 10 HA CYS 10 -10.046 1.913 2.488
24 HB2 CYS 10 2HB CYS 10 -10.861 2.571 0.191
25 HB3 CYS 10 1HB CYS 10 -9.673 3.862 0.220
26 H GLY 11 H GLY 11 -8.051 1.831 3.241
27 HA2 GLY 11 2HA GLY 11 -6.598 4.156 4.054
28 HA3 GLY 11 1HA GLY 11 -5.997 2.504 4.048
29 H ALA 12 H ALA 12 -6.924 2.555 1.061
30 HA ALA 12 HA ALA 12 -4.403 3.705 0.069
31 HB1 ALA 12 3HB ALA 12 -4.700 2.277 -1.886
32 HB2 ALA 12 1HB ALA 12 -6.234 1.698 -1.237
33 HB3 ALA 12 2HB ALA 12 -4.725 1.329 -0.398
34 H CYS 13 H CYS 13 -7.872 3.618 -0.470
35 HA CYS 13 HA CYS 13 -7.707 5.883 -2.336
36 HB2 CYS 13 2HB CYS 13 -10.145 4.350 -1.379
37 HB3 CYS 13 1HB CYS 13 -10.101 5.527 -2.680
38 H GLU 14 H GLU 14 -9.604 7.547 -1.873
39 HA GLU 14 HA GLU 14 -10.238 7.621 1.002
40 HB2 GLU 14 2HB GLU 14 -10.252 9.831 -1.050
41 HB3 GLU 14 1HB GLU 14 -11.145 9.961 0.460
42 HG2 GLU 14 2HG GLU 14 -8.800 9.275 1.473
43 HG3 GLU 14 1HG GLU 14 -8.224 10.000 -0.028
44 H LYS 15 H LYS 15 -11.166 6.086 -1.412
45 HA LYS 15 HA LYS 15 -13.970 6.702 -1.640
46 HB2 LYS 15 2HB LYS 15 -12.573 4.142 -2.436
47 HB3 LYS 15 1HB LYS 15 -14.090 4.769 -3.060
48 HG2 LYS 15 2HG LYS 15 -11.412 6.077 -3.477
49 HG3 LYS 15 1HG LYS 15 -12.174 4.975 -4.623
50 HD2 LYS 15 2HD LYS 15 -14.062 6.510 -4.847
51 HD3 LYS 15 1HD LYS 15 -13.319 7.602 -3.675
52 HE2 LYS 15 2HE LYS 15 -12.935 8.324 -5.996
53 HE3 LYS 15 1HE LYS 15 -11.435 7.961 -5.150
54 HZ1 LYS 15 3HZ LYS 15 -12.826 6.187 -7.088
55 HZ2 LYS 15 1HZ LYS 15 -11.408 5.788 -6.243
56 HZ3 LYS 15 2HZ LYS 15 -11.393 7.053 -7.371
57 H THR 16 H THR 16 -15.519 4.818 -1.161
58 HA THR 16 HA THR 16 -15.217 4.237 1.634
59 HB THR 16 HB THR 16 -17.481 2.985 1.042
60 HG1 THR 16 HG1 THR 16 -18.071 3.322 -0.949
61 HG21 THR 16 3HG2 THR 16 -17.180 5.988 1.178
62 HG22 THR 16 1HG2 THR 16 -17.292 4.894 2.556
63 HG23 THR 16 2HG2 THR 16 -18.673 5.099 1.478
64 H VAL 17 H VAL 17 -14.937 2.366 2.619
65 HA VAL 17 HA VAL 17 -14.489 -0.032 0.966
66 HB VAL 17 HB VAL 17 -13.235 0.872 3.546
67 HG11 VAL 17 1HG1 VAL 17 -13.991 -1.416 3.959
68 HG12 VAL 17 2HG1 VAL 17 -12.235 -1.353 3.804
69 HG13 VAL 17 3HG1 VAL 17 -13.218 -1.946 2.466
70 HG21 VAL 17 3HG2 VAL 17 -11.174 0.283 2.363
71 HG22 VAL 17 1HG2 VAL 17 -12.132 1.476 1.483
72 HG23 VAL 17 2HG2 VAL 17 -12.136 -0.211 0.968
73 H TYR 18 H TYR 18 -15.765 -1.732 1.268
74 HA TYR 18 HA TYR 18 -17.443 -1.811 3.694
75 HD1 TYR 18 HD1 TYR 18 -20.174 -0.759 3.295
76 HD2 TYR 18 HD2 TYR 18 -17.999 -0.819 -0.361
77 HE1 TYR 18 HE1 TYR 18 -21.105 1.443 2.709
78 HE2 TYR 18 HE2 TYR 18 -18.922 1.380 -0.953
79 HH TYR 18 HH TYR 18 -20.634 3.332 1.301
80 HB2 TYR 18 2HB TYR 18 -18.222 -2.809 0.937
81 HB3 TYR 18 1HB TYR 18 -19.221 -2.852 2.384
82 H HIS 19 H HIS 19 -18.022 -4.047 4.323
83 HA HIS 19 HA HIS 19 -15.791 -5.727 4.364
84 HD1 HIS 19 HD1 HIS 19 -19.605 -4.845 6.372
85 HD2 HIS 19 HD2 HIS 19 -19.646 -7.982 3.636
86 HE1 HIS 19 HE1 HIS 19 -22.031 -5.227 5.810
87 HE2 HIS 19 HE2 HIS 19 -22.041 -7.272 4.335
88 HB2 HIS 19 2HB HIS 19 -17.321 -7.476 5.283
89 HB3 HIS 19 1HB HIS 19 -17.378 -5.937 6.129
90 H ALA 20 H ALA 20 -18.033 -5.262 1.888
91 HA ALA 20 HA ALA 20 -18.008 -7.586 0.410
92 HB1 ALA 20 3HB ALA 20 -19.143 -5.528 -0.275
93 HB2 ALA 20 1HB ALA 20 -18.108 -6.143 -1.565
94 HB3 ALA 20 2HB ALA 20 -17.580 -4.769 -0.589
95 H GLU 21 H GLU 21 -15.481 -5.070 0.554
96 HA GLU 21 HA GLU 21 -13.528 -7.119 -0.140
97 HB2 GLU 21 2HB GLU 21 -12.455 -5.822 -1.834
98 HB3 GLU 21 1HB GLU 21 -14.144 -5.975 -2.259
99 HG2 GLU 21 2HG GLU 21 -14.511 -3.654 -1.460
100 HG3 GLU 21 1HG GLU 21 -12.785 -3.549 -1.118
101 H GLU 22 H GLU 22 -13.989 -6.200 2.342
102 HA GLU 22 HA GLU 22 -12.070 -4.075 2.905
103 HB2 GLU 22 2HB GLU 22 -14.217 -3.923 4.016
104 HB3 GLU 22 1HB GLU 22 -14.022 -5.538 4.685
105 HG2 GLU 22 2HG GLU 22 -12.077 -4.745 5.967
106 HG3 GLU 22 1HG GLU 22 -12.356 -3.119 5.336
107 H ILE 23 H ILE 23 -10.035 -4.587 3.296
108 HA ILE 23 HA ILE 23 -9.531 -7.011 4.888
109 HB ILE 23 HB ILE 23 -7.730 -5.681 2.852
110 HG12 ILE 23 2HG1 ILE 23 -8.583 -8.563 2.952
111 HG13 ILE 23 1HG1 ILE 23 -9.580 -7.347 2.156
112 HG21 ILE 23 1HG2 ILE 23 -7.107 -7.912 4.790
113 HG22 ILE 23 2HG2 ILE 23 -6.370 -6.309 4.749
114 HG23 ILE 23 3HG2 ILE 23 -6.086 -7.445 3.430
115 HD11 ILE 23 3HD1 ILE 23 -7.725 -6.836 0.654
116 HD12 ILE 23 1HD1 ILE 23 -8.182 -8.538 0.571
117 HD13 ILE 23 2HD1 ILE 23 -6.741 -8.055 1.464
118 H GLN 24 H GLN 24 -9.002 -6.585 6.906
119 HA GLN 24 HA GLN 24 -8.020 -3.973 7.677
120 HB2 GLN 24 2HB GLN 24 -8.508 -6.479 9.298
121 HB3 GLN 24 1HB GLN 24 -8.020 -4.930 9.969
122 HG2 GLN 24 2HG GLN 24 -10.580 -5.456 8.479
123 HG3 GLN 24 1HG GLN 24 -10.410 -5.342 10.230
124 HE21 GLN 24 1HE2 GLN 24 -10.499 -3.591 7.245
125 HE22 GLN 24 2HE2 GLN 24 -10.590 -2.006 7.939
126 H CYS 25 H CYS 25 -5.966 -3.628 7.045
127 HA CYS 25 HA CYS 25 -3.978 -5.693 7.689
128 HG CYS 25 HG CYS 25 -1.547 -5.759 6.778
129 HB2 CYS 25 2HB CYS 25 -4.038 -4.836 5.340
130 HB3 CYS 25 1HB CYS 25 -3.640 -3.235 5.953
131 H ASN 26 H ASN 26 -3.293 -5.447 9.690
132 HA ASN 26 HA ASN 26 -2.181 -4.616 11.473
133 HB2 ASN 26 2HB ASN 26 -0.677 -3.517 9.863
134 HB3 ASN 26 1HB ASN 26 -1.756 -2.128 9.807
135 HD21 ASN 26 1HD2 ASN 26 -1.720 -0.657 11.438
136 HD22 ASN 26 2HD2 ASN 26 -0.543 -0.665 12.698
137 H GLY 27 H GLY 27 -4.098 -1.952 10.046
138 HA2 GLY 27 2HA GLY 27 -6.049 -2.056 12.091
139 HA3 GLY 27 1HA GLY 27 -4.895 -0.784 12.458
140 H ARG 28 H ARG 28 -5.526 -1.468 9.116
141 HA ARG 28 HA ARG 28 -7.296 0.880 8.973
142 HE ARG 28 HE ARG 28 -5.112 3.682 6.743
143 HB2 ARG 28 2HB ARG 28 -4.971 0.285 7.131
144 HB3 ARG 28 1HB ARG 28 -6.118 1.600 6.925
145 HG2 ARG 28 2HG ARG 28 -5.354 2.642 8.955
146 HG3 ARG 28 1HG ARG 28 -4.295 1.274 9.298
147 HD2 ARG 28 2HD ARG 28 -2.959 3.031 8.383
148 HD3 ARG 28 1HD ARG 28 -3.090 1.756 7.177
149 HH11 ARG 28 1HH1 ARG 28 -1.652 3.215 6.417
150 HH12 ARG 28 2HH1 ARG 28 -1.462 4.431 5.196
151 HH21 ARG 28 1HH2 ARG 28 -4.872 5.284 5.121
152 HH22 ARG 28 2HH2 ARG 28 -3.308 5.591 4.438
153 H SER 29 H SER 29 -8.698 0.934 7.144
154 HA SER 29 HA SER 29 -9.428 -1.753 6.271
155 HG SER 29 HG SER 29 -12.239 -0.545 7.638
156 HB2 SER 29 2HB SER 29 -10.931 0.865 6.011
157 HB3 SER 29 1HB SER 29 -11.564 -0.734 5.616
158 H PHE 30 H PHE 30 -8.359 -2.374 4.494
159 HA PHE 30 HA PHE 30 -8.067 -0.439 2.287
160 HD1 PHE 30 HD1 PHE 30 -5.442 0.337 1.800
161 HD2 PHE 30 HD2 PHE 30 -5.526 -2.607 4.868
162 HE1 PHE 30 HE1 PHE 30 -3.779 1.624 3.075
163 HE2 PHE 30 HE2 PHE 30 -3.864 -1.323 6.149
164 HZ PHE 30 HZ PHE 30 -2.978 0.786 5.246
165 HB2 PHE 30 2HB PHE 30 -6.584 -3.026 2.820
166 HB3 PHE 30 1HB PHE 30 -6.325 -1.982 1.428
167 H HIS 31 H HIS 31 -8.733 -0.988 0.217
168 HA HIS 31 HA HIS 31 -10.820 -2.886 -0.102
169 HD2 HIS 31 HD2 HIS 31 -12.786 -1.742 -0.622
170 HE1 HIS 31 HE1 HIS 31 -12.388 2.079 -2.344
171 HE2 HIS 31 HE2 HIS 31 -13.844 0.602 -0.927
172 HB2 HIS 31 2HB HIS 31 -9.164 -1.304 -2.063
173 HB3 HIS 31 1HB HIS 31 -10.324 -2.508 -2.617
174 H LYS 32 H LYS 32 -10.824 -4.877 -1.142
175 HA LYS 32 HA LYS 32 -8.546 -6.510 -1.108
176 HB2 LYS 32 2HB LYS 32 -10.775 -7.469 -1.167
177 HB3 LYS 32 1HB LYS 32 -11.104 -6.716 -2.717
178 HG2 LYS 32 2HG LYS 32 -8.826 -8.619 -2.513
179 HG3 LYS 32 1HG LYS 32 -10.472 -9.254 -2.543
180 HD2 LYS 32 2HD LYS 32 -10.901 -8.132 -4.647
181 HD3 LYS 32 1HD LYS 32 -9.302 -7.384 -4.604
182 HE2 LYS 32 2HE LYS 32 -8.255 -9.562 -4.766
183 HE3 LYS 32 1HE LYS 32 -9.832 -10.348 -4.720
184 HZ1 LYS 32 3HZ LYS 32 -8.922 -8.475 -6.845
185 HZ2 LYS 32 1HZ LYS 32 -10.399 -9.310 -6.806
186 HZ3 LYS 32 2HZ LYS 32 -8.943 -10.166 -6.977
187 H THR 33 H THR 33 -9.930 -4.396 -3.515
188 HA THR 33 HA THR 33 -8.183 -5.027 -5.654
189 HB THR 33 HB THR 33 -9.538 -2.372 -5.154
190 HG1 THR 33 HG1 THR 33 -11.251 -3.686 -5.070
191 HG21 THR 33 3HG2 THR 33 -9.630 -2.278 -7.610
192 HG22 THR 33 1HG2 THR 33 -8.776 -3.818 -7.697
193 HG23 THR 33 2HG2 THR 33 -7.970 -2.400 -7.027
194 H CYS 34 H CYS 34 -7.815 -3.225 -2.757
195 HA CYS 34 HA CYS 34 -5.480 -1.800 -3.811
196 HB2 CYS 34 2HB CYS 34 -7.241 -1.198 -1.426
197 HB3 CYS 34 1HB CYS 34 -5.828 -0.252 -1.902
198 H PHE 35 H PHE 35 -5.930 -4.611 -2.444
199 HA PHE 35 HA PHE 35 -4.071 -4.342 -0.237
200 HD1 PHE 35 HD2 PHE 35 -4.811 -5.341 2.004
201 HD2 PHE 35 HD1 PHE 35 -3.702 -8.523 -0.589
202 HE1 PHE 35 HE2 PHE 35 -3.604 -6.426 3.854
203 HE2 PHE 35 HE1 PHE 35 -2.497 -9.611 1.251
204 HZ PHE 35 HZ PHE 35 -2.487 -8.516 3.522
205 HB2 PHE 35 2HB PHE 35 -6.051 -5.929 -0.211
206 HB3 PHE 35 1HB PHE 35 -5.154 -6.923 -1.359
207 H HIS 36 H HIS 36 -2.458 -3.463 -1.722
208 HA HIS 36 HA HIS 36 -0.509 -5.467 -2.205
209 HD1 HIS 36 HD1 HIS 36 -3.695 -4.654 -5.170
210 HD2 HIS 36 HD2 HIS 36 -0.354 -2.191 -5.296
211 HE1 HIS 36 HE1 HIS 36 -4.373 -2.666 -6.533
212 HE2 HIS 36 HE2 HIS 36 -2.297 -1.260 -6.737
213 HB2 HIS 36 2HB HIS 36 -0.096 -4.962 -4.600
214 HB3 HIS 36 1HB HIS 36 -1.626 -5.776 -4.320
215 H CYS 37 H CYS 37 1.443 -4.209 -3.459
216 HA CYS 37 HA CYS 37 2.355 -2.582 -1.382
217 HB2 CYS 37 2HB CYS 37 3.743 -3.921 -3.013
218 HB3 CYS 37 1HB CYS 37 3.470 -2.635 -4.185
219 H MET 38 H MET 38 2.141 -0.527 -0.955
220 HA MET 38 HA MET 38 0.571 1.190 -2.615
221 HB2 MET 38 2HB MET 38 2.195 1.806 -0.143
222 HB3 MET 38 1HB MET 38 1.043 2.901 -0.896
223 HG2 MET 38 2HG MET 38 0.400 0.211 0.281
224 HG3 MET 38 1HG MET 38 0.096 1.771 1.042
225 HE1 MET 38 3HE MET 38 -2.434 0.643 1.310
226 HE2 MET 38 1HE MET 38 -1.943 -0.732 0.321
227 HE3 MET 38 2HE MET 38 -3.401 0.173 -0.087
228 H ALA 39 H ALA 39 3.815 0.344 -2.686
229 HA ALA 39 HA ALA 39 4.648 2.943 -3.765
230 HB1 ALA 39 3HB ALA 39 6.352 0.581 -2.990
231 HB2 ALA 39 1HB ALA 39 6.032 1.992 -1.982
232 HB3 ALA 39 2HB ALA 39 6.927 2.171 -3.490
233 H CYS 40 H CYS 40 5.615 -0.399 -4.569
234 HA CYS 40 HA CYS 40 5.929 0.423 -7.330
235 HB2 CYS 40 2HB CYS 40 7.015 -1.707 -7.673
236 HB3 CYS 40 1HB CYS 40 7.646 -0.975 -6.203
237 H ARG 41 H ARG 41 3.543 -0.904 -5.434
238 HA ARG 41 HA ARG 41 1.445 -1.604 -5.839
239 HE ARG 41 HE ARG 41 0.835 2.669 -6.504
240 HB2 ARG 41 2HB ARG 41 2.106 -1.146 -8.750
241 HB3 ARG 41 1HB ARG 41 0.504 -1.528 -8.132
242 HG2 ARG 41 2HG ARG 41 2.128 0.913 -7.446
243 HG3 ARG 41 1HG ARG 41 0.753 0.855 -8.550
244 HD2 ARG 41 2HD ARG 41 -0.740 0.300 -6.767
245 HD3 ARG 41 1HD ARG 41 0.600 0.081 -5.644
246 HH11 ARG 41 1HH1 ARG 41 -1.745 0.828 -4.986
247 HH12 ARG 41 2HH1 ARG 41 -2.361 2.191 -4.107
248 HH21 ARG 41 1HH2 ARG 41 0.010 4.440 -5.384
249 HH22 ARG 41 2HH2 ARG 41 -1.374 4.254 -4.347
250 H LYS 42 H LYS 42 3.989 -3.323 -6.097
251 HA LYS 42 HA LYS 42 3.431 -5.663 -7.486
252 HB2 LYS 42 2HB LYS 42 5.531 -5.231 -6.262
253 HB3 LYS 42 1HB LYS 42 4.668 -5.352 -4.739
254 HG2 LYS 42 2HG LYS 42 5.829 -7.384 -5.052
255 HG3 LYS 42 1HG LYS 42 4.121 -7.723 -5.344
256 HD2 LYS 42 2HD LYS 42 4.479 -7.658 -7.737
257 HD3 LYS 42 1HD LYS 42 6.161 -7.178 -7.504
258 HE2 LYS 42 2HE LYS 42 4.947 -9.779 -6.587
259 HE3 LYS 42 1HE LYS 42 5.936 -9.570 -8.031
260 HZ1 LYS 42 3HZ LYS 42 7.794 -8.921 -6.642
261 HZ2 LYS 42 1HZ LYS 42 7.211 -10.436 -6.146
262 HZ3 LYS 42 2HZ LYS 42 6.841 -9.051 -5.244
263 H ALA 43 H ALA 43 1.936 -7.253 -7.238
264 HA ALA 43 HA ALA 43 -0.194 -6.945 -5.376
265 HB1 ALA 43 3HB ALA 43 -0.980 -9.115 -6.228
266 HB2 ALA 43 1HB ALA 43 0.551 -9.332 -7.076
267 HB3 ALA 43 2HB ALA 43 -0.533 -8.019 -7.536
268 H LEU 44 H LEU 44 -0.288 -7.569 -3.305
269 HA LEU 44 HA LEU 44 1.887 -9.217 -2.247
270 HG LEU 44 HG LEU 44 2.104 -6.497 0.190
271 HB2 LEU 44 2HB LEU 44 0.108 -7.128 -1.109
272 HB3 LEU 44 1HB LEU 44 0.642 -8.399 -0.026
273 HD11 LEU 44 1HD1 LEU 44 4.263 -7.539 -0.341
274 HD12 LEU 44 2HD1 LEU 44 3.436 -8.727 -1.347
275 HD13 LEU 44 3HD1 LEU 44 3.144 -8.687 0.392
276 HD21 LEU 44 3HD2 LEU 44 2.569 -6.768 -2.769
277 HD22 LEU 44 1HD2 LEU 44 3.468 -5.709 -1.681
278 HD23 LEU 44 2HD2 LEU 44 1.745 -5.448 -1.939
279 H ASP 45 H ASP 45 1.501 -10.878 -0.751
280 HA ASP 45 HA ASP 45 -1.198 -12.049 -0.850
281 HB2 ASP 45 2HB ASP 45 1.463 -13.376 -0.244
282 HB3 ASP 45 1HB ASP 45 -0.100 -14.177 -0.149
283 H SER 46 H SER 46 -1.584 -13.391 1.295
284 HA SER 46 HA SER 46 -1.823 -11.528 3.355
285 HG SER 46 HG SER 46 -3.335 -14.114 2.127
286 HB2 SER 46 2HB SER 46 -1.814 -14.540 3.629
287 HB3 SER 46 1HB SER 46 -2.556 -13.388 4.738
288 H THR 47 H THR 47 0.769 -13.771 2.661
289 HA THR 47 HA THR 47 1.970 -13.380 5.281
290 HB THR 47 HB THR 47 3.718 -14.988 4.225
291 HG1 THR 47 HG1 THR 47 1.578 -15.814 2.602
292 HG21 THR 47 3HG2 THR 47 2.310 -16.920 4.797
293 HG22 THR 47 1HG2 THR 47 0.886 -15.881 4.786
294 HG23 THR 47 2HG2 THR 47 2.151 -15.628 5.989
295 H THR 48 H THR 48 2.427 -12.244 2.007
296 HA THR 48 HA THR 48 5.229 -11.679 2.473
297 HB THR 48 HB THR 48 5.128 -10.803 0.083
298 HG1 THR 48 HG1 THR 48 3.295 -11.458 -1.106
299 HG21 THR 48 3HG2 THR 48 6.023 -12.998 0.658
300 HG22 THR 48 1HG2 THR 48 5.123 -13.067 -0.856
301 HG23 THR 48 2HG2 THR 48 4.396 -13.678 0.629
302 H VAL 49 H VAL 49 2.247 -9.960 2.629
303 HA VAL 49 HA VAL 49 3.231 -7.367 2.072
304 HB VAL 49 HB VAL 49 0.911 -7.512 1.968
305 HG11 VAL 49 1HG1 VAL 49 -0.524 -8.354 3.773
306 HG12 VAL 49 2HG1 VAL 49 0.901 -8.682 4.758
307 HG13 VAL 49 3HG1 VAL 49 0.637 -9.581 3.264
308 HG21 VAL 49 3HG2 VAL 49 0.056 -5.971 3.674
309 HG22 VAL 49 1HG2 VAL 49 1.611 -5.449 3.026
310 HG23 VAL 49 2HG2 VAL 49 1.530 -6.211 4.613
311 H ALA 50 H ALA 50 4.432 -6.040 3.207
312 HA ALA 50 HA ALA 50 4.867 -6.613 6.059
313 HB1 ALA 50 3HB ALA 50 6.883 -6.639 4.646
314 HB2 ALA 50 1HB ALA 50 6.935 -5.349 5.847
315 HB3 ALA 50 2HB ALA 50 6.554 -4.974 4.167
316 H ALA 51 H ALA 51 3.479 -5.450 7.232
317 HA ALA 51 HA ALA 51 2.939 -2.674 6.437
318 HB1 ALA 51 3HB ALA 51 1.374 -4.437 8.322
319 HB2 ALA 51 1HB ALA 51 0.970 -4.136 6.632
320 HB3 ALA 51 2HB ALA 51 0.931 -2.812 7.797
321 H HIS 52 H HIS 52 4.352 -1.365 7.396
322 HA HIS 52 HA HIS 52 5.037 -1.872 10.214
323 HD1 HIS 52 HD1 HIS 52 7.806 -2.358 11.007
324 HD2 HIS 52 HD2 HIS 52 7.555 1.684 10.056
325 HE1 HIS 52 HE1 HIS 52 9.180 -1.166 12.742
326 HE2 HIS 52 HE2 HIS 52 8.804 1.287 12.288
327 HB2 HIS 52 2HB HIS 52 6.930 -1.790 8.555
328 HB3 HIS 52 1HB HIS 52 6.518 -0.105 8.252
329 H GLU 53 H GLU 53 4.291 -0.567 11.687
330 HA GLU 53 HA GLU 53 3.288 1.139 12.771
331 HB2 GLU 53 2HB GLU 53 3.998 2.873 10.400
332 HB3 GLU 53 1HB GLU 53 3.539 3.427 12.002
333 HG2 GLU 53 2HG GLU 53 6.051 1.978 11.223
334 HG3 GLU 53 1HG GLU 53 5.901 3.648 11.760
335 H SER 54 H SER 54 2.494 2.007 9.398
336 HA SER 54 HA SER 54 -0.253 1.168 9.798
337 HG SER 54 HG SER 54 0.548 4.462 8.267
338 HB2 SER 54 2HB SER 54 -1.149 3.418 9.193
339 HB3 SER 54 1HB SER 54 -0.317 3.400 10.749
340 H GLU 55 H GLU 55 2.374 1.357 7.847
341 HA GLU 55 HA GLU 55 0.785 1.719 5.394
342 HB2 GLU 55 2HB GLU 55 3.774 2.051 5.703
343 HB3 GLU 55 1HB GLU 55 2.824 2.395 4.266
344 HG2 GLU 55 2HG GLU 55 2.849 3.884 6.868
345 HG3 GLU 55 1HG GLU 55 3.305 4.468 5.269
346 H ILE 56 H ILE 56 0.869 0.230 3.794
347 HA ILE 56 HA ILE 56 2.212 -2.311 4.458
348 HB ILE 56 HB ILE 56 0.132 -3.148 4.322
349 HG12 ILE 56 2HG1 ILE 56 0.497 -2.608 1.364
350 HG13 ILE 56 1HG1 ILE 56 1.055 -4.030 2.240
351 HG21 ILE 56 1HG2 ILE 56 -0.883 -0.955 4.457
352 HG22 ILE 56 2HG2 ILE 56 -1.796 -1.999 3.368
353 HG23 ILE 56 3HG2 ILE 56 -0.730 -0.757 2.710
354 HD11 ILE 56 3HD1 ILE 56 -1.818 -3.226 1.817
355 HD12 ILE 56 1HD1 ILE 56 -1.265 -4.655 2.689
356 HD13 ILE 56 2HD1 ILE 56 -0.956 -4.504 0.960
357 H TYR 57 H TYR 57 3.746 -3.041 3.148
358 HA TYR 57 HA TYR 57 3.707 -2.266 0.324
359 HD1 TYR 57 HD1 TYR 57 4.925 0.230 -0.476
360 HD2 TYR 57 HD2 TYR 57 5.774 -0.479 3.628
361 HE1 TYR 57 HE1 TYR 57 4.549 2.606 0.001
362 HE2 TYR 57 HE2 TYR 57 5.412 1.906 4.118
363 HH TYR 57 HH TYR 57 5.447 4.083 2.916
364 HB2 TYR 57 2HB TYR 57 6.220 -2.155 2.013
365 HB3 TYR 57 1HB TYR 57 6.109 -1.822 0.294
366 H CYS 58 H CYS 58 5.438 -3.528 -0.887
367 HA CYS 58 HA CYS 58 5.276 -6.315 -0.228
368 HB2 CYS 58 2HB CYS 58 6.466 -6.677 -2.279
369 HB3 CYS 58 1HB CYS 58 5.345 -5.353 -2.577
370 H LYS 59 H LYS 59 7.550 -7.534 -0.434
371 HA LYS 59 HA LYS 59 9.136 -6.566 1.767
372 HB2 LYS 59 2HB LYS 59 9.398 -9.005 0.008
373 HB3 LYS 59 1HB LYS 59 10.516 -8.627 1.311
374 HG2 LYS 59 2HG LYS 59 8.622 -8.690 2.897
375 HG3 LYS 59 1HG LYS 59 7.572 -9.189 1.567
376 HD2 LYS 59 2HD LYS 59 8.875 -11.197 1.240
377 HD3 LYS 59 1HD LYS 59 10.037 -10.677 2.459
378 HE2 LYS 59 2HE LYS 59 8.217 -10.733 4.143
379 HE3 LYS 59 1HE LYS 59 7.144 -11.381 2.904
380 HZ1 LYS 59 3HZ LYS 59 8.154 -13.091 4.366
381 HZ2 LYS 59 1HZ LYS 59 9.675 -12.679 3.749
382 HZ3 LYS 59 2HZ LYS 59 8.493 -13.331 2.721
383 H VAL 60 H VAL 60 9.120 -6.015 -1.534
384 HA VAL 60 HA VAL 60 11.978 -5.825 -1.910
385 HB VAL 60 HB VAL 60 9.781 -4.751 -3.689
386 HG11 VAL 60 1HG1 VAL 60 11.975 -3.769 -4.114
387 HG12 VAL 60 2HG1 VAL 60 11.471 -4.813 -5.444
388 HG13 VAL 60 3HG1 VAL 60 12.669 -5.381 -4.281
389 HG21 VAL 60 3HG2 VAL 60 9.525 -7.157 -3.354
390 HG22 VAL 60 1HG2 VAL 60 11.208 -7.408 -3.812
391 HG23 VAL 60 2HG2 VAL 60 10.052 -6.798 -5.000
392 H CYS 61 H CYS 61 9.283 -3.492 -1.801
393 HA CYS 61 HA CYS 61 11.013 -1.227 -1.753
394 HB2 CYS 61 2HB CYS 61 8.106 -1.431 -0.960
395 HB3 CYS 61 1HB CYS 61 8.988 0.064 -1.261
396 H TYR 62 H TYR 62 9.474 -3.205 0.697
397 HA TYR 62 HA TYR 62 10.090 -1.588 2.924
398 HD1 TYR 62 HD1 TYR 62 11.347 -4.608 5.001
399 HD2 TYR 62 HD2 TYR 62 7.698 -2.432 4.745
400 HE1 TYR 62 HE1 TYR 62 11.297 -4.416 7.449
401 HE2 TYR 62 HE2 TYR 62 7.643 -2.231 7.196
402 HH TYR 62 HH TYR 62 8.550 -3.398 9.171
403 HB2 TYR 62 2HB TYR 62 8.557 -3.636 2.829
404 HB3 TYR 62 1HB TYR 62 10.020 -4.607 2.947
405 H GLY 63 H GLY 63 11.848 -4.203 1.306
406 HA2 GLY 63 2HA GLY 63 14.124 -4.059 3.024
407 HA3 GLY 63 1HA GLY 63 14.034 -4.897 1.482
408 H ARG 64 H ARG 64 13.049 -2.109 0.450
409 HA ARG 64 HA ARG 64 15.694 -1.155 -0.258
410 HE ARG 64 HE ARG 64 12.709 -0.075 -3.721
411 HB2 ARG 64 2HB ARG 64 13.872 -1.227 -1.952
412 HB3 ARG 64 1HB ARG 64 12.986 -0.029 -1.013
413 HG2 ARG 64 2HG ARG 64 15.143 1.391 -1.268
414 HG3 ARG 64 1HG ARG 64 15.494 0.293 -2.601
415 HD2 ARG 64 2HD ARG 64 12.999 1.960 -2.302
416 HD3 ARG 64 1HD ARG 64 14.367 2.343 -3.342
417 HH11 ARG 64 1HH1 ARG 64 14.447 2.694 -4.976
418 HH12 ARG 64 2HH1 ARG 64 13.926 2.436 -6.616
419 HH21 ARG 64 1HH2 ARG 64 12.055 -0.444 -5.866
420 HH22 ARG 64 2HH2 ARG 64 12.600 0.619 -7.134
421 H ARG 65 H ARG 65 12.785 0.192 1.302
422 HA ARG 65 HA ARG 65 14.046 2.695 1.863
423 HE ARG 65 HE ARG 65 10.354 4.306 1.242
424 HB2 ARG 65 2HB ARG 65 11.598 2.417 1.498
425 HB3 ARG 65 1HB ARG 65 11.497 1.554 3.026
426 HG2 ARG 65 2HG ARG 65 12.256 3.550 4.208
427 HG3 ARG 65 1HG ARG 65 12.368 4.417 2.676
428 HD2 ARG 65 2HD ARG 65 9.848 3.231 3.836
429 HD3 ARG 65 1HD ARG 65 10.301 4.932 3.913
430 HH11 ARG 65 1HH1 ARG 65 7.961 4.211 3.811
431 HH12 ARG 65 2HH1 ARG 65 6.610 4.416 2.730
432 HH21 ARG 65 1HH2 ARG 65 8.576 4.622 -0.165
433 HH22 ARG 65 2HH2 ARG 65 6.961 4.692 0.477
434 H TYR 66 H TYR 66 13.666 -0.299 3.628
435 HA TYR 66 HA TYR 66 14.626 1.006 6.077
436 HD1 TYR 66 HD1 TYR 66 11.450 -0.359 4.584
437 HD2 TYR 66 HD2 TYR 66 12.671 0.171 8.625
438 HE1 TYR 66 HE1 TYR 66 9.295 0.707 5.088
439 HE2 TYR 66 HE2 TYR 66 10.519 1.246 9.138
440 HH TYR 66 HH TYR 66 7.878 1.221 6.899
441 HB2 TYR 66 2HB TYR 66 13.339 -1.692 5.636
442 HB3 TYR 66 1HB TYR 66 13.979 -1.156 7.185
Start of MODEL 14
1 H1 GLY 7 1H GLY 7 -20.446 2.023 7.220
2 HA2 GLY 7 2HA GLY 7 -19.083 0.054 6.061
3 HA3 GLY 7 1HA GLY 7 -19.169 1.208 4.737
4 H ALA 8 H ALA 8 -16.754 0.847 5.163
5 HA ALA 8 HA ALA 8 -15.798 2.853 7.108
6 HB1 ALA 8 3HB ALA 8 -14.329 0.475 5.956
7 HB2 ALA 8 1HB ALA 8 -15.004 0.579 7.583
8 HB3 ALA 8 2HB ALA 8 -13.672 1.636 7.111
9 H LYS 9 H LYS 9 -13.270 3.269 6.093
10 HA LYS 9 HA LYS 9 -13.783 4.195 3.354
11 HB2 LYS 9 2HB LYS 9 -12.492 6.199 3.780
12 HB3 LYS 9 1HB LYS 9 -13.775 6.092 4.975
13 HG2 LYS 9 2HG LYS 9 -12.234 5.370 6.661
14 HG3 LYS 9 1HG LYS 9 -10.936 5.230 5.472
15 HD2 LYS 9 2HD LYS 9 -12.336 7.788 6.236
16 HD3 LYS 9 1HD LYS 9 -10.756 7.278 6.826
17 HE2 LYS 9 2HE LYS 9 -11.483 7.839 3.948
18 HE3 LYS 9 1HE LYS 9 -10.546 8.891 5.006
19 HZ1 LYS 9 3HZ LYS 9 -9.754 6.227 3.959
20 HZ2 LYS 9 1HZ LYS 9 -8.915 7.017 5.203
21 HZ3 LYS 9 2HZ LYS 9 -9.016 7.719 3.662
22 H CYS 10 H CYS 10 -12.190 3.804 1.905
23 HA CYS 10 HA CYS 10 -10.219 1.878 2.464
24 HB2 CYS 10 2HB CYS 10 -11.143 2.478 0.191
25 HB3 CYS 10 1HB CYS 10 -10.130 3.916 0.233
26 H GLY 11 H GLY 11 -8.229 2.027 3.250
27 HA2 GLY 11 2HA GLY 11 -7.170 4.472 4.248
28 HA3 GLY 11 1HA GLY 11 -6.324 2.933 4.159
29 H ALA 12 H ALA 12 -7.113 3.040 1.145
30 HA ALA 12 HA ALA 12 -4.760 4.614 0.361
31 HB1 ALA 12 3HB ALA 12 -4.746 2.243 -0.283
32 HB2 ALA 12 1HB ALA 12 -4.764 3.301 -1.695
33 HB3 ALA 12 2HB ALA 12 -6.241 2.485 -1.185
34 H CYS 13 H CYS 13 -8.097 3.932 -0.644
35 HA CYS 13 HA CYS 13 -8.146 6.267 -2.372
36 HB2 CYS 13 2HB CYS 13 -10.423 4.434 -1.587
37 HB3 CYS 13 1HB CYS 13 -10.400 5.572 -2.928
38 H GLU 14 H GLU 14 -10.184 7.665 -2.153
39 HA GLU 14 HA GLU 14 -10.847 8.140 0.678
40 HB2 GLU 14 2HB GLU 14 -11.241 9.889 -1.765
41 HB3 GLU 14 1HB GLU 14 -11.824 10.289 -0.156
42 HG2 GLU 14 2HG GLU 14 -9.598 10.436 0.689
43 HG3 GLU 14 1HG GLU 14 -8.932 9.818 -0.821
44 H LYS 15 H LYS 15 -11.675 5.981 -1.071
45 HA LYS 15 HA LYS 15 -14.520 6.479 -1.523
46 HB2 LYS 15 2HB LYS 15 -12.795 4.119 -2.308
47 HB3 LYS 15 1HB LYS 15 -14.474 4.364 -2.771
48 HG2 LYS 15 2HG LYS 15 -13.889 6.278 -4.096
49 HG3 LYS 15 1HG LYS 15 -12.220 6.207 -3.530
50 HD2 LYS 15 2HD LYS 15 -11.943 4.029 -4.597
51 HD3 LYS 15 1HD LYS 15 -13.619 4.075 -5.145
52 HE2 LYS 15 2HE LYS 15 -11.507 6.088 -5.903
53 HE3 LYS 15 1HE LYS 15 -11.982 4.710 -6.895
54 HZ1 LYS 15 3HZ LYS 15 -14.159 5.593 -7.128
55 HZ2 LYS 15 1HZ LYS 15 -13.074 6.837 -7.503
56 HZ3 LYS 15 2HZ LYS 15 -13.863 6.825 -6.004
57 H THR 16 H THR 16 -15.958 4.604 -0.983
58 HA THR 16 HA THR 16 -15.602 3.997 1.808
59 HB THR 16 HB THR 16 -17.873 3.181 0.037
60 HG1 THR 16 HG1 THR 16 -17.487 5.483 -0.044
61 HG21 THR 16 3HG2 THR 16 -17.720 3.677 3.008
62 HG22 THR 16 1HG2 THR 16 -17.836 2.101 2.226
63 HG23 THR 16 2HG2 THR 16 -19.177 3.240 2.115
64 H VAL 17 H VAL 17 -15.118 2.099 2.681
65 HA VAL 17 HA VAL 17 -14.786 -0.214 0.894
66 HB VAL 17 HB VAL 17 -13.369 0.597 3.414
67 HG11 VAL 17 1HG1 VAL 17 -12.355 -1.634 3.553
68 HG12 VAL 17 2HG1 VAL 17 -13.422 -2.199 2.266
69 HG13 VAL 17 3HG1 VAL 17 -14.097 -1.708 3.820
70 HG21 VAL 17 3HG2 VAL 17 -11.397 0.011 2.073
71 HG22 VAL 17 1HG2 VAL 17 -12.393 1.253 1.316
72 HG23 VAL 17 2HG2 VAL 17 -12.466 -0.410 0.733
73 H TYR 18 H TYR 18 -16.113 -1.873 1.130
74 HA TYR 18 HA TYR 18 -17.750 -2.017 3.569
75 HD1 TYR 18 HD1 TYR 18 -20.608 -1.322 2.786
76 HD2 TYR 18 HD2 TYR 18 -17.985 -1.453 -0.560
77 HE1 TYR 18 HE1 TYR 18 -21.649 0.716 1.896
78 HE2 TYR 18 HE2 TYR 18 -19.016 0.591 -1.455
79 HH TYR 18 HH TYR 18 -20.943 2.618 0.357
80 HB2 TYR 18 2HB TYR 18 -18.235 -3.374 0.901
81 HB3 TYR 18 1HB TYR 18 -19.333 -3.331 2.276
82 H HIS 19 H HIS 19 -18.374 -4.548 3.870
83 HA HIS 19 HA HIS 19 -15.876 -5.847 4.445
84 HD1 HIS 19 HD1 HIS 19 -16.506 -5.731 7.310
85 HD2 HIS 19 HD2 HIS 19 -20.298 -5.525 5.614
86 HE1 HIS 19 HE1 HIS 19 -17.873 -4.322 8.890
87 HE2 HIS 19 HE2 HIS 19 -20.091 -4.023 7.726
88 HB2 HIS 19 2HB HIS 19 -18.571 -7.198 4.469
89 HB3 HIS 19 1HB HIS 19 -17.145 -7.594 5.424
90 H ALA 20 H ALA 20 -17.860 -5.562 1.783
91 HA ALA 20 HA ALA 20 -17.771 -8.022 0.531
92 HB1 ALA 20 3HB ALA 20 -18.160 -6.776 -1.546
93 HB2 ALA 20 1HB ALA 20 -17.720 -5.277 -0.723
94 HB3 ALA 20 2HB ALA 20 -19.164 -6.167 -0.230
95 H GLU 21 H GLU 21 -15.619 -5.229 0.057
96 HA GLU 21 HA GLU 21 -13.554 -7.063 -0.981
97 HB2 GLU 21 2HB GLU 21 -12.640 -5.156 -2.216
98 HB3 GLU 21 1HB GLU 21 -14.316 -5.433 -2.652
99 HG2 GLU 21 2HG GLU 21 -13.424 -3.320 -0.697
100 HG3 GLU 21 1HG GLU 21 -13.648 -3.042 -2.418
101 H GLU 22 H GLU 22 -14.036 -6.690 1.746
102 HA GLU 22 HA GLU 22 -12.358 -4.605 2.812
103 HB2 GLU 22 2HB GLU 22 -14.468 -5.229 3.896
104 HB3 GLU 22 1HB GLU 22 -13.856 -6.850 4.181
105 HG2 GLU 22 2HG GLU 22 -11.982 -5.656 5.494
106 HG3 GLU 22 1HG GLU 22 -13.086 -4.279 5.492
107 H ILE 23 H ILE 23 -10.224 -4.822 3.001
108 HA ILE 23 HA ILE 23 -9.311 -7.261 4.377
109 HB ILE 23 HB ILE 23 -7.732 -5.676 2.329
110 HG12 ILE 23 2HG1 ILE 23 -8.251 -8.634 2.320
111 HG13 ILE 23 1HG1 ILE 23 -9.424 -7.518 1.616
112 HG21 ILE 23 1HG2 ILE 23 -6.326 -6.263 4.219
113 HG22 ILE 23 2HG2 ILE 23 -5.910 -7.258 2.822
114 HG23 ILE 23 3HG2 ILE 23 -6.876 -7.938 4.132
115 HD11 ILE 23 3HD1 ILE 23 -7.684 -6.700 0.094
116 HD12 ILE 23 1HD1 ILE 23 -7.958 -8.433 -0.083
117 HD13 ILE 23 2HD1 ILE 23 -6.545 -7.847 0.794
118 H GLN 24 H GLN 24 -8.686 -6.770 6.383
119 HA GLN 24 HA GLN 24 -7.964 -3.986 6.949
120 HB2 GLN 24 2HB GLN 24 -8.847 -6.189 8.815
121 HB3 GLN 24 1HB GLN 24 -8.397 -4.568 9.323
122 HG2 GLN 24 2HG GLN 24 -10.226 -3.674 7.910
123 HG3 GLN 24 1HG GLN 24 -10.717 -5.333 7.572
124 HE21 GLN 24 1HE2 GLN 24 -10.015 -6.218 10.288
125 HE22 GLN 24 2HE2 GLN 24 -11.294 -5.632 11.299
126 H CYS 25 H CYS 25 -5.902 -3.535 7.096
127 HA CYS 25 HA CYS 25 -4.058 -5.628 8.033
128 HG CYS 25 HG CYS 25 -1.290 -5.716 6.323
129 HB2 CYS 25 2HB CYS 25 -3.633 -4.744 5.743
130 HB3 CYS 25 1HB CYS 25 -3.421 -3.138 6.430
131 H ASN 26 H ASN 26 -3.630 -5.414 10.102
132 HA ASN 26 HA ASN 26 -2.956 -4.578 12.093
133 HB2 ASN 26 2HB ASN 26 -1.182 -3.404 10.924
134 HB3 ASN 26 1HB ASN 26 -2.283 -2.104 10.486
135 HD21 ASN 26 1HD2 ASN 26 -0.941 -0.591 11.480
136 HD22 ASN 26 2HD2 ASN 26 -0.865 -0.425 13.196
137 H GLY 27 H GLY 27 -4.264 -1.595 10.646
138 HA2 GLY 27 2HA GLY 27 -6.658 -1.823 12.283
139 HA3 GLY 27 1HA GLY 27 -5.579 -0.499 12.696
140 H ARG 28 H ARG 28 -5.674 -1.412 9.390
141 HA ARG 28 HA ARG 28 -7.604 0.718 8.797
142 HE ARG 28 HE ARG 28 -8.821 1.821 6.431
143 HB2 ARG 28 2HB ARG 28 -5.379 1.690 8.637
144 HB3 ARG 28 1HB ARG 28 -4.877 0.426 7.530
145 HG2 ARG 28 2HG ARG 28 -5.304 2.381 6.252
146 HG3 ARG 28 1HG ARG 28 -6.619 1.247 5.938
147 HD2 ARG 28 2HD ARG 28 -6.907 3.324 8.071
148 HD3 ARG 28 1HD ARG 28 -7.138 3.762 6.381
149 HH11 ARG 28 1HH1 ARG 28 -8.184 4.054 9.051
150 HH12 ARG 28 2HH1 ARG 28 -9.755 3.862 9.771
151 HH21 ARG 28 1HH2 ARG 28 -10.887 1.553 7.382
152 HH22 ARG 28 2HH2 ARG 28 -11.275 2.403 8.855
153 H SER 29 H SER 29 -9.014 0.179 7.340
154 HA SER 29 HA SER 29 -8.794 -2.357 5.967
155 HG SER 29 HG SER 29 -11.717 -0.397 7.537
156 HB2 SER 29 2HB SER 29 -11.190 -1.404 5.231
157 HB3 SER 29 1HB SER 29 -10.931 -2.208 6.777
158 H PHE 30 H PHE 30 -8.536 -2.609 3.830
159 HA PHE 30 HA PHE 30 -8.520 -0.215 2.105
160 HD1 PHE 30 HD2 PHE 30 -5.971 0.996 1.794
161 HD2 PHE 30 HD1 PHE 30 -5.483 -2.685 3.871
162 HE1 PHE 30 HE2 PHE 30 -4.297 2.045 3.255
163 HE2 PHE 30 HE1 PHE 30 -3.806 -1.641 5.335
164 HZ PHE 30 HZ PHE 30 -3.211 0.728 5.029
165 HB2 PHE 30 2HB PHE 30 -6.695 -2.623 1.864
166 HB3 PHE 30 1HB PHE 30 -6.684 -1.200 0.831
167 H HIS 31 H HIS 31 -8.932 -0.779 -0.209
168 HA HIS 31 HA HIS 31 -10.961 -2.781 -0.530
169 HD2 HIS 31 HD2 HIS 31 -13.064 -1.523 -1.113
170 HE1 HIS 31 HE1 HIS 31 -12.387 2.463 -2.319
171 HE2 HIS 31 HE2 HIS 31 -14.100 0.833 -1.419
172 HB2 HIS 31 2HB HIS 31 -9.426 -1.152 -2.576
173 HB3 HIS 31 1HB HIS 31 -10.683 -2.304 -3.003
174 H LYS 32 H LYS 32 -10.765 -4.713 -1.818
175 HA LYS 32 HA LYS 32 -8.564 -6.315 -1.467
176 HB2 LYS 32 2HB LYS 32 -10.807 -7.024 -2.327
177 HB3 LYS 32 1HB LYS 32 -10.359 -6.378 -3.898
178 HG2 LYS 32 2HG LYS 32 -8.464 -7.962 -3.966
179 HG3 LYS 32 1HG LYS 32 -9.033 -8.656 -2.445
180 HD2 LYS 32 2HD LYS 32 -11.194 -9.170 -3.536
181 HD3 LYS 32 1HD LYS 32 -10.542 -8.565 -5.060
182 HE2 LYS 32 2HE LYS 32 -10.361 -10.946 -5.061
183 HE3 LYS 32 1HE LYS 32 -8.741 -10.270 -4.890
184 HZ1 LYS 32 3HZ LYS 32 -8.792 -10.743 -2.547
185 HZ2 LYS 32 1HZ LYS 32 -9.170 -12.159 -3.397
186 HZ3 LYS 32 2HZ LYS 32 -10.399 -11.272 -2.636
187 H THR 33 H THR 33 -9.136 -3.951 -3.989
188 HA THR 33 HA THR 33 -6.809 -4.681 -5.524
189 HB THR 33 HB THR 33 -7.428 -2.554 -6.787
190 HG1 THR 33 HG1 THR 33 -8.650 -1.521 -5.182
191 HG21 THR 33 3HG2 THR 33 -9.389 -3.616 -7.859
192 HG22 THR 33 1HG2 THR 33 -9.468 -4.772 -6.533
193 HG23 THR 33 2HG2 THR 33 -8.066 -4.753 -7.604
194 H CYS 34 H CYS 34 -7.245 -2.927 -2.728
195 HA CYS 34 HA CYS 34 -5.033 -1.087 -3.344
196 HB2 CYS 34 2HB CYS 34 -7.138 -0.749 -1.206
197 HB3 CYS 34 1HB CYS 34 -5.989 0.460 -1.784
198 H PHE 35 H PHE 35 -5.427 -3.936 -2.012
199 HA PHE 35 HA PHE 35 -4.043 -3.449 0.489
200 HD1 PHE 35 HD2 PHE 35 -4.392 -4.496 2.576
201 HD2 PHE 35 HD1 PHE 35 -3.766 -7.863 0.050
202 HE1 PHE 35 HE2 PHE 35 -3.276 -5.671 4.424
203 HE2 PHE 35 HE1 PHE 35 -2.640 -9.038 1.895
204 HZ PHE 35 HZ PHE 35 -2.409 -7.937 4.081
205 HB2 PHE 35 2HB PHE 35 -5.843 -5.133 0.395
206 HB3 PHE 35 1HB PHE 35 -4.901 -6.054 -0.773
207 H HIS 36 H HIS 36 -3.221 -3.979 -2.725
208 HA HIS 36 HA HIS 36 -0.766 -5.368 -2.072
209 HD1 HIS 36 HD1 HIS 36 -3.468 -5.632 -5.844
210 HD2 HIS 36 HD2 HIS 36 -0.937 -2.396 -5.194
211 HE1 HIS 36 HE1 HIS 36 -4.183 -3.872 -7.483
212 HE2 HIS 36 HE2 HIS 36 -2.753 -1.872 -6.977
213 HB2 HIS 36 2HB HIS 36 -0.284 -5.347 -4.500
214 HB3 HIS 36 1HB HIS 36 -1.813 -6.110 -4.099
215 H CYS 37 H CYS 37 1.255 -4.378 -3.412
216 HA CYS 37 HA CYS 37 2.141 -2.621 -1.489
217 HB2 CYS 37 2HB CYS 37 3.531 -4.081 -2.980
218 HB3 CYS 37 1HB CYS 37 3.340 -2.865 -4.239
219 H MET 38 H MET 38 2.129 -0.592 -1.142
220 HA MET 38 HA MET 38 0.768 1.283 -2.804
221 HB2 MET 38 2HB MET 38 2.461 1.702 -0.334
222 HB3 MET 38 1HB MET 38 1.430 2.918 -1.074
223 HG2 MET 38 2HG MET 38 0.451 0.306 0.046
224 HG3 MET 38 1HG MET 38 0.440 1.839 0.918
225 HE1 MET 38 3HE MET 38 -3.337 1.137 0.060
226 HE2 MET 38 1HE MET 38 -2.169 1.411 1.353
227 HE3 MET 38 2HE MET 38 -2.098 -0.072 0.400
228 H ALA 39 H ALA 39 4.083 0.323 -2.360
229 HA ALA 39 HA ALA 39 5.156 2.845 -3.276
230 HB1 ALA 39 3HB ALA 39 6.314 1.622 -1.534
231 HB2 ALA 39 1HB ALA 39 7.341 1.794 -2.957
232 HB3 ALA 39 2HB ALA 39 6.547 0.254 -2.623
233 H CYS 40 H CYS 40 5.299 -0.528 -4.502
234 HA CYS 40 HA CYS 40 5.888 0.618 -7.131
235 HB2 CYS 40 2HB CYS 40 6.553 -1.647 -7.838
236 HB3 CYS 40 1HB CYS 40 7.488 -1.095 -6.460
237 H ARG 41 H ARG 41 4.442 -2.481 -6.680
238 HA ARG 41 HA ARG 41 1.764 -1.876 -6.475
239 HE ARG 41 HE ARG 41 0.437 0.818 -8.726
240 HB2 ARG 41 2HB ARG 41 2.331 -0.915 -8.853
241 HB3 ARG 41 1HB ARG 41 2.235 -2.601 -9.345
242 HG2 ARG 41 2HG ARG 41 0.114 -1.376 -9.657
243 HG3 ARG 41 1HG ARG 41 -0.034 -2.758 -8.570
244 HD2 ARG 41 2HD ARG 41 -1.236 -0.952 -7.583
245 HD3 ARG 41 1HD ARG 41 0.242 -1.178 -6.650
246 HH11 ARG 41 1HH1 ARG 41 -0.270 0.200 -5.341
247 HH12 ARG 41 2HH1 ARG 41 -0.172 1.871 -4.894
248 HH21 ARG 41 1HH2 ARG 41 0.573 3.007 -8.113
249 HH22 ARG 41 2HH2 ARG 41 0.301 3.459 -6.459
250 H LYS 42 H LYS 42 4.066 -3.820 -6.048
251 HA LYS 42 HA LYS 42 3.576 -6.347 -7.053
252 HB2 LYS 42 2HB LYS 42 5.507 -5.815 -5.680
253 HB3 LYS 42 1HB LYS 42 4.475 -5.481 -4.300
254 HG2 LYS 42 2HG LYS 42 5.276 -7.570 -3.804
255 HG3 LYS 42 1HG LYS 42 3.736 -7.949 -4.577
256 HD2 LYS 42 2HD LYS 42 4.855 -8.452 -6.659
257 HD3 LYS 42 1HD LYS 42 6.406 -7.938 -5.988
258 HE2 LYS 42 2HE LYS 42 6.220 -9.735 -4.295
259 HE3 LYS 42 1HE LYS 42 4.737 -10.282 -5.075
260 HZ1 LYS 42 3HZ LYS 42 7.439 -10.208 -6.303
261 HZ2 LYS 42 1HZ LYS 42 6.021 -10.688 -7.100
262 HZ3 LYS 42 2HZ LYS 42 6.612 -11.593 -5.793
263 H ALA 43 H ALA 43 2.022 -7.873 -6.718
264 HA ALA 43 HA ALA 43 -0.301 -7.125 -5.188
265 HB1 ALA 43 3HB ALA 43 0.303 -9.700 -6.648
266 HB2 ALA 43 1HB ALA 43 -0.535 -8.302 -7.323
267 HB3 ALA 43 2HB ALA 43 -1.265 -9.213 -6.002
268 H LEU 44 H LEU 44 0.197 -7.106 -3.033
269 HA LEU 44 HA LEU 44 1.676 -9.170 -1.751
270 HG LEU 44 HG LEU 44 2.163 -6.349 0.507
271 HB2 LEU 44 2HB LEU 44 0.088 -6.825 -0.801
272 HB3 LEU 44 1HB LEU 44 0.534 -8.071 0.350
273 HD11 LEU 44 1HD1 LEU 44 3.040 -8.634 0.575
274 HD12 LEU 44 2HD1 LEU 44 4.219 -7.497 -0.077
275 HD13 LEU 44 3HD1 LEU 44 3.332 -8.569 -1.162
276 HD21 LEU 44 3HD2 LEU 44 3.474 -5.575 -1.407
277 HD22 LEU 44 1HD2 LEU 44 1.757 -5.223 -1.592
278 HD23 LEU 44 2HD2 LEU 44 2.481 -6.565 -2.479
279 H ASP 45 H ASP 45 1.000 -10.748 -0.381
280 HA ASP 45 HA ASP 45 -1.832 -11.527 -0.583
281 HB2 ASP 45 2HB ASP 45 -0.049 -13.070 -1.590
282 HB3 ASP 45 1HB ASP 45 0.505 -13.347 0.058
283 H SER 46 H SER 46 -2.275 -13.064 1.543
284 HA SER 46 HA SER 46 -2.357 -11.183 3.620
285 HG SER 46 HG SER 46 -3.672 -14.701 2.870
286 HB2 SER 46 2HB SER 46 -3.056 -13.232 5.017
287 HB3 SER 46 1HB SER 46 -4.061 -12.798 3.634
288 H THR 47 H THR 47 0.013 -13.610 2.848
289 HA THR 47 HA THR 47 1.218 -13.373 5.501
290 HB THR 47 HB THR 47 0.807 -15.634 4.683
291 HG1 THR 47 HG1 THR 47 2.654 -15.276 6.021
292 HG21 THR 47 3HG2 THR 47 2.730 -14.934 2.464
293 HG22 THR 47 1HG2 THR 47 1.003 -15.245 2.288
294 HG23 THR 47 2HG2 THR 47 2.085 -16.541 2.793
295 H THR 48 H THR 48 1.716 -12.134 2.329
296 HA THR 48 HA THR 48 4.621 -12.078 2.667
297 HB THR 48 HB THR 48 4.595 -11.188 0.292
298 HG1 THR 48 HG1 THR 48 2.649 -11.543 -0.858
299 HG21 THR 48 3HG2 THR 48 4.186 -13.414 -0.676
300 HG22 THR 48 1HG2 THR 48 3.412 -13.915 0.827
301 HG23 THR 48 2HG2 THR 48 5.129 -13.511 0.812
302 H VAL 49 H VAL 49 1.954 -9.935 2.998
303 HA VAL 49 HA VAL 49 3.200 -7.526 2.231
304 HB VAL 49 HB VAL 49 0.902 -7.318 2.366
305 HG11 VAL 49 1HG1 VAL 49 -0.453 -7.967 4.320
306 HG12 VAL 49 2HG1 VAL 49 1.007 -8.529 5.136
307 HG13 VAL 49 3HG1 VAL 49 0.451 -9.333 3.667
308 HG21 VAL 49 3HG2 VAL 49 0.411 -5.684 4.120
309 HG22 VAL 49 1HG2 VAL 49 1.968 -5.376 3.351
310 HG23 VAL 49 2HG2 VAL 49 1.906 -6.124 4.946
311 H ALA 50 H ALA 50 4.662 -6.289 3.153
312 HA ALA 50 HA ALA 50 5.494 -6.885 5.900
313 HB1 ALA 50 3HB ALA 50 7.238 -6.865 4.166
314 HB2 ALA 50 1HB ALA 50 7.505 -5.619 5.384
315 HB3 ALA 50 2HB ALA 50 6.847 -5.182 3.806
316 H ALA 51 H ALA 51 4.348 -5.772 7.337
317 HA ALA 51 HA ALA 51 3.542 -3.035 6.763
318 HB1 ALA 51 3HB ALA 51 1.847 -4.581 7.620
319 HB2 ALA 51 1HB ALA 51 2.119 -3.238 8.729
320 HB3 ALA 51 2HB ALA 51 2.808 -4.822 9.078
321 H HIS 52 H HIS 52 4.096 -1.305 8.045
322 HA HIS 52 HA HIS 52 6.080 -1.729 10.162
323 HD1 HIS 52 HD1 HIS 52 9.296 -1.120 9.807
324 HD2 HIS 52 HD2 HIS 52 7.105 2.389 9.371
325 HE1 HIS 52 HE1 HIS 52 10.622 0.664 10.980
326 HE2 HIS 52 HE2 HIS 52 9.200 2.737 10.840
327 HB2 HIS 52 2HB HIS 52 7.373 -1.305 8.124
328 HB3 HIS 52 1HB HIS 52 6.425 0.138 7.798
329 H GLU 53 H GLU 53 4.465 -1.163 11.625
330 HA GLU 53 HA GLU 53 3.388 0.227 13.041
331 HB2 GLU 53 2HB GLU 53 5.026 2.310 11.606
332 HB3 GLU 53 1HB GLU 53 4.016 2.660 13.003
333 HG2 GLU 53 2HG GLU 53 5.321 1.275 14.412
334 HG3 GLU 53 1HG GLU 53 6.189 0.587 13.039
335 H SER 54 H SER 54 3.456 2.499 10.314
336 HA SER 54 HA SER 54 0.549 2.136 10.050
337 HG SER 54 HG SER 54 2.295 5.661 9.477
338 HB2 SER 54 2HB SER 54 0.489 4.616 9.484
339 HB3 SER 54 1HB SER 54 0.831 4.234 11.169
340 H GLU 55 H GLU 55 2.813 0.961 8.603
341 HA GLU 55 HA GLU 55 2.212 1.982 5.912
342 HB2 GLU 55 2HB GLU 55 4.933 1.052 6.834
343 HB3 GLU 55 1HB GLU 55 4.525 1.682 5.247
344 HG2 GLU 55 2HG GLU 55 4.001 3.859 6.288
345 HG3 GLU 55 1HG GLU 55 4.526 3.209 7.841
346 H ILE 56 H ILE 56 2.369 0.464 4.228
347 HA ILE 56 HA ILE 56 3.009 -2.307 4.869
348 HB ILE 56 HB ILE 56 0.849 -2.918 5.023
349 HG12 ILE 56 2HG1 ILE 56 0.850 -2.283 2.065
350 HG13 ILE 56 1HG1 ILE 56 1.356 -3.796 2.809
351 HG21 ILE 56 1HG2 ILE 56 0.090 -0.663 5.384
352 HG22 ILE 56 2HG2 ILE 56 -1.063 -1.532 4.370
353 HG23 ILE 56 3HG2 ILE 56 0.045 -0.364 3.646
354 HD11 ILE 56 3HD1 ILE 56 -0.936 -4.163 3.588
355 HD12 ILE 56 1HD1 ILE 56 -0.850 -4.004 1.834
356 HD13 ILE 56 2HD1 ILE 56 -1.431 -2.659 2.814
357 H TYR 57 H TYR 57 4.265 -3.121 3.319
358 HA TYR 57 HA TYR 57 3.928 -2.268 0.551
359 HD1 TYR 57 HD2 TYR 57 4.989 0.331 -0.220
360 HD2 TYR 57 HD1 TYR 57 6.463 -0.633 3.647
361 HE1 TYR 57 HE2 TYR 57 4.705 2.675 0.457
362 HE2 TYR 57 HE1 TYR 57 6.190 1.713 4.342
363 HH TYR 57 HH TYR 57 4.500 4.029 2.397
364 HB2 TYR 57 2HB TYR 57 6.656 -2.198 1.870
365 HB3 TYR 57 1HB TYR 57 6.273 -1.751 0.215
366 H CYS 58 H CYS 58 5.511 -3.551 -0.870
367 HA CYS 58 HA CYS 58 5.398 -6.321 -0.148
368 HB2 CYS 58 2HB CYS 58 6.294 -6.765 -2.306
369 HB3 CYS 58 1HB CYS 58 5.198 -5.405 -2.506
370 H LYS 59 H LYS 59 7.440 -7.679 -0.332
371 HA LYS 59 HA LYS 59 9.294 -6.843 1.630
372 HB2 LYS 59 2HB LYS 59 9.430 -9.082 -0.396
373 HB3 LYS 59 1HB LYS 59 10.602 -8.855 0.895
374 HG2 LYS 59 2HG LYS 59 8.873 -9.177 2.561
375 HG3 LYS 59 1HG LYS 59 7.657 -9.341 1.291
376 HD2 LYS 59 2HD LYS 59 8.714 -11.344 0.468
377 HD3 LYS 59 1HD LYS 59 10.062 -11.141 1.587
378 HE2 LYS 59 2HE LYS 59 7.191 -11.624 2.375
379 HE3 LYS 59 1HE LYS 59 8.457 -12.850 2.342
380 HZ1 LYS 59 3HZ LYS 59 8.242 -12.108 4.561
381 HZ2 LYS 59 1HZ LYS 59 8.289 -10.473 4.109
382 HZ3 LYS 59 2HZ LYS 59 9.683 -11.431 3.972
383 H VAL 60 H VAL 60 9.113 -6.205 -1.721
384 HA VAL 60 HA VAL 60 11.953 -5.993 -2.158
385 HB VAL 60 HB VAL 60 9.736 -4.961 -3.929
386 HG11 VAL 60 1HG1 VAL 60 11.946 -4.090 -4.460
387 HG12 VAL 60 2HG1 VAL 60 11.401 -5.210 -5.709
388 HG13 VAL 60 3HG1 VAL 60 12.593 -5.729 -4.515
389 HG21 VAL 60 3HG2 VAL 60 9.940 -7.093 -5.140
390 HG22 VAL 60 1HG2 VAL 60 9.359 -7.314 -3.489
391 HG23 VAL 60 2HG2 VAL 60 11.036 -7.681 -3.890
392 H CYS 61 H CYS 61 9.237 -3.670 -2.014
393 HA CYS 61 HA CYS 61 10.918 -1.382 -2.155
394 HB2 CYS 61 2HB CYS 61 8.082 -1.643 -1.162
395 HB3 CYS 61 1HB CYS 61 8.910 -0.119 -1.454
396 H TYR 62 H TYR 62 9.513 -3.205 0.521
397 HA TYR 62 HA TYR 62 10.283 -1.447 2.578
398 HD1 TYR 62 HD1 TYR 62 11.665 -4.486 4.698
399 HD2 TYR 62 HD2 TYR 62 8.197 -2.018 4.727
400 HE1 TYR 62 HE1 TYR 62 11.938 -4.137 7.115
401 HE2 TYR 62 HE2 TYR 62 8.466 -1.664 7.141
402 HH TYR 62 HH TYR 62 11.314 -2.511 8.816
403 HB2 TYR 62 2HB TYR 62 8.708 -3.411 2.814
404 HB3 TYR 62 1HB TYR 62 10.121 -4.463 2.803
405 H GLY 63 H GLY 63 11.934 -4.138 0.999
406 HA2 GLY 63 2HA GLY 63 14.244 -4.187 2.583
407 HA3 GLY 63 1HA GLY 63 14.136 -4.739 0.919
408 H ARG 64 H ARG 64 13.440 -2.209 -0.243
409 HA ARG 64 HA ARG 64 16.069 -1.121 -0.532
410 HE ARG 64 HE ARG 64 14.056 -2.346 -5.327
411 HB2 ARG 64 2HB ARG 64 13.451 0.052 -1.478
412 HB3 ARG 64 1HB ARG 64 15.051 0.511 -2.028
413 HG2 ARG 64 2HG ARG 64 15.338 -1.729 -2.989
414 HG3 ARG 64 1HG ARG 64 13.693 -2.134 -2.484
415 HD2 ARG 64 2HD ARG 64 12.951 -0.084 -3.781
416 HD3 ARG 64 1HD ARG 64 14.571 -0.050 -4.469
417 HH11 ARG 64 1HH1 ARG 64 11.509 -0.077 -4.540
418 HH12 ARG 64 2HH1 ARG 64 10.379 -0.727 -5.688
419 HH21 ARG 64 1HH2 ARG 64 12.592 -3.197 -6.888
420 HH22 ARG 64 2HH2 ARG 64 10.989 -2.524 -7.013
421 H ARG 65 H ARG 65 13.022 0.256 0.668
422 HA ARG 65 HA ARG 65 14.138 2.772 1.286
423 HE ARG 65 HE ARG 65 10.436 6.043 2.479
424 HB2 ARG 65 2HB ARG 65 11.722 2.261 0.822
425 HB3 ARG 65 1HB ARG 65 11.619 1.563 2.429
426 HG2 ARG 65 2HG ARG 65 12.168 3.714 3.419
427 HG3 ARG 65 1HG ARG 65 12.311 4.427 1.811
428 HD2 ARG 65 2HD ARG 65 9.958 3.860 1.373
429 HD3 ARG 65 1HD ARG 65 9.826 3.201 3.002
430 HH11 ARG 65 1HH1 ARG 65 8.695 3.535 4.173
431 HH12 ARG 65 2HH1 ARG 65 7.787 4.631 5.172
432 HH21 ARG 65 1HH2 ARG 65 9.233 7.520 3.776
433 HH22 ARG 65 2HH2 ARG 65 8.110 6.903 4.941
434 H TYR 66 H TYR 66 13.863 -0.184 3.107
435 HA TYR 66 HA TYR 66 14.978 1.212 5.446
436 HD1 TYR 66 HD1 TYR 66 13.441 1.259 7.995
437 HD2 TYR 66 HD2 TYR 66 11.290 0.094 4.513
438 HE1 TYR 66 HE1 TYR 66 11.649 2.829 8.585
439 HE2 TYR 66 HE2 TYR 66 9.484 1.660 5.100
440 HH TYR 66 HH TYR 66 8.592 2.856 6.996
441 HB2 TYR 66 2HB TYR 66 13.181 -1.210 5.306
442 HB3 TYR 66 1HB TYR 66 14.050 -0.747 6.768
Start of MODEL 15
1 H1 GLY 7 1H GLY 7 -18.394 0.886 6.841
2 HA2 GLY 7 2HA GLY 7 -18.742 3.176 5.034
3 HA3 GLY 7 1HA GLY 7 -19.219 3.339 6.720
4 H ALA 8 H ALA 8 -16.430 1.651 5.331
5 HA ALA 8 HA ALA 8 -14.705 3.247 7.098
6 HB1 ALA 8 3HB ALA 8 -13.031 1.518 6.729
7 HB2 ALA 8 1HB ALA 8 -14.082 0.722 5.558
8 HB3 ALA 8 2HB ALA 8 -14.549 0.792 7.258
9 H LYS 9 H LYS 9 -12.479 3.751 6.103
10 HA LYS 9 HA LYS 9 -12.833 4.487 3.286
11 HB2 LYS 9 2HB LYS 9 -11.455 6.440 3.599
12 HB3 LYS 9 1HB LYS 9 -12.761 6.479 4.770
13 HG2 LYS 9 2HG LYS 9 -11.007 7.132 6.064
14 HG3 LYS 9 1HG LYS 9 -10.970 5.393 6.342
15 HD2 LYS 9 2HD LYS 9 -8.726 6.226 5.931
16 HD3 LYS 9 1HD LYS 9 -9.234 5.163 4.619
17 HE2 LYS 9 2HE LYS 9 -9.836 7.179 3.290
18 HE3 LYS 9 1HE LYS 9 -9.183 8.181 4.588
19 HZ1 LYS 9 3HZ LYS 9 -7.681 6.220 2.940
20 HZ2 LYS 9 1HZ LYS 9 -7.025 7.061 4.261
21 HZ3 LYS 9 2HZ LYS 9 -7.540 7.906 2.881
22 H CYS 10 H CYS 10 -11.139 4.120 1.924
23 HA CYS 10 HA CYS 10 -9.611 1.820 2.557
24 HB2 CYS 10 2HB CYS 10 -10.538 2.404 0.320
25 HB3 CYS 10 1HB CYS 10 -9.364 3.702 0.212
26 H GLY 11 H GLY 11 -7.653 1.673 3.414
27 HA2 GLY 11 2HA GLY 11 -6.074 3.878 4.180
28 HA3 GLY 11 1HA GLY 11 -5.523 2.211 4.098
29 H ALA 12 H ALA 12 -6.496 2.469 1.117
30 HA ALA 12 HA ALA 12 -3.991 3.665 0.130
31 HB1 ALA 12 3HB ALA 12 -4.327 1.324 -0.480
32 HB2 ALA 12 1HB ALA 12 -4.362 2.361 -1.905
33 HB3 ALA 12 2HB ALA 12 -5.867 1.734 -1.233
34 H CYS 13 H CYS 13 -7.468 3.433 -0.608
35 HA CYS 13 HA CYS 13 -7.368 5.649 -2.459
36 HB2 CYS 13 2HB CYS 13 -9.721 4.181 -1.241
37 HB3 CYS 13 1HB CYS 13 -9.839 5.387 -2.513
38 H GLU 14 H GLU 14 -9.085 7.382 -2.153
39 HA GLU 14 HA GLU 14 -9.355 8.234 0.643
40 HB2 GLU 14 2HB GLU 14 -9.761 10.425 -0.159
41 HB3 GLU 14 1HB GLU 14 -8.415 9.820 -1.115
42 HG2 GLU 14 2HG GLU 14 -11.279 9.824 -1.972
43 HG3 GLU 14 1HG GLU 14 -10.100 11.048 -2.438
44 H LYS 15 H LYS 15 -10.717 6.250 -1.324
45 HA LYS 15 HA LYS 15 -13.482 7.147 -1.250
46 HB2 LYS 15 2HB LYS 15 -12.499 4.511 -2.330
47 HB3 LYS 15 1HB LYS 15 -13.933 5.417 -2.795
48 HG2 LYS 15 2HG LYS 15 -12.498 7.135 -3.806
49 HG3 LYS 15 1HG LYS 15 -11.077 6.177 -3.384
50 HD2 LYS 15 2HD LYS 15 -12.134 4.299 -4.733
51 HD3 LYS 15 1HD LYS 15 -13.269 5.508 -5.337
52 HE2 LYS 15 2HE LYS 15 -10.269 5.528 -5.630
53 HE3 LYS 15 1HE LYS 15 -11.456 5.259 -6.903
54 HZ1 LYS 15 3HZ LYS 15 -10.605 7.515 -6.965
55 HZ2 LYS 15 1HZ LYS 15 -11.101 7.782 -5.364
56 HZ3 LYS 15 2HZ LYS 15 -12.256 7.523 -6.581
57 H THR 16 H THR 16 -14.934 4.953 -0.943
58 HA THR 16 HA THR 16 -14.458 4.322 1.867
59 HB THR 16 HB THR 16 -16.946 3.394 1.384
60 HG1 THR 16 HG1 THR 16 -17.055 4.076 -0.759
61 HG21 THR 16 3HG2 THR 16 -17.764 5.498 2.341
62 HG22 THR 16 1HG2 THR 16 -16.215 6.262 1.982
63 HG23 THR 16 2HG2 THR 16 -16.300 4.953 3.160
64 H VAL 17 H VAL 17 -14.457 2.306 2.689
65 HA VAL 17 HA VAL 17 -14.275 0.070 0.782
66 HB VAL 17 HB VAL 17 -13.127 0.400 3.558
67 HG11 VAL 17 1HG1 VAL 17 -13.045 -2.037 1.785
68 HG12 VAL 17 2HG1 VAL 17 -13.933 -1.891 3.300
69 HG13 VAL 17 3HG1 VAL 17 -12.171 -1.837 3.304
70 HG21 VAL 17 3HG2 VAL 17 -11.830 -0.013 0.878
71 HG22 VAL 17 1HG2 VAL 17 -10.987 0.094 2.423
72 HG23 VAL 17 2HG2 VAL 17 -11.865 1.491 1.800
73 H TYR 18 H TYR 18 -15.520 -1.728 1.044
74 HA TYR 18 HA TYR 18 -17.599 -1.624 3.136
75 HD1 TYR 18 HD1 TYR 18 -17.260 0.283 0.132
76 HD2 TYR 18 HD2 TYR 18 -20.842 -1.268 1.820
77 HE1 TYR 18 HE1 TYR 18 -18.327 2.482 -0.127
78 HE2 TYR 18 HE2 TYR 18 -21.917 0.924 1.568
79 HH TYR 18 HH TYR 18 -21.402 3.198 1.311
80 HB2 TYR 18 2HB TYR 18 -17.888 -2.273 0.197
81 HB3 TYR 18 1HB TYR 18 -19.100 -2.721 1.389
82 H HIS 19 H HIS 19 -18.740 -3.906 3.197
83 HA HIS 19 HA HIS 19 -16.771 -5.843 3.829
84 HD1 HIS 19 HD1 HIS 19 -20.202 -8.727 3.261
85 HD2 HIS 19 HD2 HIS 19 -20.804 -4.691 2.445
86 HE1 HIS 19 HE1 HIS 19 -22.281 -8.622 1.842
87 HE2 HIS 19 HE2 HIS 19 -22.713 -6.158 1.501
88 HB2 HIS 19 2HB HIS 19 -18.536 -7.314 4.389
89 HB3 HIS 19 1HB HIS 19 -19.130 -5.710 4.784
90 H ALA 20 H ALA 20 -18.025 -4.852 0.904
91 HA ALA 20 HA ALA 20 -18.089 -7.132 -0.683
92 HB1 ALA 20 3HB ALA 20 -17.196 -4.350 -1.435
93 HB2 ALA 20 1HB ALA 20 -18.858 -4.942 -1.443
94 HB3 ALA 20 2HB ALA 20 -17.674 -5.620 -2.562
95 H GLU 21 H GLU 21 -15.335 -4.996 0.109
96 HA GLU 21 HA GLU 21 -13.543 -7.190 -0.518
97 HB2 GLU 21 2HB GLU 21 -12.165 -5.896 -2.032
98 HB3 GLU 21 1HB GLU 21 -13.787 -6.047 -2.671
99 HG2 GLU 21 2HG GLU 21 -14.248 -3.733 -1.974
100 HG3 GLU 21 1HG GLU 21 -12.613 -3.621 -1.326
101 H GLU 22 H GLU 22 -14.062 -6.207 1.986
102 HA GLU 22 HA GLU 22 -11.937 -4.320 2.609
103 HB2 GLU 22 2HB GLU 22 -14.060 -3.956 3.731
104 HB3 GLU 22 1HB GLU 22 -14.012 -5.582 4.404
105 HG2 GLU 22 2HG GLU 22 -11.986 -4.993 5.654
106 HG3 GLU 22 1HG GLU 22 -12.066 -3.360 5.000
107 H ILE 23 H ILE 23 -9.979 -5.031 2.921
108 HA ILE 23 HA ILE 23 -9.639 -7.432 4.591
109 HB ILE 23 HB ILE 23 -7.732 -6.137 2.631
110 HG12 ILE 23 2HG1 ILE 23 -8.451 -9.043 2.818
111 HG13 ILE 23 1HG1 ILE 23 -9.501 -7.917 1.952
112 HG21 ILE 23 1HG2 ILE 23 -6.511 -6.661 4.683
113 HG22 ILE 23 2HG2 ILE 23 -6.037 -7.741 3.372
114 HG23 ILE 23 3HG2 ILE 23 -7.126 -8.313 4.636
115 HD11 ILE 23 3HD1 ILE 23 -7.609 -7.341 0.495
116 HD12 ILE 23 1HD1 ILE 23 -8.008 -9.060 0.433
117 HD13 ILE 23 2HD1 ILE 23 -6.609 -8.511 1.358
118 H GLN 24 H GLN 24 -9.217 -6.979 6.645
119 HA GLN 24 HA GLN 24 -8.113 -4.369 7.330
120 HB2 GLN 24 2HB GLN 24 -9.343 -6.558 9.009
121 HB3 GLN 24 1HB GLN 24 -8.593 -5.123 9.696
122 HG2 GLN 24 2HG GLN 24 -10.202 -3.704 8.570
123 HG3 GLN 24 1HG GLN 24 -10.927 -5.111 7.794
124 HE21 GLN 24 1HE2 GLN 24 -10.504 -3.383 10.788
125 HE22 GLN 24 2HE2 GLN 24 -11.796 -4.163 11.642
126 H CYS 25 H CYS 25 -5.997 -4.336 7.065
127 HA CYS 25 HA CYS 25 -4.411 -6.550 8.192
128 HG CYS 25 HG CYS 25 -2.017 -7.532 6.602
129 HB2 CYS 25 2HB CYS 25 -4.162 -6.193 5.734
130 HB3 CYS 25 1HB CYS 25 -3.584 -4.565 6.064
131 H ASN 26 H ASN 26 -3.083 -6.113 9.808
132 HA ASN 26 HA ASN 26 -1.959 -5.019 11.449
133 HB2 ASN 26 2HB ASN 26 -0.798 -3.802 9.680
134 HB3 ASN 26 1HB ASN 26 -2.128 -2.656 9.566
135 HD21 ASN 26 1HD2 ASN 26 -0.910 -0.891 10.033
136 HD22 ASN 26 2HD2 ASN 26 -0.231 -0.584 11.597
137 H GLY 27 H GLY 27 -4.204 -2.586 10.135
138 HA2 GLY 27 2HA GLY 27 -6.161 -2.859 12.104
139 HA3 GLY 27 1HA GLY 27 -5.046 -1.612 12.646
140 H ARG 28 H ARG 28 -5.654 -2.121 9.245
141 HA ARG 28 HA ARG 28 -7.408 0.232 9.183
142 HE ARG 28 HE ARG 28 -2.752 2.662 9.998
143 HB2 ARG 28 2HB ARG 28 -4.915 -0.171 7.520
144 HB3 ARG 28 1HB ARG 28 -6.182 0.957 7.078
145 HG2 ARG 28 2HG ARG 28 -4.573 2.276 8.112
146 HG3 ARG 28 1HG ARG 28 -5.784 2.021 9.369
147 HD2 ARG 28 2HD ARG 28 -4.419 0.243 10.331
148 HD3 ARG 28 1HD ARG 28 -3.221 0.468 9.059
149 HH11 ARG 28 1HH1 ARG 28 -4.662 0.505 11.990
150 HH12 ARG 28 2HH1 ARG 28 -4.163 1.226 13.485
151 HH21 ARG 28 1HH2 ARG 28 -2.126 3.642 11.968
152 HH22 ARG 28 2HH2 ARG 28 -2.746 3.026 13.473
153 H SER 29 H SER 29 -8.845 0.283 7.430
154 HA SER 29 HA SER 29 -9.372 -2.291 6.218
155 HG SER 29 HG SER 29 -12.151 -1.692 7.274
156 HB2 SER 29 2HB SER 29 -10.876 0.331 6.028
157 HB3 SER 29 1HB SER 29 -11.430 -1.212 5.380
158 H PHE 30 H PHE 30 -8.616 -2.856 4.305
159 HA PHE 30 HA PHE 30 -8.042 -0.747 2.317
160 HD1 PHE 30 HD1 PHE 30 -5.516 0.145 2.504
161 HD2 PHE 30 HD2 PHE 30 -5.546 -3.543 4.620
162 HE1 PHE 30 HE1 PHE 30 -3.944 1.081 4.149
163 HE2 PHE 30 HE2 PHE 30 -3.972 -2.617 6.266
164 HZ PHE 30 HZ PHE 30 -3.174 -0.300 6.034
165 HB2 PHE 30 2HB PHE 30 -6.612 -3.404 2.588
166 HB3 PHE 30 1HB PHE 30 -6.221 -2.109 1.465
167 H HIS 31 H HIS 31 -8.750 -1.135 0.214
168 HA HIS 31 HA HIS 31 -10.718 -3.114 -0.272
169 HD2 HIS 31 HD2 HIS 31 -12.663 -1.823 -0.661
170 HE1 HIS 31 HE1 HIS 31 -12.170 2.071 -2.203
171 HE2 HIS 31 HE2 HIS 31 -13.785 0.472 -1.114
172 HB2 HIS 31 2HB HIS 31 -9.052 -1.429 -2.151
173 HB3 HIS 31 1HB HIS 31 -10.252 -2.577 -2.730
174 H LYS 32 H LYS 32 -10.536 -5.006 -1.643
175 HA LYS 32 HA LYS 32 -8.205 -6.536 -1.125
176 HB2 LYS 32 2HB LYS 32 -10.551 -7.429 -1.537
177 HB3 LYS 32 1HB LYS 32 -10.262 -7.154 -3.249
178 HG2 LYS 32 2HG LYS 32 -8.432 -8.717 -3.242
179 HG3 LYS 32 1HG LYS 32 -8.559 -8.913 -1.491
180 HD2 LYS 32 2HD LYS 32 -10.860 -9.792 -1.814
181 HD3 LYS 32 1HD LYS 32 -10.606 -9.712 -3.557
182 HE2 LYS 32 2HE LYS 32 -10.209 -11.967 -2.774
183 HE3 LYS 32 1HE LYS 32 -8.701 -11.252 -3.334
184 HZ1 LYS 32 3HZ LYS 32 -9.502 -11.292 -0.478
185 HZ2 LYS 32 1HZ LYS 32 -7.971 -10.942 -1.124
186 HZ3 LYS 32 2HZ LYS 32 -8.581 -12.524 -1.193
187 H THR 33 H THR 33 -9.232 -4.489 -3.718
188 HA THR 33 HA THR 33 -7.086 -5.235 -5.506
189 HB THR 33 HB THR 33 -9.294 -4.414 -6.306
190 HG1 THR 33 HG1 THR 33 -7.468 -4.260 -7.675
191 HG21 THR 33 3HG2 THR 33 -8.332 -1.754 -5.259
192 HG22 THR 33 1HG2 THR 33 -9.712 -2.674 -4.658
193 HG23 THR 33 2HG2 THR 33 -9.745 -1.998 -6.288
194 H CYS 34 H CYS 34 -7.349 -3.389 -2.751
195 HA CYS 34 HA CYS 34 -5.031 -1.734 -3.504
196 HB2 CYS 34 2HB CYS 34 -7.070 -1.219 -1.337
197 HB3 CYS 34 1HB CYS 34 -5.743 -0.152 -1.800
198 H PHE 35 H PHE 35 -5.695 -4.496 -1.983
199 HA PHE 35 HA PHE 35 -4.247 -4.131 0.450
200 HD1 PHE 35 HD1 PHE 35 -4.646 -5.320 2.467
201 HD2 PHE 35 HD2 PHE 35 -3.681 -8.459 -0.238
202 HE1 PHE 35 HE1 PHE 35 -3.465 -6.501 4.266
203 HE2 PHE 35 HE2 PHE 35 -2.504 -9.650 1.564
204 HZ PHE 35 HZ PHE 35 -2.397 -8.660 3.814
205 HB2 PHE 35 2HB PHE 35 -5.966 -5.883 0.221
206 HB3 PHE 35 1HB PHE 35 -4.964 -6.700 -0.980
207 H HIS 36 H HIS 36 -3.352 -4.445 -2.757
208 HA HIS 36 HA HIS 36 -0.792 -5.581 -2.034
209 HD1 HIS 36 HD1 HIS 36 -3.718 -6.530 -5.042
210 HD2 HIS 36 HD2 HIS 36 -1.463 -3.136 -5.888
211 HE1 HIS 36 HE1 HIS 36 -4.931 -5.357 -6.903
212 HE2 HIS 36 HE2 HIS 36 -3.505 -3.364 -7.474
213 HB2 HIS 36 2HB HIS 36 -0.299 -5.419 -4.526
214 HB3 HIS 36 1HB HIS 36 -1.486 -6.591 -3.986
215 H CYS 37 H CYS 37 1.111 -4.453 -3.361
216 HA CYS 37 HA CYS 37 1.881 -2.741 -1.412
217 HB2 CYS 37 2HB CYS 37 3.322 -3.960 -3.006
218 HB3 CYS 37 1HB CYS 37 2.954 -2.740 -4.217
219 H MET 38 H MET 38 1.676 -0.747 -0.867
220 HA MET 38 HA MET 38 0.224 1.184 -2.400
221 HB2 MET 38 2HB MET 38 1.903 1.639 0.071
222 HB3 MET 38 1HB MET 38 0.635 2.685 -0.549
223 HG2 MET 38 2HG MET 38 0.277 -0.080 0.578
224 HG3 MET 38 1HG MET 38 -0.129 1.436 1.377
225 HE1 MET 38 3HE MET 38 -2.539 0.412 1.868
226 HE2 MET 38 1HE MET 38 -2.121 -1.066 0.998
227 HE3 MET 38 2HE MET 38 -3.613 -0.207 0.612
228 H ALA 39 H ALA 39 3.545 0.276 -2.118
229 HA ALA 39 HA ALA 39 4.551 2.902 -2.828
230 HB1 ALA 39 3HB ALA 39 6.051 0.321 -2.458
231 HB2 ALA 39 1HB ALA 39 5.773 1.537 -1.211
232 HB3 ALA 39 2HB ALA 39 6.758 1.928 -2.623
233 H CYS 40 H CYS 40 4.523 -0.356 -4.306
234 HA CYS 40 HA CYS 40 4.848 1.037 -6.869
235 HB2 CYS 40 2HB CYS 40 5.670 -1.077 -7.836
236 HB3 CYS 40 1HB CYS 40 6.688 -0.525 -6.518
237 H ARG 41 H ARG 41 3.775 -2.239 -6.582
238 HA ARG 41 HA ARG 41 1.100 -1.939 -5.970
239 HE ARG 41 HE ARG 41 -2.908 -0.503 -7.272
240 HB2 ARG 41 2HB ARG 41 1.360 -0.764 -8.375
241 HB3 ARG 41 1HB ARG 41 1.105 -2.424 -8.899
242 HG2 ARG 41 2HG ARG 41 -0.988 -1.159 -8.805
243 HG3 ARG 41 1HG ARG 41 -0.990 -2.516 -7.680
244 HD2 ARG 41 2HD ARG 41 -0.387 -0.967 -5.853
245 HD3 ARG 41 1HD ARG 41 -0.465 0.376 -6.990
246 HH11 ARG 41 1HH1 ARG 41 -1.069 -0.391 -4.283
247 HH12 ARG 41 2HH1 ARG 41 -2.469 -0.150 -3.286
248 HH21 ARG 41 1HH2 ARG 41 -4.753 -0.197 -5.969
249 HH22 ARG 41 2HH2 ARG 41 -4.573 -0.034 -4.247
250 H LYS 42 H LYS 42 3.608 -3.694 -6.114
251 HA LYS 42 HA LYS 42 3.105 -6.121 -7.359
252 HB2 LYS 42 2HB LYS 42 5.245 -5.533 -6.310
253 HB3 LYS 42 1HB LYS 42 4.496 -5.588 -4.722
254 HG2 LYS 42 2HG LYS 42 4.046 -7.989 -5.051
255 HG3 LYS 42 1HG LYS 42 4.890 -7.910 -6.600
256 HD2 LYS 42 2HD LYS 42 6.910 -7.111 -5.386
257 HD3 LYS 42 1HD LYS 42 6.048 -7.365 -3.868
258 HE2 LYS 42 2HE LYS 42 7.433 -9.269 -4.264
259 HE3 LYS 42 1HE LYS 42 5.756 -9.751 -4.516
260 HZ1 LYS 42 3HZ LYS 42 7.321 -10.578 -6.228
261 HZ2 LYS 42 1HZ LYS 42 7.602 -8.979 -6.708
262 HZ3 LYS 42 2HZ LYS 42 6.056 -9.658 -6.865
263 H ALA 43 H ALA 43 1.968 -7.945 -6.828
264 HA ALA 43 HA ALA 43 -0.304 -7.552 -5.155
265 HB1 ALA 43 3HB ALA 43 -0.409 -8.825 -7.251
266 HB2 ALA 43 1HB ALA 43 -1.006 -9.746 -5.871
267 HB3 ALA 43 2HB ALA 43 0.600 -10.076 -6.523
268 H LEU 44 H LEU 44 0.080 -7.459 -3.013
269 HA LEU 44 HA LEU 44 1.767 -9.396 -1.688
270 HG LEU 44 HG LEU 44 2.149 -6.451 0.468
271 HB2 LEU 44 2HB LEU 44 0.079 -7.101 -0.755
272 HB3 LEU 44 1HB LEU 44 0.663 -8.286 0.394
273 HD11 LEU 44 1HD1 LEU 44 4.275 -7.432 -0.256
274 HD12 LEU 44 2HD1 LEU 44 3.393 -8.633 -1.197
275 HD13 LEU 44 3HD1 LEU 44 3.248 -8.611 0.560
276 HD21 LEU 44 3HD2 LEU 44 3.324 -5.613 -1.511
277 HD22 LEU 44 1HD2 LEU 44 1.580 -5.373 -1.598
278 HD23 LEU 44 2HD2 LEU 44 2.337 -6.669 -2.521
279 H ASP 45 H ASP 45 1.088 -10.991 -0.268
280 HA ASP 45 HA ASP 45 -1.804 -11.546 -0.242
281 HB2 ASP 45 2HB ASP 45 -0.192 -13.275 -1.321
282 HB3 ASP 45 1HB ASP 45 0.313 -13.620 0.329
283 H SER 46 H SER 46 -1.812 -13.319 1.894
284 HA SER 46 HA SER 46 -2.203 -11.496 3.963
285 HG SER 46 HG SER 46 -2.179 -14.794 2.749
286 HB2 SER 46 2HB SER 46 -2.373 -13.664 5.360
287 HB3 SER 46 1HB SER 46 -3.496 -13.446 4.016
288 H THR 47 H THR 47 0.469 -13.857 3.583
289 HA THR 47 HA THR 47 1.677 -12.736 6.011
290 HB THR 47 HB THR 47 3.161 -14.794 5.860
291 HG1 THR 47 HG1 THR 47 2.885 -16.080 4.198
292 HG21 THR 47 3HG2 THR 47 1.418 -16.280 6.769
293 HG22 THR 47 1HG2 THR 47 0.179 -15.179 6.170
294 HG23 THR 47 2HG2 THR 47 1.293 -14.650 7.427
295 H THR 48 H THR 48 1.906 -12.022 2.870
296 HA THR 48 HA THR 48 4.839 -11.921 2.818
297 HB THR 48 HB THR 48 4.142 -11.120 0.335
298 HG1 THR 48 HG1 THR 48 2.191 -13.081 1.046
299 HG21 THR 48 3HG2 THR 48 5.711 -12.917 0.893
300 HG22 THR 48 1HG2 THR 48 4.594 -13.426 -0.373
301 HG23 THR 48 2HG2 THR 48 4.361 -13.980 1.286
302 H VAL 49 H VAL 49 2.091 -9.912 3.192
303 HA VAL 49 HA VAL 49 3.196 -7.494 2.219
304 HB VAL 49 HB VAL 49 0.913 -7.307 2.445
305 HG11 VAL 49 1HG1 VAL 49 -0.390 -8.040 4.377
306 HG12 VAL 49 2HG1 VAL 49 1.092 -8.505 5.218
307 HG13 VAL 49 3HG1 VAL 49 0.597 -9.365 3.759
308 HG21 VAL 49 3HG2 VAL 49 1.982 -6.126 5.002
309 HG22 VAL 49 1HG2 VAL 49 0.421 -5.740 4.279
310 HG23 VAL 49 2HG2 VAL 49 1.911 -5.343 3.424
311 H ALA 50 H ALA 50 4.545 -6.070 3.083
312 HA ALA 50 HA ALA 50 5.514 -6.566 5.805
313 HB1 ALA 50 3HB ALA 50 7.198 -6.512 3.999
314 HB2 ALA 50 1HB ALA 50 7.450 -5.240 5.196
315 HB3 ALA 50 2HB ALA 50 6.724 -4.851 3.638
316 H ALA 51 H ALA 51 4.383 -5.457 7.254
317 HA ALA 51 HA ALA 51 3.441 -2.764 6.576
318 HB1 ALA 51 3HB ALA 51 1.864 -3.022 8.417
319 HB2 ALA 51 1HB ALA 51 2.558 -4.596 8.802
320 HB3 ALA 51 2HB ALA 51 1.719 -4.354 7.269
321 H HIS 52 H HIS 52 4.155 -1.020 7.623
322 HA HIS 52 HA HIS 52 5.839 -1.419 10.012
323 HD1 HIS 52 HD1 HIS 52 6.852 2.834 8.737
324 HD2 HIS 52 HD2 HIS 52 8.306 -0.334 11.013
325 HE1 HIS 52 HE1 HIS 52 8.283 3.877 10.526
326 HE2 HIS 52 HE2 HIS 52 8.976 1.960 12.001
327 HB2 HIS 52 2HB HIS 52 7.259 -0.681 8.185
328 HB3 HIS 52 1HB HIS 52 6.155 0.642 7.814
329 H GLU 53 H GLU 53 4.393 -1.015 11.557
330 HA GLU 53 HA GLU 53 3.306 0.243 13.090
331 HB2 GLU 53 2HB GLU 53 3.963 2.627 11.359
332 HB3 GLU 53 1HB GLU 53 3.451 2.661 13.039
333 HG2 GLU 53 2HG GLU 53 6.028 1.543 11.973
334 HG3 GLU 53 1HG GLU 53 5.823 3.040 12.877
335 H SER 54 H SER 54 2.570 1.595 9.879
336 HA SER 54 HA SER 54 -0.252 0.969 10.313
337 HG SER 54 HG SER 54 -0.960 3.558 8.356
338 HB2 SER 54 2HB SER 54 -0.119 3.269 11.030
339 HB3 SER 54 1HB SER 54 0.813 3.713 9.601
340 H GLU 55 H GLU 55 2.362 1.837 8.125
341 HA GLU 55 HA GLU 55 0.633 1.595 5.804
342 HB2 GLU 55 2HB GLU 55 3.581 2.236 5.915
343 HB3 GLU 55 1HB GLU 55 2.514 2.438 4.531
344 HG2 GLU 55 2HG GLU 55 2.488 3.978 7.112
345 HG3 GLU 55 1HG GLU 55 2.863 4.578 5.497
346 H ILE 56 H ILE 56 0.878 0.134 4.152
347 HA ILE 56 HA ILE 56 2.450 -2.275 4.795
348 HB ILE 56 HB ILE 56 0.510 -3.391 4.762
349 HG12 ILE 56 2HG1 ILE 56 0.360 -2.527 1.862
350 HG13 ILE 56 1HG1 ILE 56 1.152 -3.974 2.488
351 HG21 ILE 56 1HG2 ILE 56 -0.801 -0.948 3.583
352 HG22 ILE 56 2HG2 ILE 56 -0.665 -1.343 5.296
353 HG23 ILE 56 3HG2 ILE 56 -1.641 -2.356 4.232
354 HD11 ILE 56 3HD1 ILE 56 -1.799 -3.388 2.581
355 HD12 ILE 56 1HD1 ILE 56 -1.015 -4.835 3.214
356 HD13 ILE 56 2HD1 ILE 56 -0.991 -4.506 1.483
357 H TYR 57 H TYR 57 3.830 -3.036 3.272
358 HA TYR 57 HA TYR 57 3.551 -2.124 0.508
359 HD1 TYR 57 HD1 TYR 57 4.561 0.483 -0.230
360 HD2 TYR 57 HD2 TYR 57 5.724 -0.403 3.762
361 HE1 TYR 57 HE1 TYR 57 4.048 2.799 0.426
362 HE2 TYR 57 HE2 TYR 57 5.223 1.909 4.431
363 HH TYR 57 HH TYR 57 3.399 4.003 2.584
364 HB2 TYR 57 2HB TYR 57 6.169 -1.950 2.028
365 HB3 TYR 57 1HB TYR 57 5.920 -1.528 0.338
366 H CYS 58 H CYS 58 5.085 -3.317 -0.958
367 HA CYS 58 HA CYS 58 5.196 -6.106 -0.241
368 HB2 CYS 58 2HB CYS 58 5.829 -6.509 -2.470
369 HB3 CYS 58 1HB CYS 58 4.758 -5.121 -2.589
370 H LYS 59 H LYS 59 7.211 -7.326 -0.342
371 HA LYS 59 HA LYS 59 8.936 -6.306 1.598
372 HB2 LYS 59 2HB LYS 59 9.204 -8.727 -0.174
373 HB3 LYS 59 1HB LYS 59 10.296 -8.368 1.158
374 HG2 LYS 59 2HG LYS 59 8.287 -8.351 2.666
375 HG3 LYS 59 1HG LYS 59 7.352 -8.969 1.304
376 HD2 LYS 59 2HD LYS 59 9.806 -10.323 2.421
377 HD3 LYS 59 1HD LYS 59 8.160 -10.716 2.911
378 HE2 LYS 59 2HE LYS 59 7.619 -11.331 0.608
379 HE3 LYS 59 1HE LYS 59 9.261 -10.920 0.112
380 HZ1 LYS 59 3HZ LYS 59 8.976 -13.306 0.447
381 HZ2 LYS 59 1HZ LYS 59 8.545 -13.045 2.065
382 HZ3 LYS 59 2HZ LYS 59 10.107 -12.666 1.532
383 H VAL 60 H VAL 60 9.155 -6.012 -1.869
384 HA VAL 60 HA VAL 60 12.002 -5.523 -1.764
385 HB VAL 60 HB VAL 60 11.966 -5.055 -4.117
386 HG11 VAL 60 1HG1 VAL 60 11.969 -7.385 -3.465
387 HG12 VAL 60 2HG1 VAL 60 11.069 -7.174 -4.967
388 HG13 VAL 60 3HG1 VAL 60 10.206 -7.407 -3.446
389 HG21 VAL 60 3HG2 VAL 60 8.958 -5.198 -3.963
390 HG22 VAL 60 1HG2 VAL 60 9.910 -5.081 -5.445
391 HG23 VAL 60 2HG2 VAL 60 9.921 -3.754 -4.281
392 H CYS 61 H CYS 61 9.064 -3.519 -2.031
393 HA CYS 61 HA CYS 61 10.508 -1.063 -2.163
394 HB2 CYS 61 2HB CYS 61 7.687 -1.631 -1.266
395 HB3 CYS 61 1HB CYS 61 8.364 -0.016 -1.426
396 H TYR 62 H TYR 62 9.289 -3.059 0.440
397 HA TYR 62 HA TYR 62 9.719 -1.231 2.536
398 HD1 TYR 62 HD2 TYR 62 7.618 -1.728 4.257
399 HD2 TYR 62 HD1 TYR 62 10.932 -4.300 4.964
400 HE1 TYR 62 HE2 TYR 62 7.426 -1.304 6.675
401 HE2 TYR 62 HE1 TYR 62 10.754 -3.876 7.377
402 HH TYR 62 HH TYR 62 8.061 -2.210 8.770
403 HB2 TYR 62 2HB TYR 62 8.421 -3.447 2.558
404 HB3 TYR 62 1HB TYR 62 9.979 -4.218 2.823
405 H GLY 63 H GLY 63 11.767 -3.827 1.222
406 HA2 GLY 63 2HA GLY 63 13.938 -3.266 2.997
407 HA3 GLY 63 1HA GLY 63 13.984 -4.314 1.588
408 H ARG 64 H ARG 64 12.893 -1.851 0.056
409 HA ARG 64 HA ARG 64 15.514 -0.815 -0.651
410 HE ARG 64 HE ARG 64 14.222 -1.564 -4.428
411 HB2 ARG 64 2HB ARG 64 13.819 -1.477 -2.361
412 HB3 ARG 64 1HB ARG 64 12.789 -0.170 -1.801
413 HG2 ARG 64 2HG ARG 64 14.483 1.455 -2.478
414 HG3 ARG 64 1HG ARG 64 15.510 0.138 -3.053
415 HD2 ARG 64 2HD ARG 64 12.775 0.888 -4.085
416 HD3 ARG 64 1HD ARG 64 14.313 1.108 -4.921
417 HH11 ARG 64 1HH1 ARG 64 12.127 0.706 -6.089
418 HH12 ARG 64 2HH1 ARG 64 11.433 -0.509 -7.126
419 HH21 ARG 64 1HH2 ARG 64 13.288 -3.163 -5.751
420 HH22 ARG 64 2HH2 ARG 64 12.048 -2.720 -6.897
421 H ARG 65 H ARG 65 12.390 0.471 0.423
422 HA ARG 65 HA ARG 65 13.310 3.170 0.564
423 HE ARG 65 HE ARG 65 9.369 5.622 3.018
424 HB2 ARG 65 2HB ARG 65 11.006 2.690 0.047
425 HB3 ARG 65 1HB ARG 65 10.809 1.805 1.551
426 HG2 ARG 65 2HG ARG 65 11.019 3.842 2.828
427 HG3 ARG 65 1HG ARG 65 11.358 4.760 1.357
428 HD2 ARG 65 2HD ARG 65 9.168 4.306 0.498
429 HD3 ARG 65 1HD ARG 65 8.823 3.205 1.828
430 HH11 ARG 65 1HH1 ARG 65 7.148 4.523 0.549
431 HH12 ARG 65 2HH1 ARG 65 5.848 5.563 1.052
432 HH21 ARG 65 1HH2 ARG 65 7.669 7.006 3.696
433 HH22 ARG 65 2HH2 ARG 65 6.153 6.983 2.853
434 H TYR 66 H TYR 66 12.890 0.566 2.921
435 HA TYR 66 HA TYR 66 13.444 2.425 5.098
436 HD1 TYR 66 HD1 TYR 66 10.554 0.398 3.802
437 HD2 TYR 66 HD2 TYR 66 11.634 1.841 7.657
438 HE1 TYR 66 HE1 TYR 66 8.293 1.327 4.084
439 HE2 TYR 66 HE2 TYR 66 9.380 2.768 7.947
440 HH TYR 66 HH TYR 66 6.791 2.014 5.833
441 HB2 TYR 66 2HB TYR 66 12.569 -0.457 5.038
442 HB3 TYR 66 1HB TYR 66 13.067 0.340 6.528
Start of MODEL 16
1 H1 GLY 7 1H GLY 7 -19.402 2.727 5.741
2 HA2 GLY 7 2HA GLY 7 -18.318 1.268 8.015
3 HA3 GLY 7 1HA GLY 7 -17.892 1.032 6.327
4 H ALA 8 H ALA 8 -15.908 1.603 5.825
5 HA ALA 8 HA ALA 8 -14.667 3.868 7.250
6 HB1 ALA 8 3HB ALA 8 -13.734 1.751 8.061
7 HB2 ALA 8 1HB ALA 8 -12.528 2.674 7.160
8 HB3 ALA 8 2HB ALA 8 -13.326 1.293 6.407
9 H LYS 9 H LYS 9 -12.432 4.288 5.823
10 HA LYS 9 HA LYS 9 -13.266 4.256 3.004
11 HB2 LYS 9 2HB LYS 9 -12.068 6.397 2.661
12 HB3 LYS 9 1HB LYS 9 -13.454 6.549 3.731
13 HG2 LYS 9 2HG LYS 9 -12.145 6.920 5.599
14 HG3 LYS 9 1HG LYS 9 -10.726 6.155 4.882
15 HD2 LYS 9 2HD LYS 9 -10.638 8.670 5.074
16 HD3 LYS 9 1HD LYS 9 -10.321 8.013 3.469
17 HE2 LYS 9 2HE LYS 9 -11.766 9.952 3.317
18 HE3 LYS 9 1HE LYS 9 -12.638 8.505 2.820
19 HZ1 LYS 9 3HZ LYS 9 -12.907 10.031 5.344
20 HZ2 LYS 9 1HZ LYS 9 -13.511 8.453 5.181
21 HZ3 LYS 9 2HZ LYS 9 -14.100 9.689 4.187
22 H CYS 10 H CYS 10 -11.679 3.984 1.504
23 HA CYS 10 HA CYS 10 -9.602 2.220 2.221
24 HB2 CYS 10 2HB CYS 10 -10.755 2.297 0.026
25 HB3 CYS 10 1HB CYS 10 -9.962 3.828 -0.310
26 H GLY 11 H GLY 11 -7.600 2.604 2.895
27 HA2 GLY 11 2HA GLY 11 -6.538 5.223 3.216
28 HA3 GLY 11 1HA GLY 11 -5.655 3.716 3.420
29 H ALA 12 H ALA 12 -6.712 3.182 0.501
30 HA ALA 12 HA ALA 12 -4.417 4.471 -0.790
31 HB1 ALA 12 3HB ALA 12 -4.561 2.055 -1.052
32 HB2 ALA 12 1HB ALA 12 -4.791 2.855 -2.607
33 HB3 ALA 12 2HB ALA 12 -6.181 2.210 -1.734
34 H CYS 13 H CYS 13 -7.885 3.901 -1.294
35 HA CYS 13 HA CYS 13 -7.990 5.913 -3.398
36 HB2 CYS 13 2HB CYS 13 -10.217 4.290 -2.144
37 HB3 CYS 13 1HB CYS 13 -10.330 5.245 -3.614
38 H GLU 14 H GLU 14 -10.178 7.253 -3.181
39 HA GLU 14 HA GLU 14 -10.367 8.374 -0.465
40 HB2 GLU 14 2HB GLU 14 -11.281 10.357 -1.432
41 HB3 GLU 14 1HB GLU 14 -9.873 9.947 -2.404
42 HG2 GLU 14 2HG GLU 14 -12.605 9.044 -3.174
43 HG3 GLU 14 1HG GLU 14 -12.038 10.656 -3.599
44 H LYS 15 H LYS 15 -11.464 5.943 -1.952
45 HA LYS 15 HA LYS 15 -14.327 6.471 -1.952
46 HB2 LYS 15 2HB LYS 15 -12.936 3.934 -2.805
47 HB3 LYS 15 1HB LYS 15 -14.544 4.494 -3.259
48 HG2 LYS 15 2HG LYS 15 -13.500 6.382 -4.464
49 HG3 LYS 15 1HG LYS 15 -11.915 5.714 -4.078
50 HD2 LYS 15 2HD LYS 15 -12.635 3.613 -5.267
51 HD3 LYS 15 1HD LYS 15 -14.062 4.502 -5.810
52 HE2 LYS 15 2HE LYS 15 -11.175 4.999 -6.475
53 HE3 LYS 15 1HE LYS 15 -12.525 4.705 -7.569
54 HZ1 LYS 15 3HZ LYS 15 -12.002 7.148 -5.970
55 HZ2 LYS 15 1HZ LYS 15 -13.461 6.863 -6.792
56 HZ3 LYS 15 2HZ LYS 15 -12.009 7.005 -7.660
57 H THR 16 H THR 16 -15.725 4.715 -1.117
58 HA THR 16 HA THR 16 -15.068 4.369 1.644
59 HB THR 16 HB THR 16 -17.490 3.137 0.529
60 HG1 THR 16 HG1 THR 16 -18.370 4.979 -0.191
61 HG21 THR 16 3HG2 THR 16 -17.124 3.312 2.948
62 HG22 THR 16 1HG2 THR 16 -18.536 4.243 2.450
63 HG23 THR 16 2HG2 THR 16 -17.016 5.066 2.801
64 H VAL 17 H VAL 17 -15.074 2.455 2.797
65 HA VAL 17 HA VAL 17 -14.771 -0.027 1.243
66 HB VAL 17 HB VAL 17 -13.110 1.041 3.505
67 HG11 VAL 17 1HG1 VAL 17 -13.835 -1.179 4.241
68 HG12 VAL 17 2HG1 VAL 17 -12.122 -1.173 3.827
69 HG13 VAL 17 3HG1 VAL 17 -13.298 -1.866 2.711
70 HG21 VAL 17 3HG2 VAL 17 -12.312 1.427 1.275
71 HG22 VAL 17 1HG2 VAL 17 -12.466 -0.289 0.892
72 HG23 VAL 17 2HG2 VAL 17 -11.275 0.249 2.080
73 H TYR 18 H TYR 18 -16.142 -1.592 1.806
74 HA TYR 18 HA TYR 18 -17.289 -1.544 4.519
75 HD1 TYR 18 HD1 TYR 18 -19.782 -0.105 4.696
76 HD2 TYR 18 HD2 TYR 18 -18.756 -0.586 0.596
77 HE1 TYR 18 HE1 TYR 18 -20.620 2.158 4.225
78 HE2 TYR 18 HE2 TYR 18 -19.593 1.668 0.112
79 HH TYR 18 HH TYR 18 -20.317 3.924 2.551
80 HB2 TYR 18 2HB TYR 18 -18.745 -2.450 2.026
81 HB3 TYR 18 1HB TYR 18 -19.400 -2.364 3.654
82 H HIS 19 H HIS 19 -18.636 -3.946 4.428
83 HA HIS 19 HA HIS 19 -16.644 -5.776 5.064
84 HD1 HIS 19 HD1 HIS 19 -20.825 -4.666 4.527
85 HD2 HIS 19 HD2 HIS 19 -19.728 -8.316 2.863
86 HE1 HIS 19 HE1 HIS 19 -22.564 -5.168 2.777
87 HE2 HIS 19 HE2 HIS 19 -21.734 -7.254 1.629
88 HB2 HIS 19 2HB HIS 19 -18.402 -7.461 5.167
89 HB3 HIS 19 1HB HIS 19 -18.977 -5.944 5.851
90 H ALA 20 H ALA 20 -18.071 -5.117 1.949
91 HA ALA 20 HA ALA 20 -17.692 -7.669 0.784
92 HB1 ALA 20 3HB ALA 20 -17.927 -4.996 -0.588
93 HB2 ALA 20 1HB ALA 20 -19.284 -5.994 -0.060
94 HB3 ALA 20 2HB ALA 20 -18.197 -6.583 -1.319
95 H GLU 21 H GLU 21 -15.735 -4.738 0.836
96 HA GLU 21 HA GLU 21 -13.635 -6.223 -0.586
97 HB2 GLU 21 2HB GLU 21 -13.058 -4.136 -1.780
98 HB3 GLU 21 1HB GLU 21 -14.660 -4.733 -2.176
99 HG2 GLU 21 2HG GLU 21 -14.236 -2.596 -0.115
100 HG3 GLU 21 1HG GLU 21 -14.362 -2.221 -1.829
101 H GLU 22 H GLU 22 -13.898 -5.824 2.270
102 HA GLU 22 HA GLU 22 -11.758 -3.884 2.802
103 HB2 GLU 22 2HB GLU 22 -13.763 -3.571 4.161
104 HB3 GLU 22 1HB GLU 22 -13.652 -5.234 4.731
105 HG2 GLU 22 2HG GLU 22 -11.341 -4.593 5.601
106 HG3 GLU 22 1HG GLU 22 -11.842 -2.924 5.337
107 H ILE 23 H ILE 23 -9.770 -4.578 3.178
108 HA ILE 23 HA ILE 23 -9.536 -6.936 4.926
109 HB ILE 23 HB ILE 23 -7.549 -6.075 2.810
110 HG12 ILE 23 2HG1 ILE 23 -7.897 -8.775 2.557
111 HG13 ILE 23 1HG1 ILE 23 -9.505 -8.262 3.056
112 HG21 ILE 23 1HG2 ILE 23 -6.346 -6.597 4.844
113 HG22 ILE 23 2HG2 ILE 23 -6.095 -7.870 3.649
114 HG23 ILE 23 3HG2 ILE 23 -7.212 -8.128 4.993
115 HD11 ILE 23 3HD1 ILE 23 -9.331 -8.322 0.650
116 HD12 ILE 23 1HD1 ILE 23 -7.958 -7.215 0.705
117 HD13 ILE 23 2HD1 ILE 23 -9.557 -6.663 1.209
118 H GLN 24 H GLN 24 -8.979 -6.286 6.895
119 HA GLN 24 HA GLN 24 -7.767 -3.689 7.278
120 HB2 GLN 24 2HB GLN 24 -8.734 -5.816 9.187
121 HB3 GLN 24 1HB GLN 24 -7.888 -4.372 9.734
122 HG2 GLN 24 2HG GLN 24 -9.604 -2.964 8.782
123 HG3 GLN 24 1HG GLN 24 -10.436 -4.373 8.131
124 HE21 GLN 24 1HE2 GLN 24 -12.308 -3.851 9.246
125 HE22 GLN 24 2HE2 GLN 24 -12.453 -4.094 10.953
126 H CYS 25 H CYS 25 -5.715 -3.561 6.774
127 HA CYS 25 HA CYS 25 -3.940 -5.826 7.307
128 HG CYS 25 HG CYS 25 -5.806 -4.334 4.877
129 HB2 CYS 25 2HB CYS 25 -3.098 -3.360 5.828
130 HB3 CYS 25 1HB CYS 25 -2.573 -5.024 5.609
131 H ASN 26 H ASN 26 -2.944 -5.802 9.158
132 HA ASN 26 HA ASN 26 -1.722 -5.178 10.957
133 HB2 ASN 26 2HB ASN 26 -0.408 -3.827 9.237
134 HB3 ASN 26 1HB ASN 26 -1.355 -2.437 9.748
135 HD21 ASN 26 1HD2 ASN 26 -0.962 -1.512 11.742
136 HD22 ASN 26 2HD2 ASN 26 0.410 -1.925 12.710
137 H GLY 27 H GLY 27 -3.556 -2.286 9.933
138 HA2 GLY 27 2HA GLY 27 -5.462 -2.598 12.020
139 HA3 GLY 27 1HA GLY 27 -4.276 -1.376 12.456
140 H ARG 28 H ARG 28 -5.093 -1.803 9.104
141 HA ARG 28 HA ARG 28 -6.923 0.492 9.216
142 HE ARG 28 HE ARG 28 -6.802 1.699 10.190
143 HB2 ARG 28 2HB ARG 28 -4.506 0.241 7.422
144 HB3 ARG 28 1HB ARG 28 -5.778 1.430 7.195
145 HG2 ARG 28 2HG ARG 28 -4.214 1.253 9.748
146 HG3 ARG 28 1HG ARG 28 -3.639 2.175 8.360
147 HD2 ARG 28 2HD ARG 28 -4.759 3.731 9.729
148 HD3 ARG 28 1HD ARG 28 -5.865 3.380 8.404
149 HH11 ARG 28 1HH1 ARG 28 -5.681 4.981 10.675
150 HH12 ARG 28 2HH1 ARG 28 -6.699 5.260 12.053
151 HH21 ARG 28 1HH2 ARG 28 -8.172 2.076 11.985
152 HH22 ARG 28 2HH2 ARG 28 -8.131 3.618 12.785
153 H SER 29 H SER 29 -8.574 0.426 7.762
154 HA SER 29 HA SER 29 -9.010 -2.027 6.320
155 HG SER 29 HG SER 29 -11.616 -1.741 7.687
156 HB2 SER 29 2HB SER 29 -10.668 0.506 6.433
157 HB3 SER 29 1HB SER 29 -11.194 -1.033 5.752
158 H PHE 30 H PHE 30 -8.490 -2.408 4.271
159 HA PHE 30 HA PHE 30 -8.327 -0.152 2.389
160 HD1 PHE 30 HD2 PHE 30 -5.983 1.094 1.980
161 HD2 PHE 30 HD1 PHE 30 -5.183 -2.313 4.402
162 HE1 PHE 30 HE2 PHE 30 -4.379 2.410 3.302
163 HE2 PHE 30 HE1 PHE 30 -3.584 -0.999 5.731
164 HZ PHE 30 HZ PHE 30 -3.178 1.365 5.179
165 HB2 PHE 30 2HB PHE 30 -6.483 -2.554 2.503
166 HB3 PHE 30 1HB PHE 30 -6.466 -1.325 1.243
167 H HIS 31 H HIS 31 -8.542 -0.952 0.066
168 HA HIS 31 HA HIS 31 -10.819 -2.676 -0.110
169 HD2 HIS 31 HD2 HIS 31 -12.755 -1.557 -0.683
170 HE1 HIS 31 HE1 HIS 31 -12.225 2.241 -2.457
171 HE2 HIS 31 HE2 HIS 31 -13.728 0.830 -0.994
172 HB2 HIS 31 2HB HIS 31 -9.149 -1.298 -2.201
173 HB3 HIS 31 1HB HIS 31 -10.362 -2.490 -2.653
174 H LYS 32 H LYS 32 -10.943 -4.564 -1.488
175 HA LYS 32 HA LYS 32 -9.019 -6.521 -0.864
176 HB2 LYS 32 2HB LYS 32 -11.423 -6.937 -1.357
177 HB3 LYS 32 1HB LYS 32 -11.113 -6.560 -3.043
178 HG2 LYS 32 2HG LYS 32 -9.727 -8.487 -3.292
179 HG3 LYS 32 1HG LYS 32 -9.777 -8.808 -1.555
180 HD2 LYS 32 2HD LYS 32 -12.174 -8.827 -3.392
181 HD3 LYS 32 1HD LYS 32 -11.308 -10.264 -2.843
182 HE2 LYS 32 2HE LYS 32 -11.901 -9.828 -0.564
183 HE3 LYS 32 1HE LYS 32 -12.585 -8.260 -0.987
184 HZ1 LYS 32 3HZ LYS 32 -13.639 -10.835 -2.021
185 HZ2 LYS 32 1HZ LYS 32 -14.357 -9.304 -2.140
186 HZ3 LYS 32 2HZ LYS 32 -14.240 -10.071 -0.631
187 H THR 33 H THR 33 -9.619 -4.611 -3.776
188 HA THR 33 HA THR 33 -7.404 -5.775 -5.203
189 HB THR 33 HB THR 33 -9.423 -4.846 -6.336
190 HG1 THR 33 HG1 THR 33 -8.055 -4.770 -7.933
191 HG21 THR 33 3HG2 THR 33 -9.770 -2.872 -4.962
192 HG22 THR 33 1HG2 THR 33 -9.592 -2.423 -6.657
193 HG23 THR 33 2HG2 THR 33 -8.248 -2.189 -5.538
194 H CYS 34 H CYS 34 -7.821 -3.333 -2.880
195 HA CYS 34 HA CYS 34 -5.328 -1.992 -3.577
196 HB2 CYS 34 2HB CYS 34 -7.392 -1.317 -1.470
197 HB3 CYS 34 1HB CYS 34 -5.974 -0.345 -1.857
198 H PHE 35 H PHE 35 -5.720 -4.755 -2.289
199 HA PHE 35 HA PHE 35 -4.184 -4.421 0.140
200 HD1 PHE 35 HD2 PHE 35 -4.790 -5.753 2.184
201 HD2 PHE 35 HD1 PHE 35 -3.396 -8.620 -0.631
202 HE1 PHE 35 HE2 PHE 35 -3.558 -6.894 3.971
203 HE2 PHE 35 HE1 PHE 35 -2.148 -9.769 1.158
204 HZ PHE 35 HZ PHE 35 -2.224 -8.891 3.466
205 HB2 PHE 35 2HB PHE 35 -5.926 -6.210 -0.098
206 HB3 PHE 35 1HB PHE 35 -4.915 -6.984 -1.312
207 H HIS 36 H HIS 36 -3.306 -3.806 -2.775
208 HA HIS 36 HA HIS 36 -0.983 -5.518 -3.047
209 HD1 HIS 36 HD1 HIS 36 -2.725 -6.647 -4.093
210 HD2 HIS 36 HD2 HIS 36 -2.931 -3.880 -7.196
211 HE1 HIS 36 HE1 HIS 36 -4.427 -7.555 -5.710
212 HE2 HIS 36 HE2 HIS 36 -4.434 -5.938 -7.643
213 HB2 HIS 36 2HB HIS 36 -1.767 -3.135 -4.690
214 HB3 HIS 36 1HB HIS 36 -0.514 -4.289 -5.090
215 H CYS 37 H CYS 37 1.128 -4.232 -3.627
216 HA CYS 37 HA CYS 37 1.960 -2.904 -1.287
217 HB2 CYS 37 2HB CYS 37 3.485 -4.131 -2.808
218 HB3 CYS 37 1HB CYS 37 3.250 -2.883 -4.026
219 H MET 38 H MET 38 1.714 -0.903 -0.677
220 HA MET 38 HA MET 38 0.366 1.018 -2.293
221 HB2 MET 38 2HB MET 38 1.722 1.273 0.396
222 HB3 MET 38 1HB MET 38 0.745 2.533 -0.344
223 HG2 MET 38 2HG MET 38 -0.233 -0.214 0.393
224 HG3 MET 38 1HG MET 38 -0.470 1.246 1.352
225 HE1 MET 38 3HE MET 38 -2.758 -0.790 0.265
226 HE2 MET 38 1HE MET 38 -4.022 0.367 -0.151
227 HE3 MET 38 2HE MET 38 -3.088 0.576 1.330
228 H ALA 39 H ALA 39 3.625 0.127 -1.996
229 HA ALA 39 HA ALA 39 4.629 2.809 -2.523
230 HB1 ALA 39 3HB ALA 39 6.151 0.240 -2.143
231 HB2 ALA 39 1HB ALA 39 5.799 1.430 -0.892
232 HB3 ALA 39 2HB ALA 39 6.844 1.861 -2.245
233 H CYS 40 H CYS 40 4.799 -0.420 -4.079
234 HA CYS 40 HA CYS 40 5.314 1.050 -6.558
235 HB2 CYS 40 2HB CYS 40 6.104 -1.082 -7.530
236 HB3 CYS 40 1HB CYS 40 7.054 -0.577 -6.143
237 H ARG 41 H ARG 41 4.082 -2.197 -6.469
238 HA ARG 41 HA ARG 41 1.348 -1.778 -6.330
239 HE ARG 41 HE ARG 41 0.334 0.491 -7.348
240 HB2 ARG 41 2HB ARG 41 1.817 -0.428 -8.444
241 HB3 ARG 41 1HB ARG 41 2.190 -1.953 -9.227
242 HG2 ARG 41 2HG ARG 41 -0.121 -1.079 -9.616
243 HG3 ARG 41 1HG ARG 41 -0.031 -2.729 -8.998
244 HD2 ARG 41 2HD ARG 41 -1.783 -1.418 -7.883
245 HD3 ARG 41 1HD ARG 41 -0.534 -1.962 -6.765
246 HH11 ARG 41 1HH1 ARG 41 -2.860 -0.655 -6.533
247 HH12 ARG 41 2HH1 ARG 41 -3.347 0.818 -5.752
248 HH21 ARG 41 1HH2 ARG 41 -0.267 2.447 -6.299
249 HH22 ARG 41 2HH2 ARG 41 -1.867 2.590 -5.625
250 H LYS 42 H LYS 42 3.609 -3.636 -5.871
251 HA LYS 42 HA LYS 42 3.226 -6.001 -7.389
252 HB2 LYS 42 2HB LYS 42 5.284 -5.419 -6.112
253 HB3 LYS 42 1HB LYS 42 4.391 -5.642 -4.620
254 HG2 LYS 42 2HG LYS 42 4.249 -7.967 -4.927
255 HG3 LYS 42 1HG LYS 42 4.725 -7.850 -6.624
256 HD2 LYS 42 2HD LYS 42 6.954 -7.184 -6.011
257 HD3 LYS 42 1HD LYS 42 6.502 -7.076 -4.313
258 HE2 LYS 42 2HE LYS 42 6.331 -9.643 -5.871
259 HE3 LYS 42 1HE LYS 42 7.798 -9.138 -5.034
260 HZ1 LYS 42 3HZ LYS 42 6.480 -9.042 -2.966
261 HZ2 LYS 42 1HZ LYS 42 6.539 -10.597 -3.634
262 HZ3 LYS 42 2HZ LYS 42 5.141 -9.653 -3.803
263 H ALA 43 H ALA 43 1.942 -7.773 -7.007
264 HA ALA 43 HA ALA 43 -0.336 -7.363 -5.276
265 HB1 ALA 43 3HB ALA 43 -0.647 -8.340 -7.493
266 HB2 ALA 43 1HB ALA 43 -1.162 -9.465 -6.236
267 HB3 ALA 43 2HB ALA 43 0.384 -9.700 -7.048
268 H LEU 44 H LEU 44 0.154 -7.585 -3.161
269 HA LEU 44 HA LEU 44 2.124 -9.408 -2.206
270 HG LEU 44 HG LEU 44 2.300 -6.745 0.261
271 HB2 LEU 44 2HB LEU 44 0.258 -7.454 -0.967
272 HB3 LEU 44 1HB LEU 44 0.949 -8.698 0.055
273 HD11 LEU 44 1HD1 LEU 44 4.472 -7.579 -0.512
274 HD12 LEU 44 2HD1 LEU 44 3.649 -8.759 -1.531
275 HD13 LEU 44 3HD1 LEU 44 3.500 -8.852 0.224
276 HD21 LEU 44 3HD2 LEU 44 1.620 -5.630 -1.811
277 HD22 LEU 44 1HD2 LEU 44 2.583 -6.780 -2.740
278 HD23 LEU 44 2HD2 LEU 44 3.374 -5.660 -1.631
279 H ASP 45 H ASP 45 1.927 -11.263 -1.090
280 HA ASP 45 HA ASP 45 -0.726 -12.517 -1.049
281 HB2 ASP 45 2HB ASP 45 1.076 -13.781 -2.192
282 HB3 ASP 45 1HB ASP 45 2.014 -13.769 -0.701
283 H SER 46 H SER 46 -1.175 -13.843 0.958
284 HA SER 46 HA SER 46 -1.442 -12.121 3.069
285 HG SER 46 HG SER 46 -3.351 -15.142 2.430
286 HB2 SER 46 2HB SER 46 -1.370 -15.133 3.270
287 HB3 SER 46 1HB SER 46 -2.217 -14.020 4.344
288 H THR 47 H THR 47 1.224 -14.410 2.550
289 HA THR 47 HA THR 47 2.273 -13.702 5.195
290 HB THR 47 HB THR 47 3.834 -15.616 4.848
291 HG1 THR 47 HG1 THR 47 3.381 -17.030 3.114
292 HG21 THR 47 3HG2 THR 47 2.139 -17.349 5.197
293 HG22 THR 47 1HG2 THR 47 0.892 -16.253 4.604
294 HG23 THR 47 2HG2 THR 47 1.749 -15.885 6.102
295 H THR 48 H THR 48 2.664 -12.593 2.096
296 HA THR 48 HA THR 48 5.550 -12.165 2.464
297 HB THR 48 HB THR 48 5.440 -11.422 0.005
298 HG1 THR 48 HG1 THR 48 3.429 -13.061 -0.633
299 HG21 THR 48 3HG2 THR 48 6.492 -13.500 0.751
300 HG22 THR 48 1HG2 THR 48 5.642 -13.741 -0.776
301 HG23 THR 48 2HG2 THR 48 4.925 -14.309 0.732
302 H VAL 49 H VAL 49 2.581 -10.543 2.686
303 HA VAL 49 HA VAL 49 3.530 -7.938 1.974
304 HB VAL 49 HB VAL 49 1.218 -8.059 1.807
305 HG11 VAL 49 1HG1 VAL 49 1.128 -9.275 4.574
306 HG12 VAL 49 2HG1 VAL 49 0.877 -10.133 3.053
307 HG13 VAL 49 3HG1 VAL 49 -0.277 -8.903 3.573
308 HG21 VAL 49 3HG2 VAL 49 1.885 -6.010 2.922
309 HG22 VAL 49 1HG2 VAL 49 1.722 -6.791 4.493
310 HG23 VAL 49 2HG2 VAL 49 0.298 -6.535 3.483
311 H ALA 50 H ALA 50 4.478 -6.427 3.153
312 HA ALA 50 HA ALA 50 5.013 -7.030 5.988
313 HB1 ALA 50 3HB ALA 50 7.006 -5.620 5.758
314 HB2 ALA 50 1HB ALA 50 6.612 -5.339 4.063
315 HB3 ALA 50 2HB ALA 50 7.030 -6.963 4.615
316 H ALA 51 H ALA 51 3.604 -5.949 7.192
317 HA ALA 51 HA ALA 51 2.960 -3.173 6.474
318 HB1 ALA 51 3HB ALA 51 1.033 -4.692 6.639
319 HB2 ALA 51 1HB ALA 51 0.971 -3.410 7.847
320 HB3 ALA 51 2HB ALA 51 1.461 -5.037 8.316
321 H HIS 52 H HIS 52 3.706 -1.583 7.713
322 HA HIS 52 HA HIS 52 4.725 -2.269 10.392
323 HD1 HIS 52 HD1 HIS 52 7.727 1.126 9.378
324 HD2 HIS 52 HD2 HIS 52 6.783 -1.979 11.983
325 HE1 HIS 52 HE1 HIS 52 8.966 1.626 11.511
326 HE2 HIS 52 HE2 HIS 52 8.209 -0.147 13.134
327 HB2 HIS 52 2HB HIS 52 6.613 -2.052 8.807
328 HB3 HIS 52 1HB HIS 52 6.071 -0.429 8.396
329 H GLU 53 H GLU 53 3.544 -1.265 11.807
330 HA GLU 53 HA GLU 53 2.668 0.401 13.060
331 HB2 GLU 53 2HB GLU 53 3.663 2.334 10.956
332 HB3 GLU 53 1HB GLU 53 3.123 2.743 12.578
333 HG2 GLU 53 2HG GLU 53 5.548 1.108 11.865
334 HG3 GLU 53 1HG GLU 53 5.540 2.775 12.434
335 H SER 54 H SER 54 2.123 1.105 9.623
336 HA SER 54 HA SER 54 -0.723 0.865 9.923
337 HG SER 54 HG SER 54 -1.596 3.329 8.311
338 HB2 SER 54 2HB SER 54 -0.272 3.156 10.818
339 HB3 SER 54 1HB SER 54 0.411 3.595 9.254
340 H GLU 55 H GLU 55 2.120 1.443 8.015
341 HA GLU 55 HA GLU 55 0.660 1.447 5.502
342 HB2 GLU 55 2HB GLU 55 3.578 1.761 6.186
343 HB3 GLU 55 1HB GLU 55 2.979 1.705 4.534
344 HG2 GLU 55 2HG GLU 55 2.060 3.708 6.575
345 HG3 GLU 55 1HG GLU 55 3.386 3.992 5.449
346 H ILE 56 H ILE 56 1.020 -0.054 3.842
347 HA ILE 56 HA ILE 56 2.245 -2.612 4.629
348 HB ILE 56 HB ILE 56 0.155 -3.460 4.666
349 HG12 ILE 56 2HG1 ILE 56 0.396 -3.083 1.673
350 HG13 ILE 56 1HG1 ILE 56 0.996 -4.452 2.605
351 HG21 ILE 56 1HG2 ILE 56 -0.791 -1.166 2.968
352 HG22 ILE 56 2HG2 ILE 56 -0.884 -1.283 4.725
353 HG23 ILE 56 3HG2 ILE 56 -1.825 -2.383 3.716
354 HD11 ILE 56 3HD1 ILE 56 -1.302 -5.065 3.171
355 HD12 ILE 56 1HD1 ILE 56 -1.051 -5.009 1.426
356 HD13 ILE 56 2HD1 ILE 56 -1.896 -3.691 2.237
357 H TYR 57 H TYR 57 3.741 -3.334 3.209
358 HA TYR 57 HA TYR 57 3.536 -2.520 0.403
359 HD1 TYR 57 HD2 TYR 57 3.943 0.056 0.013
360 HD2 TYR 57 HD1 TYR 57 6.268 -0.675 3.494
361 HE1 TYR 57 HE2 TYR 57 3.514 2.358 0.775
362 HE2 TYR 57 HE1 TYR 57 5.855 1.616 4.267
363 HH TYR 57 HH TYR 57 3.477 3.606 2.996
364 HB2 TYR 57 2HB TYR 57 6.148 -2.293 1.910
365 HB3 TYR 57 1HB TYR 57 5.835 -1.819 0.249
366 H CYS 58 H CYS 58 5.256 -3.611 -0.920
367 HA CYS 58 HA CYS 58 5.478 -6.396 -0.248
368 HB2 CYS 58 2HB CYS 58 6.423 -6.692 -2.399
369 HB3 CYS 58 1HB CYS 58 5.206 -5.440 -2.609
370 H LYS 59 H LYS 59 7.677 -7.470 -0.305
371 HA LYS 59 HA LYS 59 9.248 -6.279 1.747
372 HB2 LYS 59 2HB LYS 59 9.764 -8.726 0.053
373 HB3 LYS 59 1HB LYS 59 10.741 -8.250 1.434
374 HG2 LYS 59 2HG LYS 59 8.695 -8.395 2.847
375 HG3 LYS 59 1HG LYS 59 7.845 -9.058 1.452
376 HD2 LYS 59 2HD LYS 59 9.410 -10.929 1.377
377 HD3 LYS 59 1HD LYS 59 10.294 -10.253 2.747
378 HE2 LYS 59 2HE LYS 59 8.235 -10.442 4.108
379 HE3 LYS 59 1HE LYS 59 7.439 -11.222 2.743
380 HZ1 LYS 59 3HZ LYS 59 8.285 -12.827 4.350
381 HZ2 LYS 59 1HZ LYS 59 9.861 -12.239 4.129
382 HZ3 LYS 59 2HZ LYS 59 9.054 -13.003 2.848
383 H VAL 60 H VAL 60 9.262 -5.887 -1.605
384 HA VAL 60 HA VAL 60 12.070 -5.386 -1.937
385 HB VAL 60 HB VAL 60 9.756 -4.525 -3.689
386 HG11 VAL 60 1HG1 VAL 60 11.466 -4.347 -5.457
387 HG12 VAL 60 2HG1 VAL 60 12.714 -4.690 -4.258
388 HG13 VAL 60 3HG1 VAL 60 11.748 -3.220 -4.132
389 HG21 VAL 60 3HG2 VAL 60 9.826 -6.946 -3.432
390 HG22 VAL 60 1HG2 VAL 60 11.530 -6.955 -3.883
391 HG23 VAL 60 2HG2 VAL 60 10.309 -6.475 -5.061
392 H CYS 61 H CYS 61 9.160 -3.332 -1.791
393 HA CYS 61 HA CYS 61 10.627 -0.897 -1.652
394 HB2 CYS 61 2HB CYS 61 7.759 -1.459 -0.894
395 HB3 CYS 61 1HB CYS 61 8.465 0.136 -1.117
396 H TYR 62 H TYR 62 9.343 -3.125 0.702
397 HA TYR 62 HA TYR 62 9.509 -1.551 3.005
398 HD1 TYR 62 HD2 TYR 62 7.426 -2.557 4.536
399 HD2 TYR 62 HD1 TYR 62 11.011 -4.781 5.095
400 HE1 TYR 62 HE2 TYR 62 7.049 -2.542 6.963
401 HE2 TYR 62 HE1 TYR 62 10.635 -4.781 7.525
402 HH TYR 62 HH TYR 62 7.734 -4.084 8.922
403 HB2 TYR 62 2HB TYR 62 8.503 -3.892 2.685
404 HB3 TYR 62 1HB TYR 62 10.134 -4.501 2.921
405 H GLY 63 H GLY 63 11.915 -3.837 1.675
406 HA2 GLY 63 2HA GLY 63 13.947 -3.012 3.525
407 HA3 GLY 63 1HA GLY 63 14.168 -4.068 2.134
408 H ARG 64 H ARG 64 12.769 -1.758 0.597
409 HA ARG 64 HA ARG 64 15.147 -0.477 -0.324
410 HE ARG 64 HE ARG 64 13.983 2.678 -4.093
411 HB2 ARG 64 2HB ARG 64 13.226 -0.925 -1.794
412 HB3 ARG 64 1HB ARG 64 12.235 0.162 -0.835
413 HG2 ARG 64 2HG ARG 64 13.737 2.021 -1.473
414 HG3 ARG 64 1HG ARG 64 14.606 0.906 -2.531
415 HD2 ARG 64 2HD ARG 64 12.482 0.447 -3.719
416 HD3 ARG 64 1HD ARG 64 11.692 1.657 -2.711
417 HH11 ARG 64 1HH1 ARG 64 10.562 1.994 -4.371
418 HH12 ARG 64 2HH1 ARG 64 10.302 3.140 -5.652
419 HH21 ARG 64 1HH2 ARG 64 13.655 4.184 -5.764
420 HH22 ARG 64 2HH2 ARG 64 12.070 4.386 -6.451
421 H ARG 65 H ARG 65 12.286 0.635 1.471
422 HA ARG 65 HA ARG 65 13.371 3.254 1.883
423 HE ARG 65 HE ARG 65 9.745 4.741 1.639
424 HB2 ARG 65 2HB ARG 65 10.960 2.898 1.731
425 HB3 ARG 65 1HB ARG 65 11.003 1.883 3.166
426 HG2 ARG 65 2HG ARG 65 11.655 3.767 4.525
427 HG3 ARG 65 1HG ARG 65 11.742 4.801 3.099
428 HD2 ARG 65 2HD ARG 65 9.262 3.442 4.149
429 HD3 ARG 65 1HD ARG 65 9.661 5.151 4.335
430 HH11 ARG 65 1HH1 ARG 65 7.340 4.215 4.125
431 HH12 ARG 65 2HH1 ARG 65 5.986 4.408 3.055
432 HH21 ARG 65 1HH2 ARG 65 7.986 5.005 0.222
433 HH22 ARG 65 2HH2 ARG 65 6.354 4.888 0.812
434 H TYR 66 H TYR 66 12.964 0.357 3.897
435 HA TYR 66 HA TYR 66 14.168 1.721 6.167
436 HD1 TYR 66 HD1 TYR 66 12.601 1.285 8.643
437 HD2 TYR 66 HD2 TYR 66 10.839 -0.323 5.120
438 HE1 TYR 66 HE1 TYR 66 10.435 2.237 9.300
439 HE2 TYR 66 HE2 TYR 66 8.663 0.627 5.767
440 HH TYR 66 HH TYR 66 8.331 2.937 8.253
441 HB2 TYR 66 2HB TYR 66 13.025 -1.056 5.850
442 HB3 TYR 66 1HB TYR 66 13.731 -0.456 7.347
Start of MODEL 17
1 H1 GLY 7 1H GLY 7 -18.552 -0.031 7.730
2 HA2 GLY 7 2HA GLY 7 -17.905 0.920 5.103
3 HA3 GLY 7 1HA GLY 7 -19.006 1.676 6.250
4 H ALA 8 H ALA 8 -15.623 1.270 5.406
5 HA ALA 8 HA ALA 8 -15.006 3.746 6.898
6 HB1 ALA 8 3HB ALA 8 -12.717 2.865 7.132
7 HB2 ALA 8 1HB ALA 8 -13.215 1.383 6.316
8 HB3 ALA 8 2HB ALA 8 -13.913 1.807 7.880
9 H LYS 9 H LYS 9 -12.604 4.425 5.883
10 HA LYS 9 HA LYS 9 -13.093 4.626 2.996
11 HB2 LYS 9 2HB LYS 9 -11.940 6.727 2.960
12 HB3 LYS 9 1HB LYS 9 -13.135 6.804 4.240
13 HG2 LYS 9 2HG LYS 9 -11.355 7.773 5.271
14 HG3 LYS 9 1HG LYS 9 -11.103 6.095 5.747
15 HD2 LYS 9 2HD LYS 9 -9.005 7.084 5.016
16 HD3 LYS 9 1HD LYS 9 -9.512 5.830 3.885
17 HE2 LYS 9 2HE LYS 9 -10.476 7.631 2.436
18 HE3 LYS 9 1HE LYS 9 -9.757 8.816 3.529
19 HZ1 LYS 9 3HZ LYS 9 -7.570 7.848 3.029
20 HZ2 LYS 9 1HZ LYS 9 -8.326 8.447 1.630
21 HZ3 LYS 9 2HZ LYS 9 -8.297 6.777 1.935
22 H CYS 10 H CYS 10 -11.460 4.127 1.621
23 HA CYS 10 HA CYS 10 -9.748 2.073 2.419
24 HB2 CYS 10 2HB CYS 10 -10.676 2.458 0.135
25 HB3 CYS 10 1HB CYS 10 -9.578 3.812 -0.043
26 H GLY 11 H GLY 11 -7.791 2.101 3.297
27 HA2 GLY 11 2HA GLY 11 -6.341 4.408 3.957
28 HA3 GLY 11 1HA GLY 11 -5.681 2.779 3.904
29 H ALA 12 H ALA 12 -6.742 2.999 0.909
30 HA ALA 12 HA ALA 12 -4.332 4.368 -0.093
31 HB1 ALA 12 3HB ALA 12 -5.893 2.140 -1.390
32 HB2 ALA 12 1HB ALA 12 -4.354 1.963 -0.547
33 HB3 ALA 12 2HB ALA 12 -4.441 2.905 -2.036
34 H CYS 13 H CYS 13 -7.736 3.658 -0.868
35 HA CYS 13 HA CYS 13 -7.847 5.764 -2.865
36 HB2 CYS 13 2HB CYS 13 -10.069 4.090 -1.672
37 HB3 CYS 13 1HB CYS 13 -10.217 5.146 -3.066
38 H GLU 14 H GLU 14 -9.325 7.570 -2.726
39 HA GLU 14 HA GLU 14 -10.098 8.394 -0.044
40 HB2 GLU 14 2HB GLU 14 -10.043 9.649 -2.718
41 HB3 GLU 14 1HB GLU 14 -11.311 10.179 -1.620
42 HG2 GLU 14 2HG GLU 14 -9.192 11.494 -1.586
43 HG3 GLU 14 1HG GLU 14 -9.771 10.938 -0.027
44 H LYS 15 H LYS 15 -11.100 6.177 -2.073
45 HA LYS 15 HA LYS 15 -13.957 6.591 -2.087
46 HB2 LYS 15 2HB LYS 15 -12.534 3.997 -2.663
47 HB3 LYS 15 1HB LYS 15 -14.085 4.545 -3.276
48 HG2 LYS 15 2HG LYS 15 -12.995 6.173 -4.685
49 HG3 LYS 15 1HG LYS 15 -11.421 5.739 -4.011
50 HD2 LYS 15 2HD LYS 15 -11.893 3.379 -4.824
51 HD3 LYS 15 1HD LYS 15 -13.232 4.073 -5.741
52 HE2 LYS 15 2HE LYS 15 -11.294 3.879 -7.166
53 HE3 LYS 15 1HE LYS 15 -11.636 5.579 -6.863
54 HZ1 LYS 15 3HZ LYS 15 -9.575 3.983 -5.430
55 HZ2 LYS 15 1HZ LYS 15 -9.875 5.640 -5.238
56 HZ3 LYS 15 2HZ LYS 15 -9.261 5.058 -6.705
57 H THR 16 H THR 16 -15.364 4.827 -1.174
58 HA THR 16 HA THR 16 -14.551 4.296 1.557
59 HB THR 16 HB THR 16 -17.018 3.203 1.320
60 HG1 THR 16 HG1 THR 16 -18.148 4.145 -0.230
61 HG21 THR 16 3HG2 THR 16 -17.873 5.305 2.276
62 HG22 THR 16 1HG2 THR 16 -16.371 6.112 1.821
63 HG23 THR 16 2HG2 THR 16 -16.351 4.820 3.021
64 H VAL 17 H VAL 17 -14.391 2.322 2.496
65 HA VAL 17 HA VAL 17 -14.200 -0.013 0.727
66 HB VAL 17 HB VAL 17 -13.136 0.514 3.507
67 HG11 VAL 17 1HG1 VAL 17 -13.914 -1.804 3.401
68 HG12 VAL 17 2HG1 VAL 17 -12.151 -1.725 3.451
69 HG13 VAL 17 3HG1 VAL 17 -12.977 -2.052 1.927
70 HG21 VAL 17 3HG2 VAL 17 -11.759 -0.085 0.900
71 HG22 VAL 17 1HG2 VAL 17 -10.962 0.149 2.456
72 HG23 VAL 17 2HG2 VAL 17 -11.838 1.485 1.706
73 H TYR 18 H TYR 18 -15.483 -1.793 1.030
74 HA TYR 18 HA TYR 18 -17.412 -1.724 3.252
75 HD1 TYR 18 HD2 TYR 18 -19.813 -0.206 2.755
76 HD2 TYR 18 HD1 TYR 18 -17.665 -0.579 -0.895
77 HE1 TYR 18 HE2 TYR 18 -20.369 2.121 2.201
78 HE2 TYR 18 HE1 TYR 18 -18.219 1.750 -1.465
79 HH TYR 18 HH TYR 18 -19.549 3.934 0.815
80 HB2 TYR 18 2HB TYR 18 -18.135 -2.507 0.415
81 HB3 TYR 18 1HB TYR 18 -19.220 -2.427 1.796
82 H HIS 19 H HIS 19 -18.586 -4.057 3.198
83 HA HIS 19 HA HIS 19 -16.513 -5.950 3.578
84 HD1 HIS 19 HD1 HIS 19 -21.029 -5.369 4.440
85 HD2 HIS 19 HD2 HIS 19 -19.719 -8.090 1.569
86 HE1 HIS 19 HE1 HIS 19 -23.048 -5.928 3.052
87 HE2 HIS 19 HE2 HIS 19 -22.236 -7.561 1.312
88 HB2 HIS 19 2HB HIS 19 -18.213 -7.577 4.085
89 HB3 HIS 19 1HB HIS 19 -18.673 -6.047 4.810
90 H ALA 20 H ALA 20 -18.078 -4.872 0.815
91 HA ALA 20 HA ALA 20 -18.080 -6.996 -0.946
92 HB1 ALA 20 3HB ALA 20 -17.741 -5.350 -2.715
93 HB2 ALA 20 1HB ALA 20 -17.216 -4.162 -1.525
94 HB3 ALA 20 2HB ALA 20 -18.880 -4.746 -1.511
95 H GLU 21 H GLU 21 -15.363 -5.031 0.181
96 HA GLU 21 HA GLU 21 -13.564 -7.175 -0.386
97 HB2 GLU 21 2HB GLU 21 -12.079 -5.998 -1.887
98 HB3 GLU 21 1HB GLU 21 -13.660 -6.178 -2.609
99 HG2 GLU 21 2HG GLU 21 -14.129 -3.807 -2.076
100 HG3 GLU 21 1HG GLU 21 -12.503 -3.674 -1.406
101 H GLU 22 H GLU 22 -14.056 -6.375 2.004
102 HA GLU 22 HA GLU 22 -12.216 -4.286 2.843
103 HB2 GLU 22 2HB GLU 22 -14.412 -4.387 3.909
104 HB3 GLU 22 1HB GLU 22 -14.110 -6.042 4.419
105 HG2 GLU 22 2HG GLU 22 -12.103 -5.089 5.687
106 HG3 GLU 22 1HG GLU 22 -12.851 -3.515 5.423
107 H ILE 23 H ILE 23 -10.171 -4.711 3.317
108 HA ILE 23 HA ILE 23 -9.623 -7.157 4.869
109 HB ILE 23 HB ILE 23 -7.856 -5.893 2.762
110 HG12 ILE 23 2HG1 ILE 23 -8.518 -8.804 3.076
111 HG13 ILE 23 1HG1 ILE 23 -9.626 -7.719 2.232
112 HG21 ILE 23 1HG2 ILE 23 -7.109 -7.967 4.822
113 HG22 ILE 23 2HG2 ILE 23 -6.503 -6.313 4.739
114 HG23 ILE 23 3HG2 ILE 23 -6.104 -7.464 3.464
115 HD11 ILE 23 3HD1 ILE 23 -6.761 -8.293 1.502
116 HD12 ILE 23 1HD1 ILE 23 -7.821 -7.162 0.661
117 HD13 ILE 23 2HD1 ILE 23 -8.197 -8.885 0.668
118 H GLN 24 H GLN 24 -9.081 -6.613 6.892
119 HA GLN 24 HA GLN 24 -7.988 -3.941 7.384
120 HB2 GLN 24 2HB GLN 24 -9.028 -6.018 9.330
121 HB3 GLN 24 1HB GLN 24 -8.455 -4.412 9.768
122 HG2 GLN 24 2HG GLN 24 -10.247 -3.457 8.336
123 HG3 GLN 24 1HG GLN 24 -10.863 -5.090 8.103
124 HE21 GLN 24 1HE2 GLN 24 -9.476 -3.986 11.104
125 HE22 GLN 24 2HE2 GLN 24 -10.948 -3.969 12.015
126 H CYS 25 H CYS 25 -5.852 -3.911 7.115
127 HA CYS 25 HA CYS 25 -4.308 -6.212 8.110
128 HG CYS 25 HG CYS 25 -1.472 -5.780 5.043
129 HB2 CYS 25 2HB CYS 25 -4.246 -6.018 5.665
130 HB3 CYS 25 1HB CYS 25 -3.671 -4.360 5.806
131 H ASN 26 H ASN 26 -3.109 -5.797 9.792
132 HA ASN 26 HA ASN 26 -1.547 -4.884 11.142
133 HB2 ASN 26 2HB ASN 26 -0.409 -4.253 9.022
134 HB3 ASN 26 1HB ASN 26 -1.248 -2.708 9.068
135 HD21 ASN 26 1HD2 ASN 26 0.734 -1.629 9.127
136 HD22 ASN 26 2HD2 ASN 26 1.672 -1.550 10.577
137 H GLY 27 H GLY 27 -3.690 -2.374 9.772
138 HA2 GLY 27 2HA GLY 27 -4.417 -1.617 12.483
139 HA3 GLY 27 1HA GLY 27 -3.560 -0.387 11.572
140 H ARG 28 H ARG 28 -4.692 -0.716 9.039
141 HA ARG 28 HA ARG 28 -7.404 0.253 9.649
142 HE ARG 28 HE ARG 28 -5.897 4.204 11.333
143 HB2 ARG 28 2HB ARG 28 -5.467 1.254 7.558
144 HB3 ARG 28 1HB ARG 28 -7.129 1.804 7.727
145 HG2 ARG 28 2HG ARG 28 -4.907 2.119 9.730
146 HG3 ARG 28 1HG ARG 28 -5.678 3.394 8.780
147 HD2 ARG 28 2HD ARG 28 -7.718 3.161 9.952
148 HD3 ARG 28 1HD ARG 28 -7.205 1.642 10.686
149 HH11 ARG 28 1HH1 ARG 28 -7.533 1.263 12.320
150 HH12 ARG 28 2HH1 ARG 28 -7.168 1.474 14.006
151 HH21 ARG 28 1HH2 ARG 28 -5.427 4.494 13.538
152 HH22 ARG 28 2HH2 ARG 28 -5.981 3.330 14.706
153 H SER 29 H SER 29 -8.699 0.467 7.495
154 HA SER 29 HA SER 29 -8.806 -2.252 6.410
155 HG SER 29 HG SER 29 -11.819 -1.529 8.036
156 HB2 SER 29 2HB SER 29 -10.925 -0.094 6.280
157 HB3 SER 29 1HB SER 29 -11.133 -1.820 5.974
158 H PHE 30 H PHE 30 -8.415 -2.653 4.344
159 HA PHE 30 HA PHE 30 -8.304 -0.400 2.445
160 HD1 PHE 30 HD1 PHE 30 -5.892 0.812 2.887
161 HD2 PHE 30 HD2 PHE 30 -5.331 -3.162 4.296
162 HE1 PHE 30 HE1 PHE 30 -4.407 1.651 4.660
163 HE2 PHE 30 HE2 PHE 30 -3.850 -2.328 6.072
164 HZ PHE 30 HZ PHE 30 -3.385 0.080 6.255
165 HB2 PHE 30 2HB PHE 30 -6.486 -2.811 2.322
166 HB3 PHE 30 1HB PHE 30 -6.325 -1.285 1.459
167 H HIS 31 H HIS 31 -8.660 -1.073 0.190
168 HA HIS 31 HA HIS 31 -10.723 -3.016 -0.094
169 HD2 HIS 31 HD2 HIS 31 -12.691 -1.828 -0.589
170 HE1 HIS 31 HE1 HIS 31 -12.200 1.993 -2.310
171 HE2 HIS 31 HE2 HIS 31 -13.703 0.544 -0.903
172 HB2 HIS 31 2HB HIS 31 -9.082 -1.494 -2.111
173 HB3 HIS 31 1HB HIS 31 -10.286 -2.684 -2.590
174 H LYS 32 H LYS 32 -10.635 -4.920 -1.473
175 HA LYS 32 HA LYS 32 -8.396 -6.603 -1.094
176 HB2 LYS 32 2HB LYS 32 -10.656 -7.488 -1.532
177 HB3 LYS 32 1HB LYS 32 -10.618 -6.800 -3.148
178 HG2 LYS 32 2HG LYS 32 -8.653 -8.250 -3.642
179 HG3 LYS 32 1HG LYS 32 -8.901 -9.022 -2.078
180 HD2 LYS 32 2HD LYS 32 -11.051 -8.876 -4.177
181 HD3 LYS 32 1HD LYS 32 -9.890 -10.198 -4.096
182 HE2 LYS 32 2HE LYS 32 -11.807 -10.965 -2.959
183 HE3 LYS 32 1HE LYS 32 -10.646 -10.538 -1.703
184 HZ1 LYS 32 3HZ LYS 32 -11.813 -8.503 -1.305
185 HZ2 LYS 32 1HZ LYS 32 -12.924 -9.777 -1.237
186 HZ3 LYS 32 2HZ LYS 32 -12.865 -8.781 -2.608
187 H THR 33 H THR 33 -9.423 -4.443 -3.640
188 HA THR 33 HA THR 33 -7.278 -5.090 -5.434
189 HB THR 33 HB THR 33 -8.030 -2.871 -6.511
190 HG1 THR 33 HG1 THR 33 -10.280 -3.300 -4.799
191 HG21 THR 33 3HG2 THR 33 -9.942 -5.194 -6.265
192 HG22 THR 33 1HG2 THR 33 -8.622 -5.042 -7.424
193 HG23 THR 33 2HG2 THR 33 -10.008 -3.956 -7.518
194 H CYS 34 H CYS 34 -7.353 -3.474 -2.554
195 HA CYS 34 HA CYS 34 -5.012 -1.852 -3.289
196 HB2 CYS 34 2HB CYS 34 -7.080 -1.169 -1.195
197 HB3 CYS 34 1HB CYS 34 -5.743 -0.153 -1.739
198 H PHE 35 H PHE 35 -5.569 -4.612 -2.016
199 HA PHE 35 HA PHE 35 -4.266 -4.284 0.537
200 HD1 PHE 35 HD1 PHE 35 -4.618 -5.453 2.527
201 HD2 PHE 35 HD2 PHE 35 -3.765 -8.620 -0.183
202 HE1 PHE 35 HE1 PHE 35 -3.519 -6.708 4.340
203 HE2 PHE 35 HE2 PHE 35 -2.666 -9.875 1.617
204 HZ PHE 35 HZ PHE 35 -2.438 -8.769 3.910
205 HB2 PHE 35 2HB PHE 35 -5.979 -6.046 0.237
206 HB3 PHE 35 1HB PHE 35 -4.930 -6.838 -0.940
207 H HIS 36 H HIS 36 -3.369 -4.609 -2.679
208 HA HIS 36 HA HIS 36 -0.806 -5.791 -2.057
209 HD1 HIS 36 HD1 HIS 36 -3.584 -6.116 -5.663
210 HD2 HIS 36 HD2 HIS 36 -1.270 -2.697 -5.138
211 HE1 HIS 36 HE1 HIS 36 -4.603 -4.369 -7.154
212 HE2 HIS 36 HE2 HIS 36 -3.289 -2.274 -6.702
213 HB2 HIS 36 2HB HIS 36 -0.314 -5.510 -4.490
214 HB3 HIS 36 1HB HIS 36 -1.708 -6.518 -4.139
215 H CYS 37 H CYS 37 1.084 -4.513 -3.354
216 HA CYS 37 HA CYS 37 1.785 -2.745 -1.371
217 HB2 CYS 37 2HB CYS 37 3.322 -3.993 -2.860
218 HB3 CYS 37 1HB CYS 37 2.968 -2.835 -4.136
219 H MET 38 H MET 38 1.515 -0.741 -0.936
220 HA MET 38 HA MET 38 0.003 1.045 -2.568
221 HB2 MET 38 2HB MET 38 1.662 1.669 -0.114
222 HB3 MET 38 1HB MET 38 0.387 2.666 -0.795
223 HG2 MET 38 2HG MET 38 0.006 -0.067 0.401
224 HG3 MET 38 1HG MET 38 -0.321 1.462 1.215
225 HE1 MET 38 3HE MET 38 -2.455 -0.842 1.036
226 HE2 MET 38 1HE MET 38 -3.903 0.075 0.623
227 HE3 MET 38 2HE MET 38 -2.759 0.719 1.801
228 H ALA 39 H ALA 39 3.371 0.332 -2.171
229 HA ALA 39 HA ALA 39 4.232 3.000 -2.892
230 HB1 ALA 39 3HB ALA 39 6.494 2.165 -2.520
231 HB2 ALA 39 1HB ALA 39 5.856 0.537 -2.298
232 HB3 ALA 39 2HB ALA 39 5.436 1.811 -1.153
233 H CYS 40 H CYS 40 4.397 -0.262 -4.322
234 HA CYS 40 HA CYS 40 4.969 1.103 -6.857
235 HB2 CYS 40 2HB CYS 40 5.963 -0.984 -7.700
236 HB3 CYS 40 1HB CYS 40 6.810 -0.393 -6.283
237 H ARG 41 H ARG 41 3.985 -2.209 -6.619
238 HA ARG 41 HA ARG 41 1.239 -1.946 -6.361
239 HE ARG 41 HE ARG 41 -2.451 -0.517 -8.206
240 HB2 ARG 41 2HB ARG 41 1.863 -0.945 -8.807
241 HB3 ARG 41 1HB ARG 41 1.598 -2.638 -9.214
242 HG2 ARG 41 2HG ARG 41 -0.428 -1.239 -9.443
243 HG3 ARG 41 1HG ARG 41 -0.622 -2.565 -8.293
244 HD2 ARG 41 2HD ARG 41 -0.210 -1.031 -6.438
245 HD3 ARG 41 1HD ARG 41 0.021 0.296 -7.577
246 HH11 ARG 41 1HH1 ARG 41 -0.978 0.091 -5.074
247 HH12 ARG 41 2HH1 ARG 41 -2.451 0.656 -4.352
248 HH21 ARG 41 1HH2 ARG 41 -4.385 0.199 -7.243
249 HH22 ARG 41 2HH2 ARG 41 -4.396 0.730 -5.584
250 H LYS 42 H LYS 42 3.826 -3.657 -6.140
251 HA LYS 42 HA LYS 42 3.422 -6.172 -7.247
252 HB2 LYS 42 2HB LYS 42 5.481 -5.550 -6.106
253 HB3 LYS 42 1HB LYS 42 4.623 -5.391 -4.583
254 HG2 LYS 42 2HG LYS 42 5.804 -7.433 -4.502
255 HG3 LYS 42 1HG LYS 42 4.104 -7.841 -4.732
256 HD2 LYS 42 2HD LYS 42 4.474 -8.257 -7.080
257 HD3 LYS 42 1HD LYS 42 6.144 -7.699 -6.952
258 HE2 LYS 42 2HE LYS 42 6.648 -9.540 -5.427
259 HE3 LYS 42 1HE LYS 42 4.977 -10.088 -5.531
260 HZ1 LYS 42 3HZ LYS 42 5.298 -10.502 -7.890
261 HZ2 LYS 42 1HZ LYS 42 6.422 -11.371 -6.968
262 HZ3 LYS 42 2HZ LYS 42 6.900 -9.968 -7.786
263 H ALA 43 H ALA 43 2.089 -7.863 -6.770
264 HA ALA 43 HA ALA 43 -0.167 -7.302 -5.089
265 HB1 ALA 43 3HB ALA 43 0.522 -9.815 -6.602
266 HB2 ALA 43 1HB ALA 43 -0.452 -8.475 -7.208
267 HB3 ALA 43 2HB ALA 43 -1.032 -9.447 -5.854
268 H LEU 44 H LEU 44 -0.161 -7.595 -2.984
269 HA LEU 44 HA LEU 44 1.712 -9.439 -1.735
270 HG LEU 44 HG LEU 44 2.054 -6.560 0.519
271 HB2 LEU 44 2HB LEU 44 -0.003 -7.195 -0.747
272 HB3 LEU 44 1HB LEU 44 0.564 -8.406 0.385
273 HD11 LEU 44 1HD1 LEU 44 4.187 -7.552 -0.156
274 HD12 LEU 44 2HD1 LEU 44 3.328 -8.717 -1.165
275 HD13 LEU 44 3HD1 LEU 44 3.124 -8.747 0.585
276 HD21 LEU 44 3HD2 LEU 44 1.504 -5.483 -1.589
277 HD22 LEU 44 1HD2 LEU 44 2.359 -6.745 -2.473
278 HD23 LEU 44 2HD2 LEU 44 3.249 -5.658 -1.405
279 H ASP 45 H ASP 45 1.084 -10.986 -0.227
280 HA ASP 45 HA ASP 45 -1.763 -11.737 -0.239
281 HB2 ASP 45 2HB ASP 45 0.704 -13.459 0.110
282 HB3 ASP 45 1HB ASP 45 -0.920 -14.016 0.506
283 H SER 46 H SER 46 -2.168 -13.065 1.953
284 HA SER 46 HA SER 46 -1.983 -11.153 3.998
285 HG SER 46 HG SER 46 -2.252 -12.461 6.189
286 HB2 SER 46 2HB SER 46 -3.723 -12.948 3.852
287 HB3 SER 46 1HB SER 46 -2.499 -14.118 4.340
288 H THR 47 H THR 47 0.222 -13.639 3.028
289 HA THR 47 HA THR 47 1.615 -13.546 5.591
290 HB THR 47 HB THR 47 3.014 -15.391 4.517
291 HG1 THR 47 HG1 THR 47 2.375 -16.180 2.609
292 HG21 THR 47 3HG2 THR 47 1.320 -17.087 4.970
293 HG22 THR 47 1HG2 THR 47 0.055 -15.860 4.892
294 HG23 THR 47 2HG2 THR 47 1.256 -15.808 6.182
295 H THR 48 H THR 48 1.949 -12.343 2.359
296 HA THR 48 HA THR 48 4.839 -12.042 2.657
297 HB THR 48 HB THR 48 4.694 -11.233 0.247
298 HG1 THR 48 HG1 THR 48 2.743 -11.898 -0.828
299 HG21 THR 48 3HG2 THR 48 4.451 -13.520 -0.635
300 HG22 THR 48 1HG2 THR 48 3.767 -14.033 0.908
301 HG23 THR 48 2HG2 THR 48 5.440 -13.482 0.824
302 H VAL 49 H VAL 49 2.037 -10.161 3.105
303 HA VAL 49 HA VAL 49 3.002 -7.652 2.252
304 HB VAL 49 HB VAL 49 0.713 -7.617 2.573
305 HG11 VAL 49 1HG1 VAL 49 -0.435 -8.378 4.615
306 HG12 VAL 49 2HG1 VAL 49 1.119 -8.837 5.308
307 HG13 VAL 49 3HG1 VAL 49 0.512 -9.674 3.880
308 HG21 VAL 49 3HG2 VAL 49 1.715 -5.616 3.527
309 HG22 VAL 49 1HG2 VAL 49 1.813 -6.405 5.101
310 HG23 VAL 49 2HG2 VAL 49 0.239 -6.057 4.386
311 H ALA 50 H ALA 50 4.414 -6.315 3.057
312 HA ALA 50 HA ALA 50 5.580 -6.859 5.675
313 HB1 ALA 50 3HB ALA 50 7.329 -5.285 4.975
314 HB2 ALA 50 1HB ALA 50 6.441 -4.971 3.484
315 HB3 ALA 50 2HB ALA 50 7.109 -6.575 3.792
316 H ALA 51 H ALA 51 4.502 -5.953 7.283
317 HA ALA 51 HA ALA 51 3.274 -3.329 6.919
318 HB1 ALA 51 3HB ALA 51 1.890 -5.149 7.834
319 HB2 ALA 51 1HB ALA 51 2.065 -3.811 8.970
320 HB3 ALA 51 2HB ALA 51 3.000 -5.288 9.198
321 H HIS 52 H HIS 52 3.646 -1.641 8.384
322 HA HIS 52 HA HIS 52 5.781 -1.946 10.351
323 HD1 HIS 52 HD1 HIS 52 8.924 -1.328 9.571
324 HD2 HIS 52 HD2 HIS 52 6.643 2.048 10.416
325 HE1 HIS 52 HE1 HIS 52 10.373 0.127 11.025
326 HE2 HIS 52 HE2 HIS 52 8.889 2.046 11.701
327 HB2 HIS 52 2HB HIS 52 6.817 -1.174 8.175
328 HB3 HIS 52 1HB HIS 52 5.845 0.287 8.306
329 H GLU 53 H GLU 53 4.163 -1.699 11.876
330 HA GLU 53 HA GLU 53 2.991 -0.583 13.442
331 HB2 GLU 53 2HB GLU 53 4.161 1.875 12.136
332 HB3 GLU 53 1HB GLU 53 3.263 1.879 13.649
333 HG2 GLU 53 2HG GLU 53 4.937 0.395 14.639
334 HG3 GLU 53 1HG GLU 53 5.848 0.427 13.130
335 H SER 54 H SER 54 2.631 1.526 10.578
336 HA SER 54 HA SER 54 -0.264 1.007 10.708
337 HG SER 54 HG SER 54 -0.974 4.195 9.564
338 HB2 SER 54 2HB SER 54 0.392 3.255 11.647
339 HB3 SER 54 1HB SER 54 0.989 3.682 10.046
340 H GLU 55 H GLU 55 2.579 1.024 8.878
341 HA GLU 55 HA GLU 55 1.244 1.486 6.321
342 HB2 GLU 55 2HB GLU 55 4.158 1.002 6.948
343 HB3 GLU 55 1HB GLU 55 3.506 1.408 5.367
344 HG2 GLU 55 2HG GLU 55 2.731 3.559 6.272
345 HG3 GLU 55 1HG GLU 55 3.481 3.150 7.817
346 H ILE 56 H ILE 56 1.560 0.050 4.534
347 HA ILE 56 HA ILE 56 2.532 -2.645 5.040
348 HB ILE 56 HB ILE 56 0.480 -3.561 5.179
349 HG12 ILE 56 2HG1 ILE 56 0.268 -2.650 2.298
350 HG13 ILE 56 1HG1 ILE 56 0.937 -4.173 2.879
351 HG21 ILE 56 1HG2 ILE 56 -1.610 -2.347 4.735
352 HG22 ILE 56 2HG2 ILE 56 -0.666 -0.978 4.143
353 HG23 ILE 56 3HG2 ILE 56 -0.524 -1.488 5.826
354 HD11 ILE 56 3HD1 ILE 56 -1.938 -3.306 3.090
355 HD12 ILE 56 1HD1 ILE 56 -1.275 -4.830 3.681
356 HD13 ILE 56 2HD1 ILE 56 -1.280 -4.480 1.952
357 H TYR 57 H TYR 57 3.779 -3.290 3.398
358 HA TYR 57 HA TYR 57 3.271 -2.327 0.695
359 HD1 TYR 57 HD1 TYR 57 4.208 0.329 -0.206
360 HD2 TYR 57 HD2 TYR 57 5.530 -0.481 3.752
361 HE1 TYR 57 HE1 TYR 57 3.670 2.639 0.442
362 HE2 TYR 57 HE2 TYR 57 4.993 1.823 4.409
363 HH TYR 57 HH TYR 57 4.555 3.928 3.574
364 HB2 TYR 57 2HB TYR 57 5.993 -2.006 1.996
365 HB3 TYR 57 1HB TYR 57 5.599 -1.637 0.325
366 H CYS 58 H CYS 58 4.881 -3.397 -0.869
367 HA CYS 58 HA CYS 58 5.178 -6.176 -0.254
368 HB2 CYS 58 2HB CYS 58 6.037 -6.432 -2.438
369 HB3 CYS 58 1HB CYS 58 4.885 -5.111 -2.592
370 H LYS 59 H LYS 59 7.258 -7.280 -0.161
371 HA LYS 59 HA LYS 59 8.983 -6.030 1.703
372 HB2 LYS 59 2HB LYS 59 9.308 -8.601 0.155
373 HB3 LYS 59 1HB LYS 59 10.342 -8.097 1.487
374 HG2 LYS 59 2HG LYS 59 8.446 -8.134 3.005
375 HG3 LYS 59 1HG LYS 59 7.372 -8.579 1.676
376 HD2 LYS 59 2HD LYS 59 8.633 -10.656 1.367
377 HD3 LYS 59 1HD LYS 59 9.693 -10.210 2.707
378 HE2 LYS 59 2HE LYS 59 6.711 -10.619 2.912
379 HE3 LYS 59 1HE LYS 59 7.922 -11.820 3.349
380 HZ1 LYS 59 3HZ LYS 59 7.523 -9.169 4.634
381 HZ2 LYS 59 1HZ LYS 59 8.794 -10.229 4.995
382 HZ3 LYS 59 2HZ LYS 59 7.193 -10.688 5.309
383 H VAL 60 H VAL 60 8.839 -5.813 -1.651
384 HA VAL 60 HA VAL 60 11.647 -5.406 -2.130
385 HB VAL 60 HB VAL 60 9.297 -4.572 -3.852
386 HG11 VAL 60 1HG1 VAL 60 11.343 -3.368 -4.394
387 HG12 VAL 60 2HG1 VAL 60 10.949 -4.521 -5.668
388 HG13 VAL 60 3HG1 VAL 60 12.224 -4.891 -4.509
389 HG21 VAL 60 3HG2 VAL 60 10.982 -7.074 -3.950
390 HG22 VAL 60 1HG2 VAL 60 9.761 -6.614 -5.137
391 HG23 VAL 60 2HG2 VAL 60 9.284 -6.977 -3.479
392 H CYS 61 H CYS 61 8.780 -3.291 -1.831
393 HA CYS 61 HA CYS 61 10.353 -0.907 -1.863
394 HB2 CYS 61 2HB CYS 61 7.507 -1.348 -0.995
395 HB3 CYS 61 1HB CYS 61 8.278 0.230 -1.137
396 H TYR 62 H TYR 62 9.062 -2.971 0.673
397 HA TYR 62 HA TYR 62 9.689 -1.365 2.874
398 HD1 TYR 62 HD2 TYR 62 7.424 -2.384 4.455
399 HD2 TYR 62 HD1 TYR 62 11.213 -4.215 5.100
400 HE1 TYR 62 HE2 TYR 62 7.138 -2.112 6.879
401 HE2 TYR 62 HE1 TYR 62 10.932 -3.945 7.530
402 HH TYR 62 HH TYR 62 8.040 -3.320 8.981
403 HB2 TYR 62 2HB TYR 62 8.521 -3.713 2.704
404 HB3 TYR 62 1HB TYR 62 10.152 -4.332 2.941
405 H GLY 63 H GLY 63 11.637 -3.546 0.913
406 HA2 GLY 63 2HA GLY 63 14.035 -3.204 2.426
407 HA3 GLY 63 1HA GLY 63 13.901 -3.931 0.834
408 H ARG 64 H ARG 64 12.685 -1.609 -0.442
409 HA ARG 64 HA ARG 64 15.149 -0.286 -1.064
410 HE ARG 64 HE ARG 64 12.371 2.096 -4.247
411 HB2 ARG 64 2HB ARG 64 13.982 0.836 -2.810
412 HB3 ARG 64 1HB ARG 64 13.357 -0.804 -2.754
413 HG2 ARG 64 2HG ARG 64 11.465 0.145 -1.340
414 HG3 ARG 64 1HG ARG 64 12.035 1.732 -1.858
415 HD2 ARG 64 2HD ARG 64 11.277 -0.497 -3.740
416 HD3 ARG 64 1HD ARG 64 10.180 0.788 -3.242
417 HH11 ARG 64 1HH1 ARG 64 10.107 -0.297 -5.428
418 HH12 ARG 64 2HH1 ARG 64 10.220 0.200 -7.089
419 HH21 ARG 64 1HH2 ARG 64 12.522 2.798 -6.434
420 HH22 ARG 64 2HH2 ARG 64 11.569 1.996 -7.655
421 H ARG 65 H ARG 65 12.436 0.435 0.991
422 HA ARG 65 HA ARG 65 13.083 3.220 1.284
423 HE ARG 65 HE ARG 65 9.362 4.602 2.817
424 HB2 ARG 65 2HB ARG 65 11.385 1.398 3.004
425 HB3 ARG 65 1HB ARG 65 11.536 3.133 3.238
426 HG2 ARG 65 2HG ARG 65 10.550 3.520 1.039
427 HG3 ARG 65 1HG ARG 65 10.400 1.776 0.804
428 HD2 ARG 65 2HD ARG 65 8.277 2.569 1.523
429 HD3 ARG 65 1HD ARG 65 8.998 1.705 2.879
430 HH11 ARG 65 1HH1 ARG 65 7.650 1.860 4.174
431 HH12 ARG 65 2HH1 ARG 65 6.959 2.774 5.484
432 HH21 ARG 65 1HH2 ARG 65 8.448 5.797 4.554
433 HH22 ARG 65 2HH2 ARG 65 7.404 4.998 5.687
434 H TYR 66 H TYR 66 13.444 0.372 3.403
435 HA TYR 66 HA TYR 66 14.946 1.984 5.294
436 HD1 TYR 66 HD1 TYR 66 13.639 1.825 7.915
437 HD2 TYR 66 HD2 TYR 66 11.686 -0.465 4.907
438 HE1 TYR 66 HE1 TYR 66 11.466 2.666 8.690
439 HE2 TYR 66 HE2 TYR 66 9.513 0.375 5.675
440 HH TYR 66 HH TYR 66 8.537 1.281 7.785
441 HB2 TYR 66 2HB TYR 66 13.981 -0.875 5.418
442 HB3 TYR 66 1HB TYR 66 14.793 -0.034 6.734
Start of MODEL 18
1 H1 GLY 7 1H GLY 7 -18.720 3.507 7.401
2 HA2 GLY 7 2HA GLY 7 -17.577 1.093 7.990
3 HA3 GLY 7 1HA GLY 7 -17.379 1.252 6.248
4 H ALA 8 H ALA 8 -15.667 2.318 5.526
5 HA ALA 8 HA ALA 8 -14.495 4.505 7.032
6 HB1 ALA 8 3HB ALA 8 -12.895 2.001 6.476
7 HB2 ALA 8 1HB ALA 8 -13.434 2.543 8.066
8 HB3 ALA 8 2HB ALA 8 -12.268 3.503 7.157
9 H LYS 9 H LYS 9 -12.303 5.107 5.707
10 HA LYS 9 HA LYS 9 -13.000 4.815 2.867
11 HB2 LYS 9 2HB LYS 9 -11.956 6.851 2.345
12 HB3 LYS 9 1HB LYS 9 -12.823 7.195 3.837
13 HG2 LYS 9 2HG LYS 9 -10.830 7.171 5.108
14 HG3 LYS 9 1HG LYS 9 -9.911 6.458 3.778
15 HD2 LYS 9 2HD LYS 9 -11.178 9.199 3.766
16 HD3 LYS 9 1HD LYS 9 -9.466 8.867 4.040
17 HE2 LYS 9 2HE LYS 9 -10.938 8.043 1.541
18 HE3 LYS 9 1HE LYS 9 -10.090 9.576 1.700
19 HZ1 LYS 9 3HZ LYS 9 -8.056 8.260 2.211
20 HZ2 LYS 9 1HZ LYS 9 -8.633 8.053 0.635
21 HZ3 LYS 9 2HZ LYS 9 -8.901 6.852 1.797
22 H CYS 10 H CYS 10 -11.417 4.256 1.457
23 HA CYS 10 HA CYS 10 -9.630 2.303 2.348
24 HB2 CYS 10 2HB CYS 10 -10.772 2.531 0.135
25 HB3 CYS 10 1HB CYS 10 -9.651 3.817 -0.250
26 H GLY 11 H GLY 11 -7.655 2.487 3.137
27 HA2 GLY 11 2HA GLY 11 -6.243 4.975 3.249
28 HA3 GLY 11 1HA GLY 11 -5.632 3.409 3.765
29 H ALA 12 H ALA 12 -6.698 2.878 0.740
30 HA ALA 12 HA ALA 12 -4.038 3.369 -0.416
31 HB1 ALA 12 3HB ALA 12 -4.548 1.577 -1.982
32 HB2 ALA 12 1HB ALA 12 -6.159 1.412 -1.283
33 HB3 ALA 12 2HB ALA 12 -4.735 1.024 -0.318
34 H CYS 13 H CYS 13 -7.479 3.315 -1.357
35 HA CYS 13 HA CYS 13 -6.858 5.465 -3.270
36 HB2 CYS 13 2HB CYS 13 -8.420 4.608 -4.814
37 HB3 CYS 13 1HB CYS 13 -7.541 3.197 -4.244
38 H GLU 14 H GLU 14 -9.028 6.723 -3.795
39 HA GLU 14 HA GLU 14 -9.933 7.611 -1.160
40 HB2 GLU 14 2HB GLU 14 -10.150 8.922 -3.876
41 HB3 GLU 14 1HB GLU 14 -10.761 9.613 -2.386
42 HG2 GLU 14 2HG GLU 14 -7.924 9.057 -3.097
43 HG3 GLU 14 1HG GLU 14 -8.676 10.625 -2.845
44 H LYS 15 H LYS 15 -11.001 5.190 -2.445
45 HA LYS 15 HA LYS 15 -13.825 5.959 -2.638
46 HB2 LYS 15 2HB LYS 15 -12.651 3.184 -2.875
47 HB3 LYS 15 1HB LYS 15 -14.276 3.690 -3.307
48 HG2 LYS 15 2HG LYS 15 -13.317 5.106 -5.087
49 HG3 LYS 15 1HG LYS 15 -11.720 4.466 -4.687
50 HD2 LYS 15 2HD LYS 15 -12.907 2.151 -5.002
51 HD3 LYS 15 1HD LYS 15 -14.054 3.098 -5.951
52 HE2 LYS 15 2HE LYS 15 -12.394 2.215 -7.432
53 HE3 LYS 15 1HE LYS 15 -12.138 3.954 -7.291
54 HZ1 LYS 15 3HZ LYS 15 -10.395 3.504 -5.649
55 HZ2 LYS 15 1HZ LYS 15 -10.041 2.783 -7.143
56 HZ3 LYS 15 2HZ LYS 15 -10.620 1.841 -5.858
57 H THR 16 H THR 16 -15.343 4.542 -1.363
58 HA THR 16 HA THR 16 -14.400 4.450 1.378
59 HB THR 16 HB THR 16 -16.940 3.821 1.672
60 HG1 THR 16 HG1 THR 16 -18.206 4.669 0.007
61 HG21 THR 16 3HG2 THR 16 -15.888 5.865 2.509
62 HG22 THR 16 1HG2 THR 16 -17.472 6.208 1.813
63 HG23 THR 16 2HG2 THR 16 -16.009 6.589 0.905
64 H VAL 17 H VAL 17 -14.200 2.649 2.582
65 HA VAL 17 HA VAL 17 -14.277 0.099 1.163
66 HB VAL 17 HB VAL 17 -13.046 0.896 3.804
67 HG11 VAL 17 1HG1 VAL 17 -13.031 -1.793 2.441
68 HG12 VAL 17 2HG1 VAL 17 -13.839 -1.402 3.961
69 HG13 VAL 17 3HG1 VAL 17 -12.077 -1.361 3.861
70 HG21 VAL 17 3HG2 VAL 17 -10.940 0.431 2.672
71 HG22 VAL 17 1HG2 VAL 17 -11.855 1.685 1.836
72 HG23 VAL 17 2HG2 VAL 17 -11.818 0.043 1.194
73 H TYR 18 H TYR 18 -15.730 -1.463 1.574
74 HA TYR 18 HA TYR 18 -17.459 -1.188 3.939
75 HD1 TYR 18 HD1 TYR 18 -19.525 0.398 4.005
76 HD2 TYR 18 HD2 TYR 18 -18.330 0.294 -0.074
77 HE1 TYR 18 HE1 TYR 18 -20.032 2.791 3.800
78 HE2 TYR 18 HE2 TYR 18 -18.834 2.690 -0.292
79 HH TYR 18 HH TYR 18 -20.176 4.399 0.773
80 HB2 TYR 18 2HB TYR 18 -18.439 -1.689 1.117
81 HB3 TYR 18 1HB TYR 18 -19.436 -1.778 2.560
82 H HIS 19 H HIS 19 -19.063 -3.304 3.725
83 HA HIS 19 HA HIS 19 -17.366 -5.518 4.207
84 HD1 HIS 19 HD1 HIS 19 -20.736 -7.661 2.612
85 HD2 HIS 19 HD2 HIS 19 -21.592 -3.727 3.667
86 HE1 HIS 19 HE1 HIS 19 -22.850 -7.077 1.386
87 HE2 HIS 19 HE2 HIS 19 -23.223 -4.628 1.862
88 HB2 HIS 19 2HB HIS 19 -19.339 -6.817 4.541
89 HB3 HIS 19 1HB HIS 19 -19.672 -5.211 5.174
90 H ALA 20 H ALA 20 -18.468 -4.171 1.319
91 HA ALA 20 HA ALA 20 -18.733 -6.360 -0.384
92 HB1 ALA 20 3HB ALA 20 -18.207 -4.833 -2.196
93 HB2 ALA 20 1HB ALA 20 -17.531 -3.676 -1.049
94 HB3 ALA 20 2HB ALA 20 -19.254 -4.042 -1.016
95 H GLU 21 H GLU 21 -15.827 -4.684 0.753
96 HA GLU 21 HA GLU 21 -14.216 -6.976 0.197
97 HB2 GLU 21 2HB GLU 21 -12.668 -5.897 -1.359
98 HB3 GLU 21 1HB GLU 21 -14.271 -6.072 -2.046
99 HG2 GLU 21 2HG GLU 21 -14.698 -3.704 -1.638
100 HG3 GLU 21 1HG GLU 21 -13.101 -3.545 -0.907
101 H GLU 22 H GLU 22 -14.608 -5.902 2.596
102 HA GLU 22 HA GLU 22 -12.536 -3.982 3.201
103 HB2 GLU 22 2HB GLU 22 -14.553 -3.829 4.511
104 HB3 GLU 22 1HB GLU 22 -14.431 -5.519 4.987
105 HG2 GLU 22 2HG GLU 22 -12.358 -5.018 6.197
106 HG3 GLU 22 1HG GLU 22 -12.518 -3.322 5.743
107 H ILE 23 H ILE 23 -10.488 -4.555 3.392
108 HA ILE 23 HA ILE 23 -9.915 -7.109 4.742
109 HB ILE 23 HB ILE 23 -9.044 -6.551 2.267
110 HG12 ILE 23 2HG1 ILE 23 -7.259 -7.877 4.313
111 HG13 ILE 23 1HG1 ILE 23 -8.718 -8.620 3.666
112 HG21 ILE 23 1HG2 ILE 23 -6.708 -5.798 2.328
113 HG22 ILE 23 2HG2 ILE 23 -6.904 -5.393 4.033
114 HG23 ILE 23 3HG2 ILE 23 -7.853 -4.547 2.811
115 HD11 ILE 23 3HD1 ILE 23 -6.733 -9.446 2.537
116 HD12 ILE 23 1HD1 ILE 23 -6.304 -7.801 2.070
117 HD13 ILE 23 2HD1 ILE 23 -7.765 -8.547 1.423
118 H GLN 24 H GLN 24 -8.563 -7.026 6.545
119 HA GLN 24 HA GLN 24 -7.937 -4.292 7.434
120 HB2 GLN 24 2HB GLN 24 -8.814 -6.664 9.088
121 HB3 GLN 24 1HB GLN 24 -8.268 -5.130 9.756
122 HG2 GLN 24 2HG GLN 24 -10.108 -3.978 8.657
123 HG3 GLN 24 1HG GLN 24 -10.650 -5.499 7.949
124 HE21 GLN 24 1HE2 GLN 24 -12.650 -5.376 8.928
125 HE22 GLN 24 2HE2 GLN 24 -12.871 -5.638 10.625
126 H CYS 25 H CYS 25 -5.842 -3.994 7.203
127 HA CYS 25 HA CYS 25 -4.012 -6.136 8.021
128 HG CYS 25 HG CYS 25 -0.906 -4.271 5.888
129 HB2 CYS 25 2HB CYS 25 -3.705 -5.219 5.733
130 HB3 CYS 25 1HB CYS 25 -3.415 -3.630 6.426
131 H ASN 26 H ASN 26 -3.537 -5.998 10.077
132 HA ASN 26 HA ASN 26 -2.727 -5.275 12.059
133 HB2 ASN 26 2HB ASN 26 -1.007 -4.032 10.806
134 HB3 ASN 26 1HB ASN 26 -2.103 -2.662 10.660
135 HD21 ASN 26 1HD2 ASN 26 -0.664 -1.298 11.748
136 HD22 ASN 26 2HD2 ASN 26 -0.410 -1.400 13.457
137 H GLY 27 H GLY 27 -4.161 -2.280 10.722
138 HA2 GLY 27 2HA GLY 27 -6.484 -2.571 12.403
139 HA3 GLY 27 1HA GLY 27 -5.371 -1.333 12.970
140 H ARG 28 H ARG 28 -5.850 -2.056 9.570
141 HA ARG 28 HA ARG 28 -7.488 0.359 9.307
142 HE ARG 28 HE ARG 28 -4.960 3.790 10.279
143 HB2 ARG 28 2HB ARG 28 -4.887 -0.204 7.913
144 HB3 ARG 28 1HB ARG 28 -6.103 0.829 7.173
145 HG2 ARG 28 2HG ARG 28 -4.831 1.273 9.865
146 HG3 ARG 28 1HG ARG 28 -4.421 2.125 8.372
147 HD2 ARG 28 2HD ARG 28 -6.600 3.097 8.249
148 HD3 ARG 28 1HD ARG 28 -7.182 2.102 9.582
149 HH11 ARG 28 1HH1 ARG 28 -8.449 3.630 9.946
150 HH12 ARG 28 2HH1 ARG 28 -8.738 4.907 11.099
151 HH21 ARG 28 1HH2 ARG 28 -5.342 5.443 11.794
152 HH22 ARG 28 2HH2 ARG 28 -6.973 5.931 12.147
153 H SER 29 H SER 29 -9.066 0.258 7.847
154 HA SER 29 HA SER 29 -9.506 -2.274 6.500
155 HG SER 29 HG SER 29 -12.322 -1.865 7.919
156 HB2 SER 29 2HB SER 29 -11.246 0.196 6.703
157 HB3 SER 29 1HB SER 29 -11.733 -1.334 5.978
158 H PHE 30 H PHE 30 -8.663 -2.578 4.589
159 HA PHE 30 HA PHE 30 -8.579 -0.352 2.653
160 HD1 PHE 30 HD2 PHE 30 -6.077 0.696 2.382
161 HD2 PHE 30 HD1 PHE 30 -5.663 -2.900 4.616
162 HE1 PHE 30 HE2 PHE 30 -4.372 1.771 3.792
163 HE2 PHE 30 HE1 PHE 30 -3.958 -1.833 6.029
164 HZ PHE 30 HZ PHE 30 -3.310 0.505 5.616
165 HB2 PHE 30 2HB PHE 30 -6.937 -2.902 2.673
166 HB3 PHE 30 1HB PHE 30 -6.796 -1.589 1.512
167 H HIS 31 H HIS 31 -8.881 -1.107 0.363
168 HA HIS 31 HA HIS 31 -11.030 -3.012 0.126
169 HD2 HIS 31 HD2 HIS 31 -12.915 -1.739 -0.179
170 HE1 HIS 31 HE1 HIS 31 -12.594 1.968 -2.169
171 HE2 HIS 31 HE2 HIS 31 -14.112 0.477 -0.808
172 HB2 HIS 31 2HB HIS 31 -9.421 -1.471 -1.916
173 HB3 HIS 31 1HB HIS 31 -10.642 -2.655 -2.372
174 H LYS 32 H LYS 32 -10.949 -4.991 -0.958
175 HA LYS 32 HA LYS 32 -8.645 -6.563 -0.560
176 HB2 LYS 32 2HB LYS 32 -10.974 -7.419 -0.651
177 HB3 LYS 32 1HB LYS 32 -11.008 -7.085 -2.376
178 HG2 LYS 32 2HG LYS 32 -9.261 -8.708 -2.760
179 HG3 LYS 32 1HG LYS 32 -9.130 -9.009 -1.023
180 HD2 LYS 32 2HD LYS 32 -11.452 -9.786 -0.988
181 HD3 LYS 32 1HD LYS 32 -11.574 -9.497 -2.725
182 HE2 LYS 32 2HE LYS 32 -9.861 -11.165 -3.144
183 HE3 LYS 32 1HE LYS 32 -9.653 -11.414 -1.410
184 HZ1 LYS 32 3HZ LYS 32 -11.049 -13.124 -2.397
185 HZ2 LYS 32 1HZ LYS 32 -12.148 -11.944 -2.933
186 HZ3 LYS 32 2HZ LYS 32 -11.920 -12.203 -1.273
187 H THR 33 H THR 33 -9.837 -4.676 -3.238
188 HA THR 33 HA THR 33 -7.895 -5.678 -5.125
189 HB THR 33 HB THR 33 -10.109 -4.823 -5.836
190 HG1 THR 33 HG1 THR 33 -7.757 -3.576 -6.837
191 HG21 THR 33 3HG2 THR 33 -8.992 -2.148 -5.020
192 HG22 THR 33 1HG2 THR 33 -10.377 -2.971 -4.307
193 HG23 THR 33 2HG2 THR 33 -10.460 -2.384 -5.968
194 H CYS 34 H CYS 34 -7.934 -3.383 -2.632
195 HA CYS 34 HA CYS 34 -5.596 -1.982 -3.737
196 HB2 CYS 34 2HB CYS 34 -7.401 -1.123 -1.472
197 HB3 CYS 34 1HB CYS 34 -6.112 -0.177 -2.203
198 H PHE 35 H PHE 35 -5.786 -4.630 -2.217
199 HA PHE 35 HA PHE 35 -4.573 -4.077 0.328
200 HD1 PHE 35 HD2 PHE 35 -4.866 -5.585 2.422
201 HD2 PHE 35 HD1 PHE 35 -3.434 -8.242 -0.578
202 HE1 PHE 35 HE2 PHE 35 -3.575 -6.802 4.126
203 HE2 PHE 35 HE1 PHE 35 -2.148 -9.473 1.119
204 HZ PHE 35 HZ PHE 35 -2.172 -8.712 3.473
205 HB2 PHE 35 2HB PHE 35 -6.046 -5.998 0.131
206 HB3 PHE 35 1HB PHE 35 -5.034 -6.684 -1.135
207 H HIS 36 H HIS 36 -3.398 -4.403 -2.828
208 HA HIS 36 HA HIS 36 -0.887 -5.544 -1.955
209 HD1 HIS 36 HD1 HIS 36 -3.410 -6.988 -4.815
210 HD2 HIS 36 HD2 HIS 36 -2.101 -3.160 -5.774
211 HE1 HIS 36 HE1 HIS 36 -5.070 -6.106 -6.491
212 HE2 HIS 36 HE2 HIS 36 -4.276 -3.778 -7.053
213 HB2 HIS 36 2HB HIS 36 -0.337 -5.053 -4.528
214 HB3 HIS 36 1HB HIS 36 -1.142 -6.500 -3.955
215 H CYS 37 H CYS 37 1.090 -4.435 -3.324
216 HA CYS 37 HA CYS 37 1.900 -2.730 -1.343
217 HB2 CYS 37 2HB CYS 37 3.359 -4.001 -2.920
218 HB3 CYS 37 1HB CYS 37 3.046 -2.762 -4.130
219 H MET 38 H MET 38 1.711 -0.727 -0.859
220 HA MET 38 HA MET 38 0.125 1.079 -2.395
221 HB2 MET 38 2HB MET 38 1.812 1.617 0.058
222 HB3 MET 38 1HB MET 38 0.527 2.639 -0.564
223 HG2 MET 38 2HG MET 38 0.156 -0.160 0.459
224 HG3 MET 38 1HG MET 38 -0.145 1.310 1.387
225 HE1 MET 38 3HE MET 38 -3.700 -0.244 0.557
226 HE2 MET 38 1HE MET 38 -2.597 0.212 1.854
227 HE3 MET 38 2HE MET 38 -2.198 -1.141 0.795
228 H ALA 39 H ALA 39 3.486 0.381 -2.206
229 HA ALA 39 HA ALA 39 4.302 3.068 -2.945
230 HB1 ALA 39 3HB ALA 39 5.984 0.596 -2.576
231 HB2 ALA 39 1HB ALA 39 5.630 1.797 -1.333
232 HB3 ALA 39 2HB ALA 39 6.574 2.250 -2.753
233 H CYS 40 H CYS 40 4.704 -0.197 -4.390
234 HA CYS 40 HA CYS 40 5.129 1.165 -6.944
235 HB2 CYS 40 2HB CYS 40 5.977 -0.990 -7.788
236 HB3 CYS 40 1HB CYS 40 6.878 -0.440 -6.385
237 H ARG 41 H ARG 41 3.973 -2.064 -6.693
238 HA ARG 41 HA ARG 41 1.253 -1.754 -6.427
239 HE ARG 41 HE ARG 41 -0.609 0.776 -8.353
240 HB2 ARG 41 2HB ARG 41 1.571 -0.498 -8.662
241 HB3 ARG 41 1HB ARG 41 1.841 -2.087 -9.365
242 HG2 ARG 41 2HG ARG 41 -0.483 -1.287 -9.606
243 HG3 ARG 41 1HG ARG 41 -0.355 -2.814 -8.730
244 HD2 ARG 41 2HD ARG 41 -1.938 -1.416 -7.594
245 HD3 ARG 41 1HD ARG 41 -0.487 -1.533 -6.600
246 HH11 ARG 41 1HH1 ARG 41 -1.179 -0.495 -5.143
247 HH12 ARG 41 2HH1 ARG 41 -1.315 1.069 -4.404
248 HH21 ARG 41 1HH2 ARG 41 -0.779 2.839 -7.385
249 HH22 ARG 41 2HH2 ARG 41 -1.087 2.967 -5.678
250 H LYS 42 H LYS 42 3.695 -3.451 -6.127
251 HA LYS 42 HA LYS 42 3.420 -5.915 -7.439
252 HB2 LYS 42 2HB LYS 42 5.434 -5.197 -6.217
253 HB3 LYS 42 1HB LYS 42 4.548 -5.263 -4.705
254 HG2 LYS 42 2HG LYS 42 5.937 -7.192 -4.861
255 HG3 LYS 42 1HG LYS 42 4.258 -7.704 -5.042
256 HD2 LYS 42 2HD LYS 42 4.508 -8.151 -7.301
257 HD3 LYS 42 1HD LYS 42 5.917 -7.100 -7.457
258 HE2 LYS 42 2HE LYS 42 5.920 -9.635 -5.835
259 HE3 LYS 42 1HE LYS 42 6.390 -9.575 -7.534
260 HZ1 LYS 42 3HZ LYS 42 8.275 -8.394 -7.067
261 HZ2 LYS 42 1HZ LYS 42 8.168 -9.347 -5.671
262 HZ3 LYS 42 2HZ LYS 42 7.664 -7.724 -5.637
263 H ALA 43 H ALA 43 2.215 -7.719 -6.981
264 HA ALA 43 HA ALA 43 -0.043 -7.418 -5.241
265 HB1 ALA 43 3HB ALA 43 -0.224 -8.651 -7.346
266 HB2 ALA 43 1HB ALA 43 -0.659 -9.662 -5.968
267 HB3 ALA 43 2HB ALA 43 0.915 -9.854 -6.740
268 H LEU 44 H LEU 44 -0.190 -8.009 -3.163
269 HA LEU 44 HA LEU 44 2.070 -9.468 -2.005
270 HG LEU 44 HG LEU 44 2.338 -6.609 0.253
271 HB2 LEU 44 2HB LEU 44 0.278 -7.340 -0.940
272 HB3 LEU 44 1HB LEU 44 0.920 -8.522 0.185
273 HD11 LEU 44 1HD1 LEU 44 3.638 -8.769 -1.403
274 HD12 LEU 44 2HD1 LEU 44 3.506 -8.736 0.357
275 HD13 LEU 44 3HD1 LEU 44 4.493 -7.534 -0.478
276 HD21 LEU 44 3HD2 LEU 44 3.487 -5.764 -1.758
277 HD22 LEU 44 1HD2 LEU 44 1.736 -5.559 -1.816
278 HD23 LEU 44 2HD2 LEU 44 2.501 -6.850 -2.741
279 H ASP 45 H ASP 45 1.801 -11.287 -0.968
280 HA ASP 45 HA ASP 45 -0.894 -12.382 -0.611
281 HB2 ASP 45 2HB ASP 45 0.839 -13.781 -1.752
282 HB3 ASP 45 1HB ASP 45 1.822 -13.708 -0.295
283 H SER 46 H SER 46 -1.324 -13.403 1.522
284 HA SER 46 HA SER 46 -0.918 -11.480 3.538
285 HG SER 46 HG SER 46 -1.739 -15.170 3.900
286 HB2 SER 46 2HB SER 46 -2.014 -13.319 4.983
287 HB3 SER 46 1HB SER 46 -2.939 -12.641 3.642
288 H THR 47 H THR 47 1.049 -14.094 2.566
289 HA THR 47 HA THR 47 2.423 -14.118 5.160
290 HB THR 47 HB THR 47 1.843 -16.313 4.152
291 HG1 THR 47 HG1 THR 47 4.563 -15.603 4.562
292 HG21 THR 47 3HG2 THR 47 2.123 -15.783 1.794
293 HG22 THR 47 1HG2 THR 47 3.173 -17.128 2.242
294 HG23 THR 47 2HG2 THR 47 3.849 -15.512 2.036
295 H THR 48 H THR 48 2.632 -12.446 2.269
296 HA THR 48 HA THR 48 5.570 -12.250 2.458
297 HB THR 48 HB THR 48 5.480 -11.470 0.064
298 HG1 THR 48 HG1 THR 48 3.607 -11.825 -1.088
299 HG21 THR 48 3HG2 THR 48 6.186 -13.733 0.640
300 HG22 THR 48 1HG2 THR 48 5.248 -13.742 -0.855
301 HG23 THR 48 2HG2 THR 48 4.505 -14.270 0.655
302 H VAL 49 H VAL 49 2.642 -10.459 2.698
303 HA VAL 49 HA VAL 49 3.622 -7.916 1.971
304 HB VAL 49 HB VAL 49 1.302 -7.995 2.070
305 HG11 VAL 49 1HG1 VAL 49 1.064 -10.016 3.425
306 HG12 VAL 49 2HG1 VAL 49 0.011 -8.738 4.036
307 HG13 VAL 49 3HG1 VAL 49 1.518 -9.115 4.871
308 HG21 VAL 49 3HG2 VAL 49 0.615 -6.394 3.783
309 HG22 VAL 49 1HG2 VAL 49 2.138 -5.925 3.029
310 HG23 VAL 49 2HG2 VAL 49 2.137 -6.652 4.635
311 H ALA 50 H ALA 50 4.733 -6.401 2.991
312 HA ALA 50 HA ALA 50 5.664 -6.965 5.717
313 HB1 ALA 50 3HB ALA 50 7.398 -6.607 3.997
314 HB2 ALA 50 1HB ALA 50 7.452 -5.380 5.263
315 HB3 ALA 50 2HB ALA 50 6.742 -4.998 3.695
316 H ALA 51 H ALA 51 4.328 -6.073 7.168
317 HA ALA 51 HA ALA 51 3.292 -3.381 6.636
318 HB1 ALA 51 3HB ALA 51 2.249 -5.450 8.562
319 HB2 ALA 51 1HB ALA 51 1.587 -5.108 6.965
320 HB3 ALA 51 2HB ALA 51 1.531 -3.875 8.223
321 H HIS 52 H HIS 52 4.837 -2.064 7.409
322 HA HIS 52 HA HIS 52 5.829 -2.488 10.136
323 HD1 HIS 52 HD1 HIS 52 9.325 -2.341 9.647
324 HD2 HIS 52 HD2 HIS 52 7.184 1.032 10.824
325 HE1 HIS 52 HE1 HIS 52 10.677 -1.281 11.485
326 HE2 HIS 52 HE2 HIS 52 9.306 0.677 12.272
327 HB2 HIS 52 2HB HIS 52 7.378 -1.895 8.163
328 HB3 HIS 52 1HB HIS 52 6.671 -0.286 8.244
329 H GLU 53 H GLU 53 4.595 -1.652 11.666
330 HA GLU 53 HA GLU 53 3.011 -0.446 12.742
331 HB2 GLU 53 2HB GLU 53 3.764 1.783 10.835
332 HB3 GLU 53 1HB GLU 53 2.873 1.965 12.337
333 HG2 GLU 53 2HG GLU 53 5.741 1.101 12.044
334 HG3 GLU 53 1HG GLU 53 5.165 2.661 12.627
335 H SER 54 H SER 54 1.730 1.777 10.712
336 HA SER 54 HA SER 54 -0.416 -0.039 9.931
337 HG SER 54 HG SER 54 -1.967 2.404 11.537
338 HB2 SER 54 2HB SER 54 -0.266 2.975 9.718
339 HB3 SER 54 1HB SER 54 -1.705 1.985 9.478
340 H GLU 55 H GLU 55 2.391 0.701 8.561
341 HA GLU 55 HA GLU 55 1.339 1.331 5.900
342 HB2 GLU 55 2HB GLU 55 4.138 1.439 7.021
343 HB3 GLU 55 1HB GLU 55 3.745 1.754 5.336
344 HG2 GLU 55 2HG GLU 55 2.313 3.615 6.034
345 HG3 GLU 55 1HG GLU 55 2.756 3.309 7.715
346 H ILE 56 H ILE 56 1.016 -0.247 4.537
347 HA ILE 56 HA ILE 56 2.556 -2.737 4.806
348 HB ILE 56 HB ILE 56 0.510 -3.630 5.018
349 HG12 ILE 56 2HG1 ILE 56 0.316 -3.003 2.063
350 HG13 ILE 56 1HG1 ILE 56 1.117 -4.402 2.771
351 HG21 ILE 56 1HG2 ILE 56 -0.559 -1.516 5.405
352 HG22 ILE 56 2HG2 ILE 56 -1.591 -2.522 4.387
353 HG23 ILE 56 3HG2 ILE 56 -0.656 -1.208 3.671
354 HD11 ILE 56 3HD1 ILE 56 -1.822 -3.791 2.963
355 HD12 ILE 56 1HD1 ILE 56 -1.007 -5.210 3.619
356 HD13 ILE 56 2HD1 ILE 56 -1.077 -4.961 1.874
357 H TYR 57 H TYR 57 3.888 -3.295 3.220
358 HA TYR 57 HA TYR 57 3.389 -2.421 0.481
359 HD1 TYR 57 HD1 TYR 57 5.379 -0.620 3.663
360 HD2 TYR 57 HD2 TYR 57 4.335 0.434 -0.318
361 HE1 TYR 57 HE1 TYR 57 4.763 1.624 4.430
362 HE2 TYR 57 HE2 TYR 57 3.709 2.691 0.440
363 HH TYR 57 HH TYR 57 4.327 3.758 3.735
364 HB2 TYR 57 2HB TYR 57 6.085 -1.976 1.794
365 HB3 TYR 57 1HB TYR 57 5.639 -1.560 0.147
366 H CYS 58 H CYS 58 5.076 -3.441 -1.024
367 HA CYS 58 HA CYS 58 5.543 -6.185 -0.300
368 HB2 CYS 58 2HB CYS 58 6.330 -6.493 -2.494
369 HB3 CYS 58 1HB CYS 58 5.108 -5.244 -2.675
370 H LYS 59 H LYS 59 7.655 -7.140 -0.065
371 HA LYS 59 HA LYS 59 9.206 -5.663 1.763
372 HB2 LYS 59 2HB LYS 59 9.730 -8.307 0.416
373 HB3 LYS 59 1HB LYS 59 10.734 -7.648 1.703
374 HG2 LYS 59 2HG LYS 59 8.758 -7.605 3.179
375 HG3 LYS 59 1HG LYS 59 7.813 -8.353 1.892
376 HD2 LYS 59 2HD LYS 59 10.259 -9.559 3.181
377 HD3 LYS 59 1HD LYS 59 8.592 -9.980 3.575
378 HE2 LYS 59 2HE LYS 59 8.253 -10.697 1.239
379 HE3 LYS 59 1HE LYS 59 9.948 -10.342 0.903
380 HZ1 LYS 59 3HZ LYS 59 10.573 -11.988 2.571
381 HZ2 LYS 59 1HZ LYS 59 9.634 -12.679 1.339
382 HZ3 LYS 59 2HZ LYS 59 8.939 -12.350 2.853
383 H VAL 60 H VAL 60 9.292 -5.570 -1.595
384 HA VAL 60 HA VAL 60 12.106 -5.002 -1.853
385 HB VAL 60 HB VAL 60 9.849 -4.467 -3.798
386 HG11 VAL 60 1HG1 VAL 60 11.767 -3.047 -4.247
387 HG12 VAL 60 2HG1 VAL 60 11.637 -4.301 -5.481
388 HG13 VAL 60 3HG1 VAL 60 12.837 -4.447 -4.199
389 HG21 VAL 60 3HG2 VAL 60 10.099 -6.844 -3.297
390 HG22 VAL 60 1HG2 VAL 60 11.821 -6.749 -3.665
391 HG23 VAL 60 2HG2 VAL 60 10.633 -6.490 -4.942
392 H CYS 61 H CYS 61 9.102 -3.066 -1.987
393 HA CYS 61 HA CYS 61 10.442 -0.559 -1.932
394 HB2 CYS 61 2HB CYS 61 7.613 -1.261 -1.132
395 HB3 CYS 61 1HB CYS 61 8.230 0.373 -1.350
396 H TYR 62 H TYR 62 9.282 -2.767 0.512
397 HA TYR 62 HA TYR 62 9.569 -1.164 2.784
398 HD1 TYR 62 HD2 TYR 62 7.992 -2.260 4.902
399 HD2 TYR 62 HD1 TYR 62 11.591 -4.475 4.368
400 HE1 TYR 62 HE2 TYR 62 8.291 -2.356 7.337
401 HE2 TYR 62 HE1 TYR 62 11.893 -4.575 6.805
402 HH TYR 62 HH TYR 62 11.232 -3.565 8.788
403 HB2 TYR 62 2HB TYR 62 8.531 -3.419 2.758
404 HB3 TYR 62 1HB TYR 62 10.126 -4.131 2.525
405 H GLY 63 H GLY 63 11.923 -3.310 1.195
406 HA2 GLY 63 2HA GLY 63 14.100 -2.665 2.885
407 HA3 GLY 63 1HA GLY 63 14.214 -3.391 1.290
408 H ARG 64 H ARG 64 12.839 -1.179 -0.025
409 HA ARG 64 HA ARG 64 15.010 0.457 -0.692
410 HE ARG 64 HE ARG 64 13.007 1.457 -4.660
411 HB2 ARG 64 2HB ARG 64 13.085 0.172 -2.169
412 HB3 ARG 64 1HB ARG 64 12.046 0.981 -1.005
413 HG2 ARG 64 2HG ARG 64 13.392 3.039 -1.306
414 HG3 ARG 64 1HG ARG 64 14.307 2.211 -2.567
415 HD2 ARG 64 2HD ARG 64 11.332 2.715 -2.578
416 HD3 ARG 64 1HD ARG 64 12.531 3.607 -3.511
417 HH11 ARG 64 1HH1 ARG 64 9.921 2.006 -3.124
418 HH12 ARG 64 2HH1 ARG 64 9.078 0.814 -4.061
419 HH21 ARG 64 1HH2 ARG 64 11.897 -0.053 -5.981
420 HH22 ARG 64 2HH2 ARG 64 10.192 -0.311 -5.738
421 H ARG 65 H ARG 65 12.394 0.914 1.619
422 HA ARG 65 HA ARG 65 13.235 3.590 2.302
423 HE ARG 65 HE ARG 65 10.040 4.967 3.854
424 HB2 ARG 65 2HB ARG 65 11.203 1.770 3.604
425 HB3 ARG 65 1HB ARG 65 11.460 3.459 4.018
426 HG2 ARG 65 2HG ARG 65 10.864 4.044 1.664
427 HG3 ARG 65 1HG ARG 65 10.425 2.351 1.421
428 HD2 ARG 65 2HD ARG 65 8.473 3.732 1.947
429 HD3 ARG 65 1HD ARG 65 8.763 2.511 3.186
430 HH11 ARG 65 1HH1 ARG 65 6.899 3.437 3.755
431 HH12 ARG 65 2HH1 ARG 65 6.234 4.387 5.050
432 HH21 ARG 65 1HH2 ARG 65 9.206 6.198 5.577
433 HH22 ARG 65 2HH2 ARG 65 7.557 5.980 6.089
434 H TYR 66 H TYR 66 13.180 0.436 3.928
435 HA TYR 66 HA TYR 66 14.721 1.538 6.142
436 HD1 TYR 66 HD1 TYR 66 13.229 1.143 8.614
437 HD2 TYR 66 HD2 TYR 66 11.248 -0.503 5.227
438 HE1 TYR 66 HE1 TYR 66 11.101 2.071 9.415
439 HE2 TYR 66 HE2 TYR 66 9.113 0.432 6.016
440 HH TYR 66 HH TYR 66 8.089 1.170 8.116
441 HB2 TYR 66 2HB TYR 66 13.481 -1.197 5.786
442 HB3 TYR 66 1HB TYR 66 14.272 -0.618 7.249
Start of MODEL 19
1 H1 GLY 7 1H GLY 7 -19.452 3.303 7.891
2 HA2 GLY 7 2HA GLY 7 -18.775 3.112 5.042
3 HA3 GLY 7 1HA GLY 7 -19.293 4.570 5.882
4 H ALA 8 H ALA 8 -16.626 2.303 5.473
5 HA ALA 8 HA ALA 8 -14.795 4.107 6.859
6 HB1 ALA 8 3HB ALA 8 -13.168 2.296 6.623
7 HB2 ALA 8 1HB ALA 8 -14.321 1.381 5.653
8 HB3 ALA 8 2HB ALA 8 -14.668 1.716 7.349
9 H LYS 9 H LYS 9 -12.491 4.042 5.665
10 HA LYS 9 HA LYS 9 -12.897 4.675 2.831
11 HB2 LYS 9 2HB LYS 9 -11.371 6.285 4.869
12 HB3 LYS 9 1HB LYS 9 -11.127 6.472 3.143
13 HG2 LYS 9 2HG LYS 9 -13.442 7.176 2.879
14 HG3 LYS 9 1HG LYS 9 -13.716 6.935 4.608
15 HD2 LYS 9 2HD LYS 9 -13.331 9.251 4.317
16 HD3 LYS 9 1HD LYS 9 -11.855 8.587 5.013
17 HE2 LYS 9 2HE LYS 9 -11.017 9.946 3.362
18 HE3 LYS 9 1HE LYS 9 -11.093 8.401 2.514
19 HZ1 LYS 9 3HZ LYS 9 -11.971 10.280 1.223
20 HZ2 LYS 9 1HZ LYS 9 -13.185 10.506 2.380
21 HZ3 LYS 9 2HZ LYS 9 -13.134 9.077 1.468
22 H CYS 10 H CYS 10 -11.229 4.108 1.517
23 HA CYS 10 HA CYS 10 -9.736 1.855 2.341
24 HB2 CYS 10 2HB CYS 10 -10.618 2.357 0.046
25 HB3 CYS 10 1HB CYS 10 -9.349 3.558 -0.114
26 H GLY 11 H GLY 11 -7.723 1.690 3.092
27 HA2 GLY 11 2HA GLY 11 -6.108 3.996 3.603
28 HA3 GLY 11 1HA GLY 11 -5.625 2.321 3.831
29 H ALA 12 H ALA 12 -6.664 2.238 0.803
30 HA ALA 12 HA ALA 12 -4.039 2.980 -0.320
31 HB1 ALA 12 3HB ALA 12 -4.611 0.591 -0.509
32 HB2 ALA 12 1HB ALA 12 -4.460 1.364 -2.087
33 HB3 ALA 12 2HB ALA 12 -6.056 1.020 -1.422
34 H CYS 13 H CYS 13 -7.528 3.120 -0.842
35 HA CYS 13 HA CYS 13 -7.218 5.124 -2.946
36 HB2 CYS 13 2HB CYS 13 -9.715 3.995 -1.649
37 HB3 CYS 13 1HB CYS 13 -9.687 5.083 -3.025
38 H GLU 14 H GLU 14 -8.929 7.011 -2.626
39 HA GLU 14 HA GLU 14 -9.144 7.738 0.222
40 HB2 GLU 14 2HB GLU 14 -9.980 9.934 -1.325
41 HB3 GLU 14 1HB GLU 14 -8.510 9.807 -0.371
42 HG2 GLU 14 2HG GLU 14 -7.791 10.450 -2.486
43 HG3 GLU 14 1HG GLU 14 -7.475 8.718 -2.409
44 H LYS 15 H LYS 15 -10.563 5.994 -1.849
45 HA LYS 15 HA LYS 15 -13.259 7.015 -1.913
46 HB2 LYS 15 2HB LYS 15 -12.290 4.224 -2.574
47 HB3 LYS 15 1HB LYS 15 -13.803 4.961 -3.070
48 HG2 LYS 15 2HG LYS 15 -11.042 5.706 -4.005
49 HG3 LYS 15 1HG LYS 15 -12.285 4.865 -4.928
50 HD2 LYS 15 2HD LYS 15 -13.729 6.895 -4.668
51 HD3 LYS 15 1HD LYS 15 -12.337 7.717 -3.959
52 HE2 LYS 15 2HE LYS 15 -12.551 6.578 -6.746
53 HE3 LYS 15 1HE LYS 15 -12.476 8.279 -6.298
54 HZ1 LYS 15 3HZ LYS 15 -10.313 6.261 -6.038
55 HZ2 LYS 15 1HZ LYS 15 -10.233 7.813 -5.354
56 HZ3 LYS 15 2HZ LYS 15 -10.335 7.625 -7.041
57 H THR 16 H THR 16 -14.880 5.042 -1.306
58 HA THR 16 HA THR 16 -14.479 4.742 1.570
59 HB THR 16 HB THR 16 -16.964 3.906 1.260
60 HG1 THR 16 HG1 THR 16 -17.901 4.511 -0.572
61 HG21 THR 16 3HG2 THR 16 -16.316 5.865 2.565
62 HG22 THR 16 1HG2 THR 16 -17.729 6.231 1.577
63 HG23 THR 16 2HG2 THR 16 -16.137 6.807 1.084
64 H VAL 17 H VAL 17 -14.522 2.826 2.623
65 HA VAL 17 HA VAL 17 -14.469 0.378 0.992
66 HB VAL 17 HB VAL 17 -13.185 1.028 3.639
67 HG11 VAL 17 1HG1 VAL 17 -14.176 -1.178 3.884
68 HG12 VAL 17 2HG1 VAL 17 -12.424 -1.313 3.738
69 HG13 VAL 17 3HG1 VAL 17 -13.456 -1.688 2.359
70 HG21 VAL 17 3HG2 VAL 17 -12.102 0.018 1.024
71 HG22 VAL 17 1HG2 VAL 17 -11.150 0.299 2.484
72 HG23 VAL 17 2HG2 VAL 17 -11.933 1.653 1.669
73 H TYR 18 H TYR 18 -15.819 -1.294 1.463
74 HA TYR 18 HA TYR 18 -17.685 -0.935 3.713
75 HD1 TYR 18 HD1 TYR 18 -20.183 0.603 2.942
76 HD2 TYR 18 HD2 TYR 18 -17.687 -0.143 -0.426
77 HE1 TYR 18 HE1 TYR 18 -20.615 2.878 2.118
78 HE2 TYR 18 HE2 TYR 18 -18.115 2.130 -1.253
79 HH TYR 18 HH TYR 18 -19.774 4.507 0.682
80 HB2 TYR 18 2HB TYR 18 -18.450 -1.959 0.963
81 HB3 TYR 18 1HB TYR 18 -19.530 -1.682 2.322
82 H HIS 19 H HIS 19 -18.797 -3.083 4.211
83 HA HIS 19 HA HIS 19 -16.887 -5.113 4.553
84 HD1 HIS 19 HD1 HIS 19 -20.751 -7.445 4.164
85 HD2 HIS 19 HD2 HIS 19 -20.955 -3.330 4.788
86 HE1 HIS 19 HE1 HIS 19 -23.080 -6.768 3.502
87 HE2 HIS 19 HE2 HIS 19 -23.198 -4.282 3.920
88 HB2 HIS 19 2HB HIS 19 -18.717 -6.541 5.324
89 HB3 HIS 19 1HB HIS 19 -18.843 -4.931 6.017
90 H ALA 20 H ALA 20 -18.657 -4.254 1.824
91 HA ALA 20 HA ALA 20 -18.968 -6.578 0.369
92 HB1 ALA 20 3HB ALA 20 -18.001 -3.903 -0.633
93 HB2 ALA 20 1HB ALA 20 -19.688 -4.362 -0.396
94 HB3 ALA 20 2HB ALA 20 -18.711 -5.185 -1.615
95 H GLU 21 H GLU 21 -16.029 -4.561 0.666
96 HA GLU 21 HA GLU 21 -14.459 -6.920 0.011
97 HB2 GLU 21 2HB GLU 21 -13.132 -5.802 -1.671
98 HB3 GLU 21 1HB GLU 21 -14.817 -5.814 -2.153
99 HG2 GLU 21 2HG GLU 21 -14.995 -3.447 -1.468
100 HG3 GLU 21 1HG GLU 21 -13.288 -3.475 -1.025
101 H GLU 22 H GLU 22 -14.733 -5.814 2.489
102 HA GLU 22 HA GLU 22 -12.495 -4.042 2.971
103 HB2 GLU 22 2HB GLU 22 -14.497 -3.709 4.296
104 HB3 GLU 22 1HB GLU 22 -14.439 -5.374 4.866
105 HG2 GLU 22 2HG GLU 22 -12.199 -4.826 5.884
106 HG3 GLU 22 1HG GLU 22 -12.537 -3.135 5.508
107 H ILE 23 H ILE 23 -10.495 -4.797 3.123
108 HA ILE 23 HA ILE 23 -10.124 -7.357 4.523
109 HB ILE 23 HB ILE 23 -9.092 -6.918 2.135
110 HG12 ILE 23 2HG1 ILE 23 -7.369 -8.086 4.326
111 HG13 ILE 23 1HG1 ILE 23 -8.760 -8.909 3.630
112 HG21 ILE 23 1HG2 ILE 23 -7.111 -5.555 3.932
113 HG22 ILE 23 2HG2 ILE 23 -7.943 -4.887 2.527
114 HG23 ILE 23 3HG2 ILE 23 -6.729 -6.148 2.315
115 HD11 ILE 23 3HD1 ILE 23 -6.702 -9.714 2.653
116 HD12 ILE 23 1HD1 ILE 23 -6.274 -8.078 2.155
117 HD13 ILE 23 2HD1 ILE 23 -7.674 -8.880 1.441
118 H GLN 24 H GLN 24 -8.903 -7.383 6.391
119 HA GLN 24 HA GLN 24 -8.471 -4.692 7.497
120 HB2 GLN 24 2HB GLN 24 -8.914 -7.247 9.038
121 HB3 GLN 24 1HB GLN 24 -8.939 -5.605 9.667
122 HG2 GLN 24 2HG GLN 24 -10.932 -5.142 8.282
123 HG3 GLN 24 1HG GLN 24 -10.930 -6.826 7.763
124 HE21 GLN 24 1HE2 GLN 24 -13.020 -5.434 9.130
125 HE22 GLN 24 2HE2 GLN 24 -13.262 -6.234 10.654
126 H CYS 25 H CYS 25 -6.385 -4.205 7.234
127 HA CYS 25 HA CYS 25 -4.416 -6.179 8.207
128 HG CYS 25 HG CYS 25 -1.898 -6.152 7.720
129 HB2 CYS 25 2HB CYS 25 -4.252 -5.697 5.748
130 HB3 CYS 25 1HB CYS 25 -3.914 -4.018 6.142
131 H ASN 26 H ASN 26 -3.277 -5.576 9.916
132 HA ASN 26 HA ASN 26 -2.318 -4.335 11.554
133 HB2 ASN 26 2HB ASN 26 -1.158 -2.869 10.222
134 HB3 ASN 26 1HB ASN 26 -2.610 -2.277 9.425
135 HD21 ASN 26 1HD2 ASN 26 -0.706 -2.100 12.361
136 HD22 ASN 26 2HD2 ASN 26 -1.259 -0.537 12.845
137 H GLY 27 H GLY 27 -5.344 -3.107 10.282
138 HA2 GLY 27 2HA GLY 27 -7.011 -3.099 12.310
139 HA3 GLY 27 1HA GLY 27 -5.942 -1.797 12.830
140 H ARG 28 H ARG 28 -5.675 -1.453 9.729
141 HA ARG 28 HA ARG 28 -7.901 0.433 9.497
142 HE ARG 28 HE ARG 28 -5.313 3.895 8.364
143 HB2 ARG 28 2HB ARG 28 -5.577 1.249 9.146
144 HB3 ARG 28 1HB ARG 28 -5.406 0.121 7.810
145 HG2 ARG 28 2HG ARG 28 -7.241 1.286 6.639
146 HG3 ARG 28 1HG ARG 28 -7.296 2.458 7.956
147 HD2 ARG 28 2HD ARG 28 -4.869 1.888 6.259
148 HD3 ARG 28 1HD ARG 28 -5.985 3.223 5.985
149 HH11 ARG 28 1HH1 ARG 28 -3.156 2.208 6.172
150 HH12 ARG 28 2HH1 ARG 28 -1.722 2.941 6.819
151 HH21 ARG 28 1HH2 ARG 28 -3.449 4.868 9.202
152 HH22 ARG 28 2HH2 ARG 28 -1.895 4.494 8.512
153 H SER 29 H SER 29 -9.381 0.306 7.831
154 HA SER 29 HA SER 29 -9.646 -2.270 6.544
155 HG SER 29 HG SER 29 -12.693 -1.761 7.522
156 HB2 SER 29 2HB SER 29 -11.387 0.204 6.479
157 HB3 SER 29 1HB SER 29 -11.789 -1.310 5.674
158 H PHE 30 H PHE 30 -9.059 -2.756 4.545
159 HA PHE 30 HA PHE 30 -8.582 -0.571 2.613
160 HD1 PHE 30 HD2 PHE 30 -5.705 0.101 2.265
161 HD2 PHE 30 HD1 PHE 30 -6.258 -3.121 4.984
162 HE1 PHE 30 HE2 PHE 30 -4.012 1.080 3.762
163 HE2 PHE 30 HE1 PHE 30 -4.570 -2.150 6.488
164 HZ PHE 30 HZ PHE 30 -3.404 -0.067 5.847
165 HB2 PHE 30 2HB PHE 30 -7.144 -3.234 2.773
166 HB3 PHE 30 1HB PHE 30 -6.840 -1.967 1.592
167 H HIS 31 H HIS 31 -8.913 -1.300 0.320
168 HA HIS 31 HA HIS 31 -11.141 -3.104 0.049
169 HD2 HIS 31 HD2 HIS 31 -12.980 -1.696 -0.372
170 HE1 HIS 31 HE1 HIS 31 -12.285 1.993 -2.300
171 HE2 HIS 31 HE2 HIS 31 -13.870 0.699 -0.832
172 HB2 HIS 31 2HB HIS 31 -9.416 -1.704 -2.002
173 HB3 HIS 31 1HB HIS 31 -10.703 -2.817 -2.444
174 H LYS 32 H LYS 32 -11.135 -5.156 -0.734
175 HA LYS 32 HA LYS 32 -8.918 -6.810 -0.328
176 HB2 LYS 32 2HB LYS 32 -11.383 -7.455 -0.467
177 HB3 LYS 32 1HB LYS 32 -11.196 -7.410 -2.214
178 HG2 LYS 32 2HG LYS 32 -9.338 -9.101 -1.938
179 HG3 LYS 32 1HG LYS 32 -9.863 -9.263 -0.259
180 HD2 LYS 32 2HD LYS 32 -11.535 -9.780 -2.718
181 HD3 LYS 32 1HD LYS 32 -10.871 -10.993 -1.625
182 HE2 LYS 32 2HE LYS 32 -12.794 -8.848 -0.761
183 HE3 LYS 32 1HE LYS 32 -13.297 -10.453 -1.282
184 HZ1 LYS 32 3HZ LYS 32 -13.135 -10.248 1.139
185 HZ2 LYS 32 1HZ LYS 32 -11.480 -9.904 1.010
186 HZ3 LYS 32 2HZ LYS 32 -12.067 -11.422 0.534
187 H THR 33 H THR 33 -9.995 -4.978 -3.049
188 HA THR 33 HA THR 33 -8.268 -6.169 -4.995
189 HB THR 33 HB THR 33 -9.427 -3.401 -5.199
190 HG1 THR 33 HG1 THR 33 -11.321 -4.288 -4.820
191 HG21 THR 33 3HG2 THR 33 -9.041 -5.621 -7.216
192 HG22 THR 33 1HG2 THR 33 -8.006 -4.203 -7.030
193 HG23 THR 33 2HG2 THR 33 -9.676 -4.012 -7.559
194 H CYS 34 H CYS 34 -7.942 -3.771 -2.540
195 HA CYS 34 HA CYS 34 -5.656 -2.504 -3.848
196 HB2 CYS 34 2HB CYS 34 -7.281 -1.653 -1.443
197 HB3 CYS 34 1HB CYS 34 -5.949 -0.735 -2.142
198 H PHE 35 H PHE 35 -6.062 -5.063 -1.881
199 HA PHE 35 HA PHE 35 -4.075 -4.488 0.106
200 HD1 PHE 35 HD2 PHE 35 -4.719 -5.575 2.596
201 HD2 PHE 35 HD1 PHE 35 -3.326 -8.559 -0.103
202 HE1 PHE 35 HE2 PHE 35 -3.308 -6.519 4.372
203 HE2 PHE 35 HE1 PHE 35 -1.920 -9.509 1.676
204 HZ PHE 35 HZ PHE 35 -1.938 -8.454 3.950
205 HB2 PHE 35 2HB PHE 35 -5.923 -6.146 0.453
206 HB3 PHE 35 1HB PHE 35 -5.134 -7.201 -0.716
207 H HIS 36 H HIS 36 -2.432 -3.733 -1.320
208 HA HIS 36 HA HIS 36 -0.500 -5.747 -1.818
209 HD1 HIS 36 HD1 HIS 36 -3.754 -5.083 -4.724
210 HD2 HIS 36 HD2 HIS 36 -0.537 -2.466 -4.903
211 HE1 HIS 36 HE1 HIS 36 -4.568 -3.113 -6.036
212 HE2 HIS 36 HE2 HIS 36 -2.528 -1.672 -6.361
213 HB2 HIS 36 2HB HIS 36 -0.143 -5.239 -4.234
214 HB3 HIS 36 1HB HIS 36 -1.631 -6.108 -3.896
215 H CYS 37 H CYS 37 1.434 -4.513 -3.170
216 HA CYS 37 HA CYS 37 2.465 -2.876 -1.174
217 HB2 CYS 37 2HB CYS 37 3.775 -4.138 -2.904
218 HB3 CYS 37 1HB CYS 37 3.351 -2.884 -4.064
219 H MET 38 H MET 38 2.189 -0.843 -0.654
220 HA MET 38 HA MET 38 0.471 0.853 -2.186
221 HB2 MET 38 2HB MET 38 2.146 1.484 0.249
222 HB3 MET 38 1HB MET 38 0.884 2.511 -0.419
223 HG2 MET 38 2HG MET 38 0.494 -0.252 0.708
224 HG3 MET 38 1HG MET 38 0.105 1.264 1.523
225 HE1 MET 38 3HE MET 38 -3.362 -0.441 0.584
226 HE2 MET 38 1HE MET 38 -2.366 0.141 1.916
227 HE3 MET 38 2HE MET 38 -1.857 -1.268 0.989
228 H ALA 39 H ALA 39 3.726 0.143 -2.438
229 HA ALA 39 HA ALA 39 4.426 2.811 -3.421
230 HB1 ALA 39 3HB ALA 39 6.214 0.440 -2.930
231 HB2 ALA 39 1HB ALA 39 5.943 1.772 -1.806
232 HB3 ALA 39 2HB ALA 39 6.732 2.071 -3.354
233 H CYS 40 H CYS 40 5.412 -0.444 -4.520
234 HA CYS 40 HA CYS 40 5.444 0.569 -7.239
235 HB2 CYS 40 2HB CYS 40 6.560 -1.499 -7.829
236 HB3 CYS 40 1HB CYS 40 7.310 -0.832 -6.382
237 H ARG 41 H ARG 41 3.239 -0.892 -5.251
238 HA ARG 41 HA ARG 41 1.179 -1.730 -5.538
239 HE ARG 41 HE ARG 41 -0.224 2.446 -5.809
240 HB2 ARG 41 2HB ARG 41 1.615 -0.937 -8.416
241 HB3 ARG 41 1HB ARG 41 0.094 -1.565 -7.790
242 HG2 ARG 41 2HG ARG 41 1.482 0.955 -6.890
243 HG3 ARG 41 1HG ARG 41 0.038 0.853 -7.901
244 HD2 ARG 41 2HD ARG 41 -1.229 -0.106 -6.111
245 HD3 ARG 41 1HD ARG 41 0.213 -0.274 -5.115
246 HH11 ARG 41 1HH1 ARG 41 -1.320 -0.093 -3.670
247 HH12 ARG 41 2HH1 ARG 41 -1.915 0.991 -2.460
248 HH21 ARG 41 1HH2 ARG 41 -0.995 3.893 -4.222
249 HH22 ARG 41 2HH2 ARG 41 -1.752 3.273 -2.788
250 H LYS 42 H LYS 42 3.735 -3.281 -5.989
251 HA LYS 42 HA LYS 42 3.242 -5.600 -7.453
252 HB2 LYS 42 2HB LYS 42 5.356 -5.112 -6.292
253 HB3 LYS 42 1HB LYS 42 4.554 -5.276 -4.741
254 HG2 LYS 42 2HG LYS 42 5.696 -7.277 -5.002
255 HG3 LYS 42 1HG LYS 42 4.042 -7.677 -5.466
256 HD2 LYS 42 2HD LYS 42 4.607 -7.561 -7.796
257 HD3 LYS 42 1HD LYS 42 6.220 -6.950 -7.419
258 HE2 LYS 42 2HE LYS 42 6.619 -9.095 -6.166
259 HE3 LYS 42 1HE LYS 42 5.104 -9.685 -6.844
260 HZ1 LYS 42 3HZ LYS 42 7.419 -8.755 -8.446
261 HZ2 LYS 42 1HZ LYS 42 5.989 -9.451 -9.042
262 HZ3 LYS 42 2HZ LYS 42 7.065 -10.379 -8.112
263 H ALA 43 H ALA 43 1.950 -7.392 -7.100
264 HA ALA 43 HA ALA 43 -0.158 -7.161 -5.161
265 HB1 ALA 43 3HB ALA 43 -0.548 -8.178 -7.366
266 HB2 ALA 43 1HB ALA 43 -0.953 -9.285 -6.056
267 HB3 ALA 43 2HB ALA 43 0.553 -9.490 -6.950
268 H LEU 44 H LEU 44 -0.101 -7.867 -3.133
269 HA LEU 44 HA LEU 44 2.226 -9.405 -2.257
270 HG LEU 44 HG LEU 44 2.474 -6.798 0.282
271 HB2 LEU 44 2HB LEU 44 0.443 -7.411 -0.991
272 HB3 LEU 44 1HB LEU 44 1.021 -8.699 0.048
273 HD11 LEU 44 1HD1 LEU 44 3.793 -8.937 -1.387
274 HD12 LEU 44 2HD1 LEU 44 3.532 -8.991 0.356
275 HD13 LEU 44 3HD1 LEU 44 4.620 -7.789 -0.336
276 HD21 LEU 44 3HD2 LEU 44 2.075 -5.632 -1.752
277 HD22 LEU 44 1HD2 LEU 44 2.766 -6.941 -2.708
278 HD23 LEU 44 2HD2 LEU 44 3.799 -5.981 -1.648
279 H ASP 45 H ASP 45 2.070 -11.262 -1.109
280 HA ASP 45 HA ASP 45 -0.453 -12.699 -1.206
281 HB2 ASP 45 2HB ASP 45 2.170 -13.666 -0.041
282 HB3 ASP 45 1HB ASP 45 0.797 -14.644 -0.543
283 H SER 46 H SER 46 -0.717 -14.108 0.968
284 HA SER 46 HA SER 46 -1.334 -12.202 2.986
285 HG SER 46 HG SER 46 -2.521 -14.909 1.555
286 HB2 SER 46 2HB SER 46 -1.238 -15.204 3.305
287 HB3 SER 46 1HB SER 46 -2.204 -14.053 4.229
288 H THR 47 H THR 47 1.404 -14.236 2.341
289 HA THR 47 HA THR 47 2.429 -13.852 5.056
290 HB THR 47 HB THR 47 2.361 -16.157 4.215
291 HG1 THR 47 HG1 THR 47 4.510 -14.914 5.240
292 HG21 THR 47 3HG2 THR 47 3.887 -16.876 2.438
293 HG22 THR 47 1HG2 THR 47 4.336 -15.195 2.148
294 HG23 THR 47 2HG2 THR 47 2.685 -15.733 1.839
295 H THR 48 H THR 48 2.922 -12.655 1.859
296 HA THR 48 HA THR 48 5.747 -12.132 2.346
297 HB THR 48 HB THR 48 5.707 -11.278 -0.037
298 HG1 THR 48 HG1 THR 48 3.692 -12.433 -1.069
299 HG21 THR 48 3HG2 THR 48 6.506 -13.522 0.527
300 HG22 THR 48 1HG2 THR 48 5.644 -13.530 -1.012
301 HG23 THR 48 2HG2 THR 48 4.856 -14.137 0.445
302 H VAL 49 H VAL 49 2.822 -10.445 2.737
303 HA VAL 49 HA VAL 49 3.751 -7.856 2.012
304 HB VAL 49 HB VAL 49 1.424 -8.024 2.024
305 HG11 VAL 49 1HG1 VAL 49 0.086 -8.733 3.967
306 HG12 VAL 49 2HG1 VAL 49 1.571 -9.054 4.865
307 HG13 VAL 49 3HG1 VAL 49 1.183 -10.008 3.434
308 HG21 VAL 49 3HG2 VAL 49 0.674 -6.383 3.682
309 HG22 VAL 49 1HG2 VAL 49 2.188 -5.914 2.910
310 HG23 VAL 49 2HG2 VAL 49 2.200 -6.575 4.545
311 H ALA 50 H ALA 50 4.925 -6.432 3.070
312 HA ALA 50 HA ALA 50 5.619 -7.002 5.866
313 HB1 ALA 50 3HB ALA 50 7.526 -5.513 5.515
314 HB2 ALA 50 1HB ALA 50 6.974 -5.186 3.872
315 HB3 ALA 50 2HB ALA 50 7.510 -6.807 4.318
316 H ALA 51 H ALA 51 4.227 -6.023 7.179
317 HA ALA 51 HA ALA 51 3.254 -3.352 6.517
318 HB1 ALA 51 3HB ALA 51 1.554 -3.723 8.206
319 HB2 ALA 51 1HB ALA 51 2.302 -5.257 8.651
320 HB3 ALA 51 2HB ALA 51 1.575 -5.060 7.056
321 H HIS 52 H HIS 52 4.468 -1.769 7.260
322 HA HIS 52 HA HIS 52 5.787 -2.026 9.865
323 HD1 HIS 52 HD1 HIS 52 8.968 -1.101 9.695
324 HD2 HIS 52 HD2 HIS 52 6.323 2.113 9.829
325 HE1 HIS 52 HE1 HIS 52 10.006 0.573 11.264
326 HE2 HIS 52 HE2 HIS 52 8.335 2.458 11.426
327 HB2 HIS 52 2HB HIS 52 7.138 -1.229 7.934
328 HB3 HIS 52 1HB HIS 52 6.055 0.148 7.771
329 H GLU 53 H GLU 53 3.995 -1.810 11.188
330 HA GLU 53 HA GLU 53 2.459 -0.764 12.461
331 HB2 GLU 53 2HB GLU 53 3.742 1.802 11.510
332 HB3 GLU 53 1HB GLU 53 2.801 1.573 12.979
333 HG2 GLU 53 2HG GLU 53 4.520 0.099 13.869
334 HG3 GLU 53 1HG GLU 53 5.454 0.275 12.386
335 H SER 54 H SER 54 2.412 2.085 10.488
336 HA SER 54 HA SER 54 -0.355 1.522 9.798
337 HG SER 54 HG SER 54 1.742 4.755 9.031
338 HB2 SER 54 2HB SER 54 -0.207 3.971 9.011
339 HB3 SER 54 1HB SER 54 -0.063 3.664 10.741
340 H GLU 55 H GLU 55 2.514 0.867 8.395
341 HA GLU 55 HA GLU 55 1.639 1.566 5.671
342 HB2 GLU 55 2HB GLU 55 4.422 1.037 6.726
343 HB3 GLU 55 1HB GLU 55 4.023 1.431 5.059
344 HG2 GLU 55 2HG GLU 55 3.233 3.614 5.730
345 HG3 GLU 55 1HG GLU 55 3.519 3.216 7.424
346 H ILE 56 H ILE 56 1.991 0.056 3.977
347 HA ILE 56 HA ILE 56 2.824 -2.647 4.647
348 HB ILE 56 HB ILE 56 0.683 -3.337 4.836
349 HG12 ILE 56 2HG1 ILE 56 0.766 -2.931 1.842
350 HG13 ILE 56 1HG1 ILE 56 1.341 -4.346 2.718
351 HG21 ILE 56 1HG2 ILE 56 -0.208 -0.949 3.240
352 HG22 ILE 56 2HG2 ILE 56 -0.224 -1.116 4.995
353 HG23 ILE 56 3HG2 ILE 56 -1.280 -2.122 4.004
354 HD11 ILE 56 3HD1 ILE 56 -0.921 -4.864 3.404
355 HD12 ILE 56 1HD1 ILE 56 -0.822 -4.729 1.649
356 HD13 ILE 56 2HD1 ILE 56 -1.518 -3.414 2.599
357 H TYR 57 H TYR 57 4.169 -3.356 3.111
358 HA TYR 57 HA TYR 57 3.773 -2.575 0.333
359 HD1 TYR 57 HD2 TYR 57 4.633 0.229 -0.441
360 HD2 TYR 57 HD1 TYR 57 5.936 -0.696 3.498
361 HE1 TYR 57 HE2 TYR 57 4.101 2.517 0.261
362 HE2 TYR 57 HE1 TYR 57 5.403 1.599 4.218
363 HH TYR 57 HH TYR 57 3.688 3.819 2.133
364 HB2 TYR 57 2HB TYR 57 6.471 -2.150 1.644
365 HB3 TYR 57 1HB TYR 57 6.014 -1.736 0.001
366 H CYS 58 H CYS 58 5.459 -3.652 -1.072
367 HA CYS 58 HA CYS 58 5.927 -6.370 -0.264
368 HB2 CYS 58 2HB CYS 58 6.811 -6.699 -2.426
369 HB3 CYS 58 1HB CYS 58 5.573 -5.477 -2.672
370 H LYS 59 H LYS 59 8.126 -7.272 -0.112
371 HA LYS 59 HA LYS 59 9.592 -5.753 1.788
372 HB2 LYS 59 2HB LYS 59 10.210 -8.394 0.467
373 HB3 LYS 59 1HB LYS 59 11.123 -7.716 1.810
374 HG2 LYS 59 2HG LYS 59 9.174 -7.808 3.234
375 HG3 LYS 59 1HG LYS 59 8.182 -8.364 1.888
376 HD2 LYS 59 2HD LYS 59 10.582 -9.886 2.878
377 HD3 LYS 59 1HD LYS 59 8.966 -10.127 3.540
378 HE2 LYS 59 2HE LYS 59 9.308 -11.803 1.886
379 HE3 LYS 59 1HE LYS 59 8.186 -10.625 1.207
380 HZ1 LYS 59 3HZ LYS 59 9.958 -11.373 -0.341
381 HZ2 LYS 59 1HZ LYS 59 11.107 -10.636 0.662
382 HZ3 LYS 59 2HZ LYS 59 9.923 -9.695 -0.116
383 H VAL 60 H VAL 60 9.647 -5.671 -1.543
384 HA VAL 60 HA VAL 60 12.448 -5.084 -1.870
385 HB VAL 60 HB VAL 60 10.141 -4.523 -3.752
386 HG11 VAL 60 1HG1 VAL 60 13.124 -4.533 -4.222
387 HG12 VAL 60 2HG1 VAL 60 12.059 -3.129 -4.255
388 HG13 VAL 60 3HG1 VAL 60 11.897 -4.385 -5.481
389 HG21 VAL 60 3HG2 VAL 60 10.355 -6.905 -3.293
390 HG22 VAL 60 1HG2 VAL 60 12.076 -6.841 -3.673
391 HG23 VAL 60 2HG2 VAL 60 10.883 -6.544 -4.936
392 H CYS 61 H CYS 61 9.441 -3.163 -2.008
393 HA CYS 61 HA CYS 61 10.814 -0.667 -2.017
394 HB2 CYS 61 2HB CYS 61 7.943 -1.242 -1.288
395 HB3 CYS 61 1HB CYS 61 8.619 0.339 -1.669
396 H TYR 62 H TYR 62 9.472 -2.731 0.487
397 HA TYR 62 HA TYR 62 9.745 -0.947 2.639
398 HD1 TYR 62 HD2 TYR 62 7.746 -1.929 4.626
399 HD2 TYR 62 HD1 TYR 62 11.535 -3.863 4.755
400 HE1 TYR 62 HE2 TYR 62 7.792 -1.672 7.065
401 HE2 TYR 62 HE1 TYR 62 11.586 -3.613 7.201
402 HH TYR 62 HH TYR 62 10.614 -2.222 8.930
403 HB2 TYR 62 2HB TYR 62 8.576 -3.177 2.709
404 HB3 TYR 62 1HB TYR 62 10.162 -3.941 2.747
405 H GLY 63 H GLY 63 12.011 -3.213 1.136
406 HA2 GLY 63 2HA GLY 63 14.178 -2.581 2.905
407 HA3 GLY 63 1HA GLY 63 14.282 -3.497 1.412
408 H ARG 64 H ARG 64 12.835 -0.967 0.218
409 HA ARG 64 HA ARG 64 15.314 0.456 -0.329
410 HE ARG 64 HE ARG 64 14.691 -1.846 -4.536
411 HB2 ARG 64 2HB ARG 64 12.568 0.653 -1.569
412 HB3 ARG 64 1HB ARG 64 13.906 1.717 -2.002
413 HG2 ARG 64 2HG ARG 64 15.231 -0.225 -2.670
414 HG3 ARG 64 1HG ARG 64 13.891 -1.286 -2.247
415 HD2 ARG 64 2HD ARG 64 12.515 -0.264 -3.965
416 HD3 ARG 64 1HD ARG 64 13.815 0.862 -4.363
417 HH11 ARG 64 1HH1 ARG 64 12.821 0.568 -6.270
418 HH12 ARG 64 2HH1 ARG 64 13.211 -0.084 -7.838
419 HH21 ARG 64 1HH2 ARG 64 15.159 -2.724 -6.581
420 HH22 ARG 64 2HH2 ARG 64 14.535 -1.965 -8.015
421 H ARG 65 H ARG 65 12.108 1.152 1.034
422 HA ARG 65 HA ARG 65 12.766 3.882 1.619
423 HE ARG 65 HE ARG 65 8.865 4.616 1.167
424 HB2 ARG 65 2HB ARG 65 10.444 3.265 1.246
425 HB3 ARG 65 1HB ARG 65 10.497 2.135 2.592
426 HG2 ARG 65 2HG ARG 65 10.813 3.976 4.152
427 HG3 ARG 65 1HG ARG 65 10.814 5.121 2.811
428 HD2 ARG 65 2HD ARG 65 8.508 3.301 3.489
429 HD3 ARG 65 1HD ARG 65 8.647 4.976 4.033
430 HH11 ARG 65 1HH1 ARG 65 6.697 5.153 3.872
431 HH12 ARG 65 2HH1 ARG 65 5.474 5.906 2.892
432 HH21 ARG 65 1HH2 ARG 65 7.219 5.561 -0.118
433 HH22 ARG 65 2HH2 ARG 65 5.748 6.092 0.636
434 H TYR 66 H TYR 66 12.693 0.869 3.447
435 HA TYR 66 HA TYR 66 13.989 2.266 5.694
436 HD1 TYR 66 HD1 TYR 66 12.618 2.614 8.108
437 HD2 TYR 66 HD2 TYR 66 10.152 0.822 5.140
438 HE1 TYR 66 HE1 TYR 66 10.769 4.106 8.747
439 HE2 TYR 66 HE2 TYR 66 8.304 2.313 5.764
440 HH TYR 66 HH TYR 66 8.741 4.991 7.938
441 HB2 TYR 66 2HB TYR 66 12.204 -0.176 5.696
442 HB3 TYR 66 1HB TYR 66 13.129 0.356 7.097