Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
16645 | 2aih RC | 7078 | cing | 1-original | 6 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 1H GLY 1 1H GLY 1 6.970 -15.234 9.194
2 2H GLY 1 2H GLY 1 6.526 -16.561 10.157
3 3H GLY 1 3H GLY 1 5.458 -15.253 9.967
4 1HA GLY 1 1HA GLY 1 6.215 -17.322 8.052
5 2HA GLY 1 2HA GLY 1 4.575 -16.785 8.601
6 H ASP 2 H ASP 2 3.943 -16.598 6.412
7 HA ASP 2 HA ASP 2 4.690 -14.101 5.069
8 1HB ASP 2 1HB ASP 2 4.760 -16.745 3.497
9 2HB ASP 2 2HB ASP 2 5.391 -15.145 2.997
10 HD2 ASP 2 HD2 ASP 2 7.646 -17.825 4.827
11 H ASP 3 H ASP 3 2.275 -16.365 5.932
12 HA ASP 3 HA ASP 3 0.606 -15.730 3.603
13 1HB ASP 3 1HB ASP 3 -0.919 -17.471 4.401
14 2HB ASP 3 2HB ASP 3 0.748 -18.088 4.190
15 HD2 ASP 3 HD2 ASP 3 1.083 -19.483 5.549
16 H VAL 4 H VAL 4 1.403 -13.889 5.654
17 HA VAL 4 HA VAL 4 -0.787 -13.446 7.408
18 HB VAL 4 HB VAL 4 1.616 -13.144 7.970
19 1HG1 VAL 4 1HG1 VAL 4 2.622 -10.895 7.616
20 2HG1 VAL 4 2HG1 VAL 4 1.233 -10.378 6.611
21 3HG1 VAL 4 3HG1 VAL 4 2.322 -11.684 6.029
22 1HG2 VAL 4 1HG2 VAL 4 -0.323 -10.898 8.768
23 2HG2 VAL 4 2HG2 VAL 4 1.170 -11.400 9.618
24 3HG2 VAL 4 3HG2 VAL 4 -0.204 -12.549 9.487
25 H LYS 5 H LYS 5 -2.340 -11.892 7.540
26 HA LYS 5 HA LYS 5 -2.873 -10.294 5.149
27 1HB LYS 5 1HB LYS 5 -4.496 -10.999 7.659
28 2HB LYS 5 2HB LYS 5 -5.119 -9.901 6.396
29 1HG LYS 5 1HG LYS 5 -4.344 -12.827 5.853
30 2HG LYS 5 2HG LYS 5 -5.982 -12.268 6.329
31 1HD LYS 5 1HD LYS 5 -5.996 -10.697 4.327
32 2HD LYS 5 2HD LYS 5 -4.476 -11.478 3.757
33 1HE LYS 5 1HE LYS 5 -5.668 -13.702 3.671
34 2HE LYS 5 2HE LYS 5 -7.182 -12.910 4.269
35 1HZ LYS 5 1HZ LYS 5 -7.217 -13.153 1.922
36 2HZ LYS 5 2HZ LYS 5 -5.754 -12.312 1.731
37 3HZ LYS 5 3HZ LYS 5 -7.135 -11.503 2.307
38 H SER 6 H SER 6 -0.756 -9.680 7.088
39 HA SER 6 HA SER 6 -1.373 -7.411 8.627
40 1HB SER 6 1HB SER 6 1.278 -7.947 7.168
41 2HB SER 6 2HB SER 6 1.012 -6.640 8.390
42 HG SER 6 HG SER 6 1.821 -8.332 9.515
43 H ALA 7 H ALA 7 -0.439 -7.593 5.191
44 HA ALA 7 HA ALA 7 -2.106 -5.353 4.657
45 1HB ALA 7 1HB ALA 7 0.087 -4.200 5.173
46 2HB ALA 7 2HB ALA 7 -0.221 -4.127 3.397
47 3HB ALA 7 3HB ALA 7 0.919 -5.348 4.083
48 H CYS 8 H CYS 8 -2.793 -5.355 2.512
49 HA CYS 8 HA CYS 8 -1.568 -7.315 0.672
50 1HB CYS 8 1HB CYS 8 -4.521 -6.493 0.703
51 2HB CYS 8 2HB CYS 8 -3.692 -7.462 -0.550
52 H CYS 9 H CYS 9 -1.464 -6.538 -1.544
53 HA CYS 9 HA CYS 9 -2.174 -3.752 -2.012
54 1HB CYS 9 1HB CYS 9 -0.115 -3.560 -0.678
55 2HB CYS 9 2HB CYS 9 0.674 -4.835 -1.649
56 H ASP 10 H ASP 10 -2.809 -3.640 -4.188
57 HA ASP 10 HA ASP 10 -1.904 -5.788 -5.958
58 1HB ASP 10 1HB ASP 10 -4.088 -3.707 -5.946
59 2HB ASP 10 2HB ASP 10 -3.585 -4.293 -7.508
60 HD2 ASP 10 HD2 ASP 10 -4.058 -6.341 -8.099
61 H THR 11 H THR 11 -0.668 -2.752 -5.192
62 HA THR 11 HA THR 11 0.917 -2.761 -7.607
63 HB THR 11 HB THR 11 -0.533 -0.120 -7.159
64 HG1 THR 11 HG1 THR 11 -1.313 -2.134 -8.998
65 1HG2 THR 11 1HG2 THR 11 0.191 0.233 -9.512
66 2HG2 THR 11 2HG2 THR 11 0.888 -1.437 -9.564
67 3HG2 THR 11 3HG2 THR 11 1.607 -0.188 -8.483
68 H CYS 12 H CYS 12 2.594 -2.996 -6.400
69 HA CYS 12 HA CYS 12 3.512 -0.970 -4.536
70 1HB CYS 12 1HB CYS 12 4.879 -3.356 -5.874
71 2HB CYS 12 2HB CYS 12 5.611 -2.356 -4.538
72 H LEU 13 H LEU 13 5.386 0.344 -4.967
73 HA LEU 13 HA LEU 13 6.445 0.416 -7.696
74 1HB LEU 13 1HB LEU 13 4.478 1.953 -7.528
75 2HB LEU 13 2HB LEU 13 5.255 2.800 -6.160
76 HG LEU 13 HG LEU 13 6.427 2.552 -9.028
77 1HD1 LEU 13 1HD1 LEU 13 4.807 4.881 -7.825
78 2HD1 LEU 13 2HD1 LEU 13 4.189 3.681 -9.025
79 3HD1 LEU 13 3HD1 LEU 13 5.523 4.809 -9.476
80 1HD2 LEU 13 1HD2 LEU 13 7.132 4.462 -6.700
81 2HD2 LEU 13 2HD2 LEU 13 7.697 4.673 -8.405
82 3HD2 LEU 13 3HD2 LEU 13 8.209 3.235 -7.469
83 H CYS 14 H CYS 14 8.401 -0.069 -7.255
84 HA CYS 14 HA CYS 14 9.773 1.128 -4.982
85 1HB CYS 14 1HB CYS 14 10.687 -1.121 -6.788
86 2HB CYS 14 2HB CYS 14 11.625 -0.415 -5.457
87 H THR 15 H THR 15 11.333 2.540 -5.117
88 HA THR 15 HA THR 15 11.256 4.111 -7.503
89 HB THR 15 HB THR 15 12.808 5.674 -6.328
90 HG1 THR 15 HG1 THR 15 12.206 4.154 -4.060
91 1HG2 THR 15 1HG2 THR 15 11.057 6.365 -4.695
92 2HG2 THR 15 2HG2 THR 15 10.268 4.750 -4.779
93 3HG2 THR 15 3HG2 THR 15 10.291 5.810 -6.224
94 H ARG 16 H ARG 16 12.819 4.928 -8.764
95 HA ARG 16 HA ARG 16 15.157 3.344 -9.304
96 1HB ARG 16 1HB ARG 16 13.934 5.878 -10.504
97 2HB ARG 16 2HB ARG 16 15.491 5.181 -11.083
98 1HG ARG 16 1HG ARG 16 14.545 3.351 -12.046
99 2HG ARG 16 2HG ARG 16 13.109 3.313 -10.970
100 1HD ARG 16 1HD ARG 16 12.043 5.198 -12.156
101 2HD ARG 16 2HD ARG 16 13.557 5.499 -13.104
102 HE ARG 16 HE ARG 16 13.050 3.737 -14.507
103 1HH1 ARG 16 1HH1 ARG 16 10.937 3.381 -11.635
104 2HH1 ARG 16 2HH1 ARG 16 10.059 2.049 -12.314
105 1HH2 ARG 16 1HH2 ARG 16 11.858 2.014 -15.373
106 2HH2 ARG 16 2HH2 ARG 16 10.575 1.269 -14.471
107 H SER 17 H SER 17 16.826 3.633 -7.852
108 HA SER 17 HA SER 17 17.886 6.152 -7.124
109 1HB SER 17 1HB SER 17 15.571 6.077 -5.830
110 2HB SER 17 2HB SER 17 16.310 4.770 -4.866
111 HG SER 17 HG SER 17 16.536 6.774 -3.897
112 H GLN 18 H GLN 18 19.042 5.723 -4.895
113 HA GLN 18 HA GLN 18 20.130 3.075 -4.604
114 1HB GLN 18 1HB GLN 18 21.305 4.341 -6.574
115 2HB GLN 18 2HB GLN 18 22.088 5.323 -5.320
116 1HG GLN 18 1HG GLN 18 22.244 2.239 -5.760
117 2HG GLN 18 2HG GLN 18 23.569 3.425 -6.008
118 1HE2 GLN 18 1HE2 GLN 18 24.085 4.750 -3.885
119 2HE2 GLN 18 2HE2 GLN 18 24.147 3.803 -2.414
120 HA PRO 19 HA PRO 19 19.983 2.028 -2.781
121 1HB PRO 19 1HB PRO 19 18.878 1.689 -0.272
122 2HB PRO 19 2HB PRO 19 20.686 1.856 -0.496
123 1HG PRO 19 1HG PRO 19 18.682 4.081 0.213
124 2HG PRO 19 2HG PRO 19 20.187 3.617 1.113
125 1HD PRO 19 1HD PRO 19 20.128 5.639 -0.791
126 2HD PRO 19 2HD PRO 19 21.591 4.567 -0.597
127 HA PRO 20 HA PRO 20 15.801 2.932 -3.926
128 1HB PRO 20 1HB PRO 20 14.491 0.515 -3.852
129 2HB PRO 20 2HB PRO 20 15.930 0.750 -4.920
130 1HG PRO 20 1HG PRO 20 15.927 -0.415 -2.074
131 2HG PRO 20 2HG PRO 20 16.556 -1.196 -3.584
132 1HD PRO 20 1HD PRO 20 18.194 0.238 -1.890
133 2HD PRO 20 2HD PRO 20 18.408 0.343 -3.710
134 H THR 21 H THR 21 13.523 2.702 -3.316
135 HA THR 21 HA THR 21 12.828 2.539 -0.458
136 HB THR 21 HB THR 21 12.452 5.072 -2.212
137 HG1 THR 21 HG1 THR 21 14.473 5.299 -1.543
138 1HG2 THR 21 1HG2 THR 21 11.808 4.483 0.762
139 2HG2 THR 21 2HG2 THR 21 10.611 4.764 -0.577
140 3HG2 THR 21 3HG2 THR 21 11.669 6.084 -0.036
141 H CYS 22 H CYS 22 10.519 1.992 -0.338
142 HA CYS 22 HA CYS 22 9.121 1.998 -2.941
143 1HB CYS 22 1HB CYS 22 10.630 -0.111 -2.500
144 2HB CYS 22 2HB CYS 22 9.492 -0.522 -1.190
145 H ARG 23 H ARG 23 6.946 1.292 -2.790
146 HA ARG 23 HA ARG 23 5.449 1.686 -0.335
147 1HB ARG 23 1HB ARG 23 5.996 3.938 -2.370
148 2HB ARG 23 2HB ARG 23 4.412 3.860 -1.549
149 1HG ARG 23 1HG ARG 23 5.472 4.045 0.675
150 2HG ARG 23 2HG ARG 23 7.080 4.237 -0.106
151 1HD ARG 23 1HD ARG 23 6.135 6.402 0.611
152 2HD ARG 23 2HD ARG 23 6.412 6.357 -1.165
153 HE ARG 23 HE ARG 23 3.783 6.132 0.322
154 1HH1 ARG 23 1HH1 ARG 23 5.386 6.720 -2.867
155 2HH1 ARG 23 2HH1 ARG 23 3.893 6.966 -3.672
156 1HH2 ARG 23 1HH2 ARG 23 1.883 6.418 -0.778
157 2HH2 ARG 23 2HH2 ARG 23 1.831 6.768 -2.478
158 H CYS 24 H CYS 24 3.260 1.489 -0.685
159 HA CYS 24 HA CYS 24 2.471 0.290 -3.242
160 1HB CYS 24 1HB CYS 24 1.219 0.296 -0.458
161 2HB CYS 24 2HB CYS 24 0.245 -0.114 -1.897
162 H VAL 25 H VAL 25 1.920 1.668 -4.799
163 HA VAL 25 HA VAL 25 0.645 4.135 -4.265
164 HB VAL 25 HB VAL 25 0.401 4.408 -6.661
165 1HG1 VAL 25 1HG1 VAL 25 2.831 4.666 -7.010
166 2HG1 VAL 25 2HG1 VAL 25 3.195 3.493 -5.684
167 3HG1 VAL 25 3HG1 VAL 25 2.431 5.085 -5.305
168 1HG2 VAL 25 1HG2 VAL 25 0.109 2.017 -7.376
169 2HG2 VAL 25 2HG2 VAL 25 1.807 1.649 -6.866
170 3HG2 VAL 25 3HG2 VAL 25 1.495 2.795 -8.207
171 H ASP 26 H ASP 26 -0.484 0.948 -4.688
172 HA ASP 26 HA ASP 26 -3.167 1.646 -5.414
173 1HB ASP 26 1HB ASP 26 -2.056 -0.569 -5.949
174 2HB ASP 26 2HB ASP 26 -2.211 -1.005 -4.216
175 HD2 ASP 26 HD2 ASP 26 -3.989 -0.103 -7.121
176 H VAL 27 H VAL 27 -4.314 2.882 -4.104
177 HA VAL 27 HA VAL 27 -4.077 2.733 -1.244
178 HB VAL 27 HB VAL 27 -5.527 4.640 -1.160
179 1HG1 VAL 27 1HG1 VAL 27 -3.097 4.888 -1.668
180 2HG1 VAL 27 2HG1 VAL 27 -4.096 6.205 -2.403
181 3HG1 VAL 27 3HG1 VAL 27 -3.459 4.875 -3.433
182 1HG2 VAL 27 1HG2 VAL 27 -7.168 4.078 -2.940
183 2HG2 VAL 27 2HG2 VAL 27 -5.904 4.323 -4.210
184 3HG2 VAL 27 3HG2 VAL 27 -6.444 5.699 -3.191
185 H ARG 28 H ARG 28 -5.701 2.475 0.278
186 HA ARG 28 HA ARG 28 -7.906 0.754 -0.649
187 1HB ARG 28 1HB ARG 28 -5.944 0.389 1.671
188 2HB ARG 28 2HB ARG 28 -7.434 -0.606 1.520
189 1HG ARG 28 1HG ARG 28 -5.096 -0.506 -0.461
190 2HG ARG 28 2HG ARG 28 -5.480 -1.835 0.699
191 1HD ARG 28 1HD ARG 28 -7.611 -2.346 -0.512
192 2HD ARG 28 2HD ARG 28 -7.376 -0.920 -1.572
193 HE ARG 28 HE ARG 28 -5.684 -1.941 -2.767
194 1HH1 ARG 28 1HH1 ARG 28 -6.545 -4.156 -0.037
195 2HH1 ARG 28 2HH1 ARG 28 -5.919 -5.536 -0.867
196 1HH2 ARG 28 1HH2 ARG 28 -4.874 -3.786 -3.752
197 2HH2 ARG 28 2HH2 ARG 28 -4.995 -5.344 -3.002
198 H GLU 29 H GLU 29 -9.481 0.223 0.970
199 HA GLU 29 HA GLU 29 -10.652 2.273 2.464
200 1HB GLU 29 1HB GLU 29 -10.775 -0.770 2.309
201 2HB GLU 29 2HB GLU 29 -11.822 0.157 3.462
202 1HG GLU 29 1HG GLU 29 -12.962 1.263 1.564
203 2HG GLU 29 2HG GLU 29 -11.792 0.577 0.383
204 HE2 GLU 29 HE2 GLU 29 -14.771 -1.679 1.770
205 H SER 30 H SER 30 -8.901 -0.672 3.570
206 HA SER 30 HA SER 30 -8.317 0.542 6.087
207 1HB SER 30 1HB SER 30 -7.459 -2.230 5.119
208 2HB SER 30 2HB SER 30 -7.146 -1.528 6.748
209 HG SER 30 HG SER 30 -8.966 -2.888 6.657
210 H CYS 31 H CYS 31 -6.648 1.475 6.785
211 HA CYS 31 HA CYS 31 -4.106 1.145 5.290
212 1HB CYS 31 1HB CYS 31 -5.037 3.463 5.317
213 2HB CYS 31 2HB CYS 31 -4.840 3.481 7.116
214 H HIS 32 H HIS 32 -2.564 0.020 6.324
215 HA HIS 32 HA HIS 32 -3.253 -1.013 8.957
216 1HB HIS 32 1HB HIS 32 -1.099 -1.869 6.932
217 2HB HIS 32 2HB HIS 32 -1.513 -2.745 8.445
218 HD1 HIS 32 HD1 HIS 32 -2.661 -1.976 5.008
219 HD2 HIS 32 HD2 HIS 32 -3.907 -4.330 8.234
220 HE1 HIS 32 HE1 HIS 32 -4.523 -3.405 4.164
221 HE2 HIS 32 HE2 HIS 32 -5.242 -4.886 6.124
222 H SER 33 H SER 33 -1.470 -1.285 10.560
223 HA SER 33 HA SER 33 -0.019 1.227 10.757
224 1HB SER 33 1HB SER 33 -1.377 0.066 12.627
225 2HB SER 33 2HB SER 33 0.004 -1.073 12.797
226 HG SER 33 HG SER 33 -0.104 0.905 14.157
227 H ALA 34 H ALA 34 0.709 -1.515 9.145
228 HA ALA 34 HA ALA 34 3.363 -2.005 9.763
229 1HB ALA 34 1HB ALA 34 3.455 -3.104 7.525
230 2HB ALA 34 2HB ALA 34 1.889 -2.335 7.077
231 3HB ALA 34 3HB ALA 34 1.954 -3.538 8.408
232 H CYS 35 H CYS 35 1.932 0.366 7.476
233 HA CYS 35 HA CYS 35 4.511 1.723 7.306
234 1HB CYS 35 1HB CYS 35 3.557 3.087 5.608
235 2HB CYS 35 2HB CYS 35 3.104 1.364 5.321
236 H ASP 36 H ASP 36 4.903 3.788 8.323
237 HA ASP 36 HA ASP 36 3.480 3.887 10.792
238 1HB ASP 36 1HB ASP 36 5.992 4.295 10.519
239 2HB ASP 36 2HB ASP 36 5.591 5.901 9.817
240 HD2 ASP 36 HD2 ASP 36 5.846 6.995 13.050
241 H LYS 37 H LYS 37 3.300 5.976 7.909
242 HA LYS 37 HA LYS 37 1.364 7.643 9.334
243 1HB LYS 37 1HB LYS 37 3.560 8.770 8.568
244 2HB LYS 37 2HB LYS 37 2.986 8.524 6.912
245 1HG LYS 37 1HG LYS 37 2.289 10.744 7.478
246 2HG LYS 37 2HG LYS 37 0.807 9.750 7.636
247 1HD LYS 37 1HD LYS 37 1.356 9.557 10.176
248 2HD LYS 37 2HD LYS 37 2.653 10.757 9.891
249 1HE LYS 37 1HE LYS 37 0.898 12.413 9.106
250 2HE LYS 37 2HE LYS 37 -0.385 11.171 9.417
251 1HZ LYS 37 1HZ LYS 37 -0.125 12.693 11.249
252 2HZ LYS 37 2HZ LYS 37 1.509 12.272 11.426
253 3HZ LYS 37 3HZ LYS 37 0.305 11.117 11.713
254 H CYS 38 H CYS 38 -0.501 6.592 8.942
255 HA CYS 38 HA CYS 38 -1.452 6.177 6.234
256 1HB CYS 38 1HB CYS 38 -2.403 5.840 9.114
257 2HB CYS 38 2HB CYS 38 -3.591 5.679 7.763
258 H VAL 39 H VAL 39 -2.228 7.921 5.041
259 HA VAL 39 HA VAL 39 -3.777 9.961 6.504
260 HB VAL 39 HB VAL 39 -2.210 9.906 3.895
261 1HG1 VAL 39 1HG1 VAL 39 -3.822 12.170 5.251
262 2HG1 VAL 39 2HG1 VAL 39 -4.143 11.425 3.622
263 3HG1 VAL 39 3HG1 VAL 39 -2.659 12.400 3.892
264 1HG2 VAL 39 1HG2 VAL 39 -1.731 11.300 6.608
265 2HG2 VAL 39 2HG2 VAL 39 -0.834 11.697 5.095
266 3HG2 VAL 39 3HG2 VAL 39 -0.686 10.045 5.811
267 H CYS 40 H CYS 40 -5.908 10.409 5.430
268 HA CYS 40 HA CYS 40 -6.632 8.618 3.238
269 1HB CYS 40 1HB CYS 40 -8.124 9.051 5.858
270 2HB CYS 40 2HB CYS 40 -8.814 8.225 4.455
271 H ALA 41 H ALA 41 -7.825 9.516 1.812
272 HA ALA 41 HA ALA 41 -9.112 12.099 2.152
273 1HB ALA 41 1HB ALA 41 -9.238 10.126 -0.168
274 2HB ALA 41 2HB ALA 41 -8.188 11.598 -0.058
275 3HB ALA 41 3HB ALA 41 -9.982 11.780 -0.097
276 H TYR 42 H TYR 42 -11.133 12.403 2.759
277 HA TYR 42 HA TYR 42 -12.489 10.233 3.972
278 1HB TYR 42 1HB TYR 42 -13.981 12.103 4.855
279 2HB TYR 42 2HB TYR 42 -12.213 12.228 5.178
280 HD1 TYR 42 HD1 TYR 42 -14.935 13.471 2.869
281 HD2 TYR 42 HD2 TYR 42 -10.948 14.139 4.383
282 HE1 TYR 42 HE1 TYR 42 -14.854 15.636 1.722
283 HE2 TYR 42 HE2 TYR 42 -10.918 16.335 3.280
284 HH TYR 42 HH TYR 42 -13.452 17.307 1.002
285 H SER 43 H SER 43 -12.425 10.182 1.185
286 HA SER 43 HA SER 43 -14.759 10.716 -0.193
287 1HB SER 43 1HB SER 43 -12.939 8.319 -0.779
288 2HB SER 43 2HB SER 43 -13.849 9.386 -1.957
289 HG SER 43 HG SER 43 -11.778 10.058 -2.017
290 H ASN 44 H ASN 44 -15.727 8.572 -1.457
291 HA ASN 44 HA ASN 44 -16.503 6.597 0.540
292 1HB ASN 44 1HB ASN 44 -18.056 8.572 0.536
293 2HB ASN 44 2HB ASN 44 -18.453 8.219 -1.156
294 1HD2 ASN 44 1HD2 ASN 44 -18.331 6.574 2.141
295 2HD2 ASN 44 2HD2 ASN 44 -19.719 5.618 1.869
296 HA PRO 45 HA PRO 45 -16.050 4.652 0.694
297 1HB PRO 45 1HB PRO 45 -14.324 2.593 0.110
298 2HB PRO 45 2HB PRO 45 -16.070 2.432 -0.120
299 1HG PRO 45 1HG PRO 45 -14.007 3.221 -2.253
300 2HG PRO 45 2HG PRO 45 -15.241 1.911 -2.376
301 1HD PRO 45 1HD PRO 45 -15.645 4.464 -3.390
302 2HD PRO 45 2HD PRO 45 -17.027 3.530 -2.657
303 HA PRO 46 HA PRO 46 -12.651 7.282 1.033
304 1HB PRO 46 1HB PRO 46 -11.361 6.608 3.371
305 2HB PRO 46 2HB PRO 46 -13.066 7.212 3.350
306 1HG PRO 46 1HG PRO 46 -12.139 4.294 3.440
307 2HG PRO 46 2HG PRO 46 -13.348 5.160 4.500
308 1HD PRO 46 1HD PRO 46 -14.078 3.631 2.286
309 2HD PRO 46 2HD PRO 46 -14.997 5.187 2.789
310 H GLN 47 H GLN 47 -10.209 7.538 1.063
311 HA GLN 47 HA GLN 47 -8.944 5.140 -0.125
312 1HB GLN 47 1HB GLN 47 -8.677 8.056 -1.063
313 2HB GLN 47 2HB GLN 47 -7.829 6.630 -1.760
314 1HG GLN 47 1HG GLN 47 -10.897 7.006 -1.822
315 2HG GLN 47 2HG GLN 47 -9.793 7.606 -3.102
316 1HE2 GLN 47 1HE2 GLN 47 -10.977 4.658 -1.473
317 2HE2 GLN 47 2HE2 GLN 47 -10.630 3.588 -2.812
318 H CYS 48 H CYS 48 -6.820 4.920 0.543
319 HA CYS 48 HA CYS 48 -5.804 6.887 2.440
320 1HB CYS 48 1HB CYS 48 -6.504 3.949 3.044
321 2HB CYS 48 2HB CYS 48 -5.559 5.043 4.130
322 H GLN 49 H GLN 49 -3.785 6.901 2.631
323 HA GLN 49 HA GLN 49 -2.198 5.228 0.849
324 1HB GLN 49 1HB GLN 49 -2.153 8.190 1.704
325 2HB GLN 49 2HB GLN 49 -0.750 7.415 0.863
326 1HG GLN 49 1HG GLN 49 -1.603 8.331 -0.896
327 2HG GLN 49 2HG GLN 49 -2.555 6.807 -0.987
328 1HE2 GLN 49 1HE2 GLN 49 -2.967 9.541 -2.014
329 2HE2 GLN 49 2HE2 GLN 49 -4.421 10.218 -1.288
330 H CYS 50 H CYS 50 -0.383 4.405 1.566
331 HA CYS 50 HA CYS 50 0.669 5.109 4.224
332 1HB CYS 50 1HB CYS 50 1.709 3.287 1.956
333 2HB CYS 50 2HB CYS 50 2.659 3.631 3.412
334 H TYR 51 H TYR 51 0.985 7.282 4.018
335 HA TYR 51 HA TYR 51 2.601 8.602 2.101
336 1HB TYR 51 1HB TYR 51 1.642 9.178 4.925
337 2HB TYR 51 2HB TYR 51 3.129 10.027 4.419
338 HD1 TYR 51 HD1 TYR 51 -0.172 9.120 2.685
339 HD2 TYR 51 HD2 TYR 51 2.626 12.274 3.700
340 HE1 TYR 51 HE1 TYR 51 -1.491 10.715 1.452
341 HE2 TYR 51 HE2 TYR 51 1.279 13.831 2.540
342 HH TYR 51 HH TYR 51 -0.828 14.213 1.674
343 H ASP 52 H ASP 52 3.334 6.827 4.971
344 HA ASP 52 HA ASP 52 6.166 7.427 4.904
345 1HB ASP 52 1HB ASP 52 4.923 7.043 7.061
346 2HB ASP 52 2HB ASP 52 4.664 5.318 6.553
347 HD2 ASP 52 HD2 ASP 52 7.583 4.556 8.117
348 H THR 53 H THR 53 7.887 6.129 4.396
349 HA THR 53 HA THR 53 7.440 4.399 2.203
350 HB THR 53 HB THR 53 10.039 4.328 2.252
351 HG1 THR 53 HG1 THR 53 10.685 5.063 4.166
352 1HG2 THR 53 1HG2 THR 53 8.728 5.810 0.743
353 2HG2 THR 53 2HG2 THR 53 10.110 6.721 1.439
354 3HG2 THR 53 3HG2 THR 53 8.453 6.993 2.070
355 H HIS 54 H HIS 54 8.610 2.311 1.854
356 HA HIS 54 HA HIS 54 9.061 0.788 4.251
357 1HB HIS 54 1HB HIS 54 6.498 0.677 3.056
358 2HB HIS 54 2HB HIS 54 7.364 -0.644 2.192
359 HD1 HIS 54 HD1 HIS 54 7.868 -2.693 3.385
360 HD2 HIS 54 HD2 HIS 54 5.829 0.072 5.771
361 HE1 HIS 54 HE1 HIS 54 7.073 -3.936 5.406
362 HE2 HIS 54 HE2 HIS 54 5.794 -2.249 6.830
363 H LYS 55 H LYS 55 9.897 -1.442 3.486
364 HA LYS 55 HA LYS 55 11.179 -1.295 0.836
365 1HB LYS 55 1HB LYS 55 13.149 -2.426 1.835
366 2HB LYS 55 2HB LYS 55 12.858 -0.803 2.537
367 1HG LYS 55 1HG LYS 55 11.899 -1.759 4.576
368 2HG LYS 55 2HG LYS 55 12.002 -3.427 3.900
369 1HD LYS 55 1HD LYS 55 14.494 -3.194 3.743
370 2HD LYS 55 2HD LYS 55 14.400 -1.553 4.461
371 1HE LYS 55 1HE LYS 55 13.470 -4.173 5.832
372 2HE LYS 55 2HE LYS 55 15.036 -3.322 6.142
373 1HZ LYS 55 1HZ LYS 55 13.369 -2.763 7.776
374 2HZ LYS 55 2HZ LYS 55 12.312 -2.196 6.573
375 3HZ LYS 55 3HZ LYS 55 13.777 -1.394 6.854
376 H PHE 56 H PHE 56 8.706 -2.438 0.942
377 HA PHE 56 HA PHE 56 9.287 -5.203 0.529
378 1HB PHE 56 1HB PHE 56 8.691 -4.696 3.174
379 2HB PHE 56 2HB PHE 56 7.011 -4.789 2.538
380 HD1 PHE 56 HD1 PHE 56 10.329 -6.547 2.673
381 HD2 PHE 56 HD2 PHE 56 6.065 -6.985 2.222
382 HE1 PHE 56 HE1 PHE 56 10.557 -8.990 2.852
383 HE2 PHE 56 HE2 PHE 56 6.293 -9.418 2.408
384 HZ PHE 56 HZ PHE 56 8.538 -10.449 2.722
385 H CYS 57 H CYS 57 7.280 -6.328 -0.293
386 HA CYS 57 HA CYS 57 5.178 -4.531 -1.224
387 1HB CYS 57 1HB CYS 57 6.851 -4.821 -3.101
388 2HB CYS 57 2HB CYS 57 6.718 -6.591 -2.917
389 H TYR 58 H TYR 58 3.221 -5.443 -0.811
390 HA TYR 58 HA TYR 58 3.201 -8.277 0.073
391 1HB TYR 58 1HB TYR 58 1.256 -5.975 0.558
392 2HB TYR 58 2HB TYR 58 0.841 -7.702 0.834
393 HD1 TYR 58 HD1 TYR 58 3.043 -4.879 2.002
394 HD2 TYR 58 HD2 TYR 58 1.888 -8.995 2.639
395 HE1 TYR 58 HE1 TYR 58 4.105 -4.846 4.170
396 HE2 TYR 58 HE2 TYR 58 2.953 -8.951 4.817
397 HH TYR 58 HH TYR 58 4.292 -7.767 6.259
398 H LYS 59 H LYS 59 1.800 -9.677 -0.733
399 HA LYS 59 HA LYS 59 1.240 -9.790 -3.412
400 1HB LYS 59 1HB LYS 59 -0.187 -11.370 -1.237
401 2HB LYS 59 2HB LYS 59 0.044 -11.832 -2.957
402 1HG LYS 59 1HG LYS 59 1.867 -13.025 -2.240
403 2HG LYS 59 2HG LYS 59 2.700 -11.468 -2.043
404 1HD LYS 59 1HD LYS 59 1.221 -11.626 0.353
405 2HD LYS 59 2HD LYS 59 1.500 -13.350 0.004
406 1HE LYS 59 1HE LYS 59 3.932 -13.075 0.044
407 2HE LYS 59 2HE LYS 59 3.785 -11.271 0.066
408 1HZ LYS 59 1HZ LYS 59 4.248 -12.094 2.225
409 2HZ LYS 59 2HZ LYS 59 2.904 -13.129 2.201
410 3HZ LYS 59 3HZ LYS 59 2.677 -11.448 2.196
411 H ALA 60 H ALA 60 -0.853 -10.133 -4.523
412 HA ALA 60 HA ALA 60 -2.572 -7.921 -3.932
413 1HB ALA 60 1HB ALA 60 -2.662 -10.105 -6.058
414 2HB ALA 60 2HB ALA 60 -1.868 -8.498 -6.237
415 3HB ALA 60 3HB ALA 60 -3.665 -8.593 -6.060
416 H CYS 61 H CYS 61 -4.485 -7.871 -3.034
417 HA CYS 61 HA CYS 61 -6.123 -10.254 -2.836
418 1HB CYS 61 1HB CYS 61 -5.970 -8.103 -0.659
419 2HB CYS 61 2HB CYS 61 -6.957 -9.599 -0.607
420 H HIS 62 H HIS 62 -7.842 -9.688 -4.144
421 HA HIS 62 HA HIS 62 -7.559 -7.147 -5.380
422 1HB HIS 62 1HB HIS 62 -9.736 -9.226 -5.843
423 2HB HIS 62 2HB HIS 62 -9.271 -7.888 -6.946
424 HD1 HIS 62 HD1 HIS 62 -6.440 -8.031 -7.384
425 HD2 HIS 62 HD2 HIS 62 -8.547 -11.584 -6.654
426 HE1 HIS 62 HE1 HIS 62 -5.061 -9.906 -8.314
427 HE2 HIS 62 HE2 HIS 62 -6.337 -12.057 -7.813
428 H ASN 63 H ASN 63 -8.358 -5.236 -4.586
429 HA ASN 63 HA ASN 63 -10.289 -5.188 -2.607
430 1HB ASN 63 1HB ASN 63 -10.139 -2.744 -2.649
431 2HB ASN 63 2HB ASN 63 -8.563 -3.544 -2.543
432 1HD2 ASN 63 1HD2 ASN 63 -7.054 -3.269 -4.516
433 2HD2 ASN 63 2HD2 ASN 63 -7.529 -2.237 -5.800
434 H SER 64 H SER 64 -10.593 -3.526 -5.621
435 HA SER 64 HA SER 64 -13.549 -3.856 -5.555
436 1HB SER 64 1HB SER 64 -11.882 -1.648 -6.907
437 2HB SER 64 2HB SER 64 -13.688 -1.716 -6.801
438 HG SER 64 HG SER 64 -11.722 -1.174 -4.855
439 H GLU 65 H GLU 65 -14.662 -4.217 -7.542
440 HA GLU 65 HA GLU 65 -13.578 -5.759 -9.507
441 1HB GLU 65 1HB GLU 65 -16.114 -4.091 -9.776
442 2HB GLU 65 2HB GLU 65 -15.626 -5.557 -10.702
443 1HG GLU 65 1HG GLU 65 -17.057 -6.604 -9.266
444 2HG GLU 65 2HG GLU 65 -15.624 -6.700 -8.209
445 HE2 GLU 65 HE2 GLU 65 -16.952 -3.891 -6.288
446 H ILE 66 H ILE 66 -11.729 -4.440 -9.812
447 HA ILE 66 HA ILE 66 -11.740 -3.238 -12.425
448 HB ILE 66 HB ILE 66 -12.218 -1.330 -10.970
449 1HG1 ILE 66 1HG1 ILE 66 -9.377 -1.323 -12.182
450 2HG1 ILE 66 2HG1 ILE 66 -10.910 -1.210 -13.097
451 1HG2 ILE 66 1HG2 ILE 66 -10.731 -0.429 -9.329
452 2HG2 ILE 66 2HG2 ILE 66 -9.469 -1.663 -9.635
453 3HG2 ILE 66 3HG2 ILE 66 -11.054 -2.127 -8.873
454 1HD1 ILE 66 1HD1 ILE 66 -9.838 0.844 -11.043
455 2HD1 ILE 66 2HD1 ILE 66 -11.451 0.949 -11.828
456 3HD1 ILE 66 3HD1 ILE 66 -9.953 1.054 -12.820
457 H GLU 67 H GLU 67 -9.796 -4.086 -9.478
458 HA GLU 67 HA GLU 67 -7.983 -5.589 -11.152
459 1HB GLU 67 1HB GLU 67 -7.212 -3.351 -9.191
460 2HB GLU 67 2HB GLU 67 -6.062 -4.647 -9.672
461 1HG GLU 67 1HG GLU 67 -6.010 -3.932 -11.996
462 2HG GLU 67 2HG GLU 67 -7.367 -2.783 -11.767
463 HE2 GLU 67 HE2 GLU 67 -7.067 -1.075 -10.576
Start of MODEL 2
1 1H GLY 1 1H GLY 1 -7.901 -21.802 5.304
2 2H GLY 1 2H GLY 1 -8.034 -22.376 6.897
3 3H GLY 1 3H GLY 1 -6.527 -21.871 6.298
4 1HA GLY 1 1HA GLY 1 -8.875 -20.147 6.630
5 2HA GLY 1 2HA GLY 1 -7.482 -20.276 7.783
6 H ASP 2 H ASP 2 -8.169 -17.813 6.839
7 HA ASP 2 HA ASP 2 -5.755 -16.995 5.443
8 1HB ASP 2 1HB ASP 2 -8.581 -16.470 4.246
9 2HB ASP 2 2HB ASP 2 -7.083 -15.623 3.717
10 HD2 ASP 2 HD2 ASP 2 -7.932 -19.242 2.345
11 H ASP 3 H ASP 3 -6.213 -16.598 7.958
12 HA ASP 3 HA ASP 3 -7.153 -13.853 8.264
13 1HB ASP 3 1HB ASP 3 -7.369 -14.328 10.675
14 2HB ASP 3 2HB ASP 3 -8.401 -15.399 9.676
15 HD2 ASP 3 HD2 ASP 3 -6.652 -18.314 10.420
16 H VAL 4 H VAL 4 -5.369 -12.856 7.441
17 HA VAL 4 HA VAL 4 -2.837 -13.184 8.908
18 HB VAL 4 HB VAL 4 -3.185 -12.596 5.930
19 1HG1 VAL 4 1HG1 VAL 4 -1.067 -11.708 6.813
20 2HG1 VAL 4 2HG1 VAL 4 -0.703 -13.193 5.894
21 3HG1 VAL 4 3HG1 VAL 4 -0.721 -13.227 7.702
22 1HG2 VAL 4 1HG2 VAL 4 -3.932 -14.940 6.325
23 2HG2 VAL 4 2HG2 VAL 4 -2.485 -15.265 7.342
24 3HG2 VAL 4 3HG2 VAL 4 -2.308 -14.949 5.579
25 H LYS 5 H LYS 5 -1.978 -11.264 9.664
26 HA LYS 5 HA LYS 5 -3.457 -8.814 9.063
27 1HB LYS 5 1HB LYS 5 -1.605 -9.631 11.351
28 2HB LYS 5 2HB LYS 5 -2.326 -8.009 11.167
29 1HG LYS 5 1HG LYS 5 -4.642 -9.116 11.153
30 2HG LYS 5 2HG LYS 5 -3.845 -10.670 11.533
31 1HD LYS 5 1HD LYS 5 -4.734 -9.641 13.582
32 2HD LYS 5 2HD LYS 5 -2.941 -9.719 13.661
33 1HE LYS 5 1HE LYS 5 -2.770 -7.283 13.121
34 2HE LYS 5 2HE LYS 5 -4.560 -7.188 12.895
35 1HZ LYS 5 1HZ LYS 5 -3.155 -7.954 15.393
36 2HZ LYS 5 2HZ LYS 5 -4.834 -7.794 15.181
37 3HZ LYS 5 3HZ LYS 5 -3.830 -6.429 15.048
38 H SER 6 H SER 6 -1.294 -10.045 7.479
39 HA SER 6 HA SER 6 0.994 -8.415 7.412
40 1HB SER 6 1HB SER 6 1.314 -9.217 5.058
41 2HB SER 6 2HB SER 6 0.889 -10.561 6.181
42 HG SER 6 HG SER 6 -0.687 -9.294 4.200
43 H ALA 7 H ALA 7 1.611 -6.676 6.010
44 HA ALA 7 HA ALA 7 -0.490 -4.965 5.032
45 1HB ALA 7 1HB ALA 7 1.384 -3.680 3.975
46 2HB ALA 7 2HB ALA 7 2.518 -5.016 4.400
47 3HB ALA 7 3HB ALA 7 1.746 -4.042 5.698
48 H CYS 8 H CYS 8 -1.135 -4.637 2.898
49 HA CYS 8 HA CYS 8 -0.358 -6.657 0.914
50 1HB CYS 8 1HB CYS 8 -2.594 -7.220 0.316
51 2HB CYS 8 2HB CYS 8 -2.433 -7.465 2.079
52 H CYS 9 H CYS 9 -0.825 -6.065 -1.332
53 HA CYS 9 HA CYS 9 -1.398 -3.241 -1.750
54 1HB CYS 9 1HB CYS 9 1.057 -3.547 -0.924
55 2HB CYS 9 2HB CYS 9 1.352 -4.468 -2.416
56 H ASP 10 H ASP 10 -2.455 -3.122 -3.768
57 HA ASP 10 HA ASP 10 -2.227 -5.468 -5.504
58 1HB ASP 10 1HB ASP 10 -3.908 -2.931 -5.617
59 2HB ASP 10 2HB ASP 10 -4.028 -4.228 -6.796
60 HD2 ASP 10 HD2 ASP 10 -6.444 -4.546 -3.928
61 H THR 11 H THR 11 -1.230 -2.001 -5.579
62 HA THR 11 HA THR 11 0.449 -2.466 -7.920
63 HB THR 11 HB THR 11 -1.918 -0.509 -7.691
64 HG1 THR 11 HG1 THR 11 -1.383 -2.569 -9.581
65 1HG2 THR 11 1HG2 THR 11 -0.072 0.677 -8.868
66 2HG2 THR 11 2HG2 THR 11 -1.333 0.213 -10.047
67 3HG2 THR 11 3HG2 THR 11 0.199 -0.738 -9.949
68 H CYS 12 H CYS 12 2.163 -1.095 -7.970
69 HA CYS 12 HA CYS 12 2.521 0.846 -5.838
70 1HB CYS 12 1HB CYS 12 4.266 -0.686 -4.834
71 2HB CYS 12 2HB CYS 12 2.611 -1.400 -4.865
72 H LEU 13 H LEU 13 4.932 1.244 -5.633
73 HA LEU 13 HA LEU 13 6.297 1.462 -8.224
74 1HB LEU 13 1HB LEU 13 4.670 3.308 -7.966
75 2HB LEU 13 2HB LEU 13 5.368 3.754 -6.389
76 HG LEU 13 HG LEU 13 6.893 3.801 -9.095
77 1HD1 LEU 13 1HD1 LEU 13 4.912 5.276 -9.214
78 2HD1 LEU 13 2HD1 LEU 13 6.409 6.267 -9.107
79 3HD1 LEU 13 3HD1 LEU 13 5.357 6.056 -7.655
80 1HD2 LEU 13 1HD2 LEU 13 8.523 3.883 -7.280
81 2HD2 LEU 13 2HD2 LEU 13 7.518 5.038 -6.338
82 3HD2 LEU 13 3HD2 LEU 13 8.321 5.561 -7.878
83 H CYS 14 H CYS 14 8.013 0.411 -7.671
84 HA CYS 14 HA CYS 14 9.456 1.025 -5.229
85 1HB CYS 14 1HB CYS 14 10.081 -1.043 -7.356
86 2HB CYS 14 2HB CYS 14 10.952 -0.824 -5.827
87 H THR 15 H THR 15 11.436 1.971 -5.027
88 HA THR 15 HA THR 15 12.084 3.724 -7.224
89 HB THR 15 HB THR 15 13.782 4.719 -5.835
90 HG1 THR 15 HG1 THR 15 13.650 4.046 -3.586
91 1HG2 THR 15 1HG2 THR 15 12.219 5.641 -4.135
92 2HG2 THR 15 2HG2 THR 15 11.113 4.230 -4.314
93 3HG2 THR 15 3HG2 THR 15 11.334 5.376 -5.679
94 H ARG 16 H ARG 16 14.030 3.997 -8.301
95 HA ARG 16 HA ARG 16 16.051 1.931 -8.141
96 1HB ARG 16 1HB ARG 16 15.650 4.432 -9.834
97 2HB ARG 16 2HB ARG 16 17.303 3.769 -9.642
98 1HG ARG 16 1HG ARG 16 14.967 2.097 -10.688
99 2HG ARG 16 2HG ARG 16 16.091 3.043 -11.719
100 1HD ARG 16 1HD ARG 16 18.054 1.788 -10.872
101 2HD ARG 16 2HD ARG 16 17.013 0.798 -9.783
102 HE ARG 16 HE ARG 16 17.295 0.589 -12.731
103 1HH1 ARG 16 1HH1 ARG 16 15.361 -0.365 -9.876
104 2HH1 ARG 16 2HH1 ARG 16 14.848 -1.866 -10.577
105 1HH2 ARG 16 1HH2 ARG 16 16.597 -1.416 -13.632
106 2HH2 ARG 16 2HH2 ARG 16 15.550 -2.463 -12.730
107 H SER 17 H SER 17 17.535 2.057 -6.499
108 HA SER 17 HA SER 17 18.796 4.385 -5.645
109 1HB SER 17 1HB SER 17 16.432 4.743 -4.561
110 2HB SER 17 2HB SER 17 16.812 3.330 -3.535
111 HG SER 17 HG SER 17 17.402 5.348 -2.557
112 H GLN 18 H GLN 18 19.380 3.592 -3.065
113 HA GLN 18 HA GLN 18 20.398 0.859 -3.074
114 1HB GLN 18 1HB GLN 18 22.132 3.374 -3.302
115 2HB GLN 18 2HB GLN 18 22.759 1.862 -2.567
116 1HG GLN 18 1HG GLN 18 22.265 0.614 -4.750
117 2HG GLN 18 2HG GLN 18 21.770 2.181 -5.476
118 1HE2 GLN 18 1HE2 GLN 18 24.576 0.749 -3.656
119 2HE2 GLN 18 2HE2 GLN 18 25.779 1.548 -4.637
120 HA PRO 19 HA PRO 19 19.480 -0.402 -1.717
121 1HB PRO 19 1HB PRO 19 17.662 -1.053 0.257
122 2HB PRO 19 2HB PRO 19 19.465 -1.194 0.525
123 1HG PRO 19 1HG PRO 19 17.655 1.166 1.302
124 2HG PRO 19 2HG PRO 19 18.786 0.231 2.374
125 1HD PRO 19 1HD PRO 19 19.522 2.593 1.109
126 2HD PRO 19 2HD PRO 19 20.714 1.226 1.333
127 HA PRO 20 HA PRO 20 15.715 1.428 -3.401
128 1HB PRO 20 1HB PRO 20 14.233 -0.758 -4.213
129 2HB PRO 20 2HB PRO 20 15.773 -0.297 -5.029
130 1HG PRO 20 1HG PRO 20 15.403 -2.353 -2.792
131 2HG PRO 20 2HG PRO 20 16.221 -2.593 -4.397
132 1HD PRO 20 1HD PRO 20 17.643 -1.988 -2.104
133 2HD PRO 20 2HD PRO 20 18.119 -1.261 -3.722
134 H THR 21 H THR 21 13.348 1.452 -3.116
135 HA THR 21 HA THR 21 12.291 0.438 -0.624
136 HB THR 21 HB THR 21 13.797 2.238 0.156
137 HG1 THR 21 HG1 THR 21 12.398 2.934 1.532
138 1HG2 THR 21 1HG2 THR 21 13.001 4.635 -0.179
139 2HG2 THR 21 2HG2 THR 21 11.952 4.067 -1.524
140 3HG2 THR 21 3HG2 THR 21 13.746 3.895 -1.627
141 H CYS 22 H CYS 22 9.983 0.966 -0.436
142 HA CYS 22 HA CYS 22 8.878 1.654 -3.088
143 1HB CYS 22 1HB CYS 22 9.842 -0.753 -3.070
144 2HB CYS 22 2HB CYS 22 8.567 -1.170 -1.902
145 H ARG 23 H ARG 23 6.585 1.371 -3.264
146 HA ARG 23 HA ARG 23 4.964 1.124 -0.939
147 1HB ARG 23 1HB ARG 23 4.147 3.580 -0.876
148 2HB ARG 23 2HB ARG 23 5.777 3.282 -0.266
149 1HG ARG 23 1HG ARG 23 6.229 5.088 -1.376
150 2HG ARG 23 2HG ARG 23 6.651 3.949 -2.660
151 1HD ARG 23 1HD ARG 23 5.400 5.848 -3.656
152 2HD ARG 23 2HD ARG 23 4.355 4.384 -3.739
153 HE ARG 23 HE ARG 23 2.859 5.369 -2.334
154 1HH1 ARG 23 1HH1 ARG 23 5.902 7.282 -1.960
155 2HH1 ARG 23 2HH1 ARG 23 5.149 8.492 -1.013
156 1HH2 ARG 23 1HH2 ARG 23 1.943 6.888 -1.064
157 2HH2 ARG 23 2HH2 ARG 23 2.797 8.280 -0.452
158 H CYS 24 H CYS 24 2.768 1.599 -1.264
159 HA CYS 24 HA CYS 24 1.843 0.744 -3.858
160 1HB CYS 24 1HB CYS 24 0.257 1.583 -1.370
161 2HB CYS 24 2HB CYS 24 -0.388 0.650 -2.758
162 H VAL 25 H VAL 25 -0.098 1.856 -4.675
163 HA VAL 25 HA VAL 25 -0.307 4.743 -4.669
164 HB VAL 25 HB VAL 25 0.343 5.012 -7.005
165 1HG1 VAL 25 1HG1 VAL 25 2.203 5.255 -5.287
166 2HG1 VAL 25 2HG1 VAL 25 2.775 4.831 -6.947
167 3HG1 VAL 25 3HG1 VAL 25 2.713 3.568 -5.671
168 1HG2 VAL 25 1HG2 VAL 25 -0.178 2.837 -8.032
169 2HG2 VAL 25 2HG2 VAL 25 0.942 1.999 -6.900
170 3HG2 VAL 25 3HG2 VAL 25 1.590 3.056 -8.203
171 H ASP 26 H ASP 26 -1.679 1.482 -5.737
172 HA ASP 26 HA ASP 26 -4.071 2.928 -6.326
173 1HB ASP 26 1HB ASP 26 -5.250 0.865 -5.845
174 2HB ASP 26 2HB ASP 26 -3.841 0.523 -6.903
175 HD2 ASP 26 HD2 ASP 26 -5.475 -0.562 -4.367
176 H VAL 27 H VAL 27 -5.596 3.796 -4.867
177 HA VAL 27 HA VAL 27 -4.829 3.823 -2.045
178 HB VAL 27 HB VAL 27 -6.453 5.326 -1.607
179 1HG1 VAL 27 1HG1 VAL 27 -5.523 6.020 -4.468
180 2HG1 VAL 27 2HG1 VAL 27 -4.492 6.159 -3.007
181 3HG1 VAL 27 3HG1 VAL 27 -5.972 7.180 -3.168
182 1HG2 VAL 27 1HG2 VAL 27 -8.457 4.380 -2.675
183 2HG2 VAL 27 2HG2 VAL 27 -7.773 4.658 -4.320
184 3HG2 VAL 27 3HG2 VAL 27 -8.243 6.050 -3.279
185 H ARG 28 H ARG 28 -6.105 2.885 -0.360
186 HA ARG 28 HA ARG 28 -8.351 1.325 -1.119
187 1HB ARG 28 1HB ARG 28 -7.519 -0.902 -0.796
188 2HB ARG 28 2HB ARG 28 -6.596 -0.105 -2.038
189 1HG ARG 28 1HG ARG 28 -4.801 -0.969 -0.993
190 2HG ARG 28 2HG ARG 28 -4.913 0.539 -0.018
191 1HD ARG 28 1HD ARG 28 -4.549 -1.695 1.291
192 2HD ARG 28 2HD ARG 28 -5.879 -0.594 1.830
193 HE ARG 28 HE ARG 28 -7.329 -2.319 1.474
194 1HH1 ARG 28 1HH1 ARG 28 -4.740 -2.761 -0.969
195 2HH1 ARG 28 2HH1 ARG 28 -5.551 -4.106 -1.707
196 1HH2 ARG 28 1HH2 ARG 28 -8.310 -4.059 0.476
197 2HH2 ARG 28 2HH2 ARG 28 -7.580 -4.845 -0.910
198 H GLU 29 H GLU 29 -8.914 -0.329 0.616
199 HA GLU 29 HA GLU 29 -9.889 1.155 2.705
200 1HB GLU 29 1HB GLU 29 -9.732 -1.747 1.905
201 2HB GLU 29 2HB GLU 29 -10.610 -1.269 3.413
202 1HG GLU 29 1HG GLU 29 -12.154 0.161 2.022
203 2HG GLU 29 2HG GLU 29 -11.246 -0.270 0.526
204 HE2 GLU 29 HE2 GLU 29 -13.850 -2.824 2.122
205 H SER 30 H SER 30 -7.731 -1.699 3.207
206 HA SER 30 HA SER 30 -7.401 -0.904 5.894
207 1HB SER 30 1HB SER 30 -5.763 -3.044 4.433
208 2HB SER 30 2HB SER 30 -5.748 -2.726 6.208
209 HG SER 30 HG SER 30 -7.142 -4.433 5.646
210 H CYS 31 H CYS 31 -6.079 0.243 6.992
211 HA CYS 31 HA CYS 31 -3.397 0.886 5.896
212 1HB CYS 31 1HB CYS 31 -5.380 2.502 7.361
213 2HB CYS 31 2HB CYS 31 -3.783 2.481 8.229
214 H HIS 32 H HIS 32 -1.598 0.757 7.540
215 HA HIS 32 HA HIS 32 -2.182 -0.905 9.851
216 1HB HIS 32 1HB HIS 32 -0.355 -1.722 7.520
217 2HB HIS 32 2HB HIS 32 -0.044 -2.340 9.185
218 HD1 HIS 32 HD1 HIS 32 -2.433 -2.523 6.375
219 HD2 HIS 32 HD2 HIS 32 -1.677 -4.514 9.982
220 HE1 HIS 32 HE1 HIS 32 -3.885 -4.552 6.399
221 HE2 HIS 32 HE2 HIS 32 -3.390 -5.774 8.599
222 H SER 33 H SER 33 -0.291 -1.041 11.306
223 HA SER 33 HA SER 33 0.953 1.469 11.607
224 1HB SER 33 1HB SER 33 1.518 -1.229 12.993
225 2HB SER 33 2HB SER 33 2.043 0.379 13.614
226 HG SER 33 HG SER 33 0.128 -0.355 14.573
227 H ALA 34 H ALA 34 1.780 -0.997 9.556
228 HA ALA 34 HA ALA 34 4.555 -1.122 9.719
229 1HB ALA 34 1HB ALA 34 3.116 -2.832 8.583
230 2HB ALA 34 2HB ALA 34 4.331 -2.195 7.436
231 3HB ALA 34 3HB ALA 34 2.629 -1.609 7.345
232 H CYS 35 H CYS 35 2.519 1.359 8.471
233 HA CYS 35 HA CYS 35 4.884 2.798 7.518
234 1HB CYS 35 1HB CYS 35 3.517 3.951 5.925
235 2HB CYS 35 2HB CYS 35 3.216 2.174 5.786
236 H ASP 36 H ASP 36 4.968 5.140 8.148
237 HA ASP 36 HA ASP 36 3.949 5.368 10.823
238 1HB ASP 36 1HB ASP 36 5.289 7.343 11.050
239 2HB ASP 36 2HB ASP 36 6.253 6.067 10.229
240 HD2 ASP 36 HD2 ASP 36 6.524 7.822 7.263
241 H LYS 37 H LYS 37 3.349 7.256 7.816
242 HA LYS 37 HA LYS 37 1.086 8.537 9.158
243 1HB LYS 37 1HB LYS 37 2.976 9.950 8.152
244 2HB LYS 37 2HB LYS 37 2.489 9.343 6.554
245 1HG LYS 37 1HG LYS 37 1.451 11.480 6.788
246 2HG LYS 37 2HG LYS 37 0.139 10.283 6.997
247 1HD LYS 37 1HD LYS 37 0.219 10.608 9.489
248 2HD LYS 37 2HD LYS 37 1.647 11.677 9.313
249 1HE LYS 37 1HE LYS 37 -0.281 13.090 9.692
250 2HE LYS 37 2HE LYS 37 0.199 13.306 7.962
251 1HZ LYS 37 1HZ LYS 37 -1.986 11.579 9.008
252 2HZ LYS 37 2HZ LYS 37 -1.550 11.734 7.373
253 3HZ LYS 37 3HZ LYS 37 -2.161 13.073 8.224
254 H CYS 38 H CYS 38 -0.676 7.075 8.872
255 HA CYS 38 HA CYS 38 -1.492 6.601 6.125
256 1HB CYS 38 1HB CYS 38 -1.936 4.997 8.030
257 2HB CYS 38 2HB CYS 38 -2.892 6.300 8.828
258 H VAL 39 H VAL 39 -2.781 8.030 4.947
259 HA VAL 39 HA VAL 39 -4.294 10.083 6.435
260 HB VAL 39 HB VAL 39 -3.213 9.795 3.602
261 1HG1 VAL 39 1HG1 VAL 39 -4.242 12.051 3.195
262 2HG1 VAL 39 2HG1 VAL 39 -5.118 11.906 4.775
263 3HG1 VAL 39 3HG1 VAL 39 -5.476 10.752 3.411
264 1HG2 VAL 39 1HG2 VAL 39 -2.784 11.918 5.800
265 2HG2 VAL 39 2HG2 VAL 39 -2.074 11.965 4.146
266 3HG2 VAL 39 3HG2 VAL 39 -1.578 10.660 5.296
267 H CYS 40 H CYS 40 -6.599 9.600 6.303
268 HA CYS 40 HA CYS 40 -7.405 7.675 4.280
269 1HB CYS 40 1HB CYS 40 -6.532 6.648 6.451
270 2HB CYS 40 2HB CYS 40 -7.986 7.305 7.257
271 H ALA 41 H ALA 41 -8.426 9.283 3.310
272 HA ALA 41 HA ALA 41 -10.354 10.928 4.644
273 1HB ALA 41 1HB ALA 41 -10.843 11.897 2.490
274 2HB ALA 41 2HB ALA 41 -9.851 10.625 1.663
275 3HB ALA 41 3HB ALA 41 -9.074 11.823 2.766
276 H TYR 42 H TYR 42 -12.452 10.868 4.691
277 HA TYR 42 HA TYR 42 -13.515 8.284 4.854
278 1HB TYR 42 1HB TYR 42 -15.360 9.566 6.126
279 2HB TYR 42 2HB TYR 42 -13.669 9.818 6.682
280 HD1 TYR 42 HD1 TYR 42 -16.432 11.366 4.681
281 HD2 TYR 42 HD2 TYR 42 -12.577 12.011 6.525
282 HE1 TYR 42 HE1 TYR 42 -16.583 13.754 4.178
283 HE2 TYR 42 HE2 TYR 42 -12.720 14.393 5.959
284 HH TYR 42 HH TYR 42 -15.491 15.697 4.080
285 H SER 43 H SER 43 -13.295 9.576 2.242
286 HA SER 43 HA SER 43 -15.747 10.028 0.963
287 1HB SER 43 1HB SER 43 -13.190 8.858 -0.265
288 2HB SER 43 2HB SER 43 -14.527 9.724 -1.150
289 HG SER 43 HG SER 43 -12.961 11.147 -0.853
290 H ASN 44 H ASN 44 -15.997 8.547 -1.212
291 HA ASN 44 HA ASN 44 -16.535 5.783 -0.405
292 1HB ASN 44 1HB ASN 44 -18.369 7.389 0.158
293 2HB ASN 44 2HB ASN 44 -18.420 7.962 -1.497
294 1HD2 ASN 44 1HD2 ASN 44 -19.126 6.221 -3.203
295 2HD2 ASN 44 2HD2 ASN 44 -20.398 5.199 -2.662
296 HA PRO 45 HA PRO 45 -15.417 4.202 -1.006
297 1HB PRO 45 1HB PRO 45 -13.256 3.005 -2.230
298 2HB PRO 45 2HB PRO 45 -14.915 2.625 -2.723
299 1HG PRO 45 1HG PRO 45 -13.057 4.708 -4.006
300 2HG PRO 45 2HG PRO 45 -13.915 3.357 -4.842
301 1HD PRO 45 1HD PRO 45 -14.996 5.901 -4.746
302 2HD PRO 45 2HD PRO 45 -16.054 4.432 -4.574
303 HA PRO 46 HA PRO 46 -12.666 6.893 0.884
304 1HB PRO 46 1HB PRO 46 -11.011 5.423 2.542
305 2HB PRO 46 2HB PRO 46 -12.794 5.504 2.781
306 1HG PRO 46 1HG PRO 46 -11.251 3.341 1.247
307 2HG PRO 46 2HG PRO 46 -12.440 3.138 2.624
308 1HD PRO 46 1HD PRO 46 -13.199 2.910 -0.019
309 2HD PRO 46 2HD PRO 46 -14.293 3.808 1.223
310 H GLN 47 H GLN 47 -10.545 7.875 1.087
311 HA GLN 47 HA GLN 47 -8.724 6.941 -1.044
312 1HB GLN 47 1HB GLN 47 -9.275 9.831 -0.183
313 2HB GLN 47 2HB GLN 47 -8.118 9.291 -1.433
314 1HG GLN 47 1HG GLN 47 -11.181 8.787 -1.563
315 2HG GLN 47 2HG GLN 47 -10.374 10.213 -2.291
316 1HE2 GLN 47 1HE2 GLN 47 -8.551 9.688 -3.874
317 2HE2 GLN 47 2HE2 GLN 47 -8.765 8.333 -4.933
318 H CYS 48 H CYS 48 -7.227 5.889 0.072
319 HA CYS 48 HA CYS 48 -6.277 6.939 2.608
320 1HB CYS 48 1HB CYS 48 -8.520 5.821 2.886
321 2HB CYS 48 2HB CYS 48 -7.880 4.374 2.133
322 H GLN 49 H GLN 49 -4.320 6.469 2.972
323 HA GLN 49 HA GLN 49 -2.837 4.570 1.338
324 1HB GLN 49 1HB GLN 49 -2.970 7.619 1.283
325 2HB GLN 49 2HB GLN 49 -1.416 6.847 0.788
326 1HG GLN 49 1HG GLN 49 -2.284 5.923 -1.211
327 2HG GLN 49 2HG GLN 49 -3.985 6.061 -0.674
328 1HE2 GLN 49 1HE2 GLN 49 -4.735 8.343 -0.164
329 2HE2 GLN 49 2HE2 GLN 49 -4.201 9.640 -1.191
330 H CYS 50 H CYS 50 -0.943 4.072 2.195
331 HA CYS 50 HA CYS 50 0.163 5.459 4.516
332 1HB CYS 50 1HB CYS 50 1.273 3.326 2.591
333 2HB CYS 50 2HB CYS 50 2.266 4.055 3.860
334 H TYR 51 H TYR 51 0.435 7.512 3.996
335 HA TYR 51 HA TYR 51 1.867 8.701 1.894
336 1HB TYR 51 1HB TYR 51 0.743 9.575 4.560
337 2HB TYR 51 2HB TYR 51 2.142 10.509 4.005
338 HD1 TYR 51 HD1 TYR 51 1.790 12.284 2.418
339 HD2 TYR 51 HD2 TYR 51 -1.139 9.103 2.643
340 HE1 TYR 51 HE1 TYR 51 0.466 13.388 0.782
341 HE2 TYR 51 HE2 TYR 51 -2.498 10.272 1.015
342 HH TYR 51 HH TYR 51 -1.351 13.337 -0.534
343 H ASP 52 H ASP 52 3.376 6.627 2.240
344 HA ASP 52 HA ASP 52 5.939 7.626 3.313
345 1HB ASP 52 1HB ASP 52 4.463 6.602 5.186
346 2HB ASP 52 2HB ASP 52 4.403 5.095 4.218
347 HD2 ASP 52 HD2 ASP 52 6.903 4.363 6.529
348 H THR 53 H THR 53 7.751 6.467 2.647
349 HA THR 53 HA THR 53 7.363 4.275 0.733
350 HB THR 53 HB THR 53 9.680 6.284 0.723
351 HG1 THR 53 HG1 THR 53 8.728 7.036 -1.155
352 1HG2 THR 53 1HG2 THR 53 10.076 3.978 -0.272
353 2HG2 THR 53 2HG2 THR 53 10.055 5.258 -1.534
354 3HG2 THR 53 3HG2 THR 53 8.625 4.179 -1.311
355 H HIS 54 H HIS 54 7.987 2.384 1.956
356 HA HIS 54 HA HIS 54 10.631 2.516 2.968
357 1HB HIS 54 1HB HIS 54 9.021 3.295 4.931
358 2HB HIS 54 2HB HIS 54 8.810 1.534 5.190
359 HD1 HIS 54 HD1 HIS 54 10.804 4.410 5.881
360 HD2 HIS 54 HD2 HIS 54 11.794 0.373 5.385
361 HE1 HIS 54 HE1 HIS 54 13.100 4.116 6.821
362 HE2 HIS 54 HE2 HIS 54 13.691 1.641 6.514
363 H LYS 55 H LYS 55 7.856 0.242 3.383
364 HA LYS 55 HA LYS 55 9.642 -1.955 3.234
365 1HB LYS 55 1HB LYS 55 6.665 -1.510 3.582
366 2HB LYS 55 2HB LYS 55 7.163 -3.130 3.065
367 1HG LYS 55 1HG LYS 55 6.857 -3.172 5.401
368 2HG LYS 55 2HG LYS 55 8.589 -3.446 5.038
369 1HD LYS 55 1HD LYS 55 9.114 -1.093 5.675
370 2HD LYS 55 2HD LYS 55 7.378 -0.768 6.017
371 1HE LYS 55 1HE LYS 55 9.115 -2.882 7.474
372 2HE LYS 55 2HE LYS 55 8.777 -1.214 8.087
373 1HZ LYS 55 1HZ LYS 55 6.755 -3.324 7.526
374 2HZ LYS 55 2HZ LYS 55 6.422 -1.744 8.053
375 3HZ LYS 55 3HZ LYS 55 7.290 -2.809 9.055
376 H PHE 56 H PHE 56 8.746 -3.909 1.804
377 HA PHE 56 HA PHE 56 9.161 -3.086 -0.923
378 1HB PHE 56 1HB PHE 56 9.344 -5.537 -1.363
379 2HB PHE 56 2HB PHE 56 10.460 -4.961 -0.114
380 HD1 PHE 56 HD1 PHE 56 7.539 -7.058 -0.845
381 HD2 PHE 56 HD2 PHE 56 10.045 -5.506 2.307
382 HE1 PHE 56 HE1 PHE 56 6.784 -8.850 0.649
383 HE2 PHE 56 HE2 PHE 56 9.275 -7.291 3.797
384 HZ PHE 56 HZ PHE 56 7.654 -8.988 2.974
385 H CYS 57 H CYS 57 7.709 -4.563 -2.633
386 HA CYS 57 HA CYS 57 4.997 -3.639 -2.097
387 1HB CYS 57 1HB CYS 57 6.109 -3.137 -4.256
388 2HB CYS 57 2HB CYS 57 6.181 -4.884 -4.623
389 H TYR 58 H TYR 58 3.740 -4.884 -0.964
390 HA TYR 58 HA TYR 58 4.120 -7.723 -0.708
391 1HB TYR 58 1HB TYR 58 2.022 -5.749 0.366
392 2HB TYR 58 2HB TYR 58 1.869 -7.498 0.657
393 HD1 TYR 58 HD1 TYR 58 3.698 -4.446 1.674
394 HD2 TYR 58 HD2 TYR 58 3.679 -8.772 1.870
395 HE1 TYR 58 HE1 TYR 58 5.255 -4.385 3.514
396 HE2 TYR 58 HE2 TYR 58 5.176 -8.685 3.752
397 HH TYR 58 HH TYR 58 6.545 -7.372 5.035
398 H LYS 59 H LYS 59 2.370 -9.252 -0.861
399 HA LYS 59 HA LYS 59 1.354 -9.667 -3.365
400 1HB LYS 59 1HB LYS 59 0.553 -10.800 -0.666
401 2HB LYS 59 2HB LYS 59 -0.065 -11.438 -2.226
402 1HG LYS 59 1HG LYS 59 2.169 -12.119 -2.959
403 2HG LYS 59 2HG LYS 59 2.966 -11.230 -1.641
404 1HD LYS 59 1HD LYS 59 1.763 -12.729 0.041
405 2HD LYS 59 2HD LYS 59 1.264 -13.762 -1.347
406 1HE LYS 59 1HE LYS 59 3.692 -14.090 -1.959
407 2HE LYS 59 2HE LYS 59 4.177 -12.973 -0.617
408 1HZ LYS 59 1HZ LYS 59 4.370 -15.246 0.038
409 2HZ LYS 59 2HZ LYS 59 2.737 -15.557 -0.318
410 3HZ LYS 59 3HZ LYS 59 3.150 -14.488 0.938
411 H ALA 60 H ALA 60 -0.769 -9.853 -4.224
412 HA ALA 60 HA ALA 60 -2.292 -7.550 -3.767
413 1HB ALA 60 1HB ALA 60 -2.037 -8.792 -5.963
414 2HB ALA 60 2HB ALA 60 -3.751 -8.398 -5.553
415 3HB ALA 60 3HB ALA 60 -3.115 -10.077 -5.297
416 H CYS 61 H CYS 61 -4.447 -7.311 -3.245
417 HA CYS 61 HA CYS 61 -5.015 -8.892 -0.818
418 1HB CYS 61 1HB CYS 61 -4.167 -6.383 -1.025
419 2HB CYS 61 2HB CYS 61 -5.878 -5.997 -1.295
420 H HIS 62 H HIS 62 -6.199 -10.047 -2.899
421 HA HIS 62 HA HIS 62 -8.942 -8.975 -3.128
422 1HB HIS 62 1HB HIS 62 -7.674 -11.306 -4.613
423 2HB HIS 62 2HB HIS 62 -9.295 -10.590 -4.872
424 HD1 HIS 62 HD1 HIS 62 -8.323 -10.342 -7.309
425 HD2 HIS 62 HD2 HIS 62 -6.599 -7.765 -4.479
426 HE1 HIS 62 HE1 HIS 62 -7.150 -8.524 -8.586
427 HE2 HIS 62 HE2 HIS 62 -6.097 -6.987 -6.855
428 H ASN 63 H ASN 63 -9.702 -9.480 -1.015
429 HA ASN 63 HA ASN 63 -9.365 -11.967 0.193
430 1HB ASN 63 1HB ASN 63 -11.045 -11.017 1.887
431 2HB ASN 63 2HB ASN 63 -9.466 -10.236 1.714
432 1HD2 ASN 63 1HD2 ASN 63 -9.433 -7.926 0.920
433 2HD2 ASN 63 2HD2 ASN 63 -10.889 -7.113 0.615
434 H SER 64 H SER 64 -12.580 -10.667 -0.138
435 HA SER 64 HA SER 64 -13.422 -13.173 -1.476
436 1HB SER 64 1HB SER 64 -14.125 -12.991 0.983
437 2HB SER 64 2HB SER 64 -15.213 -11.655 0.464
438 HG SER 64 HG SER 64 -16.074 -13.922 0.515
439 H GLU 65 H GLU 65 -15.840 -12.698 -2.292
440 HA GLU 65 HA GLU 65 -15.580 -10.963 -4.445
441 1HB GLU 65 1HB GLU 65 -17.749 -11.558 -5.155
442 2HB GLU 65 2HB GLU 65 -16.990 -12.995 -4.435
443 1HG GLU 65 1HG GLU 65 -18.374 -12.509 -2.258
444 2HG GLU 65 2HG GLU 65 -19.225 -11.240 -3.207
445 HE2 GLU 65 HE2 GLU 65 -20.533 -13.782 -5.424
446 H ILE 66 H ILE 66 -17.406 -10.482 -1.489
447 HA ILE 66 HA ILE 66 -18.081 -7.778 -2.201
448 HB ILE 66 HB ILE 66 -19.642 -9.259 -1.079
449 1HG1 ILE 66 1HG1 ILE 66 -19.039 -6.687 0.475
450 2HG1 ILE 66 2HG1 ILE 66 -19.723 -6.743 -1.191
451 1HG2 ILE 66 1HG2 ILE 66 -18.028 -10.317 0.579
452 2HG2 ILE 66 2HG2 ILE 66 -19.428 -9.535 1.397
453 3HG2 ILE 66 3HG2 ILE 66 -17.836 -8.723 1.398
454 1HD1 ILE 66 1HD1 ILE 66 -21.563 -6.499 0.450
455 2HD1 ILE 66 2HD1 ILE 66 -21.024 -7.969 1.338
456 3HD1 ILE 66 3HD1 ILE 66 -21.672 -8.110 -0.337
457 H GLU 67 H GLU 67 -17.275 -5.770 -1.111
458 HA GLU 67 HA GLU 67 -14.707 -6.209 0.270
459 1HB GLU 67 1HB GLU 67 -13.813 -4.232 -0.819
460 2HB GLU 67 2HB GLU 67 -14.435 -5.366 -2.057
461 1HG GLU 67 1HG GLU 67 -15.206 -3.366 -2.908
462 2HG GLU 67 2HG GLU 67 -16.660 -3.868 -1.991
463 HE2 GLU 67 HE2 GLU 67 -16.766 -2.852 0.236
Start of MODEL 3
1 1H GLY 1 HT1 GLY 1 -7.170 -5.205 12.446
2 2H GLY 1 HT2 GLY 1 -6.675 -4.540 13.933
3 3H GLY 1 HT3 GLY 1 -7.842 -5.771 13.901
4 1HA GLY 1 HA2 GLY 1 -6.232 -7.299 12.998
5 2HA GLY 1 HA1 GLY 1 -5.014 -5.981 13.155
6 H ASP 2 HN ASP 2 -3.954 -7.783 14.451
7 HA ASP 2 HA ASP 2 -4.303 -7.175 17.254
8 1HB ASP 2 HB2 ASP 2 -4.806 -10.035 16.180
9 2HB ASP 2 HB1 ASP 2 -4.306 -9.720 17.880
10 HD2 ASP 2 HD2 ASP 2 -5.563 -8.143 18.984
11 H ASP 3 HN ASP 3 -2.343 -6.229 16.442
12 HA ASP 3 HA ASP 3 -0.182 -6.055 16.165
13 1HB ASP 3 HB2 ASP 3 -0.552 -8.001 18.461
14 2HB ASP 3 HB1 ASP 3 1.124 -7.462 18.042
15 HD2 ASP 3 HD2 ASP 3 0.652 -6.818 20.238
16 H VAL 4 HN VAL 4 -1.098 -7.882 14.225
17 HA VAL 4 HA VAL 4 1.489 -9.185 13.604
18 HB VAL 4 HB VAL 4 -1.078 -9.299 11.981
19 1HG1 VAL 4 HG11 VAL 4 1.476 -11.049 11.980
20 2HG1 VAL 4 HG12 VAL 4 1.036 -9.874 10.681
21 3HG1 VAL 4 HG13 VAL 4 0.017 -11.313 10.970
22 1HG2 VAL 4 HG21 VAL 4 -1.465 -10.346 14.245
23 2HG2 VAL 4 HG22 VAL 4 0.063 -11.280 14.076
24 3HG2 VAL 4 HG23 VAL 4 -1.328 -11.605 12.985
25 H LYS 5 HN LYS 5 2.763 -8.345 11.886
26 HA LYS 5 HA LYS 5 2.093 -5.697 10.922
27 1HB LYS 5 HB2 LYS 5 4.415 -6.707 11.807
28 2HB LYS 5 HB1 LYS 5 4.605 -7.168 10.091
29 1HG LYS 5 HG2 LYS 5 4.092 -4.343 11.253
30 2HG LYS 5 HG1 LYS 5 5.690 -5.012 10.776
31 1HD LYS 5 HD2 LYS 5 4.797 -5.249 8.383
32 2HD LYS 5 HD1 LYS 5 3.320 -4.376 8.893
33 1HE LYS 5 HE2 LYS 5 4.837 -2.804 7.783
34 2HE LYS 5 HE1 LYS 5 4.763 -2.371 9.541
35 1HZ LYS 5 HZ1 LYS 5 6.837 -3.543 9.854
36 2HZ LYS 5 HZ2 LYS 5 6.995 -2.344 8.659
37 3HZ LYS 5 HZ3 LYS 5 6.887 -3.981 8.214
38 H SER 6 HN SER 6 0.445 -7.699 10.242
39 HA SER 6 HA SER 6 0.551 -8.629 7.607
40 1HB SER 6 HB2 SER 6 -2.037 -8.685 7.845
41 2HB SER 6 HB1 SER 6 -1.062 -9.644 9.010
42 HG SER 6 HG SER 6 -2.855 -8.217 9.821
43 H ALA 7 HN ALA 7 -0.482 -7.907 5.645
44 HA ALA 7 HA ALA 7 -1.297 -5.183 5.522
45 1HB ALA 7 HB1 ALA 7 1.516 -6.035 4.631
46 2HB ALA 7 HB2 ALA 7 1.105 -4.728 5.798
47 3HB ALA 7 HB3 ALA 7 0.747 -4.506 4.049
48 H CYS 8 HN CYS 8 -3.001 -5.493 4.224
49 HA CYS 8 HA CYS 8 -2.614 -6.708 1.607
50 1HB CYS 8 HB2 CYS 8 -4.895 -4.957 2.645
51 2HB CYS 8 HB1 CYS 8 -4.881 -5.869 1.098
52 H CYS 9 HN CYS 9 -0.961 -5.696 0.496
53 HA CYS 9 HA CYS 9 -1.433 -2.865 -0.180
54 1HB CYS 9 HB2 CYS 9 0.796 -3.280 0.669
55 2HB CYS 9 HB1 CYS 9 1.020 -4.656 -0.447
56 H ASP 10 HN ASP 10 -2.744 -2.672 -1.855
57 HA ASP 10 HA ASP 10 -3.373 -4.588 -3.737
58 1HB ASP 10 HB2 ASP 10 -3.678 -1.525 -3.745
59 2HB ASP 10 HB1 ASP 10 -4.561 -2.585 -4.837
60 HD2 ASP 10 HD2 ASP 10 -6.056 -1.170 -3.685
61 H THR 11 HN THR 11 -1.139 -1.772 -4.091
62 HA THR 11 HA THR 11 0.105 -2.870 -6.496
63 HB THR 11 HB THR 11 -1.258 -0.116 -6.491
64 HG1 THR 11 HG1 THR 11 -2.225 -2.578 -7.456
65 1HG2 THR 11 HG21 THR 11 0.631 -0.330 -8.147
66 2HG2 THR 11 HG22 THR 11 -0.954 -0.123 -8.934
67 3HG2 THR 11 HG23 THR 11 -0.204 -1.755 -8.884
68 H CYS 12 HN CYS 12 2.187 -1.830 -6.836
69 HA CYS 12 HA CYS 12 3.033 0.056 -4.767
70 1HB CYS 12 HB2 CYS 12 4.566 -1.667 -3.894
71 2HB CYS 12 HB1 CYS 12 2.849 -2.273 -3.878
72 H LEU 13 HN LEU 13 5.244 0.575 -4.817
73 HA LEU 13 HA LEU 13 6.469 0.531 -7.490
74 1HB LEU 13 HB2 LEU 13 4.807 2.262 -7.604
75 2HB LEU 13 HB1 LEU 13 5.206 2.830 -5.935
76 HG LEU 13 HG LEU 13 7.416 3.696 -6.801
77 1HD1 LEU 13 HD11 LEU 13 6.262 2.775 -9.515
78 2HD1 LEU 13 HD12 LEU 13 7.743 2.133 -8.705
79 3HD1 LEU 13 HD13 LEU 13 7.711 3.828 -9.296
80 1HD2 LEU 13 HD21 LEU 13 5.420 5.210 -6.713
81 2HD2 LEU 13 HD22 LEU 13 4.969 4.717 -8.391
82 3HD2 LEU 13 HD23 LEU 13 6.502 5.607 -8.095
83 H CYS 14 HN CYS 14 8.381 -0.137 -7.010
84 HA CYS 14 HA CYS 14 9.881 1.110 -4.857
85 1HB CYS 14 HB2 CYS 14 10.620 -1.276 -6.583
86 2HB CYS 14 HB1 CYS 14 11.591 -0.589 -5.267
87 H THR 15 HN THR 15 11.418 2.527 -5.179
88 HA THR 15 HA THR 15 11.588 3.758 -7.751
89 HB THR 15 HB THR 15 13.254 5.270 -6.779
90 HG1 THR 15 HG1 THR 15 13.636 5.099 -4.586
91 1HG2 THR 15 HG21 THR 15 10.755 5.605 -6.529
92 2HG2 THR 15 HG22 THR 15 11.691 6.296 -5.156
93 3HG2 THR 15 HG23 THR 15 10.801 4.751 -4.947
94 H ARG 16 HN ARG 16 13.407 4.246 -9.044
95 HA ARG 16 HA ARG 16 15.714 2.512 -8.749
96 1HB ARG 16 HB2 ARG 16 16.682 3.227 -10.675
97 2HB ARG 16 HB1 ARG 16 14.939 3.080 -11.091
98 1HG ARG 16 HG2 ARG 16 14.667 5.498 -11.122
99 2HG ARG 16 HG1 ARG 16 16.308 5.762 -10.414
100 1HD ARG 16 HD2 ARG 16 17.353 4.690 -12.423
101 2HD ARG 16 HD1 ARG 16 15.711 4.619 -13.218
102 HE ARG 16 HE ARG 16 15.939 7.267 -12.378
103 1HH1 ARG 16 HH11 ARG 16 17.981 5.171 -14.482
104 2HH1 ARG 16 HH12 ARG 16 18.640 6.511 -15.346
105 1HH2 ARG 16 HH21 ARG 16 16.840 9.007 -13.608
106 2HH2 ARG 16 HH22 ARG 16 17.960 8.681 -14.893
107 H SER 17 HN SER 17 17.377 3.078 -7.445
108 HA SER 17 HA SER 17 18.405 5.592 -7.027
109 1HB SER 17 HB2 SER 17 16.200 5.964 -5.676
110 2HB SER 17 HB1 SER 17 16.796 4.707 -4.551
111 HG SER 17 HG SER 17 17.279 6.978 -4.029
112 H GLN 18 HN GLN 18 19.490 5.153 -4.475
113 HA GLN 18 HA GLN 18 20.378 2.376 -4.384
114 1HB GLN 18 HB2 GLN 18 21.673 3.751 -6.124
115 2HB GLN 18 HB1 GLN 18 22.486 4.538 -4.758
116 1HG GLN 18 HG2 GLN 18 22.406 1.484 -5.422
117 2HG GLN 18 HG1 GLN 18 23.786 2.593 -5.722
118 1HE2 GLN 18 HE21 GLN 18 22.375 0.429 -3.444
119 2HE2 GLN 18 HE22 GLN 18 23.539 0.741 -2.177
120 HA PRO 19 HA PRO 19 19.915 1.145 -2.779
121 1HB PRO 19 HB2 PRO 19 18.401 0.656 -0.510
122 2HB PRO 19 HB1 PRO 19 20.227 0.561 -0.501
123 1HG PRO 19 HG2 PRO 19 18.488 2.985 0.278
124 2HG PRO 19 HG1 PRO 19 19.755 2.160 1.274
125 1HD PRO 19 HD2 PRO 19 20.353 4.377 -0.251
126 2HD PRO 19 HD1 PRO 19 21.536 2.992 -0.150
127 HA PRO 20 HA PRO 20 15.914 2.558 -4.254
128 1HB PRO 20 HB2 PRO 20 14.476 0.223 -4.548
129 2HB PRO 20 HB1 PRO 20 15.955 0.544 -5.535
130 1HG PRO 20 HG2 PRO 20 15.794 -1.057 -2.918
131 2HG PRO 20 HG1 PRO 20 16.469 -1.606 -4.505
132 1HD PRO 20 HD2 PRO 20 18.088 -0.535 -2.547
133 2HD PRO 20 HD1 PRO 20 18.374 -0.130 -4.310
134 H THR 21 HN THR 21 13.522 2.412 -3.709
135 HA THR 21 HA THR 21 12.991 2.146 -0.821
136 HB THR 21 HB THR 21 13.347 4.698 -2.457
137 HG1 THR 21 HG1 THR 21 14.966 3.514 -0.963
138 1HG2 THR 21 HG21 THR 21 11.227 4.996 -1.222
139 2HG2 THR 21 HG22 THR 21 12.505 5.972 -0.448
140 3HG2 THR 21 HG23 THR 21 12.025 4.428 0.316
141 H CYS 22 HN CYS 22 10.748 2.039 -0.369
142 HA CYS 22 HA CYS 22 9.072 1.977 -2.822
143 1HB CYS 22 HB2 CYS 22 10.593 -0.100 -2.410
144 2HB CYS 22 HB1 CYS 22 9.511 -0.474 -1.056
145 H ARG 23 HN ARG 23 6.915 1.433 -2.628
146 HA ARG 23 HA ARG 23 5.527 1.356 -0.136
147 1HB ARG 23 HB2 ARG 23 4.556 3.601 -0.039
148 2HB ARG 23 HB1 ARG 23 6.320 3.756 -0.050
149 1HG ARG 23 HG2 ARG 23 6.325 4.369 -2.454
150 2HG ARG 23 HG1 ARG 23 4.567 4.054 -2.564
151 1HD ARG 23 HD2 ARG 23 4.900 5.947 -0.365
152 2HD ARG 23 HD1 ARG 23 5.948 6.511 -1.715
153 HE ARG 23 HE ARG 23 4.078 7.051 -2.935
154 1HH1 ARG 23 HH11 ARG 23 2.993 4.842 -0.323
155 2HH1 ARG 23 HH12 ARG 23 1.344 4.868 -0.831
156 1HH2 ARG 23 HH21 ARG 23 1.931 7.013 -3.598
157 2HH2 ARG 23 HH22 ARG 23 0.711 6.166 -2.696
158 H CYS 24 HN CYS 24 3.138 2.112 -0.510
159 HA CYS 24 HA CYS 24 2.245 0.412 -2.736
160 1HB CYS 24 HB2 CYS 24 1.933 -0.151 -0.191
161 2HB CYS 24 HB1 CYS 24 0.683 1.100 -0.183
162 H VAL 25 HN VAL 25 1.528 1.641 -4.487
163 HA VAL 25 HA VAL 25 0.831 4.330 -4.196
164 HB VAL 25 HB VAL 25 0.510 4.391 -6.591
165 1HG1 VAL 25 HG11 VAL 25 2.720 4.728 -5.458
166 2HG1 VAL 25 HG12 VAL 25 2.922 3.945 -7.067
167 3HG1 VAL 25 HG13 VAL 25 3.049 2.954 -5.566
168 1HG2 VAL 25 HG21 VAL 25 1.156 2.405 -7.972
169 2HG2 VAL 25 HG22 VAL 25 -0.361 2.096 -7.088
170 3HG2 VAL 25 HG23 VAL 25 1.202 1.369 -6.519
171 H ASP 26 HN ASP 26 -1.070 1.459 -4.625
172 HA ASP 26 HA ASP 26 -3.458 3.064 -5.191
173 1HB ASP 26 HB2 ASP 26 -3.167 1.144 -6.611
174 2HB ASP 26 HB1 ASP 26 -3.050 0.044 -5.184
175 HD2 ASP 26 HD2 ASP 26 -6.549 1.284 -6.546
176 H VAL 27 HN VAL 27 -4.622 3.866 -3.679
177 HA VAL 27 HA VAL 27 -4.473 3.158 -0.979
178 HB VAL 27 HB VAL 27 -6.291 4.709 -0.634
179 1HG1 VAL 27 HG11 VAL 27 -4.253 5.759 -2.685
180 2HG1 VAL 27 HG12 VAL 27 -3.903 5.402 -0.956
181 3HG1 VAL 27 HG13 VAL 27 -5.094 6.690 -1.396
182 1HG2 VAL 27 HG21 VAL 27 -7.752 4.254 -2.552
183 2HG2 VAL 27 HG22 VAL 27 -6.484 4.774 -3.732
184 3HG2 VAL 27 HG23 VAL 27 -7.207 5.963 -2.609
185 H ARG 28 HN ARG 28 -5.979 2.567 0.472
186 HA ARG 28 HA ARG 28 -7.840 0.496 -0.485
187 1HB ARG 28 HB2 ARG 28 -6.944 0.817 2.427
188 2HB ARG 28 HB1 ARG 28 -7.654 -0.616 1.630
189 1HG ARG 28 HG2 ARG 28 -5.375 -1.185 1.916
190 2HG ARG 28 HG1 ARG 28 -5.332 -0.519 0.242
191 1HD ARG 28 HD2 ARG 28 -5.064 1.716 2.073
192 2HD ARG 28 HD1 ARG 28 -4.051 0.431 2.789
193 HE ARG 28 HE ARG 28 -3.660 0.871 -0.139
194 1HH1 ARG 28 HH11 ARG 28 -2.668 1.712 3.146
195 2HH1 ARG 28 HH12 ARG 28 -1.259 2.624 2.677
196 1HH2 ARG 28 HH21 ARG 28 -1.795 2.056 -0.815
197 2HH2 ARG 28 HH22 ARG 28 -0.730 2.774 0.340
198 H GLU 29 HN GLU 29 -9.828 0.239 0.629
199 HA GLU 29 HA GLU 29 -10.993 2.195 2.299
200 1HB GLU 29 HB2 GLU 29 -11.403 -0.755 1.736
201 2HB GLU 29 HB1 GLU 29 -12.411 0.189 2.929
202 1HG GLU 29 HG2 GLU 29 -12.786 1.810 0.858
203 2HG GLU 29 HG1 GLU 29 -12.194 0.436 -0.142
204 HE2 GLU 29 HE2 GLU 29 -15.886 0.507 0.955
205 H SER 30 HN SER 30 -9.918 -1.032 3.389
206 HA SER 30 HA SER 30 -9.301 -0.037 5.997
207 1HB SER 30 HB2 SER 30 -8.700 -2.857 4.929
208 2HB SER 30 HB1 SER 30 -8.645 -2.314 6.645
209 HG SER 30 HG SER 30 -10.587 -3.433 5.980
210 H CYS 31 HN CYS 31 -7.539 1.030 6.560
211 HA CYS 31 HA CYS 31 -5.040 0.314 5.239
212 1HB CYS 31 HB2 CYS 31 -5.719 2.709 5.842
213 2HB CYS 31 HB1 CYS 31 -5.187 2.325 7.513
214 H HIS 32 HN HIS 32 -5.444 -1.954 6.144
215 HA HIS 32 HA HIS 32 -3.302 -2.035 8.134
216 1HB HIS 32 HB2 HIS 32 -5.437 -2.959 9.075
217 2HB HIS 32 HB1 HIS 32 -5.203 -4.347 7.926
218 HD1 HIS 32 HD1 HIS 32 -2.733 -5.423 8.183
219 HD2 HIS 32 HD2 HIS 32 -3.811 -2.946 11.387
220 HE1 HIS 32 HE1 HIS 32 -1.010 -5.721 9.954
221 HE2 HIS 32 HE2 HIS 32 -1.686 -4.216 11.894
222 H SER 33 HN SER 33 -1.974 -1.702 6.670
223 HA SER 33 HA SER 33 -1.633 -3.398 4.258
224 1HB SER 33 HB2 SER 33 -3.520 -1.714 3.848
225 2HB SER 33 HB1 SER 33 -2.388 -0.399 4.306
226 HG SER 33 HG SER 33 -2.464 -2.039 1.999
227 H ALA 34 HN ALA 34 -0.229 -1.141 6.584
228 HA ALA 34 HA ALA 34 1.511 -0.047 4.513
229 1HB ALA 34 HB1 ALA 34 -0.602 1.065 6.471
230 2HB ALA 34 HB2 ALA 34 -0.724 1.068 4.683
231 3HB ALA 34 HB3 ALA 34 0.446 2.165 5.508
232 H CYS 35 HN CYS 35 2.908 1.634 5.341
233 HA CYS 35 HA CYS 35 4.370 1.131 7.683
234 1HB CYS 35 HB2 CYS 35 5.314 3.404 7.083
235 2HB CYS 35 HB1 CYS 35 5.249 2.280 5.696
236 H ASP 36 HN ASP 36 4.703 3.065 9.219
237 HA ASP 36 HA ASP 36 2.662 3.567 10.945
238 1HB ASP 36 HB2 ASP 36 4.109 5.498 11.737
239 2HB ASP 36 HB1 ASP 36 5.007 3.969 11.487
240 HD2 ASP 36 HD2 ASP 36 6.058 6.437 11.679
241 H LYS 37 HN LYS 37 3.667 5.852 8.417
242 HA LYS 37 HA LYS 37 1.492 7.629 9.058
243 1HB LYS 37 HB2 LYS 37 3.908 8.280 8.518
244 2HB LYS 37 HB1 LYS 37 3.543 7.889 6.818
245 1HG LYS 37 HG2 LYS 37 1.743 9.611 6.791
246 2HG LYS 37 HG1 LYS 37 2.062 9.988 8.512
247 1HD LYS 37 HD2 LYS 37 4.388 10.717 7.966
248 2HD LYS 37 HD1 LYS 37 4.191 10.171 6.267
249 1HE LYS 37 HE2 LYS 37 2.320 11.862 5.967
250 2HE LYS 37 HE1 LYS 37 2.681 12.496 7.629
251 1HZ LYS 37 HZ1 LYS 37 4.563 12.379 5.336
252 2HZ LYS 37 HZ2 LYS 37 4.921 12.957 6.891
253 3HZ LYS 37 HZ3 LYS 37 3.770 13.756 5.933
254 H CYS 38 HN CYS 38 -0.087 5.803 8.468
255 HA CYS 38 HA CYS 38 -0.892 5.987 5.702
256 1HB CYS 38 HB2 CYS 38 -1.080 3.915 7.122
257 2HB CYS 38 HB1 CYS 38 -2.389 4.744 8.048
258 H VAL 39 HN VAL 39 -1.706 7.916 5.012
259 HA VAL 39 HA VAL 39 -3.468 9.432 6.777
260 HB VAL 39 HB VAL 39 -3.123 11.225 5.244
261 1HG1 VAL 39 HG11 VAL 39 -1.351 10.650 6.969
262 2HG1 VAL 39 HG12 VAL 39 -0.688 11.483 5.513
263 3HG1 VAL 39 HG13 VAL 39 -0.454 9.717 5.714
264 1HG2 VAL 39 HG21 VAL 39 -1.751 11.031 3.240
265 2HG2 VAL 39 HG22 VAL 39 -3.204 10.004 3.095
266 3HG2 VAL 39 HG23 VAL 39 -1.602 9.237 3.471
267 H CYS 40 HN CYS 40 -5.791 9.751 6.104
268 HA CYS 40 HA CYS 40 -6.527 8.261 3.697
269 1HB CYS 40 HB2 CYS 40 -6.365 6.778 5.690
270 2HB CYS 40 HB1 CYS 40 -7.684 7.722 6.457
271 H ALA 41 HN ALA 41 -7.529 9.574 2.528
272 HA ALA 41 HA ALA 41 -9.335 11.590 3.510
273 1HB ALA 41 HB1 ALA 41 -8.045 11.830 1.359
274 2HB ALA 41 HB2 ALA 41 -9.805 12.168 1.273
275 3HB ALA 41 HB3 ALA 41 -9.162 10.609 0.639
276 H TYR 42 HN TYR 42 -11.435 11.562 3.772
277 HA TYR 42 HA TYR 42 -12.617 9.023 4.226
278 1HB TYR 42 HB2 TYR 42 -14.265 10.358 5.566
279 2HB TYR 42 HB1 TYR 42 -12.533 10.661 5.976
280 HD1 TYR 42 HD1 TYR 42 -15.593 12.131 4.465
281 HD2 TYR 42 HD2 TYR 42 -11.423 12.822 5.333
282 HE1 TYR 42 HE1 TYR 42 -15.880 14.521 4.005
283 HE2 TYR 42 HE2 TYR 42 -11.718 15.190 4.830
284 HH TYR 42 HH TYR 42 -13.304 16.839 4.674
285 H SER 43 HN SER 43 -12.355 9.766 1.595
286 HA SER 43 HA SER 43 -14.710 10.452 0.227
287 1HB SER 43 HB2 SER 43 -12.460 8.675 -0.819
288 2HB SER 43 HB1 SER 43 -13.613 9.708 -1.790
289 HG SER 43 HG SER 43 -11.795 10.898 -1.631
290 H ASN 44 HN ASN 44 -15.330 8.637 -1.622
291 HA ASN 44 HA ASN 44 -16.034 6.156 -0.262
292 1HB ASN 44 HB2 ASN 44 -17.788 7.877 0.080
293 2HB ASN 44 HB1 ASN 44 -17.855 8.175 -1.683
294 1HD2 ASN 44 HD21 ASN 44 -17.889 5.106 0.316
295 2HD2 ASN 44 HD22 ASN 44 -19.312 4.500 -0.444
296 HA PRO 45 HA PRO 45 -15.162 4.310 -0.604
297 1HB PRO 45 HB2 PRO 45 -12.887 3.483 -2.494
298 2HB PRO 45 HB1 PRO 45 -13.716 2.467 -1.289
299 1HG PRO 45 HG2 PRO 45 -14.471 2.252 -3.890
300 2HG PRO 45 HG1 PRO 45 -15.757 2.422 -2.650
301 1HD PRO 45 HD2 PRO 45 -14.599 4.640 -4.421
302 2HD PRO 45 HD1 PRO 45 -16.330 4.260 -4.056
303 HA PRO 46 HA PRO 46 -12.110 7.132 0.919
304 1HB PRO 46 HB2 PRO 46 -11.102 4.724 2.562
305 2HB PRO 46 HB1 PRO 46 -11.290 6.444 3.113
306 1HG PRO 46 HG2 PRO 46 -13.267 4.710 3.705
307 2HG PRO 46 HG1 PRO 46 -13.702 6.310 2.949
308 1HD PRO 46 HD2 PRO 46 -13.462 3.572 1.574
309 2HD PRO 46 HD1 PRO 46 -14.759 4.903 1.405
310 H GLN 47 HN GLN 47 -9.719 7.548 1.411
311 HA GLN 47 HA GLN 47 -8.104 6.041 -0.546
312 1HB GLN 47 HB2 GLN 47 -7.974 9.052 -0.049
313 2HB GLN 47 HB1 GLN 47 -7.139 8.140 -1.356
314 1HG GLN 47 HG2 GLN 47 -10.230 8.370 -1.197
315 2HG GLN 47 HG1 GLN 47 -9.198 9.641 -1.915
316 1HE2 GLN 47 HE21 GLN 47 -10.035 6.166 -2.185
317 2HE2 GLN 47 HE22 GLN 47 -9.637 6.068 -3.891
318 H CYS 48 HN CYS 48 -7.563 4.859 1.386
319 HA CYS 48 HA CYS 48 -5.806 6.217 3.291
320 1HB CYS 48 HB2 CYS 48 -6.629 3.289 3.036
321 2HB CYS 48 HB1 CYS 48 -5.458 3.944 4.235
322 H GLN 49 HN GLN 49 -3.717 6.574 2.998
323 HA GLN 49 HA GLN 49 -2.252 4.739 1.283
324 1HB GLN 49 HB2 GLN 49 -3.171 6.954 0.220
325 2HB GLN 49 HB1 GLN 49 -1.905 7.772 1.156
326 1HG GLN 49 HG2 GLN 49 -0.135 6.374 0.015
327 2HG GLN 49 HG1 GLN 49 -1.431 5.441 -0.836
328 1HE2 GLN 49 HE21 GLN 49 -1.717 6.107 -2.920
329 2HE2 GLN 49 HE22 GLN 49 -1.430 7.725 -3.501
330 H CYS 50 HN CYS 50 -0.295 4.234 1.809
331 HA CYS 50 HA CYS 50 1.008 5.222 4.222
332 1HB CYS 50 HB2 CYS 50 1.077 2.779 3.575
333 2HB CYS 50 HB1 CYS 50 1.717 3.213 1.988
334 H TYR 51 HN TYR 51 1.320 7.329 3.842
335 HA TYR 51 HA TYR 51 2.440 8.650 1.683
336 1HB TYR 51 HB2 TYR 51 1.165 9.438 3.805
337 2HB TYR 51 HB1 TYR 51 2.708 9.404 4.658
338 HD1 TYR 51 HD1 TYR 51 0.446 11.528 3.225
339 HD2 TYR 51 HD2 TYR 51 4.704 10.796 3.153
340 HE1 TYR 51 HE1 TYR 51 0.835 13.829 2.769
341 HE2 TYR 51 HE2 TYR 51 5.098 13.112 2.697
342 HH TYR 51 HH TYR 51 4.154 15.210 2.356
343 H ASP 52 HN ASP 52 3.981 7.188 4.428
344 HA ASP 52 HA ASP 52 6.623 8.239 3.728
345 1HB ASP 52 HB2 ASP 52 5.863 8.273 6.109
346 2HB ASP 52 HB1 ASP 52 5.741 6.467 6.094
347 HD2 ASP 52 HD2 ASP 52 8.903 6.543 7.344
348 H THR 53 HN THR 53 8.123 7.207 2.508
349 HA THR 53 HA THR 53 7.678 4.549 1.605
350 HB THR 53 HB THR 53 9.956 4.733 0.619
351 HG1 THR 53 HG1 THR 53 10.429 7.141 0.505
352 1HG2 THR 53 HG21 THR 53 7.932 6.990 -0.010
353 2HG2 THR 53 HG22 THR 53 7.872 5.292 -0.624
354 3HG2 THR 53 HG23 THR 53 9.217 6.371 -1.111
355 H HIS 54 HN HIS 54 8.723 2.653 2.082
356 HA HIS 54 HA HIS 54 10.385 2.527 4.416
357 1HB HIS 54 HB2 HIS 54 8.246 2.930 5.593
358 2HB HIS 54 HB1 HIS 54 7.457 1.587 4.711
359 HD1 HIS 54 HD1 HIS 54 8.085 -0.817 5.352
360 HD2 HIS 54 HD2 HIS 54 9.733 2.053 7.937
361 HE1 HIS 54 HE1 HIS 54 8.743 -2.002 7.413
362 HE2 HIS 54 HE2 HIS 54 9.776 -0.259 8.968
363 H LYS 55 HN LYS 55 8.002 0.554 2.729
364 HA LYS 55 HA LYS 55 9.413 -1.778 3.443
365 1HB LYS 55 HB2 LYS 55 7.185 -2.762 3.181
366 2HB LYS 55 HB1 LYS 55 7.091 -1.222 4.005
367 1HG LYS 55 HG2 LYS 55 6.388 -0.103 1.740
368 2HG LYS 55 HG1 LYS 55 6.210 -1.766 1.144
369 1HD LYS 55 HD2 LYS 55 4.714 -2.193 3.257
370 2HD LYS 55 HD1 LYS 55 4.730 -0.416 3.472
371 1HE LYS 55 HE2 LYS 55 2.695 -1.056 2.222
372 2HE LYS 55 HE1 LYS 55 3.806 -0.186 1.085
373 1HZ LYS 55 HZ1 LYS 55 3.541 -3.139 1.367
374 2HZ LYS 55 HZ2 LYS 55 4.565 -2.333 0.287
375 3HZ LYS 55 HZ3 LYS 55 2.877 -2.196 0.119
376 H PHE 56 HN PHE 56 7.616 -2.982 1.088
377 HA PHE 56 HA PHE 56 9.351 -2.705 -1.174
378 1HB PHE 56 HB2 PHE 56 10.007 -5.097 -1.278
379 2HB PHE 56 HB1 PHE 56 10.641 -4.337 0.207
380 HD1 PHE 56 HD1 PHE 56 9.273 -4.652 2.429
381 HD2 PHE 56 HD2 PHE 56 8.722 -7.095 -1.080
382 HE1 PHE 56 HE1 PHE 56 8.249 -6.401 3.801
383 HE2 PHE 56 HE2 PHE 56 7.798 -8.876 0.317
384 HZ PHE 56 HZ PHE 56 7.538 -8.539 2.763
385 H CYS 57 HN CYS 57 8.370 -4.732 -2.782
386 HA CYS 57 HA CYS 57 5.518 -4.138 -2.858
387 1HB CYS 57 HB2 CYS 57 7.498 -5.410 -4.750
388 2HB CYS 57 HB1 CYS 57 5.764 -5.790 -4.936
389 H TYR 58 HN TYR 58 5.000 -5.047 -0.900
390 HA TYR 58 HA TYR 58 4.970 -7.918 -0.544
391 1HB TYR 58 HB2 TYR 58 5.141 -6.215 1.307
392 2HB TYR 58 HB1 TYR 58 3.444 -5.733 0.949
393 HD1 TYR 58 HD1 TYR 58 1.746 -6.830 2.144
394 HD2 TYR 58 HD2 TYR 58 5.524 -8.835 1.697
395 HE1 TYR 58 HE1 TYR 58 0.988 -8.599 3.628
396 HE2 TYR 58 HE2 TYR 58 4.765 -10.597 3.192
397 HH TYR 58 HH TYR 58 1.419 -10.607 4.543
398 H LYS 59 HN LYS 59 2.997 -8.961 -0.051
399 HA LYS 59 HA LYS 59 1.365 -9.434 -2.216
400 1HB LYS 59 HB2 LYS 59 0.840 -10.120 0.698
401 2HB LYS 59 HB1 LYS 59 0.122 -10.930 -0.746
402 1HG LYS 59 HG2 LYS 59 3.082 -11.143 0.192
403 2HG LYS 59 HG1 LYS 59 1.770 -12.295 0.410
404 1HD LYS 59 HD2 LYS 59 2.824 -13.251 -1.344
405 2HD LYS 59 HD1 LYS 59 1.561 -12.322 -2.221
406 1HE LYS 59 HE2 LYS 59 3.285 -10.583 -2.834
407 2HE LYS 59 HE1 LYS 59 4.500 -11.421 -1.785
408 1HZ LYS 59 HZ1 LYS 59 4.373 -13.324 -3.191
409 2HZ LYS 59 HZ2 LYS 59 4.727 -11.949 -4.122
410 3HZ LYS 59 HZ3 LYS 59 3.165 -12.614 -4.153
411 H ALA 60 HN ALA 60 -0.864 -9.329 -2.631
412 HA ALA 60 HA ALA 60 -2.205 -6.981 -1.493
413 1HB ALA 60 HB1 ALA 60 -1.744 -7.002 -3.975
414 2HB ALA 60 HB2 ALA 60 -3.517 -7.091 -3.660
415 3HB ALA 60 HB3 ALA 60 -2.581 -8.581 -4.098
416 H CYS 61 HN CYS 61 -4.472 -7.013 -1.101
417 HA CYS 61 HA CYS 61 -5.864 -9.402 -1.435
418 1HB CYS 61 HB2 CYS 61 -6.806 -8.458 1.141
419 2HB CYS 61 HB1 CYS 61 -6.290 -10.096 0.672
420 H HIS 62 HN HIS 62 -8.138 -9.019 -1.296
421 HA HIS 62 HA HIS 62 -8.593 -6.658 -2.807
422 1HB HIS 62 HB2 HIS 62 -10.419 -8.931 -1.915
423 2HB HIS 62 HB1 HIS 62 -11.050 -7.573 -2.876
424 HD1 HIS 62 HD1 HIS 62 -10.032 -7.131 -5.192
425 HD2 HIS 62 HD2 HIS 62 -8.581 -10.632 -3.409
426 HE1 HIS 62 HE1 HIS 62 -8.841 -8.413 -6.986
427 HE2 HIS 62 HE2 HIS 62 -7.906 -10.499 -5.870
428 H ASN 63 HN ASN 63 -10.360 -5.124 -2.629
429 HA ASN 63 HA ASN 63 -11.934 -4.786 -0.456
430 1HB ASN 63 HB2 ASN 63 -11.093 -2.709 0.569
431 2HB ASN 63 HB1 ASN 63 -9.978 -4.065 0.862
432 1HD2 ASN 63 HD21 ASN 63 -7.894 -4.084 -0.539
433 2HD2 ASN 63 HD22 ASN 63 -7.347 -2.599 -1.196
434 H SER 64 HN SER 64 -10.284 -3.216 -3.131
435 HA SER 64 HA SER 64 -12.666 -1.500 -3.619
436 1HB SER 64 HB2 SER 64 -9.702 -1.197 -4.395
437 2HB SER 64 HB1 SER 64 -11.016 -0.060 -4.897
438 HG SER 64 HG SER 64 -10.133 -0.586 -2.220
439 H GLU 65 HN GLU 65 -12.855 -4.138 -4.485
440 HA GLU 65 HA GLU 65 -11.957 -4.706 -7.029
441 1HB GLU 65 HB2 GLU 65 -13.481 -6.548 -7.065
442 2HB GLU 65 HB1 GLU 65 -12.814 -6.397 -5.428
443 1HG GLU 65 HG2 GLU 65 -15.630 -5.412 -6.301
444 2HG GLU 65 HG1 GLU 65 -15.278 -6.978 -5.502
445 HE2 GLU 65 HE2 GLU 65 -16.992 -5.272 -4.519
446 H ILE 66 HN ILE 66 -14.344 -2.573 -6.174
447 HA ILE 66 HA ILE 66 -14.954 -1.718 -8.826
448 HB ILE 66 HB ILE 66 -17.398 -1.597 -8.445
449 1HG1 ILE 66 HG12 ILE 66 -17.033 -3.625 -6.156
450 2HG1 ILE 66 HG11 ILE 66 -17.337 -1.879 -5.891
451 1HG2 ILE 66 HG21 ILE 66 -17.960 -3.930 -9.074
452 2HG2 ILE 66 HG22 ILE 66 -16.383 -4.514 -8.442
453 3HG2 ILE 66 HG23 ILE 66 -16.441 -3.420 -9.874
454 1HD1 ILE 66 HD11 ILE 66 -19.499 -2.059 -7.191
455 2HD1 ILE 66 HD12 ILE 66 -19.456 -3.071 -5.702
456 3HD1 ILE 66 HD13 ILE 66 -19.241 -3.845 -7.310
457 H GLU 67 HN GLU 67 -15.897 0.442 -8.665
458 HA GLU 67 HA GLU 67 -15.672 1.622 -5.947
459 1HB GLU 67 HB2 GLU 67 -14.504 3.493 -6.723
460 2HB GLU 67 HB1 GLU 67 -13.697 2.066 -7.433
461 1HG GLU 67 HG2 GLU 67 -15.083 2.580 -9.626
462 2HG GLU 67 HG1 GLU 67 -15.534 4.136 -8.838
463 HE2 GLU 67 HE2 GLU 67 -14.507 4.659 -10.815
Start of MODEL 4
1 1H GLY 1 1H GLY 1 -8.111 -15.265 9.515
2 2H GLY 1 2H GLY 1 -9.718 -14.786 9.774
3 3H GLY 1 3H GLY 1 -8.955 -15.831 10.875
4 1HA GLY 1 1HA GLY 1 -9.100 -13.642 11.750
5 2HA GLY 1 2HA GLY 1 -7.386 -14.133 11.442
6 H ASP 2 H ASP 2 -8.402 -11.400 11.753
7 HA ASP 2 HA ASP 2 -7.378 -10.264 9.266
8 1HB ASP 2 1HB ASP 2 -9.843 -10.776 8.798
9 2HB ASP 2 2HB ASP 2 -10.284 -9.826 10.252
10 HD2 ASP 2 HD2 ASP 2 -10.809 -7.293 8.087
11 H ASP 3 H ASP 3 -5.918 -9.985 11.271
12 HA ASP 3 HA ASP 3 -6.326 -7.308 12.323
13 1HB ASP 3 1HB ASP 3 -6.089 -8.032 14.687
14 2HB ASP 3 2HB ASP 3 -7.578 -8.695 13.916
15 HD2 ASP 3 HD2 ASP 3 -7.178 -9.848 15.863
16 H VAL 4 H VAL 4 -4.548 -7.720 10.526
17 HA VAL 4 HA VAL 4 -2.106 -8.768 11.775
18 HB VAL 4 HB VAL 4 -3.412 -10.183 10.202
19 1HG1 VAL 4 1HG1 VAL 4 -2.956 -9.886 7.765
20 2HG1 VAL 4 2HG1 VAL 4 -2.229 -8.274 8.072
21 3HG1 VAL 4 3HG1 VAL 4 -3.964 -8.566 8.427
22 1HG2 VAL 4 1HG2 VAL 4 -1.134 -10.720 10.969
23 2HG2 VAL 4 2HG2 VAL 4 -0.405 -9.714 9.665
24 3HG2 VAL 4 3HG2 VAL 4 -1.352 -11.170 9.245
25 H LYS 5 H LYS 5 -0.202 -7.892 11.501
26 HA LYS 5 HA LYS 5 0.181 -5.284 10.430
27 1HB LYS 5 1HB LYS 5 1.849 -7.407 11.810
28 2HB LYS 5 2HB LYS 5 2.741 -6.147 10.937
29 1HG LYS 5 1HG LYS 5 1.794 -4.359 12.198
30 2HG LYS 5 2HG LYS 5 0.600 -5.433 12.993
31 1HD LYS 5 1HD LYS 5 2.397 -6.650 14.184
32 2HD LYS 5 2HD LYS 5 3.665 -5.727 13.293
33 1HE LYS 5 1HE LYS 5 2.861 -3.595 14.342
34 2HE LYS 5 2HE LYS 5 1.619 -4.517 15.283
35 1HZ LYS 5 1HZ LYS 5 3.601 -4.072 16.555
36 2HZ LYS 5 2HZ LYS 5 4.568 -4.895 15.427
37 3HZ LYS 5 3HZ LYS 5 3.403 -5.745 16.321
38 H SER 6 H SER 6 -0.101 -8.067 8.794
39 HA SER 6 HA SER 6 1.878 -7.948 6.792
40 1HB SER 6 1HB SER 6 -1.033 -8.794 6.353
41 2HB SER 6 2HB SER 6 0.366 -9.151 5.274
42 HG SER 6 HG SER 6 -0.351 -10.787 6.860
43 H ALA 7 H ALA 7 2.348 -6.519 5.212
44 HA ALA 7 HA ALA 7 0.599 -4.371 4.572
45 1HB ALA 7 1HB ALA 7 3.125 -5.417 3.235
46 2HB ALA 7 2HB ALA 7 3.041 -4.109 4.452
47 3HB ALA 7 3HB ALA 7 2.314 -3.862 2.814
48 H CYS 8 H CYS 8 -1.064 -4.293 3.245
49 HA CYS 8 HA CYS 8 -1.375 -6.526 1.324
50 1HB CYS 8 1HB CYS 8 -3.627 -6.512 1.584
51 2HB CYS 8 2HB CYS 8 -3.019 -6.235 3.229
52 H CYS 9 H CYS 9 -0.797 -6.159 -0.712
53 HA CYS 9 HA CYS 9 -1.166 -3.451 -1.853
54 1HB CYS 9 1HB CYS 9 1.237 -5.339 -1.627
55 2HB CYS 9 2HB CYS 9 1.305 -3.901 -2.713
56 H ASP 10 H ASP 10 0.018 -3.745 -4.251
57 HA ASP 10 HA ASP 10 0.577 -5.871 -5.392
58 1HB ASP 10 1HB ASP 10 -0.909 -6.762 -7.038
59 2HB ASP 10 2HB ASP 10 -1.369 -7.159 -5.385
60 HD2 ASP 10 HD2 ASP 10 -3.003 -5.926 -4.551
61 H THR 11 H THR 11 -1.415 -3.038 -6.264
62 HA THR 11 HA THR 11 0.670 -2.167 -8.078
63 HB THR 11 HB THR 11 -1.472 -0.504 -6.704
64 HG1 THR 11 HG1 THR 11 -2.422 -0.637 -8.780
65 1HG2 THR 11 1HG2 THR 11 0.216 0.056 -9.255
66 2HG2 THR 11 2HG2 THR 11 0.462 0.881 -7.675
67 3HG2 THR 11 3HG2 THR 11 -1.061 1.124 -8.571
68 H CYS 12 H CYS 12 2.439 -1.017 -7.693
69 HA CYS 12 HA CYS 12 3.193 -0.026 -5.044
70 1HB CYS 12 1HB CYS 12 4.269 -2.376 -6.695
71 2HB CYS 12 2HB CYS 12 5.288 -1.585 -5.406
72 H LEU 13 H LEU 13 5.121 1.218 -5.120
73 HA LEU 13 HA LEU 13 6.173 1.961 -7.755
74 1HB LEU 13 1HB LEU 13 4.001 3.078 -7.456
75 2HB LEU 13 2HB LEU 13 4.505 3.789 -5.911
76 HG LEU 13 HG LEU 13 6.092 4.323 -8.503
77 1HD1 LEU 13 1HD1 LEU 13 4.528 6.174 -9.091
78 2HD1 LEU 13 2HD1 LEU 13 3.436 5.699 -7.738
79 3HD1 LEU 13 3HD1 LEU 13 3.693 4.575 -9.124
80 1HD2 LEU 13 1HD2 LEU 13 5.345 6.174 -6.135
81 2HD2 LEU 13 2HD2 LEU 13 6.421 6.588 -7.514
82 3HD2 LEU 13 3HD2 LEU 13 6.934 5.345 -6.320
83 H CYS 14 H CYS 14 8.156 3.021 -7.597
84 HA CYS 14 HA CYS 14 9.297 3.022 -4.916
85 1HB CYS 14 1HB CYS 14 9.228 0.728 -6.279
86 2HB CYS 14 2HB CYS 14 10.525 1.473 -7.244
87 H THR 15 H THR 15 11.262 3.730 -4.474
88 HA THR 15 HA THR 15 12.490 5.624 -6.339
89 HB THR 15 HB THR 15 14.259 5.915 -4.729
90 HG1 THR 15 HG1 THR 15 12.666 4.378 -2.942
91 1HG2 THR 15 1HG2 THR 15 12.133 7.262 -4.646
92 2HG2 THR 15 2HG2 THR 15 12.892 7.093 -3.024
93 3HG2 THR 15 3HG2 THR 15 11.430 6.124 -3.452
94 H ARG 16 H ARG 16 13.816 4.917 -7.945
95 HA ARG 16 HA ARG 16 15.377 2.498 -7.561
96 1HB ARG 16 1HB ARG 16 15.334 4.582 -9.794
97 2HB ARG 16 2HB ARG 16 16.535 3.242 -9.698
98 1HG ARG 16 1HG ARG 16 14.679 1.585 -9.614
99 2HG ARG 16 2HG ARG 16 13.512 2.902 -9.976
100 1HD ARG 16 1HD ARG 16 14.784 3.338 -12.160
101 2HD ARG 16 2HD ARG 16 15.931 2.007 -11.706
102 HE ARG 16 HE ARG 16 13.017 1.328 -11.768
103 1HH1 ARG 16 1HH1 ARG 16 16.168 1.208 -13.454
104 2HH1 ARG 16 2HH1 ARG 16 15.651 0.002 -14.589
105 1HH2 ARG 16 1HH2 ARG 16 12.351 -0.245 -13.321
106 2HH2 ARG 16 2HH2 ARG 16 13.465 -0.830 -14.512
107 H SER 17 H SER 17 17.328 2.510 -6.568
108 HA SER 17 HA SER 17 19.008 4.763 -6.225
109 1HB SER 17 1HB SER 17 16.904 5.531 -4.927
110 2HB SER 17 2HB SER 17 17.158 4.152 -3.826
111 HG SER 17 HG SER 17 18.046 6.167 -3.082
112 H GLN 18 H GLN 18 19.598 4.101 -3.487
113 HA GLN 18 HA GLN 18 20.760 1.405 -3.511
114 1HB GLN 18 1HB GLN 18 22.240 4.092 -3.555
115 2HB GLN 18 2HB GLN 18 23.019 2.564 -3.014
116 1HG GLN 18 1HG GLN 18 22.671 1.564 -5.319
117 2HG GLN 18 2HG GLN 18 21.957 3.118 -5.870
118 1HE2 GLN 18 1HE2 GLN 18 24.951 1.647 -4.510
119 2HE2 GLN 18 2HE2 GLN 18 26.013 2.911 -5.106
120 HA PRO 19 HA PRO 19 19.654 0.131 -2.246
121 1HB PRO 19 1HB PRO 19 17.764 -0.515 -0.310
122 2HB PRO 19 2HB PRO 19 19.555 -0.796 -0.057
123 1HG PRO 19 1HG PRO 19 17.907 1.628 0.876
124 2HG PRO 19 2HG PRO 19 18.983 0.563 1.868
125 1HD PRO 19 1HD PRO 19 19.893 2.932 0.774
126 2HD PRO 19 2HD PRO 19 20.972 1.471 0.831
127 HA PRO 20 HA PRO 20 15.910 2.240 -3.793
128 1HB PRO 20 1HB PRO 20 14.549 0.201 -5.003
129 2HB PRO 20 2HB PRO 20 16.128 0.757 -5.664
130 1HG PRO 20 1HG PRO 20 15.657 -1.587 -3.739
131 2HG PRO 20 2HG PRO 20 16.522 -1.612 -5.335
132 1HD PRO 20 1HD PRO 20 17.838 -1.307 -2.897
133 2HD PRO 20 2HD PRO 20 18.410 -0.441 -4.409
134 H THR 21 H THR 21 13.660 2.314 -3.294
135 HA THR 21 HA THR 21 12.842 0.925 -0.801
136 HB THR 21 HB THR 21 14.098 3.673 -1.036
137 HG1 THR 21 HG1 THR 21 15.047 1.585 -0.204
138 1HG2 THR 21 1HG2 THR 21 13.184 4.061 1.376
139 2HG2 THR 21 2HG2 THR 21 12.001 2.745 1.007
140 3HG2 THR 21 3HG2 THR 21 12.036 4.271 0.027
141 H CYS 22 H CYS 22 10.809 0.483 -1.138
142 HA CYS 22 HA CYS 22 9.373 2.102 -3.080
143 1HB CYS 22 1HB CYS 22 8.707 -0.760 -2.332
144 2HB CYS 22 2HB CYS 22 8.133 0.146 -3.743
145 H ARG 23 H ARG 23 6.893 1.470 -2.926
146 HA ARG 23 HA ARG 23 5.751 1.090 -0.443
147 1HB ARG 23 1HB ARG 23 4.987 3.108 0.324
148 2HB ARG 23 2HB ARG 23 6.546 3.628 -0.330
149 1HG ARG 23 1HG ARG 23 3.796 4.042 -1.572
150 2HG ARG 23 2HG ARG 23 4.880 5.241 -0.784
151 1HD ARG 23 1HD ARG 23 6.546 4.475 -2.798
152 2HD ARG 23 2HD ARG 23 4.981 4.007 -3.564
153 HE ARG 23 HE ARG 23 5.995 6.415 -3.863
154 1HH1 ARG 23 1HH1 ARG 23 3.195 5.939 -1.625
155 2HH1 ARG 23 2HH1 ARG 23 2.411 7.359 -2.209
156 1HH2 ARG 23 1HH2 ARG 23 4.986 8.178 -4.509
157 2HH2 ARG 23 2HH2 ARG 23 3.447 8.682 -3.869
158 H CYS 24 H CYS 24 3.398 1.650 -0.676
159 HA CYS 24 HA CYS 24 2.492 0.183 -3.102
160 1HB CYS 24 1HB CYS 24 2.965 -1.267 -1.186
161 2HB CYS 24 2HB CYS 24 2.180 -0.147 -0.051
162 H VAL 25 H VAL 25 0.432 0.733 -3.842
163 HA VAL 25 HA VAL 25 -0.706 3.283 -2.986
164 HB VAL 25 HB VAL 25 0.250 4.397 -5.007
165 1HG1 VAL 25 1HG1 VAL 25 2.551 4.737 -4.472
166 2HG1 VAL 25 2HG1 VAL 25 2.691 3.184 -3.615
167 3HG1 VAL 25 3HG1 VAL 25 1.681 4.514 -2.899
168 1HG2 VAL 25 1HG2 VAL 25 1.595 1.638 -5.423
169 2HG2 VAL 25 2HG2 VAL 25 2.173 3.155 -6.222
170 3HG2 VAL 25 3HG2 VAL 25 0.536 2.546 -6.577
171 H ASP 26 H ASP 26 -1.766 0.548 -4.016
172 HA ASP 26 HA ASP 26 -3.765 2.121 -5.486
173 1HB ASP 26 1HB ASP 26 -3.591 -0.130 -6.523
174 2HB ASP 26 2HB ASP 26 -3.869 -0.877 -4.907
175 HD2 ASP 26 HD2 ASP 26 -6.945 1.216 -6.501
176 H VAL 27 H VAL 27 -5.611 2.551 -4.438
177 HA VAL 27 HA VAL 27 -5.375 2.899 -1.593
178 HB VAL 27 HB VAL 27 -6.008 4.490 -3.498
179 1HG1 VAL 27 1HG1 VAL 27 -8.800 3.248 -3.048
180 2HG1 VAL 27 2HG1 VAL 27 -7.775 2.922 -4.495
181 3HG1 VAL 27 3HG1 VAL 27 -8.344 4.589 -4.157
182 1HG2 VAL 27 1HG2 VAL 27 -7.407 5.797 -1.988
183 2HG2 VAL 27 2HG2 VAL 27 -6.126 4.980 -1.020
184 3HG2 VAL 27 3HG2 VAL 27 -7.818 4.338 -1.011
185 H ARG 28 H ARG 28 -6.906 2.301 0.004
186 HA ARG 28 HA ARG 28 -8.978 0.400 -0.848
187 1HB ARG 28 1HB ARG 28 -7.246 0.260 1.695
188 2HB ARG 28 2HB ARG 28 -8.719 -0.734 1.383
189 1HG ARG 28 1HG ARG 28 -7.035 -2.236 0.995
190 2HG ARG 28 2HG ARG 28 -7.423 -1.681 -0.667
191 1HD ARG 28 1HD ARG 28 -5.385 -0.060 -0.476
192 2HD ARG 28 2HD ARG 28 -5.090 -0.732 1.143
193 HE ARG 28 HE ARG 28 -4.170 -2.647 0.172
194 1HH1 ARG 28 1HH1 ARG 28 -6.000 -0.918 -2.421
195 2HH1 ARG 28 2HH1 ARG 28 -5.420 -1.973 -3.659
196 1HH2 ARG 28 1HH2 ARG 28 -3.406 -3.966 -1.553
197 2HH2 ARG 28 2HH2 ARG 28 -3.963 -3.705 -3.175
198 H GLU 29 H GLU 29 -10.703 0.342 0.802
199 HA GLU 29 HA GLU 29 -11.321 2.678 2.268
200 1HB GLU 29 1HB GLU 29 -12.560 0.492 3.584
201 2HB GLU 29 2HB GLU 29 -13.251 1.705 2.482
202 1HG GLU 29 1HG GLU 29 -14.005 -0.372 1.718
203 2HG GLU 29 2HG GLU 29 -12.793 0.135 0.508
204 HE2 GLU 29 HE2 GLU 29 -13.912 -2.372 1.446
205 H SER 30 H SER 30 -10.053 -0.451 3.151
206 HA SER 30 HA SER 30 -9.370 -0.043 5.753
207 1HB SER 30 1HB SER 30 -7.962 -1.903 3.756
208 2HB SER 30 2HB SER 30 -7.706 -1.953 5.536
209 HG SER 30 HG SER 30 -9.679 -2.676 5.864
210 H CYS 31 H CYS 31 -7.828 0.579 7.006
211 HA CYS 31 HA CYS 31 -5.513 1.966 5.848
212 1HB CYS 31 1HB CYS 31 -6.928 3.081 7.566
213 2HB CYS 31 2HB CYS 31 -6.407 1.830 8.762
214 H HIS 32 H HIS 32 -3.817 1.246 8.404
215 HA HIS 32 HA HIS 32 -3.160 -1.438 8.177
216 1HB HIS 32 1HB HIS 32 -0.975 -1.015 6.614
217 2HB HIS 32 2HB HIS 32 -2.591 -1.478 5.954
218 HD1 HIS 32 HD1 HIS 32 -1.375 1.962 6.930
219 HD2 HIS 32 HD2 HIS 32 -2.807 -0.136 3.600
220 HE1 HIS 32 HE1 HIS 32 -1.739 3.648 5.123
221 HE2 HIS 32 HE2 HIS 32 -2.594 2.358 3.088
222 H SER 33 H SER 33 -2.297 -1.637 10.127
223 HA SER 33 HA SER 33 -0.320 0.000 11.318
224 1HB SER 33 1HB SER 33 -1.023 -2.991 11.633
225 2HB SER 33 2HB SER 33 0.319 -2.256 12.584
226 HG SER 33 HG SER 33 -1.477 -2.239 13.775
227 H ALA 34 H ALA 34 -0.080 -2.121 8.649
228 HA ALA 34 HA ALA 34 2.530 -3.080 8.934
229 1HB ALA 34 1HB ALA 34 0.807 -2.574 6.404
230 2HB ALA 34 2HB ALA 34 0.671 -4.025 7.452
231 3HB ALA 34 3HB ALA 34 2.189 -3.730 6.549
232 H CYS 35 H CYS 35 1.628 0.092 8.501
233 HA CYS 35 HA CYS 35 4.149 0.778 7.174
234 1HB CYS 35 1HB CYS 35 2.059 0.319 5.613
235 2HB CYS 35 2HB CYS 35 1.438 1.889 6.253
236 H ASP 36 H ASP 36 4.195 3.362 6.951
237 HA ASP 36 HA ASP 36 3.553 4.429 9.597
238 1HB ASP 36 1HB ASP 36 5.085 5.940 7.452
239 2HB ASP 36 2HB ASP 36 5.248 6.043 9.267
240 HD2 ASP 36 HD2 ASP 36 6.922 2.927 9.259
241 H LYS 37 H LYS 37 3.561 7.153 7.878
242 HA LYS 37 HA LYS 37 1.248 8.086 8.091
243 1HB LYS 37 1HB LYS 37 3.336 9.078 7.035
244 2HB LYS 37 2HB LYS 37 2.882 8.339 5.506
245 1HG LYS 37 1HG LYS 37 2.386 10.746 5.599
246 2HG LYS 37 2HG LYS 37 0.906 9.793 5.349
247 1HD LYS 37 1HD LYS 37 0.226 10.097 7.702
248 2HD LYS 37 2HD LYS 37 1.817 10.845 8.097
249 1HE LYS 37 1HE LYS 37 1.288 12.800 6.617
250 2HE LYS 37 2HE LYS 37 -0.304 12.062 6.194
251 1HZ LYS 37 1HZ LYS 37 -0.922 12.141 8.486
252 2HZ LYS 37 2HZ LYS 37 -0.448 13.685 7.960
253 3HZ LYS 37 3HZ LYS 37 0.594 12.767 8.938
254 H CYS 38 H CYS 38 -0.515 6.546 7.985
255 HA CYS 38 HA CYS 38 -1.608 5.933 5.388
256 1HB CYS 38 1HB CYS 38 -1.719 4.422 7.422
257 2HB CYS 38 2HB CYS 38 -2.633 5.690 8.277
258 H VAL 39 H VAL 39 -2.403 7.623 4.196
259 HA VAL 39 HA VAL 39 -3.787 9.776 5.595
260 HB VAL 39 HB VAL 39 -2.852 9.392 2.726
261 1HG1 VAL 39 1HG1 VAL 39 -4.639 11.231 3.297
262 2HG1 VAL 39 2HG1 VAL 39 -3.047 11.912 2.754
263 3HG1 VAL 39 3HG1 VAL 39 -3.462 11.864 4.508
264 1HG2 VAL 39 1HG2 VAL 39 -1.499 10.584 5.212
265 2HG2 VAL 39 2HG2 VAL 39 -1.008 11.022 3.532
266 3HG2 VAL 39 3HG2 VAL 39 -0.838 9.311 4.095
267 H CYS 40 H CYS 40 -6.074 9.678 5.541
268 HA CYS 40 HA CYS 40 -7.276 8.111 3.420
269 1HB CYS 40 1HB CYS 40 -6.476 6.671 5.320
270 2HB CYS 40 2HB CYS 40 -7.665 7.478 6.383
271 H ALA 41 H ALA 41 -7.921 10.206 2.900
272 HA ALA 41 HA ALA 41 -9.734 11.650 4.592
273 1HB ALA 41 1HB ALA 41 -9.312 11.962 1.588
274 2HB ALA 41 2HB ALA 41 -8.418 12.841 2.890
275 3HB ALA 41 3HB ALA 41 -10.183 13.120 2.679
276 H TYR 42 H TYR 42 -11.908 12.053 4.405
277 HA TYR 42 HA TYR 42 -13.249 9.605 4.289
278 1HB TYR 42 1HB TYR 42 -15.071 11.091 5.477
279 2HB TYR 42 2HB TYR 42 -13.471 10.743 6.232
280 HD1 TYR 42 HD1 TYR 42 -12.079 12.530 6.917
281 HD2 TYR 42 HD2 TYR 42 -15.110 13.324 3.964
282 HE1 TYR 42 HE1 TYR 42 -11.433 14.896 6.888
283 HE2 TYR 42 HE2 TYR 42 -14.431 15.689 3.922
284 HH TYR 42 HH TYR 42 -12.802 17.178 4.521
285 H SER 43 H SER 43 -12.781 10.294 1.801
286 HA SER 43 HA SER 43 -15.020 10.995 0.221
287 1HB SER 43 1HB SER 43 -12.751 9.018 -0.382
288 2HB SER 43 2HB SER 43 -13.800 9.863 -1.610
289 HG SER 43 HG SER 43 -11.997 10.970 -1.550
290 H ASN 44 H ASN 44 -15.188 8.683 -1.491
291 HA ASN 44 HA ASN 44 -16.456 6.628 0.111
292 1HB ASN 44 1HB ASN 44 -18.028 8.458 -0.579
293 2HB ASN 44 2HB ASN 44 -17.557 8.219 -2.267
294 1HD2 ASN 44 1HD2 ASN 44 -18.814 6.264 0.561
295 2HD2 ASN 44 2HD2 ASN 44 -19.737 5.191 -0.439
296 HA PRO 45 HA PRO 45 -15.597 4.920 0.596
297 1HB PRO 45 1HB PRO 45 -13.510 3.096 0.625
298 2HB PRO 45 2HB PRO 45 -15.115 2.672 0.042
299 1HG PRO 45 1HG PRO 45 -12.707 3.551 -1.637
300 2HG PRO 45 2HG PRO 45 -13.765 2.126 -1.896
301 1HD PRO 45 1HD PRO 45 -14.146 4.518 -3.250
302 2HD PRO 45 2HD PRO 45 -15.564 3.504 -2.722
303 HA PRO 46 HA PRO 46 -12.439 7.742 1.768
304 1HB PRO 46 1HB PRO 46 -11.432 6.920 4.193
305 2HB PRO 46 2HB PRO 46 -13.156 7.441 4.020
306 1HG PRO 46 1HG PRO 46 -12.122 4.563 3.888
307 2HG PRO 46 2HG PRO 46 -13.413 5.261 4.969
308 1HD PRO 46 1HD PRO 46 -14.019 4.019 2.587
309 2HD PRO 46 2HD PRO 46 -14.918 5.582 3.106
310 H GLN 47 H GLN 47 -10.106 8.111 1.693
311 HA GLN 47 HA GLN 47 -9.205 5.895 -0.038
312 1HB GLN 47 1HB GLN 47 -8.732 8.902 -0.171
313 2HB GLN 47 2HB GLN 47 -7.910 7.738 -1.244
314 1HG GLN 47 1HG GLN 47 -10.971 7.964 -1.034
315 2HG GLN 47 2HG GLN 47 -9.967 8.836 -2.252
316 1HE2 GLN 47 1HE2 GLN 47 -11.333 5.769 -1.308
317 2HE2 GLN 47 2HE2 GLN 47 -10.776 4.829 -2.672
318 H CYS 48 H CYS 48 -8.301 4.613 1.549
319 HA CYS 48 HA CYS 48 -6.148 5.756 3.133
320 1HB CYS 48 1HB CYS 48 -7.380 2.975 3.068
321 2HB CYS 48 2HB CYS 48 -5.886 3.351 3.983
322 H GLN 49 H GLN 49 -4.229 6.043 2.490
323 HA GLN 49 HA GLN 49 -2.843 3.872 1.162
324 1HB GLN 49 1HB GLN 49 -3.924 6.176 -0.099
325 2HB GLN 49 2HB GLN 49 -2.185 6.547 0.019
326 1HG GLN 49 1HG GLN 49 -1.595 4.391 -1.124
327 2HG GLN 49 2HG GLN 49 -3.338 3.924 -1.203
328 1HE2 GLN 49 1HE2 GLN 49 -4.704 6.010 -2.166
329 2HE2 GLN 49 2HE2 GLN 49 -4.065 6.541 -3.690
330 H CYS 50 H CYS 50 -0.683 3.661 1.625
331 HA CYS 50 HA CYS 50 0.296 5.482 3.718
332 1HB CYS 50 1HB CYS 50 0.371 3.054 4.194
333 2HB CYS 50 2HB CYS 50 1.405 2.814 2.790
334 H TYR 51 H TYR 51 1.101 7.198 3.018
335 HA TYR 51 HA TYR 51 2.344 7.788 0.586
336 1HB TYR 51 1HB TYR 51 2.056 9.142 3.306
337 2HB TYR 51 2HB TYR 51 3.200 9.820 2.126
338 HD1 TYR 51 HD1 TYR 51 -0.377 8.343 1.505
339 HD2 TYR 51 HD2 TYR 51 2.194 11.867 1.432
340 HE1 TYR 51 HE1 TYR 51 -2.079 9.589 0.457
341 HE2 TYR 51 HE2 TYR 51 0.434 13.086 0.422
342 HH TYR 51 HH TYR 51 -1.615 12.858 -0.769
343 H ASP 52 H ASP 52 3.699 6.378 3.375
344 HA ASP 52 HA ASP 52 6.302 7.596 3.013
345 1HB ASP 52 1HB ASP 52 5.086 7.108 5.261
346 2HB ASP 52 2HB ASP 52 5.647 5.409 5.077
347 HD2 ASP 52 HD2 ASP 52 7.884 7.913 6.854
348 H THR 53 H THR 53 8.161 6.826 2.211
349 HA THR 53 HA THR 53 8.139 4.197 0.947
350 HB THR 53 HB THR 53 10.216 4.922 -0.215
351 HG1 THR 53 HG1 THR 53 10.643 6.539 1.462
352 1HG2 THR 53 1HG2 THR 53 8.047 5.096 -1.294
353 2HG2 THR 53 2HG2 THR 53 9.028 6.545 -1.703
354 3HG2 THR 53 3HG2 THR 53 7.698 6.670 -0.489
355 H HIS 54 H HIS 54 8.890 2.535 1.973
356 HA HIS 54 HA HIS 54 11.508 2.499 3.114
357 1HB HIS 54 1HB HIS 54 10.852 1.317 5.235
358 2HB HIS 54 2HB HIS 54 10.308 3.038 5.182
359 HD1 HIS 54 HD1 HIS 54 7.914 3.530 4.690
360 HD2 HIS 54 HD2 HIS 54 8.635 -0.471 5.668
361 HE1 HIS 54 HE1 HIS 54 5.679 2.492 5.147
362 HE2 HIS 54 HE2 HIS 54 6.133 0.056 5.778
363 H LYS 55 H LYS 55 8.499 0.506 2.780
364 HA LYS 55 HA LYS 55 9.904 -1.867 2.680
365 1HB LYS 55 1HB LYS 55 7.732 -2.873 2.648
366 2HB LYS 55 2HB LYS 55 7.567 -1.381 3.544
367 1HG LYS 55 1HG LYS 55 6.429 -0.251 1.658
368 2HG LYS 55 2HG LYS 55 6.860 -1.579 0.558
369 1HD LYS 55 1HD LYS 55 4.617 -1.899 0.950
370 2HD LYS 55 2HD LYS 55 5.388 -3.125 2.002
371 1HE LYS 55 1HE LYS 55 4.355 -0.346 2.963
372 2HE LYS 55 2HE LYS 55 3.381 -1.867 3.008
373 1HZ LYS 55 1HZ LYS 55 4.429 -1.429 5.112
374 2HZ LYS 55 2HZ LYS 55 5.968 -1.422 4.394
375 3HZ LYS 55 3HZ LYS 55 5.055 -2.847 4.424
376 H PHE 56 H PHE 56 8.792 -3.573 0.990
377 HA PHE 56 HA PHE 56 9.513 -2.846 -1.755
378 1HB PHE 56 1HB PHE 56 9.969 -5.422 -1.911
379 2HB PHE 56 2HB PHE 56 11.136 -4.456 -0.960
380 HD1 PHE 56 HD1 PHE 56 11.319 -4.699 1.457
381 HD2 PHE 56 HD2 PHE 56 8.191 -6.736 -0.675
382 HE1 PHE 56 HE1 PHE 56 10.763 -5.961 3.492
383 HE2 PHE 56 HE2 PHE 56 7.592 -7.953 1.377
384 HZ PHE 56 HZ PHE 56 8.891 -7.602 3.468
385 H CYS 57 H CYS 57 8.177 -4.838 -3.213
386 HA CYS 57 HA CYS 57 5.434 -4.089 -2.612
387 1HB CYS 57 1HB CYS 57 6.458 -4.026 -4.932
388 2HB CYS 57 2HB CYS 57 6.372 -5.807 -4.936
389 H TYR 58 H TYR 58 3.814 -5.305 -2.024
390 HA TYR 58 HA TYR 58 4.383 -8.034 -0.987
391 1HB TYR 58 1HB TYR 58 2.798 -5.641 0.002
392 2HB TYR 58 2HB TYR 58 2.083 -7.225 0.335
393 HD1 TYR 58 HD1 TYR 58 2.944 -8.679 2.001
394 HD2 TYR 58 HD2 TYR 58 5.182 -5.190 0.809
395 HE1 TYR 58 HE1 TYR 58 4.274 -8.897 3.955
396 HE2 TYR 58 HE2 TYR 58 6.537 -5.387 2.842
397 HH TYR 58 HH TYR 58 5.988 -8.088 5.193
398 H LYS 59 H LYS 59 2.732 -9.471 -0.751
399 HA LYS 59 HA LYS 59 0.726 -9.960 -2.614
400 1HB LYS 59 1HB LYS 59 1.137 -10.881 0.253
401 2HB LYS 59 2HB LYS 59 -0.118 -11.553 -0.839
402 1HG LYS 59 1HG LYS 59 1.655 -12.329 -2.438
403 2HG LYS 59 2HG LYS 59 2.922 -11.592 -1.417
404 1HD LYS 59 1HD LYS 59 1.994 -13.062 0.526
405 2HD LYS 59 2HD LYS 59 1.203 -14.028 -0.760
406 1HE LYS 59 1HE LYS 59 4.219 -13.399 -0.474
407 2HE LYS 59 2HE LYS 59 3.428 -14.984 -0.101
408 1HZ LYS 59 1HZ LYS 59 2.821 -15.164 -2.412
409 2HZ LYS 59 2HZ LYS 59 4.500 -14.974 -2.240
410 3HZ LYS 59 3HZ LYS 59 3.548 -13.671 -2.765
411 H ALA 60 H ALA 60 -1.613 -10.195 -2.050
412 HA ALA 60 HA ALA 60 -2.371 -7.459 -1.793
413 1HB ALA 60 1HB ALA 60 -4.139 -8.156 -3.390
414 2HB ALA 60 2HB ALA 60 -3.730 -9.888 -3.038
415 3HB ALA 60 3HB ALA 60 -2.546 -8.834 -3.864
416 H CYS 61 H CYS 61 -4.552 -6.804 -1.623
417 HA CYS 61 HA CYS 61 -5.732 -7.598 0.969
418 1HB CYS 61 1HB CYS 61 -5.029 -5.051 -0.176
419 2HB CYS 61 2HB CYS 61 -6.794 -5.087 -0.292
420 H HIS 62 H HIS 62 -5.947 -9.012 -1.443
421 HA HIS 62 HA HIS 62 -8.366 -8.162 -2.836
422 1HB HIS 62 1HB HIS 62 -6.445 -8.289 -4.178
423 2HB HIS 62 2HB HIS 62 -5.965 -9.892 -3.542
424 HD1 HIS 62 HD1 HIS 62 -9.360 -9.043 -4.913
425 HD2 HIS 62 HD2 HIS 62 -5.910 -11.129 -6.025
426 HE1 HIS 62 HE1 HIS 62 -9.894 -10.265 -7.050
427 HE2 HIS 62 HE2 HIS 62 -7.770 -11.476 -7.734
428 H ASN 63 H ASN 63 -9.183 -9.005 -0.590
429 HA ASN 63 HA ASN 63 -9.753 -11.721 -0.267
430 1HB ASN 63 1HB ASN 63 -11.530 -10.764 1.400
431 2HB ASN 63 2HB ASN 63 -9.784 -10.531 1.704
432 1HD2 ASN 63 1HD2 ASN 63 -9.581 -8.391 2.702
433 2HD2 ASN 63 2HD2 ASN 63 -10.337 -7.023 2.010
434 H SER 64 H SER 64 -11.638 -9.127 -1.550
435 HA SER 64 HA SER 64 -13.989 -10.824 -1.829
436 1HB SER 64 1HB SER 64 -13.661 -7.838 -2.369
437 2HB SER 64 2HB SER 64 -15.233 -8.720 -2.262
438 HG SER 64 HG SER 64 -13.248 -8.357 -0.214
439 H GLU 65 H GLU 65 -12.002 -9.017 -4.189
440 HA GLU 65 HA GLU 65 -13.819 -9.027 -6.259
441 1HB GLU 65 1HB GLU 65 -12.047 -7.483 -6.290
442 2HB GLU 65 2HB GLU 65 -10.831 -8.768 -6.127
443 1HG GLU 65 1HG GLU 65 -11.222 -9.505 -8.507
444 2HG GLU 65 2HG GLU 65 -12.486 -8.233 -8.681
445 HE2 GLU 65 HE2 GLU 65 -8.615 -7.121 -8.328
446 H ILE 66 H ILE 66 -11.792 -11.795 -5.489
447 HA ILE 66 HA ILE 66 -12.504 -13.106 -8.030
448 HB ILE 66 HB ILE 66 -11.147 -14.291 -5.583
449 1HG1 ILE 66 1HG1 ILE 66 -9.886 -13.807 -8.323
450 2HG1 ILE 66 2HG1 ILE 66 -9.940 -12.476 -7.158
451 1HG2 ILE 66 1HG2 ILE 66 -12.398 -16.041 -6.962
452 2HG2 ILE 66 2HG2 ILE 66 -10.626 -16.215 -7.088
453 3HG2 ILE 66 3HG2 ILE 66 -11.543 -15.450 -8.428
454 1HD1 ILE 66 1HD1 ILE 66 -7.775 -13.779 -7.013
455 2HD1 ILE 66 2HD1 ILE 66 -8.707 -15.248 -6.569
456 3HD1 ILE 66 3HD1 ILE 66 -8.689 -13.830 -5.460
457 H GLU 67 H GLU 67 -13.310 -13.803 -4.424
458 HA GLU 67 HA GLU 67 -15.928 -14.505 -5.215
459 1HB GLU 67 1HB GLU 67 -14.022 -16.621 -4.048
460 2HB GLU 67 2HB GLU 67 -15.808 -16.695 -3.839
461 1HG GLU 67 1HG GLU 67 -16.096 -16.737 -6.361
462 2HG GLU 67 2HG GLU 67 -14.301 -16.867 -6.501
463 HE2 GLU 67 HE2 GLU 67 -15.533 -18.603 -7.600
Start of MODEL 5
1 1H GLY 1 1H GLY 1 -9.098 -10.070 4.215
2 2H GLY 1 2H GLY 1 -10.088 -9.522 5.487
3 3H GLY 1 3H GLY 1 -9.781 -11.184 5.302
4 1HA GLY 1 1HA GLY 1 -7.430 -10.767 5.685
5 2HA GLY 1 2HA GLY 1 -7.896 -9.060 6.083
6 H ASP 2 H ASP 2 -7.599 -12.317 7.214
7 HA ASP 2 HA ASP 2 -8.489 -11.652 9.919
8 1HB ASP 2 1HB ASP 2 -9.844 -13.847 8.155
9 2HB ASP 2 2HB ASP 2 -10.123 -13.624 9.920
10 HD2 ASP 2 HD2 ASP 2 -12.130 -10.842 9.521
11 H ASP 3 H ASP 3 -6.011 -12.064 9.350
12 HA ASP 3 HA ASP 3 -5.410 -14.471 10.676
13 1HB ASP 3 1HB ASP 3 -5.646 -15.247 8.189
14 2HB ASP 3 2HB ASP 3 -4.127 -14.361 7.867
15 HD2 ASP 3 HD2 ASP 3 -2.507 -17.279 8.674
16 H VAL 4 H VAL 4 -3.640 -12.175 8.461
17 HA VAL 4 HA VAL 4 -1.830 -11.566 10.676
18 HB VAL 4 HB VAL 4 -1.087 -11.564 7.722
19 1HG1 VAL 4 1HG1 VAL 4 1.236 -11.732 8.713
20 2HG1 VAL 4 2HG1 VAL 4 0.532 -11.721 10.367
21 3HG1 VAL 4 3HG1 VAL 4 0.396 -10.271 9.313
22 1HG2 VAL 4 1HG2 VAL 4 -1.678 -13.919 8.155
23 2HG2 VAL 4 2HG2 VAL 4 -0.846 -13.870 9.760
24 3HG2 VAL 4 3HG2 VAL 4 0.108 -13.766 8.239
25 H LYS 5 H LYS 5 -1.528 -9.338 10.987
26 HA LYS 5 HA LYS 5 -3.232 -7.604 9.366
27 1HB LYS 5 1HB LYS 5 -1.763 -7.210 12.013
28 2HB LYS 5 2HB LYS 5 -2.905 -6.029 11.307
29 1HG LYS 5 1HG LYS 5 -4.774 -7.714 11.549
30 2HG LYS 5 2HG LYS 5 -3.614 -8.894 12.222
31 1HD LYS 5 1HD LYS 5 -2.998 -7.199 14.018
32 2HD LYS 5 2HD LYS 5 -4.378 -6.184 13.469
33 1HE LYS 5 1HE LYS 5 -5.958 -8.093 14.018
34 2HE LYS 5 2HE LYS 5 -4.537 -9.101 14.516
35 1HZ LYS 5 1HZ LYS 5 -5.552 -8.098 16.396
36 2HZ LYS 5 2HZ LYS 5 -5.411 -6.541 15.737
37 3HZ LYS 5 3HZ LYS 5 -4.016 -7.413 16.165
38 H SER 6 H SER 6 -0.515 -8.614 8.713
39 HA SER 6 HA SER 6 1.352 -6.525 8.477
40 1HB SER 6 1HB SER 6 2.492 -7.944 6.770
41 2HB SER 6 2HB SER 6 2.055 -8.833 8.255
42 HG SER 6 HG SER 6 1.594 -9.893 6.268
43 H ALA 7 H ALA 7 2.185 -5.650 6.327
44 HA ALA 7 HA ALA 7 0.249 -4.131 5.010
45 1HB ALA 7 1HB ALA 7 2.168 -3.620 3.445
46 2HB ALA 7 2HB ALA 7 3.052 -5.055 4.090
47 3HB ALA 7 3HB ALA 7 2.721 -3.652 5.156
48 H CYS 8 H CYS 8 -0.296 -4.165 2.658
49 HA CYS 8 HA CYS 8 -0.003 -6.734 1.345
50 1HB CYS 8 1HB CYS 8 -2.244 -7.228 0.927
51 2HB CYS 8 2HB CYS 8 -2.193 -6.875 2.674
52 H CYS 9 H CYS 9 -0.049 -6.544 -1.021
53 HA CYS 9 HA CYS 9 -0.867 -3.967 -2.005
54 1HB CYS 9 1HB CYS 9 1.529 -3.667 -1.101
55 2HB CYS 9 2HB CYS 9 2.060 -4.864 -2.314
56 H ASP 10 H ASP 10 -1.814 -4.266 -4.059
57 HA ASP 10 HA ASP 10 -0.908 -6.563 -5.605
58 1HB ASP 10 1HB ASP 10 -2.854 -6.042 -7.023
59 2HB ASP 10 2HB ASP 10 -3.271 -6.235 -5.313
60 HD2 ASP 10 HD2 ASP 10 -3.055 -3.996 -7.883
61 H THR 11 H THR 11 -0.416 -3.087 -5.628
62 HA THR 11 HA THR 11 1.079 -3.181 -8.135
63 HB THR 11 HB THR 11 -1.406 -1.419 -7.705
64 HG1 THR 11 HG1 THR 11 -1.043 -3.552 -9.571
65 1HG2 THR 11 1HG2 THR 11 0.326 -0.318 -9.152
66 2HG2 THR 11 2HG2 THR 11 -1.078 -0.821 -10.126
67 3HG2 THR 11 3HG2 THR 11 0.433 -1.800 -10.178
68 H CYS 12 H CYS 12 2.668 -1.626 -8.117
69 HA CYS 12 HA CYS 12 2.618 0.379 -6.034
70 1HB CYS 12 1HB CYS 12 4.531 -0.631 -4.922
71 2HB CYS 12 2HB CYS 12 3.176 -1.838 -5.054
72 H LEU 13 H LEU 13 3.841 2.035 -6.232
73 HA LEU 13 HA LEU 13 5.481 2.361 -8.613
74 1HB LEU 13 1HB LEU 13 3.896 4.127 -8.142
75 2HB LEU 13 2HB LEU 13 4.490 4.277 -6.453
76 HG LEU 13 HG LEU 13 6.820 4.901 -7.600
77 1HD1 LEU 13 1HD1 LEU 13 6.594 5.867 -9.892
78 2HD1 LEU 13 2HD1 LEU 13 4.861 5.370 -9.940
79 3HD1 LEU 13 3HD1 LEU 13 6.153 4.123 -9.923
80 1HD2 LEU 13 1HD2 LEU 13 6.117 7.279 -7.888
81 2HD2 LEU 13 2HD2 LEU 13 5.447 6.558 -6.382
82 3HD2 LEU 13 3HD2 LEU 13 4.390 6.781 -7.824
83 H CYS 14 H CYS 14 7.439 1.502 -8.406
84 HA CYS 14 HA CYS 14 8.858 1.837 -5.871
85 1HB CYS 14 1HB CYS 14 9.556 0.235 -8.350
86 2HB CYS 14 2HB CYS 14 10.720 0.565 -7.060
87 H THR 15 H THR 15 10.358 3.172 -5.428
88 HA THR 15 HA THR 15 11.107 5.206 -7.321
89 HB THR 15 HB THR 15 12.766 5.928 -5.635
90 HG1 THR 15 HG1 THR 15 11.443 4.179 -3.879
91 1HG2 THR 15 1HG2 THR 15 10.379 6.761 -5.735
92 2HG2 THR 15 2HG2 THR 15 11.026 6.747 -4.052
93 3HG2 THR 15 3HG2 THR 15 9.859 5.486 -4.590
94 H ARG 16 H ARG 16 13.013 5.528 -8.351
95 HA ARG 16 HA ARG 16 14.870 3.313 -8.570
96 1HB ARG 16 1HB ARG 16 14.810 6.013 -9.990
97 2HB ARG 16 2HB ARG 16 15.993 4.682 -10.286
98 1HG ARG 16 1HG ARG 16 14.150 3.138 -10.886
99 2HG ARG 16 2HG ARG 16 12.942 4.455 -10.655
100 1HD ARG 16 1HD ARG 16 14.079 5.769 -12.515
101 2HD ARG 16 2HD ARG 16 15.173 4.340 -12.796
102 HE ARG 16 HE ARG 16 12.357 3.552 -12.739
103 1HH1 ARG 16 1HH1 ARG 16 14.800 5.143 -14.791
104 2HH1 ARG 16 2HH1 ARG 16 13.879 4.955 -16.252
105 1HH2 ARG 16 1HH2 ARG 16 11.193 3.224 -14.712
106 2HH2 ARG 16 2HH2 ARG 16 11.843 3.791 -16.219
107 H SER 17 H SER 17 16.515 3.154 -7.113
108 HA SER 17 HA SER 17 17.893 5.258 -5.903
109 1HB SER 17 1HB SER 17 15.516 5.575 -4.824
110 2HB SER 17 2HB SER 17 15.792 4.002 -4.031
111 HG SER 17 HG SER 17 16.299 5.943 -2.841
112 H GLN 18 H GLN 18 18.741 4.190 -3.678
113 HA GLN 18 HA GLN 18 18.952 1.320 -3.829
114 1HB GLN 18 1HB GLN 18 20.674 2.517 -5.425
115 2HB GLN 18 2HB GLN 18 21.599 2.810 -3.940
116 1HG GLN 18 1HG GLN 18 20.620 0.065 -5.066
117 2HG GLN 18 2HG GLN 18 22.309 0.679 -5.109
118 1HE2 GLN 18 1HE2 GLN 18 23.032 1.421 -2.718
119 2HE2 GLN 18 2HE2 GLN 18 22.842 0.126 -1.546
120 HA PRO 19 HA PRO 19 18.383 0.001 -2.204
121 1HB PRO 19 1HB PRO 19 16.650 -0.197 -0.018
122 2HB PRO 19 2HB PRO 19 18.420 -0.652 0.094
123 1HG PRO 19 1HG PRO 19 17.149 2.061 0.800
124 2HG PRO 19 2HG PRO 19 18.165 1.012 1.867
125 1HD PRO 19 1HD PRO 19 19.289 3.056 0.409
126 2HD PRO 19 2HD PRO 19 20.156 1.458 0.516
127 HA PRO 20 HA PRO 20 14.805 2.218 -3.815
128 1HB PRO 20 1HB PRO 20 13.144 0.171 -4.591
129 2HB PRO 20 2HB PRO 20 14.744 0.442 -5.401
130 1HG PRO 20 1HG PRO 20 14.126 -1.508 -3.112
131 2HG PRO 20 2HG PRO 20 14.914 -1.882 -4.704
132 1HD PRO 20 1HD PRO 20 16.374 -1.334 -2.411
133 2HD PRO 20 2HD PRO 20 16.943 -0.758 -4.061
134 H THR 21 H THR 21 12.405 2.294 -3.512
135 HA THR 21 HA THR 21 11.330 1.360 -0.954
136 HB THR 21 HB THR 21 11.973 4.291 -1.681
137 HG1 THR 21 HG1 THR 21 13.004 2.426 -0.014
138 1HG2 THR 21 1HG2 THR 21 10.760 4.904 0.462
139 2HG2 THR 21 2HG2 THR 21 10.099 3.235 0.549
140 3HG2 THR 21 3HG2 THR 21 9.661 4.330 -0.817
141 H CYS 22 H CYS 22 9.067 1.238 -1.123
142 HA CYS 22 HA CYS 22 8.022 2.248 -3.715
143 1HB CYS 22 1HB CYS 22 7.742 -0.660 -2.802
144 2HB CYS 22 2HB CYS 22 7.164 0.028 -4.325
145 H ARG 23 H ARG 23 6.291 3.213 -3.521
146 HA ARG 23 HA ARG 23 4.411 3.011 -1.385
147 1HB ARG 23 1HB ARG 23 4.373 4.352 -4.134
148 2HB ARG 23 2HB ARG 23 3.016 4.458 -2.947
149 1HG ARG 23 1HG ARG 23 4.378 5.603 -1.319
150 2HG ARG 23 2HG ARG 23 5.868 5.412 -2.287
151 1HD ARG 23 1HD ARG 23 4.868 7.757 -2.524
152 2HD ARG 23 2HD ARG 23 5.031 6.860 -4.076
153 HE ARG 23 HE ARG 23 2.779 6.840 -4.356
154 1HH1 ARG 23 1HH1 ARG 23 3.302 7.829 -0.932
155 2HH1 ARG 23 2HH1 ARG 23 1.649 8.217 -0.684
156 1HH2 ARG 23 1HH2 ARG 23 0.675 7.315 -4.011
157 2HH2 ARG 23 2HH2 ARG 23 0.068 7.932 -2.510
158 H CYS 24 H CYS 24 2.475 1.905 -1.310
159 HA CYS 24 HA CYS 24 1.832 0.223 -3.654
160 1HB CYS 24 1HB CYS 24 1.641 -0.698 -1.219
161 2HB CYS 24 2HB CYS 24 0.184 0.333 -1.076
162 H VAL 25 H VAL 25 0.723 1.268 -5.278
163 HA VAL 25 HA VAL 25 -0.468 3.770 -4.762
164 HB VAL 25 HB VAL 25 -1.178 3.772 -7.141
165 1HG1 VAL 25 1HG1 VAL 25 0.861 4.896 -6.259
166 2HG1 VAL 25 2HG1 VAL 25 1.189 4.176 -7.876
167 3HG1 VAL 25 3HG1 VAL 25 1.794 3.360 -6.390
168 1HG2 VAL 25 1HG2 VAL 25 0.587 1.232 -7.317
169 2HG2 VAL 25 2HG2 VAL 25 -0.138 2.144 -8.663
170 3HG2 VAL 25 3HG2 VAL 25 -1.208 1.254 -7.543
171 H ASP 26 H ASP 26 -1.761 0.560 -4.976
172 HA ASP 26 HA ASP 26 -4.420 1.427 -5.485
173 1HB ASP 26 1HB ASP 26 -3.521 -0.880 -6.014
174 2HB ASP 26 2HB ASP 26 -3.654 -1.276 -4.255
175 HD2 ASP 26 HD2 ASP 26 -5.707 -1.114 -3.383
176 H VAL 27 H VAL 27 -5.669 2.614 -4.162
177 HA VAL 27 HA VAL 27 -5.097 2.633 -1.343
178 HB VAL 27 HB VAL 27 -6.367 4.511 -1.106
179 1HG1 VAL 27 1HG1 VAL 27 -5.454 6.030 -2.753
180 2HG1 VAL 27 2HG1 VAL 27 -5.315 4.737 -3.998
181 3HG1 VAL 27 3HG1 VAL 27 -4.252 4.700 -2.540
182 1HG2 VAL 27 1HG2 VAL 27 -7.925 5.383 -2.920
183 2HG2 VAL 27 2HG2 VAL 27 -8.496 3.882 -2.126
184 3HG2 VAL 27 3HG2 VAL 27 -7.753 3.804 -3.771
185 H ARG 28 H ARG 28 -6.604 2.391 0.365
186 HA ARG 28 HA ARG 28 -8.856 0.580 -0.313
187 1HB ARG 28 1HB ARG 28 -6.755 0.356 1.904
188 2HB ARG 28 2HB ARG 28 -8.310 -0.551 1.938
189 1HG ARG 28 1HG ARG 28 -7.055 -2.194 1.044
190 2HG ARG 28 2HG ARG 28 -7.537 -1.369 -0.487
191 1HD ARG 28 1HD ARG 28 -5.323 -0.063 -0.317
192 2HD ARG 28 2HD ARG 28 -4.895 -1.114 1.088
193 HE ARG 28 HE ARG 28 -5.751 -2.664 -1.273
194 1HH1 ARG 28 1HH1 ARG 28 -3.033 -0.991 0.285
195 2HH1 ARG 28 2HH1 ARG 28 -1.803 -1.800 -0.639
196 1HH2 ARG 28 1HH2 ARG 28 -4.119 -3.722 -2.545
197 2HH2 ARG 28 2HH2 ARG 28 -2.439 -3.377 -2.264
198 H GLU 29 H GLU 29 -10.225 0.242 1.643
199 HA GLU 29 HA GLU 29 -11.448 2.488 2.686
200 1HB GLU 29 1HB GLU 29 -11.354 -0.460 3.342
201 2HB GLU 29 2HB GLU 29 -12.408 0.668 4.264
202 1HG GLU 29 1HG GLU 29 -13.519 1.398 2.095
203 2HG GLU 29 2HG GLU 29 -12.534 0.197 1.187
204 HE2 GLU 29 HE2 GLU 29 -14.420 -2.458 2.195
205 H SER 30 H SER 30 -8.765 0.580 3.927
206 HA SER 30 HA SER 30 -8.371 2.527 6.055
207 1HB SER 30 1HB SER 30 -8.581 0.793 7.912
208 2HB SER 30 2HB SER 30 -10.104 0.908 6.985
209 HG SER 30 HG SER 30 -9.479 -1.255 7.316
210 H CYS 31 H CYS 31 -6.710 1.730 7.682
211 HA CYS 31 HA CYS 31 -4.280 0.985 6.256
212 1HB CYS 31 1HB CYS 31 -4.657 3.054 7.739
213 2HB CYS 31 2HB CYS 31 -4.708 1.932 9.154
214 H HIS 32 H HIS 32 -2.736 -0.671 7.122
215 HA HIS 32 HA HIS 32 -3.981 -2.696 8.874
216 1HB HIS 32 1HB HIS 32 -1.510 -2.897 7.045
217 2HB HIS 32 2HB HIS 32 -2.307 -4.261 7.910
218 HD1 HIS 32 HD1 HIS 32 -2.191 -2.543 4.825
219 HD2 HIS 32 HD2 HIS 32 -5.116 -4.716 6.879
220 HE1 HIS 32 HE1 HIS 32 -3.933 -3.142 3.148
221 HE2 HIS 32 HE2 HIS 32 -5.735 -4.456 4.408
222 H SER 33 H SER 33 -1.437 -3.776 9.966
223 HA SER 33 HA SER 33 -1.196 -1.894 12.028
224 1HB SER 33 1HB SER 33 0.445 -4.423 11.334
225 2HB SER 33 2HB SER 33 0.678 -3.488 12.861
226 HG SER 33 HG SER 33 -0.749 -5.279 13.051
227 H ALA 34 H ALA 34 1.508 -3.076 9.889
228 HA ALA 34 HA ALA 34 3.188 -1.086 11.045
229 1HB ALA 34 1HB ALA 34 3.909 -3.450 10.801
230 2HB ALA 34 2HB ALA 34 5.000 -2.342 9.901
231 3HB ALA 34 3HB ALA 34 3.770 -3.304 8.996
232 H CYS 35 H CYS 35 1.345 0.230 9.636
233 HA CYS 35 HA CYS 35 3.283 1.718 8.004
234 1HB CYS 35 1HB CYS 35 1.442 0.830 6.529
235 2HB CYS 35 2HB CYS 35 0.254 1.740 7.559
236 H ASP 36 H ASP 36 3.915 3.407 9.378
237 HA ASP 36 HA ASP 36 2.143 4.169 11.490
238 1HB ASP 36 1HB ASP 36 3.888 5.740 12.185
239 2HB ASP 36 2HB ASP 36 4.586 4.126 11.818
240 HD2 ASP 36 HD2 ASP 36 6.423 5.279 9.134
241 H LYS 37 H LYS 37 3.157 5.694 8.455
242 HA LYS 37 HA LYS 37 1.237 7.844 8.905
243 1HB LYS 37 1HB LYS 37 3.738 8.180 8.358
244 2HB LYS 37 2HB LYS 37 3.289 7.769 6.684
245 1HG LYS 37 1HG LYS 37 1.568 9.595 6.724
246 2HG LYS 37 2HG LYS 37 2.080 10.002 8.402
247 1HD LYS 37 1HD LYS 37 4.470 10.370 7.475
248 2HD LYS 37 2HD LYS 37 3.808 10.084 5.835
249 1HE LYS 37 1HE LYS 37 4.001 12.475 6.177
250 2HE LYS 37 2HE LYS 37 2.235 12.083 6.181
251 1HZ LYS 37 1HZ LYS 37 2.322 12.102 8.601
252 2HZ LYS 37 2HZ LYS 37 2.859 13.576 7.943
253 3HZ LYS 37 3HZ LYS 37 3.982 12.464 8.562
254 H CYS 38 H CYS 38 -0.488 6.216 8.575
255 HA CYS 38 HA CYS 38 -1.242 5.911 5.773
256 1HB CYS 38 1HB CYS 38 -2.221 5.099 8.506
257 2HB CYS 38 2HB CYS 38 -3.484 5.261 7.235
258 H VAL 39 H VAL 39 -2.018 7.654 4.674
259 HA VAL 39 HA VAL 39 -3.381 9.766 6.204
260 HB VAL 39 HB VAL 39 -1.908 9.729 3.540
261 1HG1 VAL 39 1HG1 VAL 39 -2.079 12.222 3.750
262 2HG1 VAL 39 2HG1 VAL 39 -3.140 12.014 5.203
263 3HG1 VAL 39 3HG1 VAL 39 -3.696 11.444 3.566
264 1HG2 VAL 39 1HG2 VAL 39 -1.132 10.825 6.319
265 2HG2 VAL 39 2HG2 VAL 39 -0.254 11.209 4.786
266 3HG2 VAL 39 3HG2 VAL 39 -0.292 9.504 5.398
267 H CYS 40 H CYS 40 -5.559 10.135 5.472
268 HA CYS 40 HA CYS 40 -6.396 8.657 3.095
269 1HB CYS 40 1HB CYS 40 -6.440 7.200 5.115
270 2HB CYS 40 2HB CYS 40 -7.602 8.329 5.885
271 H ALA 41 H ALA 41 -7.327 10.022 1.903
272 HA ALA 41 HA ALA 41 -8.682 12.351 2.909
273 1HB ALA 41 1HB ALA 41 -8.838 11.133 0.112
274 2HB ALA 41 2HB ALA 41 -7.682 12.404 0.655
275 3HB ALA 41 3HB ALA 41 -9.446 12.750 0.612
276 H TYR 42 H TYR 42 -10.885 12.845 2.804
277 HA TYR 42 HA TYR 42 -12.352 10.824 4.068
278 1HB TYR 42 1HB TYR 42 -13.902 12.858 4.496
279 2HB TYR 42 2HB TYR 42 -12.165 12.988 4.972
280 HD1 TYR 42 HD1 TYR 42 -11.608 15.271 4.833
281 HD2 TYR 42 HD2 TYR 42 -13.860 13.587 1.546
282 HE1 TYR 42 HE1 TYR 42 -11.476 17.385 3.611
283 HE2 TYR 42 HE2 TYR 42 -13.645 15.668 0.331
284 HH TYR 42 HH TYR 42 -12.775 17.766 0.302
285 H SER 43 H SER 43 -12.040 10.922 1.082
286 HA SER 43 HA SER 43 -14.381 11.413 -0.266
287 1HB SER 43 1HB SER 43 -12.276 9.333 -1.057
288 2HB SER 43 2HB SER 43 -13.370 10.280 -2.158
289 HG SER 43 HG SER 43 -11.435 11.226 -2.207
290 H ASN 44 H ASN 44 -15.180 9.506 -1.843
291 HA ASN 44 HA ASN 44 -15.961 7.176 -0.311
292 1HB ASN 44 1HB ASN 44 -17.605 9.016 0.045
293 2HB ASN 44 2HB ASN 44 -17.849 9.150 -1.713
294 1HD2 ASN 44 1HD2 ASN 44 -18.781 7.066 -2.810
295 2HD2 ASN 44 2HD2 ASN 44 -19.778 6.036 -1.847
296 HA PRO 45 HA PRO 45 -15.296 5.314 -0.651
297 1HB PRO 45 1HB PRO 45 -13.430 3.562 -1.670
298 2HB PRO 45 2HB PRO 45 -15.161 3.380 -2.001
299 1HG PRO 45 1HG PRO 45 -13.085 4.754 -3.777
300 2HG PRO 45 2HG PRO 45 -14.272 3.504 -4.263
301 1HD PRO 45 1HD PRO 45 -14.665 6.257 -4.579
302 2HD PRO 45 2HD PRO 45 -16.062 5.128 -4.277
303 HA PRO 46 HA PRO 46 -12.096 7.937 0.527
304 1HB PRO 46 1HB PRO 46 -11.042 6.847 2.806
305 2HB PRO 46 2HB PRO 46 -12.794 7.273 2.693
306 1HG PRO 46 1HG PRO 46 -11.521 4.546 2.125
307 2HG PRO 46 2HG PRO 46 -12.837 4.940 3.330
308 1HD PRO 46 1HD PRO 46 -13.402 4.032 0.770
309 2HD PRO 46 2HD PRO 46 -14.423 5.402 1.561
310 H GLN 47 H GLN 47 -9.652 8.280 0.935
311 HA GLN 47 HA GLN 47 -8.322 6.455 -0.997
312 1HB GLN 47 1HB GLN 47 -7.665 9.398 -0.450
313 2HB GLN 47 2HB GLN 47 -6.974 8.370 -1.742
314 1HG GLN 47 1HG GLN 47 -9.983 9.139 -1.576
315 2HG GLN 47 2HG GLN 47 -8.750 10.107 -2.450
316 1HE2 GLN 47 1HE2 GLN 47 -7.479 8.934 -4.181
317 2HE2 GLN 47 2HE2 GLN 47 -8.287 7.686 -5.088
318 H CYS 48 H CYS 48 -7.953 5.123 1.028
319 HA CYS 48 HA CYS 48 -6.032 6.339 2.857
320 1HB CYS 48 1HB CYS 48 -7.157 3.518 2.994
321 2HB CYS 48 2HB CYS 48 -6.027 4.278 4.157
322 H GLN 49 H GLN 49 -4.017 6.431 2.600
323 HA GLN 49 HA GLN 49 -2.661 4.499 0.853
324 1HB GLN 49 1HB GLN 49 -2.677 7.536 1.125
325 2HB GLN 49 2HB GLN 49 -1.272 6.712 0.330
326 1HG GLN 49 1HG GLN 49 -2.685 5.814 -1.451
327 2HG GLN 49 2HG GLN 49 -4.194 6.360 -0.631
328 1HE2 GLN 49 1HE2 GLN 49 -4.339 8.743 -0.188
329 2HE2 GLN 49 2HE2 GLN 49 -3.696 9.852 -1.374
330 H CYS 50 H CYS 50 -0.860 3.669 1.603
331 HA CYS 50 HA CYS 50 0.268 4.623 4.138
332 1HB CYS 50 1HB CYS 50 0.033 2.117 3.717
333 2HB CYS 50 2HB CYS 50 1.136 2.282 2.321
334 H TYR 51 H TYR 51 1.074 6.577 3.715
335 HA TYR 51 HA TYR 51 2.844 7.309 1.642
336 1HB TYR 51 1HB TYR 51 1.973 8.504 4.289
337 2HB TYR 51 2HB TYR 51 3.536 9.060 3.656
338 HD1 TYR 51 HD1 TYR 51 -0.091 8.587 2.644
339 HD2 TYR 51 HD2 TYR 51 3.630 10.609 1.759
340 HE1 TYR 51 HE1 TYR 51 -1.233 10.033 1.075
341 HE2 TYR 51 HE2 TYR 51 2.506 12.009 0.207
342 HH TYR 51 HH TYR 51 0.576 12.416 -0.951
343 H ASP 52 H ASP 52 3.450 6.143 4.890
344 HA ASP 52 HA ASP 52 6.330 6.365 4.391
345 1HB ASP 52 1HB ASP 52 4.762 5.845 6.948
346 2HB ASP 52 2HB ASP 52 6.503 5.465 6.839
347 HD2 ASP 52 HD2 ASP 52 7.074 8.650 7.816
348 H THR 53 H THR 53 7.351 4.964 3.395
349 HA THR 53 HA THR 53 7.163 2.157 4.005
350 HB THR 53 HB THR 53 5.592 2.309 2.137
351 HG1 THR 53 HG1 THR 53 6.700 1.043 0.625
352 1HG2 THR 53 1HG2 THR 53 6.313 3.215 -0.077
353 2HG2 THR 53 2HG2 THR 53 7.893 3.721 0.604
354 3HG2 THR 53 3HG2 THR 53 6.365 4.493 1.158
355 H HIS 54 H HIS 54 9.050 1.170 2.877
356 HA HIS 54 HA HIS 54 11.289 2.901 2.460
357 1HB HIS 54 1HB HIS 54 11.231 2.780 5.030
358 2HB HIS 54 2HB HIS 54 11.583 1.029 4.901
359 HD1 HIS 54 HD1 HIS 54 13.262 3.319 6.192
360 HD2 HIS 54 HD2 HIS 54 14.095 1.653 2.438
361 HE1 HIS 54 HE1 HIS 54 15.672 3.764 5.722
362 HE2 HIS 54 HE2 HIS 54 16.169 2.753 3.433
363 H LYS 55 H LYS 55 10.416 -0.443 3.403
364 HA LYS 55 HA LYS 55 12.324 -1.676 1.867
365 1HB LYS 55 1HB LYS 55 9.677 -2.480 3.161
366 2HB LYS 55 2HB LYS 55 10.807 -3.712 2.466
367 1HG LYS 55 1HG LYS 55 12.462 -3.319 4.101
368 2HG LYS 55 2HG LYS 55 11.827 -1.706 4.535
369 1HD LYS 55 1HD LYS 55 9.727 -2.806 5.468
370 2HD LYS 55 2HD LYS 55 10.503 -4.404 5.189
371 1HE LYS 55 1HE LYS 55 10.790 -3.677 7.552
372 2HE LYS 55 2HE LYS 55 12.397 -3.727 6.719
373 1HZ LYS 55 1HZ LYS 55 10.743 -1.283 7.140
374 2HZ LYS 55 2HZ LYS 55 12.276 -1.361 6.418
375 3HZ LYS 55 3HZ LYS 55 12.095 -1.743 8.063
376 H PHE 56 H PHE 56 9.266 -3.112 1.026
377 HA PHE 56 HA PHE 56 9.513 -2.258 -1.736
378 1HB PHE 56 1HB PHE 56 10.077 -4.649 -2.487
379 2HB PHE 56 2HB PHE 56 11.393 -3.792 -1.647
380 HD1 PHE 56 HD1 PHE 56 8.736 -6.390 -1.239
381 HD2 PHE 56 HD2 PHE 56 12.252 -4.577 0.473
382 HE1 PHE 56 HE1 PHE 56 8.876 -8.203 0.404
383 HE2 PHE 56 HE2 PHE 56 12.380 -6.388 2.124
384 HZ PHE 56 HZ PHE 56 10.698 -8.216 2.110
385 H CYS 57 H CYS 57 8.003 -4.114 -3.065
386 HA CYS 57 HA CYS 57 5.468 -3.457 -1.931
387 1HB CYS 57 1HB CYS 57 6.127 -5.159 -4.384
388 2HB CYS 57 2HB CYS 57 4.572 -4.329 -4.041
389 H TYR 58 H TYR 58 4.222 -4.706 -0.677
390 HA TYR 58 HA TYR 58 5.021 -7.320 0.049
391 1HB TYR 58 1HB TYR 58 3.325 -5.490 1.202
392 2HB TYR 58 2HB TYR 58 2.117 -6.583 0.452
393 HD1 TYR 58 HD1 TYR 58 1.637 -8.732 1.606
394 HD2 TYR 58 HD2 TYR 58 5.083 -6.383 2.686
395 HE1 TYR 58 HE1 TYR 58 1.995 -10.145 3.528
396 HE2 TYR 58 HE2 TYR 58 5.421 -7.775 4.632
397 HH TYR 58 HH TYR 58 4.730 -9.696 5.814
398 H LYS 59 H LYS 59 3.689 -9.166 0.021
399 HA LYS 59 HA LYS 59 2.704 -10.220 -2.360
400 1HB LYS 59 1HB LYS 59 2.175 -10.904 0.556
401 2HB LYS 59 2HB LYS 59 1.541 -11.888 -0.799
402 1HG LYS 59 1HG LYS 59 3.684 -12.572 -1.538
403 2HG LYS 59 2HG LYS 59 4.553 -11.295 -0.656
404 1HD LYS 59 1HD LYS 59 3.023 -13.528 0.808
405 2HD LYS 59 2HD LYS 59 4.739 -13.656 0.284
406 1HE LYS 59 1HE LYS 59 5.315 -11.593 1.627
407 2HE LYS 59 2HE LYS 59 3.621 -11.573 2.267
408 1HZ LYS 59 1HZ LYS 59 3.980 -13.718 3.212
409 2HZ LYS 59 2HZ LYS 59 5.205 -12.657 3.722
410 3HZ LYS 59 3HZ LYS 59 5.536 -13.827 2.536
411 H ALA 60 H ALA 60 0.547 -10.881 -2.948
412 HA ALA 60 HA ALA 60 -0.834 -8.501 -3.206
413 1HB ALA 60 1HB ALA 60 -1.615 -11.300 -4.092
414 2HB ALA 60 2HB ALA 60 -0.557 -10.157 -4.984
415 3HB ALA 60 3HB ALA 60 -2.302 -9.764 -4.751
416 H CYS 61 H CYS 61 -2.882 -7.906 -3.014
417 HA CYS 61 HA CYS 61 -4.177 -8.755 -0.518
418 1HB CYS 61 1HB CYS 61 -3.005 -6.404 -0.991
419 2HB CYS 61 2HB CYS 61 -4.492 -6.003 -1.862
420 H HIS 62 H HIS 62 -4.770 -10.118 -2.930
421 HA HIS 62 HA HIS 62 -7.496 -9.173 -3.577
422 1HB HIS 62 1HB HIS 62 -5.962 -11.565 -4.699
423 2HB HIS 62 2HB HIS 62 -7.624 -11.092 -5.134
424 HD1 HIS 62 HD1 HIS 62 -6.349 -11.108 -7.515
425 HD2 HIS 62 HD2 HIS 62 -5.527 -7.865 -4.982
426 HE1 HIS 62 HE1 HIS 62 -5.350 -9.295 -8.942
427 HE2 HIS 62 HE2 HIS 62 -4.837 -7.358 -7.404
428 H ASN 63 H ASN 63 -9.207 -10.014 -2.427
429 HA ASN 63 HA ASN 63 -9.512 -12.528 -1.593
430 1HB ASN 63 1HB ASN 63 -9.496 -12.397 0.905
431 2HB ASN 63 2HB ASN 63 -7.915 -12.543 0.095
432 1HD2 ASN 63 1HD2 ASN 63 -6.599 -10.422 -0.091
433 2HD2 ASN 63 2HD2 ASN 63 -6.791 -9.263 1.196
434 H SER 64 H SER 64 -11.148 -11.572 -2.880
435 HA SER 64 HA SER 64 -13.322 -10.600 -1.071
436 1HB SER 64 1HB SER 64 -12.725 -8.933 -2.857
437 2HB SER 64 2HB SER 64 -13.229 -10.134 -4.094
438 HG SER 64 HG SER 64 -14.820 -8.533 -3.310
439 H GLU 65 H GLU 65 -13.130 -12.893 -0.574
440 HA GLU 65 HA GLU 65 -13.839 -14.956 -2.213
441 1HB GLU 65 1HB GLU 65 -14.161 -16.279 -0.200
442 2HB GLU 65 2HB GLU 65 -12.779 -15.175 -0.035
443 1HG GLU 65 1HG GLU 65 -14.782 -13.630 1.168
444 2HG GLU 65 2HG GLU 65 -15.406 -15.273 1.487
445 HE2 GLU 65 HE2 GLU 65 -13.565 -12.927 2.650
446 H ILE 66 H ILE 66 -15.861 -12.624 -0.953
447 HA ILE 66 HA ILE 66 -18.264 -13.590 -2.268
448 HB ILE 66 HB ILE 66 -18.328 -12.981 0.751
449 1HG1 ILE 66 1HG1 ILE 66 -18.754 -15.731 -0.526
450 2HG1 ILE 66 2HG1 ILE 66 -17.253 -15.218 0.304
451 1HG2 ILE 66 1HG2 ILE 66 -20.473 -14.028 -1.234
452 2HG2 ILE 66 2HG2 ILE 66 -20.382 -12.334 -0.637
453 3HG2 ILE 66 3HG2 ILE 66 -20.717 -13.662 0.508
454 1HD1 ILE 66 1HD1 ILE 66 -18.584 -16.445 1.915
455 2HD1 ILE 66 2HD1 ILE 66 -20.021 -15.401 1.629
456 3HD1 ILE 66 3HD1 ILE 66 -18.545 -14.716 2.400
457 H GLU 67 H GLU 67 -17.200 -11.306 0.357
458 HA GLU 67 HA GLU 67 -17.279 -9.073 -1.394
459 1HB GLU 67 1HB GLU 67 -18.464 -9.174 1.465
460 2HB GLU 67 2HB GLU 67 -18.035 -7.663 0.596
461 1HG GLU 67 1HG GLU 67 -19.798 -8.151 -1.147
462 2HG GLU 67 2HG GLU 67 -20.255 -9.649 -0.260
463 HE2 GLU 67 HE2 GLU 67 -22.510 -7.048 0.809
Start of MODEL 6
1 1H GLY 1 1H GLY 1 -1.984 -21.641 5.384
2 2H GLY 1 2H GLY 1 -3.031 -20.465 4.751
3 3H GLY 1 3H GLY 1 -1.770 -20.006 5.792
4 1HA GLY 1 1HA GLY 1 -0.145 -20.725 4.221
5 2HA GLY 1 2HA GLY 1 -1.500 -21.144 3.092
6 H ASP 2 H ASP 2 -3.084 -19.270 2.751
7 HA ASP 2 HA ASP 2 -2.099 -16.570 3.081
8 1HB ASP 2 1HB ASP 2 -2.344 -17.909 0.297
9 2HB ASP 2 2HB ASP 2 -2.478 -16.123 0.510
10 HD2 ASP 2 HD2 ASP 2 -0.859 -15.165 1.747
11 H ASP 3 H ASP 3 -3.976 -17.220 4.414
12 HA ASP 3 HA ASP 3 -6.383 -16.118 3.277
13 1HB ASP 3 1HB ASP 3 -7.784 -17.992 4.179
14 2HB ASP 3 2HB ASP 3 -6.761 -18.473 2.785
15 HD2 ASP 3 HD2 ASP 3 -6.557 -20.621 5.963
16 H VAL 4 H VAL 4 -5.156 -14.544 4.560
17 HA VAL 4 HA VAL 4 -5.736 -14.605 7.395
18 HB VAL 4 HB VAL 4 -3.655 -15.780 7.143
19 1HG1 VAL 4 1HG1 VAL 4 -2.807 -14.975 4.962
20 2HG1 VAL 4 2HG1 VAL 4 -1.586 -14.648 6.225
21 3HG1 VAL 4 3HG1 VAL 4 -2.602 -13.306 5.611
22 1HG2 VAL 4 1HG2 VAL 4 -3.919 -14.237 9.127
23 2HG2 VAL 4 2HG2 VAL 4 -3.090 -12.923 8.209
24 3HG2 VAL 4 3HG2 VAL 4 -2.206 -14.417 8.633
25 H LYS 5 H LYS 5 -5.766 -12.495 8.293
26 HA LYS 5 HA LYS 5 -6.042 -10.357 6.364
27 1HB LYS 5 1HB LYS 5 -6.617 -10.593 9.352
28 2HB LYS 5 2HB LYS 5 -6.838 -9.067 8.445
29 1HG LYS 5 1HG LYS 5 -8.306 -11.703 7.796
30 2HG LYS 5 2HG LYS 5 -8.952 -10.341 8.766
31 1HD LYS 5 1HD LYS 5 -9.776 -9.495 6.848
32 2HD LYS 5 2HD LYS 5 -8.112 -8.981 6.492
33 1HE LYS 5 1HE LYS 5 -9.005 -10.067 4.501
34 2HE LYS 5 2HE LYS 5 -7.803 -11.224 5.202
35 1HZ LYS 5 1HZ LYS 5 -10.745 -11.302 5.607
36 2HZ LYS 5 2HZ LYS 5 -9.616 -12.411 6.215
37 3HZ LYS 5 3HZ LYS 5 -9.854 -12.278 4.538
38 H SER 6 H SER 6 -3.663 -11.203 6.364
39 HA SER 6 HA SER 6 -1.694 -9.583 7.654
40 1HB SER 6 1HB SER 6 -0.153 -10.278 5.827
41 2HB SER 6 2HB SER 6 -1.096 -11.659 6.451
42 HG SER 6 HG SER 6 -1.571 -10.191 4.047
43 H ALA 7 H ALA 7 -0.256 -7.983 6.299
44 HA ALA 7 HA ALA 7 -1.839 -5.939 5.104
45 1HB ALA 7 1HB ALA 7 1.165 -6.557 4.796
46 2HB ALA 7 2HB ALA 7 0.468 -5.579 6.130
47 3HB ALA 7 3HB ALA 7 0.374 -4.975 4.436
48 H CYS 8 H CYS 8 -1.856 -5.266 2.946
49 HA CYS 8 HA CYS 8 -1.330 -7.356 0.879
50 1HB CYS 8 1HB CYS 8 -3.640 -5.359 1.094
51 2HB CYS 8 2HB CYS 8 -3.216 -6.220 -0.414
52 H CYS 9 H CYS 9 -0.251 -6.595 -1.045
53 HA CYS 9 HA CYS 9 -0.312 -3.686 -1.454
54 1HB CYS 9 1HB CYS 9 1.800 -4.424 -0.173
55 2HB CYS 9 2HB CYS 9 2.241 -5.358 -1.628
56 H ASP 10 H ASP 10 -1.783 -4.067 -3.312
57 HA ASP 10 HA ASP 10 -0.934 -6.022 -5.284
58 1HB ASP 10 1HB ASP 10 -3.015 -5.006 -6.547
59 2HB ASP 10 2HB ASP 10 -3.227 -6.099 -5.211
60 HD2 ASP 10 HD2 ASP 10 -4.904 -2.615 -5.074
61 H THR 11 H THR 11 -1.955 -2.664 -5.928
62 HA THR 11 HA THR 11 0.153 -2.358 -7.840
63 HB THR 11 HB THR 11 -1.579 -0.161 -6.620
64 HG1 THR 11 HG1 THR 11 -2.999 -0.638 -8.300
65 1HG2 THR 11 1HG2 THR 11 -0.434 -0.490 -9.485
66 2HG2 THR 11 2HG2 THR 11 0.399 0.468 -8.227
67 3HG2 THR 11 3HG2 THR 11 -1.236 0.956 -8.785
68 H CYS 12 H CYS 12 2.152 -1.568 -7.571
69 HA CYS 12 HA CYS 12 2.964 -0.218 -5.133
70 1HB CYS 12 1HB CYS 12 2.781 -2.743 -4.731
71 2HB CYS 12 2HB CYS 12 3.980 -2.961 -6.061
72 H LEU 13 H LEU 13 5.063 0.600 -5.245
73 HA LEU 13 HA LEU 13 6.402 0.560 -7.849
74 1HB LEU 13 1HB LEU 13 4.462 2.113 -7.958
75 2HB LEU 13 2HB LEU 13 5.000 2.983 -6.518
76 HG LEU 13 HG LEU 13 6.968 2.712 -8.837
77 1HD1 LEU 13 1HD1 LEU 13 4.472 4.487 -9.110
78 2HD1 LEU 13 2HD1 LEU 13 4.811 2.970 -10.026
79 3HD1 LEU 13 3HD1 LEU 13 5.876 4.404 -10.238
80 1HD2 LEU 13 1HD2 LEU 13 6.091 5.191 -7.219
81 2HD2 LEU 13 2HD2 LEU 13 7.456 5.096 -8.392
82 3HD2 LEU 13 3HD2 LEU 13 7.533 4.164 -6.851
83 H CYS 14 H CYS 14 8.449 1.412 -7.770
84 HA CYS 14 HA CYS 14 9.630 1.911 -5.155
85 1HB CYS 14 1HB CYS 14 9.641 -0.607 -6.615
86 2HB CYS 14 2HB CYS 14 11.252 0.079 -6.824
87 H THR 15 H THR 15 11.548 2.975 -5.203
88 HA THR 15 HA THR 15 11.766 4.687 -7.537
89 HB THR 15 HB THR 15 13.522 5.901 -6.347
90 HG1 THR 15 HG1 THR 15 13.229 5.066 -3.920
91 1HG2 THR 15 1HG2 THR 15 10.992 5.284 -4.639
92 2HG2 THR 15 2HG2 THR 15 11.033 6.350 -6.085
93 3HG2 THR 15 3HG2 THR 15 11.973 6.795 -4.616
94 H ARG 16 H ARG 16 13.554 5.108 -8.865
95 HA ARG 16 HA ARG 16 15.574 3.039 -9.073
96 1HB ARG 16 1HB ARG 16 15.250 5.698 -10.537
97 2HB ARG 16 2HB ARG 16 16.610 4.546 -10.783
98 1HG ARG 16 1HG ARG 16 15.014 2.777 -11.474
99 2HG ARG 16 2HG ARG 16 13.658 3.947 -11.302
100 1HD ARG 16 1HD ARG 16 14.886 5.455 -13.038
101 2HD ARG 16 2HD ARG 16 16.046 4.089 -13.275
102 HE ARG 16 HE ARG 16 14.353 2.824 -14.326
103 1HH1 ARG 16 1HH1 ARG 16 12.963 5.839 -13.007
104 2HH1 ARG 16 2HH1 ARG 16 11.390 5.558 -13.690
105 1HH2 ARG 16 1HH2 ARG 16 12.251 2.470 -15.201
106 2HH2 ARG 16 2HH2 ARG 16 10.975 3.616 -14.935
107 H SER 17 H SER 17 17.034 3.034 -7.425
108 HA SER 17 HA SER 17 18.583 5.254 -6.656
109 1HB SER 17 1HB SER 17 16.235 5.849 -5.641
110 2HB SER 17 2HB SER 17 16.454 4.433 -4.574
111 HG SER 17 HG SER 17 17.147 6.505 -3.702
112 H GLN 18 H GLN 18 18.891 4.428 -3.984
113 HA GLN 18 HA GLN 18 19.951 1.694 -4.130
114 1HB GLN 18 1HB GLN 18 21.540 3.173 -5.335
115 2HB GLN 18 2HB GLN 18 21.557 4.297 -3.950
116 1HG GLN 18 1HG GLN 18 22.621 2.477 -2.504
117 2HG GLN 18 2HG GLN 18 22.631 1.371 -3.927
118 1HE2 GLN 18 1HE2 GLN 18 23.893 2.156 -5.854
119 2HE2 GLN 18 2HE2 GLN 18 25.294 3.172 -5.563
120 HA PRO 19 HA PRO 19 18.999 0.292 -2.964
121 1HB PRO 19 1HB PRO 19 17.379 -0.728 -0.988
122 2HB PRO 19 2HB PRO 19 19.203 -0.798 -0.850
123 1HG PRO 19 1HG PRO 19 17.324 1.322 0.344
124 2HG PRO 19 2HG PRO 19 18.559 0.337 1.226
125 1HD PRO 19 1HD PRO 19 19.062 2.884 0.244
126 2HD PRO 19 2HD PRO 19 20.363 1.609 0.249
127 HA PRO 20 HA PRO 20 15.220 2.241 -4.294
128 1HB PRO 20 1HB PRO 20 13.618 0.168 -5.165
129 2HB PRO 20 2HB PRO 20 15.143 0.651 -5.999
130 1HG PRO 20 1HG PRO 20 14.813 -1.590 -3.937
131 2HG PRO 20 2HG PRO 20 15.563 -1.691 -5.588
132 1HD PRO 20 1HD PRO 20 17.086 -1.309 -3.319
133 2HD PRO 20 2HD PRO 20 17.489 -0.424 -4.871
134 H THR 21 H THR 21 13.824 3.251 -3.038
135 HA THR 21 HA THR 21 12.611 2.010 -0.688
136 HB THR 21 HB THR 21 11.405 4.354 -0.635
137 HG1 THR 21 HG1 THR 21 12.648 5.929 -1.557
138 1HG2 THR 21 1HG2 THR 21 14.448 4.059 -0.187
139 2HG2 THR 21 2HG2 THR 21 13.156 3.513 0.955
140 3HG2 THR 21 3HG2 THR 21 13.359 5.265 0.600
141 H CYS 22 H CYS 22 10.294 1.873 -0.369
142 HA CYS 22 HA CYS 22 8.868 1.628 -2.960
143 1HB CYS 22 1HB CYS 22 10.213 -0.543 -1.580
144 2HB CYS 22 2HB CYS 22 8.490 -0.800 -1.345
145 H ARG 23 H ARG 23 6.698 0.975 -2.797
146 HA ARG 23 HA ARG 23 5.228 1.902 -0.483
147 1HB ARG 23 1HB ARG 23 6.580 3.893 -1.428
148 2HB ARG 23 2HB ARG 23 5.704 3.664 -2.962
149 1HG ARG 23 1HG ARG 23 3.551 4.187 -1.778
150 2HG ARG 23 2HG ARG 23 4.470 4.460 -0.242
151 1HD ARG 23 1HD ARG 23 5.753 6.313 -1.379
152 2HD ARG 23 2HD ARG 23 4.823 5.963 -2.915
153 HE ARG 23 HE ARG 23 3.087 6.439 -0.600
154 1HH1 ARG 23 1HH1 ARG 23 5.020 8.125 -3.095
155 2HH1 ARG 23 2HH1 ARG 23 4.053 9.553 -3.065
156 1HH2 ARG 23 1HH2 ARG 23 1.783 8.223 -0.635
157 2HH2 ARG 23 2HH2 ARG 23 2.119 9.627 -1.607
158 H CYS 24 H CYS 24 3.213 1.246 -0.696
159 HA CYS 24 HA CYS 24 2.191 0.188 -3.233
160 1HB CYS 24 1HB CYS 24 0.732 0.438 -0.550
161 2HB CYS 24 2HB CYS 24 0.293 -0.645 -1.916
162 H VAL 25 H VAL 25 0.150 1.038 -4.011
163 HA VAL 25 HA VAL 25 -0.474 3.867 -3.677
164 HB VAL 25 HB VAL 25 0.382 4.214 -6.050
165 1HG1 VAL 25 1HG1 VAL 25 2.756 4.496 -5.640
166 2HG1 VAL 25 2HG1 VAL 25 2.753 3.343 -4.286
167 3HG1 VAL 25 3HG1 VAL 25 1.894 4.932 -4.103
168 1HG2 VAL 25 1HG2 VAL 25 2.055 2.550 -6.956
169 2HG2 VAL 25 2HG2 VAL 25 0.430 1.810 -6.757
170 3HG2 VAL 25 3HG2 VAL 25 1.719 1.473 -5.550
171 H ASP 26 H ASP 26 -1.947 1.597 -3.411
172 HA ASP 26 HA ASP 26 -4.057 2.359 -5.236
173 1HB ASP 26 1HB ASP 26 -3.632 -0.026 -5.781
174 2HB ASP 26 2HB ASP 26 -3.506 -0.428 -4.026
175 HD2 ASP 26 HD2 ASP 26 -7.233 0.585 -4.941
176 H VAL 27 H VAL 27 -5.710 3.226 -3.964
177 HA VAL 27 HA VAL 27 -5.086 3.568 -1.151
178 HB VAL 27 HB VAL 27 -6.631 5.232 -1.002
179 1HG1 VAL 27 1HG1 VAL 27 -5.818 6.806 -2.663
180 2HG1 VAL 27 2HG1 VAL 27 -5.501 5.498 -3.862
181 3HG1 VAL 27 3HG1 VAL 27 -4.501 5.610 -2.369
182 1HG2 VAL 27 1HG2 VAL 27 -7.794 4.188 -3.664
183 2HG2 VAL 27 2HG2 VAL 27 -8.173 5.815 -2.985
184 3HG2 VAL 27 3HG2 VAL 27 -8.623 4.333 -2.059
185 H ARG 28 H ARG 28 -6.202 2.875 0.555
186 HA ARG 28 HA ARG 28 -8.266 0.798 -0.033
187 1HB ARG 28 1HB ARG 28 -6.008 0.909 2.006
188 2HB ARG 28 2HB ARG 28 -7.431 -0.176 2.239
189 1HG ARG 28 1HG ARG 28 -5.672 -1.493 1.376
190 2HG ARG 28 2HG ARG 28 -6.963 -1.354 0.122
191 1HD ARG 28 1HD ARG 28 -5.624 0.217 -1.190
192 2HD ARG 28 2HD ARG 28 -4.368 0.345 0.097
193 HE ARG 28 HE ARG 28 -4.903 -1.904 -1.810
194 1HH1 ARG 28 1HH1 ARG 28 -3.085 -0.792 1.068
195 2HH1 ARG 28 2HH1 ARG 28 -1.929 -2.085 0.991
196 1HH2 ARG 28 1HH2 ARG 28 -3.391 -3.618 -1.862
197 2HH2 ARG 28 2HH2 ARG 28 -2.109 -3.705 -0.683
198 H GLU 29 H GLU 29 -9.712 0.355 1.752
199 HA GLU 29 HA GLU 29 -11.113 2.497 2.779
200 1HB GLU 29 1HB GLU 29 -10.850 -0.443 3.396
201 2HB GLU 29 2HB GLU 29 -11.984 0.552 4.363
202 1HG GLU 29 1HG GLU 29 -13.263 1.239 2.353
203 2HG GLU 29 2HG GLU 29 -12.112 0.372 1.271
204 HE2 GLU 29 HE2 GLU 29 -14.924 -1.596 3.264
205 H SER 30 H SER 30 -8.343 0.980 4.029
206 HA SER 30 HA SER 30 -8.317 2.642 6.434
207 1HB SER 30 1HB SER 30 -8.441 -0.456 6.499
208 2HB SER 30 2HB SER 30 -7.941 0.510 7.925
209 HG SER 30 HG SER 30 -10.108 -0.069 7.986
210 H CYS 31 H CYS 31 -6.438 2.050 7.869
211 HA CYS 31 HA CYS 31 -4.024 1.751 6.277
212 1HB CYS 31 1HB CYS 31 -4.534 3.447 8.218
213 2HB CYS 31 2HB CYS 31 -4.262 2.028 9.320
214 H HIS 32 H HIS 32 -2.285 0.240 7.047
215 HA HIS 32 HA HIS 32 -3.151 -1.882 8.842
216 1HB HIS 32 1HB HIS 32 -3.071 -2.893 6.541
217 2HB HIS 32 2HB HIS 32 -1.313 -2.425 6.459
218 HD1 HIS 32 HD1 HIS 32 -3.782 -4.831 7.653
219 HD2 HIS 32 HD2 HIS 32 0.270 -4.135 8.473
220 HE1 HIS 32 HE1 HIS 32 -2.935 -6.839 8.850
221 HE2 HIS 32 HE2 HIS 32 -0.458 -6.409 9.342
222 H SER 33 H SER 33 -1.501 -2.459 10.211
223 HA SER 33 HA SER 33 0.068 -0.474 11.146
224 1HB SER 33 1HB SER 33 0.507 -3.493 11.605
225 2HB SER 33 2HB SER 33 1.005 -2.178 12.734
226 HG SER 33 HG SER 33 -0.865 -2.720 13.530
227 H ALA 34 H ALA 34 0.981 -1.910 8.361
228 HA ALA 34 HA ALA 34 3.828 -2.013 8.790
229 1HB ALA 34 1HB ALA 34 3.834 -2.671 6.353
230 2HB ALA 34 2HB ALA 34 2.064 -2.311 6.268
231 3HB ALA 34 3HB ALA 34 2.667 -3.672 7.280
232 H CYS 35 H CYS 35 1.544 0.401 8.153
233 HA CYS 35 HA CYS 35 3.390 2.071 6.584
234 1HB CYS 35 1HB CYS 35 1.091 1.685 5.671
235 2HB CYS 35 2HB CYS 35 0.408 2.380 7.208
236 H ASP 36 H ASP 36 4.101 4.082 7.359
237 HA ASP 36 HA ASP 36 3.770 4.547 10.204
238 1HB ASP 36 1HB ASP 36 5.995 4.698 8.988
239 2HB ASP 36 2HB ASP 36 5.386 6.112 8.097
240 HD2 ASP 36 HD2 ASP 36 5.748 8.242 10.713
241 H LYS 37 H LYS 37 2.907 6.354 7.166
242 HA LYS 37 HA LYS 37 1.186 8.081 8.794
243 1HB LYS 37 1HB LYS 37 3.402 9.127 7.935
244 2HB LYS 37 2HB LYS 37 2.777 8.875 6.304
245 1HG LYS 37 1HG LYS 37 2.199 11.111 6.774
246 2HG LYS 37 2HG LYS 37 0.666 10.234 7.073
247 1HD LYS 37 1HD LYS 37 1.173 10.246 9.566
248 2HD LYS 37 2HD LYS 37 2.740 11.029 9.216
249 1HE LYS 37 1HE LYS 37 1.226 12.758 9.997
250 2HE LYS 37 2HE LYS 37 1.471 13.033 8.229
251 1HZ LYS 37 1HZ LYS 37 -0.821 11.619 9.489
252 2HZ LYS 37 2HZ LYS 37 -0.616 11.921 7.826
253 3HZ LYS 37 3HZ LYS 37 -0.819 13.215 8.906
254 H CYS 38 H CYS 38 -0.670 6.891 8.387
255 HA CYS 38 HA CYS 38 -1.568 6.539 5.629
256 1HB CYS 38 1HB CYS 38 -2.360 5.703 8.408
257 2HB CYS 38 2HB CYS 38 -3.676 5.732 7.183
258 H VAL 39 H VAL 39 -2.334 8.353 4.587
259 HA VAL 39 HA VAL 39 -3.987 10.207 6.161
260 HB VAL 39 HB VAL 39 -2.592 10.378 3.486
261 1HG1 VAL 39 1HG1 VAL 39 -4.168 12.435 5.155
262 2HG1 VAL 39 2HG1 VAL 39 -4.587 11.828 3.494
263 3HG1 VAL 39 3HG1 VAL 39 -3.109 12.831 3.747
264 1HG2 VAL 39 1HG2 VAL 39 -1.987 11.568 6.271
265 2HG2 VAL 39 2HG2 VAL 39 -1.154 12.053 4.755
266 3HG2 VAL 39 3HG2 VAL 39 -0.968 10.365 5.380
267 H CYS 40 H CYS 40 -6.098 9.380 6.086
268 HA CYS 40 HA CYS 40 -7.098 8.297 3.580
269 1HB CYS 40 1HB CYS 40 -8.417 8.564 6.272
270 2HB CYS 40 2HB CYS 40 -9.032 7.651 4.888
271 H ALA 41 H ALA 41 -7.898 9.579 2.109
272 HA ALA 41 HA ALA 41 -9.175 12.068 2.841
273 1HB ALA 41 1HB ALA 41 -9.914 12.326 0.579
274 2HB ALA 41 2HB ALA 41 -9.507 10.612 0.187
275 3HB ALA 41 3HB ALA 41 -8.196 11.788 0.575
276 H TYR 42 H TYR 42 -11.389 12.583 2.705
277 HA TYR 42 HA TYR 42 -12.814 10.803 4.317
278 1HB TYR 42 1HB TYR 42 -14.377 12.839 4.487
279 2HB TYR 42 2HB TYR 42 -12.648 13.047 4.944
280 HD1 TYR 42 HD1 TYR 42 -15.021 13.480 2.028
281 HD2 TYR 42 HD2 TYR 42 -11.309 14.694 3.859
282 HE1 TYR 42 HE1 TYR 42 -14.790 15.288 0.385
283 HE2 TYR 42 HE2 TYR 42 -11.090 16.491 2.225
284 HH TYR 42 HH TYR 42 -13.621 17.080 -0.279
285 H SER 43 H SER 43 -12.675 10.604 1.319
286 HA SER 43 HA SER 43 -15.031 10.709 -0.046
287 1HB SER 43 1HB SER 43 -12.636 8.807 -0.339
288 2HB SER 43 2HB SER 43 -13.779 9.202 -1.675
289 HG SER 43 HG SER 43 -11.898 10.467 -1.759
290 H ASN 44 H ASN 44 -15.422 8.384 -1.437
291 HA ASN 44 HA ASN 44 -16.444 6.385 0.418
292 1HB ASN 44 1HB ASN 44 -18.106 8.168 -0.153
293 2HB ASN 44 2HB ASN 44 -17.889 7.835 -1.879
294 1HD2 ASN 44 1HD2 ASN 44 -18.545 5.509 -2.609
295 2HD2 ASN 44 2HD2 ASN 44 -19.833 4.767 -1.736
296 HA PRO 45 HA PRO 45 -15.607 4.597 0.775
297 1HB PRO 45 1HB PRO 45 -13.600 2.688 0.516
298 2HB PRO 45 2HB PRO 45 -15.295 2.326 0.169
299 1HG PRO 45 1HG PRO 45 -13.146 3.188 -1.852
300 2HG PRO 45 2HG PRO 45 -14.210 1.737 -1.949
301 1HD PRO 45 1HD PRO 45 -14.885 4.045 -3.250
302 2HD PRO 45 2HD PRO 45 -16.174 3.111 -2.379
303 HA PRO 46 HA PRO 46 -12.443 7.434 1.513
304 1HB PRO 46 1HB PRO 46 -11.180 6.711 3.854
305 2HB PRO 46 2HB PRO 46 -12.930 7.190 3.795
306 1HG PRO 46 1HG PRO 46 -11.789 4.361 3.701
307 2HG PRO 46 2HG PRO 46 -13.046 5.029 4.833
308 1HD PRO 46 1HD PRO 46 -13.715 3.652 2.537
309 2HD PRO 46 2HD PRO 46 -14.686 5.169 3.058
310 H GLN 47 H GLN 47 -10.155 7.974 1.434
311 HA GLN 47 HA GLN 47 -8.805 5.846 -0.146
312 1HB GLN 47 1HB GLN 47 -8.662 8.877 -0.546
313 2HB GLN 47 2HB GLN 47 -7.839 7.628 -1.526
314 1HG GLN 47 1HG GLN 47 -10.060 6.740 -2.315
315 2HG GLN 47 2HG GLN 47 -10.916 7.878 -1.232
316 1HE2 GLN 47 1HE2 GLN 47 -8.274 8.200 -3.766
317 2HE2 GLN 47 2HE2 GLN 47 -9.059 9.504 -4.577
318 H CYS 48 H CYS 48 -7.760 5.002 1.611
319 HA CYS 48 HA CYS 48 -5.877 6.704 3.045
320 1HB CYS 48 1HB CYS 48 -6.277 3.711 3.293
321 2HB CYS 48 2HB CYS 48 -5.294 4.783 4.367
322 H GLN 49 H GLN 49 -4.073 7.322 2.233
323 HA GLN 49 HA GLN 49 -2.527 5.447 0.590
324 1HB GLN 49 1HB GLN 49 -2.684 8.486 0.778
325 2HB GLN 49 2HB GLN 49 -1.217 7.688 0.078
326 1HG GLN 49 1HG GLN 49 -2.727 6.461 -1.567
327 2HG GLN 49 2HG GLN 49 -4.099 7.498 -1.010
328 1HE2 GLN 49 1HE2 GLN 49 -3.348 9.963 -0.929
329 2HE2 GLN 49 2HE2 GLN 49 -2.497 10.514 -2.367
330 H CYS 50 H CYS 50 -0.461 5.042 1.078
331 HA CYS 50 HA CYS 50 0.444 5.793 3.780
332 1HB CYS 50 1HB CYS 50 0.481 3.314 2.932
333 2HB CYS 50 2HB CYS 50 1.774 3.827 1.809
334 H TYR 51 H TYR 51 1.038 7.842 3.599
335 HA TYR 51 HA TYR 51 2.491 8.960 1.480
336 1HB TYR 51 1HB TYR 51 1.608 9.891 4.209
337 2HB TYR 51 2HB TYR 51 3.040 10.735 3.546
338 HD1 TYR 51 HD1 TYR 51 2.878 12.089 1.428
339 HD2 TYR 51 HD2 TYR 51 -0.502 9.747 2.776
340 HE1 TYR 51 HE1 TYR 51 1.524 13.064 -0.270
341 HE2 TYR 51 HE2 TYR 51 -1.889 10.805 1.105
342 HH TYR 51 HH TYR 51 -0.493 13.050 -1.346
343 H ASP 52 H ASP 52 3.656 7.437 4.283
344 HA ASP 52 HA ASP 52 6.447 8.161 3.603
345 1HB ASP 52 1HB ASP 52 5.688 8.518 5.982
346 2HB ASP 52 2HB ASP 52 5.268 6.764 6.082
347 HD2 ASP 52 HD2 ASP 52 9.166 7.646 5.793
348 H THR 53 H THR 53 7.951 6.693 2.891
349 HA THR 53 HA THR 53 6.989 4.219 1.821
350 HB THR 53 HB THR 53 9.344 3.736 1.165
351 HG1 THR 53 HG1 THR 53 10.524 4.856 2.725
352 1HG2 THR 53 1HG2 THR 53 9.486 5.577 -0.485
353 2HG2 THR 53 2HG2 THR 53 8.365 6.596 0.477
354 3HG2 THR 53 3HG2 THR 53 7.770 5.084 -0.286
355 H HIS 54 H HIS 54 8.113 2.024 2.268
356 HA HIS 54 HA HIS 54 9.130 1.883 4.944
357 1HB HIS 54 1HB HIS 54 6.613 1.971 5.313
358 2HB HIS 54 2HB HIS 54 6.484 0.351 4.578
359 HD1 HIS 54 HD1 HIS 54 7.456 2.350 7.483
360 HD2 HIS 54 HD2 HIS 54 7.794 -1.703 6.467
361 HE1 HIS 54 HE1 HIS 54 8.034 1.121 9.576
362 HE2 HIS 54 HE2 HIS 54 8.235 -1.344 8.936
363 H LYS 55 H LYS 55 7.595 -0.715 2.954
364 HA LYS 55 HA LYS 55 10.040 -2.206 3.512
365 1HB LYS 55 1HB LYS 55 8.632 -4.147 3.815
366 2HB LYS 55 2HB LYS 55 7.973 -2.796 4.737
367 1HG LYS 55 1HG LYS 55 6.421 -2.469 2.552
368 2HG LYS 55 2HG LYS 55 6.814 -4.197 2.321
369 1HD LYS 55 1HD LYS 55 5.609 -2.989 4.911
370 2HD LYS 55 2HD LYS 55 4.662 -3.689 3.562
371 1HE LYS 55 1HE LYS 55 4.735 -5.367 5.243
372 2HE LYS 55 2HE LYS 55 5.843 -5.928 3.932
373 1HZ LYS 55 1HZ LYS 55 7.705 -5.236 5.256
374 2HZ LYS 55 2HZ LYS 55 6.701 -6.233 6.191
375 3HZ LYS 55 3HZ LYS 55 6.696 -4.556 6.437
376 H PHE 56 H PHE 56 8.998 -4.374 1.714
377 HA PHE 56 HA PHE 56 9.763 -3.231 -0.883
378 1HB PHE 56 1HB PHE 56 10.106 -5.664 -1.526
379 2HB PHE 56 2HB PHE 56 11.172 -5.088 -0.226
380 HD1 PHE 56 HD1 PHE 56 10.831 -5.849 2.130
381 HD2 PHE 56 HD2 PHE 56 8.394 -7.354 -1.083
382 HE1 PHE 56 HE1 PHE 56 10.139 -7.720 3.539
383 HE2 PHE 56 HE2 PHE 56 7.683 -9.225 0.341
384 HZ PHE 56 HZ PHE 56 8.552 -9.430 2.661
385 H CYS 57 H CYS 57 8.428 -4.776 -2.746
386 HA CYS 57 HA CYS 57 5.628 -4.158 -2.228
387 1HB CYS 57 1HB CYS 57 7.001 -5.512 -4.576
388 2HB CYS 57 2HB CYS 57 5.247 -5.152 -4.490
389 H TYR 58 H TYR 58 4.712 -5.287 -0.785
390 HA TYR 58 HA TYR 58 5.256 -7.955 -0.084
391 1HB TYR 58 1HB TYR 58 3.993 -5.924 1.211
392 2HB TYR 58 2HB TYR 58 2.545 -6.666 0.480
393 HD1 TYR 58 HD1 TYR 58 1.382 -7.826 2.170
394 HD2 TYR 58 HD2 TYR 58 5.699 -7.954 2.223
395 HE1 TYR 58 HE1 TYR 58 1.311 -9.304 4.060
396 HE2 TYR 58 HE2 TYR 58 5.616 -9.435 4.144
397 HH TYR 58 HH TYR 58 4.260 -10.605 5.620
398 H LYS 59 H LYS 59 3.106 -9.367 0.251
399 HA LYS 59 HA LYS 59 2.412 -10.581 -2.147
400 1HB LYS 59 1HB LYS 59 1.057 -10.635 0.546
401 2HB LYS 59 2HB LYS 59 0.527 -11.612 -0.880
402 1HG LYS 59 1HG LYS 59 2.723 -12.675 -1.069
403 2HG LYS 59 2HG LYS 59 3.395 -11.724 0.286
404 1HD LYS 59 1HD LYS 59 1.955 -12.778 1.912
405 2HD LYS 59 2HD LYS 59 0.946 -13.546 0.641
406 1HE LYS 59 1HE LYS 59 3.952 -14.153 1.030
407 2HE LYS 59 2HE LYS 59 2.611 -15.130 1.769
408 1HZ LYS 59 1HZ LYS 59 1.776 -15.571 -0.421
409 2HZ LYS 59 2HZ LYS 59 3.396 -16.067 -0.286
410 3HZ LYS 59 3HZ LYS 59 3.012 -14.649 -1.134
411 H ALA 60 H ALA 60 0.865 -10.464 -3.626
412 HA ALA 60 HA ALA 60 -0.639 -8.016 -3.761
413 1HB ALA 60 1HB ALA 60 0.589 -8.869 -5.761
414 2HB ALA 60 2HB ALA 60 -1.191 -8.853 -6.067
415 3HB ALA 60 3HB ALA 60 -0.342 -10.404 -5.665
416 H CYS 61 H CYS 61 -2.760 -7.809 -3.472
417 HA CYS 61 HA CYS 61 -4.411 -10.180 -2.958
418 1HB CYS 61 1HB CYS 61 -4.485 -7.360 -1.792
419 2HB CYS 61 2HB CYS 61 -5.729 -8.614 -1.457
420 H HIS 62 H HIS 62 -6.749 -9.516 -3.157
421 HA HIS 62 HA HIS 62 -7.139 -7.830 -5.586
422 1HB HIS 62 1HB HIS 62 -8.555 -10.401 -4.696
423 2HB HIS 62 2HB HIS 62 -9.101 -9.390 -6.063
424 HD1 HIS 62 HD1 HIS 62 -7.367 -9.102 -8.035
425 HD2 HIS 62 HD2 HIS 62 -6.246 -11.971 -5.212
426 HE1 HIS 62 HE1 HIS 62 -5.438 -10.368 -9.023
427 HE2 HIS 62 HE2 HIS 62 -4.746 -12.095 -7.284
428 H ASN 63 H ASN 63 -9.128 -6.510 -5.525
429 HA ASN 63 HA ASN 63 -10.962 -6.495 -3.550
430 1HB ASN 63 1HB ASN 63 -10.263 -4.230 -2.437
431 2HB ASN 63 2HB ASN 63 -9.598 -5.753 -1.798
432 1HD2 ASN 63 1HD2 ASN 63 -7.220 -6.153 -2.125
433 2HD2 ASN 63 2HD2 ASN 63 -6.213 -4.834 -2.631
434 H SER 64 H SER 64 -9.236 -3.710 -4.715
435 HA SER 64 HA SER 64 -11.433 -3.067 -6.617
436 1HB SER 64 1HB SER 64 -11.151 -1.563 -4.600
437 2HB SER 64 2HB SER 64 -9.499 -1.159 -5.157
438 HG SER 64 HG SER 64 -10.365 -0.026 -6.843
439 H GLU 65 H GLU 65 -9.758 -4.792 -7.743
440 HA GLU 65 HA GLU 65 -7.660 -3.614 -9.221
441 1HB GLU 65 1HB GLU 65 -7.956 -5.467 -10.835
442 2HB GLU 65 2HB GLU 65 -7.688 -5.974 -9.155
443 1HG GLU 65 1HG GLU 65 -10.547 -5.875 -10.320
444 2HG GLU 65 2HG GLU 65 -9.455 -7.264 -10.585
445 HE2 GLU 65 HE2 GLU 65 -11.390 -6.973 -7.223
446 H ILE 66 H ILE 66 -11.053 -3.413 -9.468
447 HA ILE 66 HA ILE 66 -11.000 -1.379 -11.469
448 HB ILE 66 HB ILE 66 -12.805 -2.410 -12.810
449 1HG1 ILE 66 1HG1 ILE 66 -12.098 -5.106 -11.506
450 2HG1 ILE 66 2HG1 ILE 66 -13.543 -4.139 -11.077
451 1HG2 ILE 66 1HG2 ILE 66 -11.360 -3.762 -14.233
452 2HG2 ILE 66 2HG2 ILE 66 -10.239 -4.115 -12.878
453 3HG2 ILE 66 3HG2 ILE 66 -10.379 -2.429 -13.523
454 1HD1 ILE 66 1HD1 ILE 66 -12.928 -5.317 -13.862
455 2HD1 ILE 66 2HD1 ILE 66 -14.324 -4.244 -13.470
456 3HD1 ILE 66 3HD1 ILE 66 -14.177 -5.866 -12.693
457 H GLU 67 H GLU 67 -13.297 -0.501 -11.657
458 HA GLU 67 HA GLU 67 -14.364 -0.343 -8.952
459 1HB GLU 67 1HB GLU 67 -14.793 1.210 -11.544
460 2HB GLU 67 2HB GLU 67 -15.635 1.616 -10.008
461 1HG GLU 67 1HG GLU 67 -13.614 2.326 -8.910
462 2HG GLU 67 2HG GLU 67 -12.564 1.440 -10.067
463 HE2 GLU 67 HE2 GLU 67 -11.991 4.227 -11.797
Start of MODEL 7
1 1H GLY 1 1H GLY 1 -3.965 -18.160 1.051
2 2H GLY 1 2H GLY 1 -5.484 -18.155 1.810
3 3H GLY 1 3H GLY 1 -4.250 -19.161 2.390
4 1HA GLY 1 1HA GLY 1 -4.557 -17.289 3.798
5 2HA GLY 1 2HA GLY 1 -2.942 -17.264 2.983
6 H ASP 2 H ASP 2 -5.674 -15.474 3.760
7 HA ASP 2 HA ASP 2 -4.806 -13.135 2.219
8 1HB ASP 2 1HB ASP 2 -7.563 -14.554 1.909
9 2HB ASP 2 2HB ASP 2 -7.317 -12.834 1.460
10 HD2 ASP 2 HD2 ASP 2 -6.760 -15.319 -1.301
11 H ASP 3 H ASP 3 -4.748 -13.962 4.914
12 HA ASP 3 HA ASP 3 -6.381 -12.116 6.390
13 1HB ASP 3 1HB ASP 3 -7.491 -13.946 7.729
14 2HB ASP 3 2HB ASP 3 -8.098 -13.812 6.057
15 HD2 ASP 3 HD2 ASP 3 -7.128 -17.299 7.100
16 H VAL 4 H VAL 4 -4.010 -11.637 6.516
17 HA VAL 4 HA VAL 4 -3.076 -12.667 9.017
18 HB VAL 4 HB VAL 4 -2.053 -14.154 7.396
19 1HG1 VAL 4 1HG1 VAL 4 -1.924 -12.735 5.381
20 2HG1 VAL 4 2HG1 VAL 4 -0.271 -13.276 5.823
21 3HG1 VAL 4 3HG1 VAL 4 -0.789 -11.597 6.187
22 1HG2 VAL 4 1HG2 VAL 4 0.278 -13.937 8.199
23 2HG2 VAL 4 2HG2 VAL 4 -0.877 -13.609 9.535
24 3HG2 VAL 4 3HG2 VAL 4 -0.003 -12.254 8.728
25 H LYS 5 H LYS 5 -1.999 -11.109 10.183
26 HA LYS 5 HA LYS 5 -2.599 -8.456 9.395
27 1HB LYS 5 1HB LYS 5 -2.897 -9.479 11.661
28 2HB LYS 5 2HB LYS 5 -1.112 -9.523 11.849
29 1HG LYS 5 1HG LYS 5 -0.937 -7.165 11.927
30 2HG LYS 5 2HG LYS 5 -2.634 -6.900 11.363
31 1HD LYS 5 1HD LYS 5 -1.942 -8.353 13.989
32 2HD LYS 5 2HD LYS 5 -2.165 -6.571 13.899
33 1HE LYS 5 1HE LYS 5 -4.501 -6.830 13.111
34 2HE LYS 5 2HE LYS 5 -4.327 -8.629 13.085
35 1HZ LYS 5 1HZ LYS 5 -4.072 -6.897 15.482
36 2HZ LYS 5 2HZ LYS 5 -3.942 -8.587 15.441
37 3HZ LYS 5 3HZ LYS 5 -5.419 -7.843 15.055
38 H SER 6 H SER 6 -0.143 -10.291 8.504
39 HA SER 6 HA SER 6 2.154 -8.634 8.343
40 1HB SER 6 1HB SER 6 1.066 -10.613 6.251
41 2HB SER 6 2HB SER 6 2.731 -9.959 6.259
42 HG SER 6 HG SER 6 2.821 -11.873 7.105
43 H ALA 7 H ALA 7 2.943 -7.742 6.116
44 HA ALA 7 HA ALA 7 1.135 -5.812 5.146
45 1HB ALA 7 1HB ALA 7 3.478 -5.355 5.100
46 2HB ALA 7 2HB ALA 7 2.965 -5.605 3.375
47 3HB ALA 7 3HB ALA 7 3.808 -6.908 4.254
48 H CYS 8 H CYS 8 -0.235 -5.664 3.581
49 HA CYS 8 HA CYS 8 -0.282 -7.681 1.438
50 1HB CYS 8 1HB CYS 8 -2.580 -7.347 1.132
51 2HB CYS 8 2HB CYS 8 -2.422 -7.496 2.901
52 H CYS 9 H CYS 9 -0.388 -6.817 -0.757
53 HA CYS 9 HA CYS 9 -0.555 -3.907 -1.010
54 1HB CYS 9 1HB CYS 9 1.910 -4.931 -0.652
55 2HB CYS 9 2HB CYS 9 1.745 -5.465 -2.328
56 H ASP 10 H ASP 10 -1.958 -3.508 -2.906
57 HA ASP 10 HA ASP 10 -1.890 -5.647 -4.961
58 1HB ASP 10 1HB ASP 10 -3.887 -3.487 -4.300
59 2HB ASP 10 2HB ASP 10 -3.672 -3.916 -6.010
60 HD2 ASP 10 HD2 ASP 10 -5.766 -4.552 -5.833
61 H THR 11 H THR 11 -2.078 -2.056 -5.578
62 HA THR 11 HA THR 11 0.008 -2.408 -7.478
63 HB THR 11 HB THR 11 -1.066 0.258 -6.492
64 HG1 THR 11 HG1 THR 11 -2.553 0.105 -7.950
65 1HG2 THR 11 1HG2 THR 11 1.018 0.316 -7.951
66 2HG2 THR 11 2HG2 THR 11 -0.412 0.885 -8.875
67 3HG2 THR 11 3HG2 THR 11 0.228 -0.786 -9.130
68 H CYS 12 H CYS 12 1.972 -2.793 -6.834
69 HA CYS 12 HA CYS 12 3.279 -1.330 -4.708
70 1HB CYS 12 1HB CYS 12 4.268 -3.259 -6.892
71 2HB CYS 12 2HB CYS 12 5.294 -2.648 -5.520
72 H LEU 13 H LEU 13 4.980 0.190 -4.961
73 HA LEU 13 HA LEU 13 5.973 0.707 -7.654
74 1HB LEU 13 1HB LEU 13 3.998 2.167 -7.314
75 2HB LEU 13 2HB LEU 13 4.717 2.761 -5.787
76 HG LEU 13 HG LEU 13 6.351 3.079 -8.320
77 1HD1 LEU 13 1HD1 LEU 13 3.828 4.783 -7.810
78 2HD1 LEU 13 2HD1 LEU 13 4.048 3.579 -9.127
79 3HD1 LEU 13 3HD1 LEU 13 5.075 5.062 -9.073
80 1HD2 LEU 13 1HD2 LEU 13 7.191 4.050 -6.201
81 2HD2 LEU 13 2HD2 LEU 13 5.652 4.968 -5.966
82 3HD2 LEU 13 3HD2 LEU 13 6.759 5.376 -7.331
83 H CYS 14 H CYS 14 8.032 1.326 -7.614
84 HA CYS 14 HA CYS 14 9.424 1.645 -5.060
85 1HB CYS 14 1HB CYS 14 9.862 -0.438 -7.263
86 2HB CYS 14 2HB CYS 14 11.073 -0.087 -6.015
87 H THR 15 H THR 15 11.283 2.718 -5.131
88 HA THR 15 HA THR 15 11.784 4.211 -7.597
89 HB THR 15 HB THR 15 13.310 5.591 -6.311
90 HG1 THR 15 HG1 THR 15 12.941 5.342 -3.963
91 1HG2 THR 15 1HG2 THR 15 11.502 6.734 -5.106
92 2HG2 THR 15 2HG2 THR 15 10.571 5.204 -4.948
93 3HG2 THR 15 3HG2 THR 15 10.793 5.964 -6.565
94 H ARG 16 H ARG 16 13.773 4.481 -8.559
95 HA ARG 16 HA ARG 16 15.662 2.277 -8.353
96 1HB ARG 16 1HB ARG 16 15.798 4.829 -10.064
97 2HB ARG 16 2HB ARG 16 16.862 3.381 -10.189
98 1HG ARG 16 1HG ARG 16 14.756 2.008 -10.713
99 2HG ARG 16 2HG ARG 16 13.895 3.575 -10.896
100 1HD ARG 16 1HD ARG 16 14.589 2.886 -13.116
101 2HD ARG 16 2HD ARG 16 15.677 4.249 -12.654
102 HE ARG 16 HE ARG 16 16.357 1.281 -12.513
103 1HH1 ARG 16 1HH1 ARG 16 17.471 4.661 -12.922
104 2HH1 ARG 16 2HH1 ARG 16 19.139 4.209 -13.081
105 1HH2 ARG 16 1HH2 ARG 16 18.570 0.732 -12.704
106 2HH2 ARG 16 2HH2 ARG 16 19.771 1.959 -12.954
107 H SER 17 H SER 17 15.258 4.353 -6.177
108 HA SER 17 HA SER 17 17.524 6.038 -6.044
109 1HB SER 17 1HB SER 17 15.382 6.413 -4.784
110 2HB SER 17 2HB SER 17 15.897 5.147 -3.623
111 HG SER 17 HG SER 17 16.295 7.351 -3.056
112 H GLN 18 H GLN 18 18.524 5.809 -3.566
113 HA GLN 18 HA GLN 18 20.078 3.332 -3.292
114 1HB GLN 18 1HB GLN 18 21.144 6.040 -4.166
115 2HB GLN 18 2HB GLN 18 22.207 4.942 -3.230
116 1HG GLN 18 1HG GLN 18 20.943 4.258 -5.973
117 2HG GLN 18 2HG GLN 18 22.636 4.780 -5.692
118 1HE2 GLN 18 1HE2 GLN 18 23.778 3.360 -3.855
119 2HE2 GLN 18 2HE2 GLN 18 23.626 1.642 -4.179
120 HA PRO 19 HA PRO 19 19.695 2.137 -1.611
121 1HB PRO 19 1HB PRO 19 18.085 1.497 0.556
122 2HB PRO 19 2HB PRO 19 19.891 1.764 0.706
123 1HG PRO 19 1HG PRO 19 17.649 3.798 1.233
124 2HG PRO 19 2HG PRO 19 19.026 3.351 2.319
125 1HD PRO 19 1HD PRO 19 19.137 5.548 0.626
126 2HD PRO 19 2HD PRO 19 20.607 4.533 0.940
127 HA PRO 20 HA PRO 20 15.741 3.043 -3.588
128 1HB PRO 20 1HB PRO 20 15.101 0.612 -4.709
129 2HB PRO 20 2HB PRO 20 16.482 1.602 -5.316
130 1HG PRO 20 1HG PRO 20 16.569 -0.704 -3.305
131 2HG PRO 20 2HG PRO 20 17.558 -0.502 -4.809
132 1HD PRO 20 1HD PRO 20 18.516 0.251 -2.323
133 2HD PRO 20 2HD PRO 20 18.856 1.276 -3.802
134 H THR 21 H THR 21 13.418 2.603 -3.427
135 HA THR 21 HA THR 21 12.579 0.984 -1.163
136 HB THR 21 HB THR 21 13.708 2.776 0.030
137 HG1 THR 21 HG1 THR 21 12.176 2.911 1.448
138 1HG2 THR 21 1HG2 THR 21 13.500 4.613 -1.627
139 2HG2 THR 21 2HG2 THR 21 12.821 5.103 -0.056
140 3HG2 THR 21 3HG2 THR 21 11.711 4.639 -1.402
141 H CYS 22 H CYS 22 10.295 1.598 -0.494
142 HA CYS 22 HA CYS 22 8.725 1.745 -2.990
143 1HB CYS 22 1HB CYS 22 9.060 -0.730 -1.252
144 2HB CYS 22 2HB CYS 22 7.903 -0.653 -2.583
145 H ARG 23 H ARG 23 6.475 1.011 -2.683
146 HA ARG 23 HA ARG 23 5.301 0.775 -0.193
147 1HB ARG 23 1HB ARG 23 4.089 2.812 0.192
148 2HB ARG 23 2HB ARG 23 5.752 3.351 -0.135
149 1HG ARG 23 1HG ARG 23 3.923 3.343 -2.560
150 2HG ARG 23 2HG ARG 23 3.482 4.416 -1.203
151 1HD ARG 23 1HD ARG 23 4.820 5.704 -2.714
152 2HD ARG 23 2HD ARG 23 5.820 5.372 -1.218
153 HE ARG 23 HE ARG 23 6.199 3.332 -3.253
154 1HH1 ARG 23 1HH1 ARG 23 7.097 6.701 -2.454
155 2HH1 ARG 23 2HH1 ARG 23 8.631 6.603 -3.253
156 1HH2 ARG 23 1HH2 ARG 23 8.148 3.254 -4.317
157 2HH2 ARG 23 2HH2 ARG 23 9.283 4.582 -4.291
158 H CYS 24 H CYS 24 2.896 0.871 -0.345
159 HA CYS 24 HA CYS 24 1.989 -0.189 -2.919
160 1HB CYS 24 1HB CYS 24 0.466 0.134 -0.247
161 2HB CYS 24 2HB CYS 24 -0.105 -0.779 -1.685
162 H VAL 25 H VAL 25 1.701 1.550 -4.298
163 HA VAL 25 HA VAL 25 0.584 4.028 -3.475
164 HB VAL 25 HB VAL 25 0.565 4.719 -5.774
165 1HG1 VAL 25 1HG1 VAL 25 3.121 3.315 -4.724
166 2HG1 VAL 25 2HG1 VAL 25 2.533 4.928 -4.218
167 3HG1 VAL 25 3HG1 VAL 25 3.072 4.675 -5.907
168 1HG2 VAL 25 1HG2 VAL 25 1.562 3.214 -7.504
169 2HG2 VAL 25 2HG2 VAL 25 0.031 2.522 -6.870
170 3HG2 VAL 25 3HG2 VAL 25 1.619 1.849 -6.333
171 H ASP 26 H ASP 26 -0.702 1.177 -3.969
172 HA ASP 26 HA ASP 26 -3.296 1.476 -4.894
173 1HB ASP 26 1HB ASP 26 -1.926 -0.649 -4.174
174 2HB ASP 26 2HB ASP 26 -2.483 -0.293 -2.495
175 HD2 ASP 26 HD2 ASP 26 -5.105 -1.335 -5.374
176 H VAL 27 H VAL 27 -5.253 2.291 -4.120
177 HA VAL 27 HA VAL 27 -5.198 3.373 -1.379
178 HB VAL 27 HB VAL 27 -6.764 4.519 -3.670
179 1HG1 VAL 27 1HG1 VAL 27 -7.145 5.211 -1.224
180 2HG1 VAL 27 2HG1 VAL 27 -6.404 6.550 -2.198
181 3HG1 VAL 27 3HG1 VAL 27 -5.375 5.581 -1.099
182 1HG2 VAL 27 1HG2 VAL 27 -4.793 6.183 -3.806
183 2HG2 VAL 27 2HG2 VAL 27 -4.599 4.587 -4.644
184 3HG2 VAL 27 3HG2 VAL 27 -3.793 4.875 -3.067
185 H ARG 28 H ARG 28 -6.663 2.738 -0.022
186 HA ARG 28 HA ARG 28 -9.031 1.293 -1.028
187 1HB ARG 28 1HB ARG 28 -6.832 0.493 0.947
188 2HB ARG 28 2HB ARG 28 -8.383 -0.404 0.846
189 1HG ARG 28 1HG ARG 28 -6.230 -0.139 -1.331
190 2HG ARG 28 2HG ARG 28 -6.661 -1.591 -0.367
191 1HD ARG 28 1HD ARG 28 -9.107 -1.257 -1.472
192 2HD ARG 28 2HD ARG 28 -8.241 -0.155 -2.589
193 HE ARG 28 HE ARG 28 -7.271 -1.984 -3.648
194 1HH1 ARG 28 1HH1 ARG 28 -8.609 -3.165 -0.497
195 2HH1 ARG 28 2HH1 ARG 28 -8.385 -4.818 -0.936
196 1HH2 ARG 28 1HH2 ARG 28 -7.086 -4.210 -4.154
197 2HH2 ARG 28 2HH2 ARG 28 -7.521 -5.421 -2.990
198 H GLU 29 H GLU 29 -10.369 0.517 0.937
199 HA GLU 29 HA GLU 29 -11.468 2.695 2.292
200 1HB GLU 29 1HB GLU 29 -11.500 -0.319 2.635
201 2HB GLU 29 2HB GLU 29 -12.547 0.722 3.641
202 1HG GLU 29 1HG GLU 29 -12.639 0.634 0.529
203 2HG GLU 29 2HG GLU 29 -13.761 -0.230 1.630
204 HE2 GLU 29 HE2 GLU 29 -13.546 2.348 -0.213
205 H SER 30 H SER 30 -8.787 0.793 3.041
206 HA SER 30 HA SER 30 -8.122 2.280 5.452
207 1HB SER 30 1HB SER 30 -8.642 -0.780 5.471
208 2HB SER 30 2HB SER 30 -7.641 0.012 6.734
209 HG SER 30 HG SER 30 -9.335 0.906 7.604
210 H CYS 31 H CYS 31 -5.892 1.411 6.288
211 HA CYS 31 HA CYS 31 -4.259 0.493 3.992
212 1HB CYS 31 1HB CYS 31 -3.620 1.818 6.641
213 2HB CYS 31 2HB CYS 31 -2.326 1.259 5.501
214 H HIS 32 H HIS 32 -2.726 -0.283 7.042
215 HA HIS 32 HA HIS 32 -3.973 -2.784 7.335
216 1HB HIS 32 1HB HIS 32 -2.620 -2.985 5.106
217 2HB HIS 32 2HB HIS 32 -1.196 -3.175 6.112
218 HD1 HIS 32 HD1 HIS 32 -4.337 -4.465 4.823
219 HD2 HIS 32 HD2 HIS 32 -1.606 -5.983 7.613
220 HE1 HIS 32 HE1 HIS 32 -4.866 -6.878 5.105
221 HE2 HIS 32 HE2 HIS 32 -3.177 -7.804 6.791
222 H SER 33 H SER 33 -0.813 -3.665 8.157
223 HA SER 33 HA SER 33 -1.326 -2.620 10.829
224 1HB SER 33 1HB SER 33 -0.941 -5.104 10.290
225 2HB SER 33 2HB SER 33 0.768 -4.696 9.972
226 HG SER 33 HG SER 33 -0.775 -4.365 12.358
227 H ALA 34 H ALA 34 1.826 -3.102 9.029
228 HA ALA 34 HA ALA 34 2.951 -1.154 10.779
229 1HB ALA 34 1HB ALA 34 4.019 -3.368 10.257
230 2HB ALA 34 2HB ALA 34 5.091 -1.997 9.817
231 3HB ALA 34 3HB ALA 34 4.184 -2.864 8.533
232 H CYS 35 H CYS 35 1.205 -0.145 8.706
233 HA CYS 35 HA CYS 35 2.956 1.375 6.917
234 1HB CYS 35 1HB CYS 35 0.811 0.510 6.094
235 2HB CYS 35 2HB CYS 35 -0.066 1.528 7.311
236 H ASP 36 H ASP 36 4.128 3.087 7.742
237 HA ASP 36 HA ASP 36 3.474 4.333 10.140
238 1HB ASP 36 1HB ASP 36 5.364 5.887 9.572
239 2HB ASP 36 2HB ASP 36 5.771 4.148 9.468
240 HD2 ASP 36 HD2 ASP 36 7.324 5.760 6.710
241 H LYS 37 H LYS 37 3.212 5.628 6.848
242 HA LYS 37 HA LYS 37 1.324 7.672 7.836
243 1HB LYS 37 1HB LYS 37 3.488 8.569 6.957
244 2HB LYS 37 2HB LYS 37 3.125 7.808 5.389
245 1HG LYS 37 1HG LYS 37 1.140 9.171 5.071
246 2HG LYS 37 2HG LYS 37 1.223 9.819 6.734
247 1HD LYS 37 1HD LYS 37 3.230 11.099 6.247
248 2HD LYS 37 2HD LYS 37 3.512 10.212 4.712
249 1HE LYS 37 1HE LYS 37 1.444 11.231 3.710
250 2HE LYS 37 2HE LYS 37 1.152 12.141 5.242
251 1HZ LYS 37 1HZ LYS 37 3.200 13.268 4.949
252 2HZ LYS 37 2HZ LYS 37 2.304 13.400 3.513
253 3HZ LYS 37 3HZ LYS 37 3.618 12.324 3.600
254 H CYS 38 H CYS 38 -0.364 6.104 7.740
255 HA CYS 38 HA CYS 38 -1.466 5.716 5.070
256 1HB CYS 38 1HB CYS 38 -1.701 3.960 6.887
257 2HB CYS 38 2HB CYS 38 -2.443 5.206 7.946
258 H VAL 39 H VAL 39 -2.057 7.810 4.203
259 HA VAL 39 HA VAL 39 -3.468 9.577 6.044
260 HB VAL 39 HB VAL 39 -3.551 11.189 4.361
261 1HG1 VAL 39 1HG1 VAL 39 -1.166 11.507 3.954
262 2HG1 VAL 39 2HG1 VAL 39 -0.836 9.757 4.208
263 3HG1 VAL 39 3HG1 VAL 39 -1.354 10.785 5.614
264 1HG2 VAL 39 1HG2 VAL 39 -4.062 9.946 2.376
265 2HG2 VAL 39 2HG2 VAL 39 -2.493 9.028 2.510
266 3HG2 VAL 39 3HG2 VAL 39 -2.516 10.830 2.181
267 H CYS 40 H CYS 40 -5.612 8.950 6.537
268 HA CYS 40 HA CYS 40 -6.937 7.305 4.547
269 1HB CYS 40 1HB CYS 40 -6.572 6.918 7.114
270 2HB CYS 40 2HB CYS 40 -8.117 7.789 7.252
271 H ALA 41 H ALA 41 -7.627 8.528 2.947
272 HA ALA 41 HA ALA 41 -8.427 11.185 3.413
273 1HB ALA 41 1HB ALA 41 -8.909 9.661 0.827
274 2HB ALA 41 2HB ALA 41 -7.370 10.419 1.304
275 3HB ALA 41 3HB ALA 41 -8.822 11.443 1.070
276 H TYR 42 H TYR 42 -10.224 12.265 3.083
277 HA TYR 42 HA TYR 42 -12.344 11.349 4.629
278 1HB TYR 42 1HB TYR 42 -12.873 13.921 4.345
279 2HB TYR 42 2HB TYR 42 -11.218 13.515 4.930
280 HD1 TYR 42 HD1 TYR 42 -13.152 14.521 1.882
281 HD2 TYR 42 HD2 TYR 42 -9.212 14.030 3.576
282 HE1 TYR 42 HE1 TYR 42 -12.163 15.526 -0.109
283 HE2 TYR 42 HE2 TYR 42 -8.235 14.919 1.496
284 HH TYR 42 HH TYR 42 -10.236 15.777 -1.329
285 H SER 43 H SER 43 -11.807 11.265 1.500
286 HA SER 43 HA SER 43 -13.899 12.201 0.047
287 1HB SER 43 1HB SER 43 -12.061 9.810 -0.562
288 2HB SER 43 2HB SER 43 -13.022 10.788 -1.779
289 HG SER 43 HG SER 43 -10.634 11.356 -1.211
290 H ASN 44 H ASN 44 -15.216 11.052 -1.446
291 HA ASN 44 HA ASN 44 -16.942 9.163 -0.075
292 1HB ASN 44 1HB ASN 44 -17.699 11.355 -1.172
293 2HB ASN 44 2HB ASN 44 -17.455 10.573 -2.746
294 1HD2 ASN 44 1HD2 ASN 44 -19.552 10.630 0.187
295 2HD2 ASN 44 2HD2 ASN 44 -20.588 9.365 -0.315
296 HA PRO 45 HA PRO 45 -16.507 7.296 0.641
297 1HB PRO 45 1HB PRO 45 -15.588 4.509 -0.187
298 2HB PRO 45 2HB PRO 45 -16.844 4.918 0.990
299 1HG PRO 45 1HG PRO 45 -17.623 4.054 -1.461
300 2HG PRO 45 2HG PRO 45 -18.406 5.540 -0.814
301 1HD PRO 45 1HD PRO 45 -15.945 5.435 -2.689
302 2HD PRO 45 2HD PRO 45 -17.526 6.314 -2.949
303 HA PRO 46 HA PRO 46 -12.488 7.863 1.818
304 1HB PRO 46 1HB PRO 46 -12.414 5.286 3.483
305 2HB PRO 46 2HB PRO 46 -11.773 6.914 3.952
306 1HG PRO 46 1HG PRO 46 -14.245 6.290 4.823
307 2HG PRO 46 2HG PRO 46 -14.020 7.871 3.939
308 1HD PRO 46 1HD PRO 46 -15.077 5.211 2.791
309 2HD PRO 46 2HD PRO 46 -15.751 6.952 2.642
310 H GLN 47 H GLN 47 -10.344 7.761 1.551
311 HA GLN 47 HA GLN 47 -9.361 5.539 -0.150
312 1HB GLN 47 1HB GLN 47 -9.415 8.506 -0.856
313 2HB GLN 47 2HB GLN 47 -8.336 7.362 -1.692
314 1HG GLN 47 1HG GLN 47 -11.419 7.240 -1.541
315 2HG GLN 47 2HG GLN 47 -10.459 7.749 -2.979
316 1HE2 GLN 47 1HE2 GLN 47 -8.626 5.830 -3.432
317 2HE2 GLN 47 2HE2 GLN 47 -9.321 4.239 -3.485
318 H CYS 48 H CYS 48 -8.204 4.775 1.435
319 HA CYS 48 HA CYS 48 -6.299 6.387 2.849
320 1HB CYS 48 1HB CYS 48 -7.097 3.534 3.358
321 2HB CYS 48 2HB CYS 48 -6.162 4.636 4.451
322 H GLN 49 H GLN 49 -4.291 6.660 2.501
323 HA GLN 49 HA GLN 49 -2.999 4.815 0.627
324 1HB GLN 49 1HB GLN 49 -3.836 7.424 0.292
325 2HB GLN 49 2HB GLN 49 -2.098 7.677 0.669
326 1HG GLN 49 1HG GLN 49 -3.328 5.912 -1.491
327 2HG GLN 49 2HG GLN 49 -2.551 7.514 -1.787
328 1HE2 GLN 49 1HE2 GLN 49 -2.073 4.112 -1.254
329 2HE2 GLN 49 2HE2 GLN 49 -0.338 4.061 -1.316
330 H CYS 50 H CYS 50 -1.291 3.793 1.328
331 HA CYS 50 HA CYS 50 0.419 4.825 3.436
332 1HB CYS 50 1HB CYS 50 0.622 2.435 1.509
333 2HB CYS 50 2HB CYS 50 1.918 2.821 2.660
334 H TYR 51 H TYR 51 0.848 6.784 2.675
335 HA TYR 51 HA TYR 51 1.672 7.665 0.241
336 1HB TYR 51 1HB TYR 51 1.163 8.777 2.776
337 2HB TYR 51 2HB TYR 51 2.860 9.186 2.598
338 HD1 TYR 51 HD1 TYR 51 -0.512 9.581 1.349
339 HD2 TYR 51 HD2 TYR 51 3.565 10.758 0.648
340 HE1 TYR 51 HE1 TYR 51 -1.284 11.530 0.096
341 HE2 TYR 51 HE2 TYR 51 2.800 12.664 -0.627
342 HH TYR 51 HH TYR 51 -0.635 13.647 -0.522
343 H ASP 52 H ASP 52 3.610 6.708 2.791
344 HA ASP 52 HA ASP 52 5.974 8.167 1.993
345 1HB ASP 52 1HB ASP 52 5.121 8.194 4.315
346 2HB ASP 52 2HB ASP 52 5.235 6.396 4.410
347 HD2 ASP 52 HD2 ASP 52 7.003 9.304 4.263
348 H THR 53 H THR 53 8.197 7.391 1.930
349 HA THR 53 HA THR 53 8.532 4.854 0.595
350 HB THR 53 HB THR 53 11.009 5.289 0.920
351 HG1 THR 53 HG1 THR 53 11.056 6.729 2.578
352 1HG2 THR 53 1HG2 THR 53 9.739 5.827 -1.154
353 2HG2 THR 53 2HG2 THR 53 10.989 7.078 -0.836
354 3HG2 THR 53 3HG2 THR 53 9.255 7.428 -0.479
355 H HIS 54 H HIS 54 8.229 3.020 1.676
356 HA HIS 54 HA HIS 54 9.742 2.617 4.112
357 1HB HIS 54 1HB HIS 54 7.922 1.991 5.634
358 2HB HIS 54 2HB HIS 54 7.831 3.709 5.080
359 HD1 HIS 54 HD1 HIS 54 6.185 4.040 2.985
360 HD2 HIS 54 HD2 HIS 54 5.265 1.131 5.834
361 HE1 HIS 54 HE1 HIS 54 3.727 3.748 2.921
362 HE2 HIS 54 HE2 HIS 54 3.161 1.972 4.677
363 H LYS 55 H LYS 55 7.774 0.937 1.681
364 HA LYS 55 HA LYS 55 8.173 -1.539 3.175
365 1HB LYS 55 1HB LYS 55 6.308 -0.101 3.832
366 2HB LYS 55 2HB LYS 55 5.748 0.060 2.154
367 1HG LYS 55 1HG LYS 55 5.863 -2.696 3.495
368 2HG LYS 55 2HG LYS 55 4.590 -1.517 3.956
369 1HD LYS 55 1HD LYS 55 3.882 -1.317 1.522
370 2HD LYS 55 2HD LYS 55 5.120 -2.538 1.100
371 1HE LYS 55 1HE LYS 55 3.002 -3.738 1.290
372 2HE LYS 55 2HE LYS 55 4.061 -4.141 2.699
373 1HZ LYS 55 1HZ LYS 55 1.819 -2.181 2.681
374 2HZ LYS 55 2HZ LYS 55 2.827 -2.526 4.004
375 3HZ LYS 55 3HZ LYS 55 1.804 -3.728 3.379
376 H PHE 56 H PHE 56 8.690 -3.306 1.837
377 HA PHE 56 HA PHE 56 8.808 -2.761 -0.965
378 1HB PHE 56 1HB PHE 56 9.950 -4.873 -1.300
379 2HB PHE 56 2HB PHE 56 10.670 -3.892 -0.009
380 HD1 PHE 56 HD1 PHE 56 8.180 -6.752 -0.491
381 HD2 PHE 56 HD2 PHE 56 11.189 -4.946 2.005
382 HE1 PHE 56 HE1 PHE 56 8.165 -8.726 0.952
383 HE2 PHE 56 HE2 PHE 56 11.204 -6.949 3.421
384 HZ PHE 56 HZ PHE 56 9.687 -8.855 2.909
385 H CYS 57 H CYS 57 8.262 -4.659 -2.620
386 HA CYS 57 HA CYS 57 5.412 -4.644 -2.629
387 1HB CYS 57 1HB CYS 57 6.836 -4.340 -4.657
388 2HB CYS 57 2HB CYS 57 7.296 -6.064 -4.563
389 H TYR 58 H TYR 58 4.719 -5.726 -0.965
390 HA TYR 58 HA TYR 58 4.972 -8.603 -0.650
391 1HB TYR 58 1HB TYR 58 3.197 -6.426 0.584
392 2HB TYR 58 2HB TYR 58 2.761 -8.134 0.784
393 HD1 TYR 58 HD1 TYR 58 5.470 -5.614 1.565
394 HD2 TYR 58 HD2 TYR 58 4.095 -9.671 2.075
395 HE1 TYR 58 HE1 TYR 58 6.990 -5.900 3.436
396 HE2 TYR 58 HE2 TYR 58 5.606 -9.958 3.922
397 HH TYR 58 HH TYR 58 7.329 -9.072 5.109
398 H LYS 59 H LYS 59 3.225 -10.028 -0.756
399 HA LYS 59 HA LYS 59 1.771 -10.225 -3.097
400 1HB LYS 59 1HB LYS 59 1.320 -11.680 -0.474
401 2HB LYS 59 2HB LYS 59 0.740 -12.171 -2.113
402 1HG LYS 59 1HG LYS 59 3.292 -12.072 -2.800
403 2HG LYS 59 2HG LYS 59 3.631 -12.072 -1.034
404 1HD LYS 59 1HD LYS 59 2.199 -14.219 -0.886
405 2HD LYS 59 2HD LYS 59 2.320 -14.286 -2.680
406 1HE LYS 59 1HE LYS 59 4.649 -14.235 -0.637
407 2HE LYS 59 2HE LYS 59 4.141 -15.644 -1.655
408 1HZ LYS 59 1HZ LYS 59 4.772 -14.409 -3.601
409 2HZ LYS 59 2HZ LYS 59 6.071 -14.523 -2.510
410 3HZ LYS 59 3HZ LYS 59 5.214 -13.064 -2.658
411 H ALA 60 H ALA 60 -0.548 -10.548 -3.332
412 HA ALA 60 HA ALA 60 -1.834 -8.230 -3.311
413 1HB ALA 60 1HB ALA 60 -2.345 -10.221 -4.683
414 2HB ALA 60 2HB ALA 60 -3.855 -9.573 -3.940
415 3HB ALA 60 3HB ALA 60 -3.050 -11.037 -3.247
416 H CYS 61 H CYS 61 -3.798 -7.370 -2.619
417 HA CYS 61 HA CYS 61 -4.515 -7.941 0.173
418 1HB CYS 61 1HB CYS 61 -3.347 -5.629 -0.552
419 2HB CYS 61 2HB CYS 61 -4.986 -5.196 -1.095
420 H HIS 62 H HIS 62 -5.695 -9.535 -1.382
421 HA HIS 62 HA HIS 62 -8.419 -8.478 -1.906
422 1HB HIS 62 1HB HIS 62 -6.949 -11.003 -2.749
423 2HB HIS 62 2HB HIS 62 -8.726 -10.864 -2.835
424 HD1 HIS 62 HD1 HIS 62 -6.408 -7.992 -3.713
425 HD2 HIS 62 HD2 HIS 62 -9.035 -10.683 -5.552
426 HE1 HIS 62 HE1 HIS 62 -6.677 -7.241 -6.093
427 HE2 HIS 62 HE2 HIS 62 -8.255 -8.887 -7.197
428 H ASN 63 H ASN 63 -9.464 -8.389 0.074
429 HA ASN 63 HA ASN 63 -8.712 -10.027 2.219
430 1HB ASN 63 1HB ASN 63 -11.242 -8.317 2.030
431 2HB ASN 63 2HB ASN 63 -10.474 -8.929 3.522
432 1HD2 ASN 63 1HD2 ASN 63 -8.067 -8.067 3.840
433 2HD2 ASN 63 2HD2 ASN 63 -7.936 -6.382 3.436
434 H SER 64 H SER 64 -11.873 -9.908 0.614
435 HA SER 64 HA SER 64 -12.277 -12.797 1.218
436 1HB SER 64 1HB SER 64 -13.350 -11.442 3.032
437 2HB SER 64 2HB SER 64 -14.284 -10.536 1.797
438 HG SER 64 HG SER 64 -15.600 -12.187 1.598
439 H GLU 65 H GLU 65 -11.574 -12.737 -1.135
440 HA GLU 65 HA GLU 65 -13.228 -11.734 -3.125
441 1HB GLU 65 1HB GLU 65 -12.143 -13.185 -4.706
442 2HB GLU 65 2HB GLU 65 -10.962 -12.415 -3.629
443 1HG GLU 65 1HG GLU 65 -11.975 -15.334 -3.266
444 2HG GLU 65 2HG GLU 65 -10.517 -14.892 -4.202
445 HE2 GLU 65 HE2 GLU 65 -9.020 -13.644 -3.147
446 H ILE 66 H ILE 66 -13.696 -14.527 -1.203
447 HA ILE 66 HA ILE 66 -16.283 -15.046 -2.330
448 HB ILE 66 HB ILE 66 -14.444 -16.202 -3.715
449 1HG1 ILE 66 1HG1 ILE 66 -16.707 -17.892 -2.530
450 2HG1 ILE 66 2HG1 ILE 66 -16.856 -16.631 -3.796
451 1HG2 ILE 66 1HG2 ILE 66 -14.381 -18.145 -1.302
452 2HG2 ILE 66 2HG2 ILE 66 -13.084 -16.956 -1.692
453 3HG2 ILE 66 3HG2 ILE 66 -13.470 -18.277 -2.847
454 1HD1 ILE 66 1HD1 ILE 66 -15.297 -17.914 -5.301
455 2HD1 ILE 66 2HD1 ILE 66 -16.752 -18.872 -4.865
456 3HD1 ILE 66 3HD1 ILE 66 -15.178 -19.224 -4.074
457 H GLU 67 H GLU 67 -17.432 -16.835 -0.948
458 HA GLU 67 HA GLU 67 -16.207 -17.624 1.426
459 1HB GLU 67 1HB GLU 67 -18.269 -16.877 2.802
460 2HB GLU 67 2HB GLU 67 -17.006 -15.649 2.480
461 1HG GLU 67 1HG GLU 67 -19.230 -14.627 2.261
462 2HG GLU 67 2HG GLU 67 -18.360 -14.588 0.694
463 HE2 GLU 67 HE2 GLU 67 -21.375 -17.236 1.002
Start of MODEL 8
1 1H GLY 1 1H GLY 1 -4.213 -17.674 5.795
2 2H GLY 1 2H GLY 1 -4.290 -18.720 7.134
3 3H GLY 1 3H GLY 1 -2.825 -18.517 6.296
4 1HA GLY 1 1HA GLY 1 -2.709 -16.242 6.933
5 2HA GLY 1 2HA GLY 1 -4.262 -16.470 7.847
6 H ASP 2 H ASP 2 -0.916 -16.382 8.155
7 HA ASP 2 HA ASP 2 -0.985 -17.424 10.863
8 1HB ASP 2 1HB ASP 2 0.861 -18.619 8.647
9 2HB ASP 2 2HB ASP 2 1.057 -18.921 10.407
10 HD2 ASP 2 HD2 ASP 2 -1.529 -21.025 8.264
11 H ASP 3 H ASP 3 -0.846 -14.900 9.839
12 HA ASP 3 HA ASP 3 1.560 -13.947 10.943
13 1HB ASP 3 1HB ASP 3 2.259 -14.588 8.523
14 2HB ASP 3 2HB ASP 3 1.074 -13.389 7.928
15 HD2 ASP 3 HD2 ASP 3 3.846 -13.911 9.803
16 H VAL 4 H VAL 4 0.474 -12.625 12.244
17 HA VAL 4 HA VAL 4 -2.108 -11.643 11.512
18 HB VAL 4 HB VAL 4 -2.310 -10.661 13.662
19 1HG1 VAL 4 1HG1 VAL 4 -2.156 -12.740 15.013
20 2HG1 VAL 4 2HG1 VAL 4 -1.045 -13.484 13.821
21 3HG1 VAL 4 3HG1 VAL 4 -2.746 -13.115 13.353
22 1HG2 VAL 4 1HG2 VAL 4 -0.584 -10.732 15.385
23 2HG2 VAL 4 2HG2 VAL 4 0.026 -9.793 13.996
24 3HG2 VAL 4 3HG2 VAL 4 0.597 -11.479 14.271
25 H LYS 5 H LYS 5 1.066 -10.284 11.340
26 HA LYS 5 HA LYS 5 -0.013 -7.662 10.669
27 1HB LYS 5 1HB LYS 5 2.823 -8.699 11.116
28 2HB LYS 5 2HB LYS 5 2.481 -7.011 10.644
29 1HG LYS 5 1HG LYS 5 1.369 -8.357 13.178
30 2HG LYS 5 2HG LYS 5 2.887 -7.419 13.154
31 1HD LYS 5 1HD LYS 5 1.848 -5.366 12.889
32 2HD LYS 5 2HD LYS 5 0.398 -6.015 12.068
33 1HE LYS 5 1HE LYS 5 0.982 -6.508 15.049
34 2HE LYS 5 2HE LYS 5 -0.024 -5.143 14.428
35 1HZ LYS 5 1HZ LYS 5 -1.488 -6.737 13.417
36 2HZ LYS 5 2HZ LYS 5 -1.349 -7.016 15.084
37 3HZ LYS 5 3HZ LYS 5 -0.549 -8.036 13.985
38 H SER 6 H SER 6 -0.572 -9.837 9.041
39 HA SER 6 HA SER 6 0.684 -9.733 6.532
40 1HB SER 6 1HB SER 6 -1.607 -10.462 5.640
41 2HB SER 6 2HB SER 6 -0.946 -11.471 6.983
42 HG SER 6 HG SER 6 -3.212 -10.828 7.268
43 H ALA 7 H ALA 7 0.552 -8.377 4.751
44 HA ALA 7 HA ALA 7 -1.259 -6.057 4.944
45 1HB ALA 7 1HB ALA 7 1.554 -6.340 3.706
46 2HB ALA 7 2HB ALA 7 1.166 -5.463 5.233
47 3HB ALA 7 3HB ALA 7 0.546 -4.834 3.664
48 H CYS 8 H CYS 8 -2.170 -5.312 3.016
49 HA CYS 8 HA CYS 8 -1.836 -7.078 0.653
50 1HB CYS 8 1HB CYS 8 -4.272 -5.382 1.304
51 2HB CYS 8 2HB CYS 8 -4.047 -6.457 -0.115
52 H CYS 9 H CYS 9 -0.849 -6.225 -1.054
53 HA CYS 9 HA CYS 9 -0.950 -3.309 -1.516
54 1HB CYS 9 1HB CYS 9 1.282 -4.169 -0.709
55 2HB CYS 9 2HB CYS 9 1.239 -5.425 -1.971
56 H ASP 10 H ASP 10 -1.307 -2.746 -3.767
57 HA ASP 10 HA ASP 10 -1.647 -5.037 -5.613
58 1HB ASP 10 1HB ASP 10 -3.368 -2.547 -5.156
59 2HB ASP 10 2HB ASP 10 -3.260 -3.273 -6.778
60 HD2 ASP 10 HD2 ASP 10 -5.420 -4.982 -4.020
61 H THR 11 H THR 11 -1.589 -1.499 -6.332
62 HA THR 11 HA THR 11 0.529 -2.003 -8.203
63 HB THR 11 HB THR 11 -0.642 0.724 -7.469
64 HG1 THR 11 HG1 THR 11 -2.214 -0.723 -8.440
65 1HG2 THR 11 1HG2 THR 11 1.628 0.755 -8.619
66 2HG2 THR 11 2HG2 THR 11 0.325 1.297 -9.715
67 3HG2 THR 11 3HG2 THR 11 0.992 -0.373 -9.870
68 H CYS 12 H CYS 12 2.409 -2.305 -7.515
69 HA CYS 12 HA CYS 12 3.599 -0.979 -5.226
70 1HB CYS 12 1HB CYS 12 3.914 -3.437 -5.845
71 2HB CYS 12 2HB CYS 12 4.853 -2.871 -7.297
72 H LEU 13 H LEU 13 5.434 0.442 -5.340
73 HA LEU 13 HA LEU 13 6.564 1.016 -7.954
74 1HB LEU 13 1HB LEU 13 4.602 2.528 -7.613
75 2HB LEU 13 2HB LEU 13 5.321 3.106 -6.086
76 HG LEU 13 HG LEU 13 5.459 4.692 -8.005
77 1HD1 LEU 13 1HD1 LEU 13 7.104 4.784 -6.131
78 2HD1 LEU 13 2HD1 LEU 13 7.731 5.459 -7.685
79 3HD1 LEU 13 3HD1 LEU 13 8.280 3.841 -7.128
80 1HD2 LEU 13 1HD2 LEU 13 5.765 3.029 -9.859
81 2HD2 LEU 13 2HD2 LEU 13 7.454 2.724 -9.288
82 3HD2 LEU 13 3HD2 LEU 13 6.992 4.352 -9.894
83 H CYS 14 H CYS 14 8.466 0.247 -7.403
84 HA CYS 14 HA CYS 14 9.847 1.329 -5.072
85 1HB CYS 14 1HB CYS 14 10.701 -0.889 -6.981
86 2HB CYS 14 2HB CYS 14 11.707 -0.235 -5.684
87 H THR 15 H THR 15 11.596 2.673 -5.157
88 HA THR 15 HA THR 15 11.881 4.078 -7.666
89 HB THR 15 HB THR 15 13.589 5.434 -6.638
90 HG1 THR 15 HG1 THR 15 13.994 5.210 -4.469
91 1HG2 THR 15 1HG2 THR 15 12.032 6.511 -5.011
92 2HG2 THR 15 2HG2 THR 15 11.062 5.005 -4.888
93 3HG2 THR 15 3HG2 THR 15 11.112 5.909 -6.443
94 H ARG 16 H ARG 16 13.548 4.219 -9.060
95 HA ARG 16 HA ARG 16 15.674 2.242 -8.950
96 1HB ARG 16 1HB ARG 16 14.899 4.381 -10.983
97 2HB ARG 16 2HB ARG 16 16.417 3.451 -11.113
98 1HG ARG 16 1HG ARG 16 13.656 2.130 -10.981
99 2HG ARG 16 2HG ARG 16 14.466 2.593 -12.508
100 1HD ARG 16 1HD ARG 16 16.326 1.052 -12.116
101 2HD ARG 16 2HD ARG 16 15.696 0.617 -10.469
102 HE ARG 16 HE ARG 16 13.529 -0.036 -11.867
103 1HH1 ARG 16 1HH1 ARG 16 16.928 -0.642 -12.831
104 2HH1 ARG 16 2HH1 ARG 16 16.558 -2.172 -13.562
105 1HH2 ARG 16 1HH2 ARG 16 13.098 -2.071 -12.827
106 2HH2 ARG 16 2HH2 ARG 16 14.373 -2.993 -13.559
107 H SER 17 H SER 17 17.368 2.699 -7.619
108 HA SER 17 HA SER 17 18.634 5.201 -7.372
109 1HB SER 17 1HB SER 17 16.316 5.680 -6.225
110 2HB SER 17 2HB SER 17 16.818 4.515 -4.969
111 HG SER 17 HG SER 17 17.235 6.784 -4.562
112 H GLN 18 H GLN 18 19.453 5.040 -4.789
113 HA GLN 18 HA GLN 18 20.691 2.413 -4.344
114 1HB GLN 18 1HB GLN 18 22.189 4.952 -5.175
115 2HB GLN 18 2HB GLN 18 22.999 3.533 -4.413
116 1HG GLN 18 1HG GLN 18 22.271 2.126 -6.419
117 2HG GLN 18 2HG GLN 18 21.594 3.609 -7.180
118 1HE2 GLN 18 1HE2 GLN 18 23.313 5.557 -7.159
119 2HE2 GLN 18 2HE2 GLN 18 24.899 5.079 -7.715
120 HA PRO 19 HA PRO 19 19.951 1.458 -2.683
121 1HB PRO 19 1HB PRO 19 18.460 1.125 -0.370
122 2HB PRO 19 2HB PRO 19 20.285 1.055 -0.395
123 1HG PRO 19 1HG PRO 19 18.507 3.468 0.296
124 2HG PRO 19 2HG PRO 19 19.853 2.764 1.278
125 1HD PRO 19 1HD PRO 19 20.278 4.893 -0.441
126 2HD PRO 19 2HD PRO 19 21.522 3.573 -0.248
127 HA PRO 20 HA PRO 20 15.844 2.627 -4.151
128 1HB PRO 20 1HB PRO 20 14.664 0.184 -4.559
129 2HB PRO 20 2HB PRO 20 16.084 0.695 -5.547
130 1HG PRO 20 1HG PRO 20 16.103 -1.055 -3.022
131 2HG PRO 20 2HG PRO 20 16.858 -1.427 -4.625
132 1HD PRO 20 1HD PRO 20 18.277 -0.289 -2.523
133 2HD PRO 20 2HD PRO 20 18.620 0.173 -4.257
134 H THR 21 H THR 21 13.634 2.613 -3.467
135 HA THR 21 HA THR 21 13.029 1.877 -0.686
136 HB THR 21 HB THR 21 13.377 4.739 -1.787
137 HG1 THR 21 HG1 THR 21 15.323 3.778 -1.055
138 1HG2 THR 21 1HG2 THR 21 11.434 4.615 -0.195
139 2HG2 THR 21 2HG2 THR 21 12.805 5.467 0.559
140 3HG2 THR 21 3HG2 THR 21 12.474 3.766 1.028
141 H CYS 22 H CYS 22 10.683 1.943 -0.369
142 HA CYS 22 HA CYS 22 9.332 2.158 -2.983
143 1HB CYS 22 1HB CYS 22 10.786 0.021 -2.689
144 2HB CYS 22 2HB CYS 22 9.679 -0.454 -1.379
145 H ARG 23 H ARG 23 7.193 1.250 -2.931
146 HA ARG 23 HA ARG 23 5.656 1.387 -0.516
147 1HB ARG 23 1HB ARG 23 4.457 3.563 -1.254
148 2HB ARG 23 2HB ARG 23 6.141 3.841 -0.730
149 1HG ARG 23 1HG ARG 23 6.947 4.203 -2.893
150 2HG ARG 23 2HG ARG 23 5.609 3.344 -3.699
151 1HD ARG 23 1HD ARG 23 5.513 5.807 -4.074
152 2HD ARG 23 2HD ARG 23 4.032 5.169 -3.272
153 HE ARG 23 HE ARG 23 6.251 6.797 -2.057
154 1HH1 ARG 23 1HH1 ARG 23 2.975 5.359 -1.616
155 2HH1 ARG 23 2HH1 ARG 23 2.677 6.249 -0.174
156 1HH2 ARG 23 1HH2 ARG 23 5.858 7.849 -0.181
157 2HH2 ARG 23 2HH2 ARG 23 4.376 7.663 0.721
158 H CYS 24 H CYS 24 3.353 1.464 -1.002
159 HA CYS 24 HA CYS 24 2.686 0.297 -3.633
160 1HB CYS 24 1HB CYS 24 1.271 0.033 -0.913
161 2HB CYS 24 2HB CYS 24 0.663 -0.650 -2.456
162 H VAL 25 H VAL 25 2.093 1.935 -4.904
163 HA VAL 25 HA VAL 25 0.994 4.353 -3.937
164 HB VAL 25 HB VAL 25 0.767 5.019 -6.296
165 1HG1 VAL 25 1HG1 VAL 25 2.813 5.469 -4.970
166 2HG1 VAL 25 2HG1 VAL 25 3.256 5.060 -6.665
167 3HG1 VAL 25 3HG1 VAL 25 3.465 3.835 -5.356
168 1HG2 VAL 25 1HG2 VAL 25 2.001 2.227 -6.878
169 2HG2 VAL 25 2HG2 VAL 25 1.777 3.565 -8.041
170 3HG2 VAL 25 3HG2 VAL 25 0.336 2.771 -7.331
171 H ASP 26 H ASP 26 -0.480 1.383 -4.764
172 HA ASP 26 HA ASP 26 -2.993 2.646 -5.440
173 1HB ASP 26 1HB ASP 26 -2.345 0.335 -6.298
174 2HB ASP 26 2HB ASP 26 -2.737 -0.294 -4.639
175 HD2 ASP 26 HD2 ASP 26 -6.024 -0.512 -5.566
176 H VAL 27 H VAL 27 -4.820 2.913 -4.294
177 HA VAL 27 HA VAL 27 -4.433 3.239 -1.470
178 HB VAL 27 HB VAL 27 -6.358 4.535 -1.446
179 1HG1 VAL 27 1HG1 VAL 27 -4.315 5.453 -2.682
180 2HG1 VAL 27 2HG1 VAL 27 -5.881 6.220 -3.139
181 3HG1 VAL 27 3HG1 VAL 27 -5.116 5.020 -4.233
182 1HG2 VAL 27 1HG2 VAL 27 -7.879 4.712 -3.481
183 2HG2 VAL 27 2HG2 VAL 27 -8.012 3.170 -2.574
184 3HG2 VAL 27 3HG2 VAL 27 -7.108 3.225 -4.139
185 H ARG 28 H ARG 28 -5.639 2.481 0.203
186 HA ARG 28 HA ARG 28 -7.365 0.140 -0.350
187 1HB ARG 28 1HB ARG 28 -5.606 0.888 2.026
188 2HB ARG 28 2HB ARG 28 -6.772 -0.483 2.065
189 1HG ARG 28 1HG ARG 28 -4.459 -0.218 0.041
190 2HG ARG 28 2HG ARG 28 -4.329 -1.089 1.615
191 1HD ARG 28 1HD ARG 28 -6.438 -1.867 -0.509
192 2HD ARG 28 2HD ARG 28 -4.762 -2.574 -0.407
193 HE ARG 28 HE ARG 28 -5.789 -2.682 2.203
194 1HH1 ARG 28 1HH1 ARG 28 -6.780 -4.026 -0.962
195 2HH1 ARG 28 2HH1 ARG 28 -7.556 -5.403 -0.250
196 1HH2 ARG 28 1HH2 ARG 28 -6.792 -4.389 3.076
197 2HH2 ARG 28 2HH2 ARG 28 -7.595 -5.634 2.128
198 H GLU 29 H GLU 29 -9.110 -0.173 1.125
199 HA GLU 29 HA GLU 29 -10.856 1.920 1.633
200 1HB GLU 29 1HB GLU 29 -10.548 -0.949 2.625
201 2HB GLU 29 2HB GLU 29 -11.967 0.058 3.070
202 1HG GLU 29 1HG GLU 29 -12.345 0.448 0.519
203 2HG GLU 29 2HG GLU 29 -11.194 -0.905 0.223
204 HE2 GLU 29 HE2 GLU 29 -13.454 -3.239 1.681
205 H SER 30 H SER 30 -8.265 0.730 3.457
206 HA SER 30 HA SER 30 -8.754 2.328 5.825
207 1HB SER 30 1HB SER 30 -8.588 -0.798 5.864
208 2HB SER 30 2HB SER 30 -8.556 0.211 7.344
209 HG SER 30 HG SER 30 -10.551 -0.637 7.049
210 H CYS 31 H CYS 31 -6.798 1.298 7.476
211 HA CYS 31 HA CYS 31 -4.546 0.584 5.716
212 1HB CYS 31 1HB CYS 31 -4.749 3.073 6.485
213 2HB CYS 31 2HB CYS 31 -4.258 2.468 8.119
214 H HIS 32 H HIS 32 -2.734 0.553 8.002
215 HA HIS 32 HA HIS 32 -3.528 -1.442 9.860
216 1HB HIS 32 1HB HIS 32 -3.423 -2.775 7.744
217 2HB HIS 32 2HB HIS 32 -1.755 -2.124 7.453
218 HD1 HIS 32 HD1 HIS 32 -3.378 -4.985 8.186
219 HD2 HIS 32 HD2 HIS 32 0.025 -3.216 9.835
220 HE1 HIS 32 HE1 HIS 32 -2.006 -6.833 9.121
221 HE2 HIS 32 HE2 HIS 32 0.112 -5.742 10.083
222 H SER 33 H SER 33 -1.705 -1.747 11.334
223 HA SER 33 HA SER 33 -0.070 0.607 11.441
224 1HB SER 33 1HB SER 33 0.028 -1.916 13.211
225 2HB SER 33 2HB SER 33 0.844 -0.365 13.596
226 HG SER 33 HG SER 33 -1.229 -0.774 14.587
227 H ALA 34 H ALA 34 0.573 -1.212 9.170
228 HA ALA 34 HA ALA 34 3.268 -2.145 9.776
229 1HB ALA 34 1HB ALA 34 1.467 -2.374 7.269
230 2HB ALA 34 2HB ALA 34 1.698 -3.656 8.519
231 3HB ALA 34 3HB ALA 34 3.068 -3.177 7.486
232 H CYS 35 H CYS 35 1.816 0.771 8.956
233 HA CYS 35 HA CYS 35 4.312 1.761 7.963
234 1HB CYS 35 1HB CYS 35 2.825 0.959 6.004
235 2HB CYS 35 2HB CYS 35 1.668 2.264 6.480
236 H ASP 36 H ASP 36 4.505 4.079 8.243
237 HA ASP 36 HA ASP 36 3.273 4.708 10.711
238 1HB ASP 36 1HB ASP 36 5.284 6.410 9.074
239 2HB ASP 36 2HB ASP 36 4.948 6.460 10.851
240 HD2 ASP 36 HD2 ASP 36 7.197 3.561 9.204
241 H LYS 37 H LYS 37 3.636 7.059 7.950
242 HA LYS 37 HA LYS 37 1.391 8.462 9.022
243 1HB LYS 37 1HB LYS 37 3.595 9.493 8.158
244 2HB LYS 37 2HB LYS 37 3.051 9.106 6.520
245 1HG LYS 37 1HG LYS 37 2.467 11.381 6.847
246 2HG LYS 37 2HG LYS 37 0.912 10.513 7.037
247 1HD LYS 37 1HD LYS 37 1.225 10.579 9.553
248 2HD LYS 37 2HD LYS 37 2.782 11.437 9.328
249 1HE LYS 37 1HE LYS 37 1.549 13.364 8.263
250 2HE LYS 37 2HE LYS 37 -0.022 12.498 8.537
251 1HZ LYS 37 1HZ LYS 37 1.936 13.285 10.630
252 2HZ LYS 37 2HZ LYS 37 0.467 12.476 10.884
253 3HZ LYS 37 3HZ LYS 37 0.470 14.062 10.281
254 H CYS 38 H CYS 38 -0.080 6.566 8.516
255 HA CYS 38 HA CYS 38 -1.075 6.607 5.797
256 1HB CYS 38 1HB CYS 38 -0.817 4.650 7.626
257 2HB CYS 38 2HB CYS 38 -2.499 5.141 8.017
258 H VAL 39 H VAL 39 -2.251 8.289 5.107
259 HA VAL 39 HA VAL 39 -4.159 9.486 6.995
260 HB VAL 39 HB VAL 39 -3.999 11.473 5.791
261 1HG1 VAL 39 1HG1 VAL 39 -1.914 10.921 7.156
262 2HG1 VAL 39 2HG1 VAL 39 -1.642 12.031 5.751
263 3HG1 VAL 39 3HG1 VAL 39 -1.159 10.300 5.624
264 1HG2 VAL 39 1HG2 VAL 39 -4.212 10.746 3.519
265 2HG2 VAL 39 2HG2 VAL 39 -2.624 9.843 3.631
266 3HG2 VAL 39 3HG2 VAL 39 -2.675 11.673 3.712
267 H CYS 40 H CYS 40 -6.363 9.967 5.945
268 HA CYS 40 HA CYS 40 -6.899 8.247 3.623
269 1HB CYS 40 1HB CYS 40 -8.298 8.265 6.321
270 2HB CYS 40 2HB CYS 40 -8.962 7.477 4.889
271 H ALA 41 H ALA 41 -8.175 9.095 2.264
272 HA ALA 41 HA ALA 41 -9.557 11.594 2.746
273 1HB ALA 41 1HB ALA 41 -10.291 11.514 0.469
274 2HB ALA 41 2HB ALA 41 -9.610 9.850 0.254
275 3HB ALA 41 3HB ALA 41 -8.513 11.255 0.553
276 H TYR 42 H TYR 42 -11.539 11.828 3.326
277 HA TYR 42 HA TYR 42 -13.067 9.654 4.295
278 1HB TYR 42 1HB TYR 42 -14.510 11.771 5.052
279 2HB TYR 42 2HB TYR 42 -12.829 11.538 5.678
280 HD1 TYR 42 HD1 TYR 42 -14.662 13.191 2.790
281 HD2 TYR 42 HD2 TYR 42 -11.187 13.273 5.344
282 HE1 TYR 42 HE1 TYR 42 -13.863 15.211 1.658
283 HE2 TYR 42 HE2 TYR 42 -10.423 15.309 4.222
284 HH TYR 42 HH TYR 42 -12.060 16.547 1.315
285 H SER 43 H SER 43 -12.782 9.942 1.472
286 HA SER 43 HA SER 43 -15.024 10.766 0.052
287 1HB SER 43 1HB SER 43 -13.061 8.534 -0.705
288 2HB SER 43 2HB SER 43 -14.046 9.571 -1.839
289 HG SER 43 HG SER 43 -12.017 10.350 -1.793
290 H ASN 44 H ASN 44 -15.713 8.745 -1.658
291 HA ASN 44 HA ASN 44 -16.886 6.561 -0.171
292 1HB ASN 44 1HB ASN 44 -18.457 8.525 -0.275
293 2HB ASN 44 2HB ASN 44 -18.359 8.518 -2.046
294 1HD2 ASN 44 1HD2 ASN 44 -19.145 6.283 -3.103
295 2HD2 ASN 44 2HD2 ASN 44 -20.464 5.519 -2.307
296 HA PRO 45 HA PRO 45 -16.237 4.654 -0.309
297 1HB PRO 45 1HB PRO 45 -14.428 2.700 -0.969
298 2HB PRO 45 2HB PRO 45 -16.071 2.648 -1.617
299 1HG PRO 45 1HG PRO 45 -13.580 3.812 -2.996
300 2HG PRO 45 2HG PRO 45 -14.729 2.612 -3.681
301 1HD PRO 45 1HD PRO 45 -14.909 5.373 -4.123
302 2HD PRO 45 2HD PRO 45 -16.388 4.312 -4.071
303 HA PRO 46 HA PRO 46 -12.831 6.935 1.153
304 1HB PRO 46 1HB PRO 46 -11.785 5.515 3.295
305 2HB PRO 46 2HB PRO 46 -13.426 6.263 3.315
306 1HG PRO 46 1HG PRO 46 -12.741 3.354 2.633
307 2HG PRO 46 2HG PRO 46 -13.963 4.004 3.825
308 1HD PRO 46 1HD PRO 46 -14.640 3.231 1.254
309 2HD PRO 46 2HD PRO 46 -15.417 4.739 2.062
310 H GLN 47 H GLN 47 -10.444 7.150 1.339
311 HA GLN 47 HA GLN 47 -9.004 5.038 -0.130
312 1HB GLN 47 1HB GLN 47 -8.578 8.053 -0.547
313 2HB GLN 47 2HB GLN 47 -7.892 6.699 -1.509
314 1HG GLN 47 1HG GLN 47 -10.902 7.447 -1.495
315 2HG GLN 47 2HG GLN 47 -9.686 8.200 -2.583
316 1HE2 GLN 47 1HE2 GLN 47 -10.847 4.914 -1.600
317 2HE2 GLN 47 2HE2 GLN 47 -10.687 4.204 -3.169
318 H CYS 48 H CYS 48 -6.855 4.839 0.578
319 HA CYS 48 HA CYS 48 -5.892 6.632 2.682
320 1HB CYS 48 1HB CYS 48 -6.396 3.598 2.904
321 2HB CYS 48 2HB CYS 48 -5.397 4.538 4.075
322 H GLN 49 H GLN 49 -3.769 6.763 2.714
323 HA GLN 49 HA GLN 49 -2.111 4.930 1.193
324 1HB GLN 49 1HB GLN 49 -2.573 7.935 0.778
325 2HB GLN 49 2HB GLN 49 -0.965 7.211 0.369
326 1HG GLN 49 1HG GLN 49 -2.171 5.558 -1.167
327 2HG GLN 49 2HG GLN 49 -3.666 6.542 -0.954
328 1HE2 GLN 49 1HE2 GLN 49 -3.268 9.026 -1.393
329 2HE2 GLN 49 2HE2 GLN 49 -2.314 9.349 -2.812
330 H CYS 50 H CYS 50 -0.114 4.743 2.014
331 HA CYS 50 HA CYS 50 0.507 6.319 4.424
332 1HB CYS 50 1HB CYS 50 0.767 3.760 4.417
333 2HB CYS 50 2HB CYS 50 2.103 3.992 3.251
334 H TYR 51 H TYR 51 1.271 8.201 4.008
335 HA TYR 51 HA TYR 51 2.899 8.926 1.845
336 1HB TYR 51 1HB TYR 51 1.951 10.309 4.368
337 2HB TYR 51 2HB TYR 51 3.334 11.040 3.492
338 HD1 TYR 51 HD1 TYR 51 3.091 11.764 1.066
339 HD2 TYR 51 HD2 TYR 51 -0.288 10.013 3.154
340 HE1 TYR 51 HE1 TYR 51 1.681 12.257 -0.791
341 HE2 TYR 51 HE2 TYR 51 -1.667 10.470 1.219
342 HH TYR 51 HH TYR 51 -1.824 11.264 -0.822
343 H ASP 52 H ASP 52 3.793 7.212 4.552
344 HA ASP 52 HA ASP 52 6.660 7.872 4.141
345 1HB ASP 52 1HB ASP 52 5.241 6.262 6.350
346 2HB ASP 52 2HB ASP 52 7.003 6.197 6.111
347 HD2 ASP 52 HD2 ASP 52 7.474 8.879 8.015
348 H THR 53 H THR 53 8.187 6.461 3.448
349 HA THR 53 HA THR 53 7.298 4.127 1.996
350 HB THR 53 HB THR 53 9.808 3.885 1.529
351 HG1 THR 53 HG1 THR 53 10.604 5.173 3.222
352 1HG2 THR 53 1HG2 THR 53 8.284 6.496 0.800
353 2HG2 THR 53 2HG2 THR 53 8.201 4.923 -0.072
354 3HG2 THR 53 3HG2 THR 53 9.732 5.865 -0.053
355 H HIS 54 H HIS 54 7.721 1.971 2.549
356 HA HIS 54 HA HIS 54 9.477 1.441 4.691
357 1HB HIS 54 1HB HIS 54 7.398 1.919 6.076
358 2HB HIS 54 2HB HIS 54 6.585 0.529 5.308
359 HD1 HIS 54 HD1 HIS 54 6.418 -0.104 7.827
360 HD2 HIS 54 HD2 HIS 54 10.325 -0.340 6.305
361 HE1 HIS 54 HE1 HIS 54 7.764 -1.374 9.476
362 HE2 HIS 54 HE2 HIS 54 10.145 -1.502 8.544
363 H LYS 55 H LYS 55 6.683 -0.449 3.306
364 HA LYS 55 HA LYS 55 8.425 -2.567 2.869
365 1HB LYS 55 1HB LYS 55 6.383 -3.786 2.347
366 2HB LYS 55 2HB LYS 55 6.168 -2.800 3.791
367 1HG LYS 55 1HG LYS 55 5.257 -1.691 1.091
368 2HG LYS 55 2HG LYS 55 4.316 -3.001 1.851
369 1HD LYS 55 1HD LYS 55 4.894 -0.379 3.377
370 2HD LYS 55 2HD LYS 55 3.542 -0.586 2.229
371 1HE LYS 55 1HE LYS 55 2.665 -0.936 4.446
372 2HE LYS 55 2HE LYS 55 2.640 -2.511 3.561
373 1HZ LYS 55 1HZ LYS 55 3.384 -2.802 5.793
374 2HZ LYS 55 2HZ LYS 55 4.610 -1.646 5.627
375 3HZ LYS 55 3HZ LYS 55 4.687 -3.098 4.752
376 H PHE 56 H PHE 56 8.243 -3.923 0.913
377 HA PHE 56 HA PHE 56 8.486 -2.361 -1.539
378 1HB PHE 56 1HB PHE 56 9.773 -4.407 -2.382
379 2HB PHE 56 2HB PHE 56 10.519 -3.544 -1.026
380 HD1 PHE 56 HD1 PHE 56 9.005 -6.748 -2.061
381 HD2 PHE 56 HD2 PHE 56 10.403 -4.458 1.315
382 HE1 PHE 56 HE1 PHE 56 9.018 -8.768 -0.688
383 HE2 PHE 56 HE2 PHE 56 10.422 -6.490 2.672
384 HZ PHE 56 HZ PHE 56 9.677 -8.659 1.700
385 H CYS 57 H CYS 57 7.980 -4.639 -3.351
386 HA CYS 57 HA CYS 57 5.182 -4.483 -3.385
387 1HB CYS 57 1HB CYS 57 7.051 -6.395 -4.874
388 2HB CYS 57 2HB CYS 57 5.398 -5.912 -5.378
389 H TYR 58 H TYR 58 3.663 -5.765 -2.529
390 HA TYR 58 HA TYR 58 4.533 -8.295 -1.250
391 1HB TYR 58 1HB TYR 58 3.891 -5.980 0.032
392 2HB TYR 58 2HB TYR 58 2.222 -6.564 -0.268
393 HD1 TYR 58 HD1 TYR 58 5.584 -7.850 0.979
394 HD2 TYR 58 HD2 TYR 58 1.293 -7.919 1.422
395 HE1 TYR 58 HE1 TYR 58 5.797 -9.422 2.807
396 HE2 TYR 58 HE2 TYR 58 1.504 -9.553 3.197
397 HH TYR 58 HH TYR 58 4.669 -10.773 4.339
398 H LYS 59 H LYS 59 2.555 -9.424 -0.498
399 HA LYS 59 HA LYS 59 0.958 -10.549 -2.504
400 1HB LYS 59 1HB LYS 59 0.467 -10.319 0.510
401 2HB LYS 59 2HB LYS 59 -0.407 -11.434 -0.599
402 1HG LYS 59 1HG LYS 59 1.728 -12.700 -1.000
403 2HG LYS 59 2HG LYS 59 2.635 -11.546 0.029
404 1HD LYS 59 1HD LYS 59 0.952 -12.092 1.922
405 2HD LYS 59 2HD LYS 59 0.485 -13.523 0.939
406 1HE LYS 59 1HE LYS 59 3.324 -12.802 1.976
407 2HE LYS 59 2HE LYS 59 2.240 -14.094 2.647
408 1HZ LYS 59 1HZ LYS 59 3.337 -13.987 -0.112
409 2HZ LYS 59 2HZ LYS 59 2.360 -15.216 0.533
410 3HZ LYS 59 3HZ LYS 59 3.921 -14.951 1.155
411 H ALA 60 H ALA 60 -1.270 -10.336 -2.982
412 HA ALA 60 HA ALA 60 -2.511 -7.786 -2.207
413 1HB ALA 60 1HB ALA 60 -2.078 -8.129 -4.616
414 2HB ALA 60 2HB ALA 60 -3.856 -8.182 -4.311
415 3HB ALA 60 3HB ALA 60 -2.914 -9.717 -4.554
416 H CYS 61 H CYS 61 -4.847 -7.846 -1.982
417 HA CYS 61 HA CYS 61 -6.024 -10.391 -1.673
418 1HB CYS 61 1HB CYS 61 -7.089 -10.157 0.444
419 2HB CYS 61 2HB CYS 61 -5.300 -10.082 0.589
420 H HIS 62 H HIS 62 -7.189 -10.153 -3.394
421 HA HIS 62 HA HIS 62 -9.100 -7.950 -3.674
422 1HB HIS 62 1HB HIS 62 -8.682 -10.527 -5.296
423 2HB HIS 62 2HB HIS 62 -9.809 -9.210 -5.726
424 HD1 HIS 62 HD1 HIS 62 -8.673 -6.805 -6.079
425 HD2 HIS 62 HD2 HIS 62 -6.053 -10.069 -6.129
426 HE1 HIS 62 HE1 HIS 62 -6.548 -6.007 -7.134
427 HE2 HIS 62 HE2 HIS 62 -4.949 -7.988 -7.139
428 H ASN 63 H ASN 63 -8.882 -11.063 -2.168
429 HA ASN 63 HA ASN 63 -11.285 -11.184 -1.020
430 1HB ASN 63 1HB ASN 63 -12.224 -13.227 -2.251
431 2HB ASN 63 2HB ASN 63 -12.358 -11.639 -3.055
432 1HD2 ASN 63 1HD2 ASN 63 -12.193 -12.176 -5.332
433 2HD2 ASN 63 2HD2 ASN 63 -10.779 -12.927 -5.966
434 H SER 64 H SER 64 -10.915 -14.258 -1.107
435 HA SER 64 HA SER 64 -9.204 -14.088 1.127
436 1HB SER 64 1HB SER 64 -11.416 -15.514 0.645
437 2HB SER 64 2HB SER 64 -10.268 -16.788 0.164
438 HG SER 64 HG SER 64 -10.581 -15.385 2.632
439 H GLU 65 H GLU 65 -7.354 -13.540 -0.632
440 HA GLU 65 HA GLU 65 -5.726 -15.694 -1.483
441 1HB GLU 65 1HB GLU 65 -5.096 -12.766 -0.907
442 2HB GLU 65 2HB GLU 65 -3.822 -13.968 -1.321
443 1HG GLU 65 1HG GLU 65 -4.466 -12.738 -3.314
444 2HG GLU 65 2HG GLU 65 -4.859 -14.482 -3.479
445 HE2 GLU 65 HE2 GLU 65 -8.213 -13.963 -3.899
446 H ILE 66 H ILE 66 -4.716 -13.614 1.239
447 HA ILE 66 HA ILE 66 -3.357 -15.828 2.406
448 HB ILE 66 HB ILE 66 -2.270 -13.749 2.182
449 1HG1 ILE 66 1HG1 ILE 66 -2.724 -14.241 5.173
450 2HG1 ILE 66 2HG1 ILE 66 -1.914 -15.451 4.115
451 1HG2 ILE 66 1HG2 ILE 66 -2.815 -11.751 3.491
452 2HG2 ILE 66 2HG2 ILE 66 -4.221 -12.552 4.251
453 3HG2 ILE 66 3HG2 ILE 66 -4.231 -12.162 2.478
454 1HD1 ILE 66 1HD1 ILE 66 -0.255 -13.975 5.308
455 2HD1 ILE 66 2HD1 ILE 66 -0.935 -12.534 4.470
456 3HD1 ILE 66 3HD1 ILE 66 -0.135 -13.838 3.520
457 H GLU 67 H GLU 67 -6.217 -13.892 3.188
458 HA GLU 67 HA GLU 67 -7.336 -15.736 4.910
459 1HB GLU 67 1HB GLU 67 -7.613 -14.146 6.802
460 2HB GLU 67 2HB GLU 67 -5.853 -14.359 6.498
461 1HG GLU 67 1HG GLU 67 -6.207 -12.182 4.913
462 2HG GLU 67 2HG GLU 67 -7.658 -11.927 5.925
463 HE2 GLU 67 HE2 GLU 67 -5.779 -10.519 8.408
Start of MODEL 9
1 1H GLY 1 1H GLY 1 -7.374 -17.437 9.664
2 2H GLY 1 2H GLY 1 -8.155 -18.603 10.620
3 3H GLY 1 3H GLY 1 -7.831 -17.064 11.261
4 1HA GLY 1 1HA GLY 1 -9.642 -17.703 9.035
5 2HA GLY 1 2HA GLY 1 -10.110 -17.229 10.720
6 H ASP 2 H ASP 2 -9.296 -15.096 11.434
7 HA ASP 2 HA ASP 2 -8.432 -13.148 9.460
8 1HB ASP 2 1HB ASP 2 -11.032 -13.235 9.284
9 2HB ASP 2 2HB ASP 2 -11.088 -12.732 11.009
10 HD2 ASP 2 HD2 ASP 2 -9.347 -9.674 9.603
11 H ASP 3 H ASP 3 -6.662 -13.550 10.862
12 HA ASP 3 HA ASP 3 -6.461 -11.768 13.060
13 1HB ASP 3 1HB ASP 3 -5.778 -13.715 14.716
14 2HB ASP 3 2HB ASP 3 -7.506 -13.340 14.474
15 HD2 ASP 3 HD2 ASP 3 -8.704 -14.868 13.995
16 H VAL 4 H VAL 4 -5.133 -11.621 10.815
17 HA VAL 4 HA VAL 4 -2.431 -12.592 11.462
18 HB VAL 4 HB VAL 4 -3.448 -12.067 8.648
19 1HG1 VAL 4 1HG1 VAL 4 -1.099 -13.748 9.812
20 2HG1 VAL 4 2HG1 VAL 4 -0.924 -12.127 9.045
21 3HG1 VAL 4 3HG1 VAL 4 -1.473 -13.522 8.069
22 1HG2 VAL 4 1HG2 VAL 4 -4.895 -13.892 9.443
23 2HG2 VAL 4 2HG2 VAL 4 -3.486 -14.734 10.209
24 3HG2 VAL 4 3HG2 VAL 4 -3.615 -14.602 8.415
25 H LYS 5 H LYS 5 -0.863 -11.020 11.370
26 HA LYS 5 HA LYS 5 -1.794 -8.282 11.212
27 1HB LYS 5 1HB LYS 5 0.049 -7.765 12.650
28 2HB LYS 5 2HB LYS 5 -0.660 -9.299 13.210
29 1HG LYS 5 1HG LYS 5 1.295 -10.387 11.649
30 2HG LYS 5 2HG LYS 5 2.049 -8.793 11.908
31 1HD LYS 5 1HD LYS 5 1.913 -9.104 14.382
32 2HD LYS 5 2HD LYS 5 0.954 -10.606 14.145
33 1HE LYS 5 1HE LYS 5 2.933 -11.640 12.921
34 2HE LYS 5 2HE LYS 5 3.923 -10.189 13.381
35 1HZ LYS 5 1HZ LYS 5 2.484 -11.963 15.275
36 2HZ LYS 5 2HZ LYS 5 3.535 -10.688 15.668
37 3HZ LYS 5 3HZ LYS 5 4.135 -12.076 14.893
38 H SER 6 H SER 6 -1.031 -10.055 8.898
39 HA SER 6 HA SER 6 1.227 -9.142 7.555
40 1HB SER 6 1HB SER 6 -1.424 -10.064 6.331
41 2HB SER 6 2HB SER 6 0.114 -9.843 5.405
42 HG SER 6 HG SER 6 -0.074 -11.961 5.984
43 H ALA 7 H ALA 7 1.707 -7.628 5.949
44 HA ALA 7 HA ALA 7 -0.299 -5.574 5.359
45 1HB ALA 7 1HB ALA 7 2.659 -5.870 4.560
46 2HB ALA 7 2HB ALA 7 2.077 -4.833 5.894
47 3HB ALA 7 3HB ALA 7 1.624 -4.446 4.184
48 H CYS 8 H CYS 8 -1.031 -5.221 3.267
49 HA CYS 8 HA CYS 8 -0.326 -7.138 1.184
50 1HB CYS 8 1HB CYS 8 -2.621 -7.564 0.578
51 2HB CYS 8 2HB CYS 8 -2.322 -8.111 2.247
52 H CYS 9 H CYS 9 -0.879 -6.317 -0.983
53 HA CYS 9 HA CYS 9 -1.618 -3.529 -1.175
54 1HB CYS 9 1HB CYS 9 0.805 -3.483 -0.404
55 2HB CYS 9 2HB CYS 9 1.241 -4.444 -1.840
56 H ASP 10 H ASP 10 -2.574 -3.228 -3.244
57 HA ASP 10 HA ASP 10 -2.254 -5.422 -5.176
58 1HB ASP 10 1HB ASP 10 -4.289 -3.207 -4.697
59 2HB ASP 10 2HB ASP 10 -4.399 -4.313 -6.069
60 HD2 ASP 10 HD2 ASP 10 -5.738 -3.956 -3.276
61 H THR 11 H THR 11 -1.071 -2.240 -4.781
62 HA THR 11 HA THR 11 -0.355 -2.009 -7.605
63 HB THR 11 HB THR 11 -1.986 0.219 -6.260
64 HG1 THR 11 HG1 THR 11 -2.837 -1.702 -8.175
65 1HG2 THR 11 1HG2 THR 11 -0.432 1.013 -8.006
66 2HG2 THR 11 2HG2 THR 11 -2.104 1.079 -8.632
67 3HG2 THR 11 3HG2 THR 11 -0.998 -0.247 -9.156
68 H CYS 12 H CYS 12 1.659 -1.237 -7.638
69 HA CYS 12 HA CYS 12 2.769 0.016 -5.246
70 1HB CYS 12 1HB CYS 12 2.187 -2.494 -4.943
71 2HB CYS 12 2HB CYS 12 3.426 -2.822 -6.228
72 H LEU 13 H LEU 13 5.021 0.379 -5.360
73 HA LEU 13 HA LEU 13 6.289 0.470 -7.996
74 1HB LEU 13 1HB LEU 13 4.846 2.448 -7.932
75 2HB LEU 13 2HB LEU 13 5.215 2.726 -6.203
76 HG LEU 13 HG LEU 13 7.661 3.270 -6.977
77 1HD1 LEU 13 1HD1 LEU 13 7.900 3.892 -9.405
78 2HD1 LEU 13 2HD1 LEU 13 6.248 3.227 -9.717
79 3HD1 LEU 13 3HD1 LEU 13 7.574 2.136 -9.180
80 1HD2 LEU 13 1HD2 LEU 13 5.375 5.058 -8.007
81 2HD2 LEU 13 2HD2 LEU 13 7.089 5.552 -7.738
82 3HD2 LEU 13 3HD2 LEU 13 6.071 5.046 -6.340
83 H CYS 14 H CYS 14 8.127 -0.520 -7.454
84 HA CYS 14 HA CYS 14 9.685 0.512 -5.206
85 1HB CYS 14 1HB CYS 14 10.301 -1.755 -7.107
86 2HB CYS 14 2HB CYS 14 11.401 -1.171 -5.844
87 H THR 15 H THR 15 11.604 1.628 -5.291
88 HA THR 15 HA THR 15 11.763 3.246 -7.682
89 HB THR 15 HB THR 15 13.358 4.634 -6.516
90 HG1 THR 15 HG1 THR 15 13.334 4.018 -4.109
91 1HG2 THR 15 1HG2 THR 15 11.787 5.451 -4.769
92 2HG2 THR 15 2HG2 THR 15 10.919 3.873 -4.758
93 3HG2 THR 15 3HG2 THR 15 10.877 4.916 -6.231
94 H ARG 16 H ARG 16 13.636 3.775 -8.843
95 HA ARG 16 HA ARG 16 15.994 2.094 -8.518
96 1HB ARG 16 1HB ARG 16 15.352 4.434 -10.383
97 2HB ARG 16 2HB ARG 16 17.019 3.816 -10.171
98 1HG ARG 16 1HG ARG 16 14.668 2.204 -11.279
99 2HG ARG 16 2HG ARG 16 16.010 2.949 -12.206
100 1HD ARG 16 1HD ARG 16 17.674 1.522 -10.894
101 2HD ARG 16 2HD ARG 16 16.286 0.623 -10.168
102 HE ARG 16 HE ARG 16 17.369 0.379 -12.878
103 1HH1 ARG 16 1HH1 ARG 16 14.384 0.009 -10.937
104 2HH1 ARG 16 2HH1 ARG 16 13.731 -1.231 -11.954
105 1HH2 ARG 16 1HH2 ARG 16 16.497 -1.329 -14.169
106 2HH2 ARG 16 2HH2 ARG 16 14.928 -1.978 -13.828
107 H SER 17 H SER 17 17.407 2.624 -6.929
108 HA SER 17 HA SER 17 18.329 5.166 -6.382
109 1HB SER 17 1HB SER 17 15.973 5.397 -5.241
110 2HB SER 17 2HB SER 17 16.581 4.209 -4.052
111 HG SER 17 HG SER 17 17.147 6.099 -3.169
112 H GLN 18 H GLN 18 19.456 5.042 -4.124
113 HA GLN 18 HA GLN 18 20.500 2.410 -3.424
114 1HB GLN 18 1HB GLN 18 22.103 4.582 -4.840
115 2HB GLN 18 2HB GLN 18 22.914 3.334 -3.824
116 1HG GLN 18 1HG GLN 18 21.933 1.508 -5.301
117 2HG GLN 18 2HG GLN 18 21.219 2.760 -6.358
118 1HE2 GLN 18 1HE2 GLN 18 24.138 1.078 -5.514
119 2HE2 GLN 18 2HE2 GLN 18 25.194 1.903 -6.658
120 HA PRO 19 HA PRO 19 20.247 1.715 -1.386
121 1HB PRO 19 1HB PRO 19 18.749 1.922 0.947
122 2HB PRO 19 2HB PRO 19 20.579 1.989 0.949
123 1HG PRO 19 1HG PRO 19 18.627 4.367 0.900
124 2HG PRO 19 2HG PRO 19 19.983 4.067 2.065
125 1HD PRO 19 1HD PRO 19 20.308 5.648 -0.181
126 2HD PRO 19 2HD PRO 19 21.646 4.548 0.379
127 HA PRO 20 HA PRO 20 16.375 2.181 -3.453
128 1HB PRO 20 1HB PRO 20 15.222 -0.306 -3.260
129 2HB PRO 20 2HB PRO 20 16.819 -0.082 -4.079
130 1HG PRO 20 1HG PRO 20 16.328 -0.892 -1.152
131 2HG PRO 20 2HG PRO 20 17.315 -1.778 -2.393
132 1HD PRO 20 1HD PRO 20 18.453 0.012 -0.608
133 2HD PRO 20 2HD PRO 20 19.039 -0.089 -2.348
134 H THR 21 H THR 21 13.905 1.885 -3.231
135 HA THR 21 HA THR 21 12.858 1.795 -0.524
136 HB THR 21 HB THR 21 11.608 4.113 -1.333
137 HG1 THR 21 HG1 THR 21 14.318 4.568 -1.898
138 1HG2 THR 21 1HG2 THR 21 14.285 3.999 0.215
139 2HG2 THR 21 2HG2 THR 21 12.661 3.622 0.901
140 3HG2 THR 21 3HG2 THR 21 13.043 5.284 0.331
141 H CYS 22 H CYS 22 10.551 1.514 -0.544
142 HA CYS 22 HA CYS 22 9.330 1.449 -3.199
143 1HB CYS 22 1HB CYS 22 10.629 -0.711 -2.882
144 2HB CYS 22 2HB CYS 22 9.608 -1.050 -1.482
145 H ARG 23 H ARG 23 7.049 0.750 -3.036
146 HA ARG 23 HA ARG 23 5.670 2.067 -0.825
147 1HB ARG 23 1HB ARG 23 6.756 3.324 -3.387
148 2HB ARG 23 2HB ARG 23 5.112 3.837 -2.906
149 1HG ARG 23 1HG ARG 23 7.561 4.147 -1.138
150 2HG ARG 23 2HG ARG 23 6.872 5.422 -2.197
151 1HD ARG 23 1HD ARG 23 5.386 4.088 0.167
152 2HD ARG 23 2HD ARG 23 6.113 5.739 0.179
153 HE ARG 23 HE ARG 23 3.580 4.888 -0.992
154 1HH1 ARG 23 1HH1 ARG 23 6.165 7.337 -1.391
155 2HH1 ARG 23 2HH1 ARG 23 5.123 8.494 -2.130
156 1HH2 ARG 23 1HH2 ARG 23 2.264 6.340 -1.995
157 2HH2 ARG 23 2HH2 ARG 23 2.798 7.914 -2.495
158 H CYS 24 H CYS 24 3.574 2.006 -1.023
159 HA CYS 24 HA CYS 24 2.308 0.760 -3.403
160 1HB CYS 24 1HB CYS 24 1.196 1.410 -0.626
161 2HB CYS 24 2HB CYS 24 0.211 0.735 -1.963
162 H VAL 25 H VAL 25 0.330 1.915 -4.087
163 HA VAL 25 HA VAL 25 0.290 4.813 -4.120
164 HB VAL 25 HB VAL 25 0.742 4.648 -6.658
165 1HG1 VAL 25 1HG1 VAL 25 2.493 5.609 -5.026
166 2HG1 VAL 25 2HG1 VAL 25 3.145 4.899 -6.559
167 3HG1 VAL 25 3HG1 VAL 25 3.275 3.975 -5.041
168 1HG2 VAL 25 1HG2 VAL 25 2.174 2.047 -5.818
169 2HG2 VAL 25 2HG2 VAL 25 2.074 2.747 -7.478
170 3HG2 VAL 25 3HG2 VAL 25 0.598 2.072 -6.684
171 H ASP 26 H ASP 26 -1.556 3.200 -3.239
172 HA ASP 26 HA ASP 26 -3.656 3.482 -5.215
173 1HB ASP 26 1HB ASP 26 -4.847 1.557 -3.893
174 2HB ASP 26 2HB ASP 26 -3.615 1.095 -5.103
175 HD2 ASP 26 HD2 ASP 26 -2.042 0.007 -4.469
176 H VAL 27 H VAL 27 -5.627 4.333 -4.336
177 HA VAL 27 HA VAL 27 -5.460 5.263 -1.561
178 HB VAL 27 HB VAL 27 -6.806 6.595 -3.919
179 1HG1 VAL 27 1HG1 VAL 27 -7.927 7.102 -1.736
180 2HG1 VAL 27 2HG1 VAL 27 -6.904 8.509 -2.183
181 3HG1 VAL 27 3HG1 VAL 27 -6.318 7.343 -0.940
182 1HG2 VAL 27 1HG2 VAL 27 -4.367 6.827 -4.163
183 2HG2 VAL 27 2HG2 VAL 27 -4.209 7.116 -2.381
184 3HG2 VAL 27 3HG2 VAL 27 -4.982 8.366 -3.439
185 H ARG 28 H ARG 28 -6.332 3.441 -0.889
186 HA ARG 28 HA ARG 28 -9.203 3.113 -0.958
187 1HB ARG 28 1HB ARG 28 -7.263 1.318 -2.421
188 2HB ARG 28 2HB ARG 28 -8.576 0.494 -1.503
189 1HG ARG 28 1HG ARG 28 -10.308 1.715 -2.702
190 2HG ARG 28 2HG ARG 28 -9.054 2.563 -3.695
191 1HD ARG 28 1HD ARG 28 -8.279 0.439 -4.646
192 2HD ARG 28 2HD ARG 28 -9.353 -0.512 -3.552
193 HE ARG 28 HE ARG 28 -10.183 1.200 -5.897
194 1HH1 ARG 28 1HH1 ARG 28 -11.224 -0.932 -3.217
195 2HH1 ARG 28 2HH1 ARG 28 -12.867 -1.017 -3.768
196 1HH2 ARG 28 1HH2 ARG 28 -12.391 1.115 -6.559
197 2HH2 ARG 28 2HH2 ARG 28 -13.535 0.172 -5.662
198 H GLU 29 H GLU 29 -6.583 0.907 -0.613
199 HA GLU 29 HA GLU 29 -7.349 -0.415 1.439
200 1HB GLU 29 1HB GLU 29 -4.680 0.020 0.190
201 2HB GLU 29 2HB GLU 29 -4.854 -1.152 1.541
202 1HG GLU 29 1HG GLU 29 -6.484 -2.511 0.295
203 2HG GLU 29 2HG GLU 29 -6.518 -1.342 -1.078
204 HE2 GLU 29 HE2 GLU 29 -3.278 -1.910 -1.963
205 H SER 30 H SER 30 -7.737 -0.124 3.252
206 HA SER 30 HA SER 30 -6.578 1.580 5.190
207 1HB SER 30 1HB SER 30 -7.565 0.024 6.945
208 2HB SER 30 2HB SER 30 -8.754 0.616 5.730
209 HG SER 30 HG SER 30 -9.051 -1.569 6.016
210 H CYS 31 H CYS 31 -5.300 1.109 7.058
211 HA CYS 31 HA CYS 31 -2.860 0.056 5.943
212 1HB CYS 31 1HB CYS 31 -3.594 1.495 8.516
213 2HB CYS 31 2HB CYS 31 -1.874 1.074 8.121
214 H HIS 32 H HIS 32 -1.210 -1.049 7.355
215 HA HIS 32 HA HIS 32 -2.315 -2.776 9.400
216 1HB HIS 32 1HB HIS 32 -0.585 -3.860 7.112
217 2HB HIS 32 2HB HIS 32 -1.150 -4.822 8.550
218 HD1 HIS 32 HD1 HIS 32 -2.257 -3.437 5.299
219 HD2 HIS 32 HD2 HIS 32 -3.715 -5.889 8.367
220 HE1 HIS 32 HE1 HIS 32 -4.275 -4.576 4.397
221 HE2 HIS 32 HE2 HIS 32 -5.145 -6.106 6.259
222 H SER 33 H SER 33 0.629 -4.011 9.458
223 HA SER 33 HA SER 33 1.396 -2.049 11.327
224 1HB SER 33 1HB SER 33 2.637 -4.695 10.395
225 2HB SER 33 2HB SER 33 3.132 -3.807 11.878
226 HG SER 33 HG SER 33 1.705 -5.414 12.350
227 H ALA 34 H ALA 34 2.907 -3.196 8.233
228 HA ALA 34 HA ALA 34 5.197 -1.702 8.452
229 1HB ALA 34 1HB ALA 34 4.897 -3.621 6.860
230 2HB ALA 34 2HB ALA 34 5.455 -2.153 6.012
231 3HB ALA 34 3HB ALA 34 3.716 -2.645 5.919
232 H CYS 35 H CYS 35 2.179 -0.461 8.070
233 HA CYS 35 HA CYS 35 3.111 1.972 6.649
234 1HB CYS 35 1HB CYS 35 1.296 0.668 5.537
235 2HB CYS 35 2HB CYS 35 0.265 0.940 7.007
236 H ASP 36 H ASP 36 3.720 3.529 8.116
237 HA ASP 36 HA ASP 36 2.201 3.849 10.581
238 1HB ASP 36 1HB ASP 36 4.014 5.431 11.189
239 2HB ASP 36 2HB ASP 36 4.668 3.845 10.683
240 HD2 ASP 36 HD2 ASP 36 5.156 6.962 10.438
241 H LYS 37 H LYS 37 3.156 6.032 7.827
242 HA LYS 37 HA LYS 37 1.157 7.910 8.668
243 1HB LYS 37 1HB LYS 37 3.445 8.608 7.831
244 2HB LYS 37 2HB LYS 37 2.958 8.066 6.214
245 1HG LYS 37 1HG LYS 37 2.707 10.465 6.365
246 2HG LYS 37 2HG LYS 37 1.087 9.729 6.172
247 1HD LYS 37 1HD LYS 37 0.568 10.067 8.554
248 2HD LYS 37 2HD LYS 37 2.257 10.591 8.898
249 1HE LYS 37 1HE LYS 37 1.982 12.634 7.546
250 2HE LYS 37 2HE LYS 37 0.345 12.103 6.996
251 1HZ LYS 37 1HZ LYS 37 1.126 12.677 9.807
252 2HZ LYS 37 2HZ LYS 37 -0.412 12.209 9.260
253 3HZ LYS 37 3HZ LYS 37 0.244 13.693 8.769
254 H CYS 38 H CYS 38 -0.631 6.611 8.476
255 HA CYS 38 HA CYS 38 -1.899 6.175 5.912
256 1HB CYS 38 1HB CYS 38 -2.658 6.081 8.893
257 2HB CYS 38 2HB CYS 38 -3.748 5.451 7.586
258 H VAL 39 H VAL 39 -2.750 8.061 4.857
259 HA VAL 39 HA VAL 39 -4.317 9.764 6.674
260 HB VAL 39 HB VAL 39 -3.624 11.647 5.783
261 1HG1 VAL 39 1HG1 VAL 39 -1.249 9.930 4.902
262 2HG1 VAL 39 2HG1 VAL 39 -1.541 10.548 6.594
263 3HG1 VAL 39 3HG1 VAL 39 -1.269 11.704 5.224
264 1HG2 VAL 39 1HG2 VAL 39 -2.709 11.870 3.461
265 2HG2 VAL 39 2HG2 VAL 39 -4.432 11.314 3.510
266 3HG2 VAL 39 3HG2 VAL 39 -3.088 10.101 3.220
267 H CYS 40 H CYS 40 -6.419 10.418 5.661
268 HA CYS 40 HA CYS 40 -7.236 8.619 3.476
269 1HB CYS 40 1HB CYS 40 -8.440 8.847 6.235
270 2HB CYS 40 2HB CYS 40 -9.220 8.008 4.892
271 H ALA 41 H ALA 41 -8.477 9.439 2.142
272 HA ALA 41 HA ALA 41 -9.604 12.070 2.259
273 1HB ALA 41 1HB ALA 41 -8.603 11.194 0.152
274 2HB ALA 41 2HB ALA 41 -10.341 11.638 -0.022
275 3HB ALA 41 3HB ALA 41 -9.855 9.894 0.127
276 H TYR 42 H TYR 42 -11.695 12.690 2.315
277 HA TYR 42 HA TYR 42 -13.776 10.797 2.889
278 1HB TYR 42 1HB TYR 42 -15.267 12.800 3.001
279 2HB TYR 42 2HB TYR 42 -13.869 12.769 4.103
280 HD1 TYR 42 HD1 TYR 42 -15.271 14.416 1.111
281 HD2 TYR 42 HD2 TYR 42 -11.995 14.355 3.873
282 HE1 TYR 42 HE1 TYR 42 -14.348 16.479 0.050
283 HE2 TYR 42 HE2 TYR 42 -11.138 16.451 2.904
284 HH TYR 42 HH TYR 42 -12.616 17.883 -0.027
285 H SER 43 H SER 43 -13.346 9.669 0.785
286 HA SER 43 HA SER 43 -14.853 10.715 -1.417
287 1HB SER 43 1HB SER 43 -13.023 8.891 -1.535
288 2HB SER 43 2HB SER 43 -14.349 7.771 -0.950
289 HG SER 43 HG SER 43 -14.034 7.824 -3.259
290 H ASN 44 H ASN 44 -16.291 8.201 -1.851
291 HA ASN 44 HA ASN 44 -18.153 7.707 0.269
292 1HB ASN 44 1HB ASN 44 -19.256 9.446 -1.163
293 2HB ASN 44 2HB ASN 44 -19.026 8.413 -2.595
294 1HD2 ASN 44 1HD2 ASN 44 -20.086 6.023 -2.180
295 2HD2 ASN 44 2HD2 ASN 44 -21.629 6.045 -1.384
296 HA PRO 45 HA PRO 45 -17.659 6.075 1.394
297 1HB PRO 45 1HB PRO 45 -16.620 3.642 2.147
298 2HB PRO 45 2HB PRO 45 -18.275 3.737 1.515
299 1HG PRO 45 1HG PRO 45 -15.746 3.079 -0.115
300 2HG PRO 45 2HG PRO 45 -17.232 2.085 0.013
301 1HD PRO 45 1HD PRO 45 -16.866 3.916 -2.042
302 2HD PRO 45 2HD PRO 45 -18.507 3.669 -1.286
303 HA PRO 46 HA PRO 46 -13.703 7.676 1.454
304 1HB PRO 46 1HB PRO 46 -12.652 7.388 4.047
305 2HB PRO 46 2HB PRO 46 -14.081 8.415 3.642
306 1HG PRO 46 1HG PRO 46 -14.134 5.514 4.609
307 2HG PRO 46 2HG PRO 46 -14.996 6.971 5.302
308 1HD PRO 46 1HD PRO 46 -16.263 5.279 3.570
309 2HD PRO 46 2HD PRO 46 -16.449 7.138 3.366
310 H GLN 47 H GLN 47 -11.211 7.533 1.777
311 HA GLN 47 HA GLN 47 -10.282 4.853 1.041
312 1HB GLN 47 1HB GLN 47 -10.405 7.325 -0.778
313 2HB GLN 47 2HB GLN 47 -9.417 5.869 -1.129
314 1HG GLN 47 1HG GLN 47 -11.469 4.439 -1.259
315 2HG GLN 47 2HG GLN 47 -12.494 5.844 -0.801
316 1HE2 GLN 47 1HE2 GLN 47 -9.915 5.335 -3.354
317 2HE2 GLN 47 2HE2 GLN 47 -10.928 6.007 -4.599
318 H CYS 48 H CYS 48 -7.760 4.992 0.688
319 HA CYS 48 HA CYS 48 -6.619 6.852 2.636
320 1HB CYS 48 1HB CYS 48 -7.150 3.854 3.023
321 2HB CYS 48 2HB CYS 48 -5.984 4.786 4.032
322 H GLN 49 H GLN 49 -4.454 6.832 2.757
323 HA GLN 49 HA GLN 49 -3.084 5.177 0.786
324 1HB GLN 49 1HB GLN 49 -3.941 7.554 0.095
325 2HB GLN 49 2HB GLN 49 -2.664 8.185 1.164
326 1HG GLN 49 1HG GLN 49 -0.940 6.791 -0.210
327 2HG GLN 49 2HG GLN 49 -2.284 6.390 -1.349
328 1HE2 GLN 49 1HE2 GLN 49 -3.526 9.080 -1.375
329 2HE2 GLN 49 2HE2 GLN 49 -2.375 10.099 -2.182
330 H CYS 50 H CYS 50 -1.168 4.458 1.323
331 HA CYS 50 HA CYS 50 0.116 5.259 3.846
332 1HB CYS 50 1HB CYS 50 0.659 3.028 1.777
333 2HB CYS 50 2HB CYS 50 1.771 3.358 3.127
334 H TYR 51 H TYR 51 0.756 7.265 3.422
335 HA TYR 51 HA TYR 51 2.210 8.170 1.217
336 1HB TYR 51 1HB TYR 51 1.466 9.237 3.939
337 2HB TYR 51 2HB TYR 51 2.903 9.976 3.202
338 HD1 TYR 51 HD1 TYR 51 2.727 11.380 1.132
339 HD2 TYR 51 HD2 TYR 51 -0.759 9.246 2.606
340 HE1 TYR 51 HE1 TYR 51 1.367 12.528 -0.436
341 HE2 TYR 51 HE2 TYR 51 -2.093 10.383 0.925
342 HH TYR 51 HH TYR 51 -0.816 12.859 -1.285
343 H ASP 52 H ASP 52 3.438 6.617 4.040
344 HA ASP 52 HA ASP 52 6.142 7.594 3.472
345 1HB ASP 52 1HB ASP 52 5.307 7.434 5.886
346 2HB ASP 52 2HB ASP 52 5.435 5.639 5.730
347 HD2 ASP 52 HD2 ASP 52 8.788 5.932 6.477
348 H THR 53 H THR 53 7.819 6.615 2.668
349 HA THR 53 HA THR 53 7.652 3.843 1.802
350 HB THR 53 HB THR 53 8.630 5.444 0.235
351 HG1 THR 53 HG1 THR 53 9.175 3.179 0.190
352 1HG2 THR 53 1HG2 THR 53 10.933 6.171 0.490
353 2HG2 THR 53 2HG2 THR 53 11.060 5.456 2.137
354 3HG2 THR 53 3HG2 THR 53 9.973 6.870 1.838
355 H HIS 54 H HIS 54 8.525 2.180 2.689
356 HA HIS 54 HA HIS 54 10.771 2.317 4.360
357 1HB HIS 54 1HB HIS 54 9.056 2.763 6.191
358 2HB HIS 54 2HB HIS 54 8.226 1.237 5.782
359 HD1 HIS 54 HD1 HIS 54 8.746 1.009 8.379
360 HD2 HIS 54 HD2 HIS 54 12.049 0.565 5.839
361 HE1 HIS 54 HE1 HIS 54 10.504 -0.148 9.700
362 HE2 HIS 54 HE2 HIS 54 12.530 -0.406 8.161
363 H LYS 55 H LYS 55 7.994 0.135 3.874
364 HA LYS 55 HA LYS 55 9.501 -2.112 3.550
365 1HB LYS 55 1HB LYS 55 7.274 -3.088 3.650
366 2HB LYS 55 2HB LYS 55 7.345 -1.738 4.749
367 1HG LYS 55 1HG LYS 55 6.097 -1.431 1.937
368 2HG LYS 55 2HG LYS 55 5.210 -1.990 3.387
369 1HD LYS 55 1HD LYS 55 5.961 0.135 4.591
370 2HD LYS 55 2HD LYS 55 6.423 0.782 2.964
371 1HE LYS 55 1HE LYS 55 4.074 0.543 2.174
372 2HE LYS 55 2HE LYS 55 3.606 -0.214 3.756
373 1HZ LYS 55 1HZ LYS 55 4.677 2.542 3.382
374 2HZ LYS 55 2HZ LYS 55 4.272 1.812 4.859
375 3HZ LYS 55 3HZ LYS 55 3.065 2.115 3.702
376 H PHE 56 H PHE 56 7.994 -3.641 1.797
377 HA PHE 56 HA PHE 56 8.818 -2.721 -0.850
378 1HB PHE 56 1HB PHE 56 9.482 -5.109 -1.320
379 2HB PHE 56 2HB PHE 56 10.459 -4.337 -0.041
380 HD1 PHE 56 HD1 PHE 56 9.948 -4.834 2.416
381 HD2 PHE 56 HD2 PHE 56 8.171 -7.076 -0.811
382 HE1 PHE 56 HE1 PHE 56 9.330 -6.622 3.984
383 HE2 PHE 56 HE2 PHE 56 7.598 -8.870 0.772
384 HZ PHE 56 HZ PHE 56 8.153 -8.639 3.174
385 H CYS 57 H CYS 57 7.703 -4.646 -2.502
386 HA CYS 57 HA CYS 57 4.896 -4.014 -2.165
387 1HB CYS 57 1HB CYS 57 6.392 -5.584 -4.311
388 2HB CYS 57 2HB CYS 57 4.630 -5.257 -4.338
389 H TYR 58 H TYR 58 3.577 -5.127 -1.039
390 HA TYR 58 HA TYR 58 4.136 -7.916 -0.324
391 1HB TYR 58 1HB TYR 58 2.002 -5.882 0.516
392 2HB TYR 58 2HB TYR 58 1.888 -7.595 0.988
393 HD1 TYR 58 HD1 TYR 58 3.773 -4.445 1.519
394 HD2 TYR 58 HD2 TYR 58 3.640 -8.672 2.432
395 HE1 TYR 58 HE1 TYR 58 5.395 -4.143 3.266
396 HE2 TYR 58 HE2 TYR 58 5.237 -8.337 4.204
397 HH TYR 58 HH TYR 58 6.457 -6.721 5.458
398 H LYS 59 H LYS 59 2.377 -9.444 -0.326
399 HA LYS 59 HA LYS 59 1.331 -10.182 -2.755
400 1HB LYS 59 1HB LYS 59 0.420 -10.748 0.094
401 2HB LYS 59 2HB LYS 59 -0.168 -11.657 -1.347
402 1HG LYS 59 1HG LYS 59 1.882 -12.780 -1.658
403 2HG LYS 59 2HG LYS 59 2.859 -11.509 -0.896
404 1HD LYS 59 1HD LYS 59 1.825 -12.108 1.356
405 2HD LYS 59 2HD LYS 59 1.087 -13.546 0.566
406 1HE LYS 59 1HE LYS 59 3.350 -14.416 -0.026
407 2HE LYS 59 2HE LYS 59 4.118 -12.886 0.562
408 1HZ LYS 59 1HZ LYS 59 2.604 -14.835 2.215
409 2HZ LYS 59 2HZ LYS 59 3.299 -13.386 2.768
410 3HZ LYS 59 3HZ LYS 59 4.291 -14.624 2.171
411 H ALA 60 H ALA 60 -0.674 -10.109 -3.742
412 HA ALA 60 HA ALA 60 -2.166 -7.740 -3.337
413 1HB ALA 60 1HB ALA 60 -3.551 -8.634 -5.224
414 2HB ALA 60 2HB ALA 60 -2.698 -10.222 -5.043
415 3HB ALA 60 3HB ALA 60 -1.790 -8.764 -5.564
416 H CYS 61 H CYS 61 -4.171 -7.370 -2.646
417 HA CYS 61 HA CYS 61 -4.849 -9.092 -0.409
418 1HB CYS 61 1HB CYS 61 -4.317 -6.426 -0.479
419 2HB CYS 61 2HB CYS 61 -6.076 -6.328 -0.659
420 H HIS 62 H HIS 62 -6.305 -10.618 -0.984
421 HA HIS 62 HA HIS 62 -8.894 -9.608 -2.069
422 1HB HIS 62 1HB HIS 62 -7.375 -12.148 -2.746
423 2HB HIS 62 2HB HIS 62 -9.094 -11.897 -3.177
424 HD1 HIS 62 HD1 HIS 62 -9.656 -9.888 -4.705
425 HD2 HIS 62 HD2 HIS 62 -5.528 -10.366 -4.160
426 HE1 HIS 62 HE1 HIS 62 -8.538 -8.296 -6.271
427 HE2 HIS 62 HE2 HIS 62 -6.025 -8.551 -5.887
428 H ASN 63 H ASN 63 -10.703 -10.071 -0.940
429 HA ASN 63 HA ASN 63 -11.111 -12.142 0.789
430 1HB ASN 63 1HB ASN 63 -11.149 -10.641 2.922
431 2HB ASN 63 2HB ASN 63 -9.603 -11.384 2.438
432 1HD2 ASN 63 1HD2 ASN 63 -7.787 -9.840 1.785
433 2HD2 ASN 63 2HD2 ASN 63 -8.047 -8.157 1.962
434 H SER 64 H SER 64 -11.785 -8.710 1.197
435 HA SER 64 HA SER 64 -14.645 -9.129 0.695
436 1HB SER 64 1HB SER 64 -13.738 -7.602 2.495
437 2HB SER 64 2HB SER 64 -13.217 -6.470 1.205
438 HG SER 64 HG SER 64 -15.367 -6.101 2.175
439 H GLU 65 H GLU 65 -14.379 -9.913 -1.460
440 HA GLU 65 HA GLU 65 -13.656 -8.318 -3.698
441 1HB GLU 65 1HB GLU 65 -15.741 -10.567 -3.648
442 2HB GLU 65 2HB GLU 65 -14.853 -9.936 -5.066
443 1HG GLU 65 1HG GLU 65 -13.731 -11.697 -2.766
444 2HG GLU 65 2HG GLU 65 -14.038 -12.149 -4.455
445 HE2 GLU 65 HE2 GLU 65 -11.918 -12.781 -3.611
446 H ILE 66 H ILE 66 -16.568 -8.844 -1.890
447 HA ILE 66 HA ILE 66 -17.796 -6.400 -2.586
448 HB ILE 66 HB ILE 66 -20.008 -7.454 -3.126
449 1HG1 ILE 66 1HG1 ILE 66 -18.419 -10.021 -3.757
450 2HG1 ILE 66 2HG1 ILE 66 -19.417 -9.805 -2.284
451 1HG2 ILE 66 1HG2 ILE 66 -17.878 -8.117 -5.236
452 2HG2 ILE 66 2HG2 ILE 66 -18.468 -6.448 -4.881
453 3HG2 ILE 66 3HG2 ILE 66 -19.597 -7.701 -5.519
454 1HD1 ILE 66 1HD1 ILE 66 -20.458 -9.731 -5.198
455 2HD1 ILE 66 2HD1 ILE 66 -21.450 -9.363 -3.743
456 3HD1 ILE 66 3HD1 ILE 66 -20.749 -11.008 -3.965
457 H GLU 67 H GLU 67 -19.798 -6.215 -1.133
458 HA GLU 67 HA GLU 67 -19.516 -7.901 1.255
459 1HB GLU 67 1HB GLU 67 -20.380 -5.986 2.552
460 2HB GLU 67 2HB GLU 67 -18.753 -5.680 1.868
461 1HG GLU 67 1HG GLU 67 -21.370 -4.606 0.591
462 2HG GLU 67 2HG GLU 67 -20.413 -3.704 1.815
463 HE2 GLU 67 HE2 GLU 67 -17.929 -2.796 -0.370
Start of MODEL 10
1 1H GLY 1 1H GLY 1 -7.994 -15.436 10.019
2 2H GLY 1 2H GLY 1 -6.465 -16.022 10.486
3 3H GLY 1 3H GLY 1 -6.584 -14.730 9.386
4 1HA GLY 1 1HA GLY 1 -7.593 -14.641 12.135
5 2HA GLY 1 2HA GLY 1 -5.952 -14.070 11.627
6 H ASP 2 H ASP 2 -7.350 -12.236 12.896
7 HA ASP 2 HA ASP 2 -7.927 -10.223 10.842
8 1HB ASP 2 1HB ASP 2 -9.918 -11.008 13.110
9 2HB ASP 2 2HB ASP 2 -10.130 -9.631 11.976
10 HD2 ASP 2 HD2 ASP 2 -10.828 -11.777 9.267
11 H ASP 3 H ASP 3 -5.933 -10.913 12.748
12 HA ASP 3 HA ASP 3 -5.590 -8.536 14.316
13 1HB ASP 3 1HB ASP 3 -5.094 -9.805 16.403
14 2HB ASP 3 2HB ASP 3 -6.825 -9.900 15.942
15 HD2 ASP 3 HD2 ASP 3 -6.712 -13.328 15.172
16 H VAL 4 H VAL 4 -4.400 -8.742 12.180
17 HA VAL 4 HA VAL 4 -1.746 -9.792 12.733
18 HB VAL 4 HB VAL 4 -3.025 -11.397 11.354
19 1HG1 VAL 4 1HG1 VAL 4 -3.398 -10.900 8.933
20 2HG1 VAL 4 2HG1 VAL 4 -2.890 -9.195 9.166
21 3HG1 VAL 4 3HG1 VAL 4 -4.388 -9.810 9.959
22 1HG2 VAL 4 1HG2 VAL 4 -0.551 -11.356 11.373
23 2HG2 VAL 4 2HG2 VAL 4 -0.517 -10.133 10.052
24 3HG2 VAL 4 3HG2 VAL 4 -1.165 -11.776 9.739
25 H LYS 5 H LYS 5 -0.111 -8.495 12.083
26 HA LYS 5 HA LYS 5 -0.907 -5.765 11.663
27 1HB LYS 5 1HB LYS 5 1.782 -7.129 12.192
28 2HB LYS 5 2HB LYS 5 1.579 -5.361 12.189
29 1HG LYS 5 1HG LYS 5 0.025 -7.262 14.083
30 2HG LYS 5 2HG LYS 5 1.585 -6.516 14.505
31 1HD LYS 5 1HD LYS 5 -0.809 -4.778 13.667
32 2HD LYS 5 2HD LYS 5 -0.675 -5.456 15.312
33 1HE LYS 5 1HE LYS 5 1.471 -4.337 15.734
34 2HE LYS 5 2HE LYS 5 1.509 -3.683 14.045
35 1HZ LYS 5 1HZ LYS 5 0.686 -2.087 15.634
36 2HZ LYS 5 2HZ LYS 5 -0.582 -3.122 16.084
37 3HZ LYS 5 3HZ LYS 5 -0.520 -2.498 14.510
38 H SER 6 H SER 6 -0.340 -8.152 9.623
39 HA SER 6 HA SER 6 1.411 -7.360 7.674
40 1HB SER 6 1HB SER 6 -1.177 -8.999 7.355
41 2HB SER 6 2HB SER 6 0.063 -8.845 6.055
42 HG SER 6 HG SER 6 0.443 -10.696 7.275
43 H ALA 7 H ALA 7 1.348 -6.464 5.643
44 HA ALA 7 HA ALA 7 -0.735 -4.493 5.122
45 1HB ALA 7 1HB ALA 7 0.876 -3.849 3.243
46 2HB ALA 7 2HB ALA 7 1.895 -5.260 3.692
47 3HB ALA 7 3HB ALA 7 1.723 -3.908 4.840
48 H CYS 8 H CYS 8 -1.859 -4.434 3.073
49 HA CYS 8 HA CYS 8 -1.391 -6.775 1.327
50 1HB CYS 8 1HB CYS 8 -3.704 -6.925 1.982
51 2HB CYS 8 2HB CYS 8 -3.972 -5.183 1.718
52 H CYS 9 H CYS 9 -0.361 -6.228 -0.592
53 HA CYS 9 HA CYS 9 -0.732 -3.464 -1.553
54 1HB CYS 9 1HB CYS 9 1.489 -3.964 -0.237
55 2HB CYS 9 2HB CYS 9 1.938 -4.997 -1.610
56 H ASP 10 H ASP 10 -1.843 -3.839 -3.557
57 HA ASP 10 HA ASP 10 -1.047 -6.247 -5.067
58 1HB ASP 10 1HB ASP 10 -3.418 -4.327 -5.169
59 2HB ASP 10 2HB ASP 10 -2.998 -5.217 -6.610
60 HD2 ASP 10 HD2 ASP 10 -3.543 -5.720 -3.263
61 H THR 11 H THR 11 -0.513 -2.773 -5.217
62 HA THR 11 HA THR 11 0.720 -2.940 -7.863
63 HB THR 11 HB THR 11 -1.629 -1.063 -7.142
64 HG1 THR 11 HG1 THR 11 -2.867 -2.245 -8.525
65 1HG2 THR 11 1HG2 THR 11 -1.575 -0.475 -9.555
66 2HG2 THR 11 2HG2 THR 11 -0.279 -1.691 -9.866
67 3HG2 THR 11 3HG2 THR 11 0.068 -0.221 -8.896
68 H CYS 12 H CYS 12 2.474 -1.611 -7.811
69 HA CYS 12 HA CYS 12 2.708 0.405 -5.738
70 1HB CYS 12 1HB CYS 12 4.556 -0.938 -4.705
71 2HB CYS 12 2HB CYS 12 2.904 -1.711 -4.636
72 H LEU 13 H LEU 13 4.161 1.854 -5.878
73 HA LEU 13 HA LEU 13 5.820 1.994 -8.277
74 1HB LEU 13 1HB LEU 13 4.395 3.871 -7.758
75 2HB LEU 13 2HB LEU 13 5.100 4.057 -6.123
76 HG LEU 13 HG LEU 13 6.782 4.245 -8.703
77 1HD1 LEU 13 1HD1 LEU 13 5.225 6.531 -7.330
78 2HD1 LEU 13 2HD1 LEU 13 4.790 5.749 -8.890
79 3HD1 LEU 13 3HD1 LEU 13 6.325 6.680 -8.752
80 1HD2 LEU 13 1HD2 LEU 13 8.163 5.868 -7.339
81 2HD2 LEU 13 2HD2 LEU 13 8.158 4.224 -6.622
82 3HD2 LEU 13 3HD2 LEU 13 7.126 5.514 -5.904
83 H CYS 14 H CYS 14 7.565 0.813 -8.035
84 HA CYS 14 HA CYS 14 9.170 1.183 -5.617
85 1HB CYS 14 1HB CYS 14 9.561 -0.829 -7.856
86 2HB CYS 14 2HB CYS 14 10.683 -0.565 -6.517
87 H THR 15 H THR 15 10.781 2.473 -5.556
88 HA THR 15 HA THR 15 11.402 4.120 -7.851
89 HB THR 15 HB THR 15 13.118 5.188 -6.368
90 HG1 THR 15 HG1 THR 15 11.840 3.751 -4.307
91 1HG2 THR 15 1HG2 THR 15 10.234 4.926 -5.218
92 2HG2 THR 15 2HG2 THR 15 10.734 5.998 -6.560
93 3HG2 THR 15 3HG2 THR 15 11.397 6.268 -4.910
94 H ARG 16 H ARG 16 13.376 4.429 -8.889
95 HA ARG 16 HA ARG 16 15.406 2.377 -8.701
96 1HB ARG 16 1HB ARG 16 15.315 4.917 -10.413
97 2HB ARG 16 2HB ARG 16 16.582 3.639 -10.467
98 1HG ARG 16 1HG ARG 16 14.906 1.961 -11.133
99 2HG ARG 16 2HG ARG 16 13.605 3.210 -11.099
100 1HD ARG 16 1HD ARG 16 14.723 4.463 -12.960
101 2HD ARG 16 2HD ARG 16 16.040 3.206 -13.008
102 HE ARG 16 HE ARG 16 13.414 1.962 -13.125
103 1HH1 ARG 16 1HH1 ARG 16 15.680 3.862 -15.141
104 2HH1 ARG 16 2HH1 ARG 16 15.141 3.151 -16.626
105 1HH2 ARG 16 1HH2 ARG 16 12.744 1.016 -15.117
106 2HH2 ARG 16 2HH2 ARG 16 13.446 1.530 -16.617
107 H SER 17 H SER 17 16.982 2.600 -7.132
108 HA SER 17 HA SER 17 18.188 5.007 -6.369
109 1HB SER 17 1HB SER 17 15.804 5.396 -5.346
110 2HB SER 17 2HB SER 17 16.191 4.068 -4.217
111 HG SER 17 HG SER 17 16.679 6.322 -3.526
112 H GLN 18 H GLN 18 18.711 4.425 -3.703
113 HA GLN 18 HA GLN 18 19.899 1.762 -3.546
114 1HB GLN 18 1HB GLN 18 21.496 4.370 -3.747
115 2HB GLN 18 2HB GLN 18 22.174 2.840 -3.077
116 1HG GLN 18 1HG GLN 18 21.589 1.719 -5.352
117 2HG GLN 18 2HG GLN 18 21.249 3.358 -5.988
118 1HE2 GLN 18 1HE2 GLN 18 23.793 1.605 -4.111
119 2HE2 GLN 18 2HE2 GLN 18 25.145 2.340 -4.935
120 HA PRO 19 HA PRO 19 19.017 0.494 -2.133
121 1HB PRO 19 1HB PRO 19 17.129 -0.110 -0.189
122 2HB PRO 19 2HB PRO 19 18.925 -0.198 0.142
123 1HG PRO 19 1HG PRO 19 17.035 2.153 0.747
124 2HG PRO 19 2HG PRO 19 18.152 1.296 1.893
125 1HD PRO 19 1HD PRO 19 18.898 3.610 0.579
126 2HD PRO 19 2HD PRO 19 20.099 2.261 0.840
127 HA PRO 20 HA PRO 20 15.218 2.058 -4.045
128 1HB PRO 20 1HB PRO 20 13.940 -0.218 -4.880
129 2HB PRO 20 2HB PRO 20 15.520 0.264 -5.607
130 1HG PRO 20 1HG PRO 20 15.050 -1.712 -3.302
131 2HG PRO 20 2HG PRO 20 15.989 -1.999 -4.825
132 1HD PRO 20 1HD PRO 20 17.181 -1.198 -2.437
133 2HD PRO 20 2HD PRO 20 17.810 -0.618 -4.059
134 H THR 21 H THR 21 12.899 1.953 -3.734
135 HA THR 21 HA THR 21 12.102 1.414 -0.930
136 HB THR 21 HB THR 21 12.349 4.225 -2.204
137 HG1 THR 21 HG1 THR 21 14.440 3.454 -1.611
138 1HG2 THR 21 1HG2 THR 21 11.820 5.038 0.048
139 2HG2 THR 21 2HG2 THR 21 11.970 3.384 0.737
140 3HG2 THR 21 3HG2 THR 21 10.586 3.776 -0.317
141 H CYS 22 H CYS 22 9.839 1.159 -0.879
142 HA CYS 22 HA CYS 22 8.417 1.852 -3.382
143 1HB CYS 22 1HB CYS 22 9.744 -0.379 -3.499
144 2HB CYS 22 2HB CYS 22 8.645 -1.011 -2.251
145 H ARG 23 H ARG 23 6.189 1.454 -3.381
146 HA ARG 23 HA ARG 23 4.730 0.930 -0.988
147 1HB ARG 23 1HB ARG 23 5.808 3.111 -0.404
148 2HB ARG 23 2HB ARG 23 5.019 3.893 -1.795
149 1HG ARG 23 1HG ARG 23 3.382 2.537 0.443
150 2HG ARG 23 2HG ARG 23 4.127 4.093 0.710
151 1HD ARG 23 1HD ARG 23 2.397 3.777 -1.795
152 2HD ARG 23 2HD ARG 23 1.664 4.158 -0.164
153 HE ARG 23 HE ARG 23 3.734 5.895 -0.247
154 1HH1 ARG 23 1HH1 ARG 23 1.219 5.352 -2.798
155 2HH1 ARG 23 2HH1 ARG 23 1.243 7.005 -3.262
156 1HH2 ARG 23 1HH2 ARG 23 3.708 7.878 -0.813
157 2HH2 ARG 23 2HH2 ARG 23 2.712 8.568 -2.078
158 H CYS 24 H CYS 24 2.519 0.993 -1.283
159 HA CYS 24 HA CYS 24 1.740 0.281 -3.864
160 1HB CYS 24 1HB CYS 24 -0.148 0.749 -1.499
161 2HB CYS 24 2HB CYS 24 -0.307 -0.471 -2.800
162 H VAL 25 H VAL 25 0.990 1.636 -5.492
163 HA VAL 25 HA VAL 25 -0.022 4.232 -4.971
164 HB VAL 25 HB VAL 25 -0.590 4.338 -7.331
165 1HG1 VAL 25 1HG1 VAL 25 2.220 3.192 -6.736
166 2HG1 VAL 25 2HG1 VAL 25 1.697 4.891 -6.433
167 3HG1 VAL 25 3HG1 VAL 25 1.763 4.253 -8.117
168 1HG2 VAL 25 1HG2 VAL 25 -1.245 1.943 -7.752
169 2HG2 VAL 25 2HG2 VAL 25 0.466 1.428 -7.474
170 3HG2 VAL 25 3HG2 VAL 25 0.051 2.483 -8.862
171 H ASP 26 H ASP 26 -1.262 1.107 -4.892
172 HA ASP 26 HA ASP 26 -3.950 1.633 -5.523
173 1HB ASP 26 1HB ASP 26 -2.559 -0.678 -5.266
174 2HB ASP 26 2HB ASP 26 -3.303 -0.684 -3.631
175 HD2 ASP 26 HD2 ASP 26 -5.783 -0.109 -3.829
176 H VAL 27 H VAL 27 -5.404 2.696 -4.476
177 HA VAL 27 HA VAL 27 -5.365 3.372 -1.719
178 HB VAL 27 HB VAL 27 -6.521 4.914 -2.790
179 1HG1 VAL 27 1HG1 VAL 27 -6.560 4.146 -5.042
180 2HG1 VAL 27 2HG1 VAL 27 -8.246 4.495 -4.581
181 3HG1 VAL 27 3HG1 VAL 27 -7.718 2.779 -4.647
182 1HG2 VAL 27 1HG2 VAL 27 -8.146 4.046 -1.010
183 2HG2 VAL 27 2HG2 VAL 27 -8.872 2.961 -2.260
184 3HG2 VAL 27 3HG2 VAL 27 -8.972 4.731 -2.459
185 H ARG 28 H ARG 28 -6.396 2.665 0.057
186 HA ARG 28 HA ARG 28 -7.534 -0.041 -0.089
187 1HB ARG 28 1HB ARG 28 -5.784 1.372 1.961
188 2HB ARG 28 2HB ARG 28 -6.698 -0.119 2.372
189 1HG ARG 28 1HG ARG 28 -4.792 -0.023 -0.013
190 2HG ARG 28 2HG ARG 28 -4.218 -0.409 1.655
191 1HD ARG 28 1HD ARG 28 -5.574 -2.401 1.809
192 2HD ARG 28 2HD ARG 28 -6.572 -1.925 0.385
193 HE ARG 28 HE ARG 28 -3.698 -2.901 0.332
194 1HH1 ARG 28 1HH1 ARG 28 -6.694 -2.068 -1.440
195 2HH1 ARG 28 2HH1 ARG 28 -6.131 -2.714 -2.948
196 1HH2 ARG 28 1HH2 ARG 28 -2.978 -3.728 -1.700
197 2HH2 ARG 28 2HH2 ARG 28 -4.018 -3.637 -3.101
198 H GLU 29 H GLU 29 -9.031 -0.544 1.638
199 HA GLU 29 HA GLU 29 -11.128 1.252 2.088
200 1HB GLU 29 1HB GLU 29 -10.241 -1.352 3.383
201 2HB GLU 29 2HB GLU 29 -11.781 -0.518 3.776
202 1HG GLU 29 1HG GLU 29 -12.156 -0.650 1.082
203 2HG GLU 29 2HG GLU 29 -10.936 -1.963 1.181
204 HE2 GLU 29 HE2 GLU 29 -13.910 -0.788 2.369
205 H SER 30 H SER 30 -8.290 0.382 3.950
206 HA SER 30 HA SER 30 -8.715 2.615 5.757
207 1HB SER 30 1HB SER 30 -8.280 -0.285 6.776
208 2HB SER 30 2HB SER 30 -8.454 1.173 7.824
209 HG SER 30 HG SER 30 -10.395 0.408 7.879
210 H CYS 31 H CYS 31 -6.671 1.875 7.646
211 HA CYS 31 HA CYS 31 -4.284 1.868 5.958
212 1HB CYS 31 1HB CYS 31 -4.968 2.537 8.871
213 2HB CYS 31 2HB CYS 31 -3.241 2.410 8.328
214 H HIS 32 H HIS 32 -2.372 0.625 6.981
215 HA HIS 32 HA HIS 32 -3.208 -1.815 8.328
216 1HB HIS 32 1HB HIS 32 -1.655 -3.198 7.038
217 2HB HIS 32 2HB HIS 32 -2.938 -2.483 5.956
218 HD1 HIS 32 HD1 HIS 32 0.676 -2.005 6.930
219 HD2 HIS 32 HD2 HIS 32 -1.870 -1.253 3.691
220 HE1 HIS 32 HE1 HIS 32 2.128 -1.234 5.051
221 HE2 HIS 32 HE2 HIS 32 0.574 -0.795 3.068
222 H SER 33 H SER 33 -1.729 -2.519 9.843
223 HA SER 33 HA SER 33 -0.261 -0.484 10.966
224 1HB SER 33 1HB SER 33 -0.146 -3.516 11.507
225 2HB SER 33 2HB SER 33 0.496 -2.256 12.631
226 HG SER 33 HG SER 33 -1.560 -1.412 12.812
227 H ALA 34 H ALA 34 1.065 -3.034 8.861
228 HA ALA 34 HA ALA 34 3.650 -2.882 9.631
229 1HB ALA 34 1HB ALA 34 2.620 -3.209 6.750
230 2HB ALA 34 2HB ALA 34 2.728 -4.516 7.996
231 3HB ALA 34 3HB ALA 34 4.219 -3.749 7.365
232 H CYS 35 H CYS 35 1.985 -0.336 7.928
233 HA CYS 35 HA CYS 35 4.501 1.059 7.385
234 1HB CYS 35 1HB CYS 35 3.342 2.476 5.939
235 2HB CYS 35 2HB CYS 35 2.723 0.816 5.630
236 H ASP 36 H ASP 36 4.607 3.420 8.062
237 HA ASP 36 HA ASP 36 3.657 3.493 10.864
238 1HB ASP 36 1HB ASP 36 5.998 5.052 9.623
239 2HB ASP 36 2HB ASP 36 5.637 4.777 11.361
240 HD2 ASP 36 HD2 ASP 36 7.625 3.876 9.110
241 H LYS 37 H LYS 37 3.665 5.586 7.915
242 HA LYS 37 HA LYS 37 1.839 7.342 9.390
243 1HB LYS 37 1HB LYS 37 4.049 8.424 8.704
244 2HB LYS 37 2HB LYS 37 3.657 8.030 7.020
245 1HG LYS 37 1HG LYS 37 3.049 10.328 7.330
246 2HG LYS 37 2HG LYS 37 1.510 9.424 7.248
247 1HD LYS 37 1HD LYS 37 1.504 9.434 9.864
248 2HD LYS 37 2HD LYS 37 2.974 10.448 9.770
249 1HE LYS 37 1HE LYS 37 1.097 11.916 10.117
250 2HE LYS 37 2HE LYS 37 1.621 12.160 8.405
251 1HZ LYS 37 1HZ LYS 37 -0.149 10.586 7.778
252 2HZ LYS 37 2HZ LYS 37 -0.727 11.995 8.535
253 3HZ LYS 37 3HZ LYS 37 -0.667 10.534 9.395
254 H CYS 38 H CYS 38 -0.231 7.003 8.748
255 HA CYS 38 HA CYS 38 -0.805 6.743 5.894
256 1HB CYS 38 1HB CYS 38 -0.484 4.527 7.143
257 2HB CYS 38 2HB CYS 38 -1.709 5.084 8.332
258 H VAL 39 H VAL 39 -2.686 7.691 5.273
259 HA VAL 39 HA VAL 39 -4.162 9.213 7.316
260 HB VAL 39 HB VAL 39 -3.235 9.747 4.449
261 1HG1 VAL 39 1HG1 VAL 39 -5.001 11.433 6.331
262 2HG1 VAL 39 2HG1 VAL 39 -5.482 10.714 4.725
263 3HG1 VAL 39 3HG1 VAL 39 -4.240 12.014 4.792
264 1HG2 VAL 39 1HG2 VAL 39 -2.590 11.093 7.155
265 2HG2 VAL 39 2HG2 VAL 39 -2.032 11.686 5.547
266 3HG2 VAL 39 3HG2 VAL 39 -1.439 10.099 6.179
267 H CYS 40 H CYS 40 -6.451 8.931 7.074
268 HA CYS 40 HA CYS 40 -7.427 7.496 4.722
269 1HB CYS 40 1HB CYS 40 -6.637 5.964 6.510
270 2HB CYS 40 2HB CYS 40 -7.755 6.745 7.673
271 H ALA 41 H ALA 41 -9.578 7.776 4.329
272 HA ALA 41 HA ALA 41 -11.195 9.595 5.929
273 1HB ALA 41 1HB ALA 41 -9.436 11.076 4.832
274 2HB ALA 41 2HB ALA 41 -11.062 11.378 4.112
275 3HB ALA 41 3HB ALA 41 -9.847 10.335 3.246
276 H TYR 42 H TYR 42 -13.132 10.116 5.064
277 HA TYR 42 HA TYR 42 -14.390 7.827 4.073
278 1HB TYR 42 1HB TYR 42 -16.471 9.124 4.858
279 2HB TYR 42 2HB TYR 42 -15.127 9.033 6.054
280 HD1 TYR 42 HD1 TYR 42 -16.696 11.346 3.484
281 HD2 TYR 42 HD2 TYR 42 -14.043 11.022 6.866
282 HE1 TYR 42 HE1 TYR 42 -16.503 13.794 3.578
283 HE2 TYR 42 HE2 TYR 42 -13.815 13.436 6.907
284 HH TYR 42 HH TYR 42 -14.378 15.374 6.006
285 H SER 43 H SER 43 -13.018 9.792 2.294
286 HA SER 43 HA SER 43 -14.549 11.509 0.909
287 1HB SER 43 1HB SER 43 -12.059 10.068 -0.157
288 2HB SER 43 2HB SER 43 -12.617 11.757 -0.568
289 HG SER 43 HG SER 43 -11.018 11.877 0.934
290 H ASN 44 H ASN 44 -14.203 11.473 -1.709
291 HA ASN 44 HA ASN 44 -15.421 9.073 -2.831
292 1HB ASN 44 1HB ASN 44 -17.192 10.623 -1.944
293 2HB ASN 44 2HB ASN 44 -16.519 11.939 -2.919
294 1HD2 ASN 44 1HD2 ASN 44 -17.988 8.577 -3.284
295 2HD2 ASN 44 2HD2 ASN 44 -18.685 8.941 -4.810
296 HA PRO 45 HA PRO 45 -14.362 7.825 -4.075
297 1HB PRO 45 1HB PRO 45 -11.925 6.802 -4.858
298 2HB PRO 45 2HB PRO 45 -13.103 7.383 -6.046
299 1HG PRO 45 1HG PRO 45 -10.779 8.997 -4.842
300 2HG PRO 45 2HG PRO 45 -11.136 8.751 -6.596
301 1HD PRO 45 1HD PRO 45 -12.014 10.991 -5.206
302 2HD PRO 45 2HD PRO 45 -13.063 10.216 -6.483
303 HA PRO 46 HA PRO 46 -12.704 7.973 -0.003
304 1HB PRO 46 1HB PRO 46 -12.841 5.351 0.876
305 2HB PRO 46 2HB PRO 46 -14.303 6.377 0.586
306 1HG PRO 46 1HG PRO 46 -13.055 4.366 -1.362
307 2HG PRO 46 2HG PRO 46 -14.792 4.523 -0.822
308 1HD PRO 46 1HD PRO 46 -13.831 5.614 -3.182
309 2HD PRO 46 2HD PRO 46 -15.099 6.518 -2.124
310 H GLN 47 H GLN 47 -10.731 7.547 1.311
311 HA GLN 47 HA GLN 47 -8.559 6.765 -0.510
312 1HB GLN 47 1HB GLN 47 -9.597 9.496 0.056
313 2HB GLN 47 2HB GLN 47 -7.846 9.364 0.403
314 1HG GLN 47 1HG GLN 47 -9.182 8.556 -2.226
315 2HG GLN 47 2HG GLN 47 -8.395 10.148 -1.901
316 1HE2 GLN 47 1HE2 GLN 47 -7.877 7.752 -3.677
317 2HE2 GLN 47 2HE2 GLN 47 -6.136 7.545 -3.593
318 H CYS 48 H CYS 48 -7.163 5.576 0.640
319 HA CYS 48 HA CYS 48 -6.246 6.565 3.153
320 1HB CYS 48 1HB CYS 48 -7.523 3.785 2.836
321 2HB CYS 48 2HB CYS 48 -6.671 4.394 4.306
322 H GLN 49 H GLN 49 -4.138 6.366 3.027
323 HA GLN 49 HA GLN 49 -2.955 4.069 1.819
324 1HB GLN 49 1HB GLN 49 -1.568 5.268 0.186
325 2HB GLN 49 2HB GLN 49 -3.307 5.569 -0.181
326 1HG GLN 49 1HG GLN 49 -3.159 7.808 0.793
327 2HG GLN 49 2HG GLN 49 -1.463 7.484 1.353
328 1HE2 GLN 49 1HE2 GLN 49 -0.091 8.619 0.131
329 2HE2 GLN 49 2HE2 GLN 49 -0.034 8.585 -1.615
330 H CYS 50 H CYS 50 -0.746 3.879 2.170
331 HA CYS 50 HA CYS 50 0.164 5.115 4.659
332 1HB CYS 50 1HB CYS 50 1.399 2.977 2.798
333 2HB CYS 50 2HB CYS 50 2.161 3.533 4.298
334 H TYR 51 H TYR 51 0.859 7.147 4.282
335 HA TYR 51 HA TYR 51 1.893 8.117 1.853
336 1HB TYR 51 1HB TYR 51 1.392 9.216 4.624
337 2HB TYR 51 2HB TYR 51 2.744 10.007 3.771
338 HD1 TYR 51 HD1 TYR 51 -0.933 9.346 3.651
339 HD2 TYR 51 HD2 TYR 51 2.404 11.086 1.524
340 HE1 TYR 51 HE1 TYR 51 -2.459 10.482 2.158
341 HE2 TYR 51 HE2 TYR 51 0.894 12.179 0.030
342 HH TYR 51 HH TYR 51 -2.672 11.637 0.238
343 H ASP 52 H ASP 52 3.537 7.033 4.693
344 HA ASP 52 HA ASP 52 6.127 7.742 3.733
345 1HB ASP 52 1HB ASP 52 7.112 6.464 5.546
346 2HB ASP 52 2HB ASP 52 5.734 7.435 6.122
347 HD2 ASP 52 HD2 ASP 52 4.352 4.942 4.619
348 H THR 53 H THR 53 7.092 7.053 1.980
349 HA THR 53 HA THR 53 6.641 4.383 0.967
350 HB THR 53 HB THR 53 8.139 6.822 -0.125
351 HG1 THR 53 HG1 THR 53 6.355 7.110 -1.215
352 1HG2 THR 53 1HG2 THR 53 8.083 5.566 -2.318
353 2HG2 THR 53 2HG2 THR 53 7.634 4.063 -1.430
354 3HG2 THR 53 3HG2 THR 53 9.221 4.879 -1.138
355 H HIS 54 H HIS 54 8.011 2.641 1.481
356 HA HIS 54 HA HIS 54 10.655 3.318 2.400
357 1HB HIS 54 1HB HIS 54 9.242 3.851 4.406
358 2HB HIS 54 2HB HIS 54 8.744 2.137 4.496
359 HD1 HIS 54 HD1 HIS 54 9.923 2.773 6.864
360 HD2 HIS 54 HD2 HIS 54 12.543 2.285 3.620
361 HE1 HIS 54 HE1 HIS 54 12.195 2.441 7.812
362 HE2 HIS 54 HE2 HIS 54 13.782 2.153 5.840
363 H LYS 55 H LYS 55 8.513 0.404 2.975
364 HA LYS 55 HA LYS 55 10.885 -1.096 2.629
365 1HB LYS 55 1HB LYS 55 8.000 -1.976 3.193
366 2HB LYS 55 2HB LYS 55 9.505 -2.930 3.516
367 1HG LYS 55 1HG LYS 55 9.331 -2.214 5.605
368 2HG LYS 55 2HG LYS 55 9.990 -0.651 5.032
369 1HD LYS 55 1HD LYS 55 7.509 0.066 4.610
370 2HD LYS 55 2HD LYS 55 7.028 -1.464 5.401
371 1HE LYS 55 1HE LYS 55 8.663 0.813 6.726
372 2HE LYS 55 2HE LYS 55 6.904 0.468 6.974
373 1HZ LYS 55 1HZ LYS 55 8.156 -0.480 8.739
374 2HZ LYS 55 2HZ LYS 55 9.194 -1.299 7.677
375 3HZ LYS 55 3HZ LYS 55 7.564 -1.747 7.775
376 H PHE 56 H PHE 56 9.690 -3.531 1.691
377 HA PHE 56 HA PHE 56 9.912 -3.091 -1.136
378 1HB PHE 56 1HB PHE 56 9.805 -5.598 -1.305
379 2HB PHE 56 2HB PHE 56 11.088 -5.011 -0.212
380 HD1 PHE 56 HD1 PHE 56 8.028 -6.966 -0.471
381 HD2 PHE 56 HD2 PHE 56 10.741 -5.142 2.337
382 HE1 PHE 56 HE1 PHE 56 7.068 -8.312 1.339
383 HE2 PHE 56 HE2 PHE 56 9.747 -6.454 4.144
384 HZ PHE 56 HZ PHE 56 7.889 -8.040 3.673
385 H CYS 57 H CYS 57 8.286 -4.467 -2.616
386 HA CYS 57 HA CYS 57 5.613 -3.521 -2.007
387 1HB CYS 57 1HB CYS 57 6.585 -3.435 -4.320
388 2HB CYS 57 2HB CYS 57 6.563 -5.221 -4.370
389 H TYR 58 H TYR 58 4.529 -4.558 -0.569
390 HA TYR 58 HA TYR 58 5.084 -7.152 0.341
391 1HB TYR 58 1HB TYR 58 3.620 -5.043 1.371
392 2HB TYR 58 2HB TYR 58 2.277 -6.071 0.789
393 HD1 TYR 58 HD1 TYR 58 5.465 -6.098 2.797
394 HD2 TYR 58 HD2 TYR 58 1.536 -7.816 2.285
395 HE1 TYR 58 HE1 TYR 58 5.681 -7.264 4.929
396 HE2 TYR 58 HE2 TYR 58 1.774 -8.997 4.365
397 HH TYR 58 HH TYR 58 3.157 -9.520 6.117
398 H LYS 59 H LYS 59 3.424 -8.837 0.662
399 HA LYS 59 HA LYS 59 2.446 -10.057 -1.625
400 1HB LYS 59 1HB LYS 59 1.541 -10.310 1.277
401 2HB LYS 59 2HB LYS 59 0.972 -11.390 -0.035
402 1HG LYS 59 1HG LYS 59 3.961 -11.163 0.781
403 2HG LYS 59 2HG LYS 59 2.769 -12.292 1.475
404 1HD LYS 59 1HD LYS 59 3.749 -13.630 -0.079
405 2HD LYS 59 2HD LYS 59 2.312 -13.075 -0.988
406 1HE LYS 59 1HE LYS 59 3.822 -11.412 -2.232
407 2HE LYS 59 2HE LYS 59 5.218 -12.004 -1.255
408 1HZ LYS 59 1HZ LYS 59 4.801 -14.207 -2.173
409 2HZ LYS 59 2HZ LYS 59 5.139 -13.051 -3.371
410 3HZ LYS 59 3HZ LYS 59 3.541 -13.583 -3.129
411 H ALA 60 H ALA 60 0.471 -10.419 -2.535
412 HA ALA 60 HA ALA 60 -1.322 -8.112 -2.345
413 1HB ALA 60 1HB ALA 60 -0.166 -8.460 -4.474
414 2HB ALA 60 2HB ALA 60 -1.924 -8.850 -4.683
415 3HB ALA 60 3HB ALA 60 -0.700 -10.177 -4.504
416 H CYS 61 H CYS 61 -3.100 -8.384 -1.233
417 HA CYS 61 HA CYS 61 -4.396 -10.911 -0.944
418 1HB CYS 61 1HB CYS 61 -6.005 -9.757 0.403
419 2HB CYS 61 2HB CYS 61 -4.363 -9.193 0.839
420 H HIS 62 H HIS 62 -7.001 -10.405 -1.197
421 HA HIS 62 HA HIS 62 -7.490 -9.205 -3.841
422 1HB HIS 62 1HB HIS 62 -9.026 -11.616 -2.678
423 2HB HIS 62 2HB HIS 62 -9.097 -10.998 -4.365
424 HD1 HIS 62 HD1 HIS 62 -6.736 -11.363 -5.712
425 HD2 HIS 62 HD2 HIS 62 -7.034 -13.407 -2.069
426 HE1 HIS 62 HE1 HIS 62 -4.911 -13.078 -5.694
427 HE2 HIS 62 HE2 HIS 62 -5.082 -14.293 -3.465
428 H ASN 63 H ASN 63 -9.951 -8.400 -3.808
429 HA ASN 63 HA ASN 63 -11.428 -8.424 -1.548
430 1HB ASN 63 1HB ASN 63 -11.364 -5.978 -0.884
431 2HB ASN 63 2HB ASN 63 -9.984 -6.939 -0.317
432 1HD2 ASN 63 1HD2 ASN 63 -7.837 -6.597 -1.568
433 2HD2 ASN 63 2HD2 ASN 63 -7.699 -5.260 -2.646
434 H SER 64 H SER 64 -10.530 -5.993 -3.949
435 HA SER 64 HA SER 64 -13.265 -6.000 -5.033
436 1HB SER 64 1HB SER 64 -11.902 -3.877 -4.642
437 2HB SER 64 2HB SER 64 -10.832 -4.373 -5.990
438 HG SER 64 HG SER 64 -12.393 -3.925 -7.385
439 H GLU 65 H GLU 65 -10.031 -6.926 -5.887
440 HA GLU 65 HA GLU 65 -10.316 -8.111 -8.348
441 1HB GLU 65 1HB GLU 65 -8.240 -7.564 -7.015
442 2HB GLU 65 2HB GLU 65 -8.510 -9.067 -6.077
443 1HG GLU 65 1HG GLU 65 -7.927 -10.394 -8.130
444 2HG GLU 65 2HG GLU 65 -7.976 -8.898 -9.135
445 HE2 GLU 65 HE2 GLU 65 -5.130 -8.883 -6.263
446 H ILE 66 H ILE 66 -12.650 -8.939 -7.086
447 HA ILE 66 HA ILE 66 -12.714 -11.715 -7.838
448 HB ILE 66 HB ILE 66 -14.004 -12.477 -5.834
449 1HG1 ILE 66 1HG1 ILE 66 -12.824 -10.008 -4.412
450 2HG1 ILE 66 2HG1 ILE 66 -14.535 -10.153 -4.927
451 1HG2 ILE 66 1HG2 ILE 66 -12.062 -13.110 -4.503
452 2HG2 ILE 66 2HG2 ILE 66 -11.108 -11.724 -5.146
453 3HG2 ILE 66 3HG2 ILE 66 -11.580 -13.077 -6.238
454 1HD1 ILE 66 1HD1 ILE 66 -14.788 -12.208 -3.471
455 2HD1 ILE 66 2HD1 ILE 66 -14.382 -10.716 -2.553
456 3HD1 ILE 66 3HD1 ILE 66 -13.108 -11.951 -2.861
457 H GLU 67 H GLU 67 -15.139 -12.529 -7.895
458 HA GLU 67 HA GLU 67 -17.128 -10.734 -7.359
459 1HB GLU 67 1HB GLU 67 -18.098 -10.474 -9.594
460 2HB GLU 67 2HB GLU 67 -16.466 -9.740 -9.569
461 1HG GLU 67 1HG GLU 67 -16.455 -10.848 -11.637
462 2HG GLU 67 2HG GLU 67 -15.624 -12.050 -10.583
463 HE2 GLU 67 HE2 GLU 67 -17.956 -14.417 -11.332
Start of MODEL 11
1 1H GLY 1 1H GLY 1 -3.865 -20.344 13.640
2 2H GLY 1 2H GLY 1 -3.257 -19.409 14.924
3 3H GLY 1 3H GLY 1 -2.491 -20.858 14.502
4 1HA GLY 1 1HA GLY 1 -1.282 -18.923 13.762
5 2HA GLY 1 2HA GLY 1 -1.858 -19.976 12.401
6 H ASP 2 H ASP 2 -2.374 -16.966 14.178
7 HA ASP 2 HA ASP 2 -3.369 -15.663 11.826
8 1HB ASP 2 1HB ASP 2 -5.481 -16.856 12.694
9 2HB ASP 2 2HB ASP 2 -5.297 -15.964 14.242
10 HD2 ASP 2 HD2 ASP 2 -6.757 -13.140 12.993
11 H ASP 3 H ASP 3 -1.134 -15.085 12.821
12 HA ASP 3 HA ASP 3 -1.470 -12.531 14.143
13 1HB ASP 3 1HB ASP 3 0.239 -13.154 15.950
14 2HB ASP 3 2HB ASP 3 -1.411 -13.827 16.138
15 HD2 ASP 3 HD2 ASP 3 1.691 -14.587 14.927
16 H VAL 4 H VAL 4 -0.937 -12.594 11.747
17 HA VAL 4 HA VAL 4 1.927 -12.071 11.515
18 HB VAL 4 HB VAL 4 1.188 -13.983 10.154
19 1HG1 VAL 4 1HG1 VAL 4 -0.076 -13.550 8.033
20 2HG1 VAL 4 2HG1 VAL 4 -0.438 -11.875 8.548
21 3HG1 VAL 4 3HG1 VAL 4 -1.112 -13.271 9.469
22 1HG2 VAL 4 1HG2 VAL 4 2.420 -13.221 8.124
23 2HG2 VAL 4 2HG2 VAL 4 3.195 -12.588 9.617
24 3HG2 VAL 4 3HG2 VAL 4 2.197 -11.505 8.585
25 H LYS 5 H LYS 5 2.480 -10.014 10.879
26 HA LYS 5 HA LYS 5 0.281 -8.126 10.483
27 1HB LYS 5 1HB LYS 5 3.232 -7.719 11.218
28 2HB LYS 5 2HB LYS 5 2.010 -6.420 11.072
29 1HG LYS 5 1HG LYS 5 0.705 -7.598 12.981
30 2HG LYS 5 2HG LYS 5 2.135 -8.660 13.180
31 1HD LYS 5 1HD LYS 5 3.558 -6.493 13.345
32 2HD LYS 5 2HD LYS 5 2.012 -5.590 13.460
33 1HE LYS 5 1HE LYS 5 1.442 -6.934 15.560
34 2HE LYS 5 2HE LYS 5 3.052 -7.760 15.412
35 1HZ LYS 5 1HZ LYS 5 3.323 -5.983 16.865
36 2HZ LYS 5 2HZ LYS 5 2.490 -4.888 15.869
37 3HZ LYS 5 3HZ LYS 5 4.014 -5.467 15.401
38 H SER 6 H SER 6 0.662 -9.738 8.484
39 HA SER 6 HA SER 6 2.488 -8.945 6.471
40 1HB SER 6 1HB SER 6 0.924 -10.014 4.826
41 2HB SER 6 2HB SER 6 1.415 -11.068 6.204
42 HG SER 6 HG SER 6 -0.904 -11.005 5.620
43 H ALA 7 H ALA 7 2.570 -7.276 5.018
44 HA ALA 7 HA ALA 7 0.355 -5.391 4.949
45 1HB ALA 7 1HB ALA 7 1.872 -4.131 3.356
46 2HB ALA 7 2HB ALA 7 3.076 -5.473 3.512
47 3HB ALA 7 3HB ALA 7 2.642 -4.477 4.940
48 H CYS 8 H CYS 8 -0.715 -4.831 2.897
49 HA CYS 8 HA CYS 8 -0.402 -6.889 0.761
50 1HB CYS 8 1HB CYS 8 -2.733 -6.785 0.223
51 2HB CYS 8 2HB CYS 8 -2.576 -7.173 1.964
52 H CYS 9 H CYS 9 -0.882 -6.105 -1.474
53 HA CYS 9 HA CYS 9 -1.362 -3.320 -1.850
54 1HB CYS 9 1HB CYS 9 1.135 -3.291 -1.268
55 2HB CYS 9 2HB CYS 9 1.396 -4.475 -2.583
56 H ASP 10 H ASP 10 -2.566 -3.296 -3.825
57 HA ASP 10 HA ASP 10 -2.159 -5.448 -5.708
58 1HB ASP 10 1HB ASP 10 -3.994 -3.104 -5.422
59 2HB ASP 10 2HB ASP 10 -3.687 -3.570 -7.062
60 HD2 ASP 10 HD2 ASP 10 -5.083 -4.814 -7.772
61 H THR 11 H THR 11 -0.868 -2.187 -5.493
62 HA THR 11 HA THR 11 0.548 -2.481 -8.058
63 HB THR 11 HB THR 11 -1.333 -0.098 -7.548
64 HG1 THR 11 HG1 THR 11 -2.790 -1.489 -8.026
65 1HG2 THR 11 1HG2 THR 11 0.108 -1.135 -10.101
66 2HG2 THR 11 2HG2 THR 11 0.576 0.334 -9.154
67 3HG2 THR 11 3HG2 THR 11 -0.989 0.290 -10.003
68 H CYS 12 H CYS 12 2.469 -1.421 -8.041
69 HA CYS 12 HA CYS 12 2.981 0.692 -6.127
70 1HB CYS 12 1HB CYS 12 4.544 -0.669 -4.888
71 2HB CYS 12 2HB CYS 12 3.007 -1.622 -5.027
72 H LEU 13 H LEU 13 5.235 1.265 -6.039
73 HA LEU 13 HA LEU 13 6.620 1.051 -8.595
74 1HB LEU 13 1HB LEU 13 4.862 2.744 -8.848
75 2HB LEU 13 2HB LEU 13 5.462 3.642 -7.427
76 HG LEU 13 HG LEU 13 7.322 3.023 -9.804
77 1HD1 LEU 13 1HD1 LEU 13 5.210 3.861 -10.816
78 2HD1 LEU 13 2HD1 LEU 13 6.541 5.055 -10.986
79 3HD1 LEU 13 3HD1 LEU 13 5.249 5.310 -9.756
80 1HD2 LEU 13 1HD2 LEU 13 7.084 5.499 -7.960
81 2HD2 LEU 13 2HD2 LEU 13 8.302 5.263 -9.265
82 3HD2 LEU 13 3HD2 LEU 13 8.330 4.209 -7.812
83 H CYS 14 H CYS 14 8.637 0.926 -8.253
84 HA CYS 14 HA CYS 14 9.738 1.505 -5.642
85 1HB CYS 14 1HB CYS 14 10.901 -0.113 -7.914
86 2HB CYS 14 2HB CYS 14 11.690 0.148 -6.353
87 H THR 15 H THR 15 11.694 2.508 -5.194
88 HA THR 15 HA THR 15 12.281 4.746 -6.921
89 HB THR 15 HB THR 15 14.132 5.213 -5.380
90 HG1 THR 15 HG1 THR 15 13.886 3.896 -3.327
91 1HG2 THR 15 1HG2 THR 15 11.433 4.584 -3.969
92 2HG2 THR 15 2HG2 THR 15 11.779 6.033 -4.988
93 3HG2 THR 15 3HG2 THR 15 12.668 5.790 -3.437
94 H ARG 16 H ARG 16 14.140 5.070 -8.142
95 HA ARG 16 HA ARG 16 15.973 2.816 -8.483
96 1HB ARG 16 1HB ARG 16 15.988 5.618 -9.695
97 2HB ARG 16 2HB ARG 16 17.282 4.384 -9.934
98 1HG ARG 16 1HG ARG 16 15.662 2.796 -10.889
99 2HG ARG 16 2HG ARG 16 14.333 3.981 -10.658
100 1HD ARG 16 1HD ARG 16 15.555 5.578 -12.269
101 2HD ARG 16 2HD ARG 16 16.787 4.278 -12.534
102 HE ARG 16 HE ARG 16 15.204 3.021 -13.750
103 1HH1 ARG 16 1HH1 ARG 16 13.544 5.744 -12.122
104 2HH1 ARG 16 2HH1 ARG 16 12.000 5.377 -12.815
105 1HH2 ARG 16 1HH2 ARG 16 13.128 2.548 -14.633
106 2HH2 ARG 16 2HH2 ARG 16 11.755 3.533 -14.245
107 H SER 17 H SER 17 17.587 2.565 -6.971
108 HA SER 17 HA SER 17 18.926 4.686 -5.695
109 1HB SER 17 1HB SER 17 16.522 4.779 -4.603
110 2HB SER 17 2HB SER 17 16.971 3.229 -3.835
111 HG SER 17 HG SER 17 17.395 5.118 -2.580
112 H GLN 18 H GLN 18 19.931 3.669 -3.585
113 HA GLN 18 HA GLN 18 20.604 0.849 -3.913
114 1HB GLN 18 1HB GLN 18 21.931 2.195 -5.588
115 2HB GLN 18 2HB GLN 18 22.625 3.121 -4.239
116 1HG GLN 18 1HG GLN 18 23.553 0.887 -3.311
117 2HG GLN 18 2HG GLN 18 22.968 0.081 -4.806
118 1HE2 GLN 18 1HE2 GLN 18 25.701 1.252 -3.443
119 2HE2 GLN 18 2HE2 GLN 18 26.560 1.815 -4.861
120 HA PRO 19 HA PRO 19 20.026 -0.495 -2.374
121 1HB PRO 19 1HB PRO 19 18.649 -1.126 -0.052
122 2HB PRO 19 2HB PRO 19 20.458 -1.323 -0.189
123 1HG PRO 19 1HG PRO 19 18.922 1.075 0.980
124 2HG PRO 19 2HG PRO 19 20.223 0.088 1.768
125 1HD PRO 19 1HD PRO 19 20.742 2.440 0.409
126 2HD PRO 19 2HD PRO 19 21.920 1.048 0.341
127 HA PRO 20 HA PRO 20 16.252 1.229 -3.703
128 1HB PRO 20 1HB PRO 20 14.572 -0.920 -4.107
129 2HB PRO 20 2HB PRO 20 16.151 -0.795 -4.969
130 1HG PRO 20 1HG PRO 20 15.602 -2.299 -2.341
131 2HG PRO 20 2HG PRO 20 16.297 -2.975 -3.876
132 1HD PRO 20 1HD PRO 20 17.903 -2.082 -1.837
133 2HD PRO 20 2HD PRO 20 18.352 -1.736 -3.580
134 H THR 21 H THR 21 13.789 1.389 -3.425
135 HA THR 21 HA THR 21 12.710 0.671 -0.819
136 HB THR 21 HB THR 21 12.039 3.493 -1.412
137 HG1 THR 21 HG1 THR 21 14.752 2.982 -0.882
138 1HG2 THR 21 1HG2 THR 21 12.805 3.798 0.966
139 2HG2 THR 21 2HG2 THR 21 13.560 2.162 0.949
140 3HG2 THR 21 3HG2 THR 21 11.771 2.336 0.842
141 H CYS 22 H CYS 22 10.298 0.774 -0.917
142 HA CYS 22 HA CYS 22 9.280 1.538 -3.558
143 1HB CYS 22 1HB CYS 22 10.187 -1.005 -3.334
144 2HB CYS 22 2HB CYS 22 8.641 -1.252 -2.504
145 H ARG 23 H ARG 23 6.905 1.143 -3.684
146 HA ARG 23 HA ARG 23 5.539 1.880 -1.197
147 1HB ARG 23 1HB ARG 23 7.173 3.727 -1.875
148 2HB ARG 23 2HB ARG 23 6.303 3.879 -3.419
149 1HG ARG 23 1HG ARG 23 4.932 4.373 -0.685
150 2HG ARG 23 2HG ARG 23 5.972 5.558 -1.507
151 1HD ARG 23 1HD ARG 23 4.470 5.402 -3.576
152 2HD ARG 23 2HD ARG 23 3.277 4.497 -2.529
153 HE ARG 23 HE ARG 23 4.499 7.024 -1.501
154 1HH1 ARG 23 1HH1 ARG 23 1.472 5.624 -2.898
155 2HH1 ARG 23 2HH1 ARG 23 0.508 6.880 -2.225
156 1HH2 ARG 23 1HH2 ARG 23 3.326 8.533 -0.761
157 2HH2 ARG 23 2HH2 ARG 23 1.592 8.680 -0.961
158 H CYS 24 H CYS 24 3.439 1.869 -1.374
159 HA CYS 24 HA CYS 24 2.378 0.547 -3.754
160 1HB CYS 24 1HB CYS 24 2.068 -0.414 -1.349
161 2HB CYS 24 2HB CYS 24 0.957 0.963 -1.049
162 H VAL 25 H VAL 25 1.607 1.887 -5.279
163 HA VAL 25 HA VAL 25 0.724 4.506 -4.753
164 HB VAL 25 HB VAL 25 0.406 4.748 -7.092
165 1HG1 VAL 25 1HG1 VAL 25 2.771 4.347 -7.777
166 2HG1 VAL 25 2HG1 VAL 25 2.998 3.133 -6.476
167 3HG1 VAL 25 3HG1 VAL 25 2.725 4.861 -6.049
168 1HG2 VAL 25 1HG2 VAL 25 0.820 2.890 -8.680
169 2HG2 VAL 25 2HG2 VAL 25 -0.549 2.440 -7.624
170 3HG2 VAL 25 3HG2 VAL 25 1.098 1.744 -7.345
171 H ASP 26 H ASP 26 -0.640 1.416 -4.823
172 HA ASP 26 HA ASP 26 -3.294 2.185 -5.484
173 1HB ASP 26 1HB ASP 26 -1.971 -0.303 -5.277
174 2HB ASP 26 2HB ASP 26 -3.093 -0.334 -3.876
175 HD2 ASP 26 HD2 ASP 26 -5.889 -0.159 -6.044
176 H VAL 27 H VAL 27 -5.173 1.845 -4.105
177 HA VAL 27 HA VAL 27 -4.756 3.318 -1.585
178 HB VAL 27 HB VAL 27 -5.618 4.205 -3.993
179 1HG1 VAL 27 1HG1 VAL 27 -8.223 3.461 -2.524
180 2HG1 VAL 27 2HG1 VAL 27 -7.593 2.660 -4.027
181 3HG1 VAL 27 3HG1 VAL 27 -8.053 4.409 -4.043
182 1HG2 VAL 27 1HG2 VAL 27 -6.754 6.062 -2.741
183 2HG2 VAL 27 2HG2 VAL 27 -5.110 5.637 -2.145
184 3HG2 VAL 27 3HG2 VAL 27 -6.568 5.102 -1.212
185 H ARG 28 H ARG 28 -5.847 2.644 0.205
186 HA ARG 28 HA ARG 28 -7.783 0.409 -0.187
187 1HB ARG 28 1HB ARG 28 -5.702 0.909 1.988
188 2HB ARG 28 2HB ARG 28 -6.943 -0.394 2.085
189 1HG ARG 28 1HG ARG 28 -5.944 -1.651 0.320
190 2HG ARG 28 2HG ARG 28 -4.989 -0.268 -0.297
191 1HD ARG 28 1HD ARG 28 -4.520 -1.584 2.435
192 2HD ARG 28 2HD ARG 28 -3.612 -1.959 0.890
193 HE ARG 28 HE ARG 28 -3.625 0.882 1.330
194 1HH1 ARG 28 1HH1 ARG 28 -2.161 -2.105 2.583
195 2HH1 ARG 28 2HH1 ARG 28 -0.719 -1.332 3.175
196 1HH2 ARG 28 1HH2 ARG 28 -1.710 1.925 2.146
197 2HH2 ARG 28 2HH2 ARG 28 -0.477 0.992 2.944
198 H GLU 29 H GLU 29 -9.467 0.274 1.368
199 HA GLU 29 HA GLU 29 -10.232 2.486 2.952
200 1HB GLU 29 1HB GLU 29 -10.915 -0.487 2.938
201 2HB GLU 29 2HB GLU 29 -11.593 0.691 4.135
202 1HG GLU 29 1HG GLU 29 -12.425 2.066 2.115
203 2HG GLU 29 2HG GLU 29 -11.934 0.713 1.053
204 HE2 GLU 29 HE2 GLU 29 -12.894 -1.209 1.363
205 H SER 30 H SER 30 -8.827 -0.614 3.861
206 HA SER 30 HA SER 30 -8.126 0.262 6.477
207 1HB SER 30 1HB SER 30 -7.559 -2.500 5.257
208 2HB SER 30 2HB SER 30 -7.484 -2.022 6.993
209 HG SER 30 HG SER 30 -9.469 -2.944 6.657
210 H CYS 31 H CYS 31 -6.325 0.892 7.301
211 HA CYS 31 HA CYS 31 -3.845 0.390 5.775
212 1HB CYS 31 1HB CYS 31 -4.723 2.788 6.077
213 2HB CYS 31 2HB CYS 31 -4.260 2.618 7.829
214 H HIS 32 H HIS 32 -1.881 0.402 7.333
215 HA HIS 32 HA HIS 32 -2.495 -1.818 9.196
216 1HB HIS 32 1HB HIS 32 -1.509 -2.276 6.935
217 2HB HIS 32 2HB HIS 32 0.023 -1.463 7.470
218 HD1 HIS 32 HD1 HIS 32 -2.396 -4.144 8.598
219 HD2 HIS 32 HD2 HIS 32 1.749 -3.660 8.160
220 HE1 HIS 32 HE1 HIS 32 -1.340 -6.274 9.309
221 HE2 HIS 32 HE2 HIS 32 1.189 -5.962 9.003
222 H SER 33 H SER 33 -1.025 -2.222 10.895
223 HA SER 33 HA SER 33 -0.126 -0.184 12.409
224 1HB SER 33 1HB SER 33 1.058 -3.033 12.325
225 2HB SER 33 2HB SER 33 1.120 -1.937 13.747
226 HG SER 33 HG SER 33 -1.152 -2.040 13.849
227 H ALA 34 H ALA 34 1.575 -1.623 9.794
228 HA ALA 34 HA ALA 34 4.163 -0.770 10.290
229 1HB ALA 34 1HB ALA 34 3.494 -2.536 8.633
230 2HB ALA 34 2HB ALA 34 4.500 -1.280 7.862
231 3HB ALA 34 3HB ALA 34 2.723 -1.278 7.593
232 H CYS 35 H CYS 35 1.397 1.043 9.169
233 HA CYS 35 HA CYS 35 3.171 3.237 8.262
234 1HB CYS 35 1HB CYS 35 1.548 2.354 6.582
235 2HB CYS 35 2HB CYS 35 0.203 2.867 7.697
236 H ASP 36 H ASP 36 3.501 4.707 9.779
237 HA ASP 36 HA ASP 36 1.706 5.263 11.922
238 1HB ASP 36 1HB ASP 36 3.368 6.950 12.569
239 2HB ASP 36 2HB ASP 36 4.200 5.437 12.090
240 HD2 ASP 36 HD2 ASP 36 5.208 5.424 9.999
241 H LYS 37 H LYS 37 2.589 7.034 8.959
242 HA LYS 37 HA LYS 37 0.572 9.075 9.507
243 1HB LYS 37 1HB LYS 37 3.108 9.452 9.103
244 2HB LYS 37 2HB LYS 37 2.806 9.059 7.401
245 1HG LYS 37 1HG LYS 37 1.216 11.013 7.254
246 2HG LYS 37 2HG LYS 37 1.440 11.301 9.011
247 1HD LYS 37 1HD LYS 37 3.956 11.554 8.607
248 2HD LYS 37 2HD LYS 37 3.655 11.431 6.845
249 1HE LYS 37 1HE LYS 37 2.253 13.558 6.971
250 2HE LYS 37 2HE LYS 37 2.636 13.655 8.742
251 1HZ LYS 37 1HZ LYS 37 4.544 13.745 6.470
252 2HZ LYS 37 2HZ LYS 37 4.999 13.618 8.099
253 3HZ LYS 37 3HZ LYS 37 4.154 14.990 7.560
254 H CYS 38 H CYS 38 -0.923 7.045 8.881
255 HA CYS 38 HA CYS 38 -1.261 6.922 6.001
256 1HB CYS 38 1HB CYS 38 -1.486 5.071 7.913
257 2HB CYS 38 2HB CYS 38 -3.205 5.608 7.903
258 H VAL 39 H VAL 39 -2.201 8.478 4.920
259 HA VAL 39 HA VAL 39 -3.967 10.263 6.303
260 HB VAL 39 HB VAL 39 -1.787 10.818 5.289
261 1HG1 VAL 39 1HG1 VAL 39 -1.632 11.298 2.917
262 2HG1 VAL 39 2HG1 VAL 39 -3.239 10.566 2.599
263 3HG1 VAL 39 3HG1 VAL 39 -1.867 9.524 3.175
264 1HG2 VAL 39 1HG2 VAL 39 -2.546 12.928 4.380
265 2HG2 VAL 39 2HG2 VAL 39 -3.514 12.500 5.853
266 3HG2 VAL 39 3HG2 VAL 39 -4.239 12.313 4.187
267 H CYS 40 H CYS 40 -6.089 9.536 6.329
268 HA CYS 40 HA CYS 40 -7.191 8.241 3.983
269 1HB CYS 40 1HB CYS 40 -8.392 8.649 6.701
270 2HB CYS 40 2HB CYS 40 -9.094 7.734 5.369
271 H ALA 41 H ALA 41 -8.256 9.205 2.504
272 HA ALA 41 HA ALA 41 -9.712 11.690 2.875
273 1HB ALA 41 1HB ALA 41 -8.655 11.319 0.689
274 2HB ALA 41 2HB ALA 41 -10.446 11.487 0.591
275 3HB ALA 41 3HB ALA 41 -9.674 9.851 0.457
276 H TYR 42 H TYR 42 -11.932 11.887 2.920
277 HA TYR 42 HA TYR 42 -13.186 9.817 4.388
278 1HB TYR 42 1HB TYR 42 -14.931 11.521 4.805
279 2HB TYR 42 2HB TYR 42 -13.268 12.175 5.024
280 HD1 TYR 42 HD1 TYR 42 -12.525 14.071 3.684
281 HD2 TYR 42 HD2 TYR 42 -16.165 12.030 2.601
282 HE1 TYR 42 HE1 TYR 42 -13.112 15.891 2.178
283 HE2 TYR 42 HE2 TYR 42 -16.704 13.820 1.035
284 HH TYR 42 HH TYR 42 -14.723 16.783 0.799
285 H SER 43 H SER 43 -12.891 9.885 1.298
286 HA SER 43 HA SER 43 -15.196 10.251 -0.018
287 1HB SER 43 1HB SER 43 -13.010 8.327 -0.915
288 2HB SER 43 2HB SER 43 -14.066 9.410 -1.957
289 HG SER 43 HG SER 43 -12.007 10.288 -1.688
290 H ASN 44 H ASN 44 -15.321 7.965 -1.873
291 HA ASN 44 HA ASN 44 -17.018 6.156 -0.348
292 1HB ASN 44 1HB ASN 44 -18.135 8.332 -1.026
293 2HB ASN 44 2HB ASN 44 -17.839 7.942 -2.734
294 1HD2 ASN 44 1HD2 ASN 44 -18.803 5.550 -3.324
295 2HD2 ASN 44 2HD2 ASN 44 -20.342 5.218 -2.633
296 HA PRO 45 HA PRO 45 -16.424 4.252 0.018
297 1HB PRO 45 1HB PRO 45 -14.717 2.097 -0.048
298 2HB PRO 45 2HB PRO 45 -16.310 2.006 -0.791
299 1HG PRO 45 1HG PRO 45 -13.662 2.663 -2.205
300 2HG PRO 45 2HG PRO 45 -14.880 1.432 -2.693
301 1HD PRO 45 1HD PRO 45 -14.808 4.017 -3.757
302 2HD PRO 45 2HD PRO 45 -16.376 3.129 -3.530
303 HA PRO 46 HA PRO 46 -13.202 6.711 1.378
304 1HB PRO 46 1HB PRO 46 -12.251 5.665 3.792
305 2HB PRO 46 2HB PRO 46 -13.872 6.442 3.587
306 1HG PRO 46 1HG PRO 46 -13.220 3.458 3.486
307 2HG PRO 46 2HG PRO 46 -14.521 4.313 4.413
308 1HD PRO 46 1HD PRO 46 -15.046 3.106 2.001
309 2HD PRO 46 2HD PRO 46 -15.787 4.785 2.412
310 H GLN 47 H GLN 47 -10.828 7.122 1.683
311 HA GLN 47 HA GLN 47 -9.363 4.990 0.238
312 1HB GLN 47 1HB GLN 47 -9.361 7.989 -0.419
313 2HB GLN 47 2HB GLN 47 -8.487 6.699 -1.314
314 1HG GLN 47 1HG GLN 47 -11.567 6.743 -1.170
315 2HG GLN 47 2HG GLN 47 -10.662 7.811 -2.285
316 1HE2 GLN 47 1HE2 GLN 47 -11.257 4.405 -1.468
317 2HE2 GLN 47 2HE2 GLN 47 -10.878 3.815 -3.086
318 H CYS 48 H CYS 48 -7.268 4.822 0.962
319 HA CYS 48 HA CYS 48 -6.174 7.006 2.555
320 1HB CYS 48 1HB CYS 48 -7.736 5.294 3.865
321 2HB CYS 48 2HB CYS 48 -6.392 4.163 3.660
322 H GLN 49 H GLN 49 -4.118 7.158 2.535
323 HA GLN 49 HA GLN 49 -2.549 5.131 1.105
324 1HB GLN 49 1HB GLN 49 -2.799 8.158 0.750
325 2HB GLN 49 2HB GLN 49 -1.281 7.292 0.236
326 1HG GLN 49 1HG GLN 49 -2.739 5.795 -1.229
327 2HG GLN 49 2HG GLN 49 -4.134 6.852 -0.765
328 1HE2 GLN 49 1HE2 GLN 49 -4.603 8.102 -2.465
329 2HE2 GLN 49 2HE2 GLN 49 -3.456 8.916 -3.499
330 H CYS 50 H CYS 50 -0.475 4.887 1.770
331 HA CYS 50 HA CYS 50 0.184 6.114 4.386
332 1HB CYS 50 1HB CYS 50 0.616 3.596 3.951
333 2HB CYS 50 2HB CYS 50 1.851 4.120 2.766
334 H TYR 51 H TYR 51 1.223 7.897 4.505
335 HA TYR 51 HA TYR 51 1.952 9.489 2.428
336 1HB TYR 51 1HB TYR 51 1.515 9.874 4.993
337 2HB TYR 51 2HB TYR 51 3.253 9.640 5.215
338 HD1 TYR 51 HD1 TYR 51 0.569 11.901 4.280
339 HD2 TYR 51 HD2 TYR 51 4.826 11.199 3.817
340 HE1 TYR 51 HE1 TYR 51 0.889 14.192 3.674
341 HE2 TYR 51 HE2 TYR 51 5.147 13.488 3.223
342 HH TYR 51 HH TYR 51 4.242 15.500 2.944
343 H ASP 52 H ASP 52 4.030 7.443 4.344
344 HA ASP 52 HA ASP 52 6.412 8.065 2.767
345 1HB ASP 52 1HB ASP 52 7.654 7.049 4.654
346 2HB ASP 52 2HB ASP 52 6.540 8.359 5.162
347 HD2 ASP 52 HD2 ASP 52 5.270 6.497 7.560
348 H THR 53 H THR 53 8.035 6.306 2.470
349 HA THR 53 HA THR 53 7.051 4.348 0.742
350 HB THR 53 HB THR 53 9.431 3.287 0.999
351 HG1 THR 53 HG1 THR 53 9.904 4.353 3.001
352 1HG2 THR 53 1HG2 THR 53 9.031 6.224 0.101
353 2HG2 THR 53 2HG2 THR 53 8.744 4.763 -0.904
354 3HG2 THR 53 3HG2 THR 53 10.406 5.159 -0.348
355 H HIS 54 H HIS 54 7.377 1.971 0.852
356 HA HIS 54 HA HIS 54 6.302 1.114 3.493
357 1HB HIS 54 1HB HIS 54 5.755 -0.090 0.733
358 2HB HIS 54 2HB HIS 54 5.366 -0.907 2.308
359 HD1 HIS 54 HD1 HIS 54 4.787 2.631 0.984
360 HD2 HIS 54 HD2 HIS 54 2.617 -0.659 2.428
361 HE1 HIS 54 HE1 HIS 54 2.371 3.220 0.795
362 HE2 HIS 54 HE2 HIS 54 1.062 1.220 1.686
363 H LYS 55 H LYS 55 7.701 -1.166 1.123
364 HA LYS 55 HA LYS 55 10.260 -1.092 2.206
365 1HB LYS 55 1HB LYS 55 10.092 -3.535 3.043
366 2HB LYS 55 2HB LYS 55 9.404 -2.258 4.073
367 1HG LYS 55 1HG LYS 55 7.080 -2.779 3.069
368 2HG LYS 55 2HG LYS 55 7.800 -4.294 2.433
369 1HD LYS 55 1HD LYS 55 7.743 -3.376 5.389
370 2HD LYS 55 2HD LYS 55 6.622 -4.536 4.611
371 1HE LYS 55 1HE LYS 55 8.550 -6.090 4.137
372 2HE LYS 55 2HE LYS 55 9.649 -4.973 5.047
373 1HZ LYS 55 1HZ LYS 55 7.206 -6.305 6.103
374 2HZ LYS 55 2HZ LYS 55 8.205 -5.247 6.966
375 3HZ LYS 55 3HZ LYS 55 8.814 -6.743 6.438
376 H PHE 56 H PHE 56 8.826 -4.024 1.100
377 HA PHE 56 HA PHE 56 9.312 -3.377 -1.733
378 1HB PHE 56 1HB PHE 56 9.451 -5.948 -1.987
379 2HB PHE 56 2HB PHE 56 10.819 -5.131 -1.180
380 HD1 PHE 56 HD1 PHE 56 7.777 -7.203 -0.631
381 HD2 PHE 56 HD2 PHE 56 11.337 -5.560 1.152
382 HE1 PHE 56 HE1 PHE 56 7.525 -8.709 1.298
383 HE2 PHE 56 HE2 PHE 56 11.074 -7.070 3.067
384 HZ PHE 56 HZ PHE 56 9.171 -8.663 3.148
385 H CYS 57 H CYS 57 7.671 -5.107 -3.053
386 HA CYS 57 HA CYS 57 5.040 -4.192 -2.177
387 1HB CYS 57 1HB CYS 57 5.888 -5.611 -4.730
388 2HB CYS 57 2HB CYS 57 4.282 -4.883 -4.396
389 H TYR 58 H TYR 58 3.377 -5.442 -1.640
390 HA TYR 58 HA TYR 58 3.940 -8.288 -1.043
391 1HB TYR 58 1HB TYR 58 2.229 -6.125 0.258
392 2HB TYR 58 2HB TYR 58 1.688 -7.806 0.390
393 HD1 TYR 58 HD1 TYR 58 4.704 -5.632 0.959
394 HD2 TYR 58 HD2 TYR 58 2.699 -9.311 1.985
395 HE1 TYR 58 HE1 TYR 58 6.327 -6.052 2.728
396 HE2 TYR 58 HE2 TYR 58 4.279 -9.693 3.750
397 HH TYR 58 HH TYR 58 5.979 -8.722 5.034
398 H LYS 59 H LYS 59 2.047 -9.617 -0.993
399 HA LYS 59 HA LYS 59 0.757 -10.087 -3.350
400 1HB LYS 59 1HB LYS 59 0.029 -10.718 -0.459
401 2HB LYS 59 2HB LYS 59 -0.839 -11.439 -1.855
402 1HG LYS 59 1HG LYS 59 1.083 -12.636 -2.617
403 2HG LYS 59 2HG LYS 59 2.218 -11.786 -1.546
404 1HD LYS 59 1HD LYS 59 -0.083 -13.540 -0.481
405 2HD LYS 59 2HD LYS 59 1.571 -14.139 -0.836
406 1HE LYS 59 1HE LYS 59 2.555 -12.511 0.794
407 2HE LYS 59 2HE LYS 59 0.893 -11.948 1.240
408 1HZ LYS 59 1HZ LYS 59 1.929 -14.721 1.487
409 2HZ LYS 59 2HZ LYS 59 0.378 -14.188 1.929
410 3HZ LYS 59 3HZ LYS 59 1.751 -13.594 2.744
411 H ALA 60 H ALA 60 -1.483 -10.043 -3.921
412 HA ALA 60 HA ALA 60 -2.525 -7.433 -3.741
413 1HB ALA 60 1HB ALA 60 -3.829 -10.021 -4.775
414 2HB ALA 60 2HB ALA 60 -2.689 -9.018 -5.713
415 3HB ALA 60 3HB ALA 60 -4.291 -8.328 -5.238
416 H CYS 61 H CYS 61 -4.453 -6.642 -3.024
417 HA CYS 61 HA CYS 61 -5.181 -7.842 -0.439
418 1HB CYS 61 1HB CYS 61 -4.233 -5.357 -0.980
419 2HB CYS 61 2HB CYS 61 -5.952 -4.984 -1.152
420 H HIS 62 H HIS 62 -6.414 -9.080 -2.521
421 HA HIS 62 HA HIS 62 -9.016 -7.861 -2.997
422 1HB HIS 62 1HB HIS 62 -8.036 -10.630 -3.796
423 2HB HIS 62 2HB HIS 62 -9.575 -9.840 -4.285
424 HD1 HIS 62 HD1 HIS 62 -8.228 -10.574 -6.565
425 HD2 HIS 62 HD2 HIS 62 -7.059 -7.022 -4.650
426 HE1 HIS 62 HE1 HIS 62 -7.101 -9.142 -8.289
427 HE2 HIS 62 HE2 HIS 62 -6.385 -7.013 -7.099
428 H ASN 63 H ASN 63 -9.722 -7.681 -0.848
429 HA ASN 63 HA ASN 63 -10.276 -9.815 0.890
430 1HB ASN 63 1HB ASN 63 -11.717 -8.015 2.066
431 2HB ASN 63 2HB ASN 63 -9.969 -7.743 1.973
432 1HD2 ASN 63 1HD2 ASN 63 -9.176 -5.969 0.406
433 2HD2 ASN 63 2HD2 ASN 63 -10.336 -4.847 -0.183
434 H SER 64 H SER 64 -12.405 -7.781 -0.970
435 HA SER 64 HA SER 64 -14.642 -9.718 -0.736
436 1HB SER 64 1HB SER 64 -14.481 -6.777 -1.631
437 2HB SER 64 2HB SER 64 -16.001 -7.739 -1.709
438 HG SER 64 HG SER 64 -15.970 -7.915 0.530
439 H GLU 65 H GLU 65 -13.873 -11.270 -2.369
440 HA GLU 65 HA GLU 65 -13.253 -10.483 -4.998
441 1HB GLU 65 1HB GLU 65 -13.138 -12.962 -3.686
442 2HB GLU 65 2HB GLU 65 -14.355 -13.237 -4.922
443 1HG GLU 65 1HG GLU 65 -12.300 -13.875 -5.875
444 2HG GLU 65 2HG GLU 65 -12.756 -12.332 -6.680
445 HE2 GLU 65 HE2 GLU 65 -9.876 -12.118 -3.831
446 H ILE 66 H ILE 66 -16.273 -12.222 -4.184
447 HA ILE 66 HA ILE 66 -17.570 -10.908 -6.417
448 HB ILE 66 HB ILE 66 -17.702 -13.308 -6.235
449 1HG1 ILE 66 1HG1 ILE 66 -20.381 -11.809 -6.027
450 2HG1 ILE 66 2HG1 ILE 66 -19.268 -11.724 -7.435
451 1HG2 ILE 66 1HG2 ILE 66 -17.938 -13.579 -3.740
452 2HG2 ILE 66 2HG2 ILE 66 -19.227 -14.402 -4.670
453 3HG2 ILE 66 3HG2 ILE 66 -19.604 -12.860 -3.847
454 1HD1 ILE 66 1HD1 ILE 66 -20.683 -14.275 -6.395
455 2HD1 ILE 66 2HD1 ILE 66 -19.467 -14.235 -7.727
456 3HD1 ILE 66 3HD1 ILE 66 -21.033 -13.370 -7.910
457 H GLU 67 H GLU 67 -17.700 -11.152 -2.846
458 HA GLU 67 HA GLU 67 -18.466 -8.494 -2.669
459 1HB GLU 67 1HB GLU 67 -20.369 -8.783 -1.153
460 2HB GLU 67 2HB GLU 67 -20.759 -9.613 -2.686
461 1HG GLU 67 1HG GLU 67 -21.281 -11.458 -1.495
462 2HG GLU 67 2HG GLU 67 -19.531 -11.704 -1.194
463 HE2 GLU 67 HE2 GLU 67 -18.959 -9.718 0.582
Start of MODEL 12
1 1H GLY 1 1H GLY 1 5.209 -21.877 10.218
2 2H GLY 1 2H GLY 1 3.567 -21.452 10.274
3 3H GLY 1 3H GLY 1 4.366 -21.924 11.699
4 1HA GLY 1 1HA GLY 1 5.638 -20.016 11.781
5 2HA GLY 1 2HA GLY 1 5.134 -19.596 10.089
6 H ASP 2 H ASP 2 4.232 -17.600 10.502
7 HA ASP 2 HA ASP 2 1.519 -17.698 11.479
8 1HB ASP 2 1HB ASP 2 1.761 -15.903 13.199
9 2HB ASP 2 2HB ASP 2 2.746 -17.340 13.620
10 HD2 ASP 2 HD2 ASP 2 5.060 -14.821 14.246
11 H ASP 3 H ASP 3 0.407 -15.557 11.117
12 HA ASP 3 HA ASP 3 1.781 -13.740 9.298
13 1HB ASP 3 1HB ASP 3 0.386 -15.382 7.963
14 2HB ASP 3 2HB ASP 3 -1.070 -14.897 8.892
15 HD2 ASP 3 HD2 ASP 3 -2.062 -13.174 8.283
16 H VAL 4 H VAL 4 1.784 -11.851 10.314
17 HA VAL 4 HA VAL 4 -0.285 -11.279 12.321
18 HB VAL 4 HB VAL 4 1.745 -10.200 13.621
19 1HG1 VAL 4 1HG1 VAL 4 1.784 -12.283 14.978
20 2HG1 VAL 4 2HG1 VAL 4 1.026 -13.210 13.634
21 3HG1 VAL 4 3HG1 VAL 4 0.110 -11.899 14.461
22 1HG2 VAL 4 1HG2 VAL 4 3.093 -12.667 12.298
23 2HG2 VAL 4 2HG2 VAL 4 3.738 -11.639 13.603
24 3HG2 VAL 4 3HG2 VAL 4 3.581 -10.961 11.956
25 H LYS 5 H LYS 5 2.532 -9.200 11.344
26 HA LYS 5 HA LYS 5 0.586 -7.082 11.242
27 1HB LYS 5 1HB LYS 5 3.653 -7.030 11.224
28 2HB LYS 5 2HB LYS 5 2.586 -5.610 11.424
29 1HG LYS 5 1HG LYS 5 2.894 -7.950 13.417
30 2HG LYS 5 2HG LYS 5 3.612 -6.315 13.542
31 1HD LYS 5 1HD LYS 5 1.317 -5.300 13.671
32 2HD LYS 5 2HD LYS 5 0.579 -6.934 13.520
33 1HE LYS 5 1HE LYS 5 0.601 -6.224 15.884
34 2HE LYS 5 2HE LYS 5 1.695 -7.650 15.658
35 1HZ LYS 5 1HZ LYS 5 2.664 -5.920 17.026
36 2HZ LYS 5 2HZ LYS 5 2.545 -4.803 15.749
37 3HZ LYS 5 3HZ LYS 5 3.559 -6.158 15.601
38 H SER 6 H SER 6 0.210 -8.533 9.240
39 HA SER 6 HA SER 6 1.601 -8.217 6.869
40 1HB SER 6 1HB SER 6 -1.439 -8.569 7.160
41 2HB SER 6 2HB SER 6 -0.463 -8.925 5.681
42 HG SER 6 HG SER 6 -0.832 -10.790 6.999
43 H ALA 7 H ALA 7 1.750 -6.780 5.208
44 HA ALA 7 HA ALA 7 -0.340 -4.734 4.948
45 1HB ALA 7 1HB ALA 7 2.370 -5.144 3.521
46 2HB ALA 7 2HB ALA 7 2.098 -3.969 4.847
47 3HB ALA 7 3HB ALA 7 1.261 -3.736 3.253
48 H CYS 8 H CYS 8 -1.572 -4.718 3.072
49 HA CYS 8 HA CYS 8 -1.109 -6.945 1.210
50 1HB CYS 8 1HB CYS 8 -3.311 -7.217 0.833
51 2HB CYS 8 2HB CYS 8 -3.367 -6.679 2.524
52 H CYS 9 H CYS 9 -0.824 -6.614 -0.989
53 HA CYS 9 HA CYS 9 -0.582 -3.818 -1.887
54 1HB CYS 9 1HB CYS 9 1.484 -4.801 -0.716
55 2HB CYS 9 2HB CYS 9 1.507 -6.093 -1.923
56 H ASP 10 H ASP 10 -2.038 -3.933 -3.666
57 HA ASP 10 HA ASP 10 -1.857 -6.177 -5.475
58 1HB ASP 10 1HB ASP 10 -3.968 -4.831 -4.806
59 2HB ASP 10 2HB ASP 10 -3.359 -3.517 -5.819
60 HD2 ASP 10 HD2 ASP 10 -4.904 -4.991 -8.474
61 H THR 11 H THR 11 -0.491 -2.924 -5.323
62 HA THR 11 HA THR 11 0.665 -3.027 -8.001
63 HB THR 11 HB THR 11 -1.179 -0.730 -7.062
64 HG1 THR 11 HG1 THR 11 -1.880 -2.753 -8.909
65 1HG2 THR 11 1HG2 THR 11 -0.079 -1.489 -9.857
66 2HG2 THR 11 2HG2 THR 11 0.452 -0.095 -8.841
67 3HG2 THR 11 3HG2 THR 11 -1.210 -0.135 -9.497
68 H CYS 12 H CYS 12 2.514 -1.755 -8.060
69 HA CYS 12 HA CYS 12 3.229 -0.182 -5.736
70 1HB CYS 12 1HB CYS 12 5.058 -1.798 -5.261
71 2HB CYS 12 2HB CYS 12 3.426 -2.606 -5.179
72 H LEU 13 H LEU 13 5.319 0.651 -5.797
73 HA LEU 13 HA LEU 13 6.522 1.092 -8.430
74 1HB LEU 13 1HB LEU 13 4.604 2.603 -8.236
75 2HB LEU 13 2HB LEU 13 5.062 3.082 -6.578
76 HG LEU 13 HG LEU 13 6.970 3.633 -8.915
77 1HD1 LEU 13 1HD1 LEU 13 4.460 5.270 -8.214
78 2HD1 LEU 13 2HD1 LEU 13 4.750 4.350 -9.735
79 3HD1 LEU 13 3HD1 LEU 13 5.766 5.791 -9.342
80 1HD2 LEU 13 1HD2 LEU 13 6.264 5.223 -6.351
81 2HD2 LEU 13 2HD2 LEU 13 7.466 5.717 -7.594
82 3HD2 LEU 13 3HD2 LEU 13 7.762 4.254 -6.600
83 H CYS 14 H CYS 14 8.618 1.697 -8.228
84 HA CYS 14 HA CYS 14 9.818 1.845 -5.575
85 1HB CYS 14 1HB CYS 14 10.296 -0.286 -7.730
86 2HB CYS 14 2HB CYS 14 11.504 0.057 -6.477
87 H THR 15 H THR 15 11.661 2.907 -5.477
88 HA THR 15 HA THR 15 12.350 4.504 -7.789
89 HB THR 15 HB THR 15 14.097 5.475 -6.338
90 HG1 THR 15 HG1 THR 15 14.399 3.510 -5.128
91 1HG2 THR 15 1HG2 THR 15 11.715 6.312 -6.340
92 2HG2 THR 15 2HG2 THR 15 12.515 6.519 -4.733
93 3HG2 THR 15 3HG2 THR 15 11.319 5.201 -4.982
94 H ARG 16 H ARG 16 14.169 4.437 -9.095
95 HA ARG 16 HA ARG 16 16.242 2.493 -8.497
96 1HB ARG 16 1HB ARG 16 16.214 4.799 -10.514
97 2HB ARG 16 2HB ARG 16 17.565 3.657 -10.238
98 1HG ARG 16 1HG ARG 16 15.689 1.794 -10.699
99 2HG ARG 16 2HG ARG 16 14.861 3.152 -11.530
100 1HD ARG 16 1HD ARG 16 16.222 1.955 -13.208
101 2HD ARG 16 2HD ARG 16 17.076 3.524 -12.854
102 HE ARG 16 HE ARG 16 18.007 1.502 -11.028
103 1HH1 ARG 16 1HH1 ARG 16 18.183 2.280 -14.521
104 2HH1 ARG 16 2HH1 ARG 16 19.732 1.523 -14.726
105 1HH2 ARG 16 1HH2 ARG 16 20.040 0.500 -11.344
106 2HH2 ARG 16 2HH2 ARG 16 20.800 0.505 -12.904
107 H SER 17 H SER 17 17.754 2.912 -6.962
108 HA SER 17 HA SER 17 18.850 5.362 -6.256
109 1HB SER 17 1HB SER 17 16.391 5.692 -5.345
110 2HB SER 17 2HB SER 17 16.773 4.367 -4.194
111 HG SER 17 HG SER 17 17.115 6.593 -3.474
112 H GLN 18 H GLN 18 19.388 4.761 -3.632
113 HA GLN 18 HA GLN 18 20.411 2.028 -3.543
114 1HB GLN 18 1HB GLN 18 21.931 3.310 -5.013
115 2HB GLN 18 2HB GLN 18 22.175 4.527 -3.721
116 1HG GLN 18 1HG GLN 18 23.234 2.769 -2.238
117 2HG GLN 18 2HG GLN 18 22.901 1.511 -3.481
118 1HE2 GLN 18 1HE2 GLN 18 23.767 4.201 -5.289
119 2HE2 GLN 18 2HE2 GLN 18 25.486 3.943 -5.357
120 HA PRO 19 HA PRO 19 19.693 0.713 -2.098
121 1HB PRO 19 1HB PRO 19 17.960 0.036 -0.068
122 2HB PRO 19 2HB PRO 19 19.772 0.060 0.187
123 1HG PRO 19 1HG PRO 19 17.764 2.297 0.841
124 2HG PRO 19 2HG PRO 19 18.978 1.547 1.957
125 1HD PRO 19 1HD PRO 19 19.453 3.877 0.515
126 2HD PRO 19 2HD PRO 19 20.792 2.683 0.861
127 HA PRO 20 HA PRO 20 15.830 2.205 -3.855
128 1HB PRO 20 1HB PRO 20 14.541 -0.094 -4.669
129 2HB PRO 20 2HB PRO 20 16.099 0.418 -5.421
130 1HG PRO 20 1HG PRO 20 15.713 -1.572 -3.108
131 2HG PRO 20 2HG PRO 20 16.620 -1.848 -4.658
132 1HD PRO 20 1HD PRO 20 17.872 -1.036 -2.316
133 2HD PRO 20 2HD PRO 20 18.422 -0.405 -3.947
134 H THR 21 H THR 21 13.498 2.283 -3.511
135 HA THR 21 HA THR 21 12.510 1.394 -0.901
136 HB THR 21 HB THR 21 13.202 4.259 -1.798
137 HG1 THR 21 HG1 THR 21 14.520 4.279 -0.015
138 1HG2 THR 21 1HG2 THR 21 11.041 4.272 -0.491
139 2HG2 THR 21 2HG2 THR 21 12.367 4.980 0.475
140 3HG2 THR 21 3HG2 THR 21 11.820 3.308 0.833
141 H CYS 22 H CYS 22 10.171 1.643 -0.849
142 HA CYS 22 HA CYS 22 9.030 2.340 -3.485
143 1HB CYS 22 1HB CYS 22 8.745 -0.334 -1.954
144 2HB CYS 22 2HB CYS 22 8.026 -0.011 -3.535
145 H ARG 23 H ARG 23 6.639 1.365 -3.327
146 HA ARG 23 HA ARG 23 5.300 1.560 -0.836
147 1HB ARG 23 1HB ARG 23 5.682 4.045 -1.346
148 2HB ARG 23 2HB ARG 23 4.907 3.789 -2.924
149 1HG ARG 23 1HG ARG 23 2.775 3.047 -1.570
150 2HG ARG 23 2HG ARG 23 3.611 3.713 -0.129
151 1HD ARG 23 1HD ARG 23 2.958 5.221 -2.742
152 2HD ARG 23 2HD ARG 23 1.992 5.305 -1.190
153 HE ARG 23 HE ARG 23 4.454 5.936 -0.272
154 1HH1 ARG 23 1HH1 ARG 23 2.680 7.291 -3.103
155 2HH1 ARG 23 2HH1 ARG 23 3.451 8.820 -2.971
156 1HH2 ARG 23 1HH2 ARG 23 5.388 7.827 -0.125
157 2HH2 ARG 23 2HH2 ARG 23 5.083 9.185 -1.184
158 H CYS 24 H CYS 24 3.456 0.458 -1.031
159 HA CYS 24 HA CYS 24 2.541 -0.500 -3.605
160 1HB CYS 24 1HB CYS 24 1.372 -0.821 -0.777
161 2HB CYS 24 2HB CYS 24 0.744 -1.630 -2.243
162 H VAL 25 H VAL 25 1.612 1.034 -4.854
163 HA VAL 25 HA VAL 25 0.537 3.426 -3.863
164 HB VAL 25 HB VAL 25 0.166 4.024 -6.196
165 1HG1 VAL 25 1HG1 VAL 25 2.901 2.670 -5.622
166 2HG1 VAL 25 2HG1 VAL 25 2.399 4.311 -5.061
167 3HG1 VAL 25 3HG1 VAL 25 2.577 3.974 -6.817
168 1HG2 VAL 25 1HG2 VAL 25 0.835 2.473 -8.015
169 2HG2 VAL 25 2HG2 VAL 25 -0.505 1.731 -7.093
170 3HG2 VAL 25 3HG2 VAL 25 1.197 1.173 -6.849
171 H ASP 26 H ASP 26 -0.801 0.412 -4.383
172 HA ASP 26 HA ASP 26 -3.397 1.161 -5.154
173 1HB ASP 26 1HB ASP 26 -2.377 -1.160 -5.415
174 2HB ASP 26 2HB ASP 26 -2.730 -1.433 -3.665
175 HD2 ASP 26 HD2 ASP 26 -5.667 -1.237 -6.407
176 H VAL 27 H VAL 27 -4.494 2.515 -4.080
177 HA VAL 27 HA VAL 27 -4.658 2.839 -1.290
178 HB VAL 27 HB VAL 27 -4.778 4.563 -3.017
179 1HG1 VAL 27 1HG1 VAL 27 -6.830 4.917 -4.335
180 2HG1 VAL 27 2HG1 VAL 27 -7.619 3.493 -3.602
181 3HG1 VAL 27 3HG1 VAL 27 -6.230 3.273 -4.728
182 1HG2 VAL 27 1HG2 VAL 27 -7.412 4.416 -1.412
183 2HG2 VAL 27 2HG2 VAL 27 -6.528 5.883 -1.975
184 3HG2 VAL 27 3HG2 VAL 27 -5.807 4.851 -0.692
185 H ARG 28 H ARG 28 -6.141 2.320 0.258
186 HA ARG 28 HA ARG 28 -8.492 0.800 -0.643
187 1HB ARG 28 1HB ARG 28 -6.564 0.103 1.626
188 2HB ARG 28 2HB ARG 28 -8.201 -0.639 1.449
189 1HG ARG 28 1HG ARG 28 -5.931 -0.814 -0.618
190 2HG ARG 28 2HG ARG 28 -6.365 -2.113 0.560
191 1HD ARG 28 1HD ARG 28 -8.535 -2.464 -0.430
192 2HD ARG 28 2HD ARG 28 -8.382 -1.023 -1.500
193 HE ARG 28 HE ARG 28 -6.442 -2.100 -2.622
194 1HH1 ARG 28 1HH1 ARG 28 -8.772 -4.347 -1.023
195 2HH1 ARG 28 2HH1 ARG 28 -8.456 -5.607 -2.166
196 1HH2 ARG 28 1HH2 ARG 28 -6.122 -3.780 -4.084
197 2HH2 ARG 28 2HH2 ARG 28 -6.940 -5.302 -3.902
198 H GLU 29 H GLU 29 -10.253 0.826 0.792
199 HA GLU 29 HA GLU 29 -10.748 2.982 2.500
200 1HB GLU 29 1HB GLU 29 -11.764 0.145 2.046
201 2HB GLU 29 2HB GLU 29 -12.415 1.112 3.422
202 1HG GLU 29 1HG GLU 29 -13.150 2.900 1.804
203 2HG GLU 29 2HG GLU 29 -12.466 1.933 0.448
204 HE2 GLU 29 HE2 GLU 29 -14.643 1.714 3.141
205 H SER 30 H SER 30 -9.869 -0.360 3.335
206 HA SER 30 HA SER 30 -9.358 0.312 6.068
207 1HB SER 30 1HB SER 30 -8.801 -2.380 4.700
208 2HB SER 30 2HB SER 30 -8.770 -2.017 6.463
209 HG SER 30 HG SER 30 -10.723 -2.876 5.985
210 H CYS 31 H CYS 31 -7.670 1.106 6.898
211 HA CYS 31 HA CYS 31 -5.088 0.582 5.589
212 1HB CYS 31 1HB CYS 31 -5.865 2.959 6.295
213 2HB CYS 31 2HB CYS 31 -5.365 2.456 7.966
214 H HIS 32 H HIS 32 -3.208 0.205 7.127
215 HA HIS 32 HA HIS 32 -3.659 -1.404 9.406
216 1HB HIS 32 1HB HIS 32 -2.203 -3.274 7.889
217 2HB HIS 32 2HB HIS 32 -3.999 -3.389 8.206
218 HD1 HIS 32 HD1 HIS 32 -1.565 -2.073 5.667
219 HD2 HIS 32 HD2 HIS 32 -5.590 -3.187 5.911
220 HE1 HIS 32 HE1 HIS 32 -2.515 -1.832 3.362
221 HE2 HIS 32 HE2 HIS 32 -4.982 -2.506 3.529
222 H SER 33 H SER 33 -1.562 -1.731 10.354
223 HA SER 33 HA SER 33 -0.026 0.623 9.791
224 1HB SER 33 1HB SER 33 0.196 -1.477 12.035
225 2HB SER 33 2HB SER 33 1.269 -0.035 11.925
226 HG SER 33 HG SER 33 -0.494 0.378 13.239
227 H ALA 34 H ALA 34 0.636 -0.334 7.674
228 HA ALA 34 HA ALA 34 3.027 -1.889 7.669
229 1HB ALA 34 1HB ALA 34 1.877 0.031 5.541
230 2HB ALA 34 2HB ALA 34 1.506 -1.725 5.699
231 3HB ALA 34 3HB ALA 34 3.171 -1.203 5.268
232 H CYS 35 H CYS 35 2.307 1.538 7.989
233 HA CYS 35 HA CYS 35 5.050 2.089 8.751
234 1HB CYS 35 1HB CYS 35 4.990 4.214 7.613
235 2HB CYS 35 2HB CYS 35 4.554 2.898 6.446
236 H ASP 36 H ASP 36 4.606 4.643 9.768
237 HA ASP 36 HA ASP 36 2.631 4.015 11.875
238 1HB ASP 36 1HB ASP 36 5.330 4.613 12.089
239 2HB ASP 36 2HB ASP 36 4.610 6.232 12.332
240 HD2 ASP 36 HD2 ASP 36 2.411 5.701 13.588
241 H LYS 37 H LYS 37 2.873 6.118 9.178
242 HA LYS 37 HA LYS 37 0.713 7.767 10.298
243 1HB LYS 37 1HB LYS 37 2.967 8.891 10.133
244 2HB LYS 37 2HB LYS 37 2.946 8.629 8.369
245 1HG LYS 37 1HG LYS 37 1.213 10.215 8.018
246 2HG LYS 37 2HG LYS 37 0.575 10.023 9.679
247 1HD LYS 37 1HD LYS 37 1.670 12.254 9.421
248 2HD LYS 37 2HD LYS 37 2.430 11.236 10.681
249 1HE LYS 37 1HE LYS 37 4.199 12.382 9.541
250 2HE LYS 37 2HE LYS 37 4.319 10.661 9.034
251 1HZ LYS 37 1HZ LYS 37 3.076 11.313 7.015
252 2HZ LYS 37 2HZ LYS 37 4.591 12.066 7.186
253 3HZ LYS 37 3HZ LYS 37 3.167 12.935 7.513
254 H CYS 38 H CYS 38 -0.784 6.147 9.381
255 HA CYS 38 HA CYS 38 -1.104 6.313 6.519
256 1HB CYS 38 1HB CYS 38 -1.578 4.290 7.940
257 2HB CYS 38 2HB CYS 38 -2.968 5.180 8.668
258 H VAL 39 H VAL 39 -2.224 7.740 5.421
259 HA VAL 39 HA VAL 39 -3.789 9.752 6.827
260 HB VAL 39 HB VAL 39 -1.517 10.217 5.944
261 1HG1 VAL 39 1HG1 VAL 39 -1.208 10.616 3.543
262 2HG1 VAL 39 2HG1 VAL 39 -2.813 9.890 3.179
263 3HG1 VAL 39 3HG1 VAL 39 -1.487 8.855 3.867
264 1HG2 VAL 39 1HG2 VAL 39 -2.198 12.338 4.844
265 2HG2 VAL 39 2HG2 VAL 39 -3.279 11.987 6.261
266 3HG2 VAL 39 3HG2 VAL 39 -3.848 11.689 4.556
267 H CYS 40 H CYS 40 -5.833 10.373 5.800
268 HA CYS 40 HA CYS 40 -6.751 8.511 3.739
269 1HB CYS 40 1HB CYS 40 -7.906 9.003 6.510
270 2HB CYS 40 2HB CYS 40 -8.749 8.107 5.243
271 H ALA 41 H ALA 41 -7.831 9.477 2.301
272 HA ALA 41 HA ALA 41 -9.038 12.085 2.581
273 1HB ALA 41 1HB ALA 41 -7.935 11.541 0.474
274 2HB ALA 41 2HB ALA 41 -9.685 11.906 0.262
275 3HB ALA 41 3HB ALA 41 -9.102 10.190 0.198
276 H TYR 42 H TYR 42 -11.071 12.601 2.894
277 HA TYR 42 HA TYR 42 -12.798 10.627 3.962
278 1HB TYR 42 1HB TYR 42 -14.178 12.764 4.521
279 2HB TYR 42 2HB TYR 42 -12.514 12.563 5.182
280 HD1 TYR 42 HD1 TYR 42 -14.355 14.156 2.256
281 HD2 TYR 42 HD2 TYR 42 -10.838 14.215 4.744
282 HE1 TYR 42 HE1 TYR 42 -13.711 16.337 1.307
283 HE2 TYR 42 HE2 TYR 42 -10.241 16.407 3.837
284 HH TYR 42 HH TYR 42 -12.208 18.082 1.372
285 H SER 43 H SER 43 -12.480 10.394 1.218
286 HA SER 43 HA SER 43 -14.555 11.286 -0.405
287 1HB SER 43 1HB SER 43 -12.913 8.730 -0.766
288 2HB SER 43 2HB SER 43 -13.738 9.711 -2.069
289 HG SER 43 HG SER 43 -11.544 10.194 -1.961
290 H ASN 44 H ASN 44 -15.550 9.156 -1.821
291 HA ASN 44 HA ASN 44 -17.191 7.470 -0.086
292 1HB ASN 44 1HB ASN 44 -17.940 9.613 -2.121
293 2HB ASN 44 2HB ASN 44 -18.928 8.141 -2.109
294 1HD2 ASN 44 1HD2 ASN 44 -17.745 10.566 0.380
295 2HD2 ASN 44 2HD2 ASN 44 -19.276 10.637 1.160
296 HA PRO 45 HA PRO 45 -16.635 5.564 0.222
297 1HB PRO 45 1HB PRO 45 -15.097 3.318 0.006
298 2HB PRO 45 2HB PRO 45 -16.740 3.339 -0.643
299 1HG PRO 45 1HG PRO 45 -14.145 3.863 -2.207
300 2HG PRO 45 2HG PRO 45 -15.462 2.712 -2.622
301 1HD PRO 45 1HD PRO 45 -15.314 5.293 -3.658
302 2HD PRO 45 2HD PRO 45 -16.914 4.472 -3.344
303 HA PRO 46 HA PRO 46 -12.993 7.732 1.177
304 1HB PRO 46 1HB PRO 46 -12.332 7.007 3.743
305 2HB PRO 46 2HB PRO 46 -13.905 7.808 3.353
306 1HG PRO 46 1HG PRO 46 -13.384 4.800 3.642
307 2HG PRO 46 2HG PRO 46 -14.644 5.830 4.467
308 1HD PRO 46 1HD PRO 46 -15.138 4.356 2.151
309 2HD PRO 46 2HD PRO 46 -15.930 6.028 2.461
310 H GLN 47 H GLN 47 -10.551 7.605 1.816
311 HA GLN 47 HA GLN 47 -9.443 5.128 0.662
312 1HB GLN 47 1HB GLN 47 -9.018 8.067 -0.160
313 2HB GLN 47 2HB GLN 47 -8.110 6.689 -0.835
314 1HG GLN 47 1HG GLN 47 -11.167 7.041 -1.156
315 2HG GLN 47 2HG GLN 47 -9.940 7.700 -2.292
316 1HE2 GLN 47 1HE2 GLN 47 -11.136 4.618 -0.880
317 2HE2 GLN 47 2HE2 GLN 47 -10.503 3.594 -2.148
318 H CYS 48 H CYS 48 -7.352 4.697 1.305
319 HA CYS 48 HA CYS 48 -5.982 6.561 3.084
320 1HB CYS 48 1HB CYS 48 -6.947 3.688 3.698
321 2HB CYS 48 2HB CYS 48 -5.711 4.556 4.679
322 H GLN 49 H GLN 49 -3.900 6.354 3.115
323 HA GLN 49 HA GLN 49 -2.457 4.236 1.764
324 1HB GLN 49 1HB GLN 49 -2.437 7.272 1.244
325 2HB GLN 49 2HB GLN 49 -1.186 6.161 0.556
326 1HG GLN 49 1HG GLN 49 -2.422 5.686 -1.244
327 2HG GLN 49 2HG GLN 49 -3.813 5.174 -0.237
328 1HE2 GLN 49 1HE2 GLN 49 -2.249 8.026 -1.750
329 2HE2 GLN 49 2HE2 GLN 49 -3.710 8.985 -1.806
330 H CYS 50 H CYS 50 -0.137 4.450 2.248
331 HA CYS 50 HA CYS 50 0.420 5.792 4.821
332 1HB CYS 50 1HB CYS 50 1.544 3.544 4.246
333 2HB CYS 50 2HB CYS 50 2.388 4.391 2.912
334 H TYR 51 H TYR 51 1.256 7.755 5.030
335 HA TYR 51 HA TYR 51 1.553 9.577 2.951
336 1HB TYR 51 1HB TYR 51 1.461 9.699 5.691
337 2HB TYR 51 2HB TYR 51 3.200 9.977 5.493
338 HD1 TYR 51 HD1 TYR 51 3.481 11.676 3.097
339 HD2 TYR 51 HD2 TYR 51 0.331 11.674 6.055
340 HE1 TYR 51 HE1 TYR 51 2.977 13.944 2.547
341 HE2 TYR 51 HE2 TYR 51 -0.155 13.983 5.516
342 HH TYR 51 HH TYR 51 0.315 15.779 4.177
343 H ASP 52 H ASP 52 4.014 7.753 4.686
344 HA ASP 52 HA ASP 52 6.086 8.513 2.775
345 1HB ASP 52 1HB ASP 52 7.654 7.878 4.546
346 2HB ASP 52 2HB ASP 52 6.401 9.027 5.127
347 HD2 ASP 52 HD2 ASP 52 5.145 7.065 7.503
348 H THR 53 H THR 53 7.918 6.486 3.106
349 HA THR 53 HA THR 53 6.864 4.677 1.154
350 HB THR 53 HB THR 53 9.307 3.956 1.001
351 HG1 THR 53 HG1 THR 53 9.987 4.685 3.066
352 1HG2 THR 53 1HG2 THR 53 8.554 6.952 0.687
353 2HG2 THR 53 2HG2 THR 53 8.237 5.645 -0.514
354 3HG2 THR 53 3HG2 THR 53 9.926 6.117 -0.106
355 H HIS 54 H HIS 54 7.502 2.322 1.077
356 HA HIS 54 HA HIS 54 8.079 1.134 3.559
357 1HB HIS 54 1HB HIS 54 5.620 1.352 3.823
358 2HB HIS 54 2HB HIS 54 5.382 0.448 2.276
359 HD1 HIS 54 HD1 HIS 54 5.258 -1.904 2.329
360 HD2 HIS 54 HD2 HIS 54 6.508 -0.466 6.068
361 HE1 HIS 54 HE1 HIS 54 5.142 -3.822 3.918
362 HE2 HIS 54 HE2 HIS 54 5.890 -2.938 6.188
363 H LYS 55 H LYS 55 8.687 -1.001 3.373
364 HA LYS 55 HA LYS 55 10.379 -2.102 2.054
365 1HB LYS 55 1HB LYS 55 7.656 -3.437 2.317
366 2HB LYS 55 2HB LYS 55 9.153 -4.361 1.851
367 1HG LYS 55 1HG LYS 55 10.160 -3.628 4.076
368 2HG LYS 55 2HG LYS 55 8.518 -3.022 4.513
369 1HD LYS 55 1HD LYS 55 7.639 -5.377 3.805
370 2HD LYS 55 2HD LYS 55 9.359 -5.905 3.862
371 1HE LYS 55 1HE LYS 55 7.689 -4.667 6.165
372 2HE LYS 55 2HE LYS 55 8.149 -6.410 5.998
373 1HZ LYS 55 1HZ LYS 55 10.044 -4.127 6.295
374 2HZ LYS 55 2HZ LYS 55 10.453 -5.771 6.203
375 3HZ LYS 55 3HZ LYS 55 9.565 -5.192 7.529
376 H PHE 56 H PHE 56 7.830 -3.629 0.161
377 HA PHE 56 HA PHE 56 8.766 -2.619 -2.334
378 1HB PHE 56 1HB PHE 56 9.747 -4.823 -3.138
379 2HB PHE 56 2HB PHE 56 10.692 -4.039 -1.854
380 HD1 PHE 56 HD1 PHE 56 8.497 -6.967 -2.633
381 HD2 PHE 56 HD2 PHE 56 10.892 -5.008 0.365
382 HE1 PHE 56 HE1 PHE 56 8.392 -8.967 -1.246
383 HE2 PHE 56 HE2 PHE 56 10.768 -7.013 1.765
384 HZ PHE 56 HZ PHE 56 9.494 -9.006 0.994
385 H CYS 57 H CYS 57 7.834 -4.726 -4.014
386 HA CYS 57 HA CYS 57 5.033 -4.529 -3.696
387 1HB CYS 57 1HB CYS 57 6.746 -6.320 -5.490
388 2HB CYS 57 2HB CYS 57 4.997 -5.983 -5.722
389 H TYR 58 H TYR 58 4.236 -5.480 -1.938
390 HA TYR 58 HA TYR 58 5.159 -8.093 -1.094
391 1HB TYR 58 1HB TYR 58 4.579 -5.829 0.313
392 2HB TYR 58 2HB TYR 58 2.941 -6.531 0.327
393 HD1 TYR 58 HD1 TYR 58 2.618 -7.538 2.489
394 HD2 TYR 58 HD2 TYR 58 6.539 -7.782 0.702
395 HE1 TYR 58 HE1 TYR 58 3.318 -9.001 4.246
396 HE2 TYR 58 HE2 TYR 58 7.250 -9.271 2.481
397 HH TYR 58 HH TYR 58 6.526 -10.658 4.177
398 H LYS 59 H LYS 59 3.031 -9.029 0.269
399 HA LYS 59 HA LYS 59 1.799 -10.820 -1.371
400 1HB LYS 59 1HB LYS 59 0.874 -9.727 1.333
401 2HB LYS 59 2HB LYS 59 0.200 -11.198 0.536
402 1HG LYS 59 1HG LYS 59 2.422 -12.315 0.645
403 2HG LYS 59 2HG LYS 59 3.155 -10.873 1.410
404 1HD LYS 59 1HD LYS 59 1.507 -11.079 3.328
405 2HD LYS 59 2HD LYS 59 0.952 -12.638 2.609
406 1HE LYS 59 1HE LYS 59 3.327 -13.486 2.696
407 2HE LYS 59 2HE LYS 59 3.853 -11.951 3.489
408 1HZ LYS 59 1HZ LYS 59 3.481 -13.712 5.061
409 2HZ LYS 59 2HZ LYS 59 1.868 -13.897 4.559
410 3HZ LYS 59 3HZ LYS 59 2.354 -12.461 5.316
411 H ALA 60 H ALA 60 -0.200 -11.152 -2.274
412 HA ALA 60 HA ALA 60 -1.376 -8.807 -3.305
413 1HB ALA 60 1HB ALA 60 -1.116 -10.924 -4.590
414 2HB ALA 60 2HB ALA 60 -2.856 -10.447 -4.543
415 3HB ALA 60 3HB ALA 60 -2.237 -11.756 -3.453
416 H CYS 61 H CYS 61 -3.588 -8.233 -3.371
417 HA CYS 61 HA CYS 61 -4.981 -8.670 -0.811
418 1HB CYS 61 1HB CYS 61 -3.633 -6.453 -1.282
419 2HB CYS 61 2HB CYS 61 -4.956 -6.011 -2.379
420 H HIS 62 H HIS 62 -5.866 -10.387 -2.508
421 HA HIS 62 HA HIS 62 -8.406 -9.144 -3.464
422 1HB HIS 62 1HB HIS 62 -7.009 -11.642 -4.524
423 2HB HIS 62 2HB HIS 62 -8.646 -11.091 -4.986
424 HD1 HIS 62 HD1 HIS 62 -6.936 -11.407 -7.211
425 HD2 HIS 62 HD2 HIS 62 -6.794 -7.782 -5.088
426 HE1 HIS 62 HE1 HIS 62 -5.928 -9.676 -8.727
427 HE2 HIS 62 HE2 HIS 62 -5.826 -7.520 -7.394
428 H ASN 63 H ASN 63 -9.463 -9.326 -1.451
429 HA ASN 63 HA ASN 63 -9.475 -11.603 0.085
430 1HB ASN 63 1HB ASN 63 -11.602 -10.431 1.107
431 2HB ASN 63 2HB ASN 63 -9.977 -9.793 1.338
432 1HD2 ASN 63 1HD2 ASN 63 -9.438 -7.681 0.387
433 2HD2 ASN 63 2HD2 ASN 63 -10.672 -6.731 -0.353
434 H SER 64 H SER 64 -12.498 -10.412 -1.217
435 HA SER 64 HA SER 64 -13.499 -13.143 -1.156
436 1HB SER 64 1HB SER 64 -15.680 -12.272 -1.050
437 2HB SER 64 2HB SER 64 -14.663 -11.094 -0.131
438 HG SER 64 HG SER 64 -15.893 -9.871 -1.524
439 H GLU 65 H GLU 65 -15.517 -13.268 -2.936
440 HA GLU 65 HA GLU 65 -14.293 -14.181 -5.214
441 1HB GLU 65 1HB GLU 65 -16.449 -14.772 -6.044
442 2HB GLU 65 2HB GLU 65 -16.337 -15.162 -4.315
443 1HG GLU 65 1HG GLU 65 -17.781 -12.673 -5.462
444 2HG GLU 65 2HG GLU 65 -18.578 -14.229 -5.092
445 HE2 GLU 65 HE2 GLU 65 -18.808 -11.714 -2.383
446 H ILE 66 H ILE 66 -15.211 -11.000 -4.649
447 HA ILE 66 HA ILE 66 -14.143 -10.176 -7.151
448 HB ILE 66 HB ILE 66 -16.171 -8.428 -7.360
449 1HG1 ILE 66 1HG1 ILE 66 -18.361 -9.523 -7.245
450 2HG1 ILE 66 2HG1 ILE 66 -17.646 -10.971 -6.478
451 1HG2 ILE 66 1HG2 ILE 66 -15.140 -9.865 -9.131
452 2HG2 ILE 66 2HG2 ILE 66 -16.916 -9.700 -9.304
453 3HG2 ILE 66 3HG2 ILE 66 -16.203 -11.227 -8.639
454 1HD1 ILE 66 1HD1 ILE 66 -18.839 -9.403 -4.867
455 2HD1 ILE 66 2HD1 ILE 66 -17.629 -8.125 -5.255
456 3HD1 ILE 66 3HD1 ILE 66 -17.115 -9.639 -4.425
457 H GLU 67 H GLU 67 -13.823 -7.715 -7.192
458 HA GLU 67 HA GLU 67 -14.524 -6.207 -5.042
459 1HB GLU 67 1HB GLU 67 -12.255 -5.279 -4.613
460 2HB GLU 67 2HB GLU 67 -12.433 -6.869 -3.853
461 1HG GLU 67 1HG GLU 67 -11.170 -6.492 -6.670
462 2HG GLU 67 2HG GLU 67 -10.220 -6.186 -5.198
463 HE2 GLU 67 HE2 GLU 67 -12.268 -8.636 -4.481
Start of MODEL 13
1 1H GLY 1 1H GLY 1 2.220 -9.829 9.145
2 2H GLY 1 2H GLY 1 2.026 -9.143 10.682
3 3H GLY 1 3H GLY 1 1.001 -10.398 10.184
4 1HA GLY 1 1HA GLY 1 3.908 -10.596 10.610
5 2HA GLY 1 2HA GLY 1 2.606 -11.216 11.719
6 H ASP 2 H ASP 2 2.113 -13.328 11.482
7 HA ASP 2 HA ASP 2 1.869 -14.535 8.832
8 1HB ASP 2 1HB ASP 2 3.736 -15.634 11.058
9 2HB ASP 2 2HB ASP 2 3.243 -16.553 9.596
10 HD2 ASP 2 HD2 ASP 2 5.492 -15.124 7.558
11 H ASP 3 H ASP 3 0.294 -13.716 11.275
12 HA ASP 3 HA ASP 3 -1.544 -15.780 10.848
13 1HB ASP 3 1HB ASP 3 -0.310 -16.855 12.790
14 2HB ASP 3 2HB ASP 3 -0.697 -15.424 13.801
15 HD2 ASP 3 HD2 ASP 3 -3.891 -17.618 12.611
16 H VAL 4 H VAL 4 -0.844 -13.097 13.212
17 HA VAL 4 HA VAL 4 -3.367 -11.902 12.822
18 HB VAL 4 HB VAL 4 -1.804 -11.464 14.729
19 1HG1 VAL 4 1HG1 VAL 4 -0.581 -9.388 12.755
20 2HG1 VAL 4 2HG1 VAL 4 0.270 -10.885 13.268
21 3HG1 VAL 4 3HG1 VAL 4 -0.154 -9.620 14.477
22 1HG2 VAL 4 1HG2 VAL 4 -3.003 -8.989 13.335
23 2HG2 VAL 4 2HG2 VAL 4 -2.663 -9.234 15.083
24 3HG2 VAL 4 3HG2 VAL 4 -3.930 -10.221 14.292
25 H LYS 5 H LYS 5 -4.057 -10.285 11.474
26 HA LYS 5 HA LYS 5 -3.728 -10.624 9.001
27 1HB LYS 5 1HB LYS 5 -5.451 -9.147 10.211
28 2HB LYS 5 2HB LYS 5 -4.306 -7.795 9.938
29 1HG LYS 5 1HG LYS 5 -4.464 -8.388 7.401
30 2HG LYS 5 2HG LYS 5 -5.735 -9.574 7.865
31 1HD LYS 5 1HD LYS 5 -6.983 -7.669 7.239
32 2HD LYS 5 2HD LYS 5 -6.927 -7.550 9.032
33 1HE LYS 5 1HE LYS 5 -5.002 -5.883 8.805
34 2HE LYS 5 2HE LYS 5 -5.152 -5.999 7.009
35 1HZ LYS 5 1HZ LYS 5 -7.439 -5.247 7.223
36 2HZ LYS 5 2HZ LYS 5 -6.341 -4.130 7.878
37 3HZ LYS 5 3HZ LYS 5 -7.260 -5.119 8.904
38 H SER 6 H SER 6 -2.414 -10.594 7.503
39 HA SER 6 HA SER 6 0.024 -9.260 7.322
40 1HB SER 6 1HB SER 6 -0.106 -10.094 4.873
41 2HB SER 6 2HB SER 6 -0.199 -11.313 6.195
42 HG SER 6 HG SER 6 -1.942 -10.959 4.293
43 H ALA 7 H ALA 7 0.750 -7.945 5.478
44 HA ALA 7 HA ALA 7 -0.888 -5.610 5.095
45 1HB ALA 7 1HB ALA 7 1.150 -4.875 3.744
46 2HB ALA 7 2HB ALA 7 1.782 -6.563 3.868
47 3HB ALA 7 3HB ALA 7 1.640 -5.544 5.343
48 H CYS 8 H CYS 8 -1.465 -4.741 2.979
49 HA CYS 8 HA CYS 8 -1.325 -6.546 0.691
50 1HB CYS 8 1HB CYS 8 -3.959 -5.121 1.358
51 2HB CYS 8 2HB CYS 8 -3.571 -6.122 -0.072
52 H CYS 9 H CYS 9 -0.740 -5.369 -1.179
53 HA CYS 9 HA CYS 9 -1.642 -2.562 -1.263
54 1HB CYS 9 1HB CYS 9 1.168 -3.686 -1.667
55 2HB CYS 9 2HB CYS 9 0.649 -2.250 -2.627
56 H ASP 10 H ASP 10 -2.808 -2.205 -3.206
57 HA ASP 10 HA ASP 10 -2.837 -4.479 -4.944
58 1HB ASP 10 1HB ASP 10 -4.748 -2.735 -4.157
59 2HB ASP 10 2HB ASP 10 -4.321 -1.933 -5.653
60 HD2 ASP 10 HD2 ASP 10 -3.930 -3.689 -7.410
61 H THR 11 H THR 11 -1.040 -1.573 -4.896
62 HA THR 11 HA THR 11 0.291 -2.269 -7.341
63 HB THR 11 HB THR 11 -0.735 0.596 -7.029
64 HG1 THR 11 HG1 THR 11 -1.795 -1.330 -8.812
65 1HG2 THR 11 1HG2 THR 11 -0.189 0.684 -9.512
66 2HG2 THR 11 2HG2 THR 11 0.449 -0.987 -9.422
67 3HG2 THR 11 3HG2 THR 11 1.240 0.355 -8.507
68 H CYS 12 H CYS 12 2.450 -1.613 -7.171
69 HA CYS 12 HA CYS 12 3.237 0.368 -5.237
70 1HB CYS 12 1HB CYS 12 4.647 -1.289 -4.015
71 2HB CYS 12 2HB CYS 12 2.883 -1.713 -3.964
72 H LEU 13 H LEU 13 5.546 0.617 -5.087
73 HA LEU 13 HA LEU 13 6.786 0.552 -7.746
74 1HB LEU 13 1HB LEU 13 4.990 2.274 -7.584
75 2HB LEU 13 2HB LEU 13 5.724 2.958 -6.112
76 HG LEU 13 HG LEU 13 7.023 2.872 -8.933
77 1HD1 LEU 13 1HD1 LEU 13 5.548 5.170 -7.499
78 2HD1 LEU 13 2HD1 LEU 13 4.877 4.175 -8.846
79 3HD1 LEU 13 3HD1 LEU 13 6.310 5.232 -9.130
80 1HD2 LEU 13 1HD2 LEU 13 7.778 4.430 -6.371
81 2HD2 LEU 13 2HD2 LEU 13 8.396 4.818 -8.021
82 3HD2 LEU 13 3HD2 LEU 13 8.802 3.242 -7.267
83 H CYS 14 H CYS 14 8.679 -0.231 -7.208
84 HA CYS 14 HA CYS 14 10.077 0.800 -4.868
85 1HB CYS 14 1HB CYS 14 10.832 -1.503 -6.674
86 2HB CYS 14 2HB CYS 14 11.763 -0.943 -5.276
87 H THR 15 H THR 15 11.951 1.958 -4.893
88 HA THR 15 HA THR 15 12.230 3.514 -7.272
89 HB THR 15 HB THR 15 13.994 4.759 -6.117
90 HG1 THR 15 HG1 THR 15 14.924 3.750 -4.540
91 1HG2 THR 15 1HG2 THR 15 11.533 5.293 -5.900
92 2HG2 THR 15 2HG2 THR 15 12.474 5.715 -4.416
93 3HG2 THR 15 3HG2 THR 15 11.434 4.242 -4.443
94 H ARG 16 H ARG 16 13.838 3.793 -8.662
95 HA ARG 16 HA ARG 16 16.129 2.023 -8.733
96 1HB ARG 16 1HB ARG 16 15.069 4.124 -10.660
97 2HB ARG 16 2HB ARG 16 16.685 3.386 -10.851
98 1HG ARG 16 1HG ARG 16 14.142 1.706 -10.614
99 2HG ARG 16 2HG ARG 16 14.712 2.327 -12.182
100 1HD ARG 16 1HD ARG 16 16.516 0.606 -10.341
101 2HD ARG 16 2HD ARG 16 15.389 -0.130 -11.531
102 HE ARG 16 HE ARG 16 17.881 1.356 -12.101
103 1HH1 ARG 16 1HH1 ARG 16 14.744 0.240 -13.484
104 2HH1 ARG 16 2HH1 ARG 16 15.267 0.480 -15.117
105 1HH2 ARG 16 1HH2 ARG 16 18.488 1.673 -14.306
106 2HH2 ARG 16 2HH2 ARG 16 17.377 1.286 -15.586
107 H SER 17 H SER 17 17.621 2.603 -7.206
108 HA SER 17 HA SER 17 18.729 5.177 -6.952
109 1HB SER 17 1HB SER 17 17.736 5.835 -4.757
110 2HB SER 17 2HB SER 17 16.405 5.615 -5.907
111 HG SER 17 HG SER 17 17.210 3.954 -3.745
112 H GLN 18 H GLN 18 19.828 5.038 -4.495
113 HA GLN 18 HA GLN 18 20.424 2.274 -3.833
114 1HB GLN 18 1HB GLN 18 22.361 4.373 -4.859
115 2HB GLN 18 2HB GLN 18 22.935 3.079 -3.758
116 1HG GLN 18 1HG GLN 18 21.710 2.600 -6.554
117 2HG GLN 18 2HG GLN 18 23.439 2.496 -6.085
118 1HE2 GLN 18 1HE2 GLN 18 20.276 0.898 -5.800
119 2HE2 GLN 18 2HE2 GLN 18 20.917 -0.643 -5.242
120 HA PRO 19 HA PRO 19 20.452 1.191 -2.049
121 1HB PRO 19 1HB PRO 19 19.016 0.783 0.269
122 2HB PRO 19 2HB PRO 19 20.821 1.117 0.303
123 1HG PRO 19 1HG PRO 19 18.536 3.154 0.660
124 2HG PRO 19 2HG PRO 19 19.936 2.832 1.773
125 1HD PRO 19 1HD PRO 19 19.996 4.824 -0.158
126 2HD PRO 19 2HD PRO 19 21.494 3.872 0.264
127 HA PRO 20 HA PRO 20 16.308 1.632 -3.685
128 1HB PRO 20 1HB PRO 20 15.202 -0.888 -3.510
129 2HB PRO 20 2HB PRO 20 16.608 -0.544 -4.590
130 1HG PRO 20 1HG PRO 20 16.688 -1.661 -1.732
131 2HG PRO 20 2HG PRO 20 17.466 -2.359 -3.219
132 1HD PRO 20 1HD PRO 20 18.850 -0.743 -1.459
133 2HD PRO 20 2HD PRO 20 19.135 -0.622 -3.267
134 H THR 21 H THR 21 14.043 1.707 -3.099
135 HA THR 21 HA THR 21 13.330 1.584 -0.255
136 HB THR 21 HB THR 21 13.496 4.117 -2.029
137 HG1 THR 21 HG1 THR 21 15.490 3.659 -1.135
138 1HG2 THR 21 1HG2 THR 21 11.523 4.226 -0.527
139 2HG2 THR 21 2HG2 THR 21 12.793 5.346 0.045
140 3HG2 THR 21 3HG2 THR 21 12.551 3.782 0.905
141 H CYS 22 H CYS 22 10.935 1.471 -0.166
142 HA CYS 22 HA CYS 22 9.648 1.725 -2.812
143 1HB CYS 22 1HB CYS 22 10.809 -0.575 -2.500
144 2HB CYS 22 2HB CYS 22 9.663 -0.861 -1.187
145 H ARG 23 H ARG 23 7.403 1.266 -2.780
146 HA ARG 23 HA ARG 23 5.887 1.787 -0.402
147 1HB ARG 23 1HB ARG 23 5.260 4.186 -1.101
148 2HB ARG 23 2HB ARG 23 6.935 4.040 -0.551
149 1HG ARG 23 1HG ARG 23 7.750 4.812 -2.481
150 2HG ARG 23 2HG ARG 23 6.882 3.570 -3.447
151 1HD ARG 23 1HD ARG 23 6.201 5.770 -4.235
152 2HD ARG 23 2HD ARG 23 4.797 5.038 -3.345
153 HE ARG 23 HE ARG 23 6.785 7.010 -2.180
154 1HH1 ARG 23 1HH1 ARG 23 3.290 6.050 -2.389
155 2HH1 ARG 23 2HH1 ARG 23 2.784 7.540 -1.718
156 1HH2 ARG 23 1HH2 ARG 23 6.103 8.772 -1.273
157 2HH2 ARG 23 2HH2 ARG 23 4.430 9.175 -1.005
158 H CYS 24 H CYS 24 3.678 2.482 -1.001
159 HA CYS 24 HA CYS 24 2.842 1.047 -3.439
160 1HB CYS 24 1HB CYS 24 1.313 1.565 -0.848
161 2HB CYS 24 2HB CYS 24 0.714 0.610 -2.254
162 H VAL 25 H VAL 25 0.776 1.906 -4.306
163 HA VAL 25 HA VAL 25 0.410 4.794 -4.421
164 HB VAL 25 HB VAL 25 1.135 4.721 -6.854
165 1HG1 VAL 25 1HG1 VAL 25 3.509 4.825 -6.654
166 2HG1 VAL 25 2HG1 VAL 25 3.542 3.792 -5.196
167 3HG1 VAL 25 3HG1 VAL 25 2.838 5.460 -5.100
168 1HG2 VAL 25 1HG2 VAL 25 2.594 2.744 -7.593
169 2HG2 VAL 25 2HG2 VAL 25 0.883 2.293 -7.362
170 3HG2 VAL 25 3HG2 VAL 25 2.087 1.880 -6.088
171 H ASP 26 H ASP 26 -1.318 2.550 -3.836
172 HA ASP 26 HA ASP 26 -3.336 3.493 -5.516
173 1HB ASP 26 1HB ASP 26 -2.525 1.550 -6.837
174 2HB ASP 26 2HB ASP 26 -2.908 0.453 -5.446
175 HD2 ASP 26 HD2 ASP 26 -3.740 -0.060 -7.663
176 H VAL 27 H VAL 27 -5.148 3.594 -4.428
177 HA VAL 27 HA VAL 27 -5.014 3.513 -1.612
178 HB VAL 27 HB VAL 27 -5.905 5.279 -3.080
179 1HG1 VAL 27 1HG1 VAL 27 -8.365 3.445 -3.396
180 2HG1 VAL 27 2HG1 VAL 27 -7.147 3.664 -4.704
181 3HG1 VAL 27 3HG1 VAL 27 -8.081 5.077 -4.116
182 1HG2 VAL 27 1HG2 VAL 27 -8.069 4.191 -1.174
183 2HG2 VAL 27 2HG2 VAL 27 -7.722 5.902 -1.645
184 3HG2 VAL 27 3HG2 VAL 27 -6.546 5.014 -0.619
185 H ARG 28 H ARG 28 -6.197 2.454 -0.073
186 HA ARG 28 HA ARG 28 -7.962 0.322 -0.941
187 1HB ARG 28 1HB ARG 28 -5.366 -0.048 0.040
188 2HB ARG 28 2HB ARG 28 -6.317 -0.144 1.542
189 1HG ARG 28 1HG ARG 28 -5.916 -2.376 0.605
190 2HG ARG 28 2HG ARG 28 -7.676 -2.042 0.510
191 1HD ARG 28 1HD ARG 28 -7.389 -1.408 -1.944
192 2HD ARG 28 2HD ARG 28 -5.642 -1.789 -1.808
193 HE ARG 28 HE ARG 28 -7.983 -3.692 -1.752
194 1HH1 ARG 28 1HH1 ARG 28 -4.452 -3.308 -1.463
195 2HH1 ARG 28 2HH1 ARG 28 -4.108 -4.979 -1.787
196 1HH2 ARG 28 1HH2 ARG 28 -7.533 -5.905 -2.094
197 2HH2 ARG 28 2HH2 ARG 28 -5.902 -6.494 -2.112
198 H GLU 29 H GLU 29 -9.219 -0.377 1.069
199 HA GLU 29 HA GLU 29 -10.753 1.664 2.098
200 1HB GLU 29 1HB GLU 29 -10.242 -1.237 2.859
201 2HB GLU 29 2HB GLU 29 -11.560 -0.271 3.591
202 1HG GLU 29 1HG GLU 29 -11.765 0.066 0.671
203 2HG GLU 29 2HG GLU 29 -11.522 -1.688 0.988
204 HE2 GLU 29 HE2 GLU 29 -13.337 1.081 1.842
205 H SER 30 H SER 30 -7.812 0.415 3.318
206 HA SER 30 HA SER 30 -7.860 2.177 5.644
207 1HB SER 30 1HB SER 30 -7.608 -0.900 5.969
208 2HB SER 30 2HB SER 30 -7.400 0.299 7.288
209 HG SER 30 HG SER 30 -9.436 -0.472 7.470
210 H CYS 31 H CYS 31 -5.800 1.991 6.928
211 HA CYS 31 HA CYS 31 -3.502 1.299 5.235
212 1HB CYS 31 1HB CYS 31 -3.932 2.834 7.836
213 2HB CYS 31 2HB CYS 31 -2.260 2.414 7.318
214 H HIS 32 H HIS 32 -1.705 0.687 7.549
215 HA HIS 32 HA HIS 32 -2.669 -1.580 8.891
216 1HB HIS 32 1HB HIS 32 -2.274 -2.598 6.637
217 2HB HIS 32 2HB HIS 32 -0.563 -1.944 6.662
218 HD1 HIS 32 HD1 HIS 32 -2.874 -4.018 8.825
219 HD2 HIS 32 HD2 HIS 32 1.047 -4.258 7.337
220 HE1 HIS 32 HE1 HIS 32 -1.956 -6.206 9.549
221 HE2 HIS 32 HE2 HIS 32 0.436 -6.343 8.629
222 H SER 33 H SER 33 -0.765 -2.308 10.292
223 HA SER 33 HA SER 33 0.634 -0.216 11.349
224 1HB SER 33 1HB SER 33 1.438 -3.195 11.449
225 2HB SER 33 2HB SER 33 2.041 -1.933 12.588
226 HG SER 33 HG SER 33 0.323 -2.985 13.507
227 H ALA 34 H ALA 34 1.537 -1.917 8.530
228 HA ALA 34 HA ALA 34 4.280 -1.175 8.413
229 1HB ALA 34 1HB ALA 34 4.138 -2.101 6.105
230 2HB ALA 34 2HB ALA 34 2.341 -2.154 6.216
231 3HB ALA 34 3HB ALA 34 3.369 -3.218 7.272
232 H CYS 35 H CYS 35 2.871 1.046 9.074
233 HA CYS 35 HA CYS 35 3.507 2.817 6.839
234 1HB CYS 35 1HB CYS 35 1.022 2.079 6.817
235 2HB CYS 35 2HB CYS 35 0.842 2.959 8.395
236 H ASP 36 H ASP 36 3.788 5.101 7.449
237 HA ASP 36 HA ASP 36 3.897 5.557 10.372
238 1HB ASP 36 1HB ASP 36 5.538 7.188 8.361
239 2HB ASP 36 2HB ASP 36 5.576 7.245 10.161
240 HD2 ASP 36 HD2 ASP 36 7.621 6.591 8.124
241 H LYS 37 H LYS 37 3.571 7.806 7.396
242 HA LYS 37 HA LYS 37 1.279 8.887 8.743
243 1HB LYS 37 1HB LYS 37 3.083 10.354 7.630
244 2HB LYS 37 2HB LYS 37 2.496 9.746 6.073
245 1HG LYS 37 1HG LYS 37 1.392 11.842 6.419
246 2HG LYS 37 2HG LYS 37 0.156 10.583 6.699
247 1HD LYS 37 1HD LYS 37 0.589 10.820 9.222
248 2HD LYS 37 2HD LYS 37 1.763 12.123 8.857
249 1HE LYS 37 1HE LYS 37 -0.402 13.060 9.582
250 2HE LYS 37 2HE LYS 37 -0.126 13.484 7.841
251 1HZ LYS 37 1HZ LYS 37 -1.797 11.244 8.862
252 2HZ LYS 37 2HZ LYS 37 -1.583 11.673 7.234
253 3HZ LYS 37 3HZ LYS 37 -2.363 12.744 8.299
254 H CYS 38 H CYS 38 -0.588 7.784 8.500
255 HA CYS 38 HA CYS 38 -1.383 6.757 5.897
256 1HB CYS 38 1HB CYS 38 -1.715 5.544 8.101
257 2HB CYS 38 2HB CYS 38 -2.705 6.942 8.657
258 H VAL 39 H VAL 39 -2.493 8.039 4.428
259 HA VAL 39 HA VAL 39 -3.840 10.461 5.425
260 HB VAL 39 HB VAL 39 -2.570 9.495 2.839
261 1HG1 VAL 39 1HG1 VAL 39 -4.685 10.584 2.162
262 2HG1 VAL 39 2HG1 VAL 39 -3.281 11.658 1.819
263 3HG1 VAL 39 3HG1 VAL 39 -4.320 11.989 3.259
264 1HG2 VAL 39 1HG2 VAL 39 -2.165 11.947 4.685
265 2HG2 VAL 39 2HG2 VAL 39 -1.280 11.664 3.142
266 3HG2 VAL 39 3HG2 VAL 39 -1.053 10.527 4.533
267 H CYS 40 H CYS 40 -6.186 10.551 5.039
268 HA CYS 40 HA CYS 40 -7.352 8.309 3.585
269 1HB CYS 40 1HB CYS 40 -7.890 9.071 6.469
270 2HB CYS 40 2HB CYS 40 -8.938 7.990 5.529
271 H ALA 41 H ALA 41 -8.494 9.263 2.146
272 HA ALA 41 HA ALA 41 -9.923 11.713 2.634
273 1HB ALA 41 1HB ALA 41 -9.040 11.243 0.401
274 2HB ALA 41 2HB ALA 41 -10.805 11.561 0.416
275 3HB ALA 41 3HB ALA 41 -10.189 9.869 0.230
276 H TYR 42 H TYR 42 -11.948 12.088 3.073
277 HA TYR 42 HA TYR 42 -13.468 10.078 4.364
278 1HB TYR 42 1HB TYR 42 -14.841 12.103 5.075
279 2HB TYR 42 2HB TYR 42 -13.067 12.215 5.407
280 HD1 TYR 42 HD1 TYR 42 -11.651 13.880 4.246
281 HD2 TYR 42 HD2 TYR 42 -15.799 13.401 3.137
282 HE1 TYR 42 HE1 TYR 42 -11.523 15.889 2.845
283 HE2 TYR 42 HE2 TYR 42 -15.652 15.402 1.746
284 HH TYR 42 HH TYR 42 -14.421 17.233 1.263
285 H SER 43 H SER 43 -13.213 10.112 1.476
286 HA SER 43 HA SER 43 -15.641 10.516 0.125
287 1HB SER 43 1HB SER 43 -13.424 8.534 -0.554
288 2HB SER 43 2HB SER 43 -14.669 9.200 -1.704
289 HG SER 43 HG SER 43 -12.881 10.356 -2.000
290 H ASN 44 H ASN 44 -16.227 8.229 -1.269
291 HA ASN 44 HA ASN 44 -17.294 6.334 0.644
292 1HB ASN 44 1HB ASN 44 -18.812 8.302 0.397
293 2HB ASN 44 2HB ASN 44 -18.795 8.121 -1.365
294 1HD2 ASN 44 1HD2 ASN 44 -19.965 6.076 -2.244
295 2HD2 ASN 44 2HD2 ASN 44 -20.957 5.126 -1.199
296 HA PRO 45 HA PRO 45 -17.076 4.253 0.719
297 1HB PRO 45 1HB PRO 45 -15.352 2.120 0.332
298 2HB PRO 45 2HB PRO 45 -16.982 2.109 -0.345
299 1HG PRO 45 1HG PRO 45 -14.427 3.043 -1.786
300 2HG PRO 45 2HG PRO 45 -15.568 1.763 -2.342
301 1HD PRO 45 1HD PRO 45 -15.823 4.363 -3.211
302 2HD PRO 45 2HD PRO 45 -17.318 3.411 -2.770
303 HA PRO 46 HA PRO 46 -13.729 6.455 2.291
304 1HB PRO 46 1HB PRO 46 -12.776 5.177 4.536
305 2HB PRO 46 2HB PRO 46 -14.464 5.810 4.448
306 1HG PRO 46 1HG PRO 46 -13.551 2.946 3.839
307 2HG PRO 46 2HG PRO 46 -14.838 3.503 4.998
308 1HD PRO 46 1HD PRO 46 -15.448 2.696 2.436
309 2HD PRO 46 2HD PRO 46 -16.294 4.193 3.192
310 H GLN 47 H GLN 47 -11.431 6.839 2.310
311 HA GLN 47 HA GLN 47 -9.965 4.817 0.742
312 1HB GLN 47 1HB GLN 47 -9.974 7.885 0.793
313 2HB GLN 47 2HB GLN 47 -8.968 6.908 -0.322
314 1HG GLN 47 1HG GLN 47 -12.086 6.912 -0.329
315 2HG GLN 47 2HG GLN 47 -11.082 8.030 -1.297
316 1HE2 GLN 47 1HE2 GLN 47 -9.444 6.991 -2.764
317 2HE2 GLN 47 2HE2 GLN 47 -10.021 5.636 -3.692
318 H CYS 48 H CYS 48 -7.829 4.445 1.411
319 HA CYS 48 HA CYS 48 -6.518 6.476 3.011
320 1HB CYS 48 1HB CYS 48 -7.018 3.594 3.848
321 2HB CYS 48 2HB CYS 48 -5.709 4.591 4.590
322 H GLN 49 H GLN 49 -4.431 6.586 2.673
323 HA GLN 49 HA GLN 49 -3.099 4.526 1.072
324 1HB GLN 49 1HB GLN 49 -2.953 7.605 0.911
325 2HB GLN 49 2HB GLN 49 -1.948 6.471 -0.074
326 1HG GLN 49 1HG GLN 49 -3.555 6.745 -1.686
327 2HG GLN 49 2HG GLN 49 -4.515 5.594 -0.702
328 1HE2 GLN 49 1HE2 GLN 49 -3.908 9.072 -1.360
329 2HE2 GLN 49 2HE2 GLN 49 -5.550 9.552 -1.016
330 H CYS 50 H CYS 50 -1.123 3.974 1.830
331 HA CYS 50 HA CYS 50 -0.044 5.524 4.091
332 1HB CYS 50 1HB CYS 50 0.145 2.953 4.096
333 2HB CYS 50 2HB CYS 50 1.290 3.125 2.726
334 H TYR 51 H TYR 51 0.800 7.358 3.544
335 HA TYR 51 HA TYR 51 2.127 8.019 1.151
336 1HB TYR 51 1HB TYR 51 1.654 9.317 3.844
337 2HB TYR 51 2HB TYR 51 3.184 9.797 3.058
338 HD1 TYR 51 HD1 TYR 51 2.943 11.782 1.702
339 HD2 TYR 51 HD2 TYR 51 -0.388 9.010 1.870
340 HE1 TYR 51 HE1 TYR 51 1.808 13.025 -0.001
341 HE2 TYR 51 HE2 TYR 51 -1.501 10.275 0.169
342 HH TYR 51 HH TYR 51 -1.265 11.908 -1.442
343 H ASP 52 H ASP 52 3.436 6.922 4.223
344 HA ASP 52 HA ASP 52 6.088 7.426 3.328
345 1HB ASP 52 1HB ASP 52 5.112 5.780 5.726
346 2HB ASP 52 2HB ASP 52 6.842 6.106 5.398
347 HD2 ASP 52 HD2 ASP 52 6.656 9.083 7.007
348 H THR 53 H THR 53 7.847 6.246 3.052
349 HA THR 53 HA THR 53 7.588 3.789 1.623
350 HB THR 53 HB THR 53 10.097 3.839 1.516
351 HG1 THR 53 HG1 THR 53 11.162 5.546 2.344
352 1HG2 THR 53 1HG2 THR 53 8.554 6.401 0.694
353 2HG2 THR 53 2HG2 THR 53 8.818 4.914 -0.283
354 3HG2 THR 53 3HG2 THR 53 10.202 5.971 0.117
355 H HIS 54 H HIS 54 8.578 1.774 2.131
356 HA HIS 54 HA HIS 54 9.980 1.541 4.564
357 1HB HIS 54 1HB HIS 54 7.309 0.011 4.351
358 2HB HIS 54 2HB HIS 54 8.688 -0.563 5.377
359 HD1 HIS 54 HD1 HIS 54 5.705 0.695 5.905
360 HD2 HIS 54 HD2 HIS 54 9.473 2.024 7.168
361 HE1 HIS 54 HE1 HIS 54 5.353 2.009 8.001
362 HE2 HIS 54 HE2 HIS 54 7.650 2.810 8.755
363 H LYS 55 H LYS 55 8.808 -1.559 3.271
364 HA LYS 55 HA LYS 55 11.097 -1.554 1.484
365 1HB LYS 55 1HB LYS 55 11.801 -3.727 2.646
366 2HB LYS 55 2HB LYS 55 12.081 -2.203 3.542
367 1HG LYS 55 1HG LYS 55 10.114 -2.568 4.979
368 2HG LYS 55 2HG LYS 55 9.681 -4.051 4.075
369 1HD LYS 55 1HD LYS 55 11.957 -5.014 4.754
370 2HD LYS 55 2HD LYS 55 12.149 -3.585 5.835
371 1HE LYS 55 1HE LYS 55 9.973 -4.219 6.994
372 2HE LYS 55 2HE LYS 55 9.854 -5.666 5.911
373 1HZ LYS 55 1HZ LYS 55 10.816 -6.302 7.960
374 2HZ LYS 55 2HZ LYS 55 11.981 -5.064 7.903
375 3HZ LYS 55 3HZ LYS 55 12.046 -6.348 6.788
376 H PHE 56 H PHE 56 9.496 -4.502 2.550
377 HA PHE 56 HA PHE 56 9.391 -5.094 -0.240
378 1HB PHE 56 1HB PHE 56 10.169 -6.725 1.499
379 2HB PHE 56 2HB PHE 56 8.462 -6.878 2.075
380 HD1 PHE 56 HD1 PHE 56 7.299 -8.710 1.162
381 HD2 PHE 56 HD2 PHE 56 10.463 -6.935 -1.155
382 HE1 PHE 56 HE1 PHE 56 6.959 -10.397 -0.593
383 HE2 PHE 56 HE2 PHE 56 10.129 -8.620 -2.907
384 HZ PHE 56 HZ PHE 56 8.371 -10.366 -2.649
385 H CYS 57 H CYS 57 7.711 -5.496 -1.620
386 HA CYS 57 HA CYS 57 5.159 -4.322 -0.858
387 1HB CYS 57 1HB CYS 57 6.127 -3.613 -2.987
388 2HB CYS 57 2HB CYS 57 6.167 -5.308 -3.568
389 H TYR 58 H TYR 58 3.546 -5.471 -0.059
390 HA TYR 58 HA TYR 58 3.246 -8.306 -0.684
391 1HB TYR 58 1HB TYR 58 2.736 -7.089 1.540
392 2HB TYR 58 2HB TYR 58 1.196 -6.584 0.749
393 HD1 TYR 58 HD1 TYR 58 0.007 -8.744 -0.542
394 HD2 TYR 58 HD2 TYR 58 2.587 -8.976 2.884
395 HE1 TYR 58 HE1 TYR 58 -1.076 -10.812 0.113
396 HE2 TYR 58 HE2 TYR 58 1.542 -11.020 3.540
397 HH TYR 58 HH TYR 58 -1.227 -12.449 1.643
398 H LYS 59 H LYS 59 2.289 -8.947 -2.326
399 HA LYS 59 HA LYS 59 1.206 -7.557 -4.445
400 1HB LYS 59 1HB LYS 59 0.784 -10.432 -3.506
401 2HB LYS 59 2HB LYS 59 0.237 -9.847 -5.108
402 1HG LYS 59 1HG LYS 59 2.547 -9.340 -5.802
403 2HG LYS 59 2HG LYS 59 3.193 -9.761 -4.193
404 1HD LYS 59 1HD LYS 59 2.314 -12.109 -4.456
405 2HD LYS 59 2HD LYS 59 1.799 -11.701 -6.131
406 1HE LYS 59 1HE LYS 59 4.178 -11.193 -6.754
407 2HE LYS 59 2HE LYS 59 4.695 -11.506 -5.044
408 1HZ LYS 59 1HZ LYS 59 3.425 -13.478 -6.876
409 2HZ LYS 59 2HZ LYS 59 3.917 -13.758 -5.273
410 3HZ LYS 59 3HZ LYS 59 5.071 -13.391 -6.462
411 H ALA 60 H ALA 60 -0.966 -7.782 -5.472
412 HA ALA 60 HA ALA 60 -2.970 -6.824 -3.753
413 1HB ALA 60 1HB ALA 60 -4.390 -6.926 -5.781
414 2HB ALA 60 2HB ALA 60 -3.158 -7.996 -6.572
415 3HB ALA 60 3HB ALA 60 -2.738 -6.296 -6.182
416 H CYS 61 H CYS 61 -3.981 -7.844 -2.306
417 HA CYS 61 HA CYS 61 -3.668 -10.653 -2.136
418 1HB CYS 61 1HB CYS 61 -3.890 -10.355 0.227
419 2HB CYS 61 2HB CYS 61 -2.994 -8.955 -0.419
420 H HIS 62 H HIS 62 -5.842 -9.950 -3.925
421 HA HIS 62 HA HIS 62 -8.311 -10.518 -2.502
422 1HB HIS 62 1HB HIS 62 -7.899 -10.795 -5.522
423 2HB HIS 62 2HB HIS 62 -9.439 -10.723 -4.646
424 HD1 HIS 62 HD1 HIS 62 -10.169 -8.753 -6.011
425 HD2 HIS 62 HD2 HIS 62 -6.664 -7.933 -3.860
426 HE1 HIS 62 HE1 HIS 62 -9.765 -6.275 -6.165
427 HE2 HIS 62 HE2 HIS 62 -7.621 -5.813 -4.887
428 H ASN 63 H ASN 63 -5.970 -12.401 -4.342
429 HA ASN 63 HA ASN 63 -7.109 -14.943 -4.115
430 1HB ASN 63 1HB ASN 63 -4.443 -15.441 -4.418
431 2HB ASN 63 2HB ASN 63 -5.478 -14.914 -5.756
432 1HD2 ASN 63 1HD2 ASN 63 -4.920 -12.871 -6.824
433 2HD2 ASN 63 2HD2 ASN 63 -3.920 -11.691 -6.079
434 H SER 64 H SER 64 -4.263 -13.660 -2.569
435 HA SER 64 HA SER 64 -4.665 -15.530 -0.304
436 1HB SER 64 1HB SER 64 -2.759 -15.749 -2.038
437 2HB SER 64 2HB SER 64 -2.039 -14.294 -1.296
438 HG SER 64 HG SER 64 -2.625 -16.837 -0.088
439 H GLU 65 H GLU 65 -6.078 -13.523 0.478
440 HA GLU 65 HA GLU 65 -4.787 -11.509 1.847
441 1HB GLU 65 1HB GLU 65 -6.689 -10.898 2.901
442 2HB GLU 65 2HB GLU 65 -7.239 -11.571 1.349
443 1HG GLU 65 1HG GLU 65 -8.092 -13.640 2.493
444 2HG GLU 65 2HG GLU 65 -7.295 -13.157 4.032
445 HE2 GLU 65 HE2 GLU 65 -10.680 -11.344 2.884
446 H ILE 66 H ILE 66 -4.801 -14.736 2.672
447 HA ILE 66 HA ILE 66 -2.833 -14.242 4.624
448 HB ILE 66 HB ILE 66 -4.520 -13.873 6.154
449 1HG1 ILE 66 1HG1 ILE 66 -3.453 -16.737 6.555
450 2HG1 ILE 66 2HG1 ILE 66 -2.484 -15.234 6.744
451 1HG2 ILE 66 1HG2 ILE 66 -6.431 -15.010 4.933
452 2HG2 ILE 66 2HG2 ILE 66 -6.370 -15.265 6.700
453 3HG2 ILE 66 3HG2 ILE 66 -5.859 -16.591 5.621
454 1HD1 ILE 66 1HD1 ILE 66 -4.984 -16.007 8.411
455 2HD1 ILE 66 2HD1 ILE 66 -4.032 -14.486 8.607
456 3HD1 ILE 66 3HD1 ILE 66 -3.274 -16.075 8.968
457 H GLU 67 H GLU 67 -5.019 -17.126 3.794
458 HA GLU 67 HA GLU 67 -2.828 -18.271 2.428
459 1HB GLU 67 1HB GLU 67 -2.757 -20.341 3.817
460 2HB GLU 67 2HB GLU 67 -2.209 -18.905 4.752
461 1HG GLU 67 1HG GLU 67 -4.643 -18.745 5.688
462 2HG GLU 67 2HG GLU 67 -4.938 -20.359 4.950
463 HE2 GLU 67 HE2 GLU 67 -3.544 -20.292 8.481
Start of MODEL 14
1 1H GLY 1 1H GLY 1 3.788 -20.137 10.051
2 2H GLY 1 2H GLY 1 3.150 -20.783 8.616
3 3H GLY 1 3H GLY 1 2.256 -20.876 10.058
4 1HA GLY 1 1HA GLY 1 3.005 -18.424 8.618
5 2HA GLY 1 2HA GLY 1 1.376 -19.206 8.640
6 H ASP 2 H ASP 2 3.089 -16.651 9.870
7 HA ASP 2 HA ASP 2 1.244 -16.250 12.115
8 1HB ASP 2 1HB ASP 2 4.335 -16.257 12.490
9 2HB ASP 2 2HB ASP 2 3.122 -15.783 13.727
10 HD2 ASP 2 HD2 ASP 2 4.070 -19.582 13.105
11 H ASP 3 H ASP 3 0.501 -14.352 11.195
12 HA ASP 3 HA ASP 3 0.388 -12.329 10.438
13 1HB ASP 3 1HB ASP 3 3.277 -11.786 11.219
14 2HB ASP 3 2HB ASP 3 2.025 -10.576 10.772
15 HD2 ASP 3 HD2 ASP 3 2.301 -11.543 14.477
16 H VAL 4 H VAL 4 0.047 -13.397 8.547
17 HA VAL 4 HA VAL 4 2.168 -13.228 6.502
18 HB VAL 4 HB VAL 4 0.844 -14.898 5.247
19 1HG1 VAL 4 1HG1 VAL 4 1.565 -16.822 6.642
20 2HG1 VAL 4 2HG1 VAL 4 1.726 -15.756 8.084
21 3HG1 VAL 4 3HG1 VAL 4 2.812 -15.529 6.668
22 1HG2 VAL 4 1HG2 VAL 4 -0.807 -15.238 7.827
23 2HG2 VAL 4 2HG2 VAL 4 -0.904 -16.188 6.309
24 3HG2 VAL 4 3HG2 VAL 4 -1.407 -14.471 6.301
25 H LYS 5 H LYS 5 -1.020 -11.940 7.233
26 HA LYS 5 HA LYS 5 -1.086 -10.667 4.590
27 1HB LYS 5 1HB LYS 5 -3.184 -11.234 6.748
28 2HB LYS 5 2HB LYS 5 -3.543 -10.193 5.340
29 1HG LYS 5 1HG LYS 5 -2.487 -12.993 4.780
30 2HG LYS 5 2HG LYS 5 -4.137 -12.824 5.454
31 1HD LYS 5 1HD LYS 5 -4.384 -12.906 3.064
32 2HD LYS 5 2HD LYS 5 -4.779 -11.253 3.642
33 1HE LYS 5 1HE LYS 5 -2.393 -10.538 2.877
34 2HE LYS 5 2HE LYS 5 -2.251 -12.176 2.117
35 1HZ LYS 5 1HZ LYS 5 -3.020 -10.550 0.564
36 2HZ LYS 5 2HZ LYS 5 -4.299 -10.092 1.584
37 3HZ LYS 5 3HZ LYS 5 -4.288 -11.636 0.882
38 H SER 6 H SER 6 0.717 -10.004 6.646
39 HA SER 6 HA SER 6 0.026 -7.958 8.323
40 1HB SER 6 1HB SER 6 2.712 -8.272 6.839
41 2HB SER 6 2HB SER 6 2.451 -7.305 8.343
42 HG SER 6 HG SER 6 3.258 -9.355 8.805
43 H ALA 7 H ALA 7 0.823 -7.688 4.934
44 HA ALA 7 HA ALA 7 -0.110 -4.933 4.861
45 1HB ALA 7 1HB ALA 7 2.406 -4.821 4.961
46 2HB ALA 7 2HB ALA 7 1.880 -4.447 3.287
47 3HB ALA 7 3HB ALA 7 2.519 -6.099 3.686
48 H CYS 8 H CYS 8 -0.707 -4.397 2.563
49 HA CYS 8 HA CYS 8 -0.663 -6.656 0.747
50 1HB CYS 8 1HB CYS 8 -2.905 -6.812 0.146
51 2HB CYS 8 2HB CYS 8 -2.855 -6.963 1.926
52 H CYS 9 H CYS 9 -0.634 -6.131 -1.469
53 HA CYS 9 HA CYS 9 -0.580 -3.242 -2.069
54 1HB CYS 9 1HB CYS 9 1.543 -4.198 -0.876
55 2HB CYS 9 2HB CYS 9 1.827 -5.144 -2.348
56 H ASP 10 H ASP 10 -2.273 -3.751 -3.733
57 HA ASP 10 HA ASP 10 -1.818 -5.864 -5.537
58 1HB ASP 10 1HB ASP 10 -3.650 -3.412 -5.671
59 2HB ASP 10 2HB ASP 10 -3.764 -4.734 -6.824
60 HD2 ASP 10 HD2 ASP 10 -3.959 -6.811 -5.980
61 H THR 11 H THR 11 -0.803 -2.537 -5.762
62 HA THR 11 HA THR 11 0.624 -3.051 -8.258
63 HB THR 11 HB THR 11 -1.506 -0.838 -7.961
64 HG1 THR 11 HG1 THR 11 -2.700 -2.439 -8.721
65 1HG2 THR 11 1HG2 THR 11 0.352 -1.578 -10.338
66 2HG2 THR 11 2HG2 THR 11 0.485 -0.081 -9.344
67 3HG2 THR 11 3HG2 THR 11 -0.956 -0.346 -10.373
68 H CYS 12 H CYS 12 2.491 -1.867 -8.241
69 HA CYS 12 HA CYS 12 2.884 0.167 -6.191
70 1HB CYS 12 1HB CYS 12 4.464 -1.327 -5.018
71 2HB CYS 12 2HB CYS 12 2.828 -2.095 -5.193
72 H LEU 13 H LEU 13 5.109 0.756 -5.918
73 HA LEU 13 HA LEU 13 6.715 0.683 -8.378
74 1HB LEU 13 1HB LEU 13 4.900 2.382 -8.554
75 2HB LEU 13 2HB LEU 13 5.436 3.160 -7.041
76 HG LEU 13 HG LEU 13 7.175 2.869 -9.593
77 1HD1 LEU 13 1HD1 LEU 13 5.038 4.075 -10.091
78 2HD1 LEU 13 2HD1 LEU 13 6.455 5.189 -10.172
79 3HD1 LEU 13 3HD1 LEU 13 5.364 5.217 -8.738
80 1HD2 LEU 13 1HD2 LEU 13 7.389 4.786 -7.178
81 2HD2 LEU 13 2HD2 LEU 13 8.367 4.915 -8.691
82 3HD2 LEU 13 3HD2 LEU 13 8.560 3.487 -7.620
83 H CYS 14 H CYS 14 8.513 -0.047 -7.561
84 HA CYS 14 HA CYS 14 9.637 1.180 -5.167
85 1HB CYS 14 1HB CYS 14 10.617 -1.219 -6.761
86 2HB CYS 14 2HB CYS 14 11.456 -0.514 -5.373
87 H THR 15 H THR 15 11.413 2.459 -5.160
88 HA THR 15 HA THR 15 12.255 3.544 -7.687
89 HB THR 15 HB THR 15 14.015 4.730 -6.462
90 HG1 THR 15 HG1 THR 15 14.217 2.997 -4.892
91 1HG2 THR 15 1HG2 THR 15 11.661 5.607 -6.658
92 2HG2 THR 15 2HG2 THR 15 12.462 6.123 -5.123
93 3HG2 THR 15 3HG2 THR 15 11.226 4.819 -5.101
94 H ARG 16 H ARG 16 14.136 3.291 -8.860
95 HA ARG 16 HA ARG 16 15.969 1.168 -8.155
96 1HB ARG 16 1HB ARG 16 15.854 3.207 -10.427
97 2HB ARG 16 2HB ARG 16 17.292 2.149 -10.151
98 1HG ARG 16 1HG ARG 16 16.006 0.147 -10.299
99 2HG ARG 16 2HG ARG 16 14.459 1.027 -10.548
100 1HD ARG 16 1HD ARG 16 15.109 1.772 -12.769
101 2HD ARG 16 2HD ARG 16 16.846 1.365 -12.485
102 HE ARG 16 HE ARG 16 14.575 -0.635 -12.735
103 1HH1 ARG 16 1HH1 ARG 16 18.084 0.075 -12.892
104 2HH1 ARG 16 2HH1 ARG 16 18.527 -1.587 -13.084
105 1HH2 ARG 16 1HH2 ARG 16 15.222 -2.850 -12.940
106 2HH2 ARG 16 2HH2 ARG 16 16.896 -3.256 -13.110
107 H SER 17 H SER 17 17.505 1.499 -6.623
108 HA SER 17 HA SER 17 18.994 3.852 -6.212
109 1HB SER 17 1HB SER 17 16.514 4.477 -5.415
110 2HB SER 17 2HB SER 17 16.858 3.381 -4.047
111 HG SER 17 HG SER 17 17.367 5.467 -3.510
112 H GLN 18 H GLN 18 19.575 3.590 -3.574
113 HA GLN 18 HA GLN 18 19.934 0.797 -2.854
114 1HB GLN 18 1HB GLN 18 22.372 2.640 -3.220
115 2HB GLN 18 2HB GLN 18 22.356 0.957 -2.594
116 1HG GLN 18 1HG GLN 18 23.152 0.529 -4.699
117 2HG GLN 18 2HG GLN 18 21.407 0.340 -5.030
118 1HE2 GLN 18 1HE2 GLN 18 21.186 1.212 -7.131
119 2HE2 GLN 18 2HE2 GLN 18 21.654 2.855 -7.546
120 HA PRO 19 HA PRO 19 18.921 0.105 -1.106
121 1HB PRO 19 1HB PRO 19 17.202 0.429 1.043
122 2HB PRO 19 2HB PRO 19 18.970 0.029 1.296
123 1HG PRO 19 1HG PRO 19 17.673 2.826 1.304
124 2HG PRO 19 2HG PRO 19 18.661 2.074 2.624
125 1HD PRO 19 1HD PRO 19 19.809 3.704 0.734
126 2HD PRO 19 2HD PRO 19 20.678 2.205 1.305
127 HA PRO 20 HA PRO 20 15.484 2.037 -3.201
128 1HB PRO 20 1HB PRO 20 13.470 0.144 -3.162
129 2HB PRO 20 2HB PRO 20 15.045 -0.173 -3.994
130 1HG PRO 20 1HG PRO 20 14.264 -0.945 -1.126
131 2HG PRO 20 2HG PRO 20 14.852 -2.042 -2.448
132 1HD PRO 20 1HD PRO 20 16.556 -0.947 -0.568
133 2HD PRO 20 2HD PRO 20 17.088 -1.138 -2.311
134 H THR 21 H THR 21 13.036 2.385 -2.980
135 HA THR 21 HA THR 21 12.033 2.951 -0.314
136 HB THR 21 HB THR 21 12.198 5.080 -2.549
137 HG1 THR 21 HG1 THR 21 14.296 4.809 -1.854
138 1HG2 THR 21 1HG2 THR 21 11.498 6.584 -0.722
139 2HG2 THR 21 2HG2 THR 21 11.839 5.331 0.529
140 3HG2 THR 21 3HG2 THR 21 10.460 5.122 -0.592
141 H CYS 22 H CYS 22 9.856 2.313 -0.538
142 HA CYS 22 HA CYS 22 8.775 2.252 -3.292
143 1HB CYS 22 1HB CYS 22 10.241 0.217 -2.777
144 2HB CYS 22 2HB CYS 22 9.141 -0.206 -1.462
145 H ARG 23 H ARG 23 6.595 1.462 -3.397
146 HA ARG 23 HA ARG 23 4.935 1.703 -1.059
147 1HB ARG 23 1HB ARG 23 5.917 4.129 -2.078
148 2HB ARG 23 2HB ARG 23 4.382 3.978 -2.957
149 1HG ARG 23 1HG ARG 23 3.209 3.750 -0.680
150 2HG ARG 23 2HG ARG 23 4.789 3.999 0.107
151 1HD ARG 23 1HD ARG 23 3.554 6.168 0.048
152 2HD ARG 23 2HD ARG 23 4.953 6.269 -1.073
153 HE ARG 23 HE ARG 23 3.547 6.282 -2.908
154 1HH1 ARG 23 1HH1 ARG 23 1.506 5.470 -0.045
155 2HH1 ARG 23 2HH1 ARG 23 0.052 5.455 -0.966
156 1HH2 ARG 23 1HH2 ARG 23 1.652 6.215 -4.060
157 2HH2 ARG 23 2HH2 ARG 23 0.119 5.858 -3.321
158 H CYS 24 H CYS 24 2.793 1.390 -1.441
159 HA CYS 24 HA CYS 24 2.028 0.112 -3.905
160 1HB CYS 24 1HB CYS 24 0.495 0.579 -1.268
161 2HB CYS 24 2HB CYS 24 0.058 -0.594 -2.539
162 H VAL 25 H VAL 25 1.230 1.407 -5.558
163 HA VAL 25 HA VAL 25 0.392 4.043 -5.080
164 HB VAL 25 HB VAL 25 0.126 4.311 -7.419
165 1HG1 VAL 25 1HG1 VAL 25 2.454 4.282 -6.399
166 2HG1 VAL 25 2HG1 VAL 25 2.446 3.755 -8.115
167 3HG1 VAL 25 3HG1 VAL 25 2.610 2.538 -6.809
168 1HG2 VAL 25 1HG2 VAL 25 0.454 2.369 -8.994
169 2HG2 VAL 25 2HG2 VAL 25 -1.014 2.141 -7.989
170 3HG2 VAL 25 3HG2 VAL 25 0.504 1.248 -7.593
171 H ASP 26 H ASP 26 -1.254 1.086 -4.956
172 HA ASP 26 HA ASP 26 -3.798 2.139 -5.744
173 1HB ASP 26 1HB ASP 26 -4.737 -0.046 -5.318
174 2HB ASP 26 2HB ASP 26 -3.214 -0.206 -6.260
175 HD2 ASP 26 HD2 ASP 26 -1.612 -1.361 -3.238
176 H VAL 27 H VAL 27 -5.467 2.869 -4.583
177 HA VAL 27 HA VAL 27 -5.186 3.272 -1.712
178 HB VAL 27 HB VAL 27 -6.550 4.415 -4.014
179 1HG1 VAL 27 1HG1 VAL 27 -8.576 3.225 -3.268
180 2HG1 VAL 27 2HG1 VAL 27 -8.693 4.992 -3.075
181 3HG1 VAL 27 3HG1 VAL 27 -8.418 3.969 -1.616
182 1HG2 VAL 27 1HG2 VAL 27 -6.212 5.353 -1.092
183 2HG2 VAL 27 2HG2 VAL 27 -6.721 6.381 -2.483
184 3HG2 VAL 27 3HG2 VAL 27 -5.076 5.659 -2.470
185 H ARG 28 H ARG 28 -6.366 2.278 -0.073
186 HA ARG 28 HA ARG 28 -8.648 0.728 -0.996
187 1HB ARG 28 1HB ARG 28 -6.398 -0.259 0.772
188 2HB ARG 28 2HB ARG 28 -8.066 -0.857 1.093
189 1HG ARG 28 1HG ARG 28 -6.558 -1.160 -1.563
190 2HG ARG 28 2HG ARG 28 -6.794 -2.440 -0.322
191 1HD ARG 28 1HD ARG 28 -9.350 -2.223 -0.669
192 2HD ARG 28 2HD ARG 28 -9.013 -1.016 -1.951
193 HE ARG 28 HE ARG 28 -8.254 -2.683 -3.410
194 1HH1 ARG 28 1HH1 ARG 28 -8.720 -4.242 -0.180
195 2HH1 ARG 28 2HH1 ARG 28 -8.732 -5.825 -0.864
196 1HH2 ARG 28 1HH2 ARG 28 -8.244 -4.824 -4.209
197 2HH2 ARG 28 2HH2 ARG 28 -8.395 -6.170 -3.121
198 H GLU 29 H GLU 29 -10.239 0.420 0.690
199 HA GLU 29 HA GLU 29 -10.707 2.582 2.406
200 1HB GLU 29 1HB GLU 29 -11.812 -0.246 2.140
201 2HB GLU 29 2HB GLU 29 -12.460 0.963 3.312
202 1HG GLU 29 1HG GLU 29 -12.977 2.536 1.424
203 2HG GLU 29 2HG GLU 29 -12.343 1.365 0.231
204 HE2 GLU 29 HE2 GLU 29 -15.862 0.594 2.074
205 H SER 30 H SER 30 -9.522 -0.687 3.017
206 HA SER 30 HA SER 30 -8.776 -0.117 5.713
207 1HB SER 30 1HB SER 30 -7.899 -2.554 4.044
208 2HB SER 30 2HB SER 30 -7.602 -2.306 5.796
209 HG SER 30 HG SER 30 -9.380 -3.556 5.604
210 H CYS 31 H CYS 31 -6.793 0.033 6.646
211 HA CYS 31 HA CYS 31 -4.410 0.267 4.968
212 1HB CYS 31 1HB CYS 31 -5.325 2.580 5.421
213 2HB CYS 31 2HB CYS 31 -5.210 2.257 7.206
214 H HIS 32 H HIS 32 -2.426 -0.198 6.370
215 HA HIS 32 HA HIS 32 -3.118 -1.362 8.987
216 1HB HIS 32 1HB HIS 32 -2.981 -3.184 7.366
217 2HB HIS 32 2HB HIS 32 -1.343 -2.612 6.840
218 HD1 HIS 32 HD1 HIS 32 -3.088 -4.857 8.985
219 HD2 HIS 32 HD2 HIS 32 0.632 -2.965 9.083
220 HE1 HIS 32 HE1 HIS 32 -1.711 -6.110 10.643
221 HE2 HIS 32 HE2 HIS 32 0.570 -4.950 10.718
222 H SER 33 H SER 33 -1.586 -0.983 10.536
223 HA SER 33 HA SER 33 0.278 1.174 9.827
224 1HB SER 33 1HB SER 33 -0.594 0.054 12.543
225 2HB SER 33 2HB SER 33 0.675 1.328 12.373
226 HG SER 33 HG SER 33 -1.595 2.027 12.700
227 H ALA 34 H ALA 34 1.426 -0.625 8.531
228 HA ALA 34 HA ALA 34 3.687 -1.503 10.214
229 1HB ALA 34 1HB ALA 34 4.217 -3.039 8.230
230 2HB ALA 34 2HB ALA 34 2.669 -2.504 7.461
231 3HB ALA 34 3HB ALA 34 2.645 -3.443 9.002
232 H CYS 35 H CYS 35 3.130 1.092 9.659
233 HA CYS 35 HA CYS 35 4.951 1.952 7.511
234 1HB CYS 35 1HB CYS 35 2.145 2.938 8.275
235 2HB CYS 35 2HB CYS 35 3.168 3.695 6.998
236 H ASP 36 H ASP 36 3.968 4.729 8.185
237 HA ASP 36 HA ASP 36 4.882 5.113 10.934
238 1HB ASP 36 1HB ASP 36 6.149 6.430 8.443
239 2HB ASP 36 2HB ASP 36 6.176 7.230 10.053
240 HD2 ASP 36 HD2 ASP 36 7.873 5.298 8.145
241 H LYS 37 H LYS 37 3.671 7.077 8.064
242 HA LYS 37 HA LYS 37 1.356 7.653 9.758
243 1HB LYS 37 1HB LYS 37 2.873 9.621 9.286
244 2HB LYS 37 2HB LYS 37 2.663 9.347 7.540
245 1HG LYS 37 1HG LYS 37 1.283 11.208 8.409
246 2HG LYS 37 2HG LYS 37 0.275 9.920 7.674
247 1HD LYS 37 1HD LYS 37 -0.486 9.136 9.846
248 2HD LYS 37 2HD LYS 37 0.838 10.007 10.692
249 1HE LYS 37 1HE LYS 37 -1.379 11.097 11.060
250 2HE LYS 37 2HE LYS 37 -0.212 12.197 10.221
251 1HZ LYS 37 1HZ LYS 37 -2.427 12.226 9.274
252 2HZ LYS 37 2HZ LYS 37 -2.313 10.576 8.878
253 3HZ LYS 37 3HZ LYS 37 -1.257 11.702 8.162
254 H CYS 38 H CYS 38 -0.426 6.460 9.047
255 HA CYS 38 HA CYS 38 -0.952 6.351 6.194
256 1HB CYS 38 1HB CYS 38 -1.356 4.428 7.790
257 2HB CYS 38 2HB CYS 38 -2.615 5.454 8.580
258 H VAL 39 H VAL 39 -2.371 7.705 5.094
259 HA VAL 39 HA VAL 39 -3.772 9.756 6.680
260 HB VAL 39 HB VAL 39 -2.582 9.597 3.887
261 1HG1 VAL 39 1HG1 VAL 39 -4.318 11.811 5.145
262 2HG1 VAL 39 2HG1 VAL 39 -4.690 10.833 3.658
263 3HG1 VAL 39 3HG1 VAL 39 -3.313 11.994 3.650
264 1HG2 VAL 39 1HG2 VAL 39 -1.298 11.630 4.738
265 2HG2 VAL 39 2HG2 VAL 39 -0.937 10.118 5.666
266 3HG2 VAL 39 3HG2 VAL 39 -2.044 11.372 6.359
267 H CYS 40 H CYS 40 -6.053 9.914 6.187
268 HA CYS 40 HA CYS 40 -7.066 7.928 4.299
269 1HB CYS 40 1HB CYS 40 -6.596 7.186 6.745
270 2HB CYS 40 2HB CYS 40 -8.070 8.093 7.169
271 H ALA 41 H ALA 41 -8.197 9.101 3.003
272 HA ALA 41 HA ALA 41 -9.584 11.509 3.772
273 1HB ALA 41 1HB ALA 41 -10.270 11.756 1.479
274 2HB ALA 41 2HB ALA 41 -9.695 10.096 1.084
275 3HB ALA 41 3HB ALA 41 -8.511 11.372 1.555
276 H TYR 42 H TYR 42 -11.769 11.941 3.855
277 HA TYR 42 HA TYR 42 -13.222 9.750 4.923
278 1HB TYR 42 1HB TYR 42 -14.839 11.464 5.684
279 2HB TYR 42 2HB TYR 42 -13.132 11.926 6.010
280 HD1 TYR 42 HD1 TYR 42 -16.041 12.559 3.680
281 HD2 TYR 42 HD2 TYR 42 -12.210 13.950 5.064
282 HE1 TYR 42 HE1 TYR 42 -16.362 14.674 2.469
283 HE2 TYR 42 HE2 TYR 42 -12.534 16.050 3.855
284 HH TYR 42 HH TYR 42 -15.490 16.680 1.913
285 H SER 43 H SER 43 -12.901 10.511 1.923
286 HA SER 43 HA SER 43 -15.194 11.201 0.697
287 1HB SER 43 1HB SER 43 -12.983 9.498 -0.560
288 2HB SER 43 2HB SER 43 -14.025 10.789 -1.362
289 HG SER 43 HG SER 43 -11.825 11.375 -0.752
290 H ASN 44 H ASN 44 -15.209 9.326 -1.609
291 HA ASN 44 HA ASN 44 -16.881 7.185 -0.565
292 1HB ASN 44 1HB ASN 44 -18.050 9.417 -0.921
293 2HB ASN 44 2HB ASN 44 -17.655 9.321 -2.651
294 1HD2 ASN 44 1HD2 ASN 44 -18.380 6.912 -3.576
295 2HD2 ASN 44 2HD2 ASN 44 -19.931 6.371 -3.064
296 HA PRO 45 HA PRO 45 -16.351 5.234 -0.576
297 1HB PRO 45 1HB PRO 45 -14.613 3.138 -0.904
298 2HB PRO 45 2HB PRO 45 -16.114 3.220 -1.837
299 1HG PRO 45 1HG PRO 45 -13.342 4.195 -2.745
300 2HG PRO 45 2HG PRO 45 -14.422 3.048 -3.620
301 1HD PRO 45 1HD PRO 45 -14.396 5.771 -4.162
302 2HD PRO 45 2HD PRO 45 -15.948 4.815 -4.228
303 HA PRO 46 HA PRO 46 -13.065 7.244 1.461
304 1HB PRO 46 1HB PRO 46 -12.459 5.757 3.739
305 2HB PRO 46 2HB PRO 46 -13.947 6.749 3.519
306 1HG PRO 46 1HG PRO 46 -13.657 3.745 3.153
307 2HG PRO 46 2HG PRO 46 -14.980 4.708 3.952
308 1HD PRO 46 1HD PRO 46 -15.113 3.700 1.333
309 2HD PRO 46 2HD PRO 46 -15.959 5.282 1.865
310 H GLN 47 H GLN 47 -10.740 7.382 1.894
311 HA GLN 47 HA GLN 47 -9.358 5.409 0.169
312 1HB GLN 47 1HB GLN 47 -8.739 8.390 0.492
313 2HB GLN 47 2HB GLN 47 -8.005 7.282 -0.691
314 1HG GLN 47 1HG GLN 47 -11.045 7.940 -0.760
315 2HG GLN 47 2HG GLN 47 -9.812 9.059 -1.418
316 1HE2 GLN 47 1HE2 GLN 47 -8.330 8.249 -3.066
317 2HE2 GLN 47 2HE2 GLN 47 -8.985 7.155 -4.249
318 H CYS 48 H CYS 48 -7.388 4.665 1.003
319 HA CYS 48 HA CYS 48 -6.182 6.100 3.236
320 1HB CYS 48 1HB CYS 48 -8.133 4.047 3.558
321 2HB CYS 48 2HB CYS 48 -6.593 3.192 3.732
322 H GLN 49 H GLN 49 -4.083 5.953 3.164
323 HA GLN 49 HA GLN 49 -2.654 3.756 1.981
324 1HB GLN 49 1HB GLN 49 -2.682 6.648 0.988
325 2HB GLN 49 2HB GLN 49 -1.240 5.598 0.674
326 1HG GLN 49 1HG GLN 49 -2.670 3.966 -0.596
327 2HG GLN 49 2HG GLN 49 -4.067 5.083 -0.426
328 1HE2 GLN 49 1HE2 GLN 49 -3.267 7.543 -1.041
329 2HE2 GLN 49 2HE2 GLN 49 -2.383 7.657 -2.521
330 H CYS 50 H CYS 50 -0.525 3.683 2.654
331 HA CYS 50 HA CYS 50 0.279 5.437 4.828
332 1HB CYS 50 1HB CYS 50 1.749 3.179 3.381
333 2HB CYS 50 2HB CYS 50 2.467 4.135 4.697
334 H TYR 51 H TYR 51 0.822 7.416 4.418
335 HA TYR 51 HA TYR 51 1.828 8.496 2.042
336 1HB TYR 51 1HB TYR 51 1.299 9.453 4.860
337 2HB TYR 51 2HB TYR 51 2.669 10.283 4.074
338 HD1 TYR 51 HD1 TYR 51 -0.609 8.908 2.598
339 HD2 TYR 51 HD2 TYR 51 1.812 12.433 3.364
340 HE1 TYR 51 HE1 TYR 51 -2.007 10.213 1.144
341 HE2 TYR 51 HE2 TYR 51 0.364 13.711 1.963
342 HH TYR 51 HH TYR 51 -1.480 13.709 0.587
343 H ASP 52 H ASP 52 3.528 7.159 4.701
344 HA ASP 52 HA ASP 52 6.071 8.211 3.821
345 1HB ASP 52 1HB ASP 52 5.631 7.643 6.241
346 2HB ASP 52 2HB ASP 52 5.588 5.896 5.785
347 HD2 ASP 52 HD2 ASP 52 8.952 5.700 6.234
348 H THR 53 H THR 53 6.912 7.646 1.877
349 HA THR 53 HA THR 53 6.779 5.207 0.656
350 HB THR 53 HB THR 53 9.181 7.020 0.256
351 HG1 THR 53 HG1 THR 53 7.909 8.457 -0.801
352 1HG2 THR 53 1HG2 THR 53 8.629 6.575 -2.106
353 2HG2 THR 53 2HG2 THR 53 7.010 5.931 -1.669
354 3HG2 THR 53 3HG2 THR 53 8.484 4.987 -1.268
355 H HIS 54 H HIS 54 7.645 3.242 1.454
356 HA HIS 54 HA HIS 54 10.330 3.292 2.440
357 1HB HIS 54 1HB HIS 54 9.208 3.974 4.514
358 2HB HIS 54 2HB HIS 54 8.091 2.605 4.446
359 HD1 HIS 54 HD1 HIS 54 8.771 1.487 6.480
360 HD2 HIS 54 HD2 HIS 54 12.076 2.026 3.952
361 HE1 HIS 54 HE1 HIS 54 10.624 0.130 7.426
362 HE2 HIS 54 HE2 HIS 54 12.633 0.448 5.875
363 H LYS 55 H LYS 55 7.798 0.817 3.226
364 HA LYS 55 HA LYS 55 9.727 -1.029 2.597
365 1HB LYS 55 1HB LYS 55 8.328 -2.591 3.719
366 2HB LYS 55 2HB LYS 55 8.167 -1.049 4.572
367 1HG LYS 55 1HG LYS 55 6.126 -2.112 2.505
368 2HG LYS 55 2HG LYS 55 6.062 -2.396 4.277
369 1HD LYS 55 1HD LYS 55 5.941 0.111 4.657
370 2HD LYS 55 2HD LYS 55 5.889 0.336 2.864
371 1HE LYS 55 1HE LYS 55 3.617 0.481 3.793
372 2HE LYS 55 2HE LYS 55 3.758 -0.992 2.751
373 1HZ LYS 55 1HZ LYS 55 3.977 -0.953 5.726
374 2HZ LYS 55 2HZ LYS 55 4.006 -2.319 4.720
375 3HZ LYS 55 3HZ LYS 55 2.596 -1.388 4.837
376 H PHE 56 H PHE 56 9.204 -3.135 1.524
377 HA PHE 56 HA PHE 56 9.010 -2.434 -1.195
378 1HB PHE 56 1HB PHE 56 9.721 -4.811 -1.639
379 2HB PHE 56 2HB PHE 56 10.773 -3.964 -0.482
380 HD1 PHE 56 HD1 PHE 56 8.286 -6.652 -0.919
381 HD2 PHE 56 HD2 PHE 56 10.615 -4.478 1.988
382 HE1 PHE 56 HE1 PHE 56 7.820 -8.378 0.747
383 HE2 PHE 56 HE2 PHE 56 10.128 -6.199 3.659
384 HZ PHE 56 HZ PHE 56 8.721 -8.160 3.066
385 H CYS 57 H CYS 57 7.977 -4.194 -2.765
386 HA CYS 57 HA CYS 57 5.171 -3.782 -2.370
387 1HB CYS 57 1HB CYS 57 6.352 -3.385 -4.510
388 2HB CYS 57 2HB CYS 57 6.665 -5.142 -4.667
389 H TYR 58 H TYR 58 4.076 -5.015 -1.146
390 HA TYR 58 HA TYR 58 4.612 -7.774 -0.666
391 1HB TYR 58 1HB TYR 58 3.161 -5.720 0.679
392 2HB TYR 58 2HB TYR 58 1.863 -6.804 0.138
393 HD1 TYR 58 HD1 TYR 58 5.312 -6.838 1.625
394 HD2 TYR 58 HD2 TYR 58 1.368 -8.593 1.737
395 HE1 TYR 58 HE1 TYR 58 5.957 -8.185 3.521
396 HE2 TYR 58 HE2 TYR 58 2.012 -9.935 3.627
397 HH TYR 58 HH TYR 58 5.173 -9.557 5.240
398 H LYS 59 H LYS 59 2.694 -9.203 -0.421
399 HA LYS 59 HA LYS 59 1.574 -10.274 -2.687
400 1HB LYS 59 1HB LYS 59 0.466 -10.280 0.158
401 2HB LYS 59 2HB LYS 59 -0.009 -11.416 -1.157
402 1HG LYS 59 1HG LYS 59 2.381 -12.304 -1.181
403 2HG LYS 59 2HG LYS 59 2.777 -11.217 0.184
404 1HD LYS 59 1HD LYS 59 0.708 -12.311 1.393
405 2HD LYS 59 2HD LYS 59 0.907 -13.622 0.181
406 1HE LYS 59 1HE LYS 59 3.076 -12.569 2.141
407 2HE LYS 59 2HE LYS 59 2.137 -14.109 2.322
408 1HZ LYS 59 1HZ LYS 59 4.254 -14.560 1.396
409 2HZ LYS 59 2HZ LYS 59 4.053 -13.406 0.166
410 3HZ LYS 59 3HZ LYS 59 3.090 -14.803 0.180
411 H ALA 60 H ALA 60 -0.646 -10.395 -3.421
412 HA ALA 60 HA ALA 60 -1.871 -7.837 -3.635
413 1HB ALA 60 1HB ALA 60 -1.839 -9.584 -5.451
414 2HB ALA 60 2HB ALA 60 -3.538 -9.132 -5.023
415 3HB ALA 60 3HB ALA 60 -2.811 -10.668 -4.395
416 H CYS 61 H CYS 61 -4.003 -7.236 -3.128
417 HA CYS 61 HA CYS 61 -4.783 -8.170 -0.479
418 1HB CYS 61 1HB CYS 61 -4.453 -5.632 -1.405
419 2HB CYS 61 2HB CYS 61 -6.184 -5.804 -1.754
420 H HIS 62 H HIS 62 -5.224 -9.990 -2.221
421 HA HIS 62 HA HIS 62 -8.183 -10.185 -2.343
422 1HB HIS 62 1HB HIS 62 -6.000 -11.552 -3.932
423 2HB HIS 62 2HB HIS 62 -7.411 -12.535 -3.505
424 HD1 HIS 62 HD1 HIS 62 -9.559 -12.155 -4.539
425 HD2 HIS 62 HD2 HIS 62 -6.861 -9.134 -5.639
426 HE1 HIS 62 HE1 HIS 62 -10.675 -10.788 -6.329
427 HE2 HIS 62 HE2 HIS 62 -9.026 -8.960 -6.970
428 H ASN 63 H ASN 63 -9.051 -12.302 -1.398
429 HA ASN 63 HA ASN 63 -7.780 -13.661 0.562
430 1HB ASN 63 1HB ASN 63 -8.896 -12.332 2.562
431 2HB ASN 63 2HB ASN 63 -7.314 -11.795 1.915
432 1HD2 ASN 63 1HD2 ASN 63 -7.246 -9.400 1.607
433 2HD2 ASN 63 2HD2 ASN 63 -8.586 -8.572 0.960
434 H SER 64 H SER 64 -10.732 -11.863 0.830
435 HA SER 64 HA SER 64 -12.296 -14.387 0.781
436 1HB SER 64 1HB SER 64 -11.992 -13.129 2.957
437 2HB SER 64 2HB SER 64 -12.853 -11.725 2.236
438 HG SER 64 HG SER 64 -14.656 -13.164 1.958
439 H GLU 65 H GLU 65 -11.839 -13.060 -1.614
440 HA GLU 65 HA GLU 65 -13.820 -11.443 -2.620
441 1HB GLU 65 1HB GLU 65 -12.999 -12.101 -4.852
442 2HB GLU 65 2HB GLU 65 -11.693 -11.691 -3.734
443 1HG GLU 65 1HG GLU 65 -12.557 -14.633 -4.327
444 2HG GLU 65 2HG GLU 65 -11.274 -13.770 -5.242
445 HE2 GLU 65 HE2 GLU 65 -10.294 -15.496 -1.904
446 H ILE 66 H ILE 66 -15.331 -13.238 -1.257
447 HA ILE 66 HA ILE 66 -17.132 -14.246 -3.297
448 HB ILE 66 HB ILE 66 -17.366 -16.471 -2.232
449 1HG1 ILE 66 1HG1 ILE 66 -16.086 -15.793 -0.057
450 2HG1 ILE 66 2HG1 ILE 66 -15.957 -17.434 -0.713
451 1HG2 ILE 66 1HG2 ILE 66 -14.649 -15.998 -3.581
452 2HG2 ILE 66 2HG2 ILE 66 -16.242 -16.196 -4.400
453 3HG2 ILE 66 3HG2 ILE 66 -15.540 -17.555 -3.447
454 1HD1 ILE 66 1HD1 ILE 66 -13.759 -16.576 0.103
455 2HD1 ILE 66 2HD1 ILE 66 -13.796 -15.283 -1.146
456 3HD1 ILE 66 3HD1 ILE 66 -13.712 -17.002 -1.644
457 H GLU 67 H GLU 67 -19.222 -15.160 -2.325
458 HA GLU 67 HA GLU 67 -19.876 -14.372 0.271
459 1HB GLU 67 1HB GLU 67 -21.673 -12.829 -0.381
460 2HB GLU 67 2HB GLU 67 -20.100 -12.120 -0.870
461 1HG GLU 67 1HG GLU 67 -22.039 -13.622 -2.781
462 2HG GLU 67 2HG GLU 67 -22.012 -11.840 -2.554
463 HE2 GLU 67 HE2 GLU 67 -19.912 -13.076 -5.402
Start of MODEL 15
1 1H GLY 1 1H GLY 1 -9.995 -3.751 6.568
2 2H GLY 1 2H GLY 1 -8.503 -3.549 7.362
3 3H GLY 1 3H GLY 1 -9.924 -3.754 8.267
4 1HA GLY 1 1HA GLY 1 -10.187 -5.952 7.249
5 2HA GLY 1 2HA GLY 1 -8.511 -5.713 6.602
6 H ASP 2 H ASP 2 -9.548 -7.757 8.571
7 HA ASP 2 HA ASP 2 -7.673 -7.256 10.774
8 1HB ASP 2 1HB ASP 2 -10.748 -7.486 11.191
9 2HB ASP 2 2HB ASP 2 -9.529 -7.562 12.515
10 HD2 ASP 2 HD2 ASP 2 -8.754 -4.177 12.329
11 H ASP 3 H ASP 3 -6.777 -9.066 9.748
12 HA ASP 3 HA ASP 3 -7.685 -11.428 11.138
13 1HB ASP 3 1HB ASP 3 -8.896 -11.419 8.838
14 2HB ASP 3 2HB ASP 3 -7.297 -11.687 8.075
15 HD2 ASP 3 HD2 ASP 3 -7.057 -14.960 9.291
16 H VAL 4 H VAL 4 -5.305 -10.435 8.567
17 HA VAL 4 HA VAL 4 -3.308 -12.024 9.966
18 HB VAL 4 HB VAL 4 -2.978 -10.994 7.156
19 1HG1 VAL 4 1HG1 VAL 4 -1.067 -12.230 8.377
20 2HG1 VAL 4 2HG1 VAL 4 -1.688 -13.147 6.968
21 3HG1 VAL 4 3HG1 VAL 4 -2.186 -13.618 8.627
22 1HG2 VAL 4 1HG2 VAL 4 -3.981 -13.141 6.295
23 2HG2 VAL 4 2HG2 VAL 4 -5.221 -12.066 6.992
24 3HG2 VAL 4 3HG2 VAL 4 -4.624 -13.492 7.933
25 H LYS 5 H LYS 5 -1.302 -11.070 10.492
26 HA LYS 5 HA LYS 5 -1.101 -8.235 10.537
27 1HB LYS 5 1HB LYS 5 1.017 -8.610 11.707
28 2HB LYS 5 2HB LYS 5 -0.305 -9.570 12.419
29 1HG LYS 5 1HG LYS 5 1.492 -10.960 10.368
30 2HG LYS 5 2HG LYS 5 2.143 -10.576 11.990
31 1HD LYS 5 1HD LYS 5 0.221 -11.723 13.086
32 2HD LYS 5 2HD LYS 5 -0.404 -12.234 11.485
33 1HE LYS 5 1HE LYS 5 1.717 -13.507 11.038
34 2HE LYS 5 2HE LYS 5 2.330 -13.013 12.674
35 1HZ LYS 5 1HZ LYS 5 -0.153 -14.554 12.132
36 2HZ LYS 5 2HZ LYS 5 0.435 -14.092 13.654
37 3HZ LYS 5 3HZ LYS 5 1.319 -15.182 12.700
38 H SER 6 H SER 6 -0.582 -10.421 8.184
39 HA SER 6 HA SER 6 1.540 -9.341 6.662
40 1HB SER 6 1HB SER 6 -1.048 -10.685 5.706
41 2HB SER 6 2HB SER 6 0.388 -10.347 4.673
42 HG SER 6 HG SER 6 0.341 -12.480 5.539
43 H ALA 7 H ALA 7 1.429 -7.976 4.741
44 HA ALA 7 HA ALA 7 -0.607 -5.857 4.915
45 1HB ALA 7 1HB ALA 7 1.869 -5.258 4.663
46 2HB ALA 7 2HB ALA 7 0.932 -4.744 3.206
47 3HB ALA 7 3HB ALA 7 1.928 -6.250 3.170
48 H CYS 8 H CYS 8 -1.657 -5.208 2.757
49 HA CYS 8 HA CYS 8 -1.280 -7.254 0.731
50 1HB CYS 8 1HB CYS 8 -3.331 -7.981 0.394
51 2HB CYS 8 2HB CYS 8 -3.513 -7.602 2.115
52 H CYS 9 H CYS 9 -1.246 -6.593 -1.348
53 HA CYS 9 HA CYS 9 -1.472 -3.696 -1.867
54 1HB CYS 9 1HB CYS 9 0.915 -5.613 -1.857
55 2HB CYS 9 2HB CYS 9 0.932 -4.294 -3.049
56 H ASP 10 H ASP 10 -2.582 -3.535 -3.921
57 HA ASP 10 HA ASP 10 -2.877 -5.877 -5.473
58 1HB ASP 10 1HB ASP 10 -3.314 -3.002 -6.424
59 2HB ASP 10 2HB ASP 10 -4.026 -4.441 -7.109
60 HD2 ASP 10 HD2 ASP 10 -5.650 -2.804 -6.744
61 H THR 11 H THR 11 -0.661 -3.199 -5.650
62 HA THR 11 HA THR 11 1.044 -4.372 -7.689
63 HB THR 11 HB THR 11 -0.476 -1.738 -8.150
64 HG1 THR 11 HG1 THR 11 -1.224 -2.698 -9.837
65 1HG2 THR 11 1HG2 THR 11 1.071 -1.644 -10.259
66 2HG2 THR 11 2HG2 THR 11 2.150 -2.791 -9.381
67 3HG2 THR 11 3HG2 THR 11 1.807 -1.149 -8.707
68 H CYS 12 H CYS 12 2.744 -4.326 -6.640
69 HA CYS 12 HA CYS 12 3.756 -2.170 -5.012
70 1HB CYS 12 1HB CYS 12 4.150 -4.571 -4.485
71 2HB CYS 12 2HB CYS 12 5.026 -4.751 -6.069
72 H LEU 13 H LEU 13 5.447 -0.726 -5.490
73 HA LEU 13 HA LEU 13 6.745 -0.878 -8.089
74 1HB LEU 13 1HB LEU 13 4.466 0.268 -8.172
75 2HB LEU 13 2HB LEU 13 5.147 1.563 -7.149
76 HG LEU 13 HG LEU 13 6.455 0.699 -9.803
77 1HD1 LEU 13 1HD1 LEU 13 4.100 2.677 -9.555
78 2HD1 LEU 13 2HD1 LEU 13 4.004 1.013 -10.230
79 3HD1 LEU 13 3HD1 LEU 13 4.980 2.274 -11.056
80 1HD2 LEU 13 1HD2 LEU 13 7.098 3.138 -9.946
81 2HD2 LEU 13 2HD2 LEU 13 7.724 2.379 -8.435
82 3HD2 LEU 13 3HD2 LEU 13 6.264 3.439 -8.376
83 H CYS 14 H CYS 14 8.787 -0.496 -7.775
84 HA CYS 14 HA CYS 14 9.696 0.860 -5.379
85 1HB CYS 14 1HB CYS 14 11.292 -0.737 -7.415
86 2HB CYS 14 2HB CYS 14 11.948 -0.006 -5.948
87 H THR 15 H THR 15 10.925 2.659 -5.220
88 HA THR 15 HA THR 15 10.895 4.440 -7.463
89 HB THR 15 HB THR 15 12.224 5.984 -6.088
90 HG1 THR 15 HG1 THR 15 13.246 5.237 -4.426
91 1HG2 THR 15 1HG2 THR 15 10.437 6.352 -4.390
92 2HG2 THR 15 2HG2 THR 15 9.822 4.680 -4.619
93 3HG2 THR 15 3HG2 THR 15 9.711 5.867 -5.967
94 H ARG 16 H ARG 16 12.568 5.364 -8.641
95 HA ARG 16 HA ARG 16 15.216 4.178 -8.484
96 1HB ARG 16 1HB ARG 16 13.983 6.179 -10.379
97 2HB ARG 16 2HB ARG 16 15.755 6.032 -10.193
98 1HG ARG 16 1HG ARG 16 15.783 4.459 -11.700
99 2HG ARG 16 2HG ARG 16 15.025 3.346 -10.526
100 1HD ARG 16 1HD ARG 16 13.519 5.131 -12.569
101 2HD ARG 16 2HD ARG 16 13.868 3.362 -12.775
102 HE ARG 16 HE ARG 16 12.586 3.447 -10.334
103 1HH1 ARG 16 1HH1 ARG 16 11.785 4.703 -13.578
104 2HH1 ARG 16 2HH1 ARG 16 10.071 4.544 -13.365
105 1HH2 ARG 16 1HH2 ARG 16 10.289 3.234 -10.069
106 2HH2 ARG 16 2HH2 ARG 16 9.211 3.693 -11.352
107 H SER 17 H SER 17 16.441 4.890 -6.813
108 HA SER 17 HA SER 17 16.959 7.569 -6.248
109 1HB SER 17 1HB SER 17 15.840 7.847 -4.045
110 2HB SER 17 2HB SER 17 14.620 7.563 -5.284
111 HG SER 17 HG SER 17 15.527 5.777 -3.271
112 H GLN 18 H GLN 18 17.865 7.181 -3.540
113 HA GLN 18 HA GLN 18 19.475 4.759 -3.673
114 1HB GLN 18 1HB GLN 18 20.533 6.437 -5.129
115 2HB GLN 18 2HB GLN 18 20.502 7.637 -3.811
116 1HG GLN 18 1HG GLN 18 22.093 6.184 -2.455
117 2HG GLN 18 2HG GLN 18 22.045 4.926 -3.748
118 1HE2 GLN 18 1HE2 GLN 18 22.822 5.548 -5.893
119 2HE2 GLN 18 2HE2 GLN 18 24.085 6.780 -6.032
120 HA PRO 19 HA PRO 19 19.289 3.246 -2.244
121 1HB PRO 19 1HB PRO 19 17.830 2.056 -0.207
122 2HB PRO 19 2HB PRO 19 19.591 2.506 0.002
123 1HG PRO 19 1HG PRO 19 17.121 4.139 0.841
124 2HG PRO 19 2HG PRO 19 18.545 3.667 1.858
125 1HD PRO 19 1HD PRO 19 18.352 6.122 0.554
126 2HD PRO 19 2HD PRO 19 19.955 5.279 0.763
127 HA PRO 20 HA PRO 20 15.054 3.544 -3.802
128 1HB PRO 20 1HB PRO 20 14.393 0.949 -4.418
129 2HB PRO 20 2HB PRO 20 15.671 1.839 -5.327
130 1HG PRO 20 1HG PRO 20 16.082 -0.067 -2.951
131 2HG PRO 20 2HG PRO 20 16.851 -0.142 -4.589
132 1HD PRO 20 1HD PRO 20 18.099 1.093 -2.449
133 2HD PRO 20 2HD PRO 20 18.211 1.812 -4.132
134 H THR 21 H THR 21 12.859 2.788 -3.305
135 HA THR 21 HA THR 21 12.342 2.053 -0.509
136 HB THR 21 HB THR 21 11.873 4.792 -1.885
137 HG1 THR 21 HG1 THR 21 13.910 4.617 -0.894
138 1HG2 THR 21 1HG2 THR 21 9.873 4.161 -0.463
139 2HG2 THR 21 2HG2 THR 21 10.806 5.506 0.254
140 3HG2 THR 21 3HG2 THR 21 10.986 3.863 0.939
141 H CYS 22 H CYS 22 10.230 1.139 -0.493
142 HA CYS 22 HA CYS 22 8.952 1.113 -3.151
143 1HB CYS 22 1HB CYS 22 11.016 -0.426 -3.087
144 2HB CYS 22 2HB CYS 22 10.156 -1.421 -1.872
145 H ARG 23 H ARG 23 6.950 0.310 -3.278
146 HA ARG 23 HA ARG 23 5.525 -0.644 -1.006
147 1HB ARG 23 1HB ARG 23 4.344 1.429 -0.335
148 2HB ARG 23 2HB ARG 23 6.097 1.707 -0.172
149 1HG ARG 23 1HG ARG 23 6.119 2.888 -2.393
150 2HG ARG 23 2HG ARG 23 4.334 2.677 -2.492
151 1HD ARG 23 1HD ARG 23 4.089 3.892 -0.312
152 2HD ARG 23 2HD ARG 23 5.878 4.243 -0.320
153 HE ARG 23 HE ARG 23 5.261 5.146 -2.772
154 1HH1 ARG 23 1HH1 ARG 23 3.416 5.716 0.250
155 2HH1 ARG 23 2HH1 ARG 23 2.630 7.123 -0.357
156 1HH2 ARG 23 1HH2 ARG 23 4.210 6.949 -3.561
157 2HH2 ARG 23 2HH2 ARG 23 3.106 7.871 -2.597
158 H CYS 24 H CYS 24 3.062 -0.308 -1.429
159 HA CYS 24 HA CYS 24 2.692 -0.561 -4.307
160 1HB CYS 24 1HB CYS 24 0.528 -1.576 -3.822
161 2HB CYS 24 2HB CYS 24 1.976 -2.419 -3.201
162 H VAL 25 H VAL 25 1.661 0.664 -5.572
163 HA VAL 25 HA VAL 25 1.287 3.346 -4.845
164 HB VAL 25 HB VAL 25 0.499 3.657 -7.200
165 1HG1 VAL 25 1HG1 VAL 25 3.116 2.098 -6.674
166 2HG1 VAL 25 2HG1 VAL 25 2.864 3.862 -6.382
167 3HG1 VAL 25 3HG1 VAL 25 2.780 3.216 -8.054
168 1HG2 VAL 25 1HG2 VAL 25 0.737 1.759 -8.767
169 2HG2 VAL 25 2HG2 VAL 25 -0.518 1.344 -7.557
170 3HG2 VAL 25 3HG2 VAL 25 1.134 0.613 -7.470
171 H ASP 26 H ASP 26 -0.779 0.837 -4.481
172 HA ASP 26 HA ASP 26 -3.172 2.015 -5.369
173 1HB ASP 26 1HB ASP 26 -2.830 -0.477 -3.609
174 2HB ASP 26 2HB ASP 26 -4.333 0.018 -4.491
175 HD2 ASP 26 HD2 ASP 26 -1.198 -1.357 -6.531
176 H VAL 27 H VAL 27 -4.620 3.266 -4.524
177 HA VAL 27 HA VAL 27 -4.533 3.902 -1.699
178 HB VAL 27 HB VAL 27 -4.558 5.500 -3.608
179 1HG1 VAL 27 1HG1 VAL 27 -7.574 4.868 -3.625
180 2HG1 VAL 27 2HG1 VAL 27 -6.440 4.384 -4.952
181 3HG1 VAL 27 3HG1 VAL 27 -6.728 6.134 -4.582
182 1HG2 VAL 27 1HG2 VAL 27 -5.074 5.999 -1.161
183 2HG2 VAL 27 2HG2 VAL 27 -6.827 5.767 -1.550
184 3HG2 VAL 27 3HG2 VAL 27 -5.895 7.106 -2.331
185 H ARG 28 H ARG 28 -5.773 3.131 -0.160
186 HA ARG 28 HA ARG 28 -7.999 1.339 -0.985
187 1HB ARG 28 1HB ARG 28 -6.007 1.008 1.309
188 2HB ARG 28 2HB ARG 28 -7.292 -0.172 0.873
189 1HG ARG 28 1HG ARG 28 -4.812 0.641 -0.752
190 2HG ARG 28 2HG ARG 28 -5.009 -0.897 0.146
191 1HD ARG 28 1HD ARG 28 -7.016 -0.259 -2.109
192 2HD ARG 28 2HD ARG 28 -5.313 -0.543 -2.523
193 HE ARG 28 HE ARG 28 -5.395 -2.780 -1.810
194 1HH1 ARG 28 1HH1 ARG 28 -8.623 -1.287 -1.273
195 2HH1 ARG 28 2HH1 ARG 28 -9.433 -2.815 -1.320
196 1HH2 ARG 28 1HH2 ARG 28 -6.533 -4.748 -1.888
197 2HH2 ARG 28 2HH2 ARG 28 -8.251 -4.786 -1.657
198 H GLU 29 H GLU 29 -9.311 0.665 0.979
199 HA GLU 29 HA GLU 29 -10.797 2.687 2.110
200 1HB GLU 29 1HB GLU 29 -10.163 -0.210 2.892
201 2HB GLU 29 2HB GLU 29 -11.427 0.751 3.734
202 1HG GLU 29 1HG GLU 29 -12.691 0.992 1.547
203 2HG GLU 29 2HG GLU 29 -11.510 -0.136 0.766
204 HE2 GLU 29 HE2 GLU 29 -14.237 -2.108 2.061
205 H SER 30 H SER 30 -7.851 1.240 3.171
206 HA SER 30 HA SER 30 -7.719 2.739 5.658
207 1HB SER 30 1HB SER 30 -7.667 -0.386 5.575
208 2HB SER 30 2HB SER 30 -7.346 0.598 7.043
209 HG SER 30 HG SER 30 -9.389 -0.192 7.096
210 H CYS 31 H CYS 31 -5.610 2.043 6.840
211 HA CYS 31 HA CYS 31 -3.564 1.120 4.901
212 1HB CYS 31 1HB CYS 31 -3.408 2.605 7.587
213 2HB CYS 31 2HB CYS 31 -1.946 2.067 6.677
214 H HIS 32 H HIS 32 -1.803 -0.159 6.112
215 HA HIS 32 HA HIS 32 -2.925 -1.894 8.217
216 1HB HIS 32 1HB HIS 32 -2.677 -3.212 6.161
217 2HB HIS 32 2HB HIS 32 -0.931 -2.675 6.021
218 HD1 HIS 32 HD1 HIS 32 -3.343 -4.484 8.284
219 HD2 HIS 32 HD2 HIS 32 0.746 -4.592 7.388
220 HE1 HIS 32 HE1 HIS 32 -2.347 -6.285 9.683
221 HE2 HIS 32 HE2 HIS 32 0.144 -6.352 9.109
222 H SER 33 H SER 33 -1.118 -2.759 9.558
223 HA SER 33 HA SER 33 0.426 -0.998 10.791
224 1HB SER 33 1HB SER 33 1.152 -3.985 10.453
225 2HB SER 33 2HB SER 33 1.399 -2.983 11.922
226 HG SER 33 HG SER 33 -0.450 -3.902 12.393
227 H ALA 34 H ALA 34 1.110 -1.970 7.698
228 HA ALA 34 HA ALA 34 3.944 -1.928 7.600
229 1HB ALA 34 1HB ALA 34 1.720 -1.614 5.465
230 2HB ALA 34 2HB ALA 34 2.542 -3.163 5.928
231 3HB ALA 34 3HB ALA 34 3.458 -1.865 5.092
232 H CYS 35 H CYS 35 1.604 0.508 7.992
233 HA CYS 35 HA CYS 35 3.118 2.558 6.530
234 1HB CYS 35 1HB CYS 35 0.196 2.402 7.464
235 2HB CYS 35 2HB CYS 35 0.893 3.719 6.438
236 H ASP 36 H ASP 36 4.215 4.051 7.759
237 HA ASP 36 HA ASP 36 3.337 4.438 10.552
238 1HB ASP 36 1HB ASP 36 5.858 5.267 8.978
239 2HB ASP 36 2HB ASP 36 5.507 5.858 10.632
240 HD2 ASP 36 HD2 ASP 36 6.056 2.907 12.207
241 H LYS 37 H LYS 37 3.295 6.256 7.500
242 HA LYS 37 HA LYS 37 1.529 8.101 8.940
243 1HB LYS 37 1HB LYS 37 3.525 9.378 8.100
244 2HB LYS 37 2HB LYS 37 3.205 8.771 6.476
245 1HG LYS 37 1HG LYS 37 2.338 10.987 6.568
246 2HG LYS 37 2HG LYS 37 0.922 9.899 6.502
247 1HD LYS 37 1HD LYS 37 0.597 10.168 8.983
248 2HD LYS 37 2HD LYS 37 2.081 11.193 9.059
249 1HE LYS 37 1HE LYS 37 0.990 12.892 7.558
250 2HE LYS 37 2HE LYS 37 -0.505 11.870 7.491
251 1HZ LYS 37 1HZ LYS 37 0.721 12.975 9.963
252 2HZ LYS 37 2HZ LYS 37 -0.733 12.109 9.848
253 3HZ LYS 37 3HZ LYS 37 -0.600 13.645 9.133
254 H CYS 38 H CYS 38 -0.267 6.884 8.706
255 HA CYS 38 HA CYS 38 -1.234 6.339 6.012
256 1HB CYS 38 1HB CYS 38 -1.610 4.818 8.017
257 2HB CYS 38 2HB CYS 38 -2.473 6.169 8.826
258 H VAL 39 H VAL 39 -1.834 8.180 4.854
259 HA VAL 39 HA VAL 39 -3.185 10.306 6.367
260 HB VAL 39 HB VAL 39 -1.069 10.373 4.703
261 1HG1 VAL 39 1HG1 VAL 39 -1.769 11.106 2.488
262 2HG1 VAL 39 2HG1 VAL 39 -3.473 10.706 2.821
263 3HG1 VAL 39 3HG1 VAL 39 -2.249 9.361 2.789
264 1HG2 VAL 39 1HG2 VAL 39 -3.381 12.391 4.596
265 2HG2 VAL 39 2HG2 VAL 39 -1.640 12.675 4.197
266 3HG2 VAL 39 3HG2 VAL 39 -2.111 12.309 5.912
267 H CYS 40 H CYS 40 -5.485 10.808 5.669
268 HA CYS 40 HA CYS 40 -6.537 8.969 3.642
269 1HB CYS 40 1HB CYS 40 -7.566 9.278 6.477
270 2HB CYS 40 2HB CYS 40 -8.455 8.454 5.191
271 H ALA 41 H ALA 41 -7.565 10.067 2.240
272 HA ALA 41 HA ALA 41 -8.950 12.528 2.778
273 1HB ALA 41 1HB ALA 41 -7.872 12.143 0.579
274 2HB ALA 41 2HB ALA 41 -9.625 12.545 0.470
275 3HB ALA 41 3HB ALA 41 -9.074 10.850 0.239
276 H TYR 42 H TYR 42 -11.057 12.974 2.793
277 HA TYR 42 HA TYR 42 -12.682 11.036 4.035
278 1HB TYR 42 1HB TYR 42 -14.122 13.147 4.451
279 2HB TYR 42 2HB TYR 42 -12.429 13.122 5.058
280 HD1 TYR 42 HD1 TYR 42 -10.786 14.724 4.273
281 HD2 TYR 42 HD2 TYR 42 -14.564 14.403 2.200
282 HE1 TYR 42 HE1 TYR 42 -10.259 16.726 2.963
283 HE2 TYR 42 HE2 TYR 42 -14.017 16.432 0.923
284 HH TYR 42 HH TYR 42 -12.239 17.802 0.271
285 H SER 43 H SER 43 -12.302 10.781 1.223
286 HA SER 43 HA SER 43 -14.561 11.199 -0.366
287 1HB SER 43 1HB SER 43 -12.513 8.942 -0.578
288 2HB SER 43 2HB SER 43 -13.573 9.556 -1.919
289 HG SER 43 HG SER 43 -11.449 10.386 -1.968
290 H ASN 44 H ASN 44 -15.408 9.035 -1.573
291 HA ASN 44 HA ASN 44 -16.432 7.054 0.300
292 1HB ASN 44 1HB ASN 44 -18.057 8.902 0.204
293 2HB ASN 44 2HB ASN 44 -17.971 8.953 -1.560
294 1HD2 ASN 44 1HD2 ASN 44 -18.986 7.020 -2.752
295 2HD2 ASN 44 2HD2 ASN 44 -20.302 6.225 -1.994
296 HA PRO 45 HA PRO 45 -15.926 5.053 0.308
297 1HB PRO 45 1HB PRO 45 -14.023 3.109 -0.203
298 2HB PRO 45 2HB PRO 45 -15.690 2.937 -0.778
299 1HG PRO 45 1HG PRO 45 -13.319 4.052 -2.383
300 2HG PRO 45 2HG PRO 45 -14.439 2.728 -2.872
301 1HD PRO 45 1HD PRO 45 -14.830 5.363 -3.655
302 2HD PRO 45 2HD PRO 45 -16.250 4.292 -3.246
303 HA PRO 46 HA PRO 46 -12.693 7.645 1.570
304 1HB PRO 46 1HB PRO 46 -11.555 6.553 3.824
305 2HB PRO 46 2HB PRO 46 -13.279 7.101 3.800
306 1HG PRO 46 1HG PRO 46 -12.245 4.247 3.313
307 2HG PRO 46 2HG PRO 46 -13.503 4.818 4.501
308 1HD PRO 46 1HD PRO 46 -14.158 3.811 2.001
309 2HD PRO 46 2HD PRO 46 -15.078 5.282 2.732
310 H GLN 47 H GLN 47 -10.333 8.043 1.571
311 HA GLN 47 HA GLN 47 -8.938 5.889 0.099
312 1HB GLN 47 1HB GLN 47 -8.563 8.920 -0.077
313 2HB GLN 47 2HB GLN 47 -7.693 7.693 -1.032
314 1HG GLN 47 1HG GLN 47 -10.715 8.247 -1.236
315 2HG GLN 47 2HG GLN 47 -9.456 8.969 -2.307
316 1HE2 GLN 47 1HE2 GLN 47 -10.858 5.818 -1.253
317 2HE2 GLN 47 2HE2 GLN 47 -10.593 5.026 -2.783
318 H CYS 48 H CYS 48 -6.922 5.418 0.850
319 HA CYS 48 HA CYS 48 -5.684 7.171 2.798
320 1HB CYS 48 1HB CYS 48 -6.456 4.217 3.202
321 2HB CYS 48 2HB CYS 48 -5.253 5.082 4.239
322 H GLN 49 H GLN 49 -3.591 7.162 2.606
323 HA GLN 49 HA GLN 49 -2.321 5.163 0.873
324 1HB GLN 49 1HB GLN 49 -2.193 8.187 0.916
325 2HB GLN 49 2HB GLN 49 -0.736 7.265 0.366
326 1HG GLN 49 1HG GLN 49 -2.258 6.064 -1.345
327 2HG GLN 49 2HG GLN 49 -3.540 7.261 -0.905
328 1HE2 GLN 49 1HE2 GLN 49 -2.799 9.594 -0.966
329 2HE2 GLN 49 2HE2 GLN 49 -1.624 10.096 -2.170
330 H CYS 50 H CYS 50 -0.345 4.611 1.232
331 HA CYS 50 HA CYS 50 0.527 4.745 4.029
332 1HB CYS 50 1HB CYS 50 0.118 2.566 2.524
333 2HB CYS 50 2HB CYS 50 1.614 3.019 1.678
334 H TYR 51 H TYR 51 1.159 6.962 3.700
335 HA TYR 51 HA TYR 51 2.928 7.933 1.785
336 1HB TYR 51 1HB TYR 51 1.740 8.954 4.340
337 2HB TYR 51 2HB TYR 51 3.382 9.578 4.095
338 HD1 TYR 51 HD1 TYR 51 0.233 8.938 2.110
339 HD2 TYR 51 HD2 TYR 51 3.529 11.644 2.827
340 HE1 TYR 51 HE1 TYR 51 -0.592 10.454 0.377
341 HE2 TYR 51 HE2 TYR 51 2.604 13.192 1.273
342 HH TYR 51 HH TYR 51 -0.456 12.530 -0.527
343 H ASP 52 H ASP 52 3.612 6.952 5.029
344 HA ASP 52 HA ASP 52 6.526 7.026 4.424
345 1HB ASP 52 1HB ASP 52 5.828 8.634 6.191
346 2HB ASP 52 2HB ASP 52 5.139 7.292 7.158
347 HD2 ASP 52 HD2 ASP 52 9.147 7.273 6.704
348 H THR 53 H THR 53 6.781 5.095 3.515
349 HA THR 53 HA THR 53 7.282 3.041 5.404
350 HB THR 53 HB THR 53 4.928 2.489 4.663
351 HG1 THR 53 HG1 THR 53 5.623 0.650 5.191
352 1HG2 THR 53 1HG2 THR 53 4.624 1.524 2.397
353 2HG2 THR 53 2HG2 THR 53 6.338 1.861 1.969
354 3HG2 THR 53 3HG2 THR 53 5.192 3.228 2.256
355 H HIS 54 H HIS 54 8.732 1.415 4.382
356 HA HIS 54 HA HIS 54 9.954 2.225 1.858
357 1HB HIS 54 1HB HIS 54 10.985 3.389 3.935
358 2HB HIS 54 2HB HIS 54 11.442 1.784 4.556
359 HD1 HIS 54 HD1 HIS 54 12.955 4.520 3.686
360 HD2 HIS 54 HD2 HIS 54 13.283 0.773 1.857
361 HE1 HIS 54 HE1 HIS 54 15.163 4.479 2.527
362 HE2 HIS 54 HE2 HIS 54 15.355 2.188 1.415
363 H LYS 55 H LYS 55 8.558 -0.140 3.586
364 HA LYS 55 HA LYS 55 10.478 -2.239 2.924
365 1HB LYS 55 1HB LYS 55 10.137 -2.991 5.307
366 2HB LYS 55 2HB LYS 55 10.834 -1.355 5.191
367 1HG LYS 55 1HG LYS 55 7.879 -1.204 5.341
368 2HG LYS 55 2HG LYS 55 8.539 -2.231 6.643
369 1HD LYS 55 1HD LYS 55 10.077 -0.460 7.378
370 2HD LYS 55 2HD LYS 55 9.577 0.612 6.028
371 1HE LYS 55 1HE LYS 55 7.253 0.744 6.959
372 2HE LYS 55 2HE LYS 55 7.714 -0.399 8.286
373 1HZ LYS 55 1HZ LYS 55 7.794 1.914 8.975
374 2HZ LYS 55 2HZ LYS 55 8.949 2.269 7.785
375 3HZ LYS 55 3HZ LYS 55 9.333 1.201 9.044
376 H PHE 56 H PHE 56 7.756 -1.848 1.560
377 HA PHE 56 HA PHE 56 6.982 -4.618 2.088
378 1HB PHE 56 1HB PHE 56 5.144 -2.309 2.794
379 2HB PHE 56 2HB PHE 56 4.405 -3.641 1.845
380 HD1 PHE 56 HD1 PHE 56 4.519 -5.990 2.615
381 HD2 PHE 56 HD2 PHE 56 5.773 -2.746 5.144
382 HE1 PHE 56 HE1 PHE 56 4.281 -7.438 4.588
383 HE2 PHE 56 HE2 PHE 56 5.510 -4.175 7.112
384 HZ PHE 56 HZ PHE 56 4.757 -6.536 6.860
385 H CYS 57 H CYS 57 6.677 -5.753 0.418
386 HA CYS 57 HA CYS 57 5.397 -4.577 -1.948
387 1HB CYS 57 1HB CYS 57 7.989 -4.539 -2.007
388 2HB CYS 57 2HB CYS 57 7.951 -6.320 -1.962
389 H TYR 58 H TYR 58 3.528 -5.713 -1.410
390 HA TYR 58 HA TYR 58 3.823 -8.614 -0.936
391 1HB TYR 58 1HB TYR 58 2.611 -6.569 0.607
392 2HB TYR 58 2HB TYR 58 1.215 -7.363 -0.194
393 HD1 TYR 58 HD1 TYR 58 4.381 -8.030 1.684
394 HD2 TYR 58 HD2 TYR 58 0.447 -9.498 0.711
395 HE1 TYR 58 HE1 TYR 58 4.663 -9.847 3.276
396 HE2 TYR 58 HE2 TYR 58 0.737 -11.316 2.277
397 HH TYR 58 HH TYR 58 3.828 -12.005 3.845
398 H LYS 59 H LYS 59 2.177 -9.978 -1.435
399 HA LYS 59 HA LYS 59 0.713 -9.953 -3.822
400 1HB LYS 59 1HB LYS 59 0.602 -11.585 -1.263
401 2HB LYS 59 2HB LYS 59 -0.756 -11.663 -2.402
402 1HG LYS 59 1HG LYS 59 0.522 -13.480 -2.905
403 2HG LYS 59 2HG LYS 59 0.784 -12.349 -4.267
404 1HD LYS 59 1HD LYS 59 2.792 -12.605 -1.926
405 2HD LYS 59 2HD LYS 59 2.737 -13.817 -3.232
406 1HE LYS 59 1HE LYS 59 3.337 -10.829 -3.734
407 2HE LYS 59 2HE LYS 59 4.530 -12.175 -3.639
408 1HZ LYS 59 1HZ LYS 59 3.988 -11.685 -5.875
409 2HZ LYS 59 2HZ LYS 59 2.327 -11.902 -5.610
410 3HZ LYS 59 3HZ LYS 59 3.380 -13.223 -5.491
411 H ALA 60 H ALA 60 -1.682 -10.034 -4.029
412 HA ALA 60 HA ALA 60 -2.904 -7.757 -2.739
413 1HB ALA 60 1HB ALA 60 -3.891 -9.800 -4.786
414 2HB ALA 60 2HB ALA 60 -3.172 -8.200 -5.162
415 3HB ALA 60 3HB ALA 60 -4.768 -8.290 -4.323
416 H CYS 61 H CYS 61 -5.062 -7.908 -1.892
417 HA CYS 61 HA CYS 61 -5.268 -9.715 0.309
418 1HB CYS 61 1HB CYS 61 -7.161 -7.641 -0.925
419 2HB CYS 61 2HB CYS 61 -7.786 -8.785 0.286
420 H HIS 62 H HIS 62 -7.555 -9.311 -2.341
421 HA HIS 62 HA HIS 62 -8.297 -12.069 -2.371
422 1HB HIS 62 1HB HIS 62 -9.640 -11.553 -4.322
423 2HB HIS 62 2HB HIS 62 -9.867 -10.349 -3.026
424 HD1 HIS 62 HD1 HIS 62 -10.409 -10.189 -6.109
425 HD2 HIS 62 HD2 HIS 62 -7.517 -8.057 -3.948
426 HE1 HIS 62 HE1 HIS 62 -10.056 -8.005 -7.280
427 HE2 HIS 62 HE2 HIS 62 -8.338 -6.722 -5.910
428 H ASN 63 H ASN 63 -7.859 -13.681 -4.097
429 HA ASN 63 HA ASN 63 -6.108 -13.333 -6.150
430 1HB ASN 63 1HB ASN 63 -4.217 -14.844 -5.162
431 2HB ASN 63 2HB ASN 63 -4.188 -13.095 -4.848
432 1HD2 ASN 63 1HD2 ASN 63 -4.165 -12.405 -2.542
433 2HD2 ASN 63 2HD2 ASN 63 -4.259 -13.551 -1.295
434 H SER 64 H SER 64 -6.207 -15.981 -3.843
435 HA SER 64 HA SER 64 -6.999 -17.724 -6.072
436 1HB SER 64 1HB SER 64 -4.988 -18.041 -4.442
437 2HB SER 64 2HB SER 64 -6.176 -18.689 -3.276
438 HG SER 64 HG SER 64 -5.118 -20.236 -4.704
439 H GLU 65 H GLU 65 -9.178 -16.366 -5.473
440 HA GLU 65 HA GLU 65 -11.087 -17.715 -3.905
441 1HB GLU 65 1HB GLU 65 -11.565 -15.952 -6.343
442 2HB GLU 65 2HB GLU 65 -12.821 -16.638 -5.268
443 1HG GLU 65 1HG GLU 65 -12.481 -14.333 -4.579
444 2HG GLU 65 2HG GLU 65 -11.894 -15.432 -3.283
445 HE2 GLU 65 HE2 GLU 65 -10.773 -13.876 -6.173
446 H ILE 66 H ILE 66 -10.168 -19.826 -4.480
447 HA ILE 66 HA ILE 66 -12.039 -21.296 -6.113
448 HB ILE 66 HB ILE 66 -10.211 -22.676 -7.155
449 1HG1 ILE 66 1HG1 ILE 66 -8.341 -20.302 -6.547
450 2HG1 ILE 66 2HG1 ILE 66 -8.338 -21.836 -5.608
451 1HG2 ILE 66 1HG2 ILE 66 -10.166 -19.767 -8.145
452 2HG2 ILE 66 2HG2 ILE 66 -11.538 -20.913 -8.415
453 3HG2 ILE 66 3HG2 ILE 66 -9.914 -21.267 -9.104
454 1HD1 ILE 66 1HD1 ILE 66 -7.745 -21.552 -8.624
455 2HD1 ILE 66 2HD1 ILE 66 -7.876 -23.115 -7.734
456 3HD1 ILE 66 3HD1 ILE 66 -6.575 -21.942 -7.312
457 H GLU 67 H GLU 67 -11.562 -23.799 -5.716
458 HA GLU 67 HA GLU 67 -10.058 -24.434 -3.464
459 1HB GLU 67 1HB GLU 67 -11.906 -25.365 -2.140
460 2HB GLU 67 2HB GLU 67 -12.111 -23.587 -2.248
461 1HG GLU 67 1HG GLU 67 -13.621 -25.636 -4.041
462 2HG GLU 67 2HG GLU 67 -14.259 -24.986 -2.490
463 HE2 GLU 67 HE2 GLU 67 -14.833 -21.799 -3.799
Start of MODEL 16
1 1H GLY 1 1H GLY 1 -2.753 -12.705 1.084
2 2H GLY 1 2H GLY 1 -2.491 -14.266 0.462
3 3H GLY 1 3H GLY 1 -1.992 -13.885 2.041
4 1HA GLY 1 1HA GLY 1 -4.276 -13.505 2.671
5 2HA GLY 1 2HA GLY 1 -4.740 -14.077 1.017
6 H ASP 2 H ASP 2 -4.020 -14.991 4.241
7 HA ASP 2 HA ASP 2 -4.130 -17.850 3.673
8 1HB ASP 2 1HB ASP 2 -1.590 -16.413 4.761
9 2HB ASP 2 2HB ASP 2 -1.862 -18.184 4.901
10 HD2 ASP 2 HD2 ASP 2 -0.411 -16.748 1.560
11 H ASP 3 H ASP 3 -5.813 -16.076 5.075
12 HA ASP 3 HA ASP 3 -6.995 -15.929 6.868
13 1HB ASP 3 1HB ASP 3 -5.634 -18.410 7.971
14 2HB ASP 3 2HB ASP 3 -7.256 -17.753 8.434
15 HD2 ASP 3 HD2 ASP 3 -6.892 -20.144 5.371
16 H VAL 4 H VAL 4 -5.089 -14.199 6.860
17 HA VAL 4 HA VAL 4 -4.776 -13.572 9.625
18 HB VAL 4 HB VAL 4 -2.818 -14.945 9.178
19 1HG1 VAL 4 1HG1 VAL 4 -2.036 -12.811 7.070
20 2HG1 VAL 4 2HG1 VAL 4 -2.493 -14.523 6.740
21 3HG1 VAL 4 3HG1 VAL 4 -0.997 -14.151 7.657
22 1HG2 VAL 4 1HG2 VAL 4 -2.752 -13.015 10.833
23 2HG2 VAL 4 2HG2 VAL 4 -2.034 -11.970 9.545
24 3HG2 VAL 4 3HG2 VAL 4 -1.151 -13.420 10.125
25 H LYS 5 H LYS 5 -4.673 -11.347 9.945
26 HA LYS 5 HA LYS 5 -5.377 -9.683 7.699
27 1HB LYS 5 1HB LYS 5 -5.017 -9.110 10.694
28 2HB LYS 5 2HB LYS 5 -5.605 -7.913 9.493
29 1HG LYS 5 1HG LYS 5 -7.582 -9.307 8.996
30 2HG LYS 5 2HG LYS 5 -7.020 -10.572 10.129
31 1HD LYS 5 1HD LYS 5 -7.158 -8.932 12.042
32 2HD LYS 5 2HD LYS 5 -7.693 -7.653 10.899
33 1HE LYS 5 1HE LYS 5 -9.622 -8.639 12.160
34 2HE LYS 5 2HE LYS 5 -9.776 -8.935 10.378
35 1HZ LYS 5 1HZ LYS 5 -8.957 -11.132 10.692
36 2HZ LYS 5 2HZ LYS 5 -10.272 -10.867 11.731
37 3HZ LYS 5 3HZ LYS 5 -8.690 -10.875 12.350
38 H SER 6 H SER 6 -3.109 -10.558 7.097
39 HA SER 6 HA SER 6 -0.828 -8.982 7.719
40 1HB SER 6 1HB SER 6 0.088 -9.839 5.493
41 2HB SER 6 2HB SER 6 -0.434 -11.084 6.677
42 HG SER 6 HG SER 6 -1.104 -11.461 4.542
43 H ALA 7 H ALA 7 0.301 -7.469 6.261
44 HA ALA 7 HA ALA 7 -1.427 -5.423 5.251
45 1HB ALA 7 1HB ALA 7 0.850 -4.899 6.163
46 2HB ALA 7 2HB ALA 7 0.719 -4.394 4.439
47 3HB ALA 7 3HB ALA 7 1.580 -5.914 4.871
48 H CYS 8 H CYS 8 -2.103 -5.002 3.246
49 HA CYS 8 HA CYS 8 -1.239 -6.750 1.001
50 1HB CYS 8 1HB CYS 8 -3.989 -5.714 1.778
51 2HB CYS 8 2HB CYS 8 -3.600 -6.143 0.079
52 H CYS 9 H CYS 9 -1.332 -5.814 -1.112
53 HA CYS 9 HA CYS 9 -1.543 -2.896 -1.256
54 1HB CYS 9 1HB CYS 9 0.863 -3.471 -0.674
55 2HB CYS 9 2HB CYS 9 0.904 -4.568 -2.077
56 H ASP 10 H ASP 10 -2.571 -2.373 -3.271
57 HA ASP 10 HA ASP 10 -3.095 -4.609 -5.043
58 1HB ASP 10 1HB ASP 10 -3.821 -1.661 -5.346
59 2HB ASP 10 2HB ASP 10 -4.439 -2.955 -6.348
60 HD2 ASP 10 HD2 ASP 10 -6.617 -4.155 -4.044
61 H THR 11 H THR 11 -1.073 -1.636 -5.266
62 HA THR 11 HA THR 11 0.309 -2.641 -7.626
63 HB THR 11 HB THR 11 -1.029 0.128 -7.634
64 HG1 THR 11 HG1 THR 11 -2.522 -0.655 -9.051
65 1HG2 THR 11 1HG2 THR 11 0.107 -1.687 -9.877
66 2HG2 THR 11 2HG2 THR 11 0.891 -0.191 -9.226
67 3HG2 THR 11 3HG2 THR 11 -0.643 -0.074 -10.131
68 H CYS 12 H CYS 12 2.369 -1.793 -7.690
69 HA CYS 12 HA CYS 12 3.170 0.371 -5.924
70 1HB CYS 12 1HB CYS 12 4.552 -1.131 -4.577
71 2HB CYS 12 2HB CYS 12 2.839 -1.708 -4.602
72 H LEU 13 H LEU 13 5.417 0.687 -5.820
73 HA LEU 13 HA LEU 13 6.837 0.247 -8.348
74 1HB LEU 13 1HB LEU 13 5.199 2.060 -8.647
75 2HB LEU 13 2HB LEU 13 5.719 2.843 -7.129
76 HG LEU 13 HG LEU 13 6.376 3.967 -9.271
77 1HD1 LEU 13 1HD1 LEU 13 7.575 4.377 -7.112
78 2HD1 LEU 13 2HD1 LEU 13 8.560 4.702 -8.592
79 3HD1 LEU 13 3HD1 LEU 13 8.857 3.214 -7.626
80 1HD2 LEU 13 1HD2 LEU 13 6.910 1.933 -10.637
81 2HD2 LEU 13 2HD2 LEU 13 8.403 1.676 -9.652
82 3HD2 LEU 13 3HD2 LEU 13 8.234 3.157 -10.654
83 H CYS 14 H CYS 14 8.777 -0.260 -7.763
84 HA CYS 14 HA CYS 14 9.952 0.760 -5.307
85 1HB CYS 14 1HB CYS 14 10.903 -1.487 -7.102
86 2HB CYS 14 2HB CYS 14 11.733 -0.905 -5.646
87 H THR 15 H THR 15 11.781 1.993 -5.233
88 HA THR 15 HA THR 15 12.320 3.406 -7.717
89 HB THR 15 HB THR 15 13.847 4.791 -6.424
90 HG1 THR 15 HG1 THR 15 14.313 4.287 -4.399
91 1HG2 THR 15 1HG2 THR 15 12.026 5.845 -5.053
92 2HG2 THR 15 2HG2 THR 15 11.043 4.344 -5.174
93 3HG2 THR 15 3HG2 THR 15 11.400 5.296 -6.657
94 H ARG 16 H ARG 16 14.220 3.439 -8.827
95 HA ARG 16 HA ARG 16 16.116 1.265 -8.339
96 1HB ARG 16 1HB ARG 16 16.100 3.411 -10.505
97 2HB ARG 16 2HB ARG 16 17.240 2.020 -10.416
98 1HG ARG 16 1HG ARG 16 15.333 0.435 -10.532
99 2HG ARG 16 2HG ARG 16 14.205 1.824 -10.775
100 1HD ARG 16 1HD ARG 16 15.542 2.473 -12.847
101 2HD ARG 16 2HD ARG 16 16.512 0.944 -12.655
102 HE ARG 16 HE ARG 16 13.872 0.068 -12.498
103 1HH1 ARG 16 1HH1 ARG 16 15.614 2.090 -14.868
104 2HH1 ARG 16 2HH1 ARG 16 14.492 1.771 -16.148
105 1HH2 ARG 16 1HH2 ARG 16 12.404 -0.351 -14.210
106 2HH2 ARG 16 2HH2 ARG 16 12.659 0.342 -15.784
107 H SER 17 H SER 17 15.770 3.699 -6.534
108 HA SER 17 HA SER 17 18.234 5.114 -6.567
109 1HB SER 17 1HB SER 17 17.564 6.109 -4.424
110 2HB SER 17 2HB SER 17 16.224 6.130 -5.580
111 HG SER 17 HG SER 17 16.567 4.593 -3.250
112 H GLN 18 H GLN 18 19.623 5.163 -4.508
113 HA GLN 18 HA GLN 18 20.194 2.555 -3.332
114 1HB GLN 18 1HB GLN 18 21.972 4.308 -5.120
115 2HB GLN 18 2HB GLN 18 22.687 3.140 -3.972
116 1HG GLN 18 1HG GLN 18 20.832 2.389 -6.351
117 2HG GLN 18 2HG GLN 18 22.620 2.275 -6.322
118 1HE2 GLN 18 1HE2 GLN 18 19.617 0.863 -5.022
119 2HE2 GLN 18 2HE2 GLN 18 20.385 -0.613 -4.439
120 HA PRO 19 HA PRO 19 20.090 2.233 -1.120
121 1HB PRO 19 1HB PRO 19 18.451 3.017 1.037
122 2HB PRO 19 2HB PRO 19 20.273 2.902 1.116
123 1HG PRO 19 1HG PRO 19 18.595 5.396 0.520
124 2HG PRO 19 2HG PRO 19 19.894 5.197 1.771
125 1HD PRO 19 1HD PRO 19 20.456 6.288 -0.679
126 2HD PRO 19 2HD PRO 19 21.627 5.107 0.074
127 HA PRO 20 HA PRO 20 16.252 2.333 -3.346
128 1HB PRO 20 1HB PRO 20 15.307 -0.202 -3.005
129 2HB PRO 20 2HB PRO 20 16.924 0.070 -3.758
130 1HG PRO 20 1HG PRO 20 16.336 -0.536 -0.801
131 2HG PRO 20 2HG PRO 20 17.452 -1.445 -1.902
132 1HD PRO 20 1HD PRO 20 18.313 0.604 -0.219
133 2HD PRO 20 2HD PRO 20 19.061 0.341 -1.874
134 H THR 21 H THR 21 13.851 2.031 -3.171
135 HA THR 21 HA THR 21 12.672 1.923 -0.502
136 HB THR 21 HB THR 21 13.469 4.385 -1.836
137 HG1 THR 21 HG1 THR 21 12.890 5.281 0.023
138 1HG2 THR 21 1HG2 THR 21 11.269 4.372 -3.006
139 2HG2 THR 21 2HG2 THR 21 11.395 5.704 -1.824
140 3HG2 THR 21 3HG2 THR 21 10.408 4.257 -1.418
141 H CYS 22 H CYS 22 10.354 1.665 -0.656
142 HA CYS 22 HA CYS 22 9.277 1.484 -3.357
143 1HB CYS 22 1HB CYS 22 10.460 -0.775 -2.726
144 2HB CYS 22 2HB CYS 22 9.096 -1.016 -1.598
145 H ARG 23 H ARG 23 6.990 1.158 -3.431
146 HA ARG 23 HA ARG 23 5.459 1.550 -1.034
147 1HB ARG 23 1HB ARG 23 6.862 3.836 -1.784
148 2HB ARG 23 2HB ARG 23 5.422 4.016 -2.799
149 1HG ARG 23 1HG ARG 23 4.108 3.666 -0.439
150 2HG ARG 23 2HG ARG 23 5.698 4.017 0.253
151 1HD ARG 23 1HD ARG 23 4.406 6.081 0.108
152 2HD ARG 23 2HD ARG 23 5.687 6.186 -1.194
153 HE ARG 23 HE ARG 23 3.371 4.914 -2.291
154 1HH1 ARG 23 1HH1 ARG 23 4.226 8.109 -0.976
155 2HH1 ARG 23 2HH1 ARG 23 3.151 8.985 -2.003
156 1HH2 ARG 23 1HH2 ARG 23 1.967 6.021 -3.651
157 2HH2 ARG 23 2HH2 ARG 23 1.786 7.745 -3.585
158 H CYS 24 H CYS 24 3.248 1.584 -1.398
159 HA CYS 24 HA CYS 24 2.309 0.651 -3.918
160 1HB CYS 24 1HB CYS 24 0.771 1.485 -1.400
161 2HB CYS 24 2HB CYS 24 0.078 0.578 -2.778
162 H VAL 25 H VAL 25 1.771 1.904 -5.632
163 HA VAL 25 HA VAL 25 1.252 4.668 -5.458
164 HB VAL 25 HB VAL 25 0.842 4.582 -7.847
165 1HG1 VAL 25 1HG1 VAL 25 3.345 3.013 -6.879
166 2HG1 VAL 25 2HG1 VAL 25 3.147 4.806 -6.840
167 3HG1 VAL 25 3HG1 VAL 25 3.191 3.934 -8.417
168 1HG2 VAL 25 1HG2 VAL 25 1.193 2.473 -9.103
169 2HG2 VAL 25 2HG2 VAL 25 -0.199 2.267 -8.002
170 3HG2 VAL 25 3HG2 VAL 25 1.408 1.541 -7.597
171 H ASP 26 H ASP 26 -0.649 1.827 -5.244
172 HA ASP 26 HA ASP 26 -3.157 3.344 -5.582
173 1HB ASP 26 1HB ASP 26 -2.706 1.099 -6.820
174 2HB ASP 26 2HB ASP 26 -2.938 0.301 -5.221
175 HD2 ASP 26 HD2 ASP 26 -5.064 0.524 -4.283
176 H VAL 27 H VAL 27 -4.836 3.079 -3.986
177 HA VAL 27 HA VAL 27 -3.782 3.206 -1.319
178 HB VAL 27 HB VAL 27 -5.640 4.344 -0.748
179 1HG1 VAL 27 1HG1 VAL 27 -6.155 5.947 -2.450
180 2HG1 VAL 27 2HG1 VAL 27 -5.800 4.827 -3.787
181 3HG1 VAL 27 3HG1 VAL 27 -4.451 5.448 -2.755
182 1HG2 VAL 27 1HG2 VAL 27 -7.842 4.207 -2.011
183 2HG2 VAL 27 2HG2 VAL 27 -7.434 2.704 -1.145
184 3HG2 VAL 27 3HG2 VAL 27 -7.202 2.807 -2.938
185 H ARG 28 H ARG 28 -5.110 2.263 0.522
186 HA ARG 28 HA ARG 28 -6.358 -0.290 -0.186
187 1HB ARG 28 1HB ARG 28 -4.707 0.525 2.246
188 2HB ARG 28 2HB ARG 28 -5.854 -0.855 2.323
189 1HG ARG 28 1HG ARG 28 -3.419 -0.607 0.462
190 2HG ARG 28 2HG ARG 28 -3.567 -1.651 1.933
191 1HD ARG 28 1HD ARG 28 -5.241 -1.984 -0.647
192 2HD ARG 28 2HD ARG 28 -3.845 -3.002 -0.130
193 HE ARG 28 HE ARG 28 -5.277 -3.279 2.070
194 1HH1 ARG 28 1HH1 ARG 28 -6.769 -2.953 -1.176
195 2HH1 ARG 28 2HH1 ARG 28 -8.281 -3.619 -0.648
196 1HH2 ARG 28 1HH2 ARG 28 -7.234 -4.085 2.700
197 2HH2 ARG 28 2HH2 ARG 28 -8.574 -4.251 1.579
198 H GLU 29 H GLU 29 -8.092 -0.875 1.192
199 HA GLU 29 HA GLU 29 -10.085 0.979 1.484
200 1HB GLU 29 1HB GLU 29 -9.942 -1.601 1.153
201 2HB GLU 29 2HB GLU 29 -9.964 -1.707 2.928
202 1HG GLU 29 1HG GLU 29 -12.081 -0.142 1.242
203 2HG GLU 29 2HG GLU 29 -12.192 -1.906 1.556
204 HE2 GLU 29 HE2 GLU 29 -12.827 -1.582 4.961
205 H SER 30 H SER 30 -7.617 0.189 3.608
206 HA SER 30 HA SER 30 -8.388 2.045 5.673
207 1HB SER 30 1HB SER 30 -8.287 -1.011 6.195
208 2HB SER 30 2HB SER 30 -8.010 0.158 7.530
209 HG SER 30 HG SER 30 -10.168 -0.507 7.408
210 H CYS 31 H CYS 31 -6.537 1.811 7.520
211 HA CYS 31 HA CYS 31 -4.022 1.237 6.081
212 1HB CYS 31 1HB CYS 31 -4.646 3.606 7.100
213 2HB CYS 31 2HB CYS 31 -4.147 2.833 8.663
214 H HIS 32 H HIS 32 -2.782 -0.447 6.767
215 HA HIS 32 HA HIS 32 -3.519 -1.805 9.266
216 1HB HIS 32 1HB HIS 32 -3.374 -3.125 7.199
217 2HB HIS 32 2HB HIS 32 -1.621 -2.667 7.033
218 HD1 HIS 32 HD1 HIS 32 -3.878 -4.123 9.699
219 HD2 HIS 32 HD2 HIS 32 -0.126 -4.829 7.972
220 HE1 HIS 32 HE1 HIS 32 -2.894 -6.073 10.894
221 HE2 HIS 32 HE2 HIS 32 -0.599 -6.494 9.840
222 H SER 33 H SER 33 -1.210 -2.868 10.081
223 HA SER 33 HA SER 33 -0.175 -0.842 11.611
224 1HB SER 33 1HB SER 33 1.055 -3.646 11.211
225 2HB SER 33 2HB SER 33 1.143 -2.637 12.701
226 HG SER 33 HG SER 33 -0.556 -3.847 13.158
227 H ALA 34 H ALA 34 1.407 -2.514 8.817
228 HA ALA 34 HA ALA 34 3.952 -1.458 9.517
229 1HB ALA 34 1HB ALA 34 4.725 -2.821 7.531
230 2HB ALA 34 2HB ALA 34 3.000 -3.175 7.144
231 3HB ALA 34 3HB ALA 34 3.721 -3.776 8.676
232 H CYS 35 H CYS 35 2.351 0.584 9.093
233 HA CYS 35 HA CYS 35 3.646 1.970 6.817
234 1HB CYS 35 1HB CYS 35 1.242 1.665 6.323
235 2HB CYS 35 2HB CYS 35 0.819 2.305 7.969
236 H ASP 36 H ASP 36 4.148 4.259 7.325
237 HA ASP 36 HA ASP 36 4.283 4.815 10.258
238 1HB ASP 36 1HB ASP 36 5.832 6.042 7.900
239 2HB ASP 36 2HB ASP 36 5.676 6.875 9.482
240 HD2 ASP 36 HD2 ASP 36 5.967 3.504 9.034
241 H LYS 37 H LYS 37 3.532 6.713 7.213
242 HA LYS 37 HA LYS 37 1.712 8.277 8.855
243 1HB LYS 37 1HB LYS 37 3.649 9.340 7.539
244 2HB LYS 37 2HB LYS 37 2.805 8.871 6.063
245 1HG LYS 37 1HG LYS 37 2.269 11.158 6.487
246 2HG LYS 37 2HG LYS 37 0.776 10.236 6.840
247 1HD LYS 37 1HD LYS 37 1.248 10.367 9.300
248 2HD LYS 37 2HD LYS 37 2.864 11.074 8.957
249 1HE LYS 37 1HE LYS 37 1.748 13.122 7.972
250 2HE LYS 37 2HE LYS 37 0.136 12.429 8.443
251 1HZ LYS 37 1HZ LYS 37 0.971 13.917 10.102
252 2HZ LYS 37 2HZ LYS 37 2.414 13.033 10.257
253 3HZ LYS 37 3HZ LYS 37 0.937 12.336 10.718
254 H CYS 38 H CYS 38 -0.200 7.077 8.931
255 HA CYS 38 HA CYS 38 -1.477 6.257 6.442
256 1HB CYS 38 1HB CYS 38 -2.109 6.321 9.438
257 2HB CYS 38 2HB CYS 38 -3.326 5.706 8.254
258 H VAL 39 H VAL 39 -2.184 8.094 5.209
259 HA VAL 39 HA VAL 39 -3.881 9.975 6.701
260 HB VAL 39 HB VAL 39 -3.768 11.405 4.805
261 1HG1 VAL 39 1HG1 VAL 39 -1.355 11.883 4.752
262 2HG1 VAL 39 2HG1 VAL 39 -0.968 10.226 5.323
263 3HG1 VAL 39 3HG1 VAL 39 -1.787 11.394 6.453
264 1HG2 VAL 39 1HG2 VAL 39 -2.156 9.198 3.489
265 2HG2 VAL 39 2HG2 VAL 39 -2.383 10.914 2.916
266 3HG2 VAL 39 3HG2 VAL 39 -3.808 9.813 2.987
267 H CYS 40 H CYS 40 -6.197 10.032 6.103
268 HA CYS 40 HA CYS 40 -7.048 8.031 4.129
269 1HB CYS 40 1HB CYS 40 -7.886 8.224 7.031
270 2HB CYS 40 2HB CYS 40 -8.736 7.243 5.822
271 H ALA 41 H ALA 41 -8.159 9.097 2.765
272 HA ALA 41 HA ALA 41 -9.841 11.325 3.399
273 1HB ALA 41 1HB ALA 41 -8.734 11.018 1.195
274 2HB ALA 41 2HB ALA 41 -10.500 11.365 1.125
275 3HB ALA 41 3HB ALA 41 -9.881 9.681 0.842
276 H TYR 42 H TYR 42 -12.017 11.511 3.481
277 HA TYR 42 HA TYR 42 -13.318 9.315 4.676
278 1HB TYR 42 1HB TYR 42 -15.067 11.017 5.213
279 2HB TYR 42 2HB TYR 42 -13.397 11.588 5.568
280 HD1 TYR 42 HD1 TYR 42 -16.236 11.867 3.095
281 HD2 TYR 42 HD2 TYR 42 -12.491 13.521 4.423
282 HE1 TYR 42 HE1 TYR 42 -16.610 13.870 1.695
283 HE2 TYR 42 HE2 TYR 42 -12.916 15.534 3.099
284 HH TYR 42 HH TYR 42 -14.195 16.502 1.531
285 H SER 43 H SER 43 -12.940 9.758 1.674
286 HA SER 43 HA SER 43 -15.145 10.302 0.235
287 1HB SER 43 1HB SER 43 -12.831 8.478 -0.611
288 2HB SER 43 2HB SER 43 -13.809 9.581 -1.689
289 HG SER 43 HG SER 43 -11.768 10.435 -1.076
290 H ASN 44 H ASN 44 -15.362 8.495 -1.859
291 HA ASN 44 HA ASN 44 -16.594 6.097 -0.764
292 1HB ASN 44 1HB ASN 44 -18.207 8.011 -0.807
293 2HB ASN 44 2HB ASN 44 -17.916 8.224 -2.547
294 1HD2 ASN 44 1HD2 ASN 44 -18.344 6.015 -3.857
295 2HD2 ASN 44 2HD2 ASN 44 -19.720 5.103 -3.351
296 HA PRO 45 HA PRO 45 -15.867 4.210 -1.027
297 1HB PRO 45 1HB PRO 45 -13.739 2.522 -1.547
298 2HB PRO 45 2HB PRO 45 -15.280 2.355 -2.400
299 1HG PRO 45 1HG PRO 45 -12.810 3.900 -3.372
300 2HG PRO 45 2HG PRO 45 -13.716 2.636 -4.275
301 1HD PRO 45 1HD PRO 45 -14.206 5.351 -4.609
302 2HD PRO 45 2HD PRO 45 -15.570 4.145 -4.664
303 HA PRO 46 HA PRO 46 -12.979 6.640 1.215
304 1HB PRO 46 1HB PRO 46 -12.416 5.203 3.497
305 2HB PRO 46 2HB PRO 46 -14.078 5.827 3.166
306 1HG PRO 46 1HG PRO 46 -12.999 3.016 2.552
307 2HG PRO 46 2HG PRO 46 -14.510 3.485 3.458
308 1HD PRO 46 1HD PRO 46 -14.479 2.828 0.754
309 2HD PRO 46 2HD PRO 46 -15.621 4.156 1.441
310 H GLN 47 H GLN 47 -10.646 6.837 1.913
311 HA GLN 47 HA GLN 47 -9.026 4.839 0.445
312 1HB GLN 47 1HB GLN 47 -8.630 7.876 0.496
313 2HB GLN 47 2HB GLN 47 -7.708 6.677 -0.479
314 1HG GLN 47 1HG GLN 47 -10.708 7.312 -0.916
315 2HG GLN 47 2HG GLN 47 -9.354 8.166 -1.733
316 1HE2 GLN 47 1HE2 GLN 47 -10.832 4.933 -1.317
317 2HE2 GLN 47 2HE2 GLN 47 -10.244 4.318 -2.844
318 H CYS 48 H CYS 48 -6.900 4.589 1.245
319 HA CYS 48 HA CYS 48 -5.983 6.317 3.364
320 1HB CYS 48 1HB CYS 48 -6.467 3.317 3.643
321 2HB CYS 48 2HB CYS 48 -5.234 4.189 4.646
322 H GLN 49 H GLN 49 -3.973 6.712 2.988
323 HA GLN 49 HA GLN 49 -2.455 4.964 1.175
324 1HB GLN 49 1HB GLN 49 -3.000 7.965 1.205
325 2HB GLN 49 2HB GLN 49 -1.465 7.326 0.450
326 1HG GLN 49 1HG GLN 49 -2.878 5.889 -1.058
327 2HG GLN 49 2HG GLN 49 -4.354 6.636 -0.323
328 1HE2 GLN 49 1HE2 GLN 49 -5.082 8.524 -1.354
329 2HE2 GLN 49 2HE2 GLN 49 -4.325 9.044 -2.843
330 H CYS 50 H CYS 50 -0.425 4.544 1.717
331 HA CYS 50 HA CYS 50 0.563 5.700 4.239
332 1HB CYS 50 1HB CYS 50 0.829 3.140 3.641
333 2HB CYS 50 2HB CYS 50 2.099 3.684 2.508
334 H TYR 51 H TYR 51 0.898 7.739 3.750
335 HA TYR 51 HA TYR 51 2.050 8.789 1.436
336 1HB TYR 51 1HB TYR 51 1.233 9.829 4.112
337 2HB TYR 51 2HB TYR 51 2.752 10.608 3.584
338 HD1 TYR 51 HD1 TYR 51 2.305 12.696 2.376
339 HD2 TYR 51 HD2 TYR 51 -0.410 9.351 1.914
340 HE1 TYR 51 HE1 TYR 51 1.089 13.908 0.715
341 HE2 TYR 51 HE2 TYR 51 -1.587 10.557 0.191
342 HH TYR 51 HH TYR 51 -1.574 12.364 -1.182
343 H ASP 52 H ASP 52 3.603 7.458 4.105
344 HA ASP 52 HA ASP 52 6.242 8.529 3.385
345 1HB ASP 52 1HB ASP 52 5.569 8.260 5.838
346 2HB ASP 52 2HB ASP 52 5.514 6.470 5.569
347 HD2 ASP 52 HD2 ASP 52 8.778 6.470 6.573
348 H THR 53 H THR 53 8.039 7.237 2.768
349 HA THR 53 HA THR 53 7.474 5.093 1.012
350 HB THR 53 HB THR 53 10.065 4.852 1.061
351 HG1 THR 53 HG1 THR 53 11.114 6.430 2.099
352 1HG2 THR 53 1HG2 THR 53 8.716 7.537 0.294
353 2HG2 THR 53 2HG2 THR 53 8.800 6.056 -0.728
354 3HG2 THR 53 3HG2 THR 53 10.304 6.940 -0.307
355 H HIS 54 H HIS 54 8.529 2.891 1.147
356 HA HIS 54 HA HIS 54 9.090 2.002 3.819
357 1HB HIS 54 1HB HIS 54 6.490 1.676 3.342
358 2HB HIS 54 2HB HIS 54 7.000 0.518 2.076
359 HD1 HIS 54 HD1 HIS 54 6.123 -1.500 2.976
360 HD2 HIS 54 HD2 HIS 54 8.238 0.546 5.953
361 HE1 HIS 54 HE1 HIS 54 6.185 -2.997 4.950
362 HE2 HIS 54 HE2 HIS 54 7.474 -1.741 6.776
363 H LYS 55 H LYS 55 9.196 -0.792 2.868
364 HA LYS 55 HA LYS 55 10.869 -0.653 0.502
365 1HB LYS 55 1HB LYS 55 12.743 -1.741 1.697
366 2HB LYS 55 2HB LYS 55 12.417 -0.064 2.245
367 1HG LYS 55 1HG LYS 55 11.162 -0.940 4.238
368 2HG LYS 55 2HG LYS 55 11.594 -2.622 3.756
369 1HD LYS 55 1HD LYS 55 13.597 -0.334 4.309
370 2HD LYS 55 2HD LYS 55 13.076 -1.536 5.540
371 1HE LYS 55 1HE LYS 55 14.071 -3.395 4.224
372 2HE LYS 55 2HE LYS 55 14.536 -2.255 2.895
373 1HZ LYS 55 1HZ LYS 55 15.467 -2.090 5.710
374 2HZ LYS 55 2HZ LYS 55 15.905 -1.056 4.442
375 3HZ LYS 55 3HZ LYS 55 16.352 -2.692 4.394
376 H PHE 56 H PHE 56 8.409 -1.767 0.449
377 HA PHE 56 HA PHE 56 9.024 -4.480 -0.030
378 1HB PHE 56 1HB PHE 56 8.322 -4.078 2.637
379 2HB PHE 56 2HB PHE 56 6.674 -4.163 1.933
380 HD1 PHE 56 HD1 PHE 56 10.030 -5.905 1.954
381 HD2 PHE 56 HD2 PHE 56 5.759 -6.350 1.610
382 HE1 PHE 56 HE1 PHE 56 10.279 -8.350 1.926
383 HE2 PHE 56 HE2 PHE 56 6.010 -8.789 1.596
384 HZ PHE 56 HZ PHE 56 8.276 -9.813 1.746
385 H CYS 57 H CYS 57 6.841 -5.571 -0.697
386 HA CYS 57 HA CYS 57 4.601 -3.928 -1.131
387 1HB CYS 57 1HB CYS 57 5.811 -3.214 -3.138
388 2HB CYS 57 2HB CYS 57 6.199 -4.907 -3.543
389 H TYR 58 H TYR 58 3.075 -5.218 -0.471
390 HA TYR 58 HA TYR 58 3.377 -8.121 -0.552
391 1HB TYR 58 1HB TYR 58 1.334 -6.199 0.669
392 2HB TYR 58 2HB TYR 58 0.979 -7.934 0.576
393 HD1 TYR 58 HD1 TYR 58 2.375 -9.617 1.800
394 HD2 TYR 58 HD2 TYR 58 3.056 -5.375 2.265
395 HE1 TYR 58 HE1 TYR 58 3.610 -10.040 3.830
396 HE2 TYR 58 HE2 TYR 58 4.357 -5.809 4.251
397 HH TYR 58 HH TYR 58 4.759 -9.122 5.615
398 H LYS 59 H LYS 59 1.626 -9.498 -1.124
399 HA LYS 59 HA LYS 59 0.397 -9.332 -3.613
400 1HB LYS 59 1HB LYS 59 -0.308 -10.928 -1.109
401 2HB LYS 59 2HB LYS 59 -1.025 -11.198 -2.737
402 1HG LYS 59 1HG LYS 59 1.292 -11.686 -3.648
403 2HG LYS 59 2HG LYS 59 1.962 -11.540 -1.992
404 1HD LYS 59 1HD LYS 59 0.357 -13.380 -1.246
405 2HD LYS 59 2HD LYS 59 -0.102 -13.597 -2.976
406 1HE LYS 59 1HE LYS 59 2.306 -14.099 -3.542
407 2HE LYS 59 2HE LYS 59 2.756 -13.870 -1.802
408 1HZ LYS 59 1HZ LYS 59 2.479 -16.159 -2.319
409 2HZ LYS 59 2HZ LYS 59 0.913 -15.916 -2.920
410 3HZ LYS 59 3HZ LYS 59 1.231 -15.685 -1.267
411 H ALA 60 H ALA 60 -1.906 -9.275 -4.102
412 HA ALA 60 HA ALA 60 -3.201 -7.088 -2.820
413 1HB ALA 60 1HB ALA 60 -4.897 -7.427 -4.607
414 2HB ALA 60 2HB ALA 60 -4.085 -8.993 -5.043
415 3HB ALA 60 3HB ALA 60 -3.216 -7.436 -5.263
416 H CYS 61 H CYS 61 -5.045 -6.960 -1.759
417 HA CYS 61 HA CYS 61 -6.270 -9.378 -0.606
418 1HB CYS 61 1HB CYS 61 -6.275 -6.437 0.236
419 2HB CYS 61 2HB CYS 61 -7.609 -7.510 0.732
420 H HIS 62 H HIS 62 -7.624 -10.015 -2.281
421 HA HIS 62 HA HIS 62 -9.693 -8.031 -3.074
422 1HB HIS 62 1HB HIS 62 -8.452 -10.313 -4.717
423 2HB HIS 62 2HB HIS 62 -9.975 -9.518 -5.166
424 HD1 HIS 62 HD1 HIS 62 -8.459 -9.125 -7.318
425 HD2 HIS 62 HD2 HIS 62 -7.710 -6.662 -4.005
426 HE1 HIS 62 HE1 HIS 62 -7.307 -7.076 -8.167
427 HE2 HIS 62 HE2 HIS 62 -6.818 -5.620 -6.148
428 H ASN 63 H ASN 63 -11.854 -8.918 -3.288
429 HA ASN 63 HA ASN 63 -12.432 -10.980 -1.423
430 1HB ASN 63 1HB ASN 63 -14.279 -9.714 -3.536
431 2HB ASN 63 2HB ASN 63 -14.813 -10.744 -2.184
432 1HD2 ASN 63 1HD2 ASN 63 -13.624 -9.825 0.099
433 2HD2 ASN 63 2HD2 ASN 63 -14.007 -8.156 0.306
434 H SER 64 H SER 64 -12.695 -10.806 -4.935
435 HA SER 64 HA SER 64 -12.881 -13.726 -5.097
436 1HB SER 64 1HB SER 64 -12.793 -11.663 -7.360
437 2HB SER 64 2HB SER 64 -13.138 -13.423 -7.549
438 HG SER 64 HG SER 64 -14.684 -11.394 -6.314
439 H GLU 65 H GLU 65 -10.460 -12.896 -3.971
440 HA GLU 65 HA GLU 65 -8.295 -12.846 -5.722
441 1HB GLU 65 1HB GLU 65 -6.876 -13.171 -3.864
442 2HB GLU 65 2HB GLU 65 -8.266 -12.226 -3.303
443 1HG GLU 65 1HG GLU 65 -9.270 -14.464 -2.359
444 2HG GLU 65 2HG GLU 65 -7.681 -15.214 -2.726
445 HE2 GLU 65 HE2 GLU 65 -5.853 -14.089 -1.851
446 H ILE 66 H ILE 66 -10.287 -15.394 -5.087
447 HA ILE 66 HA ILE 66 -8.768 -17.345 -6.545
448 HB ILE 66 HB ILE 66 -9.097 -19.126 -4.808
449 1HG1 ILE 66 1HG1 ILE 66 -9.431 -16.822 -2.792
450 2HG1 ILE 66 2HG1 ILE 66 -10.798 -17.807 -3.412
451 1HG2 ILE 66 1HG2 ILE 66 -7.150 -16.896 -3.968
452 2HG2 ILE 66 2HG2 ILE 66 -6.878 -18.063 -5.310
453 3HG2 ILE 66 3HG2 ILE 66 -7.020 -18.653 -3.617
454 1HD1 ILE 66 1HD1 ILE 66 -8.371 -18.884 -1.832
455 2HD1 ILE 66 2HD1 ILE 66 -9.683 -19.896 -2.542
456 3HD1 ILE 66 3HD1 ILE 66 -10.061 -18.703 -1.246
457 H GLU 67 H GLU 67 -10.189 -19.445 -6.796
458 HA GLU 67 HA GLU 67 -12.856 -19.295 -6.091
459 1HB GLU 67 1HB GLU 67 -13.778 -19.485 -8.396
460 2HB GLU 67 2HB GLU 67 -13.182 -17.837 -8.075
461 1HG GLU 67 1HG GLU 67 -11.633 -20.038 -9.639
462 2HG GLU 67 2HG GLU 67 -12.631 -18.758 -10.415
463 HE2 GLU 67 HE2 GLU 67 -11.999 -16.632 -9.074
Start of MODEL 17
1 1H GLY 1 1H GLY 1 -6.324 -20.884 4.973
2 2H GLY 1 2H GLY 1 -6.226 -19.704 3.759
3 3H GLY 1 3H GLY 1 -7.728 -20.091 4.442
4 1HA GLY 1 1HA GLY 1 -6.883 -19.333 6.591
5 2HA GLY 1 2HA GLY 1 -5.454 -18.694 5.669
6 H ASP 2 H ASP 2 -7.696 -17.339 7.236
7 HA ASP 2 HA ASP 2 -8.144 -15.237 5.328
8 1HB ASP 2 1HB ASP 2 -10.110 -17.370 5.451
9 2HB ASP 2 2HB ASP 2 -10.844 -16.016 6.354
10 HD2 ASP 2 HD2 ASP 2 -9.037 -16.693 3.494
11 H ASP 3 H ASP 3 -7.402 -16.109 8.326
12 HA ASP 3 HA ASP 3 -8.211 -13.523 9.402
13 1HB ASP 3 1HB ASP 3 -9.607 -15.464 10.362
14 2HB ASP 3 2HB ASP 3 -8.088 -16.192 10.990
15 HD2 ASP 3 HD2 ASP 3 -6.998 -15.027 12.517
16 H VAL 4 H VAL 4 -6.134 -13.553 8.020
17 HA VAL 4 HA VAL 4 -3.767 -14.025 9.721
18 HB VAL 4 HB VAL 4 -3.839 -13.668 6.685
19 1HG1 VAL 4 1HG1 VAL 4 -1.524 -14.676 6.867
20 2HG1 VAL 4 2HG1 VAL 4 -1.691 -14.692 8.655
21 3HG1 VAL 4 3HG1 VAL 4 -1.635 -13.135 7.768
22 1HG2 VAL 4 1HG2 VAL 4 -3.387 -16.184 6.603
23 2HG2 VAL 4 2HG2 VAL 4 -5.042 -15.805 7.182
24 3HG2 VAL 4 3HG2 VAL 4 -3.762 -16.283 8.359
25 H LYS 5 H LYS 5 -2.419 -12.135 10.070
26 HA LYS 5 HA LYS 5 -3.850 -9.647 9.479
27 1HB LYS 5 1HB LYS 5 -1.714 -10.434 11.526
28 2HB LYS 5 2HB LYS 5 -2.303 -8.761 11.321
29 1HG LYS 5 1HG LYS 5 -4.665 -9.560 11.757
30 2HG LYS 5 2HG LYS 5 -4.010 -11.176 12.175
31 1HD LYS 5 1HD LYS 5 -2.636 -10.188 13.998
32 2HD LYS 5 2HD LYS 5 -3.129 -8.529 13.504
33 1HE LYS 5 1HE LYS 5 -5.524 -9.067 14.097
34 2HE LYS 5 2HE LYS 5 -4.998 -10.704 14.674
35 1HZ LYS 5 1HZ LYS 5 -4.020 -8.083 15.686
36 2HZ LYS 5 2HZ LYS 5 -3.538 -9.616 16.239
37 3HZ LYS 5 3HZ LYS 5 -5.144 -9.104 16.446
38 H SER 6 H SER 6 -2.002 -11.145 7.673
39 HA SER 6 HA SER 6 0.271 -9.608 7.107
40 1HB SER 6 1HB SER 6 -1.485 -11.054 5.064
41 2HB SER 6 2HB SER 6 0.181 -10.408 4.777
42 HG SER 6 HG SER 6 0.572 -12.457 5.344
43 H ALA 7 H ALA 7 0.578 -7.575 6.316
44 HA ALA 7 HA ALA 7 -1.568 -6.033 5.230
45 1HB ALA 7 1HB ALA 7 1.489 -5.668 5.023
46 2HB ALA 7 2HB ALA 7 0.437 -4.974 6.309
47 3HB ALA 7 3HB ALA 7 0.270 -4.409 4.607
48 H CYS 8 H CYS 8 -1.693 -5.219 3.009
49 HA CYS 8 HA CYS 8 -0.628 -7.119 1.013
50 1HB CYS 8 1HB CYS 8 -2.804 -7.309 -0.046
51 2HB CYS 8 2HB CYS 8 -2.890 -7.831 1.663
52 H CYS 9 H CYS 9 -0.682 -6.329 -1.230
53 HA CYS 9 HA CYS 9 -1.267 -3.530 -1.608
54 1HB CYS 9 1HB CYS 9 1.048 -3.343 -0.696
55 2HB CYS 9 2HB CYS 9 1.589 -4.633 -1.814
56 H ASP 10 H ASP 10 -2.039 -3.333 -3.729
57 HA ASP 10 HA ASP 10 -1.831 -5.683 -5.431
58 1HB ASP 10 1HB ASP 10 -3.400 -3.078 -5.373
59 2HB ASP 10 2HB ASP 10 -3.397 -4.041 -6.841
60 HD2 ASP 10 HD2 ASP 10 -6.064 -5.698 -5.581
61 H THR 11 H THR 11 -0.155 -2.629 -5.262
62 HA THR 11 HA THR 11 1.433 -3.361 -7.556
63 HB THR 11 HB THR 11 -0.308 -0.851 -7.671
64 HG1 THR 11 HG1 THR 11 -0.814 -3.157 -8.563
65 1HG2 THR 11 1HG2 THR 11 0.962 -0.438 -9.859
66 2HG2 THR 11 2HG2 THR 11 2.080 -1.789 -9.425
67 3HG2 THR 11 3HG2 THR 11 2.035 -0.284 -8.436
68 H CYS 12 H CYS 12 3.224 -3.318 -6.541
69 HA CYS 12 HA CYS 12 3.956 -1.184 -4.712
70 1HB CYS 12 1HB CYS 12 5.438 -3.644 -5.795
71 2HB CYS 12 2HB CYS 12 6.137 -2.492 -4.564
72 H LEU 13 H LEU 13 4.608 0.756 -5.534
73 HA LEU 13 HA LEU 13 6.089 0.809 -8.067
74 1HB LEU 13 1HB LEU 13 4.398 2.415 -7.861
75 2HB LEU 13 2HB LEU 13 4.940 2.967 -6.240
76 HG LEU 13 HG LEU 13 6.744 3.214 -8.722
77 1HD1 LEU 13 1HD1 LEU 13 4.529 5.188 -7.863
78 2HD1 LEU 13 2HD1 LEU 13 4.484 4.122 -9.316
79 3HD1 LEU 13 3HD1 LEU 13 5.724 5.425 -9.192
80 1HD2 LEU 13 1HD2 LEU 13 6.414 4.950 -6.175
81 2HD2 LEU 13 2HD2 LEU 13 7.543 5.295 -7.535
82 3HD2 LEU 13 3HD2 LEU 13 7.793 3.842 -6.509
83 H CYS 14 H CYS 14 8.157 0.441 -8.015
84 HA CYS 14 HA CYS 14 9.669 1.055 -5.587
85 1HB CYS 14 1HB CYS 14 10.454 -0.572 -8.007
86 2HB CYS 14 2HB CYS 14 11.555 -0.142 -6.679
87 H THR 15 H THR 15 11.068 2.623 -5.338
88 HA THR 15 HA THR 15 10.896 4.742 -7.314
89 HB THR 15 HB THR 15 12.154 6.113 -5.782
90 HG1 THR 15 HG1 THR 15 12.455 5.185 -3.648
91 1HG2 THR 15 1HG2 THR 15 9.651 5.791 -5.576
92 2HG2 THR 15 2HG2 THR 15 10.414 6.164 -3.987
93 3HG2 THR 15 3HG2 THR 15 9.915 4.477 -4.372
94 H ARG 16 H ARG 16 12.614 5.683 -8.462
95 HA ARG 16 HA ARG 16 15.077 4.138 -8.631
96 1HB ARG 16 1HB ARG 16 14.477 6.633 -10.230
97 2HB ARG 16 2HB ARG 16 15.728 5.376 -10.489
98 1HG ARG 16 1HG ARG 16 13.550 3.758 -10.601
99 2HG ARG 16 2HG ARG 16 12.748 5.301 -11.048
100 1HD ARG 16 1HD ARG 16 13.365 4.355 -13.135
101 2HD ARG 16 2HD ARG 16 14.719 5.524 -12.839
102 HE ARG 16 HE ARG 16 15.396 2.995 -11.641
103 1HH1 ARG 16 1HH1 ARG 16 14.916 4.408 -14.886
104 2HH1 ARG 16 2HH1 ARG 16 15.823 3.171 -15.696
105 1HH2 ARG 16 1HH2 ARG 16 16.554 1.322 -12.766
106 2HH2 ARG 16 2HH2 ARG 16 16.763 1.409 -14.484
107 H SER 17 H SER 17 14.478 5.263 -6.149
108 HA SER 17 HA SER 17 16.066 7.575 -5.630
109 1HB SER 17 1HB SER 17 14.167 6.624 -4.150
110 2HB SER 17 2HB SER 17 15.425 5.552 -3.454
111 HG SER 17 HG SER 17 15.168 7.453 -2.309
112 H GLN 18 H GLN 18 17.580 6.783 -3.384
113 HA GLN 18 HA GLN 18 19.668 4.961 -4.309
114 1HB GLN 18 1HB GLN 18 20.171 7.916 -3.650
115 2HB GLN 18 2HB GLN 18 21.448 6.664 -3.812
116 1HG GLN 18 1HG GLN 18 21.635 7.671 -5.881
117 2HG GLN 18 2HG GLN 18 20.498 6.334 -6.286
118 1HE2 GLN 18 1HE2 GLN 18 19.362 7.358 -7.961
119 2HE2 GLN 18 2HE2 GLN 18 18.444 8.842 -7.737
120 HA PRO 19 HA PRO 19 19.840 3.140 -3.320
121 1HB PRO 19 1HB PRO 19 19.073 1.228 -1.491
122 2HB PRO 19 2HB PRO 19 20.731 2.000 -1.426
123 1HG PRO 19 1HG PRO 19 18.228 2.791 0.179
124 2HG PRO 19 2HG PRO 19 19.891 2.421 0.802
125 1HD PRO 19 1HD PRO 19 19.001 5.017 0.245
126 2HD PRO 19 2HD PRO 19 20.740 4.529 0.011
127 HA PRO 20 HA PRO 20 15.537 3.356 -4.254
128 1HB PRO 20 1HB PRO 20 14.996 1.048 -5.657
129 2HB PRO 20 2HB PRO 20 16.178 2.270 -6.270
130 1HG PRO 20 1HG PRO 20 16.808 -0.261 -4.656
131 2HG PRO 20 2HG PRO 20 17.514 0.252 -6.251
132 1HD PRO 20 1HD PRO 20 18.757 0.801 -3.829
133 2HD PRO 20 2HD PRO 20 18.797 2.011 -5.205
134 H THR 21 H THR 21 13.369 2.572 -3.793
135 HA THR 21 HA THR 21 13.089 0.476 -1.787
136 HB THR 21 HB THR 21 14.132 2.547 -0.651
137 HG1 THR 21 HG1 THR 21 11.692 1.594 0.488
138 1HG2 THR 21 1HG2 THR 21 12.531 4.277 0.125
139 2HG2 THR 21 2HG2 THR 21 11.251 3.620 -0.958
140 3HG2 THR 21 3HG2 THR 21 12.756 4.330 -1.648
141 H CYS 22 H CYS 22 10.551 0.659 -0.971
142 HA CYS 22 HA CYS 22 9.077 1.537 -3.391
143 1HB CYS 22 1HB CYS 22 8.901 -1.315 -2.257
144 2HB CYS 22 2HB CYS 22 8.145 -0.744 -3.748
145 H ARG 23 H ARG 23 6.765 1.150 -3.299
146 HA ARG 23 HA ARG 23 5.422 0.928 -0.830
147 1HB ARG 23 1HB ARG 23 4.791 3.434 -0.609
148 2HB ARG 23 2HB ARG 23 6.387 2.942 -0.065
149 1HG ARG 23 1HG ARG 23 6.798 4.932 -1.110
150 2HG ARG 23 2HG ARG 23 7.380 3.735 -2.312
151 1HD ARG 23 1HD ARG 23 6.145 5.607 -3.420
152 2HD ARG 23 2HD ARG 23 5.169 4.073 -3.575
153 HE ARG 23 HE ARG 23 4.635 5.567 -1.110
154 1HH1 ARG 23 1HH1 ARG 23 3.644 5.394 -4.538
155 2HH1 ARG 23 2HH1 ARG 23 1.969 5.595 -4.161
156 1HH2 ARG 23 1HH2 ARG 23 2.561 5.839 -0.653
157 2HH2 ARG 23 2HH2 ARG 23 1.295 5.874 -1.860
158 H CYS 24 H CYS 24 3.138 1.842 -1.069
159 HA CYS 24 HA CYS 24 2.403 0.400 -3.538
160 1HB CYS 24 1HB CYS 24 1.786 -0.347 -1.083
161 2HB CYS 24 2HB CYS 24 0.538 0.928 -1.156
162 H VAL 25 H VAL 25 1.621 1.531 -5.297
163 HA VAL 25 HA VAL 25 0.482 4.115 -4.988
164 HB VAL 25 HB VAL 25 -0.239 4.047 -7.301
165 1HG1 VAL 25 1HG1 VAL 25 2.081 3.832 -8.251
166 2HG1 VAL 25 2HG1 VAL 25 2.622 3.059 -6.716
167 3HG1 VAL 25 3HG1 VAL 25 2.051 4.777 -6.729
168 1HG2 VAL 25 1HG2 VAL 25 0.481 2.096 -8.728
169 2HG2 VAL 25 2HG2 VAL 25 -0.838 1.651 -7.616
170 3HG2 VAL 25 3HG2 VAL 25 0.873 1.157 -7.254
171 H ASP 26 H ASP 26 -0.827 0.970 -4.709
172 HA ASP 26 HA ASP 26 -3.573 1.931 -5.019
173 1HB ASP 26 1HB ASP 26 -2.460 -0.851 -4.399
174 2HB ASP 26 2HB ASP 26 -4.193 -0.440 -4.114
175 HD2 ASP 26 HD2 ASP 26 -2.418 0.972 -6.627
176 H VAL 27 H VAL 27 -5.076 2.214 -3.549
177 HA VAL 27 HA VAL 27 -4.150 2.697 -0.808
178 HB VAL 27 HB VAL 27 -5.640 4.495 -0.707
179 1HG1 VAL 27 1HG1 VAL 27 -4.868 5.910 -2.536
180 2HG1 VAL 27 2HG1 VAL 27 -4.487 4.501 -3.574
181 3HG1 VAL 27 3HG1 VAL 27 -3.531 4.801 -2.071
182 1HG2 VAL 27 1HG2 VAL 27 -6.950 3.327 -3.247
183 2HG2 VAL 27 2HG2 VAL 27 -7.182 5.017 -2.695
184 3HG2 VAL 27 3HG2 VAL 27 -7.690 3.664 -1.625
185 H ARG 28 H ARG 28 -5.910 2.585 0.836
186 HA ARG 28 HA ARG 28 -7.483 0.113 0.375
187 1HB ARG 28 1HB ARG 28 -6.055 1.312 2.773
188 2HB ARG 28 2HB ARG 28 -7.216 -0.083 2.895
189 1HG ARG 28 1HG ARG 28 -5.712 -1.526 1.675
190 2HG ARG 28 2HG ARG 28 -4.648 -0.138 1.226
191 1HD ARG 28 1HD ARG 28 -3.652 -1.403 3.192
192 2HD ARG 28 2HD ARG 28 -4.108 0.304 3.562
193 HE ARG 28 HE ARG 28 -5.858 -0.371 4.931
194 1HH1 ARG 28 1HH1 ARG 28 -4.611 -3.352 3.323
195 2HH1 ARG 28 2HH1 ARG 28 -5.561 -4.386 4.329
196 1HH2 ARG 28 1HH2 ARG 28 -7.092 -1.819 6.208
197 2HH2 ARG 28 2HH2 ARG 28 -6.958 -3.529 5.963
198 H GLU 29 H GLU 29 -9.468 -0.058 1.422
199 HA GLU 29 HA GLU 29 -11.220 2.115 1.661
200 1HB GLU 29 1HB GLU 29 -11.228 -0.829 1.900
201 2HB GLU 29 2HB GLU 29 -12.393 -0.028 3.001
202 1HG GLU 29 1HG GLU 29 -13.317 1.304 1.039
203 2HG GLU 29 2HG GLU 29 -12.237 0.359 -0.055
204 HE2 GLU 29 HE2 GLU 29 -14.782 0.143 2.268
205 H SER 30 H SER 30 -8.963 0.922 3.714
206 HA SER 30 HA SER 30 -9.800 2.368 6.094
207 1HB SER 30 1HB SER 30 -9.383 -0.729 6.048
208 2HB SER 30 2HB SER 30 -9.654 0.232 7.542
209 HG SER 30 HG SER 30 -11.571 -0.627 7.019
210 H CYS 31 H CYS 31 -7.826 1.347 7.910
211 HA CYS 31 HA CYS 31 -5.434 1.009 6.187
212 1HB CYS 31 1HB CYS 31 -5.790 3.345 7.232
213 2HB CYS 31 2HB CYS 31 -5.340 2.545 8.807
214 H HIS 32 H HIS 32 -3.575 -0.107 7.280
215 HA HIS 32 HA HIS 32 -4.171 -1.568 9.657
216 1HB HIS 32 1HB HIS 32 -5.194 -3.064 8.002
217 2HB HIS 32 2HB HIS 32 -3.645 -3.079 7.037
218 HD1 HIS 32 HD1 HIS 32 -4.844 -3.756 10.577
219 HD2 HIS 32 HD2 HIS 32 -2.427 -5.574 7.679
220 HE1 HIS 32 HE1 HIS 32 -3.970 -5.852 11.587
221 HE2 HIS 32 HE2 HIS 32 -2.490 -6.955 9.805
222 H SER 33 H SER 33 -2.215 -2.711 10.356
223 HA SER 33 HA SER 33 -0.115 -1.070 10.487
224 1HB SER 33 1HB SER 33 0.040 -4.131 10.857
225 2HB SER 33 2HB SER 33 0.993 -2.886 11.750
226 HG SER 33 HG SER 33 -0.825 -3.737 12.899
227 H ALA 34 H ALA 34 1.249 -0.415 8.857
228 HA ALA 34 HA ALA 34 3.108 -2.403 8.011
229 1HB ALA 34 1HB ALA 34 1.599 -2.571 6.128
230 2HB ALA 34 2HB ALA 34 3.038 -1.657 5.567
231 3HB ALA 34 3HB ALA 34 1.469 -0.803 5.953
232 H CYS 35 H CYS 35 2.378 1.068 7.167
233 HA CYS 35 HA CYS 35 4.980 1.799 8.255
234 1HB CYS 35 1HB CYS 35 4.779 3.739 6.759
235 2HB CYS 35 2HB CYS 35 4.585 2.172 5.887
236 H ASP 36 H ASP 36 4.811 4.227 8.985
237 HA ASP 36 HA ASP 36 2.766 4.201 11.109
238 1HB ASP 36 1HB ASP 36 5.517 4.248 11.217
239 2HB ASP 36 2HB ASP 36 5.243 6.008 11.114
240 HD2 ASP 36 HD2 ASP 36 3.311 6.512 12.534
241 H LYS 37 H LYS 37 2.840 5.488 8.155
242 HA LYS 37 HA LYS 37 1.715 8.081 8.961
243 1HB LYS 37 1HB LYS 37 4.189 8.028 8.160
244 2HB LYS 37 2HB LYS 37 3.544 7.578 6.569
245 1HG LYS 37 1HG LYS 37 2.204 9.705 6.530
246 2HG LYS 37 2HG LYS 37 2.808 10.107 8.166
247 1HD LYS 37 1HD LYS 37 5.142 10.255 7.340
248 2HD LYS 37 2HD LYS 37 4.646 9.682 5.712
249 1HE LYS 37 1HE LYS 37 3.241 11.765 5.412
250 2HE LYS 37 2HE LYS 37 3.805 12.357 7.026
251 1HZ LYS 37 1HZ LYS 37 5.040 13.248 5.153
252 2HZ LYS 37 2HZ LYS 37 5.576 11.695 4.731
253 3HZ LYS 37 3HZ LYS 37 6.036 12.374 6.218
254 H CYS 38 H CYS 38 -0.263 6.589 8.756
255 HA CYS 38 HA CYS 38 -1.140 6.249 6.015
256 1HB CYS 38 1HB CYS 38 -1.458 4.684 8.068
257 2HB CYS 38 2HB CYS 38 -2.774 5.808 8.560
258 H VAL 39 H VAL 39 -1.902 7.989 4.878
259 HA VAL 39 HA VAL 39 -3.326 10.133 6.319
260 HB VAL 39 HB VAL 39 -1.615 9.981 3.812
261 1HG1 VAL 39 1HG1 VAL 39 -1.758 12.500 3.871
262 2HG1 VAL 39 2HG1 VAL 39 -2.965 12.381 5.206
263 3HG1 VAL 39 3HG1 VAL 39 -3.361 11.733 3.554
264 1HG2 VAL 39 1HG2 VAL 39 -0.048 11.482 5.116
265 2HG2 VAL 39 2HG2 VAL 39 -0.208 9.838 5.845
266 3HG2 VAL 39 3HG2 VAL 39 -1.088 11.245 6.571
267 H CYS 40 H CYS 40 -5.467 10.637 5.270
268 HA CYS 40 HA CYS 40 -6.195 8.713 3.173
269 1HB CYS 40 1HB CYS 40 -6.119 7.614 5.380
270 2HB CYS 40 2HB CYS 40 -7.328 8.784 5.990
271 H ALA 41 H ALA 41 -7.342 9.546 1.758
272 HA ALA 41 HA ALA 41 -8.536 12.145 2.087
273 1HB ALA 41 1HB ALA 41 -9.209 11.961 -0.258
274 2HB ALA 41 2HB ALA 41 -8.691 10.223 -0.280
275 3HB ALA 41 3HB ALA 41 -7.475 11.532 -0.049
276 H TYR 42 H TYR 42 -10.607 12.745 2.097
277 HA TYR 42 HA TYR 42 -12.327 10.921 3.418
278 1HB TYR 42 1HB TYR 42 -13.618 12.870 4.085
279 2HB TYR 42 2HB TYR 42 -11.853 13.177 4.261
280 HD1 TYR 42 HD1 TYR 42 -10.652 14.635 2.503
281 HD2 TYR 42 HD2 TYR 42 -14.944 14.284 2.640
282 HE1 TYR 42 HE1 TYR 42 -10.862 16.575 1.057
283 HE2 TYR 42 HE2 TYR 42 -15.140 16.260 1.189
284 HH TYR 42 HH TYR 42 -12.301 18.169 0.218
285 H SER 43 H SER 43 -11.945 10.430 0.753
286 HA SER 43 HA SER 43 -13.848 11.207 -1.073
287 1HB SER 43 1HB SER 43 -12.219 8.644 -1.116
288 2HB SER 43 2HB SER 43 -12.939 9.537 -2.560
289 HG SER 43 HG SER 43 -10.716 10.020 -2.265
290 H ASN 44 H ASN 44 -14.337 8.294 -2.074
291 HA ASN 44 HA ASN 44 -16.636 7.607 -0.478
292 1HB ASN 44 1HB ASN 44 -17.192 9.468 -2.113
293 2HB ASN 44 2HB ASN 44 -16.643 8.443 -3.450
294 1HD2 ASN 44 1HD2 ASN 44 -18.065 6.419 -3.895
295 2HD2 ASN 44 2HD2 ASN 44 -19.732 6.520 -3.425
296 HA PRO 45 HA PRO 45 -16.099 6.059 0.786
297 1HB PRO 45 1HB PRO 45 -15.079 3.666 1.682
298 2HB PRO 45 2HB PRO 45 -16.658 3.730 0.905
299 1HG PRO 45 1HG PRO 45 -13.964 3.107 -0.442
300 2HG PRO 45 2HG PRO 45 -15.438 2.072 -0.461
301 1HD PRO 45 1HD PRO 45 -14.838 3.882 -2.482
302 2HD PRO 45 2HD PRO 45 -16.562 3.587 -1.974
303 HA PRO 46 HA PRO 46 -12.231 7.803 1.334
304 1HB PRO 46 1HB PRO 46 -11.048 7.195 3.777
305 2HB PRO 46 2HB PRO 46 -12.561 8.157 3.614
306 1HG PRO 46 1HG PRO 46 -12.360 5.135 4.111
307 2HG PRO 46 2HG PRO 46 -13.278 6.396 5.064
308 1HD PRO 46 1HD PRO 46 -14.510 4.901 3.145
309 2HD PRO 46 2HD PRO 46 -14.834 6.745 3.261
310 H GLN 47 H GLN 47 -9.860 7.781 1.321
311 HA GLN 47 HA GLN 47 -8.902 5.223 0.167
312 1HB GLN 47 1HB GLN 47 -8.759 8.047 -0.984
313 2HB GLN 47 2HB GLN 47 -7.971 6.608 -1.696
314 1HG GLN 47 1HG GLN 47 -11.033 6.827 -1.263
315 2HG GLN 47 2HG GLN 47 -10.217 7.371 -2.754
316 1HE2 GLN 47 1HE2 GLN 47 -10.875 4.494 -0.739
317 2HE2 GLN 47 2HE2 GLN 47 -10.649 3.347 -2.042
318 H CYS 48 H CYS 48 -7.674 4.650 1.744
319 HA CYS 48 HA CYS 48 -5.906 6.555 3.048
320 1HB CYS 48 1HB CYS 48 -6.450 3.653 3.706
321 2HB CYS 48 2HB CYS 48 -5.350 4.768 4.601
322 H GLN 49 H GLN 49 -3.894 7.008 2.563
323 HA GLN 49 HA GLN 49 -2.453 5.144 0.825
324 1HB GLN 49 1HB GLN 49 -2.191 8.135 1.433
325 2HB GLN 49 2HB GLN 49 -1.001 7.209 0.451
326 1HG GLN 49 1HG GLN 49 -2.218 8.226 -1.229
327 2HG GLN 49 2HG GLN 49 -2.957 6.599 -1.137
328 1HE2 GLN 49 1HE2 GLN 49 -3.523 9.636 0.785
329 2HE2 GLN 49 2HE2 GLN 49 -5.230 9.679 0.416
330 H CYS 50 H CYS 50 -0.548 4.370 1.450
331 HA CYS 50 HA CYS 50 0.624 5.224 4.055
332 1HB CYS 50 1HB CYS 50 0.631 2.743 3.485
333 2HB CYS 50 2HB CYS 50 1.512 3.123 1.985
334 H TYR 51 H TYR 51 1.306 7.237 3.781
335 HA TYR 51 HA TYR 51 2.443 8.365 1.473
336 1HB TYR 51 1HB TYR 51 2.078 9.165 4.341
337 2HB TYR 51 2HB TYR 51 3.549 9.852 3.626
338 HD1 TYR 51 HD1 TYR 51 3.177 12.086 2.775
339 HD2 TYR 51 HD2 TYR 51 0.031 9.131 2.378
340 HE1 TYR 51 HE1 TYR 51 1.834 13.660 1.602
341 HE2 TYR 51 HE2 TYR 51 -1.303 10.734 1.186
342 HH TYR 51 HH TYR 51 -1.417 12.834 0.273
343 H ASP 52 H ASP 52 3.949 6.671 4.017
344 HA ASP 52 HA ASP 52 6.621 7.569 3.192
345 1HB ASP 52 1HB ASP 52 5.672 7.464 5.665
346 2HB ASP 52 2HB ASP 52 6.074 5.720 5.568
347 HD2 ASP 52 HD2 ASP 52 8.767 7.914 6.888
348 H THR 53 H THR 53 8.410 6.035 3.033
349 HA THR 53 HA THR 53 7.757 3.989 1.157
350 HB THR 53 HB THR 53 10.336 3.653 1.219
351 HG1 THR 53 HG1 THR 53 10.750 4.717 3.170
352 1HG2 THR 53 1HG2 THR 53 9.058 4.911 -0.548
353 2HG2 THR 53 2HG2 THR 53 10.591 5.747 -0.133
354 3HG2 THR 53 3HG2 THR 53 9.039 6.380 0.503
355 H HIS 54 H HIS 54 8.869 1.780 1.273
356 HA HIS 54 HA HIS 54 9.169 0.755 3.929
357 1HB HIS 54 1HB HIS 54 6.625 0.545 2.778
358 2HB HIS 54 2HB HIS 54 7.416 -0.869 2.012
359 HD1 HIS 54 HD1 HIS 54 6.466 -2.724 3.016
360 HD2 HIS 54 HD2 HIS 54 7.272 0.138 5.974
361 HE1 HIS 54 HE1 HIS 54 5.776 -3.722 5.204
362 HE2 HIS 54 HE2 HIS 54 6.231 -1.956 6.983
363 H LYS 55 H LYS 55 10.005 -1.561 3.659
364 HA LYS 55 HA LYS 55 11.418 -1.874 1.103
365 1HB LYS 55 1HB LYS 55 13.266 -2.870 2.340
366 2HB LYS 55 2HB LYS 55 12.966 -1.188 2.856
367 1HG LYS 55 1HG LYS 55 11.956 -1.857 4.929
368 2HG LYS 55 2HG LYS 55 11.918 -3.602 4.453
369 1HD LYS 55 1HD LYS 55 14.520 -1.968 4.733
370 2HD LYS 55 2HD LYS 55 13.753 -2.853 6.095
371 1HE LYS 55 1HE LYS 55 13.927 -5.015 4.835
372 2HE LYS 55 2HE LYS 55 14.738 -4.156 3.466
373 1HZ LYS 55 1HZ LYS 55 16.315 -5.184 4.962
374 2HZ LYS 55 2HZ LYS 55 15.725 -4.282 6.274
375 3HZ LYS 55 3HZ LYS 55 16.485 -3.496 4.978
376 H PHE 56 H PHE 56 8.764 -2.826 1.722
377 HA PHE 56 HA PHE 56 9.244 -5.629 1.173
378 1HB PHE 56 1HB PHE 56 8.774 -5.061 3.816
379 2HB PHE 56 2HB PHE 56 7.071 -5.146 3.266
380 HD1 PHE 56 HD1 PHE 56 6.276 -7.307 2.140
381 HD2 PHE 56 HD2 PHE 56 10.158 -6.973 3.971
382 HE1 PHE 56 HE1 PHE 56 6.396 -9.750 2.314
383 HE2 PHE 56 HE2 PHE 56 10.278 -9.420 4.151
384 HZ PHE 56 HZ PHE 56 8.395 -10.833 3.339
385 H CYS 57 H CYS 57 7.883 -6.386 -0.309
386 HA CYS 57 HA CYS 57 5.420 -4.900 -0.954
387 1HB CYS 57 1HB CYS 57 7.189 -4.867 -2.780
388 2HB CYS 57 2HB CYS 57 7.167 -6.651 -2.768
389 H TYR 58 H TYR 58 3.608 -6.006 -0.680
390 HA TYR 58 HA TYR 58 3.776 -8.844 0.157
391 1HB TYR 58 1HB TYR 58 1.828 -6.539 0.742
392 2HB TYR 58 2HB TYR 58 1.403 -8.232 1.094
393 HD1 TYR 58 HD1 TYR 58 2.934 -9.637 2.571
394 HD2 TYR 58 HD2 TYR 58 3.186 -5.335 2.402
395 HE1 TYR 58 HE1 TYR 58 4.109 -9.641 4.666
396 HE2 TYR 58 HE2 TYR 58 4.365 -5.344 4.537
397 HH TYR 58 HH TYR 58 5.019 -8.398 6.316
398 H LYS 59 H LYS 59 1.887 -10.142 -0.238
399 HA LYS 59 HA LYS 59 0.913 -10.449 -2.808
400 1HB LYS 59 1HB LYS 59 -0.309 -11.146 -0.106
401 2HB LYS 59 2HB LYS 59 -0.943 -11.773 -1.669
402 1HG LYS 59 1HG LYS 59 1.168 -13.019 -2.073
403 2HG LYS 59 2HG LYS 59 1.923 -12.285 -0.639
404 1HD LYS 59 1HD LYS 59 -0.077 -13.277 0.732
405 2HD LYS 59 2HD LYS 59 -0.317 -14.361 -0.676
406 1HE LYS 59 1HE LYS 59 2.288 -13.997 0.976
407 2HE LYS 59 2HE LYS 59 1.140 -15.391 1.107
408 1HZ LYS 59 1HZ LYS 59 1.627 -15.949 -1.165
409 2HZ LYS 59 2HZ LYS 59 3.052 -15.883 -0.243
410 3HZ LYS 59 3HZ LYS 59 2.678 -14.619 -1.314
411 H ALA 60 H ALA 60 -1.328 -10.246 -3.626
412 HA ALA 60 HA ALA 60 -2.261 -7.584 -3.267
413 1HB ALA 60 1HB ALA 60 -3.816 -8.194 -5.121
414 2HB ALA 60 2HB ALA 60 -3.340 -9.937 -4.911
415 3HB ALA 60 3HB ALA 60 -2.130 -8.735 -5.464
416 H CYS 61 H CYS 61 -4.293 -6.857 -2.841
417 HA CYS 61 HA CYS 61 -5.325 -7.882 -0.380
418 1HB CYS 61 1HB CYS 61 -6.176 -5.477 -2.108
419 2HB CYS 61 2HB CYS 61 -6.723 -5.754 -0.417
420 H HIS 62 H HIS 62 -5.992 -9.800 -2.020
421 HA HIS 62 HA HIS 62 -8.730 -9.416 -3.017
422 1HB HIS 62 1HB HIS 62 -7.001 -11.923 -3.051
423 2HB HIS 62 2HB HIS 62 -8.649 -11.770 -3.729
424 HD1 HIS 62 HD1 HIS 62 -7.826 -12.279 -6.057
425 HD2 HIS 62 HD2 HIS 62 -6.214 -8.733 -4.495
426 HE1 HIS 62 HE1 HIS 62 -6.804 -11.028 -7.973
427 HE2 HIS 62 HE2 HIS 62 -5.819 -8.896 -7.013
428 H ASN 63 H ASN 63 -9.651 -8.853 -0.886
429 HA ASN 63 HA ASN 63 -10.219 -10.945 0.961
430 1HB ASN 63 1HB ASN 63 -12.169 -9.446 1.672
431 2HB ASN 63 2HB ASN 63 -10.525 -8.879 1.997
432 1HD2 ASN 63 1HD2 ASN 63 -9.746 -6.963 0.764
433 2HD2 ASN 63 2HD2 ASN 63 -10.869 -6.031 -0.176
434 H SER 64 H SER 64 -12.144 -9.306 -1.411
435 HA SER 64 HA SER 64 -14.085 -11.534 -1.465
436 1HB SER 64 1HB SER 64 -14.191 -8.729 -2.737
437 2HB SER 64 2HB SER 64 -15.543 -9.936 -2.701
438 HG SER 64 HG SER 64 -14.281 -8.587 -0.508
439 H GLU 65 H GLU 65 -12.911 -13.079 -2.738
440 HA GLU 65 HA GLU 65 -11.606 -12.508 -5.132
441 1HB GLU 65 1HB GLU 65 -11.568 -14.745 -3.790
442 2HB GLU 65 2HB GLU 65 -13.088 -15.148 -4.624
443 1HG GLU 65 1HG GLU 65 -11.327 -16.194 -5.897
444 2HG GLU 65 2HG GLU 65 -11.824 -14.777 -6.879
445 HE2 GLU 65 HE2 GLU 65 -9.687 -15.785 -4.416
446 H ILE 66 H ILE 66 -14.987 -13.255 -4.566
447 HA ILE 66 HA ILE 66 -15.873 -11.965 -6.916
448 HB ILE 66 HB ILE 66 -17.331 -13.912 -7.606
449 1HG1 ILE 66 1HG1 ILE 66 -15.284 -15.677 -6.126
450 2HG1 ILE 66 2HG1 ILE 66 -16.903 -15.278 -5.459
451 1HG2 ILE 66 1HG2 ILE 66 -14.320 -14.410 -8.034
452 2HG2 ILE 66 2HG2 ILE 66 -15.293 -13.174 -8.907
453 3HG2 ILE 66 3HG2 ILE 66 -15.649 -14.925 -9.117
454 1HD1 ILE 66 1HD1 ILE 66 -16.922 -17.496 -6.550
455 2HD1 ILE 66 2HD1 ILE 66 -16.404 -16.783 -8.115
456 3HD1 ILE 66 3HD1 ILE 66 -18.018 -16.368 -7.407
457 H GLU 67 H GLU 67 -18.383 -12.078 -6.843
458 HA GLU 67 HA GLU 67 -19.281 -12.164 -4.050
459 1HB GLU 67 1HB GLU 67 -21.155 -10.873 -4.642
460 2HB GLU 67 2HB GLU 67 -19.734 -10.056 -5.372
461 1HG GLU 67 1HG GLU 67 -21.881 -11.762 -6.840
462 2HG GLU 67 2HG GLU 67 -21.707 -9.977 -6.870
463 HE2 GLU 67 HE2 GLU 67 -20.222 -12.970 -7.687
Start of MODEL 18
1 1H GLY 1 1H GLY 1 -6.614 -23.087 6.550
2 2H GLY 1 2H GLY 1 -5.193 -22.749 5.678
3 3H GLY 1 3H GLY 1 -6.713 -22.608 4.927
4 1HA GLY 1 1HA GLY 1 -7.310 -20.884 6.494
5 2HA GLY 1 2HA GLY 1 -5.602 -20.953 7.085
6 H ASP 2 H ASP 2 -7.193 -18.747 5.823
7 HA ASP 2 HA ASP 2 -5.261 -17.840 3.819
8 1HB ASP 2 1HB ASP 2 -8.302 -18.209 3.229
9 2HB ASP 2 2HB ASP 2 -7.141 -17.320 2.170
10 HD2 ASP 2 HD2 ASP 2 -7.476 -21.170 1.761
11 H ASP 3 H ASP 3 -5.457 -16.925 6.292
12 HA ASP 3 HA ASP 3 -6.505 -14.310 5.940
13 1HB ASP 3 1HB ASP 3 -8.509 -15.682 6.763
14 2HB ASP 3 2HB ASP 3 -7.606 -15.982 8.294
15 HD2 ASP 3 HD2 ASP 3 -9.754 -13.064 8.614
16 H VAL 4 H VAL 4 -4.693 -13.291 6.358
17 HA VAL 4 HA VAL 4 -3.173 -13.873 8.819
18 HB VAL 4 HB VAL 4 -2.047 -12.655 6.253
19 1HG1 VAL 4 1HG1 VAL 4 -0.765 -14.148 8.656
20 2HG1 VAL 4 2HG1 VAL 4 -0.611 -12.377 8.299
21 3HG1 VAL 4 3HG1 VAL 4 0.119 -13.577 7.201
22 1HG2 VAL 4 1HG2 VAL 4 -2.163 -15.659 6.976
23 2HG2 VAL 4 2HG2 VAL 4 -1.065 -14.944 5.750
24 3HG2 VAL 4 3HG2 VAL 4 -2.835 -14.858 5.500
25 H LYS 5 H LYS 5 -2.303 -11.766 9.793
26 HA LYS 5 HA LYS 5 -3.947 -9.473 9.002
27 1HB LYS 5 1HB LYS 5 -2.294 -10.051 11.510
28 2HB LYS 5 2HB LYS 5 -3.267 -8.574 11.218
29 1HG LYS 5 1HG LYS 5 -5.318 -10.103 10.934
30 2HG LYS 5 2HG LYS 5 -4.318 -11.456 11.540
31 1HD LYS 5 1HD LYS 5 -3.917 -10.198 13.685
32 2HD LYS 5 2HD LYS 5 -4.869 -8.809 13.045
33 1HE LYS 5 1HE LYS 5 -6.909 -10.320 12.868
34 2HE LYS 5 2HE LYS 5 -5.947 -11.655 13.622
35 1HZ LYS 5 1HZ LYS 5 -6.522 -9.005 14.841
36 2HZ LYS 5 2HZ LYS 5 -5.639 -10.269 15.555
37 3HZ LYS 5 3HZ LYS 5 -7.290 -10.477 15.208
38 H SER 6 H SER 6 -1.622 -10.544 7.598
39 HA SER 6 HA SER 6 0.461 -8.635 7.547
40 1HB SER 6 1HB SER 6 -0.671 -10.377 5.285
41 2HB SER 6 2HB SER 6 0.789 -9.344 5.096
42 HG SER 6 HG SER 6 1.246 -11.547 5.713
43 H ALA 7 H ALA 7 0.931 -6.919 5.990
44 HA ALA 7 HA ALA 7 -1.427 -5.438 5.072
45 1HB ALA 7 1HB ALA 7 0.574 -4.206 5.995
46 2HB ALA 7 2HB ALA 7 0.305 -3.780 4.262
47 3HB ALA 7 3HB ALA 7 1.595 -4.952 4.731
48 H CYS 8 H CYS 8 -1.495 -4.762 2.659
49 HA CYS 8 HA CYS 8 -0.578 -6.964 0.933
50 1HB CYS 8 1HB CYS 8 -2.791 -7.253 0.015
51 2HB CYS 8 2HB CYS 8 -2.870 -7.484 1.788
52 H CYS 9 H CYS 9 -0.727 -6.431 -1.456
53 HA CYS 9 HA CYS 9 -1.269 -3.684 -2.163
54 1HB CYS 9 1HB CYS 9 1.402 -4.438 -1.310
55 2HB CYS 9 2HB CYS 9 1.416 -4.353 -3.100
56 H ASP 10 H ASP 10 -1.859 -3.638 -4.438
57 HA ASP 10 HA ASP 10 -1.446 -6.107 -5.942
58 1HB ASP 10 1HB ASP 10 -2.961 -3.502 -6.488
59 2HB ASP 10 2HB ASP 10 -2.679 -4.690 -7.751
60 HD2 ASP 10 HD2 ASP 10 -5.399 -6.415 -6.847
61 H THR 11 H THR 11 -0.255 -2.721 -6.070
62 HA THR 11 HA THR 11 1.702 -3.384 -8.130
63 HB THR 11 HB THR 11 -0.730 -1.510 -8.361
64 HG1 THR 11 HG1 THR 11 -1.333 -2.851 -9.992
65 1HG2 THR 11 1HG2 THR 11 1.224 -0.329 -9.387
66 2HG2 THR 11 2HG2 THR 11 0.146 -0.937 -10.679
67 3HG2 THR 11 3HG2 THR 11 1.669 -1.822 -10.309
68 H CYS 12 H CYS 12 3.412 -1.949 -8.042
69 HA CYS 12 HA CYS 12 3.223 0.315 -6.234
70 1HB CYS 12 1HB CYS 12 4.765 -0.630 -4.670
71 2HB CYS 12 2HB CYS 12 3.480 -1.873 -4.978
72 H LEU 13 H LEU 13 4.728 1.748 -6.224
73 HA LEU 13 HA LEU 13 6.449 1.898 -8.581
74 1HB LEU 13 1HB LEU 13 5.037 3.799 -8.157
75 2HB LEU 13 2HB LEU 13 5.499 3.882 -6.438
76 HG LEU 13 HG LEU 13 7.644 4.203 -8.612
77 1HD1 LEU 13 1HD1 LEU 13 5.762 5.644 -9.343
78 2HD1 LEU 13 2HD1 LEU 13 7.135 6.644 -8.746
79 3HD1 LEU 13 3HD1 LEU 13 5.684 6.399 -7.707
80 1HD2 LEU 13 1HD2 LEU 13 8.402 4.236 -6.186
81 2HD2 LEU 13 2HD2 LEU 13 7.230 5.565 -5.855
82 3HD2 LEU 13 3HD2 LEU 13 8.617 5.838 -6.970
83 H CYS 14 H CYS 14 8.638 1.736 -8.414
84 HA CYS 14 HA CYS 14 9.850 1.630 -5.763
85 1HB CYS 14 1HB CYS 14 9.924 -0.553 -7.893
86 2HB CYS 14 2HB CYS 14 11.160 -0.423 -6.631
87 H THR 15 H THR 15 11.688 2.571 -5.648
88 HA THR 15 HA THR 15 12.670 3.860 -8.059
89 HB THR 15 HB THR 15 14.219 5.063 -6.654
90 HG1 THR 15 HG1 THR 15 13.991 4.890 -4.427
91 1HG2 THR 15 1HG2 THR 15 11.311 4.983 -5.569
92 2HG2 THR 15 2HG2 THR 15 11.851 5.819 -7.073
93 3HG2 THR 15 3HG2 THR 15 12.457 6.371 -5.466
94 H ARG 16 H ARG 16 14.642 3.699 -8.984
95 HA ARG 16 HA ARG 16 16.322 1.387 -8.389
96 1HB ARG 16 1HB ARG 16 16.419 3.488 -10.610
97 2HB ARG 16 2HB ARG 16 17.633 2.172 -10.405
98 1HG ARG 16 1HG ARG 16 15.927 0.451 -10.599
99 2HG ARG 16 2HG ARG 16 14.626 1.679 -10.802
100 1HD ARG 16 1HD ARG 16 15.655 2.465 -12.927
101 2HD ARG 16 2HD ARG 16 17.025 1.302 -12.741
102 HE ARG 16 HE ARG 16 14.162 0.680 -13.358
103 1HH1 ARG 16 1HH1 ARG 16 17.439 -0.627 -12.676
104 2HH1 ARG 16 2HH1 ARG 16 17.033 -2.217 -13.241
105 1HH2 ARG 16 1HH2 ARG 16 13.700 -1.421 -14.120
106 2HH2 ARG 16 2HH2 ARG 16 14.899 -2.671 -14.071
107 H SER 17 H SER 17 15.968 3.665 -6.573
108 HA SER 17 HA SER 17 18.413 5.115 -6.321
109 1HB SER 17 1HB SER 17 16.174 5.843 -5.350
110 2HB SER 17 2HB SER 17 16.443 4.637 -4.044
111 HG SER 17 HG SER 17 17.125 6.739 -3.500
112 H GLN 18 H GLN 18 18.994 4.886 -3.656
113 HA GLN 18 HA GLN 18 20.251 2.269 -3.211
114 1HB GLN 18 1HB GLN 18 21.695 4.955 -3.629
115 2HB GLN 18 2HB GLN 18 22.448 3.548 -2.835
116 1HG GLN 18 1HG GLN 18 23.374 3.434 -4.958
117 2HG GLN 18 2HG GLN 18 22.076 2.190 -5.003
118 1HE2 GLN 18 1HE2 GLN 18 21.913 5.792 -5.414
119 2HE2 GLN 18 2HE2 GLN 18 21.142 5.725 -6.982
120 HA PRO 19 HA PRO 19 19.558 1.132 -1.630
121 1HB PRO 19 1HB PRO 19 17.947 0.545 0.532
122 2HB PRO 19 2HB PRO 19 19.772 0.633 0.660
123 1HG PRO 19 1HG PRO 19 17.731 2.829 1.328
124 2HG PRO 19 2HG PRO 19 19.101 2.216 2.360
125 1HD PRO 19 1HD PRO 19 19.284 4.479 0.728
126 2HD PRO 19 2HD PRO 19 20.719 3.393 1.030
127 HA PRO 20 HA PRO 20 15.791 2.410 -3.564
128 1HB PRO 20 1HB PRO 20 14.689 0.021 -4.413
129 2HB PRO 20 2HB PRO 20 16.238 0.654 -5.093
130 1HG PRO 20 1HG PRO 20 15.899 -1.357 -2.804
131 2HG PRO 20 2HG PRO 20 16.892 -1.563 -4.305
132 1HD PRO 20 1HD PRO 20 17.983 -0.687 -1.937
133 2HD PRO 20 2HD PRO 20 18.499 0.083 -3.522
134 H THR 21 H THR 21 13.449 2.248 -3.578
135 HA THR 21 HA THR 21 12.192 1.427 -1.031
136 HB THR 21 HB THR 21 11.385 3.908 -0.828
137 HG1 THR 21 HG1 THR 21 12.572 4.174 -2.990
138 1HG2 THR 21 1HG2 THR 21 13.340 4.672 0.448
139 2HG2 THR 21 2HG2 THR 21 14.387 3.435 -0.328
140 3HG2 THR 21 3HG2 THR 21 13.060 2.919 0.780
141 H CYS 22 H CYS 22 9.873 1.757 -1.089
142 HA CYS 22 HA CYS 22 8.791 2.229 -3.777
143 1HB CYS 22 1HB CYS 22 8.325 -0.289 -2.034
144 2HB CYS 22 2HB CYS 22 7.550 -0.002 -3.589
145 H ARG 23 H ARG 23 6.311 1.816 -3.616
146 HA ARG 23 HA ARG 23 5.044 2.225 -1.128
147 1HB ARG 23 1HB ARG 23 6.185 4.544 -1.684
148 2HB ARG 23 2HB ARG 23 4.891 4.728 -2.887
149 1HG ARG 23 1HG ARG 23 4.268 4.083 0.071
150 2HG ARG 23 2HG ARG 23 4.754 5.710 -0.383
151 1HD ARG 23 1HD ARG 23 2.339 4.373 -1.746
152 2HD ARG 23 2HD ARG 23 2.244 5.443 -0.280
153 HE ARG 23 HE ARG 23 3.800 6.910 -1.972
154 1HH1 ARG 23 1HH1 ARG 23 0.577 5.397 -2.597
155 2HH1 ARG 23 2HH1 ARG 23 0.119 6.647 -3.676
156 1HH2 ARG 23 1HH2 ARG 23 3.214 8.401 -3.316
157 2HH2 ARG 23 2HH2 ARG 23 1.662 8.485 -4.118
158 H CYS 24 H CYS 24 2.911 2.107 -1.269
159 HA CYS 24 HA CYS 24 1.799 0.376 -3.090
160 1HB CYS 24 1HB CYS 24 0.918 1.998 -0.844
161 2HB CYS 24 2HB CYS 24 -0.336 1.526 -2.014
162 H VAL 25 H VAL 25 1.189 1.321 -5.521
163 HA VAL 25 HA VAL 25 0.505 4.070 -5.637
164 HB VAL 25 HB VAL 25 0.002 3.896 -7.920
165 1HG1 VAL 25 1HG1 VAL 25 2.225 3.138 -8.685
166 2HG1 VAL 25 2HG1 VAL 25 2.436 2.140 -7.205
167 3HG1 VAL 25 3HG1 VAL 25 2.389 3.940 -7.074
168 1HG2 VAL 25 1HG2 VAL 25 0.142 1.661 -9.118
169 2HG2 VAL 25 2HG2 VAL 25 -1.278 1.769 -8.021
170 3HG2 VAL 25 3HG2 VAL 25 0.178 0.836 -7.523
171 H ASP 26 H ASP 26 -1.251 1.382 -4.801
172 HA ASP 26 HA ASP 26 -3.836 2.283 -5.772
173 1HB ASP 26 1HB ASP 26 -3.353 0.008 -3.757
174 2HB ASP 26 2HB ASP 26 -4.726 0.179 -4.900
175 HD2 ASP 26 HD2 ASP 26 -2.149 -1.313 -4.238
176 H VAL 27 H VAL 27 -5.712 2.689 -4.410
177 HA VAL 27 HA VAL 27 -5.091 3.441 -1.654
178 HB VAL 27 HB VAL 27 -7.342 4.108 -1.399
179 1HG1 VAL 27 1HG1 VAL 27 -7.228 6.054 -3.016
180 2HG1 VAL 27 2HG1 VAL 27 -5.937 5.193 -3.923
181 3HG1 VAL 27 3HG1 VAL 27 -5.645 5.716 -2.226
182 1HG2 VAL 27 1HG2 VAL 27 -8.481 2.506 -2.962
183 2HG2 VAL 27 2HG2 VAL 27 -7.770 3.384 -4.371
184 3HG2 VAL 27 3HG2 VAL 27 -8.918 4.220 -3.269
185 H ARG 28 H ARG 28 -5.778 2.500 0.105
186 HA ARG 28 HA ARG 28 -7.226 -0.062 -0.108
187 1HB ARG 28 1HB ARG 28 -6.108 -0.775 1.987
188 2HB ARG 28 2HB ARG 28 -4.997 -0.624 0.615
189 1HG ARG 28 1HG ARG 28 -3.663 0.789 1.751
190 2HG ARG 28 2HG ARG 28 -5.044 1.916 2.102
191 1HD ARG 28 1HD ARG 28 -4.085 1.158 4.226
192 2HD ARG 28 2HD ARG 28 -5.766 0.500 3.955
193 HE ARG 28 HE ARG 28 -3.590 -1.225 2.962
194 1HH1 ARG 28 1HH1 ARG 28 -5.600 -0.458 5.825
195 2HH1 ARG 28 2HH1 ARG 28 -5.495 -2.070 6.451
196 1HH2 ARG 28 1HH2 ARG 28 -3.483 -3.215 3.749
197 2HH2 ARG 28 2HH2 ARG 28 -4.208 -3.710 5.270
198 H GLU 29 H GLU 29 -8.371 -0.587 1.997
199 HA GLU 29 HA GLU 29 -10.439 1.240 2.282
200 1HB GLU 29 1HB GLU 29 -9.559 -1.246 3.774
201 2HB GLU 29 2HB GLU 29 -11.047 -0.353 4.246
202 1HG GLU 29 1HG GLU 29 -11.873 -0.584 1.804
203 2HG GLU 29 2HG GLU 29 -10.488 -1.696 1.510
204 HE2 GLU 29 HE2 GLU 29 -13.656 -2.860 3.684
205 H SER 30 H SER 30 -7.835 0.566 4.511
206 HA SER 30 HA SER 30 -8.571 2.977 6.064
207 1HB SER 30 1HB SER 30 -8.562 0.127 7.283
208 2HB SER 30 2HB SER 30 -8.751 1.656 8.248
209 HG SER 30 HG SER 30 -10.690 0.661 7.831
210 H CYS 31 H CYS 31 -6.814 1.043 8.203
211 HA CYS 31 HA CYS 31 -4.245 1.825 7.105
212 1HB CYS 31 1HB CYS 31 -5.123 3.712 8.584
213 2HB CYS 31 2HB CYS 31 -5.250 2.500 9.940
214 H HIS 32 H HIS 32 -2.516 0.753 8.617
215 HA HIS 32 HA HIS 32 -3.447 -1.816 9.660
216 1HB HIS 32 1HB HIS 32 -2.852 -2.080 7.199
217 2HB HIS 32 2HB HIS 32 -1.165 -1.521 7.617
218 HD1 HIS 32 HD1 HIS 32 -3.762 -4.124 8.368
219 HD2 HIS 32 HD2 HIS 32 0.416 -3.821 8.446
220 HE1 HIS 32 HE1 HIS 32 -2.890 -6.364 8.953
221 HE2 HIS 32 HE2 HIS 32 -0.352 -6.169 9.026
222 H SER 33 H SER 33 -1.383 -2.851 10.727
223 HA SER 33 HA SER 33 -0.165 -0.895 12.373
224 1HB SER 33 1HB SER 33 0.472 -3.880 12.004
225 2HB SER 33 2HB SER 33 1.213 -2.872 13.295
226 HG SER 33 HG SER 33 -0.804 -4.093 13.776
227 H ALA 34 H ALA 34 1.501 -3.075 9.961
228 HA ALA 34 HA ALA 34 3.910 -2.029 10.095
229 1HB ALA 34 1HB ALA 34 4.311 -2.899 7.800
230 2HB ALA 34 2HB ALA 34 2.531 -2.926 7.478
231 3HB ALA 34 3HB ALA 34 3.259 -4.013 8.717
232 H CYS 35 H CYS 35 1.327 -0.483 8.322
233 HA CYS 35 HA CYS 35 3.146 1.713 7.513
234 1HB CYS 35 1HB CYS 35 1.739 0.890 5.688
235 2HB CYS 35 2HB CYS 35 0.251 1.190 6.698
236 H ASP 36 H ASP 36 3.495 2.560 9.601
237 HA ASP 36 HA ASP 36 1.301 3.197 11.327
238 1HB ASP 36 1HB ASP 36 3.176 4.106 12.788
239 2HB ASP 36 2HB ASP 36 3.418 2.419 12.224
240 HD2 ASP 36 HD2 ASP 36 4.805 5.359 12.420
241 H LYS 37 H LYS 37 2.301 4.686 8.592
242 HA LYS 37 HA LYS 37 1.380 7.334 9.443
243 1HB LYS 37 1HB LYS 37 2.956 8.338 7.820
244 2HB LYS 37 2HB LYS 37 3.777 7.537 9.140
245 1HG LYS 37 1HG LYS 37 3.355 5.939 6.595
246 2HG LYS 37 2HG LYS 37 4.558 7.255 6.614
247 1HD LYS 37 1HD LYS 37 5.878 6.277 8.351
248 2HD LYS 37 2HD LYS 37 4.598 5.118 8.806
249 1HE LYS 37 1HE LYS 37 4.896 3.841 6.699
250 2HE LYS 37 2HE LYS 37 6.151 5.018 6.134
251 1HZ LYS 37 1HZ LYS 37 7.503 4.428 8.008
252 2HZ LYS 37 2HZ LYS 37 7.087 3.034 7.137
253 3HZ LYS 37 3HZ LYS 37 6.315 3.380 8.611
254 H CYS 38 H CYS 38 -0.708 6.177 8.864
255 HA CYS 38 HA CYS 38 -1.248 5.971 6.025
256 1HB CYS 38 1HB CYS 38 -2.777 5.822 8.661
257 2HB CYS 38 2HB CYS 38 -3.627 5.572 7.084
258 H VAL 39 H VAL 39 -2.159 7.491 4.713
259 HA VAL 39 HA VAL 39 -3.421 9.811 5.944
260 HB VAL 39 HB VAL 39 -1.248 10.133 5.058
261 1HG1 VAL 39 1HG1 VAL 39 -1.096 8.548 3.234
262 2HG1 VAL 39 2HG1 VAL 39 -0.741 10.245 2.726
263 3HG1 VAL 39 3HG1 VAL 39 -2.326 9.507 2.284
264 1HG2 VAL 39 1HG2 VAL 39 -2.983 11.947 5.113
265 2HG2 VAL 39 2HG2 VAL 39 -3.464 11.499 3.414
266 3HG2 VAL 39 3HG2 VAL 39 -1.800 12.132 3.747
267 H CYS 40 H CYS 40 -5.631 9.333 5.879
268 HA CYS 40 HA CYS 40 -6.733 8.096 3.507
269 1HB CYS 40 1HB CYS 40 -7.956 8.967 6.116
270 2HB CYS 40 2HB CYS 40 -8.853 8.222 4.793
271 H ALA 41 H ALA 41 -7.764 8.948 1.936
272 HA ALA 41 HA ALA 41 -8.721 11.669 1.888
273 1HB ALA 41 1HB ALA 41 -9.693 11.099 -0.269
274 2HB ALA 41 2HB ALA 41 -9.117 9.384 -0.081
275 3HB ALA 41 3HB ALA 41 -7.923 10.738 -0.230
276 H TYR 42 H TYR 42 -10.701 12.318 2.452
277 HA TYR 42 HA TYR 42 -12.694 10.403 3.276
278 1HB TYR 42 1HB TYR 42 -14.042 12.427 3.836
279 2HB TYR 42 2HB TYR 42 -12.447 12.266 4.642
280 HD1 TYR 42 HD1 TYR 42 -10.608 13.866 4.119
281 HD2 TYR 42 HD2 TYR 42 -14.393 14.140 2.072
282 HE1 TYR 42 HE1 TYR 42 -9.971 16.055 3.191
283 HE2 TYR 42 HE2 TYR 42 -13.715 16.256 1.086
284 HH TYR 42 HH TYR 42 -12.129 17.827 0.896
285 H SER 43 H SER 43 -12.553 9.551 0.978
286 HA SER 43 HA SER 43 -14.448 10.505 -0.910
287 1HB SER 43 1HB SER 43 -13.269 7.745 -0.564
288 2HB SER 43 2HB SER 43 -14.180 8.338 -2.029
289 HG SER 43 HG SER 43 -11.720 8.495 -1.922
290 H ASN 44 H ASN 44 -15.746 7.846 -1.295
291 HA ASN 44 HA ASN 44 -17.407 7.337 0.961
292 1HB ASN 44 1HB ASN 44 -18.694 8.880 -0.525
293 2HB ASN 44 2HB ASN 44 -18.387 7.820 -1.911
294 1HD2 ASN 44 1HD2 ASN 44 -19.241 5.438 -1.555
295 2HD2 ASN 44 2HD2 ASN 44 -20.742 5.255 -0.732
296 HA PRO 45 HA PRO 45 -16.802 5.850 2.164
297 1HB PRO 45 1HB PRO 45 -15.546 3.597 3.072
298 2HB PRO 45 2HB PRO 45 -17.221 3.516 2.515
299 1HG PRO 45 1HG PRO 45 -14.697 2.850 0.889
300 2HG PRO 45 2HG PRO 45 -16.152 1.814 1.107
301 1HD PRO 45 1HD PRO 45 -15.767 3.540 -1.075
302 2HD PRO 45 2HD PRO 45 -17.430 3.142 -0.436
303 HA PRO 46 HA PRO 46 -12.756 7.537 1.991
304 1HB PRO 46 1HB PRO 46 -11.519 7.140 4.462
305 2HB PRO 46 2HB PRO 46 -12.891 8.281 4.207
306 1HG PRO 46 1HG PRO 46 -13.098 5.369 5.138
307 2HG PRO 46 2HG PRO 46 -13.786 6.868 5.919
308 1HD PRO 46 1HD PRO 46 -15.302 5.296 4.303
309 2HD PRO 46 2HD PRO 46 -15.361 7.162 4.098
310 H GLN 47 H GLN 47 -10.462 7.174 1.651
311 HA GLN 47 HA GLN 47 -9.651 4.413 1.425
312 1HB GLN 47 1HB GLN 47 -10.314 6.342 -0.876
313 2HB GLN 47 2HB GLN 47 -9.222 4.982 -1.179
314 1HG GLN 47 1HG GLN 47 -12.113 4.605 -0.134
315 2HG GLN 47 2HG GLN 47 -11.741 4.804 -1.870
316 1HE2 GLN 47 1HE2 GLN 47 -9.322 2.799 -0.182
317 2HE2 GLN 47 2HE2 GLN 47 -9.939 1.353 -0.894
318 H CYS 48 H CYS 48 -7.341 4.346 0.911
319 HA CYS 48 HA CYS 48 -6.047 6.791 1.946
320 1HB CYS 48 1HB CYS 48 -6.229 4.028 3.304
321 2HB CYS 48 2HB CYS 48 -5.448 5.491 4.006
322 H GLN 49 H GLN 49 -3.900 6.768 2.136
323 HA GLN 49 HA GLN 49 -2.389 4.691 0.721
324 1HB GLN 49 1HB GLN 49 -2.601 7.721 0.433
325 2HB GLN 49 2HB GLN 49 -1.102 6.893 -0.141
326 1HG GLN 49 1HG GLN 49 -2.218 5.757 -1.914
327 2HG GLN 49 2HG GLN 49 -3.839 5.992 -1.185
328 1HE2 GLN 49 1HE2 GLN 49 -4.616 8.270 -0.990
329 2HE2 GLN 49 2HE2 GLN 49 -4.276 9.325 -2.331
330 H CYS 50 H CYS 50 -0.005 5.159 1.172
331 HA CYS 50 HA CYS 50 0.346 5.900 4.036
332 1HB CYS 50 1HB CYS 50 2.112 4.299 2.104
333 2HB CYS 50 2HB CYS 50 2.641 4.781 3.735
334 H TYR 51 H TYR 51 1.454 7.626 4.639
335 HA TYR 51 HA TYR 51 2.018 9.770 2.993
336 1HB TYR 51 1HB TYR 51 2.779 8.800 5.764
337 2HB TYR 51 2HB TYR 51 3.791 10.116 5.136
338 HD1 TYR 51 HD1 TYR 51 2.665 12.206 4.146
339 HD2 TYR 51 HD2 TYR 51 0.602 9.447 6.761
340 HE1 TYR 51 HE1 TYR 51 1.238 13.975 4.888
341 HE2 TYR 51 HE2 TYR 51 -0.770 11.245 7.570
342 HH TYR 51 HH TYR 51 -0.656 14.500 6.042
343 H ASP 52 H ASP 52 4.322 7.609 4.451
344 HA ASP 52 HA ASP 52 6.496 8.659 2.764
345 1HB ASP 52 1HB ASP 52 6.514 8.578 5.425
346 2HB ASP 52 2HB ASP 52 6.844 6.829 5.210
347 HD2 ASP 52 HD2 ASP 52 10.141 7.406 4.613
348 H THR 53 H THR 53 8.215 7.032 2.127
349 HA THR 53 HA THR 53 7.177 4.906 0.627
350 HB THR 53 HB THR 53 9.798 4.371 0.601
351 HG1 THR 53 HG1 THR 53 10.940 6.329 1.088
352 1HG2 THR 53 1HG2 THR 53 8.569 6.971 -0.554
353 2HG2 THR 53 2HG2 THR 53 8.465 5.337 -1.304
354 3HG2 THR 53 3HG2 THR 53 10.059 6.152 -1.148
355 H HIS 54 H HIS 54 7.868 2.630 0.792
356 HA HIS 54 HA HIS 54 8.848 1.776 3.311
357 1HB HIS 54 1HB HIS 54 6.488 1.715 3.908
358 2HB HIS 54 2HB HIS 54 6.103 0.778 2.405
359 HD1 HIS 54 HD1 HIS 54 6.212 -1.584 2.440
360 HD2 HIS 54 HD2 HIS 54 7.881 -0.067 5.986
361 HE1 HIS 54 HE1 HIS 54 6.590 -3.525 3.973
362 HE2 HIS 54 HE2 HIS 54 7.619 -2.579 6.102
363 H LYS 55 H LYS 55 10.194 0.208 3.067
364 HA LYS 55 HA LYS 55 10.884 -0.491 0.414
365 1HB LYS 55 1HB LYS 55 12.832 -1.551 1.357
366 2HB LYS 55 2HB LYS 55 12.536 0.038 2.114
367 1HG LYS 55 1HG LYS 55 11.679 -1.040 4.178
368 2HG LYS 55 2HG LYS 55 11.790 -2.665 3.420
369 1HD LYS 55 1HD LYS 55 14.212 -2.516 3.281
370 2HD LYS 55 2HD LYS 55 14.188 -0.763 3.724
371 1HE LYS 55 1HE LYS 55 13.379 -1.274 5.999
372 2HE LYS 55 2HE LYS 55 13.266 -3.035 5.602
373 1HZ LYS 55 1HZ LYS 55 15.284 -2.495 6.788
374 2HZ LYS 55 2HZ LYS 55 15.756 -1.397 5.586
375 3HZ LYS 55 3HZ LYS 55 15.644 -3.051 5.227
376 H PHE 56 H PHE 56 8.365 -1.617 0.681
377 HA PHE 56 HA PHE 56 8.976 -4.302 -0.079
378 1HB PHE 56 1HB PHE 56 8.708 -4.162 2.648
379 2HB PHE 56 2HB PHE 56 6.962 -4.268 2.231
380 HD1 PHE 56 HD1 PHE 56 6.057 -6.410 1.518
381 HD2 PHE 56 HD2 PHE 56 10.312 -5.826 1.772
382 HE1 PHE 56 HE1 PHE 56 6.397 -8.842 1.320
383 HE2 PHE 56 HE2 PHE 56 10.653 -8.247 1.545
384 HZ PHE 56 HZ PHE 56 8.692 -9.775 1.343
385 H CYS 57 H CYS 57 7.365 -5.240 -1.324
386 HA CYS 57 HA CYS 57 4.739 -3.912 -1.409
387 1HB CYS 57 1HB CYS 57 6.137 -5.401 -3.683
388 2HB CYS 57 2HB CYS 57 4.507 -4.650 -3.753
389 H TYR 58 H TYR 58 3.386 -5.168 -0.359
390 HA TYR 58 HA TYR 58 3.993 -7.966 0.176
391 1HB TYR 58 1HB TYR 58 1.729 -6.052 0.993
392 2HB TYR 58 2HB TYR 58 1.690 -7.781 1.411
393 HD1 TYR 58 HD1 TYR 58 3.068 -4.565 2.417
394 HD2 TYR 58 HD2 TYR 58 3.697 -8.839 2.619
395 HE1 TYR 58 HE1 TYR 58 4.502 -4.285 4.373
396 HE2 TYR 58 HE2 TYR 58 5.135 -8.547 4.516
397 HH TYR 58 HH TYR 58 6.195 -7.091 5.863
398 H LYS 59 H LYS 59 2.187 -9.573 0.050
399 HA LYS 59 HA LYS 59 1.582 -10.252 -2.480
400 1HB LYS 59 1HB LYS 59 0.146 -10.988 0.097
401 2HB LYS 59 2HB LYS 59 -0.110 -11.825 -1.477
402 1HG LYS 59 1HG LYS 59 2.319 -12.488 -1.519
403 2HG LYS 59 2HG LYS 59 2.561 -11.728 0.089
404 1HD LYS 59 1HD LYS 59 0.776 -13.209 1.050
405 2HD LYS 59 2HD LYS 59 0.639 -14.043 -0.538
406 1HE LYS 59 1HE LYS 59 3.057 -14.759 -0.361
407 2HE LYS 59 2HE LYS 59 3.184 -13.867 1.209
408 1HZ LYS 59 1HZ LYS 59 2.798 -16.128 1.658
409 2HZ LYS 59 2HZ LYS 59 1.478 -16.219 0.592
410 3HZ LYS 59 3HZ LYS 59 1.358 -15.304 2.016
411 H ALA 60 H ALA 60 -0.327 -10.547 -3.689
412 HA ALA 60 HA ALA 60 -1.663 -8.185 -4.135
413 1HB ALA 60 1HB ALA 60 -2.922 -9.463 -5.836
414 2HB ALA 60 2HB ALA 60 -2.374 -11.009 -5.068
415 3HB ALA 60 3HB ALA 60 -1.171 -9.915 -5.836
416 H CYS 61 H CYS 61 -3.441 -7.216 -3.547
417 HA CYS 61 HA CYS 61 -4.876 -8.456 -1.361
418 1HB CYS 61 1HB CYS 61 -3.862 -5.975 -1.584
419 2HB CYS 61 2HB CYS 61 -5.476 -5.619 -2.238
420 H HIS 62 H HIS 62 -7.177 -7.610 -1.164
421 HA HIS 62 HA HIS 62 -8.667 -7.954 -3.669
422 1HB HIS 62 1HB HIS 62 -9.344 -9.416 -1.047
423 2HB HIS 62 2HB HIS 62 -10.145 -9.631 -2.642
424 HD1 HIS 62 HD1 HIS 62 -8.668 -10.808 -4.484
425 HD2 HIS 62 HD2 HIS 62 -6.814 -10.724 -0.722
426 HE1 HIS 62 HE1 HIS 62 -6.658 -12.295 -4.622
427 HE2 HIS 62 HE2 HIS 62 -5.520 -12.188 -2.347
428 H ASN 63 H ASN 63 -10.662 -6.755 -3.637
429 HA ASN 63 HA ASN 63 -12.057 -6.096 -1.519
430 1HB ASN 63 1HB ASN 63 -11.918 -3.559 -1.379
431 2HB ASN 63 2HB ASN 63 -10.669 -4.479 -0.508
432 1HD2 ASN 63 1HD2 ASN 63 -8.397 -4.386 -1.426
433 2HD2 ASN 63 2HD2 ASN 63 -8.005 -3.101 -2.517
434 H SER 64 H SER 64 -11.044 -4.532 -4.492
435 HA SER 64 HA SER 64 -13.824 -4.853 -5.478
436 1HB SER 64 1HB SER 64 -13.254 -2.557 -4.312
437 2HB SER 64 2HB SER 64 -12.298 -2.206 -5.785
438 HG SER 64 HG SER 64 -14.467 -1.415 -5.843
439 H GLU 65 H GLU 65 -10.870 -5.839 -6.163
440 HA GLU 65 HA GLU 65 -10.310 -5.047 -8.739
441 1HB GLU 65 1HB GLU 65 -8.722 -6.737 -8.839
442 2HB GLU 65 2HB GLU 65 -8.777 -6.250 -7.132
443 1HG GLU 65 1HG GLU 65 -10.090 -8.801 -8.343
444 2HG GLU 65 2HG GLU 65 -8.494 -8.715 -7.525
445 HE2 GLU 65 HE2 GLU 65 -10.113 -10.418 -6.789
446 H ILE 66 H ILE 66 -12.638 -7.181 -7.582
447 HA ILE 66 HA ILE 66 -14.126 -7.233 -9.938
448 HB ILE 66 HB ILE 66 -12.540 -9.139 -10.299
449 1HG1 ILE 66 1HG1 ILE 66 -15.485 -9.967 -10.036
450 2HG1 ILE 66 2HG1 ILE 66 -14.807 -8.921 -11.321
451 1HG2 ILE 66 1HG2 ILE 66 -12.378 -9.822 -7.850
452 2HG2 ILE 66 2HG2 ILE 66 -12.752 -11.180 -8.971
453 3HG2 ILE 66 3HG2 ILE 66 -14.051 -10.482 -7.959
454 1HD1 ILE 66 1HD1 ILE 66 -14.997 -11.267 -12.130
455 2HD1 ILE 66 2HD1 ILE 66 -14.029 -11.866 -10.739
456 3HD1 ILE 66 3HD1 ILE 66 -13.253 -10.830 -11.993
457 H GLU 67 H GLU 67 -16.086 -8.934 -8.970
458 HA GLU 67 HA GLU 67 -17.145 -7.444 -6.755
459 1HB GLU 67 1HB GLU 67 -18.024 -10.141 -7.946
460 2HB GLU 67 2HB GLU 67 -18.953 -9.210 -6.743
461 1HG GLU 67 1HG GLU 67 -19.283 -7.321 -8.327
462 2HG GLU 67 2HG GLU 67 -18.293 -8.137 -9.586
463 HE2 GLU 67 HE2 GLU 67 -20.706 -10.585 -10.201
Start of MODEL 19
1 1H GLY 1 1H GLY 1 -1.220 1.754 17.760
2 2H GLY 1 2H GLY 1 -2.082 2.555 18.985
3 3H GLY 1 3H GLY 1 -2.695 2.517 17.408
4 1HA GLY 1 1HA GLY 1 -2.296 0.179 19.142
5 2HA GLY 1 2HA GLY 1 -3.868 1.020 18.797
6 H ASP 2 H ASP 2 -1.103 -0.552 17.213
7 HA ASP 2 HA ASP 2 -2.815 -1.885 15.257
8 1HB ASP 2 1HB ASP 2 -0.513 0.020 14.383
9 2HB ASP 2 2HB ASP 2 -1.567 -0.955 13.301
10 HD2 ASP 2 HD2 ASP 2 -4.212 1.344 13.653
11 H ASP 3 H ASP 3 -1.969 -3.945 15.318
12 HA ASP 3 HA ASP 3 0.894 -4.348 15.265
13 1HB ASP 3 1HB ASP 3 0.701 -5.885 17.344
14 2HB ASP 3 2HB ASP 3 0.780 -4.122 17.602
15 HD2 ASP 3 HD2 ASP 3 -2.280 -3.841 19.071
16 H VAL 4 H VAL 4 -0.347 -4.897 13.174
17 HA VAL 4 HA VAL 4 -0.485 -7.770 13.111
18 HB VAL 4 HB VAL 4 -2.777 -7.004 13.417
19 1HG1 VAL 4 1HG1 VAL 4 -3.996 -5.877 11.553
20 2HG1 VAL 4 2HG1 VAL 4 -2.462 -5.681 10.633
21 3HG1 VAL 4 3HG1 VAL 4 -2.701 -4.814 12.204
22 1HG2 VAL 4 1HG2 VAL 4 -3.748 -8.418 11.618
23 2HG2 VAL 4 2HG2 VAL 4 -2.230 -9.159 12.240
24 3HG2 VAL 4 3HG2 VAL 4 -2.237 -8.289 10.654
25 H LYS 5 H LYS 5 0.581 -8.590 11.445
26 HA LYS 5 HA LYS 5 2.004 -6.749 9.729
27 1HB LYS 5 1HB LYS 5 2.039 -9.775 10.176
28 2HB LYS 5 2HB LYS 5 2.994 -9.064 8.861
29 1HG LYS 5 1HG LYS 5 3.269 -8.079 11.739
30 2HG LYS 5 2HG LYS 5 4.193 -9.491 11.118
31 1HD LYS 5 1HD LYS 5 5.309 -8.196 9.424
32 2HD LYS 5 2HD LYS 5 4.288 -6.747 9.701
33 1HE LYS 5 1HE LYS 5 6.211 -7.928 11.816
34 2HE LYS 5 2HE LYS 5 6.620 -6.574 10.689
35 1HZ LYS 5 1HZ LYS 5 4.803 -5.322 11.604
36 2HZ LYS 5 2HZ LYS 5 5.895 -5.787 12.817
37 3HZ LYS 5 3HZ LYS 5 4.402 -6.580 12.666
38 H SER 6 H SER 6 -0.672 -8.976 9.383
39 HA SER 6 HA SER 6 -0.692 -9.393 6.685
40 1HB SER 6 1HB SER 6 -3.170 -9.127 8.453
41 2HB SER 6 2HB SER 6 -3.035 -9.984 6.865
42 HG SER 6 HG SER 6 -2.839 -11.413 8.613
43 H ALA 7 H ALA 7 -0.411 -7.814 5.240
44 HA ALA 7 HA ALA 7 -2.503 -5.773 4.947
45 1HB ALA 7 1HB ALA 7 0.583 -5.590 4.632
46 2HB ALA 7 2HB ALA 7 -0.363 -4.795 5.931
47 3HB ALA 7 3HB ALA 7 -0.557 -4.232 4.224
48 H CYS 8 H CYS 8 -2.654 -5.037 2.708
49 HA CYS 8 HA CYS 8 -1.289 -6.773 0.752
50 1HB CYS 8 1HB CYS 8 -4.095 -5.624 0.350
51 2HB CYS 8 2HB CYS 8 -3.135 -6.557 -0.845
52 H CYS 9 H CYS 9 -0.563 -5.742 -1.145
53 HA CYS 9 HA CYS 9 -0.809 -2.817 -1.277
54 1HB CYS 9 1HB CYS 9 1.085 -3.352 0.289
55 2HB CYS 9 2HB CYS 9 1.795 -4.403 -0.959
56 H ASP 10 H ASP 10 -2.087 -3.601 -3.175
57 HA ASP 10 HA ASP 10 -0.804 -5.262 -5.052
58 1HB ASP 10 1HB ASP 10 -2.940 -5.165 -6.243
59 2HB ASP 10 2HB ASP 10 -3.135 -5.509 -4.526
60 HD2 ASP 10 HD2 ASP 10 -4.672 -2.441 -3.832
61 H THR 11 H THR 11 0.129 -2.431 -4.619
62 HA THR 11 HA THR 11 1.203 -2.111 -7.220
63 HB THR 11 HB THR 11 -0.302 0.391 -6.340
64 HG1 THR 11 HG1 THR 11 -1.746 -1.270 -7.115
65 1HG2 THR 11 1HG2 THR 11 1.825 0.608 -7.783
66 2HG2 THR 11 2HG2 THR 11 0.334 1.061 -8.687
67 3HG2 THR 11 3HG2 THR 11 1.098 -0.554 -8.939
68 H CYS 12 H CYS 12 2.933 -2.572 -6.121
69 HA CYS 12 HA CYS 12 4.083 -0.737 -4.171
70 1HB CYS 12 1HB CYS 12 5.149 -3.213 -5.674
71 2HB CYS 12 2HB CYS 12 6.121 -2.276 -4.443
72 H LEU 13 H LEU 13 4.601 1.247 -5.072
73 HA LEU 13 HA LEU 13 6.019 1.276 -7.668
74 1HB LEU 13 1HB LEU 13 4.292 2.960 -7.241
75 2HB LEU 13 2HB LEU 13 5.182 3.562 -5.806
76 HG LEU 13 HG LEU 13 6.493 3.505 -8.586
77 1HD1 LEU 13 1HD1 LEU 13 4.184 4.553 -8.791
78 2HD1 LEU 13 2HD1 LEU 13 5.538 5.704 -9.128
79 3HD1 LEU 13 3HD1 LEU 13 4.666 5.765 -7.557
80 1HD2 LEU 13 1HD2 LEU 13 7.943 4.222 -6.620
81 2HD2 LEU 13 2HD2 LEU 13 6.725 5.474 -6.205
82 3HD2 LEU 13 3HD2 LEU 13 7.637 5.581 -7.755
83 H CYS 14 H CYS 14 8.230 1.470 -7.743
84 HA CYS 14 HA CYS 14 9.682 2.021 -5.298
85 1HB CYS 14 1HB CYS 14 10.021 -0.455 -7.067
86 2HB CYS 14 2HB CYS 14 11.159 0.003 -5.790
87 H THR 15 H THR 15 11.397 3.204 -5.588
88 HA THR 15 HA THR 15 11.836 4.169 -8.279
89 HB THR 15 HB THR 15 13.457 5.702 -7.302
90 HG1 THR 15 HG1 THR 15 13.641 5.778 -5.074
91 1HG2 THR 15 1HG2 THR 15 10.964 6.181 -7.350
92 2HG2 THR 15 2HG2 THR 15 11.810 6.993 -5.984
93 3HG2 THR 15 3HG2 THR 15 10.815 5.518 -5.678
94 H ARG 16 H ARG 16 14.063 4.539 -9.117
95 HA ARG 16 HA ARG 16 15.615 2.086 -8.946
96 1HB ARG 16 1HB ARG 16 16.936 2.818 -10.754
97 2HB ARG 16 2HB ARG 16 15.204 3.002 -11.169
98 1HG ARG 16 1HG ARG 16 15.360 5.269 -11.442
99 2HG ARG 16 2HG ARG 16 16.478 5.481 -10.049
100 1HD ARG 16 1HD ARG 16 18.344 4.452 -11.484
101 2HD ARG 16 2HD ARG 16 17.206 4.428 -12.868
102 HE ARG 16 HE ARG 16 17.564 6.694 -13.142
103 1HH1 ARG 16 1HH1 ARG 16 18.576 5.931 -9.756
104 2HH1 ARG 16 2HH1 ARG 16 19.243 7.505 -9.507
105 1HH2 ARG 16 1HH2 ARG 16 18.436 8.765 -12.710
106 2HH2 ARG 16 2HH2 ARG 16 19.148 9.124 -11.178
107 H SER 17 H SER 17 15.470 3.947 -6.650
108 HA SER 17 HA SER 17 18.090 4.922 -6.181
109 1HB SER 17 1HB SER 17 15.940 5.584 -4.856
110 2HB SER 17 2HB SER 17 16.298 4.162 -3.831
111 HG SER 17 HG SER 17 17.237 6.142 -3.087
112 H GLN 18 H GLN 18 18.765 3.904 -3.636
113 HA GLN 18 HA GLN 18 19.523 1.104 -4.025
114 1HB GLN 18 1HB GLN 18 21.503 3.458 -3.749
115 2HB GLN 18 2HB GLN 18 21.931 1.741 -3.547
116 1HG GLN 18 1HG GLN 18 22.759 2.174 -5.668
117 2HG GLN 18 2HG GLN 18 21.206 1.358 -6.008
118 1HE2 GLN 18 1HE2 GLN 18 21.333 4.851 -5.052
119 2HE2 GLN 18 2HE2 GLN 18 20.987 5.448 -6.654
120 HA PRO 19 HA PRO 19 18.502 -0.284 -2.732
121 1HB PRO 19 1HB PRO 19 16.781 -0.974 -0.677
122 2HB PRO 19 2HB PRO 19 18.573 -1.294 -0.545
123 1HG PRO 19 1HG PRO 19 17.027 1.136 0.543
124 2HG PRO 19 2HG PRO 19 18.115 0.013 1.459
125 1HD PRO 19 1HD PRO 19 18.999 2.407 0.355
126 2HD PRO 19 2HD PRO 19 20.079 0.938 0.397
127 HA PRO 20 HA PRO 20 15.264 1.998 -4.388
128 1HB PRO 20 1HB PRO 20 13.236 0.252 -5.049
129 2HB PRO 20 2HB PRO 20 14.886 0.149 -5.767
130 1HG PRO 20 1HG PRO 20 13.863 -1.401 -3.326
131 2HG PRO 20 2HG PRO 20 14.572 -2.082 -4.856
132 1HD PRO 20 1HD PRO 20 16.152 -1.640 -2.662
133 2HD PRO 20 2HD PRO 20 16.767 -1.180 -4.326
134 H THR 21 H THR 21 13.781 3.468 -3.788
135 HA THR 21 HA THR 21 12.578 3.167 -1.178
136 HB THR 21 HB THR 21 12.315 5.431 -3.196
137 HG1 THR 21 HG1 THR 21 13.738 6.404 -1.637
138 1HG2 THR 21 1HG2 THR 21 10.431 5.343 -1.480
139 2HG2 THR 21 2HG2 THR 21 11.562 6.695 -1.139
140 3HG2 THR 21 3HG2 THR 21 11.659 5.176 -0.174
141 H CYS 22 H CYS 22 10.912 1.806 -1.062
142 HA CYS 22 HA CYS 22 8.940 1.844 -3.228
143 1HB CYS 22 1HB CYS 22 9.228 -0.204 -0.982
144 2HB CYS 22 2HB CYS 22 7.996 -0.250 -2.232
145 H ARG 23 H ARG 23 6.697 1.550 -2.675
146 HA ARG 23 HA ARG 23 5.565 2.676 -0.298
147 1HB ARG 23 1HB ARG 23 5.982 4.298 -2.874
148 2HB ARG 23 2HB ARG 23 4.440 4.474 -1.986
149 1HG ARG 23 1HG ARG 23 5.791 5.029 0.125
150 2HG ARG 23 2HG ARG 23 7.214 5.248 -0.963
151 1HD ARG 23 1HD ARG 23 6.111 7.438 -0.561
152 2HD ARG 23 2HD ARG 23 5.819 6.939 -2.291
153 HE ARG 23 HE ARG 23 3.853 6.212 -0.135
154 1HH1 ARG 23 1HH1 ARG 23 4.339 8.271 -3.068
155 2HH1 ARG 23 2HH1 ARG 23 2.687 8.205 -3.484
156 1HH2 ARG 23 1HH2 ARG 23 1.792 6.177 -0.683
157 2HH2 ARG 23 2HH2 ARG 23 1.132 6.988 -2.075
158 H CYS 24 H CYS 24 3.356 2.318 -0.317
159 HA CYS 24 HA CYS 24 2.322 0.701 -2.551
160 1HB CYS 24 1HB CYS 24 1.088 1.353 0.196
161 2HB CYS 24 2HB CYS 24 0.359 0.285 -1.036
162 H VAL 25 H VAL 25 1.922 2.225 -4.155
163 HA VAL 25 HA VAL 25 0.693 4.717 -3.554
164 HB VAL 25 HB VAL 25 0.473 5.132 -5.918
165 1HG1 VAL 25 1HG1 VAL 25 2.546 5.642 -4.611
166 2HG1 VAL 25 2HG1 VAL 25 2.930 5.176 -6.307
167 3HG1 VAL 25 3HG1 VAL 25 3.192 3.994 -4.963
168 1HG2 VAL 25 1HG2 VAL 25 1.697 2.308 -6.268
169 2HG2 VAL 25 2HG2 VAL 25 1.422 3.530 -7.558
170 3HG2 VAL 25 3HG2 VAL 25 0.016 2.791 -6.734
171 H ASP 26 H ASP 26 -0.550 1.622 -4.059
172 HA ASP 26 HA ASP 26 -3.235 2.470 -4.647
173 1HB ASP 26 1HB ASP 26 -2.161 0.226 -5.358
174 2HB ASP 26 2HB ASP 26 -2.405 -0.333 -3.669
175 HD2 ASP 26 HD2 ASP 26 -5.468 0.139 -6.249
176 H VAL 27 H VAL 27 -5.044 2.346 -3.270
177 HA VAL 27 HA VAL 27 -4.424 2.607 -0.428
178 HB VAL 27 HB VAL 27 -6.475 3.762 -0.177
179 1HG1 VAL 27 1HG1 VAL 27 -5.061 4.720 -2.753
180 2HG1 VAL 27 2HG1 VAL 27 -4.382 4.888 -1.091
181 3HG1 VAL 27 3HG1 VAL 27 -5.909 5.731 -1.523
182 1HG2 VAL 27 1HG2 VAL 27 -7.975 2.509 -1.678
183 2HG2 VAL 27 2HG2 VAL 27 -7.080 3.095 -3.135
184 3HG2 VAL 27 3HG2 VAL 27 -7.973 4.244 -2.089
185 H ARG 28 H ARG 28 -5.835 1.857 1.210
186 HA ARG 28 HA ARG 28 -7.458 -0.488 0.493
187 1HB ARG 28 1HB ARG 28 -5.896 0.241 3.005
188 2HB ARG 28 2HB ARG 28 -7.326 -0.841 3.111
189 1HG ARG 28 1HG ARG 28 -5.326 -2.144 3.164
190 2HG ARG 28 2HG ARG 28 -6.372 -2.551 1.752
191 1HD ARG 28 1HD ARG 28 -3.934 -2.567 1.149
192 2HD ARG 28 2HD ARG 28 -4.789 -1.205 0.287
193 HE ARG 28 HE ARG 28 -3.904 -0.271 2.819
194 1HH1 ARG 28 1HH1 ARG 28 -2.470 -1.258 -0.291
195 2HH1 ARG 28 2HH1 ARG 28 -1.586 0.225 -0.464
196 1HH2 ARG 28 1HH2 ARG 28 -2.793 1.558 2.591
197 2HH2 ARG 28 2HH2 ARG 28 -1.665 1.855 1.278
198 H GLU 29 H GLU 29 -9.341 -0.657 1.861
199 HA GLU 29 HA GLU 29 -11.017 1.549 2.091
200 1HB GLU 29 1HB GLU 29 -10.923 -1.237 3.312
201 2HB GLU 29 2HB GLU 29 -12.309 -0.138 3.600
202 1HG GLU 29 1HG GLU 29 -12.541 0.100 1.029
203 2HG GLU 29 2HG GLU 29 -11.389 -1.263 0.859
204 HE2 GLU 29 HE2 GLU 29 -14.915 -2.340 0.791
205 H SER 30 H SER 30 -8.583 0.509 4.227
206 HA SER 30 HA SER 30 -9.169 2.504 6.240
207 1HB SER 30 1HB SER 30 -9.287 -0.547 6.873
208 2HB SER 30 2HB SER 30 -9.248 0.733 8.144
209 HG SER 30 HG SER 30 -11.340 -0.107 7.644
210 H CYS 31 H CYS 31 -7.517 2.186 8.178
211 HA CYS 31 HA CYS 31 -4.932 1.919 7.054
212 1HB CYS 31 1HB CYS 31 -5.936 2.309 9.912
213 2HB CYS 31 2HB CYS 31 -4.175 2.393 9.443
214 H HIS 32 H HIS 32 -5.144 -0.305 6.272
215 HA HIS 32 HA HIS 32 -3.370 -1.736 8.110
216 1HB HIS 32 1HB HIS 32 -5.475 -3.083 6.354
217 2HB HIS 32 2HB HIS 32 -4.041 -3.932 7.088
218 HD1 HIS 32 HD1 HIS 32 -7.347 -3.864 7.641
219 HD2 HIS 32 HD2 HIS 32 -4.194 -2.782 10.166
220 HE1 HIS 32 HE1 HIS 32 -8.198 -4.061 9.976
221 HE2 HIS 32 HE2 HIS 32 -6.261 -3.424 11.512
222 H SER 33 H SER 33 -2.096 -0.214 7.055
223 HA SER 33 HA SER 33 -1.113 -1.201 4.458
224 1HB SER 33 1HB SER 33 -0.320 1.050 3.946
225 2HB SER 33 2HB SER 33 -1.971 1.255 4.627
226 HG SER 33 HG SER 33 -0.719 2.718 5.651
227 H ALA 34 H ALA 34 1.532 -0.205 4.552
228 HA ALA 34 HA ALA 34 2.631 -1.265 7.039
229 1HB ALA 34 1HB ALA 34 2.670 -3.059 5.278
230 2HB ALA 34 2HB ALA 34 4.342 -2.474 5.648
231 3HB ALA 34 3HB ALA 34 3.488 -1.910 4.150
232 H CYS 35 H CYS 35 2.147 1.277 6.825
233 HA CYS 35 HA CYS 35 4.773 2.541 6.399
234 1HB CYS 35 1HB CYS 35 1.930 3.472 5.714
235 2HB CYS 35 2HB CYS 35 3.283 4.644 5.851
236 H ASP 36 H ASP 36 5.209 4.329 7.850
237 HA ASP 36 HA ASP 36 3.963 4.268 10.356
238 1HB ASP 36 1HB ASP 36 6.288 5.144 9.922
239 2HB ASP 36 2HB ASP 36 5.597 6.611 9.163
240 HD2 ASP 36 HD2 ASP 36 6.104 7.745 12.424
241 H LYS 37 H LYS 37 3.499 6.840 7.798
242 HA LYS 37 HA LYS 37 1.125 7.670 9.194
243 1HB LYS 37 1HB LYS 37 3.000 9.163 8.218
244 2HB LYS 37 2HB LYS 37 2.260 8.865 6.651
245 1HG LYS 37 1HG LYS 37 1.382 10.933 7.442
246 2HG LYS 37 2HG LYS 37 0.034 9.786 7.719
247 1HD LYS 37 1HD LYS 37 0.557 9.690 10.143
248 2HD LYS 37 2HD LYS 37 2.169 10.436 9.876
249 1HE LYS 37 1HE LYS 37 0.694 12.080 10.918
250 2HE LYS 37 2HE LYS 37 1.117 12.601 9.240
251 1HZ LYS 37 1HZ LYS 37 -1.413 11.293 10.107
252 2HZ LYS 37 2HZ LYS 37 -1.019 11.736 8.514
253 3HZ LYS 37 3HZ LYS 37 -1.188 12.929 9.708
254 H CYS 38 H CYS 38 -0.696 6.536 8.881
255 HA CYS 38 HA CYS 38 -1.587 5.875 6.187
256 1HB CYS 38 1HB CYS 38 -1.955 4.376 8.238
257 2HB CYS 38 2HB CYS 38 -2.873 5.731 8.985
258 H VAL 39 H VAL 39 -2.390 7.651 4.988
259 HA VAL 39 HA VAL 39 -3.930 9.639 6.527
260 HB VAL 39 HB VAL 39 -1.717 9.819 4.738
261 1HG1 VAL 39 1HG1 VAL 39 -2.608 11.303 2.983
262 2HG1 VAL 39 2HG1 VAL 39 -4.283 10.927 3.462
263 3HG1 VAL 39 3HG1 VAL 39 -3.231 9.614 2.806
264 1HG2 VAL 39 1HG2 VAL 39 -2.288 11.378 6.626
265 2HG2 VAL 39 2HG2 VAL 39 -3.706 11.973 5.661
266 3HG2 VAL 39 3HG2 VAL 39 -2.034 12.236 5.055
267 H CYS 40 H CYS 40 -6.133 10.109 5.534
268 HA CYS 40 HA CYS 40 -6.840 8.211 3.387
269 1HB CYS 40 1HB CYS 40 -8.330 8.628 5.995
270 2HB CYS 40 2HB CYS 40 -8.892 7.619 4.664
271 H ALA 41 H ALA 41 -7.950 9.071 1.893
272 HA ALA 41 HA ALA 41 -9.203 11.649 2.147
273 1HB ALA 41 1HB ALA 41 -8.294 10.866 -0.026
274 2HB ALA 41 2HB ALA 41 -10.007 11.397 -0.073
275 3HB ALA 41 3HB ALA 41 -9.611 9.632 -0.093
276 H TYR 42 H TYR 42 -11.182 12.141 2.637
277 HA TYR 42 HA TYR 42 -12.588 10.279 4.179
278 1HB TYR 42 1HB TYR 42 -13.927 12.475 4.747
279 2HB TYR 42 2HB TYR 42 -12.154 12.403 5.067
280 HD1 TYR 42 HD1 TYR 42 -14.632 13.532 2.449
281 HD2 TYR 42 HD2 TYR 42 -10.642 13.972 4.035
282 HE1 TYR 42 HE1 TYR 42 -14.232 15.436 0.960
283 HE2 TYR 42 HE2 TYR 42 -10.258 15.861 2.553
284 HH TYR 42 HH TYR 42 -12.896 17.180 0.510
285 H SER 43 H SER 43 -12.814 10.737 1.079
286 HA SER 43 HA SER 43 -15.483 10.832 0.320
287 1HB SER 43 1HB SER 43 -13.249 9.228 -1.062
288 2HB SER 43 2HB SER 43 -14.791 9.883 -1.810
289 HG SER 43 HG SER 43 -12.946 11.184 -2.210
290 H ASN 44 H ASN 44 -16.800 9.156 -0.654
291 HA ASN 44 HA ASN 44 -16.691 6.625 0.683
292 1HB ASN 44 1HB ASN 44 -18.923 6.291 -0.172
293 2HB ASN 44 2HB ASN 44 -18.757 7.853 0.619
294 1HD2 ASN 44 1HD2 ASN 44 -19.513 6.373 -2.535
295 2HD2 ASN 44 2HD2 ASN 44 -19.879 7.875 -3.293
296 HA PRO 45 HA PRO 45 -16.024 4.763 0.794
297 1HB PRO 45 1HB PRO 45 -14.451 2.582 0.309
298 2HB PRO 45 2HB PRO 45 -16.145 2.594 -0.206
299 1HG PRO 45 1HG PRO 45 -13.705 3.297 -1.937
300 2HG PRO 45 2HG PRO 45 -15.017 2.130 -2.328
301 1HD PRO 45 1HD PRO 45 -15.012 4.807 -3.180
302 2HD PRO 45 2HD PRO 45 -16.560 3.911 -2.829
303 HA PRO 46 HA PRO 46 -12.431 6.977 1.595
304 1HB PRO 46 1HB PRO 46 -11.263 5.777 3.878
305 2HB PRO 46 2HB PRO 46 -12.701 6.863 3.853
306 1HG PRO 46 1HG PRO 46 -12.676 3.815 3.802
307 2HG PRO 46 2HG PRO 46 -13.667 4.941 4.843
308 1HD PRO 46 1HD PRO 46 -14.681 3.746 2.582
309 2HD PRO 46 2HD PRO 46 -15.036 5.562 2.936
310 H GLN 47 H GLN 47 -10.168 7.232 1.414
311 HA GLN 47 HA GLN 47 -8.920 4.914 0.037
312 1HB GLN 47 1HB GLN 47 -8.624 7.844 -0.748
313 2HB GLN 47 2HB GLN 47 -8.010 6.413 -1.632
314 1HG GLN 47 1HG GLN 47 -11.035 6.948 -1.234
315 2HG GLN 47 2HG GLN 47 -10.086 7.610 -2.595
316 1HE2 GLN 47 1HE2 GLN 47 -10.890 4.432 -1.036
317 2HE2 GLN 47 2HE2 GLN 47 -10.762 3.511 -2.501
318 H CYS 48 H CYS 48 -7.905 4.222 1.806
319 HA CYS 48 HA CYS 48 -6.217 6.070 3.288
320 1HB CYS 48 1HB CYS 48 -6.851 3.155 3.814
321 2HB CYS 48 2HB CYS 48 -5.696 4.166 4.766
322 H GLN 49 H GLN 49 -4.322 6.599 2.786
323 HA GLN 49 HA GLN 49 -2.837 5.058 0.818
324 1HB GLN 49 1HB GLN 49 -2.900 7.957 1.718
325 2HB GLN 49 2HB GLN 49 -1.626 7.351 0.593
326 1HG GLN 49 1HG GLN 49 -3.340 6.797 -1.102
327 2HG GLN 49 2HG GLN 49 -4.666 7.299 -0.008
328 1HE2 GLN 49 1HE2 GLN 49 -4.426 9.622 0.847
329 2HE2 GLN 49 2HE2 GLN 49 -3.875 10.836 -0.265
330 H CYS 50 H CYS 50 -0.764 4.624 1.027
331 HA CYS 50 HA CYS 50 0.369 4.558 3.738
332 1HB CYS 50 1HB CYS 50 0.106 2.598 1.906
333 2HB CYS 50 2HB CYS 50 1.500 3.351 1.122
334 H TYR 51 H TYR 51 0.770 6.797 3.859
335 HA TYR 51 HA TYR 51 2.103 8.301 1.941
336 1HB TYR 51 1HB TYR 51 1.061 8.773 4.663
337 2HB TYR 51 2HB TYR 51 2.669 9.520 4.529
338 HD1 TYR 51 HD1 TYR 51 -0.432 9.013 2.438
339 HD2 TYR 51 HD2 TYR 51 2.608 11.816 3.689
340 HE1 TYR 51 HE1 TYR 51 -1.144 10.603 0.715
341 HE2 TYR 51 HE2 TYR 51 1.770 13.425 2.133
342 HH TYR 51 HH TYR 51 -0.088 12.439 -0.557
343 H ASP 52 H ASP 52 3.495 6.461 4.465
344 HA ASP 52 HA ASP 52 6.086 7.734 4.078
345 1HB ASP 52 1HB ASP 52 5.045 6.915 6.374
346 2HB ASP 52 2HB ASP 52 5.668 5.304 5.916
347 HD2 ASP 52 HD2 ASP 52 8.166 8.446 6.590
348 H THR 53 H THR 53 8.128 6.472 3.870
349 HA THR 53 HA THR 53 7.930 4.757 1.597
350 HB THR 53 HB THR 53 10.429 4.667 1.685
351 HG1 THR 53 HG1 THR 53 11.427 6.086 3.073
352 1HG2 THR 53 1HG2 THR 53 9.132 6.354 0.369
353 2HG2 THR 53 2HG2 THR 53 10.629 7.079 1.046
354 3HG2 THR 53 3HG2 THR 53 9.039 7.447 1.790
355 H HIS 54 H HIS 54 9.045 2.624 1.341
356 HA HIS 54 HA HIS 54 9.621 1.285 3.784
357 1HB HIS 54 1HB HIS 54 7.010 0.933 2.836
358 2HB HIS 54 2HB HIS 54 7.869 -0.384 1.976
359 HD1 HIS 54 HD1 HIS 54 6.912 -2.226 3.073
360 HD2 HIS 54 HD2 HIS 54 8.280 0.500 5.946
361 HE1 HIS 54 HE1 HIS 54 6.639 -3.319 5.301
362 HE2 HIS 54 HE2 HIS 54 7.440 -1.635 7.037
363 H LYS 55 H LYS 55 10.928 -0.572 3.384
364 HA LYS 55 HA LYS 55 12.065 -0.701 0.667
365 1HB LYS 55 1HB LYS 55 13.967 -1.824 1.713
366 2HB LYS 55 2HB LYS 55 13.597 -0.313 2.584
367 1HG LYS 55 1HG LYS 55 12.575 -1.536 4.447
368 2HG LYS 55 2HG LYS 55 12.680 -3.093 3.555
369 1HD LYS 55 1HD LYS 55 15.136 -3.041 3.693
370 2HD LYS 55 2HD LYS 55 15.108 -1.355 4.320
371 1HE LYS 55 1HE LYS 55 15.508 -2.976 6.175
372 2HE LYS 55 2HE LYS 55 13.954 -2.072 6.386
373 1HZ LYS 55 1HZ LYS 55 14.231 -4.836 5.307
374 2HZ LYS 55 2HZ LYS 55 12.781 -3.972 5.485
375 3HZ LYS 55 3HZ LYS 55 13.689 -4.400 6.856
376 H PHE 56 H PHE 56 9.431 -1.940 1.448
377 HA PHE 56 HA PHE 56 9.974 -4.730 0.747
378 1HB PHE 56 1HB PHE 56 10.281 -4.451 3.297
379 2HB PHE 56 2HB PHE 56 8.541 -4.029 3.404
380 HD1 PHE 56 HD1 PHE 56 6.838 -5.791 3.017
381 HD2 PHE 56 HD2 PHE 56 11.029 -6.656 2.657
382 HE1 PHE 56 HE1 PHE 56 6.341 -8.193 3.149
383 HE2 PHE 56 HE2 PHE 56 10.545 -9.061 2.775
384 HZ PHE 56 HZ PHE 56 8.198 -9.855 3.024
385 H CYS 57 H CYS 57 8.293 -5.723 -0.197
386 HA CYS 57 HA CYS 57 5.878 -4.095 -0.750
387 1HB CYS 57 1HB CYS 57 7.399 -4.293 -2.686
388 2HB CYS 57 2HB CYS 57 7.451 -6.054 -2.505
389 H TYR 58 H TYR 58 4.051 -4.887 -0.025
390 HA TYR 58 HA TYR 58 3.881 -7.712 0.769
391 1HB TYR 58 1HB TYR 58 2.041 -5.321 1.193
392 2HB TYR 58 2HB TYR 58 1.373 -6.976 1.228
393 HD1 TYR 58 HD1 TYR 58 1.505 -8.243 3.226
394 HD2 TYR 58 HD2 TYR 58 4.259 -4.948 2.680
395 HE1 TYR 58 HE1 TYR 58 2.295 -8.530 5.458
396 HE2 TYR 58 HE2 TYR 58 5.048 -5.260 4.960
397 HH TYR 58 HH TYR 58 3.384 -7.466 7.176
398 H LYS 59 H LYS 59 2.454 -9.119 -0.005
399 HA LYS 59 HA LYS 59 1.964 -9.321 -2.700
400 1HB LYS 59 1HB LYS 59 0.727 -10.804 -0.342
401 2HB LYS 59 2HB LYS 59 0.556 -11.268 -2.068
402 1HG LYS 59 1HG LYS 59 2.477 -12.470 -1.879
403 2HG LYS 59 2HG LYS 59 3.347 -10.926 -1.783
404 1HD LYS 59 1HD LYS 59 4.198 -11.904 0.087
405 2HD LYS 59 2HD LYS 59 2.770 -11.184 0.894
406 1HE LYS 59 1HE LYS 59 3.022 -14.088 -0.128
407 2HE LYS 59 2HE LYS 59 3.158 -13.522 1.581
408 1HZ LYS 59 1HZ LYS 59 0.884 -12.720 1.424
409 2HZ LYS 59 2HZ LYS 59 1.009 -14.394 1.145
410 3HZ LYS 59 3HZ LYS 59 0.762 -13.332 -0.161
411 H ALA 60 H ALA 60 0.053 -9.492 -3.933
412 HA ALA 60 HA ALA 60 -1.746 -7.339 -3.374
413 1HB ALA 60 1HB ALA 60 -2.593 -7.894 -5.690
414 2HB ALA 60 2HB ALA 60 -1.541 -9.363 -5.675
415 3HB ALA 60 3HB ALA 60 -0.789 -7.741 -5.627
416 H CYS 61 H CYS 61 -3.934 -7.348 -3.081
417 HA CYS 61 HA CYS 61 -5.468 -9.562 -3.529
418 1HB CYS 61 1HB CYS 61 -6.445 -10.006 -1.417
419 2HB CYS 61 2HB CYS 61 -4.679 -10.008 -1.122
420 H HIS 62 H HIS 62 -7.804 -8.922 -3.142
421 HA HIS 62 HA HIS 62 -8.109 -6.189 -4.148
422 1HB HIS 62 1HB HIS 62 -10.262 -8.334 -3.670
423 2HB HIS 62 2HB HIS 62 -10.451 -6.856 -4.643
424 HD1 HIS 62 HD1 HIS 62 -8.193 -6.925 -6.553
425 HD2 HIS 62 HD2 HIS 62 -10.168 -10.415 -5.359
426 HE1 HIS 62 HE1 HIS 62 -7.845 -8.604 -8.361
427 HE2 HIS 62 HE2 HIS 62 -9.034 -10.732 -7.621
428 H ASN 63 H ASN 63 -9.891 -4.739 -3.201
429 HA ASN 63 HA ASN 63 -11.483 -5.409 -1.191
430 1HB ASN 63 1HB ASN 63 -10.797 -4.056 0.737
431 2HB ASN 63 2HB ASN 63 -9.637 -5.358 0.452
432 1HD2 ASN 63 1HD2 ASN 63 -7.563 -4.583 -0.911
433 2HD2 ASN 63 2HD2 ASN 63 -7.009 -2.991 -0.609
434 H SER 64 H SER 64 -9.590 -2.602 -2.152
435 HA SER 64 HA SER 64 -12.032 -1.295 -3.216
436 1HB SER 64 1HB SER 64 -10.892 -0.100 -1.276
437 2HB SER 64 2HB SER 64 -9.409 -0.032 -2.242
438 HG SER 64 HG SER 64 -11.882 1.128 -3.146
439 H GLU 65 H GLU 65 -11.126 -3.213 -4.828
440 HA GLU 65 HA GLU 65 -8.862 -2.554 -6.366
441 1HB GLU 65 1HB GLU 65 -9.569 -4.902 -5.994
442 2HB GLU 65 2HB GLU 65 -10.998 -4.647 -7.012
443 1HG GLU 65 1HG GLU 65 -9.276 -5.734 -8.362
444 2HG GLU 65 2HG GLU 65 -9.457 -4.057 -8.975
445 HE2 GLU 65 HE2 GLU 65 -6.107 -5.233 -7.091
446 H ILE 66 H ILE 66 -12.268 -2.591 -7.321
447 HA ILE 66 HA ILE 66 -11.625 -1.035 -9.723
448 HB ILE 66 HB ILE 66 -14.272 -2.244 -8.802
449 1HG1 ILE 66 1HG1 ILE 66 -12.403 -3.030 -11.122
450 2HG1 ILE 66 2HG1 ILE 66 -12.435 -3.882 -9.557
451 1HG2 ILE 66 1HG2 ILE 66 -14.618 -0.134 -10.153
452 2HG2 ILE 66 2HG2 ILE 66 -15.049 -1.570 -11.117
453 3HG2 ILE 66 3HG2 ILE 66 -13.474 -0.747 -11.398
454 1HD1 ILE 66 1HD1 ILE 66 -14.822 -3.662 -11.509
455 2HD1 ILE 66 2HD1 ILE 66 -14.875 -4.433 -9.882
456 3HD1 ILE 66 3HD1 ILE 66 -13.814 -5.110 -11.178
457 H GLU 67 H GLU 67 -13.967 -0.831 -6.972
458 HA GLU 67 HA GLU 67 -12.838 1.709 -6.326
459 1HB GLU 67 1HB GLU 67 -15.835 1.015 -6.340
460 2HB GLU 67 2HB GLU 67 -15.141 2.391 -5.405
461 1HG GLU 67 1HG GLU 67 -14.496 3.587 -7.444
462 2HG GLU 67 2HG GLU 67 -14.790 2.143 -8.471
463 HE2 GLU 67 HE2 GLU 67 -18.206 2.533 -8.576
Start of MODEL 20
1 1H GLY 1 1H GLY 1 -3.618 -20.482 10.728
2 2H GLY 1 2H GLY 1 -2.926 -19.628 12.024
3 3H GLY 1 3H GLY 1 -1.929 -20.431 10.908
4 1HA GLY 1 1HA GLY 1 -2.604 -18.992 9.170
5 2HA GLY 1 2HA GLY 1 -3.696 -18.148 10.334
6 H ASP 2 H ASP 2 -2.391 -16.279 9.381
7 HA ASP 2 HA ASP 2 -0.318 -15.565 11.281
8 1HB ASP 2 1HB ASP 2 0.314 -15.789 8.229
9 2HB ASP 2 2HB ASP 2 1.321 -14.881 9.415
10 HD2 ASP 2 HD2 ASP 2 1.685 -18.796 9.105
11 H ASP 3 H ASP 3 -0.876 -13.452 11.788
12 HA ASP 3 HA ASP 3 -1.230 -11.669 9.630
13 1HB ASP 3 1HB ASP 3 -3.620 -12.898 10.553
14 2HB ASP 3 2HB ASP 3 -3.621 -11.364 11.465
15 HD2 ASP 3 HD2 ASP 3 -2.898 -12.691 8.389
16 H VAL 4 H VAL 4 0.723 -11.196 10.573
17 HA VAL 4 HA VAL 4 0.491 -9.520 12.987
18 HB VAL 4 HB VAL 4 1.687 -11.479 13.476
19 1HG1 VAL 4 1HG1 VAL 4 2.650 -12.140 11.288
20 2HG1 VAL 4 2HG1 VAL 4 3.824 -12.114 12.630
21 3HG1 VAL 4 3HG1 VAL 4 3.877 -10.809 11.423
22 1HG2 VAL 4 1HG2 VAL 4 3.684 -10.391 14.493
23 2HG2 VAL 4 2HG2 VAL 4 2.265 -9.291 14.596
24 3HG2 VAL 4 3HG2 VAL 4 3.551 -8.997 13.370
25 H LYS 5 H LYS 5 2.773 -9.613 10.111
26 HA LYS 5 HA LYS 5 2.680 -6.693 10.233
27 1HB LYS 5 1HB LYS 5 4.764 -8.610 9.076
28 2HB LYS 5 2HB LYS 5 4.923 -6.827 9.182
29 1HG LYS 5 1HG LYS 5 4.635 -7.095 11.757
30 2HG LYS 5 2HG LYS 5 4.766 -8.862 11.497
31 1HD LYS 5 1HD LYS 5 7.049 -8.472 10.410
32 2HD LYS 5 2HD LYS 5 6.930 -6.757 10.947
33 1HE LYS 5 1HE LYS 5 6.621 -7.593 13.351
34 2HE LYS 5 2HE LYS 5 6.861 -9.283 12.750
35 1HZ LYS 5 1HZ LYS 5 8.872 -8.406 13.611
36 2HZ LYS 5 2HZ LYS 5 8.808 -7.040 12.606
37 3HZ LYS 5 3HZ LYS 5 9.037 -8.582 11.929
38 H SER 6 H SER 6 0.801 -8.572 8.929
39 HA SER 6 HA SER 6 1.003 -8.585 6.169
40 1HB SER 6 1HB SER 6 -1.591 -8.346 7.803
41 2HB SER 6 2HB SER 6 -1.480 -8.800 6.060
42 HG SER 6 HG SER 6 -1.596 -10.648 7.139
43 H ALA 7 H ALA 7 0.629 -7.181 4.478
44 HA ALA 7 HA ALA 7 -0.652 -4.595 5.053
45 1HB ALA 7 1HB ALA 7 1.858 -4.347 4.891
46 2HB ALA 7 2HB ALA 7 1.064 -3.620 3.444
47 3HB ALA 7 3HB ALA 7 1.840 -5.262 3.344
48 H CYS 8 H CYS 8 -1.629 -3.679 3.127
49 HA CYS 8 HA CYS 8 -2.149 -5.653 0.981
50 1HB CYS 8 1HB CYS 8 -4.145 -5.496 2.376
51 2HB CYS 8 2HB CYS 8 -4.191 -3.717 2.177
52 H CYS 9 H CYS 9 -1.443 -4.963 -0.978
53 HA CYS 9 HA CYS 9 -1.355 -2.040 -1.450
54 1HB CYS 9 1HB CYS 9 0.753 -4.218 -1.865
55 2HB CYS 9 2HB CYS 9 0.866 -2.616 -2.673
56 H ASP 10 H ASP 10 -2.813 -1.741 -3.158
57 HA ASP 10 HA ASP 10 -3.234 -3.850 -5.044
58 1HB ASP 10 1HB ASP 10 -4.297 -1.057 -4.557
59 2HB ASP 10 2HB ASP 10 -4.294 -1.555 -6.238
60 HD2 ASP 10 HD2 ASP 10 -5.347 -2.567 -3.083
61 H THR 11 H THR 11 -1.049 -1.171 -4.917
62 HA THR 11 HA THR 11 0.465 -2.251 -7.150
63 HB THR 11 HB THR 11 -0.406 0.693 -7.083
64 HG1 THR 11 HG1 THR 11 -1.389 0.226 -9.029
65 1HG2 THR 11 1HG2 THR 11 1.959 0.360 -7.927
66 2HG2 THR 11 2HG2 THR 11 0.866 0.779 -9.265
67 3HG2 THR 11 3HG2 THR 11 1.366 -0.940 -9.037
68 H CYS 12 H CYS 12 2.154 -2.619 -6.046
69 HA CYS 12 HA CYS 12 3.392 -0.751 -4.200
70 1HB CYS 12 1HB CYS 12 3.448 -3.187 -3.722
71 2HB CYS 12 2HB CYS 12 4.319 -3.461 -5.292
72 H LEU 13 H LEU 13 4.522 0.992 -5.000
73 HA LEU 13 HA LEU 13 6.040 0.681 -7.479
74 1HB LEU 13 1HB LEU 13 4.731 2.687 -7.204
75 2HB LEU 13 2HB LEU 13 5.509 3.068 -5.639
76 HG LEU 13 HG LEU 13 7.247 2.735 -8.138
77 1HD1 LEU 13 1HD1 LEU 13 5.263 4.076 -8.868
78 2HD1 LEU 13 2HD1 LEU 13 6.776 5.065 -8.840
79 3HD1 LEU 13 3HD1 LEU 13 5.558 5.237 -7.524
80 1HD2 LEU 13 1HD2 LEU 13 8.522 4.636 -7.102
81 2HD2 LEU 13 2HD2 LEU 13 8.354 3.297 -5.911
82 3HD2 LEU 13 3HD2 LEU 13 7.304 4.754 -5.784
83 H CYS 14 H CYS 14 8.221 0.500 -7.455
84 HA CYS 14 HA CYS 14 9.700 0.917 -4.989
85 1HB CYS 14 1HB CYS 14 9.681 -1.583 -6.750
86 2HB CYS 14 2HB CYS 14 11.105 -1.168 -5.782
87 H THR 15 H THR 15 11.699 1.631 -5.264
88 HA THR 15 HA THR 15 12.161 2.888 -7.840
89 HB THR 15 HB THR 15 13.976 4.068 -6.805
90 HG1 THR 15 HG1 THR 15 14.118 3.857 -4.497
91 1HG2 THR 15 1HG2 THR 15 11.406 3.991 -5.056
92 2HG2 THR 15 2HG2 THR 15 11.597 4.870 -6.613
93 3HG2 THR 15 3HG2 THR 15 12.569 5.356 -5.177
94 H ARG 16 H ARG 16 14.023 2.770 -9.059
95 HA ARG 16 HA ARG 16 15.540 0.281 -8.946
96 1HB ARG 16 1HB ARG 16 15.681 2.685 -10.860
97 2HB ARG 16 2HB ARG 16 16.591 1.143 -11.050
98 1HG ARG 16 1HG ARG 16 14.501 -0.127 -11.230
99 2HG ARG 16 2HG ARG 16 13.518 1.366 -11.021
100 1HD ARG 16 1HD ARG 16 14.495 2.296 -13.178
101 2HD ARG 16 2HD ARG 16 15.434 0.760 -13.376
102 HE ARG 16 HE ARG 16 13.426 -0.436 -13.800
103 1HH1 ARG 16 1HH1 ARG 16 12.647 2.970 -12.995
104 2HH1 ARG 16 2HH1 ARG 16 10.955 2.776 -13.326
105 1HH2 ARG 16 1HH2 ARG 16 11.173 -0.643 -14.213
106 2HH2 ARG 16 2HH2 ARG 16 10.110 0.715 -14.021
107 H SER 17 H SER 17 15.651 2.595 -6.964
108 HA SER 17 HA SER 17 18.177 3.870 -7.124
109 1HB SER 17 1HB SER 17 16.147 4.749 -5.832
110 2HB SER 17 2HB SER 17 16.583 3.573 -4.542
111 HG SER 17 HG SER 17 17.502 5.515 -4.066
112 H GLN 18 H GLN 18 19.405 3.837 -4.874
113 HA GLN 18 HA GLN 18 20.279 1.151 -4.160
114 1HB GLN 18 1HB GLN 18 21.335 1.780 -6.387
115 2HB GLN 18 2HB GLN 18 22.087 3.179 -5.581
116 1HG GLN 18 1HG GLN 18 23.132 1.438 -3.910
117 2HG GLN 18 2HG GLN 18 22.586 0.158 -5.048
118 1HE2 GLN 18 1HE2 GLN 18 25.177 2.058 -4.195
119 2HE2 GLN 18 2HE2 GLN 18 26.053 2.095 -5.709
120 HA PRO 19 HA PRO 19 20.047 0.480 -2.164
121 1HB PRO 19 1HB PRO 19 18.975 0.751 0.386
122 2HB PRO 19 2HB PRO 19 20.773 0.593 0.091
123 1HG PRO 19 1HG PRO 19 19.184 3.186 0.482
124 2HG PRO 19 2HG PRO 19 20.672 2.632 1.357
125 1HD PRO 19 1HD PRO 19 20.800 4.312 -0.854
126 2HD PRO 19 2HD PRO 19 22.065 3.038 -0.557
127 HA PRO 20 HA PRO 20 16.098 1.513 -3.631
128 1HB PRO 20 1HB PRO 20 14.616 -0.790 -3.334
129 2HB PRO 20 2HB PRO 20 16.156 -0.787 -4.279
130 1HG PRO 20 1HG PRO 20 15.798 -1.523 -1.321
131 2HG PRO 20 2HG PRO 20 16.535 -2.548 -2.621
132 1HD PRO 20 1HD PRO 20 18.080 -0.951 -0.971
133 2HD PRO 20 2HD PRO 20 18.471 -1.127 -2.753
134 H THR 21 H THR 21 13.713 1.582 -3.264
135 HA THR 21 HA THR 21 12.835 2.039 -0.488
136 HB THR 21 HB THR 21 12.984 4.157 -2.735
137 HG1 THR 21 HG1 THR 21 14.414 4.033 -0.266
138 1HG2 THR 21 1HG2 THR 21 12.290 5.787 -0.972
139 2HG2 THR 21 2HG2 THR 21 12.080 4.441 0.210
140 3HG2 THR 21 3HG2 THR 21 11.027 4.559 -1.266
141 H CYS 22 H CYS 22 10.513 1.948 -0.407
142 HA CYS 22 HA CYS 22 9.101 1.780 -2.972
143 1HB CYS 22 1HB CYS 22 9.005 -0.441 -0.834
144 2HB CYS 22 2HB CYS 22 8.016 -0.411 -2.283
145 H ARG 23 H ARG 23 6.772 1.517 -2.646
146 HA ARG 23 HA ARG 23 5.503 2.377 -0.271
147 1HB ARG 23 1HB ARG 23 6.746 4.451 -0.653
148 2HB ARG 23 2HB ARG 23 6.288 4.480 -2.378
149 1HG ARG 23 1HG ARG 23 4.186 4.736 -0.135
150 2HG ARG 23 2HG ARG 23 5.197 6.115 -0.660
151 1HD ARG 23 1HD ARG 23 4.423 5.760 -3.077
152 2HD ARG 23 2HD ARG 23 3.251 4.544 -2.457
153 HE ARG 23 HE ARG 23 1.889 6.201 -1.730
154 1HH1 ARG 23 1HH1 ARG 23 5.097 7.730 -2.212
155 2HH1 ARG 23 2HH1 ARG 23 4.443 9.310 -2.416
156 1HH2 ARG 23 1HH2 ARG 23 1.060 8.207 -2.031
157 2HH2 ARG 23 2HH2 ARG 23 2.044 9.617 -2.282
158 H CYS 24 H CYS 24 3.369 1.981 -0.532
159 HA CYS 24 HA CYS 24 2.597 0.855 -3.114
160 1HB CYS 24 1HB CYS 24 1.184 0.793 -0.406
161 2HB CYS 24 2HB CYS 24 0.586 0.007 -1.901
162 H VAL 25 H VAL 25 2.048 2.288 -4.596
163 HA VAL 25 HA VAL 25 1.110 4.854 -3.955
164 HB VAL 25 HB VAL 25 1.019 5.255 -6.387
165 1HG1 VAL 25 1HG1 VAL 25 2.960 5.760 -4.947
166 2HG1 VAL 25 2HG1 VAL 25 3.515 5.183 -6.558
167 3HG1 VAL 25 3HG1 VAL 25 3.581 4.075 -5.135
168 1HG2 VAL 25 1HG2 VAL 25 0.578 2.941 -7.287
169 2HG2 VAL 25 2HG2 VAL 25 2.158 2.370 -6.621
170 3HG2 VAL 25 3HG2 VAL 25 2.109 3.613 -7.905
171 H ASP 26 H ASP 26 -0.553 2.003 -5.110
172 HA ASP 26 HA ASP 26 -2.900 3.661 -5.651
173 1HB ASP 26 1HB ASP 26 -2.326 1.868 -7.252
174 2HB ASP 26 2HB ASP 26 -2.693 0.625 -6.001
175 HD2 ASP 26 HD2 ASP 26 -5.743 2.969 -7.314
176 H VAL 27 H VAL 27 -4.593 3.923 -4.462
177 HA VAL 27 HA VAL 27 -4.469 3.381 -1.745
178 HB VAL 27 HB VAL 27 -6.558 4.485 -1.474
179 1HG1 VAL 27 1HG1 VAL 27 -4.441 5.780 -1.946
180 2HG1 VAL 27 2HG1 VAL 27 -5.941 6.634 -2.453
181 3HG1 VAL 27 3HG1 VAL 27 -4.895 5.856 -3.688
182 1HG2 VAL 27 1HG2 VAL 27 -7.922 5.247 -3.377
183 2HG2 VAL 27 2HG2 VAL 27 -7.862 3.453 -3.318
184 3HG2 VAL 27 3HG2 VAL 27 -6.877 4.343 -4.543
185 H ARG 28 H ARG 28 -6.053 2.557 -0.338
186 HA ARG 28 HA ARG 28 -7.311 0.070 -1.255
187 1HB ARG 28 1HB ARG 28 -6.394 -1.049 0.816
188 2HB ARG 28 2HB ARG 28 -5.173 -0.686 -0.405
189 1HG ARG 28 1HG ARG 28 -5.586 1.283 1.872
190 2HG ARG 28 2HG ARG 28 -4.759 -0.277 2.155
191 1HD ARG 28 1HD ARG 28 -3.036 0.230 0.423
192 2HD ARG 28 2HD ARG 28 -3.814 1.790 0.060
193 HE ARG 28 HE ARG 28 -3.186 2.684 2.143
194 1HH1 ARG 28 1HH1 ARG 28 -2.221 -0.805 2.082
195 2HH1 ARG 28 2HH1 ARG 28 -1.410 -0.679 3.600
196 1HH2 ARG 28 1HH2 ARG 28 -2.097 2.723 4.171
197 2HH2 ARG 28 2HH2 ARG 28 -1.332 1.283 4.771
198 H GLU 29 H GLU 29 -8.472 -0.899 0.801
199 HA GLU 29 HA GLU 29 -10.541 0.758 1.629
200 1HB GLU 29 1HB GLU 29 -9.333 -1.897 2.412
201 2HB GLU 29 2HB GLU 29 -10.563 -1.228 3.519
202 1HG GLU 29 1HG GLU 29 -10.973 -1.734 0.492
203 2HG GLU 29 2HG GLU 29 -11.545 -2.831 1.802
204 HE2 GLU 29 HE2 GLU 29 -12.783 -1.826 3.369
205 H SER 30 H SER 30 -7.656 -0.212 3.442
206 HA SER 30 HA SER 30 -7.987 1.961 5.338
207 1HB SER 30 1HB SER 30 -8.479 -0.990 6.119
208 2HB SER 30 2HB SER 30 -8.105 0.273 7.344
209 HG SER 30 HG SER 30 -10.331 -0.016 7.120
210 H CYS 31 H CYS 31 -6.352 1.589 7.266
211 HA CYS 31 HA CYS 31 -3.767 0.883 6.214
212 1HB CYS 31 1HB CYS 31 -4.723 1.546 9.083
213 2HB CYS 31 2HB CYS 31 -3.000 1.625 8.497
214 H HIS 32 H HIS 32 -2.350 -0.756 7.464
215 HA HIS 32 HA HIS 32 -3.986 -2.641 9.052
216 1HB HIS 32 1HB HIS 32 -3.655 -3.255 6.531
217 2HB HIS 32 2HB HIS 32 -1.982 -3.712 6.998
218 HD1 HIS 32 HD1 HIS 32 -5.620 -4.274 7.626
219 HD2 HIS 32 HD2 HIS 32 -2.049 -6.308 8.387
220 HE1 HIS 32 HE1 HIS 32 -6.258 -6.530 8.452
221 HE2 HIS 32 HE2 HIS 32 -4.066 -7.793 8.887
222 H SER 33 H SER 33 -0.552 -2.077 8.031
223 HA SER 33 HA SER 33 0.257 -2.308 10.796
224 1HB SER 33 1HB SER 33 1.033 -4.434 8.687
225 2HB SER 33 2HB SER 33 1.971 -4.196 10.205
226 HG SER 33 HG SER 33 0.000 -4.626 11.349
227 H ALA 34 H ALA 34 1.897 -2.589 7.528
228 HA ALA 34 HA ALA 34 4.167 -1.511 8.901
229 1HB ALA 34 1HB ALA 34 4.322 -3.640 7.610
230 2HB ALA 34 2HB ALA 34 5.416 -2.397 6.902
231 3HB ALA 34 3HB ALA 34 3.839 -2.764 6.109
232 H CYS 35 H CYS 35 2.283 0.417 8.458
233 HA CYS 35 HA CYS 35 3.958 2.299 6.908
234 1HB CYS 35 1HB CYS 35 1.717 1.727 5.855
235 2HB CYS 35 2HB CYS 35 0.922 2.468 7.293
236 H ASP 36 H ASP 36 4.318 4.377 7.813
237 HA ASP 36 HA ASP 36 3.520 4.743 10.614
238 1HB ASP 36 1HB ASP 36 5.097 6.642 10.652
239 2HB ASP 36 2HB ASP 36 5.880 5.086 10.220
240 HD2 ASP 36 HD2 ASP 36 7.157 7.747 8.084
241 H LYS 37 H LYS 37 3.595 6.719 7.630
242 HA LYS 37 HA LYS 37 1.396 8.352 8.569
243 1HB LYS 37 1HB LYS 37 3.610 9.287 7.682
244 2HB LYS 37 2HB LYS 37 3.156 8.642 6.089
245 1HG LYS 37 1HG LYS 37 2.650 10.981 6.114
246 2HG LYS 37 2HG LYS 37 1.106 10.084 6.077
247 1HD LYS 37 1HD LYS 37 0.778 10.518 8.523
248 2HD LYS 37 2HD LYS 37 2.379 11.335 8.608
249 1HE LYS 37 1HE LYS 37 1.575 13.102 7.011
250 2HE LYS 37 2HE LYS 37 -0.027 12.274 6.903
251 1HZ LYS 37 1HZ LYS 37 1.200 13.498 9.317
252 2HZ LYS 37 2HZ LYS 37 -0.237 12.591 9.310
253 3HZ LYS 37 3HZ LYS 37 -0.144 14.043 8.435
254 H CYS 38 H CYS 38 0.091 6.219 8.312
255 HA CYS 38 HA CYS 38 -1.040 5.966 5.651
256 1HB CYS 38 1HB CYS 38 -0.697 4.009 7.201
257 2HB CYS 38 2HB CYS 38 -1.824 4.782 8.369
258 H VAL 39 H VAL 39 -2.325 7.617 4.958
259 HA VAL 39 HA VAL 39 -3.977 9.031 6.940
260 HB VAL 39 HB VAL 39 -3.065 9.621 4.104
261 1HG1 VAL 39 1HG1 VAL 39 -3.933 11.926 4.579
262 2HG1 VAL 39 2HG1 VAL 39 -4.659 11.323 6.118
263 3HG1 VAL 39 3HG1 VAL 39 -5.250 10.704 4.513
264 1HG2 VAL 39 1HG2 VAL 39 -2.236 10.771 6.845
265 2HG2 VAL 39 2HG2 VAL 39 -1.744 11.462 5.255
266 3HG2 VAL 39 3HG2 VAL 39 -1.186 9.807 5.730
267 H CYS 40 H CYS 40 -6.272 8.997 6.540
268 HA CYS 40 HA CYS 40 -7.231 7.346 4.337
269 1HB CYS 40 1HB CYS 40 -6.685 6.395 6.904
270 2HB CYS 40 2HB CYS 40 -8.353 6.918 7.101
271 H ALA 41 H ALA 41 -9.586 7.510 4.243
272 HA ALA 41 HA ALA 41 -10.952 9.591 5.716
273 1HB ALA 41 1HB ALA 41 -10.158 10.030 2.770
274 2HB ALA 41 2HB ALA 41 -9.549 10.990 4.167
275 3HB ALA 41 3HB ALA 41 -11.289 11.094 3.716
276 H TYR 42 H TYR 42 -13.034 9.718 5.346
277 HA TYR 42 HA TYR 42 -14.231 7.280 4.694
278 1HB TYR 42 1HB TYR 42 -16.179 8.327 5.938
279 2HB TYR 42 2HB TYR 42 -14.595 8.444 6.791
280 HD1 TYR 42 HD1 TYR 42 -13.534 10.644 7.202
281 HD2 TYR 42 HD2 TYR 42 -17.123 10.391 4.810
282 HE1 TYR 42 HE1 TYR 42 -13.807 13.077 7.321
283 HE2 TYR 42 HE2 TYR 42 -17.369 12.818 4.934
284 HH TYR 42 HH TYR 42 -16.520 14.770 5.686
285 H SER 43 H SER 43 -13.428 9.000 2.547
286 HA SER 43 HA SER 43 -15.438 10.159 1.022
287 1HB SER 43 1HB SER 43 -12.894 8.776 -0.002
288 2HB SER 43 2HB SER 43 -13.790 10.151 -0.793
289 HG SER 43 HG SER 43 -11.901 10.783 0.375
290 H ASN 44 H ASN 44 -15.433 9.254 -1.508
291 HA ASN 44 HA ASN 44 -16.317 6.481 -1.496
292 1HB ASN 44 1HB ASN 44 -18.181 8.050 -0.925
293 2HB ASN 44 2HB ASN 44 -17.982 8.857 -2.496
294 1HD2 ASN 44 1HD2 ASN 44 -18.214 7.246 -4.493
295 2HD2 ASN 44 2HD2 ASN 44 -19.282 5.908 -4.297
296 HA PRO 45 HA PRO 45 -15.461 4.920 -2.438
297 1HB PRO 45 1HB PRO 45 -13.232 3.717 -3.495
298 2HB PRO 45 2HB PRO 45 -14.726 3.853 -4.442
299 1HG PRO 45 1HG PRO 45 -12.318 5.764 -4.533
300 2HG PRO 45 2HG PRO 45 -13.116 4.948 -5.924
301 1HD PRO 45 1HD PRO 45 -13.783 7.530 -5.144
302 2HD PRO 45 2HD PRO 45 -15.030 6.373 -5.802
303 HA PRO 46 HA PRO 46 -13.041 6.491 0.743
304 1HB PRO 46 1HB PRO 46 -12.188 4.336 2.247
305 2HB PRO 46 2HB PRO 46 -13.939 4.755 2.068
306 1HG PRO 46 1HG PRO 46 -12.356 2.711 0.408
307 2HG PRO 46 2HG PRO 46 -13.922 2.480 1.313
308 1HD PRO 46 1HD PRO 46 -13.844 3.061 -1.389
309 2HD PRO 46 2HD PRO 46 -15.131 3.848 -0.264
310 H GLN 47 H GLN 47 -10.894 6.935 1.608
311 HA GLN 47 HA GLN 47 -8.856 6.216 -0.434
312 1HB GLN 47 1HB GLN 47 -9.081 8.776 1.248
313 2HB GLN 47 2HB GLN 47 -7.810 8.399 0.036
314 1HG GLN 47 1HG GLN 47 -9.498 8.381 -1.793
315 2HG GLN 47 2HG GLN 47 -10.821 8.667 -0.609
316 1HE2 GLN 47 1HE2 GLN 47 -7.845 10.084 -2.005
317 2HE2 GLN 47 2HE2 GLN 47 -8.309 11.741 -1.728
318 H CYS 48 H CYS 48 -7.082 5.201 0.390
319 HA CYS 48 HA CYS 48 -6.124 6.067 2.937
320 1HB CYS 48 1HB CYS 48 -7.841 3.876 2.955
321 2HB CYS 48 2HB CYS 48 -6.264 3.081 2.757
322 H GLN 49 H GLN 49 -4.030 6.310 2.701
323 HA GLN 49 HA GLN 49 -2.616 4.641 0.770
324 1HB GLN 49 1HB GLN 49 -3.475 6.770 -0.340
325 2HB GLN 49 2HB GLN 49 -2.606 7.708 0.871
326 1HG GLN 49 1HG GLN 49 -0.391 6.837 0.021
327 2HG GLN 49 2HG GLN 49 -1.255 5.715 -1.091
328 1HE2 GLN 49 1HE2 GLN 49 -1.685 9.286 -0.415
329 2HE2 GLN 49 2HE2 GLN 49 -1.509 9.734 -2.079
330 H CYS 50 H CYS 50 -0.595 4.122 1.380
331 HA CYS 50 HA CYS 50 0.468 5.307 3.847
332 1HB CYS 50 1HB CYS 50 0.764 2.788 3.347
333 2HB CYS 50 2HB CYS 50 1.772 3.250 1.948
334 H TYR 51 H TYR 51 0.785 7.367 3.382
335 HA TYR 51 HA TYR 51 1.738 8.481 0.998
336 1HB TYR 51 1HB TYR 51 1.287 9.455 3.836
337 2HB TYR 51 2HB TYR 51 2.381 10.446 2.842
338 HD1 TYR 51 HD1 TYR 51 1.526 11.725 0.872
339 HD2 TYR 51 HD2 TYR 51 -1.099 9.025 2.998
340 HE1 TYR 51 HE1 TYR 51 -0.357 12.687 -0.233
341 HE2 TYR 51 HE2 TYR 51 -3.002 10.011 1.857
342 HH TYR 51 HH TYR 51 -2.673 12.718 -0.438
343 H ASP 52 H ASP 52 3.518 7.376 3.753
344 HA ASP 52 HA ASP 52 5.931 8.705 2.689
345 1HB ASP 52 1HB ASP 52 5.249 9.038 5.136
346 2HB ASP 52 2HB ASP 52 5.668 7.296 5.402
347 HD2 ASP 52 HD2 ASP 52 8.898 8.300 5.949
348 H THR 53 H THR 53 7.876 7.711 2.280
349 HA THR 53 HA THR 53 7.689 5.069 1.243
350 HB THR 53 HB THR 53 10.147 5.439 0.713
351 HG1 THR 53 HG1 THR 53 10.815 6.912 2.111
352 1HG2 THR 53 1HG2 THR 53 8.383 5.938 -0.951
353 2HG2 THR 53 2HG2 THR 53 9.674 7.178 -1.029
354 3HG2 THR 53 3HG2 THR 53 8.109 7.565 -0.236
355 H HIS 54 H HIS 54 8.761 3.179 1.829
356 HA HIS 54 HA HIS 54 10.808 3.315 3.757
357 1HB HIS 54 1HB HIS 54 8.316 1.604 4.435
358 2HB HIS 54 2HB HIS 54 9.913 1.509 5.285
359 HD1 HIS 54 HD1 HIS 54 6.782 2.701 5.782
360 HD2 HIS 54 HD2 HIS 54 10.583 4.316 6.491
361 HE1 HIS 54 HE1 HIS 54 6.521 4.403 7.588
362 HE2 HIS 54 HE2 HIS 54 8.855 5.365 8.025
363 H LYS 55 H LYS 55 10.520 0.120 3.828
364 HA LYS 55 HA LYS 55 11.252 -0.262 1.044
365 1HB LYS 55 1HB LYS 55 12.472 -2.166 1.892
366 2HB LYS 55 2HB LYS 55 12.774 -0.776 2.966
367 1HG LYS 55 1HG LYS 55 11.050 -1.710 4.597
368 2HG LYS 55 2HG LYS 55 10.902 -3.159 3.550
369 1HD LYS 55 1HD LYS 55 13.285 -3.672 3.861
370 2HD LYS 55 2HD LYS 55 13.553 -2.115 4.725
371 1HE LYS 55 1HE LYS 55 12.010 -2.852 6.572
372 2HE LYS 55 2HE LYS 55 11.770 -4.437 5.727
373 1HZ LYS 55 1HZ LYS 55 13.482 -4.574 7.401
374 2HZ LYS 55 2HZ LYS 55 14.364 -3.314 6.686
375 3HZ LYS 55 3HZ LYS 55 14.161 -4.781 5.862
376 H PHE 56 H PHE 56 8.450 -0.707 2.873
377 HA PHE 56 HA PHE 56 8.169 -3.499 2.362
378 1HB PHE 56 1HB PHE 56 7.126 -2.013 4.411
379 2HB PHE 56 2HB PHE 56 5.698 -2.018 3.326
380 HD1 PHE 56 HD1 PHE 56 4.307 -3.995 3.421
381 HD2 PHE 56 HD2 PHE 56 8.365 -4.201 4.855
382 HE1 PHE 56 HE1 PHE 56 3.853 -6.202 4.412
383 HE2 PHE 56 HE2 PHE 56 7.914 -6.415 5.808
384 HZ PHE 56 HZ PHE 56 5.652 -7.428 5.605
385 H CYS 57 H CYS 57 6.569 -4.662 1.225
386 HA CYS 57 HA CYS 57 5.188 -3.324 -0.939
387 1HB CYS 57 1HB CYS 57 7.715 -3.568 -1.488
388 2HB CYS 57 2HB CYS 57 7.483 -5.333 -1.393
389 H TYR 58 H TYR 58 3.374 -4.510 -1.404
390 HA TYR 58 HA TYR 58 3.455 -7.403 -0.857
391 1HB TYR 58 1HB TYR 58 2.136 -5.392 0.670
392 2HB TYR 58 2HB TYR 58 0.826 -6.098 -0.336
393 HD1 TYR 58 HD1 TYR 58 3.581 -6.896 2.039
394 HD2 TYR 58 HD2 TYR 58 -0.028 -8.335 0.185
395 HE1 TYR 58 HE1 TYR 58 3.504 -8.743 3.627
396 HE2 TYR 58 HE2 TYR 58 -0.078 -10.212 1.711
397 HH TYR 58 HH TYR 58 0.995 -11.314 3.396
398 H LYS 59 H LYS 59 1.940 -8.585 -1.805
399 HA LYS 59 HA LYS 59 0.678 -8.128 -4.279
400 1HB LYS 59 1HB LYS 59 0.126 -10.085 -2.003
401 2HB LYS 59 2HB LYS 59 -0.689 -10.150 -3.593
402 1HG LYS 59 1HG LYS 59 1.489 -10.470 -4.755
403 2HG LYS 59 2HG LYS 59 2.382 -10.320 -3.217
404 1HD LYS 59 1HD LYS 59 1.115 -12.310 -2.312
405 2HD LYS 59 2HD LYS 59 0.426 -12.564 -3.963
406 1HE LYS 59 1HE LYS 59 2.705 -12.866 -4.913
407 2HE LYS 59 2HE LYS 59 3.447 -12.373 -3.337
408 1HZ LYS 59 1HZ LYS 59 3.488 -14.723 -3.601
409 2HZ LYS 59 2HZ LYS 59 1.803 -14.797 -3.821
410 3HZ LYS 59 3HZ LYS 59 2.448 -14.306 -2.323
411 H ALA 60 H ALA 60 -1.735 -8.222 -4.620
412 HA ALA 60 HA ALA 60 -3.049 -6.238 -2.938
413 1HB ALA 60 1HB ALA 60 -4.798 -6.330 -4.712
414 2HB ALA 60 2HB ALA 60 -3.891 -7.693 -5.495
415 3HB ALA 60 3HB ALA 60 -3.148 -6.060 -5.414
416 H CYS 61 H CYS 61 -4.614 -6.684 -1.527
417 HA CYS 61 HA CYS 61 -4.807 -9.433 -0.723
418 1HB CYS 61 1HB CYS 61 -5.720 -8.531 1.383
419 2HB CYS 61 2HB CYS 61 -4.258 -7.631 0.881
420 H HIS 62 H HIS 62 -6.359 -8.717 -3.123
421 HA HIS 62 HA HIS 62 -9.137 -8.624 -2.276
422 1HB HIS 62 1HB HIS 62 -8.021 -9.292 -5.055
423 2HB HIS 62 2HB HIS 62 -9.734 -9.116 -4.652
424 HD1 HIS 62 HD1 HIS 62 -9.606 -7.384 -6.562
425 HD2 HIS 62 HD2 HIS 62 -7.721 -6.206 -3.007
426 HE1 HIS 62 HE1 HIS 62 -9.334 -4.881 -6.665
427 HE2 HIS 62 HE2 HIS 62 -8.189 -4.192 -4.508
428 H ASN 63 H ASN 63 -6.916 -11.270 -3.411
429 HA ASN 63 HA ASN 63 -8.150 -13.334 -2.292
430 1HB ASN 63 1HB ASN 63 -9.089 -14.471 -4.420
431 2HB ASN 63 2HB ASN 63 -10.043 -13.135 -3.776
432 1HD2 ASN 63 1HD2 ASN 63 -7.340 -13.493 -6.338
433 2HD2 ASN 63 2HD2 ASN 63 -8.154 -12.386 -7.376
434 H SER 64 H SER 64 -7.138 -15.341 -3.648
435 HA SER 64 HA SER 64 -4.346 -14.961 -3.704
436 1HB SER 64 1HB SER 64 -5.618 -17.164 -3.338
437 2HB SER 64 2HB SER 64 -5.805 -17.244 -5.125
438 HG SER 64 HG SER 64 -3.965 -18.371 -4.382
439 H GLU 65 H GLU 65 -3.033 -15.819 -5.800
440 HA GLU 65 HA GLU 65 -2.923 -13.402 -7.161
441 1HB GLU 65 1HB GLU 65 -1.461 -15.947 -8.043
442 2HB GLU 65 2HB GLU 65 -1.117 -14.277 -8.542
443 1HG GLU 65 1HG GLU 65 0.537 -14.755 -6.917
444 2HG GLU 65 2HG GLU 65 -0.646 -13.709 -6.054
445 HE2 GLU 65 HE2 GLU 65 -0.420 -16.088 -3.579
446 H ILE 66 H ILE 66 -3.904 -16.566 -8.527
447 HA ILE 66 HA ILE 66 -5.205 -15.135 -10.698
448 HB ILE 66 HB ILE 66 -4.019 -17.061 -11.290
449 1HG1 ILE 66 1HG1 ILE 66 -7.068 -17.150 -11.749
450 2HG1 ILE 66 2HG1 ILE 66 -5.887 -16.046 -12.532
451 1HG2 ILE 66 1HG2 ILE 66 -4.639 -19.299 -10.891
452 2HG2 ILE 66 2HG2 ILE 66 -6.152 -18.889 -10.044
453 3HG2 ILE 66 3HG2 ILE 66 -4.536 -18.554 -9.273
454 1HD1 ILE 66 1HD1 ILE 66 -6.385 -17.876 -14.092
455 2HD1 ILE 66 2HD1 ILE 66 -6.032 -19.116 -12.840
456 3HD1 ILE 66 3HD1 ILE 66 -4.700 -18.096 -13.489
457 H GLU 67 H GLU 67 -6.607 -17.613 -8.406
458 HA GLU 67 HA GLU 67 -8.727 -15.740 -7.774
459 1HB GLU 67 1HB GLU 67 -9.008 -18.680 -8.644
460 2HB GLU 67 2HB GLU 67 -10.308 -17.759 -7.799
461 1HG GLU 67 1HG GLU 67 -10.555 -16.209 -9.713
462 2HG GLU 67 2HG GLU 67 -9.135 -16.934 -10.552
463 HE2 GLU 67 HE2 GLU 67 -12.639 -18.886 -10.514