Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
7283 | 1k7b RC | 5210 | cing | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 H SER 10 H SER 10 -5.731 -1.175 5.930
2 HA SER 10 HA SER 10 -7.391 -3.309 6.985
3 1HB SER 10 1HB SER 10 -7.583 -0.511 8.189
4 2HB SER 10 2HB SER 10 -8.914 -1.679 8.239
5 HG SER 10 HG SER 10 -6.342 -2.429 9.132
6 H CYS 11 H CYS 11 -7.934 -3.713 5.022
7 HA CYS 11 HA CYS 11 -9.799 -2.036 3.535
8 1HB CYS 11 1HB CYS 11 -7.115 -1.839 3.093
9 2HB CYS 11 2HB CYS 11 -7.439 -3.228 2.092
10 HA PRO 12 HA PRO 12 -10.919 -6.426 2.567
11 1HB PRO 12 1HB PRO 12 -9.577 -6.684 -0.109
12 2HB PRO 12 2HB PRO 12 -11.277 -7.040 0.315
13 1HG PRO 12 1HG PRO 12 -10.623 -4.822 -1.125
14 2HG PRO 12 2HG PRO 12 -11.902 -4.771 0.133
15 1HD PRO 12 1HD PRO 12 -9.005 -3.923 0.372
16 2HD PRO 12 2HD PRO 12 -10.485 -3.050 0.879
17 HA PRO 13 HA PRO 13 -7.186 -8.620 3.648
18 1HB PRO 13 1HB PRO 13 -7.556 -11.230 2.916
19 2HB PRO 13 2HB PRO 13 -8.478 -10.465 4.250
20 1HG PRO 13 1HG PRO 13 -9.318 -10.814 1.361
21 2HG PRO 13 2HG PRO 13 -10.253 -11.234 2.836
22 1HD PRO 13 1HD PRO 13 -10.644 -8.900 1.496
23 2HD PRO 13 2HD PRO 13 -10.725 -8.949 3.285
24 H GLY 14 H GLY 14 -5.308 -9.220 2.947
25 1HA GLY 14 1HA GLY 14 -3.469 -9.174 1.591
26 2HA GLY 14 2HA GLY 14 -4.467 -9.728 0.251
27 H GLN 15 H GLN 15 -5.286 -6.618 1.820
28 HA GLN 15 HA GLN 15 -3.920 -5.067 -0.251
29 1HB GLN 15 1HB GLN 15 -6.853 -5.249 0.205
30 2HB GLN 15 2HB GLN 15 -6.182 -3.633 -0.040
31 1HG GLN 15 1HG GLN 15 -5.370 -4.099 -2.179
32 2HG GLN 15 2HG GLN 15 -5.343 -5.846 -1.916
33 1HE2 GLN 15 1HE2 GLN 15 -7.436 -6.961 -1.654
34 2HE2 GLN 15 2HE2 GLN 15 -8.704 -6.402 -2.741
35 H PHE 16 H PHE 16 -3.003 -3.394 0.533
36 HA PHE 16 HA PHE 16 -3.783 -2.190 3.197
37 1HB PHE 16 1HB PHE 16 -1.567 -2.010 3.944
38 2HB PHE 16 2HB PHE 16 -1.633 -3.622 3.273
39 HD1 PHE 16 HD1 PHE 16 -0.842 -3.861 0.804
40 HD2 PHE 16 HD2 PHE 16 0.077 -0.447 3.224
41 HE1 PHE 16 HE1 PHE 16 0.985 -3.264 -0.759
42 HE2 PHE 16 HE2 PHE 16 1.819 0.236 1.624
43 HZ PHE 16 HZ PHE 16 2.280 -1.233 -0.425
44 H ARG 17 H ARG 17 -3.016 0.119 3.505
45 HA ARG 17 HA ARG 17 -2.847 1.596 0.915
46 1HB ARG 17 1HB ARG 17 -3.788 3.500 1.983
47 2HB ARG 17 2HB ARG 17 -4.840 2.081 2.156
48 1HG ARG 17 1HG ARG 17 -4.088 1.816 4.517
49 2HG ARG 17 2HG ARG 17 -3.060 3.244 4.343
50 1HD ARG 17 1HD ARG 17 -5.141 3.850 5.476
51 2HD ARG 17 2HD ARG 17 -5.020 4.657 3.917
52 HE ARG 17 HE ARG 17 -6.899 3.529 3.160
53 1HH1 ARG 17 1HH1 ARG 17 -5.985 1.882 6.142
54 2HH1 ARG 17 2HH1 ARG 17 -7.402 0.844 6.006
55 1HH2 ARG 17 2HH2 ARG 17 -8.551 2.153 3.109
56 2HH2 ARG 17 1HH2 ARG 17 -8.729 0.941 4.378
57 H CYS 18 H CYS 18 -1.490 3.158 0.567
58 HA CYS 18 HA CYS 18 1.160 2.775 1.736
59 1HB CYS 18 1HB CYS 18 -0.011 4.049 -0.726
60 2HB CYS 18 2HB CYS 18 1.624 4.465 -0.233
61 H SER 19 H SER 19 0.154 5.745 0.506
62 HA SER 19 HA SER 19 1.486 7.174 2.761
63 1HB SER 19 1HB SER 19 1.449 7.884 -0.200
64 2HB SER 19 2HB SER 19 2.357 8.741 1.061
65 HG SER 19 HG SER 19 3.085 6.585 -0.320
66 H GLU 20 H GLU 20 -1.147 6.731 2.743
67 HA GLU 20 HA GLU 20 -2.126 9.469 3.346
68 1HB GLU 20 1HB GLU 20 -2.981 8.876 1.135
69 2HB GLU 20 2HB GLU 20 -3.775 7.449 1.801
70 1HG GLU 20 1HG GLU 20 -5.269 8.834 3.145
71 2HG GLU 20 2HG GLU 20 -4.335 10.284 2.765
72 HA PRO 21 HA PRO 21 -2.813 7.135 7.119
73 1HB PRO 21 1HB PRO 21 -3.856 9.126 8.717
74 2HB PRO 21 2HB PRO 21 -2.145 9.077 8.197
75 1HG PRO 21 1HG PRO 21 -4.440 10.609 6.925
76 2HG PRO 21 2HG PRO 21 -2.833 11.238 7.422
77 1HD PRO 21 1HD PRO 21 -3.317 10.498 4.860
78 2HD PRO 21 2HD PRO 21 -1.747 10.130 5.632
79 HA PRO 22 HA PRO 22 -7.087 5.873 7.346
80 1HB PRO 22 1HB PRO 22 -7.571 5.391 10.007
81 2HB PRO 22 2HB PRO 22 -6.516 4.363 8.990
82 1HG PRO 22 1HG PRO 22 -5.685 6.641 10.819
83 2HG PRO 22 2HG PRO 22 -5.044 4.968 10.758
84 1HD PRO 22 1HD PRO 22 -3.790 6.995 9.473
85 2HD PRO 22 2HD PRO 22 -3.913 5.386 8.705
86 H GLY 23 H GLY 23 -9.192 6.341 8.465
87 1HA GLY 23 1HA GLY 23 -10.944 7.875 8.735
88 2HA GLY 23 2HA GLY 23 -9.778 9.140 9.112
89 H ALA 24 H ALA 24 -8.389 8.272 6.468
90 HA ALA 24 HA ALA 24 -10.297 9.265 4.414
91 1HB ALA 24 1HB ALA 24 -8.363 10.306 3.266
92 2HB ALA 24 2HB ALA 24 -8.638 11.016 4.868
93 3HB ALA 24 3HB ALA 24 -7.312 9.858 4.627
94 H HIS 25 H HIS 25 -10.836 6.989 4.390
95 HA HIS 25 HA HIS 25 -9.218 4.830 4.310
96 1HB HIS 25 1HB HIS 25 -11.907 5.147 2.911
97 2HB HIS 25 2HB HIS 25 -11.189 3.647 3.461
98 HD1 HIS 25 HD1 HIS 25 -13.658 6.064 4.603
99 HD2 HIS 25 HD2 HIS 25 -10.562 3.765 6.351
100 HE1 HIS 25 HE1 HIS 25 -14.150 5.972 7.130
101 HE2 HIS 25 HE2 HIS 25 -12.277 4.562 8.190
102 H GLY 26 H GLY 26 -10.212 6.566 1.518
103 1HA GLY 26 1HA GLY 26 -9.360 6.768 -0.651
104 2HA GLY 26 2HA GLY 26 -7.832 6.385 0.140
105 H GLU 27 H GLU 27 -7.061 5.448 -1.679
106 HA GLU 27 HA GLU 27 -8.070 2.714 -2.453
107 1HB GLU 27 1HB GLU 27 -6.607 4.813 -4.127
108 2HB GLU 27 2HB GLU 27 -6.845 3.147 -4.634
109 1HG GLU 27 1HG GLU 27 -9.079 5.142 -4.051
110 2HG GLU 27 2HG GLU 27 -8.440 4.769 -5.645
111 H CYS 28 H CYS 28 -7.195 1.481 -1.268
112 HA CYS 28 HA CYS 28 -4.512 1.113 -0.512
113 1HB CYS 28 1HB CYS 28 -6.779 -0.798 -1.159
114 2HB CYS 28 2HB CYS 28 -5.435 -1.127 -0.155
115 H TYR 29 H TYR 29 -3.608 -1.109 -1.234
116 HA TYR 29 HA TYR 29 -3.586 -1.692 -4.104
117 1HB TYR 29 1HB TYR 29 -1.060 -0.972 -2.538
118 2HB TYR 29 2HB TYR 29 -1.066 -1.571 -4.174
119 HD1 TYR 29 HD1 TYR 29 -1.291 1.319 -2.007
120 HD2 TYR 29 HD2 TYR 29 -1.917 -0.027 -6.067
121 HE1 TYR 29 HE1 TYR 29 -1.294 3.678 -2.800
122 HE2 TYR 29 HE2 TYR 29 -1.906 2.327 -6.842
123 HH TYR 29 HH TYR 29 -1.468 5.080 -4.597
124 HA PRO 30 HA PRO 30 -3.164 -5.784 -2.440
125 1HB PRO 30 1HB PRO 30 -1.047 -6.429 -4.431
126 2HB PRO 30 2HB PRO 30 -2.593 -7.267 -4.117
127 1HG PRO 30 1HG PRO 30 -2.261 -5.701 -6.337
128 2HG PRO 30 2HG PRO 30 -3.805 -5.684 -5.423
129 1HD PRO 30 1HD PRO 30 -1.505 -3.722 -5.251
130 2HD PRO 30 2HD PRO 30 -3.254 -3.389 -5.389
131 H GLN 31 H GLN 31 -1.889 -6.940 -1.036
132 HA GLN 31 HA GLN 31 0.721 -5.833 -0.177
133 1HB GLN 31 1HB GLN 31 -0.822 -8.324 0.717
134 2HB GLN 31 2HB GLN 31 0.658 -7.743 1.477
135 1HG GLN 31 1HG GLN 31 -0.421 -5.704 2.221
136 2HG GLN 31 2HG GLN 31 -1.908 -6.109 1.362
137 1HE2 GLN 31 1HE2 GLN 31 -3.182 -6.017 3.385
138 2HE2 GLN 31 2HE2 GLN 31 -2.977 -7.320 4.542
139 H ASP 32 H ASP 32 -0.192 -7.788 -2.673
140 HA ASP 32 HA ASP 32 2.253 -9.271 -3.030
141 1HB ASP 32 1HB ASP 32 -0.039 -9.344 -4.320
142 2HB ASP 32 2HB ASP 32 0.535 -7.941 -5.173
143 H TRP 33 H TRP 33 1.182 -6.083 -3.474
144 HA TRP 33 HA TRP 33 3.788 -5.004 -4.289
145 1HB TRP 33 1HB TRP 33 1.222 -3.465 -4.004
146 2HB TRP 33 2HB TRP 33 2.721 -2.955 -4.729
147 HD1 TRP 33 HD1 TRP 33 1.996 -6.238 -6.222
148 HE1 TRP 33 HE1 TRP 33 0.684 -6.054 -8.415
149 HE3 TRP 33 HE3 TRP 33 0.850 -1.255 -6.050
150 HZ2 TRP 33 HZ2 TRP 33 -0.813 -4.047 -9.835
151 HZ3 TRP 33 HZ3 TRP 33 -0.498 -0.221 -7.880
152 HH2 TRP 33 HH2 TRP 33 -1.389 -1.615 -9.724
153 H LEU 34 H LEU 34 3.623 -6.133 -1.971
154 HA LEU 34 HA LEU 34 4.772 -3.954 -0.305
155 1HB LEU 34 1HB LEU 34 2.512 -4.737 0.631
156 2HB LEU 34 2HB LEU 34 3.236 -6.314 0.859
157 HG LEU 34 HG LEU 34 5.036 -5.137 2.292
158 1HD1 LEU 34 1HD1 LEU 34 2.906 -2.962 2.374
159 2HD1 LEU 34 2HD1 LEU 34 4.418 -3.013 3.306
160 3HD1 LEU 34 3HD1 LEU 34 4.465 -2.806 1.549
161 1HD2 LEU 34 1HD2 LEU 34 2.130 -5.116 3.233
162 2HD2 LEU 34 2HD2 LEU 34 3.221 -6.521 3.249
163 3HD2 LEU 34 3HD2 LEU 34 3.566 -5.124 4.282
164 H CYS 35 H CYS 35 6.870 -4.320 -0.555
165 HA CYS 35 HA CYS 35 8.804 -5.134 -1.174
166 1HB CYS 35 1HB CYS 35 8.864 -5.802 0.934
167 2HB CYS 35 2HB CYS 35 7.976 -7.280 0.708
168 H ASP 36 H ASP 36 7.676 -5.108 -3.252
169 HA ASP 36 HA ASP 36 7.264 -7.752 -4.603
170 1HB ASP 36 1HB ASP 36 5.734 -5.823 -5.089
171 2HB ASP 36 2HB ASP 36 7.109 -4.936 -5.737
172 H GLY 37 H GLY 37 9.721 -5.490 -3.877
173 1HA GLY 37 1HA GLY 37 12.042 -5.630 -4.422
174 2HA GLY 37 2HA GLY 37 11.648 -6.634 -5.830
175 H HIS 38 H HIS 38 9.557 -4.193 -5.562
176 HA HIS 38 HA HIS 38 10.796 -2.161 -7.284
177 1HB HIS 38 1HB HIS 38 10.002 -3.711 -8.891
178 2HB HIS 38 2HB HIS 38 8.566 -4.088 -7.977
179 HD1 HIS 38 HD1 HIS 38 9.788 -1.138 -10.206
180 HD2 HIS 38 HD2 HIS 38 6.468 -2.637 -8.079
181 HE1 HIS 38 HE1 HIS 38 7.811 0.460 -10.680
182 HE2 HIS 38 HE2 HIS 38 5.777 -0.496 -9.388
183 HA PRO 39 HA PRO 39 8.114 -0.037 -4.285
184 1HB PRO 39 1HB PRO 39 8.500 2.560 -5.190
185 2HB PRO 39 2HB PRO 39 9.421 1.680 -3.966
186 1HG PRO 39 1HG PRO 39 10.255 2.404 -6.710
187 2HG PRO 39 2HG PRO 39 11.257 1.774 -5.372
188 1HD PRO 39 1HD PRO 39 10.172 0.353 -7.672
189 2HD PRO 39 2HD PRO 39 11.260 -0.274 -6.412
190 H ASP 40 H ASP 40 6.090 0.997 -4.286
191 HA ASP 40 HA ASP 40 4.988 2.107 -6.842
192 1HB ASP 40 1HB ASP 40 3.656 -0.118 -5.256
193 2HB ASP 40 2HB ASP 40 2.790 0.898 -6.396
194 H CYS 41 H CYS 41 5.586 2.532 -3.602
195 HA CYS 41 HA CYS 41 2.956 3.097 -2.790
196 1HB CYS 41 1HB CYS 41 5.377 2.726 -1.488
197 2HB CYS 41 2HB CYS 41 4.662 4.176 -0.819
198 H ASP 42 H ASP 42 3.956 4.896 -4.751
199 HA ASP 42 HA ASP 42 4.679 6.930 -5.368
200 1HB ASP 42 1HB ASP 42 2.195 7.311 -5.074
201 2HB ASP 42 2HB ASP 42 2.544 8.045 -3.509
202 H ASP 43 H ASP 43 5.309 6.058 -2.386
203 HA ASP 43 HA ASP 43 7.640 7.825 -2.353
204 1HB ASP 43 1HB ASP 43 5.814 7.973 -0.381
205 2HB ASP 43 2HB ASP 43 6.787 6.641 0.213
206 H GLY 44 H GLY 44 6.602 4.889 -2.949
207 1HA GLY 44 1HA GLY 44 7.679 2.744 -3.105
208 2HA GLY 44 2HA GLY 44 9.205 3.545 -2.783
209 H ARG 45 H ARG 45 6.627 3.721 -0.571
210 HA ARG 45 HA ARG 45 8.351 2.529 1.557
211 1HB ARG 45 1HB ARG 45 6.912 3.476 3.232
212 2HB ARG 45 2HB ARG 45 7.500 4.724 2.146
213 1HG ARG 45 1HG ARG 45 5.374 4.947 1.067
214 2HG ARG 45 2HG ARG 45 4.726 3.500 1.861
215 1HD ARG 45 1HD ARG 45 5.647 5.960 3.382
216 2HD ARG 45 2HD ARG 45 3.988 5.753 2.791
217 HE ARG 45 HE ARG 45 4.363 3.427 4.155
218 1HH1 ARG 45 1HH1 ARG 45 4.676 6.758 5.174
219 2HH1 ARG 45 2HH1 ARG 45 4.288 6.376 6.834
220 1HH2 ARG 45 2HH2 ARG 45 3.915 3.001 6.269
221 2HH2 ARG 45 1HH2 ARG 45 3.861 4.302 7.424
222 H ASP 46 H ASP 46 6.537 1.211 -0.671
223 HA ASP 46 HA ASP 46 5.239 -0.728 1.001
224 1HB ASP 46 1HB ASP 46 4.871 -1.863 -1.145
225 2HB ASP 46 2HB ASP 46 4.158 -0.260 -1.153
226 H GLU 47 H GLU 47 8.167 -0.057 -0.737
227 HA GLU 47 HA GLU 47 9.191 -2.748 -0.576
228 1HB GLU 47 1HB GLU 47 10.419 -0.048 -1.206
229 2HB GLU 47 2HB GLU 47 11.374 -1.509 -1.219
230 1HG GLU 47 1HG GLU 47 8.798 -1.395 -2.797
231 2HG GLU 47 2HG GLU 47 10.259 -0.648 -3.404
232 H TRP 48 H TRP 48 9.352 0.082 1.314
233 HA TRP 48 HA TRP 48 11.839 -0.170 2.516
234 1HB TRP 48 1HB TRP 48 9.441 1.254 3.673
235 2HB TRP 48 2HB TRP 48 11.102 1.416 4.224
236 HD1 TRP 48 HD1 TRP 48 11.340 1.468 0.552
237 HE1 TRP 48 HE1 TRP 48 11.052 3.797 -0.414
238 HE3 TRP 48 HE3 TRP 48 9.845 3.787 4.766
239 HZ2 TRP 48 HZ2 TRP 48 10.521 6.520 0.651
240 HZ3 TRP 48 HZ3 TRP 48 9.450 6.294 4.824
241 HH2 TRP 48 HH2 TRP 48 9.794 7.636 2.759
242 H GLY 49 H GLY 49 12.540 -1.603 3.521
243 1HA GLY 49 1HA GLY 49 13.152 -2.971 5.366
244 2HA GLY 49 2HA GLY 49 11.712 -2.388 6.209
245 H CYS 50 H CYS 50 10.737 -3.615 3.171
246 HA CYS 50 HA CYS 50 9.191 -5.143 2.759
247 1HB CYS 50 1HB CYS 50 11.403 -5.721 1.986
248 2HB CYS 50 2HB CYS 50 11.769 -6.517 3.489
249 H GLY 51 H GLY 51 8.899 -4.453 5.506
250 1HA GLY 51 1HA GLY 51 6.873 -6.329 6.340
251 2HA GLY 51 2HA GLY 51 8.334 -6.591 7.294
Start of MODEL 2
1 H SER 10 H SER 10 -5.976 -1.076 5.850
2 HA SER 10 HA SER 10 -7.745 -3.210 6.818
3 1HB SER 10 1HB SER 10 -7.946 -0.351 7.877
4 2HB SER 10 2HB SER 10 -9.187 -1.602 8.070
5 HG SER 10 HG SER 10 -7.828 -1.451 9.909
6 H CYS 11 H CYS 11 -8.175 -3.623 4.837
7 HA CYS 11 HA CYS 11 -9.975 -1.950 3.249
8 1HB CYS 11 1HB CYS 11 -7.260 -1.827 2.923
9 2HB CYS 11 2HB CYS 11 -7.587 -3.203 1.907
10 HA PRO 12 HA PRO 12 -11.052 -6.373 2.298
11 1HB PRO 12 1HB PRO 12 -9.623 -6.728 -0.301
12 2HB PRO 12 2HB PRO 12 -11.355 -6.985 0.052
13 1HG PRO 12 1HG PRO 12 -10.489 -4.847 -1.427
14 2HG PRO 12 2HG PRO 12 -11.869 -4.718 -0.287
15 1HD PRO 12 1HD PRO 12 -8.982 -3.938 0.170
16 2HD PRO 12 2HD PRO 12 -10.472 -3.015 0.529
17 HA PRO 13 HA PRO 13 -7.335 -8.490 3.572
18 1HB PRO 13 1HB PRO 13 -7.617 -11.114 2.853
19 2HB PRO 13 2HB PRO 13 -8.627 -10.353 4.122
20 1HG PRO 13 1HG PRO 13 -9.301 -10.758 1.196
21 2HG PRO 13 2HG PRO 13 -10.307 -11.173 2.624
22 1HD PRO 13 1HD PRO 13 -10.656 -8.866 1.224
23 2HD PRO 13 2HD PRO 13 -10.851 -8.895 3.004
24 H GLY 14 H GLY 14 -5.411 -9.128 2.991
25 1HA GLY 14 1HA GLY 14 -3.493 -9.094 1.742
26 2HA GLY 14 2HA GLY 14 -4.424 -9.682 0.366
27 H GLN 15 H GLN 15 -5.295 -6.540 1.834
28 HA GLN 15 HA GLN 15 -3.913 -5.044 -0.262
29 1HB GLN 15 1HB GLN 15 -6.864 -5.273 0.076
30 2HB GLN 15 2HB GLN 15 -6.203 -3.675 -0.292
31 1HG GLN 15 1HG GLN 15 -5.297 -4.322 -2.344
32 2HG GLN 15 2HG GLN 15 -5.239 -6.033 -1.914
33 1HE2 GLN 15 2HE2 GLN 15 -7.369 -7.145 -1.551
34 2HE2 GLN 15 1HE2 GLN 15 -8.562 -6.756 -2.786
35 H PHE 16 H PHE 16 -2.938 -3.426 0.559
36 HA PHE 16 HA PHE 16 -3.790 -2.175 3.182
37 1HB PHE 16 1HB PHE 16 -1.591 -2.042 3.956
38 2HB PHE 16 2HB PHE 16 -1.669 -3.646 3.265
39 HD1 PHE 16 HD1 PHE 16 -0.821 -3.891 0.822
40 HD2 PHE 16 HD2 PHE 16 0.076 -0.483 3.263
41 HE1 PHE 16 HE1 PHE 16 1.006 -3.281 -0.728
42 HE2 PHE 16 HE2 PHE 16 1.839 0.199 1.680
43 HZ PHE 16 HZ PHE 16 2.306 -1.254 -0.373
44 H ARG 17 H ARG 17 -3.071 0.122 3.490
45 HA ARG 17 HA ARG 17 -2.869 1.598 0.902
46 1HB ARG 17 1HB ARG 17 -3.756 3.525 1.979
47 2HB ARG 17 2HB ARG 17 -4.844 2.127 2.139
48 1HG ARG 17 1HG ARG 17 -4.105 1.831 4.502
49 2HG ARG 17 2HG ARG 17 -3.041 3.233 4.338
50 1HD ARG 17 1HD ARG 17 -5.112 3.885 5.467
51 2HD ARG 17 2HD ARG 17 -4.967 4.694 3.912
52 HE ARG 17 HE ARG 17 -6.868 3.614 3.144
53 1HH1 ARG 17 2HH1 ARG 17 -6.008 1.936 6.119
54 2HH1 ARG 17 1HH1 ARG 17 -7.464 0.957 5.997
55 1HH2 ARG 17 1HH2 ARG 17 -8.555 2.306 3.087
56 2HH2 ARG 17 2HH2 ARG 17 -8.766 1.061 4.321
57 H CYS 18 H CYS 18 -1.532 3.196 0.580
58 HA CYS 18 HA CYS 18 1.130 2.771 1.734
59 1HB CYS 18 1HB CYS 18 -0.039 3.982 -0.761
60 2HB CYS 18 2HB CYS 18 1.603 4.400 -0.282
61 H SER 19 H SER 19 0.202 5.736 0.431
62 HA SER 19 HA SER 19 1.535 7.155 2.691
63 1HB SER 19 1HB SER 19 1.512 7.901 -0.259
64 2HB SER 19 2HB SER 19 2.448 8.702 1.018
65 HG SER 19 HG SER 19 3.029 6.465 -0.381
66 H GLU 20 H GLU 20 -1.101 6.739 2.673
67 HA GLU 20 HA GLU 20 -2.060 9.470 3.318
68 1HB GLU 20 1HB GLU 20 -2.937 8.923 1.108
69 2HB GLU 20 2HB GLU 20 -3.715 7.476 1.742
70 1HG GLU 20 1HG GLU 20 -5.212 8.815 3.128
71 2HG GLU 20 2HG GLU 20 -4.295 10.282 2.777
72 HA PRO 21 HA PRO 21 -2.637 7.028 7.032
73 1HB PRO 21 1HB PRO 21 -3.607 8.963 8.735
74 2HB PRO 21 2HB PRO 21 -1.922 8.945 8.133
75 1HG PRO 21 1HG PRO 21 -4.287 10.492 7.014
76 2HG PRO 21 2HG PRO 21 -2.666 11.125 7.461
77 1HD PRO 21 1HD PRO 21 -3.253 10.455 4.898
78 2HD PRO 21 2HD PRO 21 -1.647 10.086 5.593
79 HA PRO 22 HA PRO 22 -6.921 5.799 7.410
80 1HB PRO 22 1HB PRO 22 -7.278 5.236 10.076
81 2HB PRO 22 2HB PRO 22 -6.301 4.221 8.971
82 1HG PRO 22 1HG PRO 22 -5.326 6.413 10.834
83 2HG PRO 22 2HG PRO 22 -4.725 4.732 10.676
84 1HD PRO 22 1HD PRO 22 -3.500 6.788 9.403
85 2HD PRO 22 2HD PRO 22 -3.688 5.209 8.588
86 H GLY 23 H GLY 23 -8.958 6.279 8.657
87 1HA GLY 23 1HA GLY 23 -10.653 7.859 9.029
88 2HA GLY 23 2HA GLY 23 -9.433 9.080 9.387
89 H ALA 24 H ALA 24 -8.294 8.039 6.620
90 HA ALA 24 HA ALA 24 -10.210 9.227 4.698
91 1HB ALA 24 1HB ALA 24 -7.205 9.760 4.791
92 2HB ALA 24 2HB ALA 24 -8.306 10.264 3.491
93 3HB ALA 24 3HB ALA 24 -8.496 10.935 5.124
94 H HIS 25 H HIS 25 -10.834 7.012 4.502
95 HA HIS 25 HA HIS 25 -9.303 4.791 4.354
96 1HB HIS 25 1HB HIS 25 -11.955 5.296 2.941
97 2HB HIS 25 2HB HIS 25 -11.306 3.736 3.400
98 HD1 HIS 25 HD1 HIS 25 -13.735 6.105 4.657
99 HD2 HIS 25 HD2 HIS 25 -10.660 3.713 6.315
100 HE1 HIS 25 HE1 HIS 25 -14.243 5.897 7.174
101 HE2 HIS 25 HE2 HIS 25 -12.380 4.434 8.179
102 H GLY 26 H GLY 26 -10.148 6.703 1.625
103 1HA GLY 26 1HA GLY 26 -9.273 6.909 -0.540
104 2HA GLY 26 2HA GLY 26 -7.777 6.368 0.220
105 H GLU 27 H GLU 27 -7.040 5.282 -1.501
106 HA GLU 27 HA GLU 27 -8.282 2.646 -2.172
107 1HB GLU 27 1HB GLU 27 -8.820 4.286 -3.990
108 2HB GLU 27 2HB GLU 27 -7.093 4.591 -4.216
109 1HG GLU 27 1HG GLU 27 -6.744 2.235 -4.865
110 2HG GLU 27 2HG GLU 27 -8.433 1.865 -4.514
111 H CYS 28 H CYS 28 -7.236 1.314 -1.374
112 HA CYS 28 HA CYS 28 -4.536 1.160 -0.633
113 1HB CYS 28 1HB CYS 28 -6.671 -0.936 -1.167
114 2HB CYS 28 2HB CYS 28 -5.342 -1.082 -0.089
115 H TYR 29 H TYR 29 -3.522 -1.112 -1.248
116 HA TYR 29 HA TYR 29 -3.502 -1.751 -4.110
117 1HB TYR 29 1HB TYR 29 -0.989 -0.959 -2.556
118 2HB TYR 29 2HB TYR 29 -0.981 -1.598 -4.178
119 HD1 TYR 29 HD1 TYR 29 -1.851 -0.126 -6.114
120 HD2 TYR 29 HD2 TYR 29 -1.298 1.346 -2.086
121 HE1 TYR 29 HE1 TYR 29 -1.953 2.206 -6.945
122 HE2 TYR 29 HE2 TYR 29 -1.410 3.683 -2.935
123 HH TYR 29 HH TYR 29 -1.678 5.031 -4.763
124 HA PRO 30 HA PRO 30 -3.072 -5.812 -2.417
125 1HB PRO 30 1HB PRO 30 -0.945 -6.484 -4.382
126 2HB PRO 30 2HB PRO 30 -2.505 -7.302 -4.083
127 1HG PRO 30 1HG PRO 30 -2.115 -5.750 -6.310
128 2HG PRO 30 2HG PRO 30 -3.677 -5.721 -5.428
129 1HD PRO 30 1HD PRO 30 -1.369 -3.771 -5.219
130 2HD PRO 30 2HD PRO 30 -3.113 -3.429 -5.394
131 H GLN 31 H GLN 31 -1.826 -6.929 -0.986
132 HA GLN 31 HA GLN 31 0.789 -5.858 -0.121
133 1HB GLN 31 1HB GLN 31 -0.834 -8.317 0.738
134 2HB GLN 31 2HB GLN 31 0.676 -7.819 1.511
135 1HG GLN 31 1HG GLN 31 -0.288 -5.780 2.328
136 2HG GLN 31 2HG GLN 31 -1.756 -5.997 1.377
137 1HE2 GLN 31 2HE2 GLN 31 -0.090 -8.493 3.467
138 2HE2 GLN 31 1HE2 GLN 31 -1.510 -8.662 4.492
139 H ASP 32 H ASP 32 -0.099 -7.815 -2.614
140 HA ASP 32 HA ASP 32 2.357 -9.288 -2.958
141 1HB ASP 32 1HB ASP 32 0.081 -9.394 -4.263
142 2HB ASP 32 2HB ASP 32 0.632 -7.978 -5.108
143 H TRP 33 H TRP 33 1.262 -6.109 -3.422
144 HA TRP 33 HA TRP 33 3.865 -5.015 -4.228
145 1HB TRP 33 1HB TRP 33 1.280 -3.502 -3.995
146 2HB TRP 33 2HB TRP 33 2.784 -2.971 -4.695
147 HD1 TRP 33 HD1 TRP 33 2.084 -6.304 -6.156
148 HE1 TRP 33 HE1 TRP 33 0.831 -6.147 -8.378
149 HE3 TRP 33 HE3 TRP 33 0.913 -1.316 -6.072
150 HZ2 TRP 33 HZ2 TRP 33 -0.654 -4.171 -9.850
151 HZ3 TRP 33 HZ3 TRP 33 -0.417 -0.321 -7.930
152 HH2 TRP 33 HH2 TRP 33 -1.261 -1.745 -9.774
153 H LEU 34 H LEU 34 3.697 -6.131 -1.919
154 HA LEU 34 HA LEU 34 4.824 -3.938 -0.262
155 1HB LEU 34 1HB LEU 34 2.569 -4.718 0.680
156 2HB LEU 34 2HB LEU 34 3.288 -6.296 0.912
157 HG LEU 34 HG LEU 34 5.074 -5.142 2.361
158 1HD1 LEU 34 1HD1 LEU 34 2.994 -2.920 2.397
159 2HD1 LEU 34 2HD1 LEU 34 4.491 -2.997 3.352
160 3HD1 LEU 34 3HD1 LEU 34 4.567 -2.805 1.595
161 1HD2 LEU 34 1HD2 LEU 34 3.210 -6.476 3.302
162 2HD2 LEU 34 2HD2 LEU 34 3.573 -5.080 4.331
163 3HD2 LEU 34 3HD2 LEU 34 2.154 -5.045 3.260
164 H CYS 35 H CYS 35 6.922 -4.289 -0.526
165 HA CYS 35 HA CYS 35 8.862 -5.094 -1.133
166 1HB CYS 35 1HB CYS 35 8.935 -5.730 0.976
167 2HB CYS 35 2HB CYS 35 8.047 -7.217 0.778
168 H ASP 36 H ASP 36 7.743 -5.101 -3.205
169 HA ASP 36 HA ASP 36 7.343 -7.763 -4.527
170 1HB ASP 36 1HB ASP 36 5.783 -5.858 -5.012
171 2HB ASP 36 2HB ASP 36 7.136 -4.962 -5.687
172 H GLY 37 H GLY 37 9.783 -5.468 -3.846
173 1HA GLY 37 1HA GLY 37 12.101 -5.583 -4.434
174 2HA GLY 37 2HA GLY 37 11.692 -6.606 -5.825
175 H HIS 38 H HIS 38 9.576 -4.200 -5.555
176 HA HIS 38 HA HIS 38 10.764 -2.182 -7.334
177 1HB HIS 38 1HB HIS 38 9.907 -3.762 -8.886
178 2HB HIS 38 2HB HIS 38 8.488 -4.089 -7.927
179 HD1 HIS 38 HD1 HIS 38 9.736 -1.201 -10.224
180 HD2 HIS 38 HD2 HIS 38 6.404 -2.589 -8.045
181 HE1 HIS 38 HE1 HIS 38 7.779 0.406 -10.746
182 HE2 HIS 38 HE2 HIS 38 5.729 -0.484 -9.444
183 HA PRO 39 HA PRO 39 8.132 -0.062 -4.266
184 1HB PRO 39 1HB PRO 39 8.588 2.534 -5.224
185 2HB PRO 39 2HB PRO 39 9.375 1.686 -3.889
186 1HG PRO 39 1HG PRO 39 10.601 2.388 -6.428
187 2HG PRO 39 2HG PRO 39 11.324 1.466 -5.079
188 1HD PRO 39 1HD PRO 39 10.116 0.471 -7.604
189 2HD PRO 39 2HD PRO 39 11.286 -0.329 -6.527
190 H ASP 40 H ASP 40 6.124 0.966 -4.298
191 HA ASP 40 HA ASP 40 5.124 2.145 -6.829
192 1HB ASP 40 1HB ASP 40 4.572 -0.551 -6.418
193 2HB ASP 40 2HB ASP 40 3.141 0.214 -5.753
194 H CYS 41 H CYS 41 5.553 2.480 -3.649
195 HA CYS 41 HA CYS 41 2.892 2.919 -2.819
196 1HB CYS 41 1HB CYS 41 5.311 2.615 -1.528
197 2HB CYS 41 2HB CYS 41 4.618 4.093 -0.900
198 H ASP 42 H ASP 42 3.797 4.728 -4.813
199 HA ASP 42 HA ASP 42 4.440 6.778 -5.469
200 1HB ASP 42 1HB ASP 42 1.951 7.097 -5.122
201 2HB ASP 42 2HB ASP 42 2.316 7.852 -3.571
202 H ASP 43 H ASP 43 5.108 5.984 -2.465
203 HA ASP 43 HA ASP 43 7.368 7.855 -2.358
204 1HB ASP 43 1HB ASP 43 5.523 7.978 -0.512
205 2HB ASP 43 2HB ASP 43 6.292 6.518 0.075
206 H GLY 44 H GLY 44 6.473 4.861 -3.029
207 1HA GLY 44 1HA GLY 44 7.620 2.752 -3.145
208 2HA GLY 44 2HA GLY 44 9.114 3.608 -2.823
209 H ARG 45 H ARG 45 6.533 3.717 -0.600
210 HA ARG 45 HA ARG 45 8.321 2.607 1.517
211 1HB ARG 45 1HB ARG 45 6.961 3.560 3.199
212 2HB ARG 45 2HB ARG 45 7.304 4.810 2.011
213 1HG ARG 45 1HG ARG 45 5.033 4.636 1.105
214 2HG ARG 45 2HG ARG 45 4.697 3.233 2.132
215 1HD ARG 45 1HD ARG 45 3.640 5.137 3.096
216 2HD ARG 45 2HD ARG 45 4.984 4.655 4.145
217 HE ARG 45 HE ARG 45 5.866 6.685 2.299
218 1HH1 ARG 45 2HH2 ARG 45 3.741 6.495 5.069
219 2HH1 ARG 45 1HH2 ARG 45 4.028 8.165 5.496
220 1HH2 ARG 45 1HH1 ARG 45 6.255 8.681 2.906
221 2HH2 ARG 45 2HH1 ARG 45 5.416 9.409 4.274
222 H ASP 46 H ASP 46 6.524 1.209 -0.683
223 HA ASP 46 HA ASP 46 5.264 -0.739 1.004
224 1HB ASP 46 1HB ASP 46 4.915 -1.896 -1.129
225 2HB ASP 46 2HB ASP 46 4.166 -0.308 -1.141
226 H GLU 47 H GLU 47 8.180 -0.022 -0.740
227 HA GLU 47 HA GLU 47 9.242 -2.702 -0.554
228 1HB GLU 47 1HB GLU 47 10.434 0.007 -1.200
229 2HB GLU 47 2HB GLU 47 11.413 -1.442 -1.196
230 1HG GLU 47 1HG GLU 47 8.838 -1.377 -2.779
231 2HG GLU 47 2HG GLU 47 10.290 -0.613 -3.389
232 H TRP 48 H TRP 48 9.353 0.141 1.322
233 HA TRP 48 HA TRP 48 11.827 -0.082 2.555
234 1HB TRP 48 1HB TRP 48 9.403 1.322 3.684
235 2HB TRP 48 2HB TRP 48 11.060 1.514 4.235
236 HD1 TRP 48 HD1 TRP 48 11.298 1.549 0.562
237 HE1 TRP 48 HE1 TRP 48 10.956 3.858 -0.419
238 HE3 TRP 48 HE3 TRP 48 9.779 3.865 4.770
239 HZ2 TRP 48 HZ2 TRP 48 10.277 6.575 0.615
240 HZ3 TRP 48 HZ3 TRP 48 9.316 6.358 4.810
241 HH2 TRP 48 HH2 TRP 48 9.580 7.684 2.727
242 H GLY 49 H GLY 49 12.520 -1.509 3.583
243 1HA GLY 49 1HA GLY 49 13.117 -2.853 5.452
244 2HA GLY 49 2HA GLY 49 11.654 -2.285 6.265
245 H CYS 50 H CYS 50 10.714 -3.531 3.235
246 HA CYS 50 HA CYS 50 9.202 -5.091 2.817
247 1HB CYS 50 1HB CYS 50 11.435 -5.634 2.070
248 2HB CYS 50 2HB CYS 50 11.796 -6.417 3.579
249 H GLY 51 H GLY 51 8.958 -4.421 5.625
250 1HA GLY 51 1HA GLY 51 6.941 -6.332 6.448
251 2HA GLY 51 2HA GLY 51 8.420 -6.560 7.381
Start of MODEL 3
1 H SER 10 H SER 10 -6.013 -1.163 5.920
2 HA SER 10 HA SER 10 -7.832 -3.286 6.815
3 1HB SER 10 1HB SER 10 -8.055 -0.426 7.868
4 2HB SER 10 2HB SER 10 -9.310 -1.669 8.016
5 HG SER 10 HG SER 10 -8.013 -1.518 9.903
6 H CYS 11 H CYS 11 -8.207 -3.698 4.825
7 HA CYS 11 HA CYS 11 -9.987 -2.048 3.205
8 1HB CYS 11 1HB CYS 11 -7.268 -1.857 2.943
9 2HB CYS 11 2HB CYS 11 -7.545 -3.228 1.906
10 HA PRO 12 HA PRO 12 -10.989 -6.448 2.159
11 1HB PRO 12 1HB PRO 12 -9.456 -6.711 -0.408
12 2HB PRO 12 2HB PRO 12 -11.184 -7.060 -0.111
13 1HG PRO 12 1HG PRO 12 -10.405 -4.849 -1.509
14 2HG PRO 12 2HG PRO 12 -11.788 -4.797 -0.369
15 1HD PRO 12 1HD PRO 12 -8.929 -3.932 0.112
16 2HD PRO 12 2HD PRO 12 -10.451 -3.069 0.492
17 HA PRO 13 HA PRO 13 -7.314 -8.596 3.503
18 1HB PRO 13 1HB PRO 13 -7.621 -11.216 2.788
19 2HB PRO 13 2HB PRO 13 -8.648 -10.441 4.035
20 1HG PRO 13 1HG PRO 13 -9.261 -10.830 1.095
21 2HG PRO 13 2HG PRO 13 -10.303 -11.243 2.497
22 1HD PRO 13 1HD PRO 13 -10.606 -8.925 1.107
23 2HD PRO 13 2HD PRO 13 -10.828 -8.959 2.883
24 H GLY 14 H GLY 14 -5.388 -9.179 2.936
25 1HA GLY 14 1HA GLY 14 -3.463 -9.094 1.714
26 2HA GLY 14 2HA GLY 14 -4.342 -9.734 0.330
27 H GLN 15 H GLN 15 -5.294 -6.591 1.788
28 HA GLN 15 HA GLN 15 -3.925 -5.078 -0.304
29 1HB GLN 15 1HB GLN 15 -6.860 -5.367 -0.010
30 2HB GLN 15 2HB GLN 15 -6.261 -3.717 -0.220
31 1HG GLN 15 1HG GLN 15 -5.243 -4.174 -2.291
32 2HG GLN 15 2HG GLN 15 -5.249 -5.923 -2.027
33 1HE2 GLN 15 1HE2 GLN 15 -7.355 -7.019 -1.928
34 2HE2 GLN 15 2HE2 GLN 15 -8.558 -6.442 -3.079
35 H PHE 16 H PHE 16 -2.950 -3.461 0.527
36 HA PHE 16 HA PHE 16 -3.809 -2.225 3.150
37 1HB PHE 16 1HB PHE 16 -1.616 -2.112 3.950
38 2HB PHE 16 2HB PHE 16 -1.692 -3.709 3.241
39 HD1 PHE 16 HD1 PHE 16 0.055 -0.545 3.280
40 HD2 PHE 16 HD2 PHE 16 -0.832 -3.927 0.799
41 HE1 PHE 16 HE1 PHE 16 1.815 0.163 1.702
42 HE2 PHE 16 HE2 PHE 16 1.006 -3.304 -0.732
43 HZ PHE 16 HZ PHE 16 2.295 -1.275 -0.357
44 H ARG 17 H ARG 17 -3.092 0.073 3.475
45 HA ARG 17 HA ARG 17 -2.870 1.554 0.891
46 1HB ARG 17 1HB ARG 17 -3.751 3.480 1.984
47 2HB ARG 17 2HB ARG 17 -4.846 2.087 2.120
48 1HG ARG 17 1HG ARG 17 -4.123 1.756 4.483
49 2HG ARG 17 2HG ARG 17 -3.049 3.153 4.344
50 1HD ARG 17 1HD ARG 17 -5.123 3.796 5.475
51 2HD ARG 17 2HD ARG 17 -4.959 4.636 3.937
52 HE ARG 17 HE ARG 17 -6.877 3.600 3.148
53 1HH1 ARG 17 2HH2 ARG 17 -6.028 1.818 6.065
54 2HH1 ARG 17 1HH2 ARG 17 -7.488 0.848 5.901
55 1HH2 ARG 17 1HH1 ARG 17 -8.579 2.313 3.058
56 2HH2 ARG 17 2HH1 ARG 17 -8.790 1.021 4.245
57 H CYS 18 H CYS 18 -1.555 3.181 0.589
58 HA CYS 18 HA CYS 18 1.117 2.764 1.743
59 1HB CYS 18 1HB CYS 18 -0.049 3.957 -0.766
60 2HB CYS 18 2HB CYS 18 1.599 4.349 -0.289
61 H SER 19 H SER 19 0.187 5.704 0.386
62 HA SER 19 HA SER 19 1.550 7.150 2.606
63 1HB SER 19 1HB SER 19 1.454 7.864 -0.349
64 2HB SER 19 2HB SER 19 2.420 8.681 0.896
65 HG SER 19 HG SER 19 2.968 6.427 -0.488
66 H GLU 20 H GLU 20 -1.082 6.731 2.655
67 HA GLU 20 HA GLU 20 -2.057 9.462 3.278
68 1HB GLU 20 1HB GLU 20 -2.968 8.895 1.098
69 2HB GLU 20 2HB GLU 20 -3.694 7.424 1.741
70 1HG GLU 20 1HG GLU 20 -5.199 8.715 3.164
71 2HG GLU 20 2HG GLU 20 -4.339 10.211 2.788
72 HA PRO 21 HA PRO 21 -2.569 7.039 7.026
73 1HB PRO 21 1HB PRO 21 -3.463 8.999 8.738
74 2HB PRO 21 2HB PRO 21 -1.792 8.949 8.099
75 1HG PRO 21 1HG PRO 21 -4.153 10.534 7.026
76 2HG PRO 21 2HG PRO 21 -2.512 11.138 7.433
77 1HD PRO 21 1HD PRO 21 -3.175 10.465 4.887
78 2HD PRO 21 2HD PRO 21 -1.556 10.082 5.544
79 HA PRO 22 HA PRO 22 -6.871 5.906 7.477
80 1HB PRO 22 1HB PRO 22 -7.202 5.367 10.152
81 2HB PRO 22 2HB PRO 22 -6.266 4.324 9.037
82 1HG PRO 22 1HG PRO 22 -5.211 6.500 10.872
83 2HG PRO 22 2HG PRO 22 -4.651 4.805 10.713
84 1HD PRO 22 1HD PRO 22 -3.398 6.826 9.411
85 2HD PRO 22 2HD PRO 22 -3.638 5.248 8.607
86 H GLY 23 H GLY 23 -8.880 6.436 8.752
87 1HA GLY 23 1HA GLY 23 -10.533 8.057 9.142
88 2HA GLY 23 2HA GLY 23 -9.280 9.258 9.455
89 H ALA 24 H ALA 24 -8.251 8.106 6.673
90 HA ALA 24 HA ALA 24 -10.177 9.310 4.777
91 1HB ALA 24 1HB ALA 24 -7.171 9.844 4.812
92 2HB ALA 24 2HB ALA 24 -8.295 10.336 3.527
93 3HB ALA 24 3HB ALA 24 -8.456 11.021 5.156
94 H HIS 25 H HIS 25 -10.815 7.114 4.563
95 HA HIS 25 HA HIS 25 -9.336 4.863 4.421
96 1HB HIS 25 1HB HIS 25 -11.952 5.460 2.972
97 2HB HIS 25 2HB HIS 25 -11.347 3.870 3.383
98 HD1 HIS 25 HD1 HIS 25 -10.878 3.656 6.282
99 HD2 HIS 25 HD2 HIS 25 -13.702 6.363 4.666
100 HE1 HIS 25 HE1 HIS 25 -12.484 4.277 8.201
101 HE2 HIS 25 HE2 HIS 25 -14.199 5.922 7.212
102 H GLY 26 H GLY 26 -10.046 6.824 1.694
103 1HA GLY 26 1HA GLY 26 -9.107 7.015 -0.448
104 2HA GLY 26 2HA GLY 26 -7.661 6.384 0.339
105 H GLU 27 H GLU 27 -6.933 5.271 -1.364
106 HA GLU 27 HA GLU 27 -8.265 2.697 -2.065
107 1HB GLU 27 1HB GLU 27 -8.793 4.358 -3.872
108 2HB GLU 27 2HB GLU 27 -7.062 4.625 -4.119
109 1HG GLU 27 1HG GLU 27 -6.774 2.263 -4.780
110 2HG GLU 27 2HG GLU 27 -8.470 1.933 -4.414
111 H CYS 28 H CYS 28 -7.235 1.291 -1.386
112 HA CYS 28 HA CYS 28 -4.538 1.131 -0.622
113 1HB CYS 28 1HB CYS 28 -6.668 -0.960 -1.176
114 2HB CYS 28 2HB CYS 28 -5.336 -1.108 -0.099
115 H TYR 29 H TYR 29 -3.522 -1.135 -1.258
116 HA TYR 29 HA TYR 29 -3.479 -1.736 -4.128
117 1HB TYR 29 1HB TYR 29 -0.976 -0.978 -2.545
118 2HB TYR 29 2HB TYR 29 -0.967 -1.564 -4.187
119 HD1 TYR 29 HD1 TYR 29 -1.271 1.300 -1.992
120 HD2 TYR 29 HD2 TYR 29 -1.837 -0.015 -6.069
121 HE1 TYR 29 HE1 TYR 29 -1.370 3.676 -2.762
122 HE2 TYR 29 HE2 TYR 29 -1.920 2.338 -6.818
123 HH TYR 29 HH TYR 29 -1.833 4.539 -6.202
124 HA PRO 30 HA PRO 30 -3.063 -5.818 -2.472
125 1HB PRO 30 1HB PRO 30 -0.928 -6.462 -4.435
126 2HB PRO 30 2HB PRO 30 -2.481 -7.295 -4.145
127 1HG PRO 30 1HG PRO 30 -2.105 -5.719 -6.356
128 2HG PRO 30 2HG PRO 30 -3.666 -5.709 -5.472
129 1HD PRO 30 1HD PRO 30 -1.377 -3.741 -5.257
130 2HD PRO 30 2HD PRO 30 -3.127 -3.416 -5.411
131 H GLN 31 H GLN 31 -1.836 -6.952 -1.047
132 HA GLN 31 HA GLN 31 0.781 -5.883 -0.165
133 1HB GLN 31 1HB GLN 31 -0.823 -8.347 0.699
134 2HB GLN 31 2HB GLN 31 0.683 -7.834 1.466
135 1HG GLN 31 1HG GLN 31 -0.291 -5.787 2.265
136 2HG GLN 31 2HG GLN 31 -1.768 -6.036 1.333
137 1HE2 GLN 31 2HE2 GLN 31 -0.002 -8.401 3.490
138 2HE2 GLN 31 1HE2 GLN 31 -1.408 -8.603 4.528
139 H ASP 32 H ASP 32 -0.092 -7.820 -2.675
140 HA ASP 32 HA ASP 32 2.370 -9.286 -3.019
141 1HB ASP 32 1HB ASP 32 0.103 -9.387 -4.337
142 2HB ASP 32 2HB ASP 32 0.650 -7.957 -5.163
143 H TRP 33 H TRP 33 1.269 -6.106 -3.468
144 HA TRP 33 HA TRP 33 3.874 -4.992 -4.244
145 1HB TRP 33 1HB TRP 33 1.277 -3.496 -4.006
146 2HB TRP 33 2HB TRP 33 2.782 -2.949 -4.691
147 HD1 TRP 33 HD1 TRP 33 2.144 -6.260 -6.198
148 HE1 TRP 33 HE1 TRP 33 0.894 -6.102 -8.423
149 HE3 TRP 33 HE3 TRP 33 0.862 -1.302 -6.052
150 HZ2 TRP 33 HZ2 TRP 33 -0.619 -4.136 -9.881
151 HZ3 TRP 33 HZ3 TRP 33 -0.475 -0.309 -7.906
152 HH2 TRP 33 HH2 TRP 33 -1.272 -1.722 -9.778
153 H LEU 34 H LEU 34 3.699 -6.133 -1.948
154 HA LEU 34 HA LEU 34 4.801 -3.953 -0.257
155 1HB LEU 34 1HB LEU 34 2.546 -4.754 0.660
156 2HB LEU 34 2HB LEU 34 3.270 -6.333 0.875
157 HG LEU 34 HG LEU 34 5.036 -5.200 2.357
158 1HD1 LEU 34 1HD1 LEU 34 2.963 -2.972 2.394
159 2HD1 LEU 34 2HD1 LEU 34 4.446 -3.066 3.369
160 3HD1 LEU 34 3HD1 LEU 34 4.549 -2.852 1.616
161 1HD2 LEU 34 1HD2 LEU 34 2.103 -5.117 3.213
162 2HD2 LEU 34 2HD2 LEU 34 3.166 -6.543 3.264
163 3HD2 LEU 34 3HD2 LEU 34 3.502 -5.152 4.309
164 H CYS 35 H CYS 35 6.902 -4.284 -0.505
165 HA CYS 35 HA CYS 35 8.855 -5.069 -1.098
166 1HB CYS 35 1HB CYS 35 8.901 -5.724 1.013
167 2HB CYS 35 2HB CYS 35 8.034 -7.216 0.787
168 H ASP 36 H ASP 36 7.750 -5.067 -3.186
169 HA ASP 36 HA ASP 36 7.365 -7.715 -4.530
170 1HB ASP 36 1HB ASP 36 5.820 -5.800 -5.017
171 2HB ASP 36 2HB ASP 36 7.186 -4.899 -5.660
172 H GLY 37 H GLY 37 9.807 -5.443 -3.796
173 1HA GLY 37 1HA GLY 37 12.129 -5.567 -4.333
174 2HA GLY 37 2HA GLY 37 11.748 -6.586 -5.735
175 H HIS 38 H HIS 38 9.637 -4.169 -5.511
176 HA HIS 38 HA HIS 38 10.877 -2.136 -7.232
177 1HB HIS 38 1HB HIS 38 10.085 -3.696 -8.835
178 2HB HIS 38 2HB HIS 38 8.648 -4.066 -7.923
179 HD1 HIS 38 HD1 HIS 38 9.888 -1.125 -10.155
180 HD2 HIS 38 HD2 HIS 38 6.539 -2.614 -8.068
181 HE1 HIS 38 HE1 HIS 38 7.905 0.441 -10.707
182 HE2 HIS 38 HE2 HIS 38 5.845 -0.516 -9.468
183 HA PRO 39 HA PRO 39 8.149 -0.031 -4.257
184 1HB PRO 39 1HB PRO 39 8.516 2.565 -5.197
185 2HB PRO 39 2HB PRO 39 9.397 1.728 -3.917
186 1HG PRO 39 1HG PRO 39 10.380 2.447 -6.597
187 2HG PRO 39 2HG PRO 39 11.297 1.744 -5.234
188 1HD PRO 39 1HD PRO 39 10.198 0.418 -7.614
189 2HD PRO 39 2HD PRO 39 11.331 -0.236 -6.409
190 H ASP 40 H ASP 40 6.110 0.923 -4.312
191 HA ASP 40 HA ASP 40 5.115 2.096 -6.845
192 1HB ASP 40 1HB ASP 40 4.609 -0.620 -6.459
193 2HB ASP 40 2HB ASP 40 3.146 0.123 -5.838
194 H CYS 41 H CYS 41 5.515 2.432 -3.673
195 HA CYS 41 HA CYS 41 2.840 2.836 -2.851
196 1HB CYS 41 1HB CYS 41 5.270 2.606 -1.551
197 2HB CYS 41 2HB CYS 41 4.524 4.065 -0.939
198 H ASP 42 H ASP 42 3.730 4.619 -4.876
199 HA ASP 42 HA ASP 42 4.363 6.661 -5.564
200 1HB ASP 42 1HB ASP 42 1.867 6.962 -5.242
201 2HB ASP 42 2HB ASP 42 2.212 7.749 -3.704
202 H ASP 43 H ASP 43 5.014 5.938 -2.537
203 HA ASP 43 HA ASP 43 7.263 7.823 -2.464
204 1HB ASP 43 1HB ASP 43 5.408 8.022 -0.650
205 2HB ASP 43 2HB ASP 43 6.151 6.574 -0.002
206 H GLY 44 H GLY 44 6.400 4.819 -3.061
207 1HA GLY 44 1HA GLY 44 7.580 2.726 -3.142
208 2HA GLY 44 2HA GLY 44 9.055 3.611 -2.813
209 H ARG 45 H ARG 45 6.460 3.702 -0.622
210 HA ARG 45 HA ARG 45 8.227 2.612 1.525
211 1HB ARG 45 1HB ARG 45 6.832 3.566 3.187
212 2HB ARG 45 2HB ARG 45 7.225 4.809 2.008
213 1HG ARG 45 1HG ARG 45 4.978 4.673 1.042
214 2HG ARG 45 2HG ARG 45 4.588 3.284 2.073
215 1HD ARG 45 1HD ARG 45 3.556 5.232 2.993
216 2HD ARG 45 2HD ARG 45 4.855 4.714 4.079
217 HE ARG 45 HE ARG 45 5.834 6.715 2.242
218 1HH1 ARG 45 2HH1 ARG 45 3.697 6.570 5.009
219 2HH1 ARG 45 1HH1 ARG 45 4.022 8.233 5.437
220 1HH2 ARG 45 1HH2 ARG 45 6.239 8.711 2.833
221 2HH2 ARG 45 2HH2 ARG 45 5.432 9.449 4.215
222 H ASP 46 H ASP 46 6.479 1.191 -0.688
223 HA ASP 46 HA ASP 46 5.226 -0.767 0.995
224 1HB ASP 46 1HB ASP 46 4.931 -1.942 -1.139
225 2HB ASP 46 2HB ASP 46 4.142 -0.373 -1.159
226 H GLU 47 H GLU 47 8.146 -0.021 -0.726
227 HA GLU 47 HA GLU 47 9.246 -2.681 -0.524
228 1HB GLU 47 1HB GLU 47 10.407 0.047 -1.151
229 2HB GLU 47 2HB GLU 47 11.405 -1.388 -1.140
230 1HG GLU 47 1HG GLU 47 8.848 -1.349 -2.756
231 2HG GLU 47 2HG GLU 47 10.301 -0.575 -3.348
232 H TRP 48 H TRP 48 9.295 0.162 1.354
233 HA TRP 48 HA TRP 48 11.748 -0.026 2.628
234 1HB TRP 48 1HB TRP 48 9.283 1.331 3.721
235 2HB TRP 48 2HB TRP 48 10.925 1.550 4.300
236 HD1 TRP 48 HD1 TRP 48 11.219 1.602 0.630
237 HE1 TRP 48 HE1 TRP 48 10.852 3.909 -0.347
238 HE3 TRP 48 HE3 TRP 48 9.600 3.876 4.824
239 HZ2 TRP 48 HZ2 TRP 48 10.100 6.605 0.681
240 HZ3 TRP 48 HZ3 TRP 48 9.086 6.360 4.863
241 HH2 TRP 48 HH2 TRP 48 9.353 7.697 2.788
242 H GLY 49 H GLY 49 12.444 -1.450 3.658
243 1HA GLY 49 1HA GLY 49 13.034 -2.798 5.525
244 2HA GLY 49 2HA GLY 49 11.560 -2.242 6.327
245 H CYS 50 H CYS 50 10.685 -3.502 3.272
246 HA CYS 50 HA CYS 50 9.165 -5.073 2.855
247 1HB CYS 50 1HB CYS 50 11.408 -5.603 2.114
248 2HB CYS 50 2HB CYS 50 11.764 -6.387 3.624
249 H GLY 51 H GLY 51 8.775 -4.345 5.546
250 1HA GLY 51 1HA GLY 51 6.761 -6.101 6.458
251 2HA GLY 51 2HA GLY 51 8.235 -6.603 7.284
Start of MODEL 4
1 H SER 10 H SER 10 -6.549 -0.378 4.992
2 HA SER 10 HA SER 10 -7.377 -2.751 6.451
3 1HB SER 10 1HB SER 10 -9.011 -1.553 7.873
4 2HB SER 10 2HB SER 10 -7.332 -1.300 8.355
5 HG SER 10 HG SER 10 -8.683 0.609 8.347
6 H CYS 11 H CYS 11 -8.094 -3.537 4.633
7 HA CYS 11 HA CYS 11 -10.127 -2.223 2.974
8 1HB CYS 11 1HB CYS 11 -7.383 -1.950 2.573
9 2HB CYS 11 2HB CYS 11 -7.718 -3.365 1.616
10 HA PRO 12 HA PRO 12 -10.965 -6.654 2.376
11 1HB PRO 12 1HB PRO 12 -9.682 -7.073 -0.315
12 2HB PRO 12 2HB PRO 12 -11.374 -7.404 0.163
13 1HG PRO 12 1HG PRO 12 -10.736 -5.282 -1.435
14 2HG PRO 12 2HG PRO 12 -12.013 -5.159 -0.179
15 1HD PRO 12 1HD PRO 12 -9.118 -4.289 0.002
16 2HD PRO 12 2HD PRO 12 -10.588 -3.372 0.442
17 HA PRO 13 HA PRO 13 -7.208 -8.664 3.581
18 1HB PRO 13 1HB PRO 13 -7.444 -11.323 2.977
19 2HB PRO 13 2HB PRO 13 -8.436 -10.530 4.244
20 1HG PRO 13 1HG PRO 13 -9.173 -11.055 1.356
21 2HG PRO 13 2HG PRO 13 -10.133 -11.448 2.822
22 1HD PRO 13 1HD PRO 13 -10.594 -9.201 1.369
23 2HD PRO 13 2HD PRO 13 -10.707 -9.163 3.156
24 H GLY 14 H GLY 14 -5.290 -9.166 2.968
25 1HA GLY 14 1HA GLY 14 -3.413 -9.157 1.659
26 2HA GLY 14 2HA GLY 14 -4.357 -9.770 0.308
27 H GLN 15 H GLN 15 -5.314 -6.637 1.763
28 HA GLN 15 HA GLN 15 -3.935 -5.114 -0.318
29 1HB GLN 15 1HB GLN 15 -6.883 -5.377 0.001
30 2HB GLN 15 2HB GLN 15 -6.237 -3.767 -0.339
31 1HG GLN 15 1HG GLN 15 -5.303 -4.378 -2.391
32 2HG GLN 15 2HG GLN 15 -5.263 -6.098 -1.993
33 1HE2 GLN 15 1HE2 GLN 15 -7.325 -7.262 -1.792
34 2HE2 GLN 15 2HE2 GLN 15 -8.565 -6.777 -2.944
35 H PHE 16 H PHE 16 -2.991 -3.475 0.535
36 HA PHE 16 HA PHE 16 -3.877 -2.267 3.167
37 1HB PHE 16 1HB PHE 16 -1.683 -2.105 3.947
38 2HB PHE 16 2HB PHE 16 -1.742 -3.705 3.244
39 HD1 PHE 16 HD1 PHE 16 -0.011 -0.545 3.291
40 HD2 PHE 16 HD2 PHE 16 -0.874 -3.920 0.795
41 HE1 PHE 16 HE1 PHE 16 1.761 0.173 1.720
42 HE2 PHE 16 HE2 PHE 16 0.960 -3.279 -0.731
43 HZ PHE 16 HZ PHE 16 2.252 -1.251 -0.335
44 H ARG 17 H ARG 17 -3.185 0.049 3.505
45 HA ARG 17 HA ARG 17 -3.031 1.552 0.918
46 1HB ARG 17 1HB ARG 17 -3.815 3.491 2.002
47 2HB ARG 17 2HB ARG 17 -4.912 2.132 2.338
48 1HG ARG 17 1HG ARG 17 -3.893 1.925 4.626
49 2HG ARG 17 2HG ARG 17 -2.849 3.307 4.263
50 1HD ARG 17 1HD ARG 17 -4.708 4.127 5.552
51 2HD ARG 17 2HD ARG 17 -4.859 4.727 3.906
52 HE ARG 17 HE ARG 17 -6.793 3.487 3.575
53 1HH1 ARG 17 2HH1 ARG 17 -5.407 2.403 6.628
54 2HH1 ARG 17 1HH1 ARG 17 -6.846 1.454 6.974
55 1HH2 ARG 17 2HH2 ARG 17 -8.465 2.164 4.085
56 2HH2 ARG 17 1HH2 ARG 17 -8.451 1.290 5.604
57 H CYS 18 H CYS 18 -1.666 3.132 0.514
58 HA CYS 18 HA CYS 18 1.035 2.771 1.638
59 1HB CYS 18 1HB CYS 18 -0.167 3.930 -0.869
60 2HB CYS 18 2HB CYS 18 1.480 4.347 -0.409
61 H SER 19 H SER 19 0.064 5.683 0.258
62 HA SER 19 HA SER 19 1.491 7.162 2.389
63 1HB SER 19 1HB SER 19 2.135 8.711 0.481
64 2HB SER 19 2HB SER 19 2.704 7.045 0.342
65 HG SER 19 HG SER 19 1.738 6.982 -1.484
66 H GLU 20 H GLU 20 -1.143 6.746 2.553
67 HA GLU 20 HA GLU 20 -2.074 9.481 3.269
68 1HB GLU 20 1HB GLU 20 -3.074 8.855 1.058
69 2HB GLU 20 2HB GLU 20 -3.835 7.477 1.824
70 1HG GLU 20 1HG GLU 20 -5.553 9.040 1.808
71 2HG GLU 20 2HG GLU 20 -4.927 9.236 3.440
72 HA PRO 21 HA PRO 21 -2.486 6.816 6.900
73 1HB PRO 21 1HB PRO 21 -3.098 8.690 8.814
74 2HB PRO 21 2HB PRO 21 -1.480 8.552 8.063
75 1HG PRO 21 1HG PRO 21 -3.747 10.415 7.272
76 2HG PRO 21 2HG PRO 21 -2.036 10.842 7.612
77 1HD PRO 21 1HD PRO 21 -2.922 10.435 5.079
78 2HD PRO 21 2HD PRO 21 -1.299 9.875 5.580
79 HA PRO 22 HA PRO 22 -6.755 5.779 7.661
80 1HB PRO 22 1HB PRO 22 -6.215 6.157 10.612
81 2HB PRO 22 2HB PRO 22 -7.066 4.811 9.785
82 1HG PRO 22 1HG PRO 22 -4.530 4.506 10.559
83 2HG PRO 22 2HG PRO 22 -5.014 3.950 8.922
84 1HD PRO 22 1HD PRO 22 -3.588 6.515 9.690
85 2HD PRO 22 2HD PRO 22 -3.229 5.381 8.352
86 H GLY 23 H GLY 23 -8.735 6.398 8.749
87 1HA GLY 23 1HA GLY 23 -10.482 7.937 9.049
88 2HA GLY 23 2HA GLY 23 -9.300 9.199 9.388
89 H ALA 24 H ALA 24 -7.915 8.554 6.778
90 HA ALA 24 HA ALA 24 -9.887 9.458 4.731
91 1HB ALA 24 1HB ALA 24 -7.958 10.459 3.542
92 2HB ALA 24 2HB ALA 24 -8.199 11.189 5.141
93 3HB ALA 24 3HB ALA 24 -6.892 10.012 4.892
94 H HIS 25 H HIS 25 -10.412 7.149 4.845
95 HA HIS 25 HA HIS 25 -8.802 4.996 4.708
96 1HB HIS 25 1HB HIS 25 -11.587 5.366 3.525
97 2HB HIS 25 2HB HIS 25 -10.841 3.822 3.867
98 HD1 HIS 25 HD1 HIS 25 -10.050 3.612 6.671
99 HD2 HIS 25 HD2 HIS 25 -13.167 6.196 5.429
100 HE1 HIS 25 HE1 HIS 25 -11.457 4.133 8.768
101 HE2 HIS 25 HE2 HIS 25 -13.346 5.708 8.006
102 H GLY 26 H GLY 26 -9.829 6.746 1.941
103 1HA GLY 26 1HA GLY 26 -8.972 6.928 -0.224
104 2HA GLY 26 2HA GLY 26 -7.497 6.252 0.470
105 H GLU 27 H GLU 27 -7.017 5.247 -1.429
106 HA GLU 27 HA GLU 27 -8.422 2.679 -2.003
107 1HB GLU 27 1HB GLU 27 -9.041 4.364 -3.748
108 2HB GLU 27 2HB GLU 27 -7.321 4.598 -4.113
109 1HG GLU 27 1HG GLU 27 -7.131 2.235 -4.806
110 2HG GLU 27 2HG GLU 27 -8.801 1.939 -4.310
111 H CYS 28 H CYS 28 -7.381 1.254 -1.441
112 HA CYS 28 HA CYS 28 -4.712 1.084 -0.647
113 1HB CYS 28 1HB CYS 28 -6.743 -1.079 -1.290
114 2HB CYS 28 2HB CYS 28 -5.534 -1.112 -0.056
115 H TYR 29 H TYR 29 -3.617 -1.158 -1.254
116 HA TYR 29 HA TYR 29 -3.538 -1.772 -4.122
117 1HB TYR 29 1HB TYR 29 -1.068 -0.956 -2.514
118 2HB TYR 29 2HB TYR 29 -1.024 -1.572 -4.146
119 HD1 TYR 29 HD1 TYR 29 -1.445 1.334 -2.012
120 HD2 TYR 29 HD2 TYR 29 -1.868 -0.086 -6.072
121 HE1 TYR 29 HE1 TYR 29 -1.573 3.688 -2.841
122 HE2 TYR 29 HE2 TYR 29 -1.980 2.247 -6.877
123 HH TYR 29 HH TYR 29 -1.953 4.461 -6.313
124 HA PRO 30 HA PRO 30 -3.080 -5.844 -2.453
125 1HB PRO 30 1HB PRO 30 -0.948 -6.469 -4.426
126 2HB PRO 30 2HB PRO 30 -2.492 -7.314 -4.128
127 1HG PRO 30 1HG PRO 30 -2.142 -5.739 -6.344
128 2HG PRO 30 2HG PRO 30 -3.697 -5.739 -5.450
129 1HD PRO 30 1HD PRO 30 -1.421 -3.755 -5.246
130 2HD PRO 30 2HD PRO 30 -3.172 -3.441 -5.400
131 H GLN 31 H GLN 31 -1.820 -6.965 -1.033
132 HA GLN 31 HA GLN 31 0.775 -5.858 -0.150
133 1HB GLN 31 1HB GLN 31 -0.784 -8.355 0.692
134 2HB GLN 31 2HB GLN 31 0.704 -7.814 1.470
135 1HG GLN 31 1HG GLN 31 -0.317 -5.799 2.286
136 2HG GLN 31 2HG GLN 31 -1.781 -6.063 1.337
137 1HE2 GLN 31 1HE2 GLN 31 -0.009 -8.454 3.459
138 2HE2 GLN 31 2HE2 GLN 31 -1.419 -8.683 4.488
139 H ASP 32 H ASP 32 -0.077 -7.804 -2.663
140 HA ASP 32 HA ASP 32 2.388 -9.261 -3.009
141 1HB ASP 32 1HB ASP 32 0.122 -9.359 -4.329
142 2HB ASP 32 2HB ASP 32 0.670 -7.929 -5.152
143 H TRP 33 H TRP 33 1.284 -6.083 -3.446
144 HA TRP 33 HA TRP 33 3.891 -4.963 -4.205
145 1HB TRP 33 1HB TRP 33 1.294 -3.470 -3.983
146 2HB TRP 33 2HB TRP 33 2.800 -2.927 -4.669
147 HD1 TRP 33 HD1 TRP 33 2.160 -6.241 -6.171
148 HE1 TRP 33 HE1 TRP 33 0.894 -6.093 -8.386
149 HE3 TRP 33 HE3 TRP 33 0.882 -1.279 -6.041
150 HZ2 TRP 33 HZ2 TRP 33 -0.635 -4.137 -9.838
151 HZ3 TRP 33 HZ3 TRP 33 -0.467 -0.297 -7.890
152 HH2 TRP 33 HH2 TRP 33 -1.286 -1.722 -9.744
153 H LEU 34 H LEU 34 3.711 -6.106 -1.916
154 HA LEU 34 HA LEU 34 4.791 -3.921 -0.216
155 1HB LEU 34 1HB LEU 34 2.532 -4.722 0.685
156 2HB LEU 34 2HB LEU 34 3.257 -6.301 0.911
157 HG LEU 34 HG LEU 34 5.010 -5.159 2.402
158 1HD1 LEU 34 1HD1 LEU 34 2.933 -2.934 2.406
159 2HD1 LEU 34 2HD1 LEU 34 4.401 -3.023 3.405
160 3HD1 LEU 34 3HD1 LEU 34 4.531 -2.816 1.652
161 1HD2 LEU 34 1HD2 LEU 34 2.073 -5.074 3.243
162 2HD2 LEU 34 2HD2 LEU 34 3.135 -6.502 3.298
163 3HD2 LEU 34 3HD2 LEU 34 3.471 -5.113 4.342
164 H CYS 35 H CYS 35 6.900 -4.249 -0.432
165 HA CYS 35 HA CYS 35 8.851 -5.025 -1.029
166 1HB CYS 35 1HB CYS 35 8.914 -5.659 1.092
167 2HB CYS 35 2HB CYS 35 8.050 -7.158 0.882
168 H ASP 36 H ASP 36 7.761 -5.046 -3.116
169 HA ASP 36 HA ASP 36 7.397 -7.707 -4.442
170 1HB ASP 36 1HB ASP 36 5.848 -5.800 -4.954
171 2HB ASP 36 2HB ASP 36 7.214 -4.902 -5.598
172 H GLY 37 H GLY 37 9.822 -5.414 -3.714
173 1HA GLY 37 1HA GLY 37 12.149 -5.531 -4.238
174 2HA GLY 37 2HA GLY 37 11.779 -6.563 -5.634
175 H HIS 38 H HIS 38 9.657 -4.156 -5.437
176 HA HIS 38 HA HIS 38 10.894 -2.134 -7.179
177 1HB HIS 38 1HB HIS 38 10.104 -3.718 -8.761
178 2HB HIS 38 2HB HIS 38 8.659 -4.064 -7.848
179 HD1 HIS 38 HD1 HIS 38 9.939 -1.160 -10.107
180 HD2 HIS 38 HD2 HIS 38 6.559 -2.599 -8.033
181 HE1 HIS 38 HE1 HIS 38 7.971 0.413 -10.698
182 HE2 HIS 38 HE2 HIS 38 5.895 -0.508 -9.459
183 HA PRO 39 HA PRO 39 8.143 -0.025 -4.212
184 1HB PRO 39 1HB PRO 39 8.588 2.569 -5.180
185 2HB PRO 39 2HB PRO 39 9.341 1.745 -3.811
186 1HG PRO 39 1HG PRO 39 10.648 2.446 -6.309
187 2HG PRO 39 2HG PRO 39 11.332 1.534 -4.932
188 1HD PRO 39 1HD PRO 39 10.215 0.518 -7.493
189 2HD PRO 39 2HD PRO 39 11.363 -0.263 -6.380
190 H ASP 40 H ASP 40 6.120 0.956 -4.306
191 HA ASP 40 HA ASP 40 5.158 2.097 -6.870
192 1HB ASP 40 1HB ASP 40 4.678 -0.609 -6.474
193 2HB ASP 40 2HB ASP 40 3.210 0.109 -5.837
194 H CYS 41 H CYS 41 5.497 2.458 -3.679
195 HA CYS 41 HA CYS 41 2.805 2.856 -2.927
196 1HB CYS 41 1HB CYS 41 5.207 2.665 -1.560
197 2HB CYS 41 2HB CYS 41 4.397 4.096 -0.960
198 H ASP 42 H ASP 42 3.741 4.639 -4.934
199 HA ASP 42 HA ASP 42 4.396 6.677 -5.615
200 1HB ASP 42 1HB ASP 42 1.897 6.991 -5.373
201 2HB ASP 42 2HB ASP 42 2.196 7.784 -3.827
202 H ASP 43 H ASP 43 4.941 5.966 -2.568
203 HA ASP 43 HA ASP 43 7.148 7.891 -2.331
204 1HB ASP 43 1HB ASP 43 5.209 7.970 -0.619
205 2HB ASP 43 2HB ASP 43 5.891 6.468 -0.031
206 H GLY 44 H GLY 44 6.359 4.865 -3.055
207 1HA GLY 44 1HA GLY 44 7.550 2.785 -3.130
208 2HA GLY 44 2HA GLY 44 9.013 3.674 -2.772
209 H ARG 45 H ARG 45 6.382 3.726 -0.613
210 HA ARG 45 HA ARG 45 8.151 2.664 1.550
211 1HB ARG 45 1HB ARG 45 6.740 3.598 3.193
212 2HB ARG 45 2HB ARG 45 7.059 4.851 2.002
213 1HG ARG 45 1HG ARG 45 4.808 4.601 1.068
214 2HG ARG 45 2HG ARG 45 4.509 3.184 2.085
215 1HD ARG 45 1HD ARG 45 3.368 5.005 3.062
216 2HD ARG 45 2HD ARG 45 4.740 4.624 4.108
217 HE ARG 45 HE ARG 45 5.634 6.678 2.380
218 1HH1 ARG 45 2HH2 ARG 45 3.116 6.441 4.804
219 2HH1 ARG 45 1HH2 ARG 45 3.256 8.138 5.200
220 1HH2 ARG 45 1HH1 ARG 45 5.774 8.686 2.895
221 2HH2 ARG 45 2HH1 ARG 45 4.738 9.419 4.119
222 H ASP 46 H ASP 46 6.421 1.222 -0.683
223 HA ASP 46 HA ASP 46 5.173 -0.749 0.988
224 1HB ASP 46 1HB ASP 46 4.935 -1.931 -1.158
225 2HB ASP 46 2HB ASP 46 4.099 -0.385 -1.168
226 H GLU 47 H GLU 47 8.111 0.028 -0.699
227 HA GLU 47 HA GLU 47 9.221 -2.628 -0.473
228 1HB GLU 47 1HB GLU 47 10.373 0.102 -1.107
229 2HB GLU 47 2HB GLU 47 11.381 -1.328 -1.071
230 1HG GLU 47 1HG GLU 47 8.838 -1.323 -2.710
231 2HG GLU 47 2HG GLU 47 10.291 -0.541 -3.294
232 H TRP 48 H TRP 48 9.232 0.219 1.399
233 HA TRP 48 HA TRP 48 11.698 0.075 2.640
234 1HB TRP 48 1HB TRP 48 9.224 1.390 3.764
235 2HB TRP 48 2HB TRP 48 10.867 1.633 4.331
236 HD1 TRP 48 HD1 TRP 48 11.134 1.697 0.659
237 HE1 TRP 48 HE1 TRP 48 10.731 4.004 -0.307
238 HE3 TRP 48 HE3 TRP 48 9.525 3.933 4.875
239 HZ2 TRP 48 HZ2 TRP 48 9.945 6.687 0.740
240 HZ3 TRP 48 HZ3 TRP 48 8.981 6.411 4.931
241 HH2 TRP 48 HH2 TRP 48 9.207 7.759 2.856
242 H GLY 49 H GLY 49 12.448 -1.327 3.644
243 1HA GLY 49 1HA GLY 49 13.116 -2.668 5.482
244 2HA GLY 49 2HA GLY 49 11.659 -2.141 6.331
245 H CYS 50 H CYS 50 10.702 -3.422 3.312
246 HA CYS 50 HA CYS 50 9.182 -5.027 2.951
247 1HB CYS 50 1HB CYS 50 11.422 -5.526 2.155
248 2HB CYS 50 2HB CYS 50 11.822 -6.296 3.660
249 H GLY 51 H GLY 51 8.908 -4.279 5.670
250 1HA GLY 51 1HA GLY 51 8.563 -6.510 7.482
251 2HA GLY 51 2HA GLY 51 7.948 -4.877 7.721
Start of MODEL 5
1 H SER 10 H SER 10 -6.652 -0.630 5.378
2 HA SER 10 HA SER 10 -8.375 -2.635 6.609
3 1HB SER 10 1HB SER 10 -10.036 -0.955 7.446
4 2HB SER 10 2HB SER 10 -8.524 -1.016 8.371
5 HG SER 10 HG SER 10 -9.242 1.122 7.943
6 H CYS 11 H CYS 11 -8.532 -3.457 4.685
7 HA CYS 11 HA CYS 11 -10.250 -2.291 2.654
8 1HB CYS 11 1HB CYS 11 -7.502 -1.840 2.681
9 2HB CYS 11 2HB CYS 11 -7.591 -3.306 1.747
10 HA PRO 12 HA PRO 12 -10.952 -6.662 2.159
11 1HB PRO 12 1HB PRO 12 -9.675 -7.070 -0.533
12 2HB PRO 12 2HB PRO 12 -11.363 -7.394 -0.047
13 1HG PRO 12 1HG PRO 12 -10.713 -5.249 -1.620
14 2HG PRO 12 2HG PRO 12 -11.983 -5.132 -0.358
15 1HD PRO 12 1HD PRO 12 -9.081 -4.279 -0.179
16 2HD PRO 12 2HD PRO 12 -10.543 -3.367 0.289
17 HA PRO 13 HA PRO 13 -7.292 -8.861 3.391
18 1HB PRO 13 1HB PRO 13 -8.313 -11.230 1.771
19 2HB PRO 13 2HB PRO 13 -7.637 -11.225 3.435
20 1HG PRO 13 1HG PRO 13 -10.309 -11.315 3.101
21 2HG PRO 13 2HG PRO 13 -9.601 -10.179 4.304
22 1HD PRO 13 1HD PRO 13 -10.566 -9.562 1.492
23 2HD PRO 13 2HD PRO 13 -10.868 -8.673 3.020
24 H GLY 14 H GLY 14 -5.362 -9.170 2.884
25 1HA GLY 14 1HA GLY 14 -3.390 -9.068 1.719
26 2HA GLY 14 2HA GLY 14 -4.200 -9.764 0.322
27 H GLN 15 H GLN 15 -5.348 -6.649 1.664
28 HA GLN 15 HA GLN 15 -3.906 -5.124 -0.384
29 1HB GLN 15 1HB GLN 15 -6.862 -5.334 -0.122
30 2HB GLN 15 2HB GLN 15 -6.172 -3.754 -0.493
31 1HG GLN 15 1HG GLN 15 -5.246 -4.436 -2.518
32 2HG GLN 15 2HG GLN 15 -5.194 -6.140 -2.060
33 1HE2 GLN 15 1HE2 GLN 15 -7.262 -7.311 -1.826
34 2HE2 GLN 15 2HE2 GLN 15 -8.480 -6.887 -3.025
35 H PHE 16 H PHE 16 -2.991 -3.478 0.414
36 HA PHE 16 HA PHE 16 -3.886 -2.184 3.002
37 1HB PHE 16 1HB PHE 16 -1.706 -2.002 3.806
38 2HB PHE 16 2HB PHE 16 -1.741 -3.619 3.138
39 HD1 PHE 16 HD1 PHE 16 -0.036 -0.440 3.132
40 HD2 PHE 16 HD2 PHE 16 -0.857 -3.869 0.695
41 HE1 PHE 16 HE1 PHE 16 1.754 0.247 1.572
42 HE2 PHE 16 HE2 PHE 16 1.002 -3.262 -0.813
43 HZ PHE 16 HZ PHE 16 2.278 -1.220 -0.449
44 H ARG 17 H ARG 17 -3.114 0.135 3.273
45 HA ARG 17 HA ARG 17 -3.017 1.571 0.653
46 1HB ARG 17 1HB ARG 17 -3.880 3.508 1.731
47 2HB ARG 17 2HB ARG 17 -4.948 2.108 1.992
48 1HG ARG 17 1HG ARG 17 -4.064 1.876 4.313
49 2HG ARG 17 2HG ARG 17 -3.009 3.269 4.041
50 1HD ARG 17 1HD ARG 17 -4.926 4.046 5.261
51 2HD ARG 17 2HD ARG 17 -5.008 4.693 3.629
52 HE ARG 17 HE ARG 17 -6.982 3.530 3.248
53 1HH1 ARG 17 2HH1 ARG 17 -5.653 2.184 6.220
54 2HH1 ARG 17 1HH1 ARG 17 -7.189 1.382 6.537
55 1HH2 ARG 17 2HH2 ARG 17 -8.722 2.423 3.696
56 2HH2 ARG 17 1HH2 ARG 17 -8.786 1.363 5.097
57 H CYS 18 H CYS 18 -1.683 3.165 0.240
58 HA CYS 18 HA CYS 18 1.004 2.890 1.426
59 1HB CYS 18 1HB CYS 18 -0.150 3.919 -1.154
60 2HB CYS 18 2HB CYS 18 1.478 4.381 -0.674
61 H SER 19 H SER 19 -0.048 5.731 -0.083
62 HA SER 19 HA SER 19 1.498 7.291 1.857
63 1HB SER 19 1HB SER 19 1.719 8.937 -0.031
64 2HB SER 19 2HB SER 19 2.241 7.303 -0.456
65 HG SER 19 HG SER 19 0.878 8.226 -2.066
66 H GLU 20 H GLU 20 -1.157 6.709 2.305
67 HA GLU 20 HA GLU 20 -2.096 9.341 3.320
68 1HB GLU 20 1HB GLU 20 -3.171 9.035 1.177
69 2HB GLU 20 2HB GLU 20 -3.844 7.489 1.675
70 1HG GLU 20 1HG GLU 20 -5.245 8.572 3.357
71 2HG GLU 20 2HG GLU 20 -4.404 10.108 3.134
72 HA PRO 21 HA PRO 21 -2.379 6.413 6.753
73 1HB PRO 21 1HB PRO 21 -2.768 8.175 8.815
74 2HB PRO 21 2HB PRO 21 -1.218 8.058 7.931
75 1HG PRO 21 1HG PRO 21 -3.493 10.022 7.466
76 2HG PRO 21 2HG PRO 21 -1.746 10.382 7.677
77 1HD PRO 21 1HD PRO 21 -2.898 10.155 5.207
78 2HD PRO 21 2HD PRO 21 -1.226 9.598 5.519
79 HA PRO 22 HA PRO 22 -6.664 5.632 7.831
80 1HB PRO 22 1HB PRO 22 -5.814 5.841 10.727
81 2HB PRO 22 2HB PRO 22 -6.867 4.614 9.950
82 1HG PRO 22 1HG PRO 22 -4.311 4.040 10.455
83 2HG PRO 22 2HG PRO 22 -5.001 3.605 8.855
84 1HD PRO 22 1HD PRO 22 -3.270 5.993 9.567
85 2HD PRO 22 2HD PRO 22 -3.144 4.890 8.162
86 H GLY 23 H GLY 23 -8.468 6.407 9.172
87 1HA GLY 23 1HA GLY 23 -9.998 8.136 9.638
88 2HA GLY 23 2HA GLY 23 -8.646 9.243 9.875
89 H ALA 24 H ALA 24 -7.869 8.129 7.015
90 HA ALA 24 HA ALA 24 -9.839 9.504 5.284
91 1HB ALA 24 1HB ALA 24 -7.979 11.069 5.581
92 2HB ALA 24 2HB ALA 24 -6.809 9.810 5.131
93 3HB ALA 24 3HB ALA 24 -7.974 10.416 3.931
94 H HIS 25 H HIS 25 -10.654 7.366 5.096
95 HA HIS 25 HA HIS 25 -9.362 5.018 4.868
96 1HB HIS 25 1HB HIS 25 -12.013 5.791 3.576
97 2HB HIS 25 2HB HIS 25 -11.503 4.167 3.984
98 HD1 HIS 25 HD1 HIS 25 -10.871 3.968 6.852
99 HD2 HIS 25 HD2 HIS 25 -13.580 6.857 5.356
100 HE1 HIS 25 HE1 HIS 25 -12.295 4.749 8.853
101 HE2 HIS 25 HE2 HIS 25 -13.940 6.505 7.937
102 H GLY 26 H GLY 26 -10.108 7.009 2.172
103 1HA GLY 26 1HA GLY 26 -9.352 7.079 -0.061
104 2HA GLY 26 2HA GLY 26 -7.877 6.423 0.642
105 H GLU 27 H GLU 27 -7.218 5.028 -0.849
106 HA GLU 27 HA GLU 27 -8.584 2.523 -1.201
107 1HB GLU 27 1HB GLU 27 -8.416 2.465 -3.627
108 2HB GLU 27 2HB GLU 27 -9.455 3.799 -3.144
109 1HG GLU 27 1HG GLU 27 -7.537 5.386 -3.485
110 2HG GLU 27 2HG GLU 27 -6.542 4.033 -4.027
111 H CYS 28 H CYS 28 -7.253 1.061 -2.233
112 HA CYS 28 HA CYS 28 -4.661 1.037 -0.877
113 1HB CYS 28 1HB CYS 28 -6.724 -1.096 -1.504
114 2HB CYS 28 2HB CYS 28 -5.460 -1.215 -0.343
115 H TYR 29 H TYR 29 -3.587 -1.213 -1.455
116 HA TYR 29 HA TYR 29 -3.460 -1.866 -4.305
117 1HB TYR 29 1HB TYR 29 -1.013 -1.002 -2.684
118 2HB TYR 29 2HB TYR 29 -0.937 -1.674 -4.293
119 HD1 TYR 29 HD1 TYR 29 -1.748 -0.261 -6.286
120 HD2 TYR 29 HD2 TYR 29 -1.400 1.307 -2.273
121 HE1 TYR 29 HE1 TYR 29 -1.847 2.051 -7.174
122 HE2 TYR 29 HE2 TYR 29 -1.511 3.623 -3.179
123 HH TYR 29 HH TYR 29 -1.694 4.927 -5.047
124 HA PRO 30 HA PRO 30 -3.005 -5.896 -2.533
125 1HB PRO 30 1HB PRO 30 -0.820 -6.570 -4.428
126 2HB PRO 30 2HB PRO 30 -2.377 -7.400 -4.161
127 1HG PRO 30 1HG PRO 30 -1.936 -5.876 -6.400
128 2HG PRO 30 2HG PRO 30 -3.527 -5.860 -5.568
129 1HD PRO 30 1HD PRO 30 -1.259 -3.869 -5.319
130 2HD PRO 30 2HD PRO 30 -3.002 -3.559 -5.551
131 H GLN 31 H GLN 31 -1.766 -6.966 -1.046
132 HA GLN 31 HA GLN 31 0.815 -5.829 -0.164
133 1HB GLN 31 1HB GLN 31 -0.747 -8.298 0.750
134 2HB GLN 31 2HB GLN 31 0.730 -7.718 1.525
135 1HG GLN 31 1HG GLN 31 -0.312 -5.676 2.244
136 2HG GLN 31 2HG GLN 31 -1.766 -5.993 1.296
137 1HE2 GLN 31 1HE2 GLN 31 0.026 -8.243 3.551
138 2HE2 GLN 31 2HE2 GLN 31 -1.390 -8.455 4.573
139 H ASP 32 H ASP 32 -0.003 -7.856 -2.627
140 HA ASP 32 HA ASP 32 2.474 -9.311 -2.891
141 1HB ASP 32 1HB ASP 32 0.226 -9.464 -4.239
142 2HB ASP 32 2HB ASP 32 0.784 -8.064 -5.106
143 H TRP 33 H TRP 33 1.356 -6.154 -3.446
144 HA TRP 33 HA TRP 33 3.968 -5.038 -4.202
145 1HB TRP 33 1HB TRP 33 1.360 -3.555 -4.055
146 2HB TRP 33 2HB TRP 33 2.873 -3.021 -4.731
147 HD1 TRP 33 HD1 TRP 33 2.244 -6.383 -6.154
148 HE1 TRP 33 HE1 TRP 33 1.039 -6.277 -8.405
149 HE3 TRP 33 HE3 TRP 33 1.006 -1.412 -6.171
150 HZ2 TRP 33 HZ2 TRP 33 -0.435 -4.342 -9.942
151 HZ3 TRP 33 HZ3 TRP 33 -0.291 -0.461 -8.076
152 HH2 TRP 33 HH2 TRP 33 -1.074 -1.922 -9.918
153 H LEU 34 H LEU 34 3.760 -6.125 -1.886
154 HA LEU 34 HA LEU 34 4.820 -3.897 -0.236
155 1HB LEU 34 1HB LEU 34 2.558 -4.679 0.677
156 2HB LEU 34 2HB LEU 34 3.287 -6.247 0.950
157 HG LEU 34 HG LEU 34 5.048 -5.031 2.397
158 1HD1 LEU 34 1HD1 LEU 34 4.472 -2.720 1.588
159 2HD1 LEU 34 2HD1 LEU 34 2.900 -2.871 2.386
160 3HD1 LEU 34 3HD1 LEU 34 4.394 -2.888 3.349
161 1HD2 LEU 34 1HD2 LEU 34 3.531 -4.987 4.353
162 2HD2 LEU 34 2HD2 LEU 34 2.121 -5.017 3.270
163 3HD2 LEU 34 3HD2 LEU 34 3.227 -6.409 3.342
164 H CYS 35 H CYS 35 6.929 -4.231 -0.442
165 HA CYS 35 HA CYS 35 8.896 -5.038 -0.970
166 1HB CYS 35 1HB CYS 35 8.898 -5.619 1.157
167 2HB CYS 35 2HB CYS 35 8.027 -7.118 0.965
168 H ASP 36 H ASP 36 7.820 -5.106 -3.077
169 HA ASP 36 HA ASP 36 7.467 -7.798 -4.344
170 1HB ASP 36 1HB ASP 36 5.917 -5.903 -4.907
171 2HB ASP 36 2HB ASP 36 7.285 -5.022 -5.570
172 H GLY 37 H GLY 37 9.884 -5.488 -3.650
173 1HA GLY 37 1HA GLY 37 12.214 -5.605 -4.168
174 2HA GLY 37 2HA GLY 37 11.851 -6.667 -5.543
175 H HIS 38 H HIS 38 9.721 -4.263 -5.395
176 HA HIS 38 HA HIS 38 10.948 -2.286 -7.194
177 1HB HIS 38 1HB HIS 38 10.142 -3.910 -8.729
178 2HB HIS 38 2HB HIS 38 8.701 -4.224 -7.799
179 HD1 HIS 38 HD1 HIS 38 9.987 -1.386 -10.138
180 HD2 HIS 38 HD2 HIS 38 6.609 -2.743 -8.008
181 HE1 HIS 38 HE1 HIS 38 8.032 0.190 -10.753
182 HE2 HIS 38 HE2 HIS 38 5.955 -0.682 -9.480
183 HA PRO 39 HA PRO 39 8.219 -0.104 -4.261
184 1HB PRO 39 1HB PRO 39 8.674 2.470 -5.266
185 2HB PRO 39 2HB PRO 39 9.452 1.655 -3.905
186 1HG PRO 39 1HG PRO 39 10.686 2.310 -6.462
187 2HG PRO 39 2HG PRO 39 11.421 1.463 -5.070
188 1HD PRO 39 1HD PRO 39 10.286 0.337 -7.569
189 2HD PRO 39 2HD PRO 39 11.431 -0.401 -6.424
190 H ASP 40 H ASP 40 6.198 0.897 -4.373
191 HA ASP 40 HA ASP 40 5.264 2.016 -6.959
192 1HB ASP 40 1HB ASP 40 4.707 -0.672 -6.486
193 2HB ASP 40 2HB ASP 40 3.257 0.110 -5.885
194 H CYS 41 H CYS 41 5.609 2.433 -3.778
195 HA CYS 41 HA CYS 41 2.911 2.874 -3.043
196 1HB CYS 41 1HB CYS 41 5.276 2.573 -1.657
197 2HB CYS 41 2HB CYS 41 4.578 4.063 -1.080
198 H ASP 42 H ASP 42 3.894 4.661 -5.020
199 HA ASP 42 HA ASP 42 4.543 6.717 -5.663
200 1HB ASP 42 1HB ASP 42 2.037 6.988 -5.422
201 2HB ASP 42 2HB ASP 42 2.325 7.769 -3.868
202 H ASP 43 H ASP 43 5.132 5.949 -2.631
203 HA ASP 43 HA ASP 43 7.385 7.822 -2.603
204 1HB ASP 43 1HB ASP 43 5.496 7.727 -0.576
205 2HB ASP 43 2HB ASP 43 6.754 6.646 0.001
206 H GLY 44 H GLY 44 6.495 4.805 -3.171
207 1HA GLY 44 1HA GLY 44 7.665 2.712 -3.224
208 2HA GLY 44 2HA GLY 44 9.149 3.581 -2.883
209 H ARG 45 H ARG 45 6.496 3.751 -0.761
210 HA ARG 45 HA ARG 45 8.179 2.704 1.472
211 1HB ARG 45 1HB ARG 45 6.622 3.687 3.043
212 2HB ARG 45 2HB ARG 45 7.270 4.892 1.944
213 1HG ARG 45 1HG ARG 45 5.216 5.041 0.714
214 2HG ARG 45 2HG ARG 45 4.525 3.640 1.554
215 1HD ARG 45 1HD ARG 45 5.343 6.200 2.966
216 2HD ARG 45 2HD ARG 45 3.722 5.934 2.297
217 HE ARG 45 HE ARG 45 4.055 3.700 3.827
218 1HH1 ARG 45 1HH1 ARG 45 4.303 7.088 4.670
219 2HH1 ARG 45 2HH1 ARG 45 3.829 6.795 6.325
220 1HH2 ARG 45 1HH2 ARG 45 3.468 3.397 5.923
221 2HH2 ARG 45 2HH2 ARG 45 3.364 4.759 7.004
222 H ASP 46 H ASP 46 6.492 1.243 -0.759
223 HA ASP 46 HA ASP 46 5.184 -0.661 0.945
224 1HB ASP 46 1HB ASP 46 4.920 -1.887 -1.161
225 2HB ASP 46 2HB ASP 46 4.145 -0.314 -1.242
226 H GLU 47 H GLU 47 8.153 0.023 -0.725
227 HA GLU 47 HA GLU 47 9.216 -2.647 -0.433
228 1HB GLU 47 1HB GLU 47 10.424 0.049 -1.111
229 2HB GLU 47 2HB GLU 47 11.400 -1.400 -1.044
230 1HG GLU 47 1HG GLU 47 8.877 -1.373 -2.710
231 2HG GLU 47 2HG GLU 47 10.347 -0.618 -3.291
232 H TRP 48 H TRP 48 9.255 0.248 1.356
233 HA TRP 48 HA TRP 48 11.674 0.070 2.706
234 1HB TRP 48 1HB TRP 48 9.199 1.506 3.674
235 2HB TRP 48 2HB TRP 48 10.829 1.719 4.294
236 HD1 TRP 48 HD1 TRP 48 11.255 1.621 0.644
237 HE1 TRP 48 HE1 TRP 48 10.971 3.894 -0.441
238 HE3 TRP 48 HE3 TRP 48 9.495 4.096 4.667
239 HZ2 TRP 48 HZ2 TRP 48 10.297 6.641 0.454
240 HZ3 TRP 48 HZ3 TRP 48 9.025 6.589 4.576
241 HH2 TRP 48 HH2 TRP 48 9.430 7.837 2.463
242 H GLY 49 H GLY 49 12.322 -1.317 3.808
243 1HA GLY 49 1HA GLY 49 12.836 -2.580 5.756
244 2HA GLY 49 2HA GLY 49 11.321 -2.011 6.467
245 H CYS 50 H CYS 50 10.562 -3.366 3.432
246 HA CYS 50 HA CYS 50 9.074 -4.958 3.006
247 1HB CYS 50 1HB CYS 50 11.345 -5.486 2.354
248 2HB CYS 50 2HB CYS 50 11.656 -6.232 3.892
249 H GLY 51 H GLY 51 8.641 -4.184 5.709
250 1HA GLY 51 1HA GLY 51 6.645 -6.080 6.557
251 2HA GLY 51 2HA GLY 51 8.095 -6.297 7.537
Start of MODEL 6
1 H SER 10 H SER 10 -6.847 -0.489 5.391
2 HA SER 10 HA SER 10 -8.560 -2.463 6.686
3 1HB SER 10 1HB SER 10 -10.215 -0.770 7.475
4 2HB SER 10 2HB SER 10 -8.699 -0.781 8.387
5 HG SER 10 HG SER 10 -9.411 1.327 7.914
6 H CYS 11 H CYS 11 -8.731 -3.353 4.794
7 HA CYS 11 HA CYS 11 -10.358 -2.207 2.672
8 1HB CYS 11 1HB CYS 11 -7.586 -1.858 2.779
9 2HB CYS 11 2HB CYS 11 -7.707 -3.334 1.871
10 HA PRO 12 HA PRO 12 -11.025 -6.657 2.247
11 1HB PRO 12 1HB PRO 12 -9.583 -7.073 -0.356
12 2HB PRO 12 2HB PRO 12 -11.296 -7.416 0.024
13 1HG PRO 12 1HG PRO 12 -10.586 -5.299 -1.551
14 2HG PRO 12 2HG PRO 12 -11.936 -5.182 -0.375
15 1HD PRO 12 1HD PRO 12 -9.066 -4.279 -0.025
16 2HD PRO 12 2HD PRO 12 -10.565 -3.371 0.314
17 HA PRO 13 HA PRO 13 -7.262 -8.598 3.629
18 1HB PRO 13 1HB PRO 13 -7.446 -11.263 3.039
19 2HB PRO 13 2HB PRO 13 -8.492 -10.477 4.265
20 1HG PRO 13 1HG PRO 13 -9.122 -11.036 1.356
21 2HG PRO 13 2HG PRO 13 -10.127 -11.428 2.791
22 1HD PRO 13 1HD PRO 13 -10.557 -9.199 1.295
23 2HD PRO 13 2HD PRO 13 -10.749 -9.151 3.076
24 H GLY 14 H GLY 14 -5.316 -9.111 3.083
25 1HA GLY 14 1HA GLY 14 -3.399 -9.059 1.840
26 2HA GLY 14 2HA GLY 14 -4.281 -9.723 0.471
27 H GLN 15 H GLN 15 -5.296 -6.581 1.874
28 HA GLN 15 HA GLN 15 -3.937 -5.071 -0.229
29 1HB GLN 15 1HB GLN 15 -6.876 -5.363 0.089
30 2HB GLN 15 2HB GLN 15 -6.257 -3.737 -0.233
31 1HG GLN 15 1HG GLN 15 -5.282 -4.334 -2.282
32 2HG GLN 15 2HG GLN 15 -5.259 -6.058 -1.897
33 1HE2 GLN 15 1HE2 GLN 15 -7.271 -7.258 -1.852
34 2HE2 GLN 15 2HE2 GLN 15 -8.529 -6.711 -2.953
35 H PHE 16 H PHE 16 -2.939 -3.472 0.613
36 HA PHE 16 HA PHE 16 -3.770 -2.248 3.253
37 1HB PHE 16 1HB PHE 16 -1.566 -2.095 3.990
38 2HB PHE 16 2HB PHE 16 -1.636 -3.695 3.287
39 HD1 PHE 16 HD1 PHE 16 0.101 -0.537 3.307
40 HD2 PHE 16 HD2 PHE 16 -0.819 -3.900 0.812
41 HE1 PHE 16 HE1 PHE 16 1.866 0.162 1.728
42 HE2 PHE 16 HE2 PHE 16 1.025 -3.288 -0.714
43 HZ PHE 16 HZ PHE 16 2.333 -1.270 -0.336
44 H ARG 17 H ARG 17 -2.961 0.071 3.557
45 HA ARG 17 HA ARG 17 -2.837 1.527 0.949
46 1HB ARG 17 1HB ARG 17 -3.745 3.444 1.969
47 2HB ARG 17 2HB ARG 17 -4.806 2.043 2.254
48 1HG ARG 17 1HG ARG 17 -3.983 1.894 4.593
49 2HG ARG 17 2HG ARG 17 -2.901 3.266 4.304
50 1HD ARG 17 1HD ARG 17 -4.868 4.077 5.457
51 2HD ARG 17 2HD ARG 17 -4.845 4.717 3.820
52 HE ARG 17 HE ARG 17 -6.784 3.527 3.291
53 1HH1 ARG 17 2HH2 ARG 17 -5.758 2.368 6.455
54 2HH1 ARG 17 1HH2 ARG 17 -7.299 1.539 6.653
55 1HH2 ARG 17 2HH1 ARG 17 -8.518 2.336 3.587
56 2HH2 ARG 17 1HH1 ARG 17 -8.744 1.417 5.066
57 H CYS 18 H CYS 18 -1.530 3.151 0.610
58 HA CYS 18 HA CYS 18 1.154 2.744 1.727
59 1HB CYS 18 1HB CYS 18 -0.052 3.936 -0.756
60 2HB CYS 18 2HB CYS 18 1.592 4.373 -0.300
61 H SER 19 H SER 19 0.191 5.705 0.440
62 HA SER 19 HA SER 19 1.552 7.132 2.684
63 1HB SER 19 1HB SER 19 1.545 7.849 -0.272
64 2HB SER 19 2HB SER 19 2.482 8.655 1.001
65 HG SER 19 HG SER 19 3.061 6.419 -0.384
66 H GLU 20 H GLU 20 -1.078 6.732 2.664
67 HA GLU 20 HA GLU 20 -2.060 9.472 3.241
68 1HB GLU 20 1HB GLU 20 -2.961 8.888 1.079
69 2HB GLU 20 2HB GLU 20 -3.643 7.393 1.705
70 1HG GLU 20 1HG GLU 20 -5.202 8.636 3.125
71 2HG GLU 20 2HG GLU 20 -4.398 10.158 2.731
72 HA PRO 21 HA PRO 21 -2.547 7.167 7.047
73 1HB PRO 21 1HB PRO 21 -3.575 9.136 8.677
74 2HB PRO 21 2HB PRO 21 -1.893 9.149 8.069
75 1HG PRO 21 1HG PRO 21 -4.312 10.571 6.899
76 2HG PRO 21 2HG PRO 21 -2.711 11.273 7.312
77 1HD PRO 21 1HD PRO 21 -3.281 10.482 4.781
78 2HD PRO 21 2HD PRO 21 -1.664 10.187 5.485
79 HA PRO 22 HA PRO 22 -6.792 5.829 7.528
80 1HB PRO 22 1HB PRO 22 -7.098 5.354 10.213
81 2HB PRO 22 2HB PRO 22 -6.091 4.332 9.142
82 1HG PRO 22 1HG PRO 22 -5.185 6.642 10.895
83 2HG PRO 22 2HG PRO 22 -4.527 4.977 10.820
84 1HD PRO 22 1HD PRO 22 -3.378 7.002 9.432
85 2HD PRO 22 2HD PRO 22 -3.522 5.380 8.698
86 H GLY 23 H GLY 23 -8.825 6.322 8.795
87 1HA GLY 23 1HA GLY 23 -10.540 7.883 9.142
88 2HA GLY 23 2HA GLY 23 -9.333 9.129 9.459
89 H ALA 24 H ALA 24 -8.229 8.043 6.691
90 HA ALA 24 HA ALA 24 -10.193 9.172 4.781
91 1HB ALA 24 1HB ALA 24 -8.489 10.908 5.151
92 2HB ALA 24 2HB ALA 24 -7.192 9.742 4.808
93 3HB ALA 24 3HB ALA 24 -8.325 10.215 3.525
94 H HIS 25 H HIS 25 -10.781 6.927 4.645
95 HA HIS 25 HA HIS 25 -9.207 4.744 4.508
96 1HB HIS 25 1HB HIS 25 -11.907 5.198 3.168
97 2HB HIS 25 2HB HIS 25 -11.207 3.637 3.534
98 HD1 HIS 25 HD1 HIS 25 -10.586 3.392 6.383
99 HD2 HIS 25 HD2 HIS 25 -13.598 6.016 4.976
100 HE1 HIS 25 HE1 HIS 25 -12.106 3.919 8.399
101 HE2 HIS 25 HE2 HIS 25 -13.933 5.514 7.537
102 H GLY 26 H GLY 26 -10.101 6.600 1.757
103 1HA GLY 26 1HA GLY 26 -9.185 6.836 -0.380
104 2HA GLY 26 2HA GLY 26 -7.704 6.289 0.405
105 H GLU 27 H GLU 27 -6.993 5.348 -1.438
106 HA GLU 27 HA GLU 27 -8.187 2.705 -2.225
107 1HB GLU 27 1HB GLU 27 -6.908 4.785 -4.068
108 2HB GLU 27 2HB GLU 27 -7.276 3.114 -4.519
109 1HG GLU 27 1HG GLU 27 -9.685 3.516 -4.042
110 2HG GLU 27 2HG GLU 27 -9.325 5.202 -3.656
111 H CYS 28 H CYS 28 -7.216 1.370 -1.344
112 HA CYS 28 HA CYS 28 -4.565 1.068 -0.516
113 1HB CYS 28 1HB CYS 28 -6.658 -0.981 -1.315
114 2HB CYS 28 2HB CYS 28 -5.478 -1.143 -0.076
115 H TYR 29 H TYR 29 -3.530 -1.145 -1.202
116 HA TYR 29 HA TYR 29 -3.484 -1.741 -4.067
117 1HB TYR 29 1HB TYR 29 -0.982 -0.962 -2.492
118 2HB TYR 29 2HB TYR 29 -0.965 -1.596 -4.119
119 HD1 TYR 29 HD1 TYR 29 -1.342 1.341 -2.006
120 HD2 TYR 29 HD2 TYR 29 -1.776 -0.119 -6.050
121 HE1 TYR 29 HE1 TYR 29 -1.414 3.687 -2.864
122 HE2 TYR 29 HE2 TYR 29 -1.837 2.206 -6.885
123 HH TYR 29 HH TYR 29 -1.762 4.426 -6.348
124 HA PRO 30 HA PRO 30 -3.060 -5.822 -2.377
125 1HB PRO 30 1HB PRO 30 -0.942 -6.487 -4.347
126 2HB PRO 30 2HB PRO 30 -2.500 -7.305 -4.043
127 1HG PRO 30 1HG PRO 30 -2.120 -5.750 -6.271
128 2HG PRO 30 2HG PRO 30 -3.679 -5.727 -5.383
129 1HD PRO 30 1HD PRO 30 -1.380 -3.767 -5.184
130 2HD PRO 30 2HD PRO 30 -3.127 -3.435 -5.345
131 H GLN 31 H GLN 31 -1.805 -6.928 -0.941
132 HA GLN 31 HA GLN 31 0.820 -5.859 -0.108
133 1HB GLN 31 1HB GLN 31 -0.772 -8.311 0.800
134 2HB GLN 31 2HB GLN 31 0.735 -7.779 1.550
135 1HG GLN 31 1HG GLN 31 -0.244 -5.728 2.329
136 2HG GLN 31 2HG GLN 31 -1.725 -5.994 1.407
137 1HE2 GLN 31 2HE2 GLN 31 0.060 -8.318 3.593
138 2HE2 GLN 31 1HE2 GLN 31 -1.344 -8.515 4.634
139 H ASP 32 H ASP 32 -0.087 -7.818 -2.587
140 HA ASP 32 HA ASP 32 2.367 -9.296 -2.941
141 1HB ASP 32 1HB ASP 32 0.082 -9.401 -4.231
142 2HB ASP 32 2HB ASP 32 0.632 -7.989 -5.085
143 H TRP 33 H TRP 33 1.273 -6.118 -3.406
144 HA TRP 33 HA TRP 33 3.875 -5.022 -4.219
145 1HB TRP 33 1HB TRP 33 1.291 -3.508 -3.975
146 2HB TRP 33 2HB TRP 33 2.791 -2.983 -4.687
147 HD1 TRP 33 HD1 TRP 33 2.099 -6.315 -6.138
148 HE1 TRP 33 HE1 TRP 33 0.818 -6.180 -8.345
149 HE3 TRP 33 HE3 TRP 33 0.891 -1.337 -6.063
150 HZ2 TRP 33 HZ2 TRP 33 -0.690 -4.220 -9.815
151 HZ3 TRP 33 HZ3 TRP 33 -0.453 -0.357 -7.921
152 HH2 TRP 33 HH2 TRP 33 -1.303 -1.795 -9.749
153 H LEU 34 H LEU 34 3.719 -6.140 -1.917
154 HA LEU 34 HA LEU 34 4.851 -3.951 -0.261
155 1HB LEU 34 1HB LEU 34 2.608 -4.744 0.701
156 2HB LEU 34 2HB LEU 34 3.338 -6.320 0.919
157 HG LEU 34 HG LEU 34 5.143 -5.150 2.343
158 1HD1 LEU 34 1HD1 LEU 34 4.544 -3.017 3.351
159 2HD1 LEU 34 2HD1 LEU 34 4.583 -2.818 1.593
160 3HD1 LEU 34 3HD1 LEU 34 3.027 -2.962 2.425
161 1HD2 LEU 34 1HD2 LEU 34 3.328 -6.521 3.312
162 2HD2 LEU 34 2HD2 LEU 34 3.682 -5.121 4.339
163 3HD2 LEU 34 3HD2 LEU 34 2.242 -5.111 3.294
164 H CYS 35 H CYS 35 6.949 -4.293 -0.529
165 HA CYS 35 HA CYS 35 8.892 -5.090 -1.148
166 1HB CYS 35 1HB CYS 35 8.964 -5.740 0.963
167 2HB CYS 35 2HB CYS 35 8.082 -7.227 0.753
168 H ASP 36 H ASP 36 7.763 -5.085 -3.219
169 HA ASP 36 HA ASP 36 7.377 -7.737 -4.559
170 1HB ASP 36 1HB ASP 36 5.813 -5.829 -5.028
171 2HB ASP 36 2HB ASP 36 7.168 -4.925 -5.694
172 H GLY 37 H GLY 37 9.812 -5.447 -3.854
173 1HA GLY 37 1HA GLY 37 12.129 -5.551 -4.425
174 2HA GLY 37 2HA GLY 37 11.734 -6.574 -5.821
175 H HIS 38 H HIS 38 9.613 -4.163 -5.553
176 HA HIS 38 HA HIS 38 10.805 -2.137 -7.316
177 1HB HIS 38 1HB HIS 38 9.975 -3.710 -8.888
178 2HB HIS 38 2HB HIS 38 8.565 -4.079 -7.935
179 HD1 HIS 38 HD1 HIS 38 9.730 -1.162 -10.232
180 HD2 HIS 38 HD2 HIS 38 6.449 -2.629 -8.027
181 HE1 HIS 38 HE1 HIS 38 7.731 0.394 -10.743
182 HE2 HIS 38 HE2 HIS 38 5.709 -0.550 -9.431
183 HA PRO 39 HA PRO 39 8.149 -0.012 -4.289
184 1HB PRO 39 1HB PRO 39 8.474 2.578 -5.244
185 2HB PRO 39 2HB PRO 39 9.425 1.748 -4.012
186 1HG PRO 39 1HG PRO 39 10.228 2.443 -6.771
187 2HG PRO 39 2HG PRO 39 11.252 1.825 -5.444
188 1HD PRO 39 1HD PRO 39 10.106 0.385 -7.719
189 2HD PRO 39 2HD PRO 39 11.269 -0.214 -6.517
190 H ASP 40 H ASP 40 6.105 0.952 -4.304
191 HA ASP 40 HA ASP 40 5.063 2.108 -6.827
192 1HB ASP 40 1HB ASP 40 4.515 -0.595 -6.364
193 2HB ASP 40 2HB ASP 40 3.080 0.197 -5.740
194 H CYS 41 H CYS 41 5.544 2.471 -3.657
195 HA CYS 41 HA CYS 41 2.885 2.913 -2.811
196 1HB CYS 41 1HB CYS 41 5.314 2.614 -1.530
197 2HB CYS 41 2HB CYS 41 4.615 4.087 -0.899
198 H ASP 42 H ASP 42 3.793 4.705 -4.819
199 HA ASP 42 HA ASP 42 4.436 6.750 -5.490
200 1HB ASP 42 1HB ASP 42 1.951 7.079 -5.139
201 2HB ASP 42 2HB ASP 42 2.321 7.836 -3.590
202 H ASP 43 H ASP 43 5.108 5.976 -2.481
203 HA ASP 43 HA ASP 43 7.371 7.842 -2.383
204 1HB ASP 43 1HB ASP 43 5.516 7.981 -0.546
205 2HB ASP 43 2HB ASP 43 6.287 6.528 0.058
206 H GLY 44 H GLY 44 6.476 4.849 -3.041
207 1HA GLY 44 1HA GLY 44 7.623 2.739 -3.150
208 2HA GLY 44 2HA GLY 44 9.116 3.601 -2.834
209 H ARG 45 H ARG 45 6.536 3.711 -0.609
210 HA ARG 45 HA ARG 45 8.325 2.606 1.509
211 1HB ARG 45 1HB ARG 45 6.969 3.555 3.192
212 2HB ARG 45 2HB ARG 45 7.318 4.805 2.006
213 1HG ARG 45 1HG ARG 45 5.048 4.656 1.105
214 2HG ARG 45 2HG ARG 45 4.699 3.247 2.122
215 1HD ARG 45 1HD ARG 45 3.666 5.176 3.095
216 2HD ARG 45 2HD ARG 45 4.987 4.634 4.144
217 HE ARG 45 HE ARG 45 5.855 6.701 2.290
218 1HH1 ARG 45 2HH2 ARG 45 4.015 6.413 5.251
219 2HH1 ARG 45 1HH2 ARG 45 4.426 8.036 5.752
220 1HH2 ARG 45 1HH1 ARG 45 6.401 8.637 2.982
221 2HH2 ARG 45 2HH1 ARG 45 5.740 9.302 4.475
222 H ASP 46 H ASP 46 6.527 1.205 -0.687
223 HA ASP 46 HA ASP 46 5.285 -0.751 1.005
224 1HB ASP 46 1HB ASP 46 4.927 -1.905 -1.126
225 2HB ASP 46 2HB ASP 46 4.176 -0.318 -1.136
226 H GLU 47 H GLU 47 8.190 -0.021 -0.749
227 HA GLU 47 HA GLU 47 9.272 -2.691 -0.576
228 1HB GLU 47 1HB GLU 47 10.443 0.033 -1.213
229 2HB GLU 47 2HB GLU 47 11.430 -1.410 -1.220
230 1HG GLU 47 1HG GLU 47 8.850 -1.354 -2.800
231 2HG GLU 47 2HG GLU 47 10.296 -0.578 -3.410
232 H TRP 48 H TRP 48 9.370 0.148 1.308
233 HA TRP 48 HA TRP 48 11.848 -0.055 2.530
234 1HB TRP 48 1HB TRP 48 9.411 1.313 3.675
235 2HB TRP 48 2HB TRP 48 11.065 1.518 4.227
236 HD1 TRP 48 HD1 TRP 48 11.299 1.581 0.553
237 HE1 TRP 48 HE1 TRP 48 10.940 3.898 -0.408
238 HE3 TRP 48 HE3 TRP 48 9.765 3.851 4.782
239 HZ2 TRP 48 HZ2 TRP 48 10.249 6.598 0.648
240 HZ3 TRP 48 HZ3 TRP 48 9.280 6.341 4.840
241 HH2 TRP 48 HH2 TRP 48 9.538 7.686 2.769
242 H GLY 49 H GLY 49 12.567 -1.476 3.546
243 1HA GLY 49 1HA GLY 49 13.189 -2.838 5.390
244 2HA GLY 49 2HA GLY 49 11.741 -2.273 6.230
245 H CYS 50 H CYS 50 10.794 -3.526 3.191
246 HA CYS 50 HA CYS 50 9.259 -5.083 2.796
247 1HB CYS 50 1HB CYS 50 11.484 -5.638 2.030
248 2HB CYS 50 2HB CYS 50 11.854 -6.418 3.538
249 H GLY 51 H GLY 51 8.929 -4.349 5.509
250 1HA GLY 51 1HA GLY 51 7.020 -6.349 6.414
251 2HA GLY 51 2HA GLY 51 8.481 -6.374 7.404
Start of MODEL 7
1 H SER 10 H SER 10 -6.574 -0.803 5.632
2 HA SER 10 HA SER 10 -8.496 -2.660 6.816
3 1HB SER 10 1HB SER 10 -10.020 -0.838 7.606
4 2HB SER 10 2HB SER 10 -8.539 -1.017 8.562
5 HG SER 10 HG SER 10 -9.024 1.158 8.140
6 H CYS 11 H CYS 11 -8.637 -3.477 4.875
7 HA CYS 11 HA CYS 11 -10.266 -2.217 2.834
8 1HB CYS 11 1HB CYS 11 -7.518 -1.846 2.905
9 2HB CYS 11 2HB CYS 11 -7.611 -3.309 1.972
10 HA PRO 12 HA PRO 12 -10.985 -6.644 2.228
11 1HB PRO 12 1HB PRO 12 -9.538 -6.964 -0.391
12 2HB PRO 12 2HB PRO 12 -11.246 -7.341 -0.018
13 1HG PRO 12 1HG PRO 12 -10.577 -5.160 -1.514
14 2HG PRO 12 2HG PRO 12 -11.910 -5.094 -0.315
15 1HD PRO 12 1HD PRO 12 -9.041 -4.185 0.026
16 2HD PRO 12 2HD PRO 12 -10.544 -3.306 0.421
17 HA PRO 13 HA PRO 13 -7.228 -8.670 3.528
18 1HB PRO 13 1HB PRO 13 -7.470 -11.315 2.872
19 2HB PRO 13 2HB PRO 13 -8.479 -10.543 4.138
20 1HG PRO 13 1HG PRO 13 -9.171 -11.011 1.228
21 2HG PRO 13 2HG PRO 13 -10.157 -11.427 2.671
22 1HD PRO 13 1HD PRO 13 -10.582 -9.149 1.248
23 2HD PRO 13 2HD PRO 13 -10.732 -9.147 3.034
24 H GLY 14 H GLY 14 -5.304 -9.168 2.920
25 1HA GLY 14 1HA GLY 14 -3.416 -9.110 1.623
26 2HA GLY 14 2HA GLY 14 -4.352 -9.705 0.255
27 H GLN 15 H GLN 15 -5.313 -6.602 1.771
28 HA GLN 15 HA GLN 15 -3.947 -5.043 -0.298
29 1HB GLN 15 1HB GLN 15 -6.873 -5.333 0.061
30 2HB GLN 15 2HB GLN 15 -6.267 -3.687 -0.165
31 1HG GLN 15 1HG GLN 15 -5.323 -4.147 -2.264
32 2HG GLN 15 2HG GLN 15 -5.289 -5.891 -1.991
33 1HE2 GLN 15 2HE2 GLN 15 -7.296 -7.094 -1.993
34 2HE2 GLN 15 1HE2 GLN 15 -8.572 -6.488 -3.041
35 H PHE 16 H PHE 16 -3.001 -3.403 0.503
36 HA PHE 16 HA PHE 16 -3.817 -2.160 3.140
37 1HB PHE 16 1HB PHE 16 -1.625 -2.001 3.917
38 2HB PHE 16 2HB PHE 16 -1.677 -3.611 3.235
39 HD1 PHE 16 HD1 PHE 16 -0.867 -3.816 0.746
40 HD2 PHE 16 HD2 PHE 16 0.069 -0.464 3.250
41 HE1 PHE 16 HE1 PHE 16 0.965 -3.198 -0.790
42 HE2 PHE 16 HE2 PHE 16 1.827 0.241 1.660
43 HZ PHE 16 HZ PHE 16 2.284 -1.186 -0.403
44 H ARG 17 H ARG 17 -2.984 0.149 3.429
45 HA ARG 17 HA ARG 17 -2.918 1.602 0.819
46 1HB ARG 17 1HB ARG 17 -3.765 3.527 1.916
47 2HB ARG 17 2HB ARG 17 -4.826 2.130 2.200
48 1HG ARG 17 1HG ARG 17 -3.875 1.894 4.502
49 2HG ARG 17 2HG ARG 17 -2.843 3.301 4.207
50 1HD ARG 17 1HD ARG 17 -4.770 4.012 5.488
51 2HD ARG 17 2HD ARG 17 -4.843 4.717 3.878
52 HE ARG 17 HE ARG 17 -6.790 3.523 3.414
53 1HH1 ARG 17 1HH2 ARG 17 -5.538 2.153 6.400
54 2HH1 ARG 17 2HH2 ARG 17 -7.065 1.314 6.652
55 1HH2 ARG 17 2HH1 ARG 17 -8.469 2.313 3.716
56 2HH2 ARG 17 1HH1 ARG 17 -8.599 1.254 5.107
57 H CYS 18 H CYS 18 -1.597 3.197 0.403
58 HA CYS 18 HA CYS 18 1.114 2.925 1.540
59 1HB CYS 18 1HB CYS 18 -0.098 3.966 -1.010
60 2HB CYS 18 2HB CYS 18 1.534 4.441 -0.556
61 H SER 19 H SER 19 0.028 5.759 0.062
62 HA SER 19 HA SER 19 1.526 7.349 2.021
63 1HB SER 19 1HB SER 19 1.803 8.951 0.099
64 2HB SER 19 2HB SER 19 2.341 7.308 -0.270
65 HG SER 19 HG SER 19 1.027 8.176 -1.944
66 H GLU 20 H GLU 20 -1.125 6.768 2.429
67 HA GLU 20 HA GLU 20 -2.090 9.440 3.305
68 1HB GLU 20 1HB GLU 20 -3.161 8.993 1.177
69 2HB GLU 20 2HB GLU 20 -3.829 7.482 1.781
70 1HG GLU 20 1HG GLU 20 -5.235 8.675 3.385
71 2HG GLU 20 2HG GLU 20 -4.409 10.197 3.035
72 HA PRO 21 HA PRO 21 -2.437 6.868 6.989
73 1HB PRO 21 1HB PRO 21 -3.280 8.771 8.790
74 2HB PRO 21 2HB PRO 21 -1.629 8.745 8.102
75 1HG PRO 21 1HG PRO 21 -4.022 10.359 7.152
76 2HG PRO 21 2HG PRO 21 -2.370 10.954 7.531
77 1HD PRO 21 1HD PRO 21 -3.106 10.365 4.986
78 2HD PRO 21 2HD PRO 21 -1.469 9.963 5.580
79 HA PRO 22 HA PRO 22 -6.730 5.726 7.522
80 1HB PRO 22 1HB PRO 22 -6.990 5.095 10.183
81 2HB PRO 22 2HB PRO 22 -6.078 4.095 9.012
82 1HG PRO 22 1HG PRO 22 -4.985 6.217 10.891
83 2HG PRO 22 2HG PRO 22 -4.424 4.529 10.667
84 1HD PRO 22 1HD PRO 22 -3.210 6.592 9.397
85 2HD PRO 22 2HD PRO 22 -3.463 5.040 8.551
86 H GLY 23 H GLY 23 -8.705 6.208 8.894
87 1HA GLY 23 1HA GLY 23 -10.337 7.807 9.426
88 2HA GLY 23 2HA GLY 23 -9.075 9.008 9.693
89 H ALA 24 H ALA 24 -8.167 7.962 6.849
90 HA ALA 24 HA ALA 24 -10.229 9.103 5.065
91 1HB ALA 24 1HB ALA 24 -8.455 10.235 3.744
92 2HB ALA 24 2HB ALA 24 -8.583 10.899 5.385
93 3HB ALA 24 3HB ALA 24 -7.255 9.790 4.977
94 H HIS 25 H HIS 25 -10.772 6.888 4.827
95 HA HIS 25 HA HIS 25 -9.173 4.729 4.673
96 1HB HIS 25 1HB HIS 25 -11.876 5.180 3.340
97 2HB HIS 25 2HB HIS 25 -11.158 3.616 3.651
98 HD1 HIS 25 HD1 HIS 25 -10.518 3.286 6.490
99 HD2 HIS 25 HD2 HIS 25 -13.568 5.916 5.183
100 HE1 HIS 25 HE1 HIS 25 -12.036 3.724 8.526
101 HE2 HIS 25 HE2 HIS 25 -13.888 5.323 7.726
102 H GLY 26 H GLY 26 -10.030 6.615 1.930
103 1HA GLY 26 1HA GLY 26 -9.081 6.856 -0.192
104 2HA GLY 26 2HA GLY 26 -7.629 6.205 0.567
105 H GLU 27 H GLU 27 -7.046 5.305 -1.367
106 HA GLU 27 HA GLU 27 -8.328 2.691 -2.093
107 1HB GLU 27 1HB GLU 27 -7.175 4.766 -4.026
108 2HB GLU 27 2HB GLU 27 -7.597 3.100 -4.450
109 1HG GLU 27 1HG GLU 27 -9.959 3.535 -3.782
110 2HG GLU 27 2HG GLU 27 -9.546 5.217 -3.438
111 H CYS 28 H CYS 28 -7.303 1.317 -1.361
112 HA CYS 28 HA CYS 28 -4.621 1.086 -0.622
113 1HB CYS 28 1HB CYS 28 -6.725 -0.994 -1.306
114 2HB CYS 28 2HB CYS 28 -5.455 -1.158 -0.159
115 H TYR 29 H TYR 29 -3.580 -1.109 -1.304
116 HA TYR 29 HA TYR 29 -3.536 -1.724 -4.164
117 1HB TYR 29 1HB TYR 29 -1.048 -0.876 -2.596
118 2HB TYR 29 2HB TYR 29 -1.005 -1.541 -4.207
119 HD1 TYR 29 HD1 TYR 29 -1.439 1.433 -2.168
120 HD2 TYR 29 HD2 TYR 29 -1.867 -0.125 -6.179
121 HE1 TYR 29 HE1 TYR 29 -1.616 3.749 -3.060
122 HE2 TYR 29 HE2 TYR 29 -2.032 2.188 -7.052
123 HH TYR 29 HH TYR 29 -1.903 5.057 -4.915
124 HA PRO 30 HA PRO 30 -3.075 -5.779 -2.476
125 1HB PRO 30 1HB PRO 30 -0.921 -6.441 -4.415
126 2HB PRO 30 2HB PRO 30 -2.481 -7.263 -4.137
127 1HG PRO 30 1HG PRO 30 -2.066 -5.705 -6.358
128 2HG PRO 30 2HG PRO 30 -3.641 -5.689 -5.498
129 1HD PRO 30 1HD PRO 30 -1.352 -3.723 -5.255
130 2HD PRO 30 2HD PRO 30 -3.095 -3.393 -5.451
131 H GLN 31 H GLN 31 -1.828 -6.890 -1.026
132 HA GLN 31 HA GLN 31 0.774 -5.779 -0.155
133 1HB GLN 31 1HB GLN 31 -0.770 -8.262 0.753
134 2HB GLN 31 2HB GLN 31 0.699 -7.666 1.523
135 1HG GLN 31 1HG GLN 31 -0.389 -5.624 2.231
136 2HG GLN 31 2HG GLN 31 -1.864 -6.033 1.352
137 1HE2 GLN 31 2HE2 GLN 31 -3.164 -5.914 3.347
138 2HE2 GLN 31 1HE2 GLN 31 -2.993 -7.206 4.522
139 H ASP 32 H ASP 32 -0.093 -7.767 -2.639
140 HA ASP 32 HA ASP 32 2.364 -9.241 -2.944
141 1HB ASP 32 1HB ASP 32 0.099 -9.348 -4.269
142 2HB ASP 32 2HB ASP 32 0.668 -7.945 -5.125
143 H TRP 33 H TRP 33 1.277 -6.063 -3.443
144 HA TRP 33 HA TRP 33 3.889 -4.968 -4.217
145 1HB TRP 33 1HB TRP 33 1.301 -3.456 -4.010
146 2HB TRP 33 2HB TRP 33 2.812 -2.928 -4.697
147 HD1 TRP 33 HD1 TRP 33 2.118 -6.258 -6.166
148 HE1 TRP 33 HE1 TRP 33 0.881 -6.098 -8.396
149 HE3 TRP 33 HE3 TRP 33 0.953 -1.268 -6.086
150 HZ2 TRP 33 HZ2 TRP 33 -0.591 -4.119 -9.878
151 HZ3 TRP 33 HZ3 TRP 33 -0.361 -0.270 -7.952
152 HH2 TRP 33 HH2 TRP 33 -1.195 -1.692 -9.804
153 H LEU 34 H LEU 34 3.699 -6.083 -1.909
154 HA LEU 34 HA LEU 34 4.804 -3.886 -0.244
155 1HB LEU 34 1HB LEU 34 2.541 -4.638 0.685
156 2HB LEU 34 2HB LEU 34 3.241 -6.225 0.928
157 HG LEU 34 HG LEU 34 5.046 -5.065 2.367
158 1HD1 LEU 34 1HD1 LEU 34 4.521 -2.733 1.604
159 2HD1 LEU 34 2HD1 LEU 34 2.951 -2.858 2.412
160 3HD1 LEU 34 3HD1 LEU 34 4.452 -2.924 3.362
161 1HD2 LEU 34 1HD2 LEU 34 2.136 -5.001 3.286
162 2HD2 LEU 34 2HD2 LEU 34 3.212 -6.417 3.323
163 3HD2 LEU 34 3HD2 LEU 34 3.564 -5.015 4.346
164 H CYS 35 H CYS 35 6.907 -4.247 -0.469
165 HA CYS 35 HA CYS 35 8.851 -5.070 -1.040
166 1HB CYS 35 1HB CYS 35 8.885 -5.670 1.082
167 2HB CYS 35 2HB CYS 35 7.999 -7.160 0.893
168 H ASP 36 H ASP 36 7.749 -5.108 -3.127
169 HA ASP 36 HA ASP 36 7.329 -7.783 -4.409
170 1HB ASP 36 1HB ASP 36 5.805 -5.855 -4.934
171 2HB ASP 36 2HB ASP 36 7.177 -4.995 -5.614
172 H GLY 37 H GLY 37 9.794 -5.518 -3.737
173 1HA GLY 37 1HA GLY 37 12.115 -5.669 -4.293
174 2HA GLY 37 2HA GLY 37 11.712 -6.715 -5.670
175 H HIS 38 H HIS 38 9.625 -4.278 -5.469
176 HA HIS 38 HA HIS 38 10.850 -2.308 -7.277
177 1HB HIS 38 1HB HIS 38 9.992 -3.912 -8.806
178 2HB HIS 38 2HB HIS 38 8.563 -4.209 -7.854
179 HD1 HIS 38 HD1 HIS 38 9.853 -1.378 -10.197
180 HD2 HIS 38 HD2 HIS 38 6.491 -2.696 -8.019
181 HE1 HIS 38 HE1 HIS 38 7.913 0.233 -10.768
182 HE2 HIS 38 HE2 HIS 38 5.845 -0.613 -9.466
183 HA PRO 39 HA PRO 39 8.200 -0.107 -4.286
184 1HB PRO 39 1HB PRO 39 8.696 2.467 -5.281
185 2HB PRO 39 2HB PRO 39 9.459 1.632 -3.923
186 1HG PRO 39 1HG PRO 39 10.722 2.280 -6.459
187 2HG PRO 39 2HG PRO 39 11.418 1.373 -5.086
188 1HD PRO 39 1HD PRO 39 10.226 0.348 -7.608
189 2HD PRO 39 2HD PRO 39 11.378 -0.444 -6.505
190 H ASP 40 H ASP 40 6.204 0.938 -4.357
191 HA ASP 40 HA ASP 40 5.241 2.089 -6.918
192 1HB ASP 40 1HB ASP 40 4.657 -0.595 -6.457
193 2HB ASP 40 2HB ASP 40 3.227 0.201 -5.827
194 H CYS 41 H CYS 41 5.640 2.469 -3.736
195 HA CYS 41 HA CYS 41 2.960 2.938 -2.957
196 1HB CYS 41 1HB CYS 41 5.333 2.586 -1.606
197 2HB CYS 41 2HB CYS 41 4.679 4.087 -1.005
198 H ASP 42 H ASP 42 3.934 4.732 -4.929
199 HA ASP 42 HA ASP 42 4.606 6.783 -5.565
200 1HB ASP 42 1HB ASP 42 2.107 7.091 -5.289
201 2HB ASP 42 2HB ASP 42 2.428 7.857 -3.733
202 H ASP 43 H ASP 43 5.229 5.981 -2.552
203 HA ASP 43 HA ASP 43 7.508 7.820 -2.547
204 1HB ASP 43 1HB ASP 43 5.669 7.794 -0.509
205 2HB ASP 43 2HB ASP 43 6.844 6.621 0.050
206 H GLY 44 H GLY 44 6.563 4.827 -3.113
207 1HA GLY 44 1HA GLY 44 7.706 2.716 -3.217
208 2HA GLY 44 2HA GLY 44 9.206 3.561 -2.887
209 H ARG 45 H ARG 45 6.589 3.745 -0.719
210 HA ARG 45 HA ARG 45 8.293 2.642 1.472
211 1HB ARG 45 1HB ARG 45 6.824 3.631 3.081
212 2HB ARG 45 2HB ARG 45 7.419 4.847 1.964
213 1HG ARG 45 1HG ARG 45 5.310 5.037 0.853
214 2HG ARG 45 2HG ARG 45 4.669 3.588 1.649
215 1HD ARG 45 1HD ARG 45 5.511 6.082 3.155
216 2HD ARG 45 2HD ARG 45 3.863 5.816 2.558
217 HE ARG 45 HE ARG 45 4.147 3.545 3.892
218 1HH1 ARG 45 1HH2 ARG 45 5.038 6.722 5.068
219 2HH1 ARG 45 2HH2 ARG 45 4.826 6.254 6.737
220 1HH2 ARG 45 2HH1 ARG 45 3.901 3.021 6.016
221 2HH2 ARG 45 1HH1 ARG 45 4.193 4.216 7.248
222 H ASP 46 H ASP 46 6.549 1.233 -0.747
223 HA ASP 46 HA ASP 46 5.243 -0.670 0.961
224 1HB ASP 46 1HB ASP 46 4.923 -1.870 -1.151
225 2HB ASP 46 2HB ASP 46 4.167 -0.285 -1.200
226 H GLU 47 H GLU 47 8.192 -0.009 -0.754
227 HA GLU 47 HA GLU 47 9.232 -2.691 -0.492
228 1HB GLU 47 1HB GLU 47 10.459 -0.007 -1.175
229 2HB GLU 47 2HB GLU 47 11.419 -1.467 -1.132
230 1HG GLU 47 1HG GLU 47 8.870 -1.395 -2.757
231 2HG GLU 47 2HG GLU 47 10.341 -0.661 -3.356
232 H TRP 48 H TRP 48 9.336 0.198 1.311
233 HA TRP 48 HA TRP 48 11.780 -0.025 2.611
234 1HB TRP 48 1HB TRP 48 9.353 1.447 3.641
235 2HB TRP 48 2HB TRP 48 11.000 1.629 4.223
236 HD1 TRP 48 HD1 TRP 48 11.349 1.547 0.567
237 HE1 TRP 48 HE1 TRP 48 11.081 3.831 -0.499
238 HE3 TRP 48 HE3 TRP 48 9.702 4.024 4.636
239 HZ2 TRP 48 HZ2 TRP 48 10.465 6.585 0.426
240 HZ3 TRP 48 HZ3 TRP 48 9.271 6.524 4.570
241 HH2 TRP 48 HH2 TRP 48 9.655 7.779 2.458
242 H GLY 49 H GLY 49 12.425 -1.431 3.694
243 1HA GLY 49 1HA GLY 49 12.955 -2.705 5.632
244 2HA GLY 49 2HA GLY 49 11.458 -2.122 6.368
245 H CYS 50 H CYS 50 10.639 -3.449 3.335
246 HA CYS 50 HA CYS 50 9.121 -5.020 2.927
247 1HB CYS 50 1HB CYS 50 11.371 -5.566 2.220
248 2HB CYS 50 2HB CYS 50 11.708 -6.329 3.745
249 H GLY 51 H GLY 51 8.717 -4.254 5.613
250 1HA GLY 51 1HA GLY 51 6.789 -6.231 6.504
251 2HA GLY 51 2HA GLY 51 8.237 -6.286 7.511
Start of MODEL 8
1 H SER 10 H SER 10 -6.915 -0.458 5.332
2 HA SER 10 HA SER 10 -8.543 -2.510 6.610
3 1HB SER 10 1HB SER 10 -10.263 -0.872 7.415
4 2HB SER 10 2HB SER 10 -8.756 -0.867 8.339
5 HG SER 10 HG SER 10 -9.564 1.242 7.841
6 H CYS 11 H CYS 11 -8.697 -3.380 4.702
7 HA CYS 11 HA CYS 11 -10.378 -2.249 2.612
8 1HB CYS 11 1HB CYS 11 -7.628 -1.827 2.684
9 2HB CYS 11 2HB CYS 11 -7.702 -3.321 1.794
10 HA PRO 12 HA PRO 12 -11.002 -6.696 2.167
11 1HB PRO 12 1HB PRO 12 -9.531 -7.098 -0.429
12 2HB PRO 12 2HB PRO 12 -11.239 -7.478 -0.057
13 1HG PRO 12 1HG PRO 12 -10.571 -5.347 -1.629
14 2HG PRO 12 2HG PRO 12 -11.922 -5.253 -0.451
15 1HD PRO 12 1HD PRO 12 -9.069 -4.296 -0.108
16 2HD PRO 12 2HD PRO 12 -10.586 -3.421 0.238
17 HA PRO 13 HA PRO 13 -7.250 -8.618 3.589
18 1HB PRO 13 1HB PRO 13 -7.429 -11.288 3.021
19 2HB PRO 13 2HB PRO 13 -8.485 -10.492 4.232
20 1HG PRO 13 1HG PRO 13 -9.090 -11.073 1.323
21 2HG PRO 13 2HG PRO 13 -10.107 -11.456 2.753
22 1HD PRO 13 1HD PRO 13 -10.531 -9.238 1.241
23 2HD PRO 13 2HD PRO 13 -10.732 -9.178 3.020
24 H GLY 14 H GLY 14 -5.303 -9.102 3.052
25 1HA GLY 14 1HA GLY 14 -3.381 -9.049 1.817
26 2HA GLY 14 2HA GLY 14 -4.250 -9.730 0.448
27 H GLN 15 H GLN 15 -5.308 -6.584 1.821
28 HA GLN 15 HA GLN 15 -3.932 -5.079 -0.274
29 1HB GLN 15 1HB GLN 15 -6.872 -5.383 0.012
30 2HB GLN 15 2HB GLN 15 -6.257 -3.756 -0.308
31 1HG GLN 15 1HG GLN 15 -5.247 -4.354 -2.340
32 2HG GLN 15 2HG GLN 15 -5.232 -6.077 -1.954
33 1HE2 GLN 15 2HE2 GLN 15 -7.249 -7.271 -1.932
34 2HE2 GLN 15 1HE2 GLN 15 -8.491 -6.724 -3.052
35 H PHE 16 H PHE 16 -2.955 -3.466 0.567
36 HA PHE 16 HA PHE 16 -3.822 -2.237 3.193
37 1HB PHE 16 1HB PHE 16 -1.629 -2.066 3.955
38 2HB PHE 16 2HB PHE 16 -1.683 -3.667 3.258
39 HD1 PHE 16 HD1 PHE 16 -0.835 -3.880 0.794
40 HD2 PHE 16 HD2 PHE 16 0.046 -0.507 3.293
41 HE1 PHE 16 HE1 PHE 16 1.031 -3.269 -0.706
42 HE2 PHE 16 HE2 PHE 16 1.840 0.184 1.736
43 HZ PHE 16 HZ PHE 16 2.335 -1.251 -0.310
44 H ARG 17 H ARG 17 -3.040 0.082 3.507
45 HA ARG 17 HA ARG 17 -2.959 1.560 0.910
46 1HB ARG 17 1HB ARG 17 -3.797 3.482 1.990
47 2HB ARG 17 2HB ARG 17 -4.878 2.093 2.262
48 1HG ARG 17 1HG ARG 17 -4.011 1.878 4.586
49 2HG ARG 17 2HG ARG 17 -2.926 3.250 4.305
50 1HD ARG 17 1HD ARG 17 -4.859 4.062 5.503
51 2HD ARG 17 2HD ARG 17 -4.883 4.712 3.869
52 HE ARG 17 HE ARG 17 -6.821 3.522 3.377
53 1HH1 ARG 17 1HH2 ARG 17 -5.786 2.423 6.566
54 2HH1 ARG 17 2HH2 ARG 17 -7.318 1.574 6.767
55 1HH2 ARG 17 1HH1 ARG 17 -8.556 2.316 3.707
56 2HH2 ARG 17 2HH1 ARG 17 -8.766 1.458 5.232
57 H CYS 18 H CYS 18 -1.585 3.099 0.496
58 HA CYS 18 HA CYS 18 1.096 2.695 1.615
59 1HB CYS 18 1HB CYS 18 -0.104 3.868 -0.877
60 2HB CYS 18 2HB CYS 18 1.534 4.322 -0.421
61 H SER 19 H SER 19 0.138 5.651 0.313
62 HA SER 19 HA SER 19 1.515 7.084 2.540
63 1HB SER 19 1HB SER 19 1.469 7.794 -0.417
64 2HB SER 19 2HB SER 19 2.410 8.619 0.842
65 HG SER 19 HG SER 19 2.991 6.371 -0.526
66 H GLU 20 H GLU 20 -1.121 6.679 2.539
67 HA GLU 20 HA GLU 20 -2.049 9.407 3.230
68 1HB GLU 20 1HB GLU 20 -2.991 8.906 1.047
69 2HB GLU 20 2HB GLU 20 -3.730 7.428 1.661
70 1HG GLU 20 1HG GLU 20 -5.198 8.697 3.141
71 2HG GLU 20 2HG GLU 20 -4.326 10.193 2.796
72 HA PRO 21 HA PRO 21 -2.526 6.831 6.881
73 1HB PRO 21 1HB PRO 21 -3.193 8.727 8.734
74 2HB PRO 21 2HB PRO 21 -1.582 8.686 7.958
75 1HG PRO 21 1HG PRO 21 -4.003 10.336 7.116
76 2HG PRO 21 2HG PRO 21 -2.342 10.926 7.470
77 1HD PRO 21 1HD PRO 21 -3.119 10.373 4.928
78 2HD PRO 21 2HD PRO 21 -1.477 9.941 5.493
79 HA PRO 22 HA PRO 22 -6.836 5.872 7.726
80 1HB PRO 22 1HB PRO 22 -6.135 6.240 10.646
81 2HB PRO 22 2HB PRO 22 -7.089 4.930 9.874
82 1HG PRO 22 1HG PRO 22 -4.536 4.513 10.533
83 2HG PRO 22 2HG PRO 22 -5.125 3.965 8.926
84 1HD PRO 22 1HD PRO 22 -3.546 6.472 9.592
85 2HD PRO 22 2HD PRO 22 -3.297 5.303 8.256
86 H GLY 23 H GLY 23 -8.720 6.637 8.932
87 1HA GLY 23 1HA GLY 23 -10.312 8.354 9.293
88 2HA GLY 23 2HA GLY 23 -9.004 9.525 9.435
89 H ALA 24 H ALA 24 -8.142 8.130 6.723
90 HA ALA 24 HA ALA 24 -10.210 9.027 4.840
91 1HB ALA 24 1HB ALA 24 -7.248 9.631 4.505
92 2HB ALA 24 2HB ALA 24 -8.497 9.801 3.252
93 3HB ALA 24 3HB ALA 24 -8.562 10.817 4.714
94 H HIS 25 H HIS 25 -10.834 6.944 4.803
95 HA HIS 25 HA HIS 25 -9.563 4.527 4.612
96 1HB HIS 25 1HB HIS 25 -11.984 4.790 4.675
97 2HB HIS 25 2HB HIS 25 -12.010 5.500 3.077
98 HD1 HIS 25 HD1 HIS 25 -11.712 2.040 4.734
99 HD2 HIS 25 HD2 HIS 25 -11.685 3.951 0.964
100 HE1 HIS 25 HE1 HIS 25 -11.908 0.170 2.981
101 HE2 HIS 25 HE2 HIS 25 -11.913 1.324 0.671
102 H GLY 26 H GLY 26 -10.201 6.563 1.928
103 1HA GLY 26 1HA GLY 26 -9.079 7.016 -0.095
104 2HA GLY 26 2HA GLY 26 -7.672 6.286 0.680
105 H GLU 27 H GLU 27 -6.865 5.227 -1.020
106 HA GLU 27 HA GLU 27 -8.259 2.812 -1.982
107 1HB GLU 27 1HB GLU 27 -8.669 4.626 -3.705
108 2HB GLU 27 2HB GLU 27 -6.925 4.822 -3.869
109 1HG GLU 27 1HG GLU 27 -7.718 3.484 -5.696
110 2HG GLU 27 2HG GLU 27 -6.753 2.451 -4.655
111 H CYS 28 H CYS 28 -7.271 1.260 -1.690
112 HA CYS 28 HA CYS 28 -4.648 1.068 -0.603
113 1HB CYS 28 1HB CYS 28 -6.682 -1.031 -1.421
114 2HB CYS 28 2HB CYS 28 -5.530 -1.132 -0.137
115 H TYR 29 H TYR 29 -3.563 -1.154 -1.256
116 HA TYR 29 HA TYR 29 -3.440 -1.741 -4.120
117 1HB TYR 29 1HB TYR 29 -0.981 -0.945 -2.486
118 2HB TYR 29 2HB TYR 29 -0.927 -1.570 -4.117
119 HD1 TYR 29 HD1 TYR 29 -1.390 1.351 -1.994
120 HD2 TYR 29 HD2 TYR 29 -1.696 -0.089 -6.054
121 HE1 TYR 29 HE1 TYR 29 -1.492 3.703 -2.837
122 HE2 TYR 29 HE2 TYR 29 -1.777 2.241 -6.878
123 HH TYR 29 HH TYR 29 -1.757 4.458 -6.324
124 HA PRO 30 HA PRO 30 -3.034 -5.818 -2.419
125 1HB PRO 30 1HB PRO 30 -0.881 -6.476 -4.355
126 2HB PRO 30 2HB PRO 30 -2.441 -7.299 -4.079
127 1HG PRO 30 1HG PRO 30 -2.026 -5.740 -6.299
128 2HG PRO 30 2HG PRO 30 -3.601 -5.723 -5.439
129 1HD PRO 30 1HD PRO 30 -1.310 -3.758 -5.196
130 2HD PRO 30 2HD PRO 30 -3.054 -3.428 -5.390
131 H GLN 31 H GLN 31 -1.791 -6.927 -0.966
132 HA GLN 31 HA GLN 31 0.821 -5.840 -0.109
133 1HB GLN 31 1HB GLN 31 -0.758 -8.301 0.792
134 2HB GLN 31 2HB GLN 31 0.738 -7.753 1.552
135 1HG GLN 31 1HG GLN 31 -0.266 -5.706 2.314
136 2HG GLN 31 2HG GLN 31 -1.739 -5.993 1.388
137 1HE2 GLN 31 1HE2 GLN 31 0.063 -8.285 3.593
138 2HE2 GLN 31 2HE2 GLN 31 -1.343 -8.491 4.632
139 H ASP 32 H ASP 32 -0.054 -7.805 -2.596
140 HA ASP 32 HA ASP 32 2.411 -9.268 -2.927
141 1HB ASP 32 1HB ASP 32 0.141 -9.390 -4.239
142 2HB ASP 32 2HB ASP 32 0.689 -7.974 -5.089
143 H TRP 33 H TRP 33 1.297 -6.097 -3.413
144 HA TRP 33 HA TRP 33 3.898 -4.980 -4.198
145 1HB TRP 33 1HB TRP 33 1.298 -3.490 -3.974
146 2HB TRP 33 2HB TRP 33 2.804 -2.939 -4.654
147 HD1 TRP 33 HD1 TRP 33 2.184 -6.265 -6.138
148 HE1 TRP 33 HE1 TRP 33 0.948 -6.132 -8.371
149 HE3 TRP 33 HE3 TRP 33 0.923 -1.299 -6.069
150 HZ2 TRP 33 HZ2 TRP 33 -0.564 -4.187 -9.854
151 HZ3 TRP 33 HZ3 TRP 33 -0.408 -0.331 -7.940
152 HH2 TRP 33 HH2 TRP 33 -1.215 -1.772 -9.785
153 H LEU 34 H LEU 34 3.734 -6.109 -1.902
154 HA LEU 34 HA LEU 34 4.847 -3.919 -0.233
155 1HB LEU 34 1HB LEU 34 2.599 -4.715 0.711
156 2HB LEU 34 2HB LEU 34 3.326 -6.291 0.932
157 HG LEU 34 HG LEU 34 5.112 -5.135 2.382
158 1HD1 LEU 34 1HD1 LEU 34 3.011 -2.932 2.440
159 2HD1 LEU 34 2HD1 LEU 34 4.510 -3.003 3.393
160 3HD1 LEU 34 3HD1 LEU 34 4.583 -2.797 1.637
161 1HD2 LEU 34 1HD2 LEU 34 3.610 -5.093 4.358
162 2HD2 LEU 34 2HD2 LEU 34 2.193 -5.083 3.284
163 3HD2 LEU 34 3HD2 LEU 34 3.278 -6.495 3.326
164 H CYS 35 H CYS 35 6.944 -4.253 -0.504
165 HA CYS 35 HA CYS 35 8.888 -5.034 -1.112
166 1HB CYS 35 1HB CYS 35 8.966 -5.678 0.996
167 2HB CYS 35 2HB CYS 35 8.107 -7.182 0.787
168 H ASP 36 H ASP 36 7.775 -5.046 -3.188
169 HA ASP 36 HA ASP 36 7.369 -7.704 -4.514
170 1HB ASP 36 1HB ASP 36 5.824 -5.787 -4.999
171 2HB ASP 36 2HB ASP 36 7.187 -4.896 -5.664
172 H GLY 37 H GLY 37 9.822 -5.431 -3.818
173 1HA GLY 37 1HA GLY 37 12.141 -5.568 -4.375
174 2HA GLY 37 2HA GLY 37 11.741 -6.592 -5.770
175 H HIS 38 H HIS 38 9.641 -4.174 -5.538
176 HA HIS 38 HA HIS 38 10.866 -2.155 -7.293
177 1HB HIS 38 1HB HIS 38 10.037 -3.732 -8.864
178 2HB HIS 38 2HB HIS 38 8.603 -4.064 -7.931
179 HD1 HIS 38 HD1 HIS 38 9.880 -1.175 -10.208
180 HD2 HIS 38 HD2 HIS 38 6.515 -2.574 -8.082
181 HE1 HIS 38 HE1 HIS 38 7.924 0.423 -10.767
182 HE2 HIS 38 HE2 HIS 38 5.857 -0.473 -9.497
183 HA PRO 39 HA PRO 39 8.175 -0.041 -4.273
184 1HB PRO 39 1HB PRO 39 8.636 2.555 -5.242
185 2HB PRO 39 2HB PRO 39 9.384 1.722 -3.875
186 1HG PRO 39 1HG PRO 39 10.707 2.417 -6.358
187 2HG PRO 39 2HG PRO 39 11.368 1.463 -4.997
188 1HD PRO 39 1HD PRO 39 10.203 0.518 -7.571
189 2HD PRO 39 2HD PRO 39 11.366 -0.296 -6.495
190 H ASP 40 H ASP 40 6.158 0.953 -4.341
191 HA ASP 40 HA ASP 40 5.176 2.109 -6.893
192 1HB ASP 40 1HB ASP 40 4.679 -0.592 -6.503
193 2HB ASP 40 2HB ASP 40 3.227 0.130 -5.835
194 H CYS 41 H CYS 41 5.552 2.461 -3.710
195 HA CYS 41 HA CYS 41 2.872 2.860 -2.916
196 1HB CYS 41 1HB CYS 41 5.287 2.631 -1.591
197 2HB CYS 41 2HB CYS 41 4.539 4.088 -0.981
198 H ASP 42 H ASP 42 3.771 4.665 -4.919
199 HA ASP 42 HA ASP 42 4.386 6.721 -5.584
200 1HB ASP 42 1HB ASP 42 1.887 7.002 -5.269
201 2HB ASP 42 2HB ASP 42 2.221 7.773 -3.719
202 H ASP 43 H ASP 43 5.037 5.966 -2.566
203 HA ASP 43 HA ASP 43 7.278 7.860 -2.489
204 1HB ASP 43 1HB ASP 43 5.427 8.028 -0.652
205 2HB ASP 43 2HB ASP 43 6.213 6.597 -0.017
206 H GLY 44 H GLY 44 6.422 4.857 -3.095
207 1HA GLY 44 1HA GLY 44 7.607 2.764 -3.181
208 2HA GLY 44 2HA GLY 44 9.080 3.650 -2.847
209 H ARG 45 H ARG 45 6.479 3.736 -0.660
210 HA ARG 45 HA ARG 45 8.248 2.655 1.490
211 1HB ARG 45 1HB ARG 45 6.844 3.598 3.148
212 2HB ARG 45 2HB ARG 45 7.245 4.842 1.974
213 1HG ARG 45 1HG ARG 45 5.004 4.724 1.003
214 2HG ARG 45 2HG ARG 45 4.601 3.325 2.017
215 1HD ARG 45 1HD ARG 45 3.585 5.306 2.942
216 2HD ARG 45 2HD ARG 45 4.841 4.705 4.038
217 HE ARG 45 HE ARG 45 5.774 6.778 2.182
218 1HH1 ARG 45 2HH2 ARG 45 4.147 6.422 5.260
219 2HH1 ARG 45 1HH2 ARG 45 4.687 7.989 5.811
220 1HH2 ARG 45 1HH1 ARG 45 6.468 8.654 2.931
221 2HH2 ARG 45 2HH1 ARG 45 5.963 9.256 4.507
222 H ASP 46 H ASP 46 6.503 1.224 -0.721
223 HA ASP 46 HA ASP 46 5.246 -0.729 0.965
224 1HB ASP 46 1HB ASP 46 4.968 -1.915 -1.168
225 2HB ASP 46 2HB ASP 46 4.154 -0.358 -1.181
226 H GLU 47 H GLU 47 8.174 0.014 -0.752
227 HA GLU 47 HA GLU 47 9.261 -2.654 -0.539
228 1HB GLU 47 1HB GLU 47 10.437 0.065 -1.172
229 2HB GLU 47 2HB GLU 47 11.430 -1.377 -1.150
230 1HG GLU 47 1HG GLU 47 8.877 -1.335 -2.772
231 2HG GLU 47 2HG GLU 47 10.333 -0.563 -3.362
232 H TRP 48 H TRP 48 9.313 0.191 1.333
233 HA TRP 48 HA TRP 48 11.753 -0.009 2.626
234 1HB TRP 48 1HB TRP 48 9.286 1.365 3.696
235 2HB TRP 48 2HB TRP 48 10.926 1.581 4.284
236 HD1 TRP 48 HD1 TRP 48 11.245 1.612 0.616
237 HE1 TRP 48 HE1 TRP 48 10.886 3.911 -0.377
238 HE3 TRP 48 HE3 TRP 48 9.606 3.918 4.786
239 HZ2 TRP 48 HZ2 TRP 48 10.136 6.617 0.628
240 HZ3 TRP 48 HZ3 TRP 48 9.097 6.403 4.805
241 HH2 TRP 48 HH2 TRP 48 9.378 7.724 2.722
242 H GLY 49 H GLY 49 12.439 -1.426 3.666
243 1HA GLY 49 1HA GLY 49 13.020 -2.736 5.563
244 2HA GLY 49 2HA GLY 49 11.516 -2.216 6.328
245 H CYS 50 H CYS 50 10.661 -3.473 3.297
246 HA CYS 50 HA CYS 50 9.206 -5.070 2.847
247 1HB CYS 50 1HB CYS 50 11.461 -5.534 2.102
248 2HB CYS 50 2HB CYS 50 11.835 -6.328 3.601
249 H GLY 51 H GLY 51 9.015 -4.505 5.724
250 1HA GLY 51 1HA GLY 51 6.850 -5.906 6.624
251 2HA GLY 51 2HA GLY 51 8.156 -7.023 7.025
Start of MODEL 9
1 H SER 10 H SER 10 -5.987 -0.520 5.284
2 HA SER 10 HA SER 10 -6.784 -3.087 6.458
3 1HB SER 10 1HB SER 10 -7.565 -0.419 7.719
4 2HB SER 10 2HB SER 10 -8.339 -1.978 8.051
5 HG SER 10 HG SER 10 -6.736 -1.461 9.604
6 H CYS 11 H CYS 11 -7.622 -3.624 4.610
7 HA CYS 11 HA CYS 11 -9.762 -2.123 3.262
8 1HB CYS 11 1HB CYS 11 -7.111 -1.879 2.580
9 2HB CYS 11 2HB CYS 11 -7.512 -3.296 1.646
10 HA PRO 12 HA PRO 12 -10.834 -6.528 2.549
11 1HB PRO 12 1HB PRO 12 -9.639 -6.956 -0.182
12 2HB PRO 12 2HB PRO 12 -11.318 -7.271 0.348
13 1HG PRO 12 1HG PRO 12 -10.711 -5.144 -1.250
14 2HG PRO 12 2HG PRO 12 -11.940 -5.017 0.052
15 1HD PRO 12 1HD PRO 12 -9.040 -4.160 0.121
16 2HD PRO 12 2HD PRO 12 -10.497 -3.265 0.649
17 HA PRO 13 HA PRO 13 -7.120 -8.699 3.616
18 1HB PRO 13 1HB PRO 13 -7.481 -11.335 2.976
19 2HB PRO 13 2HB PRO 13 -8.388 -10.527 4.295
20 1HG PRO 13 1HG PRO 13 -9.261 -10.968 1.431
21 2HG PRO 13 2HG PRO 13 -10.177 -11.353 2.929
22 1HD PRO 13 1HD PRO 13 -10.612 -9.066 1.540
23 2HD PRO 13 2HD PRO 13 -10.640 -9.052 3.331
24 H GLY 14 H GLY 14 -5.251 -9.239 2.919
25 1HA GLY 14 1HA GLY 14 -3.419 -9.273 1.539
26 2HA GLY 14 2HA GLY 14 -4.433 -9.840 0.218
27 H GLN 15 H GLN 15 -5.337 -6.713 1.673
28 HA GLN 15 HA GLN 15 -3.892 -5.185 -0.359
29 1HB GLN 15 1HB GLN 15 -6.851 -5.359 -0.004
30 2HB GLN 15 2HB GLN 15 -6.141 -3.782 -0.371
31 1HG GLN 15 1HG GLN 15 -5.313 -4.424 -2.443
32 2HG GLN 15 2HG GLN 15 -5.241 -6.137 -2.023
33 1HE2 GLN 15 1HE2 GLN 15 -7.354 -7.256 -1.623
34 2HE2 GLN 15 2HE2 GLN 15 -8.575 -6.869 -2.831
35 H PHE 16 H PHE 16 -2.996 -3.515 0.480
36 HA PHE 16 HA PHE 16 -3.879 -2.358 3.132
37 1HB PHE 16 1HB PHE 16 -1.688 -2.166 3.934
38 2HB PHE 16 2HB PHE 16 -1.726 -3.766 3.232
39 HD1 PHE 16 HD1 PHE 16 -0.019 -0.592 3.293
40 HD2 PHE 16 HD2 PHE 16 -0.864 -3.962 0.784
41 HE1 PHE 16 HE1 PHE 16 1.776 0.121 1.744
42 HE2 PHE 16 HE2 PHE 16 0.995 -3.329 -0.718
43 HZ PHE 16 HZ PHE 16 2.276 -1.299 -0.315
44 H ARG 17 H ARG 17 -3.199 -0.046 3.501
45 HA ARG 17 HA ARG 17 -2.995 1.479 0.933
46 1HB ARG 17 1HB ARG 17 -3.869 3.392 2.025
47 2HB ARG 17 2HB ARG 17 -4.960 1.996 2.198
48 1HG ARG 17 1HG ARG 17 -4.230 1.707 4.549
49 2HG ARG 17 2HG ARG 17 -3.115 3.070 4.379
50 1HD ARG 17 1HD ARG 17 -5.146 3.815 5.512
51 2HD ARG 17 2HD ARG 17 -4.988 4.598 3.943
52 HE ARG 17 HE ARG 17 -6.946 3.599 3.220
53 1HH1 ARG 17 2HH1 ARG 17 -6.107 1.942 6.202
54 2HH1 ARG 17 1HH1 ARG 17 -7.592 1.008 6.121
55 1HH2 ARG 17 1HH2 ARG 17 -8.674 2.325 3.192
56 2HH2 ARG 17 2HH2 ARG 17 -8.883 1.077 4.419
57 H CYS 18 H CYS 18 -1.615 3.030 0.588
58 HA CYS 18 HA CYS 18 1.036 2.591 1.745
59 1HB CYS 18 1HB CYS 18 -0.127 3.867 -0.716
60 2HB CYS 18 2HB CYS 18 1.511 4.287 -0.226
61 H SER 19 H SER 19 0.108 5.591 0.527
62 HA SER 19 HA SER 19 1.487 6.948 2.797
63 1HB SER 19 1HB SER 19 1.450 7.741 -0.141
64 2HB SER 19 2HB SER 19 2.423 8.497 1.139
65 HG SER 19 HG SER 19 2.964 6.320 -0.328
66 H GLU 20 H GLU 20 -1.161 6.589 2.773
67 HA GLU 20 HA GLU 20 -2.093 9.343 3.399
68 1HB GLU 20 1HB GLU 20 -2.934 8.790 1.176
69 2HB GLU 20 2HB GLU 20 -3.750 7.359 1.814
70 1HG GLU 20 1HG GLU 20 -5.225 8.748 3.183
71 2HG GLU 20 2HG GLU 20 -4.276 10.190 2.816
72 HA PRO 21 HA PRO 21 -2.792 6.843 7.074
73 1HB PRO 21 1HB PRO 21 -3.470 8.806 8.864
74 2HB PRO 21 2HB PRO 21 -1.822 8.646 8.186
75 1HG PRO 21 1HG PRO 21 -4.069 10.450 7.208
76 2HG PRO 21 2HG PRO 21 -2.382 10.913 7.613
77 1HD PRO 21 1HD PRO 21 -3.126 10.374 5.052
78 2HD PRO 21 2HD PRO 21 -1.530 9.857 5.675
79 HA PRO 22 HA PRO 22 -7.133 5.963 7.707
80 1HB PRO 22 1HB PRO 22 -6.649 6.440 10.655
81 2HB PRO 22 2HB PRO 22 -7.539 5.099 9.863
82 1HG PRO 22 1HG PRO 22 -5.038 4.715 10.714
83 2HG PRO 22 2HG PRO 22 -5.508 4.115 9.087
84 1HD PRO 22 1HD PRO 22 -3.991 6.648 9.789
85 2HD PRO 22 2HD PRO 22 -3.645 5.443 8.509
86 H GLY 23 H GLY 23 -9.113 6.729 8.746
87 1HA GLY 23 1HA GLY 23 -10.780 8.376 8.891
88 2HA GLY 23 2HA GLY 23 -9.537 9.573 9.255
89 H ALA 24 H ALA 24 -8.245 8.518 6.603
90 HA ALA 24 HA ALA 24 -10.060 9.670 4.553
91 1HB ALA 24 1HB ALA 24 -8.060 10.591 3.418
92 2HB ALA 24 2HB ALA 24 -8.296 11.310 5.023
93 3HB ALA 24 3HB ALA 24 -7.044 10.073 4.780
94 H HIS 25 H HIS 25 -10.758 7.471 4.456
95 HA HIS 25 HA HIS 25 -9.360 5.179 4.461
96 1HB HIS 25 1HB HIS 25 -11.900 5.758 2.880
97 2HB HIS 25 2HB HIS 25 -11.371 4.191 3.455
98 HD1 HIS 25 HD1 HIS 25 -13.701 6.784 4.448
99 HD2 HIS 25 HD2 HIS 25 -10.894 4.288 6.401
100 HE1 HIS 25 HE1 HIS 25 -14.354 6.755 6.940
101 HE2 HIS 25 HE2 HIS 25 -12.655 5.227 8.124
102 H GLY 26 H GLY 26 -9.916 7.006 1.611
103 1HA GLY 26 1HA GLY 26 -8.788 7.125 -0.439
104 2HA GLY 26 2HA GLY 26 -7.469 6.317 0.412
105 H GLU 27 H GLU 27 -6.847 5.230 -1.388
106 HA GLU 27 HA GLU 27 -8.323 2.756 -2.029
107 1HB GLU 27 1HB GLU 27 -8.861 4.422 -3.859
108 2HB GLU 27 2HB GLU 27 -7.134 4.606 -4.162
109 1HG GLU 27 1HG GLU 27 -8.048 3.129 -5.818
110 2HG GLU 27 2HG GLU 27 -7.002 2.182 -4.772
111 H CYS 28 H CYS 28 -7.315 1.225 -1.694
112 HA CYS 28 HA CYS 28 -4.653 1.102 -0.721
113 1HB CYS 28 1HB CYS 28 -6.740 -1.016 -1.344
114 2HB CYS 28 2HB CYS 28 -5.485 -1.103 -0.159
115 H TYR 29 H TYR 29 -3.613 -1.208 -1.301
116 HA TYR 29 HA TYR 29 -3.480 -1.802 -4.166
117 1HB TYR 29 1HB TYR 29 -1.026 -1.035 -2.514
118 2HB TYR 29 2HB TYR 29 -0.968 -1.626 -4.154
119 HD1 TYR 29 HD1 TYR 29 -1.793 -0.084 -6.064
120 HD2 TYR 29 HD2 TYR 29 -1.335 1.245 -1.978
121 HE1 TYR 29 HE1 TYR 29 -1.852 2.265 -6.824
122 HE2 TYR 29 HE2 TYR 29 -1.410 3.618 -2.760
123 HH TYR 29 HH TYR 29 -1.773 4.466 -6.216
124 HA PRO 30 HA PRO 30 -3.074 -5.894 -2.499
125 1HB PRO 30 1HB PRO 30 -0.897 -6.496 -4.438
126 2HB PRO 30 2HB PRO 30 -2.437 -7.360 -4.167
127 1HG PRO 30 1HG PRO 30 -2.078 -5.782 -6.371
128 2HG PRO 30 2HG PRO 30 -3.642 -5.781 -5.488
129 1HD PRO 30 1HD PRO 30 -1.357 -3.805 -5.253
130 2HD PRO 30 2HD PRO 30 -3.101 -3.479 -5.446
131 H GLN 31 H GLN 31 -1.809 -7.045 -1.068
132 HA GLN 31 HA GLN 31 0.769 -5.910 -0.160
133 1HB GLN 31 1HB GLN 31 -0.763 -8.423 0.692
134 2HB GLN 31 2HB GLN 31 0.698 -7.832 1.484
135 1HG GLN 31 1HG GLN 31 -0.412 -5.808 2.219
136 2HG GLN 31 2HG GLN 31 -1.877 -6.214 1.322
137 1HE2 GLN 31 1HE2 GLN 31 -3.201 -6.144 3.297
138 2HE2 GLN 31 2HE2 GLN 31 -3.023 -7.446 4.462
139 H ASP 32 H ASP 32 -0.076 -7.862 -2.682
140 HA ASP 32 HA ASP 32 2.405 -9.291 -3.015
141 1HB ASP 32 1HB ASP 32 0.138 -9.412 -4.339
142 2HB ASP 32 2HB ASP 32 0.689 -7.989 -5.175
143 H TRP 33 H TRP 33 1.262 -6.123 -3.460
144 HA TRP 33 HA TRP 33 3.851 -4.977 -4.233
145 1HB TRP 33 1HB TRP 33 1.238 -3.512 -3.987
146 2HB TRP 33 2HB TRP 33 2.740 -2.935 -4.655
147 HD1 TRP 33 HD1 TRP 33 2.133 -6.250 -6.186
148 HE1 TRP 33 HE1 TRP 33 0.915 -6.081 -8.428
149 HE3 TRP 33 HE3 TRP 33 0.872 -1.285 -6.048
150 HZ2 TRP 33 HZ2 TRP 33 -0.585 -4.110 -9.892
151 HZ3 TRP 33 HZ3 TRP 33 -0.442 -0.285 -7.914
152 HH2 TRP 33 HH2 TRP 33 -1.237 -1.696 -9.787
153 H LEU 34 H LEU 34 3.688 -6.134 -1.938
154 HA LEU 34 HA LEU 34 4.788 -3.957 -0.244
155 1HB LEU 34 1HB LEU 34 2.536 -4.757 0.679
156 2HB LEU 34 2HB LEU 34 3.256 -6.337 0.889
157 HG LEU 34 HG LEU 34 5.030 -5.215 2.370
158 1HD1 LEU 34 1HD1 LEU 34 4.557 -2.863 1.640
159 2HD1 LEU 34 2HD1 LEU 34 2.969 -2.976 2.416
160 3HD1 LEU 34 3HD1 LEU 34 4.450 -3.082 3.391
161 1HD2 LEU 34 1HD2 LEU 34 3.503 -5.156 4.328
162 2HD2 LEU 34 2HD2 LEU 34 2.101 -5.119 3.237
163 3HD2 LEU 34 3HD2 LEU 34 3.162 -6.547 3.287
164 H CYS 35 H CYS 35 6.889 -4.288 -0.514
165 HA CYS 35 HA CYS 35 8.829 -5.070 -1.134
166 1HB CYS 35 1HB CYS 35 8.907 -5.732 0.971
167 2HB CYS 35 2HB CYS 35 8.048 -7.230 0.749
168 H ASP 36 H ASP 36 7.719 -5.057 -3.204
169 HA ASP 36 HA ASP 36 7.294 -7.698 -4.560
170 1HB ASP 36 1HB ASP 36 5.754 -5.775 -5.023
171 2HB ASP 36 2HB ASP 36 7.117 -4.874 -5.672
172 H GLY 37 H GLY 37 9.751 -5.433 -3.848
173 1HA GLY 37 1HA GLY 37 12.070 -5.566 -4.418
174 2HA GLY 37 2HA GLY 37 11.664 -6.571 -5.821
175 H HIS 38 H HIS 38 9.565 -4.151 -5.551
176 HA HIS 38 HA HIS 38 10.794 -2.107 -7.273
177 1HB HIS 38 1HB HIS 38 9.981 -3.658 -8.876
178 2HB HIS 38 2HB HIS 38 8.542 -4.014 -7.960
179 HD1 HIS 38 HD1 HIS 38 9.821 -1.063 -10.164
180 HD2 HIS 38 HD2 HIS 38 6.454 -2.534 -8.095
181 HE1 HIS 38 HE1 HIS 38 7.861 0.541 -10.688
182 HE2 HIS 38 HE2 HIS 38 5.791 -0.403 -9.461
183 HA PRO 39 HA PRO 39 8.094 -0.025 -4.254
184 1HB PRO 39 1HB PRO 39 8.513 2.581 -5.160
185 2HB PRO 39 2HB PRO 39 9.346 1.716 -3.865
186 1HG PRO 39 1HG PRO 39 10.437 2.461 -6.484
187 2HG PRO 39 2HG PRO 39 11.276 1.662 -5.124
188 1HD PRO 39 1HD PRO 39 10.156 0.479 -7.581
189 2HD PRO 39 2HD PRO 39 11.280 -0.248 -6.408
190 H ASP 40 H ASP 40 6.081 0.978 -4.288
191 HA ASP 40 HA ASP 40 5.088 2.185 -6.808
192 1HB ASP 40 1HB ASP 40 4.553 -0.529 -6.442
193 2HB ASP 40 2HB ASP 40 3.102 0.224 -5.810
194 H CYS 41 H CYS 41 5.490 2.476 -3.624
195 HA CYS 41 HA CYS 41 2.820 2.887 -2.802
196 1HB CYS 41 1HB CYS 41 5.249 2.627 -1.500
197 2HB CYS 41 2HB CYS 41 4.500 4.070 -0.859
198 H ASP 42 H ASP 42 3.723 4.711 -4.787
199 HA ASP 42 HA ASP 42 4.355 6.769 -5.429
200 1HB ASP 42 1HB ASP 42 1.863 7.071 -5.098
201 2HB ASP 42 2HB ASP 42 2.212 7.819 -3.540
202 H ASP 43 H ASP 43 5.014 5.966 -2.425
203 HA ASP 43 HA ASP 43 7.261 7.850 -2.311
204 1HB ASP 43 1HB ASP 43 5.414 7.949 -0.459
205 2HB ASP 43 2HB ASP 43 6.212 6.504 0.126
206 H GLY 44 H GLY 44 6.389 4.853 -2.988
207 1HA GLY 44 1HA GLY 44 7.555 2.754 -3.111
208 2HA GLY 44 2HA GLY 44 9.040 3.623 -2.782
209 H ARG 45 H ARG 45 6.454 3.701 -0.566
210 HA ARG 45 HA ARG 45 8.245 2.587 1.547
211 1HB ARG 45 1HB ARG 45 6.871 3.513 3.234
212 2HB ARG 45 2HB ARG 45 7.233 4.774 2.065
213 1HG ARG 45 1HG ARG 45 4.973 4.637 1.141
214 2HG ARG 45 2HG ARG 45 4.612 3.218 2.137
215 1HD ARG 45 1HD ARG 45 3.574 5.148 3.117
216 2HD ARG 45 2HD ARG 45 4.873 4.579 4.178
217 HE ARG 45 HE ARG 45 5.762 6.672 2.351
218 1HH1 ARG 45 2HH1 ARG 45 3.986 6.323 5.345
219 2HH1 ARG 45 1HH1 ARG 45 4.429 7.926 5.880
220 1HH2 ARG 45 2HH2 ARG 45 6.343 8.584 3.082
221 2HH2 ARG 45 1HH2 ARG 45 5.728 9.212 4.610
222 H ASP 46 H ASP 46 6.459 1.193 -0.665
223 HA ASP 46 HA ASP 46 5.210 -0.775 1.007
224 1HB ASP 46 1HB ASP 46 4.918 -1.939 -1.139
225 2HB ASP 46 2HB ASP 46 4.110 -0.380 -1.130
226 H GLU 47 H GLU 47 8.127 -0.026 -0.724
227 HA GLU 47 HA GLU 47 9.216 -2.692 -0.534
228 1HB GLU 47 1HB GLU 47 10.383 0.030 -1.174
229 2HB GLU 47 2HB GLU 47 11.372 -1.413 -1.178
230 1HG GLU 47 1HG GLU 47 8.793 -1.342 -2.761
231 2HG GLU 47 2HG GLU 47 10.250 -0.589 -3.369
232 H TRP 48 H TRP 48 9.293 0.151 1.343
233 HA TRP 48 HA TRP 48 11.766 -0.060 2.588
234 1HB TRP 48 1HB TRP 48 9.334 1.332 3.711
235 2HB TRP 48 2HB TRP 48 10.990 1.530 4.263
236 HD1 TRP 48 HD1 TRP 48 11.239 1.573 0.593
237 HE1 TRP 48 HE1 TRP 48 10.891 3.884 -0.384
238 HE3 TRP 48 HE3 TRP 48 9.687 3.872 4.798
239 HZ2 TRP 48 HZ2 TRP 48 10.188 6.593 0.650
240 HZ3 TRP 48 HZ3 TRP 48 9.211 6.365 4.840
241 HH2 TRP 48 HH2 TRP 48 9.478 7.696 2.760
242 H GLY 49 H GLY 49 12.454 -1.496 3.611
243 1HA GLY 49 1HA GLY 49 13.049 -2.826 5.492
244 2HA GLY 49 2HA GLY 49 11.570 -2.280 6.290
245 H CYS 50 H CYS 50 10.680 -3.523 3.243
246 HA CYS 50 HA CYS 50 9.184 -5.101 2.812
247 1HB CYS 50 1HB CYS 50 11.427 -5.596 2.050
248 2HB CYS 50 2HB CYS 50 11.802 -6.395 3.548
249 H GLY 51 H GLY 51 8.872 -4.453 5.576
250 1HA GLY 51 1HA GLY 51 6.791 -6.101 6.443
251 2HA GLY 51 2HA GLY 51 8.234 -6.840 7.140
Start of MODEL 10
1 H SER 10 H SER 10 -5.909 -1.151 5.953
2 HA SER 10 HA SER 10 -7.708 -3.186 6.978
3 1HB SER 10 1HB SER 10 -7.873 -0.335 8.058
4 2HB SER 10 2HB SER 10 -9.252 -1.447 8.060
5 HG SER 10 HG SER 10 -6.773 -2.241 9.164
6 H CYS 11 H CYS 11 -8.135 -3.662 5.014
7 HA CYS 11 HA CYS 11 -9.891 -2.044 3.356
8 1HB CYS 11 1HB CYS 11 -7.165 -1.865 3.081
9 2HB CYS 11 2HB CYS 11 -7.458 -3.247 2.062
10 HA PRO 12 HA PRO 12 -10.961 -6.424 2.429
11 1HB PRO 12 1HB PRO 12 -9.660 -6.719 -0.250
12 2HB PRO 12 2HB PRO 12 -11.375 -6.973 0.182
13 1HG PRO 12 1HG PRO 12 -10.567 -4.797 -1.270
14 2HG PRO 12 2HG PRO 12 -11.883 -4.693 -0.056
15 1HD PRO 12 1HD PRO 12 -8.968 -3.950 0.271
16 2HD PRO 12 2HD PRO 12 -10.429 -3.029 0.738
17 HA PRO 13 HA PRO 13 -7.269 -8.649 3.501
18 1HB PRO 13 1HB PRO 13 -7.592 -11.242 2.681
19 2HB PRO 13 2HB PRO 13 -8.561 -10.520 4.005
20 1HG PRO 13 1HG PRO 13 -9.309 -10.795 1.083
21 2HG PRO 13 2HG PRO 13 -10.286 -11.259 2.517
22 1HD PRO 13 1HD PRO 13 -10.649 -8.895 1.228
23 2HD PRO 13 2HD PRO 13 -10.784 -8.989 3.012
24 H GLY 14 H GLY 14 -5.370 -9.252 2.871
25 1HA GLY 14 1HA GLY 14 -3.462 -9.153 1.620
26 2HA GLY 14 2HA GLY 14 -4.383 -9.730 0.233
27 H GLN 15 H GLN 15 -5.282 -6.624 1.774
28 HA GLN 15 HA GLN 15 -3.900 -5.066 -0.285
29 1HB GLN 15 1HB GLN 15 -6.843 -5.270 0.126
30 2HB GLN 15 2HB GLN 15 -6.167 -3.671 -0.202
31 1HG GLN 15 1HG GLN 15 -5.348 -4.246 -2.305
32 2HG GLN 15 2HG GLN 15 -5.268 -5.969 -1.937
33 1HE2 GLN 15 2HE2 GLN 15 -7.384 -7.103 -1.540
34 2HE2 GLN 15 1HE2 GLN 15 -8.610 -6.685 -2.732
35 H PHE 16 H PHE 16 -2.977 -3.412 0.518
36 HA PHE 16 HA PHE 16 -3.808 -2.191 3.158
37 1HB PHE 16 1HB PHE 16 -1.613 -2.043 3.953
38 2HB PHE 16 2HB PHE 16 -1.674 -3.649 3.264
39 HD1 PHE 16 HD1 PHE 16 -0.839 -3.865 0.800
40 HD2 PHE 16 HD2 PHE 16 0.078 -0.498 3.291
41 HE1 PHE 16 HE1 PHE 16 1.002 -3.254 -0.731
42 HE2 PHE 16 HE2 PHE 16 1.848 0.196 1.714
43 HZ PHE 16 HZ PHE 16 2.309 -1.236 -0.350
44 H ARG 17 H ARG 17 -3.118 0.116 3.467
45 HA ARG 17 HA ARG 17 -2.883 1.588 0.881
46 1HB ARG 17 1HB ARG 17 -3.748 3.527 1.972
47 2HB ARG 17 2HB ARG 17 -4.856 2.143 2.107
48 1HG ARG 17 1HG ARG 17 -4.137 1.805 4.469
49 2HG ARG 17 2HG ARG 17 -3.053 3.195 4.331
50 1HD ARG 17 1HD ARG 17 -5.117 3.852 5.461
51 2HD ARG 17 2HD ARG 17 -4.951 4.690 3.922
52 HE ARG 17 HE ARG 17 -6.882 3.683 3.144
53 1HH1 ARG 17 1HH1 ARG 17 -6.015 1.844 6.025
54 2HH1 ARG 17 2HH1 ARG 17 -7.471 0.868 5.840
55 1HH2 ARG 17 1HH2 ARG 17 -8.590 2.394 3.043
56 2HH2 ARG 17 2HH2 ARG 17 -8.803 1.103 4.228
57 H CYS 18 H CYS 18 -1.537 3.186 0.567
58 HA CYS 18 HA CYS 18 1.119 2.734 1.728
59 1HB CYS 18 1HB CYS 18 -0.028 3.952 -0.774
60 2HB CYS 18 2HB CYS 18 1.618 4.351 -0.295
61 H SER 19 H SER 19 0.223 5.709 0.416
62 HA SER 19 HA SER 19 1.591 7.135 2.633
63 1HB SER 19 1HB SER 19 2.343 8.719 0.802
64 2HB SER 19 2HB SER 19 2.906 7.052 0.634
65 HG SER 19 HG SER 19 1.983 7.007 -1.221
66 H GLU 20 H GLU 20 -1.060 6.706 2.636
67 HA GLU 20 HA GLU 20 -2.014 9.411 3.374
68 1HB GLU 20 1HB GLU 20 -2.890 8.965 1.145
69 2HB GLU 20 2HB GLU 20 -3.652 7.478 1.706
70 1HG GLU 20 1HG GLU 20 -5.151 8.734 3.176
71 2HG GLU 20 2HG GLU 20 -4.267 10.229 2.862
72 HA PRO 21 HA PRO 21 -2.688 6.767 6.958
73 1HB PRO 21 1HB PRO 21 -3.569 8.639 8.767
74 2HB PRO 21 2HB PRO 21 -1.884 8.587 8.167
75 1HG PRO 21 1HG PRO 21 -4.179 10.299 7.142
76 2HG PRO 21 2HG PRO 21 -2.534 10.833 7.625
77 1HD PRO 21 1HD PRO 21 -3.156 10.336 5.026
78 2HD PRO 21 2HD PRO 21 -1.559 9.884 5.691
79 HA PRO 22 HA PRO 22 -7.045 5.766 7.205
80 1HB PRO 22 1HB PRO 22 -7.460 5.025 9.816
81 2HB PRO 22 2HB PRO 22 -6.529 4.041 8.646
82 1HG PRO 22 1HG PRO 22 -5.453 6.028 10.675
83 2HG PRO 22 2HG PRO 22 -4.945 4.332 10.395
84 1HD PRO 22 1HD PRO 22 -3.595 6.409 9.289
85 2HD PRO 22 2HD PRO 22 -3.855 4.905 8.360
86 H GLY 23 H GLY 23 -9.058 6.271 8.470
87 1HA GLY 23 1HA GLY 23 -10.661 7.918 8.960
88 2HA GLY 23 2HA GLY 23 -9.374 9.050 9.368
89 H ALA 24 H ALA 24 -8.172 8.269 6.611
90 HA ALA 24 HA ALA 24 -10.098 9.486 4.702
91 1HB ALA 24 1HB ALA 24 -8.171 10.521 3.539
92 2HB ALA 24 2HB ALA 24 -8.353 11.143 5.191
93 3HB ALA 24 3HB ALA 24 -7.085 9.953 4.827
94 H HIS 25 H HIS 25 -10.738 7.250 4.539
95 HA HIS 25 HA HIS 25 -9.220 5.037 4.389
96 1HB HIS 25 1HB HIS 25 -11.894 5.518 3.007
97 2HB HIS 25 2HB HIS 25 -11.241 3.967 3.487
98 HD1 HIS 25 HD1 HIS 25 -13.600 6.432 4.748
99 HD2 HIS 25 HD2 HIS 25 -10.599 3.926 6.373
100 HE1 HIS 25 HE1 HIS 25 -14.089 6.243 7.270
101 HE2 HIS 25 HE2 HIS 25 -12.273 4.709 8.256
102 H GLY 26 H GLY 26 -10.095 6.891 1.631
103 1HA GLY 26 1HA GLY 26 -9.295 7.005 -0.572
104 2HA GLY 26 2HA GLY 26 -7.778 6.473 0.154
105 H GLU 27 H GLU 27 -7.079 5.249 -1.475
106 HA GLU 27 HA GLU 27 -8.380 2.616 -1.982
107 1HB GLU 27 1HB GLU 27 -9.028 4.153 -3.854
108 2HB GLU 27 2HB GLU 27 -7.319 4.451 -4.192
109 1HG GLU 27 1HG GLU 27 -6.988 2.071 -4.740
110 2HG GLU 27 2HG GLU 27 -8.648 1.705 -4.262
111 H CYS 28 H CYS 28 -7.285 1.265 -1.303
112 HA CYS 28 HA CYS 28 -4.568 1.167 -0.622
113 1HB CYS 28 1HB CYS 28 -6.699 -0.946 -1.111
114 2HB CYS 28 2HB CYS 28 -5.320 -1.123 -0.108
115 H TYR 29 H TYR 29 -3.554 -1.105 -1.256
116 HA TYR 29 HA TYR 29 -3.511 -1.703 -4.128
117 1HB TYR 29 1HB TYR 29 -1.019 -0.953 -2.523
118 2HB TYR 29 2HB TYR 29 -0.987 -1.555 -4.159
119 HD1 TYR 29 HD1 TYR 29 -1.828 -0.024 -6.068
120 HD2 TYR 29 HD2 TYR 29 -1.301 1.334 -1.999
121 HE1 TYR 29 HE1 TYR 29 -1.861 2.319 -6.848
122 HE2 TYR 29 HE2 TYR 29 -1.348 3.701 -2.802
123 HH TYR 29 HH TYR 29 -1.732 4.524 -6.261
124 HA PRO 30 HA PRO 30 -3.099 -5.793 -2.462
125 1HB PRO 30 1HB PRO 30 -0.952 -6.424 -4.425
126 2HB PRO 30 2HB PRO 30 -2.498 -7.270 -4.134
127 1HG PRO 30 1HG PRO 30 -2.143 -5.699 -6.347
128 2HG PRO 30 2HG PRO 30 -3.700 -5.688 -5.453
129 1HD PRO 30 1HD PRO 30 -1.405 -3.722 -5.246
130 2HD PRO 30 2HD PRO 30 -3.151 -3.390 -5.412
131 H GLN 31 H GLN 31 -1.835 -6.935 -1.040
132 HA GLN 31 HA GLN 31 0.764 -5.831 -0.157
133 1HB GLN 31 1HB GLN 31 -0.807 -8.311 0.720
134 2HB GLN 31 2HB GLN 31 0.683 -7.759 1.487
135 1HG GLN 31 1HG GLN 31 -0.362 -5.701 2.228
136 2HG GLN 31 2HG GLN 31 -1.854 -6.078 1.363
137 1HE2 GLN 31 1HE2 GLN 31 -3.141 -5.974 3.361
138 2HE2 GLN 31 2HE2 GLN 31 -2.968 -7.274 4.529
139 H ASP 32 H ASP 32 -0.117 -7.782 -2.668
140 HA ASP 32 HA ASP 32 2.340 -9.250 -3.008
141 1HB ASP 32 1HB ASP 32 0.070 -9.346 -4.321
142 2HB ASP 32 2HB ASP 32 0.623 -7.925 -5.156
143 H TRP 33 H TRP 33 1.246 -6.068 -3.458
144 HA TRP 33 HA TRP 33 3.854 -4.964 -4.239
145 1HB TRP 33 1HB TRP 33 1.263 -3.458 -3.998
146 2HB TRP 33 2HB TRP 33 2.768 -2.916 -4.687
147 HD1 TRP 33 HD1 TRP 33 2.099 -6.229 -6.188
148 HE1 TRP 33 HE1 TRP 33 0.842 -6.063 -8.409
149 HE3 TRP 33 HE3 TRP 33 0.885 -1.254 -6.055
150 HZ2 TRP 33 HZ2 TRP 33 -0.658 -4.084 -9.862
151 HZ3 TRP 33 HZ3 TRP 33 -0.449 -0.251 -7.907
152 HH2 TRP 33 HH2 TRP 33 -1.281 -1.663 -9.764
153 H LEU 34 H LEU 34 3.674 -6.103 -1.943
154 HA LEU 34 HA LEU 34 4.801 -3.931 -0.261
155 1HB LEU 34 1HB LEU 34 2.542 -4.704 0.671
156 2HB LEU 34 2HB LEU 34 3.249 -6.291 0.888
157 HG LEU 34 HG LEU 34 5.036 -5.178 2.358
158 1HD1 LEU 34 1HD1 LEU 34 4.584 -2.828 1.608
159 2HD1 LEU 34 2HD1 LEU 34 3.000 -2.917 2.394
160 3HD1 LEU 34 3HD1 LEU 34 4.486 -3.030 3.363
161 1HD2 LEU 34 1HD2 LEU 34 2.116 -5.035 3.241
162 2HD2 LEU 34 2HD2 LEU 34 3.149 -6.482 3.285
163 3HD2 LEU 34 3HD2 LEU 34 3.526 -5.095 4.320
164 H CYS 35 H CYS 35 6.896 -4.286 -0.517
165 HA CYS 35 HA CYS 35 8.841 -5.093 -1.110
166 1HB CYS 35 1HB CYS 35 8.871 -5.759 1.002
167 2HB CYS 35 2HB CYS 35 7.992 -7.240 0.766
168 H ASP 36 H ASP 36 7.735 -5.070 -3.197
169 HA ASP 36 HA ASP 36 7.325 -7.715 -4.546
170 1HB ASP 36 1HB ASP 36 5.790 -5.788 -5.026
171 2HB ASP 36 2HB ASP 36 7.160 -4.899 -5.676
172 H GLY 37 H GLY 37 9.785 -5.464 -3.812
173 1HA GLY 37 1HA GLY 37 12.104 -5.598 -4.364
174 2HA GLY 37 2HA GLY 37 11.710 -6.612 -5.767
175 H HIS 38 H HIS 38 9.615 -4.185 -5.524
176 HA HIS 38 HA HIS 38 10.854 -2.159 -7.258
177 1HB HIS 38 1HB HIS 38 10.032 -3.714 -8.849
178 2HB HIS 38 2HB HIS 38 8.599 -4.068 -7.923
179 HD1 HIS 38 HD1 HIS 38 9.852 -1.144 -10.169
180 HD2 HIS 38 HD2 HIS 38 6.503 -2.594 -8.057
181 HE1 HIS 38 HE1 HIS 38 7.882 0.441 -10.713
182 HE2 HIS 38 HE2 HIS 38 5.824 -0.487 -9.453
183 HA PRO 39 HA PRO 39 8.162 -0.047 -4.245
184 1HB PRO 39 1HB PRO 39 8.588 2.552 -5.192
185 2HB PRO 39 2HB PRO 39 9.396 1.708 -3.868
186 1HG PRO 39 1HG PRO 39 10.569 2.425 -6.441
187 2HG PRO 39 2HG PRO 39 11.343 1.565 -5.081
188 1HD PRO 39 1HD PRO 39 10.184 0.471 -7.576
189 2HD PRO 39 2HD PRO 39 11.339 -0.286 -6.453
190 H ASP 40 H ASP 40 6.138 0.950 -4.295
191 HA ASP 40 HA ASP 40 5.151 2.131 -6.829
192 1HB ASP 40 1HB ASP 40 4.623 -0.576 -6.437
193 2HB ASP 40 2HB ASP 40 3.175 0.174 -5.794
194 H CYS 41 H CYS 41 5.551 2.460 -3.648
195 HA CYS 41 HA CYS 41 2.881 2.877 -2.835
196 1HB CYS 41 1HB CYS 41 5.302 2.619 -1.528
197 2HB CYS 41 2HB CYS 41 4.564 4.076 -0.902
198 H ASP 42 H ASP 42 3.776 4.676 -4.837
199 HA ASP 42 HA ASP 42 4.435 6.714 -5.512
200 1HB ASP 42 1HB ASP 42 1.944 7.045 -5.195
201 2HB ASP 42 2HB ASP 42 2.297 7.823 -3.653
202 H ASP 43 H ASP 43 5.062 5.963 -2.492
203 HA ASP 43 HA ASP 43 7.300 7.858 -2.314
204 1HB ASP 43 1HB ASP 43 5.404 7.956 -0.543
205 2HB ASP 43 2HB ASP 43 6.103 6.457 0.032
206 H GLY 44 H GLY 44 6.453 4.848 -3.025
207 1HA GLY 44 1HA GLY 44 7.617 2.751 -3.126
208 2HA GLY 44 2HA GLY 44 9.099 3.622 -2.791
209 H ARG 45 H ARG 45 6.504 3.700 -0.588
210 HA ARG 45 HA ARG 45 8.288 2.599 1.540
211 1HB ARG 45 1HB ARG 45 6.920 3.544 3.213
212 2HB ARG 45 2HB ARG 45 7.247 4.798 2.027
213 1HG ARG 45 1HG ARG 45 4.978 4.603 1.123
214 2HG ARG 45 2HG ARG 45 4.662 3.187 2.139
215 1HD ARG 45 1HD ARG 45 3.579 5.045 3.134
216 2HD ARG 45 2HD ARG 45 4.947 4.604 4.164
217 HE ARG 45 HE ARG 45 5.855 6.651 2.406
218 1HH1 ARG 45 1HH1 ARG 45 3.501 6.438 4.995
219 2HH1 ARG 45 2HH1 ARG 45 3.727 8.117 5.421
220 1HH2 ARG 45 1HH2 ARG 45 6.108 8.645 2.977
221 2HH2 ARG 45 2HH2 ARG 45 5.179 9.381 4.287
222 H ASP 46 H ASP 46 6.514 1.195 -0.674
223 HA ASP 46 HA ASP 46 5.257 -0.767 0.999
224 1HB ASP 46 1HB ASP 46 4.947 -1.925 -1.143
225 2HB ASP 46 2HB ASP 46 4.170 -0.350 -1.149
226 H GLU 47 H GLU 47 8.178 -0.026 -0.724
227 HA GLU 47 HA GLU 47 9.259 -2.697 -0.535
228 1HB GLU 47 1HB GLU 47 10.434 0.024 -1.168
229 2HB GLU 47 2HB GLU 47 11.425 -1.418 -1.158
230 1HG GLU 47 1HG GLU 47 8.860 -1.371 -2.759
231 2HG GLU 47 2HG GLU 47 10.313 -0.602 -3.360
232 H TRP 48 H TRP 48 9.336 0.138 1.356
233 HA TRP 48 HA TRP 48 11.805 -0.062 2.599
234 1HB TRP 48 1HB TRP 48 9.356 1.298 3.726
235 2HB TRP 48 2HB TRP 48 11.005 1.508 4.290
236 HD1 TRP 48 HD1 TRP 48 11.254 1.580 0.614
237 HE1 TRP 48 HE1 TRP 48 10.883 3.894 -0.342
238 HE3 TRP 48 HE3 TRP 48 9.710 3.832 4.846
239 HZ2 TRP 48 HZ2 TRP 48 10.145 6.589 0.715
240 HZ3 TRP 48 HZ3 TRP 48 9.208 6.318 4.912
241 HH2 TRP 48 HH2 TRP 48 9.441 7.666 2.839
242 H GLY 49 H GLY 49 12.513 -1.490 3.618
243 1HA GLY 49 1HA GLY 49 13.108 -2.880 5.451
244 2HA GLY 49 2HA GLY 49 11.666 -2.297 6.291
245 H CYS 50 H CYS 50 10.724 -3.529 3.237
246 HA CYS 50 HA CYS 50 9.178 -5.058 2.816
247 1HB CYS 50 1HB CYS 50 11.401 -5.655 2.088
248 2HB CYS 50 2HB CYS 50 11.735 -6.436 3.604
249 H GLY 51 H GLY 51 8.841 -4.333 5.550
250 1HA GLY 51 1HA GLY 51 6.806 -6.198 6.390
251 2HA GLY 51 2HA GLY 51 8.261 -6.446 7.356
Start of MODEL 11
1 H SER 10 H SER 10 -6.727 -0.371 5.394
2 HA SER 10 HA SER 10 -8.248 -2.458 6.754
3 1HB SER 10 1HB SER 10 -9.940 -0.870 7.667
4 2HB SER 10 2HB SER 10 -8.373 -0.802 8.485
5 HG SER 10 HG SER 10 -9.258 1.267 8.065
6 H CYS 11 H CYS 11 -8.481 -3.326 4.853
7 HA CYS 11 HA CYS 11 -10.248 -2.219 2.825
8 1HB CYS 11 1HB CYS 11 -7.487 -1.758 2.821
9 2HB CYS 11 2HB CYS 11 -7.600 -3.223 1.890
10 HA PRO 12 HA PRO 12 -10.946 -6.569 2.394
11 1HB PRO 12 1HB PRO 12 -9.731 -6.979 -0.333
12 2HB PRO 12 2HB PRO 12 -11.404 -7.322 0.197
13 1HG PRO 12 1HG PRO 12 -10.826 -5.169 -1.387
14 2HG PRO 12 2HG PRO 12 -12.047 -5.056 -0.078
15 1HD PRO 12 1HD PRO 12 -9.141 -4.200 -0.006
16 2HD PRO 12 2HD PRO 12 -10.583 -3.287 0.515
17 HA PRO 13 HA PRO 13 -7.281 -8.781 3.576
18 1HB PRO 13 1HB PRO 13 -8.373 -11.166 2.029
19 2HB PRO 13 2HB PRO 13 -7.648 -11.137 3.673
20 1HG PRO 13 1HG PRO 13 -10.328 -11.195 3.427
21 2HG PRO 13 2HG PRO 13 -9.567 -10.039 4.574
22 1HD PRO 13 1HD PRO 13 -10.604 -9.483 1.775
23 2HD PRO 13 2HD PRO 13 -10.863 -8.555 3.288
24 H GLY 14 H GLY 14 -5.367 -9.046 3.018
25 1HA GLY 14 1HA GLY 14 -3.430 -9.038 1.781
26 2HA GLY 14 2HA GLY 14 -4.305 -9.692 0.405
27 H GLN 15 H GLN 15 -5.376 -6.585 1.798
28 HA GLN 15 HA GLN 15 -3.927 -5.049 -0.238
29 1HB GLN 15 1HB GLN 15 -6.886 -5.197 0.062
30 2HB GLN 15 2HB GLN 15 -6.159 -3.631 -0.299
31 1HG GLN 15 1HG GLN 15 -5.272 -4.311 -2.342
32 2HG GLN 15 2HG GLN 15 -5.270 -6.023 -1.909
33 1HE2 GLN 15 1HE2 GLN 15 -7.329 -7.162 -1.740
34 2HE2 GLN 15 2HE2 GLN 15 -8.574 -6.652 -2.874
35 H PHE 16 H PHE 16 -2.958 -3.449 0.599
36 HA PHE 16 HA PHE 16 -3.777 -2.216 3.238
37 1HB PHE 16 1HB PHE 16 -1.575 -2.081 3.989
38 2HB PHE 16 2HB PHE 16 -1.649 -3.679 3.285
39 HD1 PHE 16 HD1 PHE 16 0.106 -0.532 3.316
40 HD2 PHE 16 HD2 PHE 16 -0.831 -3.880 0.808
41 HE1 PHE 16 HE1 PHE 16 1.864 0.171 1.733
42 HE2 PHE 16 HE2 PHE 16 1.003 -3.263 -0.726
43 HZ PHE 16 HZ PHE 16 2.319 -1.252 -0.340
44 H ARG 17 H ARG 17 -2.901 0.116 3.523
45 HA ARG 17 HA ARG 17 -2.794 1.540 0.897
46 1HB ARG 17 1HB ARG 17 -3.707 3.471 1.915
47 2HB ARG 17 2HB ARG 17 -4.764 2.065 2.200
48 1HG ARG 17 1HG ARG 17 -3.914 1.908 4.538
49 2HG ARG 17 2HG ARG 17 -2.862 3.301 4.243
50 1HD ARG 17 1HD ARG 17 -4.819 4.087 5.412
51 2HD ARG 17 2HD ARG 17 -4.854 4.704 3.766
52 HE ARG 17 HE ARG 17 -6.761 3.456 3.292
53 1HH1 ARG 17 2HH2 ARG 17 -5.655 2.397 6.464
54 2HH1 ARG 17 1HH2 ARG 17 -7.188 1.573 6.731
55 1HH2 ARG 17 2HH1 ARG 17 -8.484 2.252 3.667
56 2HH2 ARG 17 1HH1 ARG 17 -8.672 1.397 5.187
57 H CYS 18 H CYS 18 -1.566 3.271 0.601
58 HA CYS 18 HA CYS 18 1.148 2.954 1.737
59 1HB CYS 18 1HB CYS 18 -0.042 4.016 -0.821
60 2HB CYS 18 2HB CYS 18 1.604 4.430 -0.358
61 H SER 19 H SER 19 0.143 5.803 0.241
62 HA SER 19 HA SER 19 1.553 7.373 2.299
63 1HB SER 19 1HB SER 19 2.007 8.959 0.410
64 2HB SER 19 2HB SER 19 2.527 7.303 0.064
65 HG SER 19 HG SER 19 1.373 8.153 -1.697
66 H GLU 20 H GLU 20 -1.101 6.803 2.551
67 HA GLU 20 HA GLU 20 -2.167 9.475 3.293
68 1HB GLU 20 1HB GLU 20 -3.096 8.971 1.123
69 2HB GLU 20 2HB GLU 20 -3.743 7.438 1.695
70 1HG GLU 20 1HG GLU 20 -5.288 8.584 3.203
71 2HG GLU 20 2HG GLU 20 -4.505 10.135 2.891
72 HA PRO 21 HA PRO 21 -2.577 6.918 6.980
73 1HB PRO 21 1HB PRO 21 -3.418 8.829 8.768
74 2HB PRO 21 2HB PRO 21 -1.764 8.798 8.088
75 1HG PRO 21 1HG PRO 21 -4.149 10.416 7.123
76 2HG PRO 21 2HG PRO 21 -2.498 11.007 7.509
77 1HD PRO 21 1HD PRO 21 -3.227 10.411 4.961
78 2HD PRO 21 2HD PRO 21 -1.589 10.018 5.563
79 HA PRO 22 HA PRO 22 -6.881 5.811 7.479
80 1HB PRO 22 1HB PRO 22 -7.181 5.234 10.153
81 2HB PRO 22 2HB PRO 22 -6.276 4.197 9.008
82 1HG PRO 22 1HG PRO 22 -5.168 6.332 10.861
83 2HG PRO 22 2HG PRO 22 -4.629 4.634 10.665
84 1HD PRO 22 1HD PRO 22 -3.372 6.657 9.378
85 2HD PRO 22 2HD PRO 22 -3.648 5.100 8.548
86 H GLY 23 H GLY 23 -8.869 6.316 8.784
87 1HA GLY 23 1HA GLY 23 -10.516 7.932 9.228
88 2HA GLY 23 2HA GLY 23 -9.261 9.143 9.483
89 H ALA 24 H ALA 24 -8.243 8.035 6.710
90 HA ALA 24 HA ALA 24 -10.262 9.112 4.830
91 1HB ALA 24 1HB ALA 24 -7.290 9.807 4.827
92 2HB ALA 24 2HB ALA 24 -8.455 10.235 3.555
93 3HB ALA 24 3HB ALA 24 -8.632 10.915 5.184
94 H HIS 25 H HIS 25 -10.765 6.851 4.674
95 HA HIS 25 HA HIS 25 -9.087 4.742 4.532
96 1HB HIS 25 1HB HIS 25 -11.832 5.046 3.245
97 2HB HIS 25 2HB HIS 25 -11.052 3.526 3.631
98 HD1 HIS 25 HD1 HIS 25 -10.352 3.401 6.480
99 HD2 HIS 25 HD2 HIS 25 -13.532 5.813 5.064
100 HE1 HIS 25 HE1 HIS 25 -11.852 3.912 8.514
101 HE2 HIS 25 HE2 HIS 25 -13.783 5.377 7.646
102 H GLY 26 H GLY 26 -10.137 6.510 1.777
103 1HA GLY 26 1HA GLY 26 -9.308 6.738 -0.396
104 2HA GLY 26 2HA GLY 26 -7.773 6.333 0.367
105 H GLU 27 H GLU 27 -7.085 5.467 -1.544
106 HA GLU 27 HA GLU 27 -8.126 2.759 -2.353
107 1HB GLU 27 1HB GLU 27 -6.763 4.919 -4.033
108 2HB GLU 27 2HB GLU 27 -7.036 3.269 -4.579
109 1HG GLU 27 1HG GLU 27 -9.199 5.281 -3.816
110 2HG GLU 27 2HG GLU 27 -8.720 4.851 -5.453
111 H CYS 28 H CYS 28 -7.202 1.479 -1.321
112 HA CYS 28 HA CYS 28 -4.555 1.111 -0.499
113 1HB CYS 28 1HB CYS 28 -6.700 -0.881 -1.307
114 2HB CYS 28 2HB CYS 28 -5.510 -1.088 -0.086
115 H TYR 29 H TYR 29 -3.567 -1.117 -1.206
116 HA TYR 29 HA TYR 29 -3.518 -1.701 -4.070
117 1HB TYR 29 1HB TYR 29 -1.015 -0.925 -2.493
118 2HB TYR 29 2HB TYR 29 -0.993 -1.560 -4.118
119 HD1 TYR 29 HD1 TYR 29 -1.821 -0.086 -6.055
120 HD2 TYR 29 HD2 TYR 29 -1.349 1.382 -2.017
121 HE1 TYR 29 HE1 TYR 29 -1.893 2.238 -6.892
122 HE2 TYR 29 HE2 TYR 29 -1.433 3.725 -2.876
123 HH TYR 29 HH TYR 29 -1.819 4.458 -6.358
124 HA PRO 30 HA PRO 30 -3.083 -5.787 -2.402
125 1HB PRO 30 1HB PRO 30 -0.963 -6.443 -4.375
126 2HB PRO 30 2HB PRO 30 -2.521 -7.262 -4.075
127 1HG PRO 30 1HG PRO 30 -2.141 -5.694 -6.295
128 2HG PRO 30 2HG PRO 30 -3.701 -5.678 -5.407
129 1HD PRO 30 1HD PRO 30 -1.401 -3.719 -5.198
130 2HD PRO 30 2HD PRO 30 -3.148 -3.385 -5.358
131 H GLN 31 H GLN 31 -1.828 -6.906 -0.973
132 HA GLN 31 HA GLN 31 0.796 -5.840 -0.132
133 1HB GLN 31 1HB GLN 31 -0.799 -8.295 0.761
134 2HB GLN 31 2HB GLN 31 0.708 -7.768 1.516
135 1HG GLN 31 1HG GLN 31 -0.271 -5.722 2.304
136 2HG GLN 31 2HG GLN 31 -1.751 -5.981 1.380
137 1HE2 GLN 31 1HE2 GLN 31 0.030 -8.319 3.553
138 2HE2 GLN 31 2HE2 GLN 31 -1.376 -8.521 4.593
139 H ASP 32 H ASP 32 -0.112 -7.789 -2.621
140 HA ASP 32 HA ASP 32 2.333 -9.278 -2.977
141 1HB ASP 32 1HB ASP 32 0.052 -9.363 -4.274
142 2HB ASP 32 2HB ASP 32 0.610 -7.950 -5.119
143 H TRP 33 H TRP 33 1.257 -6.091 -3.433
144 HA TRP 33 HA TRP 33 3.868 -5.002 -4.226
145 1HB TRP 33 1HB TRP 33 1.287 -3.482 -3.986
146 2HB TRP 33 2HB TRP 33 2.792 -2.956 -4.685
147 HD1 TRP 33 HD1 TRP 33 2.122 -6.271 -6.165
148 HE1 TRP 33 HE1 TRP 33 0.850 -6.124 -8.379
149 HE3 TRP 33 HE3 TRP 33 0.877 -1.302 -6.050
150 HZ2 TRP 33 HZ2 TRP 33 -0.667 -4.161 -9.836
151 HZ3 TRP 33 HZ3 TRP 33 -0.467 -0.315 -7.903
152 HH2 TRP 33 HH2 TRP 33 -1.299 -1.742 -9.751
153 H LEU 34 H LEU 34 3.703 -6.133 -1.933
154 HA LEU 34 HA LEU 34 4.830 -3.955 -0.258
155 1HB LEU 34 1HB LEU 34 2.583 -4.756 0.686
156 2HB LEU 34 2HB LEU 34 3.316 -6.333 0.900
157 HG LEU 34 HG LEU 34 5.109 -5.166 2.340
158 1HD1 LEU 34 1HD1 LEU 34 4.488 -3.045 3.365
159 2HD1 LEU 34 2HD1 LEU 34 4.548 -2.832 1.608
160 3HD1 LEU 34 3HD1 LEU 34 2.982 -2.988 2.420
161 1HD2 LEU 34 1HD2 LEU 34 3.615 -5.152 4.325
162 2HD2 LEU 34 2HD2 LEU 34 2.196 -5.165 3.257
163 3HD2 LEU 34 3HD2 LEU 34 3.304 -6.556 3.289
164 H CYS 35 H CYS 35 6.927 -4.294 -0.519
165 HA CYS 35 HA CYS 35 8.874 -5.077 -1.130
166 1HB CYS 35 1HB CYS 35 8.936 -5.735 0.980
167 2HB CYS 35 2HB CYS 35 8.073 -7.231 0.755
168 H ASP 36 H ASP 36 7.756 -5.072 -3.209
169 HA ASP 36 HA ASP 36 7.360 -7.720 -4.555
170 1HB ASP 36 1HB ASP 36 5.812 -5.803 -5.025
171 2HB ASP 36 2HB ASP 36 7.174 -4.904 -5.682
172 H GLY 37 H GLY 37 9.808 -5.451 -3.834
173 1HA GLY 37 1HA GLY 37 12.126 -5.575 -4.388
174 2HA GLY 37 2HA GLY 37 11.735 -6.593 -5.788
175 H HIS 38 H HIS 38 9.628 -4.173 -5.542
176 HA HIS 38 HA HIS 38 10.853 -2.144 -7.282
177 1HB HIS 38 1HB HIS 38 10.034 -3.704 -8.872
178 2HB HIS 38 2HB HIS 38 8.609 -4.070 -7.938
179 HD1 HIS 38 HD1 HIS 38 9.822 -1.143 -10.200
180 HD2 HIS 38 HD2 HIS 38 6.501 -2.612 -8.056
181 HE1 HIS 38 HE1 HIS 38 7.835 0.422 -10.734
182 HE2 HIS 38 HE2 HIS 38 5.791 -0.520 -9.458
183 HA PRO 39 HA PRO 39 8.167 -0.030 -4.272
184 1HB PRO 39 1HB PRO 39 8.530 2.565 -5.218
185 2HB PRO 39 2HB PRO 39 9.426 1.729 -3.947
186 1HG PRO 39 1HG PRO 39 10.380 2.444 -6.638
187 2HG PRO 39 2HG PRO 39 11.309 1.731 -5.288
188 1HD PRO 39 1HD PRO 39 10.162 0.419 -7.657
189 2HD PRO 39 2HD PRO 39 11.320 -0.239 -6.480
190 H ASP 40 H ASP 40 6.126 0.926 -4.310
191 HA ASP 40 HA ASP 40 5.113 2.097 -6.837
192 1HB ASP 40 1HB ASP 40 4.598 -0.614 -6.441
193 2HB ASP 40 2HB ASP 40 3.148 0.135 -5.797
194 H CYS 41 H CYS 41 5.551 2.440 -3.665
195 HA CYS 41 HA CYS 41 2.876 2.868 -2.840
196 1HB CYS 41 1HB CYS 41 5.287 2.568 -1.534
197 2HB CYS 41 2HB CYS 41 4.602 4.058 -0.926
198 H ASP 42 H ASP 42 3.793 4.637 -4.861
199 HA ASP 42 HA ASP 42 4.477 6.662 -5.557
200 1HB ASP 42 1HB ASP 42 1.992 7.013 -5.263
201 2HB ASP 42 2HB ASP 42 2.333 7.796 -3.721
202 H ASP 43 H ASP 43 5.074 5.952 -2.516
203 HA ASP 43 HA ASP 43 7.317 7.838 -2.334
204 1HB ASP 43 1HB ASP 43 5.404 7.916 -0.568
205 2HB ASP 43 2HB ASP 43 6.127 6.428 0.008
206 H GLY 44 H GLY 44 6.464 4.822 -3.041
207 1HA GLY 44 1HA GLY 44 7.623 2.726 -3.137
208 2HA GLY 44 2HA GLY 44 9.108 3.597 -2.803
209 H ARG 45 H ARG 45 6.502 3.687 -0.606
210 HA ARG 45 HA ARG 45 8.284 2.598 1.528
211 1HB ARG 45 1HB ARG 45 6.923 3.542 3.198
212 2HB ARG 45 2HB ARG 45 7.226 4.795 2.005
213 1HG ARG 45 1HG ARG 45 4.948 4.582 1.130
214 2HG ARG 45 2HG ARG 45 4.657 3.157 2.142
215 1HD ARG 45 1HD ARG 45 3.566 5.025 3.148
216 2HD ARG 45 2HD ARG 45 4.925 4.539 4.170
217 HE ARG 45 HE ARG 45 5.755 6.640 2.367
218 1HH1 ARG 45 1HH1 ARG 45 3.781 6.300 5.241
219 2HH1 ARG 45 2HH1 ARG 45 4.149 7.926 5.765
220 1HH2 ARG 45 2HH2 ARG 45 6.208 8.566 3.067
221 2HH2 ARG 45 1HH2 ARG 45 5.491 9.224 4.540
222 H ASP 46 H ASP 46 6.508 1.187 -0.683
223 HA ASP 46 HA ASP 46 5.262 -0.776 0.998
224 1HB ASP 46 1HB ASP 46 4.920 -1.923 -1.136
225 2HB ASP 46 2HB ASP 46 4.168 -0.334 -1.148
226 H GLU 47 H GLU 47 8.179 -0.032 -0.731
227 HA GLU 47 HA GLU 47 9.266 -2.699 -0.547
228 1HB GLU 47 1HB GLU 47 10.437 0.026 -1.172
229 2HB GLU 47 2HB GLU 47 11.425 -1.416 -1.174
230 1HG GLU 47 1HG GLU 47 8.860 -1.359 -2.775
231 2HG GLU 47 2HG GLU 47 10.310 -0.581 -3.371
232 H TRP 48 H TRP 48 9.338 0.145 1.332
233 HA TRP 48 HA TRP 48 11.805 -0.058 2.583
234 1HB TRP 48 1HB TRP 48 9.362 1.317 3.705
235 2HB TRP 48 2HB TRP 48 11.014 1.522 4.264
236 HD1 TRP 48 HD1 TRP 48 11.277 1.583 0.596
237 HE1 TRP 48 HE1 TRP 48 10.909 3.894 -0.373
238 HE3 TRP 48 HE3 TRP 48 9.692 3.853 4.806
239 HZ2 TRP 48 HZ2 TRP 48 10.163 6.591 0.666
240 HZ3 TRP 48 HZ3 TRP 48 9.183 6.337 4.854
241 HH2 TRP 48 HH2 TRP 48 9.433 7.677 2.778
242 H GLY 49 H GLY 49 12.500 -1.492 3.604
243 1HA GLY 49 1HA GLY 49 13.102 -2.832 5.472
244 2HA GLY 49 2HA GLY 49 11.633 -2.277 6.282
245 H CYS 50 H CYS 50 10.721 -3.525 3.242
246 HA CYS 50 HA CYS 50 9.211 -5.100 2.824
247 1HB CYS 50 1HB CYS 50 11.452 -5.612 2.064
248 2HB CYS 50 2HB CYS 50 11.822 -6.404 3.567
249 H GLY 51 H GLY 51 8.899 -4.420 5.577
250 1HA GLY 51 1HA GLY 51 6.866 -6.165 6.471
251 2HA GLY 51 2HA GLY 51 8.349 -6.727 7.241
Start of MODEL 12
1 H SER 10 H SER 10 -5.783 -1.159 5.594
2 HA SER 10 HA SER 10 -7.295 -3.533 6.490
3 1HB SER 10 1HB SER 10 -7.568 -0.794 7.806
4 2HB SER 10 2HB SER 10 -8.641 -2.182 8.052
5 HG SER 10 HG SER 10 -5.879 -1.970 8.726
6 H CYS 11 H CYS 11 -7.918 -3.780 4.529
7 HA CYS 11 HA CYS 11 -9.893 -1.977 3.275
8 1HB CYS 11 1HB CYS 11 -7.279 -1.868 2.648
9 2HB CYS 11 2HB CYS 11 -7.672 -3.249 1.661
10 HA PRO 12 HA PRO 12 -11.058 -6.457 2.283
11 1HB PRO 12 1HB PRO 12 -9.530 -6.865 -0.255
12 2HB PRO 12 2HB PRO 12 -11.256 -7.196 0.066
13 1HG PRO 12 1HG PRO 12 -10.479 -5.087 -1.487
14 2HG PRO 12 2HG PRO 12 -11.870 -4.961 -0.362
15 1HD PRO 12 1HD PRO 12 -9.016 -4.060 0.079
16 2HD PRO 12 2HD PRO 12 -10.539 -3.165 0.377
17 HA PRO 13 HA PRO 13 -7.247 -8.408 3.683
18 1HB PRO 13 1HB PRO 13 -7.522 -11.068 3.129
19 2HB PRO 13 2HB PRO 13 -8.485 -10.240 4.394
20 1HG PRO 13 1HG PRO 13 -9.284 -10.839 1.534
21 2HG PRO 13 2HG PRO 13 -10.222 -11.161 3.032
22 1HD PRO 13 1HD PRO 13 -10.650 -8.954 1.491
23 2HD PRO 13 2HD PRO 13 -10.777 -8.871 3.276
24 H GLY 14 H GLY 14 -5.334 -9.075 3.051
25 1HA GLY 14 1HA GLY 14 -3.474 -9.112 1.717
26 2HA GLY 14 2HA GLY 14 -4.467 -9.711 0.392
27 H GLN 15 H GLN 15 -5.330 -6.550 1.771
28 HA GLN 15 HA GLN 15 -3.906 -5.076 -0.312
29 1HB GLN 15 1HB GLN 15 -6.861 -5.285 0.025
30 2HB GLN 15 2HB GLN 15 -6.186 -3.694 -0.353
31 1HG GLN 15 1HG GLN 15 -5.291 -4.358 -2.401
32 2HG GLN 15 2HG GLN 15 -5.239 -6.067 -1.962
33 1HE2 GLN 15 2HE2 GLN 15 -7.330 -7.211 -1.673
34 2HE2 GLN 15 1HE2 GLN 15 -8.546 -6.786 -2.872
35 H PHE 16 H PHE 16 -2.971 -3.420 0.511
36 HA PHE 16 HA PHE 16 -3.837 -2.197 3.140
37 1HB PHE 16 1HB PHE 16 -1.640 -1.995 3.913
38 2HB PHE 16 2HB PHE 16 -1.683 -3.611 3.245
39 HD1 PHE 16 HD1 PHE 16 -0.848 -3.858 0.795
40 HD2 PHE 16 HD2 PHE 16 0.006 -0.418 3.206
41 HE1 PHE 16 HE1 PHE 16 0.982 -3.247 -0.750
42 HE2 PHE 16 HE2 PHE 16 1.773 0.263 1.621
43 HZ PHE 16 HZ PHE 16 2.260 -1.203 -0.411
44 H ARG 17 H ARG 17 -3.117 0.102 3.462
45 HA ARG 17 HA ARG 17 -2.968 1.599 0.882
46 1HB ARG 17 1HB ARG 17 -3.872 3.496 1.996
47 2HB ARG 17 2HB ARG 17 -4.931 2.079 2.142
48 1HG ARG 17 1HG ARG 17 -4.148 1.750 4.494
49 2HG ARG 17 2HG ARG 17 -3.132 3.189 4.344
50 1HD ARG 17 1HD ARG 17 -5.209 3.741 5.517
51 2HD ARG 17 2HD ARG 17 -5.102 4.599 3.984
52 HE ARG 17 HE ARG 17 -6.992 3.519 3.221
53 1HH1 ARG 17 2HH1 ARG 17 -6.018 1.702 6.079
54 2HH1 ARG 17 1HH1 ARG 17 -7.449 0.686 5.930
55 1HH2 ARG 17 2HH2 ARG 17 -8.662 2.158 3.137
56 2HH2 ARG 17 1HH2 ARG 17 -8.805 0.866 4.325
57 H CYS 18 H CYS 18 -1.592 3.113 0.483
58 HA CYS 18 HA CYS 18 1.066 2.722 1.618
59 1HB CYS 18 1HB CYS 18 -0.137 3.925 -0.854
60 2HB CYS 18 2HB CYS 18 1.488 4.415 -0.393
61 H SER 19 H SER 19 0.060 5.703 0.390
62 HA SER 19 HA SER 19 1.406 7.104 2.658
63 1HB SER 19 1HB SER 19 2.343 6.923 0.149
64 2HB SER 19 2HB SER 19 1.360 8.382 -0.056
65 HG SER 19 HG SER 19 3.463 8.916 0.618
66 H GLU 20 H GLU 20 -1.218 6.639 2.641
67 HA GLU 20 HA GLU 20 -2.170 9.344 3.434
68 1HB GLU 20 1HB GLU 20 -3.098 8.769 1.164
69 2HB GLU 20 2HB GLU 20 -3.933 7.419 1.906
70 1HG GLU 20 1HG GLU 20 -5.585 9.052 1.845
71 2HG GLU 20 2HG GLU 20 -5.002 9.204 3.497
72 HA PRO 21 HA PRO 21 -2.749 6.607 6.999
73 1HB PRO 21 1HB PRO 21 -3.490 8.470 8.884
74 2HB PRO 21 2HB PRO 21 -1.827 8.349 8.235
75 1HG PRO 21 1HG PRO 21 -4.059 10.202 7.331
76 2HG PRO 21 2HG PRO 21 -2.373 10.636 7.772
77 1HD PRO 21 1HD PRO 21 -3.114 10.250 5.192
78 2HD PRO 21 2HD PRO 21 -1.514 9.701 5.776
79 HA PRO 22 HA PRO 22 -7.123 5.762 7.361
80 1HB PRO 22 1HB PRO 22 -7.534 5.105 10.002
81 2HB PRO 22 2HB PRO 22 -6.680 4.053 8.832
82 1HG PRO 22 1HG PRO 22 -5.464 6.019 10.800
83 2HG PRO 22 2HG PRO 22 -5.046 4.296 10.537
84 1HD PRO 22 1HD PRO 22 -3.612 6.275 9.371
85 2HD PRO 22 2HD PRO 22 -3.985 4.784 8.461
86 H GLY 23 H GLY 23 -9.107 6.358 8.613
87 1HA GLY 23 1HA GLY 23 -10.656 8.067 9.068
88 2HA GLY 23 2HA GLY 23 -9.333 9.164 9.452
89 H ALA 24 H ALA 24 -8.190 8.243 6.693
90 HA ALA 24 HA ALA 24 -10.070 9.512 4.776
91 1HB ALA 24 1HB ALA 24 -8.328 11.162 5.280
92 2HB ALA 24 2HB ALA 24 -7.058 9.972 4.929
93 3HB ALA 24 3HB ALA 24 -8.129 10.543 3.630
94 H HIS 25 H HIS 25 -10.731 7.306 4.560
95 HA HIS 25 HA HIS 25 -9.283 5.059 4.448
96 1HB HIS 25 1HB HIS 25 -11.877 5.630 2.956
97 2HB HIS 25 2HB HIS 25 -11.296 4.053 3.445
98 HD1 HIS 25 HD1 HIS 25 -10.857 3.975 6.360
99 HD2 HIS 25 HD2 HIS 25 -13.637 6.629 4.584
100 HE1 HIS 25 HE1 HIS 25 -12.468 4.717 8.232
101 HE2 HIS 25 HE2 HIS 25 -14.156 6.328 7.145
102 H GLY 26 H GLY 26 -9.966 6.930 1.644
103 1HA GLY 26 1HA GLY 26 -8.991 7.053 -0.482
104 2HA GLY 26 2HA GLY 26 -7.567 6.383 0.316
105 H GLU 27 H GLU 27 -6.952 5.297 -1.486
106 HA GLU 27 HA GLU 27 -8.335 2.727 -2.089
107 1HB GLU 27 1HB GLU 27 -8.879 4.355 -3.915
108 2HB GLU 27 2HB GLU 27 -7.150 4.595 -4.205
109 1HG GLU 27 1HG GLU 27 -6.909 2.203 -4.801
110 2HG GLU 27 2HG GLU 27 -8.610 1.923 -4.421
111 H CYS 28 H CYS 28 -7.313 1.307 -1.461
112 HA CYS 28 HA CYS 28 -4.632 1.118 -0.675
113 1HB CYS 28 1HB CYS 28 -6.721 -1.002 -1.255
114 2HB CYS 28 2HB CYS 28 -5.458 -1.066 -0.080
115 H TYR 29 H TYR 29 -3.582 -1.128 -1.287
116 HA TYR 29 HA TYR 29 -3.535 -1.778 -4.146
117 1HB TYR 29 1HB TYR 29 -1.038 -0.947 -2.585
118 2HB TYR 29 2HB TYR 29 -1.023 -1.582 -4.210
119 HD1 TYR 29 HD1 TYR 29 -1.891 -0.125 -6.143
120 HD2 TYR 29 HD2 TYR 29 -1.394 1.356 -2.112
121 HE1 TYR 29 HE1 TYR 29 -2.038 2.195 -6.977
122 HE2 TYR 29 HE2 TYR 29 -1.561 3.697 -2.969
123 HH TYR 29 HH TYR 29 -2.051 4.416 -6.441
124 HA PRO 30 HA PRO 30 -3.062 -5.831 -2.440
125 1HB PRO 30 1HB PRO 30 -0.902 -6.475 -4.381
126 2HB PRO 30 2HB PRO 30 -2.448 -7.320 -4.092
127 1HG PRO 30 1HG PRO 30 -2.081 -5.769 -6.321
128 2HG PRO 30 2HG PRO 30 -3.644 -5.755 -5.439
129 1HD PRO 30 1HD PRO 30 -1.362 -3.776 -5.234
130 2HD PRO 30 2HD PRO 30 -3.114 -3.460 -5.409
131 H GLN 31 H GLN 31 -1.813 -6.943 -0.990
132 HA GLN 31 HA GLN 31 0.778 -5.820 -0.105
133 1HB GLN 31 1HB GLN 31 -0.807 -8.289 0.795
134 2HB GLN 31 2HB GLN 31 0.661 -7.708 1.588
135 1HG GLN 31 1HG GLN 31 -0.417 -5.663 2.286
136 2HG GLN 31 2HG GLN 31 -1.875 -6.037 1.364
137 1HE2 GLN 31 1HE2 GLN 31 -3.138 -5.810 3.404
138 2HE2 GLN 31 2HE2 GLN 31 -3.077 -7.153 4.535
139 H ASP 32 H ASP 32 -0.080 -7.820 -2.576
140 HA ASP 32 HA ASP 32 2.385 -9.286 -2.868
141 1HB ASP 32 1HB ASP 32 0.125 -9.420 -4.193
142 2HB ASP 32 2HB ASP 32 0.677 -8.014 -5.054
143 H TRP 33 H TRP 33 1.277 -6.118 -3.398
144 HA TRP 33 HA TRP 33 3.878 -5.012 -4.187
145 1HB TRP 33 1HB TRP 33 1.286 -3.511 -3.980
146 2HB TRP 33 2HB TRP 33 2.794 -2.975 -4.670
147 HD1 TRP 33 HD1 TRP 33 2.132 -6.311 -6.121
148 HE1 TRP 33 HE1 TRP 33 0.884 -6.174 -8.349
149 HE3 TRP 33 HE3 TRP 33 0.942 -1.322 -6.079
150 HZ2 TRP 33 HZ2 TRP 33 -0.635 -4.222 -9.819
151 HZ3 TRP 33 HZ3 TRP 33 -0.410 -0.355 -7.931
152 HH2 TRP 33 HH2 TRP 33 -1.251 -1.797 -9.765
153 H LEU 34 H LEU 34 3.701 -6.115 -1.869
154 HA LEU 34 HA LEU 34 4.810 -3.904 -0.226
155 1HB LEU 34 1HB LEU 34 2.547 -4.690 0.715
156 2HB LEU 34 2HB LEU 34 3.285 -6.255 0.978
157 HG LEU 34 HG LEU 34 5.059 -5.044 2.399
158 1HD1 LEU 34 1HD1 LEU 34 2.943 -2.859 2.442
159 2HD1 LEU 34 2HD1 LEU 34 4.471 -2.900 3.353
160 3HD1 LEU 34 3HD1 LEU 34 4.491 -2.732 1.593
161 1HD2 LEU 34 1HD2 LEU 34 3.237 -6.409 3.372
162 2HD2 LEU 34 2HD2 LEU 34 3.570 -4.991 4.380
163 3HD2 LEU 34 3HD2 LEU 34 2.146 -5.008 3.314
164 H CYS 35 H CYS 35 6.914 -4.258 -0.488
165 HA CYS 35 HA CYS 35 8.846 -5.081 -1.102
166 1HB CYS 35 1HB CYS 35 8.946 -5.676 1.009
167 2HB CYS 35 2HB CYS 35 8.043 -7.165 0.852
168 H ASP 36 H ASP 36 7.732 -5.117 -3.158
169 HA ASP 36 HA ASP 36 7.309 -7.792 -4.452
170 1HB ASP 36 1HB ASP 36 5.757 -5.890 -4.964
171 2HB ASP 36 2HB ASP 36 7.113 -4.998 -5.636
172 H GLY 37 H GLY 37 9.747 -5.477 -3.812
173 1HA GLY 37 1HA GLY 37 12.072 -5.612 -4.400
174 2HA GLY 37 2HA GLY 37 11.651 -6.640 -5.784
175 H HIS 38 H HIS 38 9.546 -4.221 -5.521
176 HA HIS 38 HA HIS 38 10.750 -2.222 -7.313
177 1HB HIS 38 1HB HIS 38 9.891 -3.815 -8.855
178 2HB HIS 38 2HB HIS 38 8.454 -4.105 -7.911
179 HD1 HIS 38 HD1 HIS 38 9.795 -1.239 -10.192
180 HD2 HIS 38 HD2 HIS 38 6.403 -2.569 -8.071
181 HE1 HIS 38 HE1 HIS 38 7.880 0.413 -10.731
182 HE2 HIS 38 HE2 HIS 38 5.792 -0.445 -9.473
183 HA PRO 39 HA PRO 39 8.118 -0.055 -4.290
184 1HB PRO 39 1HB PRO 39 8.603 2.530 -5.234
185 2HB PRO 39 2HB PRO 39 9.405 1.664 -3.921
186 1HG PRO 39 1HG PRO 39 10.539 2.346 -6.536
187 2HG PRO 39 2HG PRO 39 11.340 1.526 -5.165
188 1HD PRO 39 1HD PRO 39 10.186 0.366 -7.621
189 2HD PRO 39 2HD PRO 39 11.295 -0.383 -6.448
190 H ASP 40 H ASP 40 6.130 1.000 -4.338
191 HA ASP 40 HA ASP 40 5.146 2.177 -6.876
192 1HB ASP 40 1HB ASP 40 4.577 -0.514 -6.458
193 2HB ASP 40 2HB ASP 40 3.145 0.265 -5.812
194 H CYS 41 H CYS 41 5.570 2.521 -3.698
195 HA CYS 41 HA CYS 41 2.903 2.998 -2.875
196 1HB CYS 41 1HB CYS 41 5.314 2.673 -1.569
197 2HB CYS 41 2HB CYS 41 4.624 4.153 -0.949
198 H ASP 42 H ASP 42 3.862 4.785 -4.868
199 HA ASP 42 HA ASP 42 4.518 6.830 -5.518
200 1HB ASP 42 1HB ASP 42 2.021 7.144 -5.204
201 2HB ASP 42 2HB ASP 42 2.367 7.917 -3.659
202 H ASP 43 H ASP 43 5.190 6.028 -2.520
203 HA ASP 43 HA ASP 43 7.485 7.844 -2.576
204 1HB ASP 43 1HB ASP 43 5.727 8.054 -0.580
205 2HB ASP 43 2HB ASP 43 6.673 6.712 0.032
206 H GLY 44 H GLY 44 6.506 4.876 -3.065
207 1HA GLY 44 1HA GLY 44 7.644 2.755 -3.192
208 2HA GLY 44 2HA GLY 44 9.148 3.595 -2.879
209 H ARG 45 H ARG 45 6.571 3.774 -0.676
210 HA ARG 45 HA ARG 45 8.299 2.635 1.478
211 1HB ARG 45 1HB ARG 45 6.854 3.618 3.128
212 2HB ARG 45 2HB ARG 45 7.433 4.840 2.009
213 1HG ARG 45 1HG ARG 45 5.300 4.984 0.904
214 2HG ARG 45 2HG ARG 45 4.662 3.591 1.798
215 1HD ARG 45 1HD ARG 45 5.595 6.152 3.138
216 2HD ARG 45 2HD ARG 45 3.933 5.908 2.573
217 HE ARG 45 HE ARG 45 4.359 3.676 4.109
218 1HH1 ARG 45 2HH1 ARG 45 4.519 7.089 4.843
219 2HH1 ARG 45 1HH1 ARG 45 4.154 6.832 6.532
220 1HH2 ARG 45 2HH2 ARG 45 3.967 3.407 6.266
221 2HH2 ARG 45 1HH2 ARG 45 3.842 4.800 7.303
222 H ASP 46 H ASP 46 6.518 1.256 -0.731
223 HA ASP 46 HA ASP 46 5.210 -0.653 0.966
224 1HB ASP 46 1HB ASP 46 4.886 -1.841 -1.158
225 2HB ASP 46 2HB ASP 46 4.125 -0.260 -1.181
226 H GLU 47 H GLU 47 8.153 0.003 -0.765
227 HA GLU 47 HA GLU 47 9.176 -2.689 -0.536
228 1HB GLU 47 1HB GLU 47 10.408 -0.005 -1.212
229 2HB GLU 47 2HB GLU 47 11.363 -1.471 -1.189
230 1HG GLU 47 1HG GLU 47 8.790 -1.364 -2.782
231 2HG GLU 47 2HG GLU 47 10.267 -0.657 -3.398
232 H TRP 48 H TRP 48 9.310 0.168 1.303
233 HA TRP 48 HA TRP 48 11.767 -0.079 2.569
234 1HB TRP 48 1HB TRP 48 9.354 1.387 3.640
235 2HB TRP 48 2HB TRP 48 11.006 1.556 4.213
236 HD1 TRP 48 HD1 TRP 48 11.318 1.514 0.550
237 HE1 TRP 48 HE1 TRP 48 11.054 3.816 -0.484
238 HE3 TRP 48 HE3 TRP 48 9.731 3.950 4.670
239 HZ2 TRP 48 HZ2 TRP 48 10.441 6.559 0.479
240 HZ3 TRP 48 HZ3 TRP 48 9.322 6.452 4.642
241 HH2 TRP 48 HH2 TRP 48 9.690 7.731 2.544
242 H GLY 49 H GLY 49 12.426 -1.496 3.618
243 1HA GLY 49 1HA GLY 49 13.001 -2.760 5.550
244 2HA GLY 49 2HA GLY 49 11.502 -2.211 6.305
245 H CYS 50 H CYS 50 10.647 -3.512 3.287
246 HA CYS 50 HA CYS 50 9.161 -5.109 2.880
247 1HB CYS 50 1HB CYS 50 11.412 -5.590 2.118
248 2HB CYS 50 2HB CYS 50 11.797 -6.372 3.623
249 H GLY 51 H GLY 51 8.857 -4.435 5.638
250 1HA GLY 51 1HA GLY 51 6.809 -6.122 6.538
251 2HA GLY 51 2HA GLY 51 8.277 -6.796 7.250
Start of MODEL 13
1 H SER 10 H SER 10 -5.907 -1.242 5.648
2 HA SER 10 HA SER 10 -7.521 -3.376 6.705
3 1HB SER 10 1HB SER 10 -7.308 -1.937 8.751
4 2HB SER 10 2HB SER 10 -8.060 -0.602 7.858
5 HG SER 10 HG SER 10 -9.568 -1.858 9.109
6 H CYS 11 H CYS 11 -8.136 -3.771 4.757
7 HA CYS 11 HA CYS 11 -9.960 -2.043 3.265
8 1HB CYS 11 1HB CYS 11 -7.269 -1.905 2.845
9 2HB CYS 11 2HB CYS 11 -7.617 -3.269 1.821
10 HA PRO 12 HA PRO 12 -11.057 -6.469 2.235
11 1HB PRO 12 1HB PRO 12 -9.602 -6.797 -0.354
12 2HB PRO 12 2HB PRO 12 -11.333 -7.077 -0.013
13 1HG PRO 12 1HG PRO 12 -10.489 -4.922 -1.476
14 2HG PRO 12 2HG PRO 12 -11.872 -4.813 -0.338
15 1HD PRO 12 1HD PRO 12 -8.993 -4.008 0.129
16 2HD PRO 12 2HD PRO 12 -10.496 -3.100 0.488
17 HA PRO 13 HA PRO 13 -7.349 -8.564 3.541
18 1HB PRO 13 1HB PRO 13 -7.600 -11.190 2.813
19 2HB PRO 13 2HB PRO 13 -8.637 -10.437 4.067
20 1HG PRO 13 1HG PRO 13 -9.257 -10.839 1.128
21 2HG PRO 13 2HG PRO 13 -10.285 -11.265 2.538
22 1HD PRO 13 1HD PRO 13 -10.629 -8.957 1.140
23 2HD PRO 13 2HD PRO 13 -10.850 -8.992 2.917
24 H GLY 14 H GLY 14 -5.414 -9.174 2.998
25 1HA GLY 14 1HA GLY 14 -3.469 -9.086 1.808
26 2HA GLY 14 2HA GLY 14 -4.332 -9.734 0.418
27 H GLN 15 H GLN 15 -5.295 -6.585 1.835
28 HA GLN 15 HA GLN 15 -3.902 -5.089 -0.256
29 1HB GLN 15 1HB GLN 15 -6.854 -5.320 0.067
30 2HB GLN 15 2HB GLN 15 -6.194 -3.718 -0.288
31 1HG GLN 15 1HG GLN 15 -5.264 -4.358 -2.335
32 2HG GLN 15 2HG GLN 15 -5.232 -6.074 -1.917
33 1HE2 GLN 15 2HE2 GLN 15 -7.351 -7.181 -1.622
34 2HE2 GLN 15 1HE2 GLN 15 -8.551 -6.745 -2.836
35 H PHE 16 H PHE 16 -2.938 -3.463 0.572
36 HA PHE 16 HA PHE 16 -3.794 -2.225 3.198
37 1HB PHE 16 1HB PHE 16 -1.594 -2.072 3.966
38 2HB PHE 16 2HB PHE 16 -1.662 -3.677 3.274
39 HD1 PHE 16 HD1 PHE 16 0.062 -0.503 3.278
40 HD2 PHE 16 HD2 PHE 16 -0.815 -3.908 0.826
41 HE1 PHE 16 HE1 PHE 16 1.838 0.183 1.706
42 HE2 PHE 16 HE2 PHE 16 1.030 -3.302 -0.702
43 HZ PHE 16 HZ PHE 16 2.322 -1.272 -0.338
44 H ARG 17 H ARG 17 -3.058 0.079 3.510
45 HA ARG 17 HA ARG 17 -2.887 1.561 0.924
46 1HB ARG 17 1HB ARG 17 -3.781 3.480 2.020
47 2HB ARG 17 2HB ARG 17 -4.860 2.072 2.157
48 1HG ARG 17 1HG ARG 17 -4.135 1.750 4.517
49 2HG ARG 17 2HG ARG 17 -3.076 3.158 4.381
50 1HD ARG 17 1HD ARG 17 -5.165 3.772 5.510
51 2HD ARG 17 2HD ARG 17 -4.997 4.623 3.980
52 HE ARG 17 HE ARG 17 -6.905 3.597 3.176
53 1HH1 ARG 17 1HH1 ARG 17 -6.037 1.740 6.046
54 2HH1 ARG 17 2HH1 ARG 17 -7.474 0.742 5.835
55 1HH2 ARG 17 1HH2 ARG 17 -8.592 2.285 3.045
56 2HH2 ARG 17 2HH2 ARG 17 -8.790 0.974 4.211
57 H CYS 18 H CYS 18 -1.535 3.128 0.576
58 HA CYS 18 HA CYS 18 1.122 2.730 1.747
59 1HB CYS 18 1HB CYS 18 -0.039 3.961 -0.743
60 2HB CYS 18 2HB CYS 18 1.602 4.368 -0.255
61 H SER 19 H SER 19 0.169 5.692 0.455
62 HA SER 19 HA SER 19 1.520 7.112 2.702
63 1HB SER 19 1HB SER 19 1.446 7.861 -0.247
64 2HB SER 19 2HB SER 19 2.403 8.664 1.015
65 HG SER 19 HG SER 19 2.994 6.465 -0.410
66 H GLU 20 H GLU 20 -1.123 6.691 2.698
67 HA GLU 20 HA GLU 20 -2.104 9.411 3.364
68 1HB GLU 20 1HB GLU 20 -2.948 8.899 1.138
69 2HB GLU 20 2HB GLU 20 -3.719 7.430 1.734
70 1HG GLU 20 1HG GLU 20 -5.235 8.728 3.144
71 2HG GLU 20 2HG GLU 20 -4.334 10.211 2.821
72 HA PRO 21 HA PRO 21 -2.725 6.817 6.981
73 1HB PRO 21 1HB PRO 21 -3.438 8.718 8.824
74 2HB PRO 21 2HB PRO 21 -1.794 8.618 8.126
75 1HG PRO 21 1HG PRO 21 -4.098 10.382 7.212
76 2HG PRO 21 2HG PRO 21 -2.419 10.881 7.610
77 1HD PRO 21 1HD PRO 21 -3.174 10.381 5.045
78 2HD PRO 21 2HD PRO 21 -1.560 9.894 5.642
79 HA PRO 22 HA PRO 22 -7.036 5.808 7.652
80 1HB PRO 22 1HB PRO 22 -6.517 6.235 10.602
81 2HB PRO 22 2HB PRO 22 -7.386 4.888 9.795
82 1HG PRO 22 1HG PRO 22 -4.862 4.551 10.600
83 2HG PRO 22 2HG PRO 22 -5.342 3.973 8.968
84 1HD PRO 22 1HD PRO 22 -3.879 6.529 9.701
85 2HD PRO 22 2HD PRO 22 -3.524 5.360 8.391
86 H GLY 23 H GLY 23 -9.019 6.504 8.757
87 1HA GLY 23 1HA GLY 23 -10.718 8.109 8.967
88 2HA GLY 23 2HA GLY 23 -9.496 9.333 9.309
89 H ALA 24 H ALA 24 -8.260 8.304 6.614
90 HA ALA 24 HA ALA 24 -10.158 9.413 4.617
91 1HB ALA 24 1HB ALA 24 -8.223 10.415 3.434
92 2HB ALA 24 2HB ALA 24 -8.446 11.120 5.048
93 3HB ALA 24 3HB ALA 24 -7.154 9.932 4.770
94 H HIS 25 H HIS 25 -10.775 7.184 4.515
95 HA HIS 25 HA HIS 25 -9.274 4.946 4.400
96 1HB HIS 25 1HB HIS 25 -11.905 5.481 2.956
97 2HB HIS 25 2HB HIS 25 -11.283 3.910 3.410
98 HD1 HIS 25 HD1 HIS 25 -10.802 3.787 6.313
99 HD2 HIS 25 HD2 HIS 25 -13.657 6.421 4.627
100 HE1 HIS 25 HE1 HIS 25 -12.404 4.458 8.220
101 HE2 HIS 25 HE2 HIS 25 -14.136 6.058 7.189
102 H GLY 26 H GLY 26 -10.037 6.854 1.652
103 1HA GLY 26 1HA GLY 26 -9.098 7.054 -0.486
104 2HA GLY 26 2HA GLY 26 -7.647 6.419 0.291
105 H GLU 27 H GLU 27 -6.911 5.255 -1.369
106 HA GLU 27 HA GLU 27 -8.281 2.717 -2.058
107 1HB GLU 27 1HB GLU 27 -8.758 4.399 -3.904
108 2HB GLU 27 2HB GLU 27 -7.020 4.590 -4.129
109 1HG GLU 27 1HG GLU 27 -7.831 3.113 -5.826
110 2HG GLU 27 2HG GLU 27 -6.863 2.152 -4.720
111 H CYS 28 H CYS 28 -7.267 1.262 -1.491
112 HA CYS 28 HA CYS 28 -4.581 1.128 -0.612
113 1HB CYS 28 1HB CYS 28 -6.701 -0.967 -1.204
114 2HB CYS 28 2HB CYS 28 -5.394 -1.108 -0.092
115 H TYR 29 H TYR 29 -3.557 -1.152 -1.230
116 HA TYR 29 HA TYR 29 -3.481 -1.758 -4.097
117 1HB TYR 29 1HB TYR 29 -0.992 -0.997 -2.494
118 2HB TYR 29 2HB TYR 29 -0.971 -1.587 -4.135
119 HD1 TYR 29 HD1 TYR 29 -1.297 1.284 -1.947
120 HD2 TYR 29 HD2 TYR 29 -1.818 -0.042 -6.027
121 HE1 TYR 29 HE1 TYR 29 -1.393 3.657 -2.725
122 HE2 TYR 29 HE2 TYR 29 -1.897 2.308 -6.782
123 HH TYR 29 HH TYR 29 -1.814 4.510 -6.173
124 HA PRO 30 HA PRO 30 -3.068 -5.834 -2.407
125 1HB PRO 30 1HB PRO 30 -0.935 -6.487 -4.375
126 2HB PRO 30 2HB PRO 30 -2.486 -7.318 -4.075
127 1HG PRO 30 1HG PRO 30 -2.118 -5.757 -6.297
128 2HG PRO 30 2HG PRO 30 -3.677 -5.744 -5.409
129 1HD PRO 30 1HD PRO 30 -1.390 -3.770 -5.210
130 2HD PRO 30 2HD PRO 30 -3.140 -3.449 -5.367
131 H GLN 31 H GLN 31 -1.816 -6.959 -0.980
132 HA GLN 31 HA GLN 31 0.798 -5.875 -0.116
133 1HB GLN 31 1HB GLN 31 -0.825 -8.323 0.767
134 2HB GLN 31 2HB GLN 31 0.693 -7.825 1.524
135 1HG GLN 31 1HG GLN 31 -0.255 -5.764 2.318
136 2HG GLN 31 2HG GLN 31 -1.738 -6.000 1.391
137 1HE2 GLN 31 1HE2 GLN 31 0.010 -8.369 3.559
138 2HE2 GLN 31 2HE2 GLN 31 -1.398 -8.555 4.597
139 H ASP 32 H ASP 32 -0.094 -7.823 -2.611
140 HA ASP 32 HA ASP 32 2.363 -9.293 -2.962
141 1HB ASP 32 1HB ASP 32 0.067 -9.380 -4.259
142 2HB ASP 32 2HB ASP 32 0.655 -7.992 -5.128
143 H TRP 33 H TRP 33 1.262 -6.112 -3.421
144 HA TRP 33 HA TRP 33 3.864 -5.012 -4.222
145 1HB TRP 33 1HB TRP 33 1.276 -3.504 -3.975
146 2HB TRP 33 2HB TRP 33 2.779 -2.966 -4.675
147 HD1 TRP 33 HD1 TRP 33 2.122 -6.281 -6.158
148 HE1 TRP 33 HE1 TRP 33 0.856 -6.131 -8.377
149 HE3 TRP 33 HE3 TRP 33 0.867 -1.317 -6.033
150 HZ2 TRP 33 HZ2 TRP 33 -0.661 -4.166 -9.833
151 HZ3 TRP 33 HZ3 TRP 33 -0.481 -0.327 -7.883
152 HH2 TRP 33 HH2 TRP 33 -1.302 -1.748 -9.738
153 H LEU 34 H LEU 34 3.701 -6.140 -1.920
154 HA LEU 34 HA LEU 34 4.824 -3.952 -0.252
155 1HB LEU 34 1HB LEU 34 2.575 -4.748 0.692
156 2HB LEU 34 2HB LEU 34 3.303 -6.324 0.913
157 HG LEU 34 HG LEU 34 5.085 -5.172 2.365
158 1HD1 LEU 34 1HD1 LEU 34 4.575 -2.833 1.613
159 2HD1 LEU 34 2HD1 LEU 34 3.000 -2.955 2.412
160 3HD1 LEU 34 3HD1 LEU 34 4.495 -3.034 3.370
161 1HD2 LEU 34 1HD2 LEU 34 3.228 -6.516 3.303
162 2HD2 LEU 34 2HD2 LEU 34 3.589 -5.126 4.338
163 3HD2 LEU 34 3HD2 LEU 34 2.168 -5.087 3.270
164 H CYS 35 H CYS 35 6.920 -4.291 -0.527
165 HA CYS 35 HA CYS 35 8.863 -5.079 -1.138
166 1HB CYS 35 1HB CYS 35 8.931 -5.740 0.968
167 2HB CYS 35 2HB CYS 35 8.067 -7.235 0.746
168 H ASP 36 H ASP 36 7.747 -5.069 -3.212
169 HA ASP 36 HA ASP 36 7.341 -7.716 -4.561
170 1HB ASP 36 1HB ASP 36 5.790 -5.801 -5.028
171 2HB ASP 36 2HB ASP 36 7.149 -4.897 -5.683
172 H GLY 37 H GLY 37 9.789 -5.443 -3.848
173 1HA GLY 37 1HA GLY 37 12.107 -5.566 -4.414
174 2HA GLY 37 2HA GLY 37 11.707 -6.580 -5.815
175 H HIS 38 H HIS 38 9.600 -4.163 -5.554
176 HA HIS 38 HA HIS 38 10.817 -2.131 -7.296
177 1HB HIS 38 1HB HIS 38 9.992 -3.691 -8.882
178 2HB HIS 38 2HB HIS 38 8.567 -4.051 -7.946
179 HD1 HIS 38 HD1 HIS 38 9.795 -1.123 -10.201
180 HD2 HIS 38 HD2 HIS 38 6.464 -2.584 -8.064
181 HE1 HIS 38 HE1 HIS 38 7.817 0.457 -10.727
182 HE2 HIS 38 HE2 HIS 38 5.768 -0.479 -9.453
183 HA PRO 39 HA PRO 39 8.143 -0.023 -4.269
184 1HB PRO 39 1HB PRO 39 8.524 2.574 -5.212
185 2HB PRO 39 2HB PRO 39 9.398 1.729 -3.931
186 1HG PRO 39 1HG PRO 39 10.406 2.452 -6.592
187 2HG PRO 39 2HG PRO 39 11.298 1.697 -5.240
188 1HD PRO 39 1HD PRO 39 10.144 0.445 -7.643
189 2HD PRO 39 2HD PRO 39 11.297 -0.245 -6.478
190 H ASP 40 H ASP 40 6.106 0.950 -4.301
191 HA ASP 40 HA ASP 40 5.089 2.117 -6.829
192 1HB ASP 40 1HB ASP 40 4.573 -0.590 -6.416
193 2HB ASP 40 2HB ASP 40 3.129 0.161 -5.767
194 H CYS 41 H CYS 41 5.532 2.467 -3.656
195 HA CYS 41 HA CYS 41 2.865 2.906 -2.822
196 1HB CYS 41 1HB CYS 41 5.302 2.645 -1.532
197 2HB CYS 41 2HB CYS 41 4.559 4.100 -0.905
198 H ASP 42 H ASP 42 3.782 4.680 -4.844
199 HA ASP 42 HA ASP 42 4.445 6.712 -5.530
200 1HB ASP 42 1HB ASP 42 1.957 7.051 -5.215
201 2HB ASP 42 2HB ASP 42 2.309 7.831 -3.674
202 H ASP 43 H ASP 43 5.079 5.976 -2.501
203 HA ASP 43 HA ASP 43 7.345 7.840 -2.408
204 1HB ASP 43 1HB ASP 43 5.481 8.009 -0.586
205 2HB ASP 43 2HB ASP 43 6.238 6.558 0.040
206 H GLY 44 H GLY 44 6.452 4.842 -3.037
207 1HA GLY 44 1HA GLY 44 7.606 2.740 -3.136
208 2HA GLY 44 2HA GLY 44 9.094 3.607 -2.811
209 H ARG 45 H ARG 45 6.508 3.711 -0.605
210 HA ARG 45 HA ARG 45 8.280 2.605 1.528
211 1HB ARG 45 1HB ARG 45 6.900 3.553 3.200
212 2HB ARG 45 2HB ARG 45 7.284 4.802 2.025
213 1HG ARG 45 1HG ARG 45 5.030 4.682 1.083
214 2HG ARG 45 2HG ARG 45 4.646 3.277 2.094
215 1HD ARG 45 1HD ARG 45 3.623 5.228 3.046
216 2HD ARG 45 2HD ARG 45 4.913 4.663 4.120
217 HE ARG 45 HE ARG 45 5.835 6.722 2.273
218 1HH1 ARG 45 1HH2 ARG 45 4.010 6.438 5.245
219 2HH1 ARG 45 2HH2 ARG 45 4.453 8.048 5.757
220 1HH2 ARG 45 2HH1 ARG 45 6.410 8.646 2.974
221 2HH2 ARG 45 1HH1 ARG 45 5.779 9.303 4.482
222 H ASP 46 H ASP 46 6.503 1.202 -0.683
223 HA ASP 46 HA ASP 46 5.255 -0.755 1.001
224 1HB ASP 46 1HB ASP 46 4.935 -1.922 -1.136
225 2HB ASP 46 2HB ASP 46 4.158 -0.346 -1.143
226 H GLU 47 H GLU 47 8.168 -0.021 -0.734
227 HA GLU 47 HA GLU 47 9.252 -2.690 -0.551
228 1HB GLU 47 1HB GLU 47 10.424 0.031 -1.188
229 2HB GLU 47 2HB GLU 47 11.412 -1.412 -1.189
230 1HG GLU 47 1HG GLU 47 8.837 -1.352 -2.776
231 2HG GLU 47 2HG GLU 47 10.289 -0.584 -3.383
232 H TRP 48 H TRP 48 9.337 0.151 1.328
233 HA TRP 48 HA TRP 48 11.805 -0.052 2.578
234 1HB TRP 48 1HB TRP 48 9.358 1.320 3.696
235 2HB TRP 48 2HB TRP 48 11.009 1.526 4.259
236 HD1 TRP 48 HD1 TRP 48 11.271 1.584 0.588
237 HE1 TRP 48 HE1 TRP 48 10.910 3.896 -0.380
238 HE3 TRP 48 HE3 TRP 48 9.695 3.859 4.799
239 HZ2 TRP 48 HZ2 TRP 48 10.196 6.597 0.663
240 HZ3 TRP 48 HZ3 TRP 48 9.199 6.346 4.848
241 HH2 TRP 48 HH2 TRP 48 9.467 7.688 2.775
242 H GLY 49 H GLY 49 12.503 -1.480 3.606
243 1HA GLY 49 1HA GLY 49 13.093 -2.830 5.474
244 2HA GLY 49 2HA GLY 49 11.619 -2.279 6.276
245 H CYS 50 H CYS 50 10.723 -3.517 3.229
246 HA CYS 50 HA CYS 50 9.220 -5.079 2.795
247 1HB CYS 50 1HB CYS 50 11.456 -5.607 2.047
248 2HB CYS 50 2HB CYS 50 11.818 -6.397 3.552
249 H GLY 51 H GLY 51 8.923 -4.421 5.579
250 1HA GLY 51 1HA GLY 51 6.885 -6.274 6.378
251 2HA GLY 51 2HA GLY 51 8.358 -6.624 7.285
Start of MODEL 14
1 H SER 10 H SER 10 -6.630 -0.502 5.544
2 HA SER 10 HA SER 10 -8.217 -2.583 6.834
3 1HB SER 10 1HB SER 10 -9.908 -0.982 7.732
4 2HB SER 10 2HB SER 10 -8.358 -0.946 8.587
5 HG SER 10 HG SER 10 -9.219 1.141 8.164
6 H CYS 11 H CYS 11 -8.410 -3.425 4.926
7 HA CYS 11 HA CYS 11 -10.191 -2.312 2.915
8 1HB CYS 11 1HB CYS 11 -7.439 -1.828 2.896
9 2HB CYS 11 2HB CYS 11 -7.541 -3.290 1.957
10 HA PRO 12 HA PRO 12 -10.872 -6.660 2.460
11 1HB PRO 12 1HB PRO 12 -9.699 -7.046 -0.287
12 2HB PRO 12 2HB PRO 12 -11.364 -7.389 0.264
13 1HG PRO 12 1HG PRO 12 -10.801 -5.225 -1.314
14 2HG PRO 12 2HG PRO 12 -12.008 -5.122 0.011
15 1HD PRO 12 1HD PRO 12 -9.100 -4.271 0.057
16 2HD PRO 12 2HD PRO 12 -10.533 -3.358 0.597
17 HA PRO 13 HA PRO 13 -7.163 -8.863 3.550
18 1HB PRO 13 1HB PRO 13 -8.302 -11.236 2.017
19 2HB PRO 13 2HB PRO 13 -7.523 -11.222 3.636
20 1HG PRO 13 1HG PRO 13 -10.209 -11.279 3.480
21 2HG PRO 13 2HG PRO 13 -9.410 -10.130 4.611
22 1HD PRO 13 1HD PRO 13 -10.542 -9.552 1.852
23 2HD PRO 13 2HD PRO 13 -10.747 -8.635 3.380
24 H GLY 14 H GLY 14 -5.265 -9.115 2.930
25 1HA GLY 14 1HA GLY 14 -3.370 -9.116 1.628
26 2HA GLY 14 2HA GLY 14 -4.297 -9.733 0.270
27 H GLN 15 H GLN 15 -5.331 -6.647 1.729
28 HA GLN 15 HA GLN 15 -3.921 -5.080 -0.309
29 1HB GLN 15 1HB GLN 15 -6.873 -5.279 0.014
30 2HB GLN 15 2HB GLN 15 -6.180 -3.694 -0.329
31 1HG GLN 15 1HG GLN 15 -5.307 -4.321 -2.394
32 2HG GLN 15 2HG GLN 15 -5.249 -6.037 -1.985
33 1HE2 GLN 15 2HE2 GLN 15 -7.310 -7.212 -1.743
34 2HE2 GLN 15 1HE2 GLN 15 -8.558 -6.750 -2.894
35 H PHE 16 H PHE 16 -2.986 -3.457 0.508
36 HA PHE 16 HA PHE 16 -3.826 -2.216 3.140
37 1HB PHE 16 1HB PHE 16 -1.634 -2.060 3.916
38 2HB PHE 16 2HB PHE 16 -1.684 -3.664 3.216
39 HD1 PHE 16 HD1 PHE 16 -0.852 -3.860 0.747
40 HD2 PHE 16 HD2 PHE 16 0.036 -0.494 3.249
41 HE1 PHE 16 HE1 PHE 16 0.965 -3.215 -0.794
42 HE2 PHE 16 HE2 PHE 16 1.790 0.227 1.665
43 HZ PHE 16 HZ PHE 16 2.265 -1.190 -0.402
44 H ARG 17 H ARG 17 -3.019 0.100 3.438
45 HA ARG 17 HA ARG 17 -2.953 1.565 0.834
46 1HB ARG 17 1HB ARG 17 -3.807 3.485 1.940
47 2HB ARG 17 2HB ARG 17 -4.869 2.083 2.202
48 1HG ARG 17 1HG ARG 17 -3.963 1.833 4.513
49 2HG ARG 17 2HG ARG 17 -2.908 3.228 4.242
50 1HD ARG 17 1HD ARG 17 -4.822 3.994 5.481
51 2HD ARG 17 2HD ARG 17 -4.907 4.655 3.855
52 HE ARG 17 HE ARG 17 -6.838 3.445 3.413
53 1HH1 ARG 17 2HH1 ARG 17 -5.617 2.251 6.490
54 2HH1 ARG 17 1HH1 ARG 17 -7.159 1.459 6.805
55 1HH2 ARG 17 1HH2 ARG 17 -8.583 2.273 3.832
56 2HH2 ARG 17 2HH2 ARG 17 -8.704 1.362 5.323
57 H CYS 18 H CYS 18 -1.624 3.156 0.424
58 HA CYS 18 HA CYS 18 1.081 2.858 1.550
59 1HB CYS 18 1HB CYS 18 -0.138 3.951 -0.973
60 2HB CYS 18 2HB CYS 18 1.494 4.427 -0.521
61 H SER 19 H SER 19 0.012 5.734 0.147
62 HA SER 19 HA SER 19 1.500 7.272 2.170
63 1HB SER 19 1HB SER 19 1.893 8.877 0.278
64 2HB SER 19 2HB SER 19 2.409 7.224 -0.084
65 HG SER 19 HG SER 19 1.204 8.084 -1.812
66 H GLU 20 H GLU 20 -1.149 6.726 2.489
67 HA GLU 20 HA GLU 20 -2.133 9.392 3.386
68 1HB GLU 20 1HB GLU 20 -3.149 8.888 1.158
69 2HB GLU 20 2HB GLU 20 -3.874 7.451 1.840
70 1HG GLU 20 1HG GLU 20 -5.627 8.961 1.947
71 2HG GLU 20 2HG GLU 20 -4.977 9.095 3.577
72 HA PRO 21 HA PRO 21 -2.531 6.528 6.880
73 1HB PRO 21 1HB PRO 21 -3.085 8.309 8.887
74 2HB PRO 21 2HB PRO 21 -1.483 8.222 8.096
75 1HG PRO 21 1HG PRO 21 -3.786 10.097 7.431
76 2HG PRO 21 2HG PRO 21 -2.079 10.532 7.782
77 1HD PRO 21 1HD PRO 21 -2.973 10.237 5.237
78 2HD PRO 21 2HD PRO 21 -1.341 9.675 5.701
79 HA PRO 22 HA PRO 22 -6.847 5.634 7.680
80 1HB PRO 22 1HB PRO 22 -6.205 5.848 10.627
81 2HB PRO 22 2HB PRO 22 -7.150 4.586 9.770
82 1HG PRO 22 1HG PRO 22 -4.611 4.115 10.458
83 2HG PRO 22 2HG PRO 22 -5.171 3.656 8.815
84 1HD PRO 22 1HD PRO 22 -3.591 6.109 9.642
85 2HD PRO 22 2HD PRO 22 -3.325 5.013 8.251
86 H GLY 23 H GLY 23 -8.756 6.323 8.904
87 1HA GLY 23 1HA GLY 23 -10.383 7.976 9.282
88 2HA GLY 23 2HA GLY 23 -9.102 9.145 9.596
89 H ALA 24 H ALA 24 -8.005 8.217 6.824
90 HA ALA 24 HA ALA 24 -9.992 9.375 4.945
91 1HB ALA 24 1HB ALA 24 -8.287 11.086 5.361
92 2HB ALA 24 2HB ALA 24 -6.993 9.925 4.995
93 3HB ALA 24 3HB ALA 24 -8.119 10.438 3.718
94 H HIS 25 H HIS 25 -10.583 7.126 4.808
95 HA HIS 25 HA HIS 25 -9.032 4.943 4.645
96 1HB HIS 25 1HB HIS 25 -11.739 5.410 3.327
97 2HB HIS 25 2HB HIS 25 -11.051 3.846 3.700
98 HD1 HIS 25 HD1 HIS 25 -10.418 3.621 6.551
99 HD2 HIS 25 HD2 HIS 25 -13.416 6.253 5.131
100 HE1 HIS 25 HE1 HIS 25 -11.932 4.168 8.564
101 HE2 HIS 25 HE2 HIS 25 -13.752 5.770 7.695
102 H GLY 26 H GLY 26 -9.922 6.790 1.885
103 1HA GLY 26 1HA GLY 26 -9.091 6.929 -0.296
104 2HA GLY 26 2HA GLY 26 -7.599 6.304 0.407
105 H GLU 27 H GLU 27 -7.092 5.242 -1.454
106 HA GLU 27 HA GLU 27 -8.441 2.624 -1.953
107 1HB GLU 27 1HB GLU 27 -7.459 4.569 -4.103
108 2HB GLU 27 2HB GLU 27 -7.891 2.875 -4.381
109 1HG GLU 27 1HG GLU 27 -10.200 3.338 -3.557
110 2HG GLU 27 2HG GLU 27 -9.783 5.045 -3.374
111 H CYS 28 H CYS 28 -7.366 1.238 -1.375
112 HA CYS 28 HA CYS 28 -4.672 1.088 -0.652
113 1HB CYS 28 1HB CYS 28 -6.735 -1.057 -1.264
114 2HB CYS 28 2HB CYS 28 -5.468 -1.156 -0.102
115 H TYR 29 H TYR 29 -3.601 -1.141 -1.295
116 HA TYR 29 HA TYR 29 -3.558 -1.757 -4.157
117 1HB TYR 29 1HB TYR 29 -1.075 -0.892 -2.588
118 2HB TYR 29 2HB TYR 29 -1.026 -1.560 -4.198
119 HD1 TYR 29 HD1 TYR 29 -1.473 1.421 -2.173
120 HD2 TYR 29 HD2 TYR 29 -1.901 -0.161 -6.175
121 HE1 TYR 29 HE1 TYR 29 -1.650 3.732 -3.080
122 HE2 TYR 29 HE2 TYR 29 -2.067 2.145 -7.062
123 HH TYR 29 HH TYR 29 -1.930 5.028 -4.945
124 HA PRO 30 HA PRO 30 -3.063 -5.810 -2.490
125 1HB PRO 30 1HB PRO 30 -0.915 -6.455 -4.438
126 2HB PRO 30 2HB PRO 30 -2.474 -7.280 -4.163
127 1HG PRO 30 1HG PRO 30 -2.061 -5.709 -6.375
128 2HG PRO 30 2HG PRO 30 -3.636 -5.701 -5.516
129 1HD PRO 30 1HD PRO 30 -1.349 -3.735 -5.257
130 2HD PRO 30 2HD PRO 30 -3.090 -3.403 -5.458
131 H GLN 31 H GLN 31 -1.800 -6.915 -1.049
132 HA GLN 31 HA GLN 31 0.799 -5.801 -0.183
133 1HB GLN 31 1HB GLN 31 -0.740 -8.297 0.691
134 2HB GLN 31 2HB GLN 31 0.739 -7.724 1.465
135 1HG GLN 31 1HG GLN 31 -0.309 -5.719 2.257
136 2HG GLN 31 2HG GLN 31 -1.766 -6.005 1.305
137 1HE2 GLN 31 1HE2 GLN 31 0.016 -8.366 3.450
138 2HE2 GLN 31 2HE2 GLN 31 -1.393 -8.595 4.478
139 H ASP 32 H ASP 32 -0.061 -7.767 -2.678
140 HA ASP 32 HA ASP 32 2.402 -9.231 -3.014
141 1HB ASP 32 1HB ASP 32 0.136 -9.337 -4.335
142 2HB ASP 32 2HB ASP 32 0.690 -7.915 -5.171
143 H TRP 33 H TRP 33 1.299 -6.054 -3.476
144 HA TRP 33 HA TRP 33 3.908 -4.937 -4.237
145 1HB TRP 33 1HB TRP 33 1.311 -3.441 -4.018
146 2HB TRP 33 2HB TRP 33 2.819 -2.899 -4.702
147 HD1 TRP 33 HD1 TRP 33 2.149 -6.217 -6.202
148 HE1 TRP 33 HE1 TRP 33 0.912 -6.045 -8.432
149 HE3 TRP 33 HE3 TRP 33 0.933 -1.240 -6.069
150 HZ2 TRP 33 HZ2 TRP 33 -0.574 -4.062 -9.896
151 HZ3 TRP 33 HZ3 TRP 33 -0.379 -0.233 -7.930
152 HH2 TRP 33 HH2 TRP 33 -1.199 -1.642 -9.796
153 H LEU 34 H LEU 34 3.726 -6.077 -1.944
154 HA LEU 34 HA LEU 34 4.811 -3.890 -0.251
155 1HB LEU 34 1HB LEU 34 2.553 -4.672 0.663
156 2HB LEU 34 2HB LEU 34 3.271 -6.253 0.897
157 HG LEU 34 HG LEU 34 5.065 -5.064 2.340
158 1HD1 LEU 34 1HD1 LEU 34 2.906 -2.918 2.416
159 2HD1 LEU 34 2HD1 LEU 34 4.411 -2.952 3.362
160 3HD1 LEU 34 3HD1 LEU 34 4.469 -2.739 1.604
161 1HD2 LEU 34 1HD2 LEU 34 2.156 -5.100 3.266
162 2HD2 LEU 34 2HD2 LEU 34 3.274 -6.482 3.281
163 3HD2 LEU 34 3HD2 LEU 34 3.587 -5.085 4.324
164 H CYS 35 H CYS 35 6.918 -4.237 -0.473
165 HA CYS 35 HA CYS 35 8.868 -5.042 -1.052
166 1HB CYS 35 1HB CYS 35 8.910 -5.647 1.067
167 2HB CYS 35 2HB CYS 35 8.038 -7.147 0.873
168 H ASP 36 H ASP 36 7.763 -5.084 -3.139
169 HA ASP 36 HA ASP 36 7.364 -7.758 -4.430
170 1HB ASP 36 1HB ASP 36 5.835 -5.832 -4.956
171 2HB ASP 36 2HB ASP 36 7.206 -4.970 -5.630
172 H GLY 37 H GLY 37 9.814 -5.483 -3.743
173 1HA GLY 37 1HA GLY 37 12.139 -5.623 -4.283
174 2HA GLY 37 2HA GLY 37 11.750 -6.665 -5.667
175 H HIS 38 H HIS 38 9.648 -4.241 -5.467
176 HA HIS 38 HA HIS 38 10.868 -2.253 -7.259
177 1HB HIS 38 1HB HIS 38 10.038 -3.858 -8.801
178 2HB HIS 38 2HB HIS 38 8.605 -4.174 -7.861
179 HD1 HIS 38 HD1 HIS 38 9.886 -1.313 -10.176
180 HD2 HIS 38 HD2 HIS 38 6.521 -2.686 -8.038
181 HE1 HIS 38 HE1 HIS 38 7.932 0.281 -10.752
182 HE2 HIS 38 HE2 HIS 38 5.863 -0.602 -9.477
183 HA PRO 39 HA PRO 39 8.179 -0.089 -4.268
184 1HB PRO 39 1HB PRO 39 8.662 2.492 -5.252
185 2HB PRO 39 2HB PRO 39 9.421 1.658 -3.891
186 1HG PRO 39 1HG PRO 39 10.700 2.328 -6.412
187 2HG PRO 39 2HG PRO 39 11.391 1.415 -5.039
188 1HD PRO 39 1HD PRO 39 10.223 0.398 -7.576
189 2HD PRO 39 2HD PRO 39 11.374 -0.393 -6.471
190 H ASP 40 H ASP 40 6.182 0.957 -4.346
191 HA ASP 40 HA ASP 40 5.226 2.104 -6.907
192 1HB ASP 40 1HB ASP 40 4.655 -0.588 -6.467
193 2HB ASP 40 2HB ASP 40 3.213 0.196 -5.856
194 H CYS 41 H CYS 41 5.601 2.476 -3.724
195 HA CYS 41 HA CYS 41 2.918 2.943 -2.951
196 1HB CYS 41 1HB CYS 41 5.303 2.628 -1.601
197 2HB CYS 41 2HB CYS 41 4.608 4.115 -1.011
198 H ASP 42 H ASP 42 3.885 4.714 -4.947
199 HA ASP 42 HA ASP 42 4.567 6.750 -5.607
200 1HB ASP 42 1HB ASP 42 2.066 7.066 -5.345
201 2HB ASP 42 2HB ASP 42 2.384 7.862 -3.805
202 H ASP 43 H ASP 43 5.176 5.998 -2.581
203 HA ASP 43 HA ASP 43 7.461 7.830 -2.594
204 1HB ASP 43 1HB ASP 43 5.647 8.012 -0.640
205 2HB ASP 43 2HB ASP 43 6.598 6.683 -0.009
206 H GLY 44 H GLY 44 6.515 4.845 -3.099
207 1HA GLY 44 1HA GLY 44 7.667 2.735 -3.188
208 2HA GLY 44 2HA GLY 44 9.160 3.588 -2.853
209 H ARG 45 H ARG 45 6.543 3.764 -0.698
210 HA ARG 45 HA ARG 45 8.239 2.669 1.504
211 1HB ARG 45 1HB ARG 45 6.714 3.645 3.110
212 2HB ARG 45 2HB ARG 45 7.347 4.860 2.010
213 1HG ARG 45 1HG ARG 45 5.266 4.981 0.797
214 2HG ARG 45 2HG ARG 45 4.584 3.616 1.701
215 1HD ARG 45 1HD ARG 45 5.481 6.200 3.021
216 2HD ARG 45 2HD ARG 45 3.850 5.972 2.363
217 HE ARG 45 HE ARG 45 4.220 3.763 3.995
218 1HH1 ARG 45 1HH1 ARG 45 4.172 7.213 4.573
219 2HH1 ARG 45 2HH1 ARG 45 3.572 7.018 6.201
220 1HH2 ARG 45 2HH2 ARG 45 3.497 3.581 6.072
221 2HH2 ARG 45 1HH2 ARG 45 3.205 5.014 7.019
222 H ASP 46 H ASP 46 6.510 1.252 -0.728
223 HA ASP 46 HA ASP 46 5.206 -0.663 0.968
224 1HB ASP 46 1HB ASP 46 4.902 -1.856 -1.150
225 2HB ASP 46 2HB ASP 46 4.138 -0.276 -1.197
226 H GLU 47 H GLU 47 8.162 0.015 -0.726
227 HA GLU 47 HA GLU 47 9.200 -2.671 -0.479
228 1HB GLU 47 1HB GLU 47 10.425 0.018 -1.145
229 2HB GLU 47 2HB GLU 47 11.391 -1.440 -1.101
230 1HG GLU 47 1HG GLU 47 8.848 -1.374 -2.738
231 2HG GLU 47 2HG GLU 47 10.316 -0.623 -3.327
232 H TRP 48 H TRP 48 9.291 0.207 1.340
233 HA TRP 48 HA TRP 48 11.726 -0.022 2.656
234 1HB TRP 48 1HB TRP 48 9.292 1.447 3.675
235 2HB TRP 48 2HB TRP 48 10.936 1.628 4.264
236 HD1 TRP 48 HD1 TRP 48 11.297 1.557 0.609
237 HE1 TRP 48 HE1 TRP 48 11.023 3.842 -0.452
238 HE3 TRP 48 HE3 TRP 48 9.653 4.019 4.687
239 HZ2 TRP 48 HZ2 TRP 48 10.375 6.594 0.477
240 HZ3 TRP 48 HZ3 TRP 48 9.230 6.521 4.633
241 HH2 TRP 48 HH2 TRP 48 9.600 7.780 2.523
242 H GLY 49 H GLY 49 12.357 -1.438 3.736
243 1HA GLY 49 1HA GLY 49 12.881 -2.692 5.692
244 2HA GLY 49 2HA GLY 49 11.363 -2.138 6.405
245 H CYS 50 H CYS 50 10.597 -3.456 3.362
246 HA CYS 50 HA CYS 50 9.112 -5.059 2.935
247 1HB CYS 50 1HB CYS 50 11.381 -5.534 2.220
248 2HB CYS 50 2HB CYS 50 11.732 -6.315 3.734
249 H GLY 51 H GLY 51 8.657 -4.335 5.600
250 1HA GLY 51 1HA GLY 51 6.946 -6.551 6.522
251 2HA GLY 51 2HA GLY 51 8.306 -6.213 7.594
Start of MODEL 15
1 H SER 10 H SER 10 -5.847 -0.588 5.136
2 HA SER 10 HA SER 10 -6.482 -3.285 5.979
3 1HB SER 10 1HB SER 10 -6.215 -2.111 8.189
4 2HB SER 10 2HB SER 10 -7.479 -0.970 7.699
5 HG SER 10 HG SER 10 -8.294 -2.759 8.924
6 H CYS 11 H CYS 11 -7.496 -3.576 4.135
7 HA CYS 11 HA CYS 11 -9.653 -1.771 3.180
8 1HB CYS 11 1HB CYS 11 -7.114 -1.764 2.232
9 2HB CYS 11 2HB CYS 11 -7.707 -3.110 1.308
10 HA PRO 12 HA PRO 12 -11.013 -6.216 2.336
11 1HB PRO 12 1HB PRO 12 -9.605 -6.763 -0.258
12 2HB PRO 12 2HB PRO 12 -11.319 -7.060 0.154
13 1HG PRO 12 1HG PRO 12 -10.607 -5.023 -1.507
14 2HG PRO 12 2HG PRO 12 -11.920 -4.822 -0.300
15 1HD PRO 12 1HD PRO 12 -9.023 -3.994 -0.076
16 2HD PRO 12 2HD PRO 12 -10.492 -3.034 0.277
17 HA PRO 13 HA PRO 13 -7.293 -8.285 3.712
18 1HB PRO 13 1HB PRO 13 -7.602 -10.944 3.170
19 2HB PRO 13 2HB PRO 13 -8.581 -10.095 4.409
20 1HG PRO 13 1HG PRO 13 -9.318 -10.683 1.530
21 2HG PRO 13 2HG PRO 13 -10.296 -10.999 3.003
22 1HD PRO 13 1HD PRO 13 -10.666 -8.788 1.466
23 2HD PRO 13 2HD PRO 13 -10.818 -8.697 3.248
24 H GLY 14 H GLY 14 -5.381 -8.942 3.122
25 1HA GLY 14 1HA GLY 14 -3.496 -9.006 1.829
26 2HA GLY 14 2HA GLY 14 -4.454 -9.657 0.506
27 H GLN 15 H GLN 15 -5.346 -6.452 1.787
28 HA GLN 15 HA GLN 15 -3.925 -5.033 -0.335
29 1HB GLN 15 1HB GLN 15 -6.882 -5.268 -0.037
30 2HB GLN 15 2HB GLN 15 -6.209 -3.691 -0.466
31 1HG GLN 15 1HG GLN 15 -5.265 -4.426 -2.468
32 2HG GLN 15 2HG GLN 15 -5.241 -6.120 -1.969
33 1HE2 GLN 15 2HE2 GLN 15 -7.368 -7.208 -1.634
34 2HE2 GLN 15 1HE2 GLN 15 -8.553 -6.827 -2.877
35 H PHE 16 H PHE 16 -2.933 -3.414 0.525
36 HA PHE 16 HA PHE 16 -3.816 -2.218 3.155
37 1HB PHE 16 1HB PHE 16 -1.613 -2.098 3.936
38 2HB PHE 16 2HB PHE 16 -1.702 -3.687 3.212
39 HD1 PHE 16 HD1 PHE 16 0.031 -0.509 3.249
40 HD2 PHE 16 HD2 PHE 16 -0.834 -3.905 0.784
41 HE1 PHE 16 HE1 PHE 16 1.800 0.191 1.678
42 HE2 PHE 16 HE2 PHE 16 0.992 -3.282 -0.752
43 HZ PHE 16 HZ PHE 16 2.285 -1.253 -0.380
44 H ARG 17 H ARG 17 -3.086 0.062 3.540
45 HA ARG 17 HA ARG 17 -2.931 1.614 0.986
46 1HB ARG 17 1HB ARG 17 -3.782 3.511 2.120
47 2HB ARG 17 2HB ARG 17 -4.868 2.112 2.284
48 1HG ARG 17 1HG ARG 17 -4.068 1.779 4.623
49 2HG ARG 17 2HG ARG 17 -3.011 3.187 4.454
50 1HD ARG 17 1HD ARG 17 -5.056 3.817 5.643
51 2HD ARG 17 2HD ARG 17 -4.954 4.647 4.094
52 HE ARG 17 HE ARG 17 -6.859 3.560 3.348
53 1HH1 ARG 17 1HH1 ARG 17 -5.939 1.890 6.303
54 2HH1 ARG 17 2HH1 ARG 17 -7.382 0.894 6.218
55 1HH2 ARG 17 2HH2 ARG 17 -8.527 2.224 3.304
56 2HH2 ARG 17 1HH2 ARG 17 -8.687 0.954 4.518
57 H CYS 18 H CYS 18 -1.567 3.147 0.611
58 HA CYS 18 HA CYS 18 1.108 2.753 1.742
59 1HB CYS 18 1HB CYS 18 -0.094 3.942 -0.747
60 2HB CYS 18 2HB CYS 18 1.544 4.386 -0.285
61 H SER 19 H SER 19 0.138 5.707 0.446
62 HA SER 19 HA SER 19 1.463 7.154 2.696
63 1HB SER 19 1HB SER 19 1.473 7.856 -0.264
64 2HB SER 19 2HB SER 19 2.397 8.676 1.011
65 HG SER 19 HG SER 19 3.009 6.446 -0.364
66 H GLU 20 H GLU 20 -1.170 6.736 2.650
67 HA GLU 20 HA GLU 20 -2.156 9.470 3.241
68 1HB GLU 20 1HB GLU 20 -3.013 8.901 1.041
69 2HB GLU 20 2HB GLU 20 -3.754 7.432 1.667
70 1HG GLU 20 1HG GLU 20 -5.281 8.730 3.072
71 2HG GLU 20 2HG GLU 20 -4.425 10.224 2.685
72 HA PRO 21 HA PRO 21 -2.682 6.999 6.940
73 1HB PRO 21 1HB PRO 21 -3.454 8.938 8.723
74 2HB PRO 21 2HB PRO 21 -1.812 8.870 8.015
75 1HG PRO 21 1HG PRO 21 -4.184 10.517 7.057
76 2HG PRO 21 2HG PRO 21 -2.521 11.090 7.425
77 1HD PRO 21 1HD PRO 21 -3.268 10.474 4.885
78 2HD PRO 21 2HD PRO 21 -1.638 10.054 5.489
79 HA PRO 22 HA PRO 22 -6.936 5.838 7.716
80 1HB PRO 22 1HB PRO 22 -6.392 6.404 10.637
81 2HB PRO 22 2HB PRO 22 -7.215 4.991 9.899
82 1HG PRO 22 1HG PRO 22 -4.668 4.791 10.676
83 2HG PRO 22 2HG PRO 22 -5.148 4.128 9.077
84 1HD PRO 22 1HD PRO 22 -3.781 6.768 9.682
85 2HD PRO 22 2HD PRO 22 -3.398 5.563 8.413
86 H GLY 23 H GLY 23 -8.928 6.494 8.822
87 1HA GLY 23 1HA GLY 23 -10.691 8.033 9.011
88 2HA GLY 23 2HA GLY 23 -9.516 9.317 9.291
89 H ALA 24 H ALA 24 -8.257 8.320 6.614
90 HA ALA 24 HA ALA 24 -10.244 9.281 4.621
91 1HB ALA 24 1HB ALA 24 -8.560 11.033 4.965
92 2HB ALA 24 2HB ALA 24 -7.250 9.864 4.690
93 3HB ALA 24 3HB ALA 24 -8.359 10.288 3.368
94 H HIS 25 H HIS 25 -10.795 7.016 4.662
95 HA HIS 25 HA HIS 25 -9.207 4.837 4.564
96 1HB HIS 25 1HB HIS 25 -11.937 5.167 3.249
97 2HB HIS 25 2HB HIS 25 -11.222 3.665 3.792
98 HD1 HIS 25 HD1 HIS 25 -10.580 3.813 6.669
99 HD2 HIS 25 HD2 HIS 25 -13.642 6.166 4.931
100 HE1 HIS 25 HE1 HIS 25 -12.102 4.587 8.602
101 HE2 HIS 25 HE2 HIS 25 -13.962 6.016 7.538
102 H GLY 26 H GLY 26 -10.263 6.541 1.770
103 1HA GLY 26 1HA GLY 26 -9.484 6.667 -0.433
104 2HA GLY 26 2HA GLY 26 -7.942 6.186 0.276
105 H GLU 27 H GLU 27 -7.359 5.129 -1.555
106 HA GLU 27 HA GLU 27 -8.477 2.382 -1.965
107 1HB GLU 27 1HB GLU 27 -9.287 3.893 -3.797
108 2HB GLU 27 2HB GLU 27 -7.610 4.276 -4.207
109 1HG GLU 27 1HG GLU 27 -7.188 1.902 -4.754
110 2HG GLU 27 2HG GLU 27 -8.817 1.472 -4.230
111 H CYS 28 H CYS 28 -7.298 1.165 -1.239
112 HA CYS 28 HA CYS 28 -4.553 1.142 -0.701
113 1HB CYS 28 1HB CYS 28 -5.290 -1.292 -0.351
114 2HB CYS 28 2HB CYS 28 -6.035 -0.061 0.589
115 H TYR 29 H TYR 29 -3.526 -1.056 -1.241
116 HA TYR 29 HA TYR 29 -3.509 -1.759 -4.107
117 1HB TYR 29 1HB TYR 29 -0.995 -0.935 -2.572
118 2HB TYR 29 2HB TYR 29 -0.997 -1.567 -4.197
119 HD1 TYR 29 HD1 TYR 29 -1.298 1.362 -2.093
120 HD2 TYR 29 HD2 TYR 29 -1.935 -0.089 -6.118
121 HE1 TYR 29 HE1 TYR 29 -1.484 3.702 -2.921
122 HE2 TYR 29 HE2 TYR 29 -2.110 2.244 -6.923
123 HH TYR 29 HH TYR 29 -1.846 5.059 -4.727
124 HA PRO 30 HA PRO 30 -3.078 -5.817 -2.424
125 1HB PRO 30 1HB PRO 30 -0.959 -6.481 -4.395
126 2HB PRO 30 2HB PRO 30 -2.515 -7.302 -4.088
127 1HG PRO 30 1HG PRO 30 -2.145 -5.747 -6.315
128 2HG PRO 30 2HG PRO 30 -3.701 -5.722 -5.420
129 1HD PRO 30 1HD PRO 30 -1.398 -3.765 -5.234
130 2HD PRO 30 2HD PRO 30 -3.146 -3.430 -5.385
131 H GLN 31 H GLN 31 -1.839 -6.936 -0.992
132 HA GLN 31 HA GLN 31 0.785 -5.866 -0.142
133 1HB GLN 31 1HB GLN 31 -0.847 -8.301 0.765
134 2HB GLN 31 2HB GLN 31 0.669 -7.795 1.521
135 1HG GLN 31 1HG GLN 31 -0.281 -5.723 2.288
136 2HG GLN 31 2HG GLN 31 -1.762 -5.971 1.360
137 1HE2 GLN 31 1HE2 GLN 31 -0.036 -8.331 3.552
138 2HE2 GLN 31 2HE2 GLN 31 -1.444 -8.489 4.595
139 H ASP 32 H ASP 32 -0.101 -7.815 -2.626
140 HA ASP 32 HA ASP 32 2.353 -9.296 -2.963
141 1HB ASP 32 1HB ASP 32 0.087 -9.399 -4.277
142 2HB ASP 32 2HB ASP 32 0.630 -7.970 -5.108
143 H TRP 33 H TRP 33 1.264 -6.114 -3.435
144 HA TRP 33 HA TRP 33 3.869 -5.015 -4.227
145 1HB TRP 33 1HB TRP 33 1.288 -3.499 -3.982
146 2HB TRP 33 2HB TRP 33 2.791 -2.973 -4.688
147 HD1 TRP 33 HD1 TRP 33 2.104 -6.288 -6.166
148 HE1 TRP 33 HE1 TRP 33 0.839 -6.124 -8.382
149 HE3 TRP 33 HE3 TRP 33 0.887 -1.314 -6.033
150 HZ2 TRP 33 HZ2 TRP 33 -0.659 -4.144 -9.839
151 HZ3 TRP 33 HZ3 TRP 33 -0.446 -0.309 -7.883
152 HH2 TRP 33 HH2 TRP 33 -1.277 -1.721 -9.743
153 H LEU 34 H LEU 34 3.703 -6.143 -1.922
154 HA LEU 34 HA LEU 34 4.815 -3.957 -0.245
155 1HB LEU 34 1HB LEU 34 2.554 -4.748 0.676
156 2HB LEU 34 2HB LEU 34 3.282 -6.323 0.914
157 HG LEU 34 HG LEU 34 5.056 -5.140 2.367
158 1HD1 LEU 34 1HD1 LEU 34 2.929 -2.962 2.407
159 2HD1 LEU 34 2HD1 LEU 34 4.423 -3.012 3.366
160 3HD1 LEU 34 3HD1 LEU 34 4.502 -2.813 1.609
161 1HD2 LEU 34 1HD2 LEU 34 3.555 -5.120 4.335
162 2HD2 LEU 34 2HD2 LEU 34 2.136 -5.111 3.264
163 3HD2 LEU 34 3HD2 LEU 34 3.223 -6.519 3.301
164 H CYS 35 H CYS 35 6.918 -4.303 -0.487
165 HA CYS 35 HA CYS 35 8.842 -5.079 -1.134
166 1HB CYS 35 1HB CYS 35 8.967 -5.737 0.968
167 2HB CYS 35 2HB CYS 35 8.106 -7.242 0.763
168 H ASP 36 H ASP 36 7.741 -5.075 -3.194
169 HA ASP 36 HA ASP 36 7.340 -7.720 -4.547
170 1HB ASP 36 1HB ASP 36 5.792 -5.805 -5.023
171 2HB ASP 36 2HB ASP 36 7.156 -4.903 -5.673
172 H GLY 37 H GLY 37 9.781 -5.436 -3.829
173 1HA GLY 37 1HA GLY 37 12.105 -5.564 -4.379
174 2HA GLY 37 2HA GLY 37 11.713 -6.576 -5.783
175 H HIS 38 H HIS 38 9.604 -4.156 -5.521
176 HA HIS 38 HA HIS 38 10.820 -2.123 -7.263
177 1HB HIS 38 1HB HIS 38 10.002 -3.684 -8.850
178 2HB HIS 38 2HB HIS 38 8.580 -4.055 -7.914
179 HD1 HIS 38 HD1 HIS 38 9.782 -1.122 -10.175
180 HD2 HIS 38 HD2 HIS 38 6.469 -2.601 -8.024
181 HE1 HIS 38 HE1 HIS 38 7.792 0.443 -10.697
182 HE2 HIS 38 HE2 HIS 38 5.753 -0.507 -9.417
183 HA PRO 39 HA PRO 39 8.140 -0.016 -4.239
184 1HB PRO 39 1HB PRO 39 8.502 2.581 -5.180
185 2HB PRO 39 2HB PRO 39 9.402 1.739 -3.916
186 1HG PRO 39 1HG PRO 39 10.343 2.460 -6.609
187 2HG PRO 39 2HG PRO 39 11.279 1.749 -5.263
188 1HD PRO 39 1HD PRO 39 10.130 0.434 -7.629
189 2HD PRO 39 2HD PRO 39 11.288 -0.224 -6.451
190 H ASP 40 H ASP 40 6.103 0.964 -4.268
191 HA ASP 40 HA ASP 40 5.084 2.129 -6.797
192 1HB ASP 40 1HB ASP 40 4.543 -0.577 -6.356
193 2HB ASP 40 2HB ASP 40 3.102 0.202 -5.733
194 H CYS 41 H CYS 41 5.532 2.479 -3.621
195 HA CYS 41 HA CYS 41 2.866 2.923 -2.796
196 1HB CYS 41 1HB CYS 41 5.284 2.623 -1.494
197 2HB CYS 41 2HB CYS 41 4.577 4.095 -0.868
198 H ASP 42 H ASP 42 3.792 4.711 -4.798
199 HA ASP 42 HA ASP 42 4.452 6.751 -5.465
200 1HB ASP 42 1HB ASP 42 1.964 7.088 -5.143
201 2HB ASP 42 2HB ASP 42 2.318 7.850 -3.594
202 H ASP 43 H ASP 43 5.089 5.984 -2.446
203 HA ASP 43 HA ASP 43 7.358 7.842 -2.336
204 1HB ASP 43 1HB ASP 43 5.493 8.004 -0.515
205 2HB ASP 43 2HB ASP 43 6.245 6.548 0.102
206 H GLY 44 H GLY 44 6.460 4.853 -2.990
207 1HA GLY 44 1HA GLY 44 7.607 2.744 -3.095
208 2HA GLY 44 2HA GLY 44 9.096 3.604 -2.761
209 H ARG 45 H ARG 45 6.499 3.711 -0.562
210 HA ARG 45 HA ARG 45 8.262 2.594 1.574
211 1HB ARG 45 1HB ARG 45 6.883 3.537 3.243
212 2HB ARG 45 2HB ARG 45 7.267 4.789 2.071
213 1HG ARG 45 1HG ARG 45 5.011 4.677 1.133
214 2HG ARG 45 2HG ARG 45 4.627 3.265 2.134
215 1HD ARG 45 1HD ARG 45 3.614 5.231 3.091
216 2HD ARG 45 2HD ARG 45 4.881 4.619 4.167
217 HE ARG 45 HE ARG 45 5.796 6.713 2.330
218 1HH1 ARG 45 2HH1 ARG 45 4.187 6.325 5.414
219 2HH1 ARG 45 1HH1 ARG 45 4.741 7.881 5.983
220 1HH2 ARG 45 2HH2 ARG 45 6.514 8.568 3.101
221 2HH2 ARG 45 1HH2 ARG 45 6.020 9.158 4.687
222 H ASP 46 H ASP 46 6.489 1.205 -0.648
223 HA ASP 46 HA ASP 46 5.220 -0.754 1.020
224 1HB ASP 46 1HB ASP 46 4.892 -1.900 -1.118
225 2HB ASP 46 2HB ASP 46 4.143 -0.310 -1.135
226 H GLU 47 H GLU 47 8.149 -0.025 -0.697
227 HA GLU 47 HA GLU 47 9.216 -2.703 -0.528
228 1HB GLU 47 1HB GLU 47 10.406 0.017 -1.140
229 2HB GLU 47 2HB GLU 47 11.387 -1.431 -1.144
230 1HG GLU 47 1HG GLU 47 8.823 -1.353 -2.747
231 2HG GLU 47 2HG GLU 47 10.277 -0.581 -3.340
232 H TRP 48 H TRP 48 9.302 0.118 1.374
233 HA TRP 48 HA TRP 48 11.769 -0.098 2.614
234 1HB TRP 48 1HB TRP 48 9.328 1.270 3.747
235 2HB TRP 48 2HB TRP 48 10.978 1.469 4.313
236 HD1 TRP 48 HD1 TRP 48 11.245 1.550 0.643
237 HE1 TRP 48 HE1 TRP 48 10.897 3.872 -0.311
238 HE3 TRP 48 HE3 TRP 48 9.677 3.805 4.867
239 HZ2 TRP 48 HZ2 TRP 48 10.194 6.567 0.748
240 HZ3 TRP 48 HZ3 TRP 48 9.194 6.294 4.932
241 HH2 TRP 48 HH2 TRP 48 9.469 7.648 2.868
242 H GLY 49 H GLY 49 12.474 -1.532 3.611
243 1HA GLY 49 1HA GLY 49 13.110 -2.849 5.484
244 2HA GLY 49 2HA GLY 49 11.618 -2.353 6.289
245 H CYS 50 H CYS 50 10.716 -3.577 3.251
246 HA CYS 50 HA CYS 50 9.246 -5.192 2.836
247 1HB CYS 50 1HB CYS 50 11.487 -5.605 1.999
248 2HB CYS 50 2HB CYS 50 11.924 -6.421 3.470
249 H GLY 51 H GLY 51 8.986 -4.600 5.606
250 1HA GLY 51 1HA GLY 51 7.514 -7.013 6.575
251 2HA GLY 51 2HA GLY 51 8.808 -6.389 7.597
Start of MODEL 16
1 H SER 10 H SER 10 -6.000 -0.856 6.156
2 HA SER 10 HA SER 10 -7.793 -2.906 7.146
3 1HB SER 10 1HB SER 10 -8.036 -0.038 8.188
4 2HB SER 10 2HB SER 10 -9.387 -1.184 8.185
5 HG SER 10 HG SER 10 -6.897 -1.848 9.366
6 H CYS 11 H CYS 11 -8.190 -3.426 5.244
7 HA CYS 11 HA CYS 11 -9.211 -1.757 3.080
8 1HB CYS 11 1HB CYS 11 -6.524 -3.002 3.743
9 2HB CYS 11 2HB CYS 11 -7.074 -3.193 2.149
10 HA PRO 12 HA PRO 12 -10.795 -5.934 2.197
11 1HB PRO 12 1HB PRO 12 -9.544 -6.205 -0.485
12 2HB PRO 12 2HB PRO 12 -11.278 -6.154 -0.079
13 1HG PRO 12 1HG PRO 12 -10.010 -4.068 -1.354
14 2HG PRO 12 2HG PRO 12 -11.359 -3.825 -0.201
15 1HD PRO 12 1HD PRO 12 -8.391 -3.587 0.318
16 2HD PRO 12 2HD PRO 12 -9.708 -2.489 0.806
17 HA PRO 13 HA PRO 13 -7.434 -8.723 3.048
18 1HB PRO 13 1HB PRO 13 -7.999 -11.144 1.903
19 2HB PRO 13 2HB PRO 13 -8.951 -10.475 3.266
20 1HG PRO 13 1HG PRO 13 -9.571 -10.318 0.306
21 2HG PRO 13 2HG PRO 13 -10.666 -10.829 1.634
22 1HD PRO 13 1HD PRO 13 -10.695 -8.304 0.628
23 2HD PRO 13 2HD PRO 13 -10.941 -8.592 2.380
24 H GLY 14 H GLY 14 -5.587 -9.487 2.423
25 1HA GLY 14 1HA GLY 14 -3.583 -9.327 1.334
26 2HA GLY 14 2HA GLY 14 -4.417 -9.820 -0.136
27 H GLN 15 H GLN 15 -5.186 -6.779 1.580
28 HA GLN 15 HA GLN 15 -3.736 -5.155 -0.372
29 1HB GLN 15 1HB GLN 15 -6.681 -5.230 0.052
30 2HB GLN 15 2HB GLN 15 -5.922 -3.651 -0.164
31 1HG GLN 15 1HG GLN 15 -5.170 -4.112 -2.317
32 2HG GLN 15 2HG GLN 15 -5.166 -5.861 -2.072
33 1HE2 GLN 15 2HE2 GLN 15 -7.345 -6.898 -1.697
34 2HE2 GLN 15 1HE2 GLN 15 -8.556 -6.348 -2.855
35 H PHE 16 H PHE 16 -2.946 -3.427 0.496
36 HA PHE 16 HA PHE 16 -3.795 -2.350 3.189
37 1HB PHE 16 1HB PHE 16 -1.602 -2.110 4.011
38 2HB PHE 16 2HB PHE 16 -1.621 -3.721 3.331
39 HD1 PHE 16 HD1 PHE 16 0.091 -0.548 3.359
40 HD2 PHE 16 HD2 PHE 16 -0.789 -3.921 0.875
41 HE1 PHE 16 HE1 PHE 16 1.843 0.172 1.768
42 HE2 PHE 16 HE2 PHE 16 0.989 -3.255 -0.699
43 HZ PHE 16 HZ PHE 16 2.302 -1.255 -0.307
44 H ARG 17 H ARG 17 -3.123 0.027 3.533
45 HA ARG 17 HA ARG 17 -2.945 1.479 0.928
46 1HB ARG 17 1HB ARG 17 -3.798 3.424 1.978
47 2HB ARG 17 2HB ARG 17 -4.890 2.039 2.213
48 1HG ARG 17 1HG ARG 17 -4.120 1.814 4.554
49 2HG ARG 17 2HG ARG 17 -2.987 3.155 4.324
50 1HD ARG 17 1HD ARG 17 -4.997 3.932 5.493
51 2HD ARG 17 2HD ARG 17 -4.821 4.714 3.926
52 HE ARG 17 HE ARG 17 -6.796 3.754 3.194
53 1HH1 ARG 17 2HH2 ARG 17 -5.988 2.043 6.168
54 2HH1 ARG 17 1HH2 ARG 17 -7.472 1.102 6.027
55 1HH2 ARG 17 1HH1 ARG 17 -8.530 2.504 3.142
56 2HH2 ARG 17 2HH1 ARG 17 -8.771 1.264 4.379
57 H CYS 18 H CYS 18 -1.623 3.073 0.551
58 HA CYS 18 HA CYS 18 1.067 2.697 1.671
59 1HB CYS 18 1HB CYS 18 -0.142 3.879 -0.821
60 2HB CYS 18 2HB CYS 18 1.507 4.294 -0.371
61 H SER 19 H SER 19 0.116 5.631 0.328
62 HA SER 19 HA SER 19 1.551 7.087 2.475
63 1HB SER 19 1HB SER 19 2.214 8.651 0.588
64 2HB SER 19 2HB SER 19 2.775 6.983 0.428
65 HG SER 19 HG SER 19 1.801 6.933 -1.395
66 H GLU 20 H GLU 20 -1.092 6.676 2.622
67 HA GLU 20 HA GLU 20 -2.015 9.411 3.307
68 1HB GLU 20 1HB GLU 20 -2.996 8.878 1.147
69 2HB GLU 20 2HB GLU 20 -3.717 7.405 1.792
70 1HG GLU 20 1HG GLU 20 -5.177 8.697 3.264
71 2HG GLU 20 2HG GLU 20 -4.307 10.186 2.887
72 HA PRO 21 HA PRO 21 -2.570 6.990 7.065
73 1HB PRO 21 1HB PRO 21 -3.505 8.953 8.752
74 2HB PRO 21 2HB PRO 21 -1.819 8.900 8.156
75 1HG PRO 21 1HG PRO 21 -4.151 10.489 7.027
76 2HG PRO 21 2HG PRO 21 -2.517 11.088 7.467
77 1HD PRO 21 1HD PRO 21 -3.128 10.415 4.909
78 2HD PRO 21 2HD PRO 21 -1.525 10.026 5.598
79 HA PRO 22 HA PRO 22 -6.878 5.848 7.404
80 1HB PRO 22 1HB PRO 22 -7.264 5.258 10.058
81 2HB PRO 22 2HB PRO 22 -6.287 4.246 8.951
82 1HG PRO 22 1HG PRO 22 -5.306 6.407 10.846
83 2HG PRO 22 2HG PRO 22 -4.722 4.720 10.679
84 1HD PRO 22 1HD PRO 22 -3.463 6.777 9.437
85 2HD PRO 22 2HD PRO 22 -3.655 5.205 8.609
86 H GLY 23 H GLY 23 -8.916 6.346 8.658
87 1HA GLY 23 1HA GLY 23 -10.582 7.941 9.087
88 2HA GLY 23 2HA GLY 23 -9.340 9.142 9.435
89 H ALA 24 H ALA 24 -8.250 8.147 6.642
90 HA ALA 24 HA ALA 24 -10.204 9.350 4.763
91 1HB ALA 24 1HB ALA 24 -8.497 11.064 5.192
92 2HB ALA 24 2HB ALA 24 -7.202 9.903 4.824
93 3HB ALA 24 3HB ALA 24 -8.324 10.419 3.547
94 H HIS 25 H HIS 25 -10.810 7.125 4.552
95 HA HIS 25 HA HIS 25 -9.248 4.933 4.401
96 1HB HIS 25 1HB HIS 25 -11.918 5.385 3.005
97 2HB HIS 25 2HB HIS 25 -11.239 3.837 3.460
98 HD1 HIS 25 HD1 HIS 25 -13.707 6.149 4.729
99 HD2 HIS 25 HD2 HIS 25 -10.572 3.824 6.368
100 HE1 HIS 25 HE1 HIS 25 -14.206 5.915 7.245
101 HE2 HIS 25 HE2 HIS 25 -12.305 4.494 8.240
102 H GLY 26 H GLY 26 -10.142 6.799 1.648
103 1HA GLY 26 1HA GLY 26 -9.329 6.920 -0.557
104 2HA GLY 26 2HA GLY 26 -7.812 6.377 0.167
105 H GLU 27 H GLU 27 -7.113 5.111 -1.416
106 HA GLU 27 HA GLU 27 -8.424 2.478 -1.894
107 1HB GLU 27 1HB GLU 27 -7.268 4.328 -4.042
108 2HB GLU 27 2HB GLU 27 -7.556 2.614 -4.291
109 1HG GLU 27 1HG GLU 27 -9.691 4.691 -3.644
110 2HG GLU 27 2HG GLU 27 -9.328 4.052 -5.240
111 H CYS 28 H CYS 28 -7.391 1.107 -1.174
112 HA CYS 28 HA CYS 28 -4.699 0.938 -0.409
113 1HB CYS 28 1HB CYS 28 -6.653 -1.262 -1.170
114 2HB CYS 28 2HB CYS 28 -5.417 -1.281 0.039
115 H TYR 29 H TYR 29 -3.529 -1.133 -1.182
116 HA TYR 29 HA TYR 29 -3.497 -1.669 -4.067
117 1HB TYR 29 1HB TYR 29 -1.019 -0.829 -2.475
118 2HB TYR 29 2HB TYR 29 -0.977 -1.461 -4.103
119 HD1 TYR 29 HD1 TYR 29 -1.759 -0.060 -6.049
120 HD2 TYR 29 HD2 TYR 29 -1.572 1.485 -2.019
121 HE1 TYR 29 HE1 TYR 29 -1.939 2.254 -6.924
122 HE2 TYR 29 HE2 TYR 29 -1.761 3.805 -2.909
123 HH TYR 29 HH TYR 29 -1.969 5.116 -4.773
124 HA PRO 30 HA PRO 30 -3.021 -5.760 -2.541
125 1HB PRO 30 1HB PRO 30 -0.829 -6.325 -4.478
126 2HB PRO 30 2HB PRO 30 -2.372 -7.193 -4.241
127 1HG PRO 30 1HG PRO 30 -1.994 -5.551 -6.396
128 2HG PRO 30 2HG PRO 30 -3.565 -5.583 -5.530
129 1HD PRO 30 1HD PRO 30 -1.301 -3.598 -5.233
130 2HD PRO 30 2HD PRO 30 -3.050 -3.286 -5.403
131 H GLN 31 H GLN 31 -1.805 -6.969 -1.135
132 HA GLN 31 HA GLN 31 0.764 -5.882 -0.137
133 1HB GLN 31 1HB GLN 31 -0.854 -8.389 0.630
134 2HB GLN 31 2HB GLN 31 0.604 -7.850 1.471
135 1HG GLN 31 1HG GLN 31 -0.501 -5.825 2.226
136 2HG GLN 31 2HG GLN 31 -1.943 -6.198 1.290
137 1HE2 GLN 31 1HE2 GLN 31 -3.312 -6.155 3.284
138 2HE2 GLN 31 2HE2 GLN 31 -3.148 -7.504 4.394
139 H ASP 32 H ASP 32 -0.089 -7.822 -2.688
140 HA ASP 32 HA ASP 32 2.383 -9.272 -3.004
141 1HB ASP 32 1HB ASP 32 0.135 -9.386 -4.343
142 2HB ASP 32 2HB ASP 32 0.672 -7.948 -5.158
143 H TRP 33 H TRP 33 1.270 -6.098 -3.450
144 HA TRP 33 HA TRP 33 3.873 -4.967 -4.204
145 1HB TRP 33 1HB TRP 33 1.272 -3.477 -3.989
146 2HB TRP 33 2HB TRP 33 2.783 -2.927 -4.650
147 HD1 TRP 33 HD1 TRP 33 2.161 -6.240 -6.171
148 HE1 TRP 33 HE1 TRP 33 0.959 -6.077 -8.420
149 HE3 TRP 33 HE3 TRP 33 0.872 -1.281 -6.040
150 HZ2 TRP 33 HZ2 TRP 33 -0.522 -4.108 -9.904
151 HZ3 TRP 33 HZ3 TRP 33 -0.428 -0.286 -7.919
152 HH2 TRP 33 HH2 TRP 33 -1.184 -1.697 -9.808
153 H LEU 34 H LEU 34 3.688 -6.121 -1.920
154 HA LEU 34 HA LEU 34 4.790 -3.949 -0.221
155 1HB LEU 34 1HB LEU 34 2.532 -4.742 0.698
156 2HB LEU 34 2HB LEU 34 3.244 -6.327 0.902
157 HG LEU 34 HG LEU 34 5.028 -5.214 2.382
158 1HD1 LEU 34 1HD1 LEU 34 4.560 -2.861 1.661
159 2HD1 LEU 34 2HD1 LEU 34 2.970 -2.973 2.433
160 3HD1 LEU 34 3HD1 LEU 34 4.450 -3.083 3.412
161 1HD2 LEU 34 1HD2 LEU 34 2.106 -5.118 3.266
162 2HD2 LEU 34 2HD2 LEU 34 3.157 -6.552 3.290
163 3HD2 LEU 34 3HD2 LEU 34 3.518 -5.176 4.345
164 H CYS 35 H CYS 35 6.888 -4.287 -0.478
165 HA CYS 35 HA CYS 35 8.839 -5.073 -1.059
166 1HB CYS 35 1HB CYS 35 8.865 -5.730 1.059
167 2HB CYS 35 2HB CYS 35 8.025 -7.231 0.818
168 H ASP 36 H ASP 36 7.742 -5.079 -3.149
169 HA ASP 36 HA ASP 36 7.341 -7.737 -4.477
170 1HB ASP 36 1HB ASP 36 5.802 -5.814 -4.971
171 2HB ASP 36 2HB ASP 36 7.168 -4.933 -5.637
172 H GLY 37 H GLY 37 9.795 -5.477 -3.760
173 1HA GLY 37 1HA GLY 37 12.114 -5.605 -4.310
174 2HA GLY 37 2HA GLY 37 11.725 -6.635 -5.702
175 H HIS 38 H HIS 38 9.619 -4.219 -5.486
176 HA HIS 38 HA HIS 38 10.842 -2.204 -7.245
177 1HB HIS 38 1HB HIS 38 10.025 -3.788 -8.814
178 2HB HIS 38 2HB HIS 38 8.590 -4.126 -7.884
179 HD1 HIS 38 HD1 HIS 38 9.858 -1.228 -10.158
180 HD2 HIS 38 HD2 HIS 38 6.496 -2.651 -8.048
181 HE1 HIS 38 HE1 HIS 38 7.893 0.356 -10.726
182 HE2 HIS 38 HE2 HIS 38 5.828 -0.556 -9.468
183 HA PRO 39 HA PRO 39 8.130 -0.090 -4.241
184 1HB PRO 39 1HB PRO 39 8.594 2.505 -5.213
185 2HB PRO 39 2HB PRO 39 9.327 1.677 -3.835
186 1HG PRO 39 1HG PRO 39 10.683 2.367 -6.299
187 2HG PRO 39 2HG PRO 39 11.321 1.404 -4.936
188 1HD PRO 39 1HD PRO 39 10.173 0.475 -7.525
189 2HD PRO 39 2HD PRO 39 11.331 -0.345 -6.448
190 H ASP 40 H ASP 40 6.120 0.916 -4.316
191 HA ASP 40 HA ASP 40 5.150 2.081 -6.863
192 1HB ASP 40 1HB ASP 40 4.650 -0.627 -6.495
193 2HB ASP 40 2HB ASP 40 3.190 0.094 -5.845
194 H CYS 41 H CYS 41 5.500 2.410 -3.676
195 HA CYS 41 HA CYS 41 2.816 2.804 -2.898
196 1HB CYS 41 1HB CYS 41 5.226 2.603 -1.552
197 2HB CYS 41 2HB CYS 41 4.434 4.040 -0.943
198 H ASP 42 H ASP 42 3.718 4.600 -4.903
199 HA ASP 42 HA ASP 42 4.360 6.643 -5.585
200 1HB ASP 42 1HB ASP 42 1.861 6.945 -5.303
201 2HB ASP 42 2HB ASP 42 2.184 7.742 -3.765
202 H ASP 43 H ASP 43 4.954 5.916 -2.554
203 HA ASP 43 HA ASP 43 7.159 7.846 -2.341
204 1HB ASP 43 1HB ASP 43 5.248 7.903 -0.595
205 2HB ASP 43 2HB ASP 43 5.950 6.404 -0.029
206 H GLY 44 H GLY 44 6.363 4.817 -3.065
207 1HA GLY 44 1HA GLY 44 7.557 2.737 -3.156
208 2HA GLY 44 2HA GLY 44 9.024 3.627 -2.815
209 H ARG 45 H ARG 45 6.417 3.680 -0.624
210 HA ARG 45 HA ARG 45 8.211 2.621 1.516
211 1HB ARG 45 1HB ARG 45 6.826 3.556 3.177
212 2HB ARG 45 2HB ARG 45 7.129 4.808 1.981
213 1HG ARG 45 1HG ARG 45 4.865 4.567 1.080
214 2HG ARG 45 2HG ARG 45 4.576 3.143 2.092
215 1HD ARG 45 1HD ARG 45 3.453 4.968 3.094
216 2HD ARG 45 2HD ARG 45 4.832 4.562 4.122
217 HE ARG 45 HE ARG 45 5.709 6.630 2.387
218 1HH1 ARG 45 1HH1 ARG 45 3.284 6.373 4.905
219 2HH1 ARG 45 2HH1 ARG 45 3.457 8.060 5.326
220 1HH2 ARG 45 2HH2 ARG 45 5.889 8.625 2.938
221 2HH2 ARG 45 1HH2 ARG 45 4.912 9.354 4.218
222 H ASP 46 H ASP 46 6.457 1.178 -0.693
223 HA ASP 46 HA ASP 46 5.224 -0.793 0.988
224 1HB ASP 46 1HB ASP 46 4.960 -1.971 -1.155
225 2HB ASP 46 2HB ASP 46 4.133 -0.419 -1.162
226 H GLU 47 H GLU 47 8.141 -0.022 -0.729
227 HA GLU 47 HA GLU 47 9.251 -2.679 -0.503
228 1HB GLU 47 1HB GLU 47 10.400 0.047 -1.161
229 2HB GLU 47 2HB GLU 47 11.406 -1.385 -1.130
230 1HG GLU 47 1HG GLU 47 8.846 -1.381 -2.741
231 2HG GLU 47 2HG GLU 47 10.293 -0.604 -3.344
232 H TRP 48 H TRP 48 9.285 0.177 1.357
233 HA TRP 48 HA TRP 48 11.750 0.013 2.616
234 1HB TRP 48 1HB TRP 48 9.287 1.364 3.720
235 2HB TRP 48 2HB TRP 48 10.933 1.595 4.282
236 HD1 TRP 48 HD1 TRP 48 11.189 1.628 0.607
237 HE1 TRP 48 HE1 TRP 48 10.797 3.925 -0.377
238 HE3 TRP 48 HE3 TRP 48 9.614 3.912 4.810
239 HZ2 TRP 48 HZ2 TRP 48 10.025 6.626 0.649
240 HZ3 TRP 48 HZ3 TRP 48 9.088 6.394 4.846
241 HH2 TRP 48 HH2 TRP 48 9.309 7.721 2.758
242 H GLY 49 H GLY 49 12.462 -1.404 3.650
243 1HA GLY 49 1HA GLY 49 13.066 -2.752 5.512
244 2HA GLY 49 2HA GLY 49 11.598 -2.196 6.326
245 H CYS 50 H CYS 50 10.671 -3.448 3.297
246 HA CYS 50 HA CYS 50 9.182 -5.002 2.856
247 1HB CYS 50 1HB CYS 50 11.414 -5.555 2.135
248 2HB CYS 50 2HB CYS 50 11.759 -6.328 3.652
249 H GLY 51 H GLY 51 8.983 -4.389 5.729
250 1HA GLY 51 1HA GLY 51 6.802 -6.056 6.489
251 2HA GLY 51 2HA GLY 51 8.242 -6.719 7.261
Start of MODEL 17
1 H SER 10 H SER 10 -6.051 -1.244 5.754
2 HA SER 10 HA SER 10 -7.905 -3.202 6.820
3 1HB SER 10 1HB SER 10 -8.059 -0.313 7.793
4 2HB SER 10 2HB SER 10 -9.456 -1.402 7.793
5 HG SER 10 HG SER 10 -7.028 -2.208 8.992
6 H CYS 11 H CYS 11 -8.272 -3.745 4.842
7 HA CYS 11 HA CYS 11 -9.983 -2.194 3.094
8 1HB CYS 11 1HB CYS 11 -7.258 -1.920 2.924
9 2HB CYS 11 2HB CYS 11 -7.459 -3.328 1.918
10 HA PRO 12 HA PRO 12 -10.895 -6.601 2.148
11 1HB PRO 12 1HB PRO 12 -9.387 -6.849 -0.440
12 2HB PRO 12 2HB PRO 12 -11.105 -7.229 -0.119
13 1HG PRO 12 1HG PRO 12 -10.394 -5.005 -1.526
14 2HG PRO 12 2HG PRO 12 -11.750 -4.970 -0.351
15 1HD PRO 12 1HD PRO 12 -8.888 -4.078 0.066
16 2HD PRO 12 2HD PRO 12 -10.405 -3.223 0.474
17 HA PRO 13 HA PRO 13 -7.202 -8.741 3.456
18 1HB PRO 13 1HB PRO 13 -7.518 -11.361 2.738
19 2HB PRO 13 2HB PRO 13 -8.521 -10.588 4.009
20 1HG PRO 13 1HG PRO 13 -9.187 -10.967 1.078
21 2HG PRO 13 2HG PRO 13 -10.205 -11.386 2.499
22 1HD PRO 13 1HD PRO 13 -10.539 -9.064 1.126
23 2HD PRO 13 2HD PRO 13 -10.716 -9.101 2.909
24 H GLY 14 H GLY 14 -5.284 -9.290 2.851
25 1HA GLY 14 1HA GLY 14 -3.384 -9.215 1.579
26 2HA GLY 14 2HA GLY 14 -4.305 -9.818 0.203
27 H GLN 15 H GLN 15 -5.264 -6.701 1.702
28 HA GLN 15 HA GLN 15 -3.867 -5.154 -0.351
29 1HB GLN 15 1HB GLN 15 -6.798 -5.435 -0.027
30 2HB GLN 15 2HB GLN 15 -6.197 -3.780 -0.188
31 1HG GLN 15 1HG GLN 15 -5.233 -4.154 -2.293
32 2HG GLN 15 2HG GLN 15 -5.196 -5.909 -2.086
33 1HE2 GLN 15 2HE2 GLN 15 -7.256 -7.072 -2.026
34 2HE2 GLN 15 1HE2 GLN 15 -8.503 -6.471 -3.117
35 H PHE 16 H PHE 16 -2.964 -3.481 0.450
36 HA PHE 16 HA PHE 16 -3.840 -2.259 3.079
37 1HB PHE 16 1HB PHE 16 -1.656 -2.053 3.886
38 2HB PHE 16 2HB PHE 16 -1.687 -3.670 3.223
39 HD1 PHE 16 HD1 PHE 16 -0.827 -3.908 0.763
40 HD2 PHE 16 HD2 PHE 16 0.032 -0.506 3.228
41 HE1 PHE 16 HE1 PHE 16 1.036 -3.304 -0.743
42 HE2 PHE 16 HE2 PHE 16 1.830 0.174 1.675
43 HZ PHE 16 HZ PHE 16 2.329 -1.277 -0.364
44 H ARG 17 H ARG 17 -3.257 0.050 3.381
45 HA ARG 17 HA ARG 17 -3.023 1.543 0.807
46 1HB ARG 17 1HB ARG 17 -3.876 3.475 1.919
47 2HB ARG 17 2HB ARG 17 -4.986 2.092 2.048
48 1HG ARG 17 1HG ARG 17 -4.275 1.737 4.404
49 2HG ARG 17 2HG ARG 17 -3.166 3.106 4.276
50 1HD ARG 17 1HD ARG 17 -5.224 3.785 5.422
51 2HD ARG 17 2HD ARG 17 -5.014 4.652 3.904
52 HE ARG 17 HE ARG 17 -7.012 3.795 3.150
53 1HH1 ARG 17 1HH1 ARG 17 -6.135 1.673 5.824
54 2HH1 ARG 17 2HH1 ARG 17 -7.609 0.741 5.561
55 1HH2 ARG 17 2HH2 ARG 17 -8.760 2.581 2.982
56 2HH2 ARG 17 1HH2 ARG 17 -8.972 1.166 4.016
57 H CYS 18 H CYS 18 -1.601 3.055 0.452
58 HA CYS 18 HA CYS 18 1.023 2.595 1.656
59 1HB CYS 18 1HB CYS 18 -0.083 3.887 -0.822
60 2HB CYS 18 2HB CYS 18 1.553 4.282 -0.307
61 H SER 19 H SER 19 0.142 5.604 0.423
62 HA SER 19 HA SER 19 1.547 6.928 2.692
63 1HB SER 19 1HB SER 19 1.467 7.758 -0.234
64 2HB SER 19 2HB SER 19 2.458 8.500 1.039
65 HG SER 19 HG SER 19 2.969 6.322 -0.446
66 H GLU 20 H GLU 20 -1.108 6.584 2.700
67 HA GLU 20 HA GLU 20 -1.965 9.327 3.457
68 1HB GLU 20 1HB GLU 20 -2.889 8.888 1.250
69 2HB GLU 20 2HB GLU 20 -3.708 7.444 1.847
70 1HG GLU 20 1HG GLU 20 -5.123 8.787 3.319
71 2HG GLU 20 2HG GLU 20 -4.169 10.234 2.988
72 HA PRO 21 HA PRO 21 -2.734 6.762 7.097
73 1HB PRO 21 1HB PRO 21 -3.432 8.727 8.885
74 2HB PRO 21 2HB PRO 21 -1.766 8.532 8.262
75 1HG PRO 21 1HG PRO 21 -3.931 10.406 7.243
76 2HG PRO 21 2HG PRO 21 -2.242 10.813 7.695
77 1HD PRO 21 1HD PRO 21 -2.947 10.331 5.115
78 2HD PRO 21 2HD PRO 21 -1.376 9.768 5.761
79 HA PRO 22 HA PRO 22 -7.146 6.106 7.391
80 1HB PRO 22 1HB PRO 22 -7.621 5.505 10.032
81 2HB PRO 22 2HB PRO 22 -6.774 4.408 8.899
82 1HG PRO 22 1HG PRO 22 -5.540 6.377 10.854
83 2HG PRO 22 2HG PRO 22 -5.168 4.637 10.637
84 1HD PRO 22 1HD PRO 22 -3.657 6.552 9.458
85 2HD PRO 22 2HD PRO 22 -4.046 5.047 8.578
86 H GLY 23 H GLY 23 -9.124 6.802 8.625
87 1HA GLY 23 1HA GLY 23 -10.606 8.574 9.059
88 2HA GLY 23 2HA GLY 23 -9.241 9.629 9.418
89 H ALA 24 H ALA 24 -8.142 8.619 6.680
90 HA ALA 24 HA ALA 24 -9.978 9.906 4.736
91 1HB ALA 24 1HB ALA 24 -7.994 10.776 3.532
92 2HB ALA 24 2HB ALA 24 -8.135 11.474 5.158
93 3HB ALA 24 3HB ALA 24 -6.942 10.195 4.842
94 H HIS 25 H HIS 25 -10.765 7.727 4.613
95 HA HIS 25 HA HIS 25 -9.407 5.406 4.557
96 1HB HIS 25 1HB HIS 25 -12.006 6.024 3.088
97 2HB HIS 25 2HB HIS 25 -11.476 4.452 3.649
98 HD1 HIS 25 HD1 HIS 25 -13.694 7.122 4.733
99 HD2 HIS 25 HD2 HIS 25 -10.923 4.489 6.554
100 HE1 HIS 25 HE1 HIS 25 -14.275 7.067 7.242
101 HE2 HIS 25 HE2 HIS 25 -12.598 5.457 8.348
102 H GLY 26 H GLY 26 -10.109 7.232 1.728
103 1HA GLY 26 1HA GLY 26 -9.357 7.142 -0.511
104 2HA GLY 26 2HA GLY 26 -7.867 6.543 0.213
105 H GLU 27 H GLU 27 -7.253 5.018 -1.165
106 HA GLU 27 HA GLU 27 -8.575 2.471 -1.165
107 1HB GLU 27 1HB GLU 27 -8.488 2.100 -3.552
108 2HB GLU 27 2HB GLU 27 -9.562 3.442 -3.231
109 1HG GLU 27 1HG GLU 27 -6.669 3.750 -4.165
110 2HG GLU 27 2HG GLU 27 -8.051 3.667 -5.243
111 H CYS 28 H CYS 28 -7.265 0.926 -2.102
112 HA CYS 28 HA CYS 28 -4.636 1.086 -0.820
113 1HB CYS 28 1HB CYS 28 -6.670 -1.125 -1.271
114 2HB CYS 28 2HB CYS 28 -5.313 -1.205 -0.222
115 H TYR 29 H TYR 29 -3.530 -1.203 -1.356
116 HA TYR 29 HA TYR 29 -3.406 -1.829 -4.218
117 1HB TYR 29 1HB TYR 29 -0.960 -1.009 -2.580
118 2HB TYR 29 2HB TYR 29 -0.896 -1.618 -4.214
119 HD1 TYR 29 HD1 TYR 29 -1.320 1.276 -2.070
120 HD2 TYR 29 HD2 TYR 29 -1.740 -0.116 -6.140
121 HE1 TYR 29 HE1 TYR 29 -1.456 3.636 -2.883
122 HE2 TYR 29 HE2 TYR 29 -1.864 2.221 -6.928
123 HH TYR 29 HH TYR 29 -1.850 4.432 -6.347
124 HA PRO 30 HA PRO 30 -3.001 -5.887 -2.510
125 1HB PRO 30 1HB PRO 30 -0.814 -6.525 -4.424
126 2HB PRO 30 2HB PRO 30 -2.362 -7.376 -4.159
127 1HG PRO 30 1HG PRO 30 -1.964 -5.819 -6.376
128 2HG PRO 30 2HG PRO 30 -3.542 -5.813 -5.519
129 1HD PRO 30 1HD PRO 30 -1.270 -3.826 -5.278
130 2HD PRO 30 2HD PRO 30 -3.018 -3.514 -5.477
131 H GLN 31 H GLN 31 -1.766 -7.013 -1.053
132 HA GLN 31 HA GLN 31 0.813 -5.876 -0.144
133 1HB GLN 31 1HB GLN 31 -0.728 -8.370 0.742
134 2HB GLN 31 2HB GLN 31 0.735 -7.776 1.526
135 1HG GLN 31 1HG GLN 31 -0.362 -5.728 2.220
136 2HG GLN 31 2HG GLN 31 -1.831 -6.147 1.334
137 1HE2 GLN 31 2HE2 GLN 31 -3.157 -6.037 3.309
138 2HE2 GLN 31 1HE2 GLN 31 -2.979 -7.318 4.497
139 H ASP 32 H ASP 32 -0.014 -7.874 -2.641
140 HA ASP 32 HA ASP 32 2.467 -9.313 -2.935
141 1HB ASP 32 1HB ASP 32 0.216 -9.458 -4.272
142 2HB ASP 32 2HB ASP 32 0.756 -8.036 -5.117
143 H TRP 33 H TRP 33 1.333 -6.151 -3.436
144 HA TRP 33 HA TRP 33 3.929 -5.021 -4.213
145 1HB TRP 33 1HB TRP 33 1.323 -3.541 -4.006
146 2HB TRP 33 2HB TRP 33 2.828 -2.992 -4.686
147 HD1 TRP 33 HD1 TRP 33 2.201 -6.331 -6.156
148 HE1 TRP 33 HE1 TRP 33 0.983 -6.195 -8.399
149 HE3 TRP 33 HE3 TRP 33 0.936 -1.365 -6.088
150 HZ2 TRP 33 HZ2 TRP 33 -0.501 -4.242 -9.901
151 HZ3 TRP 33 HZ3 TRP 33 -0.374 -0.392 -7.972
152 HH2 TRP 33 HH2 TRP 33 -1.149 -1.826 -9.838
153 H LEU 34 H LEU 34 3.750 -6.138 -1.902
154 HA LEU 34 HA LEU 34 4.847 -3.940 -0.238
155 1HB LEU 34 1HB LEU 34 2.584 -4.714 0.680
156 2HB LEU 34 2HB LEU 34 3.296 -6.292 0.927
157 HG LEU 34 HG LEU 34 5.051 -5.169 2.413
158 1HD1 LEU 34 1HD1 LEU 34 3.043 -2.883 2.367
159 2HD1 LEU 34 2HD1 LEU 34 4.502 -2.998 3.374
160 3HD1 LEU 34 3HD1 LEU 34 4.645 -2.827 1.620
161 1HD2 LEU 34 1HD2 LEU 34 3.509 -5.033 4.345
162 2HD2 LEU 34 2HD2 LEU 34 2.116 -4.962 3.242
163 3HD2 LEU 34 3HD2 LEU 34 3.123 -6.429 3.327
164 H CYS 35 H CYS 35 6.953 -4.284 -0.480
165 HA CYS 35 HA CYS 35 8.885 -5.076 -1.099
166 1HB CYS 35 1HB CYS 35 8.985 -5.713 1.009
167 2HB CYS 35 2HB CYS 35 8.102 -7.205 0.820
168 H ASP 36 H ASP 36 7.796 -5.080 -3.167
169 HA ASP 36 HA ASP 36 7.411 -7.738 -4.501
170 1HB ASP 36 1HB ASP 36 5.854 -5.831 -4.995
171 2HB ASP 36 2HB ASP 36 7.214 -4.933 -5.654
172 H GLY 37 H GLY 37 9.841 -5.437 -3.792
173 1HA GLY 37 1HA GLY 37 12.163 -5.551 -4.348
174 2HA GLY 37 2HA GLY 37 11.775 -6.582 -5.740
175 H HIS 38 H HIS 38 9.654 -4.172 -5.504
176 HA HIS 38 HA HIS 38 10.858 -2.153 -7.272
177 1HB HIS 38 1HB HIS 38 10.038 -3.739 -8.837
178 2HB HIS 38 2HB HIS 38 8.618 -4.096 -7.893
179 HD1 HIS 38 HD1 HIS 38 9.817 -1.198 -10.199
180 HD2 HIS 38 HD2 HIS 38 6.507 -2.641 -8.021
181 HE1 HIS 38 HE1 HIS 38 7.826 0.358 -10.746
182 HE2 HIS 38 HE2 HIS 38 5.790 -0.567 -9.445
183 HA PRO 39 HA PRO 39 8.168 -0.031 -4.262
184 1HB PRO 39 1HB PRO 39 8.543 2.560 -5.237
185 2HB PRO 39 2HB PRO 39 9.398 1.740 -3.929
186 1HG PRO 39 1HG PRO 39 10.472 2.443 -6.559
187 2HG PRO 39 2HG PRO 39 11.318 1.652 -5.199
188 1HD PRO 39 1HD PRO 39 10.146 0.448 -7.632
189 2HD PRO 39 2HD PRO 39 11.327 -0.251 -6.499
190 H ASP 40 H ASP 40 6.133 0.943 -4.317
191 HA ASP 40 HA ASP 40 5.124 2.086 -6.860
192 1HB ASP 40 1HB ASP 40 4.609 -0.619 -6.425
193 2HB ASP 40 2HB ASP 40 3.162 0.136 -5.787
194 H CYS 41 H CYS 41 5.537 2.449 -3.679
195 HA CYS 41 HA CYS 41 2.859 2.854 -2.874
196 1HB CYS 41 1HB CYS 41 5.279 2.615 -1.551
197 2HB CYS 41 2HB CYS 41 4.509 4.057 -0.925
198 H ASP 42 H ASP 42 3.777 4.662 -4.869
199 HA ASP 42 HA ASP 42 4.393 6.723 -5.521
200 1HB ASP 42 1HB ASP 42 1.896 7.003 -5.213
201 2HB ASP 42 2HB ASP 42 2.222 7.760 -3.655
202 H ASP 43 H ASP 43 5.031 5.943 -2.508
203 HA ASP 43 HA ASP 43 7.260 7.846 -2.369
204 1HB ASP 43 1HB ASP 43 5.385 7.962 -0.562
205 2HB ASP 43 2HB ASP 43 6.149 6.507 0.046
206 H GLY 44 H GLY 44 6.422 4.843 -3.050
207 1HA GLY 44 1HA GLY 44 7.604 2.751 -3.153
208 2HA GLY 44 2HA GLY 44 9.079 3.633 -2.812
209 H ARG 45 H ARG 45 6.472 3.700 -0.616
210 HA ARG 45 HA ARG 45 8.257 2.613 1.519
211 1HB ARG 45 1HB ARG 45 6.861 3.539 3.187
212 2HB ARG 45 2HB ARG 45 7.212 4.798 2.012
213 1HG ARG 45 1HG ARG 45 4.961 4.614 1.070
214 2HG ARG 45 2HG ARG 45 4.616 3.200 2.080
215 1HD ARG 45 1HD ARG 45 3.534 5.098 3.041
216 2HD ARG 45 2HD ARG 45 4.858 4.606 4.109
217 HE ARG 45 HE ARG 45 5.774 6.656 2.304
218 1HH1 ARG 45 1HH2 ARG 45 3.613 6.429 5.046
219 2HH1 ARG 45 2HH2 ARG 45 3.876 8.101 5.481
220 1HH2 ARG 45 1HH1 ARG 45 6.120 8.652 2.914
221 2HH2 ARG 45 2HH1 ARG 45 5.268 9.364 4.282
222 H ASP 46 H ASP 46 6.497 1.195 -0.701
223 HA ASP 46 HA ASP 46 5.253 -0.774 0.974
224 1HB ASP 46 1HB ASP 46 4.983 -1.953 -1.165
225 2HB ASP 46 2HB ASP 46 4.171 -0.396 -1.178
226 H GLU 47 H GLU 47 8.177 -0.009 -0.740
227 HA GLU 47 HA GLU 47 9.282 -2.668 -0.545
228 1HB GLU 47 1HB GLU 47 10.433 0.064 -1.174
229 2HB GLU 47 2HB GLU 47 11.438 -1.367 -1.163
230 1HG GLU 47 1HG GLU 47 8.874 -1.344 -2.768
231 2HG GLU 47 2HG GLU 47 10.323 -0.567 -3.369
232 H TRP 48 H TRP 48 9.322 0.160 1.347
233 HA TRP 48 HA TRP 48 11.789 -0.019 2.593
234 1HB TRP 48 1HB TRP 48 9.327 1.318 3.716
235 2HB TRP 48 2HB TRP 48 10.972 1.543 4.283
236 HD1 TRP 48 HD1 TRP 48 11.238 1.615 0.611
237 HE1 TRP 48 HE1 TRP 48 10.853 3.925 -0.351
238 HE3 TRP 48 HE3 TRP 48 9.640 3.859 4.829
239 HZ2 TRP 48 HZ2 TRP 48 10.112 6.616 0.702
240 HZ3 TRP 48 HZ3 TRP 48 9.119 6.341 4.887
241 HH2 TRP 48 HH2 TRP 48 9.371 7.691 2.818
242 H GLY 49 H GLY 49 12.510 -1.442 3.600
243 1HA GLY 49 1HA GLY 49 13.150 -2.777 5.455
244 2HA GLY 49 2HA GLY 49 11.683 -2.243 6.283
245 H CYS 50 H CYS 50 10.780 -3.513 3.241
246 HA CYS 50 HA CYS 50 9.259 -5.110 2.863
247 1HB CYS 50 1HB CYS 50 11.496 -5.602 2.061
248 2HB CYS 50 2HB CYS 50 11.899 -6.385 3.559
249 H GLY 51 H GLY 51 8.852 -4.369 5.492
250 1HA GLY 51 1HA GLY 51 7.423 -6.738 6.623
251 2HA GLY 51 2HA GLY 51 8.638 -5.963 7.639
Start of MODEL 18
1 H SER 10 H SER 10 -5.932 -1.071 5.798
2 HA SER 10 HA SER 10 -7.765 -3.142 6.766
3 1HB SER 10 1HB SER 10 -8.069 -0.249 7.707
4 2HB SER 10 2HB SER 10 -9.240 -1.552 7.961
5 HG SER 10 HG SER 10 -7.541 -2.662 9.145
6 H CYS 11 H CYS 11 -8.100 -3.622 4.788
7 HA CYS 11 HA CYS 11 -9.923 -2.095 3.122
8 1HB CYS 11 1HB CYS 11 -7.214 -1.781 2.851
9 2HB CYS 11 2HB CYS 11 -7.431 -3.194 1.853
10 HA PRO 12 HA PRO 12 -10.942 -6.427 2.263
11 1HB PRO 12 1HB PRO 12 -9.708 -6.756 -0.452
12 2HB PRO 12 2HB PRO 12 -11.401 -7.042 0.038
13 1HG PRO 12 1HG PRO 12 -10.686 -4.853 -1.445
14 2HG PRO 12 2HG PRO 12 -11.944 -4.753 -0.170
15 1HD PRO 12 1HD PRO 12 -9.023 -3.982 0.016
16 2HD PRO 12 2HD PRO 12 -10.468 -3.077 0.557
17 HA PRO 13 HA PRO 13 -7.376 -8.850 3.335
18 1HB PRO 13 1HB PRO 13 -8.495 -11.071 1.582
19 2HB PRO 13 2HB PRO 13 -7.825 -11.191 3.243
20 1HG PRO 13 1HG PRO 13 -10.497 -11.152 2.899
21 2HG PRO 13 2HG PRO 13 -9.748 -10.127 4.172
22 1HD PRO 13 1HD PRO 13 -10.677 -9.291 1.405
23 2HD PRO 13 2HD PRO 13 -10.943 -8.489 2.988
24 H GLY 14 H GLY 14 -5.465 -9.255 2.794
25 1HA GLY 14 1HA GLY 14 -3.485 -9.140 1.631
26 2HA GLY 14 2HA GLY 14 -4.331 -9.765 0.216
27 H GLN 15 H GLN 15 -5.394 -6.660 1.637
28 HA GLN 15 HA GLN 15 -3.869 -5.125 -0.348
29 1HB GLN 15 1HB GLN 15 -6.834 -5.211 -0.041
30 2HB GLN 15 2HB GLN 15 -6.070 -3.662 -0.396
31 1HG GLN 15 1HG GLN 15 -5.253 -4.326 -2.461
32 2HG GLN 15 2HG GLN 15 -5.205 -6.038 -2.032
33 1HE2 GLN 15 2HE2 GLN 15 -7.336 -7.128 -1.643
34 2HE2 GLN 15 1HE2 GLN 15 -8.543 -6.733 -2.863
35 H PHE 16 H PHE 16 -2.987 -3.461 0.449
36 HA PHE 16 HA PHE 16 -3.867 -2.216 3.065
37 1HB PHE 16 1HB PHE 16 -1.684 -2.015 3.879
38 2HB PHE 16 2HB PHE 16 -1.717 -3.634 3.221
39 HD1 PHE 16 HD1 PHE 16 -0.840 -3.889 0.777
40 HD2 PHE 16 HD2 PHE 16 0.006 -0.469 3.218
41 HE1 PHE 16 HE1 PHE 16 1.027 -3.296 -0.728
42 HE2 PHE 16 HE2 PHE 16 1.809 0.202 1.664
43 HZ PHE 16 HZ PHE 16 2.313 -1.263 -0.362
44 H ARG 17 H ARG 17 -3.199 0.097 3.360
45 HA ARG 17 HA ARG 17 -2.983 1.558 0.764
46 1HB ARG 17 1HB ARG 17 -3.855 3.495 1.835
47 2HB ARG 17 2HB ARG 17 -4.953 2.107 2.004
48 1HG ARG 17 1HG ARG 17 -4.218 1.816 4.364
49 2HG ARG 17 2HG ARG 17 -3.130 3.200 4.195
50 1HD ARG 17 1HD ARG 17 -5.192 3.876 5.333
51 2HD ARG 17 2HD ARG 17 -5.015 4.702 3.790
52 HE ARG 17 HE ARG 17 -6.969 3.724 3.036
53 1HH1 ARG 17 1HH2 ARG 17 -6.081 1.850 5.883
54 2HH1 ARG 17 2HH2 ARG 17 -7.532 0.868 5.693
55 1HH2 ARG 17 2HH1 ARG 17 -8.681 2.438 2.932
56 2HH2 ARG 17 1HH1 ARG 17 -8.864 1.104 4.075
57 H CYS 18 H CYS 18 -1.588 3.098 0.408
58 HA CYS 18 HA CYS 18 1.045 2.685 1.622
59 1HB CYS 18 1HB CYS 18 -0.066 3.929 -0.881
60 2HB CYS 18 2HB CYS 18 1.568 4.326 -0.367
61 H SER 19 H SER 19 0.134 5.655 0.318
62 HA SER 19 HA SER 19 1.500 7.052 2.567
63 1HB SER 19 1HB SER 19 1.423 7.805 -0.380
64 2HB SER 19 2HB SER 19 2.381 8.611 0.880
65 HG SER 19 HG SER 19 2.964 6.400 -0.534
66 H GLU 20 H GLU 20 -1.138 6.659 2.594
67 HA GLU 20 HA GLU 20 -2.027 9.393 3.326
68 1HB GLU 20 1HB GLU 20 -3.007 8.911 1.155
69 2HB GLU 20 2HB GLU 20 -3.771 7.452 1.786
70 1HG GLU 20 1HG GLU 20 -5.186 8.769 3.279
71 2HG GLU 20 2HG GLU 20 -4.274 10.237 2.917
72 HA PRO 21 HA PRO 21 -2.543 6.897 7.028
73 1HB PRO 21 1HB PRO 21 -3.352 8.843 8.796
74 2HB PRO 21 2HB PRO 21 -1.694 8.762 8.129
75 1HG PRO 21 1HG PRO 21 -4.029 10.433 7.129
76 2HG PRO 21 2HG PRO 21 -2.366 10.984 7.523
77 1HD PRO 21 1HD PRO 21 -3.084 10.386 4.974
78 2HD PRO 21 2HD PRO 21 -1.467 9.943 5.597
79 HA PRO 22 HA PRO 22 -6.869 5.879 7.529
80 1HB PRO 22 1HB PRO 22 -7.172 5.287 10.195
81 2HB PRO 22 2HB PRO 22 -6.282 4.246 9.043
82 1HG PRO 22 1HG PRO 22 -5.141 6.352 10.908
83 2HG PRO 22 2HG PRO 22 -4.630 4.647 10.704
84 1HD PRO 22 1HD PRO 22 -3.342 6.660 9.425
85 2HD PRO 22 2HD PRO 22 -3.636 5.107 8.592
86 H GLY 23 H GLY 23 -8.841 6.436 8.848
87 1HA GLY 23 1HA GLY 23 -10.441 8.090 9.308
88 2HA GLY 23 2HA GLY 23 -9.150 9.246 9.636
89 H ALA 24 H ALA 24 -8.169 8.183 6.814
90 HA ALA 24 HA ALA 24 -10.105 9.466 4.975
91 1HB ALA 24 1HB ALA 24 -8.218 10.497 3.735
92 2HB ALA 24 2HB ALA 24 -8.348 11.137 5.386
93 3HB ALA 24 3HB ALA 24 -7.088 9.948 4.991
94 H HIS 25 H HIS 25 -10.772 7.259 4.727
95 HA HIS 25 HA HIS 25 -9.246 5.027 4.458
96 1HB HIS 25 1HB HIS 25 -11.996 5.701 3.330
97 2HB HIS 25 2HB HIS 25 -11.332 4.086 3.361
98 HD1 HIS 25 HD1 HIS 25 -10.570 3.247 6.020
99 HD2 HIS 25 HD2 HIS 25 -13.490 6.252 5.413
100 HE1 HIS 25 HE1 HIS 25 -11.939 3.394 8.199
101 HE2 HIS 25 HE2 HIS 25 -13.707 5.228 7.825
102 H GLY 26 H GLY 26 -10.036 7.120 1.851
103 1HA GLY 26 1HA GLY 26 -9.317 7.229 -0.416
104 2HA GLY 26 2HA GLY 26 -7.827 6.579 0.252
105 H GLU 27 H GLU 27 -7.165 5.100 -1.117
106 HA GLU 27 HA GLU 27 -8.538 2.595 -1.337
107 1HB GLU 27 1HB GLU 27 -8.351 2.346 -3.746
108 2HB GLU 27 2HB GLU 27 -9.377 3.730 -3.395
109 1HG GLU 27 1HG GLU 27 -7.421 5.254 -3.833
110 2HG GLU 27 2HG GLU 27 -6.451 3.842 -4.256
111 H CYS 28 H CYS 28 -7.232 1.043 -2.189
112 HA CYS 28 HA CYS 28 -4.620 1.133 -0.865
113 1HB CYS 28 1HB CYS 28 -6.705 -1.025 -1.334
114 2HB CYS 28 2HB CYS 28 -5.369 -1.127 -0.259
115 H TYR 29 H TYR 29 -3.561 -1.186 -1.378
116 HA TYR 29 HA TYR 29 -3.417 -1.837 -4.232
117 1HB TYR 29 1HB TYR 29 -0.973 -1.025 -2.585
118 2HB TYR 29 2HB TYR 29 -0.907 -1.639 -4.218
119 HD1 TYR 29 HD1 TYR 29 -1.747 -0.129 -6.151
120 HD2 TYR 29 HD2 TYR 29 -1.297 1.259 -2.084
121 HE1 TYR 29 HE1 TYR 29 -1.852 2.219 -6.934
122 HE2 TYR 29 HE2 TYR 29 -1.423 3.615 -2.884
123 HH TYR 29 HH TYR 29 -1.660 4.999 -4.686
124 HA PRO 30 HA PRO 30 -3.030 -5.884 -2.492
125 1HB PRO 30 1HB PRO 30 -0.836 -6.538 -4.393
126 2HB PRO 30 2HB PRO 30 -2.385 -7.387 -4.122
127 1HG PRO 30 1HG PRO 30 -1.984 -5.849 -6.353
128 2HG PRO 30 2HG PRO 30 -3.563 -5.837 -5.497
129 1HD PRO 30 1HD PRO 30 -1.292 -3.846 -5.273
130 2HD PRO 30 2HD PRO 30 -3.038 -3.536 -5.475
131 H GLN 31 H GLN 31 -1.789 -7.001 -1.019
132 HA GLN 31 HA GLN 31 0.789 -5.866 -0.116
133 1HB GLN 31 1HB GLN 31 -0.788 -8.338 0.787
134 2HB GLN 31 2HB GLN 31 0.692 -7.765 1.563
135 1HG GLN 31 1HG GLN 31 -0.372 -5.693 2.243
136 2HG GLN 31 2HG GLN 31 -1.853 -6.105 1.373
137 1HE2 GLN 31 1HE2 GLN 31 -3.225 -6.054 3.289
138 2HE2 GLN 31 2HE2 GLN 31 -3.015 -7.292 4.517
139 H ASP 32 H ASP 32 -0.042 -7.868 -2.606
140 HA ASP 32 HA ASP 32 2.436 -9.313 -2.890
141 1HB ASP 32 1HB ASP 32 0.184 -9.461 -4.229
142 2HB ASP 32 2HB ASP 32 0.734 -8.049 -5.084
143 H TRP 33 H TRP 33 1.306 -6.152 -3.413
144 HA TRP 33 HA TRP 33 3.906 -5.029 -4.189
145 1HB TRP 33 1HB TRP 33 1.297 -3.549 -3.993
146 2HB TRP 33 2HB TRP 33 2.804 -2.996 -4.668
147 HD1 TRP 33 HD1 TRP 33 2.194 -6.337 -6.132
148 HE1 TRP 33 HE1 TRP 33 0.980 -6.213 -8.379
149 HE3 TRP 33 HE3 TRP 33 0.921 -1.376 -6.086
150 HZ2 TRP 33 HZ2 TRP 33 -0.506 -4.268 -9.892
151 HZ3 TRP 33 HZ3 TRP 33 -0.381 -0.408 -7.980
152 HH2 TRP 33 HH2 TRP 33 -1.155 -1.852 -9.838
153 H LEU 34 H LEU 34 3.717 -6.138 -1.874
154 HA LEU 34 HA LEU 34 4.815 -3.931 -0.219
155 1HB LEU 34 1HB LEU 34 2.554 -4.705 0.708
156 2HB LEU 34 2HB LEU 34 3.269 -6.284 0.953
157 HG LEU 34 HG LEU 34 5.035 -5.144 2.425
158 1HD1 LEU 34 1HD1 LEU 34 4.590 -2.805 1.639
159 2HD1 LEU 34 2HD1 LEU 34 2.995 -2.885 2.400
160 3HD1 LEU 34 3HD1 LEU 34 4.465 -2.982 3.394
161 1HD2 LEU 34 1HD2 LEU 34 3.508 -5.040 4.370
162 2HD2 LEU 34 2HD2 LEU 34 2.106 -4.987 3.278
163 3HD2 LEU 34 3HD2 LEU 34 3.134 -6.437 3.349
164 H CYS 35 H CYS 35 6.913 -4.274 -0.465
165 HA CYS 35 HA CYS 35 8.864 -5.073 -1.038
166 1HB CYS 35 1HB CYS 35 8.890 -5.713 1.083
167 2HB CYS 35 2HB CYS 35 8.034 -7.209 0.858
168 H ASP 36 H ASP 36 7.775 -5.085 -3.130
169 HA ASP 36 HA ASP 36 7.386 -7.744 -4.454
170 1HB ASP 36 1HB ASP 36 5.850 -5.829 -4.968
171 2HB ASP 36 2HB ASP 36 7.223 -4.938 -5.609
172 H GLY 37 H GLY 37 9.830 -5.472 -3.725
173 1HA GLY 37 1HA GLY 37 12.155 -5.605 -4.245
174 2HA GLY 37 2HA GLY 37 11.782 -6.640 -5.638
175 H HIS 38 H HIS 38 9.675 -4.210 -5.452
176 HA HIS 38 HA HIS 38 10.929 -2.198 -7.185
177 1HB HIS 38 1HB HIS 38 10.159 -3.772 -8.782
178 2HB HIS 38 2HB HIS 38 8.718 -4.150 -7.879
179 HD1 HIS 38 HD1 HIS 38 9.940 -1.222 -10.135
180 HD2 HIS 38 HD2 HIS 38 6.601 -2.719 -8.040
181 HE1 HIS 38 HE1 HIS 38 7.945 0.322 -10.704
182 HE2 HIS 38 HE2 HIS 38 5.890 -0.644 -9.463
183 HA PRO 39 HA PRO 39 8.177 -0.049 -4.271
184 1HB PRO 39 1HB PRO 39 8.511 2.532 -5.233
185 2HB PRO 39 2HB PRO 39 9.445 1.714 -3.980
186 1HG PRO 39 1HG PRO 39 10.271 2.378 -6.749
187 2HG PRO 39 2HG PRO 39 11.293 1.823 -5.393
188 1HD PRO 39 1HD PRO 39 10.254 0.297 -7.649
189 2HD PRO 39 2HD PRO 39 11.355 -0.262 -6.373
190 H ASP 40 H ASP 40 6.135 0.908 -4.336
191 HA ASP 40 HA ASP 40 5.139 2.042 -6.885
192 1HB ASP 40 1HB ASP 40 4.592 -0.667 -6.408
193 2HB ASP 40 2HB ASP 40 3.134 0.130 -5.852
194 H CYS 41 H CYS 41 5.549 2.427 -3.711
195 HA CYS 41 HA CYS 41 2.871 2.860 -2.916
196 1HB CYS 41 1HB CYS 41 5.289 2.617 -1.588
197 2HB CYS 41 2HB CYS 41 4.530 4.072 -0.979
198 H ASP 42 H ASP 42 3.805 4.635 -4.931
199 HA ASP 42 HA ASP 42 4.440 6.681 -5.610
200 1HB ASP 42 1HB ASP 42 1.947 6.991 -5.313
201 2HB ASP 42 2HB ASP 42 2.276 7.760 -3.761
202 H ASP 43 H ASP 43 5.065 5.940 -2.582
203 HA ASP 43 HA ASP 43 7.310 7.826 -2.473
204 1HB ASP 43 1HB ASP 43 5.432 7.969 -0.658
205 2HB ASP 43 2HB ASP 43 6.212 6.531 -0.029
206 H GLY 44 H GLY 44 6.449 4.818 -3.108
207 1HA GLY 44 1HA GLY 44 7.616 2.716 -3.177
208 2HA GLY 44 2HA GLY 44 9.096 3.593 -2.849
209 H ARG 45 H ARG 45 6.481 3.709 -0.665
210 HA ARG 45 HA ARG 45 8.244 2.640 1.494
211 1HB ARG 45 1HB ARG 45 6.843 3.593 3.144
212 2HB ARG 45 2HB ARG 45 7.230 4.833 1.960
213 1HG ARG 45 1HG ARG 45 4.985 4.696 1.002
214 2HG ARG 45 2HG ARG 45 4.600 3.289 2.010
215 1HD ARG 45 1HD ARG 45 3.558 5.248 2.943
216 2HD ARG 45 2HD ARG 45 4.825 4.668 4.037
217 HE ARG 45 HE ARG 45 5.763 6.744 2.202
218 1HH1 ARG 45 2HH1 ARG 45 4.008 6.409 5.213
219 2HH1 ARG 45 1HH1 ARG 45 4.490 7.998 5.754
220 1HH2 ARG 45 1HH2 ARG 45 6.378 8.639 2.935
221 2HH2 ARG 45 2HH2 ARG 45 5.800 9.267 4.477
222 H ASP 46 H ASP 46 6.493 1.202 -0.716
223 HA ASP 46 HA ASP 46 5.236 -0.743 0.978
224 1HB ASP 46 1HB ASP 46 4.963 -1.942 -1.150
225 2HB ASP 46 2HB ASP 46 4.161 -0.380 -1.180
226 H GLU 47 H GLU 47 8.165 -0.012 -0.735
227 HA GLU 47 HA GLU 47 9.267 -2.668 -0.500
228 1HB GLU 47 1HB GLU 47 10.425 0.054 -1.164
229 2HB GLU 47 2HB GLU 47 11.423 -1.379 -1.134
230 1HG GLU 47 1HG GLU 47 8.864 -1.363 -2.749
231 2HG GLU 47 2HG GLU 47 10.319 -0.601 -3.353
232 H TRP 48 H TRP 48 9.310 0.197 1.343
233 HA TRP 48 HA TRP 48 11.770 0.025 2.617
234 1HB TRP 48 1HB TRP 48 9.306 1.401 3.692
235 2HB TRP 48 2HB TRP 48 10.949 1.623 4.270
236 HD1 TRP 48 HD1 TRP 48 11.245 1.628 0.598
237 HE1 TRP 48 HE1 TRP 48 10.891 3.927 -0.405
238 HE3 TRP 48 HE3 TRP 48 9.631 3.956 4.764
239 HZ2 TRP 48 HZ2 TRP 48 10.169 6.640 0.597
240 HZ3 TRP 48 HZ3 TRP 48 9.136 6.446 4.776
241 HH2 TRP 48 HH2 TRP 48 9.423 7.759 2.689
242 H GLY 49 H GLY 49 12.468 -1.383 3.668
243 1HA GLY 49 1HA GLY 49 13.051 -2.717 5.546
244 2HA GLY 49 2HA GLY 49 11.580 -2.149 6.343
245 H CYS 50 H CYS 50 10.693 -3.433 3.307
246 HA CYS 50 HA CYS 50 9.187 -4.986 2.884
247 1HB CYS 50 1HB CYS 50 11.421 -5.557 2.180
248 2HB CYS 50 2HB CYS 50 11.754 -6.319 3.705
249 H GLY 51 H GLY 51 8.863 -4.271 5.657
250 1HA GLY 51 1HA GLY 51 6.866 -6.244 6.381
251 2HA GLY 51 2HA GLY 51 8.197 -6.369 7.464
Start of MODEL 19
1 H SER 10 H SER 10 -5.909 -1.322 5.887
2 HA SER 10 HA SER 10 -7.803 -3.283 6.919
3 1HB SER 10 1HB SER 10 -7.795 -0.425 7.994
4 2HB SER 10 2HB SER 10 -9.216 -1.481 8.049
5 HG SER 10 HG SER 10 -6.714 -2.305 9.101
6 H CYS 11 H CYS 11 -8.234 -3.715 4.925
7 HA CYS 11 HA CYS 11 -9.946 -2.011 3.306
8 1HB CYS 11 1HB CYS 11 -7.224 -1.859 3.059
9 2HB CYS 11 2HB CYS 11 -7.511 -3.217 2.011
10 HA PRO 12 HA PRO 12 -11.000 -6.401 2.218
11 1HB PRO 12 1HB PRO 12 -9.476 -6.650 -0.351
12 2HB PRO 12 2HB PRO 12 -11.209 -6.975 -0.055
13 1HG PRO 12 1HG PRO 12 -10.393 -4.762 -1.433
14 2HG PRO 12 2HG PRO 12 -11.780 -4.702 -0.299
15 1HD PRO 12 1HD PRO 12 -8.914 -3.876 0.203
16 2HD PRO 12 2HD PRO 12 -10.427 -3.000 0.586
17 HA PRO 13 HA PRO 13 -7.324 -8.581 3.524
18 1HB PRO 13 1HB PRO 13 -7.638 -11.188 2.762
19 2HB PRO 13 2HB PRO 13 -8.658 -10.432 4.028
20 1HG PRO 13 1HG PRO 13 -9.286 -10.772 1.085
21 2HG PRO 13 2HG PRO 13 -10.323 -11.203 2.486
22 1HD PRO 13 1HD PRO 13 -10.622 -8.863 1.130
23 2HD PRO 13 2HD PRO 13 -10.841 -8.925 2.907
24 H GLY 14 H GLY 14 -5.401 -9.181 2.945
25 1HA GLY 14 1HA GLY 14 -3.474 -9.091 1.716
26 2HA GLY 14 2HA GLY 14 -4.372 -9.699 0.327
27 H GLN 15 H GLN 15 -5.297 -6.577 1.821
28 HA GLN 15 HA GLN 15 -3.904 -5.040 -0.246
29 1HB GLN 15 1HB GLN 15 -6.840 -5.296 0.095
30 2HB GLN 15 2HB GLN 15 -6.216 -3.655 -0.129
31 1HG GLN 15 1HG GLN 15 -5.260 -4.123 -2.221
32 2HG GLN 15 2HG GLN 15 -5.251 -5.869 -1.950
33 1HE2 GLN 15 2HE2 GLN 15 -7.348 -6.982 -1.807
34 2HE2 GLN 15 1HE2 GLN 15 -8.569 -6.420 -2.946
35 H PHE 16 H PHE 16 -2.955 -3.401 0.565
36 HA PHE 16 HA PHE 16 -3.795 -2.166 3.197
37 1HB PHE 16 1HB PHE 16 -1.602 -2.032 3.998
38 2HB PHE 16 2HB PHE 16 -1.671 -3.638 3.308
39 HD1 PHE 16 HD1 PHE 16 0.089 -0.489 3.329
40 HD2 PHE 16 HD2 PHE 16 -0.830 -3.862 0.847
41 HE1 PHE 16 HE1 PHE 16 1.849 0.208 1.745
42 HE2 PHE 16 HE2 PHE 16 1.007 -3.253 -0.687
43 HZ PHE 16 HZ PHE 16 2.308 -1.230 -0.321
44 H ARG 17 H ARG 17 -3.056 0.127 3.516
45 HA ARG 17 HA ARG 17 -2.848 1.606 0.930
46 1HB ARG 17 1HB ARG 17 -3.730 3.533 2.023
47 2HB ARG 17 2HB ARG 17 -4.821 2.137 2.167
48 1HG ARG 17 1HG ARG 17 -4.073 1.813 4.527
49 2HG ARG 17 2HG ARG 17 -3.018 3.224 4.377
50 1HD ARG 17 1HD ARG 17 -5.097 3.835 5.524
51 2HD ARG 17 2HD ARG 17 -4.947 4.682 3.988
52 HE ARG 17 HE ARG 17 -6.849 3.625 3.196
53 1HH1 ARG 17 2HH1 ARG 17 -5.966 1.818 6.095
54 2HH1 ARG 17 1HH1 ARG 17 -7.405 0.822 5.912
55 1HH2 ARG 17 2HH2 ARG 17 -8.526 2.305 3.089
56 2HH2 ARG 17 1HH2 ARG 17 -8.729 1.020 4.284
57 H CYS 18 H CYS 18 -1.531 3.236 0.627
58 HA CYS 18 HA CYS 18 1.141 2.797 1.762
59 1HB CYS 18 1HB CYS 18 -0.035 3.983 -0.738
60 2HB CYS 18 2HB CYS 18 1.606 4.413 -0.270
61 H SER 19 H SER 19 0.211 5.762 0.451
62 HA SER 19 HA SER 19 1.550 7.192 2.702
63 1HB SER 19 1HB SER 19 1.529 7.920 -0.253
64 2HB SER 19 2HB SER 19 2.455 8.738 1.022
65 HG SER 19 HG SER 19 3.051 6.490 -0.357
66 H GLU 20 H GLU 20 -1.083 6.764 2.678
67 HA GLU 20 HA GLU 20 -2.072 9.485 3.312
68 1HB GLU 20 1HB GLU 20 -2.934 8.949 1.104
69 2HB GLU 20 2HB GLU 20 -3.671 7.467 1.710
70 1HG GLU 20 1HG GLU 20 -5.201 8.741 3.132
71 2HG GLU 20 2HG GLU 20 -4.350 10.244 2.763
72 HA PRO 21 HA PRO 21 -2.695 7.010 7.012
73 1HB PRO 21 1HB PRO 21 -3.649 8.943 8.721
74 2HB PRO 21 2HB PRO 21 -1.960 8.912 8.132
75 1HG PRO 21 1HG PRO 21 -4.299 10.496 7.010
76 2HG PRO 21 2HG PRO 21 -2.674 11.106 7.474
77 1HD PRO 21 1HD PRO 21 -3.257 10.461 4.900
78 2HD PRO 21 2HD PRO 21 -1.655 10.083 5.601
79 HA PRO 22 HA PRO 22 -7.007 5.859 7.316
80 1HB PRO 22 1HB PRO 22 -7.415 5.286 9.973
81 2HB PRO 22 2HB PRO 22 -6.446 4.258 8.873
82 1HG PRO 22 1HG PRO 22 -5.448 6.412 10.765
83 2HG PRO 22 2HG PRO 22 -4.882 4.720 10.602
84 1HD PRO 22 1HD PRO 22 -3.593 6.757 9.362
85 2HD PRO 22 2HD PRO 22 -3.808 5.190 8.531
86 H GLY 23 H GLY 23 -9.052 6.371 8.534
87 1HA GLY 23 1HA GLY 23 -10.719 7.982 8.917
88 2HA GLY 23 2HA GLY 23 -9.476 9.184 9.262
89 H ALA 24 H ALA 24 -8.256 8.252 6.546
90 HA ALA 24 HA ALA 24 -10.206 9.328 4.578
91 1HB ALA 24 1HB ALA 24 -8.518 11.063 4.991
92 2HB ALA 24 2HB ALA 24 -7.210 9.899 4.687
93 3HB ALA 24 3HB ALA 24 -8.309 10.368 3.372
94 H HIS 25 H HIS 25 -10.775 7.065 4.509
95 HA HIS 25 HA HIS 25 -9.170 4.898 4.396
96 1HB HIS 25 1HB HIS 25 -11.895 5.257 3.079
97 2HB HIS 25 2HB HIS 25 -11.171 3.735 3.554
98 HD1 HIS 25 HD1 HIS 25 -13.537 6.189 4.880
99 HD2 HIS 25 HD2 HIS 25 -10.477 3.691 6.404
100 HE1 HIS 25 HE1 HIS 25 -13.944 5.994 7.417
101 HE2 HIS 25 HE2 HIS 25 -12.094 4.463 8.340
102 H GLY 26 H GLY 26 -10.173 6.663 1.623
103 1HA GLY 26 1HA GLY 26 -9.360 6.816 -0.572
104 2HA GLY 26 2HA GLY 26 -7.830 6.356 0.175
105 H GLU 27 H GLU 27 -7.131 5.295 -1.590
106 HA GLU 27 HA GLU 27 -8.278 2.583 -2.185
107 1HB GLU 27 1HB GLU 27 -7.126 4.574 -4.204
108 2HB GLU 27 2HB GLU 27 -7.481 2.873 -4.534
109 1HG GLU 27 1HG GLU 27 -9.878 3.271 -3.996
110 2HG GLU 27 2HG GLU 27 -9.532 4.981 -3.727
111 H CYS 28 H CYS 28 -7.218 1.327 -1.263
112 HA CYS 28 HA CYS 28 -4.510 1.163 -0.582
113 1HB CYS 28 1HB CYS 28 -6.667 -0.912 -1.107
114 2HB CYS 28 2HB CYS 28 -5.300 -1.114 -0.094
115 H TYR 29 H TYR 29 -3.512 -1.092 -1.222
116 HA TYR 29 HA TYR 29 -3.482 -1.714 -4.087
117 1HB TYR 29 1HB TYR 29 -0.975 -0.941 -2.515
118 2HB TYR 29 2HB TYR 29 -0.962 -1.555 -4.147
119 HD1 TYR 29 HD1 TYR 29 -1.836 -0.040 -6.058
120 HD2 TYR 29 HD2 TYR 29 -1.260 1.351 -2.006
121 HE1 TYR 29 HE1 TYR 29 -1.905 2.296 -6.851
122 HE2 TYR 29 HE2 TYR 29 -1.339 3.709 -2.823
123 HH TYR 29 HH TYR 29 -1.798 4.507 -6.281
124 HA PRO 30 HA PRO 30 -3.068 -5.784 -2.408
125 1HB PRO 30 1HB PRO 30 -0.913 -6.436 -4.352
126 2HB PRO 30 2HB PRO 30 -2.465 -7.273 -4.067
127 1HG PRO 30 1HG PRO 30 -2.082 -5.712 -6.286
128 2HG PRO 30 2HG PRO 30 -3.648 -5.697 -5.409
129 1HD PRO 30 1HD PRO 30 -1.358 -3.729 -5.193
130 2HD PRO 30 2HD PRO 30 -3.105 -3.401 -5.365
131 H GLN 31 H GLN 31 -1.829 -6.923 -0.969
132 HA GLN 31 HA GLN 31 0.780 -5.830 -0.090
133 1HB GLN 31 1HB GLN 31 -0.801 -8.297 0.812
134 2HB GLN 31 2HB GLN 31 0.691 -7.743 1.571
135 1HG GLN 31 1HG GLN 31 -0.343 -5.675 2.296
136 2HG GLN 31 2HG GLN 31 -1.837 -6.053 1.434
137 1HE2 GLN 31 1HE2 GLN 31 -3.152 -5.963 3.400
138 2HE2 GLN 31 2HE2 GLN 31 -2.972 -7.240 4.591
139 H ASP 32 H ASP 32 -0.108 -7.802 -2.583
140 HA ASP 32 HA ASP 32 2.357 -9.263 -2.915
141 1HB ASP 32 1HB ASP 32 0.085 -9.383 -4.223
142 2HB ASP 32 2HB ASP 32 0.630 -7.967 -5.072
143 H TRP 33 H TRP 33 1.245 -6.090 -3.389
144 HA TRP 33 HA TRP 33 3.838 -4.979 -4.201
145 1HB TRP 33 1HB TRP 33 1.247 -3.481 -3.951
146 2HB TRP 33 2HB TRP 33 2.746 -2.938 -4.650
147 HD1 TRP 33 HD1 TRP 33 2.055 -6.271 -6.121
148 HE1 TRP 33 HE1 TRP 33 0.810 -6.109 -8.347
149 HE3 TRP 33 HE3 TRP 33 0.873 -1.286 -6.026
150 HZ2 TRP 33 HZ2 TRP 33 -0.665 -4.130 -9.823
151 HZ3 TRP 33 HZ3 TRP 33 -0.443 -0.285 -7.889
152 HH2 TRP 33 HH2 TRP 33 -1.272 -1.703 -9.745
153 H LEU 34 H LEU 34 3.687 -6.103 -1.893
154 HA LEU 34 HA LEU 34 4.816 -3.919 -0.229
155 1HB LEU 34 1HB LEU 34 2.562 -4.695 0.715
156 2HB LEU 34 2HB LEU 34 3.276 -6.277 0.937
157 HG LEU 34 HG LEU 34 5.074 -5.133 2.383
158 1HD1 LEU 34 1HD1 LEU 34 4.503 -2.994 3.387
159 2HD1 LEU 34 2HD1 LEU 34 4.563 -2.792 1.630
160 3HD1 LEU 34 3HD1 LEU 34 2.997 -2.910 2.448
161 1HD2 LEU 34 1HD2 LEU 34 2.161 -5.040 3.300
162 2HD2 LEU 34 2HD2 LEU 34 3.216 -6.472 3.327
163 3HD2 LEU 34 3HD2 LEU 34 3.588 -5.084 4.361
164 H CYS 35 H CYS 35 6.919 -4.277 -0.485
165 HA CYS 35 HA CYS 35 8.843 -5.083 -1.129
166 1HB CYS 35 1HB CYS 35 8.951 -5.725 0.980
167 2HB CYS 35 2HB CYS 35 8.057 -7.212 0.789
168 H ASP 36 H ASP 36 7.714 -5.078 -3.187
169 HA ASP 36 HA ASP 36 7.285 -7.727 -4.521
170 1HB ASP 36 1HB ASP 36 5.743 -5.801 -4.985
171 2HB ASP 36 2HB ASP 36 7.102 -4.916 -5.660
172 H GLY 37 H GLY 37 9.749 -5.458 -3.838
173 1HA GLY 37 1HA GLY 37 12.061 -5.591 -4.426
174 2HA GLY 37 2HA GLY 37 11.646 -6.611 -5.817
175 H HIS 38 H HIS 38 9.551 -4.182 -5.540
176 HA HIS 38 HA HIS 38 10.748 -2.169 -7.317
177 1HB HIS 38 1HB HIS 38 9.891 -3.741 -8.876
178 2HB HIS 38 2HB HIS 38 8.478 -4.084 -7.915
179 HD1 HIS 38 HD1 HIS 38 9.684 -1.186 -10.219
180 HD2 HIS 38 HD2 HIS 38 6.382 -2.604 -8.012
181 HE1 HIS 38 HE1 HIS 38 7.706 0.397 -10.734
182 HE2 HIS 38 HE2 HIS 38 5.673 -0.515 -9.416
183 HA PRO 39 HA PRO 39 8.123 -0.031 -4.262
184 1HB PRO 39 1HB PRO 39 8.519 2.560 -5.228
185 2HB PRO 39 2HB PRO 39 9.386 1.721 -3.939
186 1HG PRO 39 1HG PRO 39 10.420 2.422 -6.587
187 2HG PRO 39 2HG PRO 39 11.283 1.623 -5.242
188 1HD PRO 39 1HD PRO 39 10.070 0.432 -7.656
189 2HD PRO 39 2HD PRO 39 11.250 -0.282 -6.533
190 H ASP 40 H ASP 40 6.101 0.972 -4.279
191 HA ASP 40 HA ASP 40 5.073 2.137 -6.805
192 1HB ASP 40 1HB ASP 40 4.517 -0.560 -6.362
193 2HB ASP 40 2HB ASP 40 3.090 0.222 -5.711
194 H CYS 41 H CYS 41 5.541 2.491 -3.633
195 HA CYS 41 HA CYS 41 2.886 2.937 -2.784
196 1HB CYS 41 1HB CYS 41 5.312 2.630 -1.509
197 2HB CYS 41 2HB CYS 41 4.632 4.112 -0.880
198 H ASP 42 H ASP 42 3.781 4.732 -4.792
199 HA ASP 42 HA ASP 42 4.430 6.774 -5.465
200 1HB ASP 42 1HB ASP 42 1.946 7.109 -5.104
201 2HB ASP 42 2HB ASP 42 2.323 7.867 -3.559
202 H ASP 43 H ASP 43 5.114 5.998 -2.459
203 HA ASP 43 HA ASP 43 7.387 7.854 -2.387
204 1HB ASP 43 1HB ASP 43 5.550 8.028 -0.541
205 2HB ASP 43 2HB ASP 43 6.307 6.572 0.073
206 H GLY 44 H GLY 44 6.475 4.867 -3.019
207 1HA GLY 44 1HA GLY 44 7.616 2.753 -3.133
208 2HA GLY 44 2HA GLY 44 9.111 3.609 -2.816
209 H ARG 45 H ARG 45 6.541 3.731 -0.588
210 HA ARG 45 HA ARG 45 8.324 2.615 1.530
211 1HB ARG 45 1HB ARG 45 6.969 3.569 3.212
212 2HB ARG 45 2HB ARG 45 7.342 4.816 2.030
213 1HG ARG 45 1HG ARG 45 5.073 4.703 1.120
214 2HG ARG 45 2HG ARG 45 4.699 3.298 2.133
215 1HD ARG 45 1HD ARG 45 3.700 5.270 3.092
216 2HD ARG 45 2HD ARG 45 4.982 4.665 4.155
217 HE ARG 45 HE ARG 45 5.884 6.743 2.298
218 1HH1 ARG 45 2HH1 ARG 45 4.273 6.390 5.385
219 2HH1 ARG 45 1HH1 ARG 45 4.822 7.954 5.935
220 1HH2 ARG 45 2HH2 ARG 45 6.596 8.609 3.046
221 2HH2 ARG 45 1HH2 ARG 45 6.099 9.217 4.622
222 H ASP 46 H ASP 46 6.523 1.221 -0.665
223 HA ASP 46 HA ASP 46 5.265 -0.724 1.030
224 1HB ASP 46 1HB ASP 46 4.902 -1.880 -1.099
225 2HB ASP 46 2HB ASP 46 4.158 -0.290 -1.109
226 H GLU 47 H GLU 47 8.175 -0.013 -0.728
227 HA GLU 47 HA GLU 47 9.234 -2.695 -0.555
228 1HB GLU 47 1HB GLU 47 10.427 0.016 -1.199
229 2HB GLU 47 2HB GLU 47 11.404 -1.435 -1.202
230 1HG GLU 47 1HG GLU 47 8.822 -1.362 -2.776
231 2HG GLU 47 2HG GLU 47 10.273 -0.600 -3.391
232 H TRP 48 H TRP 48 9.356 0.139 1.329
233 HA TRP 48 HA TRP 48 11.839 -0.076 2.528
234 1HB TRP 48 1HB TRP 48 9.419 1.301 3.696
235 2HB TRP 48 2HB TRP 48 11.077 1.499 4.235
236 HD1 TRP 48 HD1 TRP 48 11.288 1.564 0.562
237 HE1 TRP 48 HE1 TRP 48 10.933 3.884 -0.395
238 HE3 TRP 48 HE3 TRP 48 9.795 3.837 4.802
239 HZ2 TRP 48 HZ2 TRP 48 10.261 6.586 0.667
240 HZ3 TRP 48 HZ3 TRP 48 9.322 6.329 4.866
241 HH2 TRP 48 HH2 TRP 48 9.571 7.676 2.795
242 H GLY 49 H GLY 49 12.566 -1.501 3.518
243 1HA GLY 49 1HA GLY 49 13.228 -2.846 5.358
244 2HA GLY 49 2HA GLY 49 11.783 -2.301 6.215
245 H CYS 50 H CYS 50 10.776 -3.548 3.206
246 HA CYS 50 HA CYS 50 9.246 -5.133 2.843
247 1HB CYS 50 1HB CYS 50 11.469 -5.640 2.011
248 2HB CYS 50 2HB CYS 50 11.883 -6.431 3.500
249 H GLY 51 H GLY 51 9.034 -4.440 5.597
250 1HA GLY 51 1HA GLY 51 8.107 -6.960 6.968
251 2HA GLY 51 2HA GLY 51 8.620 -5.489 7.784
Start of MODEL 20
1 H SER 10 H SER 10 -5.834 -0.830 5.868
2 HA SER 10 HA SER 10 -7.481 -2.947 7.044
3 1HB SER 10 1HB SER 10 -7.902 -0.010 7.794
4 2HB SER 10 2HB SER 10 -9.020 -1.328 8.168
5 HG SER 10 HG SER 10 -7.773 -1.952 9.770
6 H CYS 11 H CYS 11 -7.896 -3.571 5.085
7 HA CYS 11 HA CYS 11 -9.797 -2.168 3.391
8 1HB CYS 11 1HB CYS 11 -7.094 -1.794 3.066
9 2HB CYS 11 2HB CYS 11 -7.304 -3.240 2.113
10 HA PRO 12 HA PRO 12 -10.806 -6.473 2.707
11 1HB PRO 12 1HB PRO 12 -9.865 -6.787 -0.134
12 2HB PRO 12 2HB PRO 12 -11.500 -7.070 0.530
13 1HG PRO 12 1HG PRO 12 -10.936 -4.871 -0.996
14 2HG PRO 12 2HG PRO 12 -12.040 -4.771 0.414
15 1HD PRO 12 1HD PRO 12 -9.099 -4.054 0.284
16 2HD PRO 12 2HD PRO 12 -10.456 -3.116 0.970
17 HA PRO 13 HA PRO 13 -7.239 -8.976 3.415
18 1HB PRO 13 2HB PRO 13 -8.457 -11.120 1.631
19 2HB PRO 13 1HB PRO 13 -7.697 -11.313 3.246
20 1HG PRO 13 2HG PRO 13 -10.384 -11.251 3.051
21 2HG PRO 13 1HG PRO 13 -9.561 -10.284 4.325
22 1HD PRO 13 2HD PRO 13 -10.639 -9.332 1.653
23 2HD PRO 13 1HD PRO 13 -10.810 -8.592 3.277
24 H GLY 14 H GLY 14 -5.359 -9.341 2.777
25 1HA GLY 14 1HA GLY 14 -3.437 -9.219 1.535
26 2HA GLY 14 2HA GLY 14 -4.345 -9.786 0.137
27 H GLN 15 H GLN 15 -5.350 -6.723 1.677
28 HA GLN 15 HA GLN 15 -3.877 -5.131 -0.306
29 1HB GLN 15 1HB GLN 15 -6.837 -5.197 0.111
30 2HB GLN 15 2HB GLN 15 -6.054 -3.670 -0.294
31 1HG GLN 15 1HG GLN 15 -5.396 -4.343 -2.396
32 2HG GLN 15 2HG GLN 15 -5.254 -6.042 -1.949
33 1HE2 GLN 15 1HE2 GLN 15 -7.379 -7.165 -1.336
34 2HE2 GLN 15 2HE2 GLN 15 -8.609 -6.884 -2.565
35 H PHE 16 H PHE 16 -3.015 -3.457 0.493
36 HA PHE 16 HA PHE 16 -3.841 -2.264 3.145
37 1HB PHE 16 1HB PHE 16 -1.643 -2.072 3.934
38 2HB PHE 16 2HB PHE 16 -1.680 -3.681 3.253
39 HD1 PHE 16 HD1 PHE 16 -0.848 -3.885 0.785
40 HD2 PHE 16 HD2 PHE 16 0.040 -0.518 3.283
41 HE1 PHE 16 HE1 PHE 16 0.992 -3.259 -0.742
42 HE2 PHE 16 HE2 PHE 16 1.814 0.187 1.712
43 HZ PHE 16 HZ PHE 16 2.286 -1.233 -0.352
44 H ARG 17 H ARG 17 -3.130 0.075 3.439
45 HA ARG 17 HA ARG 17 -2.911 1.506 0.828
46 1HB ARG 17 1HB ARG 17 -3.817 3.448 1.849
47 2HB ARG 17 2HB ARG 17 -4.903 2.052 2.040
48 1HG ARG 17 1HG ARG 17 -4.198 1.822 4.410
49 2HG ARG 17 2HG ARG 17 -3.109 3.202 4.223
50 1HD ARG 17 1HD ARG 17 -5.183 3.909 5.318
51 2HD ARG 17 2HD ARG 17 -4.990 4.692 3.753
52 HE ARG 17 HE ARG 17 -6.916 3.670 2.982
53 1HH1 ARG 17 2HH2 ARG 17 -6.116 1.957 5.956
54 2HH1 ARG 17 1HH2 ARG 17 -7.561 0.963 5.769
55 1HH2 ARG 17 1HH1 ARG 17 -8.621 2.372 2.895
56 2HH2 ARG 17 2HH1 ARG 17 -8.855 1.123 4.119
57 H CYS 18 H CYS 18 -1.570 3.115 0.505
58 HA CYS 18 HA CYS 18 1.079 2.685 1.681
59 1HB CYS 18 1HB CYS 18 -0.063 3.932 -0.808
60 2HB CYS 18 2HB CYS 18 1.577 4.334 -0.311
61 H SER 19 H SER 19 0.169 5.664 0.401
62 HA SER 19 HA SER 19 1.528 7.050 2.665
63 1HB SER 19 1HB SER 19 1.483 7.826 -0.276
64 2HB SER 19 2HB SER 19 2.438 8.608 1.000
65 HG SER 19 HG SER 19 2.993 6.389 -0.429
66 H GLU 20 H GLU 20 -1.110 6.659 2.661
67 HA GLU 20 HA GLU 20 -2.061 9.390 3.330
68 1HB GLU 20 1HB GLU 20 -2.949 8.885 1.133
69 2HB GLU 20 2HB GLU 20 -3.698 7.405 1.727
70 1HG GLU 20 1HG GLU 20 -5.216 8.660 3.154
71 2HG GLU 20 2HG GLU 20 -4.327 10.157 2.868
72 HA PRO 21 HA PRO 21 -2.628 6.848 6.990
73 1HB PRO 21 1HB PRO 21 -3.346 8.774 8.808
74 2HB PRO 21 2HB PRO 21 -1.706 8.674 8.103
75 1HG PRO 21 1HG PRO 21 -4.027 10.405 7.173
76 2HG PRO 21 2HG PRO 21 -2.352 10.924 7.558
77 1HD PRO 21 1HD PRO 21 -3.106 10.382 5.004
78 2HD PRO 21 2HD PRO 21 -1.489 9.906 5.604
79 HA PRO 22 HA PRO 22 -6.923 5.809 7.702
80 1HB PRO 22 1HB PRO 22 -6.410 6.319 10.639
81 2HB PRO 22 2HB PRO 22 -7.261 4.940 9.867
82 1HG PRO 22 1HG PRO 22 -4.733 4.656 10.682
83 2HG PRO 22 2HG PRO 22 -5.205 4.030 9.066
84 1HD PRO 22 1HD PRO 22 -3.775 6.621 9.731
85 2HD PRO 22 2HD PRO 22 -3.405 5.424 8.451
86 H GLY 23 H GLY 23 -8.913 6.506 8.785
87 1HA GLY 23 1HA GLY 23 -10.630 8.090 8.999
88 2HA GLY 23 2HA GLY 23 -9.419 9.330 9.321
89 H ALA 24 H ALA 24 -8.242 8.259 6.595
90 HA ALA 24 HA ALA 24 -10.162 9.412 4.642
91 1HB ALA 24 1HB ALA 24 -8.462 11.123 5.100
92 2HB ALA 24 2HB ALA 24 -7.162 9.957 4.770
93 3HB ALA 24 3HB ALA 24 -8.256 10.466 3.465
94 H HIS 25 H HIS 25 -10.753 7.163 4.493
95 HA HIS 25 HA HIS 25 -9.147 4.983 4.293
96 1HB HIS 25 1HB HIS 25 -11.895 5.440 3.054
97 2HB HIS 25 2HB HIS 25 -11.175 3.882 3.389
98 HD1 HIS 25 HD1 HIS 25 -13.512 6.198 4.957
99 HD2 HIS 25 HD2 HIS 25 -10.370 3.660 6.223
100 HE1 HIS 25 HE1 HIS 25 -13.844 5.824 7.483
101 HE2 HIS 25 HE2 HIS 25 -11.942 4.270 8.251
102 H GLY 26 H GLY 26 -10.111 6.908 1.624
103 1HA GLY 26 1HA GLY 26 -9.344 7.091 -0.603
104 2HA GLY 26 2HA GLY 26 -7.821 6.533 0.087
105 H GLU 27 H GLU 27 -7.073 5.222 -1.411
106 HA GLU 27 HA GLU 27 -8.424 2.660 -1.963
107 1HB GLU 27 1HB GLU 27 -9.020 4.198 -3.889
108 2HB GLU 27 2HB GLU 27 -7.300 4.446 -4.184
109 1HG GLU 27 1HG GLU 27 -8.131 2.844 -5.765
110 2HG GLU 27 2HG GLU 27 -7.047 2.007 -4.668
111 H CYS 28 H CYS 28 -7.349 1.194 -1.563
112 HA CYS 28 HA CYS 28 -4.646 1.152 -0.670
113 1HB CYS 28 1HB CYS 28 -6.774 -0.953 -1.213
114 2HB CYS 28 2HB CYS 28 -5.419 -1.141 -0.174
115 H TYR 29 H TYR 29 -3.635 -1.162 -1.289
116 HA TYR 29 HA TYR 29 -3.535 -1.741 -4.156
117 1HB TYR 29 1HB TYR 29 -1.066 -0.981 -2.519
118 2HB TYR 29 2HB TYR 29 -1.012 -1.576 -4.157
119 HD1 TYR 29 HD1 TYR 29 -1.351 1.300 -1.988
120 HD2 TYR 29 HD2 TYR 29 -1.859 -0.033 -6.067
121 HE1 TYR 29 HE1 TYR 29 -1.420 3.671 -2.774
122 HE2 TYR 29 HE2 TYR 29 -1.911 2.314 -6.830
123 HH TYR 29 HH TYR 29 -1.809 4.517 -6.228
124 HA PRO 30 HA PRO 30 -3.107 -5.832 -2.474
125 1HB PRO 30 1HB PRO 30 -0.978 -6.426 -4.471
126 2HB PRO 30 2HB PRO 30 -2.491 -7.315 -4.135
127 1HG PRO 30 1HG PRO 30 -2.274 -5.760 -6.363
128 2HG PRO 30 2HG PRO 30 -3.785 -5.741 -5.387
129 1HD PRO 30 1HD PRO 30 -1.470 -3.779 -5.289
130 2HD PRO 30 2HD PRO 30 -3.217 -3.437 -5.423
131 H GLN 31 H GLN 31 -1.814 -6.975 -1.070
132 HA GLN 31 HA GLN 31 0.763 -5.836 -0.180
133 1HB GLN 31 1HB GLN 31 -0.780 -8.340 0.683
134 2HB GLN 31 2HB GLN 31 0.697 -7.768 1.461
135 1HG GLN 31 1HG GLN 31 -0.385 -5.728 2.204
136 2HG GLN 31 2HG GLN 31 -1.864 -6.126 1.328
137 1HE2 GLN 31 2HE2 GLN 31 -3.187 -6.073 3.304
138 2HE2 GLN 31 1HE2 GLN 31 -2.985 -7.366 4.474
139 H ASP 32 H ASP 32 -0.098 -7.785 -2.698
140 HA ASP 32 HA ASP 32 2.366 -9.238 -3.048
141 1HB ASP 32 1HB ASP 32 0.100 -9.340 -4.363
142 2HB ASP 32 2HB ASP 32 0.635 -7.901 -5.178
143 H TRP 33 H TRP 33 1.253 -6.058 -3.482
144 HA TRP 33 HA TRP 33 3.858 -4.935 -4.247
145 1HB TRP 33 1HB TRP 33 1.263 -3.440 -3.997
146 2HB TRP 33 2HB TRP 33 2.768 -2.889 -4.681
147 HD1 TRP 33 HD1 TRP 33 2.116 -6.191 -6.210
148 HE1 TRP 33 HE1 TRP 33 0.849 -6.016 -8.424
149 HE3 TRP 33 HE3 TRP 33 0.890 -1.220 -6.045
150 HZ2 TRP 33 HZ2 TRP 33 -0.676 -4.037 -9.851
151 HZ3 TRP 33 HZ3 TRP 33 -0.460 -0.211 -7.881
152 HH2 TRP 33 HH2 TRP 33 -1.312 -1.619 -9.733
153 H LEU 34 H LEU 34 3.681 -6.093 -1.958
154 HA LEU 34 HA LEU 34 4.794 -3.927 -0.259
155 1HB LEU 34 1HB LEU 34 2.536 -4.711 0.663
156 2HB LEU 34 2HB LEU 34 3.249 -6.296 0.878
157 HG LEU 34 HG LEU 34 5.031 -5.172 2.351
158 1HD1 LEU 34 1HD1 LEU 34 4.457 -3.035 3.367
159 2HD1 LEU 34 2HD1 LEU 34 4.551 -2.822 1.614
160 3HD1 LEU 34 3HD1 LEU 34 2.970 -2.933 2.399
161 1HD2 LEU 34 1HD2 LEU 34 3.164 -6.502 3.276
162 2HD2 LEU 34 2HD2 LEU 34 3.517 -5.111 4.314
163 3HD2 LEU 34 3HD2 LEU 34 2.109 -5.071 3.232
164 H CYS 35 H CYS 35 6.893 -4.276 -0.514
165 HA CYS 35 HA CYS 35 8.836 -5.077 -1.117
166 1HB CYS 35 1HB CYS 35 8.885 -5.740 0.990
167 2HB CYS 35 2HB CYS 35 7.999 -7.223 0.762
168 H ASP 36 H ASP 36 7.730 -5.051 -3.201
169 HA ASP 36 HA ASP 36 7.314 -7.688 -4.560
170 1HB ASP 36 1HB ASP 36 5.789 -5.751 -5.032
171 2HB ASP 36 2HB ASP 36 7.164 -4.866 -5.677
172 H GLY 37 H GLY 37 9.781 -5.445 -3.817
173 1HA GLY 37 1HA GLY 37 12.101 -5.591 -4.359
174 2HA GLY 37 2HA GLY 37 11.707 -6.599 -5.766
175 H HIS 38 H HIS 38 9.621 -4.164 -5.524
176 HA HIS 38 HA HIS 38 10.873 -2.137 -7.249
177 1HB HIS 38 1HB HIS 38 10.050 -3.689 -8.846
178 2HB HIS 38 2HB HIS 38 8.611 -4.034 -7.926
179 HD1 HIS 38 HD1 HIS 38 9.895 -1.114 -10.160
180 HD2 HIS 38 HD2 HIS 38 6.522 -2.548 -8.070
181 HE1 HIS 38 HE1 HIS 38 7.938 0.483 -10.714
182 HE2 HIS 38 HE2 HIS 38 5.866 -0.433 -9.465
183 HA PRO 39 HA PRO 39 8.173 -0.030 -4.236
184 1HB PRO 39 1HB PRO 39 8.625 2.571 -5.178
185 2HB PRO 39 2HB PRO 39 9.402 1.723 -3.838
186 1HG PRO 39 1HG PRO 39 10.646 2.441 -6.368
187 2HG PRO 39 2HG PRO 39 11.369 1.537 -5.007
188 1HD PRO 39 1HD PRO 39 10.215 0.512 -7.543
189 2HD PRO 39 2HD PRO 39 11.365 -0.274 -6.436
190 H ASP 40 H ASP 40 6.155 0.966 -4.300
191 HA ASP 40 HA ASP 40 5.179 2.146 -6.841
192 1HB ASP 40 1HB ASP 40 4.666 -0.558 -6.459
193 2HB ASP 40 2HB ASP 40 3.215 0.173 -5.802
194 H CYS 41 H CYS 41 5.560 2.474 -3.655
195 HA CYS 41 HA CYS 41 2.880 2.885 -2.862
196 1HB CYS 41 1HB CYS 41 5.292 2.630 -1.532
197 2HB CYS 41 2HB CYS 41 4.540 4.079 -0.907
198 H ASP 42 H ASP 42 3.806 4.699 -4.846
199 HA ASP 42 HA ASP 42 4.438 6.755 -5.491
200 1HB ASP 42 1HB ASP 42 1.944 7.053 -5.194
201 2HB ASP 42 2HB ASP 42 2.266 7.800 -3.631
202 H ASP 43 H ASP 43 5.063 5.970 -2.475
203 HA ASP 43 HA ASP 43 7.310 7.854 -2.344
204 1HB ASP 43 1HB ASP 43 5.440 7.998 -0.532
205 2HB ASP 43 2HB ASP 43 6.195 6.543 0.084
206 H GLY 44 H GLY 44 6.448 4.859 -3.011
207 1HA GLY 44 1HA GLY 44 7.619 2.761 -3.115
208 2HA GLY 44 2HA GLY 44 9.096 3.634 -2.764
209 H ARG 45 H ARG 45 6.485 3.709 -0.585
210 HA ARG 45 HA ARG 45 8.241 2.593 1.558
211 1HB ARG 45 1HB ARG 45 6.840 3.531 3.222
212 2HB ARG 45 2HB ARG 45 7.239 4.786 2.059
213 1HG ARG 45 1HG ARG 45 4.997 4.673 1.088
214 2HG ARG 45 2HG ARG 45 4.599 3.260 2.081
215 1HD ARG 45 1HD ARG 45 3.565 5.204 3.035
216 2HD ARG 45 2HD ARG 45 4.838 4.626 4.123
217 HE ARG 45 HE ARG 45 5.797 6.703 2.317
218 1HH1 ARG 45 1HH2 ARG 45 3.902 6.395 5.243
219 2HH1 ARG 45 2HH2 ARG 45 4.327 8.003 5.774
220 1HH2 ARG 45 2HH1 ARG 45 6.343 8.623 3.039
221 2HH2 ARG 45 1HH1 ARG 45 5.679 9.271 4.537
222 H ASP 46 H ASP 46 6.496 1.201 -0.677
223 HA ASP 46 HA ASP 46 5.221 -0.765 0.980
224 1HB ASP 46 1HB ASP 46 4.947 -1.925 -1.168
225 2HB ASP 46 2HB ASP 46 4.146 -0.360 -1.172
226 H GLU 47 H GLU 47 8.160 -0.020 -0.717
227 HA GLU 47 HA GLU 47 9.235 -2.693 -0.526
228 1HB GLU 47 1HB GLU 47 10.421 0.028 -1.132
229 2HB GLU 47 2HB GLU 47 11.410 -1.416 -1.120
230 1HG GLU 47 1HG GLU 47 8.861 -1.352 -2.748
231 2HG GLU 47 2HG GLU 47 10.323 -0.583 -3.330
232 H TRP 48 H TRP 48 9.294 0.131 1.376
233 HA TRP 48 HA TRP 48 11.740 -0.083 2.658
234 1HB TRP 48 1HB TRP 48 9.278 1.280 3.750
235 2HB TRP 48 2HB TRP 48 10.918 1.486 4.339
236 HD1 TRP 48 HD1 TRP 48 11.230 1.562 0.670
237 HE1 TRP 48 HE1 TRP 48 10.881 3.877 -0.292
238 HE3 TRP 48 HE3 TRP 48 9.610 3.817 4.875
239 HZ2 TRP 48 HZ2 TRP 48 10.144 6.572 0.754
240 HZ3 TRP 48 HZ3 TRP 48 9.112 6.303 4.930
241 HH2 TRP 48 HH2 TRP 48 9.395 7.653 2.863
242 H GLY 49 H GLY 49 12.428 -1.514 3.680
243 1HA GLY 49 1HA GLY 49 13.007 -2.877 5.538
244 2HA GLY 49 2HA GLY 49 11.530 -2.325 6.338
245 H CYS 50 H CYS 50 10.665 -3.561 3.271
246 HA CYS 50 HA CYS 50 9.136 -5.123 2.843
247 1HB CYS 50 1HB CYS 50 11.379 -5.657 2.101
248 2HB CYS 50 2HB CYS 50 11.729 -6.454 3.606
249 H GLY 51 H GLY 51 8.736 -4.406 5.526
250 1HA GLY 51 1HA GLY 51 6.758 -6.257 6.423
251 2HA GLY 51 2HA GLY 51 8.239 -6.601 7.317