Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
600269 | 2naj RC | 25939 | cing | 1-original | 3 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 HA ASN 1 HA ASN 1 -4.894 2.178 8.907
2 HB2 ASN 1 1HB ASN 1 -4.721 0.766 11.074
3 HB3 ASN 1 2HB ASN 1 -2.978 0.851 10.820
4 HD21 ASN 1 1HD2 ASN 1 -3.050 3.904 12.594
5 HD22 ASN 1 2HD2 ASN 1 -2.468 2.310 12.536
6 H CYS 2 H CYS 2 -1.891 0.294 9.327
7 HA CYS 2 HA CYS 2 -0.601 2.016 7.318
8 HB2 CYS 2 2HB CYS 2 0.420 1.222 10.019
9 HB3 CYS 2 1HB CYS 2 1.502 1.752 8.759
10 H ALA 3 H ALA 3 1.298 1.101 6.331
11 HA ALA 3 HA ALA 3 1.546 -1.822 6.477
12 HB1 ALA 3 3HB ALA 3 0.221 -0.433 4.344
13 HB2 ALA 3 1HB ALA 3 0.519 -2.165 4.516
14 HB3 ALA 3 2HB ALA 3 1.726 -1.134 3.737
15 H LYS 4 H LYS 4 3.497 -2.623 5.553
16 HA LYS 4 HA LYS 4 5.616 -0.585 5.451
17 HB2 LYS 4 1HB LYS 4 5.797 -3.570 5.895
18 HB3 LYS 4 2HB LYS 4 7.151 -2.437 5.923
19 HG2 LYS 4 1HG LYS 4 5.964 -1.180 7.750
20 HG3 LYS 4 2HG LYS 4 4.770 -2.476 7.794
21 HD2 LYS 4 1HD LYS 4 6.555 -4.108 8.272
22 HD3 LYS 4 2HD LYS 4 7.739 -2.801 8.237
23 HE2 LYS 4 1HE LYS 4 6.572 -1.693 10.115
24 HE3 LYS 4 2HE LYS 4 5.400 -3.011 10.157
25 HZ1 LYS 4 3HZ LYS 4 8.309 -3.482 10.421
26 HZ2 LYS 4 1HZ LYS 4 7.036 -4.530 10.817
27 HZ3 LYS 4 2HZ LYS 4 7.325 -3.151 11.765
28 H GLU 5 H GLU 5 6.983 -0.464 3.695
29 HA GLU 5 HA GLU 5 6.185 -0.822 1.160
30 HB2 GLU 5 1HB GLU 5 8.313 0.276 1.859
31 HB3 GLU 5 2HB GLU 5 9.023 -1.321 2.100
32 HG2 GLU 5 1HG GLU 5 8.615 -1.866 -0.257
33 HG3 GLU 5 2HG GLU 5 7.888 -0.283 -0.504
34 H GLY 6 H GLY 6 5.575 -2.490 -0.042
35 HA2 GLY 6 1HA GLY 6 6.034 -4.602 -1.100
36 HA3 GLY 6 2HA GLY 6 6.848 -5.121 0.372
37 H GLU 7 H GLU 7 4.106 -3.450 1.230
38 HA GLU 7 HA GLU 7 2.686 -5.942 1.819
39 HB2 GLU 7 1HB GLU 7 2.551 -3.133 2.858
40 HB3 GLU 7 2HB GLU 7 1.175 -4.214 3.082
41 HG2 GLU 7 1HG GLU 7 4.002 -4.975 3.847
42 HG3 GLU 7 2HG GLU 7 2.879 -4.213 4.973
43 H VAL 8 H VAL 8 0.392 -6.115 1.416
44 HA VAL 8 HA VAL 8 -0.320 -5.020 -1.192
45 HB VAL 8 HB VAL 8 -0.863 -7.278 -1.085
46 HG11 VAL 8 1HG1 VAL 8 -2.283 -8.033 1.034
47 HG12 VAL 8 2HG1 VAL 8 -1.490 -6.641 1.772
48 HG13 VAL 8 3HG1 VAL 8 -0.522 -7.956 1.109
49 HG21 VAL 8 3HG2 VAL 8 -3.456 -6.164 -0.023
50 HG22 VAL 8 1HG2 VAL 8 -3.211 -7.372 -1.284
51 HG23 VAL 8 2HG2 VAL 8 -2.847 -5.676 -1.605
52 H CYS 9 H CYS 9 -1.530 -3.274 -1.450
53 HA CYS 9 HA CYS 9 -3.136 -2.324 0.844
54 HB2 CYS 9 2HB CYS 9 -2.440 -0.239 0.363
55 HB3 CYS 9 1HB CYS 9 -1.184 -1.028 -0.580
56 H GLY 10 H GLY 10 -5.161 -1.248 0.313
57 HA2 GLY 10 1HA GLY 10 -7.070 -0.856 -0.980
58 HA3 GLY 10 2HA GLY 10 -6.316 -1.727 -2.314
59 H TRP 11 H TRP 11 -5.683 -3.777 -0.022
60 HA TRP 11 HA TRP 11 -8.321 -4.959 0.223
61 HB2 TRP 11 2HB TRP 11 -6.011 -6.577 -0.788
62 HB3 TRP 11 1HB TRP 11 -7.704 -7.027 -0.724
63 HD1 TRP 11 1HD TRP 11 -5.206 -5.634 -2.995
64 HE1 TRP 11 1HE TRP 11 -6.319 -4.684 -5.114
65 HE3 TRP 11 3HE TRP 11 -10.005 -5.522 -1.413
66 HZ2 TRP 11 2HZ TRP 11 -8.952 -3.941 -6.007
67 HZ3 TRP 11 3HZ TRP 11 -11.825 -4.687 -2.895
68 HH2 TRP 11 2HH TRP 11 -11.298 -3.893 -5.190
69 H GLY 12 H GLY 12 -5.259 -4.281 1.394
70 HA2 GLY 12 1HA GLY 12 -5.768 -5.883 3.816
71 HA3 GLY 12 2HA GLY 12 -4.185 -5.947 3.046
72 H SER 13 H SER 13 -3.943 -3.229 2.301
73 HA SER 13 HA SER 13 -4.165 -1.734 4.817
74 HB2 SER 13 1HB SER 13 -1.880 -2.991 4.476
75 HB3 SER 13 2HB SER 13 -1.561 -1.675 3.350
76 HG SER 13 HG SER 13 -1.864 -0.218 5.013
77 H LYS 14 H LYS 14 -2.765 0.497 4.178
78 HA LYS 14 HA LYS 14 -3.509 1.417 1.525
79 HB2 LYS 14 1HB LYS 14 -4.897 3.264 2.361
80 HB3 LYS 14 2HB LYS 14 -5.602 1.698 2.766
81 HG2 LYS 14 1HG LYS 14 -4.610 1.843 5.028
82 HG3 LYS 14 2HG LYS 14 -3.938 3.423 4.628
83 HD2 LYS 14 1HD LYS 14 -6.211 4.293 4.225
84 HD3 LYS 14 2HD LYS 14 -6.885 2.714 4.634
85 HE2 LYS 14 1HE LYS 14 -5.914 2.878 6.894
86 HE3 LYS 14 2HE LYS 14 -5.232 4.453 6.489
87 HZ1 LYS 14 3HZ LYS 14 -7.944 4.490 5.830
88 HZ2 LYS 14 1HZ LYS 14 -7.148 5.379 7.035
89 HZ3 LYS 14 2HZ LYS 14 -7.813 3.859 7.403
90 H CYS 15 H CYS 15 -1.007 1.096 2.896
91 HA CYS 15 HA CYS 15 0.952 2.216 3.303
92 HB2 CYS 15 2HB CYS 15 -0.538 4.219 1.620
93 HB3 CYS 15 1HB CYS 15 1.069 4.532 2.226
94 H CYS 16 H CYS 16 1.751 3.124 5.083
95 HA CYS 16 HA CYS 16 0.048 4.161 7.059
96 HB2 CYS 16 2HB CYS 16 2.429 3.139 7.265
97 HB3 CYS 16 1HB CYS 16 2.966 4.793 7.015
98 H HIS 17 H HIS 17 2.279 5.788 4.842
99 HA HIS 17 HA HIS 17 0.781 8.041 4.358
100 HB2 HIS 17 1HB HIS 17 1.984 8.107 7.032
101 HB3 HIS 17 2HB HIS 17 2.391 9.505 6.041
102 HD1 HIS 17 HD1 HIS 17 -0.054 8.565 8.379
103 HD2 HIS 17 HD2 HIS 17 -0.268 10.381 4.633
104 HE1 HIS 17 HE1 HIS 17 -2.300 9.730 8.276
105 H GLY 18 H GLY 18 3.874 6.672 4.975
106 HA2 GLY 18 1HA GLY 18 5.255 8.607 3.246
107 HA3 GLY 18 2HA GLY 18 6.020 7.334 4.192
108 H LEU 19 H LEU 19 3.432 5.929 2.787
109 HA LEU 19 HA LEU 19 4.967 5.074 0.422
110 HB2 LEU 19 1HB LEU 19 3.095 3.505 2.193
111 HB3 LEU 19 2HB LEU 19 3.742 2.902 0.675
112 HG LEU 19 HG LEU 19 5.501 3.885 2.944
113 HD11 LEU 19 1HD1 LEU 19 5.137 0.981 2.289
114 HD12 LEU 19 2HD1 LEU 19 3.969 1.767 3.351
115 HD13 LEU 19 3HD1 LEU 19 5.672 1.723 3.794
116 HD21 LEU 19 3HD2 LEU 19 7.080 2.244 1.633
117 HD22 LEU 19 1HD2 LEU 19 6.812 3.859 0.994
118 HD23 LEU 19 2HD2 LEU 19 5.946 2.485 0.310
119 H ASP 20 H ASP 20 3.779 4.567 -1.441
120 HA ASP 20 HA ASP 20 1.250 6.050 -1.673
121 HB2 ASP 20 1HB ASP 20 3.172 6.734 -3.137
122 HB3 ASP 20 2HB ASP 20 3.102 5.129 -3.870
123 H CYS 21 H CYS 21 -0.510 4.777 -1.616
124 HA CYS 21 HA CYS 21 -0.277 2.091 -2.780
125 HB2 CYS 21 2HB CYS 21 -1.005 1.483 -0.741
126 HB3 CYS 21 1HB CYS 21 -1.635 3.094 -0.385
127 HA PRO 22 HA PRO 22 -3.145 4.068 -5.700
128 HB2 PRO 22 2HB PRO 22 -2.645 2.383 -7.777
129 HB3 PRO 22 1HB PRO 22 -1.558 3.716 -7.347
130 HG2 PRO 22 2HG PRO 22 -1.289 0.814 -6.789
131 HG3 PRO 22 1HG PRO 22 -0.050 2.004 -7.178
132 HD2 PRO 22 2HD PRO 22 -0.592 1.057 -4.659
133 HD3 PRO 22 1HD PRO 22 0.242 2.583 -5.014
134 H LEU 23 H LEU 23 -5.149 3.448 -6.629
135 HA LEU 23 HA LEU 23 -6.365 1.156 -5.296
136 HB2 LEU 23 1HB LEU 23 -7.312 3.686 -6.514
137 HB3 LEU 23 2HB LEU 23 -8.393 2.300 -6.664
138 HG LEU 23 HG LEU 23 -8.453 1.987 -4.277
139 HD11 LEU 23 1HD1 LEU 23 -6.377 2.383 -3.336
140 HD12 LEU 23 2HD1 LEU 23 -7.131 3.934 -2.972
141 HD13 LEU 23 3HD1 LEU 23 -6.068 3.783 -4.366
142 HD21 LEU 23 3HD2 LEU 23 -8.567 4.964 -4.825
143 HD22 LEU 23 1HD2 LEU 23 -9.445 4.089 -3.569
144 HD23 LEU 23 2HD2 LEU 23 -9.844 3.828 -5.268
145 H ALA 24 H ALA 24 -5.969 -0.668 -6.323
146 HA ALA 24 HA ALA 24 -6.944 -0.997 -9.042
147 HB1 ALA 24 3HB ALA 24 -4.642 -0.417 -9.474
148 HB2 ALA 24 1HB ALA 24 -4.831 -2.152 -9.733
149 HB3 ALA 24 2HB ALA 24 -4.081 -1.558 -8.250
150 H PHE 25 H PHE 25 -6.323 -3.454 -9.645
151 HA PHE 25 HA PHE 25 -7.876 -5.097 -7.973
152 HB2 PHE 25 2HB PHE 25 -7.596 -5.635 -10.312
153 HB3 PHE 25 1HB PHE 25 -5.855 -5.817 -10.103
154 HD1 PHE 25 1HD PHE 25 -9.147 -7.203 -9.025
155 HD2 PHE 25 2HD PHE 25 -4.917 -7.856 -9.359
156 HE1 PHE 25 1HE PHE 25 -9.461 -9.576 -8.373
157 HE2 PHE 25 2HE PHE 25 -5.229 -10.226 -8.707
158 HZ PHE 25 HZ PHE 25 -7.502 -11.089 -8.213
159 H ILE 26 H ILE 26 -4.332 -4.977 -8.412
160 HA ILE 26 HA ILE 26 -4.041 -6.045 -5.692
161 HB ILE 26 HB ILE 26 -3.770 -7.921 -7.253
162 HG12 ILE 26 1HG1 ILE 26 -1.060 -7.136 -6.220
163 HG13 ILE 26 2HG1 ILE 26 -2.370 -7.581 -5.123
164 HG21 ILE 26 1HG2 ILE 26 -1.220 -7.003 -8.342
165 HG22 ILE 26 2HG2 ILE 26 -2.575 -6.015 -8.888
166 HG23 ILE 26 3HG2 ILE 26 -2.583 -7.756 -9.171
167 HD11 ILE 26 3HD1 ILE 26 -2.583 -9.741 -6.151
168 HD12 ILE 26 1HD1 ILE 26 -0.873 -9.499 -5.789
169 HD13 ILE 26 2HD1 ILE 26 -1.465 -9.294 -7.440
170 HA PRO 27 HA PRO 27 -1.196 -2.523 -6.415
171 HB2 PRO 27 2HB PRO 27 -2.336 -0.886 -4.501
172 HB3 PRO 27 1HB PRO 27 -2.738 -0.874 -6.222
173 HG2 PRO 27 2HG PRO 27 -4.374 -1.700 -4.028
174 HG3 PRO 27 1HG PRO 27 -4.779 -1.614 -5.742
175 HD2 PRO 27 2HD PRO 27 -4.077 -3.967 -4.163
176 HD3 PRO 27 1HD PRO 27 -4.859 -3.850 -5.745
177 H TYR 28 H TYR 28 0.556 -1.895 -5.128
178 HA TYR 28 HA TYR 28 0.698 -3.062 -2.418
179 HB2 TYR 28 2HB TYR 28 2.489 -3.441 -4.754
180 HB3 TYR 28 1HB TYR 28 3.266 -3.235 -3.184
181 HD1 TYR 28 1HD TYR 28 0.372 -5.098 -4.729
182 HD2 TYR 28 2HD TYR 28 3.575 -5.121 -1.858
183 HE1 TYR 28 1HE TYR 28 -0.179 -7.442 -4.125
184 HE2 TYR 28 2HE TYR 28 3.028 -7.461 -1.261
185 HH TYR 28 HH TYR 28 1.860 -9.445 -2.487
186 H CYS 29 H CYS 29 1.794 -1.881 -0.882
187 HA CYS 29 HA CYS 29 1.945 0.931 -1.312
188 HB2 CYS 29 2HB CYS 29 2.423 -0.932 0.952
189 HB3 CYS 29 1HB CYS 29 3.209 0.644 1.030
190 H GLU 30 H GLU 30 3.550 2.056 -2.157
191 HA GLU 30 HA GLU 30 6.315 1.117 -1.754
192 HB2 GLU 30 1HB GLU 30 6.855 1.496 -4.117
193 HB3 GLU 30 2HB GLU 30 5.606 0.261 -3.955
194 HG2 GLU 30 1HG GLU 30 3.890 2.083 -4.295
195 HG3 GLU 30 2HG GLU 30 5.218 3.170 -4.694
196 H LYS 31 H LYS 31 7.873 2.765 -1.808
197 HA LYS 31 HA LYS 31 7.096 5.266 -0.812
198 HB2 LYS 31 1HB LYS 31 9.652 4.520 -2.270
199 HB3 LYS 31 2HB LYS 31 9.413 5.957 -1.283
200 HG2 LYS 31 1HG LYS 31 8.807 3.313 -0.047
201 HG3 LYS 31 2HG LYS 31 10.498 3.764 -0.257
202 HD2 LYS 31 1HD LYS 31 10.140 5.846 0.963
203 HD3 LYS 31 2HD LYS 31 8.421 5.499 1.115
204 HE2 LYS 31 1HE LYS 31 9.580 4.896 3.189
205 HE3 LYS 31 2HE LYS 31 8.971 3.443 2.397
206 HZ1 LYS 31 3HZ LYS 31 11.744 4.483 2.176
207 HZ2 LYS 31 1HZ LYS 31 11.152 3.063 1.461
208 HZ3 LYS 31 2HZ LYS 31 11.261 3.180 3.153
209 H TYR 32 H TYR 32 6.718 7.235 -1.726
210 HA TYR 32 HA TYR 32 5.759 7.341 -4.390
211 HB2 TYR 32 2HB TYR 32 4.912 8.826 -2.633
212 HB3 TYR 32 1HB TYR 32 6.495 9.593 -2.506
213 HD1 TYR 32 1HD TYR 32 3.693 8.916 -4.871
214 HD2 TYR 32 2HD TYR 32 7.124 11.341 -3.976
215 HE1 TYR 32 1HE TYR 32 3.096 10.447 -6.730
216 HE2 TYR 32 2HE TYR 32 6.528 12.872 -5.834
217 HH TYR 32 HH TYR 32 4.401 13.503 -7.084
218 H ARG 33 H ARG 33 6.757 7.770 -6.259
219 HA ARG 33 HA ARG 33 9.504 8.857 -6.181
220 HB2 ARG 33 1HB ARG 33 9.988 7.439 -8.147
221 HB3 ARG 33 2HB ARG 33 9.572 6.480 -6.729
222 HG2 ARG 33 1HG ARG 33 7.238 6.305 -7.561
223 HG3 ARG 33 2HG ARG 33 7.703 7.208 -9.003
224 HD2 ARG 33 1HD ARG 33 9.243 5.480 -9.678
225 HD3 ARG 33 2HD ARG 33 9.029 4.623 -8.155
226 HE ARG 33 HE ARG 33 6.998 3.787 -8.952
227 HH11 ARG 33 1HH1 ARG 33 5.527 3.382 -10.627
228 HH12 ARG 33 2HH1 ARG 33 5.591 4.326 -12.077
229 HH21 ARG 33 2HH2 ARG 33 7.139 5.958 -12.296
230 HH22 ARG 33 1HH2 ARG 33 8.263 6.264 -11.013
Start of MODEL 2
1 HA ASN 1 HA ASN 1 1.402 -0.785 12.732
2 HB2 ASN 1 1HB ASN 1 1.270 -3.122 12.027
3 HB3 ASN 1 2HB ASN 1 0.837 -2.983 13.731
4 HD21 ASN 1 1HD2 ASN 1 -1.742 -5.092 11.996
5 HD22 ASN 1 2HD2 ASN 1 -0.058 -5.208 12.178
6 H CYS 2 H CYS 2 1.820 -0.481 10.594
7 HA CYS 2 HA CYS 2 -0.481 -0.282 8.758
8 HB2 CYS 2 2HB CYS 2 1.168 1.494 7.687
9 HB3 CYS 2 1HB CYS 2 0.022 1.940 8.947
10 H ALA 3 H ALA 3 0.400 -0.155 6.401
11 HA ALA 3 HA ALA 3 1.728 -2.627 5.887
12 HB1 ALA 3 3HB ALA 3 1.812 -1.377 3.492
13 HB2 ALA 3 1HB ALA 3 0.533 -0.446 4.278
14 HB3 ALA 3 2HB ALA 3 0.369 -2.195 4.107
15 H LYS 4 H LYS 4 3.760 -3.029 5.153
16 HA LYS 4 HA LYS 4 5.699 -0.820 5.379
17 HB2 LYS 4 1HB LYS 4 6.120 -3.802 5.589
18 HB3 LYS 4 2HB LYS 4 7.369 -2.568 5.768
19 HG2 LYS 4 1HG LYS 4 6.004 -1.572 7.632
20 HG3 LYS 4 2HG LYS 4 4.933 -2.966 7.519
21 HD2 LYS 4 1HD LYS 4 6.833 -4.475 7.950
22 HD3 LYS 4 2HD LYS 4 7.902 -3.074 8.058
23 HE2 LYS 4 1HE LYS 4 6.592 -2.221 9.972
24 HE3 LYS 4 2HE LYS 4 5.532 -3.628 9.870
25 HZ1 LYS 4 3HZ LYS 4 8.100 -3.390 11.075
26 HZ2 LYS 4 1HZ LYS 4 8.079 -4.647 9.937
27 HZ3 LYS 4 2HZ LYS 4 6.958 -4.640 11.213
28 H GLU 5 H GLU 5 7.020 -0.361 3.682
29 HA GLU 5 HA GLU 5 6.418 -0.531 1.109
30 HB2 GLU 5 1HB GLU 5 8.471 0.552 2.050
31 HB3 GLU 5 2HB GLU 5 9.234 -1.037 2.099
32 HG2 GLU 5 1HG GLU 5 8.906 -1.270 -0.327
33 HG3 GLU 5 2HG GLU 5 8.149 0.316 -0.382
34 H GLY 6 H GLY 6 5.780 -2.112 -0.168
35 HA2 GLY 6 1HA GLY 6 6.302 -4.070 -1.463
36 HA3 GLY 6 2HA GLY 6 7.235 -4.677 -0.100
37 H GLU 7 H GLU 7 4.406 -3.280 1.026
38 HA GLU 7 HA GLU 7 3.162 -5.926 1.343
39 HB2 GLU 7 1HB GLU 7 2.974 -3.350 2.886
40 HB3 GLU 7 2HB GLU 7 1.745 -4.602 3.061
41 HG2 GLU 7 1HG GLU 7 4.712 -5.106 3.406
42 HG3 GLU 7 2HG GLU 7 3.622 -4.749 4.740
43 H VAL 8 H VAL 8 0.910 -6.200 1.025
44 HA VAL 8 HA VAL 8 -0.097 -4.810 -1.274
45 HB VAL 8 HB VAL 8 -0.619 -7.116 -1.163
46 HG11 VAL 8 1HG1 VAL 8 -1.987 -7.970 0.828
47 HG12 VAL 8 2HG1 VAL 8 -1.548 -6.470 1.643
48 HG13 VAL 8 3HG1 VAL 8 -0.292 -7.607 1.152
49 HG21 VAL 8 3HG2 VAL 8 -3.210 -5.987 -0.166
50 HG22 VAL 8 1HG2 VAL 8 -2.910 -7.035 -1.551
51 HG23 VAL 8 2HG2 VAL 8 -2.513 -5.319 -1.642
52 H CYS 9 H CYS 9 -1.724 -3.331 -1.423
53 HA CYS 9 HA CYS 9 -3.174 -2.567 1.017
54 HB2 CYS 9 2HB CYS 9 -2.095 -0.625 1.284
55 HB3 CYS 9 1HB CYS 9 -0.988 -1.093 0.006
56 H GLY 10 H GLY 10 -4.877 -0.858 0.443
57 HA2 GLY 10 1HA GLY 10 -6.430 0.062 -1.077
58 HA3 GLY 10 2HA GLY 10 -5.820 -1.026 -2.323
59 H TRP 11 H TRP 11 -5.952 -3.105 0.018
60 HA TRP 11 HA TRP 11 -8.823 -3.490 0.102
61 HB2 TRP 11 2HB TRP 11 -7.024 -5.690 -0.837
62 HB3 TRP 11 1HB TRP 11 -8.776 -5.666 -0.812
63 HD1 TRP 11 1HD TRP 11 -5.955 -5.028 -3.020
64 HE1 TRP 11 1HE TRP 11 -6.714 -3.803 -5.162
65 HE3 TRP 11 3HE TRP 11 -10.560 -3.568 -1.532
66 HZ2 TRP 11 2HZ TRP 11 -9.020 -2.368 -6.103
67 HZ3 TRP 11 3HZ TRP 11 -12.041 -2.265 -3.047
68 HH2 TRP 11 2HH TRP 11 -11.274 -1.662 -5.327
69 H GLY 12 H GLY 12 -5.773 -3.679 1.458
70 HA2 GLY 12 1HA GLY 12 -6.845 -5.037 3.841
71 HA3 GLY 12 2HA GLY 12 -5.332 -5.610 3.143
72 H SER 13 H SER 13 -4.572 -2.822 2.355
73 HA SER 13 HA SER 13 -4.180 -1.550 4.967
74 HB2 SER 13 1HB SER 13 -2.245 -3.091 4.578
75 HB3 SER 13 2HB SER 13 -1.872 -2.177 3.120
76 HG SER 13 HG SER 13 -1.749 -0.305 4.499
77 H LYS 14 H LYS 14 -3.246 0.639 4.740
78 HA LYS 14 HA LYS 14 -3.775 1.831 2.099
79 HB2 LYS 14 1HB LYS 14 -4.875 3.729 3.213
80 HB3 LYS 14 2HB LYS 14 -5.734 2.220 3.526
81 HG2 LYS 14 1HG LYS 14 -4.563 2.021 5.704
82 HG3 LYS 14 2HG LYS 14 -3.752 3.557 5.398
83 HD2 LYS 14 1HD LYS 14 -5.932 4.697 5.283
84 HD3 LYS 14 2HD LYS 14 -6.751 3.164 5.586
85 HE2 LYS 14 1HE LYS 14 -5.603 2.976 7.761
86 HE3 LYS 14 2HE LYS 14 -4.780 4.506 7.462
87 HZ1 LYS 14 3HZ LYS 14 -6.742 5.692 7.635
88 HZ2 LYS 14 1HZ LYS 14 -6.924 4.515 8.843
89 HZ3 LYS 14 2HZ LYS 14 -7.723 4.333 7.354
90 H CYS 15 H CYS 15 -1.247 1.093 3.282
91 HA CYS 15 HA CYS 15 0.849 1.963 3.649
92 HB2 CYS 15 2HB CYS 15 -0.543 4.147 2.129
93 HB3 CYS 15 1HB CYS 15 1.086 4.378 2.727
94 H CYS 16 H CYS 16 1.910 2.793 5.345
95 HA CYS 16 HA CYS 16 0.559 3.752 7.583
96 HB2 CYS 16 2HB CYS 16 3.031 2.817 7.189
97 HB3 CYS 16 1HB CYS 16 3.390 4.542 7.217
98 H HIS 17 H HIS 17 2.549 5.572 5.264
99 HA HIS 17 HA HIS 17 0.907 7.788 5.078
100 HB2 HIS 17 1HB HIS 17 2.319 7.711 7.610
101 HB3 HIS 17 2HB HIS 17 2.776 9.127 6.667
102 HD1 HIS 17 HD1 HIS 17 0.048 7.762 8.719
103 HD2 HIS 17 HD2 HIS 17 0.461 10.747 5.839
104 HE1 HIS 17 HE1 HIS 17 -2.014 9.221 8.899
105 H GLY 18 H GLY 18 4.105 6.519 5.245
106 HA2 GLY 18 1HA GLY 18 5.162 8.579 3.432
107 HA3 GLY 18 2HA GLY 18 6.105 7.337 4.250
108 H LEU 19 H LEU 19 3.433 5.842 3.071
109 HA LEU 19 HA LEU 19 4.773 5.076 0.552
110 HB2 LEU 19 1HB LEU 19 3.151 3.418 2.483
111 HB3 LEU 19 2HB LEU 19 3.661 2.853 0.897
112 HG LEU 19 HG LEU 19 5.579 3.881 3.004
113 HD11 LEU 19 1HD1 LEU 19 5.130 0.995 2.264
114 HD12 LEU 19 2HD1 LEU 19 4.265 1.748 3.602
115 HD13 LEU 19 3HD1 LEU 19 6.025 1.638 3.636
116 HD21 LEU 19 3HD2 LEU 19 5.824 2.726 0.251
117 HD22 LEU 19 1HD2 LEU 19 7.044 2.282 1.442
118 HD23 LEU 19 2HD2 LEU 19 6.789 3.976 1.034
119 H ASP 20 H ASP 20 3.375 4.441 -1.189
120 HA ASP 20 HA ASP 20 0.569 5.273 -0.972
121 HB2 ASP 20 1HB ASP 20 2.064 7.178 -1.822
122 HB3 ASP 20 2HB ASP 20 2.274 6.196 -3.273
123 H CYS 21 H CYS 21 -0.800 4.132 -2.272
124 HA CYS 21 HA CYS 21 0.343 2.387 -4.302
125 HB2 CYS 21 2HB CYS 21 -1.352 0.613 -3.285
126 HB3 CYS 21 1HB CYS 21 0.307 0.739 -2.735
127 HA PRO 22 HA PRO 22 -3.400 3.551 -6.404
128 HB2 PRO 22 2HB PRO 22 -3.392 1.637 -8.349
129 HB3 PRO 22 1HB PRO 22 -2.283 3.021 -8.349
130 HG2 PRO 22 2HG PRO 22 -1.781 0.206 -7.524
131 HG3 PRO 22 1HG PRO 22 -0.731 1.327 -8.396
132 HD2 PRO 22 2HD PRO 22 -0.470 0.760 -5.737
133 HD3 PRO 22 1HD PRO 22 0.049 2.292 -6.478
134 H LEU 23 H LEU 23 -5.423 2.375 -7.363
135 HA LEU 23 HA LEU 23 -6.405 0.561 -5.267
136 HB2 LEU 23 1HB LEU 23 -7.595 2.677 -6.938
137 HB3 LEU 23 2HB LEU 23 -8.611 1.258 -6.702
138 HG LEU 23 HG LEU 23 -8.488 1.464 -4.305
139 HD11 LEU 23 1HD1 LEU 23 -6.426 2.162 -3.571
140 HD12 LEU 23 2HD1 LEU 23 -7.197 3.748 -3.610
141 HD13 LEU 23 3HD1 LEU 23 -6.187 3.228 -4.957
142 HD21 LEU 23 3HD2 LEU 23 -8.762 4.290 -5.317
143 HD22 LEU 23 1HD2 LEU 23 -9.658 3.509 -4.014
144 HD23 LEU 23 2HD2 LEU 23 -9.960 3.050 -5.691
145 H ALA 24 H ALA 24 -4.730 -0.194 -7.624
146 HA ALA 24 HA ALA 24 -6.211 -1.558 -9.576
147 HB1 ALA 24 3HB ALA 24 -4.117 -3.048 -9.661
148 HB2 ALA 24 1HB ALA 24 -3.468 -1.991 -8.404
149 HB3 ALA 24 2HB ALA 24 -3.898 -1.325 -9.984
150 H PHE 25 H PHE 25 -5.702 -4.124 -9.649
151 HA PHE 25 HA PHE 25 -7.555 -5.288 -7.904
152 HB2 PHE 25 2HB PHE 25 -7.216 -6.389 -9.974
153 HB3 PHE 25 1HB PHE 25 -5.475 -6.475 -9.732
154 HD1 PHE 25 1HD PHE 25 -8.267 -7.317 -7.338
155 HD2 PHE 25 2HD PHE 25 -4.962 -8.763 -9.681
156 HE1 PHE 25 1HE PHE 25 -8.457 -9.524 -6.249
157 HE2 PHE 25 2HE PHE 25 -5.156 -10.965 -8.580
158 HZ PHE 25 HZ PHE 25 -6.901 -11.356 -6.864
159 H ILE 26 H ILE 26 -4.014 -5.442 -7.932
160 HA ILE 26 HA ILE 26 -4.055 -6.122 -5.065
161 HB ILE 26 HB ILE 26 -1.893 -7.503 -5.753
162 HG12 ILE 26 1HG1 ILE 26 -2.394 -8.748 -7.894
163 HG13 ILE 26 2HG1 ILE 26 -3.636 -7.561 -8.241
164 HG21 ILE 26 1HG2 ILE 26 -3.597 -9.476 -6.123
165 HG22 ILE 26 2HG2 ILE 26 -4.794 -8.244 -5.723
166 HG23 ILE 26 3HG2 ILE 26 -3.523 -8.647 -4.569
167 HD11 ILE 26 3HD1 ILE 26 -2.003 -5.769 -8.294
168 HD12 ILE 26 1HD1 ILE 26 -1.459 -7.064 -9.362
169 HD13 ILE 26 2HD1 ILE 26 -0.730 -6.872 -7.770
170 HA PRO 27 HA PRO 27 -1.255 -2.524 -6.108
171 HB2 PRO 27 2HB PRO 27 -2.550 -1.330 -3.750
172 HB3 PRO 27 1HB PRO 27 -2.368 -0.680 -5.390
173 HG2 PRO 27 2HG PRO 27 -4.740 -1.480 -4.449
174 HG3 PRO 27 1HG PRO 27 -4.283 -1.695 -6.147
175 HD2 PRO 27 2HD PRO 27 -4.278 -3.734 -3.952
176 HD3 PRO 27 1HD PRO 27 -4.813 -3.885 -5.626
177 H TYR 28 H TYR 28 0.573 -1.810 -4.954
178 HA TYR 28 HA TYR 28 1.095 -3.170 -2.387
179 HB2 TYR 28 2HB TYR 28 2.684 -3.122 -4.892
180 HB3 TYR 28 1HB TYR 28 3.572 -3.001 -3.373
181 HD1 TYR 28 1HD TYR 28 0.744 -4.956 -4.885
182 HD2 TYR 28 2HD TYR 28 4.165 -4.975 -2.292
183 HE1 TYR 28 1HE TYR 28 0.450 -7.388 -4.511
184 HE2 TYR 28 2HE TYR 28 3.874 -7.403 -1.917
185 HH TYR 28 HH TYR 28 1.268 -9.041 -2.369
186 H CYS 29 H CYS 29 1.746 -1.885 -0.779
187 HA CYS 29 HA CYS 29 1.780 0.917 -1.036
188 HB2 CYS 29 2HB CYS 29 2.310 -1.034 1.108
189 HB3 CYS 29 1HB CYS 29 3.106 0.522 1.285
190 H GLU 30 H GLU 30 3.180 1.701 -2.515
191 HA GLU 30 HA GLU 30 6.061 1.227 -1.962
192 HB2 GLU 30 1HB GLU 30 4.669 1.812 -4.583
193 HB3 GLU 30 2HB GLU 30 6.419 1.787 -4.369
194 HG2 GLU 30 1HG GLU 30 6.334 -0.541 -3.642
195 HG3 GLU 30 2HG GLU 30 4.575 -0.534 -3.746
196 H LYS 31 H LYS 31 7.429 2.991 -1.923
197 HA LYS 31 HA LYS 31 6.618 5.368 -0.853
198 HB2 LYS 31 1HB LYS 31 8.736 6.334 -1.671
199 HB3 LYS 31 2HB LYS 31 8.977 4.708 -1.031
200 HG2 LYS 31 1HG LYS 31 8.892 3.790 -3.320
201 HG3 LYS 31 2HG LYS 31 8.657 5.413 -3.967
202 HD2 LYS 31 1HD LYS 31 10.830 6.105 -3.015
203 HD3 LYS 31 2HD LYS 31 11.070 4.473 -2.393
204 HE2 LYS 31 1HE LYS 31 10.986 3.574 -4.682
205 HE3 LYS 31 2HE LYS 31 10.721 5.197 -5.317
206 HZ1 LYS 31 3HZ LYS 31 13.128 4.151 -3.946
207 HZ2 LYS 31 1HZ LYS 31 12.862 5.810 -4.185
208 HZ3 LYS 31 2HZ LYS 31 13.008 4.773 -5.523
209 H TYR 32 H TYR 32 6.200 7.466 -1.646
210 HA TYR 32 HA TYR 32 4.510 7.590 -3.913
211 HB2 TYR 32 2HB TYR 32 4.315 9.145 -2.015
212 HB3 TYR 32 1HB TYR 32 5.883 9.843 -2.425
213 HD1 TYR 32 1HD TYR 32 2.424 9.294 -3.676
214 HD2 TYR 32 2HD TYR 32 6.102 11.458 -4.166
215 HE1 TYR 32 1HE TYR 32 1.321 10.800 -5.311
216 HE2 TYR 32 2HE TYR 32 4.999 12.963 -5.801
217 HH TYR 32 HH TYR 32 2.981 12.791 -7.385
218 H ARG 33 H ARG 33 4.921 7.982 -6.009
219 HA ARG 33 HA ARG 33 7.698 8.244 -6.853
220 HB2 ARG 33 1HB ARG 33 5.147 7.920 -8.450
221 HB3 ARG 33 2HB ARG 33 6.777 7.903 -9.123
222 HG2 ARG 33 1HG ARG 33 7.344 5.955 -7.728
223 HG3 ARG 33 2HG ARG 33 5.723 5.974 -7.033
224 HD2 ARG 33 1HD ARG 33 5.770 4.320 -8.803
225 HD3 ARG 33 2HD ARG 33 4.790 5.681 -9.340
226 HE ARG 33 HE ARG 33 6.413 6.160 -10.949
227 HH11 ARG 33 1HH1 ARG 33 8.285 5.642 -12.125
228 HH12 ARG 33 2HH1 ARG 33 9.393 4.463 -11.504
229 HH21 ARG 33 2HH2 ARG 33 8.971 3.446 -9.530
230 HH22 ARG 33 1HH2 ARG 33 7.541 3.845 -8.638
Start of MODEL 3
1 HA ASN 1 HA ASN 1 -0.708 -1.961 12.889
2 HB2 ASN 1 1HB ASN 1 0.664 -0.285 14.147
3 HB3 ASN 1 2HB ASN 1 1.055 0.490 12.612
4 HD21 ASN 1 1HD2 ASN 1 -1.990 2.118 14.153
5 HD22 ASN 1 2HD2 ASN 1 -0.432 1.799 14.748
6 H CYS 2 H CYS 2 1.357 0.000 10.732
7 HA CYS 2 HA CYS 2 -0.680 -0.210 8.641
8 HB2 CYS 2 2HB CYS 2 0.982 1.507 7.577
9 HB3 CYS 2 1HB CYS 2 -0.138 2.015 8.840
10 H ALA 3 H ALA 3 0.269 -0.266 6.367
11 HA ALA 3 HA ALA 3 1.663 -2.737 6.053
12 HB1 ALA 3 3HB ALA 3 0.384 -2.490 4.196
13 HB2 ALA 3 1HB ALA 3 1.790 -1.607 3.584
14 HB3 ALA 3 2HB ALA 3 0.427 -0.727 4.282
15 H LYS 4 H LYS 4 3.686 -3.105 5.142
16 HA LYS 4 HA LYS 4 5.582 -0.861 5.432
17 HB2 LYS 4 1HB LYS 4 6.086 -3.837 5.580
18 HB3 LYS 4 2HB LYS 4 7.291 -2.566 5.800
19 HG2 LYS 4 1HG LYS 4 5.821 -1.654 7.661
20 HG3 LYS 4 2HG LYS 4 4.885 -3.141 7.535
21 HD2 LYS 4 1HD LYS 4 6.956 -4.455 7.921
22 HD3 LYS 4 2HD LYS 4 7.839 -2.942 8.128
23 HE2 LYS 4 1HE LYS 4 5.493 -3.850 9.823
24 HE3 LYS 4 2HE LYS 4 7.188 -3.892 10.315
25 HZ1 LYS 4 3HZ LYS 4 5.626 -1.468 9.605
26 HZ2 LYS 4 1HZ LYS 4 7.277 -1.482 9.994
27 HZ3 LYS 4 2HZ LYS 4 6.126 -1.920 11.165
28 H GLU 5 H GLU 5 6.991 -0.425 3.768
29 HA GLU 5 HA GLU 5 6.335 -0.560 1.178
30 HB2 GLU 5 1HB GLU 5 8.368 0.572 2.132
31 HB3 GLU 5 2HB GLU 5 9.170 -0.993 2.160
32 HG2 GLU 5 1HG GLU 5 8.855 -1.213 -0.260
33 HG3 GLU 5 2HG GLU 5 8.028 0.339 -0.305
34 H GLY 6 H GLY 6 5.800 -2.167 -0.143
35 HA2 GLY 6 1HA GLY 6 6.430 -4.110 -1.423
36 HA3 GLY 6 2HA GLY 6 7.326 -4.693 -0.023
37 H GLU 7 H GLU 7 4.445 -3.383 1.020
38 HA GLU 7 HA GLU 7 3.223 -6.056 1.240
39 HB2 GLU 7 1HB GLU 7 2.889 -3.531 2.855
40 HB3 GLU 7 2HB GLU 7 1.814 -4.920 3.022
41 HG2 GLU 7 1HG GLU 7 4.823 -5.133 3.264
42 HG3 GLU 7 2HG GLU 7 3.766 -4.858 4.647
43 H VAL 8 H VAL 8 0.922 -6.272 0.960
44 HA VAL 8 HA VAL 8 -0.022 -4.885 -1.358
45 HB VAL 8 HB VAL 8 -1.818 -6.374 -1.352
46 HG11 VAL 8 1HG1 VAL 8 -0.677 -8.342 -1.426
47 HG12 VAL 8 2HG1 VAL 8 -0.116 -8.193 0.239
48 HG13 VAL 8 3HG1 VAL 8 0.722 -7.338 -1.055
49 HG21 VAL 8 3HG2 VAL 8 -2.289 -7.690 0.855
50 HG22 VAL 8 1HG2 VAL 8 -2.859 -6.025 0.736
51 HG23 VAL 8 2HG2 VAL 8 -1.386 -6.390 1.632
52 H CYS 9 H CYS 9 -1.797 -3.494 -1.550
53 HA CYS 9 HA CYS 9 -3.065 -2.473 0.887
54 HB2 CYS 9 2HB CYS 9 -1.451 -0.858 0.964
55 HB3 CYS 9 1HB CYS 9 -1.110 -0.982 -0.749
56 H GLY 10 H GLY 10 -4.904 -1.060 0.411
57 HA2 GLY 10 1HA GLY 10 -6.489 -0.122 -1.109
58 HA3 GLY 10 2HA GLY 10 -5.906 -1.231 -2.348
59 H TRP 11 H TRP 11 -5.877 -3.299 -0.025
60 HA TRP 11 HA TRP 11 -8.745 -3.755 0.198
61 HB2 TRP 11 2HB TRP 11 -6.883 -5.918 -0.719
62 HB3 TRP 11 1HB TRP 11 -8.636 -5.959 -0.641
63 HD1 TRP 11 1HD TRP 11 -5.918 -5.307 -2.964
64 HE1 TRP 11 1HE TRP 11 -6.783 -4.165 -5.105
65 HE3 TRP 11 3HE TRP 11 -10.504 -3.909 -1.349
66 HZ2 TRP 11 2HZ TRP 11 -9.153 -2.809 -6.003
67 HZ3 TRP 11 3HZ TRP 11 -12.072 -2.679 -2.850
68 HH2 TRP 11 2HH TRP 11 -11.393 -2.129 -5.172
69 H GLY 12 H GLY 12 -5.681 -3.733 1.501
70 HA2 GLY 12 1HA GLY 12 -6.625 -5.128 3.918
71 HA3 GLY 12 2HA GLY 12 -5.062 -5.554 3.232
72 H SER 13 H SER 13 -4.390 -2.818 2.405
73 HA SER 13 HA SER 13 -4.325 -1.345 4.938
74 HB2 SER 13 1HB SER 13 -2.340 -2.824 4.993
75 HB3 SER 13 2HB SER 13 -1.808 -2.133 3.462
76 HG SER 13 HG SER 13 -2.256 -0.738 5.900
77 H LYS 14 H LYS 14 -3.602 0.877 4.645
78 HA LYS 14 HA LYS 14 -3.797 1.789 1.852
79 HB2 LYS 14 1HB LYS 14 -4.723 3.427 4.196
80 HB3 LYS 14 2HB LYS 14 -5.143 3.587 2.493
81 HG2 LYS 14 1HG LYS 14 -7.038 2.485 3.128
82 HG3 LYS 14 2HG LYS 14 -6.011 1.060 2.958
83 HD2 LYS 14 1HD LYS 14 -5.395 1.272 5.370
84 HD3 LYS 14 2HD LYS 14 -6.544 2.603 5.511
85 HE2 LYS 14 1HE LYS 14 -7.698 0.625 6.233
86 HE3 LYS 14 2HE LYS 14 -8.321 1.018 4.630
87 HZ1 LYS 14 3HZ LYS 14 -5.989 -0.700 4.672
88 HZ2 LYS 14 1HZ LYS 14 -7.395 -0.799 3.728
89 HZ3 LYS 14 2HZ LYS 14 -7.400 -1.388 5.322
90 H CYS 15 H CYS 15 -1.352 1.155 3.054
91 HA CYS 15 HA CYS 15 0.741 2.016 3.431
92 HB2 CYS 15 2HB CYS 15 -0.632 4.215 1.931
93 HB3 CYS 15 1HB CYS 15 0.972 4.452 2.567
94 H CYS 16 H CYS 16 1.771 2.775 5.176
95 HA CYS 16 HA CYS 16 0.424 3.746 7.401
96 HB2 CYS 16 2HB CYS 16 2.885 2.805 7.033
97 HB3 CYS 16 1HB CYS 16 3.267 4.527 7.026
98 H HIS 17 H HIS 17 2.638 5.653 5.365
99 HA HIS 17 HA HIS 17 0.884 7.856 5.123
100 HB2 HIS 17 1HB HIS 17 1.538 7.890 7.643
101 HB3 HIS 17 2HB HIS 17 3.104 8.444 7.063
102 HD1 HIS 17 HD1 HIS 17 3.064 10.686 5.577
103 HD2 HIS 17 HD2 HIS 17 -0.436 9.857 7.684
104 HE1 HIS 17 HE1 HIS 17 1.718 12.831 5.604
105 H GLY 18 H GLY 18 4.078 6.585 5.246
106 HA2 GLY 18 1HA GLY 18 5.116 8.643 3.412
107 HA3 GLY 18 2HA GLY 18 6.075 7.420 4.239
108 H LEU 19 H LEU 19 3.393 5.900 3.071
109 HA LEU 19 HA LEU 19 4.775 5.106 0.587
110 HB2 LEU 19 1HB LEU 19 3.042 3.493 2.456
111 HB3 LEU 19 2HB LEU 19 3.615 2.915 0.901
112 HG LEU 19 HG LEU 19 5.438 3.902 3.111
113 HD11 LEU 19 1HD1 LEU 19 5.814 1.651 3.743
114 HD12 LEU 19 2HD1 LEU 19 5.022 1.026 2.298
115 HD13 LEU 19 3HD1 LEU 19 4.061 1.763 3.582
116 HD21 LEU 19 3HD2 LEU 19 6.964 2.318 1.590
117 HD22 LEU 19 1HD2 LEU 19 6.754 4.024 1.211
118 HD23 LEU 19 2HD2 LEU 19 5.816 2.801 0.349
119 H ASP 20 H ASP 20 3.453 4.558 -1.206
120 HA ASP 20 HA ASP 20 0.683 5.565 -1.100
121 HB2 ASP 20 1HB ASP 20 2.330 7.264 -2.067
122 HB3 ASP 20 2HB ASP 20 2.545 6.128 -3.399
123 H CYS 21 H CYS 21 -0.685 4.071 -1.869
124 HA CYS 21 HA CYS 21 0.336 2.182 -3.875
125 HB2 CYS 21 2HB CYS 21 -0.285 0.416 -2.644
126 HB3 CYS 21 1HB CYS 21 -0.432 1.536 -1.293
127 HA PRO 22 HA PRO 22 -3.204 3.747 -6.153
128 HB2 PRO 22 2HB PRO 22 -3.055 2.059 -8.281
129 HB3 PRO 22 1HB PRO 22 -1.914 3.398 -8.042
130 HG2 PRO 22 2HG PRO 22 -1.562 0.497 -7.454
131 HG3 PRO 22 1HG PRO 22 -0.420 1.651 -8.151
132 HD2 PRO 22 2HD PRO 22 -0.350 0.858 -5.557
133 HD3 PRO 22 1HD PRO 22 0.228 2.444 -6.119
134 H LEU 23 H LEU 23 -5.209 2.862 -7.223
135 HA LEU 23 HA LEU 23 -6.313 0.729 -5.527
136 HB2 LEU 23 1HB LEU 23 -7.401 3.123 -6.891
137 HB3 LEU 23 2HB LEU 23 -8.449 1.705 -6.864
138 HG LEU 23 HG LEU 23 -8.397 1.598 -4.469
139 HD11 LEU 23 1HD1 LEU 23 -6.017 3.364 -4.800
140 HD12 LEU 23 2HD1 LEU 23 -6.301 2.073 -3.629
141 HD13 LEU 23 3HD1 LEU 23 -7.031 3.660 -3.394
142 HD21 LEU 23 3HD2 LEU 23 -9.456 3.658 -3.909
143 HD22 LEU 23 1HD2 LEU 23 -9.771 3.416 -5.629
144 HD23 LEU 23 2HD2 LEU 23 -8.516 4.545 -5.111
145 H ALA 24 H ALA 24 -5.819 -1.138 -6.444
146 HA ALA 24 HA ALA 24 -6.929 -1.751 -9.084
147 HB1 ALA 24 3HB ALA 24 -4.910 -2.740 -9.906
148 HB2 ALA 24 1HB ALA 24 -4.100 -2.527 -8.353
149 HB3 ALA 24 2HB ALA 24 -4.490 -1.121 -9.344
150 H PHE 25 H PHE 25 -6.148 -4.285 -9.423
151 HA PHE 25 HA PHE 25 -7.743 -5.725 -7.640
152 HB2 PHE 25 2HB PHE 25 -7.408 -6.623 -9.825
153 HB3 PHE 25 1HB PHE 25 -5.659 -6.628 -9.627
154 HD1 PHE 25 1HD PHE 25 -8.327 -7.799 -7.226
155 HD2 PHE 25 2HD PHE 25 -5.029 -8.883 -9.765
156 HE1 PHE 25 1HE PHE 25 -8.373 -10.076 -6.309
157 HE2 PHE 25 2HE PHE 25 -5.080 -11.168 -8.832
158 HZ PHE 25 HZ PHE 25 -6.754 -11.776 -7.105
159 H ILE 26 H ILE 26 -4.195 -5.598 -7.887
160 HA ILE 26 HA ILE 26 -4.023 -6.368 -5.052
161 HB ILE 26 HB ILE 26 -1.872 -7.676 -5.879
162 HG12 ILE 26 1HG1 ILE 26 -2.458 -8.895 -8.018
163 HG13 ILE 26 2HG1 ILE 26 -3.731 -7.720 -8.276
164 HG21 ILE 26 1HG2 ILE 26 -4.721 -8.693 -6.034
165 HG22 ILE 26 2HG2 ILE 26 -3.689 -8.659 -4.604
166 HG23 ILE 26 3HG2 ILE 26 -3.292 -9.724 -5.952
167 HD11 ILE 26 3HD1 ILE 26 -0.814 -6.995 -7.935
168 HD12 ILE 26 1HD1 ILE 26 -2.130 -5.906 -8.384
169 HD13 ILE 26 2HD1 ILE 26 -1.618 -7.175 -9.495
170 HA PRO 27 HA PRO 27 -1.338 -2.719 -6.177
171 HB2 PRO 27 2HB PRO 27 -2.582 -1.442 -3.862
172 HB3 PRO 27 1HB PRO 27 -2.508 -0.901 -5.547
173 HG2 PRO 27 2HG PRO 27 -4.803 -1.715 -4.414
174 HG3 PRO 27 1HG PRO 27 -4.423 -1.969 -6.120
175 HD2 PRO 27 2HD PRO 27 -4.245 -3.947 -3.881
176 HD3 PRO 27 1HD PRO 27 -4.878 -4.150 -5.520
177 H TYR 28 H TYR 28 0.430 -1.842 -5.003
178 HA TYR 28 HA TYR 28 0.999 -3.137 -2.417
179 HB2 TYR 28 2HB TYR 28 2.611 -3.087 -4.913
180 HB3 TYR 28 1HB TYR 28 3.472 -2.928 -3.382
181 HD1 TYR 28 1HD TYR 28 0.739 -5.002 -4.936
182 HD2 TYR 28 2HD TYR 28 4.086 -4.870 -2.245
183 HE1 TYR 28 1HE TYR 28 0.533 -7.438 -4.560
184 HE2 TYR 28 2HE TYR 28 3.875 -7.309 -1.868
185 HH TYR 28 HH TYR 28 2.607 -9.120 -2.214
186 H CYS 29 H CYS 29 1.972 -1.896 -0.878
187 HA CYS 29 HA CYS 29 1.827 0.954 -1.241
188 HB2 CYS 29 2HB CYS 29 2.237 -0.918 1.016
189 HB3 CYS 29 1HB CYS 29 3.012 0.657 1.176
190 H GLU 30 H GLU 30 3.346 1.855 -2.471
191 HA GLU 30 HA GLU 30 6.172 1.317 -1.762
192 HB2 GLU 30 1HB GLU 30 5.020 1.799 -4.518
193 HB3 GLU 30 2HB GLU 30 6.741 1.697 -4.145
194 HG2 GLU 30 1HG GLU 30 6.422 -0.592 -3.282
195 HG3 GLU 30 2HG GLU 30 4.702 -0.494 -3.658
196 H LYS 31 H LYS 31 7.516 3.094 -1.643
197 HA LYS 31 HA LYS 31 6.358 5.579 -1.029
198 HB2 LYS 31 1HB LYS 31 8.527 4.868 -0.144
199 HB3 LYS 31 2HB LYS 31 9.202 4.870 -1.772
200 HG2 LYS 31 1HG LYS 31 8.877 7.250 -1.972
201 HG3 LYS 31 2HG LYS 31 7.990 7.304 -0.452
202 HD2 LYS 31 1HD LYS 31 10.210 8.086 0.024
203 HD3 LYS 31 2HD LYS 31 10.091 6.459 0.688
204 HE2 LYS 31 1HE LYS 31 11.312 5.528 -1.169
205 HE3 LYS 31 2HE LYS 31 11.233 7.049 -2.056
206 HZ1 LYS 31 3HZ LYS 31 13.355 6.455 -0.747
207 HZ2 LYS 31 1HZ LYS 31 12.471 6.952 0.613
208 HZ3 LYS 31 2HZ LYS 31 12.750 8.041 -0.663
209 H TYR 32 H TYR 32 5.399 6.918 -2.428
210 HA TYR 32 HA TYR 32 4.790 7.864 -4.449
211 HB2 TYR 32 2HB TYR 32 7.738 8.358 -4.133
212 HB3 TYR 32 1HB TYR 32 6.843 9.019 -5.499
213 HD1 TYR 32 1HD TYR 32 6.932 8.884 -1.781
214 HD2 TYR 32 2HD TYR 32 5.443 10.915 -5.254
215 HE1 TYR 32 1HE TYR 32 6.103 10.730 -0.342
216 HE2 TYR 32 2HE TYR 32 4.607 12.758 -3.821
217 HH TYR 32 HH TYR 32 4.039 12.591 -0.755
218 H ARG 33 H ARG 33 5.316 5.004 -4.611
219 HA ARG 33 HA ARG 33 5.862 3.340 -6.123
220 HB2 ARG 33 1HB ARG 33 4.607 5.424 -7.925
221 HB3 ARG 33 2HB ARG 33 4.754 3.704 -8.275
222 HG2 ARG 33 1HG ARG 33 3.354 3.142 -6.369
223 HG3 ARG 33 2HG ARG 33 3.279 4.838 -5.889
224 HD2 ARG 33 1HD ARG 33 1.242 4.313 -7.081
225 HD3 ARG 33 2HD ARG 33 2.225 5.351 -8.109
226 HE ARG 33 HE ARG 33 2.794 2.630 -8.676
227 HH11 ARG 33 1HH1 ARG 33 1.917 1.734 -10.573
228 HH12 ARG 33 2HH1 ARG 33 0.564 2.501 -11.338
229 HH21 ARG 33 2HH2 ARG 33 -0.322 4.381 -10.454
230 HH22 ARG 33 1HH2 ARG 33 0.352 5.058 -9.009
Start of MODEL 4
1 HA ASN 1 HA ASN 1 -0.270 -1.160 12.202
2 HB2 ASN 1 1HB ASN 1 0.810 -3.293 11.251
3 HB3 ASN 1 2HB ASN 1 0.230 -3.367 12.914
4 HD21 ASN 1 1HD2 ASN 1 -1.693 -6.194 12.102
5 HD22 ASN 1 2HD2 ASN 1 -0.610 -5.449 13.177
6 H CYS 2 H CYS 2 0.428 -0.102 10.428
7 HA CYS 2 HA CYS 2 -1.110 -0.140 8.015
8 HB2 CYS 2 2HB CYS 2 0.440 1.538 7.255
9 HB3 CYS 2 1HB CYS 2 -0.048 1.910 8.906
10 H ALA 3 H ALA 3 0.426 -0.027 5.935
11 HA ALA 3 HA ALA 3 1.612 -2.708 5.774
12 HB1 ALA 3 3HB ALA 3 0.389 -2.659 3.879
13 HB2 ALA 3 1HB ALA 3 1.697 -1.664 3.240
14 HB3 ALA 3 2HB ALA 3 0.258 -0.898 3.907
15 H LYS 4 H LYS 4 3.726 -3.085 5.258
16 HA LYS 4 HA LYS 4 5.523 -0.753 5.304
17 HB2 LYS 4 1HB LYS 4 6.099 -3.703 5.668
18 HB3 LYS 4 2HB LYS 4 7.292 -2.404 5.774
19 HG2 LYS 4 1HG LYS 4 5.898 -1.366 7.588
20 HG3 LYS 4 2HG LYS 4 4.872 -2.799 7.552
21 HD2 LYS 4 1HD LYS 4 6.827 -4.214 8.063
22 HD3 LYS 4 2HD LYS 4 7.842 -2.771 8.096
23 HE2 LYS 4 1HE LYS 4 6.509 -1.864 9.962
24 HE3 LYS 4 2HE LYS 4 5.484 -3.297 9.931
25 HZ1 LYS 4 3HZ LYS 4 7.667 -4.565 10.232
26 HZ2 LYS 4 1HZ LYS 4 7.032 -3.751 11.578
27 HZ3 LYS 4 2HZ LYS 4 8.323 -3.072 10.708
28 H GLU 5 H GLU 5 6.892 -0.305 3.619
29 HA GLU 5 HA GLU 5 6.367 -0.585 1.049
30 HB2 GLU 5 1HB GLU 5 8.367 0.598 1.956
31 HB3 GLU 5 2HB GLU 5 9.170 -0.961 2.133
32 HG2 GLU 5 1HG GLU 5 8.965 -1.368 -0.263
33 HG3 GLU 5 2HG GLU 5 8.101 0.151 -0.468
34 H GLY 6 H GLY 6 5.837 -2.230 -0.213
35 HA2 GLY 6 1HA GLY 6 6.434 -4.229 -1.405
36 HA3 GLY 6 2HA GLY 6 7.350 -4.753 0.007
37 H GLU 7 H GLU 7 4.427 -3.390 0.950
38 HA GLU 7 HA GLU 7 3.214 -6.063 1.279
39 HB2 GLU 7 1HB GLU 7 2.991 -3.528 2.887
40 HB3 GLU 7 2HB GLU 7 1.871 -4.875 3.091
41 HG2 GLU 7 1HG GLU 7 4.875 -5.186 3.256
42 HG3 GLU 7 2HG GLU 7 3.862 -4.874 4.663
43 H VAL 8 H VAL 8 0.934 -6.281 1.011
44 HA VAL 8 HA VAL 8 -0.072 -4.942 -1.287
45 HB VAL 8 HB VAL 8 -1.942 -6.343 -1.102
46 HG11 VAL 8 1HG1 VAL 8 -0.195 -8.159 0.439
47 HG12 VAL 8 2HG1 VAL 8 0.576 -7.384 -0.944
48 HG13 VAL 8 3HG1 VAL 8 -0.879 -8.354 -1.175
49 HG21 VAL 8 3HG2 VAL 8 -2.890 -5.971 0.992
50 HG22 VAL 8 1HG2 VAL 8 -1.353 -6.171 1.834
51 HG23 VAL 8 2HG2 VAL 8 -2.216 -7.583 1.226
52 H CYS 9 H CYS 9 -1.874 -3.547 -1.464
53 HA CYS 9 HA CYS 9 -3.059 -2.395 0.927
54 HB2 CYS 9 2HB CYS 9 -1.210 -0.976 0.975
55 HB3 CYS 9 1HB CYS 9 -1.103 -0.922 -0.774
56 H GLY 10 H GLY 10 -4.801 -0.889 0.406
57 HA2 GLY 10 1HA GLY 10 -6.289 0.142 -1.146
58 HA3 GLY 10 2HA GLY 10 -5.736 -0.987 -2.382
59 H TRP 11 H TRP 11 -5.897 -3.097 -0.108
60 HA TRP 11 HA TRP 11 -8.784 -3.346 0.105
61 HB2 TRP 11 2HB TRP 11 -7.130 -5.621 -0.953
62 HB3 TRP 11 1HB TRP 11 -8.880 -5.511 -0.838
63 HD1 TRP 11 1HD TRP 11 -6.144 -4.982 -3.159
64 HE1 TRP 11 1HE TRP 11 -6.913 -3.677 -5.246
65 HE3 TRP 11 3HE TRP 11 -10.595 -3.317 -1.478
66 HZ2 TRP 11 2HZ TRP 11 -9.164 -2.105 -6.081
67 HZ3 TRP 11 3HZ TRP 11 -12.071 -1.905 -2.919
68 HH2 TRP 11 2HH TRP 11 -11.348 -1.297 -5.219
69 H GLY 12 H GLY 12 -5.712 -3.652 1.355
70 HA2 GLY 12 1HA GLY 12 -6.726 -5.128 3.707
71 HA3 GLY 12 2HA GLY 12 -5.178 -5.567 2.993
72 H SER 13 H SER 13 -4.349 -2.855 2.330
73 HA SER 13 HA SER 13 -4.193 -1.586 4.982
74 HB2 SER 13 1HB SER 13 -2.187 -3.103 4.544
75 HB3 SER 13 2HB SER 13 -1.762 -1.991 3.244
76 HG SER 13 HG SER 13 -2.398 -0.720 5.573
77 H LYS 14 H LYS 14 -3.243 0.647 4.804
78 HA LYS 14 HA LYS 14 -3.774 1.852 2.170
79 HB2 LYS 14 1HB LYS 14 -4.707 2.834 4.875
80 HB3 LYS 14 2HB LYS 14 -4.786 3.777 3.388
81 HG2 LYS 14 1HG LYS 14 -6.188 2.038 2.346
82 HG3 LYS 14 2HG LYS 14 -6.112 1.087 3.830
83 HD2 LYS 14 1HD LYS 14 -7.199 2.919 5.070
84 HD3 LYS 14 2HD LYS 14 -7.277 3.877 3.591
85 HE2 LYS 14 1HE LYS 14 -8.684 2.154 2.535
86 HE3 LYS 14 2HE LYS 14 -8.597 1.175 4.001
87 HZ1 LYS 14 3HZ LYS 14 -10.620 2.648 3.715
88 HZ2 LYS 14 1HZ LYS 14 -9.595 3.960 4.037
89 HZ3 LYS 14 2HZ LYS 14 -9.810 2.745 5.204
90 H CYS 15 H CYS 15 -1.234 1.091 3.307
91 HA CYS 15 HA CYS 15 0.863 1.941 3.677
92 HB2 CYS 15 2HB CYS 15 -0.534 4.126 2.178
93 HB3 CYS 15 1HB CYS 15 1.080 4.386 2.802
94 H CYS 16 H CYS 16 2.012 2.892 5.283
95 HA CYS 16 HA CYS 16 0.687 3.776 7.592
96 HB2 CYS 16 2HB CYS 16 3.538 4.461 6.954
97 HB3 CYS 16 1HB CYS 16 2.816 4.121 8.526
98 H HIS 17 H HIS 17 2.698 5.678 5.364
99 HA HIS 17 HA HIS 17 0.948 7.864 5.217
100 HB2 HIS 17 1HB HIS 17 2.320 9.467 6.658
101 HB3 HIS 17 2HB HIS 17 1.289 8.328 7.519
102 HD1 HIS 17 HD1 HIS 17 4.908 8.852 6.544
103 HD2 HIS 17 HD2 HIS 17 2.655 6.507 9.153
104 HE1 HIS 17 HE1 HIS 17 6.563 7.647 8.037
105 H GLY 18 H GLY 18 4.180 6.681 5.224
106 HA2 GLY 18 1HA GLY 18 5.055 8.741 3.293
107 HA3 GLY 18 2HA GLY 18 6.110 7.589 4.104
108 H LEU 19 H LEU 19 3.401 5.982 3.052
109 HA LEU 19 HA LEU 19 4.687 5.183 0.514
110 HB2 LEU 19 1HB LEU 19 3.200 3.505 2.538
111 HB3 LEU 19 2HB LEU 19 3.685 2.934 0.947
112 HG LEU 19 HG LEU 19 5.654 4.098 2.925
113 HD11 LEU 19 1HD1 LEU 19 6.037 1.315 2.688
114 HD12 LEU 19 2HD1 LEU 19 4.314 1.536 2.984
115 HD13 LEU 19 3HD1 LEU 19 5.493 2.196 4.114
116 HD21 LEU 19 3HD2 LEU 19 7.129 2.500 1.429
117 HD22 LEU 19 1HD2 LEU 19 6.702 4.101 0.835
118 HD23 LEU 19 2HD2 LEU 19 5.819 2.683 0.267
119 H ASP 20 H ASP 20 3.281 4.501 -1.171
120 HA ASP 20 HA ASP 20 0.455 5.258 -0.866
121 HB2 ASP 20 1HB ASP 20 2.377 6.308 -2.944
122 HB3 ASP 20 2HB ASP 20 0.627 6.359 -3.154
123 H CYS 21 H CYS 21 -0.949 3.945 -1.935
124 HA CYS 21 HA CYS 21 0.217 2.028 -3.827
125 HB2 CYS 21 2HB CYS 21 -0.800 0.225 -2.833
126 HB3 CYS 21 1HB CYS 21 -0.405 1.198 -1.423
127 HA PRO 22 HA PRO 22 -3.151 3.569 -6.347
128 HB2 PRO 22 2HB PRO 22 -2.909 1.791 -8.402
129 HB3 PRO 22 1HB PRO 22 -1.787 3.147 -8.159
130 HG2 PRO 22 2HG PRO 22 -1.453 0.271 -7.454
131 HG3 PRO 22 1HG PRO 22 -0.278 1.410 -8.112
132 HD2 PRO 22 2HD PRO 22 -0.360 0.682 -5.510
133 HD3 PRO 22 1HD PRO 22 0.250 2.250 -6.074
134 H LEU 23 H LEU 23 -5.144 2.729 -7.445
135 HA LEU 23 HA LEU 23 -6.333 0.650 -5.750
136 HB2 LEU 23 1HB LEU 23 -7.447 2.878 -7.447
137 HB3 LEU 23 2HB LEU 23 -8.478 1.544 -6.929
138 HG LEU 23 HG LEU 23 -8.559 3.498 -5.367
139 HD11 LEU 23 1HD1 LEU 23 -8.445 0.827 -4.732
140 HD12 LEU 23 2HD1 LEU 23 -8.820 2.109 -3.578
141 HD13 LEU 23 3HD1 LEU 23 -7.172 1.490 -3.706
142 HD21 LEU 23 3HD2 LEU 23 -6.023 3.947 -5.830
143 HD22 LEU 23 1HD2 LEU 23 -5.756 2.773 -4.540
144 HD23 LEU 23 2HD2 LEU 23 -6.657 4.253 -4.212
145 H ALA 24 H ALA 24 -5.816 -1.263 -6.622
146 HA ALA 24 HA ALA 24 -6.900 -1.865 -9.277
147 HB1 ALA 24 3HB ALA 24 -4.085 -2.634 -8.464
148 HB2 ALA 24 1HB ALA 24 -4.487 -1.328 -9.582
149 HB3 ALA 24 2HB ALA 24 -4.881 -2.995 -9.999
150 H PHE 25 H PHE 25 -5.630 -4.478 -9.322
151 HA PHE 25 HA PHE 25 -7.567 -5.945 -7.844
152 HB2 PHE 25 2HB PHE 25 -5.052 -7.247 -8.792
153 HB3 PHE 25 1HB PHE 25 -6.721 -7.794 -8.914
154 HD1 PHE 25 1HD PHE 25 -4.024 -6.211 -10.623
155 HD2 PHE 25 2HD PHE 25 -8.310 -6.439 -10.464
156 HE1 PHE 25 1HE PHE 25 -4.154 -5.288 -12.911
157 HE2 PHE 25 2HE PHE 25 -8.442 -5.514 -12.762
158 HZ PHE 25 HZ PHE 25 -6.363 -4.937 -13.988
159 H ILE 26 H ILE 26 -4.009 -5.759 -7.519
160 HA ILE 26 HA ILE 26 -4.312 -6.044 -4.611
161 HB ILE 26 HB ILE 26 -3.904 -8.315 -5.587
162 HG12 ILE 26 1HG1 ILE 26 -1.948 -8.820 -4.072
163 HG13 ILE 26 2HG1 ILE 26 -1.771 -7.082 -3.827
164 HG21 ILE 26 1HG2 ILE 26 -2.142 -6.981 -7.235
165 HG22 ILE 26 2HG2 ILE 26 -2.247 -8.729 -7.037
166 HG23 ILE 26 3HG2 ILE 26 -1.078 -7.805 -6.095
167 HD11 ILE 26 3HD1 ILE 26 -3.678 -6.926 -2.547
168 HD12 ILE 26 1HD1 ILE 26 -3.240 -8.590 -2.177
169 HD13 ILE 26 2HD1 ILE 26 -4.486 -8.253 -3.379
170 HA PRO 27 HA PRO 27 -1.308 -2.782 -6.064
171 HB2 PRO 27 2HB PRO 27 -2.601 -1.271 -3.889
172 HB3 PRO 27 1HB PRO 27 -2.301 -0.820 -5.576
173 HG2 PRO 27 2HG PRO 27 -4.761 -1.383 -4.704
174 HG3 PRO 27 1HG PRO 27 -4.206 -1.792 -6.331
175 HD2 PRO 27 2HD PRO 27 -4.509 -3.581 -3.959
176 HD3 PRO 27 1HD PRO 27 -4.888 -3.896 -5.666
177 H TYR 28 H TYR 28 0.563 -2.048 -4.986
178 HA TYR 28 HA TYR 28 1.022 -3.198 -2.305
179 HB2 TYR 28 2HB TYR 28 2.681 -3.184 -4.767
180 HB3 TYR 28 1HB TYR 28 3.522 -2.969 -3.231
181 HD1 TYR 28 1HD TYR 28 0.660 -5.065 -4.522
182 HD2 TYR 28 2HD TYR 28 4.320 -4.932 -2.267
183 HE1 TYR 28 1HE TYR 28 0.488 -7.497 -4.091
184 HE2 TYR 28 2HE TYR 28 4.131 -7.363 -1.828
185 HH TYR 28 HH TYR 28 1.469 -9.279 -3.209
186 H CYS 29 H CYS 29 1.995 -1.957 -0.759
187 HA CYS 29 HA CYS 29 1.821 0.884 -1.083
188 HB2 CYS 29 2HB CYS 29 2.350 -1.004 1.114
189 HB3 CYS 29 1HB CYS 29 3.175 0.544 1.253
190 H GLU 30 H GLU 30 3.242 1.958 -2.248
191 HA GLU 30 HA GLU 30 6.117 1.437 -1.755
192 HB2 GLU 30 1HB GLU 30 4.840 2.001 -4.440
193 HB3 GLU 30 2HB GLU 30 6.573 1.866 -4.136
194 HG2 GLU 30 1HG GLU 30 4.581 -0.329 -3.521
195 HG3 GLU 30 2HG GLU 30 5.523 -0.250 -5.007
196 H LYS 31 H LYS 31 7.489 3.249 -1.922
197 HA LYS 31 HA LYS 31 6.286 5.716 -1.112
198 HB2 LYS 31 1HB LYS 31 8.665 6.573 -1.329
199 HB3 LYS 31 2HB LYS 31 8.437 5.219 -0.226
200 HG2 LYS 31 1HG LYS 31 9.279 3.647 -1.825
201 HG3 LYS 31 2HG LYS 31 9.239 4.843 -3.119
202 HD2 LYS 31 1HD LYS 31 11.530 4.688 -2.441
203 HD3 LYS 31 2HD LYS 31 10.922 6.191 -1.748
204 HE2 LYS 31 1HE LYS 31 10.647 5.165 0.421
205 HE3 LYS 31 2HE LYS 31 10.996 3.565 -0.234
206 HZ1 LYS 31 3HZ LYS 31 13.027 5.535 -0.765
207 HZ2 LYS 31 1HZ LYS 31 13.178 3.946 -0.190
208 HZ3 LYS 31 2HZ LYS 31 12.804 5.206 0.888
209 H TYR 32 H TYR 32 6.203 7.677 -2.214
210 HA TYR 32 HA TYR 32 6.829 7.652 -5.090
211 HB2 TYR 32 2HB TYR 32 4.161 7.988 -3.834
212 HB3 TYR 32 1HB TYR 32 4.553 9.069 -5.171
213 HD1 TYR 32 1HD TYR 32 4.246 5.509 -4.171
214 HD2 TYR 32 2HD TYR 32 4.723 8.269 -7.422
215 HE1 TYR 32 1HE TYR 32 3.800 3.681 -5.784
216 HE2 TYR 32 2HE TYR 32 4.277 6.442 -9.038
217 HH TYR 32 HH TYR 32 4.241 4.121 -9.223
218 H ARG 33 H ARG 33 4.930 10.091 -3.513
219 HA ARG 33 HA ARG 33 6.823 12.137 -4.204
220 HB2 ARG 33 1HB ARG 33 4.234 12.184 -2.647
221 HB3 ARG 33 2HB ARG 33 5.197 13.627 -2.965
222 HG2 ARG 33 1HG ARG 33 4.989 13.295 -5.368
223 HG3 ARG 33 2HG ARG 33 4.151 11.763 -5.115
224 HD2 ARG 33 1HD ARG 33 3.129 14.421 -4.089
225 HD3 ARG 33 2HD ARG 33 2.627 13.707 -5.619
226 HE ARG 33 HE ARG 33 2.243 11.775 -3.629
227 HH11 ARG 33 1HH1 ARG 33 0.175 11.476 -2.739
228 HH12 ARG 33 2HH1 ARG 33 -0.996 12.748 -2.834
229 HH21 ARG 33 2HH2 ARG 33 -0.465 14.700 -3.843
230 HH22 ARG 33 1HH2 ARG 33 1.113 14.923 -4.522
Start of MODEL 5
1 HA ASN 1 HA ASN 1 -0.402 -1.938 12.377
2 HB2 ASN 1 1HB ASN 1 -0.825 0.544 12.647
3 HB3 ASN 1 2HB ASN 1 -0.435 -0.303 14.144
4 HD21 ASN 1 1HD2 ASN 1 2.100 2.063 14.744
5 HD22 ASN 1 2HD2 ASN 1 0.737 1.241 15.334
6 H CYS 2 H CYS 2 -1.241 -0.610 10.521
7 HA CYS 2 HA CYS 2 -1.114 -0.051 8.298
8 HB2 CYS 2 2HB CYS 2 -0.151 2.002 9.083
9 HB3 CYS 2 1HB CYS 2 1.417 1.241 9.329
10 H ALA 3 H ALA 3 0.229 -0.263 6.298
11 HA ALA 3 HA ALA 3 1.465 -2.897 6.268
12 HB1 ALA 3 3HB ALA 3 0.349 -1.027 4.288
13 HB2 ALA 3 1HB ALA 3 0.355 -2.791 4.291
14 HB3 ALA 3 2HB ALA 3 1.781 -1.899 3.740
15 H LYS 4 H LYS 4 3.445 -3.047 4.748
16 HA LYS 4 HA LYS 4 5.314 -0.839 5.258
17 HB2 LYS 4 1HB LYS 4 7.088 -2.414 5.831
18 HB3 LYS 4 2HB LYS 4 5.733 -2.610 6.942
19 HG2 LYS 4 1HG LYS 4 5.724 -4.795 6.394
20 HG3 LYS 4 2HG LYS 4 5.113 -4.297 4.817
21 HD2 LYS 4 1HD LYS 4 7.039 -5.600 4.333
22 HD3 LYS 4 2HD LYS 4 7.569 -3.926 4.160
23 HE2 LYS 4 1HE LYS 4 9.258 -4.618 5.545
24 HE3 LYS 4 2HE LYS 4 8.062 -4.299 6.801
25 HZ1 LYS 4 3HZ LYS 4 8.215 -6.929 5.467
26 HZ2 LYS 4 1HZ LYS 4 7.520 -6.537 6.964
27 HZ3 LYS 4 2HZ LYS 4 9.211 -6.558 6.795
28 H GLU 5 H GLU 5 6.903 -0.594 3.678
29 HA GLU 5 HA GLU 5 6.273 -0.821 1.090
30 HB2 GLU 5 1HB GLU 5 8.281 0.333 1.984
31 HB3 GLU 5 2HB GLU 5 9.067 -1.235 2.170
32 HG2 GLU 5 1HG GLU 5 8.847 -1.649 -0.232
33 HG3 GLU 5 2HG GLU 5 8.020 -0.109 -0.433
34 H GLY 6 H GLY 6 5.680 -2.446 -0.154
35 HA2 GLY 6 1HA GLY 6 6.313 -4.455 -1.362
36 HA3 GLY 6 2HA GLY 6 7.084 -5.042 0.104
37 H GLU 7 H GLU 7 4.289 -3.641 1.134
38 HA GLU 7 HA GLU 7 2.925 -6.237 1.243
39 HB2 GLU 7 1HB GLU 7 2.875 -3.756 2.875
40 HB3 GLU 7 2HB GLU 7 1.382 -4.685 2.778
41 HG2 GLU 7 1HG GLU 7 4.031 -5.988 3.410
42 HG3 GLU 7 2HG GLU 7 3.002 -5.305 4.667
43 H VAL 8 H VAL 8 0.574 -6.291 0.928
44 HA VAL 8 HA VAL 8 -0.143 -4.801 -1.468
45 HB VAL 8 HB VAL 8 -1.819 -6.381 -1.799
46 HG11 VAL 8 1HG1 VAL 8 -0.225 -8.250 -0.149
47 HG12 VAL 8 2HG1 VAL 8 0.704 -7.275 -1.284
48 HG13 VAL 8 3HG1 VAL 8 -0.598 -8.304 -1.871
49 HG21 VAL 8 3HG2 VAL 8 -1.758 -6.651 1.207
50 HG22 VAL 8 1HG2 VAL 8 -2.498 -7.901 0.208
51 HG23 VAL 8 2HG2 VAL 8 -3.124 -6.254 0.166
52 H CYS 9 H CYS 9 -1.822 -3.323 -1.638
53 HA CYS 9 HA CYS 9 -3.101 -2.515 0.925
54 HB2 CYS 9 2HB CYS 9 -2.930 -0.236 0.243
55 HB3 CYS 9 1HB CYS 9 -1.340 -0.945 -0.028
56 H GLY 10 H GLY 10 -5.138 -1.198 0.503
57 HA2 GLY 10 1HA GLY 10 -7.162 -0.832 -0.568
58 HA3 GLY 10 2HA GLY 10 -6.526 -1.664 -1.986
59 H TRP 11 H TRP 11 -5.748 -3.680 0.368
60 HA TRP 11 HA TRP 11 -8.355 -4.911 0.640
61 HB2 TRP 11 2HB TRP 11 -5.998 -6.442 -0.404
62 HB3 TRP 11 1HB TRP 11 -7.656 -6.999 -0.256
63 HD1 TRP 11 1HD TRP 11 -5.359 -5.499 -2.673
64 HE1 TRP 11 1HE TRP 11 -6.635 -4.613 -4.732
65 HE3 TRP 11 3HE TRP 11 -10.066 -5.594 -0.831
66 HZ2 TRP 11 2HZ TRP 11 -9.339 -4.006 -5.482
67 HZ3 TRP 11 3HZ TRP 11 -11.999 -4.852 -2.214
68 HH2 TRP 11 2HH TRP 11 -11.635 -4.054 -4.536
69 H GLY 12 H GLY 12 -5.591 -3.895 2.016
70 HA2 GLY 12 1HA GLY 12 -6.050 -5.414 4.442
71 HA3 GLY 12 2HA GLY 12 -4.497 -5.728 3.671
72 H SER 13 H SER 13 -4.370 -2.929 2.638
73 HA SER 13 HA SER 13 -4.236 -1.278 5.021
74 HB2 SER 13 1HB SER 13 -2.113 -2.650 5.005
75 HB3 SER 13 2HB SER 13 -1.695 -1.838 3.498
76 HG SER 13 HG SER 13 -2.532 -0.213 5.581
77 H LYS 14 H LYS 14 -3.076 0.891 4.361
78 HA LYS 14 HA LYS 14 -3.600 1.575 1.568
79 HB2 LYS 14 1HB LYS 14 -4.918 2.882 3.950
80 HB3 LYS 14 2HB LYS 14 -4.837 3.625 2.357
81 HG2 LYS 14 1HG LYS 14 -5.991 1.665 1.380
82 HG3 LYS 14 2HG LYS 14 -6.085 0.934 2.982
83 HD2 LYS 14 1HD LYS 14 -7.431 2.836 3.784
84 HD3 LYS 14 2HD LYS 14 -7.337 3.577 2.185
85 HE2 LYS 14 1HE LYS 14 -8.480 1.623 1.204
86 HE3 LYS 14 2HE LYS 14 -8.570 0.872 2.799
87 HZ1 LYS 14 3HZ LYS 14 -9.648 3.578 2.415
88 HZ2 LYS 14 1HZ LYS 14 -10.109 2.385 3.528
89 HZ3 LYS 14 2HZ LYS 14 -10.559 2.241 1.895
90 H CYS 15 H CYS 15 -1.130 1.259 2.862
91 HA CYS 15 HA CYS 15 0.877 2.318 3.207
92 HB2 CYS 15 2HB CYS 15 -0.604 4.274 1.474
93 HB3 CYS 15 1HB CYS 15 0.981 4.646 2.085
94 H CYS 16 H CYS 16 1.512 2.970 5.165
95 HA CYS 16 HA CYS 16 0.070 4.121 7.133
96 HB2 CYS 16 2HB CYS 16 2.917 4.981 6.671
97 HB3 CYS 16 1HB CYS 16 2.086 4.731 8.206
98 H HIS 17 H HIS 17 2.266 6.103 5.153
99 HA HIS 17 HA HIS 17 0.388 8.138 4.584
100 HB2 HIS 17 1HB HIS 17 0.653 8.451 7.095
101 HB3 HIS 17 2HB HIS 17 2.330 8.877 6.778
102 HD1 HIS 17 HD1 HIS 17 -1.071 9.917 5.376
103 HD2 HIS 17 HD2 HIS 17 2.597 11.590 6.433
104 HE1 HIS 17 HE1 HIS 17 -1.276 12.408 4.967
105 H GLY 18 H GLY 18 3.600 7.067 5.088
106 HA2 GLY 18 1HA GLY 18 4.729 9.094 3.276
107 HA3 GLY 18 2HA GLY 18 5.652 7.980 4.279
108 H LEU 19 H LEU 19 3.208 6.240 2.903
109 HA LEU 19 HA LEU 19 4.921 5.369 0.668
110 HB2 LEU 19 1HB LEU 19 3.052 3.831 2.463
111 HB3 LEU 19 2HB LEU 19 3.655 3.172 0.953
112 HG LEU 19 HG LEU 19 5.454 4.250 3.139
113 HD11 LEU 19 1HD1 LEU 19 4.065 2.308 3.914
114 HD12 LEU 19 2HD1 LEU 19 5.791 1.955 3.856
115 HD13 LEU 19 3HD1 LEU 19 4.728 1.360 2.584
116 HD21 LEU 19 3HD2 LEU 19 6.800 4.128 1.253
117 HD22 LEU 19 1HD2 LEU 19 5.851 2.836 0.516
118 HD23 LEU 19 2HD2 LEU 19 6.958 2.473 1.835
119 H ASP 20 H ASP 20 3.898 4.715 -1.255
120 HA ASP 20 HA ASP 20 1.299 6.029 -1.720
121 HB2 ASP 20 1HB ASP 20 3.515 5.364 -3.678
122 HB3 ASP 20 2HB ASP 20 1.995 6.159 -4.084
123 H CYS 21 H CYS 21 -0.393 4.817 -2.346
124 HA CYS 21 HA CYS 21 0.128 2.107 -3.351
125 HB2 CYS 21 2HB CYS 21 -0.543 1.317 -1.352
126 HB3 CYS 21 1HB CYS 21 -1.284 2.856 -0.889
127 HA PRO 22 HA PRO 22 -2.881 3.906 -6.214
128 HB2 PRO 22 2HB PRO 22 -2.620 2.038 -8.175
129 HB3 PRO 22 1HB PRO 22 -1.443 3.342 -7.929
130 HG2 PRO 22 2HG PRO 22 -1.295 0.490 -7.095
131 HG3 PRO 22 1HG PRO 22 -0.032 1.535 -7.741
132 HD2 PRO 22 2HD PRO 22 -0.295 0.933 -5.106
133 HD3 PRO 22 1HD PRO 22 0.455 2.436 -5.697
134 H LEU 23 H LEU 23 -4.971 3.305 -7.019
135 HA LEU 23 HA LEU 23 -6.197 1.206 -5.401
136 HB2 LEU 23 1HB LEU 23 -7.276 3.503 -7.038
137 HB3 LEU 23 2HB LEU 23 -8.333 2.234 -6.425
138 HG LEU 23 HG LEU 23 -8.226 4.204 -4.897
139 HD11 LEU 23 1HD1 LEU 23 -8.370 2.882 -3.041
140 HD12 LEU 23 2HD1 LEU 23 -6.789 2.149 -3.321
141 HD13 LEU 23 3HD1 LEU 23 -8.202 1.567 -4.204
142 HD21 LEU 23 3HD2 LEU 23 -6.221 4.896 -3.874
143 HD22 LEU 23 1HD2 LEU 23 -5.739 4.588 -5.541
144 HD23 LEU 23 2HD2 LEU 23 -5.387 3.399 -4.288
145 H ALA 24 H ALA 24 -5.851 -0.719 -6.331
146 HA ALA 24 HA ALA 24 -7.032 -1.153 -8.976
147 HB1 ALA 24 3HB ALA 24 -4.292 -2.193 -8.216
148 HB2 ALA 24 1HB ALA 24 -4.587 -0.841 -9.311
149 HB3 ALA 24 2HB ALA 24 -5.134 -2.459 -9.746
150 H PHE 25 H PHE 25 -5.760 -3.884 -8.885
151 HA PHE 25 HA PHE 25 -7.753 -5.086 -7.098
152 HB2 PHE 25 2HB PHE 25 -8.042 -6.021 -9.210
153 HB3 PHE 25 1HB PHE 25 -6.317 -6.024 -9.559
154 HD1 PHE 25 1HD PHE 25 -8.245 -7.292 -6.595
155 HD2 PHE 25 2HD PHE 25 -5.667 -8.246 -9.897
156 HE1 PHE 25 1HE PHE 25 -8.078 -9.626 -5.792
157 HE2 PHE 25 2HE PHE 25 -5.495 -10.577 -9.086
158 HZ PHE 25 HZ PHE 25 -6.702 -11.271 -7.034
159 H ILE 26 H ILE 26 -4.318 -5.285 -7.952
160 HA ILE 26 HA ILE 26 -3.796 -6.412 -5.278
161 HB ILE 26 HB ILE 26 -1.811 -7.601 -6.544
162 HG12 ILE 26 1HG1 ILE 26 -2.514 -8.369 -8.800
163 HG13 ILE 26 2HG1 ILE 26 -3.904 -7.296 -8.730
164 HG21 ILE 26 1HG2 ILE 26 -4.693 -8.388 -6.292
165 HG22 ILE 26 2HG2 ILE 26 -3.287 -8.997 -5.419
166 HG23 ILE 26 3HG2 ILE 26 -3.565 -9.485 -7.090
167 HD11 ILE 26 3HD1 ILE 26 -2.488 -5.345 -8.696
168 HD12 ILE 26 1HD1 ILE 26 -1.935 -6.379 -10.011
169 HD13 ILE 26 2HD1 ILE 26 -1.043 -6.338 -8.493
170 HA PRO 27 HA PRO 27 -1.131 -2.700 -6.448
171 HB2 PRO 27 2HB PRO 27 -2.189 -0.878 -4.735
172 HB3 PRO 27 1HB PRO 27 -2.801 -1.127 -6.377
173 HG2 PRO 27 2HG PRO 27 -3.872 -2.110 -3.798
174 HG3 PRO 27 1HG PRO 27 -4.734 -1.494 -5.208
175 HD2 PRO 27 2HD PRO 27 -4.511 -4.164 -4.671
176 HD3 PRO 27 1HD PRO 27 -4.675 -3.493 -6.307
177 H TYR 28 H TYR 28 0.584 -1.908 -5.217
178 HA TYR 28 HA TYR 28 0.909 -3.058 -2.519
179 HB2 TYR 28 2HB TYR 28 2.750 -2.972 -4.869
180 HB3 TYR 28 1HB TYR 28 3.428 -2.954 -3.242
181 HD1 TYR 28 1HD TYR 28 0.795 -4.772 -5.216
182 HD2 TYR 28 2HD TYR 28 3.856 -4.994 -2.222
183 HE1 TYR 28 1HE TYR 28 0.446 -7.216 -5.042
184 HE2 TYR 28 2HE TYR 28 3.514 -7.434 -2.041
185 HH TYR 28 HH TYR 28 2.306 -9.277 -4.107
186 H CYS 29 H CYS 29 2.120 -1.896 -1.005
187 HA CYS 29 HA CYS 29 1.979 0.985 -1.346
188 HB2 CYS 29 2HB CYS 29 2.256 -0.904 0.917
189 HB3 CYS 29 1HB CYS 29 3.090 0.637 1.099
190 H GLU 30 H GLU 30 3.598 2.010 -2.291
191 HA GLU 30 HA GLU 30 6.358 1.232 -1.594
192 HB2 GLU 30 1HB GLU 30 5.324 1.876 -4.365
193 HB3 GLU 30 2HB GLU 30 7.028 1.694 -3.942
194 HG2 GLU 30 1HG GLU 30 6.579 -0.606 -3.158
195 HG3 GLU 30 2HG GLU 30 4.888 -0.428 -3.616
196 H LYS 31 H LYS 31 7.812 2.923 -1.412
197 HA LYS 31 HA LYS 31 6.801 5.447 -0.674
198 HB2 LYS 31 1HB LYS 31 9.163 6.161 -0.658
199 HB3 LYS 31 2HB LYS 31 8.957 4.598 0.132
200 HG2 LYS 31 1HG LYS 31 9.655 3.456 -1.945
201 HG3 LYS 31 2HG LYS 31 9.875 5.019 -2.732
202 HD2 LYS 31 1HD LYS 31 11.611 5.630 -1.140
203 HD3 LYS 31 2HD LYS 31 11.340 4.145 -0.227
204 HE2 LYS 31 1HE LYS 31 13.292 3.899 -1.703
205 HE3 LYS 31 2HE LYS 31 11.995 2.815 -2.209
206 HZ1 LYS 31 3HZ LYS 31 11.527 4.075 -4.044
207 HZ2 LYS 31 1HZ LYS 31 13.205 4.304 -3.941
208 HZ3 LYS 31 2HZ LYS 31 12.149 5.507 -3.374
209 H TYR 32 H TYR 32 7.702 7.522 -1.713
210 HA TYR 32 HA TYR 32 6.590 7.741 -4.325
211 HB2 TYR 32 2HB TYR 32 8.284 9.631 -2.680
212 HB3 TYR 32 1HB TYR 32 7.575 10.060 -4.237
213 HD1 TYR 32 1HD TYR 32 6.901 9.331 -0.702
214 HD2 TYR 32 2HD TYR 32 5.136 10.237 -4.511
215 HE1 TYR 32 1HE TYR 32 4.754 9.862 0.420
216 HE2 TYR 32 2HE TYR 32 2.989 10.767 -3.389
217 HH TYR 32 HH TYR 32 2.648 10.486 0.151
218 H ARG 33 H ARG 33 7.558 7.897 -6.310
219 HA ARG 33 HA ARG 33 10.303 6.891 -6.477
220 HB2 ARG 33 1HB ARG 33 9.741 6.744 -8.945
221 HB3 ARG 33 2HB ARG 33 8.758 5.732 -7.886
222 HG2 ARG 33 1HG ARG 33 6.944 7.335 -7.933
223 HG3 ARG 33 2HG ARG 33 7.934 8.493 -8.821
224 HD2 ARG 33 1HD ARG 33 7.185 5.748 -9.858
225 HD3 ARG 33 2HD ARG 33 6.338 7.231 -10.284
226 HE ARG 33 HE ARG 33 9.059 7.632 -10.818
227 HH11 ARG 33 1HH1 ARG 33 9.841 7.384 -12.935
228 HH12 ARG 33 2HH1 ARG 33 8.947 6.437 -14.077
229 HH21 ARG 33 2HH2 ARG 33 7.008 5.454 -13.460
230 HH22 ARG 33 1HH2 ARG 33 6.416 5.646 -11.843
Start of MODEL 6
1 HA ASN 1 HA ASN 1 1.059 -0.676 12.925
2 HB2 ASN 1 1HB ASN 1 1.830 -3.462 12.004
3 HB3 ASN 1 2HB ASN 1 2.892 -2.059 12.104
4 HD21 ASN 1 1HD2 ASN 1 2.702 -4.351 15.292
5 HD22 ASN 1 2HD2 ASN 1 2.430 -4.843 13.690
6 H CYS 2 H CYS 2 1.812 0.052 10.833
7 HA CYS 2 HA CYS 2 -0.208 -0.187 8.789
8 HB2 CYS 2 2HB CYS 2 1.085 1.504 7.632
9 HB3 CYS 2 1HB CYS 2 0.840 1.976 9.311
10 H ALA 3 H ALA 3 1.133 -0.004 6.450
11 HA ALA 3 HA ALA 3 2.370 -2.674 6.246
12 HB1 ALA 3 3HB ALA 3 0.429 -1.282 4.660
13 HB2 ALA 3 1HB ALA 3 1.052 -2.923 4.451
14 HB3 ALA 3 2HB ALA 3 1.880 -1.563 3.683
15 H LYS 4 H LYS 4 4.481 -2.799 5.879
16 HA LYS 4 HA LYS 4 5.968 -0.393 5.225
17 HB2 LYS 4 1HB LYS 4 7.122 -3.167 5.431
18 HB3 LYS 4 2HB LYS 4 7.904 -1.622 5.755
19 HG2 LYS 4 1HG LYS 4 7.443 -2.094 7.929
20 HG3 LYS 4 2HG LYS 4 5.830 -1.521 7.525
21 HD2 LYS 4 1HD LYS 4 5.357 -3.596 8.476
22 HD3 LYS 4 2HD LYS 4 5.444 -4.008 6.766
23 HE2 LYS 4 1HE LYS 4 7.784 -4.724 7.040
24 HE3 LYS 4 2HE LYS 4 7.733 -4.270 8.743
25 HZ1 LYS 4 3HZ LYS 4 7.179 -6.718 7.837
26 HZ2 LYS 4 1HZ LYS 4 5.621 -6.049 7.867
27 HZ3 LYS 4 2HZ LYS 4 6.556 -6.083 9.285
28 H GLU 5 H GLU 5 7.109 -0.109 3.348
29 HA GLU 5 HA GLU 5 6.048 -0.637 0.964
30 HB2 GLU 5 1HB GLU 5 8.007 0.826 1.359
31 HB3 GLU 5 2HB GLU 5 9.021 -0.606 1.527
32 HG2 GLU 5 1HG GLU 5 8.474 -1.283 -0.758
33 HG3 GLU 5 2HG GLU 5 7.417 0.115 -0.933
34 H GLY 6 H GLY 6 5.692 -2.342 -0.302
35 HA2 GLY 6 1HA GLY 6 6.451 -4.364 -1.400
36 HA3 GLY 6 2HA GLY 6 7.302 -4.791 0.082
37 H GLU 7 H GLU 7 4.545 -3.573 1.240
38 HA GLU 7 HA GLU 7 3.284 -6.221 1.416
39 HB2 GLU 7 1HB GLU 7 2.891 -3.690 3.032
40 HB3 GLU 7 2HB GLU 7 1.954 -5.164 3.264
41 HG2 GLU 7 1HG GLU 7 4.971 -4.970 3.491
42 HG3 GLU 7 2HG GLU 7 3.857 -5.014 4.851
43 H VAL 8 H VAL 8 1.086 -6.540 0.957
44 HA VAL 8 HA VAL 8 0.091 -5.046 -1.255
45 HB VAL 8 HB VAL 8 -1.725 -6.553 -1.284
46 HG11 VAL 8 1HG1 VAL 8 -0.458 -8.364 -1.725
47 HG12 VAL 8 2HG1 VAL 8 0.014 -8.532 -0.035
48 HG13 VAL 8 3HG1 VAL 8 0.910 -7.446 -1.096
49 HG21 VAL 8 3HG2 VAL 8 -1.108 -6.831 1.653
50 HG22 VAL 8 1HG2 VAL 8 -1.996 -8.099 0.808
51 HG23 VAL 8 2HG2 VAL 8 -2.648 -6.461 0.877
52 H CYS 9 H CYS 9 -1.514 -3.513 -1.385
53 HA CYS 9 HA CYS 9 -3.121 -2.865 0.930
54 HB2 CYS 9 2HB CYS 9 -2.318 -0.436 0.842
55 HB3 CYS 9 1HB CYS 9 -1.261 -1.600 1.629
56 H GLY 10 H GLY 10 -4.555 -0.937 0.484
57 HA2 GLY 10 1HA GLY 10 -5.606 0.483 -1.170
58 HA3 GLY 10 2HA GLY 10 -5.181 -0.708 -2.394
59 H TRP 11 H TRP 11 -5.974 -2.793 -0.236
60 HA TRP 11 HA TRP 11 -8.874 -2.473 -0.388
61 HB2 TRP 11 2HB TRP 11 -7.479 -5.027 -1.109
62 HB3 TRP 11 1HB TRP 11 -9.194 -4.670 -1.239
63 HD1 TRP 11 1HD TRP 11 -6.154 -4.661 -3.208
64 HE1 TRP 11 1HE TRP 11 -6.445 -3.304 -5.390
65 HE3 TRP 11 3HE TRP 11 -10.428 -2.231 -2.085
66 HZ2 TRP 11 2HZ TRP 11 -8.302 -1.408 -6.494
67 HZ3 TRP 11 3HZ TRP 11 -11.471 -0.645 -3.693
68 HH2 TRP 11 2HH TRP 11 -10.405 -0.230 -5.895
69 H GLY 12 H GLY 12 -6.100 -3.369 1.296
70 HA2 GLY 12 1HA GLY 12 -7.751 -4.331 3.548
71 HA3 GLY 12 2HA GLY 12 -6.322 -5.239 3.062
72 H SER 13 H SER 13 -4.719 -2.950 2.405
73 HA SER 13 HA SER 13 -4.266 -1.813 5.091
74 HB2 SER 13 1HB SER 13 -2.374 -2.975 3.112
75 HB3 SER 13 2HB SER 13 -1.819 -1.680 4.163
76 HG SER 13 HG SER 13 -3.053 -3.209 5.776
77 H LYS 14 H LYS 14 -3.556 0.314 5.235
78 HA LYS 14 HA LYS 14 -3.996 1.934 2.810
79 HB2 LYS 14 1HB LYS 14 -4.472 2.608 5.716
80 HB3 LYS 14 2HB LYS 14 -4.667 3.739 4.380
81 HG2 LYS 14 1HG LYS 14 -6.304 2.094 3.357
82 HG3 LYS 14 2HG LYS 14 -6.230 1.191 4.868
83 HD2 LYS 14 1HD LYS 14 -6.957 4.127 4.737
84 HD3 LYS 14 2HD LYS 14 -8.157 2.839 4.684
85 HE2 LYS 14 1HE LYS 14 -7.233 1.987 6.867
86 HE3 LYS 14 2HE LYS 14 -6.213 3.422 6.937
87 HZ1 LYS 14 3HZ LYS 14 -8.888 4.141 6.364
88 HZ2 LYS 14 1HZ LYS 14 -7.902 4.625 7.657
89 HZ3 LYS 14 2HZ LYS 14 -8.826 3.204 7.781
90 H CYS 15 H CYS 15 -1.496 0.660 4.050
91 HA CYS 15 HA CYS 15 0.690 1.226 4.409
92 HB2 CYS 15 2HB CYS 15 -0.292 3.514 2.721
93 HB3 CYS 15 1HB CYS 15 1.388 3.319 3.180
94 H CYS 16 H CYS 16 2.174 2.831 5.423
95 HA CYS 16 HA CYS 16 1.131 3.785 7.877
96 HB2 CYS 16 2HB CYS 16 3.758 4.681 6.751
97 HB3 CYS 16 1HB CYS 16 3.328 4.347 8.427
98 H HIS 17 H HIS 17 2.649 5.674 5.257
99 HA HIS 17 HA HIS 17 0.745 7.637 4.961
100 HB2 HIS 17 1HB HIS 17 2.096 7.890 7.531
101 HB3 HIS 17 2HB HIS 17 2.346 9.310 6.524
102 HD1 HIS 17 HD1 HIS 17 -0.228 7.551 8.519
103 HD2 HIS 17 HD2 HIS 17 -0.119 10.622 5.701
104 HE1 HIS 17 HE1 HIS 17 -2.469 8.725 8.651
105 H GLY 18 H GLY 18 4.023 6.684 5.099
106 HA2 GLY 18 1HA GLY 18 4.904 8.871 3.337
107 HA3 GLY 18 2HA GLY 18 5.950 7.683 4.114
108 H LEU 19 H LEU 19 3.338 6.065 3.013
109 HA LEU 19 HA LEU 19 4.510 5.502 0.375
110 HB2 LEU 19 1HB LEU 19 3.460 3.545 2.412
111 HB3 LEU 19 2HB LEU 19 3.837 3.132 0.748
112 HG LEU 19 HG LEU 19 5.921 4.446 2.468
113 HD11 LEU 19 1HD1 LEU 19 6.667 2.177 3.136
114 HD12 LEU 19 2HD1 LEU 19 5.245 1.485 2.356
115 HD13 LEU 19 3HD1 LEU 19 5.056 2.521 3.771
116 HD21 LEU 19 3HD2 LEU 19 6.321 4.135 0.037
117 HD22 LEU 19 1HD2 LEU 19 5.976 2.412 0.208
118 HD23 LEU 19 2HD2 LEU 19 7.392 3.111 0.992
119 H ASP 20 H ASP 20 2.968 4.524 -1.121
120 HA ASP 20 HA ASP 20 0.144 4.790 -0.477
121 HB2 ASP 20 1HB ASP 20 1.142 7.045 -1.369
122 HB3 ASP 20 2HB ASP 20 1.118 6.220 -2.926
123 H CYS 21 H CYS 21 -1.198 3.681 -1.996
124 HA CYS 21 HA CYS 21 0.262 2.075 -3.968
125 HB2 CYS 21 2HB CYS 21 -2.097 0.746 -2.901
126 HB3 CYS 21 1HB CYS 21 -0.468 0.128 -3.144
127 HA PRO 22 HA PRO 22 -2.962 3.548 -6.652
128 HB2 PRO 22 2HB PRO 22 -2.664 1.741 -8.676
129 HB3 PRO 22 1HB PRO 22 -1.511 3.061 -8.393
130 HG2 PRO 22 2HG PRO 22 -1.310 0.189 -7.618
131 HG3 PRO 22 1HG PRO 22 -0.069 1.268 -8.262
132 HD2 PRO 22 2HD PRO 22 -0.262 0.628 -5.633
133 HD3 PRO 22 1HD PRO 22 0.386 2.181 -6.212
134 H LEU 23 H LEU 23 -5.059 2.839 -7.533
135 HA LEU 23 HA LEU 23 -6.157 0.667 -5.916
136 HB2 LEU 23 1HB LEU 23 -7.404 2.828 -7.621
137 HB3 LEU 23 2HB LEU 23 -8.353 1.500 -6.955
138 HG LEU 23 HG LEU 23 -8.408 3.518 -5.491
139 HD11 LEU 23 1HD1 LEU 23 -8.146 0.928 -4.699
140 HD12 LEU 23 2HD1 LEU 23 -8.398 2.265 -3.578
141 HD13 LEU 23 3HD1 LEU 23 -6.768 1.651 -3.867
142 HD21 LEU 23 3HD2 LEU 23 -6.471 4.448 -4.545
143 HD22 LEU 23 1HD2 LEU 23 -5.957 4.082 -6.192
144 HD23 LEU 23 2HD2 LEU 23 -5.507 3.008 -4.868
145 H ALA 24 H ALA 24 -5.657 -1.228 -6.769
146 HA ALA 24 HA ALA 24 -6.635 -1.822 -9.470
147 HB1 ALA 24 3HB ALA 24 -3.878 -2.615 -8.503
148 HB2 ALA 24 1HB ALA 24 -4.206 -1.321 -9.655
149 HB3 ALA 24 2HB ALA 24 -4.593 -2.992 -10.071
150 H PHE 25 H PHE 25 -5.488 -4.431 -9.515
151 HA PHE 25 HA PHE 25 -7.450 -5.863 -8.018
152 HB2 PHE 25 2HB PHE 25 -4.993 -7.151 -9.156
153 HB3 PHE 25 1HB PHE 25 -6.653 -7.738 -9.132
154 HD1 PHE 25 1HD PHE 25 -4.173 -5.888 -10.961
155 HD2 PHE 25 2HD PHE 25 -8.394 -6.573 -10.592
156 HE1 PHE 25 1HE PHE 25 -4.521 -4.923 -13.209
157 HE2 PHE 25 2HE PHE 25 -8.747 -5.607 -12.849
158 HZ PHE 25 HZ PHE 25 -6.809 -4.782 -14.162
159 H ILE 26 H ILE 26 -3.896 -5.726 -7.845
160 HA ILE 26 HA ILE 26 -4.059 -6.177 -4.947
161 HB ILE 26 HB ILE 26 -3.690 -8.388 -6.064
162 HG12 ILE 26 1HG1 ILE 26 -1.430 -8.807 -4.787
163 HG13 ILE 26 2HG1 ILE 26 -1.659 -7.159 -4.219
164 HG21 ILE 26 1HG2 ILE 26 -0.897 -7.819 -6.705
165 HG22 ILE 26 2HG2 ILE 26 -2.032 -6.944 -7.732
166 HG23 ILE 26 3HG2 ILE 26 -2.108 -8.705 -7.634
167 HD11 ILE 26 3HD1 ILE 26 -4.157 -8.188 -3.804
168 HD12 ILE 26 1HD1 ILE 26 -2.888 -8.141 -2.581
169 HD13 ILE 26 2HD1 ILE 26 -3.151 -9.606 -3.523
170 HA PRO 27 HA PRO 27 -1.069 -2.853 -6.222
171 HB2 PRO 27 2HB PRO 27 -2.316 -1.368 -4.029
172 HB3 PRO 27 1HB PRO 27 -2.101 -0.916 -5.727
173 HG2 PRO 27 2HG PRO 27 -4.509 -1.499 -4.672
174 HG3 PRO 27 1HG PRO 27 -4.086 -1.815 -6.360
175 HD2 PRO 27 2HD PRO 27 -4.215 -3.742 -4.066
176 HD3 PRO 27 1HD PRO 27 -4.704 -3.978 -5.760
177 H TYR 28 H TYR 28 0.746 -2.132 -5.051
178 HA TYR 28 HA TYR 28 1.139 -3.405 -2.422
179 HB2 TYR 28 2HB TYR 28 2.848 -3.309 -4.843
180 HB3 TYR 28 1HB TYR 28 3.659 -3.165 -3.284
181 HD1 TYR 28 1HD TYR 28 0.807 -5.205 -4.722
182 HD2 TYR 28 2HD TYR 28 4.421 -5.172 -2.379
183 HE1 TYR 28 1HE TYR 28 0.613 -7.642 -4.378
184 HE2 TYR 28 2HE TYR 28 4.215 -7.616 -2.041
185 HH TYR 28 HH TYR 28 2.662 -9.360 -2.137
186 H CYS 29 H CYS 29 2.260 -2.260 -0.849
187 HA CYS 29 HA CYS 29 1.865 0.550 -0.866
188 HB2 CYS 29 2HB CYS 29 1.937 -1.104 1.136
189 HB3 CYS 29 1HB CYS 29 3.686 -0.925 1.023
190 H GLU 30 H GLU 30 3.037 1.882 -2.124
191 HA GLU 30 HA GLU 30 5.971 1.648 -1.984
192 HB2 GLU 30 1HB GLU 30 6.181 1.939 -4.398
193 HB3 GLU 30 2HB GLU 30 5.247 0.486 -4.041
194 HG2 GLU 30 1HG GLU 30 3.157 1.886 -4.285
195 HG3 GLU 30 2HG GLU 30 4.178 3.189 -4.887
196 H LYS 31 H LYS 31 7.085 3.604 -2.346
197 HA LYS 31 HA LYS 31 5.664 5.955 -1.580
198 HB2 LYS 31 1HB LYS 31 7.982 5.569 -0.887
199 HB3 LYS 31 2HB LYS 31 8.495 5.582 -2.576
200 HG2 LYS 31 1HG LYS 31 7.872 7.874 -2.836
201 HG3 LYS 31 2HG LYS 31 7.049 7.898 -1.281
202 HD2 LYS 31 1HD LYS 31 9.153 8.987 -0.940
203 HD3 LYS 31 2HD LYS 31 9.308 7.387 -0.218
204 HE2 LYS 31 1HE LYS 31 10.527 6.566 -2.141
205 HE3 LYS 31 2HE LYS 31 10.206 8.051 -3.037
206 HZ1 LYS 31 3HZ LYS 31 11.415 9.221 -1.184
207 HZ2 LYS 31 1HZ LYS 31 12.373 8.246 -2.189
208 HZ3 LYS 31 2HZ LYS 31 11.921 7.689 -0.649
209 H TYR 32 H TYR 32 4.799 7.501 -2.817
210 HA TYR 32 HA TYR 32 5.056 7.245 -5.736
211 HB2 TYR 32 2HB TYR 32 2.988 8.304 -3.894
212 HB3 TYR 32 1HB TYR 32 3.189 9.166 -5.420
213 HD1 TYR 32 1HD TYR 32 3.039 5.630 -4.153
214 HD2 TYR 32 2HD TYR 32 1.977 8.402 -7.260
215 HE1 TYR 32 1HE TYR 32 1.794 3.838 -5.329
216 HE2 TYR 32 2HE TYR 32 0.733 6.610 -8.435
217 HH TYR 32 HH TYR 32 -0.436 4.185 -7.374
218 H ARG 33 H ARG 33 6.235 8.630 -6.889
219 HA ARG 33 HA ARG 33 7.307 11.019 -5.538
220 HB2 ARG 33 1HB ARG 33 9.024 10.976 -7.316
221 HB3 ARG 33 2HB ARG 33 8.981 9.465 -6.410
222 HG2 ARG 33 1HG ARG 33 7.521 8.490 -8.185
223 HG3 ARG 33 2HG ARG 33 7.707 9.979 -9.112
224 HD2 ARG 33 1HD ARG 33 9.322 8.361 -9.925
225 HD3 ARG 33 2HD ARG 33 10.186 9.636 -9.069
226 HE ARG 33 HE ARG 33 10.783 8.076 -7.441
227 HH11 ARG 33 1HH1 ARG 33 10.905 5.955 -6.633
228 HH12 ARG 33 2HH1 ARG 33 9.868 4.728 -7.280
229 HH21 ARG 33 2HH2 ARG 33 8.400 5.237 -8.922
230 HH22 ARG 33 1HH2 ARG 33 8.313 6.856 -9.533
Start of MODEL 7
1 HA ASN 1 HA ASN 1 1.090 -2.107 12.284
2 HB2 ASN 1 1HB ASN 1 -0.784 -3.903 12.246
3 HB3 ASN 1 2HB ASN 1 -0.934 -3.497 10.536
4 HD21 ASN 1 1HD2 ASN 1 1.607 -5.888 9.958
5 HD22 ASN 1 2HD2 ASN 1 -0.012 -5.450 9.693
6 H CYS 2 H CYS 2 -1.440 -1.483 9.831
7 HA CYS 2 HA CYS 2 -1.333 -0.496 7.763
8 HB2 CYS 2 2HB CYS 2 -0.907 1.557 8.875
9 HB3 CYS 2 1HB CYS 2 0.734 1.085 9.292
10 H ALA 3 H ALA 3 0.101 -0.084 5.862
11 HA ALA 3 HA ALA 3 1.702 -2.394 5.345
12 HB1 ALA 3 3HB ALA 3 0.812 -1.683 3.367
13 HB2 ALA 3 1HB ALA 3 2.315 -0.767 3.289
14 HB3 ALA 3 2HB ALA 3 0.835 0.013 3.844
15 H LYS 4 H LYS 4 3.937 -2.481 4.859
16 HA LYS 4 HA LYS 4 5.561 -0.221 5.809
17 HB2 LYS 4 1HB LYS 4 7.072 -1.851 6.931
18 HB3 LYS 4 2HB LYS 4 5.488 -1.706 7.685
19 HG2 LYS 4 1HG LYS 4 5.088 -3.890 7.359
20 HG3 LYS 4 2HG LYS 4 5.294 -3.668 5.623
21 HD2 LYS 4 1HD LYS 4 6.913 -5.294 6.229
22 HD3 LYS 4 2HD LYS 4 7.812 -3.790 6.058
23 HE2 LYS 4 1HE LYS 4 7.742 -3.449 8.491
24 HE3 LYS 4 2HE LYS 4 6.775 -4.912 8.678
25 HZ1 LYS 4 3HZ LYS 4 9.509 -4.751 8.693
26 HZ2 LYS 4 1HZ LYS 4 9.141 -5.396 7.169
27 HZ3 LYS 4 2HZ LYS 4 8.581 -6.170 8.575
28 H GLU 5 H GLU 5 5.027 -0.828 3.128
29 HA GLU 5 HA GLU 5 6.251 -0.871 1.183
30 HB2 GLU 5 1HB GLU 5 8.190 -0.308 2.982
31 HB3 GLU 5 2HB GLU 5 8.736 -1.892 2.425
32 HG2 GLU 5 1HG GLU 5 8.287 -0.967 0.050
33 HG3 GLU 5 2HG GLU 5 8.286 0.615 0.822
34 H GLY 6 H GLY 6 5.937 -2.462 -0.238
35 HA2 GLY 6 1HA GLY 6 6.160 -4.575 -1.209
36 HA3 GLY 6 2HA GLY 6 6.954 -5.142 0.257
37 H GLU 7 H GLU 7 4.181 -3.525 1.122
38 HA GLU 7 HA GLU 7 2.765 -6.054 1.557
39 HB2 GLU 7 1HB GLU 7 2.298 -3.298 2.687
40 HB3 GLU 7 2HB GLU 7 1.364 -4.732 3.110
41 HG2 GLU 7 1HG GLU 7 4.366 -4.487 3.446
42 HG3 GLU 7 2HG GLU 7 3.198 -4.219 4.737
43 H VAL 8 H VAL 8 0.422 -6.111 1.230
44 HA VAL 8 HA VAL 8 -0.281 -4.875 -1.321
45 HB VAL 8 HB VAL 8 -0.810 -7.144 -1.344
46 HG11 VAL 8 1HG1 VAL 8 -0.515 -7.908 0.844
47 HG12 VAL 8 2HG1 VAL 8 -2.265 -8.039 0.669
48 HG13 VAL 8 3HG1 VAL 8 -1.565 -6.665 1.524
49 HG21 VAL 8 3HG2 VAL 8 -3.147 -7.198 -1.622
50 HG22 VAL 8 1HG2 VAL 8 -2.767 -5.488 -1.818
51 HG23 VAL 8 2HG2 VAL 8 -3.423 -6.077 -0.291
52 H CYS 9 H CYS 9 -1.550 -3.148 -1.484
53 HA CYS 9 HA CYS 9 -3.105 -2.327 0.893
54 HB2 CYS 9 2HB CYS 9 -2.571 -0.169 0.418
55 HB3 CYS 9 1HB CYS 9 -1.213 -0.920 -0.411
56 H GLY 10 H GLY 10 -5.164 -1.228 0.446
57 HA2 GLY 10 1HA GLY 10 -7.123 -0.849 -0.755
58 HA3 GLY 10 2HA GLY 10 -6.400 -1.652 -2.147
59 H TRP 11 H TRP 11 -5.691 -3.708 0.193
60 HA TRP 11 HA TRP 11 -8.292 -4.957 0.373
61 HB2 TRP 11 2HB TRP 11 -5.940 -6.510 -0.622
62 HB3 TRP 11 1HB TRP 11 -7.616 -7.011 -0.562
63 HD1 TRP 11 1HD TRP 11 -5.159 -5.567 -2.825
64 HE1 TRP 11 1HE TRP 11 -6.289 -4.651 -4.950
65 HE3 TRP 11 3HE TRP 11 -9.959 -5.539 -1.244
66 HZ2 TRP 11 2HZ TRP 11 -8.933 -3.954 -5.842
67 HZ3 TRP 11 3HZ TRP 11 -11.792 -4.735 -2.726
68 HH2 TRP 11 2HH TRP 11 -11.279 -3.941 -5.022
69 H GLY 12 H GLY 12 -5.352 -4.145 1.680
70 HA2 GLY 12 1HA GLY 12 -5.913 -5.625 4.129
71 HA3 GLY 12 2HA GLY 12 -4.383 -5.996 3.342
72 H SER 13 H SER 13 -3.870 -3.337 2.357
73 HA SER 13 HA SER 13 -3.546 -1.813 4.859
74 HB2 SER 13 1HB SER 13 -1.454 -3.093 4.176
75 HB3 SER 13 2HB SER 13 -1.395 -2.044 2.762
76 HG SER 13 HG SER 13 -1.159 -1.391 5.499
77 H LYS 14 H LYS 14 -2.485 0.431 4.163
78 HA LYS 14 HA LYS 14 -3.597 1.454 1.677
79 HB2 LYS 14 1HB LYS 14 -4.936 3.186 2.789
80 HB3 LYS 14 2HB LYS 14 -5.518 1.570 3.192
81 HG2 LYS 14 1HG LYS 14 -4.260 1.647 5.316
82 HG3 LYS 14 2HG LYS 14 -3.689 3.267 4.920
83 HD2 LYS 14 1HD LYS 14 -6.015 4.078 4.854
84 HD3 LYS 14 2HD LYS 14 -6.590 2.460 5.257
85 HE2 LYS 14 1HE LYS 14 -5.345 2.535 7.380
86 HE3 LYS 14 2HE LYS 14 -4.752 4.148 6.980
87 HZ1 LYS 14 3HZ LYS 14 -6.929 5.018 7.066
88 HZ2 LYS 14 1HZ LYS 14 -6.744 4.076 8.463
89 HZ3 LYS 14 2HZ LYS 14 -7.633 3.474 7.147
90 H CYS 15 H CYS 15 -0.939 1.173 2.946
91 HA CYS 15 HA CYS 15 0.989 2.384 3.247
92 HB2 CYS 15 2HB CYS 15 -0.614 4.165 1.429
93 HB3 CYS 15 1HB CYS 15 0.970 4.629 1.993
94 H CYS 16 H CYS 16 1.394 2.986 5.268
95 HA CYS 16 HA CYS 16 -0.162 4.269 7.063
96 HB2 CYS 16 2HB CYS 16 2.781 4.869 6.826
97 HB3 CYS 16 1HB CYS 16 1.799 4.854 8.290
98 H HIS 17 H HIS 17 2.105 5.905 4.861
99 HA HIS 17 HA HIS 17 0.489 8.033 4.179
100 HB2 HIS 17 1HB HIS 17 1.432 8.294 6.904
101 HB3 HIS 17 2HB HIS 17 2.064 9.592 5.899
102 HD1 HIS 17 HD1 HIS 17 -1.321 7.879 5.604
103 HD2 HIS 17 HD2 HIS 17 0.273 11.641 6.433
104 HE1 HIS 17 HE1 HIS 17 -3.285 9.474 5.743
105 H GLY 18 H GLY 18 3.624 6.858 4.951
106 HA2 GLY 18 1HA GLY 18 4.954 8.792 3.185
107 HA3 GLY 18 2HA GLY 18 5.754 7.596 4.199
108 H LEU 19 H LEU 19 3.269 6.033 2.734
109 HA LEU 19 HA LEU 19 4.965 5.114 0.504
110 HB2 LEU 19 1HB LEU 19 2.996 3.619 2.223
111 HB3 LEU 19 2HB LEU 19 3.697 2.954 0.757
112 HG LEU 19 HG LEU 19 5.359 4.011 3.056
113 HD11 LEU 19 1HD1 LEU 19 3.833 1.946 3.534
114 HD12 LEU 19 2HD1 LEU 19 5.544 1.843 3.936
115 HD13 LEU 19 3HD1 LEU 19 4.942 1.091 2.464
116 HD21 LEU 19 3HD2 LEU 19 6.834 3.910 1.277
117 HD22 LEU 19 1HD2 LEU 19 5.915 2.659 0.440
118 HD23 LEU 19 2HD2 LEU 19 6.926 2.236 1.815
119 H ASP 20 H ASP 20 3.873 4.464 -1.416
120 HA ASP 20 HA ASP 20 1.416 6.004 -1.897
121 HB2 ASP 20 1HB ASP 20 3.440 6.481 -3.300
122 HB3 ASP 20 2HB ASP 20 3.330 4.828 -3.909
123 H CYS 21 H CYS 21 -0.404 4.857 -1.889
124 HA CYS 21 HA CYS 21 -0.289 2.098 -2.895
125 HB2 CYS 21 2HB CYS 21 -0.955 1.602 -0.793
126 HB3 CYS 21 1HB CYS 21 -1.606 3.223 -0.515
127 HA PRO 22 HA PRO 22 -3.151 4.146 -5.784
128 HB2 PRO 22 2HB PRO 22 -2.711 2.465 -7.873
129 HB3 PRO 22 1HB PRO 22 -1.602 3.786 -7.454
130 HG2 PRO 22 2HG PRO 22 -1.360 0.876 -6.907
131 HG3 PRO 22 1HG PRO 22 -0.113 2.054 -7.319
132 HD2 PRO 22 2HD PRO 22 -0.617 1.116 -4.787
133 HD3 PRO 22 1HD PRO 22 0.224 2.638 -5.152
134 H LEU 23 H LEU 23 -5.168 3.533 -6.744
135 HA LEU 23 HA LEU 23 -6.401 1.281 -5.360
136 HB2 LEU 23 1HB LEU 23 -7.460 3.640 -6.915
137 HB3 LEU 23 2HB LEU 23 -8.503 2.289 -6.480
138 HG LEU 23 HG LEU 23 -8.593 4.146 -4.812
139 HD11 LEU 23 1HD1 LEU 23 -8.840 2.690 -3.079
140 HD12 LEU 23 2HD1 LEU 23 -7.205 2.050 -3.255
141 HD13 LEU 23 3HD1 LEU 23 -8.501 1.460 -4.298
142 HD21 LEU 23 3HD2 LEU 23 -6.083 4.653 -5.238
143 HD22 LEU 23 1HD2 LEU 23 -5.780 3.389 -4.046
144 HD23 LEU 23 2HD2 LEU 23 -6.699 4.826 -3.595
145 H ALA 24 H ALA 24 -5.925 -0.547 -6.348
146 HA ALA 24 HA ALA 24 -6.923 -0.947 -9.054
147 HB1 ALA 24 3HB ALA 24 -4.544 -0.364 -9.357
148 HB2 ALA 24 1HB ALA 24 -4.873 -2.038 -9.811
149 HB3 ALA 24 2HB ALA 24 -4.094 -1.679 -8.267
150 H PHE 25 H PHE 25 -6.383 -3.408 -9.609
151 HA PHE 25 HA PHE 25 -7.953 -4.987 -7.889
152 HB2 PHE 25 2HB PHE 25 -7.721 -5.563 -10.234
153 HB3 PHE 25 1HB PHE 25 -5.986 -5.811 -10.039
154 HD1 PHE 25 1HD PHE 25 -9.326 -7.074 -8.949
155 HD2 PHE 25 2HD PHE 25 -5.112 -7.857 -9.229
156 HE1 PHE 25 1HE PHE 25 -9.715 -9.421 -8.247
157 HE2 PHE 25 2HE PHE 25 -5.500 -10.200 -8.530
158 HZ PHE 25 HZ PHE 25 -7.801 -10.985 -8.037
159 H ILE 26 H ILE 26 -4.425 -4.960 -8.407
160 HA ILE 26 HA ILE 26 -4.085 -6.018 -5.685
161 HB ILE 26 HB ILE 26 -3.833 -7.881 -7.244
162 HG12 ILE 26 1HG1 ILE 26 -1.094 -7.086 -6.318
163 HG13 ILE 26 2HG1 ILE 26 -2.359 -7.518 -5.164
164 HG21 ILE 26 1HG2 ILE 26 -2.662 -7.735 -9.187
165 HG22 ILE 26 2HG2 ILE 26 -1.333 -6.874 -8.410
166 HG23 ILE 26 3HG2 ILE 26 -2.763 -5.990 -8.942
167 HD11 ILE 26 3HD1 ILE 26 -2.066 -9.369 -7.437
168 HD12 ILE 26 1HD1 ILE 26 -2.276 -9.715 -5.722
169 HD13 ILE 26 2HD1 ILE 26 -0.676 -9.316 -6.351
170 HA PRO 27 HA PRO 27 -1.242 -2.496 -6.421
171 HB2 PRO 27 2HB PRO 27 -2.348 -0.851 -4.504
172 HB3 PRO 27 1HB PRO 27 -2.795 -0.844 -6.216
173 HG2 PRO 27 2HG PRO 27 -4.361 -1.682 -3.964
174 HG3 PRO 27 1HG PRO 27 -4.833 -1.573 -5.657
175 HD2 PRO 27 2HD PRO 27 -4.098 -3.950 -4.128
176 HD3 PRO 27 1HD PRO 27 -4.906 -3.815 -5.697
177 H TYR 28 H TYR 28 0.509 -1.838 -5.131
178 HA TYR 28 HA TYR 28 0.694 -3.079 -2.453
179 HB2 TYR 28 2HB TYR 28 2.506 -3.277 -4.797
180 HB3 TYR 28 1HB TYR 28 3.260 -3.116 -3.212
181 HD1 TYR 28 1HD TYR 28 0.425 -5.017 -4.841
182 HD2 TYR 28 2HD TYR 28 3.663 -5.059 -2.005
183 HE1 TYR 28 1HE TYR 28 -0.023 -7.409 -4.345
184 HE2 TYR 28 2HE TYR 28 3.211 -7.443 -1.522
185 HH TYR 28 HH TYR 28 2.161 -9.355 -2.540
186 H CYS 29 H CYS 29 1.932 -1.974 -0.906
187 HA CYS 29 HA CYS 29 1.952 0.891 -1.244
188 HB2 CYS 29 2HB CYS 29 2.233 -1.038 0.977
189 HB3 CYS 29 1HB CYS 29 3.120 0.470 1.165
190 H GLU 30 H GLU 30 3.564 1.798 -2.343
191 HA GLU 30 HA GLU 30 6.331 0.973 -1.692
192 HB2 GLU 30 1HB GLU 30 5.218 1.661 -4.419
193 HB3 GLU 30 2HB GLU 30 6.931 1.435 -4.060
194 HG2 GLU 30 1HG GLU 30 6.450 -0.860 -3.270
195 HG3 GLU 30 2HG GLU 30 4.750 -0.635 -3.676
196 H LYS 31 H LYS 31 7.825 2.632 -1.499
197 HA LYS 31 HA LYS 31 6.940 5.155 -0.704
198 HB2 LYS 31 1HB LYS 31 9.068 4.409 0.039
199 HB3 LYS 31 2HB LYS 31 9.627 4.135 -1.610
200 HG2 LYS 31 1HG LYS 31 9.804 6.423 -2.066
201 HG3 LYS 31 2HG LYS 31 8.743 6.871 -0.735
202 HD2 LYS 31 1HD LYS 31 11.211 5.399 0.014
203 HD3 LYS 31 2HD LYS 31 11.443 7.042 -0.588
204 HE2 LYS 31 1HE LYS 31 11.143 7.031 1.861
205 HE3 LYS 31 2HE LYS 31 9.823 7.886 1.065
206 HZ1 LYS 31 3HZ LYS 31 8.446 5.958 1.260
207 HZ2 LYS 31 1HZ LYS 31 9.069 6.328 2.793
208 HZ3 LYS 31 2HZ LYS 31 9.725 5.041 1.898
209 H TYR 32 H TYR 32 6.394 6.940 -1.774
210 HA TYR 32 HA TYR 32 6.017 6.971 -4.550
211 HB2 TYR 32 2HB TYR 32 4.759 8.415 -3.018
212 HB3 TYR 32 1HB TYR 32 6.235 9.307 -2.647
213 HD1 TYR 32 1HD TYR 32 3.968 8.335 -5.439
214 HD2 TYR 32 2HD TYR 32 6.965 11.077 -4.043
215 HE1 TYR 32 1HE TYR 32 3.592 9.763 -7.435
216 HE2 TYR 32 2HE TYR 32 6.590 12.505 -6.036
217 HH TYR 32 HH TYR 32 3.912 12.074 -8.129
218 H ARG 33 H ARG 33 8.510 8.499 -2.568
219 HA ARG 33 HA ARG 33 9.939 9.672 -4.710
220 HB2 ARG 33 1HB ARG 33 10.771 8.894 -1.912
221 HB3 ARG 33 2HB ARG 33 11.837 9.736 -3.037
222 HG2 ARG 33 1HG ARG 33 10.213 11.568 -3.236
223 HG3 ARG 33 2HG ARG 33 9.113 10.725 -2.144
224 HD2 ARG 33 1HD ARG 33 10.801 10.829 -0.353
225 HD3 ARG 33 2HD ARG 33 11.909 11.657 -1.443
226 HE ARG 33 HE ARG 33 9.590 12.811 -0.122
227 HH11 ARG 33 1HH1 ARG 33 9.359 15.057 -0.396
228 HH12 ARG 33 2HH1 ARG 33 10.302 15.877 -1.595
229 HH21 ARG 33 2HH2 ARG 33 11.755 14.717 -2.879
230 HH22 ARG 33 1HH2 ARG 33 11.928 13.007 -2.665
Start of MODEL 8
1 HA ASN 1 HA ASN 1 -3.330 -2.845 9.909
2 HB2 ASN 1 1HB ASN 1 -5.847 -2.862 10.034
3 HB3 ASN 1 2HB ASN 1 -5.872 -1.911 8.548
4 HD21 ASN 1 1HD2 ASN 1 -6.112 -5.247 7.179
5 HD22 ASN 1 2HD2 ASN 1 -7.078 -3.993 7.790
6 H CYS 2 H CYS 2 -2.277 -0.165 9.249
7 HA CYS 2 HA CYS 2 -2.404 0.318 6.468
8 HB2 CYS 2 2HB CYS 2 -0.192 1.528 6.967
9 HB3 CYS 2 1HB CYS 2 -1.633 2.106 7.791
10 H ALA 3 H ALA 3 0.026 0.417 5.432
11 HA ALA 3 HA ALA 3 1.121 -2.323 5.590
12 HB1 ALA 3 3HB ALA 3 1.547 -1.719 3.021
13 HB2 ALA 3 1HB ALA 3 0.059 -0.818 3.274
14 HB3 ALA 3 2HB ALA 3 0.092 -2.557 3.566
15 H LYS 4 H LYS 4 3.289 -2.543 4.840
16 HA LYS 4 HA LYS 4 4.857 -0.046 5.007
17 HB2 LYS 4 1HB LYS 4 5.642 -2.844 5.830
18 HB3 LYS 4 2HB LYS 4 6.665 -1.408 5.931
19 HG2 LYS 4 1HG LYS 4 4.836 -0.354 7.342
20 HG3 LYS 4 2HG LYS 4 4.095 -1.952 7.422
21 HD2 LYS 4 1HD LYS 4 6.190 -2.874 8.349
22 HD3 LYS 4 2HD LYS 4 6.899 -1.259 8.307
23 HE2 LYS 4 1HE LYS 4 4.421 -2.036 9.874
24 HE3 LYS 4 2HE LYS 4 6.028 -1.806 10.563
25 HZ1 LYS 4 3HZ LYS 4 4.900 0.213 10.867
26 HZ2 LYS 4 1HZ LYS 4 4.287 0.217 9.287
27 HZ3 LYS 4 2HZ LYS 4 5.943 0.484 9.553
28 H GLU 5 H GLU 5 6.508 0.241 3.540
29 HA GLU 5 HA GLU 5 6.333 -0.346 0.966
30 HB2 GLU 5 1HB GLU 5 8.126 1.038 2.006
31 HB3 GLU 5 2HB GLU 5 8.975 -0.449 2.432
32 HG2 GLU 5 1HG GLU 5 9.082 -1.082 0.071
33 HG3 GLU 5 2HG GLU 5 8.199 0.374 -0.374
34 H GLY 6 H GLY 6 5.867 -2.160 -0.031
35 HA2 GLY 6 1HA GLY 6 6.718 -4.223 -0.983
36 HA3 GLY 6 2HA GLY 6 7.450 -4.582 0.575
37 H GLU 7 H GLU 7 4.549 -3.299 1.375
38 HA GLU 7 HA GLU 7 3.303 -5.960 1.566
39 HB2 GLU 7 1HB GLU 7 3.086 -3.442 3.185
40 HB3 GLU 7 2HB GLU 7 1.809 -4.650 3.241
41 HG2 GLU 7 1HG GLU 7 3.580 -4.947 5.001
42 HG3 GLU 7 2HG GLU 7 3.348 -6.348 3.961
43 H VAL 8 H VAL 8 1.097 -6.241 1.052
44 HA VAL 8 HA VAL 8 0.211 -4.757 -1.228
45 HB VAL 8 HB VAL 8 -0.333 -7.069 -1.154
46 HG11 VAL 8 1HG1 VAL 8 -1.974 -7.802 0.744
47 HG12 VAL 8 2HG1 VAL 8 -1.376 -6.373 1.588
48 HG13 VAL 8 3HG1 VAL 8 -0.259 -7.657 1.128
49 HG21 VAL 8 3HG2 VAL 8 -2.933 -5.725 -0.403
50 HG22 VAL 8 1HG2 VAL 8 -2.659 -6.989 -1.603
51 HG23 VAL 8 2HG2 VAL 8 -2.110 -5.344 -1.915
52 H CYS 9 H CYS 9 -1.545 -3.376 -1.444
53 HA CYS 9 HA CYS 9 -3.076 -2.593 0.915
54 HB2 CYS 9 2HB CYS 9 -1.343 -1.101 1.371
55 HB3 CYS 9 1HB CYS 9 -0.976 -0.877 -0.319
56 H GLY 10 H GLY 10 -4.710 -0.896 0.367
57 HA2 GLY 10 1HA GLY 10 -5.981 0.278 -1.316
58 HA3 GLY 10 2HA GLY 10 -5.424 -0.897 -2.502
59 H TRP 11 H TRP 11 -5.923 -2.973 -0.257
60 HA TRP 11 HA TRP 11 -8.834 -3.007 -0.322
61 HB2 TRP 11 2HB TRP 11 -7.226 -5.399 -1.142
62 HB3 TRP 11 1HB TRP 11 -8.965 -5.188 -1.216
63 HD1 TRP 11 1HD TRP 11 -5.982 -4.884 -3.260
64 HE1 TRP 11 1HE TRP 11 -6.465 -3.578 -5.432
65 HE3 TRP 11 3HE TRP 11 -10.461 -2.889 -2.027
66 HZ2 TRP 11 2HZ TRP 11 -8.535 -1.884 -6.497
67 HZ3 TRP 11 3HZ TRP 11 -11.696 -1.421 -3.619
68 HH2 TRP 11 2HH TRP 11 -10.730 -0.917 -5.850
69 H GLY 12 H GLY 12 -6.086 -3.185 1.391
70 HA2 GLY 12 1HA GLY 12 -7.423 -4.493 3.631
71 HA3 GLY 12 2HA GLY 12 -5.921 -5.231 3.080
72 H SER 13 H SER 13 -4.690 -2.657 2.324
73 HA SER 13 HA SER 13 -4.353 -1.454 4.995
74 HB2 SER 13 1HB SER 13 -2.235 -2.363 3.072
75 HB3 SER 13 2HB SER 13 -1.924 -1.203 4.350
76 HG SER 13 HG SER 13 -1.975 -3.827 4.519
77 H LYS 14 H LYS 14 -3.174 0.684 4.849
78 HA LYS 14 HA LYS 14 -3.792 2.106 2.360
79 HB2 LYS 14 1HB LYS 14 -4.664 2.886 5.144
80 HB3 LYS 14 2HB LYS 14 -4.645 4.001 3.781
81 HG2 LYS 14 1HG LYS 14 -6.138 2.490 2.521
82 HG3 LYS 14 2HG LYS 14 -6.176 1.391 3.900
83 HD2 LYS 14 1HD LYS 14 -7.170 3.138 5.299
84 HD3 LYS 14 2HD LYS 14 -7.084 4.282 3.960
85 HE2 LYS 14 1HE LYS 14 -9.344 3.348 4.108
86 HE3 LYS 14 2HE LYS 14 -8.562 2.798 2.626
87 HZ1 LYS 14 3HZ LYS 14 -9.591 1.253 4.725
88 HZ2 LYS 14 1HZ LYS 14 -7.914 1.004 4.665
89 HZ3 LYS 14 2HZ LYS 14 -8.862 0.724 3.284
90 H CYS 15 H CYS 15 -1.281 1.165 3.364
91 HA CYS 15 HA CYS 15 0.868 1.893 3.697
92 HB2 CYS 15 2HB CYS 15 -0.400 4.413 2.635
93 HB3 CYS 15 1HB CYS 15 1.314 4.235 2.904
94 H CYS 16 H CYS 16 2.038 2.432 5.412
95 HA CYS 16 HA CYS 16 0.753 4.034 7.531
96 HB2 CYS 16 2HB CYS 16 2.044 1.536 7.587
97 HB3 CYS 16 1HB CYS 16 3.151 2.668 8.356
98 H HIS 17 H HIS 17 3.742 3.661 5.667
99 HA HIS 17 HA HIS 17 5.000 5.855 7.103
100 HB2 HIS 17 1HB HIS 17 5.946 4.020 4.930
101 HB3 HIS 17 2HB HIS 17 6.887 5.392 5.494
102 HD1 HIS 17 HD1 HIS 17 7.272 5.383 8.241
103 HD2 HIS 17 HD2 HIS 17 6.304 1.747 6.448
104 HE1 HIS 17 HE1 HIS 17 7.946 3.574 9.881
105 H GLY 18 H GLY 18 2.665 6.033 5.214
106 HA2 GLY 18 1HA GLY 18 1.854 7.941 4.103
107 HA3 GLY 18 2HA GLY 18 3.514 8.513 3.931
108 H LEU 19 H LEU 19 3.631 5.371 3.189
109 HA LEU 19 HA LEU 19 4.227 5.639 0.496
110 HB2 LEU 19 1HB LEU 19 3.016 3.235 1.886
111 HB3 LEU 19 2HB LEU 19 3.859 3.199 0.354
112 HG LEU 19 HG LEU 19 5.204 4.335 2.782
113 HD11 LEU 19 1HD1 LEU 19 6.071 2.100 3.298
114 HD12 LEU 19 2HD1 LEU 19 5.145 1.412 1.966
115 HD13 LEU 19 3HD1 LEU 19 4.310 2.066 3.377
116 HD21 LEU 19 3HD2 LEU 19 7.113 4.106 1.533
117 HD22 LEU 19 1HD2 LEU 19 5.969 4.203 0.196
118 HD23 LEU 19 2HD2 LEU 19 6.539 2.633 0.749
119 H ASP 20 H ASP 20 3.011 4.897 -1.381
120 HA ASP 20 HA ASP 20 0.110 5.439 -1.162
121 HB2 ASP 20 1HB ASP 20 2.077 6.162 -3.341
122 HB3 ASP 20 2HB ASP 20 0.327 6.246 -3.550
123 H CYS 21 H CYS 21 -1.285 4.036 -2.139
124 HA CYS 21 HA CYS 21 -0.147 1.910 -3.829
125 HB2 CYS 21 2HB CYS 21 -2.061 0.512 -2.528
126 HB3 CYS 21 1HB CYS 21 -0.372 0.551 -2.027
127 HA PRO 22 HA PRO 22 -3.735 3.335 -6.178
128 HB2 PRO 22 2HB PRO 22 -3.277 1.876 -8.427
129 HB3 PRO 22 1HB PRO 22 -2.344 3.332 -8.026
130 HG2 PRO 22 2HG PRO 22 -1.606 0.468 -7.682
131 HG3 PRO 22 1HG PRO 22 -0.612 1.831 -8.204
132 HD2 PRO 22 2HD PRO 22 -0.560 0.780 -5.698
133 HD3 PRO 22 1HD PRO 22 -0.136 2.466 -6.075
134 H LEU 23 H LEU 23 -5.586 2.288 -7.337
135 HA LEU 23 HA LEU 23 -6.447 -0.062 -5.823
136 HB2 LEU 23 1HB LEU 23 -7.773 2.141 -7.315
137 HB3 LEU 23 2HB LEU 23 -8.597 0.582 -7.296
138 HG LEU 23 HG LEU 23 -8.659 0.550 -4.889
139 HD11 LEU 23 1HD1 LEU 23 -6.675 1.399 -4.025
140 HD12 LEU 23 2HD1 LEU 23 -7.722 2.800 -3.793
141 HD13 LEU 23 3HD1 LEU 23 -6.633 2.737 -5.176
142 HD21 LEU 23 3HD2 LEU 23 -10.060 2.448 -4.466
143 HD22 LEU 23 1HD2 LEU 23 -10.264 2.051 -6.173
144 HD23 LEU 23 2HD2 LEU 23 -9.235 3.404 -5.699
145 H ALA 24 H ALA 24 -5.610 -1.836 -6.709
146 HA ALA 24 HA ALA 24 -6.383 -2.499 -9.462
147 HB1 ALA 24 3HB ALA 24 -4.274 -2.723 -10.264
148 HB2 ALA 24 1HB ALA 24 -3.674 -3.399 -8.748
149 HB3 ALA 24 2HB ALA 24 -3.825 -1.651 -8.935
150 H PHE 25 H PHE 25 -5.144 -4.937 -9.690
151 HA PHE 25 HA PHE 25 -6.806 -6.573 -8.139
152 HB2 PHE 25 2HB PHE 25 -6.072 -7.418 -10.234
153 HB3 PHE 25 1HB PHE 25 -4.378 -7.194 -9.824
154 HD1 PHE 25 1HD PHE 25 -6.974 -8.639 -7.528
155 HD2 PHE 25 2HD PHE 25 -3.617 -9.438 -10.097
156 HE1 PHE 25 1HE PHE 25 -6.844 -10.924 -6.646
157 HE2 PHE 25 2HE PHE 25 -3.498 -11.736 -9.199
158 HZ PHE 25 HZ PHE 25 -5.116 -12.486 -7.472
159 H ILE 26 H ILE 26 -3.283 -5.997 -7.832
160 HA ILE 26 HA ILE 26 -3.508 -6.560 -4.967
161 HB ILE 26 HB ILE 26 -1.554 -8.010 -4.925
162 HG12 ILE 26 1HG1 ILE 26 -0.231 -7.372 -6.853
163 HG13 ILE 26 2HG1 ILE 26 -0.738 -9.025 -7.096
164 HG21 ILE 26 1HG2 ILE 26 -3.869 -8.896 -5.230
165 HG22 ILE 26 2HG2 ILE 26 -2.606 -9.971 -5.829
166 HG23 ILE 26 3HG2 ILE 26 -3.546 -9.002 -6.959
167 HD11 ILE 26 3HD1 ILE 26 -2.727 -8.021 -8.394
168 HD12 ILE 26 1HD1 ILE 26 -1.149 -8.024 -9.168
169 HD13 ILE 26 2HD1 ILE 26 -1.766 -6.546 -8.445
170 HA PRO 27 HA PRO 27 -0.894 -2.848 -6.170
171 HB2 PRO 27 2HB PRO 27 -2.497 -1.493 -4.099
172 HB3 PRO 27 1HB PRO 27 -2.151 -1.010 -5.767
173 HG2 PRO 27 2HG PRO 27 -4.573 -1.872 -5.035
174 HG3 PRO 27 1HG PRO 27 -3.876 -2.217 -6.629
175 HD2 PRO 27 2HD PRO 27 -4.074 -4.009 -4.233
176 HD3 PRO 27 1HD PRO 27 -4.374 -4.387 -5.943
177 H TYR 28 H TYR 28 0.717 -1.799 -4.943
178 HA TYR 28 HA TYR 28 1.160 -2.907 -2.243
179 HB2 TYR 28 2HB TYR 28 3.038 -2.662 -4.563
180 HB3 TYR 28 1HB TYR 28 3.663 -2.592 -2.914
181 HD1 TYR 28 1HD TYR 28 1.331 -4.626 -5.031
182 HD2 TYR 28 2HD TYR 28 4.161 -4.590 -1.806
183 HE1 TYR 28 1HE TYR 28 1.178 -7.093 -4.868
184 HE2 TYR 28 2HE TYR 28 4.014 -7.054 -1.639
185 HH TYR 28 HH TYR 28 2.790 -8.872 -2.277
186 H CYS 29 H CYS 29 2.196 -1.601 -0.750
187 HA CYS 29 HA CYS 29 1.645 1.213 -1.054
188 HB2 CYS 29 2HB CYS 29 2.327 -0.657 1.114
189 HB3 CYS 29 1HB CYS 29 2.943 0.975 1.327
190 H GLU 30 H GLU 30 3.090 1.887 -2.667
191 HA GLU 30 HA GLU 30 5.960 1.753 -1.970
192 HB2 GLU 30 1HB GLU 30 4.583 2.213 -4.622
193 HB3 GLU 30 2HB GLU 30 6.326 2.317 -4.376
194 HG2 GLU 30 1HG GLU 30 6.379 -0.016 -3.611
195 HG3 GLU 30 2HG GLU 30 4.630 -0.129 -3.800
196 H LYS 31 H LYS 31 7.231 3.628 -2.101
197 HA LYS 31 HA LYS 31 5.823 6.044 -1.376
198 HB2 LYS 31 1HB LYS 31 8.075 6.967 -1.032
199 HB3 LYS 31 2HB LYS 31 7.911 5.403 -0.241
200 HG2 LYS 31 1HG LYS 31 8.977 4.325 -2.223
201 HG3 LYS 31 2HG LYS 31 9.226 5.925 -2.919
202 HD2 LYS 31 1HD LYS 31 10.578 6.579 -0.971
203 HD3 LYS 31 2HD LYS 31 10.335 4.981 -0.264
204 HE2 LYS 31 1HE LYS 31 11.433 3.950 -2.224
205 HE3 LYS 31 2HE LYS 31 11.691 5.551 -2.916
206 HZ1 LYS 31 3HZ LYS 31 13.649 4.737 -1.736
207 HZ2 LYS 31 1HZ LYS 31 12.751 4.621 -0.303
208 HZ3 LYS 31 2HZ LYS 31 13.028 6.142 -1.009
209 H TYR 32 H TYR 32 5.535 7.846 -2.581
210 HA TYR 32 HA TYR 32 6.809 8.004 -5.231
211 HB2 TYR 32 2HB TYR 32 3.882 7.929 -4.643
212 HB3 TYR 32 1HB TYR 32 4.449 8.982 -5.938
213 HD1 TYR 32 1HD TYR 32 3.690 5.582 -4.991
214 HD2 TYR 32 2HD TYR 32 5.956 7.981 -7.742
215 HE1 TYR 32 1HE TYR 32 3.910 3.633 -6.514
216 HE2 TYR 32 2HE TYR 32 6.174 6.036 -9.261
217 HH TYR 32 HH TYR 32 5.039 2.829 -8.320
218 H ARG 33 H ARG 33 7.515 9.981 -5.754
219 HA ARG 33 HA ARG 33 8.289 12.107 -5.239
220 HB2 ARG 33 1HB ARG 33 5.376 12.798 -5.051
221 HB3 ARG 33 2HB ARG 33 6.686 13.683 -5.837
222 HG2 ARG 33 1HG ARG 33 6.891 11.666 -7.412
223 HG3 ARG 33 2HG ARG 33 5.329 11.152 -6.769
224 HD2 ARG 33 1HD ARG 33 4.330 13.296 -7.443
225 HD3 ARG 33 2HD ARG 33 5.890 13.835 -8.058
226 HE ARG 33 HE ARG 33 5.609 12.430 -9.911
227 HH11 ARG 33 1HH1 ARG 33 4.294 11.164 -11.256
228 HH12 ARG 33 2HH1 ARG 33 2.810 10.516 -10.649
229 HH21 ARG 33 2HH2 ARG 33 2.182 10.932 -8.517
230 HH22 ARG 33 1HH2 ARG 33 3.189 11.900 -7.492
Start of MODEL 9
1 HA ASN 1 HA ASN 1 1.934 -1.327 12.472
2 HB2 ASN 1 1HB ASN 1 1.152 -3.246 13.803
3 HB3 ASN 1 2HB ASN 1 -0.332 -3.307 12.854
4 HD21 ASN 1 1HD2 ASN 1 1.865 -5.782 11.253
5 HD22 ASN 1 2HD2 ASN 1 0.964 -5.634 12.685
6 H CYS 2 H CYS 2 1.799 -0.061 10.670
7 HA CYS 2 HA CYS 2 -0.537 -0.331 8.910
8 HB2 CYS 2 2HB CYS 2 0.919 1.543 7.707
9 HB3 CYS 2 1HB CYS 2 -0.175 1.922 9.034
10 H ALA 3 H ALA 3 0.360 0.096 6.479
11 HA ALA 3 HA ALA 3 1.550 -2.369 5.723
12 HB1 ALA 3 3HB ALA 3 0.476 -1.721 3.860
13 HB2 ALA 3 1HB ALA 3 1.866 -0.676 3.552
14 HB3 ALA 3 2HB ALA 3 0.441 -0.036 4.379
15 H LYS 4 H LYS 4 3.571 -2.844 5.008
16 HA LYS 4 HA LYS 4 5.646 -0.796 5.455
17 HB2 LYS 4 1HB LYS 4 5.848 -3.802 5.689
18 HB3 LYS 4 2HB LYS 4 7.170 -2.655 5.926
19 HG2 LYS 4 1HG LYS 4 5.740 -1.537 7.694
20 HG3 LYS 4 2HG LYS 4 4.642 -2.907 7.567
21 HD2 LYS 4 1HD LYS 4 6.472 -4.449 8.122
22 HD3 LYS 4 2HD LYS 4 7.583 -3.083 8.235
23 HE2 LYS 4 1HE LYS 4 6.224 -2.130 10.066
24 HE3 LYS 4 2HE LYS 4 5.125 -3.505 9.961
25 HZ1 LYS 4 3HZ LYS 4 7.995 -3.547 10.708
26 HZ2 LYS 4 1HZ LYS 4 7.090 -4.946 10.390
27 HZ3 LYS 4 2HZ LYS 4 6.667 -3.939 11.692
28 H GLU 5 H GLU 5 7.108 -0.445 3.848
29 HA GLU 5 HA GLU 5 6.596 -0.605 1.240
30 HB2 GLU 5 1HB GLU 5 8.616 0.450 2.254
31 HB3 GLU 5 2HB GLU 5 9.338 -1.151 2.405
32 HG2 GLU 5 1HG GLU 5 9.190 -1.466 -0.014
33 HG3 GLU 5 2HG GLU 5 8.424 0.109 -0.189
34 H GLY 6 H GLY 6 5.858 -2.238 0.069
35 HA2 GLY 6 1HA GLY 6 6.418 -4.216 -1.217
36 HA3 GLY 6 2HA GLY 6 7.272 -4.833 0.191
37 H GLU 7 H GLU 7 4.452 -3.318 1.172
38 HA GLU 7 HA GLU 7 3.112 -5.914 1.512
39 HB2 GLU 7 1HB GLU 7 2.895 -3.261 2.924
40 HB3 GLU 7 2HB GLU 7 1.635 -4.482 3.086
41 HG2 GLU 7 1HG GLU 7 4.570 -4.989 3.653
42 HG3 GLU 7 2HG GLU 7 3.380 -4.596 4.887
43 H VAL 8 H VAL 8 0.675 -5.839 1.422
44 HA VAL 8 HA VAL 8 -0.103 -4.581 -1.105
45 HB VAL 8 HB VAL 8 -0.619 -6.891 -1.037
46 HG11 VAL 8 1HG1 VAL 8 -2.282 -7.531 0.973
47 HG12 VAL 8 2HG1 VAL 8 -1.386 -6.241 1.773
48 HG13 VAL 8 3HG1 VAL 8 -0.531 -7.646 1.140
49 HG21 VAL 8 3HG2 VAL 8 -3.262 -5.764 -0.170
50 HG22 VAL 8 1HG2 VAL 8 -2.894 -6.818 -1.535
51 HG23 VAL 8 2HG2 VAL 8 -2.491 -5.103 -1.611
52 H CYS 9 H CYS 9 -1.765 -3.155 -1.350
53 HA CYS 9 HA CYS 9 -3.266 -2.325 1.052
54 HB2 CYS 9 2HB CYS 9 -1.879 -0.535 1.165
55 HB3 CYS 9 1HB CYS 9 -1.352 -0.716 -0.501
56 H GLY 10 H GLY 10 -5.173 -0.995 0.518
57 HA2 GLY 10 1HA GLY 10 -6.848 -0.233 -0.958
58 HA3 GLY 10 2HA GLY 10 -6.133 -1.216 -2.237
59 H TRP 11 H TRP 11 -5.898 -3.348 0.003
60 HA TRP 11 HA TRP 11 -8.682 -4.137 0.196
61 HB2 TRP 11 2HB TRP 11 -6.618 -6.000 -0.937
62 HB3 TRP 11 1HB TRP 11 -8.350 -6.251 -0.821
63 HD1 TRP 11 1HD TRP 11 -5.800 -5.073 -3.154
64 HE1 TRP 11 1HE TRP 11 -6.876 -3.879 -5.169
65 HE3 TRP 11 3HE TRP 11 -10.463 -4.415 -1.320
66 HZ2 TRP 11 2HZ TRP 11 -9.428 -2.775 -5.893
67 HZ3 TRP 11 3HZ TRP 11 -12.228 -3.286 -2.672
68 HH2 TRP 11 2HH TRP 11 -11.706 -2.462 -4.956
69 H GLY 12 H GLY 12 -5.679 -3.788 1.511
70 HA2 GLY 12 1HA GLY 12 -6.402 -5.397 3.848
71 HA3 GLY 12 2HA GLY 12 -4.872 -5.773 3.063
72 H SER 13 H SER 13 -4.366 -2.956 2.312
73 HA SER 13 HA SER 13 -4.061 -1.675 4.937
74 HB2 SER 13 1HB SER 13 -2.001 -3.063 4.361
75 HB3 SER 13 2HB SER 13 -1.728 -1.928 3.041
76 HG SER 13 HG SER 13 -2.285 -0.618 5.331
77 H LYS 14 H LYS 14 -2.895 0.563 4.515
78 HA LYS 14 HA LYS 14 -3.797 1.723 1.989
79 HB2 LYS 14 1HB LYS 14 -4.793 2.453 4.718
80 HB3 LYS 14 2HB LYS 14 -4.713 3.665 3.444
81 HG2 LYS 14 1HG LYS 14 -6.077 2.248 1.972
82 HG3 LYS 14 2HG LYS 14 -6.126 0.992 3.207
83 HD2 LYS 14 1HD LYS 14 -8.167 2.091 3.539
84 HD3 LYS 14 2HD LYS 14 -7.126 2.881 4.721
85 HE2 LYS 14 1HE LYS 14 -8.425 4.548 3.463
86 HE3 LYS 14 2HE LYS 14 -6.711 4.722 3.111
87 HZ1 LYS 14 3HZ LYS 14 -7.097 4.313 0.983
88 HZ2 LYS 14 1HZ LYS 14 -8.763 4.307 1.306
89 HZ3 LYS 14 2HZ LYS 14 -7.885 2.852 1.346
90 H CYS 15 H CYS 15 -1.153 1.126 3.039
91 HA CYS 15 HA CYS 15 0.908 2.112 3.284
92 HB2 CYS 15 2HB CYS 15 -0.654 4.171 1.758
93 HB3 CYS 15 1HB CYS 15 0.975 4.507 2.281
94 H CYS 16 H CYS 16 1.620 2.560 5.253
95 HA CYS 16 HA CYS 16 0.362 3.723 7.344
96 HB2 CYS 16 2HB CYS 16 2.809 2.761 7.060
97 HB3 CYS 16 1HB CYS 16 3.221 4.472 6.961
98 H HIS 17 H HIS 17 2.362 5.524 5.016
99 HA HIS 17 HA HIS 17 0.737 7.722 4.730
100 HB2 HIS 17 1HB HIS 17 2.096 7.714 7.335
101 HB3 HIS 17 2HB HIS 17 2.354 9.185 6.400
102 HD1 HIS 17 HD1 HIS 17 -0.097 10.006 5.201
103 HD2 HIS 17 HD2 HIS 17 -0.222 7.937 8.817
104 HE1 HIS 17 HE1 HIS 17 -2.350 10.515 6.239
105 H GLY 18 H GLY 18 3.911 6.482 5.119
106 HA2 GLY 18 1HA GLY 18 5.094 8.564 3.407
107 HA3 GLY 18 2HA GLY 18 5.979 7.308 4.268
108 H LEU 19 H LEU 19 3.336 5.896 2.871
109 HA LEU 19 HA LEU 19 4.855 5.143 0.458
110 HB2 LEU 19 1HB LEU 19 3.005 3.438 2.118
111 HB3 LEU 19 2HB LEU 19 3.839 2.936 0.657
112 HG LEU 19 HG LEU 19 5.223 3.884 3.189
113 HD11 LEU 19 1HD1 LEU 19 5.585 1.641 3.759
114 HD12 LEU 19 2HD1 LEU 19 5.237 1.077 2.124
115 HD13 LEU 19 3HD1 LEU 19 3.920 1.612 3.175
116 HD21 LEU 19 3HD2 LEU 19 6.768 4.226 1.471
117 HD22 LEU 19 1HD2 LEU 19 6.147 2.883 0.505
118 HD23 LEU 19 2HD2 LEU 19 7.120 2.565 1.940
119 H ASP 20 H ASP 20 3.511 4.382 -1.334
120 HA ASP 20 HA ASP 20 0.795 5.522 -1.352
121 HB2 ASP 20 1HB ASP 20 2.569 6.954 -2.566
122 HB3 ASP 20 2HB ASP 20 2.610 5.647 -3.755
123 H CYS 21 H CYS 21 -0.697 4.183 -2.135
124 HA CYS 21 HA CYS 21 0.147 1.894 -3.773
125 HB2 CYS 21 2HB CYS 21 -1.494 0.502 -2.524
126 HB3 CYS 21 1HB CYS 21 -0.126 1.018 -1.550
127 HA PRO 22 HA PRO 22 -3.203 3.958 -6.134
128 HB2 PRO 22 2HB PRO 22 -2.512 1.797 -8.049
129 HB3 PRO 22 1HB PRO 22 -2.583 3.549 -8.309
130 HG2 PRO 22 2HG PRO 22 -0.265 2.233 -8.165
131 HG3 PRO 22 1HG PRO 22 -0.443 3.880 -7.559
132 HD2 PRO 22 2HD PRO 22 -0.223 1.324 -6.047
133 HD3 PRO 22 1HD PRO 22 0.339 2.958 -5.649
134 H LEU 23 H LEU 23 -5.267 3.256 -6.979
135 HA LEU 23 HA LEU 23 -6.314 0.971 -5.513
136 HB2 LEU 23 1HB LEU 23 -7.419 3.382 -6.830
137 HB3 LEU 23 2HB LEU 23 -8.442 1.946 -6.864
138 HG LEU 23 HG LEU 23 -8.441 1.776 -4.474
139 HD11 LEU 23 1HD1 LEU 23 -7.118 3.811 -3.302
140 HD12 LEU 23 2HD1 LEU 23 -6.077 3.587 -4.701
141 HD13 LEU 23 3HD1 LEU 23 -6.357 2.246 -3.586
142 HD21 LEU 23 3HD2 LEU 23 -8.598 4.724 -5.144
143 HD22 LEU 23 1HD2 LEU 23 -9.451 3.886 -3.846
144 HD23 LEU 23 2HD2 LEU 23 -9.867 3.558 -5.530
145 H ALA 24 H ALA 24 -5.804 -0.889 -6.460
146 HA ALA 24 HA ALA 24 -6.836 -1.388 -9.159
147 HB1 ALA 24 3HB ALA 24 -4.074 -1.080 -8.584
148 HB2 ALA 24 1HB ALA 24 -4.808 -1.627 -10.091
149 HB3 ALA 24 2HB ALA 24 -4.355 -2.800 -8.854
150 H PHE 25 H PHE 25 -5.947 -3.958 -9.482
151 HA PHE 25 HA PHE 25 -7.729 -5.477 -7.915
152 HB2 PHE 25 2HB PHE 25 -5.337 -6.752 -9.168
153 HB3 PHE 25 1HB PHE 25 -7.018 -7.267 -9.174
154 HD1 PHE 25 1HD PHE 25 -4.462 -5.671 -11.042
155 HD2 PHE 25 2HD PHE 25 -8.715 -5.709 -10.441
156 HE1 PHE 25 1HE PHE 25 -4.778 -4.582 -13.235
157 HE2 PHE 25 2HE PHE 25 -9.033 -4.616 -12.646
158 HZ PHE 25 HZ PHE 25 -7.064 -4.052 -14.045
159 H ILE 26 H ILE 26 -4.156 -5.384 -7.870
160 HA ILE 26 HA ILE 26 -4.225 -5.954 -4.990
161 HB ILE 26 HB ILE 26 -3.916 -8.115 -6.214
162 HG12 ILE 26 1HG1 ILE 26 -1.579 -8.556 -5.032
163 HG13 ILE 26 2HG1 ILE 26 -1.892 -6.967 -4.340
164 HG21 ILE 26 1HG2 ILE 26 -2.376 -8.384 -7.837
165 HG22 ILE 26 2HG2 ILE 26 -1.134 -7.547 -6.907
166 HG23 ILE 26 3HG2 ILE 26 -2.289 -6.623 -7.868
167 HD11 ILE 26 3HD1 ILE 26 -3.787 -9.319 -4.213
168 HD12 ILE 26 1HD1 ILE 26 -4.062 -7.729 -3.503
169 HD13 ILE 26 2HD1 ILE 26 -2.763 -8.752 -2.895
170 HA PRO 27 HA PRO 27 -1.257 -2.574 -6.227
171 HB2 PRO 27 2HB PRO 27 -2.472 -1.217 -3.920
172 HB3 PRO 27 1HB PRO 27 -2.240 -0.654 -5.585
173 HG2 PRO 27 2HG PRO 27 -4.667 -1.268 -4.641
174 HG3 PRO 27 1HG PRO 27 -4.196 -1.587 -6.313
175 HD2 PRO 27 2HD PRO 27 -4.342 -3.512 -4.033
176 HD3 PRO 27 1HD PRO 27 -4.870 -3.719 -5.713
177 H TYR 28 H TYR 28 0.478 -1.631 -4.937
178 HA TYR 28 HA TYR 28 0.954 -2.956 -2.356
179 HB2 TYR 28 2HB TYR 28 2.554 -3.198 -4.840
180 HB3 TYR 28 1HB TYR 28 3.452 -2.998 -3.335
181 HD1 TYR 28 1HD TYR 28 0.666 -5.042 -4.862
182 HD2 TYR 28 2HD TYR 28 3.803 -4.826 -1.917
183 HE1 TYR 28 1HE TYR 28 0.329 -7.431 -4.302
184 HE2 TYR 28 2HE TYR 28 3.436 -7.210 -1.358
185 HH TYR 28 HH TYR 28 2.255 -9.326 -3.016
186 H CYS 29 H CYS 29 2.007 -1.747 -0.865
187 HA CYS 29 HA CYS 29 2.158 1.084 -1.293
188 HB2 CYS 29 2HB CYS 29 2.542 -0.807 0.993
189 HB3 CYS 29 1HB CYS 29 3.190 0.816 1.124
190 H GLU 30 H GLU 30 3.730 1.472 -2.835
191 HA GLU 30 HA GLU 30 6.373 0.336 -2.498
192 HB2 GLU 30 1HB GLU 30 5.354 0.583 -4.720
193 HB3 GLU 30 2HB GLU 30 5.302 2.333 -4.500
194 HG2 GLU 30 1HG GLU 30 7.723 2.405 -4.294
195 HG3 GLU 30 2HG GLU 30 7.807 0.655 -4.416
196 H LYS 31 H LYS 31 5.200 3.670 -2.875
197 HA LYS 31 HA LYS 31 6.798 4.690 -0.729
198 HB2 LYS 31 1HB LYS 31 8.330 6.038 -2.039
199 HB3 LYS 31 2HB LYS 31 8.545 4.335 -2.440
200 HG2 LYS 31 1HG LYS 31 7.069 4.647 -4.424
201 HG3 LYS 31 2HG LYS 31 6.953 6.364 -4.042
202 HD2 LYS 31 1HD LYS 31 9.445 6.522 -4.201
203 HD3 LYS 31 2HD LYS 31 9.478 4.841 -4.735
204 HE2 LYS 31 1HE LYS 31 7.989 7.089 -6.124
205 HE3 LYS 31 2HE LYS 31 9.518 6.392 -6.661
206 HZ1 LYS 31 3HZ LYS 31 6.849 5.141 -6.580
207 HZ2 LYS 31 1HZ LYS 31 8.252 4.189 -6.595
208 HZ3 LYS 31 2HZ LYS 31 7.934 5.251 -7.881
209 H TYR 32 H TYR 32 6.583 7.030 -0.497
210 HA TYR 32 HA TYR 32 3.944 7.895 -0.875
211 HB2 TYR 32 2HB TYR 32 5.373 8.817 0.872
212 HB3 TYR 32 1HB TYR 32 6.436 9.519 -0.347
213 HD1 TYR 32 1HD TYR 32 2.862 9.484 0.754
214 HD2 TYR 32 2HD TYR 32 6.019 11.685 -1.154
215 HE1 TYR 32 1HE TYR 32 1.404 11.489 0.654
216 HE2 TYR 32 2HE TYR 32 4.560 13.689 -1.258
217 HH TYR 32 HH TYR 32 1.734 13.991 0.521
218 H ARG 33 H ARG 33 6.895 8.769 -2.613
219 HA ARG 33 HA ARG 33 5.659 10.548 -4.441
220 HB2 ARG 33 1HB ARG 33 8.222 8.954 -4.626
221 HB3 ARG 33 2HB ARG 33 7.731 10.161 -5.814
222 HG2 ARG 33 1HG ARG 33 7.691 11.895 -4.093
223 HG3 ARG 33 2HG ARG 33 8.069 10.703 -2.850
224 HD2 ARG 33 1HD ARG 33 10.107 11.891 -3.492
225 HD3 ARG 33 2HD ARG 33 10.211 10.209 -4.005
226 HE ARG 33 HE ARG 33 9.136 11.831 -6.089
227 HH11 ARG 33 1HH1 ARG 33 10.489 12.284 -7.855
228 HH12 ARG 33 2HH1 ARG 33 12.203 12.085 -7.700
229 HH21 ARG 33 2HH2 ARG 33 13.085 11.377 -5.743
230 HH22 ARG 33 1HH2 ARG 33 12.047 11.033 -4.400
Start of MODEL 10
1 HA ASN 1 HA ASN 1 -0.421 -0.402 12.368
2 HB2 ASN 1 1HB ASN 1 -1.597 -3.096 11.655
3 HB3 ASN 1 2HB ASN 1 0.105 -2.661 11.809
4 HD21 ASN 1 1HD2 ASN 1 -0.167 -2.501 15.474
5 HD22 ASN 1 2HD2 ASN 1 0.441 -1.536 14.216
6 H CYS 2 H CYS 2 0.360 -0.224 10.246
7 HA CYS 2 HA CYS 2 -1.729 0.063 8.189
8 HB2 CYS 2 2HB CYS 2 -0.053 1.564 7.094
9 HB3 CYS 2 1HB CYS 2 -0.645 2.150 8.645
10 H ALA 3 H ALA 3 1.204 0.333 6.761
11 HA ALA 3 HA ALA 3 1.670 -2.519 6.316
12 HB1 ALA 3 3HB ALA 3 0.321 -0.758 4.393
13 HB2 ALA 3 1HB ALA 3 0.398 -2.521 4.445
14 HB3 ALA 3 2HB ALA 3 1.727 -1.598 3.733
15 H LYS 4 H LYS 4 3.648 -2.957 5.271
16 HA LYS 4 HA LYS 4 5.536 -0.687 5.292
17 HB2 LYS 4 1HB LYS 4 6.073 -3.625 5.754
18 HB3 LYS 4 2HB LYS 4 7.280 -2.335 5.764
19 HG2 LYS 4 1HG LYS 4 5.877 -1.207 7.565
20 HG3 LYS 4 2HG LYS 4 4.968 -2.715 7.672
21 HD2 LYS 4 1HD LYS 4 7.039 -3.947 8.157
22 HD3 LYS 4 2HD LYS 4 7.958 -2.446 8.034
23 HE2 LYS 4 1HE LYS 4 7.555 -2.850 10.379
24 HE3 LYS 4 2HE LYS 4 6.522 -1.510 9.887
25 HZ1 LYS 4 3HZ LYS 4 5.371 -3.208 11.235
26 HZ2 LYS 4 1HZ LYS 4 5.643 -4.343 10.005
27 HZ3 LYS 4 2HZ LYS 4 4.667 -2.983 9.704
28 H GLU 5 H GLU 5 6.892 -0.429 3.551
29 HA GLU 5 HA GLU 5 6.153 -0.792 1.028
30 HB2 GLU 5 1HB GLU 5 8.225 0.379 1.760
31 HB3 GLU 5 2HB GLU 5 9.011 -1.190 1.948
32 HG2 GLU 5 1HG GLU 5 8.610 -1.677 -0.429
33 HG3 GLU 5 2HG GLU 5 7.822 -0.115 -0.620
34 H GLY 6 H GLY 6 5.508 -2.470 -0.131
35 HA2 GLY 6 1HA GLY 6 6.111 -4.538 -1.273
36 HA3 GLY 6 2HA GLY 6 6.882 -5.072 0.215
37 H GLU 7 H GLU 7 4.186 -3.564 1.245
38 HA GLU 7 HA GLU 7 2.730 -6.077 1.526
39 HB2 GLU 7 1HB GLU 7 2.861 -3.485 2.962
40 HB3 GLU 7 2HB GLU 7 1.305 -4.315 2.971
41 HG2 GLU 7 1HG GLU 7 2.831 -4.954 4.872
42 HG3 GLU 7 2HG GLU 7 2.291 -6.302 3.878
43 H VAL 8 H VAL 8 0.480 -6.227 1.058
44 HA VAL 8 HA VAL 8 -0.297 -4.822 -1.348
45 HB VAL 8 HB VAL 8 -0.989 -7.039 -1.414
46 HG11 VAL 8 1HG1 VAL 8 -1.629 -6.646 1.514
47 HG12 VAL 8 2HG1 VAL 8 -0.471 -7.764 0.792
48 HG13 VAL 8 3HG1 VAL 8 -2.203 -8.052 0.619
49 HG21 VAL 8 3HG2 VAL 8 -3.440 -5.869 -0.089
50 HG22 VAL 8 1HG2 VAL 8 -3.355 -6.992 -1.445
51 HG23 VAL 8 2HG2 VAL 8 -2.906 -5.304 -1.674
52 H CYS 9 H CYS 9 -1.983 -3.360 -1.598
53 HA CYS 9 HA CYS 9 -3.201 -2.354 0.923
54 HB2 CYS 9 2HB CYS 9 -2.922 -0.127 0.220
55 HB3 CYS 9 1HB CYS 9 -1.386 -0.888 -0.172
56 H GLY 10 H GLY 10 -5.210 -1.091 0.520
57 HA2 GLY 10 1HA GLY 10 -7.236 -0.701 -0.540
58 HA3 GLY 10 2HA GLY 10 -6.615 -1.533 -1.963
59 H TRP 11 H TRP 11 -5.838 -3.627 0.296
60 HA TRP 11 HA TRP 11 -8.466 -4.782 0.651
61 HB2 TRP 11 2HB TRP 11 -6.251 -6.405 -0.549
62 HB3 TRP 11 1HB TRP 11 -7.942 -6.837 -0.375
63 HD1 TRP 11 1HD TRP 11 -5.593 -5.400 -2.784
64 HE1 TRP 11 1HE TRP 11 -6.858 -4.379 -4.792
65 HE3 TRP 11 3HE TRP 11 -10.270 -5.302 -0.850
66 HZ2 TRP 11 2HZ TRP 11 -9.544 -3.614 -5.466
67 HZ3 TRP 11 3HZ TRP 11 -12.190 -4.418 -2.174
68 HH2 TRP 11 2HH TRP 11 -11.823 -3.572 -4.478
69 H GLY 12 H GLY 12 -5.484 -4.027 1.802
70 HA2 GLY 12 1HA GLY 12 -5.876 -5.683 4.182
71 HA3 GLY 12 2HA GLY 12 -4.345 -5.854 3.330
72 H SER 13 H SER 13 -4.328 -3.003 2.526
73 HA SER 13 HA SER 13 -4.209 -1.533 5.026
74 HB2 SER 13 1HB SER 13 -2.015 -2.911 4.664
75 HB3 SER 13 2HB SER 13 -1.660 -1.677 3.457
76 HG SER 13 HG SER 13 -2.332 -1.215 6.182
77 H LYS 14 H LYS 14 -2.813 0.638 4.366
78 HA LYS 14 HA LYS 14 -3.538 1.551 1.703
79 HB2 LYS 14 1HB LYS 14 -4.855 3.458 2.540
80 HB3 LYS 14 2HB LYS 14 -5.614 1.918 2.939
81 HG2 LYS 14 1HG LYS 14 -4.630 2.019 5.201
82 HG3 LYS 14 2HG LYS 14 -3.888 3.570 4.808
83 HD2 LYS 14 1HD LYS 14 -6.117 4.541 4.403
84 HD3 LYS 14 2HD LYS 14 -6.863 2.992 4.800
85 HE2 LYS 14 1HE LYS 14 -5.897 3.098 7.064
86 HE3 LYS 14 2HE LYS 14 -5.140 4.641 6.672
87 HZ1 LYS 14 3HZ LYS 14 -7.770 4.953 5.983
88 HZ2 LYS 14 1HZ LYS 14 -7.011 5.581 7.363
89 HZ3 LYS 14 2HZ LYS 14 -7.826 4.093 7.448
90 H CYS 15 H CYS 15 -1.034 1.175 2.960
91 HA CYS 15 HA CYS 15 0.964 2.231 3.315
92 HB2 CYS 15 2HB CYS 15 -0.547 4.232 1.670
93 HB3 CYS 15 1HB CYS 15 1.014 4.633 2.336
94 H CYS 16 H CYS 16 1.576 2.756 5.303
95 HA CYS 16 HA CYS 16 0.172 3.876 7.323
96 HB2 CYS 16 2HB CYS 16 2.896 3.331 6.834
97 HB3 CYS 16 1HB CYS 16 2.815 4.981 7.453
98 H HIS 17 H HIS 17 2.330 5.813 5.242
99 HA HIS 17 HA HIS 17 0.544 7.895 4.767
100 HB2 HIS 17 1HB HIS 17 1.549 7.927 7.464
101 HB3 HIS 17 2HB HIS 17 2.173 9.320 6.586
102 HD1 HIS 17 HD1 HIS 17 -0.565 8.557 8.623
103 HD2 HIS 17 HD2 HIS 17 -0.259 10.406 4.900
104 HE1 HIS 17 HE1 HIS 17 -2.693 9.892 8.308
105 H GLY 18 H GLY 18 3.722 6.723 5.209
106 HA2 GLY 18 1HA GLY 18 4.906 8.886 3.594
107 HA3 GLY 18 2HA GLY 18 5.802 7.658 4.484
108 H LEU 19 H LEU 19 3.267 6.177 2.961
109 HA LEU 19 HA LEU 19 4.910 5.482 0.617
110 HB2 LEU 19 1HB LEU 19 3.151 3.758 2.359
111 HB3 LEU 19 2HB LEU 19 3.762 3.241 0.798
112 HG LEU 19 HG LEU 19 5.613 4.250 2.962
113 HD11 LEU 19 1HD1 LEU 19 4.153 1.697 2.765
114 HD12 LEU 19 2HD1 LEU 19 4.955 2.426 4.154
115 HD13 LEU 19 3HD1 LEU 19 5.894 1.523 2.965
116 HD21 LEU 19 3HD2 LEU 19 7.116 2.572 1.659
117 HD22 LEU 19 1HD2 LEU 19 6.761 4.116 0.894
118 HD23 LEU 19 2HD2 LEU 19 5.893 2.661 0.395
119 H ASP 20 H ASP 20 3.780 4.983 -1.306
120 HA ASP 20 HA ASP 20 1.000 5.978 -1.426
121 HB2 ASP 20 1HB ASP 20 3.307 6.449 -3.321
122 HB3 ASP 20 2HB ASP 20 1.626 6.729 -3.775
123 H CYS 21 H CYS 21 -0.403 4.500 -2.197
124 HA CYS 21 HA CYS 21 0.646 2.362 -3.928
125 HB2 CYS 21 2HB CYS 21 -0.158 0.739 -2.591
126 HB3 CYS 21 1HB CYS 21 -0.198 1.979 -1.351
127 HA PRO 22 HA PRO 22 -2.728 3.795 -6.493
128 HB2 PRO 22 2HB PRO 22 -2.617 1.848 -8.398
129 HB3 PRO 22 1HB PRO 22 -1.409 3.144 -8.285
130 HG2 PRO 22 2HG PRO 22 -1.238 0.326 -7.331
131 HG3 PRO 22 1HG PRO 22 -0.015 1.320 -8.129
132 HD2 PRO 22 2HD PRO 22 -0.053 0.860 -5.456
133 HD3 PRO 22 1HD PRO 22 0.624 2.335 -6.189
134 H LEU 23 H LEU 23 -4.856 3.162 -7.154
135 HA LEU 23 HA LEU 23 -5.979 1.065 -5.429
136 HB2 LEU 23 1HB LEU 23 -6.958 3.599 -6.605
137 HB3 LEU 23 2HB LEU 23 -8.134 2.288 -6.515
138 HG LEU 23 HG LEU 23 -7.856 2.081 -4.138
139 HD11 LEU 23 1HD1 LEU 23 -6.206 3.958 -3.140
140 HD12 LEU 23 2HD1 LEU 23 -5.369 3.646 -4.658
141 HD13 LEU 23 3HD1 LEU 23 -5.648 2.328 -3.514
142 HD21 LEU 23 3HD2 LEU 23 -9.254 3.964 -4.925
143 HD22 LEU 23 1HD2 LEU 23 -7.838 5.017 -4.888
144 HD23 LEU 23 2HD2 LEU 23 -8.475 4.339 -3.388
145 H ALA 24 H ALA 24 -5.639 -0.812 -6.513
146 HA ALA 24 HA ALA 24 -7.067 -1.131 -9.070
147 HB1 ALA 24 3HB ALA 24 -4.360 -2.312 -8.380
148 HB2 ALA 24 1HB ALA 24 -4.655 -1.018 -9.543
149 HB3 ALA 24 2HB ALA 24 -5.281 -2.638 -9.852
150 H PHE 25 H PHE 25 -5.689 -3.953 -8.730
151 HA PHE 25 HA PHE 25 -7.851 -5.055 -7.039
152 HB2 PHE 25 2HB PHE 25 -6.248 -6.735 -8.915
153 HB3 PHE 25 1HB PHE 25 -7.933 -6.884 -8.438
154 HD1 PHE 25 1HD PHE 25 -5.594 -5.413 -10.779
155 HD2 PHE 25 2HD PHE 25 -9.648 -5.282 -9.368
156 HE1 PHE 25 1HE PHE 25 -6.256 -4.165 -12.808
157 HE2 PHE 25 2HE PHE 25 -10.314 -4.032 -11.405
158 HZ PHE 25 HZ PHE 25 -8.618 -3.474 -13.128
159 H ILE 26 H ILE 26 -4.413 -5.313 -7.847
160 HA ILE 26 HA ILE 26 -3.941 -6.440 -5.160
161 HB ILE 26 HB ILE 26 -1.967 -7.687 -6.399
162 HG12 ILE 26 1HG1 ILE 26 -2.643 -8.468 -8.630
163 HG13 ILE 26 2HG1 ILE 26 -4.079 -7.457 -8.566
164 HG21 ILE 26 1HG2 ILE 26 -3.708 -9.573 -6.851
165 HG22 ILE 26 2HG2 ILE 26 -4.861 -8.438 -6.148
166 HG23 ILE 26 3HG2 ILE 26 -3.480 -8.993 -5.202
167 HD11 ILE 26 3HD1 ILE 26 -2.173 -6.473 -9.890
168 HD12 ILE 26 1HD1 ILE 26 -1.256 -6.369 -8.390
169 HD13 ILE 26 2HD1 ILE 26 -2.745 -5.439 -8.583
170 HA PRO 27 HA PRO 27 -1.170 -2.820 -6.430
171 HB2 PRO 27 2HB PRO 27 -2.169 -0.939 -4.735
172 HB3 PRO 27 1HB PRO 27 -2.780 -1.190 -6.381
173 HG2 PRO 27 2HG PRO 27 -3.883 -2.144 -3.799
174 HG3 PRO 27 1HG PRO 27 -4.729 -1.473 -5.191
175 HD2 PRO 27 2HD PRO 27 -4.636 -4.151 -4.707
176 HD3 PRO 27 1HD PRO 27 -4.697 -3.469 -6.348
177 H TYR 28 H TYR 28 0.566 -2.026 -5.193
178 HA TYR 28 HA TYR 28 0.852 -3.155 -2.479
179 HB2 TYR 28 2HB TYR 28 2.723 -3.132 -4.814
180 HB3 TYR 28 1HB TYR 28 3.380 -3.099 -3.178
181 HD1 TYR 28 1HD TYR 28 0.745 -4.898 -5.159
182 HD2 TYR 28 2HD TYR 28 3.759 -5.132 -2.120
183 HE1 TYR 28 1HE TYR 28 0.326 -7.328 -4.929
184 HE2 TYR 28 2HE TYR 28 3.349 -7.559 -1.883
185 HH TYR 28 HH TYR 28 2.402 -9.419 -3.452
186 H CYS 29 H CYS 29 2.012 -1.946 -0.967
187 HA CYS 29 HA CYS 29 1.869 0.914 -1.372
188 HB2 CYS 29 2HB CYS 29 2.143 -0.934 0.904
189 HB3 CYS 29 1HB CYS 29 3.054 0.565 1.065
190 H GLU 30 H GLU 30 3.457 2.052 -2.225
191 HA GLU 30 HA GLU 30 6.239 1.338 -1.563
192 HB2 GLU 30 1HB GLU 30 6.928 1.642 -3.900
193 HB3 GLU 30 2HB GLU 30 5.761 0.325 -3.758
194 HG2 GLU 30 1HG GLU 30 3.952 2.012 -4.302
195 HG3 GLU 30 2HG GLU 30 5.236 3.151 -4.700
196 H LYS 31 H LYS 31 7.698 3.081 -1.663
197 HA LYS 31 HA LYS 31 6.639 5.594 -0.910
198 HB2 LYS 31 1HB LYS 31 8.865 6.302 -0.711
199 HB3 LYS 31 2HB LYS 31 8.971 4.564 -0.432
200 HG2 LYS 31 1HG LYS 31 9.370 4.386 -2.988
201 HG3 LYS 31 2HG LYS 31 9.708 6.114 -2.913
202 HD2 LYS 31 1HD LYS 31 11.105 4.031 -1.208
203 HD3 LYS 31 2HD LYS 31 11.761 4.695 -2.702
204 HE2 LYS 31 1HE LYS 31 11.566 6.992 -1.683
205 HE3 LYS 31 2HE LYS 31 11.121 6.216 -0.162
206 HZ1 LYS 31 3HZ LYS 31 13.199 5.131 -0.052
207 HZ2 LYS 31 1HZ LYS 31 13.533 6.754 -0.417
208 HZ3 LYS 31 2HZ LYS 31 13.608 5.576 -1.640
209 H TYR 32 H TYR 32 6.746 7.611 -2.004
210 HA TYR 32 HA TYR 32 5.892 7.508 -4.714
211 HB2 TYR 32 2HB TYR 32 5.218 9.261 -3.061
212 HB3 TYR 32 1HB TYR 32 6.850 9.920 -3.161
213 HD1 TYR 32 1HD TYR 32 3.863 9.048 -5.200
214 HD2 TYR 32 2HD TYR 32 7.466 11.374 -4.936
215 HE1 TYR 32 1HE TYR 32 3.216 10.286 -7.253
216 HE2 TYR 32 2HE TYR 32 6.819 12.610 -6.989
217 HH TYR 32 HH TYR 32 5.378 12.254 -8.971
218 H ARG 33 H ARG 33 7.002 7.685 -6.573
219 HA ARG 33 HA ARG 33 9.776 7.334 -6.697
220 HB2 ARG 33 1HB ARG 33 7.803 8.365 -8.739
221 HB3 ARG 33 2HB ARG 33 9.499 8.053 -9.111
222 HG2 ARG 33 1HG ARG 33 9.245 5.715 -8.413
223 HG3 ARG 33 2HG ARG 33 7.561 6.013 -7.982
224 HD2 ARG 33 1HD ARG 33 7.053 6.593 -10.316
225 HD3 ARG 33 2HD ARG 33 8.738 6.332 -10.758
226 HE ARG 33 HE ARG 33 7.769 3.992 -9.526
227 HH11 ARG 33 1HH1 ARG 33 7.148 2.239 -10.831
228 HH12 ARG 33 2HH1 ARG 33 6.755 2.503 -12.497
229 HH21 ARG 33 2HH2 ARG 33 6.860 4.587 -13.366
230 HH22 ARG 33 1HH2 ARG 33 7.335 5.920 -12.365
Start of MODEL 11
1 HA ASN 1 HA ASN 1 0.012 -2.396 12.507
2 HB2 ASN 1 1HB ASN 1 -0.134 0.251 13.719
3 HB3 ASN 1 2HB ASN 1 -1.520 -0.065 12.677
4 HD21 ASN 1 1HD2 ASN 1 -2.990 -1.885 15.306
5 HD22 ASN 1 2HD2 ASN 1 -3.151 -0.654 14.150
6 H CYS 2 H CYS 2 1.504 -0.001 10.632
7 HA CYS 2 HA CYS 2 -0.562 -0.066 8.556
8 HB2 CYS 2 2HB CYS 2 1.095 1.642 7.526
9 HB3 CYS 2 1HB CYS 2 0.063 2.138 8.868
10 H ALA 3 H ALA 3 0.297 -0.175 6.288
11 HA ALA 3 HA ALA 3 1.676 -2.641 5.928
12 HB1 ALA 3 3HB ALA 3 0.301 -2.307 4.127
13 HB2 ALA 3 1HB ALA 3 1.778 -1.596 3.463
14 HB3 ALA 3 2HB ALA 3 0.526 -0.555 4.148
15 H LYS 4 H LYS 4 3.733 -3.056 5.238
16 HA LYS 4 HA LYS 4 5.620 -0.802 5.395
17 HB2 LYS 4 1HB LYS 4 5.941 -3.761 5.841
18 HB3 LYS 4 2HB LYS 4 7.317 -2.666 5.679
19 HG2 LYS 4 1HG LYS 4 5.128 -1.912 7.564
20 HG3 LYS 4 2HG LYS 4 6.237 -3.177 8.049
21 HD2 LYS 4 1HD LYS 4 7.365 -0.641 6.929
22 HD3 LYS 4 2HD LYS 4 6.787 -0.650 8.594
23 HE2 LYS 4 1HE LYS 4 8.261 -2.567 9.096
24 HE3 LYS 4 2HE LYS 4 8.849 -2.551 7.432
25 HZ1 LYS 4 3HZ LYS 4 10.339 -1.361 8.929
26 HZ2 LYS 4 1HZ LYS 4 9.084 -0.304 9.361
27 HZ3 LYS 4 2HZ LYS 4 9.673 -0.314 7.769
28 H GLU 5 H GLU 5 7.021 -0.407 3.718
29 HA GLU 5 HA GLU 5 6.408 -0.669 1.139
30 HB2 GLU 5 1HB GLU 5 8.406 0.539 2.023
31 HB3 GLU 5 2HB GLU 5 9.227 -1.015 2.185
32 HG2 GLU 5 1HG GLU 5 8.995 -1.415 -0.212
33 HG3 GLU 5 2HG GLU 5 8.118 0.098 -0.399
34 H GLY 6 H GLY 6 5.884 -2.311 -0.121
35 HA2 GLY 6 1HA GLY 6 6.533 -4.294 -1.330
36 HA3 GLY 6 2HA GLY 6 7.370 -4.852 0.114
37 H GLU 7 H GLU 7 4.560 -3.483 1.153
38 HA GLU 7 HA GLU 7 3.241 -6.105 1.354
39 HB2 GLU 7 1HB GLU 7 2.933 -3.549 2.926
40 HB3 GLU 7 2HB GLU 7 1.848 -4.928 3.109
41 HG2 GLU 7 1HG GLU 7 4.855 -5.139 3.388
42 HG3 GLU 7 2HG GLU 7 3.779 -4.861 4.754
43 H VAL 8 H VAL 8 0.979 -6.303 0.982
44 HA VAL 8 HA VAL 8 0.079 -4.832 -1.316
45 HB VAL 8 HB VAL 8 -0.538 -7.103 -1.308
46 HG11 VAL 8 1HG1 VAL 8 -2.120 -7.705 0.827
47 HG12 VAL 8 2HG1 VAL 8 -0.999 -6.566 1.573
48 HG13 VAL 8 3HG1 VAL 8 -0.386 -8.020 0.783
49 HG21 VAL 8 3HG2 VAL 8 -2.887 -6.999 -1.536
50 HG22 VAL 8 1HG2 VAL 8 -2.382 -5.327 -1.781
51 HG23 VAL 8 2HG2 VAL 8 -3.054 -5.828 -0.228
52 H CYS 9 H CYS 9 -1.616 -3.392 -1.476
53 HA CYS 9 HA CYS 9 -3.051 -2.588 0.948
54 HB2 CYS 9 2HB CYS 9 -1.346 -1.034 1.223
55 HB3 CYS 9 1HB CYS 9 -1.058 -0.921 -0.490
56 H GLY 10 H GLY 10 -4.810 -1.043 0.452
57 HA2 GLY 10 1HA GLY 10 -6.270 0.019 -1.117
58 HA3 GLY 10 2HA GLY 10 -5.682 -1.080 -2.362
59 H TRP 11 H TRP 11 -5.844 -3.211 -0.120
60 HA TRP 11 HA TRP 11 -8.734 -3.514 0.005
61 HB2 TRP 11 2HB TRP 11 -6.983 -5.730 -0.981
62 HB3 TRP 11 1HB TRP 11 -8.733 -5.674 -0.941
63 HD1 TRP 11 1HD TRP 11 -5.912 -5.032 -3.158
64 HE1 TRP 11 1HE TRP 11 -6.672 -3.764 -5.267
65 HE3 TRP 11 3HE TRP 11 -10.484 -3.538 -1.613
66 HZ2 TRP 11 2HZ TRP 11 -8.962 -2.280 -6.173
67 HZ3 TRP 11 3HZ TRP 11 -11.957 -2.187 -3.093
68 HH2 TRP 11 2HH TRP 11 -11.198 -1.556 -5.371
69 H GLY 12 H GLY 12 -5.740 -3.683 1.408
70 HA2 GLY 12 1HA GLY 12 -6.804 -5.128 3.738
71 HA3 GLY 12 2HA GLY 12 -5.263 -5.637 3.057
72 H SER 13 H SER 13 -4.491 -2.854 2.331
73 HA SER 13 HA SER 13 -4.223 -1.631 4.992
74 HB2 SER 13 1HB SER 13 -2.223 -3.040 4.644
75 HB3 SER 13 2HB SER 13 -1.900 -2.189 3.140
76 HG SER 13 HG SER 13 -2.132 -0.258 4.706
77 H LYS 14 H LYS 14 -3.250 0.607 4.785
78 HA LYS 14 HA LYS 14 -3.930 1.844 2.207
79 HB2 LYS 14 1HB LYS 14 -4.797 2.732 4.954
80 HB3 LYS 14 2HB LYS 14 -4.909 3.739 3.514
81 HG2 LYS 14 1HG LYS 14 -6.314 2.029 2.419
82 HG3 LYS 14 2HG LYS 14 -6.207 1.024 3.865
83 HD2 LYS 14 1HD LYS 14 -7.289 2.800 5.189
84 HD3 LYS 14 2HD LYS 14 -7.392 3.813 3.747
85 HE2 LYS 14 1HE LYS 14 -8.800 2.117 2.645
86 HE3 LYS 14 2HE LYS 14 -8.694 1.094 4.077
87 HZ1 LYS 14 3HZ LYS 14 -9.581 3.168 5.283
88 HZ2 LYS 14 1HZ LYS 14 -10.666 2.215 4.394
89 HZ3 LYS 14 2HZ LYS 14 -10.082 3.669 3.739
90 H CYS 15 H CYS 15 -1.334 1.121 3.300
91 HA CYS 15 HA CYS 15 0.766 2.013 3.595
92 HB2 CYS 15 2HB CYS 15 -0.684 4.197 2.136
93 HB3 CYS 15 1HB CYS 15 0.956 4.430 2.682
94 H CYS 16 H CYS 16 1.932 2.970 5.163
95 HA CYS 16 HA CYS 16 0.639 3.898 7.475
96 HB2 CYS 16 2HB CYS 16 3.112 2.970 6.967
97 HB3 CYS 16 1HB CYS 16 3.447 4.699 7.050
98 H HIS 17 H HIS 17 2.677 5.721 5.198
99 HA HIS 17 HA HIS 17 0.962 7.927 5.035
100 HB2 HIS 17 1HB HIS 17 2.130 7.874 7.559
101 HB3 HIS 17 2HB HIS 17 3.155 8.975 6.651
102 HD1 HIS 17 HD1 HIS 17 -0.518 8.444 7.478
103 HD2 HIS 17 HD2 HIS 17 2.047 11.483 6.231
104 HE1 HIS 17 HE1 HIS 17 -1.875 10.581 7.505
105 H GLY 18 H GLY 18 4.131 6.606 4.989
106 HA2 GLY 18 1HA GLY 18 5.071 8.650 3.079
107 HA3 GLY 18 2HA GLY 18 6.087 7.475 3.908
108 H LEU 19 H LEU 19 3.364 5.920 2.874
109 HA LEU 19 HA LEU 19 4.647 5.030 0.365
110 HB2 LEU 19 1HB LEU 19 3.000 3.464 2.353
111 HB3 LEU 19 2HB LEU 19 3.592 2.837 0.826
112 HG LEU 19 HG LEU 19 5.367 3.959 3.014
113 HD11 LEU 19 1HD1 LEU 19 5.114 1.052 2.270
114 HD12 LEU 19 2HD1 LEU 19 4.066 1.766 3.499
115 HD13 LEU 19 3HD1 LEU 19 5.815 1.759 3.724
116 HD21 LEU 19 3HD2 LEU 19 6.709 4.063 1.136
117 HD22 LEU 19 1HD2 LEU 19 5.829 2.781 0.302
118 HD23 LEU 19 2HD2 LEU 19 6.971 2.377 1.578
119 H ASP 20 H ASP 20 3.237 4.416 -1.334
120 HA ASP 20 HA ASP 20 0.446 5.313 -1.093
121 HB2 ASP 20 1HB ASP 20 2.044 6.974 -2.268
122 HB3 ASP 20 2HB ASP 20 2.072 5.795 -3.577
123 H CYS 21 H CYS 21 -1.005 4.025 -2.064
124 HA CYS 21 HA CYS 21 -0.016 1.895 -3.828
125 HB2 CYS 21 2HB CYS 21 -1.906 0.529 -2.587
126 HB3 CYS 21 1HB CYS 21 -0.252 0.596 -1.991
127 HA PRO 22 HA PRO 22 -3.446 3.838 -6.144
128 HB2 PRO 22 2HB PRO 22 -2.645 1.801 -8.142
129 HB3 PRO 22 1HB PRO 22 -2.800 3.558 -8.320
130 HG2 PRO 22 2HG PRO 22 -0.417 2.356 -8.217
131 HG3 PRO 22 1HG PRO 22 -0.688 3.960 -7.534
132 HD2 PRO 22 2HD PRO 22 -0.367 1.342 -6.139
133 HD3 PRO 22 1HD PRO 22 0.138 2.975 -5.667
134 H LEU 23 H LEU 23 -5.475 3.057 -7.066
135 HA LEU 23 HA LEU 23 -6.427 0.721 -5.638
136 HB2 LEU 23 1HB LEU 23 -7.751 2.865 -7.295
137 HB3 LEU 23 2HB LEU 23 -8.638 1.449 -6.740
138 HG LEU 23 HG LEU 23 -8.887 3.385 -5.192
139 HD11 LEU 23 1HD1 LEU 23 -8.502 0.780 -4.495
140 HD12 LEU 23 2HD1 LEU 23 -8.908 2.051 -3.344
141 HD13 LEU 23 3HD1 LEU 23 -7.225 1.557 -3.557
142 HD21 LEU 23 3HD2 LEU 23 -6.458 4.131 -5.744
143 HD22 LEU 23 1HD2 LEU 23 -5.991 3.017 -4.460
144 HD23 LEU 23 2HD2 LEU 23 -7.058 4.375 -4.103
145 H ALA 24 H ALA 24 -5.814 -1.119 -6.538
146 HA ALA 24 HA ALA 24 -6.722 -1.670 -9.266
147 HB1 ALA 24 3HB ALA 24 -4.022 -1.215 -8.666
148 HB2 ALA 24 1HB ALA 24 -4.681 -1.931 -10.138
149 HB3 ALA 24 2HB ALA 24 -4.182 -2.969 -8.800
150 H PHE 25 H PHE 25 -5.668 -4.214 -9.513
151 HA PHE 25 HA PHE 25 -7.515 -5.769 -8.034
152 HB2 PHE 25 2HB PHE 25 -4.999 -6.771 -9.365
153 HB3 PHE 25 1HB PHE 25 -6.508 -7.638 -9.127
154 HD1 PHE 25 1HD PHE 25 -4.749 -5.080 -11.001
155 HD2 PHE 25 2HD PHE 25 -8.479 -7.147 -10.557
156 HE1 PHE 25 1HE PHE 25 -5.480 -4.200 -13.176
157 HE2 PHE 25 2HE PHE 25 -9.226 -6.262 -12.755
158 HZ PHE 25 HZ PHE 25 -7.723 -4.785 -14.070
159 H ILE 26 H ILE 26 -3.964 -5.486 -7.846
160 HA ILE 26 HA ILE 26 -4.081 -6.071 -4.966
161 HB ILE 26 HB ILE 26 -1.918 -7.555 -5.483
162 HG12 ILE 26 1HG1 ILE 26 -2.335 -8.981 -7.456
163 HG13 ILE 26 2HG1 ILE 26 -3.714 -7.987 -7.891
164 HG21 ILE 26 1HG2 ILE 26 -3.459 -9.540 -5.389
165 HG22 ILE 26 2HG2 ILE 26 -4.814 -8.429 -5.587
166 HG23 ILE 26 3HG2 ILE 26 -3.783 -8.317 -4.160
167 HD11 ILE 26 3HD1 ILE 26 -2.244 -6.036 -8.171
168 HD12 ILE 26 1HD1 ILE 26 -1.690 -7.366 -9.185
169 HD13 ILE 26 2HD1 ILE 26 -0.855 -7.001 -7.677
170 HA PRO 27 HA PRO 27 -1.181 -2.652 -6.202
171 HB2 PRO 27 2HB PRO 27 -2.497 -1.260 -3.970
172 HB3 PRO 27 1HB PRO 27 -2.244 -0.740 -5.646
173 HG2 PRO 27 2HG PRO 27 -4.668 -1.405 -4.732
174 HG3 PRO 27 1HG PRO 27 -4.158 -1.759 -6.388
175 HD2 PRO 27 2HD PRO 27 -4.289 -3.619 -4.038
176 HD3 PRO 27 1HD PRO 27 -4.780 -3.896 -5.727
177 H TYR 28 H TYR 28 0.512 -1.627 -4.914
178 HA TYR 28 HA TYR 28 1.030 -2.984 -2.341
179 HB2 TYR 28 2HB TYR 28 2.771 -2.803 -4.756
180 HB3 TYR 28 1HB TYR 28 3.528 -2.758 -3.166
181 HD1 TYR 28 1HD TYR 28 0.948 -4.708 -5.092
182 HD2 TYR 28 2HD TYR 28 4.018 -4.770 -2.090
183 HE1 TYR 28 1HE TYR 28 0.707 -7.166 -4.892
184 HE2 TYR 28 2HE TYR 28 3.779 -7.225 -1.890
185 HH TYR 28 HH TYR 28 2.332 -8.978 -2.375
186 H CYS 29 H CYS 29 2.008 -1.801 -0.759
187 HA CYS 29 HA CYS 29 1.805 1.058 -1.013
188 HB2 CYS 29 2HB CYS 29 2.268 -0.891 1.163
189 HB3 CYS 29 1HB CYS 29 2.986 0.693 1.391
190 H GLU 30 H GLU 30 3.322 1.603 -2.594
191 HA GLU 30 HA GLU 30 6.155 1.188 -1.828
192 HB2 GLU 30 1HB GLU 30 4.966 1.872 -4.525
193 HB3 GLU 30 2HB GLU 30 6.685 1.650 -4.186
194 HG2 GLU 30 1HG GLU 30 4.600 -0.454 -3.605
195 HG3 GLU 30 2HG GLU 30 5.507 -0.396 -5.119
196 H LYS 31 H LYS 31 7.610 2.917 -1.901
197 HA LYS 31 HA LYS 31 6.831 5.325 -0.816
198 HB2 LYS 31 1HB LYS 31 9.007 6.209 -1.566
199 HB3 LYS 31 2HB LYS 31 9.172 4.580 -0.911
200 HG2 LYS 31 1HG LYS 31 9.108 3.658 -3.210
201 HG3 LYS 31 2HG LYS 31 8.986 5.295 -3.855
202 HD2 LYS 31 1HD LYS 31 11.154 5.868 -2.837
203 HD3 LYS 31 2HD LYS 31 11.282 4.233 -2.184
204 HE2 LYS 31 1HE LYS 31 11.228 3.312 -4.471
205 HE3 LYS 31 2HE LYS 31 11.097 4.944 -5.128
206 HZ1 LYS 31 3HZ LYS 31 13.221 5.453 -3.985
207 HZ2 LYS 31 1HZ LYS 31 13.367 4.290 -5.212
208 HZ3 LYS 31 2HZ LYS 31 13.360 3.808 -3.583
209 H TYR 32 H TYR 32 6.748 7.474 -1.699
210 HA TYR 32 HA TYR 32 6.284 7.811 -4.540
211 HB2 TYR 32 2HB TYR 32 4.012 8.270 -4.488
212 HB3 TYR 32 1HB TYR 32 4.125 6.924 -3.356
213 HD1 TYR 32 1HD TYR 32 2.242 9.559 -3.678
214 HD2 TYR 32 2HD TYR 32 5.296 8.281 -0.946
215 HE1 TYR 32 1HE TYR 32 1.295 11.035 -1.928
216 HE2 TYR 32 2HE TYR 32 4.344 9.744 0.804
217 HH TYR 32 HH TYR 32 1.422 11.686 0.200
218 H ARG 33 H ARG 33 5.818 10.101 -5.074
219 HA ARG 33 HA ARG 33 7.579 11.867 -3.779
220 HB2 ARG 33 1HB ARG 33 5.215 12.479 -5.570
221 HB3 ARG 33 2HB ARG 33 6.492 13.621 -5.144
222 HG2 ARG 33 1HG ARG 33 8.171 12.204 -6.196
223 HG3 ARG 33 2HG ARG 33 6.961 10.965 -6.528
224 HD2 ARG 33 1HD ARG 33 7.295 12.241 -8.554
225 HD3 ARG 33 2HD ARG 33 5.709 12.649 -7.906
226 HE ARG 33 HE ARG 33 7.638 14.468 -6.904
227 HH11 ARG 33 1HH1 ARG 33 7.723 16.546 -7.820
228 HH12 ARG 33 2HH1 ARG 33 7.020 16.830 -9.377
229 HH21 ARG 33 2HH2 ARG 33 6.027 15.136 -10.495
230 HH22 ARG 33 1HH2 ARG 33 5.966 13.554 -9.794
Start of MODEL 12
1 HA ASN 1 HA ASN 1 -0.932 -0.946 12.129
2 HB2 ASN 1 1HB ASN 1 -1.123 -3.816 12.178
3 HB3 ASN 1 2HB ASN 1 -0.090 -3.328 10.835
4 HD21 ASN 1 1HD2 ASN 1 2.567 -2.950 13.113
5 HD22 ASN 1 2HD2 ASN 1 2.009 -3.632 11.661
6 H CYS 2 H CYS 2 0.225 -0.294 10.264
7 HA CYS 2 HA CYS 2 -1.400 -0.252 7.834
8 HB2 CYS 2 2HB CYS 2 0.414 1.423 7.154
9 HB3 CYS 2 1HB CYS 2 -0.724 1.907 8.405
10 H ALA 3 H ALA 3 0.324 0.056 5.853
11 HA ALA 3 HA ALA 3 1.686 -2.549 5.756
12 HB1 ALA 3 3HB ALA 3 0.367 -2.544 3.876
13 HB2 ALA 3 1HB ALA 3 1.794 -1.731 3.221
14 HB3 ALA 3 2HB ALA 3 0.395 -0.784 3.738
15 H LYS 4 H LYS 4 3.711 -2.694 4.686
16 HA LYS 4 HA LYS 4 5.287 -0.211 4.686
17 HB2 LYS 4 1HB LYS 4 7.174 -1.371 5.657
18 HB3 LYS 4 2HB LYS 4 5.787 -1.574 6.723
19 HG2 LYS 4 1HG LYS 4 6.202 -3.795 6.604
20 HG3 LYS 4 2HG LYS 4 5.500 -3.691 4.994
21 HD2 LYS 4 1HD LYS 4 7.533 -4.696 4.500
22 HD3 LYS 4 2HD LYS 4 7.964 -3.001 4.296
23 HE2 LYS 4 1HE LYS 4 8.478 -4.755 6.714
24 HE3 LYS 4 2HE LYS 4 9.676 -4.007 5.659
25 HZ1 LYS 4 3HZ LYS 4 9.358 -2.797 7.754
26 HZ2 LYS 4 1HZ LYS 4 7.737 -2.517 7.341
27 HZ3 LYS 4 2HZ LYS 4 8.979 -1.847 6.398
28 H GLU 5 H GLU 5 6.899 -0.142 3.127
29 HA GLU 5 HA GLU 5 6.431 -0.954 0.628
30 HB2 GLU 5 1HB GLU 5 8.325 0.500 1.395
31 HB3 GLU 5 2HB GLU 5 9.199 -0.959 1.857
32 HG2 GLU 5 1HG GLU 5 9.090 -1.771 -0.448
33 HG3 GLU 5 2HG GLU 5 8.187 -0.334 -0.923
34 H GLY 6 H GLY 6 5.858 -2.894 -0.085
35 HA2 GLY 6 1HA GLY 6 6.788 -5.045 -0.866
36 HA3 GLY 6 2HA GLY 6 7.453 -5.251 0.750
37 H GLU 7 H GLU 7 4.486 -3.797 1.078
38 HA GLU 7 HA GLU 7 3.111 -6.396 1.413
39 HB2 GLU 7 1HB GLU 7 2.838 -3.880 3.066
40 HB3 GLU 7 2HB GLU 7 1.829 -5.317 3.241
41 HG2 GLU 7 1HG GLU 7 4.849 -5.352 3.461
42 HG3 GLU 7 2HG GLU 7 3.765 -5.221 4.843
43 H VAL 8 H VAL 8 0.976 -6.550 0.813
44 HA VAL 8 HA VAL 8 0.156 -4.855 -1.335
45 HB VAL 8 HB VAL 8 -0.444 -7.158 -1.470
46 HG11 VAL 8 1HG1 VAL 8 -1.634 -6.701 1.275
47 HG12 VAL 8 2HG1 VAL 8 -0.372 -7.845 0.820
48 HG13 VAL 8 3HG1 VAL 8 -2.033 -8.110 0.292
49 HG21 VAL 8 3HG2 VAL 8 -2.657 -6.912 -2.100
50 HG22 VAL 8 1HG2 VAL 8 -2.210 -5.214 -1.940
51 HG23 VAL 8 2HG2 VAL 8 -3.082 -6.023 -0.639
52 H CYS 9 H CYS 9 -1.472 -3.347 -1.438
53 HA CYS 9 HA CYS 9 -3.030 -2.788 0.972
54 HB2 CYS 9 2HB CYS 9 -2.442 -0.321 0.736
55 HB3 CYS 9 1HB CYS 9 -1.192 -1.357 1.416
56 H GLY 10 H GLY 10 -4.623 -0.995 0.564
57 HA2 GLY 10 1HA GLY 10 -5.992 0.228 -0.982
58 HA3 GLY 10 2HA GLY 10 -5.472 -0.867 -2.257
59 H TRP 11 H TRP 11 -5.834 -3.055 -0.076
60 HA TRP 11 HA TRP 11 -8.751 -3.183 -0.144
61 HB2 TRP 11 2HB TRP 11 -6.981 -5.495 -0.863
62 HB3 TRP 11 1HB TRP 11 -8.735 -5.431 -0.941
63 HD1 TRP 11 1HD TRP 11 -5.799 -4.953 -3.018
64 HE1 TRP 11 1HE TRP 11 -6.386 -3.705 -5.203
65 HE3 TRP 11 3HE TRP 11 -10.380 -3.228 -1.771
66 HZ2 TRP 11 2HZ TRP 11 -8.557 -2.153 -6.263
67 HZ3 TRP 11 3HZ TRP 11 -11.715 -1.860 -3.361
68 HH2 TRP 11 2HH TRP 11 -10.803 -1.318 -5.604
69 H GLY 12 H GLY 12 -5.939 -3.411 1.602
70 HA2 GLY 12 1HA GLY 12 -7.377 -4.508 3.904
71 HA3 GLY 12 2HA GLY 12 -5.917 -5.358 3.403
72 H SER 13 H SER 13 -4.743 -2.759 2.484
73 HA SER 13 HA SER 13 -4.202 -1.487 5.087
74 HB2 SER 13 1HB SER 13 -2.189 -2.544 3.119
75 HB3 SER 13 2HB SER 13 -1.787 -1.339 4.334
76 HG SER 13 HG SER 13 -2.721 -2.890 5.867
77 H LYS 14 H LYS 14 -3.206 0.651 4.897
78 HA LYS 14 HA LYS 14 -3.714 1.967 2.312
79 HB2 LYS 14 1HB LYS 14 -4.609 3.926 3.659
80 HB3 LYS 14 2HB LYS 14 -5.658 2.510 3.590
81 HG2 LYS 14 1HG LYS 14 -4.771 1.765 5.788
82 HG3 LYS 14 2HG LYS 14 -3.771 3.217 5.859
83 HD2 LYS 14 1HD LYS 14 -5.607 3.967 7.044
84 HD3 LYS 14 2HD LYS 14 -6.114 4.411 5.415
85 HE2 LYS 14 1HE LYS 14 -7.958 3.255 6.467
86 HE3 LYS 14 2HE LYS 14 -7.271 2.176 5.252
87 HZ1 LYS 14 3HZ LYS 14 -7.652 1.591 7.887
88 HZ2 LYS 14 1HZ LYS 14 -5.990 1.914 7.792
89 HZ3 LYS 14 2HZ LYS 14 -6.679 0.720 6.801
90 H CYS 15 H CYS 15 -1.212 1.088 3.424
91 HA CYS 15 HA CYS 15 0.914 1.859 3.830
92 HB2 CYS 15 2HB CYS 15 -0.403 4.182 2.460
93 HB3 CYS 15 1HB CYS 15 1.256 4.276 3.011
94 H CYS 16 H CYS 16 2.119 2.738 5.424
95 HA CYS 16 HA CYS 16 0.870 3.608 7.789
96 HB2 CYS 16 2HB CYS 16 3.740 3.767 6.885
97 HB3 CYS 16 1HB CYS 16 3.203 4.170 8.515
98 H HIS 17 H HIS 17 2.570 5.425 5.275
99 HA HIS 17 HA HIS 17 1.067 7.704 5.318
100 HB2 HIS 17 1HB HIS 17 2.688 9.190 6.758
101 HB3 HIS 17 2HB HIS 17 1.381 8.315 7.540
102 HD1 HIS 17 HD1 HIS 17 5.043 7.718 6.651
103 HD2 HIS 17 HD2 HIS 17 2.279 6.699 9.601
104 HE1 HIS 17 HE1 HIS 17 6.310 6.378 8.387
105 H GLY 18 H GLY 18 4.246 6.402 5.339
106 HA2 GLY 18 1HA GLY 18 5.283 8.466 3.528
107 HA3 GLY 18 2HA GLY 18 6.218 7.169 4.265
108 H LEU 19 H LEU 19 3.454 5.803 3.148
109 HA LEU 19 HA LEU 19 4.611 5.171 0.504
110 HB2 LEU 19 1HB LEU 19 3.286 3.326 2.494
111 HB3 LEU 19 2HB LEU 19 3.656 2.874 0.836
112 HG LEU 19 HG LEU 19 5.745 3.911 2.772
113 HD11 LEU 19 1HD1 LEU 19 6.362 1.658 3.255
114 HD12 LEU 19 2HD1 LEU 19 5.293 1.023 2.006
115 HD13 LEU 19 3HD1 LEU 19 4.612 1.722 3.479
116 HD21 LEU 19 3HD2 LEU 19 5.747 2.760 -0.009
117 HD22 LEU 19 1HD2 LEU 19 7.130 2.466 1.041
118 HD23 LEU 19 2HD2 LEU 19 6.669 4.116 0.642
119 H ASP 20 H ASP 20 3.043 4.398 -1.072
120 HA ASP 20 HA ASP 20 0.232 4.866 -0.578
121 HB2 ASP 20 1HB ASP 20 1.334 7.143 -1.125
122 HB3 ASP 20 2HB ASP 20 1.510 6.504 -2.758
123 H CYS 21 H CYS 21 -1.044 3.773 -2.067
124 HA CYS 21 HA CYS 21 0.294 2.654 -4.394
125 HB2 CYS 21 2HB CYS 21 -0.892 0.453 -3.908
126 HB3 CYS 21 1HB CYS 21 0.520 0.845 -2.950
127 HA PRO 22 HA PRO 22 -3.479 3.735 -6.380
128 HB2 PRO 22 2HB PRO 22 -3.240 2.271 -8.640
129 HB3 PRO 22 1HB PRO 22 -2.167 3.644 -8.294
130 HG2 PRO 22 2HG PRO 22 -1.659 0.725 -7.921
131 HG3 PRO 22 1HG PRO 22 -0.599 1.968 -8.593
132 HD2 PRO 22 2HD PRO 22 -0.400 1.044 -6.049
133 HD3 PRO 22 1HD PRO 22 0.075 2.678 -6.530
134 H LEU 23 H LEU 23 -5.506 2.820 -7.256
135 HA LEU 23 HA LEU 23 -6.254 0.459 -5.723
136 HB2 LEU 23 1HB LEU 23 -7.798 2.543 -7.264
137 HB3 LEU 23 2HB LEU 23 -8.571 1.060 -6.708
138 HG LEU 23 HG LEU 23 -8.832 2.954 -5.089
139 HD11 LEU 23 1HD1 LEU 23 -8.712 1.539 -3.303
140 HD12 LEU 23 2HD1 LEU 23 -7.016 1.153 -3.604
141 HD13 LEU 23 3HD1 LEU 23 -8.284 0.334 -4.518
142 HD21 LEU 23 3HD2 LEU 23 -6.970 3.948 -4.031
143 HD22 LEU 23 1HD2 LEU 23 -6.476 3.832 -5.720
144 HD23 LEU 23 2HD2 LEU 23 -5.881 2.661 -4.545
145 H ALA 24 H ALA 24 -5.610 -1.338 -6.657
146 HA ALA 24 HA ALA 24 -6.561 -1.921 -9.369
147 HB1 ALA 24 3HB ALA 24 -4.239 -1.244 -9.675
148 HB2 ALA 24 1HB ALA 24 -4.388 -2.983 -9.925
149 HB3 ALA 24 2HB ALA 24 -3.720 -2.363 -8.416
150 H PHE 25 H PHE 25 -5.360 -4.415 -9.603
151 HA PHE 25 HA PHE 25 -7.116 -6.046 -8.085
152 HB2 PHE 25 2HB PHE 25 -4.651 -7.187 -9.316
153 HB3 PHE 25 1HB PHE 25 -6.306 -7.778 -9.362
154 HD1 PHE 25 1HD PHE 25 -3.795 -6.212 -11.247
155 HD2 PHE 25 2HD PHE 25 -8.034 -6.121 -10.563
156 HE1 PHE 25 1HE PHE 25 -4.121 -5.113 -13.436
157 HE2 PHE 25 2HE PHE 25 -8.362 -5.020 -12.762
158 HZ PHE 25 HZ PHE 25 -6.405 -4.516 -14.199
159 H ILE 26 H ILE 26 -3.569 -5.681 -8.026
160 HA ILE 26 HA ILE 26 -3.608 -6.317 -5.156
161 HB ILE 26 HB ILE 26 -3.103 -8.394 -6.452
162 HG12 ILE 26 1HG1 ILE 26 -0.736 -8.639 -5.243
163 HG13 ILE 26 2HG1 ILE 26 -1.268 -7.148 -4.469
164 HG21 ILE 26 1HG2 ILE 26 -1.516 -8.480 -8.051
165 HG22 ILE 26 2HG2 ILE 26 -0.369 -7.563 -7.073
166 HG23 ILE 26 3HG2 ILE 26 -1.585 -6.716 -8.028
167 HD11 ILE 26 3HD1 ILE 26 -2.711 -9.802 -4.499
168 HD12 ILE 26 1HD1 ILE 26 -3.446 -8.301 -3.934
169 HD13 ILE 26 2HD1 ILE 26 -2.039 -8.963 -3.102
170 HA PRO 27 HA PRO 27 -0.962 -2.632 -6.228
171 HB2 PRO 27 2HB PRO 27 -2.273 -1.484 -3.871
172 HB3 PRO 27 1HB PRO 27 -2.152 -0.852 -5.522
173 HG2 PRO 27 2HG PRO 27 -4.463 -1.756 -4.491
174 HG3 PRO 27 1HG PRO 27 -4.056 -1.894 -6.206
175 HD2 PRO 27 2HD PRO 27 -3.949 -4.005 -4.081
176 HD3 PRO 27 1HD PRO 27 -4.456 -4.137 -5.782
177 H TYR 28 H TYR 28 0.772 -1.709 -4.953
178 HA TYR 28 HA TYR 28 1.306 -3.119 -2.410
179 HB2 TYR 28 2HB TYR 28 2.913 -3.117 -4.884
180 HB3 TYR 28 1HB TYR 28 3.813 -2.836 -3.393
181 HD1 TYR 28 1HD TYR 28 1.111 -5.081 -4.758
182 HD2 TYR 28 2HD TYR 28 4.486 -4.673 -2.120
183 HE1 TYR 28 1HE TYR 28 0.978 -7.487 -4.195
184 HE2 TYR 28 2HE TYR 28 4.338 -7.078 -1.566
185 HH TYR 28 HH TYR 28 2.059 -9.215 -3.219
186 H CYS 29 H CYS 29 1.708 -1.786 -0.803
187 HA CYS 29 HA CYS 29 1.665 0.976 -0.960
188 HB2 CYS 29 2HB CYS 29 2.330 -1.024 1.069
189 HB3 CYS 29 1HB CYS 29 3.168 0.502 1.292
190 H GLU 30 H GLU 30 2.978 1.796 -2.557
191 HA GLU 30 HA GLU 30 5.899 1.535 -2.102
192 HB2 GLU 30 1HB GLU 30 6.156 2.067 -4.489
193 HB3 GLU 30 2HB GLU 30 5.149 0.634 -4.267
194 HG2 GLU 30 1HG GLU 30 3.132 2.138 -4.374
195 HG3 GLU 30 2HG GLU 30 4.210 3.453 -4.836
196 H LYS 31 H LYS 31 7.178 3.403 -2.275
197 HA LYS 31 HA LYS 31 6.307 5.694 -1.039
198 HB2 LYS 31 1HB LYS 31 8.292 6.793 -1.940
199 HB3 LYS 31 2HB LYS 31 8.682 5.133 -1.482
200 HG2 LYS 31 1HG LYS 31 8.321 4.449 -3.868
201 HG3 LYS 31 2HG LYS 31 8.109 6.151 -4.282
202 HD2 LYS 31 1HD LYS 31 10.368 6.648 -3.425
203 HD3 LYS 31 2HD LYS 31 10.584 4.947 -3.009
204 HE2 LYS 31 1HE LYS 31 11.649 5.361 -5.155
205 HE3 LYS 31 2HE LYS 31 10.218 4.363 -5.416
206 HZ1 LYS 31 3HZ LYS 31 9.218 5.973 -6.567
207 HZ2 LYS 31 1HZ LYS 31 10.759 6.666 -6.710
208 HZ3 LYS 31 2HZ LYS 31 9.702 7.195 -5.490
209 H TYR 32 H TYR 32 5.434 7.634 -1.641
210 HA TYR 32 HA TYR 32 3.671 7.700 -3.819
211 HB2 TYR 32 2HB TYR 32 3.358 9.101 -1.837
212 HB3 TYR 32 1HB TYR 32 4.819 10.004 -2.236
213 HD1 TYR 32 1HD TYR 32 1.479 9.038 -3.603
214 HD2 TYR 32 2HD TYR 32 4.723 11.854 -3.696
215 HE1 TYR 32 1HE TYR 32 0.157 10.512 -5.097
216 HE2 TYR 32 2HE TYR 32 3.401 13.326 -5.190
217 HH TYR 32 HH TYR 32 0.205 13.162 -5.575
218 H ARG 33 H ARG 33 6.818 9.237 -3.378
219 HA ARG 33 HA ARG 33 6.881 10.381 -6.002
220 HB2 ARG 33 1HB ARG 33 9.253 10.861 -5.482
221 HB3 ARG 33 2HB ARG 33 8.178 11.363 -4.175
222 HG2 ARG 33 1HG ARG 33 8.671 9.261 -2.968
223 HG3 ARG 33 2HG ARG 33 9.764 8.778 -4.265
224 HD2 ARG 33 1HD ARG 33 11.053 9.769 -2.446
225 HD3 ARG 33 2HD ARG 33 11.113 10.825 -3.855
226 HE ARG 33 HE ARG 33 8.960 11.547 -2.120
227 HH11 ARG 33 1HH1 ARG 33 9.212 13.446 -0.899
228 HH12 ARG 33 2HH1 ARG 33 10.791 14.123 -0.676
229 HH21 ARG 33 2HH2 ARG 33 12.592 13.118 -1.601
230 HH22 ARG 33 1HH2 ARG 33 12.393 11.670 -2.530
Start of MODEL 13
1 HA ASN 1 HA ASN 1 1.758 -0.566 12.756
2 HB2 ASN 1 1HB ASN 1 0.928 -2.757 13.890
3 HB3 ASN 1 2HB ASN 1 -0.018 -2.976 12.418
4 HD21 ASN 1 1HD2 ASN 1 2.838 -4.549 11.054
5 HD22 ASN 1 2HD2 ASN 1 1.217 -4.723 11.529
6 H CYS 2 H CYS 2 2.021 -0.441 10.536
7 HA CYS 2 HA CYS 2 -0.417 -0.236 8.891
8 HB2 CYS 2 2HB CYS 2 1.179 1.532 7.679
9 HB3 CYS 2 1HB CYS 2 0.047 1.986 8.950
10 H ALA 3 H ALA 3 0.302 -0.122 6.480
11 HA ALA 3 HA ALA 3 1.544 -2.595 5.869
12 HB1 ALA 3 3HB ALA 3 0.273 -0.420 4.400
13 HB2 ALA 3 1HB ALA 3 0.312 -2.146 4.042
14 HB3 ALA 3 2HB ALA 3 1.652 -1.109 3.532
15 H LYS 4 H LYS 4 3.551 -3.064 5.064
16 HA LYS 4 HA LYS 4 5.597 -0.965 5.371
17 HB2 LYS 4 1HB LYS 4 5.907 -3.978 5.386
18 HB3 LYS 4 2HB LYS 4 7.198 -2.803 5.632
19 HG2 LYS 4 1HG LYS 4 5.897 -1.884 7.572
20 HG3 LYS 4 2HG LYS 4 4.766 -3.222 7.384
21 HD2 LYS 4 1HD LYS 4 6.615 -4.828 7.683
22 HD3 LYS 4 2HD LYS 4 7.733 -3.478 7.881
23 HE2 LYS 4 1HE LYS 4 6.483 -2.717 9.864
24 HE3 LYS 4 2HE LYS 4 5.352 -4.054 9.671
25 HZ1 LYS 4 3HZ LYS 4 8.264 -4.269 10.216
26 HZ2 LYS 4 1HZ LYS 4 7.238 -5.588 9.923
27 HZ3 LYS 4 2HZ LYS 4 7.003 -4.621 11.299
28 H GLU 5 H GLU 5 6.892 -0.436 3.676
29 HA GLU 5 HA GLU 5 6.223 -0.497 1.096
30 HB2 GLU 5 1HB GLU 5 8.278 0.582 2.071
31 HB3 GLU 5 2HB GLU 5 9.070 -0.988 1.970
32 HG2 GLU 5 1HG GLU 5 8.622 -1.058 -0.450
33 HG3 GLU 5 2HG GLU 5 7.854 0.522 -0.352
34 H GLY 6 H GLY 6 5.636 -2.039 -0.265
35 HA2 GLY 6 1HA GLY 6 5.990 -3.920 -1.626
36 HA3 GLY 6 2HA GLY 6 7.264 -4.451 -0.537
37 H GLU 7 H GLU 7 4.214 -3.489 0.847
38 HA GLU 7 HA GLU 7 3.765 -6.277 1.625
39 HB2 GLU 7 1HB GLU 7 3.026 -3.633 2.767
40 HB3 GLU 7 2HB GLU 7 1.948 -4.989 3.075
41 HG2 GLU 7 1HG GLU 7 4.931 -5.119 3.554
42 HG3 GLU 7 2HG GLU 7 3.768 -4.684 4.797
43 H VAL 8 H VAL 8 1.212 -3.931 1.540
44 HA VAL 8 HA VAL 8 0.004 -4.464 -0.895
45 HB VAL 8 HB VAL 8 -0.278 -6.732 -0.497
46 HG11 VAL 8 1HG1 VAL 8 -1.344 -7.343 1.878
47 HG12 VAL 8 2HG1 VAL 8 -0.524 -5.853 2.347
48 HG13 VAL 8 3HG1 VAL 8 0.399 -7.192 1.665
49 HG21 VAL 8 3HG2 VAL 8 -2.795 -5.723 0.815
50 HG22 VAL 8 1HG2 VAL 8 -2.605 -7.033 -0.351
51 HG23 VAL 8 2HG2 VAL 8 -2.449 -5.357 -0.875
52 H CYS 9 H CYS 9 -1.610 -3.045 -1.159
53 HA CYS 9 HA CYS 9 -3.190 -2.233 1.190
54 HB2 CYS 9 2HB CYS 9 -2.856 0.204 0.284
55 HB3 CYS 9 1HB CYS 9 -1.637 -0.512 1.343
56 H GLY 10 H GLY 10 -5.116 -0.977 0.601
57 HA2 GLY 10 1HA GLY 10 -6.709 -0.207 -0.993
58 HA3 GLY 10 2HA GLY 10 -5.917 -1.187 -2.223
59 H TRP 11 H TRP 11 -5.870 -3.284 0.138
60 HA TRP 11 HA TRP 11 -8.669 -4.040 0.089
61 HB2 TRP 11 2HB TRP 11 -6.532 -5.944 -0.802
62 HB3 TRP 11 1HB TRP 11 -8.265 -6.218 -0.781
63 HD1 TRP 11 1HD TRP 11 -5.595 -5.161 -3.001
64 HE1 TRP 11 1HE TRP 11 -6.531 -4.105 -5.146
65 HE3 TRP 11 3HE TRP 11 -10.345 -4.364 -1.493
66 HZ2 TRP 11 2HZ TRP 11 -9.024 -2.980 -6.078
67 HZ3 TRP 11 3HZ TRP 11 -12.006 -3.284 -2.996
68 HH2 TRP 11 2HH TRP 11 -11.347 -2.587 -5.289
69 H GLY 12 H GLY 12 -5.670 -3.870 1.582
70 HA2 GLY 12 1HA GLY 12 -6.686 -5.328 3.930
71 HA3 GLY 12 2HA GLY 12 -5.109 -5.771 3.285
72 H SER 13 H SER 13 -4.516 -2.979 2.511
73 HA SER 13 HA SER 13 -4.296 -1.666 5.132
74 HB2 SER 13 1HB SER 13 -2.218 -3.091 4.491
75 HB3 SER 13 2HB SER 13 -1.904 -1.810 3.325
76 HG SER 13 HG SER 13 -1.601 -0.400 4.929
77 H LYS 14 H LYS 14 -2.979 0.523 4.646
78 HA LYS 14 HA LYS 14 -3.840 1.709 2.119
79 HB2 LYS 14 1HB LYS 14 -4.963 3.583 3.263
80 HB3 LYS 14 2HB LYS 14 -5.766 2.049 3.601
81 HG2 LYS 14 1HG LYS 14 -4.540 1.890 5.749
82 HG3 LYS 14 2HG LYS 14 -3.771 3.442 5.418
83 HD2 LYS 14 1HD LYS 14 -5.979 4.533 5.354
84 HD3 LYS 14 2HD LYS 14 -6.754 2.983 5.687
85 HE2 LYS 14 1HE LYS 14 -5.558 2.828 7.830
86 HE3 LYS 14 2HE LYS 14 -4.754 4.363 7.503
87 HZ1 LYS 14 3HZ LYS 14 -6.503 5.424 8.306
88 HZ2 LYS 14 1HZ LYS 14 -7.256 3.946 8.662
89 HZ3 LYS 14 2HZ LYS 14 -7.519 4.692 7.158
90 H CYS 15 H CYS 15 -1.248 1.076 3.264
91 HA CYS 15 HA CYS 15 0.818 2.029 3.567
92 HB2 CYS 15 2HB CYS 15 -0.676 4.134 2.035
93 HB3 CYS 15 1HB CYS 15 0.941 4.438 2.593
94 H CYS 16 H CYS 16 1.808 2.761 5.303
95 HA CYS 16 HA CYS 16 0.512 3.766 7.516
96 HB2 CYS 16 2HB CYS 16 2.994 2.897 7.101
97 HB3 CYS 16 1HB CYS 16 3.315 4.632 7.081
98 H HIS 17 H HIS 17 2.664 5.686 5.425
99 HA HIS 17 HA HIS 17 0.853 7.847 5.171
100 HB2 HIS 17 1HB HIS 17 1.569 7.923 7.680
101 HB3 HIS 17 2HB HIS 17 3.091 8.545 7.051
102 HD1 HIS 17 HD1 HIS 17 -0.627 9.272 6.514
103 HD2 HIS 17 HD2 HIS 17 3.014 11.283 6.801
104 HE1 HIS 17 HE1 HIS 17 -1.154 11.741 6.312
105 H GLY 18 H GLY 18 4.065 6.621 5.198
106 HA2 GLY 18 1HA GLY 18 4.995 8.688 3.311
107 HA3 GLY 18 2HA GLY 18 6.016 7.511 4.129
108 H LEU 19 H LEU 19 3.311 5.943 3.026
109 HA LEU 19 HA LEU 19 4.657 5.110 0.533
110 HB2 LEU 19 1HB LEU 19 2.981 3.515 2.467
111 HB3 LEU 19 2HB LEU 19 3.528 2.911 0.915
112 HG LEU 19 HG LEU 19 5.387 3.958 3.063
113 HD11 LEU 19 1HD1 LEU 19 5.740 1.756 3.801
114 HD12 LEU 19 2HD1 LEU 19 5.039 1.059 2.344
115 HD13 LEU 19 3HD1 LEU 19 3.995 1.792 3.561
116 HD21 LEU 19 3HD2 LEU 19 5.710 3.057 0.294
117 HD22 LEU 19 1HD2 LEU 19 6.691 2.127 1.414
118 HD23 LEU 19 2HD2 LEU 19 6.864 3.878 1.347
119 H ASP 20 H ASP 20 3.282 4.457 -1.219
120 HA ASP 20 HA ASP 20 0.465 5.195 -1.066
121 HB2 ASP 20 1HB ASP 20 1.856 7.258 -1.686
122 HB3 ASP 20 2HB ASP 20 2.193 6.428 -3.205
123 H CYS 21 H CYS 21 -0.790 4.145 -2.571
124 HA CYS 21 HA CYS 21 0.470 2.664 -4.717
125 HB2 CYS 21 2HB CYS 21 -0.808 0.581 -3.932
126 HB3 CYS 21 1HB CYS 21 0.666 1.003 -3.093
127 HA PRO 22 HA PRO 22 -3.330 3.639 -6.713
128 HB2 PRO 22 2HB PRO 22 -3.403 1.646 -8.591
129 HB3 PRO 22 1HB PRO 22 -2.324 3.051 -8.693
130 HG2 PRO 22 2HG PRO 22 -1.726 0.275 -7.808
131 HG3 PRO 22 1HG PRO 22 -0.732 1.395 -8.742
132 HD2 PRO 22 2HD PRO 22 -0.362 0.881 -6.101
133 HD3 PRO 22 1HD PRO 22 0.104 2.403 -6.866
134 H LEU 23 H LEU 23 -5.452 2.636 -7.422
135 HA LEU 23 HA LEU 23 -6.351 0.854 -5.284
136 HB2 LEU 23 1HB LEU 23 -7.747 2.679 -7.228
137 HB3 LEU 23 2HB LEU 23 -8.647 1.456 -6.336
138 HG LEU 23 HG LEU 23 -8.624 3.685 -5.190
139 HD11 LEU 23 1HD1 LEU 23 -8.611 2.693 -3.139
140 HD12 LEU 23 2HD1 LEU 23 -6.972 2.074 -3.349
141 HD13 LEU 23 3HD1 LEU 23 -8.340 1.206 -4.046
142 HD21 LEU 23 3HD2 LEU 23 -6.618 4.661 -4.419
143 HD22 LEU 23 1HD2 LEU 23 -6.208 4.102 -6.040
144 HD23 LEU 23 2HD2 LEU 23 -5.707 3.166 -4.631
145 H ALA 24 H ALA 24 -4.781 -0.018 -7.674
146 HA ALA 24 HA ALA 24 -6.314 -1.399 -9.540
147 HB1 ALA 24 3HB ALA 24 -4.005 -1.334 -9.966
148 HB2 ALA 24 1HB ALA 24 -4.301 -3.022 -9.541
149 HB3 ALA 24 2HB ALA 24 -3.599 -1.922 -8.352
150 H PHE 25 H PHE 25 -5.816 -4.032 -9.463
151 HA PHE 25 HA PHE 25 -7.817 -5.023 -7.699
152 HB2 PHE 25 2HB PHE 25 -5.859 -6.891 -8.935
153 HB3 PHE 25 1HB PHE 25 -7.613 -6.980 -8.856
154 HD1 PHE 25 1HD PHE 25 -4.748 -5.809 -10.739
155 HD2 PHE 25 2HD PHE 25 -9.021 -5.571 -10.384
156 HE1 PHE 25 1HE PHE 25 -4.883 -4.860 -13.021
157 HE2 PHE 25 2HE PHE 25 -9.157 -4.618 -12.671
158 HZ PHE 25 HZ PHE 25 -7.087 -4.261 -13.990
159 H ILE 26 H ILE 26 -4.279 -5.178 -7.723
160 HA ILE 26 HA ILE 26 -4.332 -5.835 -4.860
161 HB ILE 26 HB ILE 26 -2.428 -7.484 -5.327
162 HG12 ILE 26 1HG1 ILE 26 -3.734 -7.489 -8.060
163 HG13 ILE 26 2HG1 ILE 26 -2.186 -6.716 -7.719
164 HG21 ILE 26 1HG2 ILE 26 -5.251 -8.112 -6.244
165 HG22 ILE 26 2HG2 ILE 26 -4.669 -8.169 -4.581
166 HG23 ILE 26 3HG2 ILE 26 -4.044 -9.309 -5.771
167 HD11 ILE 26 3HD1 ILE 26 -2.578 -9.383 -8.394
168 HD12 ILE 26 1HD1 ILE 26 -2.296 -9.411 -6.655
169 HD13 ILE 26 2HD1 ILE 26 -1.105 -8.679 -7.728
170 HA PRO 27 HA PRO 27 -1.290 -2.533 -6.125
171 HB2 PRO 27 2HB PRO 27 -2.436 -1.134 -3.811
172 HB3 PRO 27 1HB PRO 27 -2.238 -0.585 -5.485
173 HG2 PRO 27 2HG PRO 27 -4.651 -1.162 -4.455
174 HG3 PRO 27 1HG PRO 27 -4.256 -1.475 -6.149
175 HD2 PRO 27 2HD PRO 27 -4.360 -3.402 -3.872
176 HD3 PRO 27 1HD PRO 27 -4.923 -3.592 -5.539
177 H TYR 28 H TYR 28 0.554 -1.758 -4.950
178 HA TYR 28 HA TYR 28 1.062 -3.128 -2.386
179 HB2 TYR 28 2HB TYR 28 2.630 -3.199 -4.902
180 HB3 TYR 28 1HB TYR 28 3.540 -3.068 -3.396
181 HD1 TYR 28 1HD TYR 28 0.652 -4.980 -4.853
182 HD2 TYR 28 2HD TYR 28 4.040 -5.011 -2.220
183 HE1 TYR 28 1HE TYR 28 0.295 -7.390 -4.409
184 HE2 TYR 28 2HE TYR 28 3.694 -7.410 -1.786
185 HH TYR 28 HH TYR 28 1.964 -9.392 -3.647
186 H CYS 29 H CYS 29 1.569 -1.778 -0.807
187 HA CYS 29 HA CYS 29 1.728 0.982 -1.089
188 HB2 CYS 29 2HB CYS 29 2.345 -0.957 1.047
189 HB3 CYS 29 1HB CYS 29 3.116 0.619 1.192
190 H GLU 30 H GLU 30 3.141 1.677 -2.707
191 HA GLU 30 HA GLU 30 5.984 1.033 -2.357
192 HB2 GLU 30 1HB GLU 30 5.051 0.598 -4.565
193 HB3 GLU 30 2HB GLU 30 4.480 2.263 -4.678
194 HG2 GLU 30 1HG GLU 30 6.735 3.094 -4.585
195 HG3 GLU 30 2HG GLU 30 7.356 1.477 -4.280
196 H LYS 31 H LYS 31 7.485 2.625 -1.914
197 HA LYS 31 HA LYS 31 6.644 5.005 -0.669
198 HB2 LYS 31 1HB LYS 31 8.776 3.838 -0.181
199 HB3 LYS 31 2HB LYS 31 9.356 4.264 -1.790
200 HG2 LYS 31 1HG LYS 31 9.124 6.639 -1.265
201 HG3 LYS 31 2HG LYS 31 8.513 6.240 0.339
202 HD2 LYS 31 1HD LYS 31 10.643 5.118 0.875
203 HD3 LYS 31 2HD LYS 31 11.256 5.512 -0.734
204 HE2 LYS 31 1HE LYS 31 10.986 7.905 -0.258
205 HE3 LYS 31 2HE LYS 31 10.368 7.518 1.346
206 HZ1 LYS 31 3HZ LYS 31 12.749 6.137 1.084
207 HZ2 LYS 31 1HZ LYS 31 12.461 7.503 2.049
208 HZ3 LYS 31 2HZ LYS 31 13.058 7.692 0.471
209 H TYR 32 H TYR 32 6.205 6.953 -1.477
210 HA TYR 32 HA TYR 32 6.844 7.468 -4.322
211 HB2 TYR 32 2HB TYR 32 4.383 7.169 -3.657
212 HB3 TYR 32 1HB TYR 32 4.551 8.707 -2.811
213 HD1 TYR 32 1HD TYR 32 4.376 7.047 -6.051
214 HD2 TYR 32 2HD TYR 32 5.086 10.787 -4.066
215 HE1 TYR 32 1HE TYR 32 4.094 8.245 -8.209
216 HE2 TYR 32 2HE TYR 32 4.800 11.987 -6.219
217 HH TYR 32 HH TYR 32 3.394 10.659 -8.891
218 H ARG 33 H ARG 33 8.301 9.026 -4.581
219 HA ARG 33 HA ARG 33 9.155 10.720 -2.444
220 HB2 ARG 33 1HB ARG 33 9.749 10.742 -5.409
221 HB3 ARG 33 2HB ARG 33 10.523 11.817 -4.245
222 HG2 ARG 33 1HG ARG 33 11.460 9.941 -3.037
223 HG3 ARG 33 2HG ARG 33 10.544 8.796 -4.017
224 HD2 ARG 33 1HD ARG 33 12.591 10.717 -5.152
225 HD3 ARG 33 2HD ARG 33 12.955 9.051 -4.712
226 HE ARG 33 HE ARG 33 10.746 8.974 -6.418
227 HH11 ARG 33 1HH1 ARG 33 11.034 8.546 -8.630
228 HH12 ARG 33 2HH1 ARG 33 12.569 8.852 -9.373
229 HH21 ARG 33 2HH2 ARG 33 14.278 9.670 -8.140
230 HH22 ARG 33 1HH2 ARG 33 14.054 9.992 -6.454
Start of MODEL 14
1 HA ASN 1 HA ASN 1 -0.723 -2.195 12.451
2 HB2 ASN 1 1HB ASN 1 1.064 0.245 12.519
3 HB3 ASN 1 2HB ASN 1 -0.694 0.349 12.519
4 HD21 ASN 1 1HD2 ASN 1 0.558 0.258 16.072
5 HD22 ASN 1 2HD2 ASN 1 0.897 1.262 14.747
6 H CYS 2 H CYS 2 1.137 0.140 10.514
7 HA CYS 2 HA CYS 2 -0.718 -0.067 8.331
8 HB2 CYS 2 2HB CYS 2 0.559 1.673 7.334
9 HB3 CYS 2 1HB CYS 2 0.454 2.047 9.048
10 H ALA 3 H ALA 3 0.594 -0.003 6.056
11 HA ALA 3 HA ALA 3 1.801 -2.670 5.901
12 HB1 ALA 3 3HB ALA 3 0.420 -2.703 4.110
13 HB2 ALA 3 1HB ALA 3 1.680 -1.743 3.325
14 HB3 ALA 3 2HB ALA 3 0.289 -0.943 4.069
15 H LYS 4 H LYS 4 3.904 -2.958 5.661
16 HA LYS 4 HA LYS 4 5.660 -0.669 5.353
17 HB2 LYS 4 1HB LYS 4 6.224 -3.622 5.631
18 HB3 LYS 4 2HB LYS 4 7.454 -2.356 5.590
19 HG2 LYS 4 1HG LYS 4 6.379 -1.278 7.552
20 HG3 LYS 4 2HG LYS 4 5.215 -2.605 7.618
21 HD2 LYS 4 1HD LYS 4 7.063 -4.210 7.908
22 HD3 LYS 4 2HD LYS 4 8.210 -2.872 7.845
23 HE2 LYS 4 1HE LYS 4 7.182 -1.877 9.847
24 HE3 LYS 4 2HE LYS 4 6.013 -3.195 9.909
25 HZ1 LYS 4 3HZ LYS 4 8.130 -3.341 11.337
26 HZ2 LYS 4 1HZ LYS 4 8.903 -3.765 9.889
27 HZ3 LYS 4 2HZ LYS 4 7.627 -4.719 10.480
28 H GLU 5 H GLU 5 6.931 -0.253 3.613
29 HA GLU 5 HA GLU 5 6.071 -0.521 1.086
30 HB2 GLU 5 1HB GLU 5 8.048 0.824 1.838
31 HB3 GLU 5 2HB GLU 5 8.993 -0.663 1.873
32 HG2 GLU 5 1HG GLU 5 8.542 -1.024 -0.507
33 HG3 GLU 5 2HG GLU 5 7.568 0.443 -0.558
34 H GLY 6 H GLY 6 5.774 -2.140 -0.312
35 HA2 GLY 6 1HA GLY 6 6.512 -4.088 -1.500
36 HA3 GLY 6 2HA GLY 6 7.398 -4.587 -0.062
37 H GLU 7 H GLU 7 4.581 -3.477 1.124
38 HA GLU 7 HA GLU 7 3.430 -6.176 1.243
39 HB2 GLU 7 1HB GLU 7 2.941 -3.697 2.905
40 HB3 GLU 7 2HB GLU 7 2.048 -5.207 3.100
41 HG2 GLU 7 1HG GLU 7 5.069 -5.046 3.228
42 HG3 GLU 7 2HG GLU 7 4.038 -4.935 4.651
43 H VAL 8 H VAL 8 1.217 -6.557 0.829
44 HA VAL 8 HA VAL 8 0.160 -5.075 -1.383
45 HB VAL 8 HB VAL 8 -1.636 -6.676 -1.373
46 HG11 VAL 8 1HG1 VAL 8 -0.075 -8.032 -2.274
47 HG12 VAL 8 2HG1 VAL 8 0.042 -8.787 -0.687
48 HG13 VAL 8 3HG1 VAL 8 1.157 -7.502 -1.134
49 HG21 VAL 8 3HG2 VAL 8 -0.661 -7.230 1.432
50 HG22 VAL 8 1HG2 VAL 8 -1.669 -8.380 0.556
51 HG23 VAL 8 2HG2 VAL 8 -2.282 -6.766 0.915
52 H CYS 9 H CYS 9 -1.375 -3.481 -1.414
53 HA CYS 9 HA CYS 9 -3.050 -3.064 0.942
54 HB2 CYS 9 2HB CYS 9 -2.289 -0.539 0.689
55 HB3 CYS 9 1HB CYS 9 -1.367 -1.665 1.680
56 H GLY 10 H GLY 10 -4.535 -1.087 0.490
57 HA2 GLY 10 1HA GLY 10 -5.659 0.259 -1.171
58 HA3 GLY 10 2HA GLY 10 -5.206 -0.931 -2.381
59 H TRP 11 H TRP 11 -5.931 -3.017 -0.197
60 HA TRP 11 HA TRP 11 -8.840 -2.775 -0.353
61 HB2 TRP 11 2HB TRP 11 -7.379 -5.302 -1.038
62 HB3 TRP 11 1HB TRP 11 -9.101 -4.995 -1.166
63 HD1 TRP 11 1HD TRP 11 -6.069 -4.956 -3.152
64 HE1 TRP 11 1HE TRP 11 -6.403 -3.675 -5.367
65 HE3 TRP 11 3HE TRP 11 -10.395 -2.594 -2.075
66 HZ2 TRP 11 2HZ TRP 11 -8.299 -1.847 -6.516
67 HZ3 TRP 11 3HZ TRP 11 -11.474 -1.071 -3.725
68 HH2 TRP 11 2HH TRP 11 -10.424 -0.695 -5.940
69 H GLY 12 H GLY 12 -6.075 -3.469 1.402
70 HA2 GLY 12 1HA GLY 12 -7.695 -4.472 3.646
71 HA3 GLY 12 2HA GLY 12 -6.242 -5.354 3.188
72 H SER 13 H SER 13 -4.865 -2.841 2.421
73 HA SER 13 HA SER 13 -4.446 -1.636 5.080
74 HB2 SER 13 1HB SER 13 -2.438 -2.899 3.272
75 HB3 SER 13 2HB SER 13 -1.957 -1.552 4.301
76 HG SER 13 HG SER 13 -2.913 -2.786 6.054
77 H LYS 14 H LYS 14 -3.676 0.507 5.091
78 HA LYS 14 HA LYS 14 -4.029 1.940 2.534
79 HB2 LYS 14 1HB LYS 14 -4.683 2.814 5.360
80 HB3 LYS 14 2HB LYS 14 -4.734 3.866 3.948
81 HG2 LYS 14 1HG LYS 14 -6.454 2.513 2.918
82 HG3 LYS 14 2HG LYS 14 -6.300 1.284 4.171
83 HD2 LYS 14 1HD LYS 14 -8.248 2.583 4.709
84 HD3 LYS 14 2HD LYS 14 -6.990 3.047 5.853
85 HE2 LYS 14 1HE LYS 14 -6.531 5.079 4.640
86 HE3 LYS 14 2HE LYS 14 -7.554 4.574 3.296
87 HZ1 LYS 14 3HZ LYS 14 -9.109 5.756 4.359
88 HZ2 LYS 14 1HZ LYS 14 -8.275 5.741 5.834
89 HZ3 LYS 14 2HZ LYS 14 -9.230 4.409 5.387
90 H CYS 15 H CYS 15 -1.568 0.777 3.865
91 HA CYS 15 HA CYS 15 0.608 1.372 4.244
92 HB2 CYS 15 2HB CYS 15 -0.347 3.658 2.534
93 HB3 CYS 15 1HB CYS 15 1.320 3.450 3.020
94 H CYS 16 H CYS 16 2.044 2.903 5.331
95 HA CYS 16 HA CYS 16 0.912 3.936 7.708
96 HB2 CYS 16 2HB CYS 16 3.560 3.652 6.553
97 HB3 CYS 16 1HB CYS 16 3.384 5.172 7.429
98 H HIS 17 H HIS 17 2.582 5.749 5.124
99 HA HIS 17 HA HIS 17 0.705 7.683 4.611
100 HB2 HIS 17 1HB HIS 17 1.947 8.062 7.252
101 HB3 HIS 17 2HB HIS 17 2.016 9.480 6.209
102 HD1 HIS 17 HD1 HIS 17 -0.517 9.772 4.875
103 HD2 HIS 17 HD2 HIS 17 -0.389 8.112 8.696
104 HE1 HIS 17 HE1 HIS 17 -2.837 10.047 5.854
105 H GLY 18 H GLY 18 3.956 6.756 5.033
106 HA2 GLY 18 1HA GLY 18 4.985 8.960 3.384
107 HA3 GLY 18 2HA GLY 18 5.956 7.756 4.228
108 H LEU 19 H LEU 19 3.420 6.192 2.802
109 HA LEU 19 HA LEU 19 4.973 5.589 0.374
110 HB2 LEU 19 1HB LEU 19 3.376 3.784 2.174
111 HB3 LEU 19 2HB LEU 19 3.930 3.298 0.583
112 HG LEU 19 HG LEU 19 5.883 4.383 2.604
113 HD11 LEU 19 1HD1 LEU 19 4.555 2.437 3.603
114 HD12 LEU 19 2HD1 LEU 19 6.287 2.162 3.447
115 HD13 LEU 19 3HD1 LEU 19 5.178 1.452 2.278
116 HD21 LEU 19 3HD2 LEU 19 6.497 2.161 0.747
117 HD22 LEU 19 1HD2 LEU 19 7.451 3.589 1.141
118 HD23 LEU 19 2HD2 LEU 19 6.134 3.699 -0.022
119 H ASP 20 H ASP 20 3.135 3.989 -0.887
120 HA ASP 20 HA ASP 20 0.568 5.337 -0.996
121 HB2 ASP 20 1HB ASP 20 2.295 6.648 -2.425
122 HB3 ASP 20 2HB ASP 20 2.180 5.283 -3.533
123 H CYS 21 H CYS 21 -1.006 4.117 -2.066
124 HA CYS 21 HA CYS 21 -0.154 1.615 -3.344
125 HB2 CYS 21 2HB CYS 21 -0.841 1.476 -0.767
126 HB3 CYS 21 1HB CYS 21 -2.440 1.353 -1.487
127 HA PRO 22 HA PRO 22 -3.373 3.678 -5.887
128 HB2 PRO 22 2HB PRO 22 -2.420 1.663 -7.845
129 HB3 PRO 22 1HB PRO 22 -2.538 3.425 -8.011
130 HG2 PRO 22 2HG PRO 22 -0.185 2.197 -7.744
131 HG3 PRO 22 1HG PRO 22 -0.489 3.785 -7.037
132 HD2 PRO 22 2HD PRO 22 -0.379 1.111 -5.707
133 HD3 PRO 22 1HD PRO 22 0.194 2.692 -5.154
134 H LEU 23 H LEU 23 -5.409 2.979 -6.624
135 HA LEU 23 HA LEU 23 -6.323 0.481 -5.480
136 HB2 LEU 23 1HB LEU 23 -7.559 2.918 -6.652
137 HB3 LEU 23 2HB LEU 23 -8.486 1.422 -6.758
138 HG LEU 23 HG LEU 23 -8.450 1.132 -4.370
139 HD11 LEU 23 1HD1 LEU 23 -6.361 1.734 -3.541
140 HD12 LEU 23 2HD1 LEU 23 -7.294 3.153 -3.075
141 HD13 LEU 23 3HD1 LEU 23 -6.288 3.201 -4.518
142 HD21 LEU 23 3HD2 LEU 23 -9.800 2.940 -3.742
143 HD22 LEU 23 1HD2 LEU 23 -9.895 2.998 -5.505
144 HD23 LEU 23 2HD2 LEU 23 -8.819 4.100 -4.643
145 H ALA 24 H ALA 24 -5.548 -1.196 -6.605
146 HA ALA 24 HA ALA 24 -6.494 -1.560 -9.353
147 HB1 ALA 24 3HB ALA 24 -3.645 -2.206 -8.672
148 HB2 ALA 24 1HB ALA 24 -4.088 -0.601 -9.271
149 HB3 ALA 24 2HB ALA 24 -4.390 -2.029 -10.268
150 H PHE 25 H PHE 25 -4.617 -3.769 -9.698
151 HA PHE 25 HA PHE 25 -6.082 -5.803 -8.196
152 HB2 PHE 25 2HB PHE 25 -5.615 -5.947 -10.692
153 HB3 PHE 25 1HB PHE 25 -3.937 -6.248 -10.262
154 HD1 PHE 25 1HD PHE 25 -7.377 -7.394 -9.346
155 HD2 PHE 25 2HD PHE 25 -3.269 -8.473 -9.960
156 HE1 PHE 25 1HE PHE 25 -7.941 -9.769 -8.929
157 HE2 PHE 25 2HE PHE 25 -3.827 -10.851 -9.533
158 HZ PHE 25 HZ PHE 25 -6.166 -11.500 -9.019
159 H ILE 26 H ILE 26 -5.344 -6.225 -6.336
160 HA ILE 26 HA ILE 26 -3.974 -6.340 -4.492
161 HB ILE 26 HB ILE 26 -3.747 -8.551 -5.490
162 HG12 ILE 26 1HG1 ILE 26 -1.176 -8.836 -4.696
163 HG13 ILE 26 2HG1 ILE 26 -1.570 -7.298 -3.936
164 HG21 ILE 26 1HG2 ILE 26 -2.890 -8.170 -7.657
165 HG22 ILE 26 2HG2 ILE 26 -1.647 -9.070 -6.801
166 HG23 ILE 26 3HG2 ILE 26 -1.463 -7.346 -7.049
167 HD11 ILE 26 3HD1 ILE 26 -3.742 -8.487 -3.156
168 HD12 ILE 26 1HD1 ILE 26 -2.235 -8.873 -2.328
169 HD13 ILE 26 2HD1 ILE 26 -2.881 -9.978 -3.539
170 HA PRO 27 HA PRO 27 -1.126 -2.988 -6.212
171 HB2 PRO 27 2HB PRO 27 -2.390 -1.473 -4.024
172 HB3 PRO 27 1HB PRO 27 -2.104 -1.000 -5.701
173 HG2 PRO 27 2HG PRO 27 -4.539 -1.565 -4.768
174 HG3 PRO 27 1HG PRO 27 -4.040 -1.966 -6.418
175 HD2 PRO 27 2HD PRO 27 -4.321 -3.759 -4.065
176 HD3 PRO 27 1HD PRO 27 -4.693 -4.069 -5.756
177 H TYR 28 H TYR 28 0.683 -2.045 -5.061
178 HA TYR 28 HA TYR 28 1.192 -3.328 -2.442
179 HB2 TYR 28 2HB TYR 28 2.819 -3.204 -4.918
180 HB3 TYR 28 1HB TYR 28 3.679 -3.028 -3.391
181 HD1 TYR 28 1HD TYR 28 0.865 -5.172 -4.738
182 HD2 TYR 28 2HD TYR 28 4.525 -5.005 -2.494
183 HE1 TYR 28 1HE TYR 28 0.771 -7.607 -4.417
184 HE2 TYR 28 2HE TYR 28 4.425 -7.459 -2.173
185 HH TYR 28 HH TYR 28 2.415 -9.236 -2.161
186 H CYS 29 H CYS 29 2.359 -2.154 -0.912
187 HA CYS 29 HA CYS 29 1.940 0.677 -1.003
188 HB2 CYS 29 2HB CYS 29 1.972 -0.937 1.057
189 HB3 CYS 29 1HB CYS 29 3.717 -0.718 0.981
190 H GLU 30 H GLU 30 3.166 1.847 -2.381
191 HA GLU 30 HA GLU 30 6.100 1.501 -2.234
192 HB2 GLU 30 1HB GLU 30 4.409 2.011 -4.689
193 HB3 GLU 30 2HB GLU 30 6.169 2.126 -4.652
194 HG2 GLU 30 1HG GLU 30 6.319 -0.220 -3.943
195 HG3 GLU 30 2HG GLU 30 4.562 -0.344 -3.948
196 H LYS 31 H LYS 31 7.328 3.361 -2.310
197 HA LYS 31 HA LYS 31 5.860 5.838 -1.741
198 HB2 LYS 31 1HB LYS 31 8.308 6.622 -1.277
199 HB3 LYS 31 2HB LYS 31 7.506 5.570 -0.116
200 HG2 LYS 31 1HG LYS 31 8.602 3.613 -1.043
201 HG3 LYS 31 2HG LYS 31 9.293 4.573 -2.352
202 HD2 LYS 31 1HD LYS 31 9.847 5.397 0.476
203 HD3 LYS 31 2HD LYS 31 10.725 4.018 -0.189
204 HE2 LYS 31 1HE LYS 31 11.443 5.427 -2.108
205 HE3 LYS 31 2HE LYS 31 10.617 6.806 -1.386
206 HZ1 LYS 31 3HZ LYS 31 13.076 5.473 -0.564
207 HZ2 LYS 31 1HZ LYS 31 12.072 6.067 0.668
208 HZ3 LYS 31 2HZ LYS 31 12.667 7.121 -0.524
209 H TYR 32 H TYR 32 6.191 7.729 -2.841
210 HA TYR 32 HA TYR 32 7.734 7.590 -5.354
211 HB2 TYR 32 2HB TYR 32 4.927 8.673 -5.027
212 HB3 TYR 32 1HB TYR 32 5.923 8.892 -6.467
213 HD1 TYR 32 1HD TYR 32 4.016 6.477 -4.444
214 HD2 TYR 32 2HD TYR 32 6.495 7.004 -7.914
215 HE1 TYR 32 1HE TYR 32 3.338 4.238 -5.272
216 HE2 TYR 32 2HE TYR 32 5.817 4.765 -8.738
217 HH TYR 32 HH TYR 32 3.524 3.237 -8.228
218 H ARG 33 H ARG 33 8.602 9.548 -6.085
219 HA ARG 33 HA ARG 33 9.885 11.414 -5.601
220 HB2 ARG 33 1HB ARG 33 7.091 12.382 -4.968
221 HB3 ARG 33 2HB ARG 33 8.468 13.389 -5.407
222 HG2 ARG 33 1HG ARG 33 8.642 12.058 -7.550
223 HG3 ARG 33 2HG ARG 33 7.100 11.315 -7.128
224 HD2 ARG 33 1HD ARG 33 7.588 14.284 -7.471
225 HD3 ARG 33 2HD ARG 33 6.775 13.237 -8.628
226 HE ARG 33 HE ARG 33 5.692 14.209 -6.101
227 HH11 ARG 33 1HH1 ARG 33 3.480 13.807 -5.808
228 HH12 ARG 33 2HH1 ARG 33 2.653 12.719 -6.873
229 HH21 ARG 33 2HH2 ARG 33 3.780 11.704 -8.549
230 HH22 ARG 33 1HH2 ARG 33 5.469 12.011 -8.768
Start of MODEL 15
1 HA ASN 1 HA ASN 1 -0.867 -0.781 12.232
2 HB2 ASN 1 1HB ASN 1 0.692 -3.305 11.617
3 HB3 ASN 1 2HB ASN 1 1.403 -1.694 11.562
4 HD21 ASN 1 1HD2 ASN 1 1.853 -3.206 15.001
5 HD22 ASN 1 2HD2 ASN 1 2.225 -3.768 13.443
6 H CYS 2 H CYS 2 0.412 0.106 10.330
7 HA CYS 2 HA CYS 2 -1.166 -0.103 7.950
8 HB2 CYS 2 2HB CYS 2 0.303 1.629 7.102
9 HB3 CYS 2 1HB CYS 2 -0.205 2.037 8.737
10 H ALA 3 H ALA 3 0.117 -0.171 5.808
11 HA ALA 3 HA ALA 3 1.401 -2.762 5.671
12 HB1 ALA 3 3HB ALA 3 1.655 -1.874 3.175
13 HB2 ALA 3 1HB ALA 3 0.415 -0.741 3.714
14 HB3 ALA 3 2HB ALA 3 0.110 -2.477 3.786
15 H LYS 4 H LYS 4 3.528 -3.171 4.993
16 HA LYS 4 HA LYS 4 5.378 -0.931 5.306
17 HB2 LYS 4 1HB LYS 4 6.036 -2.469 6.883
18 HB3 LYS 4 2HB LYS 4 5.436 -3.841 5.952
19 HG2 LYS 4 1HG LYS 4 7.273 -3.858 4.531
20 HG3 LYS 4 2HG LYS 4 7.715 -2.205 4.923
21 HD2 LYS 4 1HD LYS 4 9.322 -3.609 6.011
22 HD3 LYS 4 2HD LYS 4 8.247 -2.992 7.263
23 HE2 LYS 4 1HE LYS 4 8.657 -5.414 7.544
24 HE3 LYS 4 2HE LYS 4 6.958 -5.099 7.196
25 HZ1 LYS 4 3HZ LYS 4 7.098 -6.076 5.191
26 HZ2 LYS 4 1HZ LYS 4 8.433 -6.871 5.869
27 HZ3 LYS 4 2HZ LYS 4 8.668 -5.504 4.888
28 H GLU 5 H GLU 5 6.802 -0.488 3.695
29 HA GLU 5 HA GLU 5 6.329 -0.701 1.091
30 HB2 GLU 5 1HB GLU 5 8.260 0.500 2.098
31 HB3 GLU 5 2HB GLU 5 9.086 -1.047 2.290
32 HG2 GLU 5 1HG GLU 5 8.985 -1.415 -0.130
33 HG3 GLU 5 2HG GLU 5 8.131 0.107 -0.337
34 H GLY 6 H GLY 6 5.896 -2.329 -0.240
35 HA2 GLY 6 1HA GLY 6 6.576 -4.297 -1.431
36 HA3 GLY 6 2HA GLY 6 7.463 -4.821 -0.006
37 H GLU 7 H GLU 7 4.457 -3.558 0.831
38 HA GLU 7 HA GLU 7 3.313 -6.272 1.078
39 HB2 GLU 7 1HB GLU 7 2.922 -3.785 2.739
40 HB3 GLU 7 2HB GLU 7 1.902 -5.216 2.888
41 HG2 GLU 7 1HG GLU 7 4.916 -5.328 3.099
42 HG3 GLU 7 2HG GLU 7 3.870 -5.100 4.499
43 H VAL 8 H VAL 8 1.060 -6.548 0.698
44 HA VAL 8 HA VAL 8 0.073 -4.931 -1.490
45 HB VAL 8 HB VAL 8 -0.264 -7.267 -1.718
46 HG11 VAL 8 1HG1 VAL 8 -2.020 -8.021 0.334
47 HG12 VAL 8 2HG1 VAL 8 -0.764 -7.085 1.144
48 HG13 VAL 8 3HG1 VAL 8 -0.330 -8.496 0.179
49 HG21 VAL 8 3HG2 VAL 8 -2.973 -6.405 -0.750
50 HG22 VAL 8 1HG2 VAL 8 -2.548 -7.309 -2.203
51 HG23 VAL 8 2HG2 VAL 8 -2.238 -5.575 -2.122
52 H CYS 9 H CYS 9 -1.550 -3.437 -1.450
53 HA CYS 9 HA CYS 9 -3.013 -3.113 1.122
54 HB2 CYS 9 2HB CYS 9 -2.922 -0.610 0.460
55 HB3 CYS 9 1HB CYS 9 -1.472 -1.341 1.158
56 H GLY 10 H GLY 10 -4.810 -1.255 0.554
57 HA2 GLY 10 1HA GLY 10 -6.638 -0.639 -0.757
58 HA3 GLY 10 2HA GLY 10 -6.001 -1.627 -2.067
59 H TRP 11 H TRP 11 -5.814 -3.577 0.488
60 HA TRP 11 HA TRP 11 -8.592 -4.371 0.451
61 HB2 TRP 11 2HB TRP 11 -6.400 -6.312 -0.164
62 HB3 TRP 11 1HB TRP 11 -8.124 -6.619 -0.164
63 HD1 TRP 11 1HD TRP 11 -5.392 -5.657 -2.408
64 HE1 TRP 11 1HE TRP 11 -6.325 -4.889 -4.684
65 HE3 TRP 11 3HE TRP 11 -10.243 -4.977 -1.133
66 HZ2 TRP 11 2HZ TRP 11 -8.834 -4.068 -5.803
67 HZ3 TRP 11 3HZ TRP 11 -11.908 -4.185 -2.807
68 HH2 TRP 11 2HH TRP 11 -11.200 -3.723 -5.139
69 H GLY 12 H GLY 12 -6.274 -3.412 2.294
70 HA2 GLY 12 1HA GLY 12 -7.219 -4.529 4.687
71 HA3 GLY 12 2HA GLY 12 -5.789 -5.436 4.201
72 H SER 13 H SER 13 -4.939 -2.792 2.833
73 HA SER 13 HA SER 13 -4.183 -1.226 5.184
74 HB2 SER 13 1HB SER 13 -2.240 -2.531 3.295
75 HB3 SER 13 2HB SER 13 -1.811 -1.168 4.316
76 HG SER 13 HG SER 13 -2.837 -3.685 5.151
77 H LYS 14 H LYS 14 -3.203 0.863 4.616
78 HA LYS 14 HA LYS 14 -3.754 1.756 1.881
79 HB2 LYS 14 1HB LYS 14 -4.835 3.025 4.403
80 HB3 LYS 14 2HB LYS 14 -4.850 3.792 2.820
81 HG2 LYS 14 1HG LYS 14 -6.173 1.917 1.914
82 HG3 LYS 14 2HG LYS 14 -6.161 1.149 3.501
83 HD2 LYS 14 1HD LYS 14 -7.319 3.117 4.455
84 HD3 LYS 14 2HD LYS 14 -7.365 3.854 2.852
85 HE2 LYS 14 1HE LYS 14 -8.614 1.186 3.572
86 HE3 LYS 14 2HE LYS 14 -9.497 2.704 3.401
87 HZ1 LYS 14 3HZ LYS 14 -8.518 0.929 1.380
88 HZ2 LYS 14 1HZ LYS 14 -8.032 2.532 1.115
89 HZ3 LYS 14 2HZ LYS 14 -9.683 2.161 1.268
90 H CYS 15 H CYS 15 -1.243 1.214 3.098
91 HA CYS 15 HA CYS 15 0.829 2.151 3.416
92 HB2 CYS 15 2HB CYS 15 -0.606 4.203 1.771
93 HB3 CYS 15 1HB CYS 15 0.976 4.564 2.423
94 H CYS 16 H CYS 16 1.788 2.924 5.176
95 HA CYS 16 HA CYS 16 0.439 3.929 7.352
96 HB2 CYS 16 2HB CYS 16 3.279 4.717 6.784
97 HB3 CYS 16 1HB CYS 16 2.530 4.359 8.338
98 H HIS 17 H HIS 17 2.296 5.821 4.990
99 HA HIS 17 HA HIS 17 0.552 7.922 4.724
100 HB2 HIS 17 1HB HIS 17 2.002 8.015 7.273
101 HB3 HIS 17 2HB HIS 17 2.139 9.490 6.318
102 HD1 HIS 17 HD1 HIS 17 -0.431 10.089 5.175
103 HD2 HIS 17 HD2 HIS 17 -0.240 8.172 8.872
104 HE1 HIS 17 HE1 HIS 17 -2.665 10.479 6.302
105 H GLY 18 H GLY 18 3.807 6.859 5.031
106 HA2 GLY 18 1HA GLY 18 4.792 8.945 3.193
107 HA3 GLY 18 2HA GLY 18 5.794 7.821 4.105
108 H LEU 19 H LEU 19 3.251 6.126 2.841
109 HA LEU 19 HA LEU 19 4.801 5.306 0.468
110 HB2 LEU 19 1HB LEU 19 3.082 3.687 2.345
111 HB3 LEU 19 2HB LEU 19 3.709 3.070 0.822
112 HG LEU 19 HG LEU 19 5.504 4.251 2.956
113 HD11 LEU 19 1HD1 LEU 19 4.183 2.263 3.795
114 HD12 LEU 19 2HD1 LEU 19 5.929 2.017 3.757
115 HD13 LEU 19 3HD1 LEU 19 4.914 1.320 2.497
116 HD21 LEU 19 3HD2 LEU 19 7.077 2.557 1.710
117 HD22 LEU 19 1HD2 LEU 19 6.742 4.117 0.959
118 HD23 LEU 19 2HD2 LEU 19 5.892 2.670 0.412
119 H ASP 20 H ASP 20 3.633 4.701 -1.377
120 HA ASP 20 HA ASP 20 0.935 5.889 -1.548
121 HB2 ASP 20 1HB ASP 20 2.788 6.882 -2.955
122 HB3 ASP 20 2HB ASP 20 2.827 5.349 -3.826
123 H CYS 21 H CYS 21 -0.731 4.638 -2.173
124 HA CYS 21 HA CYS 21 -0.124 1.941 -3.200
125 HB2 CYS 21 2HB CYS 21 -0.781 1.740 -0.867
126 HB3 CYS 21 1HB CYS 21 -2.250 2.660 -1.199
127 HA PRO 22 HA PRO 22 -2.872 3.842 -6.353
128 HB2 PRO 22 2HB PRO 22 -2.042 1.376 -7.780
129 HB3 PRO 22 1HB PRO 22 -1.961 3.065 -8.313
130 HG2 PRO 22 2HG PRO 22 0.225 1.707 -7.601
131 HG3 PRO 22 1HG PRO 22 0.051 3.433 -7.277
132 HD2 PRO 22 2HD PRO 22 -0.160 1.132 -5.392
133 HD3 PRO 22 1HD PRO 22 0.478 2.769 -5.150
134 H LEU 23 H LEU 23 -4.924 3.235 -7.132
135 HA LEU 23 HA LEU 23 -6.126 1.011 -5.670
136 HB2 LEU 23 1HB LEU 23 -7.239 3.381 -7.175
137 HB3 LEU 23 2HB LEU 23 -8.273 2.060 -6.635
138 HG LEU 23 HG LEU 23 -8.211 3.944 -5.003
139 HD11 LEU 23 1HD1 LEU 23 -8.137 1.282 -4.432
140 HD12 LEU 23 2HD1 LEU 23 -8.316 2.538 -3.208
141 HD13 LEU 23 3HD1 LEU 23 -6.727 1.840 -3.529
142 HD21 LEU 23 3HD2 LEU 23 -6.231 4.643 -3.955
143 HD22 LEU 23 1HD2 LEU 23 -5.726 4.404 -5.628
144 HD23 LEU 23 2HD2 LEU 23 -5.359 3.180 -4.413
145 H ALA 24 H ALA 24 -5.768 -0.847 -6.689
146 HA ALA 24 HA ALA 24 -6.851 -1.118 -9.408
147 HB1 ALA 24 3HB ALA 24 -4.443 -0.881 -9.707
148 HB2 ALA 24 1HB ALA 24 -4.927 -2.544 -10.045
149 HB3 ALA 24 2HB ALA 24 -4.143 -2.147 -8.510
150 H PHE 25 H PHE 25 -5.224 -3.858 -8.846
151 HA PHE 25 HA PHE 25 -7.479 -5.142 -7.407
152 HB2 PHE 25 2HB PHE 25 -5.820 -6.739 -9.282
153 HB3 PHE 25 1HB PHE 25 -7.542 -6.839 -8.934
154 HD1 PHE 25 1HD PHE 25 -5.034 -5.559 -11.156
155 HD2 PHE 25 2HD PHE 25 -9.069 -4.964 -9.809
156 HE1 PHE 25 1HE PHE 25 -5.509 -4.214 -13.179
157 HE2 PHE 25 2HE PHE 25 -9.545 -3.616 -11.837
158 HZ PHE 25 HZ PHE 25 -7.765 -3.241 -13.523
159 H ILE 26 H ILE 26 -4.017 -5.192 -8.112
160 HA ILE 26 HA ILE 26 -3.544 -6.503 -5.510
161 HB ILE 26 HB ILE 26 -1.468 -7.512 -6.811
162 HG12 ILE 26 1HG1 ILE 26 -2.089 -8.168 -9.111
163 HG13 ILE 26 2HG1 ILE 26 -3.569 -7.230 -8.989
164 HG21 ILE 26 1HG2 ILE 26 -2.892 -9.533 -7.290
165 HG22 ILE 26 2HG2 ILE 26 -4.302 -8.560 -6.874
166 HG23 ILE 26 3HG2 ILE 26 -3.066 -8.886 -5.658
167 HD11 ILE 26 3HD1 ILE 26 -2.326 -5.163 -8.811
168 HD12 ILE 26 1HD1 ILE 26 -1.698 -6.052 -10.196
169 HD13 ILE 26 2HD1 ILE 26 -0.801 -6.040 -8.682
170 HA PRO 27 HA PRO 27 -1.035 -2.607 -6.394
171 HB2 PRO 27 2HB PRO 27 -2.144 -1.026 -4.473
172 HB3 PRO 27 1HB PRO 27 -2.740 -1.118 -6.139
173 HG2 PRO 27 2HG PRO 27 -3.780 -2.407 -3.689
174 HG3 PRO 27 1HG PRO 27 -4.666 -1.691 -5.037
175 HD2 PRO 27 2HD PRO 27 -4.331 -4.387 -4.764
176 HD3 PRO 27 1HD PRO 27 -4.496 -3.564 -6.323
177 H TYR 28 H TYR 28 0.622 -1.748 -5.064
178 HA TYR 28 HA TYR 28 1.010 -3.066 -2.462
179 HB2 TYR 28 2HB TYR 28 2.799 -3.008 -4.838
180 HB3 TYR 28 1HB TYR 28 3.544 -2.891 -3.245
181 HD1 TYR 28 1HD TYR 28 0.967 -4.897 -5.109
182 HD2 TYR 28 2HD TYR 28 3.978 -4.839 -2.051
183 HE1 TYR 28 1HE TYR 28 0.690 -7.344 -4.781
184 HE2 TYR 28 2HE TYR 28 3.707 -7.274 -1.717
185 HH TYR 28 HH TYR 28 1.603 -8.970 -2.198
186 H CYS 29 H CYS 29 2.066 -1.895 -0.887
187 HA CYS 29 HA CYS 29 1.932 0.969 -1.199
188 HB2 CYS 29 2HB CYS 29 2.284 -0.949 1.025
189 HB3 CYS 29 1HB CYS 29 3.107 0.593 1.223
190 H GLU 30 H GLU 30 3.503 2.059 -2.165
191 HA GLU 30 HA GLU 30 6.298 1.396 -1.488
192 HB2 GLU 30 1HB GLU 30 6.976 1.639 -3.830
193 HB3 GLU 30 2HB GLU 30 5.804 0.331 -3.663
194 HG2 GLU 30 1HG GLU 30 3.999 1.937 -4.301
195 HG3 GLU 30 2HG GLU 30 5.234 3.155 -4.605
196 H LYS 31 H LYS 31 7.718 3.156 -1.554
197 HA LYS 31 HA LYS 31 6.624 5.684 -0.926
198 HB2 LYS 31 1HB LYS 31 8.940 6.484 -0.997
199 HB3 LYS 31 2HB LYS 31 8.847 4.936 -0.156
200 HG2 LYS 31 1HG LYS 31 9.503 3.782 -2.259
201 HG3 LYS 31 2HG LYS 31 9.670 5.349 -3.048
202 HD2 LYS 31 1HD LYS 31 11.399 6.005 -1.437
203 HD3 LYS 31 2HD LYS 31 11.216 4.464 -0.597
204 HE2 LYS 31 1HE LYS 31 13.137 4.362 -2.119
205 HE3 LYS 31 2HE LYS 31 11.866 3.274 -2.676
206 HZ1 LYS 31 3HZ LYS 31 11.289 5.686 -3.835
207 HZ2 LYS 31 1HZ LYS 31 11.980 4.340 -4.602
208 HZ3 LYS 31 2HZ LYS 31 12.978 5.559 -3.964
209 H TYR 32 H TYR 32 6.870 7.691 -2.085
210 HA TYR 32 HA TYR 32 7.003 7.370 -5.028
211 HB2 TYR 32 2HB TYR 32 4.651 7.632 -4.113
212 HB3 TYR 32 1HB TYR 32 5.119 9.254 -3.608
213 HD1 TYR 32 1HD TYR 32 4.388 7.051 -6.429
214 HD2 TYR 32 2HD TYR 32 5.694 10.980 -5.289
215 HE1 TYR 32 1HE TYR 32 3.990 7.856 -8.745
216 HE2 TYR 32 2HE TYR 32 5.294 11.788 -7.602
217 HH TYR 32 HH TYR 32 4.533 9.587 -10.209
218 H ARG 33 H ARG 33 8.539 8.602 -5.889
219 HA ARG 33 HA ARG 33 9.919 10.588 -4.337
220 HB2 ARG 33 1HB ARG 33 10.143 9.878 -7.273
221 HB3 ARG 33 2HB ARG 33 11.271 10.895 -6.374
222 HG2 ARG 33 1HG ARG 33 11.896 9.060 -4.937
223 HG3 ARG 33 2HG ARG 33 10.617 8.041 -5.599
224 HD2 ARG 33 1HD ARG 33 12.935 9.149 -7.207
225 HD3 ARG 33 2HD ARG 33 12.865 7.516 -6.552
226 HE ARG 33 HE ARG 33 10.538 7.907 -8.056
227 HH11 ARG 33 1HH1 ARG 33 10.430 7.138 -10.191
228 HH12 ARG 33 2HH1 ARG 33 11.890 6.846 -11.075
229 HH21 ARG 33 2HH2 ARG 33 13.895 7.228 -10.103
230 HH22 ARG 33 1HH2 ARG 33 13.972 7.813 -8.475
Start of MODEL 16
1 HA ASN 1 HA ASN 1 -0.726 -1.573 12.020
2 HB2 ASN 1 1HB ASN 1 1.625 -2.005 11.745
3 HB3 ASN 1 2HB ASN 1 0.971 -3.308 12.734
4 HD21 ASN 1 1HD2 ASN 1 3.023 -4.961 10.141
5 HD22 ASN 1 2HD2 ASN 1 3.300 -3.961 11.485
6 H CYS 2 H CYS 2 0.388 -0.266 10.332
7 HA CYS 2 HA CYS 2 -0.974 -0.494 7.830
8 HB2 CYS 2 2HB CYS 2 0.157 1.555 7.261
9 HB3 CYS 2 1HB CYS 2 -0.416 1.683 8.917
10 H ALA 3 H ALA 3 0.340 -0.183 5.784
11 HA ALA 3 HA ALA 3 1.984 -2.482 5.419
12 HB1 ALA 3 3HB ALA 3 2.392 -1.199 3.149
13 HB2 ALA 3 1HB ALA 3 1.046 -0.217 3.716
14 HB3 ALA 3 2HB ALA 3 0.837 -1.951 3.488
15 H LYS 4 H LYS 4 4.146 -2.694 5.437
16 HA LYS 4 HA LYS 4 5.755 -0.286 5.981
17 HB2 LYS 4 1HB LYS 4 6.067 -3.173 6.731
18 HB3 LYS 4 2HB LYS 4 7.429 -2.051 6.793
19 HG2 LYS 4 1HG LYS 4 4.855 -1.180 8.023
20 HG3 LYS 4 2HG LYS 4 5.808 -2.381 8.877
21 HD2 LYS 4 1HD LYS 4 7.781 -0.881 8.780
22 HD3 LYS 4 2HD LYS 4 6.799 0.332 7.958
23 HE2 LYS 4 1HE LYS 4 6.107 -0.805 10.677
24 HE3 LYS 4 2HE LYS 4 7.023 0.685 10.450
25 HZ1 LYS 4 3HZ LYS 4 4.759 0.781 8.810
26 HZ2 LYS 4 1HZ LYS 4 5.135 1.764 10.140
27 HZ3 LYS 4 2HZ LYS 4 4.252 0.330 10.367
28 H GLU 5 H GLU 5 4.992 -0.907 3.312
29 HA GLU 5 HA GLU 5 6.034 -0.794 1.266
30 HB2 GLU 5 1HB GLU 5 8.083 -0.121 2.861
31 HB3 GLU 5 2HB GLU 5 8.672 -1.686 2.294
32 HG2 GLU 5 1HG GLU 5 8.044 -0.892 -0.052
33 HG3 GLU 5 2HG GLU 5 7.888 0.715 0.647
34 H GLY 6 H GLY 6 5.850 -2.340 -0.236
35 HA2 GLY 6 1HA GLY 6 6.088 -4.416 -1.261
36 HA3 GLY 6 2HA GLY 6 6.999 -4.969 0.140
37 H GLU 7 H GLU 7 3.985 -3.468 0.787
38 HA GLU 7 HA GLU 7 2.755 -6.112 1.298
39 HB2 GLU 7 1HB GLU 7 2.351 -3.501 2.755
40 HB3 GLU 7 2HB GLU 7 1.498 -5.003 3.106
41 HG2 GLU 7 1HG GLU 7 4.511 -4.687 3.191
42 HG3 GLU 7 2HG GLU 7 3.464 -4.603 4.604
43 H VAL 8 H VAL 8 0.464 -6.276 1.001
44 HA VAL 8 HA VAL 8 -0.449 -4.850 -1.335
45 HB VAL 8 HB VAL 8 -1.002 -7.151 -1.269
46 HG11 VAL 8 1HG1 VAL 8 -1.054 -8.095 0.791
47 HG12 VAL 8 2HG1 VAL 8 -2.732 -7.560 0.866
48 HG13 VAL 8 3HG1 VAL 8 -1.458 -6.561 1.563
49 HG21 VAL 8 3HG2 VAL 8 -2.826 -5.396 -1.884
50 HG22 VAL 8 1HG2 VAL 8 -3.576 -5.876 -0.361
51 HG23 VAL 8 2HG2 VAL 8 -3.326 -7.069 -1.637
52 H CYS 9 H CYS 9 -1.919 -3.254 -1.487
53 HA CYS 9 HA CYS 9 -3.249 -2.411 1.017
54 HB2 CYS 9 2HB CYS 9 -2.138 -0.480 0.846
55 HB3 CYS 9 1HB CYS 9 -1.498 -0.930 -0.731
56 H GLY 10 H GLY 10 -5.241 -1.135 0.676
57 HA2 GLY 10 1HA GLY 10 -7.201 -0.589 -0.467
58 HA3 GLY 10 2HA GLY 10 -6.586 -1.440 -1.883
59 H TRP 11 H TRP 11 -5.884 -3.573 0.310
60 HA TRP 11 HA TRP 11 -8.540 -4.677 0.692
61 HB2 TRP 11 2HB TRP 11 -6.352 -6.306 -0.548
62 HB3 TRP 11 1HB TRP 11 -8.050 -6.717 -0.387
63 HD1 TRP 11 1HD TRP 11 -5.673 -5.259 -2.752
64 HE1 TRP 11 1HE TRP 11 -6.905 -4.141 -4.725
65 HE3 TRP 11 3HE TRP 11 -10.344 -5.116 -0.827
66 HZ2 TRP 11 2HZ TRP 11 -9.565 -3.280 -5.379
67 HZ3 TRP 11 3HZ TRP 11 -12.234 -4.135 -2.120
68 HH2 TRP 11 2HH TRP 11 -11.844 -3.216 -4.391
69 H GLY 12 H GLY 12 -5.405 -4.114 1.695
70 HA2 GLY 12 1HA GLY 12 -5.811 -5.697 4.134
71 HA3 GLY 12 2HA GLY 12 -4.331 -5.961 3.216
72 H SER 13 H SER 13 -3.888 -3.287 2.373
73 HA SER 13 HA SER 13 -3.515 -1.844 4.921
74 HB2 SER 13 1HB SER 13 -1.447 -3.108 4.212
75 HB3 SER 13 2HB SER 13 -1.396 -2.071 2.789
76 HG SER 13 HG SER 13 -1.303 -1.281 5.516
77 H LYS 14 H LYS 14 -2.568 0.442 4.371
78 HA LYS 14 HA LYS 14 -3.639 1.525 1.890
79 HB2 LYS 14 1HB LYS 14 -4.646 2.270 4.630
80 HB3 LYS 14 2HB LYS 14 -4.797 3.346 3.246
81 HG2 LYS 14 1HG LYS 14 -5.992 1.558 2.003
82 HG3 LYS 14 2HG LYS 14 -5.884 0.522 3.425
83 HD2 LYS 14 1HD LYS 14 -7.181 2.144 4.733
84 HD3 LYS 14 2HD LYS 14 -7.272 3.214 3.333
85 HE2 LYS 14 1HE LYS 14 -8.468 1.459 2.071
86 HE3 LYS 14 2HE LYS 14 -8.385 0.394 3.474
87 HZ1 LYS 14 3HZ LYS 14 -9.936 1.583 4.590
88 HZ2 LYS 14 1HZ LYS 14 -10.453 1.943 3.015
89 HZ3 LYS 14 2HZ LYS 14 -9.503 3.061 3.873
90 H CYS 15 H CYS 15 -0.969 1.182 2.934
91 HA CYS 15 HA CYS 15 0.994 2.338 3.177
92 HB2 CYS 15 2HB CYS 15 -0.744 4.266 1.675
93 HB3 CYS 15 1HB CYS 15 0.847 4.743 2.206
94 H CYS 16 H CYS 16 1.662 2.837 5.184
95 HA CYS 16 HA CYS 16 0.272 3.889 7.261
96 HB2 CYS 16 2HB CYS 16 3.141 4.665 6.798
97 HB3 CYS 16 1HB CYS 16 2.325 4.374 8.333
98 H HIS 17 H HIS 17 2.224 5.816 4.995
99 HA HIS 17 HA HIS 17 0.492 7.941 4.700
100 HB2 HIS 17 1HB HIS 17 1.837 7.962 7.298
101 HB3 HIS 17 2HB HIS 17 2.120 9.431 6.367
102 HD1 HIS 17 HD1 HIS 17 -0.253 8.013 8.639
103 HD2 HIS 17 HD2 HIS 17 -0.551 10.445 5.266
104 HE1 HIS 17 HE1 HIS 17 -2.533 9.110 8.745
105 H GLY 18 H GLY 18 3.708 6.797 5.056
106 HA2 GLY 18 1HA GLY 18 4.797 8.896 3.300
107 HA3 GLY 18 2HA GLY 18 5.741 7.716 4.204
108 H LEU 19 H LEU 19 3.216 6.080 2.885
109 HA LEU 19 HA LEU 19 4.788 5.272 0.523
110 HB2 LEU 19 1HB LEU 19 2.882 3.699 2.266
111 HB3 LEU 19 2HB LEU 19 3.586 3.084 0.775
112 HG LEU 19 HG LEU 19 5.249 4.117 3.088
113 HD11 LEU 19 1HD1 LEU 19 4.912 2.184 4.182
114 HD12 LEU 19 2HD1 LEU 19 5.445 1.281 2.765
115 HD13 LEU 19 3HD1 LEU 19 3.745 1.691 2.957
116 HD21 LEU 19 3HD2 LEU 19 5.802 2.751 0.465
117 HD22 LEU 19 1HD2 LEU 19 6.866 2.444 1.834
118 HD23 LEU 19 2HD2 LEU 19 6.661 4.085 1.241
119 H ASP 20 H ASP 20 3.590 4.663 -1.354
120 HA ASP 20 HA ASP 20 0.908 5.886 -1.546
121 HB2 ASP 20 1HB ASP 20 1.702 6.132 -4.056
122 HB3 ASP 20 2HB ASP 20 2.121 7.353 -2.855
123 H CYS 21 H CYS 21 -0.635 4.555 -2.233
124 HA CYS 21 HA CYS 21 0.161 2.092 -3.641
125 HB2 CYS 21 2HB CYS 21 -0.444 1.141 -1.655
126 HB3 CYS 21 1HB CYS 21 -1.525 2.465 -1.228
127 HA PRO 22 HA PRO 22 -2.880 3.841 -6.448
128 HB2 PRO 22 2HB PRO 22 -2.637 1.994 -8.433
129 HB3 PRO 22 1HB PRO 22 -1.432 3.268 -8.160
130 HG2 PRO 22 2HG PRO 22 -1.357 0.400 -7.349
131 HG3 PRO 22 1HG PRO 22 -0.066 1.421 -7.991
132 HD2 PRO 22 2HD PRO 22 -0.335 0.816 -5.354
133 HD3 PRO 22 1HD PRO 22 0.430 2.306 -5.945
134 H LEU 23 H LEU 23 -5.026 3.404 -7.030
135 HA LEU 23 HA LEU 23 -6.259 1.221 -5.549
136 HB2 LEU 23 1HB LEU 23 -7.321 3.590 -7.093
137 HB3 LEU 23 2HB LEU 23 -8.391 2.318 -6.511
138 HG LEU 23 HG LEU 23 -8.249 4.220 -4.911
139 HD11 LEU 23 1HD1 LEU 23 -6.779 2.108 -3.442
140 HD12 LEU 23 2HD1 LEU 23 -8.218 1.566 -4.306
141 HD13 LEU 23 3HD1 LEU 23 -8.348 2.838 -3.094
142 HD21 LEU 23 3HD2 LEU 23 -5.404 3.401 -4.365
143 HD22 LEU 23 1HD2 LEU 23 -6.229 4.896 -3.923
144 HD23 LEU 23 2HD2 LEU 23 -5.766 4.608 -5.599
145 H ALA 24 H ALA 24 -5.347 -0.477 -6.799
146 HA ALA 24 HA ALA 24 -6.704 -0.928 -9.389
147 HB1 ALA 24 3HB ALA 24 -4.746 -1.869 -10.285
148 HB2 ALA 24 1HB ALA 24 -4.011 -2.062 -8.688
149 HB3 ALA 24 2HB ALA 24 -4.158 -0.451 -9.411
150 H PHE 25 H PHE 25 -5.165 -3.454 -9.450
151 HA PHE 25 HA PHE 25 -6.887 -5.046 -7.665
152 HB2 PHE 25 2HB PHE 25 -7.202 -5.536 -10.047
153 HB3 PHE 25 1HB PHE 25 -5.478 -5.857 -10.208
154 HD1 PHE 25 1HD PHE 25 -8.565 -6.955 -8.444
155 HD2 PHE 25 2HD PHE 25 -4.562 -7.967 -9.625
156 HE1 PHE 25 1HE PHE 25 -8.928 -9.284 -7.678
157 HE2 PHE 25 2HE PHE 25 -4.925 -10.298 -8.859
158 HZ PHE 25 HZ PHE 25 -7.107 -10.956 -7.883
159 H ILE 26 H ILE 26 -5.871 -5.589 -5.983
160 HA ILE 26 HA ILE 26 -4.265 -6.197 -4.476
161 HB ILE 26 HB ILE 26 -3.193 -7.605 -6.936
162 HG12 ILE 26 1HG1 ILE 26 -5.468 -8.287 -6.280
163 HG13 ILE 26 2HG1 ILE 26 -4.315 -9.576 -5.955
164 HG21 ILE 26 1HG2 ILE 26 -2.196 -7.398 -4.186
165 HG22 ILE 26 2HG2 ILE 26 -1.365 -7.950 -5.643
166 HG23 ILE 26 3HG2 ILE 26 -2.398 -9.058 -4.739
167 HD11 ILE 26 3HD1 ILE 26 -5.384 -9.587 -3.920
168 HD12 ILE 26 1HD1 ILE 26 -5.869 -7.899 -4.049
169 HD13 ILE 26 2HD1 ILE 26 -4.226 -8.308 -3.558
170 HA PRO 27 HA PRO 27 -1.350 -2.981 -6.327
171 HB2 PRO 27 2HB PRO 27 -2.215 -0.866 -4.816
172 HB3 PRO 27 1HB PRO 27 -2.798 -1.213 -6.451
173 HG2 PRO 27 2HG PRO 27 -4.080 -1.737 -3.838
174 HG3 PRO 27 1HG PRO 27 -4.806 -1.292 -5.382
175 HD2 PRO 27 2HD PRO 27 -4.853 -3.840 -4.405
176 HD3 PRO 27 1HD PRO 27 -4.912 -3.426 -6.125
177 H TYR 28 H TYR 28 0.465 -2.191 -5.188
178 HA TYR 28 HA TYR 28 0.674 -3.115 -2.390
179 HB2 TYR 28 2HB TYR 28 2.434 -3.418 -4.751
180 HB3 TYR 28 1HB TYR 28 3.233 -3.088 -3.218
181 HD1 TYR 28 1HD TYR 28 0.233 -5.197 -4.260
182 HD2 TYR 28 2HD TYR 28 4.020 -5.016 -2.193
183 HE1 TYR 28 1HE TYR 28 0.020 -7.571 -3.612
184 HE2 TYR 28 2HE TYR 28 3.771 -7.392 -1.554
185 HH TYR 28 HH TYR 28 1.735 -9.007 -1.228
186 H CYS 29 H CYS 29 1.885 -1.863 -0.928
187 HA CYS 29 HA CYS 29 1.862 0.981 -1.489
188 HB2 CYS 29 2HB CYS 29 2.108 -0.749 0.897
189 HB3 CYS 29 1HB CYS 29 2.939 0.802 0.974
190 H GLU 30 H GLU 30 3.511 2.022 -2.327
191 HA GLU 30 HA GLU 30 6.253 1.151 -1.638
192 HB2 GLU 30 1HB GLU 30 6.971 1.537 -3.942
193 HB3 GLU 30 2HB GLU 30 5.694 0.319 -3.905
194 HG2 GLU 30 1HG GLU 30 4.040 2.178 -4.343
195 HG3 GLU 30 2HG GLU 30 5.413 3.247 -4.620
196 H LYS 31 H LYS 31 7.784 2.808 -1.538
197 HA LYS 31 HA LYS 31 6.858 5.339 -0.693
198 HB2 LYS 31 1HB LYS 31 9.290 5.984 -0.871
199 HB3 LYS 31 2HB LYS 31 8.988 4.533 0.085
200 HG2 LYS 31 1HG LYS 31 9.526 3.127 -1.869
201 HG3 LYS 31 2HG LYS 31 9.827 4.574 -2.830
202 HD2 LYS 31 1HD LYS 31 11.702 5.191 -1.454
203 HD3 LYS 31 2HD LYS 31 11.316 3.942 -0.271
204 HE2 LYS 31 1HE LYS 31 13.166 3.212 -1.725
205 HE3 LYS 31 2HE LYS 31 11.743 2.202 -1.975
206 HZ1 LYS 31 3HZ LYS 31 13.121 3.749 -3.856
207 HZ2 LYS 31 1HZ LYS 31 11.565 4.400 -3.688
208 HZ3 LYS 31 2HZ LYS 31 11.758 2.763 -4.096
209 H TYR 32 H TYR 32 6.687 7.277 -1.691
210 HA TYR 32 HA TYR 32 6.108 7.359 -4.433
211 HB2 TYR 32 2HB TYR 32 5.222 8.962 -2.751
212 HB3 TYR 32 1HB TYR 32 6.827 9.685 -2.647
213 HD1 TYR 32 1HD TYR 32 3.988 8.984 -4.926
214 HD2 TYR 32 2HD TYR 32 7.631 11.181 -4.337
215 HE1 TYR 32 1HE TYR 32 3.487 10.354 -6.937
216 HE2 TYR 32 2HE TYR 32 7.132 12.550 -6.344
217 HH TYR 32 HH TYR 32 5.203 11.770 -8.664
218 H ARG 33 H ARG 33 8.941 8.476 -2.653
219 HA ARG 33 HA ARG 33 10.919 9.409 -3.430
220 HB2 ARG 33 1HB ARG 33 10.930 6.766 -3.441
221 HB3 ARG 33 2HB ARG 33 11.093 6.994 -5.181
222 HG2 ARG 33 1HG ARG 33 13.081 8.362 -4.868
223 HG3 ARG 33 2HG ARG 33 12.887 8.303 -3.114
224 HD2 ARG 33 1HD ARG 33 14.528 6.656 -3.634
225 HD3 ARG 33 2HD ARG 33 13.035 5.779 -3.303
226 HE ARG 33 HE ARG 33 13.142 6.289 -6.063
227 HH11 ARG 33 1HH1 ARG 33 13.842 4.652 -7.474
228 HH12 ARG 33 2HH1 ARG 33 14.808 3.348 -6.868
229 HH21 ARG 33 2HH2 ARG 33 15.370 3.281 -4.679
230 HH22 ARG 33 1HH2 ARG 33 14.834 4.532 -3.609
Start of MODEL 17
1 HA ASN 1 HA ASN 1 -0.400 -0.801 13.178
2 HB2 ASN 1 1HB ASN 1 -1.315 -3.176 13.656
3 HB3 ASN 1 2HB ASN 1 -1.498 -3.306 11.909
4 HD21 ASN 1 1HD2 ASN 1 1.853 -4.424 11.836
5 HD22 ASN 1 2HD2 ASN 1 0.227 -4.804 11.533
6 H CYS 2 H CYS 2 0.880 -1.085 11.140
7 HA CYS 2 HA CYS 2 -0.658 -0.386 8.723
8 HB2 CYS 2 2HB CYS 2 0.237 1.698 9.632
9 HB3 CYS 2 1HB CYS 2 1.854 0.999 9.683
10 H ALA 3 H ALA 3 0.792 -0.495 6.742
11 HA ALA 3 HA ALA 3 2.261 -3.039 6.839
12 HB1 ALA 3 3HB ALA 3 2.165 -1.936 4.208
13 HB2 ALA 3 1HB ALA 3 0.562 -1.780 4.929
14 HB3 ALA 3 2HB ALA 3 1.327 -3.366 4.824
15 H LYS 4 H LYS 4 3.970 -2.918 4.860
16 HA LYS 4 HA LYS 4 5.612 -0.525 5.083
17 HB2 LYS 4 1HB LYS 4 7.633 -1.789 5.632
18 HB3 LYS 4 2HB LYS 4 6.423 -1.985 6.902
19 HG2 LYS 4 1HG LYS 4 6.662 -4.211 6.622
20 HG3 LYS 4 2HG LYS 4 5.819 -3.993 5.087
21 HD2 LYS 4 1HD LYS 4 7.883 -5.119 4.583
22 HD3 LYS 4 2HD LYS 4 8.051 -3.450 4.044
23 HE2 LYS 4 1HE LYS 4 9.892 -3.275 5.318
24 HE3 LYS 4 2HE LYS 4 8.867 -3.458 6.742
25 HZ1 LYS 4 3HZ LYS 4 10.126 -5.273 7.061
26 HZ2 LYS 4 1HZ LYS 4 10.585 -5.390 5.432
27 HZ3 LYS 4 2HZ LYS 4 9.075 -5.987 5.932
28 H GLU 5 H GLU 5 7.172 -0.376 3.418
29 HA GLU 5 HA GLU 5 6.376 -0.923 0.897
30 HB2 GLU 5 1HB GLU 5 8.304 0.517 1.519
31 HB3 GLU 5 2HB GLU 5 9.255 -0.933 1.846
32 HG2 GLU 5 1HG GLU 5 8.953 -1.662 -0.478
33 HG3 GLU 5 2HG GLU 5 7.991 -0.224 -0.809
34 H GLY 6 H GLY 6 5.752 -2.801 0.080
35 HA2 GLY 6 1HA GLY 6 6.677 -4.856 -0.974
36 HA3 GLY 6 2HA GLY 6 7.417 -5.201 0.586
37 H GLU 7 H GLU 7 4.421 -3.750 1.030
38 HA GLU 7 HA GLU 7 3.110 -6.388 1.367
39 HB2 GLU 7 1HB GLU 7 2.740 -3.863 2.985
40 HB3 GLU 7 2HB GLU 7 1.822 -5.355 3.197
41 HG2 GLU 7 1HG GLU 7 4.841 -5.220 3.358
42 HG3 GLU 7 2HG GLU 7 3.786 -5.107 4.765
43 H VAL 8 H VAL 8 0.898 -6.550 0.901
44 HA VAL 8 HA VAL 8 0.026 -5.093 -1.371
45 HB VAL 8 HB VAL 8 -0.699 -7.394 -0.940
46 HG11 VAL 8 1HG1 VAL 8 -2.499 -6.323 1.229
47 HG12 VAL 8 2HG1 VAL 8 -0.874 -6.894 1.607
48 HG13 VAL 8 3HG1 VAL 8 -2.053 -7.996 0.895
49 HG21 VAL 8 3HG2 VAL 8 -2.144 -5.526 -2.124
50 HG22 VAL 8 1HG2 VAL 8 -3.193 -5.733 -0.723
51 HG23 VAL 8 2HG2 VAL 8 -2.857 -7.102 -1.783
52 H CYS 9 H CYS 9 -1.748 -3.668 -1.593
53 HA CYS 9 HA CYS 9 -2.923 -2.482 0.794
54 HB2 CYS 9 2HB CYS 9 -0.914 -1.206 0.725
55 HB3 CYS 9 1HB CYS 9 -1.030 -1.009 -1.011
56 H GLY 10 H GLY 10 -4.544 -0.849 0.281
57 HA2 GLY 10 1HA GLY 10 -6.026 0.232 -1.252
58 HA3 GLY 10 2HA GLY 10 -5.555 -0.934 -2.485
59 H TRP 11 H TRP 11 -5.775 -3.030 -0.258
60 HA TRP 11 HA TRP 11 -8.676 -3.151 0.004
61 HB2 TRP 11 2HB TRP 11 -7.077 -5.487 -0.997
62 HB3 TRP 11 1HB TRP 11 -8.824 -5.330 -0.906
63 HD1 TRP 11 1HD TRP 11 -6.045 -4.904 -3.214
64 HE1 TRP 11 1HE TRP 11 -6.773 -3.606 -5.325
65 HE3 TRP 11 3HE TRP 11 -10.460 -3.105 -1.568
66 HZ2 TRP 11 2HZ TRP 11 -8.989 -1.984 -6.179
67 HZ3 TRP 11 3HZ TRP 11 -11.889 -1.675 -3.020
68 HH2 TRP 11 2HH TRP 11 -11.152 -1.111 -5.322
69 H GLY 12 H GLY 12 -5.589 -3.556 1.192
70 HA2 GLY 12 1HA GLY 12 -6.604 -4.932 3.597
71 HA3 GLY 12 2HA GLY 12 -5.079 -5.420 2.864
72 H SER 13 H SER 13 -4.126 -2.816 2.148
73 HA SER 13 HA SER 13 -3.780 -1.592 4.817
74 HB2 SER 13 1HB SER 13 -1.704 -2.132 2.711
75 HB3 SER 13 2HB SER 13 -1.459 -1.012 4.032
76 HG SER 13 HG SER 13 -2.404 -3.135 5.157
77 H LYS 14 H LYS 14 -3.086 0.641 4.777
78 HA LYS 14 HA LYS 14 -4.022 2.085 2.387
79 HB2 LYS 14 1HB LYS 14 -4.541 2.728 5.296
80 HB3 LYS 14 2HB LYS 14 -4.883 3.824 3.959
81 HG2 LYS 14 1HG LYS 14 -6.368 2.119 2.949
82 HG3 LYS 14 2HG LYS 14 -6.042 1.044 4.309
83 HD2 LYS 14 1HD LYS 14 -6.986 2.713 5.862
84 HD3 LYS 14 2HD LYS 14 -7.316 3.788 4.503
85 HE2 LYS 14 1HE LYS 14 -8.802 2.091 3.510
86 HE3 LYS 14 2HE LYS 14 -8.472 1.008 4.863
87 HZ1 LYS 14 3HZ LYS 14 -9.228 3.095 6.226
88 HZ2 LYS 14 1HZ LYS 14 -10.363 2.006 5.594
89 HZ3 LYS 14 2HZ LYS 14 -10.054 3.469 4.790
90 H CYS 15 H CYS 15 -1.294 1.264 3.446
91 HA CYS 15 HA CYS 15 0.807 2.183 3.646
92 HB2 CYS 15 2HB CYS 15 -0.708 4.214 2.041
93 HB3 CYS 15 1HB CYS 15 0.930 4.535 2.542
94 H CYS 16 H CYS 16 1.650 2.750 5.522
95 HA CYS 16 HA CYS 16 0.513 3.993 7.624
96 HB2 CYS 16 2HB CYS 16 3.362 4.606 6.862
97 HB3 CYS 16 1HB CYS 16 2.678 4.449 8.482
98 H HIS 17 H HIS 17 2.556 5.787 5.316
99 HA HIS 17 HA HIS 17 0.823 7.970 4.977
100 HB2 HIS 17 1HB HIS 17 1.993 9.677 6.367
101 HB3 HIS 17 2HB HIS 17 1.156 8.477 7.340
102 HD1 HIS 17 HD1 HIS 17 2.753 6.420 8.194
103 HD2 HIS 17 HD2 HIS 17 4.694 9.891 6.941
104 HE1 HIS 17 HE1 HIS 17 5.098 6.314 9.147
105 H GLY 18 H GLY 18 3.999 6.707 5.173
106 HA2 GLY 18 1HA GLY 18 5.092 8.684 3.297
107 HA3 GLY 18 2HA GLY 18 6.006 7.435 4.135
108 H LEU 19 H LEU 19 3.278 6.008 2.991
109 HA LEU 19 HA LEU 19 4.567 5.180 0.467
110 HB2 LEU 19 1HB LEU 19 2.981 3.550 2.453
111 HB3 LEU 19 2HB LEU 19 3.477 2.965 0.875
112 HG LEU 19 HG LEU 19 5.409 4.019 2.960
113 HD11 LEU 19 1HD1 LEU 19 5.777 1.857 3.733
114 HD12 LEU 19 2HD1 LEU 19 5.154 1.112 2.263
115 HD13 LEU 19 3HD1 LEU 19 4.039 1.804 3.444
116 HD21 LEU 19 3HD2 LEU 19 6.901 2.447 1.411
117 HD22 LEU 19 1HD2 LEU 19 6.585 4.120 0.961
118 HD23 LEU 19 2HD2 LEU 19 5.658 2.815 0.218
119 H ASP 20 H ASP 20 3.009 4.339 -1.156
120 HA ASP 20 HA ASP 20 0.253 5.292 -0.880
121 HB2 ASP 20 1HB ASP 20 1.769 7.136 -1.873
122 HB3 ASP 20 2HB ASP 20 1.862 6.098 -3.298
123 H CYS 21 H CYS 21 -1.176 4.002 -1.999
124 HA CYS 21 HA CYS 21 -0.043 2.162 -3.979
125 HB2 CYS 21 2HB CYS 21 -1.015 0.269 -3.022
126 HB3 CYS 21 1HB CYS 21 -0.391 1.143 -1.640
127 HA PRO 22 HA PRO 22 -3.657 3.575 -6.212
128 HB2 PRO 22 2HB PRO 22 -3.482 1.851 -8.326
129 HB3 PRO 22 1HB PRO 22 -2.424 3.263 -8.137
130 HG2 PRO 22 2HG PRO 22 -1.869 0.401 -7.551
131 HG3 PRO 22 1HG PRO 22 -0.816 1.627 -8.256
132 HD2 PRO 22 2HD PRO 22 -0.656 0.825 -5.659
133 HD3 PRO 22 1HD PRO 22 -0.173 2.444 -6.219
134 H LEU 23 H LEU 23 -5.647 2.530 -7.269
135 HA LEU 23 HA LEU 23 -6.642 0.475 -5.422
136 HB2 LEU 23 1HB LEU 23 -7.830 2.706 -6.965
137 HB3 LEU 23 2HB LEU 23 -8.835 1.269 -6.792
138 HG LEU 23 HG LEU 23 -8.677 1.357 -4.384
139 HD11 LEU 23 1HD1 LEU 23 -6.558 2.033 -3.725
140 HD12 LEU 23 2HD1 LEU 23 -7.411 3.563 -3.529
141 HD13 LEU 23 3HD1 LEU 23 -6.459 3.270 -4.980
142 HD21 LEU 23 3HD2 LEU 23 -9.015 4.231 -5.235
143 HD22 LEU 23 1HD2 LEU 23 -9.895 3.351 -3.984
144 HD23 LEU 23 2HD2 LEU 23 -10.190 2.994 -5.686
145 H ALA 24 H ALA 24 -4.861 -0.233 -7.573
146 HA ALA 24 HA ALA 24 -6.254 -1.416 -9.754
147 HB1 ALA 24 3HB ALA 24 -4.132 -2.742 -10.009
148 HB2 ALA 24 1HB ALA 24 -3.551 -1.977 -8.529
149 HB3 ALA 24 2HB ALA 24 -3.892 -0.995 -9.955
150 H PHE 25 H PHE 25 -5.407 -3.983 -9.907
151 HA PHE 25 HA PHE 25 -7.339 -5.414 -8.408
152 HB2 PHE 25 2HB PHE 25 -4.974 -6.798 -9.596
153 HB3 PHE 25 1HB PHE 25 -6.679 -7.233 -9.660
154 HD1 PHE 25 1HD PHE 25 -3.984 -5.752 -11.436
155 HD2 PHE 25 2HD PHE 25 -8.253 -5.599 -10.976
156 HE1 PHE 25 1HE PHE 25 -4.179 -4.643 -13.638
157 HE2 PHE 25 2HE PHE 25 -8.448 -4.490 -13.187
158 HZ PHE 25 HZ PHE 25 -6.411 -4.011 -14.519
159 H ILE 26 H ILE 26 -3.782 -5.343 -8.266
160 HA ILE 26 HA ILE 26 -3.929 -6.067 -5.414
161 HB ILE 26 HB ILE 26 -2.163 -7.335 -7.516
162 HG12 ILE 26 1HG1 ILE 26 -4.400 -8.335 -7.240
163 HG13 ILE 26 2HG1 ILE 26 -3.142 -9.430 -6.674
164 HG21 ILE 26 1HG2 ILE 26 -1.527 -8.627 -5.207
165 HG22 ILE 26 2HG2 ILE 26 -1.739 -6.981 -4.614
166 HG23 ILE 26 3HG2 ILE 26 -0.571 -7.316 -5.896
167 HD11 ILE 26 3HD1 ILE 26 -4.496 -9.598 -4.837
168 HD12 ILE 26 1HD1 ILE 26 -5.273 -8.046 -5.138
169 HD13 ILE 26 2HD1 ILE 26 -3.697 -8.105 -4.347
170 HA PRO 27 HA PRO 27 -1.198 -2.388 -6.172
171 HB2 PRO 27 2HB PRO 27 -2.644 -1.222 -3.921
172 HB3 PRO 27 1HB PRO 27 -2.453 -0.614 -5.565
173 HG2 PRO 27 2HG PRO 27 -4.808 -1.513 -4.629
174 HG3 PRO 27 1HG PRO 27 -4.328 -1.657 -6.325
175 HD2 PRO 27 2HD PRO 27 -4.272 -3.745 -4.184
176 HD3 PRO 27 1HD PRO 27 -4.760 -3.884 -5.879
177 H TYR 28 H TYR 28 0.547 -1.736 -4.906
178 HA TYR 28 HA TYR 28 0.834 -3.045 -2.273
179 HB2 TYR 28 2HB TYR 28 2.529 -3.197 -4.680
180 HB3 TYR 28 1HB TYR 28 3.398 -2.882 -3.179
181 HD1 TYR 28 1HD TYR 28 0.488 -5.060 -4.285
182 HD2 TYR 28 2HD TYR 28 4.173 -4.766 -2.067
183 HE1 TYR 28 1HE TYR 28 0.314 -7.444 -3.645
184 HE2 TYR 28 2HE TYR 28 3.974 -7.152 -1.442
185 HH TYR 28 HH TYR 28 1.206 -8.892 -1.665
186 H CYS 29 H CYS 29 1.783 -1.836 -0.665
187 HA CYS 29 HA CYS 29 1.708 0.991 -0.934
188 HB2 CYS 29 2HB CYS 29 2.265 -0.955 1.206
189 HB3 CYS 29 1HB CYS 29 3.068 0.601 1.379
190 H GLU 30 H GLU 30 3.073 1.660 -2.525
191 HA GLU 30 HA GLU 30 5.964 1.241 -2.007
192 HB2 GLU 30 1HB GLU 30 4.499 1.837 -4.582
193 HB3 GLU 30 2HB GLU 30 6.255 1.819 -4.422
194 HG2 GLU 30 1HG GLU 30 6.171 -0.518 -3.656
195 HG3 GLU 30 2HG GLU 30 4.414 -0.507 -3.801
196 H LYS 31 H LYS 31 7.333 2.984 -1.975
197 HA LYS 31 HA LYS 31 6.255 5.474 -1.124
198 HB2 LYS 31 1HB LYS 31 8.685 6.236 -1.412
199 HB3 LYS 31 2HB LYS 31 8.403 4.910 -0.285
200 HG2 LYS 31 1HG LYS 31 9.097 3.275 -1.921
201 HG3 LYS 31 2HG LYS 31 9.171 4.502 -3.187
202 HD2 LYS 31 1HD LYS 31 10.790 5.040 -0.758
203 HD3 LYS 31 2HD LYS 31 11.342 3.711 -1.778
204 HE2 LYS 31 1HE LYS 31 10.694 6.480 -2.824
205 HE3 LYS 31 2HE LYS 31 12.321 5.940 -2.407
206 HZ1 LYS 31 3HZ LYS 31 11.601 3.952 -3.964
207 HZ2 LYS 31 1HZ LYS 31 12.300 5.368 -4.582
208 HZ3 LYS 31 2HZ LYS 31 10.615 5.159 -4.642
209 H TYR 32 H TYR 32 6.643 7.562 -2.159
210 HA TYR 32 HA TYR 32 6.185 7.397 -5.055
211 HB2 TYR 32 2HB TYR 32 5.207 9.084 -2.925
212 HB3 TYR 32 1HB TYR 32 5.933 10.063 -4.200
213 HD1 TYR 32 1HD TYR 32 3.979 6.846 -4.190
214 HD2 TYR 32 2HD TYR 32 4.305 10.874 -5.659
215 HE1 TYR 32 1HE TYR 32 1.978 6.494 -5.612
216 HE2 TYR 32 2HE TYR 32 2.306 10.518 -7.078
217 HH TYR 32 HH TYR 32 1.150 8.457 -8.140
218 H ARG 33 H ARG 33 7.445 8.431 -6.544
219 HA ARG 33 HA ARG 33 10.176 8.670 -6.123
220 HB2 ARG 33 1HB ARG 33 10.214 9.946 -8.250
221 HB3 ARG 33 2HB ARG 33 9.213 8.497 -8.356
222 HG2 ARG 33 1HG ARG 33 7.214 9.949 -7.806
223 HG3 ARG 33 2HG ARG 33 8.269 11.351 -7.985
224 HD2 ARG 33 1HD ARG 33 7.782 9.258 -10.122
225 HD3 ARG 33 2HD ARG 33 7.027 10.847 -10.076
226 HE ARG 33 HE ARG 33 9.799 10.256 -10.766
227 HH11 ARG 33 1HH1 ARG 33 10.950 12.015 -11.616
228 HH12 ARG 33 2HH1 ARG 33 10.285 13.612 -11.514
229 HH21 ARG 33 2HH2 ARG 33 8.277 13.938 -10.536
230 HH22 ARG 33 1HH2 ARG 33 7.400 12.594 -9.885
Start of MODEL 18
1 HA ASN 1 HA ASN 1 -4.116 -2.948 9.541
2 HB2 ASN 1 1HB ASN 1 -6.122 -1.643 10.336
3 HB3 ASN 1 2HB ASN 1 -5.692 -0.384 9.180
4 HD21 ASN 1 1HD2 ASN 1 -8.098 -2.567 7.417
5 HD22 ASN 1 2HD2 ASN 1 -8.138 -1.471 8.712
6 H CYS 2 H CYS 2 -2.511 0.040 9.264
7 HA CYS 2 HA CYS 2 -2.494 0.419 6.470
8 HB2 CYS 2 2HB CYS 2 -0.309 1.642 7.016
9 HB3 CYS 2 1HB CYS 2 -1.770 2.245 7.786
10 H ALA 3 H ALA 3 -0.032 0.470 5.528
11 HA ALA 3 HA ALA 3 1.078 -2.245 5.850
12 HB1 ALA 3 3HB ALA 3 1.564 -1.822 3.270
13 HB2 ALA 3 1HB ALA 3 0.098 -0.862 3.404
14 HB3 ALA 3 2HB ALA 3 0.062 -2.581 3.814
15 H LYS 4 H LYS 4 3.217 -2.365 4.613
16 HA LYS 4 HA LYS 4 4.711 0.158 4.834
17 HB2 LYS 4 1HB LYS 4 6.514 -0.896 5.991
18 HB3 LYS 4 2HB LYS 4 5.037 -1.302 6.861
19 HG2 LYS 4 1HG LYS 4 5.754 -3.447 6.682
20 HG3 LYS 4 2HG LYS 4 5.140 -3.326 5.038
21 HD2 LYS 4 1HD LYS 4 7.294 -4.072 4.616
22 HD3 LYS 4 2HD LYS 4 7.556 -2.330 4.552
23 HE2 LYS 4 1HE LYS 4 8.238 -4.265 6.755
24 HE3 LYS 4 2HE LYS 4 9.262 -3.045 5.996
25 HZ1 LYS 4 3HZ LYS 4 8.293 -2.594 8.321
26 HZ2 LYS 4 1HZ LYS 4 6.856 -2.242 7.491
27 HZ3 LYS 4 2HZ LYS 4 8.264 -1.348 7.165
28 H GLU 5 H GLU 5 6.488 0.332 3.452
29 HA GLU 5 HA GLU 5 6.299 -0.451 0.891
30 HB2 GLU 5 1HB GLU 5 7.997 1.134 1.785
31 HB3 GLU 5 2HB GLU 5 8.919 -0.241 2.398
32 HG2 GLU 5 1HG GLU 5 9.124 -1.131 0.121
33 HG3 GLU 5 2HG GLU 5 8.181 0.218 -0.501
34 H GLY 6 H GLY 6 5.853 -2.424 0.186
35 HA2 GLY 6 1HA GLY 6 6.997 -4.483 -0.571
36 HA3 GLY 6 2HA GLY 6 7.581 -4.661 1.078
37 H GLU 7 H GLU 7 4.478 -3.447 1.209
38 HA GLU 7 HA GLU 7 3.298 -6.156 1.401
39 HB2 GLU 7 1HB GLU 7 2.822 -3.772 3.188
40 HB3 GLU 7 2HB GLU 7 1.881 -5.263 3.240
41 HG2 GLU 7 1HG GLU 7 4.892 -5.165 3.561
42 HG3 GLU 7 2HG GLU 7 3.761 -5.162 4.910
43 H VAL 8 H VAL 8 1.139 -6.394 0.809
44 HA VAL 8 HA VAL 8 0.265 -4.755 -1.340
45 HB VAL 8 HB VAL 8 -0.374 -7.041 -1.390
46 HG11 VAL 8 1HG1 VAL 8 -1.896 -7.934 0.460
47 HG12 VAL 8 2HG1 VAL 8 -1.458 -6.497 1.383
48 HG13 VAL 8 3HG1 VAL 8 -0.216 -7.658 0.917
49 HG21 VAL 8 3HG2 VAL 8 -2.910 -5.666 -0.497
50 HG22 VAL 8 1HG2 VAL 8 -2.703 -6.858 -1.779
51 HG23 VAL 8 2HG2 VAL 8 -2.109 -5.212 -2.001
52 H CYS 9 H CYS 9 -1.488 -3.357 -1.492
53 HA CYS 9 HA CYS 9 -2.972 -2.618 0.908
54 HB2 CYS 9 2HB CYS 9 -1.199 -1.170 1.367
55 HB3 CYS 9 1HB CYS 9 -0.889 -0.877 -0.324
56 H GLY 10 H GLY 10 -4.626 -0.931 0.417
57 HA2 GLY 10 1HA GLY 10 -5.893 0.310 -1.223
58 HA3 GLY 10 2HA GLY 10 -5.345 -0.829 -2.447
59 H TRP 11 H TRP 11 -5.834 -2.990 -0.310
60 HA TRP 11 HA TRP 11 -8.755 -3.020 -0.401
61 HB2 TRP 11 2HB TRP 11 -7.094 -5.404 -1.136
62 HB3 TRP 11 1HB TRP 11 -8.833 -5.213 -1.271
63 HD1 TRP 11 1HD TRP 11 -5.775 -4.884 -3.218
64 HE1 TRP 11 1HE TRP 11 -6.224 -3.641 -5.440
65 HE3 TRP 11 3HE TRP 11 -10.329 -2.957 -2.166
66 HZ2 TRP 11 2HZ TRP 11 -8.297 -2.021 -6.600
67 HZ3 TRP 11 3HZ TRP 11 -11.549 -1.556 -3.829
68 HH2 TRP 11 2HH TRP 11 -10.528 -1.085 -6.040
69 H GLY 12 H GLY 12 -5.999 -3.238 1.348
70 HA2 GLY 12 1HA GLY 12 -7.402 -4.492 3.587
71 HA3 GLY 12 2HA GLY 12 -5.883 -5.227 3.084
72 H SER 13 H SER 13 -4.661 -2.640 2.323
73 HA SER 13 HA SER 13 -4.383 -1.417 4.998
74 HB2 SER 13 1HB SER 13 -2.211 -2.294 3.106
75 HB3 SER 13 2HB SER 13 -1.944 -1.169 4.429
76 HG SER 13 HG SER 13 -2.152 -2.759 5.822
77 H LYS 14 H LYS 14 -3.145 0.711 4.817
78 HA LYS 14 HA LYS 14 -3.747 2.117 2.317
79 HB2 LYS 14 1HB LYS 14 -4.686 2.858 5.079
80 HB3 LYS 14 2HB LYS 14 -4.572 4.039 3.778
81 HG2 LYS 14 1HG LYS 14 -6.021 2.534 2.372
82 HG3 LYS 14 2HG LYS 14 -6.249 1.516 3.794
83 HD2 LYS 14 1HD LYS 14 -6.891 4.473 3.767
84 HD3 LYS 14 2HD LYS 14 -8.078 3.233 3.373
85 HE2 LYS 14 1HE LYS 14 -7.574 2.175 5.622
86 HE3 LYS 14 2HE LYS 14 -6.623 3.610 6.004
87 HZ1 LYS 14 3HZ LYS 14 -9.066 4.463 4.977
88 HZ2 LYS 14 1HZ LYS 14 -8.475 4.645 6.556
89 HZ3 LYS 14 2HZ LYS 14 -9.403 3.280 6.149
90 H CYS 15 H CYS 15 -1.255 1.173 3.370
91 HA CYS 15 HA CYS 15 0.891 1.904 3.730
92 HB2 CYS 15 2HB CYS 15 -0.338 4.432 2.637
93 HB3 CYS 15 1HB CYS 15 1.371 4.209 2.902
94 H CYS 16 H CYS 16 2.006 2.430 5.465
95 HA CYS 16 HA CYS 16 0.722 4.112 7.522
96 HB2 CYS 16 2HB CYS 16 1.915 1.569 7.656
97 HB3 CYS 16 1HB CYS 16 3.055 2.671 8.419
98 H HIS 17 H HIS 17 3.672 3.659 5.638
99 HA HIS 17 HA HIS 17 5.031 5.779 7.095
100 HB2 HIS 17 1HB HIS 17 5.880 3.913 4.905
101 HB3 HIS 17 2HB HIS 17 6.873 5.271 5.421
102 HD1 HIS 17 HD1 HIS 17 5.283 2.111 6.805
103 HD2 HIS 17 HD2 HIS 17 8.275 4.836 7.804
104 HE1 HIS 17 HE1 HIS 17 6.495 1.141 8.808
105 H GLY 18 H GLY 18 2.686 6.011 5.168
106 HA2 GLY 18 1HA GLY 18 1.940 7.990 4.115
107 HA3 GLY 18 2HA GLY 18 3.620 8.491 3.922
108 H LEU 19 H LEU 19 3.697 5.389 3.147
109 HA LEU 19 HA LEU 19 4.205 5.667 0.436
110 HB2 LEU 19 1HB LEU 19 3.037 3.237 1.815
111 HB3 LEU 19 2HB LEU 19 3.896 3.243 0.297
112 HG LEU 19 HG LEU 19 5.221 4.382 2.731
113 HD11 LEU 19 1HD1 LEU 19 5.124 1.442 1.980
114 HD12 LEU 19 2HD1 LEU 19 4.308 2.140 3.382
115 HD13 LEU 19 3HD1 LEU 19 6.070 2.145 3.289
116 HD21 LEU 19 3HD2 LEU 19 6.195 2.819 0.318
117 HD22 LEU 19 1HD2 LEU 19 7.216 3.574 1.546
118 HD23 LEU 19 2HD2 LEU 19 6.242 4.576 0.472
119 H ASP 20 H ASP 20 2.915 4.847 -1.401
120 HA ASP 20 HA ASP 20 0.018 5.388 -1.083
121 HB2 ASP 20 1HB ASP 20 1.486 7.142 -2.325
122 HB3 ASP 20 2HB ASP 20 1.523 5.947 -3.619
123 H CYS 21 H CYS 21 -1.381 4.014 -2.095
124 HA CYS 21 HA CYS 21 -0.244 1.931 -3.832
125 HB2 CYS 21 2HB CYS 21 -2.131 0.506 -2.495
126 HB3 CYS 21 1HB CYS 21 -0.424 0.541 -2.058
127 HA PRO 22 HA PRO 22 -3.892 3.363 -6.089
128 HB2 PRO 22 2HB PRO 22 -3.428 1.985 -8.390
129 HB3 PRO 22 1HB PRO 22 -2.534 3.456 -7.959
130 HG2 PRO 22 2HG PRO 22 -1.704 0.608 -7.723
131 HG3 PRO 22 1HG PRO 22 -0.759 2.021 -8.203
132 HD2 PRO 22 2HD PRO 22 -0.649 0.880 -5.733
133 HD3 PRO 22 1HD PRO 22 -0.271 2.587 -6.050
134 H LEU 23 H LEU 23 -5.781 2.348 -7.164
135 HA LEU 23 HA LEU 23 -6.536 -0.089 -5.739
136 HB2 LEU 23 1HB LEU 23 -7.957 2.124 -7.133
137 HB3 LEU 23 2HB LEU 23 -8.748 0.550 -7.102
138 HG LEU 23 HG LEU 23 -8.714 0.485 -4.697
139 HD11 LEU 23 1HD1 LEU 23 -7.779 2.709 -3.582
140 HD12 LEU 23 2HD1 LEU 23 -6.767 2.744 -5.025
141 HD13 LEU 23 3HD1 LEU 23 -6.694 1.362 -3.929
142 HD21 LEU 23 3HD2 LEU 23 -10.141 2.333 -4.196
143 HD22 LEU 23 1HD2 LEU 23 -10.386 1.986 -5.908
144 HD23 LEU 23 2HD2 LEU 23 -9.369 3.343 -5.422
145 H ALA 24 H ALA 24 -5.618 -1.788 -6.729
146 HA ALA 24 HA ALA 24 -6.471 -2.395 -9.472
147 HB1 ALA 24 3HB ALA 24 -4.374 -2.514 -10.344
148 HB2 ALA 24 1HB ALA 24 -3.690 -3.167 -8.853
149 HB3 ALA 24 2HB ALA 24 -3.955 -1.431 -9.014
150 H PHE 25 H PHE 25 -5.179 -4.754 -9.854
151 HA PHE 25 HA PHE 25 -6.692 -6.591 -8.363
152 HB2 PHE 25 2HB PHE 25 -5.813 -7.145 -10.558
153 HB3 PHE 25 1HB PHE 25 -4.158 -7.001 -9.964
154 HD1 PHE 25 1HD PHE 25 -7.336 -8.906 -9.479
155 HD2 PHE 25 2HD PHE 25 -3.080 -8.809 -8.916
156 HE1 PHE 25 1HE PHE 25 -7.382 -11.267 -8.722
157 HE2 PHE 25 2HE PHE 25 -3.124 -11.167 -8.159
158 HZ PHE 25 HZ PHE 25 -5.277 -12.399 -8.063
159 H ILE 26 H ILE 26 -3.210 -5.795 -8.108
160 HA ILE 26 HA ILE 26 -3.316 -6.492 -5.270
161 HB ILE 26 HB ILE 26 -2.602 -8.554 -6.493
162 HG12 ILE 26 1HG1 ILE 26 -0.291 -8.641 -5.188
163 HG13 ILE 26 2HG1 ILE 26 -0.889 -7.133 -4.497
164 HG21 ILE 26 1HG2 ILE 26 -1.165 -6.820 -8.068
165 HG22 ILE 26 2HG2 ILE 26 -0.929 -8.565 -8.014
166 HG23 ILE 26 3HG2 ILE 26 0.088 -7.511 -7.032
167 HD11 ILE 26 3HD1 ILE 26 -3.111 -8.534 -4.183
168 HD12 ILE 26 1HD1 ILE 26 -1.798 -8.648 -3.013
169 HD13 ILE 26 2HD1 ILE 26 -1.997 -9.898 -4.241
170 HA PRO 27 HA PRO 27 -0.828 -2.696 -6.320
171 HB2 PRO 27 2HB PRO 27 -2.415 -1.492 -4.165
172 HB3 PRO 27 1HB PRO 27 -2.167 -0.942 -5.829
173 HG2 PRO 27 2HG PRO 27 -4.525 -1.920 -5.011
174 HG3 PRO 27 1HG PRO 27 -3.898 -2.183 -6.649
175 HD2 PRO 27 2HD PRO 27 -3.876 -4.066 -4.310
176 HD3 PRO 27 1HD PRO 27 -4.276 -4.391 -6.013
177 H TYR 28 H TYR 28 0.747 -1.644 -4.994
178 HA TYR 28 HA TYR 28 1.191 -2.888 -2.357
179 HB2 TYR 28 2HB TYR 28 2.991 -2.702 -4.707
180 HB3 TYR 28 1HB TYR 28 3.716 -2.408 -3.126
181 HD1 TYR 28 1HD TYR 28 1.324 -4.818 -4.785
182 HD2 TYR 28 2HD TYR 28 4.474 -4.239 -1.902
183 HE1 TYR 28 1HE TYR 28 1.377 -7.250 -4.332
184 HE2 TYR 28 2HE TYR 28 4.505 -6.674 -1.455
185 HH TYR 28 HH TYR 28 3.824 -8.696 -2.251
186 H CYS 29 H CYS 29 2.144 -1.610 -0.785
187 HA CYS 29 HA CYS 29 1.616 1.210 -1.016
188 HB2 CYS 29 2HB CYS 29 2.290 -0.718 1.107
189 HB3 CYS 29 1HB CYS 29 2.948 0.893 1.354
190 H GLU 30 H GLU 30 3.091 1.711 -2.744
191 HA GLU 30 HA GLU 30 5.946 1.643 -2.016
192 HB2 GLU 30 1HB GLU 30 4.552 2.086 -4.661
193 HB3 GLU 30 2HB GLU 30 6.289 2.273 -4.429
194 HG2 GLU 30 1HG GLU 30 6.500 -0.043 -3.733
195 HG3 GLU 30 2HG GLU 30 4.752 -0.257 -3.779
196 H LYS 31 H LYS 31 7.236 3.513 -2.264
197 HA LYS 31 HA LYS 31 5.867 5.935 -1.462
198 HB2 LYS 31 1HB LYS 31 8.565 6.543 -1.828
199 HB3 LYS 31 2HB LYS 31 7.768 6.152 -0.307
200 HG2 LYS 31 1HG LYS 31 9.682 4.697 -0.590
201 HG3 LYS 31 2HG LYS 31 8.224 3.727 -0.741
202 HD2 LYS 31 1HD LYS 31 8.838 3.090 -2.817
203 HD3 LYS 31 2HD LYS 31 8.950 4.775 -3.327
204 HE2 LYS 31 1HE LYS 31 11.117 3.608 -3.588
205 HE3 LYS 31 2HE LYS 31 11.228 4.912 -2.406
206 HZ1 LYS 31 3HZ LYS 31 10.475 2.272 -1.419
207 HZ2 LYS 31 1HZ LYS 31 11.429 3.471 -0.690
208 HZ3 LYS 31 2HZ LYS 31 12.091 2.482 -1.902
209 H TYR 32 H TYR 32 6.070 7.958 -2.537
210 HA TYR 32 HA TYR 32 6.943 7.841 -5.353
211 HB2 TYR 32 2HB TYR 32 4.307 8.899 -4.322
212 HB3 TYR 32 1HB TYR 32 4.941 9.256 -5.929
213 HD1 TYR 32 1HD TYR 32 3.842 6.508 -3.672
214 HD2 TYR 32 2HD TYR 32 4.879 7.643 -7.683
215 HE1 TYR 32 1HE TYR 32 2.980 4.338 -4.511
216 HE2 TYR 32 2HE TYR 32 4.018 5.474 -8.521
217 HH TYR 32 HH TYR 32 2.577 3.711 -7.903
218 H ARG 33 H ARG 33 7.720 9.774 -6.218
219 HA ARG 33 HA ARG 33 8.521 11.749 -4.200
220 HB2 ARG 33 1HB ARG 33 10.034 12.561 -6.058
221 HB3 ARG 33 2HB ARG 33 10.357 10.923 -5.495
222 HG2 ARG 33 1HG ARG 33 9.140 9.979 -7.375
223 HG3 ARG 33 2HG ARG 33 8.642 11.587 -7.904
224 HD2 ARG 33 1HD ARG 33 11.525 10.677 -7.695
225 HD3 ARG 33 2HD ARG 33 10.594 10.687 -9.190
226 HE ARG 33 HE ARG 33 10.409 13.254 -8.125
227 HH11 ARG 33 1HH1 ARG 33 11.800 14.898 -8.847
228 HH12 ARG 33 2HH1 ARG 33 13.318 14.485 -9.572
229 HH21 ARG 33 2HH2 ARG 33 13.907 12.314 -9.800
230 HH22 ARG 33 1HH2 ARG 33 12.842 11.065 -9.248
Start of MODEL 19
1 HA ASN 1 HA ASN 1 0.363 -1.914 12.884
2 HB2 ASN 1 1HB ASN 1 -1.651 -0.607 13.466
3 HB3 ASN 1 2HB ASN 1 -0.339 -0.293 14.602
4 HD21 ASN 1 1HD2 ASN 1 -1.259 3.111 13.946
5 HD22 ASN 1 2HD2 ASN 1 -1.510 1.820 15.018
6 H CYS 2 H CYS 2 1.535 0.283 10.735
7 HA CYS 2 HA CYS 2 -0.672 -0.024 8.816
8 HB2 CYS 2 2HB CYS 2 0.958 1.649 7.556
9 HB3 CYS 2 1HB CYS 2 -0.203 2.210 8.759
10 H ALA 3 H ALA 3 0.252 -0.115 6.466
11 HA ALA 3 HA ALA 3 1.641 -2.614 6.251
12 HB1 ALA 3 3HB ALA 3 0.266 -0.759 4.438
13 HB2 ALA 3 1HB ALA 3 0.337 -2.521 4.407
14 HB3 ALA 3 2HB ALA 3 1.659 -1.570 3.719
15 H LYS 4 H LYS 4 3.675 -3.026 5.488
16 HA LYS 4 HA LYS 4 5.520 -0.729 5.488
17 HB2 LYS 4 1HB LYS 4 6.075 -3.674 5.846
18 HB3 LYS 4 2HB LYS 4 7.280 -2.386 5.883
19 HG2 LYS 4 1HG LYS 4 5.952 -1.317 7.745
20 HG3 LYS 4 2HG LYS 4 4.961 -2.775 7.785
21 HD2 LYS 4 1HD LYS 4 6.964 -4.140 8.211
22 HD3 LYS 4 2HD LYS 4 7.957 -2.683 8.161
23 HE2 LYS 4 1HE LYS 4 6.713 -1.762 10.082
24 HE3 LYS 4 2HE LYS 4 5.719 -3.217 10.137
25 HZ1 LYS 4 3HZ LYS 4 8.501 -3.833 10.115
26 HZ2 LYS 4 1HZ LYS 4 7.303 -4.308 11.216
27 HZ3 LYS 4 2HZ LYS 4 8.103 -2.825 11.424
28 H GLU 5 H GLU 5 6.891 -0.395 3.772
29 HA GLU 5 HA GLU 5 6.189 -0.650 1.226
30 HB2 GLU 5 1HB GLU 5 8.257 0.482 2.052
31 HB3 GLU 5 2HB GLU 5 9.035 -1.098 2.154
32 HG2 GLU 5 1HG GLU 5 8.637 -1.445 -0.252
33 HG3 GLU 5 2HG GLU 5 7.872 0.136 -0.354
34 H GLY 6 H GLY 6 5.574 -2.275 -0.016
35 HA2 GLY 6 1HA GLY 6 6.179 -4.287 -1.240
36 HA3 GLY 6 2HA GLY 6 6.948 -4.883 0.230
37 H GLU 7 H GLU 7 4.257 -3.450 1.350
38 HA GLU 7 HA GLU 7 2.813 -5.975 1.508
39 HB2 GLU 7 1HB GLU 7 2.888 -3.440 3.051
40 HB3 GLU 7 2HB GLU 7 1.357 -4.314 3.022
41 HG2 GLU 7 1HG GLU 7 2.907 -4.991 4.898
42 HG3 GLU 7 2HG GLU 7 2.394 -6.309 3.850
43 H VAL 8 H VAL 8 0.598 -6.168 0.970
44 HA VAL 8 HA VAL 8 -0.170 -4.621 -1.347
45 HB VAL 8 HB VAL 8 -1.843 -6.209 -1.685
46 HG11 VAL 8 1HG1 VAL 8 -0.183 -8.078 -0.108
47 HG12 VAL 8 2HG1 VAL 8 0.711 -7.047 -1.223
48 HG13 VAL 8 3HG1 VAL 8 -0.572 -8.093 -1.829
49 HG21 VAL 8 3HG2 VAL 8 -2.437 -7.779 0.322
50 HG22 VAL 8 1HG2 VAL 8 -3.113 -6.149 0.300
51 HG23 VAL 8 2HG2 VAL 8 -1.715 -6.512 1.312
52 H CYS 9 H CYS 9 -1.919 -3.238 -1.552
53 HA CYS 9 HA CYS 9 -3.287 -2.497 0.987
54 HB2 CYS 9 2HB CYS 9 -2.548 -0.391 0.859
55 HB3 CYS 9 1HB CYS 9 -1.496 -0.891 -0.459
56 H GLY 10 H GLY 10 -5.263 -1.104 0.501
57 HA2 GLY 10 1HA GLY 10 -7.218 -0.681 -0.683
58 HA3 GLY 10 2HA GLY 10 -6.543 -1.559 -2.053
59 H TRP 11 H TRP 11 -5.881 -3.628 0.223
60 HA TRP 11 HA TRP 11 -8.533 -4.725 0.553
61 HB2 TRP 11 2HB TRP 11 -6.331 -6.374 -0.636
62 HB3 TRP 11 1HB TRP 11 -8.024 -6.802 -0.453
63 HD1 TRP 11 1HD TRP 11 -5.677 -5.391 -2.887
64 HE1 TRP 11 1HE TRP 11 -6.950 -4.381 -4.892
65 HE3 TRP 11 3HE TRP 11 -10.337 -5.237 -0.914
66 HZ2 TRP 11 2HZ TRP 11 -9.637 -3.601 -5.552
67 HZ3 TRP 11 3HZ TRP 11 -12.261 -4.352 -2.231
68 HH2 TRP 11 2HH TRP 11 -11.906 -3.531 -4.545
69 H GLY 12 H GLY 12 -5.530 -4.035 1.711
70 HA2 GLY 12 1HA GLY 12 -5.960 -5.706 4.085
71 HA3 GLY 12 2HA GLY 12 -4.412 -5.840 3.254
72 H SER 13 H SER 13 -4.343 -3.004 2.491
73 HA SER 13 HA SER 13 -4.331 -1.560 5.017
74 HB2 SER 13 1HB SER 13 -2.116 -2.876 4.750
75 HB3 SER 13 2HB SER 13 -1.751 -1.702 3.486
76 HG SER 13 HG SER 13 -2.612 -0.951 6.076
77 H LYS 14 H LYS 14 -2.900 0.624 4.373
78 HA LYS 14 HA LYS 14 -3.658 1.538 1.716
79 HB2 LYS 14 1HB LYS 14 -4.795 3.583 2.806
80 HB3 LYS 14 2HB LYS 14 -5.701 2.070 2.750
81 HG2 LYS 14 1HG LYS 14 -5.353 1.623 5.028
82 HG3 LYS 14 2HG LYS 14 -3.971 2.715 5.125
83 HD2 LYS 14 1HD LYS 14 -5.899 3.733 6.232
84 HD3 LYS 14 2HD LYS 14 -5.501 4.645 4.777
85 HE2 LYS 14 1HE LYS 14 -7.291 3.555 3.543
86 HE3 LYS 14 2HE LYS 14 -7.633 2.491 4.909
87 HZ1 LYS 14 3HZ LYS 14 -8.793 4.906 4.428
88 HZ2 LYS 14 1HZ LYS 14 -7.648 5.263 5.627
89 HZ3 LYS 14 2HZ LYS 14 -8.821 4.067 5.904
90 H CYS 15 H CYS 15 -1.128 1.130 2.903
91 HA CYS 15 HA CYS 15 0.891 2.175 3.232
92 HB2 CYS 15 2HB CYS 15 -0.653 4.177 1.619
93 HB3 CYS 15 1HB CYS 15 0.940 4.555 2.209
94 H CYS 16 H CYS 16 1.648 2.770 5.118
95 HA CYS 16 HA CYS 16 0.295 3.881 7.207
96 HB2 CYS 16 2HB CYS 16 2.780 3.003 6.949
97 HB3 CYS 16 1HB CYS 16 3.125 4.729 6.837
98 H HIS 17 H HIS 17 2.530 5.790 5.190
99 HA HIS 17 HA HIS 17 0.721 7.924 4.785
100 HB2 HIS 17 1HB HIS 17 1.348 8.010 7.363
101 HB3 HIS 17 2HB HIS 17 2.818 8.761 6.746
102 HD1 HIS 17 HD1 HIS 17 -0.954 9.154 6.297
103 HD2 HIS 17 HD2 HIS 17 2.513 11.467 6.314
104 HE1 HIS 17 HE1 HIS 17 -1.698 11.558 6.020
105 H GLY 18 H GLY 18 3.916 6.706 5.052
106 HA2 GLY 18 1HA GLY 18 5.006 8.765 3.247
107 HA3 GLY 18 2HA GLY 18 5.947 7.565 4.128
108 H LEU 19 H LEU 19 3.313 6.030 2.850
109 HA LEU 19 HA LEU 19 4.816 5.195 0.448
110 HB2 LEU 19 1HB LEU 19 2.986 3.613 2.256
111 HB3 LEU 19 2HB LEU 19 3.654 3.008 0.753
112 HG LEU 19 HG LEU 19 5.337 4.033 3.055
113 HD11 LEU 19 1HD1 LEU 19 5.147 1.139 2.307
114 HD12 LEU 19 2HD1 LEU 19 3.886 1.822 3.333
115 HD13 LEU 19 3HD1 LEU 19 5.568 1.867 3.856
116 HD21 LEU 19 3HD2 LEU 19 6.747 4.125 1.219
117 HD22 LEU 19 1HD2 LEU 19 5.887 2.852 0.351
118 HD23 LEU 19 2HD2 LEU 19 6.971 2.440 1.679
119 H ASP 20 H ASP 20 3.520 4.556 -1.376
120 HA ASP 20 HA ASP 20 0.797 5.708 -1.411
121 HB2 ASP 20 1HB ASP 20 2.508 7.219 -2.501
122 HB3 ASP 20 2HB ASP 20 2.779 5.923 -3.669
123 H CYS 21 H CYS 21 -0.616 4.154 -1.959
124 HA CYS 21 HA CYS 21 0.339 2.019 -3.747
125 HB2 CYS 21 2HB CYS 21 -1.044 0.457 -2.636
126 HB3 CYS 21 1HB CYS 21 -0.197 1.346 -1.387
127 HA PRO 22 HA PRO 22 -2.825 3.816 -6.476
128 HB2 PRO 22 2HB PRO 22 -2.309 1.319 -8.009
129 HB3 PRO 22 1HB PRO 22 -2.236 3.005 -8.549
130 HG2 PRO 22 2HG PRO 22 -0.033 1.549 -8.158
131 HG3 PRO 22 1HG PRO 22 -0.082 3.281 -7.824
132 HD2 PRO 22 2HD PRO 22 -0.069 0.994 -5.916
133 HD3 PRO 22 1HD PRO 22 0.605 2.628 -5.775
134 H LEU 23 H LEU 23 -4.980 3.309 -6.980
135 HA LEU 23 HA LEU 23 -6.138 1.176 -5.365
136 HB2 LEU 23 1HB LEU 23 -7.068 3.698 -6.584
137 HB3 LEU 23 2HB LEU 23 -8.248 2.390 -6.583
138 HG LEU 23 HG LEU 23 -8.111 2.151 -4.197
139 HD11 LEU 23 1HD1 LEU 23 -6.518 4.069 -3.122
140 HD12 LEU 23 2HD1 LEU 23 -5.587 3.676 -4.566
141 HD13 LEU 23 3HD1 LEU 23 -5.974 2.412 -3.394
142 HD21 LEU 23 3HD2 LEU 23 -8.882 4.323 -3.479
143 HD22 LEU 23 1HD2 LEU 23 -9.408 4.091 -5.147
144 HD23 LEU 23 2HD2 LEU 23 -8.011 5.111 -4.797
145 H ALA 24 H ALA 24 -5.691 -0.708 -6.438
146 HA ALA 24 HA ALA 24 -7.083 -1.072 -9.012
147 HB1 ALA 24 3HB ALA 24 -5.263 -2.542 -9.763
148 HB2 ALA 24 1HB ALA 24 -4.372 -2.216 -8.273
149 HB3 ALA 24 2HB ALA 24 -4.657 -0.920 -9.435
150 H PHE 25 H PHE 25 -5.650 -3.866 -8.619
151 HA PHE 25 HA PHE 25 -7.819 -4.988 -6.941
152 HB2 PHE 25 2HB PHE 25 -6.250 -6.750 -8.733
153 HB3 PHE 25 1HB PHE 25 -7.973 -6.740 -8.381
154 HD1 PHE 25 1HD PHE 25 -5.546 -5.984 -10.822
155 HD2 PHE 25 2HD PHE 25 -9.277 -4.575 -9.226
156 HE1 PHE 25 1HE PHE 25 -5.967 -4.733 -12.916
157 HE2 PHE 25 2HE PHE 25 -9.699 -3.324 -11.325
158 HZ PHE 25 HZ PHE 25 -8.045 -3.404 -13.172
159 H ILE 26 H ILE 26 -4.377 -5.205 -7.737
160 HA ILE 26 HA ILE 26 -3.897 -6.316 -5.050
161 HB ILE 26 HB ILE 26 -1.944 -7.603 -6.261
162 HG12 ILE 26 1HG1 ILE 26 -2.660 -8.430 -8.489
163 HG13 ILE 26 2HG1 ILE 26 -4.018 -7.315 -8.466
164 HG21 ILE 26 1HG2 ILE 26 -4.857 -8.352 -6.126
165 HG22 ILE 26 2HG2 ILE 26 -3.552 -8.810 -5.031
166 HG23 ILE 26 3HG2 ILE 26 -3.628 -9.501 -6.652
167 HD11 ILE 26 3HD1 ILE 26 -1.127 -6.426 -8.254
168 HD12 ILE 26 1HD1 ILE 26 -2.547 -5.403 -8.510
169 HD13 ILE 26 2HD1 ILE 26 -2.014 -6.509 -9.774
170 HA PRO 27 HA PRO 27 -1.130 -2.719 -6.383
171 HB2 PRO 27 2HB PRO 27 -2.100 -0.830 -4.681
172 HB3 PRO 27 1HB PRO 27 -2.719 -1.086 -6.322
173 HG2 PRO 27 2HG PRO 27 -3.816 -2.006 -3.726
174 HG3 PRO 27 1HG PRO 27 -4.666 -1.351 -5.130
175 HD2 PRO 27 2HD PRO 27 -4.575 -4.027 -4.608
176 HD3 PRO 27 1HD PRO 27 -4.654 -3.365 -6.256
177 H TYR 28 H TYR 28 0.604 -1.864 -5.168
178 HA TYR 28 HA TYR 28 0.977 -3.012 -2.475
179 HB2 TYR 28 2HB TYR 28 2.788 -2.974 -4.855
180 HB3 TYR 28 1HB TYR 28 3.488 -2.927 -3.238
181 HD1 TYR 28 1HD TYR 28 0.802 -4.776 -5.115
182 HD2 TYR 28 2HD TYR 28 3.955 -4.968 -2.206
183 HE1 TYR 28 1HE TYR 28 0.442 -7.207 -4.887
184 HE2 TYR 28 2HE TYR 28 3.600 -7.406 -1.982
185 HH TYR 28 HH TYR 28 0.855 -8.989 -3.247
186 H CYS 29 H CYS 29 2.253 -1.851 -1.013
187 HA CYS 29 HA CYS 29 2.058 1.024 -1.348
188 HB2 CYS 29 2HB CYS 29 2.493 -0.861 0.902
189 HB3 CYS 29 1HB CYS 29 3.220 0.736 1.058
190 H GLU 30 H GLU 30 3.575 1.987 -2.504
191 HA GLU 30 HA GLU 30 6.402 1.274 -1.912
192 HB2 GLU 30 1HB GLU 30 6.954 1.802 -4.228
193 HB3 GLU 30 2HB GLU 30 5.713 0.547 -4.182
194 HG2 GLU 30 1HG GLU 30 3.985 2.364 -4.424
195 HG3 GLU 30 2HG GLU 30 5.300 3.503 -4.701
196 H LYS 31 H LYS 31 7.848 2.956 -1.721
197 HA LYS 31 HA LYS 31 6.861 5.415 -0.736
198 HB2 LYS 31 1HB LYS 31 9.102 6.002 -0.396
199 HB3 LYS 31 2HB LYS 31 9.152 4.238 -0.334
200 HG2 LYS 31 1HG LYS 31 9.558 4.442 -2.926
201 HG3 LYS 31 2HG LYS 31 10.070 6.081 -2.521
202 HD2 LYS 31 1HD LYS 31 11.185 3.543 -1.286
203 HD3 LYS 31 2HD LYS 31 11.986 4.510 -2.523
204 HE2 LYS 31 1HE LYS 31 11.251 5.435 0.271
205 HE3 LYS 31 2HE LYS 31 12.875 5.097 -0.324
206 HZ1 LYS 31 3HZ LYS 31 12.504 6.832 -2.029
207 HZ2 LYS 31 1HZ LYS 31 12.513 7.430 -0.442
208 HZ3 LYS 31 2HZ LYS 31 11.039 7.228 -1.262
209 H TYR 32 H TYR 32 7.413 7.573 -1.623
210 HA TYR 32 HA TYR 32 6.443 7.839 -4.296
211 HB2 TYR 32 2HB TYR 32 7.659 9.827 -2.366
212 HB3 TYR 32 1HB TYR 32 7.001 10.272 -3.940
213 HD1 TYR 32 1HD TYR 32 6.209 9.087 -0.552
214 HD2 TYR 32 2HD TYR 32 4.599 10.094 -4.405
215 HE1 TYR 32 1HE TYR 32 3.925 9.132 0.414
216 HE2 TYR 32 2HE TYR 32 2.316 10.139 -3.439
217 HH TYR 32 HH TYR 32 1.625 10.456 -0.372
218 H ARG 33 H ARG 33 7.515 8.289 -6.172
219 HA ARG 33 HA ARG 33 10.471 8.362 -6.067
220 HB2 ARG 33 1HB ARG 33 8.727 6.937 -8.092
221 HB3 ARG 33 2HB ARG 33 10.485 7.054 -8.153
222 HG2 ARG 33 1HG ARG 33 10.659 5.869 -6.007
223 HG3 ARG 33 2HG ARG 33 8.900 5.783 -5.902
224 HD2 ARG 33 1HD ARG 33 9.718 3.666 -6.762
225 HD3 ARG 33 2HD ARG 33 8.887 4.515 -8.063
226 HE ARG 33 HE ARG 33 11.674 5.124 -8.081
227 HH11 ARG 33 1HH1 ARG 33 12.936 4.169 -9.711
228 HH12 ARG 33 2HH1 ARG 33 12.337 2.785 -10.564
229 HH21 ARG 33 2HH2 ARG 33 10.306 1.935 -10.055
230 HH22 ARG 33 1HH2 ARG 33 9.347 2.669 -8.812
Start of MODEL 20
1 HA ASN 1 HA ASN 1 0.387 -0.720 12.508
2 HB2 ASN 1 1HB ASN 1 -0.904 -3.445 12.196
3 HB3 ASN 1 2HB ASN 1 0.779 -3.119 11.783
4 HD21 ASN 1 1HD2 ASN 1 0.534 -4.300 15.363
5 HD22 ASN 1 2HD2 ASN 1 -0.017 -4.950 13.894
6 H CYS 2 H CYS 2 0.792 0.334 10.655
7 HA CYS 2 HA CYS 2 -0.914 0.112 8.356
8 HB2 CYS 2 2HB CYS 2 0.535 1.758 7.377
9 HB3 CYS 2 1HB CYS 2 0.202 2.225 9.041
10 H ALA 3 H ALA 3 0.778 0.228 6.220
11 HA ALA 3 HA ALA 3 1.874 -2.510 6.192
12 HB1 ALA 3 3HB ALA 3 1.802 -1.644 3.575
13 HB2 ALA 3 1HB ALA 3 0.357 -0.911 4.281
14 HB3 ALA 3 2HB ALA 3 0.582 -2.657 4.360
15 H LYS 4 H LYS 4 3.943 -2.912 5.507
16 HA LYS 4 HA LYS 4 5.722 -0.571 5.317
17 HB2 LYS 4 1HB LYS 4 6.333 -3.509 5.753
18 HB3 LYS 4 2HB LYS 4 7.529 -2.212 5.719
19 HG2 LYS 4 1HG LYS 4 6.227 -1.100 7.586
20 HG3 LYS 4 2HG LYS 4 5.279 -2.582 7.708
21 HD2 LYS 4 1HD LYS 4 7.360 -3.868 8.082
22 HD3 LYS 4 2HD LYS 4 8.278 -2.365 7.998
23 HE2 LYS 4 1HE LYS 4 6.101 -2.969 10.024
24 HE3 LYS 4 2HE LYS 4 7.834 -3.012 10.350
25 HZ1 LYS 4 3HZ LYS 4 7.996 -0.692 9.837
26 HZ2 LYS 4 1HZ LYS 4 6.777 -0.902 10.998
27 HZ3 LYS 4 2HZ LYS 4 6.364 -0.625 9.373
28 H GLU 5 H GLU 5 7.051 -0.249 3.588
29 HA GLU 5 HA GLU 5 6.270 -0.613 1.070
30 HB2 GLU 5 1HB GLU 5 8.283 0.694 1.758
31 HB3 GLU 5 2HB GLU 5 9.168 -0.822 1.934
32 HG2 GLU 5 1HG GLU 5 8.798 -1.339 -0.424
33 HG3 GLU 5 2HG GLU 5 7.858 0.139 -0.618
34 H GLY 6 H GLY 6 5.829 -2.281 -0.196
35 HA2 GLY 6 1HA GLY 6 6.524 -4.289 -1.351
36 HA3 GLY 6 2HA GLY 6 7.370 -4.785 0.113
37 H GLU 7 H GLU 7 4.605 -3.518 1.253
38 HA GLU 7 HA GLU 7 3.335 -6.161 1.438
39 HB2 GLU 7 1HB GLU 7 3.000 -3.610 3.021
40 HB3 GLU 7 2HB GLU 7 1.937 -5.004 3.214
41 HG2 GLU 7 1HG GLU 7 3.926 -6.419 3.703
42 HG3 GLU 7 2HG GLU 7 4.947 -4.988 3.598
43 H VAL 8 H VAL 8 1.092 -6.440 1.062
44 HA VAL 8 HA VAL 8 0.123 -4.990 -1.214
45 HB VAL 8 HB VAL 8 -1.591 -6.563 -1.312
46 HG11 VAL 8 1HG1 VAL 8 0.965 -7.416 -1.023
47 HG12 VAL 8 2HG1 VAL 8 -0.378 -8.497 -1.385
48 HG13 VAL 8 3HG1 VAL 8 0.192 -8.321 0.276
49 HG21 VAL 8 3HG2 VAL 8 -2.706 -6.346 0.754
50 HG22 VAL 8 1HG2 VAL 8 -1.245 -6.683 1.681
51 HG23 VAL 8 2HG2 VAL 8 -2.063 -7.986 0.821
52 H CYS 9 H CYS 9 -1.489 -3.476 -1.356
53 HA CYS 9 HA CYS 9 -3.066 -2.793 0.992
54 HB2 CYS 9 2HB CYS 9 -2.369 -0.313 0.569
55 HB3 CYS 9 1HB CYS 9 -1.328 -1.346 1.541
56 H GLY 10 H GLY 10 -4.706 -1.093 0.486
57 HA2 GLY 10 1HA GLY 10 -5.995 0.106 -1.157
58 HA3 GLY 10 2HA GLY 10 -5.383 -0.993 -2.385
59 H TRP 11 H TRP 11 -5.889 -3.107 -0.096
60 HA TRP 11 HA TRP 11 -8.782 -3.233 -0.352
61 HB2 TRP 11 2HB TRP 11 -6.978 -5.526 -1.058
62 HB3 TRP 11 1HB TRP 11 -8.736 -5.532 -1.084
63 HD1 TRP 11 1HD TRP 11 -5.899 -5.047 -3.253
64 HE1 TRP 11 1HE TRP 11 -6.571 -3.930 -5.477
65 HE3 TRP 11 3HE TRP 11 -10.429 -3.301 -1.906
66 HZ2 TRP 11 2HZ TRP 11 -8.821 -2.372 -6.504
67 HZ3 TRP 11 3HZ TRP 11 -11.831 -1.985 -3.471
68 HH2 TRP 11 2HH TRP 11 -11.028 -1.516 -5.768
69 H GLY 12 H GLY 12 -6.032 -3.523 1.488
70 HA2 GLY 12 1HA GLY 12 -7.559 -4.619 3.734
71 HA3 GLY 12 2HA GLY 12 -6.105 -5.493 3.261
72 H SER 13 H SER 13 -4.766 -2.984 2.442
73 HA SER 13 HA SER 13 -4.296 -1.747 5.077
74 HB2 SER 13 1HB SER 13 -2.241 -2.769 3.129
75 HB3 SER 13 2HB SER 13 -1.868 -1.637 4.419
76 HG SER 13 HG SER 13 -2.633 -4.327 4.525
77 H LYS 14 H LYS 14 -3.477 0.407 5.032
78 HA LYS 14 HA LYS 14 -3.904 1.798 2.465
79 HB2 LYS 14 1HB LYS 14 -4.645 2.674 5.267
80 HB3 LYS 14 2HB LYS 14 -4.674 3.736 3.859
81 HG2 LYS 14 1HG LYS 14 -6.253 2.179 2.740
82 HG3 LYS 14 2HG LYS 14 -6.263 1.176 4.191
83 HD2 LYS 14 1HD LYS 14 -7.146 3.053 5.506
84 HD3 LYS 14 2HD LYS 14 -7.101 4.088 4.079
85 HE2 LYS 14 1HE LYS 14 -9.372 3.226 4.407
86 HE3 LYS 14 2HE LYS 14 -8.678 2.544 2.935
87 HZ1 LYS 14 3HZ LYS 14 -9.659 1.183 5.165
88 HZ2 LYS 14 1HZ LYS 14 -7.985 0.909 5.106
89 HZ3 LYS 14 2HZ LYS 14 -8.956 0.529 3.764
90 H CYS 15 H CYS 15 -1.424 0.718 3.855
91 HA CYS 15 HA CYS 15 0.725 1.383 4.259
92 HB2 CYS 15 2HB CYS 15 -0.277 3.571 2.461
93 HB3 CYS 15 1HB CYS 15 1.381 3.485 3.015
94 H CYS 16 H CYS 16 2.090 2.960 5.363
95 HA CYS 16 HA CYS 16 0.820 4.045 7.664
96 HB2 CYS 16 2HB CYS 16 3.513 3.573 6.763
97 HB3 CYS 16 1HB CYS 16 3.374 5.181 7.474
98 H HIS 17 H HIS 17 2.964 5.844 5.476
99 HA HIS 17 HA HIS 17 1.021 7.836 4.871
100 HB2 HIS 17 1HB HIS 17 2.305 8.090 7.425
101 HB3 HIS 17 2HB HIS 17 2.875 9.388 6.375
102 HD1 HIS 17 HD1 HIS 17 -0.103 8.204 8.242
103 HD2 HIS 17 HD2 HIS 17 0.740 11.085 5.348
104 HE1 HIS 17 HE1 HIS 17 -2.107 9.750 8.165
105 H GLY 18 H GLY 18 4.291 6.804 5.151
106 HA2 GLY 18 1HA GLY 18 5.278 8.776 3.234
107 HA3 GLY 18 2HA GLY 18 6.233 7.523 4.022
108 H LEU 19 H LEU 19 3.531 6.018 2.997
109 HA LEU 19 HA LEU 19 4.647 5.367 0.352
110 HB2 LEU 19 1HB LEU 19 3.518 3.529 2.444
111 HB3 LEU 19 2HB LEU 19 3.904 3.043 0.806
112 HG LEU 19 HG LEU 19 5.971 4.360 2.559
113 HD11 LEU 19 1HD1 LEU 19 5.026 2.378 3.762
114 HD12 LEU 19 2HD1 LEU 19 6.699 2.132 3.260
115 HD13 LEU 19 3HD1 LEU 19 5.388 1.388 2.344
116 HD21 LEU 19 3HD2 LEU 19 6.047 2.486 0.174
117 HD22 LEU 19 1HD2 LEU 19 7.462 2.895 1.142
118 HD23 LEU 19 2HD2 LEU 19 6.620 4.158 0.244
119 H ASP 20 H ASP 20 3.041 4.356 -1.113
120 HA ASP 20 HA ASP 20 0.237 4.707 -0.483
121 HB2 ASP 20 1HB ASP 20 1.255 6.996 -1.229
122 HB3 ASP 20 2HB ASP 20 1.247 6.272 -2.835
123 H CYS 21 H CYS 21 -1.128 3.685 -1.991
124 HA CYS 21 HA CYS 21 0.241 2.199 -4.129
125 HB2 CYS 21 2HB CYS 21 -2.032 0.815 -2.973
126 HB3 CYS 21 1HB CYS 21 -0.421 0.211 -3.345
127 HA PRO 22 HA PRO 22 -3.177 3.699 -6.570
128 HB2 PRO 22 2HB PRO 22 -2.991 1.914 -8.644
129 HB3 PRO 22 1HB PRO 22 -1.874 3.279 -8.432
130 HG2 PRO 22 2HG PRO 22 -1.490 0.403 -7.758
131 HG3 PRO 22 1HG PRO 22 -0.338 1.569 -8.414
132 HD2 PRO 22 2HD PRO 22 -0.380 0.794 -5.807
133 HD3 PRO 22 1HD PRO 22 0.218 2.374 -6.354
134 H LEU 23 H LEU 23 -5.310 3.080 -7.276
135 HA LEU 23 HA LEU 23 -6.434 0.980 -5.629
136 HB2 LEU 23 1HB LEU 23 -7.564 3.071 -7.463
137 HB3 LEU 23 2HB LEU 23 -8.583 1.788 -6.813
138 HG LEU 23 HG LEU 23 -8.633 3.855 -5.411
139 HD11 LEU 23 1HD1 LEU 23 -8.808 2.647 -3.479
140 HD12 LEU 23 2HD1 LEU 23 -7.171 1.993 -3.624
141 HD13 LEU 23 3HD1 LEU 23 -8.502 1.266 -4.529
142 HD21 LEU 23 3HD2 LEU 23 -6.698 4.708 -4.371
143 HD22 LEU 23 1HD2 LEU 23 -6.144 4.308 -5.997
144 HD23 LEU 23 2HD2 LEU 23 -5.788 3.223 -4.653
145 H ALA 24 H ALA 24 -4.907 -0.431 -7.077
146 HA ALA 24 HA ALA 24 -6.312 -1.388 -9.469
147 HB1 ALA 24 3HB ALA 24 -3.520 -1.673 -8.434
148 HB2 ALA 24 1HB ALA 24 -4.082 -1.222 -10.042
149 HB3 ALA 24 2HB ALA 24 -4.164 -2.906 -9.520
150 H PHE 25 H PHE 25 -5.745 -3.966 -9.627
151 HA PHE 25 HA PHE 25 -7.630 -5.230 -7.994
152 HB2 PHE 25 2HB PHE 25 -5.356 -6.798 -9.124
153 HB3 PHE 25 1HB PHE 25 -7.076 -7.156 -9.124
154 HD1 PHE 25 1HD PHE 25 -4.354 -5.873 -11.013
155 HD2 PHE 25 2HD PHE 25 -8.611 -5.599 -10.539
156 HE1 PHE 25 1HE PHE 25 -4.538 -4.908 -13.278
157 HE2 PHE 25 2HE PHE 25 -8.800 -4.630 -12.815
158 HZ PHE 25 HZ PHE 25 -6.761 -4.283 -14.186
159 H ILE 26 H ILE 26 -4.071 -5.460 -7.866
160 HA ILE 26 HA ILE 26 -4.261 -5.922 -4.957
161 HB ILE 26 HB ILE 26 -2.341 -7.596 -5.270
162 HG12 ILE 26 1HG1 ILE 26 -3.543 -7.738 -8.044
163 HG13 ILE 26 2HG1 ILE 26 -2.016 -6.932 -7.694
164 HG21 ILE 26 1HG2 ILE 26 -5.127 -8.261 -6.274
165 HG22 ILE 26 2HG2 ILE 26 -4.621 -8.226 -4.584
166 HG23 ILE 26 3HG2 ILE 26 -3.948 -9.430 -5.682
167 HD11 ILE 26 3HD1 ILE 26 -1.052 -8.976 -6.879
168 HD12 ILE 26 1HD1 ILE 26 -1.771 -9.305 -8.454
169 HD13 ILE 26 2HD1 ILE 26 -2.606 -9.801 -6.983
170 HA PRO 27 HA PRO 27 -1.154 -2.673 -6.140
171 HB2 PRO 27 2HB PRO 27 -2.340 -1.287 -3.844
172 HB3 PRO 27 1HB PRO 27 -2.119 -0.721 -5.504
173 HG2 PRO 27 2HG PRO 27 -4.535 -1.295 -4.525
174 HG3 PRO 27 1HG PRO 27 -4.113 -1.614 -6.211
175 HD2 PRO 27 2HD PRO 27 -4.256 -3.532 -3.933
176 HD3 PRO 27 1HD PRO 27 -4.803 -3.726 -5.606
177 H TYR 28 H TYR 28 0.646 -1.852 -4.886
178 HA TYR 28 HA TYR 28 1.121 -3.292 -2.348
179 HB2 TYR 28 2HB TYR 28 2.763 -3.170 -4.814
180 HB3 TYR 28 1HB TYR 28 3.627 -3.058 -3.281
181 HD1 TYR 28 1HD TYR 28 0.812 -5.052 -4.802
182 HD2 TYR 28 2HD TYR 28 4.295 -5.057 -2.282
183 HE1 TYR 28 1HE TYR 28 0.588 -7.497 -4.494
184 HE2 TYR 28 2HE TYR 28 4.071 -7.504 -1.978
185 HH TYR 28 HH TYR 28 1.257 -9.244 -3.116
186 H CYS 29 H CYS 29 2.286 -2.224 -0.758
187 HA CYS 29 HA CYS 29 1.990 0.587 -0.673
188 HB2 CYS 29 2HB CYS 29 2.167 -1.208 1.255
189 HB3 CYS 29 1HB CYS 29 3.894 -0.898 1.117
190 H GLU 30 H GLU 30 3.065 1.631 -2.301
191 HA GLU 30 HA GLU 30 6.024 1.417 -2.223
192 HB2 GLU 30 1HB GLU 30 4.242 1.791 -4.638
193 HB3 GLU 30 2HB GLU 30 6.000 1.934 -4.659
194 HG2 GLU 30 1HG GLU 30 6.210 -0.386 -3.867
195 HG3 GLU 30 2HG GLU 30 4.454 -0.536 -3.820
196 H LYS 31 H LYS 31 7.181 3.366 -2.437
197 HA LYS 31 HA LYS 31 5.884 5.706 -1.501
198 HB2 LYS 31 1HB LYS 31 8.113 5.629 -0.887
199 HB3 LYS 31 2HB LYS 31 8.630 5.000 -2.452
200 HG2 LYS 31 1HG LYS 31 8.440 7.107 -3.493
201 HG3 LYS 31 2HG LYS 31 7.463 7.765 -2.178
202 HD2 LYS 31 1HD LYS 31 9.281 8.250 -0.900
203 HD3 LYS 31 2HD LYS 31 10.122 6.770 -1.366
204 HE2 LYS 31 1HE LYS 31 9.754 8.956 -3.389
205 HE3 LYS 31 2HE LYS 31 11.032 9.091 -2.185
206 HZ1 LYS 31 3HZ LYS 31 11.038 6.489 -3.231
207 HZ2 LYS 31 1HZ LYS 31 12.249 7.669 -3.333
208 HZ3 LYS 31 2HZ LYS 31 11.044 7.586 -4.527
209 H TYR 32 H TYR 32 5.065 7.419 -2.559
210 HA TYR 32 HA TYR 32 4.931 7.235 -5.491
211 HB2 TYR 32 2HB TYR 32 2.874 7.535 -3.949
212 HB3 TYR 32 1HB TYR 32 3.423 9.203 -3.787
213 HD1 TYR 32 1HD TYR 32 2.032 6.682 -6.046
214 HD2 TYR 32 2HD TYR 32 3.487 10.712 -5.738
215 HE1 TYR 32 1HE TYR 32 1.019 7.215 -8.250
216 HE2 TYR 32 2HE TYR 32 2.475 11.245 -7.940
217 HH TYR 32 HH TYR 32 1.462 8.940 -10.105
218 H ARG 33 H ARG 33 6.411 8.362 -6.590
219 HA ARG 33 HA ARG 33 7.461 10.868 -5.427
220 HB2 ARG 33 1HB ARG 33 9.332 10.489 -7.115
221 HB3 ARG 33 2HB ARG 33 9.256 9.346 -5.773
222 HG2 ARG 33 1HG ARG 33 8.124 7.707 -7.168
223 HG3 ARG 33 2HG ARG 33 8.023 8.860 -8.499
224 HD2 ARG 33 1HD ARG 33 10.632 7.920 -7.284
225 HD3 ARG 33 2HD ARG 33 9.908 7.203 -8.720
226 HE ARG 33 HE ARG 33 10.083 9.966 -9.154
227 HH11 ARG 33 1HH1 ARG 33 11.809 10.804 -10.369
228 HH12 ARG 33 2HH1 ARG 33 13.267 9.885 -10.540
229 HH21 ARG 33 2HH2 ARG 33 13.448 7.860 -9.552
230 HH22 ARG 33 1HH2 ARG 33 12.129 7.226 -8.627