NMR Restraints Grid
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NMR Restraints Grid |
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Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
8898 |
1n0z   |
5667 | cing | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 1H GLY 1 1H GLY 1 13.111 -10.084 3.512
2 2H GLY 1 2H GLY 1 14.750 -9.870 3.884
3 3H GLY 1 3H GLY 1 14.241 -11.273 3.086
4 1HA GLY 1 2HA GLY 1 14.504 -10.319 1.124
5 2HA GLY 1 1HA GLY 1 13.405 -9.032 1.607
6 H SER 2 H SER 2 15.496 -8.462 -0.058
7 HA SER 2 HA SER 2 17.809 -7.590 1.374
8 1HB SER 2 2HB SER 2 17.610 -6.228 -1.107
9 2HB SER 2 1HB SER 2 18.614 -7.625 -0.712
10 HG SER 2 HG SER 2 16.866 -7.708 -2.485
11 H MET 3 H MET 3 18.550 -5.375 1.489
12 HA MET 3 HA MET 3 18.396 -3.205 2.092
13 1HB MET 3 2HB MET 3 16.971 -3.333 -0.216
14 2HB MET 3 1HB MET 3 15.752 -2.699 0.882
15 1HG MET 3 2HG MET 3 18.094 -1.250 1.394
16 2HG MET 3 1HG MET 3 17.958 -1.366 -0.358
17 1HE MET 3 1HE MET 3 17.841 0.792 -0.851
18 2HE MET 3 2HE MET 3 16.276 0.682 -1.656
19 3HE MET 3 3HE MET 3 16.580 1.972 -0.493
20 H SER 4 H SER 4 18.156 -3.811 4.255
21 HA SER 4 HA SER 4 15.703 -4.307 5.535
22 1HB SER 4 2HB SER 4 17.664 -3.049 7.259
23 2HB SER 4 1HB SER 4 17.079 -4.714 7.263
24 HG SER 4 HG SER 4 19.415 -3.714 6.319
25 H THR 5 H THR 5 14.083 -2.881 5.325
26 HA THR 5 HA THR 5 14.637 -0.077 6.034
27 HB THR 5 HB THR 5 12.249 -0.696 4.376
28 HG1 THR 5 1HG THR 5 14.528 -1.660 3.595
29 1HG2 THR 5 1HG2 THR 5 14.308 1.517 4.356
30 2HG2 THR 5 2HG2 THR 5 12.708 1.585 5.095
31 3HG2 THR 5 3HG2 THR 5 12.863 1.459 3.342
32 H LYS 6 H LYS 6 13.523 0.696 7.728
33 HA LYS 6 HA LYS 6 11.621 -0.949 9.107
34 1HB LYS 6 2HB LYS 6 13.186 0.612 10.252
35 2HB LYS 6 1HB LYS 6 12.319 1.966 9.538
36 1HG LYS 6 2HG LYS 6 10.431 0.309 10.849
37 2HG LYS 6 1HG LYS 6 11.779 0.595 11.955
38 1HD LYS 6 2HD LYS 6 11.492 2.918 11.882
39 2HD LYS 6 1HD LYS 6 10.512 2.840 10.415
40 1HE LYS 6 2HE LYS 6 8.692 2.851 11.687
41 2HE LYS 6 1HE LYS 6 9.178 1.285 12.334
42 1HZ LYS 6 1HZ LYS 6 8.956 2.596 14.207
43 2HZ LYS 6 2HZ LYS 6 9.624 3.972 13.465
44 3HZ LYS 6 3HZ LYS 6 10.625 2.675 13.907
45 H ASN 7 H ASN 7 11.531 1.696 6.858
46 HA ASN 7 HA ASN 7 8.622 1.857 6.971
47 1HB ASN 7 2HB ASN 7 10.016 3.938 6.739
48 2HB ASN 7 1HB ASN 7 10.538 3.357 5.162
49 1HD2 ASN 7 1HD2 ASN 7 9.608 4.693 3.761
50 2HD2 ASN 7 2HD2 ASN 7 7.908 5.032 3.684
51 H PHE 8 H PHE 8 7.478 1.765 4.796
52 HA PHE 8 HA PHE 8 8.332 -0.656 3.453
53 1HB PHE 8 2HB PHE 8 5.866 0.623 2.511
54 2HB PHE 8 1HB PHE 8 6.133 -1.027 3.058
55 HD1 PHE 8 1HD PHE 8 4.938 2.265 3.933
56 HD2 PHE 8 2HD PHE 8 6.026 -1.546 5.484
57 HE1 PHE 8 1HE PHE 8 3.741 2.777 6.020
58 HE2 PHE 8 2HE PHE 8 4.830 -1.040 7.574
59 HZ PHE 8 HZ PHE 8 3.688 1.123 7.843
60 H ARG 9 H ARG 9 7.198 -0.276 0.994
61 HA ARG 9 HA ARG 9 9.071 1.598 -0.234
62 1HB ARG 9 2HB ARG 9 7.254 -0.474 -1.484
63 2HB ARG 9 1HB ARG 9 8.390 0.535 -2.369
64 1HG ARG 9 2HG ARG 9 9.294 -1.269 -0.154
65 2HG ARG 9 1HG ARG 9 9.088 -1.855 -1.805
66 1HD ARG 9 2HD ARG 9 10.748 -0.401 -2.637
67 2HD ARG 9 1HD ARG 9 10.759 0.558 -1.156
68 HE ARG 9 HE ARG 9 11.957 -2.096 -1.529
69 1HH1 ARG 9 2HH1 ARG 9 11.518 0.800 0.406
70 2HH1 ARG 9 1HH1 ARG 9 12.671 0.315 1.609
71 1HH2 ARG 9 2HH2 ARG 9 13.510 -2.705 0.042
72 2HH2 ARG 9 1HH2 ARG 9 13.814 -1.656 1.397
73 H VAL 10 H VAL 10 7.315 3.006 1.103
74 HA VAL 10 HA VAL 10 5.718 4.355 -0.876
75 HB VAL 10 HB VAL 10 4.420 2.308 0.290
76 1HG1 VAL 10 1HG1 VAL 10 3.016 3.036 2.107
77 2HG1 VAL 10 2HG1 VAL 10 4.709 3.218 2.561
78 3HG1 VAL 10 3HG1 VAL 10 3.767 4.632 2.091
79 1HG2 VAL 10 1HG2 VAL 10 2.334 3.435 -0.285
80 2HG2 VAL 10 2HG2 VAL 10 3.187 4.976 -0.363
81 3HG2 VAL 10 3HG2 VAL 10 3.573 3.695 -1.513
82 H SER 11 H SER 11 4.717 6.363 0.089
83 HA SER 11 HA SER 11 6.587 7.419 2.077
84 1HB SER 11 2HB SER 11 4.704 9.282 0.791
85 2HB SER 11 1HB SER 11 6.452 9.401 0.998
86 HG SER 11 HG SER 11 5.030 7.902 -0.968
87 H ASP 12 H ASP 12 4.986 9.637 2.862
88 HA ASP 12 HA ASP 12 3.683 8.430 5.089
89 1HB ASP 12 2HB ASP 12 4.702 10.421 5.650
90 2HB ASP 12 1HB ASP 12 4.216 11.221 4.164
91 H GLY 13 H GLY 13 2.493 10.376 2.356
92 1HA GLY 13 1HA GLY 13 -0.223 10.207 3.272
93 2HA GLY 13 2HA GLY 13 0.318 10.942 1.780
94 H ASP 14 H ASP 14 1.571 8.868 0.597
95 HA ASP 14 HA ASP 14 -0.619 7.310 -0.383
96 1HB ASP 14 2HB ASP 14 1.388 6.146 -1.637
97 2HB ASP 14 1HB ASP 14 0.860 7.757 -2.101
98 H TRP 15 H TRP 15 -0.902 5.063 -0.189
99 HA TRP 15 HA TRP 15 0.617 3.837 1.995
100 1HB TRP 15 2HB TRP 15 -1.445 2.978 2.989
101 2HB TRP 15 1HB TRP 15 -1.461 4.734 2.937
102 HD1 TRP 15 HD TRP 15 -2.975 5.787 0.777
103 HE1 TRP 15 1HE TRP 15 -5.250 4.946 -0.086
104 HE3 TRP 15 3HE TRP 15 -2.889 1.035 2.690
105 HZ2 TRP 15 2HZ TRP 15 -6.806 2.588 0.024
106 HZ3 TRP 15 3HZ TRP 15 -4.793 -0.445 2.279
107 HH2 TRP 15 HH TRP 15 -6.720 0.312 0.952
108 H ILE 16 H ILE 16 0.096 1.461 2.188
109 HA ILE 16 HA ILE 16 -0.411 0.255 -0.443
110 HB ILE 16 HB ILE 16 1.038 -1.639 0.377
111 1HG1 ILE 16 2HG1 ILE 16 2.599 0.037 2.166
112 1HG2 ILE 16 1HG2 ILE 16 1.947 1.036 -0.448
113 2HG2 ILE 16 2HG2 ILE 16 3.195 -0.056 0.155
114 3HG2 ILE 16 3HG2 ILE 16 2.191 -0.535 -1.212
115 1HD1 ILE 16 1HD1 ILE 16 2.474 -1.904 3.634
116 2HD1 ILE 16 2HD1 ILE 16 1.308 -2.651 2.542
117 3HD1 ILE 16 3HD1 ILE 16 2.957 -2.350 1.998
118 H CYS 17 H CYS 17 -1.461 -1.830 -0.358
119 HA CYS 17 HA CYS 17 -3.752 -2.020 1.039
120 1HB CYS 17 2HB CYS 17 -2.445 -3.637 -0.741
121 2HB CYS 17 1HB CYS 17 -2.467 -4.647 0.698
122 HA PRO 18 HA PRO 18 -2.919 -2.698 5.278
123 1HB PRO 18 2HB PRO 18 -5.343 -4.405 5.327
124 2HB PRO 18 1HB PRO 18 -4.979 -2.942 6.249
125 1HG PRO 18 2HG PRO 18 -6.735 -2.866 4.254
126 2HG PRO 18 1HG PRO 18 -5.589 -1.532 4.506
127 1HD PRO 18 2HD PRO 18 -5.456 -3.778 2.520
128 2HD PRO 18 1HD PRO 18 -5.132 -2.050 2.281
129 H ASP 19 H ASP 19 -3.425 -5.348 3.105
130 HA ASP 19 HA ASP 19 -2.197 -7.236 4.994
131 1HB ASP 19 2HB ASP 19 -4.410 -7.741 3.683
132 2HB ASP 19 1HB ASP 19 -3.321 -8.064 2.339
133 H LYS 20 H LYS 20 -0.444 -8.543 4.279
134 HA LYS 20 HA LYS 20 1.348 -6.938 2.644
135 1HB LYS 20 2HB LYS 20 1.719 -9.126 4.646
136 2HB LYS 20 1HB LYS 20 3.004 -8.782 3.495
137 1HG LYS 20 2HG LYS 20 3.701 -7.306 5.018
138 2HG LYS 20 1HG LYS 20 2.398 -6.286 4.404
139 1HD LYS 20 2HD LYS 20 1.368 -8.143 6.337
140 2HD LYS 20 1HD LYS 20 2.738 -7.263 7.016
141 1HE LYS 20 2HE LYS 20 1.618 -5.311 7.068
142 2HE LYS 20 1HE LYS 20 0.838 -5.604 5.514
143 1HZ LYS 20 1HZ LYS 20 -0.341 -7.422 7.137
144 2HZ LYS 20 2HZ LYS 20 -0.995 -5.907 6.736
145 3HZ LYS 20 3HZ LYS 20 -0.133 -6.103 8.183
146 H LYS 21 H LYS 21 -0.698 -9.519 2.165
147 HA LYS 21 HA LYS 21 0.772 -11.088 0.320
148 1HB LYS 21 2HB LYS 21 -2.209 -10.567 0.410
149 2HB LYS 21 1HB LYS 21 -1.423 -11.864 -0.479
150 1HG LYS 21 2HG LYS 21 -0.818 -12.989 1.499
151 2HG LYS 21 1HG LYS 21 -1.184 -11.582 2.502
152 1HD LYS 21 2HD LYS 21 -3.572 -11.804 1.842
153 2HD LYS 21 1HD LYS 21 -3.159 -13.287 0.982
154 1HE LYS 21 2HE LYS 21 -4.060 -13.825 3.156
155 2HE LYS 21 1HE LYS 21 -2.350 -14.255 3.101
156 1HZ LYS 21 1HZ LYS 21 -1.777 -12.469 4.443
157 2HZ LYS 21 2HZ LYS 21 -3.215 -13.025 5.147
158 3HZ LYS 21 3HZ LYS 21 -3.233 -11.643 4.160
159 H CYS 22 H CYS 22 -1.244 -8.244 0.017
160 HA CYS 22 HA CYS 22 -0.794 -8.037 -2.848
161 1HB CYS 22 2HB CYS 22 -3.019 -7.590 -2.052
162 2HB CYS 22 1HB CYS 22 -2.426 -6.476 -0.842
163 H GLY 23 H GLY 23 -0.837 -5.481 -0.415
164 1HA GLY 23 1HA GLY 23 0.722 -3.874 0.146
165 2HA GLY 23 2HA GLY 23 1.956 -4.903 -0.573
166 H ASN 24 H ASN 24 -0.863 -3.910 -2.317
167 HA ASN 24 HA ASN 24 0.573 -2.808 -4.472
168 1HB ASN 24 2HB ASN 24 -1.645 -3.593 -4.892
169 2HB ASN 24 1HB ASN 24 -2.317 -2.602 -3.608
170 1HD2 ASN 24 1HD2 ASN 24 -2.909 -0.551 -4.025
171 2HD2 ASN 24 2HD2 ASN 24 -2.796 0.197 -5.579
172 H VAL 25 H VAL 25 1.225 -0.763 -4.933
173 HA VAL 25 HA VAL 25 1.066 1.229 -2.858
174 HB VAL 25 HB VAL 25 2.079 2.723 -4.720
175 1HG1 VAL 25 1HG1 VAL 25 3.385 1.968 -2.876
176 2HG1 VAL 25 2HG1 VAL 25 3.496 0.341 -3.552
177 3HG1 VAL 25 3HG1 VAL 25 4.320 1.683 -4.344
178 1HG2 VAL 25 1HG2 VAL 25 1.664 1.539 -6.694
179 2HG2 VAL 25 2HG2 VAL 25 3.374 1.252 -6.372
180 3HG2 VAL 25 3HG2 VAL 25 2.183 0.007 -5.991
181 H ASN 26 H ASN 26 -0.876 2.048 -2.498
182 HA ASN 26 HA ASN 26 -2.804 2.333 -4.617
183 1HB ASN 26 2HB ASN 26 -3.056 3.345 -1.781
184 2HB ASN 26 1HB ASN 26 -4.356 2.995 -2.916
185 1HD2 ASN 26 1HD2 ASN 26 -5.245 1.032 -2.866
186 2HD2 ASN 26 2HD2 ASN 26 -4.609 -0.336 -2.017
187 H PHE 27 H PHE 27 -3.858 4.274 -5.180
188 HA PHE 27 HA PHE 27 -2.356 6.389 -6.003
189 1HB PHE 27 2HB PHE 27 -4.704 5.934 -6.647
190 2HB PHE 27 1HB PHE 27 -5.239 6.495 -5.073
191 HD1 PHE 27 1HD PHE 27 -5.215 8.850 -4.521
192 HD2 PHE 27 2HD PHE 27 -4.025 7.475 -8.364
193 HE1 PHE 27 1HE PHE 27 -5.443 11.131 -5.396
194 HE2 PHE 27 2HE PHE 27 -4.248 9.760 -9.251
195 HZ PHE 27 HZ PHE 27 -4.962 11.592 -7.760
196 H ALA 28 H ALA 28 -4.691 7.106 -3.478
197 HA ALA 28 HA ALA 28 -3.025 7.762 -1.357
198 1HB ALA 28 1HB ALA 28 -3.880 10.355 -2.522
199 2HB ALA 28 2HB ALA 28 -2.485 9.971 -1.512
200 3HB ALA 28 3HB ALA 28 -2.463 9.579 -3.231
201 H ARG 29 H ARG 29 -5.615 9.598 -2.935
202 HA ARG 29 HA ARG 29 -7.359 9.396 -0.667
203 1HB ARG 29 2HB ARG 29 -9.040 10.431 -2.250
204 2HB ARG 29 1HB ARG 29 -7.578 11.370 -1.990
205 1HG ARG 29 2HG ARG 29 -6.745 10.879 -4.113
206 2HG ARG 29 1HG ARG 29 -7.864 9.535 -4.340
207 1HD ARG 29 2HD ARG 29 -8.231 11.937 -5.453
208 2HD ARG 29 1HD ARG 29 -9.566 10.887 -4.982
209 HE ARG 29 HE ARG 29 -9.921 12.245 -3.069
210 1HH1 ARG 29 2HH1 ARG 29 -7.506 13.519 -5.277
211 2HH1 ARG 29 1HH1 ARG 29 -7.539 15.118 -4.596
212 1HH2 ARG 29 2HH2 ARG 29 -9.983 14.362 -2.192
213 2HH2 ARG 29 1HH2 ARG 29 -8.995 15.610 -2.893
214 H ARG 30 H ARG 30 -6.738 6.930 -1.051
215 HA ARG 30 HA ARG 30 -8.898 5.672 -2.605
216 1HB ARG 30 2HB ARG 30 -6.121 4.766 -1.897
217 2HB ARG 30 1HB ARG 30 -7.372 3.591 -2.273
218 1HG ARG 30 2HG ARG 30 -6.616 5.837 -4.114
219 2HG ARG 30 1HG ARG 30 -5.881 4.233 -4.174
220 1HD ARG 30 2HD ARG 30 -7.932 3.213 -4.758
221 2HD ARG 30 1HD ARG 30 -8.854 4.660 -4.345
222 HE ARG 30 HE ARG 30 -7.363 4.157 -6.789
223 1HH1 ARG 30 2HH1 ARG 30 -9.070 6.464 -4.777
224 2HH1 ARG 30 1HH1 ARG 30 -9.233 7.654 -6.038
225 1HH2 ARG 30 2HH2 ARG 30 -7.559 5.729 -8.460
226 2HH2 ARG 30 1HH2 ARG 30 -8.376 7.231 -8.133
227 H THR 31 H THR 31 -10.545 5.196 -1.285
228 HA THR 31 HA THR 31 -10.041 4.422 1.462
229 HB THR 31 HB THR 31 -12.740 3.959 0.905
230 HG1 THR 31 1HG THR 31 -12.811 4.989 -1.014
231 1HG2 THR 31 1HG2 THR 31 -11.288 6.348 2.034
232 2HG2 THR 31 2HG2 THR 31 -12.006 5.004 2.922
233 3HG2 THR 31 3HG2 THR 31 -13.039 6.164 2.086
234 H SER 32 H SER 32 -10.110 2.981 -1.517
235 HA SER 32 HA SER 32 -10.078 0.338 -0.281
236 1HB SER 32 2HB SER 32 -11.400 0.715 -2.961
237 2HB SER 32 1HB SER 32 -11.541 -0.639 -1.841
238 HG SER 32 HG SER 32 -12.961 0.458 -0.640
239 H CYS 33 H CYS 33 -8.749 -1.163 -1.400
240 HA CYS 33 HA CYS 33 -6.405 -0.229 -2.502
241 1HB CYS 33 2HB CYS 33 -6.722 -2.496 -1.580
242 2HB CYS 33 1HB CYS 33 -7.680 -2.926 -2.990
243 H ASP 34 H ASP 34 -5.519 -0.289 -4.561
244 HA ASP 34 HA ASP 34 -7.361 0.457 -6.671
245 1HB ASP 34 2HB ASP 34 -4.415 0.640 -6.230
246 2HB ASP 34 1HB ASP 34 -4.984 0.581 -7.894
247 H ARG 35 H ARG 35 -5.666 -2.275 -5.555
248 HA ARG 35 HA ARG 35 -5.951 -3.655 -8.139
249 1HB ARG 35 2HB ARG 35 -3.934 -3.689 -6.119
250 2HB ARG 35 1HB ARG 35 -4.662 -5.287 -6.183
251 1HG ARG 35 2HG ARG 35 -4.199 -4.405 -8.846
252 2HG ARG 35 1HG ARG 35 -2.723 -4.172 -7.906
253 1HD ARG 35 2HD ARG 35 -2.399 -6.394 -7.620
254 2HD ARG 35 1HD ARG 35 -4.126 -6.731 -7.483
255 HE ARG 35 HE ARG 35 -2.533 -6.642 -9.923
256 1HH1 ARG 35 2HH1 ARG 35 -5.663 -7.078 -8.403
257 2HH1 ARG 35 1HH1 ARG 35 -6.442 -7.604 -9.870
258 1HH2 ARG 35 2HH2 ARG 35 -3.537 -7.364 -11.842
259 2HH2 ARG 35 1HH2 ARG 35 -5.227 -7.787 -11.818
260 H CYS 36 H CYS 36 -6.498 -4.135 -4.652
261 HA CYS 36 HA CYS 36 -8.187 -6.418 -5.089
262 1HB CYS 36 2HB CYS 36 -7.805 -4.802 -2.592
263 2HB CYS 36 1HB CYS 36 -8.510 -6.404 -2.689
264 H GLY 37 H GLY 37 -8.672 -3.106 -3.955
265 1HA GLY 37 1HA GLY 37 -10.676 -1.863 -4.044
266 2HA GLY 37 2HA GLY 37 -11.543 -3.335 -4.478
267 H ARG 38 H ARG 38 -9.312 -3.791 -2.012
268 HA ARG 38 HA ARG 38 -11.380 -4.179 -0.042
269 1HB ARG 38 2HB ARG 38 -8.693 -5.095 -0.463
270 2HB ARG 38 1HB ARG 38 -8.824 -4.420 1.158
271 1HG ARG 38 2HG ARG 38 -9.304 -6.699 1.355
272 2HG ARG 38 1HG ARG 38 -10.871 -5.885 1.420
273 1HD ARG 38 2HD ARG 38 -10.985 -6.285 -1.101
274 2HD ARG 38 1HD ARG 38 -9.645 -7.405 -0.865
275 HE ARG 38 HE ARG 38 -11.056 -8.837 0.287
276 1HH1 ARG 38 2HH1 ARG 38 -12.720 -5.921 -0.673
277 2HH1 ARG 38 1HH1 ARG 38 -14.305 -6.552 -0.353
278 1HH2 ARG 38 2HH2 ARG 38 -13.142 -9.694 0.682
279 2HH2 ARG 38 1HH2 ARG 38 -14.545 -8.707 0.392
280 H GLU 39 H GLU 39 -11.520 -3.089 1.951
281 HA GLU 39 HA GLU 39 -11.279 -0.282 1.569
282 1HB GLU 39 2HB GLU 39 -12.081 -1.792 4.055
283 2HB GLU 39 1HB GLU 39 -12.393 -0.092 3.722
284 1HG GLU 39 2HG GLU 39 -13.441 -2.340 2.023
285 2HG GLU 39 1HG GLU 39 -14.334 -1.626 3.367
286 H LYS 40 H LYS 40 -10.069 1.221 2.557
287 HA LYS 40 HA LYS 40 -7.474 0.666 3.433
288 1HB LYS 40 2HB LYS 40 -8.390 2.861 2.546
289 2HB LYS 40 1HB LYS 40 -9.085 3.127 4.139
290 1HG LYS 40 2HG LYS 40 -6.690 2.822 5.014
291 2HG LYS 40 1HG LYS 40 -6.204 3.055 3.334
292 1HD LYS 40 2HD LYS 40 -8.130 5.047 4.168
293 2HD LYS 40 1HD LYS 40 -6.711 5.042 5.216
294 1HE LYS 40 2HE LYS 40 -5.317 5.088 3.101
295 2HE LYS 40 1HE LYS 40 -6.813 5.420 2.230
296 1HZ LYS 40 1HZ LYS 40 -6.191 7.109 4.535
297 2HZ LYS 40 2HZ LYS 40 -6.943 7.511 3.065
298 3HZ LYS 40 3HZ LYS 40 -5.256 7.334 3.139
299 H THR 41 H THR 41 -7.043 -0.525 5.184
300 HA THR 41 HA THR 41 -8.435 0.145 7.685
301 HB THR 41 HB THR 41 -7.852 -2.497 8.030
302 HG1 THR 41 1HG THR 41 -8.532 -2.082 5.281
303 1HG2 THR 41 1HG2 THR 41 -10.435 -2.206 6.757
304 2HG2 THR 41 2HG2 THR 41 -10.117 -0.894 7.893
305 3HG2 THR 41 3HG2 THR 41 -10.046 -2.572 8.438
306 H THR 42 H THR 42 -7.190 -0.746 9.618
307 HA THR 42 HA THR 42 -4.521 0.162 9.559
308 HB THR 42 HB THR 42 -5.473 -1.703 11.695
309 HG1 THR 42 1HG THR 42 -7.256 -0.525 11.791
310 1HG2 THR 42 1HG2 THR 42 -3.224 -0.430 11.620
311 2HG2 THR 42 2HG2 THR 42 -4.159 -0.408 13.115
312 3HG2 THR 42 3HG2 THR 42 -4.189 0.986 12.036
313 H GLY 43 H GLY 43 -5.707 -3.153 10.224
314 1HA GLY 43 1HA GLY 43 -4.943 -5.142 9.268
315 2HA GLY 43 2HA GLY 43 -3.673 -4.241 8.457
316 HA PRO 44 HA PRO 44 -2.108 -6.199 12.543
317 1HB PRO 44 2HB PRO 44 -1.990 -8.885 11.445
318 2HB PRO 44 1HB PRO 44 -2.784 -8.330 12.919
319 1HG PRO 44 2HG PRO 44 -4.146 -9.210 10.730
320 2HG PRO 44 1HG PRO 44 -4.797 -8.022 11.874
321 1HD PRO 44 2HD PRO 44 -3.551 -7.578 9.185
322 2HD PRO 44 1HD PRO 44 -4.972 -6.797 9.914
323 H ILE 45 H ILE 45 -0.023 -7.694 12.624
324 HA ILE 45 HA ILE 45 1.756 -6.613 10.600
325 HB ILE 45 HB ILE 45 2.436 -8.319 13.003
326 1HG1 ILE 45 2HG1 ILE 45 1.403 -6.246 13.732
327 1HG2 ILE 45 1HG2 ILE 45 4.520 -6.559 12.115
328 2HG2 ILE 45 2HG2 ILE 45 4.535 -8.313 12.293
329 3HG2 ILE 45 3HG2 ILE 45 3.985 -7.584 10.784
330 1HD1 ILE 45 1HD1 ILE 45 1.544 -4.731 11.968
331 2HD1 ILE 45 2HD1 ILE 45 2.614 -4.077 13.209
332 3HD1 ILE 45 3HD1 ILE 45 3.292 -4.928 11.822
Start of MODEL 2
1 1H GLY 1 1H GLY 1 7.886 13.185 -24.689
2 2H GLY 1 2H GLY 1 7.054 14.175 -23.585
3 3H GLY 1 3H GLY 1 6.329 13.756 -25.058
4 1HA GLY 1 2HA GLY 1 5.513 11.882 -24.248
5 2HA GLY 1 1HA GLY 1 7.099 11.426 -23.636
6 H SER 2 H SER 2 7.487 11.536 -21.516
7 HA SER 2 HA SER 2 7.133 11.732 -19.294
8 1HB SER 2 2HB SER 2 5.762 14.351 -19.876
9 2HB SER 2 1HB SER 2 6.752 13.914 -18.483
10 HG SER 2 HG SER 2 7.712 15.254 -20.281
11 H MET 3 H MET 3 5.298 10.044 -20.251
12 HA MET 3 HA MET 3 2.687 10.796 -19.238
13 1HB MET 3 2HB MET 3 3.042 9.181 -21.163
14 2HB MET 3 1HB MET 3 3.638 8.023 -19.980
15 1HG MET 3 2HG MET 3 1.094 9.118 -19.171
16 2HG MET 3 1HG MET 3 1.007 8.406 -20.782
17 1HE MET 3 1HE MET 3 -0.676 7.551 -18.438
18 2HE MET 3 2HE MET 3 -0.283 6.005 -17.691
19 3HE MET 3 3HE MET 3 0.451 7.489 -17.085
20 H SER 4 H SER 4 4.816 8.054 -18.447
21 HA SER 4 HA SER 4 4.009 8.119 -15.677
22 1HB SER 4 2HB SER 4 6.300 6.462 -16.119
23 2HB SER 4 1HB SER 4 4.634 5.962 -15.819
24 HG SER 4 HG SER 4 4.492 5.424 -17.840
25 H THR 5 H THR 5 6.866 8.787 -17.616
26 HA THR 5 HA THR 5 8.671 10.108 -17.334
27 HB THR 5 HB THR 5 7.598 11.513 -14.953
28 HG1 THR 5 1HG THR 5 5.931 10.889 -16.815
29 1HG2 THR 5 1HG2 THR 5 8.412 13.446 -16.110
30 2HG2 THR 5 2HG2 THR 5 8.590 12.535 -17.611
31 3HG2 THR 5 3HG2 THR 5 9.643 12.188 -16.241
32 H LYS 6 H LYS 6 7.901 10.299 -13.900
33 HA LYS 6 HA LYS 6 10.468 8.988 -13.356
34 1HB LYS 6 2HB LYS 6 8.947 11.172 -12.084
35 2HB LYS 6 1HB LYS 6 9.698 10.045 -10.964
36 1HG LYS 6 2HG LYS 6 11.668 11.010 -11.257
37 2HG LYS 6 1HG LYS 6 11.574 10.743 -13.000
38 1HD LYS 6 2HD LYS 6 11.336 12.927 -13.297
39 2HD LYS 6 1HD LYS 6 9.818 12.862 -12.400
40 1HE LYS 6 2HE LYS 6 11.583 12.849 -10.361
41 2HE LYS 6 1HE LYS 6 12.490 13.780 -11.553
42 1HZ LYS 6 1HZ LYS 6 9.777 14.391 -10.501
43 2HZ LYS 6 2HZ LYS 6 10.511 15.234 -11.777
44 3HZ LYS 6 3HZ LYS 6 11.202 15.273 -10.226
45 H ASN 7 H ASN 7 10.604 7.424 -11.664
46 HA ASN 7 HA ASN 7 8.374 5.651 -11.562
47 1HB ASN 7 2HB ASN 7 10.951 5.162 -11.314
48 2HB ASN 7 1HB ASN 7 10.628 5.436 -9.605
49 1HD2 ASN 7 1HD2 ASN 7 10.734 3.440 -8.766
50 2HD2 ASN 7 2HD2 ASN 7 9.763 2.096 -9.287
51 H PHE 8 H PHE 8 6.695 5.718 -10.251
52 HA PHE 8 HA PHE 8 6.465 7.820 -8.355
53 1HB PHE 8 2HB PHE 8 4.494 7.456 -9.535
54 2HB PHE 8 1HB PHE 8 4.646 5.707 -9.449
55 HD1 PHE 8 1HD PHE 8 3.320 4.548 -7.986
56 HD2 PHE 8 2HD PHE 8 4.099 8.660 -7.245
57 HE1 PHE 8 1HE PHE 8 1.745 4.497 -6.091
58 HE2 PHE 8 2HE PHE 8 2.525 8.623 -5.351
59 HZ PHE 8 HZ PHE 8 1.348 6.540 -4.772
60 H ARG 9 H ARG 9 7.461 7.642 -6.518
61 HA ARG 9 HA ARG 9 7.333 5.146 -4.992
62 1HB ARG 9 2HB ARG 9 8.876 7.708 -4.601
63 2HB ARG 9 1HB ARG 9 8.789 6.466 -3.360
64 1HG ARG 9 2HG ARG 9 10.639 5.662 -4.322
65 2HG ARG 9 1HG ARG 9 9.540 5.015 -5.542
66 1HD ARG 9 2HD ARG 9 10.741 6.178 -7.022
67 2HD ARG 9 1HD ARG 9 9.929 7.603 -6.377
68 HE ARG 9 HE ARG 9 12.653 6.702 -5.764
69 1HH1 ARG 9 2HH1 ARG 9 10.100 9.077 -5.357
70 2HH1 ARG 9 1HH1 ARG 9 11.153 10.284 -4.697
71 1HH2 ARG 9 2HH2 ARG 9 14.040 8.294 -4.880
72 2HH2 ARG 9 1HH2 ARG 9 13.390 9.848 -4.428
73 H VAL 10 H VAL 10 6.113 4.941 -3.160
74 HA VAL 10 HA VAL 10 3.930 6.678 -2.789
75 HB VAL 10 HB VAL 10 3.839 5.318 -0.521
76 1HG1 VAL 10 1HG1 VAL 10 2.147 4.363 -1.596
77 2HG1 VAL 10 2HG1 VAL 10 2.790 5.005 -3.109
78 3HG1 VAL 10 3HG1 VAL 10 3.261 3.395 -2.563
79 1HG2 VAL 10 1HG2 VAL 10 6.135 4.419 -0.806
80 2HG2 VAL 10 2HG2 VAL 10 4.909 3.165 -0.639
81 3HG2 VAL 10 3HG2 VAL 10 5.574 3.542 -2.228
82 H SER 11 H SER 11 3.640 8.361 -1.466
83 HA SER 11 HA SER 11 5.942 9.623 -0.352
84 1HB SER 11 2HB SER 11 3.199 10.574 0.333
85 2HB SER 11 1HB SER 11 4.621 11.494 -0.157
86 HG SER 11 HG SER 11 2.835 9.993 -1.773
87 H ASP 12 H ASP 12 5.526 10.701 1.945
88 HA ASP 12 HA ASP 12 5.968 8.593 3.768
89 1HB ASP 12 2HB ASP 12 6.846 11.013 3.806
90 2HB ASP 12 1HB ASP 12 5.311 11.410 4.577
91 H GLY 13 H GLY 13 3.203 10.719 3.200
92 1HA GLY 13 1HA GLY 13 1.681 9.420 5.329
93 2HA GLY 13 2HA GLY 13 1.157 10.779 4.348
94 H ASP 14 H ASP 14 2.455 8.492 2.338
95 HA ASP 14 HA ASP 14 -0.178 7.706 1.414
96 1HB ASP 14 2HB ASP 14 2.612 7.430 0.341
97 2HB ASP 14 1HB ASP 14 1.364 6.357 -0.266
98 H TRP 15 H TRP 15 0.104 5.226 0.473
99 HA TRP 15 HA TRP 15 1.130 3.419 2.465
100 1HB TRP 15 2HB TRP 15 -1.030 2.429 3.034
101 2HB TRP 15 1HB TRP 15 -1.051 4.143 3.442
102 HD1 TRP 15 HD TRP 15 -2.011 5.618 1.029
103 HE1 TRP 15 1HE TRP 15 -4.239 5.147 -0.157
104 HE3 TRP 15 3HE TRP 15 -2.801 0.874 2.729
105 HZ2 TRP 15 2HZ TRP 15 -6.097 3.005 -0.338
106 HZ3 TRP 15 3HZ TRP 15 -4.820 -0.311 2.010
107 HH2 TRP 15 HH TRP 15 -6.438 0.725 0.499
108 H ILE 16 H ILE 16 -0.224 1.147 1.707
109 HA ILE 16 HA ILE 16 -0.155 1.098 -1.217
110 HB ILE 16 HB ILE 16 0.809 -1.355 -0.756
111 1HG1 ILE 16 2HG1 ILE 16 2.544 0.097 1.164
112 1HG2 ILE 16 1HG2 ILE 16 3.022 -0.475 -1.357
113 2HG2 ILE 16 2HG2 ILE 16 1.736 0.277 -2.302
114 3HG2 ILE 16 3HG2 ILE 16 2.470 1.154 -0.959
115 1HD1 ILE 16 1HD1 ILE 16 1.626 -2.719 0.778
116 2HD1 ILE 16 2HD1 ILE 16 3.267 -2.071 0.795
117 3HD1 ILE 16 3HD1 ILE 16 2.355 -2.201 2.300
118 H CYS 17 H CYS 17 -0.521 -1.427 1.210
119 HA CYS 17 HA CYS 17 -3.402 -1.527 0.799
120 1HB CYS 17 2HB CYS 17 -2.305 -3.158 -0.773
121 2HB CYS 17 1HB CYS 17 -1.595 -3.958 0.621
122 HA PRO 18 HA PRO 18 -3.194 -2.168 5.217
123 1HB PRO 18 2HB PRO 18 -5.493 -3.998 5.074
124 2HB PRO 18 1HB PRO 18 -5.357 -2.433 5.879
125 1HG PRO 18 2HG PRO 18 -6.840 -2.735 3.666
126 2HG PRO 18 1HG PRO 18 -5.913 -1.251 3.973
127 1HD PRO 18 2HD PRO 18 -5.222 -3.574 2.202
128 2HD PRO 18 1HD PRO 18 -5.083 -1.839 1.876
129 H ASP 19 H ASP 19 -3.113 -4.681 2.935
130 HA ASP 19 HA ASP 19 -2.117 -6.623 4.909
131 1HB ASP 19 2HB ASP 19 -4.024 -7.081 3.097
132 2HB ASP 19 1HB ASP 19 -2.626 -7.395 2.073
133 H LYS 20 H LYS 20 -0.433 -8.147 3.707
134 HA LYS 20 HA LYS 20 1.552 -6.353 2.460
135 1HB LYS 20 2HB LYS 20 1.765 -8.164 4.766
136 2HB LYS 20 1HB LYS 20 3.066 -8.330 3.593
137 1HG LYS 20 2HG LYS 20 3.935 -6.733 4.979
138 2HG LYS 20 1HG LYS 20 3.151 -5.719 3.765
139 1HD LYS 20 2HD LYS 20 1.097 -5.957 5.422
140 2HD LYS 20 1HD LYS 20 2.385 -6.252 6.592
141 1HE LYS 20 2HE LYS 20 2.476 -3.894 4.741
142 2HE LYS 20 1HE LYS 20 1.564 -3.835 6.249
143 1HZ LYS 20 1HZ LYS 20 4.130 -3.174 6.059
144 2HZ LYS 20 2HZ LYS 20 4.294 -4.815 6.454
145 3HZ LYS 20 3HZ LYS 20 3.430 -3.779 7.483
146 H LYS 21 H LYS 21 -0.328 -9.115 2.137
147 HA LYS 21 HA LYS 21 1.437 -10.488 0.289
148 1HB LYS 21 2HB LYS 21 -0.439 -12.060 0.006
149 2HB LYS 21 1HB LYS 21 -0.043 -11.818 1.701
150 1HG LYS 21 2HG LYS 21 -1.936 -10.219 1.860
151 2HG LYS 21 1HG LYS 21 -2.366 -10.629 0.197
152 1HD LYS 21 2HD LYS 21 -2.515 -13.031 0.941
153 2HD LYS 21 1HD LYS 21 -2.350 -12.453 2.600
154 1HE LYS 21 2HE LYS 21 -4.397 -11.059 1.043
155 2HE LYS 21 1HE LYS 21 -4.710 -12.780 1.257
156 1HZ LYS 21 1HZ LYS 21 -4.460 -12.482 3.650
157 2HZ LYS 21 2HZ LYS 21 -5.691 -11.490 3.034
158 3HZ LYS 21 3HZ LYS 21 -4.186 -10.818 3.430
159 H CYS 22 H CYS 22 -0.373 -7.793 0.101
160 HA CYS 22 HA CYS 22 -1.009 -8.161 -2.745
161 1HB CYS 22 2HB CYS 22 -3.038 -7.964 -1.425
162 2HB CYS 22 1HB CYS 22 -2.425 -6.522 -0.631
163 H GLY 23 H GLY 23 -1.151 -5.173 -0.905
164 1HA GLY 23 1HA GLY 23 0.230 -3.330 -0.826
165 2HA GLY 23 2HA GLY 23 1.511 -4.321 -1.503
166 H ASN 24 H ASN 24 -1.630 -3.028 -2.606
167 HA ASN 24 HA ASN 24 -0.681 -2.665 -5.291
168 1HB ASN 24 2HB ASN 24 -3.035 -3.184 -4.732
169 2HB ASN 24 1HB ASN 24 -3.183 -1.602 -3.983
170 1HD2 ASN 24 1HD2 ASN 24 -4.064 -0.162 -5.178
171 2HD2 ASN 24 2HD2 ASN 24 -3.969 -0.070 -6.893
172 H VAL 25 H VAL 25 -0.674 -0.573 -6.392
173 HA VAL 25 HA VAL 25 0.714 1.411 -4.838
174 HB VAL 25 HB VAL 25 0.459 2.675 -7.154
175 1HG1 VAL 25 1HG1 VAL 25 2.463 1.457 -5.901
176 2HG1 VAL 25 2HG1 VAL 25 2.321 0.374 -7.284
177 3HG1 VAL 25 3HG1 VAL 25 2.623 2.093 -7.539
178 1HG2 VAL 25 1HG2 VAL 25 0.392 -0.158 -8.129
179 2HG2 VAL 25 2HG2 VAL 25 -1.096 0.761 -7.912
180 3HG2 VAL 25 3HG2 VAL 25 0.139 1.336 -9.032
181 H ASN 26 H ASN 26 -1.423 1.480 -3.525
182 HA ASN 26 HA ASN 26 -3.394 3.311 -4.647
183 1HB ASN 26 2HB ASN 26 -3.203 1.968 -1.937
184 2HB ASN 26 1HB ASN 26 -4.503 3.052 -2.408
185 1HD2 ASN 26 1HD2 ASN 26 -3.802 -0.002 -1.924
186 2HD2 ASN 26 2HD2 ASN 26 -4.880 -0.771 -3.034
187 H PHE 27 H PHE 27 -3.211 5.498 -4.355
188 HA PHE 27 HA PHE 27 -1.187 6.498 -2.580
189 1HB PHE 27 2HB PHE 27 -2.167 8.748 -3.450
190 2HB PHE 27 1HB PHE 27 -1.197 7.758 -4.523
191 HD1 PHE 27 1HD PHE 27 -4.526 9.064 -3.804
192 HD2 PHE 27 2HD PHE 27 -2.217 6.612 -6.404
193 HE1 PHE 27 1HE PHE 27 -6.344 9.121 -5.461
194 HE2 PHE 27 2HE PHE 27 -4.032 6.660 -8.065
195 HZ PHE 27 HZ PHE 27 -6.098 7.916 -7.594
196 H ALA 28 H ALA 28 -1.867 8.472 -1.278
197 HA ALA 28 HA ALA 28 -3.284 7.737 0.915
198 1HB ALA 28 1HB ALA 28 -1.827 9.873 0.330
199 2HB ALA 28 2HB ALA 28 -3.428 10.607 0.223
200 3HB ALA 28 3HB ALA 28 -2.916 9.821 1.716
201 H ARG 29 H ARG 29 -4.594 9.795 -1.714
202 HA ARG 29 HA ARG 29 -7.186 9.946 -0.601
203 1HB ARG 29 2HB ARG 29 -5.888 10.637 -3.173
204 2HB ARG 29 1HB ARG 29 -7.646 10.557 -3.135
205 1HG ARG 29 2HG ARG 29 -7.315 12.042 -0.988
206 2HG ARG 29 1HG ARG 29 -5.802 12.448 -1.809
207 1HD ARG 29 2HD ARG 29 -7.316 14.030 -2.588
208 2HD ARG 29 1HD ARG 29 -7.229 12.821 -3.868
209 HE ARG 29 HE ARG 29 -9.318 11.896 -2.569
210 1HH1 ARG 29 2HH1 ARG 29 -8.536 15.220 -3.340
211 2HH1 ARG 29 1HH1 ARG 29 -10.201 15.736 -3.357
212 1HH2 ARG 29 2HH2 ARG 29 -11.481 12.556 -2.582
213 2HH2 ARG 29 1HH2 ARG 29 -11.885 14.215 -2.925
214 H ARG 30 H ARG 30 -5.650 7.414 -2.231
215 HA ARG 30 HA ARG 30 -8.011 6.290 -3.437
216 1HB ARG 30 2HB ARG 30 -5.172 5.754 -3.433
217 2HB ARG 30 1HB ARG 30 -6.072 4.278 -3.115
218 1HG ARG 30 2HG ARG 30 -6.892 6.041 -5.364
219 2HG ARG 30 1HG ARG 30 -5.499 4.970 -5.547
220 1HD ARG 30 2HD ARG 30 -6.815 3.046 -5.133
221 2HD ARG 30 1HD ARG 30 -8.180 4.014 -4.581
222 HE ARG 30 HE ARG 30 -7.714 4.785 -7.192
223 1HH1 ARG 30 2HH1 ARG 30 -8.537 1.836 -5.491
224 2HH1 ARG 30 1HH1 ARG 30 -9.380 1.141 -6.849
225 1HH2 ARG 30 2HH2 ARG 30 -8.851 3.885 -8.968
226 2HH2 ARG 30 1HH2 ARG 30 -9.558 2.307 -8.817
227 H THR 31 H THR 31 -9.458 6.177 -1.695
228 HA THR 31 HA THR 31 -8.744 5.055 0.810
229 HB THR 31 HB THR 31 -11.504 4.965 0.687
230 HG1 THR 31 1HG THR 31 -11.691 5.920 -1.305
231 1HG2 THR 31 1HG2 THR 31 -11.102 6.264 2.455
232 2HG2 THR 31 2HG2 THR 31 -10.707 7.604 1.376
233 3HG2 THR 31 3HG2 THR 31 -9.441 6.499 1.916
234 H SER 32 H SER 32 -9.102 3.476 -2.035
235 HA SER 32 HA SER 32 -9.879 0.991 -0.717
236 1HB SER 32 2HB SER 32 -11.029 1.139 -3.385
237 2HB SER 32 1HB SER 32 -11.800 0.707 -1.858
238 HG SER 32 HG SER 32 -12.344 2.778 -1.509
239 H CYS 33 H CYS 33 -8.698 -0.721 -1.336
240 HA CYS 33 HA CYS 33 -6.582 -0.450 -3.209
241 1HB CYS 33 2HB CYS 33 -6.895 -2.124 -1.182
242 2HB CYS 33 1HB CYS 33 -7.586 -3.156 -2.424
243 H ASP 34 H ASP 34 -6.419 -1.086 -5.246
244 HA ASP 34 HA ASP 34 -8.933 -1.771 -6.603
245 1HB ASP 34 2HB ASP 34 -7.079 0.152 -7.195
246 2HB ASP 34 1HB ASP 34 -6.596 -1.156 -8.272
247 H ARG 35 H ARG 35 -6.513 -3.379 -5.271
248 HA ARG 35 HA ARG 35 -6.035 -5.202 -7.526
249 1HB ARG 35 2HB ARG 35 -4.312 -4.044 -5.726
250 2HB ARG 35 1HB ARG 35 -4.469 -5.698 -5.151
251 1HG ARG 35 2HG ARG 35 -3.901 -6.490 -7.423
252 2HG ARG 35 1HG ARG 35 -3.624 -4.811 -7.898
253 1HD ARG 35 2HD ARG 35 -1.646 -4.730 -6.867
254 2HD ARG 35 1HD ARG 35 -2.277 -5.558 -5.447
255 HE ARG 35 HE ARG 35 -1.152 -6.833 -7.840
256 1HH1 ARG 35 2HH1 ARG 35 -2.344 -7.075 -4.547
257 2HH1 ARG 35 1HH1 ARG 35 -1.675 -8.659 -4.301
258 1HH2 ARG 35 2HH2 ARG 35 -0.275 -8.921 -7.505
259 2HH2 ARG 35 1HH2 ARG 35 -0.481 -9.694 -5.957
260 H CYS 36 H CYS 36 -6.567 -5.391 -3.992
261 HA CYS 36 HA CYS 36 -7.160 -8.223 -4.320
262 1HB CYS 36 2HB CYS 36 -7.015 -8.272 -1.843
263 2HB CYS 36 1HB CYS 36 -5.557 -7.651 -2.608
264 H GLY 37 H GLY 37 -8.567 -5.513 -2.500
265 1HA GLY 37 1HA GLY 37 -11.218 -6.719 -2.951
266 2HA GLY 37 2HA GLY 37 -10.714 -6.247 -1.337
267 H ARG 38 H ARG 38 -10.285 -3.936 -0.961
268 HA ARG 38 HA ARG 38 -11.317 -1.938 -2.608
269 1HB ARG 38 2HB ARG 38 -13.359 -3.579 -1.966
270 2HB ARG 38 1HB ARG 38 -13.419 -2.476 -0.598
271 1HG ARG 38 2HG ARG 38 -14.850 -1.461 -2.077
272 2HG ARG 38 1HG ARG 38 -13.335 -0.627 -2.428
273 1HD ARG 38 2HD ARG 38 -14.343 -3.019 -3.962
274 2HD ARG 38 1HD ARG 38 -14.620 -1.349 -4.439
275 HE ARG 38 HE ARG 38 -11.931 -2.533 -4.199
276 1HH1 ARG 38 2HH1 ARG 38 -14.252 -0.520 -5.893
277 2HH1 ARG 38 1HH1 ARG 38 -13.123 -0.056 -7.132
278 1HH2 ARG 38 2HH2 ARG 38 -10.458 -1.896 -5.807
279 2HH2 ARG 38 1HH2 ARG 38 -10.968 -0.833 -7.088
280 H GLU 39 H GLU 39 -12.968 -1.168 -0.031
281 HA GLU 39 HA GLU 39 -11.478 0.946 0.756
282 1HB GLU 39 2HB GLU 39 -13.744 -0.506 1.849
283 2HB GLU 39 1HB GLU 39 -12.793 0.281 3.098
284 1HG GLU 39 2HG GLU 39 -14.736 1.575 2.056
285 2HG GLU 39 1HG GLU 39 -13.190 2.402 2.242
286 H LYS 40 H LYS 40 -10.123 1.512 2.357
287 HA LYS 40 HA LYS 40 -8.088 -0.310 3.041
288 1HB LYS 40 2HB LYS 40 -7.915 2.207 2.760
289 2HB LYS 40 1HB LYS 40 -8.618 2.346 4.365
290 1HG LYS 40 2HG LYS 40 -6.746 1.196 5.339
291 2HG LYS 40 1HG LYS 40 -6.069 0.875 3.741
292 1HD LYS 40 2HD LYS 40 -5.179 2.924 3.583
293 2HD LYS 40 1HD LYS 40 -6.630 3.700 4.222
294 1HE LYS 40 2HE LYS 40 -4.869 2.159 6.067
295 2HE LYS 40 1HE LYS 40 -4.369 3.769 5.549
296 1HZ LYS 40 1HZ LYS 40 -6.544 4.595 6.341
297 2HZ LYS 40 2HZ LYS 40 -5.577 3.955 7.579
298 3HZ LYS 40 3HZ LYS 40 -6.878 3.051 6.966
299 H THR 41 H THR 41 -8.524 -1.973 4.336
300 HA THR 41 HA THR 41 -10.377 -1.932 6.474
301 HB THR 41 HB THR 41 -8.745 -4.097 6.958
302 HG1 THR 41 1HG THR 41 -8.181 -4.886 4.882
303 1HG2 THR 41 1HG2 THR 41 -10.700 -4.503 4.802
304 2HG2 THR 41 2HG2 THR 41 -11.329 -3.655 6.216
305 3HG2 THR 41 3HG2 THR 41 -10.602 -5.252 6.397
306 H THR 42 H THR 42 -9.796 -0.249 7.869
307 HA THR 42 HA THR 42 -7.475 -0.833 9.564
308 HB THR 42 HB THR 42 -7.901 2.024 9.350
309 HG1 THR 42 1HG THR 42 -8.352 0.964 7.097
310 1HG2 THR 42 1HG2 THR 42 -5.912 0.703 10.249
311 2HG2 THR 42 2HG2 THR 42 -5.551 2.091 9.223
312 3HG2 THR 42 3HG2 THR 42 -5.456 0.459 8.563
313 H GLY 43 H GLY 43 -8.548 -1.453 11.364
314 1HA GLY 43 1HA GLY 43 -10.390 0.546 12.525
315 2HA GLY 43 2HA GLY 43 -10.801 -1.161 12.527
316 HA PRO 44 HA PRO 44 -7.428 -0.774 15.820
317 1HB PRO 44 2HB PRO 44 -5.861 1.380 16.001
318 2HB PRO 44 1HB PRO 44 -5.584 0.160 14.755
319 1HG PRO 44 2HG PRO 44 -6.781 2.868 14.516
320 2HG PRO 44 1HG PRO 44 -5.812 1.958 13.347
321 1HD PRO 44 2HD PRO 44 -8.630 2.200 13.397
322 2HD PRO 44 1HD PRO 44 -7.676 1.106 12.377
323 H ILE 45 H ILE 45 -6.885 0.633 17.893
324 HA ILE 45 HA ILE 45 -9.217 2.341 18.460
325 HB ILE 45 HB ILE 45 -8.519 1.681 20.942
326 1HG1 ILE 45 2HG1 ILE 45 -8.174 -1.029 19.850
327 1HG2 ILE 45 1HG2 ILE 45 -10.604 1.147 19.268
328 2HG2 ILE 45 2HG2 ILE 45 -10.092 -0.471 19.748
329 3HG2 ILE 45 3HG2 ILE 45 -10.532 0.717 20.976
330 1HD1 ILE 45 1HD1 ILE 45 -7.789 -1.157 22.058
331 2HD1 ILE 45 2HD1 ILE 45 -6.156 -0.695 21.583
332 3HD1 ILE 45 3HD1 ILE 45 -7.278 0.526 22.179
Start of MODEL 3
1 1H GLY 1 1H GLY 1 -2.148 3.759 -15.693
2 2H GLY 1 2H GLY 1 -1.892 3.144 -17.253
3 3H GLY 1 3H GLY 1 -1.326 4.691 -16.846
4 1HA GLY 1 2HA GLY 1 -0.326 2.696 -15.070
5 2HA GLY 1 1HA GLY 1 0.099 2.359 -16.742
6 H SER 2 H SER 2 1.821 3.124 -14.531
7 HA SER 2 HA SER 2 2.627 5.856 -15.147
8 1HB SER 2 2HB SER 2 4.392 4.470 -13.323
9 2HB SER 2 1HB SER 2 3.357 5.866 -13.022
10 HG SER 2 HG SER 2 2.992 3.258 -12.323
11 H MET 3 H MET 3 3.909 6.168 -16.851
12 HA MET 3 HA MET 3 6.342 4.606 -17.099
13 1HB MET 3 2HB MET 3 4.567 3.432 -18.483
14 2HB MET 3 1HB MET 3 4.535 4.864 -19.502
15 1HG MET 3 2HG MET 3 7.230 3.897 -19.101
16 2HG MET 3 1HG MET 3 6.180 2.658 -19.784
17 1HE MET 3 1HE MET 3 5.549 2.348 -21.750
18 2HE MET 3 2HE MET 3 5.290 3.479 -23.080
19 3HE MET 3 3HE MET 3 6.878 2.751 -22.837
20 H SER 4 H SER 4 7.538 6.410 -16.709
21 HA SER 4 HA SER 4 8.709 8.289 -17.179
22 1HB SER 4 2HB SER 4 7.831 7.932 -20.046
23 2HB SER 4 1HB SER 4 9.324 8.661 -19.448
24 HG SER 4 HG SER 4 9.781 6.569 -20.118
25 H THR 5 H THR 5 6.055 8.679 -16.312
26 HA THR 5 HA THR 5 5.071 10.964 -17.813
27 HB THR 5 HB THR 5 3.849 10.342 -15.195
28 HG1 THR 5 1HG THR 5 3.408 8.530 -17.341
29 1HG2 THR 5 1HG2 THR 5 2.689 11.868 -16.579
30 2HG2 THR 5 2HG2 THR 5 1.800 10.352 -16.721
31 3HG2 THR 5 3HG2 THR 5 2.899 10.855 -18.006
32 H LYS 6 H LYS 6 4.184 11.860 -14.890
33 HA LYS 6 HA LYS 6 6.521 13.584 -14.517
34 1HB LYS 6 2HB LYS 6 3.741 14.071 -14.490
35 2HB LYS 6 1HB LYS 6 4.294 14.268 -12.832
36 1HG LYS 6 2HG LYS 6 4.646 16.379 -13.569
37 2HG LYS 6 1HG LYS 6 6.191 15.673 -14.042
38 1HD LYS 6 2HD LYS 6 5.418 15.362 -16.300
39 2HD LYS 6 1HD LYS 6 3.791 15.878 -15.856
40 1HE LYS 6 2HE LYS 6 4.385 17.939 -16.443
41 2HE LYS 6 1HE LYS 6 5.436 17.960 -15.026
42 1HZ LYS 6 1HZ LYS 6 7.197 16.984 -16.451
43 2HZ LYS 6 2HZ LYS 6 6.721 18.542 -16.927
44 3HZ LYS 6 3HZ LYS 6 6.181 17.190 -17.796
45 H ASN 7 H ASN 7 7.357 13.963 -12.412
46 HA ASN 7 HA ASN 7 7.306 11.653 -10.694
47 1HB ASN 7 2HB ASN 7 9.418 12.575 -10.648
48 2HB ASN 7 1HB ASN 7 8.818 14.223 -10.785
49 1HD2 ASN 7 1HD2 ASN 7 9.057 15.409 -9.055
50 2HD2 ASN 7 2HD2 ASN 7 9.171 14.845 -7.420
51 H PHE 8 H PHE 8 5.693 11.304 -9.332
52 HA PHE 8 HA PHE 8 4.291 13.617 -8.202
53 1HB PHE 8 2HB PHE 8 3.245 11.521 -9.613
54 2HB PHE 8 1HB PHE 8 3.001 10.996 -7.948
55 HD1 PHE 8 1HD PHE 8 2.863 14.332 -9.562
56 HD2 PHE 8 2HD PHE 8 0.801 11.325 -7.389
57 HE1 PHE 8 1HE PHE 8 0.900 15.812 -9.394
58 HE2 PHE 8 2HE PHE 8 -1.170 12.791 -7.212
59 HZ PHE 8 HZ PHE 8 -1.123 15.037 -8.214
60 H ARG 9 H ARG 9 5.636 13.947 -6.431
61 HA ARG 9 HA ARG 9 5.977 11.864 -4.470
62 1HB ARG 9 2HB ARG 9 6.958 14.545 -4.862
63 2HB ARG 9 1HB ARG 9 6.287 14.399 -3.245
64 1HG ARG 9 2HG ARG 9 8.544 12.847 -4.468
65 2HG ARG 9 1HG ARG 9 8.562 13.877 -3.037
66 1HD ARG 9 2HD ARG 9 8.434 11.903 -1.949
67 2HD ARG 9 1HD ARG 9 6.712 12.071 -2.288
68 HE ARG 9 HE ARG 9 8.073 10.757 -4.423
69 1HH1 ARG 9 2HH1 ARG 9 6.806 10.232 -1.191
70 2HH1 ARG 9 1HH1 ARG 9 6.561 8.526 -1.431
71 1HH2 ARG 9 2HH2 ARG 9 7.698 8.519 -4.751
72 2HH2 ARG 9 1HH2 ARG 9 7.014 7.565 -3.461
73 H VAL 10 H VAL 10 4.204 11.101 -3.548
74 HA VAL 10 HA VAL 10 1.774 12.531 -3.338
75 HB VAL 10 HB VAL 10 2.341 10.148 -1.613
76 1HG1 VAL 10 1HG1 VAL 10 0.154 10.848 -1.335
77 2HG1 VAL 10 2HG1 VAL 10 -0.021 11.314 -3.028
78 3HG1 VAL 10 3HG1 VAL 10 0.000 9.608 -2.580
79 1HG2 VAL 10 1HG2 VAL 10 1.581 8.847 -3.771
80 2HG2 VAL 10 2HG2 VAL 10 2.325 10.220 -4.594
81 3HG2 VAL 10 3HG2 VAL 10 3.282 9.227 -3.495
82 H SER 11 H SER 11 1.974 14.408 -2.164
83 HA SER 11 HA SER 11 3.302 14.510 0.351
84 1HB SER 11 2HB SER 11 1.592 16.741 0.129
85 2HB SER 11 1HB SER 11 3.316 16.674 -0.235
86 HG SER 11 HG SER 11 2.894 16.641 -2.309
87 H ASP 12 H ASP 12 0.282 13.511 -0.621
88 HA ASP 12 HA ASP 12 -1.140 14.183 1.795
89 1HB ASP 12 2HB ASP 12 -2.182 13.953 -0.531
90 2HB ASP 12 1HB ASP 12 -2.050 12.212 -0.299
91 H GLY 13 H GLY 13 0.566 11.444 0.463
92 1HA GLY 13 1HA GLY 13 1.599 9.981 2.160
93 2HA GLY 13 2HA GLY 13 0.050 10.001 2.977
94 H ASP 14 H ASP 14 1.923 8.639 0.461
95 HA ASP 14 HA ASP 14 -0.260 7.106 -0.652
96 1HB ASP 14 2HB ASP 14 1.220 6.342 -2.258
97 2HB ASP 14 1HB ASP 14 1.931 7.896 -1.851
98 H TRP 15 H TRP 15 -0.556 4.898 -0.456
99 HA TRP 15 HA TRP 15 0.900 3.561 1.692
100 1HB TRP 15 2HB TRP 15 -1.171 2.755 2.708
101 2HB TRP 15 1HB TRP 15 -1.134 4.514 2.712
102 HD1 TRP 15 HD TRP 15 -2.510 5.579 0.413
103 HE1 TRP 15 1HE TRP 15 -4.863 4.894 -0.385
104 HE3 TRP 15 3HE TRP 15 -2.819 0.993 2.643
105 HZ2 TRP 15 2HZ TRP 15 -6.598 2.695 -0.123
106 HZ3 TRP 15 3HZ TRP 15 -4.855 -0.336 2.311
107 HH2 TRP 15 HH TRP 15 -6.704 0.496 0.955
108 H ILE 16 H ILE 16 -0.100 1.187 1.791
109 HA ILE 16 HA ILE 16 0.023 0.242 -0.978
110 HB ILE 16 HB ILE 16 0.940 -1.888 0.125
111 1HG1 ILE 16 2HG1 ILE 16 2.130 -0.300 2.275
112 1HG2 ILE 16 1HG2 ILE 16 3.205 -0.480 0.496
113 2HG2 ILE 16 2HG2 ILE 16 2.553 -0.881 -1.094
114 3HG2 ILE 16 3HG2 ILE 16 2.238 0.706 -0.387
115 1HD1 ILE 16 1HD1 ILE 16 1.976 -2.219 3.531
116 2HD1 ILE 16 2HD1 ILE 16 0.535 -2.783 2.685
117 3HD1 ILE 16 3HD1 ILE 16 2.109 -2.861 1.893
118 H CYS 17 H CYS 17 -0.570 -2.161 1.367
119 HA CYS 17 HA CYS 17 -3.458 -2.025 0.950
120 1HB CYS 17 2HB CYS 17 -2.152 -3.607 -0.664
121 2HB CYS 17 1HB CYS 17 -2.007 -4.656 0.729
122 HA PRO 18 HA PRO 18 -3.421 -2.371 5.303
123 1HB PRO 18 2HB PRO 18 -5.974 -3.838 5.159
124 2HB PRO 18 1HB PRO 18 -5.619 -2.272 5.895
125 1HG PRO 18 2HG PRO 18 -7.035 -2.460 3.632
126 2HG PRO 18 1HG PRO 18 -5.897 -1.126 3.905
127 1HD PRO 18 2HD PRO 18 -5.560 -3.596 2.244
128 2HD PRO 18 1HD PRO 18 -5.063 -1.929 1.896
129 H ASP 19 H ASP 19 -4.045 -5.231 3.429
130 HA ASP 19 HA ASP 19 -2.625 -6.862 5.364
131 1HB ASP 19 2HB ASP 19 -5.270 -6.878 5.577
132 2HB ASP 19 1HB ASP 19 -5.140 -7.979 4.214
133 H LYS 20 H LYS 20 -2.432 -9.185 4.266
134 HA LYS 20 HA LYS 20 -1.940 -10.535 2.578
135 1HB LYS 20 2HB LYS 20 -3.180 -8.355 0.929
136 2HB LYS 20 1HB LYS 20 -2.604 -9.873 0.263
137 1HG LYS 20 2HG LYS 20 -4.719 -10.542 0.543
138 2HG LYS 20 1HG LYS 20 -4.264 -10.738 2.236
139 1HD LYS 20 2HD LYS 20 -6.185 -9.454 2.399
140 2HD LYS 20 1HD LYS 20 -4.915 -8.229 2.435
141 1HE LYS 20 2HE LYS 20 -6.439 -9.059 -0.035
142 2HE LYS 20 1HE LYS 20 -6.825 -7.651 0.951
143 1HZ LYS 20 1HZ LYS 20 -4.170 -8.038 -0.295
144 2HZ LYS 20 2HZ LYS 20 -4.811 -6.609 0.348
145 3HZ LYS 20 3HZ LYS 20 -5.435 -7.252 -1.097
146 H LYS 21 H LYS 21 -0.252 -10.866 1.286
147 HA LYS 21 HA LYS 21 1.862 -8.927 1.272
148 1HB LYS 21 2HB LYS 21 3.076 -10.628 -0.126
149 2HB LYS 21 1HB LYS 21 2.534 -11.195 1.444
150 1HG LYS 21 2HG LYS 21 0.942 -12.589 0.550
151 2HG LYS 21 1HG LYS 21 0.820 -11.661 -0.947
152 1HD LYS 21 2HD LYS 21 3.355 -13.081 -0.224
153 2HD LYS 21 1HD LYS 21 2.025 -13.945 -0.996
154 1HE LYS 21 2HE LYS 21 2.675 -13.178 -2.970
155 2HE LYS 21 1HE LYS 21 2.414 -11.527 -2.412
156 1HZ LYS 21 1HZ LYS 21 4.693 -12.009 -3.248
157 2HZ LYS 21 2HZ LYS 21 4.919 -13.041 -1.923
158 3HZ LYS 21 3HZ LYS 21 4.650 -11.385 -1.671
159 H CYS 22 H CYS 22 -0.439 -7.971 0.043
160 HA CYS 22 HA CYS 22 -0.110 -7.865 -2.804
161 1HB CYS 22 2HB CYS 22 -2.320 -7.550 -1.903
162 2HB CYS 22 1HB CYS 22 -1.766 -6.308 -0.808
163 H GLY 23 H GLY 23 -0.263 -5.129 -0.612
164 1HA GLY 23 1HA GLY 23 1.163 -3.353 -0.267
165 2HA GLY 23 2HA GLY 23 2.440 -4.305 -1.013
166 H ASN 24 H ASN 24 -0.640 -3.472 -2.463
167 HA ASN 24 HA ASN 24 0.612 -2.475 -4.832
168 1HB ASN 24 2HB ASN 24 -1.530 -3.514 -5.071
169 2HB ASN 24 1HB ASN 24 -2.255 -2.471 -3.859
170 1HD2 ASN 24 1HD2 ASN 24 -2.811 -0.351 -4.419
171 2HD2 ASN 24 2HD2 ASN 24 -2.926 0.152 -6.068
172 H VAL 25 H VAL 25 1.164 -0.432 -5.384
173 HA VAL 25 HA VAL 25 1.137 1.562 -3.302
174 HB VAL 25 HB VAL 25 2.132 3.000 -5.246
175 1HG1 VAL 25 1HG1 VAL 25 3.439 2.355 -3.375
176 2HG1 VAL 25 2HG1 VAL 25 3.503 0.678 -3.916
177 3HG1 VAL 25 3HG1 VAL 25 4.363 1.929 -4.815
178 1HG2 VAL 25 1HG2 VAL 25 3.374 1.550 -6.868
179 2HG2 VAL 25 2HG2 VAL 25 2.361 0.204 -6.342
180 3HG2 VAL 25 3HG2 VAL 25 1.628 1.609 -7.114
181 H ASN 26 H ASN 26 -0.792 2.369 -2.884
182 HA ASN 26 HA ASN 26 -2.673 2.983 -5.005
183 1HB ASN 26 2HB ASN 26 -2.764 2.942 -2.008
184 2HB ASN 26 1HB ASN 26 -4.008 3.809 -2.904
185 1HD2 ASN 26 1HD2 ASN 26 -3.372 0.974 -1.451
186 2HD2 ASN 26 2HD2 ASN 26 -4.373 -0.079 -2.382
187 H PHE 27 H PHE 27 -3.551 5.033 -5.385
188 HA PHE 27 HA PHE 27 -1.860 7.160 -5.673
189 1HB PHE 27 2HB PHE 27 -4.115 6.899 -6.710
190 2HB PHE 27 1HB PHE 27 -4.841 7.346 -5.177
191 HD1 PHE 27 1HD PHE 27 -5.666 9.462 -5.115
192 HD2 PHE 27 2HD PHE 27 -2.139 8.705 -7.377
193 HE1 PHE 27 1HE PHE 27 -5.565 11.838 -5.748
194 HE2 PHE 27 2HE PHE 27 -2.034 11.078 -8.016
195 HZ PHE 27 HZ PHE 27 -3.748 12.650 -7.202
196 H ALA 28 H ALA 28 -4.552 7.569 -3.451
197 HA ALA 28 HA ALA 28 -3.191 7.928 -1.053
198 1HB ALA 28 1HB ALA 28 -2.693 10.084 -2.750
199 2HB ALA 28 2HB ALA 28 -3.962 10.653 -1.666
200 3HB ALA 28 3HB ALA 28 -2.445 10.039 -1.002
201 H ARG 29 H ARG 29 -5.683 9.667 -2.898
202 HA ARG 29 HA ARG 29 -7.564 9.430 -0.722
203 1HB ARG 29 2HB ARG 29 -7.593 10.753 -3.408
204 2HB ARG 29 1HB ARG 29 -9.102 10.507 -2.538
205 1HG ARG 29 2HG ARG 29 -6.789 12.260 -1.862
206 2HG ARG 29 1HG ARG 29 -8.517 12.620 -1.860
207 1HD ARG 29 2HD ARG 29 -8.827 11.777 0.231
208 2HD ARG 29 1HD ARG 29 -7.561 10.564 0.049
209 HE ARG 29 HE ARG 29 -5.939 12.197 0.619
210 1HH1 ARG 29 2HH1 ARG 29 -9.242 13.348 0.855
211 2HH1 ARG 29 1HH1 ARG 29 -8.832 14.714 1.848
212 1HH2 ARG 29 2HH2 ARG 29 -5.392 13.976 1.917
213 2HH2 ARG 29 1HH2 ARG 29 -6.638 15.063 2.470
214 H ARG 30 H ARG 30 -6.897 6.970 -1.346
215 HA ARG 30 HA ARG 30 -9.318 5.919 -2.645
216 1HB ARG 30 2HB ARG 30 -6.475 5.087 -2.824
217 2HB ARG 30 1HB ARG 30 -7.668 3.797 -2.728
218 1HG ARG 30 2HG ARG 30 -7.804 6.034 -4.730
219 2HG ARG 30 1HG ARG 30 -7.004 4.491 -5.043
220 1HD ARG 30 2HD ARG 30 -9.577 3.918 -4.003
221 2HD ARG 30 1HD ARG 30 -9.774 5.153 -5.247
222 HE ARG 30 HE ARG 30 -8.306 3.510 -6.608
223 1HH1 ARG 30 2HH1 ARG 30 -10.825 2.642 -4.322
224 2HH1 ARG 30 1HH1 ARG 30 -11.179 1.125 -5.100
225 1HH2 ARG 30 2HH2 ARG 30 -8.739 1.515 -7.610
226 2HH2 ARG 30 1HH2 ARG 30 -9.979 0.471 -6.961
227 H THR 31 H THR 31 -10.658 5.110 -1.172
228 HA THR 31 HA THR 31 -9.713 4.426 1.466
229 HB THR 31 HB THR 31 -12.382 3.619 1.269
230 HG1 THR 31 1HG THR 31 -13.344 4.905 -0.119
231 1HG2 THR 31 1HG2 THR 31 -11.991 4.737 3.198
232 2HG2 THR 31 2HG2 THR 31 -12.575 6.121 2.274
233 3HG2 THR 31 3HG2 THR 31 -10.843 5.846 2.445
234 H SER 32 H SER 32 -9.797 2.823 -1.409
235 HA SER 32 HA SER 32 -9.625 0.239 -0.059
236 1HB SER 32 2HB SER 32 -11.209 0.593 -2.616
237 2HB SER 32 1HB SER 32 -11.065 -0.868 -1.638
238 HG SER 32 HG SER 32 -11.948 1.023 -0.037
239 H CYS 33 H CYS 33 -8.393 -1.323 -1.213
240 HA CYS 33 HA CYS 33 -6.159 -0.390 -2.579
241 1HB CYS 33 2HB CYS 33 -6.284 -2.580 -1.430
242 2HB CYS 33 1HB CYS 33 -7.352 -3.168 -2.697
243 H ASP 34 H ASP 34 -5.676 -0.030 -4.630
244 HA ASP 34 HA ASP 34 -7.716 0.126 -6.617
245 1HB ASP 34 2HB ASP 34 -5.535 1.526 -6.357
246 2HB ASP 34 1HB ASP 34 -4.777 0.203 -7.235
247 H ARG 35 H ARG 35 -5.832 -2.380 -5.449
248 HA ARG 35 HA ARG 35 -6.075 -3.899 -7.955
249 1HB ARG 35 2HB ARG 35 -3.806 -3.604 -6.811
250 2HB ARG 35 1HB ARG 35 -4.419 -4.689 -5.571
251 1HG ARG 35 2HG ARG 35 -4.872 -5.815 -8.163
252 2HG ARG 35 1HG ARG 35 -3.178 -5.363 -7.984
253 1HD ARG 35 2HD ARG 35 -4.712 -6.993 -5.966
254 2HD ARG 35 1HD ARG 35 -3.726 -7.695 -7.250
255 HE ARG 35 HE ARG 35 -2.783 -6.296 -4.867
256 1HH1 ARG 35 2HH1 ARG 35 -2.004 -7.752 -7.961
257 2HH1 ARG 35 1HH1 ARG 35 -0.316 -7.924 -7.595
258 1HH2 ARG 35 2HH2 ARG 35 -0.590 -6.496 -4.391
259 2HH2 ARG 35 1HH2 ARG 35 0.491 -7.217 -5.551
260 H CYS 36 H CYS 36 -6.294 -4.423 -4.425
261 HA CYS 36 HA CYS 36 -7.836 -6.816 -4.793
262 1HB CYS 36 2HB CYS 36 -7.352 -5.270 -2.275
263 2HB CYS 36 1HB CYS 36 -7.866 -6.945 -2.395
264 H GLY 37 H GLY 37 -8.514 -3.483 -3.964
265 1HA GLY 37 1HA GLY 37 -10.578 -2.396 -3.905
266 2HA GLY 37 2HA GLY 37 -11.375 -3.950 -4.152
267 H ARG 38 H ARG 38 -9.005 -4.108 -1.780
268 HA ARG 38 HA ARG 38 -10.961 -4.422 0.313
269 1HB ARG 38 2HB ARG 38 -8.419 -5.442 -0.158
270 2HB ARG 38 1HB ARG 38 -8.179 -4.328 1.181
271 1HG ARG 38 2HG ARG 38 -10.481 -6.157 1.378
272 2HG ARG 38 1HG ARG 38 -8.872 -6.865 1.523
273 1HD ARG 38 2HD ARG 38 -8.423 -4.963 3.200
274 2HD ARG 38 1HD ARG 38 -10.179 -4.787 3.241
275 HE ARG 38 HE ARG 38 -10.071 -7.315 3.759
276 1HH1 ARG 38 2HH1 ARG 38 -7.891 -4.847 4.943
277 2HH1 ARG 38 1HH1 ARG 38 -7.416 -5.745 6.354
278 1HH2 ARG 38 2HH2 ARG 38 -9.460 -8.513 5.607
279 2HH2 ARG 38 1HH2 ARG 38 -8.297 -7.850 6.721
280 H GLU 39 H GLU 39 -11.425 -3.025 1.906
281 HA GLU 39 HA GLU 39 -10.733 -0.283 1.421
282 1HB GLU 39 2HB GLU 39 -12.179 -0.993 3.903
283 2HB GLU 39 1HB GLU 39 -12.538 0.243 2.708
284 1HG GLU 39 2HG GLU 39 -14.283 -1.144 2.327
285 2HG GLU 39 1HG GLU 39 -13.110 -1.870 1.229
286 H LYS 40 H LYS 40 -9.888 1.170 2.977
287 HA LYS 40 HA LYS 40 -7.729 0.206 4.577
288 1HB LYS 40 2HB LYS 40 -8.432 2.648 3.501
289 2HB LYS 40 1HB LYS 40 -8.759 2.886 5.213
290 1HG LYS 40 2HG LYS 40 -6.399 1.964 5.593
291 2HG LYS 40 1HG LYS 40 -6.160 2.249 3.867
292 1HD LYS 40 2HD LYS 40 -7.232 4.613 4.602
293 2HD LYS 40 1HD LYS 40 -6.411 4.168 6.101
294 1HE LYS 40 2HE LYS 40 -4.591 3.605 4.053
295 2HE LYS 40 1HE LYS 40 -5.314 5.155 3.619
296 1HZ LYS 40 1HZ LYS 40 -3.882 4.454 6.122
297 2HZ LYS 40 2HZ LYS 40 -4.791 5.877 5.949
298 3HZ LYS 40 3HZ LYS 40 -3.439 5.610 4.959
299 H THR 41 H THR 41 -8.852 -1.333 5.839
300 HA THR 41 HA THR 41 -11.164 -1.119 7.245
301 HB THR 41 HB THR 41 -9.848 -2.716 8.920
302 HG1 THR 41 1HG THR 41 -7.796 -2.116 7.955
303 1HG2 THR 41 1HG2 THR 41 -10.785 -4.415 7.739
304 2HG2 THR 41 2HG2 THR 41 -10.070 -3.889 6.214
305 3HG2 THR 41 3HG2 THR 41 -11.520 -3.094 6.830
306 H THR 42 H THR 42 -11.726 0.580 8.477
307 HA THR 42 HA THR 42 -9.986 1.992 10.201
308 HB THR 42 HB THR 42 -12.600 2.320 11.171
309 HG1 THR 42 1HG THR 42 -13.871 1.794 9.568
310 1HG2 THR 42 1HG2 THR 42 -10.669 3.959 10.476
311 2HG2 THR 42 2HG2 THR 42 -12.348 4.498 10.447
312 3HG2 THR 42 3HG2 THR 42 -11.551 4.019 8.949
313 H GLY 43 H GLY 43 -9.218 1.386 12.117
314 1HA GLY 43 1HA GLY 43 -10.797 -0.364 13.846
315 2HA GLY 43 2HA GLY 43 -9.235 -0.972 13.313
316 HA PRO 44 HA PRO 44 -7.190 1.193 16.614
317 1HB PRO 44 2HB PRO 44 -5.211 2.121 14.609
318 2HB PRO 44 1HB PRO 44 -4.955 1.192 16.091
319 1HG PRO 44 2HG PRO 44 -4.771 0.024 13.704
320 2HG PRO 44 1HG PRO 44 -5.512 -0.820 15.077
321 1HD PRO 44 2HD PRO 44 -6.825 0.540 12.757
322 2HD PRO 44 1HD PRO 44 -7.244 -0.993 13.549
323 H ILE 45 H ILE 45 -7.484 2.808 13.533
324 HA ILE 45 HA ILE 45 -8.209 5.292 14.919
325 HB ILE 45 HB ILE 45 -6.329 4.871 12.633
326 1HG1 ILE 45 2HG1 ILE 45 -5.373 5.417 14.761
327 1HG2 ILE 45 1HG2 ILE 45 -7.322 6.340 11.286
328 2HG2 ILE 45 2HG2 ILE 45 -8.493 6.789 12.528
329 3HG2 ILE 45 3HG2 ILE 45 -6.917 7.578 12.476
330 1HD1 ILE 45 1HD1 ILE 45 -7.271 6.405 15.890
331 2HD1 ILE 45 2HD1 ILE 45 -5.877 7.484 15.962
332 3HD1 ILE 45 3HD1 ILE 45 -7.188 7.811 14.829
Start of MODEL 4
1 1H GLY 1 1H GLY 1 19.998 23.022 -13.699
2 2H GLY 1 2H GLY 1 19.244 21.543 -14.048
3 3H GLY 1 3H GLY 1 19.919 21.806 -12.516
4 1HA GLY 1 2HA GLY 1 18.281 23.370 -11.933
5 2HA GLY 1 1HA GLY 1 17.700 23.443 -13.594
6 H SER 2 H SER 2 15.720 23.022 -12.036
7 HA SER 2 HA SER 2 15.338 20.338 -11.160
8 1HB SER 2 2HB SER 2 12.934 21.964 -11.656
9 2HB SER 2 1HB SER 2 13.471 21.161 -10.180
10 HG SER 2 HG SER 2 14.175 23.009 -9.512
11 H MET 3 H MET 3 15.395 18.787 -12.669
12 HA MET 3 HA MET 3 13.810 19.169 -15.123
13 1HB MET 3 2HB MET 3 15.104 16.928 -15.711
14 2HB MET 3 1HB MET 3 15.840 18.508 -15.931
15 1HG MET 3 2HG MET 3 16.636 18.040 -13.438
16 2HG MET 3 1HG MET 3 16.454 16.373 -13.984
17 1HE MET 3 1HE MET 3 19.979 17.041 -13.619
18 2HE MET 3 2HE MET 3 18.577 16.016 -13.311
19 3HE MET 3 3HE MET 3 19.648 15.662 -14.666
20 H SER 4 H SER 4 13.751 17.605 -12.127
21 HA SER 4 HA SER 4 11.966 15.494 -13.014
22 1HB SER 4 2HB SER 4 12.183 15.972 -10.122
23 2HB SER 4 1HB SER 4 12.428 14.488 -11.039
24 HG SER 4 HG SER 4 14.516 15.311 -11.624
25 H THR 5 H THR 5 10.189 16.625 -13.820
26 HA THR 5 HA THR 5 8.843 18.616 -12.260
27 HB THR 5 HB THR 5 7.148 17.551 -14.299
28 HG1 THR 5 1HG THR 5 8.735 17.992 -16.058
29 1HG2 THR 5 1HG2 THR 5 7.984 19.839 -15.353
30 2HG2 THR 5 2HG2 THR 5 8.620 20.074 -13.725
31 3HG2 THR 5 3HG2 THR 5 6.893 19.807 -13.967
32 H LYS 6 H LYS 6 6.696 16.362 -13.702
33 HA LYS 6 HA LYS 6 5.692 15.707 -11.024
34 1HB LYS 6 2HB LYS 6 4.437 16.558 -13.433
35 2HB LYS 6 1HB LYS 6 3.861 14.937 -13.072
36 1HG LYS 6 2HG LYS 6 2.397 16.598 -12.107
37 2HG LYS 6 1HG LYS 6 3.205 15.683 -10.833
38 1HD LYS 6 2HD LYS 6 4.947 17.645 -10.969
39 2HD LYS 6 1HD LYS 6 3.584 18.521 -11.674
40 1HE LYS 6 2HE LYS 6 2.239 17.813 -9.675
41 2HE LYS 6 1HE LYS 6 3.739 17.214 -8.968
42 1HZ LYS 6 1HZ LYS 6 4.650 19.401 -8.995
43 2HZ LYS 6 2HZ LYS 6 3.130 19.484 -8.250
44 3HZ LYS 6 3HZ LYS 6 3.319 20.016 -9.852
45 H ASN 7 H ASN 7 7.838 14.247 -11.642
46 HA ASN 7 HA ASN 7 7.279 11.843 -13.046
47 1HB ASN 7 2HB ASN 7 9.573 12.954 -12.339
48 2HB ASN 7 1HB ASN 7 9.373 11.928 -10.920
49 1HD2 ASN 7 1HD2 ASN 7 9.331 11.841 -14.450
50 2HD2 ASN 7 2HD2 ASN 7 10.027 10.256 -14.592
51 H PHE 8 H PHE 8 6.065 10.207 -12.425
52 HA PHE 8 HA PHE 8 5.102 10.022 -9.723
53 1HB PHE 8 2HB PHE 8 3.926 9.447 -12.040
54 2HB PHE 8 1HB PHE 8 4.593 7.852 -11.697
55 HD1 PHE 8 1HD PHE 8 2.800 10.560 -9.874
56 HD2 PHE 8 2HD PHE 8 3.200 6.390 -10.607
57 HE1 PHE 8 1HE PHE 8 0.907 10.117 -8.358
58 HE2 PHE 8 2HE PHE 8 1.313 5.934 -9.093
59 HZ PHE 8 HZ PHE 8 0.162 7.802 -7.967
60 H ARG 9 H ARG 9 7.645 9.718 -9.281
61 HA ARG 9 HA ARG 9 8.363 6.916 -9.221
62 1HB ARG 9 2HB ARG 9 10.004 8.251 -7.388
63 2HB ARG 9 1HB ARG 9 10.413 7.813 -9.039
64 1HG ARG 9 2HG ARG 9 9.735 9.977 -9.837
65 2HG ARG 9 1HG ARG 9 9.123 10.413 -8.240
66 1HD ARG 9 2HD ARG 9 11.863 9.547 -8.067
67 2HD ARG 9 1HD ARG 9 11.701 10.843 -9.252
68 HE ARG 9 HE ARG 9 11.135 12.313 -7.563
69 1HH1 ARG 9 2HH1 ARG 9 11.296 9.034 -6.321
70 2HH1 ARG 9 1HH1 ARG 9 11.168 9.511 -4.658
71 1HH2 ARG 9 2HH2 ARG 9 10.961 12.943 -5.361
72 2HH2 ARG 9 1HH2 ARG 9 10.962 11.731 -4.112
73 H VAL 10 H VAL 10 6.284 6.422 -8.256
74 HA VAL 10 HA VAL 10 5.112 5.549 -6.529
75 HB VAL 10 HB VAL 10 7.516 6.445 -5.002
76 1HG1 VAL 10 1HG1 VAL 10 5.946 4.996 -3.200
77 2HG1 VAL 10 2HG1 VAL 10 6.375 6.703 -3.101
78 3HG1 VAL 10 3HG1 VAL 10 4.866 6.215 -3.875
79 1HG2 VAL 10 1HG2 VAL 10 7.266 4.288 -6.365
80 2HG2 VAL 10 2HG2 VAL 10 7.911 4.168 -4.727
81 3HG2 VAL 10 3HG2 VAL 10 6.230 3.743 -5.046
82 H SER 11 H SER 11 3.315 6.275 -5.596
83 HA SER 11 HA SER 11 2.581 8.958 -5.955
84 1HB SER 11 2HB SER 11 0.892 7.537 -4.079
85 2HB SER 11 1HB SER 11 0.537 8.077 -5.724
86 HG SER 11 HG SER 11 0.668 5.660 -5.091
87 H ASP 12 H ASP 12 1.812 10.463 -4.362
88 HA ASP 12 HA ASP 12 3.771 10.892 -2.343
89 1HB ASP 12 2HB ASP 12 2.578 12.659 -3.715
90 2HB ASP 12 1HB ASP 12 1.178 12.400 -2.679
91 H GLY 13 H GLY 13 0.295 10.106 -2.229
92 1HA GLY 13 1HA GLY 13 0.540 9.912 0.702
93 2HA GLY 13 2HA GLY 13 -0.939 10.278 -0.158
94 H ASP 14 H ASP 14 1.247 7.757 -1.109
95 HA ASP 14 HA ASP 14 -0.736 5.743 -1.090
96 1HB ASP 14 2HB ASP 14 1.093 5.376 -2.552
97 2HB ASP 14 1HB ASP 14 2.276 5.661 -1.279
98 H TRP 15 H TRP 15 -0.840 3.831 0.326
99 HA TRP 15 HA TRP 15 0.229 4.360 2.986
100 1HB TRP 15 2HB TRP 15 -2.086 3.164 3.624
101 2HB TRP 15 1HB TRP 15 -1.882 4.908 3.636
102 HD1 TRP 15 HD TRP 15 -2.851 6.184 1.302
103 HE1 TRP 15 1HE TRP 15 -4.940 5.586 -0.075
104 HE3 TRP 15 3HE TRP 15 -3.479 1.322 2.807
105 HZ2 TRP 15 2HZ TRP 15 -6.653 3.350 -0.456
106 HZ3 TRP 15 3HZ TRP 15 -5.355 0.045 1.900
107 HH2 TRP 15 HH TRP 15 -6.900 1.024 0.292
108 H ILE 16 H ILE 16 -0.140 2.474 0.487
109 HA ILE 16 HA ILE 16 0.283 0.307 -0.070
110 HB ILE 16 HB ILE 16 1.310 0.321 2.747
111 1HG1 ILE 16 2HG1 ILE 16 2.688 1.228 0.908
112 1HG2 ILE 16 1HG2 ILE 16 1.148 -1.860 3.034
113 2HG2 ILE 16 2HG2 ILE 16 0.186 -1.948 1.558
114 3HG2 ILE 16 3HG2 ILE 16 1.935 -2.157 1.483
115 1HD1 ILE 16 1HD1 ILE 16 3.707 -0.958 -0.395
116 2HD1 ILE 16 2HD1 ILE 16 1.968 -1.259 -0.411
117 3HD1 ILE 16 3HD1 ILE 16 2.611 0.243 -1.080
118 H CYS 17 H CYS 17 -1.043 -1.443 -0.282
119 HA CYS 17 HA CYS 17 -3.636 -1.489 0.466
120 1HB CYS 17 2HB CYS 17 -2.800 -3.035 -1.180
121 2HB CYS 17 1HB CYS 17 -1.773 -3.825 -0.004
122 HA PRO 18 HA PRO 18 -3.895 -2.448 4.767
123 1HB PRO 18 2HB PRO 18 -6.445 -3.797 4.219
124 2HB PRO 18 1HB PRO 18 -6.131 -2.347 5.179
125 1HG PRO 18 2HG PRO 18 -7.371 -2.227 2.802
126 2HG PRO 18 1HG PRO 18 -6.271 -0.948 3.352
127 1HD PRO 18 2HD PRO 18 -5.756 -3.192 1.430
128 2HD PRO 18 1HD PRO 18 -5.287 -1.485 1.313
129 H ASP 19 H ASP 19 -3.922 -4.747 2.261
130 HA ASP 19 HA ASP 19 -3.863 -7.037 4.105
131 1HB ASP 19 2HB ASP 19 -5.184 -6.820 1.792
132 2HB ASP 19 1HB ASP 19 -3.638 -7.361 1.147
133 H LYS 20 H LYS 20 -2.245 -8.799 3.086
134 HA LYS 20 HA LYS 20 0.336 -7.413 2.731
135 1HB LYS 20 2HB LYS 20 -0.470 -9.651 4.506
136 2HB LYS 20 1HB LYS 20 1.120 -9.760 3.765
137 1HG LYS 20 2HG LYS 20 1.573 -8.712 5.765
138 2HG LYS 20 1HG LYS 20 1.437 -7.349 4.652
139 1HD LYS 20 2HD LYS 20 -1.028 -7.258 5.372
140 2HD LYS 20 1HD LYS 20 -0.538 -8.308 6.704
141 1HE LYS 20 2HE LYS 20 -0.275 -6.273 7.697
142 2HE LYS 20 1HE LYS 20 1.333 -6.484 7.007
143 1HZ LYS 20 1HZ LYS 20 0.379 -5.245 5.008
144 2HZ LYS 20 2HZ LYS 20 0.741 -4.351 6.398
145 3HZ LYS 20 3HZ LYS 20 -0.864 -4.765 6.056
146 H LYS 21 H LYS 21 -1.824 -8.852 0.983
147 HA LYS 21 HA LYS 21 -0.063 -10.733 -0.398
148 1HB LYS 21 2HB LYS 21 -2.103 -11.325 -1.703
149 2HB LYS 21 1HB LYS 21 -2.258 -11.602 0.025
150 1HG LYS 21 2HG LYS 21 -3.937 -10.139 0.230
151 2HG LYS 21 1HG LYS 21 -3.176 -8.965 -0.846
152 1HD LYS 21 2HD LYS 21 -4.206 -9.790 -2.699
153 2HD LYS 21 1HD LYS 21 -4.216 -11.444 -2.086
154 1HE LYS 21 2HE LYS 21 -6.467 -10.301 -2.308
155 2HE LYS 21 1HE LYS 21 -6.113 -11.051 -0.752
156 1HZ LYS 21 1HZ LYS 21 -7.055 -8.600 -0.965
157 2HZ LYS 21 2HZ LYS 21 -5.408 -8.240 -1.056
158 3HZ LYS 21 3HZ LYS 21 -6.015 -9.059 0.294
159 H CYS 22 H CYS 22 -1.429 -7.581 -0.692
160 HA CYS 22 HA CYS 22 -0.665 -7.367 -3.502
161 1HB CYS 22 2HB CYS 22 -1.938 -5.308 -1.703
162 2HB CYS 22 1HB CYS 22 -1.734 -5.183 -3.437
163 H GLY 23 H GLY 23 -0.353 -5.225 -0.684
164 1HA GLY 23 1HA GLY 23 1.239 -3.655 -0.182
165 2HA GLY 23 2HA GLY 23 2.393 -4.602 -1.130
166 H ASN 24 H ASN 24 -0.678 -3.323 -2.169
167 HA ASN 24 HA ASN 24 0.256 -2.398 -4.628
168 1HB ASN 24 2HB ASN 24 -1.944 -2.420 -5.004
169 2HB ASN 24 1HB ASN 24 -2.216 -2.770 -3.314
170 1HD2 ASN 24 1HD2 ASN 24 -2.693 -0.562 -5.816
171 2HD2 ASN 24 2HD2 ASN 24 -3.355 0.723 -4.879
172 H VAL 25 H VAL 25 0.952 -0.506 -5.352
173 HA VAL 25 HA VAL 25 1.468 1.633 -3.474
174 HB VAL 25 HB VAL 25 2.344 2.739 -5.686
175 1HG1 VAL 25 1HG1 VAL 25 3.741 2.020 -3.819
176 2HG1 VAL 25 2HG1 VAL 25 3.718 0.365 -4.436
177 3HG1 VAL 25 3HG1 VAL 25 4.506 1.644 -5.364
178 1HG2 VAL 25 1HG2 VAL 25 1.245 0.798 -7.009
179 2HG2 VAL 25 2HG2 VAL 25 2.848 1.359 -7.486
180 3HG2 VAL 25 3HG2 VAL 25 2.676 -0.114 -6.531
181 H ASN 26 H ASN 26 -0.575 2.380 -2.976
182 HA ASN 26 HA ASN 26 -2.489 2.881 -5.073
183 1HB ASN 26 2HB ASN 26 -2.716 2.292 -2.388
184 2HB ASN 26 1HB ASN 26 -3.119 3.999 -2.447
185 1HD2 ASN 26 1HD2 ASN 26 -4.315 0.964 -2.611
186 2HD2 ASN 26 2HD2 ASN 26 -5.790 1.303 -3.453
187 H PHE 27 H PHE 27 -3.654 5.020 -5.088
188 HA PHE 27 HA PHE 27 -1.808 7.041 -5.794
189 1HB PHE 27 2HB PHE 27 -4.010 6.849 -6.853
190 2HB PHE 27 1HB PHE 27 -4.797 7.224 -5.323
191 HD1 PHE 27 1HD PHE 27 -1.968 8.745 -7.239
192 HD2 PHE 27 2HD PHE 27 -5.752 9.297 -5.369
193 HE1 PHE 27 1HE PHE 27 -1.883 11.144 -7.782
194 HE2 PHE 27 2HE PHE 27 -5.674 11.694 -5.911
195 HZ PHE 27 HZ PHE 27 -3.738 12.619 -7.117
196 H ALA 28 H ALA 28 -4.429 7.467 -3.453
197 HA ALA 28 HA ALA 28 -2.881 8.021 -1.196
198 1HB ALA 28 1HB ALA 28 -2.386 10.210 -1.224
199 2HB ALA 28 2HB ALA 28 -2.585 10.080 -2.971
200 3HB ALA 28 3HB ALA 28 -3.921 10.647 -1.970
201 H ARG 29 H ARG 29 -5.554 9.945 -2.513
202 HA ARG 29 HA ARG 29 -7.126 9.482 -0.156
203 1HB ARG 29 2HB ARG 29 -7.469 11.079 -2.664
204 2HB ARG 29 1HB ARG 29 -8.867 10.771 -1.644
205 1HG ARG 29 2HG ARG 29 -6.362 12.275 -0.965
206 2HG ARG 29 1HG ARG 29 -8.024 12.864 -0.987
207 1HD ARG 29 2HD ARG 29 -8.571 11.487 0.926
208 2HD ARG 29 1HD ARG 29 -6.959 10.775 0.906
209 HE ARG 29 HE ARG 29 -7.662 13.504 1.735
210 1HH1 ARG 29 2HH1 ARG 29 -5.242 10.999 1.365
211 2HH1 ARG 29 1HH1 ARG 29 -4.072 11.788 2.376
212 1HH2 ARG 29 2HH2 ARG 29 -6.149 14.543 3.086
213 2HH2 ARG 29 1HH2 ARG 29 -4.592 13.814 3.363
214 H ARG 30 H ARG 30 -6.576 7.077 -1.424
215 HA ARG 30 HA ARG 30 -9.129 6.257 -2.574
216 1HB ARG 30 2HB ARG 30 -6.383 5.234 -2.686
217 2HB ARG 30 1HB ARG 30 -7.567 3.986 -2.331
218 1HG ARG 30 2HG ARG 30 -7.781 5.882 -4.655
219 2HG ARG 30 1HG ARG 30 -7.069 4.270 -4.752
220 1HD ARG 30 2HD ARG 30 -9.194 3.736 -5.369
221 2HD ARG 30 1HD ARG 30 -9.392 3.615 -3.621
222 HE ARG 30 HE ARG 30 -9.940 6.214 -4.796
223 1HH1 ARG 30 2HH1 ARG 30 -11.272 3.152 -3.705
224 2HH1 ARG 30 1HH1 ARG 30 -12.869 3.789 -3.486
225 1HH2 ARG 30 2HH2 ARG 30 -12.034 7.050 -4.490
226 2HH2 ARG 30 1HH2 ARG 30 -13.317 5.992 -3.961
227 H THR 31 H THR 31 -10.587 5.090 -1.446
228 HA THR 31 HA THR 31 -9.985 4.542 1.358
229 HB THR 31 HB THR 31 -12.657 3.828 0.761
230 HG1 THR 31 1HG THR 31 -12.063 6.423 -0.265
231 1HG2 THR 31 1HG2 THR 31 -12.439 6.486 1.831
232 2HG2 THR 31 2HG2 THR 31 -11.231 5.433 2.570
233 3HG2 THR 31 3HG2 THR 31 -12.940 5.000 2.632
234 H SER 32 H SER 32 -9.631 2.963 -1.448
235 HA SER 32 HA SER 32 -9.775 0.371 -0.160
236 1HB SER 32 2HB SER 32 -10.836 0.005 -2.793
237 2HB SER 32 1HB SER 32 -11.599 -0.361 -1.244
238 HG SER 32 HG SER 32 -12.739 1.418 -1.367
239 H CYS 33 H CYS 33 -8.570 -1.230 -1.219
240 HA CYS 33 HA CYS 33 -6.212 -0.373 -2.509
241 1HB CYS 33 2HB CYS 33 -6.270 -2.334 -1.104
242 2HB CYS 33 1HB CYS 33 -7.476 -3.088 -2.133
243 H ASP 34 H ASP 34 -5.488 -0.929 -4.615
244 HA ASP 34 HA ASP 34 -7.641 -0.951 -6.606
245 1HB ASP 34 2HB ASP 34 -6.415 0.723 -7.476
246 2HB ASP 34 1HB ASP 34 -5.067 0.382 -6.402
247 H ARG 35 H ARG 35 -5.257 -2.874 -5.165
248 HA ARG 35 HA ARG 35 -4.916 -4.635 -7.457
249 1HB ARG 35 2HB ARG 35 -3.105 -3.986 -5.712
250 2HB ARG 35 1HB ARG 35 -3.866 -5.214 -4.709
251 1HG ARG 35 2HG ARG 35 -2.924 -6.881 -5.856
252 2HG ARG 35 1HG ARG 35 -3.325 -6.149 -7.411
253 1HD ARG 35 2HD ARG 35 -1.365 -4.488 -6.477
254 2HD ARG 35 1HD ARG 35 -0.832 -6.057 -5.875
255 HE ARG 35 HE ARG 35 -1.493 -6.489 -8.504
256 1HH1 ARG 35 2HH1 ARG 35 0.741 -4.399 -6.793
257 2HH1 ARG 35 1HH1 ARG 35 1.875 -4.303 -8.106
258 1HH2 ARG 35 2HH2 ARG 35 -0.028 -6.335 -10.253
259 2HH2 ARG 35 1HH2 ARG 35 1.416 -5.381 -10.088
260 H CYS 36 H CYS 36 -6.328 -4.794 -4.172
261 HA CYS 36 HA CYS 36 -7.754 -7.200 -5.099
262 1HB CYS 36 2HB CYS 36 -7.982 -7.902 -2.765
263 2HB CYS 36 1HB CYS 36 -6.297 -7.725 -3.221
264 H GLY 37 H GLY 37 -8.151 -4.463 -2.866
265 1HA GLY 37 1HA GLY 37 -10.073 -2.976 -3.492
266 2HA GLY 37 2HA GLY 37 -11.016 -4.457 -3.589
267 H ARG 38 H ARG 38 -8.766 -4.711 -1.130
268 HA ARG 38 HA ARG 38 -10.649 -4.645 0.956
269 1HB ARG 38 2HB ARG 38 -8.365 -5.778 0.943
270 2HB ARG 38 1HB ARG 38 -7.685 -4.198 1.295
271 1HG ARG 38 2HG ARG 38 -7.868 -5.304 3.362
272 2HG ARG 38 1HG ARG 38 -9.185 -4.131 3.319
273 1HD ARG 38 2HD ARG 38 -9.716 -6.487 4.165
274 2HD ARG 38 1HD ARG 38 -10.805 -5.780 2.973
275 HE ARG 38 HE ARG 38 -10.011 -7.285 1.365
276 1HH1 ARG 38 2HH1 ARG 38 -8.434 -7.736 4.464
277 2HH1 ARG 38 1HH1 ARG 38 -7.779 -9.294 4.054
278 1HH2 ARG 38 2HH2 ARG 38 -9.124 -9.329 0.811
279 2HH2 ARG 38 1HH2 ARG 38 -8.157 -10.184 1.979
280 H GLU 39 H GLU 39 -11.268 -3.077 2.374
281 HA GLU 39 HA GLU 39 -10.987 -0.372 1.487
282 1HB GLU 39 2HB GLU 39 -12.319 -1.531 3.942
283 2HB GLU 39 1HB GLU 39 -12.443 0.148 3.436
284 1HG GLU 39 2HG GLU 39 -14.394 -0.768 2.629
285 2HG GLU 39 1HG GLU 39 -13.335 -0.834 1.221
286 H LYS 40 H LYS 40 -10.201 1.375 2.666
287 HA LYS 40 HA LYS 40 -7.751 1.096 3.990
288 1HB LYS 40 2HB LYS 40 -9.065 3.182 2.927
289 2HB LYS 40 1HB LYS 40 -9.472 3.447 4.615
290 1HG LYS 40 2HG LYS 40 -7.000 3.357 5.101
291 2HG LYS 40 1HG LYS 40 -6.748 3.409 3.354
292 1HD LYS 40 2HD LYS 40 -8.394 5.473 3.543
293 2HD LYS 40 1HD LYS 40 -7.768 5.512 5.194
294 1HE LYS 40 2HE LYS 40 -5.995 6.600 4.430
295 2HE LYS 40 1HE LYS 40 -5.539 5.141 3.554
296 1HZ LYS 40 1HZ LYS 40 -7.404 7.159 2.429
297 2HZ LYS 40 2HZ LYS 40 -6.610 5.906 1.620
298 3HZ LYS 40 3HZ LYS 40 -5.723 7.229 2.195
299 H THR 41 H THR 41 -7.531 -0.017 5.834
300 HA THR 41 HA THR 41 -9.628 -0.466 7.668
301 HB THR 41 HB THR 41 -7.393 -1.124 9.077
302 HG1 THR 41 1HG THR 41 -5.705 -1.202 7.790
303 1HG2 THR 41 1HG2 THR 41 -8.547 -2.761 6.815
304 2HG2 THR 41 2HG2 THR 41 -9.306 -2.574 8.397
305 3HG2 THR 41 3HG2 THR 41 -7.736 -3.368 8.258
306 H THR 42 H THR 42 -6.532 1.219 8.235
307 HA THR 42 HA THR 42 -7.952 3.237 9.795
308 HB THR 42 HB THR 42 -5.563 2.659 11.228
309 HG1 THR 42 1HG THR 42 -5.899 0.517 10.221
310 1HG2 THR 42 1HG2 THR 42 -8.364 1.988 12.101
311 2HG2 THR 42 2HG2 THR 42 -7.791 3.652 11.979
312 3HG2 THR 42 3HG2 THR 42 -7.005 2.525 13.086
313 H GLY 43 H GLY 43 -4.889 2.103 8.453
314 1HA GLY 43 1HA GLY 43 -4.018 3.906 6.815
315 2HA GLY 43 2HA GLY 43 -3.950 4.892 8.272
316 HA PRO 44 HA PRO 44 -0.052 2.938 9.353
317 1HB PRO 44 2HB PRO 44 -0.385 2.468 12.031
318 2HB PRO 44 1HB PRO 44 0.033 4.050 11.363
319 1HG PRO 44 2HG PRO 44 -2.626 3.007 12.248
320 2HG PRO 44 1HG PRO 44 -1.917 4.617 12.474
321 1HD PRO 44 2HD PRO 44 -3.780 4.102 10.578
322 2HD PRO 44 1HD PRO 44 -2.497 5.308 10.352
323 H ILE 45 H ILE 45 -3.094 1.561 10.260
324 HA ILE 45 HA ILE 45 -2.046 -1.143 9.812
325 HB ILE 45 HB ILE 45 -4.312 -1.201 11.605
326 1HG1 ILE 45 2HG1 ILE 45 -2.057 -0.265 13.213
327 1HG2 ILE 45 1HG2 ILE 45 -2.454 -2.906 11.015
328 2HG2 ILE 45 2HG2 ILE 45 -1.548 -2.099 12.293
329 3HG2 ILE 45 3HG2 ILE 45 -3.096 -2.859 12.657
330 1HD1 ILE 45 1HD1 ILE 45 -3.660 0.288 14.630
331 2HD1 ILE 45 2HD1 ILE 45 -4.489 1.269 13.419
332 3HD1 ILE 45 3HD1 ILE 45 -4.797 -0.464 13.510
Start of MODEL 5
1 1H GLY 1 1H GLY 1 3.865 11.822 -18.972
2 2H GLY 1 2H GLY 1 3.754 12.147 -20.634
3 3H GLY 1 3H GLY 1 3.809 13.425 -19.521
4 1HA GLY 1 2HA GLY 1 5.984 11.557 -20.253
5 2HA GLY 1 1HA GLY 1 5.943 13.299 -20.479
6 H SER 2 H SER 2 7.470 14.126 -19.225
7 HA SER 2 HA SER 2 8.773 14.596 -17.435
8 1HB SER 2 2HB SER 2 6.615 13.956 -15.502
9 2HB SER 2 1HB SER 2 7.600 15.410 -15.660
10 HG SER 2 HG SER 2 6.265 16.184 -17.186
11 H MET 3 H MET 3 9.134 11.983 -18.302
12 HA MET 3 HA MET 3 9.435 10.476 -15.799
13 1HB MET 3 2HB MET 3 8.272 9.363 -17.714
14 2HB MET 3 1HB MET 3 9.767 9.475 -18.634
15 1HG MET 3 2HG MET 3 10.398 8.270 -16.159
16 2HG MET 3 1HG MET 3 8.946 7.481 -16.776
17 1HE MET 3 1HE MET 3 12.260 6.682 -16.344
18 2HE MET 3 2HE MET 3 11.039 5.421 -16.523
19 3HE MET 3 3HE MET 3 12.434 5.457 -17.601
20 H SER 4 H SER 4 11.330 10.395 -18.790
21 HA SER 4 HA SER 4 13.558 10.291 -19.161
22 1HB SER 4 2HB SER 4 13.991 12.223 -16.901
23 2HB SER 4 1HB SER 4 14.804 12.138 -18.463
24 HG SER 4 HG SER 4 12.291 12.541 -19.032
25 H THR 5 H THR 5 14.482 11.119 -15.931
26 HA THR 5 HA THR 5 15.252 8.312 -15.474
27 HB THR 5 HB THR 5 16.593 10.342 -13.830
28 HG1 THR 5 1HG THR 5 17.111 10.263 -16.648
29 1HG2 THR 5 1HG2 THR 5 18.553 9.043 -14.398
30 2HG2 THR 5 2HG2 THR 5 17.672 8.207 -15.677
31 3HG2 THR 5 3HG2 THR 5 17.236 7.944 -13.988
32 H LYS 6 H LYS 6 12.945 10.412 -14.608
33 HA LYS 6 HA LYS 6 12.938 9.717 -11.757
34 1HB LYS 6 2HB LYS 6 12.344 12.095 -13.094
35 2HB LYS 6 1HB LYS 6 10.777 11.453 -12.625
36 1HG LYS 6 2HG LYS 6 11.960 11.134 -10.304
37 2HG LYS 6 1HG LYS 6 13.026 12.395 -10.930
38 1HD LYS 6 2HD LYS 6 10.621 13.444 -11.550
39 2HD LYS 6 1HD LYS 6 10.200 12.537 -10.094
40 1HE LYS 6 2HE LYS 6 11.159 14.068 -8.804
41 2HE LYS 6 1HE LYS 6 12.673 13.933 -9.696
42 1HZ LYS 6 1HZ LYS 6 12.004 15.599 -11.193
43 2HZ LYS 6 2HZ LYS 6 11.586 16.188 -9.660
44 3HZ LYS 6 3HZ LYS 6 10.390 15.545 -10.675
45 H ASN 7 H ASN 7 12.427 7.482 -12.580
46 HA ASN 7 HA ASN 7 9.675 7.122 -13.444
47 1HB ASN 7 2HB ASN 7 10.472 5.269 -14.410
48 2HB ASN 7 1HB ASN 7 12.070 5.667 -13.799
49 1HD2 ASN 7 1HD2 ASN 7 12.930 4.496 -12.168
50 2HD2 ASN 7 2HD2 ASN 7 12.157 3.130 -11.433
51 H PHE 8 H PHE 8 8.132 5.985 -12.280
52 HA PHE 8 HA PHE 8 6.935 5.324 -10.483
53 1HB PHE 8 2HB PHE 8 8.864 3.638 -10.501
54 2HB PHE 8 1HB PHE 8 9.522 4.564 -9.161
55 HD1 PHE 8 1HD PHE 8 6.152 3.266 -10.112
56 HD2 PHE 8 2HD PHE 8 9.163 3.585 -7.120
57 HE1 PHE 8 1HE PHE 8 4.736 1.985 -8.560
58 HE2 PHE 8 2HE PHE 8 7.750 2.305 -5.562
59 HZ PHE 8 HZ PHE 8 5.536 1.504 -6.279
60 H ARG 9 H ARG 9 6.491 7.625 -10.115
61 HA ARG 9 HA ARG 9 7.856 8.743 -7.791
62 1HB ARG 9 2HB ARG 9 6.511 10.775 -8.217
63 2HB ARG 9 1HB ARG 9 7.481 10.305 -9.603
64 1HG ARG 9 2HG ARG 9 5.666 10.403 -10.856
65 2HG ARG 9 1HG ARG 9 4.977 9.068 -9.928
66 1HD ARG 9 2HD ARG 9 4.815 11.682 -8.606
67 2HD ARG 9 1HD ARG 9 3.902 11.571 -10.111
68 HE ARG 9 HE ARG 9 3.074 9.370 -8.931
69 1HH1 ARG 9 2HH1 ARG 9 3.503 12.580 -7.560
70 2HH1 ARG 9 1HH1 ARG 9 2.298 12.343 -6.325
71 1HH2 ARG 9 2HH2 ARG 9 1.499 9.068 -7.316
72 2HH2 ARG 9 1HH2 ARG 9 1.176 10.344 -6.181
73 H VAL 10 H VAL 10 7.052 8.643 -5.802
74 HA VAL 10 HA VAL 10 4.215 7.940 -5.453
75 HB VAL 10 HB VAL 10 6.545 6.699 -3.969
76 1HG1 VAL 10 1HG1 VAL 10 3.893 7.158 -3.080
77 2HG1 VAL 10 2HG1 VAL 10 4.066 5.430 -3.387
78 3HG1 VAL 10 3HG1 VAL 10 5.175 6.245 -2.283
79 1HG2 VAL 10 1HG2 VAL 10 6.480 5.230 -5.648
80 2HG2 VAL 10 2HG2 VAL 10 4.952 4.684 -4.961
81 3HG2 VAL 10 3HG2 VAL 10 4.957 5.875 -6.262
82 H SER 11 H SER 11 3.201 9.241 -4.060
83 HA SER 11 HA SER 11 4.627 11.349 -2.750
84 1HB SER 11 2HB SER 11 1.951 11.166 -1.797
85 2HB SER 11 1HB SER 11 2.611 12.306 -2.972
86 HG SER 11 HG SER 11 1.344 9.804 -3.416
87 H ASP 12 H ASP 12 5.033 11.598 -0.550
88 HA ASP 12 HA ASP 12 4.950 9.212 1.047
89 1HB ASP 12 2HB ASP 12 6.732 10.991 1.240
90 2HB ASP 12 1HB ASP 12 5.536 11.996 2.051
91 H GLY 13 H GLY 13 3.781 8.930 2.977
92 1HA GLY 13 1HA GLY 13 1.894 9.248 4.346
93 2HA GLY 13 2HA GLY 13 1.405 10.597 3.326
94 H ASP 14 H ASP 14 2.096 8.597 1.058
95 HA ASP 14 HA ASP 14 -0.545 7.639 0.568
96 1HB ASP 14 2HB ASP 14 2.094 7.452 -0.801
97 2HB ASP 14 1HB ASP 14 0.919 6.199 -1.174
98 H TRP 15 H TRP 15 -1.005 5.322 0.194
99 HA TRP 15 HA TRP 15 0.481 3.591 2.040
100 1HB TRP 15 2HB TRP 15 -1.652 2.521 2.683
101 2HB TRP 15 1HB TRP 15 -1.639 4.230 3.105
102 HD1 TRP 15 HD TRP 15 -3.017 5.866 1.293
103 HE1 TRP 15 1HE TRP 15 -5.218 5.388 0.053
104 HE3 TRP 15 3HE TRP 15 -3.066 0.782 1.713
105 HZ2 TRP 15 2HZ TRP 15 -6.798 3.125 -0.622
106 HZ3 TRP 15 3HZ TRP 15 -4.943 -0.465 0.751
107 HH2 TRP 15 HH TRP 15 -6.768 0.666 -0.404
108 H ILE 16 H ILE 16 1.047 1.645 1.203
109 HA ILE 16 HA ILE 16 0.624 1.218 -1.578
110 HB ILE 16 HB ILE 16 1.695 -1.029 -1.152
111 1HG1 ILE 16 2HG1 ILE 16 2.867 -0.372 1.378
112 1HG2 ILE 16 1HG2 ILE 16 3.851 0.341 -0.196
113 2HG2 ILE 16 2HG2 ILE 16 3.319 0.331 -1.878
114 3HG2 ILE 16 3HG2 ILE 16 2.828 1.645 -0.807
115 1HD1 ILE 16 1HD1 ILE 16 1.188 -2.635 0.368
116 2HD1 ILE 16 2HD1 ILE 16 2.912 -2.613 0.748
117 3HD1 ILE 16 3HD1 ILE 16 1.722 -2.544 2.047
118 H CYS 17 H CYS 17 -0.432 -0.542 1.289
119 HA CYS 17 HA CYS 17 -3.044 -1.050 0.260
120 1HB CYS 17 2HB CYS 17 -0.909 -3.146 0.179
121 2HB CYS 17 1HB CYS 17 -2.536 -3.641 0.623
122 HA PRO 18 HA PRO 18 -3.911 -1.282 4.561
123 1HB PRO 18 2HB PRO 18 -5.354 -3.848 4.359
124 2HB PRO 18 1HB PRO 18 -5.959 -2.257 4.827
125 1HG PRO 18 2HG PRO 18 -6.611 -3.355 2.477
126 2HG PRO 18 1HG PRO 18 -6.337 -1.608 2.641
127 1HD PRO 18 2HD PRO 18 -4.506 -3.720 1.560
128 2HD PRO 18 1HD PRO 18 -4.829 -2.090 0.939
129 H ASP 19 H ASP 19 -2.945 -4.364 3.179
130 HA ASP 19 HA ASP 19 -0.969 -4.759 5.247
131 1HB ASP 19 2HB ASP 19 -3.080 -5.754 6.111
132 2HB ASP 19 1HB ASP 19 -3.132 -6.793 4.702
133 H LYS 20 H LYS 20 0.433 -6.627 4.656
134 HA LYS 20 HA LYS 20 0.892 -6.631 1.824
135 1HB LYS 20 2HB LYS 20 2.766 -8.216 2.442
136 2HB LYS 20 1HB LYS 20 2.841 -6.610 3.153
137 1HG LYS 20 2HG LYS 20 2.557 -7.375 5.249
138 2HG LYS 20 1HG LYS 20 1.472 -8.674 4.749
139 1HD LYS 20 2HD LYS 20 4.082 -9.141 3.675
140 2HD LYS 20 1HD LYS 20 4.206 -8.848 5.411
141 1HE LYS 20 2HE LYS 20 2.024 -10.636 4.544
142 2HE LYS 20 1HE LYS 20 3.661 -11.257 4.336
143 1HZ LYS 20 1HZ LYS 20 4.023 -10.613 6.726
144 2HZ LYS 20 2HZ LYS 20 2.979 -11.920 6.464
145 3HZ LYS 20 3HZ LYS 20 2.347 -10.392 6.845
146 H LYS 21 H LYS 21 -1.617 -7.836 2.742
147 HA LYS 21 HA LYS 21 -1.366 -10.644 2.131
148 1HB LYS 21 2HB LYS 21 -4.013 -10.139 1.761
149 2HB LYS 21 1HB LYS 21 -3.296 -10.550 3.308
150 1HG LYS 21 2HG LYS 21 -3.191 -8.228 3.931
151 2HG LYS 21 1HG LYS 21 -3.764 -7.741 2.334
152 1HD LYS 21 2HD LYS 21 -5.883 -8.001 2.965
153 2HD LYS 21 1HD LYS 21 -5.565 -9.664 3.465
154 1HE LYS 21 2HE LYS 21 -5.048 -7.210 5.142
155 2HE LYS 21 1HE LYS 21 -6.449 -8.265 5.296
156 1HZ LYS 21 1HZ LYS 21 -5.044 -9.060 6.913
157 2HZ LYS 21 2HZ LYS 21 -3.641 -8.803 5.998
158 3HZ LYS 21 3HZ LYS 21 -4.672 -10.093 5.623
159 H CYS 22 H CYS 22 -2.403 -7.675 0.506
160 HA CYS 22 HA CYS 22 -2.265 -9.092 -2.037
161 1HB CYS 22 2HB CYS 22 -2.720 -6.468 -2.639
162 2HB CYS 22 1HB CYS 22 -3.949 -7.678 -2.474
163 H GLY 23 H GLY 23 -1.507 -5.785 -1.622
164 1HA GLY 23 1HA GLY 23 0.771 -4.942 -1.188
165 2HA GLY 23 2HA GLY 23 1.375 -6.329 -2.080
166 H ASN 24 H ASN 24 -0.858 -3.601 -2.558
167 HA ASN 24 HA ASN 24 0.166 -3.322 -5.313
168 1HB ASN 24 2HB ASN 24 -2.281 -3.691 -4.991
169 2HB ASN 24 1HB ASN 24 -2.359 -2.213 -4.050
170 1HD2 ASN 24 1HD2 ASN 24 -3.158 -0.588 -5.115
171 2HD2 ASN 24 2HD2 ASN 24 -3.001 -0.288 -6.811
172 H VAL 25 H VAL 25 -0.255 -0.740 -5.892
173 HA VAL 25 HA VAL 25 0.998 0.819 -3.731
174 HB VAL 25 HB VAL 25 1.736 2.301 -5.805
175 1HG1 VAL 25 1HG1 VAL 25 3.082 -0.158 -4.722
176 2HG1 VAL 25 2HG1 VAL 25 3.888 0.942 -5.840
177 3HG1 VAL 25 3HG1 VAL 25 3.339 1.525 -4.266
178 1HG2 VAL 25 1HG2 VAL 25 2.522 0.752 -7.644
179 2HG2 VAL 25 2HG2 VAL 25 1.440 -0.463 -6.965
180 3HG2 VAL 25 3HG2 VAL 25 0.784 1.050 -7.586
181 H ASN 26 H ASN 26 -0.890 1.619 -2.905
182 HA ASN 26 HA ASN 26 -2.851 2.768 -4.735
183 1HB ASN 26 2HB ASN 26 -2.940 1.878 -1.869
184 2HB ASN 26 1HB ASN 26 -4.186 2.940 -2.514
185 1HD2 ASN 26 1HD2 ASN 26 -3.348 -0.222 -1.997
186 2HD2 ASN 26 2HD2 ASN 26 -4.449 -0.965 -3.107
187 H PHE 27 H PHE 27 -3.989 4.770 -3.923
188 HA PHE 27 HA PHE 27 -1.977 6.754 -3.179
189 1HB PHE 27 2HB PHE 27 -3.529 6.784 -5.344
190 2HB PHE 27 1HB PHE 27 -4.671 7.504 -4.217
191 HD1 PHE 27 1HD PHE 27 -4.672 9.760 -3.951
192 HD2 PHE 27 2HD PHE 27 -1.134 7.865 -5.329
193 HE1 PHE 27 1HE PHE 27 -3.629 11.965 -4.276
194 HE2 PHE 27 2HE PHE 27 -0.078 10.060 -5.657
195 HZ PHE 27 HZ PHE 27 -1.329 12.118 -5.130
196 H ALA 28 H ALA 28 -2.349 8.150 -1.512
197 HA ALA 28 HA ALA 28 -3.629 7.326 0.758
198 1HB ALA 28 1HB ALA 28 -3.134 9.406 1.712
199 2HB ALA 28 2HB ALA 28 -1.893 9.157 0.483
200 3HB ALA 28 3HB ALA 28 -3.248 10.240 0.162
201 H ARG 29 H ARG 29 -5.050 9.275 -1.838
202 HA ARG 29 HA ARG 29 -7.391 9.893 -0.283
203 1HB ARG 29 2HB ARG 29 -8.199 10.979 -2.281
204 2HB ARG 29 1HB ARG 29 -6.505 11.398 -2.050
205 1HG ARG 29 2HG ARG 29 -5.942 10.548 -4.014
206 2HG ARG 29 1HG ARG 29 -6.782 9.034 -3.678
207 1HD ARG 29 2HD ARG 29 -8.034 11.572 -4.694
208 2HD ARG 29 1HD ARG 29 -7.664 10.144 -5.656
209 HE ARG 29 HE ARG 29 -9.292 8.952 -4.152
210 1HH1 ARG 29 2HH1 ARG 29 -9.502 12.404 -4.681
211 2HH1 ARG 29 1HH1 ARG 29 -11.215 12.473 -4.393
212 1HH2 ARG 29 2HH2 ARG 29 -11.545 9.038 -3.775
213 2HH2 ARG 29 1HH2 ARG 29 -12.381 10.559 -3.897
214 H ARG 30 H ARG 30 -6.323 7.132 -1.730
215 HA ARG 30 HA ARG 30 -8.841 6.183 -2.776
216 1HB ARG 30 2HB ARG 30 -6.116 4.982 -2.387
217 2HB ARG 30 1HB ARG 30 -7.495 3.936 -2.689
218 1HG ARG 30 2HG ARG 30 -7.871 5.588 -4.702
219 2HG ARG 30 1HG ARG 30 -6.146 5.884 -4.481
220 1HD ARG 30 2HD ARG 30 -6.138 3.208 -4.405
221 2HD ARG 30 1HD ARG 30 -7.562 3.454 -5.414
222 HE ARG 30 HE ARG 30 -4.798 4.087 -6.092
223 1HH1 ARG 30 2HH1 ARG 30 -8.184 4.185 -6.985
224 2HH1 ARG 30 1HH1 ARG 30 -7.864 4.657 -8.627
225 1HH2 ARG 30 2HH2 ARG 30 -4.378 4.681 -8.249
226 2HH2 ARG 30 1HH2 ARG 30 -5.702 4.916 -9.353
227 H THR 31 H THR 31 -10.369 5.186 -1.656
228 HA THR 31 HA THR 31 -9.962 4.771 1.183
229 HB THR 31 HB THR 31 -12.550 3.943 0.529
230 HG1 THR 31 1HG THR 31 -13.288 5.558 -0.898
231 1HG2 THR 31 1HG2 THR 31 -13.226 6.091 1.522
232 2HG2 THR 31 2HG2 THR 31 -11.571 6.678 1.363
233 3HG2 THR 31 3HG2 THR 31 -11.927 5.332 2.446
234 H SER 32 H SER 32 -9.744 2.988 -1.647
235 HA SER 32 HA SER 32 -9.654 0.501 -0.146
236 1HB SER 32 2HB SER 32 -10.952 -0.183 -2.551
237 2HB SER 32 1HB SER 32 -11.635 -0.222 -0.927
238 HG SER 32 HG SER 32 -12.964 1.177 -1.805
239 H CYS 33 H CYS 33 -8.533 -1.172 -1.226
240 HA CYS 33 HA CYS 33 -6.314 -0.590 -2.776
241 1HB CYS 33 2HB CYS 33 -7.985 -3.055 -2.456
242 2HB CYS 33 1HB CYS 33 -6.515 -3.069 -3.406
243 H ASP 34 H ASP 34 -5.984 -0.365 -4.935
244 HA ASP 34 HA ASP 34 -8.289 0.005 -6.629
245 1HB ASP 34 2HB ASP 34 -6.553 1.633 -6.823
246 2HB ASP 34 1HB ASP 34 -5.330 0.390 -7.074
247 H ARG 35 H ARG 35 -5.586 -2.251 -6.436
248 HA ARG 35 HA ARG 35 -6.454 -3.562 -8.903
249 1HB ARG 35 2HB ARG 35 -4.188 -3.373 -9.106
250 2HB ARG 35 1HB ARG 35 -3.926 -3.387 -7.371
251 1HG ARG 35 2HG ARG 35 -3.230 -5.475 -7.515
252 2HG ARG 35 1HG ARG 35 -4.829 -5.958 -8.071
253 1HD ARG 35 2HD ARG 35 -2.343 -5.822 -9.519
254 2HD ARG 35 1HD ARG 35 -3.870 -6.564 -9.988
255 HE ARG 35 HE ARG 35 -2.982 -3.839 -10.610
256 1HH1 ARG 35 2HH1 ARG 35 -5.377 -6.383 -10.936
257 2HH1 ARG 35 1HH1 ARG 35 -6.171 -5.622 -12.282
258 1HH2 ARG 35 2HH2 ARG 35 -4.055 -2.822 -12.354
259 2HH2 ARG 35 1HH2 ARG 35 -5.459 -3.583 -13.060
260 H CYS 36 H CYS 36 -5.865 -4.226 -5.500
261 HA CYS 36 HA CYS 36 -6.592 -6.987 -5.664
262 1HB CYS 36 2HB CYS 36 -6.560 -5.901 -3.015
263 2HB CYS 36 1HB CYS 36 -5.403 -6.992 -3.782
264 H GLY 37 H GLY 37 -8.005 -4.228 -3.875
265 1HA GLY 37 1HA GLY 37 -10.346 -3.684 -4.270
266 2HA GLY 37 2HA GLY 37 -10.658 -5.399 -4.448
267 H ARG 38 H ARG 38 -8.598 -4.532 -1.803
268 HA ARG 38 HA ARG 38 -10.790 -5.016 0.071
269 1HB ARG 38 2HB ARG 38 -7.930 -5.395 0.121
270 2HB ARG 38 1HB ARG 38 -8.428 -4.415 1.491
271 1HG ARG 38 2HG ARG 38 -9.153 -7.229 0.815
272 2HG ARG 38 1HG ARG 38 -8.528 -6.566 2.325
273 1HD ARG 38 2HD ARG 38 -10.619 -6.520 3.084
274 2HD ARG 38 1HD ARG 38 -10.962 -5.262 1.898
275 HE ARG 38 HE ARG 38 -11.179 -8.066 1.076
276 1HH1 ARG 38 2HH1 ARG 38 -12.794 -5.076 1.972
277 2HH1 ARG 38 1HH1 ARG 38 -14.285 -5.503 1.167
278 1HH2 ARG 38 2HH2 ARG 38 -13.138 -8.627 0.050
279 2HH2 ARG 38 1HH2 ARG 38 -14.483 -7.526 0.091
280 H GLU 39 H GLU 39 -10.882 -3.477 2.039
281 HA GLU 39 HA GLU 39 -10.706 -0.747 1.003
282 1HB GLU 39 2HB GLU 39 -12.240 -0.098 2.700
283 2HB GLU 39 1HB GLU 39 -12.845 -1.597 2.014
284 1HG GLU 39 2HG GLU 39 -11.102 -1.914 4.350
285 2HG GLU 39 1HG GLU 39 -12.633 -1.090 4.655
286 H LYS 40 H LYS 40 -9.738 0.946 2.192
287 HA LYS 40 HA LYS 40 -7.355 0.169 3.598
288 1HB LYS 40 2HB LYS 40 -7.537 2.164 2.057
289 2HB LYS 40 1HB LYS 40 -8.494 2.954 3.304
290 1HG LYS 40 2HG LYS 40 -6.333 2.243 4.744
291 2HG LYS 40 1HG LYS 40 -5.594 2.474 3.157
292 1HD LYS 40 2HD LYS 40 -5.607 4.671 3.506
293 2HD LYS 40 1HD LYS 40 -7.370 4.630 3.554
294 1HE LYS 40 2HE LYS 40 -5.801 3.888 5.982
295 2HE LYS 40 1HE LYS 40 -6.021 5.588 5.573
296 1HZ LYS 40 1HZ LYS 40 -8.334 3.758 5.707
297 2HZ LYS 40 2HZ LYS 40 -8.304 5.446 5.860
298 3HZ LYS 40 3HZ LYS 40 -7.717 4.467 7.115
299 H THR 41 H THR 41 -8.730 -1.017 5.223
300 HA THR 41 HA THR 41 -10.161 0.486 7.176
301 HB THR 41 HB THR 41 -10.717 -1.847 6.777
302 HG1 THR 41 1HG THR 41 -10.840 -0.843 8.977
303 1HG2 THR 41 1HG2 THR 41 -8.416 -2.620 6.230
304 2HG2 THR 41 2HG2 THR 41 -9.269 -3.679 7.355
305 3HG2 THR 41 3HG2 THR 41 -8.036 -2.569 7.954
306 H THR 42 H THR 42 -6.842 -0.550 6.807
307 HA THR 42 HA THR 42 -6.046 -0.110 9.497
308 HB THR 42 HB THR 42 -3.910 0.232 7.562
309 HG1 THR 42 1HG THR 42 -4.355 -2.206 7.023
310 1HG2 THR 42 1HG2 THR 42 -3.048 -1.789 8.748
311 2HG2 THR 42 2HG2 THR 42 -4.566 -1.857 9.643
312 3HG2 THR 42 3HG2 THR 42 -3.492 -0.471 9.833
313 H GLY 43 H GLY 43 -6.302 1.840 10.374
314 1HA GLY 43 1HA GLY 43 -4.946 4.096 9.057
315 2HA GLY 43 2HA GLY 43 -6.575 4.307 9.694
316 HA PRO 44 HA PRO 44 -3.586 5.233 13.141
317 1HB PRO 44 2HB PRO 44 -4.987 7.768 13.405
318 2HB PRO 44 1HB PRO 44 -3.275 7.475 13.084
319 1HG PRO 44 2HG PRO 44 -4.961 8.531 11.237
320 2HG PRO 44 1HG PRO 44 -3.560 7.536 10.804
321 1HD PRO 44 2HD PRO 44 -6.449 6.756 10.987
322 2HD PRO 44 1HD PRO 44 -5.245 6.328 9.751
323 H ILE 45 H ILE 45 -5.481 3.492 13.582
324 HA ILE 45 HA ILE 45 -7.238 4.625 15.658
325 HB ILE 45 HB ILE 45 -7.587 1.905 14.403
326 1HG1 ILE 45 2HG1 ILE 45 -9.369 4.080 13.492
327 1HG2 ILE 45 1HG2 ILE 45 -9.254 3.712 16.107
328 2HG2 ILE 45 2HG2 ILE 45 -10.015 2.493 15.085
329 3HG2 ILE 45 3HG2 ILE 45 -8.864 2.008 16.330
330 1HD1 ILE 45 1HD1 ILE 45 -9.816 2.151 12.357
331 2HD1 ILE 45 2HD1 ILE 45 -8.682 2.930 11.254
332 3HD1 ILE 45 3HD1 ILE 45 -8.126 1.645 12.327
Start of MODEL 6
1 1H GLY 1 1H GLY 1 13.863 -9.497 15.843
2 2H GLY 1 2H GLY 1 13.946 -10.702 14.654
3 3H GLY 1 3H GLY 1 12.457 -9.990 15.035
4 1HA GLY 1 2HA GLY 1 13.539 -7.800 14.334
5 2HA GLY 1 1HA GLY 1 14.731 -8.832 13.556
6 H SER 2 H SER 2 13.471 -7.256 11.879
7 HA SER 2 HA SER 2 10.954 -8.260 10.959
8 1HB SER 2 2HB SER 2 12.633 -6.622 9.138
9 2HB SER 2 1HB SER 2 10.938 -6.434 9.585
10 HG SER 2 HG SER 2 11.678 -4.866 10.788
11 H MET 3 H MET 3 11.322 -10.462 10.584
12 HA MET 3 HA MET 3 13.017 -11.071 8.249
13 1HB MET 3 2HB MET 3 12.949 -12.246 10.822
14 2HB MET 3 1HB MET 3 12.255 -13.422 9.716
15 1HG MET 3 2HG MET 3 14.336 -14.033 9.270
16 2HG MET 3 1HG MET 3 14.477 -12.525 8.368
17 1HE MET 3 1HE MET 3 16.897 -11.101 8.986
18 2HE MET 3 2HE MET 3 15.266 -10.453 9.142
19 3HE MET 3 3HE MET 3 16.448 -10.182 10.422
20 H SER 4 H SER 4 10.055 -10.277 8.747
21 HA SER 4 HA SER 4 8.660 -12.510 7.537
22 1HB SER 4 2HB SER 4 6.941 -10.309 7.615
23 2HB SER 4 1HB SER 4 7.044 -11.599 8.816
24 HG SER 4 HG SER 4 7.328 -9.301 9.531
25 H THR 5 H THR 5 10.763 -10.645 6.218
26 HA THR 5 HA THR 5 11.216 -9.818 4.159
27 HB THR 5 HB THR 5 8.513 -10.624 3.131
28 HG1 THR 5 1HG THR 5 9.236 -12.435 4.264
29 1HG2 THR 5 1HG2 THR 5 11.282 -10.355 1.994
30 2HG2 THR 5 2HG2 THR 5 9.793 -9.560 1.483
31 3HG2 THR 5 3HG2 THR 5 10.027 -11.279 1.166
32 H LYS 6 H LYS 6 11.314 -7.681 4.379
33 HA LYS 6 HA LYS 6 9.292 -5.959 5.193
34 1HB LYS 6 2HB LYS 6 11.931 -5.689 3.923
35 2HB LYS 6 1HB LYS 6 10.841 -4.345 3.621
36 1HG LYS 6 2HG LYS 6 11.530 -3.517 5.560
37 2HG LYS 6 1HG LYS 6 10.578 -4.785 6.333
38 1HD LYS 6 2HD LYS 6 12.601 -5.199 7.302
39 2HD LYS 6 1HD LYS 6 12.768 -6.202 5.860
40 1HE LYS 6 2HE LYS 6 13.761 -4.019 4.816
41 2HE LYS 6 1HE LYS 6 14.022 -3.568 6.500
42 1HZ LYS 6 1HZ LYS 6 15.910 -4.715 6.320
43 2HZ LYS 6 2HZ LYS 6 15.434 -5.467 4.877
44 3HZ LYS 6 3HZ LYS 6 14.959 -6.117 6.368
45 H ASN 7 H ASN 7 7.407 -5.579 4.272
46 HA ASN 7 HA ASN 7 6.785 -6.089 1.560
47 1HB ASN 7 2HB ASN 7 5.221 -5.942 3.623
48 2HB ASN 7 1HB ASN 7 5.216 -4.209 3.314
49 1HD2 ASN 7 1HD2 ASN 7 2.852 -5.000 3.186
50 2HD2 ASN 7 2HD2 ASN 7 2.280 -5.345 1.592
51 H PHE 8 H PHE 8 5.943 -4.403 0.035
52 HA PHE 8 HA PHE 8 7.890 -2.426 -0.455
53 1HB PHE 8 2HB PHE 8 6.212 -3.632 -2.072
54 2HB PHE 8 1HB PHE 8 5.162 -2.274 -1.674
55 HD1 PHE 8 1HD PHE 8 8.342 -3.255 -3.205
56 HD2 PHE 8 2HD PHE 8 5.602 -0.085 -2.502
57 HE1 PHE 8 1HE PHE 8 9.523 -1.872 -4.870
58 HE2 PHE 8 2HE PHE 8 6.770 1.306 -4.163
59 HZ PHE 8 HZ PHE 8 8.732 0.411 -5.351
60 H ARG 9 H ARG 9 8.057 -1.062 1.273
61 HA ARG 9 HA ARG 9 5.725 0.471 2.092
62 1HB ARG 9 2HB ARG 9 6.756 0.518 4.072
63 2HB ARG 9 1HB ARG 9 8.090 -0.391 3.382
64 1HG ARG 9 2HG ARG 9 8.572 2.217 2.583
65 2HG ARG 9 1HG ARG 9 7.970 2.369 4.235
66 1HD ARG 9 2HD ARG 9 9.882 1.595 5.075
67 2HD ARG 9 1HD ARG 9 9.830 0.179 4.027
68 HE ARG 9 HE ARG 9 10.968 1.493 2.327
69 1HH1 ARG 9 2HH1 ARG 9 10.955 2.807 5.580
70 2HH1 ARG 9 1HH1 ARG 9 12.360 3.796 5.325
71 1HH2 ARG 9 2HH2 ARG 9 12.820 2.771 1.993
72 2HH2 ARG 9 1HH2 ARG 9 13.443 3.747 3.288
73 H VAL 10 H VAL 10 5.333 2.506 1.508
74 HA VAL 10 HA VAL 10 7.298 3.832 -0.227
75 HB VAL 10 HB VAL 10 4.982 5.184 -0.685
76 1HG1 VAL 10 1HG1 VAL 10 6.516 4.396 -2.385
77 2HG1 VAL 10 2HG1 VAL 10 5.978 2.734 -2.131
78 3HG1 VAL 10 3HG1 VAL 10 4.864 3.931 -2.796
79 1HG2 VAL 10 1HG2 VAL 10 3.615 3.687 0.641
80 2HG2 VAL 10 2HG2 VAL 10 3.209 3.513 -1.068
81 3HG2 VAL 10 3HG2 VAL 10 4.211 2.298 -0.272
82 H SER 11 H SER 11 7.037 6.283 -0.186
83 HA SER 11 HA SER 11 7.402 7.300 2.408
84 1HB SER 11 2HB SER 11 6.530 9.358 0.595
85 2HB SER 11 1HB SER 11 8.154 9.048 1.219
86 HG SER 11 HG SER 11 8.392 7.480 -0.467
87 H ASP 12 H ASP 12 6.005 8.465 3.765
88 HA ASP 12 HA ASP 12 3.378 7.486 3.785
89 1HB ASP 12 2HB ASP 12 3.398 8.195 5.892
90 2HB ASP 12 1HB ASP 12 5.013 8.806 5.594
91 H GLY 13 H GLY 13 1.422 8.785 3.874
92 1HA GLY 13 1HA GLY 13 0.044 10.421 2.835
93 2HA GLY 13 2HA GLY 13 1.392 10.864 1.797
94 H ASP 14 H ASP 14 2.215 8.485 0.914
95 HA ASP 14 HA ASP 14 0.028 7.492 -0.751
96 1HB ASP 14 2HB ASP 14 2.933 7.648 -0.988
97 2HB ASP 14 1HB ASP 14 2.342 6.029 -1.340
98 H TRP 15 H TRP 15 -0.810 5.428 -0.511
99 HA TRP 15 HA TRP 15 0.376 3.820 1.642
100 1HB TRP 15 2HB TRP 15 -1.684 3.391 2.670
101 2HB TRP 15 1HB TRP 15 -1.736 5.112 2.320
102 HD1 TRP 15 HD TRP 15 -3.145 5.696 -0.088
103 HE1 TRP 15 1HE TRP 15 -5.386 4.683 -0.845
104 HE3 TRP 15 3HE TRP 15 -3.119 1.440 2.757
105 HZ2 TRP 15 2HZ TRP 15 -6.946 2.391 -0.293
106 HZ3 TRP 15 3HZ TRP 15 -5.015 -0.112 2.584
107 HH2 TRP 15 HH TRP 15 -6.887 0.351 1.078
108 H ILE 16 H ILE 16 0.132 1.595 1.494
109 HA ILE 16 HA ILE 16 -0.351 0.670 -1.229
110 HB ILE 16 HB ILE 16 0.817 -1.445 -0.376
111 1HG1 ILE 16 2HG1 ILE 16 2.024 0.304 1.731
112 1HG2 ILE 16 1HG2 ILE 16 1.858 0.206 -1.844
113 2HG2 ILE 16 2HG2 ILE 16 2.373 1.130 -0.435
114 3HG2 ILE 16 3HG2 ILE 16 3.020 -0.486 -0.714
115 1HD1 ILE 16 1HD1 ILE 16 2.854 -2.035 1.066
116 2HD1 ILE 16 2HD1 ILE 16 2.677 -1.648 2.778
117 3HD1 ILE 16 3HD1 ILE 16 1.451 -2.617 1.963
118 H CYS 17 H CYS 17 -0.485 -1.934 0.865
119 HA CYS 17 HA CYS 17 -3.397 -1.721 1.146
120 1HB CYS 17 2HB CYS 17 -2.449 -3.382 -0.616
121 2HB CYS 17 1HB CYS 17 -1.962 -4.350 0.754
122 HA PRO 18 HA PRO 18 -2.728 -2.150 5.411
123 1HB PRO 18 2HB PRO 18 -4.865 -4.214 5.508
124 2HB PRO 18 1HB PRO 18 -4.717 -2.706 6.417
125 1HG PRO 18 2HG PRO 18 -6.433 -2.920 4.394
126 2HG PRO 18 1HG PRO 18 -5.527 -1.419 4.671
127 1HD PRO 18 2HD PRO 18 -5.075 -3.560 2.640
128 2HD PRO 18 1HD PRO 18 -4.893 -1.802 2.486
129 H ASP 19 H ASP 19 -2.960 -5.078 3.521
130 HA ASP 19 HA ASP 19 -1.364 -6.529 5.527
131 1HB ASP 19 2HB ASP 19 -3.677 -7.410 4.898
132 2HB ASP 19 1HB ASP 19 -2.982 -7.816 3.330
133 H LYS 20 H LYS 20 -0.343 -8.572 4.091
134 HA LYS 20 HA LYS 20 1.567 -7.131 2.391
135 1HB LYS 20 2HB LYS 20 1.957 -9.814 3.724
136 2HB LYS 20 1HB LYS 20 3.190 -8.806 2.980
137 1HG LYS 20 2HG LYS 20 3.482 -7.616 4.836
138 2HG LYS 20 1HG LYS 20 1.746 -7.426 5.089
139 1HD LYS 20 2HD LYS 20 3.176 -10.002 5.699
140 2HD LYS 20 1HD LYS 20 3.068 -8.694 6.876
141 1HE LYS 20 2HE LYS 20 0.638 -9.842 5.530
142 2HE LYS 20 1HE LYS 20 1.308 -10.537 7.007
143 1HZ LYS 20 1HZ LYS 20 -0.557 -8.746 7.124
144 2HZ LYS 20 2HZ LYS 20 0.724 -7.652 6.919
145 3HZ LYS 20 3HZ LYS 20 0.720 -8.712 8.239
146 H LYS 21 H LYS 21 -0.968 -9.332 2.232
147 HA LYS 21 HA LYS 21 -0.178 -11.054 0.169
148 1HB LYS 21 2HB LYS 21 -2.820 -10.027 1.132
149 2HB LYS 21 1HB LYS 21 -2.751 -10.941 -0.370
150 1HG LYS 21 2HG LYS 21 -1.773 -12.826 0.780
151 2HG LYS 21 1HG LYS 21 -1.723 -11.914 2.288
152 1HD LYS 21 2HD LYS 21 -4.342 -12.161 0.920
153 2HD LYS 21 1HD LYS 21 -3.691 -13.606 1.694
154 1HE LYS 21 2HE LYS 21 -4.302 -10.946 2.971
155 2HE LYS 21 1HE LYS 21 -5.074 -12.500 3.288
156 1HZ LYS 21 1HZ LYS 21 -2.550 -11.440 4.273
157 2HZ LYS 21 2HZ LYS 21 -2.542 -13.089 3.859
158 3HZ LYS 21 3HZ LYS 21 -3.647 -12.510 5.009
159 H CYS 22 H CYS 22 -1.521 -7.803 0.094
160 HA CYS 22 HA CYS 22 -1.330 -7.646 -2.795
161 1HB CYS 22 2HB CYS 22 -2.529 -6.107 -0.642
162 2HB CYS 22 1HB CYS 22 -1.661 -5.080 -1.770
163 H GLY 23 H GLY 23 -0.230 -5.377 -0.336
164 1HA GLY 23 1HA GLY 23 1.641 -4.061 -0.211
165 2HA GLY 23 2HA GLY 23 2.505 -5.308 -1.112
166 H ASN 24 H ASN 24 -0.415 -3.846 -2.259
167 HA ASN 24 HA ASN 24 0.919 -3.059 -4.703
168 1HB ASN 24 2HB ASN 24 -1.301 -4.212 -4.685
169 2HB ASN 24 1HB ASN 24 -1.988 -2.773 -3.947
170 1HD2 ASN 24 1HD2 ASN 24 -2.717 -1.268 -5.198
171 2HD2 ASN 24 2HD2 ASN 24 -2.399 -1.143 -6.880
172 H VAL 25 H VAL 25 1.386 -1.049 -5.317
173 HA VAL 25 HA VAL 25 1.183 1.044 -3.366
174 HB VAL 25 HB VAL 25 2.114 2.409 -5.442
175 1HG1 VAL 25 1HG1 VAL 25 4.263 0.697 -4.625
176 2HG1 VAL 25 2HG1 VAL 25 3.933 2.370 -4.170
177 3HG1 VAL 25 3HG1 VAL 25 3.216 1.045 -3.249
178 1HG2 VAL 25 1HG2 VAL 25 2.943 -0.402 -6.141
179 2HG2 VAL 25 2HG2 VAL 25 1.692 0.495 -6.998
180 3HG2 VAL 25 3HG2 VAL 25 3.354 1.083 -6.998
181 H ASN 26 H ASN 26 -0.918 1.511 -3.078
182 HA ASN 26 HA ASN 26 -2.702 2.084 -5.265
183 1HB ASN 26 2HB ASN 26 -3.013 2.338 -2.268
184 2HB ASN 26 1HB ASN 26 -4.297 2.665 -3.426
185 1HD2 ASN 26 1HD2 ASN 26 -4.203 0.667 -1.325
186 2HD2 ASN 26 2HD2 ASN 26 -4.404 -0.868 -2.103
187 H PHE 27 H PHE 27 -4.127 4.192 -4.615
188 HA PHE 27 HA PHE 27 -2.420 6.406 -5.209
189 1HB PHE 27 2HB PHE 27 -4.853 6.030 -5.944
190 2HB PHE 27 1HB PHE 27 -5.302 6.605 -4.344
191 HD1 PHE 27 1HD PHE 27 -6.528 8.488 -5.145
192 HD2 PHE 27 2HD PHE 27 -2.434 7.985 -6.191
193 HE1 PHE 27 1HE PHE 27 -6.447 10.810 -5.944
194 HE2 PHE 27 2HE PHE 27 -2.351 10.312 -6.986
195 HZ PHE 27 HZ PHE 27 -4.361 11.726 -6.860
196 H ALA 28 H ALA 28 -4.501 7.928 -3.294
197 HA ALA 28 HA ALA 28 -2.931 7.690 -0.842
198 1HB ALA 28 1HB ALA 28 -3.109 10.117 -2.583
199 2HB ALA 28 2HB ALA 28 -2.926 10.294 -0.838
200 3HB ALA 28 3HB ALA 28 -1.705 9.426 -1.768
201 H ARG 29 H ARG 29 -5.364 9.858 -2.262
202 HA ARG 29 HA ARG 29 -6.995 9.796 0.103
203 1HB ARG 29 2HB ARG 29 -8.579 11.154 -1.272
204 2HB ARG 29 1HB ARG 29 -6.956 11.826 -1.201
205 1HG ARG 29 2HG ARG 29 -6.904 11.890 -3.410
206 2HG ARG 29 1HG ARG 29 -7.048 10.132 -3.454
207 1HD ARG 29 2HD ARG 29 -8.794 11.411 -4.755
208 2HD ARG 29 1HD ARG 29 -9.408 10.236 -3.593
209 HE ARG 29 HE ARG 29 -10.135 11.988 -2.212
210 1HH1 ARG 29 2HH1 ARG 29 -8.674 13.140 -5.183
211 2HH1 ARG 29 1HH1 ARG 29 -9.274 14.762 -4.998
212 1HH2 ARG 29 2HH2 ARG 29 -10.946 14.097 -1.981
213 2HH2 ARG 29 1HH2 ARG 29 -10.588 15.304 -3.183
214 H ARG 30 H ARG 30 -6.598 7.220 -0.748
215 HA ARG 30 HA ARG 30 -9.104 6.463 -2.091
216 1HB ARG 30 2HB ARG 30 -6.343 5.359 -2.181
217 2HB ARG 30 1HB ARG 30 -7.678 4.225 -2.314
218 1HG ARG 30 2HG ARG 30 -7.970 6.558 -4.026
219 2HG ARG 30 1HG ARG 30 -6.529 5.609 -4.371
220 1HD ARG 30 2HD ARG 30 -8.436 3.671 -4.060
221 2HD ARG 30 1HD ARG 30 -9.349 4.975 -4.817
222 HE ARG 30 HE ARG 30 -7.022 3.577 -5.954
223 1HH1 ARG 30 2HH1 ARG 30 -9.695 5.830 -6.310
224 2HH1 ARG 30 1HH1 ARG 30 -9.545 5.923 -8.040
225 1HH2 ARG 30 2HH2 ARG 30 -6.820 3.701 -8.209
226 2HH2 ARG 30 1HH2 ARG 30 -7.883 4.735 -9.121
227 H THR 31 H THR 31 -10.576 5.600 -0.816
228 HA THR 31 HA THR 31 -9.754 4.354 1.699
229 HB THR 31 HB THR 31 -12.627 4.398 1.117
230 HG1 THR 31 1HG THR 31 -11.227 6.891 1.319
231 1HG2 THR 31 1HG2 THR 31 -12.590 4.409 3.347
232 2HG2 THR 31 2HG2 THR 31 -11.903 6.035 3.315
233 3HG2 THR 31 3HG2 THR 31 -10.839 4.630 3.334
234 H SER 32 H SER 32 -9.481 3.251 -1.095
235 HA SER 32 HA SER 32 -10.193 0.549 -0.384
236 1HB SER 32 2HB SER 32 -11.183 1.737 -2.999
237 2HB SER 32 1HB SER 32 -11.364 0.061 -2.480
238 HG SER 32 HG SER 32 -12.356 1.508 -0.540
239 H CYS 33 H CYS 33 -8.922 -0.981 -1.489
240 HA CYS 33 HA CYS 33 -6.399 -0.168 -2.443
241 1HB CYS 33 2HB CYS 33 -7.270 -2.477 -1.544
242 2HB CYS 33 1HB CYS 33 -7.583 -2.793 -3.244
243 H ASP 34 H ASP 34 -5.470 -0.450 -4.499
244 HA ASP 34 HA ASP 34 -7.255 0.143 -6.726
245 1HB ASP 34 2HB ASP 34 -4.364 0.473 -6.142
246 2HB ASP 34 1HB ASP 34 -4.769 0.114 -7.815
247 H ARG 35 H ARG 35 -5.618 -2.465 -5.273
248 HA ARG 35 HA ARG 35 -5.557 -4.003 -7.779
249 1HB ARG 35 2HB ARG 35 -3.605 -3.713 -5.886
250 2HB ARG 35 1HB ARG 35 -4.353 -5.225 -5.396
251 1HG ARG 35 2HG ARG 35 -3.855 -5.070 -8.261
252 2HG ARG 35 1HG ARG 35 -2.392 -4.945 -7.286
253 1HD ARG 35 2HD ARG 35 -4.376 -7.185 -7.439
254 2HD ARG 35 1HD ARG 35 -2.626 -7.237 -7.649
255 HE ARG 35 HE ARG 35 -3.382 -6.433 -5.007
256 1HH1 ARG 35 2HH1 ARG 35 -2.899 -9.232 -7.083
257 2HH1 ARG 35 1HH1 ARG 35 -2.639 -10.312 -5.745
258 1HH2 ARG 35 2HH2 ARG 35 -3.017 -7.838 -3.284
259 2HH2 ARG 35 1HH2 ARG 35 -2.701 -9.531 -3.592
260 H CYS 36 H CYS 36 -6.108 -4.809 -4.324
261 HA CYS 36 HA CYS 36 -7.772 -7.008 -5.155
262 1HB CYS 36 2HB CYS 36 -7.906 -7.593 -2.807
263 2HB CYS 36 1HB CYS 36 -6.240 -7.241 -3.237
264 H GLY 37 H GLY 37 -8.218 -3.819 -3.774
265 1HA GLY 37 1HA GLY 37 -10.009 -2.453 -4.393
266 2HA GLY 37 2HA GLY 37 -10.881 -3.877 -4.932
267 H ARG 38 H ARG 38 -9.687 -4.449 -1.845
268 HA ARG 38 HA ARG 38 -12.296 -4.205 -0.696
269 1HB ARG 38 2HB ARG 38 -11.057 -4.750 1.469
270 2HB ARG 38 1HB ARG 38 -11.070 -5.974 0.209
271 1HG ARG 38 2HG ARG 38 -8.896 -6.030 0.845
272 2HG ARG 38 1HG ARG 38 -8.807 -4.825 -0.445
273 1HD ARG 38 2HD ARG 38 -9.354 -3.181 1.531
274 2HD ARG 38 1HD ARG 38 -8.661 -4.478 2.496
275 HE ARG 38 HE ARG 38 -6.635 -4.241 1.153
276 1HH1 ARG 38 2HH1 ARG 38 -8.924 -1.613 1.206
277 2HH1 ARG 38 1HH1 ARG 38 -7.792 -0.441 0.614
278 1HH2 ARG 38 2HH2 ARG 38 -5.119 -2.706 0.383
279 2HH2 ARG 38 1HH2 ARG 38 -5.624 -1.059 0.137
280 H GLU 39 H GLU 39 -12.591 -3.027 1.448
281 HA GLU 39 HA GLU 39 -12.122 -0.251 0.907
282 1HB GLU 39 2HB GLU 39 -13.623 0.173 2.660
283 2HB GLU 39 1HB GLU 39 -14.183 -1.353 1.992
284 1HG GLU 39 2HG GLU 39 -12.277 -1.426 4.267
285 2HG GLU 39 1HG GLU 39 -13.955 -0.988 4.578
286 H LYS 40 H LYS 40 -11.482 1.140 2.954
287 HA LYS 40 HA LYS 40 -8.737 0.448 3.509
288 1HB LYS 40 2HB LYS 40 -9.660 2.793 3.058
289 2HB LYS 40 1HB LYS 40 -10.266 2.752 4.709
290 1HG LYS 40 2HG LYS 40 -8.227 3.044 5.605
291 2HG LYS 40 1HG LYS 40 -7.436 2.040 4.388
292 1HD LYS 40 2HD LYS 40 -8.091 4.089 2.834
293 2HD LYS 40 1HD LYS 40 -8.028 4.949 4.371
294 1HE LYS 40 2HE LYS 40 -5.810 3.196 3.338
295 2HE LYS 40 1HE LYS 40 -5.884 4.938 3.076
296 1HZ LYS 40 1HZ LYS 40 -5.989 3.766 5.793
297 2HZ LYS 40 2HZ LYS 40 -5.622 5.359 5.342
298 3HZ LYS 40 3HZ LYS 40 -4.519 4.111 5.027
299 H THR 41 H THR 41 -9.972 -1.537 4.539
300 HA THR 41 HA THR 41 -10.586 -1.119 7.334
301 HB THR 41 HB THR 41 -10.994 -3.264 5.386
302 HG1 THR 41 1HG THR 41 -12.929 -2.905 6.110
303 1HG2 THR 41 1HG2 THR 41 -11.029 -5.110 6.901
304 2HG2 THR 41 2HG2 THR 41 -10.600 -4.071 8.262
305 3HG2 THR 41 3HG2 THR 41 -9.423 -4.384 6.983
306 H THR 42 H THR 42 -9.032 -1.037 8.796
307 HA THR 42 HA THR 42 -6.554 -2.529 8.283
308 HB THR 42 HB THR 42 -6.361 -0.212 10.100
309 HG1 THR 42 1HG THR 42 -7.723 0.215 7.970
310 1HG2 THR 42 1HG2 THR 42 -4.517 -0.161 7.939
311 2HG2 THR 42 2HG2 THR 42 -4.676 -1.837 8.464
312 3HG2 THR 42 3HG2 THR 42 -4.214 -0.589 9.622
313 H GLY 43 H GLY 43 -9.123 -3.062 9.797
314 1HA GLY 43 1HA GLY 43 -8.232 -3.355 12.534
315 2HA GLY 43 2HA GLY 43 -9.756 -3.929 11.861
316 HA PRO 44 HA PRO 44 -6.219 -7.246 11.999
317 1HB PRO 44 2HB PRO 44 -7.062 -7.908 14.742
318 2HB PRO 44 1HB PRO 44 -5.437 -7.708 14.085
319 1HG PRO 44 2HG PRO 44 -6.511 -5.900 15.749
320 2HG PRO 44 1HG PRO 44 -5.435 -5.425 14.419
321 1HD PRO 44 2HD PRO 44 -8.424 -5.290 14.582
322 2HD PRO 44 1HD PRO 44 -7.279 -4.106 13.917
323 H ILE 45 H ILE 45 -7.471 -8.388 10.583
324 HA ILE 45 HA ILE 45 -9.455 -10.197 11.776
325 HB ILE 45 HB ILE 45 -10.686 -10.040 9.521
326 1HG1 ILE 45 2HG1 ILE 45 -10.158 -7.258 9.143
327 1HG2 ILE 45 1HG2 ILE 45 -11.174 -8.933 11.918
328 2HG2 ILE 45 2HG2 ILE 45 -11.088 -7.476 10.923
329 3HG2 ILE 45 3HG2 ILE 45 -12.245 -8.751 10.526
330 1HD1 ILE 45 1HD1 ILE 45 -9.201 -8.307 6.906
331 2HD1 ILE 45 2HD1 ILE 45 -10.089 -9.708 7.499
332 3HD1 ILE 45 3HD1 ILE 45 -10.929 -8.180 7.234
Start of MODEL 7
1 1H GLY 1 1H GLY 1 13.560 15.144 1.043
2 2H GLY 1 2H GLY 1 12.806 14.244 -0.177
3 3H GLY 1 3H GLY 1 12.646 15.934 -0.146
4 1HA GLY 1 2HA GLY 1 15.333 14.780 -0.326
5 2HA GLY 1 1HA GLY 1 14.324 14.799 -1.767
6 H SER 2 H SER 2 16.792 16.349 -0.641
7 HA SER 2 HA SER 2 16.051 19.053 -0.391
8 1HB SER 2 2HB SER 2 18.661 18.927 -1.471
9 2HB SER 2 1HB SER 2 18.206 19.088 0.228
10 HG SER 2 HG SER 2 18.430 16.947 0.523
11 H MET 3 H MET 3 15.197 20.319 -1.871
12 HA MET 3 HA MET 3 14.839 21.465 -3.794
13 1HB MET 3 2HB MET 3 17.208 21.575 -4.189
14 2HB MET 3 1HB MET 3 17.240 19.921 -4.780
15 1HG MET 3 2HG MET 3 15.396 21.569 -6.285
16 2HG MET 3 1HG MET 3 17.034 22.224 -6.293
17 1HE MET 3 1HE MET 3 19.293 20.133 -7.221
18 2HE MET 3 2HE MET 3 18.757 20.517 -8.857
19 3HE MET 3 3HE MET 3 18.653 21.736 -7.586
20 H SER 4 H SER 4 15.628 18.068 -4.535
21 HA SER 4 HA SER 4 13.656 17.969 -6.631
22 1HB SER 4 2HB SER 4 14.613 15.373 -5.788
23 2HB SER 4 1HB SER 4 14.887 16.223 -7.311
24 HG SER 4 HG SER 4 16.668 17.187 -6.463
25 H THR 5 H THR 5 11.816 18.585 -5.250
26 HA THR 5 HA THR 5 10.871 16.651 -3.336
27 HB THR 5 HB THR 5 8.920 18.600 -4.353
28 HG1 THR 5 1HG THR 5 11.115 19.611 -2.851
29 1HG2 THR 5 1HG2 THR 5 10.004 18.263 -1.562
30 2HG2 THR 5 2HG2 THR 5 8.804 17.164 -2.242
31 3HG2 THR 5 3HG2 THR 5 8.429 18.877 -2.056
32 H LYS 6 H LYS 6 11.063 16.448 -6.549
33 HA LYS 6 HA LYS 6 8.496 15.189 -7.022
34 1HB LYS 6 2HB LYS 6 9.801 16.450 -8.797
35 2HB LYS 6 1HB LYS 6 10.949 15.120 -8.786
36 1HG LYS 6 2HG LYS 6 9.358 14.936 -10.626
37 2HG LYS 6 1HG LYS 6 9.217 13.579 -9.508
38 1HD LYS 6 2HD LYS 6 7.274 14.646 -8.465
39 2HD LYS 6 1HD LYS 6 7.426 16.009 -9.577
40 1HE LYS 6 2HE LYS 6 7.274 14.160 -11.412
41 2HE LYS 6 1HE LYS 6 6.553 13.200 -10.121
42 1HZ LYS 6 1HZ LYS 6 4.647 14.195 -10.617
43 2HZ LYS 6 2HZ LYS 6 5.403 15.294 -11.667
44 3HZ LYS 6 3HZ LYS 6 5.292 15.644 -10.014
45 H ASN 7 H ASN 7 8.994 13.811 -5.053
46 HA ASN 7 HA ASN 7 10.938 11.688 -5.603
47 1HB ASN 7 2HB ASN 7 10.256 13.166 -3.265
48 2HB ASN 7 1HB ASN 7 9.876 11.471 -2.969
49 1HD2 ASN 7 1HD2 ASN 7 12.418 13.688 -3.961
50 2HD2 ASN 7 2HD2 ASN 7 13.742 12.680 -3.483
51 H PHE 8 H PHE 8 9.670 9.969 -3.573
52 HA PHE 8 HA PHE 8 7.975 8.553 -5.427
53 1HB PHE 8 2HB PHE 8 9.219 7.806 -2.780
54 2HB PHE 8 1HB PHE 8 8.122 6.747 -3.659
55 HD1 PHE 8 1HD PHE 8 11.468 8.173 -3.526
56 HD2 PHE 8 2HD PHE 8 8.802 5.713 -5.750
57 HE1 PHE 8 1HE PHE 8 13.365 7.284 -4.812
58 HE2 PHE 8 2HE PHE 8 10.697 4.820 -7.040
59 HZ PHE 8 HZ PHE 8 12.979 5.606 -6.568
60 H ARG 9 H ARG 9 5.888 8.817 -5.381
61 HA ARG 9 HA ARG 9 4.454 9.776 -3.084
62 1HB ARG 9 2HB ARG 9 3.653 8.809 -5.807
63 2HB ARG 9 1HB ARG 9 2.437 8.999 -4.552
64 1HG ARG 9 2HG ARG 9 2.284 11.138 -5.087
65 2HG ARG 9 1HG ARG 9 3.941 11.364 -4.527
66 1HD ARG 9 2HD ARG 9 3.247 12.023 -6.971
67 2HD ARG 9 1HD ARG 9 4.813 11.282 -6.646
68 HE ARG 9 HE ARG 9 4.054 9.273 -7.600
69 1HH1 ARG 9 2HH1 ARG 9 1.627 11.812 -7.697
70 2HH1 ARG 9 1HH1 ARG 9 0.621 10.976 -8.842
71 1HH2 ARG 9 2HH2 ARG 9 2.702 8.170 -9.094
72 2HH2 ARG 9 1HH2 ARG 9 1.216 8.904 -9.614
73 H VAL 10 H VAL 10 5.408 8.093 -1.710
74 HA VAL 10 HA VAL 10 3.559 5.886 -1.376
75 HB VAL 10 HB VAL 10 5.400 5.058 -2.902
76 1HG1 VAL 10 1HG1 VAL 10 7.553 5.277 -2.425
77 2HG1 VAL 10 2HG1 VAL 10 7.079 6.317 -1.083
78 3HG1 VAL 10 3HG1 VAL 10 7.337 4.593 -0.814
79 1HG2 VAL 10 1HG2 VAL 10 3.998 3.673 -1.225
80 2HG2 VAL 10 2HG2 VAL 10 5.402 2.934 -1.995
81 3HG2 VAL 10 3HG2 VAL 10 5.514 3.528 -0.338
82 H SER 11 H SER 11 4.280 8.360 -0.095
83 HA SER 11 HA SER 11 5.706 7.560 2.346
84 1HB SER 11 2HB SER 11 5.607 10.178 2.624
85 2HB SER 11 1HB SER 11 6.776 9.453 1.519
86 HG SER 11 HG SER 11 4.254 10.025 0.460
87 H ASP 12 H ASP 12 4.482 10.078 3.550
88 HA ASP 12 HA ASP 12 1.995 8.960 4.504
89 1HB ASP 12 2HB ASP 12 1.880 11.021 5.885
90 2HB ASP 12 1HB ASP 12 3.382 10.139 6.116
91 H GLY 13 H GLY 13 -0.023 10.201 4.369
92 1HA GLY 13 1HA GLY 13 -1.547 11.458 3.108
93 2HA GLY 13 2HA GLY 13 -0.250 11.913 2.012
94 H ASP 14 H ASP 14 0.786 9.562 1.350
95 HA ASP 14 HA ASP 14 -1.308 8.216 -0.170
96 1HB ASP 14 2HB ASP 14 1.404 7.158 -0.474
97 2HB ASP 14 1HB ASP 14 0.294 7.748 -1.703
98 H TRP 15 H TRP 15 -0.803 5.693 -0.321
99 HA TRP 15 HA TRP 15 0.291 4.524 2.044
100 1HB TRP 15 2HB TRP 15 -1.714 3.451 2.897
101 2HB TRP 15 1HB TRP 15 -1.931 5.195 2.901
102 HD1 TRP 15 HD TRP 15 -3.576 6.192 0.927
103 HE1 TRP 15 1HE TRP 15 -5.661 5.131 -0.141
104 HE3 TRP 15 3HE TRP 15 -2.757 1.310 2.189
105 HZ2 TRP 15 2HZ TRP 15 -6.822 2.561 -0.411
106 HZ3 TRP 15 3HZ TRP 15 -4.379 -0.391 1.492
107 HH2 TRP 15 HH TRP 15 -6.377 0.206 0.183
108 H ILE 16 H ILE 16 0.718 2.359 1.809
109 HA ILE 16 HA ILE 16 0.007 1.145 -0.751
110 HB ILE 16 HB ILE 16 1.615 -0.632 -0.133
111 1HG1 ILE 16 2HG1 ILE 16 3.074 0.764 1.900
112 1HG2 ILE 16 1HG2 ILE 16 3.496 1.469 0.142
113 2HG2 ILE 16 2HG2 ILE 16 3.056 0.565 -1.307
114 3HG2 ILE 16 3HG2 ILE 16 2.180 2.036 -0.886
115 1HD1 ILE 16 1HD1 ILE 16 3.069 -1.712 1.355
116 2HD1 ILE 16 2HD1 ILE 16 3.062 -1.263 3.061
117 3HD1 ILE 16 3HD1 ILE 16 1.571 -1.799 2.283
118 H CYS 17 H CYS 17 -0.779 -1.074 -0.710
119 HA CYS 17 HA CYS 17 -3.115 -1.338 0.654
120 1HB CYS 17 2HB CYS 17 -1.304 -3.239 -0.726
121 2HB CYS 17 1HB CYS 17 -2.663 -3.892 0.178
122 HA PRO 18 HA PRO 18 -2.317 -1.912 4.731
123 1HB PRO 18 2HB PRO 18 -4.569 -3.717 5.135
124 2HB PRO 18 1HB PRO 18 -4.375 -2.035 5.630
125 1HG PRO 18 2HG PRO 18 -6.080 -2.780 3.680
126 2HG PRO 18 1HG PRO 18 -5.228 -1.219 3.666
127 1HD PRO 18 2HD PRO 18 -4.597 -3.727 2.151
128 2HD PRO 18 1HD PRO 18 -4.559 -2.040 1.602
129 H ASP 19 H ASP 19 -2.803 -4.993 3.091
130 HA ASP 19 HA ASP 19 -1.418 -6.322 5.327
131 1HB ASP 19 2HB ASP 19 -3.894 -6.920 4.794
132 2HB ASP 19 1HB ASP 19 -3.214 -7.810 3.434
133 H LYS 20 H LYS 20 -0.462 -8.485 4.574
134 HA LYS 20 HA LYS 20 1.530 -7.840 2.594
135 1HB LYS 20 2HB LYS 20 2.421 -10.123 3.192
136 2HB LYS 20 1HB LYS 20 2.311 -8.994 4.535
137 1HG LYS 20 2HG LYS 20 -0.128 -10.331 4.531
138 2HG LYS 20 1HG LYS 20 1.075 -11.574 4.184
139 1HD LYS 20 2HD LYS 20 1.155 -11.622 6.463
140 2HD LYS 20 1HD LYS 20 2.351 -10.359 6.172
141 1HE LYS 20 2HE LYS 20 1.048 -9.360 7.780
142 2HE LYS 20 1HE LYS 20 0.274 -8.775 6.308
143 1HZ LYS 20 1HZ LYS 20 -0.789 -11.282 7.239
144 2HZ LYS 20 2HZ LYS 20 -1.600 -9.861 6.786
145 3HZ LYS 20 3HZ LYS 20 -0.980 -10.020 8.358
146 H LYS 21 H LYS 21 -1.388 -9.696 2.801
147 HA LYS 21 HA LYS 21 -1.022 -11.244 0.429
148 1HB LYS 21 2HB LYS 21 -3.619 -10.382 1.720
149 2HB LYS 21 1HB LYS 21 -3.401 -11.719 0.595
150 1HG LYS 21 2HG LYS 21 -1.679 -11.928 2.925
151 2HG LYS 21 1HG LYS 21 -3.394 -11.871 3.342
152 1HD LYS 21 2HD LYS 21 -3.833 -13.872 2.369
153 2HD LYS 21 1HD LYS 21 -2.645 -13.632 1.085
154 1HE LYS 21 2HE LYS 21 -1.450 -13.881 3.733
155 2HE LYS 21 1HE LYS 21 -2.373 -15.306 3.250
156 1HZ LYS 21 1HZ LYS 21 -1.068 -15.051 1.051
157 2HZ LYS 21 2HZ LYS 21 -0.292 -15.730 2.394
158 3HZ LYS 21 3HZ LYS 21 0.005 -14.116 1.976
159 H CYS 22 H CYS 22 -1.714 -8.004 1.057
160 HA CYS 22 HA CYS 22 -2.771 -7.476 -1.610
161 1HB CYS 22 2HB CYS 22 -2.704 -6.082 0.997
162 2HB CYS 22 1HB CYS 22 -2.498 -5.052 -0.413
163 H GLY 23 H GLY 23 -0.693 -5.376 0.249
164 1HA GLY 23 1HA GLY 23 1.442 -4.606 -0.016
165 2HA GLY 23 2HA GLY 23 1.776 -6.024 -0.995
166 H ASN 24 H ASN 24 -0.841 -4.129 -2.076
167 HA ASN 24 HA ASN 24 0.579 -3.474 -4.485
168 1HB ASN 24 2HB ASN 24 -1.603 -4.153 -4.898
169 2HB ASN 24 1HB ASN 24 -2.243 -3.315 -3.502
170 1HD2 ASN 24 1HD2 ASN 24 -2.795 -1.201 -3.633
171 2HD2 ASN 24 2HD2 ASN 24 -2.902 -0.345 -5.135
172 H VAL 25 H VAL 25 0.831 -1.376 -5.355
173 HA VAL 25 HA VAL 25 1.030 0.750 -3.370
174 HB VAL 25 HB VAL 25 1.990 2.021 -5.424
175 1HG1 VAL 25 1HG1 VAL 25 3.621 -0.280 -4.384
176 2HG1 VAL 25 2HG1 VAL 25 4.173 1.332 -4.845
177 3HG1 VAL 25 3HG1 VAL 25 3.198 1.116 -3.393
178 1HG2 VAL 25 1HG2 VAL 25 1.852 -0.785 -6.425
179 2HG2 VAL 25 2HG2 VAL 25 1.596 0.732 -7.288
180 3HG2 VAL 25 3HG2 VAL 25 3.232 0.218 -6.874
181 H ASN 26 H ASN 26 -0.786 1.827 -3.020
182 HA ASN 26 HA ASN 26 -2.809 1.988 -5.097
183 1HB ASN 26 2HB ASN 26 -3.147 3.225 -2.384
184 2HB ASN 26 1HB ASN 26 -4.346 2.445 -3.412
185 1HD2 ASN 26 1HD2 ASN 26 -4.951 0.472 -2.805
186 2HD2 ASN 26 2HD2 ASN 26 -4.025 -0.623 -1.826
187 H PHE 27 H PHE 27 -4.093 4.141 -5.046
188 HA PHE 27 HA PHE 27 -2.523 6.146 -6.196
189 1HB PHE 27 2HB PHE 27 -4.988 5.724 -6.541
190 2HB PHE 27 1HB PHE 27 -5.279 6.492 -4.996
191 HD1 PHE 27 1HD PHE 27 -5.788 8.737 -4.966
192 HD2 PHE 27 2HD PHE 27 -3.564 7.162 -8.239
193 HE1 PHE 27 1HE PHE 27 -5.894 10.925 -6.088
194 HE2 PHE 27 2HE PHE 27 -3.665 9.349 -9.362
195 HZ PHE 27 HZ PHE 27 -4.831 11.231 -8.289
196 H ALA 28 H ALA 28 -4.622 7.103 -3.573
197 HA ALA 28 HA ALA 28 -2.802 7.652 -1.554
198 1HB ALA 28 1HB ALA 28 -2.310 9.956 -1.734
199 2HB ALA 28 2HB ALA 28 -1.926 9.275 -3.317
200 3HB ALA 28 3HB ALA 28 -3.429 10.171 -3.082
201 H ARG 29 H ARG 29 -5.334 9.593 -3.129
202 HA ARG 29 HA ARG 29 -6.866 9.782 -0.699
203 1HB ARG 29 2HB ARG 29 -7.334 10.682 -3.536
204 2HB ARG 29 1HB ARG 29 -8.580 10.830 -2.306
205 1HG ARG 29 2HG ARG 29 -5.912 12.197 -2.427
206 2HG ARG 29 1HG ARG 29 -7.519 12.923 -2.415
207 1HD ARG 29 2HD ARG 29 -7.699 12.795 -0.169
208 2HD ARG 29 1HD ARG 29 -6.878 11.235 -0.090
209 HE ARG 29 HE ARG 29 -5.574 13.878 -0.195
210 1HH1 ARG 29 2HH1 ARG 29 -5.493 10.451 0.535
211 2HH1 ARG 29 1HH1 ARG 29 -3.832 10.468 1.055
212 1HH2 ARG 29 2HH2 ARG 29 -3.378 13.906 0.508
213 2HH2 ARG 29 1HH2 ARG 29 -2.641 12.426 1.032
214 H ARG 30 H ARG 30 -6.634 7.229 -0.887
215 HA ARG 30 HA ARG 30 -9.180 6.242 -1.988
216 1HB ARG 30 2HB ARG 30 -6.415 5.167 -2.222
217 2HB ARG 30 1HB ARG 30 -7.712 4.001 -2.007
218 1HG ARG 30 2HG ARG 30 -7.920 6.107 -4.108
219 2HG ARG 30 1HG ARG 30 -6.956 4.654 -4.386
220 1HD ARG 30 2HD ARG 30 -8.825 3.241 -4.116
221 2HD ARG 30 1HD ARG 30 -9.810 4.541 -3.446
222 HE ARG 30 HE ARG 30 -9.249 4.015 -6.245
223 1HH1 ARG 30 2HH1 ARG 30 -10.453 6.297 -3.873
224 2HH1 ARG 30 1HH1 ARG 30 -11.365 7.218 -5.021
225 1HH2 ARG 30 2HH2 ARG 30 -10.438 5.246 -7.774
226 2HH2 ARG 30 1HH2 ARG 30 -11.378 6.610 -7.233
227 H THR 31 H THR 31 -10.484 5.362 -0.472
228 HA THR 31 HA THR 31 -9.317 4.523 2.069
229 HB THR 31 HB THR 31 -12.145 4.066 1.954
230 HG1 THR 31 1HG THR 31 -12.524 6.502 1.656
231 1HG2 THR 31 1HG2 THR 31 -12.026 6.051 3.632
232 2HG2 THR 31 2HG2 THR 31 -10.280 5.876 3.447
233 3HG2 THR 31 3HG2 THR 31 -11.245 4.526 4.043
234 H SER 32 H SER 32 -9.909 3.261 -0.874
235 HA SER 32 HA SER 32 -9.988 0.536 0.198
236 1HB SER 32 2HB SER 32 -11.251 1.207 -2.450
237 2HB SER 32 1HB SER 32 -11.526 -0.195 -1.417
238 HG SER 32 HG SER 32 -12.800 0.982 -0.105
239 H CYS 33 H CYS 33 -9.097 -1.058 -1.465
240 HA CYS 33 HA CYS 33 -6.506 -0.428 -2.093
241 1HB CYS 33 2HB CYS 33 -8.371 -2.536 -3.134
242 2HB CYS 33 1HB CYS 33 -6.676 -2.458 -3.512
243 H ASP 34 H ASP 34 -5.521 -0.705 -4.265
244 HA ASP 34 HA ASP 34 -6.866 1.033 -6.205
245 1HB ASP 34 2HB ASP 34 -4.428 1.357 -5.275
246 2HB ASP 34 1HB ASP 34 -4.026 0.131 -6.472
247 H ARG 35 H ARG 35 -5.277 -2.107 -5.892
248 HA ARG 35 HA ARG 35 -6.116 -2.781 -8.630
249 1HB ARG 35 2HB ARG 35 -3.941 -3.798 -6.839
250 2HB ARG 35 1HB ARG 35 -4.552 -4.815 -8.131
251 1HG ARG 35 2HG ARG 35 -2.698 -2.599 -8.225
252 2HG ARG 35 1HG ARG 35 -3.006 -3.873 -9.396
253 1HD ARG 35 2HD ARG 35 -3.991 -2.399 -10.728
254 2HD ARG 35 1HD ARG 35 -5.202 -2.087 -9.489
255 HE ARG 35 HE ARG 35 -4.191 -0.088 -9.060
256 1HH1 ARG 35 2HH1 ARG 35 -1.897 -2.122 -10.775
257 2HH1 ARG 35 1HH1 ARG 35 -0.668 -0.889 -10.835
258 1HH2 ARG 35 2HH2 ARG 35 -2.596 1.514 -9.147
259 2HH2 ARG 35 1HH2 ARG 35 -1.057 1.181 -9.902
260 H CYS 36 H CYS 36 -6.044 -4.062 -5.331
261 HA CYS 36 HA CYS 36 -7.362 -6.494 -5.998
262 1HB CYS 36 2HB CYS 36 -7.370 -5.748 -3.205
263 2HB CYS 36 1HB CYS 36 -6.497 -7.051 -4.013
264 H GLY 37 H GLY 37 -8.404 -3.545 -4.307
265 1HA GLY 37 1HA GLY 37 -10.572 -2.636 -4.424
266 2HA GLY 37 2HA GLY 37 -11.156 -4.172 -5.045
267 H ARG 38 H ARG 38 -9.186 -3.719 -2.172
268 HA ARG 38 HA ARG 38 -11.354 -4.843 -0.542
269 1HB ARG 38 2HB ARG 38 -8.494 -4.375 0.258
270 2HB ARG 38 1HB ARG 38 -9.684 -5.397 1.054
271 1HG ARG 38 2HG ARG 38 -9.673 -6.551 -1.355
272 2HG ARG 38 1HG ARG 38 -8.025 -5.913 -1.328
273 1HD ARG 38 2HD ARG 38 -8.577 -7.046 1.198
274 2HD ARG 38 1HD ARG 38 -9.069 -8.206 -0.037
275 HE ARG 38 HE ARG 38 -6.370 -6.983 0.035
276 1HH1 ARG 38 2HH1 ARG 38 -8.465 -9.772 -0.259
277 2HH1 ARG 38 1HH1 ARG 38 -7.188 -10.852 -0.722
278 1HH2 ARG 38 2HH2 ARG 38 -4.693 -8.363 -0.573
279 2HH2 ARG 38 1HH2 ARG 38 -5.021 -10.038 -0.909
280 H GLU 39 H GLU 39 -11.484 -3.876 1.723
281 HA GLU 39 HA GLU 39 -11.322 -0.967 1.568
282 1HB GLU 39 2HB GLU 39 -12.446 -2.799 3.707
283 2HB GLU 39 1HB GLU 39 -12.473 -1.042 3.784
284 1HG GLU 39 2HG GLU 39 -13.654 -2.378 1.406
285 2HG GLU 39 1HG GLU 39 -14.543 -2.414 2.929
286 H LYS 40 H LYS 40 -10.103 0.263 3.074
287 HA LYS 40 HA LYS 40 -7.538 -0.683 3.589
288 1HB LYS 40 2HB LYS 40 -8.328 1.733 3.462
289 2HB LYS 40 1HB LYS 40 -8.843 1.552 5.134
290 1HG LYS 40 2HG LYS 40 -6.674 1.361 5.919
291 2HG LYS 40 1HG LYS 40 -6.037 0.899 4.339
292 1HD LYS 40 2HD LYS 40 -5.392 3.032 4.156
293 2HD LYS 40 1HD LYS 40 -7.095 3.394 3.872
294 1HE LYS 40 2HE LYS 40 -5.731 4.662 5.723
295 2HE LYS 40 1HE LYS 40 -7.416 4.211 5.984
296 1HZ LYS 40 1HZ LYS 40 -5.120 2.546 6.880
297 2HZ LYS 40 2HZ LYS 40 -6.751 2.365 7.301
298 3HZ LYS 40 3HZ LYS 40 -5.877 3.703 7.864
299 H THR 41 H THR 41 -7.272 -2.476 4.768
300 HA THR 41 HA THR 41 -8.674 -3.118 7.129
301 HB THR 41 HB THR 41 -6.048 -4.315 6.977
302 HG1 THR 41 1HG THR 41 -6.573 -5.369 4.897
303 1HG2 THR 41 1HG2 THR 41 -7.217 -6.125 7.565
304 2HG2 THR 41 2HG2 THR 41 -8.339 -5.934 6.215
305 3HG2 THR 41 3HG2 THR 41 -8.595 -5.036 7.713
306 H THR 42 H THR 42 -8.586 -1.792 8.834
307 HA THR 42 HA THR 42 -5.945 -1.191 9.948
308 HB THR 42 HB THR 42 -7.997 0.903 10.363
309 HG1 THR 42 1HG THR 42 -7.878 0.172 7.982
310 1HG2 THR 42 1HG2 THR 42 -5.265 0.600 10.781
311 2HG2 THR 42 2HG2 THR 42 -6.192 2.094 10.931
312 3HG2 THR 42 3HG2 THR 42 -5.377 1.710 9.414
313 H GLY 43 H GLY 43 -5.935 -2.367 11.743
314 1HA GLY 43 1HA GLY 43 -7.213 -1.954 14.058
315 2HA GLY 43 2HA GLY 43 -8.410 -2.894 13.178
316 HA PRO 44 HA PRO 44 -6.289 -6.634 14.282
317 1HB PRO 44 2HB PRO 44 -6.506 -7.692 11.560
318 2HB PRO 44 1HB PRO 44 -7.301 -8.241 13.038
319 1HG PRO 44 2HG PRO 44 -8.656 -7.013 11.056
320 2HG PRO 44 1HG PRO 44 -9.091 -6.815 12.762
321 1HD PRO 44 2HD PRO 44 -7.547 -4.968 10.977
322 2HD PRO 44 1HD PRO 44 -8.811 -4.588 12.167
323 H ILE 45 H ILE 45 -4.228 -7.347 14.380
324 HA ILE 45 HA ILE 45 -2.395 -6.580 12.214
325 HB ILE 45 HB ILE 45 -2.130 -5.116 14.226
326 1HG1 ILE 45 2HG1 ILE 45 0.438 -5.984 14.515
327 1HG2 ILE 45 1HG2 ILE 45 -1.969 -5.905 16.294
328 2HG2 ILE 45 2HG2 ILE 45 -2.402 -7.483 15.636
329 3HG2 ILE 45 3HG2 ILE 45 -0.705 -7.046 15.833
330 1HD1 ILE 45 1HD1 ILE 45 0.098 -3.840 13.643
331 2HD1 ILE 45 2HD1 ILE 45 0.927 -4.734 12.368
332 3HD1 ILE 45 3HD1 ILE 45 -0.810 -4.458 12.264
Start of MODEL 8
1 1H GLY 1 1H GLY 1 4.945 -1.581 12.039
2 2H GLY 1 2H GLY 1 4.770 -3.070 12.826
3 3H GLY 1 3H GLY 1 5.024 -1.656 13.730
4 1HA GLY 1 2HA GLY 1 2.883 -0.788 12.885
5 2HA GLY 1 1HA GLY 1 2.621 -2.363 12.152
6 H SER 2 H SER 2 2.844 -4.252 13.724
7 HA SER 2 HA SER 2 0.977 -3.833 15.828
8 1HB SER 2 2HB SER 2 2.607 -6.330 15.692
9 2HB SER 2 1HB SER 2 0.876 -6.130 15.972
10 HG SER 2 HG SER 2 0.631 -5.614 13.765
11 H MET 3 H MET 3 4.469 -4.544 15.790
12 HA MET 3 HA MET 3 4.645 -4.496 18.664
13 1HB MET 3 2HB MET 3 7.229 -4.139 17.596
14 2HB MET 3 1HB MET 3 6.527 -5.623 18.223
15 1HG MET 3 2HG MET 3 7.361 -6.107 16.068
16 2HG MET 3 1HG MET 3 5.606 -6.045 15.933
17 1HE MET 3 1HE MET 3 7.966 -4.510 12.830
18 2HE MET 3 2HE MET 3 8.918 -4.721 14.299
19 3HE MET 3 3HE MET 3 7.843 -6.007 13.752
20 H SER 4 H SER 4 6.528 -2.566 16.355
21 HA SER 4 HA SER 4 6.228 -0.226 18.066
22 1HB SER 4 2HB SER 4 7.702 0.521 15.832
23 2HB SER 4 1HB SER 4 8.371 -0.005 17.379
24 HG SER 4 HG SER 4 9.235 -1.510 16.163
25 H THR 5 H THR 5 5.199 1.687 17.365
26 HA THR 5 HA THR 5 2.999 1.181 15.583
27 HB THR 5 HB THR 5 3.217 3.946 16.397
28 HG1 THR 5 1HG THR 5 3.300 1.976 18.475
29 1HG2 THR 5 1HG2 THR 5 1.290 1.820 16.238
30 2HG2 THR 5 2HG2 THR 5 1.018 3.558 16.365
31 3HG2 THR 5 3HG2 THR 5 1.202 2.587 17.823
32 H LYS 6 H LYS 6 5.798 1.433 14.482
33 HA LYS 6 HA LYS 6 5.427 3.676 12.638
34 1HB LYS 6 2HB LYS 6 7.705 2.372 13.813
35 2HB LYS 6 1HB LYS 6 7.815 2.277 12.060
36 1HG LYS 6 2HG LYS 6 7.692 4.655 11.858
37 2HG LYS 6 1HG LYS 6 7.357 4.834 13.582
38 1HD LYS 6 2HD LYS 6 9.579 3.806 14.055
39 2HD LYS 6 1HD LYS 6 9.902 3.821 12.317
40 1HE LYS 6 2HE LYS 6 9.324 6.347 12.502
41 2HE LYS 6 1HE LYS 6 9.649 6.115 14.221
42 1HZ LYS 6 1HZ LYS 6 11.495 6.595 12.243
43 2HZ LYS 6 2HZ LYS 6 11.693 4.952 12.616
44 3HZ LYS 6 3HZ LYS 6 11.823 6.117 13.838
45 H ASN 7 H ASN 7 4.144 3.131 10.985
46 HA ASN 7 HA ASN 7 4.365 0.430 9.867
47 1HB ASN 7 2HB ASN 7 2.209 2.455 10.006
48 2HB ASN 7 1HB ASN 7 2.283 1.509 8.522
49 1HD2 ASN 7 1HD2 ASN 7 0.746 1.664 11.306
50 2HD2 ASN 7 2HD2 ASN 7 0.463 -0.021 11.625
51 H PHE 8 H PHE 8 4.124 0.298 7.452
52 HA PHE 8 HA PHE 8 6.219 1.866 6.278
53 1HB PHE 8 2HB PHE 8 5.334 -0.678 5.870
54 2HB PHE 8 1HB PHE 8 4.610 0.153 4.498
55 HD1 PHE 8 1HD PHE 8 5.886 0.706 2.619
56 HD2 PHE 8 2HD PHE 8 7.828 -0.480 6.215
57 HE1 PHE 8 1HE PHE 8 8.033 0.600 1.424
58 HE2 PHE 8 2HE PHE 8 9.978 -0.586 5.024
59 HZ PHE 8 HZ PHE 8 10.081 -0.046 2.625
60 H ARG 9 H ARG 9 5.179 3.950 6.449
61 HA ARG 9 HA ARG 9 3.114 4.443 4.431
62 1HB ARG 9 2HB ARG 9 2.973 5.441 6.774
63 2HB ARG 9 1HB ARG 9 4.327 6.465 6.318
64 1HG ARG 9 2HG ARG 9 2.486 7.811 5.921
65 2HG ARG 9 1HG ARG 9 2.856 7.160 4.323
66 1HD ARG 9 2HD ARG 9 1.111 5.515 4.535
67 2HD ARG 9 1HD ARG 9 0.805 6.001 6.202
68 HE ARG 9 HE ARG 9 0.165 7.590 3.805
69 1HH1 ARG 9 2HH1 ARG 9 -0.203 6.959 7.230
70 2HH1 ARG 9 1HH1 ARG 9 -1.553 8.038 7.419
71 1HH2 ARG 9 2HH2 ARG 9 -1.623 9.018 4.047
72 2HH2 ARG 9 1HH2 ARG 9 -2.361 9.195 5.610
73 H VAL 10 H VAL 10 3.702 5.047 2.462
74 HA VAL 10 HA VAL 10 6.364 5.511 1.686
75 HB VAL 10 HB VAL 10 3.942 6.437 0.140
76 1HG1 VAL 10 1HG1 VAL 10 6.222 7.057 -0.666
77 2HG1 VAL 10 2HG1 VAL 10 6.569 5.337 -0.840
78 3HG1 VAL 10 3HG1 VAL 10 5.291 6.080 -1.802
79 1HG2 VAL 10 1HG2 VAL 10 4.472 3.804 1.041
80 2HG2 VAL 10 2HG2 VAL 10 3.213 4.352 -0.070
81 3HG2 VAL 10 3HG2 VAL 10 4.785 3.850 -0.695
82 H SER 11 H SER 11 7.570 7.302 1.683
83 HA SER 11 HA SER 11 6.732 9.593 3.071
84 1HB SER 11 2HB SER 11 9.039 10.150 1.475
85 2HB SER 11 1HB SER 11 8.946 9.861 3.214
86 HG SER 11 HG SER 11 10.277 8.330 2.080
87 H ASP 12 H ASP 12 6.290 8.691 -0.088
88 HA ASP 12 HA ASP 12 6.190 11.276 -1.315
89 1HB ASP 12 2HB ASP 12 6.146 8.637 -2.222
90 2HB ASP 12 1HB ASP 12 4.550 9.263 -2.624
91 H GLY 13 H GLY 13 4.089 9.420 0.649
92 1HA GLY 13 1HA GLY 13 2.289 10.645 1.732
93 2HA GLY 13 2HA GLY 13 1.944 11.391 0.180
94 H ASP 14 H ASP 14 2.593 8.473 -0.808
95 HA ASP 14 HA ASP 14 -0.194 7.752 -0.987
96 1HB ASP 14 2HB ASP 14 2.265 6.391 -2.117
97 2HB ASP 14 1HB ASP 14 0.601 5.968 -2.507
98 H TRP 15 H TRP 15 -0.816 5.419 -0.733
99 HA TRP 15 HA TRP 15 0.624 4.099 1.463
100 1HB TRP 15 2HB TRP 15 -1.403 3.543 2.612
101 2HB TRP 15 1HB TRP 15 -1.460 5.271 2.296
102 HD1 TRP 15 HD TRP 15 -2.992 5.937 0.015
103 HE1 TRP 15 1HE TRP 15 -5.246 4.946 -0.707
104 HE3 TRP 15 3HE TRP 15 -2.856 1.581 2.702
105 HZ2 TRP 15 2HZ TRP 15 -6.770 2.627 -0.213
106 HZ3 TRP 15 3HZ TRP 15 -4.759 0.027 2.533
107 HH2 TRP 15 HH TRP 15 -6.682 0.543 1.079
108 H ILE 16 H ILE 16 -0.276 1.706 1.628
109 HA ILE 16 HA ILE 16 -0.331 0.731 -1.145
110 HB ILE 16 HB ILE 16 0.620 -1.424 0.023
111 1HG1 ILE 16 2HG1 ILE 16 2.027 0.514 1.787
112 1HG2 ILE 16 1HG2 ILE 16 1.873 0.986 -1.064
113 2HG2 ILE 16 2HG2 ILE 16 2.951 -0.031 -0.109
114 3HG2 ILE 16 3HG2 ILE 16 2.099 -0.708 -1.496
115 1HD1 ILE 16 1HD1 ILE 16 2.213 -2.159 1.496
116 2HD1 ILE 16 2HD1 ILE 16 2.651 -1.284 2.963
117 3HD1 ILE 16 3HD1 ILE 16 1.068 -2.048 2.833
118 H CYS 17 H CYS 17 -0.713 -1.506 1.439
119 HA CYS 17 HA CYS 17 -3.609 -1.526 1.278
120 1HB CYS 17 2HB CYS 17 -2.548 -3.053 -0.550
121 2HB CYS 17 1HB CYS 17 -2.094 -4.093 0.793
122 HA PRO 18 HA PRO 18 -3.030 -2.389 5.565
123 1HB PRO 18 2HB PRO 18 -5.384 -4.186 5.432
124 2HB PRO 18 1HB PRO 18 -5.112 -2.763 6.442
125 1HG PRO 18 2HG PRO 18 -6.784 -2.672 4.368
126 2HG PRO 18 1HG PRO 18 -5.736 -1.293 4.765
127 1HD PRO 18 2HD PRO 18 -5.405 -3.368 2.632
128 2HD PRO 18 1HD PRO 18 -5.116 -1.618 2.555
129 H ASP 19 H ASP 19 -3.540 -5.004 3.316
130 HA ASP 19 HA ASP 19 -2.544 -7.037 5.141
131 1HB ASP 19 2HB ASP 19 -4.437 -7.351 3.398
132 2HB ASP 19 1HB ASP 19 -3.134 -7.470 2.220
133 H LYS 20 H LYS 20 -0.958 -8.668 3.896
134 HA LYS 20 HA LYS 20 1.300 -6.977 3.053
135 1HB LYS 20 2HB LYS 20 2.087 -9.575 4.076
136 2HB LYS 20 1HB LYS 20 2.630 -7.973 4.552
137 1HG LYS 20 2HG LYS 20 -0.038 -8.890 5.489
138 2HG LYS 20 1HG LYS 20 1.404 -9.572 6.243
139 1HD LYS 20 2HD LYS 20 2.018 -7.587 7.189
140 2HD LYS 20 1HD LYS 20 1.293 -6.628 5.898
141 1HE LYS 20 2HE LYS 20 -0.939 -7.624 6.883
142 2HE LYS 20 1HE LYS 20 0.042 -7.777 8.340
143 1HZ LYS 20 1HZ LYS 20 0.628 -5.289 7.645
144 2HZ LYS 20 2HZ LYS 20 -0.687 -5.680 8.648
145 3HZ LYS 20 3HZ LYS 20 -0.938 -5.386 6.995
146 H LYS 21 H LYS 21 -0.783 -9.496 2.141
147 HA LYS 21 HA LYS 21 1.072 -10.733 0.304
148 1HB LYS 21 2HB LYS 21 -0.610 -12.248 -0.208
149 2HB LYS 21 1HB LYS 21 -0.989 -11.823 1.454
150 1HG LYS 21 2HG LYS 21 -2.557 -10.058 0.361
151 2HG LYS 21 1HG LYS 21 -2.415 -11.094 -1.062
152 1HD LYS 21 2HD LYS 21 -3.506 -12.848 -0.062
153 2HD LYS 21 1HD LYS 21 -3.043 -12.349 1.566
154 1HE LYS 21 2HE LYS 21 -4.965 -11.271 1.823
155 2HE LYS 21 1HE LYS 21 -4.658 -10.317 0.373
156 1HZ LYS 21 1HZ LYS 21 -5.816 -11.798 -0.953
157 2HZ LYS 21 2HZ LYS 21 -6.746 -11.776 0.463
158 3HZ LYS 21 3HZ LYS 21 -5.696 -13.074 0.159
159 H CYS 22 H CYS 22 -1.207 -8.143 0.277
160 HA CYS 22 HA CYS 22 -1.402 -7.956 -2.588
161 1HB CYS 22 2HB CYS 22 -3.102 -7.203 -0.754
162 2HB CYS 22 1HB CYS 22 -2.118 -5.749 -0.682
163 H GLY 23 H GLY 23 -0.490 -5.384 -0.348
164 1HA GLY 23 1HA GLY 23 1.285 -3.925 -0.325
165 2HA GLY 23 2HA GLY 23 2.180 -5.096 -1.282
166 H ASN 24 H ASN 24 -0.870 -3.968 -2.417
167 HA ASN 24 HA ASN 24 0.182 -3.026 -4.868
168 1HB ASN 24 2HB ASN 24 -2.084 -3.815 -4.838
169 2HB ASN 24 1HB ASN 24 -2.523 -2.693 -3.558
170 1HD2 ASN 24 1HD2 ASN 24 -3.167 -0.675 -4.076
171 2HD2 ASN 24 2HD2 ASN 24 -3.276 -0.076 -5.693
172 H VAL 25 H VAL 25 0.815 -1.032 -5.514
173 HA VAL 25 HA VAL 25 1.011 1.036 -3.524
174 HB VAL 25 HB VAL 25 1.827 2.417 -5.549
175 1HG1 VAL 25 1HG1 VAL 25 4.051 1.124 -5.477
176 2HG1 VAL 25 2HG1 VAL 25 3.418 1.783 -3.966
177 3HG1 VAL 25 3HG1 VAL 25 3.225 0.065 -4.329
178 1HG2 VAL 25 1HG2 VAL 25 0.919 0.260 -6.985
179 2HG2 VAL 25 2HG2 VAL 25 2.050 1.483 -7.567
180 3HG2 VAL 25 3HG2 VAL 25 2.657 -0.031 -6.897
181 H ASN 26 H ASN 26 -0.939 1.759 -2.942
182 HA ASN 26 HA ASN 26 -2.960 2.382 -4.916
183 1HB ASN 26 2HB ASN 26 -2.864 2.119 -1.983
184 2HB ASN 26 1HB ASN 26 -3.913 3.407 -2.565
185 1HD2 ASN 26 1HD2 ASN 26 -3.711 0.195 -1.811
186 2HD2 ASN 26 2HD2 ASN 26 -5.113 -0.367 -2.652
187 H PHE 27 H PHE 27 -4.143 4.566 -4.221
188 HA PHE 27 HA PHE 27 -2.349 6.714 -4.832
189 1HB PHE 27 2HB PHE 27 -4.842 6.423 -5.493
190 2HB PHE 27 1HB PHE 27 -5.194 7.019 -3.879
191 HD1 PHE 27 1HD PHE 27 -6.483 8.774 -5.094
192 HD2 PHE 27 2HD PHE 27 -2.252 8.431 -5.392
193 HE1 PHE 27 1HE PHE 27 -6.357 11.091 -5.907
194 HE2 PHE 27 2HE PHE 27 -2.120 10.747 -6.205
195 HZ PHE 27 HZ PHE 27 -4.173 12.084 -6.459
196 H ALA 28 H ALA 28 -4.192 8.362 -2.890
197 HA ALA 28 HA ALA 28 -2.738 7.770 -0.416
198 1HB ALA 28 1HB ALA 28 -1.655 9.726 -0.346
199 2HB ALA 28 2HB ALA 28 -2.045 9.873 -2.059
200 3HB ALA 28 3HB ALA 28 -3.083 10.626 -0.853
201 H ARG 29 H ARG 29 -5.242 9.844 -1.866
202 HA ARG 29 HA ARG 29 -6.815 9.721 0.564
203 1HB ARG 29 2HB ARG 29 -8.297 11.276 -0.470
204 2HB ARG 29 1HB ARG 29 -6.661 11.783 -0.862
205 1HG ARG 29 2HG ARG 29 -7.018 10.482 -3.057
206 2HG ARG 29 1HG ARG 29 -8.732 10.563 -2.642
207 1HD ARG 29 2HD ARG 29 -8.407 13.058 -2.361
208 2HD ARG 29 1HD ARG 29 -6.828 12.843 -3.114
209 HE ARG 29 HE ARG 29 -9.271 11.969 -4.507
210 1HH1 ARG 29 2HH1 ARG 29 -6.416 14.015 -4.350
211 2HH1 ARG 29 1HH1 ARG 29 -6.584 14.570 -5.988
212 1HH2 ARG 29 2HH2 ARG 29 -9.481 12.715 -6.646
213 2HH2 ARG 29 1HH2 ARG 29 -8.302 13.812 -7.300
214 H ARG 30 H ARG 30 -6.237 7.401 -1.434
215 HA ARG 30 HA ARG 30 -8.872 6.594 -2.258
216 1HB ARG 30 2HB ARG 30 -6.131 5.451 -2.462
217 2HB ARG 30 1HB ARG 30 -7.464 4.303 -2.436
218 1HG ARG 30 2HG ARG 30 -7.865 6.552 -4.262
219 2HG ARG 30 1HG ARG 30 -6.495 5.516 -4.666
220 1HD ARG 30 2HD ARG 30 -8.499 3.726 -4.034
221 2HD ARG 30 1HD ARG 30 -9.355 5.015 -4.878
222 HE ARG 30 HE ARG 30 -7.602 3.085 -6.026
223 1HH1 ARG 30 2HH1 ARG 30 -8.743 6.386 -6.357
224 2HH1 ARG 30 1HH1 ARG 30 -8.346 6.490 -8.052
225 1HH2 ARG 30 2HH2 ARG 30 -7.159 3.188 -8.280
226 2HH2 ARG 30 1HH2 ARG 30 -7.479 4.670 -9.140
227 H THR 31 H THR 31 -10.327 5.590 -1.038
228 HA THR 31 HA THR 31 -9.551 4.655 1.607
229 HB THR 31 HB THR 31 -12.353 4.303 0.811
230 HG1 THR 31 1HG THR 31 -12.026 6.944 1.264
231 1HG2 THR 31 1HG2 THR 31 -12.786 5.175 2.950
232 2HG2 THR 31 2HG2 THR 31 -11.240 6.020 3.012
233 3HG2 THR 31 3HG2 THR 31 -11.291 4.263 3.145
234 H SER 32 H SER 32 -9.864 3.403 -1.477
235 HA SER 32 HA SER 32 -10.002 0.679 -0.393
236 1HB SER 32 2HB SER 32 -11.131 0.908 -3.080
237 2HB SER 32 1HB SER 32 -11.778 0.090 -1.658
238 HG SER 32 HG SER 32 -12.899 1.825 -1.130
239 H CYS 33 H CYS 33 -8.786 -0.849 -1.456
240 HA CYS 33 HA CYS 33 -6.438 -0.068 -2.758
241 1HB CYS 33 2HB CYS 33 -7.109 -2.272 -1.532
242 2HB CYS 33 1HB CYS 33 -7.595 -2.800 -3.138
243 H ASP 34 H ASP 34 -5.710 -0.674 -4.840
244 HA ASP 34 HA ASP 34 -7.732 -0.276 -6.917
245 1HB ASP 34 2HB ASP 34 -5.549 1.144 -6.614
246 2HB ASP 34 1HB ASP 34 -4.773 -0.223 -7.404
247 H ARG 35 H ARG 35 -5.490 -2.567 -5.630
248 HA ARG 35 HA ARG 35 -5.537 -4.198 -8.043
249 1HB ARG 35 2HB ARG 35 -3.659 -3.801 -5.969
250 2HB ARG 35 1HB ARG 35 -4.188 -5.472 -5.851
251 1HG ARG 35 2HG ARG 35 -2.411 -4.209 -7.759
252 2HG ARG 35 1HG ARG 35 -2.623 -5.911 -7.367
253 1HD ARG 35 2HD ARG 35 -3.597 -6.213 -9.334
254 2HD ARG 35 1HD ARG 35 -4.900 -5.138 -8.842
255 HE ARG 35 HE ARG 35 -2.492 -3.874 -9.888
256 1HH1 ARG 35 2HH1 ARG 35 -5.781 -4.933 -10.488
257 2HH1 ARG 35 1HH1 ARG 35 -5.955 -3.988 -11.937
258 1HH2 ARG 35 2HH2 ARG 35 -2.722 -2.636 -11.808
259 2HH2 ARG 35 1HH2 ARG 35 -4.218 -2.700 -12.695
260 H CYS 36 H CYS 36 -6.004 -4.861 -4.552
261 HA CYS 36 HA CYS 36 -7.456 -7.247 -5.250
262 1HB CYS 36 2HB CYS 36 -7.493 -7.741 -2.893
263 2HB CYS 36 1HB CYS 36 -5.881 -7.193 -3.334
264 H GLY 37 H GLY 37 -8.224 -4.128 -3.727
265 1HA GLY 37 1HA GLY 37 -10.124 -2.933 -4.570
266 2HA GLY 37 2HA GLY 37 -10.904 -4.469 -4.888
267 H ARG 38 H ARG 38 -9.469 -4.530 -1.845
268 HA ARG 38 HA ARG 38 -12.043 -4.368 -0.561
269 1HB ARG 38 2HB ARG 38 -10.721 -4.819 1.528
270 2HB ARG 38 1HB ARG 38 -10.615 -6.055 0.284
271 1HG ARG 38 2HG ARG 38 -8.444 -5.838 1.010
272 2HG ARG 38 1HG ARG 38 -8.477 -4.795 -0.420
273 1HD ARG 38 2HD ARG 38 -9.184 -2.980 1.326
274 2HD ARG 38 1HD ARG 38 -8.393 -4.071 2.454
275 HE ARG 38 HE ARG 38 -6.401 -3.868 0.984
276 1HH1 ARG 38 2HH1 ARG 38 -8.829 -1.345 1.041
277 2HH1 ARG 38 1HH1 ARG 38 -7.750 -0.119 0.462
278 1HH2 ARG 38 2HH2 ARG 38 -4.985 -2.286 0.217
279 2HH2 ARG 38 1HH2 ARG 38 -5.550 -0.657 -0.029
280 H GLU 39 H GLU 39 -12.245 -3.091 1.538
281 HA GLU 39 HA GLU 39 -11.484 -0.335 0.983
282 1HB GLU 39 2HB GLU 39 -13.253 -1.489 3.145
283 2HB GLU 39 1HB GLU 39 -13.015 0.225 2.829
284 1HG GLU 39 2HG GLU 39 -13.856 -1.313 0.490
285 2HG GLU 39 1HG GLU 39 -15.023 -1.311 1.812
286 H LYS 40 H LYS 40 -10.555 1.036 2.625
287 HA LYS 40 HA LYS 40 -8.310 -0.240 3.878
288 1HB LYS 40 2HB LYS 40 -8.024 1.927 2.820
289 2HB LYS 40 1HB LYS 40 -9.240 2.637 3.872
290 1HG LYS 40 2HG LYS 40 -7.839 2.522 5.753
291 2HG LYS 40 1HG LYS 40 -6.728 1.406 4.955
292 1HD LYS 40 2HD LYS 40 -5.647 3.506 4.947
293 2HD LYS 40 1HD LYS 40 -6.249 3.267 3.306
294 1HE LYS 40 2HE LYS 40 -6.585 5.572 4.325
295 2HE LYS 40 1HE LYS 40 -8.002 4.804 3.613
296 1HZ LYS 40 1HZ LYS 40 -9.051 4.824 5.562
297 2HZ LYS 40 2HZ LYS 40 -7.822 5.842 6.141
298 3HZ LYS 40 3HZ LYS 40 -7.725 4.169 6.387
299 H THR 41 H THR 41 -8.646 -1.365 5.681
300 HA THR 41 HA THR 41 -10.650 -0.856 7.597
301 HB THR 41 HB THR 41 -8.901 -2.308 9.019
302 HG1 THR 41 1HG THR 41 -7.599 -3.524 7.616
303 1HG2 THR 41 1HG2 THR 41 -10.119 -4.184 8.400
304 2HG2 THR 41 2HG2 THR 41 -10.224 -3.687 6.711
305 3HG2 THR 41 3HG2 THR 41 -11.210 -2.879 7.933
306 H THR 42 H THR 42 -7.314 0.136 7.287
307 HA THR 42 HA THR 42 -6.027 1.656 8.345
308 HB THR 42 HB THR 42 -8.373 2.804 9.814
309 HG1 THR 42 1HG THR 42 -9.304 2.605 7.840
310 1HG2 THR 42 1HG2 THR 42 -6.188 3.841 10.101
311 2HG2 THR 42 2HG2 THR 42 -7.255 4.918 9.199
312 3HG2 THR 42 3HG2 THR 42 -6.011 3.997 8.353
313 H GLY 43 H GLY 43 -5.889 -0.723 9.460
314 1HA GLY 43 1HA GLY 43 -6.021 -0.253 12.363
315 2HA GLY 43 2HA GLY 43 -5.866 -1.830 11.595
316 HA PRO 44 HA PRO 44 -1.652 0.599 11.842
317 1HB PRO 44 2HB PRO 44 -1.146 1.215 14.443
318 2HB PRO 44 1HB PRO 44 -1.892 2.341 13.303
319 1HG PRO 44 2HG PRO 44 -3.180 0.616 15.383
320 2HG PRO 44 1HG PRO 44 -3.534 2.299 14.949
321 1HD PRO 44 2HD PRO 44 -5.049 0.226 14.092
322 2HD PRO 44 1HD PRO 44 -4.806 1.696 13.127
323 H ILE 45 H ILE 45 -3.003 -1.521 14.270
324 HA ILE 45 HA ILE 45 -0.430 -2.807 14.733
325 HB ILE 45 HB ILE 45 -2.147 -4.256 16.242
326 1HG1 ILE 45 2HG1 ILE 45 -3.293 -1.640 16.894
327 1HG2 ILE 45 1HG2 ILE 45 -0.650 -3.507 17.691
328 2HG2 ILE 45 2HG2 ILE 45 -0.247 -2.152 16.637
329 3HG2 ILE 45 3HG2 ILE 45 -1.554 -1.997 17.810
330 1HD1 ILE 45 1HD1 ILE 45 -4.833 -2.910 17.826
331 2HD1 ILE 45 2HD1 ILE 45 -5.232 -3.631 16.267
332 3HD1 ILE 45 3HD1 ILE 45 -3.962 -4.339 17.264
Start of MODEL 9
1 1H GLY 1 1H GLY 1 -9.031 -1.583 -18.361
2 2H GLY 1 2H GLY 1 -10.395 -2.577 -18.545
3 3H GLY 1 3H GLY 1 -10.244 -1.590 -17.175
4 1HA GLY 1 2HA GLY 1 -10.794 -0.785 -19.961
5 2HA GLY 1 1HA GLY 1 -11.768 -0.483 -18.530
6 H SER 2 H SER 2 -10.041 1.071 -20.692
7 HA SER 2 HA SER 2 -8.389 2.737 -19.034
8 1HB SER 2 2HB SER 2 -9.072 3.871 -21.625
9 2HB SER 2 1HB SER 2 -7.502 3.360 -21.007
10 HG SER 2 HG SER 2 -7.671 1.721 -22.289
11 H MET 3 H MET 3 -9.829 3.567 -17.472
12 HA MET 3 HA MET 3 -11.913 5.374 -18.486
13 1HB MET 3 2HB MET 3 -12.228 3.504 -16.631
14 2HB MET 3 1HB MET 3 -11.610 4.772 -15.582
15 1HG MET 3 2HG MET 3 -13.550 6.020 -17.126
16 2HG MET 3 1HG MET 3 -14.230 4.442 -16.731
17 1HE MET 3 1HE MET 3 -14.706 8.020 -14.638
18 2HE MET 3 2HE MET 3 -12.948 7.940 -14.520
19 3HE MET 3 3HE MET 3 -13.736 7.763 -16.088
20 H SER 4 H SER 4 -9.594 5.301 -15.782
21 HA SER 4 HA SER 4 -8.916 8.095 -16.371
22 1HB SER 4 2HB SER 4 -8.877 7.738 -13.541
23 2HB SER 4 1HB SER 4 -9.900 8.820 -14.486
24 HG SER 4 HG SER 4 -10.800 6.933 -13.069
25 H THR 5 H THR 5 -7.575 5.609 -16.919
26 HA THR 5 HA THR 5 -5.774 4.703 -15.033
27 HB THR 5 HB THR 5 -4.509 4.534 -17.570
28 HG1 THR 5 1HG THR 5 -6.212 4.878 -18.816
29 1HG2 THR 5 1HG2 THR 5 -6.225 2.592 -16.023
30 2HG2 THR 5 2HG2 THR 5 -4.474 2.775 -15.910
31 3HG2 THR 5 3HG2 THR 5 -5.205 2.160 -17.395
32 H LYS 6 H LYS 6 -4.230 5.715 -13.984
33 HA LYS 6 HA LYS 6 -2.757 7.895 -15.286
34 1HB LYS 6 2HB LYS 6 -3.657 7.425 -12.613
35 2HB LYS 6 1HB LYS 6 -1.900 7.497 -12.600
36 1HG LYS 6 2HG LYS 6 -2.542 9.693 -12.228
37 2HG LYS 6 1HG LYS 6 -2.182 9.660 -13.955
38 1HD LYS 6 2HD LYS 6 -4.956 9.010 -13.243
39 2HD LYS 6 1HD LYS 6 -4.458 10.666 -12.886
40 1HE LYS 6 2HE LYS 6 -4.089 11.172 -15.104
41 2HE LYS 6 1HE LYS 6 -3.795 9.490 -15.547
42 1HZ LYS 6 1HZ LYS 6 -5.958 10.514 -16.321
43 2HZ LYS 6 2HZ LYS 6 -6.467 10.454 -14.702
44 3HZ LYS 6 3HZ LYS 6 -6.075 9.022 -15.521
45 H ASN 7 H ASN 7 -0.332 7.909 -14.338
46 HA ASN 7 HA ASN 7 0.848 5.478 -15.389
47 1HB ASN 7 2HB ASN 7 1.635 8.010 -15.636
48 2HB ASN 7 1HB ASN 7 2.524 7.623 -14.167
49 1HD2 ASN 7 1HD2 ASN 7 3.869 8.305 -16.418
50 2HD2 ASN 7 2HD2 ASN 7 4.689 6.918 -17.062
51 H PHE 8 H PHE 8 2.930 4.752 -14.121
52 HA PHE 8 HA PHE 8 1.907 3.709 -11.639
53 1HB PHE 8 2HB PHE 8 3.630 2.124 -11.752
54 2HB PHE 8 1HB PHE 8 3.241 2.433 -13.440
55 HD1 PHE 8 1HD PHE 8 5.819 2.214 -11.055
56 HD2 PHE 8 2HD PHE 8 4.692 4.258 -14.613
57 HE1 PHE 8 1HE PHE 8 8.178 2.777 -11.473
58 HE2 PHE 8 2HE PHE 8 7.048 4.824 -15.040
59 HZ PHE 8 HZ PHE 8 8.795 4.085 -13.468
60 H ARG 9 H ARG 9 3.066 6.588 -12.143
61 HA ARG 9 HA ARG 9 5.314 6.813 -10.444
62 1HB ARG 9 2HB ARG 9 5.075 9.178 -10.656
63 2HB ARG 9 1HB ARG 9 4.650 8.477 -12.209
64 1HG ARG 9 2HG ARG 9 2.777 9.660 -12.153
65 2HG ARG 9 1HG ARG 9 2.246 8.669 -10.792
66 1HD ARG 9 2HD ARG 9 3.490 10.239 -9.282
67 2HD ARG 9 1HD ARG 9 3.762 11.270 -10.683
68 HE ARG 9 HE ARG 9 1.586 11.982 -10.555
69 1HH1 ARG 9 2HH1 ARG 9 1.911 9.083 -8.618
70 2HH1 ARG 9 1HH1 ARG 9 0.439 9.346 -7.738
71 1HH2 ARG 9 2HH2 ARG 9 -0.396 12.307 -9.445
72 2HH2 ARG 9 1HH2 ARG 9 -0.895 11.152 -8.244
73 H VAL 10 H VAL 10 5.471 7.093 -8.298
74 HA VAL 10 HA VAL 10 3.116 6.502 -6.745
75 HB VAL 10 HB VAL 10 5.742 7.158 -5.472
76 1HG1 VAL 10 1HG1 VAL 10 3.270 5.923 -4.720
77 2HG1 VAL 10 2HG1 VAL 10 4.595 4.781 -4.496
78 3HG1 VAL 10 3HG1 VAL 10 4.647 6.361 -3.711
79 1HG2 VAL 10 1HG2 VAL 10 6.207 5.722 -7.472
80 2HG2 VAL 10 2HG2 VAL 10 6.652 5.000 -5.927
81 3HG2 VAL 10 3HG2 VAL 10 5.180 4.487 -6.746
82 H SER 11 H SER 11 1.967 7.870 -5.553
83 HA SER 11 HA SER 11 2.596 10.701 -5.716
84 1HB SER 11 2HB SER 11 0.211 10.006 -4.189
85 2HB SER 11 1HB SER 11 0.365 10.998 -5.638
86 HG SER 11 HG SER 11 -0.434 8.404 -5.378
87 H ASP 12 H ASP 12 2.665 12.071 -3.866
88 HA ASP 12 HA ASP 12 3.647 10.743 -1.465
89 1HB ASP 12 2HB ASP 12 3.761 13.360 -0.807
90 2HB ASP 12 1HB ASP 12 5.042 12.524 -1.675
91 H GLY 13 H GLY 13 2.671 10.920 0.553
92 1HA GLY 13 1HA GLY 13 0.847 11.252 2.001
93 2HA GLY 13 2HA GLY 13 -0.008 12.056 0.689
94 H ASP 14 H ASP 14 1.563 9.091 0.139
95 HA ASP 14 HA ASP 14 -0.974 7.831 -0.546
96 1HB ASP 14 2HB ASP 14 0.349 6.286 -1.844
97 2HB ASP 14 1HB ASP 14 0.932 7.914 -2.181
98 H TRP 15 H TRP 15 -0.535 5.248 -0.392
99 HA TRP 15 HA TRP 15 0.643 4.414 2.097
100 1HB TRP 15 2HB TRP 15 -1.467 3.334 2.918
101 2HB TRP 15 1HB TRP 15 -1.485 5.088 2.996
102 HD1 TRP 15 HD TRP 15 -2.885 6.281 0.807
103 HE1 TRP 15 1HE TRP 15 -5.133 5.512 -0.189
104 HE3 TRP 15 3HE TRP 15 -2.932 1.442 2.483
105 HZ2 TRP 15 2HZ TRP 15 -6.716 3.177 -0.257
106 HZ3 TRP 15 3HZ TRP 15 -4.842 0.012 1.907
107 HH2 TRP 15 HH TRP 15 -6.697 0.863 0.562
108 H ILE 16 H ILE 16 0.323 1.949 2.328
109 HA ILE 16 HA ILE 16 0.028 0.730 -0.325
110 HB ILE 16 HB ILE 16 1.259 -1.227 0.650
111 1HG1 ILE 16 2HG1 ILE 16 2.738 0.177 2.636
112 1HG2 ILE 16 1HG2 ILE 16 3.515 0.113 0.684
113 2HG2 ILE 16 2HG2 ILE 16 2.583 -0.079 -0.800
114 3HG2 ILE 16 3HG2 ILE 16 2.476 1.421 0.120
115 1HD1 ILE 16 1HD1 ILE 16 1.271 -1.673 4.000
116 2HD1 ILE 16 2HD1 ILE 16 1.278 -2.336 2.365
117 3HD1 ILE 16 3HD1 ILE 16 2.804 -1.985 3.185
118 H CYS 17 H CYS 17 -1.103 -1.217 -0.471
119 HA CYS 17 HA CYS 17 -3.531 -1.474 0.633
120 1HB CYS 17 2HB CYS 17 -1.618 -3.614 -0.262
121 2HB CYS 17 1HB CYS 17 -3.311 -3.932 0.093
122 HA PRO 18 HA PRO 18 -3.396 -2.307 4.873
123 1HB PRO 18 2HB PRO 18 -5.518 -4.336 4.494
124 2HB PRO 18 1HB PRO 18 -5.520 -2.870 5.478
125 1HG PRO 18 2HG PRO 18 -6.907 -2.997 3.214
126 2HG PRO 18 1HG PRO 18 -6.063 -1.509 3.690
127 1HD PRO 18 2HD PRO 18 -5.267 -3.562 1.661
128 2HD PRO 18 1HD PRO 18 -5.116 -1.794 1.596
129 H ASP 19 H ASP 19 -3.261 -5.110 2.757
130 HA ASP 19 HA ASP 19 -1.930 -6.566 4.943
131 1HB ASP 19 2HB ASP 19 -4.268 -7.384 4.055
132 2HB ASP 19 1HB ASP 19 -3.296 -8.079 2.760
133 H LYS 20 H LYS 20 -0.738 -8.570 3.898
134 HA LYS 20 HA LYS 20 1.245 -7.350 2.153
135 1HB LYS 20 2HB LYS 20 2.420 -9.630 2.679
136 2HB LYS 20 1HB LYS 20 2.359 -8.369 3.903
137 1HG LYS 20 2HG LYS 20 0.027 -9.993 4.145
138 2HG LYS 20 1HG LYS 20 1.451 -11.034 4.090
139 1HD LYS 20 2HD LYS 20 1.892 -10.524 6.209
140 2HD LYS 20 1HD LYS 20 2.066 -8.827 5.759
141 1HE LYS 20 2HE LYS 20 0.408 -9.104 7.538
142 2HE LYS 20 1HE LYS 20 -0.328 -8.487 6.061
143 1HZ LYS 20 1HZ LYS 20 -1.506 -10.378 5.737
144 2HZ LYS 20 2HZ LYS 20 -1.370 -10.474 7.427
145 3HZ LYS 20 3HZ LYS 20 -0.332 -11.381 6.444
146 H LYS 21 H LYS 21 -1.197 -9.844 2.155
147 HA LYS 21 HA LYS 21 -0.408 -11.063 -0.303
148 1HB LYS 21 2HB LYS 21 -3.206 -10.948 0.834
149 2HB LYS 21 1HB LYS 21 -2.555 -12.144 -0.278
150 1HG LYS 21 2HG LYS 21 -1.579 -11.767 2.546
151 2HG LYS 21 1HG LYS 21 -2.805 -12.941 2.064
152 1HD LYS 21 2HD LYS 21 -0.965 -13.661 0.327
153 2HD LYS 21 1HD LYS 21 0.122 -12.899 1.490
154 1HE LYS 21 2HE LYS 21 -1.481 -14.416 3.106
155 2HE LYS 21 1HE LYS 21 -1.354 -15.422 1.663
156 1HZ LYS 21 1HZ LYS 21 1.113 -15.077 1.831
157 2HZ LYS 21 2HZ LYS 21 0.427 -16.012 3.070
158 3HZ LYS 21 3HZ LYS 21 0.851 -14.396 3.362
159 H CYS 22 H CYS 22 -2.139 -8.244 0.600
160 HA CYS 22 HA CYS 22 -3.070 -7.577 -2.037
161 1HB CYS 22 2HB CYS 22 -3.558 -6.739 0.601
162 2HB CYS 22 1HB CYS 22 -2.784 -5.363 -0.171
163 H GLY 23 H GLY 23 -1.133 -5.499 0.019
164 1HA GLY 23 1HA GLY 23 0.806 -4.337 -0.288
165 2HA GLY 23 2HA GLY 23 1.396 -5.809 -1.035
166 H ASN 24 H ASN 24 -1.070 -3.490 -2.176
167 HA ASN 24 HA ASN 24 0.567 -3.051 -4.565
168 1HB ASN 24 2HB ASN 24 -1.562 -3.782 -5.182
169 2HB ASN 24 1HB ASN 24 -2.356 -2.866 -3.928
170 1HD2 ASN 24 1HD2 ASN 24 -2.970 -0.820 -4.277
171 2HD2 ASN 24 2HD2 ASN 24 -2.840 -0.016 -5.803
172 H VAL 25 H VAL 25 0.853 -0.920 -5.369
173 HA VAL 25 HA VAL 25 0.948 1.144 -3.338
174 HB VAL 25 HB VAL 25 1.744 2.523 -5.426
175 1HG1 VAL 25 1HG1 VAL 25 4.045 1.603 -5.103
176 2HG1 VAL 25 2HG1 VAL 25 3.202 2.021 -3.611
177 3HG1 VAL 25 3HG1 VAL 25 3.332 0.332 -4.107
178 1HG2 VAL 25 1HG2 VAL 25 1.200 1.052 -7.199
179 2HG2 VAL 25 2HG2 VAL 25 2.953 0.981 -7.031
180 3HG2 VAL 25 3HG2 VAL 25 1.953 -0.322 -6.390
181 H ASN 26 H ASN 26 -0.852 2.193 -2.879
182 HA ASN 26 HA ASN 26 -2.972 2.425 -4.858
183 1HB ASN 26 2HB ASN 26 -3.162 3.568 -2.089
184 2HB ASN 26 1HB ASN 26 -4.423 2.850 -3.088
185 1HD2 ASN 26 1HD2 ASN 26 -4.740 0.670 -3.036
186 2HD2 ASN 26 2HD2 ASN 26 -3.919 -0.402 -1.950
187 H PHE 27 H PHE 27 -4.090 4.491 -5.160
188 HA PHE 27 HA PHE 27 -2.451 6.458 -6.183
189 1HB PHE 27 2HB PHE 27 -4.843 6.230 -6.728
190 2HB PHE 27 1HB PHE 27 -5.264 6.808 -5.123
191 HD1 PHE 27 1HD PHE 27 -2.941 7.964 -7.819
192 HD2 PHE 27 2HD PHE 27 -6.117 8.918 -5.153
193 HE1 PHE 27 1HE PHE 27 -2.931 10.282 -8.645
194 HE2 PHE 27 2HE PHE 27 -6.115 11.237 -5.970
195 HZ PHE 27 HZ PHE 27 -4.520 11.922 -7.719
196 H ALA 28 H ALA 28 -4.532 7.188 -3.409
197 HA ALA 28 HA ALA 28 -2.589 7.977 -1.581
198 1HB ALA 28 1HB ALA 28 -2.858 9.870 -3.682
199 2HB ALA 28 2HB ALA 28 -3.560 10.574 -2.224
200 3HB ALA 28 3HB ALA 28 -1.894 9.991 -2.209
201 H ARG 29 H ARG 29 -5.341 9.971 -2.548
202 HA ARG 29 HA ARG 29 -6.583 9.571 0.026
203 1HB ARG 29 2HB ARG 29 -7.138 11.305 -2.358
204 2HB ARG 29 1HB ARG 29 -8.389 11.066 -1.144
205 1HG ARG 29 2HG ARG 29 -7.467 12.803 -0.109
206 2HG ARG 29 1HG ARG 29 -6.210 11.669 0.384
207 1HD ARG 29 2HD ARG 29 -5.366 12.381 -2.104
208 2HD ARG 29 1HD ARG 29 -6.119 13.872 -1.544
209 HE ARG 29 HE ARG 29 -4.211 12.563 0.244
210 1HH1 ARG 29 2HH1 ARG 29 -4.942 15.160 -2.007
211 2HH1 ARG 29 1HH1 ARG 29 -3.577 16.125 -1.518
212 1HH2 ARG 29 2HH2 ARG 29 -2.427 13.836 0.872
213 2HH2 ARG 29 1HH2 ARG 29 -2.153 15.380 0.116
214 H ARG 30 H ARG 30 -6.474 7.175 -1.023
215 HA ARG 30 HA ARG 30 -9.137 6.612 -2.136
216 1HB ARG 30 2HB ARG 30 -6.483 5.242 -2.358
217 2HB ARG 30 1HB ARG 30 -7.945 4.278 -2.480
218 1HG ARG 30 2HG ARG 30 -7.750 6.715 -4.160
219 2HG ARG 30 1HG ARG 30 -6.767 5.317 -4.602
220 1HD ARG 30 2HD ARG 30 -8.812 5.127 -5.792
221 2HD ARG 30 1HD ARG 30 -8.863 3.937 -4.492
222 HE ARG 30 HE ARG 30 -10.206 6.558 -4.276
223 1HH1 ARG 30 2HH1 ARG 30 -10.293 3.055 -4.136
224 2HH1 ARG 30 1HH1 ARG 30 -11.842 3.005 -3.343
225 1HH2 ARG 30 2HH2 ARG 30 -12.253 6.480 -3.293
226 2HH2 ARG 30 1HH2 ARG 30 -12.968 4.947 -2.881
227 H THR 31 H THR 31 -10.573 5.619 -0.853
228 HA THR 31 HA THR 31 -9.708 4.785 1.791
229 HB THR 31 HB THR 31 -12.498 4.373 1.429
230 HG1 THR 31 1HG THR 31 -13.154 6.069 0.304
231 1HG2 THR 31 1HG2 THR 31 -12.682 5.771 3.265
232 2HG2 THR 31 2HG2 THR 31 -11.344 6.798 2.747
233 3HG2 THR 31 3HG2 THR 31 -11.020 5.198 3.417
234 H SER 32 H SER 32 -9.680 3.328 -1.034
235 HA SER 32 HA SER 32 -10.074 0.698 0.157
236 1HB SER 32 2HB SER 32 -10.947 0.735 -2.626
237 2HB SER 32 1HB SER 32 -11.752 0.055 -1.212
238 HG SER 32 HG SER 32 -12.897 1.828 -0.977
239 H CYS 33 H CYS 33 -8.871 -0.963 -0.920
240 HA CYS 33 HA CYS 33 -6.362 -0.279 -1.904
241 1HB CYS 33 2HB CYS 33 -6.385 -2.451 -1.173
242 2HB CYS 33 1HB CYS 33 -8.010 -2.752 -1.775
243 H ASP 34 H ASP 34 -5.512 -0.647 -4.089
244 HA ASP 34 HA ASP 34 -7.397 0.634 -5.921
245 1HB ASP 34 2HB ASP 34 -4.757 1.266 -5.150
246 2HB ASP 34 1HB ASP 34 -4.682 0.777 -6.839
247 H ARG 35 H ARG 35 -6.052 -2.405 -5.456
248 HA ARG 35 HA ARG 35 -6.419 -3.033 -8.278
249 1HB ARG 35 2HB ARG 35 -4.222 -2.685 -8.639
250 2HB ARG 35 1HB ARG 35 -3.797 -2.883 -6.948
251 1HG ARG 35 2HG ARG 35 -3.328 -5.073 -7.182
252 2HG ARG 35 1HG ARG 35 -4.619 -5.337 -8.352
253 1HD ARG 35 2HD ARG 35 -2.437 -5.659 -9.385
254 2HD ARG 35 1HD ARG 35 -3.268 -4.271 -10.088
255 HE ARG 35 HE ARG 35 -1.799 -2.843 -8.793
256 1HH1 ARG 35 2HH1 ARG 35 -0.887 -6.217 -8.971
257 2HH1 ARG 35 1HH1 ARG 35 0.798 -5.913 -8.696
258 1HH2 ARG 35 2HH2 ARG 35 0.408 -2.426 -8.442
259 2HH2 ARG 35 1HH2 ARG 35 1.541 -3.745 -8.396
260 H CYS 36 H CYS 36 -6.062 -4.288 -4.957
261 HA CYS 36 HA CYS 36 -6.387 -6.982 -6.117
262 1HB CYS 36 2HB CYS 36 -4.844 -7.337 -3.830
263 2HB CYS 36 1HB CYS 36 -4.290 -7.431 -5.500
264 H GLY 37 H GLY 37 -7.194 -4.850 -3.475
265 1HA GLY 37 1HA GLY 37 -8.567 -7.111 -2.165
266 2HA GLY 37 2HA GLY 37 -7.731 -5.863 -1.261
267 H ARG 38 H ARG 38 -8.822 -4.098 -0.656
268 HA ARG 38 HA ARG 38 -11.254 -3.202 -1.771
269 1HB ARG 38 2HB ARG 38 -11.458 -5.483 0.023
270 2HB ARG 38 1HB ARG 38 -12.344 -4.096 0.635
271 1HG ARG 38 2HG ARG 38 -12.679 -5.313 -2.085
272 2HG ARG 38 1HG ARG 38 -13.765 -5.521 -0.707
273 1HD ARG 38 2HD ARG 38 -14.105 -3.063 -0.680
274 2HD ARG 38 1HD ARG 38 -13.142 -2.952 -2.155
275 HE ARG 38 HE ARG 38 -14.987 -4.725 -2.862
276 1HH1 ARG 38 2HH1 ARG 38 -15.281 -1.654 -1.206
277 2HH1 ARG 38 1HH1 ARG 38 -16.856 -1.308 -1.868
278 1HH2 ARG 38 2HH2 ARG 38 -17.055 -4.285 -3.725
279 2HH2 ARG 38 1HH2 ARG 38 -17.869 -2.803 -3.300
280 H GLU 39 H GLU 39 -12.513 -2.524 0.731
281 HA GLU 39 HA GLU 39 -11.638 0.001 1.148
282 1HB GLU 39 2HB GLU 39 -13.298 -1.898 2.630
283 2HB GLU 39 1HB GLU 39 -12.598 -0.639 3.635
284 1HG GLU 39 2HG GLU 39 -14.910 -0.253 2.596
285 2HG GLU 39 1HG GLU 39 -13.727 1.050 2.535
286 H LYS 40 H LYS 40 -10.468 1.119 2.648
287 HA LYS 40 HA LYS 40 -7.929 0.147 3.298
288 1HB LYS 40 2HB LYS 40 -8.956 2.594 3.102
289 2HB LYS 40 1HB LYS 40 -9.084 2.424 4.844
290 1HG LYS 40 2HG LYS 40 -6.690 2.016 4.992
291 2HG LYS 40 1HG LYS 40 -6.551 2.150 3.239
292 1HD LYS 40 2HD LYS 40 -7.434 4.469 3.401
293 2HD LYS 40 1HD LYS 40 -7.407 4.322 5.158
294 1HE LYS 40 2HE LYS 40 -4.991 3.964 3.397
295 2HE LYS 40 1HE LYS 40 -5.429 5.491 4.161
296 1HZ LYS 40 1HZ LYS 40 -5.467 3.778 6.241
297 2HZ LYS 40 2HZ LYS 40 -4.147 4.750 5.816
298 3HZ LYS 40 3HZ LYS 40 -4.203 3.141 5.302
299 H THR 41 H THR 41 -8.049 -1.730 4.498
300 HA THR 41 HA THR 41 -9.487 -1.813 6.997
301 HB THR 41 HB THR 41 -7.722 -4.023 6.724
302 HG1 THR 41 1HG THR 41 -9.199 -3.425 4.350
303 1HG2 THR 41 1HG2 THR 41 -10.489 -4.347 5.813
304 2HG2 THR 41 2HG2 THR 41 -10.330 -3.574 7.391
305 3HG2 THR 41 3HG2 THR 41 -9.626 -5.167 7.111
306 H THR 42 H THR 42 -6.541 -0.598 6.056
307 HA THR 42 HA THR 42 -4.992 -1.314 8.372
308 HB THR 42 HB THR 42 -3.875 0.977 7.187
309 HG1 THR 42 1HG THR 42 -3.961 0.482 4.975
310 1HG2 THR 42 1HG2 THR 42 -2.773 -1.372 6.019
311 2HG2 THR 42 2HG2 THR 42 -3.224 -1.745 7.683
312 3HG2 THR 42 3HG2 THR 42 -2.132 -0.401 7.346
313 H GLY 43 H GLY 43 -7.487 0.856 7.783
314 1HA GLY 43 1HA GLY 43 -8.427 2.356 9.315
315 2HA GLY 43 2HA GLY 43 -6.929 2.316 10.238
316 HA PRO 44 HA PRO 44 -6.868 6.349 8.064
317 1HB PRO 44 2HB PRO 44 -5.515 7.327 10.450
318 2HB PRO 44 1HB PRO 44 -7.073 7.816 9.780
319 1HG PRO 44 2HG PRO 44 -6.839 6.452 12.117
320 2HG PRO 44 1HG PRO 44 -8.243 6.299 11.044
321 1HD PRO 44 2HD PRO 44 -5.878 4.477 11.337
322 2HD PRO 44 1HD PRO 44 -7.601 4.069 11.179
323 H ILE 45 H ILE 45 -4.668 8.007 8.719
324 HA ILE 45 HA ILE 45 -2.490 6.487 7.511
325 HB ILE 45 HB ILE 45 -2.494 9.440 8.139
326 1HG1 ILE 45 2HG1 ILE 45 -4.430 8.871 6.695
327 1HG2 ILE 45 1HG2 ILE 45 -0.310 8.836 7.678
328 2HG2 ILE 45 2HG2 ILE 45 -0.784 7.625 6.488
329 3HG2 ILE 45 3HG2 ILE 45 -0.901 9.340 6.094
330 1HD1 ILE 45 1HD1 ILE 45 -2.824 7.001 5.505
331 2HD1 ILE 45 2HD1 ILE 45 -4.366 7.587 4.881
332 3HD1 ILE 45 3HD1 ILE 45 -2.857 8.306 4.317
Start of MODEL 10
1 1H GLY 1 1H GLY 1 17.347 14.433 13.212
2 2H GLY 1 2H GLY 1 18.551 13.242 13.314
3 3H GLY 1 3H GLY 1 16.919 12.811 13.450
4 1HA GLY 1 2HA GLY 1 17.459 14.216 11.022
5 2HA GLY 1 1HA GLY 1 18.418 12.749 11.173
6 H SER 2 H SER 2 17.039 12.201 9.258
7 HA SER 2 HA SER 2 14.276 11.536 9.855
8 1HB SER 2 2HB SER 2 14.909 10.573 7.307
9 2HB SER 2 1HB SER 2 14.108 12.097 7.688
10 HG SER 2 HG SER 2 16.078 12.219 6.355
11 H MET 3 H MET 3 17.036 10.076 10.605
12 HA MET 3 HA MET 3 16.467 7.395 9.680
13 1HB MET 3 2HB MET 3 18.631 8.608 11.376
14 2HB MET 3 1HB MET 3 18.451 6.865 11.247
15 1HG MET 3 2HG MET 3 19.835 7.050 9.516
16 2HG MET 3 1HG MET 3 18.413 7.607 8.634
17 1HE MET 3 1HE MET 3 19.873 8.572 6.931
18 2HE MET 3 2HE MET 3 20.787 10.074 7.064
19 3HE MET 3 3HE MET 3 21.493 8.558 7.624
20 H SER 4 H SER 4 14.276 7.934 10.889
21 HA SER 4 HA SER 4 14.396 6.304 13.316
22 1HB SER 4 2HB SER 4 12.463 8.570 13.358
23 2HB SER 4 1HB SER 4 13.315 7.793 14.691
24 HG SER 4 HG SER 4 15.243 8.849 13.510
25 H THR 5 H THR 5 11.983 8.081 11.377
26 HA THR 5 HA THR 5 10.300 5.690 11.368
27 HB THR 5 HB THR 5 9.201 8.005 9.990
28 HG1 THR 5 1HG THR 5 9.252 8.628 12.666
29 1HG2 THR 5 1HG2 THR 5 7.343 7.622 11.504
30 2HG2 THR 5 2HG2 THR 5 8.338 6.560 12.499
31 3HG2 THR 5 3HG2 THR 5 7.910 6.082 10.856
32 H LYS 6 H LYS 6 11.857 4.638 9.900
33 HA LYS 6 HA LYS 6 11.737 5.606 7.128
34 1HB LYS 6 2HB LYS 6 13.577 3.705 8.569
35 2HB LYS 6 1HB LYS 6 13.491 3.734 6.814
36 1HG LYS 6 2HG LYS 6 13.799 6.403 7.799
37 2HG LYS 6 1HG LYS 6 15.044 5.358 8.490
38 1HD LYS 6 2HD LYS 6 14.951 4.579 5.847
39 2HD LYS 6 1HD LYS 6 14.721 6.326 5.763
40 1HE LYS 6 2HE LYS 6 16.903 6.607 6.059
41 2HE LYS 6 1HE LYS 6 16.764 5.855 7.648
42 1HZ LYS 6 1HZ LYS 6 17.010 4.209 5.207
43 2HZ LYS 6 2HZ LYS 6 17.360 3.792 6.812
44 3HZ LYS 6 3HZ LYS 6 18.383 4.851 5.969
45 H ASN 7 H ASN 7 9.598 4.187 8.675
46 HA ASN 7 HA ASN 7 9.485 1.539 7.565
47 1HB ASN 7 2HB ASN 7 8.600 1.847 9.782
48 2HB ASN 7 1HB ASN 7 7.537 3.135 9.227
49 1HD2 ASN 7 1HD2 ASN 7 5.518 2.587 8.947
50 2HD2 ASN 7 2HD2 ASN 7 4.933 1.002 8.577
51 H PHE 8 H PHE 8 8.094 4.635 6.916
52 HA PHE 8 HA PHE 8 6.432 3.489 4.794
53 1HB PHE 8 2HB PHE 8 5.972 5.559 6.731
54 2HB PHE 8 1HB PHE 8 5.845 6.241 5.114
55 HD1 PHE 8 1HD PHE 8 3.496 6.677 5.292
56 HD2 PHE 8 2HD PHE 8 5.018 2.738 5.815
57 HE1 PHE 8 1HE PHE 8 1.217 5.774 5.093
58 HE2 PHE 8 2HE PHE 8 2.742 1.828 5.610
59 HZ PHE 8 HZ PHE 8 0.837 3.346 5.248
60 H ARG 9 H ARG 9 7.478 3.444 2.951
61 HA ARG 9 HA ARG 9 9.272 5.626 2.199
62 1HB ARG 9 2HB ARG 9 8.776 3.494 0.224
63 2HB ARG 9 1HB ARG 9 10.299 4.156 0.803
64 1HG ARG 9 2HG ARG 9 9.829 2.831 2.944
65 2HG ARG 9 1HG ARG 9 8.632 1.969 1.978
66 1HD ARG 9 2HD ARG 9 10.599 1.687 0.297
67 2HD ARG 9 1HD ARG 9 11.609 2.022 1.703
68 HE ARG 9 HE ARG 9 10.122 0.106 2.705
69 1HH1 ARG 9 2HH1 ARG 9 11.605 0.292 -0.475
70 2HH1 ARG 9 1HH1 ARG 9 11.670 -1.437 -0.678
71 1HH2 ARG 9 2HH2 ARG 9 10.158 -2.157 2.411
72 2HH2 ARG 9 1HH2 ARG 9 10.828 -2.825 0.946
73 H VAL 10 H VAL 10 6.602 6.263 2.497
74 HA VAL 10 HA VAL 10 5.873 7.084 -0.195
75 HB VAL 10 HB VAL 10 4.692 4.857 0.689
76 1HG1 VAL 10 1HG1 VAL 10 3.483 5.293 2.528
77 2HG1 VAL 10 2HG1 VAL 10 3.380 7.019 2.182
78 3HG1 VAL 10 3HG1 VAL 10 2.297 5.890 1.367
79 1HG2 VAL 10 1HG2 VAL 10 4.375 5.858 -1.502
80 2HG2 VAL 10 2HG2 VAL 10 2.835 5.335 -0.821
81 3HG2 VAL 10 3HG2 VAL 10 3.266 7.043 -0.812
82 H SER 11 H SER 11 3.954 8.689 -0.040
83 HA SER 11 HA SER 11 4.796 10.734 1.743
84 1HB SER 11 2HB SER 11 2.251 11.183 0.376
85 2HB SER 11 1HB SER 11 3.764 12.085 0.274
86 HG SER 11 HG SER 11 2.755 10.370 -1.480
87 H ASP 12 H ASP 12 2.487 12.085 2.404
88 HA ASP 12 HA ASP 12 1.944 10.849 4.915
89 1HB ASP 12 2HB ASP 12 1.940 13.430 3.954
90 2HB ASP 12 1HB ASP 12 0.226 13.106 4.199
91 H GLY 13 H GLY 13 -0.210 11.796 2.221
92 1HA GLY 13 1HA GLY 13 -2.418 10.387 3.498
93 2HA GLY 13 2HA GLY 13 -2.507 11.374 2.048
94 H ASP 14 H ASP 14 0.050 9.589 1.439
95 HA ASP 14 HA ASP 14 -1.356 7.745 -0.258
96 1HB ASP 14 2HB ASP 14 1.604 8.040 0.319
97 2HB ASP 14 1HB ASP 14 0.918 7.000 -0.924
98 H TRP 15 H TRP 15 -0.911 5.395 -0.199
99 HA TRP 15 HA TRP 15 0.151 4.267 2.207
100 1HB TRP 15 2HB TRP 15 -1.884 3.229 3.038
101 2HB TRP 15 1HB TRP 15 -2.073 4.976 3.009
102 HD1 TRP 15 HD TRP 15 -3.459 5.873 0.653
103 HE1 TRP 15 1HE TRP 15 -5.623 4.859 -0.310
104 HE3 TRP 15 3HE TRP 15 -3.179 1.233 2.763
105 HZ2 TRP 15 2HZ TRP 15 -7.029 2.397 -0.180
106 HZ3 TRP 15 3HZ TRP 15 -4.944 -0.385 2.317
107 HH2 TRP 15 HH TRP 15 -6.831 0.170 0.861
108 H ILE 16 H ILE 16 0.029 1.905 2.217
109 HA ILE 16 HA ILE 16 -0.330 0.771 -0.465
110 HB ILE 16 HB ILE 16 1.250 -0.994 0.240
111 1HG1 ILE 16 2HG1 ILE 16 2.518 0.434 2.402
112 1HG2 ILE 16 1HG2 ILE 16 3.248 0.269 -0.088
113 2HG2 ILE 16 2HG2 ILE 16 1.965 1.038 -1.021
114 3HG2 ILE 16 3HG2 ILE 16 2.482 1.739 0.514
115 1HD1 ILE 16 1HD1 ILE 16 2.144 -2.212 1.633
116 2HD1 ILE 16 2HD1 ILE 16 3.009 -1.620 3.054
117 3HD1 ILE 16 3HD1 ILE 16 1.305 -2.054 3.176
118 H CYS 17 H CYS 17 -1.092 -1.492 -0.450
119 HA CYS 17 HA CYS 17 -3.518 -1.804 0.733
120 1HB CYS 17 2HB CYS 17 -2.572 -3.224 -1.111
121 2HB CYS 17 1HB CYS 17 -1.650 -4.094 0.101
122 HA PRO 18 HA PRO 18 -2.682 -2.758 4.931
123 1HB PRO 18 2HB PRO 18 -5.349 -3.886 5.185
124 2HB PRO 18 1HB PRO 18 -4.698 -2.397 5.874
125 1HG PRO 18 2HG PRO 18 -6.549 -2.374 3.930
126 2HG PRO 18 1HG PRO 18 -5.278 -1.137 4.047
127 1HD PRO 18 2HD PRO 18 -5.350 -3.582 2.292
128 2HD PRO 18 1HD PRO 18 -4.939 -1.911 1.861
129 H ASP 19 H ASP 19 -3.390 -5.008 2.548
130 HA ASP 19 HA ASP 19 -3.270 -7.323 4.366
131 1HB ASP 19 2HB ASP 19 -5.137 -6.786 2.477
132 2HB ASP 19 1HB ASP 19 -3.991 -7.723 1.524
133 H LYS 20 H LYS 20 -2.095 -9.225 3.537
134 HA LYS 20 HA LYS 20 0.449 -8.314 2.424
135 1HB LYS 20 2HB LYS 20 -0.289 -10.155 4.482
136 2HB LYS 20 1HB LYS 20 0.610 -11.026 3.245
137 1HG LYS 20 2HG LYS 20 2.384 -10.329 4.435
138 2HG LYS 20 1HG LYS 20 2.163 -8.849 3.501
139 1HD LYS 20 2HD LYS 20 0.813 -7.907 5.315
140 2HD LYS 20 1HD LYS 20 1.041 -9.383 6.254
141 1HE LYS 20 2HE LYS 20 3.588 -8.841 5.837
142 2HE LYS 20 1HE LYS 20 2.970 -7.206 5.614
143 1HZ LYS 20 1HZ LYS 20 2.984 -7.004 7.809
144 2HZ LYS 20 2HZ LYS 20 3.380 -8.640 8.025
145 3HZ LYS 20 3HZ LYS 20 1.754 -8.172 7.900
146 H LYS 21 H LYS 21 -2.106 -9.076 0.918
147 HA LYS 21 HA LYS 21 -1.038 -11.183 -0.794
148 1HB LYS 21 2HB LYS 21 -3.453 -9.938 -1.801
149 2HB LYS 21 1HB LYS 21 -3.162 -11.615 -1.371
150 1HG LYS 21 2HG LYS 21 -3.663 -11.115 0.959
151 2HG LYS 21 1HG LYS 21 -3.931 -9.421 0.542
152 1HD LYS 21 2HD LYS 21 -5.478 -11.672 -0.726
153 2HD LYS 21 1HD LYS 21 -6.000 -10.874 0.760
154 1HE LYS 21 2HE LYS 21 -5.311 -9.184 -1.592
155 2HE LYS 21 1HE LYS 21 -6.838 -10.065 -1.617
156 1HZ LYS 21 1HZ LYS 21 -6.063 -8.370 0.677
157 2HZ LYS 21 2HZ LYS 21 -7.602 -8.931 0.263
158 3HZ LYS 21 3HZ LYS 21 -6.861 -7.723 -0.674
159 H CYS 22 H CYS 22 -1.721 -7.754 -0.776
160 HA CYS 22 HA CYS 22 -0.749 -7.497 -3.517
161 1HB CYS 22 2HB CYS 22 -1.917 -5.396 -1.686
162 2HB CYS 22 1HB CYS 22 -1.571 -5.210 -3.396
163 H GLY 23 H GLY 23 -0.438 -5.403 -0.696
164 1HA GLY 23 1HA GLY 23 1.340 -4.136 0.046
165 2HA GLY 23 2HA GLY 23 2.430 -5.172 -0.887
166 H ASN 24 H ASN 24 -0.356 -3.896 -2.326
167 HA ASN 24 HA ASN 24 0.985 -2.768 -4.527
168 1HB ASN 24 2HB ASN 24 -1.222 -3.616 -4.844
169 2HB ASN 24 1HB ASN 24 -1.857 -2.671 -3.509
170 1HD2 ASN 24 1HD2 ASN 24 -2.515 -0.614 -3.851
171 2HD2 ASN 24 2HD2 ASN 24 -2.550 0.131 -5.409
172 H VAL 25 H VAL 25 1.404 -0.652 -5.072
173 HA VAL 25 HA VAL 25 1.315 1.277 -2.906
174 HB VAL 25 HB VAL 25 2.365 2.788 -4.752
175 1HG1 VAL 25 1HG1 VAL 25 4.591 1.839 -4.243
176 2HG1 VAL 25 2HG1 VAL 25 3.570 1.999 -2.814
177 3HG1 VAL 25 3HG1 VAL 25 3.800 0.417 -3.562
178 1HG2 VAL 25 1HG2 VAL 25 3.027 1.895 -6.711
179 2HG2 VAL 25 2HG2 VAL 25 3.493 0.365 -5.968
180 3HG2 VAL 25 3HG2 VAL 25 1.806 0.668 -6.375
181 H ASN 26 H ASN 26 -0.682 1.984 -2.574
182 HA ASN 26 HA ASN 26 -2.536 2.391 -4.731
183 1HB ASN 26 2HB ASN 26 -2.876 3.210 -1.839
184 2HB ASN 26 1HB ASN 26 -4.145 2.925 -3.027
185 1HD2 ASN 26 1HD2 ASN 26 -5.141 1.043 -2.813
186 2HD2 ASN 26 2HD2 ASN 26 -4.444 -0.409 -2.172
187 H PHE 27 H PHE 27 -3.726 4.473 -4.936
188 HA PHE 27 HA PHE 27 -1.924 6.503 -5.635
189 1HB PHE 27 2HB PHE 27 -4.231 6.086 -6.595
190 2HB PHE 27 1HB PHE 27 -4.884 6.897 -5.178
191 HD1 PHE 27 1HD PHE 27 -5.951 8.567 -6.582
192 HD2 PHE 27 2HD PHE 27 -1.730 8.031 -6.608
193 HE1 PHE 27 1HE PHE 27 -5.686 10.737 -7.712
194 HE2 PHE 27 2HE PHE 27 -1.458 10.200 -7.736
195 HZ PHE 27 HZ PHE 27 -3.437 11.554 -8.289
196 H ALA 28 H ALA 28 -4.614 7.309 -3.491
197 HA ALA 28 HA ALA 28 -3.207 7.940 -1.176
198 1HB ALA 28 1HB ALA 28 -3.781 10.595 -2.146
199 2HB ALA 28 2HB ALA 28 -2.280 9.953 -1.477
200 3HB ALA 28 3HB ALA 28 -2.620 9.789 -3.200
201 H ARG 29 H ARG 29 -5.615 9.578 -3.240
202 HA ARG 29 HA ARG 29 -7.518 9.798 -1.093
203 1HB ARG 29 2HB ARG 29 -7.492 10.467 -4.007
204 2HB ARG 29 1HB ARG 29 -9.042 10.360 -3.188
205 1HG ARG 29 2HG ARG 29 -6.760 12.185 -2.459
206 2HG ARG 29 1HG ARG 29 -8.267 12.648 -3.249
207 1HD ARG 29 2HD ARG 29 -8.138 11.381 -0.521
208 2HD ARG 29 1HD ARG 29 -8.139 13.123 -0.785
209 HE ARG 29 HE ARG 29 -10.334 11.699 -2.021
210 1HH1 ARG 29 2HH1 ARG 29 -9.197 13.479 0.767
211 2HH1 ARG 29 1HH1 ARG 29 -10.790 13.801 1.380
212 1HH2 ARG 29 2HH2 ARG 29 -12.426 12.133 -1.272
213 2HH2 ARG 29 1HH2 ARG 29 -12.651 13.031 0.204
214 H ARG 30 H ARG 30 -6.640 7.122 -1.617
215 HA ARG 30 HA ARG 30 -8.926 5.839 -2.923
216 1HB ARG 30 2HB ARG 30 -6.173 4.863 -2.172
217 2HB ARG 30 1HB ARG 30 -7.453 3.769 -2.676
218 1HG ARG 30 2HG ARG 30 -6.523 6.080 -4.355
219 2HG ARG 30 1HG ARG 30 -5.829 4.460 -4.461
220 1HD ARG 30 2HD ARG 30 -8.216 3.648 -4.812
221 2HD ARG 30 1HD ARG 30 -8.631 5.341 -5.084
222 HE ARG 30 HE ARG 30 -6.832 3.702 -6.754
223 1HH1 ARG 30 2HH1 ARG 30 -8.823 6.556 -6.298
224 2HH1 ARG 30 1HH1 ARG 30 -8.646 7.100 -7.940
225 1HH2 ARG 30 2HH2 ARG 30 -6.593 4.419 -8.906
226 2HH2 ARG 30 1HH2 ARG 30 -7.369 5.888 -9.426
227 H THR 31 H THR 31 -10.500 5.083 -1.703
228 HA THR 31 HA THR 31 -10.044 4.705 1.146
229 HB THR 31 HB THR 31 -12.666 4.123 0.824
230 HG1 THR 31 1HG THR 31 -12.883 6.160 -0.886
231 1HG2 THR 31 1HG2 THR 31 -11.157 6.270 1.785
232 2HG2 THR 31 2HG2 THR 31 -12.874 5.971 2.061
233 3HG2 THR 31 3HG2 THR 31 -12.360 6.993 0.718
234 H SER 32 H SER 32 -9.893 2.918 -1.623
235 HA SER 32 HA SER 32 -9.883 0.456 -0.073
236 1HB SER 32 2HB SER 32 -11.274 0.651 -2.758
237 2HB SER 32 1HB SER 32 -11.131 -0.784 -1.743
238 HG SER 32 HG SER 32 -12.710 -0.088 -0.502
239 H CYS 33 H CYS 33 -8.835 -1.313 -1.389
240 HA CYS 33 HA CYS 33 -6.315 -0.467 -2.254
241 1HB CYS 33 2HB CYS 33 -6.932 -2.728 -1.314
242 2HB CYS 33 1HB CYS 33 -7.606 -3.117 -2.891
243 H ASP 34 H ASP 34 -5.315 -0.734 -4.281
244 HA ASP 34 HA ASP 34 -7.063 -0.112 -6.544
245 1HB ASP 34 2HB ASP 34 -4.173 0.318 -5.908
246 2HB ASP 34 1HB ASP 34 -4.642 0.202 -7.598
247 H ARG 35 H ARG 35 -5.520 -2.679 -5.079
248 HA ARG 35 HA ARG 35 -5.335 -4.182 -7.605
249 1HB ARG 35 2HB ARG 35 -3.591 -4.003 -5.333
250 2HB ARG 35 1HB ARG 35 -4.141 -5.662 -5.525
251 1HG ARG 35 2HG ARG 35 -3.509 -5.036 -8.084
252 2HG ARG 35 1HG ARG 35 -2.334 -4.067 -7.195
253 1HD ARG 35 2HD ARG 35 -2.151 -6.774 -7.814
254 2HD ARG 35 1HD ARG 35 -1.121 -5.867 -6.706
255 HE ARG 35 HE ARG 35 -2.742 -6.522 -4.929
256 1HH1 ARG 35 2HH1 ARG 35 -2.454 -8.440 -7.850
257 2HH1 ARG 35 1HH1 ARG 35 -3.052 -9.891 -7.104
258 1HH2 ARG 35 2HH2 ARG 35 -3.538 -8.375 -3.959
259 2HH2 ARG 35 1HH2 ARG 35 -3.667 -9.863 -4.860
260 H CYS 36 H CYS 36 -6.195 -4.801 -4.142
261 HA CYS 36 HA CYS 36 -7.803 -7.040 -5.113
262 1HB CYS 36 2HB CYS 36 -7.942 -7.800 -2.796
263 2HB CYS 36 1HB CYS 36 -6.273 -7.560 -3.284
264 H GLY 37 H GLY 37 -8.192 -4.351 -2.827
265 1HA GLY 37 1HA GLY 37 -10.177 -2.912 -3.433
266 2HA GLY 37 2HA GLY 37 -11.073 -4.423 -3.455
267 H ARG 38 H ARG 38 -8.729 -4.517 -1.045
268 HA ARG 38 HA ARG 38 -10.618 -4.467 1.050
269 1HB ARG 38 2HB ARG 38 -7.702 -4.737 0.829
270 2HB ARG 38 1HB ARG 38 -8.248 -3.982 2.318
271 1HG ARG 38 2HG ARG 38 -9.271 -6.599 1.302
272 2HG ARG 38 1HG ARG 38 -7.986 -6.411 2.501
273 1HD ARG 38 2HD ARG 38 -9.437 -5.955 4.135
274 2HD ARG 38 1HD ARG 38 -10.348 -4.834 3.122
275 HE ARG 38 HE ARG 38 -10.724 -7.737 3.221
276 1HH1 ARG 38 2HH1 ARG 38 -11.935 -4.539 2.554
277 2HH1 ARG 38 1HH1 ARG 38 -13.541 -5.067 2.181
278 1HH2 ARG 38 2HH2 ARG 38 -12.850 -8.462 2.752
279 2HH2 ARG 38 1HH2 ARG 38 -14.067 -7.299 2.303
280 H GLU 39 H GLU 39 -10.882 -2.926 2.758
281 HA GLU 39 HA GLU 39 -11.058 -0.272 1.711
282 1HB GLU 39 2HB GLU 39 -11.599 -1.146 4.550
283 2HB GLU 39 1HB GLU 39 -12.234 0.271 3.726
284 1HG GLU 39 2HG GLU 39 -12.850 -2.559 2.916
285 2HG GLU 39 1HG GLU 39 -13.853 -1.598 4.000
286 H LYS 40 H LYS 40 -10.183 1.627 2.671
287 HA LYS 40 HA LYS 40 -7.441 1.508 3.312
288 1HB LYS 40 2HB LYS 40 -8.933 3.465 2.374
289 2HB LYS 40 1HB LYS 40 -9.131 3.867 4.074
290 1HG LYS 40 2HG LYS 40 -6.587 3.826 4.205
291 2HG LYS 40 1HG LYS 40 -6.620 3.833 2.444
292 1HD LYS 40 2HD LYS 40 -8.016 5.897 2.546
293 2HD LYS 40 1HD LYS 40 -7.765 5.917 4.294
294 1HE LYS 40 2HE LYS 40 -5.369 5.714 2.550
295 2HE LYS 40 1HE LYS 40 -6.206 7.265 2.611
296 1HZ LYS 40 1HZ LYS 40 -5.834 7.450 4.901
297 2HZ LYS 40 2HZ LYS 40 -4.349 6.920 4.268
298 3HZ LYS 40 3HZ LYS 40 -5.375 5.823 5.061
299 H THR 41 H THR 41 -7.103 0.179 5.071
300 HA THR 41 HA THR 41 -8.514 0.671 7.558
301 HB THR 41 HB THR 41 -6.367 -1.266 7.694
302 HG1 THR 41 1HG THR 41 -8.170 -1.339 5.521
303 1HG2 THR 41 1HG2 THR 41 -8.047 -1.456 9.297
304 2HG2 THR 41 2HG2 THR 41 -8.405 -2.752 8.153
305 3HG2 THR 41 3HG2 THR 41 -9.330 -1.253 8.102
306 H THR 42 H THR 42 -7.021 2.878 6.948
307 HA THR 42 HA THR 42 -4.467 2.718 8.310
308 HB THR 42 HB THR 42 -5.577 5.377 7.628
309 HG1 THR 42 1HG THR 42 -4.979 3.377 5.681
310 1HG2 THR 42 1HG2 THR 42 -3.210 5.332 6.467
311 2HG2 THR 42 2HG2 THR 42 -2.966 3.929 7.507
312 3HG2 THR 42 3HG2 THR 42 -3.348 5.498 8.217
313 H GLY 43 H GLY 43 -6.080 1.920 10.154
314 1HA GLY 43 1HA GLY 43 -6.308 4.213 11.980
315 2HA GLY 43 2HA GLY 43 -7.674 3.116 11.801
316 HA PRO 44 HA PRO 44 -5.486 0.675 14.845
317 1HB PRO 44 2HB PRO 44 -7.430 -1.137 15.288
318 2HB PRO 44 1HB PRO 44 -7.520 0.509 15.919
319 1HG PRO 44 2HG PRO 44 -8.999 -0.735 13.684
320 2HG PRO 44 1HG PRO 44 -9.458 0.620 14.726
321 1HD PRO 44 2HD PRO 44 -8.400 0.745 12.088
322 2HD PRO 44 1HD PRO 44 -8.725 2.101 13.182
323 H ILE 45 H ILE 45 -3.859 -0.484 13.978
324 HA ILE 45 HA ILE 45 -4.473 -2.514 11.953
325 HB ILE 45 HB ILE 45 -1.646 -2.096 12.611
326 1HG1 ILE 45 2HG1 ILE 45 -2.225 0.094 10.918
327 1HG2 ILE 45 1HG2 ILE 45 -2.460 -3.418 10.709
328 2HG2 ILE 45 2HG2 ILE 45 -3.172 -1.961 10.015
329 3HG2 ILE 45 3HG2 ILE 45 -1.423 -2.086 10.195
330 1HD1 ILE 45 1HD1 ILE 45 -0.980 1.347 12.369
331 2HD1 ILE 45 2HD1 ILE 45 -1.624 0.532 13.796
332 3HD1 ILE 45 3HD1 ILE 45 -0.429 -0.277 12.783
Start of MODEL 11
1 1H GLY 1 1H GLY 1 9.704 -9.337 18.074
2 2H GLY 1 2H GLY 1 10.562 -9.839 16.698
3 3H GLY 1 3H GLY 1 9.395 -8.617 16.568
4 1HA GLY 1 2HA GLY 1 10.966 -7.522 18.401
5 2HA GLY 1 1HA GLY 1 12.141 -8.483 17.516
6 H SER 2 H SER 2 13.210 -7.138 16.246
7 HA SER 2 HA SER 2 11.912 -4.862 15.019
8 1HB SER 2 2HB SER 2 14.600 -5.365 14.083
9 2HB SER 2 1HB SER 2 13.988 -4.012 15.035
10 HG SER 2 HG SER 2 14.854 -6.545 16.001
11 H MET 3 H MET 3 10.428 -6.378 13.831
12 HA MET 3 HA MET 3 11.571 -7.784 11.571
13 1HB MET 3 2HB MET 3 9.462 -8.434 12.960
14 2HB MET 3 1HB MET 3 8.635 -7.267 11.936
15 1HG MET 3 2HG MET 3 9.653 -8.581 9.977
16 2HG MET 3 1HG MET 3 9.942 -9.846 11.170
17 1HE MET 3 1HE MET 3 6.096 -7.749 10.469
18 2HE MET 3 2HE MET 3 7.655 -7.405 9.717
19 3HE MET 3 3HE MET 3 6.508 -8.481 8.917
20 H SER 4 H SER 4 12.538 -5.584 11.006
21 HA SER 4 HA SER 4 10.700 -3.979 9.382
22 1HB SER 4 2HB SER 4 13.354 -2.888 9.516
23 2HB SER 4 1HB SER 4 11.856 -2.226 10.175
24 HG SER 4 HG SER 4 13.325 -2.577 11.849
25 H THR 5 H THR 5 12.034 -2.968 7.411
26 HA THR 5 HA THR 5 13.807 -4.927 6.184
27 HB THR 5 HB THR 5 11.477 -5.575 5.510
28 HG1 THR 5 1HG THR 5 12.382 -6.244 3.726
29 1HG2 THR 5 1HG2 THR 5 11.455 -2.751 4.592
30 2HG2 THR 5 2HG2 THR 5 10.145 -3.742 5.236
31 3HG2 THR 5 3HG2 THR 5 10.663 -3.944 3.561
32 H LYS 6 H LYS 6 13.913 -3.820 3.636
33 HA LYS 6 HA LYS 6 15.208 -1.272 4.186
34 1HB LYS 6 2HB LYS 6 15.367 -3.338 2.111
35 2HB LYS 6 1HB LYS 6 15.406 -1.702 1.465
36 1HG LYS 6 2HG LYS 6 17.572 -1.669 1.916
37 2HG LYS 6 1HG LYS 6 17.148 -1.641 3.628
38 1HD LYS 6 2HD LYS 6 17.982 -3.683 3.916
39 2HD LYS 6 1HD LYS 6 16.971 -4.323 2.618
40 1HE LYS 6 2HE LYS 6 18.758 -4.536 1.316
41 2HE LYS 6 1HE LYS 6 19.071 -2.805 1.450
42 1HZ LYS 6 1HZ LYS 6 20.275 -3.264 3.534
43 2HZ LYS 6 2HZ LYS 6 20.983 -4.011 2.187
44 3HZ LYS 6 3HZ LYS 6 20.059 -4.930 3.277
45 H ASN 7 H ASN 7 13.022 -0.433 4.746
46 HA ASN 7 HA ASN 7 10.885 -0.109 3.040
47 1HB ASN 7 2HB ASN 7 10.594 0.497 5.307
48 2HB ASN 7 1HB ASN 7 11.946 1.624 5.265
49 1HD2 ASN 7 1HD2 ASN 7 11.160 3.582 5.584
50 2HD2 ASN 7 2HD2 ASN 7 9.778 4.264 4.800
51 H PHE 8 H PHE 8 10.813 0.705 1.074
52 HA PHE 8 HA PHE 8 12.861 2.300 -0.026
53 1HB PHE 8 2HB PHE 8 10.672 0.736 -0.953
54 2HB PHE 8 1HB PHE 8 10.501 2.349 -1.634
55 HD1 PHE 8 1HD PHE 8 13.135 -0.242 -1.098
56 HD2 PHE 8 2HD PHE 8 11.529 2.780 -3.627
57 HE1 PHE 8 1HE PHE 8 14.793 -0.808 -2.825
58 HE2 PHE 8 2HE PHE 8 13.186 2.220 -5.355
59 HZ PHE 8 HZ PHE 8 14.816 0.424 -4.955
60 H ARG 9 H ARG 9 11.972 4.150 -1.480
61 HA ARG 9 HA ARG 9 11.139 6.209 0.379
62 1HB ARG 9 2HB ARG 9 12.560 6.113 -2.182
63 2HB ARG 9 1HB ARG 9 11.451 7.471 -2.040
64 1HG ARG 9 2HG ARG 9 12.792 7.416 0.388
65 2HG ARG 9 1HG ARG 9 14.031 7.062 -0.817
66 1HD ARG 9 2HD ARG 9 12.388 9.159 -1.811
67 2HD ARG 9 1HD ARG 9 12.855 9.562 -0.159
68 HE ARG 9 HE ARG 9 14.586 9.360 -2.478
69 1HH1 ARG 9 2HH1 ARG 9 14.345 9.624 1.012
70 2HH1 ARG 9 1HH1 ARG 9 16.006 10.112 1.218
71 1HH2 ARG 9 2HH2 ARG 9 16.772 9.968 -2.211
72 2HH2 ARG 9 1HH2 ARG 9 17.399 10.271 -0.618
73 H VAL 10 H VAL 10 9.085 4.481 -0.058
74 HA VAL 10 HA VAL 10 7.209 6.087 -1.667
75 HB VAL 10 HB VAL 10 5.975 3.634 -1.321
76 1HG1 VAL 10 1HG1 VAL 10 7.447 3.845 -3.830
77 2HG1 VAL 10 2HG1 VAL 10 5.708 3.821 -3.532
78 3HG1 VAL 10 3HG1 VAL 10 6.607 5.331 -3.381
79 1HG2 VAL 10 1HG2 VAL 10 7.403 1.890 -1.536
80 2HG2 VAL 10 2HG2 VAL 10 8.572 2.818 -2.477
81 3HG2 VAL 10 3HG2 VAL 10 8.510 2.996 -0.723
82 H SER 11 H SER 11 8.137 5.892 1.288
83 HA SER 11 HA SER 11 5.575 5.333 2.577
84 1HB SER 11 2HB SER 11 7.530 6.121 4.449
85 2HB SER 11 1HB SER 11 6.883 4.500 4.189
86 HG SER 11 HG SER 11 8.648 3.959 3.147
87 H ASP 12 H ASP 12 5.366 7.510 1.100
88 HA ASP 12 HA ASP 12 5.919 9.923 2.588
89 1HB ASP 12 2HB ASP 12 5.815 9.609 0.001
90 2HB ASP 12 1HB ASP 12 4.075 9.761 0.217
91 H GLY 13 H GLY 13 3.259 11.067 1.663
92 1HA GLY 13 1HA GLY 13 1.708 10.291 4.000
93 2HA GLY 13 2HA GLY 13 1.327 11.578 2.864
94 H ASP 14 H ASP 14 2.145 8.744 1.307
95 HA ASP 14 HA ASP 14 -0.640 8.214 0.603
96 1HB ASP 14 2HB ASP 14 2.011 7.632 -0.662
97 2HB ASP 14 1HB ASP 14 0.654 6.577 -1.040
98 H TRP 15 H TRP 15 -0.681 5.641 -0.063
99 HA TRP 15 HA TRP 15 0.523 4.043 2.045
100 1HB TRP 15 2HB TRP 15 -1.542 3.011 2.747
101 2HB TRP 15 1HB TRP 15 -1.729 4.753 2.909
102 HD1 TRP 15 HD TRP 15 -2.911 5.860 0.508
103 HE1 TRP 15 1HE TRP 15 -5.046 5.032 -0.640
104 HE3 TRP 15 3HE TRP 15 -3.022 1.119 2.400
105 HZ2 TRP 15 2HZ TRP 15 -6.593 2.654 -0.730
106 HZ3 TRP 15 3HZ TRP 15 -4.857 -0.370 1.740
107 HH2 TRP 15 HH TRP 15 -6.614 0.368 0.194
108 H ILE 16 H ILE 16 0.581 1.798 1.502
109 HA ILE 16 HA ILE 16 0.288 1.348 -1.362
110 HB ILE 16 HB ILE 16 1.390 -0.938 -0.643
111 1HG1 ILE 16 2HG1 ILE 16 2.843 0.648 1.383
112 1HG2 ILE 16 1HG2 ILE 16 3.379 -0.104 -1.429
113 2HG2 ILE 16 2HG2 ILE 16 2.261 1.150 -1.966
114 3HG2 ILE 16 3HG2 ILE 16 3.233 1.399 -0.518
115 1HD1 ILE 16 1HD1 ILE 16 2.284 -2.146 0.796
116 2HD1 ILE 16 2HD1 ILE 16 3.647 -1.408 1.641
117 3HD1 ILE 16 3HD1 ILE 16 2.150 -1.748 2.508
118 H CYS 17 H CYS 17 -0.100 -0.920 1.314
119 HA CYS 17 HA CYS 17 -2.898 -1.327 0.700
120 1HB CYS 17 2HB CYS 17 -0.704 -3.246 0.057
121 2HB CYS 17 1HB CYS 17 -2.228 -3.902 0.639
122 HA PRO 18 HA PRO 18 -2.965 -1.951 5.024
123 1HB PRO 18 2HB PRO 18 -5.272 -3.724 4.820
124 2HB PRO 18 1HB PRO 18 -5.186 -2.072 5.436
125 1HG PRO 18 2HG PRO 18 -6.438 -2.664 3.130
126 2HG PRO 18 1HG PRO 18 -5.554 -1.140 3.368
127 1HD PRO 18 2HD PRO 18 -4.637 -3.641 1.972
128 2HD PRO 18 1HD PRO 18 -4.511 -1.951 1.442
129 H ASP 19 H ASP 19 -2.703 -4.644 2.950
130 HA ASP 19 HA ASP 19 -2.213 -6.483 5.204
131 1HB ASP 19 2HB ASP 19 -4.368 -6.794 3.885
132 2HB ASP 19 1HB ASP 19 -3.361 -7.243 2.519
133 H LYS 20 H LYS 20 -0.804 -8.299 4.673
134 HA LYS 20 HA LYS 20 1.372 -7.515 2.892
135 1HB LYS 20 2HB LYS 20 2.471 -9.595 3.829
136 2HB LYS 20 1HB LYS 20 2.136 -8.324 4.995
137 1HG LYS 20 2HG LYS 20 0.085 -9.552 5.663
138 2HG LYS 20 1HG LYS 20 0.574 -10.863 4.586
139 1HD LYS 20 2HD LYS 20 2.805 -10.221 6.195
140 2HD LYS 20 1HD LYS 20 1.404 -10.336 7.263
141 1HE LYS 20 2HE LYS 20 2.312 -12.507 7.153
142 2HE LYS 20 1HE LYS 20 0.881 -12.531 6.124
143 1HZ LYS 20 1HZ LYS 20 3.481 -11.920 4.903
144 2HZ LYS 20 2HZ LYS 20 2.127 -12.691 4.236
145 3HZ LYS 20 3HZ LYS 20 3.131 -13.533 5.311
146 H LYS 21 H LYS 21 -1.411 -9.468 2.944
147 HA LYS 21 HA LYS 21 -0.578 -11.104 0.674
148 1HB LYS 21 2HB LYS 21 -3.364 -10.922 1.811
149 2HB LYS 21 1HB LYS 21 -2.643 -12.247 0.908
150 1HG LYS 21 2HG LYS 21 -1.424 -12.999 2.729
151 2HG LYS 21 1HG LYS 21 -1.539 -11.453 3.571
152 1HD LYS 21 2HD LYS 21 -4.156 -12.116 3.357
153 2HD LYS 21 1HD LYS 21 -3.419 -13.714 3.492
154 1HE LYS 21 2HE LYS 21 -3.493 -13.358 5.696
155 2HE LYS 21 1HE LYS 21 -2.103 -12.307 5.431
156 1HZ LYS 21 1HZ LYS 21 -3.811 -10.496 5.034
157 2HZ LYS 21 2HZ LYS 21 -3.619 -11.023 6.637
158 3HZ LYS 21 3HZ LYS 21 -4.947 -11.553 5.721
159 H CYS 22 H CYS 22 -1.259 -8.032 0.995
160 HA CYS 22 HA CYS 22 -3.075 -7.724 -1.275
161 1HB CYS 22 2HB CYS 22 -2.524 -6.271 1.143
162 2HB CYS 22 1HB CYS 22 -2.153 -5.241 -0.231
163 H GLY 23 H GLY 23 -0.624 -5.443 -0.411
164 1HA GLY 23 1HA GLY 23 1.401 -4.843 -1.281
165 2HA GLY 23 2HA GLY 23 1.452 -6.386 -2.121
166 H ASN 24 H ASN 24 -0.644 -3.502 -2.343
167 HA ASN 24 HA ASN 24 0.234 -3.197 -5.145
168 1HB ASN 24 2HB ASN 24 -2.063 -3.910 -5.164
169 2HB ASN 24 1HB ASN 24 -2.490 -2.783 -3.893
170 1HD2 ASN 24 1HD2 ASN 24 -3.395 -0.970 -4.462
171 2HD2 ASN 24 2HD2 ASN 24 -3.368 -0.263 -6.042
172 H VAL 25 H VAL 25 -0.029 -0.855 -5.889
173 HA VAL 25 HA VAL 25 0.699 0.951 -3.689
174 HB VAL 25 HB VAL 25 1.393 2.414 -5.804
175 1HG1 VAL 25 1HG1 VAL 25 3.018 0.152 -4.650
176 2HG1 VAL 25 2HG1 VAL 25 3.677 1.521 -5.549
177 3HG1 VAL 25 3HG1 VAL 25 2.882 1.787 -3.996
178 1HG2 VAL 25 1HG2 VAL 25 1.642 -0.431 -6.781
179 2HG2 VAL 25 2HG2 VAL 25 0.651 0.846 -7.489
180 3HG2 VAL 25 3HG2 VAL 25 2.411 0.967 -7.533
181 H ASN 26 H ASN 26 -1.072 1.974 -2.987
182 HA ASN 26 HA ASN 26 -3.156 2.695 -4.918
183 1HB ASN 26 2HB ASN 26 -3.144 2.165 -1.968
184 2HB ASN 26 1HB ASN 26 -4.445 3.111 -2.694
185 1HD2 ASN 26 1HD2 ASN 26 -3.608 0.108 -1.748
186 2HD2 ASN 26 2HD2 ASN 26 -4.662 -0.812 -2.766
187 H PHE 27 H PHE 27 -4.468 4.684 -4.070
188 HA PHE 27 HA PHE 27 -2.578 6.893 -3.757
189 1HB PHE 27 2HB PHE 27 -4.602 6.595 -5.535
190 2HB PHE 27 1HB PHE 27 -5.436 7.446 -4.240
191 HD1 PHE 27 1HD PHE 27 -5.777 9.579 -5.011
192 HD2 PHE 27 2HD PHE 27 -1.942 7.791 -5.459
193 HE1 PHE 27 1HE PHE 27 -4.880 11.716 -5.834
194 HE2 PHE 27 2HE PHE 27 -1.038 9.927 -6.283
195 HZ PHE 27 HZ PHE 27 -2.511 11.893 -6.469
196 H ALA 28 H ALA 28 -2.598 8.158 -2.021
197 HA ALA 28 HA ALA 28 -3.467 7.418 0.448
198 1HB ALA 28 1HB ALA 28 -3.503 10.318 0.097
199 2HB ALA 28 2HB ALA 28 -2.527 9.310 1.166
200 3HB ALA 28 3HB ALA 28 -2.056 9.521 -0.520
201 H ARG 29 H ARG 29 -5.171 9.745 -1.659
202 HA ARG 29 HA ARG 29 -7.315 10.110 0.166
203 1HB ARG 29 2HB ARG 29 -8.110 11.648 -1.312
204 2HB ARG 29 1HB ARG 29 -6.460 11.535 -1.906
205 1HG ARG 29 2HG ARG 29 -7.183 10.004 -3.655
206 2HG ARG 29 1HG ARG 29 -8.839 10.085 -3.048
207 1HD ARG 29 2HD ARG 29 -9.067 12.336 -3.660
208 2HD ARG 29 1HD ARG 29 -7.328 12.541 -3.868
209 HE ARG 29 HE ARG 29 -8.936 10.833 -5.662
210 1HH1 ARG 29 2HH1 ARG 29 -6.524 13.326 -5.124
211 2HH1 ARG 29 1HH1 ARG 29 -6.198 13.547 -6.820
212 1HH2 ARG 29 2HH2 ARG 29 -8.509 11.134 -7.891
213 2HH2 ARG 29 1HH2 ARG 29 -7.328 12.308 -8.386
214 H ARG 30 H ARG 30 -6.608 7.603 -2.022
215 HA ARG 30 HA ARG 30 -9.299 6.747 -2.528
216 1HB ARG 30 2HB ARG 30 -6.602 5.835 -3.195
217 2HB ARG 30 1HB ARG 30 -7.681 4.507 -2.797
218 1HG ARG 30 2HG ARG 30 -8.535 6.603 -4.742
219 2HG ARG 30 1HG ARG 30 -7.463 5.297 -5.245
220 1HD ARG 30 2HD ARG 30 -9.125 3.665 -4.374
221 2HD ARG 30 1HD ARG 30 -10.213 5.012 -4.044
222 HE ARG 30 HE ARG 30 -9.301 4.953 -6.764
223 1HH1 ARG 30 2HH1 ARG 30 -11.627 3.564 -4.538
224 2HH1 ARG 30 1HH1 ARG 30 -12.814 3.252 -5.770
225 1HH2 ARG 30 2HH2 ARG 30 -10.851 4.555 -8.382
226 2HH2 ARG 30 1HH2 ARG 30 -12.374 3.818 -7.965
227 H THR 31 H THR 31 -10.547 5.427 -1.319
228 HA THR 31 HA THR 31 -9.418 4.552 1.243
229 HB THR 31 HB THR 31 -12.280 4.147 0.966
230 HG1 THR 31 1HG THR 31 -12.786 6.416 0.875
231 1HG2 THR 31 1HG2 THR 31 -11.812 4.302 3.157
232 2HG2 THR 31 2HG2 THR 31 -11.872 6.048 2.899
233 3HG2 THR 31 3HG2 THR 31 -10.321 5.203 2.868
234 H SER 32 H SER 32 -9.737 3.332 -1.721
235 HA SER 32 HA SER 32 -10.145 0.607 -0.724
236 1HB SER 32 2HB SER 32 -11.087 0.528 -3.330
237 2HB SER 32 1HB SER 32 -12.079 0.533 -1.873
238 HG SER 32 HG SER 32 -12.772 2.425 -2.435
239 H CYS 33 H CYS 33 -9.002 -1.002 -1.761
240 HA CYS 33 HA CYS 33 -6.539 -0.316 -2.994
241 1HB CYS 33 2HB CYS 33 -8.040 -2.852 -2.507
242 2HB CYS 33 1HB CYS 33 -6.561 -2.873 -3.454
243 H ASP 34 H ASP 34 -5.875 -0.539 -5.113
244 HA ASP 34 HA ASP 34 -7.937 -0.298 -7.121
245 1HB ASP 34 2HB ASP 34 -6.123 1.210 -7.385
246 2HB ASP 34 1HB ASP 34 -4.928 -0.067 -7.190
247 H ARG 35 H ARG 35 -5.333 -2.592 -6.382
248 HA ARG 35 HA ARG 35 -6.063 -4.222 -8.684
249 1HB ARG 35 2HB ARG 35 -3.744 -4.083 -6.831
250 2HB ARG 35 1HB ARG 35 -4.096 -5.636 -7.573
251 1HG ARG 35 2HG ARG 35 -3.553 -3.057 -9.018
252 2HG ARG 35 1HG ARG 35 -2.450 -4.423 -8.855
253 1HD ARG 35 2HD ARG 35 -3.750 -5.787 -10.243
254 2HD ARG 35 1HD ARG 35 -5.164 -4.742 -10.099
255 HE ARG 35 HE ARG 35 -3.241 -3.175 -11.267
256 1HH1 ARG 35 2HH1 ARG 35 -4.779 -6.231 -12.050
257 2HH1 ARG 35 1HH1 ARG 35 -4.600 -6.023 -13.766
258 1HH2 ARG 35 2HH2 ARG 35 -3.018 -2.910 -13.531
259 2HH2 ARG 35 1HH2 ARG 35 -3.616 -4.137 -14.599
260 H CYS 36 H CYS 36 -5.762 -4.542 -5.176
261 HA CYS 36 HA CYS 36 -6.624 -7.251 -5.127
262 1HB CYS 36 2HB CYS 36 -6.718 -5.865 -2.614
263 2HB CYS 36 1HB CYS 36 -5.558 -7.074 -3.175
264 H GLY 37 H GLY 37 -8.110 -4.168 -4.122
265 1HA GLY 37 1HA GLY 37 -10.405 -3.682 -4.515
266 2HA GLY 37 2HA GLY 37 -10.731 -5.408 -4.570
267 H ARG 38 H ARG 38 -8.748 -4.267 -1.999
268 HA ARG 38 HA ARG 38 -10.940 -4.665 -0.120
269 1HB ARG 38 2HB ARG 38 -7.959 -4.629 0.091
270 2HB ARG 38 1HB ARG 38 -8.922 -4.303 1.528
271 1HG ARG 38 2HG ARG 38 -8.767 -6.541 1.768
272 2HG ARG 38 1HG ARG 38 -10.156 -6.517 0.680
273 1HD ARG 38 2HD ARG 38 -8.801 -8.050 -0.368
274 2HD ARG 38 1HD ARG 38 -8.322 -6.560 -1.183
275 HE ARG 38 HE ARG 38 -6.276 -6.603 -0.062
276 1HH1 ARG 38 2HH1 ARG 38 -8.332 -9.267 0.934
277 2HH1 ARG 38 1HH1 ARG 38 -7.057 -10.094 1.782
278 1HH2 ARG 38 2HH2 ARG 38 -4.629 -7.644 1.036
279 2HH2 ARG 38 1HH2 ARG 38 -4.942 -9.134 1.889
280 H GLU 39 H GLU 39 -9.991 -3.047 1.976
281 HA GLU 39 HA GLU 39 -10.300 -0.338 0.852
282 1HB GLU 39 2HB GLU 39 -11.447 -1.135 3.514
283 2HB GLU 39 1HB GLU 39 -11.821 0.280 2.540
284 1HG GLU 39 2HG GLU 39 -13.644 -0.864 1.967
285 2HG GLU 39 1HG GLU 39 -12.563 -1.718 0.870
286 H LYS 40 H LYS 40 -9.450 1.375 2.218
287 HA LYS 40 HA LYS 40 -6.896 0.705 3.310
288 1HB LYS 40 2HB LYS 40 -7.360 2.838 2.117
289 2HB LYS 40 1HB LYS 40 -8.387 3.335 3.454
290 1HG LYS 40 2HG LYS 40 -6.540 3.446 4.945
291 2HG LYS 40 1HG LYS 40 -5.473 2.662 3.780
292 1HD LYS 40 2HD LYS 40 -4.967 4.991 3.742
293 2HD LYS 40 1HD LYS 40 -5.849 4.625 2.259
294 1HE LYS 40 2HE LYS 40 -7.828 5.276 4.086
295 2HE LYS 40 1HE LYS 40 -6.532 6.420 4.433
296 1HZ LYS 40 1HZ LYS 40 -7.716 5.947 1.745
297 2HZ LYS 40 2HZ LYS 40 -6.527 7.091 2.127
298 3HZ LYS 40 3HZ LYS 40 -8.088 7.252 2.764
299 H THR 41 H THR 41 -7.750 -0.812 4.929
300 HA THR 41 HA THR 41 -9.127 0.230 7.227
301 HB THR 41 HB THR 41 -8.475 -2.070 8.180
302 HG1 THR 41 1HG THR 41 -7.765 -3.561 6.554
303 1HG2 THR 41 1HG2 THR 41 -9.943 -2.403 5.597
304 2HG2 THR 41 2HG2 THR 41 -10.621 -1.342 6.838
305 3HG2 THR 41 3HG2 THR 41 -10.325 -3.044 7.199
306 H THR 42 H THR 42 -5.943 -1.301 6.848
307 HA THR 42 HA THR 42 -4.991 0.198 9.174
308 HB THR 42 HB THR 42 -3.258 -1.886 8.018
309 HG1 THR 42 1HG THR 42 -5.889 -2.402 8.925
310 1HG2 THR 42 1HG2 THR 42 -4.316 -1.551 10.822
311 2HG2 THR 42 2HG2 THR 42 -2.915 -0.679 10.202
312 3HG2 THR 42 3HG2 THR 42 -2.882 -2.437 10.306
313 H GLY 43 H GLY 43 -4.029 2.051 8.668
314 1HA GLY 43 1HA GLY 43 -1.933 2.008 6.607
315 2HA GLY 43 2HA GLY 43 -3.189 3.234 6.503
316 HA PRO 44 HA PRO 44 -0.040 4.173 10.023
317 1HB PRO 44 2HB PRO 44 2.437 4.113 8.555
318 2HB PRO 44 1HB PRO 44 1.966 3.144 9.951
319 1HG PRO 44 2HG PRO 44 2.347 2.127 7.431
320 2HG PRO 44 1HG PRO 44 1.307 1.380 8.657
321 1HD PRO 44 2HD PRO 44 0.558 3.103 6.330
322 2HD PRO 44 1HD PRO 44 -0.255 1.659 6.971
323 H ILE 45 H ILE 45 -1.467 5.929 8.740
324 HA ILE 45 HA ILE 45 0.100 7.857 7.287
325 HB ILE 45 HB ILE 45 -2.702 8.076 8.410
326 1HG1 ILE 45 2HG1 ILE 45 -1.996 7.719 5.513
327 1HG2 ILE 45 1HG2 ILE 45 -1.281 9.808 6.393
328 2HG2 ILE 45 2HG2 ILE 45 -2.968 9.962 6.882
329 3HG2 ILE 45 3HG2 ILE 45 -1.680 10.264 8.047
330 1HD1 ILE 45 1HD1 ILE 45 -4.174 6.649 5.384
331 2HD1 ILE 45 2HD1 ILE 45 -4.414 6.919 7.111
332 3HD1 ILE 45 3HD1 ILE 45 -4.298 8.291 6.011
Start of MODEL 12
1 1H GLY 1 1H GLY 1 -0.807 -0.278 -25.885
2 2H GLY 1 2H GLY 1 -1.069 -1.756 -25.101
3 3H GLY 1 3H GLY 1 0.510 -1.188 -25.329
4 1HA GLY 1 2HA GLY 1 -1.212 -0.741 -23.167
5 2HA GLY 1 1HA GLY 1 0.445 -0.192 -23.376
6 H SER 2 H SER 2 -1.771 1.183 -22.103
7 HA SER 2 HA SER 2 -2.144 3.465 -23.908
8 1HB SER 2 2HB SER 2 -3.414 3.806 -21.345
9 2HB SER 2 1HB SER 2 -4.154 3.680 -22.942
10 HG SER 2 HG SER 2 -4.930 1.916 -22.020
11 H MET 3 H MET 3 -0.417 2.442 -21.097
12 HA MET 3 HA MET 3 0.422 5.205 -20.546
13 1HB MET 3 2HB MET 3 -0.431 4.141 -18.570
14 2HB MET 3 1HB MET 3 0.544 2.705 -18.851
15 1HG MET 3 2HG MET 3 2.575 4.174 -18.561
16 2HG MET 3 1HG MET 3 1.478 5.433 -18.006
17 1HE MET 3 1HE MET 3 1.461 1.367 -15.860
18 2HE MET 3 2HE MET 3 0.940 1.692 -17.514
19 3HE MET 3 3HE MET 3 2.659 1.624 -17.130
20 H SER 4 H SER 4 2.169 5.735 -21.669
21 HA SER 4 HA SER 4 4.332 3.787 -21.992
22 1HB SER 4 2HB SER 4 5.072 6.265 -23.126
23 2HB SER 4 1HB SER 4 4.547 4.813 -23.982
24 HG SER 4 HG SER 4 3.155 7.141 -23.372
25 H THR 5 H THR 5 5.967 3.769 -20.604
26 HA THR 5 HA THR 5 7.285 4.274 -18.823
27 HB THR 5 HB THR 5 6.565 7.186 -19.204
28 HG1 THR 5 1HG THR 5 7.563 5.812 -21.064
29 1HG2 THR 5 1HG2 THR 5 9.204 6.984 -18.439
30 2HG2 THR 5 2HG2 THR 5 8.421 5.711 -17.504
31 3HG2 THR 5 3HG2 THR 5 7.849 7.375 -17.378
32 H LYS 6 H LYS 6 6.817 3.954 -16.732
33 HA LYS 6 HA LYS 6 4.170 4.011 -15.813
34 1HB LYS 6 2HB LYS 6 6.690 3.136 -14.841
35 2HB LYS 6 1HB LYS 6 5.965 4.132 -13.587
36 1HG LYS 6 2HG LYS 6 3.848 2.633 -14.176
37 2HG LYS 6 1HG LYS 6 5.118 1.509 -14.661
38 1HD LYS 6 2HD LYS 6 5.620 2.803 -12.089
39 2HD LYS 6 1HD LYS 6 4.156 1.821 -12.116
40 1HE LYS 6 2HE LYS 6 5.612 0.170 -11.600
41 2HE LYS 6 1HE LYS 6 5.828 0.132 -13.349
42 1HZ LYS 6 1HZ LYS 6 7.845 0.328 -11.663
43 2HZ LYS 6 2HZ LYS 6 7.519 1.979 -11.847
44 3HZ LYS 6 3HZ LYS 6 7.883 1.030 -13.204
45 H ASN 7 H ASN 7 3.006 5.794 -15.569
46 HA ASN 7 HA ASN 7 4.284 8.215 -14.531
47 1HB ASN 7 2HB ASN 7 2.214 9.369 -15.251
48 2HB ASN 7 1HB ASN 7 3.018 8.531 -16.573
49 1HD2 ASN 7 1HD2 ASN 7 0.687 9.073 -17.287
50 2HD2 ASN 7 2HD2 ASN 7 -0.452 7.780 -17.113
51 H PHE 8 H PHE 8 3.360 5.727 -13.043
52 HA PHE 8 HA PHE 8 1.273 6.626 -11.303
53 1HB PHE 8 2HB PHE 8 2.372 4.166 -11.893
54 2HB PHE 8 1HB PHE 8 3.000 4.486 -10.281
55 HD1 PHE 8 1HD PHE 8 0.070 3.696 -12.260
56 HD2 PHE 8 2HD PHE 8 1.460 4.791 -8.391
57 HE1 PHE 8 1HE PHE 8 -2.075 2.983 -11.292
58 HE2 PHE 8 2HE PHE 8 -0.681 4.079 -7.415
59 HZ PHE 8 HZ PHE 8 -2.455 3.172 -8.866
60 H ARG 9 H ARG 9 2.415 8.705 -10.923
61 HA ARG 9 HA ARG 9 4.691 8.731 -9.187
62 1HB ARG 9 2HB ARG 9 3.941 11.205 -8.920
63 2HB ARG 9 1HB ARG 9 4.552 10.661 -10.474
64 1HG ARG 9 2HG ARG 9 2.596 11.008 -11.508
65 2HG ARG 9 1HG ARG 9 1.649 10.403 -10.147
66 1HD ARG 9 2HD ARG 9 1.432 12.457 -9.210
67 2HD ARG 9 1HD ARG 9 3.035 12.978 -9.728
68 HE ARG 9 HE ARG 9 1.555 12.806 -12.034
69 1HH1 ARG 9 2HH1 ARG 9 1.277 14.599 -9.027
70 2HH1 ARG 9 1HH1 ARG 9 0.448 15.931 -9.768
71 1HH2 ARG 9 2HH2 ARG 9 0.460 14.552 -12.990
72 2HH2 ARG 9 1HH2 ARG 9 -0.003 15.918 -12.009
73 H VAL 10 H VAL 10 3.807 7.235 -7.592
74 HA VAL 10 HA VAL 10 1.628 7.869 -5.938
75 HB VAL 10 HB VAL 10 2.422 5.643 -5.844
76 1HG1 VAL 10 1HG1 VAL 10 4.666 5.817 -6.547
77 2HG1 VAL 10 2HG1 VAL 10 5.106 6.806 -5.156
78 3HG1 VAL 10 3HG1 VAL 10 4.708 5.102 -4.936
79 1HG2 VAL 10 1HG2 VAL 10 3.038 7.109 -3.291
80 2HG2 VAL 10 2HG2 VAL 10 1.549 6.278 -3.741
81 3HG2 VAL 10 3HG2 VAL 10 3.011 5.350 -3.409
82 H SER 11 H SER 11 1.462 9.777 -5.003
83 HA SER 11 HA SER 11 3.795 11.233 -4.131
84 1HB SER 11 2HB SER 11 1.101 12.286 -3.517
85 2HB SER 11 1HB SER 11 2.471 13.079 -4.294
86 HG SER 11 HG SER 11 1.833 11.396 -6.061
87 H ASP 12 H ASP 12 3.806 12.274 -1.973
88 HA ASP 12 HA ASP 12 3.609 10.357 0.075
89 1HB ASP 12 2HB ASP 12 4.886 11.829 1.162
90 2HB ASP 12 1HB ASP 12 4.738 12.890 -0.222
91 H GLY 13 H GLY 13 2.335 10.558 2.054
92 1HA GLY 13 1HA GLY 13 0.217 10.685 3.070
93 2HA GLY 13 2HA GLY 13 -0.383 11.538 1.649
94 H ASP 14 H ASP 14 1.499 8.845 1.048
95 HA ASP 14 HA ASP 14 -0.645 7.459 -0.276
96 1HB ASP 14 2HB ASP 14 1.179 5.999 -1.082
97 2HB ASP 14 1HB ASP 14 1.550 7.702 -1.339
98 H TRP 15 H TRP 15 -0.611 5.008 -0.129
99 HA TRP 15 HA TRP 15 0.341 3.825 2.299
100 1HB TRP 15 2HB TRP 15 -1.774 3.093 3.191
101 2HB TRP 15 1HB TRP 15 -1.809 4.844 3.041
102 HD1 TRP 15 HD TRP 15 -3.225 5.774 0.785
103 HE1 TRP 15 1HE TRP 15 -5.416 4.845 -0.201
104 HE3 TRP 15 3HE TRP 15 -3.127 1.079 2.829
105 HZ2 TRP 15 2HZ TRP 15 -6.907 2.446 -0.120
106 HZ3 TRP 15 3HZ TRP 15 -4.960 -0.462 2.335
107 HH2 TRP 15 HH TRP 15 -6.817 0.202 0.880
108 H ILE 16 H ILE 16 0.251 1.543 2.253
109 HA ILE 16 HA ILE 16 -0.400 0.422 -0.388
110 HB ILE 16 HB ILE 16 0.973 -1.569 0.484
111 1HG1 ILE 16 2HG1 ILE 16 2.643 0.196 2.098
112 1HG2 ILE 16 1HG2 ILE 16 2.739 0.799 0.111
113 2HG2 ILE 16 2HG2 ILE 16 2.821 -0.802 -0.624
114 3HG2 ILE 16 3HG2 ILE 16 1.616 0.362 -1.178
115 1HD1 ILE 16 1HD1 ILE 16 2.922 -2.253 1.977
116 2HD1 ILE 16 2HD1 ILE 16 2.723 -1.648 3.621
117 3HD1 ILE 16 3HD1 ILE 16 1.374 -2.437 2.802
118 H CYS 17 H CYS 17 -1.444 -1.688 -0.396
119 HA CYS 17 HA CYS 17 -3.767 -1.877 0.995
120 1HB CYS 17 2HB CYS 17 -2.779 -3.326 -0.952
121 2HB CYS 17 1HB CYS 17 -2.288 -4.397 0.351
122 HA PRO 18 HA PRO 18 -2.857 -2.669 5.170
123 1HB PRO 18 2HB PRO 18 -5.247 -4.400 5.312
124 2HB PRO 18 1HB PRO 18 -4.896 -2.899 6.174
125 1HG PRO 18 2HG PRO 18 -6.701 -2.973 4.206
126 2HG PRO 18 1HG PRO 18 -5.638 -1.570 4.427
127 1HD PRO 18 2HD PRO 18 -5.421 -3.823 2.461
128 2HD PRO 18 1HD PRO 18 -5.169 -2.085 2.206
129 H ASP 19 H ASP 19 -3.314 -5.293 2.978
130 HA ASP 19 HA ASP 19 -2.123 -7.190 4.894
131 1HB ASP 19 2HB ASP 19 -4.471 -7.618 3.816
132 2HB ASP 19 1HB ASP 19 -3.534 -8.066 2.395
133 H LYS 20 H LYS 20 -0.514 -8.626 4.114
134 HA LYS 20 HA LYS 20 1.289 -7.252 2.315
135 1HB LYS 20 2HB LYS 20 2.933 -8.939 3.032
136 2HB LYS 20 1HB LYS 20 2.171 -8.137 4.397
137 1HG LYS 20 2HG LYS 20 0.865 -10.030 4.913
138 2HG LYS 20 1HG LYS 20 1.234 -10.797 3.365
139 1HD LYS 20 2HD LYS 20 3.433 -10.126 5.284
140 2HD LYS 20 1HD LYS 20 2.466 -11.586 5.510
141 1HE LYS 20 2HE LYS 20 3.961 -12.540 4.139
142 2HE LYS 20 1HE LYS 20 3.067 -11.727 2.855
143 1HZ LYS 20 1HZ LYS 20 5.675 -11.457 3.192
144 2HZ LYS 20 2HZ LYS 20 5.154 -10.175 4.174
145 3HZ LYS 20 3HZ LYS 20 4.706 -10.226 2.539
146 H LYS 21 H LYS 21 -1.134 -9.443 1.862
147 HA LYS 21 HA LYS 21 0.078 -11.079 -0.160
148 1HB LYS 21 2HB LYS 21 -2.864 -10.502 0.178
149 2HB LYS 21 1HB LYS 21 -2.128 -11.897 -0.601
150 1HG LYS 21 2HG LYS 21 -1.434 -12.805 1.457
151 2HG LYS 21 1HG LYS 21 -1.756 -11.298 2.319
152 1HD LYS 21 2HD LYS 21 -4.108 -11.567 2.067
153 2HD LYS 21 1HD LYS 21 -3.896 -12.910 0.941
154 1HE LYS 21 2HE LYS 21 -4.423 -13.998 2.913
155 2HE LYS 21 1HE LYS 21 -2.660 -14.041 2.923
156 1HZ LYS 21 1HZ LYS 21 -3.848 -11.712 4.179
157 2HZ LYS 21 2HZ LYS 21 -2.556 -12.687 4.691
158 3HZ LYS 21 3HZ LYS 21 -4.153 -13.187 4.964
159 H CYS 22 H CYS 22 -1.024 -7.912 0.011
160 HA CYS 22 HA CYS 22 -1.268 -7.668 -2.911
161 1HB CYS 22 2HB CYS 22 -2.864 -6.704 -0.807
162 2HB CYS 22 1HB CYS 22 -1.983 -5.308 -1.407
163 H GLY 23 H GLY 23 -0.562 -5.281 -0.423
164 1HA GLY 23 1HA GLY 23 1.229 -3.865 -0.133
165 2HA GLY 23 2HA GLY 23 2.178 -4.923 -1.173
166 H ASN 24 H ASN 24 -0.806 -3.908 -2.423
167 HA ASN 24 HA ASN 24 0.295 -2.620 -4.660
168 1HB ASN 24 2HB ASN 24 -1.923 -3.625 -4.726
169 2HB ASN 24 1HB ASN 24 -2.502 -2.488 -3.514
170 1HD2 ASN 24 1HD2 ASN 24 -3.200 -0.517 -4.139
171 2HD2 ASN 24 2HD2 ASN 24 -3.215 0.033 -5.778
172 H VAL 25 H VAL 25 0.789 -0.572 -5.096
173 HA VAL 25 HA VAL 25 0.840 1.299 -2.911
174 HB VAL 25 HB VAL 25 1.746 2.858 -4.794
175 1HG1 VAL 25 1HG1 VAL 25 3.011 0.613 -3.358
176 2HG1 VAL 25 2HG1 VAL 25 3.959 1.352 -4.648
177 3HG1 VAL 25 3HG1 VAL 25 3.371 2.340 -3.309
178 1HG2 VAL 25 1HG2 VAL 25 2.873 1.568 -6.603
179 2HG2 VAL 25 2HG2 VAL 25 1.965 0.145 -6.096
180 3HG2 VAL 25 3HG2 VAL 25 1.114 1.559 -6.716
181 H ASN 26 H ASN 26 -1.248 1.754 -2.440
182 HA ASN 26 HA ASN 26 -3.068 2.643 -4.482
183 1HB ASN 26 2HB ASN 26 -3.232 2.215 -1.525
184 2HB ASN 26 1HB ASN 26 -4.440 3.232 -2.306
185 1HD2 ASN 26 1HD2 ASN 26 -3.849 0.181 -1.314
186 2HD2 ASN 26 2HD2 ASN 26 -4.874 -0.694 -2.393
187 H PHE 27 H PHE 27 -2.963 4.523 -5.319
188 HA PHE 27 HA PHE 27 -1.401 6.543 -5.259
189 1HB PHE 27 2HB PHE 27 -3.398 6.538 -6.618
190 2HB PHE 27 1HB PHE 27 -4.395 6.881 -5.213
191 HD1 PHE 27 1HD PHE 27 -1.239 8.412 -6.519
192 HD2 PHE 27 2HD PHE 27 -5.307 8.964 -5.390
193 HE1 PHE 27 1HE PHE 27 -1.027 10.829 -6.933
194 HE2 PHE 27 2HE PHE 27 -5.099 11.377 -5.809
195 HZ PHE 27 HZ PHE 27 -2.958 12.310 -6.577
196 H ALA 28 H ALA 28 -4.264 7.303 -3.311
197 HA ALA 28 HA ALA 28 -2.963 7.904 -0.904
198 1HB ALA 28 1HB ALA 28 -3.057 10.120 -2.905
199 2HB ALA 28 2HB ALA 28 -3.335 10.499 -1.204
200 3HB ALA 28 3HB ALA 28 -1.825 9.738 -1.702
201 H ARG 29 H ARG 29 -5.339 9.629 -2.904
202 HA ARG 29 HA ARG 29 -7.306 9.563 -0.796
203 1HB ARG 29 2HB ARG 29 -8.728 10.755 -2.470
204 2HB ARG 29 1HB ARG 29 -7.185 11.545 -2.166
205 1HG ARG 29 2HG ARG 29 -6.530 11.320 -4.284
206 2HG ARG 29 1HG ARG 29 -7.092 9.650 -4.378
207 1HD ARG 29 2HD ARG 29 -8.823 10.318 -5.589
208 2HD ARG 29 1HD ARG 29 -9.383 11.292 -4.230
209 HE ARG 29 HE ARG 29 -7.565 12.918 -5.306
210 1HH1 ARG 29 2HH1 ARG 29 -10.103 11.028 -6.827
211 2HH1 ARG 29 1HH1 ARG 29 -10.354 12.168 -8.118
212 1HH2 ARG 29 2HH2 ARG 29 -7.860 14.397 -7.008
213 2HH2 ARG 29 1HH2 ARG 29 -9.079 14.101 -8.213
214 H ARG 30 H ARG 30 -6.562 7.004 -1.511
215 HA ARG 30 HA ARG 30 -8.869 5.986 -3.028
216 1HB ARG 30 2HB ARG 30 -6.081 4.949 -2.626
217 2HB ARG 30 1HB ARG 30 -7.382 3.823 -2.977
218 1HG ARG 30 2HG ARG 30 -7.122 6.179 -4.750
219 2HG ARG 30 1HG ARG 30 -5.887 4.926 -4.869
220 1HD ARG 30 2HD ARG 30 -8.080 3.387 -4.854
221 2HD ARG 30 1HD ARG 30 -8.754 4.844 -5.583
222 HE ARG 30 HE ARG 30 -6.796 3.044 -6.738
223 1HH1 ARG 30 2HH1 ARG 30 -8.382 6.150 -6.923
224 2HH1 ARG 30 1HH1 ARG 30 -7.988 6.402 -8.594
225 1HH2 ARG 30 2HH2 ARG 30 -6.277 3.348 -8.947
226 2HH2 ARG 30 1HH2 ARG 30 -6.801 4.806 -9.742
227 H THR 31 H THR 31 -10.441 5.617 -1.576
228 HA THR 31 HA THR 31 -9.898 4.741 1.096
229 HB THR 31 HB THR 31 -12.646 4.427 0.063
230 HG1 THR 31 1HG THR 31 -11.229 6.907 -0.053
231 1HG2 THR 31 1HG2 THR 31 -12.029 6.363 2.193
232 2HG2 THR 31 2HG2 THR 31 -11.522 4.706 2.522
233 3HG2 THR 31 3HG2 THR 31 -13.212 5.056 2.158
234 H SER 32 H SER 32 -10.129 3.170 -1.861
235 HA SER 32 HA SER 32 -10.152 0.600 -0.486
236 1HB SER 32 2HB SER 32 -11.690 0.928 -3.056
237 2HB SER 32 1HB SER 32 -11.780 -0.381 -1.877
238 HG SER 32 HG SER 32 -12.567 1.374 -0.406
239 H CYS 33 H CYS 33 -8.952 -0.975 -1.487
240 HA CYS 33 HA CYS 33 -6.653 -0.207 -2.829
241 1HB CYS 33 2HB CYS 33 -7.022 -2.280 -1.484
242 2HB CYS 33 1HB CYS 33 -7.916 -2.945 -2.840
243 H ASP 34 H ASP 34 -5.936 -0.328 -4.879
244 HA ASP 34 HA ASP 34 -7.920 -0.353 -7.013
245 1HB ASP 34 2HB ASP 34 -5.871 1.272 -6.704
246 2HB ASP 34 1HB ASP 34 -4.968 -0.030 -7.468
247 H ARG 35 H ARG 35 -5.796 -2.501 -5.497
248 HA ARG 35 HA ARG 35 -5.375 -4.130 -7.884
249 1HB ARG 35 2HB ARG 35 -3.648 -3.545 -5.959
250 2HB ARG 35 1HB ARG 35 -4.364 -4.973 -5.224
251 1HG ARG 35 2HG ARG 35 -3.700 -6.348 -7.025
252 2HG ARG 35 1HG ARG 35 -3.260 -4.955 -8.018
253 1HD ARG 35 2HD ARG 35 -1.180 -5.464 -7.283
254 2HD ARG 35 1HD ARG 35 -1.697 -4.495 -5.902
255 HE ARG 35 HE ARG 35 -2.410 -6.773 -4.954
256 1HH1 ARG 35 2HH1 ARG 35 0.428 -6.157 -6.914
257 2HH1 ARG 35 1HH1 ARG 35 1.262 -7.577 -6.367
258 1HH2 ARG 35 2HH2 ARG 35 -1.293 -8.650 -4.233
259 2HH2 ARG 35 1HH2 ARG 35 0.295 -8.988 -4.856
260 H CYS 36 H CYS 36 -6.867 -4.337 -4.670
261 HA CYS 36 HA CYS 36 -8.183 -6.801 -5.590
262 1HB CYS 36 2HB CYS 36 -7.857 -7.849 -3.485
263 2HB CYS 36 1HB CYS 36 -6.299 -7.199 -3.979
264 H GLY 37 H GLY 37 -8.462 -3.821 -3.827
265 1HA GLY 37 1HA GLY 37 -10.554 -2.680 -3.700
266 2HA GLY 37 2HA GLY 37 -11.370 -4.235 -3.739
267 H ARG 38 H ARG 38 -8.679 -4.205 -1.695
268 HA ARG 38 HA ARG 38 -10.121 -4.596 0.676
269 1HB ARG 38 2HB ARG 38 -7.512 -4.849 -0.052
270 2HB ARG 38 1HB ARG 38 -7.438 -3.420 0.971
271 1HG ARG 38 2HG ARG 38 -7.324 -4.795 2.702
272 2HG ARG 38 1HG ARG 38 -9.016 -5.194 2.398
273 1HD ARG 38 2HD ARG 38 -7.633 -7.203 2.550
274 2HD ARG 38 1HD ARG 38 -8.343 -7.025 0.947
275 HE ARG 38 HE ARG 38 -5.760 -5.848 1.029
276 1HH1 ARG 38 2HH1 ARG 38 -7.355 -8.983 0.920
277 2HH1 ARG 38 1HH1 ARG 38 -6.048 -9.741 0.056
278 1HH2 ARG 38 2HH2 ARG 38 -4.050 -6.865 -0.073
279 2HH2 ARG 38 1HH2 ARG 38 -4.179 -8.543 -0.501
280 H GLU 39 H GLU 39 -10.636 -3.260 2.374
281 HA GLU 39 HA GLU 39 -11.180 -0.543 1.727
282 1HB GLU 39 2HB GLU 39 -12.008 -0.413 4.074
283 2HB GLU 39 1HB GLU 39 -12.717 -1.722 3.138
284 1HG GLU 39 2HG GLU 39 -11.264 -3.325 4.223
285 2HG GLU 39 1HG GLU 39 -10.462 -2.027 5.107
286 H LYS 40 H LYS 40 -10.439 1.328 2.827
287 HA LYS 40 HA LYS 40 -7.646 1.378 3.391
288 1HB LYS 40 2HB LYS 40 -9.470 3.248 2.611
289 2HB LYS 40 1HB LYS 40 -9.281 3.654 4.314
290 1HG LYS 40 2HG LYS 40 -6.721 3.202 3.063
291 2HG LYS 40 1HG LYS 40 -7.649 4.434 2.206
292 1HD LYS 40 2HD LYS 40 -7.877 5.745 4.190
293 2HD LYS 40 1HD LYS 40 -7.220 4.447 5.189
294 1HE LYS 40 2HE LYS 40 -5.085 4.659 3.881
295 2HE LYS 40 1HE LYS 40 -5.768 6.103 3.136
296 1HZ LYS 40 1HZ LYS 40 -4.347 6.018 5.454
297 2HZ LYS 40 2HZ LYS 40 -5.947 6.149 5.999
298 3HZ LYS 40 3HZ LYS 40 -5.316 7.309 4.934
299 H THR 41 H THR 41 -7.991 -0.382 5.096
300 HA THR 41 HA THR 41 -8.730 0.725 7.691
301 HB THR 41 HB THR 41 -8.758 -1.927 6.546
302 HG1 THR 41 1HG THR 41 -10.593 -1.554 7.540
303 1HG2 THR 41 1HG2 THR 41 -7.522 -1.732 9.299
304 2HG2 THR 41 2HG2 THR 41 -6.685 -2.271 7.842
305 3HG2 THR 41 3HG2 THR 41 -8.031 -3.212 8.486
306 H THR 42 H THR 42 -7.281 1.369 9.130
307 HA THR 42 HA THR 42 -4.466 0.621 8.731
308 HB THR 42 HB THR 42 -4.985 3.157 10.145
309 HG1 THR 42 1HG THR 42 -6.015 2.649 7.634
310 1HG2 THR 42 1HG2 THR 42 -2.811 3.315 9.659
311 2HG2 THR 42 2HG2 THR 42 -3.243 3.474 7.957
312 3HG2 THR 42 3HG2 THR 42 -2.901 1.882 8.631
313 H GLY 43 H GLY 43 -3.600 -0.419 10.406
314 1HA GLY 43 1HA GLY 43 -3.425 -0.121 12.966
315 2HA GLY 43 2HA GLY 43 -5.147 -0.473 12.909
316 HA PRO 44 HA PRO 44 -2.925 -4.432 13.710
317 1HB PRO 44 2HB PRO 44 -5.500 -5.063 15.013
318 2HB PRO 44 1HB PRO 44 -3.856 -5.190 15.647
319 1HG PRO 44 2HG PRO 44 -5.530 -3.274 16.480
320 2HG PRO 44 1HG PRO 44 -3.792 -2.976 16.295
321 1HD PRO 44 2HD PRO 44 -6.052 -2.199 14.493
322 2HD PRO 44 1HD PRO 44 -4.605 -1.277 14.947
323 H ILE 45 H ILE 45 -2.905 -5.416 11.777
324 HA ILE 45 HA ILE 45 -5.416 -6.640 10.854
325 HB ILE 45 HB ILE 45 -4.614 -5.237 9.105
326 1HG1 ILE 45 2HG1 ILE 45 -3.391 -7.547 7.859
327 1HG2 ILE 45 1HG2 ILE 45 -1.909 -6.496 9.511
328 2HG2 ILE 45 2HG2 ILE 45 -2.323 -5.386 8.206
329 3HG2 ILE 45 3HG2 ILE 45 -2.371 -4.836 9.881
330 1HD1 ILE 45 1HD1 ILE 45 -4.619 -6.209 6.430
331 2HD1 ILE 45 2HD1 ILE 45 -5.684 -7.588 6.708
332 3HD1 ILE 45 3HD1 ILE 45 -5.968 -6.071 7.558
Start of MODEL 13
1 1H GLY 1 1H GLY 1 -8.770 15.358 -15.873
2 2H GLY 1 2H GLY 1 -7.864 16.327 -16.928
3 3H GLY 1 3H GLY 1 -7.927 16.702 -15.279
4 1HA GLY 1 2HA GLY 1 -6.253 15.349 -14.796
5 2HA GLY 1 1HA GLY 1 -7.022 14.038 -15.680
6 H SER 2 H SER 2 -5.154 17.016 -16.157
7 HA SER 2 HA SER 2 -4.245 16.027 -18.752
8 1HB SER 2 2HB SER 2 -3.092 18.554 -18.026
9 2HB SER 2 1HB SER 2 -4.242 18.195 -19.316
10 HG SER 2 HG SER 2 -5.363 19.545 -18.059
11 H MET 3 H MET 3 -1.748 17.230 -18.886
12 HA MET 3 HA MET 3 -0.097 15.375 -17.546
13 1HB MET 3 2HB MET 3 0.455 16.555 -19.691
14 2HB MET 3 1HB MET 3 0.733 18.017 -18.755
15 1HG MET 3 2HG MET 3 2.364 16.428 -17.424
16 2HG MET 3 1HG MET 3 2.355 15.543 -18.950
17 1HE MET 3 1HE MET 3 3.373 18.203 -16.850
18 2HE MET 3 2HE MET 3 5.016 18.035 -17.466
19 3HE MET 3 3HE MET 3 4.096 19.501 -17.805
20 H SER 4 H SER 4 -0.065 15.368 -15.376
21 HA SER 4 HA SER 4 0.630 17.890 -14.015
22 1HB SER 4 2HB SER 4 -0.736 16.053 -12.252
23 2HB SER 4 1HB SER 4 -1.158 17.716 -12.663
24 HG SER 4 HG SER 4 -1.795 16.333 -14.771
25 H THR 5 H THR 5 2.140 15.519 -15.077
26 HA THR 5 HA THR 5 3.886 14.186 -14.532
27 HB THR 5 HB THR 5 4.150 15.563 -11.878
28 HG1 THR 5 1HG THR 5 5.128 17.324 -12.985
29 1HG2 THR 5 1HG2 THR 5 6.585 15.516 -12.649
30 2HG2 THR 5 2HG2 THR 5 6.039 14.454 -13.947
31 3HG2 THR 5 3HG2 THR 5 5.848 13.960 -12.266
32 H LYS 6 H LYS 6 1.433 13.115 -14.079
33 HA LYS 6 HA LYS 6 1.446 11.875 -11.438
34 1HB LYS 6 2HB LYS 6 -0.574 12.649 -13.240
35 2HB LYS 6 1HB LYS 6 -0.611 10.893 -13.202
36 1HG LYS 6 2HG LYS 6 -0.376 11.670 -10.535
37 2HG LYS 6 1HG LYS 6 -1.547 12.781 -11.251
38 1HD LYS 6 2HD LYS 6 -2.721 10.771 -12.203
39 2HD LYS 6 1HD LYS 6 -1.644 9.770 -11.227
40 1HE LYS 6 2HE LYS 6 -2.985 10.029 -9.480
41 2HE LYS 6 1HE LYS 6 -2.733 11.773 -9.544
42 1HZ LYS 6 1HZ LYS 6 -4.574 11.981 -11.062
43 2HZ LYS 6 2HZ LYS 6 -5.086 11.151 -9.673
44 3HZ LYS 6 3HZ LYS 6 -4.788 10.298 -11.110
45 H ASN 7 H ASN 7 3.611 11.162 -13.077
46 HA ASN 7 HA ASN 7 2.977 8.573 -14.236
47 1HB ASN 7 2HB ASN 7 4.555 9.954 -15.446
48 2HB ASN 7 1HB ASN 7 5.590 10.081 -14.031
49 1HD2 ASN 7 1HD2 ASN 7 3.954 7.165 -15.123
50 2HD2 ASN 7 2HD2 ASN 7 5.398 6.292 -15.524
51 H PHE 8 H PHE 8 2.478 7.192 -12.631
52 HA PHE 8 HA PHE 8 2.637 5.901 -10.765
53 1HB PHE 8 2HB PHE 8 4.612 5.245 -12.382
54 2HB PHE 8 1HB PHE 8 5.603 5.888 -11.084
55 HD1 PHE 8 1HD PHE 8 2.574 3.733 -11.307
56 HD2 PHE 8 2HD PHE 8 6.496 4.254 -9.746
57 HE1 PHE 8 1HE PHE 8 2.389 1.578 -10.138
58 HE2 PHE 8 2HE PHE 8 6.317 2.099 -8.570
59 HZ PHE 8 HZ PHE 8 4.263 0.760 -8.763
60 H ARG 9 H ARG 9 2.269 8.354 -9.940
61 HA ARG 9 HA ARG 9 4.428 9.334 -8.308
62 1HB ARG 9 2HB ARG 9 2.474 10.622 -9.593
63 2HB ARG 9 1HB ARG 9 1.672 10.426 -8.043
64 1HG ARG 9 2HG ARG 9 4.432 11.581 -8.208
65 2HG ARG 9 1HG ARG 9 3.002 12.579 -8.473
66 1HD ARG 9 2HD ARG 9 2.351 12.472 -6.298
67 2HD ARG 9 1HD ARG 9 2.991 10.848 -6.073
68 HE ARG 9 HE ARG 9 4.257 13.259 -5.357
69 1HH1 ARG 9 2HH1 ARG 9 5.052 10.216 -6.893
70 2HH1 ARG 9 1HH1 ARG 9 6.675 10.184 -6.297
71 1HH2 ARG 9 2HH2 ARG 9 6.402 13.204 -4.553
72 2HH2 ARG 9 1HH2 ARG 9 7.454 11.888 -4.990
73 H VAL 10 H VAL 10 4.772 7.727 -6.765
74 HA VAL 10 HA VAL 10 2.661 7.248 -4.816
75 HB VAL 10 HB VAL 10 5.520 6.420 -4.401
76 1HG1 VAL 10 1HG1 VAL 10 4.017 6.038 -2.569
77 2HG1 VAL 10 2HG1 VAL 10 2.849 5.253 -3.630
78 3HG1 VAL 10 3HG1 VAL 10 4.402 4.482 -3.308
79 1HG2 VAL 10 1HG2 VAL 10 5.501 5.306 -6.341
80 2HG2 VAL 10 2HG2 VAL 10 4.362 4.214 -5.552
81 3HG2 VAL 10 3HG2 VAL 10 3.766 5.534 -6.559
82 H SER 11 H SER 11 2.243 8.910 -3.541
83 HA SER 11 HA SER 11 4.243 10.935 -3.047
84 1HB SER 11 2HB SER 11 1.599 11.090 -1.720
85 2HB SER 11 1HB SER 11 2.488 12.323 -2.614
86 HG SER 11 HG SER 11 0.977 10.151 -3.674
87 H ASP 12 H ASP 12 3.472 11.898 -0.573
88 HA ASP 12 HA ASP 12 5.197 10.321 1.057
89 1HB ASP 12 2HB ASP 12 5.242 12.745 1.191
90 2HB ASP 12 1HB ASP 12 3.554 12.776 1.691
91 H GLY 13 H GLY 13 1.723 11.064 1.166
92 1HA GLY 13 1HA GLY 13 1.444 9.367 3.538
93 2HA GLY 13 2HA GLY 13 0.230 10.458 2.893
94 H ASP 14 H ASP 14 1.721 8.600 0.520
95 HA ASP 14 HA ASP 14 -0.705 7.178 -0.015
96 1HB ASP 14 2HB ASP 14 1.985 7.279 -1.354
97 2HB ASP 14 1HB ASP 14 0.771 6.105 -1.851
98 H TRP 15 H TRP 15 -0.596 4.754 -0.490
99 HA TRP 15 HA TRP 15 0.863 3.436 1.683
100 1HB TRP 15 2HB TRP 15 -1.261 2.238 2.298
101 2HB TRP 15 1HB TRP 15 -1.242 3.953 2.686
102 HD1 TRP 15 HD TRP 15 -2.283 5.329 0.145
103 HE1 TRP 15 1HE TRP 15 -4.636 4.887 -0.797
104 HE3 TRP 15 3HE TRP 15 -3.160 0.807 2.348
105 HZ2 TRP 15 2HZ TRP 15 -6.614 2.867 -0.594
106 HZ3 TRP 15 3HZ TRP 15 -5.309 -0.306 1.929
107 HH2 TRP 15 HH TRP 15 -6.995 0.695 0.485
108 H ILE 16 H ILE 16 -0.301 0.940 1.495
109 HA ILE 16 HA ILE 16 0.384 0.146 -1.249
110 HB ILE 16 HB ILE 16 1.155 -2.044 -0.091
111 1HG1 ILE 16 2HG1 ILE 16 2.205 -0.561 2.156
112 1HG2 ILE 16 1HG2 ILE 16 2.636 -0.601 -1.336
113 2HG2 ILE 16 2HG2 ILE 16 2.760 0.507 0.030
114 3HG2 ILE 16 3HG2 ILE 16 3.436 -1.119 0.148
115 1HD1 ILE 16 1HD1 ILE 16 1.608 -2.421 3.429
116 2HD1 ILE 16 2HD1 ILE 16 0.340 -2.899 2.299
117 3HD1 ILE 16 3HD1 ILE 16 2.037 -3.075 1.849
118 H CYS 17 H CYS 17 -1.108 -1.245 1.669
119 HA CYS 17 HA CYS 17 -3.637 -1.746 0.558
120 1HB CYS 17 2HB CYS 17 -2.302 -3.386 -0.799
121 2HB CYS 17 1HB CYS 17 -1.797 -4.162 0.688
122 HA PRO 18 HA PRO 18 -4.196 -2.551 4.943
123 1HB PRO 18 2HB PRO 18 -6.399 -4.380 4.250
124 2HB PRO 18 1HB PRO 18 -6.433 -2.903 5.217
125 1HG PRO 18 2HG PRO 18 -7.504 -2.997 2.765
126 2HG PRO 18 1HG PRO 18 -6.689 -1.541 3.370
127 1HD PRO 18 2HD PRO 18 -5.670 -3.636 1.488
128 2HD PRO 18 1HD PRO 18 -5.473 -1.875 1.422
129 H ASP 19 H ASP 19 -3.607 -4.957 2.593
130 HA ASP 19 HA ASP 19 -3.150 -7.023 4.633
131 1HB ASP 19 2HB ASP 19 -4.451 -7.351 2.346
132 2HB ASP 19 1HB ASP 19 -2.823 -7.579 1.715
133 H LYS 20 H LYS 20 -1.209 -8.550 3.597
134 HA LYS 20 HA LYS 20 1.079 -6.755 3.144
135 1HB LYS 20 2HB LYS 20 2.405 -7.805 4.758
136 2HB LYS 20 1HB LYS 20 0.840 -7.667 5.544
137 1HG LYS 20 2HG LYS 20 0.529 -9.893 5.618
138 2HG LYS 20 1HG LYS 20 1.315 -10.164 4.060
139 1HD LYS 20 2HD LYS 20 3.289 -10.603 5.024
140 2HD LYS 20 1HD LYS 20 3.162 -9.206 6.094
141 1HE LYS 20 2HE LYS 20 2.049 -11.973 6.509
142 2HE LYS 20 1HE LYS 20 3.243 -11.119 7.488
143 1HZ LYS 20 1HZ LYS 20 0.380 -10.368 7.201
144 2HZ LYS 20 2HZ LYS 20 1.524 -9.541 8.143
145 3HZ LYS 20 3HZ LYS 20 1.076 -11.128 8.548
146 H LYS 21 H LYS 21 -0.723 -9.365 2.095
147 HA LYS 21 HA LYS 21 1.503 -10.633 0.679
148 1HB LYS 21 2HB LYS 21 -1.416 -11.276 1.002
149 2HB LYS 21 1HB LYS 21 -0.453 -12.057 -0.242
150 1HG LYS 21 2HG LYS 21 0.309 -12.093 2.663
151 2HG LYS 21 1HG LYS 21 -0.726 -13.316 1.928
152 1HD LYS 21 2HD LYS 21 2.047 -12.631 0.963
153 2HD LYS 21 1HD LYS 21 1.679 -13.960 2.063
154 1HE LYS 21 2HE LYS 21 0.296 -15.012 0.385
155 2HE LYS 21 1HE LYS 21 0.518 -13.641 -0.701
156 1HZ LYS 21 1HZ LYS 21 1.986 -15.345 -1.391
157 2HZ LYS 21 2HZ LYS 21 2.570 -15.590 0.182
158 3HZ LYS 21 3HZ LYS 21 2.945 -14.161 -0.647
159 H CYS 22 H CYS 22 -0.182 -7.954 0.307
160 HA CYS 22 HA CYS 22 -0.569 -8.162 -2.592
161 1HB CYS 22 2HB CYS 22 -2.371 -7.337 -0.932
162 2HB CYS 22 1HB CYS 22 -1.420 -5.867 -0.846
163 H GLY 23 H GLY 23 0.130 -5.339 -0.594
164 1HA GLY 23 1HA GLY 23 1.825 -3.783 -0.708
165 2HA GLY 23 2HA GLY 23 2.789 -4.968 -1.587
166 H ASN 24 H ASN 24 -0.306 -3.402 -2.226
167 HA ASN 24 HA ASN 24 0.383 -2.954 -4.996
168 1HB ASN 24 2HB ASN 24 -1.875 -3.631 -4.470
169 2HB ASN 24 1HB ASN 24 -2.058 -2.326 -3.308
170 1HD2 ASN 24 1HD2 ASN 24 -3.068 -0.600 -3.956
171 2HD2 ASN 24 2HD2 ASN 24 -3.312 -0.114 -5.599
172 H VAL 25 H VAL 25 -0.290 -0.612 -5.836
173 HA VAL 25 HA VAL 25 0.886 1.374 -4.008
174 HB VAL 25 HB VAL 25 1.299 2.583 -6.357
175 1HG1 VAL 25 1HG1 VAL 25 3.613 1.710 -6.279
176 2HG1 VAL 25 2HG1 VAL 25 3.012 2.204 -4.696
177 3HG1 VAL 25 3HG1 VAL 25 3.086 0.491 -5.118
178 1HG2 VAL 25 1HG2 VAL 25 1.072 -0.324 -6.988
179 2HG2 VAL 25 2HG2 VAL 25 0.594 1.078 -7.946
180 3HG2 VAL 25 3HG2 VAL 25 2.297 0.637 -7.815
181 H ASN 26 H ASN 26 -1.043 2.067 -3.153
182 HA ASN 26 HA ASN 26 -3.005 3.171 -5.049
183 1HB ASN 26 2HB ASN 26 -4.171 3.255 -2.517
184 2HB ASN 26 1HB ASN 26 -4.532 2.102 -3.789
185 1HD2 ASN 26 1HD2 ASN 26 -4.822 0.248 -2.719
186 2HD2 ASN 26 2HD2 ASN 26 -3.675 -0.468 -1.642
187 H PHE 27 H PHE 27 -3.909 5.183 -4.633
188 HA PHE 27 HA PHE 27 -2.065 7.099 -3.573
189 1HB PHE 27 2HB PHE 27 -3.753 7.142 -5.670
190 2HB PHE 27 1HB PHE 27 -4.790 7.889 -4.460
191 HD1 PHE 27 1HD PHE 27 -4.801 10.151 -4.431
192 HD2 PHE 27 2HD PHE 27 -1.225 8.146 -5.570
193 HE1 PHE 27 1HE PHE 27 -3.709 12.326 -4.822
194 HE2 PHE 27 2HE PHE 27 -0.124 10.314 -5.962
195 HZ PHE 27 HZ PHE 27 -1.369 12.404 -5.588
196 H ALA 28 H ALA 28 -2.401 8.387 -1.855
197 HA ALA 28 HA ALA 28 -3.676 7.821 0.450
198 1HB ALA 28 1HB ALA 28 -2.192 9.831 -0.172
199 2HB ALA 28 2HB ALA 28 -3.714 10.639 -0.566
200 3HB ALA 28 3HB ALA 28 -3.418 10.058 1.076
201 H ARG 29 H ARG 29 -5.086 9.493 -2.298
202 HA ARG 29 HA ARG 29 -7.578 10.036 -1.010
203 1HB ARG 29 2HB ARG 29 -6.789 10.214 -3.912
204 2HB ARG 29 1HB ARG 29 -8.206 10.956 -3.176
205 1HG ARG 29 2HG ARG 29 -5.511 11.607 -2.099
206 2HG ARG 29 1HG ARG 29 -6.017 12.325 -3.630
207 1HD ARG 29 2HD ARG 29 -7.142 13.857 -2.490
208 2HD ARG 29 1HD ARG 29 -8.188 12.584 -1.869
209 HE ARG 29 HE ARG 29 -7.198 12.832 0.162
210 1HH1 ARG 29 2HH1 ARG 29 -5.003 14.141 -2.264
211 2HH1 ARG 29 1HH1 ARG 29 -3.847 14.690 -1.083
212 1HH2 ARG 29 2HH2 ARG 29 -5.685 13.572 1.684
213 2HH2 ARG 29 1HH2 ARG 29 -4.238 14.371 1.150
214 H ARG 30 H ARG 30 -6.358 7.213 -2.064
215 HA ARG 30 HA ARG 30 -8.878 6.167 -3.129
216 1HB ARG 30 2HB ARG 30 -6.079 5.067 -2.946
217 2HB ARG 30 1HB ARG 30 -7.448 4.033 -3.315
218 1HG ARG 30 2HG ARG 30 -6.672 6.464 -4.915
219 2HG ARG 30 1HG ARG 30 -6.205 4.807 -5.313
220 1HD ARG 30 2HD ARG 30 -9.056 5.061 -4.846
221 2HD ARG 30 1HD ARG 30 -8.499 6.121 -6.139
222 HE ARG 30 HE ARG 30 -7.367 3.624 -6.614
223 1HH1 ARG 30 2HH1 ARG 30 -10.585 5.005 -6.413
224 2HH1 ARG 30 1HH1 ARG 30 -11.263 3.894 -7.564
225 1HH2 ARG 30 2HH2 ARG 30 -8.272 2.160 -8.121
226 2HH2 ARG 30 1HH2 ARG 30 -9.963 2.289 -8.530
227 H THR 31 H THR 31 -10.298 5.343 -1.718
228 HA THR 31 HA THR 31 -9.505 4.903 1.021
229 HB THR 31 HB THR 31 -12.144 4.070 0.773
230 HG1 THR 31 1HG THR 31 -12.790 4.895 -1.063
231 1HG2 THR 31 1HG2 THR 31 -11.871 6.930 1.242
232 2HG2 THR 31 2HG2 THR 31 -10.690 5.981 2.144
233 3HG2 THR 31 3HG2 THR 31 -12.413 5.654 2.332
234 H SER 32 H SER 32 -9.444 3.013 -1.687
235 HA SER 32 HA SER 32 -9.499 0.560 -0.099
236 1HB SER 32 2HB SER 32 -10.679 0.254 -2.782
237 2HB SER 32 1HB SER 32 -11.199 -0.426 -1.239
238 HG SER 32 HG SER 32 -12.595 1.133 -1.049
239 H CYS 33 H CYS 33 -8.377 -1.228 -1.141
240 HA CYS 33 HA CYS 33 -6.000 -0.523 -2.444
241 1HB CYS 33 2HB CYS 33 -6.271 -2.631 -1.191
242 2HB CYS 33 1HB CYS 33 -7.412 -3.205 -2.399
243 H ASP 34 H ASP 34 -5.367 -0.633 -4.583
244 HA ASP 34 HA ASP 34 -7.505 -0.316 -6.516
245 1HB ASP 34 2HB ASP 34 -4.779 0.566 -6.283
246 2HB ASP 34 1HB ASP 34 -4.982 -0.280 -7.814
247 H ARG 35 H ARG 35 -5.725 -2.796 -5.216
248 HA ARG 35 HA ARG 35 -5.934 -4.469 -7.632
249 1HB ARG 35 2HB ARG 35 -4.127 -4.435 -5.279
250 2HB ARG 35 1HB ARG 35 -4.578 -6.020 -5.893
251 1HG ARG 35 2HG ARG 35 -3.906 -4.615 -8.165
252 2HG ARG 35 1HG ARG 35 -2.733 -4.066 -6.966
253 1HD ARG 35 2HD ARG 35 -3.336 -6.924 -7.705
254 2HD ARG 35 1HD ARG 35 -1.892 -6.012 -8.144
255 HE ARG 35 HE ARG 35 -2.475 -6.347 -5.297
256 1HH1 ARG 35 2HH1 ARG 35 -0.558 -7.214 -8.091
257 2HH1 ARG 35 1HH1 ARG 35 0.684 -7.995 -7.156
258 1HH2 ARG 35 2HH2 ARG 35 -0.865 -7.356 -4.068
259 2HH2 ARG 35 1HH2 ARG 35 0.503 -8.098 -4.860
260 H CYS 36 H CYS 36 -6.433 -4.581 -4.108
261 HA CYS 36 HA CYS 36 -8.081 -6.921 -4.288
262 1HB CYS 36 2HB CYS 36 -7.599 -5.047 -2.001
263 2HB CYS 36 1HB CYS 36 -8.399 -6.608 -1.881
264 H GLY 37 H GLY 37 -8.630 -3.481 -3.913
265 1HA GLY 37 1HA GLY 37 -10.578 -2.271 -4.251
266 2HA GLY 37 2HA GLY 37 -11.418 -3.775 -4.609
267 H ARG 38 H ARG 38 -9.671 -4.003 -1.771
268 HA ARG 38 HA ARG 38 -12.090 -3.841 -0.168
269 1HB ARG 38 2HB ARG 38 -9.531 -5.226 0.022
270 2HB ARG 38 1HB ARG 38 -9.974 -4.449 1.536
271 1HG ARG 38 2HG ARG 38 -11.938 -6.164 0.073
272 2HG ARG 38 1HG ARG 38 -10.708 -6.879 1.120
273 1HD ARG 38 2HD ARG 38 -11.511 -5.484 2.979
274 2HD ARG 38 1HD ARG 38 -12.756 -4.812 1.924
275 HE ARG 38 HE ARG 38 -12.721 -7.703 2.254
276 1HH1 ARG 38 2HH1 ARG 38 -14.158 -4.619 3.115
277 2HH1 ARG 38 1HH1 ARG 38 -15.597 -5.336 3.785
278 1HH2 ARG 38 2HH2 ARG 38 -14.620 -8.645 3.123
279 2HH2 ARG 38 1HH2 ARG 38 -15.855 -7.624 3.804
280 H GLU 39 H GLU 39 -12.360 -2.447 1.570
281 HA GLU 39 HA GLU 39 -11.208 0.124 1.176
282 1HB GLU 39 2HB GLU 39 -12.639 0.833 2.988
283 2HB GLU 39 1HB GLU 39 -13.535 -0.249 1.931
284 1HG GLU 39 2HG GLU 39 -12.176 -1.501 4.229
285 2HG GLU 39 1HG GLU 39 -13.530 -0.437 4.600
286 H LYS 40 H LYS 40 -10.019 1.371 2.681
287 HA LYS 40 HA LYS 40 -7.908 0.125 4.046
288 1HB LYS 40 2HB LYS 40 -8.417 2.658 3.292
289 2HB LYS 40 1HB LYS 40 -8.837 2.785 4.993
290 1HG LYS 40 2HG LYS 40 -6.691 2.571 5.680
291 2HG LYS 40 1HG LYS 40 -6.259 1.486 4.357
292 1HD LYS 40 2HD LYS 40 -5.530 3.168 3.080
293 2HD LYS 40 1HD LYS 40 -6.955 4.148 3.428
294 1HE LYS 40 2HE LYS 40 -5.725 4.386 5.778
295 2HE LYS 40 1HE LYS 40 -4.310 4.086 4.770
296 1HZ LYS 40 1HZ LYS 40 -5.319 5.925 3.294
297 2HZ LYS 40 2HZ LYS 40 -4.513 6.371 4.719
298 3HZ LYS 40 3HZ LYS 40 -6.207 6.338 4.677
299 H THR 41 H THR 41 -8.169 -1.206 5.719
300 HA THR 41 HA THR 41 -10.461 -1.213 7.371
301 HB THR 41 HB THR 41 -8.713 -2.686 8.810
302 HG1 THR 41 1HG THR 41 -7.542 -3.766 6.862
303 1HG2 THR 41 1HG2 THR 41 -9.741 -3.850 6.256
304 2HG2 THR 41 2HG2 THR 41 -10.881 -3.255 7.464
305 3HG2 THR 41 3HG2 THR 41 -9.744 -4.537 7.881
306 H THR 42 H THR 42 -7.352 0.324 7.607
307 HA THR 42 HA THR 42 -8.176 1.476 10.180
308 HB THR 42 HB THR 42 -5.317 1.398 9.236
309 HG1 THR 42 1HG THR 42 -5.682 -0.747 9.368
310 1HG2 THR 42 1HG2 THR 42 -5.057 2.601 11.100
311 2HG2 THR 42 2HG2 THR 42 -5.491 1.155 12.011
312 3HG2 THR 42 3HG2 THR 42 -6.733 2.332 11.581
313 H GLY 43 H GLY 43 -9.317 3.191 9.253
314 1HA GLY 43 1HA GLY 43 -7.701 5.087 7.671
315 2HA GLY 43 2HA GLY 43 -9.452 4.949 7.568
316 HA PRO 44 HA PRO 44 -8.163 7.728 11.269
317 1HB PRO 44 2HB PRO 44 -6.401 9.611 10.019
318 2HB PRO 44 1HB PRO 44 -6.027 8.472 11.313
319 1HG PRO 44 2HG PRO 44 -4.999 8.345 8.753
320 2HG PRO 44 1HG PRO 44 -5.078 6.984 9.883
321 1HD PRO 44 2HD PRO 44 -6.882 7.665 7.598
322 2HD PRO 44 1HD PRO 44 -6.317 6.075 8.159
323 H ILE 45 H ILE 45 -10.392 7.952 10.059
324 HA ILE 45 HA ILE 45 -10.590 10.672 8.942
325 HB ILE 45 HB ILE 45 -12.983 9.729 8.311
326 1HG1 ILE 45 2HG1 ILE 45 -12.039 7.228 7.497
327 1HG2 ILE 45 1HG2 ILE 45 -11.064 10.547 6.851
328 2HG2 ILE 45 2HG2 ILE 45 -10.645 8.845 6.654
329 3HG2 ILE 45 3HG2 ILE 45 -12.220 9.433 6.119
330 1HD1 ILE 45 1HD1 ILE 45 -14.294 8.158 8.685
331 2HD1 ILE 45 2HD1 ILE 45 -13.933 6.459 8.387
332 3HD1 ILE 45 3HD1 ILE 45 -13.595 7.169 9.965
Start of MODEL 14
1 1H GLY 1 1H GLY 1 11.853 -7.288 -12.348
2 2H GLY 1 2H GLY 1 10.876 -8.072 -11.204
3 3H GLY 1 3H GLY 1 12.439 -8.647 -11.522
4 1HA GLY 1 2HA GLY 1 13.379 -7.262 -10.090
5 2HA GLY 1 1HA GLY 1 12.490 -5.904 -10.766
6 H SER 2 H SER 2 11.284 -8.858 -9.233
7 HA SER 2 HA SER 2 9.780 -9.193 -7.577
8 1HB SER 2 2HB SER 2 10.816 -7.098 -5.806
9 2HB SER 2 1HB SER 2 10.749 -8.846 -5.577
10 HG SER 2 HG SER 2 12.548 -8.650 -7.350
11 H MET 3 H MET 3 9.886 -6.092 -6.129
12 HA MET 3 HA MET 3 7.303 -5.409 -7.367
13 1HB MET 3 2HB MET 3 7.640 -6.171 -4.745
14 2HB MET 3 1HB MET 3 7.710 -4.416 -4.638
15 1HG MET 3 2HG MET 3 5.548 -5.048 -6.331
16 2HG MET 3 1HG MET 3 5.435 -6.107 -4.925
17 1HE MET 3 1HE MET 3 3.012 -3.559 -5.309
18 2HE MET 3 2HE MET 3 3.937 -2.057 -5.355
19 3HE MET 3 3HE MET 3 4.299 -3.350 -6.498
20 H SER 4 H SER 4 6.892 -3.222 -7.721
21 HA SER 4 HA SER 4 9.266 -1.591 -7.997
22 1HB SER 4 2HB SER 4 6.996 -0.147 -8.822
23 2HB SER 4 1HB SER 4 8.137 -1.012 -9.851
24 HG SER 4 HG SER 4 5.583 -1.564 -9.449
25 H THR 5 H THR 5 8.874 -1.885 -5.345
26 HA THR 5 HA THR 5 7.090 -0.040 -4.153
27 HB THR 5 HB THR 5 9.382 -0.585 -2.486
28 HG1 THR 5 1HG THR 5 8.415 -3.046 -2.820
29 1HG2 THR 5 1HG2 THR 5 7.747 -1.488 -1.022
30 2HG2 THR 5 2HG2 THR 5 6.623 -1.789 -2.346
31 3HG2 THR 5 3HG2 THR 5 6.972 -0.134 -1.845
32 H LYS 6 H LYS 6 10.649 0.093 -4.504
33 HA LYS 6 HA LYS 6 10.577 2.930 -3.827
34 1HB LYS 6 2HB LYS 6 12.395 0.887 -3.289
35 2HB LYS 6 1HB LYS 6 13.199 1.868 -4.508
36 1HG LYS 6 2HG LYS 6 12.084 3.660 -2.649
37 2HG LYS 6 1HG LYS 6 12.857 2.376 -1.718
38 1HD LYS 6 2HD LYS 6 14.831 3.313 -2.113
39 2HD LYS 6 1HD LYS 6 14.605 3.024 -3.838
40 1HE LYS 6 2HE LYS 6 13.195 5.197 -3.767
41 2HE LYS 6 1HE LYS 6 14.020 5.489 -2.236
42 1HZ LYS 6 1HZ LYS 6 15.418 4.974 -4.808
43 2HZ LYS 6 2HZ LYS 6 16.122 5.442 -3.338
44 3HZ LYS 6 3HZ LYS 6 15.117 6.521 -4.180
45 H ASN 7 H ASN 7 9.558 1.829 -6.391
46 HA ASN 7 HA ASN 7 11.426 2.671 -8.411
47 1HB ASN 7 2HB ASN 7 9.141 1.077 -8.372
48 2HB ASN 7 1HB ASN 7 8.668 2.494 -9.305
49 1HD2 ASN 7 1HD2 ASN 7 8.659 1.741 -11.325
50 2HD2 ASN 7 2HD2 ASN 7 10.025 1.021 -12.119
51 H PHE 8 H PHE 8 8.958 4.060 -6.538
52 HA PHE 8 HA PHE 8 9.426 6.651 -7.794
53 1HB PHE 8 2HB PHE 8 6.829 6.916 -6.994
54 2HB PHE 8 1HB PHE 8 7.327 6.552 -8.641
55 HD1 PHE 8 1HD PHE 8 6.588 4.631 -9.689
56 HD2 PHE 8 2HD PHE 8 6.328 4.935 -5.453
57 HE1 PHE 8 1HE PHE 8 5.292 2.541 -9.623
58 HE2 PHE 8 2HE PHE 8 5.038 2.844 -5.376
59 HZ PHE 8 HZ PHE 8 4.517 1.644 -7.465
60 H ARG 9 H ARG 9 7.653 8.021 -6.062
61 HA ARG 9 HA ARG 9 9.159 7.757 -3.564
62 1HB ARG 9 2HB ARG 9 7.906 10.082 -3.195
63 2HB ARG 9 1HB ARG 9 9.421 9.961 -4.077
64 1HG ARG 9 2HG ARG 9 8.383 11.070 -5.693
65 2HG ARG 9 1HG ARG 9 7.551 9.553 -6.040
66 1HD ARG 9 2HD ARG 9 5.766 10.234 -4.453
67 2HD ARG 9 1HD ARG 9 6.575 11.789 -4.264
68 HE ARG 9 HE ARG 9 6.253 11.775 -6.875
69 1HH1 ARG 9 2HH1 ARG 9 4.000 10.797 -4.384
70 2HH1 ARG 9 1HH1 ARG 9 2.584 11.185 -5.314
71 1HH2 ARG 9 2HH2 ARG 9 4.408 12.322 -8.107
72 2HH2 ARG 9 1HH2 ARG 9 2.818 12.078 -7.440
73 H VAL 10 H VAL 10 8.203 6.791 -1.893
74 HA VAL 10 HA VAL 10 5.293 6.646 -1.744
75 HB VAL 10 HB VAL 10 7.227 5.709 0.377
76 1HG1 VAL 10 1HG1 VAL 10 4.462 4.779 -0.388
77 2HG1 VAL 10 2HG1 VAL 10 5.441 4.153 0.937
78 3HG1 VAL 10 3HG1 VAL 10 4.857 5.816 0.983
79 1HG2 VAL 10 1HG2 VAL 10 7.930 3.985 -0.846
80 2HG2 VAL 10 2HG2 VAL 10 6.288 3.601 -1.365
81 3HG2 VAL 10 3HG2 VAL 10 7.236 4.796 -2.251
82 H SER 11 H SER 11 4.861 8.873 -1.553
83 HA SER 11 HA SER 11 6.210 10.434 0.455
84 1HB SER 11 2HB SER 11 4.132 11.950 -0.656
85 2HB SER 11 1HB SER 11 5.836 11.976 -1.115
86 HG SER 11 HG SER 11 3.745 10.390 -2.218
87 H ASP 12 H ASP 12 3.450 11.954 0.469
88 HA ASP 12 HA ASP 12 2.997 11.288 3.212
89 1HB ASP 12 2HB ASP 12 2.728 13.556 1.743
90 2HB ASP 12 1HB ASP 12 1.049 13.040 1.858
91 H GLY 13 H GLY 13 0.689 11.520 0.511
92 1HA GLY 13 1HA GLY 13 -1.239 10.001 2.044
93 2HA GLY 13 2HA GLY 13 -1.509 10.750 0.480
94 H ASP 14 H ASP 14 1.175 9.253 -0.168
95 HA ASP 14 HA ASP 14 -0.078 7.089 -1.520
96 1HB ASP 14 2HB ASP 14 2.886 7.383 -1.010
97 2HB ASP 14 1HB ASP 14 2.102 6.491 -2.305
98 H TRP 15 H TRP 15 -0.996 5.575 -0.247
99 HA TRP 15 HA TRP 15 0.688 4.354 1.817
100 1HB TRP 15 2HB TRP 15 -1.428 3.397 2.732
101 2HB TRP 15 1HB TRP 15 -1.352 5.150 2.792
102 HD1 TRP 15 HD TRP 15 -2.956 6.492 1.039
103 HE1 TRP 15 1HE TRP 15 -5.243 5.827 0.069
104 HE3 TRP 15 3HE TRP 15 -2.774 1.443 1.852
105 HZ2 TRP 15 2HZ TRP 15 -6.770 3.473 -0.318
106 HZ3 TRP 15 3HZ TRP 15 -4.676 0.062 1.146
107 HH2 TRP 15 HH TRP 15 -6.630 1.056 0.072
108 H ILE 16 H ILE 16 0.372 2.005 2.115
109 HA ILE 16 HA ILE 16 0.121 0.683 -0.483
110 HB ILE 16 HB ILE 16 1.348 -1.199 0.580
111 1HG1 ILE 16 2HG1 ILE 16 2.586 0.219 2.723
112 1HG2 ILE 16 1HG2 ILE 16 2.454 1.488 0.106
113 2HG2 ILE 16 2HG2 ILE 16 3.517 0.341 0.921
114 3HG2 ILE 16 3HG2 ILE 16 2.842 -0.053 -0.659
115 1HD1 ILE 16 1HD1 ILE 16 1.912 -2.352 2.258
116 2HD1 ILE 16 2HD1 ILE 16 2.383 -1.712 3.833
117 3HD1 ILE 16 3HD1 ILE 16 0.677 -1.887 3.429
118 H CYS 17 H CYS 17 -1.032 -1.232 -0.634
119 HA CYS 17 HA CYS 17 -3.553 -1.323 0.243
120 1HB CYS 17 2HB CYS 17 -1.677 -3.530 -0.510
121 2HB CYS 17 1HB CYS 17 -3.366 -3.858 -0.148
122 HA PRO 18 HA PRO 18 -4.022 -2.197 4.452
123 1HB PRO 18 2HB PRO 18 -6.095 -4.196 3.788
124 2HB PRO 18 1HB PRO 18 -6.220 -2.712 4.734
125 1HG PRO 18 2HG PRO 18 -7.250 -2.906 2.274
126 2HG PRO 18 1HG PRO 18 -6.540 -1.396 2.875
127 1HD PRO 18 2HD PRO 18 -5.408 -3.396 0.972
128 2HD PRO 18 1HD PRO 18 -5.253 -1.627 0.984
129 H ASP 19 H ASP 19 -3.674 -5.011 2.358
130 HA ASP 19 HA ASP 19 -2.895 -6.596 4.717
131 1HB ASP 19 2HB ASP 19 -4.982 -7.212 3.185
132 2HB ASP 19 1HB ASP 19 -3.726 -7.971 2.209
133 H LYS 20 H LYS 20 -1.433 -8.450 4.155
134 HA LYS 20 HA LYS 20 0.908 -7.399 2.841
135 1HB LYS 20 2HB LYS 20 0.696 -10.244 3.748
136 2HB LYS 20 1HB LYS 20 2.072 -9.156 3.822
137 1HG LYS 20 2HG LYS 20 1.619 -8.810 5.954
138 2HG LYS 20 1HG LYS 20 0.121 -8.014 5.468
139 1HD LYS 20 2HD LYS 20 -0.725 -10.520 5.305
140 2HD LYS 20 1HD LYS 20 0.571 -10.775 6.474
141 1HE LYS 20 2HE LYS 20 -0.742 -10.008 8.091
142 2HE LYS 20 1HE LYS 20 -0.854 -8.457 7.262
143 1HZ LYS 20 1HZ LYS 20 -3.029 -9.015 7.285
144 2HZ LYS 20 2HZ LYS 20 -2.737 -10.686 7.306
145 3HZ LYS 20 3HZ LYS 20 -2.611 -9.820 5.853
146 H LYS 21 H LYS 21 -1.526 -9.874 2.275
147 HA LYS 21 HA LYS 21 -0.420 -10.988 -0.072
148 1HB LYS 21 2HB LYS 21 -2.697 -11.795 -0.547
149 2HB LYS 21 1HB LYS 21 -2.258 -12.073 1.131
150 1HG LYS 21 2HG LYS 21 -4.119 -11.050 1.762
151 2HG LYS 21 1HG LYS 21 -3.527 -9.557 1.030
152 1HD LYS 21 2HD LYS 21 -4.407 -10.851 -1.168
153 2HD LYS 21 1HD LYS 21 -5.512 -11.505 0.041
154 1HE LYS 21 2HE LYS 21 -6.730 -9.658 -0.208
155 2HE LYS 21 1HE LYS 21 -5.419 -8.776 0.574
156 1HZ LYS 21 1HZ LYS 21 -5.138 -7.665 -1.308
157 2HZ LYS 21 2HZ LYS 21 -6.315 -8.601 -2.092
158 3HZ LYS 21 3HZ LYS 21 -4.701 -9.110 -2.092
159 H CYS 22 H CYS 22 -2.200 -8.109 0.589
160 HA CYS 22 HA CYS 22 -2.798 -7.424 -2.128
161 1HB CYS 22 2HB CYS 22 -3.488 -6.572 0.505
162 2HB CYS 22 1HB CYS 22 -2.795 -5.190 -0.323
163 H GLY 23 H GLY 23 -1.153 -5.338 0.141
164 1HA GLY 23 1HA GLY 23 0.745 -4.067 0.025
165 2HA GLY 23 2HA GLY 23 1.483 -5.516 -0.626
166 H ASN 24 H ASN 24 -1.020 -3.521 -2.172
167 HA ASN 24 HA ASN 24 0.844 -3.001 -4.369
168 1HB ASN 24 2HB ASN 24 -1.165 -3.949 -5.157
169 2HB ASN 24 1HB ASN 24 -2.154 -2.988 -4.080
170 1HD2 ASN 24 1HD2 ASN 24 -2.944 -1.135 -4.733
171 2HD2 ASN 24 2HD2 ASN 24 -2.647 -0.404 -6.271
172 H VAL 25 H VAL 25 0.911 -0.816 -5.275
173 HA VAL 25 HA VAL 25 0.805 1.211 -3.204
174 HB VAL 25 HB VAL 25 1.703 2.661 -5.182
175 1HG1 VAL 25 1HG1 VAL 25 3.356 2.432 -3.685
176 2HG1 VAL 25 2HG1 VAL 25 2.978 0.732 -3.396
177 3HG1 VAL 25 3HG1 VAL 25 3.971 1.191 -4.780
178 1HG2 VAL 25 1HG2 VAL 25 2.175 1.676 -7.127
179 2HG2 VAL 25 2HG2 VAL 25 2.984 0.329 -6.325
180 3HG2 VAL 25 3HG2 VAL 25 1.237 0.292 -6.564
181 H ASN 26 H ASN 26 -0.871 2.498 -2.912
182 HA ASN 26 HA ASN 26 -2.900 2.646 -5.032
183 1HB ASN 26 2HB ASN 26 -3.397 3.546 -2.220
184 2HB ASN 26 1HB ASN 26 -4.527 2.869 -3.388
185 1HD2 ASN 26 1HD2 ASN 26 -4.736 0.658 -3.554
186 2HD2 ASN 26 2HD2 ASN 26 -3.973 -0.454 -2.464
187 H PHE 27 H PHE 27 -4.255 4.795 -4.704
188 HA PHE 27 HA PHE 27 -2.627 6.834 -5.746
189 1HB PHE 27 2HB PHE 27 -5.043 6.547 -6.236
190 2HB PHE 27 1HB PHE 27 -5.422 7.071 -4.609
191 HD1 PHE 27 1HD PHE 27 -3.035 8.411 -7.148
192 HD2 PHE 27 2HD PHE 27 -6.483 9.102 -4.749
193 HE1 PHE 27 1HE PHE 27 -3.107 10.742 -7.926
194 HE2 PHE 27 2HE PHE 27 -6.559 11.435 -5.526
195 HZ PHE 27 HZ PHE 27 -4.871 12.255 -7.114
196 H ALA 28 H ALA 28 -4.763 7.812 -3.167
197 HA ALA 28 HA ALA 28 -2.719 8.308 -1.238
198 1HB ALA 28 1HB ALA 28 -3.270 10.345 -3.220
199 2HB ALA 28 2HB ALA 28 -3.611 10.923 -1.589
200 3HB ALA 28 3HB ALA 28 -2.013 10.289 -1.985
201 H ARG 29 H ARG 29 -5.533 10.320 -1.980
202 HA ARG 29 HA ARG 29 -6.696 9.642 0.573
203 1HB ARG 29 2HB ARG 29 -7.182 11.666 -1.541
204 2HB ARG 29 1HB ARG 29 -8.552 11.223 -0.524
205 1HG ARG 29 2HG ARG 29 -7.772 12.760 0.896
206 2HG ARG 29 1HG ARG 29 -6.553 11.553 1.300
207 1HD ARG 29 2HD ARG 29 -5.588 12.788 -0.993
208 2HD ARG 29 1HD ARG 29 -6.242 14.102 -0.016
209 HE ARG 29 HE ARG 29 -4.819 12.839 1.822
210 1HH1 ARG 29 2HH1 ARG 29 -3.976 13.534 -1.506
211 2HH1 ARG 29 1HH1 ARG 29 -2.273 13.665 -1.182
212 1HH2 ARG 29 2HH2 ARG 29 -2.577 13.043 2.262
213 2HH2 ARG 29 1HH2 ARG 29 -1.481 13.400 0.954
214 H ARG 30 H ARG 30 -6.476 7.458 -1.048
215 HA ARG 30 HA ARG 30 -9.124 6.850 -2.104
216 1HB ARG 30 2HB ARG 30 -6.415 5.612 -2.240
217 2HB ARG 30 1HB ARG 30 -7.797 4.532 -2.339
218 1HG ARG 30 2HG ARG 30 -8.375 6.615 -4.089
219 2HG ARG 30 1HG ARG 30 -6.669 6.252 -4.341
220 1HD ARG 30 2HD ARG 30 -7.245 4.476 -5.535
221 2HD ARG 30 1HD ARG 30 -7.988 3.781 -4.096
222 HE ARG 30 HE ARG 30 -9.929 5.397 -5.003
223 1HH1 ARG 30 2HH1 ARG 30 -7.912 3.025 -6.617
224 2HH1 ARG 30 1HH1 ARG 30 -9.146 2.603 -7.777
225 1HH2 ARG 30 2HH2 ARG 30 -11.540 4.823 -6.484
226 2HH2 ARG 30 1HH2 ARG 30 -11.222 3.590 -7.673
227 H THR 31 H THR 31 -10.550 5.504 -1.092
228 HA THR 31 HA THR 31 -9.949 4.787 1.649
229 HB THR 31 HB THR 31 -12.514 3.824 0.725
230 HG1 THR 31 1HG THR 31 -13.383 5.880 0.143
231 1HG2 THR 31 1HG2 THR 31 -12.792 4.323 2.888
232 2HG2 THR 31 2HG2 THR 31 -12.896 6.016 2.402
233 3HG2 THR 31 3HG2 THR 31 -11.348 5.337 2.908
234 H SER 32 H SER 32 -10.324 3.260 -1.470
235 HA SER 32 HA SER 32 -10.091 0.641 -0.163
236 1HB SER 32 2HB SER 32 -11.052 0.705 -2.950
237 2HB SER 32 1HB SER 32 -11.624 -0.248 -1.582
238 HG SER 32 HG SER 32 -12.117 2.531 -1.931
239 H CYS 33 H CYS 33 -8.930 -1.015 -1.246
240 HA CYS 33 HA CYS 33 -6.412 -0.306 -2.195
241 1HB CYS 33 2HB CYS 33 -6.356 -2.445 -1.417
242 2HB CYS 33 1HB CYS 33 -8.006 -2.785 -1.925
243 H ASP 34 H ASP 34 -5.528 -0.910 -4.338
244 HA ASP 34 HA ASP 34 -7.249 0.415 -6.291
245 1HB ASP 34 2HB ASP 34 -4.536 0.722 -5.550
246 2HB ASP 34 1HB ASP 34 -4.545 0.110 -7.199
247 H ARG 35 H ARG 35 -5.888 -2.703 -5.651
248 HA ARG 35 HA ARG 35 -6.446 -3.495 -8.419
249 1HB ARG 35 2HB ARG 35 -3.777 -3.817 -7.061
250 2HB ARG 35 1HB ARG 35 -4.236 -4.699 -8.511
251 1HG ARG 35 2HG ARG 35 -4.752 -2.285 -9.406
252 2HG ARG 35 1HG ARG 35 -3.596 -1.823 -8.159
253 1HD ARG 35 2HD ARG 35 -2.046 -3.565 -9.139
254 2HD ARG 35 1HD ARG 35 -3.158 -3.659 -10.503
255 HE ARG 35 HE ARG 35 -2.220 -0.995 -9.848
256 1HH1 ARG 35 2HH1 ARG 35 -1.661 -3.900 -11.742
257 2HH1 ARG 35 1HH1 ARG 35 -0.749 -3.068 -12.967
258 1HH2 ARG 35 2HH2 ARG 35 -1.022 0.093 -11.478
259 2HH2 ARG 35 1HH2 ARG 35 -0.396 -0.811 -12.822
260 H CYS 36 H CYS 36 -6.170 -4.520 -5.052
261 HA CYS 36 HA CYS 36 -6.381 -7.304 -6.001
262 1HB CYS 36 2HB CYS 36 -4.667 -7.442 -3.824
263 2HB CYS 36 1HB CYS 36 -4.228 -7.594 -5.528
264 H GLY 37 H GLY 37 -7.421 -5.015 -3.644
265 1HA GLY 37 1HA GLY 37 -8.632 -7.233 -2.133
266 2HA GLY 37 2HA GLY 37 -7.674 -6.040 -1.278
267 H ARG 38 H ARG 38 -8.653 -4.273 -0.545
268 HA ARG 38 HA ARG 38 -11.279 -3.459 -1.372
269 1HB ARG 38 2HB ARG 38 -10.918 -5.416 0.821
270 2HB ARG 38 1HB ARG 38 -12.001 -4.073 1.163
271 1HG ARG 38 2HG ARG 38 -12.265 -5.807 -1.272
272 2HG ARG 38 1HG ARG 38 -13.086 -6.144 0.254
273 1HD ARG 38 2HD ARG 38 -14.693 -4.718 -0.293
274 2HD ARG 38 1HD ARG 38 -13.514 -3.416 -0.398
275 HE ARG 38 HE ARG 38 -13.662 -5.120 -2.732
276 1HH1 ARG 38 2HH1 ARG 38 -14.836 -2.219 -1.160
277 2HH1 ARG 38 1HH1 ARG 38 -15.391 -1.488 -2.641
278 1HH2 ARG 38 2HH2 ARG 38 -14.382 -4.168 -4.677
279 2HH2 ARG 38 1HH2 ARG 38 -15.121 -2.599 -4.643
280 H GLU 39 H GLU 39 -12.086 -2.435 1.191
281 HA GLU 39 HA GLU 39 -10.681 0.007 1.148
282 1HB GLU 39 2HB GLU 39 -12.941 -1.119 2.592
283 2HB GLU 39 1HB GLU 39 -11.993 -0.002 3.562
284 1HG GLU 39 2HG GLU 39 -12.472 1.795 2.220
285 2HG GLU 39 1HG GLU 39 -12.778 0.793 0.803
286 H LYS 40 H LYS 40 -9.381 0.994 2.718
287 HA LYS 40 HA LYS 40 -7.353 -0.695 3.729
288 1HB LYS 40 2HB LYS 40 -7.503 1.985 3.181
289 2HB LYS 40 1HB LYS 40 -7.462 1.971 4.941
290 1HG LYS 40 2HG LYS 40 -5.524 0.129 4.092
291 2HG LYS 40 1HG LYS 40 -5.338 1.556 3.073
292 1HD LYS 40 2HD LYS 40 -5.363 2.916 5.217
293 2HD LYS 40 1HD LYS 40 -5.198 1.383 6.077
294 1HE LYS 40 2HE LYS 40 -3.290 2.560 4.061
295 2HE LYS 40 1HE LYS 40 -3.016 2.366 5.790
296 1HZ LYS 40 1HZ LYS 40 -3.607 -0.152 4.944
297 2HZ LYS 40 2HZ LYS 40 -2.052 0.454 5.239
298 3HZ LYS 40 3HZ LYS 40 -2.678 0.468 3.665
299 H THR 41 H THR 41 -7.679 -2.033 5.316
300 HA THR 41 HA THR 41 -9.578 -1.544 7.412
301 HB THR 41 HB THR 41 -8.536 -3.790 8.231
302 HG1 THR 41 1HG THR 41 -7.320 -4.860 6.696
303 1HG2 THR 41 1HG2 THR 41 -9.786 -3.954 5.513
304 2HG2 THR 41 2HG2 THR 41 -10.703 -3.310 6.877
305 3HG2 THR 41 3HG2 THR 41 -10.075 -4.957 6.940
306 H THR 42 H THR 42 -9.016 -1.725 9.690
307 HA THR 42 HA THR 42 -6.458 -0.475 10.331
308 HB THR 42 HB THR 42 -8.287 -1.108 12.545
309 HG1 THR 42 1HG THR 42 -9.143 0.985 10.853
310 1HG2 THR 42 1HG2 THR 42 -7.780 1.676 12.162
311 2HG2 THR 42 2HG2 THR 42 -6.286 0.781 11.888
312 3HG2 THR 42 3HG2 THR 42 -7.154 0.601 13.411
313 H GLY 43 H GLY 43 -4.834 -1.886 10.537
314 1HA GLY 43 1HA GLY 43 -5.375 -4.615 11.391
315 2HA GLY 43 2HA GLY 43 -3.851 -3.995 10.773
316 HA PRO 44 HA PRO 44 -3.077 -4.445 15.237
317 1HB PRO 44 2HB PRO 44 -0.333 -4.983 14.509
318 2HB PRO 44 1HB PRO 44 -1.517 -6.085 15.212
319 1HG PRO 44 2HG PRO 44 -0.535 -6.329 12.672
320 2HG PRO 44 1HG PRO 44 -2.127 -6.925 13.176
321 1HD PRO 44 2HD PRO 44 -1.420 -4.408 11.713
322 2HD PRO 44 1HD PRO 44 -2.777 -5.522 11.441
323 H ILE 45 H ILE 45 -2.033 -2.306 12.881
324 HA ILE 45 HA ILE 45 -0.830 -0.558 14.897
325 HB ILE 45 HB ILE 45 0.613 0.256 12.811
326 1HG1 ILE 45 2HG1 ILE 45 1.360 -2.321 12.047
327 1HG2 ILE 45 1HG2 ILE 45 1.301 -2.053 14.620
328 2HG2 ILE 45 2HG2 ILE 45 2.471 -1.152 13.655
329 3HG2 ILE 45 3HG2 ILE 45 1.569 -0.337 14.932
330 1HD1 ILE 45 1HD1 ILE 45 0.115 -0.014 10.738
331 2HD1 ILE 45 2HD1 ILE 45 1.498 -0.994 10.252
332 3HD1 ILE 45 3HD1 ILE 45 -0.141 -1.566 9.942
Start of MODEL 15
1 1H GLY 1 1H GLY 1 -10.741 13.761 -10.615
2 2H GLY 1 2H GLY 1 -9.928 15.210 -10.279
3 3H GLY 1 3H GLY 1 -10.012 13.989 -9.104
4 1HA GLY 1 2HA GLY 1 -7.932 14.373 -10.773
5 2HA GLY 1 1HA GLY 1 -8.290 12.875 -9.928
6 H SER 2 H SER 2 -9.775 14.510 -12.720
7 HA SER 2 HA SER 2 -10.082 11.946 -14.029
8 1HB SER 2 2HB SER 2 -10.875 14.178 -15.659
9 2HB SER 2 1HB SER 2 -11.885 12.940 -14.911
10 HG SER 2 HG SER 2 -12.455 14.993 -14.141
11 H MET 3 H MET 3 -7.956 11.388 -14.532
12 HA MET 3 HA MET 3 -6.237 11.076 -15.980
13 1HB MET 3 2HB MET 3 -8.320 11.794 -17.574
14 2HB MET 3 1HB MET 3 -7.139 13.027 -17.994
15 1HG MET 3 2HG MET 3 -5.898 11.595 -19.157
16 2HG MET 3 1HG MET 3 -6.003 10.354 -17.910
17 1HE MET 3 1HE MET 3 -8.085 11.836 -21.143
18 2HE MET 3 2HE MET 3 -9.599 11.082 -20.646
19 3HE MET 3 3HE MET 3 -8.803 12.243 -19.582
20 H SER 4 H SER 4 -6.370 13.464 -14.099
21 HA SER 4 HA SER 4 -4.544 15.320 -15.388
22 1HB SER 4 2HB SER 4 -4.993 15.683 -12.519
23 2HB SER 4 1HB SER 4 -5.271 16.806 -13.851
24 HG SER 4 HG SER 4 -7.282 16.041 -14.115
25 H THR 5 H THR 5 -4.554 13.255 -12.492
26 HA THR 5 HA THR 5 -1.625 13.302 -12.500
27 HB THR 5 HB THR 5 -2.835 11.903 -10.259
28 HG1 THR 5 1HG THR 5 -3.674 13.958 -9.348
29 1HG2 THR 5 1HG2 THR 5 -0.551 13.353 -10.785
30 2HG2 THR 5 2HG2 THR 5 -1.076 12.802 -9.194
31 3HG2 THR 5 3HG2 THR 5 -1.471 14.434 -9.737
32 H LYS 6 H LYS 6 -0.431 11.430 -12.660
33 HA LYS 6 HA LYS 6 -1.922 9.065 -13.544
34 1HB LYS 6 2HB LYS 6 0.578 10.314 -14.329
35 2HB LYS 6 1HB LYS 6 0.797 8.605 -13.968
36 1HG LYS 6 2HG LYS 6 -0.992 9.862 -16.022
37 2HG LYS 6 1HG LYS 6 0.329 8.718 -16.264
38 1HD LYS 6 2HD LYS 6 -1.008 7.038 -14.973
39 2HD LYS 6 1HD LYS 6 -2.356 8.175 -15.003
40 1HE LYS 6 2HE LYS 6 -2.454 8.087 -17.394
41 2HE LYS 6 1HE LYS 6 -0.963 7.147 -17.466
42 1HZ LYS 6 1HZ LYS 6 -2.205 5.419 -16.134
43 2HZ LYS 6 2HZ LYS 6 -2.696 5.617 -17.748
44 3HZ LYS 6 3HZ LYS 6 -3.622 6.282 -16.494
45 H ASN 7 H ASN 7 -1.269 6.971 -12.805
46 HA ASN 7 HA ASN 7 -0.320 7.044 -10.036
47 1HB ASN 7 2HB ASN 7 -1.819 5.433 -9.544
48 2HB ASN 7 1HB ASN 7 -2.562 5.858 -11.080
49 1HD2 ASN 7 1HD2 ASN 7 -0.699 3.523 -9.340
50 2HD2 ASN 7 2HD2 ASN 7 -0.744 2.281 -10.553
51 H PHE 8 H PHE 8 1.555 6.159 -9.467
52 HA PHE 8 HA PHE 8 2.725 4.035 -11.032
53 1HB PHE 8 2HB PHE 8 4.975 5.419 -10.693
54 2HB PHE 8 1HB PHE 8 3.981 5.605 -12.129
55 HD1 PHE 8 1HD PHE 8 4.735 7.091 -8.823
56 HD2 PHE 8 2HD PHE 8 3.067 7.685 -12.692
57 HE1 PHE 8 1HE PHE 8 4.571 9.504 -8.378
58 HE2 PHE 8 2HE PHE 8 2.900 10.099 -12.255
59 HZ PHE 8 HZ PHE 8 3.654 11.011 -10.095
60 H ARG 9 H ARG 9 5.254 4.216 -9.670
61 HA ARG 9 HA ARG 9 4.369 3.286 -7.030
62 1HB ARG 9 2HB ARG 9 5.859 1.940 -8.767
63 2HB ARG 9 1HB ARG 9 7.152 2.866 -8.018
64 1HG ARG 9 2HG ARG 9 7.221 1.115 -6.620
65 2HG ARG 9 1HG ARG 9 5.904 1.972 -5.816
66 1HD ARG 9 2HD ARG 9 4.525 0.278 -6.212
67 2HD ARG 9 1HD ARG 9 4.826 0.410 -7.944
68 HE ARG 9 HE ARG 9 6.131 -1.411 -6.065
69 1HH1 ARG 9 2HH1 ARG 9 5.870 -0.163 -9.325
70 2HH1 ARG 9 1HH1 ARG 9 6.757 -1.470 -10.044
71 1HH2 ARG 9 2HH2 ARG 9 7.322 -3.130 -6.995
72 2HH2 ARG 9 1HH2 ARG 9 7.591 -3.158 -8.714
73 H VAL 10 H VAL 10 4.178 5.345 -6.092
74 HA VAL 10 HA VAL 10 6.744 6.719 -5.621
75 HB VAL 10 HB VAL 10 5.335 8.156 -6.946
76 1HG1 VAL 10 1HG1 VAL 10 3.107 8.715 -6.494
77 2HG1 VAL 10 2HG1 VAL 10 3.192 6.973 -6.236
78 3HG1 VAL 10 3HG1 VAL 10 3.183 8.070 -4.855
79 1HG2 VAL 10 1HG2 VAL 10 6.326 8.851 -4.427
80 2HG2 VAL 10 2HG2 VAL 10 5.959 9.933 -5.770
81 3HG2 VAL 10 3HG2 VAL 10 4.739 9.612 -4.538
82 H SER 11 H SER 11 7.334 7.029 -3.539
83 HA SER 11 HA SER 11 5.448 6.180 -1.468
84 1HB SER 11 2HB SER 11 8.439 6.520 -1.507
85 2HB SER 11 1HB SER 11 7.535 6.390 0.002
86 HG SER 11 HG SER 11 6.584 4.433 -1.259
87 H ASP 12 H ASP 12 4.215 8.062 -1.761
88 HA ASP 12 HA ASP 12 5.420 10.583 -0.845
89 1HB ASP 12 2HB ASP 12 4.255 10.458 -3.088
90 2HB ASP 12 1HB ASP 12 2.753 10.191 -2.214
91 H GLY 13 H GLY 13 2.180 10.960 -0.605
92 1HA GLY 13 1HA GLY 13 2.123 10.220 2.238
93 2HA GLY 13 2HA GLY 13 1.018 11.326 1.435
94 H ASP 14 H ASP 14 1.974 8.293 0.145
95 HA ASP 14 HA ASP 14 -0.765 7.480 -0.210
96 1HB ASP 14 2HB ASP 14 0.196 5.619 -1.479
97 2HB ASP 14 1HB ASP 14 0.914 7.147 -1.984
98 H TRP 15 H TRP 15 -0.720 4.813 -0.068
99 HA TRP 15 HA TRP 15 0.314 3.904 2.469
100 1HB TRP 15 2HB TRP 15 -1.843 3.186 3.352
101 2HB TRP 15 1HB TRP 15 -1.871 4.924 3.082
102 HD1 TRP 15 HD TRP 15 -3.249 5.739 0.801
103 HE1 TRP 15 1HE TRP 15 -5.364 4.718 -0.256
104 HE3 TRP 15 3HE TRP 15 -3.103 1.102 2.966
105 HZ2 TRP 15 2HZ TRP 15 -6.779 2.275 -0.187
106 HZ3 TRP 15 3HZ TRP 15 -4.860 -0.514 2.433
107 HH2 TRP 15 HH TRP 15 -6.668 0.057 0.870
108 H ILE 16 H ILE 16 -0.148 1.491 2.678
109 HA ILE 16 HA ILE 16 -0.565 0.290 0.042
110 HB ILE 16 HB ILE 16 0.918 -1.533 0.695
111 1HG1 ILE 16 2HG1 ILE 16 2.375 -0.334 2.829
112 1HG2 ILE 16 1HG2 ILE 16 1.680 0.651 -0.441
113 2HG2 ILE 16 2HG2 ILE 16 2.512 0.959 1.085
114 3HG2 ILE 16 3HG2 ILE 16 2.899 -0.482 0.142
115 1HD1 ILE 16 1HD1 ILE 16 1.203 -2.460 3.983
116 2HD1 ILE 16 2HD1 ILE 16 1.017 -2.881 2.279
117 3HD1 ILE 16 3HD1 ILE 16 2.622 -2.563 2.939
118 H CYS 17 H CYS 17 -1.693 -1.621 -0.036
119 HA CYS 17 HA CYS 17 -3.970 -1.956 1.300
120 1HB CYS 17 2HB CYS 17 -2.323 -4.328 0.472
121 2HB CYS 17 1HB CYS 17 -4.056 -4.101 0.323
122 HA PRO 18 HA PRO 18 -3.279 -2.998 5.455
123 1HB PRO 18 2HB PRO 18 -5.713 -4.686 5.266
124 2HB PRO 18 1HB PRO 18 -5.371 -3.324 6.339
125 1HG PRO 18 2HG PRO 18 -7.054 -3.037 4.313
126 2HG PRO 18 1HG PRO 18 -5.902 -1.749 4.717
127 1HD PRO 18 2HD PRO 18 -5.735 -3.802 2.535
128 2HD PRO 18 1HD PRO 18 -5.381 -2.066 2.471
129 H ASP 19 H ASP 19 -3.856 -5.477 3.093
130 HA ASP 19 HA ASP 19 -2.461 -7.454 4.766
131 1HB ASP 19 2HB ASP 19 -4.650 -8.253 4.216
132 2HB ASP 19 1HB ASP 19 -4.467 -7.782 2.533
133 H LYS 20 H LYS 20 -0.492 -8.070 4.124
134 HA LYS 20 HA LYS 20 0.660 -6.599 1.939
135 1HB LYS 20 2HB LYS 20 1.584 -7.565 4.368
136 2HB LYS 20 1HB LYS 20 2.429 -8.544 3.177
137 1HG LYS 20 2HG LYS 20 3.576 -6.760 2.309
138 2HG LYS 20 1HG LYS 20 2.338 -5.597 2.785
139 1HD LYS 20 2HD LYS 20 3.039 -6.207 5.205
140 2HD LYS 20 1HD LYS 20 4.500 -6.838 4.442
141 1HE LYS 20 2HE LYS 20 5.316 -4.790 4.068
142 2HE LYS 20 1HE LYS 20 3.765 -4.192 3.476
143 1HZ LYS 20 1HZ LYS 20 3.089 -4.138 5.904
144 2HZ LYS 20 2HZ LYS 20 4.209 -2.965 5.403
145 3HZ LYS 20 3HZ LYS 20 4.732 -4.327 6.269
146 H LYS 21 H LYS 21 -1.091 -9.272 1.611
147 HA LYS 21 HA LYS 21 0.709 -10.816 -0.027
148 1HB LYS 21 2HB LYS 21 -0.890 -12.366 0.199
149 2HB LYS 21 1HB LYS 21 -1.880 -11.204 1.066
150 1HG LYS 21 2HG LYS 21 -2.563 -10.421 -1.318
151 2HG LYS 21 1HG LYS 21 -1.990 -12.019 -1.800
152 1HD LYS 21 2HD LYS 21 -4.068 -11.473 0.320
153 2HD LYS 21 1HD LYS 21 -4.412 -11.978 -1.334
154 1HE LYS 21 2HE LYS 21 -4.019 -14.119 -0.849
155 2HE LYS 21 1HE LYS 21 -2.488 -13.725 -0.068
156 1HZ LYS 21 1HZ LYS 21 -3.471 -13.546 1.978
157 2HZ LYS 21 2HZ LYS 21 -4.414 -14.774 1.291
158 3HZ LYS 21 3HZ LYS 21 -5.004 -13.183 1.349
159 H CYS 22 H CYS 22 -1.564 -8.223 -0.409
160 HA CYS 22 HA CYS 22 -1.022 -8.034 -3.274
161 1HB CYS 22 2HB CYS 22 -3.349 -7.726 -2.488
162 2HB CYS 22 1HB CYS 22 -2.826 -6.405 -1.467
163 H GLY 23 H GLY 23 -1.237 -5.679 -0.616
164 1HA GLY 23 1HA GLY 23 0.092 -3.911 -0.028
165 2HA GLY 23 2HA GLY 23 1.450 -4.903 -0.552
166 H ASN 24 H ASN 24 -1.283 -3.350 -2.180
167 HA ASN 24 HA ASN 24 0.475 -2.567 -4.370
168 1HB ASN 24 2HB ASN 24 -1.540 -3.412 -5.169
169 2HB ASN 24 1HB ASN 24 -2.484 -2.677 -3.894
170 1HD2 ASN 24 1HD2 ASN 24 -3.245 -0.637 -4.119
171 2HD2 ASN 24 2HD2 ASN 24 -3.133 0.263 -5.588
172 H VAL 25 H VAL 25 0.732 -0.417 -5.059
173 HA VAL 25 HA VAL 25 0.704 1.532 -2.940
174 HB VAL 25 HB VAL 25 1.457 3.048 -4.955
175 1HG1 VAL 25 1HG1 VAL 25 3.790 2.209 -4.638
176 2HG1 VAL 25 2HG1 VAL 25 2.911 2.507 -3.136
177 3HG1 VAL 25 3HG1 VAL 25 3.115 0.857 -3.725
178 1HG2 VAL 25 1HG2 VAL 25 2.476 0.496 -6.091
179 2HG2 VAL 25 2HG2 VAL 25 0.830 0.982 -6.493
180 3HG2 VAL 25 3HG2 VAL 25 2.185 2.045 -6.879
181 H ASN 26 H ASN 26 -1.469 1.833 -2.485
182 HA ASN 26 HA ASN 26 -3.322 2.539 -4.581
183 1HB ASN 26 2HB ASN 26 -4.173 3.092 -1.823
184 2HB ASN 26 1HB ASN 26 -4.952 2.119 -3.065
185 1HD2 ASN 26 1HD2 ASN 26 -4.887 -0.022 -2.858
186 2HD2 ASN 26 2HD2 ASN 26 -3.894 -0.895 -1.745
187 H PHE 27 H PHE 27 -3.602 4.439 -5.372
188 HA PHE 27 HA PHE 27 -2.056 6.465 -5.567
189 1HB PHE 27 2HB PHE 27 -4.364 6.307 -6.527
190 2HB PHE 27 1HB PHE 27 -4.970 7.037 -5.047
191 HD1 PHE 27 1HD PHE 27 -2.163 7.752 -7.408
192 HD2 PHE 27 2HD PHE 27 -5.564 9.219 -5.309
193 HE1 PHE 27 1HE PHE 27 -1.790 9.983 -8.374
194 HE2 PHE 27 2HE PHE 27 -5.196 11.453 -6.272
195 HZ PHE 27 HZ PHE 27 -3.305 11.839 -7.806
196 H ALA 28 H ALA 28 -4.633 7.378 -3.335
197 HA ALA 28 HA ALA 28 -3.129 7.879 -1.047
198 1HB ALA 28 1HB ALA 28 -2.167 9.598 -2.818
199 2HB ALA 28 2HB ALA 28 -3.603 10.514 -2.362
200 3HB ALA 28 3HB ALA 28 -2.417 10.063 -1.135
201 H ARG 29 H ARG 29 -5.531 9.408 -3.116
202 HA ARG 29 HA ARG 29 -7.365 9.773 -0.896
203 1HB ARG 29 2HB ARG 29 -7.522 10.482 -3.832
204 2HB ARG 29 1HB ARG 29 -8.816 10.799 -2.682
205 1HG ARG 29 2HG ARG 29 -7.748 12.552 -1.761
206 2HG ARG 29 1HG ARG 29 -6.160 11.795 -1.906
207 1HD ARG 29 2HD ARG 29 -5.731 12.860 -3.818
208 2HD ARG 29 1HD ARG 29 -7.302 12.427 -4.493
209 HE ARG 29 HE ARG 29 -8.191 14.355 -3.185
210 1HH1 ARG 29 2HH1 ARG 29 -4.814 14.287 -4.166
211 2HH1 ARG 29 1HH1 ARG 29 -4.649 16.021 -4.111
212 1HH2 ARG 29 2HH2 ARG 29 -7.957 16.598 -3.101
213 2HH2 ARG 29 1HH2 ARG 29 -6.432 17.327 -3.516
214 H ARG 30 H ARG 30 -6.497 7.146 -1.949
215 HA ARG 30 HA ARG 30 -8.992 6.008 -2.945
216 1HB ARG 30 2HB ARG 30 -6.149 5.060 -2.797
217 2HB ARG 30 1HB ARG 30 -7.445 3.880 -2.908
218 1HG ARG 30 2HG ARG 30 -7.864 5.886 -4.885
219 2HG ARG 30 1HG ARG 30 -6.202 5.311 -4.994
220 1HD ARG 30 2HD ARG 30 -7.270 3.790 -6.344
221 2HD ARG 30 1HD ARG 30 -7.326 2.953 -4.792
222 HE ARG 30 HE ARG 30 -9.649 3.977 -4.613
223 1HH1 ARG 30 2HH1 ARG 30 -8.151 3.070 -7.666
224 2HH1 ARG 30 1HH1 ARG 30 -9.682 2.854 -8.477
225 1HH2 ARG 30 2HH2 ARG 30 -11.634 3.654 -5.679
226 2HH2 ARG 30 1HH2 ARG 30 -11.647 3.159 -7.346
227 H THR 31 H THR 31 -10.406 5.414 -1.416
228 HA THR 31 HA THR 31 -9.526 4.670 1.235
229 HB THR 31 HB THR 31 -12.321 4.096 0.491
230 HG1 THR 31 1HG THR 31 -12.881 6.093 -0.079
231 1HG2 THR 31 1HG2 THR 31 -12.509 4.349 2.698
232 2HG2 THR 31 2HG2 THR 31 -12.028 6.039 2.552
233 3HG2 THR 31 3HG2 THR 31 -10.804 4.793 2.793
234 H SER 32 H SER 32 -9.564 3.152 -1.644
235 HA SER 32 HA SER 32 -9.488 0.524 -0.392
236 1HB SER 32 2HB SER 32 -10.733 -0.006 -2.814
237 2HB SER 32 1HB SER 32 -11.524 0.001 -1.235
238 HG SER 32 HG SER 32 -12.705 1.473 -2.245
239 H CYS 33 H CYS 33 -8.432 -1.065 -1.833
240 HA CYS 33 HA CYS 33 -6.150 -0.079 -3.135
241 1HB CYS 33 2HB CYS 33 -6.460 -2.371 -2.166
242 2HB CYS 33 1HB CYS 33 -7.445 -2.770 -3.564
243 H ASP 34 H ASP 34 -5.541 -0.573 -5.352
244 HA ASP 34 HA ASP 34 -7.703 -0.111 -7.280
245 1HB ASP 34 2HB ASP 34 -5.103 0.955 -7.068
246 2HB ASP 34 1HB ASP 34 -5.042 -0.159 -8.429
247 H ARG 35 H ARG 35 -6.036 -2.514 -5.809
248 HA ARG 35 HA ARG 35 -6.257 -4.325 -8.122
249 1HB ARG 35 2HB ARG 35 -3.911 -3.652 -7.165
250 2HB ARG 35 1HB ARG 35 -4.308 -4.824 -5.914
251 1HG ARG 35 2HG ARG 35 -4.534 -5.569 -8.793
252 2HG ARG 35 1HG ARG 35 -2.964 -5.566 -7.989
253 1HD ARG 35 2HD ARG 35 -5.325 -6.985 -6.802
254 2HD ARG 35 1HD ARG 35 -4.314 -7.755 -8.024
255 HE ARG 35 HE ARG 35 -3.364 -6.842 -5.373
256 1HH1 ARG 35 2HH1 ARG 35 -3.148 -8.930 -8.182
257 2HH1 ARG 35 1HH1 ARG 35 -1.843 -9.882 -7.532
258 1HH2 ARG 35 2HH2 ARG 35 -1.653 -8.075 -4.527
259 2HH2 ARG 35 1HH2 ARG 35 -0.982 -9.391 -5.450
260 H CYS 36 H CYS 36 -5.879 -4.595 -4.532
261 HA CYS 36 HA CYS 36 -7.385 -7.057 -4.628
262 1HB CYS 36 2HB CYS 36 -6.975 -7.200 -2.195
263 2HB CYS 36 1HB CYS 36 -5.497 -7.016 -3.115
264 H GLY 37 H GLY 37 -7.985 -3.757 -3.978
265 1HA GLY 37 1HA GLY 37 -10.031 -2.691 -3.817
266 2HA GLY 37 2HA GLY 37 -10.813 -4.265 -3.848
267 H ARG 38 H ARG 38 -8.395 -4.241 -1.537
268 HA ARG 38 HA ARG 38 -10.236 -4.432 0.607
269 1HB ARG 38 2HB ARG 38 -7.359 -4.661 0.232
270 2HB ARG 38 1HB ARG 38 -7.762 -3.874 1.752
271 1HG ARG 38 2HG ARG 38 -7.737 -6.043 2.426
272 2HG ARG 38 1HG ARG 38 -9.434 -5.897 1.968
273 1HD ARG 38 2HD ARG 38 -8.598 -7.936 1.044
274 2HD ARG 38 1HD ARG 38 -8.828 -6.796 -0.281
275 HE ARG 38 HE ARG 38 -6.453 -6.491 -0.381
276 1HH1 ARG 38 2HH1 ARG 38 -7.562 -9.168 1.599
277 2HH1 ARG 38 1HH1 ARG 38 -6.010 -9.954 1.629
278 1HH2 ARG 38 2HH2 ARG 38 -4.421 -7.525 -0.356
279 2HH2 ARG 38 1HH2 ARG 38 -4.202 -8.998 0.547
280 H GLU 39 H GLU 39 -10.803 -2.972 2.182
281 HA GLU 39 HA GLU 39 -10.586 -0.207 1.391
282 1HB GLU 39 2HB GLU 39 -11.814 -0.796 3.999
283 2HB GLU 39 1HB GLU 39 -12.417 0.169 2.660
284 1HG GLU 39 2HG GLU 39 -13.907 -1.463 2.399
285 2HG GLU 39 1HG GLU 39 -12.588 -2.360 1.646
286 H LYS 40 H LYS 40 -9.600 1.423 2.504
287 HA LYS 40 HA LYS 40 -7.196 0.785 3.805
288 1HB LYS 40 2HB LYS 40 -7.745 2.903 2.514
289 2HB LYS 40 1HB LYS 40 -8.600 3.449 3.952
290 1HG LYS 40 2HG LYS 40 -6.360 2.953 5.161
291 2HG LYS 40 1HG LYS 40 -5.674 3.029 3.537
292 1HD LYS 40 2HD LYS 40 -5.839 5.257 3.466
293 2HD LYS 40 1HD LYS 40 -7.489 5.234 4.090
294 1HE LYS 40 2HE LYS 40 -5.579 4.521 6.139
295 2HE LYS 40 1HE LYS 40 -5.192 6.085 5.423
296 1HZ LYS 40 1HZ LYS 40 -7.284 5.402 7.221
297 2HZ LYS 40 2HZ LYS 40 -7.918 6.113 5.818
298 3HZ LYS 40 3HZ LYS 40 -6.746 6.932 6.730
299 H THR 41 H THR 41 -7.425 -0.397 5.629
300 HA THR 41 HA THR 41 -9.222 0.493 7.732
301 HB THR 41 HB THR 41 -7.679 -1.681 8.641
302 HG1 THR 41 1HG THR 41 -8.481 -1.933 5.905
303 1HG2 THR 41 1HG2 THR 41 -10.370 -0.982 8.273
304 2HG2 THR 41 2HG2 THR 41 -9.738 -2.380 9.142
305 3HG2 THR 41 3HG2 THR 41 -10.149 -2.515 7.430
306 H THR 42 H THR 42 -8.533 1.918 9.187
307 HA THR 42 HA THR 42 -5.630 2.267 9.506
308 HB THR 42 HB THR 42 -7.438 4.418 10.426
309 HG1 THR 42 1HG THR 42 -7.980 3.346 8.127
310 1HG2 THR 42 1HG2 THR 42 -5.096 4.614 8.550
311 2HG2 THR 42 2HG2 THR 42 -4.868 4.410 10.287
312 3HG2 THR 42 3HG2 THR 42 -5.719 5.826 9.671
313 H GLY 43 H GLY 43 -4.846 1.489 11.320
314 1HA GLY 43 1HA GLY 43 -5.827 2.259 13.869
315 2HA GLY 43 2HA GLY 43 -6.293 0.596 13.526
316 HA PRO 44 HA PRO 44 -2.162 -0.587 14.834
317 1HB PRO 44 2HB PRO 44 -2.564 -3.054 13.310
318 2HB PRO 44 1HB PRO 44 -2.386 -2.844 15.054
319 1HG PRO 44 2HG PRO 44 -4.731 -3.555 13.914
320 2HG PRO 44 1HG PRO 44 -4.648 -2.571 15.386
321 1HD PRO 44 2HD PRO 44 -5.140 -1.717 12.558
322 2HD PRO 44 1HD PRO 44 -5.919 -1.162 14.054
323 H ILE 45 H ILE 45 -3.365 -0.560 11.613
324 HA ILE 45 HA ILE 45 -0.731 0.143 10.598
325 HB ILE 45 HB ILE 45 -1.667 -1.283 8.467
326 1HG1 ILE 45 2HG1 ILE 45 -1.944 -3.421 10.443
327 1HG2 ILE 45 1HG2 ILE 45 0.233 -2.068 10.655
328 2HG2 ILE 45 2HG2 ILE 45 0.015 -3.039 9.199
329 3HG2 ILE 45 3HG2 ILE 45 0.598 -1.379 9.072
330 1HD1 ILE 45 1HD1 ILE 45 -3.777 -4.128 9.072
331 2HD1 ILE 45 2HD1 ILE 45 -3.772 -2.589 8.206
332 3HD1 ILE 45 3HD1 ILE 45 -2.412 -3.699 8.041
Start of MODEL 16
1 1H GLY 1 1H GLY 1 17.837 8.257 -14.370
2 2H GLY 1 2H GLY 1 16.682 7.203 -15.028
3 3H GLY 1 3H GLY 1 16.802 8.796 -15.599
4 1HA GLY 1 2HA GLY 1 17.911 6.710 -16.819
5 2HA GLY 1 1HA GLY 1 18.512 8.357 -16.950
6 H SER 2 H SER 2 20.044 8.989 -15.109
7 HA SER 2 HA SER 2 21.957 6.781 -14.774
8 1HB SER 2 2HB SER 2 22.830 9.545 -14.197
9 2HB SER 2 1HB SER 2 23.638 8.275 -15.117
10 HG SER 2 HG SER 2 22.168 8.716 -16.842
11 H MET 3 H MET 3 22.417 6.044 -12.802
12 HA MET 3 HA MET 3 22.272 5.688 -10.563
13 1HB MET 3 2HB MET 3 23.340 8.284 -10.974
14 2HB MET 3 1HB MET 3 22.268 8.372 -9.583
15 1HG MET 3 2HG MET 3 23.987 6.038 -9.513
16 2HG MET 3 1HG MET 3 24.893 7.549 -9.579
17 1HE MET 3 1HE MET 3 22.416 5.355 -7.958
18 2HE MET 3 2HE MET 3 23.741 5.099 -6.824
19 3HE MET 3 3HE MET 3 22.263 5.895 -6.285
20 H SER 4 H SER 4 19.828 5.545 -11.685
21 HA SER 4 HA SER 4 18.107 6.622 -9.583
22 1HB SER 4 2HB SER 4 16.586 6.880 -11.942
23 2HB SER 4 1HB SER 4 17.202 8.182 -10.925
24 HG SER 4 HG SER 4 19.193 7.983 -12.189
25 H THR 5 H THR 5 17.540 4.675 -8.747
26 HA THR 5 HA THR 5 16.894 2.437 -10.437
27 HB THR 5 HB THR 5 16.037 2.072 -7.715
28 HG1 THR 5 1HG THR 5 18.749 2.525 -7.601
29 1HG2 THR 5 1HG2 THR 5 18.345 0.975 -9.332
30 2HG2 THR 5 2HG2 THR 5 16.744 0.256 -9.153
31 3HG2 THR 5 3HG2 THR 5 17.828 0.348 -7.766
32 H LYS 6 H LYS 6 14.822 2.742 -7.721
33 HA LYS 6 HA LYS 6 12.537 3.111 -9.531
34 1HB LYS 6 2HB LYS 6 12.568 2.076 -6.688
35 2HB LYS 6 1HB LYS 6 11.179 2.116 -7.766
36 1HG LYS 6 2HG LYS 6 12.503 0.603 -9.306
37 2HG LYS 6 1HG LYS 6 13.631 0.396 -7.965
38 1HD LYS 6 2HD LYS 6 12.263 -1.019 -6.913
39 2HD LYS 6 1HD LYS 6 10.871 0.044 -7.139
40 1HE LYS 6 2HE LYS 6 10.120 -1.142 -8.874
41 2HE LYS 6 1HE LYS 6 11.716 -1.206 -9.616
42 1HZ LYS 6 1HZ LYS 6 11.356 -3.398 -9.167
43 2HZ LYS 6 2HZ LYS 6 10.452 -3.097 -7.764
44 3HZ LYS 6 3HZ LYS 6 12.144 -2.942 -7.733
45 H ASN 7 H ASN 7 10.653 4.324 -8.584
46 HA ASN 7 HA ASN 7 11.633 6.768 -7.320
47 1HB ASN 7 2HB ASN 7 10.036 6.735 -9.338
48 2HB ASN 7 1HB ASN 7 8.789 6.265 -8.188
49 1HD2 ASN 7 1HD2 ASN 7 10.335 8.814 -9.656
50 2HD2 ASN 7 2HD2 ASN 7 9.847 10.091 -8.592
51 H PHE 8 H PHE 8 12.044 5.918 -5.255
52 HA PHE 8 HA PHE 8 9.835 4.745 -3.777
53 1HB PHE 8 2HB PHE 8 12.706 4.640 -3.641
54 2HB PHE 8 1HB PHE 8 12.061 5.129 -2.078
55 HD1 PHE 8 1HD PHE 8 12.685 3.129 -0.927
56 HD2 PHE 8 2HD PHE 8 10.241 2.948 -4.405
57 HE1 PHE 8 1HE PHE 8 12.140 0.785 -0.419
58 HE2 PHE 8 2HE PHE 8 9.694 0.604 -3.901
59 HZ PHE 8 HZ PHE 8 10.643 -0.481 -1.906
60 H ARG 9 H ARG 9 9.403 7.417 -4.511
61 HA ARG 9 HA ARG 9 9.959 9.040 -2.171
62 1HB ARG 9 2HB ARG 9 9.370 9.578 -4.891
63 2HB ARG 9 1HB ARG 9 8.069 10.274 -3.936
64 1HG ARG 9 2HG ARG 9 11.013 10.818 -3.593
65 2HG ARG 9 1HG ARG 9 9.828 11.899 -4.324
66 1HD ARG 9 2HD ARG 9 9.895 12.766 -2.210
67 2HD ARG 9 1HD ARG 9 8.603 11.581 -2.014
68 HE ARG 9 HE ARG 9 11.173 10.472 -1.418
69 1HH1 ARG 9 2HH1 ARG 9 8.647 12.526 -0.102
70 2HH1 ARG 9 1HH1 ARG 9 8.982 12.092 1.548
71 1HH2 ARG 9 2HH2 ARG 9 11.627 9.925 0.759
72 2HH2 ARG 9 1HH2 ARG 9 10.688 10.629 2.043
73 H VAL 10 H VAL 10 8.803 7.497 -0.794
74 HA VAL 10 HA VAL 10 5.938 7.373 -0.980
75 HB VAL 10 HB VAL 10 7.732 6.579 1.320
76 1HG1 VAL 10 1HG1 VAL 10 5.090 6.936 1.488
77 2HG1 VAL 10 2HG1 VAL 10 5.109 5.294 0.847
78 3HG1 VAL 10 3HG1 VAL 10 5.936 5.659 2.362
79 1HG2 VAL 10 1HG2 VAL 10 6.575 4.437 -0.265
80 2HG2 VAL 10 2HG2 VAL 10 7.659 5.463 -1.204
81 3HG2 VAL 10 3HG2 VAL 10 8.239 4.679 0.266
82 H SER 11 H SER 11 4.859 9.212 -0.662
83 HA SER 11 HA SER 11 5.742 11.179 1.264
84 1HB SER 11 2HB SER 11 3.112 11.668 0.163
85 2HB SER 11 1HB SER 11 4.597 12.598 -0.045
86 HG SER 11 HG SER 11 3.539 10.518 -1.620
87 H ASP 12 H ASP 12 3.994 12.149 2.737
88 HA ASP 12 HA ASP 12 2.777 10.008 4.259
89 1HB ASP 12 2HB ASP 12 3.839 12.149 5.228
90 2HB ASP 12 1HB ASP 12 2.332 12.935 4.786
91 H GLY 13 H GLY 13 0.571 9.786 4.613
92 1HA GLY 13 1HA GLY 13 -1.694 10.028 3.997
93 2HA GLY 13 2HA GLY 13 -1.213 11.105 2.695
94 H ASP 14 H ASP 14 0.836 9.418 1.704
95 HA ASP 14 HA ASP 14 -0.555 7.685 -0.039
96 1HB ASP 14 2HB ASP 14 2.387 7.727 0.708
97 2HB ASP 14 1HB ASP 14 1.708 6.809 -0.626
98 H TRP 15 H TRP 15 -0.703 5.389 0.000
99 HA TRP 15 HA TRP 15 0.296 3.995 2.326
100 1HB TRP 15 2HB TRP 15 -1.817 3.252 3.182
101 2HB TRP 15 1HB TRP 15 -1.865 5.006 3.089
102 HD1 TRP 15 HD TRP 15 -3.199 5.955 0.758
103 HE1 TRP 15 1HE TRP 15 -5.394 5.072 -0.243
104 HE3 TRP 15 3HE TRP 15 -3.240 1.301 2.882
105 HZ2 TRP 15 2HZ TRP 15 -6.950 2.701 -0.130
106 HZ3 TRP 15 3HZ TRP 15 -5.099 -0.207 2.405
107 HH2 TRP 15 HH TRP 15 -6.927 0.473 0.913
108 H ILE 16 H ILE 16 0.187 1.740 2.161
109 HA ILE 16 HA ILE 16 -0.482 0.727 -0.512
110 HB ILE 16 HB ILE 16 0.961 -1.243 0.164
111 1HG1 ILE 16 2HG1 ILE 16 2.558 0.297 2.037
112 1HG2 ILE 16 1HG2 ILE 16 3.079 0.535 0.121
113 2HG2 ILE 16 2HG2 ILE 16 2.256 -0.146 -1.281
114 3HG2 ILE 16 3HG2 ILE 16 1.761 1.423 -0.645
115 1HD1 ILE 16 1HD1 ILE 16 3.003 -1.698 2.919
116 2HD1 ILE 16 2HD1 ILE 16 1.298 -2.140 3.015
117 3HD1 ILE 16 3HD1 ILE 16 2.177 -2.348 1.501
118 H CYS 17 H CYS 17 -1.425 -1.480 -0.512
119 HA CYS 17 HA CYS 17 -3.767 -1.674 0.856
120 1HB CYS 17 2HB CYS 17 -2.910 -3.112 -1.083
121 2HB CYS 17 1HB CYS 17 -2.161 -4.129 0.132
122 HA PRO 18 HA PRO 18 -2.834 -2.572 5.015
123 1HB PRO 18 2HB PRO 18 -5.305 -4.164 5.184
124 2HB PRO 18 1HB PRO 18 -4.871 -2.672 6.025
125 1HG PRO 18 2HG PRO 18 -6.702 -2.700 4.059
126 2HG PRO 18 1HG PRO 18 -5.601 -1.328 4.292
127 1HD PRO 18 2HD PRO 18 -5.447 -3.565 2.308
128 2HD PRO 18 1HD PRO 18 -5.143 -1.832 2.075
129 H ASP 19 H ASP 19 -2.902 -4.909 2.668
130 HA ASP 19 HA ASP 19 -2.265 -7.110 4.522
131 1HB ASP 19 2HB ASP 19 -4.228 -7.216 2.764
132 2HB ASP 19 1HB ASP 19 -2.920 -7.575 1.643
133 H LYS 20 H LYS 20 -0.665 -8.683 3.672
134 HA LYS 20 HA LYS 20 1.570 -7.245 2.431
135 1HB LYS 20 2HB LYS 20 2.723 -9.526 3.181
136 2HB LYS 20 1HB LYS 20 2.491 -8.187 4.297
137 1HG LYS 20 2HG LYS 20 0.214 -10.006 4.193
138 2HG LYS 20 1HG LYS 20 1.713 -10.777 4.717
139 1HD LYS 20 2HD LYS 20 1.308 -8.174 5.955
140 2HD LYS 20 1HD LYS 20 -0.012 -9.297 6.300
141 1HE LYS 20 2HE LYS 20 1.266 -10.253 7.848
142 2HE LYS 20 1HE LYS 20 2.371 -10.766 6.573
143 1HZ LYS 20 1HZ LYS 20 2.534 -8.073 7.793
144 2HZ LYS 20 2HZ LYS 20 3.716 -8.894 6.890
145 3HZ LYS 20 3HZ LYS 20 3.337 -9.411 8.461
146 H LYS 21 H LYS 21 -0.746 -9.727 1.884
147 HA LYS 21 HA LYS 21 0.622 -11.119 -0.187
148 1HB LYS 21 2HB LYS 21 -1.198 -12.442 -0.176
149 2HB LYS 21 1HB LYS 21 -1.726 -11.492 1.203
150 1HG LYS 21 2HG LYS 21 -2.578 -10.023 -0.985
151 2HG LYS 21 1HG LYS 21 -2.860 -11.703 -1.447
152 1HD LYS 21 2HD LYS 21 -4.497 -11.976 0.073
153 2HD LYS 21 1HD LYS 21 -3.650 -11.033 1.301
154 1HE LYS 21 2HE LYS 21 -4.267 -9.010 -0.215
155 2HE LYS 21 1HE LYS 21 -5.474 -10.106 -0.882
156 1HZ LYS 21 1HZ LYS 21 -6.572 -10.257 1.144
157 2HZ LYS 21 2HZ LYS 21 -6.142 -8.613 1.059
158 3HZ LYS 21 3HZ LYS 21 -5.247 -9.675 2.037
159 H CYS 22 H CYS 22 -1.229 -8.216 -0.018
160 HA CYS 22 HA CYS 22 -1.414 -7.914 -2.897
161 1HB CYS 22 2HB CYS 22 -2.976 -7.110 -0.779
162 2HB CYS 22 1HB CYS 22 -2.119 -5.635 -1.195
163 H GLY 23 H GLY 23 -0.621 -5.458 -0.506
164 1HA GLY 23 1HA GLY 23 1.102 -3.944 -0.384
165 2HA GLY 23 2HA GLY 23 2.062 -5.028 -1.387
166 H ASN 24 H ASN 24 -1.069 -3.736 -2.216
167 HA ASN 24 HA ASN 24 -0.224 -2.778 -4.744
168 1HB ASN 24 2HB ASN 24 -2.527 -3.489 -4.350
169 2HB ASN 24 1HB ASN 24 -2.745 -2.209 -3.160
170 1HD2 ASN 24 1HD2 ASN 24 -3.357 -0.246 -3.823
171 2HD2 ASN 24 2HD2 ASN 24 -3.566 0.212 -5.480
172 H VAL 25 H VAL 25 0.165 -0.681 -5.450
173 HA VAL 25 HA VAL 25 0.896 1.178 -3.343
174 HB VAL 25 HB VAL 25 1.699 2.541 -5.441
175 1HG1 VAL 25 1HG1 VAL 25 3.212 0.040 -4.748
176 2HG1 VAL 25 2HG1 VAL 25 3.848 1.632 -5.166
177 3HG1 VAL 25 3HG1 VAL 25 3.042 1.384 -3.619
178 1HG2 VAL 25 1HG2 VAL 25 1.896 1.486 -7.430
179 2HG2 VAL 25 2HG2 VAL 25 2.174 -0.090 -6.691
180 3HG2 VAL 25 3HG2 VAL 25 0.535 0.547 -6.819
181 H ASN 26 H ASN 26 -1.132 1.831 -2.651
182 HA ASN 26 HA ASN 26 -2.977 3.083 -4.474
183 1HB ASN 26 2HB ASN 26 -3.117 3.434 -1.498
184 2HB ASN 26 1HB ASN 26 -4.429 3.297 -2.661
185 1HD2 ASN 26 1HD2 ASN 26 -5.523 1.461 -2.493
186 2HD2 ASN 26 2HD2 ASN 26 -4.877 -0.058 -1.974
187 H PHE 27 H PHE 27 -2.746 5.042 -5.221
188 HA PHE 27 HA PHE 27 -0.775 6.804 -5.002
189 1HB PHE 27 2HB PHE 27 -2.730 7.054 -6.490
190 2HB PHE 27 1HB PHE 27 -3.695 7.601 -5.138
191 HD1 PHE 27 1HD PHE 27 -0.387 8.445 -6.659
192 HD2 PHE 27 2HD PHE 27 -4.085 9.835 -5.066
193 HE1 PHE 27 1HE PHE 27 0.286 10.762 -7.129
194 HE2 PHE 27 2HE PHE 27 -3.416 12.156 -5.534
195 HZ PHE 27 HZ PHE 27 -1.228 12.621 -6.567
196 H ALA 28 H ALA 28 -3.727 7.561 -3.219
197 HA ALA 28 HA ALA 28 -2.747 8.119 -0.715
198 1HB ALA 28 1HB ALA 28 -2.785 10.709 -0.953
199 2HB ALA 28 2HB ALA 28 -1.317 9.839 -1.395
200 3HB ALA 28 3HB ALA 28 -2.424 10.396 -2.652
201 H ARG 29 H ARG 29 -4.658 9.498 -3.332
202 HA ARG 29 HA ARG 29 -6.966 9.798 -1.611
203 1HB ARG 29 2HB ARG 29 -7.100 11.606 -2.960
204 2HB ARG 29 1HB ARG 29 -5.995 10.920 -4.130
205 1HG ARG 29 2HG ARG 29 -7.965 9.564 -4.949
206 2HG ARG 29 1HG ARG 29 -8.967 10.655 -3.992
207 1HD ARG 29 2HD ARG 29 -8.648 12.395 -5.404
208 2HD ARG 29 1HD ARG 29 -6.976 11.943 -5.742
209 HE ARG 29 HE ARG 29 -7.852 10.259 -7.288
210 1HH1 ARG 29 2HH1 ARG 29 -9.939 12.914 -6.350
211 2HH1 ARG 29 1HH1 ARG 29 -11.012 12.726 -7.704
212 1HH2 ARG 29 2HH2 ARG 29 -9.253 10.026 -9.101
213 2HH2 ARG 29 1HH2 ARG 29 -10.627 11.076 -9.254
214 H ARG 30 H ARG 30 -7.038 7.589 -1.139
215 HA ARG 30 HA ARG 30 -8.564 5.985 -3.009
216 1HB ARG 30 2HB ARG 30 -5.846 5.152 -1.970
217 2HB ARG 30 1HB ARG 30 -7.024 4.001 -2.577
218 1HG ARG 30 2HG ARG 30 -5.866 6.270 -4.185
219 2HG ARG 30 1HG ARG 30 -5.279 4.604 -4.215
220 1HD ARG 30 2HD ARG 30 -6.959 3.913 -5.526
221 2HD ARG 30 1HD ARG 30 -8.161 4.846 -4.635
222 HE ARG 30 HE ARG 30 -7.523 6.779 -5.960
223 1HH1 ARG 30 2HH1 ARG 30 -6.509 3.638 -7.132
224 2HH1 ARG 30 1HH1 ARG 30 -6.289 4.171 -8.769
225 1HH2 ARG 30 2HH2 ARG 30 -7.207 7.496 -8.100
226 2HH2 ARG 30 1HH2 ARG 30 -6.657 6.375 -9.307
227 H THR 31 H THR 31 -10.199 5.279 -1.804
228 HA THR 31 HA THR 31 -9.836 5.051 1.084
229 HB THR 31 HB THR 31 -12.512 4.578 -0.048
230 HG1 THR 31 1HG THR 31 -11.121 7.055 -0.359
231 1HG2 THR 31 1HG2 THR 31 -11.285 5.615 2.351
232 2HG2 THR 31 2HG2 THR 31 -12.941 5.068 2.091
233 3HG2 THR 31 3HG2 THR 31 -12.497 6.738 1.738
234 H SER 32 H SER 32 -9.804 3.134 -1.637
235 HA SER 32 HA SER 32 -9.774 0.756 0.037
236 1HB SER 32 2HB SER 32 -11.312 0.689 -2.560
237 2HB SER 32 1HB SER 32 -11.309 -0.500 -1.256
238 HG SER 32 HG SER 32 -12.124 1.641 -0.095
239 H CYS 33 H CYS 33 -8.981 -1.145 -1.349
240 HA CYS 33 HA CYS 33 -6.561 -0.473 -2.605
241 1HB CYS 33 2HB CYS 33 -7.249 -2.667 -1.483
242 2HB CYS 33 1HB CYS 33 -8.029 -3.062 -3.007
243 H ASP 34 H ASP 34 -5.904 -0.734 -4.735
244 HA ASP 34 HA ASP 34 -8.000 -0.418 -6.763
245 1HB ASP 34 2HB ASP 34 -5.795 1.087 -6.451
246 2HB ASP 34 1HB ASP 34 -5.116 -0.173 -7.478
247 H ARG 35 H ARG 35 -6.076 -2.702 -5.332
248 HA ARG 35 HA ARG 35 -5.741 -4.316 -7.759
249 1HB ARG 35 2HB ARG 35 -3.957 -3.803 -5.826
250 2HB ARG 35 1HB ARG 35 -4.693 -5.255 -5.160
251 1HG ARG 35 2HG ARG 35 -4.118 -6.516 -7.113
252 2HG ARG 35 1HG ARG 35 -3.539 -5.063 -7.936
253 1HD ARG 35 2HD ARG 35 -1.553 -5.886 -7.171
254 2HD ARG 35 1HD ARG 35 -2.026 -4.893 -5.794
255 HE ARG 35 HE ARG 35 -2.793 -6.920 -4.691
256 1HH1 ARG 35 2HH1 ARG 35 -0.636 -7.253 -7.416
257 2HH1 ARG 35 1HH1 ARG 35 -0.168 -8.878 -7.033
258 1HH2 ARG 35 2HH2 ARG 35 -2.216 -9.080 -4.181
259 2HH2 ARG 35 1HH2 ARG 35 -1.073 -9.928 -5.186
260 H CYS 36 H CYS 36 -6.512 -5.000 -4.340
261 HA CYS 36 HA CYS 36 -8.021 -7.319 -5.236
262 1HB CYS 36 2HB CYS 36 -7.938 -8.068 -2.931
263 2HB CYS 36 1HB CYS 36 -6.330 -7.594 -3.458
264 H GLY 37 H GLY 37 -8.489 -4.274 -3.568
265 1HA GLY 37 1HA GLY 37 -10.579 -3.103 -3.838
266 2HA GLY 37 2HA GLY 37 -11.393 -4.661 -3.879
267 H ARG 38 H ARG 38 -9.036 -4.741 -1.538
268 HA ARG 38 HA ARG 38 -10.765 -4.883 0.645
269 1HB ARG 38 2HB ARG 38 -8.309 -5.635 0.432
270 2HB ARG 38 1HB ARG 38 -7.901 -3.988 0.889
271 1HG ARG 38 2HG ARG 38 -7.823 -5.311 2.853
272 2HG ARG 38 1HG ARG 38 -9.274 -4.312 2.953
273 1HD ARG 38 2HD ARG 38 -10.128 -6.620 1.675
274 2HD ARG 38 1HD ARG 38 -9.005 -7.203 2.906
275 HE ARG 38 HE ARG 38 -11.097 -5.303 3.692
276 1HH1 ARG 38 2HH1 ARG 38 -9.900 -8.603 3.723
277 2HH1 ARG 38 1HH1 ARG 38 -10.902 -9.071 5.067
278 1HH2 ARG 38 2HH2 ARG 38 -12.359 -5.910 5.472
279 2HH2 ARG 38 1HH2 ARG 38 -12.286 -7.547 6.061
280 H GLU 39 H GLU 39 -11.463 -3.457 2.160
281 HA GLU 39 HA GLU 39 -11.646 -0.716 1.394
282 1HB GLU 39 2HB GLU 39 -13.107 -0.474 3.235
283 2HB GLU 39 1HB GLU 39 -13.384 -2.106 2.645
284 1HG GLU 39 2HG GLU 39 -11.413 -1.686 4.833
285 2HG GLU 39 1HG GLU 39 -13.134 -1.612 5.204
286 H LYS 40 H LYS 40 -11.207 1.031 3.092
287 HA LYS 40 HA LYS 40 -8.432 0.953 3.831
288 1HB LYS 40 2HB LYS 40 -9.950 2.983 3.092
289 2HB LYS 40 1HB LYS 40 -10.308 3.069 4.813
290 1HG LYS 40 2HG LYS 40 -8.429 4.186 5.149
291 2HG LYS 40 1HG LYS 40 -7.496 2.828 4.518
292 1HD LYS 40 2HD LYS 40 -6.950 4.032 2.740
293 2HD LYS 40 1HD LYS 40 -8.656 4.175 2.312
294 1HE LYS 40 2HE LYS 40 -8.871 6.241 3.317
295 2HE LYS 40 1HE LYS 40 -7.523 5.959 4.419
296 1HZ LYS 40 1HZ LYS 40 -5.975 6.399 2.758
297 2HZ LYS 40 2HZ LYS 40 -7.156 7.593 2.535
298 3HZ LYS 40 3HZ LYS 40 -7.110 6.245 1.506
299 H THR 41 H THR 41 -9.182 -1.080 5.113
300 HA THR 41 HA THR 41 -10.364 -0.585 7.678
301 HB THR 41 HB THR 41 -10.028 -2.826 6.046
302 HG1 THR 41 1HG THR 41 -11.707 -3.273 7.220
303 1HG2 THR 41 1HG2 THR 41 -8.462 -3.178 8.601
304 2HG2 THR 41 2HG2 THR 41 -7.866 -3.356 6.951
305 3HG2 THR 41 3HG2 THR 41 -9.040 -4.504 7.592
306 H THR 42 H THR 42 -9.372 -0.328 9.603
307 HA THR 42 HA THR 42 -6.581 0.359 9.563
308 HB THR 42 HB THR 42 -7.500 0.355 12.225
309 HG1 THR 42 1HG THR 42 -9.433 1.880 11.428
310 1HG2 THR 42 1HG2 THR 42 -7.666 2.888 11.718
311 2HG2 THR 42 2HG2 THR 42 -7.077 2.451 10.115
312 3HG2 THR 42 3HG2 THR 42 -6.102 2.097 11.541
313 H GLY 43 H GLY 43 -8.607 -2.129 11.046
314 1HA GLY 43 1HA GLY 43 -6.137 -3.631 11.661
315 2HA GLY 43 2HA GLY 43 -7.575 -3.690 12.676
316 HA PRO 44 HA PRO 44 -7.602 -6.455 8.539
317 1HB PRO 44 2HB PRO 44 -5.935 -8.351 10.124
318 2HB PRO 44 1HB PRO 44 -5.925 -8.024 8.387
319 1HG PRO 44 2HG PRO 44 -4.002 -7.064 9.952
320 2HG PRO 44 1HG PRO 44 -4.663 -6.092 8.623
321 1HD PRO 44 2HD PRO 44 -5.158 -5.880 11.560
322 2HD PRO 44 1HD PRO 44 -5.029 -4.598 10.341
323 H ILE 45 H ILE 45 -9.466 -7.512 8.516
324 HA ILE 45 HA ILE 45 -10.634 -8.485 10.967
325 HB ILE 45 HB ILE 45 -11.635 -8.193 8.149
326 1HG1 ILE 45 2HG1 ILE 45 -13.506 -7.106 9.748
327 1HG2 ILE 45 1HG2 ILE 45 -13.339 -9.632 8.370
328 2HG2 ILE 45 2HG2 ILE 45 -12.356 -10.373 9.632
329 3HG2 ILE 45 3HG2 ILE 45 -13.604 -9.204 10.059
330 1HD1 ILE 45 1HD1 ILE 45 -11.017 -5.936 8.630
331 2HD1 ILE 45 2HD1 ILE 45 -12.703 -5.643 8.195
332 3HD1 ILE 45 3HD1 ILE 45 -12.043 -4.957 9.680
Start of MODEL 17
1 1H GLY 1 1H GLY 1 -4.769 2.339 -14.536
2 2H GLY 1 2H GLY 1 -4.998 2.981 -12.983
3 3H GLY 1 3H GLY 1 -5.213 1.322 -13.251
4 1HA GLY 1 2HA GLY 1 -3.020 2.244 -12.195
5 2HA GLY 1 1HA GLY 1 -3.017 0.859 -13.278
6 H SER 2 H SER 2 -3.347 4.346 -13.898
7 HA SER 2 HA SER 2 -1.266 4.115 -15.938
8 1HB SER 2 2HB SER 2 -2.513 6.739 -15.599
9 2HB SER 2 1HB SER 2 -2.389 5.730 -17.041
10 HG SER 2 HG SER 2 -4.568 6.191 -15.906
11 H MET 3 H MET 3 0.723 4.322 -15.128
12 HA MET 3 HA MET 3 1.393 6.758 -13.692
13 1HB MET 3 2HB MET 3 1.005 4.362 -12.280
14 2HB MET 3 1HB MET 3 2.748 4.533 -12.425
15 1HG MET 3 2HG MET 3 0.817 6.480 -11.203
16 2HG MET 3 1HG MET 3 2.052 5.530 -10.380
17 1HE MET 3 1HE MET 3 3.358 8.894 -9.704
18 2HE MET 3 2HE MET 3 2.568 7.409 -9.173
19 3HE MET 3 3HE MET 3 4.296 7.411 -9.529
20 H SER 4 H SER 4 3.409 7.465 -14.136
21 HA SER 4 HA SER 4 4.814 6.286 -16.310
22 1HB SER 4 2HB SER 4 6.300 8.269 -14.762
23 2HB SER 4 1HB SER 4 5.770 8.321 -16.444
24 HG SER 4 HG SER 4 3.769 9.051 -15.789
25 H THR 5 H THR 5 6.340 4.772 -16.252
26 HA THR 5 HA THR 5 7.066 3.453 -13.877
27 HB THR 5 HB THR 5 8.938 3.079 -16.086
28 HG1 THR 5 1HG THR 5 6.160 2.591 -16.574
29 1HG2 THR 5 1HG2 THR 5 7.506 0.775 -15.805
30 2HG2 THR 5 2HG2 THR 5 7.323 1.502 -14.209
31 3HG2 THR 5 3HG2 THR 5 8.934 1.193 -14.855
32 H LYS 6 H LYS 6 8.530 6.098 -15.593
33 HA LYS 6 HA LYS 6 11.096 5.936 -14.355
34 1HB LYS 6 2HB LYS 6 9.702 8.251 -15.716
35 2HB LYS 6 1HB LYS 6 11.384 8.255 -15.209
36 1HG LYS 6 2HG LYS 6 11.437 6.063 -16.708
37 2HG LYS 6 1HG LYS 6 10.095 6.893 -17.496
38 1HD LYS 6 2HD LYS 6 12.830 8.068 -17.009
39 2HD LYS 6 1HD LYS 6 12.256 7.416 -18.544
40 1HE LYS 6 2HE LYS 6 10.468 9.409 -17.369
41 2HE LYS 6 1HE LYS 6 12.071 10.037 -17.751
42 1HZ LYS 6 1HZ LYS 6 10.703 10.326 -19.652
43 2HZ LYS 6 2HZ LYS 6 10.164 8.720 -19.604
44 3HZ LYS 6 3HZ LYS 6 11.778 9.063 -20.008
45 H ASN 7 H ASN 7 8.293 8.070 -13.861
46 HA ASN 7 HA ASN 7 9.484 9.088 -11.410
47 1HB ASN 7 2HB ASN 7 8.447 10.629 -13.104
48 2HB ASN 7 1HB ASN 7 6.883 9.924 -12.710
49 1HD2 ASN 7 1HD2 ASN 7 5.768 11.266 -11.508
50 2HD2 ASN 7 2HD2 ASN 7 6.380 12.211 -10.188
51 H PHE 8 H PHE 8 9.169 6.778 -10.620
52 HA PHE 8 HA PHE 8 6.492 6.226 -9.647
53 1HB PHE 8 2HB PHE 8 8.977 4.722 -9.956
54 2HB PHE 8 1HB PHE 8 8.211 4.442 -8.396
55 HD1 PHE 8 1HD PHE 8 5.342 4.761 -9.267
56 HD2 PHE 8 2HD PHE 8 8.616 2.643 -10.976
57 HE1 PHE 8 1HE PHE 8 3.770 3.190 -10.320
58 HE2 PHE 8 2HE PHE 8 7.049 1.068 -12.033
59 HZ PHE 8 HZ PHE 8 4.621 1.341 -11.707
60 H ARG 9 H ARG 9 7.054 8.571 -8.690
61 HA ARG 9 HA ARG 9 8.579 8.474 -6.239
62 1HB ARG 9 2HB ARG 9 8.262 10.417 -8.061
63 2HB ARG 9 1HB ARG 9 6.987 10.877 -6.942
64 1HG ARG 9 2HG ARG 9 9.372 10.280 -5.485
65 2HG ARG 9 1HG ARG 9 9.726 11.443 -6.763
66 1HD ARG 9 2HD ARG 9 8.796 13.059 -5.562
67 2HD ARG 9 1HD ARG 9 7.266 12.183 -5.555
68 HE ARG 9 HE ARG 9 8.599 10.945 -3.595
69 1HH1 ARG 9 2HH1 ARG 9 8.153 14.354 -4.287
70 2HH1 ARG 9 1HH1 ARG 9 8.231 14.831 -2.613
71 1HH2 ARG 9 2HH2 ARG 9 8.697 11.570 -1.396
72 2HH2 ARG 9 1HH2 ARG 9 8.522 13.252 -0.973
73 H VAL 10 H VAL 10 6.906 6.796 -5.475
74 HA VAL 10 HA VAL 10 4.452 7.758 -4.414
75 HB VAL 10 HB VAL 10 5.294 5.699 -2.719
76 1HG1 VAL 10 1HG1 VAL 10 3.811 4.493 -4.728
77 2HG1 VAL 10 2HG1 VAL 10 3.188 5.266 -3.271
78 3HG1 VAL 10 3HG1 VAL 10 3.316 6.186 -4.770
79 1HG2 VAL 10 1HG2 VAL 10 7.208 5.338 -4.282
80 2HG2 VAL 10 2HG2 VAL 10 6.136 3.948 -4.130
81 3HG2 VAL 10 3HG2 VAL 10 6.042 4.982 -5.557
82 H SER 11 H SER 11 4.106 8.986 -2.666
83 HA SER 11 HA SER 11 6.533 9.898 -1.290
84 1HB SER 11 2HB SER 11 4.001 11.461 -1.182
85 2HB SER 11 1HB SER 11 5.670 12.024 -1.295
86 HG SER 11 HG SER 11 5.023 10.614 -3.496
87 H ASP 12 H ASP 12 4.426 11.338 0.479
88 HA ASP 12 HA ASP 12 4.399 9.246 2.531
89 1HB ASP 12 2HB ASP 12 3.577 11.704 3.640
90 2HB ASP 12 1HB ASP 12 5.108 10.883 3.861
91 H GLY 13 H GLY 13 2.387 11.526 0.851
92 1HA GLY 13 1HA GLY 13 0.040 11.174 2.396
93 2HA GLY 13 2HA GLY 13 0.119 11.892 0.799
94 H ASP 14 H ASP 14 1.466 9.001 0.292
95 HA ASP 14 HA ASP 14 -1.108 7.811 -0.458
96 1HB ASP 14 2HB ASP 14 0.605 6.162 -1.669
97 2HB ASP 14 1HB ASP 14 0.086 7.677 -2.401
98 H TRP 15 H TRP 15 -0.606 5.174 -0.582
99 HA TRP 15 HA TRP 15 0.595 4.211 1.837
100 1HB TRP 15 2HB TRP 15 -1.483 3.374 2.862
101 2HB TRP 15 1HB TRP 15 -1.459 5.131 2.777
102 HD1 TRP 15 HD TRP 15 -3.021 6.217 0.701
103 HE1 TRP 15 1HE TRP 15 -5.301 5.384 -0.161
104 HE3 TRP 15 3HE TRP 15 -2.876 1.422 2.479
105 HZ2 TRP 15 2HZ TRP 15 -6.831 2.999 -0.101
106 HZ3 TRP 15 3HZ TRP 15 -4.775 -0.059 2.045
107 HH2 TRP 15 HH TRP 15 -6.714 0.704 0.763
108 H ILE 16 H ILE 16 0.517 1.888 2.007
109 HA ILE 16 HA ILE 16 -0.055 0.582 -0.556
110 HB ILE 16 HB ILE 16 1.318 -1.285 0.314
111 1HG1 ILE 16 2HG1 ILE 16 2.570 0.312 2.428
112 1HG2 ILE 16 1HG2 ILE 16 2.176 1.221 -0.604
113 2HG2 ILE 16 2HG2 ILE 16 3.313 0.735 0.653
114 3HG2 ILE 16 3HG2 ILE 16 3.022 -0.322 -0.727
115 1HD1 ILE 16 1HD1 ILE 16 2.443 -1.776 3.684
116 2HD1 ILE 16 2HD1 ILE 16 1.515 -2.501 2.370
117 3HD1 ILE 16 3HD1 ILE 16 3.184 -1.999 2.098
118 H CYS 17 H CYS 17 -1.062 -1.570 -0.456
119 HA CYS 17 HA CYS 17 -3.516 -1.562 0.697
120 1HB CYS 17 2HB CYS 17 -2.509 -3.189 -1.040
121 2HB CYS 17 1HB CYS 17 -2.041 -4.156 0.352
122 HA PRO 18 HA PRO 18 -2.999 -2.265 4.997
123 1HB PRO 18 2HB PRO 18 -5.674 -3.447 5.083
124 2HB PRO 18 1HB PRO 18 -5.104 -1.923 5.765
125 1HG PRO 18 2HG PRO 18 -6.772 -1.991 3.666
126 2HG PRO 18 1HG PRO 18 -5.512 -0.750 3.829
127 1HD PRO 18 2HD PRO 18 -5.473 -3.271 2.196
128 2HD PRO 18 1HD PRO 18 -5.007 -1.628 1.727
129 H ASP 19 H ASP 19 -3.129 -4.708 2.789
130 HA ASP 19 HA ASP 19 -2.744 -6.776 4.849
131 1HB ASP 19 2HB ASP 19 -4.939 -6.782 3.331
132 2HB ASP 19 1HB ASP 19 -3.850 -7.584 2.207
133 H LYS 20 H LYS 20 -1.451 -8.643 4.056
134 HA LYS 20 HA LYS 20 0.856 -7.547 2.658
135 1HB LYS 20 2HB LYS 20 0.403 -9.937 4.406
136 2HB LYS 20 1HB LYS 20 1.837 -9.844 3.394
137 1HG LYS 20 2HG LYS 20 2.638 -8.949 5.326
138 2HG LYS 20 1HG LYS 20 2.082 -7.485 4.513
139 1HD LYS 20 2HD LYS 20 -0.071 -7.696 5.756
140 2HD LYS 20 1HD LYS 20 0.635 -9.047 6.647
141 1HE LYS 20 2HE LYS 20 2.534 -7.396 7.199
142 2HE LYS 20 1HE LYS 20 1.391 -6.148 6.708
143 1HZ LYS 20 1HZ LYS 20 0.029 -7.843 8.430
144 2HZ LYS 20 2HZ LYS 20 0.537 -6.252 8.729
145 3HZ LYS 20 3HZ LYS 20 1.541 -7.554 9.149
146 H LYS 21 H LYS 21 -1.718 -9.745 2.061
147 HA LYS 21 HA LYS 21 -0.576 -11.348 0.060
148 1HB LYS 21 2HB LYS 21 -3.435 -10.394 0.299
149 2HB LYS 21 1HB LYS 21 -2.888 -11.718 -0.722
150 1HG LYS 21 2HG LYS 21 -1.938 -12.594 1.598
151 2HG LYS 21 1HG LYS 21 -3.265 -11.607 2.211
152 1HD LYS 21 2HD LYS 21 -4.867 -12.840 0.938
153 2HD LYS 21 1HD LYS 21 -3.596 -13.688 0.055
154 1HE LYS 21 2HE LYS 21 -3.060 -15.035 1.859
155 2HE LYS 21 1HE LYS 21 -3.725 -13.899 3.031
156 1HZ LYS 21 1HZ LYS 21 -5.518 -15.225 1.108
157 2HZ LYS 21 2HZ LYS 21 -5.861 -14.625 2.658
158 3HZ LYS 21 3HZ LYS 21 -4.987 -16.071 2.479
159 H CYS 22 H CYS 22 -1.496 -8.065 0.070
160 HA CYS 22 HA CYS 22 -1.452 -7.834 -2.851
161 1HB CYS 22 2HB CYS 22 -3.024 -6.702 -0.853
162 2HB CYS 22 1HB CYS 22 -1.925 -5.413 -1.308
163 H GLY 23 H GLY 23 -0.598 -5.419 -0.459
164 1HA GLY 23 1HA GLY 23 1.357 -4.250 -0.085
165 2HA GLY 23 2HA GLY 23 2.214 -5.416 -1.091
166 H ASN 24 H ASN 24 -0.643 -3.856 -2.237
167 HA ASN 24 HA ASN 24 0.771 -2.714 -4.470
168 1HB ASN 24 2HB ASN 24 -1.384 -3.638 -4.932
169 2HB ASN 24 1HB ASN 24 -2.128 -2.734 -3.622
170 1HD2 ASN 24 1HD2 ASN 24 -2.844 -0.698 -3.985
171 2HD2 ASN 24 2HD2 ASN 24 -2.756 0.098 -5.516
172 H VAL 25 H VAL 25 1.393 -0.631 -4.739
173 HA VAL 25 HA VAL 25 0.957 1.267 -2.614
174 HB VAL 25 HB VAL 25 2.021 2.873 -4.383
175 1HG1 VAL 25 1HG1 VAL 25 3.553 0.634 -3.068
176 2HG1 VAL 25 2HG1 VAL 25 4.274 2.110 -3.713
177 3HG1 VAL 25 3HG1 VAL 25 3.145 2.197 -2.360
178 1HG2 VAL 25 1HG2 VAL 25 1.725 1.225 -6.241
179 2HG2 VAL 25 2HG2 VAL 25 3.365 1.848 -6.061
180 3HG2 VAL 25 3HG2 VAL 25 2.965 0.234 -5.477
181 H ASN 26 H ASN 26 -0.852 2.370 -2.403
182 HA ASN 26 HA ASN 26 -2.657 2.614 -4.677
183 1HB ASN 26 2HB ASN 26 -2.924 2.726 -1.723
184 2HB ASN 26 1HB ASN 26 -4.041 3.724 -2.654
185 1HD2 ASN 26 1HD2 ASN 26 -3.303 0.591 -1.574
186 2HD2 ASN 26 2HD2 ASN 26 -4.540 -0.260 -2.429
187 H PHE 27 H PHE 27 -3.741 4.667 -5.092
188 HA PHE 27 HA PHE 27 -1.936 6.623 -5.825
189 1HB PHE 27 2HB PHE 27 -4.187 6.311 -6.807
190 2HB PHE 27 1HB PHE 27 -4.902 7.003 -5.356
191 HD1 PHE 27 1HD PHE 27 -2.122 7.937 -7.679
192 HD2 PHE 27 2HD PHE 27 -5.659 9.132 -5.642
193 HE1 PHE 27 1HE PHE 27 -1.923 10.186 -8.660
194 HE2 PHE 27 2HE PHE 27 -5.469 11.380 -6.615
195 HZ PHE 27 HZ PHE 27 -3.603 11.910 -8.125
196 H ALA 28 H ALA 28 -4.546 7.468 -3.577
197 HA ALA 28 HA ALA 28 -2.974 8.185 -1.376
198 1HB ALA 28 1HB ALA 28 -1.993 10.042 -2.223
199 2HB ALA 28 2HB ALA 28 -3.233 10.265 -3.458
200 3HB ALA 28 3HB ALA 28 -3.537 10.781 -1.799
201 H ARG 29 H ARG 29 -5.632 9.854 -3.083
202 HA ARG 29 HA ARG 29 -7.312 9.991 -0.804
203 1HB ARG 29 2HB ARG 29 -7.459 10.643 -3.677
204 2HB ARG 29 1HB ARG 29 -8.999 10.301 -2.906
205 1HG ARG 29 2HG ARG 29 -8.005 12.721 -3.030
206 2HG ARG 29 1HG ARG 29 -8.943 12.182 -1.641
207 1HD ARG 29 2HD ARG 29 -6.927 11.772 -0.388
208 2HD ARG 29 1HD ARG 29 -5.934 12.117 -1.803
209 HE ARG 29 HE ARG 29 -7.015 14.010 0.018
210 1HH1 ARG 29 2HH1 ARG 29 -6.167 13.559 -3.348
211 2HH1 ARG 29 1HH1 ARG 29 -6.067 15.262 -3.687
212 1HH2 ARG 29 2HH2 ARG 29 -6.874 16.247 -0.413
213 2HH2 ARG 29 1HH2 ARG 29 -6.449 16.790 -2.011
214 H ARG 30 H ARG 30 -6.403 7.263 -1.614
215 HA ARG 30 HA ARG 30 -8.852 5.964 -2.500
216 1HB ARG 30 2HB ARG 30 -5.993 5.129 -2.215
217 2HB ARG 30 1HB ARG 30 -7.240 3.891 -2.200
218 1HG ARG 30 2HG ARG 30 -7.430 5.850 -4.386
219 2HG ARG 30 1HG ARG 30 -6.024 4.784 -4.427
220 1HD ARG 30 2HD ARG 30 -7.649 2.865 -4.093
221 2HD ARG 30 1HD ARG 30 -8.934 4.027 -4.421
222 HE ARG 30 HE ARG 30 -7.060 2.903 -6.323
223 1HH1 ARG 30 2HH1 ARG 30 -9.462 5.371 -5.676
224 2HH1 ARG 30 1HH1 ARG 30 -9.716 5.749 -7.352
225 1HH2 ARG 30 2HH2 ARG 30 -7.412 3.363 -8.532
226 2HH2 ARG 30 1HH2 ARG 30 -8.572 4.593 -8.981
227 H THR 31 H THR 31 -10.285 5.261 -1.080
228 HA THR 31 HA THR 31 -9.490 4.798 1.683
229 HB THR 31 HB THR 31 -12.264 4.181 1.000
230 HG1 THR 31 1HG THR 31 -11.342 6.863 0.593
231 1HG2 THR 31 1HG2 THR 31 -11.008 4.815 3.247
232 2HG2 THR 31 2HG2 THR 31 -12.702 5.232 2.984
233 3HG2 THR 31 3HG2 THR 31 -11.446 6.446 2.745
234 H SER 32 H SER 32 -10.073 3.125 -1.220
235 HA SER 32 HA SER 32 -9.621 0.581 0.166
236 1HB SER 32 2HB SER 32 -11.460 0.999 -2.209
237 2HB SER 32 1HB SER 32 -11.071 -0.554 -1.472
238 HG SER 32 HG SER 32 -12.415 1.624 -0.227
239 H CYS 33 H CYS 33 -8.753 -1.070 -1.409
240 HA CYS 33 HA CYS 33 -6.402 -0.145 -2.611
241 1HB CYS 33 2HB CYS 33 -7.136 -2.496 -1.747
242 2HB CYS 33 1HB CYS 33 -7.654 -2.731 -3.411
243 H ASP 34 H ASP 34 -5.695 -0.448 -4.761
244 HA ASP 34 HA ASP 34 -7.716 0.037 -6.831
245 1HB ASP 34 2HB ASP 34 -5.634 1.513 -6.577
246 2HB ASP 34 1HB ASP 34 -4.708 0.131 -7.151
247 H ARG 35 H ARG 35 -5.604 -2.322 -5.528
248 HA ARG 35 HA ARG 35 -5.363 -3.791 -8.038
249 1HB ARG 35 2HB ARG 35 -3.730 -3.472 -5.726
250 2HB ARG 35 1HB ARG 35 -4.128 -5.177 -5.880
251 1HG ARG 35 2HG ARG 35 -3.431 -4.209 -8.453
252 2HG ARG 35 1HG ARG 35 -2.198 -3.673 -7.307
253 1HD ARG 35 2HD ARG 35 -1.327 -5.717 -7.291
254 2HD ARG 35 1HD ARG 35 -2.858 -6.367 -6.698
255 HE ARG 35 HE ARG 35 -2.218 -6.038 -9.564
256 1HH1 ARG 35 2HH1 ARG 35 -3.567 -7.892 -6.911
257 2HH1 ARG 35 1HH1 ARG 35 -4.258 -9.109 -7.951
258 1HH2 ARG 35 2HH2 ARG 35 -3.123 -7.616 -10.923
259 2HH2 ARG 35 1HH2 ARG 35 -4.008 -8.944 -10.242
260 H CYS 36 H CYS 36 -6.292 -4.531 -4.659
261 HA CYS 36 HA CYS 36 -7.535 -6.975 -5.651
262 1HB CYS 36 2HB CYS 36 -7.648 -7.672 -3.315
263 2HB CYS 36 1HB CYS 36 -6.016 -7.161 -3.728
264 H GLY 37 H GLY 37 -8.376 -4.329 -3.439
265 1HA GLY 37 1HA GLY 37 -10.543 -3.177 -4.064
266 2HA GLY 37 2HA GLY 37 -11.214 -4.802 -4.105
267 H ARG 38 H ARG 38 -8.971 -4.874 -1.735
268 HA ARG 38 HA ARG 38 -10.865 -4.870 0.379
269 1HB ARG 38 2HB ARG 38 -7.966 -5.265 0.081
270 2HB ARG 38 1HB ARG 38 -8.443 -4.578 1.627
271 1HG ARG 38 2HG ARG 38 -8.745 -6.685 2.270
272 2HG ARG 38 1HG ARG 38 -10.235 -6.619 1.327
273 1HD ARG 38 2HD ARG 38 -9.433 -8.315 0.127
274 2HD ARG 38 1HD ARG 38 -8.267 -7.179 -0.548
275 HE ARG 38 HE ARG 38 -7.704 -8.802 1.858
276 1HH1 ARG 38 2HH1 ARG 38 -6.766 -7.437 -1.234
277 2HH1 ARG 38 1HH1 ARG 38 -5.184 -8.159 -1.215
278 1HH2 ARG 38 2HH2 ARG 38 -5.595 -9.708 1.910
279 2HH2 ARG 38 1HH2 ARG 38 -4.524 -9.438 0.569
280 H GLU 39 H GLU 39 -11.299 -3.338 1.936
281 HA GLU 39 HA GLU 39 -10.562 -0.609 1.257
282 1HB GLU 39 2HB GLU 39 -12.084 -0.159 3.337
283 2HB GLU 39 1HB GLU 39 -12.806 -0.658 1.816
284 1HG GLU 39 2HG GLU 39 -12.068 -2.794 3.721
285 2HG GLU 39 1HG GLU 39 -13.435 -1.765 4.144
286 H LYS 40 H LYS 40 -10.108 0.857 3.218
287 HA LYS 40 HA LYS 40 -7.678 -0.006 4.432
288 1HB LYS 40 2HB LYS 40 -8.841 2.417 3.820
289 2HB LYS 40 1HB LYS 40 -8.936 2.380 5.572
290 1HG LYS 40 2HG LYS 40 -6.766 2.791 5.784
291 2HG LYS 40 1HG LYS 40 -6.342 1.542 4.612
292 1HD LYS 40 2HD LYS 40 -5.938 3.079 3.060
293 2HD LYS 40 1HD LYS 40 -7.562 3.741 3.256
294 1HE LYS 40 2HE LYS 40 -6.641 4.955 5.296
295 2HE LYS 40 1HE LYS 40 -5.043 4.510 4.698
296 1HZ LYS 40 1HZ LYS 40 -6.876 6.522 3.740
297 2HZ LYS 40 2HZ LYS 40 -6.206 5.568 2.511
298 3HZ LYS 40 3HZ LYS 40 -5.190 6.415 3.566
299 H THR 41 H THR 41 -8.805 -1.926 5.431
300 HA THR 41 HA THR 41 -10.530 -1.425 7.674
301 HB THR 41 HB THR 41 -10.895 -3.400 6.294
302 HG1 THR 41 1HG THR 41 -11.232 -3.382 8.708
303 1HG2 THR 41 1HG2 THR 41 -9.240 -5.346 6.678
304 2HG2 THR 41 2HG2 THR 41 -8.094 -4.080 7.118
305 3HG2 THR 41 3HG2 THR 41 -8.817 -4.093 5.511
306 H THR 42 H THR 42 -7.122 -2.243 7.232
307 HA THR 42 HA THR 42 -6.715 -2.600 10.067
308 HB THR 42 HB THR 42 -4.329 -2.194 8.393
309 HG1 THR 42 1HG THR 42 -4.655 -4.165 7.256
310 1HG2 THR 42 1HG2 THR 42 -5.241 -4.509 10.108
311 2HG2 THR 42 2HG2 THR 42 -4.318 -3.128 10.694
312 3HG2 THR 42 3HG2 THR 42 -3.608 -4.223 9.509
313 H GLY 43 H GLY 43 -5.324 -0.350 7.665
314 1HA GLY 43 1HA GLY 43 -5.924 2.059 8.630
315 2HA GLY 43 2HA GLY 43 -4.703 1.539 9.784
316 HA PRO 44 HA PRO 44 -2.144 3.339 6.516
317 1HB PRO 44 2HB PRO 44 -0.244 4.344 8.105
318 2HB PRO 44 1HB PRO 44 -1.823 5.124 7.959
319 1HG PRO 44 2HG PRO 44 -0.758 3.389 10.141
320 2HG PRO 44 1HG PRO 44 -1.785 4.828 10.252
321 1HD PRO 44 2HD PRO 44 -2.682 2.197 10.383
322 2HD PRO 44 1HD PRO 44 -3.690 3.610 10.015
323 H ILE 45 H ILE 45 -1.835 0.695 8.463
324 HA ILE 45 HA ILE 45 0.669 -0.127 7.178
325 HB ILE 45 HB ILE 45 0.036 -0.756 10.071
326 1HG1 ILE 45 2HG1 ILE 45 2.386 0.912 9.595
327 1HG2 ILE 45 1HG2 ILE 45 2.529 -1.339 10.018
328 2HG2 ILE 45 2HG2 ILE 45 1.400 -2.450 9.240
329 3HG2 ILE 45 3HG2 ILE 45 2.353 -1.334 8.261
330 1HD1 ILE 45 1HD1 ILE 45 1.419 0.492 11.821
331 2HD1 ILE 45 2HD1 ILE 45 1.542 2.207 11.430
332 3HD1 ILE 45 3HD1 ILE 45 -0.018 1.390 11.333
Start of MODEL 18
1 1H GLY 1 1H GLY 1 9.900 -5.253 -25.967
2 2H GLY 1 2H GLY 1 8.278 -5.483 -25.534
3 3H GLY 1 3H GLY 1 9.515 -6.014 -24.503
4 1HA GLY 1 2HA GLY 1 9.956 -3.304 -24.960
5 2HA GLY 1 1HA GLY 1 8.249 -3.502 -24.589
6 H SER 2 H SER 2 11.412 -4.678 -23.459
7 HA SER 2 HA SER 2 10.420 -4.937 -20.753
8 1HB SER 2 2HB SER 2 13.188 -5.257 -20.703
9 2HB SER 2 1HB SER 2 11.992 -6.550 -20.841
10 HG SER 2 HG SER 2 13.766 -5.646 -22.674
11 H MET 3 H MET 3 11.560 -3.931 -18.949
12 HA MET 3 HA MET 3 12.630 -2.300 -17.786
13 1HB MET 3 2HB MET 3 13.578 -1.651 -20.519
14 2HB MET 3 1HB MET 3 13.647 -0.361 -19.329
15 1HG MET 3 2HG MET 3 15.495 -1.206 -18.472
16 2HG MET 3 1HG MET 3 14.679 -2.736 -18.153
17 1HE MET 3 1HE MET 3 17.859 -1.598 -20.860
18 2HE MET 3 2HE MET 3 16.453 -1.167 -21.836
19 3HE MET 3 3HE MET 3 16.626 -0.526 -20.198
20 H SER 4 H SER 4 10.460 -1.436 -20.388
21 HA SER 4 HA SER 4 9.778 1.131 -19.412
22 1HB SER 4 2HB SER 4 7.619 -0.112 -20.859
23 2HB SER 4 1HB SER 4 8.676 1.211 -21.356
24 HG SER 4 HG SER 4 9.198 -0.310 -22.785
25 H THR 5 H THR 5 9.043 1.361 -17.396
26 HA THR 5 HA THR 5 7.184 -0.545 -16.244
27 HB THR 5 HB THR 5 7.679 1.956 -14.774
28 HG1 THR 5 1HG THR 5 9.778 1.961 -15.024
29 1HG2 THR 5 1HG2 THR 5 8.405 0.133 -13.070
30 2HG2 THR 5 2HG2 THR 5 7.699 -0.990 -14.234
31 3HG2 THR 5 3HG2 THR 5 6.702 0.273 -13.510
32 H LYS 6 H LYS 6 5.130 -0.394 -16.928
33 HA LYS 6 HA LYS 6 3.974 2.215 -17.527
34 1HB LYS 6 2HB LYS 6 3.395 -0.559 -18.223
35 2HB LYS 6 1HB LYS 6 1.953 0.344 -17.780
36 1HG LYS 6 2HG LYS 6 2.083 0.670 -20.061
37 2HG LYS 6 1HG LYS 6 2.840 2.129 -19.416
38 1HD LYS 6 2HD LYS 6 4.808 1.638 -20.358
39 2HD LYS 6 1HD LYS 6 4.744 -0.036 -19.802
40 1HE LYS 6 2HE LYS 6 2.864 0.586 -21.954
41 2HE LYS 6 1HE LYS 6 4.558 0.778 -22.403
42 1HZ LYS 6 1HZ LYS 6 3.515 -1.663 -21.090
43 2HZ LYS 6 2HZ LYS 6 5.006 -1.456 -21.875
44 3HZ LYS 6 3HZ LYS 6 3.572 -1.484 -22.774
45 H ASN 7 H ASN 7 4.087 -0.067 -14.979
46 HA ASN 7 HA ASN 7 1.639 0.747 -13.700
47 1HB ASN 7 2HB ASN 7 3.861 -1.128 -13.081
48 2HB ASN 7 1HB ASN 7 2.991 -0.463 -11.704
49 1HD2 ASN 7 1HD2 ASN 7 0.453 -0.402 -12.344
50 2HD2 ASN 7 2HD2 ASN 7 -0.149 -1.953 -12.817
51 H PHE 8 H PHE 8 1.369 2.379 -12.311
52 HA PHE 8 HA PHE 8 3.424 4.283 -11.881
53 1HB PHE 8 2HB PHE 8 0.685 4.357 -11.794
54 2HB PHE 8 1HB PHE 8 1.100 4.425 -10.085
55 HD1 PHE 8 1HD PHE 8 0.601 6.315 -13.003
56 HD2 PHE 8 2HD PHE 8 2.964 6.161 -9.469
57 HE1 PHE 8 1HE PHE 8 1.105 8.710 -13.235
58 HE2 PHE 8 2HE PHE 8 3.465 8.556 -9.695
59 HZ PHE 8 HZ PHE 8 2.538 9.831 -11.582
60 H ARG 9 H ARG 9 5.080 3.646 -10.727
61 HA ARG 9 HA ARG 9 4.917 1.906 -8.474
62 1HB ARG 9 2HB ARG 9 7.011 3.198 -10.051
63 2HB ARG 9 1HB ARG 9 7.401 3.089 -8.340
64 1HG ARG 9 2HG ARG 9 6.339 0.592 -9.123
65 2HG ARG 9 1HG ARG 9 7.537 1.069 -10.330
66 1HD ARG 9 2HD ARG 9 9.210 0.639 -8.927
67 2HD ARG 9 1HD ARG 9 8.490 1.655 -7.679
68 HE ARG 9 HE ARG 9 7.362 -0.237 -6.821
69 1HH1 ARG 9 2HH1 ARG 9 9.671 -0.968 -9.355
70 2HH1 ARG 9 1HH1 ARG 9 9.697 -2.679 -9.025
71 1HH2 ARG 9 2HH2 ARG 9 7.407 -2.471 -6.349
72 2HH2 ARG 9 1HH2 ARG 9 8.392 -3.537 -7.313
73 H VAL 10 H VAL 10 3.342 3.190 -7.243
74 HA VAL 10 HA VAL 10 4.234 5.596 -5.950
75 HB VAL 10 HB VAL 10 2.050 3.848 -4.846
76 1HG1 VAL 10 1HG1 VAL 10 1.760 6.770 -5.102
77 2HG1 VAL 10 2HG1 VAL 10 1.356 5.702 -3.760
78 3HG1 VAL 10 3HG1 VAL 10 3.026 6.216 -4.007
79 1HG2 VAL 10 1HG2 VAL 10 2.130 4.819 -7.523
80 2HG2 VAL 10 2HG2 VAL 10 0.825 3.973 -6.693
81 3HG2 VAL 10 3HG2 VAL 10 0.913 5.733 -6.630
82 H SER 11 H SER 11 6.039 5.379 -4.750
83 HA SER 11 HA SER 11 6.701 3.079 -3.250
84 1HB SER 11 2HB SER 11 8.177 5.117 -2.144
85 2HB SER 11 1HB SER 11 8.652 4.164 -3.553
86 HG SER 11 HG SER 11 8.013 6.778 -3.401
87 H ASP 12 H ASP 12 6.501 6.215 -1.828
88 HA ASP 12 HA ASP 12 4.892 5.130 0.364
89 1HB ASP 12 2HB ASP 12 7.162 6.596 0.549
90 2HB ASP 12 1HB ASP 12 5.954 7.878 0.611
91 H GLY 13 H GLY 13 4.137 7.912 1.136
92 1HA GLY 13 1HA GLY 13 2.770 9.617 -0.107
93 2HA GLY 13 2HA GLY 13 1.965 8.235 -0.843
94 H ASP 14 H ASP 14 0.030 7.921 -0.011
95 HA ASP 14 HA ASP 14 -0.594 8.801 2.679
96 1HB ASP 14 2HB ASP 14 -2.113 8.970 0.606
97 2HB ASP 14 1HB ASP 14 -2.417 7.252 0.875
98 H TRP 15 H TRP 15 -1.060 5.836 0.856
99 HA TRP 15 HA TRP 15 -0.052 4.131 2.923
100 1HB TRP 15 2HB TRP 15 -2.100 2.945 3.396
101 2HB TRP 15 1HB TRP 15 -2.417 4.654 3.681
102 HD1 TRP 15 HD TRP 15 -3.545 5.911 1.310
103 HE1 TRP 15 1HE TRP 15 -5.515 4.997 -0.079
104 HE3 TRP 15 3HE TRP 15 -3.339 0.995 2.721
105 HZ2 TRP 15 2HZ TRP 15 -6.811 2.524 -0.512
106 HZ3 TRP 15 3HZ TRP 15 -4.976 -0.575 1.775
107 HH2 TRP 15 HH TRP 15 -6.674 0.166 0.182
108 H ILE 16 H ILE 16 -0.061 1.856 2.111
109 HA ILE 16 HA ILE 16 -0.189 1.877 -0.818
110 HB ILE 16 HB ILE 16 1.287 -0.229 -0.566
111 1HG1 ILE 16 2HG1 ILE 16 2.643 0.867 1.730
112 1HG2 ILE 16 1HG2 ILE 16 3.234 1.605 -0.040
113 2HG2 ILE 16 2HG2 ILE 16 2.453 1.384 -1.606
114 3HG2 ILE 16 3HG2 ILE 16 1.877 2.638 -0.505
115 1HD1 ILE 16 1HD1 ILE 16 2.385 -1.596 0.612
116 2HD1 ILE 16 2HD1 ILE 16 3.077 -1.265 2.199
117 3HD1 ILE 16 3HD1 ILE 16 1.385 -1.743 2.056
118 H CYS 17 H CYS 17 -0.273 -0.798 1.532
119 HA CYS 17 HA CYS 17 -3.012 -1.371 0.779
120 1HB CYS 17 2HB CYS 17 -0.677 -3.029 -0.005
121 2HB CYS 17 1HB CYS 17 -2.081 -3.893 0.604
122 HA PRO 18 HA PRO 18 -3.350 -2.334 5.010
123 1HB PRO 18 2HB PRO 18 -5.243 -4.506 4.421
124 2HB PRO 18 1HB PRO 18 -5.514 -2.972 5.252
125 1HG PRO 18 2HG PRO 18 -6.489 -3.423 2.796
126 2HG PRO 18 1HG PRO 18 -5.903 -1.822 3.288
127 1HD PRO 18 2HD PRO 18 -4.517 -3.917 1.643
128 2HD PRO 18 1HD PRO 18 -4.611 -2.163 1.382
129 H ASP 19 H ASP 19 -2.732 -5.073 2.886
130 HA ASP 19 HA ASP 19 -1.608 -6.521 5.195
131 1HB ASP 19 2HB ASP 19 -3.912 -7.279 4.050
132 2HB ASP 19 1HB ASP 19 -2.786 -8.113 2.985
133 H LYS 20 H LYS 20 -0.485 -8.638 4.131
134 HA LYS 20 HA LYS 20 1.615 -7.534 2.418
135 1HB LYS 20 2HB LYS 20 1.512 -9.477 4.533
136 2HB LYS 20 1HB LYS 20 2.167 -10.233 3.086
137 1HG LYS 20 2HG LYS 20 3.192 -7.681 4.308
138 2HG LYS 20 1HG LYS 20 3.902 -9.278 4.545
139 1HD LYS 20 2HD LYS 20 3.560 -8.790 1.744
140 2HD LYS 20 1HD LYS 20 4.419 -7.433 2.478
141 1HE LYS 20 2HE LYS 20 6.099 -8.942 1.846
142 2HE LYS 20 1HE LYS 20 5.906 -9.179 3.582
143 1HZ LYS 20 1HZ LYS 20 5.848 -11.126 1.690
144 2HZ LYS 20 2HZ LYS 20 4.205 -10.885 2.027
145 3HZ LYS 20 3HZ LYS 20 5.275 -11.278 3.281
146 H LYS 21 H LYS 21 -0.935 -9.912 2.453
147 HA LYS 21 HA LYS 21 -0.314 -11.084 -0.088
148 1HB LYS 21 2HB LYS 21 -2.692 -11.926 0.048
149 2HB LYS 21 1HB LYS 21 -1.665 -12.379 1.401
150 1HG LYS 21 2HG LYS 21 -3.275 -11.617 2.727
151 2HG LYS 21 1HG LYS 21 -2.813 -9.994 2.207
152 1HD LYS 21 2HD LYS 21 -4.387 -10.489 0.192
153 2HD LYS 21 1HD LYS 21 -5.060 -11.723 1.260
154 1HE LYS 21 2HE LYS 21 -4.692 -8.967 2.323
155 2HE LYS 21 1HE LYS 21 -6.023 -9.267 1.205
156 1HZ LYS 21 1HZ LYS 21 -5.549 -10.504 3.852
157 2HZ LYS 21 2HZ LYS 21 -6.626 -11.168 2.729
158 3HZ LYS 21 3HZ LYS 21 -6.893 -9.607 3.337
159 H CYS 22 H CYS 22 -1.290 -8.103 0.806
160 HA CYS 22 HA CYS 22 -2.957 -7.471 -1.479
161 1HB CYS 22 2HB CYS 22 -2.332 -6.347 1.115
162 2HB CYS 22 1HB CYS 22 -2.068 -5.152 -0.150
163 H GLY 23 H GLY 23 -0.416 -5.452 -0.234
164 1HA GLY 23 1HA GLY 23 1.601 -4.719 -1.018
165 2HA GLY 23 2HA GLY 23 1.694 -6.210 -1.936
166 H ASN 24 H ASN 24 -0.878 -3.863 -2.402
167 HA ASN 24 HA ASN 24 0.047 -3.513 -5.146
168 1HB ASN 24 2HB ASN 24 -2.271 -4.097 -4.924
169 2HB ASN 24 1HB ASN 24 -2.540 -2.824 -3.745
170 1HD2 ASN 24 1HD2 ASN 24 -3.261 -0.938 -4.431
171 2HD2 ASN 24 2HD2 ASN 24 -3.324 -0.422 -6.082
172 H VAL 25 H VAL 25 0.105 -1.388 -6.105
173 HA VAL 25 HA VAL 25 1.138 0.611 -4.264
174 HB VAL 25 HB VAL 25 1.518 1.837 -6.563
175 1HG1 VAL 25 1HG1 VAL 25 3.199 -0.588 -6.007
176 2HG1 VAL 25 2HG1 VAL 25 3.705 0.985 -6.622
177 3HG1 VAL 25 3HG1 VAL 25 3.203 0.815 -4.939
178 1HG2 VAL 25 1HG2 VAL 25 1.596 0.532 -8.476
179 2HG2 VAL 25 2HG2 VAL 25 1.649 -0.977 -7.565
180 3HG2 VAL 25 3HG2 VAL 25 0.145 -0.066 -7.672
181 H ASN 26 H ASN 26 -0.660 1.482 -3.272
182 HA ASN 26 HA ASN 26 -2.794 2.517 -4.974
183 1HB ASN 26 2HB ASN 26 -2.537 2.041 -2.029
184 2HB ASN 26 1HB ASN 26 -3.714 3.209 -2.614
185 1HD2 ASN 26 1HD2 ASN 26 -3.245 0.035 -1.821
186 2HD2 ASN 26 2HD2 ASN 26 -4.578 -0.658 -2.685
187 H PHE 27 H PHE 27 -3.641 4.718 -4.391
188 HA PHE 27 HA PHE 27 -1.435 6.521 -4.843
189 1HB PHE 27 2HB PHE 27 -3.404 6.611 -6.288
190 2HB PHE 27 1HB PHE 27 -4.433 6.953 -4.904
191 HD1 PHE 27 1HD PHE 27 -5.300 9.034 -5.259
192 HD2 PHE 27 2HD PHE 27 -1.135 8.405 -5.870
193 HE1 PHE 27 1HE PHE 27 -4.993 11.451 -5.615
194 HE2 PHE 27 2HE PHE 27 -0.817 10.819 -6.228
195 HZ PHE 27 HZ PHE 27 -2.747 12.347 -6.100
196 H ALA 28 H ALA 28 -4.336 7.527 -3.143
197 HA ALA 28 HA ALA 28 -3.075 7.973 -0.618
198 1HB ALA 28 1HB ALA 28 -2.550 10.210 -0.701
199 2HB ALA 28 2HB ALA 28 -2.080 9.695 -2.321
200 3HB ALA 28 3HB ALA 28 -3.617 10.527 -2.071
201 H ARG 29 H ARG 29 -5.399 9.719 -2.703
202 HA ARG 29 HA ARG 29 -7.358 9.764 -0.596
203 1HB ARG 29 2HB ARG 29 -8.763 10.969 -2.184
204 2HB ARG 29 1HB ARG 29 -7.147 11.658 -2.140
205 1HG ARG 29 2HG ARG 29 -6.583 10.657 -4.232
206 2HG ARG 29 1HG ARG 29 -8.076 9.715 -4.244
207 1HD ARG 29 2HD ARG 29 -8.023 12.725 -4.225
208 2HD ARG 29 1HD ARG 29 -8.056 11.771 -5.709
209 HE ARG 29 HE ARG 29 -10.219 10.947 -5.058
210 1HH1 ARG 29 2HH1 ARG 29 -9.014 13.609 -3.137
211 2HH1 ARG 29 1HH1 ARG 29 -10.592 14.091 -2.585
212 1HH2 ARG 29 2HH2 ARG 29 -12.288 11.570 -4.357
213 2HH2 ARG 29 1HH2 ARG 29 -12.462 12.926 -3.279
214 H ARG 30 H ARG 30 -6.395 7.209 -1.867
215 HA ARG 30 HA ARG 30 -8.870 6.096 -2.919
216 1HB ARG 30 2HB ARG 30 -6.082 4.992 -2.544
217 2HB ARG 30 1HB ARG 30 -7.444 3.957 -2.952
218 1HG ARG 30 2HG ARG 30 -7.740 5.763 -4.877
219 2HG ARG 30 1HG ARG 30 -6.006 5.940 -4.601
220 1HD ARG 30 2HD ARG 30 -6.111 4.286 -6.230
221 2HD ARG 30 1HD ARG 30 -5.931 3.373 -4.735
222 HE ARG 30 HE ARG 30 -8.307 2.878 -4.849
223 1HH1 ARG 30 2HH1 ARG 30 -6.854 4.222 -7.734
224 2HH1 ARG 30 1HH1 ARG 30 -8.008 3.494 -8.812
225 1HH2 ARG 30 2HH2 ARG 30 -9.834 1.913 -6.262
226 2HH2 ARG 30 1HH2 ARG 30 -9.684 2.158 -7.979
227 H THR 31 H THR 31 -10.360 5.508 -1.455
228 HA THR 31 HA THR 31 -9.545 4.769 1.227
229 HB THR 31 HB THR 31 -12.329 4.338 0.841
230 HG1 THR 31 1HG THR 31 -12.953 6.291 -0.107
231 1HG2 THR 31 1HG2 THR 31 -12.456 5.636 2.686
232 2HG2 THR 31 2HG2 THR 31 -11.447 6.901 1.986
233 3HG2 THR 31 3HG2 THR 31 -10.701 5.469 2.696
234 H SER 32 H SER 32 -9.708 3.203 -1.627
235 HA SER 32 HA SER 32 -9.827 0.620 -0.301
236 1HB SER 32 2HB SER 32 -11.327 1.005 -2.886
237 2HB SER 32 1HB SER 32 -11.446 -0.323 -1.732
238 HG SER 32 HG SER 32 -12.211 1.481 -0.252
239 H CYS 33 H CYS 33 -8.746 -1.039 -1.469
240 HA CYS 33 HA CYS 33 -6.416 -0.295 -2.800
241 1HB CYS 33 2HB CYS 33 -7.924 -2.888 -2.736
242 2HB CYS 33 1HB CYS 33 -6.332 -2.733 -3.450
243 H ASP 34 H ASP 34 -5.816 -0.192 -4.904
244 HA ASP 34 HA ASP 34 -7.802 0.194 -6.918
245 1HB ASP 34 2HB ASP 34 -5.794 1.503 -7.040
246 2HB ASP 34 1HB ASP 34 -4.784 0.061 -7.012
247 H ARG 35 H ARG 35 -5.607 -2.412 -6.055
248 HA ARG 35 HA ARG 35 -6.433 -3.933 -8.424
249 1HB ARG 35 2HB ARG 35 -3.970 -3.671 -6.980
250 2HB ARG 35 1HB ARG 35 -4.479 -5.351 -6.946
251 1HG ARG 35 2HG ARG 35 -4.219 -3.706 -9.449
252 2HG ARG 35 1HG ARG 35 -2.981 -4.802 -8.830
253 1HD ARG 35 2HD ARG 35 -5.753 -5.820 -9.252
254 2HD ARG 35 1HD ARG 35 -4.702 -5.598 -10.649
255 HE ARG 35 HE ARG 35 -3.097 -7.055 -9.209
256 1HH1 ARG 35 2HH1 ARG 35 -6.584 -7.404 -9.440
257 2HH1 ARG 35 1HH1 ARG 35 -6.548 -9.116 -9.145
258 1HH2 ARG 35 2HH2 ARG 35 -3.064 -9.304 -8.848
259 2HH2 ARG 35 1HH2 ARG 35 -4.559 -10.193 -8.816
260 H CYS 36 H CYS 36 -5.876 -4.454 -4.941
261 HA CYS 36 HA CYS 36 -7.131 -7.017 -4.979
262 1HB CYS 36 2HB CYS 36 -6.739 -5.910 -2.373
263 2HB CYS 36 1HB CYS 36 -5.814 -7.176 -3.190
264 H GLY 37 H GLY 37 -8.215 -3.790 -4.372
265 1HA GLY 37 1HA GLY 37 -10.361 -2.985 -4.158
266 2HA GLY 37 2HA GLY 37 -10.941 -4.630 -4.361
267 H ARG 38 H ARG 38 -8.654 -4.102 -1.839
268 HA ARG 38 HA ARG 38 -10.598 -4.793 0.159
269 1HB ARG 38 2HB ARG 38 -7.737 -3.909 0.572
270 2HB ARG 38 1HB ARG 38 -8.749 -4.789 1.711
271 1HG ARG 38 2HG ARG 38 -8.043 -5.917 -0.977
272 2HG ARG 38 1HG ARG 38 -6.995 -6.112 0.430
273 1HD ARG 38 2HD ARG 38 -8.229 -7.992 0.696
274 2HD ARG 38 1HD ARG 38 -9.309 -6.870 1.524
275 HE ARG 38 HE ARG 38 -9.663 -7.613 -1.313
276 1HH1 ARG 38 2HH1 ARG 38 -10.950 -7.068 1.899
277 2HH1 ARG 38 1HH1 ARG 38 -12.592 -7.408 1.442
278 1HH2 ARG 38 2HH2 ARG 38 -11.818 -8.088 -1.918
279 2HH2 ARG 38 1HH2 ARG 38 -13.085 -8.023 -0.719
280 H GLU 39 H GLU 39 -10.289 -3.413 2.336
281 HA GLU 39 HA GLU 39 -11.030 -0.680 1.572
282 1HB GLU 39 2HB GLU 39 -11.993 -0.660 3.950
283 2HB GLU 39 1HB GLU 39 -12.816 -1.637 2.744
284 1HG GLU 39 2HG GLU 39 -10.737 -2.964 4.386
285 2HG GLU 39 1HG GLU 39 -12.252 -2.529 5.177
286 H LYS 40 H LYS 40 -10.237 1.113 2.742
287 HA LYS 40 HA LYS 40 -7.538 0.923 3.598
288 1HB LYS 40 2HB LYS 40 -8.629 2.942 2.555
289 2HB LYS 40 1HB LYS 40 -9.452 3.208 4.087
290 1HG LYS 40 2HG LYS 40 -7.525 3.838 5.171
291 2HG LYS 40 1HG LYS 40 -6.480 2.976 4.039
292 1HD LYS 40 2HD LYS 40 -6.552 4.658 2.481
293 2HD LYS 40 1HD LYS 40 -8.137 5.224 3.015
294 1HE LYS 40 2HE LYS 40 -7.181 6.234 4.971
295 2HE LYS 40 1HE LYS 40 -5.596 5.550 4.604
296 1HZ LYS 40 1HZ LYS 40 -6.611 7.993 3.796
297 2HZ LYS 40 2HZ LYS 40 -6.559 7.036 2.402
298 3HZ LYS 40 3HZ LYS 40 -5.146 7.280 3.313
299 H THR 41 H THR 41 -7.489 -0.559 5.285
300 HA THR 41 HA THR 41 -8.837 0.214 7.765
301 HB THR 41 HB THR 41 -8.935 -2.178 6.768
302 HG1 THR 41 1HG THR 41 -9.716 -2.431 8.700
303 1HG2 THR 41 1HG2 THR 41 -7.013 -3.273 6.511
304 2HG2 THR 41 2HG2 THR 41 -6.792 -3.228 8.261
305 3HG2 THR 41 3HG2 THR 41 -6.120 -1.945 7.256
306 H THR 42 H THR 42 -7.337 -0.559 9.746
307 HA THR 42 HA THR 42 -5.505 -0.196 11.039
308 HB THR 42 HB THR 42 -3.933 0.599 8.588
309 HG1 THR 42 1HG THR 42 -5.077 -1.722 8.991
310 1HG2 THR 42 1HG2 THR 42 -2.573 1.098 10.373
311 2HG2 THR 42 2HG2 THR 42 -2.154 -0.597 10.131
312 3HG2 THR 42 3HG2 THR 42 -3.285 -0.142 11.404
313 H GLY 43 H GLY 43 -5.795 2.205 8.422
314 1HA GLY 43 1HA GLY 43 -5.973 4.273 10.519
315 2HA GLY 43 2HA GLY 43 -4.946 4.523 9.112
316 HA PRO 44 HA PRO 44 -9.442 4.626 7.470
317 1HB PRO 44 2HB PRO 44 -11.320 4.551 9.632
318 2HB PRO 44 1HB PRO 44 -11.049 3.329 8.389
319 1HG PRO 44 2HG PRO 44 -10.485 2.996 11.068
320 2HG PRO 44 1HG PRO 44 -9.737 2.066 9.758
321 1HD PRO 44 2HD PRO 44 -8.668 4.417 11.271
322 2HD PRO 44 1HD PRO 44 -7.821 2.961 10.700
323 H ILE 45 H ILE 45 -8.866 6.793 7.088
324 HA ILE 45 HA ILE 45 -10.522 8.694 8.566
325 HB ILE 45 HB ILE 45 -8.398 10.282 7.928
326 1HG1 ILE 45 2HG1 ILE 45 -6.826 8.345 9.392
327 1HG2 ILE 45 1HG2 ILE 45 -8.027 9.302 10.588
328 2HG2 ILE 45 2HG2 ILE 45 -8.724 10.831 10.047
329 3HG2 ILE 45 3HG2 ILE 45 -9.749 9.406 10.223
330 1HD1 ILE 45 1HD1 ILE 45 -6.227 9.337 6.638
331 2HD1 ILE 45 2HD1 ILE 45 -6.073 10.386 8.048
332 3HD1 ILE 45 3HD1 ILE 45 -5.112 8.912 7.935
Start of MODEL 19
1 1H GLY 1 1H GLY 1 20.078 -5.341 8.868
2 2H GLY 1 2H GLY 1 20.452 -6.704 7.932
3 3H GLY 1 3H GLY 1 20.753 -6.718 9.598
4 1HA GLY 1 2HA GLY 1 18.818 -7.832 9.675
5 2HA GLY 1 1HA GLY 1 18.168 -6.198 9.659
6 H SER 2 H SER 2 16.459 -7.980 8.806
7 HA SER 2 HA SER 2 16.671 -8.473 5.970
8 1HB SER 2 2HB SER 2 14.065 -8.737 7.408
9 2HB SER 2 1HB SER 2 14.815 -9.815 6.230
10 HG SER 2 HG SER 2 15.425 -9.524 8.987
11 H MET 3 H MET 3 17.023 -5.864 6.194
12 HA MET 3 HA MET 3 14.499 -4.445 5.998
13 1HB MET 3 2HB MET 3 16.486 -3.491 7.198
14 2HB MET 3 1HB MET 3 17.302 -3.362 5.645
15 1HG MET 3 2HG MET 3 16.448 -1.229 6.076
16 2HG MET 3 1HG MET 3 15.351 -1.936 4.893
17 1HE MET 3 1HE MET 3 13.460 0.034 5.604
18 2HE MET 3 2HE MET 3 13.055 -1.573 5.001
19 3HE MET 3 3HE MET 3 12.164 -0.890 6.362
20 H SER 4 H SER 4 13.865 -5.699 4.084
21 HA SER 4 HA SER 4 15.109 -5.084 1.581
22 1HB SER 4 2HB SER 4 12.254 -5.852 1.589
23 2HB SER 4 1HB SER 4 13.613 -6.563 0.718
24 HG SER 4 HG SER 4 12.436 -7.511 2.867
25 H THR 5 H THR 5 15.304 -2.838 1.623
26 HA THR 5 HA THR 5 13.143 -1.089 2.194
27 HB THR 5 HB THR 5 15.130 0.246 0.656
28 HG1 THR 5 1HG THR 5 16.680 -1.234 0.939
29 1HG2 THR 5 1HG2 THR 5 15.714 1.182 2.938
30 2HG2 THR 5 2HG2 THR 5 14.492 0.096 3.599
31 3HG2 THR 5 3HG2 THR 5 14.028 1.350 2.449
32 H LYS 6 H LYS 6 11.442 -0.757 0.897
33 HA LYS 6 HA LYS 6 11.718 -0.906 -1.983
34 1HB LYS 6 2HB LYS 6 9.563 -1.159 -0.208
35 2HB LYS 6 1HB LYS 6 9.261 0.343 -1.069
36 1HG LYS 6 2HG LYS 6 9.919 -1.240 -3.138
37 2HG LYS 6 1HG LYS 6 9.228 -2.437 -2.041
38 1HD LYS 6 2HD LYS 6 7.167 -1.751 -2.507
39 2HD LYS 6 1HD LYS 6 7.583 -0.084 -2.106
40 1HE LYS 6 2HE LYS 6 6.741 -0.612 -4.483
41 2HE LYS 6 1HE LYS 6 8.144 0.435 -4.300
42 1HZ LYS 6 1HZ LYS 6 8.113 -2.426 -5.097
43 2HZ LYS 6 2HZ LYS 6 9.531 -1.604 -4.660
44 3HZ LYS 6 3HZ LYS 6 8.642 -1.096 -6.008
45 H ASN 7 H ASN 7 12.927 0.682 -2.792
46 HA ASN 7 HA ASN 7 13.099 3.252 -1.546
47 1HB ASN 7 2HB ASN 7 14.767 3.757 -3.232
48 2HB ASN 7 1HB ASN 7 15.049 2.145 -2.586
49 1HD2 ASN 7 1HD2 ASN 7 15.442 3.693 -5.256
50 2HD2 ASN 7 2HD2 ASN 7 14.980 2.511 -6.439
51 H PHE 8 H PHE 8 10.651 2.161 -3.229
52 HA PHE 8 HA PHE 8 10.218 4.261 -5.119
53 1HB PHE 8 2HB PHE 8 9.094 1.834 -4.803
54 2HB PHE 8 1HB PHE 8 7.903 2.807 -3.948
55 HD1 PHE 8 1HD PHE 8 9.886 3.177 -7.093
56 HD2 PHE 8 2HD PHE 8 6.066 3.306 -5.210
57 HE1 PHE 8 1HE PHE 8 8.855 3.793 -9.237
58 HE2 PHE 8 2HE PHE 8 5.027 3.924 -7.359
59 HZ PHE 8 HZ PHE 8 6.424 4.166 -9.373
60 H ARG 9 H ARG 9 10.475 6.189 -4.095
61 HA ARG 9 HA ARG 9 9.347 6.818 -1.569
62 1HB ARG 9 2HB ARG 9 10.717 8.378 -3.730
63 2HB ARG 9 1HB ARG 9 9.910 9.232 -2.420
64 1HG ARG 9 2HG ARG 9 11.449 8.618 -0.883
65 2HG ARG 9 1HG ARG 9 11.735 7.049 -1.637
66 1HD ARG 9 2HD ARG 9 12.588 9.179 -3.370
67 2HD ARG 9 1HD ARG 9 13.347 9.335 -1.787
68 HE ARG 9 HE ARG 9 13.899 7.364 -3.786
69 1HH1 ARG 9 2HH1 ARG 9 13.866 7.910 -0.319
70 2HH1 ARG 9 1HH1 ARG 9 15.058 6.691 0.016
71 1HH2 ARG 9 2HH2 ARG 9 15.510 5.780 -3.338
72 2HH2 ARG 9 1HH2 ARG 9 15.984 5.498 -1.689
73 H VAL 10 H VAL 10 7.201 6.719 -1.386
74 HA VAL 10 HA VAL 10 5.504 7.981 -3.389
75 HB VAL 10 HB VAL 10 3.765 7.109 -1.494
76 1HG1 VAL 10 1HG1 VAL 10 3.797 4.925 -2.980
77 2HG1 VAL 10 2HG1 VAL 10 3.251 6.471 -3.629
78 3HG1 VAL 10 3HG1 VAL 10 4.884 5.898 -3.969
79 1HG2 VAL 10 1HG2 VAL 10 5.434 6.128 -0.070
80 2HG2 VAL 10 2HG2 VAL 10 4.505 4.834 -0.829
81 3HG2 VAL 10 3HG2 VAL 10 6.117 5.226 -1.423
82 H SER 11 H SER 11 3.586 9.227 -2.435
83 HA SER 11 HA SER 11 4.602 11.505 -1.101
84 1HB SER 11 2HB SER 11 1.671 11.112 -1.200
85 2HB SER 11 1HB SER 11 2.647 12.486 -1.723
86 HG SER 11 HG SER 11 1.817 10.247 -3.136
87 H ASP 12 H ASP 12 3.360 12.465 0.830
88 HA ASP 12 HA ASP 12 3.936 10.773 3.037
89 1HB ASP 12 2HB ASP 12 3.943 13.398 2.822
90 2HB ASP 12 1HB ASP 12 2.278 13.235 3.371
91 H GLY 13 H GLY 13 0.880 11.985 1.684
92 1HA GLY 13 1HA GLY 13 -0.692 10.521 3.601
93 2HA GLY 13 2HA GLY 13 -1.303 11.417 2.221
94 H ASP 14 H ASP 14 0.827 9.723 0.696
95 HA ASP 14 HA ASP 14 -1.066 7.826 -0.290
96 1HB ASP 14 2HB ASP 14 1.722 8.605 -0.964
97 2HB ASP 14 1HB ASP 14 1.226 6.979 -1.424
98 H TRP 15 H TRP 15 -0.999 5.573 -0.135
99 HA TRP 15 HA TRP 15 0.549 4.561 2.147
100 1HB TRP 15 2HB TRP 15 -1.486 3.387 2.950
101 2HB TRP 15 1HB TRP 15 -1.682 5.136 2.973
102 HD1 TRP 15 HD TRP 15 -3.028 6.115 0.646
103 HE1 TRP 15 1HE TRP 15 -5.109 5.121 -0.497
104 HE3 TRP 15 3HE TRP 15 -2.785 1.384 2.550
105 HZ2 TRP 15 2HZ TRP 15 -6.477 2.636 -0.559
106 HZ3 TRP 15 3HZ TRP 15 -4.505 -0.245 1.908
107 HH2 TRP 15 HH TRP 15 -6.313 0.363 0.368
108 H ILE 16 H ILE 16 0.599 2.183 2.253
109 HA ILE 16 HA ILE 16 0.211 0.928 -0.369
110 HB ILE 16 HB ILE 16 1.776 -0.787 0.319
111 1HG1 ILE 16 2HG1 ILE 16 2.967 0.352 2.641
112 1HG2 ILE 16 1HG2 ILE 16 2.528 2.040 0.222
113 2HG2 ILE 16 2HG2 ILE 16 3.758 0.967 0.893
114 3HG2 ILE 16 3HG2 ILE 16 3.118 0.672 -0.722
115 1HD1 ILE 16 1HD1 ILE 16 3.301 -1.863 2.693
116 2HD1 ILE 16 2HD1 ILE 16 1.771 -1.881 3.570
117 3HD1 ILE 16 3HD1 ILE 16 1.799 -2.218 1.837
118 H CYS 17 H CYS 17 -0.634 -1.253 -0.344
119 HA CYS 17 HA CYS 17 -3.080 -1.477 0.781
120 1HB CYS 17 2HB CYS 17 -1.144 -3.511 -0.230
121 2HB CYS 17 1HB CYS 17 -2.694 -4.017 0.431
122 HA PRO 18 HA PRO 18 -2.760 -2.284 5.018
123 1HB PRO 18 2HB PRO 18 -5.136 -4.001 4.890
124 2HB PRO 18 1HB PRO 18 -4.929 -2.429 5.669
125 1HG PRO 18 2HG PRO 18 -6.415 -2.715 3.456
126 2HG PRO 18 1HG PRO 18 -5.434 -1.264 3.745
127 1HD PRO 18 2HD PRO 18 -4.830 -3.630 2.002
128 2HD PRO 18 1HD PRO 18 -4.618 -1.899 1.664
129 H ASP 19 H ASP 19 -2.801 -4.973 2.851
130 HA ASP 19 HA ASP 19 -1.940 -6.753 5.036
131 1HB ASP 19 2HB ASP 19 -4.281 -7.130 3.927
132 2HB ASP 19 1HB ASP 19 -3.337 -7.829 2.614
133 H LYS 20 H LYS 20 -0.819 -8.751 4.132
134 HA LYS 20 HA LYS 20 1.304 -7.859 2.347
135 1HB LYS 20 2HB LYS 20 0.961 -10.338 4.041
136 2HB LYS 20 1HB LYS 20 2.334 -10.076 2.975
137 1HG LYS 20 2HG LYS 20 3.337 -9.113 4.707
138 2HG LYS 20 1HG LYS 20 2.222 -7.763 4.486
139 1HD LYS 20 2HD LYS 20 0.910 -9.854 5.926
140 2HD LYS 20 1HD LYS 20 2.452 -9.491 6.702
141 1HE LYS 20 2HE LYS 20 1.871 -7.202 6.973
142 2HE LYS 20 1HE LYS 20 0.458 -7.368 5.931
143 1HZ LYS 20 1HZ LYS 20 0.400 -7.482 8.612
144 2HZ LYS 20 2HZ LYS 20 0.479 -9.128 8.221
145 3HZ LYS 20 3HZ LYS 20 -0.775 -8.169 7.602
146 H LYS 21 H LYS 21 -1.467 -9.938 2.456
147 HA LYS 21 HA LYS 21 -0.927 -11.239 -0.063
148 1HB LYS 21 2HB LYS 21 -3.374 -11.025 1.692
149 2HB LYS 21 1HB LYS 21 -3.421 -11.818 0.123
150 1HG LYS 21 2HG LYS 21 -2.422 -13.659 0.896
151 2HG LYS 21 1HG LYS 21 -1.246 -12.737 1.837
152 1HD LYS 21 2HD LYS 21 -3.114 -12.282 3.478
153 2HD LYS 21 1HD LYS 21 -4.057 -13.489 2.601
154 1HE LYS 21 2HE LYS 21 -1.589 -14.697 3.059
155 2HE LYS 21 1HE LYS 21 -1.966 -13.851 4.559
156 1HZ LYS 21 1HZ LYS 21 -3.764 -15.767 3.165
157 2HZ LYS 21 2HZ LYS 21 -4.107 -14.963 4.617
158 3HZ LYS 21 3HZ LYS 21 -2.851 -16.102 4.556
159 H CYS 22 H CYS 22 -1.937 -8.215 0.946
160 HA CYS 22 HA CYS 22 -3.340 -7.473 -1.480
161 1HB CYS 22 2HB CYS 22 -3.032 -6.469 1.202
162 2HB CYS 22 1HB CYS 22 -2.533 -5.229 0.061
163 H GLY 23 H GLY 23 -0.869 -5.572 0.107
164 1HA GLY 23 1HA GLY 23 1.206 -4.818 -0.483
165 2HA GLY 23 2HA GLY 23 1.380 -6.313 -1.382
166 H ASN 24 H ASN 24 -1.024 -3.815 -2.099
167 HA ASN 24 HA ASN 24 0.372 -3.301 -4.626
168 1HB ASN 24 2HB ASN 24 -1.849 -4.032 -5.002
169 2HB ASN 24 1HB ASN 24 -2.497 -3.020 -3.728
170 1HD2 ASN 24 1HD2 ASN 24 -3.069 -0.976 -4.136
171 2HD2 ASN 24 2HD2 ASN 24 -2.983 -0.233 -5.698
172 H VAL 25 H VAL 25 0.456 -1.069 -5.391
173 HA VAL 25 HA VAL 25 0.833 0.843 -3.217
174 HB VAL 25 HB VAL 25 1.603 2.311 -5.257
175 1HG1 VAL 25 1HG1 VAL 25 3.878 1.372 -5.029
176 2HG1 VAL 25 2HG1 VAL 25 3.069 1.597 -3.477
177 3HG1 VAL 25 3HG1 VAL 25 3.191 -0.014 -4.182
178 1HG2 VAL 25 1HG2 VAL 25 2.022 -0.460 -6.378
179 2HG2 VAL 25 2HG2 VAL 25 0.793 0.671 -6.947
180 3HG2 VAL 25 3HG2 VAL 25 2.505 1.070 -7.111
181 H ASN 26 H ASN 26 -0.746 2.219 -2.701
182 HA ASN 26 HA ASN 26 -2.916 2.578 -4.660
183 1HB ASN 26 2HB ASN 26 -3.613 3.029 -1.845
184 2HB ASN 26 1HB ASN 26 -4.466 2.117 -3.083
185 1HD2 ASN 26 1HD2 ASN 26 -4.631 0.031 -2.680
186 2HD2 ASN 26 2HD2 ASN 26 -3.527 -0.928 -1.751
187 H PHE 27 H PHE 27 -4.338 4.504 -3.984
188 HA PHE 27 HA PHE 27 -2.594 6.839 -3.791
189 1HB PHE 27 2HB PHE 27 -4.551 6.201 -5.614
190 2HB PHE 27 1HB PHE 27 -5.415 7.248 -4.494
191 HD1 PHE 27 1HD PHE 27 -2.077 7.185 -6.174
192 HD2 PHE 27 2HD PHE 27 -5.507 9.444 -5.070
193 HE1 PHE 27 1HE PHE 27 -1.129 9.165 -7.291
194 HE2 PHE 27 2HE PHE 27 -4.569 11.427 -6.185
195 HZ PHE 27 HZ PHE 27 -2.376 11.288 -7.299
196 H ALA 28 H ALA 28 -2.820 8.262 -2.184
197 HA ALA 28 HA ALA 28 -4.044 7.871 0.226
198 1HB ALA 28 1HB ALA 28 -2.403 9.681 -0.403
199 2HB ALA 28 2HB ALA 28 -3.782 10.600 -1.012
200 3HB ALA 28 3HB ALA 28 -3.696 10.164 0.695
201 H ARG 29 H ARG 29 -5.455 9.315 -2.654
202 HA ARG 29 HA ARG 29 -7.920 9.999 -1.305
203 1HB ARG 29 2HB ARG 29 -6.713 10.462 -3.958
204 2HB ARG 29 1HB ARG 29 -8.467 10.318 -3.946
205 1HG ARG 29 2HG ARG 29 -8.751 12.286 -2.887
206 2HG ARG 29 1HG ARG 29 -7.313 12.069 -1.884
207 1HD ARG 29 2HD ARG 29 -5.922 12.557 -3.895
208 2HD ARG 29 1HD ARG 29 -7.407 12.936 -4.770
209 HE ARG 29 HE ARG 29 -6.185 14.500 -2.615
210 1HH1 ARG 29 2HH1 ARG 29 -8.791 14.079 -4.931
211 2HH1 ARG 29 1HH1 ARG 29 -9.367 15.715 -4.770
212 1HH2 ARG 29 2HH2 ARG 29 -6.939 16.662 -2.415
213 2HH2 ARG 29 1HH2 ARG 29 -8.301 17.186 -3.366
214 H ARG 30 H ARG 30 -6.870 7.153 -1.730
215 HA ARG 30 HA ARG 30 -9.362 6.052 -2.852
216 1HB ARG 30 2HB ARG 30 -6.510 5.239 -3.185
217 2HB ARG 30 1HB ARG 30 -7.713 3.961 -3.097
218 1HG ARG 30 2HG ARG 30 -8.038 6.252 -4.993
219 2HG ARG 30 1HG ARG 30 -7.012 4.873 -5.394
220 1HD ARG 30 2HD ARG 30 -8.760 3.489 -5.690
221 2HD ARG 30 1HD ARG 30 -9.683 4.199 -4.365
222 HE ARG 30 HE ARG 30 -9.573 5.176 -7.139
223 1HH1 ARG 30 2HH1 ARG 30 -11.005 5.244 -3.952
224 2HH1 ARG 30 1HH1 ARG 30 -12.363 6.217 -4.428
225 1HH2 ARG 30 2HH2 ARG 30 -11.347 6.483 -7.779
226 2HH2 ARG 30 1HH2 ARG 30 -12.539 6.945 -6.596
227 H THR 31 H THR 31 -10.580 5.321 -1.209
228 HA THR 31 HA THR 31 -9.409 4.513 1.286
229 HB THR 31 HB THR 31 -12.038 3.690 1.386
230 HG1 THR 31 1HG THR 31 -13.119 4.719 -0.101
231 1HG2 THR 31 1HG2 THR 31 -10.902 6.427 1.979
232 2HG2 THR 31 2HG2 THR 31 -10.896 5.037 3.066
233 3HG2 THR 31 3HG2 THR 31 -12.422 5.793 2.607
234 H SER 32 H SER 32 -9.949 3.003 -1.640
235 HA SER 32 HA SER 32 -9.472 0.382 -0.431
236 1HB SER 32 2HB SER 32 -11.021 0.202 -2.893
237 2HB SER 32 1HB SER 32 -11.320 -0.556 -1.329
238 HG SER 32 HG SER 32 -12.464 1.207 -0.667
239 H CYS 33 H CYS 33 -8.209 -1.057 -1.835
240 HA CYS 33 HA CYS 33 -6.238 0.253 -3.265
241 1HB CYS 33 2HB CYS 33 -6.636 -2.474 -4.170
242 2HB CYS 33 1HB CYS 33 -5.271 -1.705 -3.404
243 H ASP 34 H ASP 34 -5.580 -0.488 -5.474
244 HA ASP 34 HA ASP 34 -7.721 0.127 -7.371
245 1HB ASP 34 2HB ASP 34 -5.826 1.606 -7.509
246 2HB ASP 34 1HB ASP 34 -4.704 0.254 -7.552
247 H ARG 35 H ARG 35 -5.548 -2.365 -6.348
248 HA ARG 35 HA ARG 35 -6.101 -3.957 -8.749
249 1HB ARG 35 2HB ARG 35 -3.720 -3.592 -8.054
250 2HB ARG 35 1HB ARG 35 -4.060 -4.502 -6.589
251 1HG ARG 35 2HG ARG 35 -2.982 -5.948 -8.159
252 2HG ARG 35 1HG ARG 35 -4.665 -6.454 -7.999
253 1HD ARG 35 2HD ARG 35 -3.858 -6.445 -10.348
254 2HD ARG 35 1HD ARG 35 -5.237 -5.384 -10.073
255 HE ARG 35 HE ARG 35 -2.450 -4.472 -10.391
256 1HH1 ARG 35 2HH1 ARG 35 -5.906 -3.987 -10.713
257 2HH1 ARG 35 1HH1 ARG 35 -5.753 -2.392 -11.380
258 1HH2 ARG 35 2HH2 ARG 35 -2.245 -2.380 -11.307
259 2HH2 ARG 35 1HH2 ARG 35 -3.666 -1.474 -11.707
260 H CYS 36 H CYS 36 -5.647 -4.643 -5.252
261 HA CYS 36 HA CYS 36 -7.161 -7.057 -5.462
262 1HB CYS 36 2HB CYS 36 -6.746 -6.247 -2.777
263 2HB CYS 36 1HB CYS 36 -5.856 -7.460 -3.702
264 H GLY 37 H GLY 37 -7.722 -3.867 -4.018
265 1HA GLY 37 1HA GLY 37 -9.793 -2.786 -3.888
266 2HA GLY 37 2HA GLY 37 -10.582 -4.295 -4.315
267 H ARG 38 H ARG 38 -8.320 -3.475 -1.724
268 HA ARG 38 HA ARG 38 -10.320 -4.402 0.245
269 1HB ARG 38 2HB ARG 38 -7.654 -5.071 -0.025
270 2HB ARG 38 1HB ARG 38 -7.619 -3.837 1.225
271 1HG ARG 38 2HG ARG 38 -8.031 -5.514 2.628
272 2HG ARG 38 1HG ARG 38 -9.693 -5.413 2.041
273 1HD ARG 38 2HD ARG 38 -8.752 -7.709 1.999
274 2HD ARG 38 1HD ARG 38 -9.294 -7.132 0.424
275 HE ARG 38 HE ARG 38 -6.600 -6.507 0.587
276 1HH1 ARG 38 2HH1 ARG 38 -8.522 -9.441 0.746
277 2HH1 ARG 38 1HH1 ARG 38 -7.305 -10.416 -0.026
278 1HH2 ARG 38 2HH2 ARG 38 -5.028 -7.757 -0.408
279 2HH2 ARG 38 1HH2 ARG 38 -5.311 -9.448 -0.704
280 H GLU 39 H GLU 39 -10.618 -3.082 2.159
281 HA GLU 39 HA GLU 39 -10.420 -0.270 1.500
282 1HB GLU 39 2HB GLU 39 -11.754 -1.734 3.778
283 2HB GLU 39 1HB GLU 39 -11.738 0.018 3.633
284 1HG GLU 39 2HG GLU 39 -12.686 -1.463 1.268
285 2HG GLU 39 1HG GLU 39 -13.710 -1.543 2.702
286 H LYS 40 H LYS 40 -9.253 1.230 2.557
287 HA LYS 40 HA LYS 40 -6.851 0.427 3.818
288 1HB LYS 40 2HB LYS 40 -7.102 2.492 2.461
289 2HB LYS 40 1HB LYS 40 -8.124 3.172 3.720
290 1HG LYS 40 2HG LYS 40 -6.128 2.817 5.276
291 2HG LYS 40 1HG LYS 40 -5.187 2.586 3.800
292 1HD LYS 40 2HD LYS 40 -5.845 4.792 3.009
293 2HD LYS 40 1HD LYS 40 -6.860 5.021 4.435
294 1HE LYS 40 2HE LYS 40 -3.867 4.664 4.430
295 2HE LYS 40 1HE LYS 40 -4.727 6.189 4.656
296 1HZ LYS 40 1HZ LYS 40 -4.689 5.723 6.816
297 2HZ LYS 40 2HZ LYS 40 -4.159 4.133 6.556
298 3HZ LYS 40 3HZ LYS 40 -5.815 4.496 6.506
299 H THR 41 H THR 41 -7.027 -0.595 5.729
300 HA THR 41 HA THR 41 -8.930 0.199 7.721
301 HB THR 41 HB THR 41 -7.431 -1.535 9.068
302 HG1 THR 41 1HG THR 41 -6.544 -3.044 7.505
303 1HG2 THR 41 1HG2 THR 41 -9.072 -3.034 8.626
304 2HG2 THR 41 2HG2 THR 41 -8.916 -2.852 6.878
305 3HG2 THR 41 3HG2 THR 41 -9.816 -1.657 7.814
306 H THR 42 H THR 42 -8.564 2.074 8.774
307 HA THR 42 HA THR 42 -5.964 3.005 9.490
308 HB THR 42 HB THR 42 -8.047 4.029 11.216
309 HG1 THR 42 1HG THR 42 -9.631 4.332 9.849
310 1HG2 THR 42 1HG2 THR 42 -6.961 5.937 10.809
311 2HG2 THR 42 2HG2 THR 42 -7.137 5.761 9.063
312 3HG2 THR 42 3HG2 THR 42 -5.806 4.962 9.901
313 H GLY 43 H GLY 43 -8.460 1.087 10.994
314 1HA GLY 43 1HA GLY 43 -6.548 -0.027 12.848
315 2HA GLY 43 2HA GLY 43 -7.826 0.911 13.614
316 HA PRO 44 HA PRO 44 -9.215 -3.498 12.208
317 1HB PRO 44 2HB PRO 44 -8.410 -4.484 14.863
318 2HB PRO 44 1HB PRO 44 -8.133 -5.198 13.272
319 1HG PRO 44 2HG PRO 44 -6.137 -4.096 14.685
320 2HG PRO 44 1HG PRO 44 -6.202 -3.984 12.917
321 1HD PRO 44 2HD PRO 44 -6.933 -1.932 14.975
322 2HD PRO 44 1HD PRO 44 -6.047 -1.729 13.448
323 H ILE 45 H ILE 45 -9.457 -3.933 15.602
324 HA ILE 45 HA ILE 45 -11.886 -2.384 15.885
325 HB ILE 45 HB ILE 45 -12.752 -4.772 16.962
326 1HG1 ILE 45 2HG1 ILE 45 -11.378 -5.311 14.323
327 1HG2 ILE 45 1HG2 ILE 45 -13.730 -4.367 14.263
328 2HG2 ILE 45 2HG2 ILE 45 -14.566 -4.209 15.808
329 3HG2 ILE 45 3HG2 ILE 45 -13.623 -2.860 15.174
330 1HD1 ILE 45 1HD1 ILE 45 -12.861 -7.496 15.606
331 2HD1 ILE 45 2HD1 ILE 45 -13.838 -6.271 14.796
332 3HD1 ILE 45 3HD1 ILE 45 -12.597 -7.143 13.898
Start of MODEL 20
1 1H GLY 1 1H GLY 1 8.810 2.920 6.647
2 2H GLY 1 2H GLY 1 8.979 1.731 5.455
3 3H GLY 1 3H GLY 1 10.277 2.769 5.808
4 1HA GLY 1 2HA GLY 1 10.926 1.610 7.599
5 2HA GLY 1 1HA GLY 1 9.267 1.271 8.069
6 H SER 2 H SER 2 11.890 -0.308 7.547
7 HA SER 2 HA SER 2 12.432 -2.439 7.016
8 1HB SER 2 2HB SER 2 9.483 -2.807 6.426
9 2HB SER 2 1HB SER 2 10.672 -4.102 6.579
10 HG SER 2 HG SER 2 10.697 -3.862 8.697
11 H MET 3 H MET 3 9.872 -1.679 4.630
12 HA MET 3 HA MET 3 11.859 -2.256 2.531
13 1HB MET 3 2HB MET 3 9.759 -3.739 2.769
14 2HB MET 3 1HB MET 3 8.880 -2.362 2.124
15 1HG MET 3 2HG MET 3 9.529 -4.098 0.447
16 2HG MET 3 1HG MET 3 10.044 -2.455 0.071
17 1HE MET 3 1HE MET 3 12.489 -6.172 0.446
18 2HE MET 3 2HE MET 3 11.737 -5.775 1.990
19 3HE MET 3 3HE MET 3 10.742 -5.953 0.546
20 H SER 4 H SER 4 12.598 -0.454 1.652
21 HA SER 4 HA SER 4 10.900 1.921 1.580
22 1HB SER 4 2HB SER 4 13.555 2.363 0.561
23 2HB SER 4 1HB SER 4 12.800 3.035 2.006
24 HG SER 4 HG SER 4 14.489 1.883 2.775
25 H THR 5 H THR 5 10.114 2.757 -0.266
26 HA THR 5 HA THR 5 10.297 1.328 -2.723
27 HB THR 5 HB THR 5 9.318 3.876 -3.299
28 HG1 THR 5 1HG THR 5 7.722 3.850 -1.367
29 1HG2 THR 5 1HG2 THR 5 7.905 1.355 -2.439
30 2HG2 THR 5 2HG2 THR 5 8.286 1.857 -4.085
31 3HG2 THR 5 3HG2 THR 5 7.089 2.750 -3.147
32 H LYS 6 H LYS 6 12.346 1.279 -3.555
33 HA LYS 6 HA LYS 6 14.033 3.608 -3.613
34 1HB LYS 6 2HB LYS 6 14.397 1.027 -5.146
35 2HB LYS 6 1HB LYS 6 15.635 2.212 -4.748
36 1HG LYS 6 2HG LYS 6 14.591 1.502 -2.291
37 2HG LYS 6 1HG LYS 6 14.621 -0.013 -3.197
38 1HD LYS 6 2HD LYS 6 17.025 0.657 -3.828
39 2HD LYS 6 1HD LYS 6 16.899 1.816 -2.502
40 1HE LYS 6 2HE LYS 6 17.792 0.013 -1.399
41 2HE LYS 6 1HE LYS 6 16.071 -0.287 -1.165
42 1HZ LYS 6 1HZ LYS 6 18.005 -1.729 -2.799
43 2HZ LYS 6 2HZ LYS 6 16.438 -1.586 -3.433
44 3HZ LYS 6 3HZ LYS 6 16.681 -2.311 -1.917
45 H ASN 7 H ASN 7 12.052 1.817 -5.889
46 HA ASN 7 HA ASN 7 12.452 3.899 -7.921
47 1HB ASN 7 2HB ASN 7 12.704 1.687 -8.814
48 2HB ASN 7 1HB ASN 7 11.236 1.131 -8.023
49 1HD2 ASN 7 1HD2 ASN 7 10.133 0.477 -9.776
50 2HD2 ASN 7 2HD2 ASN 7 9.621 1.533 -11.054
51 H PHE 8 H PHE 8 10.961 5.436 -8.141
52 HA PHE 8 HA PHE 8 9.191 6.750 -7.695
53 1HB PHE 8 2HB PHE 8 8.095 4.675 -8.861
54 2HB PHE 8 1HB PHE 8 7.459 4.354 -7.257
55 HD1 PHE 8 1HD PHE 8 5.289 5.039 -6.975
56 HD2 PHE 8 2HD PHE 8 7.879 7.375 -9.424
57 HE1 PHE 8 1HE PHE 8 3.455 6.624 -7.403
58 HE2 PHE 8 2HE PHE 8 6.047 8.961 -9.850
59 HZ PHE 8 HZ PHE 8 3.832 8.585 -8.845
60 H ARG 9 H ARG 9 10.198 7.404 -5.770
61 HA ARG 9 HA ARG 9 9.826 5.959 -3.320
62 1HB ARG 9 2HB ARG 9 10.790 8.805 -3.562
63 2HB ARG 9 1HB ARG 9 11.163 7.636 -2.304
64 1HG ARG 9 2HG ARG 9 12.001 6.588 -4.820
65 2HG ARG 9 1HG ARG 9 12.631 8.223 -4.633
66 1HD ARG 9 2HD ARG 9 12.929 5.988 -2.630
67 2HD ARG 9 1HD ARG 9 14.175 6.526 -3.754
68 HE ARG 9 HE ARG 9 13.383 7.793 -1.290
69 1HH1 ARG 9 2HH1 ARG 9 14.962 8.219 -4.389
70 2HH1 ARG 9 1HH1 ARG 9 15.810 9.659 -3.909
71 1HH2 ARG 9 2HH2 ARG 9 14.503 9.682 -0.639
72 2HH2 ARG 9 1HH2 ARG 9 15.563 10.479 -1.769
73 H VAL 10 H VAL 10 7.504 5.887 -3.323
74 HA VAL 10 HA VAL 10 6.056 8.328 -2.790
75 HB VAL 10 HB VAL 10 4.346 6.317 -2.065
76 1HG1 VAL 10 1HG1 VAL 10 3.644 6.550 -4.595
77 2HG1 VAL 10 2HG1 VAL 10 3.473 7.896 -3.468
78 3HG1 VAL 10 3HG1 VAL 10 4.849 7.838 -4.570
79 1HG2 VAL 10 1HG2 VAL 10 4.525 4.502 -3.610
80 2HG2 VAL 10 2HG2 VAL 10 5.911 5.246 -4.408
81 3HG2 VAL 10 3HG2 VAL 10 6.063 4.639 -2.760
82 H SER 11 H SER 11 7.330 8.977 -0.955
83 HA SER 11 HA SER 11 6.630 7.597 1.533
84 1HB SER 11 2HB SER 11 8.279 10.025 1.650
85 2HB SER 11 1HB SER 11 8.542 8.455 2.415
86 HG SER 11 HG SER 11 9.969 9.275 0.542
87 H ASP 12 H ASP 12 4.597 8.882 0.093
88 HA ASP 12 HA ASP 12 4.215 11.496 1.369
89 1HB ASP 12 2HB ASP 12 4.049 10.947 -1.228
90 2HB ASP 12 1HB ASP 12 2.404 10.503 -0.786
91 H GLY 13 H GLY 13 1.307 11.301 0.654
92 1HA GLY 13 1HA GLY 13 0.416 10.005 3.109
93 2HA GLY 13 2HA GLY 13 -0.554 11.005 2.039
94 H ASP 14 H ASP 14 1.326 8.604 0.576
95 HA ASP 14 HA ASP 14 -0.931 7.180 -0.439
96 1HB ASP 14 2HB ASP 14 0.830 5.685 -1.421
97 2HB ASP 14 1HB ASP 14 1.044 7.390 -1.814
98 H TRP 15 H TRP 15 -0.732 4.654 -0.357
99 HA TRP 15 HA TRP 15 0.283 3.552 2.072
100 1HB TRP 15 2HB TRP 15 -1.818 2.853 3.060
101 2HB TRP 15 1HB TRP 15 -1.798 4.605 2.897
102 HD1 TRP 15 HD TRP 15 -3.301 5.608 0.772
103 HE1 TRP 15 1HE TRP 15 -5.532 4.725 -0.170
104 HE3 TRP 15 3HE TRP 15 -3.166 0.844 2.643
105 HZ2 TRP 15 2HZ TRP 15 -7.032 2.332 -0.125
106 HZ3 TRP 15 3HZ TRP 15 -5.029 -0.663 2.161
107 HH2 TRP 15 HH TRP 15 -6.927 0.056 0.802
108 H ILE 16 H ILE 16 0.267 1.298 2.089
109 HA ILE 16 HA ILE 16 -0.439 0.037 -0.462
110 HB ILE 16 HB ILE 16 0.940 -1.881 0.423
111 1HG1 ILE 16 2HG1 ILE 16 2.532 -0.305 2.227
112 1HG2 ILE 16 1HG2 ILE 16 2.926 -1.012 -0.400
113 2HG2 ILE 16 2HG2 ILE 16 1.698 0.021 -1.130
114 3HG2 ILE 16 3HG2 ILE 16 2.613 0.592 0.266
115 1HD1 ILE 16 1HD1 ILE 16 0.889 -2.723 2.893
116 2HD1 ILE 16 2HD1 ILE 16 2.438 -2.805 2.057
117 3HD1 ILE 16 3HD1 ILE 16 2.352 -2.149 3.692
118 H CYS 17 H CYS 17 -1.492 -2.054 -0.380
119 HA CYS 17 HA CYS 17 -3.828 -2.221 0.968
120 1HB CYS 17 2HB CYS 17 -2.465 -3.837 -0.775
121 2HB CYS 17 1HB CYS 17 -2.528 -4.842 0.665
122 HA PRO 18 HA PRO 18 -3.097 -2.565 5.216
123 1HB PRO 18 2HB PRO 18 -5.331 -4.519 5.326
124 2HB PRO 18 1HB PRO 18 -5.120 -2.997 6.200
125 1HG PRO 18 2HG PRO 18 -6.835 -3.134 4.184
126 2HG PRO 18 1HG PRO 18 -5.791 -1.709 4.380
127 1HD PRO 18 2HD PRO 18 -5.487 -4.022 2.492
128 2HD PRO 18 1HD PRO 18 -5.254 -2.289 2.190
129 H ASP 19 H ASP 19 -3.577 -5.609 3.500
130 HA ASP 19 HA ASP 19 -1.607 -6.865 5.296
131 1HB ASP 19 2HB ASP 19 -3.692 -8.069 5.377
132 2HB ASP 19 1HB ASP 19 -3.816 -8.079 3.623
133 H LYS 20 H LYS 20 0.335 -7.267 4.394
134 HA LYS 20 HA LYS 20 0.669 -6.301 1.698
135 1HB LYS 20 2HB LYS 20 3.155 -6.695 2.246
136 2HB LYS 20 1HB LYS 20 2.290 -5.420 3.093
137 1HG LYS 20 2HG LYS 20 2.831 -6.320 5.031
138 2HG LYS 20 1HG LYS 20 2.029 -7.827 4.578
139 1HD LYS 20 2HD LYS 20 4.040 -8.621 3.503
140 2HD LYS 20 1HD LYS 20 4.850 -7.083 3.810
141 1HE LYS 20 2HE LYS 20 5.632 -8.565 5.463
142 2HE LYS 20 1HE LYS 20 4.459 -7.523 6.267
143 1HZ LYS 20 1HZ LYS 20 4.233 -9.899 6.827
144 2HZ LYS 20 2HZ LYS 20 3.842 -10.230 5.213
145 3HZ LYS 20 3HZ LYS 20 2.824 -9.245 6.147
146 H LYS 21 H LYS 21 -0.624 -8.916 1.994
147 HA LYS 21 HA LYS 21 1.190 -10.618 0.502
148 1HB LYS 21 2HB LYS 21 -1.764 -10.797 1.129
149 2HB LYS 21 1HB LYS 21 -0.948 -11.945 0.075
150 1HG LYS 21 2HG LYS 21 0.513 -11.675 2.523
151 2HG LYS 21 1HG LYS 21 -1.180 -12.035 2.863
152 1HD LYS 21 2HD LYS 21 -1.076 -13.963 1.369
153 2HD LYS 21 1HD LYS 21 0.613 -13.597 1.005
154 1HE LYS 21 2HE LYS 21 0.450 -13.668 3.795
155 2HE LYS 21 1HE LYS 21 -0.517 -15.033 3.237
156 1HZ LYS 21 1HZ LYS 21 2.201 -14.530 2.189
157 2HZ LYS 21 2HZ LYS 21 1.302 -15.967 2.144
158 3HZ LYS 21 3HZ LYS 21 1.950 -15.419 3.615
159 H CYS 22 H CYS 22 -0.848 -8.002 0.061
160 HA CYS 22 HA CYS 22 -0.712 -8.178 -2.867
161 1HB CYS 22 2HB CYS 22 -2.941 -7.745 -2.127
162 2HB CYS 22 1HB CYS 22 -2.401 -6.592 -0.931
163 H GLY 23 H GLY 23 -0.804 -5.494 -0.583
164 1HA GLY 23 1HA GLY 23 0.755 -3.867 -0.071
165 2HA GLY 23 2HA GLY 23 1.963 -4.816 -0.928
166 H ASN 24 H ASN 24 -1.031 -3.889 -2.420
167 HA ASN 24 HA ASN 24 0.242 -2.638 -4.611
168 1HB ASN 24 2HB ASN 24 -2.015 -3.626 -4.755
169 2HB ASN 24 1HB ASN 24 -2.629 -2.371 -3.684
170 1HD2 ASN 24 1HD2 ASN 24 -3.173 -0.427 -4.516
171 2HD2 ASN 24 2HD2 ASN 24 -3.021 -0.006 -6.186
172 H VAL 25 H VAL 25 0.966 -0.644 -4.888
173 HA VAL 25 HA VAL 25 0.806 1.241 -2.723
174 HB VAL 25 HB VAL 25 1.973 2.714 -4.604
175 1HG1 VAL 25 1HG1 VAL 25 3.429 0.444 -3.266
176 2HG1 VAL 25 2HG1 VAL 25 4.089 2.010 -3.741
177 3HG1 VAL 25 3HG1 VAL 25 2.906 1.909 -2.436
178 1HG2 VAL 25 1HG2 VAL 25 2.689 -0.076 -5.481
179 2HG2 VAL 25 2HG2 VAL 25 1.547 0.959 -6.338
180 3HG2 VAL 25 3HG2 VAL 25 3.234 1.447 -6.183
181 H ASN 26 H ASN 26 -1.165 2.087 -2.473
182 HA ASN 26 HA ASN 26 -2.783 2.769 -4.775
183 1HB ASN 26 2HB ASN 26 -3.245 2.683 -1.812
184 2HB ASN 26 1HB ASN 26 -4.366 3.564 -2.850
185 1HD2 ASN 26 1HD2 ASN 26 -3.613 0.605 -1.537
186 2HD2 ASN 26 2HD2 ASN 26 -4.603 -0.400 -2.530
187 H PHE 27 H PHE 27 -3.557 4.797 -5.265
188 HA PHE 27 HA PHE 27 -1.840 6.808 -5.625
189 1HB PHE 27 2HB PHE 27 -3.925 6.924 -6.707
190 2HB PHE 27 1HB PHE 27 -4.816 6.885 -5.193
191 HD1 PHE 27 1HD PHE 27 -2.153 9.053 -6.692
192 HD2 PHE 27 2HD PHE 27 -5.918 8.809 -4.723
193 HE1 PHE 27 1HE PHE 27 -2.325 11.506 -6.722
194 HE2 PHE 27 2HE PHE 27 -6.095 11.264 -4.746
195 HZ PHE 27 HZ PHE 27 -4.296 12.613 -5.749
196 H ALA 28 H ALA 28 -4.305 7.325 -3.117
197 HA ALA 28 HA ALA 28 -2.640 7.823 -0.955
198 1HB ALA 28 1HB ALA 28 -3.533 10.489 -1.965
199 2HB ALA 28 2HB ALA 28 -2.214 10.081 -0.868
200 3HB ALA 28 3HB ALA 28 -2.042 9.789 -2.598
201 H ARG 29 H ARG 29 -5.379 9.480 -2.488
202 HA ARG 29 HA ARG 29 -6.912 9.246 -0.026
203 1HB ARG 29 2HB ARG 29 -7.075 10.883 -2.481
204 2HB ARG 29 1HB ARG 29 -8.614 10.442 -1.754
205 1HG ARG 29 2HG ARG 29 -6.378 12.038 -0.560
206 2HG ARG 29 1HG ARG 29 -8.057 12.510 -0.819
207 1HD ARG 29 2HD ARG 29 -8.578 10.543 0.801
208 2HD ARG 29 1HD ARG 29 -6.891 10.725 1.278
209 HE ARG 29 HE ARG 29 -7.473 13.099 1.789
210 1HH1 ARG 29 2HH1 ARG 29 -9.930 10.597 1.785
211 2HH1 ARG 29 1HH1 ARG 29 -10.980 11.443 2.887
212 1HH2 ARG 29 2HH2 ARG 29 -8.856 14.226 3.232
213 2HH2 ARG 29 1HH2 ARG 29 -10.368 13.517 3.711
214 H ARG 30 H ARG 30 -6.224 7.148 -2.256
215 HA ARG 30 HA ARG 30 -8.719 6.095 -3.085
216 1HB ARG 30 2HB ARG 30 -5.902 5.302 -3.155
217 2HB ARG 30 1HB ARG 30 -6.979 3.939 -2.888
218 1HG ARG 30 2HG ARG 30 -8.018 5.573 -4.988
219 2HG ARG 30 1HG ARG 30 -6.329 5.186 -5.315
220 1HD ARG 30 2HD ARG 30 -6.718 2.917 -5.386
221 2HD ARG 30 1HD ARG 30 -8.178 3.027 -4.405
222 HE ARG 30 HE ARG 30 -8.174 4.135 -7.125
223 1HH1 ARG 30 2HH1 ARG 30 -9.276 1.712 -4.850
224 2HH1 ARG 30 1HH1 ARG 30 -10.598 1.185 -5.852
225 1HH2 ARG 30 2HH2 ARG 30 -9.904 3.469 -8.443
226 2HH2 ARG 30 1HH2 ARG 30 -10.975 2.211 -7.894
227 H THR 31 H THR 31 -10.238 5.324 -1.742
228 HA THR 31 HA THR 31 -9.534 4.663 0.983
229 HB THR 31 HB THR 31 -12.194 4.017 0.704
230 HG1 THR 31 1HG THR 31 -12.930 4.981 -1.020
231 1HG2 THR 31 1HG2 THR 31 -12.614 6.071 1.862
232 2HG2 THR 31 2HG2 THR 31 -11.125 6.788 1.244
233 3HG2 THR 31 3HG2 THR 31 -11.051 5.463 2.406
234 H SER 32 H SER 32 -10.102 3.002 -1.962
235 HA SER 32 HA SER 32 -9.936 0.434 -0.538
236 1HB SER 32 2HB SER 32 -11.177 0.230 -3.151
237 2HB SER 32 1HB SER 32 -11.762 -0.346 -1.593
238 HG SER 32 HG SER 32 -12.872 1.459 -1.302
239 H CYS 33 H CYS 33 -8.654 -1.160 -1.521
240 HA CYS 33 HA CYS 33 -6.396 -0.334 -2.910
241 1HB CYS 33 2HB CYS 33 -6.502 -2.426 -1.627
242 2HB CYS 33 1HB CYS 33 -7.618 -3.100 -2.805
243 H ASP 34 H ASP 34 -5.838 -0.170 -4.986
244 HA ASP 34 HA ASP 34 -7.882 -0.139 -6.992
245 1HB ASP 34 2HB ASP 34 -5.501 1.137 -6.765
246 2HB ASP 34 1HB ASP 34 -5.047 -0.165 -7.858
247 H ARG 35 H ARG 35 -5.743 -2.487 -5.744
248 HA ARG 35 HA ARG 35 -5.920 -4.205 -8.101
249 1HB ARG 35 2HB ARG 35 -4.189 -3.992 -5.767
250 2HB ARG 35 1HB ARG 35 -4.721 -5.643 -6.043
251 1HG ARG 35 2HG ARG 35 -3.996 -4.945 -8.545
252 2HG ARG 35 1HG ARG 35 -2.878 -3.965 -7.593
253 1HD ARG 35 2HD ARG 35 -3.293 -6.910 -7.128
254 2HD ARG 35 1HD ARG 35 -2.068 -6.275 -8.225
255 HE ARG 35 HE ARG 35 -2.133 -5.818 -5.302
256 1HH1 ARG 35 2HH1 ARG 35 -0.403 -6.074 -8.340
257 2HH1 ARG 35 1HH1 ARG 35 1.165 -5.857 -7.619
258 1HH2 ARG 35 2HH2 ARG 35 -0.083 -5.537 -4.350
259 2HH2 ARG 35 1HH2 ARG 35 1.346 -5.546 -5.341
260 H CYS 36 H CYS 36 -6.646 -4.375 -4.627
261 HA CYS 36 HA CYS 36 -8.270 -6.732 -5.000
262 1HB CYS 36 2HB CYS 36 -7.823 -5.128 -2.512
263 2HB CYS 36 1HB CYS 36 -8.442 -6.769 -2.604
264 H GLY 37 H GLY 37 -8.794 -3.499 -3.636
265 1HA GLY 37 1HA GLY 37 -10.857 -2.283 -4.055
266 2HA GLY 37 2HA GLY 37 -11.677 -3.837 -4.179
267 H ARG 38 H ARG 38 -9.576 -4.328 -1.809
268 HA ARG 38 HA ARG 38 -11.434 -4.205 0.306
269 1HB ARG 38 2HB ARG 38 -8.598 -4.899 -0.021
270 2HB ARG 38 1HB ARG 38 -9.013 -4.276 1.570
271 1HG ARG 38 2HG ARG 38 -9.795 -6.264 2.138
272 2HG ARG 38 1HG ARG 38 -10.997 -6.160 0.849
273 1HD ARG 38 2HD ARG 38 -9.972 -7.882 -0.114
274 2HD ARG 38 1HD ARG 38 -8.634 -6.786 -0.455
275 HE ARG 38 HE ARG 38 -8.775 -8.381 2.034
276 1HH1 ARG 38 2HH1 ARG 38 -7.036 -7.313 -0.826
277 2HH1 ARG 38 1HH1 ARG 38 -5.532 -8.011 -0.320
278 1HH2 ARG 38 2HH2 ARG 38 -6.776 -9.287 2.709
279 2HH2 ARG 38 1HH2 ARG 38 -5.375 -9.127 1.683
280 H GLU 39 H GLU 39 -11.701 -2.736 1.964
281 HA GLU 39 HA GLU 39 -10.906 -0.037 1.309
282 1HB GLU 39 2HB GLU 39 -12.557 -1.142 3.589
283 2HB GLU 39 1HB GLU 39 -12.290 0.570 3.297
284 1HG GLU 39 2HG GLU 39 -13.427 -1.117 1.124
285 2HG GLU 39 1HG GLU 39 -14.459 -0.612 2.460
286 H LYS 40 H LYS 40 -9.664 1.341 2.582
287 HA LYS 40 HA LYS 40 -7.392 0.349 3.823
288 1HB LYS 40 2HB LYS 40 -7.841 2.712 2.963
289 2HB LYS 40 1HB LYS 40 -8.616 3.015 4.511
290 1HG LYS 40 2HG LYS 40 -6.294 2.023 5.385
291 2HG LYS 40 1HG LYS 40 -5.757 2.699 3.846
292 1HD LYS 40 2HD LYS 40 -6.861 4.850 4.514
293 2HD LYS 40 1HD LYS 40 -7.137 4.139 6.105
294 1HE LYS 40 2HE LYS 40 -4.448 3.677 5.597
295 2HE LYS 40 1HE LYS 40 -4.732 5.307 4.987
296 1HZ LYS 40 1HZ LYS 40 -5.984 4.935 7.514
297 2HZ LYS 40 2HZ LYS 40 -4.827 6.085 7.046
298 3HZ LYS 40 3HZ LYS 40 -4.331 4.562 7.608
299 H THR 41 H THR 41 -7.599 -1.097 5.414
300 HA THR 41 HA THR 41 -9.379 -0.561 7.666
301 HB THR 41 HB THR 41 -8.065 -3.011 8.063
302 HG1 THR 41 1HG THR 41 -8.906 -2.728 5.343
303 1HG2 THR 41 1HG2 THR 41 -10.624 -3.102 6.623
304 2HG2 THR 41 2HG2 THR 41 -10.617 -2.075 8.059
305 3HG2 THR 41 3HG2 THR 41 -10.183 -3.780 8.190
306 H THR 42 H THR 42 -6.377 0.276 6.841
307 HA THR 42 HA THR 42 -4.985 -0.372 9.293
308 HB THR 42 HB THR 42 -3.550 1.507 7.709
309 HG1 THR 42 1HG THR 42 -3.560 0.201 5.719
310 1HG2 THR 42 1HG2 THR 42 -1.998 0.060 8.397
311 2HG2 THR 42 2HG2 THR 42 -2.598 -1.096 7.207
312 3HG2 THR 42 3HG2 THR 42 -3.239 -1.109 8.850
313 H GLY 43 H GLY 43 -5.380 0.837 11.059
314 1HA GLY 43 1HA GLY 43 -5.007 2.849 12.261
315 2HA GLY 43 2HA GLY 43 -5.248 3.752 10.773
316 HA PRO 44 HA PRO 44 -9.474 2.885 12.870
317 1HB PRO 44 2HB PRO 44 -9.449 2.898 15.531
318 2HB PRO 44 1HB PRO 44 -8.973 1.449 14.634
319 1HG PRO 44 2HG PRO 44 -7.264 3.499 15.976
320 2HG PRO 44 1HG PRO 44 -7.074 1.738 15.924
321 1HD PRO 44 2HD PRO 44 -5.731 3.545 14.299
322 2HD PRO 44 1HD PRO 44 -5.934 1.816 13.957
323 H ILE 45 H ILE 45 -10.940 4.308 14.255
324 HA ILE 45 HA ILE 45 -9.856 7.048 14.360
325 HB ILE 45 HB ILE 45 -12.740 6.999 14.322
326 1HG1 ILE 45 2HG1 ILE 45 -11.545 5.997 11.750
327 1HG2 ILE 45 1HG2 ILE 45 -10.926 8.788 13.738
328 2HG2 ILE 45 2HG2 ILE 45 -11.042 8.082 12.125
329 3HG2 ILE 45 3HG2 ILE 45 -12.473 8.772 12.892
330 1HD1 ILE 45 1HD1 ILE 45 -13.676 6.797 11.326
331 2HD1 ILE 45 2HD1 ILE 45 -13.928 5.069 11.568
332 3HD1 ILE 45 3HD1 ILE 45 -14.314 6.206 12.862
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