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 |
|
|
17035 |
2b68   |
6849 | cing | 1-original | 7 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 1H GLY 1 H GLY 1 1.884 0.000 0.829
2 1HA GLY 1 1HA GLY 1 1.761 -0.843 -1.862
3 2HA GLY 1 2HA GLY 1 1.850 0.906 -1.808
4 H PHE 2 H PHE 2 3.891 1.717 -1.925
5 HA PHE 2 HA PHE 2 5.931 0.757 -0.215
6 1HB PHE 2 1HB PHE 2 5.607 -0.245 -3.012
7 2HB PHE 2 2HB PHE 2 7.195 0.436 -2.725
8 HD1 PHE 2 HD1 PHE 2 5.110 -2.421 -2.312
9 HD2 PHE 2 HD2 PHE 2 8.525 -0.468 -0.724
10 HE1 PHE 2 HE1 PHE 2 5.836 -4.568 -1.233
11 HE2 PHE 2 HE2 PHE 2 9.252 -2.614 0.355
12 HZ PHE 2 HZ PHE 2 7.898 -4.639 0.088
13 H GLY 3 H GLY 3 4.566 3.269 -0.840
14 1HA GLY 3 1HA GLY 3 6.567 5.088 -0.760
15 2HA GLY 3 2HA GLY 3 6.347 4.837 -2.481
16 H CYS 4 H CYS 4 3.592 4.420 -2.741
17 HA CYS 4 HA CYS 4 2.654 7.048 -2.609
18 1HB CYS 4 1HB CYS 4 1.649 4.434 -3.502
19 2HB CYS 4 2HB CYS 4 0.396 5.518 -2.930
20 HA PRO 5 HA PRO 5 0.392 7.485 -2.644
21 1HB PRO 5 1HB PRO 5 -0.886 9.653 -1.579
22 2HB PRO 5 2HB PRO 5 -1.688 8.128 -1.896
23 1HG PRO 5 1HG PRO 5 -0.824 9.264 0.693
24 2HG PRO 5 2HG PRO 5 -1.979 7.981 0.387
25 1HD PRO 5 1HD PRO 5 0.718 7.677 1.314
26 2HD PRO 5 2HD PRO 5 -0.399 6.392 0.898
27 H GLY 6 H GLY 6 0.866 9.461 -3.861
28 1HA GLY 6 1HA GLY 6 2.209 11.203 -4.363
29 2HA GLY 6 2HA GLY 6 2.597 11.378 -2.663
30 H ASN 7 H ASN 7 3.076 8.608 -4.968
31 HA ASN 7 HA ASN 7 5.797 9.049 -5.261
32 1HB ASN 7 1HB ASN 7 5.003 7.612 -2.817
33 2HB ASN 7 2HB ASN 7 5.998 6.593 -3.840
34 1HD2 ASN 7 1HD2 ASN 7 7.342 6.896 -1.834
35 2HD2 ASN 7 2HD2 ASN 7 8.496 8.187 -1.823
36 H GLN 8 H GLN 8 4.677 8.559 -7.399
37 HA GLN 8 HA GLN 8 3.856 5.816 -7.710
38 1HB GLN 8 1HB GLN 8 3.004 8.222 -8.835
39 2HB GLN 8 2HB GLN 8 3.937 7.506 -10.134
40 1HG GLN 8 1HG GLN 8 2.427 5.808 -10.465
41 2HG GLN 8 2HG GLN 8 2.162 5.570 -8.749
42 1HE2 GLN 8 1HE2 GLN 8 0.645 6.302 -11.469
43 2HE2 GLN 8 2HE2 GLN 8 -0.615 7.360 -10.927
44 H LEU 9 H LEU 9 6.632 7.885 -8.216
45 HA LEU 9 HA LEU 9 7.787 6.244 -10.267
46 1HB LEU 9 1HB LEU 9 9.477 7.798 -10.352
47 2HB LEU 9 2HB LEU 9 8.078 8.756 -9.908
48 HG LEU 9 HG LEU 9 9.538 7.792 -7.565
49 1HD1 LEU 9 1HD1 LEU 9 11.608 8.757 -7.821
50 2HD1 LEU 9 2HD1 LEU 9 11.326 8.115 -9.457
51 3HD1 LEU 9 3HD1 LEU 9 11.068 9.844 -9.123
52 1HD2 LEU 9 1HD2 LEU 9 9.347 10.683 -8.110
53 2HD2 LEU 9 2HD2 LEU 9 7.796 9.809 -8.130
54 3HD2 LEU 9 3HD2 LEU 9 8.840 9.738 -6.690
55 H LYS 10 H LYS 10 7.588 6.284 -6.769
56 HA LYS 10 HA LYS 10 9.980 4.811 -6.328
57 1HB LYS 10 1HB LYS 10 8.150 6.234 -4.772
58 2HB LYS 10 2HB LYS 10 7.937 4.572 -4.259
59 1HG LYS 10 1HG LYS 10 10.706 4.758 -4.439
60 2HG LYS 10 2HG LYS 10 10.275 6.372 -3.910
61 1HD LYS 10 1HD LYS 10 9.189 5.561 -1.929
62 2HD LYS 10 2HD LYS 10 9.104 3.922 -2.541
63 1HE LYS 10 1HE LYS 10 11.278 3.435 -1.940
64 2HE LYS 10 2HE LYS 10 11.868 5.028 -2.369
65 1HZ LYS 10 1HZ LYS 10 10.172 5.348 -0.173
66 2HZ LYS 10 2HZ LYS 10 11.147 4.094 0.189
67 H CYS 11 H CYS 11 6.699 4.066 -7.341
68 HA CYS 11 HA CYS 11 6.842 1.332 -6.540
69 1HB CYS 11 1HB CYS 11 4.932 2.745 -8.413
70 2HB CYS 11 2HB CYS 11 4.759 1.097 -7.844
71 H ASN 12 H ASN 12 7.579 3.351 -9.394
72 HA ASN 12 HA ASN 12 7.799 1.189 -11.174
73 1HB ASN 12 1HB ASN 12 7.483 3.292 -12.228
74 2HB ASN 12 2HB ASN 12 8.620 4.107 -11.173
75 1HD2 ASN 12 1HD2 ASN 12 9.202 0.999 -12.699
76 2HD2 ASN 12 2HD2 ASN 12 10.453 1.495 -13.789
77 H ASN 13 H ASN 13 10.053 3.140 -9.125
78 HA ASN 13 HA ASN 13 12.383 1.967 -10.118
79 1HB ASN 13 1HB ASN 13 11.965 3.160 -7.330
80 2HB ASN 13 2HB ASN 13 13.482 3.048 -8.201
81 1HD2 ASN 13 1HD2 ASN 13 11.935 5.335 -7.111
82 2HD2 ASN 13 2HD2 ASN 13 11.733 6.458 -8.414
83 H HIS 14 H HIS 14 10.047 1.218 -7.503
84 HA HIS 14 HA HIS 14 11.688 -0.718 -6.243
85 1HB HIS 14 1HB HIS 14 10.079 0.307 -4.881
86 2HB HIS 14 2HB HIS 14 8.795 0.089 -6.054
87 HD1 HIS 14 HD1 HIS 14 10.368 -1.491 -3.116
88 HD2 HIS 14 HD2 HIS 14 7.859 -2.684 -6.260
89 HE1 HIS 14 HE1 HIS 14 9.346 -3.720 -2.409
90 H CYS 15 H CYS 15 9.316 -0.690 -8.900
91 HA CYS 15 HA CYS 15 9.054 -3.521 -8.952
92 1HB CYS 15 1HB CYS 15 8.267 -1.336 -10.880
93 2HB CYS 15 2HB CYS 15 8.004 -3.036 -11.217
94 H LYS 16 H LYS 16 11.244 -1.054 -10.229
95 HA LYS 16 HA LYS 16 12.339 -2.799 -12.240
96 1HB LYS 16 1HB LYS 16 13.250 -0.932 -13.092
97 2HB LYS 16 2HB LYS 16 12.134 -0.099 -12.029
98 1HG LYS 16 1HG LYS 16 14.056 -0.349 -10.226
99 2HG LYS 16 2HG LYS 16 15.090 -0.636 -11.612
100 1HD LYS 16 1HD LYS 16 13.321 1.686 -12.026
101 2HD LYS 16 2HD LYS 16 14.321 1.874 -10.600
102 1HE LYS 16 1HE LYS 16 15.964 0.778 -12.718
103 2HE LYS 16 2HE LYS 16 15.094 2.158 -13.357
104 1HZ LYS 16 1HZ LYS 16 16.493 2.331 -10.756
105 2HZ LYS 16 2HZ LYS 16 17.283 2.617 -12.151
106 H SER 17 H SER 17 12.815 -2.045 -8.842
107 HA SER 17 HA SER 17 15.488 -3.055 -8.850
108 1HB SER 17 1HB SER 17 14.044 -1.352 -7.193
109 2HB SER 17 2HB SER 17 14.097 -2.824 -6.244
110 HG SER 17 HG SER 17 16.155 -1.042 -6.900
111 H ILE 18 H ILE 18 12.171 -4.182 -8.228
112 HA ILE 18 HA ILE 18 13.022 -6.587 -6.924
113 HB ILE 18 HB ILE 18 10.655 -7.169 -7.003
114 1HG1 ILE 18 1HG1 ILE 18 9.146 -5.173 -7.854
115 2HG1 ILE 18 2HG1 ILE 18 10.521 -4.839 -8.887
116 1HG2 ILE 18 1HG2 ILE 18 10.625 -6.011 -5.110
117 2HG2 ILE 18 2HG2 ILE 18 11.806 -4.839 -5.743
118 3HG2 ILE 18 3HG2 ILE 18 10.067 -4.599 -6.038
119 1HD1 ILE 18 1HD1 ILE 18 8.561 -7.034 -9.034
120 2HD1 ILE 18 2HD1 ILE 18 9.652 -6.403 -10.291
121 3HD1 ILE 18 3HD1 ILE 18 10.243 -7.609 -9.123
122 H SER 19 H SER 19 11.562 -5.748 -10.143
123 HA SER 19 HA SER 19 13.058 -6.940 -11.828
124 1HB SER 19 1HB SER 19 11.834 -9.128 -10.174
125 2HB SER 19 2HB SER 19 11.949 -9.409 -11.900
126 HG SER 19 HG SER 19 13.841 -10.070 -10.489
127 H CYS 20 H CYS 20 11.432 -5.140 -12.473
128 HA CYS 20 HA CYS 20 9.419 -6.388 -14.095
129 1HB CYS 20 1HB CYS 20 8.727 -4.866 -11.653
130 2HB CYS 20 2HB CYS 20 7.847 -4.415 -13.099
131 H ARG 21 H ARG 21 8.102 -4.094 -14.993
132 HA ARG 21 HA ARG 21 10.355 -2.623 -16.066
133 1HB ARG 21 1HB ARG 21 7.478 -3.002 -17.018
134 2HB ARG 21 2HB ARG 21 8.555 -1.837 -17.762
135 1HG ARG 21 1HG ARG 21 9.649 -4.608 -17.428
136 2HG ARG 21 2HG ARG 21 8.348 -4.432 -18.588
137 1HD ARG 21 1HD ARG 21 9.937 -2.253 -19.231
138 2HD ARG 21 2HD ARG 21 11.145 -3.414 -18.715
139 HE ARG 21 HE ARG 21 10.784 -4.536 -20.720
140 1HH1 ARG 21 2HH2 ARG 21 7.779 -2.872 -19.850
141 2HH1 ARG 21 1HH2 ARG 21 6.935 -3.391 -21.270
142 1HH2 ARG 21 HH1 ARG 21 8.066 -4.771 -22.870
143 H ALA 22 H ALA 22 6.890 -2.027 -15.085
144 HA ALA 22 HA ALA 22 7.653 0.167 -13.434
145 1HB ALA 22 1HB ALA 22 7.394 1.890 -14.852
146 2HB ALA 22 2HB ALA 22 7.287 0.717 -16.187
147 3HB ALA 22 3HB ALA 22 5.806 1.278 -15.373
148 H GLY 23 H GLY 23 6.011 0.633 -11.948
149 1HA GLY 23 1HA GLY 23 3.551 -0.977 -12.284
150 2HA GLY 23 2HA GLY 23 4.350 -0.679 -10.753
151 H TYR 24 H TYR 24 2.272 0.206 -9.983
152 HA TYR 24 HA TYR 24 2.215 3.011 -10.143
153 1HB TYR 24 1HB TYR 24 0.069 3.206 -11.397
154 2HB TYR 24 2HB TYR 24 1.219 2.345 -12.399
155 HD1 TYR 24 HD1 TYR 24 0.527 0.383 -13.436
156 HD2 TYR 24 HD2 TYR 24 -1.440 1.629 -9.846
157 HE1 TYR 24 HE1 TYR 24 -1.120 -1.540 -13.662
158 HE2 TYR 24 HE2 TYR 24 -3.081 -0.298 -10.085
159 HH TYR 24 HH TYR 24 -2.630 -2.754 -12.547
160 H CYS 25 H CYS 25 0.451 3.938 -8.794
161 HA CYS 25 HA CYS 25 -0.157 2.088 -6.672
162 1HB CYS 25 1HB CYS 25 -0.844 5.024 -6.823
163 2HB CYS 25 2HB CYS 25 -0.797 4.007 -5.396
164 H ASP 26 H ASP 26 -2.113 1.035 -6.521
165 HA ASP 26 HA ASP 26 -3.937 0.861 -8.385
166 1HB ASP 26 1HB ASP 26 -3.792 -0.170 -5.953
167 2HB ASP 26 2HB ASP 26 -4.896 1.119 -5.516
168 HD2 ASP 26 HD2 ASP 26 -5.593 -2.180 -6.307
169 H ALA 27 H ALA 27 -4.703 2.684 -9.536
170 HA ALA 27 HA ALA 27 -5.322 5.130 -8.265
171 1HB ALA 27 1HB ALA 27 -5.683 3.923 -11.007
172 2HB ALA 27 2HB ALA 27 -6.465 5.472 -10.607
173 3HB ALA 27 3HB ALA 27 -4.694 5.316 -10.508
174 H ALA 28 H ALA 28 -6.872 2.126 -8.200
175 HA ALA 28 HA ALA 28 -9.536 3.324 -8.062
176 1HB ALA 28 1HB ALA 28 -9.940 1.459 -9.280
177 2HB ALA 28 2HB ALA 28 -8.401 0.705 -8.802
178 3HB ALA 28 3HB ALA 28 -9.817 0.592 -7.730
179 H THR 29 H THR 29 -6.926 2.960 -6.084
180 HA THR 29 HA THR 29 -8.651 2.455 -3.751
181 HB THR 29 HB THR 29 -6.656 0.760 -4.652
182 HG1 THR 29 HG1 THR 29 -7.379 1.535 -1.913
183 1HG2 THR 29 1HG2 THR 29 -4.638 1.114 -3.527
184 2HG2 THR 29 2HG2 THR 29 -5.083 2.812 -3.827
185 3HG2 THR 29 3HG2 THR 29 -5.411 2.072 -2.241
186 H LEU 30 H LEU 30 -7.861 4.965 -5.258
187 HA LEU 30 HA LEU 30 -7.383 7.048 -4.699
188 1HB LEU 30 1HB LEU 30 -7.018 6.204 -1.833
189 2HB LEU 30 2HB LEU 30 -7.470 7.778 -2.455
190 HG LEU 30 HG LEU 30 -9.226 5.337 -2.778
191 1HD1 LEU 30 1HD1 LEU 30 -8.618 6.040 -0.343
192 2HD1 LEU 30 2HD1 LEU 30 -9.714 7.406 -0.658
193 3HD1 LEU 30 3HD1 LEU 30 -10.316 5.736 -0.782
194 1HD2 LEU 30 1HD2 LEU 30 -10.670 6.664 -3.834
195 2HD2 LEU 30 2HD2 LEU 30 -10.503 7.953 -2.618
196 3HD2 LEU 30 3HD2 LEU 30 -9.341 7.841 -3.962
197 H TRP 31 H TRP 31 -5.355 4.932 -5.406
198 HA TRP 31 HA TRP 31 -3.158 4.709 -5.598
199 1HB TRP 31 1HB TRP 31 -3.296 7.692 -5.156
200 2HB TRP 31 2HB TRP 31 -1.820 6.850 -5.585
201 HD1 TRP 31 HD1 TRP 31 -1.480 6.316 -8.160
202 HE1 TRP 31 HE1 TRP 31 -2.824 6.673 -10.403
203 HE3 TRP 31 HE3 TRP 31 -5.839 7.707 -5.942
204 HZ2 TRP 31 HZ2 TRP 31 -5.499 7.480 -10.985
205 HZ3 TRP 31 HZ3 TRP 31 -7.768 8.263 -7.420
206 HH2 TRP 31 HH2 TRP 31 -7.648 8.167 -9.860
207 H LEU 32 H LEU 32 -2.740 3.329 -3.827
208 HA LEU 32 HA LEU 32 -1.429 4.657 -1.600
209 1HB LEU 32 1HB LEU 32 -3.902 2.985 -1.397
210 2HB LEU 32 2HB LEU 32 -2.702 2.901 -0.123
211 HG LEU 32 HG LEU 32 -4.219 5.359 -1.033
212 1HD1 LEU 32 1HD1 LEU 32 -4.642 5.064 1.658
213 2HD1 LEU 32 2HD1 LEU 32 -5.744 4.515 0.372
214 3HD1 LEU 32 3HD1 LEU 32 -4.589 3.374 1.101
215 1HD2 LEU 32 1HD2 LEU 32 -1.897 5.085 0.875
216 2HD2 LEU 32 2HD2 LEU 32 -2.092 6.197 -0.501
217 3HD2 LEU 32 3HD2 LEU 32 -3.059 6.430 0.975
218 H ARG 33 H ARG 33 -2.426 1.540 -3.152
219 HA ARG 33 HA ARG 33 -0.260 0.162 -2.017
220 1HB ARG 33 1HB ARG 33 -2.612 -0.533 -3.352
221 2HB ARG 33 2HB ARG 33 -1.387 -0.947 -4.535
222 1HG ARG 33 1HG ARG 33 -1.013 -2.865 -3.386
223 2HG ARG 33 2HG ARG 33 -0.342 -1.900 -2.086
224 1HD ARG 33 1HD ARG 33 -2.072 -2.518 -0.754
225 2HD ARG 33 2HD ARG 33 -3.184 -1.696 -1.830
226 HE ARG 33 HE ARG 33 -3.901 -3.792 -2.536
227 1HH1 ARG 33 2HH2 ARG 33 -0.526 -4.090 -1.500
228 2HH1 ARG 33 1HH2 ARG 33 -0.451 -5.793 -1.809
229 1HH2 ARG 33 HH1 ARG 33 -2.390 -6.917 -2.657
230 H CYS 34 H CYS 34 1.196 -1.200 -3.768
231 HA CYS 34 HA CYS 34 2.098 0.690 -5.805
232 1HB CYS 34 1HB CYS 34 3.577 -0.219 -3.458
233 2HB CYS 34 2HB CYS 34 4.418 -0.574 -4.954
234 H THR 35 H THR 35 0.894 -0.703 -7.297
235 HA THR 35 HA THR 35 1.578 -3.503 -7.401
236 HB THR 35 HB THR 35 -0.597 -1.862 -8.150
237 HG1 THR 35 HG1 THR 35 0.301 -4.572 -8.835
238 1HG2 THR 35 1HG2 THR 35 -0.883 -2.551 -10.564
239 2HG2 THR 35 2HG2 THR 35 0.424 -1.361 -10.350
240 3HG2 THR 35 3HG2 THR 35 0.816 -3.082 -10.580
241 H CYS 36 H CYS 36 2.334 -4.531 -9.454
242 HA CYS 36 HA CYS 36 4.305 -2.778 -10.730
243 1HB CYS 36 1HB CYS 36 4.598 -5.636 -9.811
244 2HB CYS 36 2HB CYS 36 5.665 -4.919 -11.002
245 H THR 37 H THR 37 4.194 -2.750 -12.975
246 HA THR 37 HA THR 37 2.594 -4.869 -14.245
247 HB THR 37 HB THR 37 1.932 -2.790 -15.789
248 HG1 THR 37 HG1 THR 37 2.300 -0.853 -14.698
249 1HG2 THR 37 1HG2 THR 37 0.621 -4.088 -13.682
250 2HG2 THR 37 2HG2 THR 37 0.603 -2.383 -13.171
251 3HG2 THR 37 3HG2 THR 37 -0.109 -2.852 -14.734
252 H ASP 38 H ASP 38 3.216 -5.506 -16.336
253 HA ASP 38 HA ASP 38 4.625 -5.952 -17.921
254 1HB ASP 38 1HB ASP 38 5.316 -3.052 -17.407
255 2HB ASP 38 2HB ASP 38 6.320 -3.969 -18.512
256 HD2 ASP 38 HD2 ASP 38 4.423 -1.781 -18.856
257 H CYS 39 H CYS 39 6.215 -7.478 -17.454
258 HA CYS 39 HA CYS 39 8.552 -6.539 -15.985
259 1HB CYS 39 1HB CYS 39 7.207 -9.176 -15.378
260 2HB CYS 39 2HB CYS 39 8.618 -8.496 -14.593
261 H ASN 40 H ASN 40 10.506 -7.711 -16.589
262 HA ASN 40 HA ASN 40 10.120 -9.200 -19.061
263 1HB ASN 40 1HB ASN 40 11.515 -7.032 -19.069
264 2HB ASN 40 2HB ASN 40 12.683 -7.859 -18.057
265 1HD2 ASN 40 1HD2 ASN 40 10.861 -8.214 -21.087
266 2HD2 ASN 40 2HD2 ASN 40 12.102 -8.999 -22.005
267 H GLY 41 H GLY 41 9.707 -11.178 -17.685
268 1HA GLY 41 1HA GLY 41 12.139 -12.614 -17.161
269 2HA GLY 41 2HA GLY 41 11.273 -12.193 -15.697
270 H LYS 42 H LYS 42 10.415 -13.365 -19.040
271 HA LYS 42 HA LYS 42 8.999 -15.580 -17.774
272 1HB LYS 42 1HB LYS 42 7.527 -13.465 -18.417
273 2HB LYS 42 2HB LYS 42 7.635 -14.152 -20.025
274 1HG LYS 42 1HG LYS 42 5.771 -15.305 -19.271
275 2HG LYS 42 2HG LYS 42 7.011 -16.423 -18.740
276 1HD LYS 42 1HD LYS 42 6.343 -14.208 -16.834
277 2HD LYS 42 2HD LYS 42 5.091 -15.409 -17.081
278 1HE LYS 42 1HE LYS 42 7.379 -16.986 -16.804
279 2HE LYS 42 2HE LYS 42 7.697 -15.668 -15.693
280 1HZ LYS 42 1HZ LYS 42 6.194 -16.535 -14.289
281 2HZ LYS 42 2HZ LYS 42 5.009 -16.502 -15.405
282 H LYS 43 H LYS 43 9.585 -17.473 -18.696
283 HA LYS 43 HA LYS 43 10.785 -18.808 -20.022
284 1HB LYS 43 1HB LYS 43 8.444 -17.842 -21.344
285 2HB LYS 43 2HB LYS 43 9.691 -18.050 -22.557
286 1HG LYS 43 1HG LYS 43 9.501 -20.251 -20.544
287 2HG LYS 43 2HG LYS 43 8.116 -20.092 -21.605
288 1HD LYS 43 1HD LYS 43 10.250 -19.825 -23.381
289 2HD LYS 43 2HD LYS 43 10.874 -20.987 -22.228
290 1HE LYS 43 1HE LYS 43 9.544 -22.633 -23.057
291 2HE LYS 43 2HE LYS 43 8.108 -21.648 -22.867
292 1HZ LYS 43 1HZ LYS 43 9.473 -20.583 -25.032
293 2HZ LYS 43 2HZ LYS 43 9.545 -22.195 -25.250
Start of MODEL 2
1 1H GLY 1 H GLY 1 0.801 1.825 1.402
2 1HA GLY 1 1HA GLY 1 1.711 0.515 -0.784
3 2HA GLY 1 2HA GLY 1 1.729 2.259 -0.611
4 H PHE 2 H PHE 2 3.667 0.942 -2.177
5 HA PHE 2 HA PHE 2 6.029 0.680 -0.526
6 1HB PHE 2 1HB PHE 2 5.176 0.278 -3.425
7 2HB PHE 2 2HB PHE 2 6.890 0.413 -3.086
8 HD1 PHE 2 HD1 PHE 2 7.182 -1.043 -0.569
9 HD2 PHE 2 HD2 PHE 2 4.780 -1.940 -3.951
10 HE1 PHE 2 HE1 PHE 2 7.256 -3.480 0.024
11 HE2 PHE 2 HE2 PHE 2 4.854 -4.377 -3.358
12 HZ PHE 2 HZ PHE 2 6.091 -5.119 -1.377
13 H GLY 3 H GLY 3 4.529 3.333 -0.939
14 1HA GLY 3 1HA GLY 3 6.501 5.133 -0.797
15 2HA GLY 3 2HA GLY 3 6.385 4.900 -2.530
16 H CYS 4 H CYS 4 3.590 4.439 -2.844
17 HA CYS 4 HA CYS 4 2.680 7.102 -2.768
18 1HB CYS 4 1HB CYS 4 1.794 4.546 -3.853
19 2HB CYS 4 2HB CYS 4 0.456 5.495 -3.232
20 HA PRO 5 HA PRO 5 0.446 7.578 -2.924
21 1HB PRO 5 1HB PRO 5 -0.862 9.736 -1.874
22 2HB PRO 5 2HB PRO 5 -1.667 8.235 -2.287
23 1HG PRO 5 1HG PRO 5 -0.950 9.277 0.384
24 2HG PRO 5 2HG PRO 5 -2.103 8.025 -0.032
25 1HD PRO 5 1HD PRO 5 0.525 7.646 1.051
26 2HD PRO 5 2HD PRO 5 -0.582 6.393 0.527
27 H GLY 6 H GLY 6 1.085 9.513 -4.080
28 1HA GLY 6 1HA GLY 6 2.464 11.271 -4.430
29 2HA GLY 6 2HA GLY 6 2.755 11.385 -2.706
30 H ASN 7 H ASN 7 3.360 8.833 -5.236
31 HA ASN 7 HA ASN 7 6.052 9.162 -5.370
32 1HB ASN 7 1HB ASN 7 5.215 7.769 -2.911
33 2HB ASN 7 2HB ASN 7 6.241 6.743 -3.892
34 1HD2 ASN 7 1HD2 ASN 7 7.602 7.044 -1.942
35 2HD2 ASN 7 2HD2 ASN 7 8.720 8.365 -1.903
36 H GLN 8 H GLN 8 4.965 8.623 -7.514
37 HA GLN 8 HA GLN 8 4.158 5.869 -7.774
38 1HB GLN 8 1HB GLN 8 2.929 7.879 -8.827
39 2HB GLN 8 2HB GLN 8 4.258 7.980 -9.964
40 1HG GLN 8 1HG GLN 8 3.824 5.455 -10.438
41 2HG GLN 8 2HG GLN 8 2.314 5.669 -9.576
42 1HE2 GLN 8 1HE2 GLN 8 0.682 5.904 -10.882
43 2HE2 GLN 8 2HE2 GLN 8 0.635 6.795 -12.366
44 H LEU 9 H LEU 9 6.976 7.842 -8.123
45 HA LEU 9 HA LEU 9 8.158 6.238 -10.201
46 1HB LEU 9 1HB LEU 9 9.910 7.746 -10.168
47 2HB LEU 9 2HB LEU 9 8.492 8.722 -9.841
48 HG LEU 9 HG LEU 9 9.878 7.730 -7.428
49 1HD1 LEU 9 1HD1 LEU 9 11.647 8.364 -9.305
50 2HD1 LEU 9 2HD1 LEU 9 11.259 10.013 -8.757
51 3HD1 LEU 9 3HD1 LEU 9 11.875 8.813 -7.596
52 1HD2 LEU 9 1HD2 LEU 9 8.406 9.270 -6.733
53 2HD2 LEU 9 2HD2 LEU 9 9.656 10.442 -7.214
54 3HD2 LEU 9 3HD2 LEU 9 8.319 10.060 -8.326
55 H LYS 10 H LYS 10 7.833 6.208 -6.717
56 HA LYS 10 HA LYS 10 10.189 4.677 -6.237
57 1HB LYS 10 1HB LYS 10 8.396 6.151 -4.701
58 2HB LYS 10 2HB LYS 10 8.076 4.497 -4.221
59 1HG LYS 10 1HG LYS 10 10.844 4.503 -4.302
60 2HG LYS 10 2HG LYS 10 10.517 6.151 -3.804
61 1HD LYS 10 1HD LYS 10 9.214 5.401 -1.884
62 2HD LYS 10 2HD LYS 10 9.227 3.742 -2.449
63 1HE LYS 10 1HE LYS 10 10.924 3.763 -0.793
64 2HE LYS 10 2HE LYS 10 11.826 3.886 -2.290
65 1HZ LYS 10 1HZ LYS 10 11.658 6.405 -1.908
66 2HZ LYS 10 2HZ LYS 10 11.220 6.058 -0.379
67 H CYS 11 H CYS 11 6.890 4.042 -7.291
68 HA CYS 11 HA CYS 11 6.944 1.297 -6.528
69 1HB CYS 11 1HB CYS 11 5.108 2.689 -8.486
70 2HB CYS 11 2HB CYS 11 4.857 1.119 -7.750
71 H ASN 12 H ASN 12 7.812 3.322 -9.335
72 HA ASN 12 HA ASN 12 8.034 1.119 -11.098
73 1HB ASN 12 1HB ASN 12 7.643 3.177 -12.210
74 2HB ASN 12 2HB ASN 12 8.742 4.065 -11.172
75 1HD2 ASN 12 1HD2 ASN 12 9.219 0.992 -12.880
76 2HD2 ASN 12 2HD2 ASN 12 10.537 1.495 -13.887
77 H ASN 13 H ASN 13 10.100 2.953 -8.839
78 HA ASN 13 HA ASN 13 12.530 1.967 -9.890
79 1HB ASN 13 1HB ASN 13 11.852 3.237 -7.185
80 2HB ASN 13 2HB ASN 13 13.486 2.924 -7.735
81 1HD2 ASN 13 1HD2 ASN 13 12.140 5.428 -7.069
82 2HD2 ASN 13 2HD2 ASN 13 12.258 6.463 -8.453
83 H HIS 14 H HIS 14 10.104 1.000 -7.470
84 HA HIS 14 HA HIS 14 11.832 -0.921 -6.227
85 1HB HIS 14 1HB HIS 14 10.355 -0.116 -4.682
86 2HB HIS 14 2HB HIS 14 9.060 0.089 -5.843
87 HD1 HIS 14 HD1 HIS 14 10.671 -2.516 -3.625
88 HD2 HIS 14 HD2 HIS 14 7.338 -2.113 -6.140
89 HE1 HIS 14 HE1 HIS 14 9.197 -4.554 -3.192
90 H CYS 15 H CYS 15 9.388 -0.783 -8.809
91 HA CYS 15 HA CYS 15 9.075 -3.607 -8.934
92 1HB CYS 15 1HB CYS 15 8.279 -1.353 -10.778
93 2HB CYS 15 2HB CYS 15 7.978 -3.037 -11.158
94 H LYS 16 H LYS 16 11.155 -1.085 -10.375
95 HA LYS 16 HA LYS 16 12.229 -2.877 -12.350
96 1HB LYS 16 1HB LYS 16 13.451 -1.021 -13.124
97 2HB LYS 16 2HB LYS 16 11.895 -0.380 -12.639
98 1HG LYS 16 1HG LYS 16 13.445 1.145 -11.688
99 2HG LYS 16 2HG LYS 16 12.997 0.122 -10.338
100 1HD LYS 16 1HD LYS 16 15.159 -0.490 -10.056
101 2HD LYS 16 2HD LYS 16 15.197 -1.160 -11.674
102 1HE LYS 16 1HE LYS 16 16.396 0.601 -12.486
103 2HE LYS 16 2HE LYS 16 15.322 1.774 -11.749
104 1HZ LYS 16 1HZ LYS 16 17.603 1.835 -10.821
105 2HZ LYS 16 2HZ LYS 16 16.505 1.514 -9.662
106 H SER 17 H SER 17 12.882 -1.887 -9.024
107 HA SER 17 HA SER 17 15.573 -2.772 -9.086
108 1HB SER 17 1HB SER 17 14.909 -1.045 -7.500
109 2HB SER 17 2HB SER 17 13.669 -2.075 -6.812
110 HG SER 17 HG SER 17 15.493 -3.575 -6.223
111 H ILE 18 H ILE 18 12.368 -4.135 -8.281
112 HA ILE 18 HA ILE 18 13.454 -6.481 -7.061
113 HB ILE 18 HB ILE 18 11.159 -7.227 -6.977
114 1HG1 ILE 18 1HG1 ILE 18 10.601 -4.884 -8.811
115 2HG1 ILE 18 2HG1 ILE 18 10.327 -6.585 -9.131
116 1HG2 ILE 18 1HG2 ILE 18 11.227 -5.964 -5.140
117 2HG2 ILE 18 2HG2 ILE 18 12.060 -4.631 -5.976
118 3HG2 ILE 18 3HG2 ILE 18 10.288 -4.772 -6.070
119 1HD1 ILE 18 1HD1 ILE 18 8.179 -5.910 -8.509
120 2HD1 ILE 18 2HD1 ILE 18 8.818 -6.450 -6.937
121 3HD1 ILE 18 3HD1 ILE 18 8.783 -4.715 -7.335
122 H SER 19 H SER 19 11.753 -5.773 -10.195
123 HA SER 19 HA SER 19 13.276 -6.840 -11.956
124 1HB SER 19 1HB SER 19 13.833 -8.908 -11.042
125 2HB SER 19 2HB SER 19 12.275 -9.111 -10.264
126 HG SER 19 HG SER 19 11.891 -10.432 -11.914
127 H CYS 20 H CYS 20 11.469 -5.140 -12.462
128 HA CYS 20 HA CYS 20 9.502 -6.516 -14.041
129 1HB CYS 20 1HB CYS 20 8.800 -5.216 -11.504
130 2HB CYS 20 2HB CYS 20 7.875 -4.627 -12.872
131 H ARG 21 H ARG 21 8.002 -4.405 -14.942
132 HA ARG 21 HA ARG 21 10.039 -2.796 -16.157
133 1HB ARG 21 1HB ARG 21 7.208 -3.545 -16.742
134 2HB ARG 21 2HB ARG 21 7.636 -1.914 -17.223
135 1HG ARG 21 1HG ARG 21 9.476 -4.216 -17.934
136 2HG ARG 21 2HG ARG 21 8.039 -3.927 -18.895
137 1HD ARG 21 1HD ARG 21 8.863 -1.445 -19.035
138 2HD ARG 21 2HD ARG 21 10.399 -2.057 -18.456
139 HE ARG 21 HE ARG 21 9.264 -3.506 -20.765
140 1HH1 ARG 21 2HH2 ARG 21 11.469 -0.956 -19.674
141 2HH1 ARG 21 1HH2 ARG 21 12.385 -0.948 -21.143
142 1HH2 ARG 21 HH1 ARG 21 11.783 -2.449 -22.911
143 H ALA 22 H ALA 22 6.767 -2.181 -14.659
144 HA ALA 22 HA ALA 22 7.708 -0.202 -12.917
145 1HB ALA 22 1HB ALA 22 6.400 0.816 -15.473
146 2HB ALA 22 2HB ALA 22 6.758 1.798 -14.032
147 3HB ALA 22 3HB ALA 22 8.088 1.087 -14.978
148 H GLY 23 H GLY 23 6.022 0.496 -11.502
149 1HA GLY 23 1HA GLY 23 3.453 -0.899 -11.970
150 2HA GLY 23 2HA GLY 23 4.208 -0.696 -10.401
151 H TYR 24 H TYR 24 1.736 0.194 -10.335
152 HA TYR 24 HA TYR 24 2.053 3.090 -10.343
153 1HB TYR 24 1HB TYR 24 -0.151 3.272 -11.524
154 2HB TYR 24 2HB TYR 24 0.965 2.359 -12.518
155 HD1 TYR 24 HD1 TYR 24 0.253 0.341 -13.433
156 HD2 TYR 24 HD2 TYR 24 -1.654 1.795 -9.890
157 HE1 TYR 24 HE1 TYR 24 -1.415 -1.575 -13.535
158 HE2 TYR 24 HE2 TYR 24 -3.316 -0.125 -10.004
159 HH TYR 24 HH TYR 24 -2.947 -2.687 -12.392
160 H CYS 25 H CYS 25 0.290 4.175 -9.065
161 HA CYS 25 HA CYS 25 -0.249 2.558 -6.752
162 1HB CYS 25 1HB CYS 25 -1.007 5.444 -7.217
163 2HB CYS 25 2HB CYS 25 -0.919 4.595 -5.685
164 H ASP 26 H ASP 26 -2.096 1.329 -6.648
165 HA ASP 26 HA ASP 26 -3.987 1.075 -8.433
166 1HB ASP 26 1HB ASP 26 -3.688 0.426 -5.686
167 2HB ASP 26 2HB ASP 26 -5.273 1.168 -5.796
168 HD2 ASP 26 HD2 ASP 26 -5.584 -1.215 -5.134
169 H ALA 27 H ALA 27 -4.900 2.865 -9.526
170 HA ALA 27 HA ALA 27 -5.617 5.249 -8.177
171 1HB ALA 27 1HB ALA 27 -5.887 4.095 -10.941
172 2HB ALA 27 2HB ALA 27 -6.864 5.518 -10.509
173 3HB ALA 27 3HB ALA 27 -5.089 5.595 -10.407
174 H ALA 28 H ALA 28 -6.972 2.165 -8.119
175 HA ALA 28 HA ALA 28 -9.702 3.203 -7.897
176 1HB ALA 28 1HB ALA 28 -10.426 1.105 -8.520
177 2HB ALA 28 2HB ALA 28 -8.841 1.109 -9.327
178 3HB ALA 28 3HB ALA 28 -9.042 0.281 -7.764
179 H THR 29 H THR 29 -7.011 2.878 -6.006
180 HA THR 29 HA THR 29 -8.651 2.244 -3.645
181 HB THR 29 HB THR 29 -6.746 0.554 -4.627
182 HG1 THR 29 HG1 THR 29 -7.397 -0.259 -2.676
183 1HG2 THR 29 1HG2 THR 29 -5.198 1.784 -2.386
184 2HG2 THR 29 2HG2 THR 29 -4.605 0.976 -3.858
185 3HG2 THR 29 3HG2 THR 29 -5.122 2.678 -3.924
186 H LEU 30 H LEU 30 -8.089 4.832 -4.989
187 HA LEU 30 HA LEU 30 -7.574 6.894 -4.397
188 1HB LEU 30 1HB LEU 30 -7.165 5.862 -1.591
189 2HB LEU 30 2HB LEU 30 -7.514 7.508 -2.081
190 HG LEU 30 HG LEU 30 -9.414 5.179 -2.472
191 1HD1 LEU 30 1HD1 LEU 30 -9.926 7.303 -0.441
192 2HD1 LEU 30 2HD1 LEU 30 -10.427 5.595 -0.473
193 3HD1 LEU 30 3HD1 LEU 30 -8.754 6.023 -0.044
194 1HD2 LEU 30 1HD2 LEU 30 -10.667 6.545 -3.687
195 2HD2 LEU 30 2HD2 LEU 30 -10.663 7.763 -2.389
196 3HD2 LEU 30 3HD2 LEU 30 -9.371 7.763 -3.613
197 H TRP 31 H TRP 31 -5.555 5.092 -5.456
198 HA TRP 31 HA TRP 31 -3.348 4.846 -5.658
199 1HB TRP 31 1HB TRP 31 -3.526 7.803 -5.063
200 2HB TRP 31 2HB TRP 31 -2.079 7.008 -5.652
201 HD1 TRP 31 HD1 TRP 31 -1.895 6.789 -8.267
202 HE1 TRP 31 HE1 TRP 31 -3.430 7.182 -10.376
203 HE3 TRP 31 HE3 TRP 31 -6.182 7.584 -5.652
204 HZ2 TRP 31 HZ2 TRP 31 -6.203 7.769 -10.708
205 HZ3 TRP 31 HZ3 TRP 31 -8.259 8.061 -6.945
206 HH2 TRP 31 HH2 TRP 31 -8.315 8.160 -9.386
207 H LEU 32 H LEU 32 -3.011 3.395 -3.869
208 HA LEU 32 HA LEU 32 -1.559 4.671 -1.686
209 1HB LEU 32 1HB LEU 32 -3.946 2.862 -1.403
210 2HB LEU 32 2HB LEU 32 -2.731 2.979 -0.147
211 HG LEU 32 HG LEU 32 -4.487 5.215 -1.190
212 1HD1 LEU 32 1HD1 LEU 32 -4.546 3.438 1.198
213 2HD1 LEU 32 2HD1 LEU 32 -4.995 5.144 1.429
214 3HD1 LEU 32 3HD1 LEU 32 -5.878 4.143 0.252
215 1HD2 LEU 32 1HD2 LEU 32 -2.355 6.195 -0.737
216 2HD2 LEU 32 2HD2 LEU 32 -3.436 6.588 0.621
217 3HD2 LEU 32 3HD2 LEU 32 -2.209 5.311 0.802
218 H ARG 33 H ARG 33 -2.639 1.532 -3.158
219 HA ARG 33 HA ARG 33 -0.372 0.194 -2.201
220 1HB ARG 33 1HB ARG 33 -2.795 -0.581 -3.253
221 2HB ARG 33 2HB ARG 33 -1.757 -0.872 -4.635
222 1HG ARG 33 1HG ARG 33 -1.324 -2.881 -3.633
223 2HG ARG 33 2HG ARG 33 -0.227 -1.965 -2.619
224 1HD ARG 33 1HD ARG 33 -1.582 -2.135 -0.770
225 2HD ARG 33 2HD ARG 33 -3.047 -1.864 -1.692
226 HE ARG 33 HE ARG 33 -1.764 -4.469 -1.157
227 1HH1 ARG 33 2HH2 ARG 33 -4.208 -2.709 -3.022
228 2HH1 ARG 33 1HH2 ARG 33 -5.111 -4.132 -3.417
229 1HH2 ARG 33 HH1 ARG 33 -4.356 -6.262 -2.617
230 H CYS 34 H CYS 34 0.843 -1.220 -4.174
231 HA CYS 34 HA CYS 34 1.560 0.635 -6.289
232 1HB CYS 34 1HB CYS 34 3.358 -0.226 -4.084
233 2HB CYS 34 2HB CYS 34 4.032 -0.233 -5.702
234 H THR 35 H THR 35 0.486 -0.850 -7.719
235 HA THR 35 HA THR 35 1.280 -3.635 -7.652
236 HB THR 35 HB THR 35 -1.030 -2.200 -8.349
237 HG1 THR 35 HG1 THR 35 -1.670 -4.393 -8.760
238 1HG2 THR 35 1HG2 THR 35 0.314 -3.379 -10.839
239 2HG2 THR 35 2HG2 THR 35 -1.398 -2.903 -10.730
240 3HG2 THR 35 3HG2 THR 35 -0.121 -1.669 -10.607
241 H CYS 36 H CYS 36 2.763 -4.627 -8.899
242 HA CYS 36 HA CYS 36 4.360 -2.900 -10.562
243 1HB CYS 36 1HB CYS 36 4.661 -5.716 -9.546
244 2HB CYS 36 2HB CYS 36 5.690 -5.104 -10.826
245 H THR 37 H THR 37 3.872 -2.646 -12.713
246 HA THR 37 HA THR 37 2.417 -4.851 -14.021
247 HB THR 37 HB THR 37 1.714 -2.825 -15.554
248 HG1 THR 37 HG1 THR 37 3.022 -1.171 -14.742
249 1HG2 THR 37 1HG2 THR 37 -0.245 -2.945 -14.387
250 2HG2 THR 37 2HG2 THR 37 0.606 -3.840 -13.105
251 3HG2 THR 37 3HG2 THR 37 0.496 -2.065 -13.029
252 H ASP 38 H ASP 38 3.065 -5.575 -16.048
253 HA ASP 38 HA ASP 38 4.454 -6.043 -17.646
254 1HB ASP 38 1HB ASP 38 5.215 -3.142 -17.191
255 2HB ASP 38 2HB ASP 38 6.126 -4.105 -18.336
256 HD2 ASP 38 HD2 ASP 38 3.041 -2.632 -17.816
257 H CYS 39 H CYS 39 6.506 -7.120 -17.782
258 HA CYS 39 HA CYS 39 8.627 -6.302 -16.031
259 1HB CYS 39 1HB CYS 39 7.473 -9.070 -15.664
260 2HB CYS 39 2HB CYS 39 8.833 -8.364 -14.814
261 H ASN 40 H ASN 40 10.630 -7.656 -16.525
262 HA ASN 40 HA ASN 40 10.408 -8.641 -19.257
263 1HB ASN 40 1HB ASN 40 11.930 -6.762 -19.181
264 2HB ASN 40 2HB ASN 40 12.685 -7.331 -17.706
265 1HD2 ASN 40 1HD2 ASN 40 14.716 -7.705 -18.219
266 2HD2 ASN 40 2HD2 ASN 40 15.293 -8.719 -19.499
267 H GLY 41 H GLY 41 9.700 -10.762 -18.190
268 1HA GLY 41 1HA GLY 41 11.543 -12.730 -18.195
269 2HA GLY 41 2HA GLY 41 11.636 -12.145 -16.546
270 H LYS 42 H LYS 42 10.809 -14.249 -15.830
271 HA LYS 42 HA LYS 42 9.221 -15.609 -15.123
272 1HB LYS 42 1HB LYS 42 7.732 -13.029 -15.404
273 2HB LYS 42 2HB LYS 42 6.807 -14.486 -15.100
274 1HG LYS 42 1HG LYS 42 9.153 -14.447 -13.372
275 2HG LYS 42 2HG LYS 42 8.282 -12.935 -13.208
276 1HD LYS 42 1HD LYS 42 7.005 -14.123 -11.715
277 2HD LYS 42 2HD LYS 42 6.170 -14.666 -13.157
278 1HE LYS 42 1HE LYS 42 8.241 -16.469 -13.105
279 2HE LYS 42 2HE LYS 42 8.071 -16.155 -11.389
280 1HZ LYS 42 1HZ LYS 42 6.211 -17.390 -11.376
281 2HZ LYS 42 2HZ LYS 42 5.507 -16.498 -12.543
282 H LYS 43 H LYS 43 8.801 -17.396 -16.293
283 HA LYS 43 HA LYS 43 7.284 -17.007 -18.779
284 1HB LYS 43 1HB LYS 43 9.729 -18.694 -18.255
285 2HB LYS 43 2HB LYS 43 8.606 -19.105 -19.535
286 1HG LYS 43 1HG LYS 43 9.713 -17.618 -20.846
287 2HG LYS 43 2HG LYS 43 8.981 -16.347 -19.888
288 1HD LYS 43 1HD LYS 43 11.349 -15.933 -19.832
289 2HD LYS 43 2HD LYS 43 10.936 -16.569 -18.253
290 1HE LYS 43 1HE LYS 43 12.019 -18.601 -18.622
291 2HE LYS 43 2HE LYS 43 11.716 -18.579 -20.348
292 1HZ LYS 43 1HZ LYS 43 14.094 -18.041 -19.407
293 2HZ LYS 43 2HZ LYS 43 13.548 -17.243 -20.717
Start of MODEL 3
1 1H GLY 1 H GLY 1 2.362 2.021 -1.566
2 1HA GLY 1 1HA GLY 1 2.336 -0.248 0.333
3 2HA GLY 1 2HA GLY 1 2.673 -0.379 -1.382
4 H PHE 2 H PHE 2 4.571 1.112 -2.191
5 HA PHE 2 HA PHE 2 6.660 1.086 -0.128
6 1HB PHE 2 1HB PHE 2 6.364 -0.219 -2.750
7 2HB PHE 2 2HB PHE 2 7.736 0.870 -2.798
8 HD1 PHE 2 HD1 PHE 2 6.291 -1.779 -0.596
9 HD2 PHE 2 HD2 PHE 2 9.792 0.057 -2.140
10 HE1 PHE 2 HE1 PHE 2 7.702 -3.508 0.551
11 HE2 PHE 2 HE2 PHE 2 11.204 -1.672 -0.992
12 HZ PHE 2 HZ PHE 2 10.143 -3.434 0.340
13 H GLY 3 H GLY 3 4.905 3.329 -0.782
14 1HA GLY 3 1HA GLY 3 6.588 5.438 -0.857
15 2HA GLY 3 2HA GLY 3 6.376 5.072 -2.557
16 H CYS 4 H CYS 4 3.722 4.230 -2.744
17 HA CYS 4 HA CYS 4 2.390 6.705 -2.608
18 1HB CYS 4 1HB CYS 4 1.194 3.969 -3.087
19 2HB CYS 4 2HB CYS 4 0.476 5.517 -3.490
20 HA PRO 5 HA PRO 5 0.327 7.178 -2.533
21 1HB PRO 5 1HB PRO 5 -0.918 9.238 -1.239
22 2HB PRO 5 2HB PRO 5 -1.750 7.779 -1.742
23 1HG PRO 5 1HG PRO 5 -0.899 8.585 0.973
24 2HG PRO 5 2HG PRO 5 -2.077 7.375 0.506
25 1HD PRO 5 1HD PRO 5 0.598 6.901 1.423
26 2HD PRO 5 2HD PRO 5 -0.540 5.700 0.848
27 H GLY 6 H GLY 6 0.940 9.182 -3.563
28 1HA GLY 6 1HA GLY 6 2.292 10.984 -3.807
29 2HA GLY 6 2HA GLY 6 2.692 10.922 -2.102
30 H ASN 7 H ASN 7 3.136 8.727 -4.977
31 HA ASN 7 HA ASN 7 5.792 9.023 -5.251
32 1HB ASN 7 1HB ASN 7 5.241 7.618 -2.789
33 2HB ASN 7 2HB ASN 7 5.915 6.449 -3.907
34 1HD2 ASN 7 1HD2 ASN 7 6.958 7.799 -1.462
35 2HD2 ASN 7 2HD2 ASN 7 8.487 8.484 -1.900
36 H GLN 8 H GLN 8 4.656 8.633 -7.367
37 HA GLN 8 HA GLN 8 3.746 5.928 -7.774
38 1HB GLN 8 1HB GLN 8 2.764 8.283 -8.687
39 2HB GLN 8 2HB GLN 8 3.835 7.910 -10.024
40 1HG GLN 8 1HG GLN 8 2.712 5.493 -9.855
41 2HG GLN 8 2HG GLN 8 1.433 6.362 -9.030
42 1HE2 GLN 8 1HE2 GLN 8 0.259 7.961 -10.095
43 2HE2 GLN 8 2HE2 GLN 8 0.194 8.083 -11.822
44 H LEU 9 H LEU 9 6.593 7.876 -8.159
45 HA LEU 9 HA LEU 9 7.637 6.277 -10.332
46 1HB LEU 9 1HB LEU 9 9.323 7.824 -10.491
47 2HB LEU 9 2HB LEU 9 7.952 8.791 -9.986
48 HG LEU 9 HG LEU 9 9.542 7.801 -7.727
49 1HD1 LEU 9 1HD1 LEU 9 10.948 9.958 -9.228
50 2HD1 LEU 9 2HD1 LEU 9 11.584 8.725 -8.111
51 3HD1 LEU 9 3HD1 LEU 9 11.168 8.280 -9.784
52 1HD2 LEU 9 1HD2 LEU 9 8.660 10.569 -8.595
53 2HD2 LEU 9 2HD2 LEU 9 7.788 9.476 -7.492
54 3HD2 LEU 9 3HD2 LEU 9 9.369 10.143 -7.019
55 H LYS 10 H LYS 10 7.595 6.363 -6.821
56 HA LYS 10 HA LYS 10 9.983 4.869 -6.465
57 1HB LYS 10 1HB LYS 10 8.333 6.359 -4.849
58 2HB LYS 10 2HB LYS 10 7.929 4.728 -4.355
59 1HG LYS 10 1HG LYS 10 10.439 4.263 -4.145
60 2HG LYS 10 2HG LYS 10 10.716 5.970 -4.427
61 1HD LYS 10 1HD LYS 10 9.024 6.354 -2.454
62 2HD LYS 10 2HD LYS 10 9.297 4.664 -2.080
63 1HE LYS 10 1HE LYS 10 11.525 5.005 -1.461
64 2HE LYS 10 2HE LYS 10 11.733 6.373 -2.535
65 1HZ LYS 10 1HZ LYS 10 11.272 6.566 0.130
66 2HZ LYS 10 2HZ LYS 10 11.041 7.783 -0.926
67 H CYS 11 H CYS 11 6.716 4.134 -7.454
68 HA CYS 11 HA CYS 11 6.808 1.419 -6.581
69 1HB CYS 11 1HB CYS 11 4.943 2.868 -8.470
70 2HB CYS 11 2HB CYS 11 4.750 1.197 -7.980
71 H ASN 12 H ASN 12 7.500 3.342 -9.532
72 HA ASN 12 HA ASN 12 7.795 1.087 -11.188
73 1HB ASN 12 1HB ASN 12 7.304 3.305 -12.144
74 2HB ASN 12 2HB ASN 12 8.759 3.982 -11.439
75 1HD2 ASN 12 1HD2 ASN 12 9.185 4.634 -13.644
76 2HD2 ASN 12 2HD2 ASN 12 9.973 3.548 -14.739
77 H ASN 13 H ASN 13 9.909 3.142 -9.134
78 HA ASN 13 HA ASN 13 12.321 2.129 -10.138
79 1HB ASN 13 1HB ASN 13 11.684 3.415 -7.429
80 2HB ASN 13 2HB ASN 13 13.301 3.183 -8.064
81 1HD2 ASN 13 1HD2 ASN 13 12.294 5.655 -7.341
82 2HD2 ASN 13 2HD2 ASN 13 12.136 6.670 -8.736
83 H HIS 14 H HIS 14 10.030 1.265 -7.516
84 HA HIS 14 HA HIS 14 11.785 -0.593 -6.276
85 1HB HIS 14 1HB HIS 14 10.240 0.230 -4.793
86 2HB HIS 14 2HB HIS 14 8.943 0.265 -5.971
87 HD1 HIS 14 HD1 HIS 14 10.719 -2.062 -3.579
88 HD2 HIS 14 HD2 HIS 14 7.408 -2.084 -6.154
89 HE1 HIS 14 HE1 HIS 14 9.403 -4.180 -3.034
90 H CYS 15 H CYS 15 9.352 -0.660 -8.876
91 HA CYS 15 HA CYS 15 9.150 -3.487 -8.912
92 1HB CYS 15 1HB CYS 15 8.351 -1.337 -10.875
93 2HB CYS 15 2HB CYS 15 8.106 -3.043 -11.188
94 H LYS 16 H LYS 16 11.248 -0.981 -10.325
95 HA LYS 16 HA LYS 16 12.404 -2.779 -12.243
96 1HB LYS 16 1HB LYS 16 13.296 -0.926 -13.163
97 2HB LYS 16 2HB LYS 16 12.100 -0.099 -12.186
98 1HG LYS 16 1HG LYS 16 13.985 -0.177 -10.311
99 2HG LYS 16 2HG LYS 16 15.065 -0.432 -11.666
100 1HD LYS 16 1HD LYS 16 13.106 1.771 -12.075
101 2HD LYS 16 2HD LYS 16 14.226 2.046 -10.755
102 1HE LYS 16 1HE LYS 16 15.640 0.956 -13.075
103 2HE LYS 16 2HE LYS 16 14.732 2.383 -13.532
104 1HZ LYS 16 1HZ LYS 16 15.908 3.688 -12.007
105 2HZ LYS 16 2HZ LYS 16 16.387 2.431 -11.089
106 H SER 17 H SER 17 12.876 -1.856 -8.883
107 HA SER 17 HA SER 17 15.585 -2.715 -8.837
108 1HB SER 17 1HB SER 17 13.567 -1.790 -6.791
109 2HB SER 17 2HB SER 17 15.012 -2.611 -6.234
110 HG SER 17 HG SER 17 15.951 -0.864 -7.969
111 H ILE 18 H ILE 18 12.347 -4.074 -8.185
112 HA ILE 18 HA ILE 18 13.388 -6.430 -6.932
113 HB ILE 18 HB ILE 18 11.090 -7.159 -6.898
114 1HG1 ILE 18 1HG1 ILE 18 10.605 -4.832 -8.768
115 2HG1 ILE 18 2HG1 ILE 18 10.279 -6.531 -9.049
116 1HG2 ILE 18 1HG2 ILE 18 10.341 -4.541 -6.102
117 2HG2 ILE 18 2HG2 ILE 18 10.896 -5.895 -5.090
118 3HG2 ILE 18 3HG2 ILE 18 12.074 -4.733 -5.747
119 1HD1 ILE 18 1HD1 ILE 18 8.148 -5.751 -8.477
120 2HD1 ILE 18 2HD1 ILE 18 8.741 -6.305 -6.892
121 3HD1 ILE 18 3HD1 ILE 18 8.783 -4.574 -7.303
122 H SER 19 H SER 19 11.714 -5.724 -10.082
123 HA SER 19 HA SER 19 13.258 -6.752 -11.843
124 1HB SER 19 1HB SER 19 12.332 -9.048 -10.146
125 2HB SER 19 2HB SER 19 12.375 -9.317 -11.877
126 HG SER 19 HG SER 19 14.543 -9.236 -11.890
127 H CYS 20 H CYS 20 11.443 -5.114 -12.408
128 HA CYS 20 HA CYS 20 9.458 -6.566 -13.909
129 1HB CYS 20 1HB CYS 20 8.803 -5.134 -11.442
130 2HB CYS 20 2HB CYS 20 7.891 -4.561 -12.824
131 H ARG 21 H ARG 21 7.965 -4.461 -14.888
132 HA ARG 21 HA ARG 21 10.023 -2.953 -16.212
133 1HB ARG 21 1HB ARG 21 7.046 -3.377 -16.714
134 2HB ARG 21 2HB ARG 21 7.950 -2.174 -17.610
135 1HG ARG 21 1HG ARG 21 9.617 -4.369 -17.847
136 2HG ARG 21 2HG ARG 21 8.047 -5.145 -17.802
137 1HD ARG 21 1HD ARG 21 8.132 -4.707 -20.075
138 2HD ARG 21 2HD ARG 21 7.431 -3.187 -19.557
139 HE ARG 21 HE ARG 21 10.324 -3.070 -19.442
140 1HH1 ARG 21 2HH2 ARG 21 7.604 -2.920 -21.707
141 2HH1 ARG 21 1HH2 ARG 21 8.468 -1.980 -22.877
142 1HH2 ARG 21 HH1 ARG 21 10.737 -1.350 -22.432
143 H ALA 22 H ALA 22 6.744 -2.276 -14.759
144 HA ALA 22 HA ALA 22 7.690 -0.147 -13.185
145 1HB ALA 22 1HB ALA 22 7.086 1.754 -14.390
146 2HB ALA 22 2HB ALA 22 7.745 0.716 -15.678
147 3HB ALA 22 3HB ALA 22 5.984 0.854 -15.459
148 H GLY 23 H GLY 23 6.040 0.593 -11.755
149 1HA GLY 23 1HA GLY 23 3.483 -0.874 -12.038
150 2HA GLY 23 2HA GLY 23 4.309 -0.618 -10.514
151 H TYR 24 H TYR 24 1.900 0.274 -10.239
152 HA TYR 24 HA TYR 24 2.172 3.153 -10.329
153 1HB TYR 24 1HB TYR 24 -0.029 3.352 -11.508
154 2HB TYR 24 2HB TYR 24 1.076 2.427 -12.506
155 HD1 TYR 24 HD1 TYR 24 -1.549 1.900 -9.875
156 HD2 TYR 24 HD2 TYR 24 0.347 0.408 -13.408
157 HE1 TYR 24 HE1 TYR 24 -3.232 -0.003 -9.983
158 HE2 TYR 24 HE2 TYR 24 -1.342 -1.489 -13.504
159 HH TYR 24 HH TYR 24 -4.077 -1.529 -12.274
160 H CYS 25 H CYS 25 0.261 4.208 -9.134
161 HA CYS 25 HA CYS 25 -0.234 2.580 -6.798
162 1HB CYS 25 1HB CYS 25 -0.962 5.479 -7.233
163 2HB CYS 25 2HB CYS 25 -0.892 4.611 -5.712
164 H ASP 26 H ASP 26 -2.084 1.355 -6.741
165 HA ASP 26 HA ASP 26 -3.969 1.157 -8.541
166 1HB ASP 26 1HB ASP 26 -3.687 0.440 -5.808
167 2HB ASP 26 2HB ASP 26 -5.270 1.182 -5.914
168 HD2 ASP 26 HD2 ASP 26 -6.500 -1.495 -6.143
169 H ALA 27 H ALA 27 -4.813 3.020 -9.587
170 HA ALA 27 HA ALA 27 -5.493 5.380 -8.237
171 1HB ALA 27 1HB ALA 27 -5.019 5.548 -10.541
172 2HB ALA 27 2HB ALA 27 -6.101 4.197 -10.957
173 3HB ALA 27 3HB ALA 27 -6.784 5.763 -10.457
174 H ALA 28 H ALA 28 -6.951 2.293 -8.224
175 HA ALA 28 HA ALA 28 -9.629 3.379 -7.821
176 1HB ALA 28 1HB ALA 28 -9.159 1.381 -9.318
177 2HB ALA 28 2HB ALA 28 -8.711 0.480 -7.850
178 3HB ALA 28 3HB ALA 28 -10.368 1.102 -8.043
179 H THR 29 H THR 29 -6.862 3.084 -6.041
180 HA THR 29 HA THR 29 -8.406 2.564 -3.591
181 HB THR 29 HB THR 29 -6.654 0.746 -4.574
182 HG1 THR 29 HG1 THR 29 -6.733 1.768 -1.822
183 1HG2 THR 29 1HG2 THR 29 -4.901 2.869 -4.073
184 2HG2 THR 29 2HG2 THR 29 -4.834 1.938 -2.559
185 3HG2 THR 29 3HG2 THR 29 -4.440 1.151 -4.105
186 H LEU 30 H LEU 30 -7.634 5.054 -5.161
187 HA LEU 30 HA LEU 30 -7.040 7.117 -4.646
188 1HB LEU 30 1HB LEU 30 -6.649 6.190 -1.802
189 2HB LEU 30 2HB LEU 30 -6.892 7.833 -2.359
190 HG LEU 30 HG LEU 30 -8.934 5.597 -2.508
191 1HD1 LEU 30 1HD1 LEU 30 -9.965 7.595 -0.909
192 2HD1 LEU 30 2HD1 LEU 30 -9.252 6.063 -0.350
193 3HD1 LEU 30 3HD1 LEU 30 -8.252 7.534 -0.427
194 1HD2 LEU 30 1HD2 LEU 30 -8.890 8.376 -3.601
195 2HD2 LEU 30 2HD2 LEU 30 -9.600 6.888 -4.270
196 3HD2 LEU 30 3HD2 LEU 30 -10.419 7.745 -2.944
197 H TRP 31 H TRP 31 -5.155 5.280 -5.740
198 HA TRP 31 HA TRP 31 -2.967 4.864 -5.945
199 1HB TRP 31 1HB TRP 31 -2.946 7.841 -5.428
200 2HB TRP 31 2HB TRP 31 -1.586 6.937 -6.065
201 HD1 TRP 31 HD1 TRP 31 -1.544 6.653 -8.680
202 HE1 TRP 31 HE1 TRP 31 -3.152 7.107 -10.724
203 HE3 TRP 31 HE3 TRP 31 -5.636 7.792 -5.885
204 HZ2 TRP 31 HZ2 TRP 31 -5.892 7.875 -10.937
205 HZ3 TRP 31 HZ3 TRP 31 -7.737 8.383 -7.089
206 HH2 TRP 31 HH2 TRP 31 -7.906 8.435 -9.527
207 H LEU 32 H LEU 32 -3.110 3.535 -3.882
208 HA LEU 32 HA LEU 32 -1.389 4.767 -1.848
209 1HB LEU 32 1HB LEU 32 -3.396 4.758 -0.739
210 2HB LEU 32 2HB LEU 32 -3.977 3.318 -1.550
211 HG LEU 32 HG LEU 32 -2.657 1.883 -0.175
212 1HD1 LEU 32 1HD1 LEU 32 -1.449 3.869 1.598
213 2HD1 LEU 32 2HD1 LEU 32 -0.744 2.423 0.836
214 3HD1 LEU 32 3HD1 LEU 32 -0.835 3.952 -0.071
215 1HD2 LEU 32 1HD2 LEU 32 -4.103 4.051 1.341
216 2HD2 LEU 32 2HD2 LEU 32 -4.651 2.407 0.930
217 3HD2 LEU 32 3HD2 LEU 32 -3.389 2.642 2.162
218 H ARG 33 H ARG 33 -2.569 1.770 -3.472
219 HA ARG 33 HA ARG 33 -0.519 0.214 -2.333
220 1HB ARG 33 1HB ARG 33 -2.898 -0.256 -3.784
221 2HB ARG 33 2HB ARG 33 -1.636 -0.829 -4.856
222 1HG ARG 33 1HG ARG 33 -1.005 -1.716 -2.176
223 2HG ARG 33 2HG ARG 33 -2.683 -2.106 -2.495
224 1HD ARG 33 1HD ARG 33 -1.794 -3.025 -4.803
225 2HD ARG 33 2HD ARG 33 -0.221 -3.001 -4.033
226 HE ARG 33 HE ARG 33 -0.844 -4.894 -2.827
227 1HH1 ARG 33 2HH2 ARG 33 -3.793 -3.201 -3.823
228 2HH1 ARG 33 1HH2 ARG 33 -4.853 -4.415 -3.187
229 1HH2 ARG 33 HH1 ARG 33 -3.919 -6.343 -2.113
230 H CYS 34 H CYS 34 0.803 -1.227 -4.168
231 HA CYS 34 HA CYS 34 1.817 0.608 -6.187
232 1HB CYS 34 1HB CYS 34 3.307 -0.383 -3.838
233 2HB CYS 34 2HB CYS 34 4.134 -0.569 -5.371
234 H THR 35 H THR 35 0.654 -0.780 -7.686
235 HA THR 35 HA THR 35 1.324 -3.604 -7.688
236 HB THR 35 HB THR 35 -0.889 -1.973 -8.452
237 HG1 THR 35 HG1 THR 35 -1.554 -4.276 -9.091
238 1HG2 THR 35 1HG2 THR 35 0.413 -3.452 -10.799
239 2HG2 THR 35 2HG2 THR 35 -1.276 -2.892 -10.772
240 3HG2 THR 35 3HG2 THR 35 0.053 -1.710 -10.728
241 H CYS 36 H CYS 36 2.734 -4.633 -9.003
242 HA CYS 36 HA CYS 36 4.366 -2.889 -10.650
243 1HB CYS 36 1HB CYS 36 4.737 -5.682 -9.578
244 2HB CYS 36 2HB CYS 36 5.776 -5.026 -10.827
245 H THR 37 H THR 37 3.817 -2.702 -12.792
246 HA THR 37 HA THR 37 2.435 -4.994 -14.024
247 HB THR 37 HB THR 37 1.342 -3.309 -15.449
248 HG1 THR 37 HG1 THR 37 2.863 -1.395 -13.845
249 1HG2 THR 37 1HG2 THR 37 0.671 -1.573 -13.456
250 2HG2 THR 37 2HG2 THR 37 -0.028 -3.206 -13.566
251 3HG2 THR 37 3HG2 THR 37 1.340 -2.895 -12.469
252 H ASP 38 H ASP 38 3.098 -5.778 -16.024
253 HA ASP 38 HA ASP 38 4.491 -6.266 -17.611
254 1HB ASP 38 1HB ASP 38 5.079 -3.325 -17.271
255 2HB ASP 38 2HB ASP 38 6.165 -4.261 -18.277
256 HD2 ASP 38 HD2 ASP 38 5.281 -3.830 -20.592
257 H CYS 39 H CYS 39 6.422 -7.478 -17.533
258 HA CYS 39 HA CYS 39 8.598 -6.502 -15.906
259 1HB CYS 39 1HB CYS 39 7.440 -9.237 -15.356
260 2HB CYS 39 2HB CYS 39 8.802 -8.478 -14.557
261 H ASN 40 H ASN 40 10.625 -7.638 -16.465
262 HA ASN 40 HA ASN 40 10.441 -8.715 -19.129
263 1HB ASN 40 1HB ASN 40 12.545 -7.433 -17.431
264 2HB ASN 40 2HB ASN 40 13.141 -8.698 -18.488
265 1HD2 ASN 40 1HD2 ASN 40 13.708 -8.130 -20.437
266 2HD2 ASN 40 2HD2 ASN 40 13.161 -6.754 -21.335
267 H GLY 41 H GLY 41 9.393 -10.763 -18.141
268 1HA GLY 41 1HA GLY 41 11.297 -12.841 -17.926
269 2HA GLY 41 2HA GLY 41 10.687 -12.439 -16.333
270 H LYS 42 H LYS 42 9.159 -12.542 -19.637
271 HA LYS 42 HA LYS 42 7.289 -13.476 -20.352
272 1HB LYS 42 1HB LYS 42 8.426 -15.597 -18.560
273 2HB LYS 42 2HB LYS 42 6.838 -15.841 -19.260
274 1HG LYS 42 1HG LYS 42 9.113 -14.926 -21.039
275 2HG LYS 42 2HG LYS 42 9.018 -16.613 -20.575
276 1HD LYS 42 1HD LYS 42 6.554 -16.544 -21.383
277 2HD LYS 42 2HD LYS 42 6.936 -14.991 -22.099
278 1HE LYS 42 1HE LYS 42 8.961 -17.031 -22.760
279 2HE LYS 42 2HE LYS 42 7.357 -17.512 -23.275
280 1HZ LYS 42 1HZ LYS 42 8.192 -16.216 -25.033
281 2HZ LYS 42 2HZ LYS 42 7.220 -15.164 -24.258
282 H LYS 43 H LYS 43 6.251 -11.541 -19.296
283 HA LYS 43 HA LYS 43 4.696 -10.602 -18.035
284 1HB LYS 43 1HB LYS 43 3.649 -12.987 -19.080
285 2HB LYS 43 2HB LYS 43 3.115 -12.961 -17.412
286 1HG LYS 43 1HG LYS 43 1.858 -11.014 -17.687
287 2HG LYS 43 2HG LYS 43 2.905 -10.380 -18.942
288 1HD LYS 43 1HD LYS 43 1.938 -12.627 -20.201
289 2HD LYS 43 2HD LYS 43 0.575 -12.236 -19.172
290 1HE LYS 43 1HE LYS 43 0.176 -10.182 -20.229
291 2HE LYS 43 2HE LYS 43 1.851 -9.973 -20.700
292 1HZ LYS 43 1HZ LYS 43 0.708 -12.283 -21.938
293 2HZ LYS 43 2HZ LYS 43 -0.152 -10.949 -22.303
Start of MODEL 4
1 1H GLY 1 H GLY 1 4.846 0.145 3.347
2 1HA GLY 1 1HA GLY 1 4.380 1.984 2.144
3 2HA GLY 1 2HA GLY 1 5.582 2.827 3.101
4 H PHE 2 H PHE 2 4.863 1.275 0.037
5 HA PHE 2 HA PHE 2 7.540 1.133 -0.886
6 1HB PHE 2 1HB PHE 2 4.725 1.137 -2.102
7 2HB PHE 2 2HB PHE 2 6.137 1.028 -3.135
8 HD1 PHE 2 HD1 PHE 2 7.891 -0.850 -2.269
9 HD2 PHE 2 HD2 PHE 2 3.707 -0.850 -1.557
10 HE1 PHE 2 HE1 PHE 2 7.948 -3.337 -1.928
11 HE2 PHE 2 HE2 PHE 2 3.765 -3.336 -1.217
12 HZ PHE 2 HZ PHE 2 5.884 -4.550 -1.406
13 H GLY 3 H GLY 3 5.296 3.730 -0.410
14 1HA GLY 3 1HA GLY 3 6.731 5.859 -0.803
15 2HA GLY 3 2HA GLY 3 6.550 5.390 -2.482
16 H CYS 4 H CYS 4 3.897 4.326 -2.464
17 HA CYS 4 HA CYS 4 2.456 6.777 -2.504
18 1HB CYS 4 1HB CYS 4 1.516 3.938 -2.969
19 2HB CYS 4 2HB CYS 4 0.578 5.384 -3.283
20 HA PRO 5 HA PRO 5 0.388 7.167 -2.446
21 1HB PRO 5 1HB PRO 5 -0.950 9.202 -1.205
22 2HB PRO 5 2HB PRO 5 -1.717 7.700 -1.682
23 1HG PRO 5 1HG PRO 5 -0.921 8.597 1.020
24 2HG PRO 5 2HG PRO 5 -2.045 7.330 0.571
25 1HD PRO 5 1HD PRO 5 0.640 6.986 1.517
26 2HD PRO 5 2HD PRO 5 -0.444 5.727 0.959
27 H GLY 6 H GLY 6 0.991 9.105 -3.551
28 1HA GLY 6 1HA GLY 6 2.226 11.010 -3.776
29 2HA GLY 6 2HA GLY 6 2.681 10.936 -2.086
30 H ASN 7 H ASN 7 3.120 8.896 -5.074
31 HA ASN 7 HA ASN 7 5.703 9.226 -5.483
32 1HB ASN 7 1HB ASN 7 5.356 7.797 -2.945
33 2HB ASN 7 2HB ASN 7 6.216 6.785 -4.089
34 1HD2 ASN 7 1HD2 ASN 7 7.548 7.520 -1.932
35 2HD2 ASN 7 2HD2 ASN 7 8.749 8.725 -2.258
36 H GLN 8 H GLN 8 4.480 8.643 -7.493
37 HA GLN 8 HA GLN 8 3.673 5.886 -7.684
38 1HB GLN 8 1HB GLN 8 2.242 7.723 -8.609
39 2HB GLN 8 2HB GLN 8 3.516 8.137 -9.737
40 1HG GLN 8 1HG GLN 8 3.117 5.320 -10.004
41 2HG GLN 8 2HG GLN 8 1.516 6.029 -9.935
42 1HE2 GLN 8 1HE2 GLN 8 4.592 5.978 -11.599
43 2HE2 GLN 8 2HE2 GLN 8 4.082 6.710 -13.084
44 H LEU 9 H LEU 9 6.473 7.802 -8.188
45 HA LEU 9 HA LEU 9 7.456 6.169 -10.374
46 1HB LEU 9 1HB LEU 9 9.123 7.732 -10.635
47 2HB LEU 9 2HB LEU 9 7.742 8.694 -10.145
48 HG LEU 9 HG LEU 9 9.441 7.818 -7.901
49 1HD1 LEU 9 1HD1 LEU 9 10.970 8.330 -10.004
50 2HD1 LEU 9 2HD1 LEU 9 10.648 10.015 -9.526
51 3HD1 LEU 9 3HD1 LEU 9 11.402 8.890 -8.370
52 1HD2 LEU 9 1HD2 LEU 9 9.271 10.491 -7.694
53 2HD2 LEU 9 2HD2 LEU 9 7.873 10.190 -8.752
54 3HD2 LEU 9 3HD2 LEU 9 7.980 9.382 -7.170
55 H LYS 10 H LYS 10 7.535 6.386 -6.868
56 HA LYS 10 HA LYS 10 9.957 4.935 -6.547
57 1HB LYS 10 1HB LYS 10 8.101 6.340 -4.906
58 2HB LYS 10 2HB LYS 10 8.222 4.712 -4.271
59 1HG LYS 10 1HG LYS 10 10.868 5.194 -4.748
60 2HG LYS 10 2HG LYS 10 10.328 6.838 -4.471
61 1HD LYS 10 1HD LYS 10 9.408 6.232 -2.277
62 2HD LYS 10 2HD LYS 10 9.717 4.531 -2.565
63 1HE LYS 10 1HE LYS 10 11.996 4.726 -2.164
64 2HE LYS 10 2HE LYS 10 12.088 6.348 -2.821
65 1HZ LYS 10 1HZ LYS 10 10.582 5.970 -0.330
66 2HZ LYS 10 2HZ LYS 10 12.208 5.950 -0.242
67 H CYS 11 H CYS 11 6.650 4.130 -7.352
68 HA CYS 11 HA CYS 11 6.799 1.458 -6.378
69 1HB CYS 11 1HB CYS 11 4.867 2.818 -8.265
70 2HB CYS 11 2HB CYS 11 4.705 1.160 -7.716
71 H ASN 12 H ASN 12 7.301 3.230 -9.472
72 HA ASN 12 HA ASN 12 7.602 0.902 -11.007
73 1HB ASN 12 1HB ASN 12 7.051 2.953 -12.162
74 2HB ASN 12 2HB ASN 12 8.364 3.829 -11.401
75 1HD2 ASN 12 1HD2 ASN 12 8.910 4.444 -13.571
76 2HD2 ASN 12 2HD2 ASN 12 9.876 3.409 -14.569
77 H ASN 13 H ASN 13 9.750 3.084 -9.131
78 HA ASN 13 HA ASN 13 12.150 2.134 -10.180
79 1HB ASN 13 1HB ASN 13 11.554 3.357 -7.432
80 2HB ASN 13 2HB ASN 13 13.156 3.195 -8.123
81 1HD2 ASN 13 1HD2 ASN 13 11.732 5.577 -7.310
82 2HD2 ASN 13 2HD2 ASN 13 11.612 6.621 -8.687
83 H HIS 14 H HIS 14 10.047 1.242 -7.385
84 HA HIS 14 HA HIS 14 11.880 -0.608 -6.288
85 1HB HIS 14 1HB HIS 14 10.425 0.096 -4.689
86 2HB HIS 14 2HB HIS 14 9.082 0.252 -5.804
87 HD1 HIS 14 HD1 HIS 14 10.882 -2.306 -3.671
88 HD2 HIS 14 HD2 HIS 14 7.422 -1.999 -6.022
89 HE1 HIS 14 HE1 HIS 14 9.500 -4.395 -3.185
90 H CYS 15 H CYS 15 9.285 -0.725 -8.733
91 HA CYS 15 HA CYS 15 9.137 -3.547 -8.785
92 1HB CYS 15 1HB CYS 15 8.253 -1.416 -10.736
93 2HB CYS 15 2HB CYS 15 7.985 -3.128 -10.999
94 H LYS 16 H LYS 16 11.207 -1.040 -10.198
95 HA LYS 16 HA LYS 16 12.279 -2.791 -12.210
96 1HB LYS 16 1HB LYS 16 13.102 -0.913 -13.120
97 2HB LYS 16 2HB LYS 16 12.025 -0.088 -12.011
98 1HG LYS 16 1HG LYS 16 14.057 -0.323 -10.308
99 2HG LYS 16 2HG LYS 16 15.008 -0.549 -11.761
100 1HD LYS 16 1HD LYS 16 13.134 1.722 -11.995
101 2HD LYS 16 2HD LYS 16 14.243 1.915 -10.652
102 1HE LYS 16 1HE LYS 16 16.160 1.384 -12.245
103 2HE LYS 16 2HE LYS 16 15.004 1.382 -13.563
104 1HZ LYS 16 1HZ LYS 16 14.495 3.685 -13.106
105 2HZ LYS 16 2HZ LYS 16 15.409 3.706 -11.758
106 H SER 17 H SER 17 12.897 -1.917 -8.850
107 HA SER 17 HA SER 17 15.584 -2.825 -8.912
108 1HB SER 17 1HB SER 17 13.660 -1.810 -6.851
109 2HB SER 17 2HB SER 17 14.965 -2.823 -6.262
110 HG SER 17 HG SER 17 16.226 -1.111 -6.405
111 H ILE 18 H ILE 18 12.354 -4.171 -8.205
112 HA ILE 18 HA ILE 18 13.405 -6.565 -7.035
113 HB ILE 18 HB ILE 18 11.100 -7.275 -6.960
114 1HG1 ILE 18 1HG1 ILE 18 10.593 -4.896 -8.756
115 2HG1 ILE 18 2HG1 ILE 18 10.236 -6.582 -9.069
116 1HG2 ILE 18 1HG2 ILE 18 12.176 -4.998 -5.699
117 2HG2 ILE 18 2HG2 ILE 18 10.495 -4.589 -6.119
118 3HG2 ILE 18 3HG2 ILE 18 10.841 -6.036 -5.141
119 1HD1 ILE 18 1HD1 ILE 18 8.135 -5.739 -8.428
120 2HD1 ILE 18 2HD1 ILE 18 8.742 -6.422 -6.900
121 3HD1 ILE 18 3HD1 ILE 18 8.834 -4.668 -7.190
122 H SER 19 H SER 19 11.677 -5.752 -10.128
123 HA SER 19 HA SER 19 13.187 -6.790 -11.931
124 1HB SER 19 1HB SER 19 13.698 -8.898 -11.088
125 2HB SER 19 2HB SER 19 12.143 -9.085 -10.300
126 HG SER 19 HG SER 19 12.926 -9.750 -12.919
127 H CYS 20 H CYS 20 11.449 -5.045 -12.431
128 HA CYS 20 HA CYS 20 9.399 -6.349 -13.978
129 1HB CYS 20 1HB CYS 20 8.809 -4.873 -11.489
130 2HB CYS 20 2HB CYS 20 7.857 -4.391 -12.880
131 H ARG 21 H ARG 21 8.117 -4.392 -15.167
132 HA ARG 21 HA ARG 21 10.223 -2.792 -16.252
133 1HB ARG 21 1HB ARG 21 7.337 -3.363 -16.997
134 2HB ARG 21 2HB ARG 21 8.156 -2.002 -17.735
135 1HG ARG 21 1HG ARG 21 9.789 -4.475 -17.742
136 2HG ARG 21 2HG ARG 21 8.280 -4.650 -18.617
137 1HD ARG 21 1HD ARG 21 9.095 -2.183 -19.534
138 2HD ARG 21 2HD ARG 21 10.649 -2.938 -19.246
139 HE ARG 21 HE ARG 21 9.079 -4.858 -20.606
140 1HH1 ARG 21 2HH2 ARG 21 10.400 -1.636 -21.262
141 2HH1 ARG 21 1HH2 ARG 21 10.509 -1.893 -22.972
142 1HH2 ARG 21 HH1 ARG 21 9.811 -3.995 -23.889
143 H ALA 22 H ALA 22 6.847 -2.191 -15.007
144 HA ALA 22 HA ALA 22 7.666 -0.027 -13.396
145 1HB ALA 22 1HB ALA 22 7.949 1.119 -15.543
146 2HB ALA 22 2HB ALA 22 6.301 0.653 -16.033
147 3HB ALA 22 3HB ALA 22 6.540 1.785 -14.681
148 H GLY 23 H GLY 23 5.981 0.580 -11.976
149 1HA GLY 23 1HA GLY 23 3.472 -0.941 -12.359
150 2HA GLY 23 2HA GLY 23 4.249 -0.687 -10.809
151 H TYR 24 H TYR 24 2.298 0.334 -9.989
152 HA TYR 24 HA TYR 24 2.342 3.128 -10.208
153 1HB TYR 24 1HB TYR 24 0.146 3.370 -11.401
154 2HB TYR 24 2HB TYR 24 1.282 2.522 -12.432
155 HD1 TYR 24 HD1 TYR 24 0.590 0.560 -13.472
156 HD2 TYR 24 HD2 TYR 24 -1.367 1.792 -9.874
157 HE1 TYR 24 HE1 TYR 24 -1.066 -1.355 -13.709
158 HE2 TYR 24 HE2 TYR 24 -3.017 -0.127 -10.123
159 HH TYR 24 HH TYR 24 -2.843 -2.503 -11.326
160 H CYS 25 H CYS 25 0.383 4.117 -9.014
161 HA CYS 25 HA CYS 25 -0.138 2.382 -6.758
162 1HB CYS 25 1HB CYS 25 -0.866 5.296 -7.062
163 2HB CYS 25 2HB CYS 25 -0.811 4.356 -5.584
164 H ASP 26 H ASP 26 -2.043 1.244 -6.644
165 HA ASP 26 HA ASP 26 -3.878 1.035 -8.502
166 1HB ASP 26 1HB ASP 26 -3.692 0.398 -5.732
167 2HB ASP 26 2HB ASP 26 -5.268 1.137 -5.930
168 HD2 ASP 26 HD2 ASP 26 -6.633 -0.021 -7.685
169 H ALA 27 H ALA 27 -4.651 2.891 -9.613
170 HA ALA 27 HA ALA 27 -5.338 5.287 -8.318
171 1HB ALA 27 1HB ALA 27 -6.514 5.669 -10.600
172 2HB ALA 27 2HB ALA 27 -4.751 5.422 -10.599
173 3HB ALA 27 3HB ALA 27 -5.837 4.086 -11.052
174 H ALA 28 H ALA 28 -6.836 2.229 -8.306
175 HA ALA 28 HA ALA 28 -9.512 3.369 -8.044
176 1HB ALA 28 1HB ALA 28 -9.121 0.450 -7.756
177 2HB ALA 28 2HB ALA 28 -10.262 1.357 -8.779
178 3HB ALA 28 3HB ALA 28 -8.583 1.115 -9.317
179 H THR 29 H THR 29 -6.860 3.111 -6.140
180 HA THR 29 HA THR 29 -8.506 2.584 -3.763
181 HB THR 29 HB THR 29 -6.729 0.745 -4.663
182 HG1 THR 29 HG1 THR 29 -7.115 0.069 -2.563
183 1HG2 THR 29 1HG2 THR 29 -5.000 1.929 -2.562
184 2HG2 THR 29 2HG2 THR 29 -4.537 1.122 -4.080
185 3HG2 THR 29 3HG2 THR 29 -4.978 2.847 -4.087
186 H LEU 30 H LEU 30 -7.579 5.048 -5.335
187 HA LEU 30 HA LEU 30 -7.003 7.110 -4.792
188 1HB LEU 30 1HB LEU 30 -6.674 6.275 -1.919
189 2HB LEU 30 2HB LEU 30 -7.043 7.866 -2.555
190 HG LEU 30 HG LEU 30 -8.910 5.489 -2.764
191 1HD1 LEU 30 1HD1 LEU 30 -10.144 7.091 -0.995
192 2HD1 LEU 30 2HD1 LEU 30 -9.056 5.764 -0.523
193 3HD1 LEU 30 3HD1 LEU 30 -8.451 7.437 -0.571
194 1HD2 LEU 30 1HD2 LEU 30 -10.188 8.061 -2.866
195 2HD2 LEU 30 2HD2 LEU 30 -8.896 7.983 -4.088
196 3HD2 LEU 30 3HD2 LEU 30 -10.181 6.751 -4.071
197 H TRP 31 H TRP 31 -5.099 5.221 -5.780
198 HA TRP 31 HA TRP 31 -2.910 4.768 -5.876
199 1HB TRP 31 1HB TRP 31 -2.868 7.756 -5.424
200 2HB TRP 31 2HB TRP 31 -1.496 6.821 -5.981
201 HD1 TRP 31 HD1 TRP 31 -1.352 6.460 -8.586
202 HE1 TRP 31 HE1 TRP 31 -2.860 6.896 -10.706
203 HE3 TRP 31 HE3 TRP 31 -5.530 7.757 -5.996
204 HZ2 TRP 31 HZ2 TRP 31 -5.571 7.716 -11.055
205 HZ3 TRP 31 HZ3 TRP 31 -7.566 8.362 -7.302
206 HH2 TRP 31 HH2 TRP 31 -7.631 8.356 -9.746
207 H LEU 32 H LEU 32 -3.227 3.514 -3.760
208 HA LEU 32 HA LEU 32 -1.588 4.777 -1.674
209 1HB LEU 32 1HB LEU 32 -3.661 4.737 -0.687
210 2HB LEU 32 2HB LEU 32 -4.157 3.268 -1.504
211 HG LEU 32 HG LEU 32 -3.019 1.881 -0.002
212 1HD1 LEU 32 1HD1 LEU 32 -0.951 2.348 0.648
213 2HD1 LEU 32 2HD1 LEU 32 -1.140 4.044 0.141
214 3HD1 LEU 32 3HD1 LEU 32 -1.600 3.550 1.788
215 1HD2 LEU 32 1HD2 LEU 32 -3.638 2.813 2.306
216 2HD2 LEU 32 2HD2 LEU 32 -4.251 4.233 1.425
217 3HD2 LEU 32 3HD2 LEU 32 -4.940 2.624 1.107
218 H ARG 33 H ARG 33 -2.566 1.788 -3.420
219 HA ARG 33 HA ARG 33 -0.546 0.280 -2.129
220 1HB ARG 33 1HB ARG 33 -2.866 -0.295 -3.608
221 2HB ARG 33 2HB ARG 33 -1.580 -0.808 -4.680
222 1HG ARG 33 1HG ARG 33 -1.172 -2.648 -3.418
223 2HG ARG 33 2HG ARG 33 -0.955 -1.674 -1.978
224 1HD ARG 33 1HD ARG 33 -3.653 -1.537 -2.114
225 2HD ARG 33 2HD ARG 33 -3.444 -3.040 -2.990
226 HE ARG 33 HE ARG 33 -1.836 -3.148 -0.625
227 1HH1 ARG 33 2HH2 ARG 33 -5.250 -3.166 -1.572
228 2HH1 ARG 33 1HH2 ARG 33 -5.759 -4.068 -0.185
229 1HH2 ARG 33 HH1 ARG 33 -4.128 -4.747 1.437
230 H CYS 34 H CYS 34 0.930 -1.126 -3.821
231 HA CYS 34 HA CYS 34 1.970 0.721 -5.829
232 1HB CYS 34 1HB CYS 34 3.335 -0.215 -3.418
233 2HB CYS 34 2HB CYS 34 4.226 -0.574 -4.883
234 H THR 35 H THR 35 0.828 -0.643 -7.378
235 HA THR 35 HA THR 35 1.483 -3.464 -7.421
236 HB THR 35 HB THR 35 -0.693 -1.833 -8.203
237 HG1 THR 35 HG1 THR 35 -0.942 -4.021 -7.610
238 1HG2 THR 35 1HG2 THR 35 0.651 -3.166 -10.614
239 2HG2 THR 35 2HG2 THR 35 -0.984 -2.461 -10.594
240 3HG2 THR 35 3HG2 THR 35 0.441 -1.410 -10.407
241 H CYS 36 H CYS 36 2.290 -4.516 -9.422
242 HA CYS 36 HA CYS 36 4.230 -2.754 -10.734
243 1HB CYS 36 1HB CYS 36 4.588 -5.609 -9.809
244 2HB CYS 36 2HB CYS 36 5.679 -4.808 -10.923
245 H THR 37 H THR 37 4.039 -2.723 -12.961
246 HA THR 37 HA THR 37 2.486 -4.910 -14.183
247 HB THR 37 HB THR 37 1.863 -2.899 -15.812
248 HG1 THR 37 HG1 THR 37 1.906 -0.908 -14.447
249 1HG2 THR 37 1HG2 THR 37 0.516 -4.050 -13.662
250 2HG2 THR 37 2HG2 THR 37 0.582 -2.335 -13.189
251 3HG2 THR 37 3HG2 THR 37 -0.169 -2.805 -14.732
252 H ASP 38 H ASP 38 3.166 -5.709 -16.174
253 HA ASP 38 HA ASP 38 4.584 -6.245 -17.721
254 1HB ASP 38 1HB ASP 38 5.302 -3.319 -17.385
255 2HB ASP 38 2HB ASP 38 6.268 -4.319 -18.454
256 HD2 ASP 38 HD2 ASP 38 5.457 -4.778 -20.363
257 H CYS 39 H CYS 39 6.307 -7.650 -17.338
258 HA CYS 39 HA CYS 39 8.574 -6.635 -15.837
259 1HB CYS 39 1HB CYS 39 7.257 -9.251 -15.091
260 2HB CYS 39 2HB CYS 39 8.660 -8.517 -14.342
261 H ASN 40 H ASN 40 10.538 -7.906 -16.299
262 HA ASN 40 HA ASN 40 10.188 -9.483 -18.724
263 1HB ASN 40 1HB ASN 40 12.496 -7.762 -17.705
264 2HB ASN 40 2HB ASN 40 12.732 -8.930 -18.990
265 1HD2 ASN 40 1HD2 ASN 40 13.030 -7.694 -20.714
266 2HD2 ASN 40 2HD2 ASN 40 11.919 -6.521 -21.339
267 H GLY 41 H GLY 41 9.746 -11.394 -17.267
268 1HA GLY 41 1HA GLY 41 11.994 -12.992 -16.825
269 2HA GLY 41 2HA GLY 41 11.565 -12.255 -15.294
270 H LYS 42 H LYS 42 11.056 -14.939 -17.241
271 HA LYS 42 HA LYS 42 8.278 -15.314 -16.502
272 1HB LYS 42 1HB LYS 42 8.342 -17.231 -17.938
273 2HB LYS 42 2HB LYS 42 9.113 -15.897 -18.772
274 1HG LYS 42 1HG LYS 42 11.363 -16.782 -17.979
275 2HG LYS 42 2HG LYS 42 10.532 -18.175 -17.316
276 1HD LYS 42 1HD LYS 42 9.815 -18.924 -19.487
277 2HD LYS 42 2HD LYS 42 10.194 -17.385 -20.235
278 1HE LYS 42 1HE LYS 42 12.443 -17.870 -20.424
279 2HE LYS 42 2HE LYS 42 12.504 -18.700 -18.882
280 1HZ LYS 42 1HZ LYS 42 12.650 -20.044 -21.112
281 2HZ LYS 42 2HZ LYS 42 11.843 -20.680 -19.848
282 H LYS 43 H LYS 43 7.578 -16.476 -14.771
283 HA LYS 43 HA LYS 43 9.543 -18.203 -13.458
284 1HB LYS 43 1HB LYS 43 8.982 -15.725 -12.469
285 2HB LYS 43 2HB LYS 43 7.752 -16.676 -11.662
286 1HG LYS 43 1HG LYS 43 9.807 -18.354 -11.234
287 2HG LYS 43 2HG LYS 43 10.755 -16.898 -11.464
288 1HD LYS 43 1HD LYS 43 10.029 -15.942 -9.496
289 2HD LYS 43 2HD LYS 43 8.398 -16.560 -9.672
290 1HE LYS 43 1HE LYS 43 10.579 -18.568 -9.137
291 2HE LYS 43 2HE LYS 43 10.114 -17.521 -7.812
292 1HZ LYS 43 1HZ LYS 43 8.524 -19.575 -9.148
293 2HZ LYS 43 2HZ LYS 43 8.553 -19.164 -7.573
Start of MODEL 5
1 1H GLY 1 H GLY 1 3.187 -1.006 -1.809
2 1HA GLY 1 1HA GLY 1 2.403 1.367 -2.229
3 2HA GLY 1 2HA GLY 1 2.708 1.609 -0.521
4 H PHE 2 H PHE 2 4.985 1.015 0.288
5 HA PHE 2 HA PHE 2 7.160 1.357 0.218
6 1HB PHE 2 1HB PHE 2 6.432 0.059 -2.398
7 2HB PHE 2 2HB PHE 2 8.001 0.837 -2.396
8 HD1 PHE 2 HD1 PHE 2 6.127 -2.043 -1.383
9 HD2 PHE 2 HD2 PHE 2 9.694 0.134 -0.641
10 HE1 PHE 2 HE1 PHE 2 7.125 -4.058 -0.266
11 HE2 PHE 2 HE2 PHE 2 10.691 -1.880 0.477
12 HZ PHE 2 HZ PHE 2 9.395 -3.952 0.650
13 H GLY 3 H GLY 3 5.358 3.607 -0.402
14 1HA GLY 3 1HA GLY 3 6.964 5.680 -0.794
15 2HA GLY 3 2HA GLY 3 6.758 5.138 -2.448
16 H CYS 4 H CYS 4 4.078 4.209 -2.429
17 HA CYS 4 HA CYS 4 2.737 6.722 -2.511
18 1HB CYS 4 1HB CYS 4 2.289 4.003 -3.491
19 2HB CYS 4 2HB CYS 4 0.821 4.762 -2.908
20 HA PRO 5 HA PRO 5 0.466 6.814 -2.628
21 1HB PRO 5 1HB PRO 5 -1.169 8.743 -1.594
22 2HB PRO 5 2HB PRO 5 -1.718 7.121 -1.966
23 1HG PRO 5 1HG PRO 5 -1.145 8.324 0.674
24 2HG PRO 5 2HG PRO 5 -2.078 6.888 0.301
25 1HD PRO 5 1HD PRO 5 0.592 6.976 1.342
26 2HD PRO 5 2HD PRO 5 -0.298 5.546 0.861
27 H GLY 6 H GLY 6 0.735 8.820 -3.822
28 1HA GLY 6 1HA GLY 6 1.754 10.817 -4.183
29 2HA GLY 6 2HA GLY 6 2.156 10.929 -2.480
30 H ASN 7 H ASN 7 2.935 8.385 -4.956
31 HA ASN 7 HA ASN 7 5.494 9.152 -5.448
32 1HB ASN 7 1HB ASN 7 5.439 8.422 -2.798
33 2HB ASN 7 2HB ASN 7 5.766 6.861 -3.523
34 1HD2 ASN 7 1HD2 ASN 7 7.670 7.650 -1.990
35 2HD2 ASN 7 2HD2 ASN 7 9.049 8.285 -2.825
36 H GLN 8 H GLN 8 4.435 8.247 -7.435
37 HA GLN 8 HA GLN 8 3.985 5.402 -7.395
38 1HB GLN 8 1HB GLN 8 2.363 6.929 -8.521
39 2HB GLN 8 2HB GLN 8 3.615 7.443 -9.633
40 1HG GLN 8 1HG GLN 8 3.656 4.599 -9.725
41 2HG GLN 8 2HG GLN 8 1.959 5.035 -9.713
42 1HE2 GLN 8 1HE2 GLN 8 1.087 6.298 -11.349
43 2HE2 GLN 8 2HE2 GLN 8 1.862 6.527 -12.881
44 H LEU 9 H LEU 9 6.363 7.798 -8.434
45 HA LEU 9 HA LEU 9 7.659 6.177 -10.350
46 1HB LEU 9 1HB LEU 9 9.282 7.853 -10.426
47 2HB LEU 9 2HB LEU 9 7.758 8.671 -10.147
48 HG LEU 9 HG LEU 9 9.247 8.013 -7.685
49 1HD1 LEU 9 1HD1 LEU 9 10.769 10.043 -8.076
50 2HD1 LEU 9 2HD1 LEU 9 11.215 8.503 -8.847
51 3HD1 LEU 9 3HD1 LEU 9 10.444 9.788 -9.807
52 1HD2 LEU 9 1HD2 LEU 9 8.448 10.787 -8.354
53 2HD2 LEU 9 2HD2 LEU 9 7.136 9.587 -8.269
54 3HD2 LEU 9 3HD2 LEU 9 8.203 9.839 -6.867
55 H LYS 10 H LYS 10 7.669 6.357 -6.825
56 HA LYS 10 HA LYS 10 10.164 5.035 -6.503
57 1HB LYS 10 1HB LYS 10 8.373 6.429 -4.877
58 2HB LYS 10 2HB LYS 10 8.293 4.784 -4.278
59 1HG LYS 10 1HG LYS 10 10.979 4.957 -4.539
60 2HG LYS 10 2HG LYS 10 10.642 6.667 -4.359
61 1HD LYS 10 1HD LYS 10 9.182 5.929 -2.293
62 2HD LYS 10 2HD LYS 10 10.068 4.422 -2.397
63 1HE LYS 10 1HE LYS 10 12.231 5.822 -2.356
64 2HE LYS 10 2HE LYS 10 11.232 7.210 -1.972
65 1HZ LYS 10 1HZ LYS 10 12.145 5.984 0.004
66 2HZ LYS 10 2HZ LYS 10 10.527 6.162 0.047
67 H CYS 11 H CYS 11 6.852 4.065 -7.200
68 HA CYS 11 HA CYS 11 7.243 1.377 -6.319
69 1HB CYS 11 1HB CYS 11 5.069 2.492 -8.099
70 2HB CYS 11 2HB CYS 11 5.055 0.952 -7.263
71 H ASN 12 H ASN 12 7.540 3.322 -9.304
72 HA ASN 12 HA ASN 12 7.704 1.127 -11.035
73 1HB ASN 12 1HB ASN 12 8.816 3.967 -11.344
74 2HB ASN 12 2HB ASN 12 8.622 2.821 -12.656
75 1HD2 ASN 12 1HD2 ASN 12 7.285 4.381 -13.664
76 2HD2 ASN 12 2HD2 ASN 12 5.619 4.568 -13.229
77 H ASN 13 H ASN 13 10.035 3.146 -9.171
78 HA ASN 13 HA ASN 13 12.320 2.068 -10.388
79 1HB ASN 13 1HB ASN 13 12.098 3.309 -7.599
80 2HB ASN 13 2HB ASN 13 13.544 3.217 -8.584
81 1HD2 ASN 13 1HD2 ASN 13 11.979 5.477 -7.425
82 2HD2 ASN 13 2HD2 ASN 13 11.656 6.564 -8.734
83 H HIS 14 H HIS 14 10.298 1.322 -7.511
84 HA HIS 14 HA HIS 14 12.113 -0.549 -6.408
85 1HB HIS 14 1HB HIS 14 10.654 0.421 -4.875
86 2HB HIS 14 2HB HIS 14 9.256 0.234 -5.915
87 HD1 HIS 14 HD1 HIS 14 11.156 -1.444 -3.213
88 HD2 HIS 14 HD2 HIS 14 8.213 -2.485 -6.016
89 HE1 HIS 14 HE1 HIS 14 10.167 -3.659 -2.423
90 H CYS 15 H CYS 15 9.582 -0.617 -8.882
91 HA CYS 15 HA CYS 15 9.343 -3.462 -8.823
92 1HB CYS 15 1HB CYS 15 8.331 -1.335 -10.710
93 2HB CYS 15 2HB CYS 15 8.083 -3.046 -10.996
94 H LYS 16 H LYS 16 11.298 -0.958 -10.413
95 HA LYS 16 HA LYS 16 12.267 -2.746 -12.445
96 1HB LYS 16 1HB LYS 16 13.017 -0.882 -13.446
97 2HB LYS 16 2HB LYS 16 11.988 -0.046 -12.302
98 1HG LYS 16 1HG LYS 16 14.069 -0.136 -10.695
99 2HG LYS 16 2HG LYS 16 14.987 -0.505 -12.142
100 1HD LYS 16 1HD LYS 16 13.206 1.733 -12.682
101 2HD LYS 16 2HD LYS 16 14.124 2.065 -11.227
102 1HE LYS 16 1HE LYS 16 16.023 0.949 -13.001
103 2HE LYS 16 2HE LYS 16 15.037 1.979 -14.021
104 1HZ LYS 16 1HZ LYS 16 15.439 3.813 -12.463
105 2HZ LYS 16 2HZ LYS 16 16.335 2.857 -11.495
106 H SER 17 H SER 17 13.005 -1.914 -9.127
107 HA SER 17 HA SER 17 15.713 -2.816 -9.367
108 1HB SER 17 1HB SER 17 14.462 -1.055 -7.674
109 2HB SER 17 2HB SER 17 14.487 -2.487 -6.666
110 HG SER 17 HG SER 17 16.912 -1.957 -8.002
111 H ILE 18 H ILE 18 12.516 -3.984 -8.276
112 HA ILE 18 HA ILE 18 13.550 -6.312 -7.000
113 HB ILE 18 HB ILE 18 11.203 -6.977 -6.876
114 1HG1 ILE 18 1HG1 ILE 18 9.567 -5.064 -7.680
115 2HG1 ILE 18 2HG1 ILE 18 10.847 -4.730 -8.830
116 1HG2 ILE 18 1HG2 ILE 18 12.318 -4.480 -5.857
117 2HG2 ILE 18 2HG2 ILE 18 10.540 -4.468 -5.914
118 3HG2 ILE 18 3HG2 ILE 18 11.393 -5.752 -5.024
119 1HD1 ILE 18 1HD1 ILE 18 8.952 -6.980 -8.748
120 2HD1 ILE 18 2HD1 ILE 18 9.938 -6.378 -10.103
121 3HD1 ILE 18 3HD1 ILE 18 10.639 -7.519 -8.930
122 H SER 19 H SER 19 11.821 -5.679 -10.132
123 HA SER 19 HA SER 19 13.241 -6.920 -11.860
124 1HB SER 19 1HB SER 19 12.174 -9.039 -10.023
125 2HB SER 19 2HB SER 19 12.152 -9.404 -11.737
126 HG SER 19 HG SER 19 14.406 -8.841 -10.042
127 H CYS 20 H CYS 20 11.517 -5.153 -12.420
128 HA CYS 20 HA CYS 20 9.472 -6.482 -13.921
129 1HB CYS 20 1HB CYS 20 8.841 -5.118 -11.401
130 2HB CYS 20 2HB CYS 20 7.921 -4.521 -12.768
131 H ARG 21 H ARG 21 8.039 -4.360 -14.870
132 HA ARG 21 HA ARG 21 10.129 -2.792 -16.066
133 1HB ARG 21 1HB ARG 21 7.219 -3.355 -16.705
134 2HB ARG 21 2HB ARG 21 7.985 -1.953 -17.425
135 1HG ARG 21 1HG ARG 21 9.732 -4.291 -17.644
136 2HG ARG 21 2HG ARG 21 8.153 -4.646 -18.316
137 1HD ARG 21 1HD ARG 21 8.407 -3.155 -20.061
138 2HD ARG 21 2HD ARG 21 9.238 -1.971 -19.073
139 HE ARG 21 HE ARG 21 11.068 -4.055 -19.263
140 1HH1 ARG 21 2HH2 ARG 21 9.303 -2.100 -21.633
141 2HH1 ARG 21 1HH2 ARG 21 10.532 -2.235 -22.845
142 1HH2 ARG 21 HH1 ARG 21 12.515 -3.494 -22.370
143 H ALA 22 H ALA 22 6.805 -2.205 -14.680
144 HA ALA 22 HA ALA 22 7.663 -0.136 -12.997
145 1HB ALA 22 1HB ALA 22 8.026 1.108 -15.075
146 2HB ALA 22 2HB ALA 22 6.373 0.729 -15.616
147 3HB ALA 22 3HB ALA 22 6.628 1.781 -14.203
148 H GLY 23 H GLY 23 5.960 0.509 -11.597
149 1HA GLY 23 1HA GLY 23 3.403 -0.897 -12.093
150 2HA GLY 23 2HA GLY 23 4.165 -0.775 -10.520
151 H TYR 24 H TYR 24 1.619 0.117 -10.592
152 HA TYR 24 HA TYR 24 1.978 3.009 -10.370
153 1HB TYR 24 1HB TYR 24 -0.183 3.280 -11.602
154 2HB TYR 24 2HB TYR 24 0.943 2.395 -12.611
155 HD1 TYR 24 HD1 TYR 24 0.219 0.438 -13.640
156 HD2 TYR 24 HD2 TYR 24 -1.751 1.754 -10.078
157 HE1 TYR 24 HE1 TYR 24 -1.478 -1.441 -13.876
158 HE2 TYR 24 HE2 TYR 24 -3.441 -0.129 -10.326
159 HH TYR 24 HH TYR 24 -4.348 -1.515 -12.057
160 H CYS 25 H CYS 25 0.525 4.023 -8.861
161 HA CYS 25 HA CYS 25 -0.236 2.244 -6.770
162 1HB CYS 25 1HB CYS 25 -0.788 5.207 -6.978
163 2HB CYS 25 2HB CYS 25 -0.800 4.222 -5.530
164 H ASP 26 H ASP 26 -2.200 1.213 -6.648
165 HA ASP 26 HA ASP 26 -4.070 1.096 -8.445
166 1HB ASP 26 1HB ASP 26 -3.913 0.545 -5.653
167 2HB ASP 26 2HB ASP 26 -5.437 1.383 -5.875
168 HD2 ASP 26 HD2 ASP 26 -6.647 -1.121 -5.651
169 H ALA 27 H ALA 27 -4.959 2.826 -9.611
170 HA ALA 27 HA ALA 27 -5.410 5.357 -8.393
171 1HB ALA 27 1HB ALA 27 -6.604 5.675 -10.709
172 2HB ALA 27 2HB ALA 27 -4.838 5.463 -10.658
173 3HB ALA 27 3HB ALA 27 -5.887 4.091 -11.092
174 H ALA 28 H ALA 28 -6.984 2.449 -8.019
175 HA ALA 28 HA ALA 28 -9.613 3.748 -7.827
176 1HB ALA 28 1HB ALA 28 -10.034 1.964 -9.210
177 2HB ALA 28 2HB ALA 28 -8.667 1.014 -8.581
178 3HB ALA 28 3HB ALA 28 -10.180 1.118 -7.651
179 H THR 29 H THR 29 -6.967 3.318 -5.999
180 HA THR 29 HA THR 29 -8.573 2.756 -3.601
181 HB THR 29 HB THR 29 -6.859 0.907 -4.607
182 HG1 THR 29 HG1 THR 29 -7.003 1.837 -1.825
183 1HG2 THR 29 1HG2 THR 29 -4.919 2.627 -4.352
184 2HG2 THR 29 2HG2 THR 29 -5.159 2.452 -2.597
185 3HG2 THR 29 3HG2 THR 29 -4.686 1.043 -3.576
186 H LEU 30 H LEU 30 -7.444 5.202 -5.198
187 HA LEU 30 HA LEU 30 -6.934 7.259 -4.512
188 1HB LEU 30 1HB LEU 30 -6.291 6.256 -1.750
189 2HB LEU 30 2HB LEU 30 -6.738 7.875 -2.249
190 HG LEU 30 HG LEU 30 -8.567 5.457 -2.246
191 1HD1 LEU 30 1HD1 LEU 30 -8.563 7.882 -0.427
192 2HD1 LEU 30 2HD1 LEU 30 -9.688 6.504 -0.371
193 3HD1 LEU 30 3HD1 LEU 30 -7.967 6.262 0.009
194 1HD2 LEU 30 1HD2 LEU 30 -9.796 6.585 -3.716
195 2HD2 LEU 30 2HD2 LEU 30 -10.112 7.767 -2.424
196 3HD2 LEU 30 3HD2 LEU 30 -8.777 8.036 -3.570
197 H TRP 31 H TRP 31 -5.122 4.978 -5.453
198 HA TRP 31 HA TRP 31 -2.984 4.666 -5.933
199 1HB TRP 31 1HB TRP 31 -2.906 7.630 -5.379
200 2HB TRP 31 2HB TRP 31 -1.512 6.735 -5.951
201 HD1 TRP 31 HD1 TRP 31 -1.428 6.211 -8.558
202 HE1 TRP 31 HE1 TRP 31 -2.919 6.729 -10.674
203 HE3 TRP 31 HE3 TRP 31 -5.468 7.875 -5.957
204 HZ2 TRP 31 HZ2 TRP 31 -5.560 7.753 -11.014
205 HZ3 TRP 31 HZ3 TRP 31 -7.462 8.616 -7.257
206 HH2 TRP 31 HH2 TRP 31 -7.550 8.574 -9.700
207 H LEU 32 H LEU 32 -3.823 3.847 -3.373
208 HA LEU 32 HA LEU 32 -1.731 4.756 -1.559
209 1HB LEU 32 1HB LEU 32 -3.754 4.795 -0.467
210 2HB LEU 32 2HB LEU 32 -4.354 3.358 -1.270
211 HG LEU 32 HG LEU 32 -3.136 1.908 0.138
212 1HD1 LEU 32 1HD1 LEU 32 -1.706 3.739 1.862
213 2HD1 LEU 32 2HD1 LEU 32 -1.114 2.329 0.952
214 3HD1 LEU 32 3HD1 LEU 32 -1.196 3.924 0.166
215 1HD2 LEU 32 1HD2 LEU 32 -3.897 2.474 2.365
216 2HD2 LEU 32 2HD2 LEU 32 -4.076 4.184 1.904
217 3HD2 LEU 32 3HD2 LEU 32 -5.125 2.949 1.168
218 H ARG 33 H ARG 33 -2.779 1.998 -3.540
219 HA ARG 33 HA ARG 33 -0.840 0.299 -2.303
220 1HB ARG 33 1HB ARG 33 -3.216 -0.265 -3.452
221 2HB ARG 33 2HB ARG 33 -2.228 -0.418 -4.891
222 1HG ARG 33 1HG ARG 33 -1.239 -2.358 -4.168
223 2HG ARG 33 2HG ARG 33 -1.065 -1.777 -2.524
224 1HD ARG 33 1HD ARG 33 -3.750 -2.055 -2.521
225 2HD ARG 33 2HD ARG 33 -3.396 -3.206 -3.794
226 HE ARG 33 HE ARG 33 -2.618 -4.664 -2.155
227 1HH1 ARG 33 2HH2 ARG 33 -2.273 -1.358 -0.930
228 2HH1 ARG 33 1HH2 ARG 33 -1.679 -1.860 0.618
229 1HH2 ARG 33 HH1 ARG 33 -1.431 -4.200 1.076
230 H CYS 34 H CYS 34 0.276 -1.159 -4.386
231 HA CYS 34 HA CYS 34 1.291 0.630 -6.380
232 1HB CYS 34 1HB CYS 34 2.901 -0.095 -3.993
233 2HB CYS 34 2HB CYS 34 3.707 -0.213 -5.545
234 H THR 35 H THR 35 0.498 -0.856 -7.924
235 HA THR 35 HA THR 35 1.342 -3.645 -7.639
236 HB THR 35 HB THR 35 -1.075 -2.435 -8.341
237 HG1 THR 35 HG1 THR 35 0.094 -4.990 -9.195
238 1HG2 THR 35 1HG2 THR 35 0.232 -3.612 -10.849
239 2HG2 THR 35 2HG2 THR 35 -1.451 -3.054 -10.696
240 3HG2 THR 35 3HG2 THR 35 -0.114 -1.881 -10.627
241 H CYS 36 H CYS 36 2.907 -4.566 -8.829
242 HA CYS 36 HA CYS 36 4.369 -2.814 -10.577
243 1HB CYS 36 1HB CYS 36 4.854 -5.632 -9.604
244 2HB CYS 36 2HB CYS 36 5.894 -4.828 -10.765
245 H THR 37 H THR 37 3.875 -2.663 -12.737
246 HA THR 37 HA THR 37 2.520 -4.976 -13.961
247 HB THR 37 HB THR 37 1.329 -3.359 -15.327
248 HG1 THR 37 HG1 THR 37 3.017 -1.383 -13.975
249 1HG2 THR 37 1HG2 THR 37 1.148 -1.470 -13.165
250 2HG2 THR 37 2HG2 THR 37 -0.016 -2.749 -13.586
251 3HG2 THR 37 3HG2 THR 37 1.302 -3.088 -12.437
252 H ASP 38 H ASP 38 3.159 -5.692 -16.015
253 HA ASP 38 HA ASP 38 4.558 -6.150 -17.605
254 1HB ASP 38 1HB ASP 38 5.270 -3.235 -17.163
255 2HB ASP 38 2HB ASP 38 6.215 -4.188 -18.289
256 HD2 ASP 38 HD2 ASP 38 3.809 -5.418 -19.853
257 H CYS 39 H CYS 39 6.435 -7.426 -17.493
258 HA CYS 39 HA CYS 39 8.638 -6.496 -15.870
259 1HB CYS 39 1HB CYS 39 7.426 -9.212 -15.337
260 2HB CYS 39 2HB CYS 39 8.800 -8.484 -14.531
261 H ASN 40 H ASN 40 10.634 -7.751 -16.386
262 HA ASN 40 HA ASN 40 10.404 -8.845 -19.057
263 1HB ASN 40 1HB ASN 40 12.910 -8.557 -19.097
264 2HB ASN 40 2HB ASN 40 12.073 -7.054 -18.761
265 1HD2 ASN 40 1HD2 ASN 40 14.709 -8.627 -17.999
266 2HD2 ASN 40 2HD2 ASN 40 14.938 -8.228 -16.329
267 H GLY 41 H GLY 41 9.465 -10.906 -18.063
268 1HA GLY 41 1HA GLY 41 10.003 -13.153 -17.886
269 2HA GLY 41 2HA GLY 41 11.627 -12.746 -17.367
270 H LYS 42 H LYS 42 8.163 -12.562 -16.319
271 HA LYS 42 HA LYS 42 8.626 -13.769 -13.873
272 1HB LYS 42 1HB LYS 42 9.773 -11.312 -13.750
273 2HB LYS 42 2HB LYS 42 8.151 -10.913 -13.224
274 1HG LYS 42 1HG LYS 42 8.407 -11.990 -11.228
275 2HG LYS 42 2HG LYS 42 9.122 -13.403 -11.980
276 1HD LYS 42 1HD LYS 42 11.172 -11.604 -12.302
277 2HD LYS 42 2HD LYS 42 10.453 -10.984 -10.829
278 1HE LYS 42 1HE LYS 42 10.758 -13.946 -10.878
279 2HE LYS 42 2HE LYS 42 12.275 -13.069 -10.943
280 1HZ LYS 42 1HZ LYS 42 10.250 -13.031 -8.810
281 2HZ LYS 42 2HZ LYS 42 11.866 -13.184 -8.676
282 H LYS 43 H LYS 43 6.656 -14.284 -12.903
283 HA LYS 43 HA LYS 43 4.320 -12.782 -13.321
284 1HB LYS 43 1HB LYS 43 5.023 -14.451 -15.518
285 2HB LYS 43 2HB LYS 43 3.661 -15.206 -14.714
286 1HG LYS 43 1HG LYS 43 2.221 -13.446 -15.177
287 2HG LYS 43 2HG LYS 43 3.483 -12.236 -15.065
288 1HD LYS 43 1HD LYS 43 3.331 -12.187 -17.349
289 2HD LYS 43 2HD LYS 43 4.341 -13.617 -17.278
290 1HE LYS 43 1HE LYS 43 2.543 -15.087 -17.666
291 2HE LYS 43 2HE LYS 43 1.352 -13.972 -17.025
292 1HZ LYS 43 1HZ LYS 43 1.767 -12.552 -19.012
293 2HZ LYS 43 2HZ LYS 43 2.765 -13.686 -19.622
Start of MODEL 6
1 1H GLY 1 H GLY 1 2.249 -0.947 -0.950
2 1HA GLY 1 1HA GLY 1 2.182 1.615 -2.428
3 2HA GLY 1 2HA GLY 1 1.427 1.412 -0.859
4 H PHE 2 H PHE 2 4.621 0.816 -2.498
5 HA PHE 2 HA PHE 2 6.090 0.818 -0.117
6 1HB PHE 2 1HB PHE 2 6.502 0.209 -2.755
7 2HB PHE 2 2HB PHE 2 7.195 1.818 -2.764
8 HD1 PHE 2 HD1 PHE 2 9.309 2.260 -1.736
9 HD2 PHE 2 HD2 PHE 2 7.508 -1.563 -1.340
10 HE1 PHE 2 HE1 PHE 2 11.467 1.335 -0.849
11 HE2 PHE 2 HE2 PHE 2 9.667 -2.487 -0.453
12 HZ PHE 2 HZ PHE 2 11.620 -1.028 -0.219
13 H GLY 3 H GLY 3 5.310 3.412 -2.513
14 1HA GLY 3 1HA GLY 3 6.435 5.368 -0.599
15 2HA GLY 3 2HA GLY 3 6.465 5.553 -2.341
16 H CYS 4 H CYS 4 3.725 4.410 -2.742
17 HA CYS 4 HA CYS 4 2.306 6.802 -2.563
18 1HB CYS 4 1HB CYS 4 1.160 4.028 -2.916
19 2HB CYS 4 2HB CYS 4 0.407 5.545 -3.362
20 HA PRO 5 HA PRO 5 0.221 7.203 -2.444
21 1HB PRO 5 1HB PRO 5 -1.061 9.259 -1.179
22 2HB PRO 5 2HB PRO 5 -1.852 7.755 -1.608
23 1HG PRO 5 1HG PRO 5 -0.952 8.682 1.050
24 2HG PRO 5 2HG PRO 5 -2.098 7.415 0.660
25 1HD PRO 5 1HD PRO 5 0.620 7.069 1.510
26 2HD PRO 5 2HD PRO 5 -0.490 5.809 1.009
27 H GLY 6 H GLY 6 0.695 9.228 -3.534
28 1HA GLY 6 1HA GLY 6 1.992 11.043 -3.899
29 2HA GLY 6 2HA GLY 6 2.418 11.076 -2.200
30 H ASN 7 H ASN 7 2.891 8.665 -4.890
31 HA ASN 7 HA ASN 7 5.576 9.105 -5.173
32 1HB ASN 7 1HB ASN 7 5.066 7.778 -2.718
33 2HB ASN 7 2HB ASN 7 5.557 6.493 -3.803
34 1HD2 ASN 7 1HD2 ASN 7 7.016 7.336 -1.576
35 2HD2 ASN 7 2HD2 ASN 7 8.528 8.008 -2.086
36 H GLN 8 H GLN 8 4.487 8.740 -7.321
37 HA GLN 8 HA GLN 8 3.628 6.033 -7.801
38 1HB GLN 8 1HB GLN 8 2.897 8.574 -8.819
39 2HB GLN 8 2HB GLN 8 3.678 7.757 -10.159
40 1HG GLN 8 1HG GLN 8 2.166 5.696 -9.395
41 2HG GLN 8 2HG GLN 8 1.202 6.940 -8.624
42 1HE2 GLN 8 1HE2 GLN 8 2.307 5.562 -11.601
43 2HE2 GLN 8 2HE2 GLN 8 1.281 6.432 -12.691
44 H LEU 9 H LEU 9 6.488 7.934 -7.967
45 HA LEU 9 HA LEU 9 7.598 6.437 -10.191
46 1HB LEU 9 1HB LEU 9 9.340 7.966 -10.187
47 2HB LEU 9 2HB LEU 9 7.912 8.916 -9.828
48 HG LEU 9 HG LEU 9 9.357 7.944 -7.444
49 1HD1 LEU 9 1HD1 LEU 9 10.660 10.103 -9.112
50 2HD1 LEU 9 2HD1 LEU 9 11.246 9.374 -7.597
51 3HD1 LEU 9 3HD1 LEU 9 11.205 8.409 -9.093
52 1HD2 LEU 9 1HD2 LEU 9 8.846 10.823 -7.887
53 2HD2 LEU 9 2HD2 LEU 9 7.411 9.770 -7.898
54 3HD2 LEU 9 3HD2 LEU 9 8.490 9.787 -6.484
55 H LYS 10 H LYS 10 7.548 6.511 -6.653
56 HA LYS 10 HA LYS 10 9.888 4.989 -6.268
57 1HB LYS 10 1HB LYS 10 7.625 5.978 -4.644
58 2HB LYS 10 2HB LYS 10 8.359 4.499 -4.057
59 1HG LYS 10 1HG LYS 10 10.467 6.311 -4.885
60 2HG LYS 10 2HG LYS 10 9.366 7.180 -3.835
61 1HD LYS 10 1HD LYS 10 9.974 5.974 -1.986
62 2HD LYS 10 2HD LYS 10 9.971 4.453 -2.856
63 1HE LYS 10 1HE LYS 10 12.174 5.531 -3.996
64 2HE LYS 10 2HE LYS 10 12.214 6.430 -2.492
65 1HZ LYS 10 1HZ LYS 10 13.272 4.561 -1.777
66 2HZ LYS 10 2HZ LYS 10 11.774 3.955 -1.579
67 H CYS 11 H CYS 11 6.568 4.230 -7.206
68 HA CYS 11 HA CYS 11 6.689 1.506 -6.478
69 1HB CYS 11 1HB CYS 11 4.908 2.991 -8.419
70 2HB CYS 11 2HB CYS 11 4.710 1.301 -8.002
71 H ASN 12 H ASN 12 7.338 3.447 -9.455
72 HA ASN 12 HA ASN 12 7.731 1.299 -11.144
73 1HB ASN 12 1HB ASN 12 7.467 3.635 -11.944
74 2HB ASN 12 2HB ASN 12 8.966 4.103 -11.167
75 1HD2 ASN 12 1HD2 ASN 12 9.262 4.820 -13.471
76 2HD2 ASN 12 2HD2 ASN 12 10.047 3.730 -14.563
77 H ASN 13 H ASN 13 10.102 3.420 -9.355
78 HA ASN 13 HA ASN 13 12.390 2.209 -10.103
79 1HB ASN 13 1HB ASN 13 11.865 3.113 -7.232
80 2HB ASN 13 2HB ASN 13 13.387 3.170 -8.096
81 1HD2 ASN 13 1HD2 ASN 13 12.128 5.335 -6.795
82 2HD2 ASN 13 2HD2 ASN 13 11.735 6.551 -7.965
83 H HIS 14 H HIS 14 10.058 1.317 -7.490
84 HA HIS 14 HA HIS 14 11.588 -0.684 -6.318
85 1HB HIS 14 1HB HIS 14 9.601 0.374 -5.308
86 2HB HIS 14 2HB HIS 14 8.575 -0.414 -6.489
87 HD1 HIS 14 HD1 HIS 14 10.979 -1.339 -3.661
88 HD2 HIS 14 HD2 HIS 14 7.717 -2.926 -5.766
89 HE1 HIS 14 HE1 HIS 14 10.354 -3.512 -2.479
90 H CYS 15 H CYS 15 8.994 -0.875 -8.854
91 HA CYS 15 HA CYS 15 9.026 -3.567 -9.234
92 1HB CYS 15 1HB CYS 15 8.742 -1.506 -11.428
93 2HB CYS 15 2HB CYS 15 8.143 -3.152 -11.447
94 H LYS 16 H LYS 16 11.262 -1.020 -10.437
95 HA LYS 16 HA LYS 16 12.689 -2.739 -12.173
96 1HB LYS 16 1HB LYS 16 13.867 -0.250 -10.973
97 2HB LYS 16 2HB LYS 16 14.055 -0.904 -12.587
98 1HG LYS 16 1HG LYS 16 11.259 -0.442 -12.267
99 2HG LYS 16 2HG LYS 16 12.050 0.967 -11.589
100 1HD LYS 16 1HD LYS 16 12.758 -0.173 -14.330
101 2HD LYS 16 2HD LYS 16 11.549 1.075 -14.103
102 1HE LYS 16 1HE LYS 16 13.124 2.699 -13.497
103 2HE LYS 16 2HE LYS 16 14.249 1.525 -12.845
104 1HZ LYS 16 1HZ LYS 16 14.741 0.818 -15.134
105 2HZ LYS 16 2HZ LYS 16 13.696 1.911 -15.739
106 H SER 17 H SER 17 12.764 -2.037 -8.704
107 HA SER 17 HA SER 17 15.361 -2.987 -8.280
108 1HB SER 17 1HB SER 17 13.642 -1.604 -6.758
109 2HB SER 17 2HB SER 17 13.236 -3.197 -6.152
110 HG SER 17 HG SER 17 15.654 -1.720 -5.897
111 H ILE 18 H ILE 18 12.092 -4.483 -8.313
112 HA ILE 18 HA ILE 18 13.117 -7.022 -7.432
113 HB ILE 18 HB ILE 18 10.940 -7.688 -7.280
114 1HG1 ILE 18 1HG1 ILE 18 10.509 -6.022 -9.718
115 2HG1 ILE 18 2HG1 ILE 18 10.031 -7.674 -9.384
116 1HG2 ILE 18 1HG2 ILE 18 10.477 -4.706 -7.168
117 2HG2 ILE 18 2HG2 ILE 18 9.733 -5.990 -6.184
118 3HG2 ILE 18 3HG2 ILE 18 11.449 -5.574 -5.955
119 1HD1 ILE 18 1HD1 ILE 18 8.778 -5.198 -8.108
120 2HD1 ILE 18 2HD1 ILE 18 8.066 -6.153 -9.431
121 3HD1 ILE 18 3HD1 ILE 18 8.276 -6.881 -7.821
122 H SER 19 H SER 19 12.794 -5.251 -10.413
123 HA SER 19 HA SER 19 13.705 -5.815 -12.355
124 1HB SER 19 1HB SER 19 13.546 -8.785 -11.763
125 2HB SER 19 2HB SER 19 14.619 -7.953 -12.871
126 HG SER 19 HG SER 19 15.580 -6.905 -10.914
127 H CYS 20 H CYS 20 11.321 -5.012 -12.567
128 HA CYS 20 HA CYS 20 9.793 -7.145 -13.871
129 1HB CYS 20 1HB CYS 20 9.005 -5.329 -11.730
130 2HB CYS 20 2HB CYS 20 7.939 -5.216 -13.116
131 H ARG 21 H ARG 21 8.948 -3.675 -13.617
132 HA ARG 21 HA ARG 21 10.234 -2.916 -15.975
133 1HB ARG 21 1HB ARG 21 8.361 -4.407 -16.890
134 2HB ARG 21 2HB ARG 21 7.206 -3.266 -16.231
135 1HG ARG 21 1HG ARG 21 7.853 -2.957 -18.713
136 2HG ARG 21 2HG ARG 21 7.887 -1.524 -17.708
137 1HD ARG 21 1HD ARG 21 10.251 -1.461 -17.629
138 2HD ARG 21 2HD ARG 21 10.414 -3.172 -17.976
139 HE ARG 21 HE ARG 21 10.168 -2.729 -20.289
140 1HH1 ARG 21 2HH2 ARG 21 9.514 0.201 -18.407
141 2HH1 ARG 21 1HH2 ARG 21 9.541 1.244 -19.790
142 1HH2 ARG 21 HH1 ARG 21 9.950 0.308 -21.958
143 H ALA 22 H ALA 22 6.939 -2.306 -14.531
144 HA ALA 22 HA ALA 22 7.714 -0.048 -13.084
145 1HB ALA 22 1HB ALA 22 6.157 0.824 -15.501
146 2HB ALA 22 2HB ALA 22 7.251 1.758 -14.453
147 3HB ALA 22 3HB ALA 22 7.919 0.627 -15.653
148 H GLY 23 H GLY 23 6.024 0.576 -11.718
149 1HA GLY 23 1HA GLY 23 3.447 -0.795 -12.215
150 2HA GLY 23 2HA GLY 23 4.187 -0.641 -10.635
151 H TYR 24 H TYR 24 2.013 0.384 -10.122
152 HA TYR 24 HA TYR 24 2.319 3.227 -10.191
153 1HB TYR 24 1HB TYR 24 0.105 3.537 -11.375
154 2HB TYR 24 2HB TYR 24 1.255 2.721 -12.417
155 HD1 TYR 24 HD1 TYR 24 -1.424 1.902 -9.917
156 HD2 TYR 24 HD2 TYR 24 0.569 0.804 -13.540
157 HE1 TYR 24 HE1 TYR 24 -3.071 -0.004 -10.253
158 HE2 TYR 24 HE2 TYR 24 -1.085 -1.099 -13.864
159 HH TYR 24 HH TYR 24 -2.769 -2.414 -11.668
160 H CYS 25 H CYS 25 0.402 4.299 -9.007
161 HA CYS 25 HA CYS 25 -0.155 2.639 -6.721
162 1HB CYS 25 1HB CYS 25 -0.959 5.517 -7.164
163 2HB CYS 25 2HB CYS 25 -0.892 4.646 -5.645
164 H ASP 26 H ASP 26 -1.989 1.389 -6.669
165 HA ASP 26 HA ASP 26 -3.821 1.133 -8.529
166 1HB ASP 26 1HB ASP 26 -3.584 0.430 -5.785
167 2HB ASP 26 2HB ASP 26 -5.186 1.123 -5.936
168 HD2 ASP 26 HD2 ASP 26 -6.688 -0.101 -6.852
169 H ALA 27 H ALA 27 -4.670 2.987 -9.594
170 HA ALA 27 HA ALA 27 -5.444 5.326 -8.265
171 1HB ALA 27 1HB ALA 27 -4.926 5.491 -10.563
172 2HB ALA 27 2HB ALA 27 -5.978 4.121 -10.992
173 3HB ALA 27 3HB ALA 27 -6.696 5.676 -10.508
174 H ALA 28 H ALA 28 -6.837 2.199 -8.300
175 HA ALA 28 HA ALA 28 -9.546 3.215 -7.958
176 1HB ALA 28 1HB ALA 28 -9.931 1.302 -9.085
177 2HB ALA 28 2HB ALA 28 -8.271 0.722 -8.808
178 3HB ALA 28 3HB ALA 28 -9.528 0.444 -7.578
179 H THR 29 H THR 29 -6.796 2.965 -6.108
180 HA THR 29 HA THR 29 -8.394 2.463 -3.686
181 HB THR 29 HB THR 29 -6.568 0.685 -4.596
182 HG1 THR 29 HG1 THR 29 -7.123 0.055 -2.549
183 1HG2 THR 29 1HG2 THR 29 -4.377 1.179 -4.114
184 2HG2 THR 29 2HG2 THR 29 -4.896 2.881 -4.077
185 3HG2 THR 29 3HG2 THR 29 -4.817 1.942 -2.568
186 H LEU 30 H LEU 30 -7.629 4.949 -5.292
187 HA LEU 30 HA LEU 30 -7.112 7.037 -4.795
188 1HB LEU 30 1HB LEU 30 -6.822 6.155 -1.922
189 2HB LEU 30 2HB LEU 30 -7.044 7.792 -2.506
190 HG LEU 30 HG LEU 30 -9.074 5.552 -2.733
191 1HD1 LEU 30 1HD1 LEU 30 -9.982 7.763 -1.167
192 2HD1 LEU 30 2HD1 LEU 30 -9.752 6.065 -0.687
193 3HD1 LEU 30 3HD1 LEU 30 -8.408 7.223 -0.535
194 1HD2 LEU 30 1HD2 LEU 30 -9.639 6.854 -4.530
195 2HD2 LEU 30 2HD2 LEU 30 -10.552 7.674 -3.241
196 3HD2 LEU 30 3HD2 LEU 30 -9.001 8.346 -3.798
197 H TRP 31 H TRP 31 -5.142 5.249 -5.795
198 HA TRP 31 HA TRP 31 -2.938 4.884 -5.913
199 1HB TRP 31 1HB TRP 31 -3.001 7.868 -5.431
200 2HB TRP 31 2HB TRP 31 -1.607 6.986 -6.024
201 HD1 TRP 31 HD1 TRP 31 -1.495 6.670 -8.634
202 HE1 TRP 31 HE1 TRP 31 -3.056 7.075 -10.723
203 HE3 TRP 31 HE3 TRP 31 -5.676 7.768 -5.956
204 HZ2 TRP 31 HZ2 TRP 31 -5.803 7.791 -11.014
205 HZ3 TRP 31 HZ3 TRP 31 -7.755 8.310 -7.220
206 HH2 TRP 31 HH2 TRP 31 -7.862 8.332 -9.662
207 H LEU 32 H LEU 32 -3.128 3.583 -3.833
208 HA LEU 32 HA LEU 32 -1.508 4.885 -1.759
209 1HB LEU 32 1HB LEU 32 -3.557 4.846 -0.726
210 2HB LEU 32 2HB LEU 32 -4.071 3.376 -1.530
211 HG LEU 32 HG LEU 32 -2.729 2.007 -0.087
212 1HD1 LEU 32 1HD1 LEU 32 -0.985 4.089 0.056
213 2HD1 LEU 32 2HD1 LEU 32 -1.736 4.158 1.668
214 3HD1 LEU 32 3HD1 LEU 32 -0.950 2.659 1.116
215 1HD2 LEU 32 1HD2 LEU 32 -4.606 3.977 1.069
216 2HD2 LEU 32 2HD2 LEU 32 -4.622 2.198 1.116
217 3HD2 LEU 32 3HD2 LEU 32 -3.582 3.108 2.237
218 H ARG 33 H ARG 33 -2.545 1.852 -3.406
219 HA ARG 33 HA ARG 33 -0.467 0.381 -2.170
220 1HB ARG 33 1HB ARG 33 -2.787 -0.152 -3.842
221 2HB ARG 33 2HB ARG 33 -1.397 -0.961 -4.537
222 1HG ARG 33 1HG ARG 33 -0.958 -2.187 -2.506
223 2HG ARG 33 2HG ARG 33 -2.031 -1.168 -1.567
224 1HD ARG 33 1HD ARG 33 -3.980 -2.013 -2.941
225 2HD ARG 33 2HD ARG 33 -2.886 -3.087 -3.789
226 HE ARG 33 HE ARG 33 -2.851 -4.498 -1.920
227 1HH1 ARG 33 2HH2 ARG 33 -4.131 -1.341 -0.945
228 2HH1 ARG 33 1HH2 ARG 33 -4.582 -1.874 0.640
229 1HH2 ARG 33 HH1 ARG 33 -4.169 -4.147 1.275
230 H CYS 34 H CYS 34 0.877 -1.092 -3.975
231 HA CYS 34 HA CYS 34 1.855 0.723 -6.033
232 1HB CYS 34 1HB CYS 34 3.355 -0.213 -3.676
233 2HB CYS 34 2HB CYS 34 4.179 -0.454 -5.204
234 H THR 35 H THR 35 0.718 -0.669 -7.534
235 HA THR 35 HA THR 35 1.446 -3.490 -7.522
236 HB THR 35 HB THR 35 -0.856 -1.942 -8.192
237 HG1 THR 35 HG1 THR 35 -1.276 -4.028 -7.557
238 1HG2 THR 35 1HG2 THR 35 -0.127 -1.645 -10.505
239 2HG2 THR 35 2HG2 THR 35 0.458 -3.324 -10.585
240 3HG2 THR 35 3HG2 THR 35 -1.288 -2.994 -10.489
241 H CYS 36 H CYS 36 3.031 -4.357 -8.701
242 HA CYS 36 HA CYS 36 4.434 -2.597 -10.502
243 1HB CYS 36 1HB CYS 36 4.994 -5.272 -9.270
244 2HB CYS 36 2HB CYS 36 5.882 -4.777 -10.697
245 H THR 37 H THR 37 4.053 -2.585 -12.696
246 HA THR 37 HA THR 37 2.640 -4.920 -13.808
247 HB THR 37 HB THR 37 1.862 -3.031 -15.489
248 HG1 THR 37 HG1 THR 37 1.923 -0.949 -14.274
249 1HG2 THR 37 1HG2 THR 37 0.846 -3.830 -12.860
250 2HG2 THR 37 2HG2 THR 37 0.489 -2.114 -13.172
251 3HG2 THR 37 3HG2 THR 37 -0.070 -3.361 -14.312
252 H ASP 38 H ASP 38 3.154 -5.539 -15.996
253 HA ASP 38 HA ASP 38 4.519 -6.013 -17.611
254 1HB ASP 38 1HB ASP 38 5.344 -3.183 -16.999
255 2HB ASP 38 2HB ASP 38 6.418 -4.117 -18.022
256 HD2 ASP 38 HD2 ASP 38 2.866 -2.964 -18.352
257 H CYS 39 H CYS 39 6.182 -7.538 -17.472
258 HA CYS 39 HA CYS 39 8.514 -6.901 -15.893
259 1HB CYS 39 1HB CYS 39 6.951 -9.418 -15.300
260 2HB CYS 39 2HB CYS 39 8.440 -8.890 -14.542
261 H ASN 40 H ASN 40 10.327 -8.353 -16.472
262 HA ASN 40 HA ASN 40 9.974 -9.329 -19.146
263 1HB ASN 40 1HB ASN 40 12.005 -7.950 -18.150
264 2HB ASN 40 2HB ASN 40 12.547 -9.494 -17.524
265 1HD2 ASN 40 1HD2 ASN 40 14.040 -8.058 -19.312
266 2HD2 ASN 40 2HD2 ASN 40 14.125 -8.871 -20.839
267 H GLY 41 H GLY 41 8.515 -11.158 -18.276
268 1HA GLY 41 1HA GLY 41 9.219 -13.605 -18.472
269 2HA GLY 41 2HA GLY 41 10.053 -13.305 -16.960
270 H LYS 42 H LYS 42 6.794 -12.984 -18.519
271 HA LYS 42 HA LYS 42 5.643 -13.907 -15.999
272 1HB LYS 42 1HB LYS 42 3.976 -12.204 -15.960
273 2HB LYS 42 2HB LYS 42 5.534 -11.410 -16.069
274 1HG LYS 42 1HG LYS 42 4.091 -12.062 -18.640
275 2HG LYS 42 2HG LYS 42 3.497 -10.723 -17.678
276 1HD LYS 42 1HD LYS 42 5.442 -9.451 -17.976
277 2HD LYS 42 2HD LYS 42 6.464 -10.858 -18.187
278 1HE LYS 42 1HE LYS 42 4.394 -9.896 -20.220
279 2HE LYS 42 2HE LYS 42 6.113 -9.574 -20.322
280 1HZ LYS 42 1HZ LYS 42 5.532 -11.525 -21.633
281 2HZ LYS 42 2HZ LYS 42 6.488 -11.997 -20.402
282 H LYS 43 H LYS 43 3.419 -14.800 -16.303
283 HA LYS 43 HA LYS 43 2.030 -16.174 -17.328
284 1HB LYS 43 1HB LYS 43 2.606 -14.160 -19.459
285 2HB LYS 43 2HB LYS 43 1.751 -15.616 -19.927
286 1HG LYS 43 1HG LYS 43 -0.154 -14.699 -19.112
287 2HG LYS 43 2HG LYS 43 0.524 -14.818 -17.500
288 1HD LYS 43 1HD LYS 43 1.785 -12.542 -18.542
289 2HD LYS 43 2HD LYS 43 0.171 -12.436 -19.218
290 1HE LYS 43 1HE LYS 43 -0.112 -13.224 -16.463
291 2HE LYS 43 2HE LYS 43 1.025 -11.891 -16.505
292 1HZ LYS 43 1HZ LYS 43 -0.568 -10.480 -17.396
293 2HZ LYS 43 2HZ LYS 43 -1.449 -11.666 -18.081
Start of MODEL 7
1 1H GLY 1 H GLY 1 3.641 -0.764 1.888
2 1HA GLY 1 1HA GLY 1 2.664 1.707 0.631
3 2HA GLY 1 2HA GLY 1 3.398 1.791 2.220
4 H PHE 2 H PHE 2 3.971 0.686 -1.171
5 HA PHE 2 HA PHE 2 6.799 0.477 -0.696
6 1HB PHE 2 1HB PHE 2 4.914 0.314 -3.118
7 2HB PHE 2 2HB PHE 2 6.644 0.088 -3.280
8 HD1 PHE 2 HD1 PHE 2 7.730 -1.906 -2.368
9 HD2 PHE 2 HD2 PHE 2 3.528 -1.382 -2.087
10 HE1 PHE 2 HE1 PHE 2 7.464 -4.340 -1.817
11 HE2 PHE 2 HE2 PHE 2 3.261 -3.817 -1.536
12 HZ PHE 2 HZ PHE 2 5.232 -5.266 -1.409
13 H GLY 3 H GLY 3 5.001 3.128 -0.656
14 1HA GLY 3 1HA GLY 3 6.769 5.047 -1.005
15 2HA GLY 3 2HA GLY 3 6.427 4.679 -2.684
16 H CYS 4 H CYS 4 3.660 4.023 -2.566
17 HA CYS 4 HA CYS 4 2.599 6.663 -2.372
18 1HB CYS 4 1HB CYS 4 1.852 4.135 -3.592
19 2HB CYS 4 2HB CYS 4 0.483 4.887 -2.796
20 HA PRO 5 HA PRO 5 0.348 7.000 -2.347
21 1HB PRO 5 1HB PRO 5 -1.015 8.991 -1.064
22 2HB PRO 5 2HB PRO 5 -1.753 7.473 -1.534
23 1HG PRO 5 1HG PRO 5 -0.923 8.374 1.156
24 2HG PRO 5 2HG PRO 5 -2.024 7.080 0.722
25 1HD PRO 5 1HD PRO 5 0.690 6.800 1.609
26 2HD PRO 5 2HD PRO 5 -0.374 5.518 1.065
27 H GLY 6 H GLY 6 0.849 8.988 -3.434
28 1HA GLY 6 1HA GLY 6 2.048 10.904 -3.692
29 2HA GLY 6 2HA GLY 6 2.514 10.856 -2.003
30 H ASN 7 H ASN 7 2.973 8.674 -4.887
31 HA ASN 7 HA ASN 7 5.541 9.114 -5.379
32 1HB ASN 7 1HB ASN 7 5.313 7.846 -2.766
33 2HB ASN 7 2HB ASN 7 6.108 6.732 -3.861
34 1HD2 ASN 7 1HD2 ASN 7 7.574 8.165 -5.506
35 2HD2 ASN 7 2HD2 ASN 7 8.765 9.127 -4.696
36 H GLN 8 H GLN 8 4.364 8.399 -7.356
37 HA GLN 8 HA GLN 8 3.634 5.611 -7.417
38 1HB GLN 8 1HB GLN 8 2.094 7.277 -8.403
39 2HB GLN 8 2HB GLN 8 3.347 7.820 -9.501
40 1HG GLN 8 1HG GLN 8 3.255 5.017 -9.872
41 2HG GLN 8 2HG GLN 8 1.575 5.489 -9.716
42 1HE2 GLN 8 1HE2 GLN 8 0.563 6.372 -11.372
43 2HE2 GLN 8 2HE2 GLN 8 1.284 6.927 -12.846
44 H LEU 9 H LEU 9 6.168 7.835 -8.491
45 HA LEU 9 HA LEU 9 7.231 6.112 -10.482
46 1HB LEU 9 1HB LEU 9 8.894 7.702 -10.741
47 2HB LEU 9 2HB LEU 9 7.468 8.621 -10.304
48 HG LEU 9 HG LEU 9 9.141 7.867 -8.001
49 1HD1 LEU 9 1HD1 LEU 9 10.858 8.202 -9.795
50 2HD1 LEU 9 2HD1 LEU 9 10.270 9.873 -9.966
51 3HD1 LEU 9 3HD1 LEU 9 10.978 9.333 -8.425
52 1HD2 LEU 9 1HD2 LEU 9 8.260 10.620 -8.867
53 2HD2 LEU 9 2HD2 LEU 9 7.151 9.465 -8.089
54 3HD2 LEU 9 3HD2 LEU 9 8.607 10.019 -7.229
55 H LYS 10 H LYS 10 7.388 6.307 -6.980
56 HA LYS 10 HA LYS 10 9.858 4.941 -6.710
57 1HB LYS 10 1HB LYS 10 8.196 6.374 -5.048
58 2HB LYS 10 2HB LYS 10 7.926 4.733 -4.496
59 1HG LYS 10 1HG LYS 10 10.604 4.595 -4.663
60 2HG LYS 10 2HG LYS 10 10.484 6.337 -4.509
61 1HD LYS 10 1HD LYS 10 8.749 5.538 -2.523
62 2HD LYS 10 2HD LYS 10 9.892 4.210 -2.500
63 1HE LYS 10 1HE LYS 10 11.761 5.693 -2.084
64 2HE LYS 10 2HE LYS 10 10.809 7.115 -2.461
65 1HZ LYS 10 1HZ LYS 10 10.143 5.328 -0.189
66 2HZ LYS 10 2HZ LYS 10 11.090 6.642 -0.023
67 H CYS 11 H CYS 11 6.515 4.009 -7.343
68 HA CYS 11 HA CYS 11 6.815 1.333 -6.473
69 1HB CYS 11 1HB CYS 11 4.805 2.523 -8.395
70 2HB CYS 11 2HB CYS 11 4.700 0.943 -7.643
71 H ASN 12 H ASN 12 7.426 3.207 -9.447
72 HA ASN 12 HA ASN 12 7.687 0.925 -11.088
73 1HB ASN 12 1HB ASN 12 8.753 3.772 -11.482
74 2HB ASN 12 2HB ASN 12 8.628 2.560 -12.742
75 1HD2 ASN 12 1HD2 ASN 12 7.095 3.190 -14.064
76 2HD2 ASN 12 2HD2 ASN 12 5.487 3.674 -13.643
77 H ASN 13 H ASN 13 9.898 3.225 -9.364
78 HA ASN 13 HA ASN 13 12.257 2.141 -10.337
79 1HB ASN 13 1HB ASN 13 11.923 3.413 -7.580
80 2HB ASN 13 2HB ASN 13 13.345 3.454 -8.604
81 1HD2 ASN 13 1HD2 ASN 13 11.657 5.577 -7.401
82 2HD2 ASN 13 2HD2 ASN 13 11.185 6.625 -8.697
83 H HIS 14 H HIS 14 9.965 1.193 -7.814
84 HA HIS 14 HA HIS 14 11.811 -0.449 -6.387
85 1HB HIS 14 1HB HIS 14 10.181 0.202 -4.954
86 2HB HIS 14 2HB HIS 14 8.956 0.307 -6.203
87 HD1 HIS 14 HD1 HIS 14 10.531 -2.122 -3.783
88 HD2 HIS 14 HD2 HIS 14 7.439 -2.038 -6.616
89 HE1 HIS 14 HE1 HIS 14 9.172 -4.250 -3.421
90 H CYS 15 H CYS 15 9.116 -0.970 -8.751
91 HA CYS 15 HA CYS 15 9.368 -3.752 -8.777
92 1HB CYS 15 1HB CYS 15 8.301 -1.912 -10.929
93 2HB CYS 15 2HB CYS 15 8.060 -3.646 -10.853
94 H LYS 16 H LYS 16 11.233 -1.111 -10.146
95 HA LYS 16 HA LYS 16 12.428 -2.749 -12.197
96 1HB LYS 16 1HB LYS 16 12.447 -0.670 -13.050
97 2HB LYS 16 2HB LYS 16 12.329 0.097 -11.479
98 1HG LYS 16 1HG LYS 16 14.929 -1.264 -12.158
99 2HG LYS 16 2HG LYS 16 14.568 0.237 -12.988
100 1HD LYS 16 1HD LYS 16 14.039 1.216 -10.632
101 2HD LYS 16 2HD LYS 16 14.814 -0.219 -9.988
102 1HE LYS 16 1HE LYS 16 16.644 1.229 -10.097
103 2HE LYS 16 2HE LYS 16 16.784 0.432 -11.652
104 1HZ LYS 16 1HZ LYS 16 16.323 3.166 -11.159
105 2HZ LYS 16 2HZ LYS 16 16.550 2.439 -12.598
106 H SER 17 H SER 17 13.123 -1.575 -8.893
107 HA SER 17 HA SER 17 15.817 -2.327 -8.940
108 1HB SER 17 1HB SER 17 14.843 -0.709 -7.317
109 2HB SER 17 2HB SER 17 13.907 -1.995 -6.583
110 HG SER 17 HG SER 17 15.607 -2.493 -5.396
111 H ILE 18 H ILE 18 12.751 -4.015 -8.297
112 HA ILE 18 HA ILE 18 14.049 -6.294 -7.126
113 HB ILE 18 HB ILE 18 11.834 -7.236 -7.034
114 1HG1 ILE 18 1HG1 ILE 18 11.065 -4.922 -8.822
115 2HG1 ILE 18 2HG1 ILE 18 10.886 -6.636 -9.134
116 1HG2 ILE 18 1HG2 ILE 18 11.172 -4.466 -6.254
117 2HG2 ILE 18 2HG2 ILE 18 11.196 -5.964 -5.293
118 3HG2 ILE 18 3HG2 ILE 18 12.713 -5.092 -5.619
119 1HD1 ILE 18 1HD1 ILE 18 9.383 -4.977 -7.065
120 2HD1 ILE 18 2HD1 ILE 18 8.710 -5.803 -8.491
121 3HD1 ILE 18 3HD1 ILE 18 9.321 -6.754 -7.116
122 H SER 19 H SER 19 12.193 -5.658 -10.188
123 HA SER 19 HA SER 19 13.728 -6.456 -12.052
124 1HB SER 19 1HB SER 19 13.186 -8.902 -10.394
125 2HB SER 19 2HB SER 19 13.201 -9.107 -12.134
126 HG SER 19 HG SER 19 15.335 -8.857 -12.174
127 H CYS 20 H CYS 20 11.713 -5.061 -12.512
128 HA CYS 20 HA CYS 20 9.796 -6.758 -13.855
129 1HB CYS 20 1HB CYS 20 9.188 -5.428 -11.379
130 2HB CYS 20 2HB CYS 20 8.241 -4.714 -12.669
131 H ARG 21 H ARG 21 8.022 -4.623 -14.596
132 HA ARG 21 HA ARG 21 9.858 -3.135 -16.256
133 1HB ARG 21 1HB ARG 21 8.083 -4.296 -17.464
134 2HB ARG 21 2HB ARG 21 6.850 -3.638 -16.409
135 1HG ARG 21 1HG ARG 21 7.131 -2.509 -18.720
136 2HG ARG 21 2HG ARG 21 7.042 -1.449 -17.327
137 1HD ARG 21 1HD ARG 21 8.888 -0.679 -18.703
138 2HD ARG 21 2HD ARG 21 9.581 -1.401 -17.265
139 HE ARG 21 HE ARG 21 9.477 -3.529 -19.025
140 1HH1 ARG 21 2HH2 ARG 21 10.824 -0.260 -19.255
141 2HH1 ARG 21 1HH2 ARG 21 12.073 -0.719 -20.364
142 1HH2 ARG 21 HH1 ARG 21 12.232 -3.002 -21.075
143 H ALA 22 H ALA 22 6.730 -2.548 -14.471
144 HA ALA 22 HA ALA 22 7.629 -0.443 -12.945
145 1HB ALA 22 1HB ALA 22 7.914 1.211 -14.455
146 2HB ALA 22 2HB ALA 22 7.130 0.272 -15.747
147 3HB ALA 22 3HB ALA 22 6.142 1.223 -14.612
148 H GLY 23 H GLY 23 5.975 0.251 -11.536
149 1HA GLY 23 1HA GLY 23 3.338 -0.990 -12.052
150 2HA GLY 23 2HA GLY 23 4.098 -0.914 -10.475
151 H TYR 24 H TYR 24 1.660 0.127 -10.428
152 HA TYR 24 HA TYR 24 2.169 2.991 -10.250
153 1HB TYR 24 1HB TYR 24 0.002 3.381 -11.457
154 2HB TYR 24 2HB TYR 24 1.089 2.468 -12.484
155 HD1 TYR 24 HD1 TYR 24 -1.612 1.885 -9.943
156 HD2 TYR 24 HD2 TYR 24 0.273 0.570 -13.552
157 HE1 TYR 24 HE1 TYR 24 -3.379 0.077 -10.217
158 HE2 TYR 24 HE2 TYR 24 -1.500 -1.233 -13.813
159 HH TYR 24 HH TYR 24 -3.305 -2.333 -11.493
160 H CYS 25 H CYS 25 0.397 4.113 -8.981
161 HA CYS 25 HA CYS 25 -0.297 2.395 -6.773
162 1HB CYS 25 1HB CYS 25 -0.756 5.367 -7.088
163 2HB CYS 25 2HB CYS 25 -0.886 4.433 -5.612
164 H ASP 26 H ASP 26 -2.254 1.347 -6.740
165 HA ASP 26 HA ASP 26 -4.101 1.308 -8.579
166 1HB ASP 26 1HB ASP 26 -3.957 0.581 -5.840
167 2HB ASP 26 2HB ASP 26 -5.463 1.466 -5.982
168 HD2 ASP 26 HD2 ASP 26 -4.333 -1.809 -6.549
169 H ALA 27 H ALA 27 -4.839 3.180 -9.662
170 HA ALA 27 HA ALA 27 -5.336 5.615 -8.330
171 1HB ALA 27 1HB ALA 27 -5.895 4.476 -11.076
172 2HB ALA 27 2HB ALA 27 -6.520 6.075 -10.607
173 3HB ALA 27 3HB ALA 27 -4.768 5.771 -10.605
174 H ALA 28 H ALA 28 -6.991 2.668 -8.250
175 HA ALA 28 HA ALA 28 -9.597 3.972 -7.969
176 1HB ALA 28 1HB ALA 28 -10.490 2.039 -8.752
177 2HB ALA 28 2HB ALA 28 -8.836 1.690 -9.311
178 3HB ALA 28 3HB ALA 28 -9.409 1.028 -7.762
179 H THR 29 H THR 29 -6.937 3.472 -6.119
180 HA THR 29 HA THR 29 -8.580 2.984 -3.729
181 HB THR 29 HB THR 29 -6.916 1.078 -4.712
182 HG1 THR 29 HG1 THR 29 -6.974 0.411 -2.482
183 1HG2 THR 29 1HG2 THR 29 -4.700 1.317 -4.142
184 2HG2 THR 29 2HG2 THR 29 -5.048 3.062 -4.095
185 3HG2 THR 29 3HG2 THR 29 -5.103 2.102 -2.596
186 H LEU 30 H LEU 30 -7.512 5.429 -5.260
187 HA LEU 30 HA LEU 30 -6.834 7.444 -4.657
188 1HB LEU 30 1HB LEU 30 -6.493 6.483 -1.823
189 2HB LEU 30 2HB LEU 30 -6.757 8.121 -2.388
190 HG LEU 30 HG LEU 30 -8.784 5.873 -2.572
191 1HD1 LEU 30 1HD1 LEU 30 -9.526 8.068 -0.843
192 2HD1 LEU 30 2HD1 LEU 30 -9.448 6.322 -0.502
193 3HD1 LEU 30 3HD1 LEU 30 -7.995 7.332 -0.311
194 1HD2 LEU 30 1HD2 LEU 30 -8.627 8.330 -3.972
195 2HD2 LEU 30 2HD2 LEU 30 -9.967 7.160 -3.933
196 3HD2 LEU 30 3HD2 LEU 30 -9.919 8.499 -2.760
197 H TRP 31 H TRP 31 -5.060 5.445 -5.723
198 HA TRP 31 HA TRP 31 -2.902 4.890 -5.896
199 1HB TRP 31 1HB TRP 31 -2.692 7.860 -5.380
200 2HB TRP 31 2HB TRP 31 -1.380 6.867 -5.983
201 HD1 TRP 31 HD1 TRP 31 -1.312 6.524 -8.596
202 HE1 TRP 31 HE1 TRP 31 -2.830 7.092 -10.678
203 HE3 TRP 31 HE3 TRP 31 -5.345 8.052 -5.902
204 HZ2 TRP 31 HZ2 TRP 31 -5.488 8.094 -10.958
205 HZ3 TRP 31 HZ3 TRP 31 -7.361 8.809 -7.157
206 HH2 TRP 31 HH2 TRP 31 -7.473 8.847 -9.599
207 H LEU 32 H LEU 32 -3.250 3.610 -3.793
208 HA LEU 32 HA LEU 32 -1.497 4.733 -1.720
209 1HB LEU 32 1HB LEU 32 -3.537 4.761 -0.676
210 2HB LEU 32 2HB LEU 32 -4.134 3.355 -1.535
211 HG LEU 32 HG LEU 32 -2.939 1.851 -0.139
212 1HD1 LEU 32 1HD1 LEU 32 -1.647 3.675 1.713
213 2HD1 LEU 32 2HD1 LEU 32 -0.986 2.276 0.834
214 3HD1 LEU 32 3HD1 LEU 32 -1.033 3.875 0.054
215 1HD2 LEU 32 1HD2 LEU 32 -4.196 4.082 1.470
216 2HD2 LEU 32 2HD2 LEU 32 -4.955 2.580 0.890
217 3HD2 LEU 32 3HD2 LEU 32 -3.710 2.515 2.161
218 H ARG 33 H ARG 33 -2.650 1.842 -3.521
219 HA ARG 33 HA ARG 33 -0.659 0.217 -2.320
220 1HB ARG 33 1HB ARG 33 -3.057 -0.232 -3.714
221 2HB ARG 33 2HB ARG 33 -1.838 -0.777 -4.848
222 1HG ARG 33 1HG ARG 33 -0.825 -2.207 -3.040
223 2HG ARG 33 2HG ARG 33 -2.089 -1.691 -1.943
224 1HD ARG 33 1HD ARG 33 -3.722 -2.977 -2.983
225 2HD ARG 33 2HD ARG 33 -3.018 -2.782 -4.577
226 HE ARG 33 HE ARG 33 -1.135 -4.311 -3.227
227 1HH1 ARG 33 2HH2 ARG 33 -4.609 -4.663 -3.832
228 2HH1 ARG 33 1HH2 ARG 33 -4.563 -6.394 -3.804
229 1HH2 ARG 33 HH1 ARG 33 -2.475 -7.509 -3.426
230 H CYS 34 H CYS 34 0.516 -1.285 -4.288
231 HA CYS 34 HA CYS 34 1.563 0.520 -6.295
232 1HB CYS 34 1HB CYS 34 3.136 -0.504 -3.982
233 2HB CYS 34 2HB CYS 34 3.915 -0.511 -5.551
234 H THR 35 H THR 35 0.479 -0.880 -7.802
235 HA THR 35 HA THR 35 1.138 -3.714 -7.709
236 HB THR 35 HB THR 35 -1.124 -2.195 -8.415
237 HG1 THR 35 HG1 THR 35 -1.703 -4.465 -9.188
238 1HG2 THR 35 1HG2 THR 35 -0.151 -1.740 -10.679
239 2HG2 THR 35 2HG2 THR 35 0.153 -3.482 -10.886
240 3HG2 THR 35 3HG2 THR 35 -1.517 -2.876 -10.783
241 H CYS 36 H CYS 36 2.722 -4.663 -8.828
242 HA CYS 36 HA CYS 36 4.290 -2.986 -10.556
243 1HB CYS 36 1HB CYS 36 4.616 -5.800 -9.520
244 2HB CYS 36 2HB CYS 36 5.684 -5.124 -10.733
245 H THR 37 H THR 37 3.734 -2.767 -12.695
246 HA THR 37 HA THR 37 2.329 -5.030 -13.951
247 HB THR 37 HB THR 37 1.151 -3.393 -15.249
248 HG1 THR 37 HG1 THR 37 3.232 -1.623 -14.170
249 1HG2 THR 37 1HG2 THR 37 0.452 -1.573 -13.629
250 2HG2 THR 37 2HG2 THR 37 0.341 -3.204 -12.925
251 3HG2 THR 37 3HG2 THR 37 1.710 -2.145 -12.507
252 H ASP 38 H ASP 38 2.992 -5.824 -15.947
253 HA ASP 38 HA ASP 38 4.396 -6.351 -17.511
254 1HB ASP 38 1HB ASP 38 5.031 -3.415 -17.193
255 2HB ASP 38 2HB ASP 38 6.086 -4.381 -18.206
256 HD2 ASP 38 HD2 ASP 38 3.532 -2.350 -18.896
257 H CYS 39 H CYS 39 6.555 -7.278 -17.704
258 HA CYS 39 HA CYS 39 8.591 -6.416 -15.882
259 1HB CYS 39 1HB CYS 39 7.420 -9.190 -15.578
260 2HB CYS 39 2HB CYS 39 8.880 -8.607 -14.804
261 H ASN 40 H ASN 40 10.636 -7.829 -16.298
262 HA ASN 40 HA ASN 40 10.493 -8.876 -19.016
263 1HB ASN 40 1HB ASN 40 12.280 -6.816 -17.806
264 2HB ASN 40 2HB ASN 40 13.139 -8.049 -18.710
265 1HD2 ASN 40 1HD2 ASN 40 13.736 -6.652 -20.326
266 2HD2 ASN 40 2HD2 ASN 40 12.642 -6.035 -21.519
267 H GLY 41 H GLY 41 10.212 -11.003 -17.841
268 1HA GLY 41 1HA GLY 41 12.221 -12.701 -17.775
269 2HA GLY 41 2HA GLY 41 12.494 -11.893 -16.245
270 H LYS 42 H LYS 42 9.658 -13.201 -18.122
271 HA LYS 42 HA LYS 42 8.643 -14.247 -15.579
272 1HB LYS 42 1HB LYS 42 6.460 -14.133 -16.500
273 2HB LYS 42 2HB LYS 42 7.238 -12.603 -16.855
274 1HG LYS 42 1HG LYS 42 7.721 -14.597 -18.973
275 2HG LYS 42 2HG LYS 42 6.011 -14.318 -18.718
276 1HD LYS 42 1HD LYS 42 7.894 -11.951 -18.918
277 2HD LYS 42 2HD LYS 42 7.374 -12.764 -20.380
278 1HE LYS 42 1HE LYS 42 4.950 -12.500 -19.178
279 2HE LYS 42 2HE LYS 42 5.761 -11.140 -18.429
280 1HZ LYS 42 1HZ LYS 42 4.640 -11.068 -20.883
281 2HZ LYS 42 2HZ LYS 42 5.791 -10.026 -20.389
282 H LYS 43 H LYS 43 7.780 -16.436 -15.531
283 HA LYS 43 HA LYS 43 7.981 -18.608 -15.877
284 1HB LYS 43 1HB LYS 43 7.603 -17.512 -18.628
285 2HB LYS 43 2HB LYS 43 8.075 -19.194 -18.490
286 1HG LYS 43 1HG LYS 43 5.706 -19.276 -18.428
287 2HG LYS 43 2HG LYS 43 6.165 -19.424 -16.743
288 1HD LYS 43 1HD LYS 43 5.645 -17.108 -16.290
289 2HD LYS 43 2HD LYS 43 5.541 -16.719 -17.996
290 1HE LYS 43 1HE LYS 43 3.627 -18.607 -17.965
291 2HE LYS 43 2HE LYS 43 3.562 -18.201 -16.261
292 1HZ LYS 43 1HZ LYS 43 3.502 -16.036 -18.263
293 2HZ LYS 43 2HZ LYS 43 2.132 -16.845 -17.917
Start of MODEL 8
1 1H GLY 1 H GLY 1 1.142 0.947 0.698
2 1HA GLY 1 1HA GLY 1 1.786 -0.868 -0.500
3 2HA GLY 1 2HA GLY 1 2.008 0.139 -1.917
4 H PHE 2 H PHE 2 3.995 1.620 -1.929
5 HA PHE 2 HA PHE 2 6.114 0.903 -0.149
6 1HB PHE 2 1HB PHE 2 5.787 -0.158 -2.971
7 2HB PHE 2 2HB PHE 2 7.403 0.342 -2.511
8 HD1 PHE 2 HD1 PHE 2 5.094 -2.317 -2.494
9 HD2 PHE 2 HD2 PHE 2 8.298 -0.660 -0.260
10 HE1 PHE 2 HE1 PHE 2 5.462 -4.535 -1.377
11 HE2 PHE 2 HE2 PHE 2 8.666 -2.878 0.858
12 HZ PHE 2 HZ PHE 2 7.244 -4.788 0.285
13 H GLY 3 H GLY 3 4.796 3.357 -0.681
14 1HA GLY 3 1HA GLY 3 6.724 5.191 -0.904
15 2HA GLY 3 2HA GLY 3 6.415 4.832 -2.591
16 H CYS 4 H CYS 4 3.651 4.364 -2.661
17 HA CYS 4 HA CYS 4 2.705 7.029 -2.498
18 1HB CYS 4 1HB CYS 4 1.792 4.469 -3.595
19 2HB CYS 4 2HB CYS 4 0.490 5.449 -2.951
20 HA PRO 5 HA PRO 5 0.462 7.463 -2.542
21 1HB PRO 5 1HB PRO 5 -0.843 9.551 -1.355
22 2HB PRO 5 2HB PRO 5 -1.636 8.051 -1.796
23 1HG PRO 5 1HG PRO 5 -0.828 9.004 0.884
24 2HG PRO 5 2HG PRO 5 -1.973 7.746 0.466
25 1HD PRO 5 1HD PRO 5 0.704 7.379 1.426
26 2HD PRO 5 2HD PRO 5 -0.401 6.125 0.898
27 H GLY 6 H GLY 6 0.953 9.523 -3.606
28 1HA GLY 6 1HA GLY 6 2.272 11.336 -3.914
29 2HA GLY 6 2HA GLY 6 2.704 11.311 -2.216
30 H ASN 7 H ASN 7 3.102 8.883 -4.898
31 HA ASN 7 HA ASN 7 5.739 9.282 -5.353
32 1HB ASN 7 1HB ASN 7 5.291 7.945 -2.785
33 2HB ASN 7 2HB ASN 7 6.140 6.865 -3.872
34 1HD2 ASN 7 1HD2 ASN 7 7.736 7.263 -2.077
35 2HD2 ASN 7 2HD2 ASN 7 8.884 8.543 -2.288
36 H GLN 8 H GLN 8 4.511 8.678 -7.368
37 HA GLN 8 HA GLN 8 3.689 5.921 -7.509
38 1HB GLN 8 1HB GLN 8 2.393 7.942 -8.493
39 2HB GLN 8 2HB GLN 8 3.604 7.963 -9.760
40 1HG GLN 8 1HG GLN 8 3.078 5.490 -10.176
41 2HG GLN 8 2HG GLN 8 1.741 5.650 -9.055
42 1HE2 GLN 8 1HE2 GLN 8 2.921 6.221 -12.209
43 2HE2 GLN 8 2HE2 GLN 8 1.528 6.986 -12.898
44 H LEU 9 H LEU 9 6.402 7.985 -8.306
45 HA LEU 9 HA LEU 9 7.415 6.290 -10.380
46 1HB LEU 9 1HB LEU 9 9.124 7.824 -10.589
47 2HB LEU 9 2HB LEU 9 7.744 8.796 -10.118
48 HG LEU 9 HG LEU 9 9.309 7.913 -7.810
49 1HD1 LEU 9 1HD1 LEU 9 10.751 9.918 -9.508
50 2HD1 LEU 9 2HD1 LEU 9 11.358 8.889 -8.188
51 3HD1 LEU 9 3HD1 LEU 9 11.011 8.179 -9.783
52 1HD2 LEU 9 1HD2 LEU 9 7.567 9.966 -8.459
53 2HD2 LEU 9 2HD2 LEU 9 8.529 9.822 -6.968
54 3HD2 LEU 9 3HD2 LEU 9 9.147 10.778 -8.337
55 H LYS 10 H LYS 10 7.578 6.506 -6.856
56 HA LYS 10 HA LYS 10 9.949 5.008 -6.557
57 1HB LYS 10 1HB LYS 10 8.299 6.481 -4.912
58 2HB LYS 10 2HB LYS 10 7.966 4.843 -4.387
59 1HG LYS 10 1HG LYS 10 10.735 4.801 -4.659
60 2HG LYS 10 2HG LYS 10 10.452 6.443 -4.114
61 1HD LYS 10 1HD LYS 10 9.360 5.712 -2.102
62 2HD LYS 10 2HD LYS 10 9.139 4.084 -2.713
63 1HE LYS 10 1HE LYS 10 11.980 4.969 -2.635
64 2HE LYS 10 2HE LYS 10 11.216 4.888 -1.060
65 1HZ LYS 10 1HZ LYS 10 11.935 2.726 -2.809
66 2HZ LYS 10 2HZ LYS 10 11.645 2.690 -1.207
67 H CYS 11 H CYS 11 6.623 4.212 -7.359
68 HA CYS 11 HA CYS 11 6.791 1.513 -6.490
69 1HB CYS 11 1HB CYS 11 4.866 2.887 -8.377
70 2HB CYS 11 2HB CYS 11 4.702 1.236 -7.811
71 H ASN 12 H ASN 12 7.189 3.349 -9.578
72 HA ASN 12 HA ASN 12 7.483 1.146 -11.212
73 1HB ASN 12 1HB ASN 12 7.139 3.328 -12.209
74 2HB ASN 12 2HB ASN 12 8.518 4.013 -11.372
75 1HD2 ASN 12 1HD2 ASN 12 9.018 4.702 -13.587
76 2HD2 ASN 12 2HD2 ASN 12 9.945 3.658 -14.613
77 H ASN 13 H ASN 13 9.944 3.334 -9.640
78 HA ASN 13 HA ASN 13 12.178 2.062 -10.529
79 1HB ASN 13 1HB ASN 13 11.902 3.227 -7.717
80 2HB ASN 13 2HB ASN 13 13.345 3.193 -8.712
81 1HD2 ASN 13 1HD2 ASN 13 11.859 5.407 -7.452
82 2HD2 ASN 13 2HD2 ASN 13 11.486 6.541 -8.707
83 H HIS 14 H HIS 14 10.099 1.457 -7.629
84 HA HIS 14 HA HIS 14 11.739 -0.504 -6.491
85 1HB HIS 14 1HB HIS 14 10.224 0.423 -5.020
86 2HB HIS 14 2HB HIS 14 8.904 0.395 -6.173
87 HD1 HIS 14 HD1 HIS 14 10.726 -1.789 -3.689
88 HD2 HIS 14 HD2 HIS 14 7.402 -1.990 -6.240
89 HE1 HIS 14 HE1 HIS 14 9.444 -3.893 -3.028
90 H CYS 15 H CYS 15 9.333 -0.530 -9.100
91 HA CYS 15 HA CYS 15 8.910 -3.312 -9.083
92 1HB CYS 15 1HB CYS 15 8.502 -1.193 -11.196
93 2HB CYS 15 2HB CYS 15 8.099 -2.880 -11.450
94 H LYS 16 H LYS 16 11.281 -1.068 -10.566
95 HA LYS 16 HA LYS 16 12.426 -3.104 -12.224
96 1HB LYS 16 1HB LYS 16 13.906 -0.590 -11.628
97 2HB LYS 16 2HB LYS 16 13.656 -1.420 -13.152
98 1HG LYS 16 1HG LYS 16 11.077 -0.716 -12.620
99 2HG LYS 16 2HG LYS 16 11.896 0.572 -11.759
100 1HD LYS 16 1HD LYS 16 11.397 1.183 -14.137
101 2HD LYS 16 2HD LYS 16 13.111 1.243 -13.779
102 1HE LYS 16 1HE LYS 16 13.600 -0.470 -15.221
103 2HE LYS 16 2HE LYS 16 12.227 -1.427 -14.705
104 1HZ LYS 16 1HZ LYS 16 10.793 -0.087 -16.111
105 2HZ LYS 16 2HZ LYS 16 12.009 0.915 -16.520
106 H SER 17 H SER 17 12.682 -2.055 -8.903
107 HA SER 17 HA SER 17 15.334 -3.041 -8.591
108 1HB SER 17 1HB SER 17 13.215 -1.905 -6.766
109 2HB SER 17 2HB SER 17 14.561 -2.771 -6.054
110 HG SER 17 HG SER 17 15.989 -1.298 -7.335
111 H ILE 18 H ILE 18 11.973 -4.166 -8.082
112 HA ILE 18 HA ILE 18 12.782 -6.518 -6.671
113 HB ILE 18 HB ILE 18 10.451 -7.103 -6.741
114 1HG1 ILE 18 1HG1 ILE 18 10.221 -4.883 -8.783
115 2HG1 ILE 18 2HG1 ILE 18 9.818 -6.578 -8.978
116 1HG2 ILE 18 1HG2 ILE 18 11.522 -4.790 -5.573
117 2HG2 ILE 18 2HG2 ILE 18 9.935 -4.307 -6.219
118 3HG2 ILE 18 3HG2 ILE 18 10.056 -5.675 -5.088
119 1HD1 ILE 18 1HD1 ILE 18 8.339 -4.446 -7.421
120 2HD1 ILE 18 2HD1 ILE 18 7.707 -5.605 -8.614
121 3HD1 ILE 18 3HD1 ILE 18 8.143 -6.159 -6.981
122 H SER 19 H SER 19 11.390 -5.854 -9.963
123 HA SER 19 HA SER 19 12.998 -7.100 -11.535
124 1HB SER 19 1HB SER 19 11.707 -9.202 -9.834
125 2HB SER 19 2HB SER 19 11.828 -9.560 -11.545
126 HG SER 19 HG SER 19 14.126 -8.564 -10.139
127 H CYS 20 H CYS 20 11.367 -5.286 -12.250
128 HA CYS 20 HA CYS 20 9.478 -6.570 -13.985
129 1HB CYS 20 1HB CYS 20 8.611 -5.043 -11.594
130 2HB CYS 20 2HB CYS 20 7.789 -4.664 -13.094
131 H ARG 21 H ARG 21 8.173 -4.326 -14.979
132 HA ARG 21 HA ARG 21 10.438 -2.834 -15.963
133 1HB ARG 21 1HB ARG 21 7.571 -3.204 -16.931
134 2HB ARG 21 2HB ARG 21 8.607 -1.974 -17.626
135 1HG ARG 21 1HG ARG 21 10.239 -4.258 -17.632
136 2HG ARG 21 2HG ARG 21 8.654 -4.900 -18.016
137 1HD ARG 21 1HD ARG 21 8.910 -4.166 -20.148
138 2HD ARG 21 2HD ARG 21 8.886 -2.516 -19.556
139 HE ARG 21 HE ARG 21 11.504 -3.689 -19.167
140 1HH1 ARG 21 2HH2 ARG 21 9.415 -2.295 -21.667
141 2HH1 ARG 21 1HH2 ARG 21 10.738 -1.797 -22.669
142 1HH2 ARG 21 HH1 ARG 21 12.982 -2.241 -21.955
143 H ALA 22 H ALA 22 6.973 -2.161 -15.037
144 HA ALA 22 HA ALA 22 7.667 -0.125 -13.227
145 1HB ALA 22 1HB ALA 22 6.713 1.785 -14.596
146 2HB ALA 22 2HB ALA 22 8.298 1.187 -15.144
147 3HB ALA 22 3HB ALA 22 6.820 0.725 -16.021
148 H GLY 23 H GLY 23 5.782 0.657 -12.108
149 1HA GLY 23 1HA GLY 23 3.251 -0.609 -12.957
150 2HA GLY 23 2HA GLY 23 3.841 -0.757 -11.314
151 H TYR 24 H TYR 24 2.440 0.477 -10.098
152 HA TYR 24 HA TYR 24 2.664 3.242 -10.107
153 1HB TYR 24 1HB TYR 24 0.297 3.708 -10.989
154 2HB TYR 24 2HB TYR 24 1.388 3.126 -12.231
155 HD1 TYR 24 HD1 TYR 24 0.622 1.452 -13.644
156 HD2 TYR 24 HD2 TYR 24 -1.030 1.742 -9.708
157 HE1 TYR 24 HE1 TYR 24 -1.000 -0.430 -14.179
158 HE2 TYR 24 HE2 TYR 24 -2.646 -0.141 -10.256
159 HH TYR 24 HH TYR 24 -3.572 -1.276 -11.966
160 H CYS 25 H CYS 25 0.199 4.058 -9.083
161 HA CYS 25 HA CYS 25 -0.002 2.291 -6.759
162 1HB CYS 25 1HB CYS 25 -0.737 5.218 -6.889
163 2HB CYS 25 2HB CYS 25 -0.644 4.204 -5.464
164 H ASP 26 H ASP 26 -1.938 1.218 -6.507
165 HA ASP 26 HA ASP 26 -3.826 0.990 -8.302
166 1HB ASP 26 1HB ASP 26 -3.602 0.497 -5.478
167 2HB ASP 26 2HB ASP 26 -5.201 1.158 -5.751
168 HD2 ASP 26 HD2 ASP 26 -3.185 -1.499 -6.308
169 H ALA 27 H ALA 27 -4.569 2.847 -9.444
170 HA ALA 27 HA ALA 27 -5.259 5.253 -8.119
171 1HB ALA 27 1HB ALA 27 -6.374 5.583 -10.507
172 2HB ALA 27 2HB ALA 27 -4.604 5.581 -10.319
173 3HB ALA 27 3HB ALA 27 -5.440 4.120 -10.900
174 H ALA 28 H ALA 28 -6.731 2.228 -8.128
175 HA ALA 28 HA ALA 28 -9.426 3.373 -8.036
176 1HB ALA 28 1HB ALA 28 -8.593 0.449 -8.098
177 2HB ALA 28 2HB ALA 28 -10.208 1.129 -8.410
178 3HB ALA 28 3HB ALA 28 -8.884 1.419 -9.563
179 H THR 29 H THR 29 -6.861 2.974 -6.019
180 HA THR 29 HA THR 29 -8.628 2.355 -3.749
181 HB THR 29 HB THR 29 -6.731 0.616 -4.648
182 HG1 THR 29 HG1 THR 29 -6.927 -0.124 -2.443
183 1HG2 THR 29 1HG2 THR 29 -5.087 2.700 -3.846
184 2HG2 THR 29 2HG2 THR 29 -5.237 1.766 -2.338
185 3HG2 THR 29 3HG2 THR 29 -4.612 0.985 -3.810
186 H LEU 30 H LEU 30 -7.942 4.938 -5.032
187 HA LEU 30 HA LEU 30 -7.421 6.981 -4.381
188 1HB LEU 30 1HB LEU 30 -6.989 6.027 -1.566
189 2HB LEU 30 2HB LEU 30 -7.555 7.588 -2.127
190 HG LEU 30 HG LEU 30 -9.132 5.013 -2.389
191 1HD1 LEU 30 1HD1 LEU 30 -10.440 5.710 -0.496
192 2HD1 LEU 30 2HD1 LEU 30 -8.725 5.657 -0.022
193 3HD1 LEU 30 3HD1 LEU 30 -9.509 7.220 -0.349
194 1HD2 LEU 30 1HD2 LEU 30 -10.548 7.587 -2.436
195 2HD2 LEU 30 2HD2 LEU 30 -9.438 7.339 -3.806
196 3HD2 LEU 30 3HD2 LEU 30 -10.723 6.153 -3.476
197 H TRP 31 H TRP 31 -5.396 5.000 -5.301
198 HA TRP 31 HA TRP 31 -3.199 4.774 -5.501
199 1HB TRP 31 1HB TRP 31 -3.361 7.721 -4.876
200 2HB TRP 31 2HB TRP 31 -1.876 6.925 -5.356
201 HD1 TRP 31 HD1 TRP 31 -1.507 6.653 -7.955
202 HE1 TRP 31 HE1 TRP 31 -2.869 7.090 -10.173
203 HE3 TRP 31 HE3 TRP 31 -5.943 7.611 -5.663
204 HZ2 TRP 31 HZ2 TRP 31 -5.589 7.773 -10.707
205 HZ3 TRP 31 HZ3 TRP 31 -7.902 8.154 -7.105
206 HH2 TRP 31 HH2 TRP 31 -7.777 8.243 -9.545
207 H LEU 32 H LEU 32 -2.815 3.280 -3.799
208 HA LEU 32 HA LEU 32 -1.451 4.469 -1.522
209 1HB LEU 32 1HB LEU 32 -3.910 2.758 -1.371
210 2HB LEU 32 2HB LEU 32 -2.705 2.689 -0.101
211 HG LEU 32 HG LEU 32 -4.322 5.099 -0.961
212 1HD1 LEU 32 1HD1 LEU 32 -5.419 3.351 0.474
213 2HD1 LEU 32 2HD1 LEU 32 -4.215 3.722 1.732
214 3HD1 LEU 32 3HD1 LEU 32 -5.348 4.982 1.185
215 1HD2 LEU 32 1HD2 LEU 32 -3.160 6.239 0.984
216 2HD2 LEU 32 2HD2 LEU 32 -1.965 4.923 0.920
217 3HD2 LEU 32 3HD2 LEU 32 -2.187 5.991 -0.486
218 H ARG 33 H ARG 33 -2.494 1.455 -3.240
219 HA ARG 33 HA ARG 33 -0.340 -0.011 -2.209
220 1HB ARG 33 1HB ARG 33 -2.696 -0.550 -3.675
221 2HB ARG 33 2HB ARG 33 -1.407 -1.007 -4.771
222 1HG ARG 33 1HG ARG 33 -0.466 -2.565 -3.181
223 2HG ARG 33 2HG ARG 33 -1.429 -1.921 -1.866
224 1HD ARG 33 1HD ARG 33 -3.051 -3.440 -2.326
225 2HD ARG 33 2HD ARG 33 -3.290 -2.699 -3.895
226 HE ARG 33 HE ARG 33 -0.966 -4.403 -3.971
227 1HH1 ARG 33 2HH2 ARG 33 -4.505 -4.563 -3.903
228 2HH1 ARG 33 1HH2 ARG 33 -4.575 -6.096 -4.706
229 1HH2 ARG 33 HH1 ARG 33 -2.537 -7.172 -5.360
230 H CYS 34 H CYS 34 1.098 -1.274 -4.050
231 HA CYS 34 HA CYS 34 1.995 0.706 -5.995
232 1HB CYS 34 1HB CYS 34 3.515 -0.316 -3.693
233 2HB CYS 34 2HB CYS 34 4.355 -0.458 -5.224
234 H THR 35 H THR 35 0.895 -0.635 -7.579
235 HA THR 35 HA THR 35 1.567 -3.433 -7.734
236 HB THR 35 HB THR 35 -0.548 -1.734 -8.556
237 HG1 THR 35 HG1 THR 35 -1.346 -3.852 -9.093
238 1HG2 THR 35 1HG2 THR 35 -0.747 -2.336 -10.974
239 2HG2 THR 35 2HG2 THR 35 0.655 -1.275 -10.702
240 3HG2 THR 35 3HG2 THR 35 0.894 -3.024 -10.933
241 H CYS 36 H CYS 36 2.422 -4.415 -9.764
242 HA CYS 36 HA CYS 36 4.370 -2.620 -11.009
243 1HB CYS 36 1HB CYS 36 4.858 -5.382 -9.891
244 2HB CYS 36 2HB CYS 36 5.921 -4.634 -11.066
245 H THR 37 H THR 37 3.979 -2.571 -13.194
246 HA THR 37 HA THR 37 2.685 -4.941 -14.372
247 HB THR 37 HB THR 37 1.486 -3.424 -15.795
248 HG1 THR 37 HG1 THR 37 3.445 -1.518 -14.719
249 1HG2 THR 37 1HG2 THR 37 0.621 -1.585 -14.290
250 2HG2 THR 37 2HG2 THR 37 0.585 -3.181 -13.501
251 3HG2 THR 37 3HG2 THR 37 1.872 -2.018 -13.100
252 H ASP 38 H ASP 38 3.338 -5.624 -16.479
253 HA ASP 38 HA ASP 38 4.798 -6.130 -17.997
254 1HB ASP 38 1HB ASP 38 5.539 -3.241 -17.496
255 2HB ASP 38 2HB ASP 38 6.585 -4.201 -18.524
256 HD2 ASP 38 HD2 ASP 38 5.763 -2.400 -19.859
257 H CYS 39 H CYS 39 6.356 -7.674 -17.486
258 HA CYS 39 HA CYS 39 8.626 -6.789 -15.887
259 1HB CYS 39 1HB CYS 39 7.186 -9.393 -15.360
260 2HB CYS 39 2HB CYS 39 8.583 -8.764 -14.510
261 H ASN 40 H ASN 40 10.587 -7.983 -16.404
262 HA ASN 40 HA ASN 40 10.394 -9.215 -19.003
263 1HB ASN 40 1HB ASN 40 12.514 -7.861 -17.385
264 2HB ASN 40 2HB ASN 40 13.091 -9.212 -18.340
265 1HD2 ASN 40 1HD2 ASN 40 14.191 -8.142 -19.867
266 2HD2 ASN 40 2HD2 ASN 40 13.505 -7.054 -21.027
267 H GLY 41 H GLY 41 9.334 -11.206 -17.995
268 1HA GLY 41 1HA GLY 41 11.073 -13.337 -17.705
269 2HA GLY 41 2HA GLY 41 10.725 -12.780 -16.080
270 H LYS 42 H LYS 42 8.722 -12.985 -19.111
271 HA LYS 42 HA LYS 42 7.118 -15.068 -17.990
272 1HB LYS 42 1HB LYS 42 5.037 -13.846 -17.833
273 2HB LYS 42 2HB LYS 42 6.224 -13.134 -16.758
274 1HG LYS 42 1HG LYS 42 5.771 -11.141 -17.748
275 2HG LYS 42 2HG LYS 42 6.629 -11.736 -19.155
276 1HD LYS 42 1HD LYS 42 4.184 -12.922 -19.552
277 2HD LYS 42 2HD LYS 42 3.685 -11.478 -18.693
278 1HE LYS 42 1HE LYS 42 5.594 -10.541 -20.553
279 2HE LYS 42 2HE LYS 42 4.694 -11.752 -21.444
280 1HZ LYS 42 1HZ LYS 42 3.330 -9.938 -21.715
281 2HZ LYS 42 2HZ LYS 42 2.669 -10.489 -20.332
282 H LYS 43 H LYS 43 5.452 -15.802 -19.574
283 HA LYS 43 HA LYS 43 6.441 -15.261 -22.265
284 1HB LYS 43 1HB LYS 43 5.005 -17.555 -20.958
285 2HB LYS 43 2HB LYS 43 4.901 -17.343 -22.693
286 1HG LYS 43 1HG LYS 43 7.645 -17.113 -21.508
287 2HG LYS 43 2HG LYS 43 6.923 -18.709 -21.465
288 1HD LYS 43 1HD LYS 43 6.653 -17.258 -24.064
289 2HD LYS 43 2HD LYS 43 8.290 -17.702 -23.623
290 1HE LYS 43 1HE LYS 43 7.872 -19.817 -24.324
291 2HE LYS 43 2HE LYS 43 6.702 -19.992 -23.031
292 1HZ LYS 43 1HZ LYS 43 5.436 -18.517 -25.012
293 2HZ LYS 43 2HZ LYS 43 6.202 -19.715 -25.806
Start of MODEL 9
1 1H GLY 1 H GLY 1 1.513 0.731 2.337
2 1HA GLY 1 1HA GLY 1 1.865 -0.560 0.238
3 2HA GLY 1 2HA GLY 1 2.132 1.165 0.072
4 H PHE 2 H PHE 2 4.055 1.828 -0.797
5 HA PHE 2 HA PHE 2 6.506 0.637 -0.160
6 1HB PHE 2 1HB PHE 2 4.918 -0.314 -2.546
7 2HB PHE 2 2HB PHE 2 6.609 0.018 -2.866
8 HD1 PHE 2 HD1 PHE 2 8.220 -1.007 -0.927
9 HD2 PHE 2 HD2 PHE 2 4.401 -2.492 -2.032
10 HE1 PHE 2 HE1 PHE 2 8.836 -3.266 -0.022
11 HE2 PHE 2 HE2 PHE 2 5.017 -4.750 -1.125
12 HZ PHE 2 HZ PHE 2 7.227 -5.110 -0.130
13 H GLY 3 H GLY 3 5.259 3.273 -0.327
14 1HA GLY 3 1HA GLY 3 6.972 5.041 -0.954
15 2HA GLY 3 2HA GLY 3 6.718 4.477 -2.593
16 H CYS 4 H CYS 4 3.805 3.858 -2.131
17 HA CYS 4 HA CYS 4 2.894 6.614 -2.361
18 1HB CYS 4 1HB CYS 4 2.273 4.159 -3.718
19 2HB CYS 4 2HB CYS 4 0.816 4.789 -2.978
20 HA PRO 5 HA PRO 5 0.853 7.272 -2.447
21 1HB PRO 5 1HB PRO 5 -0.314 9.383 -1.163
22 2HB PRO 5 2HB PRO 5 -1.224 8.027 -1.799
23 1HG PRO 5 1HG PRO 5 -0.539 8.646 1.010
24 2HG PRO 5 2HG PRO 5 -1.774 7.568 0.393
25 1HD PRO 5 1HD PRO 5 0.763 6.817 1.502
26 2HD PRO 5 2HD PRO 5 -0.423 5.748 0.780
27 H GLY 6 H GLY 6 1.654 9.336 -3.279
28 1HA GLY 6 1HA GLY 6 3.049 11.244 -2.208
29 2HA GLY 6 2HA GLY 6 4.167 9.935 -1.881
30 H ASN 7 H ASN 7 3.776 8.329 -4.231
31 HA ASN 7 HA ASN 7 3.896 9.859 -6.549
32 1HB ASN 7 1HB ASN 7 6.469 9.125 -6.915
33 2HB ASN 7 2HB ASN 7 6.057 10.667 -6.191
34 1HD2 ASN 7 1HD2 ASN 7 8.191 10.503 -5.266
35 2HD2 ASN 7 2HD2 ASN 7 8.444 9.634 -3.788
36 H GLN 8 H GLN 8 3.643 8.391 -8.299
37 HA GLN 8 HA GLN 8 3.568 5.623 -7.546
38 1HB GLN 8 1HB GLN 8 2.802 6.990 -10.164
39 2HB GLN 8 2HB GLN 8 2.479 5.314 -9.767
40 1HG GLN 8 1HG GLN 8 0.701 5.841 -8.424
41 2HG GLN 8 2HG GLN 8 1.539 7.187 -7.677
42 1HE2 GLN 8 1HE2 GLN 8 0.894 9.149 -8.136
43 2HE2 GLN 8 2HE2 GLN 8 -0.064 9.647 -9.491
44 H LEU 9 H LEU 9 5.938 7.721 -8.623
45 HA LEU 9 HA LEU 9 7.125 6.009 -10.597
46 1HB LEU 9 1HB LEU 9 8.742 7.674 -10.838
47 2HB LEU 9 2HB LEU 9 7.224 8.513 -10.586
48 HG LEU 9 HG LEU 9 8.587 8.103 -8.058
49 1HD1 LEU 9 1HD1 LEU 9 10.716 8.396 -8.634
50 2HD1 LEU 9 2HD1 LEU 9 10.287 8.785 -10.316
51 3HD1 LEU 9 3HD1 LEU 9 10.278 10.063 -9.078
52 1HD2 LEU 9 1HD2 LEU 9 6.748 9.782 -8.854
53 2HD2 LEU 9 2HD2 LEU 9 7.961 10.283 -7.652
54 3HD2 LEU 9 3HD2 LEU 9 8.140 10.771 -9.355
55 H LYS 10 H LYS 10 7.192 6.444 -7.099
56 HA LYS 10 HA LYS 10 9.703 5.192 -6.700
57 1HB LYS 10 1HB LYS 10 7.849 6.611 -5.156
58 2HB LYS 10 2HB LYS 10 7.845 5.001 -4.464
59 1HG LYS 10 1HG LYS 10 10.545 5.361 -4.830
60 2HG LYS 10 2HG LYS 10 10.048 7.019 -4.563
61 1HD LYS 10 1HD LYS 10 8.893 6.328 -2.448
62 2HD LYS 10 2HD LYS 10 9.406 4.674 -2.713
63 1HE LYS 10 1HE LYS 10 11.207 5.276 -1.425
64 2HE LYS 10 2HE LYS 10 11.826 5.945 -2.922
65 1HZ LYS 10 1HZ LYS 10 10.223 7.489 -0.951
66 2HZ LYS 10 2HZ LYS 10 11.844 7.575 -1.091
67 H CYS 11 H CYS 11 6.370 4.094 -7.209
68 HA CYS 11 HA CYS 11 6.823 1.484 -6.211
69 1HB CYS 11 1HB CYS 11 4.679 2.562 -8.053
70 2HB CYS 11 2HB CYS 11 4.685 0.952 -7.361
71 H ASN 12 H ASN 12 7.163 3.207 -9.328
72 HA ASN 12 HA ASN 12 7.410 0.922 -10.905
73 1HB ASN 12 1HB ASN 12 8.564 3.731 -11.321
74 2HB ASN 12 2HB ASN 12 8.434 2.514 -12.574
75 1HD2 ASN 12 1HD2 ASN 12 7.285 4.956 -12.882
76 2HD2 ASN 12 2HD2 ASN 12 5.556 4.848 -12.846
77 H ASN 13 H ASN 13 9.821 3.255 -9.475
78 HA ASN 13 HA ASN 13 12.084 2.063 -10.398
79 1HB ASN 13 1HB ASN 13 11.863 3.244 -7.591
80 2HB ASN 13 2HB ASN 13 13.247 3.298 -8.665
81 1HD2 ASN 13 1HD2 ASN 13 11.547 5.370 -7.311
82 2HD2 ASN 13 2HD2 ASN 13 11.086 6.489 -8.551
83 H HIS 14 H HIS 14 10.068 1.384 -7.478
84 HA HIS 14 HA HIS 14 11.830 -0.461 -6.320
85 1HB HIS 14 1HB HIS 14 10.182 0.569 -4.959
86 2HB HIS 14 2HB HIS 14 8.876 0.083 -6.022
87 HD1 HIS 14 HD1 HIS 14 11.169 -1.247 -3.336
88 HD2 HIS 14 HD2 HIS 14 7.927 -2.549 -5.657
89 HE1 HIS 14 HE1 HIS 14 10.385 -3.444 -2.301
90 H CYS 15 H CYS 15 9.129 -0.745 -8.679
91 HA CYS 15 HA CYS 15 9.040 -3.533 -8.678
92 1HB CYS 15 1HB CYS 15 8.261 -1.504 -10.777
93 2HB CYS 15 2HB CYS 15 7.960 -3.223 -10.936
94 H LYS 16 H LYS 16 11.256 -1.150 -10.025
95 HA LYS 16 HA LYS 16 12.334 -2.926 -12.004
96 1HB LYS 16 1HB LYS 16 12.653 -0.829 -12.778
97 2HB LYS 16 2HB LYS 16 12.669 -0.113 -11.178
98 1HG LYS 16 1HG LYS 16 14.998 -1.880 -11.805
99 2HG LYS 16 2HG LYS 16 14.902 -0.408 -12.752
100 1HD LYS 16 1HD LYS 16 14.528 0.821 -10.482
101 2HD LYS 16 2HD LYS 16 15.059 -0.668 -9.724
102 1HE LYS 16 1HE LYS 16 17.243 -0.528 -10.683
103 2HE LYS 16 2HE LYS 16 16.732 0.612 -11.913
104 1HZ LYS 16 1HZ LYS 16 17.870 1.297 -9.543
105 2HZ LYS 16 2HZ LYS 16 17.039 2.326 -10.494
106 H SER 17 H SER 17 13.048 -1.903 -8.649
107 HA SER 17 HA SER 17 15.591 -3.056 -8.582
108 1HB SER 17 1HB SER 17 14.901 -1.365 -6.953
109 2HB SER 17 2HB SER 17 13.602 -2.386 -6.370
110 HG SER 17 HG SER 17 15.548 -2.412 -5.007
111 H ILE 18 H ILE 18 12.272 -4.245 -7.888
112 HA ILE 18 HA ILE 18 13.160 -6.713 -6.787
113 HB ILE 18 HB ILE 18 10.827 -7.323 -6.841
114 1HG1 ILE 18 1HG1 ILE 18 10.509 -4.892 -8.613
115 2HG1 ILE 18 2HG1 ILE 18 10.111 -6.559 -8.984
116 1HG2 ILE 18 1HG2 ILE 18 11.256 -4.444 -5.994
117 2HG2 ILE 18 2HG2 ILE 18 9.913 -5.491 -5.476
118 3HG2 ILE 18 3HG2 ILE 18 11.585 -5.900 -5.023
119 1HD1 ILE 18 1HD1 ILE 18 8.705 -4.688 -7.043
120 2HD1 ILE 18 2HD1 ILE 18 8.022 -5.542 -8.448
121 3HD1 ILE 18 3HD1 ILE 18 8.464 -6.450 -6.982
122 H SER 19 H SER 19 11.613 -5.793 -9.946
123 HA SER 19 HA SER 19 13.152 -6.841 -11.704
124 1HB SER 19 1HB SER 19 13.606 -8.963 -10.854
125 2HB SER 19 2HB SER 19 12.014 -9.145 -10.147
126 HG SER 19 HG SER 19 11.152 -9.761 -12.097
127 H CYS 20 H CYS 20 11.493 -5.086 -12.309
128 HA CYS 20 HA CYS 20 9.482 -6.336 -13.928
129 1HB CYS 20 1HB CYS 20 8.793 -4.960 -11.419
130 2HB CYS 20 2HB CYS 20 7.925 -4.369 -12.822
131 H ARG 21 H ARG 21 8.233 -4.313 -15.084
132 HA ARG 21 HA ARG 21 10.394 -2.710 -16.061
133 1HB ARG 21 1HB ARG 21 7.540 -3.260 -16.929
134 2HB ARG 21 2HB ARG 21 8.373 -1.868 -17.592
135 1HG ARG 21 1HG ARG 21 9.886 -4.462 -17.603
136 2HG ARG 21 2HG ARG 21 8.524 -4.348 -18.700
137 1HD ARG 21 1HD ARG 21 10.058 -3.376 -20.110
138 2HD ARG 21 2HD ARG 21 9.707 -1.926 -19.192
139 HE ARG 21 HE ARG 21 11.812 -3.607 -18.012
140 1HH1 ARG 21 2HH2 ARG 21 11.111 -0.930 -20.225
141 2HH1 ARG 21 1HH2 ARG 21 12.712 -0.273 -20.136
142 1HH2 ARG 21 HH1 ARG 21 14.348 -1.354 -18.759
143 H ALA 22 H ALA 22 6.979 -2.128 -14.915
144 HA ALA 22 HA ALA 22 7.680 -0.078 -13.161
145 1HB ALA 22 1HB ALA 22 7.172 1.907 -14.343
146 2HB ALA 22 2HB ALA 22 8.201 0.982 -15.462
147 3HB ALA 22 3HB ALA 22 6.437 1.016 -15.698
148 H GLY 23 H GLY 23 5.818 0.674 -11.999
149 1HA GLY 23 1HA GLY 23 3.280 -0.599 -12.825
150 2HA GLY 23 2HA GLY 23 3.886 -0.714 -11.185
151 H TYR 24 H TYR 24 2.429 0.511 -10.009
152 HA TYR 24 HA TYR 24 2.646 3.278 -10.029
153 1HB TYR 24 1HB TYR 24 0.311 3.747 -10.966
154 2HB TYR 24 2HB TYR 24 1.403 3.115 -12.182
155 HD1 TYR 24 HD1 TYR 24 -1.134 1.916 -9.691
156 HD2 TYR 24 HD2 TYR 24 0.697 1.341 -13.515
157 HE1 TYR 24 HE1 TYR 24 -2.778 0.046 -10.205
158 HE2 TYR 24 HE2 TYR 24 -0.954 -0.527 -14.016
159 HH TYR 24 HH TYR 24 -2.323 -2.180 -12.469
160 H CYS 25 H CYS 25 0.151 4.083 -9.057
161 HA CYS 25 HA CYS 25 -0.104 2.306 -6.742
162 1HB CYS 25 1HB CYS 25 -0.773 5.250 -6.828
163 2HB CYS 25 2HB CYS 25 -0.690 4.208 -5.420
164 H ASP 26 H ASP 26 -2.010 1.169 -6.733
165 HA ASP 26 HA ASP 26 -3.894 1.132 -8.523
166 1HB ASP 26 1HB ASP 26 -3.808 0.588 -5.629
167 2HB ASP 26 2HB ASP 26 -5.430 0.984 -6.160
168 HD2 ASP 26 HD2 ASP 26 -6.156 -1.783 -7.612
169 H ALA 27 H ALA 27 -4.599 3.093 -9.508
170 HA ALA 27 HA ALA 27 -5.237 5.405 -8.040
171 1HB ALA 27 1HB ALA 27 -6.369 5.997 -10.293
172 2HB ALA 27 2HB ALA 27 -4.616 5.687 -10.303
173 3HB ALA 27 3HB ALA 27 -5.745 4.429 -10.862
174 H ALA 28 H ALA 28 -6.802 2.394 -8.263
175 HA ALA 28 HA ALA 28 -9.461 3.560 -7.976
176 1HB ALA 28 1HB ALA 28 -9.870 1.761 -9.285
177 2HB ALA 28 2HB ALA 28 -8.308 1.006 -8.885
178 3HB ALA 28 3HB ALA 28 -9.699 0.805 -7.793
179 H THR 29 H THR 29 -6.797 2.986 -6.060
180 HA THR 29 HA THR 29 -8.509 2.397 -3.735
181 HB THR 29 HB THR 29 -6.724 0.626 -4.672
182 HG1 THR 29 HG1 THR 29 -7.936 0.476 -2.664
183 1HG2 THR 29 1HG2 THR 29 -4.725 2.056 -4.636
184 2HG2 THR 29 2HG2 THR 29 -5.092 2.587 -2.978
185 3HG2 THR 29 3HG2 THR 29 -4.604 0.903 -3.286
186 H LEU 30 H LEU 30 -7.265 4.897 -5.280
187 HA LEU 30 HA LEU 30 -6.878 6.967 -4.550
188 1HB LEU 30 1HB LEU 30 -6.518 5.985 -1.730
189 2HB LEU 30 2HB LEU 30 -6.941 7.594 -2.282
190 HG LEU 30 HG LEU 30 -8.710 5.138 -2.443
191 1HD1 LEU 30 1HD1 LEU 30 -9.433 5.628 -0.405
192 2HD1 LEU 30 2HD1 LEU 30 -8.173 6.879 -0.284
193 3HD1 LEU 30 3HD1 LEU 30 -9.792 7.301 -0.893
194 1HD2 LEU 30 1HD2 LEU 30 -10.408 7.144 -2.919
195 2HD2 LEU 30 2HD2 LEU 30 -8.941 7.857 -3.629
196 3HD2 LEU 30 3HD2 LEU 30 -9.540 6.288 -4.215
197 H TRP 31 H TRP 31 -4.948 5.026 -5.558
198 HA TRP 31 HA TRP 31 -2.760 4.672 -5.739
199 1HB TRP 31 1HB TRP 31 -2.744 7.610 -5.032
200 2HB TRP 31 2HB TRP 31 -1.350 6.736 -5.634
201 HD1 TRP 31 HD1 TRP 31 -1.170 6.516 -8.261
202 HE1 TRP 31 HE1 TRP 31 -2.629 7.139 -10.369
203 HE3 TRP 31 HE3 TRP 31 -5.361 7.737 -5.653
204 HZ2 TRP 31 HZ2 TRP 31 -5.312 8.052 -10.702
205 HZ3 TRP 31 HZ3 TRP 31 -7.356 8.485 -6.946
206 HH2 TRP 31 HH2 TRP 31 -7.378 8.652 -9.385
207 H LEU 32 H LEU 32 -3.434 3.402 -3.549
208 HA LEU 32 HA LEU 32 -1.662 4.406 -1.432
209 1HB LEU 32 1HB LEU 32 -4.177 2.749 -1.321
210 2HB LEU 32 2HB LEU 32 -3.060 2.862 0.025
211 HG LEU 32 HG LEU 32 -4.986 4.859 -1.031
212 1HD1 LEU 32 1HD1 LEU 32 -4.131 5.086 1.743
213 2HD1 LEU 32 2HD1 LEU 32 -5.748 4.799 1.059
214 3HD1 LEU 32 3HD1 LEU 32 -4.640 3.432 1.325
215 1HD2 LEU 32 1HD2 LEU 32 -2.283 5.663 0.069
216 2HD2 LEU 32 2HD2 LEU 32 -2.991 6.088 -1.508
217 3HD2 LEU 32 3HD2 LEU 32 -3.696 6.743 -0.010
218 H ARG 33 H ARG 33 -2.603 1.671 -3.527
219 HA ARG 33 HA ARG 33 -0.692 -0.030 -2.265
220 1HB ARG 33 1HB ARG 33 -2.931 -0.320 -4.097
221 2HB ARG 33 2HB ARG 33 -1.529 -1.103 -4.799
222 1HG ARG 33 1HG ARG 33 -1.990 -1.618 -1.883
223 2HG ARG 33 2HG ARG 33 -3.175 -2.306 -2.977
224 1HD ARG 33 1HD ARG 33 -1.691 -4.036 -3.184
225 2HD ARG 33 2HD ARG 33 -0.830 -2.971 -4.278
226 HE ARG 33 HE ARG 33 0.822 -2.628 -2.638
227 1HH1 ARG 33 2HH2 ARG 33 -1.991 -4.200 -1.163
228 2HH1 ARG 33 1HH2 ARG 33 -1.181 -4.522 0.334
229 1HH2 ARG 33 HH1 ARG 33 1.100 -3.840 0.605
230 H CYS 34 H CYS 34 0.771 -1.346 -4.045
231 HA CYS 34 HA CYS 34 1.902 0.621 -5.882
232 1HB CYS 34 1HB CYS 34 3.226 -0.636 -3.565
233 2HB CYS 34 2HB CYS 34 4.131 -0.722 -5.064
234 H THR 35 H THR 35 0.773 -0.575 -7.564
235 HA THR 35 HA THR 35 1.270 -3.408 -7.805
236 HB THR 35 HB THR 35 -0.690 -1.513 -8.654
237 HG1 THR 35 HG1 THR 35 -1.669 -3.547 -9.121
238 1HG2 THR 35 1HG2 THR 35 0.531 -1.149 -10.775
239 2HG2 THR 35 2HG2 THR 35 0.766 -2.903 -10.965
240 3HG2 THR 35 3HG2 THR 35 -0.867 -2.207 -11.081
241 H CYS 36 H CYS 36 2.152 -4.372 -9.817
242 HA CYS 36 HA CYS 36 4.226 -2.647 -10.951
243 1HB CYS 36 1HB CYS 36 4.551 -5.488 -9.971
244 2HB CYS 36 2HB CYS 36 5.711 -4.671 -10.999
245 H THR 37 H THR 37 3.952 -2.537 -13.153
246 HA THR 37 HA THR 37 2.580 -4.805 -14.440
247 HB THR 37 HB THR 37 1.456 -3.210 -15.825
248 HG1 THR 37 HG1 THR 37 3.505 -1.427 -14.709
249 1HG2 THR 37 1HG2 THR 37 1.303 -2.832 -13.026
250 2HG2 THR 37 2HG2 THR 37 1.580 -1.199 -13.678
251 3HG2 THR 37 3HG2 THR 37 0.186 -2.155 -14.236
252 H ASP 38 H ASP 38 3.332 -5.559 -16.445
253 HA ASP 38 HA ASP 38 4.829 -6.086 -17.919
254 1HB ASP 38 1HB ASP 38 5.625 -3.188 -17.475
255 2HB ASP 38 2HB ASP 38 6.550 -4.197 -18.569
256 HD2 ASP 38 HD2 ASP 38 3.948 -2.207 -18.363
257 H CYS 39 H CYS 39 6.553 -7.490 -17.526
258 HA CYS 39 HA CYS 39 8.729 -6.548 -15.862
259 1HB CYS 39 1HB CYS 39 7.348 -9.164 -15.246
260 2HB CYS 39 2HB CYS 39 8.719 -8.462 -14.408
261 H ASN 40 H ASN 40 10.707 -7.792 -16.275
262 HA ASN 40 HA ASN 40 10.747 -8.795 -18.914
263 1HB ASN 40 1HB ASN 40 12.746 -8.280 -16.719
264 2HB ASN 40 2HB ASN 40 13.222 -9.437 -17.946
265 1HD2 ASN 40 1HD2 ASN 40 13.976 -6.587 -17.208
266 2HD2 ASN 40 2HD2 ASN 40 13.955 -5.708 -18.700
267 H GLY 41 H GLY 41 9.075 -10.588 -18.268
268 1HA GLY 41 1HA GLY 41 10.372 -12.856 -16.902
269 2HA GLY 41 2HA GLY 41 8.649 -12.612 -17.108
270 H LYS 42 H LYS 42 11.469 -14.125 -18.366
271 HA LYS 42 HA LYS 42 11.807 -15.480 -20.076
272 1HB LYS 42 1HB LYS 42 9.755 -16.584 -19.507
273 2HB LYS 42 2HB LYS 42 8.791 -15.352 -20.295
274 1HG LYS 42 1HG LYS 42 9.536 -16.014 -22.489
275 2HG LYS 42 2HG LYS 42 10.856 -16.967 -21.841
276 1HD LYS 42 1HD LYS 42 8.543 -18.049 -20.621
277 2HD LYS 42 2HD LYS 42 8.056 -17.732 -22.274
278 1HE LYS 42 1HE LYS 42 10.646 -18.855 -22.506
279 2HE LYS 42 2HE LYS 42 9.875 -19.793 -21.241
280 1HZ LYS 42 1HZ LYS 42 7.960 -20.094 -22.791
281 2HZ LYS 42 2HZ LYS 42 8.793 -19.341 -23.971
282 H LYS 43 H LYS 43 12.222 -15.435 -22.377
283 HA LYS 43 HA LYS 43 12.240 -12.746 -23.364
284 1HB LYS 43 1HB LYS 43 13.871 -14.966 -23.640
285 2HB LYS 43 2HB LYS 43 13.082 -14.872 -25.202
286 1HG LYS 43 1HG LYS 43 13.719 -12.450 -25.367
287 2HG LYS 43 2HG LYS 43 14.530 -12.563 -23.818
288 1HD LYS 43 1HD LYS 43 15.278 -14.513 -26.009
289 2HD LYS 43 2HD LYS 43 15.893 -12.874 -26.087
290 1HE LYS 43 1HE LYS 43 17.068 -13.086 -24.007
291 2HE LYS 43 2HE LYS 43 16.153 -14.503 -23.532
292 1HZ LYS 43 1HZ LYS 43 17.912 -15.617 -24.386
293 2HZ LYS 43 2HZ LYS 43 17.294 -15.299 -25.859
Start of MODEL 10
1 1H GLY 1 H GLY 1 1.103 -0.242 -0.186
2 1HA GLY 1 1HA GLY 1 2.238 1.619 -1.962
3 2HA GLY 1 2HA GLY 1 1.537 1.953 -0.392
4 H PHE 2 H PHE 2 4.539 0.808 -2.036
5 HA PHE 2 HA PHE 2 6.148 0.929 0.264
6 1HB PHE 2 1HB PHE 2 6.284 0.143 -2.447
7 2HB PHE 2 2HB PHE 2 7.364 1.522 -2.404
8 HD1 PHE 2 HD1 PHE 2 9.466 1.420 -1.229
9 HD2 PHE 2 HD2 PHE 2 6.790 -1.872 -1.132
10 HE1 PHE 2 HE1 PHE 2 11.292 -0.036 -0.311
11 HE2 PHE 2 HE2 PHE 2 8.616 -3.329 -0.214
12 HZ PHE 2 HZ PHE 2 10.845 -2.394 0.186
13 H GLY 3 H GLY 3 5.346 3.291 -2.339
14 1HA GLY 3 1HA GLY 3 6.804 5.344 -0.783
15 2HA GLY 3 2HA GLY 3 6.709 5.320 -2.532
16 H CYS 4 H CYS 4 3.866 4.390 -2.604
17 HA CYS 4 HA CYS 4 2.682 6.951 -2.484
18 1HB CYS 4 1HB CYS 4 1.852 4.219 -3.291
19 2HB CYS 4 2HB CYS 4 0.567 5.310 -2.812
20 HA PRO 5 HA PRO 5 0.450 7.252 -2.410
21 1HB PRO 5 1HB PRO 5 -0.914 9.302 -1.225
22 2HB PRO 5 2HB PRO 5 -1.638 7.745 -1.574
23 1HG PRO 5 1HG PRO 5 -0.754 8.837 1.027
24 2HG PRO 5 2HG PRO 5 -1.842 7.501 0.711
25 1HD PRO 5 1HD PRO 5 0.898 7.322 1.540
26 2HD PRO 5 2HD PRO 5 -0.156 5.990 1.112
27 H GLY 6 H GLY 6 0.831 9.228 -3.609
28 1HA GLY 6 1HA GLY 6 2.021 11.103 -4.057
29 2HA GLY 6 2HA GLY 6 2.492 11.210 -2.372
30 H ASN 7 H ASN 7 2.975 8.616 -4.877
31 HA ASN 7 HA ASN 7 5.584 9.160 -5.417
32 1HB ASN 7 1HB ASN 7 5.477 8.338 -2.772
33 2HB ASN 7 2HB ASN 7 5.727 6.802 -3.578
34 1HD2 ASN 7 1HD2 ASN 7 7.536 8.124 -1.840
35 2HD2 ASN 7 2HD2 ASN 7 8.987 8.490 -2.711
36 H GLN 8 H GLN 8 4.365 8.402 -7.386
37 HA GLN 8 HA GLN 8 3.695 5.601 -7.392
38 1HB GLN 8 1HB GLN 8 2.103 7.154 -8.417
39 2HB GLN 8 2HB GLN 8 3.343 7.800 -9.472
40 1HG GLN 8 1HG GLN 8 3.627 5.387 -10.376
41 2HG GLN 8 2HG GLN 8 2.148 4.998 -9.522
42 1HE2 GLN 8 1HE2 GLN 8 3.304 5.711 -12.429
43 2HE2 GLN 8 2HE2 GLN 8 1.968 6.523 -13.175
44 H LEU 9 H LEU 9 6.244 7.804 -8.392
45 HA LEU 9 HA LEU 9 7.324 6.105 -10.405
46 1HB LEU 9 1HB LEU 9 8.990 7.698 -10.629
47 2HB LEU 9 2HB LEU 9 7.558 8.614 -10.204
48 HG LEU 9 HG LEU 9 9.174 7.850 -7.873
49 1HD1 LEU 9 1HD1 LEU 9 10.424 9.962 -9.601
50 2HD1 LEU 9 2HD1 LEU 9 11.123 9.022 -8.261
51 3HD1 LEU 9 3HD1 LEU 9 10.843 8.248 -9.839
52 1HD2 LEU 9 1HD2 LEU 9 8.506 9.875 -7.053
53 2HD2 LEU 9 2HD2 LEU 9 8.549 10.668 -8.646
54 3HD2 LEU 9 3HD2 LEU 9 7.205 9.577 -8.231
55 H LYS 10 H LYS 10 7.457 6.300 -6.895
56 HA LYS 10 HA LYS 10 9.913 4.916 -6.611
57 1HB LYS 10 1HB LYS 10 7.794 5.995 -4.887
58 2HB LYS 10 2HB LYS 10 8.493 4.511 -4.273
59 1HG LYS 10 1HG LYS 10 10.780 5.800 -5.044
60 2HG LYS 10 2HG LYS 10 9.774 7.189 -4.679
61 1HD LYS 10 1HD LYS 10 9.428 6.480 -2.403
62 2HD LYS 10 2HD LYS 10 10.014 4.861 -2.731
63 1HE LYS 10 1HE LYS 10 11.927 5.745 -1.758
64 2HE LYS 10 2HE LYS 10 12.254 6.170 -3.426
65 1HZ LYS 10 1HZ LYS 10 10.959 8.329 -2.796
66 2HZ LYS 10 2HZ LYS 10 11.319 7.927 -1.259
67 H CYS 11 H CYS 11 6.568 4.003 -7.264
68 HA CYS 11 HA CYS 11 6.853 1.322 -6.399
69 1HB CYS 11 1HB CYS 11 4.850 2.541 -8.312
70 2HB CYS 11 2HB CYS 11 4.740 0.948 -7.590
71 H ASN 12 H ASN 12 7.407 3.192 -9.400
72 HA ASN 12 HA ASN 12 7.664 0.938 -11.049
73 1HB ASN 12 1HB ASN 12 7.188 3.096 -12.068
74 2HB ASN 12 2HB ASN 12 8.568 3.847 -11.291
75 1HD2 ASN 12 1HD2 ASN 12 9.002 4.511 -13.515
76 2HD2 ASN 12 2HD2 ASN 12 9.922 3.476 -14.555
77 H ASN 13 H ASN 13 9.976 3.221 -9.409
78 HA ASN 13 HA ASN 13 12.287 2.067 -10.345
79 1HB ASN 13 1HB ASN 13 11.940 3.313 -7.574
80 2HB ASN 13 2HB ASN 13 13.403 3.285 -8.539
81 1HD2 ASN 13 1HD2 ASN 13 11.643 5.446 -7.392
82 2HD2 ASN 13 2HD2 ASN 13 11.324 6.535 -8.701
83 H HIS 14 H HIS 14 10.034 1.208 -7.720
84 HA HIS 14 HA HIS 14 11.816 -0.527 -6.365
85 1HB HIS 14 1HB HIS 14 10.105 0.318 -5.040
86 2HB HIS 14 2HB HIS 14 8.875 0.064 -6.263
87 HD1 HIS 14 HD1 HIS 14 10.941 -1.863 -3.715
88 HD2 HIS 14 HD2 HIS 14 7.561 -2.384 -6.143
89 HE1 HIS 14 HE1 HIS 14 9.863 -4.054 -2.977
90 H CYS 15 H CYS 15 9.046 -1.032 -8.659
91 HA CYS 15 HA CYS 15 9.296 -3.794 -8.753
92 1HB CYS 15 1HB CYS 15 8.268 -1.935 -10.908
93 2HB CYS 15 2HB CYS 15 7.980 -3.660 -10.812
94 H LYS 16 H LYS 16 11.234 -1.184 -10.043
95 HA LYS 16 HA LYS 16 12.383 -2.775 -12.151
96 1HB LYS 16 1HB LYS 16 12.535 -0.676 -12.920
97 2HB LYS 16 2HB LYS 16 12.364 0.030 -11.326
98 1HG LYS 16 1HG LYS 16 14.959 -1.366 -11.958
99 2HG LYS 16 2HG LYS 16 14.670 0.186 -12.717
100 1HD LYS 16 1HD LYS 16 14.034 1.008 -10.303
101 2HD LYS 16 2HD LYS 16 14.833 -0.451 -9.751
102 1HE LYS 16 1HE LYS 16 16.310 1.641 -9.870
103 2HE LYS 16 2HE LYS 16 16.949 0.221 -10.671
104 1HZ LYS 16 1HZ LYS 16 16.635 2.630 -11.860
105 2HZ LYS 16 2HZ LYS 16 16.778 1.230 -12.677
106 H SER 17 H SER 17 13.088 -1.812 -8.785
107 HA SER 17 HA SER 17 15.754 -2.668 -8.856
108 1HB SER 17 1HB SER 17 14.533 -1.114 -7.155
109 2HB SER 17 2HB SER 17 14.007 -2.591 -6.370
110 HG SER 17 HG SER 17 16.742 -1.756 -6.835
111 H ILE 18 H ILE 18 12.608 -4.240 -8.260
112 HA ILE 18 HA ILE 18 13.799 -6.628 -7.207
113 HB ILE 18 HB ILE 18 11.541 -7.474 -7.172
114 1HG1 ILE 18 1HG1 ILE 18 10.891 -5.040 -8.843
115 2HG1 ILE 18 2HG1 ILE 18 10.631 -6.726 -9.241
116 1HG2 ILE 18 1HG2 ILE 18 11.552 -4.585 -6.264
117 2HG2 ILE 18 2HG2 ILE 18 10.576 -5.923 -5.613
118 3HG2 ILE 18 3HG2 ILE 18 12.343 -5.922 -5.395
119 1HD1 ILE 18 1HD1 ILE 18 9.197 -5.095 -7.105
120 2HD1 ILE 18 2HD1 ILE 18 8.494 -5.833 -8.564
121 3HD1 ILE 18 3HD1 ILE 18 9.058 -6.866 -7.228
122 H SER 19 H SER 19 11.991 -5.774 -10.245
123 HA SER 19 HA SER 19 13.521 -6.574 -12.128
124 1HB SER 19 1HB SER 19 12.795 -9.044 -10.586
125 2HB SER 19 2HB SER 19 12.798 -9.178 -12.333
126 HG SER 19 HG SER 19 14.891 -9.648 -11.782
127 H CYS 20 H CYS 20 11.619 -5.022 -12.557
128 HA CYS 20 HA CYS 20 9.555 -6.551 -13.917
129 1HB CYS 20 1HB CYS 20 9.057 -5.289 -11.474
130 2HB CYS 20 2HB CYS 20 8.428 -4.179 -12.676
131 H ARG 21 H ARG 21 8.076 -4.066 -14.576
132 HA ARG 21 HA ARG 21 10.139 -2.802 -16.194
133 1HB ARG 21 1HB ARG 21 8.746 -3.871 -17.775
134 2HB ARG 21 2HB ARG 21 7.300 -3.642 -16.813
135 1HG ARG 21 1HG ARG 21 7.300 -2.156 -18.806
136 2HG ARG 21 2HG ARG 21 7.289 -1.226 -17.321
137 1HD ARG 21 1HD ARG 21 9.548 -0.556 -17.558
138 2HD ARG 21 2HD ARG 21 9.949 -1.907 -18.600
139 HE ARG 21 HE ARG 21 7.961 -0.024 -19.705
140 1HH1 ARG 21 2HH2 ARG 21 11.378 -0.946 -19.538
141 2HH1 ARG 21 1HH2 ARG 21 11.804 -0.106 -20.991
142 1HH2 ARG 21 HH1 ARG 21 10.110 1.082 -22.200
143 H ALA 22 H ALA 22 6.848 -2.318 -14.715
144 HA ALA 22 HA ALA 22 7.567 0.024 -13.386
145 1HB ALA 22 1HB ALA 22 6.826 0.339 -16.213
146 2HB ALA 22 2HB ALA 22 5.794 1.288 -15.115
147 3HB ALA 22 3HB ALA 22 7.560 1.508 -15.089
148 H GLY 23 H GLY 23 6.003 0.460 -11.845
149 1HA GLY 23 1HA GLY 23 3.495 -1.088 -12.116
150 2HA GLY 23 2HA GLY 23 4.332 -0.780 -10.606
151 H TYR 24 H TYR 24 2.072 0.053 -10.028
152 HA TYR 24 HA TYR 24 2.128 2.885 -10.086
153 1HB TYR 24 1HB TYR 24 0.062 3.156 -11.439
154 2HB TYR 24 2HB TYR 24 1.217 2.249 -12.397
155 HD1 TYR 24 HD1 TYR 24 -1.593 1.665 -9.977
156 HD2 TYR 24 HD2 TYR 24 0.511 0.294 -13.442
157 HE1 TYR 24 HE1 TYR 24 -3.299 -0.195 -10.286
158 HE2 TYR 24 HE2 TYR 24 -1.203 -1.560 -13.740
159 HH TYR 24 HH TYR 24 -2.955 -2.743 -11.659
160 H CYS 25 H CYS 25 0.608 3.808 -8.598
161 HA CYS 25 HA CYS 25 -0.255 1.908 -6.642
162 1HB CYS 25 1HB CYS 25 -0.729 4.891 -6.659
163 2HB CYS 25 2HB CYS 25 -0.800 3.805 -5.285
164 H ASP 26 H ASP 26 -2.296 1.016 -6.543
165 HA ASP 26 HA ASP 26 -4.080 0.985 -8.430
166 1HB ASP 26 1HB ASP 26 -4.079 0.065 -5.909
167 2HB ASP 26 2HB ASP 26 -5.188 1.397 -5.648
168 HD2 ASP 26 HD2 ASP 26 -7.822 -0.219 -7.208
169 H ALA 27 H ALA 27 -4.775 2.779 -9.641
170 HA ALA 27 HA ALA 27 -5.186 5.319 -8.429
171 1HB ALA 27 1HB ALA 27 -6.199 5.718 -10.815
172 2HB ALA 27 2HB ALA 27 -4.455 5.405 -10.650
173 3HB ALA 27 3HB ALA 27 -5.547 4.099 -11.168
174 H ALA 28 H ALA 28 -6.930 2.481 -8.224
175 HA ALA 28 HA ALA 28 -9.497 3.908 -8.188
176 1HB ALA 28 1HB ALA 28 -9.528 2.066 -9.736
177 2HB ALA 28 2HB ALA 28 -8.773 0.978 -8.547
178 3HB ALA 28 3HB ALA 28 -10.437 1.555 -8.294
179 H THR 29 H THR 29 -7.079 3.560 -6.160
180 HA THR 29 HA THR 29 -8.850 2.958 -3.899
181 HB THR 29 HB THR 29 -6.959 1.155 -4.822
182 HG1 THR 29 HG1 THR 29 -7.370 0.313 -2.675
183 1HG2 THR 29 1HG2 THR 29 -5.686 2.240 -2.323
184 2HG2 THR 29 2HG2 THR 29 -4.945 1.333 -3.664
185 3HG2 THR 29 3HG2 THR 29 -5.282 3.072 -3.843
186 H LEU 30 H LEU 30 -7.545 5.380 -5.417
187 HA LEU 30 HA LEU 30 -7.061 7.434 -4.703
188 1HB LEU 30 1HB LEU 30 -6.689 6.442 -1.888
189 2HB LEU 30 2HB LEU 30 -7.058 8.065 -2.434
190 HG LEU 30 HG LEU 30 -8.932 5.689 -2.614
191 1HD1 LEU 30 1HD1 LEU 30 -10.191 7.304 -0.923
192 2HD1 LEU 30 2HD1 LEU 30 -8.998 6.104 -0.374
193 3HD1 LEU 30 3HD1 LEU 30 -8.524 7.809 -0.556
194 1HD2 LEU 30 1HD2 LEU 30 -9.256 7.346 -4.418
195 2HD2 LEU 30 2HD2 LEU 30 -10.636 7.264 -3.298
196 3HD2 LEU 30 3HD2 LEU 30 -9.481 8.614 -3.188
197 H TRP 31 H TRP 31 -5.211 5.027 -5.358
198 HA TRP 31 HA TRP 31 -3.043 4.678 -5.641
199 1HB TRP 31 1HB TRP 31 -2.960 7.664 -5.223
200 2HB TRP 31 2HB TRP 31 -1.540 6.722 -5.629
201 HD1 TRP 31 HD1 TRP 31 -1.264 6.025 -8.190
202 HE1 TRP 31 HE1 TRP 31 -2.547 6.482 -10.450
203 HE3 TRP 31 HE3 TRP 31 -5.428 7.991 -6.035
204 HZ2 TRP 31 HZ2 TRP 31 -5.103 7.591 -11.068
205 HZ3 TRP 31 HZ3 TRP 31 -7.272 8.736 -7.539
206 HH2 TRP 31 HH2 TRP 31 -7.157 8.561 -9.974
207 H LEU 32 H LEU 32 -3.439 3.426 -3.529
208 HA LEU 32 HA LEU 32 -1.805 4.623 -1.398
209 1HB LEU 32 1HB LEU 32 -4.325 3.012 -1.319
210 2HB LEU 32 2HB LEU 32 -3.180 2.879 0.000
211 HG LEU 32 HG LEU 32 -5.201 4.645 -0.046
212 1HD1 LEU 32 1HD1 LEU 32 -2.777 4.278 1.449
213 2HD1 LEU 32 2HD1 LEU 32 -3.151 6.014 1.333
214 3HD1 LEU 32 3HD1 LEU 32 -4.359 4.885 1.990
215 1HD2 LEU 32 1HD2 LEU 32 -2.860 6.256 -1.096
216 2HD2 LEU 32 2HD2 LEU 32 -4.297 5.804 -2.043
217 3HD2 LEU 32 3HD2 LEU 32 -4.463 6.866 -0.624
218 H ARG 33 H ARG 33 -2.702 1.667 -3.246
219 HA ARG 33 HA ARG 33 -0.629 0.189 -1.982
220 1HB ARG 33 1HB ARG 33 -2.925 -0.359 -3.670
221 2HB ARG 33 2HB ARG 33 -1.518 -1.096 -4.407
222 1HG ARG 33 1HG ARG 33 -1.767 -2.805 -2.933
223 2HG ARG 33 2HG ARG 33 -1.200 -1.710 -1.688
224 1HD ARG 33 1HD ARG 33 -3.295 -1.454 -0.778
225 2HD ARG 33 2HD ARG 33 -4.072 -1.343 -2.344
226 HE ARG 33 HE ARG 33 -3.150 -4.040 -1.913
227 1HH1 ARG 33 2HH2 ARG 33 -5.684 -1.792 -0.869
228 2HH1 ARG 33 1HH2 ARG 33 -6.812 -3.049 -0.483
229 1HH2 ARG 33 HH1 ARG 33 -6.175 -5.338 -0.805
230 H CYS 34 H CYS 34 0.779 -1.205 -3.794
231 HA CYS 34 HA CYS 34 1.736 0.683 -5.797
232 1HB CYS 34 1HB CYS 34 3.197 -0.203 -3.423
233 2HB CYS 34 2HB CYS 34 4.058 -0.536 -4.912
234 H THR 35 H THR 35 0.642 -0.696 -7.345
235 HA THR 35 HA THR 35 1.286 -3.511 -7.376
236 HB THR 35 HB THR 35 -0.849 -1.876 -8.216
237 HG1 THR 35 HG1 THR 35 -1.416 -4.102 -9.155
238 1HG2 THR 35 1HG2 THR 35 0.616 -3.110 -10.609
239 2HG2 THR 35 2HG2 THR 35 -1.048 -2.481 -10.639
240 3HG2 THR 35 3HG2 THR 35 0.318 -1.372 -10.367
241 H CYS 36 H CYS 36 2.103 -4.568 -9.394
242 HA CYS 36 HA CYS 36 4.124 -2.846 -10.632
243 1HB CYS 36 1HB CYS 36 4.411 -5.662 -9.589
244 2HB CYS 36 2HB CYS 36 5.508 -4.992 -10.780
245 H THR 37 H THR 37 3.938 -2.793 -12.854
246 HA THR 37 HA THR 37 2.478 -5.017 -14.120
247 HB THR 37 HB THR 37 1.765 -3.034 -15.727
248 HG1 THR 37 HG1 THR 37 2.811 -1.249 -14.886
249 1HG2 THR 37 1HG2 THR 37 0.463 -2.459 -13.132
250 2HG2 THR 37 2HG2 THR 37 -0.260 -3.059 -14.644
251 3HG2 THR 37 3HG2 THR 37 0.502 -4.198 -13.508
252 H ASP 38 H ASP 38 3.179 -5.706 -16.163
253 HA ASP 38 HA ASP 38 4.632 -6.148 -17.709
254 1HB ASP 38 1HB ASP 38 5.388 -3.242 -17.225
255 2HB ASP 38 2HB ASP 38 6.247 -4.205 -18.410
256 HD2 ASP 38 HD2 ASP 38 3.509 -2.423 -17.824
257 H CYS 39 H CYS 39 6.647 -7.260 -17.708
258 HA CYS 39 HA CYS 39 8.753 -6.360 -15.986
259 1HB CYS 39 1HB CYS 39 7.553 -9.080 -15.446
260 2HB CYS 39 2HB CYS 39 8.926 -8.348 -14.640
261 H ASN 40 H ASN 40 10.723 -7.862 -16.320
262 HA ASN 40 HA ASN 40 10.546 -8.931 -19.022
263 1HB ASN 40 1HB ASN 40 12.628 -7.406 -17.507
264 2HB ASN 40 2HB ASN 40 13.258 -8.719 -18.482
265 1HD2 ASN 40 1HD2 ASN 40 12.631 -5.543 -18.480
266 2HD2 ASN 40 2HD2 ASN 40 12.365 -5.226 -20.162
267 H GLY 41 H GLY 41 9.694 -10.992 -17.991
268 1HA GLY 41 1HA GLY 41 11.916 -12.699 -17.144
269 2HA GLY 41 2HA GLY 41 10.555 -12.537 -16.053
270 H LYS 42 H LYS 42 8.283 -12.836 -17.164
271 HA LYS 42 HA LYS 42 8.154 -14.355 -19.525
272 1HB LYS 42 1HB LYS 42 9.223 -16.089 -18.166
273 2HB LYS 42 2HB LYS 42 7.973 -15.941 -16.948
274 1HG LYS 42 1HG LYS 42 6.814 -16.334 -19.621
275 2HG LYS 42 2HG LYS 42 7.927 -17.626 -19.214
276 1HD LYS 42 1HD LYS 42 6.709 -17.819 -16.957
277 2HD LYS 42 2HD LYS 42 5.508 -16.712 -17.594
278 1HE LYS 42 1HE LYS 42 6.055 -18.876 -19.502
279 2HE LYS 42 2HE LYS 42 5.579 -19.521 -17.943
280 1HZ LYS 42 1HZ LYS 42 4.050 -17.500 -19.496
281 2HZ LYS 42 2HZ LYS 42 3.627 -19.059 -19.292
282 H LYS 43 H LYS 43 6.054 -14.342 -20.288
283 HA LYS 43 HA LYS 43 4.256 -12.594 -19.173
284 1HB LYS 43 1HB LYS 43 4.368 -14.428 -21.402
285 2HB LYS 43 2HB LYS 43 2.777 -14.479 -20.674
286 1HG LYS 43 1HG LYS 43 4.084 -11.792 -21.155
287 2HG LYS 43 2HG LYS 43 3.366 -12.641 -22.509
288 1HD LYS 43 1HD LYS 43 1.792 -12.278 -19.939
289 2HD LYS 43 2HD LYS 43 1.888 -10.970 -21.100
290 1HE LYS 43 1HE LYS 43 0.456 -12.001 -22.553
291 2HE LYS 43 2HE LYS 43 1.272 -13.543 -22.401
292 1HZ LYS 43 1HZ LYS 43 -1.036 -13.531 -21.497
293 2HZ LYS 43 2HZ LYS 43 0.059 -13.982 -20.379
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