Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
11741 | 1ryg RC | 6067 | cing | 1-original | 4 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 1H GLU 1 1H GLU 1 12.973 1.347 1.808
2 2H GLU 1 2H GLU 1 12.987 2.286 3.222
3 3H GLU 1 3H GLU 1 14.363 2.225 2.229
4 HA GLU 1 HA GLU 1 12.846 4.290 2.084
5 1HB GLU 1 2HB GLU 1 13.461 4.419 -0.314
6 2HB GLU 1 1HB GLU 1 14.770 3.718 0.635
7 1HG GLU 1 2HG GLU 1 13.654 1.429 0.016
8 2HG GLU 1 1HG GLU 1 12.878 2.353 -1.270
9 H CYS 2 H CYS 2 10.796 2.645 2.833
10 HA CYS 2 HA CYS 2 8.765 3.175 0.755
11 1HB CYS 2 2HB CYS 2 8.055 0.748 0.815
12 2HB CYS 2 1HB CYS 2 9.628 1.016 0.067
13 H LEU 3 H LEU 3 6.537 2.467 1.631
14 HA LEU 3 HA LEU 3 6.359 3.288 4.478
15 1HB LEU 3 2HB LEU 3 4.358 2.893 2.231
16 2HB LEU 3 1HB LEU 3 3.914 3.433 3.850
17 HG LEU 3 HG LEU 3 6.036 4.859 2.239
18 1HD1 LEU 3 1HD1 LEU 3 4.257 6.455 1.562
19 2HD1 LEU 3 2HD1 LEU 3 3.047 5.392 2.280
20 3HD1 LEU 3 3HD1 LEU 3 3.984 4.848 0.888
21 1HD2 LEU 3 1HD2 LEU 3 4.153 5.997 4.307
22 2HD2 LEU 3 2HD2 LEU 3 5.732 6.601 3.805
23 3HD2 LEU 3 3HD2 LEU 3 5.618 5.147 4.797
24 H GLY 4 H GLY 4 5.380 1.971 6.075
25 1HA GLY 4 2HA GLY 4 5.571 -0.902 5.662
26 2HA GLY 4 1HA GLY 4 5.041 -0.103 7.142
27 H PHE 5 H PHE 5 3.489 -2.077 6.889
28 HA PHE 5 HA PHE 5 1.335 -1.859 4.939
29 1HB PHE 5 2HB PHE 5 1.930 -4.016 5.787
30 2HB PHE 5 1HB PHE 5 1.844 -3.462 7.458
31 HD1 PHE 5 HD1 PHE 5 0.041 -4.383 8.597
32 HD2 PHE 5 HD2 PHE 5 -0.453 -3.247 4.483
33 HE1 PHE 5 HE1 PHE 5 -2.347 -5.039 8.701
34 HE2 PHE 5 HE2 PHE 5 -2.841 -3.902 4.591
35 HZ PHE 5 HZ PHE 5 -3.788 -4.799 6.698
36 H GLY 6 H GLY 6 -0.585 -0.772 5.161
37 1HA GLY 6 2HA GLY 6 -2.419 0.241 6.285
38 2HA GLY 6 1HA GLY 6 -1.545 0.095 7.807
39 H LYS 7 H LYS 7 0.753 1.381 5.878
40 HA LYS 7 HA LYS 7 0.491 4.045 6.982
41 1HB LYS 7 2HB LYS 7 2.475 2.451 5.899
42 2HB LYS 7 1HB LYS 7 2.243 3.668 4.643
43 1HG LYS 7 2HG LYS 7 3.547 5.029 5.884
44 2HG LYS 7 1HG LYS 7 2.200 5.135 7.018
45 1HD LYS 7 2HD LYS 7 3.298 2.751 7.759
46 2HD LYS 7 1HD LYS 7 4.737 3.625 7.235
47 1HE LYS 7 2HE LYS 7 2.760 5.019 9.027
48 2HE LYS 7 1HE LYS 7 3.927 3.882 9.729
49 1HZ LYS 7 1HZ LYS 7 4.584 6.170 7.945
50 2HZ LYS 7 2HZ LYS 7 5.706 5.053 8.565
51 3HZ LYS 7 3HZ LYS 7 4.877 6.101 9.613
52 H GLY 8 H GLY 8 -0.583 5.781 6.113
53 1HA GLY 8 2HA GLY 8 -2.318 5.558 3.873
54 2HA GLY 8 1HA GLY 8 -1.827 7.080 4.609
55 H CYS 9 H CYS 9 -1.906 5.658 1.719
56 HA CYS 9 HA CYS 9 0.449 7.186 0.724
57 1HB CYS 9 2HB CYS 9 1.025 5.129 -0.673
58 2HB CYS 9 1HB CYS 9 1.324 4.969 1.056
59 H ASN 10 H ASN 10 0.367 6.756 -1.898
60 HA ASN 10 HA ASN 10 -2.399 7.548 -2.695
61 1HB ASN 10 2HB ASN 10 0.320 8.315 -3.342
62 2HB ASN 10 1HB ASN 10 -0.546 7.863 -4.810
63 1HD2 ASN 10 1HD2 ASN 10 -0.158 10.365 -2.462
64 2HD2 ASN 10 2HD2 ASN 10 -1.436 11.352 -2.985
65 HA PRO 11 HA PRO 11 -2.872 3.573 -4.623
66 1HB PRO 11 2HB PRO 11 -5.028 4.186 -6.207
67 2HB PRO 11 1HB PRO 11 -5.155 3.886 -4.462
68 1HG PRO 11 2HG PRO 11 -5.080 6.474 -5.935
69 2HG PRO 11 1HG PRO 11 -6.060 5.998 -4.538
70 1HD PRO 11 2HD PRO 11 -3.840 7.542 -4.321
71 2HD PRO 11 1HD PRO 11 -4.377 6.434 -3.038
72 H SER 12 H SER 12 -2.962 6.533 -6.645
73 HA SER 12 HA SER 12 -2.257 5.210 -9.120
74 1HB SER 12 2HB SER 12 -1.784 7.582 -9.814
75 2HB SER 12 1HB SER 12 -3.359 7.384 -9.055
76 HG SER 12 HG SER 12 -1.156 8.790 -8.229
77 H ASN 13 H ASN 13 -0.391 6.908 -6.614
78 HA ASN 13 HA ASN 13 2.140 5.885 -7.860
79 1HB ASN 13 2HB ASN 13 1.420 8.355 -6.262
80 2HB ASN 13 1HB ASN 13 3.096 7.855 -6.489
81 1HD2 ASN 13 1HD2 ASN 13 3.993 7.961 -8.676
82 2HD2 ASN 13 2HD2 ASN 13 3.207 8.822 -9.910
83 H ASP 14 H ASP 14 1.217 3.902 -6.499
84 HA ASP 14 HA ASP 14 1.371 3.962 -3.629
85 1HB ASP 14 2HB ASP 14 1.281 1.517 -3.874
86 2HB ASP 14 1HB ASP 14 0.169 2.277 -5.008
87 H GLN 15 H GLN 15 3.122 3.820 -2.286
88 HA GLN 15 HA GLN 15 5.760 3.001 -3.444
89 1HB GLN 15 2HB GLN 15 5.076 5.568 -3.008
90 2HB GLN 15 1HB GLN 15 5.623 5.158 -1.382
91 1HG GLN 15 2HG GLN 15 7.800 4.646 -2.107
92 2HG GLN 15 1HG GLN 15 7.293 4.441 -3.783
93 1HE2 GLN 15 1HE2 GLN 15 8.977 6.555 -1.860
94 2HE2 GLN 15 2HE2 GLN 15 8.680 8.001 -2.697
95 H CYS 16 H CYS 16 4.014 1.312 -1.935
96 HA CYS 16 HA CYS 16 4.841 1.308 0.883
97 1HB CYS 16 2HB CYS 16 2.688 0.413 -0.532
98 2HB CYS 16 1HB CYS 16 3.607 -1.083 -0.370
99 H CYS 17 H CYS 17 5.790 -0.829 1.772
100 HA CYS 17 HA CYS 17 8.324 -1.367 0.467
101 1HB CYS 17 2HB CYS 17 6.850 -2.649 2.791
102 2HB CYS 17 1HB CYS 17 8.527 -2.997 2.373
103 H LYS 18 H LYS 18 8.429 -2.613 -1.354
104 HA LYS 18 HA LYS 18 6.416 -4.555 -2.112
105 1HB LYS 18 2HB LYS 18 8.193 -3.101 -3.446
106 2HB LYS 18 1HB LYS 18 9.204 -4.529 -3.220
107 1HG LYS 18 2HG LYS 18 8.123 -5.573 -4.891
108 2HG LYS 18 1HG LYS 18 6.601 -5.407 -4.016
109 1HD LYS 18 2HD LYS 18 5.893 -3.810 -5.436
110 2HD LYS 18 1HD LYS 18 7.358 -2.865 -5.171
111 1HE LYS 18 2HE LYS 18 7.582 -5.297 -6.908
112 2HE LYS 18 1HE LYS 18 6.799 -3.856 -7.586
113 1HZ LYS 18 1HZ LYS 18 9.221 -3.802 -7.885
114 2HZ LYS 18 2HZ LYS 18 9.433 -3.876 -6.201
115 3HZ LYS 18 3HZ LYS 18 8.681 -2.525 -6.909
116 H SER 19 H SER 19 9.242 -4.747 -0.085
117 HA SER 19 HA SER 19 10.050 -7.447 -0.439
118 1HB SER 19 2HB SER 19 10.884 -5.377 1.029
119 2HB SER 19 1HB SER 19 9.961 -6.199 2.283
120 HG SER 19 HG SER 19 12.319 -6.767 1.827
121 H SER 20 H SER 20 7.378 -6.079 1.490
122 HA SER 20 HA SER 20 6.591 -8.840 2.338
123 1HB SER 20 2HB SER 20 5.988 -6.037 3.299
124 2HB SER 20 1HB SER 20 5.067 -7.426 3.867
125 HG SER 20 HG SER 20 6.672 -7.852 5.139
126 H ASN 21 H ASN 21 6.110 -7.515 -0.400
127 HA ASN 21 HA ASN 21 4.363 -7.300 -1.966
128 1HB ASN 21 2HB ASN 21 3.785 -9.540 -0.103
129 2HB ASN 21 1HB ASN 21 2.426 -9.012 -1.096
130 1HD2 ASN 21 1HD2 ASN 21 5.762 -10.282 -1.270
131 2HD2 ASN 21 2HD2 ASN 21 5.651 -10.803 -2.881
132 H LEU 22 H LEU 22 4.215 -5.068 -0.598
133 HA LEU 22 HA LEU 22 1.456 -4.838 0.551
134 1HB LEU 22 2HB LEU 22 3.999 -3.211 0.840
135 2HB LEU 22 1HB LEU 22 2.450 -2.708 1.514
136 HG LEU 22 HG LEU 22 3.735 -5.384 2.120
137 1HD1 LEU 22 1HD1 LEU 22 4.387 -4.383 4.281
138 2HD1 LEU 22 2HD1 LEU 22 3.774 -2.819 3.742
139 3HD1 LEU 22 3HD1 LEU 22 5.165 -3.546 2.938
140 1HD2 LEU 22 1HD2 LEU 22 2.131 -5.154 4.112
141 2HD2 LEU 22 2HD2 LEU 22 1.386 -5.454 2.543
142 3HD2 LEU 22 3HD2 LEU 22 1.385 -3.827 3.222
143 H VAL 23 H VAL 23 -0.027 -3.626 -0.544
144 HA VAL 23 HA VAL 23 0.936 -1.864 -2.780
145 HB VAL 23 HB VAL 23 -1.177 -2.584 -3.941
146 1HG1 VAL 23 1HG1 VAL 23 1.072 -3.715 -4.257
147 2HG1 VAL 23 2HG1 VAL 23 -0.327 -4.716 -4.649
148 3HG1 VAL 23 3HG1 VAL 23 0.525 -4.951 -3.123
149 1HG2 VAL 23 1HG2 VAL 23 -2.465 -4.440 -3.074
150 2HG2 VAL 23 2HG2 VAL 23 -2.363 -3.226 -1.799
151 3HG2 VAL 23 3HG2 VAL 23 -1.340 -4.662 -1.734
152 H CYS 24 H CYS 24 -0.343 0.071 -3.113
153 HA CYS 24 HA CYS 24 -1.609 1.086 -0.657
154 1HB CYS 24 2HB CYS 24 -0.017 2.279 -2.318
155 2HB CYS 24 1HB CYS 24 -1.440 2.453 -3.346
156 H SER 25 H SER 25 -3.808 1.497 -0.394
157 HA SER 25 HA SER 25 -5.648 0.270 -2.384
158 1HB SER 25 2HB SER 25 -5.445 0.091 0.316
159 2HB SER 25 1HB SER 25 -6.604 1.411 0.192
160 HG SER 25 HG SER 25 -6.921 -1.243 -0.292
161 H ARG 26 H ARG 26 -7.654 1.452 -2.936
162 HA ARG 26 HA ARG 26 -7.160 4.386 -3.227
163 1HB ARG 26 2HB ARG 26 -8.777 4.180 -5.082
164 2HB ARG 26 1HB ARG 26 -7.473 3.009 -5.256
165 1HG ARG 26 2HG ARG 26 -8.888 1.254 -5.064
166 2HG ARG 26 1HG ARG 26 -9.711 1.966 -3.678
167 1HD ARG 26 2HD ARG 26 -11.392 2.807 -4.969
168 2HD ARG 26 1HD ARG 26 -10.267 3.344 -6.232
169 HE ARG 26 HE ARG 26 -10.184 0.583 -6.427
170 1HH1 ARG 26 1HH2 ARG 26 -11.342 2.200 -8.627
171 2HH1 ARG 26 2HH2 ARG 26 -12.982 1.646 -8.686
172 1HH2 ARG 26 2HH1 ARG 26 -12.878 0.183 -5.534
173 2HH2 ARG 26 1HH1 ARG 26 -13.854 0.500 -6.930
174 H LYS 27 H LYS 27 -9.230 2.110 -1.591
175 HA LYS 27 HA LYS 27 -11.482 3.942 -1.222
176 1HB LYS 27 2HB LYS 27 -11.226 1.281 -1.200
177 2HB LYS 27 1HB LYS 27 -10.971 1.565 0.521
178 1HG LYS 27 2HG LYS 27 -13.173 1.892 0.840
179 2HG LYS 27 1HG LYS 27 -13.196 3.154 -0.392
180 1HD LYS 27 2HD LYS 27 -12.999 0.854 -1.908
181 2HD LYS 27 1HD LYS 27 -14.041 0.346 -0.579
182 1HE LYS 27 2HE LYS 27 -15.653 1.252 -1.985
183 2HE LYS 27 1HE LYS 27 -15.194 2.727 -1.111
184 1HZ LYS 27 1HZ LYS 27 -13.979 1.768 -3.653
185 2HZ LYS 27 2HZ LYS 27 -13.517 3.165 -2.803
186 3HZ LYS 27 3HZ LYS 27 -15.060 3.067 -3.507
187 H HIS 28 H HIS 28 -8.915 2.638 0.899
188 HA HIS 28 HA HIS 28 -9.567 4.712 2.942
189 1HB HIS 28 2HB HIS 28 -8.265 2.029 2.849
190 2HB HIS 28 1HB HIS 28 -7.699 3.147 4.090
191 HD1 HIS 28 HD1 HIS 28 -9.788 4.323 5.501
192 HD2 HIS 28 HD2 HIS 28 -10.564 0.694 3.600
193 HE1 HIS 28 HE1 HIS 28 -11.877 3.382 6.579
194 H ALA 29 H ALA 29 -7.475 4.386 0.313
195 HA ALA 29 HA ALA 29 -5.499 5.495 -0.325
196 1HB ALA 29 1HB ALA 29 -5.457 7.763 0.370
197 2HB ALA 29 2HB ALA 29 -6.145 7.380 1.948
198 3HB ALA 29 3HB ALA 29 -7.156 7.309 0.504
199 H TRP 30 H TRP 30 -5.079 3.331 1.469
200 HA TRP 30 HA TRP 30 -2.623 4.272 2.874
201 1HB TRP 30 2HB TRP 30 -3.292 3.330 4.927
202 2HB TRP 30 1HB TRP 30 -4.783 4.039 4.325
203 HD1 TRP 30 HD1 TRP 30 -5.269 1.610 2.161
204 HE1 TRP 30 HE1 TRP 30 -6.212 -0.611 3.060
205 HE3 TRP 30 HE3 TRP 30 -4.075 2.091 7.096
206 HZ2 TRP 30 HZ2 TRP 30 -6.431 -2.001 5.549
207 HZ3 TRP 30 HZ3 TRP 30 -4.663 0.306 8.710
208 HH2 TRP 30 HH2 TRP 30 -5.838 -1.738 7.944
209 H CYS 31 H CYS 31 -1.524 2.026 3.771
210 HA CYS 31 HA CYS 31 -1.059 0.450 1.325
211 1HB CYS 31 2HB CYS 31 0.202 0.907 3.981
212 2HB CYS 31 1HB CYS 31 0.510 -0.661 3.234
213 H LYS 32 H LYS 32 -2.472 -1.189 0.904
214 HA LYS 32 HA LYS 32 -3.727 -2.690 3.158
215 1HB LYS 32 2HB LYS 32 -4.735 -1.588 0.879
216 2HB LYS 32 1HB LYS 32 -4.417 -3.229 0.318
217 1HG LYS 32 2HG LYS 32 -5.709 -3.032 2.976
218 2HG LYS 32 1HG LYS 32 -6.695 -2.494 1.617
219 1HD LYS 32 2HD LYS 32 -5.318 -4.939 0.923
220 2HD LYS 32 1HD LYS 32 -6.214 -5.158 2.427
221 1HE LYS 32 2HE LYS 32 -8.054 -3.781 0.932
222 2HE LYS 32 1HE LYS 32 -7.238 -4.741 -0.317
223 1HZ LYS 32 1HZ LYS 32 -7.494 -6.705 1.094
224 2HZ LYS 32 2HZ LYS 32 -9.003 -6.029 0.708
225 3HZ LYS 32 3HZ LYS 32 -8.330 -5.784 2.248
226 H TYR 33 H TYR 33 -3.682 -5.052 3.101
227 HA TYR 33 HA TYR 33 -1.205 -6.133 1.827
228 1HB TYR 33 2HB TYR 33 -2.188 -6.223 4.392
229 2HB TYR 33 1HB TYR 33 -2.757 -7.762 3.749
230 HD1 TYR 33 HD1 TYR 33 -0.794 -8.818 2.050
231 HD2 TYR 33 HD2 TYR 33 -0.189 -6.414 5.559
232 HE1 TYR 33 HE1 TYR 33 1.480 -9.767 2.308
233 HE2 TYR 33 HE2 TYR 33 2.086 -7.364 5.817
234 HH TYR 33 HH TYR 33 3.124 -9.963 4.739
235 H GLU 34 H GLU 34 -1.484 -7.365 0.008
236 HA GLU 34 HA GLU 34 -4.159 -8.273 -0.805
237 1HB GLU 34 2HB GLU 34 -2.268 -7.318 -2.264
238 2HB GLU 34 1HB GLU 34 -1.480 -8.887 -2.081
239 1HG GLU 34 2HG GLU 34 -3.670 -9.926 -2.903
240 2HG GLU 34 1HG GLU 34 -4.158 -8.294 -3.359
241 H ILE 35 H ILE 35 -4.979 -10.213 -0.188
242 HA ILE 35 HA ILE 35 -5.139 -12.446 0.511
243 HB ILE 35 HB ILE 35 -2.368 -12.521 -0.738
244 1HG1 ILE 35 2HG1 ILE 35 -4.900 -13.477 -2.052
245 2HG1 ILE 35 1HG1 ILE 35 -4.521 -11.756 -2.072
246 1HG2 ILE 35 1HG2 ILE 35 -4.291 -14.656 0.175
247 2HG2 ILE 35 2HG2 ILE 35 -2.559 -14.527 0.481
248 3HG2 ILE 35 3HG2 ILE 35 -3.139 -14.975 -1.122
249 1HD1 ILE 35 1HD1 ILE 35 -3.149 -14.012 -3.444
250 2HD1 ILE 35 2HD1 ILE 35 -2.119 -12.725 -2.817
251 3HD1 ILE 35 3HD1 ILE 35 -3.391 -12.350 -3.979
252 1HN NH2 36 1HN NH2 36 -1.692 -12.473 2.818
253 2HN NH2 36 2HN NH2 36 -1.555 -11.684 1.231
Start of MODEL 2
1 1H GLU 1 1H GLU 1 11.348 7.426 -2.012
2 2H GLU 1 2H GLU 1 12.098 5.912 -1.837
3 3H GLU 1 3H GLU 1 12.854 7.310 -1.238
4 HA GLU 1 HA GLU 1 11.863 6.050 0.582
5 1HB GLU 1 2HB GLU 1 11.108 8.779 -0.302
6 2HB GLU 1 1HB GLU 1 10.129 8.122 1.009
7 1HG GLU 1 2HG GLU 1 12.614 7.413 1.860
8 2HG GLU 1 1HG GLU 1 12.989 8.904 0.996
9 H CYS 2 H CYS 2 10.517 4.272 0.519
10 HA CYS 2 HA CYS 2 7.803 4.583 -0.717
11 1HB CYS 2 2HB CYS 2 7.902 2.120 -0.906
12 2HB CYS 2 1HB CYS 2 9.309 2.861 -1.663
13 H LEU 3 H LEU 3 6.032 3.392 0.430
14 HA LEU 3 HA LEU 3 6.189 3.877 3.349
15 1HB LEU 3 2HB LEU 3 3.945 3.094 1.457
16 2HB LEU 3 1HB LEU 3 3.724 3.484 3.161
17 HG LEU 3 HG LEU 3 5.215 5.468 1.510
18 1HD1 LEU 3 1HD1 LEU 3 2.247 4.921 1.266
19 2HD1 LEU 3 2HD1 LEU 3 3.437 5.005 -0.032
20 3HD1 LEU 3 3HD1 LEU 3 2.974 6.469 0.835
21 1HD2 LEU 3 1HD2 LEU 3 3.032 5.702 3.610
22 2HD2 LEU 3 2HD2 LEU 3 4.010 7.026 2.975
23 3HD2 LEU 3 3HD2 LEU 3 4.763 5.760 3.945
24 H GLY 4 H GLY 4 6.449 2.229 4.809
25 1HA GLY 4 2HA GLY 4 6.943 -0.475 3.968
26 2HA GLY 4 1HA GLY 4 6.759 0.057 5.638
27 H PHE 5 H PHE 5 5.650 -2.256 5.430
28 HA PHE 5 HA PHE 5 3.014 -2.425 4.270
29 1HB PHE 5 2HB PHE 5 4.311 -4.402 4.750
30 2HB PHE 5 1HB PHE 5 4.489 -3.942 6.443
31 HD1 PHE 5 HD1 PHE 5 3.240 -5.284 7.867
32 HD2 PHE 5 HD2 PHE 5 1.589 -4.197 4.053
33 HE1 PHE 5 HE1 PHE 5 1.152 -6.497 8.424
34 HE2 PHE 5 HE2 PHE 5 -0.500 -5.412 4.612
35 HZ PHE 5 HZ PHE 5 -0.718 -6.561 6.798
36 H GLY 6 H GLY 6 1.073 -1.737 5.087
37 1HA GLY 6 2HA GLY 6 -0.534 -1.052 6.675
38 2HA GLY 6 1HA GLY 6 0.652 -1.327 7.951
39 H LYS 7 H LYS 7 0.645 0.797 5.072
40 HA LYS 7 HA LYS 7 1.140 3.128 6.898
41 1HB LYS 7 2HB LYS 7 2.425 2.234 4.315
42 2HB LYS 7 1HB LYS 7 2.489 3.925 4.811
43 1HG LYS 7 2HG LYS 7 3.252 1.789 6.779
44 2HG LYS 7 1HG LYS 7 4.409 2.279 5.542
45 1HD LYS 7 2HD LYS 7 4.852 4.222 6.597
46 2HD LYS 7 1HD LYS 7 3.137 4.583 6.790
47 1HE LYS 7 2HE LYS 7 3.086 3.777 8.929
48 2HE LYS 7 1HE LYS 7 4.138 2.404 8.532
49 1HZ LYS 7 1HZ LYS 7 6.024 3.901 8.431
50 2HZ LYS 7 2HZ LYS 7 5.275 4.023 9.951
51 3HZ LYS 7 3HZ LYS 7 5.030 5.230 8.782
52 H GLY 8 H GLY 8 -0.595 4.486 6.753
53 1HA GLY 8 2HA GLY 8 -2.660 4.324 4.826
54 2HA GLY 8 1HA GLY 8 -2.368 5.723 5.854
55 H CYS 9 H CYS 9 -2.579 4.786 2.702
56 HA CYS 9 HA CYS 9 -1.178 7.231 1.770
57 1HB CYS 9 2HB CYS 9 0.473 6.103 0.679
58 2HB CYS 9 1HB CYS 9 0.052 4.753 1.727
59 H ASN 10 H ASN 10 -1.598 7.266 -0.821
60 HA ASN 10 HA ASN 10 -4.532 7.032 -1.118
61 1HB ASN 10 2HB ASN 10 -4.121 8.405 -3.125
62 2HB ASN 10 1HB ASN 10 -3.302 9.092 -1.726
63 1HD2 ASN 10 1HD2 ASN 10 -2.734 8.876 -4.861
64 2HD2 ASN 10 2HD2 ASN 10 -1.077 8.513 -4.891
65 HA PRO 11 HA PRO 11 -4.166 3.210 -3.337
66 1HB PRO 11 2HB PRO 11 -6.728 3.104 -4.295
67 2HB PRO 11 1HB PRO 11 -6.302 2.741 -2.612
68 1HG PRO 11 2HG PRO 11 -7.475 5.212 -3.774
69 2HG PRO 11 1HG PRO 11 -7.805 4.424 -2.224
70 1HD PRO 11 2HD PRO 11 -6.229 6.643 -2.502
71 2HD PRO 11 1HD PRO 11 -6.067 5.471 -1.176
72 H SER 12 H SER 12 -5.475 6.127 -4.926
73 HA SER 12 HA SER 12 -5.483 5.257 -7.623
74 1HB SER 12 2HB SER 12 -5.206 7.708 -8.082
75 2HB SER 12 1HB SER 12 -6.428 7.371 -6.861
76 HG SER 12 HG SER 12 -5.213 8.297 -5.398
77 H ASN 13 H ASN 13 -2.832 6.703 -5.738
78 HA ASN 13 HA ASN 13 -0.873 5.527 -7.676
79 1HB ASN 13 2HB ASN 13 -1.375 8.345 -6.867
80 2HB ASN 13 1HB ASN 13 0.322 7.863 -6.912
81 1HD2 ASN 13 1HD2 ASN 13 1.300 7.605 -8.978
82 2HD2 ASN 13 2HD2 ASN 13 0.456 7.777 -10.441
83 H ASP 14 H ASP 14 -1.178 3.983 -5.661
84 HA ASP 14 HA ASP 14 -0.178 4.648 -3.086
85 1HB ASP 14 2HB ASP 14 -0.205 2.285 -2.740
86 2HB ASP 14 1HB ASP 14 -1.478 2.598 -3.917
87 H GLN 15 H GLN 15 1.872 4.632 -2.192
88 HA GLN 15 HA GLN 15 4.177 4.143 -4.055
89 1HB GLN 15 2HB GLN 15 3.561 6.277 -2.015
90 2HB GLN 15 1HB GLN 15 5.234 5.927 -2.450
91 1HG GLN 15 2HG GLN 15 5.012 6.793 -4.558
92 2HG GLN 15 1HG GLN 15 3.345 6.241 -4.722
93 1HE2 GLN 15 1HE2 GLN 15 1.634 7.644 -3.921
94 2HE2 GLN 15 2HE2 GLN 15 1.937 9.250 -3.460
95 H CYS 16 H CYS 16 2.948 2.158 -2.284
96 HA CYS 16 HA CYS 16 4.455 1.894 0.176
97 1HB CYS 16 2HB CYS 16 3.000 -0.161 -1.523
98 2HB CYS 16 1HB CYS 16 3.431 -0.350 0.175
99 H CYS 17 H CYS 17 6.103 0.205 0.575
100 HA CYS 17 HA CYS 17 8.207 0.160 -1.395
101 1HB CYS 17 2HB CYS 17 7.734 -1.578 1.055
102 2HB CYS 17 1HB CYS 17 9.281 -1.346 0.243
103 H LYS 18 H LYS 18 8.221 -1.094 -3.220
104 HA LYS 18 HA LYS 18 6.354 -3.336 -3.529
105 1HB LYS 18 2HB LYS 18 8.470 -2.021 -5.249
106 2HB LYS 18 1HB LYS 18 7.501 -3.382 -5.812
107 1HG LYS 18 2HG LYS 18 6.374 -0.753 -4.799
108 2HG LYS 18 1HG LYS 18 6.523 -1.201 -6.497
109 1HD LYS 18 2HD LYS 18 5.208 -3.381 -5.545
110 2HD LYS 18 1HD LYS 18 4.583 -2.140 -4.458
111 1HE LYS 18 2HE LYS 18 4.682 -1.515 -7.393
112 2HE LYS 18 1HE LYS 18 3.400 -2.588 -6.799
113 1HZ LYS 18 1HZ LYS 18 4.077 0.081 -5.669
114 2HZ LYS 18 2HZ LYS 18 2.854 -0.956 -5.102
115 3HZ LYS 18 3HZ LYS 18 2.733 -0.257 -6.646
116 H SER 19 H SER 19 9.252 -3.217 -1.931
117 HA SER 19 HA SER 19 10.774 -5.394 -2.994
118 1HB SER 19 2HB SER 19 11.414 -3.635 -1.271
119 2HB SER 19 1HB SER 19 10.481 -4.555 -0.095
120 HG SER 19 HG SER 19 12.052 -5.947 0.007
121 H SER 20 H SER 20 8.094 -5.297 -0.639
122 HA SER 20 HA SER 20 8.023 -8.298 -0.682
123 1HB SER 20 2HB SER 20 8.418 -6.700 1.443
124 2HB SER 20 1HB SER 20 6.657 -6.674 1.423
125 HG SER 20 HG SER 20 8.417 -8.726 1.999
126 H ASN 21 H ASN 21 6.731 -6.382 -2.624
127 HA ASN 21 HA ASN 21 4.665 -6.112 -3.715
128 1HB ASN 21 2HB ASN 21 4.995 -8.664 -3.393
129 2HB ASN 21 1HB ASN 21 3.786 -8.524 -2.117
130 1HD2 ASN 21 1HD2 ASN 21 4.292 -8.119 -5.627
131 2HD2 ASN 21 2HD2 ASN 21 2.643 -8.128 -6.029
132 H LEU 22 H LEU 22 4.140 -4.134 -2.540
133 HA LEU 22 HA LEU 22 1.965 -4.519 -0.504
134 1HB LEU 22 2HB LEU 22 4.331 -2.631 -0.566
135 2HB LEU 22 1HB LEU 22 2.940 -2.354 0.482
136 HG LEU 22 HG LEU 22 4.542 -4.929 0.469
137 1HD1 LEU 22 1HD1 LEU 22 4.662 -2.742 2.553
138 2HD1 LEU 22 2HD1 LEU 22 5.799 -2.815 1.207
139 3HD1 LEU 22 3HD1 LEU 22 5.729 -4.135 2.374
140 1HD2 LEU 22 1HD2 LEU 22 2.366 -3.772 2.230
141 2HD2 LEU 22 2HD2 LEU 22 3.387 -5.114 2.747
142 3HD2 LEU 22 3HD2 LEU 22 2.340 -5.294 1.340
143 H VAL 23 H VAL 23 0.108 -3.434 -1.009
144 HA VAL 23 HA VAL 23 0.240 -1.134 -2.928
145 HB VAL 23 HB VAL 23 -1.863 -2.127 -3.944
146 1HG1 VAL 23 1HG1 VAL 23 0.515 -3.995 -4.080
147 2HG1 VAL 23 2HG1 VAL 23 0.480 -2.420 -4.874
148 3HG1 VAL 23 3HG1 VAL 23 -0.671 -3.671 -5.342
149 1HG2 VAL 23 1HG2 VAL 23 -2.650 -4.225 -3.338
150 2HG2 VAL 23 2HG2 VAL 23 -2.074 -3.653 -1.774
151 3HG2 VAL 23 3HG2 VAL 23 -1.081 -4.754 -2.729
152 H CYS 24 H CYS 24 -1.495 0.425 -2.611
153 HA CYS 24 HA CYS 24 -2.477 0.534 0.150
154 1HB CYS 24 2HB CYS 24 -1.949 2.313 -2.023
155 2HB CYS 24 1HB CYS 24 -3.626 2.541 -1.532
156 H SER 25 H SER 25 -4.557 0.125 0.840
157 HA SER 25 HA SER 25 -6.399 -1.230 -1.028
158 1HB SER 25 2HB SER 25 -5.760 -1.885 1.387
159 2HB SER 25 1HB SER 25 -6.815 -0.570 1.896
160 HG SER 25 HG SER 25 -8.451 -1.813 1.483
161 H ARG 26 H ARG 26 -8.864 -0.598 -0.514
162 HA ARG 26 HA ARG 26 -9.100 2.331 -1.045
163 1HB ARG 26 2HB ARG 26 -10.319 -0.109 -1.998
164 2HB ARG 26 1HB ARG 26 -11.568 0.952 -1.349
165 1HG ARG 26 2HG ARG 26 -11.460 2.181 -3.227
166 2HG ARG 26 1HG ARG 26 -9.794 2.599 -2.828
167 1HD ARG 26 2HD ARG 26 -8.990 0.565 -3.977
168 2HD ARG 26 1HD ARG 26 -10.665 0.126 -4.370
169 HE ARG 26 HE ARG 26 -9.444 2.705 -5.294
170 1HH1 ARG 26 1HH2 ARG 26 -9.309 0.233 -7.076
171 2HH1 ARG 26 2HH2 ARG 26 -10.692 0.473 -8.092
172 1HH2 ARG 26 2HH1 ARG 26 -12.123 2.875 -6.027
173 2HH2 ARG 26 1HH1 ARG 26 -12.289 1.973 -7.496
174 H LYS 27 H LYS 27 -10.682 -0.240 0.903
175 HA LYS 27 HA LYS 27 -12.235 1.616 2.506
176 1HB LYS 27 2HB LYS 27 -11.462 -1.303 2.677
177 2HB LYS 27 1HB LYS 27 -12.458 -0.539 3.917
178 1HG LYS 27 2HG LYS 27 -14.021 0.212 2.083
179 2HG LYS 27 1HG LYS 27 -13.084 -0.777 0.961
180 1HD LYS 27 2HD LYS 27 -13.507 -2.615 2.881
181 2HD LYS 27 1HD LYS 27 -14.939 -1.618 3.136
182 1HE LYS 27 2HE LYS 27 -15.843 -2.882 1.454
183 2HE LYS 27 1HE LYS 27 -14.888 -1.838 0.384
184 1HZ LYS 27 1HZ LYS 27 -13.954 -4.375 1.625
185 2HZ LYS 27 2HZ LYS 27 -13.016 -3.357 0.638
186 3HZ LYS 27 3HZ LYS 27 -14.363 -4.167 -0.007
187 H HIS 28 H HIS 28 -9.147 -0.086 2.958
188 HA HIS 28 HA HIS 28 -8.750 1.123 5.632
189 1HB HIS 28 2HB HIS 28 -7.401 -0.913 3.879
190 2HB HIS 28 1HB HIS 28 -6.491 -0.190 5.205
191 HD1 HIS 28 HD1 HIS 28 -6.489 -2.094 6.874
192 HD2 HIS 28 HD2 HIS 28 -10.314 -1.250 5.446
193 HE1 HIS 28 HE1 HIS 28 -8.093 -3.483 8.257
194 H ALA 29 H ALA 29 -7.711 1.586 2.297
195 HA ALA 29 HA ALA 29 -6.363 3.232 1.286
196 1HB ALA 29 1HB ALA 29 -6.831 4.817 3.812
197 2HB ALA 29 2HB ALA 29 -8.158 4.466 2.705
198 3HB ALA 29 3HB ALA 29 -6.769 5.396 2.148
199 H TRP 30 H TRP 30 -4.860 1.257 2.626
200 HA TRP 30 HA TRP 30 -2.447 2.821 3.325
201 1HB TRP 30 2HB TRP 30 -2.229 1.928 5.506
202 2HB TRP 30 1HB TRP 30 -3.938 2.321 5.384
203 HD1 TRP 30 HD1 TRP 30 -4.583 -0.360 3.556
204 HE1 TRP 30 HE1 TRP 30 -4.768 -2.609 4.795
205 HE3 TRP 30 HE3 TRP 30 -2.095 0.807 7.854
206 HZ2 TRP 30 HZ2 TRP 30 -3.968 -3.761 7.292
207 HZ3 TRP 30 HZ3 TRP 30 -1.824 -0.880 9.646
208 HH2 TRP 30 HH2 TRP 30 -2.756 -3.160 9.372
209 H CYS 31 H CYS 31 -0.487 1.363 3.437
210 HA CYS 31 HA CYS 31 -0.356 -0.412 1.199
211 1HB CYS 31 2HB CYS 31 1.421 -0.157 3.650
212 2HB CYS 31 1HB CYS 31 1.881 -0.951 2.147
213 H LYS 32 H LYS 32 -1.149 -2.457 1.048
214 HA LYS 32 HA LYS 32 -1.235 -4.162 3.510
215 1HB LYS 32 2HB LYS 32 -3.482 -4.905 2.777
216 2HB LYS 32 1HB LYS 32 -3.448 -3.163 3.040
217 1HG LYS 32 2HG LYS 32 -3.763 -2.690 0.830
218 2HG LYS 32 1HG LYS 32 -2.759 -4.037 0.292
219 1HD LYS 32 2HD LYS 32 -4.543 -5.617 0.697
220 2HD LYS 32 1HD LYS 32 -5.534 -4.374 1.462
221 1HE LYS 32 2HE LYS 32 -5.413 -3.105 -0.770
222 2HE LYS 32 1HE LYS 32 -4.784 -4.613 -1.463
223 1HZ LYS 32 1HZ LYS 32 -7.210 -4.527 -1.592
224 2HZ LYS 32 2HZ LYS 32 -7.306 -4.353 0.096
225 3HZ LYS 32 3HZ LYS 32 -6.698 -5.789 -0.581
226 H TYR 33 H TYR 33 -1.842 -6.542 2.680
227 HA TYR 33 HA TYR 33 0.124 -7.174 0.533
228 1HB TYR 33 2HB TYR 33 -0.997 -8.459 2.961
229 2HB TYR 33 1HB TYR 33 -0.661 -9.551 1.616
230 HD1 TYR 33 HD1 TYR 33 1.657 -9.437 0.515
231 HD2 TYR 33 HD2 TYR 33 0.759 -7.633 4.309
232 HE1 TYR 33 HE1 TYR 33 4.077 -9.339 1.043
233 HE2 TYR 33 HE2 TYR 33 3.179 -7.534 4.836
234 HH TYR 33 HH TYR 33 5.396 -9.225 3.618
235 H GLU 34 H GLU 34 -0.718 -7.440 -1.489
236 HA GLU 34 HA GLU 34 -3.283 -8.935 -1.795
237 1HB GLU 34 2HB GLU 34 -3.676 -6.460 -1.789
238 2HB GLU 34 1HB GLU 34 -2.580 -6.318 -3.164
239 1HG GLU 34 2HG GLU 34 -4.030 -7.804 -4.488
240 2HG GLU 34 1HG GLU 34 -5.125 -7.964 -3.114
241 H ILE 35 H ILE 35 -2.868 -10.598 -3.185
242 HA ILE 35 HA ILE 35 -0.502 -10.533 -4.950
243 HB ILE 35 HB ILE 35 -2.657 -12.605 -4.395
244 1HG1 ILE 35 2HG1 ILE 35 -0.098 -13.373 -3.427
245 2HG1 ILE 35 1HG1 ILE 35 -0.353 -11.707 -2.908
246 1HG2 ILE 35 1HG2 ILE 35 -1.661 -13.080 -6.541
247 2HG2 ILE 35 2HG2 ILE 35 -0.942 -14.184 -5.369
248 3HG2 ILE 35 3HG2 ILE 35 -0.041 -12.770 -5.917
249 1HD1 ILE 35 1HD1 ILE 35 -1.913 -14.168 -2.218
250 2HD1 ILE 35 2HD1 ILE 35 -2.771 -12.628 -2.295
251 3HD1 ILE 35 3HD1 ILE 35 -1.418 -12.828 -1.182
252 1HN NH2 36 1HN NH2 36 -4.126 -9.936 -6.807
253 2HN NH2 36 2HN NH2 36 -3.842 -9.831 -5.055
Start of MODEL 3
1 1H GLU 1 1H GLU 1 12.666 6.258 3.845
2 2H GLU 1 2H GLU 1 12.036 6.014 2.286
3 3H GLU 1 3H GLU 1 11.949 4.774 3.444
4 HA GLU 1 HA GLU 1 10.440 6.112 4.801
5 1HB GLU 1 2HB GLU 1 11.501 8.074 2.915
6 2HB GLU 1 1HB GLU 1 9.742 8.156 3.016
7 1HG GLU 1 2HG GLU 1 10.169 8.021 5.610
8 2HG GLU 1 1HG GLU 1 11.781 8.588 5.177
9 H CYS 2 H CYS 2 8.883 4.541 4.446
10 HA CYS 2 HA CYS 2 7.201 4.794 2.014
11 1HB CYS 2 2HB CYS 2 7.444 2.351 1.574
12 2HB CYS 2 1HB CYS 2 8.974 3.209 1.410
13 H LEU 3 H LEU 3 5.199 3.391 2.242
14 HA LEU 3 HA LEU 3 4.212 3.519 5.027
15 1HB LEU 3 2HB LEU 3 2.918 2.830 2.365
16 2HB LEU 3 1HB LEU 3 2.043 3.018 3.883
17 HG LEU 3 HG LEU 3 3.842 5.222 2.898
18 1HD1 LEU 3 1HD1 LEU 3 0.908 5.154 2.235
19 2HD1 LEU 3 2HD1 LEU 3 2.077 4.410 1.144
20 3HD1 LEU 3 3HD1 LEU 3 2.186 6.131 1.512
21 1HD2 LEU 3 1HD2 LEU 3 2.723 6.513 4.453
22 2HD2 LEU 3 2HD2 LEU 3 2.545 4.938 5.226
23 3HD2 LEU 3 3HD2 LEU 3 1.219 5.608 4.277
24 H GLY 4 H GLY 4 4.357 1.745 6.335
25 1HA GLY 4 2HA GLY 4 5.173 -0.849 5.368
26 2HA GLY 4 1HA GLY 4 4.639 -0.488 7.010
27 H PHE 5 H PHE 5 3.771 -2.844 6.167
28 HA PHE 5 HA PHE 5 1.394 -2.936 4.572
29 1HB PHE 5 2HB PHE 5 2.794 -4.877 5.141
30 2HB PHE 5 1HB PHE 5 2.381 -4.693 6.845
31 HD1 PHE 5 HD1 PHE 5 0.696 -6.066 7.669
32 HD2 PHE 5 HD2 PHE 5 0.608 -4.909 3.532
33 HE1 PHE 5 HE1 PHE 5 -1.344 -7.434 7.328
34 HE2 PHE 5 HE2 PHE 5 -1.431 -6.278 3.193
35 HZ PHE 5 HZ PHE 5 -2.407 -7.540 5.090
36 H GLY 6 H GLY 6 -0.746 -2.589 5.091
37 1HA GLY 6 2HA GLY 6 -2.654 -2.113 6.373
38 2HA GLY 6 1HA GLY 6 -1.739 -2.537 7.817
39 H LYS 7 H LYS 7 -0.603 -0.102 5.539
40 HA LYS 7 HA LYS 7 -1.098 1.995 7.629
41 1HB LYS 7 2HB LYS 7 1.271 1.334 7.191
42 2HB LYS 7 1HB LYS 7 1.059 1.784 5.499
43 1HG LYS 7 2HG LYS 7 2.093 3.657 6.593
44 2HG LYS 7 1HG LYS 7 0.412 4.102 6.299
45 1HD LYS 7 2HD LYS 7 0.446 2.794 8.806
46 2HD LYS 7 1HD LYS 7 1.817 3.903 8.815
47 1HE LYS 7 2HE LYS 7 -0.844 4.879 7.795
48 2HE LYS 7 1HE LYS 7 -0.552 4.799 9.543
49 1HZ LYS 7 1HZ LYS 7 0.178 6.927 8.630
50 2HZ LYS 7 2HZ LYS 7 1.222 6.124 7.556
51 3HZ LYS 7 3HZ LYS 7 1.494 6.044 9.232
52 H GLY 8 H GLY 8 -2.428 3.658 6.985
53 1HA GLY 8 2HA GLY 8 -3.948 3.738 4.671
54 2HA GLY 8 1HA GLY 8 -3.532 5.193 5.573
55 H CYS 9 H CYS 9 -3.667 4.388 2.575
56 HA CYS 9 HA CYS 9 -1.229 5.886 1.779
57 1HB CYS 9 2HB CYS 9 -0.317 3.754 1.591
58 2HB CYS 9 1HB CYS 9 -1.879 3.004 1.278
59 H ASN 10 H ASN 10 -1.454 6.825 -0.343
60 HA ASN 10 HA ASN 10 -4.273 7.032 -1.267
61 1HB ASN 10 2HB ASN 10 -3.441 9.028 -2.439
62 2HB ASN 10 1HB ASN 10 -2.937 9.065 -0.753
63 1HD2 ASN 10 1HD2 ASN 10 -0.645 8.827 -0.285
64 2HD2 ASN 10 2HD2 ASN 10 0.528 8.860 -1.512
65 HA PRO 11 HA PRO 11 -3.411 4.283 -4.619
66 1HB PRO 11 2HB PRO 11 -5.586 4.880 -6.174
67 2HB PRO 11 1HB PRO 11 -5.682 3.891 -4.703
68 1HG PRO 11 2HG PRO 11 -6.350 6.767 -5.097
69 2HG PRO 11 1HG PRO 11 -7.183 5.537 -4.133
70 1HD PRO 11 2HD PRO 11 -5.536 7.414 -3.054
71 2HD PRO 11 1HD PRO 11 -5.783 5.805 -2.338
72 H SER 12 H SER 12 -4.062 7.732 -5.229
73 HA SER 12 HA SER 12 -3.340 7.910 -7.966
74 1HB SER 12 2HB SER 12 -3.036 9.780 -5.604
75 2HB SER 12 1HB SER 12 -2.697 10.283 -7.258
76 HG SER 12 HG SER 12 -4.774 10.255 -7.691
77 H ASN 13 H ASN 13 -1.293 7.941 -5.062
78 HA ASN 13 HA ASN 13 1.079 7.337 -6.774
79 1HB ASN 13 2HB ASN 13 0.658 9.840 -6.000
80 2HB ASN 13 1HB ASN 13 1.292 9.251 -4.464
81 1HD2 ASN 13 1HD2 ASN 13 2.244 10.562 -7.436
82 2HD2 ASN 13 2HD2 ASN 13 3.870 10.077 -7.415
83 H ASP 14 H ASP 14 0.623 5.140 -5.856
84 HA ASP 14 HA ASP 14 0.593 4.552 -3.061
85 1HB ASP 14 2HB ASP 14 -0.133 2.927 -4.666
86 2HB ASP 14 1HB ASP 14 1.394 3.011 -5.542
87 H GLN 15 H GLN 15 2.213 4.928 -1.624
88 HA GLN 15 HA GLN 15 5.055 4.721 -2.573
89 1HB GLN 15 2HB GLN 15 3.765 6.941 -1.695
90 2HB GLN 15 1HB GLN 15 4.346 6.308 -0.155
91 1HG GLN 15 2HG GLN 15 6.594 6.008 -1.608
92 2HG GLN 15 1HG GLN 15 5.887 7.376 -2.469
93 1HE2 GLN 15 1HE2 GLN 15 5.887 9.430 -1.415
94 2HE2 GLN 15 2HE2 GLN 15 6.537 9.678 0.133
95 H CYS 16 H CYS 16 3.541 2.466 -1.622
96 HA CYS 16 HA CYS 16 4.010 1.977 1.200
97 1HB CYS 16 2HB CYS 16 3.041 0.542 -1.216
98 2HB CYS 16 1HB CYS 16 3.678 -0.474 0.076
99 H CYS 17 H CYS 17 5.433 0.104 1.920
100 HA CYS 17 HA CYS 17 8.169 0.516 1.042
101 1HB CYS 17 2HB CYS 17 6.865 -1.560 2.836
102 2HB CYS 17 1HB CYS 17 8.601 -1.267 2.731
103 H LYS 18 H LYS 18 9.107 -0.450 -0.700
104 HA LYS 18 HA LYS 18 7.775 -2.610 -2.158
105 1HB LYS 18 2HB LYS 18 9.295 -0.535 -2.876
106 2HB LYS 18 1HB LYS 18 10.583 -1.726 -2.697
107 1HG LYS 18 2HG LYS 18 9.937 -1.965 -4.951
108 2HG LYS 18 1HG LYS 18 9.066 -3.266 -4.139
109 1HD LYS 18 2HD LYS 18 7.297 -2.352 -5.291
110 2HD LYS 18 1HD LYS 18 7.235 -1.316 -3.865
111 1HE LYS 18 2HE LYS 18 8.430 0.449 -4.982
112 2HE LYS 18 1HE LYS 18 8.835 -0.610 -6.347
113 1HZ LYS 18 1HZ LYS 18 6.898 0.769 -6.846
114 2HZ LYS 18 2HZ LYS 18 6.081 0.130 -5.500
115 3HZ LYS 18 3HZ LYS 18 6.482 -0.874 -6.811
116 H SER 19 H SER 19 9.905 -2.575 0.510
117 HA SER 19 HA SER 19 11.664 -4.755 -0.017
118 1HB SER 19 2HB SER 19 10.377 -3.595 2.460
119 2HB SER 19 1HB SER 19 11.537 -4.917 2.556
120 HG SER 19 HG SER 19 12.746 -3.102 2.681
121 H SER 20 H SER 20 8.325 -4.711 1.266
122 HA SER 20 HA SER 20 8.292 -7.703 1.218
123 1HB SER 20 2HB SER 20 6.658 -5.552 2.577
124 2HB SER 20 1HB SER 20 6.140 -7.235 2.552
125 HG SER 20 HG SER 20 8.280 -6.020 3.859
126 H ASN 21 H ASN 21 7.859 -5.584 -1.093
127 HA ASN 21 HA ASN 21 6.471 -5.376 -2.983
128 1HB ASN 21 2HB ASN 21 7.130 -7.936 -2.619
129 2HB ASN 21 1HB ASN 21 5.393 -8.103 -2.371
130 1HD2 ASN 21 1HD2 ASN 21 7.835 -7.009 -4.750
131 2HD2 ASN 21 2HD2 ASN 21 6.812 -7.143 -6.098
132 H LEU 22 H LEU 22 5.222 -3.842 -1.390
133 HA LEU 22 HA LEU 22 2.442 -4.891 -0.951
134 1HB LEU 22 2HB LEU 22 4.156 -2.830 0.451
135 2HB LEU 22 1HB LEU 22 2.420 -2.951 0.732
136 HG LEU 22 HG LEU 22 4.294 -5.310 1.019
137 1HD1 LEU 22 1HD1 LEU 22 4.238 -4.897 3.434
138 2HD1 LEU 22 2HD1 LEU 22 3.245 -3.461 3.184
139 3HD1 LEU 22 3HD1 LEU 22 4.910 -3.494 2.604
140 1HD2 LEU 22 1HD2 LEU 22 2.321 -6.048 2.499
141 2HD2 LEU 22 2HD2 LEU 22 2.038 -6.034 0.759
142 3HD2 LEU 22 3HD2 LEU 22 1.421 -4.722 1.763
143 H VAL 23 H VAL 23 0.691 -3.471 -1.502
144 HA VAL 23 HA VAL 23 1.407 -1.137 -3.247
145 HB VAL 23 HB VAL 23 -0.480 -1.911 -4.722
146 1HG1 VAL 23 1HG1 VAL 23 1.633 -4.046 -4.322
147 2HG1 VAL 23 2HG1 VAL 23 1.947 -2.502 -5.116
148 3HG1 VAL 23 3HG1 VAL 23 0.794 -3.638 -5.819
149 1HG2 VAL 23 1HG2 VAL 23 -1.472 -4.068 -4.410
150 2HG2 VAL 23 2HG2 VAL 23 -1.553 -3.271 -2.840
151 3HG2 VAL 23 3HG2 VAL 23 -0.319 -4.493 -3.145
152 H CYS 24 H CYS 24 -0.844 0.079 -3.726
153 HA CYS 24 HA CYS 24 -1.958 0.753 -1.067
154 1HB CYS 24 2HB CYS 24 -1.137 2.257 -3.123
155 2HB CYS 24 1HB CYS 24 -2.817 2.054 -3.618
156 H SER 25 H SER 25 -4.256 0.781 -0.668
157 HA SER 25 HA SER 25 -5.812 -1.142 -2.365
158 1HB SER 25 2HB SER 25 -5.174 -1.471 0.169
159 2HB SER 25 1HB SER 25 -6.488 -0.333 0.455
160 HG SER 25 HG SER 25 -7.904 -1.741 -0.429
161 H ARG 26 H ARG 26 -7.966 -0.556 -2.943
162 HA ARG 26 HA ARG 26 -8.497 2.364 -2.957
163 1HB ARG 26 2HB ARG 26 -9.655 -0.068 -4.339
164 2HB ARG 26 1HB ARG 26 -10.351 1.541 -4.526
165 1HG ARG 26 2HG ARG 26 -8.800 2.037 -6.076
166 2HG ARG 26 1HG ARG 26 -7.526 1.770 -4.886
167 1HD ARG 26 2HD ARG 26 -8.601 -0.770 -5.818
168 2HD ARG 26 1HD ARG 26 -8.003 0.209 -7.173
169 HE ARG 26 HE ARG 26 -6.346 -0.276 -4.721
170 1HH1 ARG 26 1HH2 ARG 26 -5.851 -2.281 -6.797
171 2HH1 ARG 26 2HH2 ARG 26 -4.614 -1.559 -7.771
172 1HH2 ARG 26 2HH1 ARG 26 -5.156 1.649 -6.549
173 2HH2 ARG 26 1HH1 ARG 26 -4.220 0.672 -7.630
174 H LYS 27 H LYS 27 -10.079 -0.665 -1.881
175 HA LYS 27 HA LYS 27 -12.378 0.726 -0.727
176 1HB LYS 27 2HB LYS 27 -11.899 -1.772 -1.628
177 2HB LYS 27 1HB LYS 27 -11.604 -2.036 0.090
178 1HG LYS 27 2HG LYS 27 -13.990 -0.428 -0.318
179 2HG LYS 27 1HG LYS 27 -14.104 -1.958 -1.187
180 1HD LYS 27 2HD LYS 27 -13.171 -1.873 1.680
181 2HD LYS 27 1HD LYS 27 -14.889 -1.906 1.287
182 1HE LYS 27 2HE LYS 27 -13.093 -3.915 -0.043
183 2HE LYS 27 1HE LYS 27 -13.575 -4.184 1.644
184 1HZ LYS 27 1HZ LYS 27 -15.412 -3.618 -0.627
185 2HZ LYS 27 2HZ LYS 27 -15.886 -3.803 0.994
186 3HZ LYS 27 3HZ LYS 27 -15.222 -5.116 0.146
187 H HIS 28 H HIS 28 -9.306 -0.567 0.466
188 HA HIS 28 HA HIS 28 -9.995 0.131 3.271
189 1HB HIS 28 2HB HIS 28 -7.631 -1.226 1.934
190 2HB HIS 28 1HB HIS 28 -7.781 -1.000 3.676
191 HD1 HIS 28 HD1 HIS 28 -10.460 -1.839 4.442
192 HD2 HIS 28 HD2 HIS 28 -8.495 -3.765 1.310
193 HE1 HIS 28 HE1 HIS 28 -11.593 -4.086 4.159
194 H ALA 29 H ALA 29 -8.201 1.401 0.551
195 HA ALA 29 HA ALA 29 -6.902 3.348 0.294
196 1HB ALA 29 1HB ALA 29 -8.052 4.236 2.935
197 2HB ALA 29 2HB ALA 29 -9.099 4.048 1.529
198 3HB ALA 29 3HB ALA 29 -7.757 5.191 1.482
199 H TRP 30 H TRP 30 -5.573 1.145 1.554
200 HA TRP 30 HA TRP 30 -3.494 2.619 3.061
201 1HB TRP 30 2HB TRP 30 -3.662 1.257 5.007
202 2HB TRP 30 1HB TRP 30 -5.311 1.729 4.622
203 HD1 TRP 30 HD1 TRP 30 -5.129 -0.599 2.101
204 HE1 TRP 30 HE1 TRP 30 -5.716 -3.004 2.812
205 HE3 TRP 30 HE3 TRP 30 -4.558 -0.165 7.138
206 HZ2 TRP 30 HZ2 TRP 30 -5.918 -4.543 5.220
207 HZ3 TRP 30 HZ3 TRP 30 -4.952 -2.109 8.626
208 HH2 TRP 30 HH2 TRP 30 -5.630 -4.297 7.674
209 H CYS 31 H CYS 31 -1.876 0.551 3.816
210 HA CYS 31 HA CYS 31 -0.896 -0.449 1.234
211 1HB CYS 31 2HB CYS 31 0.308 0.411 3.469
212 2HB CYS 31 1HB CYS 31 0.227 -1.304 3.871
213 H LYS 32 H LYS 32 -1.395 -2.439 0.416
214 HA LYS 32 HA LYS 32 -2.328 -4.580 2.296
215 1HB LYS 32 2HB LYS 32 -4.100 -5.094 0.626
216 2HB LYS 32 1HB LYS 32 -4.253 -3.453 1.250
217 1HG LYS 32 2HG LYS 32 -3.654 -2.487 -0.751
218 2HG LYS 32 1HG LYS 32 -2.579 -3.812 -1.191
219 1HD LYS 32 2HD LYS 32 -5.093 -5.006 -1.125
220 2HD LYS 32 1HD LYS 32 -5.402 -3.423 -1.840
221 1HE LYS 32 2HE LYS 32 -3.683 -3.806 -3.540
222 2HE LYS 32 1HE LYS 32 -3.254 -5.356 -2.791
223 1HZ LYS 32 1HZ LYS 32 -5.947 -4.636 -3.832
224 2HZ LYS 32 2HZ LYS 32 -5.516 -6.121 -3.126
225 3HZ LYS 32 3HZ LYS 32 -4.839 -5.655 -4.613
226 H TYR 33 H TYR 33 -2.214 -6.777 1.238
227 HA TYR 33 HA TYR 33 0.201 -6.948 -0.511
228 1HB TYR 33 2HB TYR 33 0.124 -8.093 1.713
229 2HB TYR 33 1HB TYR 33 -1.246 -9.046 1.144
230 HD1 TYR 33 HD1 TYR 33 -0.846 -11.099 0.107
231 HD2 TYR 33 HD2 TYR 33 2.254 -8.124 0.142
232 HE1 TYR 33 HE1 TYR 33 0.707 -12.703 -0.973
233 HE2 TYR 33 HE2 TYR 33 3.807 -9.729 -0.936
234 HH TYR 33 HH TYR 33 3.030 -12.226 -2.566
235 H GLU 34 H GLU 34 0.150 -8.444 -2.336
236 HA GLU 34 HA GLU 34 -2.256 -8.319 -3.921
237 1HB GLU 34 2HB GLU 34 0.447 -8.777 -4.296
238 2HB GLU 34 1HB GLU 34 -0.256 -10.362 -4.623
239 1HG GLU 34 2HG GLU 34 -1.727 -9.447 -6.300
240 2HG GLU 34 1HG GLU 34 -1.280 -7.796 -5.865
241 H ILE 35 H ILE 35 -4.030 -9.601 -3.665
242 HA ILE 35 HA ILE 35 -3.650 -12.456 -2.853
243 HB ILE 35 HB ILE 35 -4.201 -10.978 -0.904
244 1HG1 ILE 35 2HG1 ILE 35 -6.637 -12.651 -1.431
245 2HG1 ILE 35 1HG1 ILE 35 -5.063 -13.440 -1.341
246 1HG2 ILE 35 1HG2 ILE 35 -6.871 -10.585 -2.280
247 2HG2 ILE 35 2HG2 ILE 35 -5.592 -9.372 -2.288
248 3HG2 ILE 35 3HG2 ILE 35 -6.329 -9.865 -0.764
249 1HD1 ILE 35 1HD1 ILE 35 -5.928 -11.501 0.797
250 2HD1 ILE 35 2HD1 ILE 35 -4.720 -12.782 0.892
251 3HD1 ILE 35 3HD1 ILE 35 -6.435 -13.189 0.854
252 1HN NH2 36 1HN NH2 36 -6.725 -13.355 -4.549
253 2HN NH2 36 2HN NH2 36 -6.070 -13.474 -2.901
Start of MODEL 4
1 1H GLU 1 1H GLU 1 12.505 7.582 1.218
2 2H GLU 1 2H GLU 1 10.815 7.748 1.179
3 3H GLU 1 3H GLU 1 11.648 7.189 -0.192
4 HA GLU 1 HA GLU 1 12.182 5.131 0.827
5 1HB GLU 1 2HB GLU 1 11.864 4.803 3.207
6 2HB GLU 1 1HB GLU 1 12.715 6.331 2.990
7 1HG GLU 1 2HG GLU 1 10.548 7.540 3.180
8 2HG GLU 1 1HG GLU 1 9.734 6.002 3.463
9 H CYS 2 H CYS 2 10.617 3.366 1.177
10 HA CYS 2 HA CYS 2 7.927 4.055 0.158
11 1HB CYS 2 2HB CYS 2 7.749 1.581 -0.030
12 2HB CYS 2 1HB CYS 2 9.211 2.192 -0.797
13 H LEU 3 H LEU 3 6.001 2.989 1.221
14 HA LEU 3 HA LEU 3 6.060 3.501 4.134
15 1HB LEU 3 2HB LEU 3 3.868 2.805 2.151
16 2HB LEU 3 1HB LEU 3 3.586 3.228 3.839
17 HG LEU 3 HG LEU 3 5.256 5.104 2.227
18 1HD1 LEU 3 1HD1 LEU 3 3.619 4.999 0.592
19 2HD1 LEU 3 2HD1 LEU 3 2.886 6.183 1.674
20 3HD1 LEU 3 3HD1 LEU 3 2.366 4.498 1.728
21 1HD2 LEU 3 1HD2 LEU 3 3.825 6.723 3.595
22 2HD2 LEU 3 2HD2 LEU 3 4.879 5.663 4.530
23 3HD2 LEU 3 3HD2 LEU 3 3.156 5.306 4.405
24 H GLY 4 H GLY 4 5.488 1.918 5.709
25 1HA GLY 4 2HA GLY 4 6.201 -0.830 5.028
26 2HA GLY 4 1HA GLY 4 5.734 -0.247 6.625
27 H PHE 5 H PHE 5 4.608 -2.539 6.227
28 HA PHE 5 HA PHE 5 2.208 -2.629 4.625
29 1HB PHE 5 2HB PHE 5 3.519 -4.578 5.447
30 2HB PHE 5 1HB PHE 5 3.032 -4.191 7.096
31 HD1 PHE 5 HD1 PHE 5 1.433 -4.663 3.722
32 HD2 PHE 5 HD2 PHE 5 1.208 -5.345 7.959
33 HE1 PHE 5 HE1 PHE 5 -0.667 -5.939 3.407
34 HE2 PHE 5 HE2 PHE 5 -0.893 -6.620 7.641
35 HZ PHE 5 HZ PHE 5 -1.831 -6.917 5.365
36 H GLY 6 H GLY 6 0.194 -1.822 5.088
37 1HA GLY 6 2HA GLY 6 -1.629 -1.014 6.334
38 2HA GLY 6 1HA GLY 6 -0.789 -1.507 7.805
39 H LYS 7 H LYS 7 -0.233 0.876 5.187
40 HA LYS 7 HA LYS 7 0.213 2.961 7.298
41 1HB LYS 7 2HB LYS 7 1.844 2.147 4.892
42 2HB LYS 7 1HB LYS 7 1.951 3.792 5.519
43 1HG LYS 7 2HG LYS 7 2.281 1.388 7.318
44 2HG LYS 7 1HG LYS 7 3.642 2.085 6.443
45 1HD LYS 7 2HD LYS 7 1.843 3.813 8.137
46 2HD LYS 7 1HD LYS 7 3.196 2.935 8.851
47 1HE LYS 7 2HE LYS 7 4.690 4.014 7.092
48 2HE LYS 7 1HE LYS 7 3.313 5.057 6.684
49 1HZ LYS 7 1HZ LYS 7 4.666 6.095 8.390
50 2HZ LYS 7 2HZ LYS 7 4.516 4.727 9.386
51 3HZ LYS 7 3HZ LYS 7 3.153 5.677 9.031
52 H GLY 8 H GLY 8 -1.240 4.601 6.995
53 1HA GLY 8 2HA GLY 8 -3.042 4.800 4.829
54 2HA GLY 8 1HA GLY 8 -2.670 6.124 5.931
55 H CYS 9 H CYS 9 -2.582 5.234 2.736
56 HA CYS 9 HA CYS 9 -0.624 7.396 2.105
57 1HB CYS 9 2HB CYS 9 0.805 5.946 1.087
58 2HB CYS 9 1HB CYS 9 -0.032 4.698 2.002
59 H ASN 10 H ASN 10 -0.756 7.399 -0.624
60 HA ASN 10 HA ASN 10 -3.560 8.194 -1.129
61 1HB ASN 10 2HB ASN 10 -0.868 8.508 -2.428
62 2HB ASN 10 1HB ASN 10 -2.317 8.792 -3.393
63 1HD2 ASN 10 1HD2 ASN 10 -2.475 11.057 -3.489
64 2HD2 ASN 10 2HD2 ASN 10 -2.452 12.076 -2.131
65 HA PRO 11 HA PRO 11 -4.454 4.312 -3.107
66 1HB PRO 11 2HB PRO 11 -6.824 5.050 -4.271
67 2HB PRO 11 1HB PRO 11 -6.666 4.669 -2.545
68 1HG PRO 11 2HG PRO 11 -6.775 7.321 -3.895
69 2HG PRO 11 1HG PRO 11 -7.504 6.800 -2.368
70 1HD PRO 11 2HD PRO 11 -5.230 8.288 -2.502
71 2HD PRO 11 1HD PRO 11 -5.580 7.161 -1.173
72 H SER 12 H SER 12 -4.915 7.343 -4.983
73 HA SER 12 HA SER 12 -4.561 6.074 -7.568
74 1HB SER 12 2HB SER 12 -4.445 8.450 -8.317
75 2HB SER 12 1HB SER 12 -5.800 8.170 -7.228
76 HG SER 12 HG SER 12 -4.900 9.453 -5.820
77 H ASN 13 H ASN 13 -2.421 7.815 -5.332
78 HA ASN 13 HA ASN 13 -0.078 7.121 -7.071
79 1HB ASN 13 2HB ASN 13 -0.757 9.361 -5.168
80 2HB ASN 13 1HB ASN 13 0.929 9.006 -5.542
81 1HD2 ASN 13 1HD2 ASN 13 1.737 9.685 -7.585
82 2HD2 ASN 13 2HD2 ASN 13 0.781 10.450 -8.761
83 H ASP 14 H ASP 14 -0.861 4.982 -5.645
84 HA ASP 14 HA ASP 14 0.107 4.861 -2.920
85 1HB ASP 14 2HB ASP 14 -0.302 2.453 -3.209
86 2HB ASP 14 1HB ASP 14 -1.626 3.379 -3.912
87 H GLN 15 H GLN 15 2.168 4.514 -2.196
88 HA GLN 15 HA GLN 15 4.213 3.441 -4.096
89 1HB GLN 15 2HB GLN 15 3.946 6.071 -3.664
90 2HB GLN 15 1HB GLN 15 4.906 5.680 -2.235
91 1HG GLN 15 2HG GLN 15 6.045 4.304 -4.464
92 2HG GLN 15 1HG GLN 15 5.802 5.987 -4.930
93 1HE2 GLN 15 1HE2 GLN 15 6.998 7.639 -3.761
94 2HE2 GLN 15 2HE2 GLN 15 8.264 7.244 -2.702
95 H CYS 16 H CYS 16 3.181 1.736 -2.277
96 HA CYS 16 HA CYS 16 4.525 1.848 0.321
97 1HB CYS 16 2HB CYS 16 2.263 0.730 -0.550
98 2HB CYS 16 1HB CYS 16 3.331 -0.642 -0.842
99 H CYS 17 H CYS 17 5.873 -0.176 0.979
100 HA CYS 17 HA CYS 17 8.235 -0.331 -0.644
101 1HB CYS 17 2HB CYS 17 7.175 -2.108 1.579
102 2HB CYS 17 1HB CYS 17 8.836 -2.123 0.990
103 H LYS 18 H LYS 18 8.868 -1.849 -2.174
104 HA LYS 18 HA LYS 18 6.761 -3.598 -3.292
105 1HB LYS 18 2HB LYS 18 8.489 -1.965 -4.442
106 2HB LYS 18 1HB LYS 18 9.572 -3.351 -4.321
107 1HG LYS 18 2HG LYS 18 8.224 -4.685 -5.711
108 2HG LYS 18 1HG LYS 18 6.801 -3.672 -5.460
109 1HD LYS 18 2HD LYS 18 7.517 -3.066 -7.622
110 2HD LYS 18 1HD LYS 18 8.198 -1.802 -6.599
111 1HE LYS 18 2HE LYS 18 10.326 -3.227 -6.477
112 2HE LYS 18 1HE LYS 18 9.631 -4.190 -7.796
113 1HZ LYS 18 1HZ LYS 18 9.350 -2.181 -9.093
114 2HZ LYS 18 2HZ LYS 18 10.979 -2.341 -8.639
115 3HZ LYS 18 3HZ LYS 18 9.974 -1.234 -7.831
116 H SER 19 H SER 19 8.696 -4.126 -0.742
117 HA SER 19 HA SER 19 10.160 -6.521 -1.421
118 1HB SER 19 2HB SER 19 10.427 -4.905 0.554
119 2HB SER 19 1HB SER 19 9.048 -5.724 1.282
120 HG SER 19 HG SER 19 11.652 -6.566 0.927
121 H SER 20 H SER 20 6.935 -5.970 0.044
122 HA SER 20 HA SER 20 6.358 -8.895 -0.289
123 1HB SER 20 2HB SER 20 5.772 -6.815 1.719
124 2HB SER 20 1HB SER 20 4.395 -7.840 1.326
125 HG SER 20 HG SER 20 6.813 -8.454 2.551
126 H ASN 21 H ASN 21 6.050 -6.467 -2.264
127 HA ASN 21 HA ASN 21 4.472 -5.713 -3.851
128 1HB ASN 21 2HB ASN 21 3.665 -8.572 -3.246
129 2HB ASN 21 1HB ASN 21 2.951 -7.643 -4.563
130 1HD2 ASN 21 1HD2 ASN 21 5.955 -9.167 -3.436
131 2HD2 ASN 21 2HD2 ASN 21 6.776 -9.040 -4.916
132 H LEU 22 H LEU 22 3.731 -4.306 -1.866
133 HA LEU 22 HA LEU 22 0.922 -5.003 -1.081
134 1HB LEU 22 2HB LEU 22 2.954 -3.099 0.134
135 2HB LEU 22 1HB LEU 22 1.371 -3.477 0.810
136 HG LEU 22 HG LEU 22 3.444 -5.610 0.256
137 1HD1 LEU 22 1HD1 LEU 22 4.499 -4.168 1.842
138 2HD1 LEU 22 2HD1 LEU 22 3.802 -5.487 2.782
139 3HD1 LEU 22 3HD1 LEU 22 2.992 -3.922 2.725
140 1HD2 LEU 22 1HD2 LEU 22 2.023 -6.704 2.126
141 2HD2 LEU 22 2HD2 LEU 22 1.301 -6.585 0.521
142 3HD2 LEU 22 3HD2 LEU 22 0.842 -5.440 1.781
143 H VAL 23 H VAL 23 -0.701 -3.376 -1.292
144 HA VAL 23 HA VAL 23 0.045 -0.930 -2.857
145 HB VAL 23 HB VAL 23 -2.020 -1.379 -4.225
146 1HG1 VAL 23 1HG1 VAL 23 -0.096 -3.716 -4.290
147 2HG1 VAL 23 2HG1 VAL 23 0.320 -2.110 -4.891
148 3HG1 VAL 23 3HG1 VAL 23 -0.992 -3.019 -5.641
149 1HG2 VAL 23 1HG2 VAL 23 -3.091 -3.559 -4.100
150 2HG2 VAL 23 2HG2 VAL 23 -3.117 -2.837 -2.491
151 3HG2 VAL 23 3HG2 VAL 23 -1.943 -4.097 -2.873
152 H CYS 24 H CYS 24 -1.541 0.833 -2.609
153 HA CYS 24 HA CYS 24 -2.659 0.973 0.083
154 1HB CYS 24 2HB CYS 24 -1.837 2.719 -1.979
155 2HB CYS 24 1HB CYS 24 -3.549 3.052 -1.722
156 H SER 25 H SER 25 -4.803 0.780 0.689
157 HA SER 25 HA SER 25 -6.667 -0.473 -1.212
158 1HB SER 25 2HB SER 25 -6.225 -1.022 1.277
159 2HB SER 25 1HB SER 25 -7.193 0.404 1.633
160 HG SER 25 HG SER 25 -8.934 -0.624 1.009
161 H ARG 26 H ARG 26 -8.954 0.387 -1.337
162 HA ARG 26 HA ARG 26 -8.913 3.332 -1.757
163 1HB ARG 26 2HB ARG 26 -10.663 1.015 -2.595
164 2HB ARG 26 1HB ARG 26 -11.171 2.683 -2.854
165 1HG ARG 26 2HG ARG 26 -9.614 3.049 -4.489
166 2HG ARG 26 1HG ARG 26 -8.404 2.031 -3.707
167 1HD ARG 26 2HD ARG 26 -8.899 0.528 -5.357
168 2HD ARG 26 1HD ARG 26 -10.365 0.198 -4.412
169 HE ARG 26 HE ARG 26 -11.431 2.094 -5.761
170 1HH1 ARG 26 2HH1 ARG 26 -9.009 2.944 -7.267
171 2HH1 ARG 26 1HH1 ARG 26 -9.182 2.100 -8.769
172 1HH2 ARG 26 1HH2 ARG 26 -11.536 -0.144 -7.541
173 2HH2 ARG 26 2HH2 ARG 26 -10.617 0.346 -8.925
174 H LYS 27 H LYS 27 -10.728 0.841 0.049
175 HA LYS 27 HA LYS 27 -12.588 2.742 1.248
176 1HB LYS 27 2HB LYS 27 -11.820 -0.126 1.887
177 2HB LYS 27 1HB LYS 27 -13.199 0.717 2.592
178 1HG LYS 27 2HG LYS 27 -12.842 0.452 -0.399
179 2HG LYS 27 1HG LYS 27 -13.686 -0.768 0.554
180 1HD LYS 27 2HD LYS 27 -15.401 0.723 1.175
181 2HD LYS 27 1HD LYS 27 -14.438 2.143 0.768
182 1HE LYS 27 2HE LYS 27 -15.369 2.147 -1.297
183 2HE LYS 27 1HE LYS 27 -14.661 0.549 -1.601
184 1HZ LYS 27 1HZ LYS 27 -17.076 0.451 -1.728
185 2HZ LYS 27 2HZ LYS 27 -17.207 1.076 -0.153
186 3HZ LYS 27 3HZ LYS 27 -16.517 -0.455 -0.407
187 H HIS 28 H HIS 28 -9.625 1.084 2.301
188 HA HIS 28 HA HIS 28 -9.695 2.455 4.932
189 1HB HIS 28 2HB HIS 28 -7.895 0.387 3.635
190 2HB HIS 28 1HB HIS 28 -7.647 1.000 5.269
191 HD1 HIS 28 HD1 HIS 28 -10.313 1.001 6.536
192 HD2 HIS 28 HD2 HIS 28 -9.209 -2.024 3.887
193 HE1 HIS 28 HE1 HIS 28 -11.822 -0.971 7.031
194 H ALA 29 H ALA 29 -8.170 2.782 1.806
195 HA ALA 29 HA ALA 29 -6.612 4.343 0.980
196 1HB ALA 29 1HB ALA 29 -7.076 5.889 3.526
197 2HB ALA 29 2HB ALA 29 -8.375 5.708 2.348
198 3HB ALA 29 3HB ALA 29 -6.870 6.500 1.885
199 H TRP 30 H TRP 30 -5.521 2.140 2.438
200 HA TRP 30 HA TRP 30 -2.989 3.375 3.371
201 1HB TRP 30 2HB TRP 30 -3.082 2.403 5.519
202 2HB TRP 30 1HB TRP 30 -4.727 2.966 5.262
203 HD1 TRP 30 HD1 TRP 30 -5.630 0.524 3.344
204 HE1 TRP 30 HE1 TRP 30 -6.080 -1.774 4.413
205 HE3 TRP 30 HE3 TRP 30 -3.014 1.054 7.691
206 HZ2 TRP 30 HZ2 TRP 30 -5.423 -3.200 6.805
207 HZ3 TRP 30 HZ3 TRP 30 -2.946 -0.784 9.349
208 HH2 TRP 30 HH2 TRP 30 -4.145 -2.910 8.912
209 H CYS 31 H CYS 31 -1.234 1.705 3.546
210 HA CYS 31 HA CYS 31 -1.149 -0.005 1.257
211 1HB CYS 31 2HB CYS 31 0.750 1.054 2.570
212 2HB CYS 31 1HB CYS 31 0.514 -0.207 3.781
213 H LYS 32 H LYS 32 -1.673 -2.142 0.991
214 HA LYS 32 HA LYS 32 -2.213 -3.864 3.353
215 1HB LYS 32 2HB LYS 32 -4.448 -4.445 2.381
216 2HB LYS 32 1HB LYS 32 -4.337 -2.750 2.851
217 1HG LYS 32 2HG LYS 32 -4.439 -2.003 0.690
218 2HG LYS 32 1HG LYS 32 -3.518 -3.371 0.064
219 1HD LYS 32 2HD LYS 32 -5.582 -4.802 0.549
220 2HD LYS 32 1HD LYS 32 -6.453 -3.286 0.786
221 1HE LYS 32 2HE LYS 32 -5.990 -2.578 -1.484
222 2HE LYS 32 1HE LYS 32 -4.895 -3.951 -1.737
223 1HZ LYS 32 1HZ LYS 32 -6.734 -5.461 -1.314
224 2HZ LYS 32 2HZ LYS 32 -7.113 -4.424 -2.605
225 3HZ LYS 32 3HZ LYS 32 -7.787 -4.153 -1.070
226 H TYR 33 H TYR 33 -2.810 -6.178 2.435
227 HA TYR 33 HA TYR 33 -0.715 -6.872 0.479
228 1HB TYR 33 2HB TYR 33 -1.972 -8.048 2.716
229 2HB TYR 33 1HB TYR 33 -2.430 -9.048 1.338
230 HD1 TYR 33 HD1 TYR 33 -0.478 -9.643 -0.339
231 HD2 TYR 33 HD2 TYR 33 0.108 -8.390 3.729
232 HE1 TYR 33 HE1 TYR 33 1.787 -10.650 -0.354
233 HE2 TYR 33 HE2 TYR 33 2.372 -9.397 3.714
234 HH TYR 33 HH TYR 33 4.052 -10.103 1.121
235 H GLU 34 H GLU 34 -1.096 -7.251 -1.656
236 HA GLU 34 HA GLU 34 -3.822 -7.015 -2.735
237 1HB GLU 34 2HB GLU 34 -2.642 -6.986 -4.867
238 2HB GLU 34 1HB GLU 34 -1.754 -5.979 -3.726
239 1HG GLU 34 2HG GLU 34 -0.124 -7.713 -3.345
240 2HG GLU 34 1HG GLU 34 -1.082 -8.889 -4.245
241 H ILE 35 H ILE 35 -4.279 -8.700 -4.634
242 HA ILE 35 HA ILE 35 -4.461 -11.343 -3.393
243 HB ILE 35 HB ILE 35 -5.663 -11.856 -5.534
244 1HG1 ILE 35 2HG1 ILE 35 -5.695 -9.053 -6.414
245 2HG1 ILE 35 1HG1 ILE 35 -4.113 -9.812 -6.578
246 1HG2 ILE 35 1HG2 ILE 35 -7.560 -10.493 -5.052
247 2HG2 ILE 35 2HG2 ILE 35 -6.553 -9.198 -4.404
248 3HG2 ILE 35 3HG2 ILE 35 -6.722 -10.712 -3.515
249 1HD1 ILE 35 1HD1 ILE 35 -4.903 -11.453 -8.048
250 2HD1 ILE 35 2HD1 ILE 35 -5.844 -10.042 -8.532
251 3HD1 ILE 35 3HD1 ILE 35 -6.571 -11.275 -7.503
252 1HN NH2 36 1HN NH2 36 -1.229 -11.292 -5.944
253 2HN NH2 36 2HN NH2 36 -2.383 -9.955 -6.137
Start of MODEL 5
1 1H GLU 1 1H GLU 1 10.202 9.452 -0.830
2 2H GLU 1 2H GLU 1 10.430 10.632 0.370
3 3H GLU 1 3H GLU 1 8.863 10.267 -0.178
4 HA GLU 1 HA GLU 1 10.654 8.422 1.332
5 1HB GLU 1 2HB GLU 1 9.524 10.530 2.382
6 2HB GLU 1 1HB GLU 1 8.022 9.623 2.192
7 1HG GLU 1 2HG GLU 1 8.616 8.039 3.762
8 2HG GLU 1 1HG GLU 1 10.342 8.217 3.445
9 H CYS 2 H CYS 2 9.958 6.294 1.332
10 HA CYS 2 HA CYS 2 7.494 5.658 -0.253
11 1HB CYS 2 2HB CYS 2 9.761 4.876 -1.028
12 2HB CYS 2 1HB CYS 2 9.885 3.926 0.453
13 H LEU 3 H LEU 3 6.034 4.067 0.591
14 HA LEU 3 HA LEU 3 6.133 3.768 3.562
15 1HB LEU 3 2HB LEU 3 3.937 3.423 1.489
16 2HB LEU 3 1HB LEU 3 3.707 3.237 3.227
17 HG LEU 3 HG LEU 3 4.815 5.774 1.999
18 1HD1 LEU 3 1HD1 LEU 3 2.478 5.154 1.176
19 2HD1 LEU 3 2HD1 LEU 3 2.611 6.705 2.006
20 3HD1 LEU 3 3HD1 LEU 3 1.948 5.305 2.851
21 1HD2 LEU 3 1HD2 LEU 3 4.063 6.726 4.170
22 2HD2 LEU 3 2HD2 LEU 3 5.247 5.439 4.397
23 3HD2 LEU 3 3HD2 LEU 3 3.535 5.121 4.675
24 H GLY 4 H GLY 4 6.561 1.761 4.428
25 1HA GLY 4 2HA GLY 4 7.088 -0.506 2.660
26 2HA GLY 4 1HA GLY 4 7.239 -0.507 4.417
27 H PHE 5 H PHE 5 6.142 -2.630 4.330
28 HA PHE 5 HA PHE 5 3.397 -2.833 3.373
29 1HB PHE 5 2HB PHE 5 4.849 -4.770 3.425
30 2HB PHE 5 1HB PHE 5 5.179 -4.539 5.142
31 HD1 PHE 5 HD1 PHE 5 2.226 -4.936 2.843
32 HD2 PHE 5 HD2 PHE 5 3.985 -5.837 6.658
33 HE1 PHE 5 HE1 PHE 5 0.261 -6.332 3.419
34 HE2 PHE 5 HE2 PHE 5 2.018 -7.232 7.233
35 HZ PHE 5 HZ PHE 5 0.156 -7.479 5.613
36 H GLY 6 H GLY 6 1.506 -2.591 4.560
37 1HA GLY 6 2HA GLY 6 0.099 -2.182 6.403
38 2HA GLY 6 1HA GLY 6 1.468 -2.505 7.466
39 H LYS 7 H LYS 7 0.954 -0.054 4.912
40 HA LYS 7 HA LYS 7 1.473 2.071 6.968
41 1HB LYS 7 2HB LYS 7 2.597 1.580 4.210
42 2HB LYS 7 1HB LYS 7 2.594 3.203 4.898
43 1HG LYS 7 2HG LYS 7 3.551 1.227 6.815
44 2HG LYS 7 1HG LYS 7 4.519 1.227 5.341
45 1HD LYS 7 2HD LYS 7 5.319 3.342 5.703
46 2HD LYS 7 1HD LYS 7 3.810 3.898 6.428
47 1HE LYS 7 2HE LYS 7 4.337 2.836 8.534
48 2HE LYS 7 1HE LYS 7 5.737 2.008 7.824
49 1HZ LYS 7 1HZ LYS 7 5.382 4.959 7.963
50 2HZ LYS 7 2HZ LYS 7 6.729 4.142 7.322
51 3HZ LYS 7 3HZ LYS 7 6.388 4.052 8.984
52 H GLY 8 H GLY 8 -0.393 3.264 7.126
53 1HA GLY 8 2HA GLY 8 -2.544 3.220 5.276
54 2HA GLY 8 1HA GLY 8 -2.312 4.459 6.506
55 H CYS 9 H CYS 9 -2.584 4.025 3.247
56 HA CYS 9 HA CYS 9 -1.204 6.617 2.689
57 1HB CYS 9 2HB CYS 9 0.207 5.627 1.205
58 2HB CYS 9 1HB CYS 9 -0.231 4.117 1.996
59 H ASN 10 H ASN 10 -1.910 7.183 0.205
60 HA ASN 10 HA ASN 10 -4.867 7.261 0.272
61 1HB ASN 10 2HB ASN 10 -2.689 8.563 -1.382
62 2HB ASN 10 1HB ASN 10 -4.402 8.815 -1.713
63 1HD2 ASN 10 1HD2 ASN 10 -1.775 9.648 0.452
64 2HD2 ASN 10 2HD2 ASN 10 -2.665 10.707 1.436
65 HA PRO 11 HA PRO 11 -5.263 3.958 -2.653
66 1HB PRO 11 2HB PRO 11 -7.825 4.479 -3.484
67 2HB PRO 11 1HB PRO 11 -7.445 3.732 -1.920
68 1HG PRO 11 2HG PRO 11 -8.147 6.555 -2.546
69 2HG PRO 11 1HG PRO 11 -8.625 5.552 -1.168
70 1HD PRO 11 2HD PRO 11 -6.675 7.443 -1.029
71 2HD PRO 11 1HD PRO 11 -6.694 5.986 -0.010
72 H SER 12 H SER 12 -6.398 7.215 -3.658
73 HA SER 12 HA SER 12 -6.118 6.744 -6.498
74 1HB SER 12 2HB SER 12 -6.344 9.218 -6.583
75 2HB SER 12 1HB SER 12 -7.526 8.508 -5.489
76 HG SER 12 HG SER 12 -6.635 9.589 -3.927
77 H ASN 13 H ASN 13 -3.984 8.053 -3.988
78 HA ASN 13 HA ASN 13 -1.720 8.097 -5.959
79 1HB ASN 13 2HB ASN 13 -2.439 9.749 -3.528
80 2HB ASN 13 1HB ASN 13 -0.796 9.735 -4.167
81 1HD2 ASN 13 1HD2 ASN 13 -0.446 10.656 -6.335
82 2HD2 ASN 13 2HD2 ASN 13 -1.613 11.655 -7.056
83 H ASP 14 H ASP 14 -1.762 5.673 -5.318
84 HA ASP 14 HA ASP 14 -1.065 4.794 -2.683
85 1HB ASP 14 2HB ASP 14 -1.953 3.239 -4.255
86 2HB ASP 14 1HB ASP 14 -0.760 3.678 -5.478
87 H GLN 15 H GLN 15 0.827 5.092 -1.603
88 HA GLN 15 HA GLN 15 3.319 5.639 -3.183
89 1HB GLN 15 2HB GLN 15 2.075 7.313 -1.513
90 2HB GLN 15 1HB GLN 15 2.979 6.398 -0.306
91 1HG GLN 15 2HG GLN 15 5.079 6.897 -1.423
92 2HG GLN 15 1HG GLN 15 4.227 7.686 -2.750
93 1HE2 GLN 15 1HE2 GLN 15 5.335 8.087 0.568
94 2HE2 GLN 15 2HE2 GLN 15 4.876 9.714 0.723
95 H CYS 16 H CYS 16 2.252 2.955 -2.369
96 HA CYS 16 HA CYS 16 3.899 2.040 -0.121
97 1HB CYS 16 2HB CYS 16 2.213 0.646 -2.230
98 2HB CYS 16 1HB CYS 16 2.968 -0.184 -0.870
99 H CYS 17 H CYS 17 5.777 0.726 -0.307
100 HA CYS 17 HA CYS 17 7.516 1.235 -2.549
101 1HB CYS 17 2HB CYS 17 7.513 -0.227 0.021
102 2HB CYS 17 1HB CYS 17 8.609 -0.888 -1.190
103 H LYS 18 H LYS 18 7.943 -0.023 -4.360
104 HA LYS 18 HA LYS 18 6.102 -2.272 -4.924
105 1HB LYS 18 2HB LYS 18 7.161 -0.169 -6.360
106 2HB LYS 18 1HB LYS 18 8.152 -1.524 -6.902
107 1HG LYS 18 2HG LYS 18 5.814 -2.753 -7.070
108 2HG LYS 18 1HG LYS 18 5.198 -1.103 -7.184
109 1HD LYS 18 2HD LYS 18 5.751 -1.110 -9.366
110 2HD LYS 18 1HD LYS 18 7.446 -1.202 -8.890
111 1HE LYS 18 2HE LYS 18 5.806 -3.726 -8.927
112 2HE LYS 18 1HE LYS 18 6.455 -3.083 -10.448
113 1HZ LYS 18 1HZ LYS 18 8.003 -3.662 -7.974
114 2HZ LYS 18 2HZ LYS 18 8.642 -2.921 -9.364
115 3HZ LYS 18 3HZ LYS 18 8.083 -4.524 -9.433
116 H SER 19 H SER 19 8.731 -2.339 -3.113
117 HA SER 19 HA SER 19 10.512 -4.201 -4.446
118 1HB SER 19 2HB SER 19 10.803 -2.587 -2.382
119 2HB SER 19 1HB SER 19 10.180 -3.954 -1.461
120 HG SER 19 HG SER 19 12.191 -4.584 -1.539
121 H SER 20 H SER 20 7.819 -4.560 -2.125
122 HA SER 20 HA SER 20 7.877 -7.522 -2.614
123 1HB SER 20 2HB SER 20 7.084 -5.818 -0.238
124 2HB SER 20 1HB SER 20 6.694 -7.531 -0.343
125 HG SER 20 HG SER 20 8.724 -8.008 0.005
126 H ASN 21 H ASN 21 6.500 -5.488 -4.290
127 HA ASN 21 HA ASN 21 4.396 -5.093 -5.269
128 1HB ASN 21 2HB ASN 21 4.310 -7.906 -4.181
129 2HB ASN 21 1HB ASN 21 2.921 -7.237 -5.038
130 1HD2 ASN 21 1HD2 ASN 21 6.388 -8.044 -5.422
131 2HD2 ASN 21 2HD2 ASN 21 6.352 -8.080 -7.118
132 H LEU 22 H LEU 22 4.263 -3.482 -3.289
133 HA LEU 22 HA LEU 22 2.049 -4.256 -1.431
134 1HB LEU 22 2HB LEU 22 4.105 -2.020 -1.424
135 2HB LEU 22 1HB LEU 22 2.873 -2.236 -0.183
136 HG LEU 22 HG LEU 22 4.786 -4.458 -0.911
137 1HD1 LEU 22 1HD1 LEU 22 6.238 -2.670 -0.247
138 2HD1 LEU 22 2HD1 LEU 22 6.048 -3.702 1.170
139 3HD1 LEU 22 3HD1 LEU 22 5.154 -2.186 1.057
140 1HD2 LEU 22 1HD2 LEU 22 4.202 -5.206 1.386
141 2HD2 LEU 22 2HD2 LEU 22 2.770 -5.059 0.367
142 3HD2 LEU 22 3HD2 LEU 22 3.138 -3.810 1.556
143 H VAL 23 H VAL 23 0.053 -3.340 -1.714
144 HA VAL 23 HA VAL 23 -0.163 -0.853 -3.377
145 HB VAL 23 HB VAL 23 -2.234 -1.941 -4.358
146 1HG1 VAL 23 1HG1 VAL 23 0.302 -3.530 -4.821
147 2HG1 VAL 23 2HG1 VAL 23 0.042 -1.907 -5.462
148 3HG1 VAL 23 3HG1 VAL 23 -1.003 -3.233 -5.970
149 1HG2 VAL 23 1HG2 VAL 23 -2.550 -4.324 -4.100
150 2HG2 VAL 23 2HG2 VAL 23 -2.453 -3.630 -2.482
151 3HG2 VAL 23 3HG2 VAL 23 -1.062 -4.473 -3.164
152 H CYS 24 H CYS 24 -1.839 0.572 -2.726
153 HA CYS 24 HA CYS 24 -2.750 0.285 0.038
154 1HB CYS 24 2HB CYS 24 -2.338 2.342 -1.891
155 2HB CYS 24 1HB CYS 24 -4.024 2.431 -1.385
156 H SER 25 H SER 25 -4.573 -0.820 0.592
157 HA SER 25 HA SER 25 -6.565 -1.573 -1.451
158 1HB SER 25 2HB SER 25 -6.123 -2.126 1.493
159 2HB SER 25 1HB SER 25 -7.548 -2.716 0.641
160 HG SER 25 HG SER 25 -6.285 -4.289 0.056
161 H ARG 26 H ARG 26 -8.976 -1.360 -0.629
162 HA ARG 26 HA ARG 26 -9.424 1.515 0.007
163 1HB ARG 26 2HB ARG 26 -10.550 -0.423 -1.733
164 2HB ARG 26 1HB ARG 26 -11.800 -0.033 -0.550
165 1HG ARG 26 2HG ARG 26 -10.807 2.456 -1.108
166 2HG ARG 26 1HG ARG 26 -10.622 1.655 -2.670
167 1HD ARG 26 2HD ARG 26 -12.879 1.563 -3.023
168 2HD ARG 26 1HD ARG 26 -13.220 1.159 -1.328
169 HE ARG 26 HE ARG 26 -12.495 3.934 -2.204
170 1HH1 ARG 26 2HH1 ARG 26 -12.580 3.135 0.745
171 2HH1 ARG 26 1HH1 ARG 26 -14.161 3.685 1.193
172 1HH2 ARG 26 1HH2 ARG 26 -15.267 4.020 -2.082
173 2HH2 ARG 26 2HH2 ARG 26 -15.683 4.187 -0.409
174 H LYS 27 H LYS 27 -10.288 -1.742 1.187
175 HA LYS 27 HA LYS 27 -12.015 -0.857 3.327
176 1HB LYS 27 2HB LYS 27 -11.860 -3.138 2.222
177 2HB LYS 27 1HB LYS 27 -10.369 -3.395 3.127
178 1HG LYS 27 2HG LYS 27 -11.460 -3.637 5.127
179 2HG LYS 27 1HG LYS 27 -12.716 -2.473 4.703
180 1HD LYS 27 2HD LYS 27 -12.587 -5.092 3.237
181 2HD LYS 27 1HD LYS 27 -13.306 -5.037 4.847
182 1HE LYS 27 2HE LYS 27 -14.768 -3.122 4.018
183 2HE LYS 27 1HE LYS 27 -14.183 -3.494 2.384
184 1HZ LYS 27 1HZ LYS 27 -15.467 -5.427 4.246
185 2HZ LYS 27 2HZ LYS 27 -14.885 -5.790 2.691
186 3HZ LYS 27 3HZ LYS 27 -16.203 -4.737 2.883
187 H HIS 28 H HIS 28 -8.549 -1.635 3.146
188 HA HIS 28 HA HIS 28 -8.189 -0.900 6.011
189 1HB HIS 28 2HB HIS 28 -6.406 -2.153 3.899
190 2HB HIS 28 1HB HIS 28 -5.890 -1.831 5.554
191 HD1 HIS 28 HD1 HIS 28 -7.357 -3.071 7.471
192 HD2 HIS 28 HD2 HIS 28 -7.812 -4.531 3.593
193 HE1 HIS 28 HE1 HIS 28 -8.433 -5.354 7.687
194 H ALA 29 H ALA 29 -7.527 0.284 2.764
195 HA ALA 29 HA ALA 29 -6.586 2.303 2.001
196 1HB ALA 29 1HB ALA 29 -6.866 3.301 4.831
197 2HB ALA 29 2HB ALA 29 -8.301 2.942 3.870
198 3HB ALA 29 3HB ALA 29 -7.155 4.166 3.322
199 H TRP 30 H TRP 30 -4.730 0.273 2.883
200 HA TRP 30 HA TRP 30 -2.409 2.007 3.499
201 1HB TRP 30 2HB TRP 30 -1.829 0.874 5.499
202 2HB TRP 30 1HB TRP 30 -3.561 1.130 5.629
203 HD1 TRP 30 HD1 TRP 30 -4.058 -1.417 3.459
204 HE1 TRP 30 HE1 TRP 30 -3.989 -3.780 4.476
205 HE3 TRP 30 HE3 TRP 30 -1.571 -0.429 7.801
206 HZ2 TRP 30 HZ2 TRP 30 -3.013 -5.084 6.825
207 HZ3 TRP 30 HZ3 TRP 30 -1.089 -2.247 9.414
208 HH2 TRP 30 HH2 TRP 30 -1.805 -4.570 8.934
209 H CYS 31 H CYS 31 -0.317 0.578 3.430
210 HA CYS 31 HA CYS 31 -0.206 -0.768 0.893
211 1HB CYS 31 2HB CYS 31 1.678 -0.760 3.276
212 2HB CYS 31 1HB CYS 31 2.108 -1.324 1.664
213 H LYS 32 H LYS 32 -1.087 -2.745 0.500
214 HA LYS 32 HA LYS 32 -0.912 -4.853 2.634
215 1HB LYS 32 2HB LYS 32 -3.178 -3.682 1.976
216 2HB LYS 32 1HB LYS 32 -3.085 -4.719 0.553
217 1HG LYS 32 2HG LYS 32 -3.031 -6.709 1.914
218 2HG LYS 32 1HG LYS 32 -2.853 -5.759 3.389
219 1HD LYS 32 2HD LYS 32 -5.084 -5.506 3.565
220 2HD LYS 32 1HD LYS 32 -5.187 -4.886 1.917
221 1HE LYS 32 2HE LYS 32 -5.351 -7.120 1.002
222 2HE LYS 32 1HE LYS 32 -4.995 -7.846 2.581
223 1HZ LYS 32 1HZ LYS 32 -7.396 -7.758 2.127
224 2HZ LYS 32 2HZ LYS 32 -7.309 -6.066 2.007
225 3HZ LYS 32 3HZ LYS 32 -6.974 -6.836 3.485
226 H TYR 33 H TYR 33 -0.944 -7.106 1.677
227 HA TYR 33 HA TYR 33 0.985 -7.378 -0.462
228 1HB TYR 33 2HB TYR 33 0.423 -8.897 1.566
229 2HB TYR 33 1HB TYR 33 -0.883 -9.523 0.559
230 HD1 TYR 33 HD1 TYR 33 2.807 -9.013 0.697
231 HD2 TYR 33 HD2 TYR 33 -0.454 -11.074 -1.188
232 HE1 TYR 33 HE1 TYR 33 4.418 -10.485 -0.479
233 HE2 TYR 33 HE2 TYR 33 1.155 -12.548 -2.365
234 HH TYR 33 HH TYR 33 3.962 -13.190 -1.587
235 H GLU 34 H GLU 34 0.635 -8.167 -2.603
236 HA GLU 34 HA GLU 34 -1.827 -7.332 -3.892
237 1HB GLU 34 2HB GLU 34 0.485 -7.306 -4.863
238 2HB GLU 34 1HB GLU 34 0.453 -9.069 -4.897
239 1HG GLU 34 2HG GLU 34 -1.947 -8.012 -6.118
240 2HG GLU 34 1HG GLU 34 -0.518 -7.311 -6.881
241 H ILE 35 H ILE 35 -3.667 -8.533 -4.175
242 HA ILE 35 HA ILE 35 -3.696 -11.372 -3.324
243 HB ILE 35 HB ILE 35 -5.827 -9.374 -4.164
244 1HG1 ILE 35 2HG1 ILE 35 -5.682 -10.562 -1.436
245 2HG1 ILE 35 1HG1 ILE 35 -4.414 -9.411 -1.855
246 1HG2 ILE 35 1HG2 ILE 35 -7.379 -11.124 -3.118
247 2HG2 ILE 35 2HG2 ILE 35 -6.029 -12.252 -3.249
248 3HG2 ILE 35 3HG2 ILE 35 -6.715 -11.526 -4.702
249 1HD1 ILE 35 1HD1 ILE 35 -7.315 -8.779 -2.380
250 2HD1 ILE 35 2HD1 ILE 35 -5.956 -7.664 -2.234
251 3HD1 ILE 35 3HD1 ILE 35 -6.589 -8.474 -0.801
252 1HN NH2 36 1HN NH2 36 -4.251 -13.042 -6.363
253 2HN NH2 36 2HN NH2 36 -4.670 -13.038 -4.636
Start of MODEL 6
1 1H GLU 1 1H GLU 1 13.525 6.916 1.343
2 2H GLU 1 2H GLU 1 12.348 6.727 0.132
3 3H GLU 1 3H GLU 1 13.220 5.381 0.691
4 HA GLU 1 HA GLU 1 12.199 5.622 2.897
5 1HB GLU 1 2HB GLU 1 11.187 8.040 1.441
6 2HB GLU 1 1HB GLU 1 10.153 7.322 2.675
7 1HG GLU 1 2HG GLU 1 11.856 7.578 4.362
8 2HG GLU 1 1HG GLU 1 13.052 8.058 3.157
9 H CYS 2 H CYS 2 11.087 3.706 2.805
10 HA CYS 2 HA CYS 2 9.050 3.329 0.636
11 1HB CYS 2 2HB CYS 2 11.072 1.813 0.799
12 2HB CYS 2 1HB CYS 2 10.462 1.268 2.362
13 H LEU 3 H LEU 3 6.994 2.470 1.217
14 HA LEU 3 HA LEU 3 6.208 2.985 4.045
15 1HB LEU 3 2HB LEU 3 4.705 2.648 1.432
16 2HB LEU 3 1HB LEU 3 3.912 2.922 2.984
17 HG LEU 3 HG LEU 3 6.042 4.767 1.869
18 1HD1 LEU 3 1HD1 LEU 3 4.167 4.803 0.323
19 2HD1 LEU 3 2HD1 LEU 3 4.107 6.267 1.304
20 3HD1 LEU 3 3HD1 LEU 3 3.019 4.925 1.656
21 1HD2 LEU 3 1HD2 LEU 3 5.725 4.923 4.282
22 2HD2 LEU 3 2HD2 LEU 3 3.975 5.012 4.082
23 3HD2 LEU 3 3HD2 LEU 3 4.995 6.339 3.526
24 H GLY 4 H GLY 4 5.868 1.272 5.388
25 1HA GLY 4 2HA GLY 4 5.998 -1.465 4.385
26 2HA GLY 4 1HA GLY 4 5.785 -0.987 6.069
27 H PHE 5 H PHE 5 4.037 -2.394 6.480
28 HA PHE 5 HA PHE 5 1.649 -2.323 4.748
29 1HB PHE 5 2HB PHE 5 2.361 -4.434 5.671
30 2HB PHE 5 1HB PHE 5 2.429 -3.763 7.300
31 HD1 PHE 5 HD1 PHE 5 -0.105 -3.795 4.513
32 HD2 PHE 5 HD2 PHE 5 0.710 -4.499 8.673
33 HE1 PHE 5 HE1 PHE 5 -2.479 -4.405 4.877
34 HE2 PHE 5 HE2 PHE 5 -1.666 -5.110 9.034
35 HZ PHE 5 HZ PHE 5 -3.260 -5.062 7.135
36 H GLY 6 H GLY 6 -0.289 -1.318 5.274
37 1HA GLY 6 2HA GLY 6 -1.822 0.032 6.423
38 2HA GLY 6 1HA GLY 6 -0.923 -0.299 7.903
39 H LYS 7 H LYS 7 0.378 1.156 4.939
40 HA LYS 7 HA LYS 7 0.929 3.661 6.500
41 1HB LYS 7 2HB LYS 7 2.462 2.164 4.355
42 2HB LYS 7 1HB LYS 7 2.893 3.794 4.872
43 1HG LYS 7 2HG LYS 7 2.495 1.760 7.014
44 2HG LYS 7 1HG LYS 7 3.946 1.609 6.026
45 1HD LYS 7 2HD LYS 7 4.263 4.145 6.474
46 2HD LYS 7 1HD LYS 7 3.102 3.910 7.781
47 1HE LYS 7 2HE LYS 7 5.465 2.051 7.542
48 2HE LYS 7 1HE LYS 7 5.653 3.634 8.321
49 1HZ LYS 7 1HZ LYS 7 3.730 3.122 9.718
50 2HZ LYS 7 2HZ LYS 7 4.968 1.980 9.939
51 3HZ LYS 7 3HZ LYS 7 3.604 1.588 9.005
52 H GLY 8 H GLY 8 -0.059 5.466 5.678
53 1HA GLY 8 2HA GLY 8 -1.910 5.544 3.613
54 2HA GLY 8 1HA GLY 8 -1.003 6.964 4.124
55 H CYS 9 H CYS 9 -1.832 5.504 1.432
56 HA CYS 9 HA CYS 9 0.620 6.314 -0.035
57 1HB CYS 9 2HB CYS 9 1.001 3.977 0.479
58 2HB CYS 9 1HB CYS 9 -0.642 3.552 0.003
59 H ASN 10 H ASN 10 0.150 6.668 -2.333
60 HA ASN 10 HA ASN 10 -2.684 7.360 -2.832
61 1HB ASN 10 2HB ASN 10 -0.010 7.867 -4.129
62 2HB ASN 10 1HB ASN 10 -1.498 8.217 -5.009
63 1HD2 ASN 10 1HD2 ASN 10 0.429 9.140 -2.169
64 2HD2 ASN 10 2HD2 ASN 10 -0.411 10.582 -1.856
65 HA PRO 11 HA PRO 11 -3.459 3.661 -5.135
66 1HB PRO 11 2HB PRO 11 -5.596 4.536 -6.614
67 2HB PRO 11 1HB PRO 11 -5.711 4.123 -4.892
68 1HG PRO 11 2HG PRO 11 -5.472 6.798 -6.183
69 2HG PRO 11 1HG PRO 11 -6.466 6.295 -4.806
70 1HD PRO 11 2HD PRO 11 -4.138 7.655 -4.517
71 2HD PRO 11 1HD PRO 11 -4.734 6.494 -3.309
72 H SER 12 H SER 12 -3.448 6.754 -6.954
73 HA SER 12 HA SER 12 -2.840 5.548 -9.519
74 1HB SER 12 2HB SER 12 -2.690 8.327 -8.335
75 2HB SER 12 1HB SER 12 -2.246 8.006 -10.008
76 HG SER 12 HG SER 12 -4.286 7.799 -10.482
77 H ASN 13 H ASN 13 -0.865 7.341 -7.144
78 HA ASN 13 HA ASN 13 1.618 6.376 -8.493
79 1HB ASN 13 2HB ASN 13 0.774 8.675 -6.792
80 2HB ASN 13 1HB ASN 13 2.430 8.111 -6.570
81 1HD2 ASN 13 1HD2 ASN 13 3.959 8.669 -8.178
82 2HD2 ASN 13 2HD2 ASN 13 3.560 9.468 -9.622
83 H ASP 14 H ASP 14 0.411 4.292 -7.249
84 HA ASP 14 HA ASP 14 1.023 3.996 -4.442
85 1HB ASP 14 2HB ASP 14 0.452 1.617 -4.904
86 2HB ASP 14 1HB ASP 14 -0.731 2.725 -5.592
87 H GLN 15 H GLN 15 3.037 3.818 -3.609
88 HA GLN 15 HA GLN 15 5.098 2.250 -5.112
89 1HB GLN 15 2HB GLN 15 5.192 5.058 -4.003
90 2HB GLN 15 1HB GLN 15 6.676 4.129 -4.220
91 1HG GLN 15 2HG GLN 15 6.406 4.005 -6.556
92 2HG GLN 15 1HG GLN 15 4.686 4.386 -6.469
93 1HE2 GLN 15 1HE2 GLN 15 7.817 5.760 -6.907
94 2HE2 GLN 15 2HE2 GLN 15 7.357 7.391 -6.813
95 H CYS 16 H CYS 16 3.674 1.089 -3.065
96 HA CYS 16 HA CYS 16 4.910 1.500 -0.447
97 1HB CYS 16 2HB CYS 16 2.662 0.180 -1.611
98 2HB CYS 16 1HB CYS 16 3.590 -1.040 -0.741
99 H CYS 17 H CYS 17 5.796 -0.664 0.640
100 HA CYS 17 HA CYS 17 8.233 -1.391 -0.747
101 1HB CYS 17 2HB CYS 17 6.871 -1.877 1.829
102 2HB CYS 17 1HB CYS 17 7.929 -3.189 1.313
103 H LYS 18 H LYS 18 8.406 -2.915 -2.330
104 HA LYS 18 HA LYS 18 6.208 -4.755 -2.938
105 1HB LYS 18 2HB LYS 18 8.029 -3.461 -4.412
106 2HB LYS 18 1HB LYS 18 8.925 -4.961 -4.171
107 1HG LYS 18 2HG LYS 18 7.743 -5.693 -5.972
108 2HG LYS 18 1HG LYS 18 6.443 -5.927 -4.803
109 1HD LYS 18 2HD LYS 18 5.859 -3.441 -5.277
110 2HD LYS 18 1HD LYS 18 6.860 -3.634 -6.716
111 1HE LYS 18 2HE LYS 18 5.393 -5.809 -7.082
112 2HE LYS 18 1HE LYS 18 4.239 -4.944 -6.047
113 1HZ LYS 18 1HZ LYS 18 3.925 -4.334 -8.368
114 2HZ LYS 18 2HZ LYS 18 5.549 -3.850 -8.486
115 3HZ LYS 18 3HZ LYS 18 4.476 -3.000 -7.479
116 H SER 19 H SER 19 8.919 -4.905 -0.837
117 HA SER 19 HA SER 19 9.765 -7.618 -1.085
118 1HB SER 19 2HB SER 19 9.659 -5.589 1.149
119 2HB SER 19 1HB SER 19 10.323 -7.198 1.417
120 HG SER 19 HG SER 19 12.001 -6.706 0.219
121 H SER 20 H SER 20 7.101 -6.170 0.811
122 HA SER 20 HA SER 20 6.259 -8.867 1.750
123 1HB SER 20 2HB SER 20 6.474 -6.806 3.222
124 2HB SER 20 1HB SER 20 5.104 -6.128 2.349
125 HG SER 20 HG SER 20 3.811 -7.449 3.372
126 H ASN 21 H ASN 21 5.822 -7.320 -1.075
127 HA ASN 21 HA ASN 21 4.141 -7.272 -2.720
128 1HB ASN 21 2HB ASN 21 3.969 -9.745 -1.145
129 2HB ASN 21 1HB ASN 21 2.457 -9.348 -1.961
130 1HD2 ASN 21 1HD2 ASN 21 5.996 -9.548 -2.667
131 2HD2 ASN 21 2HD2 ASN 21 5.790 -10.084 -4.265
132 H LEU 22 H LEU 22 3.623 -5.252 -1.067
133 HA LEU 22 HA LEU 22 0.815 -5.523 -0.076
134 1HB LEU 22 2HB LEU 22 3.090 -3.580 0.395
135 2HB LEU 22 1HB LEU 22 1.456 -3.276 0.985
136 HG LEU 22 HG LEU 22 2.889 -5.864 1.588
137 1HD1 LEU 22 1HD1 LEU 22 3.549 -4.855 3.750
138 2HD1 LEU 22 2HD1 LEU 22 2.923 -3.298 3.208
139 3HD1 LEU 22 3HD1 LEU 22 4.311 -4.022 2.396
140 1HD2 LEU 22 1HD2 LEU 22 0.514 -4.353 2.690
141 2HD2 LEU 22 2HD2 LEU 22 1.311 -5.621 3.622
142 3HD2 LEU 22 3HD2 LEU 22 0.568 -6.002 2.069
143 H VAL 23 H VAL 23 -0.765 -3.950 -0.738
144 HA VAL 23 HA VAL 23 -0.053 -2.386 -3.203
145 HB VAL 23 HB VAL 23 -2.399 -2.960 -3.948
146 1HG1 VAL 23 1HG1 VAL 23 -1.809 -5.126 -4.760
147 2HG1 VAL 23 2HG1 VAL 23 -0.760 -5.437 -3.377
148 3HG1 VAL 23 3HG1 VAL 23 -0.290 -4.247 -4.591
149 1HG2 VAL 23 1HG2 VAL 23 -2.291 -4.988 -1.694
150 2HG2 VAL 23 2HG2 VAL 23 -3.628 -4.696 -2.806
151 3HG2 VAL 23 3HG2 VAL 23 -3.205 -3.482 -1.600
152 H CYS 24 H CYS 24 -1.036 -0.323 -3.369
153 HA CYS 24 HA CYS 24 -1.917 0.879 -0.841
154 1HB CYS 24 2HB CYS 24 -1.643 1.948 -3.671
155 2HB CYS 24 1HB CYS 24 -1.901 2.941 -2.236
156 H SER 25 H SER 25 -4.016 0.592 -0.213
157 HA SER 25 HA SER 25 -6.173 -0.155 -1.970
158 1HB SER 25 2HB SER 25 -5.912 -0.577 0.515
159 2HB SER 25 1HB SER 25 -6.301 1.120 0.779
160 HG SER 25 HG SER 25 -8.240 0.176 0.857
161 H ARG 26 H ARG 26 -7.849 1.105 -2.831
162 HA ARG 26 HA ARG 26 -7.279 3.980 -3.187
163 1HB ARG 26 2HB ARG 26 -9.164 3.793 -4.811
164 2HB ARG 26 1HB ARG 26 -7.923 2.574 -5.088
165 1HG ARG 26 2HG ARG 26 -9.395 0.904 -4.746
166 2HG ARG 26 1HG ARG 26 -9.897 1.592 -3.204
167 1HD ARG 26 2HD ARG 26 -10.888 3.001 -5.635
168 2HD ARG 26 1HD ARG 26 -11.585 1.402 -5.307
169 HE ARG 26 HE ARG 26 -11.892 2.344 -2.893
170 1HH1 ARG 26 1HH2 ARG 26 -10.888 5.091 -3.720
171 2HH1 ARG 26 2HH2 ARG 26 -12.378 5.931 -3.991
172 1HH2 ARG 26 2HH1 ARG 26 -14.293 3.037 -4.136
173 2HH2 ARG 26 1HH1 ARG 26 -14.310 4.766 -4.227
174 H LYS 27 H LYS 27 -9.498 1.961 -1.345
175 HA LYS 27 HA LYS 27 -11.284 4.227 -0.700
176 1HB LYS 27 2HB LYS 27 -11.515 1.458 -0.908
177 2HB LYS 27 1HB LYS 27 -11.574 1.748 0.830
178 1HG LYS 27 2HG LYS 27 -13.593 2.786 0.714
179 2HG LYS 27 1HG LYS 27 -13.170 3.646 -0.766
180 1HD LYS 27 2HD LYS 27 -14.541 2.214 -1.846
181 2HD LYS 27 1HD LYS 27 -13.312 0.981 -1.569
182 1HE LYS 27 2HE LYS 27 -15.242 1.558 0.655
183 2HE LYS 27 1HE LYS 27 -15.805 0.594 -0.724
184 1HZ LYS 27 1HZ LYS 27 -14.779 -0.834 0.928
185 2HZ LYS 27 2HZ LYS 27 -13.350 0.082 0.876
186 3HZ LYS 27 3HZ LYS 27 -13.839 -0.813 -0.483
187 H HIS 28 H HIS 28 -8.767 2.265 0.849
188 HA HIS 28 HA HIS 28 -9.069 3.701 3.422
189 1HB HIS 28 2HB HIS 28 -7.473 1.383 2.347
190 2HB HIS 28 1HB HIS 28 -7.026 2.121 3.883
191 HD1 HIS 28 HD1 HIS 28 -7.806 0.181 5.369
192 HD2 HIS 28 HD2 HIS 28 -10.818 1.638 2.882
193 HE1 HIS 28 HE1 HIS 28 -9.965 -0.879 6.161
194 H ALA 29 H ALA 29 -7.181 3.921 0.508
195 HA ALA 29 HA ALA 29 -5.442 5.369 -0.134
196 1HB ALA 29 1HB ALA 29 -7.213 6.840 1.121
197 2HB ALA 29 2HB ALA 29 -5.622 7.523 0.782
198 3HB ALA 29 3HB ALA 29 -5.994 6.911 2.394
199 H TRP 30 H TRP 30 -4.727 3.055 1.490
200 HA TRP 30 HA TRP 30 -2.117 4.020 2.498
201 1HB TRP 30 2HB TRP 30 -2.436 3.257 4.712
202 2HB TRP 30 1HB TRP 30 -3.960 4.042 4.321
203 HD1 TRP 30 HD1 TRP 30 -4.846 1.415 2.449
204 HE1 TRP 30 HE1 TRP 30 -5.812 -0.614 3.708
205 HE3 TRP 30 HE3 TRP 30 -3.090 2.388 7.134
206 HZ2 TRP 30 HZ2 TRP 30 -5.838 -1.681 6.364
207 HZ3 TRP 30 HZ3 TRP 30 -3.599 0.854 9.012
208 HH2 TRP 30 HH2 TRP 30 -4.969 -1.178 8.633
209 H CYS 31 H CYS 31 -1.008 1.775 3.475
210 HA CYS 31 HA CYS 31 -0.937 -0.012 1.134
211 1HB CYS 31 2HB CYS 31 0.919 0.953 2.878
212 2HB CYS 31 1HB CYS 31 0.601 -0.624 3.600
213 H LYS 32 H LYS 32 -2.218 -1.790 1.011
214 HA LYS 32 HA LYS 32 -3.267 -2.998 3.550
215 1HB LYS 32 2HB LYS 32 -4.682 -1.825 1.597
216 2HB LYS 32 1HB LYS 32 -4.541 -3.429 0.878
217 1HG LYS 32 2HG LYS 32 -5.335 -4.343 3.141
218 2HG LYS 32 1HG LYS 32 -5.780 -2.682 3.532
219 1HD LYS 32 2HD LYS 32 -6.937 -2.838 1.120
220 2HD LYS 32 1HD LYS 32 -6.985 -4.550 1.542
221 1HE LYS 32 2HE LYS 32 -8.900 -4.021 2.670
222 2HE LYS 32 1HE LYS 32 -7.820 -3.317 3.890
223 1HZ LYS 32 1HZ LYS 32 -9.494 -1.727 2.998
224 2HZ LYS 32 2HZ LYS 32 -8.762 -1.865 1.472
225 3HZ LYS 32 3HZ LYS 32 -7.890 -1.220 2.782
226 H TYR 33 H TYR 33 -3.562 -5.378 3.464
227 HA TYR 33 HA TYR 33 -1.317 -6.698 2.055
228 1HB TYR 33 2HB TYR 33 -2.327 -6.899 4.549
229 2HB TYR 33 1HB TYR 33 -3.262 -8.174 3.768
230 HD1 TYR 33 HD1 TYR 33 -2.196 -10.178 2.903
231 HD2 TYR 33 HD2 TYR 33 0.131 -7.024 4.663
232 HE1 TYR 33 HE1 TYR 33 -0.228 -11.684 3.001
233 HE2 TYR 33 HE2 TYR 33 2.098 -8.530 4.761
234 HH TYR 33 HH TYR 33 2.131 -11.509 4.782
235 H GLU 34 H GLU 34 -1.627 -8.481 0.614
236 HA GLU 34 HA GLU 34 -4.246 -8.475 -0.800
237 1HB GLU 34 2HB GLU 34 -1.768 -8.267 -1.739
238 2HB GLU 34 1HB GLU 34 -1.826 -10.028 -1.655
239 1HG GLU 34 2HG GLU 34 -3.694 -10.139 -3.136
240 2HG GLU 34 1HG GLU 34 -4.001 -8.407 -2.994
241 H ILE 35 H ILE 35 -5.667 -10.153 -0.541
242 HA ILE 35 HA ILE 35 -4.672 -12.668 0.769
243 HB ILE 35 HB ILE 35 -7.343 -11.220 0.847
244 1HG1 ILE 35 2HG1 ILE 35 -6.425 -11.662 3.431
245 2HG1 ILE 35 1HG1 ILE 35 -4.947 -11.292 2.543
246 1HG2 ILE 35 1HG2 ILE 35 -7.870 -13.553 0.885
247 2HG2 ILE 35 2HG2 ILE 35 -7.891 -13.027 2.568
248 3HG2 ILE 35 3HG2 ILE 35 -6.503 -13.915 1.939
249 1HD1 ILE 35 1HD1 ILE 35 -5.795 -9.187 1.811
250 2HD1 ILE 35 2HD1 ILE 35 -6.206 -9.288 3.523
251 3HD1 ILE 35 3HD1 ILE 35 -7.439 -9.597 2.299
252 1HN NH2 36 1HN NH2 36 -5.944 -14.825 -1.665
253 2HN NH2 36 2HN NH2 36 -5.498 -14.656 0.047
Start of MODEL 7
1 1H GLU 1 1H GLU 1 12.454 7.858 -0.806
2 2H GLU 1 2H GLU 1 12.846 6.670 0.343
3 3H GLU 1 3H GLU 1 13.162 8.306 0.670
4 HA GLU 1 HA GLU 1 11.212 7.712 1.895
5 1HB GLU 1 2HB GLU 1 10.966 9.385 -0.599
6 2HB GLU 1 1HB GLU 1 9.585 9.217 0.484
7 1HG GLU 1 2HG GLU 1 11.505 9.770 2.304
8 2HG GLU 1 1HG GLU 1 12.169 10.628 0.913
9 H CYS 2 H CYS 2 10.281 5.670 1.968
10 HA CYS 2 HA CYS 2 8.465 4.924 -0.296
11 1HB CYS 2 2HB CYS 2 10.711 3.761 -0.365
12 2HB CYS 2 1HB CYS 2 10.323 3.044 1.199
13 H LEU 3 H LEU 3 6.658 3.614 0.367
14 HA LEU 3 HA LEU 3 5.942 3.950 3.232
15 1HB LEU 3 2HB LEU 3 4.407 3.150 0.738
16 2HB LEU 3 1HB LEU 3 3.676 3.329 2.333
17 HG LEU 3 HG LEU 3 5.304 5.581 1.179
18 1HD1 LEU 3 1HD1 LEU 3 3.443 4.703 -0.433
19 2HD1 LEU 3 2HD1 LEU 3 3.503 6.427 -0.069
20 3HD1 LEU 3 3HD1 LEU 3 2.329 5.395 0.745
21 1HD2 LEU 3 1HD2 LEU 3 3.691 6.891 2.575
22 2HD2 LEU 3 2HD2 LEU 3 4.609 5.719 3.520
23 3HD2 LEU 3 3HD2 LEU 3 2.938 5.376 3.073
24 H GLY 4 H GLY 4 5.949 2.228 4.626
25 1HA GLY 4 2HA GLY 4 6.687 -0.433 3.589
26 2HA GLY 4 1HA GLY 4 6.610 0.033 5.288
27 H PHE 5 H PHE 5 5.445 -2.127 5.386
28 HA PHE 5 HA PHE 5 2.781 -2.361 4.241
29 1HB PHE 5 2HB PHE 5 4.223 -4.279 4.795
30 2HB PHE 5 1HB PHE 5 4.196 -3.820 6.498
31 HD1 PHE 5 HD1 PHE 5 2.660 -4.902 7.874
32 HD2 PHE 5 HD2 PHE 5 1.765 -4.446 3.697
33 HE1 PHE 5 HE1 PHE 5 0.550 -6.164 8.188
34 HE2 PHE 5 HE2 PHE 5 -0.344 -5.710 4.013
35 HZ PHE 5 HZ PHE 5 -0.953 -6.568 6.257
36 H GLY 6 H GLY 6 0.794 -1.953 5.245
37 1HA GLY 6 2HA GLY 6 -0.729 -1.047 6.777
38 2HA GLY 6 1HA GLY 6 0.451 -1.392 8.041
39 H LYS 7 H LYS 7 1.147 0.649 5.243
40 HA LYS 7 HA LYS 7 1.472 2.976 7.104
41 1HB LYS 7 2HB LYS 7 3.456 1.984 5.879
42 2HB LYS 7 1HB LYS 7 2.689 2.476 4.369
43 1HG LYS 7 2HG LYS 7 4.168 4.256 4.896
44 2HG LYS 7 1HG LYS 7 2.578 4.835 5.390
45 1HD LYS 7 2HD LYS 7 3.217 4.988 7.547
46 2HD LYS 7 1HD LYS 7 3.863 3.346 7.534
47 1HE LYS 7 2HE LYS 7 6.004 4.049 6.896
48 2HE LYS 7 1HE LYS 7 5.402 5.554 6.175
49 1HZ LYS 7 1HZ LYS 7 6.413 5.989 8.328
50 2HZ LYS 7 2HZ LYS 7 5.365 4.878 9.073
51 3HZ LYS 7 3HZ LYS 7 4.747 6.304 8.386
52 H GLY 8 H GLY 8 0.030 4.632 6.821
53 1HA GLY 8 2HA GLY 8 -2.111 4.605 4.992
54 2HA GLY 8 1HA GLY 8 -1.540 6.055 5.815
55 H CYS 9 H CYS 9 -2.170 4.922 2.841
56 HA CYS 9 HA CYS 9 -0.199 6.761 1.549
57 1HB CYS 9 2HB CYS 9 0.235 5.015 -0.142
58 2HB CYS 9 1HB CYS 9 0.622 4.411 1.468
59 H ASN 10 H ASN 10 -0.996 6.466 -1.068
60 HA ASN 10 HA ASN 10 -3.879 7.258 -0.957
61 1HB ASN 10 2HB ASN 10 -3.375 8.651 -2.878
62 2HB ASN 10 1HB ASN 10 -2.133 8.933 -1.663
63 1HD2 ASN 10 1HD2 ASN 10 0.039 7.997 -2.075
64 2HD2 ASN 10 2HD2 ASN 10 0.484 7.515 -3.640
65 HA PRO 11 HA PRO 11 -4.616 3.481 -3.188
66 1HB PRO 11 2HB PRO 11 -7.286 3.901 -3.637
67 2HB PRO 11 1HB PRO 11 -6.636 3.374 -2.072
68 1HG PRO 11 2HG PRO 11 -7.481 6.090 -2.951
69 2HG PRO 11 1HG PRO 11 -7.707 5.287 -1.389
70 1HD PRO 11 2HD PRO 11 -5.791 7.168 -1.840
71 2HD PRO 11 1HD PRO 11 -5.622 5.868 -0.640
72 H SER 12 H SER 12 -5.467 6.704 -4.398
73 HA SER 12 HA SER 12 -6.237 6.094 -7.056
74 1HB SER 12 2HB SER 12 -5.352 8.428 -7.485
75 2HB SER 12 1HB SER 12 -6.438 8.312 -6.104
76 HG SER 12 HG SER 12 -3.744 8.884 -6.219
77 H ASN 13 H ASN 13 -2.990 6.524 -5.674
78 HA ASN 13 HA ASN 13 -1.834 5.119 -8.044
79 1HB ASN 13 2HB ASN 13 -1.120 7.813 -6.866
80 2HB ASN 13 1HB ASN 13 0.049 6.894 -7.813
81 1HD2 ASN 13 1HD2 ASN 13 -2.596 9.077 -8.046
82 2HD2 ASN 13 2HD2 ASN 13 -2.855 8.942 -9.718
83 H ASP 14 H ASP 14 -1.763 3.323 -6.466
84 HA ASP 14 HA ASP 14 -0.541 3.341 -3.927
85 1HB ASP 14 2HB ASP 14 -1.711 1.407 -4.619
86 2HB ASP 14 1HB ASP 14 -0.829 1.310 -6.141
87 H GLN 15 H GLN 15 1.487 3.992 -3.389
88 HA GLN 15 HA GLN 15 3.737 3.408 -5.289
89 1HB GLN 15 2HB GLN 15 2.687 5.864 -4.661
90 2HB GLN 15 1HB GLN 15 3.973 5.723 -3.463
91 1HG GLN 15 2HG GLN 15 5.652 5.580 -5.086
92 2HG GLN 15 1HG GLN 15 4.533 5.036 -6.336
93 1HE2 GLN 15 1HE2 GLN 15 5.445 7.927 -4.415
94 2HE2 GLN 15 2HE2 GLN 15 4.849 9.050 -5.539
95 H CYS 16 H CYS 16 2.931 1.658 -3.150
96 HA CYS 16 HA CYS 16 4.582 2.130 -0.785
97 1HB CYS 16 2HB CYS 16 2.596 0.239 -1.800
98 2HB CYS 16 1HB CYS 16 3.896 -0.581 -0.937
99 H CYS 17 H CYS 17 6.196 0.272 -0.173
100 HA CYS 17 HA CYS 17 8.377 0.264 -2.035
101 1HB CYS 17 2HB CYS 17 7.662 -0.896 0.592
102 2HB CYS 17 1HB CYS 17 8.898 -1.786 -0.297
103 H LYS 18 H LYS 18 8.581 -0.949 -3.855
104 HA LYS 18 HA LYS 18 6.768 -3.120 -4.522
105 1HB LYS 18 2HB LYS 18 7.893 -1.437 -6.060
106 2HB LYS 18 1HB LYS 18 9.394 -2.331 -5.820
107 1HG LYS 18 2HG LYS 18 8.773 -3.839 -7.370
108 2HG LYS 18 1HG LYS 18 7.302 -4.192 -6.463
109 1HD LYS 18 2HD LYS 18 7.223 -1.630 -7.914
110 2HD LYS 18 1HD LYS 18 7.355 -3.043 -8.961
111 1HE LYS 18 2HE LYS 18 5.372 -3.123 -6.705
112 2HE LYS 18 1HE LYS 18 4.964 -2.212 -8.171
113 1HZ LYS 18 1HZ LYS 18 5.888 -5.039 -8.070
114 2HZ LYS 18 2HZ LYS 18 5.576 -4.162 -9.493
115 3HZ LYS 18 3HZ LYS 18 4.311 -4.521 -8.419
116 H SER 19 H SER 19 9.929 -2.950 -2.998
117 HA SER 19 HA SER 19 10.957 -5.543 -3.556
118 1HB SER 19 2HB SER 19 11.159 -3.628 -1.223
119 2HB SER 19 1HB SER 19 12.061 -5.140 -1.254
120 HG SER 19 HG SER 19 13.223 -3.344 -2.138
121 H SER 20 H SER 20 8.743 -4.443 -0.975
122 HA SER 20 HA SER 20 8.452 -7.161 0.124
123 1HB SER 20 2HB SER 20 7.075 -5.998 1.761
124 2HB SER 20 1HB SER 20 8.510 -5.026 1.451
125 HG SER 20 HG SER 20 7.239 -3.511 0.769
126 H ASN 21 H ASN 21 7.065 -5.466 -2.482
127 HA ASN 21 HA ASN 21 5.190 -5.849 -3.836
128 1HB ASN 21 2HB ASN 21 5.694 -8.451 -2.408
129 2HB ASN 21 1HB ASN 21 4.286 -8.298 -3.456
130 1HD2 ASN 21 1HD2 ASN 21 6.852 -9.891 -3.858
131 2HD2 ASN 21 2HD2 ASN 21 7.452 -9.365 -5.356
132 H LEU 22 H LEU 22 3.993 -4.186 -2.629
133 HA LEU 22 HA LEU 22 1.696 -5.351 -1.102
134 1HB LEU 22 2HB LEU 22 3.571 -3.104 -0.330
135 2HB LEU 22 1HB LEU 22 1.982 -3.288 0.410
136 HG LEU 22 HG LEU 22 4.024 -5.523 0.334
137 1HD1 LEU 22 1HD1 LEU 22 4.893 -3.543 1.577
138 2HD1 LEU 22 2HD1 LEU 22 4.590 -4.923 2.633
139 3HD1 LEU 22 3HD1 LEU 22 3.450 -3.578 2.590
140 1HD2 LEU 22 1HD2 LEU 22 1.402 -5.023 1.756
141 2HD2 LEU 22 2HD2 LEU 22 2.556 -6.218 2.347
142 3HD2 LEU 22 3HD2 LEU 22 1.849 -6.394 0.741
143 H VAL 23 H VAL 23 -0.190 -3.881 -1.073
144 HA VAL 23 HA VAL 23 -0.143 -1.817 -3.251
145 HB VAL 23 HB VAL 23 -2.456 -2.661 -3.808
146 1HG1 VAL 23 1HG1 VAL 23 -0.280 -4.767 -3.969
147 2HG1 VAL 23 2HG1 VAL 23 -0.403 -3.375 -5.044
148 3HG1 VAL 23 3HG1 VAL 23 -1.669 -4.603 -5.043
149 1HG2 VAL 23 1HG2 VAL 23 -3.185 -4.800 -2.927
150 2HG2 VAL 23 2HG2 VAL 23 -2.830 -3.742 -1.562
151 3HG2 VAL 23 3HG2 VAL 23 -1.679 -4.994 -2.028
152 H CYS 24 H CYS 24 -1.815 -0.141 -2.990
153 HA CYS 24 HA CYS 24 -2.222 0.580 -0.166
154 1HB CYS 24 2HB CYS 24 -2.559 1.835 -2.873
155 2HB CYS 24 1HB CYS 24 -3.376 2.568 -1.493
156 H SER 25 H SER 25 -4.161 0.430 0.934
157 HA SER 25 HA SER 25 -6.397 -1.003 -0.365
158 1HB SER 25 2HB SER 25 -5.299 -1.305 2.007
159 2HB SER 25 1HB SER 25 -6.344 0.038 2.460
160 HG SER 25 HG SER 25 -8.046 -1.212 2.251
161 H ARG 26 H ARG 26 -8.640 -0.170 -0.100
162 HA ARG 26 HA ARG 26 -8.749 2.792 -0.479
163 1HB ARG 26 2HB ARG 26 -10.473 0.427 -1.223
164 2HB ARG 26 1HB ARG 26 -11.103 2.072 -1.319
165 1HG ARG 26 2HG ARG 26 -9.729 2.647 -3.074
166 2HG ARG 26 1HG ARG 26 -8.436 1.565 -2.555
167 1HD ARG 26 2HD ARG 26 -10.111 -0.349 -3.184
168 2HD ARG 26 1HD ARG 26 -10.917 0.913 -4.137
169 HE ARG 26 HE ARG 26 -8.012 0.832 -4.513
170 1HH1 ARG 26 2HH1 ARG 26 -9.739 1.788 -6.674
171 2HH1 ARG 26 1HH1 ARG 26 -9.823 0.435 -7.753
172 1HH2 ARG 26 1HH2 ARG 26 -8.701 -1.855 -5.392
173 2HH2 ARG 26 2HH2 ARG 26 -9.234 -1.632 -7.025
174 H LYS 27 H LYS 27 -10.097 0.154 1.489
175 HA LYS 27 HA LYS 27 -12.035 1.770 2.905
176 1HB LYS 27 2HB LYS 27 -11.958 -0.751 2.586
177 2HB LYS 27 1HB LYS 27 -10.669 -0.785 3.790
178 1HG LYS 27 2HG LYS 27 -12.086 -0.082 5.519
179 2HG LYS 27 1HG LYS 27 -13.266 0.606 4.403
180 1HD LYS 27 2HD LYS 27 -14.403 -1.328 4.822
181 2HD LYS 27 1HD LYS 27 -13.310 -1.995 3.609
182 1HE LYS 27 2HE LYS 27 -11.942 -3.022 5.214
183 2HE LYS 27 1HE LYS 27 -12.462 -1.920 6.503
184 1HZ LYS 27 1HZ LYS 27 -14.187 -3.928 5.145
185 2HZ LYS 27 2HZ LYS 27 -14.686 -2.859 6.369
186 3HZ LYS 27 3HZ LYS 27 -13.553 -4.077 6.710
187 H HIS 28 H HIS 28 -8.690 0.766 3.609
188 HA HIS 28 HA HIS 28 -8.707 2.483 6.060
189 1HB HIS 28 2HB HIS 28 -6.988 0.200 5.059
190 2HB HIS 28 1HB HIS 28 -6.565 1.148 6.484
191 HD1 HIS 28 HD1 HIS 28 -9.080 1.455 8.008
192 HD2 HIS 28 HD2 HIS 28 -8.229 -2.081 5.968
193 HE1 HIS 28 HE1 HIS 28 -10.496 -0.349 9.081
194 H ALA 29 H ALA 29 -7.679 2.549 2.801
195 HA ALA 29 HA ALA 29 -6.185 3.935 1.617
196 1HB ALA 29 1HB ALA 29 -6.339 5.701 4.066
197 2HB ALA 29 2HB ALA 29 -7.735 5.476 3.013
198 3HB ALA 29 3HB ALA 29 -6.253 6.185 2.372
199 H TRP 30 H TRP 30 -4.845 1.876 2.939
200 HA TRP 30 HA TRP 30 -2.246 3.174 3.537
201 1HB TRP 30 2HB TRP 30 -2.041 2.189 5.691
202 2HB TRP 30 1HB TRP 30 -3.678 2.826 5.646
203 HD1 TRP 30 HD1 TRP 30 -4.718 0.279 3.772
204 HE1 TRP 30 HE1 TRP 30 -5.207 -1.934 4.992
205 HE3 TRP 30 HE3 TRP 30 -2.060 1.041 8.059
206 HZ2 TRP 30 HZ2 TRP 30 -4.560 -3.213 7.467
207 HZ3 TRP 30 HZ3 TRP 30 -2.018 -0.687 9.834
208 HH2 TRP 30 HH2 TRP 30 -3.263 -2.811 9.544
209 H CYS 31 H CYS 31 -0.515 1.331 3.818
210 HA CYS 31 HA CYS 31 -0.617 -0.333 1.454
211 1HB CYS 31 2HB CYS 31 1.319 0.738 3.024
212 2HB CYS 31 1HB CYS 31 1.319 -0.916 3.633
213 H LYS 32 H LYS 32 -1.615 -2.272 1.278
214 HA LYS 32 HA LYS 32 -1.921 -3.983 3.723
215 1HB LYS 32 2HB LYS 32 -3.919 -2.588 2.571
216 2HB LYS 32 1HB LYS 32 -3.961 -4.020 1.542
217 1HG LYS 32 2HG LYS 32 -3.707 -4.693 4.378
218 2HG LYS 32 1HG LYS 32 -5.169 -3.770 4.033
219 1HD LYS 32 2HD LYS 32 -4.984 -5.622 1.933
220 2HD LYS 32 1HD LYS 32 -4.556 -6.535 3.380
221 1HE LYS 32 2HE LYS 32 -6.806 -6.709 3.721
222 2HE LYS 32 1HE LYS 32 -6.729 -5.008 4.219
223 1HZ LYS 32 1HZ LYS 32 -7.006 -4.348 1.910
224 2HZ LYS 32 2HZ LYS 32 -8.312 -5.315 2.406
225 3HZ LYS 32 3HZ LYS 32 -7.089 -5.973 1.428
226 H TYR 33 H TYR 33 -2.319 -6.334 3.080
227 HA TYR 33 HA TYR 33 -0.340 -7.198 1.128
228 1HB TYR 33 2HB TYR 33 -1.774 -8.238 3.342
229 2HB TYR 33 1HB TYR 33 -2.194 -9.257 1.966
230 HD1 TYR 33 HD1 TYR 33 -0.726 -10.953 1.291
231 HD2 TYR 33 HD2 TYR 33 0.772 -7.674 3.626
232 HE1 TYR 33 HE1 TYR 33 1.481 -12.070 1.444
233 HE2 TYR 33 HE2 TYR 33 2.981 -8.792 3.779
234 HH TYR 33 HH TYR 33 3.619 -11.642 3.513
235 H GLU 34 H GLU 34 -0.876 -8.648 -0.719
236 HA GLU 34 HA GLU 34 -3.183 -7.614 -2.247
237 1HB GLU 34 2HB GLU 34 -0.851 -9.462 -2.840
238 2HB GLU 34 1HB GLU 34 -2.066 -9.027 -4.042
239 1HG GLU 34 2HG GLU 34 -1.339 -6.842 -4.196
240 2HG GLU 34 1HG GLU 34 -0.779 -6.800 -2.525
241 H ILE 35 H ILE 35 -4.694 -8.744 -0.614
242 HA ILE 35 HA ILE 35 -5.144 -11.596 -1.448
243 HB ILE 35 HB ILE 35 -5.481 -10.216 1.237
244 1HG1 ILE 35 2HG1 ILE 35 -3.838 -12.673 0.628
245 2HG1 ILE 35 1HG1 ILE 35 -3.178 -11.062 0.344
246 1HG2 ILE 35 1HG2 ILE 35 -6.094 -12.580 1.991
247 2HG2 ILE 35 2HG2 ILE 35 -6.314 -12.967 0.285
248 3HG2 ILE 35 3HG2 ILE 35 -7.320 -11.736 1.046
249 1HD1 ILE 35 1HD1 ILE 35 -3.842 -10.504 2.739
250 2HD1 ILE 35 2HD1 ILE 35 -2.521 -11.659 2.565
251 3HD1 ILE 35 3HD1 ILE 35 -4.142 -12.227 2.963
252 1HN NH2 36 1HN NH2 36 -8.122 -8.738 -1.152
253 2HN NH2 36 2HN NH2 36 -6.382 -8.383 -1.104
Start of MODEL 8
1 1H GLU 1 1H GLU 1 13.662 7.978 1.969
2 2H GLU 1 2H GLU 1 12.475 8.447 0.846
3 3H GLU 1 3H GLU 1 12.912 6.812 0.994
4 HA GLU 1 HA GLU 1 12.030 6.782 3.279
5 1HB GLU 1 2HB GLU 1 11.650 9.659 2.478
6 2HB GLU 1 1HB GLU 1 10.573 8.943 3.676
7 1HG GLU 1 2HG GLU 1 12.149 9.278 5.245
8 2HG GLU 1 1HG GLU 1 13.200 8.152 4.388
9 H CYS 2 H CYS 2 10.520 5.256 2.696
10 HA CYS 2 HA CYS 2 8.186 6.158 1.037
11 1HB CYS 2 2HB CYS 2 8.313 4.082 -0.169
12 2HB CYS 2 1HB CYS 2 9.952 4.729 -0.125
13 H LEU 3 H LEU 3 6.361 4.390 1.283
14 HA LEU 3 HA LEU 3 5.871 4.059 4.185
15 1HB LEU 3 2HB LEU 3 4.199 3.581 1.693
16 2HB LEU 3 1HB LEU 3 3.589 3.469 3.342
17 HG LEU 3 HG LEU 3 5.016 5.977 2.555
18 1HD1 LEU 3 1HD1 LEU 3 2.410 6.598 1.973
19 2HD1 LEU 3 2HD1 LEU 3 2.534 4.968 1.310
20 3HD1 LEU 3 3HD1 LEU 3 3.637 6.229 0.761
21 1HD2 LEU 3 1HD2 LEU 3 2.590 5.324 4.262
22 2HD2 LEU 3 2HD2 LEU 3 3.280 6.935 4.067
23 3HD2 LEU 3 3HD2 LEU 3 4.216 5.664 4.853
24 H GLY 4 H GLY 4 6.382 2.149 5.172
25 1HA GLY 4 2HA GLY 4 7.182 -0.192 3.647
26 2HA GLY 4 1HA GLY 4 7.064 -0.093 5.404
27 H PHE 5 H PHE 5 6.092 -2.302 5.144
28 HA PHE 5 HA PHE 5 3.466 -2.566 3.894
29 1HB PHE 5 2HB PHE 5 4.952 -4.461 4.004
30 2HB PHE 5 1HB PHE 5 5.161 -4.270 5.744
31 HD1 PHE 5 HD1 PHE 5 2.333 -4.626 3.281
32 HD2 PHE 5 HD2 PHE 5 3.961 -5.723 7.104
33 HE1 PHE 5 HE1 PHE 5 0.383 -6.101 3.691
34 HE2 PHE 5 HE2 PHE 5 2.010 -7.199 7.509
35 HZ PHE 5 HZ PHE 5 0.222 -7.387 5.803
36 H GLY 6 H GLY 6 1.476 -2.343 4.882
37 1HA GLY 6 2HA GLY 6 -0.110 -2.130 6.621
38 2HA GLY 6 1HA GLY 6 1.185 -2.368 7.793
39 H LYS 7 H LYS 7 1.252 0.071 5.232
40 HA LYS 7 HA LYS 7 1.282 2.187 7.350
41 1HB LYS 7 2HB LYS 7 3.032 1.512 5.272
42 2HB LYS 7 1HB LYS 7 2.168 2.924 4.664
43 1HG LYS 7 2HG LYS 7 3.976 3.864 5.843
44 2HG LYS 7 1HG LYS 7 2.646 3.955 6.997
45 1HD LYS 7 2HD LYS 7 3.476 2.213 8.303
46 2HD LYS 7 1HD LYS 7 4.384 1.508 6.966
47 1HE LYS 7 2HE LYS 7 6.081 2.504 8.277
48 2HE LYS 7 1HE LYS 7 5.755 3.756 7.062
49 1HZ LYS 7 1HZ LYS 7 4.422 3.579 9.716
50 2HZ LYS 7 2HZ LYS 7 4.205 4.805 8.558
51 3HZ LYS 7 3HZ LYS 7 5.698 4.634 9.349
52 H GLY 8 H GLY 8 -0.642 3.277 7.466
53 1HA GLY 8 2HA GLY 8 -2.780 3.115 5.642
54 2HA GLY 8 1HA GLY 8 -2.568 4.434 6.792
55 H CYS 9 H CYS 9 -3.041 3.927 3.628
56 HA CYS 9 HA CYS 9 -1.727 6.487 2.865
57 1HB CYS 9 2HB CYS 9 -0.833 5.324 0.815
58 2HB CYS 9 1HB CYS 9 -0.116 4.745 2.318
59 H ASN 10 H ASN 10 -2.363 6.596 0.221
60 HA ASN 10 HA ASN 10 -5.320 6.695 0.259
61 1HB ASN 10 2HB ASN 10 -3.185 8.193 -0.828
62 2HB ASN 10 1HB ASN 10 -4.027 7.497 -2.212
63 1HD2 ASN 10 1HD2 ASN 10 -4.181 9.973 0.196
64 2HD2 ASN 10 2HD2 ASN 10 -5.750 10.517 -0.154
65 HA PRO 11 HA PRO 11 -5.503 2.819 -1.934
66 1HB PRO 11 2HB PRO 11 -8.195 2.879 -2.462
67 2HB PRO 11 1HB PRO 11 -7.520 2.438 -0.881
68 1HG PRO 11 2HG PRO 11 -8.695 5.020 -1.780
69 2HG PRO 11 1HG PRO 11 -8.851 4.189 -0.225
70 1HD PRO 11 2HD PRO 11 -7.191 6.307 -0.617
71 2HD PRO 11 1HD PRO 11 -6.872 5.027 0.574
72 H SER 12 H SER 12 -7.181 5.717 -3.238
73 HA SER 12 HA SER 12 -7.174 4.806 -5.988
74 1HB SER 12 2HB SER 12 -7.722 7.225 -6.397
75 2HB SER 12 1HB SER 12 -8.730 6.493 -5.153
76 HG SER 12 HG SER 12 -6.776 8.450 -4.970
77 H ASN 13 H ASN 13 -4.995 6.823 -4.043
78 HA ASN 13 HA ASN 13 -3.021 6.793 -6.299
79 1HB ASN 13 2HB ASN 13 -4.176 8.893 -4.755
80 2HB ASN 13 1HB ASN 13 -2.481 8.778 -4.278
81 1HD2 ASN 13 1HD2 ASN 13 -4.597 9.936 -6.734
82 2HD2 ASN 13 2HD2 ASN 13 -3.411 10.326 -7.883
83 H ASP 14 H ASP 14 -2.544 4.586 -5.303
84 HA ASP 14 HA ASP 14 -1.463 4.293 -2.669
85 1HB ASP 14 2HB ASP 14 -0.739 2.126 -3.507
86 2HB ASP 14 1HB ASP 14 -2.314 2.495 -4.205
87 H GLN 15 H GLN 15 0.562 4.684 -1.859
88 HA GLN 15 HA GLN 15 2.770 5.348 -3.778
89 1HB GLN 15 2HB GLN 15 1.941 6.837 -1.260
90 2HB GLN 15 1HB GLN 15 3.328 7.244 -2.271
91 1HG GLN 15 2HG GLN 15 1.385 7.196 -4.158
92 2HG GLN 15 1HG GLN 15 0.433 7.691 -2.759
93 1HE2 GLN 15 1HE2 GLN 15 1.587 9.209 -5.247
94 2HE2 GLN 15 2HE2 GLN 15 2.302 10.583 -4.555
95 H CYS 16 H CYS 16 2.193 2.884 -2.168
96 HA CYS 16 HA CYS 16 3.970 2.853 0.136
97 1HB CYS 16 2HB CYS 16 2.772 0.647 -1.571
98 2HB CYS 16 1HB CYS 16 3.518 0.412 0.009
99 H CYS 17 H CYS 17 5.891 1.309 0.196
100 HA CYS 17 HA CYS 17 7.851 2.015 -1.779
101 1HB CYS 17 2HB CYS 17 7.735 0.823 0.748
102 2HB CYS 17 1HB CYS 17 8.383 -0.446 -0.291
103 H LYS 18 H LYS 18 8.240 1.114 -3.758
104 HA LYS 18 HA LYS 18 6.642 -1.176 -4.678
105 1HB LYS 18 2HB LYS 18 8.638 0.751 -5.871
106 2HB LYS 18 1HB LYS 18 8.046 -0.629 -6.796
107 1HG LYS 18 2HG LYS 18 5.790 0.131 -6.687
108 2HG LYS 18 1HG LYS 18 6.172 1.315 -5.435
109 1HD LYS 18 2HD LYS 18 7.560 2.575 -7.024
110 2HD LYS 18 1HD LYS 18 7.225 1.381 -8.279
111 1HE LYS 18 2HE LYS 18 5.422 2.645 -8.838
112 2HE LYS 18 1HE LYS 18 4.689 2.127 -7.308
113 1HZ LYS 18 1HZ LYS 18 6.528 4.439 -7.653
114 2HZ LYS 18 2HZ LYS 18 5.848 3.928 -6.181
115 3HZ LYS 18 3HZ LYS 18 4.853 4.542 -7.414
116 H SER 19 H SER 19 9.435 -1.049 -2.878
117 HA SER 19 HA SER 19 11.230 -2.844 -4.205
118 1HB SER 19 2HB SER 19 12.102 -3.124 -1.862
119 2HB SER 19 1HB SER 19 11.867 -1.439 -2.318
120 HG SER 19 HG SER 19 10.542 -2.998 -0.457
121 H SER 20 H SER 20 8.507 -3.433 -1.961
122 HA SER 20 HA SER 20 8.791 -6.374 -2.489
123 1HB SER 20 2HB SER 20 7.646 -6.597 -0.299
124 2HB SER 20 1HB SER 20 9.118 -5.643 -0.160
125 HG SER 20 HG SER 20 7.953 -3.969 0.362
126 H ASN 21 H ASN 21 7.289 -4.229 -4.093
127 HA ASN 21 HA ASN 21 5.223 -4.014 -5.199
128 1HB ASN 21 2HB ASN 21 5.962 -6.720 -4.931
129 2HB ASN 21 1HB ASN 21 4.241 -6.673 -4.549
130 1HD2 ASN 21 1HD2 ASN 21 2.804 -6.491 -6.312
131 2HD2 ASN 21 2HD2 ASN 21 3.286 -6.144 -7.902
132 H LEU 22 H LEU 22 4.832 -2.636 -3.050
133 HA LEU 22 HA LEU 22 2.626 -3.813 -1.415
134 1HB LEU 22 2HB LEU 22 4.538 -1.491 -1.156
135 2HB LEU 22 1HB LEU 22 3.103 -1.588 -0.137
136 HG LEU 22 HG LEU 22 5.096 -3.854 -0.385
137 1HD1 LEU 22 1HD1 LEU 22 5.994 -3.080 1.783
138 2HD1 LEU 22 2HD1 LEU 22 4.927 -1.677 1.723
139 3HD1 LEU 22 3HD1 LEU 22 6.217 -1.856 0.533
140 1HD2 LEU 22 1HD2 LEU 22 3.067 -4.697 0.473
141 2HD2 LEU 22 2HD2 LEU 22 2.727 -3.219 1.373
142 3HD2 LEU 22 3HD2 LEU 22 3.989 -4.320 1.928
143 H VAL 23 H VAL 23 0.541 -3.059 -1.619
144 HA VAL 23 HA VAL 23 0.075 -0.648 -3.348
145 HB VAL 23 HB VAL 23 -1.951 -1.900 -4.161
146 1HG1 VAL 23 1HG1 VAL 23 -0.746 -3.265 -5.713
147 2HG1 VAL 23 2HG1 VAL 23 0.585 -3.498 -4.580
148 3HG1 VAL 23 3HG1 VAL 23 0.320 -1.917 -5.316
149 1HG2 VAL 23 1HG2 VAL 23 -2.205 -4.249 -3.670
150 2HG2 VAL 23 2HG2 VAL 23 -2.055 -3.410 -2.127
151 3HG2 VAL 23 3HG2 VAL 23 -0.677 -4.288 -2.790
152 H CYS 24 H CYS 24 -1.822 0.602 -2.774
153 HA CYS 24 HA CYS 24 -2.464 0.503 0.097
154 1HB CYS 24 2HB CYS 24 -3.115 2.328 -2.224
155 2HB CYS 24 1HB CYS 24 -3.790 2.586 -0.615
156 H SER 25 H SER 25 -4.075 -0.849 0.774
157 HA SER 25 HA SER 25 -6.102 -1.938 -1.003
158 1HB SER 25 2HB SER 25 -4.960 -2.574 1.432
159 2HB SER 25 1HB SER 25 -6.568 -2.035 1.907
160 HG SER 25 HG SER 25 -7.339 -3.806 1.094
161 H ARG 26 H ARG 26 -8.434 -1.587 -0.747
162 HA ARG 26 HA ARG 26 -9.093 1.249 -0.202
163 1HB ARG 26 2HB ARG 26 -9.786 -0.480 -2.156
164 2HB ARG 26 1HB ARG 26 -11.127 -0.763 -1.045
165 1HG ARG 26 2HG ARG 26 -10.925 1.991 -1.039
166 2HG ARG 26 1HG ARG 26 -10.543 1.586 -2.712
167 1HD ARG 26 2HD ARG 26 -12.854 0.119 -1.555
168 2HD ARG 26 1HD ARG 26 -13.095 1.858 -1.817
169 HE ARG 26 HE ARG 26 -12.092 0.032 -3.974
170 1HH1 ARG 26 1HH2 ARG 26 -11.972 3.022 -4.384
171 2HH1 ARG 26 2HH2 ARG 26 -13.446 3.319 -5.243
172 1HH2 ARG 26 2HH1 ARG 26 -14.863 0.259 -4.406
173 2HH2 ARG 26 1HH1 ARG 26 -15.087 1.752 -5.255
174 H LYS 27 H LYS 27 -9.866 -1.998 1.028
175 HA LYS 27 HA LYS 27 -11.875 -1.091 2.935
176 1HB LYS 27 2HB LYS 27 -10.262 -3.628 2.539
177 2HB LYS 27 1HB LYS 27 -11.511 -3.472 3.774
178 1HG LYS 27 2HG LYS 27 -13.230 -3.404 2.228
179 2HG LYS 27 1HG LYS 27 -12.211 -2.710 0.966
180 1HD LYS 27 2HD LYS 27 -11.569 -5.466 1.940
181 2HD LYS 27 1HD LYS 27 -12.957 -5.263 0.871
182 1HE LYS 27 2HE LYS 27 -10.539 -3.799 -0.004
183 2HE LYS 27 1HE LYS 27 -10.382 -5.566 -0.025
184 1HZ LYS 27 1HZ LYS 27 -12.655 -4.038 -1.185
185 2HZ LYS 27 2HZ LYS 27 -12.456 -5.726 -1.230
186 3HZ LYS 27 3HZ LYS 27 -11.385 -4.718 -2.080
187 H HIS 28 H HIS 28 -8.400 -1.788 3.052
188 HA HIS 28 HA HIS 28 -8.313 -1.147 5.963
189 1HB HIS 28 2HB HIS 28 -6.291 -2.259 3.989
190 2HB HIS 28 1HB HIS 28 -5.984 -2.040 5.712
191 HD1 HIS 28 HD1 HIS 28 -6.166 -4.837 4.083
192 HD2 HIS 28 HD2 HIS 28 -9.064 -3.234 6.613
193 HE1 HIS 28 HE1 HIS 28 -7.582 -6.782 4.872
194 H ALA 29 H ALA 29 -7.589 0.260 2.855
195 HA ALA 29 HA ALA 29 -6.607 2.310 2.236
196 1HB ALA 29 1HB ALA 29 -7.164 4.106 3.721
197 2HB ALA 29 2HB ALA 29 -7.139 3.042 5.128
198 3HB ALA 29 3HB ALA 29 -8.430 2.897 3.935
199 H TRP 30 H TRP 30 -4.736 0.308 3.000
200 HA TRP 30 HA TRP 30 -2.495 2.019 3.909
201 1HB TRP 30 2HB TRP 30 -1.963 0.662 5.790
202 2HB TRP 30 1HB TRP 30 -3.699 0.918 5.884
203 HD1 TRP 30 HD1 TRP 30 -4.032 -1.385 3.389
204 HE1 TRP 30 HE1 TRP 30 -4.046 -3.844 4.157
205 HE3 TRP 30 HE3 TRP 30 -1.934 -0.864 8.003
206 HZ2 TRP 30 HZ2 TRP 30 -3.272 -5.388 6.442
207 HZ3 TRP 30 HZ3 TRP 30 -1.586 -2.840 9.460
208 HH2 TRP 30 HH2 TRP 30 -2.252 -5.100 8.685
209 H CYS 31 H CYS 31 -0.376 0.553 3.858
210 HA CYS 31 HA CYS 31 -0.164 -0.529 1.171
211 1HB CYS 31 2HB CYS 31 1.703 -0.592 3.566
212 2HB CYS 31 1HB CYS 31 2.168 -1.003 1.919
213 H LYS 32 H LYS 32 -0.471 -2.621 0.534
214 HA LYS 32 HA LYS 32 -0.568 -4.759 2.637
215 1HB LYS 32 2HB LYS 32 -2.797 -4.034 1.819
216 2HB LYS 32 1HB LYS 32 -2.295 -4.386 0.165
217 1HG LYS 32 2HG LYS 32 -3.559 -6.283 0.969
218 2HG LYS 32 1HG LYS 32 -1.865 -6.764 0.886
219 1HD LYS 32 2HD LYS 32 -2.020 -7.368 3.053
220 2HD LYS 32 1HD LYS 32 -2.174 -5.656 3.448
221 1HE LYS 32 2HE LYS 32 -4.531 -5.756 3.523
222 2HE LYS 32 1HE LYS 32 -4.586 -7.264 2.590
223 1HZ LYS 32 1HZ LYS 32 -3.285 -7.021 5.249
224 2HZ LYS 32 2HZ LYS 32 -3.582 -8.447 4.374
225 3HZ LYS 32 3HZ LYS 32 -4.875 -7.568 5.035
226 H TYR 33 H TYR 33 0.204 -6.829 1.943
227 HA TYR 33 HA TYR 33 2.235 -6.747 -0.177
228 1HB TYR 33 2HB TYR 33 1.892 -8.016 2.253
229 2HB TYR 33 1HB TYR 33 1.557 -9.314 1.107
230 HD1 TYR 33 HD1 TYR 33 3.334 -10.472 0.111
231 HD2 TYR 33 HD2 TYR 33 4.027 -6.579 1.790
232 HE1 TYR 33 HE1 TYR 33 5.763 -10.719 -0.320
233 HE2 TYR 33 HE2 TYR 33 6.456 -6.826 1.359
234 HH TYR 33 HH TYR 33 7.776 -8.745 -0.678
235 H GLU 34 H GLU 34 2.241 -9.047 -1.469
236 HA GLU 34 HA GLU 34 0.036 -8.926 -3.329
237 1HB GLU 34 2HB GLU 34 2.298 -10.878 -2.814
238 2HB GLU 34 1HB GLU 34 1.194 -11.038 -4.179
239 1HG GLU 34 2HG GLU 34 2.689 -8.465 -3.654
240 2HG GLU 34 1HG GLU 34 3.405 -9.773 -4.596
241 H ILE 35 H ILE 35 -1.884 -10.049 -3.300
242 HA ILE 35 HA ILE 35 -2.409 -11.878 -1.014
243 HB ILE 35 HB ILE 35 -4.178 -10.589 -3.125
244 1HG1 ILE 35 2HG1 ILE 35 -4.846 -9.622 -0.599
245 2HG1 ILE 35 1HG1 ILE 35 -3.086 -9.708 -0.553
246 1HG2 ILE 35 1HG2 ILE 35 -4.918 -12.142 -0.623
247 2HG2 ILE 35 2HG2 ILE 35 -5.150 -12.693 -2.282
248 3HG2 ILE 35 3HG2 ILE 35 -6.054 -11.304 -1.680
249 1HD1 ILE 35 1HD1 ILE 35 -4.357 -7.576 -1.549
250 2HD1 ILE 35 2HD1 ILE 35 -4.346 -8.567 -3.008
251 3HD1 ILE 35 3HD1 ILE 35 -2.827 -8.138 -2.222
252 1HN NH2 36 1HN NH2 36 -2.898 -14.911 -2.707
253 2HN NH2 36 2HN NH2 36 -3.437 -13.931 -1.326
Start of MODEL 9
1 1H GLU 1 1H GLU 1 8.997 7.482 3.136
2 2H GLU 1 2H GLU 1 9.451 7.926 1.560
3 3H GLU 1 3H GLU 1 10.519 8.178 2.857
4 HA GLU 1 HA GLU 1 11.214 6.242 1.575
5 1HB GLU 1 2HB GLU 1 10.260 6.217 4.395
6 2HB GLU 1 1HB GLU 1 10.717 4.654 3.717
7 1HG GLU 1 2HG GLU 1 12.933 5.306 3.355
8 2HG GLU 1 1HG GLU 1 12.531 7.023 3.346
9 H CYS 2 H CYS 2 10.641 3.760 1.483
10 HA CYS 2 HA CYS 2 8.269 3.404 -0.082
11 1HB CYS 2 2HB CYS 2 10.418 2.051 -0.061
12 2HB CYS 2 1HB CYS 2 9.846 1.301 1.430
13 H LEU 3 H LEU 3 6.305 2.295 0.443
14 HA LEU 3 HA LEU 3 5.531 2.503 3.311
15 1HB LEU 3 2HB LEU 3 3.977 2.174 0.724
16 2HB LEU 3 1HB LEU 3 3.231 2.320 2.315
17 HG LEU 3 HG LEU 3 5.184 4.390 1.306
18 1HD1 LEU 3 1HD1 LEU 3 3.137 5.712 0.650
19 2HD1 LEU 3 2HD1 LEU 3 2.192 4.235 0.843
20 3HD1 LEU 3 3HD1 LEU 3 3.457 4.318 -0.383
21 1HD2 LEU 3 1HD2 LEU 3 3.931 3.960 3.753
22 2HD2 LEU 3 2HD2 LEU 3 2.919 5.186 2.989
23 3HD2 LEU 3 3HD2 LEU 3 4.643 5.482 3.217
24 H GLY 4 H GLY 4 5.700 0.639 4.477
25 1HA GLY 4 2HA GLY 4 5.895 -1.973 3.211
26 2HA GLY 4 1HA GLY 4 5.854 -1.666 4.947
27 H PHE 5 H PHE 5 4.378 -3.603 4.909
28 HA PHE 5 HA PHE 5 1.735 -3.368 3.703
29 1HB PHE 5 2HB PHE 5 2.761 -5.530 4.068
30 2HB PHE 5 1HB PHE 5 2.990 -5.188 5.781
31 HD1 PHE 5 HD1 PHE 5 0.054 -4.771 3.465
32 HD2 PHE 5 HD2 PHE 5 1.601 -6.558 7.054
33 HE1 PHE 5 HE1 PHE 5 -2.185 -5.709 3.967
34 HE2 PHE 5 HE2 PHE 5 -0.639 -7.495 7.552
35 HZ PHE 5 HZ PHE 5 -2.532 -7.070 6.008
36 H GLY 6 H GLY 6 -0.025 -2.351 4.565
37 1HA GLY 6 2HA GLY 6 -1.502 -1.508 6.203
38 2HA GLY 6 1HA GLY 6 -0.406 -2.094 7.452
39 H LYS 7 H LYS 7 0.160 0.172 4.747
40 HA LYS 7 HA LYS 7 1.047 2.212 6.766
41 1HB LYS 7 2HB LYS 7 2.206 1.064 4.321
42 2HB LYS 7 1HB LYS 7 2.231 2.826 4.331
43 1HG LYS 7 2HG LYS 7 3.160 1.207 6.707
44 2HG LYS 7 1HG LYS 7 4.251 1.643 5.391
45 1HD LYS 7 2HD LYS 7 3.531 4.056 5.746
46 2HD LYS 7 1HD LYS 7 2.735 3.515 7.223
47 1HE LYS 7 2HE LYS 7 5.062 2.436 7.785
48 2HE LYS 7 1HE LYS 7 5.679 3.595 6.590
49 1HZ LYS 7 1HZ LYS 7 4.499 5.364 7.762
50 2HZ LYS 7 2HZ LYS 7 5.619 4.599 8.786
51 3HZ LYS 7 3HZ LYS 7 3.961 4.254 8.928
52 H GLY 8 H GLY 8 -0.422 3.870 6.848
53 1HA GLY 8 2HA GLY 8 -2.546 4.321 5.051
54 2HA GLY 8 1HA GLY 8 -1.906 5.546 6.144
55 H CYS 9 H CYS 9 -2.502 4.956 2.972
56 HA CYS 9 HA CYS 9 -0.638 7.090 2.084
57 1HB CYS 9 2HB CYS 9 0.118 5.615 0.204
58 2HB CYS 9 1HB CYS 9 0.587 4.988 1.783
59 H ASN 10 H ASN 10 -1.133 7.108 -0.585
60 HA ASN 10 HA ASN 10 -4.122 7.306 -0.774
61 1HB ASN 10 2HB ASN 10 -3.568 9.088 -2.498
62 2HB ASN 10 1HB ASN 10 -3.071 9.477 -0.854
63 1HD2 ASN 10 1HD2 ASN 10 -0.843 9.873 -0.498
64 2HD2 ASN 10 2HD2 ASN 10 0.354 9.656 -1.682
65 HA PRO 11 HA PRO 11 -3.910 4.287 -3.970
66 1HB PRO 11 2HB PRO 11 -6.219 4.887 -5.317
67 2HB PRO 11 1HB PRO 11 -6.194 4.061 -3.746
68 1HG PRO 11 2HG PRO 11 -6.720 6.926 -4.368
69 2HG PRO 11 1HG PRO 11 -7.507 5.864 -3.190
70 1HD PRO 11 2HD PRO 11 -5.627 7.704 -2.505
71 2HD PRO 11 1HD PRO 11 -5.880 6.191 -1.608
72 H SER 12 H SER 12 -4.562 7.668 -4.947
73 HA SER 12 HA SER 12 -4.058 7.434 -7.733
74 1HB SER 12 2HB SER 12 -4.998 9.395 -6.473
75 2HB SER 12 1HB SER 12 -3.376 9.734 -5.876
76 HG SER 12 HG SER 12 -4.023 10.893 -7.822
77 H ASN 13 H ASN 13 -1.762 8.480 -5.195
78 HA ASN 13 HA ASN 13 0.491 7.666 -7.001
79 1HB ASN 13 2HB ASN 13 0.029 9.834 -4.973
80 2HB ASN 13 1HB ASN 13 1.679 9.275 -5.249
81 1HD2 ASN 13 1HD2 ASN 13 2.748 10.347 -6.917
82 2HD2 ASN 13 2HD2 ASN 13 1.987 11.134 -8.214
83 H ASP 14 H ASP 14 -0.511 5.509 -5.782
84 HA ASP 14 HA ASP 14 0.276 4.985 -3.081
85 1HB ASP 14 2HB ASP 14 -0.139 2.648 -3.724
86 2HB ASP 14 1HB ASP 14 -1.369 3.692 -4.431
87 H GLN 15 H GLN 15 2.238 4.389 -2.214
88 HA GLN 15 HA GLN 15 4.497 3.818 -4.111
89 1HB GLN 15 2HB GLN 15 4.214 6.112 -2.785
90 2HB GLN 15 1HB GLN 15 4.906 5.169 -1.465
91 1HG GLN 15 2HG GLN 15 6.730 4.469 -3.130
92 2HG GLN 15 1HG GLN 15 6.124 5.760 -4.168
93 1HE2 GLN 15 1HE2 GLN 15 7.981 5.077 -1.275
94 2HE2 GLN 15 2HE2 GLN 15 8.370 6.688 -0.909
95 H CYS 16 H CYS 16 2.978 1.723 -2.991
96 HA CYS 16 HA CYS 16 4.102 0.757 -0.490
97 1HB CYS 16 2HB CYS 16 2.367 -0.296 -2.709
98 2HB CYS 16 1HB CYS 16 2.976 -1.407 -1.482
99 H CYS 17 H CYS 17 5.570 -1.052 -0.253
100 HA CYS 17 HA CYS 17 7.812 -1.057 -2.073
101 1HB CYS 17 2HB CYS 17 6.945 -2.363 0.439
102 2HB CYS 17 1HB CYS 17 8.117 -3.279 -0.507
103 H LYS 18 H LYS 18 8.205 -2.341 -3.831
104 HA LYS 18 HA LYS 18 6.135 -4.138 -4.840
105 1HB LYS 18 2HB LYS 18 7.608 -4.279 -6.764
106 2HB LYS 18 1HB LYS 18 7.604 -2.610 -6.199
107 1HG LYS 18 2HG LYS 18 9.702 -3.116 -4.901
108 2HG LYS 18 1HG LYS 18 9.733 -4.704 -5.668
109 1HD LYS 18 2HD LYS 18 10.209 -3.833 -7.773
110 2HD LYS 18 1HD LYS 18 9.500 -2.264 -7.397
111 1HE LYS 18 2HE LYS 18 11.768 -1.726 -7.285
112 2HE LYS 18 1HE LYS 18 11.488 -2.205 -5.600
113 1HZ LYS 18 1HZ LYS 18 13.383 -3.392 -6.554
114 2HZ LYS 18 2HZ LYS 18 12.390 -4.019 -7.780
115 3HZ LYS 18 3HZ LYS 18 12.129 -4.464 -6.161
116 H SER 19 H SER 19 8.916 -4.566 -2.806
117 HA SER 19 HA SER 19 9.752 -7.203 -3.474
118 1HB SER 19 2HB SER 19 10.782 -5.505 -1.883
119 2HB SER 19 1HB SER 19 9.553 -5.971 -0.710
120 HG SER 19 HG SER 19 11.231 -7.293 -0.287
121 H SER 20 H SER 20 7.183 -6.094 -1.240
122 HA SER 20 HA SER 20 6.297 -8.913 -0.837
123 1HB SER 20 2HB SER 20 4.816 -7.702 0.879
124 2HB SER 20 1HB SER 20 6.551 -7.653 1.170
125 HG SER 20 HG SER 20 6.177 -5.571 1.237
126 H ASN 21 H ASN 21 5.703 -6.579 -3.104
127 HA ASN 21 HA ASN 21 3.933 -6.138 -4.585
128 1HB ASN 21 2HB ASN 21 4.194 -8.861 -4.143
129 2HB ASN 21 1HB ASN 21 2.472 -8.590 -3.876
130 1HD2 ASN 21 1HD2 ASN 21 5.082 -8.166 -6.288
131 2HD2 ASN 21 2HD2 ASN 21 4.042 -8.038 -7.624
132 H LEU 22 H LEU 22 3.321 -4.449 -2.857
133 HA LEU 22 HA LEU 22 0.607 -5.080 -1.725
134 1HB LEU 22 2HB LEU 22 2.779 -3.217 -0.700
135 2HB LEU 22 1HB LEU 22 1.218 -3.490 0.071
136 HG LEU 22 HG LEU 22 3.283 -5.654 -0.432
137 1HD1 LEU 22 1HD1 LEU 22 3.599 -5.549 2.040
138 2HD1 LEU 22 2HD1 LEU 22 2.553 -4.130 2.086
139 3HD1 LEU 22 3HD1 LEU 22 4.095 -4.061 1.234
140 1HD2 LEU 22 1HD2 LEU 22 0.676 -5.598 1.122
141 2HD2 LEU 22 2HD2 LEU 22 1.826 -6.934 1.148
142 3HD2 LEU 22 3HD2 LEU 22 0.996 -6.515 -0.350
143 H VAL 23 H VAL 23 -0.888 -3.221 -1.691
144 HA VAL 23 HA VAL 23 -0.147 -0.938 -3.475
145 HB VAL 23 HB VAL 23 -2.279 -1.278 -4.713
146 1HG1 VAL 23 1HG1 VAL 23 -0.085 -2.327 -5.439
147 2HG1 VAL 23 2HG1 VAL 23 -1.535 -3.116 -6.060
148 3HG1 VAL 23 3HG1 VAL 23 -0.652 -3.830 -4.711
149 1HG2 VAL 23 1HG2 VAL 23 -3.657 -2.405 -3.120
150 2HG2 VAL 23 2HG2 VAL 23 -2.469 -3.686 -2.890
151 3HG2 VAL 23 3HG2 VAL 23 -3.365 -3.577 -4.405
152 H CYS 24 H CYS 24 -1.534 0.938 -3.167
153 HA CYS 24 HA CYS 24 -2.498 1.252 -0.427
154 1HB CYS 24 2HB CYS 24 -2.372 2.949 -2.924
155 2HB CYS 24 1HB CYS 24 -3.147 3.542 -1.456
156 H SER 25 H SER 25 -4.585 0.956 0.266
157 HA SER 25 HA SER 25 -6.655 0.113 -1.664
158 1HB SER 25 2HB SER 25 -6.149 -0.984 0.555
159 2HB SER 25 1HB SER 25 -6.760 0.464 1.349
160 HG SER 25 HG SER 25 -8.541 -0.722 1.194
161 H ARG 26 H ARG 26 -8.859 1.100 -1.543
162 HA ARG 26 HA ARG 26 -8.683 4.064 -1.305
163 1HB ARG 26 2HB ARG 26 -10.618 4.051 -2.750
164 2HB ARG 26 1HB ARG 26 -9.485 2.862 -3.388
165 1HG ARG 26 2HG ARG 26 -10.743 1.045 -2.349
166 2HG ARG 26 1HG ARG 26 -11.826 2.200 -1.574
167 1HD ARG 26 2HD ARG 26 -11.494 2.101 -4.585
168 2HD ARG 26 1HD ARG 26 -12.715 1.136 -3.732
169 HE ARG 26 HE ARG 26 -13.367 3.447 -2.680
170 1HH1 ARG 26 1HH2 ARG 26 -11.297 4.664 -4.686
171 2HH1 ARG 26 2HH2 ARG 26 -12.380 5.308 -5.873
172 1HH2 ARG 26 2HH1 ARG 26 -15.131 3.529 -4.711
173 2HH2 ARG 26 1HH1 ARG 26 -14.557 4.664 -5.888
174 H LYS 27 H LYS 27 -10.391 1.277 0.073
175 HA LYS 27 HA LYS 27 -12.285 2.904 1.606
176 1HB LYS 27 2HB LYS 27 -12.126 0.301 0.719
177 2HB LYS 27 1HB LYS 27 -11.736 0.121 2.430
178 1HG LYS 27 2HG LYS 27 -14.007 1.927 1.868
179 2HG LYS 27 1HG LYS 27 -14.285 0.239 1.440
180 1HD LYS 27 2HD LYS 27 -12.985 0.219 3.958
181 2HD LYS 27 1HD LYS 27 -14.246 1.448 4.056
182 1HE LYS 27 2HE LYS 27 -15.700 -0.443 2.854
183 2HE LYS 27 1HE LYS 27 -14.514 -1.505 3.636
184 1HZ LYS 27 1HZ LYS 27 -16.347 -1.029 5.139
185 2HZ LYS 27 2HZ LYS 27 -16.079 0.640 4.978
186 3HZ LYS 27 3HZ LYS 27 -14.912 -0.343 5.727
187 H HIS 28 H HIS 28 -9.331 1.043 2.316
188 HA HIS 28 HA HIS 28 -9.286 2.027 5.114
189 1HB HIS 28 2HB HIS 28 -7.671 0.082 3.449
190 2HB HIS 28 1HB HIS 28 -7.193 0.524 5.088
191 HD1 HIS 28 HD1 HIS 28 -8.786 -0.196 7.039
192 HD2 HIS 28 HD2 HIS 28 -9.937 -1.607 3.289
193 HE1 HIS 28 HE1 HIS 28 -10.537 -1.979 7.451
194 H ALA 29 H ALA 29 -7.938 2.853 2.022
195 HA ALA 29 HA ALA 29 -6.375 4.481 1.362
196 1HB ALA 29 1HB ALA 29 -6.615 5.608 4.142
197 2HB ALA 29 2HB ALA 29 -8.013 5.620 3.067
198 3HB ALA 29 3HB ALA 29 -6.537 6.464 2.602
199 H TRP 30 H TRP 30 -5.259 2.039 2.414
200 HA TRP 30 HA TRP 30 -2.620 3.074 3.247
201 1HB TRP 30 2HB TRP 30 -2.550 1.912 5.309
202 2HB TRP 30 1HB TRP 30 -4.150 2.637 5.274
203 HD1 TRP 30 HD1 TRP 30 -5.239 0.299 3.153
204 HE1 TRP 30 HE1 TRP 30 -5.884 -1.970 4.183
205 HE3 TRP 30 HE3 TRP 30 -2.720 0.597 7.580
206 HZ2 TRP 30 HZ2 TRP 30 -5.394 -3.467 6.570
207 HZ3 TRP 30 HZ3 TRP 30 -2.826 -1.263 9.213
208 HH2 TRP 30 HH2 TRP 30 -4.159 -3.293 8.715
209 H CYS 31 H CYS 31 -0.985 1.205 3.315
210 HA CYS 31 HA CYS 31 -1.100 -0.282 0.854
211 1HB CYS 31 2HB CYS 31 0.862 0.571 2.405
212 2HB CYS 31 1HB CYS 31 0.675 -1.006 3.171
213 H LYS 32 H LYS 32 -1.681 -2.434 0.483
214 HA LYS 32 HA LYS 32 -2.431 -4.131 2.823
215 1HB LYS 32 2HB LYS 32 -4.200 -2.684 1.120
216 2HB LYS 32 1HB LYS 32 -4.378 -4.393 0.721
217 1HG LYS 32 2HG LYS 32 -4.316 -3.534 3.601
218 2HG LYS 32 1HG LYS 32 -5.806 -3.377 2.672
219 1HD LYS 32 2HD LYS 32 -5.518 -5.818 2.015
220 2HD LYS 32 1HD LYS 32 -4.236 -5.904 3.225
221 1HE LYS 32 2HE LYS 32 -5.794 -5.280 4.997
222 2HE LYS 32 1HE LYS 32 -7.090 -5.036 3.811
223 1HZ LYS 32 1HZ LYS 32 -6.870 -7.338 3.127
224 2HZ LYS 32 2HZ LYS 32 -7.189 -7.259 4.794
225 3HZ LYS 32 3HZ LYS 32 -5.615 -7.584 4.243
226 H TYR 33 H TYR 33 -2.647 -6.421 2.231
227 HA TYR 33 HA TYR 33 -0.746 -7.225 0.125
228 1HB TYR 33 2HB TYR 33 -1.840 -8.226 2.619
229 2HB TYR 33 1HB TYR 33 -1.959 -9.458 1.363
230 HD1 TYR 33 HD1 TYR 33 0.193 -9.766 -0.136
231 HD2 TYR 33 HD2 TYR 33 0.178 -7.968 3.766
232 HE1 TYR 33 HE1 TYR 33 2.619 -10.223 0.084
233 HE2 TYR 33 HE2 TYR 33 2.604 -8.425 3.985
234 HH TYR 33 HH TYR 33 4.224 -10.474 2.570
235 H GLU 34 H GLU 34 -1.349 -8.909 -1.462
236 HA GLU 34 HA GLU 34 -4.157 -8.558 -2.427
237 1HB GLU 34 2HB GLU 34 -1.456 -9.010 -3.608
238 2HB GLU 34 1HB GLU 34 -2.815 -9.747 -4.457
239 1HG GLU 34 2HG GLU 34 -2.458 -7.520 -5.363
240 2HG GLU 34 1HG GLU 34 -3.964 -7.519 -4.447
241 H ILE 35 H ILE 35 -4.787 -10.163 -0.675
242 HA ILE 35 HA ILE 35 -5.454 -12.314 -0.008
243 HB ILE 35 HB ILE 35 -4.939 -12.842 -2.956
244 1HG1 ILE 35 2HG1 ILE 35 -7.689 -12.486 -2.434
245 2HG1 ILE 35 1HG1 ILE 35 -6.876 -11.178 -1.577
246 1HG2 ILE 35 1HG2 ILE 35 -6.995 -14.421 -2.411
247 2HG2 ILE 35 2HG2 ILE 35 -6.349 -14.336 -0.772
248 3HG2 ILE 35 3HG2 ILE 35 -5.348 -14.959 -2.083
249 1HD1 ILE 35 1HD1 ILE 35 -6.305 -10.134 -3.502
250 2HD1 ILE 35 2HD1 ILE 35 -7.480 -11.194 -4.281
251 3HD1 ILE 35 3HD1 ILE 35 -5.774 -11.639 -4.254
252 1HN NH2 36 1HN NH2 36 -2.505 -13.893 0.982
253 2HN NH2 36 2HN NH2 36 -4.154 -13.335 1.340
Start of MODEL 10
1 1H GLU 1 1H GLU 1 13.125 3.808 -0.820
2 2H GLU 1 2H GLU 1 14.052 4.527 0.409
3 3H GLU 1 3H GLU 1 12.583 5.232 -0.074
4 HA GLU 1 HA GLU 1 12.889 2.598 1.286
5 1HB GLU 1 2HB GLU 1 13.368 4.545 2.696
6 2HB GLU 1 1HB GLU 1 11.888 5.333 2.152
7 1HG GLU 1 2HG GLU 1 11.510 4.318 4.344
8 2HG GLU 1 1HG GLU 1 10.566 3.458 3.129
9 H CYS 2 H CYS 2 11.149 1.278 0.950
10 HA CYS 2 HA CYS 2 8.731 2.401 -0.400
11 1HB CYS 2 2HB CYS 2 8.418 0.166 -1.198
12 2HB CYS 2 1HB CYS 2 10.152 0.464 -1.307
13 H LEU 3 H LEU 3 6.605 1.424 0.324
14 HA LEU 3 HA LEU 3 6.486 1.348 3.299
15 1HB LEU 3 2HB LEU 3 4.402 1.612 1.106
16 2HB LEU 3 1HB LEU 3 4.038 1.666 2.828
17 HG LEU 3 HG LEU 3 6.121 3.506 1.676
18 1HD1 LEU 3 1HD1 LEU 3 3.171 4.172 1.839
19 2HD1 LEU 3 2HD1 LEU 3 3.958 3.667 0.344
20 3HD1 LEU 3 3HD1 LEU 3 4.461 5.155 1.145
21 1HD2 LEU 3 1HD2 LEU 3 4.265 3.483 4.067
22 2HD2 LEU 3 2HD2 LEU 3 5.127 4.938 3.566
23 3HD2 LEU 3 3HD2 LEU 3 6.029 3.505 4.060
24 H GLY 4 H GLY 4 6.543 -0.669 4.209
25 1HA GLY 4 2HA GLY 4 6.094 -3.092 2.701
26 2HA GLY 4 1HA GLY 4 6.312 -2.996 4.447
27 H PHE 5 H PHE 5 4.496 -4.793 3.719
28 HA PHE 5 HA PHE 5 1.817 -3.966 3.213
29 1HB PHE 5 2HB PHE 5 2.645 -6.271 3.045
30 2HB PHE 5 1HB PHE 5 2.960 -6.307 4.778
31 HD1 PHE 5 HD1 PHE 5 0.267 -6.044 2.219
32 HD2 PHE 5 HD2 PHE 5 1.219 -6.751 6.348
33 HE1 PHE 5 HE1 PHE 5 -2.065 -6.776 2.633
34 HE2 PHE 5 HE2 PHE 5 -1.114 -7.483 6.760
35 HZ PHE 5 HZ PHE 5 -2.756 -7.496 4.901
36 H GLY 6 H GLY 6 0.496 -2.735 4.484
37 1HA GLY 6 2HA GLY 6 -0.707 -2.411 6.582
38 2HA GLY 6 1HA GLY 6 0.720 -2.976 7.448
39 H LYS 7 H LYS 7 2.501 -1.271 5.687
40 HA LYS 7 HA LYS 7 2.618 1.064 7.348
41 1HB LYS 7 2HB LYS 7 4.322 -0.187 5.725
42 2HB LYS 7 1HB LYS 7 3.741 1.010 4.568
43 1HG LYS 7 2HG LYS 7 5.609 2.045 5.597
44 2HG LYS 7 1HG LYS 7 4.212 2.756 6.405
45 1HD LYS 7 2HD LYS 7 5.070 0.285 7.700
46 2HD LYS 7 1HD LYS 7 6.361 1.486 7.654
47 1HE LYS 7 2HE LYS 7 5.163 3.024 8.944
48 2HE LYS 7 1HE LYS 7 3.593 2.338 8.483
49 1HZ LYS 7 1HZ LYS 7 4.142 0.327 9.699
50 2HZ LYS 7 2HZ LYS 7 4.224 1.671 10.734
51 3HZ LYS 7 3HZ LYS 7 5.651 0.968 10.138
52 H GLY 8 H GLY 8 1.681 3.086 7.094
53 1HA GLY 8 2HA GLY 8 -0.659 3.466 5.580
54 2HA GLY 8 1HA GLY 8 0.320 4.785 6.215
55 H CYS 9 H CYS 9 -1.104 4.430 3.587
56 HA CYS 9 HA CYS 9 1.135 5.315 1.847
57 1HB CYS 9 2HB CYS 9 1.208 3.055 1.280
58 2HB CYS 9 1HB CYS 9 -0.503 2.811 1.617
59 H ASN 10 H ASN 10 0.321 6.464 -0.073
60 HA ASN 10 HA ASN 10 -2.303 7.754 0.404
61 1HB ASN 10 2HB ASN 10 0.036 8.779 -0.268
62 2HB ASN 10 1HB ASN 10 -0.448 8.315 -1.899
63 1HD2 ASN 10 1HD2 ASN 10 -0.991 10.623 0.667
64 2HD2 ASN 10 2HD2 ASN 10 -2.190 11.524 -0.127
65 HA PRO 11 HA PRO 11 -4.242 4.993 -2.511
66 1HB PRO 11 2HB PRO 11 -6.605 6.371 -2.761
67 2HB PRO 11 1HB PRO 11 -6.219 5.345 -1.365
68 1HG PRO 11 2HG PRO 11 -6.039 8.309 -1.639
69 2HG PRO 11 1HG PRO 11 -6.611 7.335 -0.274
70 1HD PRO 11 2HD PRO 11 -4.152 8.462 -0.328
71 2HD PRO 11 1HD PRO 11 -4.483 6.924 0.500
72 H SER 12 H SER 12 -4.339 8.541 -3.044
73 HA SER 12 HA SER 12 -4.781 8.377 -5.901
74 1HB SER 12 2HB SER 12 -5.237 10.340 -4.395
75 2HB SER 12 1HB SER 12 -3.498 10.566 -4.231
76 HG SER 12 HG SER 12 -5.190 11.111 -6.349
77 H ASN 13 H ASN 13 -1.896 8.612 -3.847
78 HA ASN 13 HA ASN 13 -0.193 8.047 -6.255
79 1HB ASN 13 2HB ASN 13 0.294 9.756 -3.791
80 2HB ASN 13 1HB ASN 13 1.545 9.368 -4.972
81 1HD2 ASN 13 1HD2 ASN 13 1.188 10.171 -7.236
82 2HD2 ASN 13 2HD2 ASN 13 0.199 11.525 -7.495
83 H ASP 14 H ASP 14 -0.754 5.745 -5.514
84 HA ASP 14 HA ASP 14 0.064 4.662 -3.011
85 1HB ASP 14 2HB ASP 14 -0.135 2.524 -4.174
86 2HB ASP 14 1HB ASP 14 -1.413 3.602 -4.731
87 H GLN 15 H GLN 15 2.031 4.019 -2.223
88 HA GLN 15 HA GLN 15 4.369 3.876 -4.071
89 1HB GLN 15 2HB GLN 15 3.863 6.122 -2.732
90 2HB GLN 15 1HB GLN 15 4.620 5.233 -1.409
91 1HG GLN 15 2HG GLN 15 6.663 5.032 -2.542
92 2HG GLN 15 1HG GLN 15 5.927 5.333 -4.116
93 1HE2 GLN 15 1HE2 GLN 15 6.956 6.934 -1.094
94 2HE2 GLN 15 2HE2 GLN 15 6.971 8.503 -1.740
95 H CYS 16 H CYS 16 2.868 1.727 -2.790
96 HA CYS 16 HA CYS 16 4.258 0.833 -0.392
97 1HB CYS 16 2HB CYS 16 2.429 -0.465 -2.431
98 2HB CYS 16 1HB CYS 16 3.014 -1.309 -0.999
99 H CYS 17 H CYS 17 5.438 -1.362 -0.444
100 HA CYS 17 HA CYS 17 7.710 -1.214 -2.212
101 1HB CYS 17 2HB CYS 17 7.031 -2.437 0.173
102 2HB CYS 17 1HB CYS 17 7.142 -3.805 -0.935
103 H LYS 18 H LYS 18 7.695 -1.780 -4.334
104 HA LYS 18 HA LYS 18 5.565 -3.336 -5.553
105 1HB LYS 18 2HB LYS 18 8.208 -2.162 -6.421
106 2HB LYS 18 1HB LYS 18 7.238 -3.134 -7.529
107 1HG LYS 18 2HG LYS 18 5.345 -1.622 -7.273
108 2HG LYS 18 1HG LYS 18 6.213 -0.692 -6.050
109 1HD LYS 18 2HD LYS 18 7.966 -0.171 -7.755
110 2HD LYS 18 1HD LYS 18 6.984 -0.994 -8.967
111 1HE LYS 18 2HE LYS 18 5.146 0.596 -8.607
112 2HE LYS 18 1HE LYS 18 6.077 1.404 -7.331
113 1HZ LYS 18 1HZ LYS 18 6.377 2.511 -9.472
114 2HZ LYS 18 2HZ LYS 18 6.953 1.066 -10.154
115 3HZ LYS 18 3HZ LYS 18 7.836 1.842 -8.926
116 H SER 19 H SER 19 8.675 -4.137 -4.153
117 HA SER 19 HA SER 19 9.295 -6.550 -5.536
118 1HB SER 19 2HB SER 19 10.592 -7.022 -3.453
119 2HB SER 19 1HB SER 19 10.818 -5.371 -4.020
120 HG SER 19 HG SER 19 10.242 -5.878 -1.667
121 H SER 20 H SER 20 7.144 -5.949 -2.751
122 HA SER 20 HA SER 20 6.389 -8.838 -2.696
123 1HB SER 20 2HB SER 20 7.098 -7.373 -0.673
124 2HB SER 20 1HB SER 20 5.500 -6.648 -0.815
125 HG SER 20 HG SER 20 4.641 -8.424 -0.066
126 H ASN 21 H ASN 21 5.452 -6.495 -4.632
127 HA ASN 21 HA ASN 21 3.445 -5.821 -5.668
128 1HB ASN 21 2HB ASN 21 3.390 -8.682 -5.000
129 2HB ASN 21 1HB ASN 21 1.783 -8.001 -5.249
130 1HD2 ASN 21 1HD2 ASN 21 1.356 -6.949 -7.373
131 2HD2 ASN 21 2HD2 ASN 21 2.303 -7.352 -8.723
132 H LEU 22 H LEU 22 3.302 -4.276 -3.673
133 HA LEU 22 HA LEU 22 0.932 -4.963 -1.970
134 1HB LEU 22 2HB LEU 22 3.273 -3.062 -1.652
135 2HB LEU 22 1HB LEU 22 1.912 -3.114 -0.531
136 HG LEU 22 HG LEU 22 3.519 -5.581 -1.222
137 1HD1 LEU 22 1HD1 LEU 22 4.122 -4.602 1.397
138 2HD1 LEU 22 2HD1 LEU 22 4.400 -3.294 0.248
139 3HD1 LEU 22 3HD1 LEU 22 5.225 -4.838 0.042
140 1HD2 LEU 22 1HD2 LEU 22 1.635 -4.807 1.027
141 2HD2 LEU 22 2HD2 LEU 22 2.590 -6.290 1.015
142 3HD2 LEU 22 3HD2 LEU 22 1.357 -6.025 -0.218
143 H VAL 23 H VAL 23 -0.916 -3.772 -2.243
144 HA VAL 23 HA VAL 23 -0.825 -1.405 -4.080
145 HB VAL 23 HB VAL 23 -3.211 -3.034 -3.153
146 1HG1 VAL 23 1HG1 VAL 23 -2.689 -1.051 -5.365
147 2HG1 VAL 23 2HG1 VAL 23 -3.962 -1.027 -4.145
148 3HG1 VAL 23 3HG1 VAL 23 -4.026 -2.198 -5.462
149 1HG2 VAL 23 1HG2 VAL 23 -2.928 -4.119 -5.481
150 2HG2 VAL 23 2HG2 VAL 23 -1.827 -4.653 -4.212
151 3HG2 VAL 23 3HG2 VAL 23 -1.275 -3.503 -5.430
152 H CYS 24 H CYS 24 -2.380 0.398 -3.456
153 HA CYS 24 HA CYS 24 -2.143 0.959 -0.558
154 1HB CYS 24 2HB CYS 24 -1.692 2.468 -2.707
155 2HB CYS 24 1HB CYS 24 -3.416 2.807 -2.541
156 H SER 25 H SER 25 -3.999 1.579 0.725
157 HA SER 25 HA SER 25 -6.600 0.476 -0.294
158 1HB SER 25 2HB SER 25 -5.457 0.714 2.508
159 2HB SER 25 1HB SER 25 -7.037 0.042 2.120
160 HG SER 25 HG SER 25 -5.925 -1.743 1.949
161 H ARG 26 H ARG 26 -8.525 1.666 0.260
162 HA ARG 26 HA ARG 26 -8.061 4.581 0.661
163 1HB ARG 26 2HB ARG 26 -10.117 2.797 -0.557
164 2HB ARG 26 1HB ARG 26 -10.696 4.321 0.118
165 1HG ARG 26 2HG ARG 26 -8.271 4.324 -1.656
166 2HG ARG 26 1HG ARG 26 -9.876 4.235 -2.381
167 1HD ARG 26 2HD ARG 26 -10.004 6.255 -0.378
168 2HD ARG 26 1HD ARG 26 -8.536 6.553 -1.329
169 HE ARG 26 HE ARG 26 -11.226 6.147 -2.590
170 1HH1 ARG 26 2HH1 ARG 26 -8.864 6.026 -4.405
171 2HH1 ARG 26 1HH1 ARG 26 -8.721 7.666 -4.942
172 1HH2 ARG 26 1HH2 ARG 26 -10.722 8.949 -2.406
173 2HH2 ARG 26 2HH2 ARG 26 -9.776 9.327 -3.807
174 H LYS 27 H LYS 27 -9.872 1.847 2.066
175 HA LYS 27 HA LYS 27 -11.140 3.425 4.155
176 1HB LYS 27 2HB LYS 27 -11.530 0.993 2.995
177 2HB LYS 27 1HB LYS 27 -10.725 0.504 4.485
178 1HG LYS 27 2HG LYS 27 -12.560 0.948 5.718
179 2HG LYS 27 1HG LYS 27 -12.734 2.547 4.994
180 1HD LYS 27 2HD LYS 27 -14.197 1.812 3.381
181 2HD LYS 27 1HD LYS 27 -13.448 0.218 3.281
182 1HE LYS 27 2HE LYS 27 -14.435 -0.317 5.541
183 2HE LYS 27 1HE LYS 27 -15.322 1.217 5.453
184 1HZ LYS 27 1HZ LYS 27 -16.253 0.519 3.332
185 2HZ LYS 27 2HZ LYS 27 -16.642 -0.604 4.545
186 3HZ LYS 27 3HZ LYS 27 -15.417 -0.955 3.422
187 H HIS 28 H HIS 28 -8.244 1.370 3.963
188 HA HIS 28 HA HIS 28 -7.593 1.939 6.812
189 1HB HIS 28 2HB HIS 28 -6.514 0.081 4.679
190 2HB HIS 28 1HB HIS 28 -5.757 0.246 6.262
191 HD1 HIS 28 HD1 HIS 28 -8.087 0.309 8.157
192 HD2 HIS 28 HD2 HIS 28 -8.005 -2.236 4.855
193 HE1 HIS 28 HE1 HIS 28 -9.708 -1.571 8.660
194 H ALA 29 H ALA 29 -6.705 2.968 3.599
195 HA ALA 29 HA ALA 29 -5.079 4.490 2.829
196 1HB ALA 29 1HB ALA 29 -4.801 6.345 4.260
197 2HB ALA 29 2HB ALA 29 -4.817 5.342 5.711
198 3HB ALA 29 3HB ALA 29 -6.313 5.634 4.825
199 H TRP 30 H TRP 30 -4.047 1.944 3.268
200 HA TRP 30 HA TRP 30 -1.243 2.561 4.006
201 1HB TRP 30 2HB TRP 30 -1.132 0.816 5.658
202 2HB TRP 30 1HB TRP 30 -2.511 1.830 6.055
203 HD1 TRP 30 HD1 TRP 30 -3.869 0.055 3.316
204 HE1 TRP 30 HE1 TRP 30 -5.088 -2.105 4.019
205 HE3 TRP 30 HE3 TRP 30 -2.001 -0.489 8.012
206 HZ2 TRP 30 HZ2 TRP 30 -5.246 -3.838 6.294
207 HZ3 TRP 30 HZ3 TRP 30 -2.696 -2.399 9.438
208 HH2 TRP 30 HH2 TRP 30 -4.316 -4.072 8.584
209 H CYS 31 H CYS 31 -0.141 0.057 3.850
210 HA CYS 31 HA CYS 31 -0.530 -0.608 0.993
211 1HB CYS 31 2HB CYS 31 1.447 -1.355 3.158
212 2HB CYS 31 1HB CYS 31 1.498 -2.086 1.555
213 H LYS 32 H LYS 32 -1.336 -2.582 0.262
214 HA LYS 32 HA LYS 32 -2.078 -4.658 2.282
215 1HB LYS 32 2HB LYS 32 -4.332 -4.756 1.217
216 2HB LYS 32 1HB LYS 32 -4.009 -3.179 1.934
217 1HG LYS 32 2HG LYS 32 -3.735 -2.139 -0.137
218 2HG LYS 32 1HG LYS 32 -3.321 -3.646 -0.953
219 1HD LYS 32 2HD LYS 32 -5.989 -3.775 0.197
220 2HD LYS 32 1HD LYS 32 -5.837 -2.413 -0.911
221 1HE LYS 32 2HE LYS 32 -4.517 -4.659 -2.108
222 2HE LYS 32 1HE LYS 32 -6.131 -5.175 -1.583
223 1HZ LYS 32 1HZ LYS 32 -7.077 -3.224 -2.635
224 2HZ LYS 32 2HZ LYS 32 -6.200 -4.125 -3.777
225 3HZ LYS 32 3HZ LYS 32 -5.539 -2.702 -3.126
226 H TYR 33 H TYR 33 -3.119 -6.599 0.843
227 HA TYR 33 HA TYR 33 -1.140 -7.120 -1.348
228 1HB TYR 33 2HB TYR 33 -1.965 -8.525 0.986
229 2HB TYR 33 1HB TYR 33 -2.543 -9.452 -0.399
230 HD1 TYR 33 HD1 TYR 33 -0.993 -10.434 -2.001
231 HD2 TYR 33 HD2 TYR 33 0.435 -8.099 1.310
232 HE1 TYR 33 HE1 TYR 33 1.309 -11.257 -2.412
233 HE2 TYR 33 HE2 TYR 33 2.736 -8.923 0.898
234 HH TYR 33 HH TYR 33 3.594 -11.377 -0.464
235 H GLU 34 H GLU 34 -2.012 -8.568 -3.121
236 HA GLU 34 HA GLU 34 -4.651 -7.569 -4.017
237 1HB GLU 34 2HB GLU 34 -3.929 -8.552 -6.165
238 2HB GLU 34 1HB GLU 34 -2.650 -7.550 -5.483
239 1HG GLU 34 2HG GLU 34 -2.411 -10.262 -4.497
240 2HG GLU 34 1HG GLU 34 -2.460 -10.261 -6.259
241 H ILE 35 H ILE 35 -5.169 -9.183 -1.895
242 HA ILE 35 HA ILE 35 -6.573 -11.464 -3.139
243 HB ILE 35 HB ILE 35 -4.260 -12.248 -2.639
244 1HG1 ILE 35 2HG1 ILE 35 -5.854 -13.647 -0.564
245 2HG1 ILE 35 1HG1 ILE 35 -6.601 -13.546 -2.158
246 1HG2 ILE 35 1HG2 ILE 35 -4.941 -11.885 0.283
247 2HG2 ILE 35 2HG2 ILE 35 -4.055 -10.659 -0.623
248 3HG2 ILE 35 3HG2 ILE 35 -3.378 -12.276 -0.435
249 1HD1 ILE 35 1HD1 ILE 35 -5.005 -15.556 -1.621
250 2HD1 ILE 35 2HD1 ILE 35 -3.723 -14.380 -1.913
251 3HD1 ILE 35 3HD1 ILE 35 -4.884 -14.754 -3.187
252 1HN NH2 36 1HN NH2 36 -8.702 -11.529 -0.149
253 2HN NH2 36 2HN NH2 36 -7.814 -12.742 -1.096
Start of MODEL 11
1 1H GLU 1 1H GLU 1 11.226 8.769 -0.765
2 2H GLU 1 2H GLU 1 11.079 9.940 0.456
3 3H GLU 1 3H GLU 1 9.704 9.416 -0.394
4 HA GLU 1 HA GLU 1 11.361 7.643 1.330
5 1HB GLU 1 2HB GLU 1 9.720 8.046 3.048
6 2HB GLU 1 1HB GLU 1 10.232 9.624 2.457
7 1HG GLU 1 2HG GLU 1 8.000 10.023 2.246
8 2HG GLU 1 1HG GLU 1 8.143 9.075 0.767
9 H CYS 2 H CYS 2 9.978 5.704 1.942
10 HA CYS 2 HA CYS 2 7.974 4.993 -0.168
11 1HB CYS 2 2HB CYS 2 10.413 4.182 -0.514
12 2HB CYS 2 1HB CYS 2 10.101 3.099 0.843
13 H LEU 3 H LEU 3 6.405 3.441 0.536
14 HA LEU 3 HA LEU 3 6.148 3.239 3.503
15 1HB LEU 3 2HB LEU 3 4.191 2.777 1.227
16 2HB LEU 3 1HB LEU 3 3.780 2.772 2.940
17 HG LEU 3 HG LEU 3 5.254 5.174 2.093
18 1HD1 LEU 3 1HD1 LEU 3 4.053 5.680 0.261
19 2HD1 LEU 3 2HD1 LEU 3 2.606 5.719 1.266
20 3HD1 LEU 3 3HD1 LEU 3 3.073 4.227 0.452
21 1HD2 LEU 3 1HD2 LEU 3 2.977 6.050 3.227
22 2HD2 LEU 3 2HD2 LEU 3 4.320 5.430 4.187
23 3HD2 LEU 3 3HD2 LEU 3 2.945 4.388 3.818
24 H GLY 4 H GLY 4 6.517 1.289 4.479
25 1HA GLY 4 2HA GLY 4 7.170 -1.064 2.868
26 2HA GLY 4 1HA GLY 4 7.208 -0.968 4.629
27 H PHE 5 H PHE 5 6.095 -3.036 4.723
28 HA PHE 5 HA PHE 5 3.400 -3.284 3.580
29 1HB PHE 5 2HB PHE 5 4.991 -5.173 3.781
30 2HB PHE 5 1HB PHE 5 4.973 -4.994 5.535
31 HD1 PHE 5 HD1 PHE 5 3.453 -6.253 6.783
32 HD2 PHE 5 HD2 PHE 5 2.601 -5.422 2.653
33 HE1 PHE 5 HE1 PHE 5 1.426 -7.676 6.914
34 HE2 PHE 5 HE2 PHE 5 0.575 -6.846 2.786
35 HZ PHE 5 HZ PHE 5 -0.012 -7.972 4.916
36 H GLY 6 H GLY 6 1.479 -2.993 4.680
37 1HA GLY 6 2HA GLY 6 -0.003 -2.531 6.441
38 2HA GLY 6 1HA GLY 6 1.294 -2.902 7.574
39 H LYS 7 H LYS 7 1.936 -0.532 5.104
40 HA LYS 7 HA LYS 7 2.168 1.561 7.188
41 1HB LYS 7 2HB LYS 7 3.755 0.839 5.143
42 2HB LYS 7 1HB LYS 7 2.756 2.016 4.291
43 1HG LYS 7 2HG LYS 7 4.480 3.358 5.128
44 2HG LYS 7 1HG LYS 7 3.238 3.539 6.367
45 1HD LYS 7 2HD LYS 7 4.430 1.418 7.414
46 2HD LYS 7 1HD LYS 7 5.801 1.987 6.462
47 1HE LYS 7 2HE LYS 7 5.493 4.266 7.522
48 2HE LYS 7 1HE LYS 7 4.300 3.525 8.606
49 1HZ LYS 7 1HZ LYS 7 6.515 3.455 9.585
50 2HZ LYS 7 2HZ LYS 7 7.107 2.610 8.235
51 3HZ LYS 7 3HZ LYS 7 5.958 1.887 9.258
52 H GLY 8 H GLY 8 0.375 2.799 7.571
53 1HA GLY 8 2HA GLY 8 -1.895 2.897 5.798
54 2HA GLY 8 1HA GLY 8 -1.662 3.915 7.217
55 H CYS 9 H CYS 9 -1.470 3.767 3.785
56 HA CYS 9 HA CYS 9 -0.258 6.510 3.691
57 1HB CYS 9 2HB CYS 9 0.838 5.836 1.766
58 2HB CYS 9 1HB CYS 9 0.692 4.272 2.561
59 H ASN 10 H ASN 10 -1.083 7.253 1.144
60 HA ASN 10 HA ASN 10 -3.964 7.758 1.584
61 1HB ASN 10 2HB ASN 10 -1.859 8.757 -0.356
62 2HB ASN 10 1HB ASN 10 -3.542 9.282 -0.419
63 1HD2 ASN 10 1HD2 ASN 10 -0.512 9.698 1.263
64 2HD2 ASN 10 2HD2 ASN 10 -1.070 10.826 2.402
65 HA PRO 11 HA PRO 11 -5.126 4.527 -1.232
66 1HB PRO 11 2HB PRO 11 -7.729 5.299 -1.616
67 2HB PRO 11 1HB PRO 11 -7.165 4.481 -0.145
68 1HG PRO 11 2HG PRO 11 -7.677 7.378 -0.621
69 2HG PRO 11 1HG PRO 11 -8.038 6.387 0.801
70 1HD PRO 11 2HD PRO 11 -5.911 8.066 0.679
71 2HD PRO 11 1HD PRO 11 -5.908 6.568 1.638
72 H SER 12 H SER 12 -5.971 7.924 -1.974
73 HA SER 12 HA SER 12 -6.281 7.494 -4.833
74 1HB SER 12 2HB SER 12 -7.258 9.338 -3.363
75 2HB SER 12 1HB SER 12 -5.649 10.054 -3.338
76 HG SER 12 HG SER 12 -5.931 10.709 -5.321
77 H ASN 13 H ASN 13 -3.627 8.512 -2.711
78 HA ASN 13 HA ASN 13 -1.775 8.433 -5.071
79 1HB ASN 13 2HB ASN 13 -2.329 10.653 -3.821
80 2HB ASN 13 1HB ASN 13 -1.327 9.999 -2.526
81 1HD2 ASN 13 1HD2 ASN 13 0.986 9.632 -3.001
82 2HD2 ASN 13 2HD2 ASN 13 1.726 10.390 -4.327
83 H ASP 14 H ASP 14 -1.785 6.032 -4.381
84 HA ASP 14 HA ASP 14 -0.492 5.304 -1.867
85 1HB ASP 14 2HB ASP 14 -2.044 3.771 -2.841
86 2HB ASP 14 1HB ASP 14 -1.271 3.879 -4.422
87 H GLN 15 H GLN 15 1.676 5.449 -1.516
88 HA GLN 15 HA GLN 15 3.526 5.301 -3.877
89 1HB GLN 15 2HB GLN 15 3.123 7.473 -2.421
90 2HB GLN 15 1HB GLN 15 4.196 6.663 -1.280
91 1HG GLN 15 2HG GLN 15 6.019 6.764 -2.707
92 2HG GLN 15 1HG GLN 15 5.016 6.782 -4.157
93 1HE2 GLN 15 1HE2 GLN 15 6.147 8.834 -1.450
94 2HE2 GLN 15 2HE2 GLN 15 5.834 10.309 -2.231
95 H CYS 16 H CYS 16 2.638 2.956 -2.464
96 HA CYS 16 HA CYS 16 4.487 2.160 -0.388
97 1HB CYS 16 2HB CYS 16 2.395 0.948 -2.128
98 2HB CYS 16 1HB CYS 16 3.567 -0.166 -1.424
99 H CYS 17 H CYS 17 6.157 0.465 -0.639
100 HA CYS 17 HA CYS 17 8.015 1.011 -2.765
101 1HB CYS 17 2HB CYS 17 7.735 -0.817 -0.437
102 2HB CYS 17 1HB CYS 17 8.866 -1.332 -1.689
103 H LYS 18 H LYS 18 8.132 0.139 -4.787
104 HA LYS 18 HA LYS 18 6.152 -1.832 -5.675
105 1HB LYS 18 2HB LYS 18 8.249 -0.057 -6.834
106 2HB LYS 18 1HB LYS 18 7.778 -1.463 -7.790
107 1HG LYS 18 2HG LYS 18 5.335 -0.689 -7.251
108 2HG LYS 18 1HG LYS 18 6.092 0.865 -6.902
109 1HD LYS 18 2HD LYS 18 6.992 -0.401 -9.413
110 2HD LYS 18 1HD LYS 18 5.293 0.071 -9.397
111 1HE LYS 18 2HE LYS 18 5.869 2.365 -8.832
112 2HE LYS 18 1HE LYS 18 7.577 1.926 -8.634
113 1HZ LYS 18 1HZ LYS 18 7.640 1.206 -10.932
114 2HZ LYS 18 2HZ LYS 18 7.136 2.826 -10.853
115 3HZ LYS 18 3HZ LYS 18 6.001 1.594 -11.135
116 H SER 19 H SER 19 9.293 -2.067 -4.300
117 HA SER 19 HA SER 19 10.446 -4.251 -5.721
118 1HB SER 19 2HB SER 19 10.557 -3.312 -2.844
119 2HB SER 19 1HB SER 19 11.576 -4.615 -3.452
120 HG SER 19 HG SER 19 11.697 -1.895 -3.886
121 H SER 20 H SER 20 8.168 -4.223 -2.958
122 HA SER 20 HA SER 20 7.928 -7.190 -3.114
123 1HB SER 20 2HB SER 20 7.089 -5.043 -1.157
124 2HB SER 20 1HB SER 20 6.549 -6.712 -0.997
125 HG SER 20 HG SER 20 8.479 -7.254 -0.351
126 H ASN 21 H ASN 21 6.517 -4.660 -4.703
127 HA ASN 21 HA ASN 21 4.466 -4.351 -5.807
128 1HB ASN 21 2HB ASN 21 5.318 -6.930 -6.098
129 2HB ASN 21 1HB ASN 21 3.722 -7.195 -5.400
130 1HD2 ASN 21 1HD2 ASN 21 3.838 -8.090 -7.929
131 2HD2 ASN 21 2HD2 ASN 21 3.132 -7.012 -9.034
132 H LEU 22 H LEU 22 4.033 -3.295 -3.493
133 HA LEU 22 HA LEU 22 1.618 -4.631 -2.305
134 1HB LEU 22 2HB LEU 22 3.701 -2.815 -1.040
135 2HB LEU 22 1HB LEU 22 2.316 -3.511 -0.201
136 HG LEU 22 HG LEU 22 4.424 -5.181 -1.597
137 1HD1 LEU 22 1HD1 LEU 22 5.307 -5.621 0.674
138 2HD1 LEU 22 2HD1 LEU 22 4.169 -4.446 1.335
139 3HD1 LEU 22 3HD1 LEU 22 5.450 -3.917 0.244
140 1HD2 LEU 22 1HD2 LEU 22 2.151 -5.775 0.317
141 2HD2 LEU 22 2HD2 LEU 22 3.432 -6.934 -0.040
142 3HD2 LEU 22 3HD2 LEU 22 2.359 -6.382 -1.326
143 H VAL 23 H VAL 23 -0.210 -3.338 -2.022
144 HA VAL 23 HA VAL 23 -0.020 -0.475 -2.917
145 HB VAL 23 HB VAL 23 -2.319 -2.400 -3.382
146 1HG1 VAL 23 1HG1 VAL 23 -1.626 0.376 -4.334
147 2HG1 VAL 23 2HG1 VAL 23 -3.109 -0.180 -3.559
148 3HG1 VAL 23 3HG1 VAL 23 -2.757 -0.644 -5.223
149 1HG2 VAL 23 1HG2 VAL 23 -1.474 -2.483 -5.747
150 2HG2 VAL 23 2HG2 VAL 23 -0.383 -3.254 -4.595
151 3HG2 VAL 23 3HG2 VAL 23 -0.019 -1.642 -5.212
152 H CYS 24 H CYS 24 -1.839 0.861 -2.002
153 HA CYS 24 HA CYS 24 -2.276 0.188 0.835
154 1HB CYS 24 2HB CYS 24 -2.329 2.536 -0.938
155 2HB CYS 24 1HB CYS 24 -3.596 2.555 0.287
156 H SER 25 H SER 25 -4.128 -0.737 1.591
157 HA SER 25 HA SER 25 -6.284 -1.523 -0.176
158 1HB SER 25 2HB SER 25 -5.361 -2.613 1.977
159 2HB SER 25 1HB SER 25 -6.330 -1.429 2.848
160 HG SER 25 HG SER 25 -7.905 -2.780 2.533
161 H ARG 26 H ARG 26 -8.564 -0.867 0.110
162 HA ARG 26 HA ARG 26 -8.817 2.052 0.562
163 1HB ARG 26 2HB ARG 26 -9.885 0.121 -1.189
164 2HB ARG 26 1HB ARG 26 -11.236 0.618 -0.170
165 1HG ARG 26 2HG ARG 26 -10.182 3.043 -0.671
166 2HG ARG 26 1HG ARG 26 -9.658 2.209 -2.134
167 1HD ARG 26 2HD ARG 26 -12.511 1.885 -1.242
168 2HD ARG 26 1HD ARG 26 -12.032 3.372 -2.083
169 HE ARG 26 HE ARG 26 -11.437 2.053 -4.017
170 1HH1 ARG 26 1HH2 ARG 26 -14.069 0.752 -3.082
171 2HH1 ARG 26 2HH2 ARG 26 -13.665 -0.926 -3.227
172 1HH2 ARG 26 2HH1 ARG 26 -10.245 -0.356 -3.456
173 2HH2 ARG 26 1HH1 ARG 26 -11.495 -1.555 -3.439
174 H LYS 27 H LYS 27 -9.368 -0.850 2.332
175 HA LYS 27 HA LYS 27 -11.613 0.202 3.928
176 1HB LYS 27 2HB LYS 27 -10.399 -2.313 3.291
177 2HB LYS 27 1HB LYS 27 -10.391 -2.129 5.044
178 1HG LYS 27 2HG LYS 27 -12.913 -1.216 4.325
179 2HG LYS 27 1HG LYS 27 -12.647 -2.574 3.232
180 1HD LYS 27 2HD LYS 27 -13.551 -3.633 5.113
181 2HD LYS 27 1HD LYS 27 -11.818 -3.812 5.385
182 1HE LYS 27 2HE LYS 27 -12.036 -1.525 6.659
183 2HE LYS 27 1HE LYS 27 -13.756 -1.950 6.747
184 1HZ LYS 27 1HZ LYS 27 -12.538 -2.876 8.627
185 2HZ LYS 27 2HZ LYS 27 -11.496 -3.701 7.569
186 3HZ LYS 27 3HZ LYS 27 -13.143 -4.114 7.638
187 H HIS 28 H HIS 28 -8.226 -0.763 4.561
188 HA HIS 28 HA HIS 28 -8.299 0.822 7.102
189 1HB HIS 28 2HB HIS 28 -6.807 -1.564 6.057
190 2HB HIS 28 1HB HIS 28 -6.074 -0.598 7.337
191 HD1 HIS 28 HD1 HIS 28 -6.619 -1.518 9.579
192 HD2 HIS 28 HD2 HIS 28 -9.779 -2.051 6.912
193 HE1 HIS 28 HE1 HIS 28 -8.465 -2.671 10.875
194 H ALA 29 H ALA 29 -7.175 1.062 3.898
195 HA ALA 29 HA ALA 29 -5.747 2.608 2.847
196 1HB ALA 29 1HB ALA 29 -6.912 3.924 4.854
197 2HB ALA 29 2HB ALA 29 -5.633 4.669 3.895
198 3HB ALA 29 3HB ALA 29 -5.259 3.964 5.468
199 H TRP 30 H TRP 30 -4.699 0.281 4.860
200 HA TRP 30 HA TRP 30 -1.908 1.223 5.173
201 1HB TRP 30 2HB TRP 30 -1.683 -0.628 6.638
202 2HB TRP 30 1HB TRP 30 -3.331 -0.077 6.897
203 HD1 TRP 30 HD1 TRP 30 -4.557 -1.441 4.225
204 HE1 TRP 30 HE1 TRP 30 -4.917 -3.992 4.210
205 HE3 TRP 30 HE3 TRP 30 -1.362 -2.800 7.966
206 HZ2 TRP 30 HZ2 TRP 30 -3.976 -6.305 5.606
207 HZ3 TRP 30 HZ3 TRP 30 -1.115 -5.180 8.604
208 HH2 TRP 30 HH2 TRP 30 -2.417 -6.934 7.431
209 H CYS 31 H CYS 31 -0.122 -0.205 4.368
210 HA CYS 31 HA CYS 31 -0.532 -0.895 1.567
211 1HB CYS 31 2HB CYS 31 1.528 0.068 2.912
212 2HB CYS 31 1HB CYS 31 1.900 -1.637 3.167
213 H LYS 32 H LYS 32 -1.426 -2.804 0.950
214 HA LYS 32 HA LYS 32 -0.910 -5.255 2.608
215 1HB LYS 32 2HB LYS 32 -3.285 -4.022 2.058
216 2HB LYS 32 1HB LYS 32 -3.188 -5.148 0.705
217 1HG LYS 32 2HG LYS 32 -2.646 -6.956 2.440
218 2HG LYS 32 1HG LYS 32 -3.151 -5.787 3.659
219 1HD LYS 32 2HD LYS 32 -5.238 -6.603 3.315
220 2HD LYS 32 1HD LYS 32 -5.212 -5.644 1.836
221 1HE LYS 32 2HE LYS 32 -4.256 -7.612 0.615
222 2HE LYS 32 1HE LYS 32 -4.433 -8.571 2.097
223 1HZ LYS 32 1HZ LYS 32 -6.766 -8.144 2.130
224 2HZ LYS 32 2HZ LYS 32 -6.380 -8.710 0.575
225 3HZ LYS 32 3HZ LYS 32 -6.655 -7.054 0.834
226 H TYR 33 H TYR 33 -1.268 -7.296 1.066
227 HA TYR 33 HA TYR 33 0.780 -7.232 -0.968
228 1HB TYR 33 2HB TYR 33 -0.471 -9.119 0.553
229 2HB TYR 33 1HB TYR 33 -1.265 -9.381 -1.000
230 HD1 TYR 33 HD1 TYR 33 1.934 -9.478 0.821
231 HD2 TYR 33 HD2 TYR 33 0.004 -10.105 -2.967
232 HE1 TYR 33 HE1 TYR 33 3.941 -10.678 -0.003
233 HE2 TYR 33 HE2 TYR 33 2.012 -11.306 -3.790
234 HH TYR 33 HH TYR 33 4.131 -12.665 -2.178
235 H GLU 34 H GLU 34 0.497 -7.488 -3.276
236 HA GLU 34 HA GLU 34 -1.553 -5.878 -4.476
237 1HB GLU 34 2HB GLU 34 0.752 -7.522 -5.244
238 2HB GLU 34 1HB GLU 34 -0.528 -7.546 -6.457
239 1HG GLU 34 2HG GLU 34 -0.011 -4.872 -5.352
240 2HG GLU 34 1HG GLU 34 1.368 -5.561 -6.207
241 H ILE 35 H ILE 35 -3.684 -6.445 -4.683
242 HA ILE 35 HA ILE 35 -4.453 -9.318 -4.674
243 HB ILE 35 HB ILE 35 -6.046 -6.732 -4.539
244 1HG1 ILE 35 2HG1 ILE 35 -6.218 -8.282 -2.160
245 2HG1 ILE 35 1HG1 ILE 35 -4.509 -8.194 -2.586
246 1HG2 ILE 35 1HG2 ILE 35 -7.843 -8.329 -3.670
247 2HG2 ILE 35 2HG2 ILE 35 -6.846 -9.642 -4.298
248 3HG2 ILE 35 3HG2 ILE 35 -7.500 -8.428 -5.398
249 1HD1 ILE 35 1HD1 ILE 35 -4.514 -5.817 -2.561
250 2HD1 ILE 35 2HD1 ILE 35 -5.434 -6.286 -1.132
251 3HD1 ILE 35 3HD1 ILE 35 -6.276 -5.743 -2.583
252 1HN NH2 36 1HN NH2 36 -5.643 -9.684 -7.941
253 2HN NH2 36 2HN NH2 36 -5.852 -10.207 -6.256
Start of MODEL 12
1 1H GLU 1 1H GLU 1 11.593 7.602 2.796
2 2H GLU 1 2H GLU 1 12.111 7.201 1.228
3 3H GLU 1 3H GLU 1 13.226 7.244 2.508
4 HA GLU 1 HA GLU 1 12.688 4.950 1.992
5 1HB GLU 1 2HB GLU 1 13.137 5.812 4.313
6 2HB GLU 1 1HB GLU 1 11.395 5.946 4.552
7 1HG GLU 1 2HG GLU 1 11.296 3.767 5.101
8 2HG GLU 1 1HG GLU 1 11.947 3.333 3.520
9 H CYS 2 H CYS 2 11.132 3.468 1.346
10 HA CYS 2 HA CYS 2 8.505 4.409 0.544
11 1HB CYS 2 2HB CYS 2 8.238 1.997 -0.081
12 2HB CYS 2 1HB CYS 2 9.745 2.688 -0.677
13 H LEU 3 H LEU 3 6.512 3.004 1.229
14 HA LEU 3 HA LEU 3 6.420 2.979 4.212
15 1HB LEU 3 2HB LEU 3 4.338 3.065 2.007
16 2HB LEU 3 1HB LEU 3 3.927 2.969 3.719
17 HG LEU 3 HG LEU 3 5.692 5.139 2.553
18 1HD1 LEU 3 1HD1 LEU 3 3.658 6.587 2.808
19 2HD1 LEU 3 2HD1 LEU 3 2.713 5.133 3.130
20 3HD1 LEU 3 3HD1 LEU 3 3.482 5.354 1.559
21 1HD2 LEU 3 1HD2 LEU 3 4.376 4.631 5.228
22 2HD2 LEU 3 2HD2 LEU 3 4.877 6.251 4.744
23 3HD2 LEU 3 3HD2 LEU 3 6.074 4.964 4.890
24 H GLY 4 H GLY 4 6.337 1.048 5.279
25 1HA GLY 4 2HA GLY 4 6.419 -1.464 3.841
26 2HA GLY 4 1HA GLY 4 6.351 -1.282 5.593
27 H PHE 5 H PHE 5 4.830 -3.158 5.403
28 HA PHE 5 HA PHE 5 2.224 -2.786 4.156
29 1HB PHE 5 2HB PHE 5 3.173 -4.990 4.386
30 2HB PHE 5 1HB PHE 5 3.416 -4.769 6.117
31 HD1 PHE 5 HD1 PHE 5 0.494 -4.171 3.820
32 HD2 PHE 5 HD2 PHE 5 1.987 -6.146 7.332
33 HE1 PHE 5 HE1 PHE 5 -1.765 -5.089 4.266
34 HE2 PHE 5 HE2 PHE 5 -0.273 -7.063 7.775
35 HZ PHE 5 HZ PHE 5 -2.149 -6.535 6.243
36 H GLY 6 H GLY 6 0.412 -1.896 5.061
37 1HA GLY 6 2HA GLY 6 -1.093 -1.172 6.726
38 2HA GLY 6 1HA GLY 6 0.024 -1.756 7.956
39 H LYS 7 H LYS 7 0.705 0.556 5.335
40 HA LYS 7 HA LYS 7 1.263 2.636 7.428
41 1HB LYS 7 2HB LYS 7 2.777 1.562 5.102
42 2HB LYS 7 1HB LYS 7 2.873 3.305 5.348
43 1HG LYS 7 2HG LYS 7 3.246 1.481 7.702
44 2HG LYS 7 1HG LYS 7 4.581 1.705 6.571
45 1HD LYS 7 2HD LYS 7 4.999 3.799 7.316
46 2HD LYS 7 1HD LYS 7 3.290 4.231 7.299
47 1HE LYS 7 2HE LYS 7 4.034 2.313 9.428
48 2HE LYS 7 1HE LYS 7 4.748 3.929 9.597
49 1HZ LYS 7 1HZ LYS 7 1.873 3.316 9.143
50 2HZ LYS 7 2HZ LYS 7 2.536 4.879 9.184
51 3HZ LYS 7 3HZ LYS 7 2.553 3.909 10.578
52 H GLY 8 H GLY 8 -0.032 4.417 7.198
53 1HA GLY 8 2HA GLY 8 -2.017 4.767 5.253
54 2HA GLY 8 1HA GLY 8 -1.339 6.093 6.195
55 H CYS 9 H CYS 9 -1.979 5.325 3.147
56 HA CYS 9 HA CYS 9 0.182 7.037 2.055
57 1HB CYS 9 2HB CYS 9 1.316 5.135 1.492
58 2HB CYS 9 1HB CYS 9 -0.085 4.113 1.790
59 H ASN 10 H ASN 10 -0.375 7.739 -0.194
60 HA ASN 10 HA ASN 10 -3.314 7.963 -0.538
61 1HB ASN 10 2HB ASN 10 -2.660 9.715 -2.185
62 2HB ASN 10 1HB ASN 10 -1.924 9.985 -0.609
63 1HD2 ASN 10 1HD2 ASN 10 0.396 9.842 -0.453
64 2HD2 ASN 10 2HD2 ASN 10 1.391 9.600 -1.807
65 HA PRO 11 HA PRO 11 -3.311 4.781 -3.613
66 1HB PRO 11 2HB PRO 11 -5.755 5.331 -4.725
67 2HB PRO 11 1HB PRO 11 -5.556 4.519 -3.159
68 1HG PRO 11 2HG PRO 11 -6.178 7.375 -3.744
69 2HG PRO 11 1HG PRO 11 -6.842 6.310 -2.495
70 1HD PRO 11 2HD PRO 11 -4.938 8.167 -1.977
71 2HD PRO 11 1HD PRO 11 -5.064 6.639 -1.078
72 H SER 12 H SER 12 -3.973 8.165 -4.493
73 HA SER 12 HA SER 12 -3.863 7.974 -7.323
74 1HB SER 12 2HB SER 12 -4.485 9.949 -5.886
75 2HB SER 12 1HB SER 12 -2.773 10.177 -5.545
76 HG SER 12 HG SER 12 -4.217 10.557 -7.912
77 H ASN 13 H ASN 13 -1.236 8.243 -4.944
78 HA ASN 13 HA ASN 13 0.714 7.525 -7.105
79 1HB ASN 13 2HB ASN 13 0.461 9.969 -5.764
80 2HB ASN 13 1HB ASN 13 1.786 9.162 -4.927
81 1HD2 ASN 13 1HD2 ASN 13 3.810 9.193 -5.962
82 2HD2 ASN 13 2HD2 ASN 13 4.053 9.664 -7.574
83 H ASP 14 H ASP 14 0.244 5.310 -6.161
84 HA ASP 14 HA ASP 14 0.876 4.629 -3.442
85 1HB ASP 14 2HB ASP 14 -0.466 3.151 -4.745
86 2HB ASP 14 1HB ASP 14 0.707 3.123 -6.061
87 H GLN 15 H GLN 15 2.867 4.786 -2.527
88 HA GLN 15 HA GLN 15 5.269 4.073 -4.176
89 1HB GLN 15 2HB GLN 15 4.688 6.581 -3.547
90 2HB GLN 15 1HB GLN 15 5.352 6.122 -1.978
91 1HG GLN 15 2HG GLN 15 7.473 5.608 -2.897
92 2HG GLN 15 1HG GLN 15 6.838 5.544 -4.541
93 1HE2 GLN 15 1HE2 GLN 15 6.927 7.471 -5.755
94 2HE2 GLN 15 2HE2 GLN 15 7.326 8.988 -5.107
95 H CYS 16 H CYS 16 3.980 2.150 -2.646
96 HA CYS 16 HA CYS 16 5.046 1.995 0.072
97 1HB CYS 16 2HB CYS 16 3.343 0.424 -1.789
98 2HB CYS 16 1HB CYS 16 4.176 -0.506 -0.545
99 H CYS 17 H CYS 17 6.232 -0.215 0.607
100 HA CYS 17 HA CYS 17 8.774 -0.206 -0.833
101 1HB CYS 17 2HB CYS 17 7.628 -1.976 1.354
102 2HB CYS 17 1HB CYS 17 9.320 -1.950 0.863
103 H LYS 18 H LYS 18 9.553 -1.813 -2.235
104 HA LYS 18 HA LYS 18 7.523 -3.603 -3.442
105 1HB LYS 18 2HB LYS 18 9.231 -2.051 -4.626
106 2HB LYS 18 1HB LYS 18 10.427 -3.281 -4.218
107 1HG LYS 18 2HG LYS 18 9.755 -4.047 -6.299
108 2HG LYS 18 1HG LYS 18 8.617 -4.915 -5.269
109 1HD LYS 18 2HD LYS 18 6.830 -3.578 -5.876
110 2HD LYS 18 1HD LYS 18 7.851 -2.179 -6.204
111 1HE LYS 18 2HE LYS 18 7.190 -2.889 -8.368
112 2HE LYS 18 1HE LYS 18 8.789 -3.635 -8.176
113 1HZ LYS 18 1HZ LYS 18 7.751 -5.645 -7.377
114 2HZ LYS 18 2HZ LYS 18 7.093 -5.248 -8.892
115 3HZ LYS 18 3HZ LYS 18 6.211 -4.941 -7.473
116 H SER 19 H SER 19 8.819 -4.125 -0.687
117 HA SER 19 HA SER 19 10.587 -6.406 -0.996
118 1HB SER 19 2HB SER 19 10.319 -4.797 0.976
119 2HB SER 19 1HB SER 19 8.840 -5.668 1.368
120 HG SER 19 HG SER 19 10.715 -6.475 2.461
121 H SER 20 H SER 20 7.125 -6.091 -0.086
122 HA SER 20 HA SER 20 6.762 -8.982 -0.813
123 1HB SER 20 2HB SER 20 6.380 -7.802 1.590
124 2HB SER 20 1HB SER 20 4.794 -7.518 0.880
125 HG SER 20 HG SER 20 4.417 -9.518 1.384
126 H ASN 21 H ASN 21 6.585 -6.483 -2.571
127 HA ASN 21 HA ASN 21 5.156 -5.578 -4.216
128 1HB ASN 21 2HB ASN 21 4.276 -8.446 -3.833
129 2HB ASN 21 1HB ASN 21 3.558 -7.427 -5.081
130 1HD2 ASN 21 1HD2 ASN 21 6.612 -8.935 -4.030
131 2HD2 ASN 21 2HD2 ASN 21 7.411 -8.740 -5.515
132 H LEU 22 H LEU 22 4.345 -4.297 -2.128
133 HA LEU 22 HA LEU 22 1.495 -4.934 -1.507
134 1HB LEU 22 2HB LEU 22 3.622 -3.141 -0.313
135 2HB LEU 22 1HB LEU 22 1.944 -3.106 0.231
136 HG LEU 22 HG LEU 22 2.862 -5.841 0.080
137 1HD1 LEU 22 1HD1 LEU 22 4.529 -5.657 1.960
138 2HD1 LEU 22 2HD1 LEU 22 4.548 -3.912 1.702
139 3HD1 LEU 22 3HD1 LEU 22 5.104 -4.999 0.429
140 1HD2 LEU 22 1HD2 LEU 22 2.091 -4.067 2.422
141 2HD2 LEU 22 2HD2 LEU 22 2.130 -5.831 2.432
142 3HD2 LEU 22 3HD2 LEU 22 0.961 -4.981 1.421
143 H VAL 23 H VAL 23 -0.089 -3.159 -1.594
144 HA VAL 23 HA VAL 23 0.645 -0.927 -3.460
145 HB VAL 23 HB VAL 23 -1.586 -1.340 -4.552
146 1HG1 VAL 23 1HG1 VAL 23 0.628 -2.288 -5.376
147 2HG1 VAL 23 2HG1 VAL 23 -0.813 -3.151 -5.915
148 3HG1 VAL 23 3HG1 VAL 23 0.169 -3.806 -4.604
149 1HG2 VAL 23 1HG2 VAL 23 -2.983 -3.057 -3.919
150 2HG2 VAL 23 2HG2 VAL 23 -2.220 -2.773 -2.356
151 3HG2 VAL 23 3HG2 VAL 23 -1.652 -4.085 -3.387
152 H CYS 24 H CYS 24 -1.054 0.851 -3.382
153 HA CYS 24 HA CYS 24 -1.826 1.351 -0.568
154 1HB CYS 24 2HB CYS 24 -0.683 2.901 -2.409
155 2HB CYS 24 1HB CYS 24 -2.361 3.229 -2.841
156 H SER 25 H SER 25 -3.932 1.271 0.153
157 HA SER 25 HA SER 25 -6.043 0.482 -1.801
158 1HB SER 25 2HB SER 25 -5.290 -0.549 0.586
159 2HB SER 25 1HB SER 25 -6.518 0.584 1.137
160 HG SER 25 HG SER 25 -6.834 -1.792 -0.029
161 H ARG 26 H ARG 26 -7.955 1.704 -2.023
162 HA ARG 26 HA ARG 26 -7.786 4.535 -1.230
163 1HB ARG 26 2HB ARG 26 -9.675 4.775 -2.729
164 2HB ARG 26 1HB ARG 26 -8.529 3.670 -3.482
165 1HG ARG 26 2HG ARG 26 -9.858 1.745 -2.645
166 2HG ARG 26 1HG ARG 26 -11.020 2.871 -1.944
167 1HD ARG 26 2HD ARG 26 -11.496 3.796 -4.187
168 2HD ARG 26 1HD ARG 26 -10.332 2.660 -4.897
169 HE ARG 26 HE ARG 26 -12.796 1.794 -3.426
170 1HH1 ARG 26 2HH1 ARG 26 -12.720 1.751 -6.447
171 2HH1 ARG 26 1HH1 ARG 26 -12.283 0.105 -6.765
172 1HH2 ARG 26 1HH2 ARG 26 -11.180 -0.505 -3.526
173 2HH2 ARG 26 2HH2 ARG 26 -11.409 -1.175 -5.107
174 H LYS 27 H LYS 27 -9.615 1.655 -0.284
175 HA LYS 27 HA LYS 27 -11.550 3.119 1.358
176 1HB LYS 27 2HB LYS 27 -11.894 0.902 0.181
177 2HB LYS 27 1HB LYS 27 -10.795 0.181 1.356
178 1HG LYS 27 2HG LYS 27 -12.289 0.416 3.110
179 2HG LYS 27 1HG LYS 27 -13.088 1.810 2.382
180 1HD LYS 27 2HD LYS 27 -14.423 0.500 1.004
181 2HD LYS 27 1HD LYS 27 -13.278 -0.842 0.998
182 1HE LYS 27 2HE LYS 27 -13.864 -1.422 3.296
183 2HE LYS 27 1HE LYS 27 -14.923 -0.004 3.414
184 1HZ LYS 27 1HZ LYS 27 -16.229 -0.851 1.572
185 2HZ LYS 27 2HZ LYS 27 -16.174 -2.005 2.818
186 3HZ LYS 27 3HZ LYS 27 -15.213 -2.203 1.431
187 H HIS 28 H HIS 28 -8.548 1.303 1.897
188 HA HIS 28 HA HIS 28 -8.677 1.735 4.825
189 1HB HIS 28 2HB HIS 28 -6.639 0.412 2.999
190 2HB HIS 28 1HB HIS 28 -6.618 0.344 4.760
191 HD1 HIS 28 HD1 HIS 28 -8.301 -1.099 1.768
192 HD2 HIS 28 HD2 HIS 28 -8.764 -1.219 5.909
193 HE1 HIS 28 HE1 HIS 28 -9.891 -3.008 2.257
194 H ALA 29 H ALA 29 -7.249 3.211 2.008
195 HA ALA 29 HA ALA 29 -5.847 5.081 1.751
196 1HB ALA 29 1HB ALA 29 -6.259 6.777 3.313
197 2HB ALA 29 2HB ALA 29 -6.297 5.652 4.670
198 3HB ALA 29 3HB ALA 29 -7.655 5.725 3.548
199 H TRP 30 H TRP 30 -4.647 2.498 2.644
200 HA TRP 30 HA TRP 30 -2.069 3.598 3.592
201 1HB TRP 30 2HB TRP 30 -1.987 2.295 5.565
202 2HB TRP 30 1HB TRP 30 -3.615 2.956 5.546
203 HD1 TRP 30 HD1 TRP 30 -4.332 0.644 3.136
204 HE1 TRP 30 HE1 TRP 30 -4.989 -1.684 4.022
205 HE3 TRP 30 HE3 TRP 30 -2.457 0.959 7.861
206 HZ2 TRP 30 HZ2 TRP 30 -4.750 -3.212 6.430
207 HZ3 TRP 30 HZ3 TRP 30 -2.683 -0.942 9.436
208 HH2 TRP 30 HH2 TRP 30 -3.826 -3.026 8.727
209 H CYS 31 H CYS 31 -0.624 1.331 3.955
210 HA CYS 31 HA CYS 31 -0.467 0.233 1.242
211 1HB CYS 31 2HB CYS 31 1.369 0.885 3.052
212 2HB CYS 31 1HB CYS 31 1.128 -0.783 3.569
213 H LYS 32 H LYS 32 -2.274 -1.113 0.926
214 HA LYS 32 HA LYS 32 -2.889 -3.241 2.900
215 1HB LYS 32 2HB LYS 32 -4.660 -1.873 1.831
216 2HB LYS 32 1HB LYS 32 -4.134 -2.435 0.246
217 1HG LYS 32 2HG LYS 32 -5.885 -3.907 0.690
218 2HG LYS 32 1HG LYS 32 -4.506 -4.826 1.290
219 1HD LYS 32 2HD LYS 32 -4.981 -3.705 3.566
220 2HD LYS 32 1HD LYS 32 -6.542 -3.261 2.876
221 1HE LYS 32 2HE LYS 32 -6.504 -5.883 2.201
222 2HE LYS 32 1HE LYS 32 -5.533 -5.942 3.685
223 1HZ LYS 32 1HZ LYS 32 -7.818 -6.083 4.310
224 2HZ LYS 32 2HZ LYS 32 -8.231 -4.742 3.354
225 3HZ LYS 32 3HZ LYS 32 -7.273 -4.537 4.743
226 H TYR 33 H TYR 33 -2.531 -5.441 2.479
227 HA TYR 33 HA TYR 33 -0.605 -6.085 0.330
228 1HB TYR 33 2HB TYR 33 -0.335 -6.873 2.670
229 2HB TYR 33 1HB TYR 33 -1.866 -7.740 2.548
230 HD1 TYR 33 HD1 TYR 33 1.533 -7.482 1.007
231 HD2 TYR 33 HD2 TYR 33 -1.951 -9.915 1.635
232 HE1 TYR 33 HE1 TYR 33 2.707 -9.422 0.005
233 HE2 TYR 33 HE2 TYR 33 -0.777 -11.855 0.633
234 HH TYR 33 HH TYR 33 2.057 -12.372 0.412
235 H GLU 34 H GLU 34 -1.615 -6.332 -1.656
236 HA GLU 34 HA GLU 34 -4.192 -7.845 -1.782
237 1HB GLU 34 2HB GLU 34 -2.995 -5.561 -3.109
238 2HB GLU 34 1HB GLU 34 -3.487 -6.769 -4.294
239 1HG GLU 34 2HG GLU 34 -5.326 -5.907 -2.060
240 2HG GLU 34 1HG GLU 34 -5.258 -5.035 -3.591
241 H ILE 35 H ILE 35 -4.355 -9.199 -3.900
242 HA ILE 35 HA ILE 35 -2.185 -11.168 -3.899
243 HB ILE 35 HB ILE 35 -4.729 -10.867 -5.537
244 1HG1 ILE 35 2HG1 ILE 35 -4.751 -13.008 -3.615
245 2HG1 ILE 35 1HG1 ILE 35 -4.301 -11.513 -2.796
246 1HG2 ILE 35 1HG2 ILE 35 -4.452 -13.197 -6.127
247 2HG2 ILE 35 2HG2 ILE 35 -3.034 -13.340 -5.089
248 3HG2 ILE 35 3HG2 ILE 35 -2.961 -12.354 -6.549
249 1HD1 ILE 35 1HD1 ILE 35 -6.277 -10.387 -3.634
250 2HD1 ILE 35 2HD1 ILE 35 -6.783 -11.902 -2.886
251 3HD1 ILE 35 3HD1 ILE 35 -6.690 -11.774 -4.642
252 1HN NH2 36 1HN NH2 36 -0.496 -10.633 -6.936
253 2HN NH2 36 2HN NH2 36 -1.122 -11.903 -5.863
Start of MODEL 13
1 1H GLU 1 1H GLU 1 11.611 6.552 -3.213
2 2H GLU 1 2H GLU 1 12.415 7.863 -2.493
3 3H GLU 1 3H GLU 1 10.723 7.881 -2.646
4 HA GLU 1 HA GLU 1 12.311 6.043 -0.917
5 1HB GLU 1 2HB GLU 1 10.729 8.576 -0.577
6 2HB GLU 1 1HB GLU 1 10.773 7.417 0.752
7 1HG GLU 1 2HG GLU 1 13.318 8.305 -0.603
8 2HG GLU 1 1HG GLU 1 12.593 9.271 0.684
9 H CYS 2 H CYS 2 11.218 4.192 -0.364
10 HA CYS 2 HA CYS 2 8.470 3.792 -1.390
11 1HB CYS 2 2HB CYS 2 8.961 1.502 -1.115
12 2HB CYS 2 1HB CYS 2 10.527 2.201 -1.513
13 H LEU 3 H LEU 3 6.852 2.738 0.092
14 HA LEU 3 HA LEU 3 6.878 4.088 2.757
15 1HB LEU 3 2HB LEU 3 4.708 2.855 1.029
16 2HB LEU 3 1HB LEU 3 4.415 3.612 2.594
17 HG LEU 3 HG LEU 3 5.988 5.230 0.669
18 1HD1 LEU 3 1HD1 LEU 3 4.539 4.870 -1.039
19 2HD1 LEU 3 2HD1 LEU 3 3.425 5.866 -0.101
20 3HD1 LEU 3 3HD1 LEU 3 3.345 4.107 0.013
21 1HD2 LEU 3 1HD2 LEU 3 5.149 5.917 2.984
22 2HD2 LEU 3 2HD2 LEU 3 3.525 5.922 2.295
23 3HD2 LEU 3 3HD2 LEU 3 4.751 7.025 1.671
24 H GLY 4 H GLY 4 6.361 2.875 4.665
25 1HA GLY 4 2HA GLY 4 7.168 0.048 4.556
26 2HA GLY 4 1HA GLY 4 6.849 0.979 6.018
27 H PHE 5 H PHE 5 5.437 -0.557 6.944
28 HA PHE 5 HA PHE 5 3.062 -1.447 5.417
29 1HB PHE 5 2HB PHE 5 4.453 -2.910 6.935
30 2HB PHE 5 1HB PHE 5 3.876 -1.949 8.297
31 HD1 PHE 5 HD1 PHE 5 2.073 -2.834 9.468
32 HD2 PHE 5 HD2 PHE 5 2.409 -3.609 5.255
33 HE1 PHE 5 HE1 PHE 5 0.002 -4.195 9.552
34 HE2 PHE 5 HE2 PHE 5 0.340 -4.968 5.339
35 HZ PHE 5 HZ PHE 5 -0.867 -5.262 7.487
36 H GLY 6 H GLY 6 1.086 -0.473 5.599
37 1HA GLY 6 2HA GLY 6 -0.671 0.815 6.481
38 2HA GLY 6 1HA GLY 6 0.206 0.882 8.010
39 H LYS 7 H LYS 7 1.096 2.006 4.732
40 HA LYS 7 HA LYS 7 1.478 4.753 5.886
41 1HB LYS 7 2HB LYS 7 3.151 2.935 4.238
42 2HB LYS 7 1HB LYS 7 3.160 4.628 3.741
43 1HG LYS 7 2HG LYS 7 3.507 3.918 6.642
44 2HG LYS 7 1HG LYS 7 4.881 3.817 5.543
45 1HD LYS 7 2HD LYS 7 5.126 6.056 5.522
46 2HD LYS 7 1HD LYS 7 3.421 6.292 5.134
47 1HE LYS 7 2HE LYS 7 3.443 7.276 7.233
48 2HE LYS 7 1HE LYS 7 3.172 5.597 7.738
49 1HZ LYS 7 1HZ LYS 7 5.574 5.292 7.875
50 2HZ LYS 7 2HZ LYS 7 5.069 6.546 8.903
51 3HZ LYS 7 3HZ LYS 7 5.825 6.909 7.426
52 H GLY 8 H GLY 8 0.169 6.256 4.938
53 1HA GLY 8 2HA GLY 8 -1.746 5.748 2.959
54 2HA GLY 8 1HA GLY 8 -1.144 7.359 3.335
55 H CYS 9 H CYS 9 -1.630 5.433 0.802
56 HA CYS 9 HA CYS 9 0.555 6.685 -0.786
57 1HB CYS 9 2HB CYS 9 0.911 4.377 -1.840
58 2HB CYS 9 1HB CYS 9 1.495 4.560 -0.188
59 H ASN 10 H ASN 10 0.115 6.078 -3.234
60 HA ASN 10 HA ASN 10 -2.765 6.602 -3.736
61 1HB ASN 10 2HB ASN 10 -1.164 8.108 -4.729
62 2HB ASN 10 1HB ASN 10 -0.211 6.767 -5.359
63 1HD2 ASN 10 1HD2 ASN 10 -0.436 7.234 -7.597
64 2HD2 ASN 10 2HD2 ASN 10 -1.925 7.206 -8.407
65 HA PRO 11 HA PRO 11 -3.188 2.273 -4.784
66 1HB PRO 11 2HB PRO 11 -5.793 2.425 -5.624
67 2HB PRO 11 1HB PRO 11 -5.319 2.390 -3.914
68 1HG PRO 11 2HG PRO 11 -6.074 4.712 -5.621
69 2HG PRO 11 1HG PRO 11 -6.497 4.367 -3.937
70 1HD PRO 11 2HD PRO 11 -4.561 6.131 -4.635
71 2HD PRO 11 1HD PRO 11 -4.508 5.187 -3.128
72 H SER 12 H SER 12 -4.300 4.858 -7.013
73 HA SER 12 HA SER 12 -4.473 3.359 -9.413
74 1HB SER 12 2HB SER 12 -3.675 6.210 -8.779
75 2HB SER 12 1HB SER 12 -3.880 5.641 -10.434
76 HG SER 12 HG SER 12 -5.752 6.140 -8.458
77 H ASN 13 H ASN 13 -1.659 4.757 -7.785
78 HA ASN 13 HA ASN 13 0.128 3.155 -9.567
79 1HB ASN 13 2HB ASN 13 -0.099 5.662 -10.141
80 2HB ASN 13 1HB ASN 13 0.732 5.969 -8.616
81 1HD2 ASN 13 1HD2 ASN 13 3.005 5.427 -8.473
82 2HD2 ASN 13 2HD2 ASN 13 3.907 4.958 -9.831
83 H ASP 14 H ASP 14 0.066 1.703 -7.657
84 HA ASP 14 HA ASP 14 0.675 2.309 -5.000
85 1HB ASP 14 2HB ASP 14 1.314 -0.015 -4.836
86 2HB ASP 14 1HB ASP 14 0.037 0.096 -6.045
87 H GLN 15 H GLN 15 2.465 2.981 -3.915
88 HA GLN 15 HA GLN 15 5.120 2.894 -5.304
89 1HB GLN 15 2HB GLN 15 5.466 5.203 -4.322
90 2HB GLN 15 1HB GLN 15 4.210 5.125 -5.555
91 1HG GLN 15 2HG GLN 15 2.469 5.244 -3.957
92 2HG GLN 15 1HG GLN 15 3.545 4.818 -2.627
93 1HE2 GLN 15 1HE2 GLN 15 5.344 6.505 -2.175
94 2HE2 GLN 15 2HE2 GLN 15 4.943 8.139 -2.391
95 H CYS 16 H CYS 16 3.906 1.178 -3.181
96 HA CYS 16 HA CYS 16 5.315 1.927 -0.694
97 1HB CYS 16 2HB CYS 16 2.962 0.740 -1.185
98 2HB CYS 16 1HB CYS 16 3.970 -0.707 -1.134
99 H CYS 17 H CYS 17 6.723 0.193 0.347
100 HA CYS 17 HA CYS 17 8.849 -0.619 -1.432
101 1HB CYS 17 2HB CYS 17 8.306 -0.405 1.359
102 2HB CYS 17 1HB CYS 17 8.858 -2.053 1.061
103 H LYS 18 H LYS 18 8.812 -2.375 -2.765
104 HA LYS 18 HA LYS 18 6.756 -4.451 -2.501
105 1HB LYS 18 2HB LYS 18 8.610 -3.398 -4.471
106 2HB LYS 18 1HB LYS 18 8.675 -5.160 -4.442
107 1HG LYS 18 2HG LYS 18 6.910 -4.837 -5.911
108 2HG LYS 18 1HG LYS 18 6.037 -4.939 -4.383
109 1HD LYS 18 2HD LYS 18 7.017 -2.234 -5.102
110 2HD LYS 18 1HD LYS 18 5.752 -2.881 -6.146
111 1HE LYS 18 2HE LYS 18 5.409 -3.111 -3.167
112 2HE LYS 18 1HE LYS 18 5.079 -1.558 -3.959
113 1HZ LYS 18 1HZ LYS 18 3.953 -4.191 -4.766
114 2HZ LYS 18 2HZ LYS 18 3.662 -2.711 -5.551
115 3HZ LYS 18 3HZ LYS 18 3.105 -2.960 -3.966
116 H SER 19 H SER 19 9.679 -4.028 -0.919
117 HA SER 19 HA SER 19 10.926 -6.604 -1.090
118 1HB SER 19 2HB SER 19 11.971 -5.846 1.061
119 2HB SER 19 1HB SER 19 12.026 -4.618 -0.200
120 HG SER 19 HG SER 19 10.617 -4.688 2.182
121 H SER 20 H SER 20 8.303 -5.352 0.966
122 HA SER 20 HA SER 20 8.089 -7.992 2.344
123 1HB SER 20 2HB SER 20 7.021 -5.202 2.807
124 2HB SER 20 1HB SER 20 6.416 -6.582 3.717
125 HG SER 20 HG SER 20 8.123 -5.692 4.845
126 H ASN 21 H ASN 21 7.027 -6.946 -0.525
127 HA ASN 21 HA ASN 21 5.168 -7.419 -1.887
128 1HB ASN 21 2HB ASN 21 5.855 -9.624 -0.460
129 2HB ASN 21 1HB ASN 21 4.188 -9.430 0.075
130 1HD2 ASN 21 1HD2 ASN 21 2.480 -9.475 -1.624
131 2HD2 ASN 21 2HD2 ASN 21 2.795 -10.214 -3.120
132 H LEU 22 H LEU 22 4.585 -5.169 -0.639
133 HA LEU 22 HA LEU 22 1.970 -5.535 0.783
134 1HB LEU 22 2HB LEU 22 3.991 -3.272 0.680
135 2HB LEU 22 1HB LEU 22 2.460 -3.188 1.551
136 HG LEU 22 HG LEU 22 4.548 -5.330 2.042
137 1HD1 LEU 22 1HD1 LEU 22 4.003 -2.761 3.565
138 2HD1 LEU 22 2HD1 LEU 22 5.460 -3.127 2.639
139 3HD1 LEU 22 3HD1 LEU 22 5.086 -4.047 4.096
140 1HD2 LEU 22 1HD2 LEU 22 3.188 -5.457 4.224
141 2HD2 LEU 22 2HD2 LEU 22 2.406 -6.080 2.771
142 3HD2 LEU 22 3HD2 LEU 22 1.974 -4.486 3.391
143 H VAL 23 H VAL 23 0.173 -4.214 0.112
144 HA VAL 23 HA VAL 23 0.457 -2.988 -2.618
145 HB VAL 23 HB VAL 23 -1.874 -3.849 -2.999
146 1HG1 VAL 23 1HG1 VAL 23 0.219 -5.101 -3.677
147 2HG1 VAL 23 2HG1 VAL 23 -1.203 -6.116 -3.445
148 3HG1 VAL 23 3HG1 VAL 23 0.046 -6.053 -2.202
149 1HG2 VAL 23 1HG2 VAL 23 -1.402 -5.445 -0.463
150 2HG2 VAL 23 2HG2 VAL 23 -2.855 -5.431 -1.461
151 3HG2 VAL 23 3HG2 VAL 23 -2.414 -4.003 -0.524
152 H CYS 24 H CYS 24 -0.854 -1.116 -3.001
153 HA CYS 24 HA CYS 24 -1.528 0.412 -0.565
154 1HB CYS 24 2HB CYS 24 -0.267 1.240 -2.635
155 2HB CYS 24 1HB CYS 24 -1.816 1.203 -3.476
156 H SER 25 H SER 25 -3.512 -0.121 0.302
157 HA SER 25 HA SER 25 -5.754 -1.172 -1.146
158 1HB SER 25 2HB SER 25 -5.348 0.172 1.528
159 2HB SER 25 1HB SER 25 -6.933 -0.407 1.022
160 HG SER 25 HG SER 25 -5.899 -2.045 2.135
161 H ARG 26 H ARG 26 -7.724 -0.122 -1.771
162 HA ARG 26 HA ARG 26 -7.404 2.709 -2.588
163 1HB ARG 26 2HB ARG 26 -9.228 0.397 -3.195
164 2HB ARG 26 1HB ARG 26 -9.751 2.030 -3.606
165 1HG ARG 26 2HG ARG 26 -7.988 2.355 -5.121
166 2HG ARG 26 1HG ARG 26 -7.010 1.072 -4.405
167 1HD ARG 26 2HD ARG 26 -8.957 -0.506 -5.173
168 2HD ARG 26 1HD ARG 26 -9.367 0.830 -6.267
169 HE ARG 26 HE ARG 26 -6.518 0.195 -6.280
170 1HH1 ARG 26 1HH2 ARG 26 -7.861 -2.396 -6.955
171 2HH1 ARG 26 2HH2 ARG 26 -8.035 -2.280 -8.675
172 1HH2 ARG 26 2HH1 ARG 26 -7.502 1.152 -8.761
173 2HH2 ARG 26 1HH1 ARG 26 -7.831 -0.265 -9.700
174 H LYS 27 H LYS 27 -9.693 0.721 -0.671
175 HA LYS 27 HA LYS 27 -11.391 2.889 0.161
176 1HB LYS 27 2HB LYS 27 -11.177 0.080 0.449
177 2HB LYS 27 1HB LYS 27 -11.209 0.734 2.086
178 1HG LYS 27 2HG LYS 27 -13.197 2.175 1.246
179 2HG LYS 27 1HG LYS 27 -13.269 1.030 -0.095
180 1HD LYS 27 2HD LYS 27 -14.490 -0.313 1.241
181 2HD LYS 27 1HD LYS 27 -13.024 -0.578 2.183
182 1HE LYS 27 2HE LYS 27 -14.085 0.405 3.934
183 2HE LYS 27 1HE LYS 27 -14.014 1.932 3.032
184 1HZ LYS 27 1HZ LYS 27 -16.040 1.289 1.863
185 2HZ LYS 27 2HZ LYS 27 -16.306 1.349 3.540
186 3HZ LYS 27 3HZ LYS 27 -16.123 -0.150 2.760
187 H HIS 28 H HIS 28 -8.466 1.447 1.558
188 HA HIS 28 HA HIS 28 -8.568 3.245 3.914
189 1HB HIS 28 2HB HIS 28 -6.584 1.132 2.999
190 2HB HIS 28 1HB HIS 28 -6.591 1.909 4.581
191 HD1 HIS 28 HD1 HIS 28 -9.317 1.756 5.610
192 HD2 HIS 28 HD2 HIS 28 -7.797 -1.326 3.246
193 HE1 HIS 28 HE1 HIS 28 -10.739 -0.285 6.091
194 H ALA 29 H ALA 29 -7.032 3.059 0.775
195 HA ALA 29 HA ALA 29 -5.539 4.498 -0.333
196 1HB ALA 29 1HB ALA 29 -5.989 6.477 1.888
197 2HB ALA 29 2HB ALA 29 -7.332 6.030 0.835
198 3HB ALA 29 3HB ALA 29 -5.882 6.764 0.152
199 H TRP 30 H TRP 30 -4.448 2.644 1.664
200 HA TRP 30 HA TRP 30 -1.863 4.010 2.129
201 1HB TRP 30 2HB TRP 30 -1.893 3.733 4.477
202 2HB TRP 30 1HB TRP 30 -3.519 4.288 4.104
203 HD1 TRP 30 HD1 TRP 30 -4.487 1.347 3.001
204 HE1 TRP 30 HE1 TRP 30 -5.053 -0.448 4.755
205 HE3 TRP 30 HE3 TRP 30 -1.973 3.231 7.018
206 HZ2 TRP 30 HZ2 TRP 30 -4.509 -1.013 7.511
207 HZ3 TRP 30 HZ3 TRP 30 -2.013 2.049 9.197
208 HH2 TRP 30 HH2 TRP 30 -3.276 -0.069 9.447
209 H CYS 31 H CYS 31 -0.249 2.294 3.082
210 HA CYS 31 HA CYS 31 -0.306 -0.032 1.329
211 1HB CYS 31 2HB CYS 31 1.636 1.464 2.404
212 2HB CYS 31 1HB CYS 31 1.569 0.218 3.648
213 H LYS 32 H LYS 32 -1.121 -2.030 1.812
214 HA LYS 32 HA LYS 32 -1.358 -2.911 4.639
215 1HB LYS 32 2HB LYS 32 -3.410 -1.634 4.093
216 2HB LYS 32 1HB LYS 32 -3.678 -2.668 2.690
217 1HG LYS 32 2HG LYS 32 -4.125 -4.568 4.030
218 2HG LYS 32 1HG LYS 32 -3.411 -3.828 5.463
219 1HD LYS 32 2HD LYS 32 -5.242 -2.350 5.753
220 2HD LYS 32 1HD LYS 32 -5.839 -2.641 4.118
221 1HE LYS 32 2HE LYS 32 -6.515 -4.899 4.691
222 2HE LYS 32 1HE LYS 32 -5.731 -4.776 6.279
223 1HZ LYS 32 1HZ LYS 32 -7.998 -3.131 5.282
224 2HZ LYS 32 2HZ LYS 32 -7.170 -2.836 6.738
225 3HZ LYS 32 3HZ LYS 32 -8.051 -4.275 6.534
226 H TYR 33 H TYR 33 -1.710 -5.240 4.788
227 HA TYR 33 HA TYR 33 -0.583 -6.741 2.526
228 1HB TYR 33 2HB TYR 33 -0.305 -6.971 5.152
229 2HB TYR 33 1HB TYR 33 -1.757 -7.963 5.012
230 HD1 TYR 33 HD1 TYR 33 -1.738 -10.058 3.728
231 HD2 TYR 33 HD2 TYR 33 1.810 -7.677 4.169
232 HE1 TYR 33 HE1 TYR 33 -0.365 -11.959 2.926
233 HE2 TYR 33 HE2 TYR 33 3.185 -9.581 3.368
234 HH TYR 33 HH TYR 33 2.465 -12.511 3.406
235 H GLU 34 H GLU 34 -1.830 -7.686 0.958
236 HA GLU 34 HA GLU 34 -4.700 -7.499 0.927
237 1HB GLU 34 2HB GLU 34 -4.479 -8.723 -1.158
238 2HB GLU 34 1HB GLU 34 -3.120 -7.608 -1.035
239 1HG GLU 34 2HG GLU 34 -1.769 -9.383 -1.376
240 2HG GLU 34 1HG GLU 34 -2.217 -9.935 0.237
241 H ILE 35 H ILE 35 -6.262 -9.232 1.062
242 HA ILE 35 HA ILE 35 -5.343 -11.562 2.719
243 HB ILE 35 HB ILE 35 -7.961 -10.026 2.594
244 1HG1 ILE 35 2HG1 ILE 35 -6.509 -10.384 5.143
245 2HG1 ILE 35 1HG1 ILE 35 -5.646 -9.418 3.946
246 1HG2 ILE 35 1HG2 ILE 35 -7.192 -12.558 4.058
247 2HG2 ILE 35 2HG2 ILE 35 -8.584 -12.288 3.009
248 3HG2 ILE 35 3HG2 ILE 35 -8.518 -11.529 4.599
249 1HD1 ILE 35 1HD1 ILE 35 -7.637 -7.978 3.678
250 2HD1 ILE 35 2HD1 ILE 35 -7.079 -7.987 5.351
251 3HD1 ILE 35 3HD1 ILE 35 -8.490 -8.938 4.887
252 1HN NH2 36 1HN NH2 36 -6.756 -14.007 0.654
253 2HN NH2 36 2HN NH2 36 -6.304 -13.600 2.324
Start of MODEL 14
1 1H GLU 1 1H GLU 1 14.586 1.293 1.883
2 2H GLU 1 2H GLU 1 14.661 -0.402 1.780
3 3H GLU 1 3H GLU 1 15.571 0.420 2.956
4 HA GLU 1 HA GLU 1 13.581 -0.637 3.919
5 1HB GLU 1 2HB GLU 1 14.720 1.847 4.291
6 2HB GLU 1 1HB GLU 1 13.012 2.253 4.121
7 1HG GLU 1 2HG GLU 1 14.003 0.071 5.972
8 2HG GLU 1 1HG GLU 1 13.774 1.740 6.495
9 H CYS 2 H CYS 2 11.394 -1.057 3.699
10 HA CYS 2 HA CYS 2 9.916 0.392 1.517
11 1HB CYS 2 2HB CYS 2 8.782 -1.767 1.152
12 2HB CYS 2 1HB CYS 2 10.530 -1.970 1.045
13 H LEU 3 H LEU 3 7.426 0.105 1.880
14 HA LEU 3 HA LEU 3 6.830 0.975 4.660
15 1HB LEU 3 2HB LEU 3 5.286 0.986 2.046
16 2HB LEU 3 1HB LEU 3 4.649 1.619 3.563
17 HG LEU 3 HG LEU 3 7.284 2.562 2.421
18 1HD1 LEU 3 1HD1 LEU 3 5.315 2.899 0.827
19 2HD1 LEU 3 2HD1 LEU 3 6.160 4.365 1.323
20 3HD1 LEU 3 3HD1 LEU 3 4.615 3.946 2.062
21 1HD2 LEU 3 1HD2 LEU 3 6.682 4.568 3.834
22 2HD2 LEU 3 2HD2 LEU 3 6.940 3.091 4.761
23 3HD2 LEU 3 3HD2 LEU 3 5.300 3.657 4.442
24 H GLY 4 H GLY 4 5.747 -0.342 6.084
25 1HA GLY 4 2HA GLY 4 5.083 -3.077 5.290
26 2HA GLY 4 1HA GLY 4 4.912 -2.396 6.908
27 H PHE 5 H PHE 5 2.808 -3.701 6.663
28 HA PHE 5 HA PHE 5 0.703 -2.758 4.923
29 1HB PHE 5 2HB PHE 5 0.546 -4.961 5.775
30 2HB PHE 5 1HB PHE 5 0.909 -4.445 7.420
31 HD1 PHE 5 HD1 PHE 5 -1.632 -3.758 4.731
32 HD2 PHE 5 HD2 PHE 5 -0.861 -4.321 8.919
33 HE1 PHE 5 HE1 PHE 5 -4.055 -3.533 5.210
34 HE2 PHE 5 HE2 PHE 5 -3.284 -4.097 9.396
35 HZ PHE 5 HZ PHE 5 -4.880 -3.703 7.540
36 H GLY 6 H GLY 6 -0.806 -1.147 5.258
37 1HA GLY 6 2HA GLY 6 -1.967 0.603 6.294
38 2HA GLY 6 1HA GLY 6 -1.442 -0.040 7.850
39 H LYS 7 H LYS 7 0.130 1.466 5.008
40 HA LYS 7 HA LYS 7 1.482 3.382 6.871
41 1HB LYS 7 2HB LYS 7 2.585 1.387 4.948
42 2HB LYS 7 1HB LYS 7 3.382 2.960 4.984
43 1HG LYS 7 2HG LYS 7 2.841 1.269 7.443
44 2HG LYS 7 1HG LYS 7 4.382 1.309 6.586
45 1HD LYS 7 2HD LYS 7 3.656 4.010 7.019
46 2HD LYS 7 1HD LYS 7 3.354 3.170 8.540
47 1HE LYS 7 2HE LYS 7 5.662 2.208 8.432
48 2HE LYS 7 1HE LYS 7 5.960 3.173 6.973
49 1HZ LYS 7 1HZ LYS 7 5.102 4.252 9.609
50 2HZ LYS 7 2HZ LYS 7 5.388 5.168 8.207
51 3HZ LYS 7 3HZ LYS 7 6.670 4.357 8.972
52 H GLY 8 H GLY 8 0.894 5.413 6.230
53 1HA GLY 8 2HA GLY 8 -0.540 6.109 3.936
54 2HA GLY 8 1HA GLY 8 0.467 7.248 4.827
55 H CYS 9 H CYS 9 -0.032 6.164 1.827
56 HA CYS 9 HA CYS 9 2.731 6.821 0.947
57 1HB CYS 9 2HB CYS 9 2.784 4.751 -0.423
58 2HB CYS 9 1HB CYS 9 2.618 4.369 1.290
59 H ASN 10 H ASN 10 2.296 6.122 -1.783
60 HA ASN 10 HA ASN 10 -0.033 7.867 -2.525
61 1HB ASN 10 2HB ASN 10 2.853 7.800 -3.378
62 2HB ASN 10 1HB ASN 10 1.633 8.411 -4.495
63 1HD2 ASN 10 1HD2 ASN 10 3.670 9.337 -1.934
64 2HD2 ASN 10 2HD2 ASN 10 2.892 10.787 -1.517
65 HA PRO 11 HA PRO 11 -1.211 4.448 -5.069
66 1HB PRO 11 2HB PRO 11 -2.812 5.776 -6.857
67 2HB PRO 11 1HB PRO 11 -3.311 5.408 -5.194
68 1HG PRO 11 2HG PRO 11 -2.283 7.958 -6.340
69 2HG PRO 11 1HG PRO 11 -3.564 7.692 -5.147
70 1HD PRO 11 2HD PRO 11 -1.053 8.500 -4.482
71 2HD PRO 11 1HD PRO 11 -2.089 7.545 -3.399
72 H SER 12 H SER 12 -0.255 7.454 -6.785
73 HA SER 12 HA SER 12 0.589 6.098 -9.210
74 1HB SER 12 2HB SER 12 0.979 8.831 -7.980
75 2HB SER 12 1HB SER 12 1.737 8.403 -9.511
76 HG SER 12 HG SER 12 -0.940 8.814 -8.872
77 H ASN 13 H ASN 13 2.240 7.298 -6.301
78 HA ASN 13 HA ASN 13 4.786 6.019 -7.217
79 1HB ASN 13 2HB ASN 13 4.415 8.524 -6.442
80 2HB ASN 13 1HB ASN 13 4.486 7.823 -4.825
81 1HD2 ASN 13 1HD2 ASN 13 6.520 6.653 -4.231
82 2HD2 ASN 13 2HD2 ASN 13 7.965 7.014 -5.045
83 H ASP 14 H ASP 14 3.348 3.988 -6.570
84 HA ASP 14 HA ASP 14 2.874 3.415 -3.786
85 1HB ASP 14 2HB ASP 14 1.711 2.286 -5.605
86 2HB ASP 14 1HB ASP 14 3.235 1.677 -6.250
87 H GLN 15 H GLN 15 4.554 3.357 -2.338
88 HA GLN 15 HA GLN 15 7.100 1.999 -3.155
89 1HB GLN 15 2HB GLN 15 6.733 4.556 -2.354
90 2HB GLN 15 1HB GLN 15 6.942 3.791 -0.778
91 1HG GLN 15 2HG GLN 15 9.164 3.958 -1.166
92 2HG GLN 15 1HG GLN 15 8.941 2.623 -2.296
93 1HE2 GLN 15 1HE2 GLN 15 9.461 6.104 -2.058
94 2HE2 GLN 15 2HE2 GLN 15 9.669 6.370 -3.722
95 H CYS 16 H CYS 16 4.697 0.608 -2.154
96 HA CYS 16 HA CYS 16 5.137 -0.039 0.669
97 1HB CYS 16 2HB CYS 16 3.296 -0.788 -1.560
98 2HB CYS 16 1HB CYS 16 3.441 -1.926 -0.221
99 H CYS 17 H CYS 17 5.588 -2.318 1.354
100 HA CYS 17 HA CYS 17 7.944 -3.384 0.029
101 1HB CYS 17 2HB CYS 17 6.833 -3.425 2.551
102 2HB CYS 17 1HB CYS 17 6.522 -5.068 1.991
103 H LYS 18 H LYS 18 7.816 -4.595 -1.806
104 HA LYS 18 HA LYS 18 5.397 -5.825 -2.781
105 1HB LYS 18 2HB LYS 18 7.419 -4.977 -4.071
106 2HB LYS 18 1HB LYS 18 8.269 -6.429 -3.543
107 1HG LYS 18 2HG LYS 18 7.332 -6.855 -5.739
108 2HG LYS 18 1HG LYS 18 6.427 -7.801 -4.557
109 1HD LYS 18 2HD LYS 18 4.570 -6.345 -4.632
110 2HD LYS 18 1HD LYS 18 5.508 -5.045 -5.367
111 1HE LYS 18 2HE LYS 18 4.299 -5.888 -7.208
112 2HE LYS 18 1HE LYS 18 5.830 -6.775 -7.339
113 1HZ LYS 18 1HZ LYS 18 3.812 -8.217 -7.398
114 2HZ LYS 18 2HZ LYS 18 3.482 -7.752 -5.798
115 3HZ LYS 18 3HZ LYS 18 4.903 -8.612 -6.161
116 H SER 19 H SER 19 8.161 -7.045 -0.912
117 HA SER 19 HA SER 19 7.692 -9.848 -1.168
118 1HB SER 19 2HB SER 19 9.660 -8.538 -0.158
119 2HB SER 19 1HB SER 19 8.684 -8.401 1.301
120 HG SER 19 HG SER 19 9.733 -10.254 1.627
121 H SER 20 H SER 20 6.259 -7.408 0.987
122 HA SER 20 HA SER 20 4.744 -9.368 2.562
123 1HB SER 20 2HB SER 20 4.778 -6.348 2.319
124 2HB SER 20 1HB SER 20 3.749 -7.207 3.462
125 HG SER 20 HG SER 20 6.256 -6.518 3.778
126 H ASN 21 H ASN 21 4.342 -8.142 -0.561
127 HA ASN 21 HA ASN 21 2.536 -8.101 -2.059
128 1HB ASN 21 2HB ASN 21 2.466 -10.413 -0.709
129 2HB ASN 21 1HB ASN 21 0.937 -9.745 -0.134
130 1HD2 ASN 21 1HD2 ASN 21 -0.555 -8.896 -1.982
131 2HD2 ASN 21 2HD2 ASN 21 -0.567 -9.790 -3.425
132 H LEU 22 H LEU 22 2.504 -5.760 -0.981
133 HA LEU 22 HA LEU 22 -0.260 -5.303 0.104
134 1HB LEU 22 2HB LEU 22 2.416 -4.044 0.764
135 2HB LEU 22 1HB LEU 22 0.883 -3.330 1.263
136 HG LEU 22 HG LEU 22 1.568 -6.206 1.887
137 1HD1 LEU 22 1HD1 LEU 22 2.121 -3.745 3.573
138 2HD1 LEU 22 2HD1 LEU 22 3.338 -4.794 2.847
139 3HD1 LEU 22 3HD1 LEU 22 2.287 -5.413 4.121
140 1HD2 LEU 22 1HD2 LEU 22 -0.762 -5.691 2.151
141 2HD2 LEU 22 2HD2 LEU 22 -0.400 -4.158 2.944
142 3HD2 LEU 22 3HD2 LEU 22 -0.068 -5.680 3.772
143 H VAL 23 H VAL 23 -1.271 -3.310 -0.613
144 HA VAL 23 HA VAL 23 0.048 -1.960 -2.946
145 HB VAL 23 HB VAL 23 -2.254 -2.005 -4.009
146 1HG1 VAL 23 1HG1 VAL 23 -1.159 -4.756 -3.366
147 2HG1 VAL 23 2HG1 VAL 23 -0.417 -3.657 -4.528
148 3HG1 VAL 23 3HG1 VAL 23 -2.045 -4.272 -4.811
149 1HG2 VAL 23 1HG2 VAL 23 -3.453 -2.420 -1.815
150 2HG2 VAL 23 2HG2 VAL 23 -2.846 -4.075 -1.872
151 3HG2 VAL 23 3HG2 VAL 23 -3.940 -3.493 -3.127
152 H CYS 24 H CYS 24 -0.382 0.277 -3.093
153 HA CYS 24 HA CYS 24 -1.280 1.624 -0.677
154 1HB CYS 24 2HB CYS 24 -0.369 2.392 -3.441
155 2HB CYS 24 1HB CYS 24 -1.060 3.621 -2.383
156 H SER 25 H SER 25 -3.402 1.915 -0.159
157 HA SER 25 HA SER 25 -5.577 1.444 -2.016
158 1HB SER 25 2HB SER 25 -5.482 1.125 0.521
159 2HB SER 25 1HB SER 25 -5.656 2.873 0.656
160 HG SER 25 HG SER 25 -7.678 2.719 0.036
161 H ARG 26 H ARG 26 -7.255 3.088 -2.530
162 HA ARG 26 HA ARG 26 -6.023 5.698 -3.259
163 1HB ARG 26 2HB ARG 26 -7.226 4.187 -4.890
164 2HB ARG 26 1HB ARG 26 -8.712 4.491 -3.989
165 1HG ARG 26 2HG ARG 26 -7.216 6.927 -4.725
166 2HG ARG 26 1HG ARG 26 -7.841 6.015 -6.098
167 1HD ARG 26 2HD ARG 26 -9.742 6.355 -3.839
168 2HD ARG 26 1HD ARG 26 -9.340 7.831 -4.739
169 HE ARG 26 HE ARG 26 -10.029 6.654 -6.814
170 1HH1 ARG 26 1HH2 ARG 26 -9.910 3.831 -6.062
171 2HH1 ARG 26 2HH2 ARG 26 -11.557 3.438 -5.696
172 1HH2 ARG 26 2HH1 ARG 26 -12.553 6.749 -5.360
173 2HH2 ARG 26 1HH1 ARG 26 -13.056 5.093 -5.298
174 H LYS 27 H LYS 27 -8.796 4.364 -1.445
175 HA LYS 27 HA LYS 27 -9.982 6.892 -0.740
176 1HB LYS 27 2HB LYS 27 -11.036 4.601 -0.717
177 2HB LYS 27 1HB LYS 27 -10.086 4.239 0.723
178 1HG LYS 27 2HG LYS 27 -11.630 5.256 2.003
179 2HG LYS 27 1HG LYS 27 -11.361 6.764 1.129
180 1HD LYS 27 2HD LYS 27 -12.933 5.927 -0.652
181 2HD LYS 27 1HD LYS 27 -13.301 4.556 0.395
182 1HE LYS 27 2HE LYS 27 -14.292 5.945 2.055
183 2HE LYS 27 1HE LYS 27 -13.585 7.415 1.356
184 1HZ LYS 27 1HZ LYS 27 -14.868 7.025 -0.664
185 2HZ LYS 27 2HZ LYS 27 -15.897 7.172 0.680
186 3HZ LYS 27 3HZ LYS 27 -15.567 5.640 0.024
187 H HIS 28 H HIS 28 -7.810 4.702 1.069
188 HA HIS 28 HA HIS 28 -7.448 6.774 3.170
189 1HB HIS 28 2HB HIS 28 -6.937 3.836 2.837
190 2HB HIS 28 1HB HIS 28 -6.032 4.719 4.067
191 HD1 HIS 28 HD1 HIS 28 -7.832 6.458 5.481
192 HD2 HIS 28 HD2 HIS 28 -9.263 2.860 3.933
193 HE1 HIS 28 HE1 HIS 28 -9.958 5.928 6.751
194 H ALA 29 H ALA 29 -5.878 5.732 0.296
195 HA ALA 29 HA ALA 29 -3.762 6.211 -0.626
196 1HB ALA 29 1HB ALA 29 -3.697 8.387 1.476
197 2HB ALA 29 2HB ALA 29 -4.777 8.466 0.084
198 3HB ALA 29 3HB ALA 29 -3.031 8.434 -0.156
199 H TRP 30 H TRP 30 -3.640 4.136 1.241
200 HA TRP 30 HA TRP 30 -0.882 4.470 2.271
201 1HB TRP 30 2HB TRP 30 -1.448 4.030 4.538
202 2HB TRP 30 1HB TRP 30 -2.640 5.206 4.004
203 HD1 TRP 30 HD1 TRP 30 -4.423 2.999 2.377
204 HE1 TRP 30 HE1 TRP 30 -5.945 1.440 3.745
205 HE3 TRP 30 HE3 TRP 30 -2.179 3.384 6.938
206 HZ2 TRP 30 HZ2 TRP 30 -6.182 0.485 6.431
207 HZ3 TRP 30 HZ3 TRP 30 -3.074 2.141 8.887
208 HH2 TRP 30 HH2 TRP 30 -5.071 0.692 8.638
209 H CYS 31 H CYS 31 -0.046 2.296 3.113
210 HA CYS 31 HA CYS 31 -0.406 0.236 1.177
211 1HB CYS 31 2HB CYS 31 1.327 0.842 3.225
212 2HB CYS 31 1HB CYS 31 0.497 -0.574 3.869
213 H LYS 32 H LYS 32 -1.897 -1.407 1.035
214 HA LYS 32 HA LYS 32 -3.587 -2.037 3.423
215 1HB LYS 32 2HB LYS 32 -4.629 -0.388 1.818
216 2HB LYS 32 1HB LYS 32 -4.556 -1.636 0.574
217 1HG LYS 32 2HG LYS 32 -6.624 -2.199 1.332
218 2HG LYS 32 1HG LYS 32 -5.740 -3.000 2.631
219 1HD LYS 32 2HD LYS 32 -5.821 -0.791 3.891
220 2HD LYS 32 1HD LYS 32 -6.960 -0.230 2.666
221 1HE LYS 32 2HE LYS 32 -8.493 -1.104 4.162
222 2HE LYS 32 1HE LYS 32 -8.113 -2.608 3.301
223 1HZ LYS 32 1HZ LYS 32 -6.731 -1.597 5.735
224 2HZ LYS 32 2HZ LYS 32 -6.320 -3.013 4.889
225 3HZ LYS 32 3HZ LYS 32 -7.817 -2.898 5.683
226 H TYR 33 H TYR 33 -4.357 -4.222 3.452
227 HA TYR 33 HA TYR 33 -2.723 -6.134 1.937
228 1HB TYR 33 2HB TYR 33 -3.536 -6.173 4.415
229 2HB TYR 33 1HB TYR 33 -5.055 -6.770 3.746
230 HD1 TYR 33 HD1 TYR 33 -5.300 -9.044 3.168
231 HD2 TYR 33 HD2 TYR 33 -1.369 -7.419 3.770
232 HE1 TYR 33 HE1 TYR 33 -4.331 -11.321 2.996
233 HE2 TYR 33 HE2 TYR 33 -0.401 -9.695 3.597
234 HH TYR 33 HH TYR 33 -1.804 -12.328 4.061
235 H GLU 34 H GLU 34 -3.755 -7.928 0.704
236 HA GLU 34 HA GLU 34 -6.391 -7.172 -0.512
237 1HB GLU 34 2HB GLU 34 -5.289 -8.069 -2.679
238 2HB GLU 34 1HB GLU 34 -4.773 -6.486 -2.106
239 1HG GLU 34 2HG GLU 34 -2.799 -7.752 -2.724
240 2HG GLU 34 1HG GLU 34 -2.824 -7.602 -0.969
241 H ILE 35 H ILE 35 -6.969 -9.227 -2.071
242 HA ILE 35 HA ILE 35 -6.600 -11.697 -0.407
243 HB ILE 35 HB ILE 35 -8.822 -10.509 -0.207
244 1HG1 ILE 35 2HG1 ILE 35 -9.360 -13.115 -1.576
245 2HG1 ILE 35 1HG1 ILE 35 -8.317 -13.128 -0.153
246 1HG2 ILE 35 1HG2 ILE 35 -10.354 -10.513 -2.066
247 2HG2 ILE 35 2HG2 ILE 35 -9.234 -11.445 -3.060
248 3HG2 ILE 35 3HG2 ILE 35 -8.854 -9.777 -2.630
249 1HD1 ILE 35 1HD1 ILE 35 -10.613 -13.470 0.566
250 2HD1 ILE 35 2HD1 ILE 35 -11.139 -12.036 -0.316
251 3HD1 ILE 35 3HD1 ILE 35 -10.090 -11.869 1.092
252 1HN NH2 36 1HN NH2 36 -6.618 -13.754 -3.486
253 2HN NH2 36 2HN NH2 36 -7.689 -13.678 -2.069
Start of MODEL 15
1 1H GLU 1 1H GLU 1 -13.501 0.844 4.319
2 2H GLU 1 2H GLU 1 -14.645 1.998 4.815
3 3H GLU 1 3H GLU 1 -13.443 1.470 5.895
4 HA GLU 1 HA GLU 1 -12.979 3.044 3.408
5 1HB GLU 1 2HB GLU 1 -13.797 3.695 6.077
6 2HB GLU 1 1HB GLU 1 -12.150 4.283 5.852
7 1HG GLU 1 2HG GLU 1 -13.322 6.081 4.992
8 2HG GLU 1 1HG GLU 1 -13.137 5.119 3.526
9 H CYS 2 H CYS 2 -11.068 2.260 2.587
10 HA CYS 2 HA CYS 2 -8.729 2.043 4.421
11 1HB CYS 2 2HB CYS 2 -8.215 -0.187 3.587
12 2HB CYS 2 1HB CYS 2 -9.875 -0.188 4.179
13 H LEU 3 H LEU 3 -6.662 1.793 3.068
14 HA LEU 3 HA LEU 3 -6.790 3.659 0.775
15 1HB LEU 3 2HB LEU 3 -4.506 2.271 2.219
16 2HB LEU 3 1HB LEU 3 -4.306 3.519 0.994
17 HG LEU 3 HG LEU 3 -6.046 4.059 3.385
18 1HD1 LEU 3 1HD1 LEU 3 -4.233 4.634 4.758
19 2HD1 LEU 3 2HD1 LEU 3 -3.105 4.701 3.404
20 3HD1 LEU 3 3HD1 LEU 3 -3.675 3.142 3.999
21 1HD2 LEU 3 1HD2 LEU 3 -4.262 5.760 1.610
22 2HD2 LEU 3 2HD2 LEU 3 -5.243 6.372 2.941
23 3HD2 LEU 3 3HD2 LEU 3 -6.021 5.665 1.525
24 H GLY 4 H GLY 4 -7.353 2.703 -1.156
25 1HA GLY 4 2HA GLY 4 -6.795 -0.089 -1.750
26 2HA GLY 4 1HA GLY 4 -7.479 1.089 -2.869
27 H PHE 5 H PHE 5 -5.866 -0.222 -4.286
28 HA PHE 5 HA PHE 5 -3.037 0.100 -4.041
29 1HB PHE 5 2HB PHE 5 -4.289 -1.508 -5.498
30 2HB PHE 5 1HB PHE 5 -4.746 -0.158 -6.537
31 HD1 PHE 5 HD1 PHE 5 -1.791 -1.958 -5.127
32 HD2 PHE 5 HD2 PHE 5 -3.279 0.637 -8.212
33 HE1 PHE 5 HE1 PHE 5 0.370 -2.142 -6.327
34 HE2 PHE 5 HE2 PHE 5 -1.116 0.451 -9.410
35 HZ PHE 5 HZ PHE 5 0.708 -0.938 -8.467
36 H GLY 6 H GLY 6 -1.773 1.894 -4.349
37 1HA GLY 6 2HA GLY 6 -1.076 3.820 -5.659
38 2HA GLY 6 1HA GLY 6 -2.754 4.062 -6.139
39 H LYS 7 H LYS 7 -3.681 3.661 -3.285
40 HA LYS 7 HA LYS 7 -3.690 6.406 -2.454
41 1HB LYS 7 2HB LYS 7 -4.417 3.742 -1.258
42 2HB LYS 7 1HB LYS 7 -4.475 5.188 -0.253
43 1HG LYS 7 2HG LYS 7 -5.719 5.570 -2.883
44 2HG LYS 7 1HG LYS 7 -6.507 4.322 -1.919
45 1HD LYS 7 2HD LYS 7 -7.359 5.832 -0.468
46 2HD LYS 7 1HD LYS 7 -5.822 6.689 -0.340
47 1HE LYS 7 2HE LYS 7 -6.649 8.336 -1.654
48 2HE LYS 7 1HE LYS 7 -6.874 7.163 -2.967
49 1HZ LYS 7 1HZ LYS 7 -8.991 8.144 -2.283
50 2HZ LYS 7 2HZ LYS 7 -8.751 7.586 -0.697
51 3HZ LYS 7 3HZ LYS 7 -8.960 6.478 -1.969
52 H GLY 8 H GLY 8 -2.246 7.542 -1.203
53 1HA GLY 8 2HA GLY 8 0.342 6.474 -0.583
54 2HA GLY 8 1HA GLY 8 -0.281 8.020 -0.016
55 H CYS 9 H CYS 9 1.199 5.716 1.345
56 HA CYS 9 HA CYS 9 -0.503 5.676 3.788
57 1HB CYS 9 2HB CYS 9 0.045 3.164 3.927
58 2HB CYS 9 1HB CYS 9 -1.147 3.639 2.720
59 H ASN 10 H ASN 10 1.003 4.158 5.444
60 HA ASN 10 HA ASN 10 3.660 5.540 5.443
61 1HB ASN 10 2HB ASN 10 1.906 4.315 7.592
62 2HB ASN 10 1HB ASN 10 3.530 4.923 7.907
63 1HD2 ASN 10 1HD2 ASN 10 0.207 5.874 7.256
64 2HD2 ASN 10 2HD2 ASN 10 0.452 7.544 7.431
65 HA PRO 11 HA PRO 11 5.568 1.624 4.665
66 1HB PRO 11 2HB PRO 11 8.071 2.178 5.643
67 2HB PRO 11 1HB PRO 11 7.476 2.793 4.087
68 1HG PRO 11 2HG PRO 11 7.627 4.167 6.729
69 2HG PRO 11 1HG PRO 11 7.990 4.790 5.112
70 1HD PRO 11 2HD PRO 11 5.672 5.337 6.397
71 2HD PRO 11 1HD PRO 11 5.780 5.206 4.627
72 H SER 12 H SER 12 6.038 3.115 7.886
73 HA SER 12 HA SER 12 6.521 0.512 9.172
74 1HB SER 12 2HB SER 12 6.224 3.379 10.090
75 2HB SER 12 1HB SER 12 6.448 2.052 11.226
76 HG SER 12 HG SER 12 8.207 3.158 9.365
77 H ASN 13 H ASN 13 3.913 2.927 9.010
78 HA ASN 13 HA ASN 13 2.080 0.971 10.363
79 1HB ASN 13 2HB ASN 13 2.689 3.295 11.357
80 2HB ASN 13 1HB ASN 13 1.666 3.953 10.080
81 1HD2 ASN 13 1HD2 ASN 13 -0.646 3.590 10.228
82 2HD2 ASN 13 2HD2 ASN 13 -1.365 2.931 11.617
83 H ASP 14 H ASP 14 2.189 0.201 7.888
84 HA ASP 14 HA ASP 14 0.775 1.732 5.894
85 1HB ASP 14 2HB ASP 14 2.289 -0.022 5.251
86 2HB ASP 14 1HB ASP 14 1.446 -1.203 6.253
87 H GLN 15 H GLN 15 -1.361 2.253 6.053
88 HA GLN 15 HA GLN 15 -3.219 0.355 7.434
89 1HB GLN 15 2HB GLN 15 -2.907 3.286 7.171
90 2HB GLN 15 1HB GLN 15 -4.574 2.717 7.071
91 1HG GLN 15 2HG GLN 15 -2.707 1.792 9.260
92 2HG GLN 15 1HG GLN 15 -3.679 3.256 9.421
93 1HE2 GLN 15 1HE2 GLN 15 -6.110 2.954 9.168
94 2HE2 GLN 15 2HE2 GLN 15 -6.791 1.467 9.623
95 H CYS 16 H CYS 16 -2.371 -0.213 4.745
96 HA CYS 16 HA CYS 16 -4.370 0.734 2.838
97 1HB CYS 16 2HB CYS 16 -1.974 -0.985 2.935
98 2HB CYS 16 1HB CYS 16 -3.183 -1.507 1.764
99 H CYS 17 H CYS 17 -5.657 -1.026 1.591
100 HA CYS 17 HA CYS 17 -7.443 -2.370 3.430
101 1HB CYS 17 2HB CYS 17 -7.383 -1.554 0.742
102 2HB CYS 17 1HB CYS 17 -7.523 -3.310 0.672
103 H LYS 18 H LYS 18 -6.680 -4.115 4.572
104 HA LYS 18 HA LYS 18 -4.586 -5.892 3.688
105 1HB LYS 18 2HB LYS 18 -6.611 -5.746 5.894
106 2HB LYS 18 1HB LYS 18 -5.746 -7.265 5.653
107 1HG LYS 18 2HG LYS 18 -3.611 -5.770 5.594
108 2HG LYS 18 1HG LYS 18 -4.635 -4.559 6.367
109 1HD LYS 18 2HD LYS 18 -4.801 -5.747 8.326
110 2HD LYS 18 1HD LYS 18 -4.722 -7.307 7.509
111 1HE LYS 18 2HE LYS 18 -2.261 -5.620 7.382
112 2HE LYS 18 1HE LYS 18 -2.649 -6.362 8.946
113 1HZ LYS 18 1HZ LYS 18 -1.360 -7.871 7.535
114 2HZ LYS 18 2HZ LYS 18 -2.566 -7.796 6.340
115 3HZ LYS 18 3HZ LYS 18 -2.905 -8.493 7.853
116 H SER 19 H SER 19 -8.073 -5.894 3.230
117 HA SER 19 HA SER 19 -8.520 -8.654 2.669
118 1HB SER 19 2HB SER 19 -10.146 -6.686 2.990
119 2HB SER 19 1HB SER 19 -9.844 -6.303 1.298
120 HG SER 19 HG SER 19 -11.317 -8.323 2.426
121 H SER 20 H SER 20 -7.247 -6.029 0.630
122 HA SER 20 HA SER 20 -7.190 -7.786 -1.762
123 1HB SER 20 2HB SER 20 -6.536 -4.890 -1.176
124 2HB SER 20 1HB SER 20 -6.257 -5.621 -2.755
125 HG SER 20 HG SER 20 -8.344 -5.649 -3.107
126 H ASN 21 H ASN 21 -5.236 -7.529 0.898
127 HA ASN 21 HA ASN 21 -2.990 -8.065 1.330
128 1HB ASN 21 2HB ASN 21 -3.972 -9.591 -0.879
129 2HB ASN 21 1HB ASN 21 -2.294 -9.177 -1.224
130 1HD2 ASN 21 1HD2 ASN 21 -0.730 -9.597 0.712
131 2HD2 ASN 21 2HD2 ASN 21 -1.031 -10.982 1.647
132 H LEU 22 H LEU 22 -3.007 -5.488 0.950
133 HA LEU 22 HA LEU 22 -0.994 -4.871 -1.195
134 1HB LEU 22 2HB LEU 22 -3.209 -3.235 0.080
135 2HB LEU 22 1HB LEU 22 -2.004 -2.554 -1.013
136 HG LEU 22 HG LEU 22 -3.800 -4.885 -1.739
137 1HD1 LEU 22 1HD1 LEU 22 -4.167 -2.211 -2.985
138 2HD1 LEU 22 2HD1 LEU 22 -4.726 -2.377 -1.321
139 3HD1 LEU 22 3HD1 LEU 22 -5.367 -3.437 -2.576
140 1HD2 LEU 22 1HD2 LEU 22 -1.822 -3.151 -3.233
141 2HD2 LEU 22 2HD2 LEU 22 -3.069 -4.070 -4.076
142 3HD2 LEU 22 3HD2 LEU 22 -1.855 -4.910 -3.111
143 H VAL 23 H VAL 23 0.798 -3.578 -0.584
144 HA VAL 23 HA VAL 23 1.082 -3.002 2.351
145 HB VAL 23 HB VAL 23 3.479 -3.694 2.047
146 1HG1 VAL 23 1HG1 VAL 23 3.042 -6.062 2.092
147 2HG1 VAL 23 2HG1 VAL 23 1.543 -5.858 1.186
148 3HG1 VAL 23 3HG1 VAL 23 1.661 -5.260 2.841
149 1HG2 VAL 23 1HG2 VAL 23 2.558 -4.797 -0.622
150 2HG2 VAL 23 2HG2 VAL 23 4.196 -4.783 0.031
151 3HG2 VAL 23 3HG2 VAL 23 3.434 -3.274 -0.469
152 H CYS 24 H CYS 24 2.769 -1.290 2.776
153 HA CYS 24 HA CYS 24 2.509 0.894 0.799
154 1HB CYS 24 2HB CYS 24 2.342 0.830 3.471
155 2HB CYS 24 1HB CYS 24 4.073 1.129 3.335
156 H SER 25 H SER 25 4.208 1.703 -0.414
157 HA SER 25 HA SER 25 6.753 0.149 -0.383
158 1HB SER 25 2HB SER 25 7.007 1.132 -2.628
159 2HB SER 25 1HB SER 25 5.415 0.398 -2.462
160 HG SER 25 HG SER 25 5.610 2.640 -3.359
161 H ARG 26 H ARG 26 8.727 1.625 -1.014
162 HA ARG 26 HA ARG 26 8.775 3.926 0.897
163 1HB ARG 26 2HB ARG 26 10.758 1.966 -0.229
164 2HB ARG 26 1HB ARG 26 11.333 3.500 0.421
165 1HG ARG 26 2HG ARG 26 11.124 2.718 2.520
166 2HG ARG 26 1HG ARG 26 9.411 2.399 2.247
167 1HD ARG 26 2HD ARG 26 10.331 0.265 2.788
168 2HD ARG 26 1HD ARG 26 10.225 0.249 1.017
169 HE ARG 26 HE ARG 26 12.626 0.798 0.932
170 1HH1 ARG 26 1HH2 ARG 26 12.732 -1.729 2.406
171 2HH1 ARG 26 2HH2 ARG 26 13.624 -1.326 3.835
172 1HH2 ARG 26 2HH1 ARG 26 13.161 2.100 3.477
173 2HH2 ARG 26 1HH1 ARG 26 13.867 0.847 4.444
174 H LYS 27 H LYS 27 9.502 3.030 -2.474
175 HA LYS 27 HA LYS 27 10.678 5.534 -3.271
176 1HB LYS 27 2HB LYS 27 9.563 3.076 -4.514
177 2HB LYS 27 1HB LYS 27 9.623 4.501 -5.551
178 1HG LYS 27 2HG LYS 27 11.767 3.839 -5.937
179 2HG LYS 27 1HG LYS 27 12.088 4.618 -4.387
180 1HD LYS 27 2HD LYS 27 12.959 2.565 -3.866
181 2HD LYS 27 1HD LYS 27 11.272 2.191 -3.510
182 1HE LYS 27 2HE LYS 27 11.016 0.895 -5.408
183 2HE LYS 27 1HE LYS 27 12.177 1.856 -6.344
184 1HZ LYS 27 1HZ LYS 27 12.875 0.070 -4.069
185 2HZ LYS 27 2HZ LYS 27 13.970 0.971 -5.006
186 3HZ LYS 27 3HZ LYS 27 13.100 -0.309 -5.706
187 H HIS 28 H HIS 28 7.351 4.268 -3.589
188 HA HIS 28 HA HIS 28 6.412 6.994 -4.369
189 1HB HIS 28 2HB HIS 28 5.272 4.195 -4.536
190 2HB HIS 28 1HB HIS 28 4.320 5.627 -4.924
191 HD1 HIS 28 HD1 HIS 28 6.129 7.345 -6.531
192 HD2 HIS 28 HD2 HIS 28 6.172 3.196 -6.944
193 HE1 HIS 28 HE1 HIS 28 7.121 6.863 -8.809
194 H ALA 29 H ALA 29 6.522 4.904 -1.630
195 HA ALA 29 HA ALA 29 5.487 4.992 0.484
196 1HB ALA 29 1HB ALA 29 5.372 7.186 1.325
197 2HB ALA 29 2HB ALA 29 4.803 7.843 -0.208
198 3HB ALA 29 3HB ALA 29 6.488 7.354 -0.030
199 H TRP 30 H TRP 30 3.804 3.987 -1.570
200 HA TRP 30 HA TRP 30 1.146 4.829 -0.525
201 1HB TRP 30 2HB TRP 30 0.269 5.089 -2.760
202 2HB TRP 30 1HB TRP 30 1.712 6.079 -2.616
203 HD1 TRP 30 HD1 TRP 30 3.202 2.862 -2.929
204 HE1 TRP 30 HE1 TRP 30 3.733 2.253 -5.373
205 HE3 TRP 30 HE3 TRP 30 0.310 6.297 -5.323
206 HZ2 TRP 30 HZ2 TRP 30 3.017 3.111 -8.009
207 HZ3 TRP 30 HZ3 TRP 30 0.245 6.387 -7.803
208 HH2 TRP 30 HH2 TRP 30 1.595 4.798 -9.147
209 H CYS 31 H CYS 31 -0.539 3.212 -1.809
210 HA CYS 31 HA CYS 31 0.079 0.574 -0.789
211 1HB CYS 31 2HB CYS 31 -2.159 2.041 -1.441
212 2HB CYS 31 1HB CYS 31 -2.106 0.856 -2.745
213 H LYS 32 H LYS 32 1.181 -1.018 -1.821
214 HA LYS 32 HA LYS 32 1.347 -0.965 -4.818
215 1HB LYS 32 2HB LYS 32 3.376 -0.854 -2.713
216 2HB LYS 32 1HB LYS 32 3.661 -2.186 -3.833
217 1HG LYS 32 2HG LYS 32 2.906 0.412 -5.060
218 2HG LYS 32 1HG LYS 32 4.502 0.339 -4.313
219 1HD LYS 32 2HD LYS 32 5.130 -0.524 -6.330
220 2HD LYS 32 1HD LYS 32 4.483 -2.024 -5.668
221 1HE LYS 32 2HE LYS 32 3.346 -1.884 -7.723
222 2HE LYS 32 1HE LYS 32 2.189 -1.101 -6.630
223 1HZ LYS 32 1HZ LYS 32 2.642 0.284 -8.575
224 2HZ LYS 32 2HZ LYS 32 4.298 0.298 -8.196
225 3HZ LYS 32 3HZ LYS 32 3.178 1.038 -7.154
226 H TYR 33 H TYR 33 2.034 -3.211 -5.652
227 HA TYR 33 HA TYR 33 0.481 -5.296 -4.179
228 1HB TYR 33 2HB TYR 33 0.724 -4.429 -6.888
229 2HB TYR 33 1HB TYR 33 1.346 -6.078 -6.805
230 HD1 TYR 33 HD1 TYR 33 -1.604 -3.982 -6.699
231 HD2 TYR 33 HD2 TYR 33 -0.081 -7.882 -5.741
232 HE1 TYR 33 HE1 TYR 33 -3.922 -4.850 -6.547
233 HE2 TYR 33 HE2 TYR 33 -2.399 -8.751 -5.590
234 HH TYR 33 HH TYR 33 -4.903 -7.220 -5.070
235 H GLU 34 H GLU 34 1.426 -7.345 -3.771
236 HA GLU 34 HA GLU 34 4.314 -7.343 -3.317
237 1HB GLU 34 2HB GLU 34 3.834 -9.524 -2.304
238 2HB GLU 34 1HB GLU 34 2.602 -8.365 -1.810
239 1HG GLU 34 2HG GLU 34 1.851 -9.680 -4.293
240 2HG GLU 34 1HG GLU 34 2.160 -10.860 -3.021
241 H ILE 35 H ILE 35 5.687 -9.199 -4.125
242 HA ILE 35 HA ILE 35 5.413 -9.476 -7.036
243 HB ILE 35 HB ILE 35 7.406 -10.500 -4.983
244 1HG1 ILE 35 2HG1 ILE 35 8.038 -8.448 -7.063
245 2HG1 ILE 35 1HG1 ILE 35 7.031 -7.941 -5.707
246 1HG2 ILE 35 1HG2 ILE 35 7.543 -11.982 -6.866
247 2HG2 ILE 35 2HG2 ILE 35 8.864 -10.828 -7.046
248 3HG2 ILE 35 3HG2 ILE 35 7.399 -10.646 -8.009
249 1HD1 ILE 35 1HD1 ILE 35 9.767 -9.237 -5.517
250 2HD1 ILE 35 2HD1 ILE 35 8.747 -8.829 -4.137
251 3HD1 ILE 35 3HD1 ILE 35 9.385 -7.551 -5.171
252 1HN NH2 36 1HN NH2 36 4.427 -12.811 -7.505
253 2HN NH2 36 2HN NH2 36 5.477 -11.528 -8.144
Start of MODEL 16
1 1H GLU 1 1H GLU 1 12.530 5.504 -2.216
2 2H GLU 1 2H GLU 1 12.921 4.331 -1.051
3 3H GLU 1 3H GLU 1 13.836 5.759 -1.164
4 HA GLU 1 HA GLU 1 12.332 5.884 0.732
5 1HB GLU 1 2HB GLU 1 12.008 7.600 -1.724
6 2HB GLU 1 1HB GLU 1 11.091 7.977 -0.264
7 1HG GLU 1 2HG GLU 1 12.904 8.933 0.660
8 2HG GLU 1 1HG GLU 1 13.813 7.432 0.474
9 H CYS 2 H CYS 2 10.847 4.161 1.091
10 HA CYS 2 HA CYS 2 8.126 4.605 0.003
11 1HB CYS 2 2HB CYS 2 7.996 2.270 -0.799
12 2HB CYS 2 1HB CYS 2 9.279 3.148 -1.625
13 H LEU 3 H LEU 3 6.521 3.161 1.141
14 HA LEU 3 HA LEU 3 7.307 2.819 3.993
15 1HB LEU 3 2HB LEU 3 4.664 2.899 2.503
16 2HB LEU 3 1HB LEU 3 4.798 2.679 4.247
17 HG LEU 3 HG LEU 3 6.076 5.025 2.831
18 1HD1 LEU 3 1HD1 LEU 3 3.848 5.461 2.313
19 2HD1 LEU 3 2HD1 LEU 3 3.971 6.207 3.907
20 3HD1 LEU 3 3HD1 LEU 3 3.244 4.609 3.735
21 1HD2 LEU 3 1HD2 LEU 3 5.251 4.455 5.697
22 2HD2 LEU 3 2HD2 LEU 3 5.887 6.001 5.133
23 3HD2 LEU 3 3HD2 LEU 3 6.900 4.558 5.080
24 H GLY 4 H GLY 4 6.798 0.834 5.125
25 1HA GLY 4 2HA GLY 4 7.118 -1.568 3.473
26 2HA GLY 4 1HA GLY 4 7.076 -1.519 5.235
27 H PHE 5 H PHE 5 5.657 -3.488 4.769
28 HA PHE 5 HA PHE 5 2.977 -3.069 3.701
29 1HB PHE 5 2HB PHE 5 3.980 -5.237 3.532
30 2HB PHE 5 1HB PHE 5 4.396 -5.255 5.245
31 HD1 PHE 5 HD1 PHE 5 2.890 -6.116 6.854
32 HD2 PHE 5 HD2 PHE 5 1.495 -5.237 2.887
33 HE1 PHE 5 HE1 PHE 5 0.722 -7.199 7.375
34 HE2 PHE 5 HE2 PHE 5 -0.671 -6.320 3.410
35 HZ PHE 5 HZ PHE 5 -1.060 -7.301 5.653
36 H GLY 6 H GLY 6 1.051 -2.809 4.874
37 1HA GLY 6 2HA GLY 6 -0.350 -2.400 6.713
38 2HA GLY 6 1HA GLY 6 0.948 -2.941 7.775
39 H LYS 7 H LYS 7 1.138 -0.323 5.385
40 HA LYS 7 HA LYS 7 1.666 1.591 7.634
41 1HB LYS 7 2HB LYS 7 2.806 1.129 4.897
42 2HB LYS 7 1HB LYS 7 2.812 2.774 5.534
43 1HG LYS 7 2HG LYS 7 3.755 0.583 7.336
44 2HG LYS 7 1HG LYS 7 4.823 1.087 6.026
45 1HD LYS 7 2HD LYS 7 5.432 2.896 7.214
46 2HD LYS 7 1HD LYS 7 3.755 3.445 7.238
47 1HE LYS 7 2HE LYS 7 3.303 2.159 9.259
48 2HE LYS 7 1HE LYS 7 4.922 1.435 9.200
49 1HZ LYS 7 1HZ LYS 7 4.344 4.347 9.398
50 2HZ LYS 7 2HZ LYS 7 5.889 3.641 9.349
51 3HZ LYS 7 3HZ LYS 7 4.867 3.365 10.678
52 H GLY 8 H GLY 8 -0.075 2.933 7.911
53 1HA GLY 8 2HA GLY 8 -2.240 3.226 6.113
54 2HA GLY 8 1HA GLY 8 -1.869 4.359 7.410
55 H CYS 9 H CYS 9 -2.050 4.005 4.070
56 HA CYS 9 HA CYS 9 -0.607 6.594 3.671
57 1HB CYS 9 2HB CYS 9 0.874 5.621 2.244
58 2HB CYS 9 1HB CYS 9 0.371 4.102 2.973
59 H ASN 10 H ASN 10 -1.136 7.171 1.114
60 HA ASN 10 HA ASN 10 -4.084 7.396 1.042
61 1HB ASN 10 2HB ASN 10 -1.728 8.595 -0.412
62 2HB ASN 10 1HB ASN 10 -3.364 8.829 -1.024
63 1HD2 ASN 10 1HD2 ASN 10 -2.607 11.204 -0.405
64 2HD2 ASN 10 2HD2 ASN 10 -3.000 11.710 1.167
65 HA PRO 11 HA PRO 11 -4.438 4.006 -1.816
66 1HB PRO 11 2HB PRO 11 -7.031 4.462 -2.576
67 2HB PRO 11 1HB PRO 11 -6.593 3.728 -1.019
68 1HG PRO 11 2HG PRO 11 -7.366 6.538 -1.635
69 2HG PRO 11 1HG PRO 11 -7.804 5.524 -0.250
70 1HD PRO 11 2HD PRO 11 -5.890 7.447 -0.127
71 2HD PRO 11 1HD PRO 11 -5.853 5.975 0.869
72 H SER 12 H SER 12 -5.562 7.276 -2.728
73 HA SER 12 HA SER 12 -5.485 6.847 -5.584
74 1HB SER 12 2HB SER 12 -6.734 8.632 -4.318
75 2HB SER 12 1HB SER 12 -5.188 9.406 -3.978
76 HG SER 12 HG SER 12 -6.639 9.232 -6.338
77 H ASN 13 H ASN 13 -3.175 8.243 -3.255
78 HA ASN 13 HA ASN 13 -1.053 8.122 -5.374
79 1HB ASN 13 2HB ASN 13 -1.806 10.353 -4.349
80 2HB ASN 13 1HB ASN 13 -1.076 9.793 -2.844
81 1HD2 ASN 13 1HD2 ASN 13 1.074 10.421 -2.603
82 2HD2 ASN 13 2HD2 ASN 13 2.146 10.742 -3.880
83 H ASP 14 H ASP 14 -1.124 5.726 -4.539
84 HA ASP 14 HA ASP 14 0.009 5.194 -1.898
85 1HB ASP 14 2HB ASP 14 -1.493 3.595 -2.856
86 2HB ASP 14 1HB ASP 14 -0.603 3.566 -4.377
87 H GLN 15 H GLN 15 2.146 5.441 -1.443
88 HA GLN 15 HA GLN 15 4.139 5.068 -3.658
89 1HB GLN 15 2HB GLN 15 3.837 7.017 -1.396
90 2HB GLN 15 1HB GLN 15 5.464 6.621 -1.950
91 1HG GLN 15 2HG GLN 15 3.459 7.225 -4.064
92 2HG GLN 15 1HG GLN 15 3.985 8.584 -3.070
93 1HE2 GLN 15 1HE2 GLN 15 5.230 5.983 -5.209
94 2HE2 GLN 15 2HE2 GLN 15 6.682 6.776 -5.583
95 H CYS 16 H CYS 16 3.138 2.893 -2.028
96 HA CYS 16 HA CYS 16 4.902 2.311 0.193
97 1HB CYS 16 2HB CYS 16 2.548 1.358 -0.757
98 2HB CYS 16 1HB CYS 16 3.641 0.124 -1.384
99 H CYS 17 H CYS 17 6.298 0.197 0.061
100 HA CYS 17 HA CYS 17 8.406 0.600 -1.873
101 1HB CYS 17 2HB CYS 17 7.727 -1.667 0.030
102 2HB CYS 17 1HB CYS 17 9.258 -1.527 -0.833
103 H LYS 18 H LYS 18 8.245 0.039 -3.994
104 HA LYS 18 HA LYS 18 6.223 -1.784 -5.009
105 1HB LYS 18 2HB LYS 18 8.661 -0.453 -6.231
106 2HB LYS 18 1HB LYS 18 7.444 -1.325 -7.162
107 1HG LYS 18 2HG LYS 18 6.855 1.050 -5.368
108 2HG LYS 18 1HG LYS 18 7.039 1.141 -7.119
109 1HD LYS 18 2HD LYS 18 5.223 -0.888 -6.900
110 2HD LYS 18 1HD LYS 18 4.780 0.110 -5.514
111 1HE LYS 18 2HE LYS 18 5.129 2.024 -7.455
112 2HE LYS 18 1HE LYS 18 4.471 0.672 -8.397
113 1HZ LYS 18 1HZ LYS 18 2.664 1.923 -7.439
114 2HZ LYS 18 2HZ LYS 18 3.337 1.791 -5.885
115 3HZ LYS 18 3HZ LYS 18 2.748 0.409 -6.680
116 H SER 19 H SER 19 9.433 -2.254 -3.781
117 HA SER 19 HA SER 19 10.363 -4.468 -5.288
118 1HB SER 19 2HB SER 19 11.636 -4.950 -3.177
119 2HB SER 19 1HB SER 19 11.711 -3.259 -3.661
120 HG SER 19 HG SER 19 11.201 -3.714 -1.385
121 H SER 20 H SER 20 8.109 -4.376 -2.517
122 HA SER 20 HA SER 20 7.725 -7.329 -2.735
123 1HB SER 20 2HB SER 20 8.181 -5.816 -0.591
124 2HB SER 20 1HB SER 20 6.437 -5.588 -0.663
125 HG SER 20 HG SER 20 6.139 -7.660 -0.214
126 H ASN 21 H ASN 21 6.488 -4.900 -4.417
127 HA ASN 21 HA ASN 21 4.413 -4.401 -5.417
128 1HB ASN 21 2HB ASN 21 4.103 -7.350 -4.754
129 2HB ASN 21 1HB ASN 21 3.129 -6.470 -5.932
130 1HD2 ASN 21 1HD2 ASN 21 4.413 -5.430 -7.793
131 2HD2 ASN 21 2HD2 ASN 21 5.816 -6.223 -8.325
132 H LEU 22 H LEU 22 3.944 -3.085 -3.378
133 HA LEU 22 HA LEU 22 1.668 -4.285 -1.826
134 1HB LEU 22 2HB LEU 22 3.918 -2.395 -1.126
135 2HB LEU 22 1HB LEU 22 2.473 -2.503 -0.120
136 HG LEU 22 HG LEU 22 4.039 -4.964 -0.909
137 1HD1 LEU 22 1HD1 LEU 22 4.429 -3.191 1.523
138 2HD1 LEU 22 2HD1 LEU 22 5.603 -3.465 0.235
139 3HD1 LEU 22 3HD1 LEU 22 5.151 -4.787 1.312
140 1HD2 LEU 22 1HD2 LEU 22 2.967 -5.789 1.226
141 2HD2 LEU 22 2HD2 LEU 22 1.815 -5.391 -0.048
142 3HD2 LEU 22 3HD2 LEU 22 2.069 -4.273 1.293
143 H VAL 23 H VAL 23 -0.257 -3.187 -1.924
144 HA VAL 23 HA VAL 23 -0.261 -0.442 -3.146
145 HB VAL 23 HB VAL 23 -2.493 -1.150 -4.085
146 1HG1 VAL 23 1HG1 VAL 23 -0.198 -2.982 -4.840
147 2HG1 VAL 23 2HG1 VAL 23 -0.354 -1.308 -5.375
148 3HG1 VAL 23 3HG1 VAL 23 -1.551 -2.506 -5.867
149 1HG2 VAL 23 1HG2 VAL 23 -3.171 -3.456 -3.997
150 2HG2 VAL 23 2HG2 VAL 23 -2.821 -2.977 -2.337
151 3HG2 VAL 23 3HG2 VAL 23 -1.653 -3.939 -3.242
152 H CYS 24 H CYS 24 -1.748 1.060 -2.205
153 HA CYS 24 HA CYS 24 -2.418 0.544 0.594
154 1HB CYS 24 2HB CYS 24 -1.933 2.753 -1.107
155 2HB CYS 24 1HB CYS 24 -3.582 2.946 -0.512
156 H SER 25 H SER 25 -4.367 -0.145 1.363
157 HA SER 25 HA SER 25 -6.522 -0.849 -0.496
158 1HB SER 25 2HB SER 25 -5.591 -2.009 1.678
159 2HB SER 25 1HB SER 25 -6.689 -0.910 2.509
160 HG SER 25 HG SER 25 -7.259 -3.191 1.306
161 H ARG 26 H ARG 26 -8.814 -0.169 0.007
162 HA ARG 26 HA ARG 26 -8.934 2.760 0.463
163 1HB ARG 26 2HB ARG 26 -10.871 0.645 -0.525
164 2HB ARG 26 1HB ARG 26 -11.312 2.343 -0.349
165 1HG ARG 26 2HG ARG 26 -9.248 2.848 -1.811
166 2HG ARG 26 1HG ARG 26 -9.262 1.129 -2.206
167 1HD ARG 26 2HD ARG 26 -11.751 2.830 -2.499
168 2HD ARG 26 1HD ARG 26 -10.565 2.672 -3.809
169 HE ARG 26 HE ARG 26 -10.904 0.165 -3.603
170 1HH1 ARG 26 2HH1 ARG 26 -13.356 1.468 -4.781
171 2HH1 ARG 26 1HH1 ARG 26 -14.623 0.770 -3.829
172 1HH2 ARG 26 1HH2 ARG 26 -12.486 -0.347 -1.327
173 2HH2 ARG 26 2HH2 ARG 26 -14.128 -0.259 -1.869
174 H LYS 27 H LYS 27 -10.589 -0.188 1.683
175 HA LYS 27 HA LYS 27 -11.987 1.197 3.811
176 1HB LYS 27 2HB LYS 27 -11.536 -1.563 2.826
177 2HB LYS 27 1HB LYS 27 -11.919 -1.435 4.542
178 1HG LYS 27 2HG LYS 27 -14.088 -1.245 3.961
179 2HG LYS 27 1HG LYS 27 -13.699 0.330 3.271
180 1HD LYS 27 2HD LYS 27 -12.871 -1.186 1.231
181 2HD LYS 27 1HD LYS 27 -14.058 -2.302 1.905
182 1HE LYS 27 2HE LYS 27 -14.893 0.556 1.579
183 2HE LYS 27 1HE LYS 27 -14.783 -0.447 0.120
184 1HZ LYS 27 1HZ LYS 27 -16.235 -1.190 2.609
185 2HZ LYS 27 2HZ LYS 27 -16.133 -2.130 1.196
186 3HZ LYS 27 3HZ LYS 27 -16.966 -0.650 1.177
187 H HIS 28 H HIS 28 -8.880 -0.492 3.587
188 HA HIS 28 HA HIS 28 -8.396 -0.205 6.503
189 1HB HIS 28 2HB HIS 28 -6.773 -1.395 4.227
190 2HB HIS 28 1HB HIS 28 -6.359 -1.517 5.936
191 HD1 HIS 28 HD1 HIS 28 -8.587 -2.952 3.334
192 HD2 HIS 28 HD2 HIS 28 -8.198 -3.152 7.479
193 HE1 HIS 28 HE1 HIS 28 -10.003 -4.909 4.093
194 H ALA 29 H ALA 29 -7.552 1.341 3.472
195 HA ALA 29 HA ALA 29 -6.238 3.230 2.979
196 1HB ALA 29 1HB ALA 29 -6.376 3.878 5.916
197 2HB ALA 29 2HB ALA 29 -7.850 3.875 4.948
198 3HB ALA 29 3HB ALA 29 -6.527 4.965 4.535
199 H TRP 30 H TRP 30 -4.745 0.829 3.552
200 HA TRP 30 HA TRP 30 -2.193 2.063 4.418
201 1HB TRP 30 2HB TRP 30 -1.843 0.552 6.216
202 2HB TRP 30 1HB TRP 30 -3.511 1.077 6.394
203 HD1 TRP 30 HD1 TRP 30 -4.414 -0.958 3.870
204 HE1 TRP 30 HE1 TRP 30 -4.762 -3.435 4.477
205 HE3 TRP 30 HE3 TRP 30 -1.829 -1.145 8.257
206 HZ2 TRP 30 HZ2 TRP 30 -4.039 -5.259 6.557
207 HZ3 TRP 30 HZ3 TRP 30 -1.675 -3.262 9.536
208 HH2 TRP 30 HH2 TRP 30 -2.776 -5.318 8.693
209 H CYS 31 H CYS 31 -0.345 0.386 4.094
210 HA CYS 31 HA CYS 31 -0.474 -0.634 1.396
211 1HB CYS 31 2HB CYS 31 1.457 -0.833 3.706
212 2HB CYS 31 1HB CYS 31 1.765 -1.683 2.195
213 H LYS 32 H LYS 32 -1.543 -2.465 0.819
214 HA LYS 32 HA LYS 32 -1.484 -4.815 2.680
215 1HB LYS 32 2HB LYS 32 -3.652 -3.338 2.357
216 2HB LYS 32 1HB LYS 32 -3.791 -4.231 0.843
217 1HG LYS 32 2HG LYS 32 -3.336 -6.317 2.428
218 2HG LYS 32 1HG LYS 32 -3.981 -5.230 3.659
219 1HD LYS 32 2HD LYS 32 -6.072 -5.080 2.623
220 2HD LYS 32 1HD LYS 32 -5.436 -5.554 1.049
221 1HE LYS 32 2HE LYS 32 -5.258 -7.530 3.306
222 2HE LYS 32 1HE LYS 32 -6.817 -7.301 2.490
223 1HZ LYS 32 1HZ LYS 32 -4.228 -7.823 1.119
224 2HZ LYS 32 2HZ LYS 32 -5.739 -7.638 0.365
225 3HZ LYS 32 3HZ LYS 32 -5.446 -8.977 1.367
226 H TYR 33 H TYR 33 -1.394 -6.874 1.601
227 HA TYR 33 HA TYR 33 -0.051 -6.838 -0.996
228 1HB TYR 33 2HB TYR 33 -0.357 -8.554 1.263
229 2HB TYR 33 1HB TYR 33 -0.908 -9.453 -0.149
230 HD1 TYR 33 HD1 TYR 33 0.618 -9.447 -2.240
231 HD2 TYR 33 HD2 TYR 33 1.943 -8.283 1.679
232 HE1 TYR 33 HE1 TYR 33 2.973 -9.815 -2.926
233 HE2 TYR 33 HE2 TYR 33 4.297 -8.651 0.992
234 HH TYR 33 HH TYR 33 5.282 -10.402 -1.325
235 H GLU 34 H GLU 34 -0.859 -7.860 -2.928
236 HA GLU 34 HA GLU 34 -3.765 -7.560 -3.314
237 1HB GLU 34 2HB GLU 34 -1.748 -6.900 -4.854
238 2HB GLU 34 1HB GLU 34 -1.767 -8.600 -5.324
239 1HG GLU 34 2HG GLU 34 -3.323 -7.957 -6.848
240 2HG GLU 34 1HG GLU 34 -4.434 -7.941 -5.478
241 H ILE 35 H ILE 35 -4.090 -9.440 -1.693
242 HA ILE 35 HA ILE 35 -4.733 -11.661 -1.277
243 HB ILE 35 HB ILE 35 -4.793 -11.701 -4.316
244 1HG1 ILE 35 2HG1 ILE 35 -7.104 -11.099 -2.458
245 2HG1 ILE 35 1HG1 ILE 35 -6.060 -9.819 -3.074
246 1HG2 ILE 35 1HG2 ILE 35 -5.156 -13.809 -2.583
247 2HG2 ILE 35 2HG2 ILE 35 -5.880 -13.695 -4.187
248 3HG2 ILE 35 3HG2 ILE 35 -6.803 -13.205 -2.767
249 1HD1 ILE 35 1HD1 ILE 35 -7.788 -11.720 -4.670
250 2HD1 ILE 35 2HD1 ILE 35 -6.529 -10.730 -5.409
251 3HD1 ILE 35 3HD1 ILE 35 -7.895 -9.961 -4.601
252 1HN NH2 36 1HN NH2 36 -1.729 -13.433 -1.150
253 2HN NH2 36 2HN NH2 36 -3.261 -12.935 -0.400
Start of MODEL 17
1 1H GLU 1 1H GLU 1 -12.952 7.709 0.899
2 2H GLU 1 2H GLU 1 -12.517 9.266 0.381
3 3H GLU 1 3H GLU 1 -11.559 8.449 1.522
4 HA GLU 1 HA GLU 1 -11.992 7.434 -1.239
5 1HB GLU 1 2HB GLU 1 -9.938 8.569 -1.833
6 2HB GLU 1 1HB GLU 1 -11.004 9.760 -1.091
7 1HG GLU 1 2HG GLU 1 -9.301 10.235 0.316
8 2HG GLU 1 1HG GLU 1 -9.609 8.673 1.072
9 H CYS 2 H CYS 2 -10.112 5.960 -1.780
10 HA CYS 2 HA CYS 2 -8.621 4.799 0.489
11 1HB CYS 2 2HB CYS 2 -10.932 3.804 0.526
12 2HB CYS 2 1HB CYS 2 -10.643 3.178 -1.097
13 H LEU 3 H LEU 3 -6.840 3.531 -0.249
14 HA LEU 3 HA LEU 3 -6.150 3.916 -3.110
15 1HB LEU 3 2HB LEU 3 -4.611 2.863 -0.712
16 2HB LEU 3 1HB LEU 3 -3.910 3.187 -2.296
17 HG LEU 3 HG LEU 3 -5.440 5.363 -0.896
18 1HD1 LEU 3 1HD1 LEU 3 -3.863 4.516 0.792
19 2HD1 LEU 3 2HD1 LEU 3 -3.339 6.089 0.193
20 3HD1 LEU 3 3HD1 LEU 3 -2.545 4.621 -0.374
21 1HD2 LEU 3 1HD2 LEU 3 -4.239 5.223 -3.332
22 2HD2 LEU 3 2HD2 LEU 3 -2.894 5.819 -2.358
23 3HD2 LEU 3 3HD2 LEU 3 -4.406 6.724 -2.421
24 H GLY 4 H GLY 4 -5.634 2.154 -4.503
25 1HA GLY 4 2HA GLY 4 -6.816 -0.452 -3.676
26 2HA GLY 4 1HA GLY 4 -6.567 0.071 -5.341
27 H PHE 5 H PHE 5 -5.325 -1.705 -5.983
28 HA PHE 5 HA PHE 5 -2.923 -2.485 -4.449
29 1HB PHE 5 2HB PHE 5 -4.093 -4.308 -5.344
30 2HB PHE 5 1HB PHE 5 -4.478 -3.455 -6.836
31 HD1 PHE 5 HD1 PHE 5 -1.490 -4.698 -4.916
32 HD2 PHE 5 HD2 PHE 5 -3.262 -3.960 -8.760
33 HE1 PHE 5 HE1 PHE 5 0.479 -5.722 -6.023
34 HE2 PHE 5 HE2 PHE 5 -1.294 -4.985 -9.865
35 HZ PHE 5 HZ PHE 5 0.577 -5.866 -8.496
36 H GLY 6 H GLY 6 -0.884 -1.772 -4.924
37 1HA GLY 6 2HA GLY 6 0.914 -0.845 -6.104
38 2HA GLY 6 1HA GLY 6 -0.027 -1.032 -7.582
39 H LYS 7 H LYS 7 -0.506 0.907 -4.599
40 HA LYS 7 HA LYS 7 -0.726 3.333 -6.354
41 1HB LYS 7 2HB LYS 7 -2.418 2.300 -4.082
42 2HB LYS 7 1HB LYS 7 -2.387 4.025 -4.448
43 1HG LYS 7 2HG LYS 7 -3.033 1.853 -6.466
44 2HG LYS 7 1HG LYS 7 -4.237 2.824 -5.621
45 1HD LYS 7 2HD LYS 7 -2.634 4.794 -6.589
46 2HD LYS 7 1HD LYS 7 -2.431 3.576 -7.849
47 1HE LYS 7 2HE LYS 7 -4.755 3.537 -8.348
48 2HE LYS 7 1HE LYS 7 -5.175 4.357 -6.831
49 1HZ LYS 7 1HZ LYS 7 -5.130 5.854 -8.802
50 2HZ LYS 7 2HZ LYS 7 -3.464 5.560 -8.942
51 3HZ LYS 7 3HZ LYS 7 -4.080 6.329 -7.558
52 H GLY 8 H GLY 8 0.711 4.907 -5.786
53 1HA GLY 8 2HA GLY 8 2.674 4.652 -3.795
54 2HA GLY 8 1HA GLY 8 2.203 6.190 -4.513
55 H CYS 9 H CYS 9 2.664 4.908 -1.623
56 HA CYS 9 HA CYS 9 0.662 6.674 -0.321
57 1HB CYS 9 2HB CYS 9 0.163 4.676 1.246
58 2HB CYS 9 1HB CYS 9 -0.554 4.632 -0.362
59 H ASN 10 H ASN 10 1.110 6.355 2.247
60 HA ASN 10 HA ASN 10 4.042 6.778 2.576
61 1HB ASN 10 2HB ASN 10 1.513 7.679 3.854
62 2HB ASN 10 1HB ASN 10 2.892 7.484 4.935
63 1HD2 ASN 10 1HD2 ASN 10 1.642 9.355 2.208
64 2HD2 ASN 10 2HD2 ASN 10 2.875 10.522 2.213
65 HA PRO 11 HA PRO 11 4.370 2.823 4.543
66 1HB PRO 11 2HB PRO 11 6.782 3.214 5.785
67 2HB PRO 11 1HB PRO 11 6.625 2.897 4.046
68 1HG PRO 11 2HG PRO 11 7.052 5.476 5.470
69 2HG PRO 11 1HG PRO 11 7.738 4.903 3.941
70 1HD PRO 11 2HD PRO 11 5.678 6.678 4.088
71 2HD PRO 11 1HD PRO 11 5.914 5.563 2.723
72 H SER 12 H SER 12 5.060 5.768 6.456
73 HA SER 12 HA SER 12 4.545 4.502 9.031
74 1HB SER 12 2HB SER 12 4.746 6.832 9.827
75 2HB SER 12 1HB SER 12 6.028 6.457 8.678
76 HG SER 12 HG SER 12 5.065 7.692 7.187
77 H ASN 13 H ASN 13 2.635 6.342 6.689
78 HA ASN 13 HA ASN 13 0.189 5.787 8.331
79 1HB ASN 13 2HB ASN 13 1.358 8.303 7.314
80 2HB ASN 13 1HB ASN 13 -0.364 8.121 6.977
81 1HD2 ASN 13 1HD2 ASN 13 -1.842 8.184 8.772
82 2HD2 ASN 13 2HD2 ASN 13 -1.338 8.514 10.359
83 H ASP 14 H ASP 14 0.221 3.875 6.770
84 HA ASP 14 HA ASP 14 -0.434 4.502 3.956
85 1HB ASP 14 2HB ASP 14 -0.269 2.089 3.684
86 2HB ASP 14 1HB ASP 14 1.074 2.626 4.688
87 H GLN 15 H GLN 15 -2.510 4.543 3.158
88 HA GLN 15 HA GLN 15 -4.712 3.587 4.963
89 1HB GLN 15 2HB GLN 15 -4.515 6.008 3.139
90 2HB GLN 15 1HB GLN 15 -6.005 5.504 3.935
91 1HG GLN 15 2HG GLN 15 -5.360 6.694 5.736
92 2HG GLN 15 1HG GLN 15 -4.064 5.523 5.970
93 1HE2 GLN 15 1HE2 GLN 15 -4.050 8.532 6.398
94 2HE2 GLN 15 2HE2 GLN 15 -2.760 9.099 5.452
95 H CYS 16 H CYS 16 -3.741 1.722 3.236
96 HA CYS 16 HA CYS 16 -5.068 1.815 0.619
97 1HB CYS 16 2HB CYS 16 -3.293 -0.012 2.186
98 2HB CYS 16 1HB CYS 16 -4.240 -0.727 0.882
99 H CYS 17 H CYS 17 -6.678 0.134 -0.016
100 HA CYS 17 HA CYS 17 -8.879 -0.054 1.845
101 1HB CYS 17 2HB CYS 17 -8.175 -0.933 -0.908
102 2HB CYS 17 1HB CYS 17 -9.464 -1.840 -0.116
103 H LYS 18 H LYS 18 -9.157 -1.557 3.443
104 HA LYS 18 HA LYS 18 -7.266 -3.705 3.904
105 1HB LYS 18 2HB LYS 18 -9.904 -2.805 5.070
106 2HB LYS 18 1HB LYS 18 -9.115 -4.271 5.653
107 1HG LYS 18 2HG LYS 18 -7.279 -1.994 5.428
108 2HG LYS 18 1HG LYS 18 -8.599 -1.709 6.564
109 1HD LYS 18 2HD LYS 18 -7.997 -4.171 7.359
110 2HD LYS 18 1HD LYS 18 -6.429 -3.769 6.657
111 1HE LYS 18 2HE LYS 18 -5.987 -2.131 8.236
112 2HE LYS 18 1HE LYS 18 -7.704 -1.745 8.466
113 1HZ LYS 18 1HZ LYS 18 -6.247 -4.149 9.422
114 2HZ LYS 18 2HZ LYS 18 -7.943 -4.039 9.413
115 3HZ LYS 18 3HZ LYS 18 -7.024 -2.972 10.363
116 H SER 19 H SER 19 -10.310 -3.506 2.161
117 HA SER 19 HA SER 19 -11.228 -6.176 2.236
118 1HB SER 19 2HB SER 19 -12.266 -4.116 1.179
119 2HB SER 19 1HB SER 19 -11.158 -4.332 -0.171
120 HG SER 19 HG SER 19 -12.415 -5.850 -0.882
121 H SER 20 H SER 20 -8.741 -4.712 0.118
122 HA SER 20 HA SER 20 -8.178 -7.280 -1.216
123 1HB SER 20 2HB SER 20 -7.649 -4.439 -1.560
124 2HB SER 20 1HB SER 20 -6.184 -5.386 -1.799
125 HG SER 20 HG SER 20 -7.059 -6.332 -3.497
126 H ASN 21 H ASN 21 -7.163 -5.732 1.680
127 HA ASN 21 HA ASN 21 -5.487 -6.239 3.245
128 1HB ASN 21 2HB ASN 21 -6.507 -8.551 2.378
129 2HB ASN 21 1HB ASN 21 -4.881 -8.754 1.730
130 1HD2 ASN 21 1HD2 ASN 21 -4.910 -10.595 3.452
131 2HD2 ASN 21 2HD2 ASN 21 -4.426 -10.180 5.025
132 H LEU 22 H LEU 22 -4.381 -4.409 1.941
133 HA LEU 22 HA LEU 22 -1.806 -5.452 0.791
134 1HB LEU 22 2HB LEU 22 -3.538 -3.106 -0.049
135 2HB LEU 22 1HB LEU 22 -1.932 -3.427 -0.702
136 HG LEU 22 HG LEU 22 -4.163 -5.473 -0.775
137 1HD1 LEU 22 1HD1 LEU 22 -4.648 -4.780 -3.028
138 2HD1 LEU 22 2HD1 LEU 22 -3.310 -3.632 -3.022
139 3HD1 LEU 22 3HD1 LEU 22 -4.727 -3.339 -2.015
140 1HD2 LEU 22 1HD2 LEU 22 -1.634 -6.044 -1.040
141 2HD2 LEU 22 2HD2 LEU 22 -1.773 -5.242 -2.604
142 3HD2 LEU 22 3HD2 LEU 22 -2.756 -6.663 -2.252
143 H VAL 23 H VAL 23 0.052 -4.050 1.169
144 HA VAL 23 HA VAL 23 -0.326 -2.015 3.340
145 HB VAL 23 HB VAL 23 1.802 -2.975 4.323
146 1HG1 VAL 23 1HG1 VAL 23 0.670 -4.769 5.449
147 2HG1 VAL 23 2HG1 VAL 23 -0.435 -5.003 4.094
148 3HG1 VAL 23 3HG1 VAL 23 -0.547 -3.547 5.083
149 1HG2 VAL 23 1HG2 VAL 23 1.222 -5.320 2.488
150 2HG2 VAL 23 2HG2 VAL 23 2.581 -5.136 3.596
151 3HG2 VAL 23 3HG2 VAL 23 2.476 -4.125 2.155
152 H CYS 24 H CYS 24 1.200 -0.288 3.304
153 HA CYS 24 HA CYS 24 2.305 0.357 0.683
154 1HB CYS 24 2HB CYS 24 1.294 1.825 2.630
155 2HB CYS 24 1HB CYS 24 2.951 1.816 3.231
156 H SER 25 H SER 25 4.305 -0.255 -0.026
157 HA SER 25 HA SER 25 6.261 -1.422 1.872
158 1HB SER 25 2HB SER 25 5.510 -1.670 -0.903
159 2HB SER 25 1HB SER 25 7.234 -1.327 -0.797
160 HG SER 25 HG SER 25 5.902 -3.590 -0.217
161 H ARG 26 H ARG 26 8.551 -0.712 1.774
162 HA ARG 26 HA ARG 26 8.761 2.246 1.551
163 1HB ARG 26 2HB ARG 26 10.785 1.914 2.890
164 2HB ARG 26 1HB ARG 26 9.456 1.005 3.606
165 1HG ARG 26 2HG ARG 26 10.295 -1.063 2.839
166 2HG ARG 26 1HG ARG 26 11.330 -0.299 1.633
167 1HD ARG 26 2HD ARG 26 12.111 0.757 4.162
168 2HD ARG 26 1HD ARG 26 11.996 -1.005 4.339
169 HE ARG 26 HE ARG 26 13.666 -1.259 2.632
170 1HH1 ARG 26 1HH2 ARG 26 14.839 1.128 4.088
171 2HH1 ARG 26 2HH2 ARG 26 15.200 2.194 2.772
172 1HH2 ARG 26 2HH1 ARG 26 13.199 0.491 0.497
173 2HH2 ARG 26 1HH1 ARG 26 14.269 1.833 0.734
174 H LYS 27 H LYS 27 9.828 -0.656 -0.102
175 HA LYS 27 HA LYS 27 12.134 0.454 -1.444
176 1HB LYS 27 2HB LYS 27 11.415 -1.992 -1.083
177 2HB LYS 27 1HB LYS 27 10.312 -1.748 -2.438
178 1HG LYS 27 2HG LYS 27 12.670 -0.727 -3.429
179 2HG LYS 27 1HG LYS 27 13.239 -2.070 -2.438
180 1HD LYS 27 2HD LYS 27 11.007 -2.334 -4.470
181 2HD LYS 27 1HD LYS 27 12.696 -2.684 -4.835
182 1HE LYS 27 2HE LYS 27 12.754 -4.419 -3.102
183 2HE LYS 27 1HE LYS 27 11.086 -4.033 -2.634
184 1HZ LYS 27 1HZ LYS 27 12.005 -4.990 -5.295
185 2HZ LYS 27 2HZ LYS 27 10.422 -4.472 -4.957
186 3HZ LYS 27 3HZ LYS 27 11.051 -5.850 -4.189
187 H HIS 28 H HIS 28 8.737 0.002 -2.444
188 HA HIS 28 HA HIS 28 9.230 1.772 -4.804
189 1HB HIS 28 2HB HIS 28 7.556 -0.565 -4.156
190 2HB HIS 28 1HB HIS 28 6.700 0.698 -5.041
191 HD1 HIS 28 HD1 HIS 28 8.173 1.642 -7.217
192 HD2 HIS 28 HD2 HIS 28 9.009 -2.203 -5.839
193 HE1 HIS 28 HE1 HIS 28 9.401 0.461 -9.090
194 H ALA 29 H ALA 29 7.968 1.912 -1.651
195 HA ALA 29 HA ALA 29 6.644 3.496 -0.521
196 1HB ALA 29 1HB ALA 29 7.011 5.705 -1.268
197 2HB ALA 29 2HB ALA 29 7.027 5.226 -2.965
198 3HB ALA 29 3HB ALA 29 8.392 4.825 -1.922
199 H TRP 30 H TRP 30 5.172 1.571 -1.999
200 HA TRP 30 HA TRP 30 2.697 3.109 -2.528
201 1HB TRP 30 2HB TRP 30 2.446 2.321 -4.757
202 2HB TRP 30 1HB TRP 30 4.127 2.824 -4.650
203 HD1 TRP 30 HD1 TRP 30 4.980 0.087 -2.989
204 HE1 TRP 30 HE1 TRP 30 5.294 -2.062 -4.363
205 HE3 TRP 30 HE3 TRP 30 2.352 1.336 -7.177
206 HZ2 TRP 30 HZ2 TRP 30 4.528 -3.122 -6.906
207 HZ3 TRP 30 HZ3 TRP 30 2.161 -0.260 -9.062
208 HH2 TRP 30 HH2 TRP 30 3.244 -2.487 -8.933
209 H CYS 31 H CYS 31 0.871 1.377 -3.078
210 HA CYS 31 HA CYS 31 0.761 -0.451 -0.828
211 1HB CYS 31 2HB CYS 31 -1.043 0.898 -2.305
212 2HB CYS 31 1HB CYS 31 -1.136 -0.664 -3.119
213 H LYS 32 H LYS 32 2.021 -2.265 -0.882
214 HA LYS 32 HA LYS 32 2.106 -3.879 -3.412
215 1HB LYS 32 2HB LYS 32 4.256 -2.926 -2.613
216 2HB LYS 32 1HB LYS 32 4.020 -3.716 -1.054
217 1HG LYS 32 2HG LYS 32 4.872 -5.642 -1.848
218 2HG LYS 32 1HG LYS 32 3.705 -5.652 -3.168
219 1HD LYS 32 2HD LYS 32 5.793 -5.584 -4.266
220 2HD LYS 32 1HD LYS 32 5.251 -3.907 -4.290
221 1HE LYS 32 2HE LYS 32 6.904 -3.220 -2.852
222 2HE LYS 32 1HE LYS 32 6.821 -4.711 -1.893
223 1HZ LYS 32 1HZ LYS 32 8.867 -4.491 -3.293
224 2HZ LYS 32 2HZ LYS 32 7.878 -4.609 -4.668
225 3HZ LYS 32 3HZ LYS 32 7.973 -5.905 -3.572
226 H TYR 33 H TYR 33 1.881 -6.208 -3.141
227 HA TYR 33 HA TYR 33 -0.120 -7.105 -1.345
228 1HB TYR 33 2HB TYR 33 1.791 -8.206 -3.283
229 2HB TYR 33 1HB TYR 33 1.403 -9.342 -1.992
230 HD1 TYR 33 HD1 TYR 33 -0.258 -6.942 -4.347
231 HD2 TYR 33 HD2 TYR 33 -0.558 -10.616 -2.141
232 HE1 TYR 33 HE1 TYR 33 -2.446 -7.405 -5.416
233 HE2 TYR 33 HE2 TYR 33 -2.748 -11.079 -3.210
234 HH TYR 33 HH TYR 33 -4.638 -9.081 -4.464
235 H GLU 34 H GLU 34 -0.016 -8.231 0.647
236 HA GLU 34 HA GLU 34 2.034 -7.543 2.509
237 1HB GLU 34 2HB GLU 34 -0.100 -9.694 2.417
238 2HB GLU 34 1HB GLU 34 0.897 -9.412 3.844
239 1HG GLU 34 2HG GLU 34 0.077 -6.863 3.243
240 2HG GLU 34 1HG GLU 34 -1.331 -7.808 2.763
241 H ILE 35 H ILE 35 4.070 -8.375 2.709
242 HA ILE 35 HA ILE 35 4.807 -10.824 1.215
243 HB ILE 35 HB ILE 35 6.366 -8.755 2.803
244 1HG1 ILE 35 2HG1 ILE 35 6.885 -8.974 -0.059
245 2HG1 ILE 35 1HG1 ILE 35 5.185 -8.629 0.259
246 1HG2 ILE 35 1HG2 ILE 35 7.668 -10.755 2.861
247 2HG2 ILE 35 2HG2 ILE 35 8.331 -9.801 1.534
248 3HG2 ILE 35 3HG2 ILE 35 7.256 -11.157 1.193
249 1HD1 ILE 35 1HD1 ILE 35 7.520 -6.899 0.582
250 2HD1 ILE 35 2HD1 ILE 35 6.527 -6.963 2.039
251 3HD1 ILE 35 3HD1 ILE 35 5.811 -6.471 0.504
252 1HN NH2 36 1HN NH2 36 5.454 -13.081 3.819
253 2HN NH2 36 2HN NH2 36 5.995 -12.552 2.211
Start of MODEL 18
1 1H GLU 1 1H GLU 1 12.900 5.730 2.451
2 2H GLU 1 2H GLU 1 13.920 5.536 3.796
3 3H GLU 1 3H GLU 1 12.264 5.852 4.019
4 HA GLU 1 HA GLU 1 13.414 3.376 2.821
5 1HB GLU 1 2HB GLU 1 12.707 4.324 5.527
6 2HB GLU 1 1HB GLU 1 12.036 2.745 5.117
7 1HG GLU 1 2HG GLU 1 14.380 2.109 4.319
8 2HG GLU 1 1HG GLU 1 14.943 3.580 5.113
9 H CYS 2 H CYS 2 11.717 1.720 2.495
10 HA CYS 2 HA CYS 2 9.298 2.824 1.285
11 1HB CYS 2 2HB CYS 2 8.916 0.482 0.680
12 2HB CYS 2 1HB CYS 2 10.617 0.874 0.432
13 H LEU 3 H LEU 3 7.111 1.779 1.874
14 HA LEU 3 HA LEU 3 6.709 2.026 4.804
15 1HB LEU 3 2HB LEU 3 4.835 1.797 2.426
16 2HB LEU 3 1HB LEU 3 4.307 2.063 4.085
17 HG LEU 3 HG LEU 3 6.327 3.897 2.804
18 1HD1 LEU 3 1HD1 LEU 3 3.320 4.276 2.746
19 2HD1 LEU 3 2HD1 LEU 3 4.266 3.734 1.360
20 3HD1 LEU 3 3HD1 LEU 3 4.540 5.337 2.042
21 1HD2 LEU 3 1HD2 LEU 3 5.956 3.983 5.261
22 2HD2 LEU 3 2HD2 LEU 3 4.241 4.278 4.978
23 3HD2 LEU 3 3HD2 LEU 3 5.436 5.471 4.471
24 H GLY 4 H GLY 4 5.989 0.321 6.101
25 1HA GLY 4 2HA GLY 4 6.365 -2.389 5.065
26 2HA GLY 4 1HA GLY 4 5.961 -1.962 6.727
27 H PHE 5 H PHE 5 4.252 -3.471 6.906
28 HA PHE 5 HA PHE 5 2.044 -3.442 4.949
29 1HB PHE 5 2HB PHE 5 2.936 -5.502 6.048
30 2HB PHE 5 1HB PHE 5 2.388 -4.878 7.604
31 HD1 PHE 5 HD1 PHE 5 1.304 -6.155 4.305
32 HD2 PHE 5 HD2 PHE 5 0.036 -4.840 8.193
33 HE1 PHE 5 HE1 PHE 5 -0.962 -7.065 3.874
34 HE2 PHE 5 HE2 PHE 5 -2.229 -5.751 7.762
35 HZ PHE 5 HZ PHE 5 -2.728 -6.863 5.602
36 H GLY 6 H GLY 6 0.087 -2.411 5.256
37 1HA GLY 6 2HA GLY 6 -1.589 -1.128 6.279
38 2HA GLY 6 1HA GLY 6 -0.917 -1.600 7.839
39 H LYS 7 H LYS 7 0.101 0.408 5.052
40 HA LYS 7 HA LYS 7 0.873 2.555 7.002
41 1HB LYS 7 2HB LYS 7 2.345 1.232 4.743
42 2HB LYS 7 1HB LYS 7 2.676 2.931 5.081
43 1HG LYS 7 2HG LYS 7 2.657 0.952 7.342
44 2HG LYS 7 1HG LYS 7 4.077 1.072 6.303
45 1HD LYS 7 2HD LYS 7 4.735 2.961 7.331
46 2HD LYS 7 1HD LYS 7 3.173 3.718 7.018
47 1HE LYS 7 2HE LYS 7 2.294 2.332 9.016
48 2HE LYS 7 1HE LYS 7 4.003 2.070 9.416
49 1HZ LYS 7 1HZ LYS 7 2.702 4.710 8.984
50 2HZ LYS 7 2HZ LYS 7 4.352 4.469 9.316
51 3HZ LYS 7 3HZ LYS 7 3.181 4.078 10.483
52 H GLY 8 H GLY 8 -0.529 4.226 6.610
53 1HA GLY 8 2HA GLY 8 -2.083 4.562 4.252
54 2HA GLY 8 1HA GLY 8 -1.799 5.820 5.452
55 H CYS 9 H CYS 9 -1.437 5.177 2.263
56 HA CYS 9 HA CYS 9 0.751 7.187 1.992
57 1HB CYS 9 2HB CYS 9 2.138 5.709 0.943
58 2HB CYS 9 1HB CYS 9 1.160 4.483 1.737
59 H ASN 10 H ASN 10 0.872 7.325 -0.767
60 HA ASN 10 HA ASN 10 -1.776 8.467 -1.425
61 1HB ASN 10 2HB ASN 10 0.655 9.412 -1.785
62 2HB ASN 10 1HB ASN 10 0.634 8.397 -3.227
63 1HD2 ASN 10 1HD2 ASN 10 -0.745 11.291 -1.755
64 2HD2 ASN 10 2HD2 ASN 10 -1.602 11.801 -3.128
65 HA PRO 11 HA PRO 11 -2.958 4.869 -3.738
66 1HB PRO 11 2HB PRO 11 -5.022 5.988 -5.153
67 2HB PRO 11 1HB PRO 11 -5.147 5.537 -3.441
68 1HG PRO 11 2HG PRO 11 -4.686 8.214 -4.663
69 2HG PRO 11 1HG PRO 11 -5.682 7.767 -3.270
70 1HD PRO 11 2HD PRO 11 -3.220 8.894 -3.034
71 2HD PRO 11 1HD PRO 11 -3.902 7.787 -1.822
72 H SER 12 H SER 12 -2.777 7.976 -5.551
73 HA SER 12 HA SER 12 -2.238 6.688 -8.098
74 1HB SER 12 2HB SER 12 -1.955 8.968 -8.863
75 2HB SER 12 1HB SER 12 -3.269 8.963 -7.691
76 HG SER 12 HG SER 12 -2.022 9.977 -6.268
77 H ASN 13 H ASN 13 -0.233 8.082 -5.528
78 HA ASN 13 HA ASN 13 2.211 7.088 -6.962
79 1HB ASN 13 2HB ASN 13 1.778 9.622 -6.594
80 2HB ASN 13 1HB ASN 13 2.116 9.293 -4.894
81 1HD2 ASN 13 1HD2 ASN 13 3.567 9.565 -8.090
82 2HD2 ASN 13 2HD2 ASN 13 5.174 9.369 -7.580
83 H ASP 14 H ASP 14 1.389 5.037 -5.723
84 HA ASP 14 HA ASP 14 1.580 4.937 -2.849
85 1HB ASP 14 2HB ASP 14 1.341 2.556 -3.193
86 2HB ASP 14 1HB ASP 14 0.355 3.365 -4.408
87 H GLN 15 H GLN 15 3.336 4.581 -1.537
88 HA GLN 15 HA GLN 15 5.989 4.073 -2.852
89 1HB GLN 15 2HB GLN 15 5.203 5.824 -0.497
90 2HB GLN 15 1HB GLN 15 6.870 5.526 -0.989
91 1HG GLN 15 2HG GLN 15 5.047 6.412 -3.154
92 2HG GLN 15 1HG GLN 15 5.385 7.612 -1.908
93 1HE2 GLN 15 1HE2 GLN 15 7.173 8.873 -2.435
94 2HE2 GLN 15 2HE2 GLN 15 8.530 8.331 -3.298
95 H CYS 16 H CYS 16 4.278 1.977 -1.883
96 HA CYS 16 HA CYS 16 5.244 1.213 0.802
97 1HB CYS 16 2HB CYS 16 2.896 0.905 -0.276
98 2HB CYS 16 1HB CYS 16 3.628 -0.457 -1.124
99 H CYS 17 H CYS 17 6.331 -0.889 1.134
100 HA CYS 17 HA CYS 17 8.550 -1.321 -0.672
101 1HB CYS 17 2HB CYS 17 7.791 -1.953 1.966
102 2HB CYS 17 1HB CYS 17 7.996 -3.510 1.164
103 H LYS 18 H LYS 18 8.606 -2.621 -2.459
104 HA LYS 18 HA LYS 18 6.249 -4.156 -3.267
105 1HB LYS 18 2HB LYS 18 8.767 -3.151 -4.383
106 2HB LYS 18 1HB LYS 18 8.351 -4.754 -4.989
107 1HG LYS 18 2HG LYS 18 6.819 -3.836 -6.353
108 2HG LYS 18 1HG LYS 18 5.954 -3.211 -4.949
109 1HD LYS 18 2HD LYS 18 6.438 -1.235 -6.074
110 2HD LYS 18 1HD LYS 18 7.832 -1.354 -5.001
111 1HE LYS 18 2HE LYS 18 9.287 -1.848 -6.724
112 2HE LYS 18 1HE LYS 18 8.051 -2.719 -7.654
113 1HZ LYS 18 1HZ LYS 18 6.955 -0.629 -8.127
114 2HZ LYS 18 2HZ LYS 18 8.571 -0.554 -8.648
115 3HZ LYS 18 3HZ LYS 18 8.101 0.223 -7.212
116 H SER 19 H SER 19 9.002 -4.879 -1.344
117 HA SER 19 HA SER 19 9.550 -7.592 -2.064
118 1HB SER 19 2HB SER 19 10.826 -5.989 -0.539
119 2HB SER 19 1HB SER 19 9.634 -6.359 0.704
120 HG SER 19 HG SER 19 11.365 -7.761 0.921
121 H SER 20 H SER 20 7.109 -6.168 0.115
122 HA SER 20 HA SER 20 6.071 -8.874 0.795
123 1HB SER 20 2HB SER 20 6.508 -6.966 2.444
124 2HB SER 20 1HB SER 20 5.121 -6.154 1.726
125 HG SER 20 HG SER 20 5.257 -8.462 3.296
126 H ASN 21 H ASN 21 5.690 -7.083 -1.860
127 HA ASN 21 HA ASN 21 3.967 -6.727 -3.427
128 1HB ASN 21 2HB ASN 21 4.065 -9.281 -2.810
129 2HB ASN 21 1HB ASN 21 2.519 -8.963 -2.022
130 1HD2 ASN 21 1HD2 ASN 21 0.682 -8.380 -3.389
131 2HD2 ASN 21 2HD2 ASN 21 0.737 -8.579 -5.074
132 H LEU 22 H LEU 22 3.627 -4.745 -1.773
133 HA LEU 22 HA LEU 22 0.757 -4.830 -0.889
134 1HB LEU 22 2HB LEU 22 3.249 -3.663 0.360
135 2HB LEU 22 1HB LEU 22 1.641 -3.113 0.833
136 HG LEU 22 HG LEU 22 2.421 -6.036 0.837
137 1HD1 LEU 22 1HD1 LEU 22 2.940 -5.859 3.173
138 2HD1 LEU 22 2HD1 LEU 22 2.391 -4.184 3.231
139 3HD1 LEU 22 3HD1 LEU 22 3.867 -4.598 2.360
140 1HD2 LEU 22 1HD2 LEU 22 0.003 -5.478 0.811
141 2HD2 LEU 22 2HD2 LEU 22 0.229 -4.473 2.242
142 3HD2 LEU 22 3HD2 LEU 22 0.478 -6.217 2.340
143 H VAL 23 H VAL 23 -0.508 -3.199 -1.704
144 HA VAL 23 HA VAL 23 0.843 -0.845 -2.986
145 HB VAL 23 HB VAL 23 -0.947 -1.035 -4.750
146 1HG1 VAL 23 1HG1 VAL 23 0.128 -2.818 -5.961
147 2HG1 VAL 23 2HG1 VAL 23 0.677 -3.577 -4.467
148 3HG1 VAL 23 3HG1 VAL 23 1.365 -2.036 -4.978
149 1HG2 VAL 23 1HG2 VAL 23 -2.273 -3.066 -4.896
150 2HG2 VAL 23 2HG2 VAL 23 -2.538 -2.347 -3.309
151 3HG2 VAL 23 3HG2 VAL 23 -1.471 -3.741 -3.478
152 H CYS 24 H CYS 24 -0.402 1.132 -2.884
153 HA CYS 24 HA CYS 24 -2.026 1.435 -0.517
154 1HB CYS 24 2HB CYS 24 -0.719 3.045 -2.487
155 2HB CYS 24 1HB CYS 24 -2.387 3.600 -2.353
156 H SER 25 H SER 25 -4.111 0.766 -0.348
157 HA SER 25 HA SER 25 -5.762 0.046 -2.615
158 1HB SER 25 2HB SER 25 -5.770 -0.858 -0.226
159 2HB SER 25 1HB SER 25 -6.606 0.620 0.239
160 HG SER 25 HG SER 25 -7.857 -1.380 -0.431
161 H ARG 26 H ARG 26 -8.044 1.040 -2.825
162 HA ARG 26 HA ARG 26 -7.771 3.984 -3.069
163 1HB ARG 26 2HB ARG 26 -9.307 1.779 -4.286
164 2HB ARG 26 1HB ARG 26 -10.240 3.258 -4.058
165 1HG ARG 26 2HG ARG 26 -7.482 3.353 -5.270
166 2HG ARG 26 1HG ARG 26 -8.892 2.990 -6.266
167 1HD ARG 26 2HD ARG 26 -9.168 5.338 -4.456
168 2HD ARG 26 1HD ARG 26 -8.048 5.527 -5.819
169 HE ARG 26 HE ARG 26 -9.878 5.222 -7.331
170 1HH1 ARG 26 1HH2 ARG 26 -11.341 6.803 -5.186
171 2HH1 ARG 26 2HH2 ARG 26 -12.773 5.852 -4.977
172 1HH2 ARG 26 2HH1 ARG 26 -11.470 3.055 -6.575
173 2HH2 ARG 26 1HH1 ARG 26 -12.846 3.725 -5.765
174 H LYS 27 H LYS 27 -9.616 1.577 -1.240
175 HA LYS 27 HA LYS 27 -11.430 3.589 -0.077
176 1HB LYS 27 2HB LYS 27 -10.948 0.622 0.297
177 2HB LYS 27 1HB LYS 27 -12.159 1.512 1.221
178 1HG LYS 27 2HG LYS 27 -13.265 2.201 -0.867
179 2HG LYS 27 1HG LYS 27 -12.045 1.340 -1.805
180 1HD LYS 27 2HD LYS 27 -13.113 -0.625 -1.524
181 2HD LYS 27 1HD LYS 27 -13.187 -0.394 0.222
182 1HE LYS 27 2HE LYS 27 -15.061 1.199 -1.506
183 2HE LYS 27 1HE LYS 27 -15.434 -0.504 -1.178
184 1HZ LYS 27 1HZ LYS 27 -14.774 1.542 0.879
185 2HZ LYS 27 2HZ LYS 27 -15.137 -0.091 1.182
186 3HZ LYS 27 3HZ LYS 27 -16.329 0.945 0.556
187 H HIS 28 H HIS 28 -8.707 1.560 1.004
188 HA HIS 28 HA HIS 28 -8.697 2.869 3.666
189 1HB HIS 28 2HB HIS 28 -7.596 0.444 2.363
190 2HB HIS 28 1HB HIS 28 -6.574 1.159 3.609
191 HD1 HIS 28 HD1 HIS 28 -7.860 1.636 5.976
192 HD2 HIS 28 HD2 HIS 28 -9.675 -1.079 3.383
193 HE1 HIS 28 HE1 HIS 28 -9.519 0.318 7.364
194 H ALA 29 H ALA 29 -6.924 2.946 0.629
195 HA ALA 29 HA ALA 29 -5.146 4.306 -0.105
196 1HB ALA 29 1HB ALA 29 -6.855 5.901 1.078
197 2HB ALA 29 2HB ALA 29 -5.243 6.510 0.708
198 3HB ALA 29 3HB ALA 29 -5.633 5.989 2.346
199 H TRP 30 H TRP 30 -4.396 2.053 1.448
200 HA TRP 30 HA TRP 30 -1.828 3.030 2.556
201 1HB TRP 30 2HB TRP 30 -2.189 2.147 4.726
202 2HB TRP 30 1HB TRP 30 -3.700 2.950 4.334
203 HD1 TRP 30 HD1 TRP 30 -4.574 0.395 2.340
204 HE1 TRP 30 HE1 TRP 30 -5.560 -1.676 3.508
205 HE3 TRP 30 HE3 TRP 30 -2.879 1.178 7.088
206 HZ2 TRP 30 HZ2 TRP 30 -5.626 -2.846 6.115
207 HZ3 TRP 30 HZ3 TRP 30 -3.421 -0.428 8.896
208 HH2 TRP 30 HH2 TRP 30 -4.790 -2.438 8.416
209 H CYS 31 H CYS 31 -0.438 1.015 3.200
210 HA CYS 31 HA CYS 31 -0.075 -0.678 0.958
211 1HB CYS 31 2HB CYS 31 0.684 -0.931 3.882
212 2HB CYS 31 1HB CYS 31 1.289 -2.024 2.640
213 H LYS 32 H LYS 32 -1.588 -2.110 0.222
214 HA LYS 32 HA LYS 32 -2.892 -3.943 2.205
215 1HB LYS 32 2HB LYS 32 -4.499 -2.249 1.611
216 2HB LYS 32 1HB LYS 32 -4.079 -2.365 -0.098
217 1HG LYS 32 2HG LYS 32 -5.543 -4.049 -0.409
218 2HG LYS 32 1HG LYS 32 -4.853 -4.962 0.933
219 1HD LYS 32 2HD LYS 32 -6.165 -3.393 2.478
220 2HD LYS 32 1HD LYS 32 -7.033 -2.873 1.034
221 1HE LYS 32 2HE LYS 32 -8.397 -4.628 1.814
222 2HE LYS 32 1HE LYS 32 -7.356 -5.474 0.653
223 1HZ LYS 32 1HZ LYS 32 -7.372 -6.612 2.794
224 2HZ LYS 32 2HZ LYS 32 -6.832 -5.201 3.570
225 3HZ LYS 32 3HZ LYS 32 -5.828 -5.998 2.455
226 H TYR 33 H TYR 33 -2.969 -6.087 1.538
227 HA TYR 33 HA TYR 33 -1.419 -6.850 -0.841
228 1HB TYR 33 2HB TYR 33 -1.717 -7.888 1.621
229 2HB TYR 33 1HB TYR 33 -2.984 -8.798 0.799
230 HD1 TYR 33 HD1 TYR 33 -2.356 -9.991 -1.406
231 HD2 TYR 33 HD2 TYR 33 0.537 -8.528 1.411
232 HE1 TYR 33 HE1 TYR 33 -0.644 -11.490 -2.389
233 HE2 TYR 33 HE2 TYR 33 2.251 -10.028 0.429
234 HH TYR 33 HH TYR 33 2.230 -11.258 -2.370
235 H GLU 34 H GLU 34 -2.278 -7.959 -2.660
236 HA GLU 34 HA GLU 34 -4.979 -7.270 -3.456
237 1HB GLU 34 2HB GLU 34 -2.723 -8.958 -4.543
238 2HB GLU 34 1HB GLU 34 -4.275 -8.876 -5.377
239 1HG GLU 34 2HG GLU 34 -3.450 -7.022 -6.382
240 2HG GLU 34 1HG GLU 34 -3.743 -6.215 -4.841
241 H ILE 35 H ILE 35 -6.835 -8.456 -3.185
242 HA ILE 35 HA ILE 35 -6.803 -10.910 -1.606
243 HB ILE 35 HB ILE 35 -8.990 -9.421 -3.104
244 1HG1 ILE 35 2HG1 ILE 35 -7.932 -8.059 -1.357
245 2HG1 ILE 35 1HG1 ILE 35 -9.547 -8.540 -0.842
246 1HG2 ILE 35 1HG2 ILE 35 -9.078 -11.697 -1.116
247 2HG2 ILE 35 2HG2 ILE 35 -9.811 -11.624 -2.719
248 3HG2 ILE 35 3HG2 ILE 35 -10.464 -10.646 -1.404
249 1HD1 ILE 35 1HD1 ILE 35 -8.450 -10.493 0.371
250 2HD1 ILE 35 2HD1 ILE 35 -8.103 -8.899 1.039
251 3HD1 ILE 35 3HD1 ILE 35 -6.901 -9.717 0.042
252 1HN NH2 36 1HN NH2 36 -7.409 -11.606 -5.654
253 2HN NH2 36 2HN NH2 36 -6.952 -10.025 -4.984
Start of MODEL 19
1 1H GLU 1 1H GLU 1 10.641 10.802 0.266
2 2H GLU 1 2H GLU 1 8.944 10.756 0.195
3 3H GLU 1 3H GLU 1 9.869 9.906 -0.949
4 HA GLU 1 HA GLU 1 10.736 8.458 0.826
5 1HB GLU 1 2HB GLU 1 10.360 10.401 2.470
6 2HB GLU 1 1HB GLU 1 8.678 9.875 2.534
7 1HG GLU 1 2HG GLU 1 10.002 7.499 2.889
8 2HG GLU 1 1HG GLU 1 11.084 8.627 3.704
9 H CYS 2 H CYS 2 9.732 6.463 0.705
10 HA CYS 2 HA CYS 2 7.077 6.286 -0.538
11 1HB CYS 2 2HB CYS 2 7.637 3.950 -0.712
12 2HB CYS 2 1HB CYS 2 9.128 4.843 -1.001
13 H LEU 3 H LEU 3 5.418 4.751 0.455
14 HA LEU 3 HA LEU 3 5.009 5.463 3.299
15 1HB LEU 3 2HB LEU 3 3.320 3.980 1.256
16 2HB LEU 3 1HB LEU 3 2.763 4.484 2.850
17 HG LEU 3 HG LEU 3 3.996 6.577 1.117
18 1HD1 LEU 3 1HD1 LEU 3 1.680 4.971 0.329
19 2HD1 LEU 3 2HD1 LEU 3 2.594 6.155 -0.604
20 3HD1 LEU 3 3HD1 LEU 3 1.295 6.687 0.462
21 1HD2 LEU 3 1HD2 LEU 3 1.578 6.494 2.952
22 2HD2 LEU 3 2HD2 LEU 3 2.252 7.944 2.207
23 3HD2 LEU 3 3HD2 LEU 3 3.187 7.054 3.408
24 H GLY 4 H GLY 4 5.044 3.966 4.990
25 1HA GLY 4 2HA GLY 4 6.442 1.450 4.531
26 2HA GLY 4 1HA GLY 4 5.847 2.034 6.085
27 H PHE 5 H PHE 5 5.357 -0.497 5.942
28 HA PHE 5 HA PHE 5 2.961 -1.241 4.446
29 1HB PHE 5 2HB PHE 5 4.689 -2.870 4.953
30 2HB PHE 5 1HB PHE 5 4.567 -2.525 6.679
31 HD1 PHE 5 HD1 PHE 5 2.453 -3.635 3.782
32 HD2 PHE 5 HD2 PHE 5 3.175 -3.847 8.011
33 HE1 PHE 5 HE1 PHE 5 0.666 -5.338 4.003
34 HE2 PHE 5 HE2 PHE 5 1.389 -5.551 8.231
35 HZ PHE 5 HZ PHE 5 0.133 -6.295 6.226
36 H GLY 6 H GLY 6 0.849 -1.307 5.214
37 1HA GLY 6 2HA GLY 6 -0.949 -1.115 6.729
38 2HA GLY 6 1HA GLY 6 0.217 -1.035 8.049
39 H LYS 7 H LYS 7 -0.040 1.054 5.171
40 HA LYS 7 HA LYS 7 -0.440 3.391 7.010
41 1HB LYS 7 2HB LYS 7 1.489 2.745 4.920
42 2HB LYS 7 1HB LYS 7 0.666 4.267 4.583
43 1HG LYS 7 2HG LYS 7 1.863 3.633 7.289
44 2HG LYS 7 1HG LYS 7 2.774 4.442 6.015
45 1HD LYS 7 2HD LYS 7 0.070 5.481 6.842
46 2HD LYS 7 1HD LYS 7 1.511 5.908 7.765
47 1HE LYS 7 2HE LYS 7 2.556 6.619 5.522
48 2HE LYS 7 1HE LYS 7 0.912 6.521 4.860
49 1HZ LYS 7 1HZ LYS 7 1.717 8.087 7.258
50 2HZ LYS 7 2HZ LYS 7 0.143 7.981 6.627
51 3HZ LYS 7 3HZ LYS 7 1.370 8.739 5.731
52 H GLY 8 H GLY 8 -2.436 4.300 6.724
53 1HA GLY 8 2HA GLY 8 -4.273 3.580 4.681
54 2HA GLY 8 1HA GLY 8 -4.419 5.014 5.695
55 H CYS 9 H CYS 9 -4.060 4.002 2.540
56 HA CYS 9 HA CYS 9 -3.256 6.738 1.682
57 1HB CYS 9 2HB CYS 9 -1.288 6.029 0.783
58 2HB CYS 9 1HB CYS 9 -1.494 4.600 1.788
59 H ASN 10 H ASN 10 -3.383 6.596 -0.976
60 HA ASN 10 HA ASN 10 -6.184 5.817 -1.516
61 1HB ASN 10 2HB ASN 10 -4.011 7.371 -2.931
62 2HB ASN 10 1HB ASN 10 -5.525 6.974 -3.744
63 1HD2 ASN 10 1HD2 ASN 10 -4.038 9.189 -1.561
64 2HD2 ASN 10 2HD2 ASN 10 -5.447 10.002 -1.077
65 HA PRO 11 HA PRO 11 -4.934 1.996 -3.395
66 1HB PRO 11 2HB PRO 11 -7.304 1.417 -4.645
67 2HB PRO 11 1HB PRO 11 -7.046 1.205 -2.903
68 1HG PRO 11 2HG PRO 11 -8.414 3.416 -4.354
69 2HG PRO 11 1HG PRO 11 -8.848 2.628 -2.829
70 1HD PRO 11 2HD PRO 11 -7.625 5.052 -2.954
71 2HD PRO 11 1HD PRO 11 -7.413 3.924 -1.597
72 H SER 12 H SER 12 -6.732 4.385 -5.381
73 HA SER 12 HA SER 12 -5.773 3.397 -7.926
74 1HB SER 12 2HB SER 12 -6.980 5.994 -6.946
75 2HB SER 12 1HB SER 12 -6.600 5.714 -8.643
76 HG SER 12 HG SER 12 -8.597 4.654 -7.047
77 H ASN 13 H ASN 13 -4.801 6.151 -5.869
78 HA ASN 13 HA ASN 13 -2.277 6.389 -7.464
79 1HB ASN 13 2HB ASN 13 -3.910 8.326 -7.218
80 2HB ASN 13 1HB ASN 13 -3.515 8.344 -5.500
81 1HD2 ASN 13 1HD2 ASN 13 -1.877 8.485 -8.717
82 2HD2 ASN 13 2HD2 ASN 13 -0.624 9.503 -8.194
83 H ASP 14 H ASP 14 -1.938 4.287 -5.954
84 HA ASP 14 HA ASP 14 -1.129 4.934 -3.198
85 1HB ASP 14 2HB ASP 14 -0.697 2.516 -3.092
86 2HB ASP 14 1HB ASP 14 -2.262 2.813 -3.844
87 H GLN 15 H GLN 15 0.963 5.295 -2.530
88 HA GLN 15 HA GLN 15 3.161 4.928 -4.541
89 1HB GLN 15 2HB GLN 15 2.121 7.305 -3.741
90 2HB GLN 15 1HB GLN 15 3.343 7.079 -2.489
91 1HG GLN 15 2HG GLN 15 4.712 6.370 -4.780
92 2HG GLN 15 1HG GLN 15 3.683 7.686 -5.346
93 1HE2 GLN 15 1HE2 GLN 15 4.368 9.794 -4.847
94 2HE2 GLN 15 2HE2 GLN 15 5.594 10.165 -3.734
95 H CYS 16 H CYS 16 2.397 3.001 -2.529
96 HA CYS 16 HA CYS 16 4.017 3.241 -0.142
97 1HB CYS 16 2HB CYS 16 1.945 1.709 -0.931
98 2HB CYS 16 1HB CYS 16 3.261 0.586 -1.278
99 H CYS 17 H CYS 17 5.924 1.889 0.338
100 HA CYS 17 HA CYS 17 8.012 2.061 -1.583
101 1HB CYS 17 2HB CYS 17 7.596 1.230 1.112
102 2HB CYS 17 1HB CYS 17 8.470 -0.068 0.298
103 H LYS 18 H LYS 18 8.258 0.886 -3.431
104 HA LYS 18 HA LYS 18 6.752 -1.602 -3.868
105 1HB LYS 18 2HB LYS 18 8.706 0.041 -5.506
106 2HB LYS 18 1HB LYS 18 7.880 -1.389 -6.126
107 1HG LYS 18 2HG LYS 18 5.790 0.037 -5.049
108 2HG LYS 18 1HG LYS 18 6.832 1.325 -5.654
109 1HD LYS 18 2HD LYS 18 5.762 0.907 -7.625
110 2HD LYS 18 1HD LYS 18 6.936 -0.402 -7.751
111 1HE LYS 18 2HE LYS 18 5.371 -2.026 -6.960
112 2HE LYS 18 1HE LYS 18 4.250 -0.773 -6.392
113 1HZ LYS 18 1HZ LYS 18 3.970 -0.013 -8.657
114 2HZ LYS 18 2HZ LYS 18 3.587 -1.666 -8.561
115 3HZ LYS 18 3HZ LYS 18 5.072 -1.172 -9.222
116 H SER 19 H SER 19 9.687 -0.939 -2.353
117 HA SER 19 HA SER 19 11.465 -2.925 -3.379
118 1HB SER 19 2HB SER 19 11.867 -0.982 -1.758
119 2HB SER 19 1HB SER 19 11.192 -2.014 -0.501
120 HG SER 19 HG SER 19 13.512 -2.129 -0.720
121 H SER 20 H SER 20 8.899 -3.103 -0.903
122 HA SER 20 HA SER 20 9.415 -6.031 -0.582
123 1HB SER 20 2HB SER 20 7.921 -3.919 0.988
124 2HB SER 20 1HB SER 20 7.800 -5.632 1.374
125 HG SER 20 HG SER 20 9.635 -3.990 2.184
126 H ASN 21 H ASN 21 7.865 -4.521 -2.860
127 HA ASN 21 HA ASN 21 5.910 -4.855 -4.130
128 1HB ASN 21 2HB ASN 21 7.104 -7.191 -3.682
129 2HB ASN 21 1HB ASN 21 5.630 -7.514 -2.768
130 1HD2 ASN 21 1HD2 ASN 21 3.569 -7.527 -3.975
131 2HD2 ASN 21 2HD2 ASN 21 3.555 -7.676 -5.666
132 H LEU 22 H LEU 22 5.155 -3.229 -2.209
133 HA LEU 22 HA LEU 22 2.791 -4.481 -0.845
134 1HB LEU 22 2HB LEU 22 4.642 -2.183 -0.167
135 2HB LEU 22 1HB LEU 22 3.108 -2.423 0.669
136 HG LEU 22 HG LEU 22 5.244 -4.561 0.443
137 1HD1 LEU 22 1HD1 LEU 22 4.621 -2.717 2.771
138 2HD1 LEU 22 2HD1 LEU 22 6.045 -2.595 1.737
139 3HD1 LEU 22 3HD1 LEU 22 5.817 -4.012 2.762
140 1HD2 LEU 22 1HD2 LEU 22 3.807 -5.245 2.586
141 2HD2 LEU 22 2HD2 LEU 22 3.299 -5.711 0.962
142 3HD2 LEU 22 3HD2 LEU 22 2.561 -4.316 1.751
143 H VAL 23 H VAL 23 0.806 -3.735 -1.461
144 HA VAL 23 HA VAL 23 0.655 -1.154 -2.991
145 HB VAL 23 HB VAL 23 -1.115 -2.273 -4.337
146 1HG1 VAL 23 1HG1 VAL 23 1.363 -4.007 -4.283
147 2HG1 VAL 23 2HG1 VAL 23 1.373 -2.363 -4.921
148 3HG1 VAL 23 3HG1 VAL 23 0.358 -3.594 -5.672
149 1HG2 VAL 23 1HG2 VAL 23 -1.853 -3.883 -2.595
150 2HG2 VAL 23 2HG2 VAL 23 -0.321 -4.746 -2.757
151 3HG2 VAL 23 3HG2 VAL 23 -1.456 -4.702 -4.107
152 H CYS 24 H CYS 24 -1.361 0.034 -2.687
153 HA CYS 24 HA CYS 24 -2.441 -0.178 0.011
154 1HB CYS 24 2HB CYS 24 -2.246 1.728 -2.085
155 2HB CYS 24 1HB CYS 24 -3.964 1.534 -1.737
156 H SER 25 H SER 25 -3.965 -1.674 0.530
157 HA SER 25 HA SER 25 -5.633 -3.001 -1.464
158 1HB SER 25 2HB SER 25 -4.679 -3.993 0.651
159 2HB SER 25 1HB SER 25 -5.793 -2.985 1.569
160 HG SER 25 HG SER 25 -7.289 -4.388 1.149
161 H ARG 26 H ARG 26 -8.002 -2.927 -1.454
162 HA ARG 26 HA ARG 26 -9.055 -0.207 -0.961
163 1HB ARG 26 2HB ARG 26 -9.506 -2.399 -2.748
164 2HB ARG 26 1HB ARG 26 -11.019 -2.070 -1.905
165 1HG ARG 26 2HG ARG 26 -9.335 0.002 -3.345
166 2HG ARG 26 1HG ARG 26 -10.822 -0.713 -3.968
167 1HD ARG 26 2HD ARG 26 -11.758 0.126 -1.589
168 2HD ARG 26 1HD ARG 26 -10.463 1.319 -1.811
169 HE ARG 26 HE ARG 26 -11.476 1.790 -4.076
170 1HH1 ARG 26 2HH1 ARG 26 -13.341 2.872 -2.046
171 2HH1 ARG 26 1HH1 ARG 26 -14.856 2.165 -2.499
172 1HH2 ARG 26 1HH2 ARG 26 -13.418 -0.290 -4.492
173 2HH2 ARG 26 2HH2 ARG 26 -14.900 0.371 -3.887
174 H LYS 27 H LYS 27 -9.365 -3.470 0.366
175 HA LYS 27 HA LYS 27 -11.763 -3.197 1.863
176 1HB LYS 27 2HB LYS 27 -10.161 -5.201 1.370
177 2HB LYS 27 1HB LYS 27 -9.329 -4.684 2.836
178 1HG LYS 27 2HG LYS 27 -11.329 -4.966 4.158
179 2HG LYS 27 1HG LYS 27 -12.303 -5.246 2.715
180 1HD LYS 27 2HD LYS 27 -10.725 -7.237 2.258
181 2HD LYS 27 1HD LYS 27 -10.208 -7.046 3.933
182 1HE LYS 27 2HE LYS 27 -13.151 -7.074 3.496
183 2HE LYS 27 1HE LYS 27 -12.307 -8.612 3.231
184 1HZ LYS 27 1HZ LYS 27 -11.985 -6.877 5.626
185 2HZ LYS 27 2HZ LYS 27 -11.223 -8.373 5.365
186 3HZ LYS 27 3HZ LYS 27 -12.907 -8.300 5.576
187 H HIS 28 H HIS 28 -8.401 -2.428 2.788
188 HA HIS 28 HA HIS 28 -9.462 -0.994 5.202
189 1HB HIS 28 2HB HIS 28 -6.981 -2.556 4.554
190 2HB HIS 28 1HB HIS 28 -6.900 -1.311 5.800
191 HD1 HIS 28 HD1 HIS 28 -8.689 -1.572 7.810
192 HD2 HIS 28 HD2 HIS 28 -8.183 -4.927 5.385
193 HE1 HIS 28 HE1 HIS 28 -9.673 -3.530 9.079
194 H ALA 29 H ALA 29 -8.323 -0.368 2.107
195 HA ALA 29 HA ALA 29 -7.413 1.533 1.056
196 1HB ALA 29 1HB ALA 29 -8.267 2.985 3.563
197 2HB ALA 29 2HB ALA 29 -9.456 2.321 2.443
198 3HB ALA 29 3HB ALA 29 -8.322 3.554 1.895
199 H TRP 30 H TRP 30 -5.484 0.008 2.480
200 HA TRP 30 HA TRP 30 -3.518 2.133 3.107
201 1HB TRP 30 2HB TRP 30 -3.075 1.343 5.313
202 2HB TRP 30 1HB TRP 30 -4.826 1.435 5.192
203 HD1 TRP 30 HD1 TRP 30 -4.852 -1.418 3.399
204 HE1 TRP 30 HE1 TRP 30 -4.704 -3.600 4.751
205 HE3 TRP 30 HE3 TRP 30 -2.961 0.391 7.775
206 HZ2 TRP 30 HZ2 TRP 30 -3.894 -4.471 7.353
207 HZ3 TRP 30 HZ3 TRP 30 -2.513 -1.134 9.677
208 HH2 TRP 30 HH2 TRP 30 -2.977 -3.562 9.471
209 H CYS 31 H CYS 31 -1.268 1.084 3.455
210 HA CYS 31 HA CYS 31 -0.605 -0.567 1.222
211 1HB CYS 31 2HB CYS 31 0.779 0.201 3.797
212 2HB CYS 31 1HB CYS 31 1.576 -0.806 2.592
213 H LYS 32 H LYS 32 -0.923 -2.721 0.958
214 HA LYS 32 HA LYS 32 -0.879 -4.516 3.357
215 1HB LYS 32 2HB LYS 32 -3.155 -3.664 2.091
216 2HB LYS 32 1HB LYS 32 -2.803 -5.143 1.196
217 1HG LYS 32 2HG LYS 32 -2.506 -6.260 3.498
218 2HG LYS 32 1HG LYS 32 -3.289 -4.825 4.161
219 1HD LYS 32 2HD LYS 32 -5.272 -5.212 2.817
220 2HD LYS 32 1HD LYS 32 -4.484 -6.540 1.964
221 1HE LYS 32 2HE LYS 32 -5.646 -7.771 3.554
222 2HE LYS 32 1HE LYS 32 -4.182 -7.436 4.498
223 1HZ LYS 32 1HZ LYS 32 -6.564 -5.657 4.430
224 2HZ LYS 32 2HZ LYS 32 -5.199 -5.500 5.430
225 3HZ LYS 32 3HZ LYS 32 -6.273 -6.797 5.651
226 H TYR 33 H TYR 33 -0.666 -6.865 2.629
227 HA TYR 33 HA TYR 33 1.511 -7.144 0.711
228 1HB TYR 33 2HB TYR 33 -0.006 -8.763 2.668
229 2HB TYR 33 1HB TYR 33 0.603 -9.677 1.289
230 HD1 TYR 33 HD1 TYR 33 2.722 -10.595 1.511
231 HD2 TYR 33 HD2 TYR 33 1.807 -6.948 3.581
232 HE1 TYR 33 HE1 TYR 33 4.994 -10.590 2.507
233 HE2 TYR 33 HE2 TYR 33 4.076 -6.942 4.576
234 HH TYR 33 HH TYR 33 6.520 -8.256 3.583
235 H GLU 34 H GLU 34 1.364 -8.702 -1.157
236 HA GLU 34 HA GLU 34 -1.107 -8.221 -2.717
237 1HB GLU 34 2HB GLU 34 1.312 -7.934 -3.517
238 2HB GLU 34 1HB GLU 34 1.415 -9.695 -3.519
239 1HG GLU 34 2HG GLU 34 -0.815 -9.524 -4.921
240 2HG GLU 34 1HG GLU 34 -0.235 -7.893 -5.263
241 H ILE 35 H ILE 35 -2.705 -9.661 -2.064
242 HA ILE 35 HA ILE 35 -3.840 -11.697 -1.763
243 HB ILE 35 HB ILE 35 -1.553 -12.653 -3.528
244 1HG1 ILE 35 2HG1 ILE 35 -4.276 -11.985 -4.567
245 2HG1 ILE 35 1HG1 ILE 35 -3.204 -10.642 -4.174
246 1HG2 ILE 35 1HG2 ILE 35 -4.166 -13.845 -2.656
247 2HG2 ILE 35 2HG2 ILE 35 -2.599 -14.627 -2.869
248 3HG2 ILE 35 3HG2 ILE 35 -3.568 -14.197 -4.279
249 1HD1 ILE 35 1HD1 ILE 35 -2.448 -12.963 -5.971
250 2HD1 ILE 35 2HD1 ILE 35 -1.480 -11.526 -5.650
251 3HD1 ILE 35 3HD1 ILE 35 -2.990 -11.389 -6.549
252 1HN NH2 36 1HN NH2 36 -2.425 -13.036 1.132
253 2HN NH2 36 2HN NH2 36 -3.844 -12.462 0.230
Start of MODEL 20
1 1H GLU 1 1H GLU 1 11.366 8.725 -0.880
2 2H GLU 1 2H GLU 1 12.567 7.598 -0.464
3 3H GLU 1 3H GLU 1 12.678 9.202 0.083
4 HA GLU 1 HA GLU 1 11.934 7.782 1.889
5 1HB GLU 1 2HB GLU 1 10.965 10.183 1.044
6 2HB GLU 1 1HB GLU 1 9.471 9.248 1.106
7 1HG GLU 1 2HG GLU 1 9.502 9.112 3.377
8 2HG GLU 1 1HG GLU 1 11.248 8.871 3.435
9 H CYS 2 H CYS 2 10.587 6.093 2.589
10 HA CYS 2 HA CYS 2 8.655 4.969 0.584
11 1HB CYS 2 2HB CYS 2 10.969 3.852 0.859
12 2HB CYS 2 1HB CYS 2 10.394 3.340 2.445
13 H LEU 3 H LEU 3 6.845 3.824 1.536
14 HA LEU 3 HA LEU 3 6.164 4.766 4.275
15 1HB LEU 3 2HB LEU 3 4.553 3.400 2.091
16 2HB LEU 3 1HB LEU 3 3.886 4.060 3.582
17 HG LEU 3 HG LEU 3 5.433 5.708 1.562
18 1HD1 LEU 3 1HD1 LEU 3 3.252 6.580 0.849
19 2HD1 LEU 3 2HD1 LEU 3 2.435 5.500 1.978
20 3HD1 LEU 3 3HD1 LEU 3 3.315 4.834 0.603
21 1HD2 LEU 3 1HD2 LEU 3 3.943 6.265 4.117
22 2HD2 LEU 3 2HD2 LEU 3 4.061 7.517 2.881
23 3HD2 LEU 3 3HD2 LEU 3 5.525 6.854 3.606
24 H GLY 4 H GLY 4 5.757 3.325 5.979
25 1HA GLY 4 2HA GLY 4 6.883 0.635 5.729
26 2HA GLY 4 1HA GLY 4 6.240 1.357 7.203
27 H PHE 5 H PHE 5 5.161 -0.749 7.536
28 HA PHE 5 HA PHE 5 3.028 -1.541 5.669
29 1HB PHE 5 2HB PHE 5 4.425 -3.163 6.916
30 2HB PHE 5 1HB PHE 5 3.814 -2.514 8.438
31 HD1 PHE 5 HD1 PHE 5 2.743 -4.152 5.256
32 HD2 PHE 5 HD2 PHE 5 1.757 -3.264 9.343
33 HE1 PHE 5 HE1 PHE 5 0.771 -5.649 5.107
34 HE2 PHE 5 HE2 PHE 5 -0.214 -4.761 9.192
35 HZ PHE 5 HZ PHE 5 -0.706 -5.953 7.075
36 H GLY 6 H GLY 6 0.809 -1.303 6.041
37 1HA GLY 6 2HA GLY 6 -1.172 -0.558 7.062
38 2HA GLY 6 1HA GLY 6 -0.261 -0.280 8.543
39 H LYS 7 H LYS 7 1.192 1.254 5.850
40 HA LYS 7 HA LYS 7 0.581 3.900 6.909
41 1HB LYS 7 2HB LYS 7 2.321 2.615 4.917
42 2HB LYS 7 1HB LYS 7 1.743 4.199 4.403
43 1HG LYS 7 2HG LYS 7 2.936 3.717 7.141
44 2HG LYS 7 1HG LYS 7 3.911 4.196 5.752
45 1HD LYS 7 2HD LYS 7 3.094 6.328 5.744
46 2HD LYS 7 1HD LYS 7 1.471 5.816 6.205
47 1HE LYS 7 2HE LYS 7 2.112 6.861 8.180
48 2HE LYS 7 1HE LYS 7 2.744 5.236 8.509
49 1HZ LYS 7 1HZ LYS 7 4.257 7.454 7.225
50 2HZ LYS 7 2HZ LYS 7 4.856 5.892 7.526
51 3HZ LYS 7 3HZ LYS 7 4.464 6.919 8.821
52 H GLY 8 H GLY 8 -1.252 5.030 6.416
53 1HA GLY 8 2HA GLY 8 -3.104 4.110 4.377
54 2HA GLY 8 1HA GLY 8 -3.288 5.562 5.358
55 H CYS 9 H CYS 9 -1.879 4.261 2.407
56 HA CYS 9 HA CYS 9 -1.078 7.001 1.534
57 1HB CYS 9 2HB CYS 9 0.504 5.913 0.255
58 2HB CYS 9 1HB CYS 9 0.248 4.654 1.459
59 H ASN 10 H ASN 10 -1.385 6.874 -1.179
60 HA ASN 10 HA ASN 10 -4.327 6.941 -1.491
61 1HB ASN 10 2HB ASN 10 -1.923 7.806 -3.108
62 2HB ASN 10 1HB ASN 10 -3.555 7.880 -3.773
63 1HD2 ASN 10 1HD2 ASN 10 -5.157 9.259 -2.554
64 2HD2 ASN 10 2HD2 ASN 10 -4.585 10.562 -1.629
65 HA PRO 11 HA PRO 11 -4.509 3.007 -3.496
66 1HB PRO 11 2HB PRO 11 -6.842 3.352 -4.897
67 2HB PRO 11 1HB PRO 11 -6.794 3.067 -3.146
68 1HG PRO 11 2HG PRO 11 -7.136 5.622 -4.637
69 2HG PRO 11 1HG PRO 11 -7.935 5.062 -3.159
70 1HD PRO 11 2HD PRO 11 -5.888 6.850 -3.154
71 2HD PRO 11 1HD PRO 11 -6.201 5.727 -1.812
72 H SER 12 H SER 12 -5.194 5.884 -5.528
73 HA SER 12 HA SER 12 -4.383 4.589 -8.012
74 1HB SER 12 2HB SER 12 -5.346 7.210 -7.040
75 2HB SER 12 1HB SER 12 -4.286 7.299 -8.445
76 HG SER 12 HG SER 12 -6.845 6.352 -8.210
77 H ASN 13 H ASN 13 -2.847 6.702 -5.616
78 HA ASN 13 HA ASN 13 -0.257 6.484 -7.110
79 1HB ASN 13 2HB ASN 13 -1.614 8.552 -5.434
80 2HB ASN 13 1HB ASN 13 0.145 8.465 -5.324
81 1HD2 ASN 13 1HD2 ASN 13 1.362 9.292 -7.086
82 2HD2 ASN 13 2HD2 ASN 13 0.662 9.898 -8.508
83 H ASP 14 H ASP 14 -0.428 4.209 -5.964
84 HA ASP 14 HA ASP 14 0.100 4.142 -3.089
85 1HB ASP 14 2HB ASP 14 -1.098 2.336 -4.161
86 2HB ASP 14 1HB ASP 14 0.188 2.115 -5.346
87 H GLN 15 H GLN 15 2.057 4.922 -2.395
88 HA GLN 15 HA GLN 15 4.515 4.164 -3.945
89 1HB GLN 15 2HB GLN 15 3.601 6.613 -2.473
90 2HB GLN 15 1HB GLN 15 5.330 6.272 -2.534
91 1HG GLN 15 2HG GLN 15 5.465 6.635 -4.798
92 2HG GLN 15 1HG GLN 15 3.833 6.036 -5.097
93 1HE2 GLN 15 1HE2 GLN 15 2.081 7.562 -5.026
94 2HE2 GLN 15 2HE2 GLN 15 2.326 9.228 -4.817
95 H CYS 16 H CYS 16 3.330 2.396 -2.014
96 HA CYS 16 HA CYS 16 4.765 2.710 0.535
97 1HB CYS 16 2HB CYS 16 2.415 1.633 -0.142
98 2HB CYS 16 1HB CYS 16 3.408 0.187 -0.327
99 H CYS 17 H CYS 17 6.154 0.863 1.331
100 HA CYS 17 HA CYS 17 8.347 0.328 -0.444
101 1HB CYS 17 2HB CYS 17 7.447 -0.372 2.295
102 2HB CYS 17 1HB CYS 17 8.596 -1.496 1.571
103 H LYS 18 H LYS 18 8.275 -1.069 -2.152
104 HA LYS 18 HA LYS 18 6.333 -3.304 -2.192
105 1HB LYS 18 2HB LYS 18 7.884 -1.663 -4.069
106 2HB LYS 18 1HB LYS 18 7.857 -3.370 -4.512
107 1HG LYS 18 2HG LYS 18 5.230 -2.847 -3.742
108 2HG LYS 18 1HG LYS 18 5.707 -1.395 -4.622
109 1HD LYS 18 2HD LYS 18 6.538 -3.949 -5.870
110 2HD LYS 18 1HD LYS 18 4.798 -3.665 -5.829
111 1HE LYS 18 2HE LYS 18 4.930 -1.797 -7.211
112 2HE LYS 18 1HE LYS 18 6.591 -1.420 -6.712
113 1HZ LYS 18 1HZ LYS 18 5.787 -3.809 -8.293
114 2HZ LYS 18 2HZ LYS 18 7.373 -3.384 -7.849
115 3HZ LYS 18 3HZ LYS 18 6.506 -2.416 -8.942
116 H SER 19 H SER 19 9.161 -3.107 -0.650
117 HA SER 19 HA SER 19 10.828 -5.183 -1.706
118 1HB SER 19 2HB SER 19 10.377 -4.012 1.050
119 2HB SER 19 1HB SER 19 11.642 -5.194 0.721
120 HG SER 19 HG SER 19 12.752 -3.704 -0.277
121 H SER 20 H SER 20 8.124 -5.258 0.629
122 HA SER 20 HA SER 20 8.261 -8.253 0.629
123 1HB SER 20 2HB SER 20 7.763 -6.158 2.600
124 2HB SER 20 1HB SER 20 6.477 -7.361 2.599
125 HG SER 20 HG SER 20 7.842 -8.820 3.304
126 H ASN 21 H ASN 21 7.021 -6.520 -1.508
127 HA ASN 21 HA ASN 21 5.045 -6.419 -2.785
128 1HB ASN 21 2HB ASN 21 4.870 -9.036 -1.276
129 2HB ASN 21 1HB ASN 21 3.664 -8.581 -2.480
130 1HD2 ASN 21 1HD2 ASN 21 6.671 -10.124 -2.105
131 2HD2 ASN 21 2HD2 ASN 21 7.172 -10.077 -3.726
132 H LEU 22 H LEU 22 4.562 -4.538 -1.167
133 HA LEU 22 HA LEU 22 2.037 -5.164 0.335
134 1HB LEU 22 2HB LEU 22 4.430 -3.429 0.918
135 2HB LEU 22 1HB LEU 22 2.875 -3.063 1.665
136 HG LEU 22 HG LEU 22 4.120 -5.819 1.778
137 1HD1 LEU 22 1HD1 LEU 22 4.806 -5.182 4.103
138 2HD1 LEU 22 2HD1 LEU 22 4.364 -3.515 3.736
139 3HD1 LEU 22 3HD1 LEU 22 5.679 -4.293 2.855
140 1HD2 LEU 22 1HD2 LEU 22 2.591 -5.830 3.865
141 2HD2 LEU 22 2HD2 LEU 22 1.807 -5.918 2.288
142 3HD2 LEU 22 3HD2 LEU 22 1.849 -4.390 3.167
143 H VAL 23 H VAL 23 0.331 -4.285 -0.745
144 HA VAL 23 HA VAL 23 0.730 -1.725 -2.262
145 HB VAL 23 HB VAL 23 -1.495 -3.769 -2.540
146 1HG1 VAL 23 1HG1 VAL 23 -1.450 -2.741 -4.907
147 2HG1 VAL 23 2HG1 VAL 23 -0.467 -1.463 -4.193
148 3HG1 VAL 23 3HG1 VAL 23 -2.106 -1.747 -3.607
149 1HG2 VAL 23 1HG2 VAL 23 -0.117 -4.495 -4.593
150 2HG2 VAL 23 2HG2 VAL 23 0.471 -5.031 -3.020
151 3HG2 VAL 23 3HG2 VAL 23 1.241 -3.666 -3.831
152 H CYS 24 H CYS 24 -1.225 -0.258 -2.208
153 HA CYS 24 HA CYS 24 -2.232 -0.008 0.551
154 1HB CYS 24 2HB CYS 24 -1.875 1.637 -1.854
155 2HB CYS 24 1HB CYS 24 -3.393 1.967 -1.020
156 H SER 25 H SER 25 -4.329 -0.438 1.192
157 HA SER 25 HA SER 25 -6.033 -2.076 -0.495
158 1HB SER 25 2HB SER 25 -5.699 -2.034 2.073
159 2HB SER 25 1HB SER 25 -6.806 -0.665 2.065
160 HG SER 25 HG SER 25 -8.147 -2.344 2.240
161 H ARG 26 H ARG 26 -8.413 -1.464 -0.794
162 HA ARG 26 HA ARG 26 -8.576 1.278 -1.933
163 1HB ARG 26 2HB ARG 26 -9.991 -1.350 -2.233
164 2HB ARG 26 1HB ARG 26 -10.854 0.120 -2.687
165 1HG ARG 26 2HG ARG 26 -9.608 0.400 -4.552
166 2HG ARG 26 1HG ARG 26 -8.104 0.083 -3.688
167 1HD ARG 26 2HD ARG 26 -9.235 -2.425 -3.732
168 2HD ARG 26 1HD ARG 26 -9.760 -1.761 -5.292
169 HE ARG 26 HE ARG 26 -7.005 -2.365 -4.547
170 1HH1 ARG 26 2HH1 ARG 26 -8.339 -2.397 -7.325
171 2HH1 ARG 26 1HH1 ARG 26 -7.480 -1.113 -8.108
172 1HH2 ARG 26 1HH2 ARG 26 -6.205 0.195 -5.150
173 2HH2 ARG 26 2HH2 ARG 26 -6.268 0.358 -6.873
174 H LYS 27 H LYS 27 -10.288 -0.832 0.389
175 HA LYS 27 HA LYS 27 -12.143 1.315 1.179
176 1HB LYS 27 2HB LYS 27 -11.607 -1.546 1.997
177 2HB LYS 27 1HB LYS 27 -12.773 -0.545 2.862
178 1HG LYS 27 2HG LYS 27 -14.237 -1.338 1.304
179 2HG LYS 27 1HG LYS 27 -13.535 -0.080 0.287
180 1HD LYS 27 2HD LYS 27 -12.469 -1.582 -1.040
181 2HD LYS 27 1HD LYS 27 -11.975 -2.577 0.330
182 1HE LYS 27 2HE LYS 27 -14.885 -2.575 -0.363
183 2HE LYS 27 1HE LYS 27 -13.786 -3.460 -1.439
184 1HZ LYS 27 1HZ LYS 27 -13.886 -3.733 1.522
185 2HZ LYS 27 2HZ LYS 27 -12.845 -4.580 0.479
186 3HZ LYS 27 3HZ LYS 27 -14.520 -4.851 0.416
187 H HIS 28 H HIS 28 -9.232 -0.258 2.449
188 HA HIS 28 HA HIS 28 -9.342 1.338 4.953
189 1HB HIS 28 2HB HIS 28 -7.413 -0.766 3.914
190 2HB HIS 28 1HB HIS 28 -7.398 -0.094 5.542
191 HD1 HIS 28 HD1 HIS 28 -8.014 -3.154 4.689
192 HD2 HIS 28 HD2 HIS 28 -10.802 -0.283 5.857
193 HE1 HIS 28 HE1 HIS 28 -10.040 -4.422 5.527
194 H ALA 29 H ALA 29 -7.554 1.151 1.916
195 HA ALA 29 HA ALA 29 -6.049 2.665 0.918
196 1HB ALA 29 1HB ALA 29 -7.799 4.184 2.247
197 2HB ALA 29 2HB ALA 29 -6.376 4.885 1.477
198 3HB ALA 29 3HB ALA 29 -6.369 4.558 3.209
199 H TRP 30 H TRP 30 -5.472 1.051 3.755
200 HA TRP 30 HA TRP 30 -2.867 2.321 4.362
201 1HB TRP 30 2HB TRP 30 -2.970 1.062 6.361
202 2HB TRP 30 1HB TRP 30 -4.652 1.460 6.039
203 HD1 TRP 30 HD1 TRP 30 -5.224 -0.753 3.817
204 HE1 TRP 30 HE1 TRP 30 -5.413 -3.224 4.517
205 HE3 TRP 30 HE3 TRP 30 -2.721 -0.600 8.262
206 HZ2 TRP 30 HZ2 TRP 30 -4.607 -4.916 6.680
207 HZ3 TRP 30 HZ3 TRP 30 -2.446 -2.653 9.621
208 HH2 TRP 30 HH2 TRP 30 -3.385 -4.809 8.838
209 H CYS 31 H CYS 31 -0.921 0.866 4.523
210 HA CYS 31 HA CYS 31 -0.578 -0.664 2.067
211 1HB CYS 31 2HB CYS 31 1.104 -0.049 4.502
212 2HB CYS 31 1HB CYS 31 1.705 -1.058 3.188
213 H LYS 32 H LYS 32 -1.073 -2.790 1.833
214 HA LYS 32 HA LYS 32 -0.740 -4.658 4.123
215 1HB LYS 32 2HB LYS 32 -3.052 -5.500 3.761
216 2HB LYS 32 1HB LYS 32 -3.048 -3.801 4.229
217 1HG LYS 32 2HG LYS 32 -3.578 -3.069 2.061
218 2HG LYS 32 1HG LYS 32 -3.024 -4.569 1.317
219 1HD LYS 32 2HD LYS 32 -5.014 -5.456 3.009
220 2HD LYS 32 1HD LYS 32 -5.651 -3.907 2.458
221 1HE LYS 32 2HE LYS 32 -6.359 -5.109 0.640
222 2HE LYS 32 1HE LYS 32 -4.671 -4.974 0.110
223 1HZ LYS 32 1HZ LYS 32 -5.379 -7.295 0.192
224 2HZ LYS 32 2HZ LYS 32 -5.773 -7.133 1.836
225 3HZ LYS 32 3HZ LYS 32 -4.156 -6.996 1.329
226 H TYR 33 H TYR 33 -1.410 -6.992 3.182
227 HA TYR 33 HA TYR 33 0.240 -7.372 0.762
228 1HB TYR 33 2HB TYR 33 -1.179 -9.241 2.692
229 2HB TYR 33 1HB TYR 33 -0.144 -9.790 1.374
230 HD1 TYR 33 HD1 TYR 33 2.282 -8.960 1.307
231 HD2 TYR 33 HD2 TYR 33 -0.249 -8.542 4.755
232 HE1 TYR 33 HE1 TYR 33 4.280 -8.604 2.732
233 HE2 TYR 33 HE2 TYR 33 1.750 -8.187 6.178
234 HH TYR 33 HH TYR 33 4.497 -9.017 5.731
235 H GLU 34 H GLU 34 -1.223 -6.373 -0.806
236 HA GLU 34 HA GLU 34 -3.886 -7.608 -1.215
237 1HB GLU 34 2HB GLU 34 -2.977 -5.085 -1.424
238 2HB GLU 34 1HB GLU 34 -2.683 -5.609 -3.082
239 1HG GLU 34 2HG GLU 34 -5.241 -6.586 -2.469
240 2HG GLU 34 1HG GLU 34 -5.202 -4.961 -1.783
241 H ILE 35 H ILE 35 -4.455 -8.661 -3.215
242 HA ILE 35 HA ILE 35 -2.411 -10.367 -4.345
243 HB ILE 35 HB ILE 35 -4.305 -11.068 -5.822
244 1HG1 ILE 35 2HG1 ILE 35 -6.390 -9.567 -4.512
245 2HG1 ILE 35 1HG1 ILE 35 -5.243 -8.449 -5.246
246 1HG2 ILE 35 1HG2 ILE 35 -5.712 -11.936 -4.037
247 2HG2 ILE 35 2HG2 ILE 35 -5.120 -10.700 -2.927
248 3HG2 ILE 35 3HG2 ILE 35 -4.030 -11.959 -3.506
249 1HD1 ILE 35 1HD1 ILE 35 -6.961 -9.031 -6.880
250 2HD1 ILE 35 2HD1 ILE 35 -6.645 -10.749 -6.637
251 3HD1 ILE 35 3HD1 ILE 35 -5.419 -9.724 -7.382
252 1HN NH2 36 1HN NH2 36 -2.551 -6.932 -6.476
253 2HN NH2 36 2HN NH2 36 -2.747 -7.174 -4.727