Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
27155 | 2p81 RC | 7386 | cing | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 1H ALA 16 1H ALA 16 -13.156 17.317 -11.906
2 2H ALA 16 2H ALA 16 -12.606 18.908 -12.238
3 3H ALA 16 3H ALA 16 -13.294 18.536 -10.710
4 HA ALA 16 HA ALA 16 -10.778 17.491 -11.819
5 1HB ALA 16 1HB ALA 16 -9.648 18.965 -10.492
6 2HB ALA 16 2HB ALA 16 -10.961 19.093 -9.322
7 3HB ALA 16 3HB ALA 16 -11.073 19.934 -10.868
8 H LYS 17 H LYS 17 -12.881 17.686 -8.949
9 HA LYS 17 HA LYS 17 -11.573 15.386 -7.765
10 1HB LYS 17 1HB LYS 17 -13.283 15.753 -5.938
11 2HB LYS 17 2HB LYS 17 -12.167 17.083 -6.216
12 1HG LYS 17 1HG LYS 17 -13.821 18.363 -7.320
13 2HG LYS 17 2HG LYS 17 -14.916 16.983 -7.424
14 1HD LYS 17 1HD LYS 17 -15.128 16.968 -4.986
15 2HD LYS 17 2HD LYS 17 -14.028 18.344 -4.880
16 1HE LYS 17 1HE LYS 17 -15.858 19.298 -6.628
17 2HE LYS 17 2HE LYS 17 -16.870 18.239 -5.646
18 1HZ LYS 17 1HZ LYS 17 -15.664 19.449 -3.702
19 2HZ LYS 17 2HZ LYS 17 -16.976 20.185 -4.474
20 3HZ LYS 17 3HZ LYS 17 -15.398 20.654 -4.860
21 H ARG 18 H ARG 18 -12.147 13.373 -8.203
22 HA ARG 18 HA ARG 18 -14.922 12.620 -8.408
23 1HB ARG 18 1HB ARG 18 -13.074 12.378 -10.784
24 2HB ARG 18 2HB ARG 18 -14.583 11.488 -10.633
25 1HG ARG 18 1HG ARG 18 -15.650 13.818 -10.304
26 2HG ARG 18 2HG ARG 18 -14.151 14.419 -11.016
27 1HD ARG 18 1HD ARG 18 -15.808 14.140 -12.748
28 2HD ARG 18 2HD ARG 18 -14.525 12.951 -12.964
29 HE ARG 18 HE ARG 18 -16.376 11.615 -11.507
30 1HH1 ARG 18 1HH1 ARG 18 -16.524 13.424 -14.488
31 2HH1 ARG 18 2HH1 ARG 18 -17.818 12.479 -15.143
32 1HH2 ARG 18 1HH2 ARG 18 -18.078 10.371 -12.367
33 2HH2 ARG 18 2HH2 ARG 18 -18.701 10.746 -13.939
34 H GLU 19 H GLU 19 -11.701 11.381 -9.319
35 HA GLU 19 HA GLU 19 -12.010 9.243 -7.353
36 1HB GLU 19 1HB GLU 19 -12.655 8.701 -9.919
37 2HB GLU 19 2HB GLU 19 -10.927 8.379 -9.969
38 1HG GLU 19 1HG GLU 19 -12.283 7.191 -7.673
39 2HG GLU 19 2HG GLU 19 -12.854 6.598 -9.232
40 H PHE 20 H PHE 20 -9.909 7.915 -7.257
41 HA PHE 20 HA PHE 20 -7.580 9.629 -7.781
42 1HB PHE 20 1HB PHE 20 -6.661 9.025 -5.566
43 2HB PHE 20 2HB PHE 20 -8.163 9.933 -5.438
44 HD1 PHE 20 HD1 PHE 20 -6.926 6.420 -5.535
45 HD2 PHE 20 HD2 PHE 20 -9.811 9.163 -4.031
46 HE1 PHE 20 HE1 PHE 20 -7.871 4.643 -4.119
47 HE2 PHE 20 HE2 PHE 20 -10.761 7.392 -2.612
48 HZ PHE 20 HZ PHE 20 -9.792 5.128 -2.656
49 H ASN 21 H ASN 21 -5.553 8.128 -6.919
50 HA ASN 21 HA ASN 21 -5.450 6.024 -8.847
51 1HB ASN 21 1HB ASN 21 -3.475 6.777 -6.688
52 2HB ASN 21 2HB ASN 21 -3.162 5.671 -8.021
53 1HD2 ASN 21 1HD2 ASN 21 -2.286 6.489 -9.782
54 2HD2 ASN 21 2HD2 ASN 21 -2.247 8.162 -10.211
55 H GLU 22 H GLU 22 -6.768 4.341 -8.399
56 HA GLU 22 HA GLU 22 -7.143 3.244 -5.811
57 1HB GLU 22 1HB GLU 22 -8.399 2.967 -8.237
58 2HB GLU 22 2HB GLU 22 -7.588 1.416 -8.069
59 1HG GLU 22 1HG GLU 22 -8.649 1.582 -5.635
60 2HG GLU 22 2HG GLU 22 -9.811 2.580 -6.507
61 H ASN 23 H ASN 23 -4.936 3.057 -5.120
62 HA ASN 23 HA ASN 23 -3.062 1.879 -4.622
63 1HB ASN 23 1HB ASN 23 -4.228 -0.474 -6.076
64 2HB ASN 23 2HB ASN 23 -3.112 -0.467 -4.718
65 1HD2 ASN 23 1HD2 ASN 23 -4.191 1.064 -2.878
66 2HD2 ASN 23 2HD2 ASN 23 -5.756 0.506 -2.402
67 H ARG 24 H ARG 24 -1.987 3.255 -6.083
68 HA ARG 24 HA ARG 24 -0.509 1.840 -8.100
69 1HB ARG 24 1HB ARG 24 -2.228 4.194 -8.922
70 2HB ARG 24 2HB ARG 24 -1.054 3.376 -9.944
71 1HG ARG 24 1HG ARG 24 -2.419 1.279 -9.620
72 2HG ARG 24 2HG ARG 24 -3.653 2.307 -8.886
73 1HD ARG 24 1HD ARG 24 -3.354 3.708 -11.077
74 2HD ARG 24 2HD ARG 24 -2.699 2.201 -11.714
75 HE ARG 24 HE ARG 24 -5.164 1.705 -10.440
76 1HH1 ARG 24 1HH1 ARG 24 -3.850 3.183 -13.315
77 2HH1 ARG 24 2HH1 ARG 24 -5.271 2.898 -14.263
78 1HH2 ARG 24 1HH2 ARG 24 -7.034 1.328 -11.685
79 2HH2 ARG 24 2HH2 ARG 24 -7.079 1.846 -13.337
80 H TYR 25 H TYR 25 -1.378 5.156 -7.173
81 HA TYR 25 HA TYR 25 0.848 6.569 -7.683
82 1HB TYR 25 1HB TYR 25 0.279 8.026 -5.815
83 2HB TYR 25 2HB TYR 25 -1.191 7.474 -6.613
84 HD1 TYR 25 HD1 TYR 25 -2.129 5.169 -5.551
85 HD2 TYR 25 HD2 TYR 25 0.252 8.043 -3.510
86 HE1 TYR 25 HE1 TYR 25 -2.973 4.329 -3.407
87 HE2 TYR 25 HE2 TYR 25 -0.592 7.215 -1.354
88 HH TYR 25 HH TYR 25 -3.269 5.289 -1.043
89 H LEU 26 H LEU 26 0.402 4.577 -4.779
90 HA LEU 26 HA LEU 26 3.316 4.647 -4.391
91 1HB LEU 26 1HB LEU 26 3.126 5.079 -2.185
92 2HB LEU 26 2HB LEU 26 1.616 5.801 -2.690
93 HG LEU 26 HG LEU 26 1.123 4.575 -0.744
94 1HD1 LEU 26 1HD1 LEU 26 -0.709 3.593 -1.520
95 2HD1 LEU 26 2HD1 LEU 26 0.214 2.384 -2.410
96 3HD1 LEU 26 3HD1 LEU 26 -0.102 3.960 -3.133
97 1HD2 LEU 26 1HD2 LEU 26 1.977 1.918 -1.596
98 2HD2 LEU 26 2HD2 LEU 26 2.174 2.735 -0.045
99 3HD2 LEU 26 3HD2 LEU 26 3.307 3.051 -1.359
100 H THR 27 H THR 27 0.513 2.737 -4.777
101 HA THR 27 HA THR 27 1.169 0.379 -3.491
102 HB THR 27 HB THR 27 -0.345 0.896 -6.046
103 HG1 THR 27 HG1 THR 27 -1.161 0.215 -3.418
104 1HG2 THR 27 1HG2 THR 27 -1.361 -1.369 -5.650
105 2HG2 THR 27 2HG2 THR 27 0.012 -1.706 -4.596
106 3HG2 THR 27 3HG2 THR 27 0.276 -1.359 -6.305
107 H GLU 28 H GLU 28 1.400 0.583 -7.023
108 HA GLU 28 HA GLU 28 3.299 -1.464 -7.245
109 1HB GLU 28 1HB GLU 28 2.717 0.760 -9.205
110 2HB GLU 28 2HB GLU 28 3.537 -0.751 -9.575
111 1HG GLU 28 1HG GLU 28 1.358 -1.845 -8.681
112 2HG GLU 28 2HG GLU 28 0.656 -0.256 -8.984
113 H ARG 29 H ARG 29 3.676 2.015 -6.931
114 HA ARG 29 HA ARG 29 6.406 2.142 -7.643
115 1HB ARG 29 1HB ARG 29 4.397 3.947 -6.790
116 2HB ARG 29 2HB ARG 29 5.763 4.154 -5.704
117 1HG ARG 29 1HG ARG 29 5.933 4.255 -8.708
118 2HG ARG 29 2HG ARG 29 5.817 5.664 -7.653
119 1HD ARG 29 1HD ARG 29 8.019 5.637 -7.377
120 2HD ARG 29 2HD ARG 29 7.913 4.022 -6.676
121 HE ARG 29 HE ARG 29 7.831 3.567 -9.350
122 1HH1 ARG 29 1HH1 ARG 29 10.020 5.312 -7.266
123 2HH1 ARG 29 2HH1 ARG 29 11.404 5.016 -8.264
124 1HH2 ARG 29 1HH2 ARG 29 9.650 3.177 -10.664
125 2HH2 ARG 29 2HH2 ARG 29 11.194 3.806 -10.194
126 H ARG 30 H ARG 30 4.812 1.943 -4.469
127 HA ARG 30 HA ARG 30 7.332 1.719 -3.092
128 1HB ARG 30 1HB ARG 30 5.034 2.701 -2.263
129 2HB ARG 30 2HB ARG 30 4.729 1.034 -1.796
130 1HG ARG 30 1HG ARG 30 6.206 1.096 -0.098
131 2HG ARG 30 2HG ARG 30 7.332 2.136 -0.972
132 1HD ARG 30 1HD ARG 30 4.986 3.643 -0.487
133 2HD ARG 30 2HD ARG 30 5.417 2.840 1.022
134 HE ARG 30 HE ARG 30 7.754 3.925 0.032
135 1HH1 ARG 30 1HH1 ARG 30 4.636 5.104 1.063
136 2HH1 ARG 30 2HH1 ARG 30 5.249 6.636 1.588
137 1HH2 ARG 30 1HH2 ARG 30 8.563 5.939 0.721
138 2HH2 ARG 30 2HH2 ARG 30 7.479 7.111 1.392
139 H ARG 31 H ARG 31 4.987 -0.467 -4.422
140 HA ARG 31 HA ARG 31 5.582 -2.747 -2.886
141 1HB ARG 31 1HB ARG 31 4.259 -2.223 -5.489
142 2HB ARG 31 2HB ARG 31 4.833 -3.860 -5.212
143 1HG ARG 31 1HG ARG 31 3.559 -3.829 -3.046
144 2HG ARG 31 2HG ARG 31 2.838 -2.312 -3.585
145 1HD ARG 31 1HD ARG 31 1.422 -4.280 -4.059
146 2HD ARG 31 2HD ARG 31 1.881 -3.395 -5.512
147 HE ARG 31 HE ARG 31 2.770 -6.057 -4.722
148 1HH1 ARG 31 1HH1 ARG 31 3.043 -3.390 -6.964
149 2HH1 ARG 31 2HH1 ARG 31 3.791 -4.345 -8.198
150 1HH2 ARG 31 1HH2 ARG 31 3.755 -7.307 -6.347
151 2HH2 ARG 31 2HH2 ARG 31 4.195 -6.565 -7.849
152 H GLN 32 H GLN 32 6.959 -1.548 -5.925
153 HA GLN 32 HA GLN 32 8.713 -3.769 -6.264
154 1HB GLN 32 1HB GLN 32 9.734 -2.472 -8.039
155 2HB GLN 32 2HB GLN 32 7.985 -2.338 -8.141
156 1HG GLN 32 1HG GLN 32 8.420 -0.157 -8.385
157 2HG GLN 32 2HG GLN 32 8.540 -0.183 -6.627
158 1HE2 GLN 32 1HE2 GLN 32 9.893 1.286 -8.989
159 2HE2 GLN 32 2HE2 GLN 32 11.566 1.245 -8.561
160 H GLN 33 H GLN 33 9.008 -0.591 -4.780
161 HA GLN 33 HA GLN 33 11.825 -0.814 -4.311
162 1HB GLN 33 1HB GLN 33 9.674 1.095 -3.490
163 2HB GLN 33 2HB GLN 33 11.212 1.125 -2.639
164 1HG GLN 33 1HG GLN 33 12.354 1.928 -4.437
165 2HG GLN 33 2HG GLN 33 11.265 1.180 -5.604
166 1HE2 GLN 33 1HE2 GLN 33 10.662 3.358 -2.877
167 2HE2 GLN 33 2HE2 GLN 33 9.889 4.591 -3.807
168 H LEU 34 H LEU 34 8.901 -1.392 -2.421
169 HA LEU 34 HA LEU 34 10.170 -1.821 0.060
170 1HB LEU 34 1HB LEU 34 7.522 -2.590 -1.099
171 2HB LEU 34 2HB LEU 34 8.019 -3.259 0.443
172 HG LEU 34 HG LEU 34 7.568 -0.354 -0.226
173 1HD1 LEU 34 1HD1 LEU 34 5.778 -2.237 0.536
174 2HD1 LEU 34 2HD1 LEU 34 5.632 -0.517 0.898
175 3HD1 LEU 34 3HD1 LEU 34 6.305 -1.618 2.099
176 1HD2 LEU 34 1HD2 LEU 34 8.023 -0.313 2.408
177 2HD2 LEU 34 2HD2 LEU 34 9.287 -0.027 1.213
178 3HD2 LEU 34 3HD2 LEU 34 9.117 -1.619 1.952
179 H SER 35 H SER 35 9.452 -3.946 -2.646
180 HA SER 35 HA SER 35 10.034 -6.391 -1.401
181 1HB SER 35 1HB SER 35 10.256 -7.300 -3.637
182 2HB SER 35 2HB SER 35 8.925 -6.143 -3.626
183 HG SER 35 HG SER 35 9.973 -5.321 -5.258
184 H SER 36 H SER 36 12.111 -4.311 -3.418
185 HA SER 36 HA SER 36 14.460 -5.844 -2.994
186 1HB SER 36 1HB SER 36 15.633 -3.856 -3.947
187 2HB SER 36 2HB SER 36 14.284 -4.411 -4.938
188 HG SER 36 HG SER 36 13.432 -2.518 -4.700
189 H GLU 37 H GLU 37 13.094 -3.010 -1.407
190 HA GLU 37 HA GLU 37 15.337 -2.411 0.206
191 1HB GLU 37 1HB GLU 37 12.415 -1.724 0.392
192 2HB GLU 37 2HB GLU 37 13.558 -1.212 1.625
193 1HG GLU 37 1HG GLU 37 13.857 -0.577 -1.298
194 2HG GLU 37 2HG GLU 37 13.069 0.486 -0.133
195 H LEU 38 H LEU 38 12.352 -4.224 0.897
196 HA LEU 38 HA LEU 38 13.331 -4.969 3.518
197 1HB LEU 38 1HB LEU 38 10.810 -5.533 1.987
198 2HB LEU 38 2HB LEU 38 11.174 -6.379 3.478
199 HG LEU 38 HG LEU 38 11.173 -4.302 4.720
200 1HD1 LEU 38 1HD1 LEU 38 12.088 -2.740 3.210
201 2HD1 LEU 38 2HD1 LEU 38 10.435 -2.205 3.513
202 3HD1 LEU 38 3HD1 LEU 38 10.829 -3.043 2.013
203 1HD2 LEU 38 1HD2 LEU 38 8.843 -5.013 3.021
204 2HD2 LEU 38 2HD2 LEU 38 8.757 -3.530 3.971
205 3HD2 LEU 38 3HD2 LEU 38 9.029 -5.077 4.774
206 H GLY 39 H GLY 39 13.401 -6.261 0.332
207 1HA GLY 39 1HA GLY 39 14.492 -8.130 -0.464
208 2HA GLY 39 2HA GLY 39 15.011 -8.468 1.181
209 H LEU 40 H LEU 40 11.643 -8.054 0.393
210 HA LEU 40 HA LEU 40 11.233 -10.918 0.928
211 1HB LEU 40 1HB LEU 40 8.771 -9.960 1.256
212 2HB LEU 40 2HB LEU 40 9.951 -9.990 2.554
213 HG LEU 40 HG LEU 40 10.524 -7.597 1.904
214 1HD1 LEU 40 1HD1 LEU 40 7.836 -7.591 0.586
215 2HD1 LEU 40 2HD1 LEU 40 9.303 -7.901 -0.342
216 3HD1 LEU 40 3HD1 LEU 40 9.112 -6.374 0.520
217 1HD2 LEU 40 1HD2 LEU 40 8.121 -6.874 2.849
218 2HD2 LEU 40 2HD2 LEU 40 9.384 -7.580 3.857
219 3HD2 LEU 40 3HD2 LEU 40 8.083 -8.595 3.233
220 H ASN 41 H ASN 41 9.338 -11.903 -0.164
221 HA ASN 41 HA ASN 41 9.420 -11.239 -2.985
222 1HB ASN 41 1HB ASN 41 9.340 -13.619 -1.676
223 2HB ASN 41 2HB ASN 41 7.637 -13.411 -2.074
224 1HD2 ASN 41 1HD2 ASN 41 7.193 -12.828 -4.371
225 2HD2 ASN 41 2HD2 ASN 41 8.144 -13.607 -5.585
226 H GLU 42 H GLU 42 7.556 -10.885 -4.269
227 HA GLU 42 HA GLU 42 5.748 -9.009 -3.331
228 1HB GLU 42 1HB GLU 42 5.362 -10.973 -5.600
229 2HB GLU 42 2HB GLU 42 4.447 -9.488 -5.372
230 1HG GLU 42 1HG GLU 42 6.352 -8.144 -5.802
231 2HG GLU 42 2HG GLU 42 7.430 -9.538 -5.733
232 H ALA 43 H ALA 43 5.624 -12.488 -3.211
233 HA ALA 43 HA ALA 43 2.888 -12.881 -2.747
234 1HB ALA 43 1HB ALA 43 3.750 -14.924 -1.407
235 2HB ALA 43 2HB ALA 43 5.343 -14.417 -1.971
236 3HB ALA 43 3HB ALA 43 4.087 -14.838 -3.136
237 H GLN 44 H GLN 44 5.507 -11.901 -0.653
238 HA GLN 44 HA GLN 44 3.927 -11.968 1.766
239 1HB GLN 44 1HB GLN 44 6.651 -10.850 1.095
240 2HB GLN 44 2HB GLN 44 5.932 -10.725 2.695
241 1HG GLN 44 1HG GLN 44 6.426 -13.335 1.287
242 2HG GLN 44 2HG GLN 44 7.564 -12.591 2.409
243 1HE2 GLN 44 1HE2 GLN 44 6.101 -11.711 4.427
244 2HE2 GLN 44 2HE2 GLN 44 5.228 -12.991 5.190
245 H ILE 45 H ILE 45 4.767 -9.777 -0.758
246 HA ILE 45 HA ILE 45 4.154 -7.323 0.479
247 HB ILE 45 HB ILE 45 4.193 -8.160 -2.420
248 1HG1 ILE 45 1HG1 ILE 45 6.329 -8.154 -1.075
249 2HG1 ILE 45 2HG1 ILE 45 6.340 -7.116 -2.498
250 1HG2 ILE 45 1HG2 ILE 45 3.958 -5.936 -3.124
251 2HG2 ILE 45 2HG2 ILE 45 4.148 -5.311 -1.490
252 3HG2 ILE 45 3HG2 ILE 45 2.678 -6.172 -1.937
253 1HD1 ILE 45 1HD1 ILE 45 6.066 -6.289 0.375
254 2HD1 ILE 45 2HD1 ILE 45 5.793 -5.199 -0.984
255 3HD1 ILE 45 3HD1 ILE 45 7.381 -5.929 -0.743
256 H LYS 46 H LYS 46 2.182 -9.643 -1.342
257 HA LYS 46 HA LYS 46 -0.137 -8.087 -1.588
258 1HB LYS 46 1HB LYS 46 0.569 -10.576 -2.400
259 2HB LYS 46 2HB LYS 46 -0.515 -10.978 -1.075
260 1HG LYS 46 1HG LYS 46 -2.001 -9.133 -2.350
261 2HG LYS 46 2HG LYS 46 -1.094 -9.802 -3.709
262 1HD LYS 46 1HD LYS 46 -2.365 -11.659 -1.749
263 2HD LYS 46 2HD LYS 46 -3.372 -10.869 -2.965
264 1HE LYS 46 1HE LYS 46 -2.559 -12.136 -4.627
265 2HE LYS 46 2HE LYS 46 -0.903 -12.016 -4.034
266 1HZ LYS 46 1HZ LYS 46 -1.270 -14.203 -3.653
267 2HZ LYS 46 2HZ LYS 46 -2.941 -14.026 -3.464
268 3HZ LYS 46 3HZ LYS 46 -1.899 -13.613 -2.198
269 H ILE 47 H ILE 47 0.816 -10.421 0.897
270 HA ILE 47 HA ILE 47 -1.428 -9.975 2.593
271 HB ILE 47 HB ILE 47 1.150 -11.421 2.768
272 1HG1 ILE 47 1HG1 ILE 47 -0.837 -12.823 4.115
273 2HG1 ILE 47 2HG1 ILE 47 -1.712 -11.963 2.852
274 1HG2 ILE 47 1HG2 ILE 47 0.825 -11.822 5.229
275 2HG2 ILE 47 2HG2 ILE 47 -0.282 -10.450 5.230
276 3HG2 ILE 47 3HG2 ILE 47 1.412 -10.215 4.795
277 1HD1 ILE 47 1HD1 ILE 47 0.760 -13.354 2.038
278 2HD1 ILE 47 2HD1 ILE 47 -0.780 -13.179 1.196
279 3HD1 ILE 47 3HD1 ILE 47 -0.613 -14.361 2.495
280 H TRP 48 H TRP 48 1.867 -8.786 2.481
281 HA TRP 48 HA TRP 48 1.943 -7.297 4.833
282 1HB TRP 48 1HB TRP 48 3.906 -7.863 3.484
283 2HB TRP 48 2HB TRP 48 3.314 -6.868 2.168
284 HD1 TRP 48 HD1 TRP 48 5.602 -6.788 5.037
285 HE1 TRP 48 HE1 TRP 48 6.456 -4.397 5.423
286 HE3 TRP 48 HE3 TRP 48 2.296 -4.209 2.130
287 HZ2 TRP 48 HZ2 TRP 48 5.828 -1.784 4.642
288 HZ3 TRP 48 HZ3 TRP 48 2.486 -1.769 2.008
289 HH2 TRP 48 HH2 TRP 48 4.225 -0.586 3.227
290 H PHE 49 H PHE 49 1.132 -6.286 1.535
291 HA PHE 49 HA PHE 49 0.440 -3.638 2.309
292 1HB PHE 49 1HB PHE 49 0.260 -5.214 -0.206
293 2HB PHE 49 2HB PHE 49 -0.749 -3.769 -0.061
294 HD1 PHE 49 HD1 PHE 49 2.671 -5.042 -0.155
295 HD2 PHE 49 HD2 PHE 49 0.216 -1.584 0.069
296 HE1 PHE 49 HE1 PHE 49 4.645 -3.635 -0.558
297 HE2 PHE 49 HE2 PHE 49 2.189 -0.156 -0.347
298 HZ PHE 49 HZ PHE 49 4.414 -1.195 -0.633
299 H GLN 50 H GLN 50 -1.432 -6.551 1.690
300 HA GLN 50 HA GLN 50 -3.947 -5.325 1.990
301 1HB GLN 50 1HB GLN 50 -2.995 -8.171 2.192
302 2HB GLN 50 2HB GLN 50 -4.665 -7.752 2.543
303 1HG GLN 50 1HG GLN 50 -3.981 -6.537 0.083
304 2HG GLN 50 2HG GLN 50 -3.429 -8.210 0.029
305 1HE2 GLN 50 1HE2 GLN 50 -4.962 -9.883 0.350
306 2HE2 GLN 50 2HE2 GLN 50 -6.639 -9.618 0.031
307 H ASN 51 H ASN 51 -1.608 -6.602 4.259
308 HA ASN 51 HA ASN 51 -3.389 -6.657 6.501
309 1HB ASN 51 1HB ASN 51 -0.456 -6.999 6.085
310 2HB ASN 51 2HB ASN 51 -1.019 -6.616 7.709
311 1HD2 ASN 51 1HD2 ASN 51 0.241 -8.954 7.309
312 2HD2 ASN 51 2HD2 ASN 51 -0.873 -10.271 7.399
313 H LYS 52 H LYS 52 -1.213 -4.309 5.085
314 HA LYS 52 HA LYS 52 -1.234 -2.495 7.280
315 1HB LYS 52 1HB LYS 52 0.131 -2.709 4.850
316 2HB LYS 52 2HB LYS 52 -0.792 -1.219 4.713
317 1HG LYS 52 1HG LYS 52 1.043 -0.355 5.693
318 2HG LYS 52 2HG LYS 52 0.215 -0.871 7.164
319 1HD LYS 52 1HD LYS 52 2.185 -2.601 5.680
320 2HD LYS 52 2HD LYS 52 2.647 -1.518 6.995
321 1HE LYS 52 1HE LYS 52 1.270 -2.703 8.547
322 2HE LYS 52 2HE LYS 52 0.546 -3.661 7.256
323 1HZ LYS 52 1HZ LYS 52 2.087 -5.134 7.967
324 2HZ LYS 52 2HZ LYS 52 3.143 -3.948 8.550
325 3HZ LYS 52 3HZ LYS 52 3.080 -4.283 6.893
326 H ARG 53 H ARG 53 -3.272 -3.000 4.488
327 HA ARG 53 HA ARG 53 -4.712 -0.523 4.825
328 1HB ARG 53 1HB ARG 53 -4.660 -2.728 2.892
329 2HB ARG 53 2HB ARG 53 -6.271 -2.088 3.187
330 1HG ARG 53 1HG ARG 53 -4.309 0.015 2.815
331 2HG ARG 53 2HG ARG 53 -4.396 -1.080 1.434
332 1HD ARG 53 1HD ARG 53 -6.753 0.305 2.711
333 2HD ARG 53 2HD ARG 53 -5.943 0.833 1.237
334 HE ARG 53 HE ARG 53 -6.632 -1.716 0.670
335 1HH1 ARG 53 1HH1 ARG 53 -8.432 1.013 1.894
336 2HH1 ARG 53 2HH1 ARG 53 -9.926 0.506 1.181
337 1HH2 ARG 53 1HH2 ARG 53 -8.596 -2.383 -0.269
338 2HH2 ARG 53 2HH2 ARG 53 -10.020 -1.421 -0.048
339 H ALA 54 H ALA 54 -5.020 -3.834 5.854
340 HA ALA 54 HA ALA 54 -7.769 -3.753 6.561
341 1HB ALA 54 1HB ALA 54 -6.005 -5.558 8.084
342 2HB ALA 54 2HB ALA 54 -5.969 -5.740 6.330
343 3HB ALA 54 3HB ALA 54 -7.493 -5.898 7.202
344 H LYS 55 H LYS 55 -4.977 -3.972 8.770
345 HA LYS 55 HA LYS 55 -6.414 -3.087 11.023
346 1HB LYS 55 1HB LYS 55 -3.618 -3.707 10.371
347 2HB LYS 55 2HB LYS 55 -3.807 -2.500 11.635
348 1HG LYS 55 1HG LYS 55 -4.964 -5.279 11.620
349 2HG LYS 55 2HG LYS 55 -3.626 -4.694 12.610
350 1HD LYS 55 1HD LYS 55 -5.881 -2.973 12.973
351 2HD LYS 55 2HD LYS 55 -6.390 -4.647 13.201
352 1HE LYS 55 1HE LYS 55 -4.003 -3.396 14.552
353 2HE LYS 55 2HE LYS 55 -5.603 -3.520 15.282
354 1HZ LYS 55 1HZ LYS 55 -4.143 -5.892 14.281
355 2HZ LYS 55 2HZ LYS 55 -5.463 -5.844 15.338
356 3HZ LYS 55 3HZ LYS 55 -3.944 -5.316 15.860
357 H ILE 56 H ILE 56 -4.205 -1.378 8.830
358 HA ILE 56 HA ILE 56 -3.947 0.835 8.357
359 HB ILE 56 HB ILE 56 -6.516 1.330 9.855
360 1HG1 ILE 56 1HG1 ILE 56 -6.221 0.648 6.924
361 2HG1 ILE 56 2HG1 ILE 56 -6.730 -0.506 8.152
362 1HG2 ILE 56 1HG2 ILE 56 -6.694 3.157 8.114
363 2HG2 ILE 56 2HG2 ILE 56 -5.009 2.817 7.721
364 3HG2 ILE 56 3HG2 ILE 56 -5.443 3.367 9.339
365 1HD1 ILE 56 1HD1 ILE 56 -8.532 0.637 6.760
366 2HD1 ILE 56 2HD1 ILE 56 -8.192 2.071 7.728
367 3HD1 ILE 56 3HD1 ILE 56 -8.753 0.593 8.509
368 H LYS 57 H LYS 57 -2.179 1.383 9.518
369 HA LYS 57 HA LYS 57 -0.863 2.099 11.236
370 1HB LYS 57 1HB LYS 57 -1.360 4.249 11.935
371 2HB LYS 57 2HB LYS 57 -2.311 4.108 10.466
372 1HG LYS 57 1HG LYS 57 -3.978 3.246 12.558
373 2HG LYS 57 2HG LYS 57 -3.161 4.695 13.137
374 1HD LYS 57 1HD LYS 57 -4.061 6.026 11.472
375 2HD LYS 57 2HD LYS 57 -4.359 4.657 10.399
376 1HE LYS 57 1HE LYS 57 -5.964 3.967 12.421
377 2HE LYS 57 2HE LYS 57 -5.988 5.717 12.634
378 1HZ LYS 57 1HZ LYS 57 -7.461 4.224 10.831
379 2HZ LYS 57 2HZ LYS 57 -6.324 5.064 9.903
380 3HZ LYS 57 3HZ LYS 57 -7.367 5.911 10.930
381 H LYS 58 H LYS 58 -1.251 3.038 13.746
382 HA LYS 58 HA LYS 58 -2.641 0.832 15.119
383 1HB LYS 58 1HB LYS 58 0.058 1.132 15.070
384 2HB LYS 58 2HB LYS 58 -0.343 2.063 16.506
385 1HG LYS 58 1HG LYS 58 -0.942 0.239 17.690
386 2HG LYS 58 2HG LYS 58 -1.609 -0.591 16.283
387 1HD LYS 58 1HD LYS 58 1.044 -0.519 15.668
388 2HD LYS 58 2HD LYS 58 1.094 -0.679 17.425
389 1HE LYS 58 1HE LYS 58 0.867 -2.873 17.041
390 2HE LYS 58 2HE LYS 58 -0.829 -2.495 16.745
391 1HZ LYS 58 1HZ LYS 58 -0.590 -2.731 14.517
392 2HZ LYS 58 2HZ LYS 58 0.640 -3.788 14.998
393 3HZ LYS 58 3HZ LYS 58 1.022 -2.217 14.502
394 H SER 59 H SER 59 -1.516 4.181 15.342
395 HA SER 59 HA SER 59 -2.321 5.990 16.458
396 1HB SER 59 1HB SER 59 -4.709 4.276 16.087
397 2HB SER 59 2HB SER 59 -4.846 5.536 17.313
398 HG SER 59 HG SER 59 -5.087 6.897 15.747
Start of MODEL 2
1 1H ALA 16 1H ALA 16 -22.642 11.347 -10.281
2 2H ALA 16 2H ALA 16 -21.209 10.598 -10.855
3 3H ALA 16 3H ALA 16 -21.126 11.761 -9.596
4 HA ALA 16 HA ALA 16 -22.069 10.381 -8.066
5 1HB ALA 16 1HB ALA 16 -22.832 8.021 -9.060
6 2HB ALA 16 2HB ALA 16 -23.162 9.037 -10.463
7 3HB ALA 16 3HB ALA 16 -23.925 9.397 -8.914
8 H LYS 17 H LYS 17 -20.769 9.050 -6.906
9 HA LYS 17 HA LYS 17 -18.928 7.843 -6.339
10 1HB LYS 17 1HB LYS 17 -19.974 6.609 -8.751
11 2HB LYS 17 2HB LYS 17 -18.234 6.392 -8.620
12 1HG LYS 17 1HG LYS 17 -19.036 5.790 -6.096
13 2HG LYS 17 2HG LYS 17 -20.405 5.216 -7.049
14 1HD LYS 17 1HD LYS 17 -18.847 3.923 -8.457
15 2HD LYS 17 2HD LYS 17 -17.510 4.460 -7.440
16 1HE LYS 17 1HE LYS 17 -18.101 2.296 -6.684
17 2HE LYS 17 2HE LYS 17 -18.727 3.432 -5.490
18 1HZ LYS 17 1HZ LYS 17 -20.826 3.221 -7.099
19 2HZ LYS 17 2HZ LYS 17 -20.583 2.212 -5.764
20 3HZ LYS 17 3HZ LYS 17 -20.160 1.681 -7.313
21 H ARG 18 H ARG 18 -16.661 7.066 -7.588
22 HA ARG 18 HA ARG 18 -15.585 9.087 -9.301
23 1HB ARG 18 1HB ARG 18 -15.657 9.884 -6.719
24 2HB ARG 18 2HB ARG 18 -14.107 9.054 -6.737
25 1HG ARG 18 1HG ARG 18 -13.266 10.487 -8.437
26 2HG ARG 18 2HG ARG 18 -14.861 11.190 -8.716
27 1HD ARG 18 1HD ARG 18 -14.403 11.583 -6.008
28 2HD ARG 18 2HD ARG 18 -12.838 11.887 -6.758
29 HE ARG 18 HE ARG 18 -13.687 13.813 -7.643
30 1HH1 ARG 18 1HH1 ARG 18 -16.346 11.769 -6.677
31 2HH1 ARG 18 2HH1 ARG 18 -17.550 12.974 -6.994
32 1HH2 ARG 18 1HH2 ARG 18 -15.269 15.398 -8.058
33 2HH2 ARG 18 2HH2 ARG 18 -16.938 15.034 -7.778
34 H GLU 19 H GLU 19 -14.864 6.534 -6.951
35 HA GLU 19 HA GLU 19 -13.477 4.735 -7.034
36 1HB GLU 19 1HB GLU 19 -14.335 5.165 -9.743
37 2HB GLU 19 2HB GLU 19 -12.671 4.596 -9.741
38 1HG GLU 19 1HG GLU 19 -13.817 2.621 -9.815
39 2HG GLU 19 2HG GLU 19 -13.581 2.809 -8.079
40 H PHE 20 H PHE 20 -11.188 4.046 -7.878
41 HA PHE 20 HA PHE 20 -9.393 6.217 -8.460
42 1HB PHE 20 1HB PHE 20 -8.052 5.972 -6.396
43 2HB PHE 20 2HB PHE 20 -9.672 6.574 -6.068
44 HD1 PHE 20 HD1 PHE 20 -7.768 3.375 -6.212
45 HD2 PHE 20 HD2 PHE 20 -10.900 5.601 -4.384
46 HE1 PHE 20 HE1 PHE 20 -8.109 1.556 -4.590
47 HE2 PHE 20 HE2 PHE 20 -11.246 3.787 -2.758
48 HZ PHE 20 HZ PHE 20 -9.850 1.761 -2.859
49 H ASN 21 H ASN 21 -6.998 5.219 -7.872
50 HA ASN 21 HA ASN 21 -6.740 3.033 -9.693
51 1HB ASN 21 1HB ASN 21 -4.528 4.014 -7.913
52 2HB ASN 21 2HB ASN 21 -4.424 3.350 -9.539
53 1HD2 ASN 21 1HD2 ASN 21 -4.347 4.707 -11.197
54 2HD2 ASN 21 2HD2 ASN 21 -4.636 6.408 -11.112
55 H GLU 22 H GLU 22 -7.592 1.156 -8.961
56 HA GLU 22 HA GLU 22 -7.490 0.209 -6.327
57 1HB GLU 22 1HB GLU 22 -8.549 -0.673 -8.775
58 2HB GLU 22 2HB GLU 22 -7.487 -1.965 -8.231
59 1HG GLU 22 1HG GLU 22 -8.751 -2.418 -6.383
60 2HG GLU 22 2HG GLU 22 -9.393 -0.779 -6.285
61 H ASN 23 H ASN 23 -5.394 0.500 -5.549
62 HA ASN 23 HA ASN 23 -3.237 -0.030 -5.085
63 1HB ASN 23 1HB ASN 23 -3.765 -2.732 -6.274
64 2HB ASN 23 2HB ASN 23 -2.686 -2.305 -4.954
65 1HD2 ASN 23 1HD2 ASN 23 -3.612 -1.722 -2.927
66 2HD2 ASN 23 2HD2 ASN 23 -5.175 -2.305 -2.479
67 H ARG 24 H ARG 24 -2.627 1.434 -6.748
68 HA ARG 24 HA ARG 24 -0.842 0.233 -8.674
69 1HB ARG 24 1HB ARG 24 -3.191 1.933 -9.531
70 2HB ARG 24 2HB ARG 24 -1.791 1.642 -10.553
71 1HG ARG 24 1HG ARG 24 -3.547 -0.534 -9.444
72 2HG ARG 24 2HG ARG 24 -3.754 0.195 -11.035
73 1HD ARG 24 1HD ARG 24 -1.135 -1.001 -10.193
74 2HD ARG 24 2HD ARG 24 -2.423 -1.995 -10.871
75 HE ARG 24 HE ARG 24 -0.735 -0.145 -12.279
76 1HH1 ARG 24 1HH1 ARG 24 -3.815 -1.788 -12.296
77 2HH1 ARG 24 2HH1 ARG 24 -4.010 -1.668 -14.012
78 1HH2 ARG 24 1HH2 ARG 24 -0.993 0.015 -14.537
79 2HH2 ARG 24 2HH2 ARG 24 -2.409 -0.646 -15.285
80 H TYR 25 H TYR 25 -2.444 3.357 -8.197
81 HA TYR 25 HA TYR 25 -0.629 5.189 -8.804
82 1HB TYR 25 1HB TYR 25 -1.517 6.623 -7.025
83 2HB TYR 25 2HB TYR 25 -2.811 5.698 -7.786
84 HD1 TYR 25 HD1 TYR 25 -3.202 3.308 -6.575
85 HD2 TYR 25 HD2 TYR 25 -1.597 6.785 -4.724
86 HE1 TYR 25 HE1 TYR 25 -3.860 2.430 -4.384
87 HE2 TYR 25 HE2 TYR 25 -2.256 5.917 -2.519
88 HH TYR 25 HH TYR 25 -4.333 3.218 -2.151
89 H LEU 26 H LEU 26 -0.567 3.456 -5.700
90 HA LEU 26 HA LEU 26 2.242 4.281 -5.402
91 1HB LEU 26 1HB LEU 26 1.944 4.910 -3.259
92 2HB LEU 26 2HB LEU 26 0.299 5.160 -3.795
93 HG LEU 26 HG LEU 26 0.147 4.085 -1.705
94 1HD1 LEU 26 1HD1 LEU 26 -1.383 2.593 -2.303
95 2HD1 LEU 26 2HD1 LEU 26 -0.193 1.564 -3.099
96 3HD1 LEU 26 3HD1 LEU 26 -0.906 2.923 -3.967
97 1HD2 LEU 26 1HD2 LEU 26 1.604 2.613 -0.854
98 2HD2 LEU 26 2HD2 LEU 26 2.638 3.121 -2.189
99 3HD2 LEU 26 3HD2 LEU 26 1.663 1.659 -2.336
100 H THR 27 H THR 27 0.003 1.704 -5.494
101 HA THR 27 HA THR 27 1.213 -0.251 -3.964
102 HB THR 27 HB THR 27 -0.381 -0.399 -6.512
103 HG1 THR 27 HG1 THR 27 -0.925 -0.932 -3.786
104 1HG2 THR 27 1HG2 THR 27 -0.626 -2.867 -5.315
105 2HG2 THR 27 2HG2 THR 27 1.109 -2.553 -5.283
106 3HG2 THR 27 3HG2 THR 27 0.232 -2.506 -6.812
107 H GLU 28 H GLU 28 1.423 -0.441 -7.495
108 HA GLU 28 HA GLU 28 3.648 -2.039 -7.645
109 1HB GLU 28 1HB GLU 28 2.782 0.119 -9.572
110 2HB GLU 28 2HB GLU 28 3.947 -1.145 -9.945
111 1HG GLU 28 1HG GLU 28 1.555 -2.321 -8.906
112 2HG GLU 28 2HG GLU 28 1.156 -1.224 -10.227
113 H ARG 29 H ARG 29 3.537 1.450 -7.243
114 HA ARG 29 HA ARG 29 6.276 1.930 -7.787
115 1HB ARG 29 1HB ARG 29 4.326 3.606 -7.699
116 2HB ARG 29 2HB ARG 29 4.594 3.627 -5.961
117 1HG ARG 29 1HG ARG 29 7.024 4.015 -7.541
118 2HG ARG 29 2HG ARG 29 5.804 5.270 -7.766
119 1HD ARG 29 1HD ARG 29 5.753 5.738 -5.425
120 2HD ARG 29 2HD ARG 29 6.755 4.332 -5.066
121 HE ARG 29 HE ARG 29 8.607 5.574 -5.569
122 1HH1 ARG 29 1HH1 ARG 29 5.796 7.185 -6.865
123 2HH1 ARG 29 2HH1 ARG 29 6.670 8.606 -7.330
124 1HH2 ARG 29 1HH2 ARG 29 9.759 7.442 -6.179
125 2HH2 ARG 29 2HH2 ARG 29 8.920 8.752 -6.941
126 H ARG 30 H ARG 30 4.504 1.550 -4.719
127 HA ARG 30 HA ARG 30 6.931 1.689 -3.174
128 1HB ARG 30 1HB ARG 30 4.355 2.233 -2.580
129 2HB ARG 30 2HB ARG 30 4.477 0.607 -1.923
130 1HG ARG 30 1HG ARG 30 6.152 1.227 -0.402
131 2HG ARG 30 2HG ARG 30 6.474 2.742 -1.247
132 1HD ARG 30 1HD ARG 30 3.772 2.854 -0.579
133 2HD ARG 30 2HD ARG 30 4.558 2.159 0.838
134 HE ARG 30 HE ARG 30 5.535 4.187 1.245
135 1HH1 ARG 30 1HH1 ARG 30 4.320 4.163 -2.026
136 2HH1 ARG 30 2HH1 ARG 30 4.628 5.847 -2.286
137 1HH2 ARG 30 1HH2 ARG 30 5.942 6.402 0.905
138 2HH2 ARG 30 2HH2 ARG 30 5.550 7.118 -0.623
139 H ARG 31 H ARG 31 4.904 -0.823 -4.496
140 HA ARG 31 HA ARG 31 5.785 -2.976 -2.921
141 1HB ARG 31 1HB ARG 31 4.619 -2.785 -5.684
142 2HB ARG 31 2HB ARG 31 5.120 -4.333 -5.018
143 1HG ARG 31 1HG ARG 31 3.614 -3.748 -3.031
144 2HG ARG 31 2HG ARG 31 2.934 -2.510 -4.086
145 1HD ARG 31 1HD ARG 31 2.944 -5.491 -4.488
146 2HD ARG 31 2HD ARG 31 1.553 -4.425 -4.305
147 HE ARG 31 HE ARG 31 3.071 -3.675 -6.568
148 1HH1 ARG 31 1HH1 ARG 31 0.870 -6.142 -5.452
149 2HH1 ARG 31 2HH1 ARG 31 0.281 -6.510 -7.039
150 1HH2 ARG 31 1HH2 ARG 31 2.299 -4.158 -8.655
151 2HH2 ARG 31 2HH2 ARG 31 1.094 -5.386 -8.857
152 H GLN 32 H GLN 32 7.010 -1.660 -5.973
153 HA GLN 32 HA GLN 32 8.993 -3.624 -6.388
154 1HB GLN 32 1HB GLN 32 8.018 -1.539 -7.848
155 2HB GLN 32 2HB GLN 32 9.590 -0.912 -7.374
156 1HG GLN 32 1HG GLN 32 10.707 -2.769 -8.387
157 2HG GLN 32 2HG GLN 32 9.172 -3.576 -8.705
158 1HE2 GLN 32 1HE2 GLN 32 10.523 -0.336 -9.251
159 2HE2 GLN 32 2HE2 GLN 32 10.076 -0.245 -10.918
160 H GLN 33 H GLN 33 9.080 -0.464 -4.793
161 HA GLN 33 HA GLN 33 11.876 -0.615 -4.203
162 1HB GLN 33 1HB GLN 33 9.990 1.398 -4.227
163 2HB GLN 33 2HB GLN 33 10.301 1.179 -2.511
164 1HG GLN 33 1HG GLN 33 12.819 1.181 -3.689
165 2HG GLN 33 2HG GLN 33 11.921 2.440 -4.536
166 1HE2 GLN 33 1HE2 GLN 33 10.302 3.413 -2.586
167 2HE2 GLN 33 2HE2 GLN 33 11.246 4.133 -1.331
168 H LEU 34 H LEU 34 8.901 -1.237 -2.385
169 HA LEU 34 HA LEU 34 10.127 -1.648 0.118
170 1HB LEU 34 1HB LEU 34 7.508 -2.464 -1.079
171 2HB LEU 34 2HB LEU 34 7.987 -3.098 0.484
172 HG LEU 34 HG LEU 34 7.527 -0.207 -0.242
173 1HD1 LEU 34 1HD1 LEU 34 5.691 -2.032 0.428
174 2HD1 LEU 34 2HD1 LEU 34 5.583 -0.337 0.903
175 3HD1 LEU 34 3HD1 LEU 34 6.204 -1.533 2.040
176 1HD2 LEU 34 1HD2 LEU 34 7.906 -0.090 2.383
177 2HD2 LEU 34 2HD2 LEU 34 9.229 0.109 1.235
178 3HD2 LEU 34 3HD2 LEU 34 8.977 -1.445 2.030
179 H SER 35 H SER 35 9.474 -3.808 -2.581
180 HA SER 35 HA SER 35 10.046 -6.236 -1.306
181 1HB SER 35 1HB SER 35 8.983 -6.156 -3.503
182 2HB SER 35 2HB SER 35 10.439 -5.453 -4.205
183 HG SER 35 HG SER 35 10.143 -8.042 -3.088
184 H SER 36 H SER 36 12.162 -4.074 -3.183
185 HA SER 36 HA SER 36 14.508 -5.617 -2.793
186 1HB SER 36 1HB SER 36 13.807 -3.041 -4.001
187 2HB SER 36 2HB SER 36 15.411 -3.058 -3.270
188 HG SER 36 HG SER 36 15.907 -4.871 -4.537
189 H GLU 37 H GLU 37 13.087 -2.896 -1.057
190 HA GLU 37 HA GLU 37 15.291 -2.393 0.639
191 1HB GLU 37 1HB GLU 37 12.871 -1.181 0.157
192 2HB GLU 37 2HB GLU 37 12.660 -1.806 1.786
193 1HG GLU 37 1HG GLU 37 15.226 -0.557 1.545
194 2HG GLU 37 2HG GLU 37 13.963 0.543 0.995
195 H LEU 38 H LEU 38 12.305 -4.263 1.154
196 HA LEU 38 HA LEU 38 13.255 -5.195 3.725
197 1HB LEU 38 1HB LEU 38 10.749 -5.635 2.132
198 2HB LEU 38 2HB LEU 38 11.098 -6.601 3.554
199 HG LEU 38 HG LEU 38 11.445 -4.103 4.558
200 1HD1 LEU 38 1HD1 LEU 38 9.676 -3.894 2.191
201 2HD1 LEU 38 2HD1 LEU 38 10.744 -2.696 2.921
202 3HD1 LEU 38 3HD1 LEU 38 9.179 -3.046 3.656
203 1HD2 LEU 38 1HD2 LEU 38 9.688 -4.638 5.875
204 2HD2 LEU 38 2HD2 LEU 38 9.864 -6.203 5.081
205 3HD2 LEU 38 3HD2 LEU 38 8.651 -5.057 4.512
206 H GLY 39 H GLY 39 13.359 -6.254 0.456
207 1HA GLY 39 1HA GLY 39 14.427 -8.068 -0.476
208 2HA GLY 39 2HA GLY 39 14.991 -8.492 1.133
209 H LEU 40 H LEU 40 11.603 -8.100 0.361
210 HA LEU 40 HA LEU 40 11.249 -10.991 0.785
211 1HB LEU 40 1HB LEU 40 8.760 -10.007 1.141
212 2HB LEU 40 2HB LEU 40 9.919 -10.240 2.437
213 HG LEU 40 HG LEU 40 10.613 -7.817 2.058
214 1HD1 LEU 40 1HD1 LEU 40 9.171 -7.956 -0.193
215 2HD1 LEU 40 2HD1 LEU 40 9.463 -6.448 0.674
216 3HD1 LEU 40 3HD1 LEU 40 7.944 -7.316 0.900
217 1HD2 LEU 40 1HD2 LEU 40 8.150 -8.865 3.290
218 2HD2 LEU 40 2HD2 LEU 40 8.218 -7.115 3.076
219 3HD2 LEU 40 3HD2 LEU 40 9.474 -7.940 4.000
220 H ASN 41 H ASN 41 9.359 -11.955 -0.318
221 HA ASN 41 HA ASN 41 9.414 -11.238 -3.118
222 1HB ASN 41 1HB ASN 41 9.554 -13.588 -2.534
223 2HB ASN 41 2HB ASN 41 8.046 -13.492 -1.633
224 1HD2 ASN 41 1HD2 ASN 41 8.991 -12.295 -4.833
225 2HD2 ASN 41 2HD2 ASN 41 7.743 -13.119 -5.698
226 H GLU 42 H GLU 42 7.604 -10.712 -4.380
227 HA GLU 42 HA GLU 42 5.824 -8.850 -3.360
228 1HB GLU 42 1HB GLU 42 5.446 -10.655 -5.760
229 2HB GLU 42 2HB GLU 42 4.554 -9.170 -5.453
230 1HG GLU 42 1HG GLU 42 7.431 -8.775 -5.395
231 2HG GLU 42 2HG GLU 42 6.860 -9.415 -6.935
232 H ALA 43 H ALA 43 5.612 -12.325 -3.470
233 HA ALA 43 HA ALA 43 2.859 -12.673 -3.083
234 1HB ALA 43 1HB ALA 43 4.937 -14.445 -1.824
235 2HB ALA 43 2HB ALA 43 4.637 -14.446 -3.562
236 3HB ALA 43 3HB ALA 43 3.345 -14.885 -2.445
237 H GLN 44 H GLN 44 5.446 -11.849 -0.897
238 HA GLN 44 HA GLN 44 3.833 -12.060 1.496
239 1HB GLN 44 1HB GLN 44 6.599 -11.051 0.877
240 2HB GLN 44 2HB GLN 44 5.871 -10.789 2.455
241 1HG GLN 44 1HG GLN 44 6.325 -13.476 1.177
242 2HG GLN 44 2HG GLN 44 7.348 -12.742 2.412
243 1HE2 GLN 44 1HE2 GLN 44 5.629 -11.741 4.192
244 2HE2 GLN 44 2HE2 GLN 44 4.652 -12.986 4.884
245 H ILE 45 H ILE 45 4.730 -9.732 -0.877
246 HA ILE 45 HA ILE 45 4.140 -7.350 0.502
247 HB ILE 45 HB ILE 45 4.190 -8.001 -2.445
248 1HG1 ILE 45 1HG1 ILE 45 6.318 -8.120 -1.097
249 2HG1 ILE 45 2HG1 ILE 45 6.351 -6.977 -2.439
250 1HG2 ILE 45 1HG2 ILE 45 2.702 -6.062 -1.972
251 2HG2 ILE 45 2HG2 ILE 45 4.117 -5.665 -2.945
252 3HG2 ILE 45 3HG2 ILE 45 4.084 -5.252 -1.234
253 1HD1 ILE 45 1HD1 ILE 45 5.789 -5.182 -0.761
254 2HD1 ILE 45 2HD1 ILE 45 7.388 -5.912 -0.620
255 3HD1 ILE 45 3HD1 ILE 45 6.103 -6.383 0.490
256 H LYS 46 H LYS 46 2.142 -9.523 -1.473
257 HA LYS 46 HA LYS 46 -0.142 -7.921 -1.670
258 1HB LYS 46 1HB LYS 46 0.277 -10.107 -2.861
259 2HB LYS 46 2HB LYS 46 -0.127 -10.928 -1.360
260 1HG LYS 46 1HG LYS 46 -2.314 -9.473 -1.548
261 2HG LYS 46 2HG LYS 46 -1.883 -9.471 -3.260
262 1HD LYS 46 1HD LYS 46 -2.039 -11.806 -3.417
263 2HD LYS 46 2HD LYS 46 -1.984 -12.012 -1.665
264 1HE LYS 46 1HE LYS 46 -4.216 -12.278 -1.941
265 2HE LYS 46 2HE LYS 46 -4.190 -10.518 -1.844
266 1HZ LYS 46 1HZ LYS 46 -4.379 -10.323 -4.154
267 2HZ LYS 46 2HZ LYS 46 -5.480 -11.540 -3.745
268 3HZ LYS 46 3HZ LYS 46 -3.987 -11.946 -4.427
269 H ILE 47 H ILE 47 0.754 -10.340 0.749
270 HA ILE 47 HA ILE 47 -1.503 -9.928 2.438
271 HB ILE 47 HB ILE 47 1.058 -11.403 2.578
272 1HG1 ILE 47 1HG1 ILE 47 -1.498 -12.319 3.813
273 2HG1 ILE 47 2HG1 ILE 47 -1.436 -12.157 2.061
274 1HG2 ILE 47 1HG2 ILE 47 -0.352 -10.481 5.072
275 2HG2 ILE 47 2HG2 ILE 47 1.341 -10.246 4.633
276 3HG2 ILE 47 3HG2 ILE 47 0.746 -11.860 5.028
277 1HD1 ILE 47 1HD1 ILE 47 -0.383 -14.228 3.751
278 2HD1 ILE 47 2HD1 ILE 47 0.884 -13.533 2.740
279 3HD1 ILE 47 3HD1 ILE 47 -0.573 -14.192 1.998
280 H TRP 48 H TRP 48 1.791 -8.760 2.366
281 HA TRP 48 HA TRP 48 1.919 -7.351 4.753
282 1HB TRP 48 1HB TRP 48 3.838 -7.864 3.317
283 2HB TRP 48 2HB TRP 48 3.206 -6.808 2.068
284 HD1 TRP 48 HD1 TRP 48 5.570 -6.860 4.885
285 HE1 TRP 48 HE1 TRP 48 6.448 -4.489 5.337
286 HE3 TRP 48 HE3 TRP 48 2.213 -4.154 2.155
287 HZ2 TRP 48 HZ2 TRP 48 5.823 -1.847 4.668
288 HZ3 TRP 48 HZ3 TRP 48 2.420 -1.712 2.117
289 HH2 TRP 48 HH2 TRP 48 4.196 -0.586 3.336
290 H PHE 49 H PHE 49 1.014 -6.222 1.522
291 HA PHE 49 HA PHE 49 0.348 -3.605 2.413
292 1HB PHE 49 1HB PHE 49 0.091 -5.084 -0.152
293 2HB PHE 49 2HB PHE 49 -0.917 -3.650 0.078
294 HD1 PHE 49 HD1 PHE 49 2.499 -4.907 -0.168
295 HD2 PHE 49 HD2 PHE 49 0.047 -1.470 0.272
296 HE1 PHE 49 HE1 PHE 49 4.461 -3.477 -0.566
297 HE2 PHE 49 HE2 PHE 49 2.005 -0.018 -0.139
298 HZ PHE 49 HZ PHE 49 4.222 -1.037 -0.530
299 H GLN 50 H GLN 50 -1.547 -6.495 1.751
300 HA GLN 50 HA GLN 50 -4.054 -5.303 2.142
301 1HB GLN 50 1HB GLN 50 -3.059 -8.135 2.327
302 2HB GLN 50 2HB GLN 50 -4.720 -7.741 2.749
303 1HG GLN 50 1HG GLN 50 -4.060 -6.554 0.231
304 2HG GLN 50 2HG GLN 50 -3.660 -8.270 0.207
305 1HE2 GLN 50 1HE2 GLN 50 -5.256 -9.733 0.061
306 2HE2 GLN 50 2HE2 GLN 50 -6.940 -9.349 0.022
307 H ASN 51 H ASN 51 -1.638 -6.537 4.356
308 HA ASN 51 HA ASN 51 -3.396 -6.473 6.645
309 1HB ASN 51 1HB ASN 51 -0.592 -7.231 6.108
310 2HB ASN 51 2HB ASN 51 -0.896 -6.575 7.714
311 1HD2 ASN 51 1HD2 ASN 51 -0.054 -9.142 7.419
312 2HD2 ASN 51 2HD2 ASN 51 -1.329 -10.233 7.829
313 H LYS 52 H LYS 52 -1.095 -4.352 5.102
314 HA LYS 52 HA LYS 52 -0.632 -2.540 7.180
315 1HB LYS 52 1HB LYS 52 0.347 -2.746 4.724
316 2HB LYS 52 2HB LYS 52 -0.882 -1.538 4.380
317 1HG LYS 52 1HG LYS 52 0.672 -0.053 4.963
318 2HG LYS 52 2HG LYS 52 0.301 -0.523 6.623
319 1HD LYS 52 1HD LYS 52 2.220 -2.267 5.237
320 2HD LYS 52 2HD LYS 52 2.778 -0.616 5.513
321 1HE LYS 52 1HE LYS 52 2.446 -0.811 7.861
322 2HE LYS 52 2HE LYS 52 1.582 -2.336 7.675
323 1HZ LYS 52 1HZ LYS 52 3.730 -3.218 6.715
324 2HZ LYS 52 2HZ LYS 52 3.728 -2.903 8.377
325 3HZ LYS 52 3HZ LYS 52 4.473 -1.820 7.313
326 H ARG 53 H ARG 53 -3.246 -2.739 4.820
327 HA ARG 53 HA ARG 53 -4.620 -0.558 6.247
328 1HB ARG 53 1HB ARG 53 -5.081 -1.479 3.406
329 2HB ARG 53 2HB ARG 53 -5.855 -0.116 4.203
330 1HG ARG 53 1HG ARG 53 -3.227 0.505 4.510
331 2HG ARG 53 2HG ARG 53 -3.219 -0.320 2.949
332 1HD ARG 53 1HD ARG 53 -3.733 1.736 2.173
333 2HD ARG 53 2HD ARG 53 -5.369 1.261 2.627
334 HE ARG 53 HE ARG 53 -3.902 2.544 4.741
335 1HH1 ARG 53 1HH1 ARG 53 -5.944 3.050 1.957
336 2HH1 ARG 53 2HH1 ARG 53 -6.503 4.599 2.492
337 1HH2 ARG 53 1HH2 ARG 53 -4.637 4.580 5.448
338 2HH2 ARG 53 2HH2 ARG 53 -5.760 5.468 4.474
339 H ALA 54 H ALA 54 -5.783 -1.633 7.748
340 HA ALA 54 HA ALA 54 -8.133 -3.006 6.924
341 1HB ALA 54 1HB ALA 54 -7.708 -5.190 7.421
342 2HB ALA 54 2HB ALA 54 -6.446 -4.794 8.587
343 3HB ALA 54 3HB ALA 54 -6.107 -4.705 6.859
344 H LYS 55 H LYS 55 -7.322 -0.769 8.586
345 HA LYS 55 HA LYS 55 -8.557 -1.623 11.116
346 1HB LYS 55 1HB LYS 55 -6.079 -1.150 11.297
347 2HB LYS 55 2HB LYS 55 -6.447 0.522 10.895
348 1HG LYS 55 1HG LYS 55 -7.634 0.858 12.889
349 2HG LYS 55 2HG LYS 55 -7.741 -0.874 13.213
350 1HD LYS 55 1HD LYS 55 -5.715 -0.935 14.178
351 2HD LYS 55 2HD LYS 55 -4.999 0.115 12.953
352 1HE LYS 55 1HE LYS 55 -6.296 2.005 14.119
353 2HE LYS 55 2HE LYS 55 -6.470 0.870 15.456
354 1HZ LYS 55 1HZ LYS 55 -4.413 2.534 15.194
355 2HZ LYS 55 2HZ LYS 55 -3.783 1.179 14.404
356 3HZ LYS 55 3HZ LYS 55 -4.311 1.052 16.005
357 H ILE 56 H ILE 56 -9.777 -0.497 8.730
358 HA ILE 56 HA ILE 56 -10.935 1.906 9.959
359 HB ILE 56 HB ILE 56 -10.357 1.708 7.005
360 1HG1 ILE 56 1HG1 ILE 56 -8.883 3.413 9.017
361 2HG1 ILE 56 2HG1 ILE 56 -8.294 1.843 8.481
362 1HG2 ILE 56 1HG2 ILE 56 -11.362 3.715 6.768
363 2HG2 ILE 56 2HG2 ILE 56 -10.820 4.295 8.343
364 3HG2 ILE 56 3HG2 ILE 56 -12.212 3.217 8.231
365 1HD1 ILE 56 1HD1 ILE 56 -7.212 3.632 7.266
366 2HD1 ILE 56 2HD1 ILE 56 -8.779 4.247 6.738
367 3HD1 ILE 56 3HD1 ILE 56 -8.216 2.671 6.180
368 H LYS 57 H LYS 57 -12.584 0.352 10.586
369 HA LYS 57 HA LYS 57 -14.628 -0.620 10.383
370 1HB LYS 57 1HB LYS 57 -14.937 1.699 9.214
371 2HB LYS 57 2HB LYS 57 -15.025 0.740 7.743
372 1HG LYS 57 1HG LYS 57 -16.993 -0.300 8.383
373 2HG LYS 57 2HG LYS 57 -16.748 0.070 10.091
374 1HD LYS 57 1HD LYS 57 -16.855 2.564 9.042
375 2HD LYS 57 2HD LYS 57 -17.938 1.701 7.948
376 1HE LYS 57 1HE LYS 57 -18.243 1.270 10.876
377 2HE LYS 57 2HE LYS 57 -18.812 2.792 10.191
378 1HZ LYS 57 1HZ LYS 57 -20.296 0.597 10.309
379 2HZ LYS 57 2HZ LYS 57 -19.609 0.381 8.779
380 3HZ LYS 57 3HZ LYS 57 -20.494 1.781 9.116
381 H LYS 58 H LYS 58 -16.026 -2.013 8.899
382 HA LYS 58 HA LYS 58 -14.350 -3.470 6.969
383 1HB LYS 58 1HB LYS 58 -14.639 -4.566 9.295
384 2HB LYS 58 2HB LYS 58 -16.288 -4.887 8.777
385 1HG LYS 58 1HG LYS 58 -15.630 -6.383 7.151
386 2HG LYS 58 2HG LYS 58 -14.003 -5.708 7.041
387 1HD LYS 58 1HD LYS 58 -13.429 -7.499 8.274
388 2HD LYS 58 2HD LYS 58 -14.048 -6.543 9.622
389 1HE LYS 58 1HE LYS 58 -16.338 -7.632 8.877
390 2HE LYS 58 2HE LYS 58 -15.266 -8.864 8.213
391 1HZ LYS 58 1HZ LYS 58 -14.548 -9.484 10.277
392 2HZ LYS 58 2HZ LYS 58 -16.135 -9.035 10.649
393 3HZ LYS 58 3HZ LYS 58 -14.857 -7.977 10.981
394 H SER 59 H SER 59 -15.875 -1.692 5.866
395 HA SER 59 HA SER 59 -18.171 -3.206 4.829
396 1HB SER 59 1HB SER 59 -18.137 -0.477 6.003
397 2HB SER 59 2HB SER 59 -19.110 -0.701 4.550
398 HG SER 59 HG SER 59 -20.288 -2.270 5.599
Start of MODEL 3
1 1H ALA 16 1H ALA 16 -17.879 13.070 -5.017
2 2H ALA 16 2H ALA 16 -19.459 13.109 -5.685
3 3H ALA 16 3H ALA 16 -19.086 14.053 -4.301
4 HA ALA 16 HA ALA 16 -19.216 15.197 -6.512
5 1HB ALA 16 1HB ALA 16 -18.227 16.058 -4.355
6 2HB ALA 16 2HB ALA 16 -17.596 16.778 -5.836
7 3HB ALA 16 3HB ALA 16 -16.655 15.557 -4.978
8 H LYS 17 H LYS 17 -18.213 12.484 -7.132
9 HA LYS 17 HA LYS 17 -16.996 11.435 -8.740
10 1HB LYS 17 1HB LYS 17 -17.902 13.703 -9.896
11 2HB LYS 17 2HB LYS 17 -16.170 13.949 -10.067
12 1HG LYS 17 1HG LYS 17 -17.536 11.426 -10.947
13 2HG LYS 17 2HG LYS 17 -17.353 12.832 -11.997
14 1HD LYS 17 1HD LYS 17 -14.942 11.782 -10.603
15 2HD LYS 17 2HD LYS 17 -15.573 10.878 -11.981
16 1HE LYS 17 1HE LYS 17 -15.207 13.823 -12.241
17 2HE LYS 17 2HE LYS 17 -13.783 12.785 -12.298
18 1HZ LYS 17 1HZ LYS 17 -14.656 11.629 -14.158
19 2HZ LYS 17 2HZ LYS 17 -14.806 13.279 -14.497
20 3HZ LYS 17 3HZ LYS 17 -16.163 12.387 -14.022
21 H ARG 18 H ARG 18 -15.446 10.952 -7.029
22 HA ARG 18 HA ARG 18 -13.062 12.574 -6.851
23 1HB ARG 18 1HB ARG 18 -14.280 10.932 -5.083
24 2HB ARG 18 2HB ARG 18 -13.058 9.839 -5.718
25 1HG ARG 18 1HG ARG 18 -11.674 12.189 -5.226
26 2HG ARG 18 2HG ARG 18 -12.789 12.045 -3.868
27 1HD ARG 18 1HD ARG 18 -10.875 9.913 -4.813
28 2HD ARG 18 2HD ARG 18 -10.646 10.951 -3.406
29 HE ARG 18 HE ARG 18 -12.350 8.639 -3.604
30 1HH1 ARG 18 1HH1 ARG 18 -11.728 11.613 -1.884
31 2HH1 ARG 18 2HH1 ARG 18 -12.546 11.098 -0.447
32 1HH2 ARG 18 1HH2 ARG 18 -13.427 7.962 -1.715
33 2HH2 ARG 18 2HH2 ARG 18 -13.511 9.026 -0.351
34 H GLU 19 H GLU 19 -13.457 9.091 -7.514
35 HA GLU 19 HA GLU 19 -12.329 7.668 -8.885
36 1HB GLU 19 1HB GLU 19 -13.133 9.783 -10.453
37 2HB GLU 19 2HB GLU 19 -11.413 9.688 -10.801
38 1HG GLU 19 1HG GLU 19 -11.985 7.115 -11.047
39 2HG GLU 19 2HG GLU 19 -13.585 7.767 -11.403
40 H PHE 20 H PHE 20 -10.651 7.209 -7.455
41 HA PHE 20 HA PHE 20 -8.151 8.699 -7.902
42 1HB PHE 20 1HB PHE 20 -7.440 7.936 -5.687
43 2HB PHE 20 2HB PHE 20 -8.964 8.811 -5.588
44 HD1 PHE 20 HD1 PHE 20 -7.486 5.421 -5.630
45 HD2 PHE 20 HD2 PHE 20 -10.870 7.812 -4.666
46 HE1 PHE 20 HE1 PHE 20 -8.496 3.508 -4.457
47 HE2 PHE 20 HE2 PHE 20 -11.888 5.905 -3.490
48 HZ PHE 20 HZ PHE 20 -10.701 3.750 -3.385
49 H ASN 21 H ASN 21 -6.264 7.047 -7.024
50 HA ASN 21 HA ASN 21 -6.283 4.934 -9.021
51 1HB ASN 21 1HB ASN 21 -4.093 5.940 -7.200
52 2HB ASN 21 2HB ASN 21 -3.888 4.695 -8.428
53 1HD2 ASN 21 1HD2 ASN 21 -2.418 5.830 -9.630
54 2HD2 ASN 21 2HD2 ASN 21 -2.828 7.247 -10.531
55 H GLU 22 H GLU 22 -7.436 3.217 -8.314
56 HA GLU 22 HA GLU 22 -7.460 2.286 -5.640
57 1HB GLU 22 1HB GLU 22 -8.761 1.633 -8.088
58 2HB GLU 22 2HB GLU 22 -8.073 0.151 -7.436
59 1HG GLU 22 1HG GLU 22 -9.431 0.150 -5.616
60 2HG GLU 22 2HG GLU 22 -9.564 1.908 -5.575
61 H ASN 23 H ASN 23 -5.221 2.217 -5.120
62 HA ASN 23 HA ASN 23 -3.237 1.179 -4.749
63 1HB ASN 23 1HB ASN 23 -4.402 -1.307 -5.959
64 2HB ASN 23 2HB ASN 23 -3.159 -1.168 -4.724
65 1HD2 ASN 23 1HD2 ASN 23 -4.036 0.245 -2.786
66 2HD2 ASN 23 2HD2 ASN 23 -5.550 -0.299 -2.156
67 H ARG 24 H ARG 24 -2.469 2.559 -6.423
68 HA ARG 24 HA ARG 24 -1.020 1.121 -8.445
69 1HB ARG 24 1HB ARG 24 -2.986 3.252 -9.321
70 2HB ARG 24 2HB ARG 24 -1.872 2.370 -10.359
71 1HG ARG 24 1HG ARG 24 -3.072 0.272 -9.720
72 2HG ARG 24 2HG ARG 24 -4.260 1.282 -8.892
73 1HD ARG 24 1HD ARG 24 -5.314 1.672 -10.809
74 2HD ARG 24 2HD ARG 24 -3.833 2.298 -11.531
75 HE ARG 24 HE ARG 24 -3.644 0.347 -12.687
76 1HH1 ARG 24 1HH1 ARG 24 -5.700 -0.218 -9.925
77 2HH1 ARG 24 2HH1 ARG 24 -6.083 -1.843 -10.385
78 1HH2 ARG 24 1HH2 ARG 24 -4.145 -1.791 -13.293
79 2HH2 ARG 24 2HH2 ARG 24 -5.200 -2.736 -12.298
80 H TYR 25 H TYR 25 -2.141 4.375 -7.593
81 HA TYR 25 HA TYR 25 -0.129 5.968 -8.433
82 1HB TYR 25 1HB TYR 25 -0.687 7.497 -6.628
83 2HB TYR 25 2HB TYR 25 -2.157 6.734 -7.226
84 HD1 TYR 25 HD1 TYR 25 -2.752 4.455 -5.915
85 HD2 TYR 25 HD2 TYR 25 -0.464 7.678 -4.339
86 HE1 TYR 25 HE1 TYR 25 -3.284 3.706 -3.640
87 HE2 TYR 25 HE2 TYR 25 -0.996 6.941 -2.054
88 HH TYR 25 HH TYR 25 -3.403 4.636 -1.377
89 H LEU 26 H LEU 26 -0.115 4.132 -5.397
90 HA LEU 26 HA LEU 26 2.794 4.541 -5.266
91 1HB LEU 26 1HB LEU 26 2.734 5.068 -3.073
92 2HB LEU 26 2HB LEU 26 1.121 5.602 -3.486
93 HG LEU 26 HG LEU 26 0.915 4.446 -1.448
94 1HD1 LEU 26 1HD1 LEU 26 0.112 2.074 -2.896
95 2HD1 LEU 26 2HD1 LEU 26 -0.410 3.552 -3.701
96 3HD1 LEU 26 3HD1 LEU 26 -0.865 3.257 -2.025
97 1HD2 LEU 26 1HD2 LEU 26 2.140 2.696 -0.757
98 2HD2 LEU 26 2HD2 LEU 26 3.203 3.168 -2.083
99 3HD2 LEU 26 3HD2 LEU 26 2.033 1.868 -2.311
100 H THR 27 H THR 27 0.198 2.300 -5.257
101 HA THR 27 HA THR 27 1.158 0.120 -3.918
102 HB THR 27 HB THR 27 -0.403 0.291 -6.492
103 HG1 THR 27 HG1 THR 27 -1.084 -0.212 -3.792
104 1HG2 THR 27 1HG2 THR 27 -0.025 -2.179 -4.818
105 2HG2 THR 27 2HG2 THR 27 0.692 -1.910 -6.408
106 3HG2 THR 27 3HG2 THR 27 -1.060 -2.006 -6.235
107 H GLU 28 H GLU 28 1.361 0.067 -7.452
108 HA GLU 28 HA GLU 28 3.438 -1.762 -7.603
109 1HB GLU 28 1HB GLU 28 2.749 0.398 -9.599
110 2HB GLU 28 2HB GLU 28 3.687 -1.051 -9.935
111 1HG GLU 28 1HG GLU 28 0.929 -1.309 -8.834
112 2HG GLU 28 2HG GLU 28 1.158 -0.938 -10.542
113 H ARG 29 H ARG 29 3.568 1.734 -7.302
114 HA ARG 29 HA ARG 29 6.279 2.074 -7.988
115 1HB ARG 29 1HB ARG 29 4.222 3.759 -7.429
116 2HB ARG 29 2HB ARG 29 5.175 3.909 -5.958
117 1HG ARG 29 1HG ARG 29 6.163 4.375 -8.765
118 2HG ARG 29 2HG ARG 29 5.783 5.617 -7.570
119 1HD ARG 29 1HD ARG 29 7.519 4.136 -6.154
120 2HD ARG 29 2HD ARG 29 8.127 3.832 -7.780
121 HE ARG 29 HE ARG 29 8.374 6.242 -6.285
122 1HH1 ARG 29 1HH1 ARG 29 8.034 4.995 -9.526
123 2HH1 ARG 29 2HH1 ARG 29 8.807 6.356 -10.265
124 1HH2 ARG 29 1HH2 ARG 29 9.392 8.034 -7.255
125 2HH2 ARG 29 2HH2 ARG 29 9.579 8.082 -8.976
126 H ARG 30 H ARG 30 4.707 1.713 -4.817
127 HA ARG 30 HA ARG 30 7.239 1.683 -3.440
128 1HB ARG 30 1HB ARG 30 4.404 1.714 -2.689
129 2HB ARG 30 2HB ARG 30 5.411 0.751 -1.618
130 1HG ARG 30 1HG ARG 30 6.803 3.150 -2.067
131 2HG ARG 30 2HG ARG 30 5.122 3.591 -1.764
132 1HD ARG 30 1HD ARG 30 5.490 1.740 0.163
133 2HD ARG 30 2HD ARG 30 7.126 2.383 0.033
134 HE ARG 30 HE ARG 30 4.815 3.720 1.099
135 1HH1 ARG 30 1HH1 ARG 30 7.965 4.156 -0.340
136 2HH1 ARG 30 2HH1 ARG 30 8.196 5.731 0.342
137 1HH2 ARG 30 1HH2 ARG 30 5.117 5.792 1.995
138 2HH2 ARG 30 2HH2 ARG 30 6.579 6.660 1.667
139 H ARG 31 H ARG 31 5.095 -0.677 -4.802
140 HA ARG 31 HA ARG 31 5.830 -2.920 -3.293
141 1HB ARG 31 1HB ARG 31 4.735 -2.546 -6.059
142 2HB ARG 31 2HB ARG 31 5.213 -4.147 -5.511
143 1HG ARG 31 1HG ARG 31 3.615 -4.104 -3.747
144 2HG ARG 31 2HG ARG 31 3.256 -2.402 -4.037
145 1HD ARG 31 1HD ARG 31 1.487 -3.440 -5.089
146 2HD ARG 31 2HD ARG 31 2.619 -3.223 -6.423
147 HE ARG 31 HE ARG 31 3.161 -5.708 -5.354
148 1HH1 ARG 31 1HH1 ARG 31 0.431 -4.122 -6.841
149 2HH1 ARG 31 2HH1 ARG 31 -0.223 -5.586 -7.495
150 1HH2 ARG 31 1HH2 ARG 31 2.303 -7.636 -6.215
151 2HH2 ARG 31 2HH2 ARG 31 0.840 -7.581 -7.140
152 H GLN 32 H GLN 32 7.249 -1.529 -6.218
153 HA GLN 32 HA GLN 32 9.158 -3.581 -6.623
154 1HB GLN 32 1HB GLN 32 8.847 -0.768 -7.604
155 2HB GLN 32 2HB GLN 32 10.346 -1.635 -7.911
156 1HG GLN 32 1HG GLN 32 7.599 -2.558 -8.724
157 2HG GLN 32 2HG GLN 32 8.776 -1.784 -9.782
158 1HE2 GLN 32 1HE2 GLN 32 7.501 -4.658 -8.988
159 2HE2 GLN 32 2HE2 GLN 32 8.816 -5.704 -9.391
160 H GLN 33 H GLN 33 9.327 -0.437 -4.992
161 HA GLN 33 HA GLN 33 12.083 -0.731 -4.287
162 1HB GLN 33 1HB GLN 33 9.990 1.167 -3.217
163 2HB GLN 33 2HB GLN 33 11.718 1.289 -2.923
164 1HG GLN 33 1HG GLN 33 11.438 1.145 -5.700
165 2HG GLN 33 2HG GLN 33 10.168 2.234 -5.146
166 1HE2 GLN 33 1HE2 GLN 33 11.133 4.042 -6.030
167 2HE2 GLN 33 2HE2 GLN 33 12.572 4.743 -5.380
168 H LEU 34 H LEU 34 9.014 -1.321 -2.643
169 HA LEU 34 HA LEU 34 10.071 -1.697 -0.061
170 1HB LEU 34 1HB LEU 34 7.548 -2.549 -1.423
171 2HB LEU 34 2HB LEU 34 7.930 -3.175 0.168
172 HG LEU 34 HG LEU 34 7.445 -0.302 -0.603
173 1HD1 LEU 34 1HD1 LEU 34 5.619 -2.123 -0.024
174 2HD1 LEU 34 2HD1 LEU 34 5.484 -0.458 0.541
175 3HD1 LEU 34 3HD1 LEU 34 6.088 -1.712 1.624
176 1HD2 LEU 34 1HD2 LEU 34 7.794 0.112 1.875
177 2HD2 LEU 34 2HD2 LEU 34 9.246 -0.162 0.913
178 3HD2 LEU 34 3HD2 LEU 34 8.600 -1.455 1.922
179 H SER 35 H SER 35 9.534 -3.936 -2.737
180 HA SER 35 HA SER 35 10.081 -6.320 -1.397
181 1HB SER 35 1HB SER 35 10.603 -7.250 -3.617
182 2HB SER 35 2HB SER 35 9.153 -6.249 -3.671
183 HG SER 35 HG SER 35 11.656 -5.825 -4.803
184 H SER 36 H SER 36 12.282 -4.170 -3.184
185 HA SER 36 HA SER 36 14.621 -5.674 -2.638
186 1HB SER 36 1HB SER 36 14.005 -3.012 -3.797
187 2HB SER 36 2HB SER 36 15.635 -3.243 -3.165
188 HG SER 36 HG SER 36 15.848 -5.041 -4.530
189 H GLU 37 H GLU 37 13.111 -2.904 -1.042
190 HA GLU 37 HA GLU 37 15.224 -2.376 0.755
191 1HB GLU 37 1HB GLU 37 12.586 -1.372 0.249
192 2HB GLU 37 2HB GLU 37 12.784 -1.620 1.978
193 1HG GLU 37 1HG GLU 37 15.126 -0.366 0.924
194 2HG GLU 37 2HG GLU 37 13.694 0.528 0.414
195 H LEU 38 H LEU 38 12.214 -4.229 1.153
196 HA LEU 38 HA LEU 38 13.018 -5.094 3.796
197 1HB LEU 38 1HB LEU 38 10.611 -5.619 2.075
198 2HB LEU 38 2HB LEU 38 10.878 -6.489 3.573
199 HG LEU 38 HG LEU 38 11.171 -3.850 4.335
200 1HD1 LEU 38 1HD1 LEU 38 8.826 -4.018 2.451
201 2HD1 LEU 38 2HD1 LEU 38 10.328 -3.159 2.113
202 3HD1 LEU 38 3HD1 LEU 38 9.295 -2.640 3.445
203 1HD2 LEU 38 1HD2 LEU 38 8.459 -5.018 4.497
204 2HD2 LEU 38 2HD2 LEU 38 9.486 -4.346 5.763
205 3HD2 LEU 38 3HD2 LEU 38 9.779 -5.979 5.166
206 H GLY 39 H GLY 39 13.315 -6.232 0.566
207 1HA GLY 39 1HA GLY 39 14.443 -8.064 -0.253
208 2HA GLY 39 2HA GLY 39 14.903 -8.452 1.398
209 H LEU 40 H LEU 40 11.559 -8.074 0.499
210 HA LEU 40 HA LEU 40 11.195 -10.971 0.879
211 1HB LEU 40 1HB LEU 40 8.711 -10.069 1.222
212 2HB LEU 40 2HB LEU 40 9.872 -10.167 2.533
213 HG LEU 40 HG LEU 40 10.422 -7.747 2.098
214 1HD1 LEU 40 1HD1 LEU 40 7.854 -7.716 0.540
215 2HD1 LEU 40 2HD1 LEU 40 9.435 -7.818 -0.236
216 3HD1 LEU 40 3HD1 LEU 40 9.025 -6.415 0.752
217 1HD2 LEU 40 1HD2 LEU 40 8.500 -8.882 3.651
218 2HD2 LEU 40 2HD2 LEU 40 7.560 -7.710 2.728
219 3HD2 LEU 40 3HD2 LEU 40 8.942 -7.175 3.684
220 H ASN 41 H ASN 41 9.335 -11.924 -0.295
221 HA ASN 41 HA ASN 41 9.437 -11.089 -3.069
222 1HB ASN 41 1HB ASN 41 8.028 -13.196 -3.397
223 2HB ASN 41 2HB ASN 41 9.672 -13.423 -2.808
224 1HD2 ASN 41 1HD2 ASN 41 6.309 -13.262 -1.845
225 2HD2 ASN 41 2HD2 ASN 41 6.467 -14.244 -0.433
226 H GLU 42 H GLU 42 7.523 -10.831 -4.363
227 HA GLU 42 HA GLU 42 5.727 -8.957 -3.380
228 1HB GLU 42 1HB GLU 42 5.292 -10.850 -5.698
229 2HB GLU 42 2HB GLU 42 4.467 -9.318 -5.441
230 1HG GLU 42 1HG GLU 42 6.147 -8.133 -6.310
231 2HG GLU 42 2HG GLU 42 7.373 -9.082 -5.472
232 H ALA 43 H ALA 43 5.559 -12.444 -3.379
233 HA ALA 43 HA ALA 43 2.814 -12.801 -2.941
234 1HB ALA 43 1HB ALA 43 4.856 -14.505 -3.233
235 2HB ALA 43 2HB ALA 43 3.310 -14.983 -2.534
236 3HB ALA 43 3HB ALA 43 4.669 -14.592 -1.482
237 H GLN 44 H GLN 44 5.424 -11.923 -0.794
238 HA GLN 44 HA GLN 44 3.823 -12.051 1.610
239 1HB GLN 44 1HB GLN 44 6.593 -11.101 0.937
240 2HB GLN 44 2HB GLN 44 5.879 -10.730 2.499
241 1HG GLN 44 1HG GLN 44 6.281 -13.499 1.389
242 2HG GLN 44 2HG GLN 44 7.325 -12.707 2.567
243 1HE2 GLN 44 1HE2 GLN 44 5.626 -11.565 4.289
244 2HE2 GLN 44 2HE2 GLN 44 4.640 -12.752 5.066
245 H ILE 45 H ILE 45 4.725 -9.798 -0.833
246 HA ILE 45 HA ILE 45 4.144 -7.375 0.473
247 HB ILE 45 HB ILE 45 4.194 -8.119 -2.449
248 1HG1 ILE 45 1HG1 ILE 45 6.315 -8.173 -1.060
249 2HG1 ILE 45 2HG1 ILE 45 6.358 -7.136 -2.483
250 1HG2 ILE 45 1HG2 ILE 45 4.148 -5.781 -3.008
251 2HG2 ILE 45 2HG2 ILE 45 4.035 -5.343 -1.307
252 3HG2 ILE 45 3HG2 ILE 45 2.700 -6.186 -2.088
253 1HD1 ILE 45 1HD1 ILE 45 5.835 -5.207 -0.976
254 2HD1 ILE 45 2HD1 ILE 45 7.405 -5.970 -0.714
255 3HD1 ILE 45 3HD1 ILE 45 6.067 -6.301 0.387
256 H LYS 46 H LYS 46 2.139 -9.593 -1.442
257 HA LYS 46 HA LYS 46 -0.141 -7.994 -1.690
258 1HB LYS 46 1HB LYS 46 0.554 -10.732 -2.140
259 2HB LYS 46 2HB LYS 46 -0.971 -10.687 -1.267
260 1HG LYS 46 1HG LYS 46 -2.023 -9.440 -2.963
261 2HG LYS 46 2HG LYS 46 -0.486 -9.048 -3.735
262 1HD LYS 46 1HD LYS 46 -0.190 -11.479 -4.213
263 2HD LYS 46 2HD LYS 46 -1.819 -11.750 -3.592
264 1HE LYS 46 1HE LYS 46 -1.575 -9.643 -5.633
265 2HE LYS 46 2HE LYS 46 -1.235 -11.279 -6.194
266 1HZ LYS 46 1HZ LYS 46 -3.467 -11.690 -4.812
267 2HZ LYS 46 2HZ LYS 46 -3.455 -11.319 -6.462
268 3HZ LYS 46 3HZ LYS 46 -3.742 -10.101 -5.324
269 H ILE 47 H ILE 47 0.761 -10.321 0.812
270 HA ILE 47 HA ILE 47 -1.492 -9.858 2.494
271 HB ILE 47 HB ILE 47 1.085 -11.299 2.681
272 1HG1 ILE 47 1HG1 ILE 47 -0.489 -12.998 3.754
273 2HG1 ILE 47 2HG1 ILE 47 -1.793 -11.879 3.371
274 1HG2 ILE 47 1HG2 ILE 47 0.762 -11.676 5.150
275 2HG2 ILE 47 2HG2 ILE 47 -0.338 -10.298 5.136
276 3HG2 ILE 47 3HG2 ILE 47 1.357 -10.077 4.694
277 1HD1 ILE 47 1HD1 ILE 47 -0.006 -13.367 1.480
278 2HD1 ILE 47 2HD1 ILE 47 -1.002 -12.002 0.972
279 3HD1 ILE 47 3HD1 ILE 47 -1.761 -13.450 1.633
280 H TRP 48 H TRP 48 1.766 -8.642 2.301
281 HA TRP 48 HA TRP 48 1.931 -7.163 4.649
282 1HB TRP 48 1HB TRP 48 3.825 -7.711 3.189
283 2HB TRP 48 2HB TRP 48 3.163 -6.691 1.927
284 HD1 TRP 48 HD1 TRP 48 5.562 -6.651 4.719
285 HE1 TRP 48 HE1 TRP 48 6.436 -4.264 5.083
286 HE3 TRP 48 HE3 TRP 48 2.171 -4.053 1.932
287 HZ2 TRP 48 HZ2 TRP 48 5.796 -1.647 4.328
288 HZ3 TRP 48 HZ3 TRP 48 2.370 -1.612 1.805
289 HH2 TRP 48 HH2 TRP 48 4.154 -0.440 2.968
290 H PHE 49 H PHE 49 0.956 -6.135 1.401
291 HA PHE 49 HA PHE 49 0.301 -3.493 2.224
292 1HB PHE 49 1HB PHE 49 -0.025 -5.056 -0.287
293 2HB PHE 49 2HB PHE 49 -1.007 -3.601 -0.079
294 HD1 PHE 49 HD1 PHE 49 2.387 -4.914 -0.359
295 HD2 PHE 49 HD2 PHE 49 -0.011 -1.427 -0.001
296 HE1 PHE 49 HE1 PHE 49 4.356 -3.527 -0.858
297 HE2 PHE 49 HE2 PHE 49 1.956 -0.021 -0.513
298 HZ PHE 49 HZ PHE 49 4.149 -1.086 -0.913
299 H GLN 50 H GLN 50 -1.609 -6.400 1.685
300 HA GLN 50 HA GLN 50 -4.092 -5.133 2.162
301 1HB GLN 50 1HB GLN 50 -3.261 -8.036 2.268
302 2HB GLN 50 2HB GLN 50 -4.921 -7.499 2.488
303 1HG GLN 50 1HG GLN 50 -3.862 -6.330 0.108
304 2HG GLN 50 2HG GLN 50 -3.575 -8.070 0.085
305 1HE2 GLN 50 1HE2 GLN 50 -5.469 -9.439 0.586
306 2HE2 GLN 50 2HE2 GLN 50 -7.013 -8.933 -0.001
307 H ASN 51 H ASN 51 -1.671 -6.593 4.229
308 HA ASN 51 HA ASN 51 -3.359 -6.758 6.541
309 1HB ASN 51 1HB ASN 51 -1.357 -8.200 6.194
310 2HB ASN 51 2HB ASN 51 -0.337 -6.780 6.403
311 1HD2 ASN 51 1HD2 ASN 51 -2.280 -9.158 7.951
312 2HD2 ASN 51 2HD2 ASN 51 -1.917 -8.709 9.579
313 H LYS 52 H LYS 52 -1.094 -4.400 5.249
314 HA LYS 52 HA LYS 52 -0.791 -2.778 7.498
315 1HB LYS 52 1HB LYS 52 -0.023 -2.686 4.807
316 2HB LYS 52 2HB LYS 52 -0.941 -1.209 5.067
317 1HG LYS 52 1HG LYS 52 0.508 -0.722 7.024
318 2HG LYS 52 2HG LYS 52 1.481 -2.131 6.597
319 1HD LYS 52 1HD LYS 52 2.157 -1.157 4.548
320 2HD LYS 52 2HD LYS 52 0.942 0.118 4.671
321 1HE LYS 52 1HE LYS 52 3.218 -0.223 6.616
322 2HE LYS 52 2HE LYS 52 3.291 0.826 5.201
323 1HZ LYS 52 1HZ LYS 52 2.481 1.638 7.602
324 2HZ LYS 52 2HZ LYS 52 0.991 1.207 6.929
325 3HZ LYS 52 3HZ LYS 52 1.967 2.352 6.157
326 H ARG 53 H ARG 53 -3.419 -3.030 5.208
327 HA ARG 53 HA ARG 53 -4.778 -0.743 6.435
328 1HB ARG 53 1HB ARG 53 -5.402 -2.359 3.963
329 2HB ARG 53 2HB ARG 53 -6.424 -1.065 4.573
330 1HG ARG 53 1HG ARG 53 -4.909 0.581 4.006
331 2HG ARG 53 2HG ARG 53 -3.544 -0.536 3.993
332 1HD ARG 53 1HD ARG 53 -4.001 0.002 1.731
333 2HD ARG 53 2HD ARG 53 -4.604 -1.634 1.992
334 HE ARG 53 HE ARG 53 -6.733 -0.881 1.604
335 1HH1 ARG 53 1HH1 ARG 53 -4.632 1.859 2.114
336 2HH1 ARG 53 2HH1 ARG 53 -5.828 3.021 1.647
337 1HH2 ARG 53 1HH2 ARG 53 -8.307 0.646 0.990
338 2HH2 ARG 53 2HH2 ARG 53 -7.915 2.333 1.010
339 H ALA 54 H ALA 54 -4.416 -3.647 7.470
340 HA ALA 54 HA ALA 54 -6.912 -4.909 7.535
341 1HB ALA 54 1HB ALA 54 -4.891 -5.032 9.759
342 2HB ALA 54 2HB ALA 54 -4.674 -5.866 8.221
343 3HB ALA 54 3HB ALA 54 -6.042 -6.271 9.256
344 H LYS 55 H LYS 55 -5.399 -2.878 10.056
345 HA LYS 55 HA LYS 55 -8.097 -2.053 10.880
346 1HB LYS 55 1HB LYS 55 -7.178 -2.071 13.269
347 2HB LYS 55 2HB LYS 55 -7.576 -3.623 12.546
348 1HG LYS 55 1HG LYS 55 -5.171 -3.902 11.972
349 2HG LYS 55 2HG LYS 55 -4.837 -2.422 12.874
350 1HD LYS 55 1HD LYS 55 -6.225 -3.733 14.738
351 2HD LYS 55 2HD LYS 55 -5.590 -5.119 13.850
352 1HE LYS 55 1HE LYS 55 -4.027 -2.897 15.151
353 2HE LYS 55 2HE LYS 55 -4.056 -4.599 15.610
354 1HZ LYS 55 1HZ LYS 55 -2.964 -5.170 13.564
355 2HZ LYS 55 2HZ LYS 55 -2.059 -3.976 14.347
356 3HZ LYS 55 3HZ LYS 55 -3.027 -3.569 13.021
357 H ILE 56 H ILE 56 -4.617 -1.391 11.197
358 HA ILE 56 HA ILE 56 -3.438 0.555 11.277
359 HB ILE 56 HB ILE 56 -5.899 1.866 10.123
360 1HG1 ILE 56 1HG1 ILE 56 -3.585 0.684 8.584
361 2HG1 ILE 56 2HG1 ILE 56 -5.090 -0.184 8.866
362 1HG2 ILE 56 1HG2 ILE 56 -3.180 2.731 9.383
363 2HG2 ILE 56 2HG2 ILE 56 -3.677 3.067 11.041
364 3HG2 ILE 56 3HG2 ILE 56 -4.632 3.683 9.692
365 1HD1 ILE 56 1HD1 ILE 56 -6.246 1.064 7.379
366 2HD1 ILE 56 2HD1 ILE 56 -4.639 1.239 6.675
367 3HD1 ILE 56 3HD1 ILE 56 -5.300 2.519 7.692
368 H LYS 57 H LYS 57 -3.417 0.586 13.558
369 HA LYS 57 HA LYS 57 -4.784 2.877 14.687
370 1HB LYS 57 1HB LYS 57 -5.734 0.204 15.134
371 2HB LYS 57 2HB LYS 57 -5.127 0.863 16.646
372 1HG LYS 57 1HG LYS 57 -6.838 2.677 15.095
373 2HG LYS 57 2HG LYS 57 -7.634 1.229 15.716
374 1HD LYS 57 1HD LYS 57 -5.877 2.663 17.609
375 2HD LYS 57 2HD LYS 57 -7.356 3.502 17.133
376 1HE LYS 57 1HE LYS 57 -8.073 0.827 17.656
377 2HE LYS 57 2HE LYS 57 -7.014 1.332 18.972
378 1HZ LYS 57 1HZ LYS 57 -8.457 3.331 19.198
379 2HZ LYS 57 2HZ LYS 57 -9.231 1.874 19.569
380 3HZ LYS 57 3HZ LYS 57 -9.529 2.636 18.089
381 H LYS 58 H LYS 58 -4.058 3.235 17.004
382 HA LYS 58 HA LYS 58 -1.194 2.622 17.162
383 1HB LYS 58 1HB LYS 58 -2.889 4.901 18.004
384 2HB LYS 58 2HB LYS 58 -1.554 4.494 19.073
385 1HG LYS 58 1HG LYS 58 -0.236 4.488 16.758
386 2HG LYS 58 2HG LYS 58 -1.525 5.618 16.341
387 1HD LYS 58 1HD LYS 58 -0.121 7.135 17.253
388 2HD LYS 58 2HD LYS 58 -0.826 6.565 18.767
389 1HE LYS 58 1HE LYS 58 1.011 5.078 19.137
390 2HE LYS 58 2HE LYS 58 1.662 5.400 17.532
391 1HZ LYS 58 1HZ LYS 58 2.613 6.601 19.629
392 2HZ LYS 58 2HZ LYS 58 1.311 7.650 19.379
393 3HZ LYS 58 3HZ LYS 58 2.462 7.428 18.160
394 H SER 59 H SER 59 -3.260 0.722 17.945
395 HA SER 59 HA SER 59 -3.111 0.669 20.855
396 1HB SER 59 1HB SER 59 -5.263 0.092 20.005
397 2HB SER 59 2HB SER 59 -4.576 -1.033 18.835
398 HG SER 59 HG SER 59 -4.515 -1.324 21.659
Start of MODEL 4
1 1H ALA 16 1H ALA 16 -22.344 12.595 -3.937
2 2H ALA 16 2H ALA 16 -22.784 12.660 -5.595
3 3H ALA 16 3H ALA 16 -21.341 13.418 -5.057
4 HA ALA 16 HA ALA 16 -21.913 10.533 -5.007
5 1HB ALA 16 1HB ALA 16 -21.611 11.216 -7.267
6 2HB ALA 16 2HB ALA 16 -20.101 10.473 -6.737
7 3HB ALA 16 3HB ALA 16 -20.232 12.229 -6.841
8 H LYS 17 H LYS 17 -19.630 9.428 -4.944
9 HA LYS 17 HA LYS 17 -17.976 10.782 -2.922
10 1HB LYS 17 1HB LYS 17 -19.226 8.076 -2.836
11 2HB LYS 17 2HB LYS 17 -17.634 8.278 -2.119
12 1HG LYS 17 1HG LYS 17 -19.043 10.412 -1.107
13 2HG LYS 17 2HG LYS 17 -20.242 9.117 -1.149
14 1HD LYS 17 1HD LYS 17 -19.157 7.878 0.418
15 2HD LYS 17 2HD LYS 17 -17.560 8.421 -0.103
16 1HE LYS 17 1HE LYS 17 -19.551 9.919 1.592
17 2HE LYS 17 2HE LYS 17 -17.969 9.311 2.079
18 1HZ LYS 17 1HZ LYS 17 -17.287 10.877 0.043
19 2HZ LYS 17 2HZ LYS 17 -17.363 11.418 1.644
20 3HZ LYS 17 3HZ LYS 17 -18.655 11.708 0.592
21 H ARG 18 H ARG 18 -16.081 11.160 -3.857
22 HA ARG 18 HA ARG 18 -15.081 9.748 -6.086
23 1HB ARG 18 1HB ARG 18 -14.505 12.134 -5.025
24 2HB ARG 18 2HB ARG 18 -13.188 11.209 -4.317
25 1HG ARG 18 1HG ARG 18 -12.985 10.396 -6.865
26 2HG ARG 18 2HG ARG 18 -13.657 12.009 -7.115
27 1HD ARG 18 1HD ARG 18 -11.303 11.536 -5.312
28 2HD ARG 18 2HD ARG 18 -11.107 11.767 -7.048
29 HE ARG 18 HE ARG 18 -11.746 13.772 -5.091
30 1HH1 ARG 18 1HH1 ARG 18 -11.955 12.899 -8.463
31 2HH1 ARG 18 2HH1 ARG 18 -12.083 14.537 -9.009
32 1HH2 ARG 18 1HH2 ARG 18 -11.914 15.929 -5.806
33 2HH2 ARG 18 2HH2 ARG 18 -12.060 16.257 -7.501
34 H GLU 19 H GLU 19 -13.674 8.080 -6.276
35 HA GLU 19 HA GLU 19 -12.992 6.662 -3.800
36 1HB GLU 19 1HB GLU 19 -13.042 5.675 -6.658
37 2HB GLU 19 2HB GLU 19 -12.661 4.693 -5.248
38 1HG GLU 19 1HG GLU 19 -14.977 5.370 -4.391
39 2HG GLU 19 2HG GLU 19 -15.287 5.888 -6.046
40 H PHE 20 H PHE 20 -10.937 6.354 -3.179
41 HA PHE 20 HA PHE 20 -8.853 7.779 -4.545
42 1HB PHE 20 1HB PHE 20 -7.421 6.977 -2.683
43 2HB PHE 20 2HB PHE 20 -8.888 7.770 -2.120
44 HD1 PHE 20 HD1 PHE 20 -7.576 4.376 -2.914
45 HD2 PHE 20 HD2 PHE 20 -10.161 6.744 -0.502
46 HE1 PHE 20 HE1 PHE 20 -8.120 2.394 -1.561
47 HE2 PHE 20 HE2 PHE 20 -10.711 4.766 0.856
48 HZ PHE 20 HZ PHE 20 -9.690 2.589 0.327
49 H ASN 21 H ASN 21 -6.601 6.415 -4.405
50 HA ASN 21 HA ASN 21 -6.902 4.425 -6.474
51 1HB ASN 21 1HB ASN 21 -4.408 5.400 -5.071
52 2HB ASN 21 2HB ASN 21 -4.458 4.412 -6.527
53 1HD2 ASN 21 1HD2 ASN 21 -5.991 5.445 -8.249
54 2HD2 ASN 21 2HD2 ASN 21 -5.683 7.114 -8.568
55 H GLU 22 H GLU 22 -7.750 2.565 -5.692
56 HA GLU 22 HA GLU 22 -6.979 1.414 -3.198
57 1HB GLU 22 1HB GLU 22 -9.032 1.005 -5.049
58 2HB GLU 22 2HB GLU 22 -8.108 -0.491 -5.075
59 1HG GLU 22 1HG GLU 22 -8.525 -0.935 -2.836
60 2HG GLU 22 2HG GLU 22 -8.950 0.739 -2.485
61 H ASN 23 H ASN 23 -4.706 1.349 -3.349
62 HA ASN 23 HA ASN 23 -2.699 0.343 -3.687
63 1HB ASN 23 1HB ASN 23 -4.166 -1.984 -4.894
64 2HB ASN 23 2HB ASN 23 -2.614 -1.979 -4.067
65 1HD2 ASN 23 1HD2 ASN 23 -2.807 -1.036 -1.756
66 2HD2 ASN 23 2HD2 ASN 23 -4.097 -1.684 -0.808
67 H ARG 24 H ARG 24 -2.364 1.966 -5.262
68 HA ARG 24 HA ARG 24 -1.559 0.911 -7.805
69 1HB ARG 24 1HB ARG 24 -3.698 3.056 -7.746
70 2HB ARG 24 2HB ARG 24 -2.888 2.448 -9.184
71 1HG ARG 24 1HG ARG 24 -3.836 0.191 -8.643
72 2HG ARG 24 2HG ARG 24 -4.794 0.977 -7.387
73 1HD ARG 24 1HD ARG 24 -5.837 2.407 -9.059
74 2HD ARG 24 2HD ARG 24 -4.851 1.672 -10.322
75 HE ARG 24 HE ARG 24 -7.215 0.576 -9.101
76 1HH1 ARG 24 1HH1 ARG 24 -4.287 -0.159 -10.853
77 2HH1 ARG 24 2HH1 ARG 24 -4.890 -1.656 -11.479
78 1HH2 ARG 24 1HH2 ARG 24 -8.009 -1.392 -9.924
79 2HH2 ARG 24 2HH2 ARG 24 -7.002 -2.356 -10.953
80 H TYR 25 H TYR 25 -2.442 4.025 -6.354
81 HA TYR 25 HA TYR 25 -0.672 5.736 -7.437
82 1HB TYR 25 1HB TYR 25 -0.811 7.063 -5.411
83 2HB TYR 25 2HB TYR 25 -2.374 6.320 -5.734
84 HD1 TYR 25 HD1 TYR 25 -2.642 3.909 -4.555
85 HD2 TYR 25 HD2 TYR 25 -0.076 7.032 -3.226
86 HE1 TYR 25 HE1 TYR 25 -2.642 2.937 -2.303
87 HE2 TYR 25 HE2 TYR 25 -0.072 6.070 -0.964
88 HH TYR 25 HH TYR 25 -0.892 3.064 -0.241
89 H LEU 26 H LEU 26 0.071 3.611 -4.675
90 HA LEU 26 HA LEU 26 2.926 4.124 -5.187
91 1HB LEU 26 1HB LEU 26 3.254 4.707 -3.066
92 2HB LEU 26 2HB LEU 26 1.512 4.786 -2.908
93 HG LEU 26 HG LEU 26 3.202 2.368 -2.259
94 1HD1 LEU 26 1HD1 LEU 26 1.729 4.083 -0.294
95 2HD1 LEU 26 2HD1 LEU 26 3.388 4.446 -0.773
96 3HD1 LEU 26 3HD1 LEU 26 3.009 2.905 -0.001
97 1HD2 LEU 26 1HD2 LEU 26 0.345 2.751 -2.617
98 2HD2 LEU 26 2HD2 LEU 26 0.744 2.137 -1.012
99 3HD2 LEU 26 3HD2 LEU 26 1.277 1.262 -2.448
100 H THR 27 H THR 27 0.489 1.783 -5.026
101 HA THR 27 HA THR 27 1.641 -0.448 -3.958
102 HB THR 27 HB THR 27 -0.173 -0.124 -6.334
103 HG1 THR 27 HG1 THR 27 -0.535 -1.087 -3.694
104 1HG2 THR 27 1HG2 THR 27 -0.547 -2.707 -5.503
105 2HG2 THR 27 2HG2 THR 27 1.210 -2.553 -5.536
106 3HG2 THR 27 3HG2 THR 27 0.266 -2.203 -6.985
107 H GLU 28 H GLU 28 1.569 -0.222 -7.493
108 HA GLU 28 HA GLU 28 3.708 -1.961 -7.893
109 1HB GLU 28 1HB GLU 28 2.853 0.205 -9.807
110 2HB GLU 28 2HB GLU 28 3.627 -1.325 -10.199
111 1HG GLU 28 1HG GLU 28 1.245 -1.883 -8.760
112 2HG GLU 28 2HG GLU 28 0.865 -0.726 -10.035
113 H ARG 29 H ARG 29 3.700 1.579 -7.703
114 HA ARG 29 HA ARG 29 6.371 1.944 -8.537
115 1HB ARG 29 1HB ARG 29 4.494 3.684 -8.324
116 2HB ARG 29 2HB ARG 29 4.938 3.772 -6.625
117 1HG ARG 29 1HG ARG 29 7.359 4.075 -7.787
118 2HG ARG 29 2HG ARG 29 6.313 4.821 -8.997
119 1HD ARG 29 1HD ARG 29 6.563 6.650 -7.708
120 2HD ARG 29 2HD ARG 29 5.292 5.898 -6.746
121 HE ARG 29 HE ARG 29 6.817 5.527 -5.079
122 1HH1 ARG 29 1HH1 ARG 29 8.525 6.317 -8.018
123 2HH1 ARG 29 2HH1 ARG 29 10.068 6.431 -7.240
124 1HH2 ARG 29 1HH2 ARG 29 8.844 5.677 -4.053
125 2HH2 ARG 29 2HH2 ARG 29 10.249 6.067 -4.988
126 H ARG 30 H ARG 30 4.947 1.770 -5.292
127 HA ARG 30 HA ARG 30 7.520 1.915 -4.011
128 1HB ARG 30 1HB ARG 30 5.268 2.759 -3.091
129 2HB ARG 30 2HB ARG 30 4.969 1.081 -2.657
130 1HG ARG 30 1HG ARG 30 6.564 1.070 -1.024
131 2HG ARG 30 2HG ARG 30 7.534 2.318 -1.809
132 1HD ARG 30 1HD ARG 30 5.706 3.947 -1.245
133 2HD ARG 30 2HD ARG 30 4.970 2.675 -0.271
134 HE ARG 30 HE ARG 30 7.708 3.128 0.413
135 1HH1 ARG 30 1HH1 ARG 30 4.457 4.300 0.898
136 2HH1 ARG 30 2HH1 ARG 30 4.811 5.018 2.433
137 1HH2 ARG 30 1HH2 ARG 30 8.175 4.069 2.432
138 2HH2 ARG 30 2HH2 ARG 30 6.921 4.887 3.304
139 H ARG 31 H ARG 31 5.477 -0.609 -5.189
140 HA ARG 31 HA ARG 31 6.185 -2.724 -3.529
141 1HB ARG 31 1HB ARG 31 4.985 -2.402 -6.158
142 2HB ARG 31 2HB ARG 31 5.976 -3.848 -6.068
143 1HG ARG 31 1HG ARG 31 4.728 -4.539 -4.054
144 2HG ARG 31 2HG ARG 31 3.680 -3.134 -4.259
145 1HD ARG 31 1HD ARG 31 2.822 -5.336 -5.183
146 2HD ARG 31 2HD ARG 31 2.798 -3.955 -6.278
147 HE ARG 31 HE ARG 31 5.166 -5.591 -6.468
148 1HH1 ARG 31 1HH1 ARG 31 1.910 -5.090 -7.621
149 2HH1 ARG 31 2HH1 ARG 31 2.180 -5.917 -9.119
150 1HH2 ARG 31 1HH2 ARG 31 5.523 -6.677 -8.438
151 2HH2 ARG 31 2HH2 ARG 31 4.230 -6.817 -9.582
152 H GLN 32 H GLN 32 7.825 -1.396 -6.347
153 HA GLN 32 HA GLN 32 9.798 -3.388 -6.599
154 1HB GLN 32 1HB GLN 32 9.154 -0.939 -7.864
155 2HB GLN 32 2HB GLN 32 10.840 -0.829 -7.376
156 1HG GLN 32 1HG GLN 32 10.915 -1.708 -9.526
157 2HG GLN 32 2HG GLN 32 11.130 -3.110 -8.478
158 1HE2 GLN 32 1HE2 GLN 32 10.462 -4.304 -10.384
159 2HE2 GLN 32 2HE2 GLN 32 8.776 -4.502 -10.706
160 H GLN 33 H GLN 33 9.805 -0.296 -4.862
161 HA GLN 33 HA GLN 33 12.461 -0.655 -3.858
162 1HB GLN 33 1HB GLN 33 10.374 1.230 -2.771
163 2HB GLN 33 2HB GLN 33 12.123 1.383 -2.666
164 1HG GLN 33 1HG GLN 33 12.184 1.625 -5.141
165 2HG GLN 33 2HG GLN 33 10.421 1.650 -5.130
166 1HE2 GLN 33 1HE2 GLN 33 9.897 3.169 -2.926
167 2HE2 GLN 33 2HE2 GLN 33 10.478 4.778 -3.169
168 H LEU 34 H LEU 34 9.209 -1.067 -2.501
169 HA LEU 34 HA LEU 34 10.034 -1.636 0.129
170 1HB LEU 34 1HB LEU 34 7.560 -1.900 -1.434
171 2HB LEU 34 2HB LEU 34 7.711 -3.033 -0.104
172 HG LEU 34 HG LEU 34 7.987 -0.045 0.204
173 1HD1 LEU 34 1HD1 LEU 34 5.605 -1.792 0.799
174 2HD1 LEU 34 2HD1 LEU 34 5.733 -0.658 -0.546
175 3HD1 LEU 34 3HD1 LEU 34 5.744 -0.061 1.113
176 1HD2 LEU 34 1HD2 LEU 34 9.123 -1.272 1.937
177 2HD2 LEU 34 2HD2 LEU 34 7.710 -2.296 2.190
178 3HD2 LEU 34 3HD2 LEU 34 7.640 -0.580 2.595
179 H SER 35 H SER 35 9.492 -3.710 -2.670
180 HA SER 35 HA SER 35 9.812 -6.167 -1.323
181 1HB SER 35 1HB SER 35 8.808 -6.032 -3.556
182 2HB SER 35 2HB SER 35 10.343 -5.481 -4.227
183 HG SER 35 HG SER 35 9.506 -7.988 -3.767
184 H SER 36 H SER 36 12.107 -4.208 -3.217
185 HA SER 36 HA SER 36 14.337 -5.888 -2.733
186 1HB SER 36 1HB SER 36 14.264 -2.972 -3.536
187 2HB SER 36 2HB SER 36 15.673 -4.028 -3.637
188 HG SER 36 HG SER 36 13.270 -4.134 -5.116
189 H GLU 37 H GLU 37 13.150 -2.955 -1.142
190 HA GLU 37 HA GLU 37 15.362 -2.581 0.562
191 1HB GLU 37 1HB GLU 37 13.476 -0.942 0.025
192 2HB GLU 37 2HB GLU 37 12.536 -1.794 1.242
193 1HG GLU 37 1HG GLU 37 15.216 -0.544 1.783
194 2HG GLU 37 2HG GLU 37 13.680 0.285 2.026
195 H LEU 38 H LEU 38 12.268 -4.244 1.081
196 HA LEU 38 HA LEU 38 13.085 -5.109 3.719
197 1HB LEU 38 1HB LEU 38 10.610 -5.362 2.073
198 2HB LEU 38 2HB LEU 38 10.851 -6.467 3.411
199 HG LEU 38 HG LEU 38 11.058 -4.532 4.943
200 1HD1 LEU 38 1HD1 LEU 38 10.576 -2.319 4.238
201 2HD1 LEU 38 2HD1 LEU 38 10.131 -2.859 2.620
202 3HD1 LEU 38 3HD1 LEU 38 11.812 -2.945 3.147
203 1HD2 LEU 38 1HD2 LEU 38 8.648 -3.839 4.780
204 2HD2 LEU 38 2HD2 LEU 38 8.930 -5.579 4.820
205 3HD2 LEU 38 3HD2 LEU 38 8.552 -4.781 3.294
206 H GLY 39 H GLY 39 13.380 -6.273 0.526
207 1HA GLY 39 1HA GLY 39 14.379 -8.188 -0.272
208 2HA GLY 39 2HA GLY 39 14.781 -8.599 1.389
209 H LEU 40 H LEU 40 11.506 -7.986 0.357
210 HA LEU 40 HA LEU 40 10.910 -10.843 0.752
211 1HB LEU 40 1HB LEU 40 8.508 -9.817 1.117
212 2HB LEU 40 2HB LEU 40 9.675 -9.906 2.424
213 HG LEU 40 HG LEU 40 10.304 -7.493 1.754
214 1HD1 LEU 40 1HD1 LEU 40 7.520 -7.456 0.648
215 2HD1 LEU 40 2HD1 LEU 40 8.914 -7.734 -0.394
216 3HD1 LEU 40 3HD1 LEU 40 8.783 -6.232 0.520
217 1HD2 LEU 40 1HD2 LEU 40 9.314 -7.650 3.815
218 2HD2 LEU 40 2HD2 LEU 40 7.866 -8.432 3.182
219 3HD2 LEU 40 3HD2 LEU 40 8.105 -6.700 2.950
220 H ASN 41 H ASN 41 9.153 -11.733 -0.510
221 HA ASN 41 HA ASN 41 9.238 -10.756 -3.239
222 1HB ASN 41 1HB ASN 41 9.265 -13.267 -2.237
223 2HB ASN 41 2HB ASN 41 7.544 -13.090 -2.565
224 1HD2 ASN 41 1HD2 ASN 41 6.963 -12.369 -4.752
225 2HD2 ASN 41 2HD2 ASN 41 7.925 -12.916 -6.078
226 H GLU 42 H GLU 42 7.310 -10.444 -4.508
227 HA GLU 42 HA GLU 42 5.469 -8.682 -3.440
228 1HB GLU 42 1HB GLU 42 5.020 -10.571 -5.761
229 2HB GLU 42 2HB GLU 42 4.138 -9.080 -5.457
230 1HG GLU 42 1HG GLU 42 5.661 -7.889 -6.532
231 2HG GLU 42 2HG GLU 42 6.955 -8.551 -5.535
232 H ALA 43 H ALA 43 5.464 -12.164 -3.458
233 HA ALA 43 HA ALA 43 2.760 -12.670 -2.913
234 1HB ALA 43 1HB ALA 43 4.718 -14.389 -1.528
235 2HB ALA 43 2HB ALA 43 4.924 -14.245 -3.273
236 3HB ALA 43 3HB ALA 43 3.394 -14.821 -2.610
237 H GLN 44 H GLN 44 5.434 -11.715 -0.873
238 HA GLN 44 HA GLN 44 3.957 -11.921 1.600
239 1HB GLN 44 1HB GLN 44 6.621 -10.723 0.846
240 2HB GLN 44 2HB GLN 44 5.968 -10.620 2.476
241 1HG GLN 44 1HG GLN 44 6.401 -13.227 1.048
242 2HG GLN 44 2HG GLN 44 7.628 -12.463 2.058
243 1HE2 GLN 44 1HE2 GLN 44 6.328 -11.562 4.182
244 2HE2 GLN 44 2HE2 GLN 44 5.537 -12.841 5.034
245 H ILE 45 H ILE 45 4.623 -9.604 -0.862
246 HA ILE 45 HA ILE 45 3.994 -7.224 0.505
247 HB ILE 45 HB ILE 45 3.933 -7.935 -2.427
248 1HG1 ILE 45 1HG1 ILE 45 6.129 -7.926 -1.209
249 2HG1 ILE 45 2HG1 ILE 45 6.037 -6.780 -2.543
250 1HG2 ILE 45 1HG2 ILE 45 2.380 -6.019 -1.779
251 2HG2 ILE 45 2HG2 ILE 45 3.583 -5.700 -3.024
252 3HG2 ILE 45 3HG2 ILE 45 3.847 -5.129 -1.380
253 1HD1 ILE 45 1HD1 ILE 45 7.126 -5.712 -0.737
254 2HD1 ILE 45 2HD1 ILE 45 5.855 -6.184 0.392
255 3HD1 ILE 45 3HD1 ILE 45 5.516 -5.003 -0.873
256 H LYS 46 H LYS 46 2.010 -9.525 -1.326
257 HA LYS 46 HA LYS 46 -0.363 -8.039 -1.427
258 1HB LYS 46 1HB LYS 46 -0.447 -11.003 -0.984
259 2HB LYS 46 2HB LYS 46 -1.448 -10.009 -2.033
260 1HG LYS 46 1HG LYS 46 0.690 -9.639 -3.395
261 2HG LYS 46 2HG LYS 46 1.334 -11.009 -2.489
262 1HD LYS 46 1HD LYS 46 0.076 -12.498 -3.611
263 2HD LYS 46 2HD LYS 46 -1.339 -11.445 -3.615
264 1HE LYS 46 1HE LYS 46 -0.241 -10.101 -5.408
265 2HE LYS 46 2HE LYS 46 1.035 -11.317 -5.467
266 1HZ LYS 46 1HZ LYS 46 -0.320 -12.126 -7.073
267 2HZ LYS 46 2HZ LYS 46 -1.726 -11.473 -6.398
268 3HZ LYS 46 3HZ LYS 46 -1.055 -12.884 -5.750
269 H ILE 47 H ILE 47 0.777 -10.385 0.958
270 HA ILE 47 HA ILE 47 -1.403 -10.070 2.756
271 HB ILE 47 HB ILE 47 1.245 -11.396 2.793
272 1HG1 ILE 47 1HG1 ILE 47 -1.120 -12.536 4.160
273 2HG1 ILE 47 2HG1 ILE 47 -1.296 -12.244 2.432
274 1HG2 ILE 47 1HG2 ILE 47 -0.135 -10.548 5.330
275 2HG2 ILE 47 2HG2 ILE 47 1.529 -10.228 4.839
276 3HG2 ILE 47 3HG2 ILE 47 1.031 -11.870 5.255
277 1HD1 ILE 47 1HD1 ILE 47 0.858 -13.541 2.142
278 2HD1 ILE 47 2HD1 ILE 47 -0.564 -14.459 2.640
279 3HD1 ILE 47 3HD1 ILE 47 0.668 -14.028 3.827
280 H TRP 48 H TRP 48 1.805 -8.718 2.490
281 HA TRP 48 HA TRP 48 1.964 -7.280 4.869
282 1HB TRP 48 1HB TRP 48 3.849 -7.735 3.365
283 2HB TRP 48 2HB TRP 48 3.127 -6.721 2.131
284 HD1 TRP 48 HD1 TRP 48 5.588 -6.644 4.862
285 HE1 TRP 48 HE1 TRP 48 6.392 -4.237 5.250
286 HE3 TRP 48 HE3 TRP 48 2.035 -4.111 2.218
287 HZ2 TRP 48 HZ2 TRP 48 5.644 -1.628 4.561
288 HZ3 TRP 48 HZ3 TRP 48 2.148 -1.664 2.134
289 HH2 TRP 48 HH2 TRP 48 3.923 -0.450 3.273
290 H PHE 49 H PHE 49 0.898 -6.237 1.656
291 HA PHE 49 HA PHE 49 0.151 -3.640 2.531
292 1HB PHE 49 1HB PHE 49 -0.129 -5.177 0.002
293 2HB PHE 49 2HB PHE 49 -1.181 -3.776 0.239
294 HD1 PHE 49 HD1 PHE 49 2.273 -4.912 -0.097
295 HD2 PHE 49 HD2 PHE 49 -0.295 -1.561 0.363
296 HE1 PHE 49 HE1 PHE 49 4.163 -3.415 -0.585
297 HE2 PHE 49 HE2 PHE 49 1.591 -0.044 -0.138
298 HZ PHE 49 HZ PHE 49 3.830 -0.986 -0.585
299 H GLN 50 H GLN 50 -1.646 -6.614 1.973
300 HA GLN 50 HA GLN 50 -4.177 -5.470 2.484
301 1HB GLN 50 1HB GLN 50 -3.192 -8.323 2.575
302 2HB GLN 50 2HB GLN 50 -4.871 -7.885 2.856
303 1HG GLN 50 1HG GLN 50 -3.937 -6.666 0.438
304 2HG GLN 50 2HG GLN 50 -3.610 -8.397 0.410
305 1HE2 GLN 50 1HE2 GLN 50 -5.331 -9.850 0.504
306 2HE2 GLN 50 2HE2 GLN 50 -6.954 -9.367 0.157
307 H ASN 51 H ASN 51 -1.661 -6.800 4.525
308 HA ASN 51 HA ASN 51 -3.294 -7.039 6.863
309 1HB ASN 51 1HB ASN 51 -1.199 -8.340 6.498
310 2HB ASN 51 2HB ASN 51 -0.281 -6.850 6.683
311 1HD2 ASN 51 1HD2 ASN 51 -1.522 -9.510 8.245
312 2HD2 ASN 51 2HD2 ASN 51 -1.371 -8.959 9.876
313 H LYS 52 H LYS 52 -1.412 -4.501 5.401
314 HA LYS 52 HA LYS 52 -1.247 -2.837 7.709
315 1HB LYS 52 1HB LYS 52 -0.293 -2.782 5.030
316 2HB LYS 52 2HB LYS 52 -1.154 -1.276 5.318
317 1HG LYS 52 1HG LYS 52 0.226 -0.869 7.297
318 2HG LYS 52 2HG LYS 52 1.098 -2.372 6.990
319 1HD LYS 52 1HD LYS 52 2.155 -1.530 5.115
320 2HD LYS 52 2HD LYS 52 0.919 -0.300 4.845
321 1HE LYS 52 1HE LYS 52 1.768 0.619 7.146
322 2HE LYS 52 2HE LYS 52 3.217 -0.302 6.749
323 1HZ LYS 52 1HZ LYS 52 3.770 1.109 5.103
324 2HZ LYS 52 2HZ LYS 52 2.821 2.204 5.976
325 3HZ LYS 52 3HZ LYS 52 2.168 1.398 4.640
326 H ARG 53 H ARG 53 -3.629 -3.329 5.211
327 HA ARG 53 HA ARG 53 -5.113 -0.941 5.905
328 1HB ARG 53 1HB ARG 53 -4.983 -1.843 3.569
329 2HB ARG 53 2HB ARG 53 -5.952 -3.212 4.099
330 1HG ARG 53 1HG ARG 53 -7.830 -1.836 4.523
331 2HG ARG 53 2HG ARG 53 -6.872 -0.363 4.358
332 1HD ARG 53 1HD ARG 53 -7.400 -2.342 2.145
333 2HD ARG 53 2HD ARG 53 -8.285 -0.836 2.382
334 HE ARG 53 HE ARG 53 -5.445 -0.474 2.176
335 1HH1 ARG 53 1HH1 ARG 53 -8.418 -0.792 0.378
336 2HH1 ARG 53 2HH1 ARG 53 -7.814 0.045 -1.012
337 1HH2 ARG 53 1HH2 ARG 53 -4.647 0.628 0.348
338 2HH2 ARG 53 2HH2 ARG 53 -5.673 0.852 -1.029
339 H ALA 54 H ALA 54 -4.700 -3.629 7.588
340 HA ALA 54 HA ALA 54 -7.446 -4.334 8.139
341 1HB ALA 54 1HB ALA 54 -5.173 -5.749 8.298
342 2HB ALA 54 2HB ALA 54 -6.623 -6.138 9.223
343 3HB ALA 54 3HB ALA 54 -5.315 -5.227 9.977
344 H LYS 55 H LYS 55 -4.991 -2.257 9.479
345 HA LYS 55 HA LYS 55 -6.533 -1.799 11.910
346 1HB LYS 55 1HB LYS 55 -4.616 -0.273 12.489
347 2HB LYS 55 2HB LYS 55 -4.188 -1.965 12.280
348 1HG LYS 55 1HG LYS 55 -3.926 -0.634 9.772
349 2HG LYS 55 2HG LYS 55 -3.079 0.295 11.008
350 1HD LYS 55 1HD LYS 55 -2.619 -2.575 11.231
351 2HD LYS 55 2HD LYS 55 -2.099 -1.914 9.679
352 1HE LYS 55 1HE LYS 55 -0.765 -0.231 10.832
353 2HE LYS 55 2HE LYS 55 -1.307 -0.854 12.390
354 1HZ LYS 55 1HZ LYS 55 -0.329 -3.069 11.372
355 2HZ LYS 55 2HZ LYS 55 0.644 -1.964 12.204
356 3HZ LYS 55 3HZ LYS 55 0.630 -1.970 10.513
357 H ILE 56 H ILE 56 -5.611 -0.154 8.941
358 HA ILE 56 HA ILE 56 -6.250 1.827 8.009
359 HB ILE 56 HB ILE 56 -8.800 1.407 9.567
360 1HG1 ILE 56 1HG1 ILE 56 -8.694 0.516 6.766
361 2HG1 ILE 56 2HG1 ILE 56 -7.680 -0.424 7.857
362 1HG2 ILE 56 1HG2 ILE 56 -9.207 3.410 8.623
363 2HG2 ILE 56 2HG2 ILE 56 -9.527 2.442 7.184
364 3HG2 ILE 56 3HG2 ILE 56 -7.954 3.208 7.399
365 1HD1 ILE 56 1HD1 ILE 56 -10.468 0.127 8.696
366 2HD1 ILE 56 2HD1 ILE 56 -9.453 -1.288 8.978
367 3HD1 ILE 56 3HD1 ILE 56 -10.202 -1.040 7.400
368 H LYS 57 H LYS 57 -4.914 3.350 8.895
369 HA LYS 57 HA LYS 57 -5.054 4.357 11.504
370 1HB LYS 57 1HB LYS 57 -3.839 5.320 8.947
371 2HB LYS 57 2HB LYS 57 -3.901 6.412 10.324
372 1HG LYS 57 1HG LYS 57 -2.787 3.660 10.647
373 2HG LYS 57 2HG LYS 57 -1.804 4.946 9.942
374 1HD LYS 57 1HD LYS 57 -2.674 6.270 12.066
375 2HD LYS 57 2HD LYS 57 -2.834 4.636 12.714
376 1HE LYS 57 1HE LYS 57 -0.683 5.169 13.340
377 2HE LYS 57 2HE LYS 57 -0.409 4.340 11.809
378 1HZ LYS 57 1HZ LYS 57 -0.236 6.468 10.707
379 2HZ LYS 57 2HZ LYS 57 0.872 6.393 11.984
380 3HZ LYS 57 3HZ LYS 57 -0.555 7.286 12.154
381 H LYS 58 H LYS 58 -6.280 5.862 12.467
382 HA LYS 58 HA LYS 58 -7.805 7.760 10.874
383 1HB LYS 58 1HB LYS 58 -9.076 5.476 11.429
384 2HB LYS 58 2HB LYS 58 -9.379 6.315 12.943
385 1HG LYS 58 1HG LYS 58 -10.011 7.487 10.249
386 2HG LYS 58 2HG LYS 58 -11.163 6.553 11.205
387 1HD LYS 58 1HD LYS 58 -11.733 8.510 12.129
388 2HD LYS 58 2HD LYS 58 -10.213 8.390 13.018
389 1HE LYS 58 1HE LYS 58 -9.491 10.234 12.017
390 2HE LYS 58 2HE LYS 58 -9.620 9.431 10.452
391 1HZ LYS 58 1HZ LYS 58 -11.973 10.668 11.743
392 2HZ LYS 58 2HZ LYS 58 -11.748 10.276 10.113
393 3HZ LYS 58 3HZ LYS 58 -10.912 11.580 10.791
394 H SER 59 H SER 59 -7.336 6.488 14.168
395 HA SER 59 HA SER 59 -8.004 8.834 15.537
396 1HB SER 59 1HB SER 59 -6.229 6.507 16.272
397 2HB SER 59 2HB SER 59 -6.559 7.830 17.390
398 HG SER 59 HG SER 59 -8.550 7.137 17.646
Start of MODEL 5
1 1H ALA 16 1H ALA 16 -22.260 9.001 -9.859
2 2H ALA 16 2H ALA 16 -22.445 7.665 -10.921
3 3H ALA 16 3H ALA 16 -22.861 9.246 -11.444
4 HA ALA 16 HA ALA 16 -20.818 8.642 -12.396
5 1HB ALA 16 1HB ALA 16 -21.309 10.955 -11.119
6 2HB ALA 16 2HB ALA 16 -19.831 10.638 -12.028
7 3HB ALA 16 3HB ALA 16 -19.847 10.445 -10.275
8 H LYS 17 H LYS 17 -19.254 7.179 -12.346
9 HA LYS 17 HA LYS 17 -18.449 6.048 -9.773
10 1HB LYS 17 1HB LYS 17 -18.136 5.124 -12.623
11 2HB LYS 17 2HB LYS 17 -17.284 4.350 -11.295
12 1HG LYS 17 1HG LYS 17 -19.338 3.697 -10.265
13 2HG LYS 17 2HG LYS 17 -20.275 4.648 -11.420
14 1HD LYS 17 1HD LYS 17 -18.465 2.678 -12.631
15 2HD LYS 17 2HD LYS 17 -19.762 1.985 -11.655
16 1HE LYS 17 1HE LYS 17 -20.766 2.126 -13.724
17 2HE LYS 17 2HE LYS 17 -21.269 3.644 -12.983
18 1HZ LYS 17 1HZ LYS 17 -18.771 3.717 -14.463
19 2HZ LYS 17 2HZ LYS 17 -20.026 4.849 -14.399
20 3HZ LYS 17 3HZ LYS 17 -20.167 3.487 -15.391
21 H ARG 18 H ARG 18 -16.534 6.438 -8.865
22 HA ARG 18 HA ARG 18 -14.719 8.287 -10.112
23 1HB ARG 18 1HB ARG 18 -14.295 6.767 -7.539
24 2HB ARG 18 2HB ARG 18 -13.531 8.272 -8.032
25 1HG ARG 18 1HG ARG 18 -16.445 7.893 -7.372
26 2HG ARG 18 2HG ARG 18 -15.232 8.675 -6.355
27 1HD ARG 18 1HD ARG 18 -14.899 10.386 -8.074
28 2HD ARG 18 2HD ARG 18 -16.110 9.603 -9.089
29 HE ARG 18 HE ARG 18 -17.336 10.134 -6.666
30 1HH1 ARG 18 1HH1 ARG 18 -15.848 11.963 -9.240
31 2HH1 ARG 18 2HH1 ARG 18 -16.841 13.360 -8.990
32 1HH2 ARG 18 1HH2 ARG 18 -18.642 11.970 -6.336
33 2HH2 ARG 18 2HH2 ARG 18 -18.427 13.364 -7.341
34 H GLU 19 H GLU 19 -14.468 4.924 -8.965
35 HA GLU 19 HA GLU 19 -13.104 3.208 -9.568
36 1HB GLU 19 1HB GLU 19 -13.987 4.160 -11.885
37 2HB GLU 19 2HB GLU 19 -12.292 4.579 -12.089
38 1HG GLU 19 1HG GLU 19 -11.643 2.431 -12.320
39 2HG GLU 19 2HG GLU 19 -12.858 1.826 -11.195
40 H PHE 20 H PHE 20 -11.720 3.997 -7.811
41 HA PHE 20 HA PHE 20 -9.346 5.483 -8.575
42 1HB PHE 20 1HB PHE 20 -8.748 5.311 -6.186
43 2HB PHE 20 2HB PHE 20 -10.370 5.960 -6.410
44 HD1 PHE 20 HD1 PHE 20 -8.589 2.759 -5.769
45 HD2 PHE 20 HD2 PHE 20 -12.134 5.048 -5.229
46 HE1 PHE 20 HE1 PHE 20 -9.479 1.016 -4.281
47 HE2 PHE 20 HE2 PHE 20 -13.032 3.310 -3.736
48 HZ PHE 20 HZ PHE 20 -11.705 1.291 -3.260
49 H ASN 21 H ASN 21 -7.300 4.466 -7.265
50 HA ASN 21 HA ASN 21 -6.891 1.853 -8.533
51 1HB ASN 21 1HB ASN 21 -4.972 3.974 -7.582
52 2HB ASN 21 2HB ASN 21 -4.453 2.362 -8.063
53 1HD2 ASN 21 1HD2 ASN 21 -6.437 5.052 -9.242
54 2HD2 ASN 21 2HD2 ASN 21 -5.931 4.928 -10.889
55 H GLU 22 H GLU 22 -7.595 0.348 -7.101
56 HA GLU 22 HA GLU 22 -7.457 0.451 -4.324
57 1HB GLU 22 1HB GLU 22 -7.323 -2.006 -6.086
58 2HB GLU 22 2HB GLU 22 -7.733 -1.993 -4.376
59 1HG GLU 22 1HG GLU 22 -9.773 -0.893 -4.767
60 2HG GLU 22 2HG GLU 22 -9.317 -0.470 -6.416
61 H ASN 23 H ASN 23 -5.198 -0.969 -6.644
62 HA ASN 23 HA ASN 23 -2.992 -0.473 -4.847
63 1HB ASN 23 1HB ASN 23 -3.322 -3.275 -5.876
64 2HB ASN 23 2HB ASN 23 -2.204 -2.680 -4.658
65 1HD2 ASN 23 1HD2 ASN 23 -3.037 -2.101 -2.593
66 2HD2 ASN 23 2HD2 ASN 23 -4.499 -2.810 -2.008
67 H ARG 24 H ARG 24 -2.520 0.950 -6.545
68 HA ARG 24 HA ARG 24 -0.871 -0.214 -8.610
69 1HB ARG 24 1HB ARG 24 -3.296 1.450 -9.327
70 2HB ARG 24 2HB ARG 24 -2.018 1.009 -10.450
71 1HG ARG 24 1HG ARG 24 -3.788 -0.949 -9.002
72 2HG ARG 24 2HG ARG 24 -4.032 -0.390 -10.656
73 1HD ARG 24 1HD ARG 24 -1.882 -1.317 -11.310
74 2HD ARG 24 2HD ARG 24 -1.580 -1.832 -9.652
75 HE ARG 24 HE ARG 24 -2.870 -3.669 -10.048
76 1HH1 ARG 24 1HH1 ARG 24 -3.664 -1.237 -12.424
77 2HH1 ARG 24 2HH1 ARG 24 -4.718 -2.278 -13.320
78 1HH2 ARG 24 1HH2 ARG 24 -4.258 -5.038 -11.226
79 2HH2 ARG 24 2HH2 ARG 24 -5.056 -4.436 -12.640
80 H TYR 25 H TYR 25 -2.550 2.865 -8.096
81 HA TYR 25 HA TYR 25 -0.830 4.716 -8.911
82 1HB TYR 25 1HB TYR 25 -1.683 6.228 -7.202
83 2HB TYR 25 2HB TYR 25 -2.980 5.195 -7.795
84 HD1 TYR 25 HD1 TYR 25 -3.142 2.879 -6.367
85 HD2 TYR 25 HD2 TYR 25 -1.656 6.597 -4.930
86 HE1 TYR 25 HE1 TYR 25 -3.618 2.167 -4.068
87 HE2 TYR 25 HE2 TYR 25 -2.135 5.897 -2.620
88 HH TYR 25 HH TYR 25 -4.125 3.614 -1.764
89 H LEU 26 H LEU 26 -0.540 3.169 -5.722
90 HA LEU 26 HA LEU 26 2.244 4.115 -5.628
91 1HB LEU 26 1HB LEU 26 2.042 4.821 -3.494
92 2HB LEU 26 2HB LEU 26 0.365 4.999 -3.960
93 HG LEU 26 HG LEU 26 0.341 4.015 -1.823
94 1HD1 LEU 26 1HD1 LEU 26 0.027 1.419 -3.069
95 2HD1 LEU 26 2HD1 LEU 26 -0.761 2.704 -3.981
96 3HD1 LEU 26 3HD1 LEU 26 -1.165 2.453 -2.286
97 1HD2 LEU 26 1HD2 LEU 26 1.898 2.658 -0.970
98 2HD2 LEU 26 2HD2 LEU 26 2.842 3.099 -2.392
99 3HD2 LEU 26 3HD2 LEU 26 1.901 1.608 -2.387
100 H THR 27 H THR 27 0.120 1.445 -5.460
101 HA THR 27 HA THR 27 1.525 -0.373 -3.920
102 HB THR 27 HB THR 27 -0.248 -0.725 -6.326
103 HG1 THR 27 HG1 THR 27 -1.050 -0.011 -4.216
104 1HG2 THR 27 1HG2 THR 27 0.391 -2.832 -6.544
105 2HG2 THR 27 2HG2 THR 27 -0.285 -3.121 -4.941
106 3HG2 THR 27 3HG2 THR 27 1.427 -2.739 -5.121
107 H GLU 28 H GLU 28 1.555 -0.382 -7.486
108 HA GLU 28 HA GLU 28 3.765 -2.039 -7.774
109 1HB GLU 28 1HB GLU 28 2.871 0.133 -9.674
110 2HB GLU 28 2HB GLU 28 3.868 -1.257 -10.080
111 1HG GLU 28 1HG GLU 28 2.112 -2.694 -10.088
112 2HG GLU 28 2HG GLU 28 1.221 -1.790 -8.863
113 H ARG 29 H ARG 29 3.622 1.483 -7.502
114 HA ARG 29 HA ARG 29 6.321 1.982 -8.139
115 1HB ARG 29 1HB ARG 29 4.126 3.538 -7.620
116 2HB ARG 29 2HB ARG 29 5.114 3.819 -6.193
117 1HG ARG 29 1HG ARG 29 5.926 4.253 -9.059
118 2HG ARG 29 2HG ARG 29 5.589 5.493 -7.850
119 1HD ARG 29 1HD ARG 29 7.534 5.029 -6.653
120 2HD ARG 29 2HD ARG 29 7.715 3.435 -7.385
121 HE ARG 29 HE ARG 29 8.807 4.400 -9.158
122 1HH1 ARG 29 1HH1 ARG 29 7.263 6.896 -7.269
123 2HH1 ARG 29 2HH1 ARG 29 8.046 8.191 -8.113
124 1HH2 ARG 29 1HH2 ARG 29 9.835 6.101 -10.268
125 2HH2 ARG 29 2HH2 ARG 29 9.503 7.740 -9.816
126 H ARG 30 H ARG 30 4.695 1.551 -5.013
127 HA ARG 30 HA ARG 30 7.162 1.767 -3.546
128 1HB ARG 30 1HB ARG 30 4.541 2.141 -2.890
129 2HB ARG 30 2HB ARG 30 4.847 0.560 -2.185
130 1HG ARG 30 1HG ARG 30 6.486 1.387 -0.747
131 2HG ARG 30 2HG ARG 30 6.684 2.872 -1.679
132 1HD ARG 30 1HD ARG 30 4.290 3.417 -1.054
133 2HD ARG 30 2HD ARG 30 4.385 2.081 0.093
134 HE ARG 30 HE ARG 30 6.514 3.990 0.370
135 1HH1 ARG 30 1HH1 ARG 30 3.238 3.210 1.282
136 2HH1 ARG 30 2HH1 ARG 30 3.285 4.152 2.734
137 1HH2 ARG 30 1HH2 ARG 30 6.579 5.229 2.280
138 2HH2 ARG 30 2HH2 ARG 30 5.182 5.299 3.301
139 H ARG 31 H ARG 31 5.352 -0.786 -5.011
140 HA ARG 31 HA ARG 31 6.161 -2.963 -3.455
141 1HB ARG 31 1HB ARG 31 4.890 -2.539 -6.019
142 2HB ARG 31 2HB ARG 31 6.010 -3.890 -6.098
143 1HG ARG 31 1HG ARG 31 4.868 -5.086 -4.445
144 2HG ARG 31 2HG ARG 31 3.973 -3.661 -3.912
145 1HD ARG 31 1HD ARG 31 2.321 -4.514 -5.175
146 2HD ARG 31 2HD ARG 31 3.220 -3.797 -6.512
147 HE ARG 31 HE ARG 31 4.327 -6.250 -6.280
148 1HH1 ARG 31 1HH1 ARG 31 1.026 -5.151 -6.554
149 2HH1 ARG 31 2HH1 ARG 31 0.485 -6.582 -7.364
150 1HH2 ARG 31 1HH2 ARG 31 3.618 -8.133 -7.346
151 2HH2 ARG 31 2HH2 ARG 31 1.956 -8.276 -7.815
152 H GLN 32 H GLN 32 7.715 -1.397 -6.211
153 HA GLN 32 HA GLN 32 9.805 -3.253 -6.536
154 1HB GLN 32 1HB GLN 32 8.984 -0.906 -7.789
155 2HB GLN 32 2HB GLN 32 10.584 -0.522 -7.167
156 1HG GLN 32 1HG GLN 32 11.593 -2.245 -8.408
157 2HG GLN 32 2HG GLN 32 10.041 -2.998 -8.771
158 1HE2 GLN 32 1HE2 GLN 32 11.618 0.163 -9.148
159 2HE2 GLN 32 2HE2 GLN 32 11.094 0.420 -10.775
160 H GLN 33 H GLN 33 9.619 -0.241 -4.673
161 HA GLN 33 HA GLN 33 12.292 -0.476 -3.680
162 1HB GLN 33 1HB GLN 33 10.065 1.235 -2.570
163 2HB GLN 33 2HB GLN 33 11.795 1.470 -2.356
164 1HG GLN 33 1HG GLN 33 10.465 1.570 -5.046
165 2HG GLN 33 2HG GLN 33 10.645 2.986 -4.009
166 1HE2 GLN 33 1HE2 GLN 33 11.844 3.757 -5.916
167 2HE2 GLN 33 2HE2 GLN 33 13.526 3.384 -6.030
168 H LEU 34 H LEU 34 9.072 -1.130 -2.336
169 HA LEU 34 HA LEU 34 9.948 -1.774 0.262
170 1HB LEU 34 1HB LEU 34 7.483 -2.314 -1.323
171 2HB LEU 34 2HB LEU 34 7.730 -3.206 0.165
172 HG LEU 34 HG LEU 34 7.469 -0.220 -0.149
173 1HD1 LEU 34 1HD1 LEU 34 5.501 -1.994 -0.015
174 2HD1 LEU 34 2HD1 LEU 34 5.405 -0.420 0.778
175 3HD1 LEU 34 3HD1 LEU 34 5.843 -1.853 1.708
176 1HD2 LEU 34 1HD2 LEU 34 9.126 -0.437 1.499
177 2HD2 LEU 34 2HD2 LEU 34 8.366 -1.866 2.197
178 3HD2 LEU 34 3HD2 LEU 34 7.617 -0.282 2.397
179 H SER 35 H SER 35 9.474 -3.741 -2.629
180 HA SER 35 HA SER 35 9.935 -6.236 -1.396
181 1HB SER 35 1HB SER 35 8.899 -5.841 -3.677
182 2HB SER 35 2HB SER 35 10.531 -5.556 -4.281
183 HG SER 35 HG SER 35 9.377 -7.927 -3.314
184 H SER 36 H SER 36 12.085 -4.072 -3.232
185 HA SER 36 HA SER 36 14.405 -5.666 -2.899
186 1HB SER 36 1HB SER 36 14.360 -4.117 -4.717
187 2HB SER 36 2HB SER 36 14.028 -2.762 -3.637
188 HG SER 36 HG SER 36 16.086 -2.816 -2.915
189 H GLU 37 H GLU 37 13.176 -2.827 -1.162
190 HA GLU 37 HA GLU 37 15.395 -2.497 0.536
191 1HB GLU 37 1HB GLU 37 13.491 -0.859 0.084
192 2HB GLU 37 2HB GLU 37 12.562 -1.776 1.262
193 1HG GLU 37 1HG GLU 37 13.453 0.024 2.452
194 2HG GLU 37 2HG GLU 37 14.470 -1.352 2.877
195 H LEU 38 H LEU 38 12.338 -4.241 1.005
196 HA LEU 38 HA LEU 38 13.189 -5.187 3.606
197 1HB LEU 38 1HB LEU 38 10.722 -5.646 1.947
198 2HB LEU 38 2HB LEU 38 11.010 -6.502 3.450
199 HG LEU 38 HG LEU 38 11.176 -3.537 3.529
200 1HD1 LEU 38 1HD1 LEU 38 8.829 -3.215 3.620
201 2HD1 LEU 38 2HD1 LEU 38 8.520 -4.950 3.537
202 3HD1 LEU 38 3HD1 LEU 38 9.164 -4.100 2.132
203 1HD2 LEU 38 1HD2 LEU 38 9.764 -4.230 5.657
204 2HD2 LEU 38 2HD2 LEU 38 11.521 -4.382 5.618
205 3HD2 LEU 38 3HD2 LEU 38 10.507 -5.797 5.335
206 H GLY 39 H GLY 39 13.365 -6.251 0.343
207 1HA GLY 39 1HA GLY 39 14.411 -8.094 -0.557
208 2HA GLY 39 2HA GLY 39 14.912 -8.535 1.068
209 H LEU 40 H LEU 40 11.553 -8.039 0.298
210 HA LEU 40 HA LEU 40 11.116 -10.930 0.625
211 1HB LEU 40 1HB LEU 40 8.664 -9.917 1.040
212 2HB LEU 40 2HB LEU 40 9.836 -10.167 2.319
213 HG LEU 40 HG LEU 40 10.543 -7.756 1.974
214 1HD1 LEU 40 1HD1 LEU 40 7.905 -7.160 0.815
215 2HD1 LEU 40 2HD1 LEU 40 9.082 -7.873 -0.286
216 3HD1 LEU 40 3HD1 LEU 40 9.463 -6.374 0.562
217 1HD2 LEU 40 1HD2 LEU 40 7.831 -8.543 2.993
218 2HD2 LEU 40 2HD2 LEU 40 8.444 -6.897 3.145
219 3HD2 LEU 40 3HD2 LEU 40 9.307 -8.232 3.909
220 H ASN 41 H ASN 41 9.252 -11.837 -0.531
221 HA ASN 41 HA ASN 41 9.248 -10.898 -3.276
222 1HB ASN 41 1HB ASN 41 7.851 -13.017 -3.626
223 2HB ASN 41 2HB ASN 41 9.526 -13.234 -3.128
224 1HD2 ASN 41 1HD2 ASN 41 6.225 -13.104 -1.944
225 2HD2 ASN 41 2HD2 ASN 41 6.462 -14.164 -0.601
226 H GLU 42 H GLU 42 7.281 -10.626 -4.489
227 HA GLU 42 HA GLU 42 5.498 -8.809 -3.391
228 1HB GLU 42 1HB GLU 42 5.028 -10.673 -5.728
229 2HB GLU 42 2HB GLU 42 4.122 -9.202 -5.395
230 1HG GLU 42 1HG GLU 42 5.910 -7.825 -5.956
231 2HG GLU 42 2HG GLU 42 7.088 -9.124 -5.779
232 H ALA 43 H ALA 43 5.389 -12.294 -3.435
233 HA ALA 43 HA ALA 43 2.675 -12.710 -2.875
234 1HB ALA 43 1HB ALA 43 4.617 -14.485 -1.520
235 2HB ALA 43 2HB ALA 43 4.744 -14.365 -3.275
236 3HB ALA 43 3HB ALA 43 3.230 -14.886 -2.535
237 H GLN 44 H GLN 44 5.366 -11.803 -0.845
238 HA GLN 44 HA GLN 44 3.891 -11.997 1.633
239 1HB GLN 44 1HB GLN 44 6.599 -10.952 0.846
240 2HB GLN 44 2HB GLN 44 5.954 -10.670 2.456
241 1HG GLN 44 1HG GLN 44 6.340 -13.386 1.221
242 2HG GLN 44 2HG GLN 44 7.474 -12.610 2.326
243 1HE2 GLN 44 1HE2 GLN 44 5.920 -11.550 4.227
244 2HE2 GLN 44 2HE2 GLN 44 5.023 -12.775 5.050
245 H ILE 45 H ILE 45 4.621 -9.689 -0.820
246 HA ILE 45 HA ILE 45 4.048 -7.298 0.552
247 HB ILE 45 HB ILE 45 3.960 -7.990 -2.384
248 1HG1 ILE 45 1HG1 ILE 45 6.157 -8.058 -1.141
249 2HG1 ILE 45 2HG1 ILE 45 6.106 -6.951 -2.510
250 1HG2 ILE 45 1HG2 ILE 45 3.915 -5.213 -1.241
251 2HG2 ILE 45 2HG2 ILE 45 2.470 -6.054 -1.799
252 3HG2 ILE 45 3HG2 ILE 45 3.772 -5.691 -2.929
253 1HD1 ILE 45 1HD1 ILE 45 7.238 -5.849 -0.759
254 2HD1 ILE 45 2HD1 ILE 45 5.986 -6.270 0.412
255 3HD1 ILE 45 3HD1 ILE 45 5.639 -5.110 -0.870
256 H LYS 46 H LYS 46 2.009 -9.542 -1.294
257 HA LYS 46 HA LYS 46 -0.319 -7.996 -1.408
258 1HB LYS 46 1HB LYS 46 0.093 -10.188 -2.588
259 2HB LYS 46 2HB LYS 46 -0.216 -10.997 -1.058
260 1HG LYS 46 1HG LYS 46 -2.470 -9.906 -1.039
261 2HG LYS 46 2HG LYS 46 -2.139 -9.353 -2.681
262 1HD LYS 46 1HD LYS 46 -1.598 -12.181 -2.383
263 2HD LYS 46 2HD LYS 46 -3.257 -11.789 -1.928
264 1HE LYS 46 1HE LYS 46 -3.207 -12.310 -4.270
265 2HE LYS 46 2HE LYS 46 -3.507 -10.583 -4.083
266 1HZ LYS 46 1HZ LYS 46 -0.892 -10.527 -4.289
267 2HZ LYS 46 2HZ LYS 46 -1.892 -10.518 -5.653
268 3HZ LYS 46 3HZ LYS 46 -1.161 -11.958 -5.150
269 H ILE 47 H ILE 47 0.750 -10.349 1.003
270 HA ILE 47 HA ILE 47 -1.436 -9.972 2.793
271 HB ILE 47 HB ILE 47 1.178 -11.362 2.837
272 1HG1 ILE 47 1HG1 ILE 47 -0.446 -13.016 4.101
273 2HG1 ILE 47 2HG1 ILE 47 -1.691 -11.970 3.425
274 1HG2 ILE 47 1HG2 ILE 47 0.981 -11.789 5.307
275 2HG2 ILE 47 2HG2 ILE 47 -0.156 -10.443 5.374
276 3HG2 ILE 47 3HG2 ILE 47 1.509 -10.165 4.861
277 1HD1 ILE 47 1HD1 ILE 47 -0.843 -12.408 1.184
278 2HD1 ILE 47 2HD1 ILE 47 -1.288 -13.900 2.011
279 3HD1 ILE 47 3HD1 ILE 47 0.411 -13.448 1.859
280 H TRP 48 H TRP 48 1.804 -8.695 2.515
281 HA TRP 48 HA TRP 48 1.989 -7.237 4.881
282 1HB TRP 48 1HB TRP 48 3.870 -7.735 3.392
283 2HB TRP 48 2HB TRP 48 3.166 -6.732 2.140
284 HD1 TRP 48 HD1 TRP 48 5.629 -6.640 4.867
285 HE1 TRP 48 HE1 TRP 48 6.456 -4.236 5.221
286 HE3 TRP 48 HE3 TRP 48 2.098 -4.109 2.194
287 HZ2 TRP 48 HZ2 TRP 48 5.731 -1.630 4.500
288 HZ3 TRP 48 HZ3 TRP 48 2.233 -1.666 2.078
289 HH2 TRP 48 HH2 TRP 48 4.021 -0.457 3.196
290 H PHE 49 H PHE 49 0.950 -6.201 1.654
291 HA PHE 49 HA PHE 49 0.219 -3.586 2.509
292 1HB PHE 49 1HB PHE 49 -0.071 -5.141 -0.012
293 2HB PHE 49 2HB PHE 49 -1.110 -3.729 0.218
294 HD1 PHE 49 HD1 PHE 49 2.326 -4.902 -0.088
295 HD2 PHE 49 HD2 PHE 49 -0.211 -1.523 0.296
296 HE1 PHE 49 HE1 PHE 49 4.233 -3.435 -0.607
297 HE2 PHE 49 HE2 PHE 49 1.694 -0.031 -0.218
298 HZ PHE 49 HZ PHE 49 3.926 -1.002 -0.648
299 H GLN 50 H GLN 50 -1.568 -6.541 1.891
300 HA GLN 50 HA GLN 50 -4.113 -5.462 2.359
301 1HB GLN 50 1HB GLN 50 -3.960 -7.551 1.222
302 2HB GLN 50 2HB GLN 50 -3.026 -8.272 2.525
303 1HG GLN 50 1HG GLN 50 -4.842 -8.816 3.695
304 2HG GLN 50 2HG GLN 50 -5.653 -7.292 3.337
305 1HE2 GLN 50 1HE2 GLN 50 -4.804 -10.425 1.950
306 2HE2 GLN 50 2HE2 GLN 50 -6.174 -10.536 0.904
307 H ASN 51 H ASN 51 -1.602 -6.656 4.486
308 HA ASN 51 HA ASN 51 -3.256 -6.860 6.811
309 1HB ASN 51 1HB ASN 51 -0.325 -6.976 6.252
310 2HB ASN 51 2HB ASN 51 -0.849 -6.697 7.910
311 1HD2 ASN 51 1HD2 ASN 51 -0.149 -8.644 8.684
312 2HD2 ASN 51 2HD2 ASN 51 -0.879 -10.150 8.257
313 H LYS 52 H LYS 52 -1.235 -4.368 5.383
314 HA LYS 52 HA LYS 52 -1.302 -2.590 7.597
315 1HB LYS 52 1HB LYS 52 -0.625 -2.298 4.687
316 2HB LYS 52 2HB LYS 52 -0.740 -0.878 5.717
317 1HG LYS 52 1HG LYS 52 0.865 -2.432 7.225
318 2HG LYS 52 2HG LYS 52 1.314 -2.979 5.607
319 1HD LYS 52 1HD LYS 52 2.348 -1.046 5.113
320 2HD LYS 52 2HD LYS 52 1.090 -0.069 5.874
321 1HE LYS 52 1HE LYS 52 3.060 -1.640 7.503
322 2HE LYS 52 2HE LYS 52 3.443 -0.028 6.899
323 1HZ LYS 52 1HZ LYS 52 1.089 0.451 7.992
324 2HZ LYS 52 2HZ LYS 52 2.534 0.553 8.867
325 3HZ LYS 52 3HZ LYS 52 1.572 -0.835 8.980
326 H ARG 53 H ARG 53 -3.443 -3.215 4.920
327 HA ARG 53 HA ARG 53 -5.034 -0.838 5.468
328 1HB ARG 53 1HB ARG 53 -5.633 -3.025 3.480
329 2HB ARG 53 2HB ARG 53 -6.275 -1.388 3.501
330 1HG ARG 53 1HG ARG 53 -3.335 -1.808 3.236
331 2HG ARG 53 2HG ARG 53 -4.384 -2.039 1.837
332 1HD ARG 53 1HD ARG 53 -5.101 0.194 1.867
333 2HD ARG 53 2HD ARG 53 -4.517 0.448 3.511
334 HE ARG 53 HE ARG 53 -2.292 -0.159 2.004
335 1HH1 ARG 53 1HH1 ARG 53 -4.758 2.310 1.994
336 2HH1 ARG 53 2HH1 ARG 53 -3.720 3.521 1.321
337 1HH2 ARG 53 1HH2 ARG 53 -0.924 1.432 1.120
338 2HH2 ARG 53 2HH2 ARG 53 -1.543 3.023 0.823
339 H ALA 54 H ALA 54 -4.763 -3.468 7.163
340 HA ALA 54 HA ALA 54 -7.603 -4.151 7.343
341 1HB ALA 54 1HB ALA 54 -6.625 -5.866 9.038
342 2HB ALA 54 2HB ALA 54 -5.086 -5.466 8.273
343 3HB ALA 54 3HB ALA 54 -6.407 -6.124 7.307
344 H LYS 55 H LYS 55 -6.450 -1.587 8.298
345 HA LYS 55 HA LYS 55 -7.015 -1.841 11.175
346 1HB LYS 55 1HB LYS 55 -4.770 -0.906 10.407
347 2HB LYS 55 2HB LYS 55 -5.664 0.498 9.839
348 1HG LYS 55 1HG LYS 55 -6.594 0.374 12.346
349 2HG LYS 55 2HG LYS 55 -5.000 -0.346 12.584
350 1HD LYS 55 1HD LYS 55 -3.890 1.581 11.948
351 2HD LYS 55 2HD LYS 55 -5.264 2.187 11.020
352 1HE LYS 55 1HE LYS 55 -5.116 3.540 12.957
353 2HE LYS 55 2HE LYS 55 -6.480 2.451 13.211
354 1HZ LYS 55 1HZ LYS 55 -5.406 1.335 14.847
355 2HZ LYS 55 2HZ LYS 55 -4.640 2.832 15.040
356 3HZ LYS 55 3HZ LYS 55 -3.866 1.590 14.192
357 H ILE 56 H ILE 56 -9.055 -1.731 9.136
358 HA ILE 56 HA ILE 56 -10.270 0.885 9.742
359 HB ILE 56 HB ILE 56 -10.976 -0.911 7.422
360 1HG1 ILE 56 1HG1 ILE 56 -9.438 1.665 7.204
361 2HG1 ILE 56 2HG1 ILE 56 -8.606 0.133 7.453
362 1HG2 ILE 56 1HG2 ILE 56 -12.545 0.595 6.843
363 2HG2 ILE 56 2HG2 ILE 56 -11.568 1.969 7.362
364 3HG2 ILE 56 3HG2 ILE 56 -12.474 1.033 8.550
365 1HD1 ILE 56 1HD1 ILE 56 -8.542 0.301 5.178
366 2HD1 ILE 56 2HD1 ILE 56 -10.102 1.119 5.083
367 3HD1 ILE 56 3HD1 ILE 56 -10.033 -0.617 5.391
368 H LYS 57 H LYS 57 -10.918 -0.158 11.787
369 HA LYS 57 HA LYS 57 -12.639 -2.362 11.926
370 1HB LYS 57 1HB LYS 57 -12.639 -0.003 13.809
371 2HB LYS 57 2HB LYS 57 -13.146 -1.647 14.165
372 1HG LYS 57 1HG LYS 57 -11.099 -1.841 15.045
373 2HG LYS 57 2HG LYS 57 -10.592 -2.063 13.369
374 1HD LYS 57 1HD LYS 57 -10.630 0.658 13.588
375 2HD LYS 57 2HD LYS 57 -10.118 0.173 15.205
376 1HE LYS 57 1HE LYS 57 -8.806 -1.205 12.947
377 2HE LYS 57 2HE LYS 57 -8.424 0.505 13.143
378 1HZ LYS 57 1HZ LYS 57 -6.888 -0.315 14.546
379 2HZ LYS 57 2HZ LYS 57 -7.729 -1.755 14.830
380 3HZ LYS 57 3HZ LYS 57 -8.171 -0.341 15.648
381 H LYS 58 H LYS 58 -14.940 -1.943 13.032
382 HA LYS 58 HA LYS 58 -16.395 0.119 11.553
383 1HB LYS 58 1HB LYS 58 -18.152 -1.588 10.968
384 2HB LYS 58 2HB LYS 58 -16.633 -1.750 10.096
385 1HG LYS 58 1HG LYS 58 -16.131 -3.734 11.057
386 2HG LYS 58 2HG LYS 58 -16.901 -3.313 12.588
387 1HD LYS 58 1HD LYS 58 -19.035 -3.856 11.797
388 2HD LYS 58 2HD LYS 58 -18.521 -3.802 10.110
389 1HE LYS 58 1HE LYS 58 -17.162 -5.805 10.460
390 2HE LYS 58 2HE LYS 58 -17.669 -5.856 12.148
391 1HZ LYS 58 1HZ LYS 58 -19.541 -6.028 9.852
392 2HZ LYS 58 2HZ LYS 58 -19.907 -6.270 11.486
393 3HZ LYS 58 3HZ LYS 58 -18.921 -7.375 10.668
394 H SER 59 H SER 59 -18.742 0.188 12.291
395 HA SER 59 HA SER 59 -18.812 0.567 15.079
396 1HB SER 59 1HB SER 59 -21.121 1.158 14.791
397 2HB SER 59 2HB SER 59 -20.251 1.748 13.376
398 HG SER 59 HG SER 59 -22.036 0.718 12.607
Start of MODEL 6
1 1H ALA 16 1H ALA 16 -17.355 3.635 -9.125
2 2H ALA 16 2H ALA 16 -18.459 3.502 -10.433
3 3H ALA 16 3H ALA 16 -18.414 4.934 -9.488
4 HA ALA 16 HA ALA 16 -16.463 3.923 -11.423
5 1HB ALA 16 1HB ALA 16 -17.239 6.753 -11.327
6 2HB ALA 16 2HB ALA 16 -18.549 5.633 -11.705
7 3HB ALA 16 3HB ALA 16 -17.094 5.657 -12.702
8 H LYS 17 H LYS 17 -14.451 3.887 -10.667
9 HA LYS 17 HA LYS 17 -13.576 5.283 -8.372
10 1HB LYS 17 1HB LYS 17 -12.272 3.662 -10.504
11 2HB LYS 17 2HB LYS 17 -11.245 4.687 -9.512
12 1HG LYS 17 1HG LYS 17 -11.207 2.640 -8.420
13 2HG LYS 17 2HG LYS 17 -12.399 3.573 -7.512
14 1HD LYS 17 1HD LYS 17 -13.706 1.768 -7.791
15 2HD LYS 17 2HD LYS 17 -13.958 2.409 -9.416
16 1HE LYS 17 1HE LYS 17 -13.349 0.230 -9.862
17 2HE LYS 17 2HE LYS 17 -11.803 1.068 -9.986
18 1HZ LYS 17 1HZ LYS 17 -11.808 0.438 -7.407
19 2HZ LYS 17 2HZ LYS 17 -11.158 -0.567 -8.601
20 3HZ LYS 17 3HZ LYS 17 -12.716 -0.855 -8.010
21 H ARG 18 H ARG 18 -11.797 6.869 -8.319
22 HA ARG 18 HA ARG 18 -11.160 8.448 -10.584
23 1HB ARG 18 1HB ARG 18 -13.657 9.020 -9.720
24 2HB ARG 18 2HB ARG 18 -12.726 10.114 -8.706
25 1HG ARG 18 1HG ARG 18 -12.802 11.540 -10.406
26 2HG ARG 18 2HG ARG 18 -11.635 10.487 -11.209
27 1HD ARG 18 1HD ARG 18 -13.367 9.323 -12.362
28 2HD ARG 18 2HD ARG 18 -14.617 10.116 -11.405
29 HE ARG 18 HE ARG 18 -14.510 11.900 -12.824
30 1HH1 ARG 18 1HH1 ARG 18 -11.617 9.990 -13.224
31 2HH1 ARG 18 2HH1 ARG 18 -11.048 10.906 -14.580
32 1HH2 ARG 18 1HH2 ARG 18 -13.764 13.107 -14.606
33 2HH2 ARG 18 2HH2 ARG 18 -12.267 12.676 -15.363
34 H GLU 19 H GLU 19 -10.370 10.771 -9.628
35 HA GLU 19 HA GLU 19 -8.767 11.835 -8.419
36 1HB GLU 19 1HB GLU 19 -10.187 10.183 -6.424
37 2HB GLU 19 2HB GLU 19 -8.590 10.739 -5.944
38 1HG GLU 19 1HG GLU 19 -9.268 13.049 -6.413
39 2HG GLU 19 2HG GLU 19 -10.876 12.475 -6.851
40 H PHE 20 H PHE 20 -6.817 11.449 -9.238
41 HA PHE 20 HA PHE 20 -4.865 10.407 -9.793
42 1HB PHE 20 1HB PHE 20 -3.592 9.569 -7.864
43 2HB PHE 20 2HB PHE 20 -4.404 11.087 -7.493
44 HD1 PHE 20 HD1 PHE 20 -4.628 7.419 -7.053
45 HD2 PHE 20 HD2 PHE 20 -5.885 11.248 -5.694
46 HE1 PHE 20 HE1 PHE 20 -5.668 6.372 -5.084
47 HE2 PHE 20 HE2 PHE 20 -6.927 10.211 -3.721
48 HZ PHE 20 HZ PHE 20 -6.819 7.769 -3.415
49 H ASN 21 H ASN 21 -3.581 8.140 -9.181
50 HA ASN 21 HA ASN 21 -5.310 6.108 -10.359
51 1HB ASN 21 1HB ASN 21 -2.338 5.954 -9.855
52 2HB ASN 21 2HB ASN 21 -3.296 4.934 -10.924
53 1HD2 ASN 21 1HD2 ASN 21 -1.055 6.230 -11.819
54 2HD2 ASN 21 2HD2 ASN 21 -1.510 7.466 -12.938
55 H GLU 22 H GLU 22 -6.511 5.153 -8.824
56 HA GLU 22 HA GLU 22 -5.831 4.702 -6.170
57 1HB GLU 22 1HB GLU 22 -7.826 3.508 -8.042
58 2HB GLU 22 2HB GLU 22 -7.567 2.733 -6.484
59 1HG GLU 22 1HG GLU 22 -7.864 5.229 -5.632
60 2HG GLU 22 2HG GLU 22 -8.792 5.348 -7.127
61 H ASN 23 H ASN 23 -4.785 3.144 -5.069
62 HA ASN 23 HA ASN 23 -3.165 1.566 -4.733
63 1HB ASN 23 1HB ASN 23 -4.931 -0.014 -6.583
64 2HB ASN 23 2HB ASN 23 -3.805 -0.666 -5.401
65 1HD2 ASN 23 1HD2 ASN 23 -4.304 -0.536 -3.204
66 2HD2 ASN 23 2HD2 ASN 23 -5.914 -0.241 -2.651
67 H ARG 24 H ARG 24 -2.534 3.316 -6.760
68 HA ARG 24 HA ARG 24 -0.712 1.678 -8.364
69 1HB ARG 24 1HB ARG 24 -2.418 3.935 -9.434
70 2HB ARG 24 2HB ARG 24 -1.145 3.121 -10.335
71 1HG ARG 24 1HG ARG 24 -3.152 1.320 -9.201
72 2HG ARG 24 2HG ARG 24 -3.784 2.463 -10.388
73 1HD ARG 24 1HD ARG 24 -2.695 1.485 -12.101
74 2HD ARG 24 2HD ARG 24 -1.254 1.171 -11.137
75 HE ARG 24 HE ARG 24 -2.070 -0.914 -10.637
76 1HH1 ARG 24 1HH1 ARG 24 -4.615 1.001 -12.067
77 2HH1 ARG 24 2HH1 ARG 24 -5.695 -0.340 -12.244
78 1HH2 ARG 24 1HH2 ARG 24 -3.491 -2.678 -10.868
79 2HH2 ARG 24 2HH2 ARG 24 -5.058 -2.428 -11.564
80 H TYR 25 H TYR 25 -1.639 4.964 -7.451
81 HA TYR 25 HA TYR 25 0.557 6.447 -7.972
82 1HB TYR 25 1HB TYR 25 -0.054 7.853 -6.066
83 2HB TYR 25 2HB TYR 25 -1.503 7.302 -6.904
84 HD1 TYR 25 HD1 TYR 25 -2.387 4.930 -5.927
85 HD2 TYR 25 HD2 TYR 25 -0.145 7.815 -3.757
86 HE1 TYR 25 HE1 TYR 25 -3.237 3.988 -3.834
87 HE2 TYR 25 HE2 TYR 25 -1.003 6.892 -1.645
88 HH TYR 25 HH TYR 25 -3.590 4.666 -1.525
89 H LEU 26 H LEU 26 0.129 4.386 -5.113
90 HA LEU 26 HA LEU 26 3.019 4.615 -4.601
91 1HB LEU 26 1HB LEU 26 2.654 4.908 -2.395
92 2HB LEU 26 2HB LEU 26 1.088 5.474 -2.941
93 HG LEU 26 HG LEU 26 0.358 2.991 -2.614
94 1HD1 LEU 26 1HD1 LEU 26 2.266 2.849 -0.395
95 2HD1 LEU 26 2HD1 LEU 26 2.985 2.648 -1.994
96 3HD1 LEU 26 3HD1 LEU 26 1.677 1.583 -1.475
97 1HD2 LEU 26 1HD2 LEU 26 -0.758 3.853 -0.896
98 2HD2 LEU 26 2HD2 LEU 26 0.242 5.297 -1.048
99 3HD2 LEU 26 3HD2 LEU 26 0.714 4.010 0.061
100 H THR 27 H THR 27 0.273 2.498 -4.896
101 HA THR 27 HA THR 27 1.059 0.157 -3.804
102 HB THR 27 HB THR 27 -0.342 0.678 -6.412
103 HG1 THR 27 HG1 THR 27 -1.160 -0.050 -3.805
104 1HG2 THR 27 1HG2 THR 27 0.584 -1.883 -5.396
105 2HG2 THR 27 2HG2 THR 27 -0.061 -1.451 -6.980
106 3HG2 THR 27 3HG2 THR 27 -1.160 -1.817 -5.649
107 H GLU 28 H GLU 28 1.436 0.325 -7.315
108 HA GLU 28 HA GLU 28 3.503 -1.558 -7.406
109 1HB GLU 28 1HB GLU 28 2.874 0.544 -9.479
110 2HB GLU 28 2HB GLU 28 3.717 -0.976 -9.747
111 1HG GLU 28 1HG GLU 28 1.502 -2.009 -8.800
112 2HG GLU 28 2HG GLU 28 0.822 -0.462 -9.301
113 H ARG 29 H ARG 29 3.610 1.951 -7.210
114 HA ARG 29 HA ARG 29 6.304 2.313 -7.905
115 1HB ARG 29 1HB ARG 29 4.360 4.033 -7.478
116 2HB ARG 29 2HB ARG 29 5.006 4.048 -5.843
117 1HG ARG 29 1HG ARG 29 6.153 5.787 -6.783
118 2HG ARG 29 2HG ARG 29 7.282 4.459 -7.063
119 1HD ARG 29 1HD ARG 29 6.678 4.280 -9.326
120 2HD ARG 29 2HD ARG 29 5.215 5.238 -9.097
121 HE ARG 29 HE ARG 29 7.632 6.683 -8.532
122 1HH1 ARG 29 1HH1 ARG 29 5.403 5.713 -11.036
123 2HH1 ARG 29 2HH1 ARG 29 5.822 7.022 -12.089
124 1HH2 ARG 29 1HH2 ARG 29 8.184 8.404 -9.914
125 2HH2 ARG 29 2HH2 ARG 29 7.401 8.550 -11.452
126 H ARG 30 H ARG 30 4.779 1.899 -4.732
127 HA ARG 30 HA ARG 30 7.318 1.856 -3.370
128 1HB ARG 30 1HB ARG 30 4.490 1.358 -2.448
129 2HB ARG 30 2HB ARG 30 5.879 1.233 -1.379
130 1HG ARG 30 1HG ARG 30 6.358 3.660 -2.332
131 2HG ARG 30 2HG ARG 30 4.610 3.628 -2.573
132 1HD ARG 30 1HD ARG 30 4.190 3.331 -0.284
133 2HD ARG 30 2HD ARG 30 5.857 2.861 0.047
134 HE ARG 30 HE ARG 30 6.111 5.395 -0.846
135 1HH1 ARG 30 1HH1 ARG 30 4.105 3.939 1.610
136 2HH1 ARG 30 2HH1 ARG 30 4.053 5.367 2.590
137 1HH2 ARG 30 1HH2 ARG 30 6.044 7.272 0.442
138 2HH2 ARG 30 2HH2 ARG 30 5.153 7.258 1.927
139 H ARG 31 H ARG 31 5.213 -0.476 -4.810
140 HA ARG 31 HA ARG 31 5.914 -2.757 -3.339
141 1HB ARG 31 1HB ARG 31 4.384 -2.166 -5.653
142 2HB ARG 31 2HB ARG 31 5.504 -3.448 -6.090
143 1HG ARG 31 1HG ARG 31 4.594 -4.942 -4.596
144 2HG ARG 31 2HG ARG 31 3.927 -3.671 -3.569
145 1HD ARG 31 1HD ARG 31 1.973 -3.925 -4.594
146 2HD ARG 31 2HD ARG 31 2.718 -3.372 -6.092
147 HE ARG 31 HE ARG 31 3.379 -5.989 -6.016
148 1HH1 ARG 31 1HH1 ARG 31 0.345 -4.297 -5.691
149 2HH1 ARG 31 2HH1 ARG 31 -0.593 -5.594 -6.352
150 1HH2 ARG 31 1HH2 ARG 31 2.148 -7.696 -6.886
151 2HH2 ARG 31 2HH2 ARG 31 0.430 -7.524 -7.032
152 H GLN 32 H GLN 32 7.377 -1.314 -6.221
153 HA GLN 32 HA GLN 32 9.286 -3.337 -6.669
154 1HB GLN 32 1HB GLN 32 8.986 -0.489 -7.512
155 2HB GLN 32 2HB GLN 32 10.532 -1.285 -7.776
156 1HG GLN 32 1HG GLN 32 9.213 -3.120 -8.936
157 2HG GLN 32 2HG GLN 32 7.851 -2.002 -8.910
158 1HE2 GLN 32 1HE2 GLN 32 11.326 -1.803 -9.627
159 2HE2 GLN 32 2HE2 GLN 32 11.140 -0.964 -11.127
160 H GLN 33 H GLN 33 9.482 -0.283 -4.873
161 HA GLN 33 HA GLN 33 12.209 -0.694 -4.113
162 1HB GLN 33 1HB GLN 33 10.231 1.193 -2.837
163 2HB GLN 33 2HB GLN 33 11.985 1.312 -2.822
164 1HG GLN 33 1HG GLN 33 10.399 1.424 -5.365
165 2HG GLN 33 2HG GLN 33 10.725 2.856 -4.390
166 1HE2 GLN 33 1HE2 GLN 33 11.588 2.029 -7.119
167 2HE2 GLN 33 2HE2 GLN 33 13.310 2.166 -7.102
168 H LEU 34 H LEU 34 9.081 -1.214 -2.549
169 HA LEU 34 HA LEU 34 10.090 -1.786 0.019
170 1HB LEU 34 1HB LEU 34 7.537 -2.434 -1.402
171 2HB LEU 34 2HB LEU 34 7.868 -3.140 0.166
172 HG LEU 34 HG LEU 34 7.492 -0.230 -0.510
173 1HD1 LEU 34 1HD1 LEU 34 5.535 -0.379 0.596
174 2HD1 LEU 34 2HD1 LEU 34 6.162 -1.535 1.771
175 3HD1 LEU 34 3HD1 LEU 34 5.671 -2.084 0.168
176 1HD2 LEU 34 1HD2 LEU 34 7.937 0.132 1.958
177 2HD2 LEU 34 2HD2 LEU 34 9.348 -0.176 0.946
178 3HD2 LEU 34 3HD2 LEU 34 8.691 -1.463 1.957
179 H SER 35 H SER 35 9.550 -3.805 -2.811
180 HA SER 35 HA SER 35 9.949 -6.295 -1.574
181 1HB SER 35 1HB SER 35 9.259 -5.520 -4.082
182 2HB SER 35 2HB SER 35 10.930 -6.013 -4.350
183 HG SER 35 HG SER 35 8.721 -7.534 -3.836
184 H SER 36 H SER 36 12.227 -4.245 -3.394
185 HA SER 36 HA SER 36 14.495 -5.853 -2.833
186 1HB SER 36 1HB SER 36 13.912 -3.492 -4.347
187 2HB SER 36 2HB SER 36 15.340 -3.194 -3.356
188 HG SER 36 HG SER 36 16.072 -5.312 -4.211
189 H GLU 37 H GLU 37 13.112 -3.000 -1.284
190 HA GLU 37 HA GLU 37 15.264 -2.485 0.469
191 1HB GLU 37 1HB GLU 37 12.366 -1.722 0.428
192 2HB GLU 37 2HB GLU 37 13.352 -1.350 1.836
193 1HG GLU 37 1HG GLU 37 14.888 -0.471 -0.278
194 2HG GLU 37 2HG GLU 37 13.242 -0.057 -0.755
195 H LEU 38 H LEU 38 12.222 -4.264 0.950
196 HA LEU 38 HA LEU 38 13.050 -5.096 3.597
197 1HB LEU 38 1HB LEU 38 10.610 -5.694 1.934
198 2HB LEU 38 2HB LEU 38 10.885 -6.399 3.516
199 HG LEU 38 HG LEU 38 11.037 -3.446 3.360
200 1HD1 LEU 38 1HD1 LEU 38 9.064 -4.249 1.913
201 2HD1 LEU 38 2HD1 LEU 38 8.757 -3.047 3.167
202 3HD1 LEU 38 3HD1 LEU 38 8.337 -4.738 3.444
203 1HD2 LEU 38 1HD2 LEU 38 10.183 -5.554 5.285
204 2HD2 LEU 38 2HD2 LEU 38 9.543 -3.921 5.461
205 3HD2 LEU 38 3HD2 LEU 38 11.284 -4.195 5.514
206 H GLY 39 H GLY 39 13.264 -6.297 0.383
207 1HA GLY 39 1HA GLY 39 14.351 -8.161 -0.420
208 2HA GLY 39 2HA GLY 39 14.817 -8.536 1.231
209 H LEU 40 H LEU 40 11.458 -8.097 0.542
210 HA LEU 40 HA LEU 40 11.060 -10.985 0.899
211 1HB LEU 40 1HB LEU 40 8.589 -10.031 1.245
212 2HB LEU 40 2HB LEU 40 9.754 -10.151 2.550
213 HG LEU 40 HG LEU 40 10.324 -7.781 2.257
214 1HD1 LEU 40 1HD1 LEU 40 8.243 -6.732 0.778
215 2HD1 LEU 40 2HD1 LEU 40 8.768 -8.127 -0.167
216 3HD1 LEU 40 3HD1 LEU 40 9.926 -6.869 0.269
217 1HD2 LEU 40 1HD2 LEU 40 7.593 -8.715 2.907
218 2HD2 LEU 40 2HD2 LEU 40 7.829 -6.975 2.739
219 3HD2 LEU 40 3HD2 LEU 40 8.780 -7.885 3.914
220 H ASN 41 H ASN 41 9.276 -11.989 -0.277
221 HA ASN 41 HA ASN 41 9.327 -11.185 -3.053
222 1HB ASN 41 1HB ASN 41 9.280 -13.618 -1.860
223 2HB ASN 41 2HB ASN 41 7.569 -13.415 -2.223
224 1HD2 ASN 41 1HD2 ASN 41 7.063 -12.774 -4.473
225 2HD2 ASN 41 2HD2 ASN 41 8.010 -13.468 -5.740
226 H GLU 42 H GLU 42 7.433 -10.854 -4.335
227 HA GLU 42 HA GLU 42 5.626 -9.002 -3.358
228 1HB GLU 42 1HB GLU 42 5.152 -10.951 -5.624
229 2HB GLU 42 2HB GLU 42 4.333 -9.412 -5.390
230 1HG GLU 42 1HG GLU 42 7.226 -9.144 -5.471
231 2HG GLU 42 2HG GLU 42 6.560 -9.853 -6.941
232 H ALA 43 H ALA 43 5.517 -12.485 -3.274
233 HA ALA 43 HA ALA 43 2.789 -12.888 -2.763
234 1HB ALA 43 1HB ALA 43 4.886 -14.546 -3.058
235 2HB ALA 43 2HB ALA 43 3.345 -15.050 -2.363
236 3HB ALA 43 3HB ALA 43 4.690 -14.620 -1.306
237 H GLN 44 H GLN 44 5.456 -11.950 -0.710
238 HA GLN 44 HA GLN 44 3.930 -12.040 1.740
239 1HB GLN 44 1HB GLN 44 6.652 -10.982 0.995
240 2HB GLN 44 2HB GLN 44 5.974 -10.763 2.603
241 1HG GLN 44 1HG GLN 44 6.340 -13.453 1.313
242 2HG GLN 44 2HG GLN 44 7.548 -12.693 2.349
243 1HE2 GLN 44 1HE2 GLN 44 6.183 -11.649 4.365
244 2HE2 GLN 44 2HE2 GLN 44 5.305 -12.857 5.232
245 H ILE 45 H ILE 45 4.712 -9.822 -0.777
246 HA ILE 45 HA ILE 45 4.141 -7.381 0.508
247 HB ILE 45 HB ILE 45 4.093 -8.176 -2.404
248 1HG1 ILE 45 1HG1 ILE 45 6.275 -8.200 -1.171
249 2HG1 ILE 45 2HG1 ILE 45 6.227 -7.076 -2.527
250 1HG2 ILE 45 1HG2 ILE 45 2.588 -6.212 -1.880
251 2HG2 ILE 45 2HG2 ILE 45 3.869 -5.921 -3.053
252 3HG2 ILE 45 3HG2 ILE 45 4.047 -5.350 -1.397
253 1HD1 ILE 45 1HD1 ILE 45 7.307 -5.941 -0.795
254 2HD1 ILE 45 2HD1 ILE 45 6.120 -6.460 0.402
255 3HD1 ILE 45 3HD1 ILE 45 5.671 -5.281 -0.830
256 H LYS 46 H LYS 46 2.109 -9.673 -1.287
257 HA LYS 46 HA LYS 46 -0.208 -8.112 -1.462
258 1HB LYS 46 1HB LYS 46 0.513 -10.711 -2.141
259 2HB LYS 46 2HB LYS 46 -0.762 -10.931 -0.951
260 1HG LYS 46 1HG LYS 46 -2.107 -9.266 -2.344
261 2HG LYS 46 2HG LYS 46 -0.894 -9.531 -3.598
262 1HD LYS 46 1HD LYS 46 -1.566 -11.679 -3.987
263 2HD LYS 46 2HD LYS 46 -2.114 -11.922 -2.327
264 1HE LYS 46 1HE LYS 46 -4.204 -11.461 -2.919
265 2HE LYS 46 2HE LYS 46 -3.707 -9.889 -3.542
266 1HZ LYS 46 1HZ LYS 46 -3.576 -12.435 -5.065
267 2HZ LYS 46 2HZ LYS 46 -3.200 -10.896 -5.655
268 3HZ LYS 46 3HZ LYS 46 -4.793 -11.270 -5.227
269 H ILE 47 H ILE 47 0.819 -10.425 1.008
270 HA ILE 47 HA ILE 47 -1.381 -9.987 2.764
271 HB ILE 47 HB ILE 47 1.211 -11.410 2.868
272 1HG1 ILE 47 1HG1 ILE 47 -0.510 -12.967 4.198
273 2HG1 ILE 47 2HG1 ILE 47 -1.673 -11.958 3.343
274 1HG2 ILE 47 1HG2 ILE 47 1.536 -10.175 4.871
275 2HG2 ILE 47 2HG2 ILE 47 0.986 -11.784 5.343
276 3HG2 ILE 47 3HG2 ILE 47 -0.138 -10.425 5.372
277 1HD1 ILE 47 1HD1 ILE 47 -1.459 -13.479 1.725
278 2HD1 ILE 47 2HD1 ILE 47 0.083 -14.069 2.345
279 3HD1 ILE 47 3HD1 ILE 47 0.032 -12.619 1.341
280 H TRP 48 H TRP 48 1.887 -8.766 2.520
281 HA TRP 48 HA TRP 48 2.055 -7.257 4.852
282 1HB TRP 48 1HB TRP 48 3.953 -7.809 3.402
283 2HB TRP 48 2HB TRP 48 3.281 -6.820 2.118
284 HD1 TRP 48 HD1 TRP 48 5.698 -6.705 4.888
285 HE1 TRP 48 HE1 TRP 48 6.545 -4.303 5.217
286 HE3 TRP 48 HE3 TRP 48 2.246 -4.184 2.104
287 HZ2 TRP 48 HZ2 TRP 48 5.859 -1.703 4.439
288 HZ3 TRP 48 HZ3 TRP 48 2.407 -1.743 1.952
289 HH2 TRP 48 HH2 TRP 48 4.186 -0.533 3.083
290 H PHE 49 H PHE 49 1.067 -6.281 1.592
291 HA PHE 49 HA PHE 49 0.383 -3.636 2.381
292 1HB PHE 49 1HB PHE 49 0.094 -5.234 -0.110
293 2HB PHE 49 2HB PHE 49 -0.925 -3.802 0.076
294 HD1 PHE 49 HD1 PHE 49 2.504 -5.030 -0.177
295 HD2 PHE 49 HD2 PHE 49 0.016 -1.605 0.139
296 HE1 PHE 49 HE1 PHE 49 4.438 -3.598 -0.683
297 HE2 PHE 49 HE2 PHE 49 1.947 -0.152 -0.381
298 HZ PHE 49 HZ PHE 49 4.169 -1.164 -0.764
299 H GLN 50 H GLN 50 -1.487 -6.575 1.881
300 HA GLN 50 HA GLN 50 -3.997 -5.368 2.304
301 1HB GLN 50 1HB GLN 50 -3.011 -8.206 2.478
302 2HB GLN 50 2HB GLN 50 -4.666 -7.795 2.906
303 1HG GLN 50 1HG GLN 50 -4.196 -6.581 0.430
304 2HG GLN 50 2HG GLN 50 -3.494 -8.194 0.320
305 1HE2 GLN 50 1HE2 GLN 50 -4.951 -9.951 1.232
306 2HE2 GLN 50 2HE2 GLN 50 -6.620 -9.862 0.794
307 H ASN 51 H ASN 51 -1.530 -6.609 4.451
308 HA ASN 51 HA ASN 51 -3.137 -6.753 6.790
309 1HB ASN 51 1HB ASN 51 -0.252 -6.892 6.149
310 2HB ASN 51 2HB ASN 51 -0.645 -6.366 7.783
311 1HD2 ASN 51 1HD2 ASN 51 -2.318 -8.663 5.684
312 2HD2 ASN 51 2HD2 ASN 51 -2.146 -10.021 6.736
313 H LYS 52 H LYS 52 -1.156 -4.226 5.336
314 HA LYS 52 HA LYS 52 -1.255 -2.395 7.472
315 1HB LYS 52 1HB LYS 52 -0.219 -2.459 4.834
316 2HB LYS 52 2HB LYS 52 -1.214 -1.015 4.956
317 1HG LYS 52 1HG LYS 52 0.340 0.034 6.134
318 2HG LYS 52 2HG LYS 52 0.435 -1.291 7.294
319 1HD LYS 52 1HD LYS 52 1.766 -2.405 5.253
320 2HD LYS 52 2HD LYS 52 2.118 -0.705 4.930
321 1HE LYS 52 1HE LYS 52 2.484 -1.900 7.660
322 2HE LYS 52 2HE LYS 52 3.741 -2.012 6.429
323 1HZ LYS 52 1HZ LYS 52 4.253 -0.109 7.652
324 2HZ LYS 52 2HZ LYS 52 2.646 0.416 7.711
325 3HZ LYS 52 3HZ LYS 52 3.508 0.494 6.257
326 H ARG 53 H ARG 53 -3.406 -2.966 4.736
327 HA ARG 53 HA ARG 53 -5.382 -1.201 6.021
328 1HB ARG 53 1HB ARG 53 -5.194 -1.574 3.038
329 2HB ARG 53 2HB ARG 53 -6.109 -0.365 3.926
330 1HG ARG 53 1HG ARG 53 -4.424 1.039 3.636
331 2HG ARG 53 2HG ARG 53 -3.444 0.012 4.683
332 1HD ARG 53 1HD ARG 53 -2.107 -0.136 2.881
333 2HD ARG 53 2HD ARG 53 -3.276 -1.346 2.351
334 HE ARG 53 HE ARG 53 -3.944 1.337 1.561
335 1HH1 ARG 53 1HH1 ARG 53 -2.151 -1.536 0.715
336 2HH1 ARG 53 2HH1 ARG 53 -2.126 -1.173 -0.978
337 1HH2 ARG 53 1HH2 ARG 53 -3.911 1.816 -0.667
338 2HH2 ARG 53 2HH2 ARG 53 -3.124 0.729 -1.763
339 H ALA 54 H ALA 54 -6.683 -2.686 6.948
340 HA ALA 54 HA ALA 54 -8.416 -4.217 5.278
341 1HB ALA 54 1HB ALA 54 -6.695 -5.823 5.158
342 2HB ALA 54 2HB ALA 54 -7.826 -6.429 6.368
343 3HB ALA 54 3HB ALA 54 -6.320 -5.663 6.875
344 H LYS 55 H LYS 55 -7.115 -3.953 8.578
345 HA LYS 55 HA LYS 55 -9.813 -4.325 9.653
346 1HB LYS 55 1HB LYS 55 -7.062 -4.655 10.717
347 2HB LYS 55 2HB LYS 55 -8.290 -4.124 11.859
348 1HG LYS 55 1HG LYS 55 -9.640 -6.135 10.840
349 2HG LYS 55 2HG LYS 55 -8.026 -6.711 10.420
350 1HD LYS 55 1HD LYS 55 -8.946 -5.925 13.185
351 2HD LYS 55 2HD LYS 55 -8.778 -7.578 12.594
352 1HE LYS 55 1HE LYS 55 -6.350 -6.143 12.108
353 2HE LYS 55 2HE LYS 55 -6.816 -5.948 13.797
354 1HZ LYS 55 1HZ LYS 55 -7.220 -8.551 13.485
355 2HZ LYS 55 2HZ LYS 55 -5.742 -7.903 13.991
356 3HZ LYS 55 3HZ LYS 55 -5.967 -8.333 12.370
357 H ILE 56 H ILE 56 -8.948 -1.869 8.274
358 HA ILE 56 HA ILE 56 -9.666 0.008 10.400
359 HB ILE 56 HB ILE 56 -7.455 0.629 8.445
360 1HG1 ILE 56 1HG1 ILE 56 -7.165 -0.043 11.379
361 2HG1 ILE 56 2HG1 ILE 56 -6.847 -1.186 10.078
362 1HG2 ILE 56 1HG2 ILE 56 -8.923 2.126 10.500
363 2HG2 ILE 56 2HG2 ILE 56 -8.066 2.698 9.068
364 3HG2 ILE 56 3HG2 ILE 56 -7.171 2.324 10.540
365 1HD1 ILE 56 1HD1 ILE 56 -4.759 -0.454 10.090
366 2HD1 ILE 56 2HD1 ILE 56 -5.169 0.885 11.162
367 3HD1 ILE 56 3HD1 ILE 56 -5.360 1.063 9.418
368 H LYS 57 H LYS 57 -11.726 -0.179 9.280
369 HA LYS 57 HA LYS 57 -12.217 1.966 7.545
370 1HB LYS 57 1HB LYS 57 -12.969 0.544 5.550
371 2HB LYS 57 2HB LYS 57 -11.242 0.813 5.744
372 1HG LYS 57 1HG LYS 57 -10.813 -1.360 6.094
373 2HG LYS 57 2HG LYS 57 -12.267 -1.598 7.064
374 1HD LYS 57 1HD LYS 57 -13.442 -1.270 4.712
375 2HD LYS 57 2HD LYS 57 -11.876 -1.833 4.125
376 1HE LYS 57 1HE LYS 57 -12.795 -3.871 4.399
377 2HE LYS 57 2HE LYS 57 -12.335 -3.630 6.084
378 1HZ LYS 57 1HZ LYS 57 -14.496 -4.088 6.425
379 2HZ LYS 57 2HZ LYS 57 -14.969 -3.637 4.865
380 3HZ LYS 57 3HZ LYS 57 -14.720 -2.453 6.046
381 H LYS 58 H LYS 58 -13.794 2.202 9.195
382 HA LYS 58 HA LYS 58 -16.251 0.755 8.612
383 1HB LYS 58 1HB LYS 58 -14.960 0.823 11.339
384 2HB LYS 58 2HB LYS 58 -16.660 0.448 11.093
385 1HG LYS 58 1HG LYS 58 -15.484 -1.272 9.354
386 2HG LYS 58 2HG LYS 58 -14.280 -1.197 10.641
387 1HD LYS 58 1HD LYS 58 -16.081 -1.693 12.280
388 2HD LYS 58 2HD LYS 58 -17.200 -1.897 10.931
389 1HE LYS 58 1HE LYS 58 -16.562 -4.015 10.751
390 2HE LYS 58 2HE LYS 58 -14.930 -3.475 10.365
391 1HZ LYS 58 1HZ LYS 58 -15.485 -5.000 12.450
392 2HZ LYS 58 2HZ LYS 58 -15.665 -3.486 13.182
393 3HZ LYS 58 3HZ LYS 58 -14.200 -3.899 12.443
394 H SER 59 H SER 59 -15.861 3.262 7.826
395 HA SER 59 HA SER 59 -17.858 4.711 9.274
396 1HB SER 59 1HB SER 59 -16.147 6.746 9.417
397 2HB SER 59 2HB SER 59 -16.303 5.578 10.729
398 HG SER 59 HG SER 59 -14.435 5.259 8.630
Start of MODEL 7
1 1H ALA 16 1H ALA 16 -15.893 16.116 -14.315
2 2H ALA 16 2H ALA 16 -17.463 15.640 -14.820
3 3H ALA 16 3H ALA 16 -16.323 14.456 -14.326
4 HA ALA 16 HA ALA 16 -17.192 16.594 -12.531
5 1HB ALA 16 1HB ALA 16 -19.277 15.763 -12.809
6 2HB ALA 16 2HB ALA 16 -18.682 14.534 -11.692
7 3HB ALA 16 3HB ALA 16 -18.699 14.215 -13.426
8 H LYS 17 H LYS 17 -16.408 13.124 -12.830
9 HA LYS 17 HA LYS 17 -15.290 13.036 -10.186
10 1HB LYS 17 1HB LYS 17 -15.735 11.104 -12.398
11 2HB LYS 17 2HB LYS 17 -14.455 10.722 -11.255
12 1HG LYS 17 1HG LYS 17 -16.612 11.474 -9.670
13 2HG LYS 17 2HG LYS 17 -17.315 10.501 -10.963
14 1HD LYS 17 1HD LYS 17 -16.766 8.930 -9.328
15 2HD LYS 17 2HD LYS 17 -15.413 8.840 -10.459
16 1HE LYS 17 1HE LYS 17 -14.658 10.816 -8.675
17 2HE LYS 17 2HE LYS 17 -15.456 9.615 -7.658
18 1HZ LYS 17 1HZ LYS 17 -13.430 8.676 -7.689
19 2HZ LYS 17 2HZ LYS 17 -12.961 9.434 -9.126
20 3HZ LYS 17 3HZ LYS 17 -13.932 8.051 -9.180
21 H ARG 18 H ARG 18 -13.170 13.017 -9.580
22 HA ARG 18 HA ARG 18 -11.280 14.131 -11.453
23 1HB ARG 18 1HB ARG 18 -11.296 13.573 -8.517
24 2HB ARG 18 2HB ARG 18 -9.755 13.820 -9.325
25 1HG ARG 18 1HG ARG 18 -12.003 15.784 -9.601
26 2HG ARG 18 2HG ARG 18 -10.878 15.840 -8.243
27 1HD ARG 18 1HD ARG 18 -9.409 16.926 -9.503
28 2HD ARG 18 2HD ARG 18 -9.359 15.567 -10.625
29 HE ARG 18 HE ARG 18 -11.608 17.312 -11.022
30 1HH1 ARG 18 1HH1 ARG 18 -8.250 16.755 -11.793
31 2HH1 ARG 18 2HH1 ARG 18 -8.308 17.665 -13.264
32 1HH2 ARG 18 1HH2 ARG 18 -11.685 18.508 -12.958
33 2HH2 ARG 18 2HH2 ARG 18 -10.258 18.661 -13.926
34 H GLU 19 H GLU 19 -11.850 11.053 -9.875
35 HA GLU 19 HA GLU 19 -10.954 8.984 -10.169
36 1HB GLU 19 1HB GLU 19 -10.153 10.246 -12.790
37 2HB GLU 19 2HB GLU 19 -9.881 8.548 -12.420
38 1HG GLU 19 1HG GLU 19 -12.625 9.626 -12.087
39 2HG GLU 19 2HG GLU 19 -12.020 9.375 -13.724
40 H PHE 20 H PHE 20 -8.922 7.760 -10.253
41 HA PHE 20 HA PHE 20 -6.437 9.215 -10.182
42 1HB PHE 20 1HB PHE 20 -5.864 8.539 -7.862
43 2HB PHE 20 2HB PHE 20 -7.205 9.678 -7.927
44 HD1 PHE 20 HD1 PHE 20 -6.536 6.016 -7.800
45 HD2 PHE 20 HD2 PHE 20 -9.121 9.223 -6.730
46 HE1 PHE 20 HE1 PHE 20 -7.910 4.462 -6.478
47 HE2 PHE 20 HE2 PHE 20 -10.499 7.675 -5.405
48 HZ PHE 20 HZ PHE 20 -9.895 5.290 -5.278
49 H ASN 21 H ASN 21 -4.689 7.557 -9.206
50 HA ASN 21 HA ASN 21 -4.881 5.235 -10.921
51 1HB ASN 21 1HB ASN 21 -2.738 6.667 -9.476
52 2HB ASN 21 2HB ASN 21 -2.515 4.929 -9.632
53 1HD2 ASN 21 1HD2 ASN 21 -3.776 7.511 -11.717
54 2HD2 ASN 21 2HD2 ASN 21 -2.797 7.115 -13.084
55 H GLU 22 H GLU 22 -5.741 3.387 -10.263
56 HA GLU 22 HA GLU 22 -6.080 2.865 -7.429
57 1HB GLU 22 1HB GLU 22 -7.519 2.223 -9.770
58 2HB GLU 22 2HB GLU 22 -6.967 0.696 -9.094
59 1HG GLU 22 1HG GLU 22 -7.878 1.762 -6.860
60 2HG GLU 22 2HG GLU 22 -8.862 2.692 -7.988
61 H ASN 23 H ASN 23 -4.303 2.130 -6.450
62 HA ASN 23 HA ASN 23 -2.591 0.764 -5.857
63 1HB ASN 23 1HB ASN 23 -3.609 -1.254 -7.814
64 2HB ASN 23 2HB ASN 23 -2.770 -1.527 -6.293
65 1HD2 ASN 23 1HD2 ASN 23 -3.924 -1.000 -4.321
66 2HD2 ASN 23 2HD2 ASN 23 -5.643 -1.164 -4.277
67 H ARG 24 H ARG 24 -2.121 2.580 -7.853
68 HA ARG 24 HA ARG 24 0.068 1.280 -9.309
69 1HB ARG 24 1HB ARG 24 -1.693 3.429 -10.499
70 2HB ARG 24 2HB ARG 24 -0.395 2.558 -11.305
71 1HG ARG 24 1HG ARG 24 -1.648 0.652 -11.561
72 2HG ARG 24 2HG ARG 24 -2.694 1.029 -10.191
73 1HD ARG 24 1HD ARG 24 -3.476 3.023 -11.635
74 2HD ARG 24 2HD ARG 24 -2.759 2.130 -12.976
75 HE ARG 24 HE ARG 24 -4.396 0.344 -11.658
76 1HH1 ARG 24 1HH1 ARG 24 -4.780 3.397 -13.306
77 2HH1 ARG 24 2HH1 ARG 24 -6.403 3.062 -13.810
78 1HH2 ARG 24 1HH2 ARG 24 -6.529 -0.097 -12.320
79 2HH2 ARG 24 2HH2 ARG 24 -7.396 1.078 -13.251
80 H TYR 25 H TYR 25 -1.376 4.314 -8.262
81 HA TYR 25 HA TYR 25 0.692 6.077 -8.593
82 1HB TYR 25 1HB TYR 25 -0.337 7.413 -6.838
83 2HB TYR 25 2HB TYR 25 -1.586 6.681 -7.842
84 HD1 TYR 25 HD1 TYR 25 -2.320 4.232 -6.911
85 HD2 TYR 25 HD2 TYR 25 -0.736 7.411 -4.568
86 HE1 TYR 25 HE1 TYR 25 -3.347 3.254 -4.909
87 HE2 TYR 25 HE2 TYR 25 -1.771 6.445 -2.557
88 HH TYR 25 HH TYR 25 -4.120 4.029 -2.676
89 H LEU 26 H LEU 26 0.116 3.970 -5.782
90 HA LEU 26 HA LEU 26 2.907 4.457 -4.980
91 1HB LEU 26 1HB LEU 26 2.345 4.842 -2.819
92 2HB LEU 26 2HB LEU 26 0.869 5.409 -3.573
93 HG LEU 26 HG LEU 26 0.011 2.986 -3.160
94 1HD1 LEU 26 1HD1 LEU 26 1.646 2.901 -0.741
95 2HD1 LEU 26 2HD1 LEU 26 2.556 2.617 -2.224
96 3HD1 LEU 26 3HD1 LEU 26 1.167 1.603 -1.835
97 1HD2 LEU 26 1HD2 LEU 26 0.175 4.215 -0.538
98 2HD2 LEU 26 2HD2 LEU 26 -1.222 3.960 -1.583
99 3HD2 LEU 26 3HD2 LEU 26 -0.211 5.386 -1.800
100 H THR 27 H THR 27 0.202 2.185 -4.940
101 HA THR 27 HA THR 27 1.282 0.022 -3.704
102 HB THR 27 HB THR 27 -0.669 0.375 -5.901
103 HG1 THR 27 HG1 THR 27 -1.948 -0.775 -4.385
104 1HG2 THR 27 1HG2 THR 27 -1.030 -2.216 -5.658
105 2HG2 THR 27 2HG2 THR 27 0.715 -2.199 -5.409
106 3HG2 THR 27 3HG2 THR 27 0.029 -1.545 -6.897
107 H GLU 28 H GLU 28 1.262 0.112 -7.261
108 HA GLU 28 HA GLU 28 3.275 -1.811 -7.559
109 1HB GLU 28 1HB GLU 28 2.266 0.299 -9.463
110 2HB GLU 28 2HB GLU 28 3.389 -0.972 -9.927
111 1HG GLU 28 1HG GLU 28 1.077 -2.057 -8.584
112 2HG GLU 28 2HG GLU 28 0.615 -1.078 -9.975
113 H ARG 29 H ARG 29 3.480 1.710 -7.401
114 HA ARG 29 HA ARG 29 6.157 1.923 -8.277
115 1HB ARG 29 1HB ARG 29 4.129 3.686 -7.524
116 2HB ARG 29 2HB ARG 29 5.420 3.979 -6.368
117 1HG ARG 29 1HG ARG 29 6.889 3.991 -8.570
118 2HG ARG 29 2HG ARG 29 5.345 4.447 -9.293
119 1HD ARG 29 1HD ARG 29 6.699 6.398 -8.629
120 2HD ARG 29 2HD ARG 29 5.150 6.326 -7.788
121 HE ARG 29 HE ARG 29 7.271 5.097 -6.312
122 1HH1 ARG 29 1HH1 ARG 29 5.754 8.146 -7.076
123 2HH1 ARG 29 2HH1 ARG 29 6.286 8.918 -5.619
124 1HH2 ARG 29 1HH2 ARG 29 7.972 6.111 -4.397
125 2HH2 ARG 29 2HH2 ARG 29 7.545 7.763 -4.099
126 H ARG 30 H ARG 30 4.768 1.828 -5.009
127 HA ARG 30 HA ARG 30 7.367 1.807 -3.770
128 1HB ARG 30 1HB ARG 30 4.733 2.361 -2.935
129 2HB ARG 30 2HB ARG 30 5.264 0.981 -1.985
130 1HG ARG 30 1HG ARG 30 7.232 2.227 -1.262
131 2HG ARG 30 2HG ARG 30 6.722 3.605 -2.238
132 1HD ARG 30 1HD ARG 30 4.502 2.977 -0.681
133 2HD ARG 30 2HD ARG 30 5.876 2.801 0.409
134 HE ARG 30 HE ARG 30 6.359 5.171 -0.782
135 1HH1 ARG 30 1HH1 ARG 30 3.550 3.862 0.825
136 2HH1 ARG 30 2HH1 ARG 30 2.990 5.407 1.372
137 1HH2 ARG 30 1HH2 ARG 30 5.623 7.202 -0.062
138 2HH2 ARG 30 2HH2 ARG 30 4.166 7.302 0.870
139 H ARG 31 H ARG 31 5.131 -0.556 -4.920
140 HA ARG 31 HA ARG 31 5.752 -2.746 -3.313
141 1HB ARG 31 1HB ARG 31 4.543 -2.309 -5.952
142 2HB ARG 31 2HB ARG 31 5.337 -3.869 -5.788
143 1HG ARG 31 1HG ARG 31 3.919 -3.741 -3.472
144 2HG ARG 31 2HG ARG 31 2.859 -2.878 -4.589
145 1HD ARG 31 1HD ARG 31 4.074 -5.486 -5.398
146 2HD ARG 31 2HD ARG 31 2.666 -5.469 -4.339
147 HE ARG 31 HE ARG 31 2.755 -4.766 -7.145
148 1HH1 ARG 31 1HH1 ARG 31 0.950 -4.595 -4.160
149 2HH1 ARG 31 2HH1 ARG 31 -0.567 -4.331 -4.949
150 1HH2 ARG 31 1HH2 ARG 31 0.760 -4.415 -8.181
151 2HH2 ARG 31 2HH2 ARG 31 -0.676 -4.228 -7.230
152 H GLN 32 H GLN 32 7.358 -1.488 -6.187
153 HA GLN 32 HA GLN 32 9.222 -3.619 -6.428
154 1HB GLN 32 1HB GLN 32 8.612 -1.177 -7.809
155 2HB GLN 32 2HB GLN 32 10.348 -1.280 -7.549
156 1HG GLN 32 1HG GLN 32 9.025 -3.721 -8.548
157 2HG GLN 32 2HG GLN 32 9.100 -2.351 -9.656
158 1HE2 GLN 32 1HE2 GLN 32 11.022 -1.781 -10.551
159 2HE2 GLN 32 2HE2 GLN 32 12.488 -2.669 -10.331
160 H GLN 33 H GLN 33 9.314 -0.465 -4.839
161 HA GLN 33 HA GLN 33 12.063 -0.687 -4.077
162 1HB GLN 33 1HB GLN 33 9.850 1.165 -3.195
163 2HB GLN 33 2HB GLN 33 11.501 1.284 -2.603
164 1HG GLN 33 1HG GLN 33 12.037 1.337 -5.192
165 2HG GLN 33 2HG GLN 33 10.384 1.946 -5.266
166 1HE2 GLN 33 1HE2 GLN 33 11.741 3.789 -6.145
167 2HE2 GLN 33 2HE2 GLN 33 12.249 4.981 -5.002
168 H LEU 34 H LEU 34 8.968 -1.297 -2.488
169 HA LEU 34 HA LEU 34 9.993 -1.718 0.101
170 1HB LEU 34 1HB LEU 34 7.468 -2.350 -1.319
171 2HB LEU 34 2HB LEU 34 7.800 -3.246 0.153
172 HG LEU 34 HG LEU 34 8.265 -0.432 0.576
173 1HD1 LEU 34 1HD1 LEU 34 5.930 -1.123 -1.022
174 2HD1 LEU 34 2HD1 LEU 34 6.658 0.448 -0.692
175 3HD1 LEU 34 3HD1 LEU 34 5.533 -0.262 0.465
176 1HD2 LEU 34 1HD2 LEU 34 7.937 -1.897 2.411
177 2HD2 LEU 34 2HD2 LEU 34 6.421 -2.503 1.745
178 3HD2 LEU 34 3HD2 LEU 34 6.521 -0.847 2.345
179 H SER 35 H SER 35 9.483 -3.904 -2.622
180 HA SER 35 HA SER 35 10.000 -6.312 -1.285
181 1HB SER 35 1HB SER 35 10.399 -7.267 -3.490
182 2HB SER 35 2HB SER 35 9.031 -6.156 -3.569
183 HG SER 35 HG SER 35 10.100 -5.107 -5.025
184 H SER 36 H SER 36 12.188 -4.167 -3.091
185 HA SER 36 HA SER 36 14.518 -5.707 -2.610
186 1HB SER 36 1HB SER 36 14.261 -4.037 -4.454
187 2HB SER 36 2HB SER 36 14.365 -2.754 -3.249
188 HG SER 36 HG SER 36 16.446 -3.555 -2.707
189 H GLU 37 H GLU 37 13.151 -2.855 -1.003
190 HA GLU 37 HA GLU 37 15.281 -2.453 0.797
191 1HB GLU 37 1HB GLU 37 13.054 -1.052 0.157
192 2HB GLU 37 2HB GLU 37 12.572 -1.712 1.714
193 1HG GLU 37 1HG GLU 37 15.091 -0.142 1.220
194 2HG GLU 37 2HG GLU 37 13.593 0.527 1.865
195 H LEU 38 H LEU 38 12.215 -4.213 1.149
196 HA LEU 38 HA LEU 38 12.927 -5.080 3.817
197 1HB LEU 38 1HB LEU 38 10.556 -5.493 2.033
198 2HB LEU 38 2HB LEU 38 10.766 -6.474 3.472
199 HG LEU 38 HG LEU 38 10.970 -3.546 3.856
200 1HD1 LEU 38 1HD1 LEU 38 8.614 -3.162 3.800
201 2HD1 LEU 38 2HD1 LEU 38 8.293 -4.853 3.415
202 3HD1 LEU 38 3HD1 LEU 38 9.095 -3.817 2.236
203 1HD2 LEU 38 1HD2 LEU 38 10.219 -4.026 5.964
204 2HD2 LEU 38 2HD2 LEU 38 11.002 -5.553 5.558
205 3HD2 LEU 38 3HD2 LEU 38 9.250 -5.398 5.429
206 H GLY 39 H GLY 39 13.291 -6.239 0.601
207 1HA GLY 39 1HA GLY 39 14.399 -8.099 -0.183
208 2HA GLY 39 2HA GLY 39 14.815 -8.484 1.481
209 H LEU 40 H LEU 40 11.512 -8.050 0.430
210 HA LEU 40 HA LEU 40 11.075 -10.936 0.829
211 1HB LEU 40 1HB LEU 40 8.616 -10.025 1.177
212 2HB LEU 40 2HB LEU 40 9.778 -10.079 2.491
213 HG LEU 40 HG LEU 40 10.313 -7.652 1.933
214 1HD1 LEU 40 1HD1 LEU 40 7.648 -7.703 0.553
215 2HD1 LEU 40 2HD1 LEU 40 9.165 -7.843 -0.333
216 3HD1 LEU 40 3HD1 LEU 40 8.832 -6.397 0.619
217 1HD2 LEU 40 1HD2 LEU 40 9.157 -7.726 3.873
218 2HD2 LEU 40 2HD2 LEU 40 7.885 -8.748 3.204
219 3HD2 LEU 40 3HD2 LEU 40 7.884 -7.014 2.880
220 H ASN 41 H ASN 41 9.215 -11.843 -0.380
221 HA ASN 41 HA ASN 41 9.359 -10.977 -3.145
222 1HB ASN 41 1HB ASN 41 9.272 -13.449 -2.019
223 2HB ASN 41 2HB ASN 41 7.574 -13.223 -2.430
224 1HD2 ASN 41 1HD2 ASN 41 7.111 -12.585 -4.669
225 2HD2 ASN 41 2HD2 ASN 41 8.110 -13.222 -5.927
226 H GLU 42 H GLU 42 7.468 -10.646 -4.451
227 HA GLU 42 HA GLU 42 5.652 -8.807 -3.442
228 1HB GLU 42 1HB GLU 42 5.234 -10.676 -5.783
229 2HB GLU 42 2HB GLU 42 4.386 -9.160 -5.507
230 1HG GLU 42 1HG GLU 42 6.689 -8.061 -5.588
231 2HG GLU 42 2HG GLU 42 7.254 -9.588 -6.265
232 H ALA 43 H ALA 43 5.539 -12.292 -3.475
233 HA ALA 43 HA ALA 43 2.803 -12.708 -3.031
234 1HB ALA 43 1HB ALA 43 4.925 -14.353 -3.320
235 2HB ALA 43 2HB ALA 43 3.354 -14.881 -2.717
236 3HB ALA 43 3HB ALA 43 4.651 -14.498 -1.584
237 H GLN 44 H GLN 44 5.433 -11.885 -0.876
238 HA GLN 44 HA GLN 44 3.857 -12.052 1.533
239 1HB GLN 44 1HB GLN 44 6.584 -10.938 0.885
240 2HB GLN 44 2HB GLN 44 5.875 -10.813 2.489
241 1HG GLN 44 1HG GLN 44 6.268 -13.436 1.079
242 2HG GLN 44 2HG GLN 44 7.488 -12.712 2.127
243 1HE2 GLN 44 1HE2 GLN 44 6.122 -11.746 4.197
244 2HE2 GLN 44 2HE2 GLN 44 5.271 -12.999 5.029
245 H ILE 45 H ILE 45 4.681 -9.731 -0.878
246 HA ILE 45 HA ILE 45 4.084 -7.352 0.500
247 HB ILE 45 HB ILE 45 4.077 -8.008 -2.445
248 1HG1 ILE 45 1HG1 ILE 45 6.229 -8.090 -1.085
249 2HG1 ILE 45 2HG1 ILE 45 6.240 -7.040 -2.499
250 1HG2 ILE 45 1HG2 ILE 45 2.586 -6.103 -2.012
251 2HG2 ILE 45 2HG2 ILE 45 4.034 -5.632 -2.902
252 3HG2 ILE 45 3HG2 ILE 45 3.908 -5.285 -1.181
253 1HD1 ILE 45 1HD1 ILE 45 5.738 -5.127 -0.958
254 2HD1 ILE 45 2HD1 ILE 45 7.318 -5.881 -0.747
255 3HD1 ILE 45 3HD1 ILE 45 6.013 -6.236 0.386
256 H LYS 46 H LYS 46 2.079 -9.557 -1.430
257 HA LYS 46 HA LYS 46 -0.229 -7.987 -1.596
258 1HB LYS 46 1HB LYS 46 0.275 -10.246 -2.715
259 2HB LYS 46 2HB LYS 46 -0.283 -10.976 -1.217
260 1HG LYS 46 1HG LYS 46 -2.417 -9.625 -1.547
261 2HG LYS 46 2HG LYS 46 -1.841 -9.344 -3.191
262 1HD LYS 46 1HD LYS 46 -3.076 -11.232 -3.542
263 2HD LYS 46 2HD LYS 46 -1.525 -11.972 -3.140
264 1HE LYS 46 1HE LYS 46 -2.842 -13.160 -1.722
265 2HE LYS 46 2HE LYS 46 -2.519 -11.774 -0.681
266 1HZ LYS 46 1HZ LYS 46 -4.970 -12.438 -2.173
267 2HZ LYS 46 2HZ LYS 46 -4.642 -10.830 -1.764
268 3HZ LYS 46 3HZ LYS 46 -4.795 -11.996 -0.548
269 H ILE 47 H ILE 47 0.745 -10.370 0.826
270 HA ILE 47 HA ILE 47 -1.483 -9.974 2.560
271 HB ILE 47 HB ILE 47 1.108 -11.400 2.662
272 1HG1 ILE 47 1HG1 ILE 47 -0.551 -13.056 3.852
273 2HG1 ILE 47 2HG1 ILE 47 -1.781 -11.977 3.202
274 1HG2 ILE 47 1HG2 ILE 47 -0.274 -10.478 5.171
275 2HG2 ILE 47 2HG2 ILE 47 1.409 -10.229 4.701
276 3HG2 ILE 47 3HG2 ILE 47 0.838 -11.845 5.123
277 1HD1 ILE 47 1HD1 ILE 47 -0.700 -14.121 1.910
278 2HD1 ILE 47 2HD1 ILE 47 0.218 -12.774 1.238
279 3HD1 ILE 47 3HD1 ILE 47 -1.543 -12.779 1.138
280 H TRP 48 H TRP 48 1.765 -8.733 2.351
281 HA TRP 48 HA TRP 48 1.972 -7.312 4.729
282 1HB TRP 48 1HB TRP 48 3.827 -7.801 3.196
283 2HB TRP 48 2HB TRP 48 3.120 -6.747 1.987
284 HD1 TRP 48 HD1 TRP 48 5.603 -6.785 4.702
285 HE1 TRP 48 HE1 TRP 48 6.480 -4.409 5.116
286 HE3 TRP 48 HE3 TRP 48 2.111 -4.114 2.113
287 HZ2 TRP 48 HZ2 TRP 48 5.806 -1.769 4.464
288 HZ3 TRP 48 HZ3 TRP 48 2.298 -1.670 2.058
289 HH2 TRP 48 HH2 TRP 48 4.114 -0.525 3.200
290 H PHE 49 H PHE 49 0.905 -6.209 1.534
291 HA PHE 49 HA PHE 49 0.230 -3.602 2.451
292 1HB PHE 49 1HB PHE 49 -0.123 -5.093 -0.100
293 2HB PHE 49 2HB PHE 49 -1.127 -3.662 0.174
294 HD1 PHE 49 HD1 PHE 49 2.280 -4.905 -0.220
295 HD2 PHE 49 HD2 PHE 49 -0.166 -1.474 0.315
296 HE1 PHE 49 HE1 PHE 49 4.215 -3.467 -0.708
297 HE2 PHE 49 HE2 PHE 49 1.767 -0.018 -0.184
298 HZ PHE 49 HZ PHE 49 3.967 -1.030 -0.668
299 H GLN 50 H GLN 50 -1.640 -6.525 1.870
300 HA GLN 50 HA GLN 50 -4.141 -5.342 2.404
301 1HB GLN 50 1HB GLN 50 -3.166 -8.192 2.437
302 2HB GLN 50 2HB GLN 50 -4.820 -7.782 2.869
303 1HG GLN 50 1HG GLN 50 -4.443 -6.461 0.483
304 2HG GLN 50 2HG GLN 50 -3.566 -7.974 0.261
305 1HE2 GLN 50 1HE2 GLN 50 -4.719 -9.956 0.567
306 2HE2 GLN 50 2HE2 GLN 50 -6.425 -10.016 0.303
307 H ASN 51 H ASN 51 -1.630 -6.690 4.436
308 HA ASN 51 HA ASN 51 -3.272 -6.808 6.797
309 1HB ASN 51 1HB ASN 51 -0.376 -7.243 6.187
310 2HB ASN 51 2HB ASN 51 -0.865 -6.987 7.859
311 1HD2 ASN 51 1HD2 ASN 51 0.244 -9.285 7.502
312 2HD2 ASN 51 2HD2 ASN 51 -0.894 -10.582 7.407
313 H LYS 52 H LYS 52 -0.844 -4.603 5.480
314 HA LYS 52 HA LYS 52 -0.699 -2.880 7.706
315 1HB LYS 52 1HB LYS 52 0.733 -3.079 5.462
316 2HB LYS 52 2HB LYS 52 -0.332 -1.770 4.969
317 1HG LYS 52 1HG LYS 52 0.360 -0.692 7.222
318 2HG LYS 52 2HG LYS 52 1.712 -1.825 7.143
319 1HD LYS 52 1HD LYS 52 2.495 0.159 6.140
320 2HD LYS 52 2HD LYS 52 2.128 -0.931 4.801
321 1HE LYS 52 1HE LYS 52 1.331 1.366 4.400
322 2HE LYS 52 2HE LYS 52 0.020 0.187 4.419
323 1HZ LYS 52 1HZ LYS 52 -0.838 1.033 6.319
324 2HZ LYS 52 2HZ LYS 52 -0.100 2.447 5.755
325 3HZ LYS 52 3HZ LYS 52 0.663 1.511 6.940
326 H ARG 53 H ARG 53 -2.825 -2.972 4.903
327 HA ARG 53 HA ARG 53 -4.470 -0.892 6.178
328 1HB ARG 53 1HB ARG 53 -4.095 -1.207 3.196
329 2HB ARG 53 2HB ARG 53 -5.012 0.048 4.020
330 1HG ARG 53 1HG ARG 53 -2.849 0.764 5.094
331 2HG ARG 53 2HG ARG 53 -2.033 -0.335 3.980
332 1HD ARG 53 1HD ARG 53 -1.928 1.681 2.853
333 2HD ARG 53 2HD ARG 53 -3.358 0.931 2.149
334 HE ARG 53 HE ARG 53 -3.282 3.228 3.938
335 1HH1 ARG 53 1HH1 ARG 53 -5.222 0.879 2.224
336 2HH1 ARG 53 2HH1 ARG 53 -6.672 1.818 2.333
337 1HH2 ARG 53 1HH2 ARG 53 -5.191 4.456 4.080
338 2HH2 ARG 53 2HH2 ARG 53 -6.655 3.846 3.385
339 H ALA 54 H ALA 54 -6.094 -2.090 6.985
340 HA ALA 54 HA ALA 54 -7.768 -3.533 5.077
341 1HB ALA 54 1HB ALA 54 -6.197 -4.791 7.193
342 2HB ALA 54 2HB ALA 54 -6.968 -5.502 5.775
343 3HB ALA 54 3HB ALA 54 -7.909 -5.211 7.237
344 H LYS 55 H LYS 55 -7.445 -2.738 8.541
345 HA LYS 55 HA LYS 55 -9.963 -1.325 8.490
346 1HB LYS 55 1HB LYS 55 -10.084 -4.013 9.068
347 2HB LYS 55 2HB LYS 55 -9.981 -3.287 10.666
348 1HG LYS 55 1HG LYS 55 -12.268 -3.468 10.219
349 2HG LYS 55 2HG LYS 55 -11.883 -1.772 9.931
350 1HD LYS 55 1HD LYS 55 -11.553 -3.408 7.549
351 2HD LYS 55 2HD LYS 55 -13.196 -3.472 8.191
352 1HE LYS 55 1HE LYS 55 -13.225 -0.992 8.225
353 2HE LYS 55 2HE LYS 55 -11.637 -0.997 7.460
354 1HZ LYS 55 1HZ LYS 55 -13.692 -2.562 6.131
355 2HZ LYS 55 2HZ LYS 55 -12.498 -1.560 5.474
356 3HZ LYS 55 3HZ LYS 55 -13.915 -0.885 6.103
357 H ILE 56 H ILE 56 -7.642 -2.829 10.743
358 HA ILE 56 HA ILE 56 -6.511 -2.007 12.539
359 HB ILE 56 HB ILE 56 -6.887 0.700 11.259
360 1HG1 ILE 56 1HG1 ILE 56 -4.352 -0.735 10.833
361 2HG1 ILE 56 2HG1 ILE 56 -5.740 -1.461 10.028
362 1HG2 ILE 56 1HG2 ILE 56 -5.103 -0.391 13.388
363 2HG2 ILE 56 2HG2 ILE 56 -6.002 1.127 13.341
364 3HG2 ILE 56 3HG2 ILE 56 -4.539 0.937 12.373
365 1HD1 ILE 56 1HD1 ILE 56 -5.171 1.462 9.765
366 2HD1 ILE 56 2HD1 ILE 56 -6.098 0.405 8.700
367 3HD1 ILE 56 3HD1 ILE 56 -4.340 0.274 8.761
368 H LYS 57 H LYS 57 -7.836 -2.353 14.253
369 HA LYS 57 HA LYS 57 -10.083 -0.614 14.784
370 1HB LYS 57 1HB LYS 57 -9.218 -3.228 15.615
371 2HB LYS 57 2HB LYS 57 -9.571 -2.249 17.033
372 1HG LYS 57 1HG LYS 57 -11.771 -2.323 16.677
373 2HG LYS 57 2HG LYS 57 -11.594 -2.025 14.947
374 1HD LYS 57 1HD LYS 57 -12.386 -4.153 14.843
375 2HD LYS 57 2HD LYS 57 -10.670 -4.522 15.018
376 1HE LYS 57 1HE LYS 57 -11.116 -4.551 17.534
377 2HE LYS 57 2HE LYS 57 -12.826 -4.601 17.108
378 1HZ LYS 57 1HZ LYS 57 -12.411 -6.627 15.852
379 2HZ LYS 57 2HZ LYS 57 -11.949 -6.817 17.467
380 3HZ LYS 57 3HZ LYS 57 -10.773 -6.580 16.275
381 H LYS 58 H LYS 58 -10.345 0.334 17.000
382 HA LYS 58 HA LYS 58 -7.870 1.721 17.728
383 1HB LYS 58 1HB LYS 58 -10.753 2.387 17.818
384 2HB LYS 58 2HB LYS 58 -9.779 3.009 19.144
385 1HG LYS 58 1HG LYS 58 -9.899 4.671 17.432
386 2HG LYS 58 2HG LYS 58 -8.254 4.033 17.481
387 1HD LYS 58 1HD LYS 58 -8.403 3.148 15.414
388 2HD LYS 58 2HD LYS 58 -10.075 2.633 15.646
389 1HE LYS 58 1HE LYS 58 -9.807 4.367 13.892
390 2HE LYS 58 2HE LYS 58 -10.881 4.850 15.204
391 1HZ LYS 58 1HZ LYS 58 -9.216 6.233 16.115
392 2HZ LYS 58 2HZ LYS 58 -9.247 6.572 14.459
393 3HZ LYS 58 3HZ LYS 58 -8.016 5.606 15.101
394 H SER 59 H SER 59 -8.398 -1.015 18.570
395 HA SER 59 HA SER 59 -9.032 -0.827 21.398
396 1HB SER 59 1HB SER 59 -9.727 -2.760 19.868
397 2HB SER 59 2HB SER 59 -8.045 -3.284 19.950
398 HG SER 59 HG SER 59 -9.897 -3.887 21.637
Start of MODEL 8
1 1H ALA 16 1H ALA 16 -20.117 14.585 -7.074
2 2H ALA 16 2H ALA 16 -19.383 13.075 -6.717
3 3H ALA 16 3H ALA 16 -19.211 13.767 -8.278
4 HA ALA 16 HA ALA 16 -17.818 15.400 -7.558
5 1HB ALA 16 1HB ALA 16 -19.157 16.080 -5.628
6 2HB ALA 16 2HB ALA 16 -17.450 15.932 -5.209
7 3HB ALA 16 3HB ALA 16 -18.587 14.670 -4.736
8 H LYS 17 H LYS 17 -17.707 12.456 -8.014
9 HA LYS 17 HA LYS 17 -15.260 11.829 -6.504
10 1HB LYS 17 1HB LYS 17 -15.704 9.464 -7.213
11 2HB LYS 17 2HB LYS 17 -16.923 10.149 -6.145
12 1HG LYS 17 1HG LYS 17 -18.415 10.508 -8.001
13 2HG LYS 17 2HG LYS 17 -17.178 9.970 -9.140
14 1HD LYS 17 1HD LYS 17 -17.277 7.845 -7.470
15 2HD LYS 17 2HD LYS 17 -18.948 8.404 -7.379
16 1HE LYS 17 1HE LYS 17 -17.437 7.779 -9.914
17 2HE LYS 17 2HE LYS 17 -18.634 6.735 -9.149
18 1HZ LYS 17 1HZ LYS 17 -19.362 9.490 -9.880
19 2HZ LYS 17 2HZ LYS 17 -20.350 8.125 -9.734
20 3HZ LYS 17 3HZ LYS 17 -19.333 8.291 -11.074
21 H ARG 18 H ARG 18 -13.498 10.830 -7.629
22 HA ARG 18 HA ARG 18 -13.494 11.161 -10.541
23 1HB ARG 18 1HB ARG 18 -11.225 12.149 -8.814
24 2HB ARG 18 2HB ARG 18 -11.426 12.365 -10.547
25 1HG ARG 18 1HG ARG 18 -13.424 13.490 -8.625
26 2HG ARG 18 2HG ARG 18 -11.922 14.343 -8.982
27 1HD ARG 18 1HD ARG 18 -13.849 13.406 -11.098
28 2HD ARG 18 2HD ARG 18 -13.902 15.015 -10.378
29 HE ARG 18 HE ARG 18 -11.327 14.733 -11.248
30 1HH1 ARG 18 1HH1 ARG 18 -14.473 14.510 -12.743
31 2HH1 ARG 18 2HH1 ARG 18 -13.912 15.039 -14.294
32 1HH2 ARG 18 1HH2 ARG 18 -10.586 15.427 -13.287
33 2HH2 ARG 18 2HH2 ARG 18 -11.704 15.559 -14.603
34 H GLU 19 H GLU 19 -12.545 9.515 -11.579
35 HA GLU 19 HA GLU 19 -11.599 7.265 -10.104
36 1HB GLU 19 1HB GLU 19 -12.006 7.924 -12.978
37 2HB GLU 19 2HB GLU 19 -10.922 6.594 -12.592
38 1HG GLU 19 1HG GLU 19 -12.595 5.275 -11.794
39 2HG GLU 19 2HG GLU 19 -13.578 6.643 -11.275
40 H PHE 20 H PHE 20 -9.634 7.007 -9.297
41 HA PHE 20 HA PHE 20 -7.399 8.475 -10.522
42 1HB PHE 20 1HB PHE 20 -6.265 8.257 -8.359
43 2HB PHE 20 2HB PHE 20 -7.833 9.034 -8.172
44 HD1 PHE 20 HD1 PHE 20 -6.210 5.690 -7.957
45 HD2 PHE 20 HD2 PHE 20 -9.297 8.267 -6.563
46 HE1 PHE 20 HE1 PHE 20 -6.828 4.025 -6.254
47 HE2 PHE 20 HE2 PHE 20 -9.918 6.607 -4.858
48 HZ PHE 20 HZ PHE 20 -8.683 4.482 -4.701
49 H ASN 21 H ASN 21 -5.235 7.184 -9.670
50 HA ASN 21 HA ASN 21 -5.086 4.925 -11.358
51 1HB ASN 21 1HB ASN 21 -3.156 5.780 -9.199
52 2HB ASN 21 2HB ASN 21 -2.813 4.672 -10.522
53 1HD2 ASN 21 1HD2 ASN 21 -2.933 5.528 -12.699
54 2HD2 ASN 21 2HD2 ASN 21 -2.531 7.186 -12.976
55 H GLU 22 H GLU 22 -6.407 3.261 -10.828
56 HA GLU 22 HA GLU 22 -6.860 2.311 -8.211
57 1HB GLU 22 1HB GLU 22 -7.742 1.670 -10.831
58 2HB GLU 22 2HB GLU 22 -7.124 0.184 -10.123
59 1HG GLU 22 1HG GLU 22 -8.658 0.265 -8.348
60 2HG GLU 22 2HG GLU 22 -9.075 1.945 -8.681
61 H ASN 23 H ASN 23 -4.793 2.198 -7.263
62 HA ASN 23 HA ASN 23 -2.932 1.124 -6.524
63 1HB ASN 23 1HB ASN 23 -3.645 -1.252 -8.223
64 2HB ASN 23 2HB ASN 23 -2.770 -1.213 -6.697
65 1HD2 ASN 23 1HD2 ASN 23 -4.262 0.097 -4.996
66 2HD2 ASN 23 2HD2 ASN 23 -5.828 -0.609 -4.814
67 H ARG 24 H ARG 24 -1.553 2.491 -7.566
68 HA ARG 24 HA ARG 24 0.197 1.368 -9.482
69 1HB ARG 24 1HB ARG 24 -0.916 1.886 -11.367
70 2HB ARG 24 2HB ARG 24 -2.099 2.842 -10.486
71 1HG ARG 24 1HG ARG 24 -1.039 4.209 -12.141
72 2HG ARG 24 2HG ARG 24 -0.541 4.756 -10.541
73 1HD ARG 24 1HD ARG 24 1.616 4.209 -10.892
74 2HD ARG 24 2HD ARG 24 1.202 2.723 -11.747
75 HE ARG 24 HE ARG 24 0.535 4.721 -13.484
76 1HH1 ARG 24 1HH1 ARG 24 3.443 3.810 -11.785
77 2HH1 ARG 24 2HH1 ARG 24 4.501 4.426 -13.010
78 1HH2 ARG 24 1HH2 ARG 24 1.924 5.531 -15.096
79 2HH2 ARG 24 2HH2 ARG 24 3.638 5.405 -14.890
80 H TYR 25 H TYR 25 -1.069 4.562 -8.585
81 HA TYR 25 HA TYR 25 1.127 6.131 -8.710
82 1HB TYR 25 1HB TYR 25 0.138 7.506 -6.944
83 2HB TYR 25 2HB TYR 25 -1.113 6.913 -8.034
84 HD1 TYR 25 HD1 TYR 25 -2.090 4.513 -7.240
85 HD2 TYR 25 HD2 TYR 25 -0.371 7.456 -4.696
86 HE1 TYR 25 HE1 TYR 25 -3.289 3.551 -5.340
87 HE2 TYR 25 HE2 TYR 25 -1.578 6.502 -2.776
88 HH TYR 25 HH TYR 25 -3.227 3.477 -2.957
89 H LEU 26 H LEU 26 0.276 4.062 -5.950
90 HA LEU 26 HA LEU 26 3.061 4.293 -5.035
91 1HB LEU 26 1HB LEU 26 2.447 4.706 -2.910
92 2HB LEU 26 2HB LEU 26 0.989 5.303 -3.669
93 HG LEU 26 HG LEU 26 0.296 4.014 -1.819
94 1HD1 LEU 26 1HD1 LEU 26 -0.170 1.804 -3.640
95 2HD1 LEU 26 2HD1 LEU 26 -0.498 3.374 -4.372
96 3HD1 LEU 26 3HD1 LEU 26 -1.312 2.910 -2.879
97 1HD2 LEU 26 1HD2 LEU 26 2.657 2.658 -2.096
98 2HD2 LEU 26 2HD2 LEU 26 1.462 1.441 -2.544
99 3HD2 LEU 26 3HD2 LEU 26 1.358 2.242 -0.976
100 H THR 27 H THR 27 0.486 2.227 -5.928
101 HA THR 27 HA THR 27 1.064 -0.104 -4.552
102 HB THR 27 HB THR 27 -0.057 0.372 -7.308
103 HG1 THR 27 HG1 THR 27 -1.186 -0.399 -4.826
104 1HG2 THR 27 1HG2 THR 27 0.327 -2.245 -5.901
105 2HG2 THR 27 2HG2 THR 27 0.726 -1.812 -7.564
106 3HG2 THR 27 3HG2 THR 27 -0.960 -1.988 -7.078
107 H GLU 28 H GLU 28 1.808 0.025 -8.004
108 HA GLU 28 HA GLU 28 3.910 -1.823 -7.845
109 1HB GLU 28 1HB GLU 28 3.437 0.235 -10.004
110 2HB GLU 28 2HB GLU 28 4.368 -1.248 -10.161
111 1HG GLU 28 1HG GLU 28 2.386 -2.582 -9.884
112 2HG GLU 28 2HG GLU 28 1.422 -1.142 -9.556
113 H ARG 29 H ARG 29 3.891 1.681 -7.680
114 HA ARG 29 HA ARG 29 6.635 2.124 -8.092
115 1HB ARG 29 1HB ARG 29 4.578 3.773 -7.906
116 2HB ARG 29 2HB ARG 29 5.087 3.867 -6.226
117 1HG ARG 29 1HG ARG 29 6.219 5.630 -7.172
118 2HG ARG 29 2HG ARG 29 7.431 4.347 -7.229
119 1HD ARG 29 1HD ARG 29 5.941 4.113 -9.595
120 2HD ARG 29 2HD ARG 29 6.244 5.837 -9.383
121 HE ARG 29 HE ARG 29 8.136 3.864 -10.133
122 1HH1 ARG 29 1HH1 ARG 29 7.804 6.797 -8.270
123 2HH1 ARG 29 2HH1 ARG 29 9.468 7.246 -8.449
124 1HH2 ARG 29 1HH2 ARG 29 10.323 4.453 -10.369
125 2HH2 ARG 29 2HH2 ARG 29 10.897 5.917 -9.641
126 H ARG 30 H ARG 30 4.784 1.728 -5.085
127 HA ARG 30 HA ARG 30 7.169 1.817 -3.470
128 1HB ARG 30 1HB ARG 30 4.647 2.452 -2.901
129 2HB ARG 30 2HB ARG 30 4.608 0.777 -2.365
130 1HG ARG 30 1HG ARG 30 6.493 1.217 -0.868
131 2HG ARG 30 2HG ARG 30 6.521 2.897 -1.406
132 1HD ARG 30 1HD ARG 30 3.952 1.817 -0.385
133 2HD ARG 30 2HD ARG 30 5.233 2.124 0.788
134 HE ARG 30 HE ARG 30 3.642 4.068 -0.561
135 1HH1 ARG 30 1HH1 ARG 30 6.811 3.500 0.784
136 2HH1 ARG 30 2HH1 ARG 30 7.122 5.176 1.085
137 1HH2 ARG 30 1HH2 ARG 30 4.048 6.274 -0.166
138 2HH2 ARG 30 2HH2 ARG 30 5.554 6.751 0.546
139 H ARG 31 H ARG 31 5.312 -0.630 -5.052
140 HA ARG 31 HA ARG 31 5.968 -2.849 -3.458
141 1HB ARG 31 1HB ARG 31 4.693 -2.366 -5.984
142 2HB ARG 31 2HB ARG 31 5.819 -3.705 -6.155
143 1HG ARG 31 1HG ARG 31 4.674 -5.038 -4.677
144 2HG ARG 31 2HG ARG 31 3.940 -3.667 -3.842
145 1HD ARG 31 1HD ARG 31 2.162 -4.549 -5.038
146 2HD ARG 31 2HD ARG 31 2.730 -3.252 -6.087
147 HE ARG 31 HE ARG 31 3.354 -4.818 -7.640
148 1HH1 ARG 31 1HH1 ARG 31 2.718 -6.415 -4.602
149 2HH1 ARG 31 2HH1 ARG 31 2.811 -8.007 -5.278
150 1HH2 ARG 31 1HH2 ARG 31 3.477 -6.912 -8.529
151 2HH2 ARG 31 2HH2 ARG 31 3.242 -8.289 -7.506
152 H GLN 32 H GLN 32 7.612 -1.406 -6.245
153 HA GLN 32 HA GLN 32 9.638 -3.344 -6.484
154 1HB GLN 32 1HB GLN 32 9.250 -0.547 -7.427
155 2HB GLN 32 2HB GLN 32 10.878 -1.209 -7.486
156 1HG GLN 32 1HG GLN 32 9.703 -3.216 -8.671
157 2HG GLN 32 2HG GLN 32 8.444 -2.024 -8.992
158 1HE2 GLN 32 1HE2 GLN 32 11.695 -3.013 -9.652
159 2HE2 GLN 32 2HE2 GLN 32 11.978 -1.932 -10.970
160 H GLN 33 H GLN 33 9.502 -0.296 -4.682
161 HA GLN 33 HA GLN 33 12.180 -0.528 -3.702
162 1HB GLN 33 1HB GLN 33 10.052 1.416 -3.614
163 2HB GLN 33 2HB GLN 33 10.743 1.204 -2.012
164 1HG GLN 33 1HG GLN 33 13.007 1.414 -3.362
165 2HG GLN 33 2HG GLN 33 11.966 2.291 -4.483
166 1HE2 GLN 33 1HE2 GLN 33 10.231 3.503 -2.722
167 2HE2 GLN 33 2HE2 GLN 33 11.094 4.659 -1.771
168 H LEU 34 H LEU 34 8.965 -1.175 -2.365
169 HA LEU 34 HA LEU 34 9.819 -1.810 0.242
170 1HB LEU 34 1HB LEU 34 7.369 -2.425 -1.361
171 2HB LEU 34 2HB LEU 34 7.602 -3.186 0.202
172 HG LEU 34 HG LEU 34 7.733 -0.201 -0.113
173 1HD1 LEU 34 1HD1 LEU 34 5.406 -0.035 0.408
174 2HD1 LEU 34 2HD1 LEU 34 5.264 -1.787 0.558
175 3HD1 LEU 34 3HD1 LEU 34 5.580 -1.059 -1.017
176 1HD2 LEU 34 1HD2 LEU 34 7.148 -0.242 2.257
177 2HD2 LEU 34 2HD2 LEU 34 8.623 -1.158 1.946
178 3HD2 LEU 34 3HD2 LEU 34 7.101 -2.005 2.219
179 H SER 35 H SER 35 9.477 -3.742 -2.679
180 HA SER 35 HA SER 35 9.894 -6.260 -1.445
181 1HB SER 35 1HB SER 35 10.186 -7.122 -3.683
182 2HB SER 35 2HB SER 35 8.892 -5.925 -3.719
183 HG SER 35 HG SER 35 10.313 -5.582 -5.439
184 H SER 36 H SER 36 12.080 -4.119 -3.272
185 HA SER 36 HA SER 36 14.392 -5.700 -2.825
186 1HB SER 36 1HB SER 36 15.596 -3.984 -3.897
187 2HB SER 36 2HB SER 36 13.994 -3.899 -4.628
188 HG SER 36 HG SER 36 13.518 -2.159 -3.281
189 H GLU 37 H GLU 37 13.046 -2.868 -1.192
190 HA GLU 37 HA GLU 37 15.204 -2.439 0.571
191 1HB GLU 37 1HB GLU 37 13.382 -0.800 0.049
192 2HB GLU 37 2HB GLU 37 12.303 -1.757 1.055
193 1HG GLU 37 1HG GLU 37 13.102 -0.879 2.934
194 2HG GLU 37 2HG GLU 37 14.775 -1.065 2.413
195 H LEU 38 H LEU 38 12.161 -4.229 0.975
196 HA LEU 38 HA LEU 38 12.937 -5.104 3.624
197 1HB LEU 38 1HB LEU 38 10.554 -5.777 1.903
198 2HB LEU 38 2HB LEU 38 10.794 -6.383 3.530
199 HG LEU 38 HG LEU 38 10.822 -3.432 3.097
200 1HD1 LEU 38 1HD1 LEU 38 8.195 -4.630 3.676
201 2HD1 LEU 38 2HD1 LEU 38 8.767 -4.795 2.017
202 3HD1 LEU 38 3HD1 LEU 38 8.611 -3.195 2.739
203 1HD2 LEU 38 1HD2 LEU 38 9.434 -3.867 5.339
204 2HD2 LEU 38 2HD2 LEU 38 11.196 -3.796 5.303
205 3HD2 LEU 38 3HD2 LEU 38 10.377 -5.357 5.299
206 H GLY 39 H GLY 39 13.234 -6.240 0.392
207 1HA GLY 39 1HA GLY 39 14.350 -8.079 -0.426
208 2HA GLY 39 2HA GLY 39 14.798 -8.477 1.225
209 H LEU 40 H LEU 40 11.448 -8.068 0.400
210 HA LEU 40 HA LEU 40 11.078 -10.969 0.734
211 1HB LEU 40 1HB LEU 40 8.598 -10.082 1.080
212 2HB LEU 40 2HB LEU 40 9.758 -10.160 2.394
213 HG LEU 40 HG LEU 40 10.277 -7.737 1.958
214 1HD1 LEU 40 1HD1 LEU 40 7.733 -7.759 0.359
215 2HD1 LEU 40 2HD1 LEU 40 9.329 -7.821 -0.386
216 3HD1 LEU 40 3HD1 LEU 40 8.867 -6.429 0.592
217 1HD2 LEU 40 1HD2 LEU 40 7.771 -7.119 2.730
218 2HD2 LEU 40 2HD2 LEU 40 8.978 -7.831 3.801
219 3HD2 LEU 40 3HD2 LEU 40 7.770 -8.858 3.027
220 H ASN 41 H ASN 41 9.216 -11.911 -0.440
221 HA ASN 41 HA ASN 41 9.307 -11.065 -3.214
222 1HB ASN 41 1HB ASN 41 9.295 -13.528 -2.089
223 2HB ASN 41 2HB ASN 41 7.577 -13.337 -2.429
224 1HD2 ASN 41 1HD2 ASN 41 7.016 -12.705 -4.649
225 2HD2 ASN 41 2HD2 ASN 41 7.968 -13.334 -5.944
226 H GLU 42 H GLU 42 7.378 -10.775 -4.486
227 HA GLU 42 HA GLU 42 5.564 -8.947 -3.468
228 1HB GLU 42 1HB GLU 42 5.138 -10.884 -5.755
229 2HB GLU 42 2HB GLU 42 4.220 -9.408 -5.481
230 1HG GLU 42 1HG GLU 42 5.961 -8.044 -6.122
231 2HG GLU 42 2HG GLU 42 7.185 -9.265 -5.775
232 H ALA 43 H ALA 43 5.505 -12.431 -3.403
233 HA ALA 43 HA ALA 43 2.792 -12.879 -2.860
234 1HB ALA 43 1HB ALA 43 4.752 -14.555 -3.288
235 2HB ALA 43 2HB ALA 43 3.385 -15.037 -2.284
236 3HB ALA 43 3HB ALA 43 4.897 -14.533 -1.531
237 H GLN 44 H GLN 44 5.468 -11.920 -0.826
238 HA GLN 44 HA GLN 44 3.980 -12.045 1.644
239 1HB GLN 44 1HB GLN 44 6.692 -11.101 0.802
240 2HB GLN 44 2HB GLN 44 6.049 -10.570 2.349
241 1HG GLN 44 1HG GLN 44 5.828 -13.448 1.907
242 2HG GLN 44 2HG GLN 44 7.485 -12.848 1.927
243 1HE2 GLN 44 1HE2 GLN 44 4.739 -11.560 3.712
244 2HE2 GLN 44 2HE2 GLN 44 5.361 -11.912 5.284
245 H ILE 45 H ILE 45 4.695 -9.798 -0.866
246 HA ILE 45 HA ILE 45 4.090 -7.382 0.441
247 HB ILE 45 HB ILE 45 4.028 -8.144 -2.477
248 1HG1 ILE 45 1HG1 ILE 45 6.215 -8.146 -1.215
249 2HG1 ILE 45 2HG1 ILE 45 6.157 -7.066 -2.605
250 1HG2 ILE 45 1HG2 ILE 45 3.770 -5.397 -1.280
251 2HG2 ILE 45 2HG2 ILE 45 2.502 -6.277 -2.129
252 3HG2 ILE 45 3HG2 ILE 45 3.948 -5.760 -2.994
253 1HD1 ILE 45 1HD1 ILE 45 7.210 -5.825 -0.959
254 2HD1 ILE 45 2HD1 ILE 45 6.116 -6.385 0.305
255 3HD1 ILE 45 3HD1 ILE 45 5.547 -5.243 -0.911
256 H LYS 46 H LYS 46 2.074 -9.686 -1.357
257 HA LYS 46 HA LYS 46 -0.265 -8.171 -1.527
258 1HB LYS 46 1HB LYS 46 0.435 -10.684 -2.290
259 2HB LYS 46 2HB LYS 46 -0.615 -11.046 -0.927
260 1HG LYS 46 1HG LYS 46 -1.654 -9.067 -2.840
261 2HG LYS 46 2HG LYS 46 -1.479 -10.712 -3.451
262 1HD LYS 46 1HD LYS 46 -2.642 -10.752 -0.822
263 2HD LYS 46 2HD LYS 46 -3.561 -9.674 -1.875
264 1HE LYS 46 1HE LYS 46 -3.431 -11.617 -3.577
265 2HE LYS 46 2HE LYS 46 -3.021 -12.606 -2.176
266 1HZ LYS 46 1HZ LYS 46 -5.551 -11.373 -2.899
267 2HZ LYS 46 2HZ LYS 46 -5.159 -11.336 -1.255
268 3HZ LYS 46 3HZ LYS 46 -5.247 -12.816 -2.070
269 H ILE 47 H ILE 47 0.829 -10.405 0.983
270 HA ILE 47 HA ILE 47 -1.353 -9.960 2.765
271 HB ILE 47 HB ILE 47 1.266 -11.330 2.850
272 1HG1 ILE 47 1HG1 ILE 47 -0.421 -12.847 4.305
273 2HG1 ILE 47 2HG1 ILE 47 -1.593 -11.914 3.380
274 1HG2 ILE 47 1HG2 ILE 47 -0.030 -10.295 5.363
275 2HG2 ILE 47 2HG2 ILE 47 1.621 -10.017 4.801
276 3HG2 ILE 47 3HG2 ILE 47 1.129 -11.625 5.338
277 1HD1 ILE 47 1HD1 ILE 47 0.456 -12.853 1.630
278 2HD1 ILE 47 2HD1 ILE 47 -1.272 -13.205 1.619
279 3HD1 ILE 47 3HD1 ILE 47 -0.177 -14.197 2.580
280 H TRP 48 H TRP 48 1.847 -8.662 2.358
281 HA TRP 48 HA TRP 48 2.143 -7.113 4.637
282 1HB TRP 48 1HB TRP 48 3.914 -7.616 3.010
283 2HB TRP 48 2HB TRP 48 3.097 -6.636 1.807
284 HD1 TRP 48 HD1 TRP 48 5.729 -6.476 4.381
285 HE1 TRP 48 HE1 TRP 48 6.546 -4.057 4.643
286 HE3 TRP 48 HE3 TRP 48 2.022 -4.040 1.862
287 HZ2 TRP 48 HZ2 TRP 48 5.751 -1.474 3.913
288 HZ3 TRP 48 HZ3 TRP 48 2.123 -1.594 1.691
289 HH2 TRP 48 HH2 TRP 48 3.956 -0.344 2.687
290 H PHE 49 H PHE 49 0.850 -6.206 1.469
291 HA PHE 49 HA PHE 49 0.150 -3.574 2.288
292 1HB PHE 49 1HB PHE 49 -0.318 -5.212 -0.151
293 2HB PHE 49 2HB PHE 49 -1.336 -3.790 0.107
294 HD1 PHE 49 HD1 PHE 49 2.061 -4.985 -0.460
295 HD2 PHE 49 HD2 PHE 49 -0.411 -1.579 0.100
296 HE1 PHE 49 HE1 PHE 49 3.929 -3.535 -1.144
297 HE2 PHE 49 HE2 PHE 49 1.451 -0.111 -0.598
298 HZ PHE 49 HZ PHE 49 3.633 -1.103 -1.192
299 H GLN 50 H GLN 50 -1.667 -6.572 1.984
300 HA GLN 50 HA GLN 50 -4.161 -5.417 2.620
301 1HB GLN 50 1HB GLN 50 -3.127 -8.247 2.745
302 2HB GLN 50 2HB GLN 50 -4.771 -7.834 3.212
303 1HG GLN 50 1HG GLN 50 -4.691 -6.665 0.806
304 2HG GLN 50 2HG GLN 50 -3.529 -7.965 0.542
305 1HE2 GLN 50 1HE2 GLN 50 -4.404 -10.103 1.656
306 2HE2 GLN 50 2HE2 GLN 50 -6.004 -10.532 1.166
307 H ASN 51 H ASN 51 -1.492 -6.623 4.536
308 HA ASN 51 HA ASN 51 -2.858 -6.879 6.998
309 1HB ASN 51 1HB ASN 51 -0.046 -6.804 6.099
310 2HB ASN 51 2HB ASN 51 -0.316 -6.307 7.767
311 1HD2 ASN 51 1HD2 ASN 51 -2.094 -8.694 5.879
312 2HD2 ASN 51 2HD2 ASN 51 -1.698 -10.044 6.879
313 H LYS 52 H LYS 52 -1.095 -4.191 5.514
314 HA LYS 52 HA LYS 52 -1.342 -2.444 7.739
315 1HB LYS 52 1HB LYS 52 -0.452 -2.231 4.927
316 2HB LYS 52 2HB LYS 52 -1.030 -0.740 5.658
317 1HG LYS 52 1HG LYS 52 0.570 -1.109 7.525
318 2HG LYS 52 2HG LYS 52 1.212 -2.492 6.638
319 1HD LYS 52 1HD LYS 52 2.551 -1.120 5.512
320 2HD LYS 52 2HD LYS 52 1.134 -0.315 4.837
321 1HE LYS 52 1HE LYS 52 1.817 0.463 7.587
322 2HE LYS 52 2HE LYS 52 3.017 0.899 6.373
323 1HZ LYS 52 1HZ LYS 52 0.777 1.670 5.160
324 2HZ LYS 52 2HZ LYS 52 1.700 2.689 6.146
325 3HZ LYS 52 3HZ LYS 52 0.331 1.920 6.773
326 H ARG 53 H ARG 53 -3.381 -3.200 5.011
327 HA ARG 53 HA ARG 53 -5.108 -0.938 5.300
328 1HB ARG 53 1HB ARG 53 -4.696 -2.644 3.282
329 2HB ARG 53 2HB ARG 53 -6.095 -3.426 4.007
330 1HG ARG 53 1HG ARG 53 -7.510 -1.815 3.336
331 2HG ARG 53 2HG ARG 53 -6.341 -0.523 3.620
332 1HD ARG 53 1HD ARG 53 -5.651 -2.332 1.416
333 2HD ARG 53 2HD ARG 53 -7.130 -1.406 1.165
334 HE ARG 53 HE ARG 53 -4.439 -0.399 1.201
335 1HH1 ARG 53 1HH1 ARG 53 -7.803 0.411 1.647
336 2HH1 ARG 53 2HH1 ARG 53 -7.573 2.092 1.304
337 1HH2 ARG 53 1HH2 ARG 53 -4.134 1.812 0.749
338 2HH2 ARG 53 2HH2 ARG 53 -5.491 2.888 0.793
339 H ALA 54 H ALA 54 -4.924 -4.108 6.705
340 HA ALA 54 HA ALA 54 -7.556 -4.471 7.549
341 1HB ALA 54 1HB ALA 54 -5.303 -5.926 7.756
342 2HB ALA 54 2HB ALA 54 -6.770 -6.260 8.677
343 3HB ALA 54 3HB ALA 54 -5.453 -5.350 9.417
344 H LYS 55 H LYS 55 -4.838 -3.002 9.333
345 HA LYS 55 HA LYS 55 -6.738 -1.947 11.293
346 1HB LYS 55 1HB LYS 55 -4.221 -3.046 11.571
347 2HB LYS 55 2HB LYS 55 -3.912 -1.321 11.717
348 1HG LYS 55 1HG LYS 55 -6.152 -2.497 13.278
349 2HG LYS 55 2HG LYS 55 -4.496 -2.791 13.813
350 1HD LYS 55 1HD LYS 55 -5.597 -0.047 13.233
351 2HD LYS 55 2HD LYS 55 -5.613 -0.785 14.836
352 1HE LYS 55 1HE LYS 55 -3.018 -0.820 13.446
353 2HE LYS 55 2HE LYS 55 -3.614 0.777 13.896
354 1HZ LYS 55 1HZ LYS 55 -2.219 -0.761 15.536
355 2HZ LYS 55 2HZ LYS 55 -3.773 -1.287 15.941
356 3HZ LYS 55 3HZ LYS 55 -3.372 0.350 16.084
357 H ILE 56 H ILE 56 -6.429 -0.887 8.525
358 HA ILE 56 HA ILE 56 -6.262 1.910 9.265
359 HB ILE 56 HB ILE 56 -4.538 0.899 7.004
360 1HG1 ILE 56 1HG1 ILE 56 -3.741 1.768 9.792
361 2HG1 ILE 56 2HG1 ILE 56 -3.596 0.145 9.129
362 1HG2 ILE 56 1HG2 ILE 56 -4.257 3.575 8.274
363 2HG2 ILE 56 2HG2 ILE 56 -5.588 3.305 7.151
364 3HG2 ILE 56 3HG2 ILE 56 -3.924 3.069 6.618
365 1HD1 ILE 56 1HD1 ILE 56 -2.188 1.579 7.313
366 2HD1 ILE 56 2HD1 ILE 56 -1.492 0.757 8.711
367 3HD1 ILE 56 3HD1 ILE 56 -1.867 2.478 8.796
368 H LYS 57 H LYS 57 -8.488 1.872 8.746
369 HA LYS 57 HA LYS 57 -9.141 1.429 5.918
370 1HB LYS 57 1HB LYS 57 -10.557 0.988 8.419
371 2HB LYS 57 2HB LYS 57 -11.523 1.919 7.282
372 1HG LYS 57 1HG LYS 57 -10.162 -0.623 6.464
373 2HG LYS 57 2HG LYS 57 -11.742 -0.625 7.248
374 1HD LYS 57 1HD LYS 57 -11.635 1.300 5.090
375 2HD LYS 57 2HD LYS 57 -11.220 -0.320 4.529
376 1HE LYS 57 1HE LYS 57 -13.677 0.324 4.456
377 2HE LYS 57 2HE LYS 57 -13.279 -1.208 5.234
378 1HZ LYS 57 1HZ LYS 57 -14.815 0.717 6.319
379 2HZ LYS 57 2HZ LYS 57 -13.315 1.053 7.025
380 3HZ LYS 57 3HZ LYS 57 -14.006 -0.480 7.202
381 H LYS 58 H LYS 58 -8.088 3.475 5.385
382 HA LYS 58 HA LYS 58 -8.133 5.673 4.803
383 1HB LYS 58 1HB LYS 58 -10.551 4.756 4.177
384 2HB LYS 58 2HB LYS 58 -11.038 5.894 5.424
385 1HG LYS 58 1HG LYS 58 -10.936 7.535 3.947
386 2HG LYS 58 2HG LYS 58 -9.208 7.239 3.749
387 1HD LYS 58 1HD LYS 58 -10.942 5.353 2.317
388 2HD LYS 58 2HD LYS 58 -11.065 7.025 1.767
389 1HE LYS 58 1HE LYS 58 -9.334 5.579 0.610
390 2HE LYS 58 2HE LYS 58 -8.773 7.128 1.238
391 1HZ LYS 58 1HZ LYS 58 -8.546 4.753 2.943
392 2HZ LYS 58 2HZ LYS 58 -7.567 6.130 2.882
393 3HZ LYS 58 3HZ LYS 58 -7.438 4.949 1.679
394 H SER 59 H SER 59 -8.952 7.933 5.602
395 HA SER 59 HA SER 59 -8.320 8.035 8.441
396 1HB SER 59 1HB SER 59 -8.302 10.559 7.965
397 2HB SER 59 2HB SER 59 -7.057 9.586 7.183
398 HG SER 59 HG SER 59 -7.794 10.545 5.453
Start of MODEL 9
1 1H ALA 16 1H ALA 16 -12.063 17.903 -6.029
2 2H ALA 16 2H ALA 16 -13.507 18.801 -5.802
3 3H ALA 16 3H ALA 16 -13.243 17.955 -7.271
4 HA ALA 16 HA ALA 16 -13.511 16.723 -4.615
5 1HB ALA 16 1HB ALA 16 -15.727 16.456 -4.949
6 2HB ALA 16 2HB ALA 16 -15.557 16.306 -6.698
7 3HB ALA 16 3HB ALA 16 -15.527 17.899 -5.943
8 H LYS 17 H LYS 17 -12.353 14.918 -4.622
9 HA LYS 17 HA LYS 17 -11.521 13.621 -7.031
10 1HB LYS 17 1HB LYS 17 -11.337 12.592 -4.196
11 2HB LYS 17 2HB LYS 17 -10.403 12.038 -5.579
12 1HG LYS 17 1HG LYS 17 -9.044 13.888 -5.579
13 2HG LYS 17 2HG LYS 17 -10.245 14.903 -4.778
14 1HD LYS 17 1HD LYS 17 -8.693 14.550 -3.095
15 2HD LYS 17 2HD LYS 17 -9.893 13.298 -2.770
16 1HE LYS 17 1HE LYS 17 -8.409 11.801 -4.253
17 2HE LYS 17 2HE LYS 17 -7.170 13.029 -3.996
18 1HZ LYS 17 1HZ LYS 17 -6.921 12.457 -1.838
19 2HZ LYS 17 2HZ LYS 17 -7.487 10.962 -2.389
20 3HZ LYS 17 3HZ LYS 17 -8.547 12.037 -1.627
21 H ARG 18 H ARG 18 -12.774 12.348 -8.212
22 HA ARG 18 HA ARG 18 -14.917 10.837 -6.882
23 1HB ARG 18 1HB ARG 18 -14.613 11.537 -9.808
24 2HB ARG 18 2HB ARG 18 -15.980 10.701 -9.084
25 1HG ARG 18 1HG ARG 18 -15.961 12.922 -7.578
26 2HG ARG 18 2HG ARG 18 -15.284 13.564 -9.076
27 1HD ARG 18 1HD ARG 18 -17.271 12.298 -10.189
28 2HD ARG 18 2HD ARG 18 -17.970 12.352 -8.571
29 HE ARG 18 HE ARG 18 -17.763 14.510 -10.416
30 1HH1 ARG 18 1HH1 ARG 18 -17.724 13.741 -7.012
31 2HH1 ARG 18 2HH1 ARG 18 -18.275 15.309 -6.524
32 1HH2 ARG 18 1HH2 ARG 18 -18.488 16.573 -9.776
33 2HH2 ARG 18 2HH2 ARG 18 -18.707 16.917 -8.092
34 H GLU 19 H GLU 19 -12.280 10.556 -9.219
35 HA GLU 19 HA GLU 19 -12.401 7.628 -8.891
36 1HB GLU 19 1HB GLU 19 -12.877 8.690 -11.216
37 2HB GLU 19 2HB GLU 19 -11.141 8.963 -11.268
38 1HG GLU 19 1HG GLU 19 -11.923 6.239 -10.530
39 2HG GLU 19 2HG GLU 19 -12.394 6.729 -12.156
40 H PHE 20 H PHE 20 -10.513 6.538 -8.453
41 HA PHE 20 HA PHE 20 -7.971 7.909 -8.500
42 1HB PHE 20 1HB PHE 20 -7.505 7.624 -6.114
43 2HB PHE 20 2HB PHE 20 -8.903 8.666 -6.356
44 HD1 PHE 20 HD1 PHE 20 -7.977 5.141 -5.641
45 HD2 PHE 20 HD2 PHE 20 -10.888 8.218 -5.250
46 HE1 PHE 20 HE1 PHE 20 -9.302 3.690 -4.162
47 HE2 PHE 20 HE2 PHE 20 -12.221 6.774 -3.768
48 HZ PHE 20 HZ PHE 20 -11.428 4.507 -3.223
49 H ASN 21 H ASN 21 -6.322 6.356 -7.227
50 HA ASN 21 HA ASN 21 -6.715 3.709 -8.437
51 1HB ASN 21 1HB ASN 21 -4.287 5.306 -7.694
52 2HB ASN 21 2HB ASN 21 -4.186 3.563 -7.911
53 1HD2 ASN 21 1HD2 ASN 21 -2.884 5.578 -9.465
54 2HD2 ASN 21 2HD2 ASN 21 -3.451 5.416 -11.089
55 H GLU 22 H GLU 22 -7.690 2.400 -6.983
56 HA GLU 22 HA GLU 22 -7.538 2.529 -4.213
57 1HB GLU 22 1HB GLU 22 -7.902 0.039 -5.892
58 2HB GLU 22 2HB GLU 22 -8.354 0.223 -4.202
59 1HG GLU 22 1HG GLU 22 -10.210 1.426 -4.683
60 2HG GLU 22 2HG GLU 22 -9.498 2.160 -6.118
61 H ASN 23 H ASN 23 -5.584 0.668 -6.491
62 HA ASN 23 HA ASN 23 -3.364 0.681 -4.638
63 1HB ASN 23 1HB ASN 23 -4.258 -1.966 -5.742
64 2HB ASN 23 2HB ASN 23 -3.028 -1.649 -4.527
65 1HD2 ASN 23 1HD2 ASN 23 -3.637 -1.211 -2.420
66 2HD2 ASN 23 2HD2 ASN 23 -5.236 -1.507 -1.837
67 H ARG 24 H ARG 24 -2.650 2.042 -6.323
68 HA ARG 24 HA ARG 24 -1.115 0.657 -8.323
69 1HB ARG 24 1HB ARG 24 -3.215 2.652 -9.211
70 2HB ARG 24 2HB ARG 24 -2.044 1.846 -10.248
71 1HG ARG 24 1HG ARG 24 -3.100 -0.330 -9.552
72 2HG ARG 24 2HG ARG 24 -4.373 0.629 -8.793
73 1HD ARG 24 1HD ARG 24 -3.706 1.303 -11.592
74 2HD ARG 24 2HD ARG 24 -4.491 -0.253 -11.329
75 HE ARG 24 HE ARG 24 -5.670 2.354 -11.058
76 1HH1 ARG 24 1HH1 ARG 24 -5.867 -0.989 -10.078
77 2HH1 ARG 24 2HH1 ARG 24 -7.555 -0.909 -9.703
78 1HH2 ARG 24 1HH2 ARG 24 -7.890 2.461 -10.565
79 2HH2 ARG 24 2HH2 ARG 24 -8.704 1.049 -9.980
80 H TYR 25 H TYR 25 -2.401 3.864 -7.519
81 HA TYR 25 HA TYR 25 -0.484 5.543 -8.399
82 1HB TYR 25 1HB TYR 25 -1.115 7.076 -6.616
83 2HB TYR 25 2HB TYR 25 -2.543 6.234 -7.211
84 HD1 TYR 25 HD1 TYR 25 -3.019 3.937 -5.862
85 HD2 TYR 25 HD2 TYR 25 -0.937 7.317 -4.332
86 HE1 TYR 25 HE1 TYR 25 -3.532 3.205 -3.578
87 HE2 TYR 25 HE2 TYR 25 -1.452 6.597 -2.037
88 HH TYR 25 HH TYR 25 -2.866 3.495 -1.352
89 H LEU 26 H LEU 26 -0.361 3.817 -5.298
90 HA LEU 26 HA LEU 26 2.525 4.374 -5.211
91 1HB LEU 26 1HB LEU 26 2.452 4.968 -3.034
92 2HB LEU 26 2HB LEU 26 0.809 5.397 -3.449
93 HG LEU 26 HG LEU 26 0.683 4.296 -1.373
94 1HD1 LEU 26 1HD1 LEU 26 -1.026 2.982 -1.889
95 2HD1 LEU 26 2HD1 LEU 26 0.001 1.846 -2.759
96 3HD1 LEU 26 3HD1 LEU 26 -0.621 3.278 -3.577
97 1HD2 LEU 26 1HD2 LEU 26 2.223 2.878 -0.657
98 2HD2 LEU 26 2HD2 LEU 26 2.987 2.937 -2.245
99 3HD2 LEU 26 3HD2 LEU 26 1.773 1.706 -1.895
100 H THR 27 H THR 27 0.048 2.009 -5.127
101 HA THR 27 HA THR 27 1.150 -0.086 -3.741
102 HB THR 27 HB THR 27 -0.482 -0.085 -6.279
103 HG1 THR 27 HG1 THR 27 -1.346 0.718 -4.221
104 1HG2 THR 27 1HG2 THR 27 -1.072 -2.451 -5.127
105 2HG2 THR 27 2HG2 THR 27 0.662 -2.355 -4.821
106 3HG2 THR 27 3HG2 THR 27 0.050 -2.248 -6.472
107 H GLU 28 H GLU 28 1.276 -0.048 -7.292
108 HA GLU 28 HA GLU 28 3.400 -1.846 -7.501
109 1HB GLU 28 1HB GLU 28 2.589 0.290 -9.478
110 2HB GLU 28 2HB GLU 28 3.553 -1.137 -9.836
111 1HG GLU 28 1HG GLU 28 0.771 -1.332 -8.736
112 2HG GLU 28 2HG GLU 28 1.093 -1.195 -10.464
113 H ARG 29 H ARG 29 3.394 1.651 -7.202
114 HA ARG 29 HA ARG 29 6.072 2.112 -7.935
115 1HB ARG 29 1HB ARG 29 3.965 3.705 -7.311
116 2HB ARG 29 2HB ARG 29 4.931 3.864 -5.850
117 1HG ARG 29 1HG ARG 29 6.508 4.119 -8.281
118 2HG ARG 29 2HG ARG 29 5.225 5.324 -8.156
119 1HD ARG 29 1HD ARG 29 6.285 6.425 -6.528
120 2HD ARG 29 2HD ARG 29 6.639 4.940 -5.646
121 HE ARG 29 HE ARG 29 8.734 4.945 -6.558
122 1HH1 ARG 29 1HH1 ARG 29 6.704 7.095 -8.409
123 2HH1 ARG 29 2HH1 ARG 29 8.010 7.708 -9.366
124 1HH2 ARG 29 1HH2 ARG 29 10.455 5.749 -7.817
125 2HH2 ARG 29 2HH2 ARG 29 10.140 6.943 -9.030
126 H ARG 30 H ARG 30 4.579 1.632 -4.747
127 HA ARG 30 HA ARG 30 7.129 1.675 -3.408
128 1HB ARG 30 1HB ARG 30 4.293 1.475 -2.604
129 2HB ARG 30 2HB ARG 30 5.442 0.675 -1.543
130 1HG ARG 30 1HG ARG 30 6.591 3.146 -2.038
131 2HG ARG 30 2HG ARG 30 4.868 3.490 -1.867
132 1HD ARG 30 1HD ARG 30 5.806 1.615 0.137
133 2HD ARG 30 2HD ARG 30 6.703 3.131 0.184
134 HE ARG 30 HE ARG 30 4.027 3.808 0.030
135 1HH1 ARG 30 1HH1 ARG 30 6.107 2.082 2.239
136 2HH1 ARG 30 2HH1 ARG 30 5.172 2.494 3.638
137 1HH2 ARG 30 1HH2 ARG 30 2.797 4.350 1.869
138 2HH2 ARG 30 2HH2 ARG 30 3.293 3.782 3.427
139 H ARG 31 H ARG 31 5.107 -0.721 -4.852
140 HA ARG 31 HA ARG 31 5.836 -2.995 -3.417
141 1HB ARG 31 1HB ARG 31 4.571 -2.393 -5.959
142 2HB ARG 31 2HB ARG 31 5.583 -3.826 -6.076
143 1HG ARG 31 1HG ARG 31 4.217 -5.057 -4.787
144 2HG ARG 31 2HG ARG 31 3.829 -3.708 -3.718
145 1HD ARG 31 1HD ARG 31 1.818 -4.203 -4.825
146 2HD ARG 31 2HD ARG 31 2.456 -2.785 -5.653
147 HE ARG 31 HE ARG 31 2.745 -4.046 -7.549
148 1HH1 ARG 31 1HH1 ARG 31 2.073 -6.157 -4.851
149 2HH1 ARG 31 2HH1 ARG 31 1.869 -7.563 -5.842
150 1HH2 ARG 31 1HH2 ARG 31 2.478 -5.893 -8.851
151 2HH2 ARG 31 2HH2 ARG 31 2.099 -7.413 -8.112
152 H GLN 32 H GLN 32 7.423 -1.401 -6.132
153 HA GLN 32 HA GLN 32 9.438 -3.372 -6.481
154 1HB GLN 32 1HB GLN 32 8.804 -0.730 -7.565
155 2HB GLN 32 2HB GLN 32 10.533 -1.020 -7.433
156 1HG GLN 32 1HG GLN 32 9.599 -1.641 -9.626
157 2HG GLN 32 2HG GLN 32 10.369 -2.989 -8.789
158 1HE2 GLN 32 1HE2 GLN 32 7.166 -1.557 -8.353
159 2HE2 GLN 32 2HE2 GLN 32 6.279 -2.995 -8.712
160 H GLN 33 H GLN 33 9.298 -0.335 -4.672
161 HA GLN 33 HA GLN 33 12.020 -0.485 -3.805
162 1HB GLN 33 1HB GLN 33 9.677 1.237 -3.043
163 2HB GLN 33 2HB GLN 33 11.200 1.328 -2.168
164 1HG GLN 33 1HG GLN 33 12.287 1.727 -4.436
165 2HG GLN 33 2HG GLN 33 10.652 2.001 -5.036
166 1HE2 GLN 33 1HE2 GLN 33 11.309 4.143 -5.544
167 2HE2 GLN 33 2HE2 GLN 33 11.388 5.354 -4.314
168 H LEU 34 H LEU 34 8.897 -1.338 -2.369
169 HA LEU 34 HA LEU 34 9.879 -1.864 0.225
170 1HB LEU 34 1HB LEU 34 7.404 -2.471 -1.281
171 2HB LEU 34 2HB LEU 34 7.742 -3.485 0.109
172 HG LEU 34 HG LEU 34 7.795 -0.497 0.360
173 1HD1 LEU 34 1HD1 LEU 34 5.510 -0.354 0.720
174 2HD1 LEU 34 2HD1 LEU 34 5.331 -2.098 0.914
175 3HD1 LEU 34 3HD1 LEU 34 5.628 -1.415 -0.684
176 1HD2 LEU 34 1HD2 LEU 34 8.707 -1.723 2.212
177 2HD2 LEU 34 2HD2 LEU 34 7.296 -2.780 2.265
178 3HD2 LEU 34 3HD2 LEU 34 7.137 -1.074 2.685
179 H SER 35 H SER 35 9.472 -3.909 -2.623
180 HA SER 35 HA SER 35 10.092 -6.358 -1.395
181 1HB SER 35 1HB SER 35 10.381 -7.229 -3.612
182 2HB SER 35 2HB SER 35 9.083 -6.038 -3.691
183 HG SER 35 HG SER 35 10.524 -4.571 -4.578
184 H SER 36 H SER 36 12.146 -4.039 -3.141
185 HA SER 36 HA SER 36 14.552 -5.494 -2.784
186 1HB SER 36 1HB SER 36 13.856 -3.427 -4.361
187 2HB SER 36 2HB SER 36 14.710 -2.551 -3.091
188 HG SER 36 HG SER 36 15.675 -4.513 -4.858
189 H GLU 37 H GLU 37 13.001 -2.916 -0.938
190 HA GLU 37 HA GLU 37 15.176 -2.405 0.796
191 1HB GLU 37 1HB GLU 37 12.304 -1.702 0.691
192 2HB GLU 37 2HB GLU 37 13.052 -1.644 2.281
193 1HG GLU 37 1HG GLU 37 14.573 -0.344 0.130
194 2HG GLU 37 2HG GLU 37 13.027 0.404 0.529
195 H LEU 38 H LEU 38 12.220 -4.337 1.251
196 HA LEU 38 HA LEU 38 13.211 -5.367 3.769
197 1HB LEU 38 1HB LEU 38 10.684 -5.719 2.200
198 2HB LEU 38 2HB LEU 38 11.057 -6.795 3.533
199 HG LEU 38 HG LEU 38 11.323 -4.648 4.934
200 1HD1 LEU 38 1HD1 LEU 38 10.713 -2.654 4.111
201 2HD1 LEU 38 2HD1 LEU 38 9.370 -3.332 3.190
202 3HD1 LEU 38 3HD1 LEU 38 11.008 -3.399 2.540
203 1HD2 LEU 38 1HD2 LEU 38 8.522 -5.142 3.994
204 2HD2 LEU 38 2HD2 LEU 38 9.106 -4.796 5.622
205 3HD2 LEU 38 3HD2 LEU 38 9.411 -6.372 4.892
206 H GLY 39 H GLY 39 13.292 -6.283 0.460
207 1HA GLY 39 1HA GLY 39 14.366 -8.045 -0.557
208 2HA GLY 39 2HA GLY 39 14.933 -8.546 1.029
209 H LEU 40 H LEU 40 11.537 -8.124 0.349
210 HA LEU 40 HA LEU 40 11.200 -11.035 0.610
211 1HB LEU 40 1HB LEU 40 8.714 -10.133 1.034
212 2HB LEU 40 2HB LEU 40 9.895 -10.333 2.313
213 HG LEU 40 HG LEU 40 10.479 -7.889 2.002
214 1HD1 LEU 40 1HD1 LEU 40 9.060 -8.056 -0.287
215 2HD1 LEU 40 2HD1 LEU 40 9.365 -6.550 0.577
216 3HD1 LEU 40 3HD1 LEU 40 7.838 -7.402 0.801
217 1HD2 LEU 40 1HD2 LEU 40 9.288 -8.104 3.908
218 2HD2 LEU 40 2HD2 LEU 40 8.004 -9.031 3.129
219 3HD2 LEU 40 3HD2 LEU 40 8.047 -7.274 2.967
220 H ASN 41 H ASN 41 9.344 -11.977 -0.549
221 HA ASN 41 HA ASN 41 9.350 -11.050 -3.293
222 1HB ASN 41 1HB ASN 41 7.938 -13.163 -3.635
223 2HB ASN 41 2HB ASN 41 9.609 -13.386 -3.127
224 1HD2 ASN 41 1HD2 ASN 41 6.313 -13.190 -1.929
225 2HD2 ASN 41 2HD2 ASN 41 6.536 -14.254 -0.588
226 H GLU 42 H GLU 42 7.392 -10.774 -4.522
227 HA GLU 42 HA GLU 42 5.618 -8.933 -3.463
228 1HB GLU 42 1HB GLU 42 6.044 -9.423 -5.899
229 2HB GLU 42 2HB GLU 42 5.006 -10.834 -5.732
230 1HG GLU 42 1HG GLU 42 3.425 -8.856 -4.727
231 2HG GLU 42 2HG GLU 42 4.316 -8.007 -5.989
232 H ALA 43 H ALA 43 5.488 -12.415 -3.439
233 HA ALA 43 HA ALA 43 2.772 -12.811 -2.879
234 1HB ALA 43 1HB ALA 43 4.688 -14.574 -1.479
235 2HB ALA 43 2HB ALA 43 4.851 -14.476 -3.233
236 3HB ALA 43 3HB ALA 43 3.321 -14.981 -2.517
237 H GLN 44 H GLN 44 5.459 -11.887 -0.848
238 HA GLN 44 HA GLN 44 3.971 -12.035 1.625
239 1HB GLN 44 1HB GLN 44 6.693 -11.064 0.814
240 2HB GLN 44 2HB GLN 44 6.046 -10.641 2.392
241 1HG GLN 44 1HG GLN 44 5.799 -13.475 1.824
242 2HG GLN 44 2HG GLN 44 7.468 -12.911 1.759
243 1HE2 GLN 44 1HE2 GLN 44 4.880 -11.642 3.777
244 2HE2 GLN 44 2HE2 GLN 44 5.596 -12.078 5.287
245 H ILE 45 H ILE 45 4.728 -9.763 -0.853
246 HA ILE 45 HA ILE 45 4.146 -7.360 0.488
247 HB ILE 45 HB ILE 45 4.072 -8.068 -2.444
248 1HG1 ILE 45 1HG1 ILE 45 6.252 -8.131 -1.086
249 2HG1 ILE 45 2HG1 ILE 45 6.249 -7.180 -2.567
250 1HG2 ILE 45 1HG2 ILE 45 2.612 -6.151 -2.025
251 2HG2 ILE 45 2HG2 ILE 45 4.060 -5.682 -2.915
252 3HG2 ILE 45 3HG2 ILE 45 3.935 -5.333 -1.194
253 1HD1 ILE 45 1HD1 ILE 45 5.993 -6.123 0.237
254 2HD1 ILE 45 2HD1 ILE 45 5.897 -5.147 -1.227
255 3HD1 ILE 45 3HD1 ILE 45 7.395 -5.989 -0.826
256 H LYS 46 H LYS 46 2.118 -9.614 -1.357
257 HA LYS 46 HA LYS 46 -0.199 -8.064 -1.525
258 1HB LYS 46 1HB LYS 46 0.502 -10.613 -2.273
259 2HB LYS 46 2HB LYS 46 -0.669 -10.918 -0.997
260 1HG LYS 46 1HG LYS 46 -1.972 -9.026 -2.418
261 2HG LYS 46 2HG LYS 46 -1.052 -9.824 -3.695
262 1HD LYS 46 1HD LYS 46 -2.138 -11.830 -3.411
263 2HD LYS 46 2HD LYS 46 -2.522 -11.503 -1.719
264 1HE LYS 46 1HE LYS 46 -4.588 -11.101 -2.509
265 2HE LYS 46 2HE LYS 46 -3.914 -9.533 -2.952
266 1HZ LYS 46 1HZ LYS 46 -3.670 -10.178 -5.157
267 2HZ LYS 46 2HZ LYS 46 -5.163 -10.846 -4.727
268 3HZ LYS 46 3HZ LYS 46 -3.789 -11.829 -4.806
269 H ILE 47 H ILE 47 0.833 -10.367 0.953
270 HA ILE 47 HA ILE 47 -1.373 -9.925 2.708
271 HB ILE 47 HB ILE 47 1.214 -11.350 2.802
272 1HG1 ILE 47 1HG1 ILE 47 -1.366 -12.130 4.136
273 2HG1 ILE 47 2HG1 ILE 47 -1.174 -12.259 2.391
274 1HG2 ILE 47 1HG2 ILE 47 1.601 -10.079 4.769
275 2HG2 ILE 47 2HG2 ILE 47 1.049 -11.673 5.289
276 3HG2 ILE 47 3HG2 ILE 47 -0.062 -10.303 5.319
277 1HD1 ILE 47 1HD1 ILE 47 0.262 -13.747 4.552
278 2HD1 ILE 47 2HD1 ILE 47 0.914 -13.637 2.916
279 3HD1 ILE 47 3HD1 ILE 47 -0.662 -14.380 3.189
280 H TRP 48 H TRP 48 1.875 -8.692 2.416
281 HA TRP 48 HA TRP 48 2.125 -7.174 4.720
282 1HB TRP 48 1HB TRP 48 3.943 -7.686 3.153
283 2HB TRP 48 2HB TRP 48 3.177 -6.698 1.924
284 HD1 TRP 48 HD1 TRP 48 5.745 -6.569 4.559
285 HE1 TRP 48 HE1 TRP 48 6.582 -4.158 4.840
286 HE3 TRP 48 HE3 TRP 48 2.119 -4.085 1.970
287 HZ2 TRP 48 HZ2 TRP 48 5.832 -1.566 4.103
288 HZ3 TRP 48 HZ3 TRP 48 2.249 -1.642 1.808
289 HH2 TRP 48 HH2 TRP 48 4.076 -0.413 2.841
290 H PHE 49 H PHE 49 0.948 -6.215 1.524
291 HA PHE 49 HA PHE 49 0.230 -3.589 2.357
292 1HB PHE 49 1HB PHE 49 -0.150 -5.190 -0.122
293 2HB PHE 49 2HB PHE 49 -1.189 -3.781 0.123
294 HD1 PHE 49 HD1 PHE 49 2.237 -4.937 -0.331
295 HD2 PHE 49 HD2 PHE 49 -0.291 -1.563 0.158
296 HE1 PHE 49 HE1 PHE 49 4.113 -3.464 -0.936
297 HE2 PHE 49 HE2 PHE 49 1.579 -0.070 -0.458
298 HZ PHE 49 HZ PHE 49 3.793 -1.034 -0.977
299 H GLN 50 H GLN 50 -1.550 -6.587 1.931
300 HA GLN 50 HA GLN 50 -4.091 -5.526 2.442
301 1HB GLN 50 1HB GLN 50 -2.882 -8.258 2.536
302 2HB GLN 50 2HB GLN 50 -4.465 -8.022 3.261
303 1HG GLN 50 1HG GLN 50 -4.406 -8.822 0.866
304 2HG GLN 50 2HG GLN 50 -5.441 -7.439 1.216
305 1HE2 GLN 50 1HE2 GLN 50 -3.395 -8.631 -0.984
306 2HE2 GLN 50 2HE2 GLN 50 -2.781 -7.170 -1.671
307 H ASN 51 H ASN 51 -1.481 -6.539 4.544
308 HA ASN 51 HA ASN 51 -3.033 -6.632 6.940
309 1HB ASN 51 1HB ASN 51 -0.203 -6.899 6.196
310 2HB ASN 51 2HB ASN 51 -0.461 -6.178 7.782
311 1HD2 ASN 51 1HD2 ASN 51 -2.424 -8.591 6.123
312 2HD2 ASN 51 2HD2 ASN 51 -2.196 -9.843 7.291
313 H LYS 52 H LYS 52 -0.994 -4.193 5.394
314 HA LYS 52 HA LYS 52 -1.252 -2.284 7.497
315 1HB LYS 52 1HB LYS 52 0.085 -2.468 4.934
316 2HB LYS 52 2HB LYS 52 -0.657 -0.888 5.144
317 1HG LYS 52 1HG LYS 52 0.586 -0.462 7.110
318 2HG LYS 52 2HG LYS 52 1.129 -2.138 7.211
319 1HD LYS 52 1HD LYS 52 2.796 -1.809 5.737
320 2HD LYS 52 2HD LYS 52 1.797 -0.801 4.688
321 1HE LYS 52 1HE LYS 52 2.239 0.655 7.070
322 2HE LYS 52 2HE LYS 52 3.794 -0.015 6.577
323 1HZ LYS 52 1HZ LYS 52 3.123 2.239 5.640
324 2HZ LYS 52 2HZ LYS 52 2.047 1.387 4.651
325 3HZ LYS 52 3HZ LYS 52 3.708 1.088 4.545
326 H ARG 53 H ARG 53 -3.052 -3.025 4.594
327 HA ARG 53 HA ARG 53 -4.638 -0.619 4.709
328 1HB ARG 53 1HB ARG 53 -4.796 -3.118 3.029
329 2HB ARG 53 2HB ARG 53 -5.979 -1.822 2.913
330 1HG ARG 53 1HG ARG 53 -3.090 -1.159 2.647
331 2HG ARG 53 2HG ARG 53 -3.926 -1.924 1.294
332 1HD ARG 53 1HD ARG 53 -5.280 -0.114 0.929
333 2HD ARG 53 2HD ARG 53 -5.222 0.405 2.614
334 HE ARG 53 HE ARG 53 -2.709 0.655 1.240
335 1HH1 ARG 53 1HH1 ARG 53 -5.758 2.205 1.930
336 2HH1 ARG 53 2HH1 ARG 53 -5.149 3.804 1.662
337 1HH2 ARG 53 1HH2 ARG 53 -1.905 2.758 0.887
338 2HH2 ARG 53 2HH2 ARG 53 -2.962 4.118 1.070
339 H ALA 54 H ALA 54 -4.613 -3.314 6.590
340 HA ALA 54 HA ALA 54 -7.521 -3.505 6.855
341 1HB ALA 54 1HB ALA 54 -5.328 -5.167 8.089
342 2HB ALA 54 2HB ALA 54 -6.318 -5.606 6.697
343 3HB ALA 54 3HB ALA 54 -7.058 -5.446 8.290
344 H LYS 55 H LYS 55 -5.966 -1.156 7.751
345 HA LYS 55 HA LYS 55 -6.231 -1.319 10.660
346 1HB LYS 55 1HB LYS 55 -5.035 0.801 10.718
347 2HB LYS 55 2HB LYS 55 -4.153 -0.368 9.743
348 1HG LYS 55 1HG LYS 55 -5.215 0.692 7.720
349 2HG LYS 55 2HG LYS 55 -5.784 1.971 8.796
350 1HD LYS 55 1HD LYS 55 -3.574 2.629 9.332
351 2HD LYS 55 2HD LYS 55 -2.889 1.175 8.605
352 1HE LYS 55 1HE LYS 55 -3.980 2.052 6.424
353 2HE LYS 55 2HE LYS 55 -4.039 3.597 7.273
354 1HZ LYS 55 1HZ LYS 55 -1.721 3.673 7.428
355 2HZ LYS 55 2HZ LYS 55 -2.014 3.143 5.848
356 3HZ LYS 55 3HZ LYS 55 -1.536 2.037 7.035
357 H ILE 56 H ILE 56 -7.382 0.587 7.902
358 HA ILE 56 HA ILE 56 -9.217 1.903 7.613
359 HB ILE 56 HB ILE 56 -10.366 0.495 10.021
360 1HG1 ILE 56 1HG1 ILE 56 -11.192 -0.531 7.428
361 2HG1 ILE 56 2HG1 ILE 56 -9.458 -0.710 7.674
362 1HG2 ILE 56 1HG2 ILE 56 -11.420 2.300 7.950
363 2HG2 ILE 56 2HG2 ILE 56 -11.969 2.020 9.602
364 3HG2 ILE 56 3HG2 ILE 56 -12.419 0.896 8.321
365 1HD1 ILE 56 1HD1 ILE 56 -11.230 -1.525 9.896
366 2HD1 ILE 56 2HD1 ILE 56 -9.713 -2.227 9.333
367 3HD1 ILE 56 3HD1 ILE 56 -11.210 -2.537 8.453
368 H LYS 57 H LYS 57 -7.982 3.764 8.220
369 HA LYS 57 HA LYS 57 -8.658 4.815 10.888
370 1HB LYS 57 1HB LYS 57 -6.646 6.337 10.484
371 2HB LYS 57 2HB LYS 57 -6.312 4.644 10.819
372 1HG LYS 57 1HG LYS 57 -5.437 4.275 8.783
373 2HG LYS 57 2HG LYS 57 -6.602 5.325 7.974
374 1HD LYS 57 1HD LYS 57 -4.979 6.982 9.587
375 2HD LYS 57 2HD LYS 57 -3.898 5.877 8.737
376 1HE LYS 57 1HE LYS 57 -6.009 7.618 7.466
377 2HE LYS 57 2HE LYS 57 -4.273 7.925 7.456
378 1HZ LYS 57 1HZ LYS 57 -5.171 5.343 6.439
379 2HZ LYS 57 2HZ LYS 57 -3.907 6.333 5.908
380 3HZ LYS 57 3HZ LYS 57 -5.503 6.697 5.481
381 H LYS 58 H LYS 58 -10.696 5.528 9.965
382 HA LYS 58 HA LYS 58 -10.411 7.930 8.281
383 1HB LYS 58 1HB LYS 58 -12.343 5.709 8.270
384 2HB LYS 58 2HB LYS 58 -13.068 7.305 8.137
385 1HG LYS 58 1HG LYS 58 -12.661 6.380 5.944
386 2HG LYS 58 2HG LYS 58 -11.631 7.788 6.211
387 1HD LYS 58 1HD LYS 58 -10.274 6.129 5.187
388 2HD LYS 58 2HD LYS 58 -9.807 6.189 6.888
389 1HE LYS 58 1HE LYS 58 -10.512 4.094 7.282
390 2HE LYS 58 2HE LYS 58 -11.959 4.292 6.293
391 1HZ LYS 58 1HZ LYS 58 -10.624 2.676 5.243
392 2HZ LYS 58 2HZ LYS 58 -9.223 3.613 5.379
393 3HZ LYS 58 3HZ LYS 58 -10.455 4.082 4.319
394 H SER 59 H SER 59 -12.056 6.530 11.073
395 HA SER 59 HA SER 59 -12.527 9.257 12.066
396 1HB SER 59 1HB SER 59 -14.620 8.067 11.136
397 2HB SER 59 2HB SER 59 -14.501 7.038 12.564
398 HG SER 59 HG SER 59 -14.784 9.861 12.515
Start of MODEL 10
1 1H ALA 16 1H ALA 16 -20.934 -6.398 -7.166
2 2H ALA 16 2H ALA 16 -20.982 -7.915 -6.364
3 3H ALA 16 3H ALA 16 -20.017 -7.714 -7.769
4 HA ALA 16 HA ALA 16 -19.598 -6.747 -5.052
5 1HB ALA 16 1HB ALA 16 -17.205 -7.447 -5.915
6 2HB ALA 16 2HB ALA 16 -18.154 -8.384 -7.070
7 3HB ALA 16 3HB ALA 16 -18.363 -8.646 -5.339
8 H LYS 17 H LYS 17 -18.623 -4.852 -4.637
9 HA LYS 17 HA LYS 17 -17.945 -3.154 -6.942
10 1HB LYS 17 1HB LYS 17 -18.323 -1.242 -5.438
11 2HB LYS 17 2HB LYS 17 -19.750 -2.261 -5.576
12 1HG LYS 17 1HG LYS 17 -19.346 -3.229 -3.425
13 2HG LYS 17 2HG LYS 17 -17.786 -2.414 -3.301
14 1HD LYS 17 1HD LYS 17 -19.436 -0.305 -3.732
15 2HD LYS 17 2HD LYS 17 -20.503 -1.387 -2.835
16 1HE LYS 17 1HE LYS 17 -17.768 -0.467 -1.961
17 2HE LYS 17 2HE LYS 17 -19.307 0.120 -1.333
18 1HZ LYS 17 1HZ LYS 17 -17.913 -2.376 -0.798
19 2HZ LYS 17 2HZ LYS 17 -19.596 -2.483 -0.936
20 3HZ LYS 17 3HZ LYS 17 -18.907 -1.449 0.212
21 H ARG 18 H ARG 18 -16.256 -1.433 -6.370
22 HA ARG 18 HA ARG 18 -14.211 -2.383 -4.525
23 1HB ARG 18 1HB ARG 18 -12.463 -2.092 -6.340
24 2HB ARG 18 2HB ARG 18 -13.485 -3.516 -6.471
25 1HG ARG 18 1HG ARG 18 -14.108 -0.984 -7.951
26 2HG ARG 18 2HG ARG 18 -13.007 -2.202 -8.599
27 1HD ARG 18 1HD ARG 18 -15.395 -3.477 -7.669
28 2HD ARG 18 2HD ARG 18 -15.824 -2.145 -8.740
29 HE ARG 18 HE ARG 18 -14.809 -3.249 -10.506
30 1HH1 ARG 18 1HH1 ARG 18 -14.264 -4.983 -7.521
31 2HH1 ARG 18 2HH1 ARG 18 -13.696 -6.412 -8.314
32 1HH2 ARG 18 1HH2 ARG 18 -14.061 -5.130 -11.542
33 2HH2 ARG 18 2HH2 ARG 18 -13.579 -6.497 -10.593
34 H GLU 19 H GLU 19 -13.263 -0.743 -3.492
35 HA GLU 19 HA GLU 19 -13.932 1.969 -4.296
36 1HB GLU 19 1HB GLU 19 -13.153 0.622 -1.812
37 2HB GLU 19 2HB GLU 19 -12.383 2.189 -2.030
38 1HG GLU 19 1HG GLU 19 -14.453 3.306 -2.123
39 2HG GLU 19 2HG GLU 19 -15.344 1.797 -2.314
40 H PHE 20 H PHE 20 -12.662 2.884 -5.764
41 HA PHE 20 HA PHE 20 -10.826 3.456 -6.990
42 1HB PHE 20 1HB PHE 20 -9.030 4.468 -5.703
43 2HB PHE 20 2HB PHE 20 -10.583 4.876 -4.982
44 HD1 PHE 20 HD1 PHE 20 -7.738 2.502 -4.668
45 HD2 PHE 20 HD2 PHE 20 -10.960 4.495 -2.728
46 HE1 PHE 20 HE1 PHE 20 -6.951 1.653 -2.499
47 HE2 PHE 20 HE2 PHE 20 -10.178 3.650 -0.554
48 HZ PHE 20 HZ PHE 20 -8.171 2.227 -0.438
49 H ASN 21 H ASN 21 -8.179 3.119 -6.876
50 HA ASN 21 HA ASN 21 -7.818 0.444 -7.693
51 1HB ASN 21 1HB ASN 21 -5.600 2.331 -6.928
52 2HB ASN 21 2HB ASN 21 -5.550 1.009 -8.090
53 1HD2 ASN 21 1HD2 ASN 21 -6.482 4.283 -7.512
54 2HD2 ASN 21 2HD2 ASN 21 -6.881 4.680 -9.146
55 H GLU 22 H GLU 22 -8.246 -1.048 -6.138
56 HA GLU 22 HA GLU 22 -7.382 -0.887 -3.455
57 1HB GLU 22 1HB GLU 22 -8.828 -2.746 -5.092
58 2HB GLU 22 2HB GLU 22 -7.599 -3.624 -4.190
59 1HG GLU 22 1HG GLU 22 -8.515 -2.281 -2.161
60 2HG GLU 22 2HG GLU 22 -9.933 -2.065 -3.186
61 H ASN 23 H ASN 23 -5.204 -0.255 -3.573
62 HA ASN 23 HA ASN 23 -2.964 -0.611 -3.461
63 1HB ASN 23 1HB ASN 23 -3.426 -3.550 -3.911
64 2HB ASN 23 2HB ASN 23 -2.113 -2.765 -3.040
65 1HD2 ASN 23 1HD2 ASN 23 -2.647 -1.699 -1.024
66 2HD2 ASN 23 2HD2 ASN 23 -3.932 -2.324 -0.052
67 H ARG 24 H ARG 24 -2.551 0.457 -5.336
68 HA ARG 24 HA ARG 24 -1.315 -0.982 -7.427
69 1HB ARG 24 1HB ARG 24 -3.169 -1.503 -8.614
70 2HB ARG 24 2HB ARG 24 -4.174 -0.374 -7.717
71 1HG ARG 24 1HG ARG 24 -3.748 1.365 -9.173
72 2HG ARG 24 2HG ARG 24 -2.256 0.640 -9.772
73 1HD ARG 24 1HD ARG 24 -4.250 -1.207 -10.390
74 2HD ARG 24 2HD ARG 24 -4.961 0.365 -10.751
75 HE ARG 24 HE ARG 24 -2.399 0.324 -11.841
76 1HH1 ARG 24 1HH1 ARG 24 -5.453 -1.306 -12.278
77 2HH1 ARG 24 2HH1 ARG 24 -5.192 -1.610 -13.962
78 1HH2 ARG 24 1HH2 ARG 24 -2.053 -0.075 -14.056
79 2HH2 ARG 24 2HH2 ARG 24 -3.262 -0.912 -14.972
80 H TYR 25 H TYR 25 -3.260 1.987 -7.289
81 HA TYR 25 HA TYR 25 -1.909 3.772 -8.715
82 1HB TYR 25 1HB TYR 25 -2.619 5.519 -7.157
83 2HB TYR 25 2HB TYR 25 -3.883 4.302 -7.327
84 HD1 TYR 25 HD1 TYR 25 -3.599 2.288 -5.542
85 HD2 TYR 25 HD2 TYR 25 -2.222 6.278 -5.013
86 HE1 TYR 25 HE1 TYR 25 -3.602 1.954 -3.117
87 HE2 TYR 25 HE2 TYR 25 -2.232 5.959 -2.574
88 HH TYR 25 HH TYR 25 -3.694 3.238 -1.080
89 H LEU 26 H LEU 26 -0.941 2.818 -5.446
90 HA LEU 26 HA LEU 26 1.713 3.967 -5.973
91 1HB LEU 26 1HB LEU 26 1.783 5.017 -3.981
92 2HB LEU 26 2HB LEU 26 0.042 4.974 -4.143
93 HG LEU 26 HG LEU 26 0.518 4.369 -1.912
94 1HD1 LEU 26 1HD1 LEU 26 0.228 1.588 -2.663
95 2HD1 LEU 26 2HD1 LEU 26 -0.824 2.646 -3.601
96 3HD1 LEU 26 3HD1 LEU 26 -0.899 2.666 -1.841
97 1HD2 LEU 26 1HD2 LEU 26 2.130 1.997 -2.296
98 2HD2 LEU 26 2HD2 LEU 26 2.383 3.377 -1.228
99 3HD2 LEU 26 3HD2 LEU 26 2.934 3.445 -2.902
100 H THR 27 H THR 27 -0.115 1.233 -5.030
101 HA THR 27 HA THR 27 1.676 -0.233 -3.516
102 HB THR 27 HB THR 27 -0.391 -1.110 -5.531
103 HG1 THR 27 HG1 THR 27 -1.007 -0.047 -3.522
104 1HG2 THR 27 1HG2 THR 27 0.628 -3.111 -5.474
105 2HG2 THR 27 2HG2 THR 27 -0.205 -3.239 -3.924
106 3HG2 THR 27 3HG2 THR 27 1.490 -2.755 -3.978
107 H GLU 28 H GLU 28 1.339 -0.119 -7.052
108 HA GLU 28 HA GLU 28 3.351 -1.971 -7.659
109 1HB GLU 28 1HB GLU 28 2.040 0.253 -9.177
110 2HB GLU 28 2HB GLU 28 3.410 -0.597 -9.879
111 1HG GLU 28 1HG GLU 28 1.923 -2.697 -9.147
112 2HG GLU 28 2HG GLU 28 0.647 -1.510 -9.408
113 H ARG 29 H ARG 29 3.519 1.594 -7.635
114 HA ARG 29 HA ARG 29 6.228 1.807 -8.282
115 1HB ARG 29 1HB ARG 29 4.298 3.603 -8.020
116 2HB ARG 29 2HB ARG 29 5.002 3.791 -6.421
117 1HG ARG 29 1HG ARG 29 6.373 5.259 -7.380
118 2HG ARG 29 2HG ARG 29 7.206 3.854 -8.047
119 1HD ARG 29 1HD ARG 29 5.303 4.095 -9.889
120 2HD ARG 29 2HD ARG 29 5.357 5.774 -9.352
121 HE ARG 29 HE ARG 29 7.339 4.382 -10.893
122 1HH1 ARG 29 1HH1 ARG 29 6.786 7.029 -8.685
123 2HH1 ARG 29 2HH1 ARG 29 8.168 7.925 -9.216
124 1HH2 ARG 29 1HH2 ARG 29 9.158 5.560 -11.592
125 2HH2 ARG 29 2HH2 ARG 29 9.516 7.092 -10.867
126 H ARG 30 H ARG 30 4.633 1.524 -5.146
127 HA ARG 30 HA ARG 30 7.104 1.730 -3.684
128 1HB ARG 30 1HB ARG 30 4.243 1.494 -3.032
129 2HB ARG 30 2HB ARG 30 5.329 0.731 -1.880
130 1HG ARG 30 1HG ARG 30 6.104 3.437 -2.710
131 2HG ARG 30 2HG ARG 30 4.594 3.329 -1.806
132 1HD ARG 30 1HD ARG 30 6.009 1.795 -0.223
133 2HD ARG 30 2HD ARG 30 7.370 2.639 -0.961
134 HE ARG 30 HE ARG 30 5.311 4.392 0.013
135 1HH1 ARG 30 1HH1 ARG 30 8.201 2.626 0.855
136 2HH1 ARG 30 2HH1 ARG 30 8.594 3.659 2.189
137 1HH2 ARG 30 1HH2 ARG 30 5.826 5.752 1.765
138 2HH2 ARG 30 2HH2 ARG 30 7.246 5.434 2.706
139 H ARG 31 H ARG 31 5.272 -0.814 -5.125
140 HA ARG 31 HA ARG 31 6.006 -2.993 -3.550
141 1HB ARG 31 1HB ARG 31 4.794 -2.558 -6.119
142 2HB ARG 31 2HB ARG 31 5.967 -3.861 -6.245
143 1HG ARG 31 1HG ARG 31 4.860 -5.161 -4.635
144 2HG ARG 31 2HG ARG 31 3.877 -3.798 -4.094
145 1HD ARG 31 1HD ARG 31 2.347 -4.136 -5.689
146 2HD ARG 31 2HD ARG 31 3.572 -4.365 -6.935
147 HE ARG 31 HE ARG 31 3.665 -6.673 -5.512
148 1HH1 ARG 31 1HH1 ARG 31 1.098 -4.913 -7.091
149 2HH1 ARG 31 2HH1 ARG 31 0.171 -6.333 -7.440
150 1HH2 ARG 31 1HH2 ARG 31 2.446 -8.541 -5.969
151 2HH2 ARG 31 2HH2 ARG 31 0.936 -8.393 -6.803
152 H GLN 32 H GLN 32 7.658 -1.500 -6.292
153 HA GLN 32 HA GLN 32 9.766 -3.367 -6.460
154 1HB GLN 32 1HB GLN 32 9.451 -0.518 -7.368
155 2HB GLN 32 2HB GLN 32 10.973 -1.374 -7.579
156 1HG GLN 32 1HG GLN 32 8.338 -2.379 -8.622
157 2HG GLN 32 2HG GLN 32 9.457 -1.392 -9.561
158 1HE2 GLN 32 1HE2 GLN 32 10.765 -2.478 -10.829
159 2HE2 GLN 32 2HE2 GLN 32 11.306 -4.102 -10.593
160 H GLN 33 H GLN 33 9.425 -0.331 -4.682
161 HA GLN 33 HA GLN 33 12.093 -0.388 -3.652
162 1HB GLN 33 1HB GLN 33 9.651 1.246 -2.998
163 2HB GLN 33 2HB GLN 33 11.149 1.410 -2.092
164 1HG GLN 33 1HG GLN 33 12.156 2.563 -3.721
165 2HG GLN 33 2HG GLN 33 11.472 1.556 -4.996
166 1HE2 GLN 33 1HE2 GLN 33 11.146 3.513 -6.178
167 2HE2 GLN 33 2HE2 GLN 33 9.782 4.518 -5.841
168 H LEU 34 H LEU 34 8.897 -1.194 -2.321
169 HA LEU 34 HA LEU 34 9.791 -1.766 0.286
170 1HB LEU 34 1HB LEU 34 7.344 -2.225 -1.282
171 2HB LEU 34 2HB LEU 34 7.605 -3.355 0.034
172 HG LEU 34 HG LEU 34 7.779 -0.402 0.522
173 1HD1 LEU 34 1HD1 LEU 34 5.268 -2.066 0.487
174 2HD1 LEU 34 2HD1 LEU 34 5.651 -0.709 -0.573
175 3HD1 LEU 34 3HD1 LEU 34 5.402 -0.438 1.152
176 1HD2 LEU 34 1HD2 LEU 34 7.163 -1.048 2.776
177 2HD2 LEU 34 2HD2 LEU 34 8.572 -1.965 2.242
178 3HD2 LEU 34 3HD2 LEU 34 6.982 -2.727 2.267
179 H SER 35 H SER 35 9.427 -3.804 -2.573
180 HA SER 35 HA SER 35 9.980 -6.255 -1.290
181 1HB SER 35 1HB SER 35 8.940 -6.197 -3.490
182 2HB SER 35 2HB SER 35 10.373 -5.434 -4.178
183 HG SER 35 HG SER 35 11.210 -7.338 -4.391
184 H SER 36 H SER 36 12.056 -3.944 -3.002
185 HA SER 36 HA SER 36 14.443 -5.446 -2.733
186 1HB SER 36 1HB SER 36 13.935 -3.515 -4.356
187 2HB SER 36 2HB SER 36 14.355 -2.450 -3.015
188 HG SER 36 HG SER 36 16.214 -2.795 -4.151
189 H GLU 37 H GLU 37 13.129 -2.714 -0.868
190 HA GLU 37 HA GLU 37 15.311 -2.472 0.893
191 1HB GLU 37 1HB GLU 37 12.870 -1.159 0.484
192 2HB GLU 37 2HB GLU 37 12.812 -1.728 2.145
193 1HG GLU 37 1HG GLU 37 14.518 -0.380 2.816
194 2HG GLU 37 2HG GLU 37 15.286 -0.374 1.228
195 H LEU 38 H LEU 38 12.243 -4.231 1.209
196 HA LEU 38 HA LEU 38 13.028 -5.288 3.787
197 1HB LEU 38 1HB LEU 38 10.607 -5.640 2.043
198 2HB LEU 38 2HB LEU 38 10.850 -6.605 3.487
199 HG LEU 38 HG LEU 38 10.991 -3.636 3.725
200 1HD1 LEU 38 1HD1 LEU 38 8.383 -5.135 3.736
201 2HD1 LEU 38 2HD1 LEU 38 8.961 -4.192 2.362
202 3HD1 LEU 38 3HD1 LEU 38 8.635 -3.398 3.904
203 1HD2 LEU 38 1HD2 LEU 38 11.523 -5.077 5.634
204 2HD2 LEU 38 2HD2 LEU 38 9.925 -5.814 5.518
205 3HD2 LEU 38 3HD2 LEU 38 10.081 -4.106 5.931
206 H GLY 39 H GLY 39 13.282 -6.232 0.488
207 1HA GLY 39 1HA GLY 39 14.322 -8.049 -0.462
208 2HA GLY 39 2HA GLY 39 14.840 -8.517 1.150
209 H LEU 40 H LEU 40 11.479 -8.048 0.346
210 HA LEU 40 HA LEU 40 11.065 -10.939 0.691
211 1HB LEU 40 1HB LEU 40 8.607 -10.039 1.069
212 2HB LEU 40 2HB LEU 40 9.784 -10.086 2.367
213 HG LEU 40 HG LEU 40 10.298 -7.657 1.803
214 1HD1 LEU 40 1HD1 LEU 40 9.135 -7.846 -0.450
215 2HD1 LEU 40 2HD1 LEU 40 8.784 -6.410 0.512
216 3HD1 LEU 40 3HD1 LEU 40 7.620 -7.734 0.448
217 1HD2 LEU 40 1HD2 LEU 40 7.481 -7.710 2.639
218 2HD2 LEU 40 2HD2 LEU 40 8.898 -7.045 3.453
219 3HD2 LEU 40 3HD2 LEU 40 8.558 -8.773 3.545
220 H ASN 41 H ASN 41 9.213 -11.864 -0.487
221 HA ASN 41 HA ASN 41 9.299 -11.007 -3.257
222 1HB ASN 41 1HB ASN 41 9.273 -13.474 -2.128
223 2HB ASN 41 2HB ASN 41 7.562 -13.277 -2.496
224 1HD2 ASN 41 1HD2 ASN 41 7.032 -12.653 -4.721
225 2HD2 ASN 41 2HD2 ASN 41 8.007 -13.277 -6.004
226 H GLU 42 H GLU 42 7.372 -10.718 -4.532
227 HA GLU 42 HA GLU 42 5.555 -8.893 -3.508
228 1HB GLU 42 1HB GLU 42 5.072 -10.808 -5.800
229 2HB GLU 42 2HB GLU 42 4.258 -9.271 -5.537
230 1HG GLU 42 1HG GLU 42 5.771 -8.441 -6.944
231 2HG GLU 42 2HG GLU 42 6.878 -8.519 -5.575
232 H ALA 43 H ALA 43 5.488 -12.379 -3.483
233 HA ALA 43 HA ALA 43 2.770 -12.824 -2.962
234 1HB ALA 43 1HB ALA 43 3.355 -14.991 -2.386
235 2HB ALA 43 2HB ALA 43 4.878 -14.494 -1.650
236 3HB ALA 43 3HB ALA 43 4.710 -14.508 -3.406
237 H GLN 44 H GLN 44 5.445 -11.930 -0.894
238 HA GLN 44 HA GLN 44 3.936 -12.071 1.560
239 1HB GLN 44 1HB GLN 44 6.654 -11.064 0.773
240 2HB GLN 44 2HB GLN 44 5.998 -10.702 2.363
241 1HG GLN 44 1HG GLN 44 6.383 -13.472 1.247
242 2HG GLN 44 2HG GLN 44 7.490 -12.659 2.354
243 1HE2 GLN 44 1HE2 GLN 44 5.852 -11.504 4.148
244 2HE2 GLN 44 2HE2 GLN 44 4.939 -12.697 5.000
245 H ILE 45 H ILE 45 4.681 -9.792 -0.913
246 HA ILE 45 HA ILE 45 4.097 -7.390 0.430
247 HB ILE 45 HB ILE 45 4.042 -8.115 -2.497
248 1HG1 ILE 45 1HG1 ILE 45 6.224 -8.126 -1.216
249 2HG1 ILE 45 2HG1 ILE 45 6.174 -7.050 -2.609
250 1HG2 ILE 45 1HG2 ILE 45 3.848 -5.356 -1.319
251 2HG2 ILE 45 2HG2 ILE 45 2.513 -6.228 -2.067
252 3HG2 ILE 45 3HG2 ILE 45 3.915 -5.766 -3.029
253 1HD1 ILE 45 1HD1 ILE 45 7.258 -5.897 -0.859
254 2HD1 ILE 45 2HD1 ILE 45 5.985 -6.306 0.291
255 3HD1 ILE 45 3HD1 ILE 45 5.655 -5.182 -1.026
256 H LYS 46 H LYS 46 2.067 -9.650 -1.408
257 HA LYS 46 HA LYS 46 -0.258 -8.110 -1.562
258 1HB LYS 46 1HB LYS 46 0.447 -10.652 -2.316
259 2HB LYS 46 2HB LYS 46 -0.703 -10.968 -1.023
260 1HG LYS 46 1HG LYS 46 -2.034 -9.081 -2.435
261 2HG LYS 46 2HG LYS 46 -1.133 -9.892 -3.718
262 1HD LYS 46 1HD LYS 46 -2.033 -12.046 -2.998
263 2HD LYS 46 2HD LYS 46 -2.916 -11.247 -1.695
264 1HE LYS 46 1HE LYS 46 -4.260 -10.035 -3.276
265 2HE LYS 46 2HE LYS 46 -3.296 -10.640 -4.623
266 1HZ LYS 46 1HZ LYS 46 -5.403 -11.951 -3.116
267 2HZ LYS 46 2HZ LYS 46 -4.077 -12.924 -3.512
268 3HZ LYS 46 3HZ LYS 46 -4.945 -12.144 -4.734
269 H ILE 47 H ILE 47 0.808 -10.394 0.913
270 HA ILE 47 HA ILE 47 -1.387 -9.978 2.686
271 HB ILE 47 HB ILE 47 1.242 -11.341 2.781
272 1HG1 ILE 47 1HG1 ILE 47 -1.173 -12.361 4.178
273 2HG1 ILE 47 2HG1 ILE 47 -1.282 -12.189 2.429
274 1HG2 ILE 47 1HG2 ILE 47 1.550 -10.095 4.773
275 2HG2 ILE 47 2HG2 ILE 47 1.021 -11.706 5.263
276 3HG2 ILE 47 3HG2 ILE 47 -0.120 -10.362 5.280
277 1HD1 ILE 47 1HD1 ILE 47 1.177 -13.455 3.011
278 2HD1 ILE 47 2HD1 ILE 47 -0.236 -14.116 2.189
279 3HD1 ILE 47 3HD1 ILE 47 -0.086 -14.264 3.940
280 H TRP 48 H TRP 48 1.823 -8.678 2.336
281 HA TRP 48 HA TRP 48 2.067 -7.165 4.653
282 1HB TRP 48 1HB TRP 48 3.886 -7.676 3.080
283 2HB TRP 48 2HB TRP 48 3.122 -6.675 1.860
284 HD1 TRP 48 HD1 TRP 48 5.675 -6.569 4.511
285 HE1 TRP 48 HE1 TRP 48 6.509 -4.162 4.821
286 HE3 TRP 48 HE3 TRP 48 2.066 -4.067 1.916
287 HZ2 TRP 48 HZ2 TRP 48 5.761 -1.562 4.096
288 HZ3 TRP 48 HZ3 TRP 48 2.195 -1.622 1.772
289 HH2 TRP 48 HH2 TRP 48 4.012 -0.400 2.832
290 H PHE 49 H PHE 49 0.891 -6.209 1.451
291 HA PHE 49 HA PHE 49 0.183 -3.584 2.283
292 1HB PHE 49 1HB PHE 49 -0.206 -5.182 -0.196
293 2HB PHE 49 2HB PHE 49 -1.227 -3.759 0.046
294 HD1 PHE 49 HD1 PHE 49 2.187 -4.961 -0.386
295 HD2 PHE 49 HD2 PHE 49 -0.300 -1.552 0.076
296 HE1 PHE 49 HE1 PHE 49 4.082 -3.515 -0.996
297 HE2 PHE 49 HE2 PHE 49 1.595 -0.085 -0.528
298 HZ PHE 49 HZ PHE 49 3.796 -1.082 -1.043
299 H GLN 50 H GLN 50 -1.637 -6.565 1.863
300 HA GLN 50 HA GLN 50 -4.148 -5.416 2.419
301 1HB GLN 50 1HB GLN 50 -3.109 -8.241 2.542
302 2HB GLN 50 2HB GLN 50 -4.761 -7.849 2.999
303 1HG GLN 50 1HG GLN 50 -4.501 -6.622 0.560
304 2HG GLN 50 2HG GLN 50 -3.553 -8.096 0.364
305 1HE2 GLN 50 1HE2 GLN 50 -4.606 -10.124 0.847
306 2HE2 GLN 50 2HE2 GLN 50 -6.309 -10.279 0.601
307 H ASN 51 H ASN 51 -1.554 -6.633 4.426
308 HA ASN 51 HA ASN 51 -3.090 -6.760 6.839
309 1HB ASN 51 1HB ASN 51 -1.005 -8.072 6.461
310 2HB ASN 51 2HB ASN 51 -0.087 -6.570 6.516
311 1HD2 ASN 51 1HD2 ASN 51 -0.031 -8.971 8.230
312 2HD2 ASN 51 2HD2 ASN 51 -0.275 -8.390 9.839
313 H LYS 52 H LYS 52 -0.953 -4.380 5.347
314 HA LYS 52 HA LYS 52 -0.880 -2.575 7.515
315 1HB LYS 52 1HB LYS 52 0.426 -2.735 5.155
316 2HB LYS 52 2HB LYS 52 -0.726 -1.460 4.778
317 1HG LYS 52 1HG LYS 52 0.091 -0.092 6.547
318 2HG LYS 52 2HG LYS 52 1.084 -1.407 7.180
319 1HD LYS 52 1HD LYS 52 2.223 -1.371 4.869
320 2HD LYS 52 2HD LYS 52 1.469 0.214 4.685
321 1HE LYS 52 1HE LYS 52 2.866 -0.212 7.235
322 2HE LYS 52 2HE LYS 52 3.903 -0.218 5.809
323 1HZ LYS 52 1HZ LYS 52 3.872 1.989 6.113
324 2HZ LYS 52 2HZ LYS 52 2.449 1.968 7.028
325 3HZ LYS 52 3HZ LYS 52 2.368 1.921 5.339
326 H ARG 53 H ARG 53 -3.117 -3.019 4.849
327 HA ARG 53 HA ARG 53 -4.543 -0.600 5.145
328 1HB ARG 53 1HB ARG 53 -4.570 -2.452 3.258
329 2HB ARG 53 2HB ARG 53 -5.915 -3.079 4.201
330 1HG ARG 53 1HG ARG 53 -6.801 -0.637 4.062
331 2HG ARG 53 2HG ARG 53 -5.694 -0.517 2.693
332 1HD ARG 53 1HD ARG 53 -6.788 -2.604 1.785
333 2HD ARG 53 2HD ARG 53 -8.010 -2.407 3.041
334 HE ARG 53 HE ARG 53 -7.782 -0.918 0.611
335 1HH1 ARG 53 1HH1 ARG 53 -8.877 -0.762 3.921
336 2HH1 ARG 53 2HH1 ARG 53 -10.046 0.476 3.607
337 1HH2 ARG 53 1HH2 ARG 53 -9.319 0.711 0.196
338 2HH2 ARG 53 2HH2 ARG 53 -10.297 1.313 1.493
339 H ALA 54 H ALA 54 -4.662 -3.638 6.838
340 HA ALA 54 HA ALA 54 -7.211 -3.545 7.948
341 1HB ALA 54 1HB ALA 54 -5.063 -4.506 9.724
342 2HB ALA 54 2HB ALA 54 -5.143 -5.260 8.132
343 3HB ALA 54 3HB ALA 54 -6.547 -5.302 9.199
344 H LYS 55 H LYS 55 -4.321 -1.772 8.781
345 HA LYS 55 HA LYS 55 -5.293 -0.829 11.307
346 1HB LYS 55 1HB LYS 55 -2.827 -0.961 10.192
347 2HB LYS 55 2HB LYS 55 -3.207 0.733 9.912
348 1HG LYS 55 1HG LYS 55 -3.869 0.692 12.443
349 2HG LYS 55 2HG LYS 55 -2.817 -0.724 12.478
350 1HD LYS 55 1HD LYS 55 -1.219 0.829 12.867
351 2HD LYS 55 2HD LYS 55 -1.249 0.977 11.109
352 1HE LYS 55 1HE LYS 55 -3.287 2.626 12.306
353 2HE LYS 55 2HE LYS 55 -1.707 2.990 12.998
354 1HZ LYS 55 1HZ LYS 55 -2.498 3.092 10.145
355 2HZ LYS 55 2HZ LYS 55 -0.886 3.154 10.651
356 3HZ LYS 55 3HZ LYS 55 -1.966 4.368 11.120
357 H ILE 56 H ILE 56 -5.614 0.163 8.008
358 HA ILE 56 HA ILE 56 -6.871 1.790 7.027
359 HB ILE 56 HB ILE 56 -7.857 2.523 9.783
360 1HG1 ILE 56 1HG1 ILE 56 -9.210 0.607 7.888
361 2HG1 ILE 56 2HG1 ILE 56 -8.085 0.050 9.123
362 1HG2 ILE 56 1HG2 ILE 56 -8.240 3.850 7.478
363 2HG2 ILE 56 2HG2 ILE 56 -9.428 3.795 8.779
364 3HG2 ILE 56 3HG2 ILE 56 -9.582 2.709 7.399
365 1HD1 ILE 56 1HD1 ILE 56 -10.585 0.008 9.646
366 2HD1 ILE 56 2HD1 ILE 56 -10.438 1.756 9.830
367 3HD1 ILE 56 3HD1 ILE 56 -9.495 0.678 10.859
368 H LYS 57 H LYS 57 -5.440 3.225 6.249
369 HA LYS 57 HA LYS 57 -4.994 5.656 7.745
370 1HB LYS 57 1HB LYS 57 -3.072 3.688 7.977
371 2HB LYS 57 2HB LYS 57 -2.443 4.696 6.681
372 1HG LYS 57 1HG LYS 57 -3.068 6.627 8.388
373 2HG LYS 57 2HG LYS 57 -2.843 5.318 9.550
374 1HD LYS 57 1HD LYS 57 -0.623 4.872 8.420
375 2HD LYS 57 2HD LYS 57 -0.854 6.398 7.565
376 1HE LYS 57 1HE LYS 57 -1.041 6.257 10.553
377 2HE LYS 57 2HE LYS 57 0.522 6.392 9.747
378 1HZ LYS 57 1HZ LYS 57 -0.288 8.563 10.336
379 2HZ LYS 57 2HZ LYS 57 -1.745 8.297 9.520
380 3HZ LYS 57 3HZ LYS 57 -0.299 8.412 8.650
381 H LYS 58 H LYS 58 -5.796 6.991 6.239
382 HA LYS 58 HA LYS 58 -5.336 6.573 3.428
383 1HB LYS 58 1HB LYS 58 -7.187 8.027 5.018
384 2HB LYS 58 2HB LYS 58 -6.381 9.182 3.965
385 1HG LYS 58 1HG LYS 58 -7.550 8.506 2.210
386 2HG LYS 58 2HG LYS 58 -7.120 6.819 2.498
387 1HD LYS 58 1HD LYS 58 -8.934 7.230 4.471
388 2HD LYS 58 2HD LYS 58 -9.558 8.302 3.215
389 1HE LYS 58 1HE LYS 58 -9.565 6.447 1.628
390 2HE LYS 58 2HE LYS 58 -8.919 5.374 2.869
391 1HZ LYS 58 1HZ LYS 58 -11.411 6.822 3.416
392 2HZ LYS 58 2HZ LYS 58 -10.901 5.311 3.978
393 3HZ LYS 58 3HZ LYS 58 -11.466 5.476 2.393
394 H SER 59 H SER 59 -3.554 7.174 2.408
395 HA SER 59 HA SER 59 -2.274 9.704 3.134
396 1HB SER 59 1HB SER 59 -0.889 8.212 4.335
397 2HB SER 59 2HB SER 59 -0.929 7.008 3.048
398 HG SER 59 HG SER 59 0.413 9.502 3.064
Start of MODEL 11
1 1H ALA 16 1H ALA 16 -17.907 15.143 -0.635
2 2H ALA 16 2H ALA 16 -18.004 15.755 -2.236
3 3H ALA 16 3H ALA 16 -19.165 16.226 -1.063
4 HA ALA 16 HA ALA 16 -17.351 17.834 -1.636
5 1HB ALA 16 1HB ALA 16 -18.333 17.010 1.039
6 2HB ALA 16 2HB ALA 16 -18.570 18.520 0.158
7 3HB ALA 16 3HB ALA 16 -17.037 18.204 0.970
8 H LYS 17 H LYS 17 -16.123 15.133 -1.899
9 HA LYS 17 HA LYS 17 -13.648 15.555 -0.369
10 1HB LYS 17 1HB LYS 17 -13.146 13.176 -1.006
11 2HB LYS 17 2HB LYS 17 -14.546 13.380 0.039
12 1HG LYS 17 1HG LYS 17 -16.045 13.053 -1.794
13 2HG LYS 17 2HG LYS 17 -14.711 13.067 -2.949
14 1HD LYS 17 1HD LYS 17 -14.997 10.812 -2.736
15 2HD LYS 17 2HD LYS 17 -13.851 11.081 -1.421
16 1HE LYS 17 1HE LYS 17 -15.326 10.371 0.083
17 2HE LYS 17 2HE LYS 17 -16.536 11.515 -0.496
18 1HZ LYS 17 1HZ LYS 17 -17.618 9.627 -1.015
19 2HZ LYS 17 2HZ LYS 17 -16.211 8.693 -1.105
20 3HZ LYS 17 3HZ LYS 17 -16.656 9.677 -2.407
21 H ARG 18 H ARG 18 -11.744 14.392 -1.731
22 HA ARG 18 HA ARG 18 -11.773 15.654 -4.394
23 1HB ARG 18 1HB ARG 18 -10.177 16.388 -2.288
24 2HB ARG 18 2HB ARG 18 -9.139 15.264 -3.152
25 1HG ARG 18 1HG ARG 18 -10.093 16.794 -5.190
26 2HG ARG 18 2HG ARG 18 -10.007 17.964 -3.871
27 1HD ARG 18 1HD ARG 18 -7.795 16.296 -5.038
28 2HD ARG 18 2HD ARG 18 -7.911 18.053 -4.952
29 HE ARG 18 HE ARG 18 -7.923 17.276 -2.350
30 1HH1 ARG 18 1HH1 ARG 18 -5.793 16.664 -5.046
31 2HH1 ARG 18 2HH1 ARG 18 -4.382 16.499 -4.055
32 1HH2 ARG 18 1HH2 ARG 18 -6.070 17.061 -1.045
33 2HH2 ARG 18 2HH2 ARG 18 -4.540 16.725 -1.783
34 H GLU 19 H GLU 19 -10.050 14.695 -5.865
35 HA GLU 19 HA GLU 19 -10.459 11.847 -5.955
36 1HB GLU 19 1HB GLU 19 -9.238 13.889 -7.757
37 2HB GLU 19 2HB GLU 19 -8.815 12.200 -8.000
38 1HG GLU 19 1HG GLU 19 -10.670 11.922 -9.161
39 2HG GLU 19 2HG GLU 19 -11.614 12.301 -7.721
40 H PHE 20 H PHE 20 -8.476 10.472 -6.610
41 HA PHE 20 HA PHE 20 -5.945 11.185 -5.504
42 1HB PHE 20 1HB PHE 20 -6.003 9.303 -3.771
43 2HB PHE 20 2HB PHE 20 -6.871 10.780 -3.371
44 HD1 PHE 20 HD1 PHE 20 -7.524 7.536 -5.104
45 HD2 PHE 20 HD2 PHE 20 -8.941 10.535 -2.435
46 HE1 PHE 20 HE1 PHE 20 -9.573 6.225 -4.717
47 HE2 PHE 20 HE2 PHE 20 -10.989 9.229 -2.045
48 HZ PHE 20 HZ PHE 20 -11.307 7.071 -3.187
49 H ASN 21 H ASN 21 -4.712 8.863 -5.141
50 HA ASN 21 HA ASN 21 -5.019 7.540 -7.737
51 1HB ASN 21 1HB ASN 21 -2.716 7.665 -5.790
52 2HB ASN 21 2HB ASN 21 -2.720 6.649 -7.225
53 1HD2 ASN 21 1HD2 ASN 21 -2.846 9.954 -6.074
54 2HD2 ASN 21 2HD2 ASN 21 -2.259 10.682 -7.527
55 H GLU 22 H GLU 22 -6.408 5.878 -7.578
56 HA GLU 22 HA GLU 22 -6.788 4.307 -5.258
57 1HB GLU 22 1HB GLU 22 -7.842 4.414 -7.950
58 2HB GLU 22 2HB GLU 22 -7.567 2.748 -7.460
59 1HG GLU 22 1HG GLU 22 -9.033 2.922 -5.643
60 2HG GLU 22 2HG GLU 22 -9.048 4.683 -5.719
61 H ASN 23 H ASN 23 -4.600 3.809 -4.688
62 HA ASN 23 HA ASN 23 -2.798 2.443 -4.518
63 1HB ASN 23 1HB ASN 23 -4.245 0.491 -6.280
64 2HB ASN 23 2HB ASN 23 -3.046 0.160 -5.037
65 1HD2 ASN 23 1HD2 ASN 23 -3.717 0.967 -2.808
66 2HD2 ASN 23 2HD2 ASN 23 -5.345 0.631 -2.338
67 H ARG 24 H ARG 24 -1.812 4.068 -5.858
68 HA ARG 24 HA ARG 24 -0.457 2.897 -8.120
69 1HB ARG 24 1HB ARG 24 -2.015 5.469 -8.492
70 2HB ARG 24 2HB ARG 24 -0.997 4.686 -9.691
71 1HG ARG 24 1HG ARG 24 -3.451 3.404 -8.524
72 2HG ARG 24 2HG ARG 24 -3.465 4.387 -9.985
73 1HD ARG 24 1HD ARG 24 -1.950 2.870 -11.081
74 2HD ARG 24 2HD ARG 24 -1.760 1.930 -9.601
75 HE ARG 24 HE ARG 24 -4.401 1.774 -10.017
76 1HH1 ARG 24 1HH1 ARG 24 -1.694 1.261 -12.164
77 2HH1 ARG 24 2HH1 ARG 24 -2.534 0.109 -13.146
78 1HH2 ARG 24 1HH2 ARG 24 -5.502 0.258 -11.308
79 2HH2 ARG 24 2HH2 ARG 24 -4.693 -0.462 -12.660
80 H TYR 25 H TYR 25 -1.114 5.977 -6.510
81 HA TYR 25 HA TYR 25 1.198 7.346 -6.929
82 1HB TYR 25 1HB TYR 25 0.703 8.593 -4.905
83 2HB TYR 25 2HB TYR 25 -0.799 8.220 -5.744
84 HD1 TYR 25 HD1 TYR 25 -1.859 5.857 -4.947
85 HD2 TYR 25 HD2 TYR 25 0.695 8.338 -2.616
86 HE1 TYR 25 HE1 TYR 25 -2.732 4.818 -2.905
87 HE2 TYR 25 HE2 TYR 25 -0.178 7.309 -0.561
88 HH TYR 25 HH TYR 25 -2.301 4.534 -0.645
89 H LEU 26 H LEU 26 0.617 5.027 -4.295
90 HA LEU 26 HA LEU 26 3.530 4.890 -3.911
91 1HB LEU 26 1HB LEU 26 3.357 5.072 -1.673
92 2HB LEU 26 2HB LEU 26 1.878 5.913 -2.079
93 HG LEU 26 HG LEU 26 1.354 4.475 -0.282
94 1HD1 LEU 26 1HD1 LEU 26 0.286 2.563 -2.166
95 2HD1 LEU 26 2HD1 LEU 26 0.081 4.221 -2.727
96 3HD1 LEU 26 3HD1 LEU 26 -0.547 3.742 -1.153
97 1HD2 LEU 26 1HD2 LEU 26 1.983 1.886 -1.414
98 2HD2 LEU 26 2HD2 LEU 26 2.389 2.561 0.165
99 3HD2 LEU 26 3HD2 LEU 26 3.421 2.889 -1.226
100 H THR 27 H THR 27 0.612 3.164 -4.456
101 HA THR 27 HA THR 27 1.193 0.663 -3.451
102 HB THR 27 HB THR 27 -0.371 1.565 -5.851
103 HG1 THR 27 HG1 THR 27 -0.993 0.531 -3.296
104 1HG2 THR 27 1HG2 THR 27 -0.266 -0.477 -6.729
105 2HG2 THR 27 2HG2 THR 27 -1.291 -0.960 -5.377
106 3HG2 THR 27 3HG2 THR 27 0.457 -1.168 -5.276
107 H GLU 28 H GLU 28 1.280 0.952 -6.957
108 HA GLU 28 HA GLU 28 3.161 -1.033 -7.365
109 1HB GLU 28 1HB GLU 28 2.636 1.344 -9.151
110 2HB GLU 28 2HB GLU 28 3.347 -0.188 -9.641
111 1HG GLU 28 1HG GLU 28 1.238 -1.319 -9.034
112 2HG GLU 28 2HG GLU 28 0.537 0.255 -8.658
113 H ARG 29 H ARG 29 3.666 2.402 -6.804
114 HA ARG 29 HA ARG 29 6.384 2.462 -7.594
115 1HB ARG 29 1HB ARG 29 4.783 4.429 -7.263
116 2HB ARG 29 2HB ARG 29 5.150 4.294 -5.549
117 1HG ARG 29 1HG ARG 29 7.174 5.226 -5.778
118 2HG ARG 29 2HG ARG 29 7.502 4.387 -7.296
119 1HD ARG 29 1HD ARG 29 5.402 6.426 -7.463
120 2HD ARG 29 2HD ARG 29 6.996 7.057 -7.054
121 HE ARG 29 HE ARG 29 6.157 5.952 -9.573
122 1HH1 ARG 29 1HH1 ARG 29 8.890 6.623 -7.509
123 2HH1 ARG 29 2HH1 ARG 29 10.026 6.659 -8.814
124 1HH2 ARG 29 1HH2 ARG 29 7.651 6.000 -11.292
125 2HH2 ARG 29 2HH2 ARG 29 9.324 6.307 -10.962
126 H ARG 30 H ARG 30 4.870 2.204 -4.378
127 HA ARG 30 HA ARG 30 7.425 1.845 -3.095
128 1HB ARG 30 1HB ARG 30 5.178 2.868 -2.158
129 2HB ARG 30 2HB ARG 30 4.860 1.196 -1.715
130 1HG ARG 30 1HG ARG 30 6.452 1.171 -0.108
131 2HG ARG 30 2HG ARG 30 7.510 2.280 -0.982
132 1HD ARG 30 1HD ARG 30 5.361 3.869 -0.415
133 2HD ARG 30 2HD ARG 30 5.429 2.826 1.005
134 HE ARG 30 HE ARG 30 7.967 3.962 0.259
135 1HH1 ARG 30 1HH1 ARG 30 5.039 4.433 2.102
136 2HH1 ARG 30 2HH1 ARG 30 5.766 5.552 3.206
137 1HH2 ARG 30 1HH2 ARG 30 8.923 5.434 1.709
138 2HH2 ARG 30 2HH2 ARG 30 7.971 6.120 2.983
139 H ARG 31 H ARG 31 4.930 -0.215 -4.368
140 HA ARG 31 HA ARG 31 5.458 -2.562 -2.943
141 1HB ARG 31 1HB ARG 31 3.556 -2.025 -4.612
142 2HB ARG 31 2HB ARG 31 4.679 -2.583 -5.845
143 1HG ARG 31 1HG ARG 31 4.556 -4.751 -5.173
144 2HG ARG 31 2HG ARG 31 4.230 -4.325 -3.493
145 1HD ARG 31 1HD ARG 31 2.084 -4.758 -3.872
146 2HD ARG 31 2HD ARG 31 2.044 -3.356 -4.939
147 HE ARG 31 HE ARG 31 2.109 -6.140 -5.711
148 1HH1 ARG 31 1HH1 ARG 31 2.617 -2.839 -6.728
149 2HH1 ARG 31 2HH1 ARG 31 2.401 -3.195 -8.408
150 1HH2 ARG 31 1HH2 ARG 31 1.826 -6.606 -7.920
151 2HH2 ARG 31 2HH2 ARG 31 1.953 -5.332 -9.086
152 H GLN 32 H GLN 32 6.930 -1.274 -5.882
153 HA GLN 32 HA GLN 32 8.589 -3.550 -6.336
154 1HB GLN 32 1HB GLN 32 7.844 -1.681 -7.988
155 2HB GLN 32 2HB GLN 32 9.232 -0.804 -7.360
156 1HG GLN 32 1HG GLN 32 9.926 -3.515 -8.080
157 2HG GLN 32 2HG GLN 32 9.215 -2.638 -9.435
158 1HE2 GLN 32 1HE2 GLN 32 10.318 -0.960 -10.357
159 2HE2 GLN 32 2HE2 GLN 32 11.953 -0.565 -9.961
160 H GLN 33 H GLN 33 9.011 -0.466 -4.690
161 HA GLN 33 HA GLN 33 11.811 -0.832 -4.220
162 1HB GLN 33 1HB GLN 33 10.434 1.369 -4.292
163 2HB GLN 33 2HB GLN 33 10.061 1.002 -2.613
164 1HG GLN 33 1HG GLN 33 12.898 0.790 -3.207
165 2HG GLN 33 2HG GLN 33 12.245 2.396 -3.530
166 1HE2 GLN 33 1HE2 GLN 33 10.665 3.108 -1.706
167 2HE2 GLN 33 2HE2 GLN 33 11.280 2.921 -0.103
168 H LEU 34 H LEU 34 8.863 -1.497 -2.430
169 HA LEU 34 HA LEU 34 10.049 -1.993 0.075
170 1HB LEU 34 1HB LEU 34 7.449 -2.453 -1.190
171 2HB LEU 34 2HB LEU 34 7.858 -3.640 0.035
172 HG LEU 34 HG LEU 34 8.231 -0.785 0.755
173 1HD1 LEU 34 1HD1 LEU 34 5.884 -0.509 1.321
174 2HD1 LEU 34 2HD1 LEU 34 5.513 -2.077 0.603
175 3HD1 LEU 34 3HD1 LEU 34 6.086 -0.755 -0.413
176 1HD2 LEU 34 1HD2 LEU 34 8.741 -2.725 2.253
177 2HD2 LEU 34 2HD2 LEU 34 7.014 -3.083 2.275
178 3HD2 LEU 34 3HD2 LEU 34 7.605 -1.553 2.923
179 H SER 35 H SER 35 9.404 -4.089 -2.686
180 HA SER 35 HA SER 35 10.065 -6.532 -1.492
181 1HB SER 35 1HB SER 35 9.161 -5.822 -3.941
182 2HB SER 35 2HB SER 35 10.845 -6.176 -4.328
183 HG SER 35 HG SER 35 8.872 -7.883 -3.263
184 H SER 36 H SER 36 12.107 -4.354 -3.442
185 HA SER 36 HA SER 36 14.489 -5.834 -3.033
186 1HB SER 36 1HB SER 36 15.476 -3.451 -3.709
187 2HB SER 36 2HB SER 36 14.700 -4.508 -4.890
188 HG SER 36 HG SER 36 13.329 -2.495 -3.438
189 H GLU 37 H GLU 37 13.056 -3.067 -1.372
190 HA GLU 37 HA GLU 37 15.300 -2.480 0.251
191 1HB GLU 37 1HB GLU 37 13.273 -1.000 -0.255
192 2HB GLU 37 2HB GLU 37 12.443 -1.902 1.005
193 1HG GLU 37 1HG GLU 37 14.570 -1.250 2.406
194 2HG GLU 37 2HG GLU 37 14.675 0.046 1.217
195 H LEU 38 H LEU 38 12.322 -4.320 0.917
196 HA LEU 38 HA LEU 38 13.326 -5.122 3.512
197 1HB LEU 38 1HB LEU 38 10.778 -5.501 2.009
198 2HB LEU 38 2HB LEU 38 11.151 -6.602 3.321
199 HG LEU 38 HG LEU 38 11.235 -4.775 4.904
200 1HD1 LEU 38 1HD1 LEU 38 10.331 -2.510 3.848
201 2HD1 LEU 38 2HD1 LEU 38 11.187 -3.137 2.439
202 3HD1 LEU 38 3HD1 LEU 38 12.051 -2.885 3.955
203 1HD2 LEU 38 1HD2 LEU 38 8.826 -3.823 4.363
204 2HD2 LEU 38 2HD2 LEU 38 9.071 -5.494 4.877
205 3HD2 LEU 38 3HD2 LEU 38 8.850 -5.119 3.168
206 H GLY 39 H GLY 39 13.385 -6.330 0.298
207 1HA GLY 39 1HA GLY 39 14.451 -8.181 -0.561
208 2HA GLY 39 2HA GLY 39 15.017 -8.544 1.062
209 H LEU 40 H LEU 40 11.627 -8.155 0.336
210 HA LEU 40 HA LEU 40 11.252 -11.021 0.880
211 1HB LEU 40 1HB LEU 40 8.783 -10.110 1.205
212 2HB LEU 40 2HB LEU 40 9.969 -10.070 2.499
213 HG LEU 40 HG LEU 40 10.469 -7.681 1.790
214 1HD1 LEU 40 1HD1 LEU 40 9.325 -8.035 -0.459
215 2HD1 LEU 40 2HD1 LEU 40 8.977 -6.531 0.393
216 3HD1 LEU 40 3HD1 LEU 40 7.806 -7.850 0.416
217 1HD2 LEU 40 1HD2 LEU 40 9.310 -7.631 3.728
218 2HD2 LEU 40 2HD2 LEU 40 8.054 -8.717 3.131
219 3HD2 LEU 40 3HD2 LEU 40 8.027 -7.010 2.688
220 H ASN 41 H ASN 41 9.379 -12.042 -0.198
221 HA ASN 41 HA ASN 41 9.430 -11.392 -3.025
222 1HB ASN 41 1HB ASN 41 9.186 -13.772 -1.524
223 2HB ASN 41 2HB ASN 41 7.660 -13.574 -2.380
224 1HD2 ASN 41 1HD2 ASN 41 7.896 -13.010 -4.727
225 2HD2 ASN 41 2HD2 ASN 41 9.126 -13.840 -5.612
226 H GLU 42 H GLU 42 7.503 -11.147 -4.288
227 HA GLU 42 HA GLU 42 5.693 -9.272 -3.375
228 1HB GLU 42 1HB GLU 42 5.248 -11.363 -5.517
229 2HB GLU 42 2HB GLU 42 4.320 -9.880 -5.331
230 1HG GLU 42 1HG GLU 42 7.271 -10.009 -5.915
231 2HG GLU 42 2HG GLU 42 6.007 -9.747 -7.117
232 H ALA 43 H ALA 43 5.653 -12.739 -3.063
233 HA ALA 43 HA ALA 43 2.949 -13.170 -2.465
234 1HB ALA 43 1HB ALA 43 3.574 -15.286 -1.968
235 2HB ALA 43 2HB ALA 43 4.891 -14.761 -0.918
236 3HB ALA 43 3HB ALA 43 5.112 -14.780 -2.667
237 H GLN 44 H GLN 44 5.626 -12.029 -0.522
238 HA GLN 44 HA GLN 44 4.133 -11.991 1.953
239 1HB GLN 44 1HB GLN 44 6.819 -10.920 1.099
240 2HB GLN 44 2HB GLN 44 6.152 -10.587 2.691
241 1HG GLN 44 1HG GLN 44 6.072 -13.410 2.061
242 2HG GLN 44 2HG GLN 44 7.705 -12.754 1.961
243 1HE2 GLN 44 1HE2 GLN 44 5.103 -11.687 4.077
244 2HE2 GLN 44 2HE2 GLN 44 5.887 -12.107 5.557
245 H ILE 45 H ILE 45 4.846 -9.928 -0.712
246 HA ILE 45 HA ILE 45 4.214 -7.421 0.402
247 HB ILE 45 HB ILE 45 4.192 -8.427 -2.442
248 1HG1 ILE 45 1HG1 ILE 45 6.368 -8.345 -1.208
249 2HG1 ILE 45 2HG1 ILE 45 6.318 -7.308 -2.632
250 1HG2 ILE 45 1HG2 ILE 45 3.826 -6.302 -3.282
251 2HG2 ILE 45 2HG2 ILE 45 4.201 -5.522 -1.748
252 3HG2 ILE 45 3HG2 ILE 45 2.682 -6.390 -1.945
253 1HD1 ILE 45 1HD1 ILE 45 7.390 -6.100 -0.917
254 2HD1 ILE 45 2HD1 ILE 45 6.122 -6.486 0.246
255 3HD1 ILE 45 3HD1 ILE 45 5.781 -5.402 -1.101
256 H LYS 46 H LYS 46 2.240 -9.878 -1.231
257 HA LYS 46 HA LYS 46 -0.109 -8.380 -1.513
258 1HB LYS 46 1HB LYS 46 0.603 -10.879 -2.219
259 2HB LYS 46 2HB LYS 46 -0.380 -11.251 -0.810
260 1HG LYS 46 1HG LYS 46 -1.577 -9.346 -2.698
261 2HG LYS 46 2HG LYS 46 -1.341 -10.981 -3.317
262 1HD LYS 46 1HD LYS 46 -2.537 -11.869 -1.352
263 2HD LYS 46 2HD LYS 46 -2.818 -10.216 -0.799
264 1HE LYS 46 1HE LYS 46 -4.467 -9.864 -2.287
265 2HE LYS 46 2HE LYS 46 -3.633 -10.743 -3.569
266 1HZ LYS 46 1HZ LYS 46 -5.556 -11.702 -1.608
267 2HZ LYS 46 2HZ LYS 46 -4.281 -12.752 -1.973
268 3HZ LYS 46 3HZ LYS 46 -5.298 -12.198 -3.205
269 H ILE 47 H ILE 47 0.949 -10.524 1.094
270 HA ILE 47 HA ILE 47 -1.264 -10.015 2.812
271 HB ILE 47 HB ILE 47 1.362 -11.380 3.029
272 1HG1 ILE 47 1HG1 ILE 47 -1.038 -12.408 4.405
273 2HG1 ILE 47 2HG1 ILE 47 -1.206 -12.199 2.665
274 1HG2 ILE 47 1HG2 ILE 47 1.076 -11.657 5.502
275 2HG2 ILE 47 2HG2 ILE 47 -0.105 -10.350 5.448
276 3HG2 ILE 47 3HG2 ILE 47 1.571 -10.043 4.990
277 1HD1 ILE 47 1HD1 ILE 47 0.060 -13.974 2.228
278 2HD1 ILE 47 2HD1 ILE 47 -0.171 -14.392 3.925
279 3HD1 ILE 47 3HD1 ILE 47 1.274 -13.516 3.422
280 H TRP 48 H TRP 48 1.994 -8.765 2.531
281 HA TRP 48 HA TRP 48 2.097 -7.128 4.784
282 1HB TRP 48 1HB TRP 48 4.037 -7.761 3.428
283 2HB TRP 48 2HB TRP 48 3.404 -6.852 2.068
284 HD1 TRP 48 HD1 TRP 48 5.732 -6.568 4.902
285 HE1 TRP 48 HE1 TRP 48 6.566 -4.150 5.115
286 HE3 TRP 48 HE3 TRP 48 2.372 -4.221 1.864
287 HZ2 TRP 48 HZ2 TRP 48 5.909 -1.601 4.163
288 HZ3 TRP 48 HZ3 TRP 48 2.540 -1.793 1.570
289 HH2 TRP 48 HH2 TRP 48 4.280 -0.514 2.687
290 H PHE 49 H PHE 49 1.206 -6.342 1.446
291 HA PHE 49 HA PHE 49 0.509 -3.657 2.059
292 1HB PHE 49 1HB PHE 49 0.279 -5.400 -0.338
293 2HB PHE 49 2HB PHE 49 -0.736 -3.955 -0.267
294 HD1 PHE 49 HD1 PHE 49 2.696 -5.211 -0.330
295 HD2 PHE 49 HD2 PHE 49 0.211 -1.765 -0.336
296 HE1 PHE 49 HE1 PHE 49 4.650 -3.821 -0.871
297 HE2 PHE 49 HE2 PHE 49 2.165 -0.358 -0.891
298 HZ PHE 49 HZ PHE 49 4.393 -1.399 -1.129
299 H GLN 50 H GLN 50 -1.353 -6.618 1.686
300 HA GLN 50 HA GLN 50 -3.872 -5.407 1.945
301 1HB GLN 50 1HB GLN 50 -2.882 -8.212 2.413
302 2HB GLN 50 2HB GLN 50 -4.556 -7.773 2.722
303 1HG GLN 50 1HG GLN 50 -3.726 -6.852 0.125
304 2HG GLN 50 2HG GLN 50 -3.429 -8.580 0.306
305 1HE2 GLN 50 1HE2 GLN 50 -5.453 -9.459 1.803
306 2HE2 GLN 50 2HE2 GLN 50 -6.972 -9.184 1.027
307 H ASN 51 H ASN 51 -1.467 -6.430 4.275
308 HA ASN 51 HA ASN 51 -3.151 -6.389 6.562
309 1HB ASN 51 1HB ASN 51 -0.233 -6.502 6.044
310 2HB ASN 51 2HB ASN 51 -0.721 -5.889 7.621
311 1HD2 ASN 51 1HD2 ASN 51 -2.893 -7.375 8.223
312 2HD2 ASN 51 2HD2 ASN 51 -2.466 -9.045 8.345
313 H LYS 52 H LYS 52 -1.185 -3.965 4.938
314 HA LYS 52 HA LYS 52 -1.266 -1.955 6.875
315 1HB LYS 52 1HB LYS 52 -0.484 -2.203 4.126
316 2HB LYS 52 2HB LYS 52 -1.388 -0.710 4.335
317 1HG LYS 52 1HG LYS 52 0.139 0.127 5.904
318 2HG LYS 52 2HG LYS 52 0.876 -1.457 6.155
319 1HD LYS 52 1HD LYS 52 2.425 -0.848 4.671
320 2HD LYS 52 2HD LYS 52 1.173 -0.990 3.435
321 1HE LYS 52 1HE LYS 52 1.631 1.523 5.024
322 2HE LYS 52 2HE LYS 52 2.446 1.196 3.496
323 1HZ LYS 52 1HZ LYS 52 0.376 1.153 2.364
324 2HZ LYS 52 2HZ LYS 52 0.388 2.555 3.310
325 3HZ LYS 52 3HZ LYS 52 -0.504 1.208 3.809
326 H ARG 53 H ARG 53 -3.618 -2.898 4.442
327 HA ARG 53 HA ARG 53 -5.392 -0.727 5.316
328 1HB ARG 53 1HB ARG 53 -5.166 -2.341 2.817
329 2HB ARG 53 2HB ARG 53 -6.741 -1.695 3.258
330 1HG ARG 53 1HG ARG 53 -4.227 -0.082 2.870
331 2HG ARG 53 2HG ARG 53 -5.559 -0.221 1.719
332 1HD ARG 53 1HD ARG 53 -7.058 0.677 3.548
333 2HD ARG 53 2HD ARG 53 -5.588 1.053 4.446
334 HE ARG 53 HE ARG 53 -6.641 2.461 2.173
335 1HH1 ARG 53 1HH1 ARG 53 -3.765 1.750 4.017
336 2HH1 ARG 53 2HH1 ARG 53 -2.933 3.181 3.507
337 1HH2 ARG 53 1HH2 ARG 53 -5.549 4.343 1.502
338 2HH2 ARG 53 2HH2 ARG 53 -3.946 4.654 2.080
339 H ALA 54 H ALA 54 -4.795 -3.513 6.551
340 HA ALA 54 HA ALA 54 -7.162 -5.037 6.381
341 1HB ALA 54 1HB ALA 54 -5.657 -5.162 8.911
342 2HB ALA 54 2HB ALA 54 -4.726 -5.475 7.446
343 3HB ALA 54 3HB ALA 54 -6.147 -6.453 7.813
344 H LYS 55 H LYS 55 -6.252 -2.283 8.321
345 HA LYS 55 HA LYS 55 -8.341 -2.525 10.243
346 1HB LYS 55 1HB LYS 55 -6.127 -0.782 9.754
347 2HB LYS 55 2HB LYS 55 -7.568 0.199 9.978
348 1HG LYS 55 1HG LYS 55 -6.616 -1.926 11.887
349 2HG LYS 55 2HG LYS 55 -6.334 -0.193 12.068
350 1HD LYS 55 1HD LYS 55 -9.132 -1.116 11.679
351 2HD LYS 55 2HD LYS 55 -8.373 -1.419 13.243
352 1HE LYS 55 1HE LYS 55 -8.617 1.262 11.880
353 2HE LYS 55 2HE LYS 55 -9.597 0.699 13.234
354 1HZ LYS 55 1HZ LYS 55 -8.040 1.788 14.414
355 2HZ LYS 55 2HZ LYS 55 -6.864 1.678 13.203
356 3HZ LYS 55 3HZ LYS 55 -7.154 0.359 14.221
357 H ILE 56 H ILE 56 -8.038 -0.966 7.116
358 HA ILE 56 HA ILE 56 -9.582 -0.056 5.711
359 HB ILE 56 HB ILE 56 -11.698 -1.135 7.570
360 1HG1 ILE 56 1HG1 ILE 56 -10.537 -2.555 5.172
361 2HG1 ILE 56 2HG1 ILE 56 -9.956 -2.834 6.810
362 1HG2 ILE 56 1HG2 ILE 56 -12.844 0.171 6.084
363 2HG2 ILE 56 2HG2 ILE 56 -12.802 -1.348 5.188
364 3HG2 ILE 56 3HG2 ILE 56 -11.662 -0.060 4.797
365 1HD1 ILE 56 1HD1 ILE 56 -11.473 -4.548 6.462
366 2HD1 ILE 56 2HD1 ILE 56 -12.613 -3.500 5.618
367 3HD1 ILE 56 3HD1 ILE 56 -12.408 -3.355 7.364
368 H LYS 57 H LYS 57 -9.202 2.097 5.994
369 HA LYS 57 HA LYS 57 -10.886 3.477 7.980
370 1HB LYS 57 1HB LYS 57 -8.024 3.780 7.311
371 2HB LYS 57 2HB LYS 57 -8.918 5.280 7.517
372 1HG LYS 57 1HG LYS 57 -9.141 3.132 9.575
373 2HG LYS 57 2HG LYS 57 -7.724 4.184 9.545
374 1HD LYS 57 1HD LYS 57 -9.223 6.147 9.648
375 2HD LYS 57 2HD LYS 57 -10.604 5.056 9.770
376 1HE LYS 57 1HE LYS 57 -10.322 4.964 11.970
377 2HE LYS 57 2HE LYS 57 -8.723 4.262 11.729
378 1HZ LYS 57 1HZ LYS 57 -8.916 7.144 11.404
379 2HZ LYS 57 2HZ LYS 57 -7.709 6.215 12.139
380 3HZ LYS 57 3HZ LYS 57 -9.135 6.564 12.978
381 H LYS 58 H LYS 58 -12.043 5.235 7.317
382 HA LYS 58 HA LYS 58 -12.502 5.498 4.499
383 1HB LYS 58 1HB LYS 58 -14.123 5.798 6.585
384 2HB LYS 58 2HB LYS 58 -13.606 7.473 6.438
385 1HG LYS 58 1HG LYS 58 -14.224 6.895 3.863
386 2HG LYS 58 2HG LYS 58 -15.383 5.885 4.731
387 1HD LYS 58 1HD LYS 58 -14.977 8.795 5.372
388 2HD LYS 58 2HD LYS 58 -16.127 8.247 4.152
389 1HE LYS 58 1HE LYS 58 -17.439 7.119 5.735
390 2HE LYS 58 2HE LYS 58 -16.161 7.160 6.948
391 1HZ LYS 58 1HZ LYS 58 -18.010 9.285 6.125
392 2HZ LYS 58 2HZ LYS 58 -16.481 9.719 6.702
393 3HZ LYS 58 3HZ LYS 58 -17.528 8.821 7.680
394 H SER 59 H SER 59 -12.403 7.518 3.319
395 HA SER 59 HA SER 59 -10.596 9.551 4.371
396 1HB SER 59 1HB SER 59 -10.056 8.049 1.798
397 2HB SER 59 2HB SER 59 -9.173 9.473 2.347
398 HG SER 59 HG SER 59 -9.152 6.858 3.357
Start of MODEL 12
1 1H ALA 16 1H ALA 16 -11.669 8.812 -16.214
2 2H ALA 16 2H ALA 16 -10.292 9.205 -15.267
3 3H ALA 16 3H ALA 16 -11.600 10.311 -15.385
4 HA ALA 16 HA ALA 16 -12.988 8.456 -14.428
5 1HB ALA 16 1HB ALA 16 -10.808 6.964 -14.727
6 2HB ALA 16 2HB ALA 16 -11.981 6.675 -13.443
7 3HB ALA 16 3HB ALA 16 -10.497 7.561 -13.096
8 H LYS 17 H LYS 17 -13.891 9.992 -13.197
9 HA LYS 17 HA LYS 17 -12.238 11.178 -11.063
10 1HB LYS 17 1HB LYS 17 -13.160 12.675 -13.007
11 2HB LYS 17 2HB LYS 17 -14.676 12.557 -12.126
12 1HG LYS 17 1HG LYS 17 -13.638 14.550 -11.417
13 2HG LYS 17 2HG LYS 17 -13.438 13.392 -10.101
14 1HD LYS 17 1HD LYS 17 -11.308 14.213 -10.217
15 2HD LYS 17 2HD LYS 17 -11.175 12.882 -11.368
16 1HE LYS 17 1HE LYS 17 -10.236 14.617 -12.558
17 2HE LYS 17 2HE LYS 17 -11.911 14.677 -13.106
18 1HZ LYS 17 1HZ LYS 17 -11.977 16.770 -12.435
19 2HZ LYS 17 2HZ LYS 17 -10.413 16.673 -11.798
20 3HZ LYS 17 3HZ LYS 17 -11.744 16.268 -10.836
21 H ARG 18 H ARG 18 -12.761 10.032 -9.296
22 HA ARG 18 HA ARG 18 -15.288 10.350 -8.084
23 1HB ARG 18 1HB ARG 18 -15.727 8.574 -9.890
24 2HB ARG 18 2HB ARG 18 -14.764 7.497 -8.888
25 1HG ARG 18 1HG ARG 18 -16.743 6.976 -7.977
26 2HG ARG 18 2HG ARG 18 -16.498 8.461 -7.054
27 1HD ARG 18 1HD ARG 18 -18.000 9.656 -8.320
28 2HD ARG 18 2HD ARG 18 -17.796 8.621 -9.732
29 HE ARG 18 HE ARG 18 -19.470 7.275 -8.943
30 1HH1 ARG 18 1HH1 ARG 18 -18.375 9.343 -6.353
31 2HH1 ARG 18 2HH1 ARG 18 -19.639 8.868 -5.271
32 1HH2 ARG 18 1HH2 ARG 18 -21.135 6.649 -7.520
33 2HH2 ARG 18 2HH2 ARG 18 -21.205 7.337 -5.931
34 H GLU 19 H GLU 19 -12.850 7.741 -8.187
35 HA GLU 19 HA GLU 19 -12.159 8.393 -5.404
36 1HB GLU 19 1HB GLU 19 -12.587 5.620 -6.532
37 2HB GLU 19 2HB GLU 19 -11.949 5.970 -4.931
38 1HG GLU 19 1HG GLU 19 -14.162 7.313 -4.648
39 2HG GLU 19 2HG GLU 19 -14.718 6.303 -5.983
40 H PHE 20 H PHE 20 -10.036 7.563 -4.740
41 HA PHE 20 HA PHE 20 -8.067 8.107 -6.731
42 1HB PHE 20 1HB PHE 20 -6.446 7.545 -4.908
43 2HB PHE 20 2HB PHE 20 -7.630 8.766 -4.453
44 HD1 PHE 20 HD1 PHE 20 -7.141 5.070 -4.319
45 HD2 PHE 20 HD2 PHE 20 -8.689 8.554 -2.428
46 HE1 PHE 20 HE1 PHE 20 -7.764 3.723 -2.358
47 HE2 PHE 20 HE2 PHE 20 -9.314 7.212 -0.462
48 HZ PHE 20 HZ PHE 20 -8.854 4.793 -0.426
49 H ASN 21 H ASN 21 -6.026 6.467 -6.504
50 HA ASN 21 HA ASN 21 -6.955 4.045 -7.790
51 1HB ASN 21 1HB ASN 21 -4.526 5.620 -7.757
52 2HB ASN 21 2HB ASN 21 -4.175 3.912 -7.522
53 1HD2 ASN 21 1HD2 ASN 21 -3.980 5.987 -9.800
54 2HD2 ASN 21 2HD2 ASN 21 -4.581 5.115 -11.166
55 H GLU 22 H GLU 22 -7.067 2.079 -6.896
56 HA GLU 22 HA GLU 22 -6.249 1.803 -4.101
57 1HB GLU 22 1HB GLU 22 -8.381 0.699 -5.763
58 2HB GLU 22 2HB GLU 22 -7.567 -0.529 -4.804
59 1HG GLU 22 1HG GLU 22 -7.917 1.313 -2.909
60 2HG GLU 22 2HG GLU 22 -9.275 1.724 -3.954
61 H ASN 23 H ASN 23 -4.305 0.971 -3.731
62 HA ASN 23 HA ASN 23 -2.411 -0.279 -3.915
63 1HB ASN 23 1HB ASN 23 -4.461 -2.141 -5.063
64 2HB ASN 23 2HB ASN 23 -2.771 -2.605 -4.928
65 1HD2 ASN 23 1HD2 ASN 23 -5.272 -1.083 -2.919
66 2HD2 ASN 23 2HD2 ASN 23 -4.921 -1.993 -1.493
67 H ARG 24 H ARG 24 -2.914 1.608 -5.870
68 HA ARG 24 HA ARG 24 -1.302 0.559 -8.079
69 1HB ARG 24 1HB ARG 24 -3.721 2.328 -8.494
70 2HB ARG 24 2HB ARG 24 -2.699 1.620 -9.743
71 1HG ARG 24 1HG ARG 24 -3.544 -0.572 -8.313
72 2HG ARG 24 2HG ARG 24 -4.955 0.486 -8.305
73 1HD ARG 24 1HD ARG 24 -3.952 0.588 -10.915
74 2HD ARG 24 2HD ARG 24 -3.868 -1.107 -10.444
75 HE ARG 24 HE ARG 24 -6.224 -1.088 -10.097
76 1HH1 ARG 24 1HH1 ARG 24 -4.998 1.843 -11.562
77 2HH1 ARG 24 2HH1 ARG 24 -6.543 2.323 -12.175
78 1HH2 ARG 24 1HH2 ARG 24 -8.248 -0.446 -10.903
79 2HH2 ARG 24 2HH2 ARG 24 -8.384 1.028 -11.800
80 H TYR 25 H TYR 25 -2.706 3.393 -6.536
81 HA TYR 25 HA TYR 25 -1.223 5.415 -7.673
82 1HB TYR 25 1HB TYR 25 -1.773 6.729 -5.700
83 2HB TYR 25 2HB TYR 25 -3.156 5.743 -6.164
84 HD1 TYR 25 HD1 TYR 25 -3.232 3.363 -4.949
85 HD2 TYR 25 HD2 TYR 25 -1.200 6.792 -3.457
86 HE1 TYR 25 HE1 TYR 25 -3.319 2.421 -2.684
87 HE2 TYR 25 HE2 TYR 25 -1.288 5.860 -1.184
88 HH TYR 25 HH TYR 25 -1.470 3.386 -0.214
89 H LEU 26 H LEU 26 -0.443 3.525 -4.766
90 HA LEU 26 HA LEU 26 2.336 4.470 -5.008
91 1HB LEU 26 1HB LEU 26 1.846 5.515 -3.067
92 2HB LEU 26 2HB LEU 26 0.469 4.486 -2.742
93 HG LEU 26 HG LEU 26 3.270 3.484 -2.327
94 1HD1 LEU 26 1HD1 LEU 26 3.501 5.176 -0.853
95 2HD1 LEU 26 2HD1 LEU 26 2.511 4.128 0.164
96 3HD1 LEU 26 3HD1 LEU 26 1.763 5.451 -0.729
97 1HD2 LEU 26 1HD2 LEU 26 1.611 2.432 -0.411
98 2HD2 LEU 26 2HD2 LEU 26 2.064 1.641 -1.921
99 3HD2 LEU 26 3HD2 LEU 26 0.551 2.544 -1.817
100 H THR 27 H THR 27 0.212 1.857 -3.947
101 HA THR 27 HA THR 27 1.914 -0.042 -3.060
102 HB THR 27 HB THR 27 -0.606 -0.143 -4.623
103 HG1 THR 27 HG1 THR 27 -1.215 -1.319 -2.728
104 1HG2 THR 27 1HG2 THR 27 -0.547 -2.698 -4.185
105 2HG2 THR 27 2HG2 THR 27 1.201 -2.488 -4.301
106 3HG2 THR 27 3HG2 THR 27 0.166 -2.040 -5.657
107 H GLU 28 H GLU 28 1.191 0.520 -6.507
108 HA GLU 28 HA GLU 28 2.856 -1.492 -7.520
109 1HB GLU 28 1HB GLU 28 1.560 0.940 -8.620
110 2HB GLU 28 2HB GLU 28 2.872 0.241 -9.559
111 1HG GLU 28 1HG GLU 28 0.402 -1.218 -8.647
112 2HG GLU 28 2HG GLU 28 0.682 -0.580 -10.267
113 H ARG 29 H ARG 29 3.518 2.007 -7.233
114 HA ARG 29 HA ARG 29 6.189 1.822 -8.132
115 1HB ARG 29 1HB ARG 29 4.498 3.884 -6.848
116 2HB ARG 29 2HB ARG 29 6.235 4.083 -6.656
117 1HG ARG 29 1HG ARG 29 6.131 3.595 -9.289
118 2HG ARG 29 2HG ARG 29 4.549 4.344 -9.058
119 1HD ARG 29 1HD ARG 29 6.073 6.088 -9.589
120 2HD ARG 29 2HD ARG 29 5.719 6.216 -7.866
121 HE ARG 29 HE ARG 29 8.070 4.670 -8.454
122 1HH1 ARG 29 1HH1 ARG 29 6.824 7.882 -7.897
123 2HH1 ARG 29 2HH1 ARG 29 8.350 8.521 -7.388
124 1HH2 ARG 29 1HH2 ARG 29 10.078 5.510 -7.785
125 2HH2 ARG 29 2HH2 ARG 29 10.198 7.175 -7.325
126 H ARG 30 H ARG 30 4.767 1.806 -4.901
127 HA ARG 30 HA ARG 30 7.279 1.763 -3.542
128 1HB ARG 30 1HB ARG 30 4.752 2.354 -2.781
129 2HB ARG 30 2HB ARG 30 4.895 0.723 -2.141
130 1HG ARG 30 1HG ARG 30 5.748 1.758 -0.350
131 2HG ARG 30 2HG ARG 30 7.231 1.799 -1.305
132 1HD ARG 30 1HD ARG 30 5.158 3.988 -1.227
133 2HD ARG 30 2HD ARG 30 6.661 3.987 -0.305
134 HE ARG 30 HE ARG 30 7.528 3.671 -2.833
135 1HH1 ARG 30 1HH1 ARG 30 5.327 5.956 -1.376
136 2HH1 ARG 30 2HH1 ARG 30 5.705 7.222 -2.493
137 1HH2 ARG 30 1HH2 ARG 30 8.027 5.337 -4.302
138 2HH2 ARG 30 2HH2 ARG 30 7.239 6.872 -4.154
139 H ARG 31 H ARG 31 5.246 -0.653 -4.955
140 HA ARG 31 HA ARG 31 5.923 -2.879 -3.422
141 1HB ARG 31 1HB ARG 31 4.663 -2.372 -5.968
142 2HB ARG 31 2HB ARG 31 5.724 -3.767 -6.090
143 1HG ARG 31 1HG ARG 31 4.482 -5.017 -4.644
144 2HG ARG 31 2HG ARG 31 3.873 -3.609 -3.772
145 1HD ARG 31 1HD ARG 31 2.018 -4.415 -4.948
146 2HD ARG 31 2HD ARG 31 2.597 -3.059 -5.917
147 HE ARG 31 HE ARG 31 3.859 -5.163 -7.031
148 1HH1 ARG 31 1HH1 ARG 31 0.512 -4.573 -6.233
149 2HH1 ARG 31 2HH1 ARG 31 -0.097 -5.560 -7.518
150 1HH2 ARG 31 1HH2 ARG 31 3.058 -6.461 -8.721
151 2HH2 ARG 31 2HH2 ARG 31 1.347 -6.633 -8.930
152 H GLN 32 H GLN 32 7.558 -1.433 -6.197
153 HA GLN 32 HA GLN 32 9.561 -3.420 -6.441
154 1HB GLN 32 1HB GLN 32 9.062 -0.726 -7.538
155 2HB GLN 32 2HB GLN 32 10.753 -1.204 -7.473
156 1HG GLN 32 1HG GLN 32 9.464 -3.423 -8.512
157 2HG GLN 32 2HG GLN 32 8.653 -2.052 -9.269
158 1HE2 GLN 32 1HE2 GLN 32 10.648 -0.245 -9.540
159 2HE2 GLN 32 2HE2 GLN 32 11.868 -0.852 -10.603
160 H GLN 33 H GLN 33 9.410 -0.360 -4.682
161 HA GLN 33 HA GLN 33 12.117 -0.505 -3.771
162 1HB GLN 33 1HB GLN 33 9.847 1.167 -2.684
163 2HB GLN 33 2HB GLN 33 11.563 1.428 -2.406
164 1HG GLN 33 1HG GLN 33 10.927 1.340 -5.229
165 2HG GLN 33 2HG GLN 33 10.009 2.581 -4.378
166 1HE2 GLN 33 1HE2 GLN 33 11.311 3.989 -5.786
167 2HE2 GLN 33 2HE2 GLN 33 12.872 4.481 -5.236
168 H LEU 34 H LEU 34 8.958 -1.220 -2.310
169 HA LEU 34 HA LEU 34 9.949 -1.808 0.263
170 1HB LEU 34 1HB LEU 34 7.425 -2.212 -1.197
171 2HB LEU 34 2HB LEU 34 7.720 -3.351 0.101
172 HG LEU 34 HG LEU 34 8.010 -0.420 0.625
173 1HD1 LEU 34 1HD1 LEU 34 5.585 -0.528 1.392
174 2HD1 LEU 34 2HD1 LEU 34 5.446 -1.954 0.363
175 3HD1 LEU 34 3HD1 LEU 34 5.880 -0.396 -0.342
176 1HD2 LEU 34 1HD2 LEU 34 8.744 -1.813 2.391
177 2HD2 LEU 34 2HD2 LEU 34 7.328 -2.855 2.253
178 3HD2 LEU 34 3HD2 LEU 34 7.156 -1.210 2.863
179 H SER 35 H SER 35 9.439 -3.797 -2.597
180 HA SER 35 HA SER 35 9.982 -6.285 -1.389
181 1HB SER 35 1HB SER 35 10.263 -7.130 -3.654
182 2HB SER 35 2HB SER 35 8.895 -6.019 -3.609
183 HG SER 35 HG SER 35 11.412 -5.707 -4.785
184 H SER 36 H SER 36 12.067 -4.099 -3.279
185 HA SER 36 HA SER 36 14.424 -5.634 -2.918
186 1HB SER 36 1HB SER 36 13.778 -3.641 -4.593
187 2HB SER 36 2HB SER 36 14.658 -2.709 -3.382
188 HG SER 36 HG SER 36 15.644 -5.026 -4.696
189 H GLU 37 H GLU 37 13.031 -2.896 -1.178
190 HA GLU 37 HA GLU 37 15.265 -2.402 0.483
191 1HB GLU 37 1HB GLU 37 13.361 -0.820 0.049
192 2HB GLU 37 2HB GLU 37 12.376 -1.807 1.119
193 1HG GLU 37 1HG GLU 37 13.412 -1.065 2.989
194 2HG GLU 37 2HG GLU 37 14.966 -0.860 2.181
195 H LEU 38 H LEU 38 12.267 -4.238 1.045
196 HA LEU 38 HA LEU 38 13.223 -5.130 3.628
197 1HB LEU 38 1HB LEU 38 10.708 -5.574 2.053
198 2HB LEU 38 2HB LEU 38 11.058 -6.537 3.476
199 HG LEU 38 HG LEU 38 11.072 -4.559 4.874
200 1HD1 LEU 38 1HD1 LEU 38 10.518 -2.356 3.965
201 2HD1 LEU 38 2HD1 LEU 38 10.543 -3.025 2.333
202 3HD1 LEU 38 3HD1 LEU 38 12.023 -2.979 3.288
203 1HD2 LEU 38 1HD2 LEU 38 8.732 -5.074 3.104
204 2HD2 LEU 38 2HD2 LEU 38 8.668 -3.725 4.238
205 3HD2 LEU 38 3HD2 LEU 38 8.926 -5.366 4.833
206 H GLY 39 H GLY 39 13.313 -6.247 0.376
207 1HA GLY 39 1HA GLY 39 14.368 -8.082 -0.527
208 2HA GLY 39 2HA GLY 39 14.940 -8.477 1.087
209 H LEU 40 H LEU 40 11.545 -8.082 0.399
210 HA LEU 40 HA LEU 40 11.185 -10.962 0.872
211 1HB LEU 40 1HB LEU 40 8.717 -10.073 1.243
212 2HB LEU 40 2HB LEU 40 9.914 -10.053 2.524
213 HG LEU 40 HG LEU 40 10.389 -7.654 1.914
214 1HD1 LEU 40 1HD1 LEU 40 9.384 -7.873 -0.381
215 2HD1 LEU 40 2HD1 LEU 40 8.881 -6.454 0.536
216 3HD1 LEU 40 3HD1 LEU 40 7.800 -7.841 0.395
217 1HD2 LEU 40 1HD2 LEU 40 7.912 -7.011 2.738
218 2HD2 LEU 40 2HD2 LEU 40 9.159 -7.654 3.807
219 3HD2 LEU 40 3HD2 LEU 40 7.931 -8.728 3.138
220 H ASN 41 H ASN 41 9.293 -11.956 -0.217
221 HA ASN 41 HA ASN 41 9.356 -11.276 -3.032
222 1HB ASN 41 1HB ASN 41 9.157 -13.662 -1.629
223 2HB ASN 41 2HB ASN 41 7.535 -13.428 -2.273
224 1HD2 ASN 41 1HD2 ASN 41 7.461 -12.832 -4.622
225 2HD2 ASN 41 2HD2 ASN 41 8.556 -13.657 -5.674
226 H GLU 42 H GLU 42 7.504 -10.871 -4.304
227 HA GLU 42 HA GLU 42 5.698 -9.013 -3.322
228 1HB GLU 42 1HB GLU 42 5.273 -10.911 -5.641
229 2HB GLU 42 2HB GLU 42 4.433 -9.385 -5.386
230 1HG GLU 42 1HG GLU 42 6.096 -8.191 -6.266
231 2HG GLU 42 2HG GLU 42 7.332 -9.108 -5.406
232 H ALA 43 H ALA 43 5.561 -12.495 -3.306
233 HA ALA 43 HA ALA 43 2.820 -12.887 -2.867
234 1HB ALA 43 1HB ALA 43 3.345 -15.063 -2.438
235 2HB ALA 43 2HB ALA 43 4.720 -14.643 -1.417
236 3HB ALA 43 3HB ALA 43 4.870 -14.568 -3.173
237 H GLN 44 H GLN 44 5.433 -11.985 -0.736
238 HA GLN 44 HA GLN 44 3.848 -12.116 1.678
239 1HB GLN 44 1HB GLN 44 6.602 -11.128 0.985
240 2HB GLN 44 2HB GLN 44 5.892 -10.782 2.556
241 1HG GLN 44 1HG GLN 44 6.313 -13.537 1.422
242 2HG GLN 44 2HG GLN 44 7.373 -12.740 2.583
243 1HE2 GLN 44 1HE2 GLN 44 5.734 -11.633 4.358
244 2HE2 GLN 44 2HE2 GLN 44 4.759 -12.822 5.145
245 H ILE 45 H ILE 45 4.704 -9.861 -0.781
246 HA ILE 45 HA ILE 45 4.113 -7.441 0.526
247 HB ILE 45 HB ILE 45 4.142 -8.192 -2.396
248 1HG1 ILE 45 1HG1 ILE 45 6.280 -8.210 -1.042
249 2HG1 ILE 45 2HG1 ILE 45 6.286 -7.151 -2.450
250 1HG2 ILE 45 1HG2 ILE 45 3.954 -5.413 -1.262
251 2HG2 ILE 45 2HG2 ILE 45 2.617 -6.280 -2.015
252 3HG2 ILE 45 3HG2 ILE 45 4.040 -5.858 -2.963
253 1HD1 ILE 45 1HD1 ILE 45 7.316 -5.955 -0.716
254 2HD1 ILE 45 2HD1 ILE 45 6.058 -6.388 0.440
255 3HD1 ILE 45 3HD1 ILE 45 5.700 -5.270 -0.875
256 H LYS 46 H LYS 46 2.109 -9.686 -1.361
257 HA LYS 46 HA LYS 46 -0.187 -8.109 -1.590
258 1HB LYS 46 1HB LYS 46 0.484 -10.627 -2.371
259 2HB LYS 46 2HB LYS 46 -0.635 -10.982 -1.061
260 1HG LYS 46 1HG LYS 46 -2.052 -9.119 -2.374
261 2HG LYS 46 2HG LYS 46 -1.133 -9.806 -3.714
262 1HD LYS 46 1HD LYS 46 -2.273 -11.801 -1.898
263 2HD LYS 46 2HD LYS 46 -3.475 -10.813 -2.729
264 1HE LYS 46 1HE LYS 46 -2.305 -11.344 -4.875
265 2HE LYS 46 2HE LYS 46 -1.294 -12.476 -3.977
266 1HZ LYS 46 1HZ LYS 46 -3.569 -13.162 -5.165
267 2HZ LYS 46 2HZ LYS 46 -4.160 -12.783 -3.627
268 3HZ LYS 46 3HZ LYS 46 -2.958 -13.960 -3.803
269 H ILE 47 H ILE 47 0.759 -10.416 0.913
270 HA ILE 47 HA ILE 47 -1.479 -9.957 2.617
271 HB ILE 47 HB ILE 47 1.106 -11.385 2.782
272 1HG1 ILE 47 1HG1 ILE 47 -1.449 -12.265 4.064
273 2HG1 ILE 47 2HG1 ILE 47 -1.350 -12.225 2.307
274 1HG2 ILE 47 1HG2 ILE 47 1.398 -10.140 4.781
275 2HG2 ILE 47 2HG2 ILE 47 0.831 -11.742 5.254
276 3HG2 ILE 47 3HG2 ILE 47 -0.286 -10.378 5.253
277 1HD1 ILE 47 1HD1 ILE 47 0.283 -13.872 2.242
278 2HD1 ILE 47 2HD1 ILE 47 -0.806 -14.412 3.520
279 3HD1 ILE 47 3HD1 ILE 47 0.723 -13.638 3.934
280 H TRP 48 H TRP 48 1.774 -8.731 2.393
281 HA TRP 48 HA TRP 48 1.963 -7.229 4.720
282 1HB TRP 48 1HB TRP 48 3.830 -7.768 3.217
283 2HB TRP 48 2HB TRP 48 3.130 -6.753 1.970
284 HD1 TRP 48 HD1 TRP 48 5.592 -6.698 4.708
285 HE1 TRP 48 HE1 TRP 48 6.460 -4.307 5.054
286 HE3 TRP 48 HE3 TRP 48 2.120 -4.120 1.999
287 HZ2 TRP 48 HZ2 TRP 48 5.785 -1.692 4.313
288 HZ3 TRP 48 HZ3 TRP 48 2.300 -1.678 1.870
289 HH2 TRP 48 HH2 TRP 48 4.103 -0.493 2.995
290 H PHE 49 H PHE 49 0.921 -6.237 1.484
291 HA PHE 49 HA PHE 49 0.241 -3.600 2.302
292 1HB PHE 49 1HB PHE 49 -0.091 -5.181 -0.195
293 2HB PHE 49 2HB PHE 49 -1.094 -3.740 0.016
294 HD1 PHE 49 HD1 PHE 49 -0.123 -1.550 0.101
295 HD2 PHE 49 HD2 PHE 49 2.309 -5.005 -0.313
296 HE1 PHE 49 HE1 PHE 49 1.820 -0.117 -0.433
297 HE2 PHE 49 HE2 PHE 49 4.250 -3.593 -0.851
298 HZ PHE 49 HZ PHE 49 4.015 -1.155 -0.889
299 H GLN 50 H GLN 50 -1.627 -6.540 1.809
300 HA GLN 50 HA GLN 50 -4.131 -5.335 2.280
301 1HB GLN 50 1HB GLN 50 -3.161 -8.183 2.414
302 2HB GLN 50 2HB GLN 50 -4.819 -7.757 2.814
303 1HG GLN 50 1HG GLN 50 -4.419 -6.514 0.393
304 2HG GLN 50 2HG GLN 50 -3.529 -8.026 0.226
305 1HE2 GLN 50 1HE2 GLN 50 -4.836 -9.152 -1.083
306 2HE2 GLN 50 2HE2 GLN 50 -6.475 -9.564 -0.722
307 H ASN 51 H ASN 51 -1.640 -6.626 4.375
308 HA ASN 51 HA ASN 51 -3.286 -6.713 6.724
309 1HB ASN 51 1HB ASN 51 -0.381 -7.066 6.129
310 2HB ASN 51 2HB ASN 51 -0.859 -6.735 7.792
311 1HD2 ASN 51 1HD2 ASN 51 -2.340 -8.654 5.204
312 2HD2 ASN 51 2HD2 ASN 51 -2.404 -10.129 6.101
313 H LYS 52 H LYS 52 -1.037 -4.409 5.297
314 HA LYS 52 HA LYS 52 -0.875 -2.634 7.471
315 1HB LYS 52 1HB LYS 52 0.366 -2.787 5.083
316 2HB LYS 52 2HB LYS 52 -0.774 -1.493 4.738
317 1HG LYS 52 1HG LYS 52 0.302 -0.019 6.046
318 2HG LYS 52 2HG LYS 52 0.684 -1.226 7.275
319 1HD LYS 52 1HD LYS 52 2.076 -1.563 4.704
320 2HD LYS 52 2HD LYS 52 2.508 -0.112 5.612
321 1HE LYS 52 1HE LYS 52 2.366 -2.670 7.105
322 2HE LYS 52 2HE LYS 52 3.717 -2.455 5.993
323 1HZ LYS 52 1HZ LYS 52 3.149 -1.109 8.503
324 2HZ LYS 52 2HZ LYS 52 3.763 -0.128 7.270
325 3HZ LYS 52 3HZ LYS 52 4.635 -1.482 7.785
326 H ARG 53 H ARG 53 -3.069 -2.743 4.690
327 HA ARG 53 HA ARG 53 -4.826 -0.861 6.122
328 1HB ARG 53 1HB ARG 53 -5.551 0.007 3.918
329 2HB ARG 53 2HB ARG 53 -3.850 0.309 4.245
330 1HG ARG 53 1HG ARG 53 -3.793 -2.099 2.930
331 2HG ARG 53 2HG ARG 53 -5.103 -1.237 2.121
332 1HD ARG 53 1HD ARG 53 -2.996 -0.807 1.004
333 2HD ARG 53 2HD ARG 53 -3.603 0.668 1.749
334 HE ARG 53 HE ARG 53 -1.300 -0.914 2.633
335 1HH1 ARG 53 1HH1 ARG 53 -3.301 1.933 2.995
336 2HH1 ARG 53 2HH1 ARG 53 -2.149 2.760 3.985
337 1HH2 ARG 53 1HH2 ARG 53 0.205 0.182 3.936
338 2HH2 ARG 53 2HH2 ARG 53 -0.163 1.770 4.519
339 H ALA 54 H ALA 54 -6.336 -2.208 6.923
340 HA ALA 54 HA ALA 54 -7.636 -4.076 5.050
341 1HB ALA 54 1HB ALA 54 -6.423 -4.832 7.282
342 2HB ALA 54 2HB ALA 54 -7.893 -5.619 6.707
343 3HB ALA 54 3HB ALA 54 -7.984 -4.403 7.980
344 H LYS 55 H LYS 55 -8.267 -1.932 7.820
345 HA LYS 55 HA LYS 55 -11.109 -1.918 7.251
346 1HB LYS 55 1HB LYS 55 -9.356 -0.890 9.424
347 2HB LYS 55 2HB LYS 55 -10.885 -0.062 9.162
348 1HG LYS 55 1HG LYS 55 -10.638 -3.028 9.602
349 2HG LYS 55 2HG LYS 55 -10.955 -1.857 10.883
350 1HD LYS 55 1HD LYS 55 -12.676 -2.314 8.446
351 2HD LYS 55 2HD LYS 55 -13.022 -2.898 10.074
352 1HE LYS 55 1HE LYS 55 -12.638 -0.258 10.546
353 2HE LYS 55 2HE LYS 55 -13.319 -0.208 8.920
354 1HZ LYS 55 1HZ LYS 55 -15.134 -1.671 9.806
355 2HZ LYS 55 2HZ LYS 55 -15.119 -0.093 10.414
356 3HZ LYS 55 3HZ LYS 55 -14.535 -1.368 11.359
357 H ILE 56 H ILE 56 -8.713 0.689 7.704
358 HA ILE 56 HA ILE 56 -8.439 2.700 6.672
359 HB ILE 56 HB ILE 56 -10.101 1.571 4.421
360 1HG1 ILE 56 1HG1 ILE 56 -7.177 1.560 4.136
361 2HG1 ILE 56 2HG1 ILE 56 -7.774 0.463 5.377
362 1HG2 ILE 56 1HG2 ILE 56 -9.777 3.969 4.293
363 2HG2 ILE 56 2HG2 ILE 56 -8.826 3.162 3.046
364 3HG2 ILE 56 3HG2 ILE 56 -8.038 3.767 4.502
365 1HD1 ILE 56 1HD1 ILE 56 -7.996 0.318 2.461
366 2HD1 ILE 56 2HD1 ILE 56 -9.462 -0.104 3.345
367 3HD1 ILE 56 3HD1 ILE 56 -7.957 -0.967 3.667
368 H LYS 57 H LYS 57 -9.525 4.136 7.901
369 HA LYS 57 HA LYS 57 -12.151 4.966 6.980
370 1HB LYS 57 1HB LYS 57 -12.654 3.296 8.713
371 2HB LYS 57 2HB LYS 57 -11.658 4.184 9.859
372 1HG LYS 57 1HG LYS 57 -13.897 4.740 10.340
373 2HG LYS 57 2HG LYS 57 -13.204 6.140 9.520
374 1HD LYS 57 1HD LYS 57 -14.284 4.421 7.536
375 2HD LYS 57 2HD LYS 57 -15.496 4.606 8.805
376 1HE LYS 57 1HE LYS 57 -14.612 7.164 8.516
377 2HE LYS 57 2HE LYS 57 -14.471 6.557 6.867
378 1HZ LYS 57 1HZ LYS 57 -16.751 6.050 6.801
379 2HZ LYS 57 2HZ LYS 57 -16.663 7.591 7.489
380 3HZ LYS 57 3HZ LYS 57 -16.942 6.243 8.471
381 H LYS 58 H LYS 58 -12.335 7.119 7.004
382 HA LYS 58 HA LYS 58 -11.843 9.316 7.320
383 1HB LYS 58 1HB LYS 58 -11.157 8.131 9.985
384 2HB LYS 58 2HB LYS 58 -10.795 9.822 9.666
385 1HG LYS 58 1HG LYS 58 -13.534 8.703 9.202
386 2HG LYS 58 2HG LYS 58 -13.016 9.248 10.799
387 1HD LYS 58 1HD LYS 58 -13.007 11.440 10.196
388 2HD LYS 58 2HD LYS 58 -12.528 11.091 8.533
389 1HE LYS 58 1HE LYS 58 -15.246 10.314 9.506
390 2HE LYS 58 2HE LYS 58 -14.923 11.982 9.034
391 1HZ LYS 58 1HZ LYS 58 -13.905 10.679 6.955
392 2HZ LYS 58 2HZ LYS 58 -15.512 11.202 7.022
393 3HZ LYS 58 3HZ LYS 58 -15.129 9.596 7.390
394 H SER 59 H SER 59 -9.984 10.878 7.796
395 HA SER 59 HA SER 59 -7.320 10.002 7.876
396 1HB SER 59 1HB SER 59 -6.750 10.605 5.452
397 2HB SER 59 2HB SER 59 -7.550 9.055 5.716
398 HG SER 59 HG SER 59 -8.431 11.283 4.383
Start of MODEL 13
1 1H ALA 16 1H ALA 16 -16.170 17.194 -3.990
2 2H ALA 16 2H ALA 16 -14.729 16.685 -4.773
3 3H ALA 16 3H ALA 16 -15.725 15.539 -3.972
4 HA ALA 16 HA ALA 16 -17.515 16.339 -5.560
5 1HB ALA 16 1HB ALA 16 -14.989 17.372 -6.794
6 2HB ALA 16 2HB ALA 16 -16.546 18.178 -6.601
7 3HB ALA 16 3HB ALA 16 -16.360 16.894 -7.794
8 H LYS 17 H LYS 17 -14.351 14.816 -5.659
9 HA LYS 17 HA LYS 17 -15.611 12.390 -6.703
10 1HB LYS 17 1HB LYS 17 -14.516 13.690 -8.580
11 2HB LYS 17 2HB LYS 17 -12.978 13.398 -7.779
12 1HG LYS 17 1HG LYS 17 -13.234 11.020 -8.051
13 2HG LYS 17 2HG LYS 17 -14.853 11.238 -8.718
14 1HD LYS 17 1HD LYS 17 -14.006 12.268 -10.676
15 2HD LYS 17 2HD LYS 17 -12.399 12.449 -9.970
16 1HE LYS 17 1HE LYS 17 -13.467 9.699 -10.140
17 2HE LYS 17 2HE LYS 17 -13.052 10.475 -11.667
18 1HZ LYS 17 1HZ LYS 17 -11.219 9.185 -10.622
19 2HZ LYS 17 2HZ LYS 17 -11.197 10.309 -9.358
20 3HZ LYS 17 3HZ LYS 17 -10.832 10.802 -10.934
21 H ARG 18 H ARG 18 -15.274 10.911 -5.189
22 HA ARG 18 HA ARG 18 -12.911 11.055 -3.494
23 1HB ARG 18 1HB ARG 18 -15.574 10.228 -3.109
24 2HB ARG 18 2HB ARG 18 -14.595 8.774 -2.964
25 1HG ARG 18 1HG ARG 18 -14.584 9.505 -0.803
26 2HG ARG 18 2HG ARG 18 -13.127 10.294 -1.412
27 1HD ARG 18 1HD ARG 18 -13.974 12.314 -1.020
28 2HD ARG 18 2HD ARG 18 -15.455 11.925 -1.894
29 HE ARG 18 HE ARG 18 -15.063 11.904 0.949
30 1HH1 ARG 18 1HH1 ARG 18 -16.948 10.590 -1.678
31 2HH1 ARG 18 2HH1 ARG 18 -18.314 10.224 -0.679
32 1HH2 ARG 18 1HH2 ARG 18 -16.860 11.422 2.264
33 2HH2 ARG 18 2HH2 ARG 18 -18.265 10.697 1.558
34 H GLU 19 H GLU 19 -12.579 8.370 -2.854
35 HA GLU 19 HA GLU 19 -11.426 6.515 -3.480
36 1HB GLU 19 1HB GLU 19 -13.156 7.039 -5.855
37 2HB GLU 19 2HB GLU 19 -11.875 5.845 -6.005
38 1HG GLU 19 1HG GLU 19 -12.909 4.361 -4.664
39 2HG GLU 19 2HG GLU 19 -13.587 5.609 -3.620
40 H PHE 20 H PHE 20 -9.850 5.686 -5.309
41 HA PHE 20 HA PHE 20 -8.493 7.664 -6.842
42 1HB PHE 20 1HB PHE 20 -6.382 7.695 -5.590
43 2HB PHE 20 2HB PHE 20 -7.700 8.343 -4.621
44 HD1 PHE 20 HD1 PHE 20 -5.857 5.163 -5.244
45 HD2 PHE 20 HD2 PHE 20 -8.012 7.573 -2.473
46 HE1 PHE 20 HE1 PHE 20 -5.319 3.573 -3.447
47 HE2 PHE 20 HE2 PHE 20 -7.475 5.986 -0.672
48 HZ PHE 20 HZ PHE 20 -6.127 3.983 -1.157
49 H ASN 21 H ASN 21 -6.049 6.625 -7.189
50 HA ASN 21 HA ASN 21 -6.491 4.355 -8.767
51 1HB ASN 21 1HB ASN 21 -3.802 5.117 -7.665
52 2HB ASN 21 2HB ASN 21 -4.175 4.344 -9.201
53 1HD2 ASN 21 1HD2 ASN 21 -2.611 6.708 -8.751
54 2HD2 ASN 21 2HD2 ASN 21 -3.388 7.994 -9.603
55 H GLU 22 H GLU 22 -7.379 2.640 -7.730
56 HA GLU 22 HA GLU 22 -6.583 1.653 -5.221
57 1HB GLU 22 1HB GLU 22 -8.580 1.041 -7.002
58 2HB GLU 22 2HB GLU 22 -7.545 -0.376 -7.117
59 1HG GLU 22 1HG GLU 22 -7.635 -0.479 -4.594
60 2HG GLU 22 2HG GLU 22 -8.922 0.722 -4.689
61 H ASN 23 H ASN 23 -4.442 1.363 -4.953
62 HA ASN 23 HA ASN 23 -2.398 0.392 -5.080
63 1HB ASN 23 1HB ASN 23 -4.025 -1.691 -6.511
64 2HB ASN 23 2HB ASN 23 -2.282 -1.841 -6.324
65 1HD2 ASN 23 1HD2 ASN 23 -5.048 -0.937 -4.284
66 2HD2 ASN 23 2HD2 ASN 23 -4.599 -1.932 -2.946
67 H ARG 24 H ARG 24 -1.584 2.085 -6.246
68 HA ARG 24 HA ARG 24 -0.376 1.507 -8.710
69 1HB ARG 24 1HB ARG 24 -2.233 1.841 -10.005
70 2HB ARG 24 2HB ARG 24 -3.028 2.845 -8.800
71 1HG ARG 24 1HG ARG 24 -2.128 4.769 -9.607
72 2HG ARG 24 2HG ARG 24 -0.664 3.976 -10.192
73 1HD ARG 24 1HD ARG 24 -2.341 2.818 -11.849
74 2HD ARG 24 2HD ARG 24 -3.337 4.227 -11.486
75 HE ARG 24 HE ARG 24 -0.982 5.350 -12.105
76 1HH1 ARG 24 1HH1 ARG 24 -2.895 2.922 -13.730
77 2HH1 ARG 24 2HH1 ARG 24 -2.346 3.369 -15.309
78 1HH2 ARG 24 1HH2 ARG 24 -0.262 5.938 -14.183
79 2HH2 ARG 24 2HH2 ARG 24 -0.851 5.080 -15.567
80 H TYR 25 H TYR 25 -1.874 4.471 -7.480
81 HA TYR 25 HA TYR 25 0.021 6.325 -7.890
82 1HB TYR 25 1HB TYR 25 -0.819 7.525 -5.929
83 2HB TYR 25 2HB TYR 25 -2.148 6.767 -6.804
84 HD1 TYR 25 HD1 TYR 25 -2.734 4.314 -5.947
85 HD2 TYR 25 HD2 TYR 25 -0.781 7.291 -3.620
86 HE1 TYR 25 HE1 TYR 25 -3.428 3.156 -3.903
87 HE2 TYR 25 HE2 TYR 25 -1.479 6.141 -1.562
88 HH TYR 25 HH TYR 25 -2.207 3.315 -1.188
89 H LEU 26 H LEU 26 -0.031 4.156 -5.080
90 HA LEU 26 HA LEU 26 2.803 4.806 -4.620
91 1HB LEU 26 1HB LEU 26 1.967 5.713 -2.722
92 2HB LEU 26 2HB LEU 26 0.489 4.778 -2.801
93 HG LEU 26 HG LEU 26 3.075 3.507 -1.948
94 1HD1 LEU 26 1HD1 LEU 26 1.410 5.440 -0.487
95 2HD1 LEU 26 2HD1 LEU 26 3.096 4.978 -0.249
96 3HD1 LEU 26 3HD1 LEU 26 1.805 3.960 0.389
97 1HD2 LEU 26 1HD2 LEU 26 0.281 2.724 -2.159
98 2HD2 LEU 26 2HD2 LEU 26 0.949 2.427 -0.554
99 3HD2 LEU 26 3HD2 LEU 26 1.726 1.727 -1.974
100 H THR 27 H THR 27 0.279 2.356 -4.487
101 HA THR 27 HA THR 27 1.581 0.208 -3.445
102 HB THR 27 HB THR 27 -0.509 0.493 -5.552
103 HG1 THR 27 HG1 THR 27 -0.380 -0.727 -3.000
104 1HG2 THR 27 1HG2 THR 27 1.049 -1.970 -5.101
105 2HG2 THR 27 2HG2 THR 27 0.142 -1.434 -6.516
106 3HG2 THR 27 3HG2 THR 27 -0.707 -2.130 -5.136
107 H GLU 28 H GLU 28 1.217 0.258 -6.967
108 HA GLU 28 HA GLU 28 3.264 -1.461 -7.566
109 1HB GLU 28 1HB GLU 28 2.149 0.833 -9.171
110 2HB GLU 28 2HB GLU 28 3.294 -0.327 -9.830
111 1HG GLU 28 1HG GLU 28 1.503 -2.048 -8.905
112 2HG GLU 28 2HG GLU 28 0.437 -0.662 -9.131
113 H ARG 29 H ARG 29 3.503 2.044 -7.133
114 HA ARG 29 HA ARG 29 6.168 2.284 -8.044
115 1HB ARG 29 1HB ARG 29 4.577 4.023 -6.154
116 2HB ARG 29 2HB ARG 29 6.137 4.464 -6.836
117 1HG ARG 29 1HG ARG 29 4.241 3.663 -8.878
118 2HG ARG 29 2HG ARG 29 3.654 5.015 -7.908
119 1HD ARG 29 1HD ARG 29 4.830 6.146 -9.514
120 2HD ARG 29 2HD ARG 29 6.088 5.927 -8.299
121 HE ARG 29 HE ARG 29 6.367 3.745 -9.866
122 1HH1 ARG 29 1HH1 ARG 29 6.202 7.162 -10.556
123 2HH1 ARG 29 2HH1 ARG 29 7.207 7.054 -11.962
124 1HH2 ARG 29 1HH2 ARG 29 7.691 3.601 -11.715
125 2HH2 ARG 29 2HH2 ARG 29 8.052 5.032 -12.620
126 H ARG 30 H ARG 30 4.824 2.017 -4.767
127 HA ARG 30 HA ARG 30 7.432 1.932 -3.559
128 1HB ARG 30 1HB ARG 30 4.631 1.648 -2.511
129 2HB ARG 30 2HB ARG 30 6.027 1.338 -1.487
130 1HG ARG 30 1HG ARG 30 6.700 3.743 -2.501
131 2HG ARG 30 2HG ARG 30 4.941 3.878 -2.493
132 1HD ARG 30 1HD ARG 30 4.991 3.129 -0.099
133 2HD ARG 30 2HD ARG 30 6.747 3.269 -0.160
134 HE ARG 30 HE ARG 30 5.362 5.655 -0.972
135 1HH1 ARG 30 1HH1 ARG 30 6.645 3.870 1.739
136 2HH1 ARG 30 2HH1 ARG 30 6.812 5.272 2.742
137 1HH2 ARG 30 1HH2 ARG 30 5.582 7.499 0.346
138 2HH2 ARG 30 2HH2 ARG 30 6.209 7.331 1.952
139 H ARG 31 H ARG 31 5.195 -0.401 -4.789
140 HA ARG 31 HA ARG 31 5.856 -2.634 -3.262
141 1HB ARG 31 1HB ARG 31 4.136 -2.217 -5.284
142 2HB ARG 31 2HB ARG 31 5.401 -3.062 -6.163
143 1HG ARG 31 1HG ARG 31 4.373 -4.199 -3.607
144 2HG ARG 31 2HG ARG 31 3.439 -4.386 -5.094
145 1HD ARG 31 1HD ARG 31 6.262 -5.304 -4.574
146 2HD ARG 31 2HD ARG 31 4.839 -6.313 -4.829
147 HE ARG 31 HE ARG 31 6.447 -5.044 -6.841
148 1HH1 ARG 31 1HH1 ARG 31 3.289 -6.330 -6.103
149 2HH1 ARG 31 2HH1 ARG 31 2.887 -6.634 -7.760
150 1HH2 ARG 31 1HH2 ARG 31 5.921 -5.441 -9.021
151 2HH2 ARG 31 2HH2 ARG 31 4.381 -6.129 -9.417
152 H GLN 32 H GLN 32 7.464 -1.214 -6.048
153 HA GLN 32 HA GLN 32 9.314 -3.335 -6.447
154 1HB GLN 32 1HB GLN 32 8.729 -1.637 -8.171
155 2HB GLN 32 2HB GLN 32 9.599 -0.430 -7.234
156 1HG GLN 32 1HG GLN 32 11.294 -2.685 -7.660
157 2HG GLN 32 2HG GLN 32 10.605 -2.173 -9.199
158 1HE2 GLN 32 1HE2 GLN 32 11.148 -0.191 -10.045
159 2HE2 GLN 32 2HE2 GLN 32 12.433 0.778 -9.416
160 H GLN 33 H GLN 33 9.467 -0.271 -4.679
161 HA GLN 33 HA GLN 33 12.192 -0.634 -3.880
162 1HB GLN 33 1HB GLN 33 10.097 1.217 -2.733
163 2HB GLN 33 2HB GLN 33 11.832 1.327 -2.471
164 1HG GLN 33 1HG GLN 33 11.513 1.325 -5.239
165 2HG GLN 33 2HG GLN 33 10.228 2.363 -4.622
166 1HE2 GLN 33 1HE2 GLN 33 10.737 4.297 -3.681
167 2HE2 GLN 33 2HE2 GLN 33 12.329 4.967 -3.688
168 H LEU 34 H LEU 34 9.046 -1.209 -2.387
169 HA LEU 34 HA LEU 34 9.990 -1.806 0.198
170 1HB LEU 34 1HB LEU 34 7.480 -2.182 -1.303
171 2HB LEU 34 2HB LEU 34 7.732 -3.291 0.032
172 HG LEU 34 HG LEU 34 8.094 -0.364 0.506
173 1HD1 LEU 34 1HD1 LEU 34 5.767 -0.038 0.925
174 2HD1 LEU 34 2HD1 LEU 34 5.412 -1.729 0.571
175 3HD1 LEU 34 3HD1 LEU 34 5.944 -0.650 -0.718
176 1HD2 LEU 34 1HD2 LEU 34 7.009 -1.159 2.700
177 2HD2 LEU 34 2HD2 LEU 34 8.674 -1.633 2.366
178 3HD2 LEU 34 3HD2 LEU 34 7.362 -2.784 2.112
179 H SER 35 H SER 35 9.475 -3.808 -2.655
180 HA SER 35 HA SER 35 9.953 -6.293 -1.402
181 1HB SER 35 1HB SER 35 8.940 -5.761 -3.746
182 2HB SER 35 2HB SER 35 10.619 -5.791 -4.288
183 HG SER 35 HG SER 35 9.172 -7.880 -3.029
184 H SER 36 H SER 36 12.082 -4.203 -3.350
185 HA SER 36 HA SER 36 14.395 -5.796 -2.981
186 1HB SER 36 1HB SER 36 13.773 -3.779 -4.663
187 2HB SER 36 2HB SER 36 14.759 -2.901 -3.494
188 HG SER 36 HG SER 36 15.803 -4.032 -5.393
189 H GLU 37 H GLU 37 13.141 -2.954 -1.289
190 HA GLU 37 HA GLU 37 15.409 -2.520 0.334
191 1HB GLU 37 1HB GLU 37 13.508 -0.904 -0.096
192 2HB GLU 37 2HB GLU 37 12.565 -1.830 1.065
193 1HG GLU 37 1HG GLU 37 15.125 -1.149 2.174
194 2HG GLU 37 2HG GLU 37 14.306 0.293 1.577
195 H LEU 38 H LEU 38 12.387 -4.294 0.942
196 HA LEU 38 HA LEU 38 13.335 -5.166 3.535
197 1HB LEU 38 1HB LEU 38 10.816 -5.617 1.967
198 2HB LEU 38 2HB LEU 38 11.158 -6.545 3.414
199 HG LEU 38 HG LEU 38 11.375 -3.608 3.687
200 1HD1 LEU 38 1HD1 LEU 38 9.407 -3.771 2.273
201 2HD1 LEU 38 2HD1 LEU 38 8.954 -3.334 3.920
202 3HD1 LEU 38 3HD1 LEU 38 8.715 -4.985 3.349
203 1HD2 LEU 38 1HD2 LEU 38 11.444 -5.684 5.405
204 2HD2 LEU 38 2HD2 LEU 38 9.734 -5.262 5.489
205 3HD2 LEU 38 3HD2 LEU 38 10.961 -4.050 5.858
206 H GLY 39 H GLY 39 13.406 -6.319 0.295
207 1HA GLY 39 1HA GLY 39 14.433 -8.177 -0.592
208 2HA GLY 39 2HA GLY 39 15.011 -8.558 1.022
209 H LEU 40 H LEU 40 11.618 -8.132 0.364
210 HA LEU 40 HA LEU 40 11.225 -11.000 0.879
211 1HB LEU 40 1HB LEU 40 8.767 -10.074 1.236
212 2HB LEU 40 2HB LEU 40 9.966 -10.053 2.516
213 HG LEU 40 HG LEU 40 10.475 -7.666 1.844
214 1HD1 LEU 40 1HD1 LEU 40 9.403 -7.917 -0.419
215 2HD1 LEU 40 2HD1 LEU 40 8.942 -6.475 0.486
216 3HD1 LEU 40 3HD1 LEU 40 7.844 -7.853 0.402
217 1HD2 LEU 40 1HD2 LEU 40 8.039 -8.691 3.152
218 2HD2 LEU 40 2HD2 LEU 40 8.033 -6.979 2.728
219 3HD2 LEU 40 3HD2 LEU 40 9.300 -7.624 3.771
220 H ASN 41 H ASN 41 9.323 -11.993 -0.189
221 HA ASN 41 HA ASN 41 9.373 -11.344 -3.014
222 1HB ASN 41 1HB ASN 41 9.219 -13.718 -1.604
223 2HB ASN 41 2HB ASN 41 7.577 -13.503 -2.201
224 1HD2 ASN 41 1HD2 ASN 41 7.423 -12.933 -4.548
225 2HD2 ASN 41 2HD2 ASN 41 8.495 -13.749 -5.628
226 H GLU 42 H GLU 42 7.501 -10.978 -4.274
227 HA GLU 42 HA GLU 42 5.696 -9.114 -3.304
228 1HB GLU 42 1HB GLU 42 6.220 -9.682 -5.722
229 2HB GLU 42 2HB GLU 42 5.119 -11.045 -5.555
230 1HG GLU 42 1HG GLU 42 3.733 -8.782 -4.627
231 2HG GLU 42 2HG GLU 42 4.538 -8.304 -6.121
232 H ALA 43 H ALA 43 5.580 -12.596 -3.222
233 HA ALA 43 HA ALA 43 2.847 -12.998 -2.745
234 1HB ALA 43 1HB ALA 43 5.119 -14.601 -1.567
235 2HB ALA 43 2HB ALA 43 4.499 -14.803 -3.206
236 3HB ALA 43 3HB ALA 43 3.459 -15.139 -1.821
237 H GLN 44 H GLN 44 5.477 -12.035 -0.660
238 HA GLN 44 HA GLN 44 3.921 -12.128 1.773
239 1HB GLN 44 1HB GLN 44 6.663 -11.161 1.021
240 2HB GLN 44 2HB GLN 44 5.974 -10.745 2.584
241 1HG GLN 44 1HG GLN 44 6.412 -13.539 1.551
242 2HG GLN 44 2HG GLN 44 7.432 -12.698 2.718
243 1HE2 GLN 44 1HE2 GLN 44 5.653 -11.529 4.370
244 2HE2 GLN 44 2HE2 GLN 44 4.700 -12.721 5.180
245 H ILE 45 H ILE 45 4.736 -9.919 -0.739
246 HA ILE 45 HA ILE 45 4.138 -7.475 0.520
247 HB ILE 45 HB ILE 45 4.162 -8.298 -2.381
248 1HG1 ILE 45 1HG1 ILE 45 6.311 -8.268 -1.088
249 2HG1 ILE 45 2HG1 ILE 45 6.283 -7.164 -2.461
250 1HG2 ILE 45 1HG2 ILE 45 4.004 -5.471 -1.383
251 2HG2 ILE 45 2HG2 ILE 45 2.609 -6.372 -1.973
252 3HG2 ILE 45 3HG2 ILE 45 3.960 -6.031 -3.051
253 1HD1 ILE 45 1HD1 ILE 45 6.098 -6.516 0.453
254 2HD1 ILE 45 2HD1 ILE 45 5.634 -5.362 -0.796
255 3HD1 ILE 45 3HD1 ILE 45 7.287 -5.974 -0.731
256 H LYS 46 H LYS 46 2.137 -9.779 -1.295
257 HA LYS 46 HA LYS 46 -0.176 -8.230 -1.543
258 1HB LYS 46 1HB LYS 46 0.493 -10.720 -2.323
259 2HB LYS 46 2HB LYS 46 -0.523 -11.117 -0.945
260 1HG LYS 46 1HG LYS 46 -1.919 -9.166 -2.397
261 2HG LYS 46 2HG LYS 46 -1.276 -10.302 -3.585
262 1HD LYS 46 1HD LYS 46 -2.184 -12.093 -1.893
263 2HD LYS 46 2HD LYS 46 -3.216 -10.762 -1.365
264 1HE LYS 46 1HE LYS 46 -4.410 -10.742 -3.295
265 2HE LYS 46 2HE LYS 46 -3.029 -11.222 -4.280
266 1HZ LYS 46 1HZ LYS 46 -3.487 -13.397 -4.020
267 2HZ LYS 46 2HZ LYS 46 -5.055 -12.840 -3.715
268 3HZ LYS 46 3HZ LYS 46 -4.029 -13.223 -2.426
269 H ILE 47 H ILE 47 0.813 -10.468 1.009
270 HA ILE 47 HA ILE 47 -1.421 -9.990 2.713
271 HB ILE 47 HB ILE 47 1.179 -11.392 2.905
272 1HG1 ILE 47 1HG1 ILE 47 -0.657 -12.845 4.308
273 2HG1 ILE 47 2HG1 ILE 47 -1.699 -11.951 3.205
274 1HG2 ILE 47 1HG2 ILE 47 0.905 -11.694 5.387
275 2HG2 ILE 47 2HG2 ILE 47 -0.220 -10.336 5.351
276 3HG2 ILE 47 3HG2 ILE 47 1.464 -10.099 4.874
277 1HD1 ILE 47 1HD1 ILE 47 0.482 -12.960 1.710
278 2HD1 ILE 47 2HD1 ILE 47 -1.225 -13.390 1.603
279 3HD1 ILE 47 3HD1 ILE 47 -0.161 -14.270 2.701
280 H TRP 48 H TRP 48 1.834 -8.752 2.470
281 HA TRP 48 HA TRP 48 1.999 -7.188 4.756
282 1HB TRP 48 1HB TRP 48 3.882 -7.752 3.286
283 2HB TRP 48 2HB TRP 48 3.186 -6.781 2.003
284 HD1 TRP 48 HD1 TRP 48 5.627 -6.622 4.753
285 HE1 TRP 48 HE1 TRP 48 6.466 -4.213 5.041
286 HE3 TRP 48 HE3 TRP 48 2.147 -4.154 1.954
287 HZ2 TRP 48 HZ2 TRP 48 5.767 -1.626 4.231
288 HZ3 TRP 48 HZ3 TRP 48 2.300 -1.714 1.764
289 HH2 TRP 48 HH2 TRP 48 4.081 -0.480 2.870
290 H PHE 49 H PHE 49 0.972 -6.290 1.490
291 HA PHE 49 HA PHE 49 0.273 -3.636 2.229
292 1HB PHE 49 1HB PHE 49 -0.030 -5.290 -0.224
293 2HB PHE 49 2HB PHE 49 -1.049 -3.853 -0.060
294 HD1 PHE 49 HD1 PHE 49 2.375 -5.088 -0.331
295 HD2 PHE 49 HD2 PHE 49 -0.108 -1.656 -0.032
296 HE1 PHE 49 HE1 PHE 49 4.304 -3.663 -0.881
297 HE2 PHE 49 HE2 PHE 49 1.818 -0.213 -0.597
298 HZ PHE 49 HZ PHE 49 4.033 -1.231 -0.994
299 H GLN 50 H GLN 50 -1.577 -6.599 1.812
300 HA GLN 50 HA GLN 50 -4.092 -5.404 2.228
301 1HB GLN 50 1HB GLN 50 -3.090 -8.233 2.473
302 2HB GLN 50 2HB GLN 50 -4.750 -7.814 2.872
303 1HG GLN 50 1HG GLN 50 -4.288 -6.662 0.377
304 2HG GLN 50 2HG GLN 50 -3.532 -8.252 0.305
305 1HE2 GLN 50 1HE2 GLN 50 -4.908 -10.066 1.119
306 2HE2 GLN 50 2HE2 GLN 50 -6.587 -10.031 0.711
307 H ASN 51 H ASN 51 -1.600 -6.575 4.392
308 HA ASN 51 HA ASN 51 -3.202 -6.687 6.737
309 1HB ASN 51 1HB ASN 51 -0.345 -6.890 6.071
310 2HB ASN 51 2HB ASN 51 -0.666 -6.214 7.665
311 1HD2 ASN 51 1HD2 ASN 51 -2.387 -8.677 5.797
312 2HD2 ASN 51 2HD2 ASN 51 -2.230 -9.930 6.976
313 H LYS 52 H LYS 52 -1.190 -4.173 5.279
314 HA LYS 52 HA LYS 52 -1.386 -2.318 7.398
315 1HB LYS 52 1HB LYS 52 -0.523 -2.257 4.569
316 2HB LYS 52 2HB LYS 52 -1.011 -0.714 5.256
317 1HG LYS 52 1HG LYS 52 0.664 -0.804 6.909
318 2HG LYS 52 2HG LYS 52 0.991 -2.510 6.592
319 1HD LYS 52 1HD LYS 52 2.213 -2.067 4.710
320 2HD LYS 52 2HD LYS 52 1.327 -0.582 4.354
321 1HE LYS 52 1HE LYS 52 2.920 -0.586 6.839
322 2HE LYS 52 2HE LYS 52 3.835 -0.631 5.332
323 1HZ LYS 52 1HZ LYS 52 2.218 1.502 6.456
324 2HZ LYS 52 2HZ LYS 52 2.077 1.286 4.785
325 3HZ LYS 52 3HZ LYS 52 3.592 1.587 5.472
326 H ARG 53 H ARG 53 -3.494 -3.110 4.737
327 HA ARG 53 HA ARG 53 -5.105 -0.752 4.932
328 1HB ARG 53 1HB ARG 53 -4.804 -2.723 3.056
329 2HB ARG 53 2HB ARG 53 -6.360 -3.136 3.764
330 1HG ARG 53 1HG ARG 53 -7.386 -1.317 2.909
331 2HG ARG 53 2HG ARG 53 -5.955 -0.297 3.069
332 1HD ARG 53 1HD ARG 53 -6.124 -2.504 1.038
333 2HD ARG 53 2HD ARG 53 -6.732 -0.882 0.706
334 HE ARG 53 HE ARG 53 -3.983 -1.715 0.832
335 1HH1 ARG 53 1HH1 ARG 53 -6.169 0.990 1.119
336 2HH1 ARG 53 2HH1 ARG 53 -4.958 2.169 0.745
337 1HH2 ARG 53 1HH2 ARG 53 -2.389 -0.165 0.339
338 2HH2 ARG 53 2HH2 ARG 53 -2.812 1.514 0.302
339 H ALA 54 H ALA 54 -4.796 -3.399 6.942
340 HA ALA 54 HA ALA 54 -7.448 -3.995 7.636
341 1HB ALA 54 1HB ALA 54 -6.567 -5.065 9.559
342 2HB ALA 54 2HB ALA 54 -5.106 -4.078 9.523
343 3HB ALA 54 3HB ALA 54 -5.383 -5.289 8.271
344 H LYS 55 H LYS 55 -5.349 -1.358 8.542
345 HA LYS 55 HA LYS 55 -6.671 -0.478 10.848
346 1HB LYS 55 1HB LYS 55 -4.455 0.319 9.509
347 2HB LYS 55 2HB LYS 55 -5.568 1.608 9.068
348 1HG LYS 55 1HG LYS 55 -6.028 1.922 11.509
349 2HG LYS 55 2HG LYS 55 -4.715 0.788 11.832
350 1HD LYS 55 1HD LYS 55 -3.602 2.798 11.954
351 2HD LYS 55 2HD LYS 55 -3.357 2.380 10.258
352 1HE LYS 55 1HE LYS 55 -4.102 4.485 9.923
353 2HE LYS 55 2HE LYS 55 -5.681 3.714 10.070
354 1HZ LYS 55 1HZ LYS 55 -5.188 5.801 11.455
355 2HZ LYS 55 2HZ LYS 55 -4.304 4.763 12.456
356 3HZ LYS 55 3HZ LYS 55 -5.956 4.497 12.212
357 H ILE 56 H ILE 56 -6.971 0.822 7.536
358 HA ILE 56 HA ILE 56 -8.731 1.755 6.428
359 HB ILE 56 HB ILE 56 -10.496 0.752 8.660
360 1HG1 ILE 56 1HG1 ILE 56 -10.173 -0.740 6.097
361 2HG1 ILE 56 2HG1 ILE 56 -8.916 -0.914 7.318
362 1HG2 ILE 56 1HG2 ILE 56 -12.283 0.920 7.108
363 2HG2 ILE 56 2HG2 ILE 56 -11.179 1.244 5.772
364 3HG2 ILE 56 3HG2 ILE 56 -11.403 2.447 7.042
365 1HD1 ILE 56 1HD1 ILE 56 -11.059 -2.491 7.187
366 2HD1 ILE 56 2HD1 ILE 56 -11.698 -1.231 8.242
367 3HD1 ILE 56 3HD1 ILE 56 -10.237 -2.108 8.699
368 H LYS 57 H LYS 57 -8.508 3.903 6.474
369 HA LYS 57 HA LYS 57 -9.186 5.347 8.940
370 1HB LYS 57 1HB LYS 57 -7.806 6.495 6.518
371 2HB LYS 57 2HB LYS 57 -7.863 7.157 8.146
372 1HG LYS 57 1HG LYS 57 -6.416 5.449 8.971
373 2HG LYS 57 2HG LYS 57 -6.503 4.568 7.444
374 1HD LYS 57 1HD LYS 57 -5.636 6.993 6.593
375 2HD LYS 57 2HD LYS 57 -4.892 6.914 8.191
376 1HE LYS 57 1HE LYS 57 -4.084 4.596 7.525
377 2HE LYS 57 2HE LYS 57 -4.560 5.017 5.881
378 1HZ LYS 57 1HZ LYS 57 -2.241 5.484 6.197
379 2HZ LYS 57 2HZ LYS 57 -2.563 6.438 7.557
380 3HZ LYS 57 3HZ LYS 57 -3.070 6.949 6.027
381 H LYS 58 H LYS 58 -9.927 7.748 8.229
382 HA LYS 58 HA LYS 58 -12.246 7.353 6.453
383 1HB LYS 58 1HB LYS 58 -12.402 7.886 9.082
384 2HB LYS 58 2HB LYS 58 -12.294 9.531 8.468
385 1HG LYS 58 1HG LYS 58 -14.189 8.032 6.923
386 2HG LYS 58 2HG LYS 58 -14.567 7.905 8.642
387 1HD LYS 58 1HD LYS 58 -14.990 10.144 8.855
388 2HD LYS 58 2HD LYS 58 -13.883 10.586 7.554
389 1HE LYS 58 1HE LYS 58 -15.520 10.562 6.041
390 2HE LYS 58 2HE LYS 58 -16.087 8.982 6.580
391 1HZ LYS 58 1HZ LYS 58 -16.968 10.511 8.561
392 2HZ LYS 58 2HZ LYS 58 -17.880 10.180 7.176
393 3HZ LYS 58 3HZ LYS 58 -17.029 11.636 7.298
394 H SER 59 H SER 59 -12.354 8.588 4.698
395 HA SER 59 HA SER 59 -10.685 11.016 4.595
396 1HB SER 59 1HB SER 59 -10.468 10.621 2.163
397 2HB SER 59 2HB SER 59 -9.810 9.284 3.108
398 HG SER 59 HG SER 59 -11.716 9.214 1.254
Start of MODEL 14
1 1H ALA 16 1H ALA 16 -16.985 -1.174 -7.910
2 2H ALA 16 2H ALA 16 -15.477 -1.032 -8.718
3 3H ALA 16 3H ALA 16 -16.848 -1.636 -9.555
4 HA ALA 16 HA ALA 16 -16.155 0.717 -9.982
5 1HB ALA 16 1HB ALA 16 -18.320 -0.351 -10.612
6 2HB ALA 16 2HB ALA 16 -18.425 1.385 -10.311
7 3HB ALA 16 3HB ALA 16 -18.993 0.242 -9.094
8 H LYS 17 H LYS 17 -15.452 0.200 -7.137
9 HA LYS 17 HA LYS 17 -16.812 2.168 -5.567
10 1HB LYS 17 1HB LYS 17 -14.604 0.251 -5.178
11 2HB LYS 17 2HB LYS 17 -14.499 1.714 -4.207
12 1HG LYS 17 1HG LYS 17 -17.015 0.092 -4.306
13 2HG LYS 17 2HG LYS 17 -15.692 -0.319 -3.213
14 1HD LYS 17 1HD LYS 17 -15.983 1.564 -1.934
15 2HD LYS 17 2HD LYS 17 -16.666 2.494 -3.268
16 1HE LYS 17 1HE LYS 17 -18.643 2.127 -2.291
17 2HE LYS 17 2HE LYS 17 -18.509 0.491 -2.934
18 1HZ LYS 17 1HZ LYS 17 -17.119 0.250 -0.681
19 2HZ LYS 17 2HZ LYS 17 -18.781 -0.051 -0.782
20 3HZ LYS 17 3HZ LYS 17 -18.225 1.439 -0.205
21 H ARG 18 H ARG 18 -16.665 4.189 -6.411
22 HA ARG 18 HA ARG 18 -15.779 6.219 -6.928
23 1HB ARG 18 1HB ARG 18 -13.761 5.050 -5.068
24 2HB ARG 18 2HB ARG 18 -13.343 6.525 -5.928
25 1HG ARG 18 1HG ARG 18 -15.047 7.747 -4.903
26 2HG ARG 18 2HG ARG 18 -15.898 6.292 -4.381
27 1HD ARG 18 1HD ARG 18 -13.155 6.542 -3.367
28 2HD ARG 18 2HD ARG 18 -14.262 7.794 -2.805
29 HE ARG 18 HE ARG 18 -14.286 5.008 -2.093
30 1HH1 ARG 18 1HH1 ARG 18 -16.198 7.918 -2.337
31 2HH1 ARG 18 2HH1 ARG 18 -17.353 7.406 -1.153
32 1HH2 ARG 18 1HH2 ARG 18 -15.806 4.334 -0.537
33 2HH2 ARG 18 2HH2 ARG 18 -17.131 5.372 -0.131
34 H GLU 19 H GLU 19 -13.530 7.233 -7.797
35 HA GLU 19 HA GLU 19 -12.591 5.430 -9.930
36 1HB GLU 19 1HB GLU 19 -14.167 7.217 -10.718
37 2HB GLU 19 2HB GLU 19 -12.995 8.414 -10.185
38 1HG GLU 19 1HG GLU 19 -11.490 6.755 -11.766
39 2HG GLU 19 2HG GLU 19 -13.046 6.783 -12.593
40 H PHE 20 H PHE 20 -10.577 4.898 -9.376
41 HA PHE 20 HA PHE 20 -8.490 6.780 -9.441
42 1HB PHE 20 1HB PHE 20 -7.718 6.660 -7.104
43 2HB PHE 20 2HB PHE 20 -9.301 7.423 -7.223
44 HD1 PHE 20 HD1 PHE 20 -7.717 4.117 -6.595
45 HD2 PHE 20 HD2 PHE 20 -11.016 6.697 -5.855
46 HE1 PHE 20 HE1 PHE 20 -8.599 2.506 -4.963
47 HE2 PHE 20 HE2 PHE 20 -11.907 5.092 -4.218
48 HZ PHE 20 HZ PHE 20 -10.699 2.991 -3.770
49 H ASN 21 H ASN 21 -6.394 5.695 -8.454
50 HA ASN 21 HA ASN 21 -6.217 3.104 -9.719
51 1HB ASN 21 1HB ASN 21 -4.143 4.812 -8.337
52 2HB ASN 21 2HB ASN 21 -3.801 3.292 -9.153
53 1HD2 ASN 21 1HD2 ASN 21 -3.994 6.602 -9.487
54 2HD2 ASN 21 2HD2 ASN 21 -3.972 6.697 -11.211
55 H GLU 22 H GLU 22 -7.112 1.495 -8.538
56 HA GLU 22 HA GLU 22 -7.218 1.344 -5.753
57 1HB GLU 22 1HB GLU 22 -7.878 -0.356 -7.986
58 2HB GLU 22 2HB GLU 22 -7.146 -1.306 -6.700
59 1HG GLU 22 1HG GLU 22 -8.980 -1.201 -5.462
60 2HG GLU 22 2HG GLU 22 -9.089 0.549 -5.651
61 H ASN 23 H ASN 23 -4.880 -0.039 -8.026
62 HA ASN 23 HA ASN 23 -2.860 -0.015 -5.958
63 1HB ASN 23 1HB ASN 23 -3.379 -2.595 -7.398
64 2HB ASN 23 2HB ASN 23 -2.285 -2.301 -6.055
65 1HD2 ASN 23 1HD2 ASN 23 -3.069 -2.239 -3.984
66 2HD2 ASN 23 2HD2 ASN 23 -4.682 -2.702 -3.571
67 H ARG 24 H ARG 24 -2.479 1.628 -7.679
68 HA ARG 24 HA ARG 24 -0.497 0.592 -9.549
69 1HB ARG 24 1HB ARG 24 -2.636 2.539 -10.440
70 2HB ARG 24 2HB ARG 24 -1.360 1.849 -11.431
71 1HG ARG 24 1HG ARG 24 -3.047 -0.170 -10.180
72 2HG ARG 24 2HG ARG 24 -3.935 0.928 -11.233
73 1HD ARG 24 1HD ARG 24 -1.376 -0.368 -12.113
74 2HD ARG 24 2HD ARG 24 -2.926 -1.192 -12.268
75 HE ARG 24 HE ARG 24 -2.857 1.462 -13.398
76 1HH1 ARG 24 1HH1 ARG 24 -2.348 -1.941 -13.985
77 2HH1 ARG 24 2HH1 ARG 24 -2.567 -1.806 -15.697
78 1HH2 ARG 24 1HH2 ARG 24 -3.144 1.641 -15.649
79 2HH2 ARG 24 2HH2 ARG 24 -3.016 0.228 -16.643
80 H TYR 25 H TYR 25 -2.129 3.492 -8.353
81 HA TYR 25 HA TYR 25 -0.300 5.434 -8.929
82 1HB TYR 25 1HB TYR 25 -1.247 6.715 -7.084
83 2HB TYR 25 2HB TYR 25 -2.518 5.856 -7.947
84 HD1 TYR 25 HD1 TYR 25 -2.950 3.379 -6.905
85 HD2 TYR 25 HD2 TYR 25 -1.409 6.732 -4.788
86 HE1 TYR 25 HE1 TYR 25 -3.693 2.376 -4.794
87 HE2 TYR 25 HE2 TYR 25 -2.165 5.742 -2.670
88 HH TYR 25 HH TYR 25 -3.237 2.498 -2.432
89 H LEU 26 H LEU 26 -0.369 3.515 -5.914
90 HA LEU 26 HA LEU 26 2.431 4.315 -5.485
91 1HB LEU 26 1HB LEU 26 2.098 4.409 -3.190
92 2HB LEU 26 2HB LEU 26 0.624 5.105 -3.837
93 HG LEU 26 HG LEU 26 -0.377 2.739 -3.561
94 1HD1 LEU 26 1HD1 LEU 26 1.189 1.225 -2.991
95 2HD1 LEU 26 2HD1 LEU 26 0.893 1.827 -1.360
96 3HD1 LEU 26 3HD1 LEU 26 2.262 2.436 -2.291
97 1HD2 LEU 26 1HD2 LEU 26 -1.359 3.499 -1.686
98 2HD2 LEU 26 2HD2 LEU 26 -0.451 4.968 -2.036
99 3HD2 LEU 26 3HD2 LEU 26 0.176 3.800 -0.874
100 H THR 27 H THR 27 0.142 1.699 -5.568
101 HA THR 27 HA THR 27 1.380 -0.359 -4.331
102 HB THR 27 HB THR 27 -0.150 -0.296 -6.916
103 HG1 THR 27 HG1 THR 27 -0.740 -1.071 -4.260
104 1HG2 THR 27 1HG2 THR 27 0.473 -2.366 -7.398
105 2HG2 THR 27 2HG2 THR 27 -0.383 -2.869 -5.940
106 3HG2 THR 27 3HG2 THR 27 1.348 -2.537 -5.876
107 H GLU 28 H GLU 28 1.675 -0.354 -7.854
108 HA GLU 28 HA GLU 28 3.937 -1.890 -8.029
109 1HB GLU 28 1HB GLU 28 3.035 0.308 -9.890
110 2HB GLU 28 2HB GLU 28 4.250 -0.898 -10.289
111 1HG GLU 28 1HG GLU 28 2.692 -2.631 -10.321
112 2HG GLU 28 2HG GLU 28 1.497 -1.694 -9.426
113 H ARG 29 H ARG 29 3.766 1.599 -7.547
114 HA ARG 29 HA ARG 29 6.500 2.129 -8.036
115 1HB ARG 29 1HB ARG 29 4.187 3.580 -6.983
116 2HB ARG 29 2HB ARG 29 5.710 4.084 -6.264
117 1HG ARG 29 1HG ARG 29 6.403 4.042 -8.867
118 2HG ARG 29 2HG ARG 29 4.691 4.450 -8.998
119 1HD ARG 29 1HD ARG 29 6.026 6.470 -8.869
120 2HD ARG 29 2HD ARG 29 5.030 6.306 -7.424
121 HE ARG 29 HE ARG 29 6.936 6.104 -6.167
122 1HH1 ARG 29 1HH1 ARG 29 7.749 5.716 -9.539
123 2HH1 ARG 29 2HH1 ARG 29 9.457 5.745 -9.259
124 1HH2 ARG 29 1HH2 ARG 29 9.182 6.143 -5.797
125 2HH2 ARG 29 2HH2 ARG 29 10.271 5.987 -7.136
126 H ARG 30 H ARG 30 4.713 1.615 -5.006
127 HA ARG 30 HA ARG 30 7.118 1.715 -3.429
128 1HB ARG 30 1HB ARG 30 4.280 1.764 -2.942
129 2HB ARG 30 2HB ARG 30 5.049 0.583 -1.892
130 1HG ARG 30 1HG ARG 30 6.275 2.164 -0.777
131 2HG ARG 30 2HG ARG 30 6.256 3.292 -2.134
132 1HD ARG 30 1HD ARG 30 4.115 4.038 -1.649
133 2HD ARG 30 2HD ARG 30 3.712 2.592 -0.727
134 HE ARG 30 HE ARG 30 5.003 4.965 0.246
135 1HH1 ARG 30 1HH1 ARG 30 4.554 1.544 0.760
136 2HH1 ARG 30 2HH1 ARG 30 4.923 1.622 2.450
137 1HH2 ARG 30 1HH2 ARG 30 5.490 5.071 2.468
138 2HH2 ARG 30 2HH2 ARG 30 5.455 3.624 3.421
139 H ARG 31 H ARG 31 5.262 -0.741 -5.012
140 HA ARG 31 HA ARG 31 5.976 -2.970 -3.474
141 1HB ARG 31 1HB ARG 31 4.338 -2.638 -5.552
142 2HB ARG 31 2HB ARG 31 5.722 -3.283 -6.421
143 1HG ARG 31 1HG ARG 31 5.195 -4.848 -4.070
144 2HG ARG 31 2HG ARG 31 3.743 -4.708 -5.064
145 1HD ARG 31 1HD ARG 31 6.456 -5.704 -5.921
146 2HD ARG 31 2HD ARG 31 4.976 -6.650 -5.762
147 HE ARG 31 HE ARG 31 4.293 -4.771 -7.572
148 1HH1 ARG 31 1HH1 ARG 31 6.992 -6.975 -7.356
149 2HH1 ARG 31 2HH1 ARG 31 7.184 -7.104 -9.071
150 1HH2 ARG 31 1HH2 ARG 31 4.544 -4.941 -9.828
151 2HH2 ARG 31 2HH2 ARG 31 5.795 -5.950 -10.476
152 H GLN 32 H GLN 32 7.589 -1.441 -6.224
153 HA GLN 32 HA GLN 32 9.626 -3.362 -6.531
154 1HB GLN 32 1HB GLN 32 9.028 -1.618 -8.210
155 2HB GLN 32 2HB GLN 32 9.771 -0.411 -7.169
156 1HG GLN 32 1HG GLN 32 11.669 -2.463 -7.530
157 2HG GLN 32 2HG GLN 32 10.982 -2.106 -9.114
158 1HE2 GLN 32 1HE2 GLN 32 10.591 0.465 -9.228
159 2HE2 GLN 32 2HE2 GLN 32 12.031 1.371 -8.932
160 H GLN 33 H GLN 33 9.530 -0.318 -4.708
161 HA GLN 33 HA GLN 33 12.196 -0.617 -3.711
162 1HB GLN 33 1HB GLN 33 9.947 1.286 -3.262
163 2HB GLN 33 2HB GLN 33 11.227 1.219 -2.058
164 1HG GLN 33 1HG GLN 33 12.781 1.445 -4.155
165 2HG GLN 33 2HG GLN 33 11.328 2.120 -4.891
166 1HE2 GLN 33 1HE2 GLN 33 12.101 4.183 -5.064
167 2HE2 GLN 33 2HE2 GLN 33 12.403 5.201 -3.700
168 H LEU 34 H LEU 34 8.964 -1.249 -2.422
169 HA LEU 34 HA LEU 34 9.759 -1.821 0.219
170 1HB LEU 34 1HB LEU 34 7.365 -2.521 -1.433
171 2HB LEU 34 2HB LEU 34 7.575 -3.241 0.150
172 HG LEU 34 HG LEU 34 7.310 -0.301 -0.468
173 1HD1 LEU 34 1HD1 LEU 34 5.205 -0.410 0.508
174 2HD1 LEU 34 2HD1 LEU 34 5.543 -1.951 1.295
175 3HD1 LEU 34 3HD1 LEU 34 5.285 -1.890 -0.447
176 1HD2 LEU 34 1HD2 LEU 34 7.290 -0.100 2.051
177 2HD2 LEU 34 2HD2 LEU 34 8.859 -0.436 1.316
178 3HD2 LEU 34 3HD2 LEU 34 7.955 -1.733 2.098
179 H SER 35 H SER 35 9.419 -3.867 -2.638
180 HA SER 35 HA SER 35 9.892 -6.318 -1.309
181 1HB SER 35 1HB SER 35 9.734 -5.392 -4.109
182 2HB SER 35 2HB SER 35 10.730 -6.823 -3.849
183 HG SER 35 HG SER 35 8.962 -7.840 -2.908
184 H SER 36 H SER 36 12.031 -4.201 -3.215
185 HA SER 36 HA SER 36 14.371 -5.735 -2.759
186 1HB SER 36 1HB SER 36 14.270 -2.794 -3.442
187 2HB SER 36 2HB SER 36 15.563 -3.940 -3.798
188 HG SER 36 HG SER 36 13.403 -3.353 -5.257
189 H GLU 37 H GLU 37 12.972 -2.926 -1.135
190 HA GLU 37 HA GLU 37 15.169 -2.411 0.567
191 1HB GLU 37 1HB GLU 37 13.352 -0.787 0.080
192 2HB GLU 37 2HB GLU 37 12.255 -1.768 1.043
193 1HG GLU 37 1HG GLU 37 12.916 -0.059 2.475
194 2HG GLU 37 2HG GLU 37 13.911 -1.436 2.953
195 H LEU 38 H LEU 38 12.126 -4.170 1.121
196 HA LEU 38 HA LEU 38 13.023 -5.037 3.734
197 1HB LEU 38 1HB LEU 38 10.524 -5.505 2.131
198 2HB LEU 38 2HB LEU 38 10.831 -6.360 3.629
199 HG LEU 38 HG LEU 38 11.098 -3.432 3.803
200 1HD1 LEU 38 1HD1 LEU 38 8.508 -3.372 4.064
201 2HD1 LEU 38 2HD1 LEU 38 8.556 -4.755 2.969
202 3HD1 LEU 38 3HD1 LEU 38 9.238 -3.207 2.467
203 1HD2 LEU 38 1HD2 LEU 38 9.851 -3.827 5.884
204 2HD2 LEU 38 2HD2 LEU 38 11.278 -4.856 5.757
205 3HD2 LEU 38 3HD2 LEU 38 9.677 -5.525 5.443
206 H GLY 39 H GLY 39 13.291 -6.163 0.529
207 1HA GLY 39 1HA GLY 39 14.300 -8.054 -0.307
208 2HA GLY 39 2HA GLY 39 14.743 -8.472 1.341
209 H LEU 40 H LEU 40 11.446 -7.927 0.295
210 HA LEU 40 HA LEU 40 10.910 -10.790 0.730
211 1HB LEU 40 1HB LEU 40 8.488 -9.819 1.088
212 2HB LEU 40 2HB LEU 40 9.657 -9.858 2.394
213 HG LEU 40 HG LEU 40 10.222 -7.438 1.675
214 1HD1 LEU 40 1HD1 LEU 40 8.682 -7.858 -0.423
215 2HD1 LEU 40 2HD1 LEU 40 8.777 -6.273 0.344
216 3HD1 LEU 40 3HD1 LEU 40 7.419 -7.340 0.693
217 1HD2 LEU 40 1HD2 LEU 40 7.826 -8.414 3.150
218 2HD2 LEU 40 2HD2 LEU 40 8.030 -6.682 2.896
219 3HD2 LEU 40 3HD2 LEU 40 9.267 -7.599 3.755
220 H ASN 41 H ASN 41 9.223 -11.757 -0.538
221 HA ASN 41 HA ASN 41 9.272 -10.809 -3.274
222 1HB ASN 41 1HB ASN 41 9.364 -13.301 -2.244
223 2HB ASN 41 2HB ASN 41 7.635 -13.173 -2.553
224 1HD2 ASN 41 1HD2 ASN 41 7.005 -12.512 -4.742
225 2HD2 ASN 41 2HD2 ASN 41 7.966 -13.053 -6.071
226 H GLU 42 H GLU 42 7.339 -10.568 -4.555
227 HA GLU 42 HA GLU 42 5.464 -8.819 -3.544
228 1HB GLU 42 1HB GLU 42 5.930 -9.365 -5.972
229 2HB GLU 42 2HB GLU 42 4.924 -10.794 -5.766
230 1HG GLU 42 1HG GLU 42 3.830 -8.114 -5.054
231 2HG GLU 42 2HG GLU 42 3.924 -8.596 -6.747
232 H ALA 43 H ALA 43 5.521 -12.298 -3.451
233 HA ALA 43 HA ALA 43 2.833 -12.834 -2.860
234 1HB ALA 43 1HB ALA 43 4.987 -14.421 -1.539
235 2HB ALA 43 2HB ALA 43 4.878 -14.433 -3.300
236 3HB ALA 43 3HB ALA 43 3.508 -14.971 -2.329
237 H GLN 44 H GLN 44 5.480 -11.702 -0.904
238 HA GLN 44 HA GLN 44 4.023 -11.915 1.589
239 1HB GLN 44 1HB GLN 44 6.608 -10.488 0.930
240 2HB GLN 44 2HB GLN 44 5.986 -10.791 2.548
241 1HG GLN 44 1HG GLN 44 6.292 -13.179 0.870
242 2HG GLN 44 2HG GLN 44 7.793 -12.349 1.276
243 1HE2 GLN 44 1HE2 GLN 44 7.328 -11.439 3.774
244 2HE2 GLN 44 2HE2 GLN 44 7.084 -12.759 4.862
245 H ILE 45 H ILE 45 4.644 -9.647 -0.929
246 HA ILE 45 HA ILE 45 3.991 -7.250 0.390
247 HB ILE 45 HB ILE 45 3.882 -7.999 -2.531
248 1HG1 ILE 45 1HG1 ILE 45 6.098 -7.999 -1.270
249 2HG1 ILE 45 2HG1 ILE 45 6.021 -6.991 -2.711
250 1HG2 ILE 45 1HG2 ILE 45 3.771 -5.222 -1.381
251 2HG2 ILE 45 2HG2 ILE 45 2.370 -6.096 -1.996
252 3HG2 ILE 45 3HG2 ILE 45 3.693 -5.678 -3.081
253 1HD1 ILE 45 1HD1 ILE 45 5.591 -5.035 -1.233
254 2HD1 ILE 45 2HD1 ILE 45 7.169 -5.792 -1.012
255 3HD1 ILE 45 3HD1 ILE 45 5.876 -6.088 0.152
256 H LYS 46 H LYS 46 1.990 -9.605 -1.395
257 HA LYS 46 HA LYS 46 -0.361 -8.071 -1.464
258 1HB LYS 46 1HB LYS 46 -1.530 -10.074 -1.968
259 2HB LYS 46 2HB LYS 46 0.064 -10.248 -2.688
260 1HG LYS 46 1HG LYS 46 0.694 -11.529 -0.582
261 2HG LYS 46 2HG LYS 46 -1.034 -11.585 -0.238
262 1HD LYS 46 1HD LYS 46 -1.372 -12.610 -2.488
263 2HD LYS 46 2HD LYS 46 0.382 -12.690 -2.660
264 1HE LYS 46 1HE LYS 46 0.249 -13.924 -0.357
265 2HE LYS 46 2HE LYS 46 -1.423 -14.217 -0.835
266 1HZ LYS 46 1HZ LYS 46 0.511 -15.861 -1.478
267 2HZ LYS 46 2HZ LYS 46 0.672 -14.804 -2.789
268 3HZ LYS 46 3HZ LYS 46 -0.799 -15.591 -2.515
269 H ILE 47 H ILE 47 0.808 -10.402 0.928
270 HA ILE 47 HA ILE 47 -1.367 -10.073 2.746
271 HB ILE 47 HB ILE 47 1.259 -11.426 2.738
272 1HG1 ILE 47 1HG1 ILE 47 -0.502 -12.907 4.250
273 2HG1 ILE 47 2HG1 ILE 47 -1.576 -12.039 3.157
274 1HG2 ILE 47 1HG2 ILE 47 1.653 -10.169 4.723
275 2HG2 ILE 47 2HG2 ILE 47 1.197 -11.802 5.212
276 3HG2 ILE 47 3HG2 ILE 47 0.022 -10.490 5.319
277 1HD1 ILE 47 1HD1 ILE 47 -1.177 -13.764 1.792
278 2HD1 ILE 47 2HD1 ILE 47 0.315 -14.207 2.620
279 3HD1 ILE 47 3HD1 ILE 47 0.319 -12.903 1.433
280 H TRP 48 H TRP 48 1.864 -8.761 2.452
281 HA TRP 48 HA TRP 48 2.073 -7.269 4.779
282 1HB TRP 48 1HB TRP 48 3.916 -7.724 3.236
283 2HB TRP 48 2HB TRP 48 3.142 -6.761 1.993
284 HD1 TRP 48 HD1 TRP 48 5.709 -6.572 4.606
285 HE1 TRP 48 HE1 TRP 48 6.493 -4.145 4.898
286 HE3 TRP 48 HE3 TRP 48 1.999 -4.151 2.073
287 HZ2 TRP 48 HZ2 TRP 48 5.675 -1.565 4.189
288 HZ3 TRP 48 HZ3 TRP 48 2.072 -1.705 1.930
289 HH2 TRP 48 HH2 TRP 48 3.879 -0.444 2.954
290 H PHE 49 H PHE 49 0.902 -6.289 1.588
291 HA PHE 49 HA PHE 49 0.128 -3.685 2.445
292 1HB PHE 49 1HB PHE 49 -0.189 -5.272 -0.050
293 2HB PHE 49 2HB PHE 49 -1.278 -3.901 0.198
294 HD1 PHE 49 HD1 PHE 49 -0.457 -1.658 0.271
295 HD2 PHE 49 HD2 PHE 49 2.183 -4.940 -0.246
296 HE1 PHE 49 HE1 PHE 49 1.368 -0.094 -0.316
297 HE2 PHE 49 HE2 PHE 49 4.011 -3.400 -0.838
298 HZ PHE 49 HZ PHE 49 3.612 -0.979 -0.849
299 H GLN 50 H GLN 50 -1.576 -6.707 1.961
300 HA GLN 50 HA GLN 50 -4.146 -5.715 2.460
301 1HB GLN 50 1HB GLN 50 -3.906 -7.845 1.402
302 2HB GLN 50 2HB GLN 50 -2.951 -8.472 2.739
303 1HG GLN 50 1HG GLN 50 -4.749 -9.049 3.906
304 2HG GLN 50 2HG GLN 50 -5.588 -7.544 3.538
305 1HE2 GLN 50 1HE2 GLN 50 -5.321 -10.855 2.867
306 2HE2 GLN 50 2HE2 GLN 50 -6.467 -10.935 1.577
307 H ASN 51 H ASN 51 -1.544 -6.717 4.591
308 HA ASN 51 HA ASN 51 -3.221 -6.783 6.939
309 1HB ASN 51 1HB ASN 51 -0.881 -7.972 6.396
310 2HB ASN 51 2HB ASN 51 -0.272 -6.535 7.210
311 1HD2 ASN 51 1HD2 ASN 51 -2.708 -9.082 7.573
312 2HD2 ASN 51 2HD2 ASN 51 -2.534 -9.243 9.284
313 H LYS 52 H LYS 52 -1.017 -4.512 5.410
314 HA LYS 52 HA LYS 52 -0.942 -2.649 7.553
315 1HB LYS 52 1HB LYS 52 0.642 -2.860 5.525
316 2HB LYS 52 2HB LYS 52 -0.564 -1.916 4.661
317 1HG LYS 52 1HG LYS 52 -0.017 -0.006 5.714
318 2HG LYS 52 2HG LYS 52 0.283 -0.815 7.253
319 1HD LYS 52 1HD LYS 52 2.201 -1.457 5.120
320 2HD LYS 52 2HD LYS 52 2.218 0.225 5.652
321 1HE LYS 52 1HE LYS 52 3.223 -0.301 7.570
322 2HE LYS 52 2HE LYS 52 2.080 -1.605 7.892
323 1HZ LYS 52 1HZ LYS 52 4.714 -1.708 6.664
324 2HZ LYS 52 2HZ LYS 52 3.542 -2.722 5.986
325 3HZ LYS 52 3HZ LYS 52 3.923 -2.851 7.629
326 H ARG 53 H ARG 53 -3.118 -3.184 4.877
327 HA ARG 53 HA ARG 53 -4.440 -0.682 4.958
328 1HB ARG 53 1HB ARG 53 -5.135 -3.383 3.848
329 2HB ARG 53 2HB ARG 53 -6.326 -2.089 3.848
330 1HG ARG 53 1HG ARG 53 -4.518 -0.695 2.675
331 2HG ARG 53 2HG ARG 53 -3.720 -2.243 2.383
332 1HD ARG 53 1HD ARG 53 -6.581 -2.197 1.731
333 2HD ARG 53 2HD ARG 53 -5.590 -1.116 0.754
334 HE ARG 53 HE ARG 53 -4.523 -3.776 0.982
335 1HH1 ARG 53 1HH1 ARG 53 -6.701 -1.709 -0.798
336 2HH1 ARG 53 2HH1 ARG 53 -6.640 -2.674 -2.234
337 1HH2 ARG 53 1HH2 ARG 53 -4.443 -5.045 -0.906
338 2HH2 ARG 53 2HH2 ARG 53 -5.360 -4.568 -2.296
339 H ALA 54 H ALA 54 -4.695 -3.563 6.870
340 HA ALA 54 HA ALA 54 -7.305 -3.128 7.895
341 1HB ALA 54 1HB ALA 54 -4.978 -4.768 8.854
342 2HB ALA 54 2HB ALA 54 -6.461 -5.317 8.074
343 3HB ALA 54 3HB ALA 54 -6.510 -4.698 9.724
344 H LYS 55 H LYS 55 -4.244 -1.710 8.592
345 HA LYS 55 HA LYS 55 -5.328 -0.515 11.055
346 1HB LYS 55 1HB LYS 55 -3.096 -1.908 10.984
347 2HB LYS 55 2HB LYS 55 -2.421 -0.406 10.366
348 1HG LYS 55 1HG LYS 55 -4.045 0.080 12.696
349 2HG LYS 55 2HG LYS 55 -2.795 -1.119 13.029
350 1HD LYS 55 1HD LYS 55 -1.496 0.683 13.393
351 2HD LYS 55 2HD LYS 55 -1.381 0.728 11.633
352 1HE LYS 55 1HE LYS 55 -3.296 2.275 11.572
353 2HE LYS 55 2HE LYS 55 -3.349 2.257 13.334
354 1HZ LYS 55 1HZ LYS 55 -0.783 2.928 12.148
355 2HZ LYS 55 2HZ LYS 55 -1.565 3.599 13.488
356 3HZ LYS 55 3HZ LYS 55 -2.012 4.070 11.927
357 H ILE 56 H ILE 56 -6.493 0.945 9.548
358 HA ILE 56 HA ILE 56 -4.778 3.230 8.842
359 HB ILE 56 HB ILE 56 -7.170 2.354 7.225
360 1HG1 ILE 56 1HG1 ILE 56 -4.230 2.064 6.570
361 2HG1 ILE 56 2HG1 ILE 56 -5.296 0.743 7.040
362 1HG2 ILE 56 1HG2 ILE 56 -6.885 4.190 5.947
363 2HG2 ILE 56 2HG2 ILE 56 -5.130 4.170 6.118
364 3HG2 ILE 56 3HG2 ILE 56 -6.134 4.830 7.409
365 1HD1 ILE 56 1HD1 ILE 56 -6.169 2.371 4.744
366 2HD1 ILE 56 2HD1 ILE 56 -6.266 0.630 5.011
367 3HD1 ILE 56 3HD1 ILE 56 -4.743 1.361 4.503
368 H LYS 57 H LYS 57 -5.401 4.102 10.899
369 HA LYS 57 HA LYS 57 -8.123 5.226 10.873
370 1HB LYS 57 1HB LYS 57 -6.836 3.596 12.892
371 2HB LYS 57 2HB LYS 57 -7.301 5.158 13.550
372 1HG LYS 57 1HG LYS 57 -9.145 3.801 13.948
373 2HG LYS 57 2HG LYS 57 -9.592 4.713 12.503
374 1HD LYS 57 1HD LYS 57 -10.212 2.485 12.054
375 2HD LYS 57 2HD LYS 57 -8.704 2.737 11.171
376 1HE LYS 57 1HE LYS 57 -8.101 0.804 12.154
377 2HE LYS 57 2HE LYS 57 -7.746 1.846 13.531
378 1HZ LYS 57 1HZ LYS 57 -9.065 -0.035 14.218
379 2HZ LYS 57 2HZ LYS 57 -10.262 0.333 13.083
380 3HZ LYS 57 3HZ LYS 57 -9.980 1.380 14.380
381 H LYS 58 H LYS 58 -7.892 7.311 10.393
382 HA LYS 58 HA LYS 58 -5.996 8.891 11.976
383 1HB LYS 58 1HB LYS 58 -5.457 10.226 9.925
384 2HB LYS 58 2HB LYS 58 -4.838 8.582 9.905
385 1HG LYS 58 1HG LYS 58 -5.767 8.364 7.905
386 2HG LYS 58 2HG LYS 58 -7.334 8.383 8.715
387 1HD LYS 58 1HD LYS 58 -6.730 11.048 8.555
388 2HD LYS 58 2HD LYS 58 -6.048 10.420 7.053
389 1HE LYS 58 1HE LYS 58 -8.890 10.233 8.022
390 2HE LYS 58 2HE LYS 58 -8.286 11.055 6.584
391 1HZ LYS 58 1HZ LYS 58 -9.272 9.022 5.902
392 2HZ LYS 58 2HZ LYS 58 -8.416 8.129 7.057
393 3HZ LYS 58 3HZ LYS 58 -7.597 8.827 5.753
394 H SER 59 H SER 59 -6.440 11.356 11.344
395 HA SER 59 HA SER 59 -9.330 11.790 11.109
396 1HB SER 59 1HB SER 59 -8.342 11.746 13.562
397 2HB SER 59 2HB SER 59 -7.828 13.381 13.148
398 HG SER 59 HG SER 59 -9.860 13.505 14.047
Start of MODEL 15
1 1H ALA 16 1H ALA 16 -16.578 8.792 -4.223
2 2H ALA 16 2H ALA 16 -17.073 10.167 -3.321
3 3H ALA 16 3H ALA 16 -16.456 8.784 -2.513
4 HA ALA 16 HA ALA 16 -14.933 10.704 -2.727
5 1HB ALA 16 1HB ALA 16 -14.407 8.163 -2.432
6 2HB ALA 16 2HB ALA 16 -13.108 9.305 -2.780
7 3HB ALA 16 3HB ALA 16 -13.774 8.306 -4.071
8 H LYS 17 H LYS 17 -15.158 12.361 -4.153
9 HA LYS 17 HA LYS 17 -14.692 11.798 -6.999
10 1HB LYS 17 1HB LYS 17 -16.391 13.672 -5.555
11 2HB LYS 17 2HB LYS 17 -15.421 14.470 -6.786
12 1HG LYS 17 1HG LYS 17 -17.355 13.916 -7.920
13 2HG LYS 17 2HG LYS 17 -16.259 12.600 -8.346
14 1HD LYS 17 1HD LYS 17 -17.832 12.135 -5.913
15 2HD LYS 17 2HD LYS 17 -18.791 12.277 -7.388
16 1HE LYS 17 1HE LYS 17 -17.932 10.374 -8.292
17 2HE LYS 17 2HE LYS 17 -16.365 10.581 -7.510
18 1HZ LYS 17 1HZ LYS 17 -17.933 10.134 -5.401
19 2HZ LYS 17 2HZ LYS 17 -17.109 8.911 -6.228
20 3HZ LYS 17 3HZ LYS 17 -18.738 9.208 -6.567
21 H ARG 18 H ARG 18 -12.394 11.559 -6.573
22 HA ARG 18 HA ARG 18 -11.050 14.173 -6.509
23 1HB ARG 18 1HB ARG 18 -9.947 11.681 -5.207
24 2HB ARG 18 2HB ARG 18 -9.264 13.300 -5.152
25 1HG ARG 18 1HG ARG 18 -11.151 14.077 -3.840
26 2HG ARG 18 2HG ARG 18 -11.894 12.479 -3.936
27 1HD ARG 18 1HD ARG 18 -9.464 11.827 -2.965
28 2HD ARG 18 2HD ARG 18 -9.654 13.439 -2.275
29 HE ARG 18 HE ARG 18 -12.010 12.231 -1.703
30 1HH1 ARG 18 1HH1 ARG 18 -8.674 11.352 -1.173
31 2HH1 ARG 18 2HH1 ARG 18 -9.010 10.451 0.267
32 1HH2 ARG 18 1HH2 ARG 18 -12.453 11.047 0.190
33 2HH2 ARG 18 2HH2 ARG 18 -11.156 10.277 1.041
34 H GLU 19 H GLU 19 -8.852 14.101 -7.468
35 HA GLU 19 HA GLU 19 -8.673 12.057 -9.584
36 1HB GLU 19 1HB GLU 19 -8.169 15.025 -9.728
37 2HB GLU 19 2HB GLU 19 -7.532 13.910 -10.929
38 1HG GLU 19 1HG GLU 19 -10.124 13.168 -10.906
39 2HG GLU 19 2HG GLU 19 -10.272 14.879 -10.508
40 H PHE 20 H PHE 20 -7.249 10.808 -8.320
41 HA PHE 20 HA PHE 20 -4.497 11.748 -8.426
42 1HB PHE 20 1HB PHE 20 -3.997 11.245 -6.127
43 2HB PHE 20 2HB PHE 20 -5.370 12.347 -6.151
44 HD1 PHE 20 HD1 PHE 20 -4.410 8.800 -5.762
45 HD2 PHE 20 HD2 PHE 20 -7.411 11.752 -5.150
46 HE1 PHE 20 HE1 PHE 20 -5.684 7.210 -4.386
47 HE2 PHE 20 HE2 PHE 20 -8.693 10.168 -3.770
48 HZ PHE 20 HZ PHE 20 -7.830 7.893 -3.385
49 H ASN 21 H ASN 21 -3.077 9.823 -7.432
50 HA ASN 21 HA ASN 21 -3.639 7.562 -9.116
51 1HB ASN 21 1HB ASN 21 -1.414 7.935 -7.109
52 2HB ASN 21 2HB ASN 21 -1.483 6.727 -8.387
53 1HD2 ASN 21 1HD2 ASN 21 0.558 7.593 -9.064
54 2HD2 ASN 21 2HD2 ASN 21 0.606 9.017 -10.042
55 H GLU 22 H GLU 22 -5.315 6.335 -8.399
56 HA GLU 22 HA GLU 22 -5.999 5.823 -5.747
57 1HB GLU 22 1HB GLU 22 -6.800 4.887 -8.340
58 2HB GLU 22 2HB GLU 22 -6.672 3.516 -7.244
59 1HG GLU 22 1HG GLU 22 -8.505 4.098 -6.127
60 2HG GLU 22 2HG GLU 22 -8.027 5.794 -6.050
61 H ASN 23 H ASN 23 -4.117 3.807 -7.982
62 HA ASN 23 HA ASN 23 -2.541 2.823 -5.748
63 1HB ASN 23 1HB ASN 23 -3.652 0.806 -7.666
64 2HB ASN 23 2HB ASN 23 -2.902 0.548 -6.097
65 1HD2 ASN 23 1HD2 ASN 23 -4.097 1.051 -4.208
66 2HD2 ASN 23 2HD2 ASN 23 -5.824 1.080 -4.237
67 H ARG 24 H ARG 24 -1.011 4.124 -6.769
68 HA ARG 24 HA ARG 24 0.609 2.736 -8.688
69 1HB ARG 24 1HB ARG 24 -0.628 5.401 -9.434
70 2HB ARG 24 2HB ARG 24 0.663 4.605 -10.326
71 1HG ARG 24 1HG ARG 24 -0.954 2.649 -10.579
72 2HG ARG 24 2HG ARG 24 -2.201 3.773 -10.034
73 1HD ARG 24 1HD ARG 24 -1.705 5.265 -11.875
74 2HD ARG 24 2HD ARG 24 -0.373 4.233 -12.389
75 HE ARG 24 HE ARG 24 -2.795 2.770 -12.321
76 1HH1 ARG 24 1HH1 ARG 24 -1.097 5.178 -14.191
77 2HH1 ARG 24 2HH1 ARG 24 -1.873 4.750 -15.679
78 1HH2 ARG 24 1HH2 ARG 24 -3.818 2.207 -14.278
79 2HH2 ARG 24 2HH2 ARG 24 -3.417 3.065 -15.729
80 H TYR 25 H TYR 25 0.046 6.014 -7.455
81 HA TYR 25 HA TYR 25 2.518 7.067 -7.350
82 1HB TYR 25 1HB TYR 25 1.789 8.406 -5.438
83 2HB TYR 25 2HB TYR 25 0.486 8.237 -6.609
84 HD1 TYR 25 HD1 TYR 25 -1.022 6.012 -6.107
85 HD2 TYR 25 HD2 TYR 25 1.172 8.246 -3.225
86 HE1 TYR 25 HE1 TYR 25 -2.489 5.155 -4.338
87 HE2 TYR 25 HE2 TYR 25 -0.303 7.405 -1.449
88 HH TYR 25 HH TYR 25 -2.841 6.484 -1.444
89 H LEU 26 H LEU 26 1.158 5.011 -4.781
90 HA LEU 26 HA LEU 26 3.905 4.542 -3.840
91 1HB LEU 26 1HB LEU 26 3.228 4.602 -1.644
92 2HB LEU 26 2HB LEU 26 2.176 5.811 -2.355
93 HG LEU 26 HG LEU 26 0.476 3.843 -2.563
94 1HD1 LEU 26 1HD1 LEU 26 0.906 1.911 -1.543
95 2HD1 LEU 26 2HD1 LEU 26 1.512 2.718 -0.097
96 3HD1 LEU 26 3HD1 LEU 26 2.587 2.438 -1.465
97 1HD2 LEU 26 1HD2 LEU 26 0.844 5.895 -0.777
98 2HD2 LEU 26 2HD2 LEU 26 0.696 4.486 0.273
99 3HD2 LEU 26 3HD2 LEU 26 -0.581 4.863 -0.881
100 H THR 27 H THR 27 0.810 3.157 -4.652
101 HA THR 27 HA THR 27 0.998 0.607 -3.699
102 HB THR 27 HB THR 27 -0.126 1.651 -6.287
103 HG1 THR 27 HG1 THR 27 -1.106 2.200 -4.244
104 1HG2 THR 27 1HG2 THR 27 -1.444 -0.720 -5.713
105 2HG2 THR 27 2HG2 THR 27 0.271 -1.109 -5.588
106 3HG2 THR 27 3HG2 THR 27 -0.367 -0.399 -7.071
107 H GLU 28 H GLU 28 1.449 0.782 -7.173
108 HA GLU 28 HA GLU 28 3.252 -1.360 -7.256
109 1HB GLU 28 1HB GLU 28 2.902 0.766 -9.366
110 2HB GLU 28 2HB GLU 28 3.476 -0.880 -9.603
111 1HG GLU 28 1HG GLU 28 0.977 -1.133 -8.382
112 2HG GLU 28 2HG GLU 28 0.790 0.142 -9.585
113 H ARG 29 H ARG 29 3.794 2.109 -7.106
114 HA ARG 29 HA ARG 29 6.504 2.110 -7.851
115 1HB ARG 29 1HB ARG 29 4.590 4.000 -6.879
116 2HB ARG 29 2HB ARG 29 6.079 4.186 -5.961
117 1HG ARG 29 1HG ARG 29 6.958 5.333 -7.633
118 2HG ARG 29 2HG ARG 29 6.797 3.924 -8.682
119 1HD ARG 29 1HD ARG 29 4.242 4.904 -8.624
120 2HD ARG 29 2HD ARG 29 5.208 6.377 -8.563
121 HE ARG 29 HE ARG 29 6.081 4.547 -10.587
122 1HH1 ARG 29 1HH1 ARG 29 3.798 7.080 -9.847
123 2HH1 ARG 29 2HH1 ARG 29 3.577 7.537 -11.502
124 1HH2 ARG 29 1HH2 ARG 29 5.793 5.147 -12.766
125 2HH2 ARG 29 2HH2 ARG 29 4.710 6.439 -13.160
126 H ARG 30 H ARG 30 4.993 2.015 -4.636
127 HA ARG 30 HA ARG 30 7.547 1.696 -3.334
128 1HB ARG 30 1HB ARG 30 5.233 2.729 -2.467
129 2HB ARG 30 2HB ARG 30 5.041 1.088 -1.865
130 1HG ARG 30 1HG ARG 30 7.206 1.297 -0.701
131 2HG ARG 30 2HG ARG 30 7.309 2.970 -1.251
132 1HD ARG 30 1HD ARG 30 4.769 2.386 0.026
133 2HD ARG 30 2HD ARG 30 6.137 2.070 1.091
134 HE ARG 30 HE ARG 30 6.699 4.509 0.069
135 1HH1 ARG 30 1HH1 ARG 30 3.893 3.172 1.655
136 2HH1 ARG 30 2HH1 ARG 30 3.411 4.683 2.349
137 1HH2 ARG 30 1HH2 ARG 30 6.066 6.498 0.979
138 2HH2 ARG 30 2HH2 ARG 30 4.643 6.573 1.964
139 H ARG 31 H ARG 31 5.118 -0.380 -4.633
140 HA ARG 31 HA ARG 31 5.557 -2.693 -3.108
141 1HB ARG 31 1HB ARG 31 4.245 -2.006 -5.628
142 2HB ARG 31 2HB ARG 31 4.934 -3.624 -5.639
143 1HG ARG 31 1HG ARG 31 3.613 -4.314 -3.822
144 2HG ARG 31 2HG ARG 31 3.162 -2.656 -3.420
145 1HD ARG 31 1HD ARG 31 1.314 -3.792 -4.507
146 2HD ARG 31 2HD ARG 31 1.923 -2.495 -5.532
147 HE ARG 31 HE ARG 31 2.488 -4.057 -7.098
148 1HH1 ARG 31 1HH1 ARG 31 2.013 -5.672 -4.042
149 2HH1 ARG 31 2HH1 ARG 31 2.155 -7.260 -4.716
150 1HH2 ARG 31 1HH2 ARG 31 2.675 -6.145 -7.988
151 2HH2 ARG 31 2HH2 ARG 31 2.532 -7.529 -6.956
152 H GLN 32 H GLN 32 7.120 -1.518 -6.061
153 HA GLN 32 HA GLN 32 8.801 -3.799 -6.372
154 1HB GLN 32 1HB GLN 32 8.697 -1.062 -7.583
155 2HB GLN 32 2HB GLN 32 10.114 -2.070 -7.843
156 1HG GLN 32 1HG GLN 32 7.280 -2.810 -8.536
157 2HG GLN 32 2HG GLN 32 8.512 -2.260 -9.671
158 1HE2 GLN 32 1HE2 GLN 32 10.175 -3.640 -10.249
159 2HE2 GLN 32 2HE2 GLN 32 10.133 -5.335 -9.918
160 H GLN 33 H GLN 33 9.188 -0.630 -4.875
161 HA GLN 33 HA GLN 33 11.963 -0.985 -4.277
162 1HB GLN 33 1HB GLN 33 9.956 0.950 -3.109
163 2HB GLN 33 2HB GLN 33 11.702 1.048 -2.917
164 1HG GLN 33 1HG GLN 33 11.634 1.042 -5.556
165 2HG GLN 33 2HG GLN 33 10.009 1.665 -5.274
166 1HE2 GLN 33 1HE2 GLN 33 9.757 3.746 -4.742
167 2HE2 GLN 33 2HE2 GLN 33 11.050 4.856 -4.450
168 H LEU 34 H LEU 34 8.945 -1.595 -2.615
169 HA LEU 34 HA LEU 34 9.976 -1.963 -0.020
170 1HB LEU 34 1HB LEU 34 7.489 -2.767 -1.445
171 2HB LEU 34 2HB LEU 34 7.856 -3.549 0.081
172 HG LEU 34 HG LEU 34 7.496 -0.586 -0.360
173 1HD1 LEU 34 1HD1 LEU 34 5.424 -0.768 0.622
174 2HD1 LEU 34 2HD1 LEU 34 5.818 -2.289 1.422
175 3HD1 LEU 34 3HD1 LEU 34 5.501 -2.261 -0.312
176 1HD2 LEU 34 1HD2 LEU 34 7.569 -0.590 2.188
177 2HD2 LEU 34 2HD2 LEU 34 9.104 -0.765 1.339
178 3HD2 LEU 34 3HD2 LEU 34 8.323 -2.178 2.048
179 H SER 35 H SER 35 9.512 -4.195 -2.721
180 HA SER 35 HA SER 35 10.156 -6.560 -1.354
181 1HB SER 35 1HB SER 35 9.112 -6.642 -3.542
182 2HB SER 35 2HB SER 35 10.501 -5.838 -4.274
183 HG SER 35 HG SER 35 11.712 -7.642 -3.977
184 H SER 36 H SER 36 12.201 -4.473 -3.387
185 HA SER 36 HA SER 36 14.601 -5.876 -2.836
186 1HB SER 36 1HB SER 36 13.865 -3.333 -4.184
187 2HB SER 36 2HB SER 36 15.530 -3.484 -3.624
188 HG SER 36 HG SER 36 15.463 -5.593 -4.766
189 H GLU 37 H GLU 37 13.072 -3.042 -1.388
190 HA GLU 37 HA GLU 37 15.277 -2.334 0.256
191 1HB GLU 37 1HB GLU 37 13.399 -0.810 -0.409
192 2HB GLU 37 2HB GLU 37 12.365 -1.681 0.715
193 1HG GLU 37 1HG GLU 37 13.246 -0.670 2.511
194 2HG GLU 37 2HG GLU 37 14.883 -0.704 1.857
195 H LEU 38 H LEU 38 12.194 -3.961 1.021
196 HA LEU 38 HA LEU 38 13.170 -4.657 3.658
197 1HB LEU 38 1HB LEU 38 10.573 -5.035 2.209
198 2HB LEU 38 2HB LEU 38 10.898 -5.924 3.684
199 HG LEU 38 HG LEU 38 11.291 -3.718 4.828
200 1HD1 LEU 38 1HD1 LEU 38 10.475 -2.749 2.124
201 2HD1 LEU 38 2HD1 LEU 38 11.755 -2.165 3.187
202 3HD1 LEU 38 3HD1 LEU 38 10.068 -1.809 3.559
203 1HD2 LEU 38 1HD2 LEU 38 8.901 -3.184 5.010
204 2HD2 LEU 38 2HD2 LEU 38 9.200 -4.921 5.088
205 3HD2 LEU 38 3HD2 LEU 38 8.577 -4.200 3.604
206 H GLY 39 H GLY 39 13.362 -6.019 0.571
207 1HA GLY 39 1HA GLY 39 14.247 -8.025 -0.131
208 2HA GLY 39 2HA GLY 39 14.642 -8.367 1.549
209 H LEU 40 H LEU 40 11.421 -7.629 0.421
210 HA LEU 40 HA LEU 40 10.558 -10.297 1.275
211 1HB LEU 40 1HB LEU 40 9.361 -7.609 1.263
212 2HB LEU 40 2HB LEU 40 8.266 -8.904 0.814
213 HG LEU 40 HG LEU 40 9.829 -8.745 3.390
214 1HD1 LEU 40 1HD1 LEU 40 8.189 -7.212 3.752
215 2HD1 LEU 40 2HD1 LEU 40 7.285 -8.675 4.145
216 3HD1 LEU 40 3HD1 LEU 40 7.102 -7.925 2.556
217 1HD2 LEU 40 1HD2 LEU 40 8.330 -10.891 2.065
218 2HD2 LEU 40 2HD2 LEU 40 7.859 -10.593 3.739
219 3HD2 LEU 40 3HD2 LEU 40 9.536 -10.973 3.348
220 H ASN 41 H ASN 41 9.008 -11.454 0.057
221 HA ASN 41 HA ASN 41 9.381 -11.181 -2.812
222 1HB ASN 41 1HB ASN 41 9.577 -13.417 -1.818
223 2HB ASN 41 2HB ASN 41 7.939 -13.292 -1.182
224 1HD2 ASN 41 1HD2 ASN 41 9.170 -12.332 -4.344
225 2HD2 ASN 41 2HD2 ASN 41 8.176 -13.411 -5.257
226 H GLU 42 H GLU 42 7.652 -10.877 -4.279
227 HA GLU 42 HA GLU 42 5.716 -9.030 -3.602
228 1HB GLU 42 1HB GLU 42 5.544 -11.120 -5.788
229 2HB GLU 42 2HB GLU 42 4.585 -9.649 -5.702
230 1HG GLU 42 1HG GLU 42 6.503 -8.283 -6.041
231 2HG GLU 42 2HG GLU 42 7.587 -9.663 -5.859
232 H ALA 43 H ALA 43 5.652 -12.513 -3.380
233 HA ALA 43 HA ALA 43 2.892 -12.903 -2.983
234 1HB ALA 43 1HB ALA 43 4.980 -14.569 -3.254
235 2HB ALA 43 2HB ALA 43 3.420 -15.071 -2.600
236 3HB ALA 43 3HB ALA 43 4.746 -14.669 -1.509
237 H GLN 44 H GLN 44 5.515 -12.102 -0.777
238 HA GLN 44 HA GLN 44 3.884 -12.253 1.593
239 1HB GLN 44 1HB GLN 44 6.662 -11.295 0.964
240 2HB GLN 44 2HB GLN 44 5.932 -10.929 2.520
241 1HG GLN 44 1HG GLN 44 6.283 -13.703 1.409
242 2HG GLN 44 2HG GLN 44 7.379 -12.928 2.552
243 1HE2 GLN 44 1HE2 GLN 44 5.690 -11.708 4.278
244 2HE2 GLN 44 2HE2 GLN 44 4.724 -12.878 5.103
245 H ILE 45 H ILE 45 4.826 -9.918 -0.755
246 HA ILE 45 HA ILE 45 4.188 -7.564 0.637
247 HB ILE 45 HB ILE 45 4.389 -8.194 -2.298
248 1HG1 ILE 45 1HG1 ILE 45 6.306 -7.904 -0.320
249 2HG1 ILE 45 2HG1 ILE 45 6.586 -7.760 -2.053
250 1HG2 ILE 45 1HG2 ILE 45 4.013 -5.489 -1.028
251 2HG2 ILE 45 2HG2 ILE 45 2.839 -6.329 -2.040
252 3HG2 ILE 45 3HG2 ILE 45 4.369 -5.786 -2.727
253 1HD1 ILE 45 1HD1 ILE 45 7.523 -5.913 -0.706
254 2HD1 ILE 45 2HD1 ILE 45 5.878 -5.450 -0.261
255 3HD1 ILE 45 3HD1 ILE 45 6.389 -5.389 -1.950
256 H LYS 46 H LYS 46 2.256 -9.714 -1.421
257 HA LYS 46 HA LYS 46 -0.021 -8.124 -1.702
258 1HB LYS 46 1HB LYS 46 0.568 -10.485 -2.681
259 2HB LYS 46 2HB LYS 46 -0.262 -11.080 -1.249
260 1HG LYS 46 1HG LYS 46 -2.229 -9.671 -1.936
261 2HG LYS 46 2HG LYS 46 -1.390 -9.391 -3.463
262 1HD LYS 46 1HD LYS 46 -1.807 -11.474 -4.220
263 2HD LYS 46 2HD LYS 46 -1.566 -12.207 -2.633
264 1HE LYS 46 1HE LYS 46 -3.755 -12.183 -2.173
265 2HE LYS 46 2HE LYS 46 -3.946 -10.532 -2.763
266 1HZ LYS 46 1HZ LYS 46 -3.663 -11.769 -5.063
267 2HZ LYS 46 2HZ LYS 46 -5.169 -11.624 -4.308
268 3HZ LYS 46 3HZ LYS 46 -4.293 -13.064 -4.175
269 H ILE 47 H ILE 47 0.841 -10.458 0.808
270 HA ILE 47 HA ILE 47 -1.458 -10.024 2.444
271 HB ILE 47 HB ILE 47 1.116 -11.458 2.661
272 1HG1 ILE 47 1HG1 ILE 47 -0.751 -12.920 4.006
273 2HG1 ILE 47 2HG1 ILE 47 -1.775 -11.978 2.927
274 1HG2 ILE 47 1HG2 ILE 47 0.812 -11.809 5.132
275 2HG2 ILE 47 2HG2 ILE 47 -0.295 -10.437 5.115
276 3HG2 ILE 47 3HG2 ILE 47 1.396 -10.211 4.660
277 1HD1 ILE 47 1HD1 ILE 47 -1.370 -13.515 1.387
278 2HD1 ILE 47 2HD1 ILE 47 -0.101 -14.254 2.363
279 3HD1 ILE 47 3HD1 ILE 47 0.278 -12.894 1.305
280 H TRP 48 H TRP 48 1.791 -8.796 2.318
281 HA TRP 48 HA TRP 48 1.966 -7.316 4.649
282 1HB TRP 48 1HB TRP 48 3.826 -7.822 3.127
283 2HB TRP 48 2HB TRP 48 3.111 -6.796 1.900
284 HD1 TRP 48 HD1 TRP 48 5.587 -6.761 4.625
285 HE1 TRP 48 HE1 TRP 48 6.454 -4.372 4.977
286 HE3 TRP 48 HE3 TRP 48 2.097 -4.172 1.949
287 HZ2 TRP 48 HZ2 TRP 48 5.775 -1.754 4.256
288 HZ3 TRP 48 HZ3 TRP 48 2.277 -1.729 1.833
289 HH2 TRP 48 HH2 TRP 48 4.086 -0.550 2.952
290 H PHE 49 H PHE 49 0.901 -6.292 1.433
291 HA PHE 49 HA PHE 49 0.212 -3.667 2.281
292 1HB PHE 49 1HB PHE 49 -0.149 -5.227 -0.227
293 2HB PHE 49 2HB PHE 49 -1.149 -3.788 0.012
294 HD1 PHE 49 HD1 PHE 49 -0.175 -1.597 0.113
295 HD2 PHE 49 HD2 PHE 49 2.243 -5.051 -0.390
296 HE1 PHE 49 HE1 PHE 49 1.761 -0.161 -0.433
297 HE2 PHE 49 HE2 PHE 49 4.179 -3.632 -0.942
298 HZ PHE 49 HZ PHE 49 3.948 -1.193 -0.938
299 H GLN 50 H GLN 50 -1.644 -6.614 1.784
300 HA GLN 50 HA GLN 50 -4.152 -5.441 2.275
301 1HB GLN 50 1HB GLN 50 -3.143 -8.274 2.438
302 2HB GLN 50 2HB GLN 50 -4.801 -7.867 2.859
303 1HG GLN 50 1HG GLN 50 -4.457 -6.652 0.415
304 2HG GLN 50 2HG GLN 50 -3.549 -8.154 0.255
305 1HE2 GLN 50 1HE2 GLN 50 -4.699 -10.143 0.874
306 2HE2 GLN 50 2HE2 GLN 50 -6.389 -10.250 0.534
307 H ASN 51 H ASN 51 -1.630 -6.664 4.374
308 HA ASN 51 HA ASN 51 -3.284 -6.674 6.734
309 1HB ASN 51 1HB ASN 51 -0.488 -7.333 6.068
310 2HB ASN 51 2HB ASN 51 -0.727 -6.678 7.685
311 1HD2 ASN 51 1HD2 ASN 51 -1.867 -9.163 5.457
312 2HD2 ASN 51 2HD2 ASN 51 -2.294 -10.312 6.674
313 H LYS 52 H LYS 52 -1.009 -4.482 5.204
314 HA LYS 52 HA LYS 52 -0.805 -2.659 7.371
315 1HB LYS 52 1HB LYS 52 0.546 -2.976 5.046
316 2HB LYS 52 2HB LYS 52 -0.476 -1.606 4.628
317 1HG LYS 52 1HG LYS 52 1.428 -0.590 5.440
318 2HG LYS 52 2HG LYS 52 0.371 -0.598 6.853
319 1HD LYS 52 1HD LYS 52 1.662 -3.013 7.054
320 2HD LYS 52 2HD LYS 52 2.918 -1.958 6.402
321 1HE LYS 52 1HE LYS 52 3.261 -1.226 8.473
322 2HE LYS 52 2HE LYS 52 1.678 -0.455 8.395
323 1HZ LYS 52 1HZ LYS 52 0.935 -2.892 9.049
324 2HZ LYS 52 2HZ LYS 52 1.365 -1.742 10.213
325 3HZ LYS 52 3HZ LYS 52 2.482 -2.919 9.735
326 H ARG 53 H ARG 53 -3.086 -3.083 4.772
327 HA ARG 53 HA ARG 53 -4.325 -0.500 5.174
328 1HB ARG 53 1HB ARG 53 -4.171 -2.098 3.013
329 2HB ARG 53 2HB ARG 53 -5.737 -2.601 3.635
330 1HG ARG 53 1HG ARG 53 -6.403 -0.187 3.652
331 2HG ARG 53 2HG ARG 53 -4.896 0.164 2.804
332 1HD ARG 53 1HD ARG 53 -5.580 -1.368 1.004
333 2HD ARG 53 2HD ARG 53 -7.103 -1.655 1.845
334 HE ARG 53 HE ARG 53 -6.426 0.605 0.232
335 1HH1 ARG 53 1HH1 ARG 53 -8.352 -0.440 2.948
336 2HH1 ARG 53 2HH1 ARG 53 -9.535 0.810 2.749
337 1HH2 ARG 53 1HH2 ARG 53 -7.981 2.249 -0.031
338 2HH2 ARG 53 2HH2 ARG 53 -9.325 2.335 1.059
339 H ALA 54 H ALA 54 -4.328 -3.138 7.045
340 HA ALA 54 HA ALA 54 -7.165 -3.389 7.529
341 1HB ALA 54 1HB ALA 54 -5.267 -4.497 9.495
342 2HB ALA 54 2HB ALA 54 -5.125 -5.114 7.848
343 3HB ALA 54 3HB ALA 54 -6.658 -5.244 8.709
344 H LYS 55 H LYS 55 -4.387 -2.416 9.552
345 HA LYS 55 HA LYS 55 -6.016 -1.304 11.595
346 1HB LYS 55 1HB LYS 55 -3.913 -0.403 12.494
347 2HB LYS 55 2HB LYS 55 -3.759 -2.100 12.060
348 1HG LYS 55 1HG LYS 55 -1.899 -1.487 11.004
349 2HG LYS 55 2HG LYS 55 -2.971 -0.834 9.764
350 1HD LYS 55 1HD LYS 55 -1.758 1.044 10.172
351 2HD LYS 55 2HD LYS 55 -2.968 1.242 11.443
352 1HE LYS 55 1HE LYS 55 -0.747 1.619 12.338
353 2HE LYS 55 2HE LYS 55 -1.445 0.160 13.038
354 1HZ LYS 55 1HZ LYS 55 0.073 -1.152 12.043
355 2HZ LYS 55 2HZ LYS 55 1.004 0.260 12.034
356 3HZ LYS 55 3HZ LYS 55 0.163 -0.205 10.643
357 H ILE 56 H ILE 56 -4.559 -0.029 8.688
358 HA ILE 56 HA ILE 56 -4.805 1.954 7.599
359 HB ILE 56 HB ILE 56 -7.005 2.567 9.574
360 1HG1 ILE 56 1HG1 ILE 56 -7.706 1.553 6.894
361 2HG1 ILE 56 2HG1 ILE 56 -6.955 0.369 7.958
362 1HG2 ILE 56 1HG2 ILE 56 -6.217 4.474 8.252
363 2HG2 ILE 56 2HG2 ILE 56 -7.864 4.014 7.821
364 3HG2 ILE 56 3HG2 ILE 56 -6.521 3.565 6.771
365 1HD1 ILE 56 1HD1 ILE 56 -8.684 1.036 9.682
366 2HD1 ILE 56 2HD1 ILE 56 -9.264 0.143 8.275
367 3HD1 ILE 56 3HD1 ILE 56 -9.505 1.887 8.373
368 H LYS 57 H LYS 57 -2.930 3.000 8.032
369 HA LYS 57 HA LYS 57 -2.481 4.282 10.585
370 1HB LYS 57 1HB LYS 57 -0.888 3.734 8.147
371 2HB LYS 57 2HB LYS 57 -0.434 5.160 9.067
372 1HG LYS 57 1HG LYS 57 -0.848 2.771 10.702
373 2HG LYS 57 2HG LYS 57 0.467 2.635 9.533
374 1HD LYS 57 1HD LYS 57 0.933 5.109 10.533
375 2HD LYS 57 2HD LYS 57 0.237 4.310 11.944
376 1HE LYS 57 1HE LYS 57 2.116 3.177 12.306
377 2HE LYS 57 2HE LYS 57 2.136 2.581 10.647
378 1HZ LYS 57 1HZ LYS 57 3.034 5.319 11.291
379 2HZ LYS 57 2HZ LYS 57 3.403 4.376 9.937
380 3HZ LYS 57 3HZ LYS 57 4.084 4.001 11.438
381 H LYS 58 H LYS 58 -1.616 6.598 10.531
382 HA LYS 58 HA LYS 58 -2.462 8.392 8.523
383 1HB LYS 58 1HB LYS 58 -4.632 7.554 9.810
384 2HB LYS 58 2HB LYS 58 -4.131 8.782 10.964
385 1HG LYS 58 1HG LYS 58 -4.890 10.423 9.677
386 2HG LYS 58 2HG LYS 58 -4.055 9.790 8.257
387 1HD LYS 58 1HD LYS 58 -6.099 8.001 8.553
388 2HD LYS 58 2HD LYS 58 -6.852 9.506 9.086
389 1HE LYS 58 1HE LYS 58 -6.783 10.426 7.022
390 2HE LYS 58 2HE LYS 58 -5.237 9.677 6.625
391 1HZ LYS 58 1HZ LYS 58 -7.648 8.004 6.822
392 2HZ LYS 58 2HZ LYS 58 -6.249 7.763 5.902
393 3HZ LYS 58 3HZ LYS 58 -7.386 8.919 5.423
394 H SER 59 H SER 59 -2.382 10.717 9.349
395 HA SER 59 HA SER 59 -0.947 11.179 11.795
396 1HB SER 59 1HB SER 59 1.099 12.029 10.831
397 2HB SER 59 2HB SER 59 0.849 10.386 10.240
398 HG SER 59 HG SER 59 0.312 11.158 8.276
Start of MODEL 16
1 1H ALA 16 1H ALA 16 -14.165 19.424 -2.207
2 2H ALA 16 2H ALA 16 -13.972 19.748 -3.881
3 3H ALA 16 3H ALA 16 -13.223 18.373 -3.177
4 HA ALA 16 HA ALA 16 -15.574 17.718 -2.536
5 1HB ALA 16 1HB ALA 16 -16.085 19.601 -4.835
6 2HB ALA 16 2HB ALA 16 -16.610 19.830 -3.167
7 3HB ALA 16 3HB ALA 16 -17.263 18.499 -4.122
8 H LYS 17 H LYS 17 -13.738 18.378 -5.469
9 HA LYS 17 HA LYS 17 -14.585 15.886 -6.694
10 1HB LYS 17 1HB LYS 17 -12.611 17.978 -7.626
11 2HB LYS 17 2HB LYS 17 -13.135 16.590 -8.569
12 1HG LYS 17 1HG LYS 17 -15.473 17.467 -8.391
13 2HG LYS 17 2HG LYS 17 -14.794 18.930 -7.676
14 1HD LYS 17 1HD LYS 17 -14.728 19.646 -9.811
15 2HD LYS 17 2HD LYS 17 -13.249 18.686 -9.884
16 1HE LYS 17 1HE LYS 17 -15.177 16.814 -10.390
17 2HE LYS 17 2HE LYS 17 -15.846 18.250 -11.164
18 1HZ LYS 17 1HZ LYS 17 -13.668 18.504 -12.306
19 2HZ LYS 17 2HZ LYS 17 -14.517 17.109 -12.749
20 3HZ LYS 17 3HZ LYS 17 -13.207 16.999 -11.685
21 H ARG 18 H ARG 18 -13.713 14.099 -5.851
22 HA ARG 18 HA ARG 18 -10.899 14.116 -5.041
23 1HB ARG 18 1HB ARG 18 -12.997 11.982 -4.610
24 2HB ARG 18 2HB ARG 18 -11.386 12.018 -3.904
25 1HG ARG 18 1HG ARG 18 -12.338 14.401 -3.067
26 2HG ARG 18 2HG ARG 18 -13.827 13.456 -3.126
27 1HD ARG 18 1HD ARG 18 -12.877 13.255 -0.932
28 2HD ARG 18 2HD ARG 18 -12.710 11.708 -1.763
29 HE ARG 18 HE ARG 18 -10.354 12.928 -2.268
30 1HH1 ARG 18 1HH1 ARG 18 -12.134 12.323 0.672
31 2HH1 ARG 18 2HH1 ARG 18 -10.714 12.217 1.658
32 1HH2 ARG 18 1HH2 ARG 18 -8.485 12.789 -0.975
33 2HH2 ARG 18 2HH2 ARG 18 -8.642 12.483 0.724
34 H GLU 19 H GLU 19 -9.428 13.442 -6.437
35 HA GLU 19 HA GLU 19 -10.035 11.164 -8.172
36 1HB GLU 19 1HB GLU 19 -10.191 13.637 -9.224
37 2HB GLU 19 2HB GLU 19 -8.468 13.350 -9.421
38 1HG GLU 19 1HG GLU 19 -9.492 11.022 -10.355
39 2HG GLU 19 2HG GLU 19 -10.755 12.162 -10.815
40 H PHE 20 H PHE 20 -8.659 9.808 -7.105
41 HA PHE 20 HA PHE 20 -5.810 10.382 -7.419
42 1HB PHE 20 1HB PHE 20 -5.291 9.672 -5.148
43 2HB PHE 20 2HB PHE 20 -6.404 11.038 -5.110
44 HD1 PHE 20 HD1 PHE 20 -6.089 7.410 -4.627
45 HD2 PHE 20 HD2 PHE 20 -8.594 10.820 -4.202
46 HE1 PHE 20 HE1 PHE 20 -7.623 6.098 -3.222
47 HE2 PHE 20 HE2 PHE 20 -10.135 9.517 -2.793
48 HZ PHE 20 HZ PHE 20 -9.651 7.153 -2.302
49 H ASN 21 H ASN 21 -4.673 8.225 -6.355
50 HA ASN 21 HA ASN 21 -5.788 6.022 -7.947
51 1HB ASN 21 1HB ASN 21 -3.012 6.548 -6.898
52 2HB ASN 21 2HB ASN 21 -3.489 5.054 -7.694
53 1HD2 ASN 21 1HD2 ASN 21 -2.411 8.227 -8.102
54 2HD2 ASN 21 2HD2 ASN 21 -2.530 8.310 -9.823
55 H GLU 22 H GLU 22 -6.810 4.446 -6.906
56 HA GLU 22 HA GLU 22 -6.808 4.261 -4.062
57 1HB GLU 22 1HB GLU 22 -8.093 2.744 -6.292
58 2HB GLU 22 2HB GLU 22 -8.077 2.037 -4.682
59 1HG GLU 22 1HG GLU 22 -9.680 3.392 -3.954
60 2HG GLU 22 2HG GLU 22 -8.920 4.814 -4.668
61 H ASN 23 H ASN 23 -4.839 2.881 -6.510
62 HA ASN 23 HA ASN 23 -3.133 1.619 -4.641
63 1HB ASN 23 1HB ASN 23 -5.355 0.077 -5.495
64 2HB ASN 23 2HB ASN 23 -3.911 -0.606 -6.221
65 1HD2 ASN 23 1HD2 ASN 23 -4.229 1.029 -3.117
66 2HD2 ASN 23 2HD2 ASN 23 -3.767 -0.327 -2.151
67 H ARG 24 H ARG 24 -2.764 3.408 -6.636
68 HA ARG 24 HA ARG 24 -1.084 1.925 -8.542
69 1HB ARG 24 1HB ARG 24 -2.626 4.449 -9.159
70 2HB ARG 24 2HB ARG 24 -1.653 3.512 -10.287
71 1HG ARG 24 1HG ARG 24 -3.894 2.140 -8.905
72 2HG ARG 24 2HG ARG 24 -4.281 3.295 -10.183
73 1HD ARG 24 1HD ARG 24 -2.248 1.125 -10.590
74 2HD ARG 24 2HD ARG 24 -3.969 0.830 -10.830
75 HE ARG 24 HE ARG 24 -2.968 3.122 -12.251
76 1HH1 ARG 24 1HH1 ARG 24 -3.455 -0.332 -12.359
77 2HH1 ARG 24 2HH1 ARG 24 -3.456 -0.404 -14.089
78 1HH2 ARG 24 1HH2 ARG 24 -2.967 3.030 -14.526
79 2HH2 ARG 24 2HH2 ARG 24 -3.177 1.504 -15.320
80 H TYR 25 H TYR 25 -1.691 5.017 -6.978
81 HA TYR 25 HA TYR 25 0.514 6.484 -7.603
82 1HB TYR 25 1HB TYR 25 0.155 7.687 -5.515
83 2HB TYR 25 2HB TYR 25 -1.395 7.281 -6.245
84 HD1 TYR 25 HD1 TYR 25 -2.277 4.832 -5.434
85 HD2 TYR 25 HD2 TYR 25 0.291 7.415 -3.229
86 HE1 TYR 25 HE1 TYR 25 -2.943 3.708 -3.354
87 HE2 TYR 25 HE2 TYR 25 -0.379 6.302 -1.141
88 HH TYR 25 HH TYR 25 -3.020 4.121 -0.984
89 H LEU 26 H LEU 26 0.268 4.152 -4.918
90 HA LEU 26 HA LEU 26 3.202 4.237 -4.707
91 1HB LEU 26 1HB LEU 26 2.996 4.665 -2.539
92 2HB LEU 26 2HB LEU 26 1.268 4.822 -2.778
93 HG LEU 26 HG LEU 26 2.640 2.223 -2.087
94 1HD1 LEU 26 1HD1 LEU 26 2.307 2.593 0.131
95 2HD1 LEU 26 2HD1 LEU 26 0.955 3.694 -0.138
96 3HD1 LEU 26 3HD1 LEU 26 2.608 4.251 -0.391
97 1HD2 LEU 26 1HD2 LEU 26 -0.090 2.988 -2.796
98 2HD2 LEU 26 2HD2 LEU 26 0.026 2.072 -1.292
99 3HD2 LEU 26 3HD2 LEU 26 0.680 1.402 -2.787
100 H THR 27 H THR 27 0.473 2.241 -5.267
101 HA THR 27 HA THR 27 1.193 -0.193 -4.263
102 HB THR 27 HB THR 27 -0.196 0.549 -6.820
103 HG1 THR 27 HG1 THR 27 -1.903 -0.563 -5.531
104 1HG2 THR 27 1HG2 THR 27 0.499 -2.199 -5.873
105 2HG2 THR 27 2HG2 THR 27 0.554 -1.530 -7.505
106 3HG2 THR 27 3HG2 THR 27 -0.999 -1.897 -6.753
107 H GLU 28 H GLU 28 1.648 0.195 -7.747
108 HA GLU 28 HA GLU 28 3.744 -1.656 -7.889
109 1HB GLU 28 1HB GLU 28 3.179 0.541 -9.877
110 2HB GLU 28 2HB GLU 28 3.979 -0.994 -10.186
111 1HG GLU 28 1HG GLU 28 1.853 -2.143 -9.588
112 2HG GLU 28 2HG GLU 28 1.085 -0.558 -9.492
113 H ARG 29 H ARG 29 3.800 1.852 -7.528
114 HA ARG 29 HA ARG 29 6.551 2.191 -8.099
115 1HB ARG 29 1HB ARG 29 4.695 3.962 -8.001
116 2HB ARG 29 2HB ARG 29 4.966 3.973 -6.264
117 1HG ARG 29 1HG ARG 29 7.292 4.332 -8.086
118 2HG ARG 29 2HG ARG 29 6.182 5.680 -7.828
119 1HD ARG 29 1HD ARG 29 6.909 6.033 -5.734
120 2HD ARG 29 2HD ARG 29 6.995 4.309 -5.372
121 HE ARG 29 HE ARG 29 9.217 4.333 -5.934
122 1HH1 ARG 29 1HH1 ARG 29 7.729 7.283 -7.059
123 2HH1 ARG 29 2HH1 ARG 29 9.233 8.023 -7.493
124 1HH2 ARG 29 1HH2 ARG 29 11.196 5.306 -6.505
125 2HH2 ARG 29 2HH2 ARG 29 11.201 6.901 -7.179
126 H ARG 30 H ARG 30 4.810 1.928 -5.005
127 HA ARG 30 HA ARG 30 7.268 1.939 -3.499
128 1HB ARG 30 1HB ARG 30 4.802 2.699 -2.835
129 2HB ARG 30 2HB ARG 30 4.719 1.040 -2.257
130 1HG ARG 30 1HG ARG 30 6.453 1.378 -0.711
131 2HG ARG 30 2HG ARG 30 6.950 2.888 -1.476
132 1HD ARG 30 1HD ARG 30 4.395 3.481 -0.862
133 2HD ARG 30 2HD ARG 30 4.770 2.352 0.438
134 HE ARG 30 HE ARG 30 6.806 4.320 0.126
135 1HH1 ARG 30 1HH1 ARG 30 3.626 3.783 1.458
136 2HH1 ARG 30 2HH1 ARG 30 3.792 5.006 2.673
137 1HH2 ARG 30 1HH2 ARG 30 7.026 5.930 1.723
138 2HH2 ARG 30 2HH2 ARG 30 5.720 6.225 2.823
139 H ARG 31 H ARG 31 5.128 -0.456 -4.837
140 HA ARG 31 HA ARG 31 5.787 -2.651 -3.244
141 1HB ARG 31 1HB ARG 31 4.747 -2.304 -6.016
142 2HB ARG 31 2HB ARG 31 5.340 -3.893 -5.553
143 1HG ARG 31 1HG ARG 31 3.737 -4.101 -3.833
144 2HG ARG 31 2HG ARG 31 3.297 -2.395 -3.939
145 1HD ARG 31 1HD ARG 31 1.606 -3.804 -4.988
146 2HD ARG 31 2HD ARG 31 2.390 -2.760 -6.174
147 HE ARG 31 HE ARG 31 3.808 -5.089 -6.278
148 1HH1 ARG 31 1HH1 ARG 31 0.437 -4.254 -6.631
149 2HH1 ARG 31 2HH1 ARG 31 0.102 -5.549 -7.729
150 1HH2 ARG 31 1HH2 ARG 31 3.369 -6.793 -7.723
151 2HH2 ARG 31 2HH2 ARG 31 1.766 -6.991 -8.349
152 H GLN 32 H GLN 32 7.374 -1.314 -6.098
153 HA GLN 32 HA GLN 32 9.272 -3.373 -6.440
154 1HB GLN 32 1HB GLN 32 9.338 -0.461 -7.238
155 2HB GLN 32 2HB GLN 32 10.541 -1.641 -7.741
156 1HG GLN 32 1HG GLN 32 8.892 -2.896 -8.946
157 2HG GLN 32 2HG GLN 32 7.598 -1.873 -8.324
158 1HE2 GLN 32 1HE2 GLN 32 10.780 -1.056 -9.642
159 2HE2 GLN 32 2HE2 GLN 32 10.189 -0.064 -10.925
160 H GLN 33 H GLN 33 9.413 -0.292 -4.687
161 HA GLN 33 HA GLN 33 12.114 -0.681 -3.825
162 1HB GLN 33 1HB GLN 33 9.953 1.297 -3.245
163 2HB GLN 33 2HB GLN 33 11.328 1.206 -2.153
164 1HG GLN 33 1HG GLN 33 12.691 1.355 -4.399
165 2HG GLN 33 2HG GLN 33 11.203 2.101 -4.982
166 1HE2 GLN 33 1HE2 GLN 33 11.169 4.216 -4.830
167 2HE2 GLN 33 2HE2 GLN 33 11.996 5.174 -3.654
168 H LEU 34 H LEU 34 8.929 -1.211 -2.407
169 HA LEU 34 HA LEU 34 9.794 -1.786 0.210
170 1HB LEU 34 1HB LEU 34 7.326 -2.259 -1.367
171 2HB LEU 34 2HB LEU 34 7.545 -3.219 0.084
172 HG LEU 34 HG LEU 34 7.689 -0.208 0.081
173 1HD1 LEU 34 1HD1 LEU 34 5.497 -0.467 -0.524
174 2HD1 LEU 34 2HD1 LEU 34 5.367 -0.584 1.231
175 3HD1 LEU 34 3HD1 LEU 34 5.354 -2.048 0.247
176 1HD2 LEU 34 1HD2 LEU 34 6.934 -0.913 2.548
177 2HD2 LEU 34 2HD2 LEU 34 8.623 -0.760 2.067
178 3HD2 LEU 34 3HD2 LEU 34 7.860 -2.350 2.112
179 H SER 35 H SER 35 9.375 -3.806 -2.643
180 HA SER 35 HA SER 35 9.772 -6.290 -1.359
181 1HB SER 35 1HB SER 35 9.501 -5.316 -4.081
182 2HB SER 35 2HB SER 35 10.720 -6.584 -3.975
183 HG SER 35 HG SER 35 8.599 -7.411 -4.313
184 H SER 36 H SER 36 12.010 -4.238 -3.225
185 HA SER 36 HA SER 36 14.294 -5.832 -2.700
186 1HB SER 36 1HB SER 36 14.041 -2.951 -3.587
187 2HB SER 36 2HB SER 36 15.563 -3.841 -3.533
188 HG SER 36 HG SER 36 14.999 -4.370 -5.496
189 H GLU 37 H GLU 37 12.963 -2.941 -1.154
190 HA GLU 37 HA GLU 37 15.122 -2.462 0.591
191 1HB GLU 37 1HB GLU 37 12.207 -1.716 0.702
192 2HB GLU 37 2HB GLU 37 13.339 -1.238 1.960
193 1HG GLU 37 1HG GLU 37 13.796 -0.600 -0.936
194 2HG GLU 37 2HG GLU 37 12.865 0.449 0.133
195 H LEU 38 H LEU 38 12.084 -4.238 1.062
196 HA LEU 38 HA LEU 38 12.899 -5.084 3.710
197 1HB LEU 38 1HB LEU 38 10.468 -5.643 2.025
198 2HB LEU 38 2HB LEU 38 10.737 -6.416 3.576
199 HG LEU 38 HG LEU 38 10.562 -3.428 3.189
200 1HD1 LEU 38 1HD1 LEU 38 8.332 -3.468 3.686
201 2HD1 LEU 38 2HD1 LEU 38 8.432 -5.015 4.527
202 3HD1 LEU 38 3HD1 LEU 38 8.469 -4.967 2.765
203 1HD2 LEU 38 1HD2 LEU 38 11.677 -4.833 5.253
204 2HD2 LEU 38 2HD2 LEU 38 10.019 -4.604 5.810
205 3HD2 LEU 38 3HD2 LEU 38 11.002 -3.207 5.372
206 H GLY 39 H GLY 39 13.244 -6.223 0.509
207 1HA GLY 39 1HA GLY 39 14.318 -8.091 -0.299
208 2HA GLY 39 2HA GLY 39 14.739 -8.491 1.360
209 H LEU 40 H LEU 40 11.434 -8.021 0.335
210 HA LEU 40 HA LEU 40 10.974 -10.904 0.724
211 1HB LEU 40 1HB LEU 40 8.517 -9.959 1.053
212 2HB LEU 40 2HB LEU 40 9.664 -10.058 2.377
213 HG LEU 40 HG LEU 40 10.248 -7.622 1.815
214 1HD1 LEU 40 1HD1 LEU 40 7.515 -7.444 0.662
215 2HD1 LEU 40 2HD1 LEU 40 8.839 -7.934 -0.395
216 3HD1 LEU 40 3HD1 LEU 40 8.907 -6.384 0.442
217 1HD2 LEU 40 1HD2 LEU 40 9.169 -7.695 3.797
218 2HD2 LEU 40 2HD2 LEU 40 7.875 -8.721 3.177
219 3HD2 LEU 40 3HD2 LEU 40 7.854 -6.985 2.861
220 H ASN 41 H ASN 41 9.219 -11.855 -0.516
221 HA ASN 41 HA ASN 41 9.283 -10.918 -3.261
222 1HB ASN 41 1HB ASN 41 9.385 -13.411 -2.236
223 2HB ASN 41 2HB ASN 41 7.653 -13.286 -2.529
224 1HD2 ASN 41 1HD2 ASN 41 7.007 -12.610 -4.710
225 2HD2 ASN 41 2HD2 ASN 41 7.953 -13.152 -6.050
226 H GLU 42 H GLU 42 7.341 -10.671 -4.529
227 HA GLU 42 HA GLU 42 5.472 -8.925 -3.508
228 1HB GLU 42 1HB GLU 42 5.075 -10.917 -5.752
229 2HB GLU 42 2HB GLU 42 4.095 -9.482 -5.479
230 1HG GLU 42 1HG GLU 42 6.010 -8.059 -5.905
231 2HG GLU 42 2HG GLU 42 7.040 -9.477 -6.104
232 H ALA 43 H ALA 43 5.546 -12.401 -3.379
233 HA ALA 43 HA ALA 43 2.864 -12.946 -2.768
234 1HB ALA 43 1HB ALA 43 4.989 -14.517 -1.402
235 2HB ALA 43 2HB ALA 43 4.958 -14.522 -3.166
236 3HB ALA 43 3HB ALA 43 3.550 -15.069 -2.258
237 H GLN 44 H GLN 44 5.546 -11.854 -0.806
238 HA GLN 44 HA GLN 44 4.106 -11.983 1.693
239 1HB GLN 44 1HB GLN 44 6.753 -10.860 0.813
240 2HB GLN 44 2HB GLN 44 6.115 -10.509 2.413
241 1HG GLN 44 1HG GLN 44 6.037 -13.341 1.798
242 2HG GLN 44 2HG GLN 44 7.666 -12.673 1.699
243 1HE2 GLN 44 1HE2 GLN 44 5.051 -11.616 3.806
244 2HE2 GLN 44 2HE2 GLN 44 5.835 -12.026 5.290
245 H ILE 45 H ILE 45 4.692 -9.764 -0.874
246 HA ILE 45 HA ILE 45 4.032 -7.339 0.393
247 HB ILE 45 HB ILE 45 3.959 -8.184 -2.502
248 1HG1 ILE 45 1HG1 ILE 45 6.161 -8.078 -1.310
249 2HG1 ILE 45 2HG1 ILE 45 6.033 -6.977 -2.681
250 1HG2 ILE 45 1HG2 ILE 45 3.774 -5.352 -1.530
251 2HG2 ILE 45 2HG2 ILE 45 2.362 -6.298 -1.996
252 3HG2 ILE 45 3HG2 ILE 45 3.620 -5.948 -3.180
253 1HD1 ILE 45 1HD1 ILE 45 5.420 -5.184 -1.013
254 2HD1 ILE 45 2HD1 ILE 45 7.083 -5.773 -0.970
255 3HD1 ILE 45 3HD1 ILE 45 5.922 -6.320 0.240
256 H LYS 46 H LYS 46 2.065 -9.753 -1.311
257 HA LYS 46 HA LYS 46 -0.330 -8.313 -1.447
258 1HB LYS 46 1HB LYS 46 0.289 -10.635 -2.436
259 2HB LYS 46 2HB LYS 46 -0.269 -11.267 -0.893
260 1HG LYS 46 1HG LYS 46 -2.416 -9.930 -1.365
261 2HG LYS 46 2HG LYS 46 -1.828 -9.869 -3.027
262 1HD LYS 46 1HD LYS 46 -3.177 -11.765 -3.009
263 2HD LYS 46 2HD LYS 46 -1.554 -12.423 -2.788
264 1HE LYS 46 1HE LYS 46 -2.051 -13.231 -0.766
265 2HE LYS 46 2HE LYS 46 -2.826 -11.726 -0.269
266 1HZ LYS 46 1HZ LYS 46 -4.077 -13.875 -1.896
267 2HZ LYS 46 2HZ LYS 46 -4.823 -12.420 -1.460
268 3HZ LYS 46 3HZ LYS 46 -4.400 -13.543 -0.267
269 H ILE 47 H ILE 47 0.877 -10.522 1.038
270 HA ILE 47 HA ILE 47 -1.289 -10.141 2.851
271 HB ILE 47 HB ILE 47 1.360 -11.458 2.904
272 1HG1 ILE 47 1HG1 ILE 47 -1.069 -12.424 4.349
273 2HG1 ILE 47 2HG1 ILE 47 -1.098 -12.391 2.588
274 1HG2 ILE 47 1HG2 ILE 47 0.058 -10.466 5.430
275 2HG2 ILE 47 2HG2 ILE 47 1.702 -10.160 4.864
276 3HG2 ILE 47 3HG2 ILE 47 1.235 -11.779 5.391
277 1HD1 ILE 47 1HD1 ILE 47 1.170 -13.693 4.026
278 2HD1 ILE 47 2HD1 ILE 47 0.547 -13.995 2.403
279 3HD1 ILE 47 3HD1 ILE 47 -0.363 -14.539 3.812
280 H TRP 48 H TRP 48 1.929 -8.802 2.514
281 HA TRP 48 HA TRP 48 2.109 -7.241 4.799
282 1HB TRP 48 1HB TRP 48 3.969 -7.720 3.274
283 2HB TRP 48 2HB TRP 48 3.194 -6.782 2.012
284 HD1 TRP 48 HD1 TRP 48 5.720 -6.517 4.670
285 HE1 TRP 48 HE1 TRP 48 6.464 -4.074 4.936
286 HE3 TRP 48 HE3 TRP 48 2.035 -4.194 2.013
287 HZ2 TRP 48 HZ2 TRP 48 5.627 -1.519 4.162
288 HZ3 TRP 48 HZ3 TRP 48 2.076 -1.750 1.827
289 HH2 TRP 48 HH2 TRP 48 3.843 -0.444 2.869
290 H PHE 49 H PHE 49 0.946 -6.370 1.575
291 HA PHE 49 HA PHE 49 0.161 -3.748 2.348
292 1HB PHE 49 1HB PHE 49 -0.139 -5.405 -0.101
293 2HB PHE 49 2HB PHE 49 -1.224 -4.023 0.099
294 HD1 PHE 49 HD1 PHE 49 -0.390 -1.778 0.110
295 HD2 PHE 49 HD2 PHE 49 2.246 -5.084 -0.284
296 HE1 PHE 49 HE1 PHE 49 1.446 -0.241 -0.503
297 HE2 PHE 49 HE2 PHE 49 4.081 -3.568 -0.900
298 HZ PHE 49 HZ PHE 49 3.692 -1.151 -0.988
299 H GLN 50 H GLN 50 -1.570 -6.789 1.974
300 HA GLN 50 HA GLN 50 -4.123 -5.725 2.458
301 1HB GLN 50 1HB GLN 50 -2.938 -8.475 2.648
302 2HB GLN 50 2HB GLN 50 -4.571 -8.183 3.232
303 1HG GLN 50 1HG GLN 50 -4.611 -7.013 0.757
304 2HG GLN 50 2HG GLN 50 -3.563 -8.409 0.508
305 1HE2 GLN 50 1HE2 GLN 50 -4.496 -10.426 1.738
306 2HE2 GLN 50 2HE2 GLN 50 -6.157 -10.756 1.397
307 H ASN 51 H ASN 51 -1.513 -6.719 4.568
308 HA ASN 51 HA ASN 51 -3.113 -6.727 6.957
309 1HB ASN 51 1HB ASN 51 -0.282 -7.181 6.263
310 2HB ASN 51 2HB ASN 51 -0.554 -6.491 7.860
311 1HD2 ASN 51 1HD2 ASN 51 -2.398 -8.829 5.940
312 2HD2 ASN 51 2HD2 ASN 51 -2.366 -10.085 7.126
313 H LYS 52 H LYS 52 -0.867 -4.476 5.410
314 HA LYS 52 HA LYS 52 -0.982 -2.531 7.488
315 1HB LYS 52 1HB LYS 52 0.654 -2.925 5.357
316 2HB LYS 52 2HB LYS 52 -0.343 -1.607 4.757
317 1HG LYS 52 1HG LYS 52 0.602 -0.105 6.121
318 2HG LYS 52 2HG LYS 52 0.650 -1.223 7.485
319 1HD LYS 52 1HD LYS 52 2.536 -2.382 6.106
320 2HD LYS 52 2HD LYS 52 2.635 -0.824 5.285
321 1HE LYS 52 1HE LYS 52 2.602 -0.019 7.862
322 2HE LYS 52 2HE LYS 52 3.404 -1.580 8.029
323 1HZ LYS 52 1HZ LYS 52 5.212 -0.350 7.557
324 2HZ LYS 52 2HZ LYS 52 4.340 0.860 6.759
325 3HZ LYS 52 3HZ LYS 52 4.722 -0.577 5.954
326 H ARG 53 H ARG 53 -2.893 -3.199 4.654
327 HA ARG 53 HA ARG 53 -4.178 -0.687 4.444
328 1HB ARG 53 1HB ARG 53 -4.161 -2.338 2.623
329 2HB ARG 53 2HB ARG 53 -5.154 -3.418 3.591
330 1HG ARG 53 1HG ARG 53 -6.609 -2.371 2.065
331 2HG ARG 53 2HG ARG 53 -6.896 -1.596 3.625
332 1HD ARG 53 1HD ARG 53 -4.895 -0.062 2.515
333 2HD ARG 53 2HD ARG 53 -5.903 -0.470 1.128
334 HE ARG 53 HE ARG 53 -7.387 0.463 3.408
335 1HH1 ARG 53 1HH1 ARG 53 -5.643 1.420 0.540
336 2HH1 ARG 53 2HH1 ARG 53 -6.471 2.933 0.390
337 1HH2 ARG 53 1HH2 ARG 53 -8.476 2.453 3.213
338 2HH2 ARG 53 2HH2 ARG 53 -8.078 3.521 1.908
339 H ALA 54 H ALA 54 -4.552 -3.301 6.643
340 HA ALA 54 HA ALA 54 -7.225 -2.428 7.447
341 1HB ALA 54 1HB ALA 54 -6.891 -4.818 7.198
342 2HB ALA 54 2HB ALA 54 -7.217 -4.419 8.885
343 3HB ALA 54 3HB ALA 54 -5.570 -4.775 8.365
344 H LYS 55 H LYS 55 -4.822 -0.782 7.920
345 HA LYS 55 HA LYS 55 -4.589 -0.876 10.837
346 1HB LYS 55 1HB LYS 55 -2.924 0.194 8.635
347 2HB LYS 55 2HB LYS 55 -2.931 1.132 10.122
348 1HG LYS 55 1HG LYS 55 -2.521 -1.787 10.376
349 2HG LYS 55 2HG LYS 55 -1.209 -0.842 9.668
350 1HD LYS 55 1HD LYS 55 -0.638 -0.674 11.872
351 2HD LYS 55 2HD LYS 55 -1.710 0.722 11.748
352 1HE LYS 55 1HE LYS 55 -3.307 -1.557 12.303
353 2HE LYS 55 2HE LYS 55 -1.947 -1.566 13.424
354 1HZ LYS 55 1HZ LYS 55 -4.172 0.287 13.224
355 2HZ LYS 55 2HZ LYS 55 -2.668 0.989 13.543
356 3HZ LYS 55 3HZ LYS 55 -3.282 -0.196 14.580
357 H ILE 56 H ILE 56 -4.775 1.771 8.453
358 HA ILE 56 HA ILE 56 -5.919 3.738 8.449
359 HB ILE 56 HB ILE 56 -7.865 2.410 10.330
360 1HG1 ILE 56 1HG1 ILE 56 -8.747 2.355 7.609
361 2HG1 ILE 56 2HG1 ILE 56 -7.148 1.621 7.690
362 1HG2 ILE 56 1HG2 ILE 56 -7.808 4.979 9.568
363 2HG2 ILE 56 2HG2 ILE 56 -9.302 4.098 9.891
364 3HG2 ILE 56 3HG2 ILE 56 -8.734 4.295 8.232
365 1HD1 ILE 56 1HD1 ILE 56 -8.098 -0.248 8.379
366 2HD1 ILE 56 2HD1 ILE 56 -9.675 0.539 8.451
367 3HD1 ILE 56 3HD1 ILE 56 -8.605 0.582 9.851
368 H LYS 57 H LYS 57 -4.535 5.112 9.472
369 HA LYS 57 HA LYS 57 -3.754 6.530 11.070
370 1HB LYS 57 1HB LYS 57 -6.341 6.714 11.380
371 2HB LYS 57 2HB LYS 57 -6.050 5.809 12.859
372 1HG LYS 57 1HG LYS 57 -4.698 7.526 13.757
373 2HG LYS 57 2HG LYS 57 -4.606 8.361 12.205
374 1HD LYS 57 1HD LYS 57 -6.264 9.626 13.051
375 2HD LYS 57 2HD LYS 57 -7.292 8.267 12.592
376 1HE LYS 57 1HE LYS 57 -7.931 8.305 14.743
377 2HE LYS 57 2HE LYS 57 -6.408 7.468 15.034
378 1HZ LYS 57 1HZ LYS 57 -7.064 9.659 16.316
379 2HZ LYS 57 2HZ LYS 57 -6.347 10.387 14.969
380 3HZ LYS 57 3HZ LYS 57 -5.456 9.308 15.920
381 H LYS 58 H LYS 58 -2.455 6.508 12.904
382 HA LYS 58 HA LYS 58 -2.316 3.951 14.356
383 1HB LYS 58 1HB LYS 58 -0.093 5.541 13.104
384 2HB LYS 58 2HB LYS 58 0.219 4.453 14.449
385 1HG LYS 58 1HG LYS 58 0.591 2.969 12.804
386 2HG LYS 58 2HG LYS 58 -1.166 2.809 12.834
387 1HD LYS 58 1HD LYS 58 -0.687 4.993 11.177
388 2HD LYS 58 2HD LYS 58 0.566 3.827 10.748
389 1HE LYS 58 1HE LYS 58 -0.973 2.224 10.086
390 2HE LYS 58 2HE LYS 58 -2.276 2.942 11.031
391 1HZ LYS 58 1HZ LYS 58 -1.075 4.217 8.635
392 2HZ LYS 58 2HZ LYS 58 -2.450 4.724 9.477
393 3HZ LYS 58 3HZ LYS 58 -2.482 3.278 8.600
394 H SER 59 H SER 59 -0.641 4.331 16.291
395 HA SER 59 HA SER 59 -1.131 6.929 17.540
396 1HB SER 59 1HB SER 59 -1.893 4.265 18.749
397 2HB SER 59 2HB SER 59 -1.767 5.758 19.680
398 HG SER 59 HG SER 59 -3.408 5.509 17.387
Start of MODEL 17
1 1H ALA 16 1H ALA 16 -6.012 21.899 0.411
2 2H ALA 16 2H ALA 16 -5.254 22.899 1.583
3 3H ALA 16 3H ALA 16 -4.724 21.282 1.357
4 HA ALA 16 HA ALA 16 -4.331 23.635 -0.318
5 1HB ALA 16 1HB ALA 16 -2.475 23.308 0.995
6 2HB ALA 16 2HB ALA 16 -2.045 22.366 -0.433
7 3HB ALA 16 3HB ALA 16 -2.658 21.554 1.007
8 H LYS 17 H LYS 17 -4.497 20.095 -0.415
9 HA LYS 17 HA LYS 17 -4.936 20.269 -3.309
10 1HB LYS 17 1HB LYS 17 -2.577 19.677 -2.990
11 2HB LYS 17 2HB LYS 17 -3.046 18.327 -1.966
12 1HG LYS 17 1HG LYS 17 -2.509 17.468 -4.116
13 2HG LYS 17 2HG LYS 17 -4.258 17.357 -3.913
14 1HD LYS 17 1HD LYS 17 -4.218 18.265 -5.998
15 2HD LYS 17 2HD LYS 17 -4.137 19.759 -5.062
16 1HE LYS 17 1HE LYS 17 -2.238 20.251 -6.100
17 2HE LYS 17 2HE LYS 17 -1.491 18.856 -5.322
18 1HZ LYS 17 1HZ LYS 17 -1.614 17.634 -7.195
19 2HZ LYS 17 2HZ LYS 17 -1.643 19.147 -7.952
20 3HZ LYS 17 3HZ LYS 17 -3.086 18.305 -7.691
21 H ARG 18 H ARG 18 -6.121 18.510 -4.203
22 HA ARG 18 HA ARG 18 -7.391 16.711 -2.264
23 1HB ARG 18 1HB ARG 18 -8.839 18.431 -4.282
24 2HB ARG 18 2HB ARG 18 -9.587 17.115 -3.389
25 1HG ARG 18 1HG ARG 18 -9.383 18.247 -1.340
26 2HG ARG 18 2HG ARG 18 -8.253 19.424 -2.014
27 1HD ARG 18 1HD ARG 18 -10.294 20.570 -1.866
28 2HD ARG 18 2HD ARG 18 -10.157 20.113 -3.562
29 HE ARG 18 HE ARG 18 -11.982 18.749 -3.313
30 1HH1 ARG 18 1HH1 ARG 18 -10.818 19.681 -0.158
31 2HH1 ARG 18 2HH1 ARG 18 -12.182 19.020 0.678
32 1HH2 ARG 18 1HH2 ARG 18 -13.778 17.879 -2.215
33 2HH2 ARG 18 2HH2 ARG 18 -13.862 17.997 -0.489
34 H GLU 19 H GLU 19 -8.321 14.806 -3.194
35 HA GLU 19 HA GLU 19 -8.326 12.996 -4.567
36 1HB GLU 19 1HB GLU 19 -9.168 15.016 -6.126
37 2HB GLU 19 2HB GLU 19 -7.704 14.582 -6.997
38 1HG GLU 19 1HG GLU 19 -9.005 12.166 -6.435
39 2HG GLU 19 2HG GLU 19 -10.259 13.286 -6.967
40 H PHE 20 H PHE 20 -6.666 11.669 -4.325
41 HA PHE 20 HA PHE 20 -4.090 12.398 -5.560
42 1HB PHE 20 1HB PHE 20 -2.996 11.053 -3.764
43 2HB PHE 20 2HB PHE 20 -3.832 12.478 -3.155
44 HD1 PHE 20 HD1 PHE 20 -4.458 8.859 -3.794
45 HD2 PHE 20 HD2 PHE 20 -5.188 12.242 -1.318
46 HE1 PHE 20 HE1 PHE 20 -5.727 7.439 -2.237
47 HE2 PHE 20 HE2 PHE 20 -6.458 10.828 0.245
48 HZ PHE 20 HZ PHE 20 -6.730 8.423 -0.214
49 H ASN 21 H ASN 21 -2.710 10.151 -5.491
50 HA ASN 21 HA ASN 21 -4.058 8.471 -7.391
51 1HB ASN 21 1HB ASN 21 -1.317 8.837 -6.407
52 2HB ASN 21 2HB ASN 21 -1.723 7.170 -6.794
53 1HD2 ASN 21 1HD2 ASN 21 -0.085 9.461 -8.049
54 2HD2 ASN 21 2HD2 ASN 21 -0.532 9.387 -9.716
55 H GLU 22 H GLU 22 -5.435 6.938 -6.803
56 HA GLU 22 HA GLU 22 -5.414 5.860 -4.130
57 1HB GLU 22 1HB GLU 22 -7.371 6.295 -6.040
58 2HB GLU 22 2HB GLU 22 -7.206 4.545 -6.018
59 1HG GLU 22 1HG GLU 22 -7.498 4.625 -3.542
60 2HG GLU 22 2HG GLU 22 -7.854 6.345 -3.698
61 H ASN 23 H ASN 23 -3.965 4.361 -3.635
62 HA ASN 23 HA ASN 23 -2.751 2.442 -3.660
63 1HB ASN 23 1HB ASN 23 -5.061 1.715 -5.410
64 2HB ASN 23 2HB ASN 23 -3.741 0.583 -5.153
65 1HD2 ASN 23 1HD2 ASN 23 -5.672 2.799 -3.159
66 2HD2 ASN 23 2HD2 ASN 23 -6.018 1.650 -1.916
67 H ARG 24 H ARG 24 -1.898 4.465 -5.300
68 HA ARG 24 HA ARG 24 -0.405 2.966 -7.320
69 1HB ARG 24 1HB ARG 24 -1.703 5.643 -7.872
70 2HB ARG 24 2HB ARG 24 -0.730 4.701 -8.997
71 1HG ARG 24 1HG ARG 24 -2.397 3.097 -9.279
72 2HG ARG 24 2HG ARG 24 -3.248 3.595 -7.815
73 1HD ARG 24 1HD ARG 24 -4.020 5.589 -8.832
74 2HD ARG 24 2HD ARG 24 -2.928 5.395 -10.204
75 HE ARG 24 HE ARG 24 -5.495 4.138 -9.827
76 1HH1 ARG 24 1HH1 ARG 24 -2.430 3.986 -11.491
77 2HH1 ARG 24 2HH1 ARG 24 -3.047 3.038 -12.802
78 1HH2 ARG 24 1HH2 ARG 24 -6.307 2.890 -11.551
79 2HH2 ARG 24 2HH2 ARG 24 -5.247 2.416 -12.836
80 H TYR 25 H TYR 25 -0.817 6.063 -5.687
81 HA TYR 25 HA TYR 25 1.543 7.333 -6.116
82 1HB TYR 25 1HB TYR 25 1.202 8.454 -3.976
83 2HB TYR 25 2HB TYR 25 -0.345 8.233 -4.790
84 HD1 TYR 25 HD1 TYR 25 -1.494 5.862 -4.157
85 HD2 TYR 25 HD2 TYR 25 1.226 8.019 -1.701
86 HE1 TYR 25 HE1 TYR 25 -2.363 4.689 -2.189
87 HE2 TYR 25 HE2 TYR 25 0.353 6.861 0.284
88 HH TYR 25 HH TYR 25 -1.809 5.697 0.940
89 H LEU 26 H LEU 26 0.937 4.863 -3.656
90 HA LEU 26 HA LEU 26 3.840 4.521 -3.354
91 1HB LEU 26 1HB LEU 26 3.479 5.474 -1.340
92 2HB LEU 26 2HB LEU 26 1.760 5.156 -1.389
93 HG LEU 26 HG LEU 26 3.739 2.987 -0.731
94 1HD1 LEU 26 1HD1 LEU 26 3.661 5.220 0.741
95 2HD1 LEU 26 2HD1 LEU 26 3.905 3.615 1.432
96 3HD1 LEU 26 3HD1 LEU 26 2.302 4.353 1.455
97 1HD2 LEU 26 1HD2 LEU 26 0.872 3.196 -0.979
98 2HD2 LEU 26 2HD2 LEU 26 1.327 2.695 0.651
99 3HD2 LEU 26 3HD2 LEU 26 1.876 1.765 -0.743
100 H THR 27 H THR 27 1.199 3.107 -4.530
101 HA THR 27 HA THR 27 1.416 0.514 -3.312
102 HB THR 27 HB THR 27 -0.166 1.575 -5.642
103 HG1 THR 27 HG1 THR 27 -0.821 0.711 -3.028
104 1HG2 THR 27 1HG2 THR 27 0.412 -1.181 -5.046
105 2HG2 THR 27 2HG2 THR 27 -0.473 -0.478 -6.400
106 3HG2 THR 27 3HG2 THR 27 -1.310 -0.832 -4.888
107 H GLU 28 H GLU 28 1.284 0.895 -6.805
108 HA GLU 28 HA GLU 28 3.041 -1.217 -7.308
109 1HB GLU 28 1HB GLU 28 2.447 1.011 -9.241
110 2HB GLU 28 2HB GLU 28 2.838 -0.663 -9.609
111 1HG GLU 28 1HG GLU 28 0.588 -0.872 -8.038
112 2HG GLU 28 2HG GLU 28 0.280 0.570 -9.005
113 H ARG 29 H ARG 29 3.625 2.293 -7.496
114 HA ARG 29 HA ARG 29 6.250 2.137 -8.451
115 1HB ARG 29 1HB ARG 29 4.716 4.224 -6.940
116 2HB ARG 29 2HB ARG 29 6.432 4.448 -7.261
117 1HG ARG 29 1HG ARG 29 5.302 3.683 -9.705
118 2HG ARG 29 2HG ARG 29 4.179 4.845 -8.997
119 1HD ARG 29 1HD ARG 29 5.625 6.229 -10.139
120 2HD ARG 29 2HD ARG 29 6.336 6.227 -8.526
121 HE ARG 29 HE ARG 29 7.413 4.198 -10.248
122 1HH1 ARG 29 1HH1 ARG 29 7.644 7.552 -9.310
123 2HH1 ARG 29 2HH1 ARG 29 9.297 7.705 -9.803
124 1HH2 ARG 29 1HH2 ARG 29 9.587 4.398 -10.896
125 2HH2 ARG 29 2HH2 ARG 29 10.400 5.916 -10.705
126 H ARG 30 H ARG 30 5.037 2.380 -5.132
127 HA ARG 30 HA ARG 30 7.689 2.207 -4.020
128 1HB ARG 30 1HB ARG 30 5.094 2.938 -3.084
129 2HB ARG 30 2HB ARG 30 5.742 1.697 -2.018
130 1HG ARG 30 1HG ARG 30 7.894 3.221 -2.130
131 2HG ARG 30 2HG ARG 30 6.703 4.460 -2.533
132 1HD ARG 30 1HD ARG 30 5.915 4.540 -0.440
133 2HD ARG 30 2HD ARG 30 5.915 2.784 -0.278
134 HE ARG 30 HE ARG 30 7.831 3.002 0.922
135 1HH1 ARG 30 1HH1 ARG 30 7.632 5.716 -1.268
136 2HH1 ARG 30 2HH1 ARG 30 9.104 6.435 -0.705
137 1HH2 ARG 30 1HH2 ARG 30 9.766 3.949 1.659
138 2HH2 ARG 30 2HH2 ARG 30 10.317 5.430 0.951
139 H ARG 31 H ARG 31 5.222 -0.045 -4.901
140 HA ARG 31 HA ARG 31 5.756 -2.162 -3.167
141 1HB ARG 31 1HB ARG 31 4.449 -1.821 -5.768
142 2HB ARG 31 2HB ARG 31 5.159 -3.413 -5.550
143 1HG ARG 31 1HG ARG 31 3.878 -3.762 -3.539
144 2HG ARG 31 2HG ARG 31 3.235 -2.122 -3.630
145 1HD ARG 31 1HD ARG 31 1.542 -3.512 -4.490
146 2HD ARG 31 2HD ARG 31 2.298 -2.766 -5.896
147 HE ARG 31 HE ARG 31 2.406 -5.565 -5.123
148 1HH1 ARG 31 1HH1 ARG 31 3.660 -3.048 -7.195
149 2HH1 ARG 31 2HH1 ARG 31 4.255 -4.156 -8.384
150 1HH2 ARG 31 1HH2 ARG 31 3.187 -7.016 -6.688
151 2HH2 ARG 31 2HH2 ARG 31 3.986 -6.406 -8.098
152 H GLN 32 H GLN 32 7.312 -1.235 -6.193
153 HA GLN 32 HA GLN 32 8.980 -3.501 -6.418
154 1HB GLN 32 1HB GLN 32 8.410 -1.466 -8.066
155 2HB GLN 32 2HB GLN 32 9.954 -0.892 -7.450
156 1HG GLN 32 1HG GLN 32 11.055 -2.264 -8.785
157 2HG GLN 32 2HG GLN 32 10.172 -3.654 -8.159
158 1HE2 GLN 32 1HE2 GLN 32 7.786 -3.637 -9.014
159 2HE2 GLN 32 2HE2 GLN 32 7.645 -3.449 -10.725
160 H GLN 33 H GLN 33 9.395 -0.380 -4.827
161 HA GLN 33 HA GLN 33 12.130 -0.849 -4.120
162 1HB GLN 33 1HB GLN 33 10.253 1.129 -2.830
163 2HB GLN 33 2HB GLN 33 12.007 1.207 -2.914
164 1HG GLN 33 1HG GLN 33 10.831 1.073 -5.548
165 2HG GLN 33 2HG GLN 33 10.191 2.427 -4.618
166 1HE2 GLN 33 1HE2 GLN 33 11.335 3.584 -6.394
167 2HE2 GLN 33 2HE2 GLN 33 12.997 3.985 -6.145
168 H LEU 34 H LEU 34 9.015 -1.307 -2.566
169 HA LEU 34 HA LEU 34 9.959 -1.783 0.043
170 1HB LEU 34 1HB LEU 34 7.451 -2.355 -1.446
171 2HB LEU 34 2HB LEU 34 7.720 -3.214 0.059
172 HG LEU 34 HG LEU 34 8.282 -0.491 0.574
173 1HD1 LEU 34 1HD1 LEU 34 5.689 0.087 0.042
174 2HD1 LEU 34 2HD1 LEU 34 6.123 -0.873 -1.373
175 3HD1 LEU 34 3HD1 LEU 34 7.053 0.570 -0.967
176 1HD2 LEU 34 1HD2 LEU 34 6.355 -2.561 1.431
177 2HD2 LEU 34 2HD2 LEU 34 5.930 -0.888 1.790
178 3HD2 LEU 34 3HD2 LEU 34 7.448 -1.560 2.386
179 H SER 35 H SER 35 9.475 -3.913 -2.721
180 HA SER 35 HA SER 35 9.904 -6.349 -1.367
181 1HB SER 35 1HB SER 35 8.905 -6.215 -3.621
182 2HB SER 35 2HB SER 35 10.454 -5.680 -4.270
183 HG SER 35 HG SER 35 10.277 -7.886 -4.580
184 H SER 36 H SER 36 12.128 -4.374 -3.331
185 HA SER 36 HA SER 36 14.414 -5.950 -2.763
186 1HB SER 36 1HB SER 36 14.216 -4.451 -4.736
187 2HB SER 36 2HB SER 36 14.313 -3.060 -3.656
188 HG SER 36 HG SER 36 16.300 -5.069 -3.941
189 H GLU 37 H GLU 37 13.056 -3.048 -1.287
190 HA GLU 37 HA GLU 37 15.241 -2.453 0.391
191 1HB GLU 37 1HB GLU 37 12.315 -1.766 0.498
192 2HB GLU 37 2HB GLU 37 13.426 -1.247 1.758
193 1HG GLU 37 1HG GLU 37 14.425 -0.648 -0.896
194 2HG GLU 37 2HG GLU 37 12.851 0.085 -0.590
195 H LEU 38 H LEU 38 12.240 -4.258 1.012
196 HA LEU 38 HA LEU 38 13.156 -5.003 3.657
197 1HB LEU 38 1HB LEU 38 10.664 -5.557 2.076
198 2HB LEU 38 2HB LEU 38 10.995 -6.401 3.577
199 HG LEU 38 HG LEU 38 11.350 -3.806 4.341
200 1HD1 LEU 38 1HD1 LEU 38 10.630 -2.682 2.455
201 2HD1 LEU 38 2HD1 LEU 38 9.163 -2.757 3.432
202 3HD1 LEU 38 3HD1 LEU 38 9.387 -3.878 2.089
203 1HD2 LEU 38 1HD2 LEU 38 9.617 -4.227 5.735
204 2HD2 LEU 38 2HD2 LEU 38 9.822 -5.864 5.112
205 3HD2 LEU 38 3HD2 LEU 38 8.574 -4.815 4.441
206 H GLY 39 H GLY 39 13.290 -6.299 0.476
207 1HA GLY 39 1HA GLY 39 14.378 -8.177 -0.299
208 2HA GLY 39 2HA GLY 39 14.884 -8.502 1.352
209 H LEU 40 H LEU 40 11.524 -8.107 0.507
210 HA LEU 40 HA LEU 40 11.110 -10.955 1.108
211 1HB LEU 40 1HB LEU 40 8.616 -9.864 1.230
212 2HB LEU 40 2HB LEU 40 9.675 -10.109 2.607
213 HG LEU 40 HG LEU 40 10.522 -7.736 2.178
214 1HD1 LEU 40 1HD1 LEU 40 7.978 -7.029 0.929
215 2HD1 LEU 40 2HD1 LEU 40 9.053 -7.956 -0.117
216 3HD1 LEU 40 3HD1 LEU 40 9.607 -6.442 0.600
217 1HD2 LEU 40 1HD2 LEU 40 7.961 -8.628 3.324
218 2HD2 LEU 40 2HD2 LEU 40 8.107 -6.893 3.041
219 3HD2 LEU 40 3HD2 LEU 40 9.282 -7.722 4.061
220 H ASN 41 H ASN 41 9.250 -11.979 0.011
221 HA ASN 41 HA ASN 41 9.423 -11.482 -2.835
222 1HB ASN 41 1HB ASN 41 9.542 -13.784 -2.080
223 2HB ASN 41 2HB ASN 41 8.007 -13.626 -1.234
224 1HD2 ASN 41 1HD2 ASN 41 9.059 -12.673 -4.483
225 2HD2 ASN 41 2HD2 ASN 41 7.834 -13.556 -5.322
226 H GLU 42 H GLU 42 7.647 -11.061 -4.191
227 HA GLU 42 HA GLU 42 5.849 -9.124 -3.367
228 1HB GLU 42 1HB GLU 42 6.527 -10.094 -5.755
229 2HB GLU 42 2HB GLU 42 5.027 -10.989 -5.547
230 1HG GLU 42 1HG GLU 42 4.137 -9.183 -6.542
231 2HG GLU 42 2HG GLU 42 4.179 -8.525 -4.907
232 H ALA 43 H ALA 43 5.606 -12.602 -3.249
233 HA ALA 43 HA ALA 43 2.844 -12.887 -2.858
234 1HB ALA 43 1HB ALA 43 3.287 -15.068 -2.153
235 2HB ALA 43 2HB ALA 43 4.843 -14.626 -1.449
236 3HB ALA 43 3HB ALA 43 4.656 -14.696 -3.202
237 H GLN 44 H GLN 44 5.436 -11.969 -0.718
238 HA GLN 44 HA GLN 44 3.860 -12.055 1.694
239 1HB GLN 44 1HB GLN 44 6.554 -10.876 1.019
240 2HB GLN 44 2HB GLN 44 5.840 -10.777 2.622
241 1HG GLN 44 1HG GLN 44 6.468 -13.339 1.172
242 2HG GLN 44 2HG GLN 44 7.488 -12.590 2.402
243 1HE2 GLN 44 1HE2 GLN 44 5.774 -11.826 4.307
244 2HE2 GLN 44 2HE2 GLN 44 4.934 -13.184 4.968
245 H ILE 45 H ILE 45 4.637 -9.822 -0.818
246 HA ILE 45 HA ILE 45 4.009 -7.397 0.465
247 HB ILE 45 HB ILE 45 3.978 -8.161 -2.456
248 1HG1 ILE 45 1HG1 ILE 45 6.159 -8.267 -1.250
249 2HG1 ILE 45 2HG1 ILE 45 6.133 -7.072 -2.545
250 1HG2 ILE 45 1HG2 ILE 45 2.529 -6.144 -1.806
251 2HG2 ILE 45 2HG2 ILE 45 3.721 -5.935 -3.086
252 3HG2 ILE 45 3HG2 ILE 45 4.058 -5.341 -1.463
253 1HD1 ILE 45 1HD1 ILE 45 6.080 -6.630 0.412
254 2HD1 ILE 45 2HD1 ILE 45 5.576 -5.376 -0.721
255 3HD1 ILE 45 3HD1 ILE 45 7.219 -6.017 -0.786
256 H LYS 46 H LYS 46 2.021 -9.710 -1.356
257 HA LYS 46 HA LYS 46 -0.310 -8.170 -1.541
258 1HB LYS 46 1HB LYS 46 0.257 -10.497 -2.563
259 2HB LYS 46 2HB LYS 46 -0.393 -11.136 -1.059
260 1HG LYS 46 1HG LYS 46 -2.502 -9.902 -1.519
261 2HG LYS 46 2HG LYS 46 -1.838 -9.447 -3.089
262 1HD LYS 46 1HD LYS 46 -1.543 -12.271 -2.717
263 2HD LYS 46 2HD LYS 46 -3.216 -11.814 -2.396
264 1HE LYS 46 1HE LYS 46 -3.200 -10.569 -4.569
265 2HE LYS 46 2HE LYS 46 -1.614 -11.270 -4.890
266 1HZ LYS 46 1HZ LYS 46 -4.063 -12.866 -4.373
267 2HZ LYS 46 2HZ LYS 46 -2.555 -13.450 -4.870
268 3HZ LYS 46 3HZ LYS 46 -3.480 -12.497 -5.918
269 H ILE 47 H ILE 47 0.702 -10.512 0.908
270 HA ILE 47 HA ILE 47 -1.493 -10.064 2.668
271 HB ILE 47 HB ILE 47 1.059 -11.556 2.741
272 1HG1 ILE 47 1HG1 ILE 47 -0.781 -13.013 4.115
273 2HG1 ILE 47 2HG1 ILE 47 -1.831 -12.021 3.107
274 1HG2 ILE 47 1HG2 ILE 47 1.425 -10.351 4.762
275 2HG2 ILE 47 2HG2 ILE 47 0.856 -11.961 5.205
276 3HG2 ILE 47 3HG2 ILE 47 -0.247 -10.586 5.274
277 1HD1 ILE 47 1HD1 ILE 47 0.263 -13.024 1.480
278 2HD1 ILE 47 2HD1 ILE 47 -1.465 -13.371 1.402
279 3HD1 ILE 47 3HD1 ILE 47 -0.411 -14.361 2.412
280 H TRP 48 H TRP 48 1.841 -8.942 2.555
281 HA TRP 48 HA TRP 48 1.974 -7.481 4.908
282 1HB TRP 48 1HB TRP 48 3.902 -8.021 3.504
283 2HB TRP 48 2HB TRP 48 3.278 -7.007 2.217
284 HD1 TRP 48 HD1 TRP 48 5.639 -6.967 5.028
285 HE1 TRP 48 HE1 TRP 48 6.511 -4.582 5.417
286 HE3 TRP 48 HE3 TRP 48 2.263 -4.342 2.244
287 HZ2 TRP 48 HZ2 TRP 48 5.873 -1.960 4.683
288 HZ3 TRP 48 HZ3 TRP 48 2.460 -1.902 2.144
289 HH2 TRP 48 HH2 TRP 48 4.236 -0.738 3.328
290 H PHE 49 H PHE 49 1.088 -6.407 1.656
291 HA PHE 49 HA PHE 49 0.406 -3.772 2.495
292 1HB PHE 49 1HB PHE 49 0.153 -5.310 -0.040
293 2HB PHE 49 2HB PHE 49 -0.854 -3.872 0.162
294 HD1 PHE 49 HD1 PHE 49 2.559 -5.137 -0.041
295 HD2 PHE 49 HD2 PHE 49 0.100 -1.693 0.287
296 HE1 PHE 49 HE1 PHE 49 4.517 -3.717 -0.491
297 HE2 PHE 49 HE2 PHE 49 2.059 -0.249 -0.158
298 HZ PHE 49 HZ PHE 49 4.275 -1.278 -0.525
299 H GLN 50 H GLN 50 -1.421 -6.688 1.856
300 HA GLN 50 HA GLN 50 -3.963 -5.579 2.178
301 1HB GLN 50 1HB GLN 50 -3.724 -7.738 1.162
302 2HB GLN 50 2HB GLN 50 -2.933 -8.387 2.592
303 1HG GLN 50 1HG GLN 50 -4.861 -8.809 3.623
304 2HG GLN 50 2HG GLN 50 -5.598 -7.301 3.082
305 1HE2 GLN 50 1HE2 GLN 50 -5.832 -10.548 2.901
306 2HE2 GLN 50 2HE2 GLN 50 -6.662 -10.708 1.394
307 H ASN 51 H ASN 51 -1.571 -6.672 4.502
308 HA ASN 51 HA ASN 51 -3.402 -6.652 6.727
309 1HB ASN 51 1HB ASN 51 -0.829 -7.665 6.275
310 2HB ASN 51 2HB ASN 51 -0.615 -6.412 7.493
311 1HD2 ASN 51 1HD2 ASN 51 -1.891 -9.522 6.784
312 2HD2 ASN 51 2HD2 ASN 51 -2.402 -9.919 8.386
313 H LYS 52 H LYS 52 -1.014 -4.458 5.354
314 HA LYS 52 HA LYS 52 -0.936 -2.560 7.405
315 1HB LYS 52 1HB LYS 52 0.340 -2.831 5.043
316 2HB LYS 52 2HB LYS 52 -0.798 -1.558 4.621
317 1HG LYS 52 1HG LYS 52 0.749 -0.168 5.421
318 2HG LYS 52 2HG LYS 52 0.176 -0.673 7.012
319 1HD LYS 52 1HD LYS 52 2.377 -2.085 5.516
320 2HD LYS 52 2HD LYS 52 2.670 -0.781 6.668
321 1HE LYS 52 1HE LYS 52 0.969 -2.531 8.003
322 2HE LYS 52 2HE LYS 52 2.098 -3.577 7.144
323 1HZ LYS 52 1HZ LYS 52 3.356 -3.203 8.953
324 2HZ LYS 52 2HZ LYS 52 2.572 -1.760 9.355
325 3HZ LYS 52 3HZ LYS 52 3.765 -1.767 8.156
326 H ARG 53 H ARG 53 -3.217 -3.041 4.782
327 HA ARG 53 HA ARG 53 -4.876 -0.883 5.912
328 1HB ARG 53 1HB ARG 53 -4.954 -1.733 3.022
329 2HB ARG 53 2HB ARG 53 -5.647 -0.290 3.750
330 1HG ARG 53 1HG ARG 53 -2.699 -0.853 3.506
331 2HG ARG 53 2HG ARG 53 -3.633 0.177 2.419
332 1HD ARG 53 1HD ARG 53 -4.310 1.304 4.739
333 2HD ARG 53 2HD ARG 53 -2.736 0.659 5.204
334 HE ARG 53 HE ARG 53 -2.520 2.028 2.749
335 1HH1 ARG 53 1HH1 ARG 53 -2.974 2.630 6.156
336 2HH1 ARG 53 2HH1 ARG 53 -2.245 4.199 6.103
337 1HH2 ARG 53 1HH2 ARG 53 -1.562 4.092 2.677
338 2HH2 ARG 53 2HH2 ARG 53 -1.444 5.031 4.128
339 H ALA 54 H ALA 54 -6.302 -1.995 7.126
340 HA ALA 54 HA ALA 54 -8.025 -3.912 5.726
341 1HB ALA 54 1HB ALA 54 -6.711 -5.449 6.846
342 2HB ALA 54 2HB ALA 54 -8.043 -5.205 7.977
343 3HB ALA 54 3HB ALA 54 -6.496 -4.401 8.247
344 H LYS 55 H LYS 55 -8.284 -1.094 6.575
345 HA LYS 55 HA LYS 55 -10.924 -1.210 7.575
346 1HB LYS 55 1HB LYS 55 -9.722 -1.686 9.688
347 2HB LYS 55 2HB LYS 55 -8.851 -0.169 9.516
348 1HG LYS 55 1HG LYS 55 -10.522 0.398 10.987
349 2HG LYS 55 2HG LYS 55 -11.217 0.888 9.442
350 1HD LYS 55 1HD LYS 55 -11.891 -1.830 9.838
351 2HD LYS 55 2HD LYS 55 -12.221 -0.986 11.352
352 1HE LYS 55 1HE LYS 55 -13.227 -0.183 8.624
353 2HE LYS 55 2HE LYS 55 -14.173 -0.990 9.874
354 1HZ LYS 55 1HZ LYS 55 -14.529 1.433 9.781
355 2HZ LYS 55 2HZ LYS 55 -12.907 1.677 10.192
356 3HZ LYS 55 3HZ LYS 55 -13.949 0.915 11.285
357 H ILE 56 H ILE 56 -8.027 0.853 7.527
358 HA ILE 56 HA ILE 56 -7.675 2.977 6.790
359 HB ILE 56 HB ILE 56 -10.086 2.549 5.028
360 1HG1 ILE 56 1HG1 ILE 56 -7.408 2.035 3.911
361 2HG1 ILE 56 2HG1 ILE 56 -7.934 0.860 5.111
362 1HG2 ILE 56 1HG2 ILE 56 -9.499 4.752 4.752
363 2HG2 ILE 56 2HG2 ILE 56 -8.509 3.981 3.513
364 3HG2 ILE 56 3HG2 ILE 56 -7.788 4.447 5.053
365 1HD1 ILE 56 1HD1 ILE 56 -9.837 0.278 3.831
366 2HD1 ILE 56 2HD1 ILE 56 -8.460 0.296 2.730
367 3HD1 ILE 56 3HD1 ILE 56 -9.600 1.642 2.739
368 H LYS 57 H LYS 57 -8.233 3.916 8.804
369 HA LYS 57 HA LYS 57 -10.944 5.022 9.000
370 1HB LYS 57 1HB LYS 57 -9.546 3.709 10.886
371 2HB LYS 57 2HB LYS 57 -9.022 5.350 11.235
372 1HG LYS 57 1HG LYS 57 -11.876 4.397 11.142
373 2HG LYS 57 2HG LYS 57 -10.933 4.715 12.599
374 1HD LYS 57 1HD LYS 57 -11.819 6.772 12.499
375 2HD LYS 57 2HD LYS 57 -10.653 7.055 11.204
376 1HE LYS 57 1HE LYS 57 -12.282 6.508 9.535
377 2HE LYS 57 2HE LYS 57 -13.434 5.980 10.761
378 1HZ LYS 57 1HZ LYS 57 -13.666 8.318 9.733
379 2HZ LYS 57 2HZ LYS 57 -12.417 8.744 10.790
380 3HZ LYS 57 3HZ LYS 57 -13.870 8.134 11.403
381 H LYS 58 H LYS 58 -10.263 6.535 7.247
382 HA LYS 58 HA LYS 58 -8.502 8.688 8.138
383 1HB LYS 58 1HB LYS 58 -9.679 7.902 5.494
384 2HB LYS 58 2HB LYS 58 -9.069 9.533 5.737
385 1HG LYS 58 1HG LYS 58 -7.461 7.024 6.158
386 2HG LYS 58 2HG LYS 58 -7.428 8.012 4.697
387 1HD LYS 58 1HD LYS 58 -6.932 9.928 6.472
388 2HD LYS 58 2HD LYS 58 -6.309 8.558 7.393
389 1HE LYS 58 1HE LYS 58 -4.412 9.022 6.260
390 2HE LYS 58 2HE LYS 58 -5.185 8.050 5.008
391 1HZ LYS 58 1HZ LYS 58 -4.276 10.204 4.219
392 2HZ LYS 58 2HZ LYS 58 -5.418 11.003 5.178
393 3HZ LYS 58 3HZ LYS 58 -5.928 10.010 3.910
394 H SER 59 H SER 59 -9.361 10.939 7.213
395 HA SER 59 HA SER 59 -12.044 11.291 8.372
396 1HB SER 59 1HB SER 59 -11.307 13.681 8.725
397 2HB SER 59 2HB SER 59 -10.419 12.486 9.668
398 HG SER 59 HG SER 59 -8.735 12.624 8.168
Start of MODEL 18
1 1H ALA 16 1H ALA 16 -15.690 11.967 -11.839
2 2H ALA 16 2H ALA 16 -14.508 11.270 -12.868
3 3H ALA 16 3H ALA 16 -14.902 12.934 -13.014
4 HA ALA 16 HA ALA 16 -12.787 12.308 -11.842
5 1HB ALA 16 1HB ALA 16 -13.678 14.551 -11.847
6 2HB ALA 16 2HB ALA 16 -13.099 14.150 -10.229
7 3HB ALA 16 3HB ALA 16 -14.828 14.130 -10.577
8 H LYS 17 H LYS 17 -15.543 12.481 -9.588
9 HA LYS 17 HA LYS 17 -14.145 10.645 -7.804
10 1HB LYS 17 1HB LYS 17 -15.275 12.848 -7.080
11 2HB LYS 17 2HB LYS 17 -16.787 11.966 -7.238
12 1HG LYS 17 1HG LYS 17 -16.519 11.164 -5.196
13 2HG LYS 17 2HG LYS 17 -15.040 10.353 -5.715
14 1HD LYS 17 1HD LYS 17 -13.686 11.977 -4.855
15 2HD LYS 17 2HD LYS 17 -14.879 13.253 -5.100
16 1HE LYS 17 1HE LYS 17 -14.967 13.082 -2.827
17 2HE LYS 17 2HE LYS 17 -16.193 11.890 -3.259
18 1HZ LYS 17 1HZ LYS 17 -14.701 10.135 -2.873
19 2HZ LYS 17 2HZ LYS 17 -14.494 11.183 -1.561
20 3HZ LYS 17 3HZ LYS 17 -13.357 11.162 -2.813
21 H ARG 18 H ARG 18 -14.524 8.543 -7.936
22 HA ARG 18 HA ARG 18 -17.086 7.397 -7.846
23 1HB ARG 18 1HB ARG 18 -16.979 8.253 -10.258
24 2HB ARG 18 2HB ARG 18 -15.779 6.998 -10.532
25 1HG ARG 18 1HG ARG 18 -17.429 5.309 -9.817
26 2HG ARG 18 2HG ARG 18 -18.630 6.592 -9.654
27 1HD ARG 18 1HD ARG 18 -18.424 7.114 -12.018
28 2HD ARG 18 2HD ARG 18 -17.169 5.889 -12.197
29 HE ARG 18 HE ARG 18 -19.999 5.464 -12.124
30 1HH1 ARG 18 1HH1 ARG 18 -16.900 4.009 -11.446
31 2HH1 ARG 18 2HH1 ARG 18 -17.483 2.388 -11.619
32 1HH2 ARG 18 1HH2 ARG 18 -20.767 3.332 -12.351
33 2HH2 ARG 18 2HH2 ARG 18 -19.679 2.002 -12.134
34 H GLU 19 H GLU 19 -13.814 6.861 -9.126
35 HA GLU 19 HA GLU 19 -13.343 4.750 -7.244
36 1HB GLU 19 1HB GLU 19 -14.149 4.130 -10.009
37 2HB GLU 19 2HB GLU 19 -12.692 3.306 -9.469
38 1HG GLU 19 1HG GLU 19 -13.820 1.946 -8.104
39 2HG GLU 19 2HG GLU 19 -14.879 3.236 -7.533
40 H PHE 20 H PHE 20 -11.151 4.137 -7.131
41 HA PHE 20 HA PHE 20 -9.333 5.787 -8.760
42 1HB PHE 20 1HB PHE 20 -7.866 6.002 -6.817
43 2HB PHE 20 2HB PHE 20 -9.470 6.627 -6.450
44 HD1 PHE 20 HD1 PHE 20 -7.369 3.584 -6.097
45 HD2 PHE 20 HD2 PHE 20 -10.597 5.894 -4.564
46 HE1 PHE 20 HE1 PHE 20 -7.484 2.111 -4.129
47 HE2 PHE 20 HE2 PHE 20 -10.718 4.426 -2.593
48 HZ PHE 20 HZ PHE 20 -9.159 2.530 -2.374
49 H ASN 21 H ASN 21 -6.938 4.846 -8.207
50 HA ASN 21 HA ASN 21 -6.903 2.289 -9.476
51 1HB ASN 21 1HB ASN 21 -4.534 3.610 -8.181
52 2HB ASN 21 2HB ASN 21 -4.558 2.508 -9.553
53 1HD2 ASN 21 1HD2 ASN 21 -5.726 3.315 -11.495
54 2HD2 ASN 21 2HD2 ASN 21 -5.551 4.986 -11.894
55 H GLU 22 H GLU 22 -7.755 0.694 -8.236
56 HA GLU 22 HA GLU 22 -7.354 0.354 -5.479
57 1HB GLU 22 1HB GLU 22 -8.665 -1.050 -7.589
58 2HB GLU 22 2HB GLU 22 -7.676 -2.205 -6.705
59 1HG GLU 22 1HG GLU 22 -9.072 -2.220 -4.982
60 2HG GLU 22 2HG GLU 22 -9.133 -0.460 -4.919
61 H ASN 23 H ASN 23 -5.177 0.663 -5.023
62 HA ASN 23 HA ASN 23 -3.037 0.032 -4.601
63 1HB ASN 23 1HB ASN 23 -3.648 -2.718 -5.641
64 2HB ASN 23 2HB ASN 23 -2.511 -2.240 -4.388
65 1HD2 ASN 23 1HD2 ASN 23 -4.012 -0.672 -2.773
66 2HD2 ASN 23 2HD2 ASN 23 -5.294 -1.590 -2.068
67 H ARG 24 H ARG 24 -2.237 1.344 -6.197
68 HA ARG 24 HA ARG 24 -0.755 0.068 -8.258
69 1HB ARG 24 1HB ARG 24 -2.304 0.098 -9.886
70 2HB ARG 24 2HB ARG 24 -3.416 1.039 -8.902
71 1HG ARG 24 1HG ARG 24 -2.561 3.076 -9.695
72 2HG ARG 24 2HG ARG 24 -1.128 2.305 -10.379
73 1HD ARG 24 1HD ARG 24 -3.322 1.039 -11.578
74 2HD ARG 24 2HD ARG 24 -3.708 2.759 -11.572
75 HE ARG 24 HE ARG 24 -2.030 3.115 -13.096
76 1HH1 ARG 24 1HH1 ARG 24 -1.716 -0.101 -11.778
77 2HH1 ARG 24 2HH1 ARG 24 -0.507 -0.586 -12.919
78 1HH2 ARG 24 1HH2 ARG 24 -0.442 2.478 -14.598
79 2HH2 ARG 24 2HH2 ARG 24 0.216 0.877 -14.520
80 H TYR 25 H TYR 25 -2.285 3.227 -7.696
81 HA TYR 25 HA TYR 25 -0.467 4.985 -8.580
82 1HB TYR 25 1HB TYR 25 -1.221 6.546 -6.863
83 2HB TYR 25 2HB TYR 25 -2.581 5.590 -7.448
84 HD1 TYR 25 HD1 TYR 25 -2.900 3.304 -6.032
85 HD2 TYR 25 HD2 TYR 25 -1.123 6.887 -4.584
86 HE1 TYR 25 HE1 TYR 25 -3.395 2.609 -3.738
87 HE2 TYR 25 HE2 TYR 25 -1.623 6.204 -2.275
88 HH TYR 25 HH TYR 25 -2.033 4.066 -1.035
89 H LEU 26 H LEU 26 -0.268 3.395 -5.413
90 HA LEU 26 HA LEU 26 2.576 4.133 -5.317
91 1HB LEU 26 1HB LEU 26 2.435 4.853 -3.187
92 2HB LEU 26 2HB LEU 26 0.763 5.129 -3.621
93 HG LEU 26 HG LEU 26 0.729 4.132 -1.487
94 1HD1 LEU 26 1HD1 LEU 26 0.227 1.576 -2.763
95 2HD1 LEU 26 2HD1 LEU 26 -0.510 2.924 -3.626
96 3HD1 LEU 26 3HD1 LEU 26 -0.876 2.663 -1.923
97 1HD2 LEU 26 1HD2 LEU 26 2.167 2.599 -0.685
98 2HD2 LEU 26 2HD2 LEU 26 3.156 3.116 -2.050
99 3HD2 LEU 26 3HD2 LEU 26 2.169 1.660 -2.179
100 H THR 27 H THR 27 0.245 1.644 -5.193
101 HA THR 27 HA THR 27 1.535 -0.312 -3.694
102 HB THR 27 HB THR 27 -0.325 -0.503 -6.060
103 HG1 THR 27 HG1 THR 27 -1.125 0.318 -4.052
104 1HG2 THR 27 1HG2 THR 27 -0.676 -2.863 -4.835
105 2HG2 THR 27 2HG2 THR 27 1.067 -2.669 -4.644
106 3HG2 THR 27 3HG2 THR 27 0.346 -2.633 -6.253
107 H GLU 28 H GLU 28 1.525 -0.020 -7.252
108 HA GLU 28 HA GLU 28 3.533 -1.925 -7.699
109 1HB GLU 28 1HB GLU 28 2.168 0.156 -9.285
110 2HB GLU 28 2HB GLU 28 3.754 -0.318 -9.876
111 1HG GLU 28 1HG GLU 28 2.624 -2.737 -9.397
112 2HG GLU 28 2HG GLU 28 1.221 -1.785 -9.879
113 H ARG 29 H ARG 29 3.728 1.616 -7.482
114 HA ARG 29 HA ARG 29 6.472 1.841 -8.028
115 1HB ARG 29 1HB ARG 29 4.466 3.615 -7.674
116 2HB ARG 29 2HB ARG 29 5.296 3.785 -6.133
117 1HG ARG 29 1HG ARG 29 6.530 5.295 -7.226
118 2HG ARG 29 2HG ARG 29 7.386 3.885 -7.850
119 1HD ARG 29 1HD ARG 29 4.986 4.528 -9.372
120 2HD ARG 29 2HD ARG 29 6.162 5.841 -9.354
121 HE ARG 29 HE ARG 29 7.611 4.543 -10.591
122 1HH1 ARG 29 1HH1 ARG 29 4.905 2.604 -9.539
123 2HH1 ARG 29 2HH1 ARG 29 5.287 1.281 -10.587
124 1HH2 ARG 29 1HH2 ARG 29 8.115 2.803 -11.967
125 2HH2 ARG 29 2HH2 ARG 29 7.110 1.392 -11.964
126 H ARG 30 H ARG 30 4.731 1.519 -4.962
127 HA ARG 30 HA ARG 30 7.148 1.598 -3.400
128 1HB ARG 30 1HB ARG 30 4.937 2.410 -2.570
129 2HB ARG 30 2HB ARG 30 4.379 0.742 -2.546
130 1HG ARG 30 1HG ARG 30 5.193 0.508 -0.505
131 2HG ARG 30 2HG ARG 30 6.816 0.831 -1.119
132 1HD ARG 30 1HD ARG 30 6.791 3.000 -0.437
133 2HD ARG 30 2HD ARG 30 5.054 3.170 -0.682
134 HE ARG 30 HE ARG 30 5.752 1.446 1.511
135 1HH1 ARG 30 1HH1 ARG 30 5.167 4.747 0.538
136 2HH1 ARG 30 2HH1 ARG 30 4.755 5.277 2.133
137 1HH2 ARG 30 1HH2 ARG 30 5.208 2.142 3.612
138 2HH2 ARG 30 2HH2 ARG 30 4.778 3.798 3.879
139 H ARG 31 H ARG 31 5.223 -0.848 -4.922
140 HA ARG 31 HA ARG 31 5.934 -3.076 -3.382
141 1HB ARG 31 1HB ARG 31 4.825 -2.601 -6.071
142 2HB ARG 31 2HB ARG 31 5.671 -4.130 -5.882
143 1HG ARG 31 1HG ARG 31 4.182 -4.900 -4.275
144 2HG ARG 31 2HG ARG 31 3.589 -3.279 -3.909
145 1HD ARG 31 1HD ARG 31 1.898 -4.416 -5.156
146 2HD ARG 31 2HD ARG 31 2.619 -3.196 -6.205
147 HE ARG 31 HE ARG 31 4.014 -5.515 -6.695
148 1HH1 ARG 31 1HH1 ARG 31 0.687 -4.487 -6.909
149 2HH1 ARG 31 2HH1 ARG 31 0.309 -5.559 -8.216
150 1HH2 ARG 31 1HH2 ARG 31 3.521 -6.925 -8.413
151 2HH2 ARG 31 2HH2 ARG 31 1.918 -6.945 -9.069
152 H GLN 32 H GLN 32 7.514 -1.586 -6.171
153 HA GLN 32 HA GLN 32 9.546 -3.532 -6.451
154 1HB GLN 32 1HB GLN 32 9.620 -0.620 -7.255
155 2HB GLN 32 2HB GLN 32 10.668 -1.893 -7.866
156 1HG GLN 32 1HG GLN 32 7.759 -2.310 -8.165
157 2HG GLN 32 2HG GLN 32 8.491 -1.043 -9.151
158 1HE2 GLN 32 1HE2 GLN 32 8.822 -4.443 -8.253
159 2HE2 GLN 32 2HE2 GLN 32 9.471 -4.965 -9.767
160 H GLN 33 H GLN 33 9.371 -0.485 -4.669
161 HA GLN 33 HA GLN 33 12.095 -0.592 -3.797
162 1HB GLN 33 1HB GLN 33 9.796 1.037 -2.702
163 2HB GLN 33 2HB GLN 33 11.503 1.308 -2.376
164 1HG GLN 33 1HG GLN 33 11.585 1.447 -5.026
165 2HG GLN 33 2HG GLN 33 9.905 1.926 -4.788
166 1HE2 GLN 33 1HE2 GLN 33 10.647 3.960 -5.706
167 2HE2 GLN 33 2HE2 GLN 33 11.377 5.134 -4.669
168 H LEU 34 H LEU 34 8.975 -1.438 -2.353
169 HA LEU 34 HA LEU 34 9.950 -1.991 0.233
170 1HB LEU 34 1HB LEU 34 7.482 -2.553 -1.286
171 2HB LEU 34 2HB LEU 34 7.817 -3.646 0.044
172 HG LEU 34 HG LEU 34 7.582 -0.644 0.264
173 1HD1 LEU 34 1HD1 LEU 34 5.441 -0.900 0.997
174 2HD1 LEU 34 2HD1 LEU 34 5.719 -2.540 1.584
175 3HD1 LEU 34 3HD1 LEU 34 5.522 -2.244 -0.143
176 1HD2 LEU 34 1HD2 LEU 34 7.387 -1.542 2.778
177 2HD2 LEU 34 2HD2 LEU 34 8.917 -1.056 2.046
178 3HD2 LEU 34 3HD2 LEU 34 8.478 -2.763 2.121
179 H SER 35 H SER 35 9.572 -4.007 -2.639
180 HA SER 35 HA SER 35 10.230 -6.459 -1.422
181 1HB SER 35 1HB SER 35 10.451 -7.332 -3.630
182 2HB SER 35 2HB SER 35 9.182 -6.110 -3.714
183 HG SER 35 HG SER 35 11.275 -6.223 -5.216
184 H SER 36 H SER 36 12.227 -4.173 -3.286
185 HA SER 36 HA SER 36 14.653 -5.586 -2.892
186 1HB SER 36 1HB SER 36 14.198 -2.684 -3.621
187 2HB SER 36 2HB SER 36 15.734 -3.539 -3.756
188 HG SER 36 HG SER 36 13.372 -4.403 -5.056
189 H GLU 37 H GLU 37 13.182 -2.822 -1.231
190 HA GLU 37 HA GLU 37 15.392 -2.345 0.488
191 1HB GLU 37 1HB GLU 37 12.495 -1.520 0.659
192 2HB GLU 37 2HB GLU 37 13.726 -0.982 1.793
193 1HG GLU 37 1HG GLU 37 14.019 -0.565 -1.159
194 2HG GLU 37 2HG GLU 37 13.122 0.562 -0.144
195 H LEU 38 H LEU 38 12.226 -3.881 1.080
196 HA LEU 38 HA LEU 38 13.094 -4.764 3.696
197 1HB LEU 38 1HB LEU 38 10.609 -4.301 2.423
198 2HB LEU 38 2HB LEU 38 10.640 -5.996 2.872
199 HG LEU 38 HG LEU 38 11.472 -4.967 5.190
200 1HD1 LEU 38 1HD1 LEU 38 9.487 -2.879 4.567
201 2HD1 LEU 38 2HD1 LEU 38 11.096 -2.654 3.883
202 3HD1 LEU 38 3HD1 LEU 38 10.897 -2.831 5.626
203 1HD2 LEU 38 1HD2 LEU 38 8.636 -5.185 4.197
204 2HD2 LEU 38 2HD2 LEU 38 9.071 -4.973 5.894
205 3HD2 LEU 38 3HD2 LEU 38 9.586 -6.419 5.025
206 H GLY 39 H GLY 39 13.255 -5.985 0.525
207 1HA GLY 39 1HA GLY 39 14.095 -7.978 -0.264
208 2HA GLY 39 2HA GLY 39 14.501 -8.392 1.396
209 H LEU 40 H LEU 40 11.263 -7.567 0.388
210 HA LEU 40 HA LEU 40 10.407 -10.285 1.082
211 1HB LEU 40 1HB LEU 40 9.122 -7.601 1.148
212 2HB LEU 40 2HB LEU 40 8.093 -8.997 0.896
213 HG LEU 40 HG LEU 40 9.894 -8.539 3.272
214 1HD1 LEU 40 1HD1 LEU 40 7.066 -7.963 2.677
215 2HD1 LEU 40 2HD1 LEU 40 8.170 -7.196 3.822
216 3HD1 LEU 40 3HD1 LEU 40 7.387 -8.721 4.239
217 1HD2 LEU 40 1HD2 LEU 40 8.306 -10.532 4.036
218 2HD2 LEU 40 2HD2 LEU 40 9.854 -10.813 3.237
219 3HD2 LEU 40 3HD2 LEU 40 8.356 -10.883 2.308
220 H ASN 41 H ASN 41 8.881 -11.390 -0.206
221 HA ASN 41 HA ASN 41 9.174 -10.854 -3.047
222 1HB ASN 41 1HB ASN 41 9.437 -13.163 -2.203
223 2HB ASN 41 2HB ASN 41 7.776 -13.131 -1.619
224 1HD2 ASN 41 1HD2 ASN 41 6.625 -14.416 -2.862
225 2HD2 ASN 41 2HD2 ASN 41 6.646 -14.446 -4.589
226 H GLU 42 H GLU 42 7.363 -10.605 -4.464
227 HA GLU 42 HA GLU 42 5.430 -8.807 -3.639
228 1HB GLU 42 1HB GLU 42 5.107 -10.798 -5.896
229 2HB GLU 42 2HB GLU 42 4.297 -9.245 -5.736
230 1HG GLU 42 1HG GLU 42 5.908 -8.528 -7.108
231 2HG GLU 42 2HG GLU 42 6.884 -8.472 -5.641
232 H ALA 43 H ALA 43 5.410 -12.302 -3.585
233 HA ALA 43 HA ALA 43 2.665 -12.726 -3.118
234 1HB ALA 43 1HB ALA 43 4.713 -14.518 -1.894
235 2HB ALA 43 2HB ALA 43 4.607 -14.402 -3.651
236 3HB ALA 43 3HB ALA 43 3.206 -14.926 -2.714
237 H GLN 44 H GLN 44 5.357 -12.042 -0.951
238 HA GLN 44 HA GLN 44 3.767 -12.326 1.445
239 1HB GLN 44 1HB GLN 44 6.566 -11.480 0.802
240 2HB GLN 44 2HB GLN 44 5.891 -11.065 2.371
241 1HG GLN 44 1HG GLN 44 5.375 -13.820 1.833
242 2HG GLN 44 2HG GLN 44 7.086 -13.485 1.574
243 1HE2 GLN 44 1HE2 GLN 44 4.881 -11.932 3.841
244 2HE2 GLN 44 2HE2 GLN 44 5.711 -12.428 5.273
245 H ILE 45 H ILE 45 4.754 -9.872 -0.762
246 HA ILE 45 HA ILE 45 4.174 -7.598 0.785
247 HB ILE 45 HB ILE 45 4.352 -8.031 -2.188
248 1HG1 ILE 45 1HG1 ILE 45 6.273 -7.846 -0.155
249 2HG1 ILE 45 2HG1 ILE 45 6.559 -7.757 -1.889
250 1HG2 ILE 45 1HG2 ILE 45 4.022 -5.428 -0.718
251 2HG2 ILE 45 2HG2 ILE 45 2.856 -6.159 -1.820
252 3HG2 ILE 45 3HG2 ILE 45 4.410 -5.588 -2.428
253 1HD1 ILE 45 1HD1 ILE 45 6.366 -5.349 -1.818
254 2HD1 ILE 45 2HD1 ILE 45 7.593 -5.912 -0.684
255 3HD1 ILE 45 3HD1 ILE 45 6.007 -5.406 -0.090
256 H LYS 46 H LYS 46 2.195 -9.578 -1.398
257 HA LYS 46 HA LYS 46 -0.047 -7.942 -1.601
258 1HB LYS 46 1HB LYS 46 0.524 -10.340 -2.598
259 2HB LYS 46 2HB LYS 46 -0.443 -10.879 -1.232
260 1HG LYS 46 1HG LYS 46 -2.282 -9.413 -2.024
261 2HG LYS 46 2HG LYS 46 -1.312 -9.043 -3.452
262 1HD LYS 46 1HD LYS 46 -1.225 -11.515 -3.905
263 2HD LYS 46 2HD LYS 46 -2.412 -11.720 -2.615
264 1HE LYS 46 1HE LYS 46 -4.034 -10.439 -3.796
265 2HE LYS 46 2HE LYS 46 -2.842 -9.915 -4.986
266 1HZ LYS 46 1HZ LYS 46 -2.977 -11.851 -6.107
267 2HZ LYS 46 2HZ LYS 46 -4.513 -11.922 -5.403
268 3HZ LYS 46 3HZ LYS 46 -3.230 -12.787 -4.721
269 H ILE 47 H ILE 47 0.784 -10.362 0.831
270 HA ILE 47 HA ILE 47 -1.504 -9.951 2.491
271 HB ILE 47 HB ILE 47 1.057 -11.419 2.652
272 1HG1 ILE 47 1HG1 ILE 47 -0.813 -12.906 3.956
273 2HG1 ILE 47 2HG1 ILE 47 -1.840 -11.919 2.921
274 1HG2 ILE 47 1HG2 ILE 47 0.754 -11.843 5.113
275 2HG2 ILE 47 2HG2 ILE 47 -0.332 -10.454 5.142
276 3HG2 ILE 47 3HG2 ILE 47 1.360 -10.241 4.688
277 1HD1 ILE 47 1HD1 ILE 47 0.512 -13.306 1.738
278 2HD1 ILE 47 2HD1 ILE 47 -1.021 -12.851 0.995
279 3HD1 ILE 47 3HD1 ILE 47 -0.949 -14.223 2.102
280 H TRP 48 H TRP 48 1.762 -8.755 2.383
281 HA TRP 48 HA TRP 48 1.961 -7.353 4.763
282 1HB TRP 48 1HB TRP 48 3.811 -7.833 3.224
283 2HB TRP 48 2HB TRP 48 3.105 -6.767 2.027
284 HD1 TRP 48 HD1 TRP 48 5.581 -6.832 4.755
285 HE1 TRP 48 HE1 TRP 48 6.488 -4.467 5.154
286 HE3 TRP 48 HE3 TRP 48 2.134 -4.134 2.132
287 HZ2 TRP 48 HZ2 TRP 48 5.854 -1.824 4.482
288 HZ3 TRP 48 HZ3 TRP 48 2.357 -1.694 2.062
289 HH2 TRP 48 HH2 TRP 48 4.186 -0.568 3.201
290 H PHE 49 H PHE 49 0.898 -6.215 1.584
291 HA PHE 49 HA PHE 49 0.216 -3.612 2.513
292 1HB PHE 49 1HB PHE 49 -0.176 -5.109 -0.033
293 2HB PHE 49 2HB PHE 49 -1.147 -3.659 0.251
294 HD1 PHE 49 HD1 PHE 49 2.207 -4.976 -0.206
295 HD2 PHE 49 HD2 PHE 49 -0.141 -1.499 0.398
296 HE1 PHE 49 HE1 PHE 49 4.171 -3.581 -0.730
297 HE2 PHE 49 HE2 PHE 49 1.814 -0.077 -0.136
298 HZ PHE 49 HZ PHE 49 3.983 -1.137 -0.672
299 H GLN 50 H GLN 50 -1.629 -6.522 1.857
300 HA GLN 50 HA GLN 50 -4.146 -5.413 2.386
301 1HB GLN 50 1HB GLN 50 -4.081 -7.467 1.205
302 2HB GLN 50 2HB GLN 50 -3.088 -8.233 2.435
303 1HG GLN 50 1HG GLN 50 -4.849 -8.841 3.647
304 2HG GLN 50 2HG GLN 50 -5.654 -7.287 3.434
305 1HE2 GLN 50 1HE2 GLN 50 -5.232 -10.497 2.191
306 2HE2 GLN 50 2HE2 GLN 50 -6.548 -10.461 1.073
307 H ASN 51 H ASN 51 -1.629 -6.692 4.456
308 HA ASN 51 HA ASN 51 -3.311 -6.816 6.796
309 1HB ASN 51 1HB ASN 51 -0.440 -7.332 6.188
310 2HB ASN 51 2HB ASN 51 -0.869 -6.967 7.855
311 1HD2 ASN 51 1HD2 ASN 51 0.070 -9.246 7.905
312 2HD2 ASN 51 2HD2 ASN 51 -1.074 -10.535 7.799
313 H LYS 52 H LYS 52 -0.880 -4.620 5.478
314 HA LYS 52 HA LYS 52 -0.705 -2.901 7.700
315 1HB LYS 52 1HB LYS 52 0.582 -3.096 5.298
316 2HB LYS 52 2HB LYS 52 -0.381 -1.644 5.058
317 1HG LYS 52 1HG LYS 52 0.576 -0.854 7.290
318 2HG LYS 52 2HG LYS 52 1.745 -2.162 7.106
319 1HD LYS 52 1HD LYS 52 2.867 -0.390 6.141
320 2HD LYS 52 2HD LYS 52 2.103 -1.135 4.735
321 1HE LYS 52 1HE LYS 52 1.545 1.056 4.383
322 2HE LYS 52 2HE LYS 52 0.154 0.531 5.330
323 1HZ LYS 52 1HZ LYS 52 1.598 2.683 5.912
324 2HZ LYS 52 2HZ LYS 52 2.415 1.536 6.850
325 3HZ LYS 52 3HZ LYS 52 0.758 1.788 7.077
326 H ARG 53 H ARG 53 -2.809 -2.889 4.860
327 HA ARG 53 HA ARG 53 -4.467 -0.855 6.199
328 1HB ARG 53 1HB ARG 53 -5.128 -0.178 3.814
329 2HB ARG 53 2HB ARG 53 -3.543 0.321 4.390
330 1HG ARG 53 1HG ARG 53 -2.506 -1.514 3.175
331 2HG ARG 53 2HG ARG 53 -4.093 -2.055 2.623
332 1HD ARG 53 1HD ARG 53 -4.412 -0.013 1.386
333 2HD ARG 53 2HD ARG 53 -2.919 0.659 2.040
334 HE ARG 53 HE ARG 53 -2.101 -1.608 0.800
335 1HH1 ARG 53 1HH1 ARG 53 -3.996 1.140 -0.221
336 2HH1 ARG 53 2HH1 ARG 53 -3.486 1.036 -1.873
337 1HH2 ARG 53 1HH2 ARG 53 -1.429 -1.746 -1.372
338 2HH2 ARG 53 2HH2 ARG 53 -2.029 -0.603 -2.526
339 H ALA 54 H ALA 54 -6.090 -2.071 6.997
340 HA ALA 54 HA ALA 54 -7.580 -3.740 5.079
341 1HB ALA 54 1HB ALA 54 -7.702 -5.496 6.498
342 2HB ALA 54 2HB ALA 54 -7.738 -4.472 7.933
343 3HB ALA 54 3HB ALA 54 -6.207 -4.801 7.124
344 H LYS 55 H LYS 55 -7.931 -0.925 5.913
345 HA LYS 55 HA LYS 55 -10.714 -1.160 6.814
346 1HB LYS 55 1HB LYS 55 -8.520 0.384 8.075
347 2HB LYS 55 2HB LYS 55 -10.068 1.205 7.933
348 1HG LYS 55 1HG LYS 55 -10.664 -1.345 8.909
349 2HG LYS 55 2HG LYS 55 -9.233 -0.815 9.794
350 1HD LYS 55 1HD LYS 55 -11.165 -0.097 11.012
351 2HD LYS 55 2HD LYS 55 -10.420 1.327 10.281
352 1HE LYS 55 1HE LYS 55 -12.056 1.250 8.465
353 2HE LYS 55 2HE LYS 55 -12.796 -0.177 9.189
354 1HZ LYS 55 1HZ LYS 55 -13.713 1.039 10.874
355 2HZ LYS 55 2HZ LYS 55 -13.757 2.189 9.636
356 3HZ LYS 55 3HZ LYS 55 -12.541 2.256 10.808
357 H ILE 56 H ILE 56 -8.365 1.298 5.727
358 HA ILE 56 HA ILE 56 -8.465 2.882 4.096
359 HB ILE 56 HB ILE 56 -10.721 1.295 2.880
360 1HG1 ILE 56 1HG1 ILE 56 -7.739 0.901 2.537
361 2HG1 ILE 56 2HG1 ILE 56 -8.832 -0.204 3.365
362 1HG2 ILE 56 1HG2 ILE 56 -10.418 2.503 0.996
363 2HG2 ILE 56 2HG2 ILE 56 -8.677 2.650 1.240
364 3HG2 ILE 56 3HG2 ILE 56 -9.784 3.695 2.131
365 1HD1 ILE 56 1HD1 ILE 56 -8.979 -1.260 1.417
366 2HD1 ILE 56 2HD1 ILE 56 -8.266 0.091 0.536
367 3HD1 ILE 56 3HD1 ILE 56 -9.994 0.083 0.892
368 H LYS 57 H LYS 57 -9.187 4.572 5.366
369 HA LYS 57 HA LYS 57 -12.039 5.220 5.068
370 1HB LYS 57 1HB LYS 57 -11.482 4.401 7.385
371 2HB LYS 57 2HB LYS 57 -10.430 5.801 7.557
372 1HG LYS 57 1HG LYS 57 -12.709 7.012 6.792
373 2HG LYS 57 2HG LYS 57 -13.364 5.611 7.641
374 1HD LYS 57 1HD LYS 57 -11.510 6.344 9.416
375 2HD LYS 57 2HD LYS 57 -11.817 7.917 8.677
376 1HE LYS 57 1HE LYS 57 -14.132 6.228 9.496
377 2HE LYS 57 2HE LYS 57 -13.222 7.084 10.740
378 1HZ LYS 57 1HZ LYS 57 -13.821 9.128 9.895
379 2HZ LYS 57 2HZ LYS 57 -15.231 8.230 9.638
380 3HZ LYS 57 3HZ LYS 57 -14.171 8.525 8.353
381 H LYS 58 H LYS 58 -12.477 7.266 4.452
382 HA LYS 58 HA LYS 58 -10.208 8.979 3.825
383 1HB LYS 58 1HB LYS 58 -12.470 8.389 2.432
384 2HB LYS 58 2HB LYS 58 -12.931 9.913 3.177
385 1HG LYS 58 1HG LYS 58 -10.282 10.095 2.073
386 2HG LYS 58 2HG LYS 58 -11.430 9.536 0.855
387 1HD LYS 58 1HD LYS 58 -12.919 11.465 1.645
388 2HD LYS 58 2HD LYS 58 -11.475 12.082 2.450
389 1HE LYS 58 1HE LYS 58 -10.523 12.729 0.517
390 2HE LYS 58 2HE LYS 58 -11.081 11.300 -0.352
391 1HZ LYS 58 1HZ LYS 58 -12.393 12.804 -1.359
392 2HZ LYS 58 2HZ LYS 58 -12.328 13.909 -0.081
393 3HZ LYS 58 3HZ LYS 58 -13.379 12.585 -0.001
394 H SER 59 H SER 59 -9.875 11.011 4.644
395 HA SER 59 HA SER 59 -11.128 11.567 7.192
396 1HB SER 59 1HB SER 59 -8.747 12.564 5.712
397 2HB SER 59 2HB SER 59 -9.490 13.664 6.874
398 HG SER 59 HG SER 59 -8.994 12.323 8.492
Start of MODEL 19
1 1H ALA 16 1H ALA 16 -15.398 16.807 -6.627
2 2H ALA 16 2H ALA 16 -14.218 17.023 -5.398
3 3H ALA 16 3H ALA 16 -15.330 18.281 -5.754
4 HA ALA 16 HA ALA 16 -15.961 17.210 -3.768
5 1HB ALA 16 1HB ALA 16 -17.904 17.894 -4.709
6 2HB ALA 16 2HB ALA 16 -18.196 16.156 -4.786
7 3HB ALA 16 3HB ALA 16 -17.615 17.016 -6.211
8 H LYS 17 H LYS 17 -16.333 14.849 -6.422
9 HA LYS 17 HA LYS 17 -16.250 12.652 -4.553
10 1HB LYS 17 1HB LYS 17 -17.188 13.064 -7.206
11 2HB LYS 17 2HB LYS 17 -16.009 11.761 -7.258
12 1HG LYS 17 1HG LYS 17 -18.088 11.681 -5.140
13 2HG LYS 17 2HG LYS 17 -18.561 11.307 -6.798
14 1HD LYS 17 1HD LYS 17 -16.470 9.748 -6.746
15 2HD LYS 17 2HD LYS 17 -16.660 9.867 -4.995
16 1HE LYS 17 1HE LYS 17 -18.722 8.811 -5.017
17 2HE LYS 17 2HE LYS 17 -19.008 9.188 -6.715
18 1HZ LYS 17 1HZ LYS 17 -16.931 7.292 -5.770
19 2HZ LYS 17 2HZ LYS 17 -17.416 7.559 -7.368
20 3HZ LYS 17 3HZ LYS 17 -18.477 6.823 -6.274
21 H ARG 18 H ARG 18 -14.571 11.335 -4.117
22 HA ARG 18 HA ARG 18 -11.946 12.164 -4.933
23 1HB ARG 18 1HB ARG 18 -12.691 9.692 -3.367
24 2HB ARG 18 2HB ARG 18 -11.128 10.495 -3.410
25 1HG ARG 18 1HG ARG 18 -13.648 11.709 -2.299
26 2HG ARG 18 2HG ARG 18 -12.392 10.926 -1.339
27 1HD ARG 18 1HD ARG 18 -11.584 13.096 -3.200
28 2HD ARG 18 2HD ARG 18 -12.436 13.548 -1.724
29 HE ARG 18 HE ARG 18 -10.493 11.901 -0.826
30 1HH1 ARG 18 1HH1 ARG 18 -10.458 14.718 -2.884
31 2HH1 ARG 18 2HH1 ARG 18 -8.869 15.207 -2.400
32 1HH2 ARG 18 1HH2 ARG 18 -8.404 12.542 -0.188
33 2HH2 ARG 18 2HH2 ARG 18 -7.702 13.972 -0.869
34 H GLU 19 H GLU 19 -11.018 11.576 -6.769
35 HA GLU 19 HA GLU 19 -11.475 8.855 -7.779
36 1HB GLU 19 1HB GLU 19 -12.339 11.267 -9.011
37 2HB GLU 19 2HB GLU 19 -11.026 10.620 -9.984
38 1HG GLU 19 1HG GLU 19 -13.009 8.634 -9.153
39 2HG GLU 19 2HG GLU 19 -13.633 9.904 -10.203
40 H PHE 20 H PHE 20 -9.460 8.264 -6.894
41 HA PHE 20 HA PHE 20 -7.143 9.367 -8.343
42 1HB PHE 20 1HB PHE 20 -5.777 8.813 -6.335
43 2HB PHE 20 2HB PHE 20 -6.996 10.045 -6.024
44 HD1 PHE 20 HD1 PHE 20 -6.543 6.350 -5.817
45 HD2 PHE 20 HD2 PHE 20 -8.306 9.845 -4.147
46 HE1 PHE 20 HE1 PHE 20 -7.406 5.013 -3.941
47 HE2 PHE 20 HE2 PHE 20 -9.171 8.515 -2.267
48 HZ PHE 20 HZ PHE 20 -8.721 6.096 -2.162
49 H ASN 21 H ASN 21 -5.206 7.651 -7.823
50 HA ASN 21 HA ASN 21 -6.015 5.284 -9.249
51 1HB ASN 21 1HB ASN 21 -3.511 6.651 -8.616
52 2HB ASN 21 2HB ASN 21 -3.381 4.900 -8.499
53 1HD2 ASN 21 1HD2 ASN 21 -1.917 5.120 -10.298
54 2HD2 ASN 21 2HD2 ASN 21 -2.549 5.219 -11.903
55 H GLU 22 H GLU 22 -6.906 3.618 -8.241
56 HA GLU 22 HA GLU 22 -6.536 3.199 -5.415
57 1HB GLU 22 1HB GLU 22 -8.395 2.328 -7.465
58 2HB GLU 22 2HB GLU 22 -7.895 0.988 -6.442
59 1HG GLU 22 1HG GLU 22 -8.500 2.388 -4.461
60 2HG GLU 22 2HG GLU 22 -9.187 3.562 -5.582
61 H ASN 23 H ASN 23 -4.877 2.153 -4.595
62 HA ASN 23 HA ASN 23 -3.076 0.781 -4.367
63 1HB ASN 23 1HB ASN 23 -4.762 -1.139 -5.947
64 2HB ASN 23 2HB ASN 23 -3.458 -1.543 -4.839
65 1HD2 ASN 23 1HD2 ASN 23 -3.795 -1.365 -2.620
66 2HD2 ASN 23 2HD2 ASN 23 -5.379 -1.258 -1.939
67 H ARG 24 H ARG 24 -2.883 2.496 -6.494
68 HA ARG 24 HA ARG 24 -1.099 1.000 -8.277
69 1HB ARG 24 1HB ARG 24 -2.996 3.155 -9.228
70 2HB ARG 24 2HB ARG 24 -1.893 2.211 -10.221
71 1HG ARG 24 1HG ARG 24 -3.422 0.299 -8.941
72 2HG ARG 24 2HG ARG 24 -4.570 1.590 -9.303
73 1HD ARG 24 1HD ARG 24 -2.757 0.173 -11.252
74 2HD ARG 24 2HD ARG 24 -4.511 0.034 -11.144
75 HE ARG 24 HE ARG 24 -3.008 2.138 -12.404
76 1HH1 ARG 24 1HH1 ARG 24 -6.054 1.285 -10.928
77 2HH1 ARG 24 2HH1 ARG 24 -6.944 2.519 -11.757
78 1HH2 ARG 24 1HH2 ARG 24 -4.177 3.759 -13.496
79 2HH2 ARG 24 2HH2 ARG 24 -5.879 3.922 -13.217
80 H TYR 25 H TYR 25 -2.191 4.183 -7.222
81 HA TYR 25 HA TYR 25 -0.193 5.829 -8.061
82 1HB TYR 25 1HB TYR 25 -0.748 7.272 -6.177
83 2HB TYR 25 2HB TYR 25 -2.215 6.551 -6.831
84 HD1 TYR 25 HD1 TYR 25 -2.781 4.170 -5.650
85 HD2 TYR 25 HD2 TYR 25 -0.603 7.362 -3.876
86 HE1 TYR 25 HE1 TYR 25 -3.337 3.297 -3.427
87 HE2 TYR 25 HE2 TYR 25 -1.168 6.507 -1.641
88 HH TYR 25 HH TYR 25 -2.943 5.087 -0.605
89 H LEU 26 H LEU 26 -0.170 3.866 -5.096
90 HA LEU 26 HA LEU 26 2.727 4.351 -4.902
91 1HB LEU 26 1HB LEU 26 2.575 4.733 -2.682
92 2HB LEU 26 2HB LEU 26 0.932 5.180 -3.097
93 HG LEU 26 HG LEU 26 0.389 2.683 -2.572
94 1HD1 LEU 26 1HD1 LEU 26 2.025 2.176 -0.514
95 2HD1 LEU 26 2HD1 LEU 26 3.157 2.990 -1.593
96 3HD1 LEU 26 3HD1 LEU 26 2.297 1.552 -2.141
97 1HD2 LEU 26 1HD2 LEU 26 0.947 3.886 -0.005
98 2HD2 LEU 26 2HD2 LEU 26 -0.600 3.563 -0.785
99 3HD2 LEU 26 3HD2 LEU 26 0.266 5.059 -1.130
100 H THR 27 H THR 27 0.174 2.000 -4.888
101 HA THR 27 HA THR 27 1.218 -0.198 -3.713
102 HB THR 27 HB THR 27 -0.376 0.072 -6.245
103 HG1 THR 27 HG1 THR 27 -1.172 0.477 -3.995
104 1HG2 THR 27 1HG2 THR 27 0.424 -2.019 -6.715
105 2HG2 THR 27 2HG2 THR 27 -0.965 -2.406 -5.700
106 3HG2 THR 27 3HG2 THR 27 0.661 -2.433 -5.017
107 H GLU 28 H GLU 28 1.448 -0.061 -7.246
108 HA GLU 28 HA GLU 28 3.548 -1.864 -7.466
109 1HB GLU 28 1HB GLU 28 2.645 0.324 -9.335
110 2HB GLU 28 2HB GLU 28 3.846 -0.885 -9.769
111 1HG GLU 28 1HG GLU 28 1.791 -2.425 -8.842
112 2HG GLU 28 2HG GLU 28 0.941 -1.091 -9.620
113 H ARG 29 H ARG 29 3.651 1.639 -7.088
114 HA ARG 29 HA ARG 29 6.379 1.971 -7.737
115 1HB ARG 29 1HB ARG 29 4.320 3.594 -6.320
116 2HB ARG 29 2HB ARG 29 6.006 4.058 -6.138
117 1HG ARG 29 1HG ARG 29 5.723 3.661 -8.859
118 2HG ARG 29 2HG ARG 29 4.208 4.428 -8.377
119 1HD ARG 29 1HD ARG 29 5.881 6.090 -9.013
120 2HD ARG 29 2HD ARG 29 5.452 6.233 -7.309
121 HE ARG 29 HE ARG 29 7.632 4.645 -7.248
122 1HH1 ARG 29 1HH1 ARG 29 6.987 7.727 -8.750
123 2HH1 ARG 29 2HH1 ARG 29 8.628 8.268 -8.634
124 1HH2 ARG 29 1HH2 ARG 29 9.791 5.354 -7.094
125 2HH2 ARG 29 2HH2 ARG 29 10.220 6.921 -7.695
126 H ARG 30 H ARG 30 4.752 1.625 -4.596
127 HA ARG 30 HA ARG 30 7.256 1.583 -3.173
128 1HB ARG 30 1HB ARG 30 4.378 1.459 -2.442
129 2HB ARG 30 2HB ARG 30 5.526 0.765 -1.306
130 1HG ARG 30 1HG ARG 30 6.714 3.136 -1.833
131 2HG ARG 30 2HG ARG 30 5.013 3.571 -2.001
132 1HD ARG 30 1HD ARG 30 4.847 2.171 0.256
133 2HD ARG 30 2HD ARG 30 6.528 2.684 0.391
134 HE ARG 30 HE ARG 30 5.188 4.974 -0.209
135 1HH1 ARG 30 1HH1 ARG 30 4.850 2.538 2.267
136 2HH1 ARG 30 2HH1 ARG 30 4.211 3.640 3.440
137 1HH2 ARG 30 1HH2 ARG 30 4.348 6.426 1.333
138 2HH2 ARG 30 2HH2 ARG 30 3.925 5.847 2.910
139 H ARG 31 H ARG 31 4.995 -0.770 -4.420
140 HA ARG 31 HA ARG 31 5.773 -3.010 -2.946
141 1HB ARG 31 1HB ARG 31 4.479 -2.568 -5.590
142 2HB ARG 31 2HB ARG 31 5.110 -4.175 -5.253
143 1HG ARG 31 1HG ARG 31 3.766 -3.820 -2.997
144 2HG ARG 31 2HG ARG 31 2.835 -2.730 -4.025
145 1HD ARG 31 1HD ARG 31 3.355 -5.664 -4.469
146 2HD ARG 31 2HD ARG 31 1.814 -4.900 -4.086
147 HE ARG 31 HE ARG 31 3.014 -3.931 -6.512
148 1HH1 ARG 31 1HH1 ARG 31 0.969 -6.390 -5.115
149 2HH1 ARG 31 2HH1 ARG 31 0.154 -6.735 -6.603
150 1HH2 ARG 31 1HH2 ARG 31 1.944 -4.384 -8.470
151 2HH2 ARG 31 2HH2 ARG 31 0.708 -5.597 -8.509
152 H GLN 32 H GLN 32 7.145 -1.589 -5.864
153 HA GLN 32 HA GLN 32 9.004 -3.690 -6.347
154 1HB GLN 32 1HB GLN 32 8.123 -1.715 -7.882
155 2HB GLN 32 2HB GLN 32 9.558 -0.908 -7.267
156 1HG GLN 32 1HG GLN 32 10.857 -2.947 -8.020
157 2HG GLN 32 2HG GLN 32 9.396 -3.434 -8.879
158 1HE2 GLN 32 1HE2 GLN 32 11.243 -0.433 -8.420
159 2HE2 GLN 32 2HE2 GLN 32 11.292 -0.007 -10.094
160 H GLN 33 H GLN 33 9.188 -0.588 -4.661
161 HA GLN 33 HA GLN 33 11.984 -0.821 -4.095
162 1HB GLN 33 1HB GLN 33 9.797 1.027 -3.196
163 2HB GLN 33 2HB GLN 33 11.368 1.060 -2.408
164 1HG GLN 33 1HG GLN 33 12.455 1.610 -4.479
165 2HG GLN 33 2HG GLN 33 10.941 1.424 -5.364
166 1HE2 GLN 33 1HE2 GLN 33 10.140 3.300 -5.941
167 2HE2 GLN 33 2HE2 GLN 33 10.170 4.757 -5.013
168 H LEU 34 H LEU 34 9.006 -1.533 -2.339
169 HA LEU 34 HA LEU 34 10.192 -2.019 0.171
170 1HB LEU 34 1HB LEU 34 7.591 -2.518 -1.100
171 2HB LEU 34 2HB LEU 34 8.012 -3.669 0.154
172 HG LEU 34 HG LEU 34 8.259 -0.746 0.728
173 1HD1 LEU 34 1HD1 LEU 34 5.880 -0.923 1.617
174 2HD1 LEU 34 2HD1 LEU 34 5.712 -2.322 0.558
175 3HD1 LEU 34 3HD1 LEU 34 6.079 -0.738 -0.124
176 1HD2 LEU 34 1HD2 LEU 34 9.069 -2.546 2.281
177 2HD2 LEU 34 2HD2 LEU 34 7.387 -3.041 2.470
178 3HD2 LEU 34 3HD2 LEU 34 7.894 -1.429 2.975
179 H SER 35 H SER 35 9.546 -4.113 -2.596
180 HA SER 35 HA SER 35 10.234 -6.552 -1.394
181 1HB SER 35 1HB SER 35 9.102 -6.566 -3.516
182 2HB SER 35 2HB SER 35 10.399 -5.643 -4.275
183 HG SER 35 HG SER 35 10.578 -7.856 -4.760
184 H SER 36 H SER 36 12.210 -4.366 -3.400
185 HA SER 36 HA SER 36 14.618 -5.815 -3.027
186 1HB SER 36 1HB SER 36 13.978 -4.066 -4.852
187 2HB SER 36 2HB SER 36 14.575 -2.887 -3.684
188 HG SER 36 HG SER 36 16.576 -3.839 -3.760
189 H GLU 37 H GLU 37 13.273 -2.935 -1.460
190 HA GLU 37 HA GLU 37 15.535 -2.433 0.176
191 1HB GLU 37 1HB GLU 37 13.636 -0.830 -0.462
192 2HB GLU 37 2HB GLU 37 12.725 -1.587 0.838
193 1HG GLU 37 1HG GLU 37 15.045 -1.003 2.106
194 2HG GLU 37 2HG GLU 37 14.948 0.320 0.946
195 H LEU 38 H LEU 38 12.384 -3.939 0.896
196 HA LEU 38 HA LEU 38 13.289 -4.701 3.537
197 1HB LEU 38 1HB LEU 38 10.799 -4.244 2.347
198 2HB LEU 38 2HB LEU 38 10.819 -5.962 2.700
199 HG LEU 38 HG LEU 38 11.647 -5.130 5.068
200 1HD1 LEU 38 1HD1 LEU 38 9.814 -2.870 4.589
201 2HD1 LEU 38 2HD1 LEU 38 11.442 -2.707 3.931
202 3HD1 LEU 38 3HD1 LEU 38 11.213 -2.995 5.656
203 1HD2 LEU 38 1HD2 LEU 38 9.129 -4.853 5.634
204 2HD2 LEU 38 2HD2 LEU 38 9.715 -6.400 5.022
205 3HD2 LEU 38 3HD2 LEU 38 8.881 -5.281 3.941
206 H GLY 39 H GLY 39 13.441 -6.038 0.418
207 1HA GLY 39 1HA GLY 39 14.290 -8.050 -0.307
208 2HA GLY 39 2HA GLY 39 14.711 -8.404 1.363
209 H LEU 40 H LEU 40 11.471 -7.636 0.312
210 HA LEU 40 HA LEU 40 10.617 -10.314 1.149
211 1HB LEU 40 1HB LEU 40 9.434 -7.624 1.217
212 2HB LEU 40 2HB LEU 40 8.321 -8.898 0.756
213 HG LEU 40 HG LEU 40 9.941 -8.854 3.299
214 1HD1 LEU 40 1HD1 LEU 40 8.366 -7.212 3.645
215 2HD1 LEU 40 2HD1 LEU 40 7.501 -8.647 4.200
216 3HD1 LEU 40 3HD1 LEU 40 7.174 -7.984 2.595
217 1HD2 LEU 40 1HD2 LEU 40 7.882 -10.620 3.627
218 2HD2 LEU 40 2HD2 LEU 40 9.540 -11.061 3.221
219 3HD2 LEU 40 3HD2 LEU 40 8.335 -10.895 1.944
220 H ASN 41 H ASN 41 9.015 -11.436 -0.047
221 HA ASN 41 HA ASN 41 9.337 -11.136 -2.921
222 1HB ASN 41 1HB ASN 41 9.186 -13.347 -1.335
223 2HB ASN 41 2HB ASN 41 7.513 -13.216 -1.871
224 1HD2 ASN 41 1HD2 ASN 41 7.367 -12.698 -4.308
225 2HD2 ASN 41 2HD2 ASN 41 8.346 -13.692 -5.327
226 H GLU 42 H GLU 42 7.615 -10.718 -4.344
227 HA GLU 42 HA GLU 42 5.711 -8.873 -3.590
228 1HB GLU 42 1HB GLU 42 5.346 -10.889 -5.817
229 2HB GLU 42 2HB GLU 42 4.619 -9.292 -5.704
230 1HG GLU 42 1HG GLU 42 6.292 -8.628 -7.009
231 2HG GLU 42 2HG GLU 42 7.287 -8.724 -5.556
232 H ALA 43 H ALA 43 5.593 -12.357 -3.472
233 HA ALA 43 HA ALA 43 2.837 -12.728 -3.070
234 1HB ALA 43 1HB ALA 43 4.648 -14.547 -1.617
235 2HB ALA 43 2HB ALA 43 4.933 -14.401 -3.351
236 3HB ALA 43 3HB ALA 43 3.351 -14.905 -2.757
237 H GLN 44 H GLN 44 5.471 -12.024 -0.834
238 HA GLN 44 HA GLN 44 3.814 -12.181 1.520
239 1HB GLN 44 1HB GLN 44 6.610 -11.174 0.985
240 2HB GLN 44 2HB GLN 44 5.851 -11.029 2.564
241 1HG GLN 44 1HG GLN 44 5.485 -13.687 1.905
242 2HG GLN 44 2HG GLN 44 7.103 -13.319 1.309
243 1HE2 GLN 44 1HE2 GLN 44 5.318 -12.105 4.115
244 2HE2 GLN 44 2HE2 GLN 44 6.478 -12.610 5.291
245 H ILE 45 H ILE 45 4.843 -9.819 -0.767
246 HA ILE 45 HA ILE 45 4.246 -7.480 0.670
247 HB ILE 45 HB ILE 45 4.464 -8.052 -2.274
248 1HG1 ILE 45 1HG1 ILE 45 6.370 -7.864 -0.279
249 2HG1 ILE 45 2HG1 ILE 45 6.668 -7.678 -2.005
250 1HG2 ILE 45 1HG2 ILE 45 4.502 -5.645 -2.664
251 2HG2 ILE 45 2HG2 ILE 45 4.163 -5.362 -0.959
252 3HG2 ILE 45 3HG2 ILE 45 2.959 -6.150 -1.976
253 1HD1 ILE 45 1HD1 ILE 45 6.520 -5.304 -1.831
254 2HD1 ILE 45 2HD1 ILE 45 7.643 -5.893 -0.607
255 3HD1 ILE 45 3HD1 ILE 45 6.009 -5.406 -0.145
256 H LYS 46 H LYS 46 2.300 -9.542 -1.462
257 HA LYS 46 HA LYS 46 0.063 -7.898 -1.740
258 1HB LYS 46 1HB LYS 46 0.740 -10.521 -2.426
259 2HB LYS 46 2HB LYS 46 -0.670 -10.691 -1.391
260 1HG LYS 46 1HG LYS 46 -1.870 -9.078 -2.835
261 2HG LYS 46 2HG LYS 46 -0.468 -9.054 -3.908
262 1HD LYS 46 1HD LYS 46 -0.916 -11.727 -3.671
263 2HD LYS 46 2HD LYS 46 -2.559 -11.089 -3.574
264 1HE LYS 46 1HE LYS 46 -2.558 -10.398 -5.725
265 2HE LYS 46 2HE LYS 46 -0.859 -9.930 -5.684
266 1HZ LYS 46 1HZ LYS 46 -0.636 -12.569 -5.524
267 2HZ LYS 46 2HZ LYS 46 -0.655 -11.733 -6.994
268 3HZ LYS 46 3HZ LYS 46 -2.067 -12.468 -6.421
269 H ILE 47 H ILE 47 0.801 -10.342 0.709
270 HA ILE 47 HA ILE 47 -1.516 -9.872 2.309
271 HB ILE 47 HB ILE 47 0.993 -11.415 2.532
272 1HG1 ILE 47 1HG1 ILE 47 -1.749 -12.088 3.594
273 2HG1 ILE 47 2HG1 ILE 47 -1.339 -12.248 1.889
274 1HG2 ILE 47 1HG2 ILE 47 0.625 -11.826 4.987
275 2HG2 ILE 47 2HG2 ILE 47 -0.417 -10.403 4.990
276 3HG2 ILE 47 3HG2 ILE 47 1.291 -10.245 4.573
277 1HD1 ILE 47 1HD1 ILE 47 0.608 -13.530 3.609
278 2HD1 ILE 47 2HD1 ILE 47 -0.290 -14.173 2.233
279 3HD1 ILE 47 3HD1 ILE 47 -1.022 -14.163 3.838
280 H TRP 48 H TRP 48 1.780 -8.763 2.293
281 HA TRP 48 HA TRP 48 1.955 -7.370 4.680
282 1HB TRP 48 1HB TRP 48 3.830 -7.874 3.176
283 2HB TRP 48 2HB TRP 48 3.167 -6.789 1.971
284 HD1 TRP 48 HD1 TRP 48 5.588 -6.912 4.744
285 HE1 TRP 48 HE1 TRP 48 6.510 -4.562 5.195
286 HE3 TRP 48 HE3 TRP 48 2.223 -4.143 2.091
287 HZ2 TRP 48 HZ2 TRP 48 5.915 -1.903 4.550
288 HZ3 TRP 48 HZ3 TRP 48 2.470 -1.703 2.063
289 HH2 TRP 48 HH2 TRP 48 4.285 -0.611 3.255
290 H PHE 49 H PHE 49 0.986 -6.212 1.481
291 HA PHE 49 HA PHE 49 0.334 -3.602 2.401
292 1HB PHE 49 1HB PHE 49 0.014 -5.071 -0.166
293 2HB PHE 49 2HB PHE 49 -0.971 -3.626 0.093
294 HD1 PHE 49 HD1 PHE 49 0.036 -1.457 0.320
295 HD2 PHE 49 HD2 PHE 49 2.408 -4.926 -0.279
296 HE1 PHE 49 HE1 PHE 49 2.007 -0.031 -0.119
297 HE2 PHE 49 HE2 PHE 49 4.379 -3.520 -0.725
298 HZ PHE 49 HZ PHE 49 4.187 -1.080 -0.619
299 H GLN 50 H GLN 50 -1.565 -6.495 1.762
300 HA GLN 50 HA GLN 50 -4.067 -5.306 2.223
301 1HB GLN 50 1HB GLN 50 -3.097 -8.156 2.385
302 2HB GLN 50 2HB GLN 50 -4.763 -7.728 2.745
303 1HG GLN 50 1HG GLN 50 -4.860 -6.675 0.458
304 2HG GLN 50 2HG GLN 50 -3.303 -7.438 0.140
305 1HE2 GLN 50 1HE2 GLN 50 -6.297 -8.487 1.735
306 2HE2 GLN 50 2HE2 GLN 50 -6.491 -9.926 0.798
307 H ASN 51 H ASN 51 -1.609 -6.601 4.351
308 HA ASN 51 HA ASN 51 -3.269 -6.729 6.677
309 1HB ASN 51 1HB ASN 51 -0.378 -7.052 6.075
310 2HB ASN 51 2HB ASN 51 -0.800 -6.621 7.730
311 1HD2 ASN 51 1HD2 ASN 51 0.415 -9.017 7.072
312 2HD2 ASN 51 2HD2 ASN 51 -0.688 -10.310 7.380
313 H LYS 52 H LYS 52 -1.267 -4.285 5.182
314 HA LYS 52 HA LYS 52 -1.160 -2.529 7.418
315 1HB LYS 52 1HB LYS 52 -0.874 -1.866 4.482
316 2HB LYS 52 2HB LYS 52 -0.354 -0.864 5.829
317 1HG LYS 52 1HG LYS 52 0.813 -3.467 6.066
318 2HG LYS 52 2HG LYS 52 1.120 -2.817 4.454
319 1HD LYS 52 1HD LYS 52 2.840 -1.757 5.432
320 2HD LYS 52 2HD LYS 52 1.609 -0.646 6.035
321 1HE LYS 52 1HE LYS 52 2.625 -1.173 8.005
322 2HE LYS 52 2HE LYS 52 1.427 -2.466 7.947
323 1HZ LYS 52 1HZ LYS 52 3.966 -3.025 6.648
324 2HZ LYS 52 2HZ LYS 52 2.997 -4.024 7.610
325 3HZ LYS 52 3HZ LYS 52 4.019 -2.887 8.334
326 H ARG 53 H ARG 53 -3.436 -3.047 4.822
327 HA ARG 53 HA ARG 53 -4.879 -0.625 5.101
328 1HB ARG 53 1HB ARG 53 -4.916 -2.351 3.174
329 2HB ARG 53 2HB ARG 53 -6.103 -3.202 4.152
330 1HG ARG 53 1HG ARG 53 -7.117 -1.744 2.447
331 2HG ARG 53 2HG ARG 53 -7.587 -1.311 4.092
332 1HD ARG 53 1HD ARG 53 -6.690 0.724 3.909
333 2HD ARG 53 2HD ARG 53 -5.193 0.086 3.230
334 HE ARG 53 HE ARG 53 -7.423 1.188 1.788
335 1HH1 ARG 53 1HH1 ARG 53 -4.650 -0.923 1.599
336 2HH1 ARG 53 2HH1 ARG 53 -4.495 -0.771 -0.118
337 1HH2 ARG 53 1HH2 ARG 53 -7.222 1.387 -0.471
338 2HH2 ARG 53 2HH2 ARG 53 -5.955 0.541 -1.295
339 H ALA 54 H ALA 54 -4.991 -3.698 6.753
340 HA ALA 54 HA ALA 54 -7.358 -2.823 8.262
341 1HB ALA 54 1HB ALA 54 -7.967 -4.986 8.504
342 2HB ALA 54 2HB ALA 54 -6.304 -5.551 8.661
343 3HB ALA 54 3HB ALA 54 -6.968 -5.193 7.067
344 H LYS 55 H LYS 55 -4.624 -1.811 8.685
345 HA LYS 55 HA LYS 55 -3.744 -3.000 11.171
346 1HB LYS 55 1HB LYS 55 -2.327 -1.848 9.269
347 2HB LYS 55 2HB LYS 55 -2.700 -0.385 10.169
348 1HG LYS 55 1HG LYS 55 -1.817 -1.680 12.213
349 2HG LYS 55 2HG LYS 55 -1.096 -2.761 11.018
350 1HD LYS 55 1HD LYS 55 0.445 -1.236 10.378
351 2HD LYS 55 2HD LYS 55 -0.671 0.119 10.556
352 1HE LYS 55 1HE LYS 55 0.117 0.601 12.582
353 2HE LYS 55 2HE LYS 55 -0.055 -1.071 13.115
354 1HZ LYS 55 1HZ LYS 55 2.092 -1.283 11.575
355 2HZ LYS 55 2HZ LYS 55 2.176 -0.928 13.227
356 3HZ LYS 55 3HZ LYS 55 2.284 0.318 12.088
357 H ILE 56 H ILE 56 -4.530 0.372 10.308
358 HA ILE 56 HA ILE 56 -5.497 2.058 11.492
359 HB ILE 56 HB ILE 56 -6.990 -0.132 12.936
360 1HG1 ILE 56 1HG1 ILE 56 -8.244 1.266 10.650
361 2HG1 ILE 56 2HG1 ILE 56 -6.955 0.139 10.238
362 1HG2 ILE 56 1HG2 ILE 56 -8.364 1.449 13.763
363 2HG2 ILE 56 2HG2 ILE 56 -8.272 2.442 12.309
364 3HG2 ILE 56 3HG2 ILE 56 -6.975 2.504 13.502
365 1HD1 ILE 56 1HD1 ILE 56 -9.085 -0.767 12.096
366 2HD1 ILE 56 2HD1 ILE 56 -8.144 -1.682 10.918
367 3HD1 ILE 56 3HD1 ILE 56 -9.454 -0.633 10.377
368 H LYS 57 H LYS 57 -3.920 2.976 12.699
369 HA LYS 57 HA LYS 57 -2.685 1.782 14.937
370 1HB LYS 57 1HB LYS 57 -2.854 4.631 13.973
371 2HB LYS 57 2HB LYS 57 -1.965 4.187 15.424
372 1HG LYS 57 1HG LYS 57 -1.275 2.538 13.129
373 2HG LYS 57 2HG LYS 57 -0.965 4.255 12.867
374 1HD LYS 57 1HD LYS 57 0.012 3.924 15.379
375 2HD LYS 57 2HD LYS 57 0.358 2.346 14.668
376 1HE LYS 57 1HE LYS 57 1.693 3.275 12.980
377 2HE LYS 57 2HE LYS 57 1.058 4.897 13.252
378 1HZ LYS 57 1HZ LYS 57 2.438 3.631 15.486
379 2HZ LYS 57 2HZ LYS 57 2.443 5.247 14.987
380 3HZ LYS 57 3HZ LYS 57 3.397 4.110 14.177
381 H LYS 58 H LYS 58 -3.362 1.550 16.961
382 HA LYS 58 HA LYS 58 -5.574 3.256 17.902
383 1HB LYS 58 1HB LYS 58 -5.768 0.579 17.482
384 2HB LYS 58 2HB LYS 58 -5.260 0.606 19.164
385 1HG LYS 58 1HG LYS 58 -7.327 1.066 19.796
386 2HG LYS 58 2HG LYS 58 -7.310 2.543 18.832
387 1HD LYS 58 1HD LYS 58 -7.912 -0.174 17.679
388 2HD LYS 58 2HD LYS 58 -9.159 0.908 18.303
389 1HE LYS 58 1HE LYS 58 -7.793 2.582 16.663
390 2HE LYS 58 2HE LYS 58 -7.597 1.048 15.814
391 1HZ LYS 58 1HZ LYS 58 -10.277 1.680 16.760
392 2HZ LYS 58 2HZ LYS 58 -9.783 0.936 15.324
393 3HZ LYS 58 3HZ LYS 58 -9.694 2.618 15.478
394 H SER 59 H SER 59 -5.368 4.200 19.865
395 HA SER 59 HA SER 59 -2.792 4.364 21.038
396 1HB SER 59 1HB SER 59 -5.487 5.326 22.023
397 2HB SER 59 2HB SER 59 -3.951 5.726 22.790
398 HG SER 59 HG SER 59 -4.963 7.183 21.065
Start of MODEL 20
1 1H ALA 16 1H ALA 16 -12.088 8.584 -17.230
2 2H ALA 16 2H ALA 16 -11.904 10.273 -17.471
3 3H ALA 16 3H ALA 16 -13.467 9.603 -17.239
4 HA ALA 16 HA ALA 16 -11.310 10.039 -15.325
5 1HB ALA 16 1HB ALA 16 -14.277 10.434 -15.034
6 2HB ALA 16 2HB ALA 16 -13.215 11.655 -15.736
7 3HB ALA 16 3HB ALA 16 -12.978 11.136 -14.067
8 H LYS 17 H LYS 17 -12.001 9.258 -13.064
9 HA LYS 17 HA LYS 17 -13.088 6.528 -13.238
10 1HB LYS 17 1HB LYS 17 -10.471 6.927 -12.923
11 2HB LYS 17 2HB LYS 17 -10.956 7.105 -11.242
12 1HG LYS 17 1HG LYS 17 -11.061 4.909 -11.006
13 2HG LYS 17 2HG LYS 17 -12.225 4.792 -12.328
14 1HD LYS 17 1HD LYS 17 -10.133 5.011 -13.849
15 2HD LYS 17 2HD LYS 17 -9.242 4.540 -12.401
16 1HE LYS 17 1HE LYS 17 -9.634 2.443 -13.088
17 2HE LYS 17 2HE LYS 17 -11.251 2.700 -12.434
18 1HZ LYS 17 1HZ LYS 17 -11.729 1.996 -14.539
19 2HZ LYS 17 2HZ LYS 17 -10.355 2.702 -15.227
20 3HZ LYS 17 3HZ LYS 17 -11.678 3.666 -14.802
21 H ARG 18 H ARG 18 -14.370 5.857 -11.557
22 HA ARG 18 HA ARG 18 -15.746 7.802 -10.081
23 1HB ARG 18 1HB ARG 18 -16.715 5.624 -10.659
24 2HB ARG 18 2HB ARG 18 -15.569 4.823 -9.592
25 1HG ARG 18 1HG ARG 18 -16.556 6.123 -7.696
26 2HG ARG 18 2HG ARG 18 -17.801 6.683 -8.815
27 1HD ARG 18 1HD ARG 18 -18.010 4.081 -9.285
28 2HD ARG 18 2HD ARG 18 -17.353 3.985 -7.653
29 HE ARG 18 HE ARG 18 -19.987 4.846 -8.415
30 1HH1 ARG 18 1HH1 ARG 18 -17.516 5.032 -5.958
31 2HH1 ARG 18 2HH1 ARG 18 -18.628 5.420 -4.691
32 1HH2 ARG 18 1HH2 ARG 18 -21.453 5.356 -6.748
33 2HH2 ARG 18 2HH2 ARG 18 -20.864 5.604 -5.139
34 H GLU 19 H GLU 19 -12.922 5.890 -9.336
35 HA GLU 19 HA GLU 19 -12.531 7.465 -6.914
36 1HB GLU 19 1HB GLU 19 -13.571 4.919 -6.718
37 2HB GLU 19 2HB GLU 19 -11.849 4.649 -6.490
38 1HG GLU 19 1HG GLU 19 -12.509 5.005 -4.338
39 2HG GLU 19 2HG GLU 19 -12.067 6.645 -4.813
40 H PHE 20 H PHE 20 -10.310 7.079 -5.986
41 HA PHE 20 HA PHE 20 -8.356 7.521 -7.933
42 1HB PHE 20 1HB PHE 20 -6.724 7.175 -6.061
43 2HB PHE 20 2HB PHE 20 -8.019 8.308 -5.680
44 HD1 PHE 20 HD1 PHE 20 -7.268 4.661 -5.399
45 HD2 PHE 20 HD2 PHE 20 -9.046 8.105 -3.642
46 HE1 PHE 20 HE1 PHE 20 -7.813 3.350 -3.391
47 HE2 PHE 20 HE2 PHE 20 -9.593 6.800 -1.630
48 HZ PHE 20 HZ PHE 20 -8.978 4.419 -1.502
49 H ASN 21 H ASN 21 -6.176 6.067 -7.561
50 HA ASN 21 HA ASN 21 -6.821 3.563 -8.835
51 1HB ASN 21 1HB ASN 21 -4.474 5.265 -8.533
52 2HB ASN 21 2HB ASN 21 -4.094 3.559 -8.340
53 1HD2 ASN 21 1HD2 ASN 21 -5.767 2.342 -10.062
54 2HD2 ASN 21 2HD2 ASN 21 -5.432 2.835 -11.683
55 H GLU 22 H GLU 22 -7.031 1.652 -7.866
56 HA GLU 22 HA GLU 22 -6.412 1.462 -5.018
57 1HB GLU 22 1HB GLU 22 -8.394 0.309 -6.782
58 2HB GLU 22 2HB GLU 22 -7.573 -0.946 -5.865
59 1HG GLU 22 1HG GLU 22 -8.063 0.874 -3.922
60 2HG GLU 22 2HG GLU 22 -9.453 1.120 -4.980
61 H ASN 23 H ASN 23 -4.382 0.882 -4.594
62 HA ASN 23 HA ASN 23 -2.456 -0.323 -4.528
63 1HB ASN 23 1HB ASN 23 -4.428 -2.295 -5.546
64 2HB ASN 23 2HB ASN 23 -2.723 -2.708 -5.645
65 1HD2 ASN 23 1HD2 ASN 23 -4.474 -0.872 -3.189
66 2HD2 ASN 23 2HD2 ASN 23 -4.097 -1.929 -1.876
67 H ARG 24 H ARG 24 -2.837 1.457 -6.586
68 HA ARG 24 HA ARG 24 -1.029 0.363 -8.614
69 1HB ARG 24 1HB ARG 24 -3.457 2.040 -9.286
70 2HB ARG 24 2HB ARG 24 -2.295 1.372 -10.427
71 1HG ARG 24 1HG ARG 24 -3.913 -0.384 -8.617
72 2HG ARG 24 2HG ARG 24 -4.535 0.183 -10.168
73 1HD ARG 24 1HD ARG 24 -1.835 -0.925 -10.319
74 2HD ARG 24 2HD ARG 24 -3.043 -2.086 -9.771
75 HE ARG 24 HE ARG 24 -3.826 -0.603 -12.108
76 1HH1 ARG 24 1HH1 ARG 24 -2.134 -3.420 -10.934
77 2HH1 ARG 24 2HH1 ARG 24 -2.319 -4.302 -12.413
78 1HH2 ARG 24 1HH2 ARG 24 -4.070 -1.761 -14.053
79 2HH2 ARG 24 2HH2 ARG 24 -3.417 -3.360 -14.183
80 H TYR 25 H TYR 25 -2.608 3.229 -7.313
81 HA TYR 25 HA TYR 25 -1.056 5.228 -8.401
82 1HB TYR 25 1HB TYR 25 -1.800 6.615 -6.544
83 2HB TYR 25 2HB TYR 25 -3.123 5.587 -7.086
84 HD1 TYR 25 HD1 TYR 25 -3.287 3.265 -5.781
85 HD2 TYR 25 HD2 TYR 25 -1.421 6.775 -4.263
86 HE1 TYR 25 HE1 TYR 25 -3.570 2.416 -3.498
87 HE2 TYR 25 HE2 TYR 25 -1.704 5.937 -1.970
88 HH TYR 25 HH TYR 25 -2.623 2.714 -1.289
89 H LEU 26 H LEU 26 -0.521 3.482 -5.352
90 HA LEU 26 HA LEU 26 2.257 4.461 -5.382
91 1HB LEU 26 1HB LEU 26 1.587 5.558 -3.527
92 2HB LEU 26 2HB LEU 26 0.194 4.524 -3.298
93 HG LEU 26 HG LEU 26 2.945 3.544 -2.603
94 1HD1 LEU 26 1HD1 LEU 26 3.072 5.292 -1.183
95 2HD1 LEU 26 2HD1 LEU 26 1.984 4.300 -0.211
96 3HD1 LEU 26 3HD1 LEU 26 1.334 5.591 -1.224
97 1HD2 LEU 26 1HD2 LEU 26 0.287 2.514 -2.462
98 2HD2 LEU 26 2HD2 LEU 26 0.912 2.702 -0.823
99 3HD2 LEU 26 3HD2 LEU 26 1.802 1.736 -2.001
100 H THR 27 H THR 27 0.079 1.859 -4.415
101 HA THR 27 HA THR 27 1.701 0.012 -3.309
102 HB THR 27 HB THR 27 -0.631 -0.183 -5.140
103 HG1 THR 27 HG1 THR 27 -0.950 0.157 -2.939
104 1HG2 THR 27 1HG2 THR 27 -0.711 -2.642 -4.816
105 2HG2 THR 27 2HG2 THR 27 0.968 -2.576 -4.278
106 3HG2 THR 27 3HG2 THR 27 0.548 -2.097 -5.923
107 H GLU 28 H GLU 28 1.133 0.085 -6.839
108 HA GLU 28 HA GLU 28 3.025 -1.796 -7.550
109 1HB GLU 28 1HB GLU 28 1.742 0.489 -8.967
110 2HB GLU 28 2HB GLU 28 3.102 -0.309 -9.743
111 1HG GLU 28 1HG GLU 28 1.089 -2.148 -8.696
112 2HG GLU 28 2HG GLU 28 0.495 -1.065 -9.954
113 H ARG 29 H ARG 29 3.482 1.737 -7.376
114 HA ARG 29 HA ARG 29 6.190 1.688 -8.168
115 1HB ARG 29 1HB ARG 29 4.369 3.677 -6.918
116 2HB ARG 29 2HB ARG 29 6.098 3.973 -6.783
117 1HG ARG 29 1HG ARG 29 4.590 3.550 -9.356
118 2HG ARG 29 2HG ARG 29 5.121 5.105 -8.714
119 1HD ARG 29 1HD ARG 29 6.819 2.820 -9.685
120 2HD ARG 29 2HD ARG 29 6.721 4.455 -10.339
121 HE ARG 29 HE ARG 29 7.584 4.862 -7.813
122 1HH1 ARG 29 1HH1 ARG 29 8.685 2.784 -10.390
123 2HH1 ARG 29 2HH1 ARG 29 10.341 2.824 -9.885
124 1HH2 ARG 29 1HH2 ARG 29 9.761 4.918 -7.147
125 2HH2 ARG 29 2HH2 ARG 29 10.952 4.036 -8.043
126 H ARG 30 H ARG 30 4.697 1.862 -4.952
127 HA ARG 30 HA ARG 30 7.192 1.836 -3.568
128 1HB ARG 30 1HB ARG 30 4.749 2.608 -2.840
129 2HB ARG 30 2HB ARG 30 4.693 0.970 -2.205
130 1HG ARG 30 1HG ARG 30 6.606 1.382 -0.816
131 2HG ARG 30 2HG ARG 30 6.844 2.971 -1.546
132 1HD ARG 30 1HD ARG 30 5.262 3.923 -0.270
133 2HD ARG 30 2HD ARG 30 4.164 2.555 -0.447
134 HE ARG 30 HE ARG 30 6.395 2.034 1.289
135 1HH1 ARG 30 1HH1 ARG 30 3.158 3.324 1.096
136 2HH1 ARG 30 2HH1 ARG 30 2.823 3.067 2.776
137 1HH2 ARG 30 1HH2 ARG 30 5.955 1.696 3.498
138 2HH2 ARG 30 2HH2 ARG 30 4.410 2.145 4.139
139 H ARG 31 H ARG 31 5.110 -0.615 -4.839
140 HA ARG 31 HA ARG 31 5.770 -2.758 -3.164
141 1HB ARG 31 1HB ARG 31 4.613 -2.432 -5.858
142 2HB ARG 31 2HB ARG 31 5.391 -3.981 -5.569
143 1HG ARG 31 1HG ARG 31 3.951 -3.887 -3.355
144 2HG ARG 31 2HG ARG 31 2.951 -2.824 -4.344
145 1HD ARG 31 1HD ARG 31 3.801 -5.626 -5.064
146 2HD ARG 31 2HD ARG 31 2.204 -5.146 -4.492
147 HE ARG 31 HE ARG 31 3.061 -3.745 -6.853
148 1HH1 ARG 31 1HH1 ARG 31 1.489 -6.616 -5.639
149 2HH1 ARG 31 2HH1 ARG 31 0.615 -6.908 -7.105
150 1HH2 ARG 31 1HH2 ARG 31 1.911 -4.128 -8.781
151 2HH2 ARG 31 2HH2 ARG 31 0.854 -5.496 -8.888
152 H GLN 32 H GLN 32 7.327 -1.543 -6.098
153 HA GLN 32 HA GLN 32 9.280 -3.588 -6.263
154 1HB GLN 32 1HB GLN 32 8.653 -2.127 -8.160
155 2HB GLN 32 2HB GLN 32 9.404 -0.765 -7.338
156 1HG GLN 32 1HG GLN 32 11.399 -1.305 -8.123
157 2HG GLN 32 2HG GLN 32 11.250 -2.955 -7.523
158 1HE2 GLN 32 1HE2 GLN 32 9.670 -4.306 -8.897
159 2HE2 GLN 32 2HE2 GLN 32 9.895 -4.196 -10.607
160 H GLN 33 H GLN 33 9.201 -0.440 -4.683
161 HA GLN 33 HA GLN 33 11.959 -0.498 -3.919
162 1HB GLN 33 1HB GLN 33 9.624 1.213 -3.068
163 2HB GLN 33 2HB GLN 33 11.238 1.408 -2.396
164 1HG GLN 33 1HG GLN 33 12.060 2.353 -4.276
165 2HG GLN 33 2HG GLN 33 11.025 1.401 -5.340
166 1HE2 GLN 33 1HE2 GLN 33 10.689 3.869 -2.807
167 2HE2 GLN 33 2HE2 GLN 33 9.513 4.816 -3.648
168 H LEU 34 H LEU 34 8.890 -1.168 -2.262
169 HA LEU 34 HA LEU 34 10.018 -1.665 0.275
170 1HB LEU 34 1HB LEU 34 7.420 -2.092 -1.038
171 2HB LEU 34 2HB LEU 34 7.777 -3.218 0.259
172 HG LEU 34 HG LEU 34 8.078 -0.269 0.702
173 1HD1 LEU 34 1HD1 LEU 34 5.874 -0.336 -0.106
174 2HD1 LEU 34 2HD1 LEU 34 5.728 -0.388 1.651
175 3HD1 LEU 34 3HD1 LEU 34 5.535 -1.865 0.705
176 1HD2 LEU 34 1HD2 LEU 34 7.266 -2.473 2.584
177 2HD2 LEU 34 2HD2 LEU 34 7.778 -0.835 2.989
178 3HD2 LEU 34 3HD2 LEU 34 8.940 -1.981 2.323
179 H SER 35 H SER 35 9.348 -3.752 -2.486
180 HA SER 35 HA SER 35 9.911 -6.212 -1.261
181 1HB SER 35 1HB SER 35 8.867 -5.748 -3.574
182 2HB SER 35 2HB SER 35 10.530 -5.628 -4.152
183 HG SER 35 HG SER 35 9.397 -7.774 -4.200
184 H SER 36 H SER 36 12.008 -4.030 -3.134
185 HA SER 36 HA SER 36 14.351 -5.596 -2.814
186 1HB SER 36 1HB SER 36 15.532 -3.509 -3.560
187 2HB SER 36 2HB SER 36 14.231 -4.022 -4.634
188 HG SER 36 HG SER 36 14.114 -1.970 -2.676
189 H GLU 37 H GLU 37 12.970 -2.900 -1.009
190 HA GLU 37 HA GLU 37 15.211 -2.503 0.691
191 1HB GLU 37 1HB GLU 37 12.410 -1.550 0.573
192 2HB GLU 37 2HB GLU 37 13.182 -1.493 2.150
193 1HG GLU 37 1HG GLU 37 14.745 -0.415 -0.105
194 2HG GLU 37 2HG GLU 37 13.308 0.493 0.361
195 H LEU 38 H LEU 38 12.165 -4.292 1.083
196 HA LEU 38 HA LEU 38 12.957 -5.226 3.707
197 1HB LEU 38 1HB LEU 38 10.566 -5.854 1.980
198 2HB LEU 38 2HB LEU 38 10.811 -6.502 3.591
199 HG LEU 38 HG LEU 38 10.620 -3.551 2.999
200 1HD1 LEU 38 1HD1 LEU 38 8.335 -3.879 4.133
201 2HD1 LEU 38 2HD1 LEU 38 8.513 -5.572 3.668
202 3HD1 LEU 38 3HD1 LEU 38 8.498 -4.316 2.431
203 1HD2 LEU 38 1HD2 LEU 38 9.987 -4.683 5.647
204 2HD2 LEU 38 2HD2 LEU 38 10.826 -3.192 5.217
205 3HD2 LEU 38 3HD2 LEU 38 11.684 -4.732 5.167
206 H GLY 39 H GLY 39 13.234 -6.296 0.449
207 1HA GLY 39 1HA GLY 39 14.318 -8.122 -0.427
208 2HA GLY 39 2HA GLY 39 14.831 -8.524 1.203
209 H LEU 40 H LEU 40 11.450 -8.161 0.477
210 HA LEU 40 HA LEU 40 11.134 -11.062 0.839
211 1HB LEU 40 1HB LEU 40 8.636 -10.170 1.203
212 2HB LEU 40 2HB LEU 40 9.808 -10.302 2.501
213 HG LEU 40 HG LEU 40 10.343 -7.899 2.220
214 1HD1 LEU 40 1HD1 LEU 40 7.947 -7.779 0.411
215 2HD1 LEU 40 2HD1 LEU 40 9.601 -7.853 -0.193
216 3HD1 LEU 40 3HD1 LEU 40 9.085 -6.490 0.801
217 1HD2 LEU 40 1HD2 LEU 40 7.734 -8.980 3.047
218 2HD2 LEU 40 2HD2 LEU 40 7.789 -7.234 2.799
219 3HD2 LEU 40 3HD2 LEU 40 8.894 -7.997 3.941
220 H ASN 41 H ASN 41 9.269 -12.045 -0.269
221 HA ASN 41 HA ASN 41 9.319 -11.338 -3.067
222 1HB ASN 41 1HB ASN 41 9.449 -13.683 -2.498
223 2HB ASN 41 2HB ASN 41 7.969 -13.582 -1.550
224 1HD2 ASN 41 1HD2 ASN 41 8.831 -12.427 -4.791
225 2HD2 ASN 41 2HD2 ASN 41 7.549 -13.248 -5.608
226 H GLU 42 H GLU 42 7.499 -10.821 -4.331
227 HA GLU 42 HA GLU 42 5.750 -8.926 -3.340
228 1HB GLU 42 1HB GLU 42 5.293 -10.797 -5.675
229 2HB GLU 42 2HB GLU 42 4.448 -9.278 -5.402
230 1HG GLU 42 1HG GLU 42 6.902 -8.315 -5.392
231 2HG GLU 42 2HG GLU 42 7.223 -9.768 -6.337
232 H ALA 43 H ALA 43 5.503 -12.400 -3.340
233 HA ALA 43 HA ALA 43 2.752 -12.714 -2.890
234 1HB ALA 43 1HB ALA 43 4.846 -14.455 -1.611
235 2HB ALA 43 2HB ALA 43 4.505 -14.519 -3.340
236 3HB ALA 43 3HB ALA 43 3.238 -14.907 -2.177
237 H GLN 44 H GLN 44 5.409 -11.924 -0.769
238 HA GLN 44 HA GLN 44 3.864 -11.986 1.663
239 1HB GLN 44 1HB GLN 44 6.629 -11.091 0.903
240 2HB GLN 44 2HB GLN 44 5.960 -10.657 2.469
241 1HG GLN 44 1HG GLN 44 5.684 -13.488 1.849
242 2HG GLN 44 2HG GLN 44 7.358 -12.936 1.893
243 1HE2 GLN 44 1HE2 GLN 44 4.662 -11.679 3.773
244 2HE2 GLN 44 2HE2 GLN 44 5.281 -12.144 5.316
245 H ILE 45 H ILE 45 4.756 -9.759 -0.822
246 HA ILE 45 HA ILE 45 4.198 -7.325 0.480
247 HB ILE 45 HB ILE 45 4.252 -8.101 -2.432
248 1HG1 ILE 45 1HG1 ILE 45 6.373 -8.095 -1.087
249 2HG1 ILE 45 2HG1 ILE 45 6.380 -6.998 -2.465
250 1HG2 ILE 45 1HG2 ILE 45 2.703 -6.192 -2.092
251 2HG2 ILE 45 2HG2 ILE 45 4.126 -5.791 -3.050
252 3HG2 ILE 45 3HG2 ILE 45 4.036 -5.300 -1.363
253 1HD1 ILE 45 1HD1 ILE 45 6.501 -6.426 0.413
254 2HD1 ILE 45 2HD1 ILE 45 5.517 -5.324 -0.549
255 3HD1 ILE 45 3HD1 ILE 45 7.215 -5.572 -0.952
256 H LYS 46 H LYS 46 2.196 -9.506 -1.493
257 HA LYS 46 HA LYS 46 -0.109 -7.918 -1.618
258 1HB LYS 46 1HB LYS 46 0.489 -10.265 -2.693
259 2HB LYS 46 2HB LYS 46 -0.354 -10.881 -1.279
260 1HG LYS 46 1HG LYS 46 -2.160 -10.729 -2.593
261 2HG LYS 46 2HG LYS 46 -2.119 -9.025 -2.133
262 1HD LYS 46 1HD LYS 46 -0.942 -8.450 -4.144
263 2HD LYS 46 2HD LYS 46 -0.744 -10.151 -4.570
264 1HE LYS 46 1HE LYS 46 -2.861 -10.339 -5.344
265 2HE LYS 46 2HE LYS 46 -3.516 -9.243 -4.128
266 1HZ LYS 46 1HZ LYS 46 -2.444 -7.407 -5.424
267 2HZ LYS 46 2HZ LYS 46 -3.730 -8.177 -6.207
268 3HZ LYS 46 3HZ LYS 46 -2.136 -8.529 -6.652
269 H ILE 47 H ILE 47 0.964 -10.296 0.752
270 HA ILE 47 HA ILE 47 -1.248 -10.042 2.524
271 HB ILE 47 HB ILE 47 1.504 -11.214 2.673
272 1HG1 ILE 47 1HG1 ILE 47 -0.094 -12.705 1.797
273 2HG1 ILE 47 2HG1 ILE 47 0.125 -13.211 3.468
274 1HG2 ILE 47 1HG2 ILE 47 1.043 -11.872 5.062
275 2HG2 ILE 47 2HG2 ILE 47 -0.214 -10.636 5.069
276 3HG2 ILE 47 3HG2 ILE 47 1.469 -10.179 4.791
277 1HD1 ILE 47 1HD1 ILE 47 -1.933 -11.640 3.872
278 2HD1 ILE 47 2HD1 ILE 47 -2.141 -13.292 3.287
279 3HD1 ILE 47 3HD1 ILE 47 -2.210 -11.940 2.156
280 H TRP 48 H TRP 48 1.928 -8.627 2.279
281 HA TRP 48 HA TRP 48 2.045 -7.206 4.673
282 1HB TRP 48 1HB TRP 48 3.942 -7.686 3.189
283 2HB TRP 48 2HB TRP 48 3.254 -6.641 1.960
284 HD1 TRP 48 HD1 TRP 48 5.630 -6.644 4.778
285 HE1 TRP 48 HE1 TRP 48 6.469 -4.261 5.201
286 HE3 TRP 48 HE3 TRP 48 2.236 -4.036 2.007
287 HZ2 TRP 48 HZ2 TRP 48 5.808 -1.630 4.487
288 HZ3 TRP 48 HZ3 TRP 48 2.406 -1.591 1.928
289 HH2 TRP 48 HH2 TRP 48 4.163 -0.419 3.134
290 H PHE 49 H PHE 49 1.057 -6.153 1.436
291 HA PHE 49 HA PHE 49 0.308 -3.554 2.294
292 1HB PHE 49 1HB PHE 49 0.037 -5.097 -0.239
293 2HB PHE 49 2HB PHE 49 -0.967 -3.658 -0.018
294 HD1 PHE 49 HD1 PHE 49 0.003 -1.475 0.125
295 HD2 PHE 49 HD2 PHE 49 2.439 -4.924 -0.313
296 HE1 PHE 49 HE1 PHE 49 1.955 -0.033 -0.343
297 HE2 PHE 49 HE2 PHE 49 4.392 -3.503 -0.787
298 HZ PHE 49 HZ PHE 49 4.158 -1.062 -0.778
299 H GLN 50 H GLN 50 -1.486 -6.525 1.707
300 HA GLN 50 HA GLN 50 -4.023 -5.384 2.139
301 1HB GLN 50 1HB GLN 50 -2.998 -8.215 2.288
302 2HB GLN 50 2HB GLN 50 -4.676 -7.820 2.635
303 1HG GLN 50 1HG GLN 50 -3.998 -6.585 0.182
304 2HG GLN 50 2HG GLN 50 -3.424 -8.251 0.124
305 1HE2 GLN 50 1HE2 GLN 50 -4.830 -9.620 -0.672
306 2HE2 GLN 50 2HE2 GLN 50 -6.551 -9.501 -0.570
307 H ASN 51 H ASN 51 -1.551 -6.631 4.280
308 HA ASN 51 HA ASN 51 -3.268 -6.720 6.591
309 1HB ASN 51 1HB ASN 51 -0.346 -7.129 6.089
310 2HB ASN 51 2HB ASN 51 -0.902 -6.855 7.738
311 1HD2 ASN 51 1HD2 ASN 51 -1.303 -8.621 8.833
312 2HD2 ASN 51 2HD2 ASN 51 -1.818 -10.136 8.183
313 H LYS 52 H LYS 52 -0.790 -4.529 5.331
314 HA LYS 52 HA LYS 52 -0.778 -2.752 7.521
315 1HB LYS 52 1HB LYS 52 0.594 -2.991 5.100
316 2HB LYS 52 2HB LYS 52 -0.225 -1.439 4.993
317 1HG LYS 52 1HG LYS 52 0.798 -1.317 7.503
318 2HG LYS 52 2HG LYS 52 2.024 -2.276 6.673
319 1HD LYS 52 1HD LYS 52 2.685 -0.548 5.370
320 2HD LYS 52 2HD LYS 52 1.051 0.103 5.225
321 1HE LYS 52 1HE LYS 52 2.955 0.409 7.540
322 2HE LYS 52 2HE LYS 52 2.363 1.672 6.461
323 1HZ LYS 52 1HZ LYS 52 1.015 1.955 8.268
324 2HZ LYS 52 2HZ LYS 52 0.979 0.311 8.661
325 3HZ LYS 52 3HZ LYS 52 0.064 0.889 7.362
326 H ARG 53 H ARG 53 -2.870 -3.078 4.757
327 HA ARG 53 HA ARG 53 -4.161 -0.516 5.267
328 1HB ARG 53 1HB ARG 53 -4.301 -2.568 3.103
329 2HB ARG 53 2HB ARG 53 -5.653 -1.463 3.315
330 1HG ARG 53 1HG ARG 53 -2.845 -0.451 3.060
331 2HG ARG 53 2HG ARG 53 -3.823 -0.833 1.640
332 1HD ARG 53 1HD ARG 53 -5.305 0.880 2.032
333 2HD ARG 53 2HD ARG 53 -4.982 0.906 3.764
334 HE ARG 53 HE ARG 53 -2.640 1.726 2.693
335 1HH1 ARG 53 1HH1 ARG 53 -5.946 2.761 2.264
336 2HH1 ARG 53 2HH1 ARG 53 -5.518 4.403 1.919
337 1HH2 ARG 53 1HH2 ARG 53 -2.076 3.885 2.240
338 2HH2 ARG 53 2HH2 ARG 53 -3.322 5.042 1.904
339 H ALA 54 H ALA 54 -4.304 -3.055 7.019
340 HA ALA 54 HA ALA 54 -7.180 -3.547 6.984
341 1HB ALA 54 1HB ALA 54 -4.983 -4.822 8.607
342 2HB ALA 54 2HB ALA 54 -5.750 -5.491 7.167
343 3HB ALA 54 3HB ALA 54 -6.683 -5.290 8.651
344 H LYS 55 H LYS 55 -6.000 -0.959 7.855
345 HA LYS 55 HA LYS 55 -7.683 -0.425 10.022
346 1HB LYS 55 1HB LYS 55 -5.988 -0.016 11.795
347 2HB LYS 55 2HB LYS 55 -6.169 -1.715 11.383
348 1HG LYS 55 1HG LYS 55 -4.133 -1.700 10.133
349 2HG LYS 55 2HG LYS 55 -3.994 0.052 10.290
350 1HD LYS 55 1HD LYS 55 -3.352 -0.060 12.496
351 2HD LYS 55 2HD LYS 55 -4.154 -1.611 12.759
352 1HE LYS 55 1HE LYS 55 -1.915 -2.196 12.769
353 2HE LYS 55 2HE LYS 55 -2.388 -2.527 11.103
354 1HZ LYS 55 1HZ LYS 55 -1.403 0.153 11.627
355 2HZ LYS 55 2HZ LYS 55 -1.101 -0.876 10.320
356 3HZ LYS 55 3HZ LYS 55 -0.257 -1.084 11.770
357 H ILE 56 H ILE 56 -4.637 0.435 8.448
358 HA ILE 56 HA ILE 56 -3.781 2.421 7.736
359 HB ILE 56 HB ILE 56 -6.636 3.389 7.679
360 1HG1 ILE 56 1HG1 ILE 56 -6.091 2.569 5.131
361 2HG1 ILE 56 2HG1 ILE 56 -5.253 1.339 6.073
362 1HG2 ILE 56 1HG2 ILE 56 -4.672 4.129 5.604
363 2HG2 ILE 56 2HG2 ILE 56 -4.408 4.805 7.212
364 3HG2 ILE 56 3HG2 ILE 56 -5.933 5.094 6.375
365 1HD1 ILE 56 1HD1 ILE 56 -7.218 0.303 6.133
366 2HD1 ILE 56 2HD1 ILE 56 -8.096 1.748 5.636
367 3HD1 ILE 56 3HD1 ILE 56 -7.677 1.510 7.333
368 H LYS 57 H LYS 57 -2.631 3.272 9.391
369 HA LYS 57 HA LYS 57 -4.068 4.880 11.389
370 1HB LYS 57 1HB LYS 57 -1.388 3.506 11.445
371 2HB LYS 57 2HB LYS 57 -1.826 4.735 12.623
372 1HG LYS 57 1HG LYS 57 -3.828 3.342 13.197
373 2HG LYS 57 2HG LYS 57 -3.152 2.075 12.169
374 1HD LYS 57 1HD LYS 57 -2.487 1.575 14.392
375 2HD LYS 57 2HD LYS 57 -1.062 2.212 13.571
376 1HE LYS 57 1HE LYS 57 -2.759 4.190 14.953
377 2HE LYS 57 2HE LYS 57 -1.898 3.053 15.989
378 1HZ LYS 57 1HZ LYS 57 -0.837 5.318 15.099
379 2HZ LYS 57 2HZ LYS 57 -0.333 4.274 13.868
380 3HZ LYS 57 3HZ LYS 57 0.084 3.951 15.475
381 H LYS 58 H LYS 58 -4.136 6.966 10.881
382 HA LYS 58 HA LYS 58 -1.736 8.194 9.687
383 1HB LYS 58 1HB LYS 58 -4.356 8.132 8.685
384 2HB LYS 58 2HB LYS 58 -4.138 9.762 9.310
385 1HG LYS 58 1HG LYS 58 -3.319 10.126 7.247
386 2HG LYS 58 2HG LYS 58 -1.836 9.494 7.966
387 1HD LYS 58 1HD LYS 58 -2.277 7.302 7.082
388 2HD LYS 58 2HD LYS 58 -3.867 7.809 6.507
389 1HE LYS 58 1HE LYS 58 -2.195 7.709 4.700
390 2HE LYS 58 2HE LYS 58 -2.851 9.330 4.926
391 1HZ LYS 58 1HZ LYS 58 -0.875 10.130 5.603
392 2HZ LYS 58 2HZ LYS 58 -0.254 8.814 4.740
393 3HZ LYS 58 3HZ LYS 58 -0.436 8.714 6.419
394 H SER 59 H SER 59 -4.650 9.101 11.540
395 HA SER 59 HA SER 59 -3.154 11.225 12.853
396 1HB SER 59 1HB SER 59 -5.586 11.398 11.968
397 2HB SER 59 2HB SER 59 -6.022 10.527 13.438
398 HG SER 59 HG SER 59 -5.366 13.131 13.118
Start of MODEL 21
1 1H ALA 16 1H ALA 16 -2.947 20.109 -11.023
2 2H ALA 16 2H ALA 16 -3.162 21.092 -12.413
3 3H ALA 16 3H ALA 16 -2.890 19.406 -12.585
4 HA ALA 16 HA ALA 16 -5.200 20.558 -11.186
5 1HB ALA 16 1HB ALA 16 -6.491 20.306 -13.156
6 2HB ALA 16 2HB ALA 16 -5.172 19.495 -14.001
7 3HB ALA 16 3HB ALA 16 -5.048 21.211 -13.615
8 H LYS 17 H LYS 17 -7.020 18.889 -11.350
9 HA LYS 17 HA LYS 17 -5.884 16.216 -10.849
10 1HB LYS 17 1HB LYS 17 -7.057 17.626 -8.968
11 2HB LYS 17 2HB LYS 17 -8.533 17.069 -9.744
12 1HG LYS 17 1HG LYS 17 -6.674 14.897 -9.315
13 2HG LYS 17 2HG LYS 17 -7.061 15.737 -7.812
14 1HD LYS 17 1HD LYS 17 -9.183 14.992 -7.801
15 2HD LYS 17 2HD LYS 17 -9.372 15.213 -9.541
16 1HE LYS 17 1HE LYS 17 -7.768 12.967 -8.343
17 2HE LYS 17 2HE LYS 17 -9.491 12.830 -8.690
18 1HZ LYS 17 1HZ LYS 17 -7.585 13.673 -10.779
19 2HZ LYS 17 2HZ LYS 17 -9.127 13.004 -10.961
20 3HZ LYS 17 3HZ LYS 17 -7.839 12.035 -10.447
21 H ARG 18 H ARG 18 -6.183 15.112 -12.699
22 HA ARG 18 HA ARG 18 -8.839 15.210 -13.960
23 1HB ARG 18 1HB ARG 18 -6.161 14.384 -15.089
24 2HB ARG 18 2HB ARG 18 -7.685 14.239 -15.954
25 1HG ARG 18 1HG ARG 18 -7.072 16.908 -14.868
26 2HG ARG 18 2HG ARG 18 -6.031 16.342 -16.175
27 1HD ARG 18 1HD ARG 18 -8.579 15.681 -17.024
28 2HD ARG 18 2HD ARG 18 -8.790 17.250 -16.248
29 HE ARG 18 HE ARG 18 -7.768 18.183 -18.051
30 1HH1 ARG 18 1HH1 ARG 18 -6.713 14.865 -17.816
31 2HH1 ARG 18 2HH1 ARG 18 -5.767 14.933 -19.265
32 1HH2 ARG 18 1HH2 ARG 18 -6.525 18.273 -19.957
33 2HH2 ARG 18 2HH2 ARG 18 -5.660 16.867 -20.480
34 H GLU 19 H GLU 19 -6.254 12.768 -13.951
35 HA GLU 19 HA GLU 19 -8.067 10.850 -12.699
36 1HB GLU 19 1HB GLU 19 -6.774 10.481 -15.402
37 2HB GLU 19 2HB GLU 19 -7.414 9.146 -14.453
38 1HG GLU 19 1HG GLU 19 -9.233 9.548 -15.725
39 2HG GLU 19 2HG GLU 19 -9.565 10.703 -14.435
40 H PHE 20 H PHE 20 -6.951 10.195 -10.987
41 HA PHE 20 HA PHE 20 -4.113 10.266 -10.840
42 1HB PHE 20 1HB PHE 20 -4.426 9.163 -8.643
43 2HB PHE 20 2HB PHE 20 -5.455 10.578 -8.841
44 HD1 PHE 20 HD1 PHE 20 -5.523 6.878 -9.276
45 HD2 PHE 20 HD2 PHE 20 -7.695 10.414 -8.334
46 HE1 PHE 20 HE1 PHE 20 -7.494 5.515 -8.720
47 HE2 PHE 20 HE2 PHE 20 -9.670 9.058 -7.776
48 HZ PHE 20 HZ PHE 20 -9.571 6.605 -7.970
49 H ASN 21 H ASN 21 -3.038 8.162 -9.846
50 HA ASN 21 HA ASN 21 -3.200 6.173 -11.952
51 1HB ASN 21 1HB ASN 21 -1.203 7.076 -10.043
52 2HB ASN 21 2HB ASN 21 -1.306 5.321 -10.102
53 1HD2 ASN 21 1HD2 ASN 21 0.956 6.637 -10.903
54 2HD2 ASN 21 2HD2 ASN 21 1.146 6.475 -12.613
55 H GLU 22 H GLU 22 -4.044 4.180 -11.773
56 HA GLU 22 HA GLU 22 -5.457 3.522 -9.320
57 1HB GLU 22 1HB GLU 22 -5.616 2.715 -12.153
58 2HB GLU 22 2HB GLU 22 -5.979 1.445 -10.993
59 1HG GLU 22 1HG GLU 22 -7.881 2.452 -10.267
60 2HG GLU 22 2HG GLU 22 -7.280 4.076 -10.598
61 H ASN 23 H ASN 23 -3.962 2.836 -7.847
62 HA ASN 23 HA ASN 23 -2.558 1.412 -6.768
63 1HB ASN 23 1HB ASN 23 -3.170 -0.608 -8.896
64 2HB ASN 23 2HB ASN 23 -2.704 -0.899 -7.226
65 1HD2 ASN 23 1HD2 ASN 23 -4.276 0.250 -5.634
66 2HD2 ASN 23 2HD2 ASN 23 -5.952 -0.031 -5.942
67 H ARG 24 H ARG 24 -1.496 3.124 -8.632
68 HA ARG 24 HA ARG 24 0.910 1.663 -9.481
69 1HB ARG 24 1HB ARG 24 -0.397 3.954 -10.960
70 2HB ARG 24 2HB ARG 24 1.068 3.108 -11.448
71 1HG ARG 24 1HG ARG 24 -1.493 1.613 -11.084
72 2HG ARG 24 2HG ARG 24 -1.180 2.513 -12.571
73 1HD ARG 24 1HD ARG 24 1.048 1.245 -12.638
74 2HD ARG 24 2HD ARG 24 0.326 0.177 -11.435
75 HE ARG 24 HE ARG 24 -0.998 -0.729 -13.075
76 1HH1 ARG 24 1HH1 ARG 24 0.455 2.209 -14.273
77 2HH1 ARG 24 2HH1 ARG 24 -0.068 1.951 -15.903
78 1HH2 ARG 24 1HH2 ARG 24 -1.689 -1.069 -15.217
79 2HH2 ARG 24 2HH2 ARG 24 -1.288 0.091 -16.439
80 H TYR 25 H TYR 25 -0.507 4.751 -8.603
81 HA TYR 25 HA TYR 25 1.660 6.389 -8.388
82 1HB TYR 25 1HB TYR 25 0.371 7.668 -6.754
83 2HB TYR 25 2HB TYR 25 -0.678 7.097 -8.048
84 HD1 TYR 25 HD1 TYR 25 -1.674 4.612 -7.486
85 HD2 TYR 25 HD2 TYR 25 -0.525 7.555 -4.636
86 HE1 TYR 25 HE1 TYR 25 -3.134 3.555 -5.823
87 HE2 TYR 25 HE2 TYR 25 -1.992 6.508 -2.962
88 HH TYR 25 HH TYR 25 -3.083 4.462 -2.486
89 H LEU 26 H LEU 26 0.434 4.215 -5.833
90 HA LEU 26 HA LEU 26 3.065 4.451 -4.545
91 1HB LEU 26 1HB LEU 26 2.184 4.974 -2.554
92 2HB LEU 26 2HB LEU 26 0.809 5.488 -3.501
93 HG LEU 26 HG LEU 26 -0.012 4.261 -1.640
94 1HD1 LEU 26 1HD1 LEU 26 -1.551 3.242 -2.852
95 2HD1 LEU 26 2HD1 LEU 26 -0.408 2.005 -3.374
96 3HD1 LEU 26 3HD1 LEU 26 -0.542 3.519 -4.270
97 1HD2 LEU 26 1HD2 LEU 26 1.245 1.687 -2.268
98 2HD2 LEU 26 2HD2 LEU 26 0.925 2.450 -0.710
99 3HD2 LEU 26 3HD2 LEU 26 2.343 2.920 -1.647
100 H THR 27 H THR 27 0.462 2.370 -5.516
101 HA THR 27 HA THR 27 1.138 0.095 -4.038
102 HB THR 27 HB THR 27 -0.404 0.631 -6.515
103 HG1 THR 27 HG1 THR 27 -2.034 -0.177 -5.295
104 1HG2 THR 27 1HG2 THR 27 0.387 -1.317 -7.404
105 2HG2 THR 27 2HG2 THR 27 -0.965 -1.913 -6.441
106 3HG2 THR 27 3HG2 THR 27 0.683 -2.045 -5.825
107 H GLU 28 H GLU 28 1.607 0.249 -7.547
108 HA GLU 28 HA GLU 28 3.656 -1.661 -7.594
109 1HB GLU 28 1HB GLU 28 2.997 0.479 -9.620
110 2HB GLU 28 2HB GLU 28 4.024 -0.918 -9.919
111 1HG GLU 28 1HG GLU 28 1.780 -2.119 -8.995
112 2HG GLU 28 2HG GLU 28 1.103 -0.708 -9.807
113 H ARG 29 H ARG 29 3.763 1.836 -7.310
114 HA ARG 29 HA ARG 29 6.508 2.161 -7.873
115 1HB ARG 29 1HB ARG 29 4.418 3.814 -6.526
116 2HB ARG 29 2HB ARG 29 6.104 4.294 -6.376
117 1HG ARG 29 1HG ARG 29 5.136 3.679 -9.100
118 2HG ARG 29 2HG ARG 29 4.512 5.143 -8.340
119 1HD ARG 29 1HD ARG 29 6.380 6.039 -9.249
120 2HD ARG 29 2HD ARG 29 7.106 5.435 -7.762
121 HE ARG 29 HE ARG 29 7.471 4.387 -10.443
122 1HH1 ARG 29 1HH1 ARG 29 7.926 3.883 -7.016
123 2HH1 ARG 29 2HH1 ARG 29 9.185 2.717 -7.230
124 1HH2 ARG 29 1HH2 ARG 29 9.127 2.852 -10.720
125 2HH2 ARG 29 2HH2 ARG 29 9.866 2.131 -9.331
126 H ARG 30 H ARG 30 4.777 1.873 -4.774
127 HA ARG 30 HA ARG 30 7.248 1.863 -3.288
128 1HB ARG 30 1HB ARG 30 4.431 1.265 -2.370
129 2HB ARG 30 2HB ARG 30 5.823 1.474 -1.320
130 1HG ARG 30 1HG ARG 30 6.013 3.789 -2.518
131 2HG ARG 30 2HG ARG 30 4.310 3.508 -2.883
132 1HD ARG 30 1HD ARG 30 4.346 2.879 -0.263
133 2HD ARG 30 2HD ARG 30 5.634 4.082 -0.310
134 HE ARG 30 HE ARG 30 2.825 4.550 -0.598
135 1HH1 ARG 30 1HH1 ARG 30 5.993 5.737 -1.455
136 2HH1 ARG 30 2HH1 ARG 30 5.458 7.370 -1.675
137 1HH2 ARG 30 1HH2 ARG 30 2.120 6.696 -0.887
138 2HH2 ARG 30 2HH2 ARG 30 3.260 7.915 -1.353
139 H ARG 31 H ARG 31 5.060 -0.510 -4.601
140 HA ARG 31 HA ARG 31 5.807 -2.729 -3.058
141 1HB ARG 31 1HB ARG 31 4.561 -2.336 -5.733
142 2HB ARG 31 2HB ARG 31 5.189 -3.933 -5.350
143 1HG ARG 31 1HG ARG 31 3.796 -3.920 -3.292
144 2HG ARG 31 2HG ARG 31 3.088 -2.400 -3.836
145 1HD ARG 31 1HD ARG 31 1.696 -4.361 -4.396
146 2HD ARG 31 2HD ARG 31 2.221 -3.463 -5.820
147 HE ARG 31 HE ARG 31 3.929 -5.676 -5.125
148 1HH1 ARG 31 1HH1 ARG 31 1.103 -4.675 -6.913
149 2HH1 ARG 31 2HH1 ARG 31 1.191 -5.993 -8.032
150 1HH2 ARG 31 1HH2 ARG 31 4.045 -7.410 -6.595
151 2HH2 ARG 31 2HH2 ARG 31 2.860 -7.546 -7.851
152 H GLN 32 H GLN 32 7.183 -1.392 -6.026
153 HA GLN 32 HA GLN 32 9.050 -3.452 -6.494
154 1HB GLN 32 1HB GLN 32 8.440 -0.839 -7.581
155 2HB GLN 32 2HB GLN 32 10.179 -1.083 -7.480
156 1HG GLN 32 1HG GLN 32 9.816 -1.958 -9.533
157 2HG GLN 32 2HG GLN 32 9.544 -3.409 -8.568
158 1HE2 GLN 32 1HE2 GLN 32 7.427 -4.134 -8.239
159 2HE2 GLN 32 2HE2 GLN 32 6.127 -3.635 -9.261
160 H GLN 33 H GLN 33 9.340 -0.354 -4.786
161 HA GLN 33 HA GLN 33 12.082 -0.780 -4.084
162 1HB GLN 33 1HB GLN 33 10.131 1.160 -2.839
163 2HB GLN 33 2HB GLN 33 11.886 1.250 -2.796
164 1HG GLN 33 1HG GLN 33 11.320 1.170 -5.490
165 2HG GLN 33 2HG GLN 33 10.020 2.157 -4.824
166 1HE2 GLN 33 1HE2 GLN 33 10.890 3.765 -3.103
167 2HE2 GLN 33 2HE2 GLN 33 12.272 4.677 -3.596
168 H LEU 34 H LEU 34 8.983 -1.246 -2.470
169 HA LEU 34 HA LEU 34 9.994 -1.763 0.106
170 1HB LEU 34 1HB LEU 34 7.436 -2.385 -1.304
171 2HB LEU 34 2HB LEU 34 7.756 -3.117 0.257
172 HG LEU 34 HG LEU 34 7.799 -0.140 -0.227
173 1HD1 LEU 34 1HD1 LEU 34 5.570 -1.982 0.176
174 2HD1 LEU 34 2HD1 LEU 34 5.580 -0.312 -0.393
175 3HD1 LEU 34 3HD1 LEU 34 5.616 -0.654 1.336
176 1HD2 LEU 34 1HD2 LEU 34 8.961 -1.478 1.786
177 2HD2 LEU 34 2HD2 LEU 34 7.330 -1.319 2.438
178 3HD2 LEU 34 3HD2 LEU 34 8.238 0.120 1.974
179 H SER 35 H SER 35 9.434 -3.839 -2.677
180 HA SER 35 HA SER 35 9.850 -6.304 -1.373
181 1HB SER 35 1HB SER 35 10.294 -7.186 -3.661
182 2HB SER 35 2HB SER 35 8.822 -6.219 -3.574
183 HG SER 35 HG SER 35 11.058 -5.818 -5.045
184 H SER 36 H SER 36 12.066 -4.310 -3.324
185 HA SER 36 HA SER 36 14.351 -5.907 -2.803
186 1HB SER 36 1HB SER 36 14.069 -4.318 -4.740
187 2HB SER 36 2HB SER 36 14.332 -2.992 -3.607
188 HG SER 36 HG SER 36 16.247 -3.727 -4.730
189 H GLU 37 H GLU 37 13.013 -3.022 -1.277
190 HA GLU 37 HA GLU 37 15.209 -2.452 0.396
191 1HB GLU 37 1HB GLU 37 12.286 -1.759 0.508
192 2HB GLU 37 2HB GLU 37 13.381 -1.283 1.799
193 1HG GLU 37 1HG GLU 37 14.671 0.056 0.324
194 2HG GLU 37 2HG GLU 37 13.834 -0.586 -1.089
195 H LEU 38 H LEU 38 12.213 -4.269 1.005
196 HA LEU 38 HA LEU 38 13.139 -5.051 3.635
197 1HB LEU 38 1HB LEU 38 10.641 -5.523 2.052
198 2HB LEU 38 2HB LEU 38 10.974 -6.489 3.477
199 HG LEU 38 HG LEU 38 11.362 -3.867 4.332
200 1HD1 LEU 38 1HD1 LEU 38 10.310 -2.652 2.740
201 2HD1 LEU 38 2HD1 LEU 38 8.886 -3.122 3.667
202 3HD1 LEU 38 3HD1 LEU 38 9.317 -4.006 2.202
203 1HD2 LEU 38 1HD2 LEU 38 9.849 -4.449 5.909
204 2HD2 LEU 38 2HD2 LEU 38 10.084 -6.052 5.213
205 3HD2 LEU 38 3HD2 LEU 38 8.697 -5.076 4.731
206 H GLY 39 H GLY 39 13.280 -6.285 0.433
207 1HA GLY 39 1HA GLY 39 14.419 -8.129 -0.361
208 2HA GLY 39 2HA GLY 39 14.844 -8.528 1.298
209 H LEU 40 H LEU 40 11.522 -8.045 0.385
210 HA LEU 40 HA LEU 40 11.072 -10.933 0.736
211 1HB LEU 40 1HB LEU 40 8.608 -9.918 1.070
212 2HB LEU 40 2HB LEU 40 9.744 -10.151 2.386
213 HG LEU 40 HG LEU 40 10.452 -7.731 2.014
214 1HD1 LEU 40 1HD1 LEU 40 8.998 -7.905 -0.255
215 2HD1 LEU 40 2HD1 LEU 40 9.376 -6.389 0.564
216 3HD1 LEU 40 3HD1 LEU 40 7.818 -7.173 0.832
217 1HD2 LEU 40 1HD2 LEU 40 7.971 -8.772 3.207
218 2HD2 LEU 40 2HD2 LEU 40 8.032 -7.024 2.978
219 3HD2 LEU 40 3HD2 LEU 40 9.275 -7.832 3.933
220 H ASN 41 H ASN 41 9.289 -11.872 -0.477
221 HA ASN 41 HA ASN 41 9.324 -10.932 -3.220
222 1HB ASN 41 1HB ASN 41 7.978 -13.090 -3.593
223 2HB ASN 41 2HB ASN 41 9.657 -13.256 -3.089
224 1HD2 ASN 41 1HD2 ASN 41 6.375 -13.111 -1.824
225 2HD2 ASN 41 2HD2 ASN 41 6.632 -14.212 -0.518
226 H GLU 42 H GLU 42 7.367 -10.712 -4.473
227 HA GLU 42 HA GLU 42 5.532 -8.928 -3.442
228 1HB GLU 42 1HB GLU 42 5.011 -10.893 -5.682
229 2HB GLU 42 2HB GLU 42 4.199 -9.353 -5.431
230 1HG GLU 42 1HG GLU 42 5.678 -8.511 -6.859
231 2HG GLU 42 2HG GLU 42 6.849 -8.638 -5.547
232 H ALA 43 H ALA 43 5.517 -12.408 -3.349
233 HA ALA 43 HA ALA 43 2.816 -12.882 -2.763
234 1HB ALA 43 1HB ALA 43 4.772 -14.560 -1.328
235 2HB ALA 43 2HB ALA 43 4.973 -14.477 -3.078
236 3HB ALA 43 3HB ALA 43 3.444 -15.024 -2.391
237 H GLN 44 H GLN 44 5.492 -11.830 -0.779
238 HA GLN 44 HA GLN 44 4.031 -11.957 1.712
239 1HB GLN 44 1HB GLN 44 6.721 -10.954 0.843
240 2HB GLN 44 2HB GLN 44 6.080 -10.478 2.409
241 1HG GLN 44 1HG GLN 44 5.954 -13.354 1.867
242 2HG GLN 44 2HG GLN 44 7.583 -12.686 1.951
243 1HE2 GLN 44 1HE2 GLN 44 4.737 -11.590 3.711
244 2HE2 GLN 44 2HE2 GLN 44 5.339 -11.970 5.285
245 H ILE 45 H ILE 45 4.696 -9.739 -0.836
246 HA ILE 45 HA ILE 45 4.074 -7.307 0.433
247 HB ILE 45 HB ILE 45 4.010 -8.135 -2.468
248 1HG1 ILE 45 1HG1 ILE 45 6.206 -8.095 -1.282
249 2HG1 ILE 45 2HG1 ILE 45 6.110 -6.948 -2.617
250 1HG2 ILE 45 1HG2 ILE 45 2.455 -6.217 -1.979
251 2HG2 ILE 45 2HG2 ILE 45 3.746 -5.876 -3.129
252 3HG2 ILE 45 3HG2 ILE 45 3.875 -5.307 -1.467
253 1HD1 ILE 45 1HD1 ILE 45 5.504 -5.210 -0.868
254 2HD1 ILE 45 2HD1 ILE 45 7.167 -5.800 -0.889
255 3HD1 ILE 45 3HD1 ILE 45 6.034 -6.398 0.323
256 H LYS 46 H LYS 46 2.075 -9.672 -1.302
257 HA LYS 46 HA LYS 46 -0.288 -8.178 -1.454
258 1HB LYS 46 1HB LYS 46 0.312 -10.524 -2.435
259 2HB LYS 46 2HB LYS 46 -0.325 -11.132 -0.914
260 1HG LYS 46 1HG LYS 46 -2.370 -9.601 -1.536
261 2HG LYS 46 2HG LYS 46 -1.735 -9.808 -3.170
262 1HD LYS 46 1HD LYS 46 -1.761 -12.278 -2.781
263 2HD LYS 46 2HD LYS 46 -2.587 -11.973 -1.251
264 1HE LYS 46 1HE LYS 46 -4.434 -12.251 -2.519
265 2HE LYS 46 2HE LYS 46 -4.155 -10.553 -2.907
266 1HZ LYS 46 1HZ LYS 46 -3.798 -12.920 -4.565
267 2HZ LYS 46 2HZ LYS 46 -2.648 -11.694 -4.752
268 3HZ LYS 46 3HZ LYS 46 -4.287 -11.358 -4.996
269 H ILE 47 H ILE 47 0.846 -10.433 1.026
270 HA ILE 47 HA ILE 47 -1.326 -10.018 2.823
271 HB ILE 47 HB ILE 47 1.299 -11.385 2.889
272 1HG1 ILE 47 1HG1 ILE 47 -0.435 -12.900 4.333
273 2HG1 ILE 47 2HG1 ILE 47 -1.559 -11.987 3.331
274 1HG2 ILE 47 1HG2 ILE 47 1.133 -11.726 5.376
275 2HG2 ILE 47 2HG2 ILE 47 -0.013 -10.386 5.408
276 3HG2 ILE 47 3HG2 ILE 47 1.645 -10.116 4.866
277 1HD1 ILE 47 1HD1 ILE 47 0.783 -13.384 2.110
278 2HD1 ILE 47 2HD1 ILE 47 -0.742 -12.900 1.367
279 3HD1 ILE 47 3HD1 ILE 47 -0.700 -14.258 2.493
280 H TRP 48 H TRP 48 1.906 -8.727 2.492
281 HA TRP 48 HA TRP 48 2.110 -7.194 4.799
282 1HB TRP 48 1HB TRP 48 3.968 -7.699 3.282
283 2HB TRP 48 2HB TRP 48 3.221 -6.736 2.022
284 HD1 TRP 48 HD1 TRP 48 5.729 -6.543 4.705
285 HE1 TRP 48 HE1 TRP 48 6.523 -4.119 4.993
286 HE3 TRP 48 HE3 TRP 48 2.120 -4.127 2.028
287 HZ2 TRP 48 HZ2 TRP 48 5.746 -1.541 4.228
288 HZ3 TRP 48 HZ3 TRP 48 2.215 -1.683 1.858
289 HH2 TRP 48 HH2 TRP 48 3.999 -0.421 2.925
290 H PHE 49 H PHE 49 0.982 -6.271 1.573
291 HA PHE 49 HA PHE 49 0.252 -3.639 2.363
292 1HB PHE 49 1HB PHE 49 -0.080 -5.268 -0.102
293 2HB PHE 49 2HB PHE 49 -1.129 -3.860 0.106
294 HD1 PHE 49 HD1 PHE 49 2.317 -5.005 -0.267
295 HD2 PHE 49 HD2 PHE 49 -0.240 -1.638 0.130
296 HE1 PHE 49 HE1 PHE 49 4.194 -3.529 -0.852
297 HE2 PHE 49 HE2 PHE 49 1.634 -0.143 -0.469
298 HZ PHE 49 HZ PHE 49 3.863 -1.103 -0.933
299 H GLN 50 H GLN 50 -1.548 -6.634 1.961
300 HA GLN 50 HA GLN 50 -4.074 -5.494 2.463
301 1HB GLN 50 1HB GLN 50 -3.000 -8.300 2.610
302 2HB GLN 50 2HB GLN 50 -4.646 -7.938 3.111
303 1HG GLN 50 1HG GLN 50 -4.419 -6.718 0.641
304 2HG GLN 50 2HG GLN 50 -3.532 -8.230 0.457
305 1HE2 GLN 50 1HE2 GLN 50 -4.784 -10.098 1.673
306 2HE2 GLN 50 2HE2 GLN 50 -6.443 -10.236 1.213
307 H ASN 51 H ASN 51 -1.501 -6.652 4.534
308 HA ASN 51 HA ASN 51 -3.038 -6.811 6.924
309 1HB ASN 51 1HB ASN 51 -0.177 -6.943 6.194
310 2HB ASN 51 2HB ASN 51 -0.516 -6.398 7.833
311 1HD2 ASN 51 1HD2 ASN 51 0.841 -8.676 7.555
312 2HD2 ASN 51 2HD2 ASN 51 -0.145 -10.040 7.945
313 H LYS 52 H LYS 52 -1.013 -4.295 5.478
314 HA LYS 52 HA LYS 52 -1.278 -2.465 7.640
315 1HB LYS 52 1HB LYS 52 0.237 -2.604 5.313
316 2HB LYS 52 2HB LYS 52 -0.812 -1.218 5.049
317 1HG LYS 52 1HG LYS 52 0.449 0.033 6.365
318 2HG LYS 52 2HG LYS 52 0.236 -1.100 7.701
319 1HD LYS 52 1HD LYS 52 2.090 -2.455 6.828
320 2HD LYS 52 2HD LYS 52 2.307 -1.298 5.514
321 1HE LYS 52 1HE LYS 52 2.753 0.463 7.191
322 2HE LYS 52 2HE LYS 52 2.628 -0.752 8.463
323 1HZ LYS 52 1HZ LYS 52 4.641 -1.598 7.972
324 2HZ LYS 52 2HZ LYS 52 4.922 -0.063 7.323
325 3HZ LYS 52 3HZ LYS 52 4.485 -1.343 6.307
326 H ARG 53 H ARG 53 -2.956 -2.867 4.550
327 HA ARG 53 HA ARG 53 -5.106 -1.151 5.591
328 1HB ARG 53 1HB ARG 53 -5.464 -0.466 3.150
329 2HB ARG 53 2HB ARG 53 -4.103 0.252 3.999
330 1HG ARG 53 1HG ARG 53 -2.546 -1.103 2.868
331 2HG ARG 53 2HG ARG 53 -3.808 -2.181 2.267
332 1HD ARG 53 1HD ARG 53 -2.990 -0.691 0.510
333 2HD ARG 53 2HD ARG 53 -4.691 -0.396 0.869
334 HE ARG 53 HE ARG 53 -4.144 1.707 1.593
335 1HH1 ARG 53 1HH1 ARG 53 -1.230 -0.193 1.322
336 2HH1 ARG 53 2HH1 ARG 53 -0.176 1.156 1.581
337 1HH2 ARG 53 1HH2 ARG 53 -2.759 3.483 1.935
338 2HH2 ARG 53 2HH2 ARG 53 -1.044 3.243 1.930
339 H ALA 54 H ALA 54 -6.558 -2.700 6.090
340 HA ALA 54 HA ALA 54 -7.096 -4.858 4.209
341 1HB ALA 54 1HB ALA 54 -6.948 -5.527 6.490
342 2HB ALA 54 2HB ALA 54 -8.634 -5.668 5.995
343 3HB ALA 54 3HB ALA 54 -8.116 -4.301 6.982
344 H LYS 55 H LYS 55 -7.830 -3.034 2.727
345 HA LYS 55 HA LYS 55 -9.499 -2.019 1.561
346 1HB LYS 55 1HB LYS 55 -10.463 -4.479 2.316
347 2HB LYS 55 2HB LYS 55 -11.717 -3.396 2.903
348 1HG LYS 55 1HG LYS 55 -10.676 -3.434 0.080
349 2HG LYS 55 2HG LYS 55 -12.140 -4.253 0.629
350 1HD LYS 55 1HD LYS 55 -13.243 -2.237 1.063
351 2HD LYS 55 2HD LYS 55 -11.740 -1.312 1.069
352 1HE LYS 55 1HE LYS 55 -11.724 -2.343 -1.445
353 2HE LYS 55 2HE LYS 55 -13.453 -2.129 -1.174
354 1HZ LYS 55 1HZ LYS 55 -12.576 -0.148 -2.140
355 2HZ LYS 55 2HZ LYS 55 -11.349 -0.045 -0.980
356 3HZ LYS 55 3HZ LYS 55 -12.961 0.193 -0.528
357 H ILE 56 H ILE 56 -8.626 -0.662 3.825
358 HA ILE 56 HA ILE 56 -9.160 1.146 5.102
359 HB ILE 56 HB ILE 56 -11.876 1.051 3.787
360 1HG1 ILE 56 1HG1 ILE 56 -9.868 2.956 2.781
361 2HG1 ILE 56 2HG1 ILE 56 -9.503 1.267 2.442
362 1HG2 ILE 56 1HG2 ILE 56 -11.644 3.574 4.198
363 2HG2 ILE 56 2HG2 ILE 56 -10.369 3.130 5.331
364 3HG2 ILE 56 3HG2 ILE 56 -12.011 2.537 5.577
365 1HD1 ILE 56 1HD1 ILE 56 -10.811 2.552 0.693
366 2HD1 ILE 56 2HD1 ILE 56 -12.173 2.471 1.811
367 3HD1 ILE 56 3HD1 ILE 56 -11.457 0.987 1.185
368 H LYS 57 H LYS 57 -9.143 0.314 7.132
369 HA LYS 57 HA LYS 57 -9.922 -0.388 9.151
370 1HB LYS 57 1HB LYS 57 -12.290 0.884 7.891
371 2HB LYS 57 2HB LYS 57 -12.588 -0.125 9.299
372 1HG LYS 57 1HG LYS 57 -11.160 1.221 10.657
373 2HG LYS 57 2HG LYS 57 -10.601 2.134 9.253
374 1HD LYS 57 1HD LYS 57 -13.514 2.119 9.639
375 2HD LYS 57 2HD LYS 57 -12.601 2.924 10.916
376 1HE LYS 57 1HE LYS 57 -11.906 3.531 8.090
377 2HE LYS 57 2HE LYS 57 -13.395 4.212 8.745
378 1HZ LYS 57 1HZ LYS 57 -11.695 5.784 9.121
379 2HZ LYS 57 2HZ LYS 57 -10.631 4.621 9.732
380 3HZ LYS 57 3HZ LYS 57 -11.998 5.067 10.623
381 H LYS 58 H LYS 58 -11.791 -1.872 10.145
382 HA LYS 58 HA LYS 58 -11.926 -4.242 8.400
383 1HB LYS 58 1HB LYS 58 -10.523 -4.433 10.469
384 2HB LYS 58 2HB LYS 58 -11.981 -4.187 11.421
385 1HG LYS 58 1HG LYS 58 -12.894 -6.235 10.766
386 2HG LYS 58 2HG LYS 58 -11.777 -6.400 9.410
387 1HD LYS 58 1HD LYS 58 -10.758 -7.817 10.869
388 2HD LYS 58 2HD LYS 58 -9.994 -6.313 11.386
389 1HE LYS 58 1HE LYS 58 -10.858 -7.721 13.255
390 2HE LYS 58 2HE LYS 58 -11.516 -6.086 13.214
391 1HZ LYS 58 1HZ LYS 58 -13.575 -6.833 12.749
392 2HZ LYS 58 2HZ LYS 58 -13.017 -8.256 13.472
393 3HZ LYS 58 3HZ LYS 58 -13.033 -8.115 11.787
394 H SER 59 H SER 59 -13.652 -2.807 11.177
395 HA SER 59 HA SER 59 -16.073 -4.179 10.667
396 1HB SER 59 1HB SER 59 -15.207 -1.960 12.448
397 2HB SER 59 2HB SER 59 -16.935 -2.111 12.135
398 HG SER 59 HG SER 59 -16.982 -3.982 13.172
Start of MODEL 22
1 1H ALA 16 1H ALA 16 -7.407 19.574 -2.014
2 2H ALA 16 2H ALA 16 -8.121 20.884 -1.166
3 3H ALA 16 3H ALA 16 -8.135 20.859 -2.883
4 HA ALA 16 HA ALA 16 -9.649 19.229 -0.984
5 1HB ALA 16 1HB ALA 16 -10.206 21.275 -3.042
6 2HB ALA 16 2HB ALA 16 -11.021 20.949 -1.511
7 3HB ALA 16 3HB ALA 16 -11.356 19.942 -2.919
8 H LYS 17 H LYS 17 -9.580 17.118 -1.348
9 HA LYS 17 HA LYS 17 -9.258 16.171 -4.117
10 1HB LYS 17 1HB LYS 17 -8.575 14.828 -1.498
11 2HB LYS 17 2HB LYS 17 -8.487 14.033 -3.064
12 1HG LYS 17 1HG LYS 17 -6.565 15.051 -3.621
13 2HG LYS 17 2HG LYS 17 -7.034 16.579 -2.874
14 1HD LYS 17 1HD LYS 17 -6.185 15.999 -0.833
15 2HD LYS 17 2HD LYS 17 -6.466 14.276 -1.085
16 1HE LYS 17 1HE LYS 17 -4.616 14.338 -2.790
17 2HE LYS 17 2HE LYS 17 -4.263 15.974 -2.237
18 1HZ LYS 17 1HZ LYS 17 -4.443 13.938 -0.171
19 2HZ LYS 17 2HZ LYS 17 -3.361 15.228 -0.328
20 3HZ LYS 17 3HZ LYS 17 -3.119 13.810 -1.217
21 H ARG 18 H ARG 18 -10.250 13.896 -4.407
22 HA ARG 18 HA ARG 18 -12.726 13.521 -2.925
23 1HB ARG 18 1HB ARG 18 -13.136 15.098 -4.897
24 2HB ARG 18 2HB ARG 18 -12.829 13.708 -5.930
25 1HG ARG 18 1HG ARG 18 -14.672 12.511 -4.789
26 2HG ARG 18 2HG ARG 18 -15.015 13.983 -3.878
27 1HD ARG 18 1HD ARG 18 -14.845 14.586 -6.677
28 2HD ARG 18 2HD ARG 18 -15.976 13.257 -6.421
29 HE ARG 18 HE ARG 18 -16.320 16.002 -5.647
30 1HH1 ARG 18 1HH1 ARG 18 -17.261 12.707 -4.987
31 2HH1 ARG 18 2HH1 ARG 18 -18.767 13.152 -4.256
32 1HH2 ARG 18 1HH2 ARG 18 -18.300 16.589 -4.687
33 2HH2 ARG 18 2HH2 ARG 18 -19.357 15.356 -4.086
34 H GLU 19 H GLU 19 -11.195 12.413 -5.954
35 HA GLU 19 HA GLU 19 -11.315 9.669 -4.892
36 1HB GLU 19 1HB GLU 19 -13.005 10.330 -6.762
37 2HB GLU 19 2HB GLU 19 -11.607 10.236 -7.824
38 1HG GLU 19 1HG GLU 19 -11.256 7.898 -6.859
39 2HG GLU 19 2HG GLU 19 -12.896 8.054 -6.229
40 H PHE 20 H PHE 20 -9.623 8.297 -5.428
41 HA PHE 20 HA PHE 20 -7.411 9.390 -6.999
42 1HB PHE 20 1HB PHE 20 -5.789 8.689 -5.241
43 2HB PHE 20 2HB PHE 20 -6.837 10.010 -4.732
44 HD1 PHE 20 HD1 PHE 20 -6.646 6.289 -4.613
45 HD2 PHE 20 HD2 PHE 20 -7.858 9.879 -2.677
46 HE1 PHE 20 HE1 PHE 20 -7.309 4.991 -2.630
47 HE2 PHE 20 HE2 PHE 20 -8.523 8.588 -0.690
48 HZ PHE 20 HZ PHE 20 -8.247 6.141 -0.665
49 H ASN 21 H ASN 21 -5.556 7.524 -6.836
50 HA ASN 21 HA ASN 21 -6.810 5.228 -8.068
51 1HB ASN 21 1HB ASN 21 -3.871 5.520 -7.529
52 2HB ASN 21 2HB ASN 21 -4.671 4.600 -8.798
53 1HD2 ASN 21 1HD2 ASN 21 -3.443 7.653 -7.831
54 2HD2 ASN 21 2HD2 ASN 21 -3.734 8.490 -9.314
55 H GLU 22 H GLU 22 -7.849 4.136 -6.440
56 HA GLU 22 HA GLU 22 -6.810 3.517 -3.923
57 1HB GLU 22 1HB GLU 22 -9.178 3.012 -5.268
58 2HB GLU 22 2HB GLU 22 -8.505 1.406 -5.028
59 1HG GLU 22 1HG GLU 22 -8.297 2.988 -2.628
60 2HG GLU 22 2HG GLU 22 -9.961 2.911 -3.205
61 H ASN 23 H ASN 23 -4.888 2.600 -3.643
62 HA ASN 23 HA ASN 23 -3.126 1.177 -3.819
63 1HB ASN 23 1HB ASN 23 -4.995 -0.917 -4.880
64 2HB ASN 23 2HB ASN 23 -3.573 -1.114 -3.863
65 1HD2 ASN 23 1HD2 ASN 23 -3.715 -0.283 -1.660
66 2HD2 ASN 23 2HD2 ASN 23 -5.238 -0.339 -0.845
67 H ARG 24 H ARG 24 -2.226 2.358 -5.472
68 HA ARG 24 HA ARG 24 -1.696 0.933 -7.884
69 1HB ARG 24 1HB ARG 24 -3.645 3.191 -7.867
70 2HB ARG 24 2HB ARG 24 -2.495 3.122 -9.197
71 1HG ARG 24 1HG ARG 24 -3.560 0.525 -8.891
72 2HG ARG 24 2HG ARG 24 -4.912 1.657 -8.839
73 1HD ARG 24 1HD ARG 24 -3.612 2.704 -10.905
74 2HD ARG 24 2HD ARG 24 -3.015 1.050 -11.043
75 HE ARG 24 HE ARG 24 -5.865 1.206 -10.760
76 1HH1 ARG 24 1HH1 ARG 24 -3.221 1.358 -13.032
77 2HH1 ARG 24 2HH1 ARG 24 -4.195 0.894 -14.387
78 1HH2 ARG 24 1HH2 ARG 24 -7.147 0.595 -12.541
79 2HH2 ARG 24 2HH2 ARG 24 -6.423 0.460 -14.108
80 H TYR 25 H TYR 25 -1.919 4.376 -7.160
81 HA TYR 25 HA TYR 25 0.450 5.279 -8.131
82 1HB TYR 25 1HB TYR 25 0.285 6.920 -6.053
83 2HB TYR 25 2HB TYR 25 -0.888 6.989 -7.360
84 HD1 TYR 25 HD1 TYR 25 -1.028 4.219 -4.943
85 HD2 TYR 25 HD2 TYR 25 -2.512 8.092 -5.909
86 HE1 TYR 25 HE1 TYR 25 -2.840 3.917 -3.324
87 HE2 TYR 25 HE2 TYR 25 -4.332 7.798 -4.283
88 HH TYR 25 HH TYR 25 -4.468 6.073 -1.958
89 H LEU 26 H LEU 26 0.385 5.350 -4.640
90 HA LEU 26 HA LEU 26 3.068 4.873 -4.227
91 1HB LEU 26 1HB LEU 26 1.971 5.799 -2.427
92 2HB LEU 26 2HB LEU 26 0.577 4.747 -2.610
93 HG LEU 26 HG LEU 26 3.179 3.593 -1.669
94 1HD1 LEU 26 1HD1 LEU 26 3.021 4.383 0.448
95 2HD1 LEU 26 2HD1 LEU 26 1.265 4.542 0.377
96 3HD1 LEU 26 3HD1 LEU 26 2.293 5.756 -0.384
97 1HD2 LEU 26 1HD2 LEU 26 0.414 2.766 -1.912
98 2HD2 LEU 26 2HD2 LEU 26 1.020 2.540 -0.270
99 3HD2 LEU 26 3HD2 LEU 26 1.861 1.796 -1.631
100 H THR 27 H THR 27 0.400 2.649 -4.617
101 HA THR 27 HA THR 27 1.429 0.333 -3.546
102 HB THR 27 HB THR 27 -0.349 0.728 -5.951
103 HG1 THR 27 HG1 THR 27 -1.048 1.353 -3.783
104 1HG2 THR 27 1HG2 THR 27 0.322 -1.449 -6.330
105 2HG2 THR 27 2HG2 THR 27 -1.108 -1.651 -5.319
106 3HG2 THR 27 3HG2 THR 27 0.500 -1.803 -4.611
107 H GLU 28 H GLU 28 1.227 0.388 -7.064
108 HA GLU 28 HA GLU 28 3.268 -1.374 -7.543
109 1HB GLU 28 1HB GLU 28 2.508 0.920 -9.351
110 2HB GLU 28 2HB GLU 28 3.271 -0.588 -9.833
111 1HG GLU 28 1HG GLU 28 0.789 -1.028 -8.403
112 2HG GLU 28 2HG GLU 28 0.569 -0.028 -9.839
113 H ARG 29 H ARG 29 3.531 2.111 -7.086
114 HA ARG 29 HA ARG 29 6.217 2.328 -7.966
115 1HB ARG 29 1HB ARG 29 4.283 4.120 -7.341
116 2HB ARG 29 2HB ARG 29 5.292 4.232 -5.907
117 1HG ARG 29 1HG ARG 29 7.237 4.476 -7.604
118 2HG ARG 29 2HG ARG 29 5.954 4.894 -8.741
119 1HD ARG 29 1HD ARG 29 6.701 6.940 -7.844
120 2HD ARG 29 2HD ARG 29 5.179 6.591 -7.027
121 HE ARG 29 HE ARG 29 7.015 5.548 -5.348
122 1HH1 ARG 29 1HH1 ARG 29 6.696 8.676 -6.864
123 2HH1 ARG 29 2HH1 ARG 29 7.480 9.521 -5.572
124 1HH2 ARG 29 1HH2 ARG 29 8.046 6.659 -3.648
125 2HH2 ARG 29 2HH2 ARG 29 8.247 8.377 -3.747
126 H ARG 30 H ARG 30 4.806 2.079 -4.706
127 HA ARG 30 HA ARG 30 7.402 1.950 -3.469
128 1HB ARG 30 1HB ARG 30 5.107 2.839 -2.526
129 2HB ARG 30 2HB ARG 30 4.912 1.166 -2.024
130 1HG ARG 30 1HG ARG 30 6.820 1.257 -0.638
131 2HG ARG 30 2HG ARG 30 7.346 2.787 -1.343
132 1HD ARG 30 1HD ARG 30 4.753 2.478 0.152
133 2HD ARG 30 2HD ARG 30 6.267 2.916 0.943
134 HE ARG 30 HE ARG 30 4.623 4.595 -0.718
135 1HH1 ARG 30 1HH1 ARG 30 7.834 4.077 0.550
136 2HH1 ARG 30 2HH1 ARG 30 8.304 5.735 0.377
137 1HH2 ARG 30 1HH2 ARG 30 5.241 6.775 -0.946
138 2HH2 ARG 30 2HH2 ARG 30 6.832 7.267 -0.471
139 H ARG 31 H ARG 31 5.129 -0.336 -4.722
140 HA ARG 31 HA ARG 31 5.762 -2.593 -3.200
141 1HB ARG 31 1HB ARG 31 3.994 -2.138 -5.152
142 2HB ARG 31 2HB ARG 31 5.225 -2.956 -6.101
143 1HG ARG 31 1HG ARG 31 4.976 -4.563 -3.883
144 2HG ARG 31 2HG ARG 31 3.323 -4.025 -4.183
145 1HD ARG 31 1HD ARG 31 4.064 -4.626 -6.691
146 2HD ARG 31 2HD ARG 31 5.087 -5.755 -5.806
147 HE ARG 31 HE ARG 31 3.216 -6.946 -5.201
148 1HH1 ARG 31 1HH1 ARG 31 2.245 -3.903 -6.609
149 2HH1 ARG 31 2HH1 ARG 31 0.574 -4.345 -6.715
150 1HH2 ARG 31 1HH2 ARG 31 1.020 -7.526 -5.340
151 2HH2 ARG 31 2HH2 ARG 31 -0.122 -6.400 -5.993
152 H GLN 32 H GLN 32 7.269 -1.286 -6.114
153 HA GLN 32 HA GLN 32 9.091 -3.420 -6.495
154 1HB GLN 32 1HB GLN 32 8.357 -1.239 -7.956
155 2HB GLN 32 2HB GLN 32 9.953 -0.753 -7.402
156 1HG GLN 32 1HG GLN 32 10.698 -1.851 -9.190
157 2HG GLN 32 2HG GLN 32 10.408 -3.305 -8.237
158 1HE2 GLN 32 1HE2 GLN 32 10.015 -4.550 -10.058
159 2HE2 GLN 32 2HE2 GLN 32 8.564 -4.401 -10.986
160 H GLN 33 H GLN 33 9.337 -0.323 -4.803
161 HA GLN 33 HA GLN 33 12.091 -0.683 -4.113
162 1HB GLN 33 1HB GLN 33 10.131 1.186 -2.786
163 2HB GLN 33 2HB GLN 33 11.880 1.342 -2.863
164 1HG GLN 33 1HG GLN 33 11.269 1.298 -5.493
165 2HG GLN 33 2HG GLN 33 9.826 2.065 -4.830
166 1HE2 GLN 33 1HE2 GLN 33 10.373 4.009 -5.863
167 2HE2 GLN 33 2HE2 GLN 33 11.623 5.035 -5.255
168 H LEU 34 H LEU 34 9.012 -1.225 -2.464
169 HA LEU 34 HA LEU 34 10.081 -1.750 0.087
170 1HB LEU 34 1HB LEU 34 7.501 -2.179 -1.272
171 2HB LEU 34 2HB LEU 34 7.827 -3.243 0.083
172 HG LEU 34 HG LEU 34 8.042 -0.248 0.306
173 1HD1 LEU 34 1HD1 LEU 34 5.775 -0.623 1.541
174 2HD1 LEU 34 2HD1 LEU 34 5.650 -2.018 0.469
175 3HD1 LEU 34 3HD1 LEU 34 5.811 -0.397 -0.207
176 1HD2 LEU 34 1HD2 LEU 34 7.804 -0.703 2.691
177 2HD2 LEU 34 2HD2 LEU 34 9.190 -1.560 2.016
178 3HD2 LEU 34 3HD2 LEU 34 7.695 -2.431 2.357
179 H SER 35 H SER 35 9.434 -3.844 -2.673
180 HA SER 35 HA SER 35 9.934 -6.296 -1.403
181 1HB SER 35 1HB SER 35 10.272 -7.196 -3.661
182 2HB SER 35 2HB SER 35 8.878 -6.117 -3.625
183 HG SER 35 HG SER 35 10.299 -4.468 -4.443
184 H SER 36 H SER 36 12.098 -4.212 -3.313
185 HA SER 36 HA SER 36 14.410 -5.798 -2.894
186 1HB SER 36 1HB SER 36 14.717 -2.888 -3.422
187 2HB SER 36 2HB SER 36 15.499 -4.265 -4.198
188 HG SER 36 HG SER 36 14.043 -4.147 -5.692
189 H GLU 37 H GLU 37 13.072 -2.998 -1.206
190 HA GLU 37 HA GLU 37 15.307 -2.493 0.439
191 1HB GLU 37 1HB GLU 37 12.454 -1.691 0.408
192 2HB GLU 37 2HB GLU 37 13.289 -1.551 1.948
193 1HG GLU 37 1HG GLU 37 13.353 0.534 0.694
194 2HG GLU 37 2HG GLU 37 14.969 -0.126 0.938
195 H LEU 38 H LEU 38 12.321 -4.323 1.053
196 HA LEU 38 HA LEU 38 13.325 -5.225 3.616
197 1HB LEU 38 1HB LEU 38 10.767 -5.532 2.109
198 2HB LEU 38 2HB LEU 38 11.132 -6.665 3.396
199 HG LEU 38 HG LEU 38 11.605 -4.293 4.648
200 1HD1 LEU 38 1HD1 LEU 38 9.450 -2.998 4.063
201 2HD1 LEU 38 2HD1 LEU 38 9.554 -3.844 2.519
202 3HD1 LEU 38 3HD1 LEU 38 10.872 -2.795 3.041
203 1HD2 LEU 38 1HD2 LEU 38 9.679 -4.754 5.894
204 2HD2 LEU 38 2HD2 LEU 38 10.191 -6.327 5.283
205 3HD2 LEU 38 3HD2 LEU 38 8.850 -5.476 4.515
206 H GLY 39 H GLY 39 13.352 -6.327 0.361
207 1HA GLY 39 1HA GLY 39 14.369 -8.172 -0.569
208 2HA GLY 39 2HA GLY 39 14.969 -8.576 1.033
209 H LEU 40 H LEU 40 11.574 -8.138 0.365
210 HA LEU 40 HA LEU 40 11.164 -11.004 0.886
211 1HB LEU 40 1HB LEU 40 8.709 -10.049 1.235
212 2HB LEU 40 2HB LEU 40 9.902 -10.056 2.521
213 HG LEU 40 HG LEU 40 10.455 -7.671 1.843
214 1HD1 LEU 40 1HD1 LEU 40 8.897 -6.452 0.529
215 2HD1 LEU 40 2HD1 LEU 40 7.800 -7.831 0.443
216 3HD1 LEU 40 3HD1 LEU 40 9.349 -7.884 -0.397
217 1HD2 LEU 40 1HD2 LEU 40 9.301 -7.811 3.830
218 2HD2 LEU 40 2HD2 LEU 40 7.896 -8.574 3.083
219 3HD2 LEU 40 3HD2 LEU 40 8.191 -6.850 2.852
220 H ASN 41 H ASN 41 9.299 -12.010 -0.201
221 HA ASN 41 HA ASN 41 9.336 -11.338 -3.019
222 1HB ASN 41 1HB ASN 41 9.265 -13.721 -1.702
223 2HB ASN 41 2HB ASN 41 7.562 -13.512 -2.097
224 1HD2 ASN 41 1HD2 ASN 41 7.117 -12.925 -4.395
225 2HD2 ASN 41 2HD2 ASN 41 8.064 -13.707 -5.610
226 H GLU 42 H GLU 42 7.455 -10.970 -4.275
227 HA GLU 42 HA GLU 42 5.663 -9.099 -3.304
228 1HB GLU 42 1HB GLU 42 6.107 -9.584 -5.710
229 2HB GLU 42 2HB GLU 42 5.171 -11.066 -5.551
230 1HG GLU 42 1HG GLU 42 3.558 -8.965 -4.585
231 2HG GLU 42 2HG GLU 42 4.271 -8.417 -6.101
232 H ALA 43 H ALA 43 5.544 -12.579 -3.185
233 HA ALA 43 HA ALA 43 2.817 -12.975 -2.666
234 1HB ALA 43 1HB ALA 43 3.395 -15.121 -1.874
235 2HB ALA 43 2HB ALA 43 5.007 -14.595 -1.387
236 3HB ALA 43 3HB ALA 43 4.605 -14.739 -3.099
237 H GLN 44 H GLN 44 5.478 -11.990 -0.631
238 HA GLN 44 HA GLN 44 3.957 -12.054 1.825
239 1HB GLN 44 1HB GLN 44 6.674 -11.005 1.054
240 2HB GLN 44 2HB GLN 44 5.998 -10.735 2.654
241 1HG GLN 44 1HG GLN 44 6.414 -13.453 1.434
242 2HG GLN 44 2HG GLN 44 7.563 -12.657 2.511
243 1HE2 GLN 44 1HE2 GLN 44 6.053 -11.589 4.432
244 2HE2 GLN 44 2HE2 GLN 44 5.171 -12.806 5.284
245 H ILE 45 H ILE 45 4.735 -9.869 -0.723
246 HA ILE 45 HA ILE 45 4.145 -7.414 0.523
247 HB ILE 45 HB ILE 45 4.144 -8.260 -2.373
248 1HG1 ILE 45 1HG1 ILE 45 6.309 -8.229 -1.134
249 2HG1 ILE 45 2HG1 ILE 45 6.257 -7.086 -2.475
250 1HG2 ILE 45 1HG2 ILE 45 2.597 -6.307 -1.906
251 2HG2 ILE 45 2HG2 ILE 45 3.883 -6.030 -3.077
252 3HG2 ILE 45 3HG2 ILE 45 4.040 -5.413 -1.435
253 1HD1 ILE 45 1HD1 ILE 45 6.144 -6.535 0.456
254 2HD1 ILE 45 2HD1 ILE 45 5.595 -5.350 -0.727
255 3HD1 ILE 45 3HD1 ILE 45 7.265 -5.916 -0.753
256 H LYS 46 H LYS 46 2.132 -9.738 -1.253
257 HA LYS 46 HA LYS 46 -0.189 -8.191 -1.472
258 1HB LYS 46 1HB LYS 46 0.092 -10.334 -2.631
259 2HB LYS 46 2HB LYS 46 0.064 -11.183 -1.092
260 1HG LYS 46 1HG LYS 46 -2.073 -11.449 -2.051
261 2HG LYS 46 2HG LYS 46 -2.251 -10.271 -0.748
262 1HD LYS 46 1HD LYS 46 -3.145 -8.846 -2.202
263 2HD LYS 46 2HD LYS 46 -1.613 -8.813 -3.077
264 1HE LYS 46 1HE LYS 46 -3.307 -11.157 -3.606
265 2HE LYS 46 2HE LYS 46 -3.978 -9.615 -4.138
266 1HZ LYS 46 1HZ LYS 46 -2.752 -10.277 -5.950
267 2HZ LYS 46 2HZ LYS 46 -1.519 -10.968 -5.022
268 3HZ LYS 46 3HZ LYS 46 -1.639 -9.286 -5.148
269 H ILE 47 H ILE 47 0.827 -10.455 1.046
270 HA ILE 47 HA ILE 47 -1.383 -9.992 2.785
271 HB ILE 47 HB ILE 47 1.223 -11.396 2.929
272 1HG1 ILE 47 1HG1 ILE 47 -1.399 -12.224 4.151
273 2HG1 ILE 47 2HG1 ILE 47 -1.124 -12.347 2.416
274 1HG2 ILE 47 1HG2 ILE 47 0.979 -11.742 5.401
275 2HG2 ILE 47 2HG2 ILE 47 -0.170 -10.404 5.407
276 3HG2 ILE 47 3HG2 ILE 47 1.504 -10.128 4.920
277 1HD1 ILE 47 1HD1 ILE 47 -0.221 -14.057 4.566
278 2HD1 ILE 47 2HD1 ILE 47 1.103 -13.546 3.518
279 3HD1 ILE 47 3HD1 ILE 47 -0.301 -14.363 2.832
280 H TRP 48 H TRP 48 1.875 -8.749 2.516
281 HA TRP 48 HA TRP 48 2.028 -7.210 4.833
282 1HB TRP 48 1HB TRP 48 3.933 -7.772 3.392
283 2HB TRP 48 2HB TRP 48 3.260 -6.799 2.099
284 HD1 TRP 48 HD1 TRP 48 5.668 -6.648 4.873
285 HE1 TRP 48 HE1 TRP 48 6.503 -4.241 5.182
286 HE3 TRP 48 HE3 TRP 48 2.216 -4.166 2.054
287 HZ2 TRP 48 HZ2 TRP 48 5.813 -1.649 4.378
288 HZ3 TRP 48 HZ3 TRP 48 2.369 -1.726 1.878
289 HH2 TRP 48 HH2 TRP 48 4.139 -0.498 3.006
290 H PHE 49 H PHE 49 1.066 -6.279 1.554
291 HA PHE 49 HA PHE 49 0.339 -3.631 2.301
292 1HB PHE 49 1HB PHE 49 0.093 -5.273 -0.168
293 2HB PHE 49 2HB PHE 49 -0.933 -3.841 -0.016
294 HD1 PHE 49 HD1 PHE 49 -0.001 -1.644 0.040
295 HD2 PHE 49 HD2 PHE 49 2.489 -5.070 -0.226
296 HE1 PHE 49 HE1 PHE 49 1.933 -0.194 -0.484
297 HE2 PHE 49 HE2 PHE 49 4.425 -3.644 -0.756
298 HZ PHE 49 HZ PHE 49 4.153 -1.208 -0.862
299 H GLN 50 H GLN 50 -1.449 -6.598 1.778
300 HA GLN 50 HA GLN 50 -3.998 -5.470 2.136
301 1HB GLN 50 1HB GLN 50 -3.829 -7.590 1.053
302 2HB GLN 50 2HB GLN 50 -2.956 -8.288 2.408
303 1HG GLN 50 1HG GLN 50 -4.822 -8.794 3.505
304 2HG GLN 50 2HG GLN 50 -5.581 -7.250 3.120
305 1HE2 GLN 50 1HE2 GLN 50 -4.502 -10.129 1.341
306 2HE2 GLN 50 2HE2 GLN 50 -5.953 -10.315 0.421
307 H ASN 51 H ASN 51 -1.559 -6.638 4.360
308 HA ASN 51 HA ASN 51 -3.300 -6.733 6.637
309 1HB ASN 51 1HB ASN 51 -1.204 -8.077 6.440
310 2HB ASN 51 2HB ASN 51 -0.278 -6.586 6.581
311 1HD2 ASN 51 1HD2 ASN 51 -0.691 -9.093 8.275
312 2HD2 ASN 51 2HD2 ASN 51 -0.967 -8.468 9.860
313 H LYS 52 H LYS 52 -1.250 -4.338 5.135
314 HA LYS 52 HA LYS 52 -1.189 -2.521 7.318
315 1HB LYS 52 1HB LYS 52 0.032 -2.697 4.825
316 2HB LYS 52 2HB LYS 52 -0.980 -1.265 4.700
317 1HG LYS 52 1HG LYS 52 0.092 -0.255 6.580
318 2HG LYS 52 2HG LYS 52 0.976 -1.741 6.934
319 1HD LYS 52 1HD LYS 52 2.626 -0.736 5.771
320 2HD LYS 52 2HD LYS 52 1.724 -1.316 4.370
321 1HE LYS 52 1HE LYS 52 1.790 0.842 3.739
322 2HE LYS 52 2HE LYS 52 0.443 1.014 4.863
323 1HZ LYS 52 1HZ LYS 52 2.126 1.562 6.596
324 2HZ LYS 52 2HZ LYS 52 2.016 2.701 5.351
325 3HZ LYS 52 3HZ LYS 52 3.303 1.605 5.381
326 H ARG 53 H ARG 53 -3.245 -2.837 4.455
327 HA ARG 53 HA ARG 53 -4.908 -0.617 5.373
328 1HB ARG 53 1HB ARG 53 -4.110 -1.118 2.909
329 2HB ARG 53 2HB ARG 53 -5.509 -2.183 2.904
330 1HG ARG 53 1HG ARG 53 -6.644 -0.383 2.243
331 2HG ARG 53 2HG ARG 53 -6.556 0.118 3.933
332 1HD ARG 53 1HD ARG 53 -4.622 0.876 1.746
333 2HD ARG 53 2HD ARG 53 -5.857 1.920 2.447
334 HE ARG 53 HE ARG 53 -4.006 0.856 4.373
335 1HH1 ARG 53 1HH1 ARG 53 -4.605 3.433 2.097
336 2HH1 ARG 53 2HH1 ARG 53 -3.551 4.551 2.894
337 1HH2 ARG 53 1HH2 ARG 53 -2.619 2.326 5.423
338 2HH2 ARG 53 2HH2 ARG 53 -2.422 3.923 4.783
339 H ALA 54 H ALA 54 -4.749 -3.534 6.451
340 HA ALA 54 HA ALA 54 -7.435 -4.498 6.009
341 1HB ALA 54 1HB ALA 54 -5.043 -5.478 7.486
342 2HB ALA 54 2HB ALA 54 -6.028 -6.287 6.267
343 3HB ALA 54 3HB ALA 54 -6.628 -6.119 7.917
344 H LYS 55 H LYS 55 -5.692 -2.699 8.445
345 HA LYS 55 HA LYS 55 -8.101 -2.658 10.134
346 1HB LYS 55 1HB LYS 55 -5.235 -2.001 10.840
347 2HB LYS 55 2HB LYS 55 -6.598 -1.892 11.945
348 1HG LYS 55 1HG LYS 55 -6.915 -4.418 11.243
349 2HG LYS 55 2HG LYS 55 -5.191 -4.282 10.890
350 1HD LYS 55 1HD LYS 55 -5.300 -5.019 13.120
351 2HD LYS 55 2HD LYS 55 -4.959 -3.291 13.228
352 1HE LYS 55 1HE LYS 55 -6.683 -3.220 14.651
353 2HE LYS 55 2HE LYS 55 -7.695 -3.345 13.213
354 1HZ LYS 55 1HZ LYS 55 -7.238 -5.899 13.630
355 2HZ LYS 55 2HZ LYS 55 -8.512 -5.083 14.384
356 3HZ LYS 55 3HZ LYS 55 -7.072 -5.362 15.226
357 H ILE 56 H ILE 56 -5.792 -0.685 8.401
358 HA ILE 56 HA ILE 56 -5.830 1.496 7.747
359 HB ILE 56 HB ILE 56 -8.692 1.571 8.697
360 1HG1 ILE 56 1HG1 ILE 56 -7.612 0.723 5.999
361 2HG1 ILE 56 2HG1 ILE 56 -8.339 -0.349 7.192
362 1HG2 ILE 56 1HG2 ILE 56 -7.165 3.620 7.855
363 2HG2 ILE 56 2HG2 ILE 56 -8.908 3.530 7.604
364 3HG2 ILE 56 3HG2 ILE 56 -7.805 3.056 6.312
365 1HD1 ILE 56 1HD1 ILE 56 -10.235 1.631 6.808
366 2HD1 ILE 56 2HD1 ILE 56 -10.263 -0.005 6.152
367 3HD1 ILE 56 3HD1 ILE 56 -9.590 1.315 5.197
368 H LYS 57 H LYS 57 -4.418 2.391 9.188
369 HA LYS 57 HA LYS 57 -5.625 3.714 11.522
370 1HB LYS 57 1HB LYS 57 -3.473 1.771 11.454
371 2HB LYS 57 2HB LYS 57 -2.943 3.282 12.180
372 1HG LYS 57 1HG LYS 57 -5.459 2.727 13.291
373 2HG LYS 57 2HG LYS 57 -4.567 1.204 13.292
374 1HD LYS 57 1HD LYS 57 -3.030 3.559 14.157
375 2HD LYS 57 2HD LYS 57 -4.363 3.101 15.219
376 1HE LYS 57 1HE LYS 57 -2.155 1.275 14.274
377 2HE LYS 57 2HE LYS 57 -2.260 2.019 15.869
378 1HZ LYS 57 1HZ LYS 57 -4.581 0.839 15.857
379 2HZ LYS 57 2HZ LYS 57 -3.181 -0.006 16.289
380 3HZ LYS 57 3HZ LYS 57 -3.827 -0.181 14.736
381 H LYS 58 H LYS 58 -5.581 5.824 11.140
382 HA LYS 58 HA LYS 58 -3.075 7.095 10.419
383 1HB LYS 58 1HB LYS 58 -4.914 6.538 8.410
384 2HB LYS 58 2HB LYS 58 -5.221 8.223 8.806
385 1HG LYS 58 1HG LYS 58 -3.609 8.559 7.269
386 2HG LYS 58 2HG LYS 58 -2.553 8.298 8.659
387 1HD LYS 58 1HD LYS 58 -2.607 5.824 8.004
388 2HD LYS 58 2HD LYS 58 -3.278 6.375 6.468
389 1HE LYS 58 1HE LYS 58 -0.955 6.203 6.118
390 2HE LYS 58 2HE LYS 58 -1.279 7.925 6.311
391 1HZ LYS 58 1HZ LYS 58 -0.238 6.112 8.422
392 2HZ LYS 58 2HZ LYS 58 -0.551 7.763 8.613
393 3HZ LYS 58 3HZ LYS 58 0.670 7.251 7.561
394 H SER 59 H SER 59 -2.848 9.060 11.340
395 HA SER 59 HA SER 59 -5.238 10.349 12.465
396 1HB SER 59 1HB SER 59 -3.530 8.986 14.058
397 2HB SER 59 2HB SER 59 -2.746 10.566 14.053
398 HG SER 59 HG SER 59 -4.943 11.382 14.571
Start of MODEL 23
1 1H ALA 16 1H ALA 16 -20.202 5.883 -7.754
2 2H ALA 16 2H ALA 16 -19.968 7.067 -6.534
3 3H ALA 16 3H ALA 16 -18.948 5.688 -6.603
4 HA ALA 16 HA ALA 16 -17.876 6.397 -8.467
5 1HB ALA 16 1HB ALA 16 -20.351 7.960 -8.873
6 2HB ALA 16 2HB ALA 16 -19.361 7.076 -10.034
7 3HB ALA 16 3HB ALA 16 -18.854 8.670 -9.476
8 H LYS 17 H LYS 17 -17.963 7.102 -5.586
9 HA LYS 17 HA LYS 17 -17.082 9.859 -5.481
10 1HB LYS 17 1HB LYS 17 -17.206 7.717 -3.351
11 2HB LYS 17 2HB LYS 17 -16.745 9.389 -3.060
12 1HG LYS 17 1HG LYS 17 -18.962 10.119 -3.815
13 2HG LYS 17 2HG LYS 17 -19.420 8.432 -4.060
14 1HD LYS 17 1HD LYS 17 -19.689 8.050 -1.850
15 2HD LYS 17 2HD LYS 17 -18.327 9.079 -1.402
16 1HE LYS 17 1HE LYS 17 -21.012 10.102 -2.315
17 2HE LYS 17 2HE LYS 17 -20.535 9.927 -0.627
18 1HZ LYS 17 1HZ LYS 17 -19.203 11.723 -0.726
19 2HZ LYS 17 2HZ LYS 17 -20.210 12.166 -2.011
20 3HZ LYS 17 3HZ LYS 17 -18.716 11.435 -2.320
21 H ARG 18 H ARG 18 -15.163 10.115 -6.509
22 HA ARG 18 HA ARG 18 -13.044 8.286 -6.552
23 1HB ARG 18 1HB ARG 18 -11.655 10.336 -7.149
24 2HB ARG 18 2HB ARG 18 -13.025 9.981 -8.192
25 1HG ARG 18 1HG ARG 18 -13.767 12.038 -7.877
26 2HG ARG 18 2HG ARG 18 -13.976 11.685 -6.161
27 1HD ARG 18 1HD ARG 18 -11.574 12.284 -5.826
28 2HD ARG 18 2HD ARG 18 -11.522 12.801 -7.510
29 HE ARG 18 HE ARG 18 -12.682 14.214 -5.301
30 1HH1 ARG 18 1HH1 ARG 18 -12.794 13.758 -8.759
31 2HH1 ARG 18 2HH1 ARG 18 -13.479 15.317 -9.068
32 1HH2 ARG 18 1HH2 ARG 18 -13.583 16.266 -5.705
33 2HH2 ARG 18 2HH2 ARG 18 -13.927 16.741 -7.335
34 H GLU 19 H GLU 19 -10.973 8.384 -5.504
35 HA GLU 19 HA GLU 19 -10.734 9.963 -3.086
36 1HB GLU 19 1HB GLU 19 -12.021 7.761 -2.599
37 2HB GLU 19 2HB GLU 19 -10.453 6.988 -2.791
38 1HG GLU 19 1HG GLU 19 -9.631 7.849 -0.861
39 2HG GLU 19 2HG GLU 19 -10.602 9.317 -0.971
40 H PHE 20 H PHE 20 -9.059 10.706 -4.654
41 HA PHE 20 HA PHE 20 -6.936 10.780 -5.490
42 1HB PHE 20 1HB PHE 20 -5.192 10.347 -3.834
43 2HB PHE 20 2HB PHE 20 -6.553 11.185 -3.098
44 HD1 PHE 20 HD1 PHE 20 -5.214 7.742 -3.617
45 HD2 PHE 20 HD2 PHE 20 -7.433 10.388 -1.127
46 HE1 PHE 20 HE1 PHE 20 -5.359 5.994 -1.893
47 HE2 PHE 20 HE2 PHE 20 -7.580 8.643 0.601
48 HZ PHE 20 HZ PHE 20 -6.543 6.443 0.219
49 H ASN 21 H ASN 21 -4.718 9.273 -5.381
50 HA ASN 21 HA ASN 21 -5.188 7.244 -7.245
51 1HB ASN 21 1HB ASN 21 -2.791 7.637 -5.450
52 2HB ASN 21 2HB ASN 21 -2.839 6.615 -6.882
53 1HD2 ASN 21 1HD2 ASN 21 -2.767 7.535 -8.897
54 2HD2 ASN 21 2HD2 ASN 21 -2.417 9.207 -9.157
55 H GLU 22 H GLU 22 -6.550 5.631 -6.692
56 HA GLU 22 HA GLU 22 -6.438 4.325 -4.136
57 1HB GLU 22 1HB GLU 22 -8.076 4.100 -6.599
58 2HB GLU 22 2HB GLU 22 -7.942 2.649 -5.618
59 1HG GLU 22 1HG GLU 22 -9.554 3.427 -4.328
60 2HG GLU 22 2HG GLU 22 -8.478 4.730 -3.826
61 H ASN 23 H ASN 23 -4.345 3.515 -3.954
62 HA ASN 23 HA ASN 23 -2.693 1.961 -4.121
63 1HB ASN 23 1HB ASN 23 -4.657 0.350 -5.735
64 2HB ASN 23 2HB ASN 23 -3.240 -0.245 -4.885
65 1HD2 ASN 23 1HD2 ASN 23 -3.294 0.569 -2.465
66 2HD2 ASN 23 2HD2 ASN 23 -4.770 0.211 -1.642
67 H ARG 24 H ARG 24 -1.781 3.631 -5.492
68 HA ARG 24 HA ARG 24 -0.831 2.538 -7.984
69 1HB ARG 24 1HB ARG 24 -2.166 5.240 -8.097
70 2HB ARG 24 2HB ARG 24 -1.604 4.252 -9.440
71 1HG ARG 24 1HG ARG 24 -3.376 2.614 -8.928
72 2HG ARG 24 2HG ARG 24 -3.958 3.684 -7.650
73 1HD ARG 24 1HD ARG 24 -4.848 5.173 -9.116
74 2HD ARG 24 2HD ARG 24 -3.617 4.868 -10.341
75 HE ARG 24 HE ARG 24 -5.259 2.597 -10.067
76 1HH1 ARG 24 1HH1 ARG 24 -5.352 5.861 -11.299
77 2HH1 ARG 24 2HH1 ARG 24 -6.552 5.508 -12.496
78 1HH2 ARG 24 1HH2 ARG 24 -6.836 2.130 -11.639
79 2HH2 ARG 24 2HH2 ARG 24 -7.396 3.389 -12.689
80 H TYR 25 H TYR 25 -1.158 5.717 -6.469
81 HA TYR 25 HA TYR 25 1.328 6.757 -7.107
82 1HB TYR 25 1HB TYR 25 0.867 8.438 -5.471
83 2HB TYR 25 2HB TYR 25 -0.675 7.974 -6.179
84 HD1 TYR 25 HD1 TYR 25 -0.871 5.317 -4.567
85 HD2 TYR 25 HD2 TYR 25 -0.074 9.335 -3.437
86 HE1 TYR 25 HE1 TYR 25 -1.739 4.832 -2.338
87 HE2 TYR 25 HE2 TYR 25 -0.953 8.871 -1.186
88 HH TYR 25 HH TYR 25 -2.781 6.205 -0.435
89 H LEU 26 H LEU 26 0.566 4.343 -4.816
90 HA LEU 26 HA LEU 26 3.295 4.456 -3.764
91 1HB LEU 26 1HB LEU 26 2.587 4.930 -1.708
92 2HB LEU 26 2HB LEU 26 0.976 5.153 -2.366
93 HG LEU 26 HG LEU 26 0.728 2.588 -1.997
94 1HD1 LEU 26 1HD1 LEU 26 3.108 2.204 -1.488
95 2HD1 LEU 26 2HD1 LEU 26 2.042 1.689 -0.181
96 3HD1 LEU 26 3HD1 LEU 26 2.939 3.201 -0.044
97 1HD2 LEU 26 1HD2 LEU 26 -0.454 3.064 -0.123
98 2HD2 LEU 26 2HD2 LEU 26 -0.156 4.716 -0.663
99 3HD2 LEU 26 3HD2 LEU 26 0.852 4.005 0.598
100 H THR 27 H THR 27 0.372 2.565 -4.293
101 HA THR 27 HA THR 27 1.117 0.103 -3.412
102 HB THR 27 HB THR 27 -0.576 0.989 -5.715
103 HG1 THR 27 HG1 THR 27 -1.155 0.973 -3.366
104 1HG2 THR 27 1HG2 THR 27 0.249 -1.811 -5.149
105 2HG2 THR 27 2HG2 THR 27 -0.066 -1.016 -6.691
106 3HG2 THR 27 3HG2 THR 27 -1.409 -1.479 -5.647
107 H GLU 28 H GLU 28 1.157 0.522 -6.920
108 HA GLU 28 HA GLU 28 3.136 -1.413 -7.346
109 1HB GLU 28 1HB GLU 28 2.288 0.831 -9.181
110 2HB GLU 28 2HB GLU 28 3.162 -0.617 -9.662
111 1HG GLU 28 1HG GLU 28 1.067 -1.793 -8.542
112 2HG GLU 28 2HG GLU 28 0.306 -0.261 -8.969
113 H ARG 29 H ARG 29 3.387 2.083 -6.973
114 HA ARG 29 HA ARG 29 6.047 2.319 -7.901
115 1HB ARG 29 1HB ARG 29 4.504 4.227 -7.717
116 2HB ARG 29 2HB ARG 29 4.547 4.089 -5.965
117 1HG ARG 29 1HG ARG 29 5.991 5.875 -6.671
118 2HG ARG 29 2HG ARG 29 6.966 4.558 -6.015
119 1HD ARG 29 1HD ARG 29 8.026 5.369 -8.007
120 2HD ARG 29 2HD ARG 29 7.360 3.770 -8.338
121 HE ARG 29 HE ARG 29 5.411 5.538 -9.113
122 1HH1 ARG 29 1HH1 ARG 29 8.754 4.986 -9.949
123 2HH1 ARG 29 2HH1 ARG 29 8.571 5.553 -11.575
124 1HH2 ARG 29 1HH2 ARG 29 5.168 6.284 -11.252
125 2HH2 ARG 29 2HH2 ARG 29 6.536 6.290 -12.315
126 H ARG 30 H ARG 30 4.729 2.081 -4.604
127 HA ARG 30 HA ARG 30 7.364 1.989 -3.444
128 1HB ARG 30 1HB ARG 30 4.995 2.786 -2.460
129 2HB ARG 30 2HB ARG 30 5.019 1.140 -1.842
130 1HG ARG 30 1HG ARG 30 7.319 1.668 -0.921
131 2HG ARG 30 2HG ARG 30 6.969 3.356 -1.298
132 1HD ARG 30 1HD ARG 30 4.748 2.200 0.095
133 2HD ARG 30 2HD ARG 30 6.232 1.898 0.998
134 HE ARG 30 HE ARG 30 6.169 4.589 0.186
135 1HH1 ARG 30 1HH1 ARG 30 4.580 2.413 2.404
136 2HH1 ARG 30 2HH1 ARG 30 4.189 3.659 3.542
137 1HH2 ARG 30 1HH2 ARG 30 5.657 6.228 1.682
138 2HH2 ARG 30 2HH2 ARG 30 4.799 5.825 3.132
139 H ARG 31 H ARG 31 5.073 -0.312 -4.619
140 HA ARG 31 HA ARG 31 5.760 -2.569 -3.126
141 1HB ARG 31 1HB ARG 31 4.492 -2.058 -5.751
142 2HB ARG 31 2HB ARG 31 5.168 -3.665 -5.525
143 1HG ARG 31 1HG ARG 31 3.775 -4.068 -3.635
144 2HG ARG 31 2HG ARG 31 3.230 -2.389 -3.610
145 1HD ARG 31 1HD ARG 31 1.629 -4.075 -4.615
146 2HD ARG 31 2HD ARG 31 1.990 -2.657 -5.597
147 HE ARG 31 HE ARG 31 3.675 -4.922 -6.152
148 1HH1 ARG 31 1HH1 ARG 31 0.653 -3.343 -6.902
149 2HH1 ARG 31 2HH1 ARG 31 0.514 -4.078 -8.464
150 1HH2 ARG 31 1HH2 ARG 31 3.493 -5.888 -8.206
151 2HH2 ARG 31 2HH2 ARG 31 2.125 -5.523 -9.204
152 H GLN 32 H GLN 32 7.232 -1.189 -6.016
153 HA GLN 32 HA GLN 32 9.028 -3.308 -6.525
154 1HB GLN 32 1HB GLN 32 8.387 -0.833 -7.700
155 2HB GLN 32 2HB GLN 32 10.107 -0.762 -7.345
156 1HG GLN 32 1HG GLN 32 9.165 -3.250 -8.603
157 2HG GLN 32 2HG GLN 32 9.070 -1.798 -9.598
158 1HE2 GLN 32 1HE2 GLN 32 11.001 -0.628 -10.015
159 2HE2 GLN 32 2HE2 GLN 32 12.539 -1.411 -9.945
160 H GLN 33 H GLN 33 9.429 -0.248 -4.761
161 HA GLN 33 HA GLN 33 12.143 -0.808 -4.049
162 1HB GLN 33 1HB GLN 33 10.188 1.242 -2.998
163 2HB GLN 33 2HB GLN 33 11.889 1.175 -2.556
164 1HG GLN 33 1HG GLN 33 12.582 1.728 -4.738
165 2HG GLN 33 2HG GLN 33 10.972 1.444 -5.402
166 1HE2 GLN 33 1HE2 GLN 33 12.836 3.819 -5.307
167 2HE2 GLN 33 2HE2 GLN 33 11.846 5.111 -4.727
168 H LEU 34 H LEU 34 9.018 -1.176 -2.460
169 HA LEU 34 HA LEU 34 9.994 -1.757 0.117
170 1HB LEU 34 1HB LEU 34 7.429 -2.211 -1.323
171 2HB LEU 34 2HB LEU 34 7.702 -3.078 0.177
172 HG LEU 34 HG LEU 34 7.823 -0.076 -0.107
173 1HD1 LEU 34 1HD1 LEU 34 5.595 -0.232 -0.190
174 2HD1 LEU 34 2HD1 LEU 34 5.712 -0.636 1.523
175 3HD1 LEU 34 3HD1 LEU 34 5.595 -1.920 0.320
176 1HD2 LEU 34 1HD2 LEU 34 7.980 -1.917 2.271
177 2HD2 LEU 34 2HD2 LEU 34 7.711 -0.178 2.388
178 3HD2 LEU 34 3HD2 LEU 34 9.211 -0.793 1.695
179 H SER 35 H SER 35 9.380 -3.784 -2.692
180 HA SER 35 HA SER 35 9.716 -6.270 -1.400
181 1HB SER 35 1HB SER 35 9.645 -5.304 -4.197
182 2HB SER 35 2HB SER 35 10.482 -6.832 -3.931
183 HG SER 35 HG SER 35 7.787 -6.191 -3.610
184 H SER 36 H SER 36 11.983 -4.356 -3.372
185 HA SER 36 HA SER 36 14.211 -6.036 -2.863
186 1HB SER 36 1HB SER 36 15.538 -4.126 -3.798
187 2HB SER 36 2HB SER 36 14.208 -4.649 -4.832
188 HG SER 36 HG SER 36 14.512 -2.285 -4.390
189 H GLU 37 H GLU 37 13.004 -3.093 -1.341
190 HA GLU 37 HA GLU 37 15.247 -2.589 0.288
191 1HB GLU 37 1HB GLU 37 13.467 -0.936 -0.205
192 2HB GLU 37 2HB GLU 37 12.364 -1.852 0.812
193 1HG GLU 37 1HG GLU 37 14.099 -1.504 2.665
194 2HG GLU 37 2HG GLU 37 14.771 -0.262 1.609
195 H LEU 38 H LEU 38 12.233 -4.359 0.939
196 HA LEU 38 HA LEU 38 13.136 -5.058 3.601
197 1HB LEU 38 1HB LEU 38 10.660 -5.681 2.016
198 2HB LEU 38 2HB LEU 38 10.987 -6.456 3.555
199 HG LEU 38 HG LEU 38 11.224 -4.020 4.448
200 1HD1 LEU 38 1HD1 LEU 38 10.001 -2.352 3.292
201 2HD1 LEU 38 2HD1 LEU 38 9.411 -3.512 2.102
202 3HD1 LEU 38 3HD1 LEU 38 11.116 -3.063 2.126
203 1HD2 LEU 38 1HD2 LEU 38 8.949 -4.040 5.103
204 2HD2 LEU 38 2HD2 LEU 38 9.441 -5.728 4.960
205 3HD2 LEU 38 3HD2 LEU 38 8.476 -4.981 3.687
206 H GLY 39 H GLY 39 13.308 -6.409 0.444
207 1HA GLY 39 1HA GLY 39 14.491 -8.268 -0.255
208 2HA GLY 39 2HA GLY 39 14.861 -8.618 1.426
209 H LEU 40 H LEU 40 11.539 -8.168 0.706
210 HA LEU 40 HA LEU 40 11.118 -11.059 0.997
211 1HB LEU 40 1HB LEU 40 8.640 -10.091 1.271
212 2HB LEU 40 2HB LEU 40 9.761 -10.237 2.612
213 HG LEU 40 HG LEU 40 10.352 -7.864 2.373
214 1HD1 LEU 40 1HD1 LEU 40 8.892 -8.175 -0.114
215 2HD1 LEU 40 2HD1 LEU 40 10.032 -6.924 0.383
216 3HD1 LEU 40 3HD1 LEU 40 8.331 -6.791 0.825
217 1HD2 LEU 40 1HD2 LEU 40 8.738 -8.004 3.970
218 2HD2 LEU 40 2HD2 LEU 40 7.580 -8.778 2.889
219 3HD2 LEU 40 3HD2 LEU 40 7.859 -7.040 2.783
220 H ASN 41 H ASN 41 9.318 -12.020 -0.220
221 HA ASN 41 HA ASN 41 9.452 -11.175 -2.991
222 1HB ASN 41 1HB ASN 41 9.263 -13.649 -1.710
223 2HB ASN 41 2HB ASN 41 7.690 -13.426 -2.469
224 1HD2 ASN 41 1HD2 ASN 41 7.796 -12.669 -4.776
225 2HD2 ASN 41 2HD2 ASN 41 8.990 -13.406 -5.782
226 H GLU 42 H GLU 42 7.590 -10.834 -4.302
227 HA GLU 42 HA GLU 42 5.725 -9.045 -3.353
228 1HB GLU 42 1HB GLU 42 5.356 -11.008 -5.626
229 2HB GLU 42 2HB GLU 42 4.443 -9.522 -5.395
230 1HG GLU 42 1HG GLU 42 5.937 -8.521 -6.690
231 2HG GLU 42 2HG GLU 42 7.089 -8.701 -5.368
232 H ALA 43 H ALA 43 5.698 -12.522 -3.252
233 HA ALA 43 HA ALA 43 2.976 -12.998 -2.772
234 1HB ALA 43 1HB ALA 43 4.890 -14.669 -1.267
235 2HB ALA 43 2HB ALA 43 5.138 -14.594 -3.012
236 3HB ALA 43 3HB ALA 43 3.591 -15.140 -2.363
237 H GLN 44 H GLN 44 5.587 -11.971 -0.690
238 HA GLN 44 HA GLN 44 4.025 -12.081 1.738
239 1HB GLN 44 1HB GLN 44 6.720 -10.899 1.058
240 2HB GLN 44 2HB GLN 44 6.011 -10.813 2.665
241 1HG GLN 44 1HG GLN 44 6.427 -13.432 1.268
242 2HG GLN 44 2HG GLN 44 7.709 -12.660 2.201
243 1HE2 GLN 44 1HE2 GLN 44 6.496 -11.676 4.351
244 2HE2 GLN 44 2HE2 GLN 44 5.737 -12.922 5.274
245 H ILE 45 H ILE 45 4.804 -9.863 -0.782
246 HA ILE 45 HA ILE 45 4.156 -7.427 0.472
247 HB ILE 45 HB ILE 45 4.176 -8.243 -2.433
248 1HG1 ILE 45 1HG1 ILE 45 6.335 -8.230 -1.155
249 2HG1 ILE 45 2HG1 ILE 45 6.300 -7.122 -2.524
250 1HG2 ILE 45 1HG2 ILE 45 4.034 -5.423 -1.410
251 2HG2 ILE 45 2HG2 ILE 45 2.632 -6.316 -1.994
252 3HG2 ILE 45 3HG2 ILE 45 3.973 -5.968 -3.083
253 1HD1 ILE 45 1HD1 ILE 45 6.404 -6.555 0.375
254 2HD1 ILE 45 2HD1 ILE 45 5.531 -5.419 -0.651
255 3HD1 ILE 45 3HD1 ILE 45 7.229 -5.771 -0.970
256 H LYS 46 H LYS 46 2.215 -9.779 -1.339
257 HA LYS 46 HA LYS 46 -0.136 -8.293 -1.600
258 1HB LYS 46 1HB LYS 46 0.527 -10.675 -2.489
259 2HB LYS 46 2HB LYS 46 -0.234 -11.229 -1.004
260 1HG LYS 46 1HG LYS 46 -1.913 -9.322 -2.359
261 2HG LYS 46 2HG LYS 46 -1.473 -10.652 -3.432
262 1HD LYS 46 1HD LYS 46 -2.089 -12.121 -1.344
263 2HD LYS 46 2HD LYS 46 -3.022 -10.697 -0.882
264 1HE LYS 46 1HE LYS 46 -4.646 -11.352 -2.246
265 2HE LYS 46 2HE LYS 46 -3.548 -11.166 -3.612
266 1HZ LYS 46 1HZ LYS 46 -4.096 -13.350 -3.820
267 2HZ LYS 46 2HZ LYS 46 -4.315 -13.589 -2.160
268 3HZ LYS 46 3HZ LYS 46 -2.753 -13.515 -2.803
269 H ILE 47 H ILE 47 0.871 -10.532 0.943
270 HA ILE 47 HA ILE 47 -1.365 -10.070 2.650
271 HB ILE 47 HB ILE 47 1.223 -11.492 2.818
272 1HG1 ILE 47 1HG1 ILE 47 -0.601 -12.947 4.221
273 2HG1 ILE 47 2HG1 ILE 47 -1.659 -12.023 3.158
274 1HG2 ILE 47 1HG2 ILE 47 1.534 -10.211 4.795
275 2HG2 ILE 47 2HG2 ILE 47 0.980 -11.810 5.297
276 3HG2 ILE 47 3HG2 ILE 47 -0.143 -10.451 5.290
277 1HD1 ILE 47 1HD1 ILE 47 0.449 -14.016 2.445
278 2HD1 ILE 47 2HD1 ILE 47 -0.108 -12.820 1.274
279 3HD1 ILE 47 3HD1 ILE 47 -1.250 -13.968 1.973
280 H TRP 48 H TRP 48 1.912 -8.852 2.467
281 HA TRP 48 HA TRP 48 2.063 -7.322 4.772
282 1HB TRP 48 1HB TRP 48 3.958 -7.841 3.308
283 2HB TRP 48 2HB TRP 48 3.258 -6.868 2.029
284 HD1 TRP 48 HD1 TRP 48 5.697 -6.712 4.771
285 HE1 TRP 48 HE1 TRP 48 6.510 -4.298 5.091
286 HE3 TRP 48 HE3 TRP 48 2.180 -4.241 2.021
287 HZ2 TRP 48 HZ2 TRP 48 5.781 -1.708 4.322
288 HZ3 TRP 48 HZ3 TRP 48 2.306 -1.797 1.867
289 HH2 TRP 48 HH2 TRP 48 4.077 -0.560 2.984
290 H PHE 49 H PHE 49 1.038 -6.374 1.525
291 HA PHE 49 HA PHE 49 0.315 -3.736 2.308
292 1HB PHE 49 1HB PHE 49 0.030 -5.355 -0.170
293 2HB PHE 49 2HB PHE 49 -1.012 -3.938 0.017
294 HD1 PHE 49 HD1 PHE 49 2.432 -5.112 -0.274
295 HD2 PHE 49 HD2 PHE 49 -0.107 -1.726 0.073
296 HE1 PHE 49 HE1 PHE 49 4.336 -3.648 -0.805
297 HE2 PHE 49 HE2 PHE 49 1.793 -0.244 -0.472
298 HZ PHE 49 HZ PHE 49 4.025 -1.220 -0.883
299 H GLN 50 H GLN 50 -1.484 -6.717 1.848
300 HA GLN 50 HA GLN 50 -4.030 -5.630 2.233
301 1HB GLN 50 1HB GLN 50 -2.838 -8.354 2.405
302 2HB GLN 50 2HB GLN 50 -4.416 -8.115 3.141
303 1HG GLN 50 1HG GLN 50 -4.350 -8.948 0.746
304 2HG GLN 50 2HG GLN 50 -5.421 -7.595 1.103
305 1HE2 GLN 50 1HE2 GLN 50 -3.296 -8.740 -1.077
306 2HE2 GLN 50 2HE2 GLN 50 -2.760 -7.262 -1.791
307 H ASN 51 H ASN 51 -1.518 -6.589 4.477
308 HA ASN 51 HA ASN 51 -3.215 -6.530 6.795
309 1HB ASN 51 1HB ASN 51 -0.533 -7.312 6.199
310 2HB ASN 51 2HB ASN 51 -0.487 -6.162 7.531
311 1HD2 ASN 51 1HD2 ASN 51 -1.735 -9.237 6.442
312 2HD2 ASN 51 2HD2 ASN 51 -2.096 -9.865 8.011
313 H LYS 52 H LYS 52 -1.047 -4.285 5.177
314 HA LYS 52 HA LYS 52 -1.126 -2.297 7.220
315 1HB LYS 52 1HB LYS 52 0.422 -2.713 5.006
316 2HB LYS 52 2HB LYS 52 -0.598 -1.383 4.473
317 1HG LYS 52 1HG LYS 52 0.065 -0.222 6.639
318 2HG LYS 52 2HG LYS 52 1.312 -1.462 6.784
319 1HD LYS 52 1HD LYS 52 2.240 -0.807 4.632
320 2HD LYS 52 2HD LYS 52 0.962 0.393 4.429
321 1HE LYS 52 1HE LYS 52 2.865 1.577 5.182
322 2HE LYS 52 2HE LYS 52 1.785 1.449 6.570
323 1HZ LYS 52 1HZ LYS 52 3.210 0.118 7.669
324 2HZ LYS 52 2HZ LYS 52 4.365 0.845 6.670
325 3HZ LYS 52 3HZ LYS 52 3.744 -0.678 6.274
326 H ARG 53 H ARG 53 -3.034 -2.990 4.363
327 HA ARG 53 HA ARG 53 -4.429 -0.516 4.291
328 1HB ARG 53 1HB ARG 53 -5.020 -3.235 3.127
329 2HB ARG 53 2HB ARG 53 -6.080 -1.853 2.886
330 1HG ARG 53 1HG ARG 53 -3.206 -2.085 2.023
331 2HG ARG 53 2HG ARG 53 -4.631 -2.113 0.983
332 1HD ARG 53 1HD ARG 53 -4.446 0.092 0.782
333 2HD ARG 53 2HD ARG 53 -4.853 0.232 2.492
334 HE ARG 53 HE ARG 53 -2.177 -0.275 2.480
335 1HH1 ARG 53 1HH1 ARG 53 -4.212 2.126 0.975
336 2HH1 ARG 53 2HH1 ARG 53 -2.985 3.348 0.975
337 1HH2 ARG 53 1HH2 ARG 53 -0.561 1.329 2.481
338 2HH2 ARG 53 2HH2 ARG 53 -0.911 2.895 1.828
339 H ALA 54 H ALA 54 -4.854 -3.482 6.062
340 HA ALA 54 HA ALA 54 -7.565 -3.085 6.808
341 1HB ALA 54 1HB ALA 54 -7.371 -5.037 7.928
342 2HB ALA 54 2HB ALA 54 -5.819 -4.600 8.643
343 3HB ALA 54 3HB ALA 54 -5.892 -5.177 6.978
344 H LYS 55 H LYS 55 -4.623 -1.671 7.871
345 HA LYS 55 HA LYS 55 -5.629 -0.927 10.480
346 1HB LYS 55 1HB LYS 55 -3.228 -1.440 10.103
347 2HB LYS 55 2HB LYS 55 -3.116 -0.027 9.062
348 1HG LYS 55 1HG LYS 55 -2.277 0.705 11.100
349 2HG LYS 55 2HG LYS 55 -3.938 1.300 11.091
350 1HD LYS 55 1HD LYS 55 -3.454 -1.383 12.260
351 2HD LYS 55 2HD LYS 55 -2.889 0.015 13.176
352 1HE LYS 55 1HE LYS 55 -5.612 0.247 12.093
353 2HE LYS 55 2HE LYS 55 -5.400 -1.006 13.315
354 1HZ LYS 55 1HZ LYS 55 -6.017 1.316 14.103
355 2HZ LYS 55 2HZ LYS 55 -4.422 1.749 13.746
356 3HZ LYS 55 3HZ LYS 55 -4.733 0.550 14.896
357 H ILE 56 H ILE 56 -7.525 0.057 9.149
358 HA ILE 56 HA ILE 56 -7.000 2.936 8.978
359 HB ILE 56 HB ILE 56 -8.677 1.484 6.930
360 1HG1 ILE 56 1HG1 ILE 56 -5.909 2.664 6.606
361 2HG1 ILE 56 2HG1 ILE 56 -6.260 0.942 6.717
362 1HG2 ILE 56 1HG2 ILE 56 -7.622 4.243 6.581
363 2HG2 ILE 56 2HG2 ILE 56 -9.000 3.999 7.654
364 3HG2 ILE 56 3HG2 ILE 56 -9.102 3.511 5.962
365 1HD1 ILE 56 1HD1 ILE 56 -7.366 0.936 4.642
366 2HD1 ILE 56 2HD1 ILE 56 -5.895 1.880 4.405
367 3HD1 ILE 56 3HD1 ILE 56 -7.447 2.697 4.593
368 H LYS 57 H LYS 57 -8.033 3.106 11.001
369 HA LYS 57 HA LYS 57 -10.953 3.016 10.820
370 1HB LYS 57 1HB LYS 57 -10.003 0.953 12.001
371 2HB LYS 57 2HB LYS 57 -9.526 2.048 13.291
372 1HG LYS 57 1HG LYS 57 -12.242 2.569 12.699
373 2HG LYS 57 2HG LYS 57 -12.047 0.820 12.829
374 1HD LYS 57 1HD LYS 57 -10.682 2.410 14.900
375 2HD LYS 57 2HD LYS 57 -12.446 2.465 14.940
376 1HE LYS 57 1HE LYS 57 -11.490 0.662 16.343
377 2HE LYS 57 2HE LYS 57 -12.568 0.066 15.081
378 1HZ LYS 57 1HZ LYS 57 -10.588 -0.436 13.736
379 2HZ LYS 57 2HZ LYS 57 -10.617 -1.303 15.188
380 3HZ LYS 57 3HZ LYS 57 -9.599 0.037 15.026
381 H LYS 58 H LYS 58 -11.080 5.237 10.730
382 HA LYS 58 HA LYS 58 -10.369 6.626 13.218
383 1HB LYS 58 1HB LYS 58 -8.922 7.008 10.959
384 2HB LYS 58 2HB LYS 58 -10.172 8.225 10.740
385 1HG LYS 58 1HG LYS 58 -9.619 9.130 12.977
386 2HG LYS 58 2HG LYS 58 -8.292 7.970 13.077
387 1HD LYS 58 1HD LYS 58 -7.852 9.139 10.643
388 2HD LYS 58 2HD LYS 58 -8.491 10.485 11.588
389 1HE LYS 58 1HE LYS 58 -6.395 10.734 12.327
390 2HE LYS 58 2HE LYS 58 -6.727 9.325 13.333
391 1HZ LYS 58 1HZ LYS 58 -5.339 9.407 10.719
392 2HZ LYS 58 2HZ LYS 58 -5.906 7.965 11.398
393 3HZ LYS 58 3HZ LYS 58 -4.731 8.875 12.206
394 H SER 59 H SER 59 -12.099 7.059 10.127
395 HA SER 59 HA SER 59 -14.259 8.381 11.632
396 1HB SER 59 1HB SER 59 -12.870 9.463 9.584
397 2HB SER 59 2HB SER 59 -14.165 8.674 8.684
398 HG SER 59 HG SER 59 -14.441 10.949 9.578
Start of MODEL 24
1 1H ALA 16 1H ALA 16 -13.415 6.221 -9.074
2 2H ALA 16 2H ALA 16 -13.982 5.659 -7.555
3 3H ALA 16 3H ALA 16 -13.616 7.321 -7.775
4 HA ALA 16 HA ALA 16 -15.921 7.091 -7.809
5 1HB ALA 16 1HB ALA 16 -16.367 7.732 -10.244
6 2HB ALA 16 2HB ALA 16 -14.630 7.539 -10.480
7 3HB ALA 16 3HB ALA 16 -15.237 8.730 -9.330
8 H LYS 17 H LYS 17 -14.448 4.982 -10.264
9 HA LYS 17 HA LYS 17 -16.252 2.853 -9.687
10 1HB LYS 17 1HB LYS 17 -17.391 2.755 -11.847
11 2HB LYS 17 2HB LYS 17 -17.763 4.257 -11.013
12 1HG LYS 17 1HG LYS 17 -15.561 4.900 -12.545
13 2HG LYS 17 2HG LYS 17 -16.492 3.818 -13.581
14 1HD LYS 17 1HD LYS 17 -18.453 5.200 -13.344
15 2HD LYS 17 2HD LYS 17 -17.632 6.227 -12.167
16 1HE LYS 17 1HE LYS 17 -16.441 5.873 -14.879
17 2HE LYS 17 2HE LYS 17 -17.822 6.951 -14.682
18 1HZ LYS 17 1HZ LYS 17 -16.578 8.174 -13.008
19 2HZ LYS 17 2HZ LYS 17 -15.737 8.145 -14.474
20 3HZ LYS 17 3HZ LYS 17 -15.253 7.140 -13.203
21 H ARG 18 H ARG 18 -15.505 0.919 -10.445
22 HA ARG 18 HA ARG 18 -14.057 -0.602 -11.310
23 1HB ARG 18 1HB ARG 18 -13.680 1.574 -13.372
24 2HB ARG 18 2HB ARG 18 -12.957 -0.023 -13.501
25 1HG ARG 18 1HG ARG 18 -14.882 -0.985 -14.131
26 2HG ARG 18 2HG ARG 18 -15.848 -0.024 -13.011
27 1HD ARG 18 1HD ARG 18 -16.493 1.292 -14.678
28 2HD ARG 18 2HD ARG 18 -14.813 1.714 -15.010
29 HE ARG 18 HE ARG 18 -16.467 -0.042 -16.525
30 1HH1 ARG 18 1HH1 ARG 18 -13.169 0.522 -15.532
31 2HH1 ARG 18 2HH1 ARG 18 -12.487 -0.283 -16.905
32 1HH2 ARG 18 1HH2 ARG 18 -15.571 -1.101 -18.330
33 2HH2 ARG 18 2HH2 ARG 18 -13.850 -1.204 -18.495
34 H GLU 19 H GLU 19 -12.208 2.276 -12.258
35 HA GLU 19 HA GLU 19 -9.816 1.260 -11.101
36 1HB GLU 19 1HB GLU 19 -10.248 3.017 -13.051
37 2HB GLU 19 2HB GLU 19 -10.088 4.162 -11.725
38 1HG GLU 19 1HG GLU 19 -7.879 3.553 -11.306
39 2HG GLU 19 2HG GLU 19 -8.030 2.042 -12.199
40 H PHE 20 H PHE 20 -8.958 1.559 -9.135
41 HA PHE 20 HA PHE 20 -10.376 3.375 -7.298
42 1HB PHE 20 1HB PHE 20 -9.238 1.799 -5.535
43 2HB PHE 20 2HB PHE 20 -10.723 1.300 -6.339
44 HD1 PHE 20 HD1 PHE 20 -7.025 1.031 -6.629
45 HD2 PHE 20 HD2 PHE 20 -10.810 -0.761 -7.384
46 HE1 PHE 20 HE1 PHE 20 -5.898 -1.017 -7.400
47 HE2 PHE 20 HE2 PHE 20 -9.691 -2.812 -8.155
48 HZ PHE 20 HZ PHE 20 -7.232 -2.943 -8.164
49 H ASN 21 H ASN 21 -8.912 3.893 -5.333
50 HA ASN 21 HA ASN 21 -6.192 4.521 -6.228
51 1HB ASN 21 1HB ASN 21 -8.325 6.372 -5.548
52 2HB ASN 21 2HB ASN 21 -6.904 6.614 -4.540
53 1HD2 ASN 21 1HD2 ASN 21 -4.795 6.487 -5.897
54 2HD2 ASN 21 2HD2 ASN 21 -4.798 7.447 -7.334
55 H GLU 22 H GLU 22 -7.206 2.438 -4.634
56 HA GLU 22 HA GLU 22 -6.267 3.081 -1.934
57 1HB GLU 22 1HB GLU 22 -7.287 0.934 -1.274
58 2HB GLU 22 2HB GLU 22 -8.449 2.016 -2.029
59 1HG GLU 22 1HG GLU 22 -7.496 0.555 -4.152
60 2HG GLU 22 2HG GLU 22 -7.548 -0.624 -2.842
61 H ASN 23 H ASN 23 -5.515 1.213 -4.770
62 HA ASN 23 HA ASN 23 -2.898 0.643 -3.705
63 1HB ASN 23 1HB ASN 23 -4.662 -1.654 -4.559
64 2HB ASN 23 2HB ASN 23 -2.985 -1.759 -4.035
65 1HD2 ASN 23 1HD2 ASN 23 -2.495 -1.248 -1.836
66 2HD2 ASN 23 2HD2 ASN 23 -3.694 -1.453 -0.609
67 H ARG 24 H ARG 24 -2.029 1.798 -5.350
68 HA ARG 24 HA ARG 24 -1.353 0.560 -7.739
69 1HB ARG 24 1HB ARG 24 -3.863 2.138 -7.829
70 2HB ARG 24 2HB ARG 24 -2.716 2.445 -9.126
71 1HG ARG 24 1HG ARG 24 -3.065 -0.383 -8.666
72 2HG ARG 24 2HG ARG 24 -4.600 0.420 -9.001
73 1HD ARG 24 1HD ARG 24 -2.821 1.507 -10.843
74 2HD ARG 24 2HD ARG 24 -2.404 -0.203 -10.785
75 HE ARG 24 HE ARG 24 -5.144 -0.117 -10.990
76 1HH1 ARG 24 1HH1 ARG 24 -2.442 1.028 -12.878
77 2HH1 ARG 24 2HH1 ARG 24 -3.281 0.901 -14.387
78 1HH2 ARG 24 1HH2 ARG 24 -6.250 -0.283 -12.974
79 2HH2 ARG 24 2HH2 ARG 24 -5.444 0.158 -14.442
80 H TYR 25 H TYR 25 -2.466 3.840 -7.157
81 HA TYR 25 HA TYR 25 -0.579 5.421 -8.206
82 1HB TYR 25 1HB TYR 25 -1.045 7.029 -6.376
83 2HB TYR 25 2HB TYR 25 -2.520 6.261 -6.963
84 HD1 TYR 25 HD1 TYR 25 -2.968 3.893 -5.641
85 HD2 TYR 25 HD2 TYR 25 -0.944 7.291 -4.074
86 HE1 TYR 25 HE1 TYR 25 -3.453 3.117 -3.384
87 HE2 TYR 25 HE2 TYR 25 -1.445 6.529 -1.790
88 HH TYR 25 HH TYR 25 -3.662 4.602 -0.936
89 H LEU 26 H LEU 26 -0.319 3.776 -5.102
90 HA LEU 26 HA LEU 26 2.556 4.386 -5.045
91 1HB LEU 26 1HB LEU 26 2.489 4.868 -2.827
92 2HB LEU 26 2HB LEU 26 0.870 5.363 -3.269
93 HG LEU 26 HG LEU 26 0.618 4.202 -1.248
94 1HD1 LEU 26 1HD1 LEU 26 -1.053 2.869 -1.856
95 2HD1 LEU 26 2HD1 LEU 26 0.016 1.782 -2.740
96 3HD1 LEU 26 3HD1 LEU 26 -0.596 3.241 -3.516
97 1HD2 LEU 26 1HD2 LEU 26 2.990 3.074 -1.702
98 2HD2 LEU 26 2HD2 LEU 26 1.951 1.702 -2.085
99 3HD2 LEU 26 3HD2 LEU 26 1.854 2.466 -0.499
100 H THR 27 H THR 27 0.159 1.955 -5.043
101 HA THR 27 HA THR 27 1.332 -0.116 -3.662
102 HB THR 27 HB THR 27 -0.437 -0.073 -6.089
103 HG1 THR 27 HG1 THR 27 -0.842 -0.946 -3.425
104 1HG2 THR 27 1HG2 THR 27 0.868 -2.441 -4.867
105 2HG2 THR 27 2HG2 THR 27 0.390 -2.144 -6.539
106 3HG2 THR 27 3HG2 THR 27 -0.828 -2.561 -5.334
107 H GLU 28 H GLU 28 1.332 -0.232 -7.202
108 HA GLU 28 HA GLU 28 3.521 -1.919 -7.436
109 1HB GLU 28 1HB GLU 28 2.641 0.118 -9.481
110 2HB GLU 28 2HB GLU 28 3.535 -1.365 -9.786
111 1HG GLU 28 1HG GLU 28 1.688 -2.612 -9.810
112 2HG GLU 28 2HG GLU 28 1.005 -1.797 -8.404
113 H ARG 29 H ARG 29 3.434 1.604 -7.300
114 HA ARG 29 HA ARG 29 6.080 2.060 -8.148
115 1HB ARG 29 1HB ARG 29 4.142 3.646 -6.484
116 2HB ARG 29 2HB ARG 29 5.779 4.223 -6.766
117 1HG ARG 29 1HG ARG 29 3.891 3.494 -8.988
118 2HG ARG 29 2HG ARG 29 4.016 5.119 -8.313
119 1HD ARG 29 1HD ARG 29 5.479 5.277 -10.072
120 2HD ARG 29 2HD ARG 29 6.572 4.782 -8.780
121 HE ARG 29 HE ARG 29 5.514 2.536 -10.169
122 1HH1 ARG 29 1HH1 ARG 29 7.898 5.075 -10.396
123 2HH1 ARG 29 2HH1 ARG 29 8.945 4.170 -11.437
124 1HH2 ARG 29 1HH2 ARG 29 6.890 1.345 -11.538
125 2HH2 ARG 29 2HH2 ARG 29 8.372 2.054 -12.086
126 H ARG 30 H ARG 30 4.697 1.751 -4.892
127 HA ARG 30 HA ARG 30 7.293 1.872 -3.647
128 1HB ARG 30 1HB ARG 30 4.537 1.310 -2.556
129 2HB ARG 30 2HB ARG 30 5.986 1.335 -1.559
130 1HG ARG 30 1HG ARG 30 6.277 3.708 -2.702
131 2HG ARG 30 2HG ARG 30 4.523 3.570 -2.838
132 1HD ARG 30 1HD ARG 30 4.563 2.955 -0.356
133 2HD ARG 30 2HD ARG 30 6.220 3.558 -0.359
134 HE ARG 30 HE ARG 30 3.835 5.113 -0.368
135 1HH1 ARG 30 1HH1 ARG 30 7.132 5.064 -1.511
136 2HH1 ARG 30 2HH1 ARG 30 7.262 6.789 -1.588
137 1HH2 ARG 30 1HH2 ARG 30 4.004 7.381 -0.470
138 2HH2 ARG 30 2HH2 ARG 30 5.487 8.106 -0.997
139 H ARG 31 H ARG 31 5.218 -0.593 -4.880
140 HA ARG 31 HA ARG 31 5.974 -2.789 -3.341
141 1HB ARG 31 1HB ARG 31 4.545 -2.321 -5.775
142 2HB ARG 31 2HB ARG 31 5.655 -3.659 -6.027
143 1HG ARG 31 1HG ARG 31 4.692 -4.910 -4.267
144 2HG ARG 31 2HG ARG 31 3.761 -3.521 -3.701
145 1HD ARG 31 1HD ARG 31 2.477 -5.252 -5.018
146 2HD ARG 31 2HD ARG 31 2.336 -3.589 -5.584
147 HE ARG 31 HE ARG 31 4.411 -5.089 -6.893
148 1HH1 ARG 31 1HH1 ARG 31 1.015 -4.283 -6.911
149 2HH1 ARG 31 2HH1 ARG 31 0.817 -4.619 -8.598
150 1HH2 ARG 31 1HH2 ARG 31 4.152 -5.531 -9.112
151 2HH2 ARG 31 2HH2 ARG 31 2.597 -5.328 -9.848
152 H GLN 32 H GLN 32 7.475 -1.393 -6.215
153 HA GLN 32 HA GLN 32 9.441 -3.375 -6.576
154 1HB GLN 32 1HB GLN 32 8.707 -1.466 -8.156
155 2HB GLN 32 2HB GLN 32 9.872 -0.485 -7.278
156 1HG GLN 32 1HG GLN 32 11.218 -2.844 -7.945
157 2HG GLN 32 2HG GLN 32 10.300 -2.389 -9.379
158 1HE2 GLN 32 1HE2 GLN 32 10.349 0.387 -9.050
159 2HE2 GLN 32 2HE2 GLN 32 11.969 0.938 -9.288
160 H GLN 33 H GLN 33 9.506 -0.310 -4.800
161 HA GLN 33 HA GLN 33 12.221 -0.630 -3.960
162 1HB GLN 33 1HB GLN 33 10.085 1.210 -2.874
163 2HB GLN 33 2HB GLN 33 11.813 1.343 -2.576
164 1HG GLN 33 1HG GLN 33 12.177 1.729 -4.975
165 2HG GLN 33 2HG GLN 33 10.435 1.652 -5.234
166 1HE2 GLN 33 1HE2 GLN 33 9.117 3.297 -4.346
167 2HE2 GLN 33 2HE2 GLN 33 9.770 4.851 -3.971
168 H LEU 34 H LEU 34 9.069 -1.181 -2.437
169 HA LEU 34 HA LEU 34 10.051 -1.723 0.142
170 1HB LEU 34 1HB LEU 34 7.513 -2.125 -1.296
171 2HB LEU 34 2HB LEU 34 7.785 -3.208 0.053
172 HG LEU 34 HG LEU 34 7.622 -0.199 0.122
173 1HD1 LEU 34 1HD1 LEU 34 6.059 -1.761 2.007
174 2HD1 LEU 34 2HD1 LEU 34 5.677 -2.136 0.329
175 3HD1 LEU 34 3HD1 LEU 34 5.557 -0.476 0.909
176 1HD2 LEU 34 1HD2 LEU 34 8.866 -2.099 2.020
177 2HD2 LEU 34 2HD2 LEU 34 7.839 -0.839 2.705
178 3HD2 LEU 34 3HD2 LEU 34 9.229 -0.401 1.709
179 H SER 35 H SER 35 9.459 -3.841 -2.622
180 HA SER 35 HA SER 35 9.925 -6.270 -1.283
181 1HB SER 35 1HB SER 35 9.527 -5.396 -4.011
182 2HB SER 35 2HB SER 35 10.795 -6.618 -3.935
183 HG SER 35 HG SER 35 8.083 -6.825 -3.390
184 H SER 36 H SER 36 12.098 -4.147 -3.122
185 HA SER 36 HA SER 36 14.407 -5.756 -2.793
186 1HB SER 36 1HB SER 36 14.313 -4.152 -4.593
187 2HB SER 36 2HB SER 36 14.104 -2.821 -3.455
188 HG SER 36 HG SER 36 16.189 -3.095 -2.761
189 H GLU 37 H GLU 37 13.235 -2.881 -1.054
190 HA GLU 37 HA GLU 37 15.446 -2.640 0.669
191 1HB GLU 37 1HB GLU 37 13.199 -1.160 0.182
192 2HB GLU 37 2HB GLU 37 12.861 -1.795 1.786
193 1HG GLU 37 1HG GLU 37 13.986 0.016 2.464
194 2HG GLU 37 2HG GLU 37 15.403 -0.975 2.123
195 H LEU 38 H LEU 38 12.334 -4.296 1.082
196 HA LEU 38 HA LEU 38 13.106 -5.264 3.700
197 1HB LEU 38 1HB LEU 38 10.659 -5.518 1.994
198 2HB LEU 38 2HB LEU 38 10.885 -6.585 3.367
199 HG LEU 38 HG LEU 38 10.940 -4.697 4.888
200 1HD1 LEU 38 1HD1 LEU 38 11.898 -2.887 3.896
201 2HD1 LEU 38 2HD1 LEU 38 10.201 -2.445 3.712
202 3HD1 LEU 38 3HD1 LEU 38 11.080 -3.154 2.356
203 1HD2 LEU 38 1HD2 LEU 38 8.619 -3.743 4.334
204 2HD2 LEU 38 2HD2 LEU 38 8.763 -5.479 4.606
205 3HD2 LEU 38 3HD2 LEU 38 8.647 -4.851 2.963
206 H GLY 39 H GLY 39 13.391 -6.320 0.453
207 1HA GLY 39 1HA GLY 39 14.386 -8.205 -0.418
208 2HA GLY 39 2HA GLY 39 14.834 -8.650 1.223
209 H LEU 40 H LEU 40 11.528 -8.064 0.266
210 HA LEU 40 HA LEU 40 10.981 -10.936 0.623
211 1HB LEU 40 1HB LEU 40 8.570 -9.938 1.040
212 2HB LEU 40 2HB LEU 40 9.755 -10.052 2.327
213 HG LEU 40 HG LEU 40 10.364 -7.623 1.714
214 1HD1 LEU 40 1HD1 LEU 40 8.933 -7.836 -0.425
215 2HD1 LEU 40 2HD1 LEU 40 8.856 -6.340 0.506
216 3HD1 LEU 40 3HD1 LEU 40 7.569 -7.537 0.651
217 1HD2 LEU 40 1HD2 LEU 40 8.234 -6.838 2.973
218 2HD2 LEU 40 2HD2 LEU 40 9.384 -7.901 3.785
219 3HD2 LEU 40 3HD2 LEU 40 7.896 -8.562 3.108
220 H ASN 41 H ASN 41 9.195 -11.821 -0.612
221 HA ASN 41 HA ASN 41 9.229 -10.813 -3.332
222 1HB ASN 41 1HB ASN 41 9.290 -13.334 -2.372
223 2HB ASN 41 2HB ASN 41 7.558 -13.163 -2.638
224 1HD2 ASN 41 1HD2 ASN 41 6.897 -12.420 -4.794
225 2HD2 ASN 41 2HD2 ASN 41 7.815 -12.945 -6.160
226 H GLU 42 H GLU 42 7.276 -10.496 -4.563
227 HA GLU 42 HA GLU 42 5.457 -8.740 -3.460
228 1HB GLU 42 1HB GLU 42 4.979 -10.638 -5.768
229 2HB GLU 42 2HB GLU 42 4.067 -9.169 -5.442
230 1HG GLU 42 1HG GLU 42 5.511 -7.991 -6.628
231 2HG GLU 42 2HG GLU 42 6.819 -8.488 -5.556
232 H ALA 43 H ALA 43 5.453 -12.221 -3.462
233 HA ALA 43 HA ALA 43 2.763 -12.729 -2.856
234 1HB ALA 43 1HB ALA 43 4.920 -14.300 -3.257
235 2HB ALA 43 2HB ALA 43 3.408 -14.878 -2.555
236 3HB ALA 43 3HB ALA 43 4.756 -14.437 -1.506
237 H GLN 44 H GLN 44 5.476 -11.760 -0.872
238 HA GLN 44 HA GLN 44 4.040 -11.959 1.627
239 1HB GLN 44 1HB GLN 44 6.691 -10.742 0.847
240 2HB GLN 44 2HB GLN 44 6.065 -10.701 2.489
241 1HG GLN 44 1HG GLN 44 6.445 -13.271 0.991
242 2HG GLN 44 2HG GLN 44 7.739 -12.522 1.926
243 1HE2 GLN 44 1HE2 GLN 44 6.590 -11.647 4.143
244 2HE2 GLN 44 2HE2 GLN 44 5.852 -12.933 5.030
245 H ILE 45 H ILE 45 4.680 -9.650 -0.850
246 HA ILE 45 HA ILE 45 4.074 -7.262 0.515
247 HB ILE 45 HB ILE 45 3.968 -7.989 -2.411
248 1HG1 ILE 45 1HG1 ILE 45 6.183 -7.997 -1.228
249 2HG1 ILE 45 2HG1 ILE 45 6.081 -6.862 -2.572
250 1HG2 ILE 45 1HG2 ILE 45 4.024 -5.151 -1.514
251 2HG2 ILE 45 2HG2 ILE 45 2.482 -5.996 -1.608
252 3HG2 ILE 45 3HG2 ILE 45 3.488 -5.841 -3.042
253 1HD1 ILE 45 1HD1 ILE 45 5.621 -5.062 -0.914
254 2HD1 ILE 45 2HD1 ILE 45 7.219 -5.799 -0.787
255 3HD1 ILE 45 3HD1 ILE 45 5.952 -6.234 0.362
256 H LYS 46 H LYS 46 2.067 -9.572 -1.284
257 HA LYS 46 HA LYS 46 -0.299 -8.079 -1.365
258 1HB LYS 46 1HB LYS 46 0.330 -10.411 -2.411
259 2HB LYS 46 2HB LYS 46 -0.381 -11.041 -0.931
260 1HG LYS 46 1HG LYS 46 -1.991 -9.028 -2.346
261 2HG LYS 46 2HG LYS 46 -1.762 -10.560 -3.193
262 1HD LYS 46 1HD LYS 46 -2.351 -11.471 -0.728
263 2HD LYS 46 2HD LYS 46 -3.261 -9.959 -0.720
264 1HE LYS 46 1HE LYS 46 -4.578 -10.607 -2.540
265 2HE LYS 46 2HE LYS 46 -3.451 -11.877 -3.018
266 1HZ LYS 46 1HZ LYS 46 -5.206 -11.884 -0.622
267 2HZ LYS 46 2HZ LYS 46 -4.054 -13.072 -0.971
268 3HZ LYS 46 3HZ LYS 46 -5.376 -12.850 -2.001
269 H ILE 47 H ILE 47 0.843 -10.434 1.016
270 HA ILE 47 HA ILE 47 -1.330 -10.094 2.827
271 HB ILE 47 HB ILE 47 1.292 -11.471 2.845
272 1HG1 ILE 47 1HG1 ILE 47 -1.321 -12.354 4.059
273 2HG1 ILE 47 2HG1 ILE 47 -1.020 -12.449 2.327
274 1HG2 ILE 47 1HG2 ILE 47 1.105 -11.934 5.307
275 2HG2 ILE 47 2HG2 ILE 47 -0.046 -10.601 5.397
276 3HG2 ILE 47 3HG2 ILE 47 1.615 -10.297 4.885
277 1HD1 ILE 47 1HD1 ILE 47 -0.400 -14.541 2.938
278 2HD1 ILE 47 2HD1 ILE 47 0.126 -14.038 4.546
279 3HD1 ILE 47 3HD1 ILE 47 1.147 -13.718 3.143
280 H TRP 48 H TRP 48 1.929 -8.816 2.606
281 HA TRP 48 HA TRP 48 2.057 -7.368 4.981
282 1HB TRP 48 1HB TRP 48 3.983 -7.859 3.552
283 2HB TRP 48 2HB TRP 48 3.317 -6.858 2.276
284 HD1 TRP 48 HD1 TRP 48 5.699 -6.758 5.073
285 HE1 TRP 48 HE1 TRP 48 6.501 -4.350 5.462
286 HE3 TRP 48 HE3 TRP 48 2.235 -4.234 2.308
287 HZ2 TRP 48 HZ2 TRP 48 5.781 -1.743 4.732
288 HZ3 TRP 48 HZ3 TRP 48 2.357 -1.788 2.206
289 HH2 TRP 48 HH2 TRP 48 4.103 -0.572 3.383
290 H PHE 49 H PHE 49 1.095 -6.319 1.736
291 HA PHE 49 HA PHE 49 0.374 -3.702 2.581
292 1HB PHE 49 1HB PHE 49 0.121 -5.248 0.053
293 2HB PHE 49 2HB PHE 49 -0.912 -3.828 0.262
294 HD1 PHE 49 HD1 PHE 49 2.538 -5.020 0.058
295 HD2 PHE 49 HD2 PHE 49 -0.003 -1.629 0.332
296 HE1 PHE 49 HE1 PHE 49 4.460 -3.563 -0.409
297 HE2 PHE 49 HE2 PHE 49 1.919 -0.150 -0.145
298 HZ PHE 49 HZ PHE 49 4.162 -1.131 -0.488
299 H GLN 50 H GLN 50 -1.448 -6.652 1.993
300 HA GLN 50 HA GLN 50 -3.982 -5.521 2.386
301 1HB GLN 50 1HB GLN 50 -2.891 -8.309 2.544
302 2HB GLN 50 2HB GLN 50 -4.534 -7.990 3.083
303 1HG GLN 50 1HG GLN 50 -4.254 -6.743 0.578
304 2HG GLN 50 2HG GLN 50 -3.535 -8.346 0.432
305 1HE2 GLN 50 1HE2 GLN 50 -5.057 -9.877 2.029
306 2HE2 GLN 50 2HE2 GLN 50 -6.692 -9.911 1.472
307 H ASN 51 H ASN 51 -1.516 -6.652 4.595
308 HA ASN 51 HA ASN 51 -3.196 -6.732 6.907
309 1HB ASN 51 1HB ASN 51 -0.341 -7.093 6.307
310 2HB ASN 51 2HB ASN 51 -0.658 -6.390 7.890
311 1HD2 ASN 51 1HD2 ASN 51 -1.330 -9.125 5.799
312 2HD2 ASN 51 2HD2 ASN 51 -1.708 -10.239 7.065
313 H LYS 52 H LYS 52 -1.215 -4.298 5.349
314 HA LYS 52 HA LYS 52 -1.264 -2.421 7.486
315 1HB LYS 52 1HB LYS 52 -0.872 -1.911 4.531
316 2HB LYS 52 2HB LYS 52 -0.451 -0.814 5.838
317 1HG LYS 52 1HG LYS 52 0.755 -3.478 6.043
318 2HG LYS 52 2HG LYS 52 1.269 -2.533 4.645
319 1HD LYS 52 1HD LYS 52 1.305 -1.527 7.489
320 2HD LYS 52 2HD LYS 52 2.700 -2.221 6.661
321 1HE LYS 52 1HE LYS 52 2.407 -0.456 4.900
322 2HE LYS 52 2HE LYS 52 1.195 0.288 5.942
323 1HZ LYS 52 1HZ LYS 52 3.388 1.297 6.209
324 2HZ LYS 52 2HZ LYS 52 4.029 -0.191 6.692
325 3HZ LYS 52 3HZ LYS 52 2.863 0.576 7.647
326 H ARG 53 H ARG 53 -3.213 -2.835 4.552
327 HA ARG 53 HA ARG 53 -5.213 -1.023 5.735
328 1HB ARG 53 1HB ARG 53 -4.836 -1.367 2.768
329 2HB ARG 53 2HB ARG 53 -5.736 -0.117 3.615
330 1HG ARG 53 1HG ARG 53 -3.129 0.123 4.558
331 2HG ARG 53 2HG ARG 53 -2.964 -0.180 2.828
332 1HD ARG 53 1HD ARG 53 -4.592 1.991 4.142
333 2HD ARG 53 2HD ARG 53 -3.105 2.196 3.221
334 HE ARG 53 HE ARG 53 -4.293 1.734 1.237
335 1HH1 ARG 53 1HH1 ARG 53 -6.375 1.794 4.048
336 2HH1 ARG 53 2HH1 ARG 53 -7.821 1.995 3.120
337 1HH2 ARG 53 1HH2 ARG 53 -6.197 1.995 0.028
338 2HH2 ARG 53 2HH2 ARG 53 -7.721 2.107 0.842
339 H ALA 54 H ALA 54 -6.643 -2.461 6.540
340 HA ALA 54 HA ALA 54 -7.739 -4.459 4.670
341 1HB ALA 54 1HB ALA 54 -7.231 -4.638 7.621
342 2HB ALA 54 2HB ALA 54 -6.698 -5.723 6.338
343 3HB ALA 54 3HB ALA 54 -8.394 -5.693 6.819
344 H LYS 55 H LYS 55 -8.700 -2.925 7.747
345 HA LYS 55 HA LYS 55 -11.185 -2.041 6.473
346 1HB LYS 55 1HB LYS 55 -11.641 -4.202 7.594
347 2HB LYS 55 2HB LYS 55 -11.085 -3.513 9.112
348 1HG LYS 55 1HG LYS 55 -12.899 -1.787 8.866
349 2HG LYS 55 2HG LYS 55 -13.519 -2.751 7.523
350 1HD LYS 55 1HD LYS 55 -14.277 -4.403 8.885
351 2HD LYS 55 2HD LYS 55 -12.969 -4.189 10.050
352 1HE LYS 55 1HE LYS 55 -15.026 -3.536 11.092
353 2HE LYS 55 2HE LYS 55 -14.063 -2.088 10.801
354 1HZ LYS 55 1HZ LYS 55 -15.399 -1.796 8.721
355 2HZ LYS 55 2HZ LYS 55 -16.265 -1.594 10.160
356 3HZ LYS 55 3HZ LYS 55 -16.423 -3.026 9.274
357 H ILE 56 H ILE 56 -10.175 0.036 6.560
358 HA ILE 56 HA ILE 56 -10.382 1.268 9.220
359 HB ILE 56 HB ILE 56 -8.224 1.981 7.235
360 1HG1 ILE 56 1HG1 ILE 56 -7.783 0.528 9.836
361 2HG1 ILE 56 2HG1 ILE 56 -8.079 -0.349 8.339
362 1HG2 ILE 56 1HG2 ILE 56 -7.431 3.490 8.788
363 2HG2 ILE 56 2HG2 ILE 56 -8.225 2.679 10.139
364 3HG2 ILE 56 3HG2 ILE 56 -9.175 3.637 9.003
365 1HD1 ILE 56 1HD1 ILE 56 -6.044 0.157 7.485
366 2HD1 ILE 56 2HD1 ILE 56 -5.643 0.229 9.201
367 3HD1 ILE 56 3HD1 ILE 56 -5.960 1.715 8.305
368 H LYS 57 H LYS 57 -12.465 1.977 8.514
369 HA LYS 57 HA LYS 57 -13.931 3.507 7.687
370 1HB LYS 57 1HB LYS 57 -12.159 5.049 8.635
371 2HB LYS 57 2HB LYS 57 -11.515 5.181 7.004
372 1HG LYS 57 1HG LYS 57 -13.196 6.514 6.299
373 2HG LYS 57 2HG LYS 57 -14.398 5.725 7.321
374 1HD LYS 57 1HD LYS 57 -13.186 6.834 9.285
375 2HD LYS 57 2HD LYS 57 -12.397 7.838 8.067
376 1HE LYS 57 1HE LYS 57 -15.385 7.556 8.320
377 2HE LYS 57 2HE LYS 57 -14.456 8.832 9.105
378 1HZ LYS 57 1HZ LYS 57 -14.533 8.347 6.176
379 2HZ LYS 57 2HZ LYS 57 -13.731 9.612 6.960
380 3HZ LYS 57 3HZ LYS 57 -15.420 9.539 6.985
381 H LYS 58 H LYS 58 -14.767 4.445 5.710
382 HA LYS 58 HA LYS 58 -14.045 2.872 3.415
383 1HB LYS 58 1HB LYS 58 -15.942 3.945 2.329
384 2HB LYS 58 2HB LYS 58 -16.394 3.387 3.934
385 1HG LYS 58 1HG LYS 58 -15.862 5.793 4.681
386 2HG LYS 58 2HG LYS 58 -15.965 6.183 2.964
387 1HD LYS 58 1HD LYS 58 -18.158 4.599 4.220
388 2HD LYS 58 2HD LYS 58 -18.082 6.338 4.516
389 1HE LYS 58 1HE LYS 58 -18.103 5.050 1.789
390 2HE LYS 58 2HE LYS 58 -19.518 5.730 2.590
391 1HZ LYS 58 1HZ LYS 58 -18.910 7.550 1.440
392 2HZ LYS 58 2HZ LYS 58 -17.293 7.075 1.295
393 3HZ LYS 58 3HZ LYS 58 -17.840 7.785 2.730
394 H SER 59 H SER 59 -12.376 3.391 2.174
395 HA SER 59 HA SER 59 -12.190 5.890 0.859
396 1HB SER 59 1HB SER 59 -11.306 6.458 3.174
397 2HB SER 59 2HB SER 59 -9.948 5.389 2.822
398 HG SER 59 HG SER 59 -10.682 7.524 1.117
Start of MODEL 25
1 1H ALA 16 1H ALA 16 -18.735 -7.191 -9.725
2 2H ALA 16 2H ALA 16 -17.088 -6.896 -10.104
3 3H ALA 16 3H ALA 16 -18.216 -5.603 -10.107
4 HA ALA 16 HA ALA 16 -18.404 -5.564 -7.859
5 1HB ALA 16 1HB ALA 16 -18.615 -8.125 -7.810
6 2HB ALA 16 2HB ALA 16 -17.935 -7.317 -6.398
7 3HB ALA 16 3HB ALA 16 -16.871 -8.120 -7.552
8 H LYS 17 H LYS 17 -16.393 -4.790 -9.857
9 HA LYS 17 HA LYS 17 -14.193 -4.258 -7.990
10 1HB LYS 17 1HB LYS 17 -13.573 -6.098 -9.579
11 2HB LYS 17 2HB LYS 17 -13.779 -4.957 -10.901
12 1HG LYS 17 1HG LYS 17 -12.010 -3.553 -9.961
13 2HG LYS 17 2HG LYS 17 -11.798 -4.710 -8.646
14 1HD LYS 17 1HD LYS 17 -11.591 -6.338 -10.804
15 2HD LYS 17 2HD LYS 17 -10.913 -4.843 -11.450
16 1HE LYS 17 1HE LYS 17 -9.686 -4.945 -9.045
17 2HE LYS 17 2HE LYS 17 -9.871 -6.665 -9.383
18 1HZ LYS 17 1HZ LYS 17 -8.614 -6.485 -11.330
19 2HZ LYS 17 2HZ LYS 17 -7.767 -5.555 -10.199
20 3HZ LYS 17 3HZ LYS 17 -8.724 -4.797 -11.369
21 H ARG 18 H ARG 18 -13.265 -2.243 -8.157
22 HA ARG 18 HA ARG 18 -14.116 -0.475 -10.317
23 1HB ARG 18 1HB ARG 18 -14.903 -0.213 -7.462
24 2HB ARG 18 2HB ARG 18 -14.455 1.262 -8.311
25 1HG ARG 18 1HG ARG 18 -16.215 1.072 -9.824
26 2HG ARG 18 2HG ARG 18 -16.457 -0.639 -9.469
27 1HD ARG 18 1HD ARG 18 -16.773 1.173 -7.176
28 2HD ARG 18 2HD ARG 18 -17.968 1.373 -8.457
29 HE ARG 18 HE ARG 18 -17.727 -0.838 -6.642
30 1HH1 ARG 18 1HH1 ARG 18 -18.868 0.153 -9.788
31 2HH1 ARG 18 2HH1 ARG 18 -20.050 -1.108 -9.895
32 1HH2 ARG 18 1HH2 ARG 18 -19.281 -2.497 -6.781
33 2HH2 ARG 18 2HH2 ARG 18 -20.284 -2.613 -8.188
34 H GLU 19 H GLU 19 -12.821 1.421 -10.537
35 HA GLU 19 HA GLU 19 -10.086 1.014 -10.081
36 1HB GLU 19 1HB GLU 19 -11.736 2.943 -11.404
37 2HB GLU 19 2HB GLU 19 -10.533 3.794 -10.445
38 1HG GLU 19 1HG GLU 19 -8.879 2.110 -11.556
39 2HG GLU 19 2HG GLU 19 -10.160 1.953 -12.755
40 H PHE 20 H PHE 20 -8.714 2.840 -9.020
41 HA PHE 20 HA PHE 20 -9.746 4.161 -6.735
42 1HB PHE 20 1HB PHE 20 -8.310 2.745 -5.101
43 2HB PHE 20 2HB PHE 20 -9.894 2.139 -5.577
44 HD1 PHE 20 HD1 PHE 20 -6.284 1.882 -6.396
45 HD2 PHE 20 HD2 PHE 20 -10.107 0.019 -6.505
46 HE1 PHE 20 HE1 PHE 20 -5.240 -0.206 -7.170
47 HE2 PHE 20 HE2 PHE 20 -9.070 -2.073 -7.278
48 HZ PHE 20 HZ PHE 20 -6.633 -2.188 -7.612
49 H ASN 21 H ASN 21 -7.908 4.965 -5.305
50 HA ASN 21 HA ASN 21 -5.442 5.319 -6.859
51 1HB ASN 21 1HB ASN 21 -7.297 7.290 -6.615
52 2HB ASN 21 2HB ASN 21 -6.285 7.605 -5.211
53 1HD2 ASN 21 1HD2 ASN 21 -5.571 6.469 -8.491
54 2HD2 ASN 21 2HD2 ASN 21 -4.423 7.708 -8.857
55 H GLU 22 H GLU 22 -6.022 3.555 -4.758
56 HA GLU 22 HA GLU 22 -4.137 4.521 -2.719
57 1HB GLU 22 1HB GLU 22 -5.450 3.026 -1.105
58 2HB GLU 22 2HB GLU 22 -6.180 4.557 -1.569
59 1HG GLU 22 1HG GLU 22 -7.412 3.218 -3.362
60 2HG GLU 22 2HG GLU 22 -6.906 1.791 -2.459
61 H ASN 23 H ASN 23 -4.437 2.437 -5.174
62 HA ASN 23 HA ASN 23 -2.494 0.621 -4.022
63 1HB ASN 23 1HB ASN 23 -5.241 -0.143 -4.790
64 2HB ASN 23 2HB ASN 23 -3.959 -1.230 -5.309
65 1HD2 ASN 23 1HD2 ASN 23 -2.425 -1.904 -3.588
66 2HD2 ASN 23 2HD2 ASN 23 -3.070 -2.217 -2.016
67 H ARG 24 H ARG 24 -2.390 2.669 -5.931
68 HA ARG 24 HA ARG 24 -1.250 1.200 -8.183
69 1HB ARG 24 1HB ARG 24 -3.019 3.584 -8.683
70 2HB ARG 24 2HB ARG 24 -2.383 2.441 -9.857
71 1HG ARG 24 1HG ARG 24 -4.316 1.608 -7.720
72 2HG ARG 24 2HG ARG 24 -4.850 2.271 -9.264
73 1HD ARG 24 1HD ARG 24 -2.962 0.327 -9.925
74 2HD ARG 24 2HD ARG 24 -3.913 -0.386 -8.625
75 HE ARG 24 HE ARG 24 -5.802 0.612 -10.272
76 1HH1 ARG 24 1HH1 ARG 24 -3.043 -1.457 -10.810
77 2HH1 ARG 24 2HH1 ARG 24 -3.773 -2.295 -12.138
78 1HH2 ARG 24 1HH2 ARG 24 -6.762 -0.489 -12.019
79 2HH2 ARG 24 2HH2 ARG 24 -5.883 -1.744 -12.825
80 H TYR 25 H TYR 25 -2.016 4.524 -7.237
81 HA TYR 25 HA TYR 25 0.153 5.847 -8.289
82 1HB TYR 25 1HB TYR 25 -0.377 7.630 -6.778
83 2HB TYR 25 2HB TYR 25 -1.891 6.847 -7.212
84 HD1 TYR 25 HD1 TYR 25 -1.481 4.414 -5.333
85 HD2 TYR 25 HD2 TYR 25 -1.158 8.611 -4.731
86 HE1 TYR 25 HE1 TYR 25 -1.980 4.089 -2.962
87 HE2 TYR 25 HE2 TYR 25 -1.667 8.303 -2.343
88 HH TYR 25 HH TYR 25 -1.707 5.208 -0.853
89 H LEU 26 H LEU 26 0.107 3.693 -5.621
90 HA LEU 26 HA LEU 26 2.899 4.349 -5.021
91 1HB LEU 26 1HB LEU 26 2.141 5.217 -3.096
92 2HB LEU 26 2HB LEU 26 0.556 4.492 -3.299
93 HG LEU 26 HG LEU 26 2.890 2.854 -2.342
94 1HD1 LEU 26 1HD1 LEU 26 2.478 3.407 -0.103
95 2HD1 LEU 26 2HD1 LEU 26 0.979 4.251 -0.497
96 3HD1 LEU 26 3HD1 LEU 26 2.533 4.955 -0.947
97 1HD2 LEU 26 1HD2 LEU 26 1.288 1.305 -2.583
98 2HD2 LEU 26 2HD2 LEU 26 0.001 2.509 -2.672
99 3HD2 LEU 26 3HD2 LEU 26 0.614 1.988 -1.102
100 H THR 27 H THR 27 0.354 1.959 -5.218
101 HA THR 27 HA THR 27 1.455 -0.226 -4.031
102 HB THR 27 HB THR 27 -0.319 0.106 -6.408
103 HG1 THR 27 HG1 THR 27 -0.683 -0.135 -3.861
104 1HG2 THR 27 1HG2 THR 27 1.096 -2.405 -5.719
105 2HG2 THR 27 2HG2 THR 27 0.519 -1.817 -7.279
106 3HG2 THR 27 3HG2 THR 27 -0.619 -2.499 -6.116
107 H GLU 28 H GLU 28 1.601 -0.072 -7.572
108 HA GLU 28 HA GLU 28 3.744 -1.826 -7.825
109 1HB GLU 28 1HB GLU 28 2.954 0.352 -9.764
110 2HB GLU 28 2HB GLU 28 3.875 -1.099 -10.141
111 1HG GLU 28 1HG GLU 28 1.917 -2.462 -9.507
112 2HG GLU 28 2HG GLU 28 1.003 -0.978 -9.250
113 H ARG 29 H ARG 29 3.770 1.714 -7.653
114 HA ARG 29 HA ARG 29 6.490 2.060 -8.285
115 1HB ARG 29 1HB ARG 29 4.366 3.711 -7.033
116 2HB ARG 29 2HB ARG 29 6.026 4.207 -6.737
117 1HG ARG 29 1HG ARG 29 4.867 3.748 -9.475
118 2HG ARG 29 2HG ARG 29 4.951 5.321 -8.680
119 1HD ARG 29 1HD ARG 29 7.314 3.554 -9.305
120 2HD ARG 29 2HD ARG 29 6.812 4.951 -10.255
121 HE ARG 29 HE ARG 29 8.230 4.968 -7.751
122 1HH1 ARG 29 1HH1 ARG 29 6.180 6.803 -9.901
123 2HH1 ARG 29 2HH1 ARG 29 6.701 8.337 -9.289
124 1HH2 ARG 29 1HH2 ARG 29 8.914 6.986 -6.947
125 2HH2 ARG 29 2HH2 ARG 29 8.250 8.441 -7.611
126 H ARG 30 H ARG 30 4.847 1.832 -5.152
127 HA ARG 30 HA ARG 30 7.320 1.926 -3.685
128 1HB ARG 30 1HB ARG 30 5.011 2.758 -2.916
129 2HB ARG 30 2HB ARG 30 4.662 1.070 -2.567
130 1HG ARG 30 1HG ARG 30 5.910 1.068 -0.713
131 2HG ARG 30 2HG ARG 30 7.198 2.016 -1.459
132 1HD ARG 30 1HD ARG 30 5.518 3.981 -1.269
133 2HD ARG 30 2HD ARG 30 4.705 2.952 -0.090
134 HE ARG 30 HE ARG 30 7.357 3.005 0.656
135 1HH1 ARG 30 1HH1 ARG 30 4.803 5.345 0.226
136 2HH1 ARG 30 2HH1 ARG 30 5.423 6.428 1.427
137 1HH2 ARG 30 1HH2 ARG 30 8.173 4.427 2.235
138 2HH2 ARG 30 2HH2 ARG 30 7.337 5.907 2.568
139 H ARG 31 H ARG 31 5.334 -0.541 -5.066
140 HA ARG 31 HA ARG 31 5.980 -2.709 -3.427
141 1HB ARG 31 1HB ARG 31 4.840 -2.313 -6.091
142 2HB ARG 31 2HB ARG 31 5.750 -3.811 -5.949
143 1HG ARG 31 1HG ARG 31 4.347 -4.063 -3.737
144 2HG ARG 31 2HG ARG 31 3.248 -2.970 -4.585
145 1HD ARG 31 1HD ARG 31 4.321 -5.381 -5.989
146 2HD ARG 31 2HD ARG 31 2.990 -5.556 -4.844
147 HE ARG 31 HE ARG 31 2.594 -3.500 -6.823
148 1HH1 ARG 31 1HH1 ARG 31 2.196 -6.887 -6.078
149 2HH1 ARG 31 2HH1 ARG 31 0.885 -7.105 -7.189
150 1HH2 ARG 31 1HH2 ARG 31 0.870 -3.785 -8.284
151 2HH2 ARG 31 2HH2 ARG 31 0.131 -5.344 -8.439
152 H GLN 32 H GLN 32 7.638 -1.373 -6.251
153 HA GLN 32 HA GLN 32 9.593 -3.381 -6.490
154 1HB GLN 32 1HB GLN 32 8.944 -1.416 -8.090
155 2HB GLN 32 2HB GLN 32 10.175 -0.530 -7.201
156 1HG GLN 32 1HG GLN 32 11.219 -1.416 -9.124
157 2HG GLN 32 2HG GLN 32 11.772 -2.377 -7.754
158 1HE2 GLN 32 1HE2 GLN 32 10.947 -4.484 -7.482
159 2HE2 GLN 32 2HE2 GLN 32 10.275 -5.360 -8.811
160 H GLN 33 H GLN 33 9.610 -0.300 -4.737
161 HA GLN 33 HA GLN 33 12.283 -0.640 -3.773
162 1HB GLN 33 1HB GLN 33 10.065 1.254 -2.999
163 2HB GLN 33 2HB GLN 33 11.663 1.296 -2.269
164 1HG GLN 33 1HG GLN 33 12.670 1.791 -4.404
165 2HG GLN 33 2HG GLN 33 11.110 1.631 -5.209
166 1HE2 GLN 33 1HE2 GLN 33 12.656 3.907 -5.436
167 2HE2 GLN 33 2HE2 GLN 33 11.857 5.219 -4.644
168 H LEU 34 H LEU 34 9.058 -1.160 -2.413
169 HA LEU 34 HA LEU 34 9.899 -1.730 0.212
170 1HB LEU 34 1HB LEU 34 7.433 -2.260 -1.373
171 2HB LEU 34 2HB LEU 34 7.648 -3.117 0.141
172 HG LEU 34 HG LEU 34 7.435 -0.138 -0.266
173 1HD1 LEU 34 1HD1 LEU 34 5.380 -0.282 0.669
174 2HD1 LEU 34 2HD1 LEU 34 5.820 -1.649 1.693
175 3HD1 LEU 34 3HD1 LEU 34 5.459 -1.908 -0.013
176 1HD2 LEU 34 1HD2 LEU 34 8.358 -1.701 2.127
177 2HD2 LEU 34 2HD2 LEU 34 7.619 -0.106 2.281
178 3HD2 LEU 34 3HD2 LEU 34 9.114 -0.301 1.364
179 H SER 35 H SER 35 9.425 -3.800 -2.610
180 HA SER 35 HA SER 35 9.852 -6.246 -1.252
181 1HB SER 35 1HB SER 35 9.571 -5.361 -4.034
182 2HB SER 35 2HB SER 35 10.641 -6.748 -3.840
183 HG SER 35 HG SER 35 8.102 -6.881 -3.979
184 H SER 36 H SER 36 12.012 -4.208 -3.214
185 HA SER 36 HA SER 36 14.312 -5.816 -2.802
186 1HB SER 36 1HB SER 36 13.727 -3.808 -4.510
187 2HB SER 36 2HB SER 36 14.702 -2.928 -3.332
188 HG SER 36 HG SER 36 15.984 -3.831 -4.995
189 H GLU 37 H GLU 37 13.059 -2.930 -1.187
190 HA GLU 37 HA GLU 37 15.281 -2.496 0.496
191 1HB GLU 37 1HB GLU 37 13.481 -0.833 0.008
192 2HB GLU 37 2HB GLU 37 12.402 -1.762 1.040
193 1HG GLU 37 1HG GLU 37 13.975 -1.398 2.922
194 2HG GLU 37 2HG GLU 37 14.926 -0.351 1.869
195 H LEU 38 H LEU 38 12.225 -4.225 1.038
196 HA LEU 38 HA LEU 38 13.072 -5.064 3.676
197 1HB LEU 38 1HB LEU 38 10.614 -5.602 2.025
198 2HB LEU 38 2HB LEU 38 10.893 -6.378 3.573
199 HG LEU 38 HG LEU 38 11.129 -3.443 3.610
200 1HD1 LEU 38 1HD1 LEU 38 9.312 -3.464 2.107
201 2HD1 LEU 38 2HD1 LEU 38 8.613 -3.229 3.708
202 3HD1 LEU 38 3HD1 LEU 38 8.540 -4.814 2.939
203 1HD2 LEU 38 1HD2 LEU 38 9.985 -5.620 5.311
204 2HD2 LEU 38 2HD2 LEU 38 9.534 -3.938 5.595
205 3HD2 LEU 38 3HD2 LEU 38 11.225 -4.427 5.701
206 H GLY 39 H GLY 39 13.299 -6.252 0.467
207 1HA GLY 39 1HA GLY 39 14.360 -8.132 -0.336
208 2HA GLY 39 2HA GLY 39 14.793 -8.532 1.319
209 H LEU 40 H LEU 40 11.494 -8.008 0.287
210 HA LEU 40 HA LEU 40 10.977 -10.879 0.703
211 1HB LEU 40 1HB LEU 40 8.554 -9.919 1.098
212 2HB LEU 40 2HB LEU 40 9.738 -9.975 2.391
213 HG LEU 40 HG LEU 40 10.295 -7.548 1.718
214 1HD1 LEU 40 1HD1 LEU 40 8.725 -6.322 0.503
215 2HD1 LEU 40 2HD1 LEU 40 7.505 -7.591 0.621
216 3HD1 LEU 40 3HD1 LEU 40 8.909 -7.812 -0.424
217 1HD2 LEU 40 1HD2 LEU 40 7.974 -8.601 3.218
218 2HD2 LEU 40 2HD2 LEU 40 7.994 -6.868 2.888
219 3HD2 LEU 40 3HD2 LEU 40 9.329 -7.615 3.765
220 H ASN 41 H ASN 41 9.203 -11.804 -0.525
221 HA ASN 41 HA ASN 41 9.259 -10.863 -3.265
222 1HB ASN 41 1HB ASN 41 9.291 -13.359 -2.223
223 2HB ASN 41 2HB ASN 41 7.568 -13.186 -2.547
224 1HD2 ASN 41 1HD2 ASN 41 6.977 -12.501 -4.741
225 2HD2 ASN 41 2HD2 ASN 41 7.934 -13.066 -6.064
226 H GLU 42 H GLU 42 7.324 -10.571 -4.529
227 HA GLU 42 HA GLU 42 5.488 -8.797 -3.464
228 1HB GLU 42 1HB GLU 42 5.063 -10.688 -5.788
229 2HB GLU 42 2HB GLU 42 4.146 -9.219 -5.479
230 1HG GLU 42 1HG GLU 42 5.586 -8.213 -6.841
231 2HG GLU 42 2HG GLU 42 6.739 -8.319 -5.511
232 H ALA 43 H ALA 43 5.478 -12.281 -3.476
233 HA ALA 43 HA ALA 43 2.774 -12.779 -2.929
234 1HB ALA 43 1HB ALA 43 3.796 -14.829 -1.668
235 2HB ALA 43 2HB ALA 43 5.310 -14.262 -2.371
236 3HB ALA 43 3HB ALA 43 3.961 -14.701 -3.420
237 H GLN 44 H GLN 44 5.454 -11.837 -0.889
238 HA GLN 44 HA GLN 44 3.973 -12.033 1.581
239 1HB GLN 44 1HB GLN 44 6.652 -10.885 0.817
240 2HB GLN 44 2HB GLN 44 5.998 -10.717 2.439
241 1HG GLN 44 1HG GLN 44 6.471 -13.350 1.064
242 2HG GLN 44 2HG GLN 44 7.599 -12.588 2.187
243 1HE2 GLN 44 1HE2 GLN 44 6.069 -11.679 4.169
244 2HE2 GLN 44 2HE2 GLN 44 5.221 -12.968 4.947
245 H ILE 45 H ILE 45 4.652 -9.722 -0.881
246 HA ILE 45 HA ILE 45 4.039 -7.337 0.483
247 HB ILE 45 HB ILE 45 3.966 -8.051 -2.447
248 1HG1 ILE 45 1HG1 ILE 45 6.163 -8.036 -1.208
249 2HG1 ILE 45 2HG1 ILE 45 6.075 -6.931 -2.577
250 1HG2 ILE 45 1HG2 ILE 45 3.699 -5.769 -3.020
251 2HG2 ILE 45 2HG2 ILE 45 3.826 -5.265 -1.338
252 3HG2 ILE 45 3HG2 ILE 45 2.410 -6.160 -1.883
253 1HD1 ILE 45 1HD1 ILE 45 5.951 -6.268 0.344
254 2HD1 ILE 45 2HD1 ILE 45 5.517 -5.119 -0.920
255 3HD1 ILE 45 3HD1 ILE 45 7.154 -5.772 -0.846
256 H LYS 46 H LYS 46 2.035 -9.631 -1.336
257 HA LYS 46 HA LYS 46 -0.322 -8.133 -1.448
258 1HB LYS 46 1HB LYS 46 0.196 -10.376 -2.570
259 2HB LYS 46 2HB LYS 46 -0.243 -11.121 -1.040
260 1HG LYS 46 1HG LYS 46 -2.431 -9.728 -1.318
261 2HG LYS 46 2HG LYS 46 -1.959 -9.700 -3.018
262 1HD LYS 46 1HD LYS 46 -2.276 -11.948 -3.282
263 2HD LYS 46 2HD LYS 46 -1.895 -12.311 -1.598
264 1HE LYS 46 1HE LYS 46 -4.350 -10.736 -2.175
265 2HE LYS 46 2HE LYS 46 -4.367 -12.460 -2.543
266 1HZ LYS 46 1HZ LYS 46 -3.561 -12.796 -0.198
267 2HZ LYS 46 2HZ LYS 46 -5.153 -12.244 -0.353
268 3HZ LYS 46 3HZ LYS 46 -3.925 -11.167 0.085
269 H ILE 47 H ILE 47 0.776 -10.481 0.958
270 HA ILE 47 HA ILE 47 -1.403 -10.098 2.755
271 HB ILE 47 HB ILE 47 1.185 -11.524 2.769
272 1HG1 ILE 47 1HG1 ILE 47 -1.320 -12.406 4.153
273 2HG1 ILE 47 2HG1 ILE 47 -1.277 -12.358 2.394
274 1HG2 ILE 47 1HG2 ILE 47 1.567 -10.296 4.781
275 2HG2 ILE 47 2HG2 ILE 47 1.079 -11.930 5.233
276 3HG2 ILE 47 3HG2 ILE 47 -0.077 -10.604 5.346
277 1HD1 ILE 47 1HD1 ILE 47 0.966 -13.727 3.739
278 2HD1 ILE 47 2HD1 ILE 47 0.116 -14.127 2.247
279 3HD1 ILE 47 3HD1 ILE 47 -0.612 -14.511 3.806
280 H TRP 48 H TRP 48 1.864 -8.864 2.517
281 HA TRP 48 HA TRP 48 2.079 -7.417 4.872
282 1HB TRP 48 1HB TRP 48 3.936 -7.869 3.341
283 2HB TRP 48 2HB TRP 48 3.192 -6.865 2.112
284 HD1 TRP 48 HD1 TRP 48 5.716 -6.769 4.774
285 HE1 TRP 48 HE1 TRP 48 6.513 -4.360 5.150
286 HE3 TRP 48 HE3 TRP 48 2.081 -4.244 2.232
287 HZ2 TRP 48 HZ2 TRP 48 5.732 -1.752 4.498
288 HZ3 TRP 48 HZ3 TRP 48 2.175 -1.797 2.161
289 HH2 TRP 48 HH2 TRP 48 3.971 -0.578 3.260
290 H PHE 49 H PHE 49 0.960 -6.364 1.689
291 HA PHE 49 HA PHE 49 0.226 -3.763 2.581
292 1HB PHE 49 1HB PHE 49 -0.094 -5.297 0.055
293 2HB PHE 49 2HB PHE 49 -1.157 -3.909 0.316
294 HD1 PHE 49 HD1 PHE 49 -0.286 -1.682 0.438
295 HD2 PHE 49 HD2 PHE 49 2.295 -5.008 -0.107
296 HE1 PHE 49 HE1 PHE 49 1.576 -0.147 -0.094
297 HE2 PHE 49 HE2 PHE 49 4.158 -3.496 -0.644
298 HZ PHE 49 HZ PHE 49 3.809 -1.070 -0.615
299 H GLN 50 H GLN 50 -1.532 -6.753 2.050
300 HA GLN 50 HA GLN 50 -4.090 -5.739 2.532
301 1HB GLN 50 1HB GLN 50 -2.822 -8.422 2.530
302 2HB GLN 50 2HB GLN 50 -4.335 -8.283 3.413
303 1HG GLN 50 1HG GLN 50 -4.550 -9.030 1.048
304 2HG GLN 50 2HG GLN 50 -5.512 -7.614 1.473
305 1HE2 GLN 50 1HE2 GLN 50 -4.131 -8.770 -1.039
306 2HE2 GLN 50 2HE2 GLN 50 -3.382 -7.382 -1.746
307 H ASN 51 H ASN 51 -1.502 -6.707 4.681
308 HA ASN 51 HA ASN 51 -3.100 -6.813 7.048
309 1HB ASN 51 1HB ASN 51 -0.651 -7.740 6.480
310 2HB ASN 51 2HB ASN 51 -0.193 -6.221 7.244
311 1HD2 ASN 51 1HD2 ASN 51 0.147 -9.018 8.102
312 2HD2 ASN 51 2HD2 ASN 51 -0.575 -9.110 9.669
313 H LYS 52 H LYS 52 -1.160 -4.345 5.454
314 HA LYS 52 HA LYS 52 -1.302 -2.438 7.555
315 1HB LYS 52 1HB LYS 52 -0.939 -1.805 4.630
316 2HB LYS 52 2HB LYS 52 -0.357 -0.891 6.015
317 1HG LYS 52 1HG LYS 52 0.695 -3.548 6.123
318 2HG LYS 52 2HG LYS 52 1.006 -2.850 4.533
319 1HD LYS 52 1HD LYS 52 2.405 -1.262 5.354
320 2HD LYS 52 2HD LYS 52 1.509 -1.103 6.867
321 1HE LYS 52 1HE LYS 52 3.210 -3.494 6.189
322 2HE LYS 52 2HE LYS 52 3.819 -2.089 7.065
323 1HZ LYS 52 1HZ LYS 52 1.449 -3.610 7.979
324 2HZ LYS 52 2HZ LYS 52 2.391 -2.513 8.857
325 3HZ LYS 52 3HZ LYS 52 3.022 -4.028 8.445
326 H ARG 53 H ARG 53 -3.265 -3.071 4.692
327 HA ARG 53 HA ARG 53 -4.869 -0.780 4.771
328 1HB ARG 53 1HB ARG 53 -4.786 -2.413 2.893
329 2HB ARG 53 2HB ARG 53 -5.695 -3.548 3.880
330 1HG ARG 53 1HG ARG 53 -7.514 -2.679 2.945
331 2HG ARG 53 2HG ARG 53 -7.238 -1.275 3.976
332 1HD ARG 53 1HD ARG 53 -5.630 -0.566 2.019
333 2HD ARG 53 2HD ARG 53 -6.648 -1.656 1.080
334 HE ARG 53 HE ARG 53 -7.355 0.933 2.090
335 1HH1 ARG 53 1HH1 ARG 53 -8.602 -2.175 1.106
336 2HH1 ARG 53 2HH1 ARG 53 -10.174 -1.562 0.719
337 1HH2 ARG 53 1HH2 ARG 53 -9.424 1.741 1.583
338 2HH2 ARG 53 2HH2 ARG 53 -10.642 0.661 0.992
339 H ALA 54 H ALA 54 -4.967 -3.717 6.650
340 HA ALA 54 HA ALA 54 -7.597 -3.240 7.716
341 1HB ALA 54 1HB ALA 54 -7.189 -5.480 7.773
342 2HB ALA 54 2HB ALA 54 -6.658 -5.059 9.401
343 3HB ALA 54 3HB ALA 54 -5.471 -5.273 8.114
344 H LYS 55 H LYS 55 -4.271 -2.746 8.791
345 HA LYS 55 HA LYS 55 -4.834 -2.006 11.442
346 1HB LYS 55 1HB LYS 55 -2.581 -2.579 10.694
347 2HB LYS 55 2HB LYS 55 -2.546 -1.162 9.654
348 1HG LYS 55 1HG LYS 55 -3.124 -0.097 12.119
349 2HG LYS 55 2HG LYS 55 -2.008 -1.409 12.501
350 1HD LYS 55 1HD LYS 55 -0.953 -0.114 10.238
351 2HD LYS 55 2HD LYS 55 -1.464 1.164 11.343
352 1HE LYS 55 1HE LYS 55 -0.138 0.227 13.119
353 2HE LYS 55 2HE LYS 55 0.267 -1.175 12.131
354 1HZ LYS 55 1HZ LYS 55 1.181 1.618 11.809
355 2HZ LYS 55 2HZ LYS 55 1.292 0.499 10.546
356 3HZ LYS 55 3HZ LYS 55 2.115 0.220 11.996
357 H ILE 56 H ILE 56 -3.706 0.267 8.944
358 HA ILE 56 HA ILE 56 -4.204 2.451 8.541
359 HB ILE 56 HB ILE 56 -6.920 1.839 9.699
360 1HG1 ILE 56 1HG1 ILE 56 -5.912 1.428 6.875
361 2HG1 ILE 56 2HG1 ILE 56 -6.327 0.153 8.016
362 1HG2 ILE 56 1HG2 ILE 56 -6.654 4.170 9.354
363 2HG2 ILE 56 2HG2 ILE 56 -7.609 3.567 8.000
364 3HG2 ILE 56 3HG2 ILE 56 -5.895 3.920 7.782
365 1HD1 ILE 56 1HD1 ILE 56 -8.288 2.208 7.039
366 2HD1 ILE 56 2HD1 ILE 56 -8.626 0.733 7.946
367 3HD1 ILE 56 3HD1 ILE 56 -8.052 0.633 6.281
368 H LYS 57 H LYS 57 -2.981 3.676 9.863
369 HA LYS 57 HA LYS 57 -2.400 5.037 11.588
370 1HB LYS 57 1HB LYS 57 -5.060 5.505 11.163
371 2HB LYS 57 2HB LYS 57 -5.052 5.072 12.867
372 1HG LYS 57 1HG LYS 57 -2.924 6.924 12.251
373 2HG LYS 57 2HG LYS 57 -4.496 7.559 11.760
374 1HD LYS 57 1HD LYS 57 -4.433 6.284 14.411
375 2HD LYS 57 2HD LYS 57 -3.476 7.759 14.266
376 1HE LYS 57 1HE LYS 57 -6.335 7.584 13.351
377 2HE LYS 57 2HE LYS 57 -5.893 8.031 14.998
378 1HZ LYS 57 1HZ LYS 57 -4.347 9.686 13.607
379 2HZ LYS 57 2HZ LYS 57 -5.908 10.087 14.119
380 3HZ LYS 57 3HZ LYS 57 -5.649 9.549 12.535
381 H LYS 58 H LYS 58 -2.735 5.244 14.146
382 HA LYS 58 HA LYS 58 -2.341 4.298 16.176
383 1HB LYS 58 1HB LYS 58 -3.901 1.959 15.060
384 2HB LYS 58 2HB LYS 58 -3.556 2.259 16.758
385 1HG LYS 58 1HG LYS 58 -4.833 4.547 15.580
386 2HG LYS 58 2HG LYS 58 -5.786 3.091 15.298
387 1HD LYS 58 1HD LYS 58 -4.719 3.338 18.019
388 2HD LYS 58 2HD LYS 58 -5.870 4.598 17.568
389 1HE LYS 58 1HE LYS 58 -7.327 2.649 16.715
390 2HE LYS 58 2HE LYS 58 -6.273 1.631 17.695
391 1HZ LYS 58 1HZ LYS 58 -6.834 3.167 19.589
392 2HZ LYS 58 2HZ LYS 58 -8.098 2.185 19.045
393 3HZ LYS 58 3HZ LYS 58 -8.049 3.817 18.608
394 H SER 59 H SER 59 -0.153 4.057 16.145
395 HA SER 59 HA SER 59 1.874 3.027 16.096
396 1HB SER 59 1HB SER 59 1.971 0.805 16.832
397 2HB SER 59 2HB SER 59 0.419 1.362 17.455
398 HG SER 59 HG SER 59 0.980 -0.515 15.508