Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
11425 | 1rhw RC | 6096 | cing | 1-original | 6 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 1H MET 1 H MET 1 -13.215 19.737 -12.667
2 HA MET 1 HA MET 1 -13.825 18.270 -14.453
3 1HB MET 1 1HB MET 1 -10.988 17.620 -14.147
4 2HB MET 1 2HB MET 1 -11.929 16.147 -14.021
5 1HG MET 1 1HG MET 1 -12.841 17.914 -16.221
6 2HG MET 1 2HG MET 1 -11.178 17.394 -16.407
7 1HE MET 1 1HE MET 1 -12.198 16.740 -18.452
8 2HE MET 1 2HE MET 1 -11.923 14.992 -18.640
9 3HE MET 1 3HE MET 1 -13.581 15.639 -18.656
10 H SER 2 H SER 2 -13.967 15.530 -13.996
11 HA SER 2 HA SER 2 -15.189 15.546 -11.378
12 1HB SER 2 1HB SER 2 -15.512 13.923 -13.892
13 2HB SER 2 2HB SER 2 -15.939 13.159 -12.373
14 HG SER 2 HG SER 2 -17.788 14.205 -13.232
15 H ASP 3 H ASP 3 -13.178 15.398 -10.137
16 HA ASP 3 HA ASP 3 -11.220 13.551 -10.593
17 1HB ASP 3 1HB ASP 3 -12.188 14.435 -7.839
18 2HB ASP 3 2HB ASP 3 -10.568 13.918 -8.263
19 HD2 ASP 3 HD ASP 3 -9.287 15.346 -9.264
20 H ARG 4 H ARG 4 -10.948 12.010 -8.190
21 HA ARG 4 HA ARG 4 -13.387 10.479 -8.019
22 1HB ARG 4 1HB ARG 4 -10.716 9.456 -9.031
23 2HB ARG 4 2HB ARG 4 -11.763 8.364 -8.148
24 1HG ARG 4 1HG ARG 4 -13.544 8.595 -9.759
25 2HG ARG 4 2HG ARG 4 -12.798 9.995 -10.501
26 1HD ARG 4 1HD ARG 4 -10.774 8.295 -10.938
27 2HD ARG 4 2HD ARG 4 -12.024 7.082 -10.748
28 HE ARG 4 HE ARG 4 -12.973 7.752 -12.788
29 1HH1 ARG 4 2HH2 ARG 4 -10.655 10.210 -11.722
30 2HH1 ARG 4 1HH2 ARG 4 -10.716 11.092 -13.211
31 1HH2 ARG 4 1HH ARG 4 -12.133 10.313 -14.980
32 H LYS 5 H LYS 5 -10.032 9.534 -7.086
33 HA LYS 5 HA LYS 5 -10.073 10.593 -4.509
34 1HB LYS 5 1HB LYS 5 -11.950 8.646 -4.607
35 2HB LYS 5 2HB LYS 5 -10.546 7.673 -4.216
36 1HG LYS 5 1HG LYS 5 -10.914 8.298 -2.056
37 2HG LYS 5 2HG LYS 5 -10.208 9.836 -2.509
38 1HD LYS 5 1HD LYS 5 -12.822 10.156 -3.384
39 2HD LYS 5 2HD LYS 5 -13.052 9.146 -1.971
40 1HE LYS 5 1HE LYS 5 -12.156 10.752 -0.495
41 2HE LYS 5 2HE LYS 5 -11.205 11.530 -1.746
42 1HZ LYS 5 1HZ LYS 5 -13.549 12.085 -2.723
43 H ALA 6 H ALA 6 -8.699 8.258 -3.278
44 HA ALA 6 HA ALA 6 -6.125 8.810 -4.005
45 1HB ALA 6 1HB ALA 6 -6.351 7.693 -1.985
46 2HB ALA 6 2HB ALA 6 -5.793 6.364 -3.030
47 3HB ALA 6 3HB ALA 6 -7.522 6.523 -2.639
48 H VAL 7 H VAL 7 -5.067 8.569 -5.904
49 HA VAL 7 HA VAL 7 -6.128 6.853 -7.919
50 HB VAL 7 HB VAL 7 -3.556 8.439 -7.778
51 1HG1 VAL 7 1HG1 VAL 7 -3.314 6.822 -9.506
52 2HG1 VAL 7 2HG1 VAL 7 -3.762 8.347 -10.308
53 3HG1 VAL 7 3HG1 VAL 7 -4.982 7.073 -10.075
54 1HG2 VAL 7 1HG2 VAL 7 -4.666 10.301 -8.449
55 2HG2 VAL 7 2HG2 VAL 7 -6.039 9.502 -7.646
56 3HG2 VAL 7 3HG2 VAL 7 -5.849 9.384 -9.412
57 H ILE 8 H ILE 8 -4.626 5.258 -9.097
58 HA ILE 8 HA ILE 8 -2.816 3.936 -7.227
59 HB ILE 8 HB ILE 8 -5.349 2.846 -8.341
60 1HG1 ILE 8 1HG1 ILE 8 -4.884 1.478 -6.089
61 2HG1 ILE 8 2HG1 ILE 8 -3.859 2.860 -5.752
62 1HG2 ILE 8 1HG2 ILE 8 -2.786 1.261 -8.098
63 2HG2 ILE 8 2HG2 ILE 8 -3.875 1.404 -9.499
64 3HG2 ILE 8 3HG2 ILE 8 -4.402 0.515 -8.049
65 1HD1 ILE 8 1HD1 ILE 8 -6.464 2.872 -5.126
66 2HD1 ILE 8 2HD1 ILE 8 -6.622 3.409 -6.816
67 3HD1 ILE 8 3HD1 ILE 8 -5.641 4.354 -5.669
68 H LYS 9 H LYS 9 -0.913 3.456 -8.195
69 HA LYS 9 HA LYS 9 -0.780 3.845 -11.067
70 1HB LYS 9 1HB LYS 9 1.254 3.715 -8.845
71 2HB LYS 9 2HB LYS 9 1.742 3.586 -10.523
72 1HG LYS 9 1HG LYS 9 1.099 5.782 -11.034
73 2HG LYS 9 2HG LYS 9 -0.130 5.831 -9.784
74 1HD LYS 9 1HD LYS 9 2.434 5.438 -8.504
75 2HD LYS 9 2HD LYS 9 2.592 6.763 -9.640
76 1HE LYS 9 1HE LYS 9 0.076 6.873 -8.076
77 2HE LYS 9 2HE LYS 9 1.511 6.950 -7.073
78 1HZ LYS 9 1HZ LYS 9 1.717 9.078 -7.708
79 H ASN 10 H ASN 10 1.129 1.547 -9.057
80 HA ASN 10 HA ASN 10 0.273 -0.503 -10.940
81 1HB ASN 10 1HB ASN 10 2.845 0.310 -10.341
82 2HB ASN 10 2HB ASN 10 2.653 -0.992 -9.182
83 1HD2 ASN 10 2HD2 ASN 10 2.295 -3.097 -9.869
84 2HD2 ASN 10 1HD2 ASN 10 2.632 -3.633 -11.482
85 H ALA 11 H ALA 11 -0.457 -2.542 -10.056
86 HA ALA 11 HA ALA 11 -0.405 -2.839 -7.164
87 1HB ALA 11 1HB ALA 11 -3.040 -3.524 -8.141
88 2HB ALA 11 2HB ALA 11 -2.669 -1.831 -8.549
89 3HB ALA 11 3HB ALA 11 -2.581 -2.379 -6.857
90 H ASP 12 H ASP 12 -1.474 -4.148 -10.371
91 HA ASP 12 HA ASP 12 -1.587 -6.193 -11.126
92 1HB ASP 12 1HB ASP 12 1.113 -5.914 -9.874
93 2HB ASP 12 2HB ASP 12 0.644 -7.558 -10.259
94 HD2 ASP 12 HD ASP 12 0.359 -7.825 -12.930
95 H MET 13 H MET 13 -3.448 -6.622 -9.538
96 HA MET 13 HA MET 13 -2.988 -9.045 -8.206
97 1HB MET 13 1HB MET 13 -2.540 -6.646 -6.676
98 2HB MET 13 2HB MET 13 -4.071 -7.295 -6.124
99 1HG MET 13 1HG MET 13 -2.831 -9.596 -5.982
100 2HG MET 13 2HG MET 13 -1.353 -8.665 -6.121
101 1HE MET 13 1HE MET 13 -0.853 -6.957 -2.869
102 2HE MET 13 2HE MET 13 -0.202 -7.615 -4.389
103 3HE MET 13 3HE MET 13 -1.273 -6.194 -4.420
104 H SER 14 H SER 14 -5.164 -9.360 -6.608
105 HA SER 14 HA SER 14 -7.285 -8.942 -8.503
106 1HB SER 14 1HB SER 14 -6.900 -11.181 -7.450
107 2HB SER 14 2HB SER 14 -7.248 -10.494 -5.876
108 HG SER 14 HG SER 14 -9.359 -9.771 -7.165
109 H GLU 15 H GLU 15 -9.186 -7.723 -8.084
110 HA GLU 15 HA GLU 15 -8.946 -5.486 -6.596
111 1HB GLU 15 1HB GLU 15 -10.836 -6.520 -8.298
112 2HB GLU 15 2HB GLU 15 -11.715 -6.579 -6.784
113 1HG GLU 15 1HG GLU 15 -11.882 -4.295 -6.637
114 2HG GLU 15 2HG GLU 15 -10.236 -4.039 -7.183
115 HE2 GLU 15 HE GLU 15 -13.424 -4.335 -8.101
116 H GLU 16 H GLU 16 -9.564 -8.736 -5.491
117 HA GLU 16 HA GLU 16 -11.024 -8.202 -3.213
118 1HB GLU 16 1HB GLU 16 -9.210 -10.412 -4.139
119 2HB GLU 16 2HB GLU 16 -9.631 -10.381 -2.438
120 1HG GLU 16 1HG GLU 16 -11.618 -10.375 -4.759
121 2HG GLU 16 2HG GLU 16 -11.241 -11.754 -3.745
122 HE2 GLU 16 HE GLU 16 -14.242 -10.128 -2.506
123 H MET 17 H MET 17 -7.443 -8.840 -3.451
124 HA MET 17 HA MET 17 -7.081 -7.743 -0.851
125 1HB MET 17 1HB MET 17 -4.886 -8.349 -2.885
126 2HB MET 17 2HB MET 17 -4.788 -8.464 -1.140
127 1HG MET 17 1HG MET 17 -6.266 -10.320 -3.050
128 2HG MET 17 2HG MET 17 -4.970 -10.730 -1.943
129 1HE MET 17 1HE MET 17 -6.592 -12.758 -0.325
130 2HE MET 17 2HE MET 17 -8.262 -12.517 -0.893
131 3HE MET 17 3HE MET 17 -6.914 -12.489 -2.055
132 H GLN 18 H GLN 18 -6.806 -6.650 -4.220
133 HA GLN 18 HA GLN 18 -5.148 -4.466 -3.705
134 1HB GLN 18 1HB GLN 18 -5.673 -5.541 -5.963
135 2HB GLN 18 2HB GLN 18 -7.217 -4.713 -5.927
136 1HG GLN 18 1HG GLN 18 -5.013 -2.870 -5.314
137 2HG GLN 18 2HG GLN 18 -4.759 -3.668 -6.853
138 1HE2 GLN 18 2HE2 GLN 18 -5.130 -1.893 -8.094
139 2HE2 GLN 18 1HE2 GLN 18 -6.680 -1.147 -8.298
140 H GLN 19 H GLN 19 -8.743 -4.847 -3.910
141 HA GLN 19 HA GLN 19 -9.210 -2.117 -3.425
142 1HB GLN 19 1HB GLN 19 -10.764 -3.850 -4.547
143 2HB GLN 19 2HB GLN 19 -11.168 -4.393 -2.930
144 1HG GLN 19 1HG GLN 19 -11.614 -1.617 -4.110
145 2HG GLN 19 2HG GLN 19 -12.838 -2.760 -3.593
146 1HE2 GLN 19 2HE2 GLN 19 -11.403 0.013 -2.799
147 2HE2 GLN 19 1HE2 GLN 19 -11.508 0.001 -1.070
148 H ASP 20 H ASP 20 -9.253 -5.104 -1.383
149 HA ASP 20 HA ASP 20 -10.165 -3.893 0.912
150 1HB ASP 20 1HB ASP 20 -9.831 -6.394 0.404
151 2HB ASP 20 2HB ASP 20 -8.132 -6.163 0.767
152 HD2 ASP 20 HD ASP 20 -10.716 -7.316 1.973
153 H ALA 21 H ALA 21 -6.828 -4.459 -0.393
154 HA ALA 21 HA ALA 21 -5.445 -3.441 1.820
155 1HB ALA 21 1HB ALA 21 -4.429 -4.874 0.103
156 2HB ALA 21 2HB ALA 21 -3.551 -3.331 0.218
157 3HB ALA 21 3HB ALA 21 -4.684 -3.611 -1.125
158 H VAL 22 H VAL 22 -6.105 -1.905 -1.416
159 HA VAL 22 HA VAL 22 -5.189 0.602 -0.748
160 HB VAL 22 HB VAL 22 -6.047 -0.532 -2.969
161 1HG1 VAL 22 1HG1 VAL 22 -8.479 -0.245 -1.829
162 2HG1 VAL 22 2HG1 VAL 22 -8.211 -0.232 -3.588
163 3HG1 VAL 22 3HG1 VAL 22 -8.371 1.303 -2.702
164 1HG2 VAL 22 1HG2 VAL 22 -5.583 1.449 -4.011
165 2HG2 VAL 22 2HG2 VAL 22 -4.981 1.849 -2.384
166 3HG2 VAL 22 3HG2 VAL 22 -6.593 2.403 -2.898
167 H ASP 23 H ASP 23 -8.124 -1.088 0.222
168 HA ASP 23 HA ASP 23 -9.680 1.122 0.800
169 1HB ASP 23 1HB ASP 23 -9.739 -1.732 1.219
170 2HB ASP 23 2HB ASP 23 -10.130 -0.968 2.747
171 HD2 ASP 23 HD ASP 23 -12.674 -1.744 2.207
172 H CYS 24 H CYS 24 -7.808 -1.060 3.059
173 HA CYS 24 HA CYS 24 -8.052 0.575 5.276
174 1HB CYS 24 1HB CYS 24 -6.152 -1.633 4.513
175 2HB CYS 24 2HB CYS 24 -5.884 -0.720 5.985
176 HG CYS 24 HG CYS 24 -8.704 -2.181 5.031
177 H ALA 25 H ALA 25 -5.986 0.699 2.412
178 HA ALA 25 HA ALA 25 -3.915 2.270 3.488
179 1HB ALA 25 1HB ALA 25 -3.160 2.387 1.278
180 2HB ALA 25 2HB ALA 25 -4.809 2.398 0.607
181 3HB ALA 25 3HB ALA 25 -4.124 0.891 1.262
182 H THR 26 H THR 26 -6.451 3.324 1.107
183 HA THR 26 HA THR 26 -6.134 6.023 1.517
184 HB THR 26 HB THR 26 -7.428 4.842 -0.318
185 HG1 THR 26 HG1 THR 26 -8.797 6.785 1.409
186 1HG2 THR 26 1HG2 THR 26 -9.763 4.244 0.084
187 2HG2 THR 26 2HG2 THR 26 -9.659 4.788 1.775
188 3HG2 THR 26 3HG2 THR 26 -8.777 3.333 1.253
189 H GLN 27 H GLN 27 -8.450 3.803 3.201
190 HA GLN 27 HA GLN 27 -9.620 5.729 4.742
191 1HB GLN 27 1HB GLN 27 -9.070 2.789 5.322
192 2HB GLN 27 2HB GLN 27 -10.086 3.786 6.344
193 1HG GLN 27 1HG GLN 27 -10.858 4.123 3.548
194 2HG GLN 27 2HG GLN 27 -10.842 2.419 3.959
195 1HE2 GLN 27 2HE2 GLN 27 -13.168 2.757 3.525
196 2HE2 GLN 27 1HE2 GLN 27 -14.205 3.215 4.834
197 H ALA 28 H ALA 28 -6.666 3.741 5.397
198 HA ALA 28 HA ALA 28 -6.164 4.555 7.965
199 1HB ALA 28 1HB ALA 28 -4.856 2.810 7.059
200 2HB ALA 28 2HB ALA 28 -3.710 4.161 7.229
201 3HB ALA 28 3HB ALA 28 -4.397 3.771 5.634
202 H LEU 29 H LEU 29 -5.036 6.088 4.869
203 HA LEU 29 HA LEU 29 -3.801 8.250 6.180
204 1HB LEU 29 1HB LEU 29 -3.203 7.478 3.947
205 2HB LEU 29 2HB LEU 29 -4.781 7.937 3.340
206 HG LEU 29 HG LEU 29 -3.366 10.152 4.650
207 1HD1 LEU 29 1HD1 LEU 29 -1.535 8.670 3.531
208 2HD1 LEU 29 2HD1 LEU 29 -1.545 10.428 3.256
209 3HD1 LEU 29 3HD1 LEU 29 -2.189 9.330 2.013
210 1HD2 LEU 29 1HD2 LEU 29 -4.081 11.360 2.659
211 2HD2 LEU 29 2HD2 LEU 29 -5.426 10.417 3.344
212 3HD2 LEU 29 3HD2 LEU 29 -4.581 9.834 1.890
213 H GLU 30 H GLU 30 -7.127 7.496 5.289
214 HA GLU 30 HA GLU 30 -7.934 10.230 5.516
215 1HB GLU 30 1HB GLU 30 -8.964 7.987 4.231
216 2HB GLU 30 2HB GLU 30 -10.047 8.159 5.599
217 1HG GLU 30 1HG GLU 30 -9.657 10.802 4.617
218 2HG GLU 30 2HG GLU 30 -9.850 9.803 3.189
219 HE2 GLU 30 HE GLU 30 -11.643 11.661 4.731
220 H LYS 31 H LYS 31 -6.840 8.117 7.752
221 HA LYS 31 HA LYS 31 -8.733 9.099 9.769
222 1HB LYS 31 1HB LYS 31 -9.317 6.844 9.636
223 2HB LYS 31 2HB LYS 31 -7.672 6.318 9.341
224 1HG LYS 31 1HG LYS 31 -7.033 6.922 11.664
225 2HG LYS 31 2HG LYS 31 -8.645 7.537 11.969
226 1HD LYS 31 1HD LYS 31 -9.545 5.207 11.415
227 2HD LYS 31 2HD LYS 31 -7.886 4.645 11.352
228 1HE LYS 31 1HE LYS 31 -7.603 5.593 13.735
229 2HE LYS 31 2HE LYS 31 -9.340 5.822 13.762
230 1HZ LYS 31 1HZ LYS 31 -8.854 3.678 14.687
231 H TYR 32 H TYR 32 -5.405 8.024 8.921
232 HA TYR 32 HA TYR 32 -4.437 9.366 11.339
233 1HB TYR 32 1HB TYR 32 -3.546 7.226 9.368
234 2HB TYR 32 2HB TYR 32 -2.281 8.144 10.160
235 HD1 TYR 32 HD1 TYR 32 -3.098 8.474 12.887
236 HD2 TYR 32 HD2 TYR 32 -3.738 5.119 10.310
237 HE1 TYR 32 HE1 TYR 32 -3.263 6.943 14.910
238 HE2 TYR 32 HE2 TYR 32 -3.900 3.600 12.343
239 HH TYR 32 HH TYR 32 -4.410 3.736 14.653
240 H ASN 33 H ASN 33 -2.375 10.651 11.104
241 HA ASN 33 HA ASN 33 -2.476 12.083 8.566
242 1HB ASN 33 1HB ASN 33 -3.140 13.578 10.365
243 2HB ASN 33 2HB ASN 33 -1.847 13.017 11.406
244 1HD2 ASN 33 2HD2 ASN 33 -0.767 14.854 11.738
245 2HD2 ASN 33 1HD2 ASN 33 0.020 15.802 10.519
246 H ILE 34 H ILE 34 -0.570 10.399 11.043
247 HA ILE 34 HA ILE 34 1.964 11.258 10.002
248 HB ILE 34 HB ILE 34 1.254 9.117 12.012
249 1HG1 ILE 34 1HG1 ILE 34 2.318 11.143 13.460
250 2HG1 ILE 34 2HG1 ILE 34 1.527 12.070 12.201
251 1HG2 ILE 34 1HG2 ILE 34 3.883 10.353 12.235
252 2HG2 ILE 34 2HG2 ILE 34 3.661 9.503 10.687
253 3HG2 ILE 34 3HG2 ILE 34 3.417 8.635 12.221
254 1HD1 ILE 34 1HD1 ILE 34 0.335 10.709 14.459
255 2HD1 ILE 34 2HD1 ILE 34 -0.309 10.009 12.955
256 3HD1 ILE 34 3HD1 ILE 34 -0.451 11.758 13.255
257 H GLU 35 H GLU 35 1.862 10.687 7.769
258 HA GLU 35 HA GLU 35 1.026 8.484 6.613
259 1HB GLU 35 1HB GLU 35 3.636 9.967 6.116
260 2HB GLU 35 2HB GLU 35 3.054 8.715 5.036
261 1HG GLU 35 1HG GLU 35 1.564 10.133 4.075
262 2HG GLU 35 2HG GLU 35 0.887 10.570 5.631
263 HE2 GLU 35 HE GLU 35 2.538 13.339 6.140
264 H LYS 36 H LYS 36 4.271 8.774 8.218
265 HA LYS 36 HA LYS 36 5.254 6.298 7.719
266 1HB LYS 36 1HB LYS 36 5.944 8.451 9.304
267 2HB LYS 36 2HB LYS 36 5.693 7.184 10.488
268 1HG LYS 36 1HG LYS 36 7.313 6.616 7.985
269 2HG LYS 36 2HG LYS 36 8.058 7.441 9.339
270 1HD LYS 36 1HD LYS 36 6.583 5.177 10.371
271 2HD LYS 36 2HD LYS 36 7.563 4.621 9.028
272 1HE LYS 36 1HE LYS 36 9.597 5.298 10.057
273 2HE LYS 36 2HE LYS 36 8.794 6.426 11.132
274 1HZ LYS 36 1HZ LYS 36 9.441 4.390 12.300
275 H ASP 37 H ASP 37 2.883 7.250 10.271
276 HA ASP 37 HA ASP 37 2.759 4.639 11.308
277 1HB ASP 37 1HB ASP 37 2.092 6.951 12.373
278 2HB ASP 37 2HB ASP 37 0.563 6.726 11.548
279 HD2 ASP 37 HD ASP 37 0.741 5.496 15.027
280 H ILE 38 H ILE 38 1.201 6.470 8.702
281 HA ILE 38 HA ILE 38 -1.140 4.933 8.471
282 HB ILE 38 HB ILE 38 0.349 6.585 6.428
283 1HG1 ILE 38 1HG1 ILE 38 -1.798 7.287 8.441
284 2HG1 ILE 38 2HG1 ILE 38 -0.182 7.953 8.318
285 1HG2 ILE 38 1HG2 ILE 38 -2.589 6.154 6.262
286 2HG2 ILE 38 2HG2 ILE 38 -1.535 4.799 5.788
287 3HG2 ILE 38 3HG2 ILE 38 -1.380 6.375 4.975
288 1HD1 ILE 38 1HD1 ILE 38 -0.737 9.359 6.584
289 2HD1 ILE 38 2HD1 ILE 38 -2.381 9.145 7.232
290 3HD1 ILE 38 3HD1 ILE 38 -1.839 8.174 5.842
291 H ALA 39 H ALA 39 1.989 4.841 6.623
292 HA ALA 39 HA ALA 39 1.295 2.534 5.185
293 1HB ALA 39 1HB ALA 39 3.573 2.584 4.451
294 2HB ALA 39 2HB ALA 39 4.092 3.481 5.898
295 3HB ALA 39 3HB ALA 39 3.083 4.281 4.670
296 H ALA 40 H ALA 40 2.896 3.102 8.348
297 HA ALA 40 HA ALA 40 3.735 0.439 8.711
298 1HB ALA 40 1HB ALA 40 3.925 1.184 11.109
299 2HB ALA 40 2HB ALA 40 3.157 2.720 10.642
300 3HB ALA 40 3HB ALA 40 4.734 2.266 9.950
301 H TYR 41 H TYR 41 0.662 2.164 9.147
302 HA TYR 41 HA TYR 41 -0.497 0.155 10.812
303 1HB TYR 41 1HB TYR 41 -1.363 2.424 10.899
304 2HB TYR 41 2HB TYR 41 -1.331 2.587 9.154
305 HD1 TYR 41 HD1 TYR 41 -3.309 1.650 12.029
306 HD2 TYR 41 HD2 TYR 41 -3.061 1.348 7.769
307 HE1 TYR 41 HE1 TYR 41 -5.777 1.048 11.922
308 HE2 TYR 41 HE2 TYR 41 -5.530 0.747 7.676
309 HH TYR 41 HH TYR 41 -7.617 1.333 10.032
310 H ILE 42 H ILE 42 -0.312 0.840 7.303
311 HA ILE 42 HA ILE 42 -2.362 -0.962 6.579
312 HB ILE 42 HB ILE 42 -0.044 0.144 4.991
313 1HG1 ILE 42 1HG1 ILE 42 -2.833 1.192 4.769
314 2HG1 ILE 42 2HG1 ILE 42 -1.897 1.659 6.175
315 1HG2 ILE 42 1HG2 ILE 42 -1.082 -0.567 3.034
316 2HG2 ILE 42 2HG2 ILE 42 -2.643 -0.847 3.843
317 3HG2 ILE 42 3HG2 ILE 42 -1.281 -1.955 4.131
318 1HD1 ILE 42 1HD1 ILE 42 -0.623 3.087 4.957
319 2HD1 ILE 42 2HD1 ILE 42 -1.752 2.809 3.609
320 3HD1 ILE 42 3HD1 ILE 42 -0.271 1.832 3.744
321 H LYS 43 H LYS 43 1.263 -1.212 6.506
322 HA LYS 43 HA LYS 43 1.288 -3.891 5.729
323 1HB LYS 43 1HB LYS 43 3.337 -3.000 5.389
324 2HB LYS 43 2HB LYS 43 3.211 -1.892 6.740
325 1HG LYS 43 1HG LYS 43 3.448 -4.842 7.339
326 2HG LYS 43 2HG LYS 43 4.882 -3.991 6.803
327 1HD LYS 43 1HD LYS 43 3.750 -2.268 8.732
328 2HD LYS 43 2HD LYS 43 3.508 -3.869 9.401
329 1HE LYS 43 1HE LYS 43 5.662 -3.680 10.140
330 2HE LYS 43 2HE LYS 43 6.109 -4.077 8.493
331 1HZ LYS 43 1HZ LYS 43 5.907 -1.371 9.679
332 H LYS 44 H LYS 44 1.460 -2.343 9.001
333 HA LYS 44 HA LYS 44 1.674 -4.735 10.414
334 1HB LYS 44 1HB LYS 44 2.229 -2.588 11.391
335 2HB LYS 44 2HB LYS 44 0.579 -2.025 11.215
336 1HG LYS 44 1HG LYS 44 -0.179 -3.234 13.028
337 2HG LYS 44 2HG LYS 44 0.856 -4.606 12.684
338 1HD LYS 44 1HD LYS 44 2.087 -3.891 14.469
339 2HD LYS 44 2HD LYS 44 2.734 -2.695 13.362
340 1HE LYS 44 1HE LYS 44 1.980 -1.454 15.273
341 2HE LYS 44 2HE LYS 44 0.780 -1.166 14.029
342 1HZ LYS 44 1HZ LYS 44 -0.288 -3.301 15.175
343 H GLU 45 H GLU 45 -1.171 -2.862 9.246
344 HA GLU 45 HA GLU 45 -3.096 -4.272 10.586
345 1HB GLU 45 1HB GLU 45 -3.741 -2.278 9.455
346 2HB GLU 45 2HB GLU 45 -3.071 -2.814 7.926
347 1HG GLU 45 1HG GLU 45 -5.476 -3.042 7.768
348 2HG GLU 45 2HG GLU 45 -4.812 -4.661 7.871
349 HE2 GLU 45 HE GLU 45 -6.826 -3.035 10.921
350 H PHE 46 H PHE 46 -1.597 -4.912 7.350
351 HA PHE 46 HA PHE 46 -3.150 -7.262 6.945
352 1HB PHE 46 1HB PHE 46 -0.949 -5.661 5.677
353 2HB PHE 46 2HB PHE 46 -0.882 -7.370 5.297
354 HD1 PHE 46 HD1 PHE 46 -1.800 -4.513 3.870
355 HD2 PHE 46 HD2 PHE 46 -3.616 -8.186 4.977
356 HE1 PHE 46 HE1 PHE 46 -3.541 -4.187 2.093
357 HE2 PHE 46 HE2 PHE 46 -5.357 -7.860 3.199
358 HZ PHE 46 HZ PHE 46 -5.299 -5.864 1.779
359 H ASP 47 H ASP 47 0.455 -6.852 7.216
360 HA ASP 47 HA ASP 47 1.241 -9.317 7.467
361 1HB ASP 47 1HB ASP 47 3.161 -8.451 8.385
362 2HB ASP 47 2HB ASP 47 2.375 -6.921 8.052
363 HD2 ASP 47 HD ASP 47 3.975 -7.010 11.032
364 H LYS 48 H LYS 48 -0.615 -7.464 9.905
365 HA LYS 48 HA LYS 48 -0.333 -8.739 12.206
366 1HB LYS 48 1HB LYS 48 -1.927 -6.966 11.929
367 2HB LYS 48 2HB LYS 48 -2.912 -7.929 10.846
368 1HG LYS 48 1HG LYS 48 -4.070 -8.709 12.630
369 2HG LYS 48 2HG LYS 48 -2.616 -9.503 13.202
370 1HD LYS 48 1HD LYS 48 -2.748 -8.126 15.010
371 2HD LYS 48 2HD LYS 48 -2.160 -6.860 13.951
372 1HE LYS 48 1HE LYS 48 -4.387 -6.065 13.483
373 2HE LYS 48 2HE LYS 48 -5.129 -7.512 14.134
374 1HZ LYS 48 1HZ LYS 48 -5.288 -6.278 16.010
375 H LYS 49 H LYS 49 -3.001 -9.920 10.060
376 HA LYS 49 HA LYS 49 -2.058 -12.640 10.591
377 1HB LYS 49 1HB LYS 49 -3.838 -12.038 12.229
378 2HB LYS 49 2HB LYS 49 -4.934 -11.730 10.899
379 1HG LYS 49 1HG LYS 49 -5.422 -13.937 10.757
380 2HG LYS 49 2HG LYS 49 -3.740 -14.306 10.432
381 1HD LYS 49 1HD LYS 49 -3.350 -15.017 12.574
382 2HD LYS 49 2HD LYS 49 -4.246 -13.688 13.283
383 1HE LYS 49 1HE LYS 49 -6.379 -14.817 12.899
384 2HE LYS 49 2HE LYS 49 -5.611 -16.060 11.932
385 1HZ LYS 49 1HZ LYS 49 -4.649 -15.697 14.679
386 H TYR 50 H TYR 50 -1.166 -11.972 8.353
387 HA TYR 50 HA TYR 50 -3.132 -12.878 6.393
388 1HB TYR 50 1HB TYR 50 -2.640 -10.224 6.688
389 2HB TYR 50 2HB TYR 50 -1.159 -10.612 5.833
390 HD1 TYR 50 HD1 TYR 50 -1.478 -9.502 3.776
391 HD2 TYR 50 HD2 TYR 50 -4.534 -12.102 5.260
392 HE1 TYR 50 HE1 TYR 50 -2.715 -9.325 1.561
393 HE2 TYR 50 HE2 TYR 50 -5.761 -11.916 3.041
394 HH TYR 50 HH TYR 50 -4.291 -10.347 0.296
395 H ASN 51 H ASN 51 0.264 -11.573 6.455
396 HA ASN 51 HA ASN 51 1.417 -14.076 6.140
397 1HB ASN 51 1HB ASN 51 0.249 -13.277 3.754
398 2HB ASN 51 2HB ASN 51 1.858 -12.606 3.571
399 1HD2 ASN 51 2HD2 ASN 51 2.255 -14.054 1.884
400 2HD2 ASN 51 1HD2 ASN 51 2.653 -15.718 2.157
401 HA PRO 52 HA PRO 52 4.020 -10.435 7.114
402 1HB PRO 52 1HB PRO 52 4.835 -11.205 9.606
403 2HB PRO 52 2HB PRO 52 3.458 -10.157 9.329
404 1HG PRO 52 1HG PRO 52 3.491 -13.015 10.087
405 2HG PRO 52 2HG PRO 52 2.181 -11.859 10.219
406 1HD PRO 52 1HD PRO 52 2.462 -13.916 8.240
407 2HD PRO 52 2HD PRO 52 1.214 -12.687 8.305
408 H THR 53 H THR 53 7.333 -11.409 6.898
409 HA THR 53 HA THR 53 5.298 -9.567 7.934
410 HB THR 53 HB THR 53 7.399 -9.784 9.235
411 HG1 THR 53 HG1 THR 53 7.393 -7.401 7.526
412 1HG2 THR 53 1HG2 THR 53 9.050 -10.441 7.565
413 2HG2 THR 53 2HG2 THR 53 9.504 -8.814 8.123
414 3HG2 THR 53 3HG2 THR 53 8.676 -9.020 6.562
415 H TRP 54 H TRP 54 4.977 -7.483 6.988
416 HA TRP 54 HA TRP 54 5.488 -7.568 4.105
417 1HB TRP 54 1HB TRP 54 3.456 -6.033 5.732
418 2HB TRP 54 2HB TRP 54 3.682 -5.861 4.003
419 HD1 TRP 54 HD TRP 54 2.854 -8.796 6.462
420 HE1 TRP 54 HE1 TRP 54 1.150 -10.475 5.348
421 HE3 TRP 54 HE3 TRP 54 2.633 -6.416 1.974
422 HZ2 TRP 54 HZ2 TRP 54 -0.071 -10.617 2.773
423 HZ3 TRP 54 HZ3 TRP 54 1.161 -7.390 0.214
424 HH2 TRP 54 HH TRP 54 -0.162 -9.417 0.557
425 H HIS 55 H HIS 55 6.351 -5.654 3.055
426 HA HIS 55 HA HIS 55 7.594 -3.782 4.931
427 1HB HIS 55 1HB HIS 55 8.888 -4.828 2.402
428 2HB HIS 55 2HB HIS 55 9.601 -3.752 3.587
429 HD1 HIS 55 HD1 HIS 55 10.640 -6.691 2.702
430 HD2 HIS 55 HD2 HIS 55 8.643 -5.675 6.248
431 HE1 HIS 55 HE1 HIS 55 11.251 -8.489 4.407
432 H CYS 56 H CYS 56 6.811 -1.765 4.620
433 HA CYS 56 HA CYS 56 5.945 -1.115 1.896
434 1HB CYS 56 1HB CYS 56 4.231 0.304 2.800
435 2HB CYS 56 2HB CYS 56 4.075 -1.278 3.538
436 HG CYS 56 HG CYS 56 3.917 -0.333 5.710
437 H ILE 57 H ILE 57 6.386 1.136 1.218
438 HA ILE 57 HA ILE 57 8.312 2.530 2.919
439 HB ILE 57 HB ILE 57 8.713 1.922 -0.013
440 1HG1 ILE 57 1HG1 ILE 57 9.083 0.021 1.635
441 2HG1 ILE 57 2HG1 ILE 57 10.425 0.433 0.587
442 1HG2 ILE 57 1HG2 ILE 57 9.545 4.118 0.455
443 2HG2 ILE 57 2HG2 ILE 57 10.934 3.009 0.359
444 3HG2 ILE 57 3HG2 ILE 57 10.342 3.560 1.945
445 1HD1 ILE 57 1HD1 ILE 57 11.188 0.106 2.922
446 2HD1 ILE 57 2HD1 ILE 57 10.083 1.391 3.467
447 3HD1 ILE 57 3HD1 ILE 57 11.453 1.788 2.402
448 H VAL 58 H VAL 58 8.330 4.825 2.637
449 HA VAL 58 HA VAL 58 6.214 5.836 0.880
450 HB VAL 58 HB VAL 58 6.660 6.601 3.772
451 1HG1 VAL 58 1HG1 VAL 58 4.704 8.047 3.503
452 2HG1 VAL 58 2HG1 VAL 58 4.584 7.589 1.787
453 3HG1 VAL 58 3HG1 VAL 58 5.992 8.510 2.365
454 1HG2 VAL 58 1HG2 VAL 58 5.475 4.350 3.118
455 2HG2 VAL 58 2HG2 VAL 58 4.112 5.419 2.704
456 3HG2 VAL 58 3HG2 VAL 58 4.766 5.410 4.360
457 H GLY 59 H GLY 59 7.654 6.651 -0.651
458 1HA GLY 59 2HA GLY 59 9.494 8.735 0.366
459 2HA GLY 59 1HA GLY 59 9.931 7.618 -0.913
460 H ARG 60 H ARG 60 9.150 7.917 -3.040
461 HA ARG 60 HA ARG 60 7.124 9.879 -3.460
462 1HB ARG 60 1HB ARG 60 9.994 10.506 -3.794
463 2HB ARG 60 2HB ARG 60 9.090 10.773 -5.270
464 1HG ARG 60 1HG ARG 60 8.251 12.701 -4.426
465 2HG ARG 60 2HG ARG 60 7.498 11.813 -3.115
466 1HD ARG 60 1HD ARG 60 8.926 12.867 -1.695
467 2HD ARG 60 2HD ARG 60 10.219 11.902 -2.381
468 HE ARG 60 HE ARG 60 9.538 14.307 -3.941
469 1HH1 ARG 60 2HH2 ARG 60 11.597 12.946 -1.398
470 2HH1 ARG 60 1HH2 ARG 60 12.815 14.167 -1.558
471 1HH2 ARG 60 1HH ARG 60 12.528 15.905 -3.183
472 H ASN 61 H ASN 61 9.704 7.734 -4.789
473 HA ASN 61 HA ASN 61 7.764 6.765 -6.687
474 1HB ASN 61 1HB ASN 61 9.253 8.615 -7.762
475 2HB ASN 61 2HB ASN 61 10.589 7.492 -7.599
476 1HD2 ASN 61 2HD2 ASN 61 10.717 7.633 -9.906
477 2HD2 ASN 61 1HD2 ASN 61 9.709 6.651 -10.915
478 H PHE 62 H PHE 62 8.280 4.542 -7.360
479 HA PHE 62 HA PHE 62 10.673 3.402 -6.132
480 1HB PHE 62 1HB PHE 62 7.990 1.961 -6.113
481 2HB PHE 62 2HB PHE 62 9.346 1.727 -5.028
482 HD1 PHE 62 HD1 PHE 62 9.749 3.336 -3.187
483 HD2 PHE 62 HD2 PHE 62 6.303 3.594 -5.650
484 HE1 PHE 62 HE1 PHE 62 8.642 4.813 -1.485
485 HE2 PHE 62 HE2 PHE 62 5.197 5.071 -3.948
486 HZ PHE 62 HZ PHE 62 6.380 5.662 -1.886
487 H GLY 63 H GLY 63 11.741 2.949 -8.054
488 1HA GLY 63 2HA GLY 63 10.250 1.285 -9.996
489 2HA GLY 63 1HA GLY 63 11.474 2.458 -10.438
490 H SER 64 H SER 64 10.840 -0.781 -9.228
491 HA SER 64 HA SER 64 13.659 -1.339 -9.566
492 1HB SER 64 1HB SER 64 12.329 -1.291 -7.016
493 2HB SER 64 2HB SER 64 12.679 -2.966 -7.393
494 HG SER 64 HG SER 64 14.379 -1.347 -6.330
495 H TYR 65 H TYR 65 10.913 -3.283 -8.217
496 HA TYR 65 HA TYR 65 9.944 -5.152 -8.911
497 1HB TYR 65 1HB TYR 65 8.962 -3.972 -10.743
498 2HB TYR 65 2HB TYR 65 10.520 -3.515 -11.401
499 HD1 TYR 65 HD1 TYR 65 11.197 -4.521 -13.378
500 HD2 TYR 65 HD2 TYR 65 8.496 -6.626 -10.813
501 HE1 TYR 65 HE1 TYR 65 11.015 -6.390 -15.091
502 HE2 TYR 65 HE2 TYR 65 8.325 -8.490 -12.535
503 HH TYR 65 HH TYR 65 9.998 -8.222 -15.651
504 H VAL 66 H VAL 66 12.275 -4.828 -11.664
505 HA VAL 66 HA VAL 66 13.086 -7.552 -11.254
506 HB VAL 66 HB VAL 66 12.696 -6.439 -13.468
507 1HG1 VAL 66 1HG1 VAL 66 14.187 -4.390 -12.551
508 2HG1 VAL 66 2HG1 VAL 66 13.983 -4.749 -14.282
509 3HG1 VAL 66 3HG1 VAL 66 15.444 -5.297 -13.425
510 1HG2 VAL 66 1HG2 VAL 66 14.467 -7.625 -14.590
511 2HG2 VAL 66 2HG2 VAL 66 13.993 -8.559 -13.151
512 3HG2 VAL 66 3HG2 VAL 66 15.484 -7.588 -13.130
513 H THR 67 H THR 67 13.664 -6.487 -8.890
514 HA THR 67 HA THR 67 16.541 -6.555 -8.856
515 HB THR 67 HB THR 67 14.940 -4.037 -8.230
516 HG1 THR 67 HG1 THR 67 17.307 -4.918 -9.712
517 1HG2 THR 67 1HG2 THR 67 16.509 -4.583 -6.287
518 2HG2 THR 67 2HG2 THR 67 16.943 -3.103 -7.174
519 3HG2 THR 67 3HG2 THR 67 17.847 -4.608 -7.461
520 H HIS 68 H HIS 68 13.818 -5.455 -6.718
521 HA HIS 68 HA HIS 68 14.757 -7.499 -4.840
522 1HB HIS 68 1HB HIS 68 13.990 -4.673 -4.510
523 2HB HIS 68 2HB HIS 68 13.244 -5.752 -3.348
524 HD1 HIS 68 HD1 HIS 68 15.137 -7.495 -2.166
525 HD2 HIS 68 HD2 HIS 68 16.464 -3.835 -3.726
526 HE1 HIS 68 HE1 HIS 68 17.390 -7.025 -1.066
527 H GLU 69 H GLU 69 13.121 -8.307 -6.951
528 HA GLU 69 HA GLU 69 10.510 -8.102 -6.887
529 1HB GLU 69 1HB GLU 69 10.375 -10.505 -7.562
530 2HB GLU 69 2HB GLU 69 11.664 -9.647 -8.382
531 1HG GLU 69 1HG GLU 69 12.997 -11.366 -7.688
532 2HG GLU 69 2HG GLU 69 12.994 -10.552 -6.136
533 HE2 GLU 69 HE GLU 69 11.417 -12.950 -7.973
534 H THR 70 H THR 70 8.682 -9.225 -5.841
535 HA THR 70 HA THR 70 9.313 -10.407 -3.241
536 HB THR 70 HB THR 70 7.934 -8.842 -2.061
537 HG1 THR 70 HG1 THR 70 6.572 -7.386 -3.406
538 1HG2 THR 70 1HG2 THR 70 9.274 -7.247 -4.310
539 2HG2 THR 70 2HG2 THR 70 10.029 -7.679 -2.757
540 3HG2 THR 70 3HG2 THR 70 8.653 -6.553 -2.793
541 H ARG 71 H ARG 71 6.312 -10.106 -2.669
542 HA ARG 71 HA ARG 71 5.535 -12.252 -4.478
543 1HB ARG 71 1HB ARG 71 5.122 -11.857 -1.505
544 2HB ARG 71 2HB ARG 71 3.908 -12.751 -2.399
545 1HG ARG 71 1HG ARG 71 5.301 -14.524 -1.902
546 2HG ARG 71 2HG ARG 71 6.092 -14.006 -3.378
547 1HD ARG 71 1HD ARG 71 7.126 -12.410 -1.193
548 2HD ARG 71 2HD ARG 71 7.188 -14.096 -0.716
549 HE ARG 71 HE ARG 71 8.748 -12.826 -2.843
550 1HH1 ARG 71 2HH2 ARG 71 7.478 -15.912 -1.652
551 2HH1 ARG 71 1HH2 ARG 71 8.667 -16.862 -2.478
552 1HH2 ARG 71 1HH ARG 71 10.326 -15.764 -3.814
553 H HIS 72 H HIS 72 4.046 -9.886 -2.129
554 HA HIS 72 HA HIS 72 2.174 -9.173 -4.264
555 1HB HIS 72 1HB HIS 72 1.625 -10.092 -1.483
556 2HB HIS 72 2HB HIS 72 0.640 -8.777 -2.092
557 HD1 HIS 72 HD1 HIS 72 1.834 -11.524 -4.403
558 HD2 HIS 72 HD2 HIS 72 -1.648 -10.383 -2.361
559 HE1 HIS 72 HE1 HIS 72 -0.046 -12.980 -5.327
560 H PHE 73 H PHE 73 2.334 -7.053 -4.780
561 HA PHE 73 HA PHE 73 2.931 -5.185 -2.625
562 1HB PHE 73 1HB PHE 73 4.473 -4.102 -4.520
563 2HB PHE 73 2HB PHE 73 5.114 -5.422 -3.563
564 HD1 PHE 73 HD1 PHE 73 4.930 -7.789 -4.534
565 HD2 PHE 73 HD2 PHE 73 4.348 -4.280 -6.851
566 HE1 PHE 73 HE1 PHE 73 5.357 -9.102 -6.630
567 HE2 PHE 73 HE2 PHE 73 4.775 -5.594 -8.946
568 HZ PHE 73 HZ PHE 73 5.274 -7.989 -8.811
569 H ILE 74 H ILE 74 2.523 -2.870 -3.320
570 HA ILE 74 HA ILE 74 1.027 -2.468 -5.713
571 HB ILE 74 HB ILE 74 -0.875 -3.281 -4.816
572 1HG1 ILE 74 1HG1 ILE 74 -0.909 -0.553 -3.498
573 2HG1 ILE 74 2HG1 ILE 74 -1.123 -0.810 -5.218
574 1HG2 ILE 74 1HG2 ILE 74 -1.273 -2.754 -2.189
575 2HG2 ILE 74 2HG2 ILE 74 0.502 -2.873 -2.233
576 3HG2 ILE 74 3HG2 ILE 74 -0.495 -4.230 -2.811
577 1HD1 ILE 74 1HD1 ILE 74 -3.341 -0.988 -4.703
578 2HD1 ILE 74 2HD1 ILE 74 -3.006 -1.319 -2.986
579 3HD1 ILE 74 3HD1 ILE 74 -2.921 -2.636 -4.180
580 H TYR 75 H TYR 75 1.699 -0.510 -6.387
581 HA TYR 75 HA TYR 75 2.449 1.418 -4.294
582 1HB TYR 75 1HB TYR 75 4.367 0.816 -5.655
583 2HB TYR 75 2HB TYR 75 3.394 0.668 -7.103
584 HD1 TYR 75 HD1 TYR 75 4.545 2.099 -8.590
585 HD2 TYR 75 HD2 TYR 75 3.414 3.542 -4.725
586 HE1 TYR 75 HE1 TYR 75 5.205 4.459 -9.269
587 HE2 TYR 75 HE2 TYR 75 4.078 5.896 -5.417
588 HH TYR 75 HH TYR 75 4.495 6.807 -8.537
589 H PHE 76 H PHE 76 0.998 3.038 -4.044
590 HA PHE 76 HA PHE 76 -0.088 4.244 -6.451
591 1HB PHE 76 1HB PHE 76 -2.381 4.190 -5.253
592 2HB PHE 76 2HB PHE 76 -1.821 2.631 -5.824
593 HD1 PHE 76 HD1 PHE 76 -0.357 1.297 -4.028
594 HD2 PHE 76 HD2 PHE 76 -3.197 4.310 -3.101
595 HE1 PHE 76 HE1 PHE 76 -0.591 0.363 -1.710
596 HE2 PHE 76 HE2 PHE 76 -3.432 3.376 -0.783
597 HZ PHE 76 HZ PHE 76 -2.126 1.414 -0.116
598 H TYR 77 H TYR 77 -1.615 6.213 -5.604
599 HA TYR 77 HA TYR 77 0.077 7.620 -3.667
600 1HB TYR 77 1HB TYR 77 -0.559 8.294 -6.191
601 2HB TYR 77 2HB TYR 77 -2.107 8.738 -5.501
602 HD1 TYR 77 HD1 TYR 77 -2.318 11.032 -5.280
603 HD2 TYR 77 HD2 TYR 77 1.465 9.226 -4.426
604 HE1 TYR 77 HE1 TYR 77 -1.372 13.302 -4.636
605 HE2 TYR 77 HE2 TYR 77 2.398 11.503 -3.784
606 HH TYR 77 HH TYR 77 1.952 13.592 -3.427
607 H LEU 78 H LEU 78 -0.690 7.793 -1.624
608 HA LEU 78 HA LEU 78 -3.574 7.536 -1.250
609 1HB LEU 78 1HB LEU 78 -1.501 6.287 -0.019
610 2HB LEU 78 2HB LEU 78 -1.762 7.628 1.078
611 HG LEU 78 HG LEU 78 -4.040 6.966 1.481
612 1HD1 LEU 78 1HD1 LEU 78 -4.573 4.564 0.336
613 2HD1 LEU 78 2HD1 LEU 78 -3.649 5.354 -0.963
614 3HD1 LEU 78 3HD1 LEU 78 -5.112 6.132 -0.312
615 1HD2 LEU 78 1HD2 LEU 78 -1.779 5.292 2.046
616 2HD2 LEU 78 2HD2 LEU 78 -3.231 4.282 1.853
617 3HD2 LEU 78 3HD2 LEU 78 -3.224 5.613 3.034
618 H GLY 79 H GLY 79 -4.770 9.342 -1.051
619 1HA GLY 79 2HA GLY 79 -5.371 11.444 -0.528
620 2HA GLY 79 1HA GLY 79 -4.095 11.455 0.674
621 H GLN 80 H GLN 80 -1.881 12.075 0.025
622 HA GLN 80 HA GLN 80 -1.664 13.247 -2.593
623 1HB GLN 80 1HB GLN 80 -2.579 14.940 -0.731
624 2HB GLN 80 2HB GLN 80 -0.885 15.031 -0.291
625 1HG GLN 80 1HG GLN 80 -0.835 15.225 -3.095
626 2HG GLN 80 2HG GLN 80 -2.267 16.135 -2.654
627 1HE2 GLN 80 2HE2 GLN 80 1.000 16.264 -3.098
628 2HE2 GLN 80 1HE2 GLN 80 1.400 17.698 -2.213
629 H VAL 81 H VAL 81 -0.500 10.949 -1.103
630 HA VAL 81 HA VAL 81 2.289 11.736 -1.414
631 HB VAL 81 HB VAL 81 2.929 10.632 0.638
632 1HG1 VAL 81 1HG1 VAL 81 2.315 12.322 2.151
633 2HG1 VAL 81 2HG1 VAL 81 0.715 12.540 1.402
634 3HG1 VAL 81 3HG1 VAL 81 2.179 13.095 0.553
635 1HG2 VAL 81 1HG2 VAL 81 0.397 9.413 0.478
636 2HG2 VAL 81 2HG2 VAL 81 0.354 10.424 1.943
637 3HG2 VAL 81 3HG2 VAL 81 1.627 9.197 1.745
638 H ALA 82 H ALA 82 3.700 9.630 -1.385
639 HA ALA 82 HA ALA 82 2.254 7.701 -3.041
640 1HB ALA 82 1HB ALA 82 4.767 9.016 -3.233
641 2HB ALA 82 2HB ALA 82 4.103 7.767 -4.313
642 3HB ALA 82 3HB ALA 82 5.112 7.297 -2.925
643 H ILE 83 H ILE 83 2.498 5.406 -2.654
644 HA ILE 83 HA ILE 83 3.757 4.616 -0.182
645 HB ILE 83 HB ILE 83 1.379 5.466 0.301
646 1HG1 ILE 83 1HG1 ILE 83 1.812 2.651 1.252
647 2HG1 ILE 83 2HG1 ILE 83 2.986 3.885 1.661
648 1HG2 ILE 83 1HG2 ILE 83 0.640 2.751 -0.816
649 2HG2 ILE 83 2HG2 ILE 83 0.352 4.296 -1.653
650 3HG2 ILE 83 3HG2 ILE 83 -0.443 3.966 -0.095
651 1HD1 ILE 83 1HD1 ILE 83 1.524 5.032 3.039
652 2HD1 ILE 83 2HD1 ILE 83 0.798 3.413 3.175
653 3HD1 ILE 83 3HD1 ILE 83 0.101 4.609 2.055
654 H LEU 84 H LEU 84 4.909 2.847 -0.713
655 HA LEU 84 HA LEU 84 3.731 1.077 -2.741
656 1HB LEU 84 1HB LEU 84 5.498 2.029 -3.865
657 2HB LEU 84 2HB LEU 84 6.495 2.163 -2.430
658 HG LEU 84 HG LEU 84 6.050 -0.615 -2.889
659 1HD1 LEU 84 1HD1 LEU 84 6.352 0.975 -5.371
660 2HD1 LEU 84 2HD1 LEU 84 5.647 -0.638 -5.109
661 3HD1 LEU 84 3HD1 LEU 84 7.414 -0.444 -5.210
662 1HD2 LEU 84 1HD2 LEU 84 8.052 -0.326 -1.921
663 2HD2 LEU 84 2HD2 LEU 84 8.284 1.287 -2.638
664 3HD2 LEU 84 3HD2 LEU 84 8.650 -0.172 -3.590
665 H LEU 85 H LEU 85 2.861 -0.576 -1.571
666 HA LEU 85 HA LEU 85 4.447 -1.587 0.669
667 1HB LEU 85 1HB LEU 85 2.194 -0.937 1.211
668 2HB LEU 85 2HB LEU 85 1.543 -1.922 -0.083
669 HG LEU 85 HG LEU 85 3.178 -3.382 1.909
670 1HD1 LEU 85 1HD1 LEU 85 0.428 -2.880 2.867
671 2HD1 LEU 85 2HD1 LEU 85 1.558 -1.512 3.016
672 3HD1 LEU 85 3HD1 LEU 85 1.949 -3.077 3.769
673 1HD2 LEU 85 1HD2 LEU 85 2.125 -4.657 0.209
674 2HD2 LEU 85 2HD2 LEU 85 0.558 -3.856 0.477
675 3HD2 LEU 85 3HD2 LEU 85 1.215 -4.959 1.709
676 H PHE 86 H PHE 86 5.098 -3.768 0.783
677 HA PHE 86 HA PHE 86 4.364 -5.569 -1.310
678 1HB PHE 86 1HB PHE 86 6.631 -5.728 -2.263
679 2HB PHE 86 2HB PHE 86 6.177 -4.036 -2.295
680 HD1 PHE 86 HD1 PHE 86 7.223 -2.438 -0.769
681 HD2 PHE 86 HD2 PHE 86 8.378 -6.520 -0.787
682 HE1 PHE 86 HE1 PHE 86 9.299 -1.857 0.519
683 HE2 PHE 86 HE2 PHE 86 10.453 -5.940 0.499
684 HZ PHE 86 HZ PHE 86 10.889 -3.615 1.137
685 H LYS 87 H LYS 87 4.809 -7.733 -0.750
686 HA LYS 87 HA LYS 87 5.831 -8.033 1.973
687 1HB LYS 87 1HB LYS 87 3.741 -8.993 1.954
688 2HB LYS 87 2HB LYS 87 3.853 -9.504 0.282
689 1HG LYS 87 1HG LYS 87 4.004 -11.484 1.697
690 2HG LYS 87 2HG LYS 87 5.567 -11.227 0.948
691 1HD LYS 87 1HD LYS 87 6.374 -10.082 3.024
692 2HD LYS 87 2HD LYS 87 4.809 -10.339 3.773
693 1HE LYS 87 1HE LYS 87 5.740 -12.274 4.568
694 2HE LYS 87 2HE LYS 87 5.400 -12.908 2.969
695 1HZ LYS 87 1HZ LYS 87 7.842 -12.907 3.982
696 H SER 88 H SER 88 7.957 -8.491 2.125
697 HA SER 88 HA SER 88 8.981 -10.395 0.176
698 1HB SER 88 1HB SER 88 9.836 -8.211 -0.484
699 2HB SER 88 2HB SER 88 10.319 -7.841 1.159
700 HG SER 88 HG SER 88 11.388 -10.118 -0.259
701 H GLY 89 H GLY 89 9.990 -12.146 1.130
702 1HA GLY 89 2HA GLY 89 10.037 -12.352 3.973
703 2HA GLY 89 1HA GLY 89 10.617 -13.523 2.806
Start of MODEL 2
1 1H MET 1 H MET 1 -14.702 20.163 -11.065
2 HA MET 1 HA MET 1 -15.447 18.521 -12.316
3 1HB MET 1 1HB MET 1 -12.489 17.822 -12.371
4 2HB MET 1 2HB MET 1 -13.636 16.633 -12.957
5 1HG MET 1 1HG MET 1 -14.613 18.694 -14.346
6 2HG MET 1 2HG MET 1 -13.025 19.383 -14.068
7 1HE MET 1 1HE MET 1 -14.896 17.535 -16.741
8 2HE MET 1 2HE MET 1 -14.003 19.074 -16.764
9 3HE MET 1 3HE MET 1 -13.434 17.701 -17.742
10 H SER 2 H SER 2 -14.151 18.333 -9.243
11 HA SER 2 HA SER 2 -14.672 17.108 -7.519
12 1HB SER 2 1HB SER 2 -16.699 16.312 -9.405
13 2HB SER 2 2HB SER 2 -16.167 14.875 -8.557
14 HG SER 2 HG SER 2 -17.764 15.721 -7.256
15 H ASP 3 H ASP 3 -13.423 15.552 -6.457
16 HA ASP 3 HA ASP 3 -11.504 14.226 -8.010
17 1HB ASP 3 1HB ASP 3 -11.786 14.986 -5.343
18 2HB ASP 3 2HB ASP 3 -11.922 13.241 -5.240
19 HD2 ASP 3 HD ASP 3 -8.536 15.113 -5.983
20 H ARG 4 H ARG 4 -11.340 11.716 -6.439
21 HA ARG 4 HA ARG 4 -13.851 10.426 -7.038
22 1HB ARG 4 1HB ARG 4 -11.219 9.893 -8.395
23 2HB ARG 4 2HB ARG 4 -12.171 8.486 -7.967
24 1HG ARG 4 1HG ARG 4 -13.946 9.071 -9.395
25 2HG ARG 4 2HG ARG 4 -13.568 10.781 -9.344
26 1HD ARG 4 1HD ARG 4 -11.354 10.129 -10.588
27 2HD ARG 4 2HD ARG 4 -12.141 8.596 -10.907
28 HE ARG 4 HE ARG 4 -14.065 10.350 -11.729
29 1HH1 ARG 4 2HH2 ARG 4 -10.591 10.226 -12.411
30 2HH1 ARG 4 1HH2 ARG 4 -10.743 10.968 -13.966
31 1HH2 ARG 4 1HH ARG 4 -12.914 11.610 -14.754
32 H LYS 5 H LYS 5 -10.431 9.435 -6.248
33 HA LYS 5 HA LYS 5 -10.948 8.989 -3.533
34 1HB LYS 5 1HB LYS 5 -10.929 6.517 -3.503
35 2HB LYS 5 2HB LYS 5 -12.381 7.183 -4.222
36 1HG LYS 5 1HG LYS 5 -11.044 6.942 -6.501
37 2HG LYS 5 2HG LYS 5 -10.046 5.824 -5.595
38 1HD LYS 5 1HD LYS 5 -11.612 4.197 -5.779
39 2HD LYS 5 2HD LYS 5 -12.821 5.222 -5.032
40 1HE LYS 5 1HE LYS 5 -12.625 6.328 -7.582
41 2HE LYS 5 2HE LYS 5 -12.370 4.625 -7.906
42 1HZ LYS 5 1HZ LYS 5 -14.588 5.356 -6.127
43 H ALA 6 H ALA 6 -9.082 6.925 -3.025
44 HA ALA 6 HA ALA 6 -6.687 8.343 -3.397
45 1HB ALA 6 1HB ALA 6 -5.807 5.957 -2.599
46 2HB ALA 6 2HB ALA 6 -7.536 5.688 -2.280
47 3HB ALA 6 3HB ALA 6 -6.685 7.036 -1.488
48 H VAL 7 H VAL 7 -6.378 8.730 -5.643
49 HA VAL 7 HA VAL 7 -6.648 7.064 -7.719
50 HB VAL 7 HB VAL 7 -4.377 8.241 -8.462
51 1HG1 VAL 7 1HG1 VAL 7 -6.336 10.350 -8.244
52 2HG1 VAL 7 2HG1 VAL 7 -7.141 8.810 -8.626
53 3HG1 VAL 7 3HG1 VAL 7 -5.836 9.414 -9.674
54 1HG2 VAL 7 1HG2 VAL 7 -3.570 9.894 -7.149
55 2HG2 VAL 7 2HG2 VAL 7 -4.357 8.982 -5.838
56 3HG2 VAL 7 3HG2 VAL 7 -5.185 10.374 -6.577
57 H ILE 8 H ILE 8 -5.072 5.712 -8.965
58 HA ILE 8 HA ILE 8 -3.087 4.442 -7.237
59 HB ILE 8 HB ILE 8 -5.465 3.169 -8.509
60 1HG1 ILE 8 1HG1 ILE 8 -4.591 1.782 -6.226
61 2HG1 ILE 8 2HG1 ILE 8 -4.325 3.474 -5.856
62 1HG2 ILE 8 1HG2 ILE 8 -3.597 2.091 -9.646
63 2HG2 ILE 8 2HG2 ILE 8 -4.367 0.978 -8.490
64 3HG2 ILE 8 3HG2 ILE 8 -2.819 1.754 -8.079
65 1HD1 ILE 8 1HD1 ILE 8 -6.941 2.246 -6.844
66 2HD1 ILE 8 2HD1 ILE 8 -6.681 3.985 -6.560
67 3HD1 ILE 8 3HD1 ILE 8 -6.604 2.840 -5.200
68 H LYS 9 H LYS 9 -1.325 3.461 -8.398
69 HA LYS 9 HA LYS 9 -1.178 4.442 -11.163
70 1HB LYS 9 1HB LYS 9 1.002 4.061 -9.090
71 2HB LYS 9 2HB LYS 9 1.303 4.433 -10.777
72 1HG LYS 9 1HG LYS 9 -0.631 6.332 -10.041
73 2HG LYS 9 2HG LYS 9 0.367 6.204 -8.606
74 1HD LYS 9 1HD LYS 9 2.021 6.273 -11.031
75 2HD LYS 9 2HD LYS 9 0.957 7.663 -10.959
76 1HE LYS 9 1HE LYS 9 2.502 6.849 -8.480
77 2HE LYS 9 2HE LYS 9 3.323 7.732 -9.752
78 1HZ LYS 9 1HZ LYS 9 1.876 8.908 -7.816
79 H ASN 10 H ASN 10 0.628 1.972 -9.216
80 HA ASN 10 HA ASN 10 -0.179 0.058 -11.260
81 1HB ASN 10 1HB ASN 10 2.285 0.863 -11.372
82 2HB ASN 10 2HB ASN 10 2.527 0.062 -9.831
83 1HD2 ASN 10 2HD2 ASN 10 2.147 -0.275 -13.222
84 2HD2 ASN 10 1HD2 ASN 10 2.346 -1.991 -13.353
85 H ALA 11 H ALA 11 -0.590 -2.105 -10.430
86 HA ALA 11 HA ALA 11 -0.120 -2.576 -7.608
87 1HB ALA 11 1HB ALA 11 -2.292 -1.445 -7.610
88 2HB ALA 11 2HB ALA 11 -2.507 -3.171 -7.230
89 3HB ALA 11 3HB ALA 11 -2.897 -2.561 -8.857
90 H ASP 12 H ASP 12 -1.923 -3.819 -10.517
91 HA ASP 12 HA ASP 12 -1.948 -5.760 -11.481
92 1HB ASP 12 1HB ASP 12 0.623 -5.136 -11.512
93 2HB ASP 12 2HB ASP 12 0.784 -6.431 -10.342
94 HD2 ASP 12 HD ASP 12 1.793 -6.851 -13.369
95 H MET 13 H MET 13 -3.596 -6.523 -9.891
96 HA MET 13 HA MET 13 -2.834 -8.923 -8.677
97 1HB MET 13 1HB MET 13 -2.449 -6.584 -7.077
98 2HB MET 13 2HB MET 13 -3.931 -7.300 -6.477
99 1HG MET 13 1HG MET 13 -2.797 -9.468 -6.124
100 2HG MET 13 2HG MET 13 -1.328 -8.856 -6.856
101 1HE MET 13 1HE MET 13 -0.663 -5.930 -5.507
102 2HE MET 13 2HE MET 13 0.398 -6.801 -4.374
103 3HE MET 13 3HE MET 13 0.204 -7.390 -6.042
104 H SER 14 H SER 14 -4.909 -9.265 -6.799
105 HA SER 14 HA SER 14 -7.161 -9.105 -8.600
106 1HB SER 14 1HB SER 14 -6.930 -11.299 -7.781
107 2HB SER 14 2HB SER 14 -6.466 -10.766 -6.177
108 HG SER 14 HG SER 14 -8.625 -11.585 -6.155
109 H GLU 15 H GLU 15 -8.874 -7.710 -8.266
110 HA GLU 15 HA GLU 15 -8.749 -5.573 -6.706
111 1HB GLU 15 1HB GLU 15 -10.626 -6.624 -8.400
112 2HB GLU 15 2HB GLU 15 -11.487 -6.753 -6.881
113 1HG GLU 15 1HG GLU 15 -12.079 -4.580 -7.387
114 2HG GLU 15 2HG GLU 15 -10.566 -4.228 -6.576
115 HE2 GLU 15 HE GLU 15 -11.558 -2.599 -8.419
116 H GLU 16 H GLU 16 -9.492 -8.867 -5.669
117 HA GLU 16 HA GLU 16 -10.859 -8.383 -3.362
118 1HB GLU 16 1HB GLU 16 -9.990 -10.607 -4.588
119 2HB GLU 16 2HB GLU 16 -8.731 -10.513 -3.373
120 1HG GLU 16 1HG GLU 16 -11.155 -10.000 -1.976
121 2HG GLU 16 2HG GLU 16 -11.524 -11.319 -3.068
122 HE2 GLU 16 HE GLU 16 -9.276 -13.516 -1.491
123 H MET 17 H MET 17 -7.277 -9.028 -3.555
124 HA MET 17 HA MET 17 -6.939 -7.906 -0.968
125 1HB MET 17 1HB MET 17 -4.540 -8.464 -1.374
126 2HB MET 17 2HB MET 17 -5.559 -9.812 -1.838
127 1HG MET 17 1HG MET 17 -5.518 -8.666 -4.238
128 2HG MET 17 2HG MET 17 -4.094 -7.847 -3.625
129 1HE MET 17 1HE MET 17 -5.004 -11.986 -4.754
130 2HE MET 17 2HE MET 17 -4.865 -12.128 -2.985
131 3HE MET 17 3HE MET 17 -5.995 -10.953 -3.696
132 H GLN 18 H GLN 18 -6.316 -6.914 -4.369
133 HA GLN 18 HA GLN 18 -4.763 -4.721 -3.857
134 1HB GLN 18 1HB GLN 18 -5.214 -5.693 -6.111
135 2HB GLN 18 2HB GLN 18 -6.852 -5.073 -6.053
136 1HG GLN 18 1HG GLN 18 -4.840 -2.988 -5.470
137 2HG GLN 18 2HG GLN 18 -4.608 -3.716 -7.048
138 1HE2 GLN 18 2HE2 GLN 18 -5.377 -2.296 -8.436
139 2HE2 GLN 18 1HE2 GLN 18 -6.963 -1.599 -8.436
140 H GLN 19 H GLN 19 -8.369 -5.015 -4.008
141 HA GLN 19 HA GLN 19 -8.759 -2.274 -3.511
142 1HB GLN 19 1HB GLN 19 -10.367 -3.986 -4.614
143 2HB GLN 19 2HB GLN 19 -10.781 -4.481 -2.985
144 1HG GLN 19 1HG GLN 19 -11.150 -1.728 -4.234
145 2HG GLN 19 2HG GLN 19 -12.400 -2.809 -3.651
146 1HE2 GLN 19 2HE2 GLN 19 -11.085 -0.021 -2.990
147 2HE2 GLN 19 1HE2 GLN 19 -11.075 0.016 -1.259
148 H ASP 20 H ASP 20 -8.909 -5.268 -1.478
149 HA ASP 20 HA ASP 20 -9.808 -4.187 0.820
150 1HB ASP 20 1HB ASP 20 -9.210 -6.618 0.323
151 2HB ASP 20 2HB ASP 20 -7.529 -6.207 0.611
152 HD2 ASP 20 HD ASP 20 -8.771 -8.021 2.979
153 H ALA 21 H ALA 21 -6.402 -4.385 -0.432
154 HA ALA 21 HA ALA 21 -5.240 -3.116 1.805
155 1HB ALA 21 1HB ALA 21 -3.345 -3.718 0.741
156 2HB ALA 21 2HB ALA 21 -3.800 -2.826 -0.731
157 3HB ALA 21 3HB ALA 21 -4.392 -4.485 -0.476
158 H VAL 22 H VAL 22 -5.451 -1.867 -1.601
159 HA VAL 22 HA VAL 22 -4.881 0.697 -1.196
160 HB VAL 22 HB VAL 22 -5.790 -0.714 -3.253
161 1HG1 VAL 22 1HG1 VAL 22 -7.968 0.039 -4.021
162 2HG1 VAL 22 2HG1 VAL 22 -8.164 1.053 -2.573
163 3HG1 VAL 22 3HG1 VAL 22 -8.129 -0.720 -2.420
164 1HG2 VAL 22 1HG2 VAL 22 -6.213 2.279 -3.273
165 2HG2 VAL 22 2HG2 VAL 22 -5.601 1.226 -4.571
166 3HG2 VAL 22 3HG2 VAL 22 -4.589 1.558 -3.144
167 H ASP 23 H ASP 23 -7.883 -0.961 -0.205
168 HA ASP 23 HA ASP 23 -9.342 1.330 0.337
169 1HB ASP 23 1HB ASP 23 -10.282 -0.983 0.203
170 2HB ASP 23 2HB ASP 23 -9.434 -1.416 1.675
171 HD2 ASP 23 HD ASP 23 -10.817 -1.367 3.382
172 H CYS 24 H CYS 24 -7.568 -0.957 2.566
173 HA CYS 24 HA CYS 24 -7.859 0.510 4.865
174 1HB CYS 24 1HB CYS 24 -5.623 -1.361 4.024
175 2HB CYS 24 2HB CYS 24 -5.796 -0.719 5.646
176 HG CYS 24 HG CYS 24 -6.912 -3.280 4.559
177 H ALA 25 H ALA 25 -5.681 0.885 2.072
178 HA ALA 25 HA ALA 25 -3.811 2.589 3.303
179 1HB ALA 25 1HB ALA 25 -4.607 2.536 0.372
180 2HB ALA 25 2HB ALA 25 -3.603 1.273 1.125
181 3HB ALA 25 3HB ALA 25 -3.027 2.956 1.073
182 H THR 26 H THR 26 -6.354 3.445 0.845
183 HA THR 26 HA THR 26 -6.264 6.157 1.219
184 HB THR 26 HB THR 26 -7.504 4.701 -0.536
185 HG1 THR 26 HG1 THR 26 -9.047 6.497 -0.701
186 1HG2 THR 26 1HG2 THR 26 -9.989 4.506 0.026
187 2HG2 THR 26 2HG2 THR 26 -9.562 4.801 1.728
188 3HG2 THR 26 3HG2 THR 26 -8.958 3.346 0.897
189 H GLN 27 H GLN 27 -8.046 3.706 3.143
190 HA GLN 27 HA GLN 27 -9.488 5.576 4.611
191 1HB GLN 27 1HB GLN 27 -8.619 2.732 5.285
192 2HB GLN 27 2HB GLN 27 -9.758 3.652 6.249
193 1HG GLN 27 1HG GLN 27 -10.393 3.622 3.345
194 2HG GLN 27 2HG GLN 27 -10.435 2.038 4.095
195 1HE2 GLN 27 2HE2 GLN 27 -11.708 5.303 4.147
196 2HE2 GLN 27 1HE2 GLN 27 -13.160 4.984 5.035
197 H ALA 28 H ALA 28 -6.236 4.113 5.016
198 HA ALA 28 HA ALA 28 -5.756 4.954 7.623
199 1HB ALA 28 1HB ALA 28 -4.399 3.304 6.382
200 2HB ALA 28 2HB ALA 28 -3.387 4.623 7.015
201 3HB ALA 28 3HB ALA 28 -3.830 4.591 5.292
202 H LEU 29 H LEU 29 -4.996 6.549 4.449
203 HA LEU 29 HA LEU 29 -3.935 8.859 5.651
204 1HB LEU 29 1HB LEU 29 -4.052 7.773 3.128
205 2HB LEU 29 2HB LEU 29 -5.113 9.161 2.983
206 HG LEU 29 HG LEU 29 -2.989 9.909 2.311
207 1HD1 LEU 29 1HD1 LEU 29 -3.574 10.758 5.150
208 2HD1 LEU 29 2HD1 LEU 29 -3.983 11.589 3.631
209 3HD1 LEU 29 3HD1 LEU 29 -2.288 11.501 4.169
210 1HD2 LEU 29 1HD2 LEU 29 -0.918 9.537 3.461
211 2HD2 LEU 29 2HD2 LEU 29 -1.734 7.968 3.254
212 3HD2 LEU 29 3HD2 LEU 29 -1.756 8.781 4.837
213 H GLU 30 H GLU 30 -7.120 7.623 5.500
214 HA GLU 30 HA GLU 30 -8.227 10.305 5.677
215 1HB GLU 30 1HB GLU 30 -9.106 7.993 4.336
216 2HB GLU 30 2HB GLU 30 -10.162 8.094 5.730
217 1HG GLU 30 1HG GLU 30 -10.993 10.233 5.117
218 2HG GLU 30 2HG GLU 30 -9.617 10.585 4.091
219 HE2 GLU 30 HE GLU 30 -12.685 9.617 4.079
220 H LYS 31 H LYS 31 -6.892 8.010 7.665
221 HA LYS 31 HA LYS 31 -8.735 8.698 9.848
222 1HB LYS 31 1HB LYS 31 -9.074 6.408 9.562
223 2HB LYS 31 2HB LYS 31 -7.400 6.093 9.156
224 1HG LYS 31 1HG LYS 31 -6.775 6.759 11.540
225 2HG LYS 31 2HG LYS 31 -8.486 6.859 11.905
226 1HD LYS 31 1HD LYS 31 -8.273 4.357 10.674
227 2HD LYS 31 2HD LYS 31 -6.774 4.469 11.574
228 1HE LYS 31 1HE LYS 31 -8.279 5.251 13.579
229 2HE LYS 31 2HE LYS 31 -9.616 4.617 12.641
230 1HZ LYS 31 1HZ LYS 31 -7.316 2.849 12.919
231 H TYR 32 H TYR 32 -5.336 7.858 8.922
232 HA TYR 32 HA TYR 32 -4.419 9.217 11.338
233 1HB TYR 32 1HB TYR 32 -3.375 7.310 9.199
234 2HB TYR 32 2HB TYR 32 -2.197 8.259 10.081
235 HD1 TYR 32 HD1 TYR 32 -1.933 7.956 12.546
236 HD2 TYR 32 HD2 TYR 32 -4.502 5.443 10.225
237 HE1 TYR 32 HE1 TYR 32 -1.976 6.247 14.428
238 HE2 TYR 32 HE2 TYR 32 -4.536 3.742 12.113
239 HH TYR 32 HH TYR 32 -3.434 4.480 15.221
240 H ASN 33 H ASN 33 -2.385 10.615 11.060
241 HA ASN 33 HA ASN 33 -2.657 12.142 8.591
242 1HB ASN 33 1HB ASN 33 -3.357 13.092 11.077
243 2HB ASN 33 2HB ASN 33 -1.663 13.539 11.057
244 1HD2 ASN 33 2HD2 ASN 33 -0.932 15.134 9.759
245 2HD2 ASN 33 1HD2 ASN 33 -1.932 16.143 8.767
246 H ILE 34 H ILE 34 -0.797 9.929 10.010
247 HA ILE 34 HA ILE 34 1.717 11.337 9.436
248 HB ILE 34 HB ILE 34 1.200 9.168 11.473
249 1HG1 ILE 34 1HG1 ILE 34 2.143 11.213 12.919
250 2HG1 ILE 34 2HG1 ILE 34 1.391 12.143 11.638
251 1HG2 ILE 34 1HG2 ILE 34 3.775 10.631 11.431
252 2HG2 ILE 34 2HG2 ILE 34 3.509 9.470 10.107
253 3HG2 ILE 34 3HG2 ILE 34 3.419 8.928 11.800
254 1HD1 ILE 34 1HD1 ILE 34 -0.038 11.453 13.741
255 2HD1 ILE 34 2HD1 ILE 34 -0.146 9.873 12.927
256 3HD1 ILE 34 3HD1 ILE 34 -0.768 11.334 12.122
257 H GLU 35 H GLU 35 2.388 10.713 7.452
258 HA GLU 35 HA GLU 35 1.480 8.557 6.093
259 1HB GLU 35 1HB GLU 35 4.181 9.957 5.914
260 2HB GLU 35 2HB GLU 35 3.615 8.805 4.721
261 1HG GLU 35 1HG GLU 35 2.132 10.290 3.796
262 2HG GLU 35 2HG GLU 35 1.615 10.899 5.356
263 HE2 GLU 35 HE GLU 35 5.034 11.059 4.381
264 H LYS 36 H LYS 36 4.543 8.790 8.034
265 HA LYS 36 HA LYS 36 5.468 6.248 7.607
266 1HB LYS 36 1HB LYS 36 5.803 8.328 9.699
267 2HB LYS 36 2HB LYS 36 6.262 6.701 10.161
268 1HG LYS 36 1HG LYS 36 7.183 7.628 7.457
269 2HG LYS 36 2HG LYS 36 7.934 8.397 8.842
270 1HD LYS 36 1HD LYS 36 8.098 5.821 9.679
271 2HD LYS 36 2HD LYS 36 8.073 5.528 7.952
272 1HE LYS 36 1HE LYS 36 10.287 6.023 7.897
273 2HE LYS 36 2HE LYS 36 9.876 7.685 8.270
274 1HZ LYS 36 1HZ LYS 36 11.158 7.217 10.086
275 H ASP 37 H ASP 37 3.065 7.411 10.044
276 HA ASP 37 HA ASP 37 2.781 4.883 11.210
277 1HB ASP 37 1HB ASP 37 2.017 7.401 11.891
278 2HB ASP 37 2HB ASP 37 0.498 6.843 11.220
279 HD2 ASP 37 HD ASP 37 -0.248 4.700 13.713
280 H ILE 38 H ILE 38 1.384 6.588 8.416
281 HA ILE 38 HA ILE 38 -0.945 5.041 8.136
282 HB ILE 38 HB ILE 38 0.676 6.736 6.248
283 1HG1 ILE 38 1HG1 ILE 38 -0.867 7.524 8.306
284 2HG1 ILE 38 2HG1 ILE 38 -0.657 8.457 6.838
285 1HG2 ILE 38 1HG2 ILE 38 -0.441 4.948 4.966
286 2HG2 ILE 38 2HG2 ILE 38 -1.110 6.561 4.621
287 3HG2 ILE 38 3HG2 ILE 38 -2.000 5.436 5.675
288 1HD1 ILE 38 1HD1 ILE 38 -2.938 6.517 7.433
289 2HD1 ILE 38 2HD1 ILE 38 -2.704 7.344 5.874
290 3HD1 ILE 38 3HD1 ILE 38 -3.046 8.292 7.343
291 H ALA 39 H ALA 39 2.275 4.856 6.457
292 HA ALA 39 HA ALA 39 1.660 2.496 5.086
293 1HB ALA 39 1HB ALA 39 4.326 3.692 5.947
294 2HB ALA 39 2HB ALA 39 3.457 4.028 4.430
295 3HB ALA 39 3HB ALA 39 4.122 2.404 4.735
296 H ALA 40 H ALA 40 2.899 3.180 8.367
297 HA ALA 40 HA ALA 40 3.768 0.555 8.909
298 1HB ALA 40 1HB ALA 40 3.943 1.340 11.179
299 2HB ALA 40 2HB ALA 40 2.784 2.656 10.875
300 3HB ALA 40 3HB ALA 40 4.394 2.695 10.118
301 H TYR 41 H TYR 41 0.622 2.225 9.003
302 HA TYR 41 HA TYR 41 -0.660 0.197 10.544
303 1HB TYR 41 1HB TYR 41 -1.480 2.528 10.455
304 2HB TYR 41 2HB TYR 41 -1.460 2.523 8.702
305 HD1 TYR 41 HD1 TYR 41 -3.333 1.576 11.698
306 HD2 TYR 41 HD2 TYR 41 -3.231 1.354 7.426
307 HE1 TYR 41 HE1 TYR 41 -5.786 0.905 11.666
308 HE2 TYR 41 HE2 TYR 41 -5.683 0.685 7.409
309 HH TYR 41 HH TYR 41 -7.705 1.209 9.330
310 H ILE 42 H ILE 42 -0.236 0.929 7.049
311 HA ILE 42 HA ILE 42 -2.115 -0.976 6.167
312 HB ILE 42 HB ILE 42 0.252 0.287 4.779
313 1HG1 ILE 42 1HG1 ILE 42 -2.675 1.066 4.675
314 2HG1 ILE 42 2HG1 ILE 42 -1.492 1.847 5.707
315 1HG2 ILE 42 1HG2 ILE 42 -2.036 -0.617 3.166
316 2HG2 ILE 42 2HG2 ILE 42 -1.097 -1.928 3.920
317 3HG2 ILE 42 3HG2 ILE 42 -0.286 -0.745 2.866
318 1HD1 ILE 42 1HD1 ILE 42 -1.840 2.021 2.753
319 2HD1 ILE 42 2HD1 ILE 42 -0.155 1.928 3.316
320 3HD1 ILE 42 3HD1 ILE 42 -1.218 3.232 3.899
321 H LYS 43 H LYS 43 1.498 -1.043 6.497
322 HA LYS 43 HA LYS 43 1.794 -3.669 5.628
323 1HB LYS 43 1HB LYS 43 3.713 -2.316 5.670
324 2HB LYS 43 2HB LYS 43 3.451 -1.812 7.327
325 1HG LYS 43 1HG LYS 43 3.693 -4.749 7.050
326 2HG LYS 43 2HG LYS 43 5.121 -3.897 6.495
327 1HD LYS 43 1HD LYS 43 5.225 -2.655 8.664
328 2HD LYS 43 2HD LYS 43 3.796 -3.504 9.221
329 1HE LYS 43 1HE LYS 43 5.324 -5.649 8.506
330 2HE LYS 43 2HE LYS 43 6.602 -4.515 8.891
331 1HZ LYS 43 1HZ LYS 43 6.016 -5.631 10.902
332 H LYS 44 H LYS 44 1.355 -2.301 8.953
333 HA LYS 44 HA LYS 44 1.497 -4.761 10.263
334 1HB LYS 44 1HB LYS 44 1.791 -2.894 11.613
335 2HB LYS 44 2HB LYS 44 0.421 -2.039 10.931
336 1HG LYS 44 1HG LYS 44 -1.109 -3.781 11.975
337 2HG LYS 44 2HG LYS 44 0.293 -4.488 12.754
338 1HD LYS 44 1HD LYS 44 -0.640 -1.599 13.117
339 2HD LYS 44 2HD LYS 44 -0.938 -2.900 14.254
340 1HE LYS 44 1HE LYS 44 1.883 -2.904 13.681
341 2HE LYS 44 2HE LYS 44 1.422 -1.243 13.998
342 1HZ LYS 44 1HZ LYS 44 1.922 -3.009 15.937
343 H GLU 45 H GLU 45 -1.204 -2.989 8.695
344 HA GLU 45 HA GLU 45 -3.274 -4.465 9.670
345 1HB GLU 45 1HB GLU 45 -3.536 -2.430 8.292
346 2HB GLU 45 2HB GLU 45 -2.928 -3.274 6.883
347 1HG GLU 45 1HG GLU 45 -5.178 -3.600 6.488
348 2HG GLU 45 2HG GLU 45 -4.918 -4.991 7.523
349 HE2 GLU 45 HE GLU 45 -6.052 -4.917 9.529
350 H PHE 46 H PHE 46 -1.378 -5.053 6.620
351 HA PHE 46 HA PHE 46 -2.675 -7.539 6.163
352 1HB PHE 46 1HB PHE 46 -0.421 -5.842 5.070
353 2HB PHE 46 2HB PHE 46 -0.356 -7.544 4.661
354 HD1 PHE 46 HD1 PHE 46 -3.500 -5.658 5.075
355 HD2 PHE 46 HD2 PHE 46 -0.718 -7.301 2.323
356 HE1 PHE 46 HE1 PHE 46 -5.125 -5.269 3.201
357 HE2 PHE 46 HE2 PHE 46 -2.344 -6.913 0.450
358 HZ PHE 46 HZ PHE 46 -4.526 -5.902 0.911
359 H ASP 47 H ASP 47 0.005 -6.469 8.136
360 HA ASP 47 HA ASP 47 1.386 -8.932 8.075
361 1HB ASP 47 1HB ASP 47 2.363 -6.656 8.676
362 2HB ASP 47 2HB ASP 47 1.475 -6.727 10.185
363 HD2 ASP 47 HD ASP 47 4.978 -7.831 10.361
364 H LYS 48 H LYS 48 -1.451 -7.651 9.645
365 HA LYS 48 HA LYS 48 -1.421 -8.857 12.113
366 1HB LYS 48 1HB LYS 48 -3.663 -8.169 10.208
367 2HB LYS 48 2HB LYS 48 -3.972 -8.854 11.789
368 1HG LYS 48 1HG LYS 48 -2.030 -6.663 11.964
369 2HG LYS 48 2HG LYS 48 -3.503 -6.128 11.181
370 1HD LYS 48 1HD LYS 48 -4.190 -7.798 13.460
371 2HD LYS 48 2HD LYS 48 -3.063 -6.558 13.976
372 1HE LYS 48 1HE LYS 48 -4.547 -4.838 12.795
373 2HE LYS 48 2HE LYS 48 -5.712 -6.117 12.522
374 1HZ LYS 48 1HZ LYS 48 -5.281 -4.648 14.896
375 H LYS 49 H LYS 49 -3.792 -10.230 9.845
376 HA LYS 49 HA LYS 49 -2.470 -12.829 10.138
377 1HB LYS 49 1HB LYS 49 -4.978 -11.993 11.320
378 2HB LYS 49 2HB LYS 49 -5.250 -13.298 10.184
379 1HG LYS 49 1HG LYS 49 -4.069 -14.831 11.439
380 2HG LYS 49 2HG LYS 49 -2.865 -13.659 11.938
381 1HD LYS 49 1HD LYS 49 -4.193 -12.850 13.725
382 2HD LYS 49 2HD LYS 49 -5.688 -13.416 13.009
383 1HE LYS 49 1HE LYS 49 -3.744 -15.592 13.575
384 2HE LYS 49 2HE LYS 49 -4.273 -14.733 15.008
385 1HZ LYS 49 1HZ LYS 49 -5.845 -16.395 13.208
386 H TYR 50 H TYR 50 -1.692 -12.032 7.947
387 HA TYR 50 HA TYR 50 -3.656 -12.893 5.955
388 1HB TYR 50 1HB TYR 50 -3.080 -10.249 6.413
389 2HB TYR 50 2HB TYR 50 -1.683 -10.636 5.430
390 HD1 TYR 50 HD1 TYR 50 -2.022 -9.598 3.367
391 HD2 TYR 50 HD2 TYR 50 -5.236 -11.800 5.136
392 HE1 TYR 50 HE1 TYR 50 -3.416 -9.264 1.269
393 HE2 TYR 50 HE2 TYR 50 -6.619 -11.458 3.031
394 HH TYR 50 HH TYR 50 -5.284 -10.439 0.143
395 H ASN 51 H ASN 51 -0.250 -11.620 6.105
396 HA ASN 51 HA ASN 51 0.875 -14.113 5.627
397 1HB ASN 51 1HB ASN 51 -0.262 -13.429 3.320
398 2HB ASN 51 2HB ASN 51 1.092 -12.326 3.174
399 1HD2 ASN 51 2HD2 ASN 51 0.597 -14.424 1.419
400 2HD2 ASN 51 1HD2 ASN 51 1.870 -15.594 1.520
401 HA PRO 52 HA PRO 52 3.474 -10.510 6.830
402 1HB PRO 52 1HB PRO 52 4.080 -11.275 9.383
403 2HB PRO 52 2HB PRO 52 2.764 -10.184 8.997
404 1HG PRO 52 1HG PRO 52 2.641 -13.031 9.784
405 2HG PRO 52 2HG PRO 52 1.366 -11.828 9.809
406 1HD PRO 52 1HD PRO 52 1.717 -13.919 7.878
407 2HD PRO 52 2HD PRO 52 0.511 -12.647 7.839
408 H THR 53 H THR 53 6.763 -11.609 6.910
409 HA THR 53 HA THR 53 4.747 -9.705 7.850
410 HB THR 53 HB THR 53 6.708 -9.890 9.271
411 HG1 THR 53 HG1 THR 53 7.125 -7.712 7.353
412 1HG2 THR 53 1HG2 THR 53 8.954 -9.098 8.040
413 2HG2 THR 53 2HG2 THR 53 8.171 -9.832 6.620
414 3HG2 THR 53 3HG2 THR 53 8.505 -10.821 8.062
415 H TRP 54 H TRP 54 4.558 -7.583 6.927
416 HA TRP 54 HA TRP 54 5.170 -7.654 4.062
417 1HB TRP 54 1HB TRP 54 3.119 -6.067 5.616
418 2HB TRP 54 2HB TRP 54 3.412 -5.913 3.895
419 HD1 TRP 54 HD TRP 54 2.352 -8.762 6.360
420 HE1 TRP 54 HE1 TRP 54 0.663 -10.415 5.187
421 HE3 TRP 54 HE3 TRP 54 2.501 -6.511 1.804
422 HZ2 TRP 54 HZ2 TRP 54 -0.397 -10.590 2.543
423 HZ3 TRP 54 HZ3 TRP 54 1.109 -7.487 -0.019
424 HH2 TRP 54 HH TRP 54 -0.306 -9.455 0.293
425 H HIS 55 H HIS 55 5.675 -5.380 3.133
426 HA HIS 55 HA HIS 55 7.041 -3.705 5.072
427 1HB HIS 55 1HB HIS 55 8.372 -4.912 2.632
428 2HB HIS 55 2HB HIS 55 9.038 -3.584 3.560
429 HD1 HIS 55 HD1 HIS 55 8.943 -4.370 6.399
430 HD2 HIS 55 HD2 HIS 55 9.607 -7.212 3.386
431 HE1 HIS 55 HE1 HIS 55 10.084 -6.355 7.528
432 H CYS 56 H CYS 56 6.311 -1.665 4.779
433 HA CYS 56 HA CYS 56 5.344 -1.003 2.098
434 1HB CYS 56 1HB CYS 56 3.735 -0.954 4.094
435 2HB CYS 56 2HB CYS 56 4.618 0.453 4.651
436 HG CYS 56 HG CYS 56 3.634 0.165 1.522
437 H ILE 57 H ILE 57 6.029 1.031 1.166
438 HA ILE 57 HA ILE 57 8.154 2.402 2.642
439 HB ILE 57 HB ILE 57 8.285 1.222 -0.115
440 1HG1 ILE 57 1HG1 ILE 57 9.091 -0.046 1.906
441 2HG1 ILE 57 2HG1 ILE 57 10.279 0.195 0.640
442 1HG2 ILE 57 1HG2 ILE 57 10.392 2.549 -0.425
443 2HG2 ILE 57 2HG2 ILE 57 9.894 3.545 0.963
444 3HG2 ILE 57 3HG2 ILE 57 8.886 3.496 -0.502
445 1HD1 ILE 57 1HD1 ILE 57 11.634 1.406 2.004
446 2HD1 ILE 57 2HD1 ILE 57 10.601 0.851 3.342
447 3HD1 ILE 57 3HD1 ILE 57 10.284 2.420 2.564
448 H VAL 58 H VAL 58 8.529 4.640 1.850
449 HA VAL 58 HA VAL 58 6.264 5.687 0.326
450 HB VAL 58 HB VAL 58 6.072 5.797 2.931
451 1HG1 VAL 58 1HG1 VAL 58 7.021 7.928 3.833
452 2HG1 VAL 58 2HG1 VAL 58 7.976 8.086 2.339
453 3HG1 VAL 58 3HG1 VAL 58 8.252 6.708 3.430
454 1HG2 VAL 58 1HG2 VAL 58 5.174 7.458 0.767
455 2HG2 VAL 58 2HG2 VAL 58 5.431 8.470 2.208
456 3HG2 VAL 58 3HG2 VAL 58 4.350 7.059 2.293
457 H GLY 59 H GLY 59 6.846 8.303 0.148
458 1HA GLY 59 2HA GLY 59 8.992 9.626 0.038
459 2HA GLY 59 1HA GLY 59 9.591 8.306 -0.944
460 H ARG 60 H ARG 60 8.820 7.998 -3.105
461 HA ARG 60 HA ARG 60 6.753 9.725 -4.030
462 1HB ARG 60 1HB ARG 60 9.213 10.875 -4.101
463 2HB ARG 60 2HB ARG 60 9.316 9.970 -5.599
464 1HG ARG 60 1HG ARG 60 6.741 11.139 -5.666
465 2HG ARG 60 2HG ARG 60 7.765 12.392 -4.994
466 1HD ARG 60 1HD ARG 60 9.027 12.610 -6.938
467 2HD ARG 60 2HD ARG 60 8.869 10.917 -7.366
468 HE ARG 60 HE ARG 60 6.833 11.382 -8.472
469 1HH1 ARG 60 2HH2 ARG 60 7.893 14.225 -6.641
470 2HH1 ARG 60 1HH2 ARG 60 6.739 15.284 -7.379
471 1HH2 ARG 60 1HH ARG 60 5.230 14.413 -9.026
472 H ASN 61 H ASN 61 9.460 7.450 -4.774
473 HA ASN 61 HA ASN 61 7.618 6.072 -6.545
474 1HB ASN 61 1HB ASN 61 9.591 7.568 -7.641
475 2HB ASN 61 2HB ASN 61 10.556 6.154 -7.265
476 1HD2 ASN 61 2HD2 ASN 61 10.707 4.715 -8.794
477 2HD2 ASN 61 1HD2 ASN 61 9.552 4.369 -10.038
478 H PHE 62 H PHE 62 9.434 3.976 -7.294
479 HA PHE 62 HA PHE 62 9.915 2.769 -4.672
480 1HB PHE 62 1HB PHE 62 8.426 1.915 -6.801
481 2HB PHE 62 2HB PHE 62 9.982 1.317 -7.341
482 HD1 PHE 62 HD1 PHE 62 7.679 -0.459 -6.797
483 HD2 PHE 62 HD2 PHE 62 10.752 0.922 -4.214
484 HE1 PHE 62 HE1 PHE 62 7.394 -2.501 -5.366
485 HE2 PHE 62 HE2 PHE 62 10.466 -1.121 -2.783
486 HZ PHE 62 HZ PHE 62 8.790 -2.808 -3.375
487 H GLY 63 H GLY 63 11.481 0.633 -6.315
488 1HA GLY 63 2HA GLY 63 13.656 1.277 -7.610
489 2HA GLY 63 1HA GLY 63 14.063 1.999 -6.066
490 H SER 64 H SER 64 12.216 -0.296 -4.850
491 HA SER 64 HA SER 64 14.364 -2.268 -4.916
492 1HB SER 64 1HB SER 64 12.427 -1.476 -2.707
493 2HB SER 64 2HB SER 64 13.352 -2.963 -2.638
494 HG SER 64 HG SER 64 14.954 -1.791 -1.858
495 H TYR 65 H TYR 65 13.477 -3.419 -6.747
496 HA TYR 65 HA TYR 65 11.414 -5.268 -6.013
497 1HB TYR 65 1HB TYR 65 9.941 -4.552 -7.919
498 2HB TYR 65 2HB TYR 65 10.157 -3.216 -6.805
499 HD1 TYR 65 HD1 TYR 65 10.756 -4.440 -10.180
500 HD2 TYR 65 HD2 TYR 65 11.689 -1.329 -7.395
501 HE1 TYR 65 HE1 TYR 65 11.592 -2.978 -12.084
502 HE2 TYR 65 HE2 TYR 65 12.521 0.124 -9.310
503 HH TYR 65 HH TYR 65 12.401 0.371 -11.561
504 H VAL 66 H VAL 66 13.450 -3.804 -8.615
505 HA VAL 66 HA VAL 66 13.568 -6.378 -9.950
506 HB VAL 66 HB VAL 66 13.221 -4.362 -11.259
507 1HG1 VAL 66 1HG1 VAL 66 14.228 -2.619 -10.042
508 2HG1 VAL 66 2HG1 VAL 66 15.237 -2.778 -11.500
509 3HG1 VAL 66 3HG1 VAL 66 15.794 -3.460 -9.951
510 1HG2 VAL 66 1HG2 VAL 66 16.037 -5.233 -11.891
511 2HG2 VAL 66 2HG2 VAL 66 14.688 -4.878 -12.996
512 3HG2 VAL 66 3HG2 VAL 66 14.679 -6.374 -12.031
513 H THR 67 H THR 67 14.579 -6.545 -7.355
514 HA THR 67 HA THR 67 17.315 -7.252 -7.942
515 HB THR 67 HB THR 67 16.548 -5.029 -5.988
516 HG1 THR 67 HG1 THR 67 18.557 -5.429 -8.092
517 1HG2 THR 67 1HG2 THR 67 18.349 -5.557 -4.691
518 2HG2 THR 67 2HG2 THR 67 19.390 -5.516 -6.134
519 3HG2 THR 67 3HG2 THR 67 18.601 -7.037 -5.648
520 H HIS 68 H HIS 68 14.877 -6.791 -5.297
521 HA HIS 68 HA HIS 68 15.680 -9.449 -4.368
522 1HB HIS 68 1HB HIS 68 15.016 -8.815 -2.172
523 2HB HIS 68 2HB HIS 68 16.061 -7.555 -2.797
524 HD1 HIS 68 HD1 HIS 68 13.110 -7.861 -0.890
525 HD2 HIS 68 HD2 HIS 68 14.209 -5.408 -4.110
526 HE1 HIS 68 HE1 HIS 68 11.534 -5.854 -0.831
527 H GLU 69 H GLU 69 13.085 -7.391 -5.589
528 HA GLU 69 HA GLU 69 11.064 -7.829 -6.254
529 1HB GLU 69 1HB GLU 69 11.990 -10.720 -6.029
530 2HB GLU 69 2HB GLU 69 10.400 -10.294 -6.628
531 1HG GLU 69 1HG GLU 69 11.524 -8.798 -8.357
532 2HG GLU 69 2HG GLU 69 13.073 -9.414 -7.814
533 HE2 GLU 69 HE GLU 69 13.014 -12.355 -8.688
534 H THR 70 H THR 70 8.851 -8.689 -5.520
535 HA THR 70 HA THR 70 8.812 -9.564 -2.743
536 HB THR 70 HB THR 70 7.441 -7.648 -2.049
537 HG1 THR 70 HG1 THR 70 7.830 -7.009 -4.888
538 1HG2 THR 70 1HG2 THR 70 10.069 -7.329 -2.407
539 2HG2 THR 70 2HG2 THR 70 9.042 -5.912 -2.090
540 3HG2 THR 70 3HG2 THR 70 9.548 -6.291 -3.754
541 H ARG 71 H ARG 71 7.324 -11.103 -2.448
542 HA ARG 71 HA ARG 71 6.025 -12.364 -4.292
543 1HB ARG 71 1HB ARG 71 5.207 -11.705 -1.457
544 2HB ARG 71 2HB ARG 71 4.074 -12.599 -2.449
545 1HG ARG 71 1HG ARG 71 5.417 -14.490 -2.541
546 2HG ARG 71 2HG ARG 71 6.908 -13.570 -2.511
547 1HD ARG 71 1HD ARG 71 6.904 -14.570 -0.374
548 2HD ARG 71 2HD ARG 71 6.246 -12.982 -0.033
549 HE ARG 71 HE ARG 71 4.189 -13.970 0.488
550 1HH1 ARG 71 2HH2 ARG 71 6.135 -16.295 -1.345
551 2HH1 ARG 71 1HH2 ARG 71 5.022 -17.600 -1.111
552 1HH2 ARG 71 1HH ARG 71 3.020 -17.223 0.152
553 H HIS 72 H HIS 72 4.175 -9.901 -2.342
554 HA HIS 72 HA HIS 72 2.803 -9.174 -4.824
555 1HB HIS 72 1HB HIS 72 1.691 -10.212 -2.303
556 2HB HIS 72 2HB HIS 72 0.920 -8.742 -2.862
557 HD1 HIS 72 HD1 HIS 72 1.202 -9.407 -5.987
558 HD2 HIS 72 HD2 HIS 72 -0.360 -11.943 -3.033
559 HE1 HIS 72 HE1 HIS 72 -0.331 -11.052 -7.194
560 H PHE 73 H PHE 73 2.530 -6.974 -5.171
561 HA PHE 73 HA PHE 73 3.080 -5.185 -2.951
562 1HB PHE 73 1HB PHE 73 4.596 -3.954 -4.778
563 2HB PHE 73 2HB PHE 73 5.285 -5.280 -3.862
564 HD1 PHE 73 HD1 PHE 73 4.614 -4.024 -7.104
565 HD2 PHE 73 HD2 PHE 73 5.126 -7.635 -4.936
566 HE1 PHE 73 HE1 PHE 73 5.133 -5.233 -9.243
567 HE2 PHE 73 HE2 PHE 73 5.645 -8.845 -7.074
568 HZ PHE 73 HZ PHE 73 5.642 -7.629 -9.202
569 H ILE 74 H ILE 74 2.689 -2.820 -3.665
570 HA ILE 74 HA ILE 74 1.116 -2.456 -6.015
571 HB ILE 74 HB ILE 74 -0.720 -3.328 -4.997
572 1HG1 ILE 74 1HG1 ILE 74 -1.001 -0.602 -3.758
573 2HG1 ILE 74 2HG1 ILE 74 -0.874 -0.762 -5.498
574 1HG2 ILE 74 1HG2 ILE 74 0.138 -4.020 -2.915
575 2HG2 ILE 74 2HG2 ILE 74 -1.241 -2.961 -2.535
576 3HG2 ILE 74 3HG2 ILE 74 0.422 -2.347 -2.379
577 1HD1 ILE 74 1HD1 ILE 74 -2.751 -2.726 -4.378
578 2HD1 ILE 74 2HD1 ILE 74 -3.002 -1.533 -5.676
579 3HD1 ILE 74 3HD1 ILE 74 -3.210 -1.054 -3.974
580 H TYR 75 H TYR 75 1.671 -0.474 -6.731
581 HA TYR 75 HA TYR 75 2.511 1.472 -4.688
582 1HB TYR 75 1HB TYR 75 4.393 0.936 -6.097
583 2HB TYR 75 2HB TYR 75 3.377 0.658 -7.495
584 HD1 TYR 75 HD1 TYR 75 2.645 2.512 -8.915
585 HD2 TYR 75 HD2 TYR 75 5.105 3.202 -5.484
586 HE1 TYR 75 HE1 TYR 75 3.171 4.852 -9.756
587 HE2 TYR 75 HE2 TYR 75 5.625 5.540 -6.337
588 HH TYR 75 HH TYR 75 5.657 6.753 -8.353
589 H PHE 76 H PHE 76 0.915 2.946 -4.355
590 HA PHE 76 HA PHE 76 -0.248 4.153 -6.743
591 1HB PHE 76 1HB PHE 76 -2.470 4.089 -5.411
592 2HB PHE 76 2HB PHE 76 -1.923 2.532 -6.000
593 HD1 PHE 76 HD1 PHE 76 -3.159 4.221 -3.216
594 HD2 PHE 76 HD2 PHE 76 -0.339 1.235 -4.282
595 HE1 PHE 76 HE1 PHE 76 -3.243 3.306 -0.880
596 HE2 PHE 76 HE2 PHE 76 -0.423 0.320 -1.945
597 HZ PHE 76 HZ PHE 76 -1.875 1.368 -0.273
598 H TYR 77 H TYR 77 -1.807 6.087 -5.798
599 HA TYR 77 HA TYR 77 0.001 7.600 -4.060
600 1HB TYR 77 1HB TYR 77 -0.899 8.228 -6.491
601 2HB TYR 77 2HB TYR 77 -2.427 8.531 -5.688
602 HD1 TYR 77 HD1 TYR 77 -2.874 10.742 -5.177
603 HD2 TYR 77 HD2 TYR 77 1.192 9.412 -5.155
604 HE1 TYR 77 HE1 TYR 77 -2.097 13.096 -4.606
605 HE2 TYR 77 HE2 TYR 77 1.954 11.769 -4.587
606 HH TYR 77 HH TYR 77 1.354 13.857 -4.407
607 H LEU 78 H LEU 78 -0.548 7.951 -1.971
608 HA LEU 78 HA LEU 78 -3.367 7.540 -1.270
609 1HB LEU 78 1HB LEU 78 -1.103 6.354 -0.269
610 2HB LEU 78 2HB LEU 78 -1.380 7.643 0.886
611 HG LEU 78 HG LEU 78 -3.522 6.806 1.481
612 1HD1 LEU 78 1HD1 LEU 78 -4.260 4.577 0.254
613 2HD1 LEU 78 2HD1 LEU 78 -3.319 5.285 -1.081
614 3HD1 LEU 78 3HD1 LEU 78 -4.686 6.184 -0.382
615 1HD2 LEU 78 1HD2 LEU 78 -1.619 5.632 2.484
616 2HD2 LEU 78 2HD2 LEU 78 -1.654 4.440 1.163
617 3HD2 LEU 78 3HD2 LEU 78 -3.026 4.559 2.289
618 H GLY 79 H GLY 79 -4.482 9.417 -1.207
619 1HA GLY 79 2HA GLY 79 -5.054 11.502 -0.577
620 2HA GLY 79 1HA GLY 79 -3.728 11.489 0.568
621 H GLN 80 H GLN 80 -1.737 12.474 0.052
622 HA GLN 80 HA GLN 80 -1.621 13.628 -2.621
623 1HB GLN 80 1HB GLN 80 -0.680 15.710 -1.636
624 2HB GLN 80 2HB GLN 80 -2.313 15.402 -1.077
625 1HG GLN 80 1HG GLN 80 -1.565 15.495 1.059
626 2HG GLN 80 2HG GLN 80 -0.628 14.044 0.767
627 1HE2 GLN 80 2HE2 GLN 80 0.770 15.060 2.379
628 2HE2 GLN 80 1HE2 GLN 80 1.996 16.170 1.871
629 H VAL 81 H VAL 81 -0.382 11.261 -0.938
630 HA VAL 81 HA VAL 81 2.375 11.885 -1.725
631 HB VAL 81 HB VAL 81 1.706 11.903 0.829
632 1HG1 VAL 81 1HG1 VAL 81 0.637 9.716 0.868
633 2HG1 VAL 81 2HG1 VAL 81 2.099 9.698 1.883
634 3HG1 VAL 81 3HG1 VAL 81 2.127 8.948 0.270
635 1HG2 VAL 81 1HG2 VAL 81 4.034 11.870 -0.500
636 2HG2 VAL 81 2HG2 VAL 81 4.162 10.291 0.311
637 3HG2 VAL 81 3HG2 VAL 81 3.941 11.771 1.274
638 H ALA 82 H ALA 82 3.617 9.533 -1.531
639 HA ALA 82 HA ALA 82 1.955 7.780 -3.196
640 1HB ALA 82 1HB ALA 82 3.792 8.383 -4.494
641 2HB ALA 82 2HB ALA 82 4.377 6.883 -3.736
642 3HB ALA 82 3HB ALA 82 4.889 8.464 -3.094
643 H ILE 83 H ILE 83 2.415 5.387 -2.935
644 HA ILE 83 HA ILE 83 3.530 4.605 -0.404
645 HB ILE 83 HB ILE 83 1.087 5.408 -0.060
646 1HG1 ILE 83 1HG1 ILE 83 1.388 2.687 1.069
647 2HG1 ILE 83 2HG1 ILE 83 2.758 3.753 1.314
648 1HG2 ILE 83 1HG2 ILE 83 0.282 4.040 -2.049
649 2HG2 ILE 83 2HG2 ILE 83 -0.658 3.901 -0.544
650 3HG2 ILE 83 3HG2 ILE 83 0.472 2.608 -1.012
651 1HD1 ILE 83 1HD1 ILE 83 0.677 5.463 1.893
652 2HD1 ILE 83 2HD1 ILE 83 1.554 4.503 3.108
653 3HD1 ILE 83 3HD1 ILE 83 0.013 3.907 2.444
654 H LEU 84 H LEU 84 4.659 2.783 -0.803
655 HA LEU 84 HA LEU 84 3.628 1.042 -2.932
656 1HB LEU 84 1HB LEU 84 5.887 0.599 -3.636
657 2HB LEU 84 2HB LEU 84 5.524 2.309 -3.755
658 HG LEU 84 HG LEU 84 6.711 1.809 -1.190
659 1HD1 LEU 84 1HD1 LEU 84 9.026 1.222 -2.425
660 2HD1 LEU 84 2HD1 LEU 84 7.900 0.296 -3.448
661 3HD1 LEU 84 3HD1 LEU 84 7.962 -0.004 -1.695
662 1HD2 LEU 84 1HD2 LEU 84 7.156 3.505 -3.580
663 2HD2 LEU 84 2HD2 LEU 84 8.562 3.242 -2.521
664 3HD2 LEU 84 3HD2 LEU 84 7.065 3.938 -1.856
665 H LEU 85 H LEU 85 2.693 -0.586 -1.766
666 HA LEU 85 HA LEU 85 4.165 -1.586 0.546
667 1HB LEU 85 1HB LEU 85 1.865 -1.022 0.934
668 2HB LEU 85 2HB LEU 85 1.339 -1.996 -0.427
669 HG LEU 85 HG LEU 85 2.759 -3.766 1.241
670 1HD1 LEU 85 1HD1 LEU 85 2.342 -1.767 2.909
671 2HD1 LEU 85 2HD1 LEU 85 2.133 -3.458 3.421
672 3HD1 LEU 85 3HD1 LEU 85 0.711 -2.473 2.997
673 1HD2 LEU 85 1HD2 LEU 85 0.033 -3.378 0.223
674 2HD2 LEU 85 2HD2 LEU 85 0.118 -4.291 1.749
675 3HD2 LEU 85 3HD2 LEU 85 1.029 -4.849 0.326
676 H PHE 86 H PHE 86 4.819 -3.777 0.729
677 HA PHE 86 HA PHE 86 4.345 -5.560 -1.455
678 1HB PHE 86 1HB PHE 86 6.885 -5.753 -1.865
679 2HB PHE 86 2HB PHE 86 6.180 -4.249 -2.424
680 HD1 PHE 86 HD1 PHE 86 6.498 -2.168 -1.082
681 HD2 PHE 86 HD2 PHE 86 8.525 -5.775 -0.139
682 HE1 PHE 86 HE1 PHE 86 8.149 -0.880 0.304
683 HE2 PHE 86 HE2 PHE 86 10.175 -4.488 1.245
684 HZ PHE 86 HZ PHE 86 9.967 -2.056 1.450
685 H LYS 87 H LYS 87 4.966 -7.745 -0.949
686 HA LYS 87 HA LYS 87 5.688 -8.061 1.879
687 1HB LYS 87 1HB LYS 87 3.585 -8.970 1.778
688 2HB LYS 87 2HB LYS 87 3.735 -9.449 0.100
689 1HG LYS 87 1HG LYS 87 3.781 -11.472 1.436
690 2HG LYS 87 2HG LYS 87 5.395 -11.229 0.801
691 1HD LYS 87 1HD LYS 87 6.121 -10.219 2.948
692 2HD LYS 87 2HD LYS 87 4.495 -10.356 3.587
693 1HE LYS 87 1HE LYS 87 6.342 -12.656 2.801
694 2HE LYS 87 2HE LYS 87 5.836 -12.230 4.422
695 1HZ LYS 87 1HZ LYS 87 4.059 -13.228 2.263
696 H SER 88 H SER 88 7.695 -8.813 2.263
697 HA SER 88 HA SER 88 8.819 -10.562 0.223
698 1HB SER 88 1HB SER 88 9.836 -8.314 0.006
699 2HB SER 88 2HB SER 88 10.267 -8.322 1.704
700 HG SER 88 HG SER 88 11.805 -9.143 -0.238
701 H GLY 89 H GLY 89 8.207 -12.387 1.564
702 1HA GLY 89 2HA GLY 89 8.720 -14.001 3.053
703 2HA GLY 89 1HA GLY 89 10.154 -13.102 3.508
Start of MODEL 3
1 1H MET 1 H MET 1 -11.545 6.064 -10.170
2 HA MET 1 HA MET 1 -10.452 4.624 -11.741
3 1HB MET 1 1HB MET 1 -13.050 4.295 -12.684
4 2HB MET 1 2HB MET 1 -12.389 5.364 -13.905
5 1HG MET 1 1HG MET 1 -10.470 3.785 -14.245
6 2HG MET 1 2HG MET 1 -11.139 2.713 -13.032
7 1HE MET 1 1HE MET 1 -10.856 0.957 -15.307
8 2HE MET 1 2HE MET 1 -11.697 1.339 -16.828
9 3HE MET 1 3HE MET 1 -10.413 2.415 -16.227
10 H SER 2 H SER 2 -12.330 7.640 -12.263
11 HA SER 2 HA SER 2 -10.078 8.686 -13.767
12 1HB SER 2 1HB SER 2 -12.546 8.829 -14.577
13 2HB SER 2 2HB SER 2 -12.757 10.059 -13.346
14 HG SER 2 HG SER 2 -12.210 11.090 -15.305
15 H ASP 3 H ASP 3 -11.130 11.501 -13.037
16 HA ASP 3 HA ASP 3 -10.525 13.077 -11.671
17 1HB ASP 3 1HB ASP 3 -10.873 11.334 -9.240
18 2HB ASP 3 2HB ASP 3 -11.417 12.978 -9.504
19 HD2 ASP 3 HD ASP 3 -13.789 9.945 -9.979
20 H ARG 4 H ARG 4 -9.376 12.779 -8.899
21 HA ARG 4 HA ARG 4 -6.922 11.357 -9.471
22 1HB ARG 4 1HB ARG 4 -7.193 14.304 -8.771
23 2HB ARG 4 2HB ARG 4 -5.745 13.430 -8.312
24 1HG ARG 4 1HG ARG 4 -5.230 12.881 -10.617
25 2HG ARG 4 2HG ARG 4 -6.811 13.401 -11.168
26 1HD ARG 4 1HD ARG 4 -5.509 15.273 -11.725
27 2HD ARG 4 2HD ARG 4 -6.111 15.748 -10.149
28 HE ARG 4 HE ARG 4 -3.576 14.267 -10.044
29 1HH1 ARG 4 2HH2 ARG 4 -5.065 17.471 -10.320
30 2HH1 ARG 4 1HH2 ARG 4 -3.660 18.310 -9.753
31 1HH2 ARG 4 1HH ARG 4 -1.706 17.057 -9.155
32 H LYS 5 H LYS 5 -9.484 11.276 -7.658
33 HA LYS 5 HA LYS 5 -8.588 11.762 -5.026
34 1HB LYS 5 1HB LYS 5 -10.932 11.813 -5.520
35 2HB LYS 5 2HB LYS 5 -10.905 10.188 -6.171
36 1HG LYS 5 1HG LYS 5 -9.806 9.934 -3.570
37 2HG LYS 5 2HG LYS 5 -11.136 11.059 -3.381
38 1HD LYS 5 1HD LYS 5 -11.813 8.755 -5.116
39 2HD LYS 5 2HD LYS 5 -11.362 8.277 -3.492
40 1HE LYS 5 1HE LYS 5 -13.225 10.616 -3.687
41 2HE LYS 5 2HE LYS 5 -13.889 9.073 -4.184
42 1HZ LYS 5 1HZ LYS 5 -12.660 8.397 -1.895
43 H ALA 6 H ALA 6 -6.824 10.745 -4.209
44 HA ALA 6 HA ALA 6 -5.567 9.090 -3.441
45 1HB ALA 6 1HB ALA 6 -7.099 6.747 -4.200
46 2HB ALA 6 2HB ALA 6 -8.172 7.985 -3.505
47 3HB ALA 6 3HB ALA 6 -6.770 7.399 -2.578
48 H VAL 7 H VAL 7 -7.211 7.470 -6.251
49 HA VAL 7 HA VAL 7 -6.426 6.761 -8.193
50 HB VAL 7 HB VAL 7 -3.983 8.466 -7.683
51 1HG1 VAL 7 1HG1 VAL 7 -3.549 7.081 -9.540
52 2HG1 VAL 7 2HG1 VAL 7 -4.101 8.620 -10.245
53 3HG1 VAL 7 3HG1 VAL 7 -5.213 7.232 -10.155
54 1HG2 VAL 7 1HG2 VAL 7 -5.085 10.341 -8.571
55 2HG2 VAL 7 2HG2 VAL 7 -6.269 9.632 -7.446
56 3HG2 VAL 7 3HG2 VAL 7 -6.437 9.368 -9.199
57 H ILE 8 H ILE 8 -4.535 5.413 -9.183
58 HA ILE 8 HA ILE 8 -2.873 4.202 -7.141
59 HB ILE 8 HB ILE 8 -5.232 2.904 -8.380
60 1HG1 ILE 8 1HG1 ILE 8 -4.537 1.567 -6.070
61 2HG1 ILE 8 2HG1 ILE 8 -3.962 3.190 -5.742
62 1HG2 ILE 8 1HG2 ILE 8 -2.662 1.381 -7.866
63 2HG2 ILE 8 2HG2 ILE 8 -3.382 1.708 -9.461
64 3HG2 ILE 8 3HG2 ILE 8 -4.242 0.680 -8.290
65 1HD1 ILE 8 1HD1 ILE 8 -6.436 2.625 -5.148
66 2HD1 ILE 8 2HD1 ILE 8 -6.733 2.741 -6.900
67 3HD1 ILE 8 3HD1 ILE 8 -6.118 4.152 -6.006
68 H LYS 9 H LYS 9 -0.905 3.564 -7.959
69 HA LYS 9 HA LYS 9 -0.518 4.134 -10.783
70 1HB LYS 9 1HB LYS 9 1.211 4.033 -8.352
71 2HB LYS 9 2HB LYS 9 1.959 3.651 -9.889
72 1HG LYS 9 1HG LYS 9 2.227 5.986 -9.787
73 2HG LYS 9 2HG LYS 9 0.782 5.830 -10.766
74 1HD LYS 9 1HD LYS 9 -0.418 7.002 -9.243
75 2HD LYS 9 2HD LYS 9 -0.031 5.833 -7.997
76 1HE LYS 9 1HE LYS 9 1.093 7.556 -7.000
77 2HE LYS 9 2HE LYS 9 2.356 7.213 -8.166
78 1HZ LYS 9 1HZ LYS 9 0.743 9.521 -8.002
79 H ASN 10 H ASN 10 0.760 1.597 -8.514
80 HA ASN 10 HA ASN 10 0.152 -0.308 -10.633
81 1HB ASN 10 1HB ASN 10 2.709 0.395 -9.947
82 2HB ASN 10 2HB ASN 10 2.445 -0.870 -8.764
83 1HD2 ASN 10 2HD2 ASN 10 4.072 -2.066 -9.828
84 2HD2 ASN 10 1HD2 ASN 10 3.746 -2.972 -11.267
85 H ALA 11 H ALA 11 -0.294 -2.546 -9.782
86 HA ALA 11 HA ALA 11 -0.584 -2.804 -6.917
87 1HB ALA 11 1HB ALA 11 -2.877 -2.864 -6.810
88 2HB ALA 11 2HB ALA 11 -3.049 -3.442 -8.484
89 3HB ALA 11 3HB ALA 11 -2.711 -1.723 -8.165
90 H ASP 12 H ASP 12 -1.262 -4.163 -10.208
91 HA ASP 12 HA ASP 12 -1.213 -6.218 -10.950
92 1HB ASP 12 1HB ASP 12 1.363 -5.853 -9.431
93 2HB ASP 12 2HB ASP 12 1.015 -7.463 -10.032
94 HD2 ASP 12 HD ASP 12 0.270 -4.475 -11.535
95 H MET 13 H MET 13 -3.130 -6.491 -9.217
96 HA MET 13 HA MET 13 -2.693 -8.999 -7.990
97 1HB MET 13 1HB MET 13 -3.151 -8.308 -5.667
98 2HB MET 13 2HB MET 13 -1.778 -7.387 -6.253
99 1HG MET 13 1HG MET 13 -3.896 -5.759 -7.013
100 2HG MET 13 2HG MET 13 -4.510 -6.452 -5.526
101 1HE MET 13 1HE MET 13 -2.622 -7.038 -3.700
102 2HE MET 13 2HE MET 13 -1.708 -5.692 -2.980
103 3HE MET 13 3HE MET 13 -3.488 -5.645 -3.005
104 H SER 14 H SER 14 -4.893 -9.246 -6.347
105 HA SER 14 HA SER 14 -6.995 -8.876 -8.276
106 1HB SER 14 1HB SER 14 -6.979 -11.066 -7.384
107 2HB SER 14 2HB SER 14 -6.654 -10.511 -5.755
108 HG SER 14 HG SER 14 -9.104 -10.746 -7.124
109 H GLU 15 H GLU 15 -9.016 -7.788 -7.789
110 HA GLU 15 HA GLU 15 -8.762 -5.424 -6.481
111 1HB GLU 15 1HB GLU 15 -10.657 -6.541 -8.065
112 2HB GLU 15 2HB GLU 15 -11.487 -6.678 -6.529
113 1HG GLU 15 1HG GLU 15 -10.804 -4.152 -6.198
114 2HG GLU 15 2HG GLU 15 -10.519 -4.163 -7.928
115 HE2 GLU 15 HE GLU 15 -12.200 -3.250 -8.759
116 H GLU 16 H GLU 16 -9.194 -8.608 -5.142
117 HA GLU 16 HA GLU 16 -10.582 -7.958 -2.837
118 1HB GLU 16 1HB GLU 16 -8.968 -10.218 -3.849
119 2HB GLU 16 2HB GLU 16 -8.908 -10.062 -2.105
120 1HG GLU 16 1HG GLU 16 -11.482 -9.876 -2.158
121 2HG GLU 16 2HG GLU 16 -11.396 -10.347 -3.844
122 HE2 GLU 16 HE GLU 16 -11.714 -13.544 -2.424
123 H MET 17 H MET 17 -7.005 -8.337 -3.388
124 HA MET 17 HA MET 17 -6.476 -7.265 -0.803
125 1HB MET 17 1HB MET 17 -4.645 -7.892 -3.187
126 2HB MET 17 2HB MET 17 -4.073 -7.521 -1.573
127 1HG MET 17 1HG MET 17 -4.108 -9.812 -1.330
128 2HG MET 17 2HG MET 17 -5.798 -9.541 -0.954
129 1HE MET 17 1HE MET 17 -3.880 -11.954 -3.925
130 2HE MET 17 2HE MET 17 -3.678 -11.568 -2.200
131 3HE MET 17 3HE MET 17 -4.969 -12.679 -2.718
132 H GLN 18 H GLN 18 -6.495 -6.124 -4.191
133 HA GLN 18 HA GLN 18 -5.071 -3.778 -3.725
134 1HB GLN 18 1HB GLN 18 -5.467 -4.763 -5.976
135 2HB GLN 18 2HB GLN 18 -7.174 -4.391 -5.849
136 1HG GLN 18 1HG GLN 18 -6.308 -1.915 -5.392
137 2HG GLN 18 2HG GLN 18 -4.840 -2.489 -6.159
138 1HE2 GLN 18 2HE2 GLN 18 -7.436 -0.781 -6.766
139 2HE2 GLN 18 1HE2 GLN 18 -7.790 -1.175 -8.416
140 H GLN 19 H GLN 19 -8.607 -4.546 -3.715
141 HA GLN 19 HA GLN 19 -9.341 -1.883 -3.189
142 1HB GLN 19 1HB GLN 19 -10.758 -3.791 -4.218
143 2HB GLN 19 2HB GLN 19 -11.008 -4.352 -2.578
144 1HG GLN 19 1HG GLN 19 -11.904 -1.740 -3.834
145 2HG GLN 19 2HG GLN 19 -12.877 -2.938 -3.007
146 1HE2 GLN 19 2HE2 GLN 19 -12.383 -3.314 -0.695
147 2HE2 GLN 19 1HE2 GLN 19 -11.985 -1.956 0.305
148 H ASP 20 H ASP 20 -9.183 -4.882 -1.141
149 HA ASP 20 HA ASP 20 -9.992 -3.760 1.193
150 1HB ASP 20 1HB ASP 20 -9.482 -6.205 0.717
151 2HB ASP 20 2HB ASP 20 -7.775 -5.835 0.863
152 HD2 ASP 20 HD ASP 20 -9.471 -7.524 3.153
153 H ALA 21 H ALA 21 -6.639 -4.089 -0.184
154 HA ALA 21 HA ALA 21 -5.266 -2.919 1.922
155 1HB ALA 21 1HB ALA 21 -4.204 -4.197 0.120
156 2HB ALA 21 2HB ALA 21 -3.493 -2.567 0.213
157 3HB ALA 21 3HB ALA 21 -4.671 -2.953 -1.064
158 H VAL 22 H VAL 22 -5.987 -1.335 -1.273
159 HA VAL 22 HA VAL 22 -5.376 1.200 -0.607
160 HB VAL 22 HB VAL 22 -6.363 0.017 -2.760
161 1HG1 VAL 22 1HG1 VAL 22 -8.748 1.714 -2.297
162 2HG1 VAL 22 2HG1 VAL 22 -8.691 0.195 -1.369
163 3HG1 VAL 22 3HG1 VAL 22 -8.589 0.157 -3.144
164 1HG2 VAL 22 1HG2 VAL 22 -5.485 1.963 -3.443
165 2HG2 VAL 22 2HG2 VAL 22 -5.950 2.794 -1.939
166 3HG2 VAL 22 3HG2 VAL 22 -7.121 2.641 -3.271
167 H ASP 23 H ASP 23 -8.081 -0.734 0.569
168 HA ASP 23 HA ASP 23 -9.716 1.362 1.355
169 1HB ASP 23 1HB ASP 23 -9.922 -1.355 1.342
170 2HB ASP 23 2HB ASP 23 -9.573 -1.121 3.043
171 HD2 ASP 23 HD ASP 23 -12.276 1.259 3.036
172 H CYS 24 H CYS 24 -7.413 -0.749 3.250
173 HA CYS 24 HA CYS 24 -7.609 0.725 5.606
174 1HB CYS 24 1HB CYS 24 -5.694 -0.543 6.365
175 2HB CYS 24 2HB CYS 24 -6.775 -1.602 5.480
176 HG CYS 24 HG CYS 24 -3.758 -0.710 4.990
177 H ALA 25 H ALA 25 -5.658 1.029 2.631
178 HA ALA 25 HA ALA 25 -3.719 2.786 3.639
179 1HB ALA 25 1HB ALA 25 -3.073 3.012 1.390
180 2HB ALA 25 2HB ALA 25 -4.736 2.802 0.791
181 3HB ALA 25 3HB ALA 25 -3.839 1.405 1.430
182 H THR 26 H THR 26 -6.414 3.623 1.349
183 HA THR 26 HA THR 26 -6.321 6.335 1.748
184 HB THR 26 HB THR 26 -8.636 6.259 0.807
185 HG1 THR 26 HG1 THR 26 -9.761 4.323 1.064
186 1HG2 THR 26 1HG2 THR 26 -7.962 4.023 -0.778
187 2HG2 THR 26 2HG2 THR 26 -6.388 4.698 -0.291
188 3HG2 THR 26 3HG2 THR 26 -7.569 5.718 -1.147
189 H GLN 27 H GLN 27 -8.325 3.924 3.559
190 HA GLN 27 HA GLN 27 -9.607 5.741 5.143
191 1HB GLN 27 1HB GLN 27 -10.325 3.448 5.126
192 2HB GLN 27 2HB GLN 27 -8.752 2.867 5.632
193 1HG GLN 27 1HG GLN 27 -9.023 3.698 7.861
194 2HG GLN 27 2HG GLN 27 -10.338 4.762 7.400
195 1HE2 GLN 27 2HE2 GLN 27 -10.847 3.311 9.488
196 2HE2 GLN 27 1HE2 GLN 27 -11.900 1.972 9.174
197 H ALA 28 H ALA 28 -6.435 4.075 5.669
198 HA ALA 28 HA ALA 28 -5.889 4.981 8.196
199 1HB ALA 28 1HB ALA 28 -4.301 4.149 5.798
200 2HB ALA 28 2HB ALA 28 -4.345 3.454 7.436
201 3HB ALA 28 3HB ALA 28 -3.427 4.948 7.126
202 H LEU 29 H LEU 29 -5.099 6.577 5.029
203 HA LEU 29 HA LEU 29 -4.034 8.878 6.259
204 1HB LEU 29 1HB LEU 29 -3.397 8.215 4.041
205 2HB LEU 29 2HB LEU 29 -5.051 8.323 3.472
206 HG LEU 29 HG LEU 29 -3.815 10.793 4.614
207 1HD1 LEU 29 1HD1 LEU 29 -2.894 9.419 2.123
208 2HD1 LEU 29 2HD1 LEU 29 -1.983 10.390 3.304
209 3HD1 LEU 29 3HD1 LEU 29 -3.041 11.193 2.119
210 1HD2 LEU 29 1HD2 LEU 29 -5.123 11.793 2.687
211 2HD2 LEU 29 2HD2 LEU 29 -6.079 11.005 3.967
212 3HD2 LEU 29 3HD2 LEU 29 -5.799 10.167 2.421
213 H GLU 30 H GLU 30 -7.293 7.749 5.566
214 HA GLU 30 HA GLU 30 -8.375 10.392 5.796
215 1HB GLU 30 1HB GLU 30 -9.214 8.078 4.530
216 2HB GLU 30 2HB GLU 30 -10.231 8.081 5.957
217 1HG GLU 30 1HG GLU 30 -10.104 10.775 4.862
218 2HG GLU 30 2HG GLU 30 -10.541 9.653 3.589
219 HE2 GLU 30 HE GLU 30 -13.469 10.813 5.075
220 H LYS 31 H LYS 31 -6.873 8.691 8.018
221 HA LYS 31 HA LYS 31 -8.750 9.472 10.107
222 1HB LYS 31 1HB LYS 31 -9.301 7.185 9.940
223 2HB LYS 31 2HB LYS 31 -7.636 6.699 9.695
224 1HG LYS 31 1HG LYS 31 -7.355 6.447 11.929
225 2HG LYS 31 2HG LYS 31 -7.747 8.134 12.187
226 1HD LYS 31 1HD LYS 31 -10.243 6.910 11.664
227 2HD LYS 31 2HD LYS 31 -9.394 5.750 12.668
228 1HE LYS 31 1HE LYS 31 -9.085 8.540 13.619
229 2HE LYS 31 2HE LYS 31 -10.755 8.010 13.590
230 1HZ LYS 31 1HZ LYS 31 -8.527 6.600 14.959
231 H TYR 32 H TYR 32 -5.461 8.350 9.138
232 HA TYR 32 HA TYR 32 -4.361 9.637 11.509
233 1HB TYR 32 1HB TYR 32 -3.467 7.786 9.241
234 2HB TYR 32 2HB TYR 32 -2.244 8.599 10.198
235 HD1 TYR 32 HD1 TYR 32 -1.739 7.896 12.446
236 HD2 TYR 32 HD2 TYR 32 -4.992 6.122 10.306
237 HE1 TYR 32 HE1 TYR 32 -1.898 6.058 14.196
238 HE2 TYR 32 HE2 TYR 32 -5.139 4.290 12.064
239 HH TYR 32 HH TYR 32 -4.496 4.160 14.585
240 H ASN 33 H ASN 33 -2.285 10.951 11.159
241 HA ASN 33 HA ASN 33 -2.537 12.491 8.702
242 1HB ASN 33 1HB ASN 33 -3.351 13.518 11.077
243 2HB ASN 33 2HB ASN 33 -1.639 13.854 11.247
244 1HD2 ASN 33 2HD2 ASN 33 -0.651 15.371 10.009
245 2HD2 ASN 33 1HD2 ASN 33 -1.475 16.460 8.942
246 H ILE 34 H ILE 34 -0.728 10.306 10.279
247 HA ILE 34 HA ILE 34 1.807 11.654 9.652
248 HB ILE 34 HB ILE 34 1.245 9.666 11.856
249 1HG1 ILE 34 1HG1 ILE 34 1.957 12.610 12.012
250 2HG1 ILE 34 2HG1 ILE 34 0.362 11.941 12.287
251 1HG2 ILE 34 1HG2 ILE 34 3.548 9.717 10.553
252 2HG2 ILE 34 2HG2 ILE 34 3.479 9.548 12.324
253 3HG2 ILE 34 3HG2 ILE 34 3.836 11.131 11.594
254 1HD1 ILE 34 1HD1 ILE 34 2.703 10.825 13.844
255 2HD1 ILE 34 2HD1 ILE 34 0.983 10.898 14.297
256 3HD1 ILE 34 3HD1 ILE 34 1.975 12.374 14.336
257 H GLU 35 H GLU 35 2.060 10.900 7.556
258 HA GLU 35 HA GLU 35 1.294 8.650 6.444
259 1HB GLU 35 1HB GLU 35 3.995 10.025 6.163
260 2HB GLU 35 2HB GLU 35 3.486 8.734 5.094
261 1HG GLU 35 1HG GLU 35 2.307 10.221 3.859
262 2HG GLU 35 2HG GLU 35 1.290 10.566 5.243
263 HE2 GLU 35 HE GLU 35 4.622 12.700 5.351
264 H LYS 36 H LYS 36 4.192 8.974 8.580
265 HA LYS 36 HA LYS 36 5.225 6.453 8.291
266 1HB LYS 36 1HB LYS 36 5.228 8.507 10.470
267 2HB LYS 36 2HB LYS 36 5.836 6.906 10.843
268 1HG LYS 36 1HG LYS 36 6.877 7.756 8.259
269 2HG LYS 36 2HG LYS 36 7.189 9.003 9.451
270 1HD LYS 36 1HD LYS 36 8.664 7.694 10.641
271 2HD LYS 36 2HD LYS 36 7.723 6.234 10.412
272 1HE LYS 36 1HE LYS 36 8.511 6.382 7.904
273 2HE LYS 36 2HE LYS 36 9.722 7.497 8.503
274 1HZ LYS 36 1HZ LYS 36 9.551 4.640 8.900
275 H ASP 37 H ASP 37 2.643 7.576 10.577
276 HA ASP 37 HA ASP 37 2.279 5.017 11.643
277 1HB ASP 37 1HB ASP 37 1.177 7.684 11.952
278 2HB ASP 37 2HB ASP 37 -0.151 6.545 11.834
279 HD2 ASP 37 HD ASP 37 0.156 4.960 14.542
280 H ILE 38 H ILE 38 1.122 6.767 8.787
281 HA ILE 38 HA ILE 38 -1.231 5.306 8.329
282 HB ILE 38 HB ILE 38 0.586 6.813 6.443
283 1HG1 ILE 38 1HG1 ILE 38 -1.694 7.616 8.227
284 2HG1 ILE 38 2HG1 ILE 38 -0.139 8.390 7.990
285 1HG2 ILE 38 1HG2 ILE 38 -1.108 6.765 4.818
286 2HG2 ILE 38 2HG2 ILE 38 -2.316 6.136 5.964
287 3HG2 ILE 38 3HG2 ILE 38 -0.988 5.090 5.406
288 1HD1 ILE 38 1HD1 ILE 38 -2.098 9.593 6.905
289 2HD1 ILE 38 2HD1 ILE 38 -2.254 8.205 5.800
290 3HD1 ILE 38 3HD1 ILE 38 -0.772 9.192 5.787
291 H ALA 39 H ALA 39 1.979 5.067 6.630
292 HA ALA 39 HA ALA 39 1.376 2.666 5.366
293 1HB ALA 39 1HB ALA 39 3.505 4.515 5.511
294 2HB ALA 39 2HB ALA 39 3.364 3.118 4.419
295 3HB ALA 39 3HB ALA 39 4.203 2.946 5.978
296 H ALA 40 H ALA 40 2.631 3.417 8.628
297 HA ALA 40 HA ALA 40 3.473 0.802 9.237
298 1HB ALA 40 1HB ALA 40 2.598 3.142 10.976
299 2HB ALA 40 2HB ALA 40 4.258 2.746 10.473
300 3HB ALA 40 3HB ALA 40 3.384 1.667 11.587
301 H TYR 41 H TYR 41 0.336 2.497 9.301
302 HA TYR 41 HA TYR 41 -0.955 0.485 10.865
303 1HB TYR 41 1HB TYR 41 -1.654 2.901 10.697
304 2HB TYR 41 2HB TYR 41 -1.850 2.739 8.962
305 HD1 TYR 41 HD1 TYR 41 -3.365 2.153 12.227
306 HD2 TYR 41 HD2 TYR 41 -3.752 1.432 8.028
307 HE1 TYR 41 HE1 TYR 41 -5.807 1.522 12.553
308 HE2 TYR 41 HE2 TYR 41 -6.191 0.804 8.368
309 HH TYR 41 HH TYR 41 -7.489 -0.191 10.666
310 H ILE 42 H ILE 42 -0.440 1.153 7.384
311 HA ILE 42 HA ILE 42 -2.393 -0.665 6.471
312 HB ILE 42 HB ILE 42 0.080 0.432 5.124
313 1HG1 ILE 42 1HG1 ILE 42 -2.740 1.438 4.766
314 2HG1 ILE 42 2HG1 ILE 42 -1.731 2.036 6.070
315 1HG2 ILE 42 1HG2 ILE 42 -1.970 -0.104 3.257
316 2HG2 ILE 42 2HG2 ILE 42 -1.812 -1.558 4.273
317 3HG2 ILE 42 3HG2 ILE 42 -0.390 -0.909 3.422
318 1HD1 ILE 42 1HD1 ILE 42 -0.482 3.307 4.658
319 2HD1 ILE 42 2HD1 ILE 42 -1.737 2.981 3.438
320 3HD1 ILE 42 3HD1 ILE 42 -0.278 1.963 3.509
321 H LYS 43 H LYS 43 1.235 -0.925 6.598
322 HA LYS 43 HA LYS 43 1.306 -3.614 5.928
323 1HB LYS 43 1HB LYS 43 3.340 -2.574 5.709
324 2HB LYS 43 2HB LYS 43 3.173 -1.659 7.194
325 1HG LYS 43 1HG LYS 43 3.301 -4.640 7.491
326 2HG LYS 43 2HG LYS 43 4.776 -3.856 6.963
327 1HD LYS 43 1HD LYS 43 3.464 -2.417 9.190
328 2HD LYS 43 2HD LYS 43 3.880 -4.067 9.612
329 1HE LYS 43 1HE LYS 43 6.230 -3.618 8.705
330 2HE LYS 43 2HE LYS 43 5.777 -1.936 8.520
331 1HZ LYS 43 1HZ LYS 43 6.177 -1.644 10.697
332 H LYS 44 H LYS 44 1.291 -2.018 9.184
333 HA LYS 44 HA LYS 44 1.383 -4.369 10.654
334 1HB LYS 44 1HB LYS 44 1.815 -2.113 11.550
335 2HB LYS 44 2HB LYS 44 0.120 -1.706 11.367
336 1HG LYS 44 1HG LYS 44 0.525 -4.243 12.833
337 2HG LYS 44 2HG LYS 44 1.294 -2.881 13.623
338 1HD LYS 44 1HD LYS 44 -1.477 -2.381 12.615
339 2HD LYS 44 2HD LYS 44 -1.354 -3.531 13.932
340 1HE LYS 44 1HE LYS 44 -1.470 -1.594 15.194
341 2HE LYS 44 2HE LYS 44 0.265 -1.634 14.961
342 1HZ LYS 44 1HZ LYS 44 -0.447 0.524 14.326
343 H GLU 45 H GLU 45 -1.366 -2.573 9.189
344 HA GLU 45 HA GLU 45 -3.378 -3.982 10.423
345 1HB GLU 45 1HB GLU 45 -4.005 -2.026 9.248
346 2HB GLU 45 2HB GLU 45 -3.154 -2.503 7.793
347 1HG GLU 45 1HG GLU 45 -5.540 -2.798 7.403
348 2HG GLU 45 2HG GLU 45 -4.802 -4.384 7.476
349 HE2 GLU 45 HE GLU 45 -6.512 -5.331 10.306
350 H PHE 46 H PHE 46 -1.624 -4.629 7.320
351 HA PHE 46 HA PHE 46 -3.120 -6.994 6.807
352 1HB PHE 46 1HB PHE 46 -0.847 -5.374 5.707
353 2HB PHE 46 2HB PHE 46 -0.712 -7.086 5.360
354 HD1 PHE 46 HD1 PHE 46 -1.148 -7.203 3.071
355 HD2 PHE 46 HD2 PHE 46 -3.805 -5.032 5.566
356 HE1 PHE 46 HE1 PHE 46 -2.738 -6.937 1.147
357 HE2 PHE 46 HE2 PHE 46 -5.395 -4.766 3.643
358 HZ PHE 46 HZ PHE 46 -4.842 -5.721 1.456
359 H ASP 47 H ASP 47 0.456 -6.579 7.323
360 HA ASP 47 HA ASP 47 1.206 -9.046 7.680
361 1HB ASP 47 1HB ASP 47 3.080 -8.039 8.462
362 2HB ASP 47 2HB ASP 47 2.186 -6.532 8.460
363 HD2 ASP 47 HD ASP 47 2.303 -6.213 11.824
364 H LYS 48 H LYS 48 -0.579 -7.042 10.099
365 HA LYS 48 HA LYS 48 -0.475 -8.360 12.374
366 1HB LYS 48 1HB LYS 48 -1.927 -6.544 12.302
367 2HB LYS 48 2HB LYS 48 -2.812 -7.158 10.919
368 1HG LYS 48 1HG LYS 48 -4.254 -8.333 12.233
369 2HG LYS 48 2HG LYS 48 -2.953 -9.036 13.170
370 1HD LYS 48 1HD LYS 48 -3.303 -6.163 13.743
371 2HD LYS 48 2HD LYS 48 -4.763 -7.079 14.056
372 1HE LYS 48 1HE LYS 48 -2.253 -8.362 15.041
373 2HE LYS 48 2HE LYS 48 -2.658 -6.849 15.828
374 1HZ LYS 48 1HZ LYS 48 -5.035 -8.023 15.879
375 H LYS 49 H LYS 49 -3.169 -9.315 10.150
376 HA LYS 49 HA LYS 49 -2.445 -12.103 10.655
377 1HB LYS 49 1HB LYS 49 -4.487 -10.871 12.039
378 2HB LYS 49 2HB LYS 49 -5.340 -11.588 10.689
379 1HG LYS 49 1HG LYS 49 -5.324 -13.439 12.067
380 2HG LYS 49 2HG LYS 49 -3.773 -13.703 11.297
381 1HD LYS 49 1HD LYS 49 -2.614 -13.293 13.225
382 2HD LYS 49 2HD LYS 49 -3.570 -11.876 13.608
383 1HE LYS 49 1HE LYS 49 -4.869 -14.587 13.904
384 2HE LYS 49 2HE LYS 49 -3.697 -14.098 15.112
385 1HZ LYS 49 1HZ LYS 49 -5.770 -13.291 15.871
386 H TYR 50 H TYR 50 -1.503 -11.606 8.441
387 HA TYR 50 HA TYR 50 -3.523 -12.307 6.471
388 1HB TYR 50 1HB TYR 50 -3.033 -9.706 6.727
389 2HB TYR 50 2HB TYR 50 -1.452 -10.075 6.068
390 HD1 TYR 50 HD1 TYR 50 -4.379 -8.667 5.156
391 HD2 TYR 50 HD2 TYR 50 -1.845 -11.874 3.891
392 HE1 TYR 50 HE1 TYR 50 -5.312 -8.484 2.798
393 HE2 TYR 50 HE2 TYR 50 -2.785 -11.679 1.537
394 HH TYR 50 HH TYR 50 -5.248 -10.704 0.660
395 H ASN 51 H ASN 51 -0.080 -11.139 6.463
396 HA ASN 51 HA ASN 51 0.981 -13.685 6.168
397 1HB ASN 51 1HB ASN 51 -0.239 -13.034 3.824
398 2HB ASN 51 2HB ASN 51 1.280 -12.205 3.553
399 1HD2 ASN 51 2HD2 ASN 51 -0.263 -14.900 2.847
400 2HD2 ASN 51 1HD2 ASN 51 1.014 -16.068 2.775
401 HA PRO 52 HA PRO 52 3.737 -10.130 7.007
402 1HB PRO 52 1HB PRO 52 4.636 -10.924 9.463
403 2HB PRO 52 2HB PRO 52 3.278 -9.838 9.244
404 1HG PRO 52 1HG PRO 52 3.261 -12.695 10.002
405 2HG PRO 52 2HG PRO 52 1.991 -11.503 10.189
406 1HD PRO 52 1HD PRO 52 2.130 -13.566 8.200
407 2HD PRO 52 2HD PRO 52 0.922 -12.302 8.317
408 H THR 53 H THR 53 7.016 -11.203 6.681
409 HA THR 53 HA THR 53 5.077 -9.311 7.807
410 HB THR 53 HB THR 53 7.176 -9.602 9.069
411 HG1 THR 53 HG1 THR 53 6.232 -7.418 8.667
412 1HG2 THR 53 1HG2 THR 53 9.224 -8.505 7.663
413 2HG2 THR 53 2HG2 THR 53 8.371 -9.299 6.317
414 3HG2 THR 53 3HG2 THR 53 8.949 -10.264 7.697
415 H TRP 54 H TRP 54 4.853 -7.175 6.919
416 HA TRP 54 HA TRP 54 5.292 -7.224 4.021
417 1HB TRP 54 1HB TRP 54 3.343 -5.624 5.688
418 2HB TRP 54 2HB TRP 54 3.522 -5.511 3.947
419 HD1 TRP 54 HD TRP 54 2.632 -8.308 6.536
420 HE1 TRP 54 HE1 TRP 54 0.860 -9.976 5.517
421 HE3 TRP 54 HE3 TRP 54 2.455 -6.138 1.942
422 HZ2 TRP 54 HZ2 TRP 54 -0.391 -10.196 2.961
423 HZ3 TRP 54 HZ3 TRP 54 0.932 -7.140 0.242
424 HH2 TRP 54 HH TRP 54 -0.459 -9.099 0.690
425 H HIS 55 H HIS 55 5.927 -5.092 3.028
426 HA HIS 55 HA HIS 55 7.260 -3.312 4.901
427 1HB HIS 55 1HB HIS 55 8.670 -4.520 2.506
428 2HB HIS 55 2HB HIS 55 9.330 -3.327 3.607
429 HD1 HIS 55 HD1 HIS 55 9.175 -4.302 6.315
430 HD2 HIS 55 HD2 HIS 55 9.529 -7.021 3.142
431 HE1 HIS 55 HE1 HIS 55 10.071 -6.465 7.324
432 H CYS 56 H CYS 56 6.526 -1.298 4.475
433 HA CYS 56 HA CYS 56 5.900 -0.711 1.672
434 1HB CYS 56 1HB CYS 56 4.099 0.776 2.459
435 2HB CYS 56 2HB CYS 56 3.817 -0.892 2.912
436 HG CYS 56 HG CYS 56 3.066 0.657 4.876
437 H ILE 57 H ILE 57 6.214 1.642 1.118
438 HA ILE 57 HA ILE 57 7.997 3.013 2.987
439 HB ILE 57 HB ILE 57 8.544 2.578 0.049
440 1HG1 ILE 57 1HG1 ILE 57 8.949 0.658 1.732
441 2HG1 ILE 57 2HG1 ILE 57 10.230 1.095 0.620
442 1HG2 ILE 57 1HG2 ILE 57 10.784 3.685 0.830
443 2HG2 ILE 57 2HG2 ILE 57 9.762 4.385 2.107
444 3HG2 ILE 57 3HG2 ILE 57 9.383 4.692 0.396
445 1HD1 ILE 57 1HD1 ILE 57 10.293 2.657 3.135
446 2HD1 ILE 57 2HD1 ILE 57 11.609 1.804 2.294
447 3HD1 ILE 57 3HD1 ILE 57 10.511 0.907 3.369
448 H VAL 58 H VAL 58 8.088 5.364 2.625
449 HA VAL 58 HA VAL 58 5.733 6.298 1.136
450 HB VAL 58 HB VAL 58 5.454 6.292 3.609
451 1HG1 VAL 58 1HG1 VAL 58 6.979 7.125 5.016
452 2HG1 VAL 58 2HG1 VAL 58 7.072 8.657 4.113
453 3HG1 VAL 58 3HG1 VAL 58 8.075 7.271 3.620
454 1HG2 VAL 58 1HG2 VAL 58 3.982 7.853 2.962
455 2HG2 VAL 58 2HG2 VAL 58 5.116 8.554 1.783
456 3HG2 VAL 58 3HG2 VAL 58 5.186 9.051 3.492
457 H GLY 59 H GLY 59 7.225 6.530 -0.704
458 1HA GLY 59 2HA GLY 59 9.039 8.844 -0.365
459 2HA GLY 59 1HA GLY 59 9.341 7.499 -1.448
460 H ARG 60 H ARG 60 8.728 7.725 -3.561
461 HA ARG 60 HA ARG 60 6.368 9.211 -4.148
462 1HB ARG 60 1HB ARG 60 9.031 10.414 -4.415
463 2HB ARG 60 2HB ARG 60 8.243 10.324 -5.977
464 1HG ARG 60 1HG ARG 60 6.230 11.462 -5.040
465 2HG ARG 60 2HG ARG 60 6.990 11.528 -3.462
466 1HD ARG 60 1HD ARG 60 8.622 12.662 -5.696
467 2HD ARG 60 2HD ARG 60 7.152 13.542 -5.331
468 HE ARG 60 HE ARG 60 9.533 13.457 -3.703
469 1HH1 ARG 60 2HH2 ARG 60 6.001 13.588 -3.437
470 2HH1 ARG 60 1HH2 ARG 60 6.024 14.367 -1.889
471 1HH2 ARG 60 1HH ARG 60 8.126 14.883 -0.864
472 H ASN 61 H ASN 61 9.365 7.557 -5.297
473 HA ASN 61 HA ASN 61 7.716 6.064 -7.123
474 1HB ASN 61 1HB ASN 61 8.704 8.092 -8.373
475 2HB ASN 61 2HB ASN 61 10.292 7.415 -8.075
476 1HD2 ASN 61 2HD2 ASN 61 7.246 7.046 -9.727
477 2HD2 ASN 61 1HD2 ASN 61 7.726 5.844 -10.879
478 H PHE 62 H PHE 62 8.915 4.062 -7.881
479 HA PHE 62 HA PHE 62 11.397 3.549 -6.444
480 1HB PHE 62 1HB PHE 62 9.025 1.606 -6.530
481 2HB PHE 62 2HB PHE 62 10.448 1.483 -5.516
482 HD1 PHE 62 HD1 PHE 62 7.281 3.296 -6.012
483 HD2 PHE 62 HD2 PHE 62 10.576 2.631 -3.423
484 HE1 PHE 62 HE1 PHE 62 6.059 4.463 -4.156
485 HE2 PHE 62 HE2 PHE 62 9.355 3.799 -1.568
486 HZ PHE 62 HZ PHE 62 7.110 4.701 -1.956
487 H GLY 63 H GLY 63 11.112 0.626 -7.112
488 1HA GLY 63 2HA GLY 63 10.777 0.383 -9.931
489 2HA GLY 63 1HA GLY 63 12.469 0.551 -9.509
490 H SER 64 H SER 64 13.417 -1.443 -9.537
491 HA SER 64 HA SER 64 13.873 -3.491 -8.963
492 1HB SER 64 1HB SER 64 12.079 -2.666 -6.801
493 2HB SER 64 2HB SER 64 11.915 -4.381 -7.126
494 HG SER 64 HG SER 64 14.580 -3.518 -7.093
495 H TYR 65 H TYR 65 10.361 -3.871 -8.232
496 HA TYR 65 HA TYR 65 8.960 -5.437 -9.059
497 1HB TYR 65 1HB TYR 65 8.403 -3.430 -10.344
498 2HB TYR 65 2HB TYR 65 9.861 -3.559 -11.308
499 HD1 TYR 65 HD1 TYR 65 7.079 -5.968 -10.542
500 HD2 TYR 65 HD2 TYR 65 9.330 -3.901 -13.535
501 HE1 TYR 65 HE1 TYR 65 5.776 -7.173 -12.362
502 HE2 TYR 65 HE2 TYR 65 8.020 -5.113 -15.346
503 HH TYR 65 HH TYR 65 6.077 -6.252 -15.703
504 H VAL 66 H VAL 66 10.594 -5.156 -12.215
505 HA VAL 66 HA VAL 66 10.887 -8.024 -12.252
506 HB VAL 66 HB VAL 66 9.977 -6.663 -14.135
507 1HG1 VAL 66 1HG1 VAL 66 11.075 -4.894 -14.934
508 2HG1 VAL 66 2HG1 VAL 66 12.471 -5.918 -15.349
509 3HG1 VAL 66 3HG1 VAL 66 12.363 -5.169 -13.738
510 1HG2 VAL 66 1HG2 VAL 66 10.600 -8.281 -15.573
511 2HG2 VAL 66 2HG2 VAL 66 11.493 -8.949 -14.185
512 3HG2 VAL 66 3HG2 VAL 66 12.333 -7.927 -15.376
513 H THR 67 H THR 67 12.444 -7.227 -10.205
514 HA THR 67 HA THR 67 15.082 -7.835 -11.204
515 HB THR 67 HB THR 67 14.351 -5.150 -9.940
516 HG1 THR 67 HG1 THR 67 14.786 -4.635 -12.048
517 1HG2 THR 67 1HG2 THR 67 17.109 -5.194 -10.510
518 2HG2 THR 67 2HG2 THR 67 16.829 -6.734 -9.664
519 3HG2 THR 67 3HG2 THR 67 16.388 -5.197 -8.884
520 H HIS 68 H HIS 68 13.306 -6.622 -8.278
521 HA HIS 68 HA HIS 68 14.803 -8.575 -6.735
522 1HB HIS 68 1HB HIS 68 13.485 -5.995 -6.199
523 2HB HIS 68 2HB HIS 68 13.219 -7.202 -4.955
524 HD1 HIS 68 HD1 HIS 68 14.722 -5.946 -3.247
525 HD2 HIS 68 HD2 HIS 68 16.713 -7.106 -6.750
526 HE1 HIS 68 HE1 HIS 68 17.212 -5.633 -2.790
527 H GLU 69 H GLU 69 11.501 -7.726 -7.826
528 HA GLU 69 HA GLU 69 9.619 -8.806 -7.783
529 1HB GLU 69 1HB GLU 69 11.454 -11.227 -7.560
530 2HB GLU 69 2HB GLU 69 9.723 -11.366 -7.796
531 1HG GLU 69 1HG GLU 69 10.023 -9.809 -9.845
532 2HG GLU 69 2HG GLU 69 11.747 -10.062 -9.664
533 HE2 GLU 69 HE GLU 69 12.484 -11.791 -10.682
534 H THR 70 H THR 70 7.992 -9.898 -6.382
535 HA THR 70 HA THR 70 8.858 -10.580 -3.704
536 HB THR 70 HB THR 70 7.608 -8.805 -2.620
537 HG1 THR 70 HG1 THR 70 6.209 -7.498 -3.951
538 1HG2 THR 70 1HG2 THR 70 8.551 -6.712 -3.556
539 2HG2 THR 70 2HG2 THR 70 8.953 -7.555 -5.072
540 3HG2 THR 70 3HG2 THR 70 9.797 -7.983 -3.565
541 H ARG 71 H ARG 71 5.955 -10.005 -2.861
542 HA ARG 71 HA ARG 71 4.865 -12.319 -4.257
543 1HB ARG 71 1HB ARG 71 5.170 -11.721 -1.383
544 2HB ARG 71 2HB ARG 71 3.511 -12.112 -1.786
545 1HG ARG 71 1HG ARG 71 4.218 -14.282 -1.559
546 2HG ARG 71 2HG ARG 71 4.800 -14.073 -3.199
547 1HD ARG 71 1HD ARG 71 6.755 -14.829 -2.172
548 2HD ARG 71 2HD ARG 71 6.974 -13.100 -1.992
549 HE ARG 71 HE ARG 71 5.628 -13.671 0.302
550 1HH1 ARG 71 2HH2 ARG 71 8.388 -15.303 -1.207
551 2HH1 ARG 71 1HH2 ARG 71 9.038 -15.865 0.297
552 1HH2 ARG 71 1HH ARG 71 7.902 -15.330 2.338
553 H HIS 72 H HIS 72 3.745 -9.645 -2.037
554 HA HIS 72 HA HIS 72 1.753 -8.973 -4.068
555 1HB HIS 72 1HB HIS 72 1.303 -9.916 -1.307
556 2HB HIS 72 2HB HIS 72 0.426 -8.456 -1.723
557 HD1 HIS 72 HD1 HIS 72 0.109 -12.033 -1.867
558 HD2 HIS 72 HD2 HIS 72 -1.067 -8.861 -4.347
559 HE1 HIS 72 HE1 HIS 72 -1.735 -12.950 -3.375
560 H PHE 73 H PHE 73 2.038 -6.894 -4.679
561 HA PHE 73 HA PHE 73 2.778 -4.982 -2.602
562 1HB PHE 73 1HB PHE 73 4.255 -4.030 -4.640
563 2HB PHE 73 2HB PHE 73 4.907 -5.291 -3.613
564 HD1 PHE 73 HD1 PHE 73 4.285 -7.760 -4.424
565 HD2 PHE 73 HD2 PHE 73 4.387 -4.330 -6.920
566 HE1 PHE 73 HE1 PHE 73 4.603 -9.231 -6.433
567 HE2 PHE 73 HE2 PHE 73 4.704 -5.801 -8.929
568 HZ PHE 73 HZ PHE 73 4.809 -8.234 -8.661
569 H ILE 74 H ILE 74 2.338 -2.701 -3.254
570 HA ILE 74 HA ILE 74 0.834 -2.253 -5.634
571 HB ILE 74 HB ILE 74 -1.082 -3.033 -4.760
572 1HG1 ILE 74 1HG1 ILE 74 -1.032 -0.360 -3.329
573 2HG1 ILE 74 2HG1 ILE 74 -1.303 -0.552 -5.049
574 1HG2 ILE 74 1HG2 ILE 74 -1.604 -2.939 -2.257
575 2HG2 ILE 74 2HG2 ILE 74 0.106 -2.492 -2.040
576 3HG2 ILE 74 3HG2 ILE 74 -0.318 -4.050 -2.789
577 1HD1 ILE 74 1HD1 ILE 74 -3.125 -1.114 -2.776
578 2HD1 ILE 74 2HD1 ILE 74 -3.112 -2.374 -4.033
579 3HD1 ILE 74 3HD1 ILE 74 -3.507 -0.691 -4.462
580 H TYR 75 H TYR 75 1.533 -0.295 -6.283
581 HA TYR 75 HA TYR 75 2.312 1.596 -4.169
582 1HB TYR 75 1HB TYR 75 4.235 1.101 -5.514
583 2HB TYR 75 2HB TYR 75 3.265 0.791 -6.940
584 HD1 TYR 75 HD1 TYR 75 3.973 2.210 -8.638
585 HD2 TYR 75 HD2 TYR 75 3.499 3.790 -4.690
586 HE1 TYR 75 HE1 TYR 75 4.504 4.543 -9.500
587 HE2 TYR 75 HE2 TYR 75 4.031 6.117 -5.565
588 HH TYR 75 HH TYR 75 5.493 6.927 -7.749
589 H PHE 76 H PHE 76 0.869 3.216 -3.874
590 HA PHE 76 HA PHE 76 -0.243 4.454 -6.258
591 1HB PHE 76 1HB PHE 76 -2.499 4.440 -4.984
592 2HB PHE 76 2HB PHE 76 -1.988 2.878 -5.589
593 HD1 PHE 76 HD1 PHE 76 -0.504 1.487 -3.862
594 HD2 PHE 76 HD2 PHE 76 -3.230 4.562 -2.801
595 HE1 PHE 76 HE1 PHE 76 -0.679 0.533 -1.547
596 HE2 PHE 76 HE2 PHE 76 -3.406 3.606 -0.486
597 HZ PHE 76 HZ PHE 76 -2.129 1.604 0.113
598 H TYR 77 H TYR 77 -1.768 6.419 -5.313
599 HA TYR 77 HA TYR 77 0.007 7.804 -3.428
600 1HB TYR 77 1HB TYR 77 -0.648 8.491 -5.947
601 2HB TYR 77 2HB TYR 77 -2.172 8.978 -5.232
602 HD1 TYR 77 HD1 TYR 77 -2.204 11.311 -5.318
603 HD2 TYR 77 HD2 TYR 77 1.316 9.332 -3.903
604 HE1 TYR 77 HE1 TYR 77 -1.188 13.554 -4.688
605 HE2 TYR 77 HE2 TYR 77 2.320 11.582 -3.278
606 HH TYR 77 HH TYR 77 0.436 14.558 -3.631
607 H LEU 78 H LEU 78 -0.732 8.032 -1.382
608 HA LEU 78 HA LEU 78 -3.603 7.761 -0.953
609 1HB LEU 78 1HB LEU 78 -1.496 6.602 0.290
610 2HB LEU 78 2HB LEU 78 -1.737 7.994 1.328
611 HG LEU 78 HG LEU 78 -4.042 7.336 1.761
612 1HD1 LEU 78 1HD1 LEU 78 -4.352 4.756 0.828
613 2HD1 LEU 78 2HD1 LEU 78 -3.601 5.599 -0.548
614 3HD1 LEU 78 3HD1 LEU 78 -5.115 6.218 0.158
615 1HD2 LEU 78 1HD2 LEU 78 -3.233 6.155 3.451
616 2HD2 LEU 78 2HD2 LEU 78 -1.722 5.880 2.551
617 3HD2 LEU 78 3HD2 LEU 78 -3.075 4.734 2.391
618 H GLY 79 H GLY 79 -4.692 9.648 -1.213
619 1HA GLY 79 2HA GLY 79 -5.349 11.758 -0.786
620 2HA GLY 79 1HA GLY 79 -4.241 11.795 0.571
621 H GLN 80 H GLN 80 -1.904 12.273 0.135
622 HA GLN 80 HA GLN 80 -1.384 13.425 -2.443
623 1HB GLN 80 1HB GLN 80 -2.196 15.071 -0.251
624 2HB GLN 80 2HB GLN 80 -0.476 15.338 -0.461
625 1HG GLN 80 1HG GLN 80 -0.725 16.218 -2.611
626 2HG GLN 80 2HG GLN 80 -2.162 15.276 -2.953
627 1HE2 GLN 80 2HE2 GLN 80 -0.876 18.005 -1.136
628 2HE2 GLN 80 1HE2 GLN 80 -2.349 18.900 -0.979
629 H VAL 81 H VAL 81 -0.488 11.124 -0.696
630 HA VAL 81 HA VAL 81 2.358 11.801 -0.756
631 HB VAL 81 HB VAL 81 1.062 10.224 1.469
632 1HG1 VAL 81 1HG1 VAL 81 3.152 9.717 2.056
633 2HG1 VAL 81 2HG1 VAL 81 3.559 11.446 2.161
634 3HG1 VAL 81 3HG1 VAL 81 3.759 10.577 0.622
635 1HG2 VAL 81 1HG2 VAL 81 1.414 13.162 1.141
636 2HG2 VAL 81 2HG2 VAL 81 1.859 12.473 2.720
637 3HG2 VAL 81 3HG2 VAL 81 0.214 12.244 2.083
638 H ALA 82 H ALA 82 3.741 9.989 -1.220
639 HA ALA 82 HA ALA 82 2.363 7.982 -2.770
640 1HB ALA 82 1HB ALA 82 4.947 9.273 -2.726
641 2HB ALA 82 2HB ALA 82 4.230 8.245 -3.990
642 3HB ALA 82 3HB ALA 82 5.165 7.507 -2.667
643 H ILE 83 H ILE 83 2.343 5.747 -2.345
644 HA ILE 83 HA ILE 83 3.657 4.829 0.068
645 HB ILE 83 HB ILE 83 1.193 5.773 0.423
646 1HG1 ILE 83 1HG1 ILE 83 2.005 3.191 1.763
647 2HG1 ILE 83 2HG1 ILE 83 2.884 4.683 2.034
648 1HG2 ILE 83 1HG2 ILE 83 0.278 4.203 -1.311
649 2HG2 ILE 83 2HG2 ILE 83 -0.504 4.108 0.284
650 3HG2 ILE 83 3HG2 ILE 83 0.665 2.860 -0.207
651 1HD1 ILE 83 1HD1 ILE 83 0.879 5.802 2.865
652 2HD1 ILE 83 2HD1 ILE 83 1.059 4.255 3.728
653 3HD1 ILE 83 3HD1 ILE 83 -0.132 4.408 2.414
654 H LEU 84 H LEU 84 4.715 3.018 -0.516
655 HA LEU 84 HA LEU 84 3.400 1.320 -2.521
656 1HB LEU 84 1HB LEU 84 5.097 2.173 -3.776
657 2HB LEU 84 2HB LEU 84 6.161 2.413 -2.404
658 HG LEU 84 HG LEU 84 5.649 -0.420 -2.875
659 1HD1 LEU 84 1HD1 LEU 84 7.323 -0.146 -4.987
660 2HD1 LEU 84 2HD1 LEU 84 6.285 1.284 -5.209
661 3HD1 LEU 84 3HD1 LEU 84 5.558 -0.339 -5.123
662 1HD2 LEU 84 1HD2 LEU 84 7.440 0.488 -1.450
663 2HD2 LEU 84 2HD2 LEU 84 8.207 1.207 -2.887
664 3HD2 LEU 84 3HD2 LEU 84 8.069 -0.562 -2.742
665 H LEU 85 H LEU 85 2.661 -0.449 -1.474
666 HA LEU 85 HA LEU 85 4.290 -1.452 0.745
667 1HB LEU 85 1HB LEU 85 2.080 -0.897 1.414
668 2HB LEU 85 2HB LEU 85 1.373 -1.736 0.049
669 HG LEU 85 HG LEU 85 2.776 -3.751 1.314
670 1HD1 LEU 85 1HD1 LEU 85 1.954 -1.704 3.327
671 2HD1 LEU 85 2HD1 LEU 85 3.349 -2.808 3.314
672 3HD1 LEU 85 3HD1 LEU 85 1.730 -3.425 3.723
673 1HD2 LEU 85 1HD2 LEU 85 0.263 -3.358 0.436
674 2HD2 LEU 85 2HD2 LEU 85 -0.026 -3.347 2.192
675 3HD2 LEU 85 3HD2 LEU 85 0.754 -4.752 1.428
676 H PHE 86 H PHE 86 4.927 -3.653 0.823
677 HA PHE 86 HA PHE 86 4.210 -5.398 -1.321
678 1HB PHE 86 1HB PHE 86 6.518 -5.544 -2.229
679 2HB PHE 86 2HB PHE 86 6.001 -3.871 -2.302
680 HD1 PHE 86 HD1 PHE 86 7.017 -2.191 -0.883
681 HD2 PHE 86 HD2 PHE 86 8.216 -6.253 -0.620
682 HE1 PHE 86 HE1 PHE 86 9.048 -1.507 0.423
683 HE2 PHE 86 HE2 PHE 86 10.249 -5.569 0.686
684 HZ PHE 86 HZ PHE 86 10.639 -3.204 1.190
685 H LYS 87 H LYS 87 4.669 -7.575 -0.823
686 HA LYS 87 HA LYS 87 5.830 -7.939 1.848
687 1HB LYS 87 1HB LYS 87 3.663 -8.696 2.048
688 2HB LYS 87 2HB LYS 87 3.569 -9.246 0.388
689 1HG LYS 87 1HG LYS 87 3.687 -11.213 1.808
690 2HG LYS 87 2HG LYS 87 5.209 -11.088 0.945
691 1HD LYS 87 1HD LYS 87 6.280 -10.040 2.921
692 2HD LYS 87 2HD LYS 87 4.754 -10.052 3.783
693 1HE LYS 87 1HE LYS 87 5.594 -12.035 4.621
694 2HE LYS 87 2HE LYS 87 4.867 -12.689 3.166
695 1HZ LYS 87 1HZ LYS 87 7.370 -11.810 2.394
696 H SER 88 H SER 88 7.984 -8.331 1.561
697 HA SER 88 HA SER 88 8.580 -10.541 -0.236
698 1HB SER 88 1HB SER 88 10.677 -9.413 -0.921
699 2HB SER 88 2HB SER 88 9.269 -8.476 -1.377
700 HG SER 88 HG SER 88 10.263 -7.852 1.176
701 H GLY 89 H GLY 89 9.338 -12.190 1.036
702 1HA GLY 89 2HA GLY 89 11.397 -11.603 3.013
703 2HA GLY 89 1HA GLY 89 9.895 -12.267 3.629
Start of MODEL 4
1 1H MET 1 H MET 1 -16.075 20.813 -8.000
2 HA MET 1 HA MET 1 -14.317 19.981 -9.020
3 1HB MET 1 1HB MET 1 -13.760 22.934 -8.621
4 2HB MET 1 2HB MET 1 -12.501 21.969 -9.366
5 1HG MET 1 1HG MET 1 -14.110 21.194 -11.110
6 2HG MET 1 2HG MET 1 -15.393 22.116 -10.354
7 1HE MET 1 1HE MET 1 -15.160 24.646 -13.054
8 2HE MET 1 2HE MET 1 -14.990 22.909 -13.403
9 3HE MET 1 3HE MET 1 -16.091 23.455 -12.114
10 H SER 2 H SER 2 -13.705 18.484 -7.271
11 HA SER 2 HA SER 2 -11.022 19.027 -6.438
12 1HB SER 2 1HB SER 2 -11.581 18.357 -4.024
13 2HB SER 2 2HB SER 2 -12.053 19.972 -4.510
14 HG SER 2 HG SER 2 -13.945 17.862 -4.863
15 H ASP 3 H ASP 3 -10.888 17.251 -8.096
16 HA ASP 3 HA ASP 3 -11.935 14.727 -7.152
17 1HB ASP 3 1HB ASP 3 -10.879 13.964 -9.428
18 2HB ASP 3 2HB ASP 3 -12.341 14.926 -9.457
19 HD2 ASP 3 HD ASP 3 -11.749 17.003 -11.187
20 H ARG 4 H ARG 4 -10.520 13.868 -5.584
21 HA ARG 4 HA ARG 4 -7.803 13.477 -6.474
22 1HB ARG 4 1HB ARG 4 -8.646 14.896 -3.922
23 2HB ARG 4 2HB ARG 4 -7.136 14.008 -3.963
24 1HG ARG 4 1HG ARG 4 -6.102 15.615 -5.207
25 2HG ARG 4 2HG ARG 4 -7.435 15.709 -6.341
26 1HD ARG 4 1HD ARG 4 -8.481 17.443 -5.197
27 2HD ARG 4 2HD ARG 4 -7.943 16.880 -3.626
28 HE ARG 4 HE ARG 4 -6.083 18.271 -3.825
29 1HH1 ARG 4 2HH2 ARG 4 -7.315 17.605 -7.079
30 2HH1 ARG 4 1HH2 ARG 4 -6.192 18.670 -7.856
31 1HH2 ARG 4 1HH ARG 4 -4.607 19.879 -6.526
32 H LYS 5 H LYS 5 -10.205 11.760 -6.250
33 HA LYS 5 HA LYS 5 -10.359 10.294 -3.940
34 1HB LYS 5 1HB LYS 5 -11.441 10.200 -6.516
35 2HB LYS 5 2HB LYS 5 -10.648 8.649 -6.331
36 1HG LYS 5 1HG LYS 5 -12.530 8.019 -5.206
37 2HG LYS 5 2HG LYS 5 -11.863 8.920 -3.858
38 1HD LYS 5 1HD LYS 5 -13.126 10.850 -5.549
39 2HD LYS 5 2HD LYS 5 -14.237 9.498 -5.444
40 1HE LYS 5 1HE LYS 5 -12.936 10.438 -2.890
41 2HE LYS 5 2HE LYS 5 -14.191 11.447 -3.582
42 1HZ LYS 5 1HZ LYS 5 -14.601 8.546 -3.134
43 H ALA 6 H ALA 6 -9.629 7.908 -3.694
44 HA ALA 6 HA ALA 6 -6.819 7.919 -3.587
45 1HB ALA 6 1HB ALA 6 -8.988 6.438 -2.530
46 2HB ALA 6 2HB ALA 6 -7.262 6.272 -2.126
47 3HB ALA 6 3HB ALA 6 -7.976 5.267 -3.410
48 H VAL 7 H VAL 7 -5.693 8.051 -5.502
49 HA VAL 7 HA VAL 7 -6.590 6.504 -7.766
50 HB VAL 7 HB VAL 7 -4.296 8.409 -7.289
51 1HG1 VAL 7 1HG1 VAL 7 -5.070 6.914 -9.814
52 2HG1 VAL 7 2HG1 VAL 7 -3.528 6.829 -8.931
53 3HG1 VAL 7 3HG1 VAL 7 -3.986 8.326 -9.779
54 1HG2 VAL 7 1HG2 VAL 7 -6.629 9.339 -7.374
55 2HG2 VAL 7 2HG2 VAL 7 -6.755 8.722 -9.038
56 3HG2 VAL 7 3HG2 VAL 7 -5.541 9.961 -8.638
57 H ILE 8 H ILE 8 -4.898 5.145 -8.977
58 HA ILE 8 HA ILE 8 -2.999 3.891 -7.166
59 HB ILE 8 HB ILE 8 -5.460 2.627 -8.239
60 1HG1 ILE 8 1HG1 ILE 8 -4.615 1.214 -6.049
61 2HG1 ILE 8 2HG1 ILE 8 -3.952 2.799 -5.708
62 1HG2 ILE 8 1HG2 ILE 8 -4.422 0.393 -8.243
63 2HG2 ILE 8 2HG2 ILE 8 -2.822 1.147 -8.038
64 3HG2 ILE 8 3HG2 ILE 8 -3.763 1.448 -9.517
65 1HD1 ILE 8 1HD1 ILE 8 -6.017 3.374 -4.964
66 2HD1 ILE 8 2HD1 ILE 8 -6.747 1.910 -5.664
67 3HD1 ILE 8 3HD1 ILE 8 -6.533 3.364 -6.668
68 H LYS 9 H LYS 9 -1.140 3.203 -8.207
69 HA LYS 9 HA LYS 9 -1.021 3.923 -11.028
70 1HB LYS 9 1HB LYS 9 0.993 3.628 -8.818
71 2HB LYS 9 2HB LYS 9 1.518 3.494 -10.484
72 1HG LYS 9 1HG LYS 9 1.651 5.773 -10.432
73 2HG LYS 9 2HG LYS 9 -0.090 5.739 -10.624
74 1HD LYS 9 1HD LYS 9 -0.191 6.882 -8.658
75 2HD LYS 9 2HD LYS 9 0.204 5.364 -7.876
76 1HE LYS 9 1HE LYS 9 2.696 6.381 -8.781
77 2HE LYS 9 2HE LYS 9 1.841 7.777 -8.155
78 1HZ LYS 9 1HZ LYS 9 1.905 5.284 -6.576
79 H ASN 10 H ASN 10 1.236 1.578 -9.696
80 HA ASN 10 HA ASN 10 -0.037 -0.406 -11.407
81 1HB ASN 10 1HB ASN 10 2.666 0.539 -11.264
82 2HB ASN 10 2HB ASN 10 2.694 -1.087 -10.613
83 1HD2 ASN 10 2HD2 ASN 10 4.057 -1.205 -12.641
84 2HD2 ASN 10 1HD2 ASN 10 3.274 -1.710 -14.101
85 H ALA 11 H ALA 11 -0.951 -2.134 -10.280
86 HA ALA 11 HA ALA 11 0.378 -3.155 -7.936
87 1HB ALA 11 1HB ALA 11 -2.499 -2.218 -7.684
88 2HB ALA 11 2HB ALA 11 -1.117 -1.215 -7.181
89 3HB ALA 11 3HB ALA 11 -1.407 -2.787 -6.398
90 H ASP 12 H ASP 12 0.520 -4.694 -9.916
91 HA ASP 12 HA ASP 12 -1.671 -5.909 -10.967
92 1HB ASP 12 1HB ASP 12 1.178 -6.375 -10.816
93 2HB ASP 12 2HB ASP 12 0.370 -7.907 -10.543
94 HD2 ASP 12 HD ASP 12 0.445 -8.169 -13.988
95 H MET 13 H MET 13 -3.346 -6.571 -9.546
96 HA MET 13 HA MET 13 -2.876 -8.916 -8.060
97 1HB MET 13 1HB MET 13 -2.299 -6.566 -6.668
98 2HB MET 13 2HB MET 13 -3.983 -6.810 -6.245
99 1HG MET 13 1HG MET 13 -2.599 -7.955 -4.585
100 2HG MET 13 2HG MET 13 -3.435 -9.168 -5.533
101 1HE MET 13 1HE MET 13 -2.489 -10.904 -6.771
102 2HE MET 13 2HE MET 13 -0.776 -11.379 -6.675
103 3HE MET 13 3HE MET 13 -1.742 -11.231 -5.187
104 H SER 14 H SER 14 -5.040 -9.362 -6.634
105 HA SER 14 HA SER 14 -7.154 -8.920 -8.532
106 1HB SER 14 1HB SER 14 -6.964 -11.186 -7.805
107 2HB SER 14 2HB SER 14 -6.799 -10.728 -6.122
108 HG SER 14 HG SER 14 -9.200 -10.035 -7.529
109 H GLU 15 H GLU 15 -9.208 -7.950 -7.975
110 HA GLU 15 HA GLU 15 -9.096 -5.701 -6.502
111 1HB GLU 15 1HB GLU 15 -10.953 -6.799 -8.107
112 2HB GLU 15 2HB GLU 15 -11.717 -7.180 -6.576
113 1HG GLU 15 1HG GLU 15 -12.153 -4.963 -6.073
114 2HG GLU 15 2HG GLU 15 -10.679 -4.385 -6.826
115 HE2 GLU 15 HE GLU 15 -14.078 -4.250 -8.704
116 H GLU 16 H GLU 16 -9.331 -8.995 -5.359
117 HA GLU 16 HA GLU 16 -10.658 -8.589 -2.980
118 1HB GLU 16 1HB GLU 16 -9.386 -10.718 -4.286
119 2HB GLU 16 2HB GLU 16 -8.470 -10.554 -2.803
120 1HG GLU 16 1HG GLU 16 -10.200 -11.303 -1.506
121 2HG GLU 16 2HG GLU 16 -11.384 -10.331 -2.357
122 HE2 GLU 16 HE GLU 16 -11.863 -11.822 -4.878
123 H MET 17 H MET 17 -7.059 -8.840 -3.501
124 HA MET 17 HA MET 17 -6.610 -7.727 -0.921
125 1HB MET 17 1HB MET 17 -5.119 -9.464 -1.955
126 2HB MET 17 2HB MET 17 -4.729 -8.365 -3.263
127 1HG MET 17 1HG MET 17 -3.862 -6.733 -1.445
128 2HG MET 17 2HG MET 17 -4.000 -8.064 -0.316
129 1HE MET 17 1HE MET 17 -0.270 -7.187 -1.926
130 2HE MET 17 2HE MET 17 -1.683 -6.192 -1.499
131 3HE MET 17 3HE MET 17 -0.984 -7.305 -0.300
132 H GLN 18 H GLN 18 -6.670 -6.600 -4.300
133 HA GLN 18 HA GLN 18 -5.250 -4.243 -3.874
134 1HB GLN 18 1HB GLN 18 -5.732 -5.278 -6.110
135 2HB GLN 18 2HB GLN 18 -7.417 -4.827 -5.944
136 1HG GLN 18 1HG GLN 18 -6.936 -2.786 -6.800
137 2HG GLN 18 2HG GLN 18 -5.927 -2.454 -5.407
138 1HE2 GLN 18 2HE2 GLN 18 -5.672 -1.740 -8.259
139 2HE2 GLN 18 1HE2 GLN 18 -4.111 -2.286 -8.774
140 H GLN 19 H GLN 19 -8.775 -5.044 -3.759
141 HA GLN 19 HA GLN 19 -9.517 -2.381 -3.232
142 1HB GLN 19 1HB GLN 19 -10.951 -4.285 -4.221
143 2HB GLN 19 2HB GLN 19 -11.140 -4.869 -2.581
144 1HG GLN 19 1HG GLN 19 -12.055 -2.203 -3.727
145 2HG GLN 19 2HG GLN 19 -13.045 -3.462 -3.013
146 1HE2 GLN 19 2HE2 GLN 19 -11.660 -0.525 -2.517
147 2HE2 GLN 19 1HE2 GLN 19 -11.615 -0.459 -0.786
148 H ASP 20 H ASP 20 -9.252 -5.368 -1.180
149 HA ASP 20 HA ASP 20 -10.018 -4.238 1.173
150 1HB ASP 20 1HB ASP 20 -9.403 -6.696 0.573
151 2HB ASP 20 2HB ASP 20 -7.747 -6.253 0.938
152 HD2 ASP 20 HD ASP 20 -7.723 -7.393 3.473
153 H ALA 21 H ALA 21 -6.698 -4.577 -0.283
154 HA ALA 21 HA ALA 21 -5.281 -3.379 1.779
155 1HB ALA 21 1HB ALA 21 -4.272 -4.688 -0.043
156 2HB ALA 21 2HB ALA 21 -3.538 -3.070 0.044
157 3HB ALA 21 3HB ALA 21 -4.738 -3.434 -1.218
158 H VAL 22 H VAL 22 -6.032 -1.834 -1.426
159 HA VAL 22 HA VAL 22 -5.420 0.709 -0.798
160 HB VAL 22 HB VAL 22 -6.368 -0.453 -2.940
161 1HG1 VAL 22 1HG1 VAL 22 -8.864 0.713 -1.670
162 2HG1 VAL 22 2HG1 VAL 22 -8.589 -0.956 -2.224
163 3HG1 VAL 22 3HG1 VAL 22 -8.717 0.364 -3.409
164 1HG2 VAL 22 1HG2 VAL 22 -6.416 2.408 -2.089
165 2HG2 VAL 22 2HG2 VAL 22 -7.212 1.995 -3.628
166 3HG2 VAL 22 3HG2 VAL 22 -5.492 1.609 -3.385
167 H ASP 23 H ASP 23 -8.108 -1.210 0.438
168 HA ASP 23 HA ASP 23 -9.737 0.891 1.215
169 1HB ASP 23 1HB ASP 23 -9.789 -1.898 1.346
170 2HB ASP 23 2HB ASP 23 -9.681 -1.450 3.036
171 HD2 ASP 23 HD ASP 23 -12.342 0.618 2.937
172 H CYS 24 H CYS 24 -7.399 -1.178 3.108
173 HA CYS 24 HA CYS 24 -7.567 0.337 5.442
174 1HB CYS 24 1HB CYS 24 -5.613 -0.907 6.184
175 2HB CYS 24 2HB CYS 24 -6.745 -1.981 5.386
176 HG CYS 24 HG CYS 24 -3.948 -2.182 4.930
177 H ALA 25 H ALA 25 -5.514 0.487 2.497
178 HA ALA 25 HA ALA 25 -3.631 2.311 3.451
179 1HB ALA 25 1HB ALA 25 -4.446 2.443 0.589
180 2HB ALA 25 2HB ALA 25 -3.964 0.839 1.193
181 3HB ALA 25 3HB ALA 25 -2.836 2.211 1.311
182 H THR 26 H THR 26 -6.271 3.055 1.071
183 HA THR 26 HA THR 26 -6.194 5.777 1.351
184 HB THR 26 HB THR 26 -8.599 3.949 0.832
185 HG1 THR 26 HG1 THR 26 -7.758 4.335 -1.395
186 1HG2 THR 26 1HG2 THR 26 -9.551 5.785 -0.391
187 2HG2 THR 26 2HG2 THR 26 -8.029 6.709 -0.335
188 3HG2 THR 26 3HG2 THR 26 -9.007 6.513 1.139
189 H GLN 27 H GLN 27 -8.197 3.450 3.268
190 HA GLN 27 HA GLN 27 -9.512 5.324 4.747
191 1HB GLN 27 1HB GLN 27 -10.163 3.000 4.834
192 2HB GLN 27 2HB GLN 27 -8.592 2.508 5.435
193 1HG GLN 27 1HG GLN 27 -8.979 3.447 7.592
194 2HG GLN 27 2HG GLN 27 -10.266 4.487 7.015
195 1HE2 GLN 27 2HE2 GLN 27 -11.095 3.350 9.063
196 2HE2 GLN 27 1HE2 GLN 27 -12.065 1.935 8.823
197 H ALA 28 H ALA 28 -6.266 3.840 5.280
198 HA ALA 28 HA ALA 28 -5.767 4.882 7.790
199 1HB ALA 28 1HB ALA 28 -3.405 4.501 7.213
200 2HB ALA 28 2HB ALA 28 -3.834 4.384 5.488
201 3HB ALA 28 3HB ALA 28 -4.417 3.154 6.636
202 H LEU 29 H LEU 29 -4.940 6.256 4.527
203 HA LEU 29 HA LEU 29 -3.937 8.656 5.604
204 1HB LEU 29 1HB LEU 29 -3.838 7.407 3.203
205 2HB LEU 29 2HB LEU 29 -5.024 8.649 2.857
206 HG LEU 29 HG LEU 29 -2.936 9.978 4.201
207 1HD1 LEU 29 1HD1 LEU 29 -1.856 7.625 3.180
208 2HD1 LEU 29 2HD1 LEU 29 -0.969 9.093 3.658
209 3HD1 LEU 29 3HD1 LEU 29 -1.457 8.861 1.962
210 1HD2 LEU 29 1HD2 LEU 29 -4.040 11.199 2.598
211 2HD2 LEU 29 2HD2 LEU 29 -4.008 9.879 1.405
212 3HD2 LEU 29 3HD2 LEU 29 -2.527 10.809 1.744
213 H GLU 30 H GLU 30 -7.118 7.386 5.349
214 HA GLU 30 HA GLU 30 -8.255 10.049 5.259
215 1HB GLU 30 1HB GLU 30 -9.056 7.674 4.082
216 2HB GLU 30 2HB GLU 30 -10.091 7.729 5.494
217 1HG GLU 30 1HG GLU 30 -9.766 10.188 3.742
218 2HG GLU 30 2HG GLU 30 -10.878 8.916 3.278
219 HE2 GLU 30 HE GLU 30 -10.348 11.233 5.939
220 H LYS 31 H LYS 31 -6.856 8.191 7.544
221 HA LYS 31 HA LYS 31 -8.753 9.092 9.588
222 1HB LYS 31 1HB LYS 31 -9.219 6.801 9.534
223 2HB LYS 31 2HB LYS 31 -7.552 6.355 9.233
224 1HG LYS 31 1HG LYS 31 -6.892 6.798 11.484
225 2HG LYS 31 2HG LYS 31 -8.308 7.780 11.806
226 1HD LYS 31 1HD LYS 31 -8.868 4.954 11.006
227 2HD LYS 31 2HD LYS 31 -8.069 5.150 12.553
228 1HE LYS 31 1HE LYS 31 -10.068 7.130 12.594
229 2HE LYS 31 2HE LYS 31 -10.848 5.780 11.795
230 1HZ LYS 31 1HZ LYS 31 -11.068 5.623 14.213
231 H TYR 32 H TYR 32 -5.405 7.842 8.941
232 HA TYR 32 HA TYR 32 -4.450 9.502 11.140
233 1HB TYR 32 1HB TYR 32 -3.508 7.198 9.376
234 2HB TYR 32 2HB TYR 32 -2.283 8.173 10.163
235 HD1 TYR 32 HD1 TYR 32 -5.020 5.768 10.689
236 HD2 TYR 32 HD2 TYR 32 -1.960 8.087 12.580
237 HE1 TYR 32 HE1 TYR 32 -5.280 4.394 12.813
238 HE2 TYR 32 HE2 TYR 32 -2.230 6.704 14.696
239 HH TYR 32 HH TYR 32 -3.769 5.339 15.767
240 H ASN 33 H ASN 33 -2.457 10.823 10.810
241 HA ASN 33 HA ASN 33 -2.529 11.972 8.133
242 1HB ASN 33 1HB ASN 33 -3.001 13.270 10.499
243 2HB ASN 33 2HB ASN 33 -1.261 13.462 10.421
244 1HD2 ASN 33 2HD2 ASN 33 -0.338 14.321 8.425
245 2HD2 ASN 33 1HD2 ASN 33 -1.204 15.524 7.529
246 H ILE 34 H ILE 34 -0.617 10.519 10.744
247 HA ILE 34 HA ILE 34 1.913 11.267 9.598
248 HB ILE 34 HB ILE 34 1.215 9.376 11.847
249 1HG1 ILE 34 1HG1 ILE 34 2.444 11.985 12.457
250 2HG1 ILE 34 2HG1 ILE 34 0.824 12.095 11.797
251 1HG2 ILE 34 1HG2 ILE 34 3.563 9.419 10.489
252 2HG2 ILE 34 2HG2 ILE 34 3.402 9.002 12.212
253 3HG2 ILE 34 3HG2 ILE 34 3.877 10.649 11.737
254 1HD1 ILE 34 1HD1 ILE 34 0.370 10.094 13.548
255 2HD1 ILE 34 2HD1 ILE 34 0.282 11.804 14.030
256 3HD1 ILE 34 3HD1 ILE 34 1.750 10.861 14.371
257 H GLU 35 H GLU 35 1.714 10.445 7.433
258 HA GLU 35 HA GLU 35 0.886 8.127 6.551
259 1HB GLU 35 1HB GLU 35 2.005 9.830 5.150
260 2HB GLU 35 2HB GLU 35 3.562 9.402 5.830
261 1HG GLU 35 1HG GLU 35 1.822 7.326 4.443
262 2HG GLU 35 2HG GLU 35 2.903 8.360 3.530
263 HE2 GLU 35 HE GLU 35 5.171 7.227 6.229
264 H LYS 36 H LYS 36 3.997 8.614 8.315
265 HA LYS 36 HA LYS 36 5.138 6.172 8.013
266 1HB LYS 36 1HB LYS 36 6.022 8.204 9.233
267 2HB LYS 36 2HB LYS 36 5.063 7.719 10.616
268 1HG LYS 36 1HG LYS 36 6.243 5.376 10.313
269 2HG LYS 36 2HG LYS 36 7.404 6.262 9.345
270 1HD LYS 36 1HD LYS 36 7.025 7.836 11.687
271 2HD LYS 36 2HD LYS 36 7.116 6.180 12.252
272 1HE LYS 36 1HE LYS 36 9.386 6.807 12.210
273 2HE LYS 36 2HE LYS 36 9.210 5.980 10.676
274 1HZ LYS 36 1HZ LYS 36 8.700 8.868 10.726
275 H ASP 37 H ASP 37 2.640 7.106 10.472
276 HA ASP 37 HA ASP 37 2.495 4.505 11.499
277 1HB ASP 37 1HB ASP 37 1.704 6.852 12.457
278 2HB ASP 37 2HB ASP 37 0.208 6.492 11.618
279 HD2 ASP 37 HD ASP 37 0.831 6.506 14.633
280 H ILE 38 H ILE 38 1.093 6.227 8.754
281 HA ILE 38 HA ILE 38 -1.221 4.641 8.440
282 HB ILE 38 HB ILE 38 0.301 6.255 6.392
283 1HG1 ILE 38 1HG1 ILE 38 -1.752 7.069 8.456
284 2HG1 ILE 38 2HG1 ILE 38 -0.143 7.719 8.212
285 1HG2 ILE 38 1HG2 ILE 38 -1.340 5.855 4.935
286 2HG2 ILE 38 2HG2 ILE 38 -2.607 6.100 6.161
287 3HG2 ILE 38 3HG2 ILE 38 -1.811 4.514 6.008
288 1HD1 ILE 38 1HD1 ILE 38 -0.937 9.228 6.726
289 2HD1 ILE 38 2HD1 ILE 38 -2.582 8.624 7.041
290 3HD1 ILE 38 3HD1 ILE 38 -1.613 7.924 5.722
291 H ALA 39 H ALA 39 1.786 4.722 6.396
292 HA ALA 39 HA ALA 39 1.277 2.341 5.102
293 1HB ALA 39 1HB ALA 39 3.815 3.861 5.769
294 2HB ALA 39 2HB ALA 39 2.926 3.809 4.229
295 3HB ALA 39 3HB ALA 39 3.832 2.382 4.782
296 H ALA 40 H ALA 40 2.853 3.008 8.260
297 HA ALA 40 HA ALA 40 3.781 0.376 8.652
298 1HB ALA 40 1HB ALA 40 3.181 2.701 10.516
299 2HB ALA 40 2HB ALA 40 4.763 2.201 9.871
300 3HB ALA 40 3HB ALA 40 3.921 1.176 11.059
301 H TYR 41 H TYR 41 0.674 2.039 9.148
302 HA TYR 41 HA TYR 41 -0.406 -0.016 10.813
303 1HB TYR 41 1HB TYR 41 -1.347 2.199 10.992
304 2HB TYR 41 2HB TYR 41 -1.286 2.457 9.260
305 HD1 TYR 41 HD1 TYR 41 -3.309 1.362 12.040
306 HD2 TYR 41 HD2 TYR 41 -2.968 1.256 7.777
307 HE1 TYR 41 HE1 TYR 41 -5.766 0.736 11.854
308 HE2 TYR 41 HE2 TYR 41 -5.426 0.631 7.603
309 HH TYR 41 HH TYR 41 -7.254 0.216 8.665
310 H ILE 42 H ILE 42 -0.303 0.721 7.315
311 HA ILE 42 HA ILE 42 -2.356 -1.064 6.589
312 HB ILE 42 HB ILE 42 -0.030 -0.002 4.985
313 1HG1 ILE 42 1HG1 ILE 42 -2.790 1.145 4.841
314 2HG1 ILE 42 2HG1 ILE 42 -1.788 1.577 6.213
315 1HG2 ILE 42 1HG2 ILE 42 -2.467 -0.508 3.511
316 2HG2 ILE 42 2HG2 ILE 42 -1.890 -1.987 4.315
317 3HG2 ILE 42 3HG2 ILE 42 -0.813 -1.093 3.217
318 1HD1 ILE 42 1HD1 ILE 42 -0.174 1.714 3.810
319 2HD1 ILE 42 2HD1 ILE 42 -0.599 3.020 4.942
320 3HD1 ILE 42 3HD1 ILE 42 -1.672 2.645 3.571
321 H LYS 43 H LYS 43 1.261 -1.355 6.610
322 HA LYS 43 HA LYS 43 1.289 -4.012 5.756
323 1HB LYS 43 1HB LYS 43 3.288 -2.822 5.527
324 2HB LYS 43 2HB LYS 43 3.242 -2.209 7.168
325 1HG LYS 43 1HG LYS 43 3.242 -5.121 7.228
326 2HG LYS 43 2HG LYS 43 4.560 -4.563 6.217
327 1HD LYS 43 1HD LYS 43 5.727 -4.192 8.130
328 2HD LYS 43 2HD LYS 43 4.673 -2.821 8.411
329 1HE LYS 43 1HE LYS 43 3.199 -4.094 9.819
330 2HE LYS 43 2HE LYS 43 3.849 -5.624 9.263
331 1HZ LYS 43 1HZ LYS 43 5.437 -3.641 10.803
332 H LYS 44 H LYS 44 1.302 -2.541 9.064
333 HA LYS 44 HA LYS 44 1.479 -4.955 10.440
334 1HB LYS 44 1HB LYS 44 1.964 -2.927 11.576
335 2HB LYS 44 2HB LYS 44 0.412 -2.224 11.169
336 1HG LYS 44 1HG LYS 44 -0.668 -4.152 12.509
337 2HG LYS 44 2HG LYS 44 0.942 -4.539 13.081
338 1HD LYS 44 1HD LYS 44 0.508 -3.040 14.750
339 2HD LYS 44 2HD LYS 44 0.864 -1.815 13.549
340 1HE LYS 44 1HE LYS 44 -1.258 -1.044 13.751
341 2HE LYS 44 2HE LYS 44 -1.846 -2.554 13.083
342 1HZ LYS 44 1HZ LYS 44 -1.762 -1.714 15.860
343 H GLU 45 H GLU 45 -1.333 -3.106 9.159
344 HA GLU 45 HA GLU 45 -3.288 -4.612 10.369
345 1HB GLU 45 1HB GLU 45 -3.669 -2.458 9.185
346 2HB GLU 45 2HB GLU 45 -3.349 -3.235 7.647
347 1HG GLU 45 1HG GLU 45 -5.308 -4.866 8.908
348 2HG GLU 45 2HG GLU 45 -5.813 -3.216 9.225
349 HE2 GLU 45 HE GLU 45 -7.394 -4.441 6.623
350 H PHE 46 H PHE 46 -1.590 -5.064 7.208
351 HA PHE 46 HA PHE 46 -3.100 -7.377 6.546
352 1HB PHE 46 1HB PHE 46 -0.879 -5.669 5.538
353 2HB PHE 46 2HB PHE 46 -0.613 -7.361 5.165
354 HD1 PHE 46 HD1 PHE 46 -3.769 -5.372 5.265
355 HD2 PHE 46 HD2 PHE 46 -1.051 -7.626 2.909
356 HE1 PHE 46 HE1 PHE 46 -5.316 -5.181 3.297
357 HE2 PHE 46 HE2 PHE 46 -2.598 -7.436 0.942
358 HZ PHE 46 HZ PHE 46 -4.711 -6.215 1.160
359 H ASP 47 H ASP 47 0.474 -7.030 7.140
360 HA ASP 47 HA ASP 47 1.197 -9.524 7.334
361 1HB ASP 47 1HB ASP 47 3.070 -8.630 8.258
362 2HB ASP 47 2HB ASP 47 2.221 -7.096 8.242
363 HD2 ASP 47 HD ASP 47 2.445 -9.043 11.752
364 H LYS 48 H LYS 48 -0.699 -7.697 9.785
365 HA LYS 48 HA LYS 48 -0.635 -9.085 12.014
366 1HB LYS 48 1HB LYS 48 -2.165 -7.252 11.681
367 2HB LYS 48 2HB LYS 48 -3.118 -8.177 10.537
368 1HG LYS 48 1HG LYS 48 -4.402 -8.724 12.347
369 2HG LYS 48 2HG LYS 48 -3.137 -9.881 12.707
370 1HD LYS 48 1HD LYS 48 -3.063 -8.785 14.724
371 2HD LYS 48 2HD LYS 48 -2.035 -7.663 13.853
372 1HE LYS 48 1HE LYS 48 -3.548 -5.998 14.141
373 2HE LYS 48 2HE LYS 48 -4.782 -6.938 13.324
374 1HZ LYS 48 1HZ LYS 48 -4.129 -7.524 16.142
375 H LYS 49 H LYS 49 -3.313 -10.099 9.826
376 HA LYS 49 HA LYS 49 -2.413 -12.864 10.202
377 1HB LYS 49 1HB LYS 49 -4.348 -12.018 11.751
378 2HB LYS 49 2HB LYS 49 -5.335 -12.155 10.310
379 1HG LYS 49 1HG LYS 49 -4.645 -14.536 10.044
380 2HG LYS 49 2HG LYS 49 -3.615 -14.406 11.456
381 1HD LYS 49 1HD LYS 49 -5.836 -13.609 12.672
382 2HD LYS 49 2HD LYS 49 -6.641 -14.374 11.317
383 1HE LYS 49 1HE LYS 49 -6.509 -16.185 12.781
384 2HE LYS 49 2HE LYS 49 -5.024 -16.416 11.882
385 1HZ LYS 49 1HZ LYS 49 -3.814 -15.283 13.646
386 H TYR 50 H TYR 50 -1.454 -12.186 8.020
387 HA TYR 50 HA TYR 50 -3.410 -12.915 5.983
388 1HB TYR 50 1HB TYR 50 -2.933 -10.314 6.340
389 2HB TYR 50 2HB TYR 50 -1.349 -10.661 5.677
390 HD1 TYR 50 HD1 TYR 50 -1.650 -12.311 3.421
391 HD2 TYR 50 HD2 TYR 50 -4.356 -9.308 4.821
392 HE1 TYR 50 HE1 TYR 50 -2.582 -12.046 1.071
393 HE2 TYR 50 HE2 TYR 50 -5.280 -9.052 2.466
394 HH TYR 50 HH TYR 50 -3.711 -10.376 -0.237
395 H ASN 51 H ASN 51 0.020 -11.717 6.106
396 HA ASN 51 HA ASN 51 1.114 -14.242 5.763
397 1HB ASN 51 1HB ASN 51 -0.049 -13.513 3.403
398 2HB ASN 51 2HB ASN 51 1.485 -12.691 3.202
399 1HD2 ASN 51 2HD2 ASN 51 0.011 -15.274 2.229
400 2HD2 ASN 51 1HD2 ASN 51 1.256 -16.477 2.210
401 HA PRO 52 HA PRO 52 3.806 -10.680 6.776
402 1HB PRO 52 1HB PRO 52 4.625 -11.518 9.244
403 2HB PRO 52 2HB PRO 52 3.269 -10.437 9.002
404 1HG PRO 52 1HG PRO 52 3.248 -13.309 9.702
405 2HG PRO 52 2HG PRO 52 1.963 -12.129 9.867
406 1HD PRO 52 1HD PRO 52 2.186 -14.151 7.844
407 2HD PRO 52 2HD PRO 52 0.964 -12.899 7.945
408 H THR 53 H THR 53 7.101 -11.723 6.537
409 HA THR 53 HA THR 53 5.112 -9.868 7.636
410 HB THR 53 HB THR 53 7.222 -10.213 8.919
411 HG1 THR 53 HG1 THR 53 6.572 -8.067 9.080
412 1HG2 THR 53 1HG2 THR 53 9.285 -10.238 7.931
413 2HG2 THR 53 2HG2 THR 53 8.939 -8.725 7.063
414 3HG2 THR 53 3HG2 THR 53 8.449 -10.286 6.360
415 H TRP 54 H TRP 54 4.932 -7.699 6.791
416 HA TRP 54 HA TRP 54 5.437 -7.700 3.900
417 1HB TRP 54 1HB TRP 54 3.427 -6.147 5.541
418 2HB TRP 54 2HB TRP 54 3.656 -5.995 3.811
419 HD1 TRP 54 HD TRP 54 2.735 -8.870 6.304
420 HE1 TRP 54 HE1 TRP 54 1.000 -10.524 5.201
421 HE3 TRP 54 HE3 TRP 54 2.627 -6.567 1.772
422 HZ2 TRP 54 HZ2 TRP 54 -0.197 -10.679 2.613
423 HZ3 TRP 54 HZ3 TRP 54 1.149 -7.534 0.013
424 HH2 TRP 54 HH TRP 54 -0.232 -9.517 0.375
425 H HIS 55 H HIS 55 5.875 -5.381 3.026
426 HA HIS 55 HA HIS 55 7.298 -3.761 4.971
427 1HB HIS 55 1HB HIS 55 8.569 -4.742 2.400
428 2HB HIS 55 2HB HIS 55 9.273 -3.592 3.520
429 HD1 HIS 55 HD1 HIS 55 10.409 -4.511 5.637
430 HD2 HIS 55 HD2 HIS 55 8.487 -7.458 3.353
431 HE1 HIS 55 HE1 HIS 55 11.156 -6.757 6.592
432 H CYS 56 H CYS 56 6.393 -1.777 4.805
433 HA CYS 56 HA CYS 56 5.465 -0.987 2.142
434 1HB CYS 56 1HB CYS 56 3.761 -1.186 4.024
435 2HB CYS 56 2HB CYS 56 4.549 0.182 4.784
436 HG CYS 56 HG CYS 56 3.782 0.247 1.588
437 H ILE 57 H ILE 57 6.056 1.144 1.385
438 HA ILE 57 HA ILE 57 7.992 2.563 3.055
439 HB ILE 57 HB ILE 57 8.417 1.419 0.329
440 1HG1 ILE 57 1HG1 ILE 57 9.869 1.505 2.950
441 2HG1 ILE 57 2HG1 ILE 57 9.486 0.133 1.930
442 1HG2 ILE 57 1HG2 ILE 57 10.194 2.999 -0.143
443 2HG2 ILE 57 2HG2 ILE 57 9.840 3.888 1.356
444 3HG2 ILE 57 3HG2 ILE 57 8.646 3.856 0.038
445 1HD1 ILE 57 1HD1 ILE 57 11.606 2.265 1.442
446 2HD1 ILE 57 2HD1 ILE 57 11.098 1.109 0.187
447 3HD1 ILE 57 3HD1 ILE 57 11.850 0.520 1.690
448 H VAL 58 H VAL 58 8.253 4.857 2.409
449 HA VAL 58 HA VAL 58 6.020 5.816 0.777
450 HB VAL 58 HB VAL 58 5.197 6.004 2.985
451 1HG1 VAL 58 1HG1 VAL 58 7.983 6.401 3.672
452 2HG1 VAL 58 2HG1 VAL 58 6.610 5.948 4.710
453 3HG1 VAL 58 3HG1 VAL 58 6.968 7.666 4.405
454 1HG2 VAL 58 1HG2 VAL 58 4.679 7.960 1.744
455 2HG2 VAL 58 2HG2 VAL 58 6.315 8.626 1.959
456 3HG2 VAL 58 3HG2 VAL 58 5.205 8.527 3.347
457 H GLY 59 H GLY 59 7.331 6.372 -0.967
458 1HA GLY 59 2HA GLY 59 9.311 8.488 -0.391
459 2HA GLY 59 1HA GLY 59 9.680 7.153 -1.464
460 H ARG 60 H ARG 60 8.750 7.046 -3.568
461 HA ARG 60 HA ARG 60 6.783 8.985 -4.258
462 1HB ARG 60 1HB ARG 60 9.609 9.519 -4.729
463 2HB ARG 60 2HB ARG 60 8.793 9.353 -6.270
464 1HG ARG 60 1HG ARG 60 7.742 11.355 -6.028
465 2HG ARG 60 2HG ARG 60 7.161 10.934 -4.429
466 1HD ARG 60 1HD ARG 60 8.646 12.416 -3.559
467 2HD ARG 60 2HD ARG 60 9.944 11.364 -4.086
468 HE ARG 60 HE ARG 60 9.102 13.856 -5.354
469 1HH1 ARG 60 2HH2 ARG 60 10.703 10.748 -5.933
470 2HH1 ARG 60 1HH2 ARG 60 11.588 11.319 -7.307
471 1HH2 ARG 60 1HH ARG 60 11.317 13.593 -8.015
472 H ASN 61 H ASN 61 9.220 6.529 -5.283
473 HA ASN 61 HA ASN 61 7.357 5.712 -7.364
474 1HB ASN 61 1HB ASN 61 10.266 5.958 -7.239
475 2HB ASN 61 2HB ASN 61 9.842 4.296 -7.602
476 1HD2 ASN 61 2HD2 ASN 61 10.896 4.812 -9.637
477 2HD2 ASN 61 1HD2 ASN 61 9.987 5.530 -10.925
478 H PHE 62 H PHE 62 8.307 3.052 -7.741
479 HA PHE 62 HA PHE 62 7.673 1.854 -5.138
480 1HB PHE 62 1HB PHE 62 7.025 -0.090 -6.846
481 2HB PHE 62 2HB PHE 62 5.931 1.268 -6.668
482 HD1 PHE 62 HD1 PHE 62 8.146 -0.505 -8.905
483 HD2 PHE 62 HD2 PHE 62 5.919 3.071 -8.394
484 HE1 PHE 62 HE1 PHE 62 8.309 -0.052 -11.368
485 HE2 PHE 62 HE2 PHE 62 6.081 3.523 -10.858
486 HZ PHE 62 HZ PHE 62 7.274 1.958 -12.315
487 H GLY 63 H GLY 63 10.092 2.109 -4.738
488 1HA GLY 63 2HA GLY 63 12.242 1.377 -4.864
489 2HA GLY 63 1HA GLY 63 11.456 -0.179 -4.672
490 H SER 64 H SER 64 12.831 -1.436 -5.963
491 HA SER 64 HA SER 64 13.363 -0.498 -8.628
492 1HB SER 64 1HB SER 64 14.240 -3.042 -7.190
493 2HB SER 64 2HB SER 64 14.806 -2.537 -8.769
494 HG SER 64 HG SER 64 15.673 -1.746 -6.285
495 H TYR 65 H TYR 65 11.633 -3.148 -6.893
496 HA TYR 65 HA TYR 65 10.043 -4.554 -7.535
497 1HB TYR 65 1HB TYR 65 8.603 -2.847 -8.312
498 2HB TYR 65 2HB TYR 65 9.847 -2.140 -9.324
499 HD1 TYR 65 HD1 TYR 65 7.852 -5.327 -9.184
500 HD2 TYR 65 HD2 TYR 65 9.475 -2.195 -11.606
501 HE1 TYR 65 HE1 TYR 65 6.771 -6.350 -11.244
502 HE2 TYR 65 HE2 TYR 65 8.386 -3.230 -13.658
503 HH TYR 65 HH TYR 65 6.834 -6.360 -13.490
504 H VAL 66 H VAL 66 11.174 -3.413 -10.794
505 HA VAL 66 HA VAL 66 11.333 -6.139 -11.672
506 HB VAL 66 HB VAL 66 10.488 -4.385 -13.114
507 1HG1 VAL 66 1HG1 VAL 66 12.272 -2.768 -14.092
508 2HG1 VAL 66 2HG1 VAL 66 13.179 -3.126 -12.603
509 3HG1 VAL 66 3HG1 VAL 66 11.556 -2.401 -12.503
510 1HG2 VAL 66 1HG2 VAL 66 11.248 -5.974 -14.547
511 2HG2 VAL 66 2HG2 VAL 66 12.882 -5.988 -13.840
512 3HG2 VAL 66 3HG2 VAL 66 12.417 -4.703 -14.982
513 H THR 67 H THR 67 12.940 -6.274 -9.594
514 HA THR 67 HA THR 67 15.540 -6.597 -10.793
515 HB THR 67 HB THR 67 14.948 -4.519 -8.637
516 HG1 THR 67 HG1 THR 67 15.969 -3.256 -10.260
517 1HG2 THR 67 1HG2 THR 67 16.885 -5.435 -7.657
518 2HG2 THR 67 2HG2 THR 67 17.615 -4.350 -8.864
519 3HG2 THR 67 3HG2 THR 67 17.473 -6.091 -9.204
520 H HIS 68 H HIS 68 13.908 -6.425 -7.552
521 HA HIS 68 HA HIS 68 15.140 -9.016 -7.006
522 1HB HIS 68 1HB HIS 68 15.413 -6.873 -5.520
523 2HB HIS 68 2HB HIS 68 13.816 -7.289 -4.932
524 HD1 HIS 68 HD1 HIS 68 16.957 -9.411 -5.599
525 HD2 HIS 68 HD2 HIS 68 14.122 -8.654 -2.600
526 HE1 HIS 68 HE1 HIS 68 17.569 -10.925 -3.637
527 H GLU 69 H GLU 69 12.066 -7.230 -7.283
528 HA GLU 69 HA GLU 69 9.994 -7.874 -7.354
529 1HB GLU 69 1HB GLU 69 11.362 -10.420 -8.244
530 2HB GLU 69 2HB GLU 69 9.623 -10.405 -8.038
531 1HG GLU 69 1HG GLU 69 10.031 -8.059 -9.466
532 2HG GLU 69 2HG GLU 69 11.293 -9.087 -10.116
533 HE2 GLU 69 HE GLU 69 10.209 -9.289 -12.015
534 H THR 70 H THR 70 8.246 -8.926 -6.124
535 HA THR 70 HA THR 70 9.211 -10.391 -3.765
536 HB THR 70 HB THR 70 7.754 -8.971 -2.366
537 HG1 THR 70 HG1 THR 70 6.347 -7.547 -3.437
538 1HG2 THR 70 1HG2 THR 70 9.368 -7.360 -2.269
539 2HG2 THR 70 2HG2 THR 70 8.746 -6.648 -3.777
540 3HG2 THR 70 3HG2 THR 70 9.999 -7.912 -3.840
541 H ARG 71 H ARG 71 6.331 -10.230 -2.771
542 HA ARG 71 HA ARG 71 5.388 -12.319 -4.561
543 1HB ARG 71 1HB ARG 71 5.023 -11.869 -1.568
544 2HB ARG 71 2HB ARG 71 3.980 -12.964 -2.452
545 1HG ARG 71 1HG ARG 71 7.024 -13.173 -2.497
546 2HG ARG 71 2HG ARG 71 6.026 -14.038 -1.345
547 1HD ARG 71 1HD ARG 71 5.170 -15.492 -2.954
548 2HD ARG 71 2HD ARG 71 5.246 -14.298 -4.235
549 HE ARG 71 HE ARG 71 7.438 -14.978 -4.723
550 1HH1 ARG 71 2HH2 ARG 71 6.514 -16.248 -1.547
551 2HH1 ARG 71 1HH2 ARG 71 7.926 -17.243 -1.397
552 1HH2 ARG 71 1HH ARG 71 9.548 -17.252 -3.161
553 H HIS 72 H HIS 72 3.922 -10.136 -2.035
554 HA HIS 72 HA HIS 72 1.928 -9.400 -4.052
555 1HB HIS 72 1HB HIS 72 1.617 -10.109 -1.144
556 2HB HIS 72 2HB HIS 72 0.466 -9.038 -1.917
557 HD1 HIS 72 HD1 HIS 72 -0.496 -11.757 -0.882
558 HD2 HIS 72 HD2 HIS 72 0.864 -11.120 -4.798
559 HE1 HIS 72 HE1 HIS 72 -1.519 -13.612 -2.304
560 H PHE 73 H PHE 73 2.310 -7.344 -4.705
561 HA PHE 73 HA PHE 73 2.911 -5.400 -2.602
562 1HB PHE 73 1HB PHE 73 4.310 -4.403 -4.714
563 2HB PHE 73 2HB PHE 73 5.044 -5.537 -3.599
564 HD1 PHE 73 HD1 PHE 73 4.596 -8.100 -4.241
565 HD2 PHE 73 HD2 PHE 73 4.513 -4.847 -6.965
566 HE1 PHE 73 HE1 PHE 73 5.045 -9.678 -6.141
567 HE2 PHE 73 HE2 PHE 73 4.961 -6.426 -8.864
568 HZ PHE 73 HZ PHE 73 5.222 -8.821 -8.430
569 H ILE 74 H ILE 74 2.479 -3.100 -3.348
570 HA ILE 74 HA ILE 74 0.860 -2.772 -5.675
571 HB ILE 74 HB ILE 74 -0.980 -3.562 -4.620
572 1HG1 ILE 74 1HG1 ILE 74 -0.941 -0.732 -3.532
573 2HG1 ILE 74 2HG1 ILE 74 -1.297 -1.149 -5.197
574 1HG2 ILE 74 1HG2 ILE 74 -1.433 -3.471 -2.226
575 2HG2 ILE 74 2HG2 ILE 74 0.044 -2.511 -1.968
576 3HG2 ILE 74 3HG2 ILE 74 0.164 -4.190 -2.547
577 1HD1 ILE 74 1HD1 ILE 74 -3.189 -2.604 -4.408
578 2HD1 ILE 74 2HD1 ILE 74 -3.396 -0.896 -3.955
579 3HD1 ILE 74 3HD1 ILE 74 -2.853 -2.079 -2.740
580 H TYR 75 H TYR 75 1.402 -0.808 -6.454
581 HA TYR 75 HA TYR 75 2.373 1.156 -4.491
582 1HB TYR 75 1HB TYR 75 4.111 0.471 -6.070
583 2HB TYR 75 2HB TYR 75 2.975 0.410 -7.403
584 HD1 TYR 75 HD1 TYR 75 4.352 2.913 -4.962
585 HD2 TYR 75 HD2 TYR 75 3.033 2.132 -8.956
586 HE1 TYR 75 HE1 TYR 75 5.025 5.266 -5.653
587 HE2 TYR 75 HE2 TYR 75 3.711 4.487 -9.632
588 HH TYR 75 HH TYR 75 5.342 6.625 -7.331
589 H PHE 76 H PHE 76 1.095 2.903 -4.172
590 HA PHE 76 HA PHE 76 -0.303 4.015 -6.445
591 1HB PHE 76 1HB PHE 76 -2.435 4.032 -4.959
592 2HB PHE 76 2HB PHE 76 -1.983 2.463 -5.594
593 HD1 PHE 76 HD1 PHE 76 -0.336 1.095 -3.997
594 HD2 PHE 76 HD2 PHE 76 -2.961 4.174 -2.720
595 HE1 PHE 76 HE1 PHE 76 -0.291 0.166 -1.667
596 HE2 PHE 76 HE2 PHE 76 -2.914 3.245 -0.388
597 HZ PHE 76 HZ PHE 76 -1.581 1.251 0.111
598 H TYR 77 H TYR 77 -1.747 6.000 -5.419
599 HA TYR 77 HA TYR 77 0.117 7.376 -3.601
600 1HB TYR 77 1HB TYR 77 -0.475 7.974 -6.203
601 2HB TYR 77 2HB TYR 77 -1.888 8.707 -5.471
602 HD1 TYR 77 HD1 TYR 77 1.814 8.629 -4.802
603 HD2 TYR 77 HD2 TYR 77 -1.745 10.985 -5.111
604 HE1 TYR 77 HE1 TYR 77 3.154 10.732 -4.303
605 HE2 TYR 77 HE2 TYR 77 -0.392 13.080 -4.611
606 HH TYR 77 HH TYR 77 2.493 13.075 -3.233
607 H LEU 78 H LEU 78 -0.721 7.544 -1.583
608 HA LEU 78 HA LEU 78 -3.602 7.502 -1.275
609 1HB LEU 78 1HB LEU 78 -1.251 7.272 0.582
610 2HB LEU 78 2HB LEU 78 -2.862 7.579 1.203
611 HG LEU 78 HG LEU 78 -1.921 5.159 -0.352
612 1HD1 LEU 78 1HD1 LEU 78 -3.281 4.973 2.289
613 2HD1 LEU 78 2HD1 LEU 78 -1.615 5.599 2.263
614 3HD1 LEU 78 3HD1 LEU 78 -1.973 3.989 1.593
615 1HD2 LEU 78 1HD2 LEU 78 -4.673 6.195 0.119
616 2HD2 LEU 78 2HD2 LEU 78 -4.405 4.447 0.314
617 3HD2 LEU 78 3HD2 LEU 78 -4.015 5.239 -1.231
618 H GLY 79 H GLY 79 -4.794 9.324 -1.273
619 1HA GLY 79 2HA GLY 79 -5.371 11.483 -1.054
620 2HA GLY 79 1HA GLY 79 -4.204 11.583 0.251
621 H GLN 80 H GLN 80 -1.926 12.102 -0.259
622 HA GLN 80 HA GLN 80 -1.469 13.049 -2.937
623 1HB GLN 80 1HB GLN 80 -2.389 14.870 -1.058
624 2HB GLN 80 2HB GLN 80 -0.652 15.052 -0.906
625 1HG GLN 80 1HG GLN 80 -1.419 14.882 -3.726
626 2HG GLN 80 2HG GLN 80 -2.321 16.151 -2.924
627 1HE2 GLN 80 2HE2 GLN 80 -1.057 17.628 -1.510
628 2HE2 GLN 80 1HE2 GLN 80 0.508 18.143 -2.041
629 H VAL 81 H VAL 81 -0.446 10.807 -1.434
630 HA VAL 81 HA VAL 81 2.362 11.550 -1.459
631 HB VAL 81 HB VAL 81 0.928 10.318 0.895
632 1HG1 VAL 81 1HG1 VAL 81 3.280 10.210 1.892
633 2HG1 VAL 81 2HG1 VAL 81 3.879 10.383 0.224
634 3HG1 VAL 81 3HG1 VAL 81 2.869 8.985 0.667
635 1HG2 VAL 81 1HG2 VAL 81 1.942 12.177 2.149
636 2HG2 VAL 81 2HG2 VAL 81 0.902 12.768 0.831
637 3HG2 VAL 81 3HG2 VAL 81 2.673 12.792 0.647
638 H ALA 82 H ALA 82 3.777 9.623 -1.653
639 HA ALA 82 HA ALA 82 2.403 7.594 -3.206
640 1HB ALA 82 1HB ALA 82 4.292 8.275 -4.353
641 2HB ALA 82 2HB ALA 82 4.974 6.917 -3.427
642 3HB ALA 82 3HB ALA 82 5.217 8.587 -2.863
643 H ILE 83 H ILE 83 2.615 5.311 -2.773
644 HA ILE 83 HA ILE 83 3.781 4.544 -0.251
645 HB ILE 83 HB ILE 83 1.395 5.427 0.141
646 1HG1 ILE 83 1HG1 ILE 83 1.861 2.626 1.147
647 2HG1 ILE 83 2HG1 ILE 83 2.926 3.934 1.621
648 1HG2 ILE 83 1HG2 ILE 83 0.336 4.306 -1.761
649 2HG2 ILE 83 2HG2 ILE 83 -0.399 3.812 -0.218
650 3HG2 ILE 83 3HG2 ILE 83 0.732 2.722 -1.055
651 1HD1 ILE 83 1HD1 ILE 83 0.673 3.331 2.990
652 2HD1 ILE 83 2HD1 ILE 83 -0.018 4.478 1.818
653 3HD1 ILE 83 3HD1 ILE 83 1.307 4.991 2.890
654 H LEU 84 H LEU 84 4.861 2.690 -0.632
655 HA LEU 84 HA LEU 84 3.745 0.926 -2.701
656 1HB LEU 84 1HB LEU 84 5.538 1.694 -3.846
657 2HB LEU 84 2HB LEU 84 6.451 2.090 -2.404
658 HG LEU 84 HG LEU 84 6.338 -0.684 -2.333
659 1HD1 LEU 84 1HD1 LEU 84 7.426 -0.583 -4.963
660 2HD1 LEU 84 2HD1 LEU 84 5.784 0.100 -5.014
661 3HD1 LEU 84 3HD1 LEU 84 6.049 -1.533 -4.357
662 1HD2 LEU 84 1HD2 LEU 84 8.229 1.199 -2.088
663 2HD2 LEU 84 2HD2 LEU 84 8.669 0.561 -3.690
664 3HD2 LEU 84 3HD2 LEU 84 8.597 -0.531 -2.287
665 H LEU 85 H LEU 85 2.958 -0.849 -1.709
666 HA LEU 85 HA LEU 85 4.427 -1.799 0.650
667 1HB LEU 85 1HB LEU 85 2.203 -1.125 1.202
668 2HB LEU 85 2HB LEU 85 1.525 -2.029 -0.138
669 HG LEU 85 HG LEU 85 3.013 -3.825 1.553
670 1HD1 LEU 85 1HD1 LEU 85 1.583 -1.718 2.976
671 2HD1 LEU 85 2HD1 LEU 85 2.710 -2.956 3.582
672 3HD1 LEU 85 3HD1 LEU 85 0.986 -3.347 3.377
673 1HD2 LEU 85 1HD2 LEU 85 0.081 -3.994 1.588
674 2HD2 LEU 85 2HD2 LEU 85 1.300 -5.184 1.075
675 3HD2 LEU 85 3HD2 LEU 85 0.788 -3.897 -0.042
676 H PHE 86 H PHE 86 5.049 -3.983 0.780
677 HA PHE 86 HA PHE 86 4.307 -5.781 -1.319
678 1HB PHE 86 1HB PHE 86 6.667 -6.039 -2.120
679 2HB PHE 86 2HB PHE 86 6.139 -4.383 -2.351
680 HD1 PHE 86 HD1 PHE 86 8.476 -6.562 -0.664
681 HD2 PHE 86 HD2 PHE 86 6.930 -2.611 -0.783
682 HE1 PHE 86 HE1 PHE 86 10.456 -5.749 0.647
683 HE2 PHE 86 HE2 PHE 86 8.910 -1.798 0.530
684 HZ PHE 86 HZ PHE 86 10.650 -3.376 1.228
685 H LYS 87 H LYS 87 4.760 -7.965 -0.779
686 HA LYS 87 HA LYS 87 5.678 -8.278 1.982
687 1HB LYS 87 1HB LYS 87 3.356 -9.090 0.942
688 2HB LYS 87 2HB LYS 87 4.322 -10.477 0.483
689 1HG LYS 87 1HG LYS 87 4.261 -9.357 3.322
690 2HG LYS 87 2HG LYS 87 3.191 -10.633 2.776
691 1HD LYS 87 1HD LYS 87 6.217 -10.853 2.494
692 2HD LYS 87 2HD LYS 87 5.391 -11.347 3.958
693 1HE LYS 87 1HE LYS 87 4.461 -13.217 2.974
694 2HE LYS 87 2HE LYS 87 4.191 -12.410 1.442
695 1HZ LYS 87 1HZ LYS 87 6.935 -13.095 2.309
696 H SER 88 H SER 88 7.734 -8.925 2.288
697 HA SER 88 HA SER 88 8.797 -10.793 0.335
698 1HB SER 88 1HB SER 88 10.740 -9.576 -0.072
699 2HB SER 88 2HB SER 88 9.568 -8.281 0.070
700 HG SER 88 HG SER 88 10.729 -7.516 1.684
701 H GLY 89 H GLY 89 9.286 -12.633 1.469
702 1HA GLY 89 2HA GLY 89 10.856 -13.573 3.059
703 2HA GLY 89 1HA GLY 89 10.427 -12.294 4.179
Start of MODEL 5
1 1H MET 1 H MET 1 -16.993 11.839 -11.764
2 HA MET 1 HA MET 1 -16.951 14.169 -13.200
3 1HB MET 1 1HB MET 1 -19.280 15.054 -12.609
4 2HB MET 1 2HB MET 1 -19.289 13.782 -13.815
5 1HG MET 1 1HG MET 1 -20.877 12.843 -12.440
6 2HG MET 1 2HG MET 1 -19.482 12.249 -11.559
7 1HE MET 1 1HE MET 1 -22.158 13.132 -9.047
8 2HE MET 1 2HE MET 1 -22.877 14.030 -10.404
9 3HE MET 1 3HE MET 1 -22.165 12.421 -10.679
10 H SER 2 H SER 2 -17.921 12.442 -10.224
11 HA SER 2 HA SER 2 -16.891 14.721 -8.723
12 1HB SER 2 1HB SER 2 -19.230 12.937 -8.320
13 2HB SER 2 2HB SER 2 -18.276 13.194 -6.872
14 HG SER 2 HG SER 2 -20.109 14.829 -7.839
15 H ASP 3 H ASP 3 -14.685 14.063 -8.701
16 HA ASP 3 HA ASP 3 -14.088 11.375 -7.943
17 1HB ASP 3 1HB ASP 3 -11.704 12.178 -8.118
18 2HB ASP 3 2HB ASP 3 -12.640 12.440 -9.577
19 HD2 ASP 3 HD ASP 3 -11.376 15.499 -9.695
20 H ARG 4 H ARG 4 -11.868 11.588 -6.272
21 HA ARG 4 HA ARG 4 -12.649 13.327 -4.105
22 1HB ARG 4 1HB ARG 4 -12.605 10.308 -4.039
23 2HB ARG 4 2HB ARG 4 -12.052 11.155 -2.607
24 1HG ARG 4 1HG ARG 4 -14.477 12.439 -3.500
25 2HG ARG 4 2HG ARG 4 -14.766 10.711 -3.488
26 1HD ARG 4 1HD ARG 4 -14.624 10.565 -1.194
27 2HD ARG 4 2HD ARG 4 -13.290 11.697 -1.100
28 HE ARG 4 HE ARG 4 -15.655 13.123 -1.878
29 1HH1 ARG 4 2HH2 ARG 4 -14.260 11.507 0.949
30 2HH1 ARG 4 1HH2 ARG 4 -15.122 12.486 2.089
31 1HH2 ARG 4 1HH ARG 4 -16.605 14.190 1.287
32 H LYS 5 H LYS 5 -10.496 10.491 -3.786
33 HA LYS 5 HA LYS 5 -8.126 11.681 -4.639
34 1HB LYS 5 1HB LYS 5 -9.043 12.685 -2.112
35 2HB LYS 5 2HB LYS 5 -7.610 11.714 -1.837
36 1HG LYS 5 1HG LYS 5 -6.312 13.010 -3.430
37 2HG LYS 5 2HG LYS 5 -7.743 13.818 -4.040
38 1HD LYS 5 1HD LYS 5 -7.433 14.144 -1.120
39 2HD LYS 5 2HD LYS 5 -6.054 14.762 -2.007
40 1HE LYS 5 1HE LYS 5 -7.321 16.647 -2.279
41 2HE LYS 5 2HE LYS 5 -8.132 15.742 -3.542
42 1HZ LYS 5 1HZ LYS 5 -9.335 14.960 -1.173
43 H ALA 6 H ALA 6 -8.296 9.470 -5.511
44 HA ALA 6 HA ALA 6 -6.798 7.671 -3.903
45 1HB ALA 6 1HB ALA 6 -8.384 6.264 -3.123
46 2HB ALA 6 2HB ALA 6 -9.287 6.299 -4.659
47 3HB ALA 6 3HB ALA 6 -9.538 7.580 -3.447
48 H VAL 7 H VAL 7 -5.330 7.597 -5.609
49 HA VAL 7 HA VAL 7 -6.428 6.538 -8.122
50 HB VAL 7 HB VAL 7 -4.108 8.409 -7.623
51 1HG1 VAL 7 1HG1 VAL 7 -3.171 7.449 -9.427
52 2HG1 VAL 7 2HG1 VAL 7 -4.437 8.288 -10.355
53 3HG1 VAL 7 3HG1 VAL 7 -4.669 6.592 -9.866
54 1HG2 VAL 7 1HG2 VAL 7 -5.483 10.087 -8.161
55 2HG2 VAL 7 2HG2 VAL 7 -6.826 8.932 -7.999
56 3HG2 VAL 7 3HG2 VAL 7 -6.092 9.222 -9.594
57 H ILE 8 H ILE 8 -5.266 4.833 -9.142
58 HA ILE 8 HA ILE 8 -3.126 3.689 -7.494
59 HB ILE 8 HB ILE 8 -5.687 2.472 -8.384
60 1HG1 ILE 8 1HG1 ILE 8 -4.285 1.326 -6.098
61 2HG1 ILE 8 2HG1 ILE 8 -4.461 3.064 -5.947
62 1HG2 ILE 8 1HG2 ILE 8 -3.016 1.117 -8.563
63 2HG2 ILE 8 2HG2 ILE 8 -4.432 1.001 -9.637
64 3HG2 ILE 8 3HG2 ILE 8 -4.448 0.193 -8.052
65 1HD1 ILE 8 1HD1 ILE 8 -6.708 2.917 -5.618
66 2HD1 ILE 8 2HD1 ILE 8 -6.432 1.177 -5.372
67 3HD1 ILE 8 3HD1 ILE 8 -6.912 1.783 -6.976
68 H LYS 9 H LYS 9 -1.299 3.209 -8.618
69 HA LYS 9 HA LYS 9 -1.468 3.536 -11.515
70 1HB LYS 9 1HB LYS 9 0.825 3.720 -9.549
71 2HB LYS 9 2HB LYS 9 1.060 3.706 -11.284
72 1HG LYS 9 1HG LYS 9 0.889 5.996 -10.960
73 2HG LYS 9 2HG LYS 9 -0.804 5.632 -11.227
74 1HD LYS 9 1HD LYS 9 -1.283 6.472 -9.180
75 2HD LYS 9 2HD LYS 9 -0.361 5.173 -8.452
76 1HE LYS 9 1HE LYS 9 0.992 6.829 -7.648
77 2HE LYS 9 2HE LYS 9 1.671 6.866 -9.262
78 1HZ LYS 9 1HZ LYS 9 -0.214 8.515 -9.761
79 H ASN 10 H ASN 10 0.756 1.585 -9.432
80 HA ASN 10 HA ASN 10 0.175 -0.626 -11.229
81 1HB ASN 10 1HB ASN 10 2.577 0.192 -11.034
82 2HB ASN 10 2HB ASN 10 2.552 -0.238 -9.335
83 1HD2 ASN 10 2HD2 ASN 10 1.943 -1.554 -12.575
84 2HD2 ASN 10 1HD2 ASN 10 2.522 -3.159 -12.279
85 H ALA 11 H ALA 11 -0.342 -2.718 -10.285
86 HA ALA 11 HA ALA 11 -0.416 -2.918 -7.397
87 1HB ALA 11 1HB ALA 11 -2.876 -2.861 -9.169
88 2HB ALA 11 2HB ALA 11 -2.556 -1.937 -7.682
89 3HB ALA 11 3HB ALA 11 -2.870 -3.687 -7.593
90 H ASP 12 H ASP 12 -1.251 -4.348 -10.617
91 HA ASP 12 HA ASP 12 -1.163 -6.392 -11.360
92 1HB ASP 12 1HB ASP 12 1.331 -5.709 -10.891
93 2HB ASP 12 2HB ASP 12 1.249 -6.855 -9.568
94 HD2 ASP 12 HD ASP 12 0.368 -9.391 -11.969
95 H MET 13 H MET 13 -3.144 -6.683 -9.758
96 HA MET 13 HA MET 13 -2.833 -9.176 -8.517
97 1HB MET 13 1HB MET 13 -2.452 -6.755 -6.883
98 2HB MET 13 2HB MET 13 -3.831 -7.670 -6.304
99 1HG MET 13 1HG MET 13 -2.452 -9.192 -5.336
100 2HG MET 13 2HG MET 13 -1.716 -9.550 -6.887
101 1HE MET 13 1HE MET 13 -1.023 -8.246 -3.391
102 2HE MET 13 2HE MET 13 -0.217 -6.682 -3.657
103 3HE MET 13 3HE MET 13 -1.929 -6.889 -4.101
104 H SER 14 H SER 14 -5.040 -9.337 -6.875
105 HA SER 14 HA SER 14 -7.121 -8.808 -8.788
106 1HB SER 14 1HB SER 14 -7.316 -10.995 -7.987
107 2HB SER 14 2HB SER 14 -6.801 -10.568 -6.368
108 HG SER 14 HG SER 14 -8.864 -10.462 -5.845
109 H GLU 15 H GLU 15 -8.938 -7.460 -8.394
110 HA GLU 15 HA GLU 15 -8.551 -5.233 -6.909
111 1HB GLU 15 1HB GLU 15 -10.456 -6.092 -8.669
112 2HB GLU 15 2HB GLU 15 -11.386 -6.142 -7.184
113 1HG GLU 15 1HG GLU 15 -11.407 -3.855 -6.959
114 2HG GLU 15 2HG GLU 15 -9.743 -3.683 -7.481
115 HE2 GLU 15 HE GLU 15 -9.760 -3.173 -10.218
116 H GLU 16 H GLU 16 -9.417 -8.426 -5.817
117 HA GLU 16 HA GLU 16 -10.898 -7.788 -3.578
118 1HB GLU 16 1HB GLU 16 -10.426 -10.090 -4.666
119 2HB GLU 16 2HB GLU 16 -8.936 -10.106 -3.746
120 1HG GLU 16 1HG GLU 16 -11.578 -9.557 -2.356
121 2HG GLU 16 2HG GLU 16 -11.099 -11.204 -2.715
122 HE2 GLU 16 HE GLU 16 -9.763 -11.880 -0.429
123 H MET 17 H MET 17 -7.347 -8.590 -3.784
124 HA MET 17 HA MET 17 -6.963 -7.593 -1.148
125 1HB MET 17 1HB MET 17 -4.831 -8.258 -3.242
126 2HB MET 17 2HB MET 17 -4.650 -8.315 -1.499
127 1HG MET 17 1HG MET 17 -5.125 -10.541 -1.690
128 2HG MET 17 2HG MET 17 -6.792 -10.041 -1.887
129 1HE MET 17 1HE MET 17 -3.416 -10.501 -4.169
130 2HE MET 17 2HE MET 17 -3.952 -11.826 -3.108
131 3HE MET 17 3HE MET 17 -4.083 -11.992 -4.876
132 H GLN 18 H GLN 18 -6.526 -6.429 -4.493
133 HA GLN 18 HA GLN 18 -4.842 -4.305 -3.870
134 1HB GLN 18 1HB GLN 18 -5.083 -5.090 -6.161
135 2HB GLN 18 2HB GLN 18 -6.803 -4.749 -6.160
136 1HG GLN 18 1HG GLN 18 -5.623 -2.293 -5.422
137 2HG GLN 18 2HG GLN 18 -4.544 -2.928 -6.648
138 1HE2 GLN 18 2HE2 GLN 18 -7.620 -1.592 -5.935
139 2HE2 GLN 18 1HE2 GLN 18 -8.264 -1.512 -7.541
140 H GLN 19 H GLN 19 -8.440 -4.581 -4.132
141 HA GLN 19 HA GLN 19 -8.841 -1.847 -3.600
142 1HB GLN 19 1HB GLN 19 -10.425 -3.528 -4.773
143 2HB GLN 19 2HB GLN 19 -10.871 -4.072 -3.169
144 1HG GLN 19 1HG GLN 19 -11.256 -1.306 -4.378
145 2HG GLN 19 2HG GLN 19 -12.487 -2.396 -3.774
146 1HE2 GLN 19 2HE2 GLN 19 -10.750 0.310 -3.127
147 2HE2 GLN 19 1HE2 GLN 19 -10.863 0.384 -1.401
148 H ASP 20 H ASP 20 -9.003 -4.874 -1.621
149 HA ASP 20 HA ASP 20 -9.931 -3.730 0.682
150 1HB ASP 20 1HB ASP 20 -9.564 -6.207 0.150
151 2HB ASP 20 2HB ASP 20 -7.861 -5.967 0.490
152 HD2 ASP 20 HD ASP 20 -8.401 -5.219 3.826
153 H ALA 21 H ALA 21 -6.558 -4.213 -0.567
154 HA ALA 21 HA ALA 21 -5.256 -3.180 1.698
155 1HB ALA 21 1HB ALA 21 -4.319 -3.252 -1.197
156 2HB ALA 21 2HB ALA 21 -4.255 -4.637 -0.082
157 3HB ALA 21 3HB ALA 21 -3.297 -3.176 0.258
158 H VAL 22 H VAL 22 -5.668 -1.673 -1.589
159 HA VAL 22 HA VAL 22 -4.842 0.835 -0.925
160 HB VAL 22 HB VAL 22 -5.655 -0.326 -3.149
161 1HG1 VAL 22 1HG1 VAL 22 -8.034 1.467 -2.624
162 2HG1 VAL 22 2HG1 VAL 22 -8.069 -0.279 -2.277
163 3HG1 VAL 22 3HG1 VAL 22 -7.789 0.294 -3.939
164 1HG2 VAL 22 1HG2 VAL 22 -6.242 2.540 -3.356
165 2HG2 VAL 22 2HG2 VAL 22 -4.946 1.577 -4.106
166 3HG2 VAL 22 3HG2 VAL 22 -4.752 2.192 -2.446
167 H ASP 23 H ASP 23 -7.786 -0.842 0.022
168 HA ASP 23 HA ASP 23 -9.335 1.401 0.546
169 1HB ASP 23 1HB ASP 23 -9.436 -1.467 0.984
170 2HB ASP 23 2HB ASP 23 -9.929 -0.659 2.460
171 HD2 ASP 23 HD ASP 23 -12.830 -1.284 0.452
172 H CYS 24 H CYS 24 -7.624 -0.851 2.861
173 HA CYS 24 HA CYS 24 -7.896 0.717 5.094
174 1HB CYS 24 1HB CYS 24 -5.766 -1.305 4.347
175 2HB CYS 24 2HB CYS 24 -5.849 -0.552 5.927
176 HG CYS 24 HG CYS 24 -7.180 -3.093 4.994
177 H ALA 25 H ALA 25 -5.529 0.796 2.402
178 HA ALA 25 HA ALA 25 -3.664 2.503 3.584
179 1HB ALA 25 1HB ALA 25 -3.529 1.080 1.435
180 2HB ALA 25 2HB ALA 25 -2.773 2.692 1.395
181 3HB ALA 25 3HB ALA 25 -4.362 2.434 0.634
182 H THR 26 H THR 26 -6.118 3.368 1.040
183 HA THR 26 HA THR 26 -5.909 6.084 1.275
184 HB THR 26 HB THR 26 -8.306 4.283 0.649
185 HG1 THR 26 HG1 THR 26 -7.169 4.194 -1.252
186 1HG2 THR 26 1HG2 THR 26 -8.103 6.907 -0.694
187 2HG2 THR 26 2HG2 THR 26 -8.399 7.064 1.053
188 3HG2 THR 26 3HG2 THR 26 -9.525 6.129 0.040
189 H GLN 27 H GLN 27 -8.140 3.926 3.143
190 HA GLN 27 HA GLN 27 -9.355 5.919 4.556
191 1HB GLN 27 1HB GLN 27 -9.143 3.036 4.670
192 2HB GLN 27 2HB GLN 27 -9.040 3.666 6.301
193 1HG GLN 27 1HG GLN 27 -11.213 4.473 4.313
194 2HG GLN 27 2HG GLN 27 -11.407 3.195 5.497
195 1HE2 GLN 27 2HE2 GLN 27 -13.220 4.671 6.060
196 2HE2 GLN 27 1HE2 GLN 27 -12.944 5.905 7.242
197 H ALA 28 H ALA 28 -6.203 4.292 5.093
198 HA ALA 28 HA ALA 28 -5.711 5.204 7.667
199 1HB ALA 28 1HB ALA 28 -3.666 4.813 5.453
200 2HB ALA 28 2HB ALA 28 -4.450 3.466 6.312
201 3HB ALA 28 3HB ALA 28 -3.427 4.618 7.204
202 H LEU 29 H LEU 29 -4.699 6.637 4.480
203 HA LEU 29 HA LEU 29 -3.662 8.966 5.679
204 1HB LEU 29 1HB LEU 29 -3.427 7.787 3.275
205 2HB LEU 29 2HB LEU 29 -4.600 9.025 2.867
206 HG LEU 29 HG LEU 29 -2.361 9.795 2.376
207 1HD1 LEU 29 1HD1 LEU 29 -4.196 11.314 3.422
208 2HD1 LEU 29 2HD1 LEU 29 -2.534 11.928 3.250
209 3HD1 LEU 29 3HD1 LEU 29 -3.111 11.352 4.832
210 1HD2 LEU 29 1HD2 LEU 29 -0.673 10.125 4.129
211 2HD2 LEU 29 2HD2 LEU 29 -1.100 8.409 3.929
212 3HD2 LEU 29 3HD2 LEU 29 -1.744 9.333 5.308
213 H GLU 30 H GLU 30 -6.868 7.828 5.220
214 HA GLU 30 HA GLU 30 -7.909 10.526 5.094
215 1HB GLU 30 1HB GLU 30 -8.748 8.121 3.954
216 2HB GLU 30 2HB GLU 30 -9.859 8.315 5.294
217 1HG GLU 30 1HG GLU 30 -9.275 10.637 3.424
218 2HG GLU 30 2HG GLU 30 -10.458 9.422 2.991
219 HE2 GLU 30 HE GLU 30 -11.926 9.183 5.545
220 H LYS 31 H LYS 31 -6.701 8.557 7.440
221 HA LYS 31 HA LYS 31 -8.611 9.594 9.409
222 1HB LYS 31 1HB LYS 31 -9.171 7.300 9.271
223 2HB LYS 31 2HB LYS 31 -7.496 6.798 9.176
224 1HG LYS 31 1HG LYS 31 -7.436 6.595 11.430
225 2HG LYS 31 2HG LYS 31 -7.730 8.315 11.587
226 1HD LYS 31 1HD LYS 31 -10.198 7.905 11.436
227 2HD LYS 31 2HD LYS 31 -9.900 6.183 11.287
228 1HE LYS 31 1HE LYS 31 -9.051 6.015 13.525
229 2HE LYS 31 2HE LYS 31 -8.805 7.744 13.657
230 1HZ LYS 31 1HZ LYS 31 -10.834 6.966 14.816
231 H TYR 32 H TYR 32 -5.294 8.329 8.724
232 HA TYR 32 HA TYR 32 -4.329 9.846 11.033
233 1HB TYR 32 1HB TYR 32 -3.358 7.618 9.168
234 2HB TYR 32 2HB TYR 32 -2.186 8.487 10.138
235 HD1 TYR 32 HD1 TYR 32 -5.336 6.491 10.423
236 HD2 TYR 32 HD2 TYR 32 -1.759 7.828 12.353
237 HE1 TYR 32 HE1 TYR 32 -5.812 4.950 12.388
238 HE2 TYR 32 HE2 TYR 32 -2.248 6.283 14.312
239 HH TYR 32 HH TYR 32 -4.410 3.795 14.148
240 H ASN 33 H ASN 33 -2.331 11.150 10.787
241 HA ASN 33 HA ASN 33 -2.240 12.294 8.105
242 1HB ASN 33 1HB ASN 33 -3.118 13.791 9.996
243 2HB ASN 33 2HB ASN 33 -1.538 13.679 10.745
244 1HD2 ASN 33 2HD2 ASN 33 -0.076 15.125 10.239
245 2HD2 ASN 33 1HD2 ASN 33 -0.076 16.174 8.861
246 H ILE 34 H ILE 34 -0.647 10.383 10.401
247 HA ILE 34 HA ILE 34 2.009 11.362 9.649
248 HB ILE 34 HB ILE 34 1.202 9.459 11.852
249 1HG1 ILE 34 1HG1 ILE 34 2.213 11.913 12.869
250 2HG1 ILE 34 2HG1 ILE 34 0.981 12.321 11.692
251 1HG2 ILE 34 1HG2 ILE 34 3.371 9.195 12.367
252 2HG2 ILE 34 2HG2 ILE 34 3.779 10.884 11.980
253 3HG2 ILE 34 3HG2 ILE 34 3.650 9.679 10.677
254 1HD1 ILE 34 1HD1 ILE 34 -0.724 11.321 12.904
255 2HD1 ILE 34 2HD1 ILE 34 0.371 11.727 14.248
256 3HD1 ILE 34 3HD1 ILE 34 0.349 10.076 13.585
257 H GLU 35 H GLU 35 2.825 10.420 7.859
258 HA GLU 35 HA GLU 35 1.807 8.221 6.651
259 1HB GLU 35 1HB GLU 35 3.265 9.505 5.341
260 2HB GLU 35 2HB GLU 35 4.496 9.582 6.587
261 1HG GLU 35 1HG GLU 35 3.896 6.822 5.641
262 2HG GLU 35 2HG GLU 35 4.555 7.875 4.403
263 HE2 GLU 35 HE GLU 35 5.448 5.890 6.849
264 H LYS 36 H LYS 36 4.667 8.371 8.888
265 HA LYS 36 HA LYS 36 5.434 5.785 8.865
266 1HB LYS 36 1HB LYS 36 5.308 7.797 11.113
267 2HB LYS 36 2HB LYS 36 6.005 6.206 11.344
268 1HG LYS 36 1HG LYS 36 7.741 6.592 9.757
269 2HG LYS 36 2HG LYS 36 6.882 7.915 8.993
270 1HD LYS 36 1HD LYS 36 7.096 9.141 11.290
271 2HD LYS 36 2HD LYS 36 8.278 7.912 11.696
272 1HE LYS 36 1HE LYS 36 9.793 8.615 10.013
273 2HE LYS 36 2HE LYS 36 8.543 9.404 9.074
274 1HZ LYS 36 1HZ LYS 36 8.537 11.227 10.502
275 H ASP 37 H ASP 37 2.754 7.196 10.857
276 HA ASP 37 HA ASP 37 2.083 4.743 11.994
277 1HB ASP 37 1HB ASP 37 1.193 7.474 12.088
278 2HB ASP 37 2HB ASP 37 -0.222 6.493 11.759
279 HD2 ASP 37 HD ASP 37 0.313 4.337 13.201
280 H ILE 38 H ILE 38 1.242 6.459 8.980
281 HA ILE 38 HA ILE 38 -1.075 5.002 8.351
282 HB ILE 38 HB ILE 38 0.892 6.542 6.661
283 1HG1 ILE 38 1HG1 ILE 38 -0.759 7.524 8.555
284 2HG1 ILE 38 2HG1 ILE 38 -0.297 8.401 7.110
285 1HG2 ILE 38 1HG2 ILE 38 -1.843 5.517 5.856
286 2HG2 ILE 38 2HG2 ILE 38 -0.289 4.834 5.319
287 3HG2 ILE 38 3HG2 ILE 38 -0.733 6.500 4.872
288 1HD1 ILE 38 1HD1 ILE 38 -2.339 7.531 5.940
289 2HD1 ILE 38 2HD1 ILE 38 -2.739 8.487 7.387
290 3HD1 ILE 38 3HD1 ILE 38 -2.817 6.709 7.446
291 H ALA 39 H ALA 39 2.187 4.767 6.764
292 HA ALA 39 HA ALA 39 1.698 2.349 5.536
293 1HB ALA 39 1HB ALA 39 3.908 4.151 6.013
294 2HB ALA 39 2HB ALA 39 3.678 2.984 4.689
295 3HB ALA 39 3HB ALA 39 4.456 2.469 6.205
296 H ALA 40 H ALA 40 2.616 3.117 8.889
297 HA ALA 40 HA ALA 40 3.453 0.513 9.578
298 1HB ALA 40 1HB ALA 40 4.145 2.366 10.927
299 2HB ALA 40 2HB ALA 40 3.022 1.415 11.928
300 3HB ALA 40 3HB ALA 40 2.467 2.917 11.152
301 H TYR 41 H TYR 41 0.301 2.185 9.396
302 HA TYR 41 HA TYR 41 -1.114 0.194 10.846
303 1HB TYR 41 1HB TYR 41 -1.822 2.591 10.492
304 2HB TYR 41 2HB TYR 41 -1.843 2.340 8.758
305 HD1 TYR 41 HD1 TYR 41 -3.398 0.901 11.860
306 HD2 TYR 41 HD2 TYR 41 -3.891 1.938 7.737
307 HE1 TYR 41 HE1 TYR 41 -5.851 0.243 11.980
308 HE2 TYR 41 HE2 TYR 41 -6.342 1.275 7.871
309 HH TYR 41 HH TYR 41 -7.631 -0.298 10.718
310 H ILE 42 H ILE 42 -0.392 0.808 7.372
311 HA ILE 42 HA ILE 42 -2.146 -1.183 6.416
312 HB ILE 42 HB ILE 42 0.305 0.004 5.112
313 1HG1 ILE 42 1HG1 ILE 42 -2.561 0.991 5.037
314 2HG1 ILE 42 2HG1 ILE 42 -1.267 1.730 5.959
315 1HG2 ILE 42 1HG2 ILE 42 -1.794 -0.573 3.280
316 2HG2 ILE 42 2HG2 ILE 42 -1.512 -2.026 4.270
317 3HG2 ILE 42 3HG2 ILE 42 -0.164 -1.284 3.373
318 1HD1 ILE 42 1HD1 ILE 42 -0.013 2.256 3.939
319 2HD1 ILE 42 2HD1 ILE 42 -1.688 2.809 3.703
320 3HD1 ILE 42 3HD1 ILE 42 -1.133 1.298 2.940
321 H LYS 43 H LYS 43 1.476 -1.129 6.770
322 HA LYS 43 HA LYS 43 1.914 -3.745 6.091
323 1HB LYS 43 1HB LYS 43 3.796 -2.386 6.262
324 2HB LYS 43 2HB LYS 43 3.350 -1.770 7.840
325 1HG LYS 43 1HG LYS 43 3.671 -4.698 7.867
326 2HG LYS 43 2HG LYS 43 5.126 -3.893 7.313
327 1HD LYS 43 1HD LYS 43 3.662 -2.969 9.818
328 2HD LYS 43 2HD LYS 43 4.842 -4.265 9.877
329 1HE LYS 43 1HE LYS 43 5.848 -1.936 8.374
330 2HE LYS 43 2HE LYS 43 5.389 -1.506 10.009
331 1HZ LYS 43 1HZ LYS 43 7.584 -2.263 10.209
332 H LYS 44 H LYS 44 1.214 -2.367 9.372
333 HA LYS 44 HA LYS 44 1.282 -4.847 10.671
334 1HB LYS 44 1HB LYS 44 1.540 -2.728 11.843
335 2HB LYS 44 2HB LYS 44 -0.085 -2.241 11.404
336 1HG LYS 44 1HG LYS 44 -1.021 -4.175 12.672
337 2HG LYS 44 2HG LYS 44 0.598 -4.700 13.087
338 1HD LYS 44 1HD LYS 44 -0.003 -3.480 15.001
339 2HD LYS 44 2HD LYS 44 0.883 -2.277 14.085
340 1HE LYS 44 1HE LYS 44 -0.951 -0.943 14.021
341 2HE LYS 44 2HE LYS 44 -1.854 -2.193 13.186
342 1HZ LYS 44 1HZ LYS 44 -3.006 -1.833 15.194
343 H GLU 45 H GLU 45 -1.231 -3.107 8.834
344 HA GLU 45 HA GLU 45 -3.430 -4.446 9.729
345 1HB GLU 45 1HB GLU 45 -2.752 -2.698 7.569
346 2HB GLU 45 2HB GLU 45 -3.623 -4.046 6.865
347 1HG GLU 45 1HG GLU 45 -4.632 -2.576 9.337
348 2HG GLU 45 2HG GLU 45 -5.042 -2.058 7.714
349 HE2 GLU 45 HE GLU 45 -5.939 -3.905 6.381
350 H PHE 46 H PHE 46 -1.540 -5.236 6.714
351 HA PHE 46 HA PHE 46 -2.792 -7.776 6.500
352 1HB PHE 46 1HB PHE 46 -0.552 -6.172 5.213
353 2HB PHE 46 2HB PHE 46 -0.606 -7.890 4.867
354 HD1 PHE 46 HD1 PHE 46 -3.544 -8.335 4.741
355 HD2 PHE 46 HD2 PHE 46 -1.160 -5.185 3.192
356 HE1 PHE 46 HE1 PHE 46 -5.255 -7.921 2.951
357 HE2 PHE 46 HE2 PHE 46 -2.871 -4.771 1.402
358 HZ PHE 46 HZ PHE 46 -4.898 -6.144 1.303
359 H ASP 47 H ASP 47 0.527 -6.640 7.433
360 HA ASP 47 HA ASP 47 1.844 -8.891 7.709
361 1HB ASP 47 1HB ASP 47 2.779 -6.739 8.389
362 2HB ASP 47 2HB ASP 47 1.647 -6.609 9.722
363 HD2 ASP 47 HD ASP 47 4.608 -6.850 9.366
364 H LYS 48 H LYS 48 -0.744 -7.654 9.897
365 HA LYS 48 HA LYS 48 -0.565 -9.225 12.058
366 1HB LYS 48 1HB LYS 48 -2.281 -7.557 11.820
367 2HB LYS 48 2HB LYS 48 -3.035 -8.426 10.499
368 1HG LYS 48 1HG LYS 48 -4.384 -9.198 12.208
369 2HG LYS 48 2HG LYS 48 -3.121 -10.407 12.326
370 1HD LYS 48 1HD LYS 48 -2.898 -9.772 14.498
371 2HD LYS 48 2HD LYS 48 -2.103 -8.333 13.891
372 1HE LYS 48 1HE LYS 48 -3.813 -7.024 14.604
373 2HE LYS 48 2HE LYS 48 -4.967 -7.954 13.670
374 1HZ LYS 48 1HZ LYS 48 -4.037 -8.590 16.417
375 H LYS 49 H LYS 49 -2.613 -10.224 9.225
376 HA LYS 49 HA LYS 49 -1.504 -12.892 9.445
377 1HB LYS 49 1HB LYS 49 -4.177 -12.149 10.433
378 2HB LYS 49 2HB LYS 49 -4.188 -13.486 9.302
379 1HG LYS 49 1HG LYS 49 -2.668 -14.783 10.649
380 2HG LYS 49 2HG LYS 49 -2.216 -13.396 11.619
381 1HD LYS 49 1HD LYS 49 -4.916 -13.408 12.074
382 2HD LYS 49 2HD LYS 49 -4.663 -15.118 11.785
383 1HE LYS 49 1HE LYS 49 -3.786 -15.367 13.862
384 2HE LYS 49 2HE LYS 49 -2.526 -14.205 13.496
385 1HZ LYS 49 1HZ LYS 49 -4.039 -13.585 15.393
386 H TYR 50 H TYR 50 -0.595 -11.875 7.413
387 HA TYR 50 HA TYR 50 -2.299 -12.660 5.213
388 1HB TYR 50 1HB TYR 50 -2.568 -10.105 5.947
389 2HB TYR 50 2HB TYR 50 -0.951 -9.905 5.304
390 HD1 TYR 50 HD1 TYR 50 -4.089 -11.634 4.151
391 HD2 TYR 50 HD2 TYR 50 -0.910 -8.931 3.208
392 HE1 TYR 50 HE1 TYR 50 -5.049 -11.306 1.820
393 HE2 TYR 50 HE2 TYR 50 -1.881 -8.613 0.880
394 HH TYR 50 HH TYR 50 -3.299 -9.478 -0.610
395 H ASN 51 H ASN 51 0.151 -13.701 6.444
396 HA ASN 51 HA ASN 51 1.990 -14.615 5.717
397 1HB ASN 51 1HB ASN 51 0.766 -13.800 3.245
398 2HB ASN 51 2HB ASN 51 2.456 -13.354 3.129
399 1HD2 ASN 51 2HD2 ASN 51 2.529 -14.963 1.456
400 2HD2 ASN 51 1HD2 ASN 51 2.762 -16.635 1.843
401 HA PRO 52 HA PRO 52 3.960 -10.552 6.539
402 1HB PRO 52 1HB PRO 52 4.790 -11.029 9.099
403 2HB PRO 52 2HB PRO 52 3.282 -10.222 8.715
404 1HG PRO 52 1HG PRO 52 3.714 -12.987 9.667
405 2HG PRO 52 2HG PRO 52 2.242 -12.037 9.685
406 1HD PRO 52 1HD PRO 52 2.899 -14.150 7.860
407 2HD PRO 52 2HD PRO 52 1.479 -13.122 7.807
408 H THR 53 H THR 53 7.404 -11.034 6.576
409 HA THR 53 HA THR 53 5.061 -9.482 7.436
410 HB THR 53 HB THR 53 6.898 -9.335 9.006
411 HG1 THR 53 HG1 THR 53 6.600 -7.150 8.832
412 1HG2 THR 53 1HG2 THR 53 9.122 -8.299 7.981
413 2HG2 THR 53 2HG2 THR 53 8.568 -9.080 6.481
414 3HG2 THR 53 3HG2 THR 53 8.882 -10.062 7.931
415 H TRP 54 H TRP 54 4.822 -7.269 6.556
416 HA TRP 54 HA TRP 54 5.520 -7.317 3.703
417 1HB TRP 54 1HB TRP 54 3.264 -5.890 5.124
418 2HB TRP 54 2HB TRP 54 3.602 -5.816 3.406
419 HD1 TRP 54 HD TRP 54 2.726 -8.599 6.014
420 HE1 TRP 54 HE1 TRP 54 1.235 -10.469 4.899
421 HE3 TRP 54 HE3 TRP 54 2.815 -6.616 1.333
422 HZ2 TRP 54 HZ2 TRP 54 0.280 -10.899 2.244
423 HZ3 TRP 54 HZ3 TRP 54 1.577 -7.823 -0.463
424 HH2 TRP 54 HH TRP 54 0.340 -9.893 -0.067
425 H HIS 55 H HIS 55 5.745 -4.951 2.807
426 HA HIS 55 HA HIS 55 6.924 -3.197 4.800
427 1HB HIS 55 1HB HIS 55 8.373 -4.055 2.280
428 2HB HIS 55 2HB HIS 55 8.918 -2.829 3.407
429 HD1 HIS 55 HD1 HIS 55 10.360 -3.610 5.320
430 HD2 HIS 55 HD2 HIS 55 8.249 -6.753 3.515
431 HE1 HIS 55 HE1 HIS 55 11.219 -5.758 6.393
432 H CYS 56 H CYS 56 6.247 -1.122 4.504
433 HA CYS 56 HA CYS 56 5.065 -0.534 1.888
434 1HB CYS 56 1HB CYS 56 3.652 -0.593 4.144
435 2HB CYS 56 2HB CYS 56 4.298 1.026 4.329
436 HG CYS 56 HG CYS 56 3.689 1.699 1.757
437 H ILE 57 H ILE 57 5.742 1.394 0.856
438 HA ILE 57 HA ILE 57 7.758 2.950 2.316
439 HB ILE 57 HB ILE 57 7.839 2.082 -0.576
440 1HG1 ILE 57 1HG1 ILE 57 8.405 0.410 1.333
441 2HG1 ILE 57 2HG1 ILE 57 9.489 0.561 -0.036
442 1HG2 ILE 57 1HG2 ILE 57 10.208 3.132 -0.332
443 2HG2 ILE 57 2HG2 ILE 57 9.472 4.047 1.007
444 3HG2 ILE 57 3HG2 ILE 57 8.804 4.184 -0.637
445 1HD1 ILE 57 1HD1 ILE 57 9.839 2.059 2.601
446 2HD1 ILE 57 2HD1 ILE 57 10.977 2.050 1.233
447 3HD1 ILE 57 3HD1 ILE 57 10.694 0.561 2.165
448 H VAL 58 H VAL 58 7.868 5.221 1.747
449 HA VAL 58 HA VAL 58 5.576 6.160 0.188
450 HB VAL 58 HB VAL 58 4.842 6.230 2.466
451 1HG1 VAL 58 1HG1 VAL 58 7.612 6.955 2.998
452 2HG1 VAL 58 2HG1 VAL 58 6.372 6.303 4.095
453 3HG1 VAL 58 3HG1 VAL 58 6.473 8.056 3.808
454 1HG2 VAL 58 1HG2 VAL 58 3.921 8.258 2.228
455 2HG2 VAL 58 2HG2 VAL 58 4.949 8.436 0.786
456 3HG2 VAL 58 3HG2 VAL 58 5.496 9.079 2.352
457 H GLY 59 H GLY 59 6.732 6.912 -1.559
458 1HA GLY 59 2HA GLY 59 8.610 9.098 -0.991
459 2HA GLY 59 1HA GLY 59 9.152 7.754 -1.974
460 H ARG 60 H ARG 60 8.452 7.531 -4.131
461 HA ARG 60 HA ARG 60 6.302 9.171 -5.027
462 1HB ARG 60 1HB ARG 60 7.856 10.149 -6.898
463 2HB ARG 60 2HB ARG 60 7.908 10.894 -5.313
464 1HG ARG 60 1HG ARG 60 9.881 9.383 -4.743
465 2HG ARG 60 2HG ARG 60 9.872 8.826 -6.405
466 1HD ARG 60 1HD ARG 60 9.872 11.545 -6.815
467 2HD ARG 60 2HD ARG 60 10.737 11.466 -5.293
468 HE ARG 60 HE ARG 60 12.036 9.535 -6.690
469 1HH1 ARG 60 2HH2 ARG 60 11.086 12.807 -7.662
470 2HH1 ARG 60 1HH2 ARG 60 12.398 12.992 -8.777
471 1HH2 ARG 60 1HH ARG 60 13.963 11.199 -9.054
472 H ASN 61 H ASN 61 9.128 7.061 -5.811
473 HA ASN 61 HA ASN 61 7.431 5.801 -7.821
474 1HB ASN 61 1HB ASN 61 10.090 6.925 -8.066
475 2HB ASN 61 2HB ASN 61 10.226 5.190 -8.268
476 1HD2 ASN 61 2HD2 ASN 61 10.503 4.974 -10.383
477 2HD2 ASN 61 1HD2 ASN 61 9.415 5.509 -11.618
478 H PHE 62 H PHE 62 9.136 3.534 -8.286
479 HA PHE 62 HA PHE 62 8.695 2.097 -5.825
480 1HB PHE 62 1HB PHE 62 9.983 1.088 -8.408
481 2HB PHE 62 2HB PHE 62 8.991 0.178 -7.287
482 HD1 PHE 62 HD1 PHE 62 8.971 2.528 -10.083
483 HD2 PHE 62 HD2 PHE 62 6.561 0.351 -7.352
484 HE1 PHE 62 HE1 PHE 62 6.956 2.966 -11.512
485 HE2 PHE 62 HE2 PHE 62 4.545 0.790 -8.781
486 HZ PHE 62 HZ PHE 62 4.767 2.091 -10.844
487 H GLY 63 H GLY 63 10.934 0.165 -6.810
488 1HA GLY 63 2HA GLY 63 13.298 1.710 -6.002
489 2HA GLY 63 1HA GLY 63 12.822 0.327 -5.036
490 H SER 64 H SER 64 14.512 -1.094 -5.496
491 HA SER 64 HA SER 64 15.718 -1.378 -7.926
492 1HB SER 64 1HB SER 64 15.339 -3.796 -6.162
493 2HB SER 64 2HB SER 64 16.779 -3.260 -7.004
494 HG SER 64 HG SER 64 16.854 -2.923 -4.660
495 H TYR 65 H TYR 65 13.091 -3.453 -6.481
496 HA TYR 65 HA TYR 65 11.501 -4.680 -7.417
497 1HB TYR 65 1HB TYR 65 12.016 -2.396 -9.171
498 2HB TYR 65 2HB TYR 65 11.674 -3.782 -10.188
499 HD1 TYR 65 HD1 TYR 65 9.454 -4.534 -10.514
500 HD2 TYR 65 HD2 TYR 65 10.305 -1.756 -7.372
501 HE1 TYR 65 HE1 TYR 65 6.964 -4.192 -10.131
502 HE2 TYR 65 HE2 TYR 65 7.813 -1.425 -7.000
503 HH TYR 65 HH TYR 65 5.443 -3.191 -8.980
504 H VAL 66 H VAL 66 13.599 -4.179 -10.335
505 HA VAL 66 HA VAL 66 13.591 -7.019 -10.781
506 HB VAL 66 HB VAL 66 13.329 -5.550 -12.648
507 1HG1 VAL 66 1HG1 VAL 66 14.257 -3.493 -12.099
508 2HG1 VAL 66 2HG1 VAL 66 15.416 -4.113 -13.298
509 3HG1 VAL 66 3HG1 VAL 66 15.796 -4.210 -11.562
510 1HG2 VAL 66 1HG2 VAL 66 14.495 -6.934 -13.951
511 2HG2 VAL 66 2HG2 VAL 66 15.298 -7.551 -12.488
512 3HG2 VAL 66 3HG2 VAL 66 16.038 -6.226 -13.417
513 H THR 67 H THR 67 14.648 -6.893 -8.354
514 HA THR 67 HA THR 67 17.395 -7.649 -8.817
515 HB THR 67 HB THR 67 16.608 -5.274 -7.051
516 HG1 THR 67 HG1 THR 67 18.337 -5.817 -9.359
517 1HG2 THR 67 1HG2 THR 67 19.439 -5.565 -7.314
518 2HG2 THR 67 2HG2 THR 67 18.827 -7.155 -6.800
519 3HG2 THR 67 3HG2 THR 67 18.484 -5.710 -5.820
520 H HIS 68 H HIS 68 15.282 -6.729 -6.012
521 HA HIS 68 HA HIS 68 15.980 -9.302 -4.854
522 1HB HIS 68 1HB HIS 68 15.313 -6.641 -3.835
523 2HB HIS 68 2HB HIS 68 14.423 -7.911 -3.018
524 HD1 HIS 68 HD1 HIS 68 17.776 -6.357 -3.254
525 HD2 HIS 68 HD2 HIS 68 16.119 -9.886 -1.707
526 HE1 HIS 68 HE1 HIS 68 19.528 -7.338 -1.682
527 H GLU 69 H GLU 69 13.361 -7.540 -6.409
528 HA GLU 69 HA GLU 69 11.357 -8.115 -7.009
529 1HB GLU 69 1HB GLU 69 12.374 -10.915 -6.391
530 2HB GLU 69 2HB GLU 69 10.773 -10.631 -7.047
531 1HG GLU 69 1HG GLU 69 11.581 -10.158 -9.136
532 2HG GLU 69 2HG GLU 69 12.877 -9.158 -8.514
533 HE2 GLU 69 HE GLU 69 14.491 -10.061 -9.590
534 H THR 70 H THR 70 9.168 -9.068 -6.188
535 HA THR 70 HA THR 70 9.101 -9.554 -3.334
536 HB THR 70 HB THR 70 7.754 -7.583 -2.835
537 HG1 THR 70 HG1 THR 70 8.065 -7.177 -5.728
538 1HG2 THR 70 1HG2 THR 70 9.227 -5.713 -3.409
539 2HG2 THR 70 2HG2 THR 70 9.939 -6.633 -4.756
540 3HG2 THR 70 3HG2 THR 70 10.258 -7.125 -3.075
541 H ARG 71 H ARG 71 7.783 -11.226 -3.049
542 HA ARG 71 HA ARG 71 6.413 -12.511 -4.855
543 1HB ARG 71 1HB ARG 71 5.698 -11.981 -1.946
544 2HB ARG 71 2HB ARG 71 4.702 -13.049 -2.916
545 1HG ARG 71 1HG ARG 71 7.720 -13.387 -2.586
546 2HG ARG 71 2HG ARG 71 6.535 -14.222 -1.600
547 1HD ARG 71 1HD ARG 71 6.045 -14.450 -4.527
548 2HD ARG 71 2HD ARG 71 7.553 -15.173 -4.001
549 HE ARG 71 HE ARG 71 5.187 -15.860 -2.368
550 1HH1 ARG 71 2HH2 ARG 71 7.322 -16.817 -5.029
551 2HH1 ARG 71 1HH2 ARG 71 6.871 -18.487 -4.956
552 1HH2 ARG 71 1HH ARG 71 5.262 -19.198 -3.326
553 H HIS 72 H HIS 72 4.714 -10.127 -2.674
554 HA HIS 72 HA HIS 72 3.041 -9.430 -4.969
555 1HB HIS 72 1HB HIS 72 2.230 -10.717 -2.497
556 2HB HIS 72 2HB HIS 72 1.427 -9.170 -2.682
557 HD1 HIS 72 HD1 HIS 72 -0.787 -10.685 -2.982
558 HD2 HIS 72 HD2 HIS 72 2.040 -10.915 -6.072
559 HE1 HIS 72 HE1 HIS 72 -1.990 -11.727 -4.977
560 H PHE 73 H PHE 73 2.121 -7.238 -4.850
561 HA PHE 73 HA PHE 73 2.861 -5.497 -2.759
562 1HB PHE 73 1HB PHE 73 4.377 -4.122 -4.417
563 2HB PHE 73 2HB PHE 73 5.091 -5.543 -3.681
564 HD1 PHE 73 HD1 PHE 73 5.360 -7.619 -5.004
565 HD2 PHE 73 HD2 PHE 73 3.969 -4.022 -6.774
566 HE1 PHE 73 HE1 PHE 73 5.876 -8.541 -7.281
567 HE2 PHE 73 HE2 PHE 73 4.485 -4.945 -9.052
568 HZ PHE 73 HZ PHE 73 5.433 -7.192 -9.278
569 H ILE 74 H ILE 74 2.469 -3.091 -3.524
570 HA ILE 74 HA ILE 74 0.822 -2.806 -5.833
571 HB ILE 74 HB ILE 74 -0.974 -3.670 -4.742
572 1HG1 ILE 74 1HG1 ILE 74 -1.059 -0.814 -3.731
573 2HG1 ILE 74 2HG1 ILE 74 -1.375 -1.282 -5.389
574 1HG2 ILE 74 1HG2 ILE 74 -0.073 -2.465 -2.112
575 2HG2 ILE 74 2HG2 ILE 74 0.267 -4.131 -2.639
576 3HG2 ILE 74 3HG2 ILE 74 -1.413 -3.607 -2.377
577 1HD1 ILE 74 1HD1 ILE 74 -3.278 -2.659 -4.719
578 2HD1 ILE 74 2HD1 ILE 74 -3.461 -1.045 -3.989
579 3HD1 ILE 74 3HD1 ILE 74 -2.897 -2.411 -2.999
580 H TYR 75 H TYR 75 1.411 -0.863 -6.620
581 HA TYR 75 HA TYR 75 2.252 1.156 -4.652
582 1HB TYR 75 1HB TYR 75 4.096 0.545 -6.102
583 2HB TYR 75 2HB TYR 75 3.038 0.309 -7.479
584 HD1 TYR 75 HD1 TYR 75 2.591 2.079 -9.009
585 HD2 TYR 75 HD2 TYR 75 4.600 2.905 -5.323
586 HE1 TYR 75 HE1 TYR 75 3.153 4.418 -9.831
587 HE2 TYR 75 HE2 TYR 75 5.155 5.241 -6.157
588 HH TYR 75 HH TYR 75 3.651 6.735 -8.461
589 H PHE 76 H PHE 76 0.721 2.696 -4.346
590 HA PHE 76 HA PHE 76 -0.573 3.745 -6.743
591 1HB PHE 76 1HB PHE 76 -2.701 3.821 -5.270
592 2HB PHE 76 2HB PHE 76 -2.210 2.212 -5.760
593 HD1 PHE 76 HD1 PHE 76 -0.511 1.052 -4.042
594 HD2 PHE 76 HD2 PHE 76 -3.260 4.132 -3.056
595 HE1 PHE 76 HE1 PHE 76 -0.452 0.336 -1.636
596 HE2 PHE 76 HE2 PHE 76 -3.199 3.417 -0.652
597 HZ PHE 76 HZ PHE 76 -1.797 1.527 0.031
598 H TYR 77 H TYR 77 -2.007 5.791 -5.905
599 HA TYR 77 HA TYR 77 -0.112 7.360 -4.302
600 1HB TYR 77 1HB TYR 77 -0.875 7.841 -6.797
601 2HB TYR 77 2HB TYR 77 -2.432 8.257 -6.107
602 HD1 TYR 77 HD1 TYR 77 1.177 9.062 -5.410
603 HD2 TYR 77 HD2 TYR 77 -2.823 10.518 -5.835
604 HE1 TYR 77 HE1 TYR 77 1.988 11.435 -4.988
605 HE2 TYR 77 HE2 TYR 77 -1.999 12.885 -5.412
606 HH TYR 77 HH TYR 77 1.120 13.778 -5.662
607 H LEU 78 H LEU 78 -0.693 7.921 -2.268
608 HA LEU 78 HA LEU 78 -3.546 7.733 -1.618
609 1HB LEU 78 1HB LEU 78 -1.366 6.544 -0.442
610 2HB LEU 78 2HB LEU 78 -1.617 7.946 0.580
611 HG LEU 78 HG LEU 78 -3.904 7.267 1.045
612 1HD1 LEU 78 1HD1 LEU 78 -4.378 4.763 0.202
613 2HD1 LEU 78 2HD1 LEU 78 -3.404 5.352 -1.167
614 3HD1 LEU 78 3HD1 LEU 78 -4.889 6.212 -0.697
615 1HD2 LEU 78 1HD2 LEU 78 -2.664 4.665 1.553
616 2HD2 LEU 78 2HD2 LEU 78 -3.254 5.904 2.689
617 3HD2 LEU 78 3HD2 LEU 78 -1.622 6.042 1.989
618 H GLY 79 H GLY 79 -4.467 9.703 -1.992
619 1HA GLY 79 2HA GLY 79 -4.942 11.875 -1.647
620 2HA GLY 79 1HA GLY 79 -3.826 11.869 -0.297
621 H GLN 80 H GLN 80 -1.753 12.747 -0.517
622 HA GLN 80 HA GLN 80 -1.164 13.740 -3.197
623 1HB GLN 80 1HB GLN 80 -1.300 15.104 -0.609
624 2HB GLN 80 2HB GLN 80 0.274 15.320 -1.349
625 1HG GLN 80 1HG GLN 80 -0.554 16.676 -2.988
626 2HG GLN 80 2HG GLN 80 -1.903 15.609 -3.313
627 1HE2 GLN 80 2HE2 GLN 80 -0.817 18.458 -1.804
628 2HE2 GLN 80 1HE2 GLN 80 -2.287 18.956 -1.037
629 H VAL 81 H VAL 81 -0.273 11.589 -0.720
630 HA VAL 81 HA VAL 81 2.531 11.634 -1.596
631 HB VAL 81 HB VAL 81 3.016 10.501 0.523
632 1HG1 VAL 81 1HG1 VAL 81 2.061 13.229 0.222
633 2HG1 VAL 81 2HG1 VAL 81 3.449 12.604 1.144
634 3HG1 VAL 81 3HG1 VAL 81 1.831 12.642 1.887
635 1HG2 VAL 81 1HG2 VAL 81 1.472 9.761 2.002
636 2HG2 VAL 81 2HG2 VAL 81 0.395 9.779 0.584
637 3HG2 VAL 81 3HG2 VAL 81 0.387 11.144 1.726
638 H ALA 82 H ALA 82 3.529 9.628 -2.170
639 HA ALA 82 HA ALA 82 1.625 7.751 -3.264
640 1HB ALA 82 1HB ALA 82 4.276 6.865 -3.681
641 2HB ALA 82 2HB ALA 82 4.340 8.641 -3.783
642 3HB ALA 82 3HB ALA 82 3.232 7.729 -4.835
643 H ILE 83 H ILE 83 2.227 5.315 -3.015
644 HA ILE 83 HA ILE 83 3.507 4.591 -0.576
645 HB ILE 83 HB ILE 83 1.009 5.475 -0.150
646 1HG1 ILE 83 1HG1 ILE 83 2.373 3.168 1.268
647 2HG1 ILE 83 2HG1 ILE 83 2.658 4.874 1.556
648 1HG2 ILE 83 1HG2 ILE 83 -0.613 3.776 -0.099
649 2HG2 ILE 83 2HG2 ILE 83 0.588 2.497 -0.399
650 3HG2 ILE 83 3HG2 ILE 83 0.157 3.636 -1.697
651 1HD1 ILE 83 1HD1 ILE 83 0.215 3.220 2.217
652 2HD1 ILE 83 2HD1 ILE 83 0.041 4.973 1.962
653 3HD1 ILE 83 3HD1 ILE 83 1.113 4.363 3.244
654 H LEU 84 H LEU 84 4.376 2.592 -0.859
655 HA LEU 84 HA LEU 84 3.043 0.821 -2.766
656 1HB LEU 84 1HB LEU 84 4.706 0.771 -4.227
657 2HB LEU 84 2HB LEU 84 5.194 2.297 -3.517
658 HG LEU 84 HG LEU 84 6.664 0.928 -1.929
659 1HD1 LEU 84 1HD1 LEU 84 7.328 -1.283 -3.314
660 2HD1 LEU 84 2HD1 LEU 84 5.585 -1.217 -3.669
661 3HD1 LEU 84 3HD1 LEU 84 6.149 -1.270 -1.980
662 1HD2 LEU 84 1HD2 LEU 84 8.343 0.482 -3.901
663 2HD2 LEU 84 2HD2 LEU 84 7.873 2.139 -3.457
664 3HD2 LEU 84 3HD2 LEU 84 7.117 1.345 -4.860
665 H LEU 85 H LEU 85 2.600 -1.056 -1.757
666 HA LEU 85 HA LEU 85 4.366 -1.797 0.468
667 1HB LEU 85 1HB LEU 85 2.088 -1.270 1.135
668 2HB LEU 85 2HB LEU 85 1.452 -2.427 -0.018
669 HG LEU 85 HG LEU 85 2.984 -4.116 1.360
670 1HD1 LEU 85 1HD1 LEU 85 2.206 -2.189 3.548
671 2HD1 LEU 85 2HD1 LEU 85 3.813 -2.166 2.784
672 3HD1 LEU 85 3HD1 LEU 85 3.256 -3.623 3.639
673 1HD2 LEU 85 1HD2 LEU 85 0.456 -3.404 2.765
674 2HD2 LEU 85 2HD2 LEU 85 1.049 -4.979 2.180
675 3HD2 LEU 85 3HD2 LEU 85 0.353 -3.807 1.034
676 H PHE 86 H PHE 86 5.040 -4.006 0.658
677 HA PHE 86 HA PHE 86 4.344 -5.834 -1.432
678 1HB PHE 86 1HB PHE 86 6.631 -5.956 -2.353
679 2HB PHE 86 2HB PHE 86 6.132 -4.278 -2.411
680 HD1 PHE 86 HD1 PHE 86 7.967 -6.665 -0.210
681 HD2 PHE 86 HD2 PHE 86 7.528 -2.654 -1.525
682 HE1 PHE 86 HE1 PHE 86 10.010 -6.014 1.095
683 HE2 PHE 86 HE2 PHE 86 9.571 -2.003 -0.219
684 HZ PHE 86 HZ PHE 86 10.788 -3.690 1.075
685 H LYS 87 H LYS 87 5.302 -8.003 -1.060
686 HA LYS 87 HA LYS 87 6.209 -8.272 1.721
687 1HB LYS 87 1HB LYS 87 4.103 -9.210 1.800
688 2HB LYS 87 2HB LYS 87 4.158 -9.776 0.143
689 1HG LYS 87 1HG LYS 87 4.372 -11.725 1.562
690 2HG LYS 87 2HG LYS 87 5.941 -11.451 0.830
691 1HD LYS 87 1HD LYS 87 6.765 -10.356 2.872
692 2HD LYS 87 2HD LYS 87 5.173 -10.422 3.601
693 1HE LYS 87 1HE LYS 87 5.554 -12.525 4.364
694 2HE LYS 87 2HE LYS 87 5.901 -13.094 2.744
695 1HZ LYS 87 1HZ LYS 87 7.958 -13.378 3.660
696 H SER 88 H SER 88 8.402 -8.475 1.552
697 HA SER 88 HA SER 88 9.315 -10.395 -0.446
698 1HB SER 88 1HB SER 88 10.302 -8.301 -0.990
699 2HB SER 88 2HB SER 88 10.579 -7.885 0.688
700 HG SER 88 HG SER 88 12.202 -9.577 0.787
701 H GLY 89 H GLY 89 10.666 -8.928 2.600
702 1HA GLY 89 2HA GLY 89 12.199 -10.986 3.462
703 2HA GLY 89 1HA GLY 89 11.344 -9.889 4.528
Start of MODEL 6
1 1H MET 1 H MET 1 -10.993 18.616 -14.119
2 HA MET 1 HA MET 1 -13.348 20.029 -13.133
3 1HB MET 1 1HB MET 1 -12.763 17.158 -13.906
4 2HB MET 1 2HB MET 1 -13.947 17.427 -12.645
5 1HG MET 1 1HG MET 1 -14.855 19.249 -14.448
6 2HG MET 1 2HG MET 1 -14.083 18.140 -15.562
7 1HE MET 1 1HE MET 1 -17.682 17.587 -12.908
8 2HE MET 1 2HE MET 1 -16.539 18.945 -13.047
9 3HE MET 1 3HE MET 1 -17.723 18.643 -14.340
10 H SER 2 H SER 2 -14.140 18.897 -10.921
11 HA SER 2 HA SER 2 -11.796 19.022 -9.219
12 1HB SER 2 1HB SER 2 -14.713 19.644 -8.884
13 2HB SER 2 2HB SER 2 -13.866 19.064 -7.463
14 HG SER 2 HG SER 2 -12.352 20.969 -8.768
15 H ASP 3 H ASP 3 -11.053 16.826 -9.594
16 HA ASP 3 HA ASP 3 -12.393 14.970 -7.907
17 1HB ASP 3 1HB ASP 3 -13.021 14.927 -10.666
18 2HB ASP 3 2HB ASP 3 -11.842 13.646 -10.474
19 HD2 ASP 3 HD ASP 3 -14.264 11.629 -10.056
20 H ARG 4 H ARG 4 -10.619 14.166 -6.775
21 HA ARG 4 HA ARG 4 -8.384 13.237 -8.310
22 1HB ARG 4 1HB ARG 4 -8.175 15.434 -6.204
23 2HB ARG 4 2HB ARG 4 -6.798 14.432 -6.617
24 1HG ARG 4 1HG ARG 4 -6.891 15.154 -8.960
25 2HG ARG 4 2HG ARG 4 -8.399 16.004 -8.687
26 1HD ARG 4 1HD ARG 4 -7.247 17.864 -8.086
27 2HD ARG 4 2HD ARG 4 -6.541 16.996 -6.737
28 HE ARG 4 HE ARG 4 -5.265 16.467 -9.342
29 1HH1 ARG 4 2HH2 ARG 4 -5.218 18.423 -6.388
30 2HH1 ARG 4 1HH2 ARG 4 -3.559 18.884 -6.572
31 1HH2 ARG 4 1HH ARG 4 -2.318 18.080 -8.458
32 H LYS 5 H LYS 5 -10.202 11.602 -7.117
33 HA LYS 5 HA LYS 5 -9.677 11.101 -4.382
34 1HB LYS 5 1HB LYS 5 -11.486 10.193 -6.421
35 2HB LYS 5 2HB LYS 5 -10.766 8.796 -5.646
36 1HG LYS 5 1HG LYS 5 -11.746 9.242 -3.603
37 2HG LYS 5 2HG LYS 5 -11.585 10.978 -3.781
38 1HD LYS 5 1HD LYS 5 -13.476 10.985 -5.423
39 2HD LYS 5 2HD LYS 5 -13.637 9.250 -5.246
40 1HE LYS 5 1HE LYS 5 -13.679 10.816 -2.693
41 2HE LYS 5 2HE LYS 5 -15.049 11.067 -3.755
42 1HZ LYS 5 1HZ LYS 5 -15.402 8.655 -3.785
43 H ALA 6 H ALA 6 -8.950 8.752 -3.713
44 HA ALA 6 HA ALA 6 -6.303 8.499 -4.039
45 1HB ALA 6 1HB ALA 6 -8.533 6.571 -3.465
46 2HB ALA 6 2HB ALA 6 -7.196 7.109 -2.421
47 3HB ALA 6 3HB ALA 6 -6.895 5.919 -3.710
48 H VAL 7 H VAL 7 -4.834 7.623 -5.498
49 HA VAL 7 HA VAL 7 -6.012 6.523 -7.954
50 HB VAL 7 HB VAL 7 -3.768 8.524 -7.647
51 1HG1 VAL 7 1HG1 VAL 7 -4.083 8.336 -10.320
52 2HG1 VAL 7 2HG1 VAL 7 -4.445 6.655 -9.860
53 3HG1 VAL 7 3HG1 VAL 7 -2.886 7.385 -9.406
54 1HG2 VAL 7 1HG2 VAL 7 -6.616 8.712 -8.290
55 2HG2 VAL 7 2HG2 VAL 7 -5.580 9.453 -9.533
56 3HG2 VAL 7 3HG2 VAL 7 -5.457 9.985 -7.839
57 H ILE 8 H ILE 8 -4.714 4.911 -9.037
58 HA ILE 8 HA ILE 8 -2.575 3.844 -7.331
59 HB ILE 8 HB ILE 8 -4.973 2.514 -8.495
60 1HG1 ILE 8 1HG1 ILE 8 -3.766 1.369 -6.110
61 2HG1 ILE 8 2HG1 ILE 8 -4.018 3.093 -5.923
62 1HG2 ILE 8 1HG2 ILE 8 -3.174 1.372 -9.651
63 2HG2 ILE 8 2HG2 ILE 8 -3.862 0.318 -8.394
64 3HG2 ILE 8 3HG2 ILE 8 -2.304 1.132 -8.118
65 1HD1 ILE 8 1HD1 ILE 8 -6.162 2.518 -5.390
66 2HD1 ILE 8 2HD1 ILE 8 -6.008 0.909 -6.136
67 3HD1 ILE 8 3HD1 ILE 8 -6.384 2.326 -7.146
68 H LYS 9 H LYS 9 -0.726 3.085 -8.389
69 HA LYS 9 HA LYS 9 -0.583 3.912 -11.185
70 1HB LYS 9 1HB LYS 9 1.331 3.736 -8.919
71 2HB LYS 9 2HB LYS 9 1.973 3.342 -10.500
72 1HG LYS 9 1HG LYS 9 2.176 5.576 -10.854
73 2HG LYS 9 2HG LYS 9 0.431 5.625 -11.010
74 1HD LYS 9 1HD LYS 9 0.613 7.144 -9.285
75 2HD LYS 9 2HD LYS 9 0.586 5.694 -8.303
76 1HE LYS 9 1HE LYS 9 2.536 6.562 -7.444
77 2HE LYS 9 2HE LYS 9 3.257 5.791 -8.842
78 1HZ LYS 9 1HZ LYS 9 2.264 8.348 -9.564
79 H ASN 10 H ASN 10 0.884 1.244 -9.197
80 HA ASN 10 HA ASN 10 -0.022 -0.563 -11.284
81 1HB ASN 10 1HB ASN 10 2.761 -0.596 -10.000
82 2HB ASN 10 2HB ASN 10 2.177 -1.753 -11.180
83 1HD2 ASN 10 2HD2 ASN 10 4.444 0.084 -11.266
84 2HD2 ASN 10 1HD2 ASN 10 4.255 1.071 -12.676
85 H ALA 11 H ALA 11 -1.432 -1.903 -10.132
86 HA ALA 11 HA ALA 11 -0.404 -3.326 -7.858
87 1HB ALA 11 1HB ALA 11 -1.928 -2.541 -6.231
88 2HB ALA 11 2HB ALA 11 -2.939 -1.717 -7.444
89 3HB ALA 11 3HB ALA 11 -1.339 -1.059 -7.023
90 H ASP 12 H ASP 12 -0.810 -4.531 -10.152
91 HA ASP 12 HA ASP 12 -3.280 -5.113 -11.036
92 1HB ASP 12 1HB ASP 12 -0.708 -6.674 -10.840
93 2HB ASP 12 2HB ASP 12 -2.141 -7.545 -11.348
94 HD2 ASP 12 HD ASP 12 -0.767 -4.369 -13.170
95 H MET 13 H MET 13 -1.560 -7.762 -9.304
96 HA MET 13 HA MET 13 -2.425 -9.391 -8.088
97 1HB MET 13 1HB MET 13 -2.032 -6.994 -6.640
98 2HB MET 13 2HB MET 13 -3.595 -7.548 -6.076
99 1HG MET 13 1HG MET 13 -2.438 -8.912 -4.662
100 2HG MET 13 2HG MET 13 -2.109 -9.907 -6.067
101 1HE MET 13 1HE MET 13 -0.378 -9.443 -7.707
102 2HE MET 13 2HE MET 13 0.142 -7.740 -7.723
103 3HE MET 13 3HE MET 13 1.295 -9.017 -7.267
104 H SER 14 H SER 14 -4.627 -9.208 -6.092
105 HA SER 14 HA SER 14 -6.817 -9.304 -8.011
106 1HB SER 14 1HB SER 14 -6.539 -11.473 -7.075
107 2HB SER 14 2HB SER 14 -6.231 -10.845 -5.468
108 HG SER 14 HG SER 14 -8.771 -10.433 -6.771
109 H GLU 15 H GLU 15 -8.616 -7.989 -7.690
110 HA GLU 15 HA GLU 15 -8.462 -5.756 -6.226
111 1HB GLU 15 1HB GLU 15 -10.336 -6.893 -7.894
112 2HB GLU 15 2HB GLU 15 -11.209 -6.897 -6.376
113 1HG GLU 15 1HG GLU 15 -10.331 -4.393 -6.185
114 2HG GLU 15 2HG GLU 15 -10.107 -4.535 -7.917
115 HE2 GLU 15 HE GLU 15 -12.578 -4.747 -5.450
116 H GLU 16 H GLU 16 -9.097 -9.005 -5.065
117 HA GLU 16 HA GLU 16 -10.544 -8.462 -2.804
118 1HB GLU 16 1HB GLU 16 -9.176 -10.682 -3.947
119 2HB GLU 16 2HB GLU 16 -8.575 -10.548 -2.307
120 1HG GLU 16 1HG GLU 16 -11.550 -10.484 -2.975
121 2HG GLU 16 2HG GLU 16 -10.695 -11.973 -2.627
122 HE2 GLU 16 HE GLU 16 -11.945 -9.769 0.332
123 H MET 17 H MET 17 -6.943 -9.001 -2.969
124 HA MET 17 HA MET 17 -6.649 -7.819 -0.402
125 1HB MET 17 1HB MET 17 -4.259 -8.349 -0.745
126 2HB MET 17 2HB MET 17 -5.219 -9.707 -1.299
127 1HG MET 17 1HG MET 17 -3.781 -9.461 -3.122
128 2HG MET 17 2HG MET 17 -5.112 -8.451 -3.651
129 1HE MET 17 1HE MET 17 -1.032 -7.393 -2.103
130 2HE MET 17 2HE MET 17 -2.214 -7.121 -0.800
131 3HE MET 17 3HE MET 17 -2.099 -8.718 -1.578
132 H GLN 18 H GLN 18 -6.180 -6.848 -3.817
133 HA GLN 18 HA GLN 18 -4.667 -4.590 -3.336
134 1HB GLN 18 1HB GLN 18 -5.006 -5.613 -5.574
135 2HB GLN 18 2HB GLN 18 -6.687 -5.124 -5.559
136 1HG GLN 18 1HG GLN 18 -5.348 -2.732 -4.993
137 2HG GLN 18 2HG GLN 18 -4.270 -3.517 -6.128
138 1HE2 GLN 18 2HE2 GLN 18 -7.009 -1.649 -5.743
139 2HE2 GLN 18 1HE2 GLN 18 -7.682 -1.743 -7.336
140 H GLN 19 H GLN 19 -8.253 -5.050 -3.558
141 HA GLN 19 HA GLN 19 -8.782 -2.323 -3.136
142 1HB GLN 19 1HB GLN 19 -10.293 -4.113 -4.224
143 2HB GLN 19 2HB GLN 19 -10.690 -4.630 -2.596
144 1HG GLN 19 1HG GLN 19 -11.162 -1.863 -3.796
145 2HG GLN 19 2HG GLN 19 -12.387 -3.037 -3.357
146 1HE2 GLN 19 2HE2 GLN 19 -12.102 -3.875 -1.008
147 2HE2 GLN 19 1HE2 GLN 19 -11.919 -2.660 0.212
148 H ASP 20 H ASP 20 -9.038 -5.264 -1.014
149 HA ASP 20 HA ASP 20 -9.925 -4.076 1.229
150 1HB ASP 20 1HB ASP 20 -9.406 -6.544 0.817
151 2HB ASP 20 2HB ASP 20 -7.722 -6.188 1.139
152 HD2 ASP 20 HD ASP 20 -10.849 -5.907 2.779
153 H ALA 21 H ALA 21 -6.526 -4.384 0.002
154 HA ALA 21 HA ALA 21 -5.315 -3.162 2.232
155 1HB ALA 21 1HB ALA 21 -3.409 -2.891 0.518
156 2HB ALA 21 2HB ALA 21 -4.490 -3.711 -0.633
157 3HB ALA 21 3HB ALA 21 -3.971 -4.546 0.850
158 H VAL 22 H VAL 22 -5.481 -1.843 -1.147
159 HA VAL 22 HA VAL 22 -4.881 0.702 -0.684
160 HB VAL 22 HB VAL 22 -5.772 -0.644 -2.783
161 1HG1 VAL 22 1HG1 VAL 22 -7.945 0.290 -3.557
162 2HG1 VAL 22 2HG1 VAL 22 -8.170 1.023 -1.949
163 3HG1 VAL 22 3HG1 VAL 22 -8.101 -0.749 -2.120
164 1HG2 VAL 22 1HG2 VAL 22 -4.645 1.723 -2.486
165 2HG2 VAL 22 2HG2 VAL 22 -6.278 2.313 -2.877
166 3HG2 VAL 22 3HG2 VAL 22 -5.412 1.265 -4.026
167 H ASP 23 H ASP 23 -7.899 -0.936 0.268
168 HA ASP 23 HA ASP 23 -9.358 1.350 0.817
169 1HB ASP 23 1HB ASP 23 -10.204 -1.047 0.692
170 2HB ASP 23 2HB ASP 23 -9.477 -1.339 2.258
171 HD2 ASP 23 HD ASP 23 -11.662 0.797 0.723
172 H CYS 24 H CYS 24 -7.653 -0.952 3.087
173 HA CYS 24 HA CYS 24 -7.915 0.604 5.345
174 1HB CYS 24 1HB CYS 24 -5.744 -1.403 4.651
175 2HB CYS 24 2HB CYS 24 -6.033 -0.754 6.254
176 HG CYS 24 HG CYS 24 -7.046 -3.139 6.174
177 H ALA 25 H ALA 25 -5.697 0.754 2.572
178 HA ALA 25 HA ALA 25 -3.715 2.346 3.784
179 1HB ALA 25 1HB ALA 25 -4.392 1.259 1.159
180 2HB ALA 25 2HB ALA 25 -2.798 1.651 1.847
181 3HB ALA 25 3HB ALA 25 -3.753 2.916 1.036
182 H THR 26 H THR 26 -6.018 3.380 1.176
183 HA THR 26 HA THR 26 -5.771 6.072 1.581
184 HB THR 26 HB THR 26 -6.993 4.687 -0.258
185 HG1 THR 26 HG1 THR 26 -8.464 6.609 -0.468
186 1HG2 THR 26 1HG2 THR 26 -9.455 4.565 0.046
187 2HG2 THR 26 2HG2 THR 26 -9.290 5.152 1.718
188 3HG2 THR 26 3HG2 THR 26 -8.647 3.554 1.268
189 H GLN 27 H GLN 27 -8.032 3.808 3.250
190 HA GLN 27 HA GLN 27 -9.373 5.764 4.649
191 1HB GLN 27 1HB GLN 27 -8.821 2.830 5.214
192 2HB GLN 27 2HB GLN 27 -9.787 3.799 6.309
193 1HG GLN 27 1HG GLN 27 -10.519 4.013 3.415
194 2HG GLN 27 2HG GLN 27 -10.816 2.453 4.154
195 1HE2 GLN 27 2HE2 GLN 27 -11.873 5.634 3.751
196 2HE2 GLN 27 1HE2 GLN 27 -13.194 5.655 4.872
197 H ALA 28 H ALA 28 -6.366 3.925 5.431
198 HA ALA 28 HA ALA 28 -6.030 4.786 8.030
199 1HB ALA 28 1HB ALA 28 -3.473 4.571 7.126
200 2HB ALA 28 2HB ALA 28 -4.339 3.717 5.827
201 3HB ALA 28 3HB ALA 28 -4.502 3.172 7.513
202 H LEU 29 H LEU 29 -4.846 6.279 4.939
203 HA LEU 29 HA LEU 29 -3.683 8.489 6.233
204 1HB LEU 29 1HB LEU 29 -3.334 7.465 3.866
205 2HB LEU 29 2HB LEU 29 -4.657 8.516 3.397
206 HG LEU 29 HG LEU 29 -2.086 9.459 4.697
207 1HD1 LEU 29 1HD1 LEU 29 -2.863 9.060 1.842
208 2HD1 LEU 29 2HD1 LEU 29 -1.290 8.848 2.647
209 3HD1 LEU 29 3HD1 LEU 29 -1.882 10.483 2.263
210 1HD2 LEU 29 1HD2 LEU 29 -3.611 11.104 5.232
211 2HD2 LEU 29 2HD2 LEU 29 -4.562 10.863 3.746
212 3HD2 LEU 29 3HD2 LEU 29 -2.984 11.685 3.670
213 H GLU 30 H GLU 30 -6.973 7.647 5.292
214 HA GLU 30 HA GLU 30 -7.834 10.374 5.472
215 1HB GLU 30 1HB GLU 30 -8.788 8.087 4.177
216 2HB GLU 30 2HB GLU 30 -9.931 8.298 5.488
217 1HG GLU 30 1HG GLU 30 -10.742 9.569 3.578
218 2HG GLU 30 2HG GLU 30 -10.224 10.711 4.804
219 HE2 GLU 30 HE GLU 30 -8.905 11.234 1.336
220 H LYS 31 H LYS 31 -6.779 8.276 7.742
221 HA LYS 31 HA LYS 31 -8.759 9.218 9.694
222 1HB LYS 31 1HB LYS 31 -9.284 6.949 9.544
223 2HB LYS 31 2HB LYS 31 -7.618 6.463 9.302
224 1HG LYS 31 1HG LYS 31 -7.073 7.109 11.649
225 2HG LYS 31 2HG LYS 31 -8.726 7.638 11.897
226 1HD LYS 31 1HD LYS 31 -9.078 5.050 10.916
227 2HD LYS 31 2HD LYS 31 -7.612 4.889 11.862
228 1HE LYS 31 1HE LYS 31 -8.686 5.313 13.871
229 2HE LYS 31 2HE LYS 31 -9.809 6.454 13.160
230 1HZ LYS 31 1HZ LYS 31 -10.673 4.136 13.874
231 H TYR 32 H TYR 32 -5.379 8.210 8.969
232 HA TYR 32 HA TYR 32 -4.542 9.679 11.372
233 1HB TYR 32 1HB TYR 32 -3.565 7.362 9.655
234 2HB TYR 32 2HB TYR 32 -2.343 8.318 10.468
235 HD1 TYR 32 HD1 TYR 32 -2.262 8.398 12.959
236 HD2 TYR 32 HD2 TYR 32 -4.974 5.829 10.873
237 HE1 TYR 32 HE1 TYR 32 -2.621 7.042 15.079
238 HE2 TYR 32 HE2 TYR 32 -5.325 4.483 13.001
239 HH TYR 32 HH TYR 32 -3.374 4.419 15.432
240 H ASN 33 H ASN 33 -2.478 10.937 11.175
241 HA ASN 33 HA ASN 33 -2.366 12.123 8.514
242 1HB ASN 33 1HB ASN 33 -3.124 13.556 10.551
243 2HB ASN 33 2HB ASN 33 -1.474 13.435 11.126
244 1HD2 ASN 33 2HD2 ASN 33 -3.635 14.800 8.808
245 2HD2 ASN 33 1HD2 ASN 33 -2.542 15.905 8.043
246 H ILE 34 H ILE 34 -0.685 10.549 11.189
247 HA ILE 34 HA ILE 34 1.940 11.291 10.242
248 HB ILE 34 HB ILE 34 1.103 9.377 12.423
249 1HG1 ILE 34 1HG1 ILE 34 2.103 11.658 13.625
250 2HG1 ILE 34 2HG1 ILE 34 1.153 12.309 12.304
251 1HG2 ILE 34 1HG2 ILE 34 3.276 8.788 12.157
252 2HG2 ILE 34 2HG2 ILE 34 3.528 10.231 13.169
253 3HG2 ILE 34 3HG2 ILE 34 3.725 10.337 11.403
254 1HD1 ILE 34 1HD1 ILE 34 -0.850 11.244 13.053
255 2HD1 ILE 34 2HD1 ILE 34 -0.082 11.868 14.532
256 3HD1 ILE 34 3HD1 ILE 34 0.045 10.140 14.125
257 H GLU 35 H GLU 35 1.906 10.472 8.077
258 HA GLU 35 HA GLU 35 1.088 8.187 7.117
259 1HB GLU 35 1HB GLU 35 2.310 9.734 5.727
260 2HB GLU 35 2HB GLU 35 3.783 9.520 6.654
261 1HG GLU 35 1HG GLU 35 2.531 7.093 5.355
262 2HG GLU 35 2HG GLU 35 3.408 8.225 4.342
263 HE2 GLU 35 HE GLU 35 5.547 8.707 5.071
264 H LYS 36 H LYS 36 4.076 8.556 9.114
265 HA LYS 36 HA LYS 36 5.142 6.077 8.911
266 1HB LYS 36 1HB LYS 36 5.243 8.288 10.772
267 2HB LYS 36 2HB LYS 36 5.316 6.771 11.645
268 1HG LYS 36 1HG LYS 36 7.024 6.176 9.602
269 2HG LYS 36 2HG LYS 36 7.248 7.914 9.656
270 1HD LYS 36 1HD LYS 36 7.275 7.103 12.372
271 2HD LYS 36 2HD LYS 36 8.192 5.869 11.532
272 1HE LYS 36 1HE LYS 36 9.050 8.339 10.404
273 2HE LYS 36 2HE LYS 36 8.946 8.629 12.129
274 1HZ LYS 36 1HZ LYS 36 10.878 7.098 10.743
275 H ASP 37 H ASP 37 2.468 7.092 11.144
276 HA ASP 37 HA ASP 37 2.148 4.494 12.142
277 1HB ASP 37 1HB ASP 37 1.080 7.109 12.609
278 2HB ASP 37 2HB ASP 37 -0.296 6.075 12.279
279 HD2 ASP 37 HD ASP 37 1.599 6.182 15.640
280 H ILE 38 H ILE 38 0.967 6.327 9.342
281 HA ILE 38 HA ILE 38 -1.336 4.807 8.810
282 HB ILE 38 HB ILE 38 0.397 6.367 6.893
283 1HG1 ILE 38 1HG1 ILE 38 -1.763 7.273 8.804
284 2HG1 ILE 38 2HG1 ILE 38 -0.104 7.831 8.708
285 1HG2 ILE 38 1HG2 ILE 38 -2.535 6.237 6.546
286 2HG2 ILE 38 2HG2 ILE 38 -1.656 4.715 6.261
287 3HG2 ILE 38 3HG2 ILE 38 -1.223 6.177 5.344
288 1HD1 ILE 38 1HD1 ILE 38 -2.262 9.055 7.479
289 2HD1 ILE 38 2HD1 ILE 38 -1.577 8.093 6.148
290 3HD1 ILE 38 3HD1 ILE 38 -0.562 9.279 7.002
291 H ALA 39 H ALA 39 1.831 4.791 7.021
292 HA ALA 39 HA ALA 39 1.322 2.410 5.695
293 1HB ALA 39 1HB ALA 39 4.109 3.242 6.484
294 2HB ALA 39 2HB ALA 39 3.148 4.294 5.418
295 3HB ALA 39 3HB ALA 39 3.511 2.622 4.928
296 H ALA 40 H ALA 40 2.548 3.097 8.971
297 HA ALA 40 HA ALA 40 3.580 0.525 9.464
298 1HB ALA 40 1HB ALA 40 4.284 2.373 10.819
299 2HB ALA 40 2HB ALA 40 3.336 1.301 11.879
300 3HB ALA 40 3HB ALA 40 2.605 2.791 11.236
301 H TYR 41 H TYR 41 0.332 1.993 9.618
302 HA TYR 41 HA TYR 41 -0.811 -0.160 11.098
303 1HB TYR 41 1HB TYR 41 -1.783 2.109 11.094
304 2HB TYR 41 2HB TYR 41 -1.757 2.179 9.344
305 HD1 TYR 41 HD1 TYR 41 -3.493 1.100 8.011
306 HD2 TYR 41 HD2 TYR 41 -3.532 0.851 12.282
307 HE1 TYR 41 HE1 TYR 41 -5.900 0.278 7.949
308 HE2 TYR 41 HE2 TYR 41 -5.936 0.029 12.206
309 HH TYR 41 HH TYR 41 -7.493 -0.704 9.140
310 H ILE 42 H ILE 42 -0.401 0.681 7.633
311 HA ILE 42 HA ILE 42 -2.183 -1.298 6.692
312 HB ILE 42 HB ILE 42 0.120 0.064 5.292
313 1HG1 ILE 42 1HG1 ILE 42 -2.785 0.913 5.313
314 2HG1 ILE 42 2HG1 ILE 42 -1.588 1.586 6.400
315 1HG2 ILE 42 1HG2 ILE 42 -0.614 -1.876 4.064
316 2HG2 ILE 42 2HG2 ILE 42 -1.200 -0.409 3.245
317 3HG2 ILE 42 3HG2 ILE 42 -2.317 -1.386 4.226
318 1HD1 ILE 42 1HD1 ILE 42 -1.780 3.029 4.434
319 2HD1 ILE 42 2HD1 ILE 42 -1.490 1.647 3.350
320 3HD1 ILE 42 3HD1 ILE 42 -0.186 2.236 4.408
321 H LYS 43 H LYS 43 1.444 -1.149 6.886
322 HA LYS 43 HA LYS 43 1.868 -3.737 5.993
323 1HB LYS 43 1HB LYS 43 3.722 -2.323 5.994
324 2HB LYS 43 2HB LYS 43 3.449 -1.779 7.637
325 1HG LYS 43 1HG LYS 43 3.967 -4.717 7.224
326 2HG LYS 43 2HG LYS 43 5.324 -3.626 7.024
327 1HD LYS 43 1HD LYS 43 4.530 -2.603 9.327
328 2HD LYS 43 2HD LYS 43 3.641 -4.102 9.504
329 1HE LYS 43 1HE LYS 43 5.529 -5.210 10.103
330 2HE LYS 43 2HE LYS 43 6.326 -4.736 8.616
331 1HZ LYS 43 1HZ LYS 43 6.498 -2.455 9.960
332 H LYS 44 H LYS 44 1.511 -2.463 9.369
333 HA LYS 44 HA LYS 44 1.771 -4.982 10.573
334 1HB LYS 44 1HB LYS 44 2.160 -2.954 11.816
335 2HB LYS 44 2HB LYS 44 0.530 -2.383 11.517
336 1HG LYS 44 1HG LYS 44 -0.447 -4.005 12.957
337 2HG LYS 44 2HG LYS 44 0.954 -5.055 12.888
338 1HD LYS 44 1HD LYS 44 1.413 -4.120 14.939
339 2HD LYS 44 2HD LYS 44 2.138 -2.856 13.967
340 1HE LYS 44 1HE LYS 44 0.691 -1.734 15.527
341 2HE LYS 44 2HE LYS 44 -0.132 -1.668 13.981
342 1HZ LYS 44 1HZ LYS 44 -1.221 -3.865 14.828
343 H GLU 45 H GLU 45 -0.971 -3.207 9.133
344 HA GLU 45 HA GLU 45 -3.027 -4.616 10.232
345 1HB GLU 45 1HB GLU 45 -2.581 -2.982 7.810
346 2HB GLU 45 2HB GLU 45 -3.854 -4.168 7.604
347 1HG GLU 45 1HG GLU 45 -3.794 -2.490 10.125
348 2HG GLU 45 2HG GLU 45 -4.399 -1.782 8.642
349 HE2 GLU 45 HE GLU 45 -5.854 -2.381 10.920
350 H PHE 46 H PHE 46 -1.348 -5.303 7.072
351 HA PHE 46 HA PHE 46 -2.666 -7.800 6.795
352 1HB PHE 46 1HB PHE 46 -0.460 -6.172 5.498
353 2HB PHE 46 2HB PHE 46 -0.502 -7.880 5.107
354 HD1 PHE 46 HD1 PHE 46 -3.388 -5.612 5.688
355 HD2 PHE 46 HD2 PHE 46 -1.175 -7.884 2.871
356 HE1 PHE 46 HE1 PHE 46 -5.146 -5.171 3.952
357 HE2 PHE 46 HE2 PHE 46 -2.933 -7.444 1.134
358 HZ PHE 46 HZ PHE 46 -4.897 -6.093 1.695
359 H ASP 47 H ASP 47 0.621 -6.731 7.852
360 HA ASP 47 HA ASP 47 1.889 -9.087 7.943
361 1HB ASP 47 1HB ASP 47 2.866 -6.887 8.592
362 2HB ASP 47 2HB ASP 47 1.922 -6.890 10.068
363 HD2 ASP 47 HD ASP 47 4.823 -6.972 9.474
364 H LYS 48 H LYS 48 -0.715 -7.846 10.045
365 HA LYS 48 HA LYS 48 -0.447 -9.416 12.270
366 1HB LYS 48 1HB LYS 48 -2.900 -8.369 10.842
367 2HB LYS 48 2HB LYS 48 -2.986 -9.202 12.381
368 1HG LYS 48 1HG LYS 48 -0.888 -7.184 12.488
369 2HG LYS 48 2HG LYS 48 -2.375 -6.449 11.922
370 1HD LYS 48 1HD LYS 48 -2.931 -8.278 14.138
371 2HD LYS 48 2HD LYS 48 -1.701 -7.118 14.602
372 1HE LYS 48 1HE LYS 48 -3.146 -5.235 13.990
373 2HE LYS 48 2HE LYS 48 -4.331 -6.311 13.277
374 1HZ LYS 48 1HZ LYS 48 -4.443 -7.335 15.619
375 H LYS 49 H LYS 49 -2.821 -10.215 9.646
376 HA LYS 49 HA LYS 49 -1.851 -12.958 9.721
377 1HB LYS 49 1HB LYS 49 -4.583 -12.050 10.579
378 2HB LYS 49 2HB LYS 49 -4.402 -13.597 9.777
379 1HG LYS 49 1HG LYS 49 -2.522 -14.103 11.487
380 2HG LYS 49 2HG LYS 49 -3.066 -12.685 12.361
381 1HD LYS 49 1HD LYS 49 -4.588 -14.023 13.383
382 2HD LYS 49 2HD LYS 49 -5.452 -14.074 11.859
383 1HE LYS 49 1HE LYS 49 -4.824 -16.235 11.435
384 2HE LYS 49 2HE LYS 49 -3.165 -15.947 11.919
385 1HZ LYS 49 1HZ LYS 49 -4.901 -15.861 14.178
386 H TYR 50 H TYR 50 -0.967 -11.957 7.660
387 HA TYR 50 HA TYR 50 -2.788 -12.623 5.529
388 1HB TYR 50 1HB TYR 50 -2.803 -10.024 6.413
389 2HB TYR 50 2HB TYR 50 -1.363 -9.936 5.417
390 HD1 TYR 50 HD1 TYR 50 -4.313 -8.672 5.203
391 HD2 TYR 50 HD2 TYR 50 -2.204 -11.797 3.183
392 HE1 TYR 50 HE1 TYR 50 -5.755 -8.321 3.140
393 HE2 TYR 50 HE2 TYR 50 -3.654 -11.436 1.126
394 HH TYR 50 HH TYR 50 -6.496 -9.641 1.218
395 H ASN 51 H ASN 51 -0.477 -13.951 6.424
396 HA ASN 51 HA ASN 51 1.344 -14.836 5.646
397 1HB ASN 51 1HB ASN 51 0.044 -13.858 3.273
398 2HB ASN 51 2HB ASN 51 1.746 -13.480 3.094
399 1HD2 ASN 51 2HD2 ASN 51 0.440 -15.284 1.470
400 2HD2 ASN 51 1HD2 ASN 51 1.046 -16.885 1.733
401 HA PRO 52 HA PRO 52 3.518 -10.885 6.531
402 1HB PRO 52 1HB PRO 52 4.393 -11.467 9.054
403 2HB PRO 52 2HB PRO 52 2.917 -10.579 8.733
404 1HG PRO 52 1HG PRO 52 3.238 -13.385 9.605
405 2HG PRO 52 2HG PRO 52 1.816 -12.364 9.688
406 1HD PRO 52 1HD PRO 52 2.319 -14.459 7.794
407 2HD PRO 52 2HD PRO 52 0.950 -13.364 7.807
408 H THR 53 H THR 53 6.939 -11.539 6.487
409 HA THR 53 HA THR 53 4.704 -9.908 7.475
410 HB THR 53 HB THR 53 6.568 -9.894 9.001
411 HG1 THR 53 HG1 THR 53 6.585 -7.679 8.889
412 1HG2 THR 53 1HG2 THR 53 8.242 -9.585 6.467
413 2HG2 THR 53 2HG2 THR 53 8.426 -10.794 7.762
414 3HG2 THR 53 3HG2 THR 53 8.865 -9.094 8.062
415 H TRP 54 H TRP 54 4.640 -7.607 6.721
416 HA TRP 54 HA TRP 54 5.273 -7.562 3.849
417 1HB TRP 54 1HB TRP 54 3.046 -6.137 5.317
418 2HB TRP 54 2HB TRP 54 3.377 -6.045 3.599
419 HD1 TRP 54 HD TRP 54 2.646 -8.976 6.105
420 HE1 TRP 54 HE1 TRP 54 1.033 -10.746 4.997
421 HE3 TRP 54 HE3 TRP 54 2.291 -6.619 1.612
422 HZ2 TRP 54 HZ2 TRP 54 -0.181 -10.958 2.424
423 HZ3 TRP 54 HZ3 TRP 54 0.871 -7.676 -0.143
424 HH2 TRP 54 HH TRP 54 -0.341 -9.770 0.205
425 H HIS 55 H HIS 55 5.814 -5.336 3.009
426 HA HIS 55 HA HIS 55 6.799 -3.548 5.079
427 1HB HIS 55 1HB HIS 55 8.538 -4.478 2.779
428 2HB HIS 55 2HB HIS 55 8.979 -3.337 4.033
429 HD1 HIS 55 HD1 HIS 55 9.730 -4.277 6.314
430 HD2 HIS 55 HD2 HIS 55 8.424 -7.221 3.625
431 HE1 HIS 55 HE1 HIS 55 10.392 -6.520 7.333
432 H CYS 56 H CYS 56 6.140 -1.501 4.647
433 HA CYS 56 HA CYS 56 5.519 -0.914 1.844
434 1HB CYS 56 1HB CYS 56 3.792 0.680 2.737
435 2HB CYS 56 2HB CYS 56 3.434 -1.016 2.999
436 HG CYS 56 HG CYS 56 2.874 -0.553 5.271
437 H ILE 57 H ILE 57 6.213 1.162 1.075
438 HA ILE 57 HA ILE 57 7.869 2.663 2.978
439 HB ILE 57 HB ILE 57 8.493 1.755 0.186
440 1HG1 ILE 57 1HG1 ILE 57 10.664 1.156 1.286
441 2HG1 ILE 57 2HG1 ILE 57 9.976 1.632 2.826
442 1HG2 ILE 57 1HG2 ILE 57 9.884 4.007 1.659
443 2HG2 ILE 57 2HG2 ILE 57 8.814 4.197 0.250
444 3HG2 ILE 57 3HG2 ILE 57 10.350 3.311 0.090
445 1HD1 ILE 57 1HD1 ILE 57 8.229 -0.201 1.287
446 2HD1 ILE 57 2HD1 ILE 57 8.726 -0.270 2.994
447 3HD1 ILE 57 3HD1 ILE 57 9.803 -0.904 1.728
448 H VAL 58 H VAL 58 7.990 4.978 2.581
449 HA VAL 58 HA VAL 58 5.940 5.957 0.737
450 HB VAL 58 HB VAL 58 6.262 6.782 3.629
451 1HG1 VAL 58 1HG1 VAL 58 5.215 8.677 3.102
452 2HG1 VAL 58 2HG1 VAL 58 3.850 7.748 2.439
453 3HG1 VAL 58 3HG1 VAL 58 5.211 8.204 1.386
454 1HG2 VAL 58 1HG2 VAL 58 4.804 5.178 4.143
455 2HG2 VAL 58 2HG2 VAL 58 4.763 4.654 2.442
456 3HG2 VAL 58 3HG2 VAL 58 3.622 5.892 3.020
457 H GLY 59 H GLY 59 7.395 6.787 -0.751
458 1HA GLY 59 2HA GLY 59 9.114 8.957 0.271
459 2HA GLY 59 1HA GLY 59 9.762 7.732 -0.802
460 H ARG 60 H ARG 60 9.001 7.584 -3.023
461 HA ARG 60 HA ARG 60 7.136 9.559 -3.881
462 1HB ARG 60 1HB ARG 60 9.344 10.799 -3.810
463 2HB ARG 60 2HB ARG 60 10.008 9.633 -4.937
464 1HG ARG 60 1HG ARG 60 8.048 10.257 -6.514
465 2HG ARG 60 2HG ARG 60 7.737 11.603 -5.436
466 1HD ARG 60 1HD ARG 60 10.561 11.209 -6.435
467 2HD ARG 60 2HD ARG 60 9.374 11.860 -7.549
468 HE ARG 60 HE ARG 60 9.198 13.252 -5.031
469 1HH1 ARG 60 2HH2 ARG 60 11.268 12.993 -7.896
470 2HH1 ARG 60 1HH2 ARG 60 11.895 14.600 -7.740
471 1HH2 ARG 60 1HH ARG 60 11.152 15.979 -5.926
472 H ASN 61 H ASN 61 9.638 7.086 -4.695
473 HA ASN 61 HA ASN 61 7.743 6.004 -6.605
474 1HB ASN 61 1HB ASN 61 9.831 7.415 -7.575
475 2HB ASN 61 2HB ASN 61 10.696 5.922 -7.273
476 1HD2 ASN 61 2HD2 ASN 61 9.338 7.574 -9.618
477 2HD2 ASN 61 1HD2 ASN 61 8.694 6.337 -10.646
478 H PHE 62 H PHE 62 9.295 3.798 -7.473
479 HA PHE 62 HA PHE 62 10.144 2.537 -4.963
480 1HB PHE 62 1HB PHE 62 8.951 0.504 -5.764
481 2HB PHE 62 2HB PHE 62 7.825 1.847 -5.738
482 HD1 PHE 62 HD1 PHE 62 9.638 -0.503 -7.841
483 HD2 PHE 62 HD2 PHE 62 7.071 2.876 -7.839
484 HE1 PHE 62 HE1 PHE 62 9.100 -0.910 -10.259
485 HE2 PHE 62 HE2 PHE 62 6.534 2.469 -10.257
486 HZ PHE 62 HZ PHE 62 7.553 0.580 -11.438
487 H GLY 63 H GLY 63 10.724 -0.009 -6.249
488 1HA GLY 63 2HA GLY 63 12.466 0.417 -8.476
489 2HA GLY 63 1HA GLY 63 13.353 0.307 -6.968
490 H SER 64 H SER 64 12.147 -1.573 -5.439
491 HA SER 64 HA SER 64 12.907 -3.928 -6.677
492 1HB SER 64 1HB SER 64 12.088 -5.032 -4.660
493 2HB SER 64 2HB SER 64 12.883 -3.536 -4.211
494 HG SER 64 HG SER 64 10.744 -2.524 -4.105
495 H TYR 65 H TYR 65 11.662 -3.845 -8.731
496 HA TYR 65 HA TYR 65 8.999 -5.002 -8.350
497 1HB TYR 65 1HB TYR 65 8.831 -2.538 -8.872
498 2HB TYR 65 2HB TYR 65 9.931 -2.737 -10.221
499 HD1 TYR 65 HD1 TYR 65 6.870 -4.630 -9.136
500 HD2 TYR 65 HD2 TYR 65 8.809 -2.380 -12.217
501 HE1 TYR 65 HE1 TYR 65 4.900 -5.046 -10.689
502 HE2 TYR 65 HE2 TYR 65 6.833 -2.805 -13.760
503 HH TYR 65 HH TYR 65 4.216 -3.324 -13.231
504 H VAL 66 H VAL 66 11.618 -4.166 -10.724
505 HA VAL 66 HA VAL 66 11.161 -6.817 -11.905
506 HB VAL 66 HB VAL 66 10.309 -5.001 -13.325
507 1HG1 VAL 66 1HG1 VAL 66 12.915 -3.814 -12.675
508 2HG1 VAL 66 2HG1 VAL 66 11.411 -3.046 -13.236
509 3HG1 VAL 66 3HG1 VAL 66 12.532 -3.772 -14.413
510 1HG2 VAL 66 1HG2 VAL 66 11.915 -5.544 -15.339
511 2HG2 VAL 66 2HG2 VAL 66 10.906 -6.821 -14.618
512 3HG2 VAL 66 3HG2 VAL 66 12.630 -6.700 -14.190
513 H THR 67 H THR 67 12.820 -6.775 -9.794
514 HA THR 67 HA THR 67 15.401 -7.166 -11.058
515 HB THR 67 HB THR 67 16.398 -5.778 -9.054
516 HG1 THR 67 HG1 THR 67 13.702 -4.684 -9.430
517 1HG2 THR 67 1HG2 THR 67 14.812 -4.063 -11.001
518 2HG2 THR 67 2HG2 THR 67 16.184 -5.034 -11.583
519 3HG2 THR 67 3HG2 THR 67 16.444 -3.780 -10.348
520 H HIS 68 H HIS 68 13.687 -7.057 -7.860
521 HA HIS 68 HA HIS 68 14.947 -9.647 -7.330
522 1HB HIS 68 1HB HIS 68 14.148 -7.366 -5.535
523 2HB HIS 68 2HB HIS 68 14.287 -8.991 -4.895
524 HD1 HIS 68 HD1 HIS 68 16.728 -10.142 -5.121
525 HD2 HIS 68 HD2 HIS 68 16.543 -6.017 -5.863
526 HE1 HIS 68 HE1 HIS 68 19.127 -9.283 -4.986
527 H GLU 69 H GLU 69 11.936 -7.797 -7.614
528 HA GLU 69 HA GLU 69 9.843 -8.370 -7.601
529 1HB GLU 69 1HB GLU 69 11.220 -10.760 -8.667
530 2HB GLU 69 2HB GLU 69 9.633 -11.115 -8.018
531 1HG GLU 69 1HG GLU 69 9.582 -8.645 -9.600
532 2HG GLU 69 2HG GLU 69 10.221 -9.977 -10.544
533 HE2 GLU 69 HE GLU 69 6.453 -9.770 -10.368
534 H THR 70 H THR 70 8.066 -9.603 -6.411
535 HA THR 70 HA THR 70 9.038 -10.912 -3.981
536 HB THR 70 HB THR 70 7.797 -9.397 -2.561
537 HG1 THR 70 HG1 THR 70 6.931 -8.182 -5.083
538 1HG2 THR 70 1HG2 THR 70 8.562 -7.093 -3.244
539 2HG2 THR 70 2HG2 THR 70 9.062 -7.754 -4.820
540 3HG2 THR 70 3HG2 THR 70 9.881 -8.287 -3.331
541 H ARG 71 H ARG 71 6.167 -10.620 -2.960
542 HA ARG 71 HA ARG 71 5.139 -12.729 -4.678
543 1HB ARG 71 1HB ARG 71 5.005 -12.245 -1.691
544 2HB ARG 71 2HB ARG 71 3.703 -13.141 -2.449
545 1HG ARG 71 1HG ARG 71 6.575 -13.910 -3.037
546 2HG ARG 71 2HG ARG 71 5.839 -14.421 -1.531
547 1HD ARG 71 1HD ARG 71 4.033 -14.898 -3.800
548 2HD ARG 71 2HD ARG 71 5.580 -15.681 -4.052
549 HE ARG 71 HE ARG 71 4.934 -16.288 -1.407
550 1HH1 ARG 71 2HH2 ARG 71 3.344 -16.766 -4.536
551 2HH1 ARG 71 1HH2 ARG 71 2.511 -18.199 -4.035
552 1HH2 ARG 71 1HH ARG 71 2.813 -19.011 -1.801
553 H HIS 72 H HIS 72 3.920 -10.274 -2.268
554 HA HIS 72 HA HIS 72 1.916 -9.519 -4.257
555 1HB HIS 72 1HB HIS 72 1.503 -10.425 -1.434
556 2HB HIS 72 2HB HIS 72 0.466 -9.158 -2.058
557 HD1 HIS 72 HD1 HIS 72 -0.805 -11.836 -1.346
558 HD2 HIS 72 HD2 HIS 72 0.678 -10.943 -5.167
559 HE1 HIS 72 HE1 HIS 72 -2.006 -13.403 -2.963
560 H PHE 73 H PHE 73 1.829 -7.346 -4.618
561 HA PHE 73 HA PHE 73 2.599 -5.546 -2.497
562 1HB PHE 73 1HB PHE 73 4.195 -4.441 -4.283
563 2HB PHE 73 2HB PHE 73 4.781 -5.876 -3.464
564 HD1 PHE 73 HD1 PHE 73 3.896 -4.418 -6.629
565 HD2 PHE 73 HD2 PHE 73 4.633 -8.098 -4.647
566 HE1 PHE 73 HE1 PHE 73 4.247 -5.543 -8.846
567 HE2 PHE 73 HE2 PHE 73 4.985 -9.222 -6.863
568 HZ PHE 73 HZ PHE 73 4.788 -7.930 -8.937
569 H ILE 74 H ILE 74 2.312 -3.188 -3.257
570 HA ILE 74 HA ILE 74 0.752 -2.788 -5.609
571 HB ILE 74 HB ILE 74 -1.154 -3.486 -4.637
572 1HG1 ILE 74 1HG1 ILE 74 -1.043 -0.757 -3.329
573 2HG1 ILE 74 2HG1 ILE 74 -1.270 -0.989 -5.051
574 1HG2 ILE 74 1HG2 ILE 74 -1.646 -3.481 -2.237
575 2HG2 ILE 74 2HG2 ILE 74 -0.099 -2.657 -1.919
576 3HG2 ILE 74 3HG2 ILE 74 -0.109 -4.306 -2.592
577 1HD1 ILE 74 1HD1 ILE 74 -3.102 -2.762 -3.750
578 2HD1 ILE 74 2HD1 ILE 74 -3.481 -1.302 -4.693
579 3HD1 ILE 74 3HD1 ILE 74 -3.229 -1.185 -2.935
580 H TYR 75 H TYR 75 1.530 -0.898 -6.356
581 HA TYR 75 HA TYR 75 2.394 1.066 -4.343
582 1HB TYR 75 1HB TYR 75 4.239 0.262 -5.739
583 2HB TYR 75 2HB TYR 75 3.234 0.244 -7.175
584 HD1 TYR 75 HD1 TYR 75 3.658 3.000 -4.680
585 HD2 TYR 75 HD2 TYR 75 4.373 1.646 -8.674
586 HE1 TYR 75 HE1 TYR 75 4.518 5.306 -5.314
587 HE2 TYR 75 HE2 TYR 75 5.232 3.958 -9.295
588 HH TYR 75 HH TYR 75 5.520 6.001 -8.650
589 H PHE 76 H PHE 76 1.009 2.746 -4.122
590 HA PHE 76 HA PHE 76 -0.049 3.930 -6.553
591 1HB PHE 76 1HB PHE 76 -2.333 3.997 -5.355
592 2HB PHE 76 2HB PHE 76 -1.834 2.395 -5.856
593 HD1 PHE 76 HD1 PHE 76 -3.138 4.245 -3.211
594 HD2 PHE 76 HD2 PHE 76 -0.420 1.086 -4.005
595 HE1 PHE 76 HE1 PHE 76 -3.404 3.424 -0.854
596 HE2 PHE 76 HE2 PHE 76 -0.685 0.264 -1.648
597 HZ PHE 76 HZ PHE 76 -2.173 1.443 -0.100
598 H TYR 77 H TYR 77 -1.516 5.969 -5.716
599 HA TYR 77 HA TYR 77 0.248 7.352 -3.818
600 1HB TYR 77 1HB TYR 77 -0.373 7.966 -6.387
601 2HB TYR 77 2HB TYR 77 -1.851 8.576 -5.671
602 HD1 TYR 77 HD1 TYR 77 -1.870 10.871 -5.395
603 HD2 TYR 77 HD2 TYR 77 1.813 8.769 -4.833
604 HE1 TYR 77 HE1 TYR 77 -0.696 13.059 -4.852
605 HE2 TYR 77 HE2 TYR 77 2.975 10.964 -4.290
606 HH TYR 77 HH TYR 77 1.659 13.500 -3.302
607 H LEU 78 H LEU 78 -0.530 7.741 -1.811
608 HA LEU 78 HA LEU 78 -3.416 7.524 -1.436
609 1HB LEU 78 1HB LEU 78 -1.347 6.395 -0.090
610 2HB LEU 78 2HB LEU 78 -1.618 7.826 0.885
611 HG LEU 78 HG LEU 78 -3.881 7.193 1.354
612 1HD1 LEU 78 1HD1 LEU 78 -3.554 5.502 -1.016
613 2HD1 LEU 78 2HD1 LEU 78 -5.022 6.207 -0.294
614 3HD1 LEU 78 3HD1 LEU 78 -4.361 4.680 0.341
615 1HD2 LEU 78 1HD2 LEU 78 -2.771 4.502 1.730
616 2HD2 LEU 78 2HD2 LEU 78 -3.330 5.698 2.924
617 3HD2 LEU 78 3HD2 LEU 78 -1.685 5.812 2.252
618 H GLY 79 H GLY 79 -4.544 9.382 -1.625
619 1HA GLY 79 2HA GLY 79 -5.131 11.537 -1.392
620 2HA GLY 79 1HA GLY 79 -4.090 11.592 0.018
621 H GLN 80 H GLN 80 -1.743 12.049 -0.290
622 HA GLN 80 HA GLN 80 -1.063 13.106 -2.879
623 1HB GLN 80 1HB GLN 80 -2.132 14.891 -1.131
624 2HB GLN 80 2HB GLN 80 -0.465 14.956 -0.597
625 1HG GLN 80 1HG GLN 80 -0.147 15.051 -3.346
626 2HG GLN 80 2HG GLN 80 -1.672 15.892 -3.153
627 1HE2 GLN 80 2HE2 GLN 80 1.178 16.688 -3.806
628 2HE2 GLN 80 1HE2 GLN 80 1.531 18.028 -2.769
629 H VAL 81 H VAL 81 -0.220 10.776 -1.367
630 HA VAL 81 HA VAL 81 2.604 11.432 -1.183
631 HB VAL 81 HB VAL 81 1.486 11.628 1.099
632 1HG1 VAL 81 1HG1 VAL 81 -0.038 9.811 1.119
633 2HG1 VAL 81 2HG1 VAL 81 1.251 9.373 2.266
634 3HG1 VAL 81 3HG1 VAL 81 1.222 8.646 0.641
635 1HG2 VAL 81 1HG2 VAL 81 3.992 11.007 0.412
636 2HG2 VAL 81 2HG2 VAL 81 3.573 9.495 1.255
637 3HG2 VAL 81 3HG2 VAL 81 3.457 11.052 2.109
638 H ALA 82 H ALA 82 3.975 9.513 -1.418
639 HA ALA 82 HA ALA 82 2.631 7.535 -3.053
640 1HB ALA 82 1HB ALA 82 4.579 8.212 -4.102
641 2HB ALA 82 2HB ALA 82 5.191 6.812 -3.190
642 3HB ALA 82 3HB ALA 82 5.447 8.460 -2.568
643 H ILE 83 H ILE 83 2.491 5.324 -2.570
644 HA ILE 83 HA ILE 83 3.682 4.404 -0.096
645 HB ILE 83 HB ILE 83 1.239 5.460 0.141
646 1HG1 ILE 83 1HG1 ILE 83 2.039 2.919 1.582
647 2HG1 ILE 83 2HG1 ILE 83 2.788 4.476 1.884
648 1HG2 ILE 83 1HG2 ILE 83 0.619 2.543 -0.361
649 2HG2 ILE 83 2HG2 ILE 83 0.350 3.824 -1.568
650 3HG2 ILE 83 3HG2 ILE 83 -0.513 3.871 -0.012
651 1HD1 ILE 83 1HD1 ILE 83 0.000 3.549 2.519
652 2HD1 ILE 83 2HD1 ILE 83 0.225 5.267 2.111
653 3HD1 ILE 83 3HD1 ILE 83 1.109 4.555 3.482
654 H LEU 84 H LEU 84 4.646 2.510 -0.572
655 HA LEU 84 HA LEU 84 3.300 0.804 -2.543
656 1HB LEU 84 1HB LEU 84 5.439 0.223 -3.507
657 2HB LEU 84 2HB LEU 84 5.110 1.936 -3.666
658 HG LEU 84 HG LEU 84 6.640 1.389 -1.254
659 1HD1 LEU 84 1HD1 LEU 84 7.621 0.220 -3.841
660 2HD1 LEU 84 2HD1 LEU 84 7.684 -0.449 -2.194
661 3HD1 LEU 84 3HD1 LEU 84 8.769 0.884 -2.656
662 1HD2 LEU 84 1HD2 LEU 84 6.936 3.130 -3.696
663 2HD2 LEU 84 2HD2 LEU 84 8.207 3.031 -2.454
664 3HD2 LEU 84 3HD2 LEU 84 6.577 3.598 -2.017
665 H LEU 85 H LEU 85 2.650 -1.013 -1.536
666 HA LEU 85 HA LEU 85 4.308 -1.943 0.702
667 1HB LEU 85 1HB LEU 85 2.130 -1.307 1.433
668 2HB LEU 85 2HB LEU 85 1.358 -2.204 0.140
669 HG LEU 85 HG LEU 85 2.943 -4.057 1.611
670 1HD1 LEU 85 1HD1 LEU 85 1.650 -1.982 3.294
671 2HD1 LEU 85 2HD1 LEU 85 3.057 -3.022 3.619
672 3HD1 LEU 85 3HD1 LEU 85 1.409 -3.676 3.785
673 1HD2 LEU 85 1HD2 LEU 85 -0.064 -3.715 1.638
674 2HD2 LEU 85 2HD2 LEU 85 0.868 -5.205 1.919
675 3HD2 LEU 85 3HD2 LEU 85 0.849 -4.457 0.303
676 H PHE 86 H PHE 86 4.987 -4.108 0.771
677 HA PHE 86 HA PHE 86 4.132 -5.881 -1.328
678 1HB PHE 86 1HB PHE 86 6.475 -6.153 -2.169
679 2HB PHE 86 2HB PHE 86 5.970 -4.486 -2.350
680 HD1 PHE 86 HD1 PHE 86 7.038 -2.728 -1.122
681 HD2 PHE 86 HD2 PHE 86 8.067 -6.777 -0.380
682 HE1 PHE 86 HE1 PHE 86 9.049 -1.978 0.181
683 HE2 PHE 86 HE2 PHE 86 10.077 -6.028 0.925
684 HZ PHE 86 HZ PHE 86 10.544 -3.636 1.187
685 H LYS 87 H LYS 87 5.063 -8.103 -1.032
686 HA LYS 87 HA LYS 87 5.825 -8.488 1.780
687 1HB LYS 87 1HB LYS 87 3.520 -9.351 0.618
688 2HB LYS 87 2HB LYS 87 4.557 -10.730 0.316
689 1HG LYS 87 1HG LYS 87 4.568 -9.495 3.075
690 2HG LYS 87 2HG LYS 87 3.205 -10.495 2.614
691 1HD LYS 87 1HD LYS 87 4.743 -12.010 3.629
692 2HD LYS 87 2HD LYS 87 4.917 -12.291 1.909
693 1HE LYS 87 1HE LYS 87 6.721 -10.154 2.659
694 2HE LYS 87 2HE LYS 87 6.941 -11.478 3.787
695 1HZ LYS 87 1HZ LYS 87 6.748 -12.261 0.994
696 H SER 88 H SER 88 8.032 -8.639 1.720
697 HA SER 88 HA SER 88 9.055 -10.626 -0.153
698 1HB SER 88 1HB SER 88 10.981 -9.323 -0.586
699 2HB SER 88 2HB SER 88 9.673 -8.156 -0.613
700 HG SER 88 HG SER 88 11.599 -7.510 0.660
701 H GLY 89 H GLY 89 9.660 -12.417 1.007
702 1HA GLY 89 2HA GLY 89 10.428 -13.703 2.684
703 2HA GLY 89 1HA GLY 89 11.626 -12.448 2.936
Start of MODEL 7
1 1H MET 1 H MET 1 -16.027 18.893 -9.039
2 HA MET 1 HA MET 1 -13.792 17.362 -10.103
3 1HB MET 1 1HB MET 1 -15.014 19.998 -10.657
4 2HB MET 1 2HB MET 1 -13.287 20.145 -10.394
5 1HG MET 1 1HG MET 1 -12.769 18.632 -12.192
6 2HG MET 1 2HG MET 1 -14.407 18.016 -12.261
7 1HE MET 1 1HE MET 1 -12.075 21.085 -13.696
8 2HE MET 1 2HE MET 1 -12.139 19.349 -14.085
9 3HE MET 1 3HE MET 1 -12.855 20.540 -15.199
10 H SER 2 H SER 2 -11.563 18.648 -9.609
11 HA SER 2 HA SER 2 -10.064 19.213 -8.145
12 1HB SER 2 1HB SER 2 -12.466 20.607 -7.113
13 2HB SER 2 2HB SER 2 -11.251 20.314 -5.884
14 HG SER 2 HG SER 2 -10.946 22.357 -7.015
15 H ASP 3 H ASP 3 -10.173 16.680 -8.028
16 HA ASP 3 HA ASP 3 -10.236 16.047 -5.222
17 1HB ASP 3 1HB ASP 3 -12.152 15.009 -7.235
18 2HB ASP 3 2HB ASP 3 -11.335 13.739 -6.346
19 HD2 ASP 3 HD ASP 3 -14.358 14.770 -5.816
20 H ARG 4 H ARG 4 -9.424 13.528 -5.083
21 HA ARG 4 HA ARG 4 -7.532 13.111 -7.246
22 1HB ARG 4 1HB ARG 4 -6.995 13.410 -4.304
23 2HB ARG 4 2HB ARG 4 -6.097 12.150 -5.126
24 1HG ARG 4 1HG ARG 4 -4.673 13.984 -5.431
25 2HG ARG 4 2HG ARG 4 -5.594 14.023 -6.923
26 1HD ARG 4 1HD ARG 4 -7.075 15.769 -6.046
27 2HD ARG 4 2HD ARG 4 -6.376 15.629 -4.445
28 HE ARG 4 HE ARG 4 -4.553 16.928 -5.141
29 1HH1 ARG 4 2HH2 ARG 4 -6.315 15.790 -7.999
30 2HH1 ARG 4 1HH2 ARG 4 -5.408 16.771 -9.101
31 1HH2 ARG 4 1HH ARG 4 -3.674 18.192 -8.256
32 H LYS 5 H LYS 5 -9.014 11.730 -4.225
33 HA LYS 5 HA LYS 5 -9.998 9.776 -3.861
34 1HB LYS 5 1HB LYS 5 -10.249 10.038 -6.675
35 2HB LYS 5 2HB LYS 5 -9.733 8.390 -6.375
36 1HG LYS 5 1HG LYS 5 -11.836 9.405 -4.514
37 2HG LYS 5 2HG LYS 5 -12.341 9.257 -6.185
38 1HD LYS 5 1HD LYS 5 -12.519 7.008 -5.968
39 2HD LYS 5 2HD LYS 5 -10.828 6.894 -5.523
40 1HE LYS 5 1HE LYS 5 -11.723 6.091 -3.550
41 2HE LYS 5 2HE LYS 5 -11.780 7.798 -3.157
42 1HZ LYS 5 1HZ LYS 5 -14.111 7.344 -4.533
43 H ALA 6 H ALA 6 -9.430 7.254 -4.007
44 HA ALA 6 HA ALA 6 -6.975 6.936 -2.826
45 1HB ALA 6 1HB ALA 6 -9.175 5.392 -3.253
46 2HB ALA 6 2HB ALA 6 -7.622 4.753 -2.659
47 3HB ALA 6 3HB ALA 6 -8.033 4.633 -4.387
48 H VAL 7 H VAL 7 -7.869 5.953 -6.217
49 HA VAL 7 HA VAL 7 -6.666 5.821 -8.066
50 HB VAL 7 HB VAL 7 -4.733 7.698 -6.692
51 1HG1 VAL 7 1HG1 VAL 7 -3.612 7.036 -8.601
52 2HG1 VAL 7 2HG1 VAL 7 -4.529 8.433 -9.212
53 3HG1 VAL 7 3HG1 VAL 7 -5.109 6.781 -9.527
54 1HG2 VAL 7 1HG2 VAL 7 -6.146 9.419 -6.983
55 2HG2 VAL 7 2HG2 VAL 7 -7.413 8.179 -7.128
56 3HG2 VAL 7 3HG2 VAL 7 -6.656 8.852 -8.591
57 H ILE 8 H ILE 8 -4.680 4.823 -9.009
58 HA ILE 8 HA ILE 8 -2.877 3.617 -7.106
59 HB ILE 8 HB ILE 8 -5.020 2.100 -8.518
60 1HG1 ILE 8 1HG1 ILE 8 -4.190 0.812 -6.175
61 2HG1 ILE 8 2HG1 ILE 8 -4.073 2.519 -5.797
62 1HG2 ILE 8 1HG2 ILE 8 -2.257 1.001 -7.938
63 2HG2 ILE 8 2HG2 ILE 8 -3.032 1.176 -9.532
64 3HG2 ILE 8 3HG2 ILE 8 -3.689 0.023 -8.344
65 1HD1 ILE 8 1HD1 ILE 8 -6.405 2.876 -6.577
66 2HD1 ILE 8 2HD1 ILE 8 -6.339 1.645 -5.293
67 3HD1 ILE 8 3HD1 ILE 8 -6.527 1.150 -6.993
68 H LYS 9 H LYS 9 -0.873 3.183 -8.026
69 HA LYS 9 HA LYS 9 -0.584 4.172 -10.739
70 1HB LYS 9 1HB LYS 9 1.173 3.858 -8.359
71 2HB LYS 9 2HB LYS 9 1.940 3.676 -9.924
72 1HG LYS 9 1HG LYS 9 1.914 5.920 -10.228
73 2HG LYS 9 2HG LYS 9 0.166 5.939 -10.097
74 1HD LYS 9 1HD LYS 9 0.241 6.813 -7.998
75 2HD LYS 9 2HD LYS 9 1.384 5.600 -7.455
76 1HE LYS 9 1HE LYS 9 2.759 7.451 -7.267
77 2HE LYS 9 2HE LYS 9 3.092 7.069 -8.943
78 1HZ LYS 9 1HZ LYS 9 2.468 9.432 -8.574
79 H ASN 10 H ASN 10 0.760 1.367 -8.851
80 HA ASN 10 HA ASN 10 0.040 -0.315 -11.077
81 1HB ASN 10 1HB ASN 10 2.543 0.645 -11.182
82 2HB ASN 10 2HB ASN 10 2.850 -0.574 -9.961
83 1HD2 ASN 10 2HD2 ASN 10 4.236 -0.945 -12.093
84 2HD2 ASN 10 1HD2 ASN 10 3.635 -2.192 -13.132
85 H ALA 11 H ALA 11 -1.133 -1.904 -9.985
86 HA ALA 11 HA ALA 11 0.118 -3.105 -7.636
87 1HB ALA 11 1HB ALA 11 -2.823 -2.350 -7.696
88 2HB ALA 11 2HB ALA 11 -1.577 -1.297 -6.985
89 3HB ALA 11 3HB ALA 11 -1.858 -2.920 -6.312
90 H ASP 12 H ASP 12 0.586 -4.520 -9.668
91 HA ASP 12 HA ASP 12 -1.375 -5.811 -11.022
92 1HB ASP 12 1HB ASP 12 1.432 -6.515 -10.177
93 2HB ASP 12 2HB ASP 12 0.459 -7.790 -10.887
94 HD2 ASP 12 HD ASP 12 2.082 -7.702 -12.445
95 H MET 13 H MET 13 -3.165 -6.434 -9.650
96 HA MET 13 HA MET 13 -2.854 -8.930 -8.401
97 1HB MET 13 1HB MET 13 -2.553 -6.503 -6.773
98 2HB MET 13 2HB MET 13 -3.963 -7.399 -6.245
99 1HG MET 13 1HG MET 13 -1.131 -8.514 -6.518
100 2HG MET 13 2HG MET 13 -1.954 -8.157 -5.013
101 1HE MET 13 1HE MET 13 -2.017 -11.480 -7.820
102 2HE MET 13 2HE MET 13 -0.789 -10.329 -7.237
103 3HE MET 13 3HE MET 13 -1.170 -11.784 -6.284
104 H SER 14 H SER 14 -5.104 -9.228 -6.917
105 HA SER 14 HA SER 14 -7.129 -8.645 -8.875
106 1HB SER 14 1HB SER 14 -7.160 -10.908 -8.149
107 2HB SER 14 2HB SER 14 -6.943 -10.475 -6.465
108 HG SER 14 HG SER 14 -9.210 -11.102 -7.421
109 H GLU 15 H GLU 15 -9.132 -7.539 -8.369
110 HA GLU 15 HA GLU 15 -8.874 -5.297 -6.873
111 1HB GLU 15 1HB GLU 15 -10.750 -6.246 -8.579
112 2HB GLU 15 2HB GLU 15 -11.617 -6.500 -7.078
113 1HG GLU 15 1HG GLU 15 -12.235 -4.312 -7.269
114 2HG GLU 15 2HG GLU 15 -10.621 -3.947 -6.689
115 HE2 GLU 15 HE GLU 15 -9.388 -4.834 -9.299
116 H GLU 16 H GLU 16 -9.394 -8.561 -5.784
117 HA GLU 16 HA GLU 16 -10.830 -8.081 -3.477
118 1HB GLU 16 1HB GLU 16 -9.232 -10.259 -4.632
119 2HB GLU 16 2HB GLU 16 -9.103 -10.221 -2.886
120 1HG GLU 16 1HG GLU 16 -11.023 -11.625 -3.672
121 2HG GLU 16 2HG GLU 16 -11.537 -10.312 -2.633
122 HE2 GLU 16 HE GLU 16 -12.984 -11.265 -5.779
123 H MET 17 H MET 17 -7.234 -8.529 -3.862
124 HA MET 17 HA MET 17 -6.829 -7.525 -1.227
125 1HB MET 17 1HB MET 17 -4.895 -8.219 -3.507
126 2HB MET 17 2HB MET 17 -4.386 -7.850 -1.872
127 1HG MET 17 1HG MET 17 -4.499 -10.152 -1.659
128 2HG MET 17 2HG MET 17 -6.171 -9.793 -1.276
129 1HE MET 17 1HE MET 17 -4.560 -12.598 -3.231
130 2HE MET 17 2HE MET 17 -4.379 -11.850 -4.837
131 3HE MET 17 3HE MET 17 -3.607 -11.106 -3.416
132 H GLN 18 H GLN 18 -6.644 -6.318 -4.579
133 HA GLN 18 HA GLN 18 -5.127 -4.055 -4.010
134 1HB GLN 18 1HB GLN 18 -5.515 -5.003 -6.295
135 2HB GLN 18 2HB GLN 18 -7.186 -4.483 -6.221
136 1HG GLN 18 1HG GLN 18 -6.339 -2.098 -5.851
137 2HG GLN 18 2HG GLN 18 -4.717 -2.687 -6.158
138 1HE2 GLN 18 2HE2 GLN 18 -4.724 -4.273 -8.171
139 2HE2 GLN 18 1HE2 GLN 18 -5.415 -3.607 -9.612
140 H GLN 19 H GLN 19 -8.689 -4.662 -4.125
141 HA GLN 19 HA GLN 19 -9.316 -1.972 -3.574
142 1HB GLN 19 1HB GLN 19 -10.789 -3.757 -4.709
143 2HB GLN 19 2HB GLN 19 -11.108 -4.387 -3.105
144 1HG GLN 19 1HG GLN 19 -11.768 -1.601 -4.154
145 2HG GLN 19 2HG GLN 19 -12.902 -2.844 -3.666
146 1HE2 GLN 19 2HE2 GLN 19 -11.582 -0.027 -2.772
147 2HE2 GLN 19 1HE2 GLN 19 -11.665 -0.121 -1.045
148 H ASP 20 H ASP 20 -9.332 -5.020 -1.597
149 HA ASP 20 HA ASP 20 -10.194 -3.915 0.734
150 1HB ASP 20 1HB ASP 20 -9.726 -6.378 0.166
151 2HB ASP 20 2HB ASP 20 -8.034 -6.061 0.497
152 HD2 ASP 20 HD ASP 20 -9.299 -7.788 2.986
153 H ALA 21 H ALA 21 -6.801 -4.399 -0.501
154 HA ALA 21 HA ALA 21 -5.456 -3.333 1.668
155 1HB ALA 21 1HB ALA 21 -4.744 -3.285 -1.294
156 2HB ALA 21 2HB ALA 21 -4.410 -4.614 -0.159
157 3HB ALA 21 3HB ALA 21 -3.604 -3.041 0.052
158 H VAL 22 H VAL 22 -6.102 -1.648 -1.494
159 HA VAL 22 HA VAL 22 -5.379 0.855 -0.692
160 HB VAL 22 HB VAL 22 -6.232 -0.221 -2.958
161 1HG1 VAL 22 1HG1 VAL 22 -8.655 0.010 -1.742
162 2HG1 VAL 22 2HG1 VAL 22 -8.413 0.015 -3.505
163 3HG1 VAL 22 3HG1 VAL 22 -8.580 1.553 -2.627
164 1HG2 VAL 22 1HG2 VAL 22 -6.870 2.482 -3.363
165 2HG2 VAL 22 2HG2 VAL 22 -5.279 1.706 -3.562
166 3HG2 VAL 22 3HG2 VAL 22 -5.708 2.474 -2.014
167 H ASP 23 H ASP 23 -8.154 -1.051 0.285
168 HA ASP 23 HA ASP 23 -9.846 1.036 0.966
169 1HB ASP 23 1HB ASP 23 -9.979 -1.714 0.985
170 2HB ASP 23 2HB ASP 23 -9.841 -1.398 2.703
171 HD2 ASP 23 HD ASP 23 -12.759 0.776 1.338
172 H CYS 24 H CYS 24 -7.720 -1.089 3.044
173 HA CYS 24 HA CYS 24 -8.040 0.442 5.349
174 1HB CYS 24 1HB CYS 24 -6.036 -1.639 4.486
175 2HB CYS 24 2HB CYS 24 -5.830 -0.783 6.001
176 HG CYS 24 HG CYS 24 -8.860 -1.702 5.373
177 H ALA 25 H ALA 25 -5.951 0.678 2.485
178 HA ALA 25 HA ALA 25 -3.980 2.346 3.589
179 1HB ALA 25 1HB ALA 25 -4.695 2.647 0.717
180 2HB ALA 25 2HB ALA 25 -4.323 0.991 1.254
181 3HB ALA 25 3HB ALA 25 -3.125 2.289 1.475
182 H THR 26 H THR 26 -6.567 3.273 1.209
183 HA THR 26 HA THR 26 -6.382 5.980 1.575
184 HB THR 26 HB THR 26 -7.687 4.663 -0.180
185 HG1 THR 26 HG1 THR 26 -7.956 7.009 0.370
186 1HG2 THR 26 1HG2 THR 26 -9.832 4.667 2.005
187 2HG2 THR 26 2HG2 THR 26 -8.973 3.204 1.466
188 3HG2 THR 26 3HG2 THR 26 -10.021 4.090 0.332
189 H GLN 27 H GLN 27 -8.377 3.635 3.459
190 HA GLN 27 HA GLN 27 -9.651 5.544 4.981
191 1HB GLN 27 1HB GLN 27 -8.966 2.627 5.426
192 2HB GLN 27 2HB GLN 27 -9.770 3.542 6.685
193 1HG GLN 27 1HG GLN 27 -11.364 4.267 4.629
194 2HG GLN 27 2HG GLN 27 -10.788 2.753 3.959
195 1HE2 GLN 27 2HE2 GLN 27 -12.910 4.271 6.111
196 2HE2 GLN 27 1HE2 GLN 27 -13.581 2.881 6.897
197 H ALA 28 H ALA 28 -6.509 3.835 5.450
198 HA ALA 28 HA ALA 28 -5.949 4.685 8.009
199 1HB ALA 28 1HB ALA 28 -4.090 4.229 5.640
200 2HB ALA 28 2HB ALA 28 -4.655 2.996 6.792
201 3HB ALA 28 3HB ALA 28 -3.582 4.304 7.344
202 H LEU 29 H LEU 29 -5.144 6.278 4.844
203 HA LEU 29 HA LEU 29 -3.994 8.536 6.070
204 1HB LEU 29 1HB LEU 29 -3.370 7.949 3.863
205 2HB LEU 29 2HB LEU 29 -5.030 7.954 3.303
206 HG LEU 29 HG LEU 29 -4.297 10.552 4.380
207 1HD1 LEU 29 1HD1 LEU 29 -2.055 10.194 3.787
208 2HD1 LEU 29 2HD1 LEU 29 -2.751 11.098 2.420
209 3HD1 LEU 29 3HD1 LEU 29 -2.492 9.341 2.286
210 1HD2 LEU 29 1HD2 LEU 29 -4.895 10.094 1.493
211 2HD2 LEU 29 2HD2 LEU 29 -5.505 11.336 2.615
212 3HD2 LEU 29 3HD2 LEU 29 -6.148 9.678 2.687
213 H GLU 30 H GLU 30 -7.293 7.498 5.471
214 HA GLU 30 HA GLU 30 -8.287 10.180 5.743
215 1HB GLU 30 1HB GLU 30 -9.223 7.847 4.498
216 2HB GLU 30 2HB GLU 30 -10.274 8.013 5.890
217 1HG GLU 30 1HG GLU 30 -10.754 10.386 5.239
218 2HG GLU 30 2HG GLU 30 -9.709 10.211 3.842
219 HE2 GLU 30 HE GLU 30 -10.757 9.252 2.009
220 H LYS 31 H LYS 31 -6.847 8.296 7.896
221 HA LYS 31 HA LYS 31 -8.703 9.065 10.022
222 1HB LYS 31 1HB LYS 31 -9.216 6.786 9.850
223 2HB LYS 31 2HB LYS 31 -7.562 6.328 9.501
224 1HG LYS 31 1HG LYS 31 -6.866 6.867 11.798
225 2HG LYS 31 2HG LYS 31 -8.450 7.519 12.169
226 1HD LYS 31 1HD LYS 31 -8.221 4.663 11.186
227 2HD LYS 31 2HD LYS 31 -7.834 5.026 12.857
228 1HE LYS 31 1HE LYS 31 -10.084 6.077 13.155
229 2HE LYS 31 2HE LYS 31 -10.472 5.735 11.481
230 1HZ LYS 31 1HZ LYS 31 -11.320 4.019 13.021
231 H TYR 32 H TYR 32 -5.393 8.029 9.023
232 HA TYR 32 HA TYR 32 -4.320 9.323 11.406
233 1HB TYR 32 1HB TYR 32 -3.377 7.486 9.142
234 2HB TYR 32 2HB TYR 32 -2.183 8.298 10.135
235 HD1 TYR 32 HD1 TYR 32 -4.544 5.555 9.934
236 HD2 TYR 32 HD2 TYR 32 -2.095 7.821 12.612
237 HE1 TYR 32 HE1 TYR 32 -4.719 3.705 11.670
238 HE2 TYR 32 HE2 TYR 32 -2.278 5.965 14.340
239 HH TYR 32 HH TYR 32 -4.531 3.740 14.359
240 H ASN 33 H ASN 33 -1.837 10.168 10.541
241 HA ASN 33 HA ASN 33 -2.360 11.946 8.323
242 1HB ASN 33 1HB ASN 33 -2.863 13.043 10.668
243 2HB ASN 33 2HB ASN 33 -1.125 13.020 10.897
244 1HD2 ASN 33 2HD2 ASN 33 -2.549 15.357 10.873
245 2HD2 ASN 33 1HD2 ASN 33 -2.154 16.308 9.481
246 H ILE 34 H ILE 34 -0.116 10.750 10.910
247 HA ILE 34 HA ILE 34 2.246 11.524 9.572
248 HB ILE 34 HB ILE 34 1.799 9.446 11.719
249 1HG1 ILE 34 1HG1 ILE 34 2.926 11.872 12.716
250 2HG1 ILE 34 2HG1 ILE 34 1.506 12.296 11.780
251 1HG2 ILE 34 1HG2 ILE 34 4.044 9.696 10.254
252 2HG2 ILE 34 2HG2 ILE 34 4.035 9.243 11.975
253 3HG2 ILE 34 3HG2 ILE 34 4.361 10.925 11.501
254 1HD1 ILE 34 1HD1 ILE 34 0.053 11.067 13.151
255 2HD1 ILE 34 2HD1 ILE 34 1.263 11.623 14.332
256 3HD1 ILE 34 3HD1 ILE 34 1.338 9.962 13.694
257 H GLU 35 H GLU 35 1.970 10.836 7.374
258 HA GLU 35 HA GLU 35 1.202 8.577 6.348
259 1HB GLU 35 1HB GLU 35 3.649 10.233 5.711
260 2HB GLU 35 2HB GLU 35 3.330 8.784 4.779
261 1HG GLU 35 1HG GLU 35 1.695 9.822 3.594
262 2HG GLU 35 2HG GLU 35 0.864 10.302 5.059
263 HE2 GLU 35 HE GLU 35 1.133 12.812 3.257
264 H LYS 36 H LYS 36 4.314 8.987 8.117
265 HA LYS 36 HA LYS 36 5.454 6.551 7.591
266 1HB LYS 36 1HB LYS 36 5.673 8.634 9.661
267 2HB LYS 36 2HB LYS 36 6.157 7.041 10.209
268 1HG LYS 36 1HG LYS 36 7.723 6.813 8.316
269 2HG LYS 36 2HG LYS 36 7.169 8.328 7.629
270 1HD LYS 36 1HD LYS 36 7.852 9.144 10.175
271 2HD LYS 36 2HD LYS 36 9.007 7.849 9.931
272 1HE LYS 36 1HE LYS 36 9.067 9.234 7.486
273 2HE LYS 36 2HE LYS 36 8.894 10.515 8.670
274 1HZ LYS 36 1HZ LYS 36 11.244 9.418 8.071
275 H ASP 37 H ASP 37 3.164 7.407 10.275
276 HA ASP 37 HA ASP 37 3.050 4.777 11.203
277 1HB ASP 37 1HB ASP 37 2.309 7.120 12.253
278 2HB ASP 37 2HB ASP 37 0.760 6.731 11.534
279 HD2 ASP 37 HD ASP 37 1.199 5.632 15.019
280 H ILE 38 H ILE 38 1.464 6.605 8.625
281 HA ILE 38 HA ILE 38 -0.874 5.065 8.393
282 HB ILE 38 HB ILE 38 0.597 6.679 6.306
283 1HG1 ILE 38 1HG1 ILE 38 -1.475 7.494 8.362
284 2HG1 ILE 38 2HG1 ILE 38 0.182 8.054 8.247
285 1HG2 ILE 38 1HG2 ILE 38 -2.180 5.512 6.430
286 2HG2 ILE 38 2HG2 ILE 38 -0.961 5.380 5.140
287 3HG2 ILE 38 3HG2 ILE 38 -1.798 6.925 5.419
288 1HD1 ILE 38 1HD1 ILE 38 -2.200 8.907 6.719
289 2HD1 ILE 38 2HD1 ILE 38 -0.777 8.594 5.694
290 3HD1 ILE 38 3HD1 ILE 38 -0.674 9.774 7.024
291 H ALA 39 H ALA 39 2.345 4.904 6.735
292 HA ALA 39 HA ALA 39 1.656 2.660 5.180
293 1HB ALA 39 1HB ALA 39 3.465 4.154 4.556
294 2HB ALA 39 2HB ALA 39 4.145 2.536 4.855
295 3HB ALA 39 3HB ALA 39 4.325 3.817 6.077
296 H ALA 40 H ALA 40 3.121 3.111 8.434
297 HA ALA 40 HA ALA 40 3.812 0.402 8.785
298 1HB ALA 40 1HB ALA 40 4.552 1.113 10.839
299 2HB ALA 40 2HB ALA 40 3.117 2.126 11.128
300 3HB ALA 40 3HB ALA 40 4.412 2.703 10.052
301 H TYR 41 H TYR 41 0.819 2.284 9.139
302 HA TYR 41 HA TYR 41 -0.519 0.370 10.754
303 1HB TYR 41 1HB TYR 41 -1.247 2.709 10.660
304 2HB TYR 41 2HB TYR 41 -1.210 2.720 8.909
305 HD1 TYR 41 HD1 TYR 41 -3.058 1.784 7.601
306 HD2 TYR 41 HD2 TYR 41 -3.145 1.748 11.878
307 HE1 TYR 41 HE1 TYR 41 -5.544 1.262 7.552
308 HE2 TYR 41 HE2 TYR 41 -5.632 1.227 11.815
309 HH TYR 41 HH TYR 41 -7.363 1.066 8.725
310 H ILE 42 H ILE 42 -0.241 0.989 7.218
311 HA ILE 42 HA ILE 42 -2.253 -0.849 6.496
312 HB ILE 42 HB ILE 42 0.078 0.272 4.938
313 1HG1 ILE 42 1HG1 ILE 42 -2.785 1.200 4.783
314 2HG1 ILE 42 2HG1 ILE 42 -1.703 1.838 6.006
315 1HG2 ILE 42 1HG2 ILE 42 -0.943 -0.468 2.954
316 2HG2 ILE 42 2HG2 ILE 42 -2.458 -0.890 3.787
317 3HG2 ILE 42 3HG2 ILE 42 -0.995 -1.867 4.054
318 1HD1 ILE 42 1HD1 ILE 42 -1.761 3.210 3.887
319 2HD1 ILE 42 2HD1 ILE 42 -1.059 1.821 3.022
320 3HD1 ILE 42 3HD1 ILE 42 -0.132 2.628 4.310
321 H LYS 43 H LYS 43 1.373 -1.086 6.292
322 HA LYS 43 HA LYS 43 1.490 -3.726 5.583
323 1HB LYS 43 1HB LYS 43 3.510 -2.655 5.435
324 2HB LYS 43 2HB LYS 43 3.317 -1.810 6.958
325 1HG LYS 43 1HG LYS 43 3.449 -4.778 7.202
326 2HG LYS 43 2HG LYS 43 4.914 -4.036 6.589
327 1HD LYS 43 1HD LYS 43 3.504 -3.004 9.085
328 2HD LYS 43 2HD LYS 43 4.709 -4.273 9.158
329 1HE LYS 43 1HE LYS 43 6.374 -2.760 8.060
330 2HE LYS 43 2HE LYS 43 5.168 -1.489 7.980
331 1HZ LYS 43 1HZ LYS 43 5.263 -2.398 10.629
332 H LYS 44 H LYS 44 1.456 -2.319 8.927
333 HA LYS 44 HA LYS 44 1.526 -4.789 10.225
334 1HB LYS 44 1HB LYS 44 2.113 -2.764 11.376
335 2HB LYS 44 2HB LYS 44 0.536 -2.059 11.082
336 1HG LYS 44 1HG LYS 44 0.452 -4.707 12.441
337 2HG LYS 44 2HG LYS 44 1.245 -3.451 13.371
338 1HD LYS 44 1HD LYS 44 -1.350 -2.709 12.048
339 2HD LYS 44 2HD LYS 44 -1.447 -3.824 13.397
340 1HE LYS 44 1HE LYS 44 0.365 -1.558 13.952
341 2HE LYS 44 2HE LYS 44 -1.260 -1.027 13.573
342 1HZ LYS 44 1HZ LYS 44 -1.957 -2.846 15.249
343 H GLU 45 H GLU 45 -1.142 -2.830 8.858
344 HA GLU 45 HA GLU 45 -3.233 -4.104 10.069
345 1HB GLU 45 1HB GLU 45 -2.807 -2.378 7.751
346 2HB GLU 45 2HB GLU 45 -4.067 -3.548 7.417
347 1HG GLU 45 1HG GLU 45 -4.041 -1.975 10.020
348 2HG GLU 45 2HG GLU 45 -4.742 -1.297 8.563
349 HE2 GLU 45 HE GLU 45 -5.756 -4.863 9.705
350 H PHE 46 H PHE 46 -1.570 -4.920 6.946
351 HA PHE 46 HA PHE 46 -3.155 -7.255 6.580
352 1HB PHE 46 1HB PHE 46 -0.885 -5.743 5.327
353 2HB PHE 46 2HB PHE 46 -0.824 -7.468 5.028
354 HD1 PHE 46 HD1 PHE 46 -3.712 -8.108 4.802
355 HD2 PHE 46 HD2 PHE 46 -1.492 -4.830 3.273
356 HE1 PHE 46 HE1 PHE 46 -5.379 -7.847 2.945
357 HE2 PHE 46 HE2 PHE 46 -3.161 -4.567 1.416
358 HZ PHE 46 HZ PHE 46 -5.084 -6.078 1.274
359 H ASP 47 H ASP 47 0.426 -6.821 7.095
360 HA ASP 47 HA ASP 47 1.195 -9.297 7.425
361 1HB ASP 47 1HB ASP 47 3.061 -8.345 8.323
362 2HB ASP 47 2HB ASP 47 2.217 -6.822 8.122
363 HD2 ASP 47 HD ASP 47 0.770 -7.467 11.294
364 H LYS 48 H LYS 48 -0.832 -7.398 9.680
365 HA LYS 48 HA LYS 48 -0.691 -8.620 12.029
366 1HB LYS 48 1HB LYS 48 -2.254 -6.848 11.626
367 2HB LYS 48 2HB LYS 48 -3.169 -7.816 10.488
368 1HG LYS 48 1HG LYS 48 -4.410 -7.914 12.533
369 2HG LYS 48 2HG LYS 48 -3.609 -9.467 12.410
370 1HD LYS 48 1HD LYS 48 -2.917 -9.019 14.548
371 2HD LYS 48 2HD LYS 48 -1.683 -8.058 13.759
372 1HE LYS 48 1HE LYS 48 -2.737 -6.677 15.470
373 2HE LYS 48 2HE LYS 48 -3.198 -6.045 13.902
374 1HZ LYS 48 1HZ LYS 48 -4.859 -7.411 15.867
375 H LYS 49 H LYS 49 -3.195 -9.835 9.706
376 HA LYS 49 HA LYS 49 -2.283 -12.544 10.284
377 1HB LYS 49 1HB LYS 49 -4.735 -11.324 11.306
378 2HB LYS 49 2HB LYS 49 -5.062 -12.753 10.345
379 1HG LYS 49 1HG LYS 49 -3.275 -13.977 11.698
380 2HG LYS 49 2HG LYS 49 -3.163 -12.565 12.729
381 1HD LYS 49 1HD LYS 49 -5.522 -12.777 13.383
382 2HD LYS 49 2HD LYS 49 -5.772 -14.066 12.223
383 1HE LYS 49 1HE LYS 49 -3.799 -14.235 14.551
384 2HE LYS 49 2HE LYS 49 -5.434 -14.861 14.613
385 1HZ LYS 49 1HZ LYS 49 -3.175 -16.095 13.485
386 H TYR 50 H TYR 50 -1.427 -11.818 8.037
387 HA TYR 50 HA TYR 50 -3.421 -12.714 6.092
388 1HB TYR 50 1HB TYR 50 -2.940 -10.087 6.357
389 2HB TYR 50 2HB TYR 50 -1.401 -10.459 5.608
390 HD1 TYR 50 HD1 TYR 50 -1.559 -9.383 3.522
391 HD2 TYR 50 HD2 TYR 50 -4.737 -11.941 4.811
392 HE1 TYR 50 HE1 TYR 50 -2.639 -9.210 1.226
393 HE2 TYR 50 HE2 TYR 50 -5.806 -11.759 2.511
394 HH TYR 50 HH TYR 50 -5.201 -9.462 0.420
395 H ASN 51 H ASN 51 0.003 -11.486 6.124
396 HA ASN 51 HA ASN 51 1.093 -14.018 5.792
397 1HB ASN 51 1HB ASN 51 -0.081 -13.413 3.456
398 2HB ASN 51 2HB ASN 51 1.344 -12.421 3.224
399 1HD2 ASN 51 2HD2 ASN 51 0.719 -14.562 1.597
400 2HD2 ASN 51 1HD2 ASN 51 1.894 -15.820 1.777
401 HA PRO 52 HA PRO 52 3.796 -10.454 6.774
402 1HB PRO 52 1HB PRO 52 4.621 -11.273 9.247
403 2HB PRO 52 2HB PRO 52 3.265 -10.193 9.000
404 1HG PRO 52 1HG PRO 52 3.241 -13.059 9.721
405 2HG PRO 52 2HG PRO 52 1.959 -11.875 9.883
406 1HD PRO 52 1HD PRO 52 2.169 -13.912 7.875
407 2HD PRO 52 2HD PRO 52 0.951 -12.656 7.970
408 H THR 53 H THR 53 7.089 -11.508 6.546
409 HA THR 53 HA THR 53 5.113 -9.646 7.654
410 HB THR 53 HB THR 53 7.207 -9.970 8.938
411 HG1 THR 53 HG1 THR 53 6.233 -7.797 8.657
412 1HG2 THR 53 1HG2 THR 53 9.158 -8.655 7.422
413 2HG2 THR 53 2HG2 THR 53 8.407 -9.749 6.235
414 3HG2 THR 53 3HG2 THR 53 9.114 -10.408 7.730
415 H TRP 54 H TRP 54 5.019 -7.434 6.830
416 HA TRP 54 HA TRP 54 5.490 -7.444 3.930
417 1HB TRP 54 1HB TRP 54 3.470 -5.892 5.558
418 2HB TRP 54 2HB TRP 54 3.699 -5.764 3.826
419 HD1 TRP 54 HD TRP 54 2.713 -8.550 6.387
420 HE1 TRP 54 HE1 TRP 54 1.009 -10.244 5.297
421 HE3 TRP 54 HE3 TRP 54 2.773 -6.446 1.759
422 HZ2 TRP 54 HZ2 TRP 54 -0.097 -10.510 2.680
423 HZ3 TRP 54 HZ3 TRP 54 1.351 -7.485 -0.008
424 HH2 TRP 54 HH TRP 54 -0.050 -9.447 0.393
425 H HIS 55 H HIS 55 6.164 -5.308 3.003
426 HA HIS 55 HA HIS 55 7.380 -3.532 4.954
427 1HB HIS 55 1HB HIS 55 8.942 -4.641 2.609
428 2HB HIS 55 2HB HIS 55 9.520 -3.530 3.835
429 HD1 HIS 55 HD1 HIS 55 10.699 -4.565 5.791
430 HD2 HIS 55 HD2 HIS 55 8.230 -7.304 3.789
431 HE1 HIS 55 HE1 HIS 55 11.109 -6.833 6.887
432 H CYS 56 H CYS 56 6.427 -1.607 4.523
433 HA CYS 56 HA CYS 56 6.070 -0.951 1.688
434 1HB CYS 56 1HB CYS 56 3.879 -1.164 2.495
435 2HB CYS 56 2HB CYS 56 4.266 -0.453 4.050
436 HG CYS 56 HG CYS 56 4.864 1.943 3.099
437 H ILE 57 H ILE 57 6.370 1.392 1.188
438 HA ILE 57 HA ILE 57 7.826 2.844 3.267
439 HB ILE 57 HB ILE 57 8.792 2.291 0.463
440 1HG1 ILE 57 1HG1 ILE 57 9.238 0.560 2.205
441 2HG1 ILE 57 2HG1 ILE 57 10.681 1.261 1.499
442 1HG2 ILE 57 1HG2 ILE 57 9.148 4.630 0.857
443 2HG2 ILE 57 2HG2 ILE 57 10.702 3.784 1.045
444 3HG2 ILE 57 3HG2 ILE 57 9.796 4.311 2.484
445 1HD1 ILE 57 1HD1 ILE 57 11.381 2.053 3.505
446 2HD1 ILE 57 2HD1 ILE 57 10.070 1.100 4.241
447 3HD1 ILE 57 3HD1 ILE 57 9.802 2.810 3.827
448 H VAL 58 H VAL 58 8.061 5.228 2.632
449 HA VAL 58 HA VAL 58 5.810 6.031 0.932
450 HB VAL 58 HB VAL 58 6.516 7.072 3.682
451 1HG1 VAL 58 1HG1 VAL 58 4.857 8.744 3.444
452 2HG1 VAL 58 2HG1 VAL 58 4.233 8.026 1.938
453 3HG1 VAL 58 3HG1 VAL 58 5.827 8.821 1.952
454 1HG2 VAL 58 1HG2 VAL 58 4.375 6.241 4.383
455 2HG2 VAL 58 2HG2 VAL 58 5.233 4.913 3.563
456 3HG2 VAL 58 3HG2 VAL 58 3.938 5.796 2.715
457 H GLY 59 H GLY 59 7.290 6.454 -0.784
458 1HA GLY 59 2HA GLY 59 9.015 8.802 -0.271
459 2HA GLY 59 1HA GLY 59 9.554 7.437 -1.227
460 H ARG 60 H ARG 60 8.879 7.195 -3.385
461 HA ARG 60 HA ARG 60 6.730 8.820 -4.316
462 1HB ARG 60 1HB ARG 60 9.337 9.899 -4.439
463 2HB ARG 60 2HB ARG 60 9.075 9.268 -6.052
464 1HG ARG 60 1HG ARG 60 6.684 10.662 -5.084
465 2HG ARG 60 2HG ARG 60 8.088 11.706 -4.995
466 1HD ARG 60 1HD ARG 60 8.616 11.072 -7.415
467 2HD ARG 60 2HD ARG 60 7.089 10.214 -7.467
468 HE ARG 60 HE ARG 60 6.469 12.790 -6.518
469 1HH1 ARG 60 2HH2 ARG 60 7.895 11.414 -9.455
470 2HH1 ARG 60 1HH2 ARG 60 7.335 12.697 -10.476
471 1HH2 ARG 60 1HH ARG 60 6.064 14.489 -9.518
472 H ASN 61 H ASN 61 9.547 6.682 -5.040
473 HA ASN 61 HA ASN 61 7.810 5.282 -6.904
474 1HB ASN 61 1HB ASN 61 10.056 6.772 -7.679
475 2HB ASN 61 2HB ASN 61 10.709 5.151 -7.548
476 1HD2 ASN 61 2HD2 ASN 61 10.455 3.805 -9.168
477 2HD2 ASN 61 1HD2 ASN 61 9.359 3.972 -10.498
478 H PHE 62 H PHE 62 9.671 3.194 -7.550
479 HA PHE 62 HA PHE 62 10.000 1.975 -4.908
480 1HB PHE 62 1HB PHE 62 8.625 1.144 -7.138
481 2HB PHE 62 2HB PHE 62 10.203 0.500 -7.551
482 HD1 PHE 62 HD1 PHE 62 10.691 0.160 -4.347
483 HD2 PHE 62 HD2 PHE 62 7.856 -1.234 -7.180
484 HE1 PHE 62 HE1 PHE 62 10.245 -1.852 -2.912
485 HE2 PHE 62 HE2 PHE 62 7.411 -3.245 -5.745
486 HZ PHE 62 HZ PHE 62 8.611 -3.530 -3.628
487 H GLY 63 H GLY 63 11.635 -0.180 -6.412
488 1HA GLY 63 2HA GLY 63 14.046 1.143 -7.236
489 2HA GLY 63 1HA GLY 63 14.154 0.497 -5.610
490 H SER 64 H SER 64 13.656 -1.855 -5.273
491 HA SER 64 HA SER 64 14.579 -3.313 -7.600
492 1HB SER 64 1HB SER 64 15.150 -5.105 -6.011
493 2HB SER 64 2HB SER 64 15.856 -3.584 -5.499
494 HG SER 64 HG SER 64 13.308 -4.511 -4.499
495 H TYR 65 H TYR 65 12.576 -3.445 -8.781
496 HA TYR 65 HA TYR 65 10.642 -5.270 -7.533
497 1HB TYR 65 1HB TYR 65 9.480 -3.183 -7.506
498 2HB TYR 65 2HB TYR 65 10.409 -2.547 -8.850
499 HD1 TYR 65 HD1 TYR 65 9.209 -2.147 -10.786
500 HD2 TYR 65 HD2 TYR 65 8.013 -5.391 -8.266
501 HE1 TYR 65 HE1 TYR 65 7.278 -2.665 -12.357
502 HE2 TYR 65 HE2 TYR 65 6.087 -5.898 -9.844
503 HH TYR 65 HH TYR 65 5.580 -5.547 -12.233
504 H VAL 66 H VAL 66 11.949 -3.796 -10.567
505 HA VAL 66 HA VAL 66 10.894 -6.049 -12.072
506 HB VAL 66 HB VAL 66 10.656 -3.689 -12.836
507 1HG1 VAL 66 1HG1 VAL 66 12.425 -2.334 -12.677
508 2HG1 VAL 66 2HG1 VAL 66 13.126 -3.199 -14.064
509 3HG1 VAL 66 3HG1 VAL 66 13.530 -3.701 -12.405
510 1HG2 VAL 66 1HG2 VAL 66 11.869 -5.892 -14.431
511 2HG2 VAL 66 2HG2 VAL 66 11.824 -4.283 -15.188
512 3HG2 VAL 66 3HG2 VAL 66 10.315 -5.047 -14.632
513 H THR 67 H THR 67 12.856 -6.670 -10.063
514 HA THR 67 HA THR 67 14.792 -7.949 -11.767
515 HB THR 67 HB THR 67 15.947 -5.828 -11.501
516 HG1 THR 67 HG1 THR 67 17.723 -6.687 -10.209
517 1HG2 THR 67 1HG2 THR 67 15.852 -6.064 -8.483
518 2HG2 THR 67 2HG2 THR 67 14.491 -5.277 -9.317
519 3HG2 THR 67 3HG2 THR 67 16.136 -4.620 -9.486
520 H HIS 68 H HIS 68 14.152 -7.063 -8.303
521 HA HIS 68 HA HIS 68 14.695 -9.848 -7.655
522 1HB HIS 68 1HB HIS 68 15.897 -8.066 -6.429
523 2HB HIS 68 2HB HIS 68 14.367 -7.433 -5.852
524 HD1 HIS 68 HD1 HIS 68 16.422 -10.657 -5.642
525 HD2 HIS 68 HD2 HIS 68 13.491 -8.552 -3.503
526 HE1 HIS 68 HE1 HIS 68 16.117 -11.900 -3.435
527 H GLU 69 H GLU 69 12.134 -7.392 -7.804
528 HA GLU 69 HA GLU 69 10.010 -7.434 -7.287
529 1HB GLU 69 1HB GLU 69 8.745 -9.407 -8.184
530 2HB GLU 69 2HB GLU 69 9.931 -8.778 -9.310
531 1HG GLU 69 1HG GLU 69 11.522 -10.555 -8.730
532 2HG GLU 69 2HG GLU 69 10.489 -11.120 -7.431
533 HE2 GLU 69 HE GLU 69 8.645 -11.411 -10.922
534 H THR 70 H THR 70 8.145 -9.258 -6.319
535 HA THR 70 HA THR 70 9.287 -10.579 -4.005
536 HB THR 70 HB THR 70 8.096 -9.215 -2.391
537 HG1 THR 70 HG1 THR 70 6.180 -8.536 -3.288
538 1HG2 THR 70 1HG2 THR 70 8.891 -6.914 -2.802
539 2HG2 THR 70 2HG2 THR 70 9.125 -7.277 -4.529
540 3HG2 THR 70 3HG2 THR 70 10.157 -8.059 -3.309
541 H ARG 71 H ARG 71 6.498 -10.454 -2.769
542 HA ARG 71 HA ARG 71 5.447 -12.521 -4.514
543 1HB ARG 71 1HB ARG 71 4.954 -11.940 -1.549
544 2HB ARG 71 2HB ARG 71 4.140 -13.212 -2.438
545 1HG ARG 71 1HG ARG 71 7.103 -13.231 -2.723
546 2HG ARG 71 2HG ARG 71 6.538 -13.516 -1.090
547 1HD ARG 71 1HD ARG 71 6.498 -15.698 -1.920
548 2HD ARG 71 2HD ARG 71 4.853 -15.209 -2.274
549 HE ARG 71 HE ARG 71 6.719 -14.573 -4.438
550 1HH1 ARG 71 2HH2 ARG 71 4.640 -17.099 -3.077
551 2HH1 ARG 71 1HH2 ARG 71 4.480 -17.949 -4.578
552 1HH2 ARG 71 1HH ARG 71 5.586 -17.103 -6.529
553 H HIS 72 H HIS 72 4.189 -10.047 -2.141
554 HA HIS 72 HA HIS 72 2.148 -9.390 -4.133
555 1HB HIS 72 1HB HIS 72 1.805 -10.072 -1.224
556 2HB HIS 72 2HB HIS 72 0.692 -8.960 -1.997
557 HD1 HIS 72 HD1 HIS 72 -1.392 -10.340 -2.270
558 HD2 HIS 72 HD2 HIS 72 2.046 -12.358 -3.578
559 HE1 HIS 72 HE1 HIS 72 -2.201 -12.509 -3.342
560 H PHE 73 H PHE 73 2.278 -7.286 -4.716
561 HA PHE 73 HA PHE 73 3.068 -5.370 -2.663
562 1HB PHE 73 1HB PHE 73 4.432 -4.333 -4.707
563 2HB PHE 73 2HB PHE 73 5.150 -5.654 -3.806
564 HD1 PHE 73 HD1 PHE 73 4.017 -4.540 -7.010
565 HD2 PHE 73 HD2 PHE 73 4.908 -8.012 -4.737
566 HE1 PHE 73 HE1 PHE 73 4.223 -5.874 -9.126
567 HE2 PHE 73 HE2 PHE 73 5.114 -9.345 -6.854
568 HZ PHE 73 HZ PHE 73 4.768 -8.261 -9.023
569 H ILE 74 H ILE 74 2.556 -3.084 -3.315
570 HA ILE 74 HA ILE 74 0.885 -2.692 -5.588
571 HB ILE 74 HB ILE 74 -0.955 -3.504 -4.596
572 1HG1 ILE 74 1HG1 ILE 74 -0.821 -0.809 -3.213
573 2HG1 ILE 74 2HG1 ILE 74 -1.310 -1.069 -4.875
574 1HG2 ILE 74 1HG2 ILE 74 -0.026 -4.511 -2.687
575 2HG2 ILE 74 2HG2 ILE 74 -1.316 -3.449 -2.072
576 3HG2 ILE 74 3HG2 ILE 74 0.388 -2.944 -1.951
577 1HD1 ILE 74 1HD1 ILE 74 -3.421 -1.449 -4.155
578 2HD1 ILE 74 2HD1 ILE 74 -2.889 -1.342 -2.461
579 3HD1 ILE 74 3HD1 ILE 74 -2.839 -2.905 -3.312
580 H TYR 75 H TYR 75 1.460 -0.712 -6.288
581 HA TYR 75 HA TYR 75 2.304 1.219 -4.235
582 1HB TYR 75 1HB TYR 75 4.157 0.602 -5.699
583 2HB TYR 75 2HB TYR 75 3.114 0.521 -7.105
584 HD1 TYR 75 HD1 TYR 75 3.038 2.318 -8.598
585 HD2 TYR 75 HD2 TYR 75 4.457 2.977 -4.616
586 HE1 TYR 75 HE1 TYR 75 3.701 4.693 -9.219
587 HE2 TYR 75 HE2 TYR 75 5.114 5.349 -5.250
588 HH TYR 75 HH TYR 75 5.391 6.364 -8.387
589 H PHE 76 H PHE 76 0.825 2.801 -3.914
590 HA PHE 76 HA PHE 76 -0.440 3.926 -6.287
591 1HB PHE 76 1HB PHE 76 -2.587 3.978 -4.818
592 2HB PHE 76 2HB PHE 76 -2.120 2.395 -5.408
593 HD1 PHE 76 HD1 PHE 76 -0.493 1.067 -3.770
594 HD2 PHE 76 HD2 PHE 76 -3.115 4.184 -2.583
595 HE1 PHE 76 HE1 PHE 76 -0.461 0.197 -1.416
596 HE2 PHE 76 HE2 PHE 76 -3.084 3.314 -0.228
597 HZ PHE 76 HZ PHE 76 -1.757 1.331 0.327
598 H TYR 77 H TYR 77 -1.909 5.934 -5.348
599 HA TYR 77 HA TYR 77 -0.043 7.413 -3.622
600 1HB TYR 77 1HB TYR 77 -0.768 7.927 -6.191
601 2HB TYR 77 2HB TYR 77 -2.211 8.573 -5.435
602 HD1 TYR 77 HD1 TYR 77 1.482 8.769 -4.731
603 HD2 TYR 77 HD2 TYR 77 -2.200 10.879 -5.278
604 HE1 TYR 77 HE1 TYR 77 2.677 10.976 -4.323
605 HE2 TYR 77 HE2 TYR 77 -0.993 13.078 -4.868
606 HH TYR 77 HH TYR 77 1.842 13.333 -3.413
607 H LEU 78 H LEU 78 -0.774 7.590 -1.563
608 HA LEU 78 HA LEU 78 -3.640 7.494 -1.111
609 1HB LEU 78 1HB LEU 78 -1.186 7.157 0.562
610 2HB LEU 78 2HB LEU 78 -2.687 7.616 1.341
611 HG LEU 78 HG LEU 78 -2.433 5.183 -0.441
612 1HD1 LEU 78 1HD1 LEU 78 -0.949 5.315 1.726
613 2HD1 LEU 78 2HD1 LEU 78 -1.852 3.834 1.323
614 3HD1 LEU 78 3HD1 LEU 78 -2.488 4.963 2.545
615 1HD2 LEU 78 1HD2 LEU 78 -4.472 5.530 1.727
616 2HD2 LEU 78 2HD2 LEU 78 -4.548 4.578 0.225
617 3HD2 LEU 78 3HD2 LEU 78 -4.702 6.350 0.165
618 H GLY 79 H GLY 79 -4.829 9.316 -1.058
619 1HA GLY 79 2HA GLY 79 -5.417 11.457 -0.705
620 2HA GLY 79 1HA GLY 79 -4.102 11.580 0.446
621 H GLN 80 H GLN 80 -1.924 12.161 -0.318
622 HA GLN 80 HA GLN 80 -1.791 13.067 -3.046
623 1HB GLN 80 1HB GLN 80 -1.095 15.348 -2.447
624 2HB GLN 80 2HB GLN 80 -2.703 15.025 -1.828
625 1HG GLN 80 1HG GLN 80 -1.424 14.271 0.368
626 2HG GLN 80 2HG GLN 80 -0.088 15.188 -0.300
627 1HE2 GLN 80 2HE2 GLN 80 0.034 17.040 0.710
628 2HE2 GLN 80 1HE2 GLN 80 -1.264 18.139 1.044
629 H VAL 81 H VAL 81 -0.571 10.922 -1.382
630 HA VAL 81 HA VAL 81 2.206 11.685 -1.848
631 HB VAL 81 HB VAL 81 1.635 12.069 0.548
632 1HG1 VAL 81 1HG1 VAL 81 1.689 9.494 1.624
633 2HG1 VAL 81 2HG1 VAL 81 0.542 9.380 0.268
634 3HG1 VAL 81 3HG1 VAL 81 0.287 10.590 1.550
635 1HG2 VAL 81 1HG2 VAL 81 3.913 11.175 -0.501
636 2HG2 VAL 81 2HG2 VAL 81 3.545 9.767 0.523
637 3HG2 VAL 81 3HG2 VAL 81 3.705 11.383 1.254
638 H ALA 82 H ALA 82 3.639 9.696 -1.924
639 HA ALA 82 HA ALA 82 2.149 7.598 -3.282
640 1HB ALA 82 1HB ALA 82 5.142 8.104 -3.043
641 2HB ALA 82 2HB ALA 82 4.108 8.687 -4.369
642 3HB ALA 82 3HB ALA 82 4.348 6.940 -4.131
643 H ILE 83 H ILE 83 2.490 5.327 -2.762
644 HA ILE 83 HA ILE 83 3.830 4.736 -0.280
645 HB ILE 83 HB ILE 83 1.481 5.586 0.261
646 1HG1 ILE 83 1HG1 ILE 83 2.025 2.801 1.281
647 2HG1 ILE 83 2HG1 ILE 83 3.099 4.130 1.671
648 1HG2 ILE 83 1HG2 ILE 83 0.336 4.391 -1.577
649 2HG2 ILE 83 2HG2 ILE 83 -0.351 4.028 0.025
650 3HG2 ILE 83 3HG2 ILE 83 0.709 2.846 -0.777
651 1HD1 ILE 83 1HD1 ILE 83 1.549 4.134 3.461
652 2HD1 ILE 83 2HD1 ILE 83 0.169 3.803 2.386
653 3HD1 ILE 83 3HD1 ILE 83 0.932 5.411 2.386
654 H LEU 84 H LEU 84 4.921 2.878 -0.616
655 HA LEU 84 HA LEU 84 3.777 1.033 -2.596
656 1HB LEU 84 1HB LEU 84 5.634 1.210 -3.752
657 2HB LEU 84 2HB LEU 84 6.251 2.391 -2.614
658 HG LEU 84 HG LEU 84 7.781 0.473 -3.047
659 1HD1 LEU 84 1HD1 LEU 84 8.658 1.009 -1.086
660 2HD1 LEU 84 2HD1 LEU 84 7.475 -0.024 -0.250
661 3HD1 LEU 84 3HD1 LEU 84 7.094 1.684 -0.572
662 1HD2 LEU 84 1HD2 LEU 84 5.520 -1.091 -2.807
663 2HD2 LEU 84 2HD2 LEU 84 6.384 -1.393 -1.280
664 3HD2 LEU 84 3HD2 LEU 84 7.202 -1.671 -2.836
665 H LEU 85 H LEU 85 3.180 -0.911 -1.805
666 HA LEU 85 HA LEU 85 4.476 -1.762 0.690
667 1HB LEU 85 1HB LEU 85 2.222 -0.961 1.125
668 2HB LEU 85 2HB LEU 85 1.574 -2.030 -0.102
669 HG LEU 85 HG LEU 85 3.138 -3.303 2.093
670 1HD1 LEU 85 1HD1 LEU 85 0.814 -3.330 3.356
671 2HD1 LEU 85 2HD1 LEU 85 0.609 -1.771 2.521
672 3HD1 LEU 85 3HD1 LEU 85 1.998 -2.026 3.606
673 1HD2 LEU 85 1HD2 LEU 85 2.316 -4.845 0.567
674 2HD2 LEU 85 2HD2 LEU 85 0.767 -3.989 0.373
675 3HD2 LEU 85 3HD2 LEU 85 1.104 -4.893 1.870
676 H PHE 86 H PHE 86 5.423 -3.746 0.633
677 HA PHE 86 HA PHE 86 4.504 -5.638 -1.368
678 1HB PHE 86 1HB PHE 86 6.750 -5.848 -2.310
679 2HB PHE 86 2HB PHE 86 6.410 -4.129 -2.271
680 HD1 PHE 86 HD1 PHE 86 7.907 -2.682 -1.234
681 HD2 PHE 86 HD2 PHE 86 8.052 -6.813 -0.277
682 HE1 PHE 86 HE1 PHE 86 9.998 -2.300 0.101
683 HE2 PHE 86 HE2 PHE 86 10.142 -6.431 1.059
684 HZ PHE 86 HZ PHE 86 11.090 -4.179 1.232
685 H LYS 87 H LYS 87 5.030 -7.837 -0.860
686 HA LYS 87 HA LYS 87 5.912 -8.145 1.917
687 1HB LYS 87 1HB LYS 87 3.588 -8.961 0.840
688 2HB LYS 87 2HB LYS 87 4.563 -10.363 0.452
689 1HG LYS 87 1HG LYS 87 4.572 -9.169 3.251
690 2HG LYS 87 2HG LYS 87 3.339 -10.315 2.760
691 1HD LYS 87 1HD LYS 87 6.286 -10.949 2.363
692 2HD LYS 87 2HD LYS 87 5.516 -11.223 3.914
693 1HE LYS 87 1HE LYS 87 4.867 -13.242 3.089
694 2HE LYS 87 2HE LYS 87 3.692 -12.364 2.132
695 1HZ LYS 87 1HZ LYS 87 5.224 -13.838 0.825
696 H SER 88 H SER 88 7.909 -8.938 2.284
697 HA SER 88 HA SER 88 8.956 -10.830 0.377
698 1HB SER 88 1HB SER 88 10.724 -9.582 -0.358
699 2HB SER 88 2HB SER 88 9.700 -8.226 0.068
700 HG SER 88 HG SER 88 11.992 -8.281 0.945
701 H GLY 89 H GLY 89 9.424 -12.570 1.671
702 1HA GLY 89 2HA GLY 89 11.188 -13.250 3.291
703 2HA GLY 89 1HA GLY 89 10.549 -12.008 4.350
Start of MODEL 8
1 1H MET 1 H MET 1 -10.178 17.759 -11.681
2 HA MET 1 HA MET 1 -12.141 18.544 -12.761
3 1HB MET 1 1HB MET 1 -10.324 18.114 -15.124
4 2HB MET 1 2HB MET 1 -12.015 17.732 -15.390
5 1HG MET 1 1HG MET 1 -12.707 19.987 -14.760
6 2HG MET 1 2HG MET 1 -11.100 20.384 -14.187
7 1HE MET 1 1HE MET 1 -10.849 22.694 -16.325
8 2HE MET 1 2HE MET 1 -9.933 21.755 -15.121
9 3HE MET 1 3HE MET 1 -9.358 21.848 -16.802
10 H SER 2 H SER 2 -10.215 15.731 -14.017
11 HA SER 2 HA SER 2 -12.571 14.095 -13.549
12 1HB SER 2 1HB SER 2 -10.339 14.043 -15.494
13 2HB SER 2 2HB SER 2 -10.687 12.469 -14.805
14 HG SER 2 HG SER 2 -12.175 13.990 -16.609
15 H ASP 3 H ASP 3 -12.380 13.818 -11.259
16 HA ASP 3 HA ASP 3 -10.003 12.310 -10.497
17 1HB ASP 3 1HB ASP 3 -10.122 13.305 -8.282
18 2HB ASP 3 2HB ASP 3 -10.129 14.602 -9.461
19 HD2 ASP 3 HD ASP 3 -11.912 15.079 -6.705
20 H ARG 4 H ARG 4 -10.501 10.826 -8.514
21 HA ARG 4 HA ARG 4 -13.307 10.164 -8.352
22 1HB ARG 4 1HB ARG 4 -11.081 8.270 -9.205
23 2HB ARG 4 2HB ARG 4 -12.540 7.653 -8.459
24 1HG ARG 4 1HG ARG 4 -13.871 8.166 -10.289
25 2HG ARG 4 2HG ARG 4 -12.954 9.603 -10.695
26 1HD ARG 4 1HD ARG 4 -11.210 8.319 -11.762
27 2HD ARG 4 2HD ARG 4 -11.777 6.816 -11.062
28 HE ARG 4 HE ARG 4 -13.763 8.164 -12.758
29 1HH1 ARG 4 2HH2 ARG 4 -11.103 5.825 -12.680
30 2HH1 ARG 4 1HH2 ARG 4 -11.599 5.027 -14.135
31 1HH2 ARG 4 1HH ARG 4 -13.550 5.799 -15.293
32 H LYS 5 H LYS 5 -10.048 8.876 -7.331
33 HA LYS 5 HA LYS 5 -10.300 9.707 -4.681
34 1HB LYS 5 1HB LYS 5 -10.843 7.679 -3.517
35 2HB LYS 5 2HB LYS 5 -12.141 8.046 -4.635
36 1HG LYS 5 1HG LYS 5 -10.022 6.363 -5.840
37 2HG LYS 5 2HG LYS 5 -10.789 5.608 -4.458
38 1HD LYS 5 1HD LYS 5 -12.899 5.538 -5.481
39 2HD LYS 5 2HD LYS 5 -12.575 6.928 -6.498
40 1HE LYS 5 1HE LYS 5 -11.572 5.664 -8.148
41 2HE LYS 5 2HE LYS 5 -10.795 4.588 -7.005
42 1HZ LYS 5 1HZ LYS 5 -12.758 3.323 -6.793
43 H ALA 6 H ALA 6 -8.784 7.701 -3.389
44 HA ALA 6 HA ALA 6 -6.244 8.331 -4.094
45 1HB ALA 6 1HB ALA 6 -7.577 6.132 -2.582
46 2HB ALA 6 2HB ALA 6 -6.321 7.281 -2.063
47 3HB ALA 6 3HB ALA 6 -5.879 5.862 -3.042
48 H VAL 7 H VAL 7 -5.458 8.253 -6.162
49 HA VAL 7 HA VAL 7 -6.238 6.274 -8.008
50 HB VAL 7 HB VAL 7 -3.835 8.112 -8.014
51 1HG1 VAL 7 1HG1 VAL 7 -3.626 6.358 -9.681
52 2HG1 VAL 7 2HG1 VAL 7 -4.007 7.901 -10.483
53 3HG1 VAL 7 3HG1 VAL 7 -5.278 6.674 -10.266
54 1HG2 VAL 7 1HG2 VAL 7 -6.617 8.742 -8.068
55 2HG2 VAL 7 2HG2 VAL 7 -5.958 9.034 -9.696
56 3HG2 VAL 7 3HG2 VAL 7 -5.226 9.831 -8.282
57 H ILE 8 H ILE 8 -4.660 4.742 -9.100
58 HA ILE 8 HA ILE 8 -2.669 3.741 -7.204
59 HB ILE 8 HB ILE 8 -5.044 2.306 -8.299
60 1HG1 ILE 8 1HG1 ILE 8 -4.682 1.185 -5.966
61 2HG1 ILE 8 2HG1 ILE 8 -3.627 2.551 -5.655
62 1HG2 ILE 8 1HG2 ILE 8 -3.679 0.166 -7.599
63 2HG2 ILE 8 2HG2 ILE 8 -2.284 1.173 -8.055
64 3HG2 ILE 8 3HG2 ILE 8 -3.562 0.832 -9.244
65 1HD1 ILE 8 1HD1 ILE 8 -6.509 2.465 -5.594
66 2HD1 ILE 8 2HD1 ILE 8 -6.005 3.603 -6.867
67 3HD1 ILE 8 3HD1 ILE 8 -5.436 3.827 -5.195
68 H LYS 9 H LYS 9 -0.749 3.177 -8.155
69 HA LYS 9 HA LYS 9 -0.600 3.641 -11.016
70 1HB LYS 9 1HB LYS 9 1.390 3.519 -8.762
71 2HB LYS 9 2HB LYS 9 1.932 3.342 -10.419
72 1HG LYS 9 1HG LYS 9 1.083 5.513 -11.042
73 2HG LYS 9 2HG LYS 9 0.129 5.648 -9.577
74 1HD LYS 9 1HD LYS 9 2.866 5.214 -8.786
75 2HD LYS 9 2HD LYS 9 2.869 6.461 -10.018
76 1HE LYS 9 1HE LYS 9 0.702 6.778 -8.007
77 2HE LYS 9 2HE LYS 9 2.313 6.874 -7.326
78 1HZ LYS 9 1HZ LYS 9 2.479 8.391 -9.595
79 H ASN 10 H ASN 10 0.609 1.145 -8.660
80 HA ASN 10 HA ASN 10 -0.162 -0.849 -10.594
81 1HB ASN 10 1HB ASN 10 2.550 -0.004 -10.301
82 2HB ASN 10 2HB ASN 10 2.452 -1.530 -9.448
83 1HD2 ASN 10 2HD2 ASN 10 3.272 -3.011 -10.725
84 2HD2 ASN 10 1HD2 ASN 10 2.855 -3.311 -12.378
85 H ALA 11 H ALA 11 -0.902 -2.732 -9.505
86 HA ALA 11 HA ALA 11 -0.043 -3.231 -6.798
87 1HB ALA 11 1HB ALA 11 -2.357 -1.664 -7.267
88 2HB ALA 11 2HB ALA 11 -1.839 -2.401 -5.733
89 3HB ALA 11 3HB ALA 11 -2.940 -3.284 -6.818
90 H ASP 12 H ASP 12 -2.348 -3.988 -9.486
91 HA ASP 12 HA ASP 12 -2.864 -5.858 -10.456
92 1HB ASP 12 1HB ASP 12 -0.171 -6.260 -9.697
93 2HB ASP 12 2HB ASP 12 -0.985 -7.717 -9.163
94 HD2 ASP 12 HD ASP 12 -0.203 -7.228 -12.990
95 H MET 13 H MET 13 -2.764 -8.618 -9.501
96 HA MET 13 HA MET 13 -3.619 -10.029 -8.060
97 1HB MET 13 1HB MET 13 -2.768 -7.976 -6.355
98 2HB MET 13 2HB MET 13 -4.472 -8.084 -5.960
99 1HG MET 13 1HG MET 13 -4.279 -10.452 -5.404
100 2HG MET 13 2HG MET 13 -2.656 -10.537 -6.059
101 1HE MET 13 1HE MET 13 -3.786 -11.063 -2.627
102 2HE MET 13 2HE MET 13 -2.666 -11.789 -3.804
103 3HE MET 13 3HE MET 13 -2.032 -11.023 -2.328
104 H SER 14 H SER 14 -5.866 -10.008 -6.402
105 HA SER 14 HA SER 14 -7.875 -9.384 -8.362
106 1HB SER 14 1HB SER 14 -8.157 -11.552 -7.470
107 2HB SER 14 2HB SER 14 -7.772 -11.045 -5.836
108 HG SER 14 HG SER 14 -10.140 -10.157 -7.245
109 H GLU 15 H GLU 15 -9.654 -7.952 -7.995
110 HA GLU 15 HA GLU 15 -9.152 -5.672 -6.661
111 1HB GLU 15 1HB GLU 15 -11.188 -6.610 -8.240
112 2HB GLU 15 2HB GLU 15 -12.023 -6.483 -6.706
113 1HG GLU 15 1HG GLU 15 -12.323 -4.298 -7.354
114 2HG GLU 15 2HG GLU 15 -10.721 -4.091 -6.674
115 HE2 GLU 15 HE GLU 15 -11.426 -2.447 -8.511
116 H GLU 16 H GLU 16 -10.122 -8.759 -5.327
117 HA GLU 16 HA GLU 16 -11.415 -7.903 -3.048
118 1HB GLU 16 1HB GLU 16 -10.836 -10.140 -2.137
119 2HB GLU 16 2HB GLU 16 -11.421 -10.243 -3.786
120 1HG GLU 16 1HG GLU 16 -8.895 -10.111 -4.477
121 2HG GLU 16 2HG GLU 16 -8.556 -10.482 -2.798
122 HE2 GLU 16 HE GLU 16 -9.655 -13.499 -2.637
123 H MET 17 H MET 17 -7.908 -8.681 -3.599
124 HA MET 17 HA MET 17 -7.256 -7.786 -0.977
125 1HB MET 17 1HB MET 17 -5.479 -8.429 -3.396
126 2HB MET 17 2HB MET 17 -4.912 -8.276 -1.746
127 1HG MET 17 1HG MET 17 -5.320 -10.493 -1.471
128 2HG MET 17 2HG MET 17 -7.033 -10.142 -1.580
129 1HE MET 17 1HE MET 17 -6.698 -13.139 -2.968
130 2HE MET 17 2HE MET 17 -5.156 -13.073 -3.855
131 3HE MET 17 3HE MET 17 -5.234 -12.525 -2.164
132 H GLN 18 H GLN 18 -6.995 -6.535 -4.344
133 HA GLN 18 HA GLN 18 -5.419 -4.346 -3.740
134 1HB GLN 18 1HB GLN 18 -5.664 -4.974 -6.033
135 2HB GLN 18 2HB GLN 18 -7.414 -4.935 -5.951
136 1HG GLN 18 1HG GLN 18 -6.471 -2.939 -7.133
137 2HG GLN 18 2HG GLN 18 -7.417 -2.493 -5.727
138 1HE2 GLN 18 2HE2 GLN 18 -4.856 -1.592 -7.335
139 2HE2 GLN 18 1HE2 GLN 18 -3.773 -1.057 -6.094
140 H GLN 19 H GLN 19 -8.999 -4.806 -3.746
141 HA GLN 19 HA GLN 19 -9.527 -2.103 -3.198
142 1HB GLN 19 1HB GLN 19 -11.098 -3.893 -4.205
143 2HB GLN 19 2HB GLN 19 -11.354 -4.450 -2.564
144 1HG GLN 19 1HG GLN 19 -12.093 -1.773 -3.783
145 2HG GLN 19 2HG GLN 19 -13.129 -2.907 -2.938
146 1HE2 GLN 19 2HE2 GLN 19 -12.692 -3.293 -0.646
147 2HE2 GLN 19 1HE2 GLN 19 -12.148 -1.986 0.352
148 H ASP 20 H ASP 20 -9.654 -5.104 -1.140
149 HA ASP 20 HA ASP 20 -10.317 -3.945 1.197
150 1HB ASP 20 1HB ASP 20 -9.872 -6.426 0.627
151 2HB ASP 20 2HB ASP 20 -8.178 -6.103 0.945
152 HD2 ASP 20 HD ASP 20 -9.432 -7.961 2.711
153 H ALA 21 H ALA 21 -7.052 -4.311 -0.332
154 HA ALA 21 HA ALA 21 -5.595 -3.231 1.817
155 1HB ALA 21 1HB ALA 21 -3.781 -3.097 0.156
156 2HB ALA 21 2HB ALA 21 -4.953 -3.357 -1.159
157 3HB ALA 21 3HB ALA 21 -4.643 -4.650 0.024
158 H VAL 22 H VAL 22 -6.158 -1.729 -1.447
159 HA VAL 22 HA VAL 22 -5.418 0.785 -0.883
160 HB VAL 22 HB VAL 22 -6.480 -0.419 -2.987
161 1HG1 VAL 22 1HG1 VAL 22 -8.752 -0.567 -2.193
162 2HG1 VAL 22 2HG1 VAL 22 -8.698 0.611 -3.528
163 3HG1 VAL 22 3HG1 VAL 22 -8.795 1.178 -1.843
164 1HG2 VAL 22 1HG2 VAL 22 -5.926 2.370 -2.275
165 2HG2 VAL 22 2HG2 VAL 22 -7.077 2.207 -3.625
166 3HG2 VAL 22 3HG2 VAL 22 -5.472 1.443 -3.726
167 H ASP 23 H ASP 23 -8.304 -0.907 0.292
168 HA ASP 23 HA ASP 23 -9.750 1.336 1.034
169 1HB ASP 23 1HB ASP 23 -10.433 -1.177 0.952
170 2HB ASP 23 2HB ASP 23 -9.715 -1.309 2.546
171 HD2 ASP 23 HD ASP 23 -12.665 1.103 1.682
172 H CYS 24 H CYS 24 -7.795 -0.983 3.075
173 HA CYS 24 HA CYS 24 -7.858 0.513 5.384
174 1HB CYS 24 1HB CYS 24 -5.785 -1.469 4.396
175 2HB CYS 24 2HB CYS 24 -5.798 -0.804 6.015
176 HG CYS 24 HG CYS 24 -6.863 -3.046 6.372
177 H ALA 25 H ALA 25 -5.936 0.789 2.409
178 HA ALA 25 HA ALA 25 -3.870 2.391 3.453
179 1HB ALA 25 1HB ALA 25 -3.189 2.570 1.229
180 2HB ALA 25 2HB ALA 25 -4.859 2.577 0.610
181 3HB ALA 25 3HB ALA 25 -4.133 1.061 1.197
182 H THR 26 H THR 26 -6.487 3.445 1.166
183 HA THR 26 HA THR 26 -6.239 6.133 1.639
184 HB THR 26 HB THR 26 -8.623 4.376 0.871
185 HG1 THR 26 HG1 THR 26 -6.687 6.147 -0.451
186 1HG2 THR 26 1HG2 THR 26 -9.896 6.252 0.400
187 2HG2 THR 26 2HG2 THR 26 -8.469 7.233 -0.003
188 3HG2 THR 26 3HG2 THR 26 -8.927 6.988 1.698
189 H GLN 27 H GLN 27 -8.398 3.798 3.371
190 HA GLN 27 HA GLN 27 -9.597 5.642 4.985
191 1HB GLN 27 1HB GLN 27 -8.867 2.729 5.499
192 2HB GLN 27 2HB GLN 27 -9.882 3.658 6.584
193 1HG GLN 27 1HG GLN 27 -10.855 4.041 3.885
194 2HG GLN 27 2HG GLN 27 -10.643 2.322 4.154
195 1HE2 GLN 27 2HE2 GLN 27 -12.500 5.097 4.788
196 2HE2 GLN 27 1HE2 GLN 27 -13.666 4.423 5.875
197 H ALA 28 H ALA 28 -6.539 3.774 5.533
198 HA ALA 28 HA ALA 28 -5.976 4.622 8.074
199 1HB ALA 28 1HB ALA 28 -3.513 4.392 7.145
200 2HB ALA 28 2HB ALA 28 -4.340 3.803 5.681
201 3HB ALA 28 3HB ALA 28 -4.573 2.965 7.234
202 H LEU 29 H LEU 29 -5.049 6.196 4.934
203 HA LEU 29 HA LEU 29 -3.842 8.406 6.191
204 1HB LEU 29 1HB LEU 29 -3.418 7.560 3.881
205 2HB LEU 29 2HB LEU 29 -4.978 8.197 3.401
206 HG LEU 29 HG LEU 29 -3.427 10.261 4.710
207 1HD1 LEU 29 1HD1 LEU 29 -1.904 10.204 2.424
208 2HD1 LEU 29 2HD1 LEU 29 -1.945 8.490 2.904
209 3HD1 LEU 29 3HD1 LEU 29 -1.361 9.721 4.050
210 1HD2 LEU 29 1HD2 LEU 29 -4.498 9.963 1.892
211 2HD2 LEU 29 2HD2 LEU 29 -3.879 11.468 2.614
212 3HD2 LEU 29 3HD2 LEU 29 -5.340 10.695 3.278
213 H GLU 30 H GLU 30 -7.157 7.470 5.621
214 HA GLU 30 HA GLU 30 -8.050 10.199 5.893
215 1HB GLU 30 1HB GLU 30 -9.049 7.950 4.545
216 2HB GLU 30 2HB GLU 30 -10.131 8.117 5.914
217 1HG GLU 30 1HG GLU 30 -10.116 10.697 5.230
218 2HG GLU 30 2HG GLU 30 -9.587 10.080 3.678
219 HE2 GLU 30 HE GLU 30 -11.872 8.815 2.493
220 H LYS 31 H LYS 31 -6.754 8.181 8.017
221 HA LYS 31 HA LYS 31 -8.654 8.937 10.112
222 1HB LYS 31 1HB LYS 31 -9.193 6.677 9.879
223 2HB LYS 31 2HB LYS 31 -7.543 6.204 9.527
224 1HG LYS 31 1HG LYS 31 -6.975 6.048 11.743
225 2HG LYS 31 2HG LYS 31 -7.846 7.506 12.174
226 1HD LYS 31 1HD LYS 31 -9.102 5.844 13.271
227 2HD LYS 31 2HD LYS 31 -10.014 6.075 11.792
228 1HE LYS 31 1HE LYS 31 -8.255 4.152 10.947
229 2HE LYS 31 2HE LYS 31 -8.339 3.743 12.649
230 1HZ LYS 31 1HZ LYS 31 -10.364 3.434 10.636
231 H TYR 32 H TYR 32 -5.327 7.872 9.196
232 HA TYR 32 HA TYR 32 -4.318 9.115 11.637
233 1HB TYR 32 1HB TYR 32 -3.310 7.291 9.388
234 2HB TYR 32 2HB TYR 32 -2.157 8.048 10.468
235 HD1 TYR 32 HD1 TYR 32 -5.051 5.714 10.351
236 HD2 TYR 32 HD2 TYR 32 -1.745 7.169 12.643
237 HE1 TYR 32 HE1 TYR 32 -5.373 3.828 12.026
238 HE2 TYR 32 HE2 TYR 32 -2.078 5.280 14.310
239 HH TYR 32 HH TYR 32 -3.297 3.599 14.902
240 H ASN 33 H ASN 33 -1.987 10.182 11.180
241 HA ASN 33 HA ASN 33 -2.328 11.915 8.865
242 1HB ASN 33 1HB ASN 33 -2.789 12.844 11.365
243 2HB ASN 33 2HB ASN 33 -1.042 12.985 11.386
244 1HD2 ASN 33 2HD2 ASN 33 -3.986 14.298 10.333
245 2HD2 ASN 33 1HD2 ASN 33 -3.394 15.608 9.367
246 H ILE 34 H ILE 34 -0.188 10.546 11.446
247 HA ILE 34 HA ILE 34 2.230 11.351 10.233
248 HB ILE 34 HB ILE 34 1.722 9.129 12.213
249 1HG1 ILE 34 1HG1 ILE 34 2.704 11.650 13.296
250 2HG1 ILE 34 2HG1 ILE 34 1.142 11.844 12.525
251 1HG2 ILE 34 1HG2 ILE 34 3.911 8.786 12.210
252 2HG2 ILE 34 2HG2 ILE 34 4.206 10.502 12.574
253 3HG2 ILE 34 3HG2 ILE 34 4.084 9.960 10.884
254 1HD1 ILE 34 1HD1 ILE 34 0.711 11.230 14.817
255 2HD1 ILE 34 2HD1 ILE 34 1.874 9.884 14.740
256 3HD1 ILE 34 3HD1 ILE 34 0.346 9.793 13.833
257 H GLU 35 H GLU 35 1.984 10.794 7.987
258 HA GLU 35 HA GLU 35 1.218 8.587 6.833
259 1HB GLU 35 1HB GLU 35 3.783 10.131 6.276
260 2HB GLU 35 2HB GLU 35 3.180 8.891 5.194
261 1HG GLU 35 1HG GLU 35 1.915 10.513 4.227
262 2HG GLU 35 2HG GLU 35 0.907 10.454 5.659
263 HE2 GLU 35 HE GLU 35 1.763 13.673 4.849
264 H LYS 36 H LYS 36 4.344 8.927 8.605
265 HA LYS 36 HA LYS 36 5.487 6.524 7.969
266 1HB LYS 36 1HB LYS 36 5.909 8.624 9.820
267 2HB LYS 36 2HB LYS 36 5.921 7.144 10.756
268 1HG LYS 36 1HG LYS 36 7.404 6.378 8.552
269 2HG LYS 36 2HG LYS 36 7.825 8.076 8.661
270 1HD LYS 36 1HD LYS 36 7.990 7.315 11.317
271 2HD LYS 36 2HD LYS 36 8.484 5.839 10.514
272 1HE LYS 36 1HE LYS 36 10.266 6.998 9.308
273 2HE LYS 36 2HE LYS 36 9.684 8.564 9.839
274 1HZ LYS 36 1HZ LYS 36 10.351 8.097 12.055
275 H ASP 37 H ASP 37 3.136 7.247 10.633
276 HA ASP 37 HA ASP 37 3.052 4.572 11.457
277 1HB ASP 37 1HB ASP 37 2.351 6.764 12.705
278 2HB ASP 37 2HB ASP 37 0.829 6.612 11.851
279 HD2 ASP 37 HD ASP 37 0.172 3.520 13.612
280 H ILE 38 H ILE 38 1.510 6.492 8.933
281 HA ILE 38 HA ILE 38 -0.836 4.966 8.625
282 HB ILE 38 HB ILE 38 0.648 6.687 6.635
283 1HG1 ILE 38 1HG1 ILE 38 -1.444 7.370 8.714
284 2HG1 ILE 38 2HG1 ILE 38 0.195 7.981 8.609
285 1HG2 ILE 38 1HG2 ILE 38 -2.294 6.001 6.649
286 2HG2 ILE 38 2HG2 ILE 38 -1.087 5.070 5.732
287 3HG2 ILE 38 3HG2 ILE 38 -1.343 6.793 5.370
288 1HD1 ILE 38 1HD1 ILE 38 -0.679 9.717 7.432
289 2HD1 ILE 38 2HD1 ILE 38 -2.221 8.862 7.178
290 3HD1 ILE 38 3HD1 ILE 38 -0.850 8.571 6.080
291 H ALA 39 H ALA 39 2.373 4.915 6.934
292 HA ALA 39 HA ALA 39 1.701 2.723 5.304
293 1HB ALA 39 1HB ALA 39 3.523 4.410 4.906
294 2HB ALA 39 2HB ALA 39 4.067 2.722 4.762
295 3HB ALA 39 3HB ALA 39 4.447 3.657 6.227
296 H ALA 40 H ALA 40 3.282 3.054 8.529
297 HA ALA 40 HA ALA 40 3.947 0.328 8.756
298 1HB ALA 40 1HB ALA 40 4.958 2.222 10.046
299 2HB ALA 40 2HB ALA 40 4.384 0.895 11.084
300 3HB ALA 40 3HB ALA 40 3.427 2.387 10.937
301 H TYR 41 H TYR 41 0.984 2.208 9.237
302 HA TYR 41 HA TYR 41 -0.310 0.251 10.853
303 1HB TYR 41 1HB TYR 41 -1.044 2.572 10.916
304 2HB TYR 41 2HB TYR 41 -1.005 2.712 9.171
305 HD1 TYR 41 HD1 TYR 41 -2.753 1.328 7.830
306 HD2 TYR 41 HD2 TYR 41 -3.068 2.124 12.023
307 HE1 TYR 41 HE1 TYR 41 -5.249 0.848 7.743
308 HE2 TYR 41 HE2 TYR 41 -5.561 1.641 11.920
309 HH TYR 41 HH TYR 41 -6.991 0.090 9.329
310 H ILE 42 H ILE 42 -0.095 0.980 7.342
311 HA ILE 42 HA ILE 42 -2.189 -0.757 6.598
312 HB ILE 42 HB ILE 42 0.160 0.309 5.027
313 1HG1 ILE 42 1HG1 ILE 42 -2.599 1.421 4.786
314 2HG1 ILE 42 2HG1 ILE 42 -1.687 1.839 6.222
315 1HG2 ILE 42 1HG2 ILE 42 -0.761 -1.606 3.894
316 2HG2 ILE 42 2HG2 ILE 42 -1.277 -0.128 3.049
317 3HG2 ILE 42 3HG2 ILE 42 -2.418 -0.991 4.108
318 1HD1 ILE 42 1HD1 ILE 42 0.021 2.033 3.862
319 2HD1 ILE 42 2HD1 ILE 42 -0.388 3.287 5.059
320 3HD1 ILE 42 3HD1 ILE 42 -1.453 3.010 3.658
321 H LYS 43 H LYS 43 1.423 -1.113 6.620
322 HA LYS 43 HA LYS 43 1.409 -3.762 5.746
323 1HB LYS 43 1HB LYS 43 3.462 -2.763 5.526
324 2HB LYS 43 2HB LYS 43 3.358 -1.923 7.060
325 1HG LYS 43 1HG LYS 43 3.380 -4.892 7.293
326 2HG LYS 43 2HG LYS 43 4.846 -4.216 6.612
327 1HD LYS 43 1HD LYS 43 3.601 -3.118 9.168
328 2HD LYS 43 2HD LYS 43 4.743 -4.446 9.191
329 1HE LYS 43 1HE LYS 43 6.533 -3.106 8.412
330 2HE LYS 43 2HE LYS 43 5.467 -1.920 7.686
331 1HZ LYS 43 1HZ LYS 43 4.986 -0.999 9.778
332 H LYS 44 H LYS 44 1.472 -2.339 9.079
333 HA LYS 44 HA LYS 44 1.566 -4.776 10.417
334 1HB LYS 44 1HB LYS 44 2.121 -2.818 11.610
335 2HB LYS 44 2HB LYS 44 0.628 -2.010 11.173
336 1HG LYS 44 1HG LYS 44 -0.676 -3.635 12.530
337 2HG LYS 44 2HG LYS 44 0.792 -4.508 12.925
338 1HD LYS 44 1HD LYS 44 0.888 -3.163 14.767
339 2HD LYS 44 2HD LYS 44 1.482 -1.932 13.672
340 1HE LYS 44 1HE LYS 44 -0.985 -1.303 13.235
341 2HE LYS 44 2HE LYS 44 -1.401 -2.358 14.572
342 1HZ LYS 44 1HZ LYS 44 -1.116 -0.151 15.426
343 H GLU 45 H GLU 45 -1.178 -2.834 9.137
344 HA GLU 45 HA GLU 45 -3.205 -4.213 10.339
345 1HB GLU 45 1HB GLU 45 -3.564 -2.141 9.083
346 2HB GLU 45 2HB GLU 45 -3.085 -2.912 7.584
347 1HG GLU 45 1HG GLU 45 -5.433 -3.925 9.244
348 2HG GLU 45 2HG GLU 45 -5.625 -2.682 8.023
349 HE2 GLU 45 HE GLU 45 -5.953 -5.774 8.434
350 H PHE 46 H PHE 46 -1.632 -4.842 7.124
351 HA PHE 46 HA PHE 46 -3.158 -7.195 6.690
352 1HB PHE 46 1HB PHE 46 -0.963 -5.568 5.470
353 2HB PHE 46 2HB PHE 46 -0.810 -7.281 5.125
354 HD1 PHE 46 HD1 PHE 46 -1.567 -4.701 3.382
355 HD2 PHE 46 HD2 PHE 46 -3.717 -8.006 4.950
356 HE1 PHE 46 HE1 PHE 46 -3.253 -4.480 1.536
357 HE2 PHE 46 HE2 PHE 46 -5.404 -7.785 3.104
358 HZ PHE 46 HZ PHE 46 -5.151 -6.024 1.420
359 H ASP 47 H ASP 47 0.428 -6.748 7.142
360 HA ASP 47 HA ASP 47 1.232 -9.216 7.372
361 1HB ASP 47 1HB ASP 47 3.093 -8.347 8.405
362 2HB ASP 47 2HB ASP 47 2.307 -6.819 8.057
363 HD2 ASP 47 HD ASP 47 3.664 -6.869 11.208
364 H LYS 48 H LYS 48 -0.808 -7.455 9.717
365 HA LYS 48 HA LYS 48 -0.615 -8.758 12.019
366 1HB LYS 48 1HB LYS 48 -2.232 -6.989 11.583
367 2HB LYS 48 2HB LYS 48 -3.182 -8.054 10.566
368 1HG LYS 48 1HG LYS 48 -4.339 -8.605 12.443
369 2HG LYS 48 2HG LYS 48 -2.935 -9.541 12.916
370 1HD LYS 48 1HD LYS 48 -2.577 -6.686 13.529
371 2HD LYS 48 2HD LYS 48 -4.022 -7.325 14.289
372 1HE LYS 48 1HE LYS 48 -1.985 -9.309 14.642
373 2HE LYS 48 2HE LYS 48 -1.238 -7.768 15.012
374 1HZ LYS 48 1HZ LYS 48 -3.446 -7.424 16.363
375 H LYS 49 H LYS 49 -3.208 -9.945 9.799
376 HA LYS 49 HA LYS 49 -2.200 -12.657 10.254
377 1HB LYS 49 1HB LYS 49 -4.780 -11.506 11.141
378 2HB LYS 49 2HB LYS 49 -4.900 -13.045 10.314
379 1HG LYS 49 1HG LYS 49 -2.896 -13.762 11.890
380 2HG LYS 49 2HG LYS 49 -3.387 -12.385 12.858
381 1HD LYS 49 1HD LYS 49 -5.735 -13.316 12.930
382 2HD LYS 49 2HD LYS 49 -5.180 -14.722 12.043
383 1HE LYS 49 1HE LYS 49 -3.434 -15.055 13.925
384 2HE LYS 49 2HE LYS 49 -4.312 -13.836 14.830
385 1HZ LYS 49 1HZ LYS 49 -6.344 -15.361 14.266
386 H TYR 50 H TYR 50 -1.321 -11.895 8.036
387 HA TYR 50 HA TYR 50 -3.283 -12.754 6.045
388 1HB TYR 50 1HB TYR 50 -2.770 -10.124 6.398
389 2HB TYR 50 2HB TYR 50 -1.264 -10.504 5.585
390 HD1 TYR 50 HD1 TYR 50 -1.404 -9.511 3.476
391 HD2 TYR 50 HD2 TYR 50 -4.728 -11.777 4.931
392 HE1 TYR 50 HE1 TYR 50 -2.563 -9.269 1.227
393 HE2 TYR 50 HE2 TYR 50 -5.877 -11.527 2.677
394 HH TYR 50 HH TYR 50 -5.739 -9.759 0.775
395 H ASN 51 H ASN 51 0.130 -11.501 6.128
396 HA ASN 51 HA ASN 51 1.251 -14.015 5.784
397 1HB ASN 51 1HB ASN 51 0.416 -12.578 3.305
398 2HB ASN 51 2HB ASN 51 2.092 -13.091 3.292
399 1HD2 ASN 51 2HD2 ASN 51 2.298 -15.390 4.434
400 2HD2 ASN 51 1HD2 ASN 51 1.285 -16.620 3.754
401 HA PRO 52 HA PRO 52 3.906 -10.422 6.793
402 1HB PRO 52 1HB PRO 52 4.736 -11.247 9.263
403 2HB PRO 52 2HB PRO 52 3.366 -10.181 9.019
404 1HG PRO 52 1HG PRO 52 3.376 -13.052 9.723
405 2HG PRO 52 2HG PRO 52 2.079 -11.886 9.887
406 1HD PRO 52 1HD PRO 52 2.322 -13.908 7.869
407 2HD PRO 52 2HD PRO 52 1.087 -12.668 7.967
408 H THR 53 H THR 53 7.214 -11.433 6.563
409 HA THR 53 HA THR 53 5.207 -9.601 7.670
410 HB THR 53 HB THR 53 7.275 -9.871 8.984
411 HG1 THR 53 HG1 THR 53 7.441 -7.481 7.298
412 1HG2 THR 53 1HG2 THR 53 9.420 -8.915 7.852
413 2HG2 THR 53 2HG2 THR 53 8.599 -9.240 6.306
414 3HG2 THR 53 3HG2 THR 53 8.964 -10.581 7.420
415 H TRP 54 H TRP 54 5.133 -7.368 6.864
416 HA TRP 54 HA TRP 54 5.625 -7.361 3.965
417 1HB TRP 54 1HB TRP 54 3.543 -5.847 5.551
418 2HB TRP 54 2HB TRP 54 3.787 -5.753 3.817
419 HD1 TRP 54 HD TRP 54 2.806 -8.477 6.443
420 HE1 TRP 54 HE1 TRP 54 1.166 -10.244 5.371
421 HE3 TRP 54 HE3 TRP 54 2.943 -6.538 1.744
422 HZ2 TRP 54 HZ2 TRP 54 0.133 -10.626 2.737
423 HZ3 TRP 54 HZ3 TRP 54 1.590 -7.668 -0.019
424 HH2 TRP 54 HH TRP 54 0.219 -9.644 0.417
425 H HIS 55 H HIS 55 5.865 -4.920 3.185
426 HA HIS 55 HA HIS 55 7.322 -3.376 5.170
427 1HB HIS 55 1HB HIS 55 8.473 -4.156 2.476
428 2HB HIS 55 2HB HIS 55 9.180 -2.993 3.580
429 HD1 HIS 55 HD1 HIS 55 10.959 -3.935 5.051
430 HD2 HIS 55 HD2 HIS 55 8.182 -6.853 3.883
431 HE1 HIS 55 HE1 HIS 55 11.787 -6.141 6.029
432 H CYS 56 H CYS 56 6.284 -1.451 5.216
433 HA CYS 56 HA CYS 56 5.084 -0.541 2.717
434 1HB CYS 56 1HB CYS 56 3.864 -0.784 5.087
435 2HB CYS 56 2HB CYS 56 4.517 0.824 5.316
436 HG CYS 56 HG CYS 56 1.995 0.874 4.451
437 H ILE 57 H ILE 57 5.832 1.356 1.736
438 HA ILE 57 HA ILE 57 7.732 2.970 3.262
439 HB ILE 57 HB ILE 57 8.200 1.730 0.554
440 1HG1 ILE 57 1HG1 ILE 57 8.779 0.335 2.490
441 2HG1 ILE 57 2HG1 ILE 57 10.196 0.810 1.574
442 1HG2 ILE 57 1HG2 ILE 57 10.286 3.073 0.483
443 2HG2 ILE 57 2HG2 ILE 57 9.707 3.993 1.892
444 3HG2 ILE 57 3HG2 ILE 57 8.806 4.055 0.358
445 1HD1 ILE 57 1HD1 ILE 57 9.705 2.844 3.564
446 2HD1 ILE 57 2HD1 ILE 57 11.099 1.748 3.424
447 3HD1 ILE 57 3HD1 ILE 57 9.667 1.251 4.356
448 H VAL 58 H VAL 58 8.111 5.139 2.138
449 HA VAL 58 HA VAL 58 5.802 5.888 0.506
450 HB VAL 58 HB VAL 58 5.070 6.498 2.645
451 1HG1 VAL 58 1HG1 VAL 58 7.936 6.966 3.169
452 2HG1 VAL 58 2HG1 VAL 58 6.642 6.413 4.258
453 3HG1 VAL 58 3HG1 VAL 58 6.841 8.149 3.922
454 1HG2 VAL 58 1HG2 VAL 58 4.528 8.624 2.163
455 2HG2 VAL 58 2HG2 VAL 58 5.540 8.410 0.714
456 3HG2 VAL 58 3HG2 VAL 58 6.226 9.159 2.176
457 H GLY 59 H GLY 59 7.070 6.058 -1.361
458 1HA GLY 59 2HA GLY 59 9.489 7.703 -1.222
459 2HA GLY 59 1HA GLY 59 8.965 6.691 -2.553
460 H ARG 60 H ARG 60 7.797 7.585 -4.243
461 HA ARG 60 HA ARG 60 6.376 10.013 -3.786
462 1HB ARG 60 1HB ARG 60 7.608 11.166 -5.741
463 2HB ARG 60 2HB ARG 60 8.489 11.063 -4.230
464 1HG ARG 60 1HG ARG 60 9.218 8.677 -5.412
465 2HG ARG 60 2HG ARG 60 9.011 9.691 -6.826
466 1HD ARG 60 1HD ARG 60 10.425 11.432 -5.292
467 2HD ARG 60 2HD ARG 60 11.006 9.936 -4.589
468 HE ARG 60 HE ARG 60 12.102 9.409 -6.613
469 1HH1 ARG 60 2HH2 ARG 60 9.962 12.191 -7.094
470 2HH1 ARG 60 1HH2 ARG 60 10.604 12.571 -8.658
471 1HH2 ARG 60 1HH ARG 60 12.360 11.217 -9.567
472 H ASN 61 H ASN 61 7.728 7.602 -6.113
473 HA ASN 61 HA ASN 61 5.127 7.630 -7.414
474 1HB ASN 61 1HB ASN 61 7.343 8.681 -8.641
475 2HB ASN 61 2HB ASN 61 7.540 7.001 -9.097
476 1HD2 ASN 61 2HD2 ASN 61 5.536 5.903 -9.921
477 2HD2 ASN 61 1HD2 ASN 61 4.526 6.779 -11.020
478 H PHE 62 H PHE 62 8.342 5.921 -7.706
479 HA PHE 62 HA PHE 62 6.995 3.442 -6.934
480 1HB PHE 62 1HB PHE 62 8.048 4.269 -9.530
481 2HB PHE 62 2HB PHE 62 9.083 2.996 -8.914
482 HD1 PHE 62 HD1 PHE 62 6.248 3.633 -10.816
483 HD2 PHE 62 HD2 PHE 62 7.711 0.923 -7.897
484 HE1 PHE 62 HE1 PHE 62 4.589 1.914 -11.581
485 HE2 PHE 62 HE2 PHE 62 6.051 -0.798 -8.663
486 HZ PHE 62 HZ PHE 62 4.509 -0.282 -10.495
487 H GLY 63 H GLY 63 9.358 1.813 -7.446
488 1HA GLY 63 2HA GLY 63 11.778 2.361 -6.693
489 2HA GLY 63 1HA GLY 63 10.984 2.719 -5.173
490 H SER 64 H SER 64 12.930 0.515 -6.041
491 HA SER 64 HA SER 64 13.254 -1.615 -5.755
492 1HB SER 64 1HB SER 64 11.902 -2.704 -3.831
493 2HB SER 64 2HB SER 64 12.893 -1.313 -3.439
494 HG SER 64 HG SER 64 11.127 -0.071 -3.110
495 H TYR 65 H TYR 65 12.690 -2.580 -7.729
496 HA TYR 65 HA TYR 65 10.303 -4.161 -7.711
497 1HB TYR 65 1HB TYR 65 9.919 -1.621 -8.569
498 2HB TYR 65 2HB TYR 65 10.723 -2.195 -10.014
499 HD1 TYR 65 HD1 TYR 65 9.672 -3.951 -11.427
500 HD2 TYR 65 HD2 TYR 65 7.656 -2.284 -8.040
501 HE1 TYR 65 HE1 TYR 65 7.461 -4.868 -12.282
502 HE2 TYR 65 HE2 TYR 65 5.451 -3.208 -8.908
503 HH TYR 65 HH TYR 65 5.271 -5.551 -11.234
504 H VAL 66 H VAL 66 13.027 -2.759 -9.635
505 HA VAL 66 HA VAL 66 13.300 -5.390 -10.910
506 HB VAL 66 HB VAL 66 14.543 -2.840 -11.895
507 1HG1 VAL 66 1HG1 VAL 66 13.475 -5.011 -13.654
508 2HG1 VAL 66 2HG1 VAL 66 14.958 -5.334 -12.724
509 3HG1 VAL 66 3HG1 VAL 66 14.901 -3.966 -13.860
510 1HG2 VAL 66 1HG2 VAL 66 11.674 -3.727 -12.203
511 2HG2 VAL 66 2HG2 VAL 66 12.479 -2.743 -13.450
512 3HG2 VAL 66 3HG2 VAL 66 12.318 -2.117 -11.792
513 H THR 67 H THR 67 14.161 -5.137 -8.255
514 HA THR 67 HA THR 67 16.973 -5.643 -8.617
515 HB THR 67 HB THR 67 15.918 -3.089 -7.483
516 HG1 THR 67 HG1 THR 67 17.402 -3.366 -9.329
517 1HG2 THR 67 1HG2 THR 67 18.086 -3.027 -6.024
518 2HG2 THR 67 2HG2 THR 67 18.012 -4.806 -6.080
519 3HG2 THR 67 3HG2 THR 67 16.678 -3.883 -5.346
520 H HIS 68 H HIS 68 14.761 -4.787 -5.870
521 HA HIS 68 HA HIS 68 15.502 -7.377 -4.735
522 1HB HIS 68 1HB HIS 68 14.718 -4.734 -3.534
523 2HB HIS 68 2HB HIS 68 14.475 -6.211 -2.623
524 HD1 HIS 68 HD1 HIS 68 16.936 -7.815 -2.895
525 HD2 HIS 68 HD2 HIS 68 17.080 -3.625 -2.778
526 HE1 HIS 68 HE1 HIS 68 19.304 -7.202 -2.176
527 H GLU 69 H GLU 69 13.749 -7.688 -6.765
528 HA GLU 69 HA GLU 69 11.165 -7.237 -6.556
529 1HB GLU 69 1HB GLU 69 12.501 -9.889 -7.246
530 2HB GLU 69 2HB GLU 69 10.808 -9.560 -7.554
531 1HG GLU 69 1HG GLU 69 11.379 -7.680 -9.030
532 2HG GLU 69 2HG GLU 69 13.076 -7.810 -8.613
533 HE2 GLU 69 HE GLU 69 10.794 -8.737 -10.690
534 H THR 70 H THR 70 9.268 -8.331 -5.629
535 HA THR 70 HA THR 70 9.906 -9.886 -3.213
536 HB THR 70 HB THR 70 8.239 -8.552 -1.998
537 HG1 THR 70 HG1 THR 70 8.049 -7.183 -4.588
538 1HG2 THR 70 1HG2 THR 70 10.388 -7.089 -3.517
539 2HG2 THR 70 2HG2 THR 70 10.120 -7.190 -1.760
540 3HG2 THR 70 3HG2 THR 70 9.125 -6.095 -2.750
541 H ARG 71 H ARG 71 6.927 -9.871 -2.643
542 HA ARG 71 HA ARG 71 6.325 -11.903 -4.635
543 1HB ARG 71 1HB ARG 71 5.523 -11.590 -1.711
544 2HB ARG 71 2HB ARG 71 4.641 -12.667 -2.777
545 1HG ARG 71 1HG ARG 71 7.669 -12.832 -2.514
546 2HG ARG 71 2HG ARG 71 6.611 -13.669 -1.395
547 1HD ARG 71 1HD ARG 71 5.787 -15.136 -3.044
548 2HD ARG 71 2HD ARG 71 6.114 -14.021 -4.356
549 HE ARG 71 HE ARG 71 8.352 -14.777 -4.444
550 1HH1 ARG 71 2HH2 ARG 71 6.744 -16.090 -1.572
551 2HH1 ARG 71 1HH2 ARG 71 8.016 -17.214 -1.223
552 1HH2 ARG 71 1HH ARG 71 9.935 -17.298 -2.655
553 H HIS 72 H HIS 72 4.513 -9.756 -2.306
554 HA HIS 72 HA HIS 72 2.781 -9.035 -4.557
555 1HB HIS 72 1HB HIS 72 2.114 -10.240 -1.974
556 2HB HIS 72 2HB HIS 72 1.224 -8.760 -2.271
557 HD1 HIS 72 HD1 HIS 72 0.702 -12.183 -2.631
558 HD2 HIS 72 HD2 HIS 72 0.283 -8.972 -5.298
559 HE1 HIS 72 HE1 HIS 72 -0.899 -12.973 -4.454
560 H PHE 73 H PHE 73 3.154 -6.940 -5.067
561 HA PHE 73 HA PHE 73 3.598 -5.109 -2.815
562 1HB PHE 73 1HB PHE 73 4.954 -3.849 -4.685
563 2HB PHE 73 2HB PHE 73 5.694 -5.281 -4.000
564 HD1 PHE 73 HD1 PHE 73 6.127 -7.200 -5.334
565 HD2 PHE 73 HD2 PHE 73 3.853 -3.990 -6.926
566 HE1 PHE 73 HE1 PHE 73 6.322 -8.199 -7.628
567 HE2 PHE 73 HE2 PHE 73 4.048 -4.989 -9.220
568 HZ PHE 73 HZ PHE 73 5.281 -7.082 -9.543
569 H ILE 74 H ILE 74 2.987 -2.801 -3.323
570 HA ILE 74 HA ILE 74 1.269 -2.365 -5.561
571 HB ILE 74 HB ILE 74 -0.506 -3.308 -4.552
572 1HG1 ILE 74 1HG1 ILE 74 -0.524 -0.672 -3.057
573 2HG1 ILE 74 2HG1 ILE 74 -0.906 -0.838 -4.759
574 1HG2 ILE 74 1HG2 ILE 74 0.876 -2.747 -1.931
575 2HG2 ILE 74 2HG2 ILE 74 0.471 -4.312 -2.677
576 3HG2 ILE 74 3HG2 ILE 74 -0.820 -3.284 -2.009
577 1HD1 ILE 74 1HD1 ILE 74 -2.581 -1.399 -2.439
578 2HD1 ILE 74 2HD1 ILE 74 -2.453 -2.836 -3.481
579 3HD1 ILE 74 3HD1 ILE 74 -3.040 -1.298 -4.155
580 H TYR 75 H TYR 75 2.232 -0.490 -6.171
581 HA TYR 75 HA TYR 75 2.793 1.459 -4.048
582 1HB TYR 75 1HB TYR 75 4.392 0.354 -6.009
583 2HB TYR 75 2HB TYR 75 3.707 1.675 -6.935
584 HD1 TYR 75 HD1 TYR 75 3.558 3.847 -4.932
585 HD2 TYR 75 HD2 TYR 75 6.620 0.938 -5.618
586 HE1 TYR 75 HE1 TYR 75 5.290 5.427 -3.950
587 HE2 TYR 75 HE2 TYR 75 8.342 2.528 -4.632
588 HH TYR 75 HH TYR 75 8.303 4.428 -2.993
589 H PHE 76 H PHE 76 1.015 2.761 -3.796
590 HA PHE 76 HA PHE 76 0.057 4.049 -6.246
591 1HB PHE 76 1HB PHE 76 -2.244 3.929 -5.099
592 2HB PHE 76 2HB PHE 76 -1.615 2.368 -5.587
593 HD1 PHE 76 HD1 PHE 76 -0.138 1.176 -3.699
594 HD2 PHE 76 HD2 PHE 76 -3.119 4.109 -2.976
595 HE1 PHE 76 HE1 PHE 76 -0.391 0.338 -1.347
596 HE2 PHE 76 HE2 PHE 76 -3.372 3.271 -0.623
597 HZ PHE 76 HZ PHE 76 -2.006 1.396 0.163
598 H TYR 77 H TYR 77 -1.593 5.947 -5.372
599 HA TYR 77 HA TYR 77 0.064 7.447 -3.470
600 1HB TYR 77 1HB TYR 77 -0.587 8.080 -5.995
601 2HB TYR 77 2HB TYR 77 -2.162 8.453 -5.322
602 HD1 TYR 77 HD1 TYR 77 1.363 9.121 -4.194
603 HD2 TYR 77 HD2 TYR 77 -2.481 10.738 -5.145
604 HE1 TYR 77 HE1 TYR 77 2.177 11.445 -3.561
605 HE2 TYR 77 HE2 TYR 77 -1.656 13.056 -4.509
606 HH TYR 77 HH TYR 77 1.173 14.007 -4.458
607 H LEU 78 H LEU 78 -0.766 8.157 -1.543
608 HA LEU 78 HA LEU 78 -3.631 7.648 -1.132
609 1HB LEU 78 1HB LEU 78 -1.241 7.194 0.616
610 2HB LEU 78 2HB LEU 78 -2.802 7.519 1.341
611 HG LEU 78 HG LEU 78 -2.101 5.215 -0.496
612 1HD1 LEU 78 1HD1 LEU 78 -3.226 4.598 2.125
613 2HD1 LEU 78 2HD1 LEU 78 -1.694 5.499 2.229
614 3HD1 LEU 78 3HD1 LEU 78 -1.767 3.969 1.321
615 1HD2 LEU 78 1HD2 LEU 78 -4.554 4.580 0.438
616 2HD2 LEU 78 2HD2 LEU 78 -4.260 5.378 -1.126
617 3HD2 LEU 78 3HD2 LEU 78 -4.719 6.346 0.297
618 H GLY 79 H GLY 79 -4.690 9.558 -1.279
619 1HA GLY 79 2HA GLY 79 -5.305 11.658 -0.738
620 2HA GLY 79 1HA GLY 79 -4.132 11.640 0.565
621 H GLN 80 H GLN 80 -1.983 12.435 0.229
622 HA GLN 80 HA GLN 80 -1.520 13.566 -2.407
623 1HB GLN 80 1HB GLN 80 -0.776 15.693 -1.445
624 2HB GLN 80 2HB GLN 80 -2.427 15.372 -0.958
625 1HG GLN 80 1HG GLN 80 -1.771 15.636 1.197
626 2HG GLN 80 2HG GLN 80 -0.874 14.138 1.050
627 1HE2 GLN 80 2HE2 GLN 80 0.638 14.952 2.534
628 2HE2 GLN 80 1HE2 GLN 80 1.874 16.074 2.072
629 H VAL 81 H VAL 81 -0.563 11.191 -0.683
630 HA VAL 81 HA VAL 81 2.284 11.801 -0.984
631 HB VAL 81 HB VAL 81 2.659 10.402 1.072
632 1HG1 VAL 81 1HG1 VAL 81 1.629 12.413 2.573
633 2HG1 VAL 81 2HG1 VAL 81 1.584 13.166 0.962
634 3HG1 VAL 81 3HG1 VAL 81 3.123 12.553 1.615
635 1HG2 VAL 81 1HG2 VAL 81 0.931 9.934 2.596
636 2HG2 VAL 81 2HG2 VAL 81 0.249 9.497 1.011
637 3HG2 VAL 81 3HG2 VAL 81 -0.209 11.033 1.784
638 H ALA 82 H ALA 82 3.567 9.610 -0.921
639 HA ALA 82 HA ALA 82 2.096 7.804 -2.686
640 1HB ALA 82 1HB ALA 82 4.007 8.096 -3.856
641 2HB ALA 82 2HB ALA 82 4.766 7.028 -2.649
642 3HB ALA 82 3HB ALA 82 4.853 8.795 -2.454
643 H ILE 83 H ILE 83 2.585 5.409 -2.411
644 HA ILE 83 HA ILE 83 3.402 4.607 0.223
645 HB ILE 83 HB ILE 83 1.051 5.319 0.541
646 1HG1 ILE 83 1HG1 ILE 83 0.387 2.803 1.317
647 2HG1 ILE 83 2HG1 ILE 83 2.113 2.606 1.091
648 1HG2 ILE 83 1HG2 ILE 83 -0.725 3.785 -0.377
649 2HG2 ILE 83 2HG2 ILE 83 0.509 3.143 -1.489
650 3HG2 ILE 83 3HG2 ILE 83 0.049 4.862 -1.565
651 1HD1 ILE 83 1HD1 ILE 83 0.833 4.825 2.753
652 2HD1 ILE 83 2HD1 ILE 83 2.577 4.508 2.589
653 3HD1 ILE 83 3HD1 ILE 83 1.532 3.328 3.415
654 H LEU 84 H LEU 84 4.513 2.731 0.018
655 HA LEU 84 HA LEU 84 3.811 1.033 -2.268
656 1HB LEU 84 1HB LEU 84 5.722 2.163 -3.009
657 2HB LEU 84 2HB LEU 84 6.503 2.078 -1.442
658 HG LEU 84 HG LEU 84 6.698 -0.410 -1.741
659 1HD1 LEU 84 1HD1 LEU 84 5.103 0.194 -4.100
660 2HD1 LEU 84 2HD1 LEU 84 5.433 -1.363 -3.303
661 3HD1 LEU 84 3HD1 LEU 84 6.580 -0.716 -4.500
662 1HD2 LEU 84 1HD2 LEU 84 8.182 0.495 -4.071
663 2HD2 LEU 84 2HD2 LEU 84 8.764 -0.038 -2.476
664 3HD2 LEU 84 3HD2 LEU 84 8.282 1.656 -2.726
665 H LEU 85 H LEU 85 2.932 -0.769 -1.397
666 HA LEU 85 HA LEU 85 4.189 -1.780 1.057
667 1HB LEU 85 1HB LEU 85 1.765 -0.998 1.088
668 2HB LEU 85 2HB LEU 85 1.403 -2.388 0.086
669 HG LEU 85 HG LEU 85 2.893 -3.386 2.270
670 1HD1 LEU 85 1HD1 LEU 85 1.015 -2.560 4.014
671 2HD1 LEU 85 2HD1 LEU 85 1.177 -1.089 3.024
672 3HD1 LEU 85 3HD1 LEU 85 2.604 -1.782 3.832
673 1HD2 LEU 85 1HD2 LEU 85 -0.075 -3.601 2.287
674 2HD2 LEU 85 2HD2 LEU 85 1.176 -4.860 2.432
675 3HD2 LEU 85 3HD2 LEU 85 0.781 -4.178 0.837
676 H PHE 86 H PHE 86 5.373 -3.601 0.865
677 HA PHE 86 HA PHE 86 4.597 -5.501 -1.202
678 1HB PHE 86 1HB PHE 86 7.052 -5.625 -1.848
679 2HB PHE 86 2HB PHE 86 6.362 -4.051 -2.190
680 HD1 PHE 86 HD1 PHE 86 9.059 -5.729 -0.705
681 HD2 PHE 86 HD2 PHE 86 6.629 -2.280 -0.244
682 HE1 PHE 86 HE1 PHE 86 10.860 -4.643 0.663
683 HE2 PHE 86 HE2 PHE 86 8.431 -1.195 1.124
684 HZ PHE 86 HZ PHE 86 10.525 -2.389 1.561
685 H LYS 87 H LYS 87 4.999 -7.660 -0.649
686 HA LYS 87 HA LYS 87 5.829 -8.030 2.115
687 1HB LYS 87 1HB LYS 87 3.705 -9.017 0.759
688 2HB LYS 87 2HB LYS 87 4.850 -10.314 0.486
689 1HG LYS 87 1HG LYS 87 4.421 -9.161 3.269
690 2HG LYS 87 2HG LYS 87 3.366 -10.409 2.636
691 1HD LYS 87 1HD LYS 87 6.393 -10.739 2.624
692 2HD LYS 87 2HD LYS 87 5.437 -11.159 4.031
693 1HE LYS 87 1HE LYS 87 4.821 -13.130 3.090
694 2HE LYS 87 2HE LYS 87 4.169 -12.304 1.688
695 1HZ LYS 87 1HZ LYS 87 6.511 -13.808 1.801
696 H SER 88 H SER 88 7.980 -8.258 2.436
697 HA SER 88 HA SER 88 9.348 -10.005 0.545
698 1HB SER 88 1HB SER 88 9.952 -7.545 0.297
699 2HB SER 88 2HB SER 88 10.590 -7.589 1.927
700 HG SER 88 HG SER 88 11.957 -9.462 1.108
701 H GLY 89 H GLY 89 10.780 -11.538 1.478
702 1HA GLY 89 2HA GLY 89 10.284 -12.316 4.128
703 2HA GLY 89 1HA GLY 89 11.558 -12.909 3.080
Start of MODEL 9
1 1H MET 1 H MET 1 -19.886 13.254 -15.080
2 HA MET 1 HA MET 1 -17.875 14.464 -14.374
3 1HB MET 1 1HB MET 1 -19.563 12.697 -12.916
4 2HB MET 1 2HB MET 1 -17.948 12.301 -12.361
5 1HG MET 1 1HG MET 1 -17.734 14.999 -12.252
6 2HG MET 1 2HG MET 1 -19.474 14.884 -12.081
7 1HE MET 1 1HE MET 1 -19.544 15.852 -9.668
8 2HE MET 1 2HE MET 1 -18.408 15.370 -8.385
9 3HE MET 1 3HE MET 1 -17.802 16.162 -9.859
10 H SER 2 H SER 2 -15.727 14.030 -13.137
11 HA SER 2 HA SER 2 -14.441 11.626 -14.098
12 1HB SER 2 1HB SER 2 -13.814 14.412 -14.966
13 2HB SER 2 2HB SER 2 -12.425 13.441 -14.520
14 HG SER 2 HG SER 2 -12.648 12.856 -16.607
15 H ASP 3 H ASP 3 -14.280 10.860 -11.942
16 HA ASP 3 HA ASP 3 -12.824 12.625 -10.141
17 1HB ASP 3 1HB ASP 3 -13.826 11.430 -8.310
18 2HB ASP 3 2HB ASP 3 -15.119 11.757 -9.449
19 HD2 ASP 3 HD ASP 3 -13.397 9.075 -7.977
20 H ARG 4 H ARG 4 -11.131 11.525 -8.755
21 HA ARG 4 HA ARG 4 -10.316 8.942 -9.744
22 1HB ARG 4 1HB ARG 4 -8.681 11.495 -9.899
23 2HB ARG 4 2HB ARG 4 -7.856 9.964 -9.678
24 1HG ARG 4 1HG ARG 4 -8.317 9.246 -11.816
25 2HG ARG 4 2HG ARG 4 -9.932 9.927 -11.810
26 1HD ARG 4 1HD ARG 4 -8.940 11.377 -13.331
27 2HD ARG 4 2HD ARG 4 -8.590 12.255 -11.856
28 HE ARG 4 HE ARG 4 -6.310 11.622 -12.012
29 1HH1 ARG 4 2HH2 ARG 4 -8.229 9.952 -14.479
30 2HH1 ARG 4 1HH2 ARG 4 -6.843 9.403 -15.362
31 1HH2 ARG 4 1HH ARG 4 -4.650 9.972 -14.579
32 H LYS 5 H LYS 5 -11.580 9.769 -7.266
33 HA LYS 5 HA LYS 5 -9.953 10.408 -5.184
34 1HB LYS 5 1HB LYS 5 -12.560 9.263 -5.569
35 2HB LYS 5 2HB LYS 5 -11.757 8.406 -4.269
36 1HG LYS 5 1HG LYS 5 -11.258 10.533 -3.114
37 2HG LYS 5 2HG LYS 5 -11.924 11.451 -4.451
38 1HD LYS 5 1HD LYS 5 -14.165 10.453 -4.055
39 2HD LYS 5 2HD LYS 5 -13.516 9.461 -2.764
40 1HE LYS 5 1HE LYS 5 -13.429 11.216 -1.266
41 2HE LYS 5 2HE LYS 5 -12.953 12.378 -2.488
42 1HZ LYS 5 1HZ LYS 5 -15.300 12.280 -3.314
43 H ALA 6 H ALA 6 -8.205 9.528 -4.208
44 HA ALA 6 HA ALA 6 -6.587 8.097 -3.728
45 1HB ALA 6 1HB ALA 6 -8.626 5.871 -4.049
46 2HB ALA 6 2HB ALA 6 -8.623 6.974 -2.652
47 3HB ALA 6 3HB ALA 6 -7.217 5.929 -2.962
48 H VAL 7 H VAL 7 -5.122 8.232 -5.398
49 HA VAL 7 HA VAL 7 -5.729 6.887 -7.887
50 HB VAL 7 HB VAL 7 -3.416 8.589 -6.942
51 1HG1 VAL 7 1HG1 VAL 7 -2.648 8.617 -9.263
52 2HG1 VAL 7 2HG1 VAL 7 -3.961 7.508 -9.729
53 3HG1 VAL 7 3HG1 VAL 7 -2.674 6.951 -8.634
54 1HG2 VAL 7 1HG2 VAL 7 -4.478 10.392 -7.794
55 2HG2 VAL 7 2HG2 VAL 7 -5.939 9.399 -7.563
56 3HG2 VAL 7 3HG2 VAL 7 -5.160 9.478 -9.162
57 H ILE 8 H ILE 8 -4.168 5.339 -8.856
58 HA ILE 8 HA ILE 8 -2.511 3.967 -6.891
59 HB ILE 8 HB ILE 8 -4.962 2.898 -8.174
60 1HG1 ILE 8 1HG1 ILE 8 -4.388 1.427 -5.919
61 2HG1 ILE 8 2HG1 ILE 8 -3.676 2.979 -5.527
62 1HG2 ILE 8 1HG2 ILE 8 -3.309 1.568 -9.321
63 2HG2 ILE 8 2HG2 ILE 8 -4.087 0.579 -8.062
64 3HG2 ILE 8 3HG2 ILE 8 -2.455 1.240 -7.795
65 1HD1 ILE 8 1HD1 ILE 8 -5.752 3.723 -5.010
66 2HD1 ILE 8 2HD1 ILE 8 -6.490 2.234 -5.648
67 3HD1 ILE 8 3HD1 ILE 8 -6.164 3.606 -6.737
68 H LYS 9 H LYS 9 -0.585 3.289 -7.749
69 HA LYS 9 HA LYS 9 -0.185 3.921 -10.552
70 1HB LYS 9 1HB LYS 9 1.442 3.884 -8.126
71 2HB LYS 9 2HB LYS 9 2.238 3.075 -9.462
72 1HG LYS 9 1HG LYS 9 2.193 5.010 -10.839
73 2HG LYS 9 2HG LYS 9 0.894 5.753 -9.928
74 1HD LYS 9 1HD LYS 9 3.668 5.250 -8.757
75 2HD LYS 9 2HD LYS 9 3.221 6.751 -9.542
76 1HE LYS 9 1HE LYS 9 1.125 6.207 -7.686
77 2HE LYS 9 2HE LYS 9 2.615 5.849 -6.834
78 1HZ LYS 9 1HZ LYS 9 3.434 8.071 -7.522
79 H ASN 10 H ASN 10 1.557 1.357 -8.780
80 HA ASN 10 HA ASN 10 0.523 -0.485 -10.789
81 1HB ASN 10 1HB ASN 10 3.053 0.025 -10.702
82 2HB ASN 10 2HB ASN 10 3.088 -0.771 -9.141
83 1HD2 ASN 10 2HD2 ASN 10 4.674 -1.796 -10.952
84 2HD2 ASN 10 1HD2 ASN 10 4.095 -3.291 -11.609
85 H ALA 11 H ALA 11 -1.092 -1.741 -9.824
86 HA ALA 11 HA ALA 11 -0.478 -2.859 -7.183
87 1HB ALA 11 1HB ALA 11 -3.329 -2.269 -7.770
88 2HB ALA 11 2HB ALA 11 -2.293 -0.844 -7.521
89 3HB ALA 11 3HB ALA 11 -2.410 -2.089 -6.257
90 H ASP 12 H ASP 12 -2.752 -2.990 -10.020
91 HA ASP 12 HA ASP 12 -3.603 -4.656 -11.116
92 1HB ASP 12 1HB ASP 12 -0.885 -5.724 -10.370
93 2HB ASP 12 2HB ASP 12 -2.025 -6.853 -11.074
94 HD2 ASP 12 HD ASP 12 -1.162 -3.447 -12.572
95 H MET 13 H MET 13 -1.875 -7.086 -9.160
96 HA MET 13 HA MET 13 -2.800 -8.847 -8.148
97 1HB MET 13 1HB MET 13 -2.275 -6.728 -6.519
98 2HB MET 13 2HB MET 13 -3.989 -6.875 -6.182
99 1HG MET 13 1HG MET 13 -3.041 -8.293 -4.552
100 2HG MET 13 2HG MET 13 -3.478 -9.430 -5.812
101 1HE MET 13 1HE MET 13 -1.127 -11.192 -6.838
102 2HE MET 13 2HE MET 13 -0.613 -11.340 -5.140
103 3HE MET 13 3HE MET 13 -2.335 -11.125 -5.532
104 H SER 14 H SER 14 -5.138 -8.461 -6.155
105 HA SER 14 HA SER 14 -7.237 -8.570 -8.178
106 1HB SER 14 1HB SER 14 -7.053 -10.795 -7.406
107 2HB SER 14 2HB SER 14 -6.699 -10.304 -5.760
108 HG SER 14 HG SER 14 -9.146 -10.788 -6.962
109 H GLU 15 H GLU 15 -9.144 -7.398 -7.753
110 HA GLU 15 HA GLU 15 -9.068 -5.183 -6.298
111 1HB GLU 15 1HB GLU 15 -10.955 -6.391 -7.839
112 2HB GLU 15 2HB GLU 15 -11.713 -6.591 -6.270
113 1HG GLU 15 1HG GLU 15 -11.570 -4.162 -5.843
114 2HG GLU 15 2HG GLU 15 -10.677 -3.918 -7.330
115 HE2 GLU 15 HE GLU 15 -13.920 -2.984 -8.108
116 H GLU 16 H GLU 16 -9.445 -8.458 -5.069
117 HA GLU 16 HA GLU 16 -10.684 -7.882 -2.670
118 1HB GLU 16 1HB GLU 16 -9.467 -10.137 -3.948
119 2HB GLU 16 2HB GLU 16 -8.768 -10.029 -2.345
120 1HG GLU 16 1HG GLU 16 -11.017 -9.984 -1.321
121 2HG GLU 16 2HG GLU 16 -11.771 -9.951 -2.902
122 HE2 GLU 16 HE GLU 16 -12.022 -13.343 -2.472
123 H MET 17 H MET 17 -7.147 -8.237 -3.445
124 HA MET 17 HA MET 17 -6.471 -7.282 -0.843
125 1HB MET 17 1HB MET 17 -4.791 -7.866 -3.346
126 2HB MET 17 2HB MET 17 -4.109 -7.511 -1.771
127 1HG MET 17 1HG MET 17 -4.137 -9.804 -1.548
128 2HG MET 17 2HG MET 17 -5.795 -9.531 -1.056
129 1HE MET 17 1HE MET 17 -4.634 -12.261 -2.267
130 2HE MET 17 2HE MET 17 -6.311 -12.043 -1.712
131 3HE MET 17 3HE MET 17 -5.989 -12.735 -3.320
132 H GLN 18 H GLN 18 -6.665 -6.016 -4.180
133 HA GLN 18 HA GLN 18 -5.197 -3.695 -3.689
134 1HB GLN 18 1HB GLN 18 -5.451 -4.239 -5.962
135 2HB GLN 18 2HB GLN 18 -7.160 -4.594 -5.800
136 1HG GLN 18 1HG GLN 18 -7.127 -2.503 -6.923
137 2HG GLN 18 2HG GLN 18 -7.470 -2.071 -5.258
138 1HE2 GLN 18 2HE2 GLN 18 -5.428 -1.784 -3.875
139 2HE2 GLN 18 1HE2 GLN 18 -4.166 -0.808 -4.552
140 H GLN 19 H GLN 19 -8.732 -4.453 -3.584
141 HA GLN 19 HA GLN 19 -9.440 -1.808 -2.943
142 1HB GLN 19 1HB GLN 19 -10.890 -3.709 -3.969
143 2HB GLN 19 2HB GLN 19 -11.099 -4.278 -2.326
144 1HG GLN 19 1HG GLN 19 -11.970 -1.615 -3.508
145 2HG GLN 19 2HG GLN 19 -12.972 -2.838 -2.751
146 1HE2 GLN 19 2HE2 GLN 19 -11.186 -0.007 -2.342
147 2HE2 GLN 19 1HE2 GLN 19 -11.239 0.136 -0.616
148 H ASP 20 H ASP 20 -8.973 -4.844 -1.027
149 HA ASP 20 HA ASP 20 -9.765 -3.794 1.391
150 1HB ASP 20 1HB ASP 20 -9.347 -6.221 0.881
151 2HB ASP 20 2HB ASP 20 -7.625 -5.903 0.830
152 HD2 ASP 20 HD ASP 20 -6.840 -5.825 3.756
153 H ALA 21 H ALA 21 -6.544 -3.984 -0.265
154 HA ALA 21 HA ALA 21 -5.055 -2.891 1.851
155 1HB ALA 21 1HB ALA 21 -4.538 -2.938 -1.150
156 2HB ALA 21 2HB ALA 21 -4.091 -4.213 0.008
157 3HB ALA 21 3HB ALA 21 -3.322 -2.612 0.109
158 H VAL 22 H VAL 22 -6.046 -1.372 -1.305
159 HA VAL 22 HA VAL 22 -5.333 1.193 -0.653
160 HB VAL 22 HB VAL 22 -6.127 0.127 -2.852
161 1HG1 VAL 22 1HG1 VAL 22 -8.309 -0.216 -3.266
162 2HG1 VAL 22 2HG1 VAL 22 -8.787 1.327 -2.518
163 3HG1 VAL 22 3HG1 VAL 22 -8.525 -0.112 -1.503
164 1HG2 VAL 22 1HG2 VAL 22 -5.861 2.201 -3.632
165 2HG2 VAL 22 2HG2 VAL 22 -5.930 2.789 -1.954
166 3HG2 VAL 22 3HG2 VAL 22 -7.414 2.718 -2.933
167 H ASP 23 H ASP 23 -7.991 -0.770 0.539
168 HA ASP 23 HA ASP 23 -9.696 1.294 1.262
169 1HB ASP 23 1HB ASP 23 -9.430 -1.577 1.697
170 2HB ASP 23 2HB ASP 23 -9.902 -0.803 3.197
171 HD2 ASP 23 HD ASP 23 -11.525 -2.322 2.493
172 H CYS 24 H CYS 24 -7.543 -0.782 3.361
173 HA CYS 24 HA CYS 24 -7.733 0.813 5.607
174 1HB CYS 24 1HB CYS 24 -5.826 -1.307 4.682
175 2HB CYS 24 2HB CYS 24 -5.384 -0.344 6.078
176 HG CYS 24 HG CYS 24 -7.204 -2.816 5.865
177 H ALA 25 H ALA 25 -5.782 1.034 2.644
178 HA ALA 25 HA ALA 25 -3.809 2.781 3.625
179 1HB ALA 25 1HB ALA 25 -3.068 2.774 1.447
180 2HB ALA 25 2HB ALA 25 -4.708 2.911 0.771
181 3HB ALA 25 3HB ALA 25 -4.123 1.342 1.377
182 H THR 26 H THR 26 -6.446 3.614 1.271
183 HA THR 26 HA THR 26 -6.334 6.325 1.615
184 HB THR 26 HB THR 26 -8.422 4.311 0.763
185 HG1 THR 26 HG1 THR 26 -8.048 5.737 -1.162
186 1HG2 THR 26 1HG2 THR 26 -9.848 6.019 1.808
187 2HG2 THR 26 2HG2 THR 26 -9.849 6.295 0.050
188 3HG2 THR 26 3HG2 THR 26 -8.856 7.323 1.110
189 H GLN 27 H GLN 27 -8.125 3.921 3.603
190 HA GLN 27 HA GLN 27 -9.483 5.818 5.101
191 1HB GLN 27 1HB GLN 27 -8.634 2.959 5.720
192 2HB GLN 27 2HB GLN 27 -9.654 3.895 6.794
193 1HG GLN 27 1HG GLN 27 -11.370 4.143 5.067
194 2HG GLN 27 2HG GLN 27 -10.323 3.438 3.852
195 1HE2 GLN 27 2HE2 GLN 27 -12.866 2.853 5.792
196 2HE2 GLN 27 1HE2 GLN 27 -12.779 1.135 5.981
197 H ALA 28 H ALA 28 -6.256 4.267 5.489
198 HA ALA 28 HA ALA 28 -5.674 5.132 8.042
199 1HB ALA 28 1HB ALA 28 -4.337 3.509 6.772
200 2HB ALA 28 2HB ALA 28 -3.314 4.855 7.325
201 3HB ALA 28 3HB ALA 28 -3.849 4.781 5.628
202 H LEU 29 H LEU 29 -5.084 6.774 4.858
203 HA LEU 29 HA LEU 29 -3.969 9.074 6.033
204 1HB LEU 29 1HB LEU 29 -3.553 8.387 3.738
205 2HB LEU 29 2HB LEU 29 -5.243 8.620 3.330
206 HG LEU 29 HG LEU 29 -3.923 11.004 4.470
207 1HD1 LEU 29 1HD1 LEU 29 -2.174 11.207 3.122
208 2HD1 LEU 29 2HD1 LEU 29 -3.177 10.883 1.688
209 3HD1 LEU 29 3HD1 LEU 29 -2.446 9.531 2.586
210 1HD2 LEU 29 1HD2 LEU 29 -5.032 11.909 2.268
211 2HD2 LEU 29 2HD2 LEU 29 -6.027 11.467 3.675
212 3HD2 LEU 29 3HD2 LEU 29 -5.880 10.345 2.303
213 H GLU 30 H GLU 30 -7.203 7.844 5.854
214 HA GLU 30 HA GLU 30 -8.279 10.511 6.228
215 1HB GLU 30 1HB GLU 30 -9.210 8.238 4.837
216 2HB GLU 30 2HB GLU 30 -10.238 8.331 6.254
217 1HG GLU 30 1HG GLU 30 -9.719 10.932 4.869
218 2HG GLU 30 2HG GLU 30 -10.668 9.772 3.961
219 HE2 GLU 30 HE GLU 30 -12.107 11.817 6.947
220 H LYS 31 H LYS 31 -6.741 8.436 8.144
221 HA LYS 31 HA LYS 31 -8.564 8.936 10.384
222 1HB LYS 31 1HB LYS 31 -8.917 6.653 10.034
223 2HB LYS 31 2HB LYS 31 -7.253 6.349 9.584
224 1HG LYS 31 1HG LYS 31 -6.490 6.388 11.811
225 2HG LYS 31 2HG LYS 31 -7.807 7.408 12.358
226 1HD LYS 31 1HD LYS 31 -9.357 5.375 11.772
227 2HD LYS 31 2HD LYS 31 -7.879 4.434 11.730
228 1HE LYS 31 1HE LYS 31 -8.216 6.202 14.125
229 2HE LYS 31 2HE LYS 31 -9.343 4.865 14.008
230 1HZ LYS 31 1HZ LYS 31 -7.596 3.785 14.984
231 H TYR 32 H TYR 32 -5.212 8.189 9.254
232 HA TYR 32 HA TYR 32 -4.222 9.566 11.652
233 1HB TYR 32 1HB TYR 32 -3.245 7.484 9.639
234 2HB TYR 32 2HB TYR 32 -2.045 8.421 10.506
235 HD1 TYR 32 HD1 TYR 32 -4.463 5.713 10.713
236 HD2 TYR 32 HD2 TYR 32 -1.879 8.242 12.999
237 HE1 TYR 32 HE1 TYR 32 -4.624 4.112 12.681
238 HE2 TYR 32 HE2 TYR 32 -2.049 6.633 14.959
239 HH TYR 32 HH TYR 32 -4.053 4.822 15.632
240 H ASN 33 H ASN 33 -2.284 10.983 11.353
241 HA ASN 33 HA ASN 33 -2.511 12.345 8.787
242 1HB ASN 33 1HB ASN 33 -2.988 13.435 11.249
243 2HB ASN 33 2HB ASN 33 -1.259 13.712 11.163
244 1HD2 ASN 33 2HD2 ASN 33 -4.171 13.945 9.125
245 2HD2 ASN 33 1HD2 ASN 33 -3.796 15.462 8.376
246 H ILE 34 H ILE 34 -0.569 10.398 10.845
247 HA ILE 34 HA ILE 34 1.940 11.496 9.842
248 HB ILE 34 HB ILE 34 1.629 9.226 11.785
249 1HG1 ILE 34 1HG1 ILE 34 2.085 11.581 13.255
250 2HG1 ILE 34 2HG1 ILE 34 0.764 11.967 12.171
251 1HG2 ILE 34 1HG2 ILE 34 3.787 10.574 12.597
252 2HG2 ILE 34 2HG2 ILE 34 3.807 11.040 10.879
253 3HG2 ILE 34 3HG2 ILE 34 3.852 9.320 11.335
254 1HD1 ILE 34 1HD1 ILE 34 -0.435 11.004 13.911
255 2HD1 ILE 34 2HD1 ILE 34 0.892 9.905 14.357
256 3HD1 ILE 34 3HD1 ILE 34 -0.121 9.548 12.937
257 H GLU 35 H GLU 35 2.403 10.835 7.800
258 HA GLU 35 HA GLU 35 1.366 8.656 6.569
259 1HB GLU 35 1HB GLU 35 3.500 10.577 6.085
260 2HB GLU 35 2HB GLU 35 3.984 8.997 5.503
261 1HG GLU 35 1HG GLU 35 1.497 10.575 4.729
262 2HG GLU 35 2HG GLU 35 2.821 10.091 3.687
263 HE2 GLU 35 HE GLU 35 -0.161 9.329 4.558
264 H LYS 36 H LYS 36 4.458 8.916 8.435
265 HA LYS 36 HA LYS 36 5.461 6.415 7.946
266 1HB LYS 36 1HB LYS 36 5.803 8.523 9.949
267 2HB LYS 36 2HB LYS 36 6.106 6.925 10.600
268 1HG LYS 36 1HG LYS 36 7.405 6.723 8.182
269 2HG LYS 36 2HG LYS 36 7.605 8.434 8.503
270 1HD LYS 36 1HD LYS 36 9.032 8.077 10.268
271 2HD LYS 36 2HD LYS 36 8.113 6.713 10.871
272 1HE LYS 36 1HE LYS 36 9.738 6.463 8.315
273 2HE LYS 36 2HE LYS 36 10.510 6.286 9.878
274 1HZ LYS 36 1HZ LYS 36 9.791 4.166 9.769
275 H ASP 37 H ASP 37 2.998 7.441 10.382
276 HA ASP 37 HA ASP 37 2.784 4.839 11.435
277 1HB ASP 37 1HB ASP 37 2.117 7.195 12.437
278 2HB ASP 37 2HB ASP 37 0.605 6.949 11.585
279 HD2 ASP 37 HD ASP 37 2.367 6.087 14.326
280 H ILE 38 H ILE 38 1.448 6.628 8.706
281 HA ILE 38 HA ILE 38 -0.947 5.160 8.408
282 HB ILE 38 HB ILE 38 0.686 6.892 6.560
283 1HG1 ILE 38 1HG1 ILE 38 -0.785 7.643 8.688
284 2HG1 ILE 38 2HG1 ILE 38 -0.575 8.628 7.255
285 1HG2 ILE 38 1HG2 ILE 38 -1.967 5.530 6.026
286 2HG2 ILE 38 2HG2 ILE 38 -0.439 5.320 5.138
287 3HG2 ILE 38 3HG2 ILE 38 -1.306 6.873 5.062
288 1HD1 ILE 38 1HD1 ILE 38 -2.957 8.517 7.812
289 2HD1 ILE 38 2HD1 ILE 38 -2.905 6.739 7.815
290 3HD1 ILE 38 3HD1 ILE 38 -2.678 7.632 6.292
291 H ALA 39 H ALA 39 2.141 5.060 6.483
292 HA ALA 39 HA ALA 39 1.469 2.698 5.159
293 1HB ALA 39 1HB ALA 39 4.266 2.828 5.288
294 2HB ALA 39 2HB ALA 39 3.736 4.523 5.426
295 3HB ALA 39 3HB ALA 39 3.227 3.542 4.031
296 H ALA 40 H ALA 40 3.111 3.365 8.280
297 HA ALA 40 HA ALA 40 3.986 0.718 8.695
298 1HB ALA 40 1HB ALA 40 4.296 1.508 11.030
299 2HB ALA 40 2HB ALA 40 3.393 2.991 10.633
300 3HB ALA 40 3HB ALA 40 4.953 2.659 9.841
301 H TYR 41 H TYR 41 0.913 2.442 9.175
302 HA TYR 41 HA TYR 41 -0.194 0.457 10.900
303 1HB TYR 41 1HB TYR 41 -1.100 2.695 10.997
304 2HB TYR 41 2HB TYR 41 -1.046 2.882 9.256
305 HD1 TYR 41 HD1 TYR 41 -2.918 2.307 7.887
306 HD2 TYR 41 HD2 TYR 41 -2.901 1.262 12.036
307 HE1 TYR 41 HE1 TYR 41 -5.384 1.705 7.754
308 HE2 TYR 41 HE2 TYR 41 -5.368 0.663 11.887
309 HH TYR 41 HH TYR 41 -7.115 0.972 8.805
310 H ILE 42 H ILE 42 -0.169 1.126 7.373
311 HA ILE 42 HA ILE 42 -2.208 -0.702 6.735
312 HB ILE 42 HB ILE 42 0.073 0.330 5.048
313 1HG1 ILE 42 1HG1 ILE 42 -2.661 1.502 4.890
314 2HG1 ILE 42 2HG1 ILE 42 -1.710 1.910 6.305
315 1HG2 ILE 42 1HG2 ILE 42 -2.045 -0.039 3.370
316 2HG2 ILE 42 2HG2 ILE 42 -2.236 -1.410 4.489
317 3HG2 ILE 42 3HG2 ILE 42 -0.710 -1.193 3.600
318 1HD1 ILE 42 1HD1 ILE 42 -1.493 3.036 3.707
319 2HD1 ILE 42 2HD1 ILE 42 -0.025 2.056 3.937
320 3HD1 ILE 42 3HD1 ILE 42 -0.432 3.339 5.103
321 H LYS 43 H LYS 43 1.409 -0.959 6.727
322 HA LYS 43 HA LYS 43 1.464 -3.623 5.902
323 1HB LYS 43 1HB LYS 43 3.489 -2.581 5.647
324 2HB LYS 43 2HB LYS 43 3.368 -1.702 7.158
325 1HG LYS 43 1HG LYS 43 3.507 -4.686 7.397
326 2HG LYS 43 2HG LYS 43 4.960 -3.900 6.811
327 1HD LYS 43 1HD LYS 43 4.579 -2.246 8.845
328 2HD LYS 43 2HD LYS 43 3.552 -3.522 9.470
329 1HE LYS 43 1HE LYS 43 5.409 -4.560 10.259
330 2HE LYS 43 2HE LYS 43 5.903 -4.852 8.604
331 1HZ LYS 43 1HZ LYS 43 7.131 -3.152 10.433
332 H LYS 44 H LYS 44 1.443 -2.120 9.194
333 HA LYS 44 HA LYS 44 1.652 -4.514 10.597
334 1HB LYS 44 1HB LYS 44 2.092 -2.481 11.728
335 2HB LYS 44 2HB LYS 44 0.548 -1.786 11.280
336 1HG LYS 44 1HG LYS 44 -0.660 -3.146 12.810
337 2HG LYS 44 2HG LYS 44 0.618 -4.340 12.914
338 1HD LYS 44 1HD LYS 44 1.225 -3.290 14.844
339 2HD LYS 44 2HD LYS 44 1.917 -2.053 13.811
340 1HE LYS 44 1HE LYS 44 -0.229 -0.784 13.866
341 2HE LYS 44 2HE LYS 44 -0.958 -2.035 14.853
342 1HZ LYS 44 1HZ LYS 44 0.942 -1.561 16.474
343 H GLU 45 H GLU 45 -1.184 -2.736 9.269
344 HA GLU 45 HA GLU 45 -3.130 -4.233 10.485
345 1HB GLU 45 1HB GLU 45 -3.356 -2.098 9.073
346 2HB GLU 45 2HB GLU 45 -3.302 -3.125 7.654
347 1HG GLU 45 1HG GLU 45 -5.361 -3.249 9.906
348 2HG GLU 45 2HG GLU 45 -5.642 -2.700 8.265
349 HE2 GLU 45 HE GLU 45 -4.617 -5.762 6.997
350 H PHE 46 H PHE 46 -1.414 -4.768 7.339
351 HA PHE 46 HA PHE 46 -2.860 -7.150 6.785
352 1HB PHE 46 1HB PHE 46 -0.612 -5.472 5.719
353 2HB PHE 46 2HB PHE 46 -0.461 -7.172 5.326
354 HD1 PHE 46 HD1 PHE 46 -3.473 -4.976 5.542
355 HD2 PHE 46 HD2 PHE 46 -1.009 -7.415 3.095
356 HE1 PHE 46 HE1 PHE 46 -5.074 -4.677 3.634
357 HE2 PHE 46 HE2 PHE 46 -2.611 -7.117 1.186
358 HZ PHE 46 HZ PHE 46 -4.625 -5.751 1.477
359 H ASP 47 H ASP 47 0.709 -6.685 7.305
360 HA ASP 47 HA ASP 47 1.525 -9.129 7.591
361 1HB ASP 47 1HB ASP 47 3.357 -8.116 8.473
362 2HB ASP 47 2HB ASP 47 2.430 -6.629 8.472
363 HD2 ASP 47 HD ASP 47 2.714 -9.406 10.777
364 H LYS 48 H LYS 48 -0.431 -7.310 10.009
365 HA LYS 48 HA LYS 48 -0.315 -8.675 12.257
366 1HB LYS 48 1HB LYS 48 -1.870 -6.873 11.961
367 2HB LYS 48 2HB LYS 48 -2.802 -7.777 10.786
368 1HG LYS 48 1HG LYS 48 -4.087 -8.546 12.488
369 2HG LYS 48 2HG LYS 48 -2.708 -9.474 13.045
370 1HD LYS 48 1HD LYS 48 -2.365 -6.712 13.871
371 2HD LYS 48 2HD LYS 48 -3.969 -7.243 14.336
372 1HE LYS 48 1HE LYS 48 -1.415 -8.804 14.950
373 2HE LYS 48 2HE LYS 48 -2.182 -7.703 16.077
374 1HZ LYS 48 1HZ LYS 48 -2.833 -10.357 15.703
375 H LYS 49 H LYS 49 -2.918 -9.742 9.984
376 HA LYS 49 HA LYS 49 -2.001 -12.489 10.397
377 1HB LYS 49 1HB LYS 49 -4.608 -11.300 11.227
378 2HB LYS 49 2HB LYS 49 -4.652 -12.894 10.502
379 1HG LYS 49 1HG LYS 49 -3.092 -13.779 12.157
380 2HG LYS 49 2HG LYS 49 -2.759 -12.176 12.784
381 1HD LYS 49 1HD LYS 49 -4.332 -12.824 14.350
382 2HD LYS 49 2HD LYS 49 -5.426 -12.151 13.159
383 1HE LYS 49 1HE LYS 49 -5.536 -14.530 12.129
384 2HE LYS 49 2HE LYS 49 -4.727 -15.089 13.578
385 1HZ LYS 49 1HZ LYS 49 -6.835 -15.207 14.369
386 H TYR 50 H TYR 50 -1.111 -11.704 8.191
387 HA TYR 50 HA TYR 50 -3.100 -12.479 6.192
388 1HB TYR 50 1HB TYR 50 -2.618 -9.876 6.561
389 2HB TYR 50 2HB TYR 50 -1.055 -10.217 5.849
390 HD1 TYR 50 HD1 TYR 50 -1.376 -11.805 3.579
391 HD2 TYR 50 HD2 TYR 50 -4.132 -8.910 5.106
392 HE1 TYR 50 HE1 TYR 50 -2.377 -11.525 1.260
393 HE2 TYR 50 HE2 TYR 50 -5.124 -8.641 2.781
394 HH TYR 50 HH TYR 50 -4.872 -9.092 0.654
395 H ASN 51 H ASN 51 0.327 -11.266 6.255
396 HA ASN 51 HA ASN 51 1.427 -13.779 5.877
397 1HB ASN 51 1HB ASN 51 0.213 -13.198 3.567
398 2HB ASN 51 2HB ASN 51 1.601 -12.160 3.313
399 1HD2 ASN 51 2HD2 ASN 51 1.754 -13.731 1.477
400 2HD2 ASN 51 1HD2 ASN 51 2.714 -15.155 1.699
401 HA PRO 52 HA PRO 52 4.122 -10.207 6.838
402 1HB PRO 52 1HB PRO 52 5.009 -11.051 9.281
403 2HB PRO 52 2HB PRO 52 3.639 -9.978 9.077
404 1HG PRO 52 1HG PRO 52 3.656 -12.853 9.763
405 2HG PRO 52 2HG PRO 52 2.367 -11.684 9.967
406 1HD PRO 52 1HD PRO 52 2.553 -13.694 7.929
407 2HD PRO 52 2HD PRO 52 1.326 -12.450 8.067
408 H THR 53 H THR 53 7.420 -11.226 6.523
409 HA THR 53 HA THR 53 5.450 -9.397 7.694
410 HB THR 53 HB THR 53 7.625 -9.779 8.887
411 HG1 THR 53 HG1 THR 53 7.414 -7.224 7.459
412 1HG2 THR 53 1HG2 THR 53 9.717 -9.040 7.929
413 2HG2 THR 53 2HG2 THR 53 8.897 -8.336 6.515
414 3HG2 THR 53 3HG2 THR 53 8.989 -10.104 6.703
415 H TRP 54 H TRP 54 5.274 -7.196 6.889
416 HA TRP 54 HA TRP 54 5.707 -7.160 3.985
417 1HB TRP 54 1HB TRP 54 3.696 -5.649 5.663
418 2HB TRP 54 2HB TRP 54 3.886 -5.515 3.926
419 HD1 TRP 54 HD TRP 54 2.976 -8.304 6.511
420 HE1 TRP 54 HE1 TRP 54 1.283 -10.028 5.451
421 HE3 TRP 54 HE3 TRP 54 2.952 -6.229 1.868
422 HZ2 TRP 54 HZ2 TRP 54 0.149 -10.324 2.850
423 HZ3 TRP 54 HZ3 TRP 54 1.524 -7.297 0.127
424 HH2 TRP 54 HH TRP 54 0.155 -9.275 0.556
425 H HIS 55 H HIS 55 6.030 -4.779 3.166
426 HA HIS 55 HA HIS 55 7.504 -3.205 5.115
427 1HB HIS 55 1HB HIS 55 8.664 -4.009 2.432
428 2HB HIS 55 2HB HIS 55 9.401 -2.924 3.594
429 HD1 HIS 55 HD1 HIS 55 10.878 -3.960 5.361
430 HD2 HIS 55 HD2 HIS 55 8.447 -6.782 3.431
431 HE1 HIS 55 HE1 HIS 55 11.643 -6.248 6.188
432 H CYS 56 H CYS 56 6.630 -1.202 5.071
433 HA CYS 56 HA CYS 56 5.523 -0.322 2.505
434 1HB CYS 56 1HB CYS 56 4.022 -0.662 4.651
435 2HB CYS 56 2HB CYS 56 4.681 0.893 5.121
436 HG CYS 56 HG CYS 56 3.715 0.450 2.026
437 H ILE 57 H ILE 57 6.246 1.680 1.691
438 HA ILE 57 HA ILE 57 8.094 3.169 3.413
439 HB ILE 57 HB ILE 57 8.549 2.128 0.634
440 1HG1 ILE 57 1HG1 ILE 57 10.794 1.597 1.666
441 2HG1 ILE 57 2HG1 ILE 57 10.137 2.091 3.213
442 1HG2 ILE 57 1HG2 ILE 57 10.642 3.677 0.765
443 2HG2 ILE 57 2HG2 ILE 57 9.630 4.643 1.866
444 3HG2 ILE 57 3HG2 ILE 57 9.085 4.332 0.200
445 1HD1 ILE 57 1HD1 ILE 57 8.335 0.237 1.801
446 2HD1 ILE 57 2HD1 ILE 57 8.979 0.149 3.458
447 3HD1 ILE 57 3HD1 ILE 57 9.945 -0.463 2.095
448 H VAL 58 H VAL 58 8.199 5.460 2.960
449 HA VAL 58 HA VAL 58 6.099 6.412 1.159
450 HB VAL 58 HB VAL 58 6.540 7.434 3.969
451 1HG1 VAL 58 1HG1 VAL 58 4.057 7.964 2.395
452 2HG1 VAL 58 2HG1 VAL 58 5.535 8.840 1.931
453 3HG1 VAL 58 3HG1 VAL 58 4.900 8.982 3.588
454 1HG2 VAL 58 1HG2 VAL 58 5.508 5.489 4.538
455 2HG2 VAL 58 2HG2 VAL 58 4.803 5.258 2.920
456 3HG2 VAL 58 3HG2 VAL 58 4.052 6.397 4.062
457 H GLY 59 H GLY 59 7.464 7.233 -0.403
458 1HA GLY 59 2HA GLY 59 9.318 9.338 0.522
459 2HA GLY 59 1HA GLY 59 9.820 8.125 -0.639
460 H ARG 60 H ARG 60 9.047 8.184 -2.809
461 HA ARG 60 HA ARG 60 7.066 10.122 -3.467
462 1HB ARG 60 1HB ARG 60 9.830 10.875 -3.566
463 2HB ARG 60 2HB ARG 60 9.333 10.637 -5.231
464 1HG ARG 60 1HG ARG 60 7.264 12.093 -4.672
465 2HG ARG 60 2HG ARG 60 8.076 12.500 -3.173
466 1HD ARG 60 1HD ARG 60 9.635 13.843 -4.220
467 2HD ARG 60 2HD ARG 60 9.775 12.783 -5.607
468 HE ARG 60 HE ARG 60 7.188 13.905 -5.746
469 1HH1 ARG 60 2HH2 ARG 60 10.530 15.078 -5.833
470 2HH1 ARG 60 1HH2 ARG 60 10.154 16.453 -6.817
471 1HH2 ARG 60 1HH ARG 60 7.890 16.811 -7.516
472 H ASN 61 H ASN 61 9.669 7.858 -4.545
473 HA ASN 61 HA ASN 61 7.770 6.845 -6.496
474 1HB ASN 61 1HB ASN 61 9.837 8.373 -7.354
475 2HB ASN 61 2HB ASN 61 10.713 6.864 -7.194
476 1HD2 ASN 61 2HD2 ASN 61 10.698 5.525 -8.830
477 2HD2 ASN 61 1HD2 ASN 61 9.570 5.486 -10.143
478 H PHE 62 H PHE 62 9.514 4.794 -7.537
479 HA PHE 62 HA PHE 62 10.492 3.397 -5.172
480 1HB PHE 62 1HB PHE 62 9.151 1.431 -5.774
481 2HB PHE 62 2HB PHE 62 8.049 2.794 -5.751
482 HD1 PHE 62 HD1 PHE 62 9.046 0.002 -7.579
483 HD2 PHE 62 HD2 PHE 62 7.829 4.032 -8.110
484 HE1 PHE 62 HE1 PHE 62 8.352 -0.517 -9.934
485 HE2 PHE 62 HE2 PHE 62 7.134 3.513 -10.466
486 HZ PHE 62 HZ PHE 62 7.404 1.244 -11.350
487 H GLY 63 H GLY 63 10.620 0.888 -6.895
488 1HA GLY 63 2HA GLY 63 11.794 0.764 -9.186
489 2HA GLY 63 1HA GLY 63 13.053 1.660 -8.360
490 H SER 64 H SER 64 10.978 -1.293 -7.930
491 HA SER 64 HA SER 64 13.260 -2.886 -7.540
492 1HB SER 64 1HB SER 64 12.035 -1.683 -5.169
493 2HB SER 64 2HB SER 64 11.926 -3.431 -5.099
494 HG SER 64 HG SER 64 14.282 -3.460 -5.607
495 H TYR 65 H TYR 65 12.286 -4.178 -9.170
496 HA TYR 65 HA TYR 65 10.255 -5.963 -8.219
497 1HB TYR 65 1HB TYR 65 8.802 -4.164 -9.014
498 2HB TYR 65 2HB TYR 65 9.861 -3.809 -10.365
499 HD1 TYR 65 HD1 TYR 65 7.681 -6.559 -9.041
500 HD2 TYR 65 HD2 TYR 65 9.313 -4.614 -12.484
501 HE1 TYR 65 HE1 TYR 65 6.254 -8.023 -10.554
502 HE2 TYR 65 HE2 TYR 65 7.881 -6.083 -13.985
503 HH TYR 65 HH TYR 65 5.777 -8.582 -12.583
504 H VAL 66 H VAL 66 11.926 -4.658 -11.172
505 HA VAL 66 HA VAL 66 12.153 -7.391 -12.154
506 HB VAL 66 HB VAL 66 11.308 -5.709 -13.670
507 1HG1 VAL 66 1HG1 VAL 66 13.152 -3.970 -14.455
508 2HG1 VAL 66 2HG1 VAL 66 13.737 -4.194 -12.789
509 3HG1 VAL 66 3HG1 VAL 66 12.076 -3.626 -13.080
510 1HG2 VAL 66 1HG2 VAL 66 13.556 -7.389 -14.159
511 2HG2 VAL 66 2HG2 VAL 66 13.795 -5.886 -15.083
512 3HG2 VAL 66 3HG2 VAL 66 12.311 -6.841 -15.308
513 H THR 67 H THR 67 13.574 -7.099 -9.817
514 HA THR 67 HA THR 67 16.259 -7.497 -10.779
515 HB THR 67 HB THR 67 15.465 -5.123 -9.030
516 HG1 THR 67 HG1 THR 67 15.663 -4.711 -11.291
517 1HG2 THR 67 1HG2 THR 67 17.971 -6.742 -9.033
518 2HG2 THR 67 2HG2 THR 67 17.400 -5.545 -7.844
519 3HG2 THR 67 3HG2 THR 67 18.215 -5.005 -9.331
520 H HIS 68 H HIS 68 14.487 -6.809 -7.683
521 HA HIS 68 HA HIS 68 15.779 -9.183 -6.608
522 1HB HIS 68 1HB HIS 68 15.197 -6.622 -5.575
523 2HB HIS 68 2HB HIS 68 14.131 -7.725 -4.727
524 HD1 HIS 68 HD1 HIS 68 15.374 -9.829 -3.502
525 HD2 HIS 68 HD2 HIS 68 17.808 -6.626 -4.689
526 HE1 HIS 68 HE1 HIS 68 17.559 -10.076 -2.209
527 H GLU 69 H GLU 69 12.582 -7.751 -7.367
528 HA GLU 69 HA GLU 69 10.636 -8.671 -7.677
529 1HB GLU 69 1HB GLU 69 12.433 -10.954 -8.023
530 2HB GLU 69 2HB GLU 69 10.890 -11.470 -7.369
531 1HG GLU 69 1HG GLU 69 10.449 -9.496 -9.468
532 2HG GLU 69 2HG GLU 69 11.488 -10.771 -10.072
533 HE2 GLU 69 HE GLU 69 8.811 -12.746 -10.607
534 H THR 70 H THR 70 8.793 -9.625 -6.458
535 HA THR 70 HA THR 70 9.423 -10.442 -3.731
536 HB THR 70 HB THR 70 7.976 -8.684 -2.791
537 HG1 THR 70 HG1 THR 70 6.595 -8.654 -4.767
538 1HG2 THR 70 1HG2 THR 70 9.142 -6.586 -3.573
539 2HG2 THR 70 2HG2 THR 70 9.900 -7.529 -4.878
540 3HG2 THR 70 3HG2 THR 70 10.291 -7.887 -3.179
541 H ARG 71 H ARG 71 6.479 -9.899 -3.113
542 HA ARG 71 HA ARG 71 5.432 -12.063 -4.750
543 1HB ARG 71 1HB ARG 71 5.388 -11.718 -1.735
544 2HB ARG 71 2HB ARG 71 4.093 -12.604 -2.514
545 1HG ARG 71 1HG ARG 71 5.411 -14.440 -2.660
546 2HG ARG 71 2HG ARG 71 6.558 -13.554 -3.647
547 1HD ARG 71 1HD ARG 71 7.240 -12.545 -1.212
548 2HD ARG 71 2HD ARG 71 6.612 -14.096 -0.690
549 HE ARG 71 HE ARG 71 8.455 -14.302 -2.959
550 1HH1 ARG 71 2HH2 ARG 71 8.222 -14.188 0.574
551 2HH1 ARG 71 1HH2 ARG 71 9.741 -14.982 0.824
552 1HH2 ARG 71 1HH ARG 71 11.039 -15.657 -1.074
553 H HIS 72 H HIS 72 4.228 -9.907 -2.070
554 HA HIS 72 HA HIS 72 2.115 -9.056 -3.914
555 1HB HIS 72 1HB HIS 72 1.613 -10.483 -1.766
556 2HB HIS 72 2HB HIS 72 1.825 -8.961 -0.926
557 HD1 HIS 72 HD1 HIS 72 0.401 -6.971 -2.745
558 HD2 HIS 72 HD2 HIS 72 -1.094 -10.805 -1.925
559 HE1 HIS 72 HE1 HIS 72 -2.110 -6.867 -3.179
560 H PHE 73 H PHE 73 2.473 -7.026 -4.649
561 HA PHE 73 HA PHE 73 3.337 -5.046 -2.692
562 1HB PHE 73 1HB PHE 73 4.801 -4.189 -4.735
563 2HB PHE 73 2HB PHE 73 5.418 -5.526 -3.785
564 HD1 PHE 73 HD1 PHE 73 4.745 -7.919 -4.652
565 HD2 PHE 73 HD2 PHE 73 4.695 -4.409 -7.036
566 HE1 PHE 73 HE1 PHE 73 4.892 -9.324 -6.727
567 HE2 PHE 73 HE2 PHE 73 4.841 -5.813 -9.110
568 HZ PHE 73 HZ PHE 73 4.938 -8.256 -8.931
569 H ILE 74 H ILE 74 2.712 -2.858 -3.228
570 HA ILE 74 HA ILE 74 1.312 -2.346 -5.654
571 HB ILE 74 HB ILE 74 -0.607 -3.274 -4.954
572 1HG1 ILE 74 1HG1 ILE 74 -2.133 -1.654 -4.089
573 2HG1 ILE 74 2HG1 ILE 74 -0.859 -0.771 -3.274
574 1HG2 ILE 74 1HG2 ILE 74 -1.179 -3.148 -2.344
575 2HG2 ILE 74 2HG2 ILE 74 0.596 -3.069 -2.240
576 3HG2 ILE 74 3HG2 ILE 74 -0.187 -4.444 -3.056
577 1HD1 ILE 74 1HD1 ILE 74 -1.829 -0.111 -5.750
578 2HD1 ILE 74 2HD1 ILE 74 -0.441 -1.130 -6.203
579 3HD1 ILE 74 3HD1 ILE 74 -0.195 0.310 -5.186
580 H TYR 75 H TYR 75 2.047 -0.353 -6.128
581 HA TYR 75 HA TYR 75 2.517 1.462 -3.863
582 1HB TYR 75 1HB TYR 75 4.553 0.964 -5.122
583 2HB TYR 75 2HB TYR 75 3.698 0.990 -6.651
584 HD1 TYR 75 HD1 TYR 75 5.282 2.519 -7.683
585 HD2 TYR 75 HD2 TYR 75 3.173 3.629 -4.131
586 HE1 TYR 75 HE1 TYR 75 5.971 4.943 -8.022
587 HE2 TYR 75 HE2 TYR 75 3.868 6.049 -4.482
588 HH TYR 75 HH TYR 75 5.949 7.159 -5.727
589 H PHE 76 H PHE 76 1.121 3.134 -3.658
590 HA PHE 76 HA PHE 76 0.054 4.305 -6.100
591 1HB PHE 76 1HB PHE 76 -2.220 4.326 -4.851
592 2HB PHE 76 2HB PHE 76 -1.696 2.746 -5.400
593 HD1 PHE 76 HD1 PHE 76 -0.198 1.441 -3.599
594 HD2 PHE 76 HD2 PHE 76 -3.004 4.492 -2.693
595 HE1 PHE 76 HE1 PHE 76 -0.398 0.561 -1.258
596 HE2 PHE 76 HE2 PHE 76 -3.204 3.613 -0.351
597 HZ PHE 76 HZ PHE 76 -1.899 1.659 0.338
598 H TYR 77 H TYR 77 -1.487 6.296 -5.242
599 HA TYR 77 HA TYR 77 0.227 7.723 -3.327
600 1HB TYR 77 1HB TYR 77 -0.246 8.320 -5.920
601 2HB TYR 77 2HB TYR 77 -1.782 8.904 -5.308
602 HD1 TYR 77 HD1 TYR 77 1.783 9.170 -4.132
603 HD2 TYR 77 HD2 TYR 77 -1.835 11.211 -5.157
604 HE1 TYR 77 HE1 TYR 77 2.860 11.395 -3.536
605 HE2 TYR 77 HE2 TYR 77 -0.747 13.429 -4.557
606 HH TYR 77 HH TYR 77 2.006 13.657 -2.762
607 H LEU 78 H LEU 78 -0.653 8.006 -1.344
608 HA LEU 78 HA LEU 78 -3.546 7.819 -1.109
609 1HB LEU 78 1HB LEU 78 -1.224 7.559 0.761
610 2HB LEU 78 2HB LEU 78 -2.806 7.956 1.404
611 HG LEU 78 HG LEU 78 -2.030 5.473 -0.144
612 1HD1 LEU 78 1HD1 LEU 78 -1.946 4.372 1.811
613 2HD1 LEU 78 2HD1 LEU 78 -3.327 5.263 2.497
614 3HD1 LEU 78 3HD1 LEU 78 -1.702 5.992 2.506
615 1HD2 LEU 78 1HD2 LEU 78 -4.146 5.650 -0.947
616 2HD2 LEU 78 2HD2 LEU 78 -4.707 6.653 0.413
617 3HD2 LEU 78 3HD2 LEU 78 -4.521 4.893 0.620
618 H GLY 79 H GLY 79 -4.756 9.626 -1.195
619 1HA GLY 79 2HA GLY 79 -5.386 11.773 -0.990
620 2HA GLY 79 1HA GLY 79 -4.297 11.883 0.378
621 H GLN 80 H GLN 80 -1.971 12.382 -0.032
622 HA GLN 80 HA GLN 80 -1.399 13.384 -2.660
623 1HB GLN 80 1HB GLN 80 -2.039 15.138 -0.365
624 2HB GLN 80 2HB GLN 80 -0.501 15.519 -1.113
625 1HG GLN 80 1HG GLN 80 -1.471 16.078 -3.173
626 2HG GLN 80 2HG GLN 80 -2.852 15.025 -2.935
627 1HE2 GLN 80 2HE2 GLN 80 -4.416 16.497 -3.316
628 2HE2 GLN 80 1HE2 GLN 80 -4.762 17.861 -2.306
629 H VAL 81 H VAL 81 -0.419 11.135 -1.168
630 HA VAL 81 HA VAL 81 2.374 11.918 -1.014
631 HB VAL 81 HB VAL 81 1.405 12.117 1.275
632 1HG1 VAL 81 1HG1 VAL 81 1.328 9.330 1.948
633 2HG1 VAL 81 2HG1 VAL 81 0.206 9.627 0.599
634 3HG1 VAL 81 3HG1 VAL 81 0.049 10.557 2.109
635 1HG2 VAL 81 1HG2 VAL 81 3.333 11.373 2.256
636 2HG2 VAL 81 2HG2 VAL 81 3.831 11.274 0.549
637 3HG2 VAL 81 3HG2 VAL 81 3.296 9.809 1.407
638 H ALA 82 H ALA 82 3.819 9.968 -1.076
639 HA ALA 82 HA ALA 82 2.553 7.956 -2.762
640 1HB ALA 82 1HB ALA 82 5.282 9.096 -2.376
641 2HB ALA 82 2HB ALA 82 4.453 8.590 -3.868
642 3HB ALA 82 3HB ALA 82 5.200 7.371 -2.807
643 H ILE 83 H ILE 83 2.634 5.713 -2.298
644 HA ILE 83 HA ILE 83 3.824 4.900 0.208
645 HB ILE 83 HB ILE 83 1.448 5.813 0.607
646 1HG1 ILE 83 1HG1 ILE 83 1.864 3.001 1.599
647 2HG1 ILE 83 2HG1 ILE 83 2.968 4.279 2.068
648 1HG2 ILE 83 1HG2 ILE 83 0.701 3.096 -0.504
649 2HG2 ILE 83 2HG2 ILE 83 0.446 4.640 -1.353
650 3HG2 ILE 83 3HG2 ILE 83 -0.387 4.324 0.189
651 1HD1 ILE 83 1HD1 ILE 83 1.016 3.914 3.660
652 2HD1 ILE 83 2HD1 ILE 83 -0.058 4.513 2.372
653 3HD1 ILE 83 3HD1 ILE 83 1.184 5.583 3.065
654 H LEU 84 H LEU 84 4.942 3.096 -0.276
655 HA LEU 84 HA LEU 84 3.787 1.352 -2.338
656 1HB LEU 84 1HB LEU 84 5.594 1.840 -3.518
657 2HB LEU 84 2HB LEU 84 6.374 2.638 -2.167
658 HG LEU 84 HG LEU 84 7.077 0.375 -1.318
659 1HD1 LEU 84 1HD1 LEU 84 5.808 -0.487 -3.912
660 2HD1 LEU 84 2HD1 LEU 84 5.588 -1.151 -2.276
661 3HD1 LEU 84 3HD1 LEU 84 7.114 -1.427 -3.151
662 1HD2 LEU 84 1HD2 LEU 84 8.936 1.203 -2.236
663 2HD2 LEU 84 2HD2 LEU 84 8.071 1.814 -3.668
664 3HD2 LEU 84 3HD2 LEU 84 8.593 0.113 -3.600
665 H LEU 85 H LEU 85 3.114 -0.557 -1.541
666 HA LEU 85 HA LEU 85 4.471 -1.514 0.885
667 1HB LEU 85 1HB LEU 85 2.129 -0.786 1.205
668 2HB LEU 85 2HB LEU 85 1.611 -1.970 0.019
669 HG LEU 85 HG LEU 85 3.101 -3.461 1.854
670 1HD1 LEU 85 1HD1 LEU 85 1.497 -2.672 3.911
671 2HD1 LEU 85 2HD1 LEU 85 1.914 -1.108 3.169
672 3HD1 LEU 85 3HD1 LEU 85 3.203 -2.208 3.711
673 1HD2 LEU 85 1HD2 LEU 85 0.345 -3.225 0.926
674 2HD2 LEU 85 2HD2 LEU 85 0.461 -3.821 2.599
675 3HD2 LEU 85 3HD2 LEU 85 1.317 -4.670 1.290
676 H PHE 86 H PHE 86 5.359 -3.548 0.860
677 HA PHE 86 HA PHE 86 4.591 -5.383 -1.225
678 1HB PHE 86 1HB PHE 86 6.917 -5.510 -2.106
679 2HB PHE 86 2HB PHE 86 6.356 -3.853 -2.229
680 HD1 PHE 86 HD1 PHE 86 8.568 -6.137 -0.383
681 HD2 PHE 86 HD2 PHE 86 7.365 -2.103 -0.929
682 HE1 PHE 86 HE1 PHE 86 10.568 -5.363 0.920
683 HE2 PHE 86 HE2 PHE 86 9.366 -1.330 0.374
684 HZ PHE 86 HZ PHE 86 10.943 -2.969 1.283
685 H LYS 87 H LYS 87 5.263 -7.562 -0.785
686 HA LYS 87 HA LYS 87 6.345 -7.872 1.930
687 1HB LYS 87 1HB LYS 87 4.284 -8.777 2.215
688 2HB LYS 87 2HB LYS 87 4.067 -9.132 0.513
689 1HG LYS 87 1HG LYS 87 4.278 -11.255 1.652
690 2HG LYS 87 2HG LYS 87 5.762 -11.013 0.750
691 1HD LYS 87 1HD LYS 87 6.844 -10.103 2.848
692 2HD LYS 87 2HD LYS 87 5.374 -10.459 3.730
693 1HE LYS 87 1HE LYS 87 5.896 -12.670 3.904
694 2HE LYS 87 2HE LYS 87 6.253 -12.798 2.194
695 1HZ LYS 87 1HZ LYS 87 8.228 -11.367 3.790
696 H SER 88 H SER 88 8.441 -8.465 1.890
697 HA SER 88 HA SER 88 9.162 -10.413 -0.154
698 1HB SER 88 1HB SER 88 10.128 -8.306 -0.865
699 2HB SER 88 2HB SER 88 10.725 -7.960 0.746
700 HG SER 88 HG SER 88 12.517 -8.762 -0.244
701 H GLY 89 H GLY 89 10.759 -11.999 0.518
702 1HA GLY 89 2HA GLY 89 12.329 -12.779 2.131
703 2HA GLY 89 1HA GLY 89 11.442 -11.941 3.387
Start of MODEL 10
1 1H MET 1 H MET 1 -11.469 17.044 -14.462
2 HA MET 1 HA MET 1 -9.547 15.688 -14.155
3 1HB MET 1 1HB MET 1 -8.298 17.884 -15.889
4 2HB MET 1 2HB MET 1 -7.316 16.766 -14.964
5 1HG MET 1 1HG MET 1 -9.421 15.846 -16.976
6 2HG MET 1 2HG MET 1 -7.742 16.103 -17.406
7 1HE MET 1 1HE MET 1 -7.954 12.293 -17.355
8 2HE MET 1 2HE MET 1 -9.588 12.986 -17.229
9 3HE MET 1 3HE MET 1 -8.370 13.764 -18.266
10 H SER 2 H SER 2 -9.855 16.120 -11.965
11 HA SER 2 HA SER 2 -8.308 18.321 -10.962
12 1HB SER 2 1HB SER 2 -11.244 18.329 -11.022
13 2HB SER 2 2HB SER 2 -10.638 18.461 -9.383
14 HG SER 2 HG SER 2 -9.125 20.177 -10.418
15 H ASP 3 H ASP 3 -7.019 17.382 -9.425
16 HA ASP 3 HA ASP 3 -6.334 16.121 -7.802
17 1HB ASP 3 1HB ASP 3 -9.313 15.811 -7.213
18 2HB ASP 3 2HB ASP 3 -8.063 15.178 -6.161
19 HD2 ASP 3 HD ASP 3 -6.965 17.338 -4.743
20 H ARG 4 H ARG 4 -6.602 13.683 -6.836
21 HA ARG 4 HA ARG 4 -7.565 12.015 -9.016
22 1HB ARG 4 1HB ARG 4 -4.861 12.213 -7.847
23 2HB ARG 4 2HB ARG 4 -5.471 10.571 -7.786
24 1HG ARG 4 1HG ARG 4 -4.473 10.633 -9.913
25 2HG ARG 4 2HG ARG 4 -6.151 10.961 -10.296
26 1HD ARG 4 1HD ARG 4 -5.670 13.056 -11.063
27 2HD ARG 4 2HD ARG 4 -4.722 13.442 -9.640
28 HE ARG 4 HE ARG 4 -3.701 12.480 -12.196
29 1HH1 ARG 4 2HH2 ARG 4 -3.030 12.594 -8.718
30 2HH1 ARG 4 1HH2 ARG 4 -1.319 12.410 -8.917
31 1HH2 ARG 4 1HH ARG 4 -0.409 12.200 -11.124
32 H LYS 5 H LYS 5 -6.658 12.286 -5.526
33 HA LYS 5 HA LYS 5 -7.464 11.337 -3.704
34 1HB LYS 5 1HB LYS 5 -9.840 10.977 -5.528
35 2HB LYS 5 2HB LYS 5 -9.861 10.369 -3.885
36 1HG LYS 5 1HG LYS 5 -9.616 12.546 -2.939
37 2HG LYS 5 2HG LYS 5 -9.021 13.234 -4.437
38 1HD LYS 5 1HD LYS 5 -11.199 14.002 -4.564
39 2HD LYS 5 2HD LYS 5 -11.435 12.449 -5.342
40 1HE LYS 5 1HE LYS 5 -12.866 11.809 -3.703
41 2HE LYS 5 2HE LYS 5 -11.622 12.034 -2.492
42 1HZ LYS 5 1HZ LYS 5 -13.194 13.587 -1.849
43 H ALA 6 H ALA 6 -8.769 8.974 -3.089
44 HA ALA 6 HA ALA 6 -6.854 7.097 -3.177
45 1HB ALA 6 1HB ALA 6 -8.790 6.816 -1.801
46 2HB ALA 6 2HB ALA 6 -8.785 5.444 -2.936
47 3HB ALA 6 3HB ALA 6 -9.880 6.821 -3.209
48 H VAL 7 H VAL 7 -5.661 6.779 -5.051
49 HA VAL 7 HA VAL 7 -7.141 5.481 -7.215
50 HB VAL 7 HB VAL 7 -5.228 7.804 -7.426
51 1HG1 VAL 7 1HG1 VAL 7 -6.043 5.814 -9.564
52 2HG1 VAL 7 2HG1 VAL 7 -4.399 6.250 -9.037
53 3HG1 VAL 7 3HG1 VAL 7 -5.391 7.431 -9.926
54 1HG2 VAL 7 1HG2 VAL 7 -7.936 7.812 -7.276
55 2HG2 VAL 7 2HG2 VAL 7 -7.715 7.654 -9.036
56 3HG2 VAL 7 3HG2 VAL 7 -6.986 9.025 -8.167
57 H ILE 8 H ILE 8 -5.681 4.139 -8.613
58 HA ILE 8 HA ILE 8 -3.334 3.274 -7.071
59 HB ILE 8 HB ILE 8 -5.634 1.773 -8.140
60 1HG1 ILE 8 1HG1 ILE 8 -3.985 0.397 -6.220
61 2HG1 ILE 8 2HG1 ILE 8 -4.208 2.055 -5.704
62 1HG2 ILE 8 1HG2 ILE 8 -2.792 0.880 -8.610
63 2HG2 ILE 8 2HG2 ILE 8 -4.169 0.892 -9.737
64 3HG2 ILE 8 3HG2 ILE 8 -4.123 -0.283 -8.401
65 1HD1 ILE 8 1HD1 ILE 8 -6.560 0.401 -6.686
66 2HD1 ILE 8 2HD1 ILE 8 -6.583 1.865 -5.674
67 3HD1 ILE 8 3HD1 ILE 8 -6.010 0.323 -4.995
68 H LYS 9 H LYS 9 -1.431 2.880 -8.221
69 HA LYS 9 HA LYS 9 -1.483 3.937 -10.938
70 1HB LYS 9 1HB LYS 9 0.453 3.897 -8.713
71 2HB LYS 9 2HB LYS 9 1.158 3.571 -10.283
72 1HG LYS 9 1HG LYS 9 1.232 5.936 -10.130
73 2HG LYS 9 2HG LYS 9 -0.176 5.639 -11.131
74 1HD LYS 9 1HD LYS 9 -0.842 7.271 -9.486
75 2HD LYS 9 2HD LYS 9 -1.611 5.764 -9.027
76 1HE LYS 9 1HE LYS 9 -0.650 5.972 -6.982
77 2HE LYS 9 2HE LYS 9 0.905 5.682 -7.737
78 1HZ LYS 9 1HZ LYS 9 0.661 7.850 -6.465
79 H ASN 10 H ASN 10 0.580 1.417 -9.354
80 HA ASN 10 HA ASN 10 -0.333 -0.413 -11.413
81 1HB ASN 10 1HB ASN 10 2.572 0.238 -10.701
82 2HB ASN 10 2HB ASN 10 2.123 -1.203 -11.592
83 1HD2 ASN 10 2HD2 ASN 10 1.046 -0.990 -13.620
84 2HD2 ASN 10 1HD2 ASN 10 1.280 0.405 -14.618
85 H ALA 11 H ALA 11 -0.867 -2.385 -10.440
86 HA ALA 11 HA ALA 11 0.690 -3.440 -8.301
87 1HB ALA 11 1HB ALA 11 -0.948 -3.337 -6.549
88 2HB ALA 11 2HB ALA 11 -2.176 -2.664 -7.648
89 3HB ALA 11 3HB ALA 11 -0.769 -1.680 -7.177
90 H ASP 12 H ASP 12 0.892 -5.190 -9.780
91 HA ASP 12 HA ASP 12 -1.269 -6.318 -11.076
92 1HB ASP 12 1HB ASP 12 1.342 -7.611 -10.156
93 2HB ASP 12 2HB ASP 12 0.251 -8.313 -11.333
94 HD2 ASP 12 HD ASP 12 0.755 -4.997 -12.778
95 H MET 13 H MET 13 -3.045 -6.806 -9.673
96 HA MET 13 HA MET 13 -2.788 -9.182 -8.184
97 1HB MET 13 1HB MET 13 -2.023 -6.970 -6.739
98 2HB MET 13 2HB MET 13 -3.750 -6.918 -6.442
99 1HG MET 13 1HG MET 13 -3.764 -8.983 -5.304
100 2HG MET 13 2HG MET 13 -2.326 -9.566 -6.119
101 1HE MET 13 1HE MET 13 -2.245 -8.927 -2.123
102 2HE MET 13 2HE MET 13 -3.040 -9.901 -3.383
103 3HE MET 13 3HE MET 13 -1.296 -10.089 -3.081
104 H SER 14 H SER 14 -5.036 -9.374 -6.751
105 HA SER 14 HA SER 14 -7.052 -8.817 -8.738
106 1HB SER 14 1HB SER 14 -6.898 -11.115 -7.889
107 2HB SER 14 2HB SER 14 -7.061 -10.558 -6.235
108 HG SER 14 HG SER 14 -9.094 -11.318 -6.966
109 H GLU 15 H GLU 15 -8.934 -7.561 -8.325
110 HA GLU 15 HA GLU 15 -8.697 -5.388 -6.777
111 1HB GLU 15 1HB GLU 15 -10.558 -6.260 -8.518
112 2HB GLU 15 2HB GLU 15 -11.453 -6.563 -7.042
113 1HG GLU 15 1HG GLU 15 -11.634 -4.307 -6.514
114 2HG GLU 15 2HG GLU 15 -10.087 -3.899 -7.232
115 HE2 GLU 15 HE GLU 15 -13.396 -3.916 -7.814
116 H GLU 16 H GLU 16 -9.397 -8.657 -5.736
117 HA GLU 16 HA GLU 16 -10.803 -8.129 -3.427
118 1HB GLU 16 1HB GLU 16 -9.741 -10.379 -4.716
119 2HB GLU 16 2HB GLU 16 -8.892 -10.360 -3.183
120 1HG GLU 16 1HG GLU 16 -11.922 -10.064 -3.380
121 2HG GLU 16 2HG GLU 16 -11.139 -11.624 -3.231
122 HE2 GLU 16 HE GLU 16 -11.949 -10.314 0.109
123 H MET 17 H MET 17 -7.230 -8.732 -3.816
124 HA MET 17 HA MET 17 -6.782 -7.808 -1.161
125 1HB MET 17 1HB MET 17 -4.654 -8.237 -3.305
126 2HB MET 17 2HB MET 17 -4.500 -8.484 -1.578
127 1HG MET 17 1HG MET 17 -6.011 -10.210 -3.579
128 2HG MET 17 2HG MET 17 -4.680 -10.683 -2.543
129 1HE MET 17 1HE MET 17 -7.312 -12.779 -0.764
130 2HE MET 17 2HE MET 17 -6.996 -12.591 -2.506
131 3HE MET 17 3HE MET 17 -5.639 -12.656 -1.355
132 H GLN 18 H GLN 18 -6.456 -6.549 -4.498
133 HA GLN 18 HA GLN 18 -4.885 -4.357 -3.864
134 1HB GLN 18 1HB GLN 18 -5.096 -4.999 -6.164
135 2HB GLN 18 2HB GLN 18 -6.847 -4.937 -6.110
136 1HG GLN 18 1HG GLN 18 -6.726 -2.451 -5.728
137 2HG GLN 18 2HG GLN 18 -4.979 -2.533 -5.845
138 1HE2 GLN 18 2HE2 GLN 18 -4.235 -3.876 -7.844
139 2HE2 GLN 18 1HE2 GLN 18 -4.949 -3.425 -9.357
140 H GLN 19 H GLN 19 -8.478 -4.772 -4.065
141 HA GLN 19 HA GLN 19 -8.973 -2.082 -3.412
142 1HB GLN 19 1HB GLN 19 -10.507 -3.797 -4.621
143 2HB GLN 19 2HB GLN 19 -10.918 -4.384 -3.023
144 1HG GLN 19 1HG GLN 19 -11.407 -1.614 -4.182
145 2HG GLN 19 2HG GLN 19 -12.592 -2.749 -3.567
146 1HE2 GLN 19 2HE2 GLN 19 -11.219 0.066 -2.928
147 2HE2 GLN 19 1HE2 GLN 19 -11.199 0.095 -1.197
148 H ASP 20 H ASP 20 -9.031 -5.193 -1.557
149 HA ASP 20 HA ASP 20 -9.952 -4.199 0.802
150 1HB ASP 20 1HB ASP 20 -9.552 -6.612 0.283
151 2HB ASP 20 2HB ASP 20 -7.822 -6.344 0.353
152 HD2 ASP 20 HD ASP 20 -10.258 -7.499 2.044
153 H ALA 21 H ALA 21 -6.587 -4.397 -0.528
154 HA ALA 21 HA ALA 21 -5.326 -3.374 1.780
155 1HB ALA 21 1HB ALA 21 -4.045 -4.672 0.237
156 2HB ALA 21 2HB ALA 21 -3.432 -3.008 0.099
157 3HB ALA 21 3HB ALA 21 -4.535 -3.655 -1.138
158 H VAL 22 H VAL 22 -5.554 -1.795 -1.482
159 HA VAL 22 HA VAL 22 -4.944 0.716 -0.767
160 HB VAL 22 HB VAL 22 -5.758 -0.471 -3.009
161 1HG1 VAL 22 1HG1 VAL 22 -8.096 1.361 -2.427
162 2HG1 VAL 22 2HG1 VAL 22 -8.162 -0.398 -2.164
163 3HG1 VAL 22 3HG1 VAL 22 -7.875 0.248 -3.798
164 1HG2 VAL 22 1HG2 VAL 22 -6.193 2.147 -3.714
165 2HG2 VAL 22 2HG2 VAL 22 -4.595 1.381 -3.543
166 3HG2 VAL 22 3HG2 VAL 22 -5.281 2.321 -2.195
167 H ASP 23 H ASP 23 -7.936 -1.050 -0.029
168 HA ASP 23 HA ASP 23 -9.466 1.173 0.627
169 1HB ASP 23 1HB ASP 23 -10.564 -0.942 0.303
170 2HB ASP 23 2HB ASP 23 -9.518 -1.751 1.455
171 HD2 ASP 23 HD ASP 23 -9.850 -1.013 3.708
172 H CYS 24 H CYS 24 -7.694 -1.254 2.702
173 HA CYS 24 HA CYS 24 -8.117 -0.045 5.120
174 1HB CYS 24 1HB CYS 24 -5.704 -1.646 4.209
175 2HB CYS 24 2HB CYS 24 -6.074 -1.259 5.876
176 HG CYS 24 HG CYS 24 -8.758 -2.150 5.227
177 H ALA 25 H ALA 25 -5.435 0.409 2.714
178 HA ALA 25 HA ALA 25 -3.981 2.266 4.182
179 1HB ALA 25 1HB ALA 25 -4.303 1.922 1.174
180 2HB ALA 25 2HB ALA 25 -3.126 1.080 2.211
181 3HB ALA 25 3HB ALA 25 -3.004 2.840 1.972
182 H THR 26 H THR 26 -6.615 2.712 1.731
183 HA THR 26 HA THR 26 -6.627 5.459 1.647
184 HB THR 26 HB THR 26 -8.782 3.316 1.391
185 HG1 THR 26 HG1 THR 26 -7.148 3.465 -0.263
186 1HG2 THR 26 1HG2 THR 26 -9.239 5.964 0.116
187 2HG2 THR 26 2HG2 THR 26 -9.411 5.985 1.888
188 3HG2 THR 26 3HG2 THR 26 -10.406 4.879 0.911
189 H GLN 27 H GLN 27 -8.683 3.405 3.824
190 HA GLN 27 HA GLN 27 -9.671 5.565 5.223
191 1HB GLN 27 1HB GLN 27 -10.445 3.085 5.177
192 2HB GLN 27 2HB GLN 27 -9.248 2.806 6.428
193 1HG GLN 27 1HG GLN 27 -10.337 4.719 7.752
194 2HG GLN 27 2HG GLN 27 -11.620 4.722 6.559
195 1HE2 GLN 27 2HE2 GLN 27 -12.661 4.304 8.781
196 2HE2 GLN 27 1HE2 GLN 27 -12.979 2.648 9.182
197 H ALA 28 H ALA 28 -6.660 3.675 5.569
198 HA ALA 28 HA ALA 28 -5.916 4.348 8.117
199 1HB ALA 28 1HB ALA 28 -3.719 3.749 7.432
200 2HB ALA 28 2HB ALA 28 -4.015 4.268 5.755
201 3HB ALA 28 3HB ALA 28 -4.806 2.804 6.387
202 H LEU 29 H LEU 29 -5.069 6.131 5.058
203 HA LEU 29 HA LEU 29 -3.970 8.312 6.461
204 1HB LEU 29 1HB LEU 29 -3.279 7.783 4.231
205 2HB LEU 29 2HB LEU 29 -4.911 7.953 3.618
206 HG LEU 29 HG LEU 29 -3.724 10.342 4.945
207 1HD1 LEU 29 1HD1 LEU 29 -1.789 9.750 3.740
208 2HD1 LEU 29 2HD1 LEU 29 -2.626 10.955 2.732
209 3HD1 LEU 29 3HD1 LEU 29 -2.728 9.225 2.321
210 1HD2 LEU 29 1HD2 LEU 29 -5.494 9.859 2.538
211 2HD2 LEU 29 2HD2 LEU 29 -4.879 11.462 3.011
212 3HD2 LEU 29 3HD2 LEU 29 -5.944 10.558 4.114
213 H GLU 30 H GLU 30 -7.245 7.422 5.404
214 HA GLU 30 HA GLU 30 -8.297 10.009 5.676
215 1HB GLU 30 1HB GLU 30 -9.189 7.575 4.672
216 2HB GLU 30 2HB GLU 30 -10.172 7.759 6.112
217 1HG GLU 30 1HG GLU 30 -11.446 8.887 4.475
218 2HG GLU 30 2HG GLU 30 -10.602 10.201 5.272
219 HE2 GLU 30 HE GLU 30 -11.123 8.680 2.424
220 H LYS 31 H LYS 31 -7.015 7.897 7.966
221 HA LYS 31 HA LYS 31 -8.721 9.054 10.059
222 1HB LYS 31 1HB LYS 31 -9.269 6.774 10.070
223 2HB LYS 31 2HB LYS 31 -7.623 6.267 9.753
224 1HG LYS 31 1HG LYS 31 -6.920 6.658 11.970
225 2HG LYS 31 2HG LYS 31 -8.184 7.832 12.278
226 1HD LYS 31 1HD LYS 31 -8.658 4.837 11.894
227 2HD LYS 31 2HD LYS 31 -8.567 5.637 13.451
228 1HE LYS 31 1HE LYS 31 -10.773 6.134 13.303
229 2HE LYS 31 2HE LYS 31 -10.439 7.150 11.916
230 1HZ LYS 31 1HZ LYS 31 -11.175 4.284 11.888
231 H TYR 32 H TYR 32 -5.452 8.024 8.985
232 HA TYR 32 HA TYR 32 -4.313 9.440 11.278
233 1HB TYR 32 1HB TYR 32 -3.458 7.399 9.167
234 2HB TYR 32 2HB TYR 32 -2.216 8.303 10.009
235 HD1 TYR 32 HD1 TYR 32 -1.751 7.907 12.373
236 HD2 TYR 32 HD2 TYR 32 -4.833 5.740 10.347
237 HE1 TYR 32 HE1 TYR 32 -1.847 6.239 14.290
238 HE2 TYR 32 HE2 TYR 32 -4.919 4.079 12.271
239 HH TYR 32 HH TYR 32 -3.752 3.321 14.045
240 H ASN 33 H ASN 33 -1.863 10.226 10.329
241 HA ASN 33 HA ASN 33 -2.426 11.825 7.983
242 1HB ASN 33 1HB ASN 33 -2.661 12.962 10.483
243 2HB ASN 33 2HB ASN 33 -0.953 13.222 10.193
244 1HD2 ASN 33 2HD2 ASN 33 -2.953 15.216 10.411
245 2HD2 ASN 33 1HD2 ASN 33 -3.049 16.084 8.916
246 H ILE 34 H ILE 34 -0.125 10.758 10.569
247 HA ILE 34 HA ILE 34 2.210 11.425 9.133
248 HB ILE 34 HB ILE 34 1.796 9.464 11.393
249 1HG1 ILE 34 1HG1 ILE 34 2.871 12.209 11.838
250 2HG1 ILE 34 2HG1 ILE 34 1.152 12.070 11.528
251 1HG2 ILE 34 1HG2 ILE 34 4.362 10.813 11.284
252 2HG2 ILE 34 2HG2 ILE 34 4.055 9.864 9.810
253 3HG2 ILE 34 3HG2 ILE 34 3.984 9.079 11.405
254 1HD1 ILE 34 1HD1 ILE 34 0.736 11.062 13.540
255 2HD1 ILE 34 2HD1 ILE 34 2.320 11.732 14.000
256 3HD1 ILE 34 3HD1 ILE 34 2.195 10.047 13.439
257 H GLU 35 H GLU 35 1.917 10.633 6.984
258 HA GLU 35 HA GLU 35 1.076 8.326 6.098
259 1HB GLU 35 1HB GLU 35 3.729 9.570 5.247
260 2HB GLU 35 2HB GLU 35 2.773 8.462 4.283
261 1HG GLU 35 1HG GLU 35 1.388 10.123 3.586
262 2HG GLU 35 2HG GLU 35 1.106 10.671 5.227
263 HE2 GLU 35 HE GLU 35 3.995 10.640 3.226
264 H LYS 36 H LYS 36 4.229 8.805 7.770
265 HA LYS 36 HA LYS 36 5.348 6.339 7.332
266 1HB LYS 36 1HB LYS 36 5.771 8.598 9.044
267 2HB LYS 36 2HB LYS 36 5.922 7.144 10.010
268 1HG LYS 36 1HG LYS 36 7.401 6.234 8.045
269 2HG LYS 36 2HG LYS 36 7.474 7.900 7.506
270 1HD LYS 36 1HD LYS 36 8.583 8.626 9.502
271 2HD LYS 36 2HD LYS 36 8.141 7.175 10.382
272 1HE LYS 36 1HE LYS 36 9.879 5.943 9.500
273 2HE LYS 36 2HE LYS 36 9.731 6.670 7.912
274 1HZ LYS 36 1HZ LYS 36 10.898 8.613 8.697
275 H ASP 37 H ASP 37 3.146 7.342 10.043
276 HA ASP 37 HA ASP 37 3.043 4.782 11.122
277 1HB ASP 37 1HB ASP 37 2.001 7.362 11.696
278 2HB ASP 37 2HB ASP 37 0.593 6.332 11.548
279 HD2 ASP 37 HD ASP 37 0.973 4.411 14.035
280 H ILE 38 H ILE 38 1.340 6.465 8.497
281 HA ILE 38 HA ILE 38 -0.944 4.840 8.384
282 HB ILE 38 HB ILE 38 0.427 6.409 6.198
283 1HG1 ILE 38 1HG1 ILE 38 -1.566 7.224 8.322
284 2HG1 ILE 38 2HG1 ILE 38 0.022 7.899 8.015
285 1HG2 ILE 38 1HG2 ILE 38 -1.316 6.016 4.843
286 2HG2 ILE 38 2HG2 ILE 38 -2.501 6.093 6.168
287 3HG2 ILE 38 3HG2 ILE 38 -1.581 4.595 5.882
288 1HD1 ILE 38 1HD1 ILE 38 -1.905 7.937 5.717
289 2HD1 ILE 38 2HD1 ILE 38 -0.692 9.146 6.202
290 3HD1 ILE 38 3HD1 ILE 38 -2.240 9.039 7.073
291 H ALA 39 H ALA 39 2.277 4.669 6.751
292 HA ALA 39 HA ALA 39 1.635 2.384 5.238
293 1HB ALA 39 1HB ALA 39 3.567 4.170 5.061
294 2HB ALA 39 2HB ALA 39 3.860 2.490 4.551
295 3HB ALA 39 3HB ALA 39 4.433 3.050 6.140
296 H ALA 40 H ALA 40 3.016 2.922 8.513
297 HA ALA 40 HA ALA 40 3.722 0.229 8.947
298 1HB ALA 40 1HB ALA 40 3.861 0.962 11.317
299 2HB ALA 40 2HB ALA 40 3.059 2.490 10.880
300 3HB ALA 40 3HB ALA 40 4.666 2.108 10.219
301 H TYR 41 H TYR 41 0.701 2.088 9.187
302 HA TYR 41 HA TYR 41 -0.663 0.190 10.798
303 1HB TYR 41 1HB TYR 41 -1.478 2.471 10.679
304 2HB TYR 41 2HB TYR 41 -1.268 2.541 8.940
305 HD1 TYR 41 HD1 TYR 41 -2.841 1.029 7.507
306 HD2 TYR 41 HD2 TYR 41 -3.596 2.049 11.593
307 HE1 TYR 41 HE1 TYR 41 -5.305 0.482 7.195
308 HE2 TYR 41 HE2 TYR 41 -6.057 1.500 11.267
309 HH TYR 41 HH TYR 41 -7.623 1.063 9.802
310 H ILE 42 H ILE 42 -0.272 0.729 7.262
311 HA ILE 42 HA ILE 42 -2.255 -1.114 6.501
312 HB ILE 42 HB ILE 42 0.165 -0.078 5.020
313 1HG1 ILE 42 1HG1 ILE 42 -2.656 0.907 4.669
314 2HG1 ILE 42 2HG1 ILE 42 -1.668 1.533 5.975
315 1HG2 ILE 42 1HG2 ILE 42 -1.233 -2.245 4.269
316 2HG2 ILE 42 2HG2 ILE 42 -0.547 -1.073 3.117
317 3HG2 ILE 42 3HG2 ILE 42 -2.265 -0.973 3.570
318 1HD1 ILE 42 1HD1 ILE 42 -0.274 1.412 3.349
319 2HD1 ILE 42 2HD1 ILE 42 -0.312 2.718 4.561
320 3HD1 ILE 42 3HD1 ILE 42 -1.658 2.530 3.411
321 H LYS 43 H LYS 43 1.361 -1.378 6.724
322 HA LYS 43 HA LYS 43 1.522 -4.034 6.000
323 1HB LYS 43 1HB LYS 43 3.470 -2.640 6.082
324 2HB LYS 43 2HB LYS 43 3.262 -2.326 7.793
325 1HG LYS 43 1HG LYS 43 3.343 -5.049 7.868
326 2HG LYS 43 2HG LYS 43 4.300 -4.788 6.423
327 1HD LYS 43 1HD LYS 43 5.913 -4.743 8.156
328 2HD LYS 43 2HD LYS 43 5.633 -3.044 7.826
329 1HE LYS 43 1HE LYS 43 3.667 -3.663 9.737
330 2HE LYS 43 2HE LYS 43 5.050 -4.600 10.268
331 1HZ LYS 43 1HZ LYS 43 5.067 -1.679 9.719
332 H LYS 44 H LYS 44 1.028 -2.540 9.255
333 HA LYS 44 HA LYS 44 1.028 -4.982 10.634
334 1HB LYS 44 1HB LYS 44 1.429 -3.101 11.941
335 2HB LYS 44 2HB LYS 44 0.120 -2.181 11.228
336 1HG LYS 44 1HG LYS 44 -1.525 -3.787 12.298
337 2HG LYS 44 2HG LYS 44 -0.181 -4.586 13.090
338 1HD LYS 44 1HD LYS 44 -0.853 -1.622 13.408
339 2HD LYS 44 2HD LYS 44 -1.332 -2.869 14.542
340 1HE LYS 44 1HE LYS 44 1.576 -2.341 13.772
341 2HE LYS 44 2HE LYS 44 0.801 -1.598 15.158
342 1HZ LYS 44 1HZ LYS 44 2.020 -3.722 15.646
343 H GLU 45 H GLU 45 -1.509 -3.092 8.947
344 HA GLU 45 HA GLU 45 -3.701 -4.373 9.930
345 1HB GLU 45 1HB GLU 45 -3.517 -2.369 8.301
346 2HB GLU 45 2HB GLU 45 -3.411 -3.555 7.016
347 1HG GLU 45 1HG GLU 45 -5.707 -3.263 9.009
348 2HG GLU 45 2HG GLU 45 -5.751 -2.828 7.312
349 HE2 GLU 45 HE GLU 45 -6.721 -5.444 6.143
350 H PHE 46 H PHE 46 -1.819 -5.217 6.931
351 HA PHE 46 HA PHE 46 -3.269 -7.623 6.553
352 1HB PHE 46 1HB PHE 46 -0.895 -6.123 5.446
353 2HB PHE 46 2HB PHE 46 -0.887 -7.848 5.140
354 HD1 PHE 46 HD1 PHE 46 -3.975 -5.844 5.333
355 HD2 PHE 46 HD2 PHE 46 -1.146 -7.704 2.774
356 HE1 PHE 46 HE1 PHE 46 -5.518 -5.506 3.383
357 HE2 PHE 46 HE2 PHE 46 -2.690 -7.365 0.823
358 HZ PHE 46 HZ PHE 46 -4.857 -6.271 1.150
359 H ASP 47 H ASP 47 -0.026 -6.775 7.909
360 HA ASP 47 HA ASP 47 1.011 -9.243 8.169
361 1HB ASP 47 1HB ASP 47 1.186 -6.699 9.755
362 2HB ASP 47 2HB ASP 47 1.837 -8.133 10.523
363 HD2 ASP 47 HD ASP 47 4.788 -7.453 8.927
364 H LYS 48 H LYS 48 -1.696 -7.744 9.885
365 HA LYS 48 HA LYS 48 -1.797 -9.016 12.266
366 1HB LYS 48 1HB LYS 48 -4.013 -8.317 10.328
367 2HB LYS 48 2HB LYS 48 -4.326 -8.926 11.940
368 1HG LYS 48 1HG LYS 48 -2.363 -6.862 12.232
369 2HG LYS 48 2HG LYS 48 -3.569 -6.239 11.124
370 1HD LYS 48 1HD LYS 48 -5.146 -6.056 12.764
371 2HD LYS 48 2HD LYS 48 -4.807 -7.658 13.389
372 1HE LYS 48 1HE LYS 48 -2.518 -6.167 14.093
373 2HE LYS 48 2HE LYS 48 -3.840 -5.044 14.340
374 1HZ LYS 48 1HZ LYS 48 -4.914 -6.636 15.782
375 H LYS 49 H LYS 49 -3.992 -10.317 9.737
376 HA LYS 49 HA LYS 49 -2.821 -12.959 10.186
377 1HB LYS 49 1HB LYS 49 -5.131 -13.898 10.380
378 2HB LYS 49 2HB LYS 49 -4.621 -12.928 11.747
379 1HG LYS 49 1HG LYS 49 -6.306 -11.438 11.426
380 2HG LYS 49 2HG LYS 49 -5.886 -11.226 9.739
381 1HD LYS 49 1HD LYS 49 -7.018 -13.730 9.646
382 2HD LYS 49 2HD LYS 49 -7.920 -13.032 10.976
383 1HE LYS 49 1HE LYS 49 -7.689 -11.087 8.807
384 2HE LYS 49 2HE LYS 49 -8.333 -12.595 8.188
385 1HZ LYS 49 1HZ LYS 49 -9.478 -10.856 10.268
386 H TYR 50 H TYR 50 -1.857 -12.178 8.060
387 HA TYR 50 HA TYR 50 -3.691 -12.985 5.923
388 1HB TYR 50 1HB TYR 50 -3.227 -10.385 6.331
389 2HB TYR 50 2HB TYR 50 -1.617 -10.731 5.730
390 HD1 TYR 50 HD1 TYR 50 -4.452 -9.239 4.733
391 HD2 TYR 50 HD2 TYR 50 -1.963 -12.486 3.483
392 HE1 TYR 50 HE1 TYR 50 -5.279 -8.962 2.345
393 HE2 TYR 50 HE2 TYR 50 -2.799 -12.198 1.099
394 HH TYR 50 HH TYR 50 -3.886 -10.869 -0.277
395 H ASN 51 H ASN 51 -0.274 -11.784 6.237
396 HA ASN 51 HA ASN 51 0.850 -14.296 5.946
397 1HB ASN 51 1HB ASN 51 -0.209 -13.721 3.551
398 2HB ASN 51 2HB ASN 51 1.209 -12.707 3.384
399 1HD2 ASN 51 2HD2 ASN 51 0.116 -15.455 2.378
400 2HD2 ASN 51 1HD2 ASN 51 1.506 -16.487 2.401
401 HA PRO 52 HA PRO 52 3.453 -10.677 7.025
402 1HB PRO 52 1HB PRO 52 4.093 -11.405 9.581
403 2HB PRO 52 2HB PRO 52 2.760 -10.335 9.194
404 1HG PRO 52 1HG PRO 52 2.679 -13.174 10.015
405 2HG PRO 52 2HG PRO 52 1.390 -11.988 10.039
406 1HD PRO 52 1HD PRO 52 1.748 -14.096 8.127
407 2HD PRO 52 2HD PRO 52 0.527 -12.839 8.086
408 H THR 53 H THR 53 6.752 -11.729 7.058
409 HA THR 53 HA THR 53 4.707 -9.827 7.950
410 HB THR 53 HB THR 53 6.774 -10.124 9.333
411 HG1 THR 53 HG1 THR 53 6.729 -7.681 7.707
412 1HG2 THR 53 1HG2 THR 53 8.216 -8.947 6.902
413 2HG2 THR 53 2HG2 THR 53 8.341 -10.656 7.384
414 3HG2 THR 53 3HG2 THR 53 8.942 -9.381 8.471
415 H TRP 54 H TRP 54 4.525 -7.724 6.977
416 HA TRP 54 HA TRP 54 5.180 -7.863 4.122
417 1HB TRP 54 1HB TRP 54 3.087 -6.250 5.593
418 2HB TRP 54 2HB TRP 54 3.402 -6.162 3.871
419 HD1 TRP 54 HD TRP 54 2.376 -8.948 6.424
420 HE1 TRP 54 HE1 TRP 54 0.703 -10.653 5.301
421 HE3 TRP 54 HE3 TRP 54 2.473 -6.813 1.811
422 HZ2 TRP 54 HZ2 TRP 54 -0.368 -10.911 2.668
423 HZ3 TRP 54 HZ3 TRP 54 1.085 -7.854 0.019
424 HH2 TRP 54 HH TRP 54 -0.301 -9.833 0.389
425 H HIS 55 H HIS 55 5.576 -5.531 3.174
426 HA HIS 55 HA HIS 55 6.977 -3.864 5.098
427 1HB HIS 55 1HB HIS 55 8.233 -5.027 2.601
428 2HB HIS 55 2HB HIS 55 8.901 -3.670 3.483
429 HD1 HIS 55 HD1 HIS 55 9.937 -4.149 5.854
430 HD2 HIS 55 HD2 HIS 55 8.595 -7.552 3.801
431 HE1 HIS 55 HE1 HIS 55 10.925 -6.159 7.078
432 H CYS 56 H CYS 56 6.149 -1.852 4.887
433 HA CYS 56 HA CYS 56 5.172 -1.123 2.223
434 1HB CYS 56 1HB CYS 56 3.478 -1.293 4.118
435 2HB CYS 56 2HB CYS 56 4.267 0.093 4.846
436 HG CYS 56 HG CYS 56 3.565 0.154 1.649
437 H ILE 57 H ILE 57 5.825 0.937 1.384
438 HA ILE 57 HA ILE 57 7.771 2.385 3.030
439 HB ILE 57 HB ILE 57 8.086 1.438 0.188
440 1HG1 ILE 57 1HG1 ILE 57 8.776 -0.125 1.954
441 2HG1 ILE 57 2HG1 ILE 57 10.134 0.435 0.999
442 1HG2 ILE 57 1HG2 ILE 57 10.236 2.785 0.248
443 2HG2 ILE 57 2HG2 ILE 57 9.541 3.654 1.637
444 3HG2 ILE 57 3HG2 ILE 57 8.726 3.706 0.056
445 1HD1 ILE 57 1HD1 ILE 57 10.960 0.651 3.186
446 2HD1 ILE 57 2HD1 ILE 57 9.385 1.162 3.837
447 3HD1 ILE 57 3HD1 ILE 57 10.357 2.296 2.867
448 H VAL 58 H VAL 58 7.925 4.675 2.547
449 HA VAL 58 HA VAL 58 5.778 5.674 0.833
450 HB VAL 58 HB VAL 58 5.141 5.504 3.308
451 1HG1 VAL 58 1HG1 VAL 58 6.336 6.557 4.873
452 2HG1 VAL 58 2HG1 VAL 58 6.295 8.085 3.960
453 3HG1 VAL 58 3HG1 VAL 58 7.566 6.885 3.629
454 1HG2 VAL 58 1HG2 VAL 58 4.487 7.321 1.291
455 2HG2 VAL 58 2HG2 VAL 58 4.764 8.335 2.728
456 3HG2 VAL 58 3HG2 VAL 58 3.574 7.013 2.788
457 H GLY 59 H GLY 59 6.111 8.325 0.948
458 1HA GLY 59 2HA GLY 59 8.083 9.859 1.245
459 2HA GLY 59 1HA GLY 59 8.968 8.688 0.285
460 H ARG 60 H ARG 60 9.164 9.212 -1.842
461 HA ARG 60 HA ARG 60 6.841 10.116 -3.224
462 1HB ARG 60 1HB ARG 60 8.695 12.054 -2.233
463 2HB ARG 60 2HB ARG 60 9.016 11.932 -3.952
464 1HG ARG 60 1HG ARG 60 6.549 12.242 -4.401
465 2HG ARG 60 2HG ARG 60 6.289 12.458 -2.681
466 1HD ARG 60 1HD ARG 60 6.505 14.686 -3.382
467 2HD ARG 60 2HD ARG 60 8.150 14.333 -2.891
468 HE ARG 60 HE ARG 60 7.599 13.714 -5.710
469 1HH1 ARG 60 2HH2 ARG 60 8.670 16.210 -3.434
470 2HH1 ARG 60 1HH2 ARG 60 9.501 17.130 -4.643
471 1HH2 ARG 60 1HH ARG 60 9.502 16.359 -6.911
472 H ASN 61 H ASN 61 8.925 7.870 -3.105
473 HA ASN 61 HA ASN 61 9.673 8.054 -5.912
474 1HB ASN 61 1HB ASN 61 11.783 6.815 -5.372
475 2HB ASN 61 2HB ASN 61 11.723 8.361 -4.549
476 1HD2 ASN 61 2HD2 ASN 61 13.077 5.758 -3.980
477 2HD2 ASN 61 1HD2 ASN 61 12.663 5.348 -2.349
478 H PHE 62 H PHE 62 10.242 5.662 -6.720
479 HA PHE 62 HA PHE 62 8.951 3.583 -5.208
480 1HB PHE 62 1HB PHE 62 6.974 4.370 -6.320
481 2HB PHE 62 2HB PHE 62 7.874 4.918 -7.721
482 HD1 PHE 62 HD1 PHE 62 7.267 1.672 -5.960
483 HD2 PHE 62 HD2 PHE 62 7.487 3.744 -9.656
484 HE1 PHE 62 HE1 PHE 62 6.653 -0.436 -7.178
485 HE2 PHE 62 HE2 PHE 62 6.873 1.638 -10.875
486 HZ PHE 62 HZ PHE 62 6.463 -0.426 -9.620
487 H GLY 63 H GLY 63 10.959 2.495 -5.241
488 1HA GLY 63 2HA GLY 63 11.734 1.494 -7.910
489 2HA GLY 63 1HA GLY 63 12.928 2.093 -6.777
490 H SER 64 H SER 64 10.299 -0.354 -7.174
491 HA SER 64 HA SER 64 11.899 -2.378 -6.152
492 1HB SER 64 1HB SER 64 10.311 -2.816 -4.096
493 2HB SER 64 2HB SER 64 11.653 -1.703 -3.934
494 HG SER 64 HG SER 64 10.053 0.033 -4.531
495 H TYR 65 H TYR 65 11.000 -3.076 -8.267
496 HA TYR 65 HA TYR 65 8.615 -4.619 -7.892
497 1HB TYR 65 1HB TYR 65 8.126 -2.071 -8.620
498 2HB TYR 65 2HB TYR 65 8.728 -2.590 -10.182
499 HD1 TYR 65 HD1 TYR 65 5.841 -2.199 -8.229
500 HD2 TYR 65 HD2 TYR 65 7.597 -4.846 -11.096
501 HE1 TYR 65 HE1 TYR 65 3.537 -3.092 -8.827
502 HE2 TYR 65 HE2 TYR 65 5.286 -5.729 -11.684
503 HH TYR 65 HH TYR 65 2.790 -5.570 -9.901
504 H VAL 66 H VAL 66 11.003 -3.222 -10.227
505 HA VAL 66 HA VAL 66 11.168 -5.906 -11.414
506 HB VAL 66 HB VAL 66 11.699 -3.318 -12.862
507 1HG1 VAL 66 1HG1 VAL 66 12.285 -5.931 -13.519
508 2HG1 VAL 66 2HG1 VAL 66 12.113 -4.584 -14.671
509 3HG1 VAL 66 3HG1 VAL 66 10.733 -5.662 -14.349
510 1HG2 VAL 66 1HG2 VAL 66 9.401 -3.165 -12.159
511 2HG2 VAL 66 2HG2 VAL 66 9.085 -4.845 -12.654
512 3HG2 VAL 66 3HG2 VAL 66 9.429 -3.604 -13.883
513 H THR 67 H THR 67 12.677 -5.758 -9.283
514 HA THR 67 HA THR 67 15.349 -5.491 -10.368
515 HB THR 67 HB THR 67 14.210 -3.749 -8.142
516 HG1 THR 67 HG1 THR 67 14.904 -2.228 -9.648
517 1HG2 THR 67 1HG2 THR 67 17.151 -4.363 -8.750
518 2HG2 THR 67 2HG2 THR 67 16.306 -4.757 -7.234
519 3HG2 THR 67 3HG2 THR 67 16.575 -3.057 -7.687
520 H HIS 68 H HIS 68 13.639 -5.886 -7.187
521 HA HIS 68 HA HIS 68 15.279 -8.285 -6.839
522 1HB HIS 68 1HB HIS 68 14.300 -6.167 -5.004
523 2HB HIS 68 2HB HIS 68 14.264 -7.800 -4.372
524 HD1 HIS 68 HD1 HIS 68 16.817 -9.068 -5.239
525 HD2 HIS 68 HD2 HIS 68 16.618 -5.018 -4.166
526 HE1 HIS 68 HE1 HIS 68 19.189 -8.381 -4.596
527 H GLU 69 H GLU 69 11.994 -6.940 -6.994
528 HA GLU 69 HA GLU 69 10.036 -7.867 -7.130
529 1HB GLU 69 1HB GLU 69 11.654 -10.348 -7.838
530 2HB GLU 69 2HB GLU 69 9.903 -10.316 -7.898
531 1HG GLU 69 1HG GLU 69 10.415 -8.053 -9.326
532 2HG GLU 69 2HG GLU 69 11.894 -8.928 -9.669
533 HE2 GLU 69 HE GLU 69 10.776 -11.228 -11.556
534 H THR 70 H THR 70 8.427 -9.088 -5.890
535 HA THR 70 HA THR 70 9.517 -10.485 -3.553
536 HB THR 70 HB THR 70 8.199 -9.124 -2.055
537 HG1 THR 70 HG1 THR 70 6.270 -8.719 -3.118
538 1HG2 THR 70 1HG2 THR 70 9.241 -7.058 -2.254
539 2HG2 THR 70 2HG2 THR 70 8.807 -6.899 -3.973
540 3HG2 THR 70 3HG2 THR 70 10.194 -7.908 -3.494
541 H ARG 71 H ARG 71 6.685 -10.496 -2.462
542 HA ARG 71 HA ARG 71 5.871 -12.711 -4.128
543 1HB ARG 71 1HB ARG 71 5.354 -11.880 -1.261
544 2HB ARG 71 2HB ARG 71 4.201 -12.948 -2.039
545 1HG ARG 71 1HG ARG 71 7.062 -13.711 -2.420
546 2HG ARG 71 2HG ARG 71 6.493 -13.798 -0.764
547 1HD ARG 71 1HD ARG 71 4.613 -15.261 -1.444
548 2HD ARG 71 2HD ARG 71 5.066 -15.107 -3.130
549 HE ARG 71 HE ARG 71 7.360 -16.038 -1.734
550 1HH1 ARG 71 2HH2 ARG 71 4.109 -17.191 -2.545
551 2HH1 ARG 71 1HH2 ARG 71 4.565 -18.862 -2.538
552 1HH2 ARG 71 1HH ARG 71 6.836 -19.457 -2.053
553 H HIS 72 H HIS 72 4.288 -10.021 -2.235
554 HA HIS 72 HA HIS 72 2.567 -9.555 -4.530
555 1HB HIS 72 1HB HIS 72 1.688 -10.479 -1.826
556 2HB HIS 72 2HB HIS 72 0.704 -9.278 -2.640
557 HD1 HIS 72 HD1 HIS 72 0.079 -10.033 -5.287
558 HD2 HIS 72 HD2 HIS 72 1.028 -13.036 -2.514
559 HE1 HIS 72 HE1 HIS 72 -0.854 -12.209 -6.240
560 H PHE 73 H PHE 73 2.747 -7.436 -5.034
561 HA PHE 73 HA PHE 73 3.084 -5.576 -2.791
562 1HB PHE 73 1HB PHE 73 4.407 -4.328 -4.803
563 2HB PHE 73 2HB PHE 73 5.226 -5.495 -3.785
564 HD1 PHE 73 HD1 PHE 73 2.878 -5.891 -6.666
565 HD2 PHE 73 HD2 PHE 73 6.722 -6.695 -5.060
566 HE1 PHE 73 HE1 PHE 73 3.434 -7.267 -8.689
567 HE2 PHE 73 HE2 PHE 73 7.280 -8.070 -7.084
568 HZ PHE 73 HZ PHE 73 5.630 -8.340 -8.874
569 H ILE 74 H ILE 74 2.559 -3.236 -3.503
570 HA ILE 74 HA ILE 74 0.846 -2.961 -5.766
571 HB ILE 74 HB ILE 74 -0.889 -3.900 -4.628
572 1HG1 ILE 74 1HG1 ILE 74 -0.963 -0.994 -3.770
573 2HG1 ILE 74 2HG1 ILE 74 -1.515 -1.638 -5.303
574 1HG2 ILE 74 1HG2 ILE 74 0.299 -4.397 -2.567
575 2HG2 ILE 74 2HG2 ILE 74 -1.302 -3.702 -2.212
576 3HG2 ILE 74 3HG2 ILE 74 0.161 -2.698 -2.051
577 1HD1 ILE 74 1HD1 ILE 74 -2.746 -1.915 -2.567
578 2HD1 ILE 74 2HD1 ILE 74 -2.988 -3.233 -3.739
579 3HD1 ILE 74 3HD1 ILE 74 -3.527 -1.583 -4.131
580 H TYR 75 H TYR 75 1.298 -0.973 -6.534
581 HA TYR 75 HA TYR 75 2.180 1.028 -4.564
582 1HB TYR 75 1HB TYR 75 3.927 0.344 -6.181
583 2HB TYR 75 2HB TYR 75 2.789 0.408 -7.512
584 HD1 TYR 75 HD1 TYR 75 3.226 2.128 -8.992
585 HD2 TYR 75 HD2 TYR 75 3.857 2.805 -4.815
586 HE1 TYR 75 HE1 TYR 75 3.940 4.519 -9.480
587 HE2 TYR 75 HE2 TYR 75 4.568 5.193 -5.317
588 HH TYR 75 HH TYR 75 5.566 6.394 -7.296
589 H PHE 76 H PHE 76 0.768 2.664 -4.222
590 HA PHE 76 HA PHE 76 -0.621 3.773 -6.495
591 1HB PHE 76 1HB PHE 76 -2.813 3.577 -5.138
592 2HB PHE 76 2HB PHE 76 -2.210 2.055 -5.765
593 HD1 PHE 76 HD1 PHE 76 -3.570 3.551 -2.970
594 HD2 PHE 76 HD2 PHE 76 -0.458 0.879 -4.057
595 HE1 PHE 76 HE1 PHE 76 -3.586 2.591 -0.651
596 HE2 PHE 76 HE2 PHE 76 -0.474 -0.083 -1.738
597 HZ PHE 76 HZ PHE 76 -2.037 0.785 -0.063
598 H TYR 77 H TYR 77 -2.224 5.618 -5.456
599 HA TYR 77 HA TYR 77 -0.426 7.151 -3.731
600 1HB TYR 77 1HB TYR 77 -1.490 7.809 -6.090
601 2HB TYR 77 2HB TYR 77 -2.983 8.011 -5.195
602 HD1 TYR 77 HD1 TYR 77 -3.491 10.229 -4.788
603 HD2 TYR 77 HD2 TYR 77 0.603 9.001 -4.627
604 HE1 TYR 77 HE1 TYR 77 -2.798 12.598 -4.179
605 HE2 TYR 77 HE2 TYR 77 1.283 11.373 -4.018
606 HH TYR 77 HH TYR 77 -1.171 13.873 -3.493
607 H LEU 78 H LEU 78 -0.909 7.531 -1.624
608 HA LEU 78 HA LEU 78 -3.644 6.879 -0.785
609 1HB LEU 78 1HB LEU 78 -1.228 5.874 0.090
610 2HB LEU 78 2HB LEU 78 -1.595 7.096 1.291
611 HG LEU 78 HG LEU 78 -2.374 4.684 1.709
612 1HD1 LEU 78 1HD1 LEU 78 -4.817 5.964 2.256
613 2HD1 LEU 78 2HD1 LEU 78 -3.571 7.233 2.326
614 3HD1 LEU 78 3HD1 LEU 78 -3.414 5.777 3.335
615 1HD2 LEU 78 1HD2 LEU 78 -4.748 5.444 0.019
616 2HD2 LEU 78 2HD2 LEU 78 -4.296 3.856 0.681
617 3HD2 LEU 78 3HD2 LEU 78 -3.366 4.556 -0.666
618 H GLY 79 H GLY 79 -4.909 8.635 -0.523
619 1HA GLY 79 2HA GLY 79 -5.588 10.668 0.159
620 2HA GLY 79 1HA GLY 79 -4.180 10.748 1.199
621 H GLN 80 H GLN 80 -2.215 11.738 0.452
622 HA GLN 80 HA GLN 80 -2.389 12.930 -2.186
623 1HB GLN 80 1HB GLN 80 -1.706 15.134 -1.330
624 2HB GLN 80 2HB GLN 80 -3.217 14.639 -0.593
625 1HG GLN 80 1HG GLN 80 -1.205 13.584 1.107
626 2HG GLN 80 2HG GLN 80 -0.633 15.184 0.675
627 1HE2 GLN 80 2HE2 GLN 80 -2.472 13.456 2.786
628 2HE2 GLN 80 1HE2 GLN 80 -3.501 14.692 3.427
629 H VAL 81 H VAL 81 -0.889 10.655 -0.860
630 HA VAL 81 HA VAL 81 1.761 11.569 -1.656
631 HB VAL 81 HB VAL 81 2.783 10.510 0.289
632 1HG1 VAL 81 1HG1 VAL 81 0.749 12.459 1.368
633 2HG1 VAL 81 2HG1 VAL 81 1.993 12.978 0.206
634 3HG1 VAL 81 3HG1 VAL 81 2.474 12.289 1.774
635 1HG2 VAL 81 1HG2 VAL 81 0.390 9.189 0.607
636 2HG2 VAL 81 2HG2 VAL 81 0.332 10.397 1.914
637 3HG2 VAL 81 3HG2 VAL 81 1.698 9.259 1.813
638 H ALA 82 H ALA 82 3.256 9.402 -1.547
639 HA ALA 82 HA ALA 82 1.733 7.474 -3.124
640 1HB ALA 82 1HB ALA 82 4.641 8.254 -2.874
641 2HB ALA 82 2HB ALA 82 3.612 8.196 -4.325
642 3HB ALA 82 3HB ALA 82 4.186 6.685 -3.579
643 H ILE 83 H ILE 83 2.129 5.133 -2.758
644 HA ILE 83 HA ILE 83 3.264 4.404 -0.219
645 HB ILE 83 HB ILE 83 0.807 5.219 0.090
646 1HG1 ILE 83 1HG1 ILE 83 1.350 2.530 1.302
647 2HG1 ILE 83 2HG1 ILE 83 2.464 3.843 1.624
648 1HG2 ILE 83 1HG2 ILE 83 0.210 2.364 -0.677
649 2HG2 ILE 83 2HG2 ILE 83 0.044 3.708 -1.832
650 3HG2 ILE 83 3HG2 ILE 83 -0.920 3.695 -0.336
651 1HD1 ILE 83 1HD1 ILE 83 0.457 5.272 2.301
652 2HD1 ILE 83 2HD1 ILE 83 0.796 3.891 3.371
653 3HD1 ILE 83 3HD1 ILE 83 -0.530 3.795 2.188
654 H LEU 84 H LEU 84 4.376 2.560 -0.568
655 HA LEU 84 HA LEU 84 3.306 0.746 -2.613
656 1HB LEU 84 1HB LEU 84 5.344 0.487 -3.644
657 2HB LEU 84 2HB LEU 84 5.262 2.212 -3.348
658 HG LEU 84 HG LEU 84 6.587 1.522 -1.131
659 1HD1 LEU 84 1HD1 LEU 84 6.409 -0.944 -2.089
660 2HD1 LEU 84 2HD1 LEU 84 7.844 -0.380 -1.201
661 3HD1 LEU 84 3HD1 LEU 84 7.866 -0.441 -2.979
662 1HD2 LEU 84 1HD2 LEU 84 7.818 3.038 -2.214
663 2HD2 LEU 84 2HD2 LEU 84 7.352 2.413 -3.814
664 3HD2 LEU 84 3HD2 LEU 84 8.683 1.648 -2.913
665 H LEU 85 H LEU 85 2.861 -1.217 -1.778
666 HA LEU 85 HA LEU 85 4.386 -1.999 0.609
667 1HB LEU 85 1HB LEU 85 2.133 -1.458 1.225
668 2HB LEU 85 2HB LEU 85 1.480 -2.442 -0.069
669 HG LEU 85 HG LEU 85 3.171 -4.055 1.634
670 1HD1 LEU 85 1HD1 LEU 85 1.150 -3.773 3.474
671 2HD1 LEU 85 2HD1 LEU 85 1.481 -2.090 3.003
672 3HD1 LEU 85 3HD1 LEU 85 2.796 -3.115 3.626
673 1HD2 LEU 85 1HD2 LEU 85 1.048 -5.367 1.851
674 2HD2 LEU 85 2HD2 LEU 85 1.557 -5.041 0.176
675 3HD2 LEU 85 3HD2 LEU 85 0.234 -4.099 0.905
676 H PHE 86 H PHE 86 4.913 -4.270 0.805
677 HA PHE 86 HA PHE 86 4.336 -5.988 -1.410
678 1HB PHE 86 1HB PHE 86 6.791 -6.255 -1.962
679 2HB PHE 86 2HB PHE 86 6.237 -4.624 -2.283
680 HD1 PHE 86 HD1 PHE 86 8.539 -6.659 -0.432
681 HD2 PHE 86 HD2 PHE 86 6.747 -2.817 -0.588
682 HE1 PHE 86 HE1 PHE 86 10.357 -5.753 1.041
683 HE2 PHE 86 HE2 PHE 86 8.566 -1.909 0.886
684 HZ PHE 86 HZ PHE 86 10.349 -3.388 1.682
685 H LYS 87 H LYS 87 4.818 -8.204 -0.941
686 HA LYS 87 HA LYS 87 5.388 -8.626 1.894
687 1HB LYS 87 1HB LYS 87 3.360 -9.631 1.455
688 2HB LYS 87 2HB LYS 87 3.796 -10.079 -0.183
689 1HG LYS 87 1HG LYS 87 3.850 -12.139 0.998
690 2HG LYS 87 2HG LYS 87 5.538 -11.683 0.879
691 1HD LYS 87 1HD LYS 87 4.342 -10.494 3.268
692 2HD LYS 87 2HD LYS 87 4.062 -12.225 3.252
693 1HE LYS 87 1HE LYS 87 6.770 -10.835 2.975
694 2HE LYS 87 2HE LYS 87 6.205 -11.726 4.373
695 1HZ LYS 87 1HZ LYS 87 6.139 -13.210 1.877
696 H SER 88 H SER 88 7.566 -8.774 2.216
697 HA SER 88 HA SER 88 9.016 -10.413 0.294
698 1HB SER 88 1HB SER 88 9.897 -8.138 0.511
699 2HB SER 88 2HB SER 88 9.980 -8.287 2.254
700 HG SER 88 HG SER 88 11.365 -10.287 0.817
701 H GLY 89 H GLY 89 9.132 -9.548 3.837
702 1HA GLY 89 2HA GLY 89 9.335 -10.841 5.668
703 2HA GLY 89 1HA GLY 89 8.837 -12.224 4.712