Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | in_recoord | stage | position | program | type |
|
|
27860 | 2sob RC | 4010 | cing | recoord | 1-original | 6 | MR format | nomenclature mapping |
Entry H atom name Orig H atom name
Start of MODEL 1
Raw file had 866 H/Q atoms
Start of MODEL 1
1 1H ALA 1 2H ALA 1 -1.266 19.715 -20.071
2 2H ALA 1 1H ALA 1 -2.378 19.179 -21.238
3 3H ALA 1 3H ALA 1 -2.859 19.336 -19.620
4 HA ALA 1 HA ALA 1 -1.407 17.559 -18.946
5 1HB ALA 1 2HB ALA 1 -3.132 16.897 -21.353
6 2HB ALA 1 1HB ALA 1 -2.496 15.703 -20.221
7 3HB ALA 1 3HB ALA 1 -3.649 16.919 -19.667
8 H THR 2 H THR 2 0.565 16.648 -19.271
9 HA THR 2 HA THR 2 1.669 16.626 -22.056
10 HB THR 2 HB THR 2 3.926 16.895 -20.971
11 HG1 THR 2 HG1 THR 2 3.905 16.590 -18.902
12 1HG2 THR 2 2HG2 THR 2 1.894 19.081 -20.440
13 2HG2 THR 2 1HG2 THR 2 3.642 19.309 -20.493
14 3HG2 THR 2 3HG2 THR 2 2.771 18.824 -21.948
15 H SER 3 H SER 3 2.993 14.807 -22.603
16 HA SER 3 HA SER 3 2.215 12.329 -21.292
17 1HB SER 3 2HB SER 3 3.940 13.056 -23.640
18 2HB SER 3 1HB SER 3 4.064 11.438 -22.956
19 HG SER 3 HG SER 3 1.934 12.695 -24.258
20 H THR 4 H THR 4 3.048 12.299 -19.199
21 HA THR 4 HA THR 4 6.025 12.131 -18.995
22 HB THR 4 HB THR 4 5.128 14.318 -18.114
23 HG1 THR 4 HG1 THR 4 6.777 14.141 -16.865
24 1HG2 THR 4 1HG2 THR 4 2.970 13.295 -17.271
25 2HG2 THR 4 3HG2 THR 4 3.897 12.611 -15.937
26 3HG2 THR 4 2HG2 THR 4 3.781 14.359 -16.124
27 H LYS 5 H LYS 5 3.938 10.028 -19.245
28 HA LYS 5 HA LYS 5 4.070 8.756 -16.551
29 1HB LYS 5 2HB LYS 5 1.967 8.982 -18.338
30 2HB LYS 5 1HB LYS 5 2.551 7.343 -18.625
31 1HG LYS 5 2HG LYS 5 2.601 7.268 -15.965
32 2HG LYS 5 1HG LYS 5 1.385 8.534 -16.139
33 1HD LYS 5 2HD LYS 5 0.107 6.554 -16.116
34 2HD LYS 5 1HD LYS 5 0.257 6.924 -17.834
35 1HE LYS 5 2HE LYS 5 0.792 4.624 -17.704
36 2HE LYS 5 1HE LYS 5 2.363 5.421 -17.774
37 1HZ LYS 5 2HZ LYS 5 1.026 4.715 -15.223
38 2HZ LYS 5 1HZ LYS 5 2.107 3.672 -16.017
39 3HZ LYS 5 3HZ LYS 5 2.644 5.182 -15.459
40 H LYS 6 H LYS 6 5.234 6.914 -16.235
41 HA LYS 6 HA LYS 6 6.015 5.045 -18.262
42 1HB LYS 6 2HB LYS 6 8.518 5.570 -18.167
43 2HB LYS 6 1HB LYS 6 7.534 6.667 -19.134
44 1HG LYS 6 2HG LYS 6 7.389 8.171 -17.094
45 2HG LYS 6 1HG LYS 6 8.597 7.133 -16.335
46 1HD LYS 6 2HD LYS 6 10.243 7.677 -17.963
47 2HD LYS 6 1HD LYS 6 9.047 8.379 -19.051
48 1HE LYS 6 2HE LYS 6 9.998 10.286 -18.091
49 2HE LYS 6 1HE LYS 6 8.590 10.025 -17.062
50 1HZ LYS 6 2HZ LYS 6 11.250 8.881 -16.433
51 2HZ LYS 6 1HZ LYS 6 10.774 10.421 -15.897
52 3HZ LYS 6 3HZ LYS 6 9.907 9.049 -15.403
53 H LEU 7 H LEU 7 6.811 6.525 -15.142
54 HA LEU 7 HA LEU 7 7.089 5.546 -13.037
55 1HB LEU 7 2HB LEU 7 6.743 2.838 -14.346
56 2HB LEU 7 1HB LEU 7 6.512 3.258 -12.652
57 HG LEU 7 HG LEU 7 4.870 4.845 -14.522
58 1HD1 LEU 7 2HD1 LEU 7 4.822 1.867 -14.504
59 2HD1 LEU 7 1HD1 LEU 7 3.262 2.684 -14.421
60 3HD1 LEU 7 3HD1 LEU 7 4.348 2.993 -15.776
61 1HD2 LEU 7 1HD2 LEU 7 4.802 4.724 -11.945
62 2HD2 LEU 7 3HD2 LEU 7 3.257 4.621 -12.789
63 3HD2 LEU 7 2HD2 LEU 7 4.018 3.159 -12.160
64 H HIS 8 H HIS 8 9.045 5.434 -12.096
65 HA HIS 8 HA HIS 8 11.389 4.626 -13.663
66 1HB HIS 8 2HB HIS 8 11.079 5.673 -10.830
67 2HB HIS 8 1HB HIS 8 12.635 5.321 -11.582
68 HD1 HIS 8 HD1 HIS 8 10.102 7.939 -11.295
69 HD2 HIS 8 HD2 HIS 8 13.088 6.948 -14.030
70 HE1 HIS 8 HE1 HIS 8 10.479 9.997 -12.721
71 H LYS 9 H LYS 9 12.489 3.703 -10.776
72 HA LYS 9 HA LYS 9 11.214 1.207 -10.200
73 1HB LYS 9 2HB LYS 9 13.046 -0.277 -11.180
74 2HB LYS 9 1HB LYS 9 11.923 0.414 -12.344
75 1HG LYS 9 2HG LYS 9 13.528 1.684 -13.327
76 2HG LYS 9 1HG LYS 9 14.262 2.119 -11.783
77 1HD LYS 9 2HD LYS 9 15.835 0.515 -11.985
78 2HD LYS 9 1HD LYS 9 14.625 -0.711 -12.367
79 1HE LYS 9 2HE LYS 9 14.627 -0.105 -14.694
80 2HE LYS 9 1HE LYS 9 15.599 1.332 -14.380
81 1HZ LYS 9 1HZ LYS 9 17.413 -0.100 -13.664
82 2HZ LYS 9 3HZ LYS 9 16.477 -1.479 -13.985
83 3HZ LYS 9 2HZ LYS 9 16.949 -0.459 -15.259
84 H GLU 10 H GLU 10 11.990 0.511 -8.212
85 HA GLU 10 HA GLU 10 14.753 0.899 -7.393
86 1HB GLU 10 2HB GLU 10 13.412 3.175 -7.098
87 2HB GLU 10 1HB GLU 10 12.778 2.364 -5.667
88 1HG GLU 10 2HG GLU 10 15.029 2.003 -4.814
89 2HG GLU 10 1HG GLU 10 15.731 2.663 -6.291
90 HA PRO 11 HA PRO 11 13.364 -2.670 -5.212
91 1HB PRO 11 2HB PRO 11 15.525 -2.363 -3.303
92 2HB PRO 11 1HB PRO 11 15.324 -3.585 -4.566
93 1HG PRO 11 2HG PRO 11 17.171 -1.431 -4.592
94 2HG PRO 11 1HG PRO 11 16.791 -2.512 -5.939
95 1HD PRO 11 2HD PRO 11 16.051 0.290 -5.603
96 2HD PRO 11 1HD PRO 11 15.839 -0.751 -7.027
97 H ALA 12 H ALA 12 12.465 -3.233 -3.136
98 HA ALA 12 HA ALA 12 12.141 -1.029 -1.175
99 1HB ALA 12 1HB ALA 12 10.241 -1.317 -3.034
100 2HB ALA 12 3HB ALA 12 9.695 -2.566 -1.916
101 3HB ALA 12 2HB ALA 12 9.852 -0.897 -1.366
102 H THR 13 H THR 13 10.082 -2.474 0.302
103 HA THR 13 HA THR 13 11.204 -5.128 0.899
104 HB THR 13 HB THR 13 12.628 -3.736 2.305
105 HG1 THR 13 HG1 THR 13 12.123 -5.477 3.450
106 1HG2 THR 13 1HG2 THR 13 10.995 -1.783 2.281
107 2HG2 THR 13 3HG2 THR 13 10.129 -2.609 3.577
108 3HG2 THR 13 2HG2 THR 13 11.797 -2.092 3.820
109 H LEU 14 H LEU 14 9.452 -6.399 1.130
110 HA LEU 14 HA LEU 14 6.815 -5.430 1.172
111 1HB LEU 14 2HB LEU 14 6.066 -7.676 1.570
112 2HB LEU 14 1HB LEU 14 7.425 -7.721 0.467
113 HG LEU 14 HG LEU 14 7.938 -9.478 1.883
114 1HD1 LEU 14 2HD1 LEU 14 9.194 -7.060 3.189
115 2HD1 LEU 14 1HD1 LEU 14 9.611 -8.715 3.618
116 3HD1 LEU 14 3HD1 LEU 14 9.901 -8.130 1.981
117 1HD2 LEU 14 2HD2 LEU 14 6.133 -8.112 3.658
118 2HD2 LEU 14 1HD2 LEU 14 6.619 -9.806 3.659
119 3HD2 LEU 14 3HD2 LEU 14 7.568 -8.617 4.550
120 H ILE 15 H ILE 15 5.723 -4.386 2.672
121 HA ILE 15 HA ILE 15 6.400 -4.887 5.535
122 HB ILE 15 HB ILE 15 4.919 -2.521 4.331
123 1HG1 ILE 15 2HG1 ILE 15 7.709 -2.574 5.511
124 2HG1 ILE 15 1HG1 ILE 15 7.402 -2.720 3.781
125 1HG2 ILE 15 1HG2 ILE 15 5.865 -3.179 7.131
126 2HG2 ILE 15 3HG2 ILE 15 5.405 -1.552 6.633
127 3HG2 ILE 15 2HG2 ILE 15 4.215 -2.852 6.603
128 1HD1 ILE 15 2HD1 ILE 15 5.948 -0.556 4.148
129 2HD1 ILE 15 1HD1 ILE 15 6.944 -0.369 5.591
130 3HD1 ILE 15 3HD1 ILE 15 7.698 -0.417 4.000
131 H LYS 16 H LYS 16 3.554 -4.077 3.497
132 HA LYS 16 HA LYS 16 2.018 -6.329 4.354
133 1HB LYS 16 2HB LYS 16 0.266 -4.774 5.591
134 2HB LYS 16 1HB LYS 16 1.597 -5.514 6.474
135 1HG LYS 16 2HG LYS 16 2.373 -3.483 7.051
136 2HG LYS 16 1HG LYS 16 2.500 -3.026 5.356
137 1HD LYS 16 2HD LYS 16 0.939 -1.467 5.990
138 2HD LYS 16 1HD LYS 16 -0.166 -2.797 5.646
139 1HE LYS 16 2HE LYS 16 1.020 -2.704 8.380
140 2HE LYS 16 1HE LYS 16 -0.191 -1.481 7.993
141 1HZ LYS 16 1HZ LYS 16 -1.693 -3.252 7.298
142 2HZ LYS 16 3HZ LYS 16 -0.529 -4.420 7.697
143 3HZ LYS 16 2HZ LYS 16 -1.216 -3.455 8.916
144 H ALA 17 H ALA 17 1.029 -6.592 2.416
145 HA ALA 17 HA ALA 17 0.231 -4.376 0.713
146 1HB ALA 17 3HB ALA 17 -0.494 -7.325 0.642
147 2HB ALA 17 2HB ALA 17 -0.916 -6.168 -0.619
148 3HB ALA 17 1HB ALA 17 0.775 -6.535 -0.291
149 H ILE 18 H ILE 18 -1.356 -3.063 1.294
150 HA ILE 18 HA ILE 18 -3.460 -3.767 3.144
151 HB ILE 18 HB ILE 18 -2.876 -1.402 1.370
152 1HG1 ILE 18 2HG1 ILE 18 -3.185 -0.822 4.163
153 2HG1 ILE 18 1HG1 ILE 18 -2.140 -2.232 4.001
154 1HG2 ILE 18 3HG2 ILE 18 -5.378 -2.070 2.870
155 2HG2 ILE 18 2HG2 ILE 18 -4.798 -0.407 2.962
156 3HG2 ILE 18 1HG2 ILE 18 -5.175 -1.125 1.395
157 1HD1 ILE 18 2HD1 ILE 18 -0.968 -0.825 2.127
158 2HD1 ILE 18 1HD1 ILE 18 -1.743 0.546 2.920
159 3HD1 ILE 18 3HD1 ILE 18 -0.612 -0.467 3.817
160 H ASP 19 H ASP 19 -3.614 -2.854 -0.336
161 HA ASP 19 HA ASP 19 -5.773 -4.839 -0.732
162 1HB ASP 19 2HB ASP 19 -6.061 -1.854 -1.076
163 2HB ASP 19 1HB ASP 19 -7.065 -2.974 -1.991
164 H GLY 20 H GLY 20 -6.443 -3.882 -3.371
165 1HA GLY 20 2HA GLY 20 -4.455 -5.115 -4.964
166 2HA GLY 20 1HA GLY 20 -5.689 -4.022 -5.591
167 H ASP 21 H ASP 21 -5.197 -1.697 -5.626
168 HA ASP 21 HA ASP 21 -2.496 -1.114 -6.396
169 1HB ASP 21 2HB ASP 21 -4.659 0.859 -5.599
170 2HB ASP 21 1HB ASP 21 -3.227 1.201 -6.559
171 H THR 22 H THR 22 -4.230 -0.838 -3.328
172 HA THR 22 HA THR 22 -2.246 0.889 -2.094
173 HB THR 22 HB THR 22 -4.196 -0.871 -0.626
174 HG1 THR 22 HG1 THR 22 -4.646 1.645 -1.855
175 1HG2 THR 22 2HG2 THR 22 -2.334 0.611 0.469
176 2HG2 THR 22 1HG2 THR 22 -3.421 1.942 0.069
177 3HG2 THR 22 3HG2 THR 22 -3.968 0.646 1.131
178 H VAL 23 H VAL 23 -0.275 0.247 -1.385
179 HA VAL 23 HA VAL 23 0.068 -2.455 -0.231
180 HB VAL 23 HB VAL 23 2.187 -2.726 -1.643
181 1HG1 VAL 23 1HG1 VAL 23 0.078 -4.018 -1.982
182 2HG1 VAL 23 3HG1 VAL 23 -0.476 -2.767 -3.096
183 3HG1 VAL 23 2HG1 VAL 23 0.947 -3.730 -3.490
184 1HG2 VAL 23 1HG2 VAL 23 0.892 -0.344 -2.923
185 2HG2 VAL 23 3HG2 VAL 23 2.604 -0.700 -2.694
186 3HG2 VAL 23 2HG2 VAL 23 1.693 -1.518 -3.965
187 H LYS 24 H LYS 24 1.546 -2.486 1.445
188 HA LYS 24 HA LYS 24 2.905 0.100 2.031
189 1HB LYS 24 2HB LYS 24 1.367 -1.051 3.717
190 2HB LYS 24 1HB LYS 24 2.624 -2.275 3.875
191 1HG LYS 24 2HG LYS 24 3.636 -0.945 5.382
192 2HG LYS 24 1HG LYS 24 3.965 0.191 4.075
193 1HD LYS 24 2HD LYS 24 2.284 1.605 4.702
194 2HD LYS 24 1HD LYS 24 1.217 0.285 5.183
195 1HE LYS 24 2HE LYS 24 3.074 0.003 7.095
196 2HE LYS 24 1HE LYS 24 3.289 1.724 6.774
197 1HZ LYS 24 1HZ LYS 24 0.710 0.400 7.420
198 2HZ LYS 24 3HZ LYS 24 1.633 1.333 8.494
199 3HZ LYS 24 2HZ LYS 24 0.930 2.060 7.129
200 H LEU 25 H LEU 25 5.031 0.255 1.605
201 HA LEU 25 HA LEU 25 6.904 -1.914 2.185
202 1HB LEU 25 2HB LEU 25 7.845 -1.973 -0.136
203 2HB LEU 25 1HB LEU 25 6.228 -2.669 -0.015
204 HG LEU 25 HG LEU 25 6.226 0.217 -0.533
205 1HD1 LEU 25 3HD1 LEU 25 8.233 -0.399 -1.818
206 2HD1 LEU 25 2HD1 LEU 25 7.327 -1.681 -2.622
207 3HD1 LEU 25 1HD1 LEU 25 6.897 0.008 -2.888
208 1HD2 LEU 25 2HD2 LEU 25 4.325 -1.519 -0.614
209 2HD2 LEU 25 1HD2 LEU 25 4.422 -0.370 -1.948
210 3HD2 LEU 25 3HD2 LEU 25 5.018 -2.017 -2.157
211 H MET 26 H MET 26 9.181 -1.151 1.859
212 HA MET 26 HA MET 26 9.325 1.826 2.100
213 1HB MET 26 2HB MET 26 11.465 -0.173 2.891
214 2HB MET 26 1HB MET 26 11.393 1.536 3.307
215 1HG MET 26 2HG MET 26 9.264 1.082 4.549
216 2HG MET 26 1HG MET 26 9.504 -0.637 4.245
217 1HE MET 26 1HE MET 26 9.600 -1.630 6.053
218 2HE MET 26 3HE MET 26 11.282 -2.171 5.954
219 3HE MET 26 2HE MET 26 10.664 -1.473 7.449
220 H TYR 27 H TYR 27 9.613 2.555 0.016
221 HA TYR 27 HA TYR 27 11.291 1.115 -1.894
222 1HB TYR 27 2HB TYR 27 10.532 2.640 -3.479
223 2HB TYR 27 1HB TYR 27 9.216 2.708 -2.311
224 HD1 TYR 27 HD1 TYR 27 9.281 4.550 -0.519
225 HD2 TYR 27 HD2 TYR 27 11.794 4.554 -4.002
226 HE1 TYR 27 HE1 TYR 27 9.712 6.973 -0.207
227 HE2 TYR 27 HE2 TYR 27 12.224 6.976 -3.691
228 HH TYR 27 HH TYR 27 10.603 8.966 -2.297
229 H LYS 28 H LYS 28 11.682 3.876 0.275
230 HA LYS 28 HA LYS 28 14.574 3.907 -0.405
231 1HB LYS 28 2HB LYS 28 13.215 5.894 -1.330
232 2HB LYS 28 1HB LYS 28 13.044 6.399 0.351
233 1HG LYS 28 2HG LYS 28 15.781 5.771 -0.010
234 2HG LYS 28 1HG LYS 28 15.305 6.729 -1.413
235 1HD LYS 28 2HD LYS 28 14.418 8.482 0.030
236 2HD LYS 28 1HD LYS 28 14.748 7.510 1.464
237 1HE LYS 28 2HE LYS 28 16.741 8.581 1.535
238 2HE LYS 28 1HE LYS 28 17.199 7.552 0.180
239 1HZ LYS 28 1HZ LYS 28 16.317 9.255 -1.326
240 2HZ LYS 28 3HZ LYS 28 15.976 10.253 0.003
241 3HZ LYS 28 2HZ LYS 28 17.585 9.849 -0.364
242 H GLY 29 H GLY 29 13.472 2.379 1.642
243 1HA GLY 29 2HA GLY 29 13.935 1.914 3.894
244 2HA GLY 29 1HA GLY 29 14.905 3.386 3.945
245 H GLN 30 H GLN 30 11.697 3.858 2.787
246 HA GLN 30 HA GLN 30 10.870 4.850 5.477
247 1HB GLN 30 2HB GLN 30 11.440 6.611 3.708
248 2HB GLN 30 1HB GLN 30 9.998 6.066 2.853
249 1HG GLN 30 2HG GLN 30 8.557 6.871 4.480
250 2HG GLN 30 1HG GLN 30 9.754 6.716 5.765
251 1HE2 GLN 30 2HE2 GLN 30 9.882 10.055 3.357
252 2HE2 GLN 30 1HE2 GLN 30 9.162 8.638 2.762
253 HA PRO 31 HA PRO 31 7.679 1.778 4.693
254 1HB PRO 31 2HB PRO 31 6.538 2.425 7.241
255 2HB PRO 31 1HB PRO 31 7.530 1.019 6.830
256 1HG PRO 31 2HG PRO 31 8.280 3.305 8.429
257 2HG PRO 31 1HG PRO 31 9.253 1.880 8.045
258 1HD PRO 31 2HD PRO 31 9.543 4.551 6.997
259 2HD PRO 31 1HD PRO 31 10.521 3.119 6.620
260 H MET 32 H MET 32 6.179 2.583 3.257
261 HA MET 32 HA MET 32 4.213 4.574 4.275
262 1HB MET 32 2HB MET 32 5.651 4.779 1.608
263 2HB MET 32 1HB MET 32 4.340 5.830 2.144
264 1HG MET 32 2HG MET 32 5.757 6.447 4.138
265 2HG MET 32 1HG MET 32 7.084 5.552 3.398
266 1HE MET 32 3HE MET 32 7.242 5.713 0.791
267 2HE MET 32 2HE MET 32 7.690 7.258 0.073
268 3HE MET 32 1HE MET 32 8.642 6.605 1.404
269 H THR 33 H THR 33 2.817 4.810 1.781
270 HA THR 33 HA THR 33 2.083 2.038 1.051
271 HB THR 33 HB THR 33 0.531 2.649 2.867
272 HG1 THR 33 HG1 THR 33 -0.339 1.457 1.182
273 1HG2 THR 33 3HG2 THR 33 0.716 5.107 2.615
274 2HG2 THR 33 2HG2 THR 33 -0.203 5.009 1.115
275 3HG2 THR 33 1HG2 THR 33 -0.964 4.576 2.643
276 H PHE 34 H PHE 34 1.528 1.896 -1.117
277 HA PHE 34 HA PHE 34 1.419 4.498 -2.601
278 1HB PHE 34 2HB PHE 34 2.495 1.917 -3.742
279 2HB PHE 34 1HB PHE 34 2.740 3.557 -4.337
280 HD1 PHE 34 HD1 PHE 34 3.409 1.390 -1.356
281 HD2 PHE 34 HD2 PHE 34 4.667 4.743 -3.719
282 HE1 PHE 34 HE1 PHE 34 5.453 1.594 0.027
283 HE2 PHE 34 HE2 PHE 34 6.718 4.941 -2.336
284 HZ PHE 34 HZ PHE 34 7.110 3.368 -0.464
285 H ARG 35 H ARG 35 -0.412 4.789 -3.813
286 HA ARG 35 HA ARG 35 -2.056 2.354 -4.395
287 1HB ARG 35 2HB ARG 35 -4.007 3.992 -4.452
288 2HB ARG 35 1HB ARG 35 -3.300 3.703 -2.867
289 1HG ARG 35 2HG ARG 35 -2.198 5.785 -2.849
290 2HG ARG 35 1HG ARG 35 -2.347 5.980 -4.591
291 1HD ARG 35 2HD ARG 35 -3.913 7.464 -3.434
292 2HD ARG 35 1HD ARG 35 -4.795 6.237 -4.346
293 HE ARG 35 HE ARG 35 -4.634 5.085 -1.876
294 1HH1 ARG 35 1HH2 ARG 35 -4.476 8.300 -1.522
295 2HH1 ARG 35 2HH2 ARG 35 -6.080 8.553 -0.918
296 1HH2 ARG 35 2HH1 ARG 35 -7.173 5.355 -1.714
297 2HH2 ARG 35 1HH1 ARG 35 -7.608 6.883 -1.029
298 H LEU 36 H LEU 36 -0.992 5.503 -5.707
299 HA LEU 36 HA LEU 36 -0.749 6.215 -7.927
300 1HB LEU 36 2HB LEU 36 0.300 3.977 -8.276
301 2HB LEU 36 1HB LEU 36 -1.287 3.303 -8.615
302 HG LEU 36 HG LEU 36 -0.493 5.713 -10.175
303 1HD1 LEU 36 1HD1 LEU 36 1.123 3.305 -10.039
304 2HD1 LEU 36 3HD1 LEU 36 0.453 3.519 -11.657
305 3HD1 LEU 36 2HD1 LEU 36 1.425 4.798 -10.929
306 1HD2 LEU 36 3HD2 LEU 36 -2.245 3.327 -10.396
307 2HD2 LEU 36 2HD2 LEU 36 -2.499 4.965 -10.995
308 3HD2 LEU 36 1HD2 LEU 36 -1.484 3.843 -11.900
309 H LEU 37 H LEU 37 -3.104 3.640 -8.617
310 HA LEU 37 HA LEU 37 -5.073 5.716 -9.426
311 1HB LEU 37 2HB LEU 37 -4.392 3.618 -10.852
312 2HB LEU 37 1HB LEU 37 -5.465 2.746 -9.758
313 HG LEU 37 HG LEU 37 -7.045 4.865 -10.362
314 1HD1 LEU 37 3HD1 LEU 37 -5.184 5.637 -11.955
315 2HD1 LEU 37 2HD1 LEU 37 -5.629 4.259 -12.964
316 3HD1 LEU 37 1HD1 LEU 37 -6.808 5.529 -12.635
317 1HD2 LEU 37 1HD2 LEU 37 -6.674 2.250 -11.849
318 2HD2 LEU 37 3HD2 LEU 37 -7.812 2.597 -10.546
319 3HD2 LEU 37 2HD2 LEU 37 -8.042 3.327 -12.135
320 H LEU 38 H LEU 38 -4.336 3.483 -6.910
321 HA LEU 38 HA LEU 38 -5.345 3.057 -4.877
322 1HB LEU 38 2HB LEU 38 -6.089 5.070 -4.193
323 2HB LEU 38 1HB LEU 38 -6.672 5.504 -5.794
324 HG LEU 38 HG LEU 38 -8.662 3.958 -5.340
325 1HD1 LEU 38 1HD1 LEU 38 -7.119 3.659 -2.855
326 2HD1 LEU 38 3HD1 LEU 38 -8.815 4.067 -2.579
327 3HD1 LEU 38 2HD1 LEU 38 -8.393 2.631 -3.517
328 1HD2 LEU 38 1HD2 LEU 38 -8.085 6.516 -3.867
329 2HD2 LEU 38 3HD2 LEU 38 -9.180 6.236 -5.222
330 3HD2 LEU 38 2HD2 LEU 38 -9.618 5.684 -3.605
331 H VAL 39 H VAL 39 -6.382 1.259 -4.425
332 HA VAL 39 HA VAL 39 -7.916 -0.195 -6.320
333 HB VAL 39 HB VAL 39 -6.502 -0.923 -4.223
334 1HG1 VAL 39 3HG1 VAL 39 -8.479 0.367 -2.854
335 2HG1 VAL 39 2HG1 VAL 39 -9.071 -1.293 -2.813
336 3HG1 VAL 39 1HG1 VAL 39 -7.474 -0.912 -2.173
337 1HG2 VAL 39 2HG2 VAL 39 -8.708 -2.155 -5.680
338 2HG2 VAL 39 1HG2 VAL 39 -7.171 -2.855 -5.176
339 3HG2 VAL 39 3HG2 VAL 39 -8.538 -2.836 -4.062
340 H ASP 40 H ASP 40 -10.073 -1.163 -4.621
341 HA ASP 40 HA ASP 40 -11.778 1.177 -4.073
342 1HB ASP 40 2HB ASP 40 -11.923 0.615 -6.568
343 2HB ASP 40 1HB ASP 40 -12.702 -0.890 -6.085
344 H THR 41 H THR 41 -10.963 -0.480 -2.119
345 HA THR 41 HA THR 41 -12.764 -2.739 -1.748
346 HB THR 41 HB THR 41 -11.286 -1.634 0.582
347 HG1 THR 41 HG1 THR 41 -9.966 -2.823 -1.629
348 1HG2 THR 41 3HG2 THR 41 -11.550 -4.358 -0.701
349 2HG2 THR 41 2HG2 THR 41 -10.710 -4.032 0.815
350 3HG2 THR 41 1HG2 THR 41 -12.450 -3.769 0.697
351 HA PRO 42 HA PRO 42 -14.642 0.209 1.610
352 1HB PRO 42 2HB PRO 42 -13.944 2.923 1.027
353 2HB PRO 42 1HB PRO 42 -13.476 1.972 2.444
354 1HG PRO 42 2HG PRO 42 -11.804 2.804 0.239
355 2HG PRO 42 1HG PRO 42 -11.335 1.886 1.677
356 1HD PRO 42 2HD PRO 42 -11.638 0.918 -1.024
357 2HD PRO 42 1HD PRO 42 -11.143 0.007 0.414
358 H GLU 43 H GLU 43 -16.697 0.090 0.752
359 HA GLU 43 HA GLU 43 -17.377 1.965 -1.476
360 1HB GLU 43 2HB GLU 43 -18.103 -0.957 -1.180
361 2HB GLU 43 1HB GLU 43 -18.991 0.131 -2.247
362 1HG GLU 43 2HG GLU 43 -15.986 -0.217 -2.388
363 2HG GLU 43 1HG GLU 43 -17.108 -1.171 -3.356
364 H THR 44 H THR 44 -18.255 3.413 0.090
365 HA THR 44 HA THR 44 -20.012 4.373 1.291
366 HB THR 44 HB THR 44 -21.615 1.948 0.417
367 HG1 THR 44 HG1 THR 44 -21.194 2.793 -1.470
368 1HG2 THR 44 2HG2 THR 44 -22.606 3.344 2.226
369 2HG2 THR 44 1HG2 THR 44 -22.472 4.755 1.177
370 3HG2 THR 44 3HG2 THR 44 -23.536 3.422 0.730
371 H LYS 45 H LYS 45 -19.670 4.366 3.448
372 HA LYS 45 HA LYS 45 -19.423 1.869 4.964
373 1HB LYS 45 2HB LYS 45 -19.237 4.801 5.637
374 2HB LYS 45 1HB LYS 45 -19.361 3.603 6.926
375 1HG LYS 45 2HG LYS 45 -17.388 2.426 6.035
376 2HG LYS 45 1HG LYS 45 -17.262 3.614 4.736
377 1HD LYS 45 2HD LYS 45 -17.023 5.406 6.476
378 2HD LYS 45 1HD LYS 45 -16.981 4.146 7.707
379 1HE LYS 45 2HE LYS 45 -14.713 4.384 7.328
380 2HE LYS 45 1HE LYS 45 -15.085 3.152 6.122
381 1HZ LYS 45 1HZ LYS 45 -15.351 4.910 4.474
382 2HZ LYS 45 3HZ LYS 45 -14.961 6.082 5.637
383 3HZ LYS 45 2HZ LYS 45 -13.796 4.941 5.158
384 H HIS 46 H HIS 46 -21.207 0.776 5.606
385 HA HIS 46 HA HIS 46 -23.803 2.171 5.802
386 1HB HIS 46 2HB HIS 46 -23.016 -0.749 5.994
387 2HB HIS 46 1HB HIS 46 -24.669 -0.173 6.201
388 HD1 HIS 46 HD1 HIS 46 -21.950 -0.498 3.612
389 HD2 HIS 46 HD2 HIS 46 -25.955 0.641 3.810
390 HE1 HIS 46 HE1 HIS 46 -22.753 -0.288 1.221
391 HA PRO 47 HA PRO 47 -23.869 2.703 10.149
392 1HB PRO 47 2HB PRO 47 -26.610 1.864 10.426
393 2HB PRO 47 1HB PRO 47 -25.976 3.515 10.371
394 1HG PRO 47 2HG PRO 47 -27.466 2.133 8.324
395 2HG PRO 47 1HG PRO 47 -26.834 3.784 8.279
396 1HD PRO 47 2HD PRO 47 -25.867 1.487 6.835
397 2HD PRO 47 1HD PRO 47 -25.225 3.142 6.805
398 H LYS 48 H LYS 48 -25.573 -0.236 8.998
399 HA LYS 48 HA LYS 48 -25.226 -1.689 11.477
400 1HB LYS 48 2HB LYS 48 -25.985 -3.643 10.205
401 2HB LYS 48 1HB LYS 48 -26.994 -2.248 9.824
402 1HG LYS 48 2HG LYS 48 -25.136 -1.934 7.908
403 2HG LYS 48 1HG LYS 48 -25.015 -3.681 8.113
404 1HD LYS 48 2HD LYS 48 -27.201 -4.053 7.416
405 2HD LYS 48 1HD LYS 48 -27.736 -2.440 7.885
406 1HE LYS 48 2HE LYS 48 -25.656 -2.535 5.772
407 2HE LYS 48 1HE LYS 48 -27.240 -3.158 5.312
408 1HZ LYS 48 3HZ LYS 48 -28.217 -1.081 6.164
409 2HZ LYS 48 2HZ LYS 48 -26.655 -0.483 6.463
410 3HZ LYS 48 1HZ LYS 48 -27.149 -0.818 4.873
411 H LYS 49 H LYS 49 -23.793 -3.510 11.834
412 HA LYS 49 HA LYS 49 -21.085 -3.045 10.916
413 1HB LYS 49 2HB LYS 49 -22.408 -5.160 12.611
414 2HB LYS 49 1HB LYS 49 -20.725 -5.330 12.113
415 1HG LYS 49 2HG LYS 49 -20.813 -2.714 12.989
416 2HG LYS 49 1HG LYS 49 -21.912 -3.524 14.108
417 1HD LYS 49 2HD LYS 49 -19.215 -4.711 13.468
418 2HD LYS 49 1HD LYS 49 -19.383 -3.467 14.707
419 1HE LYS 49 2HE LYS 49 -20.221 -4.952 16.179
420 2HE LYS 49 1HE LYS 49 -21.434 -5.493 15.019
421 1HZ LYS 49 3HZ LYS 49 -19.740 -6.902 13.990
422 2HZ LYS 49 2HZ LYS 49 -18.612 -6.411 15.160
423 3HZ LYS 49 1HZ LYS 49 -19.981 -7.304 15.619
424 H GLY 50 H GLY 50 -20.042 -3.948 9.196
425 1HA GLY 50 2HA GLY 50 -21.534 -5.940 7.558
426 2HA GLY 50 1HA GLY 50 -20.228 -4.911 6.970
427 H VAL 51 H VAL 51 -18.258 -5.860 6.790
428 HA VAL 51 HA VAL 51 -17.330 -7.861 8.707
429 HB VAL 51 HB VAL 51 -18.744 -9.234 7.190
430 1HG1 VAL 51 2HG1 VAL 51 -18.320 -7.697 5.187
431 2HG1 VAL 51 1HG1 VAL 51 -16.775 -8.527 5.005
432 3HG1 VAL 51 3HG1 VAL 51 -18.284 -9.428 4.858
433 1HG2 VAL 51 3HG2 VAL 51 -16.659 -10.151 8.234
434 2HG2 VAL 51 2HG2 VAL 51 -17.062 -10.928 6.704
435 3HG2 VAL 51 1HG2 VAL 51 -15.778 -9.721 6.768
436 H GLU 52 H GLU 52 -15.106 -7.876 8.770
437 HA GLU 52 HA GLU 52 -13.693 -5.937 7.070
438 1HB GLU 52 2HB GLU 52 -13.298 -6.244 9.575
439 2HB GLU 52 1HB GLU 52 -12.483 -7.754 9.168
440 1HG GLU 52 2HG GLU 52 -11.585 -5.501 7.520
441 2HG GLU 52 1HG GLU 52 -11.290 -5.249 9.240
442 H LYS 53 H LYS 53 -12.574 -6.478 5.262
443 HA LYS 53 HA LYS 53 -11.872 -9.359 4.840
444 1HB LYS 53 2HB LYS 53 -13.702 -8.223 3.351
445 2HB LYS 53 1HB LYS 53 -12.332 -7.435 2.571
446 1HG LYS 53 2HG LYS 53 -11.967 -9.296 1.365
447 2HG LYS 53 1HG LYS 53 -11.657 -10.185 2.856
448 1HD LYS 53 2HD LYS 53 -14.476 -9.659 1.914
449 2HD LYS 53 1HD LYS 53 -13.558 -11.042 1.318
450 1HE LYS 53 2HE LYS 53 -13.574 -10.616 4.267
451 2HE LYS 53 1HE LYS 53 -15.078 -11.175 3.536
452 1HZ LYS 53 2HZ LYS 53 -13.810 -12.967 2.466
453 2HZ LYS 53 1HZ LYS 53 -12.411 -12.458 3.287
454 3HZ LYS 53 3HZ LYS 53 -13.739 -13.050 4.162
455 H TYR 54 H TYR 54 -9.785 -9.792 4.138
456 HA TYR 54 HA TYR 54 -7.785 -7.731 4.537
457 1HB TYR 54 2HB TYR 54 -6.153 -9.450 4.034
458 2HB TYR 54 1HB TYR 54 -7.411 -10.167 5.035
459 HD1 TYR 54 HD1 TYR 54 -9.073 -11.718 4.057
460 HD2 TYR 54 HD2 TYR 54 -5.871 -10.081 1.705
461 HE1 TYR 54 HE1 TYR 54 -9.486 -13.424 2.308
462 HE2 TYR 54 HE2 TYR 54 -6.286 -11.788 -0.046
463 HH TYR 54 HH TYR 54 -8.834 -13.336 -0.536
464 H GLY 55 H GLY 55 -9.219 -9.271 1.670
465 1HA GLY 55 2HA GLY 55 -8.493 -6.997 0.008
466 2HA GLY 55 1HA GLY 55 -7.545 -8.433 -0.378
467 HA PRO 56 HA PRO 56 -12.046 -8.385 -2.158
468 1HB PRO 56 2HB PRO 56 -11.051 -7.390 -4.693
469 2HB PRO 56 1HB PRO 56 -12.281 -6.683 -3.638
470 1HG PRO 56 2HG PRO 56 -9.668 -5.672 -4.071
471 2HG PRO 56 1HG PRO 56 -10.809 -5.137 -2.832
472 1HD PRO 56 2HD PRO 56 -8.385 -6.753 -2.515
473 2HD PRO 56 1HD PRO 56 -9.371 -5.961 -1.269
474 H GLU 57 H GLU 57 -12.124 -9.122 -4.915
475 HA GLU 57 HA GLU 57 -11.162 -11.867 -4.723
476 1HB GLU 57 2HB GLU 57 -12.127 -11.958 -7.141
477 2HB GLU 57 1HB GLU 57 -13.239 -11.737 -5.794
478 1HG GLU 57 2HG GLU 57 -12.237 -9.172 -6.700
479 2HG GLU 57 1HG GLU 57 -12.943 -10.065 -8.044
480 H ALA 58 H ALA 58 -10.759 -9.861 -7.675
481 HA ALA 58 HA ALA 58 -8.331 -11.168 -8.418
482 1HB ALA 58 2HB ALA 58 -9.559 -8.536 -9.275
483 2HB ALA 58 1HB ALA 58 -8.089 -9.189 -10.000
484 3HB ALA 58 3HB ALA 58 -9.607 -10.077 -10.133
485 H SER 59 H SER 59 -8.970 -8.166 -6.637
486 HA SER 59 HA SER 59 -6.272 -7.212 -6.544
487 1HB SER 59 2HB SER 59 -8.787 -6.691 -5.060
488 2HB SER 59 1HB SER 59 -7.294 -6.250 -4.235
489 HG SER 59 HG SER 59 -8.508 -4.836 -6.001
490 H ALA 60 H ALA 60 -7.972 -9.700 -4.704
491 HA ALA 60 HA ALA 60 -6.199 -9.868 -2.460
492 1HB ALA 60 2HB ALA 60 -8.077 -11.766 -3.809
493 2HB ALA 60 1HB ALA 60 -6.913 -12.424 -2.662
494 3HB ALA 60 3HB ALA 60 -8.067 -11.197 -2.141
495 H PHE 61 H PHE 61 -6.051 -11.362 -5.688
496 HA PHE 61 HA PHE 61 -3.639 -12.877 -5.193
497 1HB PHE 61 2HB PHE 61 -4.724 -11.860 -7.842
498 2HB PHE 61 1HB PHE 61 -3.566 -13.173 -7.619
499 HD1 PHE 61 HD1 PHE 61 -4.370 -15.084 -5.944
500 HD2 PHE 61 HD2 PHE 61 -6.983 -12.406 -8.055
501 HE1 PHE 61 HE1 PHE 61 -6.241 -16.687 -5.660
502 HE2 PHE 61 HE2 PHE 61 -8.855 -14.009 -7.772
503 HZ PHE 61 HZ PHE 61 -8.483 -16.149 -6.574
504 H THR 62 H THR 62 -4.341 -9.616 -6.346
505 HA THR 62 HA THR 62 -1.692 -8.886 -7.178
506 HB THR 62 HB THR 62 -3.959 -7.189 -6.070
507 HG1 THR 62 HG1 THR 62 -3.102 -7.768 -8.712
508 1HG2 THR 62 1HG2 THR 62 -1.278 -6.503 -7.227
509 2HG2 THR 62 3HG2 THR 62 -2.645 -5.425 -7.509
510 3HG2 THR 62 2HG2 THR 62 -2.121 -5.773 -5.860
511 H LYS 63 H LYS 63 -3.291 -9.113 -4.068
512 HA LYS 63 HA LYS 63 -1.460 -7.596 -2.468
513 1HB LYS 63 2HB LYS 63 -3.817 -8.966 -2.033
514 2HB LYS 63 1HB LYS 63 -2.640 -9.988 -1.213
515 1HG LYS 63 2HG LYS 63 -2.015 -8.302 0.278
516 2HG LYS 63 1HG LYS 63 -2.599 -7.016 -0.778
517 1HD LYS 63 2HD LYS 63 -4.635 -8.975 0.140
518 2HD LYS 63 1HD LYS 63 -3.988 -7.890 1.372
519 1HE LYS 63 2HE LYS 63 -5.847 -6.731 0.450
520 2HE LYS 63 1HE LYS 63 -4.431 -5.991 -0.291
521 1HZ LYS 63 1HZ LYS 63 -5.878 -8.232 -1.571
522 2HZ LYS 63 3HZ LYS 63 -6.334 -6.617 -1.815
523 3HZ LYS 63 2HZ LYS 63 -4.785 -7.139 -2.280
524 H LYS 64 H LYS 64 -1.376 -10.843 -3.804
525 HA LYS 64 HA LYS 64 0.724 -11.828 -2.084
526 1HB LYS 64 2HB LYS 64 -0.584 -12.760 -4.615
527 2HB LYS 64 1HB LYS 64 0.930 -13.512 -4.110
528 1HG LYS 64 2HG LYS 64 -0.369 -14.840 -2.814
529 2HG LYS 64 1HG LYS 64 -0.496 -13.436 -1.755
530 1HD LYS 64 2HD LYS 64 -2.424 -12.771 -3.475
531 2HD LYS 64 1HD LYS 64 -2.476 -14.517 -3.713
532 1HE LYS 64 2HE LYS 64 -3.970 -14.255 -1.941
533 2HE LYS 64 1HE LYS 64 -2.469 -14.589 -1.080
534 1HZ LYS 64 2HZ LYS 64 -3.477 -11.862 -1.698
535 2HZ LYS 64 1HZ LYS 64 -3.700 -12.652 -0.208
536 3HZ LYS 64 3HZ LYS 64 -2.135 -12.259 -0.732
537 H MET 65 H MET 65 0.690 -10.167 -5.215
538 HA MET 65 HA MET 65 3.556 -10.561 -5.649
539 1HB MET 65 2HB MET 65 1.327 -9.110 -6.990
540 2HB MET 65 1HB MET 65 2.939 -8.432 -7.221
541 1HG MET 65 2HG MET 65 2.384 -10.092 -8.979
542 2HG MET 65 1HG MET 65 3.763 -10.607 -8.007
543 1HE MET 65 2HE MET 65 4.154 -12.376 -7.234
544 2HE MET 65 1HE MET 65 3.205 -12.863 -5.832
545 3HE MET 65 3HE MET 65 3.215 -13.865 -7.289
546 H LEU 66 H LEU 66 3.510 -9.823 -3.151
547 HA LEU 66 HA LEU 66 4.994 -7.423 -2.902
548 1HB LEU 66 2HB LEU 66 2.627 -6.547 -3.395
549 2HB LEU 66 1HB LEU 66 2.190 -7.169 -1.805
550 HG LEU 66 HG LEU 66 4.588 -5.753 -1.417
551 1HD1 LEU 66 3HD1 LEU 66 2.672 -4.384 -3.311
552 2HD1 LEU 66 2HD1 LEU 66 3.801 -3.485 -2.298
553 3HD1 LEU 66 1HD1 LEU 66 4.409 -4.616 -3.506
554 1HD2 LEU 66 1HD2 LEU 66 2.648 -5.967 0.122
555 2HD2 LEU 66 3HD2 LEU 66 3.128 -4.283 -0.088
556 3HD2 LEU 66 2HD2 LEU 66 1.712 -4.906 -0.932
557 H GLU 67 H GLU 67 2.937 -9.900 -1.373
558 HA GLU 67 HA GLU 67 3.948 -9.341 1.314
559 1HB GLU 67 2HB GLU 67 1.907 -10.297 1.617
560 2HB GLU 67 1HB GLU 67 1.937 -11.082 0.046
561 1HG GLU 67 2HG GLU 67 2.054 -12.964 1.344
562 2HG GLU 67 1HG GLU 67 3.774 -12.602 1.313
563 H ASN 68 H ASN 68 4.860 -11.366 -1.382
564 HA ASN 68 HA ASN 68 7.057 -12.499 0.297
565 1HB ASN 68 2HB ASN 68 6.886 -14.592 -1.012
566 2HB ASN 68 1HB ASN 68 5.390 -14.243 -0.149
567 1HD2 ASN 68 2HD2 ASN 68 3.603 -13.397 -3.210
568 2HD2 ASN 68 1HD2 ASN 68 3.706 -12.905 -1.587
569 H ALA 69 H ALA 69 6.647 -10.260 -1.935
570 HA ALA 69 HA ALA 69 8.538 -11.149 -3.990
571 1HB ALA 69 1HB ALA 69 6.576 -9.389 -4.171
572 2HB ALA 69 3HB ALA 69 7.801 -8.267 -3.577
573 3HB ALA 69 2HB ALA 69 8.066 -9.147 -5.082
574 H LYS 70 H LYS 70 10.686 -11.161 -3.662
575 HA LYS 70 HA LYS 70 11.860 -9.649 -1.409
576 1HB LYS 70 2HB LYS 70 12.953 -11.706 -3.345
577 2HB LYS 70 1HB LYS 70 13.989 -10.837 -2.214
578 1HG LYS 70 2HG LYS 70 11.959 -11.655 -0.563
579 2HG LYS 70 1HG LYS 70 12.044 -12.999 -1.703
580 1HD LYS 70 2HD LYS 70 13.774 -13.763 -0.466
581 2HD LYS 70 1HD LYS 70 14.716 -12.445 -1.163
582 1HE LYS 70 2HE LYS 70 12.986 -11.945 1.250
583 2HE LYS 70 1HE LYS 70 14.584 -12.664 1.441
584 1HZ LYS 70 3HZ LYS 70 15.491 -10.774 0.169
585 2HZ LYS 70 2HZ LYS 70 13.947 -10.065 0.153
586 3HZ LYS 70 1HZ LYS 70 14.762 -10.299 1.625
587 H LYS 71 H LYS 71 12.533 -10.030 -4.906
588 HA LYS 71 HA LYS 71 14.060 -7.516 -4.973
589 1HB LYS 71 2HB LYS 71 13.222 -9.558 -7.041
590 2HB LYS 71 1HB LYS 71 13.920 -8.012 -7.523
591 1HG LYS 71 2HG LYS 71 15.367 -9.493 -5.389
592 2HG LYS 71 1HG LYS 71 15.425 -10.201 -7.002
593 1HD LYS 71 2HD LYS 71 15.835 -7.431 -7.368
594 2HD LYS 71 1HD LYS 71 16.832 -7.886 -5.987
595 1HE LYS 71 2HE LYS 71 16.845 -9.661 -8.401
596 2HE LYS 71 1HE LYS 71 17.750 -8.150 -8.464
597 1HZ LYS 71 2HZ LYS 71 18.024 -10.166 -6.299
598 2HZ LYS 71 1HZ LYS 71 19.054 -10.071 -7.648
599 3HZ LYS 71 3HZ LYS 71 18.988 -8.786 -6.542
600 H ILE 72 H ILE 72 13.024 -5.542 -5.164
601 HA ILE 72 HA ILE 72 10.367 -5.534 -6.505
602 HB ILE 72 HB ILE 72 11.200 -3.865 -4.111
603 1HG1 ILE 72 2HG1 ILE 72 9.162 -6.104 -4.233
604 2HG1 ILE 72 1HG1 ILE 72 10.792 -6.299 -3.601
605 1HG2 ILE 72 1HG2 ILE 72 8.723 -3.980 -5.813
606 2HG2 ILE 72 3HG2 ILE 72 8.633 -3.448 -4.133
607 3HG2 ILE 72 2HG2 ILE 72 9.638 -2.568 -5.283
608 1HD1 ILE 72 1HD1 ILE 72 8.715 -4.351 -2.553
609 2HD1 ILE 72 3HD1 ILE 72 9.157 -5.879 -1.792
610 3HD1 ILE 72 2HD1 ILE 72 10.339 -4.575 -1.901
611 H GLU 73 H GLU 73 9.860 -3.390 -7.429
612 HA GLU 73 HA GLU 73 12.164 -1.603 -7.813
613 1HB GLU 73 2HB GLU 73 10.799 -3.112 -10.070
614 2HB GLU 73 1HB GLU 73 11.701 -1.624 -10.344
615 1HG GLU 73 2HG GLU 73 12.815 -4.158 -9.094
616 2HG GLU 73 1HG GLU 73 13.118 -3.611 -10.738
617 H VAL 74 H VAL 74 10.241 -0.829 -6.297
618 HA VAL 74 HA VAL 74 7.737 0.005 -7.127
619 HB VAL 74 HB VAL 74 8.882 2.290 -5.794
620 1HG1 VAL 74 3HG1 VAL 74 6.550 1.302 -5.699
621 2HG1 VAL 74 2HG1 VAL 74 7.209 0.062 -4.632
622 3HG1 VAL 74 1HG1 VAL 74 7.242 1.756 -4.140
623 1HG2 VAL 74 3HG2 VAL 74 9.708 -0.409 -4.696
624 2HG2 VAL 74 2HG2 VAL 74 10.722 1.007 -4.980
625 3HG2 VAL 74 1HG2 VAL 74 9.541 1.016 -3.674
626 H GLU 75 H GLU 75 7.324 0.758 -9.124
627 HA GLU 75 HA GLU 75 9.167 2.702 -10.371
628 1HB GLU 75 2HB GLU 75 6.675 1.390 -11.495
629 2HB GLU 75 1HB GLU 75 7.871 2.311 -12.404
630 1HG GLU 75 2HG GLU 75 9.562 0.567 -11.373
631 2HG GLU 75 1HG GLU 75 8.118 -0.422 -11.195
632 H PHE 76 H PHE 76 8.837 4.755 -9.704
633 HA PHE 76 HA PHE 76 6.047 5.740 -9.352
634 1HB PHE 76 2HB PHE 76 8.668 7.058 -8.554
635 2HB PHE 76 1HB PHE 76 7.058 7.671 -8.201
636 HD1 PHE 76 HD2 PHE 76 6.486 4.336 -7.911
637 HD2 PHE 76 HD1 PHE 76 8.746 7.417 -5.955
638 HE1 PHE 76 HE2 PHE 76 6.437 3.039 -5.816
639 HE2 PHE 76 HE1 PHE 76 8.696 6.113 -3.853
640 HZ PHE 76 HZ PHE 76 7.554 3.915 -3.784
641 H ASP 77 H ASP 77 5.283 6.546 -11.257
642 HA ASP 77 HA ASP 77 6.791 7.280 -13.517
643 1HB ASP 77 2HB ASP 77 4.769 8.313 -14.381
644 2HB ASP 77 1HB ASP 77 4.329 6.847 -13.507
645 H LYS 78 H LYS 78 7.328 9.336 -14.453
646 HA LYS 78 HA LYS 78 8.659 11.189 -12.818
647 1HB LYS 78 2HB LYS 78 8.869 11.055 -15.311
648 2HB LYS 78 1HB LYS 78 7.287 11.815 -15.454
649 1HG LYS 78 2HG LYS 78 8.693 13.667 -15.625
650 2HG LYS 78 1HG LYS 78 8.355 13.653 -13.894
651 1HD LYS 78 2HD LYS 78 10.445 12.428 -13.478
652 2HD LYS 78 1HD LYS 78 10.781 12.393 -15.209
653 1HE LYS 78 2HE LYS 78 12.018 14.254 -14.566
654 2HE LYS 78 1HE LYS 78 10.489 15.011 -15.008
655 1HZ LYS 78 1HZ LYS 78 9.824 14.913 -12.674
656 2HZ LYS 78 3HZ LYS 78 11.322 14.228 -12.264
657 3HZ LYS 78 2HZ LYS 78 11.252 15.812 -12.874
658 H GLY 79 H GLY 79 7.903 12.649 -11.357
659 1HA GLY 79 2HA GLY 79 6.447 14.209 -10.332
660 2HA GLY 79 1HA GLY 79 5.440 14.160 -11.789
661 H GLN 80 H GLN 80 6.112 12.578 -8.721
662 HA GLN 80 HA GLN 80 4.533 10.291 -8.911
663 1HB GLN 80 2HB GLN 80 4.668 10.133 -6.602
664 2HB GLN 80 1HB GLN 80 6.014 11.207 -6.955
665 1HG GLN 80 2HG GLN 80 5.106 12.797 -5.656
666 2HG GLN 80 1HG GLN 80 3.643 12.796 -6.640
667 1HE2 GLN 80 2HE2 GLN 80 3.670 10.855 -3.062
668 2HE2 GLN 80 1HE2 GLN 80 5.077 11.589 -3.662
669 H ARG 81 H ARG 81 2.376 9.807 -8.201
670 HA ARG 81 HA ARG 81 0.430 11.714 -9.209
671 1HB ARG 81 2HB ARG 81 0.573 8.899 -8.649
672 2HB ARG 81 1HB ARG 81 -0.856 9.560 -7.857
673 1HG ARG 81 2HG ARG 81 -0.343 10.483 -10.639
674 2HG ARG 81 1HG ARG 81 -0.850 8.805 -10.447
675 1HD ARG 81 2HD ARG 81 -2.973 9.456 -10.098
676 2HD ARG 81 1HD ARG 81 -2.465 10.460 -8.740
677 HE ARG 81 HE ARG 81 -1.809 11.987 -10.953
678 1HH1 ARG 81 2HH1 ARG 81 -3.957 10.826 -12.532
679 2HH1 ARG 81 1HH1 ARG 81 -5.355 11.734 -12.064
680 1HH2 ARG 81 1HH2 ARG 81 -3.903 12.977 -9.161
681 2HH2 ARG 81 2HH2 ARG 81 -5.325 12.955 -10.149
682 H THR 82 H THR 82 1.276 13.296 -7.347
683 HA THR 82 HA THR 82 0.140 12.836 -4.710
684 HB THR 82 HB THR 82 0.710 15.484 -4.697
685 HG1 THR 82 HG1 THR 82 1.446 15.825 -6.673
686 1HG2 THR 82 3HG2 THR 82 1.881 13.142 -3.748
687 2HG2 THR 82 2HG2 THR 82 3.194 13.973 -4.583
688 3HG2 THR 82 1HG2 THR 82 2.317 14.787 -3.288
689 H ASP 83 H ASP 83 -1.177 14.863 -3.887
690 HA ASP 83 HA ASP 83 -3.025 16.088 -5.739
691 1HB ASP 83 2HB ASP 83 -3.885 13.742 -5.714
692 2HB ASP 83 1HB ASP 83 -4.155 13.890 -3.979
693 H LYS 84 H LYS 84 -4.209 15.045 -2.590
694 HA LYS 84 HA LYS 84 -3.955 17.857 -1.661
695 1HB LYS 84 2HB LYS 84 -6.162 16.205 -1.710
696 2HB LYS 84 1HB LYS 84 -5.596 16.019 -0.050
697 1HG LYS 84 2HG LYS 84 -6.994 17.890 0.115
698 2HG LYS 84 1HG LYS 84 -5.407 18.630 -0.091
699 1HD LYS 84 2HD LYS 84 -6.765 17.995 -2.629
700 2HD LYS 84 1HD LYS 84 -7.607 19.194 -1.645
701 1HE LYS 84 2HE LYS 84 -5.043 20.080 -1.411
702 2HE LYS 84 1HE LYS 84 -4.996 19.387 -3.031
703 1HZ LYS 84 1HZ LYS 84 -6.991 21.362 -2.060
704 2HZ LYS 84 3HZ LYS 84 -5.670 21.712 -3.064
705 3HZ LYS 84 2HZ LYS 84 -6.920 20.708 -3.627
706 H TYR 85 H TYR 85 -3.835 14.544 -0.293
707 HA TYR 85 HA TYR 85 -2.184 15.444 1.952
708 1HB TYR 85 2HB TYR 85 -3.786 13.595 2.258
709 2HB TYR 85 1HB TYR 85 -2.948 12.652 1.027
710 HD1 TYR 85 HD1 TYR 85 -2.361 14.403 4.289
711 HD2 TYR 85 HD2 TYR 85 -1.169 11.243 1.633
712 HE1 TYR 85 HE1 TYR 85 -0.782 13.557 6.004
713 HE2 TYR 85 HE2 TYR 85 0.410 10.398 3.347
714 HH TYR 85 HH TYR 85 0.315 10.856 6.320
715 H GLY 86 H GLY 86 -1.684 14.104 -1.249
716 1HA GLY 86 2HA GLY 86 0.306 13.876 -2.466
717 2HA GLY 86 1HA GLY 86 1.158 14.634 -1.121
718 H ARG 87 H ARG 87 -0.761 11.595 -1.304
719 HA ARG 87 HA ARG 87 1.127 10.162 0.350
720 1HB ARG 87 2HB ARG 87 -1.451 9.735 -0.275
721 2HB ARG 87 1HB ARG 87 -0.713 8.690 -1.484
722 1HG ARG 87 2HG ARG 87 0.539 7.509 0.261
723 2HG ARG 87 1HG ARG 87 -0.130 8.584 1.487
724 1HD ARG 87 2HD ARG 87 -1.473 6.633 1.587
725 2HD ARG 87 1HD ARG 87 -2.437 7.802 0.678
726 HE ARG 87 HE ARG 87 -1.157 6.470 -1.340
727 1HH1 ARG 87 2HH1 ARG 87 -3.846 6.016 0.584
728 2HH1 ARG 87 1HH1 ARG 87 -4.012 4.319 0.282
729 1HH2 ARG 87 1HH2 ARG 87 -0.947 4.035 -1.325
730 2HH2 ARG 87 2HH2 ARG 87 -2.369 3.198 -0.807
731 H VAL 88 H VAL 88 2.025 7.947 -0.662
732 HA VAL 88 HA VAL 88 3.708 8.764 -2.939
733 HB VAL 88 HB VAL 88 3.857 5.973 -1.911
734 1HG1 VAL 88 2HG1 VAL 88 5.756 8.191 -2.689
735 2HG1 VAL 88 1HG1 VAL 88 6.335 6.741 -1.869
736 3HG1 VAL 88 3HG1 VAL 88 5.549 6.610 -3.442
737 1HG2 VAL 88 2HG2 VAL 88 4.405 8.413 -0.211
738 2HG2 VAL 88 1HG2 VAL 88 3.512 6.955 0.223
739 3HG2 VAL 88 3HG2 VAL 88 5.266 6.898 0.052
740 H LEU 89 H LEU 89 1.622 8.885 -4.237
741 HA LEU 89 HA LEU 89 0.223 6.481 -4.931
742 1HB LEU 89 2HB LEU 89 0.431 9.134 -6.360
743 2HB LEU 89 1HB LEU 89 -0.684 7.853 -6.817
744 HG LEU 89 HG LEU 89 -0.937 9.842 -4.717
745 1HD1 LEU 89 3HD1 LEU 89 -2.774 7.690 -5.804
746 2HD1 LEU 89 2HD1 LEU 89 -3.284 9.042 -4.793
747 3HD1 LEU 89 1HD1 LEU 89 -2.636 9.342 -6.405
748 1HD2 LEU 89 3HD2 LEU 89 -1.005 6.935 -3.907
749 2HD2 LEU 89 2HD2 LEU 89 -0.220 8.281 -3.088
750 3HD2 LEU 89 1HD2 LEU 89 -1.977 8.145 -3.075
751 H ALA 90 H ALA 90 1.467 4.842 -5.696
752 HA ALA 90 HA ALA 90 2.453 5.057 -8.430
753 1HB ALA 90 3HB ALA 90 4.282 5.841 -6.628
754 2HB ALA 90 2HB ALA 90 4.552 4.100 -6.555
755 3HB ALA 90 1HB ALA 90 4.717 4.954 -8.088
756 H TYR 91 H TYR 91 3.791 2.800 -8.797
757 HA TYR 91 HA TYR 91 2.149 0.657 -7.530
758 1HB TYR 91 2HB TYR 91 2.870 1.115 -10.391
759 2HB TYR 91 1HB TYR 91 2.675 -0.541 -9.816
760 HD1 TYR 91 HD1 TYR 91 0.572 0.191 -7.626
761 HD2 TYR 91 HD2 TYR 91 0.892 1.120 -11.811
762 HE1 TYR 91 HE1 TYR 91 -1.884 0.467 -7.748
763 HE2 TYR 91 HE2 TYR 91 -1.569 1.392 -11.927
764 HH TYR 91 HH TYR 91 -3.624 0.313 -10.314
765 H ILE 92 H ILE 92 3.126 -1.383 -7.250
766 HA ILE 92 HA ILE 92 6.066 -1.189 -6.852
767 HB ILE 92 HB ILE 92 4.403 -3.476 -5.832
768 1HG1 ILE 92 2HG1 ILE 92 3.076 -1.520 -5.204
769 2HG1 ILE 92 1HG1 ILE 92 3.900 -2.148 -3.779
770 1HG2 ILE 92 3HG2 ILE 92 6.909 -2.012 -5.031
771 2HG2 ILE 92 2HG2 ILE 92 6.045 -3.017 -3.866
772 3HG2 ILE 92 1HG2 ILE 92 6.683 -3.733 -5.346
773 1HD1 ILE 92 2HD1 ILE 92 4.944 0.146 -5.467
774 2HD1 ILE 92 1HD1 ILE 92 4.025 0.350 -3.976
775 3HD1 ILE 92 3HD1 ILE 92 5.605 -0.429 -3.937
776 H TYR 93 H TYR 93 7.436 -2.539 -7.947
777 HA TYR 93 HA TYR 93 6.169 -4.502 -9.810
778 1HB TYR 93 2HB TYR 93 8.530 -2.654 -10.262
779 2HB TYR 93 1HB TYR 93 8.045 -3.931 -11.380
780 HD1 TYR 93 HD1 TYR 93 6.477 -1.084 -9.461
781 HD2 TYR 93 HD2 TYR 93 6.593 -3.362 -13.095
782 HE1 TYR 93 HE1 TYR 93 4.761 0.379 -10.437
783 HE2 TYR 93 HE2 TYR 93 4.878 -1.898 -14.075
784 HH TYR 93 HH TYR 93 2.879 -0.139 -12.569
785 H ALA 94 H ALA 94 6.573 -5.972 -7.928
786 HA ALA 94 HA ALA 94 9.346 -6.961 -7.986
787 1HB ALA 94 3HB ALA 94 8.703 -5.821 -5.842
788 2HB ALA 94 2HB ALA 94 7.461 -7.048 -5.623
789 3HB ALA 94 1HB ALA 94 9.162 -7.508 -5.633
790 H ASP 95 H ASP 95 9.565 -9.171 -8.167
791 HA ASP 95 HA ASP 95 8.963 -11.332 -8.870
792 1HB ASP 95 2HB ASP 95 7.203 -10.717 -6.508
793 2HB ASP 95 1HB ASP 95 7.028 -12.254 -7.355
794 H GLY 96 H GLY 96 8.232 -10.593 -10.981
795 1HA GLY 96 2HA GLY 96 6.386 -11.364 -12.484
796 2HA GLY 96 1HA GLY 96 5.254 -10.719 -11.293
797 H LYS 97 H LYS 97 6.698 -8.295 -10.729
798 HA LYS 97 HA LYS 97 7.038 -6.123 -11.522
799 1HB LYS 97 2HB LYS 97 8.063 -7.705 -13.559
800 2HB LYS 97 1HB LYS 97 6.898 -6.675 -14.392
801 1HG LYS 97 2HG LYS 97 7.968 -4.727 -13.072
802 2HG LYS 97 1HG LYS 97 9.289 -5.849 -12.744
803 1HD LYS 97 2HD LYS 97 9.946 -5.945 -14.968
804 2HD LYS 97 1HD LYS 97 8.334 -5.548 -15.569
805 1HE LYS 97 2HE LYS 97 8.725 -3.242 -14.427
806 2HE LYS 97 1HE LYS 97 10.426 -3.701 -14.430
807 1HZ LYS 97 3HZ LYS 97 10.236 -4.093 -16.837
808 2HZ LYS 97 2HZ LYS 97 8.636 -3.520 -16.793
809 3HZ LYS 97 1HZ LYS 97 9.925 -2.479 -16.415
810 H MET 98 H MET 98 5.470 -4.643 -11.547
811 HA MET 98 HA MET 98 3.520 -3.482 -12.122
812 1HB MET 98 2HB MET 98 4.125 -4.632 -14.473
813 2HB MET 98 1HB MET 98 2.637 -5.511 -14.118
814 1HG MET 98 2HG MET 98 1.401 -3.434 -13.876
815 2HG MET 98 1HG MET 98 2.882 -2.491 -14.045
816 1HE MET 98 2HE MET 98 1.113 -5.519 -15.762
817 2HE MET 98 1HE MET 98 -0.043 -4.192 -15.684
818 3HE MET 98 3HE MET 98 0.544 -4.770 -17.251
819 H VAL 99 H VAL 99 3.722 -6.402 -10.668
820 HA VAL 99 HA VAL 99 2.313 -7.660 -9.338
821 HB VAL 99 HB VAL 99 1.695 -5.010 -8.991
822 1HG1 VAL 99 2HG1 VAL 99 -0.362 -5.532 -10.514
823 2HG1 VAL 99 1HG1 VAL 99 -0.989 -6.385 -9.107
824 3HG1 VAL 99 3HG1 VAL 99 -0.635 -4.661 -9.007
825 1HG2 VAL 99 2HG2 VAL 99 0.540 -7.429 -7.571
826 2HG2 VAL 99 1HG2 VAL 99 2.089 -6.660 -7.229
827 3HG2 VAL 99 3HG2 VAL 99 0.586 -5.795 -6.911
828 H ASN 100 H ASN 100 1.632 -7.201 -12.530
829 HA ASN 100 HA ASN 100 -1.083 -8.314 -12.566
830 1HB ASN 100 2HB ASN 100 -0.921 -8.169 -14.979
831 2HB ASN 100 1HB ASN 100 -0.267 -6.684 -14.294
832 1HD2 ASN 100 2HD2 ASN 100 2.047 -8.691 -16.792
833 2HD2 ASN 100 1HD2 ASN 100 0.352 -8.764 -16.743
834 H GLU 101 H GLU 101 0.276 -10.114 -11.119
835 HA GLU 101 HA GLU 101 1.597 -12.167 -12.681
836 1HB GLU 101 2HB GLU 101 1.647 -11.664 -10.082
837 2HB GLU 101 1HB GLU 101 0.283 -12.782 -10.057
838 1HG GLU 101 2HG GLU 101 2.096 -14.236 -9.789
839 2HG GLU 101 1HG GLU 101 1.844 -14.292 -11.534
840 H ALA 102 H ALA 102 -1.743 -11.627 -11.611
841 HA ALA 102 HA ALA 102 -2.768 -14.218 -12.284
842 1HB ALA 102 2HB ALA 102 -3.943 -12.413 -10.923
843 2HB ALA 102 1HB ALA 102 -4.302 -11.610 -12.453
844 3HB ALA 102 3HB ALA 102 -4.947 -13.221 -12.128
845 H LEU 103 HN LEU 103 -2.635 -15.097 -14.285
846 HA LEU 103 HA LEU 103 -3.082 -13.312 -16.649
847 1HB LEU 103 2HB LEU 103 -0.774 -14.691 -16.096
848 2HB LEU 103 1HB LEU 103 -1.635 -15.846 -17.113
849 HG LEU 103 HG LEU 103 -2.082 -13.668 -18.586
850 1HD1 LEU 103 2HD1 LEU 103 -0.887 -12.231 -16.884
851 2HD1 LEU 103 1HD1 LEU 103 0.603 -13.072 -17.312
852 3HD1 LEU 103 3HD1 LEU 103 -0.243 -12.105 -18.521
853 1HD2 LEU 103 2HD2 LEU 103 -0.854 -15.787 -19.213
854 2HD2 LEU 103 1HD2 LEU 103 -0.212 -14.331 -19.972
855 3HD2 LEU 103 3HD2 LEU 103 0.620 -15.046 -18.591
No H/Q in entry = 855
Start of MODEL 2
Raw file had 866 H/Q atoms
Start of MODEL 2
1 1H ALA 1 2H ALA 1 16.886 11.150 -18.265
2 2H ALA 1 1H ALA 1 18.123 9.985 -18.191
3 3H ALA 1 3H ALA 1 18.513 11.626 -18.381
4 HA ALA 1 HA ALA 1 17.499 11.672 -20.556
5 1HB ALA 1 1HB ALA 1 19.467 9.410 -20.102
6 2HB ALA 1 3HB ALA 1 19.072 10.071 -21.688
7 3HB ALA 1 2HB ALA 1 19.856 11.088 -20.478
8 H THR 2 H THR 2 15.386 11.073 -20.943
9 HA THR 2 HA THR 2 13.567 9.720 -21.518
10 HB THR 2 HB THR 2 15.582 7.558 -22.173
11 HG1 THR 2 HG1 THR 2 16.461 8.954 -23.456
12 1HG2 THR 2 2HG2 THR 2 12.820 8.329 -23.051
13 2HG2 THR 2 1HG2 THR 2 13.874 7.473 -24.176
14 3HG2 THR 2 3HG2 THR 2 13.452 6.738 -22.629
15 H SER 3 H SER 3 14.478 9.665 -18.745
16 HA SER 3 HA SER 3 13.056 7.267 -17.875
17 1HB SER 3 2HB SER 3 15.679 6.807 -18.269
18 2HB SER 3 1HB SER 3 15.766 7.480 -16.645
19 HG SER 3 HG SER 3 15.004 5.045 -17.405
20 H THR 4 H THR 4 12.698 10.140 -17.600
21 HA THR 4 HA THR 4 12.553 10.275 -14.642
22 HB THR 4 HB THR 4 13.813 12.469 -16.324
23 HG1 THR 4 HG1 THR 4 15.470 11.202 -16.011
24 1HG2 THR 4 2HG2 THR 4 13.072 12.241 -13.408
25 2HG2 THR 4 1HG2 THR 4 14.336 13.345 -13.951
26 3HG2 THR 4 3HG2 THR 4 12.686 13.537 -14.540
27 H LYS 5 H LYS 5 10.853 11.589 -13.902
28 HA LYS 5 HA LYS 5 8.906 12.885 -13.983
29 1HB LYS 5 2HB LYS 5 10.434 13.940 -16.040
30 2HB LYS 5 1HB LYS 5 8.923 13.516 -16.844
31 1HG LYS 5 2HG LYS 5 7.703 15.052 -15.660
32 2HG LYS 5 1HG LYS 5 8.671 14.849 -14.199
33 1HD LYS 5 2HD LYS 5 10.542 16.076 -15.348
34 2HD LYS 5 1HD LYS 5 9.440 16.402 -16.686
35 1HE LYS 5 2HE LYS 5 7.929 17.612 -15.202
36 2HE LYS 5 1HE LYS 5 8.925 17.201 -13.806
37 1HZ LYS 5 2HZ LYS 5 10.764 18.418 -14.820
38 2HZ LYS 5 1HZ LYS 5 9.770 18.845 -16.131
39 3HZ LYS 5 3HZ LYS 5 9.415 19.424 -14.577
40 H LYS 6 H LYS 6 8.983 9.982 -14.623
41 HA LYS 6 HA LYS 6 6.253 9.798 -15.667
42 1HB LYS 6 2HB LYS 6 7.653 7.744 -17.089
43 2HB LYS 6 1HB LYS 6 6.689 9.060 -17.744
44 1HG LYS 6 2HG LYS 6 8.814 9.344 -18.736
45 2HG LYS 6 1HG LYS 6 8.795 10.520 -17.426
46 1HD LYS 6 2HD LYS 6 10.876 9.469 -17.161
47 2HD LYS 6 1HD LYS 6 9.860 8.615 -16.005
48 1HE LYS 6 2HE LYS 6 11.040 6.916 -17.197
49 2HE LYS 6 1HE LYS 6 9.410 6.920 -17.869
50 1HZ LYS 6 3HZ LYS 6 11.493 8.606 -19.087
51 2HZ LYS 6 2HZ LYS 6 11.446 6.945 -19.442
52 3HZ LYS 6 1HZ LYS 6 10.108 7.930 -19.796
53 H LEU 7 H LEU 7 8.723 7.234 -15.569
54 HA LEU 7 HA LEU 7 7.691 6.248 -12.983
55 1HB LEU 7 2HB LEU 7 7.214 4.934 -15.632
56 2HB LEU 7 1HB LEU 7 7.562 3.902 -14.246
57 HG LEU 7 HG LEU 7 5.728 5.720 -13.229
58 1HD1 LEU 7 1HD1 LEU 7 4.914 4.913 -16.039
59 2HD1 LEU 7 3HD1 LEU 7 3.863 5.692 -14.857
60 3HD1 LEU 7 2HD1 LEU 7 5.260 6.556 -15.499
61 1HD2 LEU 7 2HD2 LEU 7 5.875 3.223 -12.918
62 2HD2 LEU 7 1HD2 LEU 7 4.231 3.815 -13.155
63 3HD2 LEU 7 3HD2 LEU 7 5.088 3.034 -14.484
64 H HIS 8 H HIS 8 9.115 4.612 -12.056
65 HA HIS 8 HA HIS 8 11.559 3.852 -13.460
66 1HB HIS 8 2HB HIS 8 11.712 6.295 -12.294
67 2HB HIS 8 1HB HIS 8 12.170 5.273 -10.933
68 HD1 HIS 8 HD1 HIS 8 13.651 6.956 -13.705
69 HD2 HIS 8 HD2 HIS 8 14.263 3.242 -11.913
70 HE1 HIS 8 HE1 HIS 8 15.951 6.183 -14.426
71 H LYS 9 H LYS 9 12.165 1.926 -12.703
72 HA LYS 9 HA LYS 9 10.741 0.654 -10.516
73 1HB LYS 9 2HB LYS 9 12.487 -1.204 -10.948
74 2HB LYS 9 1HB LYS 9 11.368 -0.823 -12.255
75 1HG LYS 9 2HG LYS 9 12.993 0.203 -13.541
76 2HG LYS 9 1HG LYS 9 13.953 0.677 -12.139
77 1HD LYS 9 2HD LYS 9 15.278 -1.059 -12.862
78 2HD LYS 9 1HD LYS 9 14.146 -1.998 -11.889
79 1HE LYS 9 2HE LYS 9 13.413 -1.436 -14.735
80 2HE LYS 9 1HE LYS 9 14.650 -2.652 -14.422
81 1HZ LYS 9 2HZ LYS 9 13.085 -3.720 -12.863
82 2HZ LYS 9 1HZ LYS 9 11.887 -2.608 -13.332
83 3HZ LYS 9 3HZ LYS 9 12.516 -3.703 -14.465
84 H GLU 10 H GLU 10 11.568 0.021 -8.485
85 HA GLU 10 HA GLU 10 14.294 0.686 -7.677
86 1HB GLU 10 2HB GLU 10 12.673 2.832 -7.569
87 2HB GLU 10 1HB GLU 10 12.219 2.084 -6.037
88 1HG GLU 10 2HG GLU 10 15.134 2.324 -6.684
89 2HG GLU 10 1HG GLU 10 14.269 3.774 -6.174
90 HA PRO 11 HA PRO 11 12.979 -3.044 -5.625
91 1HB PRO 11 2HB PRO 11 15.396 -2.728 -4.003
92 2HB PRO 11 1HB PRO 11 14.957 -4.017 -5.133
93 1HG PRO 11 2HG PRO 11 16.843 -1.976 -5.598
94 2HG PRO 11 1HG PRO 11 16.177 -3.084 -6.803
95 1HD PRO 11 2HD PRO 11 15.682 -0.235 -6.517
96 2HD PRO 11 1HD PRO 11 15.111 -1.331 -7.793
97 H ALA 12 H ALA 12 11.615 -3.161 -4.028
98 HA ALA 12 HA ALA 12 11.708 -1.218 -1.764
99 1HB ALA 12 1HB ALA 12 9.649 -1.818 -3.544
100 2HB ALA 12 3HB ALA 12 9.222 -2.708 -2.085
101 3HB ALA 12 2HB ALA 12 9.478 -0.964 -2.011
102 H THR 13 H THR 13 9.764 -2.858 -0.239
103 HA THR 13 HA THR 13 11.030 -5.461 0.181
104 HB THR 13 HB THR 13 12.672 -4.288 1.407
105 HG1 THR 13 HG1 THR 13 12.088 -5.773 2.829
106 1HG2 THR 13 3HG2 THR 13 11.537 -2.093 1.308
107 2HG2 THR 13 2HG2 THR 13 10.443 -2.612 2.589
108 3HG2 THR 13 1HG2 THR 13 12.164 -2.426 2.922
109 H LEU 14 H LEU 14 9.558 -6.848 1.044
110 HA LEU 14 HA LEU 14 6.837 -6.147 1.409
111 1HB LEU 14 2HB LEU 14 7.799 -8.454 0.937
112 2HB LEU 14 1HB LEU 14 8.264 -8.532 2.634
113 HG LEU 14 HG LEU 14 5.440 -8.071 1.658
114 1HD1 LEU 14 2HD1 LEU 14 6.322 -10.325 1.068
115 2HD1 LEU 14 1HD1 LEU 14 6.714 -10.591 2.767
116 3HD1 LEU 14 3HD1 LEU 14 5.032 -10.409 2.268
117 1HD2 LEU 14 3HD2 LEU 14 6.733 -8.346 4.352
118 2HD2 LEU 14 2HD2 LEU 14 5.449 -7.252 3.840
119 3HD2 LEU 14 1HD2 LEU 14 5.093 -8.953 4.131
120 H ILE 15 H ILE 15 6.130 -4.780 3.014
121 HA ILE 15 HA ILE 15 7.326 -5.172 5.735
122 HB ILE 15 HB ILE 15 6.244 -2.767 6.070
123 1HG1 ILE 15 2HG1 ILE 15 6.889 -2.815 3.102
124 2HG1 ILE 15 1HG1 ILE 15 5.270 -2.674 3.787
125 1HG2 ILE 15 3HG2 ILE 15 8.669 -3.491 6.214
126 2HG2 ILE 15 2HG2 ILE 15 8.818 -3.081 4.505
127 3HG2 ILE 15 1HG2 ILE 15 8.422 -1.828 5.682
128 1HD1 ILE 15 3HD1 ILE 15 6.371 -0.657 5.115
129 2HD1 ILE 15 2HD1 ILE 15 7.498 -0.674 3.761
130 3HD1 ILE 15 1HD1 ILE 15 5.778 -0.431 3.472
131 H LYS 16 H LYS 16 4.314 -4.576 3.930
132 HA LYS 16 HA LYS 16 2.749 -6.343 5.491
133 1HB LYS 16 2HB LYS 16 3.282 -4.114 7.000
134 2HB LYS 16 1HB LYS 16 1.755 -3.669 6.239
135 1HG LYS 16 2HG LYS 16 1.703 -6.429 7.150
136 2HG LYS 16 1HG LYS 16 2.076 -5.327 8.475
137 1HD LYS 16 2HD LYS 16 0.035 -4.267 8.358
138 2HD LYS 16 1HD LYS 16 -0.120 -4.530 6.620
139 1HE LYS 16 2HE LYS 16 -0.413 -7.011 7.157
140 2HE LYS 16 1HE LYS 16 -0.588 -6.527 8.843
141 1HZ LYS 16 1HZ LYS 16 -2.253 -5.544 6.587
142 2HZ LYS 16 3HZ LYS 16 -2.730 -6.703 7.729
143 3HZ LYS 16 2HZ LYS 16 -2.429 -5.104 8.219
144 H ALA 17 H ALA 17 0.416 -6.174 4.957
145 HA ALA 17 HA ALA 17 -0.079 -4.575 2.466
146 1HB ALA 17 1HB ALA 17 -0.660 -7.443 3.133
147 2HB ALA 17 3HB ALA 17 -1.828 -6.573 2.138
148 3HB ALA 17 2HB ALA 17 -0.156 -6.732 1.600
149 H ILE 18 H ILE 18 -1.206 -2.909 3.276
150 HA ILE 18 HA ILE 18 -2.913 -2.838 5.508
151 HB ILE 18 HB ILE 18 -2.861 -1.244 2.945
152 1HG1 ILE 18 2HG1 ILE 18 -2.290 0.206 5.369
153 2HG1 ILE 18 1HG1 ILE 18 -1.312 -1.261 5.330
154 1HG2 ILE 18 3HG2 ILE 18 -4.647 -0.968 5.372
155 2HG2 ILE 18 2HG2 ILE 18 -4.241 0.427 4.373
156 3HG2 ILE 18 1HG2 ILE 18 -5.104 -0.939 3.669
157 1HD1 ILE 18 2HD1 ILE 18 -0.646 -0.656 2.970
158 2HD1 ILE 18 1HD1 ILE 18 -1.466 0.888 3.199
159 3HD1 ILE 18 3HD1 ILE 18 -0.071 0.475 4.195
160 H ASP 19 H ASP 19 -3.580 -3.936 2.217
161 HA ASP 19 HA ASP 19 -5.346 -5.253 1.416
162 1HB ASP 19 2HB ASP 19 -5.412 -5.935 4.007
163 2HB ASP 19 1HB ASP 19 -6.929 -5.039 3.937
164 H GLY 20 H GLY 20 -7.270 -4.747 0.359
165 1HA GLY 20 2HA GLY 20 -9.313 -3.483 0.039
166 2HA GLY 20 1HA GLY 20 -8.698 -2.261 1.154
167 H ASP 21 H ASP 21 -7.403 -0.597 0.350
168 HA ASP 21 HA ASP 21 -6.657 -0.715 -2.536
169 1HB ASP 21 2HB ASP 21 -7.764 1.791 -1.254
170 2HB ASP 21 1HB ASP 21 -7.554 1.443 -2.970
171 H THR 22 H THR 22 -4.828 -1.212 -0.469
172 HA THR 22 HA THR 22 -2.953 0.971 -0.919
173 HB THR 22 HB THR 22 -2.665 1.011 1.779
174 HG1 THR 22 HG1 THR 22 -4.861 1.248 2.567
175 1HG2 THR 22 3HG2 THR 22 -3.185 2.832 -0.107
176 2HG2 THR 22 2HG2 THR 22 -4.767 2.813 0.671
177 3HG2 THR 22 1HG2 THR 22 -3.329 3.209 1.611
178 H VAL 23 H VAL 23 -0.840 0.344 -0.649
179 HA VAL 23 HA VAL 23 -0.219 -2.212 0.740
180 HB VAL 23 HB VAL 23 1.263 -2.888 -1.155
181 1HG1 VAL 23 3HG1 VAL 23 -1.121 -3.711 -0.888
182 2HG1 VAL 23 2HG1 VAL 23 -1.594 -2.499 -2.080
183 3HG1 VAL 23 1HG1 VAL 23 -0.485 -3.794 -2.532
184 1HG2 VAL 23 2HG2 VAL 23 1.503 -0.594 -2.121
185 2HG2 VAL 23 1HG2 VAL 23 1.023 -1.790 -3.324
186 3HG2 VAL 23 3HG2 VAL 23 -0.173 -0.678 -2.660
187 H LYS 24 H LYS 24 1.876 -2.149 1.744
188 HA LYS 24 HA LYS 24 3.265 0.475 1.382
189 1HB LYS 24 2HB LYS 24 4.078 0.111 3.766
190 2HB LYS 24 1HB LYS 24 2.361 0.458 3.583
191 1HG LYS 24 2HG LYS 24 1.755 -1.813 3.920
192 2HG LYS 24 1HG LYS 24 3.415 -2.366 3.707
193 1HD LYS 24 2HD LYS 24 3.449 -2.344 5.989
194 2HD LYS 24 1HD LYS 24 3.740 -0.619 5.769
195 1HE LYS 24 2HE LYS 24 1.451 -0.076 6.126
196 2HE LYS 24 1HE LYS 24 0.943 -1.754 5.931
197 1HZ LYS 24 2HZ LYS 24 2.310 -2.259 7.943
198 2HZ LYS 24 1HZ LYS 24 2.495 -0.585 8.172
199 3HZ LYS 24 3HZ LYS 24 0.950 -1.282 8.236
200 H LEU 25 H LEU 25 5.447 0.528 1.203
201 HA LEU 25 HA LEU 25 7.059 -1.939 1.434
202 1HB LEU 25 2HB LEU 25 6.768 -0.363 -1.144
203 2HB LEU 25 1HB LEU 25 8.054 -1.526 -0.841
204 HG LEU 25 HG LEU 25 5.845 -2.992 -0.170
205 1HD1 LEU 25 2HD1 LEU 25 5.118 -1.118 -2.440
206 2HD1 LEU 25 1HD1 LEU 25 4.270 -2.628 -2.114
207 3HD1 LEU 25 3HD1 LEU 25 4.251 -1.333 -0.920
208 1HD2 LEU 25 1HD2 LEU 25 7.439 -2.649 -2.693
209 2HD2 LEU 25 3HD2 LEU 25 7.482 -3.971 -1.526
210 3HD2 LEU 25 2HD2 LEU 25 6.121 -3.818 -2.638
211 H MET 26 H MET 26 9.080 -1.396 2.195
212 HA MET 26 HA MET 26 9.649 1.452 2.640
213 1HB MET 26 2HB MET 26 10.703 -1.130 3.656
214 2HB MET 26 1HB MET 26 11.872 0.184 3.554
215 1HG MET 26 2HG MET 26 10.594 1.579 4.989
216 2HG MET 26 1HG MET 26 9.160 0.564 4.826
217 1HE MET 26 3HE MET 26 12.459 1.285 6.361
218 2HE MET 26 2HE MET 26 11.160 1.652 7.493
219 3HE MET 26 1HE MET 26 12.359 0.428 7.905
220 H TYR 27 H TYR 27 9.790 1.893 0.287
221 HA TYR 27 HA TYR 27 12.015 0.771 -1.238
222 1HB TYR 27 2HB TYR 27 11.277 2.161 -3.030
223 2HB TYR 27 1HB TYR 27 9.805 1.666 -2.197
224 HD1 TYR 27 HD2 TYR 27 8.732 3.246 -0.537
225 HD2 TYR 27 HD1 TYR 27 11.923 4.444 -3.145
226 HE1 TYR 27 HE2 TYR 27 8.190 5.624 -0.109
227 HE2 TYR 27 HE1 TYR 27 11.381 6.823 -2.717
228 HH TYR 27 HH TYR 27 10.244 8.142 -0.846
229 H LYS 28 H LYS 28 11.403 3.778 0.570
230 HA LYS 28 HA LYS 28 14.232 4.574 0.113
231 1HB LYS 28 2HB LYS 28 12.350 6.156 -0.602
232 2HB LYS 28 1HB LYS 28 12.011 6.367 1.113
233 1HG LYS 28 2HG LYS 28 14.835 6.656 0.685
234 2HG LYS 28 1HG LYS 28 13.978 7.695 -0.454
235 1HD LYS 28 2HD LYS 28 13.141 7.628 2.435
236 2HD LYS 28 1HD LYS 28 14.520 8.607 1.942
237 1HE LYS 28 2HE LYS 28 11.867 8.790 0.511
238 2HE LYS 28 1HE LYS 28 12.205 9.753 1.949
239 1HZ LYS 28 1HZ LYS 28 14.201 10.600 0.818
240 2HZ LYS 28 3HZ LYS 28 13.758 9.752 -0.581
241 3HZ LYS 28 2HZ LYS 28 12.769 11.004 0.000
242 H GLY 29 H GLY 29 13.402 2.572 2.041
243 1HA GLY 29 2HA GLY 29 13.981 2.014 4.244
244 2HA GLY 29 1HA GLY 29 14.738 3.600 4.388
245 H GLN 30 H GLN 30 11.472 3.693 3.318
246 HA GLN 30 HA GLN 30 10.441 4.050 6.075
247 1HB GLN 30 2HB GLN 30 9.180 6.130 5.068
248 2HB GLN 30 1HB GLN 30 10.834 6.312 5.645
249 1HG GLN 30 2HG GLN 30 11.720 6.173 3.415
250 2HG GLN 30 1HG GLN 30 10.161 5.675 2.761
251 1HE2 GLN 30 2HE2 GLN 30 9.420 9.037 2.024
252 2HE2 GLN 30 1HE2 GLN 30 9.448 7.422 1.503
253 HA PRO 31 HA PRO 31 7.205 1.581 4.345
254 1HB PRO 31 2HB PRO 31 5.424 2.335 6.469
255 2HB PRO 31 1HB PRO 31 6.350 0.837 6.312
256 1HG PRO 31 2HG PRO 31 6.822 3.016 8.143
257 2HG PRO 31 1HG PRO 31 7.734 1.509 7.989
258 1HD PRO 31 2HD PRO 31 8.545 4.157 7.178
259 2HD PRO 31 1HD PRO 31 9.460 2.643 7.035
260 H MET 32 H MET 32 6.181 2.438 2.581
261 HA MET 32 HA MET 32 4.647 4.985 2.916
262 1HB MET 32 2HB MET 32 6.394 3.916 0.812
263 2HB MET 32 1HB MET 32 4.856 4.514 0.190
264 1HG MET 32 2HG MET 32 6.525 6.319 0.242
265 2HG MET 32 1HG MET 32 5.218 6.655 1.378
266 1HE MET 32 3HE MET 32 5.325 6.726 3.792
267 2HE MET 32 2HE MET 32 6.816 7.277 4.552
268 3HE MET 32 1HE MET 32 6.179 8.139 3.155
269 H THR 33 H THR 33 3.001 4.832 0.715
270 HA THR 33 HA THR 33 1.526 2.272 0.841
271 HB THR 33 HB THR 33 0.319 3.361 2.541
272 HG1 THR 33 HG1 THR 33 -1.083 2.723 0.888
273 1HG2 THR 33 1HG2 THR 33 1.514 5.558 2.203
274 2HG2 THR 33 3HG2 THR 33 0.348 5.929 0.934
275 3HG2 THR 33 2HG2 THR 33 -0.196 5.714 2.598
276 H PHE 34 H PHE 34 1.749 1.820 -1.321
277 HA PHE 34 HA PHE 34 1.297 4.002 -3.287
278 1HB PHE 34 2HB PHE 34 2.189 1.247 -4.072
279 2HB PHE 34 1HB PHE 34 2.585 2.798 -4.808
280 HD1 PHE 34 HD2 PHE 34 3.325 0.493 -2.017
281 HD2 PHE 34 HD1 PHE 34 4.351 4.198 -3.919
282 HE1 PHE 34 HE2 PHE 34 5.411 0.604 -0.692
283 HE2 PHE 34 HE1 PHE 34 6.443 4.306 -2.594
284 HZ PHE 34 HZ PHE 34 6.973 2.505 -0.976
285 H ARG 35 H ARG 35 -0.980 4.125 -3.394
286 HA ARG 35 HA ARG 35 -2.202 2.119 -5.082
287 1HB ARG 35 2HB ARG 35 -2.303 1.391 -2.509
288 2HB ARG 35 1HB ARG 35 -3.734 2.421 -2.565
289 1HG ARG 35 2HG ARG 35 -4.786 0.578 -3.370
290 2HG ARG 35 1HG ARG 35 -3.984 0.983 -4.885
291 1HD ARG 35 2HD ARG 35 -2.338 -0.554 -2.969
292 2HD ARG 35 1HD ARG 35 -3.718 -1.421 -3.636
293 HE ARG 35 HE ARG 35 -2.487 -0.183 -5.826
294 1HH1 ARG 35 1HH2 ARG 35 -2.643 -3.200 -4.761
295 2HH1 ARG 35 2HH2 ARG 35 -1.004 -3.664 -5.069
296 1HH2 ARG 35 2HH1 ARG 35 0.088 -0.408 -5.626
297 2HH2 ARG 35 1HH1 ARG 35 0.549 -2.076 -5.563
298 H LEU 36 H LEU 36 -3.628 3.049 -6.326
299 HA LEU 36 HA LEU 36 -5.778 4.667 -5.883
300 1HB LEU 36 2HB LEU 36 -3.523 6.221 -5.172
301 2HB LEU 36 1HB LEU 36 -4.026 6.816 -6.750
302 HG LEU 36 HG LEU 36 -5.242 8.064 -5.073
303 1HD1 LEU 36 2HD1 LEU 36 -6.444 7.085 -7.158
304 2HD1 LEU 36 1HD1 LEU 36 -7.230 5.999 -6.011
305 3HD1 LEU 36 3HD1 LEU 36 -7.441 7.744 -5.861
306 1HD2 LEU 36 3HD2 LEU 36 -5.878 5.321 -3.964
307 2HD2 LEU 36 2HD2 LEU 36 -5.106 6.675 -3.141
308 3HD2 LEU 36 1HD2 LEU 36 -6.823 6.746 -3.534
309 H LEU 37 H LEU 37 -2.827 4.952 -7.884
310 HA LEU 37 HA LEU 37 -4.387 5.198 -10.358
311 1HB LEU 37 2HB LEU 37 -1.673 5.659 -9.561
312 2HB LEU 37 1HB LEU 37 -1.656 4.473 -10.866
313 HG LEU 37 HG LEU 37 -3.405 6.894 -11.140
314 1HD1 LEU 37 3HD1 LEU 37 -0.401 6.804 -11.526
315 2HD1 LEU 37 2HD1 LEU 37 -1.437 8.036 -12.250
316 3HD1 LEU 37 1HD1 LEU 37 -1.314 7.905 -10.495
317 1HD2 LEU 37 2HD2 LEU 37 -3.090 4.769 -12.720
318 2HD2 LEU 37 1HD2 LEU 37 -3.318 6.381 -13.399
319 3HD2 LEU 37 3HD2 LEU 37 -1.697 5.692 -13.287
320 H LEU 38 H LEU 38 -2.589 2.733 -8.574
321 HA LEU 38 HA LEU 38 -2.923 0.664 -10.605
322 1HB LEU 38 2HB LEU 38 -1.060 0.744 -8.859
323 2HB LEU 38 1HB LEU 38 -2.270 0.316 -7.656
324 HG LEU 38 HG LEU 38 -0.859 -1.593 -8.722
325 1HD1 LEU 38 3HD1 LEU 38 -3.145 -1.647 -7.408
326 2HD1 LEU 38 2HD1 LEU 38 -3.801 -2.106 -8.978
327 3HD1 LEU 38 1HD1 LEU 38 -2.554 -3.096 -8.221
328 1HD2 LEU 38 3HD2 LEU 38 -1.263 -0.770 -11.073
329 2HD2 LEU 38 2HD2 LEU 38 -1.666 -2.467 -10.826
330 3HD2 LEU 38 1HD2 LEU 38 -2.948 -1.260 -10.896
331 H VAL 39 H VAL 39 -4.101 0.743 -7.213
332 HA VAL 39 HA VAL 39 -6.457 -0.839 -7.968
333 HB VAL 39 HB VAL 39 -5.492 0.303 -5.321
334 1HG1 VAL 39 1HG1 VAL 39 -8.103 -0.986 -6.078
335 2HG1 VAL 39 3HG1 VAL 39 -7.421 -1.274 -4.478
336 3HG1 VAL 39 2HG1 VAL 39 -7.806 0.369 -4.989
337 1HG2 VAL 39 1HG2 VAL 39 -5.725 -2.475 -6.515
338 2HG2 VAL 39 3HG2 VAL 39 -4.257 -1.643 -6.006
339 3HG2 VAL 39 2HG2 VAL 39 -5.420 -2.189 -4.802
340 H ASP 40 H ASP 40 -7.855 0.387 -9.188
341 HA ASP 40 HA ASP 40 -8.552 3.129 -8.266
342 1HB ASP 40 2HB ASP 40 -8.018 2.238 -10.775
343 2HB ASP 40 1HB ASP 40 -9.769 2.034 -10.747
344 H THR 41 H THR 41 -9.469 0.824 -6.771
345 HA THR 41 HA THR 41 -12.253 0.325 -7.439
346 HB THR 41 HB THR 41 -10.482 -0.376 -5.095
347 HG1 THR 41 HG1 THR 41 -10.079 -1.704 -6.738
348 1HG2 THR 41 2HG2 THR 41 -13.439 -0.731 -5.463
349 2HG2 THR 41 1HG2 THR 41 -12.507 -1.922 -4.555
350 3HG2 THR 41 3HG2 THR 41 -12.550 -0.242 -4.020
351 HA PRO 42 HA PRO 42 -12.868 3.172 -3.541
352 1HB PRO 42 2HB PRO 42 -10.748 5.070 -3.389
353 2HB PRO 42 1HB PRO 42 -11.110 3.773 -2.243
354 1HG PRO 42 2HG PRO 42 -8.908 3.936 -4.122
355 2HG PRO 42 1HG PRO 42 -9.219 2.697 -2.902
356 1HD PRO 42 2HD PRO 42 -9.537 2.482 -5.752
357 2HD PRO 42 1HD PRO 42 -9.862 1.240 -4.529
358 H GLU 43 H GLU 43 -14.473 4.200 -4.730
359 HA GLU 43 HA GLU 43 -13.986 6.884 -5.693
360 1HB GLU 43 2HB GLU 43 -14.726 6.411 -8.076
361 2HB GLU 43 1HB GLU 43 -13.110 5.838 -7.670
362 1HG GLU 43 2HG GLU 43 -13.898 3.576 -7.394
363 2HG GLU 43 1HG GLU 43 -15.582 4.089 -7.526
364 H THR 44 H THR 44 -15.779 5.476 -3.859
365 HA THR 44 HA THR 44 -18.319 6.653 -4.770
366 HB THR 44 HB THR 44 -19.537 4.471 -4.118
367 HG1 THR 44 HG1 THR 44 -18.145 3.080 -3.364
368 1HG2 THR 44 1HG2 THR 44 -19.017 5.444 -6.490
369 2HG2 THR 44 3HG2 THR 44 -17.871 4.107 -6.589
370 3HG2 THR 44 2HG2 THR 44 -19.587 3.781 -6.348
371 H LYS 45 H LYS 45 -16.953 7.758 -2.832
372 HA LYS 45 HA LYS 45 -17.722 6.582 -0.216
373 1HB LYS 45 2HB LYS 45 -15.791 8.701 -1.109
374 2HB LYS 45 1HB LYS 45 -16.368 8.707 0.558
375 1HG LYS 45 2HG LYS 45 -14.400 7.380 0.610
376 2HG LYS 45 1HG LYS 45 -15.725 6.217 0.616
377 1HD LYS 45 2HD LYS 45 -14.769 5.264 -1.194
378 2HD LYS 45 1HD LYS 45 -15.228 6.704 -2.101
379 1HE LYS 45 2HE LYS 45 -12.739 6.825 -0.449
380 2HE LYS 45 1HE LYS 45 -12.687 5.920 -1.961
381 1HZ LYS 45 3HZ LYS 45 -13.574 7.892 -3.092
382 2HZ LYS 45 2HZ LYS 45 -13.512 8.755 -1.629
383 3HZ LYS 45 1HZ LYS 45 -12.079 8.199 -2.353
384 H HIS 46 H HIS 46 -18.597 9.195 -2.376
385 HA HIS 46 HA HIS 46 -20.033 10.724 -0.345
386 1HB HIS 46 2HB HIS 46 -19.075 11.307 -2.867
387 2HB HIS 46 1HB HIS 46 -20.814 11.184 -3.142
388 HD1 HIS 46 HD1 HIS 46 -18.278 13.084 -1.082
389 HD2 HIS 46 HD2 HIS 46 -22.338 13.254 -2.013
390 HE1 HIS 46 HE1 HIS 46 -19.127 15.295 -0.183
391 HA PRO 47 HA PRO 47 -23.874 8.767 -2.482
392 1HB PRO 47 2HB PRO 47 -23.248 6.611 -4.195
393 2HB PRO 47 1HB PRO 47 -23.726 8.241 -4.690
394 1HG PRO 47 2HG PRO 47 -21.108 6.987 -4.906
395 2HG PRO 47 1HG PRO 47 -21.636 8.551 -5.543
396 1HD PRO 47 2HD PRO 47 -19.959 8.040 -3.246
397 2HD PRO 47 1HD PRO 47 -20.451 9.607 -3.915
398 H LYS 48 H LYS 48 -22.293 7.806 -0.183
399 HA LYS 48 HA LYS 48 -22.279 6.081 1.391
400 1HB LYS 48 2HB LYS 48 -24.733 5.313 -0.217
401 2HB LYS 48 1HB LYS 48 -24.268 4.523 1.288
402 1HG LYS 48 2HG LYS 48 -24.179 7.358 1.700
403 2HG LYS 48 1HG LYS 48 -25.730 6.951 0.962
404 1HD LYS 48 2HD LYS 48 -24.911 5.067 3.065
405 2HD LYS 48 1HD LYS 48 -25.144 6.713 3.651
406 1HE LYS 48 2HE LYS 48 -27.381 6.772 2.606
407 2HE LYS 48 1HE LYS 48 -27.152 5.122 2.026
408 1HZ LYS 48 1HZ LYS 48 -27.137 5.963 4.875
409 2HZ LYS 48 3HZ LYS 48 -28.423 5.188 4.086
410 3HZ LYS 48 2HZ LYS 48 -26.949 4.374 4.304
411 H LYS 49 H LYS 49 -22.698 3.376 1.290
412 HA LYS 49 HA LYS 49 -20.475 2.488 -0.398
413 1HB LYS 49 2HB LYS 49 -20.919 0.251 0.662
414 2HB LYS 49 1HB LYS 49 -20.632 1.540 1.829
415 1HG LYS 49 2HG LYS 49 -22.636 1.157 2.774
416 2HG LYS 49 1HG LYS 49 -23.439 1.468 1.236
417 1HD LYS 49 2HD LYS 49 -22.478 -1.018 0.754
418 2HD LYS 49 1HD LYS 49 -22.712 -1.117 2.500
419 1HE LYS 49 2HE LYS 49 -25.032 0.106 1.750
420 2HE LYS 49 1HE LYS 49 -24.721 -0.904 0.338
421 1HZ LYS 49 3HZ LYS 49 -24.755 -1.864 3.149
422 2HZ LYS 49 2HZ LYS 49 -26.024 -2.055 2.035
423 3HZ LYS 49 1HZ LYS 49 -24.532 -2.821 1.765
424 H GLY 50 H GLY 50 -20.905 2.213 -2.535
425 1HA GLY 50 2HA GLY 50 -23.259 0.533 -3.280
426 2HA GLY 50 1HA GLY 50 -22.960 2.044 -4.138
427 H VAL 51 H VAL 51 -20.776 -0.570 -3.037
428 HA VAL 51 HA VAL 51 -20.095 -1.182 -5.855
429 HB VAL 51 HB VAL 51 -17.593 -1.129 -5.057
430 1HG1 VAL 51 3HG1 VAL 51 -18.655 0.305 -6.818
431 2HG1 VAL 51 2HG1 VAL 51 -19.067 1.473 -5.560
432 3HG1 VAL 51 1HG1 VAL 51 -17.376 1.128 -5.925
433 1HG2 VAL 51 3HG2 VAL 51 -18.284 -0.581 -2.673
434 2HG2 VAL 51 2HG2 VAL 51 -17.085 0.511 -3.366
435 3HG2 VAL 51 1HG2 VAL 51 -18.773 1.010 -3.258
436 H GLU 52 H GLU 52 -19.941 -3.355 -6.079
437 HA GLU 52 HA GLU 52 -19.836 -5.023 -3.634
438 1HB GLU 52 2HB GLU 52 -20.521 -5.587 -6.526
439 2HB GLU 52 1HB GLU 52 -20.320 -6.879 -5.344
440 1HG GLU 52 2HG GLU 52 -22.162 -4.547 -4.812
441 2HG GLU 52 1HG GLU 52 -22.713 -5.958 -5.713
442 H LYS 53 H LYS 53 -17.532 -4.532 -3.258
443 HA LYS 53 HA LYS 53 -15.807 -6.534 -4.506
444 1HB LYS 53 2HB LYS 53 -15.852 -4.307 -5.954
445 2HB LYS 53 1HB LYS 53 -14.736 -3.743 -4.709
446 1HG LYS 53 2HG LYS 53 -13.378 -5.838 -5.101
447 2HG LYS 53 1HG LYS 53 -14.414 -6.176 -6.487
448 1HD LYS 53 2HD LYS 53 -13.494 -4.507 -7.752
449 2HD LYS 53 1HD LYS 53 -13.278 -3.437 -6.368
450 1HE LYS 53 2HE LYS 53 -11.229 -4.360 -5.796
451 2HE LYS 53 1HE LYS 53 -11.613 -5.922 -6.520
452 1HZ LYS 53 3HZ LYS 53 -11.249 -3.467 -8.138
453 2HZ LYS 53 2HZ LYS 53 -9.958 -4.502 -7.747
454 3HZ LYS 53 1HZ LYS 53 -11.264 -5.080 -8.668
455 H TYR 54 H TYR 54 -15.002 -7.373 -2.650
456 HA TYR 54 HA TYR 54 -14.172 -5.518 -0.462
457 1HB TYR 54 2HB TYR 54 -15.789 -7.623 -0.212
458 2HB TYR 54 1HB TYR 54 -14.259 -8.492 -0.110
459 HD1 TYR 54 HD2 TYR 54 -16.383 -5.913 1.462
460 HD2 TYR 54 HD1 TYR 54 -12.752 -8.189 1.771
461 HE1 TYR 54 HE2 TYR 54 -16.135 -5.196 3.822
462 HE2 TYR 54 HE1 TYR 54 -12.505 -7.472 4.132
463 HH TYR 54 HH TYR 54 -14.653 -6.507 5.994
464 H GLY 55 H GLY 55 -13.076 -8.420 -2.242
465 1HA GLY 55 2HA GLY 55 -10.562 -7.819 -2.990
466 2HA GLY 55 1HA GLY 55 -10.317 -8.044 -1.256
467 HA PRO 56 HA PRO 56 -11.804 -12.279 -3.079
468 1HB PRO 56 2HB PRO 56 -11.437 -12.305 -5.897
469 2HB PRO 56 1HB PRO 56 -12.979 -12.275 -5.031
470 1HG PRO 56 2HG PRO 56 -11.759 -10.147 -6.572
471 2HG PRO 56 1HG PRO 56 -13.336 -10.151 -5.771
472 1HD PRO 56 2HD PRO 56 -10.911 -8.798 -4.944
473 2HD PRO 56 1HD PRO 56 -12.516 -8.735 -4.190
474 H GLU 57 H GLU 57 -10.459 -13.846 -4.958
475 HA GLU 57 HA GLU 57 -7.709 -13.719 -3.952
476 1HB GLU 57 2HB GLU 57 -9.397 -15.761 -4.892
477 2HB GLU 57 1HB GLU 57 -8.104 -15.641 -6.087
478 1HG GLU 57 2HG GLU 57 -6.411 -15.886 -4.383
479 2HG GLU 57 1HG GLU 57 -7.620 -15.788 -3.102
480 H ALA 58 H ALA 58 -9.365 -13.315 -7.084
481 HA ALA 58 HA ALA 58 -7.095 -12.957 -8.744
482 1HB ALA 58 1HB ALA 58 -9.490 -13.117 -9.520
483 2HB ALA 58 3HB ALA 58 -9.719 -11.455 -8.980
484 3HB ALA 58 2HB ALA 58 -8.579 -11.811 -10.279
485 H SER 59 H SER 59 -8.935 -10.546 -6.853
486 HA SER 59 HA SER 59 -7.179 -8.344 -7.573
487 1HB SER 59 2HB SER 59 -9.654 -8.319 -6.660
488 2HB SER 59 1HB SER 59 -8.866 -8.342 -5.086
489 HG SER 59 HG SER 59 -9.224 -6.286 -6.711
490 H ALA 60 H ALA 60 -7.296 -10.724 -4.954
491 HA ALA 60 HA ALA 60 -5.441 -9.432 -3.185
492 1HB ALA 60 3HB ALA 60 -6.105 -12.362 -3.593
493 2HB ALA 60 2HB ALA 60 -5.083 -11.760 -2.289
494 3HB ALA 60 1HB ALA 60 -6.779 -11.281 -2.372
495 H PHE 61 H PHE 61 -5.013 -11.553 -5.994
496 HA PHE 61 HA PHE 61 -2.250 -12.140 -5.701
497 1HB PHE 61 2HB PHE 61 -3.761 -11.648 -8.289
498 2HB PHE 61 1HB PHE 61 -2.236 -12.514 -8.130
499 HD1 PHE 61 HD2 PHE 61 -2.915 -13.976 -5.509
500 HD2 PHE 61 HD1 PHE 61 -5.108 -13.420 -9.164
501 HE1 PHE 61 HE2 PHE 61 -4.159 -16.078 -5.083
502 HE2 PHE 61 HE1 PHE 61 -6.349 -15.523 -8.737
503 HZ PHE 61 HZ PHE 61 -5.876 -16.850 -6.698
504 H THR 62 H THR 62 -3.832 -9.388 -7.354
505 HA THR 62 HA THR 62 -1.412 -8.105 -8.198
506 HB THR 62 HB THR 62 -3.526 -6.196 -7.609
507 HG1 THR 62 HG1 THR 62 -4.236 -8.375 -9.275
508 1HG2 THR 62 1HG2 THR 62 -2.348 -7.283 -10.175
509 2HG2 THR 62 3HG2 THR 62 -3.367 -5.849 -10.051
510 3HG2 THR 62 2HG2 THR 62 -1.778 -5.870 -9.286
511 H LYS 63 H LYS 63 -3.301 -7.836 -5.183
512 HA LYS 63 HA LYS 63 -1.676 -5.650 -4.152
513 1HB LYS 63 2HB LYS 63 -3.130 -5.617 -2.377
514 2HB LYS 63 1HB LYS 63 -4.136 -6.520 -3.506
515 1HG LYS 63 2HG LYS 63 -3.169 -8.642 -2.528
516 2HG LYS 63 1HG LYS 63 -2.403 -7.649 -1.292
517 1HD LYS 63 2HD LYS 63 -4.584 -6.818 -0.562
518 2HD LYS 63 1HD LYS 63 -5.384 -7.721 -1.848
519 1HE LYS 63 2HE LYS 63 -5.622 -9.105 0.057
520 2HE LYS 63 1HE LYS 63 -4.265 -9.810 -0.819
521 1HZ LYS 63 3HZ LYS 63 -4.053 -7.908 1.454
522 2HZ LYS 63 2HZ LYS 63 -3.779 -9.583 1.537
523 3HZ LYS 63 1HZ LYS 63 -2.748 -8.596 0.616
524 H LYS 64 H LYS 64 -1.447 -9.130 -4.118
525 HA LYS 64 HA LYS 64 0.496 -9.237 -1.941
526 1HB LYS 64 2HB LYS 64 -0.840 -11.199 -3.742
527 2HB LYS 64 1HB LYS 64 0.732 -11.658 -3.084
528 1HG LYS 64 2HG LYS 64 -0.189 -12.086 -1.080
529 2HG LYS 64 1HG LYS 64 -0.843 -10.451 -1.002
530 1HD LYS 64 2HD LYS 64 -2.912 -11.257 -1.336
531 2HD LYS 64 1HD LYS 64 -2.402 -11.920 -2.887
532 1HE LYS 64 2HE LYS 64 -1.335 -13.795 -1.307
533 2HE LYS 64 1HE LYS 64 -2.635 -13.270 -0.237
534 1HZ LYS 64 1HZ LYS 64 -2.999 -14.084 -3.070
535 2HZ LYS 64 3HZ LYS 64 -3.300 -15.083 -1.731
536 3HZ LYS 64 2HZ LYS 64 -4.229 -13.680 -1.968
537 H MET 65 H MET 65 0.851 -7.840 -4.784
538 HA MET 65 HA MET 65 2.958 -9.047 -6.190
539 1HB MET 65 2HB MET 65 3.312 -6.911 -7.169
540 2HB MET 65 1HB MET 65 1.600 -6.951 -6.761
541 1HG MET 65 2HG MET 65 2.982 -5.984 -4.468
542 2HG MET 65 1HG MET 65 3.605 -5.100 -5.856
543 1HE MET 65 2HE MET 65 1.762 -5.163 -7.819
544 2HE MET 65 1HE MET 65 0.166 -4.443 -7.634
545 3HE MET 65 3HE MET 65 1.613 -3.431 -7.531
546 H LEU 66 H LEU 66 3.017 -7.459 -3.086
547 HA LEU 66 HA LEU 66 5.992 -7.728 -3.020
548 1HB LEU 66 2HB LEU 66 5.983 -5.855 -1.398
549 2HB LEU 66 1HB LEU 66 5.293 -5.373 -2.947
550 HG LEU 66 HG LEU 66 3.280 -6.478 -1.130
551 1HD1 LEU 66 3HD1 LEU 66 5.217 -4.933 0.149
552 2HD1 LEU 66 2HD1 LEU 66 3.927 -3.785 -0.210
553 3HD1 LEU 66 1HD1 LEU 66 3.580 -5.235 0.730
554 1HD2 LEU 66 3HD2 LEU 66 3.615 -4.409 -3.151
555 2HD2 LEU 66 2HD2 LEU 66 2.145 -5.232 -2.633
556 3HD2 LEU 66 1HD2 LEU 66 2.711 -3.807 -1.762
557 H GLU 67 H GLU 67 3.069 -8.921 -1.747
558 HA GLU 67 HA GLU 67 4.030 -9.388 0.978
559 1HB GLU 67 2HB GLU 67 1.612 -10.426 -0.524
560 2HB GLU 67 1HB GLU 67 1.930 -10.738 1.181
561 1HG GLU 67 2HG GLU 67 1.599 -7.996 -0.082
562 2HG GLU 67 1HG GLU 67 0.399 -8.821 0.914
563 H ASN 68 H ASN 68 5.455 -10.591 -1.508
564 HA ASN 68 HA ASN 68 5.930 -13.217 -0.263
565 1HB ASN 68 2HB ASN 68 5.347 -14.548 -2.165
566 2HB ASN 68 1HB ASN 68 3.971 -13.491 -1.857
567 1HD2 ASN 68 2HD2 ASN 68 4.653 -11.437 -4.788
568 2HD2 ASN 68 1HD2 ASN 68 4.109 -11.291 -3.185
569 H ALA 69 H ALA 69 6.768 -10.880 -2.793
570 HA ALA 69 HA ALA 69 9.258 -12.241 -3.512
571 1HB ALA 69 2HB ALA 69 7.925 -9.668 -4.276
572 2HB ALA 69 1HB ALA 69 9.604 -9.968 -4.721
573 3HB ALA 69 3HB ALA 69 8.335 -11.051 -5.290
574 H LYS 70 H LYS 70 11.210 -10.593 -3.662
575 HA LYS 70 HA LYS 70 11.609 -9.389 -0.944
576 1HB LYS 70 2HB LYS 70 12.966 -11.590 -2.018
577 2HB LYS 70 1HB LYS 70 14.067 -10.235 -2.276
578 1HG LYS 70 2HG LYS 70 14.347 -9.850 -0.020
579 2HG LYS 70 1HG LYS 70 12.733 -10.436 0.388
580 1HD LYS 70 2HD LYS 70 13.457 -12.562 0.687
581 2HD LYS 70 1HD LYS 70 14.460 -12.514 -0.762
582 1HE LYS 70 2HE LYS 70 15.973 -10.921 0.688
583 2HE LYS 70 1HE LYS 70 15.149 -11.695 2.042
584 1HZ LYS 70 2HZ LYS 70 15.798 -13.854 1.133
585 2HZ LYS 70 1HZ LYS 70 16.641 -13.078 -0.123
586 3HZ LYS 70 3HZ LYS 70 17.152 -12.889 1.483
587 H LYS 71 H LYS 71 12.451 -9.359 -4.382
588 HA LYS 71 HA LYS 71 13.510 -6.580 -4.124
589 1HB LYS 71 2HB LYS 71 14.263 -8.798 -5.716
590 2HB LYS 71 1HB LYS 71 13.525 -7.640 -6.822
591 1HG LYS 71 2HG LYS 71 14.994 -5.855 -5.859
592 2HG LYS 71 1HG LYS 71 15.792 -7.089 -4.884
593 1HD LYS 71 2HD LYS 71 17.147 -6.796 -6.841
594 2HD LYS 71 1HD LYS 71 16.288 -8.322 -7.052
595 1HE LYS 71 2HE LYS 71 16.161 -7.060 -9.129
596 2HE LYS 71 1HE LYS 71 14.559 -7.111 -8.397
597 1HZ LYS 71 3HZ LYS 71 16.416 -4.869 -7.879
598 2HZ LYS 71 2HZ LYS 71 15.405 -4.878 -9.243
599 3HZ LYS 71 1HZ LYS 71 14.732 -4.916 -7.684
600 H ILE 72 H ILE 72 11.840 -5.114 -4.228
601 HA ILE 72 HA ILE 72 9.627 -5.690 -6.135
602 HB ILE 72 HB ILE 72 9.684 -4.014 -3.635
603 1HG1 ILE 72 2HG1 ILE 72 7.558 -5.904 -3.713
604 2HG1 ILE 72 1HG1 ILE 72 9.021 -6.755 -4.206
605 1HG2 ILE 72 1HG2 ILE 72 7.791 -4.112 -5.928
606 2HG2 ILE 72 3HG2 ILE 72 7.102 -4.011 -4.309
607 3HG2 ILE 72 2HG2 ILE 72 8.211 -2.762 -4.873
608 1HD1 ILE 72 2HD1 ILE 72 9.075 -4.949 -1.806
609 2HD1 ILE 72 1HD1 ILE 72 8.452 -6.592 -1.664
610 3HD1 ILE 72 3HD1 ILE 72 10.114 -6.322 -2.186
611 H GLU 73 H GLU 73 9.891 -4.603 -7.959
612 HA GLU 73 HA GLU 73 11.471 -2.147 -8.041
613 1HB GLU 73 2HB GLU 73 9.971 -3.723 -10.156
614 2HB GLU 73 1HB GLU 73 10.831 -2.225 -10.508
615 1HG GLU 73 2HG GLU 73 12.466 -3.840 -10.966
616 2HG GLU 73 1HG GLU 73 12.841 -3.396 -9.301
617 H VAL 74 H VAL 74 10.154 -0.817 -6.666
618 HA VAL 74 HA VAL 74 7.370 -0.264 -7.141
619 HB VAL 74 HB VAL 74 9.146 1.876 -6.049
620 1HG1 VAL 74 2HG1 VAL 74 6.474 1.606 -6.144
621 2HG1 VAL 74 1HG1 VAL 74 6.795 0.839 -4.589
622 3HG1 VAL 74 3HG1 VAL 74 7.302 2.503 -4.871
623 1HG2 VAL 74 1HG2 VAL 74 9.105 -0.865 -5.037
624 2HG2 VAL 74 3HG2 VAL 74 10.185 0.465 -4.623
625 3HG2 VAL 74 2HG2 VAL 74 8.620 0.319 -3.826
626 H GLU 75 H GLU 75 6.908 0.255 -9.262
627 HA GLU 75 HA GLU 75 8.622 2.027 -10.810
628 1HB GLU 75 2HB GLU 75 6.603 0.121 -11.369
629 2HB GLU 75 1HB GLU 75 6.035 1.660 -12.018
630 1HG GLU 75 2HG GLU 75 7.354 1.156 -13.801
631 2HG GLU 75 1HG GLU 75 8.675 1.697 -12.767
632 H PHE 76 H PHE 76 8.643 4.044 -9.856
633 HA PHE 76 HA PHE 76 6.331 5.738 -10.388
634 1HB PHE 76 2HB PHE 76 5.923 6.511 -8.168
635 2HB PHE 76 1HB PHE 76 5.904 4.758 -8.091
636 HD1 PHE 76 HD2 PHE 76 7.721 3.514 -7.007
637 HD2 PHE 76 HD1 PHE 76 7.736 7.806 -7.173
638 HE1 PHE 76 HE2 PHE 76 9.524 3.578 -5.307
639 HE2 PHE 76 HE1 PHE 76 9.533 7.869 -5.472
640 HZ PHE 76 HZ PHE 76 10.429 5.754 -4.544
641 H ASP 77 H ASP 77 7.061 7.810 -10.914
642 HA ASP 77 HA ASP 77 9.664 8.752 -9.900
643 1HB ASP 77 2HB ASP 77 10.045 7.224 -11.951
644 2HB ASP 77 1HB ASP 77 9.341 8.538 -12.891
645 H LYS 78 H LYS 78 7.186 9.398 -12.429
646 HA LYS 78 HA LYS 78 7.603 12.158 -12.728
647 1HB LYS 78 2HB LYS 78 6.019 10.672 -14.051
648 2HB LYS 78 1HB LYS 78 4.863 10.877 -12.736
649 1HG LYS 78 2HG LYS 78 5.086 13.369 -13.026
650 2HG LYS 78 1HG LYS 78 6.063 13.061 -14.462
651 1HD LYS 78 2HD LYS 78 4.265 12.404 -15.709
652 2HD LYS 78 1HD LYS 78 3.480 11.611 -14.343
653 1HE LYS 78 2HE LYS 78 3.697 14.615 -14.451
654 2HE LYS 78 1HE LYS 78 2.396 13.777 -15.296
655 1HZ LYS 78 1HZ LYS 78 1.796 12.706 -13.197
656 2HZ LYS 78 3HZ LYS 78 3.016 13.571 -12.398
657 3HZ LYS 78 2HZ LYS 78 1.701 14.398 -13.084
658 H GLY 79 H GLY 79 8.026 13.245 -10.798
659 1HA GLY 79 2HA GLY 79 7.627 14.148 -8.645
660 2HA GLY 79 1HA GLY 79 6.165 14.701 -9.455
661 H GLN 80 H GLN 80 7.220 11.473 -8.284
662 HA GLN 80 HA GLN 80 4.535 10.969 -7.261
663 1HB GLN 80 2HB GLN 80 6.567 9.342 -8.210
664 2HB GLN 80 1HB GLN 80 6.606 9.052 -6.473
665 1HG GLN 80 2HG GLN 80 4.411 8.505 -8.437
666 2HG GLN 80 1HG GLN 80 5.006 7.501 -7.120
667 1HE2 GLN 80 2HE2 GLN 80 3.013 9.220 -4.627
668 2HE2 GLN 80 1HE2 GLN 80 4.514 8.450 -4.823
669 H ARG 81 H ARG 81 5.491 13.155 -5.917
670 HA ARG 81 HA ARG 81 6.546 12.190 -3.322
671 1HB ARG 81 2HB ARG 81 7.302 14.352 -4.607
672 2HB ARG 81 1HB ARG 81 5.845 15.055 -3.904
673 1HG ARG 81 2HG ARG 81 7.716 15.478 -2.404
674 2HG ARG 81 1HG ARG 81 6.636 14.309 -1.646
675 1HD ARG 81 2HD ARG 81 8.247 12.733 -1.602
676 2HD ARG 81 1HD ARG 81 8.612 12.974 -3.310
677 HE ARG 81 HE ARG 81 9.794 15.154 -2.088
678 1HH1 ARG 81 1HH2 ARG 81 10.141 13.540 0.363
679 2HH1 ARG 81 2HH2 ARG 81 11.638 12.719 0.077
680 1HH2 ARG 81 2HH1 ARG 81 11.622 13.313 -3.345
681 2HH2 ARG 81 1HH1 ARG 81 12.476 12.587 -2.025
682 H THR 82 H THR 82 3.685 11.879 -4.558
683 HA THR 82 HA THR 82 1.980 13.307 -2.665
684 HB THR 82 HB THR 82 0.527 11.163 -3.731
685 HG1 THR 82 HG1 THR 82 1.434 10.701 -5.549
686 1HG2 THR 82 2HG2 THR 82 -0.211 13.512 -3.388
687 2HG2 THR 82 1HG2 THR 82 0.754 13.997 -4.782
688 3HG2 THR 82 3HG2 THR 82 -0.619 12.913 -4.995
689 H ASP 83 H ASP 83 1.819 12.646 -0.637
690 HA ASP 83 HA ASP 83 1.336 9.860 0.024
691 1HB ASP 83 2HB ASP 83 3.309 9.431 1.312
692 2HB ASP 83 1HB ASP 83 3.834 9.996 -0.271
693 H LYS 84 H LYS 84 -0.283 11.949 0.355
694 HA LYS 84 HA LYS 84 -0.571 12.102 3.291
695 1HB LYS 84 2HB LYS 84 0.849 14.113 2.510
696 2HB LYS 84 1HB LYS 84 -0.611 14.679 1.699
697 1HG LYS 84 2HG LYS 84 -1.774 14.367 3.985
698 2HG LYS 84 1HG LYS 84 -0.145 14.279 4.655
699 1HD LYS 84 2HD LYS 84 -0.015 16.490 2.987
700 2HD LYS 84 1HD LYS 84 -1.632 16.608 3.681
701 1HE LYS 84 2HE LYS 84 -0.775 16.579 5.917
702 2HE LYS 84 1HE LYS 84 0.833 16.113 5.364
703 1HZ LYS 84 1HZ LYS 84 1.004 18.239 4.212
704 2HZ LYS 84 3HZ LYS 84 -0.529 18.688 4.783
705 3HZ LYS 84 2HZ LYS 84 0.751 18.460 5.877
706 H TYR 85 H TYR 85 -2.129 10.612 2.033
707 HA TYR 85 HA TYR 85 -4.436 10.210 1.785
708 1HB TYR 85 2HB TYR 85 -4.706 12.706 2.749
709 2HB TYR 85 1HB TYR 85 -5.128 13.019 1.060
710 HD1 TYR 85 HD1 TYR 85 -5.998 11.079 4.085
711 HD2 TYR 85 HD2 TYR 85 -7.098 12.043 0.046
712 HE1 TYR 85 HE1 TYR 85 -8.191 9.979 4.421
713 HE2 TYR 85 HE2 TYR 85 -9.293 10.949 0.383
714 HH TYR 85 HH TYR 85 -10.756 10.470 2.823
715 H GLY 86 H GLY 86 -2.567 12.372 -0.275
716 1HA GLY 86 2HA GLY 86 -3.963 11.853 -2.738
717 2HA GLY 86 1HA GLY 86 -2.291 12.414 -2.599
718 H ARG 87 H ARG 87 -1.871 10.025 -0.686
719 HA ARG 87 HA ARG 87 -1.239 7.790 -0.755
720 1HB ARG 87 2HB ARG 87 -3.252 7.983 -2.843
721 2HB ARG 87 1HB ARG 87 -1.993 6.834 -3.282
722 1HG ARG 87 2HG ARG 87 -4.008 5.952 -1.919
723 2HG ARG 87 1HG ARG 87 -2.394 5.488 -1.389
724 1HD ARG 87 2HD ARG 87 -3.311 8.024 -0.222
725 2HD ARG 87 1HD ARG 87 -4.320 6.642 0.217
726 HE ARG 87 HE ARG 87 -1.776 5.684 0.595
727 1HH1 ARG 87 1HH2 ARG 87 -0.980 8.543 1.095
728 2HH1 ARG 87 2HH2 ARG 87 -1.228 8.695 2.803
729 1HH2 ARG 87 2HH1 ARG 87 -3.189 5.837 3.041
730 2HH2 ARG 87 1HH1 ARG 87 -2.481 7.159 3.906
731 H VAL 88 H VAL 88 0.574 6.660 -1.485
732 HA VAL 88 HA VAL 88 2.458 8.213 -3.110
733 HB VAL 88 HB VAL 88 2.752 5.407 -1.983
734 1HG1 VAL 88 1HG1 VAL 88 4.398 6.024 -3.734
735 2HG1 VAL 88 3HG1 VAL 88 4.812 7.476 -2.824
736 3HG1 VAL 88 2HG1 VAL 88 5.169 5.885 -2.154
737 1HG2 VAL 88 2HG2 VAL 88 3.398 8.115 -0.780
738 2HG2 VAL 88 1HG2 VAL 88 2.268 6.915 -0.151
739 3HG2 VAL 88 3HG2 VAL 88 4.001 6.587 -0.137
740 H LEU 89 H LEU 89 0.824 8.096 -4.891
741 HA LEU 89 HA LEU 89 0.002 5.840 -6.306
742 1HB LEU 89 2HB LEU 89 0.877 8.302 -7.806
743 2HB LEU 89 1HB LEU 89 -0.527 7.274 -8.087
744 HG LEU 89 HG LEU 89 -0.116 9.279 -5.855
745 1HD1 LEU 89 3HD1 LEU 89 -0.999 10.144 -7.973
746 2HD1 LEU 89 2HD1 LEU 89 -2.283 8.934 -7.935
747 3HD1 LEU 89 1HD1 LEU 89 -2.223 10.198 -6.705
748 1HD2 LEU 89 2HD2 LEU 89 -1.865 6.866 -5.996
749 2HD2 LEU 89 1HD2 LEU 89 -1.154 7.657 -4.592
750 3HD2 LEU 89 3HD2 LEU 89 -2.587 8.342 -5.356
751 H ALA 90 H ALA 90 1.631 4.273 -6.282
752 HA ALA 90 HA ALA 90 3.678 4.588 -8.409
753 1HB ALA 90 1HB ALA 90 4.240 3.674 -5.572
754 2HB ALA 90 3HB ALA 90 5.393 3.591 -6.902
755 3HB ALA 90 2HB ALA 90 4.830 5.157 -6.317
756 H TYR 91 H TYR 91 4.040 2.670 -9.505
757 HA TYR 91 HA TYR 91 2.209 0.452 -8.954
758 1HB TYR 91 2HB TYR 91 4.298 0.968 -11.079
759 2HB TYR 91 1HB TYR 91 3.428 -0.562 -10.960
760 HD1 TYR 91 HD1 TYR 91 3.062 3.080 -11.522
761 HD2 TYR 91 HD2 TYR 91 1.089 -0.735 -11.526
762 HE1 TYR 91 HE1 TYR 91 1.105 4.094 -12.653
763 HE2 TYR 91 HE2 TYR 91 -0.867 0.277 -12.659
764 HH TYR 91 HH TYR 91 -1.755 3.023 -12.692
765 H ILE 92 H ILE 92 2.978 -1.759 -8.523
766 HA ILE 92 HA ILE 92 5.728 -1.834 -7.322
767 HB ILE 92 HB ILE 92 3.369 -3.195 -6.016
768 1HG1 ILE 92 2HG1 ILE 92 2.886 -0.717 -6.284
769 2HG1 ILE 92 1HG1 ILE 92 2.953 -1.283 -4.619
770 1HG2 ILE 92 1HG2 ILE 92 6.074 -2.223 -5.084
771 2HG2 ILE 92 3HG2 ILE 92 4.833 -2.851 -4.001
772 3HG2 ILE 92 2HG2 ILE 92 5.530 -3.893 -5.240
773 1HD1 ILE 92 1HD1 ILE 92 5.537 -0.375 -5.743
774 2HD1 ILE 92 3HD1 ILE 92 4.322 0.886 -5.529
775 3HD1 ILE 92 2HD1 ILE 92 4.836 -0.086 -4.151
776 H TYR 93 H TYR 93 6.670 -3.311 -8.805
777 HA TYR 93 HA TYR 93 5.326 -5.993 -8.941
778 1HB TYR 93 2HB TYR 93 7.210 -5.376 -11.143
779 2HB TYR 93 1HB TYR 93 5.708 -6.285 -11.171
780 HD1 TYR 93 HD1 TYR 93 3.589 -4.593 -10.445
781 HD2 TYR 93 HD2 TYR 93 7.208 -3.579 -12.507
782 HE1 TYR 93 HE1 TYR 93 2.467 -2.635 -11.470
783 HE2 TYR 93 HE2 TYR 93 6.096 -1.626 -13.529
784 HH TYR 93 HH TYR 93 4.200 -0.190 -13.192
785 H ALA 94 H ALA 94 6.529 -7.340 -7.717
786 HA ALA 94 HA ALA 94 9.389 -6.852 -7.397
787 1HB ALA 94 2HB ALA 94 7.768 -7.368 -5.468
788 2HB ALA 94 1HB ALA 94 7.767 -9.023 -6.074
789 3HB ALA 94 3HB ALA 94 9.269 -8.292 -5.511
790 H ASP 95 H ASP 95 10.909 -8.151 -8.206
791 HA ASP 95 HA ASP 95 11.917 -9.674 -9.681
792 1HB ASP 95 2HB ASP 95 9.711 -11.433 -8.557
793 2HB ASP 95 1HB ASP 95 11.097 -12.023 -9.472
794 H GLY 96 H GLY 96 9.606 -7.980 -10.659
795 1HA GLY 96 2HA GLY 96 9.029 -7.778 -13.028
796 2HA GLY 96 1HA GLY 96 8.984 -9.542 -13.121
797 H LYS 97 H LYS 97 7.528 -10.202 -10.935
798 HA LYS 97 HA LYS 97 5.374 -10.565 -10.220
799 1HB LYS 97 2HB LYS 97 5.867 -7.738 -10.044
800 2HB LYS 97 1HB LYS 97 4.173 -8.013 -10.441
801 1HG LYS 97 2HG LYS 97 5.647 -9.406 -8.188
802 2HG LYS 97 1HG LYS 97 4.607 -7.999 -7.977
803 1HD LYS 97 2HD LYS 97 3.656 -10.572 -9.261
804 2HD LYS 97 1HD LYS 97 3.490 -10.239 -7.538
805 1HE LYS 97 2HE LYS 97 2.461 -7.946 -8.526
806 2HE LYS 97 1HE LYS 97 2.056 -9.034 -9.845
807 1HZ LYS 97 3HZ LYS 97 1.512 -10.045 -7.184
808 2HZ LYS 97 2HZ LYS 97 0.557 -8.731 -7.673
809 3HZ LYS 97 1HZ LYS 97 0.586 -10.153 -8.597
810 H MET 98 H MET 98 4.213 -7.901 -12.248
811 HA MET 98 HA MET 98 3.583 -9.311 -14.618
812 1HB MET 98 2HB MET 98 1.315 -10.095 -14.189
813 2HB MET 98 1HB MET 98 2.395 -10.826 -13.004
814 1HG MET 98 2HG MET 98 1.830 -8.975 -11.415
815 2HG MET 98 1HG MET 98 0.639 -8.389 -12.571
816 1HE MET 98 1HE MET 98 -1.196 -8.378 -11.902
817 2HE MET 98 3HE MET 98 -2.316 -9.743 -11.898
818 3HE MET 98 2HE MET 98 -1.660 -9.135 -10.383
819 H VAL 99 H VAL 99 2.195 -7.130 -12.160
820 HA VAL 99 HA VAL 99 0.394 -5.689 -13.763
821 HB VAL 99 HB VAL 99 2.055 -4.661 -11.445
822 1HG1 VAL 99 3HG1 VAL 99 0.953 -2.891 -12.787
823 2HG1 VAL 99 2HG1 VAL 99 -0.591 -3.710 -12.561
824 3HG1 VAL 99 1HG1 VAL 99 0.260 -3.032 -11.173
825 1HG2 VAL 99 3HG2 VAL 99 -0.576 -6.142 -11.626
826 2HG2 VAL 99 2HG2 VAL 99 0.859 -6.593 -10.705
827 3HG2 VAL 99 1HG2 VAL 99 -0.114 -5.212 -10.200
828 H ASN 100 H ASN 100 3.861 -5.551 -13.736
829 HA ASN 100 HA ASN 100 4.485 -3.021 -14.730
830 1HB ASN 100 2HB ASN 100 6.379 -4.120 -15.927
831 2HB ASN 100 1HB ASN 100 6.213 -4.684 -14.265
832 1HD2 ASN 100 2HD2 ASN 100 5.714 -7.304 -17.332
833 2HD2 ASN 100 1HD2 ASN 100 6.057 -5.668 -17.625
834 H GLU 101 H GLU 101 2.987 -5.715 -16.500
835 HA GLU 101 HA GLU 101 3.281 -4.716 -19.142
836 1HB GLU 101 2HB GLU 101 1.307 -6.105 -19.701
837 2HB GLU 101 1HB GLU 101 2.451 -6.983 -18.691
838 1HG GLU 101 2HG GLU 101 0.727 -7.415 -17.301
839 2HG GLU 101 1HG GLU 101 0.765 -5.709 -16.860
840 H ALA 102 H ALA 102 1.057 -3.763 -16.577
841 HA ALA 102 HA ALA 102 -0.790 -2.289 -18.228
842 1HB ALA 102 1HB ALA 102 -0.070 -1.903 -15.303
843 2HB ALA 102 3HB ALA 102 -1.481 -1.219 -16.108
844 3HB ALA 102 2HB ALA 102 -1.337 -2.966 -15.916
845 H LEU 103 HN LEU 103 -0.573 -0.300 -19.124
846 HA LEU 103 HA LEU 103 0.289 1.793 -19.682
847 1HB LEU 103 2HB LEU 103 1.194 1.489 -16.848
848 2HB LEU 103 1HB LEU 103 1.954 2.748 -17.818
849 HG LEU 103 HG LEU 103 -1.041 2.401 -17.502
850 1HD1 LEU 103 2HD1 LEU 103 0.446 3.149 -15.465
851 2HD1 LEU 103 1HD1 LEU 103 0.558 4.671 -16.350
852 3HD1 LEU 103 3HD1 LEU 103 -1.017 4.053 -15.852
853 1HD2 LEU 103 1HD2 LEU 103 0.734 4.414 -18.895
854 2HD2 LEU 103 3HD2 LEU 103 -0.628 3.513 -19.559
855 3HD2 LEU 103 2HD2 LEU 103 -0.912 4.821 -18.411
No H/Q in entry = 855
Start of MODEL 3
Raw file had 866 H/Q atoms
Start of MODEL 3
1 1H ALA 1 2H ALA 1 18.205 22.137 -14.063
2 2H ALA 1 1H ALA 1 19.123 20.787 -14.535
3 3H ALA 1 3H ALA 1 17.967 21.435 -15.593
4 HA ALA 1 HA ALA 1 17.132 19.414 -14.581
5 1HB ALA 1 3HB ALA 1 17.614 20.959 -12.015
6 2HB ALA 1 2HB ALA 1 16.700 19.454 -12.113
7 3HB ALA 1 1HB ALA 1 18.418 19.470 -12.513
8 H THR 2 H THR 2 15.059 19.574 -15.267
9 HA THR 2 HA THR 2 13.361 21.784 -14.188
10 HB THR 2 HB THR 2 12.291 21.920 -16.481
11 HG1 THR 2 HG1 THR 2 12.891 20.214 -17.604
12 1HG2 THR 2 3HG2 THR 2 13.995 23.551 -15.659
13 2HG2 THR 2 2HG2 THR 2 15.250 22.567 -16.410
14 3HG2 THR 2 1HG2 THR 2 14.026 23.348 -17.410
15 H SER 3 H SER 3 13.196 19.463 -12.929
16 HA SER 3 HA SER 3 11.770 17.716 -12.313
17 1HB SER 3 2HB SER 3 10.123 19.682 -12.655
18 2HB SER 3 1HB SER 3 9.720 18.910 -14.186
19 HG SER 3 HG SER 3 8.353 17.974 -12.798
20 H THR 4 H THR 4 13.324 16.406 -13.661
21 HA THR 4 HA THR 4 11.938 15.229 -16.040
22 HB THR 4 HB THR 4 14.080 16.460 -16.545
23 HG1 THR 4 HG1 THR 4 13.654 14.952 -18.012
24 1HG2 THR 4 1HG2 THR 4 15.194 15.800 -14.377
25 2HG2 THR 4 3HG2 THR 4 15.390 14.179 -15.043
26 3HG2 THR 4 2HG2 THR 4 16.188 15.552 -15.811
27 H LYS 5 H LYS 5 12.171 12.926 -16.313
28 HA LYS 5 HA LYS 5 12.246 10.703 -15.608
29 1HB LYS 5 2HB LYS 5 14.329 11.969 -13.871
30 2HB LYS 5 1HB LYS 5 13.766 10.352 -13.452
31 1HG LYS 5 2HG LYS 5 14.612 11.048 -16.266
32 2HG LYS 5 1HG LYS 5 15.780 10.516 -15.055
33 1HD LYS 5 2HD LYS 5 14.334 8.484 -14.668
34 2HD LYS 5 1HD LYS 5 13.357 8.988 -16.049
35 1HE LYS 5 2HE LYS 5 16.346 8.688 -16.307
36 2HE LYS 5 1HE LYS 5 15.282 7.290 -16.466
37 1HZ LYS 5 3HZ LYS 5 14.042 8.549 -18.176
38 2HZ LYS 5 2HZ LYS 5 15.210 9.780 -18.084
39 3HZ LYS 5 1HZ LYS 5 15.649 8.228 -18.616
40 H LYS 6 H LYS 6 10.709 9.593 -14.499
41 HA LYS 6 HA LYS 6 9.844 10.497 -11.846
42 1HB LYS 6 2HB LYS 6 7.680 9.787 -13.796
43 2HB LYS 6 1HB LYS 6 7.609 10.841 -12.390
44 1HG LYS 6 2HG LYS 6 9.267 11.646 -14.769
45 2HG LYS 6 1HG LYS 6 7.523 11.890 -14.793
46 1HD LYS 6 2HD LYS 6 7.573 13.388 -12.988
47 2HD LYS 6 1HD LYS 6 9.148 12.821 -12.436
48 1HE LYS 6 2HE LYS 6 10.181 14.390 -13.675
49 2HE LYS 6 1HE LYS 6 9.400 13.781 -15.134
50 1HZ LYS 6 3HZ LYS 6 8.149 15.658 -13.200
51 2HZ LYS 6 2HZ LYS 6 8.864 16.114 -14.672
52 3HZ LYS 6 1HZ LYS 6 7.480 15.129 -14.667
53 H LEU 7 H LEU 7 8.512 8.222 -14.267
54 HA LEU 7 HA LEU 7 8.267 6.072 -12.390
55 1HB LEU 7 2HB LEU 7 8.197 6.249 -15.402
56 2HB LEU 7 1HB LEU 7 8.130 4.683 -14.595
57 HG LEU 7 HG LEU 7 6.272 6.948 -13.846
58 1HD1 LEU 7 3HD1 LEU 7 5.848 4.755 -15.900
59 2HD1 LEU 7 2HD1 LEU 7 4.585 5.828 -15.297
60 3HD1 LEU 7 1HD1 LEU 7 5.932 6.486 -16.226
61 1HD2 LEU 7 3HD2 LEU 7 6.166 3.932 -13.505
62 2HD2 LEU 7 2HD2 LEU 7 6.488 5.109 -12.232
63 3HD2 LEU 7 1HD2 LEU 7 4.901 5.051 -12.999
64 H HIS 8 H HIS 8 10.226 5.657 -11.342
65 HA HIS 8 HA HIS 8 12.400 4.542 -13.065
66 1HB HIS 8 2HB HIS 8 12.905 6.811 -11.993
67 2HB HIS 8 1HB HIS 8 12.893 5.963 -10.449
68 HD1 HIS 8 HD1 HIS 8 14.775 4.191 -10.037
69 HD2 HIS 8 HD2 HIS 8 15.155 6.270 -13.630
70 HE1 HIS 8 HE1 HIS 8 17.104 3.705 -10.903
71 H LYS 9 H LYS 9 13.028 2.556 -12.511
72 HA LYS 9 HA LYS 9 11.632 0.989 -10.563
73 1HB LYS 9 2HB LYS 9 14.161 0.499 -12.151
74 2HB LYS 9 1HB LYS 9 13.467 -0.710 -11.070
75 1HG LYS 9 2HG LYS 9 11.266 -0.348 -12.355
76 2HG LYS 9 1HG LYS 9 12.245 0.487 -13.560
77 1HD LYS 9 2HD LYS 9 13.430 -1.446 -14.135
78 2HD LYS 9 1HD LYS 9 13.063 -2.244 -12.606
79 1HE LYS 9 2HE LYS 9 10.556 -1.953 -13.524
80 2HE LYS 9 1HE LYS 9 11.402 -2.012 -15.070
81 1HZ LYS 9 1HZ LYS 9 12.476 -4.073 -14.323
82 2HZ LYS 9 3HZ LYS 9 11.558 -4.029 -12.897
83 3HZ LYS 9 2HZ LYS 9 10.785 -4.218 -14.398
84 H GLU 10 H GLU 10 12.125 0.487 -8.472
85 HA GLU 10 HA GLU 10 14.792 0.992 -7.339
86 1HB GLU 10 2HB GLU 10 12.449 2.770 -6.863
87 2HB GLU 10 1HB GLU 10 13.361 2.293 -5.432
88 1HG GLU 10 2HG GLU 10 15.154 3.561 -6.005
89 2HG GLU 10 1HG GLU 10 15.054 3.099 -7.704
90 HA PRO 11 HA PRO 11 13.225 -2.853 -5.644
91 1HB PRO 11 2HB PRO 11 15.514 -2.601 -3.815
92 2HB PRO 11 1HB PRO 11 15.135 -3.881 -4.979
93 1HG PRO 11 2HG PRO 11 17.104 -1.917 -5.315
94 2HG PRO 11 1HG PRO 11 16.438 -2.941 -6.593
95 1HD PRO 11 2HD PRO 11 16.047 -0.078 -6.181
96 2HD PRO 11 1HD PRO 11 15.538 -1.079 -7.557
97 H ALA 12 H ALA 12 11.960 -3.296 -3.879
98 HA ALA 12 HA ALA 12 11.802 -1.203 -1.746
99 1HB ALA 12 2HB ALA 12 9.825 -2.032 -3.558
100 2HB ALA 12 1HB ALA 12 9.387 -2.789 -2.028
101 3HB ALA 12 3HB ALA 12 9.587 -1.040 -2.121
102 H THR 13 H THR 13 9.971 -2.625 -0.109
103 HA THR 13 HA THR 13 11.046 -5.257 0.534
104 HB THR 13 HB THR 13 12.806 -4.111 1.643
105 HG1 THR 13 HG1 THR 13 12.111 -5.378 3.212
106 1HG2 THR 13 2HG2 THR 13 10.708 -2.036 2.089
107 2HG2 THR 13 1HG2 THR 13 12.017 -2.142 3.267
108 3HG2 THR 13 3HG2 THR 13 12.380 -1.848 1.565
109 H LEU 14 H LEU 14 8.966 -6.047 0.552
110 HA LEU 14 HA LEU 14 6.596 -4.822 1.247
111 1HB LEU 14 2HB LEU 14 5.655 -6.995 1.689
112 2HB LEU 14 1HB LEU 14 6.829 -7.170 0.388
113 HG LEU 14 HG LEU 14 8.419 -7.590 2.566
114 1HD1 LEU 14 2HD1 LEU 14 6.001 -7.532 3.772
115 2HD1 LEU 14 1HD1 LEU 14 6.050 -9.234 3.313
116 3HD1 LEU 14 3HD1 LEU 14 7.319 -8.559 4.336
117 1HD2 LEU 14 3HD2 LEU 14 6.742 -9.592 1.028
118 2HD2 LEU 14 2HD2 LEU 14 8.357 -9.021 0.608
119 3HD2 LEU 14 1HD2 LEU 14 8.121 -10.025 2.039
120 H ILE 15 H ILE 15 5.813 -3.892 3.051
121 HA ILE 15 HA ILE 15 7.183 -4.538 5.614
122 HB ILE 15 HB ILE 15 5.239 -2.254 5.198
123 1HG1 ILE 15 2HG1 ILE 15 8.184 -1.762 5.091
124 2HG1 ILE 15 1HG1 ILE 15 7.413 -2.392 3.636
125 1HG2 ILE 15 2HG2 ILE 15 7.524 -2.728 7.136
126 2HG2 ILE 15 1HG2 ILE 15 6.514 -1.284 7.089
127 3HG2 ILE 15 3HG2 ILE 15 5.805 -2.841 7.513
128 1HD1 ILE 15 3HD1 ILE 15 6.328 -0.004 5.141
129 2HD1 ILE 15 2HD1 ILE 15 7.491 0.151 3.826
130 3HD1 ILE 15 1HD1 ILE 15 5.901 -0.544 3.520
131 H LYS 16 H LYS 16 3.865 -3.656 4.604
132 HA LYS 16 HA LYS 16 2.756 -6.044 5.884
133 1HB LYS 16 2HB LYS 16 2.854 -3.462 7.273
134 2HB LYS 16 1HB LYS 16 1.214 -4.092 7.119
135 1HG LYS 16 2HG LYS 16 2.444 -6.361 7.861
136 2HG LYS 16 1HG LYS 16 3.539 -5.206 8.620
137 1HD LYS 16 2HD LYS 16 2.055 -4.798 10.261
138 2HD LYS 16 1HD LYS 16 0.802 -4.407 9.082
139 1HE LYS 16 2HE LYS 16 1.519 -7.283 9.577
140 2HE LYS 16 1HE LYS 16 0.458 -6.445 10.708
141 1HZ LYS 16 1HZ LYS 16 -0.992 -5.862 8.863
142 2HZ LYS 16 3HZ LYS 16 0.026 -6.676 7.777
143 3HZ LYS 16 2HZ LYS 16 -0.805 -7.547 8.975
144 H ALA 17 H ALA 17 1.707 -6.505 3.937
145 HA ALA 17 HA ALA 17 0.416 -4.649 2.226
146 1HB ALA 17 2HB ALA 17 -0.304 -7.550 2.766
147 2HB ALA 17 1HB ALA 17 -0.888 -6.600 1.399
148 3HB ALA 17 3HB ALA 17 0.830 -6.972 1.545
149 H ILE 18 H ILE 18 -1.074 -3.241 2.856
150 HA ILE 18 HA ILE 18 -2.724 -3.416 5.159
151 HB ILE 18 HB ILE 18 -2.812 -1.810 2.616
152 1HG1 ILE 18 2HG1 ILE 18 -2.717 -0.482 5.238
153 2HG1 ILE 18 1HG1 ILE 18 -1.368 -1.582 4.957
154 1HG2 ILE 18 2HG2 ILE 18 -4.830 -1.823 4.872
155 2HG2 ILE 18 1HG2 ILE 18 -4.602 -0.424 3.823
156 3HG2 ILE 18 3HG2 ILE 18 -5.139 -1.958 3.141
157 1HD1 ILE 18 3HD1 ILE 18 -0.938 -0.467 2.776
158 2HD1 ILE 18 2HD1 ILE 18 -2.247 0.664 3.117
159 3HD1 ILE 18 1HD1 ILE 18 -0.803 0.655 4.129
160 H ASP 19 H ASP 19 -3.185 -4.597 1.874
161 HA ASP 19 HA ASP 19 -4.736 -6.102 0.993
162 1HB ASP 19 2HB ASP 19 -5.978 -6.298 3.748
163 2HB ASP 19 1HB ASP 19 -6.077 -7.467 2.436
164 H GLY 20 H GLY 20 -6.295 -5.323 -0.304
165 1HA GLY 20 2HA GLY 20 -8.750 -4.644 -0.274
166 2HA GLY 20 1HA GLY 20 -8.259 -3.390 0.864
167 H ASP 21 H ASP 21 -7.204 -1.533 0.076
168 HA ASP 21 HA ASP 21 -7.270 -1.242 -2.898
169 1HB ASP 21 2HB ASP 21 -7.738 0.650 -0.614
170 2HB ASP 21 1HB ASP 21 -7.205 1.286 -2.167
171 H THR 22 H THR 22 -5.360 -0.121 -0.072
172 HA THR 22 HA THR 22 -3.077 0.317 -1.938
173 HB THR 22 HB THR 22 -3.717 1.454 0.779
174 HG1 THR 22 HG1 THR 22 -4.747 2.663 -0.633
175 1HG2 THR 22 2HG2 THR 22 -1.211 1.617 -0.885
176 2HG2 THR 22 1HG2 THR 22 -1.640 2.886 0.258
177 3HG2 THR 22 3HG2 THR 22 -1.363 1.242 0.831
178 H VAL 23 H VAL 23 -0.919 -0.225 -1.182
179 HA VAL 23 HA VAL 23 -0.849 -2.502 0.748
180 HB VAL 23 HB VAL 23 1.145 -3.293 -0.642
181 1HG1 VAL 23 3HG1 VAL 23 -1.253 -4.193 -0.718
182 2HG1 VAL 23 2HG1 VAL 23 -1.455 -3.233 -2.184
183 3HG1 VAL 23 1HG1 VAL 23 -0.251 -4.521 -2.131
184 1HG2 VAL 23 1HG2 VAL 23 1.334 -1.033 -1.830
185 2HG2 VAL 23 3HG2 VAL 23 1.404 -2.454 -2.872
186 3HG2 VAL 23 2HG2 VAL 23 -0.083 -1.513 -2.763
187 H LYS 24 H LYS 24 0.986 -2.543 2.190
188 HA LYS 24 HA LYS 24 2.371 0.091 2.358
189 1HB LYS 24 2HB LYS 24 0.965 -1.031 4.297
190 2HB LYS 24 1HB LYS 24 2.454 -1.935 4.564
191 1HG LYS 24 2HG LYS 24 3.704 0.217 4.682
192 2HG LYS 24 1HG LYS 24 2.176 1.084 4.518
193 1HD LYS 24 2HD LYS 24 1.551 0.652 6.664
194 2HD LYS 24 1HD LYS 24 2.206 -0.985 6.629
195 1HE LYS 24 2HE LYS 24 4.497 -0.062 6.843
196 2HE LYS 24 1HE LYS 24 3.822 1.566 6.923
197 1HZ LYS 24 1HZ LYS 24 3.243 -0.642 8.825
198 2HZ LYS 24 3HZ LYS 24 4.263 0.679 9.127
199 3HZ LYS 24 2HZ LYS 24 2.597 0.929 8.902
200 H LEU 25 H LEU 25 4.184 -0.127 1.098
201 HA LEU 25 HA LEU 25 6.160 -2.163 1.988
202 1HB LEU 25 2HB LEU 25 6.785 -2.752 -0.247
203 2HB LEU 25 1HB LEU 25 5.035 -2.897 -0.168
204 HG LEU 25 HG LEU 25 6.280 -0.310 -1.070
205 1HD1 LEU 25 3HD1 LEU 25 7.258 -2.263 -2.368
206 2HD1 LEU 25 2HD1 LEU 25 5.619 -2.613 -2.916
207 3HD1 LEU 25 1HD1 LEU 25 6.381 -1.079 -3.336
208 1HD2 LEU 25 2HD2 LEU 25 3.649 -1.741 -1.321
209 2HD2 LEU 25 1HD2 LEU 25 3.966 -0.082 -0.818
210 3HD2 LEU 25 3HD2 LEU 25 4.099 -0.528 -2.517
211 H MET 26 H MET 26 8.275 -1.406 2.020
212 HA MET 26 HA MET 26 8.563 1.527 1.689
213 1HB MET 26 2HB MET 26 9.333 0.668 3.816
214 2HB MET 26 1HB MET 26 10.293 -0.578 3.024
215 1HG MET 26 2HG MET 26 11.798 1.069 2.102
216 2HG MET 26 1HG MET 26 10.763 2.389 2.639
217 1HE MET 26 3HE MET 26 13.271 -0.173 3.231
218 2HE MET 26 2HE MET 26 14.123 1.360 3.406
219 3HE MET 26 1HE MET 26 14.042 0.248 4.768
220 H TYR 27 H TYR 27 9.511 2.308 -0.131
221 HA TYR 27 HA TYR 27 10.756 0.463 -2.036
222 1HB TYR 27 2HB TYR 27 11.207 2.741 -3.281
223 2HB TYR 27 1HB TYR 27 9.571 2.097 -3.198
224 HD1 TYR 27 HD2 TYR 27 11.891 4.270 -1.183
225 HD2 TYR 27 HD1 TYR 27 7.872 3.510 -2.492
226 HE1 TYR 27 HE2 TYR 27 11.122 6.317 -0.015
227 HE2 TYR 27 HE1 TYR 27 7.104 5.553 -1.323
228 HH TYR 27 HH TYR 27 9.200 7.928 -0.199
229 H LYS 28 H LYS 28 12.173 0.439 0.327
230 HA LYS 28 HA LYS 28 14.300 0.620 1.212
231 1HB LYS 28 2HB LYS 28 14.608 -0.280 -1.287
232 2HB LYS 28 1HB LYS 28 15.451 1.258 -1.471
233 1HG LYS 28 2HG LYS 28 17.191 0.603 -0.156
234 2HG LYS 28 1HG LYS 28 16.138 -0.233 0.985
235 1HD LYS 28 2HD LYS 28 17.189 -2.060 0.041
236 2HD LYS 28 1HD LYS 28 15.833 -1.901 -1.076
237 1HE LYS 28 2HE LYS 28 17.584 -1.976 -2.590
238 2HE LYS 28 1HE LYS 28 17.494 -0.237 -2.318
239 1HZ LYS 28 3HZ LYS 28 19.300 -2.113 -0.888
240 2HZ LYS 28 2HZ LYS 28 19.762 -1.059 -2.136
241 3HZ LYS 28 1HZ LYS 28 19.224 -0.435 -0.650
242 H GLY 29 H GLY 29 13.139 2.741 1.878
243 1HA GLY 29 2HA GLY 29 15.060 4.753 2.220
244 2HA GLY 29 1HA GLY 29 14.108 5.239 0.815
245 H GLN 30 H GLN 30 11.609 4.103 1.696
246 HA GLN 30 HA GLN 30 10.972 5.213 4.320
247 1HB GLN 30 2HB GLN 30 11.088 7.304 3.077
248 2HB GLN 30 1HB GLN 30 10.019 6.658 1.833
249 1HG GLN 30 2HG GLN 30 8.202 6.445 3.482
250 2HG GLN 30 1HG GLN 30 9.270 7.060 4.746
251 1HE2 GLN 30 2HE2 GLN 30 7.767 9.672 1.951
252 2HE2 GLN 30 1HE2 GLN 30 7.731 8.004 1.631
253 HA PRO 31 HA PRO 31 7.925 2.008 3.534
254 1HB PRO 31 2HB PRO 31 6.847 2.431 6.150
255 2HB PRO 31 1HB PRO 31 7.956 1.147 5.652
256 1HG PRO 31 2HG PRO 31 8.533 3.441 7.318
257 2HG PRO 31 1HG PRO 31 9.618 2.120 6.867
258 1HD PRO 31 2HD PRO 31 9.641 4.838 5.898
259 2HD PRO 31 1HD PRO 31 10.735 3.513 5.455
260 H MET 32 H MET 32 6.281 2.829 2.207
261 HA MET 32 HA MET 32 4.619 5.040 3.364
262 1HB MET 32 2HB MET 32 5.953 4.738 0.778
263 2HB MET 32 1HB MET 32 4.267 5.241 0.651
264 1HG MET 32 2HG MET 32 6.179 6.566 2.577
265 2HG MET 32 1HG MET 32 6.012 7.112 0.909
266 1HE MET 32 3HE MET 32 5.596 8.758 3.519
267 2HE MET 32 2HE MET 32 5.337 9.533 1.959
268 3HE MET 32 1HE MET 32 4.124 9.694 3.227
269 H THR 33 H THR 33 2.579 5.259 1.775
270 HA THR 33 HA THR 33 1.179 2.637 1.656
271 HB THR 33 HB THR 33 0.171 3.811 3.503
272 HG1 THR 33 HG1 THR 33 -1.633 3.316 2.588
273 1HG2 THR 33 2HG2 THR 33 0.233 6.256 1.717
274 2HG2 THR 33 1HG2 THR 33 -0.609 6.183 3.264
275 3HG2 THR 33 3HG2 THR 33 1.144 6.006 3.205
276 H PHE 34 H PHE 34 1.089 2.246 -0.462
277 HA PHE 34 HA PHE 34 1.355 4.309 -2.452
278 1HB PHE 34 2HB PHE 34 0.915 1.356 -2.451
279 2HB PHE 34 1HB PHE 34 0.879 2.271 -3.961
280 HD1 PHE 34 HD2 PHE 34 2.950 2.119 -0.818
281 HD2 PHE 34 HD1 PHE 34 2.866 2.480 -5.093
282 HE1 PHE 34 HE2 PHE 34 5.430 2.180 -0.862
283 HE2 PHE 34 HE1 PHE 34 5.342 2.543 -5.142
284 HZ PHE 34 HZ PHE 34 6.626 2.390 -3.024
285 H ARG 35 H ARG 35 -0.192 3.807 -4.527
286 HA ARG 35 HA ARG 35 -2.756 4.980 -3.789
287 1HB ARG 35 2HB ARG 35 -3.164 4.801 -6.320
288 2HB ARG 35 1HB ARG 35 -1.822 5.818 -5.809
289 1HG ARG 35 2HG ARG 35 -0.394 4.568 -7.010
290 2HG ARG 35 1HG ARG 35 -0.866 3.129 -6.110
291 1HD ARG 35 2HD ARG 35 -1.400 2.598 -8.341
292 2HD ARG 35 1HD ARG 35 -2.939 3.077 -7.638
293 HE ARG 35 HE ARG 35 -1.928 4.266 -9.905
294 1HH1 ARG 35 1HH2 ARG 35 -0.527 6.416 -8.937
295 2HH1 ARG 35 2HH2 ARG 35 -1.695 7.588 -8.425
296 1HH2 ARG 35 2HH1 ARG 35 -4.314 5.312 -8.290
297 2HH2 ARG 35 1HH1 ARG 35 -3.843 6.962 -8.054
298 H LEU 36 H LEU 36 -4.717 4.027 -5.213
299 HA LEU 36 HA LEU 36 -4.919 1.126 -4.514
300 1HB LEU 36 2HB LEU 36 -7.346 1.525 -4.243
301 2HB LEU 36 1HB LEU 36 -6.403 2.550 -3.164
302 HG LEU 36 HG LEU 36 -6.809 3.855 -5.729
303 1HD1 LEU 36 1HD1 LEU 36 -8.876 2.402 -5.652
304 2HD1 LEU 36 3HD1 LEU 36 -9.322 3.223 -4.158
305 3HD1 LEU 36 2HD1 LEU 36 -9.204 4.133 -5.663
306 1HD2 LEU 36 2HD2 LEU 36 -6.155 4.960 -3.609
307 2HD2 LEU 36 1HD2 LEU 36 -7.640 5.652 -4.262
308 3HD2 LEU 36 3HD2 LEU 36 -7.714 4.523 -2.909
309 H LEU 37 H LEU 37 -3.796 1.651 -6.936
310 HA LEU 37 HA LEU 37 -5.984 0.974 -8.861
311 1HB LEU 37 2HB LEU 37 -4.261 3.248 -8.928
312 2HB LEU 37 1HB LEU 37 -3.773 2.177 -10.241
313 HG LEU 37 HG LEU 37 -6.301 2.010 -10.775
314 1HD1 LEU 37 1HD1 LEU 37 -6.195 4.387 -8.905
315 2HD1 LEU 37 3HD1 LEU 37 -7.472 4.193 -10.107
316 3HD1 LEU 37 2HD1 LEU 37 -7.273 2.992 -8.830
317 1HD2 LEU 37 3HD2 LEU 37 -4.799 4.621 -11.153
318 2HD2 LEU 37 2HD2 LEU 37 -4.682 3.202 -12.193
319 3HD2 LEU 37 1HD2 LEU 37 -6.194 4.107 -12.103
320 H LEU 38 H LEU 38 -2.492 0.756 -8.151
321 HA LEU 38 HA LEU 38 -1.828 -1.201 -10.110
322 1HB LEU 38 2HB LEU 38 -0.273 0.204 -8.598
323 2HB LEU 38 1HB LEU 38 -0.553 -1.025 -7.371
324 HG LEU 38 HG LEU 38 1.496 -1.170 -9.091
325 1HD1 LEU 38 3HD1 LEU 38 0.638 -2.748 -7.192
326 2HD1 LEU 38 2HD1 LEU 38 0.011 -3.718 -8.524
327 3HD1 LEU 38 1HD1 LEU 38 1.740 -3.388 -8.412
328 1HD2 LEU 38 2HD2 LEU 38 -0.237 -1.250 -11.012
329 2HD2 LEU 38 1HD2 LEU 38 1.061 -2.441 -11.036
330 3HD2 LEU 38 3HD2 LEU 38 -0.548 -2.902 -10.482
331 H VAL 39 H VAL 39 -3.424 -1.483 -6.995
332 HA VAL 39 HA VAL 39 -3.084 -4.383 -6.814
333 HB VAL 39 HB VAL 39 -5.165 -2.797 -5.294
334 1HG1 VAL 39 2HG1 VAL 39 -4.527 -5.444 -5.259
335 2HG1 VAL 39 1HG1 VAL 39 -3.421 -4.837 -4.027
336 3HG1 VAL 39 3HG1 VAL 39 -5.158 -4.579 -3.858
337 1HG2 VAL 39 2HG2 VAL 39 -2.165 -2.773 -4.989
338 2HG2 VAL 39 1HG2 VAL 39 -3.295 -1.421 -4.906
339 3HG2 VAL 39 3HG2 VAL 39 -3.204 -2.577 -3.578
340 H ASP 40 H ASP 40 -6.196 -4.431 -6.037
341 HA ASP 40 HA ASP 40 -7.457 -4.200 -8.661
342 1HB ASP 40 2HB ASP 40 -6.072 -6.406 -8.609
343 2HB ASP 40 1HB ASP 40 -7.334 -6.993 -7.526
344 H THR 41 H THR 41 -8.522 -2.820 -6.791
345 HA THR 41 HA THR 41 -10.971 -4.253 -6.021
346 HB THR 41 HB THR 41 -8.813 -3.702 -4.136
347 HG1 THR 41 HG1 THR 41 -9.617 -5.622 -3.867
348 1HG2 THR 41 3HG2 THR 41 -11.576 -2.651 -3.467
349 2HG2 THR 41 2HG2 THR 41 -10.275 -2.883 -2.302
350 3HG2 THR 41 1HG2 THR 41 -10.099 -1.695 -3.592
351 HA PRO 42 HA PRO 42 -12.756 -0.367 -7.017
352 1HB PRO 42 2HB PRO 42 -14.947 -0.685 -5.200
353 2HB PRO 42 1HB PRO 42 -14.925 -1.017 -6.936
354 1HG PRO 42 2HG PRO 42 -14.998 -2.926 -4.771
355 2HG PRO 42 1HG PRO 42 -15.003 -3.252 -6.508
356 1HD PRO 42 2HD PRO 42 -12.841 -3.656 -4.642
357 2HD PRO 42 1HD PRO 42 -12.858 -3.990 -6.384
358 H GLU 43 H GLU 43 -13.640 1.656 -5.892
359 HA GLU 43 HA GLU 43 -12.002 2.213 -3.478
360 1HB GLU 43 2HB GLU 43 -12.530 4.602 -3.980
361 2HB GLU 43 1HB GLU 43 -11.748 3.784 -5.331
362 1HG GLU 43 2HG GLU 43 -13.538 4.100 -6.671
363 2HG GLU 43 1HG GLU 43 -14.649 3.498 -5.441
364 H THR 44 H THR 44 -14.306 0.586 -3.070
365 HA THR 44 HA THR 44 -16.027 0.386 -1.501
366 HB THR 44 HB THR 44 -15.555 3.291 -0.784
367 HG1 THR 44 HG1 THR 44 -13.682 2.662 -0.122
368 1HG2 THR 44 3HG2 THR 44 -16.673 0.897 0.696
369 2HG2 THR 44 2HG2 THR 44 -16.311 2.447 1.457
370 3HG2 THR 44 1HG2 THR 44 -17.550 2.347 0.205
371 H LYS 45 H LYS 45 -18.241 0.570 -1.657
372 HA LYS 45 HA LYS 45 -19.370 2.838 -3.223
373 1HB LYS 45 2HB LYS 45 -20.885 1.133 -4.378
374 2HB LYS 45 1HB LYS 45 -19.203 1.149 -4.903
375 1HG LYS 45 2HG LYS 45 -19.647 -0.648 -2.632
376 2HG LYS 45 1HG LYS 45 -20.611 -1.086 -4.041
377 1HD LYS 45 2HD LYS 45 -17.688 -0.425 -4.341
378 2HD LYS 45 1HD LYS 45 -18.194 -2.041 -3.847
379 1HE LYS 45 2HE LYS 45 -19.846 -1.787 -5.913
380 2HE LYS 45 1HE LYS 45 -18.629 -0.631 -6.453
381 1HZ LYS 45 2HZ LYS 45 -17.825 -3.307 -5.503
382 2HZ LYS 45 1HZ LYS 45 -18.378 -3.093 -7.095
383 3HZ LYS 45 3HZ LYS 45 -17.009 -2.252 -6.556
384 H HIS 46 H HIS 46 -20.590 3.762 -1.640
385 HA HIS 46 HA HIS 46 -21.980 2.149 0.367
386 1HB HIS 46 2HB HIS 46 -21.538 5.055 -0.123
387 2HB HIS 46 1HB HIS 46 -22.958 4.604 0.820
388 HD1 HIS 46 HD1 HIS 46 -22.377 2.816 2.857
389 HD2 HIS 46 HD2 HIS 46 -19.226 5.117 1.390
390 HE1 HIS 46 HE1 HIS 46 -20.553 2.733 4.611
391 HA PRO 47 HA PRO 47 -25.876 4.030 -1.885
392 1HB PRO 47 2HB PRO 47 -25.076 4.592 -4.604
393 2HB PRO 47 1HB PRO 47 -25.752 5.705 -3.409
394 1HG PRO 47 2HG PRO 47 -23.044 5.603 -4.350
395 2HG PRO 47 1HG PRO 47 -23.709 6.661 -3.098
396 1HD PRO 47 2HD PRO 47 -21.944 4.401 -2.763
397 2HD PRO 47 1HD PRO 47 -22.575 5.491 -1.513
398 H LYS 48 H LYS 48 -23.604 2.594 -4.274
399 HA LYS 48 HA LYS 48 -25.654 0.613 -5.046
400 1HB LYS 48 2HB LYS 48 -23.349 1.785 -6.294
401 2HB LYS 48 1HB LYS 48 -23.143 0.035 -6.261
402 1HG LYS 48 2HG LYS 48 -25.741 1.295 -7.142
403 2HG LYS 48 1HG LYS 48 -24.414 1.030 -8.274
404 1HD LYS 48 2HD LYS 48 -24.390 -1.396 -7.484
405 2HD LYS 48 1HD LYS 48 -25.917 -1.051 -6.669
406 1HE LYS 48 2HE LYS 48 -26.905 -0.350 -8.821
407 2HE LYS 48 1HE LYS 48 -25.385 -0.712 -9.636
408 1HZ LYS 48 1HZ LYS 48 -27.030 -2.671 -8.125
409 2HZ LYS 48 3HZ LYS 48 -26.974 -2.537 -9.815
410 3HZ LYS 48 2HZ LYS 48 -25.586 -3.008 -8.956
411 H LYS 49 H LYS 49 -25.129 -1.713 -5.025
412 HA LYS 49 HA LYS 49 -23.411 -2.419 -2.685
413 1HB LYS 49 2HB LYS 49 -24.906 -4.682 -3.155
414 2HB LYS 49 1HB LYS 49 -25.308 -3.443 -1.973
415 1HG LYS 49 2HG LYS 49 -27.298 -3.689 -3.206
416 2HG LYS 49 1HG LYS 49 -26.552 -2.271 -3.935
417 1HD LYS 49 2HD LYS 49 -25.866 -3.460 -5.848
418 2HD LYS 49 1HD LYS 49 -26.003 -5.022 -5.037
419 1HE LYS 49 2HE LYS 49 -28.526 -4.477 -4.845
420 2HE LYS 49 1HE LYS 49 -28.212 -3.243 -6.065
421 1HZ LYS 49 2HZ LYS 49 -27.302 -4.951 -7.511
422 2HZ LYS 49 1HZ LYS 49 -27.611 -6.140 -6.336
423 3HZ LYS 49 3HZ LYS 49 -28.901 -5.324 -7.074
424 H GLY 50 H GLY 50 -21.439 -2.904 -3.529
425 1HA GLY 50 2HA GLY 50 -21.286 -4.584 -5.983
426 2HA GLY 50 1HA GLY 50 -19.955 -3.654 -5.298
427 H VAL 51 H VAL 51 -20.114 -6.560 -5.974
428 HA VAL 51 HA VAL 51 -19.733 -7.741 -3.260
429 HB VAL 51 HB VAL 51 -19.891 -9.335 -5.802
430 1HG1 VAL 51 3HG1 VAL 51 -19.212 -10.277 -3.502
431 2HG1 VAL 51 2HG1 VAL 51 -20.894 -10.020 -3.038
432 3HG1 VAL 51 1HG1 VAL 51 -20.503 -11.119 -4.360
433 1HG2 VAL 51 3HG2 VAL 51 -22.167 -8.161 -4.190
434 2HG2 VAL 51 2HG2 VAL 51 -21.896 -8.031 -5.928
435 3HG2 VAL 51 1HG2 VAL 51 -22.373 -9.576 -5.222
436 H GLU 52 H GLU 52 -17.706 -6.044 -4.371
437 HA GLU 52 HA GLU 52 -15.566 -8.028 -5.030
438 1HB GLU 52 2HB GLU 52 -16.289 -5.641 -6.341
439 2HB GLU 52 1HB GLU 52 -14.793 -5.270 -5.484
440 1HG GLU 52 2HG GLU 52 -14.731 -7.901 -6.775
441 2HG GLU 52 1HG GLU 52 -14.971 -6.587 -7.924
442 H LYS 53 H LYS 53 -16.505 -7.465 -2.331
443 HA LYS 53 HA LYS 53 -14.271 -5.888 -1.153
444 1HB LYS 53 2HB LYS 53 -15.545 -6.082 0.970
445 2HB LYS 53 1HB LYS 53 -16.509 -5.350 -0.310
446 1HG LYS 53 2HG LYS 53 -16.821 -8.215 -0.407
447 2HG LYS 53 1HG LYS 53 -17.145 -7.645 1.230
448 1HD LYS 53 2HD LYS 53 -18.606 -5.835 0.141
449 2HD LYS 53 1HD LYS 53 -18.488 -6.789 -1.338
450 1HE LYS 53 2HE LYS 53 -19.188 -8.339 1.080
451 2HE LYS 53 1HE LYS 53 -20.404 -7.166 0.575
452 1HZ LYS 53 3HZ LYS 53 -19.156 -9.011 -1.367
453 2HZ LYS 53 2HZ LYS 53 -20.495 -9.487 -0.436
454 3HZ LYS 53 1HZ LYS 53 -20.621 -8.166 -1.497
455 H TYR 54 H TYR 54 -13.289 -6.902 0.893
456 HA TYR 54 HA TYR 54 -11.988 -8.615 1.820
457 1HB TYR 54 2HB TYR 54 -14.600 -9.860 1.165
458 2HB TYR 54 1HB TYR 54 -13.264 -10.993 1.370
459 HD1 TYR 54 HD1 TYR 54 -15.324 -8.412 3.010
460 HD2 TYR 54 HD2 TYR 54 -12.131 -11.242 3.512
461 HE1 TYR 54 HE1 TYR 54 -15.478 -8.150 5.471
462 HE2 TYR 54 HE2 TYR 54 -12.285 -10.980 5.973
463 HH TYR 54 HH TYR 54 -14.601 -10.053 7.580
464 H GLY 55 H GLY 55 -10.483 -8.095 0.025
465 1HA GLY 55 2HA GLY 55 -10.239 -9.114 -2.500
466 2HA GLY 55 1HA GLY 55 -8.845 -8.974 -1.436
467 HA PRO 56 HA PRO 56 -10.599 -13.531 -1.584
468 1HB PRO 56 2HB PRO 56 -11.010 -14.023 -4.357
469 2HB PRO 56 1HB PRO 56 -12.250 -13.930 -3.099
470 1HG PRO 56 2HG PRO 56 -11.720 -12.034 -5.222
471 2HG PRO 56 1HG PRO 56 -13.005 -11.983 -4.006
472 1HD PRO 56 2HD PRO 56 -10.602 -10.376 -4.131
473 2HD PRO 56 1HD PRO 56 -11.924 -10.285 -2.950
474 H GLU 57 H GLU 57 -9.707 -15.333 -3.561
475 HA GLU 57 HA GLU 57 -6.820 -15.074 -3.314
476 1HB GLU 57 2HB GLU 57 -8.399 -17.230 -3.489
477 2HB GLU 57 1HB GLU 57 -8.017 -17.054 -5.203
478 1HG GLU 57 2HG GLU 57 -5.610 -17.043 -4.673
479 2HG GLU 57 1HG GLU 57 -5.982 -17.205 -2.957
480 H ALA 58 H ALA 58 -9.184 -14.739 -5.955
481 HA ALA 58 HA ALA 58 -7.345 -14.406 -8.107
482 1HB ALA 58 2HB ALA 58 -9.818 -14.706 -8.367
483 2HB ALA 58 1HB ALA 58 -10.044 -13.059 -7.776
484 3HB ALA 58 3HB ALA 58 -9.191 -13.342 -9.293
485 H SER 59 H SER 59 -8.841 -11.990 -5.935
486 HA SER 59 HA SER 59 -7.373 -9.760 -7.092
487 1HB SER 59 2HB SER 59 -9.603 -9.662 -5.804
488 2HB SER 59 1HB SER 59 -8.632 -9.816 -4.342
489 HG SER 59 HG SER 59 -8.287 -7.760 -4.539
490 H ALA 60 H ALA 60 -6.836 -12.042 -4.456
491 HA ALA 60 HA ALA 60 -4.741 -10.592 -3.123
492 1HB ALA 60 2HB ALA 60 -5.409 -13.541 -3.249
493 2HB ALA 60 1HB ALA 60 -4.111 -12.892 -2.248
494 3HB ALA 60 3HB ALA 60 -5.781 -12.407 -1.950
495 H PHE 61 H PHE 61 -4.781 -12.543 -6.045
496 HA PHE 61 HA PHE 61 -2.038 -13.267 -6.215
497 1HB PHE 61 2HB PHE 61 -3.982 -12.518 -8.424
498 2HB PHE 61 1HB PHE 61 -2.409 -13.264 -8.696
499 HD1 PHE 61 HD1 PHE 61 -2.384 -15.115 -6.274
500 HD2 PHE 61 HD2 PHE 61 -5.420 -14.257 -9.191
501 HE1 PHE 61 HE1 PHE 61 -3.382 -17.353 -5.897
502 HE2 PHE 61 HE2 PHE 61 -6.417 -16.495 -8.810
503 HZ PHE 61 HZ PHE 61 -5.397 -18.043 -7.165
504 H THR 62 H THR 62 -3.688 -10.287 -7.312
505 HA THR 62 HA THR 62 -1.263 -9.006 -8.263
506 HB THR 62 HB THR 62 -3.783 -7.597 -7.332
507 HG1 THR 62 HG1 THR 62 -4.744 -8.720 -8.812
508 1HG2 THR 62 1HG2 THR 62 -1.722 -6.279 -7.967
509 2HG2 THR 62 3HG2 THR 62 -1.880 -6.949 -9.592
510 3HG2 THR 62 2HG2 THR 62 -3.153 -5.922 -8.935
511 H LYS 63 H LYS 63 -2.963 -9.168 -5.187
512 HA LYS 63 HA LYS 63 -1.375 -7.096 -3.890
513 1HB LYS 63 2HB LYS 63 -3.785 -8.064 -3.345
514 2HB LYS 63 1HB LYS 63 -2.862 -9.201 -2.365
515 1HG LYS 63 2HG LYS 63 -1.657 -6.961 -1.559
516 2HG LYS 63 1HG LYS 63 -3.201 -6.252 -2.035
517 1HD LYS 63 2HD LYS 63 -2.829 -8.562 -0.105
518 2HD LYS 63 1HD LYS 63 -3.259 -6.909 0.333
519 1HE LYS 63 2HE LYS 63 -5.426 -7.456 0.051
520 2HE LYS 63 1HE LYS 63 -5.101 -7.682 -1.667
521 1HZ LYS 63 3HZ LYS 63 -4.375 -9.975 -1.115
522 2HZ LYS 63 2HZ LYS 63 -4.914 -9.726 0.478
523 3HZ LYS 63 1HZ LYS 63 -6.020 -9.686 -0.813
524 H LYS 64 H LYS 64 -0.728 -10.341 -4.737
525 HA LYS 64 HA LYS 64 0.812 -11.142 -2.437
526 1HB LYS 64 2HB LYS 64 0.559 -12.112 -5.270
527 2HB LYS 64 1HB LYS 64 1.883 -12.708 -4.277
528 1HG LYS 64 2HG LYS 64 -1.079 -13.051 -3.862
529 2HG LYS 64 1HG LYS 64 0.177 -14.283 -3.903
530 1HD LYS 64 2HD LYS 64 1.111 -13.084 -1.796
531 2HD LYS 64 1HD LYS 64 -0.488 -12.347 -1.698
532 1HE LYS 64 2HE LYS 64 -1.561 -14.483 -1.510
533 2HE LYS 64 1HE LYS 64 -0.074 -15.336 -1.924
534 1HZ LYS 64 1HZ LYS 64 -0.474 -13.669 0.503
535 2HZ LYS 64 3HZ LYS 64 -0.514 -15.364 0.463
536 3HZ LYS 64 2HZ LYS 64 0.930 -14.543 0.110
537 H MET 65 H MET 65 1.422 -8.910 -4.959
538 HA MET 65 HA MET 65 4.238 -9.116 -5.254
539 1HB MET 65 2HB MET 65 4.115 -6.974 -6.226
540 2HB MET 65 1HB MET 65 2.501 -7.627 -6.489
541 1HG MET 65 2HG MET 65 2.047 -6.489 -4.119
542 2HG MET 65 1HG MET 65 3.390 -5.465 -4.627
543 1HE MET 65 1HE MET 65 0.259 -5.389 -4.006
544 2HE MET 65 3HE MET 65 0.673 -3.707 -4.363
545 3HE MET 65 2HE MET 65 -0.649 -4.493 -5.222
546 H LEU 66 H LEU 66 2.439 -8.414 -2.446
547 HA LEU 66 HA LEU 66 4.818 -7.180 -1.125
548 1HB LEU 66 2HB LEU 66 1.960 -6.468 -1.113
549 2HB LEU 66 1HB LEU 66 2.672 -6.577 0.494
550 HG LEU 66 HG LEU 66 4.626 -5.191 -0.722
551 1HD1 LEU 66 1HD1 LEU 66 2.110 -4.749 -2.314
552 2HD1 LEU 66 3HD1 LEU 66 3.258 -3.427 -2.101
553 3HD1 LEU 66 2HD1 LEU 66 3.770 -4.920 -2.886
554 1HD2 LEU 66 3HD2 LEU 66 2.107 -4.403 0.683
555 2HD2 LEU 66 2HD2 LEU 66 3.784 -4.202 1.192
556 3HD2 LEU 66 1HD2 LEU 66 3.091 -3.115 -0.011
557 H GLU 67 H GLU 67 2.535 -9.830 -1.115
558 HA GLU 67 HA GLU 67 2.929 -10.479 1.710
559 1HB GLU 67 2HB GLU 67 1.361 -11.572 -0.566
560 2HB GLU 67 1HB GLU 67 1.807 -12.710 0.705
561 1HG GLU 67 2HG GLU 67 0.092 -11.914 1.928
562 2HG GLU 67 1HG GLU 67 0.959 -10.384 2.048
563 H ASN 68 H ASN 68 4.506 -11.279 -1.299
564 HA ASN 68 HA ASN 68 6.387 -13.002 0.216
565 1HB ASN 68 2HB ASN 68 6.163 -14.870 -1.283
566 2HB ASN 68 1HB ASN 68 4.553 -14.442 -0.710
567 1HD2 ASN 68 2HD2 ASN 68 3.673 -12.958 -3.970
568 2HD2 ASN 68 1HD2 ASN 68 3.523 -12.549 -2.326
569 H ALA 69 H ALA 69 5.819 -10.894 -2.530
570 HA ALA 69 HA ALA 69 8.220 -11.541 -3.990
571 1HB ALA 69 3HB ALA 69 6.129 -10.158 -4.734
572 2HB ALA 69 2HB ALA 69 6.989 -8.797 -4.011
573 3HB ALA 69 1HB ALA 69 7.720 -9.696 -5.340
574 H LYS 70 H LYS 70 10.293 -10.955 -3.610
575 HA LYS 70 HA LYS 70 10.850 -9.195 -1.275
576 1HB LYS 70 2HB LYS 70 11.888 -11.603 -1.801
577 2HB LYS 70 1HB LYS 70 13.024 -10.636 -2.739
578 1HG LYS 70 2HG LYS 70 13.863 -9.551 -0.869
579 2HG LYS 70 1HG LYS 70 12.369 -9.753 0.047
580 1HD LYS 70 2HD LYS 70 12.851 -12.229 0.133
581 2HD LYS 70 1HD LYS 70 14.428 -11.887 -0.579
582 1HE LYS 70 2HE LYS 70 13.640 -10.288 1.814
583 2HE LYS 70 1HE LYS 70 14.064 -11.978 2.077
584 1HZ LYS 70 3HZ LYS 70 15.749 -9.994 0.646
585 2HZ LYS 70 2HZ LYS 70 15.991 -10.516 2.244
586 3HZ LYS 70 1HZ LYS 70 16.158 -11.611 0.955
587 H LYS 71 H LYS 71 11.969 -9.668 -4.654
588 HA LYS 71 HA LYS 71 13.300 -7.049 -4.674
589 1HB LYS 71 2HB LYS 71 12.724 -9.054 -6.881
590 2HB LYS 71 1HB LYS 71 13.643 -7.567 -7.113
591 1HG LYS 71 2HG LYS 71 15.411 -8.296 -5.738
592 2HG LYS 71 1HG LYS 71 14.419 -9.529 -4.960
593 1HD LYS 71 2HD LYS 71 15.028 -9.637 -7.915
594 2HD LYS 71 1HD LYS 71 16.128 -10.328 -6.723
595 1HE LYS 71 2HE LYS 71 13.198 -11.024 -6.674
596 2HE LYS 71 1HE LYS 71 14.297 -11.868 -7.763
597 1HZ LYS 71 2HZ LYS 71 15.700 -12.376 -5.819
598 2HZ LYS 71 1HZ LYS 71 14.524 -11.681 -4.808
599 3HZ LYS 71 3HZ LYS 71 14.151 -13.066 -5.713
600 H ILE 72 H ILE 72 12.230 -5.152 -5.096
601 HA ILE 72 HA ILE 72 9.750 -5.287 -6.735
602 HB ILE 72 HB ILE 72 9.977 -3.668 -4.204
603 1HG1 ILE 72 2HG1 ILE 72 8.401 -6.224 -4.568
604 2HG1 ILE 72 1HG1 ILE 72 10.002 -6.190 -3.834
605 1HG2 ILE 72 1HG2 ILE 72 8.402 -2.941 -6.043
606 2HG2 ILE 72 3HG2 ILE 72 7.536 -4.457 -5.798
607 3HG2 ILE 72 2HG2 ILE 72 7.632 -3.274 -4.494
608 1HD1 ILE 72 1HD1 ILE 72 7.694 -4.499 -2.846
609 2HD1 ILE 72 3HD1 ILE 72 8.073 -6.095 -2.193
610 3HD1 ILE 72 2HD1 ILE 72 9.241 -4.781 -2.045
611 H GLU 73 H GLU 73 10.342 -4.083 -8.476
612 HA GLU 73 HA GLU 73 12.086 -1.742 -8.169
613 1HB GLU 73 2HB GLU 73 10.632 -2.828 -10.614
614 2HB GLU 73 1HB GLU 73 11.831 -1.539 -10.632
615 1HG GLU 73 2HG GLU 73 13.174 -3.367 -11.141
616 2HG GLU 73 1HG GLU 73 13.324 -3.332 -9.384
617 H VAL 74 H VAL 74 10.437 -0.818 -6.635
618 HA VAL 74 HA VAL 74 7.847 0.012 -7.472
619 HB VAL 74 HB VAL 74 9.376 1.713 -5.541
620 1HG1 VAL 74 3HG1 VAL 74 6.645 1.111 -6.213
621 2HG1 VAL 74 2HG1 VAL 74 6.939 0.722 -4.518
622 3HG1 VAL 74 1HG1 VAL 74 7.269 2.347 -5.120
623 1HG2 VAL 74 1HG2 VAL 74 8.856 -1.213 -5.257
624 2HG2 VAL 74 3HG2 VAL 74 10.179 -0.242 -4.611
625 3HG2 VAL 74 2HG2 VAL 74 8.590 -0.186 -3.850
626 H GLU 75 H GLU 75 7.474 1.258 -9.178
627 HA GLU 75 HA GLU 75 9.392 3.364 -9.995
628 1HB GLU 75 2HB GLU 75 7.884 1.544 -11.400
629 2HB GLU 75 1HB GLU 75 6.876 2.987 -11.504
630 1HG GLU 75 2HG GLU 75 8.429 4.147 -12.736
631 2HG GLU 75 1HG GLU 75 9.794 3.321 -11.994
632 H PHE 76 H PHE 76 9.067 5.247 -8.734
633 HA PHE 76 HA PHE 76 6.292 6.325 -8.696
634 1HB PHE 76 2HB PHE 76 6.515 6.807 -6.237
635 2HB PHE 76 1HB PHE 76 6.427 5.095 -6.628
636 HD1 PHE 76 HD1 PHE 76 8.497 3.688 -6.613
637 HD2 PHE 76 HD2 PHE 76 8.498 7.760 -5.242
638 HE1 PHE 76 HE1 PHE 76 10.658 3.304 -5.463
639 HE2 PHE 76 HE2 PHE 76 10.659 7.373 -4.097
640 HZ PHE 76 HZ PHE 76 11.739 5.147 -4.208
641 H ASP 77 H ASP 77 8.098 7.623 -10.329
642 HA ASP 77 HA ASP 77 8.877 9.797 -10.710
643 1HB ASP 77 2HB ASP 77 6.848 10.338 -9.236
644 2HB ASP 77 1HB ASP 77 8.004 10.521 -7.917
645 H LYS 78 H LYS 78 10.807 10.957 -10.411
646 HA LYS 78 HA LYS 78 13.002 9.695 -9.174
647 1HB LYS 78 2HB LYS 78 12.445 12.451 -10.172
648 2HB LYS 78 1HB LYS 78 13.843 12.254 -9.114
649 1HG LYS 78 2HG LYS 78 13.442 10.333 -11.388
650 2HG LYS 78 1HG LYS 78 14.116 11.930 -11.713
651 1HD LYS 78 2HD LYS 78 15.864 11.523 -9.995
652 2HD LYS 78 1HD LYS 78 15.210 9.906 -9.737
653 1HE LYS 78 2HE LYS 78 16.752 9.319 -11.318
654 2HE LYS 78 1HE LYS 78 15.510 9.875 -12.438
655 1HZ LYS 78 2HZ LYS 78 16.540 12.100 -12.339
656 2HZ LYS 78 1HZ LYS 78 17.793 11.457 -11.387
657 3HZ LYS 78 3HZ LYS 78 17.578 10.918 -12.980
658 H GLY 79 H GLY 79 10.879 12.263 -7.870
659 1HA GLY 79 2HA GLY 79 12.077 11.801 -5.180
660 2HA GLY 79 1HA GLY 79 11.294 13.304 -5.676
661 H GLN 80 H GLN 80 10.127 12.625 -3.548
662 HA GLN 80 HA GLN 80 8.074 10.566 -3.862
663 1HB GLN 80 2HB GLN 80 9.338 11.491 -1.665
664 2HB GLN 80 1HB GLN 80 7.903 12.515 -1.619
665 1HG GLN 80 2HG GLN 80 7.691 10.308 -0.373
666 2HG GLN 80 1HG GLN 80 6.440 10.609 -1.578
667 1HE2 GLN 80 2HE2 GLN 80 7.187 7.601 -3.239
668 2HE2 GLN 80 1HE2 GLN 80 6.025 8.751 -2.785
669 H ARG 81 H ARG 81 5.970 10.906 -4.424
670 HA ARG 81 HA ARG 81 5.225 13.668 -5.226
671 1HB ARG 81 2HB ARG 81 4.410 10.923 -6.035
672 2HB ARG 81 1HB ARG 81 3.145 12.151 -6.070
673 1HG ARG 81 2HG ARG 81 4.366 13.515 -7.591
674 2HG ARG 81 1HG ARG 81 5.853 12.603 -7.334
675 1HD ARG 81 2HD ARG 81 5.005 10.700 -8.498
676 2HD ARG 81 1HD ARG 81 3.361 11.334 -8.487
677 HE ARG 81 HE ARG 81 5.035 11.751 -10.618
678 1HH1 ARG 81 1HH2 ARG 81 6.326 14.109 -9.834
679 2HH1 ARG 81 2HH2 ARG 81 5.191 15.389 -10.107
680 1HH2 ARG 81 2HH1 ARG 81 2.439 13.274 -10.261
681 2HH2 ARG 81 1HH1 ARG 81 2.985 14.915 -10.349
682 H THR 82 H THR 82 5.213 13.848 -2.657
683 HA THR 82 HA THR 82 2.826 12.841 -1.346
684 HB THR 82 HB THR 82 3.584 14.305 0.533
685 HG1 THR 82 HG1 THR 82 4.774 15.910 -0.094
686 1HG2 THR 82 3HG2 THR 82 4.499 11.920 -0.065
687 2HG2 THR 82 2HG2 THR 82 5.980 12.790 -0.464
688 3HG2 THR 82 1HG2 THR 82 5.321 12.875 1.169
689 H ASP 83 H ASP 83 1.223 14.296 -0.422
690 HA ASP 83 HA ASP 83 0.978 17.010 -1.359
691 1HB ASP 83 2HB ASP 83 0.504 15.718 -3.441
692 2HB ASP 83 1HB ASP 83 -0.889 15.004 -2.630
693 H LYS 84 H LYS 84 -1.615 14.588 -0.872
694 HA LYS 84 HA LYS 84 -2.978 16.384 0.980
695 1HB LYS 84 2HB LYS 84 -4.648 14.569 1.131
696 2HB LYS 84 1HB LYS 84 -4.244 14.933 -0.546
697 1HG LYS 84 2HG LYS 84 -3.487 12.839 -0.892
698 2HG LYS 84 1HG LYS 84 -2.440 12.928 0.524
699 1HD LYS 84 2HD LYS 84 -3.829 11.316 1.344
700 2HD LYS 84 1HD LYS 84 -4.877 12.684 1.721
701 1HE LYS 84 2HE LYS 84 -6.027 12.410 -0.443
702 2HE LYS 84 1HE LYS 84 -4.974 11.050 -0.833
703 1HZ LYS 84 3HZ LYS 84 -6.826 11.187 1.486
704 2HZ LYS 84 2HZ LYS 84 -7.098 10.311 0.056
705 3HZ LYS 84 1HZ LYS 84 -5.825 9.874 1.093
706 H TYR 85 H TYR 85 -0.384 14.398 1.438
707 HA TYR 85 HA TYR 85 -0.138 14.590 4.195
708 1HB TYR 85 2HB TYR 85 -2.129 13.326 4.617
709 2HB TYR 85 1HB TYR 85 -1.743 12.155 3.359
710 HD1 TYR 85 HD1 TYR 85 -0.563 13.470 6.655
711 HD2 TYR 85 HD2 TYR 85 -0.516 10.203 3.866
712 HE1 TYR 85 HE1 TYR 85 0.608 12.059 8.326
713 HE2 TYR 85 HE2 TYR 85 0.654 8.793 5.535
714 HH TYR 85 HH TYR 85 2.296 9.565 7.766
715 H GLY 86 H GLY 86 0.229 12.580 1.331
716 1HA GLY 86 2HA GLY 86 2.925 12.512 1.077
717 2HA GLY 86 1HA GLY 86 2.653 11.265 2.297
718 H ARG 87 H ARG 87 1.038 9.581 1.733
719 HA ARG 87 HA ARG 87 0.440 7.795 0.333
720 1HB ARG 87 2HB ARG 87 -0.806 10.113 -0.558
721 2HB ARG 87 1HB ARG 87 -0.094 9.442 -2.021
722 1HG ARG 87 2HG ARG 87 -2.461 8.658 -1.466
723 2HG ARG 87 1HG ARG 87 -1.277 7.394 -1.783
724 1HD ARG 87 2HD ARG 87 -0.966 7.600 0.877
725 2HD ARG 87 1HD ARG 87 -2.626 8.153 0.772
726 HE ARG 87 HE ARG 87 -1.588 5.436 0.407
727 1HH1 ARG 87 2HH1 ARG 87 -2.702 6.285 -2.333
728 2HH1 ARG 87 1HH1 ARG 87 -4.305 5.642 -2.237
729 1HH2 ARG 87 1HH2 ARG 87 -4.212 5.186 1.201
730 2HH2 ARG 87 2HH2 ARG 87 -5.160 5.019 -0.239
731 H VAL 88 H VAL 88 0.803 6.853 -1.995
732 HA VAL 88 HA VAL 88 3.304 7.794 -3.198
733 HB VAL 88 HB VAL 88 3.100 5.138 -1.776
734 1HG1 VAL 88 3HG1 VAL 88 5.061 6.110 -3.899
735 2HG1 VAL 88 2HG1 VAL 88 5.422 4.787 -2.792
736 3HG1 VAL 88 1HG1 VAL 88 4.098 4.635 -3.942
737 1HG2 VAL 88 2HG2 VAL 88 4.780 7.640 -1.693
738 2HG2 VAL 88 1HG2 VAL 88 3.891 6.870 -0.380
739 3HG2 VAL 88 3HG2 VAL 88 5.367 6.131 -0.998
740 H LEU 89 H LEU 89 1.483 8.181 -4.563
741 HA LEU 89 HA LEU 89 0.035 6.276 -6.065
742 1HB LEU 89 2HB LEU 89 0.341 8.251 -7.892
743 2HB LEU 89 1HB LEU 89 -0.789 8.364 -6.555
744 HG LEU 89 HG LEU 89 0.822 10.356 -7.020
745 1HD1 LEU 89 3HD1 LEU 89 -0.254 9.267 -4.584
746 2HD1 LEU 89 2HD1 LEU 89 1.201 10.213 -4.269
747 3HD1 LEU 89 1HD1 LEU 89 -0.162 10.944 -5.118
748 1HD2 LEU 89 2HD2 LEU 89 2.741 8.317 -6.248
749 2HD2 LEU 89 1HD2 LEU 89 3.011 9.893 -6.978
750 3HD2 LEU 89 3HD2 LEU 89 2.844 9.748 -5.231
751 H ALA 90 H ALA 90 1.553 4.528 -6.549
752 HA ALA 90 HA ALA 90 3.111 5.022 -9.002
753 1HB ALA 90 1HB ALA 90 4.312 4.808 -6.338
754 2HB ALA 90 3HB ALA 90 5.001 3.685 -7.510
755 3HB ALA 90 2HB ALA 90 5.000 5.417 -7.840
756 H TYR 91 H TYR 91 4.535 2.794 -9.289
757 HA TYR 91 HA TYR 91 2.537 0.586 -9.074
758 1HB TYR 91 2HB TYR 91 4.381 1.468 -11.223
759 2HB TYR 91 1HB TYR 91 4.198 -0.276 -11.010
760 HD1 TYR 91 HD1 TYR 91 1.804 2.570 -10.549
761 HD2 TYR 91 HD2 TYR 91 2.706 -1.076 -12.629
762 HE1 TYR 91 HE1 TYR 91 -0.412 2.650 -11.636
763 HE2 TYR 91 HE2 TYR 91 0.490 -0.997 -13.722
764 HH TYR 91 HH TYR 91 -1.265 1.403 -14.164
765 H ILE 92 H ILE 92 3.255 -1.482 -8.517
766 HA ILE 92 HA ILE 92 5.908 -1.563 -7.144
767 HB ILE 92 HB ILE 92 3.492 -3.309 -6.570
768 1HG1 ILE 92 2HG1 ILE 92 2.852 -1.013 -6.084
769 2HG1 ILE 92 1HG1 ILE 92 3.196 -1.827 -4.557
770 1HG2 ILE 92 2HG2 ILE 92 6.009 -2.684 -5.000
771 2HG2 ILE 92 1HG2 ILE 92 4.700 -3.733 -4.456
772 3HG2 ILE 92 3HG2 ILE 92 5.678 -4.193 -5.851
773 1HD1 ILE 92 1HD1 ILE 92 5.673 -0.856 -5.223
774 2HD1 ILE 92 3HD1 ILE 92 4.619 0.406 -5.858
775 3HD1 ILE 92 2HD1 ILE 92 4.537 -0.036 -4.154
776 H TYR 93 H TYR 93 7.278 -2.545 -8.558
777 HA TYR 93 HA TYR 93 6.297 -4.800 -10.224
778 1HB TYR 93 2HB TYR 93 8.936 -3.306 -10.226
779 2HB TYR 93 1HB TYR 93 8.488 -4.572 -11.368
780 HD1 TYR 93 HD2 TYR 93 5.432 -3.578 -11.211
781 HD2 TYR 93 HD1 TYR 93 9.193 -1.730 -12.134
782 HE1 TYR 93 HE2 TYR 93 4.270 -1.925 -12.608
783 HE2 TYR 93 HE1 TYR 93 8.032 -0.074 -13.536
784 HH TYR 93 HH TYR 93 5.157 -0.380 -14.771
785 H ALA 94 H ALA 94 6.101 -6.246 -8.377
786 HA ALA 94 HA ALA 94 8.721 -7.143 -7.364
787 1HB ALA 94 2HB ALA 94 6.770 -6.277 -5.805
788 2HB ALA 94 1HB ALA 94 6.161 -7.916 -6.024
789 3HB ALA 94 3HB ALA 94 7.756 -7.654 -5.318
790 H ASP 95 H ASP 95 9.402 -9.018 -8.174
791 HA ASP 95 HA ASP 95 9.432 -11.217 -8.965
792 1HB ASP 95 2HB ASP 95 7.723 -11.557 -7.102
793 2HB ASP 95 1HB ASP 95 6.475 -11.365 -8.332
794 H GLY 96 H GLY 96 6.155 -10.034 -9.879
795 1HA GLY 96 2HA GLY 96 6.382 -11.073 -12.563
796 2HA GLY 96 1HA GLY 96 5.121 -9.986 -11.985
797 H LYS 97 H LYS 97 7.443 -8.113 -11.072
798 HA LYS 97 HA LYS 97 8.740 -6.373 -11.971
799 1HB LYS 97 2HB LYS 97 8.927 -8.397 -13.970
800 2HB LYS 97 1HB LYS 97 8.633 -6.864 -14.789
801 1HG LYS 97 2HG LYS 97 10.957 -6.849 -14.579
802 2HG LYS 97 1HG LYS 97 10.462 -5.951 -13.145
803 1HD LYS 97 2HD LYS 97 10.764 -7.850 -11.729
804 2HD LYS 97 1HD LYS 97 10.902 -8.942 -13.108
805 1HE LYS 97 2HE LYS 97 12.982 -7.725 -13.797
806 2HE LYS 97 1HE LYS 97 12.871 -6.777 -12.315
807 1HZ LYS 97 1HZ LYS 97 12.930 -8.880 -11.061
808 2HZ LYS 97 3HZ LYS 97 13.171 -9.726 -12.513
809 3HZ LYS 97 2HZ LYS 97 14.341 -8.619 -11.971
810 H MET 98 H MET 98 5.534 -7.040 -12.779
811 HA MET 98 HA MET 98 4.943 -4.240 -13.248
812 1HB MET 98 2HB MET 98 5.746 -5.419 -15.517
813 2HB MET 98 1HB MET 98 4.060 -5.938 -15.541
814 1HG MET 98 2HG MET 98 3.269 -3.813 -15.867
815 2HG MET 98 1HG MET 98 4.537 -3.079 -14.885
816 1HE MET 98 3HE MET 98 7.023 -3.274 -15.546
817 2HE MET 98 2HE MET 98 7.467 -2.494 -17.063
818 3HE MET 98 1HE MET 98 6.387 -1.671 -15.941
819 H VAL 99 H VAL 99 4.147 -6.578 -11.522
820 HA VAL 99 HA VAL 99 2.251 -7.541 -10.596
821 HB VAL 99 HB VAL 99 1.906 -4.857 -10.709
822 1HG1 VAL 99 2HG1 VAL 99 0.388 -5.581 -12.869
823 2HG1 VAL 99 1HG1 VAL 99 -0.813 -5.638 -11.582
824 3HG1 VAL 99 3HG1 VAL 99 0.084 -4.151 -11.887
825 1HG2 VAL 99 1HG2 VAL 99 0.193 -7.083 -9.628
826 2HG2 VAL 99 3HG2 VAL 99 1.284 -6.002 -8.763
827 3HG2 VAL 99 2HG2 VAL 99 -0.263 -5.401 -9.359
828 H ASN 100 H ASN 100 2.832 -7.972 -13.620
829 HA ASN 100 HA ASN 100 0.185 -8.516 -14.747
830 1HB ASN 100 2HB ASN 100 3.005 -8.675 -15.664
831 2HB ASN 100 1HB ASN 100 1.888 -9.818 -16.406
832 1HD2 ASN 100 2HD2 ASN 100 1.184 -5.794 -16.967
833 2HD2 ASN 100 1HD2 ASN 100 1.979 -6.298 -15.555
834 H GLU 101 H GLU 101 2.484 -10.242 -12.795
835 HA GLU 101 HA GLU 101 2.077 -12.926 -13.491
836 1HB GLU 101 2HB GLU 101 2.543 -11.564 -10.843
837 2HB GLU 101 1HB GLU 101 2.313 -13.311 -10.921
838 1HG GLU 101 2HG GLU 101 4.265 -12.049 -12.810
839 2HG GLU 101 1HG GLU 101 4.739 -12.252 -11.125
840 H ALA 102 H ALA 102 0.010 -10.849 -11.456
841 HA ALA 102 HA ALA 102 -1.896 -12.945 -10.839
842 1HB ALA 102 1HB ALA 102 -1.573 -10.828 -9.500
843 2HB ALA 102 3HB ALA 102 -2.363 -9.950 -10.810
844 3HB ALA 102 2HB ALA 102 -3.253 -11.175 -9.907
845 H LEU 103 HN LEU 103 -3.466 -13.730 -12.157
846 HA LEU 103 HA LEU 103 -3.903 -12.484 -14.789
847 1HB LEU 103 2HB LEU 103 -4.267 -15.122 -13.607
848 2HB LEU 103 1HB LEU 103 -5.701 -14.619 -14.498
849 HG LEU 103 HG LEU 103 -4.114 -15.809 -15.967
850 1HD1 LEU 103 1HD1 LEU 103 -5.540 -13.769 -16.706
851 2HD1 LEU 103 3HD1 LEU 103 -4.009 -12.896 -16.736
852 3HD1 LEU 103 2HD1 LEU 103 -4.242 -14.302 -17.774
853 1HD2 LEU 103 2HD2 LEU 103 -2.080 -15.021 -14.633
854 2HD2 LEU 103 1HD2 LEU 103 -1.904 -14.990 -16.387
855 3HD2 LEU 103 3HD2 LEU 103 -2.217 -13.495 -15.506
No H/Q in entry = 855
Start of MODEL 4
Raw file had 866 H/Q atoms
Start of MODEL 4
1 1H ALA 1 2H ALA 1 15.955 12.468 -10.971
2 2H ALA 1 1H ALA 1 14.949 13.437 -10.004
3 3H ALA 1 3H ALA 1 15.115 11.784 -9.663
4 HA ALA 1 HA ALA 1 14.046 11.207 -11.747
5 1HB ALA 1 2HB ALA 1 12.694 11.557 -9.672
6 2HB ALA 1 1HB ALA 1 12.440 13.233 -10.160
7 3HB ALA 1 3HB ALA 1 11.795 11.920 -11.144
8 H THR 2 H THR 2 13.520 11.824 -13.816
9 HA THR 2 HA THR 2 14.323 14.485 -14.721
10 HB THR 2 HB THR 2 13.523 13.621 -16.968
11 HG1 THR 2 HG1 THR 2 12.076 12.099 -16.618
12 1HG2 THR 2 1HG2 THR 2 15.447 11.873 -15.411
13 2HG2 THR 2 3HG2 THR 2 15.337 11.957 -17.169
14 3HG2 THR 2 2HG2 THR 2 15.857 13.369 -16.250
15 H SER 3 H SER 3 12.737 15.664 -16.286
16 HA SER 3 HA SER 3 10.149 15.960 -14.859
17 1HB SER 3 2HB SER 3 11.706 17.773 -16.708
18 2HB SER 3 1HB SER 3 10.037 18.108 -16.259
19 HG SER 3 HG SER 3 12.368 18.217 -14.754
20 H THR 4 H THR 4 10.593 13.739 -16.703
21 HA THR 4 HA THR 4 8.269 14.171 -18.447
22 HB THR 4 HB THR 4 10.209 15.004 -19.790
23 HG1 THR 4 HG1 THR 4 9.322 14.154 -21.495
24 1HG2 THR 4 2HG2 THR 4 11.854 13.390 -18.727
25 2HG2 THR 4 1HG2 THR 4 11.163 12.131 -19.750
26 3HG2 THR 4 3HG2 THR 4 11.964 13.522 -20.481
27 H LYS 5 H LYS 5 9.052 12.406 -16.161
28 HA LYS 5 HA LYS 5 9.146 9.732 -17.442
29 1HB LYS 5 2HB LYS 5 10.382 10.688 -15.201
30 2HB LYS 5 1HB LYS 5 8.972 9.897 -14.499
31 1HG LYS 5 2HG LYS 5 10.117 7.959 -14.695
32 2HG LYS 5 1HG LYS 5 9.852 8.092 -16.434
33 1HD LYS 5 2HD LYS 5 12.214 7.834 -16.141
34 2HD LYS 5 1HD LYS 5 11.951 9.536 -16.518
35 1HE LYS 5 2HE LYS 5 12.034 10.091 -14.118
36 2HE LYS 5 1HE LYS 5 12.278 8.389 -13.728
37 1HZ LYS 5 3HZ LYS 5 14.324 8.429 -15.020
38 2HZ LYS 5 2HZ LYS 5 14.089 10.073 -15.373
39 3HZ LYS 5 1HZ LYS 5 14.373 9.577 -13.775
40 H LYS 6 H LYS 6 7.732 8.285 -15.463
41 HA LYS 6 HA LYS 6 5.126 9.202 -14.830
42 1HB LYS 6 2HB LYS 6 3.753 8.274 -16.613
43 2HB LYS 6 1HB LYS 6 4.902 9.402 -17.324
44 1HG LYS 6 2HG LYS 6 5.328 6.399 -17.196
45 2HG LYS 6 1HG LYS 6 4.690 7.249 -18.602
46 1HD LYS 6 2HD LYS 6 6.866 8.738 -18.267
47 2HD LYS 6 1HD LYS 6 7.458 7.288 -17.456
48 1HE LYS 6 2HE LYS 6 8.056 6.680 -19.579
49 2HE LYS 6 1HE LYS 6 6.371 6.172 -19.682
50 1HZ LYS 6 3HZ LYS 6 5.817 8.355 -20.580
51 2HZ LYS 6 2HZ LYS 6 7.453 8.812 -20.514
52 3HZ LYS 6 1HZ LYS 6 6.958 7.562 -21.553
53 H LEU 7 H LEU 7 7.226 6.526 -15.728
54 HA LEU 7 HA LEU 7 6.065 4.895 -13.568
55 1HB LEU 7 2HB LEU 7 6.017 4.165 -16.498
56 2HB LEU 7 1HB LEU 7 6.097 2.908 -15.276
57 HG LEU 7 HG LEU 7 3.939 5.028 -15.524
58 1HD1 LEU 7 2HD1 LEU 7 3.835 3.152 -17.168
59 2HD1 LEU 7 1HD1 LEU 7 3.799 2.013 -15.822
60 3HD1 LEU 7 3HD1 LEU 7 2.472 3.153 -16.050
61 1HD2 LEU 7 1HD2 LEU 7 4.473 4.406 -13.144
62 2HD2 LEU 7 3HD2 LEU 7 2.847 3.938 -13.639
63 3HD2 LEU 7 2HD2 LEU 7 4.123 2.726 -13.551
64 H HIS 8 H HIS 8 8.086 5.154 -12.522
65 HA HIS 8 HA HIS 8 10.548 4.291 -13.929
66 1HB HIS 8 2HB HIS 8 10.118 6.387 -12.275
67 2HB HIS 8 1HB HIS 8 10.648 5.190 -11.095
68 HD1 HIS 8 HD1 HIS 8 11.849 5.853 -14.665
69 HD2 HIS 8 HD2 HIS 8 13.350 5.655 -10.779
70 HE1 HIS 8 HE1 HIS 8 14.357 6.157 -14.848
71 H LYS 9 H LYS 9 11.817 3.505 -11.302
72 HA LYS 9 HA LYS 9 10.409 1.274 -10.172
73 1HB LYS 9 2HB LYS 9 11.973 -0.488 -11.238
74 2HB LYS 9 1HB LYS 9 10.634 0.105 -12.219
75 1HG LYS 9 2HG LYS 9 12.139 1.699 -13.335
76 2HG LYS 9 1HG LYS 9 13.482 1.151 -12.333
77 1HD LYS 9 2HD LYS 9 13.905 -0.363 -13.956
78 2HD LYS 9 1HD LYS 9 12.460 -1.207 -13.403
79 1HE LYS 9 2HE LYS 9 11.917 -0.904 -15.635
80 2HE LYS 9 1HE LYS 9 11.235 0.570 -14.949
81 1HZ LYS 9 1HZ LYS 9 13.936 0.320 -16.160
82 2HZ LYS 9 3HZ LYS 9 12.588 1.035 -16.899
83 3HZ LYS 9 2HZ LYS 9 13.267 1.740 -15.511
84 H GLU 10 H GLU 10 11.473 0.584 -8.333
85 HA GLU 10 HA GLU 10 14.364 0.791 -8.021
86 1HB GLU 10 2HB GLU 10 12.558 2.896 -6.982
87 2HB GLU 10 1HB GLU 10 13.689 2.245 -5.798
88 1HG GLU 10 2HG GLU 10 14.431 3.375 -8.516
89 2HG GLU 10 1HG GLU 10 14.667 4.181 -6.969
90 HA PRO 11 HA PRO 11 13.122 -2.770 -5.706
91 1HB PRO 11 2HB PRO 11 15.642 -2.584 -4.254
92 2HB PRO 11 1HB PRO 11 15.094 -3.818 -5.399
93 1HG PRO 11 2HG PRO 11 17.031 -1.816 -5.896
94 2HG PRO 11 1HG PRO 11 16.292 -2.888 -7.090
95 1HD PRO 11 2HD PRO 11 15.874 -0.035 -6.737
96 2HD PRO 11 1HD PRO 11 15.228 -1.094 -8.006
97 H ALA 12 H ALA 12 12.127 -3.069 -3.799
98 HA ALA 12 HA ALA 12 12.461 -1.029 -1.641
99 1HB ALA 12 3HB ALA 12 10.301 -0.962 -3.068
100 2HB ALA 12 2HB ALA 12 9.865 -2.446 -2.222
101 3HB ALA 12 1HB ALA 12 10.125 -0.956 -1.314
102 H THR 13 H THR 13 10.806 -2.308 0.265
103 HA THR 13 HA THR 13 11.952 -5.041 0.539
104 HB THR 13 HB THR 13 13.405 -3.622 1.883
105 HG1 THR 13 HG1 THR 13 13.147 -5.390 3.032
106 1HG2 THR 13 2HG2 THR 13 11.376 -1.898 2.105
107 2HG2 THR 13 1HG2 THR 13 11.169 -2.734 3.644
108 3HG2 THR 13 3HG2 THR 13 12.696 -1.933 3.273
109 H LEU 14 H LEU 14 10.120 -6.191 0.372
110 HA LEU 14 HA LEU 14 7.498 -5.693 0.688
111 1HB LEU 14 2HB LEU 14 8.568 -7.927 0.220
112 2HB LEU 14 1HB LEU 14 8.752 -8.135 1.959
113 HG LEU 14 HG LEU 14 6.073 -7.455 0.779
114 1HD1 LEU 14 3HD1 LEU 14 7.592 -9.969 0.522
115 2HD1 LEU 14 2HD1 LEU 14 5.977 -10.170 1.204
116 3HD1 LEU 14 1HD1 LEU 14 6.179 -9.411 -0.375
117 1HD2 LEU 14 1HD2 LEU 14 7.191 -8.444 3.359
118 2HD2 LEU 14 3HD2 LEU 14 5.824 -7.368 3.067
119 3HD2 LEU 14 2HD2 LEU 14 5.633 -9.111 2.871
120 H ILE 15 H ILE 15 6.396 -4.546 2.217
121 HA ILE 15 HA ILE 15 7.181 -4.928 5.072
122 HB ILE 15 HB ILE 15 5.561 -2.738 3.730
123 1HG1 ILE 15 2HG1 ILE 15 8.243 -2.756 5.153
124 2HG1 ILE 15 1HG1 ILE 15 7.983 -2.525 3.425
125 1HG2 ILE 15 3HG2 ILE 15 6.209 -3.171 6.663
126 2HG2 ILE 15 2HG2 ILE 15 5.488 -1.707 5.998
127 3HG2 ILE 15 1HG2 ILE 15 4.606 -3.230 5.932
128 1HD1 ILE 15 1HD1 ILE 15 6.596 -0.497 3.974
129 2HD1 ILE 15 3HD1 ILE 15 7.074 -0.690 5.660
130 3HD1 ILE 15 2HD1 ILE 15 8.291 -0.343 4.433
131 H LYS 16 H LYS 16 4.095 -4.195 3.393
132 HA LYS 16 HA LYS 16 2.802 -6.657 4.037
133 1HB LYS 16 2HB LYS 16 3.067 -4.924 6.270
134 2HB LYS 16 1HB LYS 16 1.380 -4.837 5.763
135 1HG LYS 16 2HG LYS 16 1.743 -7.501 5.575
136 2HG LYS 16 1HG LYS 16 2.915 -7.146 6.844
137 1HD LYS 16 2HD LYS 16 0.385 -5.741 7.255
138 2HD LYS 16 1HD LYS 16 0.177 -7.492 7.206
139 1HE LYS 16 2HE LYS 16 2.412 -6.306 8.832
140 2HE LYS 16 1HE LYS 16 0.774 -6.331 9.485
141 1HZ LYS 16 2HZ LYS 16 0.714 -8.736 9.029
142 2HZ LYS 16 1HZ LYS 16 2.340 -8.671 8.540
143 3HZ LYS 16 3HZ LYS 16 1.924 -8.312 10.144
144 H ALA 17 H ALA 17 0.999 -6.765 2.760
145 HA ALA 17 HA ALA 17 0.200 -4.385 1.243
146 1HB ALA 17 2HB ALA 17 -0.534 -7.301 1.196
147 2HB ALA 17 1HB ALA 17 -1.574 -6.133 0.382
148 3HB ALA 17 3HB ALA 17 0.114 -6.295 -0.101
149 H ILE 18 H ILE 18 -1.174 -2.955 2.059
150 HA ILE 18 HA ILE 18 -2.759 -3.293 4.395
151 HB ILE 18 HB ILE 18 -2.741 -1.342 2.102
152 1HG1 ILE 18 2HG1 ILE 18 -2.516 -0.020 4.544
153 2HG1 ILE 18 1HG1 ILE 18 -1.666 -1.540 4.818
154 1HG2 ILE 18 1HG2 ILE 18 -4.774 -1.528 4.339
155 2HG2 ILE 18 3HG2 ILE 18 -4.424 -0.005 3.519
156 3HG2 ILE 18 2HG2 ILE 18 -5.074 -1.369 2.608
157 1HD1 ILE 18 1HD1 ILE 18 -1.177 0.225 2.405
158 2HD1 ILE 18 3HD1 ILE 18 -0.223 0.320 3.885
159 3HD1 ILE 18 2HD1 ILE 18 -0.220 -1.160 2.929
160 H ASP 19 H ASP 19 -3.885 -3.100 0.992
161 HA ASP 19 HA ASP 19 -5.666 -5.348 1.230
162 1HB ASP 19 2HB ASP 19 -6.700 -3.132 2.463
163 2HB ASP 19 1HB ASP 19 -7.306 -2.912 0.823
164 H GLY 20 H GLY 20 -7.558 -4.486 -0.752
165 1HA GLY 20 2HA GLY 20 -5.810 -4.491 -3.124
166 2HA GLY 20 1HA GLY 20 -7.565 -4.683 -3.130
167 H ASP 21 H ASP 21 -5.592 -2.094 -1.677
168 HA ASP 21 HA ASP 21 -6.588 -0.133 -3.661
169 1HB ASP 21 2HB ASP 21 -6.864 0.535 -0.736
170 2HB ASP 21 1HB ASP 21 -7.689 1.254 -2.113
171 H THR 22 H THR 22 -4.839 -0.492 -0.564
172 HA THR 22 HA THR 22 -2.699 1.297 -1.652
173 HB THR 22 HB THR 22 -3.383 0.924 1.266
174 HG1 THR 22 HG1 THR 22 -5.111 2.003 0.763
175 1HG2 THR 22 3HG2 THR 22 -1.566 2.676 -0.320
176 2HG2 THR 22 2HG2 THR 22 -2.304 3.348 1.134
177 3HG2 THR 22 1HG2 THR 22 -1.299 1.903 1.243
178 H VAL 23 H VAL 23 -0.509 0.822 -0.612
179 HA VAL 23 HA VAL 23 -0.185 -1.942 0.414
180 HB VAL 23 HB VAL 23 1.918 -1.965 -1.242
181 1HG1 VAL 23 1HG1 VAL 23 0.106 -3.659 -1.063
182 2HG1 VAL 23 3HG1 VAL 23 -0.903 -2.661 -2.110
183 3HG1 VAL 23 2HG1 VAL 23 0.586 -3.370 -2.735
184 1HG2 VAL 23 3HG2 VAL 23 1.039 0.331 -2.130
185 2HG2 VAL 23 2HG2 VAL 23 1.567 -0.879 -3.298
186 3HG2 VAL 23 1HG2 VAL 23 -0.153 -0.644 -2.989
187 H LYS 24 H LYS 24 1.862 -2.245 1.575
188 HA LYS 24 HA LYS 24 3.096 0.366 2.343
189 1HB LYS 24 2HB LYS 24 1.894 -1.492 3.983
190 2HB LYS 24 1HB LYS 24 3.599 -1.928 4.112
191 1HG LYS 24 2HG LYS 24 4.170 0.397 4.663
192 2HG LYS 24 1HG LYS 24 2.476 0.860 4.500
193 1HD LYS 24 2HD LYS 24 1.926 0.026 6.540
194 2HD LYS 24 1HD LYS 24 2.912 -1.419 6.313
195 1HE LYS 24 2HE LYS 24 4.058 -0.331 8.033
196 2HE LYS 24 1HE LYS 24 4.926 0.240 6.608
197 1HZ LYS 24 1HZ LYS 24 2.688 1.685 7.923
198 2HZ LYS 24 3HZ LYS 24 4.331 2.041 8.141
199 3HZ LYS 24 2HZ LYS 24 3.615 2.241 6.613
200 H LEU 25 H LEU 25 5.225 0.641 1.899
201 HA LEU 25 HA LEU 25 6.996 -1.700 1.588
202 1HB LEU 25 2HB LEU 25 5.768 -0.431 -0.640
203 2HB LEU 25 1HB LEU 25 7.461 0.047 -0.656
204 HG LEU 25 HG LEU 25 7.329 -1.964 -1.932
205 1HD1 LEU 25 3HD1 LEU 25 9.043 -1.768 0.050
206 2HD1 LEU 25 2HD1 LEU 25 8.107 -3.100 0.727
207 3HD1 LEU 25 1HD1 LEU 25 8.895 -3.283 -0.840
208 1HD2 LEU 25 2HD2 LEU 25 5.045 -2.517 -0.730
209 2HD2 LEU 25 1HD2 LEU 25 6.024 -3.812 -1.417
210 3HD2 LEU 25 3HD2 LEU 25 6.075 -3.495 0.316
211 H MET 26 H MET 26 9.144 -1.198 2.032
212 HA MET 26 HA MET 26 9.710 1.626 2.820
213 1HB MET 26 2HB MET 26 10.324 -0.922 4.007
214 2HB MET 26 1HB MET 26 11.838 -0.129 3.571
215 1HG MET 26 2HG MET 26 11.092 1.914 4.754
216 2HG MET 26 1HG MET 26 9.609 1.087 5.224
217 1HE MET 26 3HE MET 26 13.172 1.174 4.961
218 2HE MET 26 2HE MET 26 13.580 1.413 6.657
219 3HE MET 26 1HE MET 26 13.820 -0.166 5.916
220 H TYR 27 H TYR 27 9.772 1.812 0.324
221 HA TYR 27 HA TYR 27 12.103 0.707 -1.030
222 1HB TYR 27 2HB TYR 27 11.238 1.650 -2.978
223 2HB TYR 27 1HB TYR 27 9.777 1.410 -2.020
224 HD1 TYR 27 HD2 TYR 27 8.871 3.355 -0.664
225 HD2 TYR 27 HD1 TYR 27 11.927 3.825 -3.638
226 HE1 TYR 27 HE2 TYR 27 8.422 5.788 -0.735
227 HE2 TYR 27 HE1 TYR 27 11.485 6.259 -3.711
228 HH TYR 27 HH TYR 27 9.124 7.780 -1.529
229 H LYS 28 H LYS 28 11.278 3.906 0.355
230 HA LYS 28 HA LYS 28 13.998 4.829 -0.381
231 1HB LYS 28 2HB LYS 28 13.213 7.095 -0.025
232 2HB LYS 28 1HB LYS 28 12.072 6.260 -1.071
233 1HG LYS 28 2HG LYS 28 10.396 6.383 0.459
234 2HG LYS 28 1HG LYS 28 11.471 5.997 1.802
235 1HD LYS 28 2HD LYS 28 10.732 8.255 2.150
236 2HD LYS 28 1HD LYS 28 12.402 8.353 1.591
237 1HE LYS 28 2HE LYS 28 11.353 8.547 -0.786
238 2HE LYS 28 1HE LYS 28 9.869 8.955 0.074
239 1HZ LYS 28 1HZ LYS 28 11.085 10.722 1.220
240 2HZ LYS 28 3HZ LYS 28 12.478 10.350 0.326
241 3HZ LYS 28 2HZ LYS 28 11.096 10.941 -0.465
242 H GLY 29 H GLY 29 13.536 2.972 1.802
243 1HA GLY 29 2HA GLY 29 14.621 2.695 3.868
244 2HA GLY 29 1HA GLY 29 15.040 4.406 3.841
245 H GLN 30 H GLN 30 11.732 4.170 3.255
246 HA GLN 30 HA GLN 30 11.029 4.067 6.131
247 1HB GLN 30 2HB GLN 30 9.787 6.202 6.004
248 2HB GLN 30 1HB GLN 30 11.510 6.434 5.725
249 1HG GLN 30 2HG GLN 30 11.099 7.321 3.703
250 2HG GLN 30 1HG GLN 30 10.218 5.874 3.214
251 1HE2 GLN 30 2HE2 GLN 30 7.012 7.299 3.799
252 2HE2 GLN 30 1HE2 GLN 30 7.870 5.868 3.486
253 HA PRO 31 HA PRO 31 7.564 1.867 4.577
254 1HB PRO 31 2HB PRO 31 5.971 2.480 6.873
255 2HB PRO 31 1HB PRO 31 6.903 1.008 6.572
256 1HG PRO 31 2HG PRO 31 7.483 3.120 8.459
257 2HG PRO 31 1HG PRO 31 8.385 1.623 8.188
258 1HD PRO 31 2HD PRO 31 9.133 4.301 7.420
259 2HD PRO 31 1HD PRO 31 10.038 2.797 7.157
260 H MET 32 H MET 32 6.044 2.598 3.152
261 HA MET 32 HA MET 32 4.559 5.093 3.797
262 1HB MET 32 2HB MET 32 4.751 5.084 1.012
263 2HB MET 32 1HB MET 32 5.554 6.192 2.114
264 1HG MET 32 2HG MET 32 7.502 5.394 1.312
265 2HG MET 32 1HG MET 32 7.153 3.886 2.151
266 1HE MET 32 2HE MET 32 5.266 2.555 1.412
267 2HE MET 32 1HE MET 32 4.374 2.884 -0.068
268 3HE MET 32 3HE MET 32 5.578 1.590 -0.022
269 H THR 33 H THR 33 2.813 5.243 1.763
270 HA THR 33 HA THR 33 1.454 2.590 1.757
271 HB THR 33 HB THR 33 -0.678 4.091 1.602
272 HG1 THR 33 HG1 THR 33 -0.387 6.083 2.661
273 1HG2 THR 33 3HG2 THR 33 0.942 3.854 4.150
274 2HG2 THR 33 2HG2 THR 33 -0.789 4.188 4.078
275 3HG2 THR 33 1HG2 THR 33 -0.165 2.642 3.503
276 H PHE 34 H PHE 34 2.572 2.243 -0.248
277 HA PHE 34 HA PHE 34 2.460 3.858 -2.569
278 1HB PHE 34 2HB PHE 34 2.895 0.975 -1.972
279 2HB PHE 34 1HB PHE 34 2.559 1.410 -3.644
280 HD1 PHE 34 HD2 PHE 34 3.855 3.975 -3.997
281 HD2 PHE 34 HD1 PHE 34 5.163 0.569 -1.754
282 HE1 PHE 34 HE2 PHE 34 6.212 4.684 -4.311
283 HE2 PHE 34 HE1 PHE 34 7.525 1.270 -2.064
284 HZ PHE 34 HZ PHE 34 8.048 3.331 -3.341
285 H ARG 35 H ARG 35 1.159 3.490 -4.561
286 HA ARG 35 HA ARG 35 -1.651 2.999 -3.867
287 1HB ARG 35 2HB ARG 35 -2.236 4.180 -5.770
288 2HB ARG 35 1HB ARG 35 -0.734 4.963 -5.315
289 1HG ARG 35 2HG ARG 35 0.375 3.233 -6.934
290 2HG ARG 35 1HG ARG 35 -1.256 3.047 -7.582
291 1HD ARG 35 2HD ARG 35 -0.708 5.838 -7.247
292 2HD ARG 35 1HD ARG 35 0.622 5.115 -8.140
293 HE ARG 35 HE ARG 35 -1.827 5.785 -9.283
294 1HH1 ARG 35 1HH2 ARG 35 0.579 4.053 -10.398
295 2HH1 ARG 35 2HH2 ARG 35 -0.328 2.758 -11.106
296 1HH2 ARG 35 2HH1 ARG 35 -3.292 3.606 -9.509
297 2HH2 ARG 35 1HH1 ARG 35 -2.529 2.517 -10.610
298 H LEU 36 H LEU 36 -2.342 0.951 -3.954
299 HA LEU 36 HA LEU 36 -1.056 -1.136 -5.529
300 1HB LEU 36 2HB LEU 36 -2.466 -1.491 -3.414
301 2HB LEU 36 1HB LEU 36 -3.884 -1.184 -4.415
302 HG LEU 36 HG LEU 36 -1.977 -3.153 -5.529
303 1HD1 LEU 36 3HD1 LEU 36 -3.311 -3.504 -2.869
304 2HD1 LEU 36 2HD1 LEU 36 -3.211 -4.890 -3.953
305 3HD1 LEU 36 1HD1 LEU 36 -1.739 -4.084 -3.414
306 1HD2 LEU 36 1HD2 LEU 36 -4.247 -2.540 -6.460
307 2HD2 LEU 36 3HD2 LEU 36 -4.033 -4.264 -6.162
308 3HD2 LEU 36 2HD2 LEU 36 -4.966 -3.284 -5.032
309 H LEU 37 H LEU 37 -3.708 1.069 -5.850
310 HA LEU 37 HA LEU 37 -3.750 0.908 -8.754
311 1HB LEU 37 2HB LEU 37 -5.320 -0.975 -7.705
312 2HB LEU 37 1HB LEU 37 -6.408 0.388 -7.446
313 HG LEU 37 HG LEU 37 -5.432 0.687 -10.075
314 1HD1 LEU 37 3HD1 LEU 37 -4.717 -1.706 -9.907
315 2HD1 LEU 37 2HD1 LEU 37 -6.390 -2.146 -9.568
316 3HD1 LEU 37 1HD1 LEU 37 -5.961 -1.447 -11.128
317 1HD2 LEU 37 1HD2 LEU 37 -7.711 1.191 -9.065
318 2HD2 LEU 37 3HD2 LEU 37 -7.752 0.449 -10.664
319 3HD2 LEU 37 2HD2 LEU 37 -8.077 -0.526 -9.232
320 H LEU 38 H LEU 38 -3.244 2.751 -6.495
321 HA LEU 38 HA LEU 38 -3.742 4.849 -5.683
322 1HB LEU 38 2HB LEU 38 -3.811 6.439 -7.309
323 2HB LEU 38 1HB LEU 38 -3.346 5.053 -8.280
324 HG LEU 38 HG LEU 38 -6.184 5.030 -8.190
325 1HD1 LEU 38 1HD1 LEU 38 -5.824 7.471 -7.473
326 2HD1 LEU 38 3HD1 LEU 38 -5.177 7.735 -9.093
327 3HD1 LEU 38 2HD1 LEU 38 -6.849 7.209 -8.884
328 1HD2 LEU 38 3HD2 LEU 38 -4.065 5.620 -10.244
329 2HD2 LEU 38 2HD2 LEU 38 -5.141 4.230 -10.131
330 3HD2 LEU 38 1HD2 LEU 38 -5.768 5.788 -10.666
331 H VAL 39 H VAL 39 -5.758 2.741 -5.353
332 HA VAL 39 HA VAL 39 -8.408 3.848 -5.596
333 HB VAL 39 HB VAL 39 -7.328 1.732 -3.701
334 1HG1 VAL 39 2HG1 VAL 39 -10.055 2.815 -4.267
335 2HG1 VAL 39 1HG1 VAL 39 -9.910 1.072 -4.050
336 3HG1 VAL 39 3HG1 VAL 39 -9.395 2.165 -2.767
337 1HG2 VAL 39 2HG2 VAL 39 -7.540 1.682 -6.489
338 2HG2 VAL 39 1HG2 VAL 39 -7.402 0.279 -5.432
339 3HG2 VAL 39 3HG2 VAL 39 -8.992 0.851 -5.934
340 H ASP 40 H ASP 40 -8.528 5.912 -4.708
341 HA ASP 40 HA ASP 40 -8.514 6.063 -1.756
342 1HB ASP 40 2HB ASP 40 -6.196 6.718 -2.765
343 2HB ASP 40 1HB ASP 40 -7.017 8.186 -3.294
344 H THR 41 H THR 41 -10.751 6.080 -3.384
345 HA THR 41 HA THR 41 -11.656 8.908 -3.161
346 HB THR 41 HB THR 41 -11.752 7.057 -5.510
347 HG1 THR 41 HG1 THR 41 -10.423 8.753 -5.734
348 1HG2 THR 41 3HG2 THR 41 -13.968 8.917 -4.671
349 2HG2 THR 41 2HG2 THR 41 -13.668 8.563 -6.373
350 3HG2 THR 41 1HG2 THR 41 -14.084 7.258 -5.260
351 HA PRO 42 HA PRO 42 -14.625 6.701 -0.621
352 1HB PRO 42 2HB PRO 42 -16.005 9.167 -0.164
353 2HB PRO 42 1HB PRO 42 -14.881 8.342 0.925
354 1HG PRO 42 2HG PRO 42 -14.437 10.778 -0.568
355 2HG PRO 42 1HG PRO 42 -13.335 9.972 0.556
356 1HD PRO 42 2HD PRO 42 -13.158 10.083 -2.323
357 2HD PRO 42 1HD PRO 42 -12.046 9.287 -1.189
358 H GLU 43 H GLU 43 -17.002 6.379 -0.729
359 HA GLU 43 HA GLU 43 -18.308 7.446 -3.179
360 1HB GLU 43 2HB GLU 43 -17.986 5.408 -4.138
361 2HB GLU 43 1HB GLU 43 -17.562 4.655 -2.604
362 1HG GLU 43 2HG GLU 43 -19.786 4.156 -2.082
363 2HG GLU 43 1HG GLU 43 -20.422 5.403 -3.154
364 H THR 44 H THR 44 -20.275 8.254 -2.670
365 HA THR 44 HA THR 44 -21.384 7.849 0.013
366 HB THR 44 HB THR 44 -21.448 10.064 -1.197
367 HG1 THR 44 HG1 THR 44 -22.894 10.097 0.349
368 1HG2 THR 44 2HG2 THR 44 -22.079 8.950 -3.421
369 2HG2 THR 44 1HG2 THR 44 -23.721 8.862 -2.783
370 3HG2 THR 44 3HG2 THR 44 -22.945 10.430 -3.006
371 H LYS 45 H LYS 45 -23.314 6.758 0.510
372 HA LYS 45 HA LYS 45 -24.854 5.454 -1.647
373 1HB LYS 45 2HB LYS 45 -22.918 4.043 0.087
374 2HB LYS 45 1HB LYS 45 -24.511 3.292 -0.005
375 1HG LYS 45 2HG LYS 45 -24.274 3.644 -2.577
376 2HG LYS 45 1HG LYS 45 -22.555 3.837 -2.230
377 1HD LYS 45 2HD LYS 45 -22.730 1.629 -0.931
378 2HD LYS 45 1HD LYS 45 -24.296 1.423 -1.716
379 1HE LYS 45 2HE LYS 45 -23.148 1.726 -3.933
380 2HE LYS 45 1HE LYS 45 -21.606 1.721 -3.078
381 1HZ LYS 45 1HZ LYS 45 -22.170 -0.474 -2.195
382 2HZ LYS 45 3HZ LYS 45 -23.613 -0.469 -3.087
383 3HZ LYS 45 2HZ LYS 45 -22.117 -0.474 -3.893
384 H HIS 46 H HIS 46 -26.847 4.446 -0.802
385 HA HIS 46 HA HIS 46 -27.967 5.996 1.413
386 1HB HIS 46 2HB HIS 46 -30.078 4.946 0.828
387 2HB HIS 46 1HB HIS 46 -29.265 5.419 -0.660
388 HD1 HIS 46 HD1 HIS 46 -28.308 3.518 -2.163
389 HD2 HIS 46 HD2 HIS 46 -30.297 2.137 1.231
390 HE1 HIS 46 HE1 HIS 46 -28.668 1.034 -2.503
391 HA PRO 47 HA PRO 47 -27.517 3.245 4.783
392 1HB PRO 47 2HB PRO 47 -30.301 3.113 5.516
393 2HB PRO 47 1HB PRO 47 -29.024 4.092 6.251
394 1HG PRO 47 2HG PRO 47 -31.185 4.999 4.579
395 2HG PRO 47 1HG PRO 47 -29.895 5.969 5.300
396 1HD PRO 47 2HD PRO 47 -30.225 5.247 2.530
397 2HD PRO 47 1HD PRO 47 -28.932 6.222 3.255
398 H LYS 48 H LYS 48 -27.039 1.156 4.189
399 HA LYS 48 HA LYS 48 -29.181 -0.815 3.997
400 1HB LYS 48 2HB LYS 48 -28.560 -1.647 1.745
401 2HB LYS 48 1HB LYS 48 -29.189 -0.001 1.678
402 1HG LYS 48 2HG LYS 48 -27.049 0.932 1.333
403 2HG LYS 48 1HG LYS 48 -26.225 -0.516 1.910
404 1HD LYS 48 2HD LYS 48 -27.950 -1.135 -0.343
405 2HD LYS 48 1HD LYS 48 -26.797 0.134 -0.760
406 1HE LYS 48 2HE LYS 48 -24.993 -1.347 0.278
407 2HE LYS 48 1HE LYS 48 -26.200 -2.634 0.308
408 1HZ LYS 48 1HZ LYS 48 -25.417 -1.129 -2.129
409 2HZ LYS 48 3HZ LYS 48 -24.794 -2.648 -1.702
410 3HZ LYS 48 2HZ LYS 48 -26.448 -2.478 -2.051
411 H LYS 49 H LYS 49 -28.291 -3.041 3.916
412 HA LYS 49 HA LYS 49 -25.887 -3.285 5.509
413 1HB LYS 49 2HB LYS 49 -26.216 -5.721 5.260
414 2HB LYS 49 1HB LYS 49 -27.723 -4.920 5.697
415 1HG LYS 49 2HG LYS 49 -28.632 -5.992 3.924
416 2HG LYS 49 1HG LYS 49 -27.755 -4.835 2.923
417 1HD LYS 49 2HD LYS 49 -26.890 -6.761 2.019
418 2HD LYS 49 1HD LYS 49 -25.765 -6.593 3.367
419 1HE LYS 49 2HE LYS 49 -27.308 -8.030 4.742
420 2HE LYS 49 1HE LYS 49 -28.264 -8.306 3.287
421 1HZ LYS 49 1HZ LYS 49 -26.266 -9.192 2.215
422 2HZ LYS 49 3HZ LYS 49 -25.395 -8.985 3.656
423 3HZ LYS 49 2HZ LYS 49 -26.689 -10.085 3.597
424 H GLY 50 H GLY 50 -23.805 -3.742 4.868
425 1HA GLY 50 2HA GLY 50 -23.266 -3.675 1.945
426 2HA GLY 50 1HA GLY 50 -22.082 -3.359 3.213
427 H VAL 51 H VAL 51 -20.537 -4.909 2.868
428 HA VAL 51 HA VAL 51 -21.221 -7.692 3.430
429 HB VAL 51 HB VAL 51 -21.740 -7.527 1.004
430 1HG1 VAL 51 1HG1 VAL 51 -19.975 -5.688 0.647
431 2HG1 VAL 51 3HG1 VAL 51 -18.798 -6.999 0.565
432 3HG1 VAL 51 2HG1 VAL 51 -20.110 -6.917 -0.610
433 1HG2 VAL 51 1HG2 VAL 51 -20.750 -9.607 2.063
434 2HG2 VAL 51 3HG2 VAL 51 -20.473 -9.461 0.327
435 3HG2 VAL 51 2HG2 VAL 51 -19.178 -9.080 1.462
436 H GLU 52 H GLU 52 -19.462 -8.740 4.312
437 HA GLU 52 HA GLU 52 -17.135 -7.216 5.041
438 1HB GLU 52 2HB GLU 52 -18.140 -9.250 6.255
439 2HB GLU 52 1HB GLU 52 -17.301 -10.236 5.058
440 1HG GLU 52 2HG GLU 52 -15.166 -9.476 5.764
441 2HG GLU 52 1HG GLU 52 -15.854 -8.122 6.659
442 H LYS 53 H LYS 53 -15.393 -6.772 3.789
443 HA LYS 53 HA LYS 53 -14.719 -8.665 1.568
444 1HB LYS 53 2HB LYS 53 -15.068 -5.702 1.572
445 2HB LYS 53 1HB LYS 53 -13.768 -6.360 0.579
446 1HG LYS 53 2HG LYS 53 -16.142 -7.964 0.238
447 2HG LYS 53 1HG LYS 53 -16.530 -6.267 -0.046
448 1HD LYS 53 2HD LYS 53 -15.793 -6.969 -2.157
449 2HD LYS 53 1HD LYS 53 -14.336 -6.256 -1.466
450 1HE LYS 53 2HE LYS 53 -14.053 -8.774 -0.547
451 2HE LYS 53 1HE LYS 53 -14.973 -9.112 -2.013
452 1HZ LYS 53 1HZ LYS 53 -13.335 -7.773 -3.248
453 2HZ LYS 53 3HZ LYS 53 -12.422 -7.603 -1.828
454 3HZ LYS 53 2HZ LYS 53 -12.648 -9.141 -2.514
455 H TYR 54 H TYR 54 -12.537 -9.108 1.274
456 HA TYR 54 HA TYR 54 -10.584 -7.720 3.058
457 1HB TYR 54 2HB TYR 54 -11.045 -10.692 2.756
458 2HB TYR 54 1HB TYR 54 -9.497 -10.051 3.305
459 HD1 TYR 54 HD2 TYR 54 -9.596 -8.312 5.271
460 HD2 TYR 54 HD1 TYR 54 -12.753 -11.061 4.310
461 HE1 TYR 54 HE2 TYR 54 -10.513 -8.060 7.561
462 HE2 TYR 54 HE1 TYR 54 -13.668 -10.810 6.599
463 HH TYR 54 HH TYR 54 -13.283 -8.547 8.495
464 H GLY 55 H GLY 55 -10.743 -10.213 0.472
465 1HA GLY 55 2HA GLY 55 -8.605 -8.692 -0.967
466 2HA GLY 55 1HA GLY 55 -8.554 -10.450 -0.846
467 HA PRO 56 HA PRO 56 -11.609 -8.687 -4.224
468 1HB PRO 56 2HB PRO 56 -9.594 -8.039 -6.156
469 2HB PRO 56 1HB PRO 56 -10.717 -6.933 -5.356
470 1HG PRO 56 2HG PRO 56 -7.876 -7.187 -4.919
471 2HG PRO 56 1HG PRO 56 -9.000 -6.066 -4.141
472 1HD PRO 56 2HD PRO 56 -7.752 -8.408 -3.003
473 2HD PRO 56 1HD PRO 56 -8.846 -7.255 -2.213
474 H GLU 57 H GLU 57 -10.870 -9.330 -6.907
475 HA GLU 57 HA GLU 57 -10.255 -12.245 -6.642
476 1HB GLU 57 2HB GLU 57 -11.403 -12.165 -9.068
477 2HB GLU 57 1HB GLU 57 -12.348 -12.343 -7.593
478 1HG GLU 57 2HG GLU 57 -13.178 -10.193 -7.702
479 2HG GLU 57 1HG GLU 57 -11.740 -9.560 -8.498
480 H ALA 58 H ALA 58 -10.082 -9.773 -9.252
481 HA ALA 58 HA ALA 58 -7.675 -11.038 -10.344
482 1HB ALA 58 2HB ALA 58 -9.042 -8.425 -11.074
483 2HB ALA 58 1HB ALA 58 -7.761 -9.204 -12.002
484 3HB ALA 58 3HB ALA 58 -9.334 -9.984 -11.844
485 H SER 59 H SER 59 -8.494 -8.047 -8.591
486 HA SER 59 HA SER 59 -5.806 -6.989 -8.568
487 1HB SER 59 2HB SER 59 -7.902 -5.646 -8.162
488 2HB SER 59 1HB SER 59 -8.037 -6.429 -6.591
489 HG SER 59 HG SER 59 -6.544 -5.141 -5.875
490 H ALA 60 H ALA 60 -7.512 -9.344 -6.597
491 HA ALA 60 HA ALA 60 -5.933 -9.277 -4.234
492 1HB ALA 60 2HB ALA 60 -7.536 -11.397 -5.629
493 2HB ALA 60 1HB ALA 60 -6.491 -11.862 -4.286
494 3HB ALA 60 3HB ALA 60 -7.778 -10.682 -4.034
495 H PHE 61 H PHE 61 -5.404 -10.964 -7.330
496 HA PHE 61 HA PHE 61 -3.018 -12.357 -6.555
497 1HB PHE 61 2HB PHE 61 -3.994 -11.403 -9.262
498 2HB PHE 61 1HB PHE 61 -2.571 -12.419 -9.040
499 HD1 PHE 61 HD2 PHE 61 -2.987 -14.553 -7.468
500 HD2 PHE 61 HD1 PHE 61 -6.030 -12.456 -9.661
501 HE1 PHE 61 HE2 PHE 61 -4.440 -16.561 -7.374
502 HE2 PHE 61 HE1 PHE 61 -7.481 -14.465 -9.566
503 HZ PHE 61 HZ PHE 61 -6.687 -16.516 -8.424
504 H THR 62 H THR 62 -3.587 -9.172 -8.035
505 HA THR 62 HA THR 62 -0.844 -8.418 -8.381
506 HB THR 62 HB THR 62 -3.466 -6.980 -8.211
507 HG1 THR 62 HG1 THR 62 -1.336 -7.266 -10.026
508 1HG2 THR 62 1HG2 THR 62 -0.759 -5.644 -7.978
509 2HG2 THR 62 3HG2 THR 62 -2.231 -4.799 -8.458
510 3HG2 THR 62 2HG2 THR 62 -2.111 -5.516 -6.853
511 H LYS 63 H LYS 63 -3.068 -8.234 -5.625
512 HA LYS 63 HA LYS 63 -1.432 -6.620 -3.908
513 1HB LYS 63 2HB LYS 63 -3.864 -7.071 -3.558
514 2HB LYS 63 1HB LYS 63 -3.461 -8.731 -3.123
515 1HG LYS 63 2HG LYS 63 -2.354 -8.082 -1.153
516 2HG LYS 63 1HG LYS 63 -2.146 -6.420 -1.709
517 1HD LYS 63 2HD LYS 63 -3.899 -6.311 -0.109
518 2HD LYS 63 1HD LYS 63 -4.708 -6.258 -1.675
519 1HE LYS 63 2HE LYS 63 -4.939 -8.796 -1.488
520 2HE LYS 63 1HE LYS 63 -4.443 -8.621 0.195
521 1HZ LYS 63 3HZ LYS 63 -6.286 -7.084 0.529
522 2HZ LYS 63 2HZ LYS 63 -6.771 -7.293 -1.086
523 3HZ LYS 63 1HZ LYS 63 -6.838 -8.597 0.001
524 H LYS 64 H LYS 64 -1.109 -9.928 -4.896
525 HA LYS 64 HA LYS 64 0.232 -10.940 -2.560
526 1HB LYS 64 2HB LYS 64 -0.056 -11.813 -5.402
527 2HB LYS 64 1HB LYS 64 1.239 -12.530 -4.447
528 1HG LYS 64 2HG LYS 64 -0.256 -13.894 -3.473
529 2HG LYS 64 1HG LYS 64 -1.084 -12.486 -2.807
530 1HD LYS 64 2HD LYS 64 -2.577 -12.353 -4.616
531 2HD LYS 64 1HD LYS 64 -1.550 -13.336 -5.657
532 1HE LYS 64 2HE LYS 64 -2.975 -15.016 -5.081
533 2HE LYS 64 1HE LYS 64 -2.016 -15.074 -3.602
534 1HZ LYS 64 3HZ LYS 64 -4.468 -13.440 -3.982
535 2HZ LYS 64 2HZ LYS 64 -4.400 -14.923 -3.157
536 3HZ LYS 64 1HZ LYS 64 -3.565 -13.574 -2.551
537 H MET 65 H MET 65 1.184 -8.697 -4.947
538 HA MET 65 HA MET 65 3.972 -9.181 -5.179
539 1HB MET 65 2HB MET 65 4.088 -6.989 -6.064
540 2HB MET 65 1HB MET 65 2.456 -7.529 -6.440
541 1HG MET 65 2HG MET 65 1.967 -6.429 -4.047
542 2HG MET 65 1HG MET 65 3.354 -5.450 -4.518
543 1HE MET 65 2HE MET 65 0.393 -5.214 -3.865
544 2HE MET 65 1HE MET 65 0.166 -3.645 -4.633
545 3HE MET 65 3HE MET 65 -0.761 -5.045 -5.186
546 H LEU 66 H LEU 66 2.167 -8.299 -2.419
547 HA LEU 66 HA LEU 66 4.631 -7.317 -1.040
548 1HB LEU 66 2HB LEU 66 1.841 -6.375 -1.052
549 2HB LEU 66 1HB LEU 66 2.517 -6.565 0.564
550 HG LEU 66 HG LEU 66 4.515 -5.233 -0.202
551 1HD1 LEU 66 1HD1 LEU 66 2.752 -4.977 -2.645
552 2HD1 LEU 66 3HD1 LEU 66 3.998 -3.787 -2.266
553 3HD1 LEU 66 2HD1 LEU 66 4.446 -5.466 -2.570
554 1HD2 LEU 66 1HD2 LEU 66 1.727 -4.068 -0.217
555 2HD2 LEU 66 3HD2 LEU 66 2.904 -4.065 1.096
556 3HD2 LEU 66 2HD2 LEU 66 3.160 -3.045 -0.318
557 H GLU 67 H GLU 67 2.342 -9.881 -1.223
558 HA GLU 67 HA GLU 67 2.489 -10.586 1.620
559 1HB GLU 67 2HB GLU 67 0.954 -12.305 1.131
560 2HB GLU 67 1HB GLU 67 0.498 -11.008 0.031
561 1HG GLU 67 2HG GLU 67 0.854 -12.345 -1.742
562 2HG GLU 67 1HG GLU 67 2.511 -12.634 -1.226
563 H ASN 68 H ASN 68 4.553 -11.065 -1.056
564 HA ASN 68 HA ASN 68 6.158 -12.986 0.482
565 1HB ASN 68 2HB ASN 68 6.022 -14.813 -1.045
566 2HB ASN 68 1HB ASN 68 4.363 -14.318 -0.719
567 1HD2 ASN 68 2HD2 ASN 68 4.122 -12.706 -4.057
568 2HD2 ASN 68 1HD2 ASN 68 3.790 -12.265 -2.451
569 H ALA 69 H ALA 69 5.856 -10.902 -2.354
570 HA ALA 69 HA ALA 69 8.421 -11.528 -3.502
571 1HB ALA 69 3HB ALA 69 6.233 -9.728 -4.040
572 2HB ALA 69 2HB ALA 69 7.766 -8.867 -4.176
573 3HB ALA 69 1HB ALA 69 7.479 -10.318 -5.138
574 H LYS 70 H LYS 70 10.384 -11.026 -2.710
575 HA LYS 70 HA LYS 70 10.644 -9.096 -0.496
576 1HB LYS 70 2HB LYS 70 12.237 -11.297 -1.607
577 2HB LYS 70 1HB LYS 70 13.212 -9.891 -1.176
578 1HG LYS 70 2HG LYS 70 13.019 -10.388 1.009
579 2HG LYS 70 1HG LYS 70 11.261 -10.338 0.888
580 1HD LYS 70 2HD LYS 70 11.106 -12.639 0.400
581 2HD LYS 70 1HD LYS 70 12.806 -12.748 -0.058
582 1HE LYS 70 2HE LYS 70 13.463 -12.327 2.287
583 2HE LYS 70 1HE LYS 70 11.763 -12.228 2.744
584 1HZ LYS 70 2HZ LYS 70 13.049 -14.601 1.501
585 2HZ LYS 70 1HZ LYS 70 12.735 -14.427 3.161
586 3HZ LYS 70 3HZ LYS 70 11.448 -14.497 2.059
587 H LYS 71 H LYS 71 12.087 -9.484 -3.770
588 HA LYS 71 HA LYS 71 13.167 -6.755 -3.708
589 1HB LYS 71 2HB LYS 71 13.820 -9.009 -5.143
590 2HB LYS 71 1HB LYS 71 12.893 -8.095 -6.333
591 1HG LYS 71 2HG LYS 71 15.034 -7.236 -6.668
592 2HG LYS 71 1HG LYS 71 14.375 -6.078 -5.512
593 1HD LYS 71 2HD LYS 71 15.595 -6.966 -3.723
594 2HD LYS 71 1HD LYS 71 15.817 -8.523 -4.520
595 1HE LYS 71 2HE LYS 71 17.185 -7.203 -6.279
596 2HE LYS 71 1HE LYS 71 17.230 -5.915 -5.075
597 1HZ LYS 71 3HZ LYS 71 18.142 -8.709 -4.641
598 2HZ LYS 71 2HZ LYS 71 19.155 -7.372 -4.907
599 3HZ LYS 71 1HZ LYS 71 18.207 -7.455 -3.500
600 H ILE 72 H ILE 72 12.153 -4.926 -4.598
601 HA ILE 72 HA ILE 72 9.707 -5.330 -6.211
602 HB ILE 72 HB ILE 72 9.814 -3.969 -3.530
603 1HG1 ILE 72 2HG1 ILE 72 7.931 -6.062 -4.658
604 2HG1 ILE 72 1HG1 ILE 72 9.307 -6.418 -3.618
605 1HG2 ILE 72 2HG2 ILE 72 7.705 -3.750 -5.682
606 2HG2 ILE 72 1HG2 ILE 72 7.461 -3.256 -4.007
607 3HG2 ILE 72 3HG2 ILE 72 8.662 -2.436 -5.000
608 1HD1 ILE 72 1HD1 ILE 72 8.277 -4.811 -1.924
609 2HD1 ILE 72 3HD1 ILE 72 6.822 -4.845 -2.921
610 3HD1 ILE 72 2HD1 ILE 72 7.412 -6.328 -2.171
611 H GLU 73 H GLU 73 10.436 -4.230 -7.924
612 HA GLU 73 HA GLU 73 11.896 -1.705 -7.685
613 1HB GLU 73 2HB GLU 73 10.979 -3.454 -9.948
614 2HB GLU 73 1HB GLU 73 11.405 -1.778 -10.286
615 1HG GLU 73 2HG GLU 73 13.423 -2.818 -8.571
616 2HG GLU 73 1HG GLU 73 13.162 -4.008 -9.846
617 H VAL 74 H VAL 74 9.934 -0.966 -6.313
618 HA VAL 74 HA VAL 74 7.384 -0.426 -7.243
619 HB VAL 74 HB VAL 74 7.947 1.944 -5.929
620 1HG1 VAL 74 1HG1 VAL 74 6.627 -0.562 -5.468
621 2HG1 VAL 74 3HG1 VAL 74 7.353 0.022 -3.972
622 3HG1 VAL 74 2HG1 VAL 74 6.219 1.042 -4.859
623 1HG2 VAL 74 1HG2 VAL 74 10.282 1.122 -5.512
624 2HG2 VAL 74 3HG2 VAL 74 9.360 1.390 -4.035
625 3HG2 VAL 74 2HG2 VAL 74 9.598 -0.248 -4.638
626 H GLU 75 H GLU 75 6.609 0.583 -8.929
627 HA GLU 75 HA GLU 75 8.286 2.453 -10.493
628 1HB GLU 75 2HB GLU 75 7.049 0.539 -11.541
629 2HB GLU 75 1HB GLU 75 5.538 1.298 -11.054
630 1HG GLU 75 2HG GLU 75 5.693 2.940 -12.642
631 2HG GLU 75 1HG GLU 75 7.451 2.965 -12.599
632 H PHE 76 H PHE 76 8.187 4.305 -9.070
633 HA PHE 76 HA PHE 76 5.460 5.448 -8.666
634 1HB PHE 76 2HB PHE 76 6.911 7.073 -7.116
635 2HB PHE 76 1HB PHE 76 6.315 5.529 -6.538
636 HD1 PHE 76 HD2 PHE 76 9.268 7.140 -8.147
637 HD2 PHE 76 HD1 PHE 76 7.798 3.887 -5.761
638 HE1 PHE 76 HE2 PHE 76 11.596 6.417 -7.703
639 HE2 PHE 76 HE1 PHE 76 10.126 3.164 -5.313
640 HZ PHE 76 HZ PHE 76 12.027 4.430 -6.282
641 H ASP 77 H ASP 77 6.726 5.689 -11.241
642 HA ASP 77 HA ASP 77 7.404 7.246 -12.856
643 1HB ASP 77 2HB ASP 77 5.957 9.188 -12.966
644 2HB ASP 77 1HB ASP 77 5.020 7.814 -12.397
645 H LYS 78 H LYS 78 7.793 9.951 -12.917
646 HA LYS 78 HA LYS 78 10.404 10.244 -11.685
647 1HB LYS 78 2HB LYS 78 10.102 12.697 -12.484
648 2HB LYS 78 1HB LYS 78 10.171 11.438 -13.711
649 1HG LYS 78 2HG LYS 78 7.925 11.628 -14.230
650 2HG LYS 78 1HG LYS 78 7.485 12.139 -12.603
651 1HD LYS 78 2HD LYS 78 8.516 14.343 -13.009
652 2HD LYS 78 1HD LYS 78 8.959 13.835 -14.640
653 1HE LYS 78 2HE LYS 78 6.093 13.653 -13.746
654 2HE LYS 78 1HE LYS 78 6.747 15.199 -14.283
655 1HZ LYS 78 3HZ LYS 78 7.463 14.091 -16.343
656 2HZ LYS 78 2HZ LYS 78 6.702 12.663 -15.828
657 3HZ LYS 78 1HZ LYS 78 5.781 14.055 -16.137
658 H GLY 79 H GLY 79 10.389 10.335 -9.430
659 1HA GLY 79 2HA GLY 79 10.258 11.518 -7.397
660 2HA GLY 79 1HA GLY 79 9.253 12.726 -8.196
661 H GLN 80 H GLN 80 8.567 11.818 -5.701
662 HA GLN 80 HA GLN 80 6.834 9.615 -5.457
663 1HB GLN 80 2HB GLN 80 7.277 12.131 -4.009
664 2HB GLN 80 1HB GLN 80 5.617 11.546 -3.887
665 1HG GLN 80 2HG GLN 80 7.147 9.239 -3.571
666 2HG GLN 80 1HG GLN 80 8.055 10.465 -2.685
667 1HE2 GLN 80 2HE2 GLN 80 4.169 9.804 -1.464
668 2HE2 GLN 80 1HE2 GLN 80 4.533 9.709 -3.119
669 H ARG 81 H ARG 81 6.238 12.781 -6.904
670 HA ARG 81 HA ARG 81 4.608 13.349 -8.507
671 1HB ARG 81 2HB ARG 81 4.422 10.775 -8.827
672 2HB ARG 81 1HB ARG 81 2.986 10.910 -7.811
673 1HG ARG 81 2HG ARG 81 2.169 11.141 -10.027
674 2HG ARG 81 1HG ARG 81 2.244 12.790 -9.408
675 1HD ARG 81 2HD ARG 81 4.799 12.223 -10.497
676 2HD ARG 81 1HD ARG 81 3.621 11.648 -11.673
677 HE ARG 81 HE ARG 81 4.292 14.295 -11.516
678 1HH1 ARG 81 1HH2 ARG 81 2.544 15.337 -9.666
679 2HH1 ARG 81 2HH2 ARG 81 0.992 15.429 -10.429
680 1HH2 ARG 81 2HH1 ARG 81 1.812 13.198 -12.965
681 2HH2 ARG 81 1HH1 ARG 81 0.577 14.214 -12.302
682 H THR 82 H THR 82 3.537 12.097 -5.347
683 HA THR 82 HA THR 82 1.790 14.492 -5.129
684 HB THR 82 HB THR 82 0.085 12.923 -3.968
685 HG1 THR 82 HG1 THR 82 1.437 11.072 -5.639
686 1HG2 THR 82 3HG2 THR 82 0.036 14.099 -6.311
687 2HG2 THR 82 2HG2 THR 82 0.270 12.465 -6.929
688 3HG2 THR 82 1HG2 THR 82 -1.146 12.842 -5.948
689 H ASP 83 H ASP 83 1.649 11.833 -2.849
690 HA ASP 83 HA ASP 83 2.453 11.579 -0.689
691 1HB ASP 83 2HB ASP 83 4.675 11.883 -0.698
692 2HB ASP 83 1HB ASP 83 4.552 12.993 -2.053
693 H LYS 84 H LYS 84 0.997 14.401 -1.831
694 HA LYS 84 HA LYS 84 0.790 15.608 0.885
695 1HB LYS 84 2HB LYS 84 0.011 16.619 -1.864
696 2HB LYS 84 1HB LYS 84 -0.399 17.468 -0.373
697 1HG LYS 84 2HG LYS 84 2.440 16.687 -1.085
698 2HG LYS 84 1HG LYS 84 1.739 18.242 -1.531
699 1HD LYS 84 2HD LYS 84 2.430 18.964 0.500
700 2HD LYS 84 1HD LYS 84 1.093 18.020 1.157
701 1HE LYS 84 2HE LYS 84 2.877 16.040 0.922
702 2HE LYS 84 1HE LYS 84 4.010 17.381 1.078
703 1HZ LYS 84 1HZ LYS 84 2.842 18.057 3.102
704 2HZ LYS 84 3HZ LYS 84 1.810 16.717 2.960
705 3HZ LYS 84 2HZ LYS 84 3.470 16.485 3.234
706 H TYR 85 H TYR 85 -0.947 13.908 -1.561
707 HA TYR 85 HA TYR 85 -3.123 13.216 0.236
708 1HB TYR 85 2HB TYR 85 -4.098 15.299 -0.498
709 2HB TYR 85 1HB TYR 85 -3.641 14.990 -2.174
710 HD1 TYR 85 HD1 TYR 85 -5.672 13.553 0.630
711 HD2 TYR 85 HD2 TYR 85 -5.135 13.890 -3.619
712 HE1 TYR 85 HE1 TYR 85 -7.789 12.314 0.264
713 HE2 TYR 85 HE2 TYR 85 -7.252 12.656 -3.985
714 HH TYR 85 HH TYR 85 -9.567 12.329 -1.965
715 H GLY 86 H GLY 86 -1.747 13.250 -3.036
716 1HA GLY 86 2HA GLY 86 -3.116 10.962 -4.061
717 2HA GLY 86 1HA GLY 86 -1.585 11.595 -4.663
718 H ARG 87 H ARG 87 -0.743 11.227 -1.592
719 HA ARG 87 HA ARG 87 0.314 9.571 -0.313
720 1HB ARG 87 2HB ARG 87 -1.944 8.397 -1.342
721 2HB ARG 87 1HB ARG 87 -0.672 7.349 -1.957
722 1HG ARG 87 2HG ARG 87 0.091 6.823 0.239
723 2HG ARG 87 1HG ARG 87 -0.852 8.131 0.958
724 1HD ARG 87 2HD ARG 87 -1.791 5.662 1.036
725 2HD ARG 87 1HD ARG 87 -2.877 7.002 0.708
726 HE ARG 87 HE ARG 87 -1.817 6.104 -1.789
727 1HH1 ARG 87 1HH2 ARG 87 -4.633 5.946 -0.077
728 2HH1 ARG 87 2HH2 ARG 87 -5.152 4.409 -0.684
729 1HH2 ARG 87 2HH1 ARG 87 -2.121 3.693 -2.218
730 2HH2 ARG 87 1HH1 ARG 87 -3.729 3.135 -1.903
731 H VAL 88 H VAL 88 1.234 7.013 -1.402
732 HA VAL 88 HA VAL 88 3.468 8.044 -3.052
733 HB VAL 88 HB VAL 88 3.315 5.181 -2.180
734 1HG1 VAL 88 3HG1 VAL 88 5.212 6.188 -3.503
735 2HG1 VAL 88 2HG1 VAL 88 5.553 7.238 -2.129
736 3HG1 VAL 88 1HG1 VAL 88 5.720 5.491 -1.964
737 1HG2 VAL 88 2HG2 VAL 88 3.211 7.501 -0.361
738 2HG2 VAL 88 1HG2 VAL 88 2.934 5.794 -0.020
739 3HG2 VAL 88 3HG2 VAL 88 4.576 6.431 -0.052
740 H LEU 89 H LEU 89 2.013 8.320 -4.898
741 HA LEU 89 HA LEU 89 0.557 6.145 -6.065
742 1HB LEU 89 2HB LEU 89 1.716 8.597 -7.442
743 2HB LEU 89 1HB LEU 89 0.428 7.567 -8.067
744 HG LEU 89 HG LEU 89 0.266 9.061 -5.434
745 1HD1 LEU 89 2HD1 LEU 89 0.388 10.559 -7.453
746 2HD1 LEU 89 1HD1 LEU 89 -1.066 9.766 -8.058
747 3HD1 LEU 89 3HD1 LEU 89 -1.123 10.681 -6.552
748 1HD2 LEU 89 3HD2 LEU 89 -1.636 7.375 -7.057
749 2HD2 LEU 89 2HD2 LEU 89 -1.242 7.251 -5.342
750 3HD2 LEU 89 1HD2 LEU 89 -2.240 8.584 -5.924
751 H ALA 90 H ALA 90 1.840 4.319 -6.198
752 HA ALA 90 HA ALA 90 3.672 4.163 -8.475
753 1HB ALA 90 3HB ALA 90 4.838 4.840 -6.103
754 2HB ALA 90 2HB ALA 90 4.903 3.080 -6.016
755 3HB ALA 90 1HB ALA 90 5.651 3.922 -7.370
756 H TYR 91 H TYR 91 3.777 2.055 -9.257
757 HA TYR 91 HA TYR 91 2.030 0.090 -7.913
758 1HB TYR 91 2HB TYR 91 3.064 0.467 -10.661
759 2HB TYR 91 1HB TYR 91 2.864 -1.204 -10.134
760 HD1 TYR 91 HD1 TYR 91 0.722 1.124 -8.417
761 HD2 TYR 91 HD2 TYR 91 1.067 -1.246 -11.983
762 HE1 TYR 91 HE1 TYR 91 -1.716 1.293 -8.754
763 HE2 TYR 91 HE2 TYR 91 -1.379 -1.071 -12.321
764 HH TYR 91 HH TYR 91 -3.228 0.724 -11.549
765 H ILE 92 H ILE 92 2.853 -2.230 -7.848
766 HA ILE 92 HA ILE 92 5.648 -2.128 -6.789
767 HB ILE 92 HB ILE 92 3.628 -4.287 -6.193
768 1HG1 ILE 92 2HG1 ILE 92 2.533 -2.185 -5.586
769 2HG1 ILE 92 1HG1 ILE 92 3.082 -2.987 -4.117
770 1HG2 ILE 92 3HG2 ILE 92 6.125 -4.469 -5.660
771 2HG2 ILE 92 2HG2 ILE 92 5.851 -3.187 -4.480
772 3HG2 ILE 92 1HG2 ILE 92 5.014 -4.729 -4.318
773 1HD1 ILE 92 1HD1 ILE 92 5.243 -1.535 -4.415
774 2HD1 ILE 92 3HD1 ILE 92 4.235 -0.550 -5.475
775 3HD1 ILE 92 2HD1 ILE 92 3.789 -0.764 -3.784
776 H TYR 93 H TYR 93 7.179 -3.167 -7.909
777 HA TYR 93 HA TYR 93 6.332 -5.245 -9.888
778 1HB TYR 93 2HB TYR 93 8.579 -3.215 -10.077
779 2HB TYR 93 1HB TYR 93 8.234 -4.463 -11.279
780 HD1 TYR 93 HD1 TYR 93 6.503 -1.723 -9.383
781 HD2 TYR 93 HD2 TYR 93 6.787 -3.969 -13.020
782 HE1 TYR 93 HE1 TYR 93 4.749 -0.333 -10.379
783 HE2 TYR 93 HE2 TYR 93 5.028 -2.579 -14.026
784 HH TYR 93 HH TYR 93 4.147 0.281 -13.045
785 H ALA 94 H ALA 94 6.778 -7.050 -8.582
786 HA ALA 94 HA ALA 94 9.466 -7.212 -7.418
787 1HB ALA 94 1HB ALA 94 7.319 -7.891 -6.181
788 2HB ALA 94 3HB ALA 94 7.309 -9.312 -7.226
789 3HB ALA 94 2HB ALA 94 8.659 -9.036 -6.125
790 H ASP 95 H ASP 95 9.472 -10.160 -7.601
791 HA ASP 95 HA ASP 95 11.182 -10.714 -9.663
792 1HB ASP 95 2HB ASP 95 10.298 -12.284 -7.865
793 2HB ASP 95 1HB ASP 95 8.935 -12.600 -8.936
794 H GLY 96 H GLY 96 7.629 -11.144 -9.985
795 1HA GLY 96 2HA GLY 96 7.792 -10.314 -12.827
796 2HA GLY 96 1HA GLY 96 7.184 -11.939 -12.521
797 H LYS 97 H LYS 97 6.610 -9.202 -10.378
798 HA LYS 97 HA LYS 97 3.747 -9.669 -10.673
799 1HB LYS 97 2HB LYS 97 5.240 -8.725 -8.588
800 2HB LYS 97 1HB LYS 97 4.601 -7.222 -9.247
801 1HG LYS 97 2HG LYS 97 2.809 -7.773 -7.938
802 2HG LYS 97 1HG LYS 97 2.366 -8.699 -9.366
803 1HD LYS 97 2HD LYS 97 3.825 -10.584 -8.277
804 2HD LYS 97 1HD LYS 97 3.566 -9.676 -6.790
805 1HE LYS 97 2HE LYS 97 1.232 -9.980 -6.863
806 2HE LYS 97 1HE LYS 97 1.248 -10.384 -8.579
807 1HZ LYS 97 3HZ LYS 97 2.428 -12.430 -8.043
808 2HZ LYS 97 2HZ LYS 97 2.383 -12.042 -6.389
809 3HZ LYS 97 1HZ LYS 97 0.941 -12.355 -7.232
810 H MET 98 H MET 98 5.094 -6.380 -10.609
811 HA MET 98 HA MET 98 4.684 -4.582 -12.031
812 1HB MET 98 2HB MET 98 4.551 -6.653 -14.247
813 2HB MET 98 1HB MET 98 5.012 -4.959 -14.388
814 1HG MET 98 2HG MET 98 7.161 -5.509 -14.021
815 2HG MET 98 1HG MET 98 6.728 -6.181 -12.451
816 1HE MET 98 1HE MET 98 9.113 -7.183 -13.927
817 2HE MET 98 3HE MET 98 8.551 -8.031 -12.480
818 3HE MET 98 2HE MET 98 8.969 -8.938 -13.931
819 H VAL 99 H VAL 99 2.543 -6.413 -10.863
820 HA VAL 99 HA VAL 99 0.256 -6.661 -10.914
821 HB VAL 99 HB VAL 99 0.946 -4.007 -11.330
822 1HG1 VAL 99 2HG1 VAL 99 0.246 -4.563 -13.786
823 2HG1 VAL 99 1HG1 VAL 99 -1.395 -4.498 -13.142
824 3HG1 VAL 99 3HG1 VAL 99 -0.346 -3.086 -13.030
825 1HG2 VAL 99 3HG2 VAL 99 -0.667 -5.031 -9.715
826 2HG2 VAL 99 2HG2 VAL 99 -1.237 -3.532 -10.447
827 3HG2 VAL 99 1HG2 VAL 99 -1.862 -5.083 -11.009
828 H ASN 100 H ASN 100 2.027 -7.782 -13.155
829 HA ASN 100 HA ASN 100 0.688 -7.648 -15.665
830 1HB ASN 100 2HB ASN 100 2.988 -8.712 -14.952
831 2HB ASN 100 1HB ASN 100 2.024 -10.177 -14.761
832 1HD2 ASN 100 2HD2 ASN 100 1.575 -10.655 -18.248
833 2HD2 ASN 100 1HD2 ASN 100 1.134 -11.166 -16.690
834 H GLU 101 H GLU 101 -0.024 -9.631 -12.812
835 HA GLU 101 HA GLU 101 -1.647 -11.621 -13.959
836 1HB GLU 101 2HB GLU 101 -0.990 -11.238 -11.469
837 2HB GLU 101 1HB GLU 101 -2.462 -10.270 -11.394
838 1HG GLU 101 2HG GLU 101 -3.426 -12.293 -10.914
839 2HG GLU 101 1HG GLU 101 -3.422 -12.459 -12.667
840 H ALA 102 H ALA 102 -2.523 -8.265 -13.121
841 HA ALA 102 HA ALA 102 -5.306 -8.609 -13.934
842 1HB ALA 102 2HB ALA 102 -3.669 -6.102 -13.421
843 2HB ALA 102 1HB ALA 102 -5.412 -6.131 -13.686
844 3HB ALA 102 3HB ALA 102 -4.723 -6.912 -12.262
845 H LEU 103 HN LEU 103 -5.385 -9.279 -16.085
846 HA LEU 103 HA LEU 103 -3.988 -7.588 -18.111
847 1HB LEU 103 2HB LEU 103 -4.041 -10.321 -17.873
848 2HB LEU 103 1HB LEU 103 -5.352 -10.047 -19.023
849 HG LEU 103 HG LEU 103 -3.591 -8.420 -20.153
850 1HD1 LEU 103 1HD1 LEU 103 -1.926 -8.752 -18.318
851 2HD1 LEU 103 3HD1 LEU 103 -1.817 -10.454 -18.767
852 3HD1 LEU 103 2HD1 LEU 103 -1.296 -9.209 -19.901
853 1HD2 LEU 103 2HD2 LEU 103 -4.583 -10.433 -21.196
854 2HD2 LEU 103 1HD2 LEU 103 -2.865 -10.306 -21.574
855 3HD2 LEU 103 3HD2 LEU 103 -3.415 -11.446 -20.348
No H/Q in entry = 855
Start of MODEL 5
Raw file had 866 H/Q atoms
Start of MODEL 5
1 1H ALA 1 3H ALA 1 19.025 18.141 -18.263
2 2H ALA 1 2H ALA 1 19.479 18.097 -19.900
3 3H ALA 1 1H ALA 1 18.770 19.498 -19.248
4 HA ALA 1 HA ALA 1 16.696 18.320 -18.879
5 1HB ALA 1 2HB ALA 1 17.821 18.094 -21.689
6 2HB ALA 1 1HB ALA 1 16.109 17.972 -21.282
7 3HB ALA 1 3HB ALA 1 16.976 19.485 -21.008
8 H THR 2 H THR 2 15.987 16.384 -18.159
9 HA THR 2 HA THR 2 17.148 13.901 -19.362
10 HB THR 2 HB THR 2 16.810 12.847 -17.075
11 HG1 THR 2 HG1 THR 2 15.737 14.075 -15.761
12 1HG2 THR 2 2HG2 THR 2 19.022 13.621 -17.948
13 2HG2 THR 2 1HG2 THR 2 18.748 15.174 -17.158
14 3HG2 THR 2 3HG2 THR 2 18.901 13.707 -16.191
15 H SER 3 H SER 3 14.394 15.125 -17.413
16 HA SER 3 HA SER 3 12.124 14.567 -17.451
17 1HB SER 3 2HB SER 3 12.869 14.007 -20.336
18 2HB SER 3 1HB SER 3 11.214 13.958 -19.739
19 HG SER 3 HG SER 3 12.667 16.069 -20.461
20 H THR 4 H THR 4 13.312 12.686 -16.106
21 HA THR 4 HA THR 4 12.369 10.094 -17.272
22 HB THR 4 HB THR 4 14.602 10.283 -15.246
23 HG1 THR 4 HG1 THR 4 14.816 10.355 -18.077
24 1HG2 THR 4 2HG2 THR 4 13.524 8.096 -15.649
25 2HG2 THR 4 1HG2 THR 4 13.883 8.242 -17.369
26 3HG2 THR 4 3HG2 THR 4 15.198 8.098 -16.203
27 H LYS 5 H LYS 5 10.670 11.784 -15.788
28 HA LYS 5 HA LYS 5 10.443 10.302 -13.196
29 1HB LYS 5 2HB LYS 5 10.190 13.182 -13.862
30 2HB LYS 5 1HB LYS 5 8.960 12.545 -12.771
31 1HG LYS 5 2HG LYS 5 10.599 13.079 -11.229
32 2HG LYS 5 1HG LYS 5 11.076 11.424 -11.606
33 1HD LYS 5 2HD LYS 5 12.465 12.591 -13.530
34 2HD LYS 5 1HD LYS 5 12.332 14.003 -12.482
35 1HE LYS 5 2HE LYS 5 14.312 12.994 -11.726
36 2HE LYS 5 1HE LYS 5 13.109 12.377 -10.593
37 1HZ LYS 5 1HZ LYS 5 13.998 10.961 -13.049
38 2HZ LYS 5 3HZ LYS 5 14.575 10.636 -11.488
39 3HZ LYS 5 2HZ LYS 5 12.941 10.362 -11.861
40 H LYS 6 H LYS 6 9.230 8.702 -14.423
41 HA LYS 6 HA LYS 6 6.351 9.315 -14.551
42 1HB LYS 6 2HB LYS 6 7.749 8.037 -16.924
43 2HB LYS 6 1HB LYS 6 6.043 8.452 -16.799
44 1HG LYS 6 2HG LYS 6 8.184 10.560 -16.551
45 2HG LYS 6 1HG LYS 6 7.577 10.051 -18.125
46 1HD LYS 6 2HD LYS 6 5.221 10.431 -16.892
47 2HD LYS 6 1HD LYS 6 6.193 11.573 -15.965
48 1HE LYS 6 2HE LYS 6 6.901 12.696 -18.012
49 2HE LYS 6 1HE LYS 6 6.048 11.505 -18.993
50 1HZ LYS 6 3HZ LYS 6 4.776 13.331 -17.025
51 2HZ LYS 6 2HZ LYS 6 4.766 13.545 -18.709
52 3HZ LYS 6 1HZ LYS 6 3.969 12.215 -18.015
53 H LEU 7 H LEU 7 8.608 6.779 -15.644
54 HA LEU 7 HA LEU 7 7.496 4.912 -13.612
55 1HB LEU 7 2HB LEU 7 7.467 4.533 -16.606
56 2HB LEU 7 1HB LEU 7 7.561 3.138 -15.531
57 HG LEU 7 HG LEU 7 5.458 5.255 -15.107
58 1HD1 LEU 7 2HD1 LEU 7 5.272 4.510 -17.458
59 2HD1 LEU 7 1HD1 LEU 7 5.246 2.831 -16.920
60 3HD1 LEU 7 3HD1 LEU 7 3.923 3.915 -16.490
61 1HD2 LEU 7 1HD2 LEU 7 5.741 2.308 -14.446
62 2HD2 LEU 7 3HD2 LEU 7 5.736 3.657 -13.311
63 3HD2 LEU 7 2HD2 LEU 7 4.262 3.230 -14.179
64 H HIS 8 H HIS 8 9.328 4.381 -12.494
65 HA HIS 8 HA HIS 8 11.674 3.428 -14.034
66 1HB HIS 8 2HB HIS 8 11.749 5.946 -13.108
67 2HB HIS 8 1HB HIS 8 12.261 5.101 -11.649
68 HD1 HIS 8 HD1 HIS 8 13.395 6.061 -15.048
69 HD2 HIS 8 HD2 HIS 8 14.701 3.558 -11.981
70 HE1 HIS 8 HE1 HIS 8 15.794 5.456 -15.590
71 H LYS 9 H LYS 9 12.294 1.562 -13.246
72 HA LYS 9 HA LYS 9 11.126 0.305 -10.955
73 1HB LYS 9 2HB LYS 9 13.127 -1.336 -11.298
74 2HB LYS 9 1HB LYS 9 11.911 -1.210 -12.568
75 1HG LYS 9 2HG LYS 9 13.314 -0.017 -13.986
76 2HG LYS 9 1HG LYS 9 14.289 0.613 -12.659
77 1HD LYS 9 2HD LYS 9 15.721 -0.996 -13.570
78 2HD LYS 9 1HD LYS 9 14.926 -1.911 -12.290
79 1HE LYS 9 2HE LYS 9 13.514 -1.895 -14.896
80 2HE LYS 9 1HE LYS 9 15.059 -2.745 -14.880
81 1HZ LYS 9 2HZ LYS 9 14.253 -3.933 -12.868
82 2HZ LYS 9 1HZ LYS 9 12.726 -3.228 -13.110
83 3HZ LYS 9 3HZ LYS 9 13.367 -4.279 -14.275
84 H GLU 10 H GLU 10 11.905 -0.020 -8.893
85 HA GLU 10 HA GLU 10 14.564 0.847 -8.053
86 1HB GLU 10 2HB GLU 10 12.193 2.590 -7.731
87 2HB GLU 10 1HB GLU 10 13.098 2.312 -6.244
88 1HG GLU 10 2HG GLU 10 14.775 3.655 -6.923
89 2HG GLU 10 1HG GLU 10 14.894 2.821 -8.472
90 HA PRO 11 HA PRO 11 13.300 -2.689 -5.682
91 1HB PRO 11 2HB PRO 11 15.676 -2.264 -4.055
92 2HB PRO 11 1HB PRO 11 15.292 -3.604 -5.146
93 1HG PRO 11 2HG PRO 11 17.168 -1.553 -5.638
94 2HG PRO 11 1HG PRO 11 16.553 -2.719 -6.817
95 1HD PRO 11 2HD PRO 11 15.975 0.138 -6.619
96 2HD PRO 11 1HD PRO 11 15.532 -0.998 -7.910
97 H ALA 12 H ALA 12 12.249 -2.974 -3.799
98 HA ALA 12 HA ALA 12 12.262 -0.766 -1.787
99 1HB ALA 12 3HB ALA 12 10.256 -0.614 -3.225
100 2HB ALA 12 2HB ALA 12 9.853 -2.285 -2.833
101 3HB ALA 12 1HB ALA 12 9.820 -1.052 -1.575
102 H THR 13 H THR 13 10.300 -2.147 -0.119
103 HA THR 13 HA THR 13 11.460 -4.793 0.441
104 HB THR 13 HB THR 13 12.986 -3.374 1.700
105 HG1 THR 13 HG1 THR 13 11.046 -4.350 3.518
106 1HG2 THR 13 2HG2 THR 13 10.813 -1.642 1.898
107 2HG2 THR 13 1HG2 THR 13 11.057 -2.207 3.551
108 3HG2 THR 13 3HG2 THR 13 12.382 -1.436 2.678
109 H LEU 14 H LEU 14 9.496 -5.768 0.212
110 HA LEU 14 HA LEU 14 6.969 -4.826 0.741
111 1HB LEU 14 2HB LEU 14 6.189 -7.104 1.004
112 2HB LEU 14 1HB LEU 14 7.389 -7.029 -0.271
113 HG LEU 14 HG LEU 14 8.029 -8.953 0.860
114 1HD1 LEU 14 1HD1 LEU 14 9.543 -6.783 2.330
115 2HD1 LEU 14 3HD1 LEU 14 10.005 -8.481 2.270
116 3HD1 LEU 14 2HD1 LEU 14 9.993 -7.520 0.794
117 1HD2 LEU 14 2HD2 LEU 14 6.532 -7.784 3.002
118 2HD2 LEU 14 1HD2 LEU 14 7.024 -9.464 2.790
119 3HD2 LEU 14 3HD2 LEU 14 8.085 -8.335 3.632
120 H ILE 15 H ILE 15 5.994 -3.994 2.461
121 HA ILE 15 HA ILE 15 7.133 -4.588 5.128
122 HB ILE 15 HB ILE 15 5.037 -2.532 4.355
123 1HG1 ILE 15 2HG1 ILE 15 7.944 -2.029 5.031
124 2HG1 ILE 15 1HG1 ILE 15 7.403 -2.275 3.371
125 1HG2 ILE 15 3HG2 ILE 15 6.634 -3.002 6.888
126 2HG2 ILE 15 2HG2 ILE 15 5.695 -1.543 6.576
127 3HG2 ILE 15 1HG2 ILE 15 4.883 -3.102 6.703
128 1HD1 ILE 15 1HD1 ILE 15 5.652 -0.429 3.895
129 2HD1 ILE 15 3HD1 ILE 15 6.690 -0.041 5.266
130 3HD1 ILE 15 2HD1 ILE 15 7.322 0.067 3.624
131 H LYS 16 H LYS 16 3.872 -4.363 3.646
132 HA LYS 16 HA LYS 16 2.977 -6.888 4.612
133 1HB LYS 16 2HB LYS 16 3.170 -5.089 6.707
134 2HB LYS 16 1HB LYS 16 1.479 -4.940 6.229
135 1HG LYS 16 2HG LYS 16 2.635 -7.690 6.460
136 2HG LYS 16 1HG LYS 16 2.260 -6.818 7.947
137 1HD LYS 16 2HD LYS 16 -0.029 -6.685 7.449
138 2HD LYS 16 1HD LYS 16 0.233 -6.956 5.725
139 1HE LYS 16 2HE LYS 16 1.014 -9.102 7.672
140 2HE LYS 16 1HE LYS 16 -0.684 -8.912 7.240
141 1HZ LYS 16 2HZ LYS 16 1.553 -9.274 5.319
142 2HZ LYS 16 1HZ LYS 16 0.441 -10.474 5.776
143 3HZ LYS 16 3HZ LYS 16 -0.089 -9.114 4.913
144 H ALA 17 H ALA 17 1.269 -7.373 3.307
145 HA ALA 17 HA ALA 17 0.034 -5.326 1.648
146 1HB ALA 17 2HB ALA 17 0.340 -7.696 0.897
147 2HB ALA 17 1HB ALA 17 -0.844 -8.202 2.103
148 3HB ALA 17 3HB ALA 17 -1.335 -7.158 0.768
149 H ILE 18 H ILE 18 -1.154 -3.868 2.703
150 HA ILE 18 HA ILE 18 -2.699 -4.309 5.062
151 HB ILE 18 HB ILE 18 -2.706 -2.181 2.920
152 1HG1 ILE 18 2HG1 ILE 18 -2.063 -1.553 5.735
153 2HG1 ILE 18 1HG1 ILE 18 -0.957 -2.695 4.971
154 1HG2 ILE 18 2HG2 ILE 18 -4.360 -2.326 5.465
155 2HG2 ILE 18 1HG2 ILE 18 -4.106 -0.842 4.548
156 3HG2 ILE 18 3HG2 ILE 18 -4.966 -2.195 3.814
157 1HD1 ILE 18 2HD1 ILE 18 -0.792 -1.069 3.026
158 2HD1 ILE 18 1HD1 ILE 18 -1.669 0.092 4.021
159 3HD1 ILE 18 3HD1 ILE 18 -0.087 -0.495 4.537
160 H ASP 19 H ASP 19 -3.994 -3.570 1.788
161 HA ASP 19 HA ASP 19 -5.824 -5.780 1.742
162 1HB ASP 19 2HB ASP 19 -6.670 -3.842 3.485
163 2HB ASP 19 1HB ASP 19 -7.419 -3.297 1.985
164 H GLY 20 H GLY 20 -7.718 -4.981 0.034
165 1HA GLY 20 2HA GLY 20 -6.400 -4.501 -2.416
166 2HA GLY 20 1HA GLY 20 -8.146 -4.398 -2.168
167 H ASP 21 H ASP 21 -5.894 -2.671 -3.411
168 HA ASP 21 HA ASP 21 -5.995 -0.377 -4.054
169 1HB ASP 21 2HB ASP 21 -7.444 0.222 -1.466
170 2HB ASP 21 1HB ASP 21 -7.291 1.254 -2.875
171 H THR 22 H THR 22 -5.145 -1.536 -0.848
172 HA THR 22 HA THR 22 -3.058 0.594 -0.722
173 HB THR 22 HB THR 22 -3.090 0.187 1.763
174 HG1 THR 22 HG1 THR 22 -5.517 -1.170 1.242
175 1HG2 THR 22 1HG2 THR 22 -5.047 1.519 0.117
176 2HG2 THR 22 3HG2 THR 22 -5.798 0.959 1.611
177 3HG2 THR 22 2HG2 THR 22 -4.385 2.013 1.674
178 H VAL 23 H VAL 23 -0.992 -0.020 0.112
179 HA VAL 23 HA VAL 23 -0.343 -2.830 0.606
180 HB VAL 23 HB VAL 23 1.524 -2.636 -1.253
181 1HG1 VAL 23 2HG1 VAL 23 -0.552 -4.202 -1.042
182 2HG1 VAL 23 1HG1 VAL 23 -1.260 -3.156 -2.272
183 3HG1 VAL 23 3HG1 VAL 23 0.230 -4.038 -2.614
184 1HG2 VAL 23 2HG2 VAL 23 0.721 -0.262 -1.807
185 2HG2 VAL 23 1HG2 VAL 23 0.931 -1.353 -3.176
186 3HG2 VAL 23 3HG2 VAL 23 -0.685 -1.024 -2.551
187 H LYS 24 H LYS 24 1.074 -2.690 2.282
188 HA LYS 24 HA LYS 24 2.486 -0.184 2.801
189 1HB LYS 24 2HB LYS 24 1.515 -2.137 4.436
190 2HB LYS 24 1HB LYS 24 3.221 -2.578 4.380
191 1HG LYS 24 2HG LYS 24 3.885 -0.371 5.112
192 2HG LYS 24 1HG LYS 24 2.229 0.222 4.977
193 1HD LYS 24 2HD LYS 24 1.532 -1.406 6.726
194 2HD LYS 24 1HD LYS 24 3.215 -1.907 6.900
195 1HE LYS 24 2HE LYS 24 2.489 1.001 7.145
196 2HE LYS 24 1HE LYS 24 2.253 -0.082 8.518
197 1HZ LYS 24 1HZ LYS 24 4.585 -0.735 8.337
198 2HZ LYS 24 3HZ LYS 24 4.801 0.352 7.052
199 3HZ LYS 24 2HZ LYS 24 4.427 0.935 8.602
200 H LEU 25 H LEU 25 4.304 0.277 1.730
201 HA LEU 25 HA LEU 25 6.512 -1.649 1.628
202 1HB LEU 25 2HB LEU 25 5.196 -2.274 -0.370
203 2HB LEU 25 1HB LEU 25 5.259 -0.607 -0.934
204 HG LEU 25 HG LEU 25 7.923 -1.541 -0.304
205 1HD1 LEU 25 2HD1 LEU 25 6.146 -3.365 -1.838
206 2HD1 LEU 25 1HD1 LEU 25 7.754 -3.080 -2.502
207 3HD1 LEU 25 3HD1 LEU 25 7.575 -3.734 -0.874
208 1HD2 LEU 25 2HD2 LEU 25 6.406 -0.296 -2.544
209 2HD2 LEU 25 1HD2 LEU 25 7.921 0.211 -1.795
210 3HD2 LEU 25 3HD2 LEU 25 7.913 -1.107 -2.969
211 H MET 26 H MET 26 8.517 -0.595 1.170
212 HA MET 26 HA MET 26 8.408 2.354 0.761
213 1HB MET 26 2HB MET 26 10.134 2.650 2.530
214 2HB MET 26 1HB MET 26 8.617 2.032 3.177
215 1HG MET 26 2HG MET 26 9.504 -0.226 3.255
216 2HG MET 26 1HG MET 26 10.980 0.288 2.438
217 1HE MET 26 1HE MET 26 9.781 -0.925 5.498
218 2HE MET 26 3HE MET 26 10.043 0.245 6.801
219 3HE MET 26 2HE MET 26 8.770 0.514 5.612
220 H TYR 27 H TYR 27 10.293 3.194 -0.268
221 HA TYR 27 HA TYR 27 11.844 1.141 -1.724
222 1HB TYR 27 2HB TYR 27 12.823 3.704 -2.444
223 2HB TYR 27 1HB TYR 27 11.786 2.652 -3.398
224 HD1 TYR 27 HD2 TYR 27 11.892 5.530 -1.107
225 HD2 TYR 27 HD1 TYR 27 9.367 3.010 -3.500
226 HE1 TYR 27 HE2 TYR 27 10.047 7.168 -0.880
227 HE2 TYR 27 HE1 TYR 27 7.520 4.649 -3.273
228 HH TYR 27 HH TYR 27 7.707 7.555 -2.660
229 H LYS 28 H LYS 28 12.396 1.013 0.899
230 HA LYS 28 HA LYS 28 14.093 1.067 2.484
231 1HB LYS 28 2HB LYS 28 15.622 1.275 -0.115
232 2HB LYS 28 1HB LYS 28 16.459 1.237 1.436
233 1HG LYS 28 2HG LYS 28 16.393 -1.028 1.017
234 2HG LYS 28 1HG LYS 28 14.836 -0.855 1.828
235 1HD LYS 28 2HD LYS 28 13.973 -1.818 -0.035
236 2HD LYS 28 1HD LYS 28 14.193 -0.233 -0.776
237 1HE LYS 28 2HE LYS 28 16.524 -2.113 -0.722
238 2HE LYS 28 1HE LYS 28 15.237 -2.407 -1.889
239 1HZ LYS 28 3HZ LYS 28 15.482 -0.067 -2.603
240 2HZ LYS 28 2HZ LYS 28 16.829 0.080 -1.578
241 3HZ LYS 28 1HZ LYS 28 16.867 -1.001 -2.888
242 H GLY 29 H GLY 29 12.872 3.243 2.797
243 1HA GLY 29 2HA GLY 29 14.846 5.202 3.567
244 2HA GLY 29 1HA GLY 29 13.948 5.752 2.153
245 H GLN 30 H GLN 30 11.424 4.535 2.854
246 HA GLN 30 HA GLN 30 10.659 5.484 5.508
247 1HB GLN 30 2HB GLN 30 8.977 7.159 4.525
248 2HB GLN 30 1HB GLN 30 10.667 7.658 4.548
249 1HG GLN 30 2HG GLN 30 10.907 6.954 2.189
250 2HG GLN 30 1HG GLN 30 9.213 6.464 2.164
251 1HE2 GLN 30 2HE2 GLN 30 8.133 9.714 1.382
252 2HE2 GLN 30 1HE2 GLN 30 7.847 8.042 1.324
253 HA PRO 31 HA PRO 31 7.783 2.194 4.643
254 1HB PRO 31 2HB PRO 31 6.236 2.999 6.944
255 2HB PRO 31 1HB PRO 31 7.324 1.613 6.791
256 1HG PRO 31 2HG PRO 31 7.776 4.039 8.273
257 2HG PRO 31 1HG PRO 31 8.868 2.659 8.098
258 1HD PRO 31 2HD PRO 31 9.130 5.272 6.915
259 2HD PRO 31 1HD PRO 31 10.214 3.878 6.727
260 H MET 32 H MET 32 6.387 2.640 2.958
261 HA MET 32 HA MET 32 4.394 4.843 3.365
262 1HB MET 32 2HB MET 32 5.882 3.991 0.877
263 2HB MET 32 1HB MET 32 4.455 5.026 0.823
264 1HG MET 32 2HG MET 32 6.887 5.653 2.514
265 2HG MET 32 1HG MET 32 6.670 6.263 0.875
266 1HE MET 32 1HE MET 32 6.961 7.006 3.904
267 2HE MET 32 3HE MET 32 6.517 8.706 3.695
268 3HE MET 32 2HE MET 32 5.544 7.657 4.723
269 H THR 33 H THR 33 2.646 4.525 1.461
270 HA THR 33 HA THR 33 1.740 1.716 1.292
271 HB THR 33 HB THR 33 -0.256 3.863 1.935
272 HG1 THR 33 HG1 THR 33 0.728 4.097 3.781
273 1HG2 THR 33 3HG2 THR 33 -0.117 0.889 2.480
274 2HG2 THR 33 2HG2 THR 33 -1.488 1.932 2.859
275 3HG2 THR 33 1HG2 THR 33 -1.027 1.657 1.180
276 H PHE 34 H PHE 34 1.026 1.350 -0.804
277 HA PHE 34 HA PHE 34 0.952 3.758 -2.545
278 1HB PHE 34 2HB PHE 34 1.272 0.836 -3.212
279 2HB PHE 34 1HB PHE 34 1.313 2.154 -4.380
280 HD1 PHE 34 HD2 PHE 34 2.992 0.778 -1.350
281 HD2 PHE 34 HD1 PHE 34 3.265 3.475 -4.678
282 HE1 PHE 34 HE2 PHE 34 5.387 1.158 -0.854
283 HE2 PHE 34 HE1 PHE 34 5.662 3.854 -4.178
284 HZ PHE 34 HZ PHE 34 6.724 2.694 -2.262
285 H ARG 35 H ARG 35 -0.740 4.326 -3.776
286 HA ARG 35 HA ARG 35 -3.091 2.574 -4.112
287 1HB ARG 35 2HB ARG 35 -3.862 3.636 -2.157
288 2HB ARG 35 1HB ARG 35 -3.102 5.170 -2.579
289 1HG ARG 35 2HG ARG 35 -4.726 5.635 -4.252
290 2HG ARG 35 1HG ARG 35 -5.315 3.975 -4.242
291 1HD ARG 35 2HD ARG 35 -5.539 5.858 -1.882
292 2HD ARG 35 1HD ARG 35 -6.826 5.590 -3.051
293 HE ARG 35 HE ARG 35 -6.103 3.035 -2.150
294 1HH1 ARG 35 2HH1 ARG 35 -6.292 5.759 -0.139
295 2HH1 ARG 35 1HH1 ARG 35 -7.500 5.103 0.910
296 1HH2 ARG 35 1HH2 ARG 35 -8.072 2.293 -1.044
297 2HH2 ARG 35 2HH2 ARG 35 -8.507 3.145 0.400
298 H LEU 36 H LEU 36 -3.835 2.856 -6.148
299 HA LEU 36 HA LEU 36 -3.851 5.379 -7.569
300 1HB LEU 36 2HB LEU 36 -2.153 4.565 -9.341
301 2HB LEU 36 1HB LEU 36 -1.494 5.147 -7.815
302 HG LEU 36 HG LEU 36 -2.109 2.215 -8.172
303 1HD1 LEU 36 1HD1 LEU 36 -0.671 3.068 -10.074
304 2HD1 LEU 36 3HD1 LEU 36 0.536 3.498 -8.864
305 3HD1 LEU 36 2HD1 LEU 36 0.064 1.814 -9.078
306 1HD2 LEU 36 3HD2 LEU 36 -0.562 3.936 -6.304
307 2HD2 LEU 36 2HD2 LEU 36 -1.451 2.447 -5.988
308 3HD2 LEU 36 1HD2 LEU 36 0.155 2.378 -6.705
309 H LEU 37 H LEU 37 -3.053 2.740 -9.668
310 HA LEU 37 HA LEU 37 -5.854 2.530 -10.518
311 1HB LEU 37 2HB LEU 37 -3.221 1.548 -11.497
312 2HB LEU 37 1HB LEU 37 -4.602 0.518 -11.853
313 HG LEU 37 HG LEU 37 -4.113 2.229 -13.639
314 1HD1 LEU 37 3HD1 LEU 37 -6.395 1.214 -13.190
315 2HD1 LEU 37 2HD1 LEU 37 -6.784 2.677 -12.286
316 3HD1 LEU 37 1HD1 LEU 37 -6.420 2.775 -14.009
317 1HD2 LEU 37 1HD2 LEU 37 -3.572 3.980 -11.739
318 2HD2 LEU 37 3HD2 LEU 37 -4.313 4.521 -13.245
319 3HD2 LEU 37 2HD2 LEU 37 -5.306 4.290 -11.806
320 H LEU 38 H LEU 38 -3.586 0.905 -8.455
321 HA LEU 38 HA LEU 38 -4.765 -1.676 -8.192
322 1HB LEU 38 2HB LEU 38 -2.991 0.086 -6.543
323 2HB LEU 38 1HB LEU 38 -3.781 -1.256 -5.720
324 HG LEU 38 HG LEU 38 -2.821 -2.848 -7.300
325 1HD1 LEU 38 2HD1 LEU 38 -1.741 -0.355 -8.643
326 2HD1 LEU 38 1HD1 LEU 38 -1.137 -1.976 -8.985
327 3HD1 LEU 38 3HD1 LEU 38 -2.815 -1.566 -9.342
328 1HD2 LEU 38 2HD2 LEU 38 -1.053 -0.887 -5.888
329 2HD2 LEU 38 1HD2 LEU 38 -1.293 -2.606 -5.573
330 3HD2 LEU 38 3HD2 LEU 38 -0.291 -2.088 -6.929
331 H VAL 39 H VAL 39 -5.527 1.477 -6.785
332 HA VAL 39 HA VAL 39 -7.480 0.347 -4.933
333 HB VAL 39 HB VAL 39 -6.318 2.362 -4.230
334 1HG1 VAL 39 2HG1 VAL 39 -7.297 3.388 -6.863
335 2HG1 VAL 39 1HG1 VAL 39 -7.182 4.527 -5.525
336 3HG1 VAL 39 3HG1 VAL 39 -5.752 3.647 -6.061
337 1HG2 VAL 39 2HG2 VAL 39 -9.162 2.061 -4.321
338 2HG2 VAL 39 1HG2 VAL 39 -8.193 2.895 -3.109
339 3HG2 VAL 39 3HG2 VAL 39 -8.793 3.774 -4.514
340 H ASP 40 H ASP 40 -9.195 -0.570 -5.826
341 HA ASP 40 HA ASP 40 -10.429 0.399 -8.292
342 1HB ASP 40 2HB ASP 40 -11.569 -1.639 -6.361
343 2HB ASP 40 1HB ASP 40 -11.914 -1.476 -8.081
344 H THR 41 H THR 41 -11.076 0.643 -4.821
345 HA THR 41 HA THR 41 -13.717 1.832 -5.182
346 HB THR 41 HB THR 41 -11.887 1.275 -2.860
347 HG1 THR 41 HG1 THR 41 -13.207 -0.349 -3.001
348 1HG2 THR 41 3HG2 THR 41 -14.182 3.218 -2.922
349 2HG2 THR 41 2HG2 THR 41 -13.794 2.326 -1.452
350 3HG2 THR 41 1HG2 THR 41 -12.597 3.402 -2.172
351 HA PRO 42 HA PRO 42 -12.292 5.917 -6.100
352 1HB PRO 42 2HB PRO 42 -14.685 7.076 -5.002
353 2HB PRO 42 1HB PRO 42 -14.289 6.802 -6.704
354 1HG PRO 42 2HG PRO 42 -16.196 5.364 -5.085
355 2HG PRO 42 1HG PRO 42 -15.806 5.105 -6.790
356 1HD PRO 42 2HD PRO 42 -15.104 3.436 -4.552
357 2HD PRO 42 1HD PRO 42 -14.693 3.192 -6.261
358 H GLU 43 H GLU 43 -11.951 8.033 -4.914
359 HA GLU 43 HA GLU 43 -11.253 7.496 -2.080
360 1HB GLU 43 2HB GLU 43 -10.561 9.813 -3.918
361 2HB GLU 43 1HB GLU 43 -9.982 9.638 -2.262
362 1HG GLU 43 2HG GLU 43 -9.563 7.411 -4.244
363 2HG GLU 43 1HG GLU 43 -8.471 8.795 -4.228
364 H THR 44 H THR 44 -14.057 7.840 -2.776
365 HA THR 44 HA THR 44 -14.673 10.137 -1.001
366 HB THR 44 HB THR 44 -16.573 10.771 -2.569
367 HG1 THR 44 HG1 THR 44 -16.789 9.211 -4.004
368 1HG2 THR 44 1HG2 THR 44 -14.357 11.984 -2.387
369 2HG2 THR 44 3HG2 THR 44 -13.824 11.070 -3.799
370 3HG2 THR 44 2HG2 THR 44 -15.188 12.182 -3.930
371 H LYS 45 H LYS 45 -17.231 10.055 -0.616
372 HA LYS 45 HA LYS 45 -17.791 7.362 0.391
373 1HB LYS 45 2HB LYS 45 -19.361 9.956 0.463
374 2HB LYS 45 1HB LYS 45 -19.941 8.452 1.180
375 1HG LYS 45 2HG LYS 45 -17.205 9.501 1.872
376 2HG LYS 45 1HG LYS 45 -18.632 10.142 2.686
377 1HD LYS 45 2HD LYS 45 -19.106 8.132 3.739
378 2HD LYS 45 1HD LYS 45 -18.331 7.169 2.481
379 1HE LYS 45 2HE LYS 45 -16.113 8.014 3.245
380 2HE LYS 45 1HE LYS 45 -16.921 8.878 4.553
381 1HZ LYS 45 3HZ LYS 45 -17.776 6.772 5.372
382 2HZ LYS 45 2HZ LYS 45 -16.995 5.941 4.112
383 3HZ LYS 45 1HZ LYS 45 -16.082 6.744 5.299
384 H HIS 46 H HIS 46 -18.515 5.851 -1.030
385 HA HIS 46 HA HIS 46 -20.564 6.692 -3.043
386 1HB HIS 46 2HB HIS 46 -19.658 4.991 -4.572
387 2HB HIS 46 1HB HIS 46 -18.403 6.143 -4.123
388 HD1 HIS 46 HD1 HIS 46 -19.442 2.570 -3.691
389 HD2 HIS 46 HD2 HIS 46 -16.361 5.073 -2.418
390 HE1 HIS 46 HE1 HIS 46 -17.672 1.069 -2.678
391 HA PRO 47 HA PRO 47 -23.261 3.756 -1.204
392 1HB PRO 47 2HB PRO 47 -24.574 3.146 -3.676
393 2HB PRO 47 1HB PRO 47 -25.105 4.274 -2.421
394 1HG PRO 47 2HG PRO 47 -24.050 4.904 -5.037
395 2HG PRO 47 1HG PRO 47 -24.618 6.025 -3.794
396 1HD PRO 47 2HD PRO 47 -21.898 5.512 -4.600
397 2HD PRO 47 1HD PRO 47 -22.473 6.638 -3.355
398 H LYS 48 H LYS 48 -23.479 1.479 -1.031
399 HA LYS 48 HA LYS 48 -22.163 -0.212 -3.096
400 1HB LYS 48 2HB LYS 48 -20.979 -1.488 -1.312
401 2HB LYS 48 1HB LYS 48 -20.424 0.181 -1.423
402 1HG LYS 48 2HG LYS 48 -21.994 0.771 0.442
403 2HG LYS 48 1HG LYS 48 -22.385 -0.941 0.601
404 1HD LYS 48 2HD LYS 48 -20.688 -0.670 2.194
405 2HD LYS 48 1HD LYS 48 -19.795 -1.256 0.790
406 1HE LYS 48 2HE LYS 48 -19.181 1.034 0.182
407 2HE LYS 48 1HE LYS 48 -20.141 1.669 1.518
408 1HZ LYS 48 1HZ LYS 48 -17.814 -0.156 1.802
409 2HZ LYS 48 3HZ LYS 48 -17.777 1.519 2.064
410 3HZ LYS 48 2HZ LYS 48 -18.716 0.523 3.071
411 H LYS 49 H LYS 49 -22.925 -2.405 -3.098
412 HA LYS 49 HA LYS 49 -25.544 -2.735 -1.709
413 1HB LYS 49 2HB LYS 49 -24.356 -4.029 -4.178
414 2HB LYS 49 1HB LYS 49 -25.845 -4.600 -3.423
415 1HG LYS 49 2HG LYS 49 -26.634 -2.134 -3.594
416 2HG LYS 49 1HG LYS 49 -25.313 -1.944 -4.748
417 1HD LYS 49 2HD LYS 49 -27.238 -4.233 -5.055
418 2HD LYS 49 1HD LYS 49 -27.692 -2.626 -5.622
419 1HE LYS 49 2HE LYS 49 -26.020 -2.575 -7.244
420 2HE LYS 49 1HE LYS 49 -25.009 -3.736 -6.385
421 1HZ LYS 49 1HZ LYS 49 -27.583 -4.356 -7.733
422 2HZ LYS 49 3HZ LYS 49 -26.041 -4.720 -8.338
423 3HZ LYS 49 2HZ LYS 49 -26.593 -5.472 -6.919
424 H GLY 50 H GLY 50 -23.367 -3.126 -0.049
425 1HA GLY 50 2HA GLY 50 -22.786 -4.728 1.594
426 2HA GLY 50 1HA GLY 50 -23.699 -5.938 0.693
427 H VAL 51 H VAL 51 -20.586 -4.839 1.458
428 HA VAL 51 HA VAL 51 -19.406 -6.498 -0.733
429 HB VAL 51 HB VAL 51 -18.002 -4.246 0.692
430 1HG1 VAL 51 2HG1 VAL 51 -17.459 -5.862 -1.805
431 2HG1 VAL 51 1HG1 VAL 51 -16.584 -4.382 -1.411
432 3HG1 VAL 51 3HG1 VAL 51 -16.476 -5.781 -0.343
433 1HG2 VAL 51 3HG2 VAL 51 -19.623 -4.221 -1.863
434 2HG2 VAL 51 2HG2 VAL 51 -19.830 -3.188 -0.449
435 3HG2 VAL 51 1HG2 VAL 51 -18.419 -2.988 -1.489
436 H GLU 52 H GLU 52 -18.702 -8.379 0.106
437 HA GLU 52 HA GLU 52 -17.559 -8.374 2.873
438 1HB GLU 52 2HB GLU 52 -19.744 -9.746 2.160
439 2HB GLU 52 1HB GLU 52 -18.531 -10.905 1.614
440 1HG GLU 52 2HG GLU 52 -17.454 -10.604 3.938
441 2HG GLU 52 1HG GLU 52 -18.971 -9.834 4.405
442 H LYS 53 H LYS 53 -16.034 -7.760 0.481
443 HA LYS 53 HA LYS 53 -14.047 -9.968 0.641
444 1HB LYS 53 2HB LYS 53 -15.323 -8.888 -1.872
445 2HB LYS 53 1HB LYS 53 -13.708 -9.596 -1.907
446 1HG LYS 53 2HG LYS 53 -14.774 -11.597 -0.656
447 2HG LYS 53 1HG LYS 53 -16.318 -10.918 -1.172
448 1HD LYS 53 2HD LYS 53 -15.437 -10.924 -3.537
449 2HD LYS 53 1HD LYS 53 -14.033 -11.815 -2.947
450 1HE LYS 53 2HE LYS 53 -15.509 -13.603 -2.111
451 2HE LYS 53 1HE LYS 53 -16.918 -12.716 -2.691
452 1HZ LYS 53 2HZ LYS 53 -14.687 -13.713 -4.382
453 2HZ LYS 53 1HZ LYS 53 -16.230 -14.415 -4.264
454 3HZ LYS 53 3HZ LYS 53 -16.053 -12.867 -4.938
455 H TYR 54 H TYR 54 -11.896 -9.238 -0.272
456 HA TYR 54 HA TYR 54 -11.294 -6.543 0.702
457 1HB TYR 54 2HB TYR 54 -9.468 -8.540 -0.674
458 2HB TYR 54 1HB TYR 54 -8.962 -7.120 0.240
459 HD1 TYR 54 HD1 TYR 54 -10.485 -7.080 2.643
460 HD2 TYR 54 HD2 TYR 54 -9.011 -10.499 0.500
461 HE1 TYR 54 HE1 TYR 54 -10.535 -8.411 4.732
462 HE2 TYR 54 HE2 TYR 54 -9.063 -11.830 2.590
463 HH TYR 54 HH TYR 54 -8.978 -10.855 5.393
464 H GLY 55 H GLY 55 -10.695 -8.186 -2.438
465 1HA GLY 55 2HA GLY 55 -11.822 -6.244 -4.118
466 2HA GLY 55 1HA GLY 55 -10.162 -5.718 -3.836
467 HA PRO 56 HA PRO 56 -9.836 -10.134 -5.845
468 1HB PRO 56 2HB PRO 56 -12.353 -10.749 -7.051
469 2HB PRO 56 1HB PRO 56 -11.536 -11.607 -5.738
470 1HG PRO 56 2HG PRO 56 -13.891 -9.943 -5.564
471 2HG PRO 56 1HG PRO 56 -13.080 -10.820 -4.259
472 1HD PRO 56 2HD PRO 56 -13.083 -7.978 -4.740
473 2HD PRO 56 1HD PRO 56 -12.276 -8.864 -3.430
474 H GLU 57 H GLU 57 -12.065 -7.739 -7.248
475 HA GLU 57 HA GLU 57 -11.890 -8.137 -9.963
476 1HB GLU 57 2HB GLU 57 -11.681 -5.527 -10.119
477 2HB GLU 57 1HB GLU 57 -13.116 -6.234 -9.383
478 1HG GLU 57 2HG GLU 57 -11.059 -5.914 -7.377
479 2HG GLU 57 1HG GLU 57 -11.318 -4.385 -8.212
480 H ALA 58 H ALA 58 -9.487 -6.032 -8.320
481 HA ALA 58 HA ALA 58 -7.362 -7.236 -10.005
482 1HB ALA 58 2HB ALA 58 -8.228 -5.236 -11.213
483 2HB ALA 58 1HB ALA 58 -7.821 -4.245 -9.813
484 3HB ALA 58 3HB ALA 58 -6.545 -5.053 -10.724
485 H SER 59 H SER 59 -8.347 -6.272 -6.947
486 HA SER 59 HA SER 59 -5.767 -5.266 -6.008
487 1HB SER 59 2HB SER 59 -7.067 -4.425 -4.380
488 2HB SER 59 1HB SER 59 -8.457 -5.262 -5.052
489 HG SER 59 HG SER 59 -8.155 -6.897 -3.663
490 H ALA 60 H ALA 60 -7.645 -8.291 -5.641
491 HA ALA 60 HA ALA 60 -5.941 -9.664 -3.877
492 1HB ALA 60 1HB ALA 60 -7.511 -10.790 -6.211
493 2HB ALA 60 3HB ALA 60 -6.855 -11.739 -4.876
494 3HB ALA 60 2HB ALA 60 -8.116 -10.544 -4.573
495 H PHE 61 H PHE 61 -5.447 -9.030 -7.307
496 HA PHE 61 HA PHE 61 -3.279 -10.980 -7.564
497 1HB PHE 61 2HB PHE 61 -4.030 -8.706 -9.425
498 2HB PHE 61 1HB PHE 61 -3.027 -10.101 -9.819
499 HD1 PHE 61 HD1 PHE 61 -4.085 -12.444 -9.589
500 HD2 PHE 61 HD2 PHE 61 -6.378 -8.812 -9.672
501 HE1 PHE 61 HE1 PHE 61 -6.113 -13.738 -10.189
502 HE2 PHE 61 HE2 PHE 61 -8.404 -10.108 -10.273
503 HZ PHE 61 HZ PHE 61 -8.272 -12.570 -10.531
504 H THR 62 H THR 62 -3.470 -7.411 -7.499
505 HA THR 62 HA THR 62 -0.564 -7.124 -7.404
506 HB THR 62 HB THR 62 -2.475 -4.907 -6.732
507 HG1 THR 62 HG1 THR 62 -3.403 -5.215 -8.580
508 1HG2 THR 62 1HG2 THR 62 0.220 -5.196 -8.050
509 2HG2 THR 62 3HG2 THR 62 -0.734 -3.725 -8.232
510 3HG2 THR 62 2HG2 THR 62 -0.211 -4.244 -6.630
511 H LYS 63 H LYS 63 -3.156 -7.320 -5.060
512 HA LYS 63 HA LYS 63 -2.005 -6.061 -2.800
513 1HB LYS 63 2HB LYS 63 -4.306 -7.007 -2.829
514 2HB LYS 63 1HB LYS 63 -3.626 -8.633 -2.863
515 1HG LYS 63 2HG LYS 63 -2.375 -7.945 -0.705
516 2HG LYS 63 1HG LYS 63 -3.515 -6.600 -0.635
517 1HD LYS 63 2HD LYS 63 -5.003 -8.974 -1.193
518 2HD LYS 63 1HD LYS 63 -3.934 -9.313 0.169
519 1HE LYS 63 2HE LYS 63 -4.758 -7.319 1.339
520 2HE LYS 63 1HE LYS 63 -5.795 -6.926 -0.033
521 1HZ LYS 63 1HZ LYS 63 -5.961 -9.406 1.595
522 2HZ LYS 63 3HZ LYS 63 -7.008 -8.078 1.717
523 3HZ LYS 63 2HZ LYS 63 -6.971 -8.999 0.290
524 H LYS 64 H LYS 64 -1.294 -9.091 -4.378
525 HA LYS 64 HA LYS 64 0.523 -10.047 -2.313
526 1HB LYS 64 2HB LYS 64 -0.384 -10.953 -5.041
527 2HB LYS 64 1HB LYS 64 1.076 -11.652 -4.343
528 1HG LYS 64 2HG LYS 64 -0.215 -13.031 -3.131
529 2HG LYS 64 1HG LYS 64 -0.831 -11.622 -2.268
530 1HD LYS 64 2HD LYS 64 -2.721 -11.455 -3.605
531 2HD LYS 64 1HD LYS 64 -1.972 -12.311 -4.953
532 1HE LYS 64 2HE LYS 64 -2.877 -14.240 -4.232
533 2HE LYS 64 1HE LYS 64 -2.009 -14.077 -2.706
534 1HZ LYS 64 2HZ LYS 64 -4.634 -12.839 -3.342
535 2HZ LYS 64 1HZ LYS 64 -4.396 -14.204 -2.359
536 3HZ LYS 64 3HZ LYS 64 -3.799 -12.694 -1.868
537 H MET 65 H MET 65 2.389 -10.704 -4.853
538 HA MET 65 HA MET 65 4.402 -9.706 -5.602
539 1HB MET 65 2HB MET 65 2.833 -7.141 -5.825
540 2HB MET 65 1HB MET 65 4.009 -7.812 -6.949
541 1HG MET 65 2HG MET 65 1.139 -8.646 -6.516
542 2HG MET 65 1HG MET 65 1.907 -8.120 -8.011
543 1HE MET 65 1HE MET 65 0.485 -10.000 -8.831
544 2HE MET 65 3HE MET 65 1.945 -10.085 -9.826
545 3HE MET 65 2HE MET 65 1.211 -11.561 -9.204
546 H LEU 66 H LEU 66 3.672 -9.552 -2.733
547 HA LEU 66 HA LEU 66 5.701 -7.729 -1.762
548 1HB LEU 66 2HB LEU 66 3.008 -6.735 -2.076
549 2HB LEU 66 1HB LEU 66 3.363 -6.874 -0.358
550 HG LEU 66 HG LEU 66 5.668 -5.759 -1.622
551 1HD1 LEU 66 3HD1 LEU 66 3.032 -4.757 -2.629
552 2HD1 LEU 66 2HD1 LEU 66 4.279 -3.566 -2.264
553 3HD1 LEU 66 1HD1 LEU 66 4.589 -4.831 -3.452
554 1HD2 LEU 66 3HD2 LEU 66 4.593 -5.486 0.737
555 2HD2 LEU 66 2HD2 LEU 66 5.375 -4.080 0.014
556 3HD2 LEU 66 1HD2 LEU 66 3.618 -4.226 -0.021
557 H GLU 67 H GLU 67 2.724 -9.594 -1.027
558 HA GLU 67 HA GLU 67 3.642 -10.224 1.688
559 1HB GLU 67 2HB GLU 67 1.199 -10.428 0.189
560 2HB GLU 67 1HB GLU 67 1.570 -11.999 0.898
561 1HG GLU 67 2HG GLU 67 1.710 -9.444 2.507
562 2HG GLU 67 1HG GLU 67 0.221 -10.377 2.360
563 H ASN 68 H ASN 68 5.131 -11.213 -0.935
564 HA ASN 68 HA ASN 68 5.806 -13.834 0.205
565 1HB ASN 68 2HB ASN 68 5.321 -15.101 -1.840
566 2HB ASN 68 1HB ASN 68 3.852 -14.354 -1.215
567 1HD2 ASN 68 2HD2 ASN 68 3.621 -11.992 -3.935
568 2HD2 ASN 68 1HD2 ASN 68 3.242 -12.181 -2.292
569 H ALA 69 H ALA 69 6.345 -11.482 -2.431
570 HA ALA 69 HA ALA 69 8.945 -12.632 -3.147
571 1HB ALA 69 2HB ALA 69 7.492 -10.110 -3.945
572 2HB ALA 69 1HB ALA 69 9.107 -10.509 -4.533
573 3HB ALA 69 3HB ALA 69 7.744 -11.565 -4.908
574 H LYS 70 H LYS 70 10.740 -10.778 -3.368
575 HA LYS 70 HA LYS 70 10.975 -9.300 -0.786
576 1HB LYS 70 2HB LYS 70 12.840 -11.405 -1.874
577 2HB LYS 70 1HB LYS 70 13.467 -10.101 -0.863
578 1HG LYS 70 2HG LYS 70 11.869 -10.696 0.915
579 2HG LYS 70 1HG LYS 70 11.220 -11.990 -0.094
580 1HD LYS 70 2HD LYS 70 13.672 -12.844 -0.198
581 2HD LYS 70 1HD LYS 70 13.937 -11.796 1.197
582 1HE LYS 70 2HE LYS 70 11.867 -12.953 2.222
583 2HE LYS 70 1HE LYS 70 12.086 -14.169 0.963
584 1HZ LYS 70 2HZ LYS 70 14.370 -14.479 1.739
585 2HZ LYS 70 1HZ LYS 70 14.104 -13.356 2.985
586 3HZ LYS 70 3HZ LYS 70 13.241 -14.815 2.963
587 H LYS 71 H LYS 71 12.324 -9.950 -4.016
588 HA LYS 71 HA LYS 71 13.684 -7.339 -4.130
589 1HB LYS 71 2HB LYS 71 13.229 -9.590 -6.102
590 2HB LYS 71 1HB LYS 71 13.881 -8.039 -6.631
591 1HG LYS 71 2HG LYS 71 15.892 -8.957 -6.091
592 2HG LYS 71 1HG LYS 71 15.439 -8.539 -4.438
593 1HD LYS 71 2HD LYS 71 14.283 -11.084 -5.338
594 2HD LYS 71 1HD LYS 71 16.047 -11.087 -5.331
595 1HE LYS 71 2HE LYS 71 14.819 -9.838 -2.954
596 2HE LYS 71 1HE LYS 71 14.499 -11.564 -3.122
597 1HZ LYS 71 2HZ LYS 71 17.188 -10.302 -3.228
598 2HZ LYS 71 1HZ LYS 71 16.543 -11.124 -1.888
599 3HZ LYS 71 3HZ LYS 71 16.858 -11.966 -3.326
600 H ILE 72 H ILE 72 12.836 -5.488 -5.241
601 HA ILE 72 HA ILE 72 10.186 -5.796 -6.528
602 HB ILE 72 HB ILE 72 10.749 -3.926 -4.202
603 1HG1 ILE 72 2HG1 ILE 72 8.568 -5.998 -4.353
604 2HG1 ILE 72 1HG1 ILE 72 10.195 -6.458 -3.860
605 1HG2 ILE 72 3HG2 ILE 72 8.357 -4.164 -6.037
606 2HG2 ILE 72 2HG2 ILE 72 8.279 -3.391 -4.455
607 3HG2 ILE 72 1HG2 ILE 72 9.327 -2.728 -5.707
608 1HD1 ILE 72 3HD1 ILE 72 9.382 -4.048 -2.487
609 2HD1 ILE 72 2HD1 ILE 72 8.196 -5.329 -2.238
610 3HD1 ILE 72 1HD1 ILE 72 9.885 -5.596 -1.811
611 H GLU 73 H GLU 73 9.510 -3.653 -7.545
612 HA GLU 73 HA GLU 73 11.787 -1.895 -8.220
613 1HB GLU 73 2HB GLU 73 10.230 -3.600 -10.183
614 2HB GLU 73 1HB GLU 73 10.981 -2.089 -10.694
615 1HG GLU 73 2HG GLU 73 12.919 -3.206 -10.944
616 2HG GLU 73 1HG GLU 73 12.951 -3.445 -9.198
617 H VAL 74 H VAL 74 10.272 -0.683 -6.714
618 HA VAL 74 HA VAL 74 7.607 0.025 -7.345
619 HB VAL 74 HB VAL 74 8.964 2.357 -6.298
620 1HG1 VAL 74 1HG1 VAL 74 6.560 1.465 -6.027
621 2HG1 VAL 74 3HG1 VAL 74 7.238 0.471 -4.737
622 3HG1 VAL 74 2HG1 VAL 74 7.333 2.230 -4.639
623 1HG2 VAL 74 1HG2 VAL 74 9.703 -0.292 -5.079
624 2HG2 VAL 74 3HG2 VAL 74 10.729 1.108 -5.390
625 3HG2 VAL 74 2HG2 VAL 74 9.558 1.149 -4.077
626 H GLU 75 H GLU 75 7.057 0.653 -9.388
627 HA GLU 75 HA GLU 75 8.783 2.562 -10.847
628 1HB GLU 75 2HB GLU 75 6.971 0.501 -11.604
629 2HB GLU 75 1HB GLU 75 6.314 2.017 -12.216
630 1HG GLU 75 2HG GLU 75 7.827 1.976 -13.880
631 2HG GLU 75 1HG GLU 75 9.115 2.089 -12.683
632 H PHE 76 H PHE 76 8.492 4.502 -9.666
633 HA PHE 76 HA PHE 76 5.773 5.674 -9.918
634 1HB PHE 76 2HB PHE 76 5.853 6.622 -7.730
635 2HB PHE 76 1HB PHE 76 6.286 4.928 -7.556
636 HD1 PHE 76 HD2 PHE 76 8.752 4.301 -7.382
637 HD2 PHE 76 HD1 PHE 76 7.324 8.337 -7.025
638 HE1 PHE 76 HE2 PHE 76 10.860 4.947 -6.252
639 HE2 PHE 76 HE1 PHE 76 9.430 8.982 -5.891
640 HZ PHE 76 HZ PHE 76 11.202 7.287 -5.507
641 H ASP 77 H ASP 77 5.749 7.567 -10.897
642 HA ASP 77 HA ASP 77 8.052 8.776 -12.067
643 1HB ASP 77 2HB ASP 77 6.522 10.502 -12.817
644 2HB ASP 77 1HB ASP 77 5.677 8.961 -12.898
645 H LYS 78 H LYS 78 7.727 11.532 -11.632
646 HA LYS 78 HA LYS 78 9.402 12.126 -9.474
647 1HB LYS 78 2HB LYS 78 8.459 13.659 -11.375
648 2HB LYS 78 1HB LYS 78 7.182 14.020 -10.216
649 1HG LYS 78 2HG LYS 78 8.544 15.326 -8.970
650 2HG LYS 78 1HG LYS 78 9.847 14.139 -9.012
651 1HD LYS 78 2HD LYS 78 10.643 16.113 -10.145
652 2HD LYS 78 1HD LYS 78 10.337 14.891 -11.377
653 1HE LYS 78 2HE LYS 78 7.939 16.441 -10.845
654 2HE LYS 78 1HE LYS 78 9.280 17.491 -11.300
655 1HZ LYS 78 1HZ LYS 78 9.670 16.008 -13.220
656 2HZ LYS 78 3HZ LYS 78 8.266 15.147 -12.813
657 3HZ LYS 78 2HZ LYS 78 8.157 16.780 -13.267
658 H GLY 79 H GLY 79 9.059 12.699 -7.294
659 1HA GLY 79 2HA GLY 79 7.261 11.339 -5.714
660 2HA GLY 79 1HA GLY 79 7.949 12.887 -5.229
661 H GLN 80 H GLN 80 5.120 11.262 -6.291
662 HA GLN 80 HA GLN 80 3.626 13.664 -6.995
663 1HB GLN 80 2HB GLN 80 1.835 12.230 -7.506
664 2HB GLN 80 1HB GLN 80 3.238 11.228 -7.851
665 1HG GLN 80 2HG GLN 80 1.884 11.157 -5.147
666 2HG GLN 80 1HG GLN 80 1.318 10.168 -6.486
667 1HE2 GLN 80 2HE2 GLN 80 4.065 7.906 -6.332
668 2HE2 GLN 80 1HE2 GLN 80 2.754 8.440 -7.271
669 H ARG 81 H ARG 81 3.872 11.481 -4.218
670 HA ARG 81 HA ARG 81 2.701 11.562 -2.145
671 1HB ARG 81 2HB ARG 81 3.799 13.342 -0.799
672 2HB ARG 81 1HB ARG 81 4.934 12.452 -1.808
673 1HG ARG 81 2HG ARG 81 5.616 14.411 -2.674
674 2HG ARG 81 1HG ARG 81 4.026 14.593 -3.406
675 1HD ARG 81 2HD ARG 81 3.701 15.295 -0.692
676 2HD ARG 81 1HD ARG 81 5.193 16.075 -1.217
677 HE ARG 81 HE ARG 81 3.414 16.635 -3.263
678 1HH1 ARG 81 2HH1 ARG 81 1.279 16.455 -1.150
679 2HH1 ARG 81 1HH1 ARG 81 1.213 18.084 -0.568
680 1HH2 ARG 81 1HH2 ARG 81 4.272 18.983 -1.951
681 2HH2 ARG 81 2HH2 ARG 81 2.912 19.519 -1.022
682 H THR 82 H THR 82 0.717 12.249 -3.830
683 HA THR 82 HA THR 82 -0.830 14.207 -2.260
684 HB THR 82 HB THR 82 0.233 14.750 -4.931
685 HG1 THR 82 HG1 THR 82 1.041 16.161 -3.609
686 1HG2 THR 82 2HG2 THR 82 -2.544 15.498 -4.053
687 2HG2 THR 82 1HG2 THR 82 -1.670 16.436 -5.262
688 3HG2 THR 82 3HG2 THR 82 -2.057 14.744 -5.570
689 H ASP 83 H ASP 83 -2.853 13.509 -2.156
690 HA ASP 83 HA ASP 83 -4.756 12.747 -3.906
691 1HB ASP 83 2HB ASP 83 -3.465 11.097 -5.057
692 2HB ASP 83 1HB ASP 83 -2.853 10.411 -3.555
693 H LYS 84 H LYS 84 -3.593 10.272 -1.629
694 HA LYS 84 HA LYS 84 -5.870 10.941 0.168
695 1HB LYS 84 2HB LYS 84 -5.339 8.520 -0.833
696 2HB LYS 84 1HB LYS 84 -4.198 8.469 0.509
697 1HG LYS 84 2HG LYS 84 -6.927 9.448 1.159
698 2HG LYS 84 1HG LYS 84 -6.794 7.736 0.756
699 1HD LYS 84 2HD LYS 84 -6.168 7.432 2.909
700 2HD LYS 84 1HD LYS 84 -4.627 8.147 2.436
701 1HE LYS 84 2HE LYS 84 -5.695 10.422 2.915
702 2HE LYS 84 1HE LYS 84 -7.006 9.531 3.688
703 1HZ LYS 84 2HZ LYS 84 -4.146 9.206 4.408
704 2HZ LYS 84 1HZ LYS 84 -5.208 10.253 5.220
705 3HZ LYS 84 3HZ LYS 84 -5.493 8.582 5.233
706 H TYR 85 H TYR 85 -4.696 12.769 1.031
707 HA TYR 85 HA TYR 85 -3.367 13.800 2.662
708 1HB TYR 85 2HB TYR 85 -3.496 12.447 4.486
709 2HB TYR 85 1HB TYR 85 -3.493 10.995 3.502
710 HD1 TYR 85 HD1 TYR 85 -1.382 9.845 2.956
711 HD2 TYR 85 HD2 TYR 85 -1.443 13.365 5.419
712 HE1 TYR 85 HE1 TYR 85 0.935 9.368 3.694
713 HE2 TYR 85 HE2 TYR 85 0.875 12.888 6.155
714 HH TYR 85 HH TYR 85 2.301 10.271 6.162
715 H GLY 86 H GLY 86 -2.536 12.589 -0.099
716 1HA GLY 86 2HA GLY 86 -0.705 12.897 -1.496
717 2HA GLY 86 1HA GLY 86 0.173 13.650 -0.165
718 H ARG 87 H ARG 87 -1.205 10.477 -0.988
719 HA ARG 87 HA ARG 87 0.952 9.076 0.422
720 1HB ARG 87 2HB ARG 87 -1.692 8.523 -0.036
721 2HB ARG 87 1HB ARG 87 -0.902 7.520 -1.253
722 1HG ARG 87 2HG ARG 87 0.421 6.398 0.407
723 2HG ARG 87 1HG ARG 87 -0.057 7.551 1.653
724 1HD ARG 87 2HD ARG 87 -1.381 5.557 1.969
725 2HD ARG 87 1HD ARG 87 -2.440 6.804 1.320
726 HE ARG 87 HE ARG 87 -1.472 5.427 -0.923
727 1HH1 ARG 87 1HH2 ARG 87 -4.292 5.499 0.567
728 2HH1 ARG 87 2HH2 ARG 87 -4.651 3.806 0.524
729 1HH2 ARG 87 2HH1 ARG 87 -1.429 2.879 -0.365
730 2HH2 ARG 87 1HH1 ARG 87 -3.024 2.323 -0.011
731 H VAL 88 H VAL 88 1.927 7.143 -0.797
732 HA VAL 88 HA VAL 88 3.247 8.200 -3.187
733 HB VAL 88 HB VAL 88 3.558 5.463 -1.939
734 1HG1 VAL 88 3HG1 VAL 88 5.390 7.201 -3.628
735 2HG1 VAL 88 2HG1 VAL 88 5.822 5.630 -2.953
736 3HG1 VAL 88 1HG1 VAL 88 4.554 5.748 -4.174
737 1HG2 VAL 88 2HG2 VAL 88 4.840 8.118 -1.230
738 2HG2 VAL 88 1HG2 VAL 88 3.959 7.027 -0.160
739 3HG2 VAL 88 3HG2 VAL 88 5.546 6.567 -0.775
740 H LEU 89 H LEU 89 1.372 8.233 -4.613
741 HA LEU 89 HA LEU 89 -0.083 5.814 -5.270
742 1HB LEU 89 2HB LEU 89 0.267 8.153 -7.150
743 2HB LEU 89 1HB LEU 89 -1.101 7.054 -7.023
744 HG LEU 89 HG LEU 89 -0.305 9.275 -5.138
745 1HD1 LEU 89 3HD1 LEU 89 -2.117 9.010 -7.271
746 2HD1 LEU 89 2HD1 LEU 89 -3.104 8.955 -5.810
747 3HD1 LEU 89 1HD1 LEU 89 -2.040 10.330 -6.104
748 1HD2 LEU 89 1HD2 LEU 89 -0.967 6.927 -4.069
749 2HD2 LEU 89 3HD2 LEU 89 -1.641 8.424 -3.430
750 3HD2 LEU 89 2HD2 LEU 89 -2.593 7.428 -4.529
751 H ALA 90 H ALA 90 1.522 4.206 -5.703
752 HA ALA 90 HA ALA 90 2.613 4.346 -8.433
753 1HB ALA 90 1HB ALA 90 4.366 5.412 -7.074
754 2HB ALA 90 3HB ALA 90 4.422 3.991 -6.032
755 3HB ALA 90 2HB ALA 90 4.914 3.865 -7.720
756 H TYR 91 H TYR 91 3.246 2.325 -9.243
757 HA TYR 91 HA TYR 91 1.889 0.031 -8.041
758 1HB TYR 91 2HB TYR 91 3.684 0.183 -10.475
759 2HB TYR 91 1HB TYR 91 2.672 -1.189 -10.027
760 HD1 TYR 91 HD1 TYR 91 0.187 -0.967 -10.022
761 HD2 TYR 91 HD2 TYR 91 2.758 2.140 -11.498
762 HE1 TYR 91 HE1 TYR 91 -1.749 0.090 -11.155
763 HE2 TYR 91 HE2 TYR 91 0.829 3.196 -12.631
764 HH TYR 91 HH TYR 91 -1.796 3.162 -12.220
765 H ILE 92 H ILE 92 3.072 -2.067 -7.761
766 HA ILE 92 HA ILE 92 5.922 -1.743 -6.932
767 HB ILE 92 HB ILE 92 4.070 -3.327 -5.168
768 1HG1 ILE 92 2HG1 ILE 92 3.036 -1.029 -5.484
769 2HG1 ILE 92 1HG1 ILE 92 3.488 -1.415 -3.825
770 1HG2 ILE 92 3HG2 ILE 92 6.714 -1.924 -4.948
771 2HG2 ILE 92 2HG2 ILE 92 5.777 -2.260 -3.492
772 3HG2 ILE 92 1HG2 ILE 92 6.293 -3.586 -4.533
773 1HD1 ILE 92 2HD1 ILE 92 5.644 -0.161 -5.380
774 2HD1 ILE 92 1HD1 ILE 92 4.233 0.871 -5.157
775 3HD1 ILE 92 3HD1 ILE 92 5.070 0.206 -3.756
776 H TYR 93 H TYR 93 6.712 -3.174 -8.514
777 HA TYR 93 HA TYR 93 5.399 -5.855 -8.683
778 1HB TYR 93 2HB TYR 93 7.594 -5.192 -10.569
779 2HB TYR 93 1HB TYR 93 6.079 -6.040 -10.857
780 HD1 TYR 93 HD2 TYR 93 3.905 -4.486 -10.458
781 HD2 TYR 93 HD1 TYR 93 7.827 -3.133 -11.526
782 HE1 TYR 93 HE2 TYR 93 2.942 -2.400 -11.368
783 HE2 TYR 93 HE1 TYR 93 6.871 -1.049 -12.434
784 HH TYR 93 HH TYR 93 3.748 -0.651 -13.226
785 H ALA 94 H ALA 94 6.343 -7.427 -7.556
786 HA ALA 94 HA ALA 94 8.989 -7.092 -6.452
787 1HB ALA 94 3HB ALA 94 6.723 -8.486 -5.690
788 2HB ALA 94 2HB ALA 94 7.811 -9.763 -6.233
789 3HB ALA 94 1HB ALA 94 8.319 -8.654 -4.959
790 H ASP 95 H ASP 95 10.773 -7.654 -7.477
791 HA ASP 95 HA ASP 95 12.260 -8.594 -9.032
792 1HB ASP 95 2HB ASP 95 11.126 -10.653 -7.672
793 2HB ASP 95 1HB ASP 95 10.633 -11.066 -9.314
794 H GLY 96 H GLY 96 9.961 -7.045 -10.040
795 1HA GLY 96 2HA GLY 96 9.624 -6.436 -12.376
796 2HA GLY 96 1HA GLY 96 9.876 -8.128 -12.817
797 H LYS 97 H LYS 97 8.249 -9.340 -10.902
798 HA LYS 97 HA LYS 97 6.114 -10.141 -10.692
799 1HB LYS 97 2HB LYS 97 6.243 -7.686 -9.540
800 2HB LYS 97 1HB LYS 97 4.892 -7.457 -10.645
801 1HG LYS 97 2HG LYS 97 3.938 -8.307 -8.637
802 2HG LYS 97 1HG LYS 97 3.966 -9.662 -9.764
803 1HD LYS 97 2HD LYS 97 6.443 -9.418 -8.215
804 2HD LYS 97 1HD LYS 97 5.029 -9.684 -7.204
805 1HE LYS 97 2HE LYS 97 4.768 -11.815 -7.929
806 2HE LYS 97 1HE LYS 97 5.074 -11.372 -9.607
807 1HZ LYS 97 3HZ LYS 97 7.442 -11.288 -9.109
808 2HZ LYS 97 2HZ LYS 97 7.136 -11.740 -7.500
809 3HZ LYS 97 1HZ LYS 97 6.803 -12.821 -8.768
810 H MET 98 H MET 98 4.828 -7.248 -12.317
811 HA MET 98 HA MET 98 4.676 -8.264 -14.960
812 1HB MET 98 2HB MET 98 2.439 -9.288 -14.928
813 2HB MET 98 1HB MET 98 3.531 -10.155 -13.851
814 1HG MET 98 2HG MET 98 2.679 -8.797 -11.938
815 2HG MET 98 1HG MET 98 1.514 -8.041 -13.025
816 1HE MET 98 2HE MET 98 -0.745 -8.643 -12.541
817 2HE MET 98 1HE MET 98 -1.229 -10.070 -11.630
818 3HE MET 98 3HE MET 98 -0.068 -8.928 -10.939
819 H VAL 99 H VAL 99 2.850 -6.594 -12.387
820 HA VAL 99 HA VAL 99 0.988 -5.173 -13.907
821 HB VAL 99 HB VAL 99 2.473 -4.231 -11.432
822 1HG1 VAL 99 2HG1 VAL 99 -0.068 -3.245 -12.747
823 2HG1 VAL 99 1HG1 VAL 99 0.450 -2.796 -11.121
824 3HG1 VAL 99 3HG1 VAL 99 1.424 -2.333 -12.516
825 1HG2 VAL 99 2HG2 VAL 99 -0.100 -5.759 -11.891
826 2HG2 VAL 99 1HG2 VAL 99 1.317 -6.289 -10.985
827 3HG2 VAL 99 3HG2 VAL 99 0.301 -4.993 -10.354
828 H ASN 100 H ASN 100 4.447 -4.578 -13.660
829 HA ASN 100 HA ASN 100 4.565 -1.911 -14.633
830 1HB ASN 100 2HB ASN 100 6.841 -2.455 -15.392
831 2HB ASN 100 1HB ASN 100 6.550 -3.152 -13.804
832 1HD2 ASN 100 2HD2 ASN 100 7.473 -5.587 -16.879
833 2HD2 ASN 100 1HD2 ASN 100 7.524 -3.896 -17.014
834 H GLU 101 H GLU 101 4.363 -4.996 -16.414
835 HA GLU 101 HA GLU 101 4.351 -3.673 -19.022
836 1HB GLU 101 2HB GLU 101 5.249 -6.011 -18.561
837 2HB GLU 101 1HB GLU 101 3.572 -6.532 -18.406
838 1HG GLU 101 2HG GLU 101 3.946 -4.937 -20.807
839 2HG GLU 101 1HG GLU 101 5.044 -6.316 -20.788
840 H ALA 102 H ALA 102 1.959 -4.958 -16.755
841 HA ALA 102 HA ALA 102 -0.330 -5.172 -18.338
842 1HB ALA 102 2HB ALA 102 -0.210 -5.651 -15.884
843 2HB ALA 102 1HB ALA 102 -0.237 -3.913 -15.581
844 3HB ALA 102 3HB ALA 102 -1.625 -4.699 -16.333
845 H LEU 103 HN LEU 103 -1.356 -3.767 -19.646
846 HA LEU 103 HA LEU 103 -0.681 -0.902 -19.561
847 1HB LEU 103 2HB LEU 103 -2.499 -2.479 -21.414
848 2HB LEU 103 1HB LEU 103 -2.077 -0.779 -21.618
849 HG LEU 103 HG LEU 103 0.396 -1.979 -21.303
850 1HD1 LEU 103 2HD1 LEU 103 -1.466 -3.814 -22.833
851 2HD1 LEU 103 1HD1 LEU 103 0.287 -3.845 -23.035
852 3HD1 LEU 103 3HD1 LEU 103 -0.427 -4.226 -21.468
853 1HD2 LEU 103 1HD2 LEU 103 -1.158 -1.383 -23.843
854 2HD2 LEU 103 3HD2 LEU 103 -0.154 -0.248 -22.941
855 3HD2 LEU 103 2HD2 LEU 103 0.589 -1.616 -23.767
No H/Q in entry = 855
Start of MODEL 6
Raw file had 866 H/Q atoms
Start of MODEL 6
1 1H ALA 1 3H ALA 1 5.634 20.935 -17.275
2 2H ALA 1 2H ALA 1 6.023 21.488 -18.834
3 3H ALA 1 1H ALA 1 5.109 20.070 -18.637
4 HA ALA 1 HA ALA 1 7.370 19.506 -19.218
5 1HB ALA 1 2HB ALA 1 8.052 21.052 -16.697
6 2HB ALA 1 1HB ALA 1 9.195 20.114 -17.658
7 3HB ALA 1 3HB ALA 1 8.433 21.549 -18.345
8 H THR 2 H THR 2 7.373 17.359 -18.788
9 HA THR 2 HA THR 2 7.223 16.414 -15.992
10 HB THR 2 HB THR 2 4.857 16.547 -16.773
11 HG1 THR 2 HG1 THR 2 4.970 14.960 -15.379
12 1HG2 THR 2 2HG2 THR 2 5.660 15.970 -19.216
13 2HG2 THR 2 1HG2 THR 2 5.412 14.306 -18.688
14 3HG2 THR 2 3HG2 THR 2 4.068 15.448 -18.664
15 H SER 3 H SER 3 9.403 16.384 -17.784
16 HA SER 3 HA SER 3 9.565 13.585 -18.762
17 1HB SER 3 2HB SER 3 11.280 16.032 -19.238
18 2HB SER 3 1HB SER 3 11.754 14.422 -19.772
19 HG SER 3 HG SER 3 9.667 16.075 -20.638
20 H THR 4 H THR 4 9.537 13.897 -15.960
21 HA THR 4 HA THR 4 12.266 12.921 -15.285
22 HB THR 4 HB THR 4 12.153 14.223 -13.127
23 HG1 THR 4 HG1 THR 4 10.131 15.679 -14.477
24 1HG2 THR 4 1HG2 THR 4 13.453 14.957 -15.157
25 2HG2 THR 4 3HG2 THR 4 12.082 15.977 -15.594
26 3HG2 THR 4 2HG2 THR 4 12.963 16.276 -14.096
27 H LYS 5 H LYS 5 8.935 13.403 -14.058
28 HA LYS 5 HA LYS 5 9.204 10.921 -12.436
29 1HB LYS 5 2HB LYS 5 6.792 12.739 -12.483
30 2HB LYS 5 1HB LYS 5 7.324 11.663 -11.196
31 1HG LYS 5 2HG LYS 5 8.880 14.104 -12.099
32 2HG LYS 5 1HG LYS 5 7.759 14.102 -10.739
33 1HD LYS 5 2HD LYS 5 9.089 12.305 -9.663
34 2HD LYS 5 1HD LYS 5 10.231 12.365 -11.006
35 1HE LYS 5 2HE LYS 5 11.324 13.866 -9.677
36 2HE LYS 5 1HE LYS 5 10.138 14.999 -10.321
37 1HZ LYS 5 1HZ LYS 5 9.764 13.413 -7.838
38 2HZ LYS 5 3HZ LYS 5 10.291 15.025 -7.874
39 3HZ LYS 5 2HZ LYS 5 8.737 14.629 -8.433
40 H LYS 6 H LYS 6 8.563 9.054 -13.457
41 HA LYS 6 HA LYS 6 6.053 9.133 -14.997
42 1HB LYS 6 2HB LYS 6 7.021 7.897 -16.920
43 2HB LYS 6 1HB LYS 6 7.688 9.513 -16.744
44 1HG LYS 6 2HG LYS 6 9.058 7.029 -15.676
45 2HG LYS 6 1HG LYS 6 9.379 7.703 -17.264
46 1HD LYS 6 2HD LYS 6 9.586 9.917 -15.613
47 2HD LYS 6 1HD LYS 6 10.294 8.629 -14.639
48 1HE LYS 6 2HE LYS 6 12.115 8.478 -15.975
49 2HE LYS 6 1HE LYS 6 11.139 8.519 -17.443
50 1HZ LYS 6 1HZ LYS 6 10.877 10.969 -16.992
51 2HZ LYS 6 3HZ LYS 6 12.107 10.808 -15.835
52 3HZ LYS 6 2HZ LYS 6 12.428 10.462 -17.466
53 H LEU 7 H LEU 7 8.687 6.840 -14.056
54 HA LEU 7 HA LEU 7 7.203 5.249 -12.329
55 1HB LEU 7 2HB LEU 7 6.036 4.971 -14.827
56 2HB LEU 7 1HB LEU 7 7.124 3.589 -14.763
57 HG LEU 7 HG LEU 7 6.156 3.210 -12.385
58 1HD1 LEU 7 1HD1 LEU 7 4.023 4.982 -13.611
59 2HD1 LEU 7 3HD1 LEU 7 3.807 4.009 -12.156
60 3HD1 LEU 7 2HD1 LEU 7 4.971 5.334 -12.166
61 1HD2 LEU 7 1HD2 LEU 7 5.728 1.736 -14.325
62 2HD2 LEU 7 3HD2 LEU 7 4.290 1.895 -13.317
63 3HD2 LEU 7 2HD2 LEU 7 4.410 2.793 -14.831
64 H HIS 8 H HIS 8 9.708 5.731 -12.022
65 HA HIS 8 HA HIS 8 11.464 3.753 -13.307
66 1HB HIS 8 2HB HIS 8 11.819 6.190 -11.706
67 2HB HIS 8 1HB HIS 8 12.925 4.895 -11.251
68 HD1 HIS 8 HD1 HIS 8 14.940 4.628 -12.705
69 HD2 HIS 8 HD2 HIS 8 11.890 6.688 -14.663
70 HE1 HIS 8 HE1 HIS 8 15.886 5.356 -14.939
71 H LYS 9 H LYS 9 12.293 1.949 -12.267
72 HA LYS 9 HA LYS 9 10.817 1.055 -9.868
73 1HB LYS 9 2HB LYS 9 12.454 -1.054 -10.573
74 2HB LYS 9 1HB LYS 9 10.788 -0.836 -11.094
75 1HG LYS 9 2HG LYS 9 11.447 0.118 -13.169
76 2HG LYS 9 1HG LYS 9 13.100 0.381 -12.612
77 1HD LYS 9 2HD LYS 9 13.185 -1.545 -14.031
78 2HD LYS 9 1HD LYS 9 13.297 -2.151 -12.380
79 1HE LYS 9 2HE LYS 9 11.695 -3.560 -13.405
80 2HE LYS 9 1HE LYS 9 10.730 -2.403 -12.492
81 1HZ LYS 9 2HZ LYS 9 11.380 -2.206 -15.385
82 2HZ LYS 9 1HZ LYS 9 9.886 -2.694 -14.739
83 3HZ LYS 9 3HZ LYS 9 10.432 -1.106 -14.504
84 H GLU 10 H GLU 10 11.863 0.190 -7.975
85 HA GLU 10 HA GLU 10 14.747 0.368 -7.626
86 1HB GLU 10 2HB GLU 10 13.751 2.797 -7.407
87 2HB GLU 10 1HB GLU 10 13.154 2.216 -5.853
88 1HG GLU 10 2HG GLU 10 16.038 1.802 -6.610
89 2HG GLU 10 1HG GLU 10 15.511 3.354 -5.963
90 HA PRO 11 HA PRO 11 13.247 -3.022 -5.177
91 1HB PRO 11 2HB PRO 11 15.746 -2.784 -3.663
92 2HB PRO 11 1HB PRO 11 15.150 -4.124 -4.655
93 1HG PRO 11 2HG PRO 11 17.180 -2.291 -5.375
94 2HG PRO 11 1HG PRO 11 16.385 -3.454 -6.444
95 1HD PRO 11 2HD PRO 11 16.134 -0.569 -6.455
96 2HD PRO 11 1HD PRO 11 15.374 -1.739 -7.554
97 H ALA 12 H ALA 12 12.141 -3.144 -3.310
98 HA ALA 12 HA ALA 12 12.463 -0.985 -1.262
99 1HB ALA 12 2HB ALA 12 10.397 -0.941 -2.863
100 2HB ALA 12 1HB ALA 12 9.811 -2.257 -1.851
101 3HB ALA 12 3HB ALA 12 10.151 -0.682 -1.138
102 H THR 13 H THR 13 10.401 -2.155 0.450
103 HA THR 13 HA THR 13 11.397 -4.882 1.047
104 HB THR 13 HB THR 13 12.828 -3.591 2.478
105 HG1 THR 13 HG1 THR 13 10.619 -4.199 4.132
106 1HG2 THR 13 2HG2 THR 13 10.352 -2.045 3.291
107 2HG2 THR 13 1HG2 THR 13 11.960 -1.833 3.982
108 3HG2 THR 13 3HG2 THR 13 11.669 -1.438 2.288
109 H LEU 14 H LEU 14 9.555 -6.052 1.061
110 HA LEU 14 HA LEU 14 6.952 -4.966 1.169
111 1HB LEU 14 2HB LEU 14 6.136 -7.222 1.335
112 2HB LEU 14 1HB LEU 14 7.558 -7.244 0.296
113 HG LEU 14 HG LEU 14 8.669 -7.636 2.785
114 1HD1 LEU 14 2HD1 LEU 14 6.117 -7.891 3.459
115 2HD1 LEU 14 1HD1 LEU 14 6.319 -9.502 2.771
116 3HD1 LEU 14 3HD1 LEU 14 7.328 -8.986 4.123
117 1HD2 LEU 14 2HD2 LEU 14 7.703 -9.592 0.691
118 2HD2 LEU 14 1HD2 LEU 14 9.325 -8.926 0.885
119 3HD2 LEU 14 3HD2 LEU 14 8.701 -10.083 2.060
120 H ILE 15 H ILE 15 5.941 -4.003 2.815
121 HA ILE 15 HA ILE 15 6.568 -4.962 5.575
122 HB ILE 15 HB ILE 15 5.158 -2.351 5.159
123 1HG1 ILE 15 2HG1 ILE 15 8.173 -2.527 4.993
124 2HG1 ILE 15 1HG1 ILE 15 7.161 -2.458 3.551
125 1HG2 ILE 15 1HG2 ILE 15 5.601 -3.309 7.411
126 2HG2 ILE 15 3HG2 ILE 15 7.331 -3.253 7.069
127 3HG2 ILE 15 2HG2 ILE 15 6.404 -1.756 7.173
128 1HD1 ILE 15 3HD1 ILE 15 6.067 -0.389 4.671
129 2HD1 ILE 15 2HD1 ILE 15 7.492 -0.380 5.708
130 3HD1 ILE 15 1HD1 ILE 15 7.671 -0.194 3.965
131 H LYS 16 H LYS 16 4.699 -6.267 3.809
132 HA LYS 16 HA LYS 16 2.638 -7.348 4.086
133 1HB LYS 16 2HB LYS 16 3.067 -6.282 6.618
134 2HB LYS 16 1HB LYS 16 1.488 -5.643 6.161
135 1HG LYS 16 2HG LYS 16 2.040 -8.536 5.625
136 2HG LYS 16 1HG LYS 16 1.727 -8.047 7.290
137 1HD LYS 16 2HD LYS 16 -0.477 -8.005 6.845
138 2HD LYS 16 1HD LYS 16 -0.197 -6.726 5.664
139 1HE LYS 16 2HE LYS 16 -1.213 -8.417 4.382
140 2HE LYS 16 1HE LYS 16 0.505 -8.656 4.069
141 1HZ LYS 16 3HZ LYS 16 -0.977 -10.095 6.197
142 2HZ LYS 16 2HZ LYS 16 -0.765 -10.712 4.629
143 3HZ LYS 16 1HZ LYS 16 0.584 -10.425 5.620
144 H ALA 17 H ALA 17 0.858 -7.038 2.852
145 HA ALA 17 HA ALA 17 0.250 -4.281 1.932
146 1HB ALA 17 3HB ALA 17 -0.681 -7.003 0.959
147 2HB ALA 17 2HB ALA 17 -1.173 -5.468 0.243
148 3HB ALA 17 1HB ALA 17 0.518 -5.965 0.187
149 H ILE 18 H ILE 18 -1.385 -3.187 2.752
150 HA ILE 18 HA ILE 18 -3.133 -4.239 4.786
151 HB ILE 18 HB ILE 18 -3.009 -1.682 3.190
152 1HG1 ILE 18 2HG1 ILE 18 -2.843 -1.181 5.936
153 2HG1 ILE 18 1HG1 ILE 18 -1.952 -2.688 5.719
154 1HG2 ILE 18 1HG2 ILE 18 -5.279 -2.743 4.683
155 2HG2 ILE 18 3HG2 ILE 18 -4.695 -1.238 5.394
156 3HG2 ILE 18 2HG2 ILE 18 -5.177 -1.283 3.699
157 1HD1 ILE 18 2HD1 ILE 18 -0.656 -1.616 3.876
158 2HD1 ILE 18 1HD1 ILE 18 -1.497 -0.100 4.205
159 3HD1 ILE 18 3HD1 ILE 18 -0.431 -0.799 5.423
160 H ASP 19 H ASP 19 -3.902 -2.978 1.509
161 HA ASP 19 HA ASP 19 -6.107 -4.990 1.349
162 1HB ASP 19 2HB ASP 19 -6.187 -2.053 0.580
163 2HB ASP 19 1HB ASP 19 -7.410 -3.218 0.083
164 H GLY 20 H GLY 20 -6.824 -4.084 -1.356
165 1HA GLY 20 2HA GLY 20 -5.066 -5.675 -2.914
166 2HA GLY 20 1HA GLY 20 -6.209 -4.506 -3.577
167 H ASP 21 H ASP 21 -5.480 -2.253 -3.787
168 HA ASP 21 HA ASP 21 -2.686 -2.086 -4.612
169 1HB ASP 21 2HB ASP 21 -4.931 -0.066 -4.503
170 2HB ASP 21 1HB ASP 21 -3.298 0.362 -5.008
171 H THR 22 H THR 22 -4.402 -1.386 -1.655
172 HA THR 22 HA THR 22 -2.549 0.645 -0.710
173 HB THR 22 HB THR 22 -4.460 -1.151 0.814
174 HG1 THR 22 HG1 THR 22 -5.764 0.122 -0.260
175 1HG2 THR 22 1HG2 THR 22 -2.987 1.352 1.661
176 2HG2 THR 22 3HG2 THR 22 -4.228 0.541 2.613
177 3HG2 THR 22 2HG2 THR 22 -2.703 -0.275 2.271
178 H VAL 23 H VAL 23 -0.394 -0.013 -0.452
179 HA VAL 23 HA VAL 23 0.091 -2.503 1.105
180 HB VAL 23 HB VAL 23 2.014 -3.014 -0.437
181 1HG1 VAL 23 2HG1 VAL 23 -0.590 -3.754 -0.597
182 2HG1 VAL 23 1HG1 VAL 23 -0.383 -3.021 -2.187
183 3HG1 VAL 23 3HG1 VAL 23 0.653 -4.359 -1.691
184 1HG2 VAL 23 1HG2 VAL 23 0.708 -0.762 -1.985
185 2HG2 VAL 23 3HG2 VAL 23 2.400 -0.913 -1.512
186 3HG2 VAL 23 2HG2 VAL 23 1.736 -1.965 -2.761
187 H LYS 24 H LYS 24 1.709 -2.390 2.592
188 HA LYS 24 HA LYS 24 2.987 0.236 3.009
189 1HB LYS 24 2HB LYS 24 1.971 -1.392 4.813
190 2HB LYS 24 1HB LYS 24 3.534 -2.193 4.688
191 1HG LYS 24 2HG LYS 24 4.463 -0.614 5.993
192 2HG LYS 24 1HG LYS 24 3.987 0.631 4.838
193 1HD LYS 24 2HD LYS 24 1.762 0.768 5.885
194 2HD LYS 24 1HD LYS 24 2.217 -0.492 7.031
195 1HE LYS 24 2HE LYS 24 2.533 1.600 8.162
196 2HE LYS 24 1HE LYS 24 4.141 1.009 7.745
197 1HZ LYS 24 3HZ LYS 24 2.635 2.863 5.994
198 2HZ LYS 24 2HZ LYS 24 3.658 3.415 7.233
199 3HZ LYS 24 1HZ LYS 24 4.290 2.493 5.955
200 H LEU 25 H LEU 25 4.946 0.668 2.115
201 HA LEU 25 HA LEU 25 6.993 -1.464 1.934
202 1HB LEU 25 2HB LEU 25 5.502 -0.355 -0.356
203 2HB LEU 25 1HB LEU 25 7.253 -0.333 -0.551
204 HG LEU 25 HG LEU 25 5.931 -2.826 0.471
205 1HD1 LEU 25 1HD1 LEU 25 6.062 -1.901 -2.412
206 2HD1 LEU 25 3HD1 LEU 25 5.746 -3.566 -1.925
207 3HD1 LEU 25 2HD1 LEU 25 4.609 -2.289 -1.490
208 1HD2 LEU 25 3HD2 LEU 25 8.514 -2.170 0.085
209 2HD2 LEU 25 2HD2 LEU 25 7.916 -3.811 -0.148
210 3HD2 LEU 25 1HD2 LEU 25 8.132 -2.748 -1.536
211 H MET 26 H MET 26 9.124 -0.642 1.754
212 HA MET 26 HA MET 26 9.363 2.321 2.143
213 1HB MET 26 2HB MET 26 11.568 0.422 2.899
214 2HB MET 26 1HB MET 26 11.168 1.992 3.588
215 1HG MET 26 2HG MET 26 9.167 1.030 4.651
216 2HG MET 26 1HG MET 26 9.539 -0.541 3.943
217 1HE MET 26 3HE MET 26 9.055 0.130 7.011
218 2HE MET 26 2HE MET 26 9.341 -1.501 6.410
219 3HE MET 26 1HE MET 26 10.271 -0.899 7.779
220 H TYR 27 H TYR 27 10.105 3.268 0.278
221 HA TYR 27 HA TYR 27 11.622 1.621 -1.644
222 1HB TYR 27 2HB TYR 27 11.441 3.577 -3.163
223 2HB TYR 27 1HB TYR 27 9.873 3.045 -2.570
224 HD1 TYR 27 HD2 TYR 27 12.456 5.678 -2.358
225 HD2 TYR 27 HD1 TYR 27 8.573 4.410 -1.028
226 HE1 TYR 27 HE2 TYR 27 12.006 7.958 -1.506
227 HE2 TYR 27 HE1 TYR 27 8.121 6.696 -0.181
228 HH TYR 27 HH TYR 27 9.212 9.191 -0.955
229 H LYS 28 H LYS 28 12.952 2.118 0.796
230 HA LYS 28 HA LYS 28 15.008 2.812 1.634
231 1HB LYS 28 2HB LYS 28 15.441 2.593 -1.322
232 2HB LYS 28 1HB LYS 28 16.709 3.342 -0.355
233 1HG LYS 28 2HG LYS 28 17.376 1.146 -0.173
234 2HG LYS 28 1HG LYS 28 16.265 1.208 1.194
235 1HD LYS 28 2HD LYS 28 14.846 0.650 -1.281
236 2HD LYS 28 1HD LYS 28 16.118 -0.537 -0.996
237 1HE LYS 28 2HE LYS 28 14.876 -0.097 1.509
238 2HE LYS 28 1HE LYS 28 13.573 -0.267 0.334
239 1HZ LYS 28 1HZ LYS 28 14.680 -2.304 -0.468
240 2HZ LYS 28 3HZ LYS 28 15.813 -2.161 0.787
241 3HZ LYS 28 2HZ LYS 28 14.173 -2.416 1.149
242 H GLY 29 H GLY 29 13.365 4.724 2.016
243 1HA GLY 29 2HA GLY 29 14.812 7.123 2.132
244 2HA GLY 29 1HA GLY 29 13.860 7.218 0.650
245 H GLN 30 H GLN 30 11.653 5.578 1.837
246 HA GLN 30 HA GLN 30 10.681 7.112 4.128
247 1HB GLN 30 2HB GLN 30 10.328 8.566 2.028
248 2HB GLN 30 1HB GLN 30 9.098 7.388 1.576
249 1HG GLN 30 2HG GLN 30 8.074 7.759 3.879
250 2HG GLN 30 1HG GLN 30 9.164 9.135 4.041
251 1HE2 GLN 30 2HE2 GLN 30 6.391 9.398 0.996
252 2HE2 GLN 30 1HE2 GLN 30 7.132 7.901 1.295
253 HA PRO 31 HA PRO 31 8.980 2.874 4.018
254 1HB PRO 31 2HB PRO 31 8.668 3.069 6.860
255 2HB PRO 31 1HB PRO 31 9.893 2.151 5.977
256 1HG PRO 31 2HG PRO 31 10.261 4.572 7.508
257 2HG PRO 31 1HG PRO 31 11.489 3.624 6.659
258 1HD PRO 31 2HD PRO 31 10.393 6.185 5.902
259 2HD PRO 31 1HD PRO 31 11.637 5.237 5.062
260 H MET 32 H MET 32 6.945 3.447 3.087
261 HA MET 32 HA MET 32 4.843 4.249 5.052
262 1HB MET 32 2HB MET 32 5.067 5.557 2.329
263 2HB MET 32 1HB MET 32 3.959 5.979 3.632
264 1HG MET 32 2HG MET 32 6.931 6.099 4.087
265 2HG MET 32 1HG MET 32 6.106 7.424 3.274
266 1HE MET 32 2HE MET 32 4.656 8.985 4.115
267 2HE MET 32 1HE MET 32 4.594 9.469 5.808
268 3HE MET 32 3HE MET 32 6.141 9.432 4.950
269 H THR 33 H THR 33 2.619 4.253 3.726
270 HA THR 33 HA THR 33 2.554 1.717 2.148
271 HB THR 33 HB THR 33 1.290 1.715 4.334
272 HG1 THR 33 HG1 THR 33 -0.368 1.578 2.038
273 1HG2 THR 33 2HG2 THR 33 0.618 4.139 4.186
274 2HG2 THR 33 1HG2 THR 33 -0.537 3.684 2.935
275 3HG2 THR 33 3HG2 THR 33 -0.711 3.046 4.570
276 H PHE 34 H PHE 34 1.591 1.794 0.088
277 HA PHE 34 HA PHE 34 0.235 4.320 -0.677
278 1HB PHE 34 2HB PHE 34 1.807 3.898 -2.889
279 2HB PHE 34 1HB PHE 34 2.100 5.106 -1.646
280 HD1 PHE 34 HD2 PHE 34 3.734 4.689 0.157
281 HD2 PHE 34 HD1 PHE 34 3.157 1.881 -3.043
282 HE1 PHE 34 HE2 PHE 34 5.906 3.630 0.699
283 HE2 PHE 34 HE1 PHE 34 5.335 0.827 -2.500
284 HZ PHE 34 HZ PHE 34 6.711 1.706 -0.639
285 H ARG 35 H ARG 35 -0.351 4.131 -3.157
286 HA ARG 35 HA ARG 35 -1.226 1.359 -3.829
287 1HB ARG 35 2HB ARG 35 -3.037 3.787 -3.676
288 2HB ARG 35 1HB ARG 35 -3.505 2.242 -4.375
289 1HG ARG 35 2HG ARG 35 -3.367 1.143 -2.274
290 2HG ARG 35 1HG ARG 35 -2.519 2.492 -1.534
291 1HD ARG 35 2HD ARG 35 -5.011 3.372 -2.679
292 2HD ARG 35 1HD ARG 35 -5.306 2.037 -1.581
293 HE ARG 35 HE ARG 35 -4.779 4.707 -0.809
294 1HH1 ARG 35 2HH1 ARG 35 -1.964 3.688 -0.370
295 2HH1 ARG 35 1HH1 ARG 35 -2.035 3.172 1.280
296 1HH2 ARG 35 1HH2 ARG 35 -5.506 3.189 1.418
297 2HH2 ARG 35 2HH2 ARG 35 -4.041 2.902 2.298
298 H LEU 36 H LEU 36 -2.586 1.708 -6.092
299 HA LEU 36 HA LEU 36 -0.733 2.386 -8.122
300 1HB LEU 36 2HB LEU 36 -2.498 1.159 -8.979
301 2HB LEU 36 1HB LEU 36 -3.680 1.949 -7.956
302 HG LEU 36 HG LEU 36 -3.570 3.967 -9.374
303 1HD1 LEU 36 3HD1 LEU 36 -1.134 2.912 -10.215
304 2HD1 LEU 36 2HD1 LEU 36 -2.188 2.700 -11.613
305 3HD1 LEU 36 1HD1 LEU 36 -1.958 4.304 -10.917
306 1HD2 LEU 36 2HD2 LEU 36 -4.418 1.307 -10.299
307 2HD2 LEU 36 1HD2 LEU 36 -5.308 2.828 -10.281
308 3HD2 LEU 36 3HD2 LEU 36 -4.198 2.471 -11.604
309 H LEU 37 H LEU 37 -3.575 4.178 -7.060
310 HA LEU 37 HA LEU 37 -2.137 6.746 -7.212
311 1HB LEU 37 2HB LEU 37 -3.932 7.798 -8.541
312 2HB LEU 37 1HB LEU 37 -3.200 6.481 -9.454
313 HG LEU 37 HG LEU 37 -5.260 5.248 -8.017
314 1HD1 LEU 37 2HD1 LEU 37 -5.847 8.048 -8.279
315 2HD1 LEU 37 1HD1 LEU 37 -6.932 7.144 -9.335
316 3HD1 LEU 37 3HD1 LEU 37 -6.867 6.773 -7.612
317 1HD2 LEU 37 3HD2 LEU 37 -4.363 5.228 -10.539
318 2HD2 LEU 37 2HD2 LEU 37 -5.969 4.629 -10.129
319 3HD2 LEU 37 1HD2 LEU 37 -5.777 6.254 -10.786
320 H LEU 38 H LEU 38 -2.846 5.117 -5.087
321 HA LEU 38 HA LEU 38 -3.811 5.248 -2.981
322 1HB LEU 38 2HB LEU 38 -3.555 7.612 -2.934
323 2HB LEU 38 1HB LEU 38 -4.826 7.857 -4.118
324 HG LEU 38 HG LEU 38 -5.773 6.435 -1.737
325 1HD1 LEU 38 1HD1 LEU 38 -3.897 8.451 -1.221
326 2HD1 LEU 38 3HD1 LEU 38 -5.459 9.243 -1.025
327 3HD1 LEU 38 2HD1 LEU 38 -5.077 7.805 -0.081
328 1HD2 LEU 38 3HD2 LEU 38 -6.884 7.904 -3.742
329 2HD2 LEU 38 2HD2 LEU 38 -7.672 7.644 -2.187
330 3HD2 LEU 38 1HD2 LEU 38 -6.776 9.133 -2.482
331 H VAL 39 H VAL 39 -4.813 3.624 -5.027
332 HA VAL 39 HA VAL 39 -7.458 3.633 -5.783
333 HB VAL 39 HB VAL 39 -5.893 1.326 -4.573
334 1HG1 VAL 39 2HG1 VAL 39 -8.547 1.455 -6.012
335 2HG1 VAL 39 1HG1 VAL 39 -7.531 0.019 -6.142
336 3HG1 VAL 39 3HG1 VAL 39 -8.118 0.545 -4.564
337 1HG2 VAL 39 2HG2 VAL 39 -6.080 2.623 -7.266
338 2HG2 VAL 39 1HG2 VAL 39 -4.690 1.892 -6.464
339 3HG2 VAL 39 3HG2 VAL 39 -5.911 0.868 -7.218
340 H ASP 40 H ASP 40 -8.858 4.716 -4.351
341 HA ASP 40 HA ASP 40 -10.015 3.089 -2.218
342 1HB ASP 40 2HB ASP 40 -8.117 5.261 -1.608
343 2HB ASP 40 1HB ASP 40 -9.665 5.431 -0.782
344 H THR 41 H THR 41 -11.467 3.618 -4.270
345 HA THR 41 HA THR 41 -12.695 6.260 -4.267
346 HB THR 41 HB THR 41 -13.079 3.714 -5.812
347 HG1 THR 41 HG1 THR 41 -11.744 4.965 -6.866
348 1HG2 THR 41 2HG2 THR 41 -15.036 5.997 -5.580
349 2HG2 THR 41 1HG2 THR 41 -14.947 4.994 -7.027
350 3HG2 THR 41 3HG2 THR 41 -15.357 4.264 -5.476
351 HA PRO 42 HA PRO 42 -16.468 3.770 -2.505
352 1HB PRO 42 2HB PRO 42 -15.515 1.348 -1.292
353 2HB PRO 42 1HB PRO 42 -16.621 1.513 -2.663
354 1HG PRO 42 2HG PRO 42 -13.873 0.634 -2.710
355 2HG PRO 42 1HG PRO 42 -14.991 0.782 -4.073
356 1HD PRO 42 2HD PRO 42 -12.743 2.471 -3.440
357 2HD PRO 42 1HD PRO 42 -13.862 2.611 -4.808
358 H GLU 43 H GLU 43 -16.626 5.160 -0.778
359 HA GLU 43 HA GLU 43 -15.239 4.423 1.739
360 1HB GLU 43 2HB GLU 43 -14.621 6.837 2.114
361 2HB GLU 43 1HB GLU 43 -13.739 6.078 0.789
362 1HG GLU 43 2HG GLU 43 -14.532 7.608 -0.658
363 2HG GLU 43 1HG GLU 43 -16.190 7.180 -0.240
364 H THR 44 H THR 44 -18.020 4.291 0.760
365 HA THR 44 HA THR 44 -19.303 5.643 3.045
366 HB THR 44 HB THR 44 -20.245 6.150 0.201
367 HG1 THR 44 HG1 THR 44 -19.040 7.872 2.109
368 1HG2 THR 44 2HG2 THR 44 -21.269 7.017 2.913
369 2HG2 THR 44 1HG2 THR 44 -21.760 7.791 1.407
370 3HG2 THR 44 3HG2 THR 44 -22.129 6.089 1.684
371 H LYS 45 H LYS 45 -21.230 4.575 3.668
372 HA LYS 45 HA LYS 45 -21.559 1.873 2.591
373 1HB LYS 45 2HB LYS 45 -21.810 2.649 5.067
374 2HB LYS 45 1HB LYS 45 -23.427 3.159 4.579
375 1HG LYS 45 2HG LYS 45 -24.157 0.997 4.234
376 2HG LYS 45 1HG LYS 45 -22.553 0.415 3.787
377 1HD LYS 45 2HD LYS 45 -22.484 -0.471 5.872
378 2HD LYS 45 1HD LYS 45 -22.195 1.181 6.418
379 1HE LYS 45 2HE LYS 45 -25.021 0.277 5.968
380 2HE LYS 45 1HE LYS 45 -24.187 -0.227 7.437
381 1HZ LYS 45 3HZ LYS 45 -23.685 2.109 7.889
382 2HZ LYS 45 2HZ LYS 45 -24.552 2.570 6.502
383 3HZ LYS 45 1HZ LYS 45 -25.356 1.833 7.804
384 H HIS 46 H HIS 46 -22.397 2.019 0.519
385 HA HIS 46 HA HIS 46 -25.243 2.618 0.288
386 1HB HIS 46 2HB HIS 46 -23.242 4.585 -0.565
387 2HB HIS 46 1HB HIS 46 -24.335 4.116 -1.868
388 HD1 HIS 46 HD1 HIS 46 -27.008 4.100 -1.028
389 HD2 HIS 46 HD2 HIS 46 -24.334 6.534 1.047
390 HE1 HIS 46 HE1 HIS 46 -28.407 5.810 0.211
391 HA PRO 47 HA PRO 47 -23.685 0.841 -3.925
392 1HB PRO 47 2HB PRO 47 -20.855 0.393 -3.832
393 2HB PRO 47 1HB PRO 47 -21.736 1.516 -4.877
394 1HG PRO 47 2HG PRO 47 -20.055 2.150 -2.611
395 2HG PRO 47 1HG PRO 47 -20.892 3.268 -3.693
396 1HD PRO 47 2HD PRO 47 -21.555 2.637 -0.970
397 2HD PRO 47 1HD PRO 47 -22.410 3.731 -2.071
398 H LYS 48 H LYS 48 -24.446 -1.210 -3.563
399 HA LYS 48 HA LYS 48 -24.531 -3.452 -2.896
400 1HB LYS 48 2HB LYS 48 -21.547 -3.052 -2.506
401 2HB LYS 48 1HB LYS 48 -22.371 -4.610 -2.504
402 1HG LYS 48 2HG LYS 48 -23.192 -4.128 -4.818
403 2HG LYS 48 1HG LYS 48 -22.228 -2.651 -4.814
404 1HD LYS 48 2HD LYS 48 -20.918 -5.274 -4.153
405 2HD LYS 48 1HD LYS 48 -21.217 -4.850 -5.840
406 1HE LYS 48 2HE LYS 48 -20.062 -2.633 -5.365
407 2HE LYS 48 1HE LYS 48 -19.567 -3.317 -3.817
408 1HZ LYS 48 3HZ LYS 48 -18.511 -5.144 -5.029
409 2HZ LYS 48 2HZ LYS 48 -18.943 -4.419 -6.504
410 3HZ LYS 48 1HZ LYS 48 -17.852 -3.642 -5.458
411 H LYS 49 H LYS 49 -23.648 -4.912 -0.866
412 HA LYS 49 HA LYS 49 -24.589 -3.454 1.501
413 1HB LYS 49 2HB LYS 49 -25.073 -5.937 0.810
414 2HB LYS 49 1HB LYS 49 -23.513 -6.262 1.566
415 1HG LYS 49 2HG LYS 49 -24.391 -4.969 3.596
416 2HG LYS 49 1HG LYS 49 -25.982 -5.074 2.843
417 1HD LYS 49 2HD LYS 49 -26.123 -7.048 3.968
418 2HD LYS 49 1HD LYS 49 -25.149 -7.664 2.633
419 1HE LYS 49 2HE LYS 49 -23.267 -6.531 4.343
420 2HE LYS 49 1HE LYS 49 -24.420 -7.292 5.440
421 1HZ LYS 49 3HZ LYS 49 -24.205 -9.345 4.178
422 2HZ LYS 49 2HZ LYS 49 -23.081 -8.609 3.137
423 3HZ LYS 49 1HZ LYS 49 -22.701 -8.842 4.777
424 H GLY 50 H GLY 50 -23.306 -2.645 3.106
425 1HA GLY 50 2HA GLY 50 -20.405 -2.645 2.748
426 2HA GLY 50 1HA GLY 50 -21.292 -1.828 4.035
427 H VAL 51 H VAL 51 -19.071 -4.181 3.575
428 HA VAL 51 HA VAL 51 -19.898 -5.617 6.049
429 HB VAL 51 HB VAL 51 -20.168 -6.846 3.725
430 1HG1 VAL 51 3HG1 VAL 51 -17.657 -6.223 3.254
431 2HG1 VAL 51 2HG1 VAL 51 -17.320 -7.637 4.252
432 3HG1 VAL 51 1HG1 VAL 51 -18.271 -7.805 2.777
433 1HG2 VAL 51 3HG2 VAL 51 -19.748 -7.671 6.380
434 2HG2 VAL 51 2HG2 VAL 51 -20.441 -8.628 5.071
435 3HG2 VAL 51 1HG2 VAL 51 -18.711 -8.710 5.402
436 H GLU 52 H GLU 52 -17.603 -7.153 6.371
437 HA GLU 52 HA GLU 52 -15.692 -5.180 7.302
438 1HB GLU 52 2HB GLU 52 -16.292 -7.857 7.895
439 2HB GLU 52 1HB GLU 52 -14.661 -7.901 7.228
440 1HG GLU 52 2HG GLU 52 -14.850 -5.645 8.985
441 2HG GLU 52 1HG GLU 52 -15.470 -7.061 9.833
442 H LYS 53 H LYS 53 -13.199 -6.247 6.780
443 HA LYS 53 HA LYS 53 -12.492 -5.181 4.264
444 1HB LYS 53 2HB LYS 53 -10.982 -5.826 6.271
445 2HB LYS 53 1HB LYS 53 -10.942 -7.433 5.545
446 1HG LYS 53 2HG LYS 53 -9.999 -6.563 3.499
447 2HG LYS 53 1HG LYS 53 -10.227 -4.900 4.041
448 1HD LYS 53 2HD LYS 53 -7.976 -5.233 4.545
449 2HD LYS 53 1HD LYS 53 -8.737 -5.669 6.075
450 1HE LYS 53 2HE LYS 53 -7.398 -7.528 5.785
451 2HE LYS 53 1HE LYS 53 -8.834 -8.074 4.920
452 1HZ LYS 53 2HZ LYS 53 -6.496 -6.729 3.670
453 2HZ LYS 53 1HZ LYS 53 -6.792 -8.402 3.639
454 3HZ LYS 53 3HZ LYS 53 -7.857 -7.340 2.856
455 H TYR 54 H TYR 54 -12.738 -5.941 2.223
456 HA TYR 54 HA TYR 54 -13.073 -8.883 1.819
457 1HB TYR 54 2HB TYR 54 -15.195 -7.202 1.702
458 2HB TYR 54 1HB TYR 54 -14.620 -7.068 0.041
459 HD1 TYR 54 HD1 TYR 54 -14.413 -9.109 -1.385
460 HD2 TYR 54 HD2 TYR 54 -16.197 -9.227 2.522
461 HE1 TYR 54 HE1 TYR 54 -15.431 -11.307 -1.917
462 HE2 TYR 54 HE2 TYR 54 -17.215 -11.425 1.990
463 HH TYR 54 HH TYR 54 -16.393 -13.416 0.079
464 H GLY 55 H GLY 55 -11.327 -9.460 0.617
465 1HA GLY 55 2HA GLY 55 -10.014 -7.568 -1.198
466 2HA GLY 55 1HA GLY 55 -9.525 -9.239 -0.910
467 HA PRO 56 HA PRO 56 -12.069 -8.612 -4.930
468 1HB PRO 56 2HB PRO 56 -9.741 -8.694 -6.578
469 2HB PRO 56 1HB PRO 56 -10.812 -7.315 -6.305
470 1HG PRO 56 2HG PRO 56 -8.112 -7.684 -5.338
471 2HG PRO 56 1HG PRO 56 -9.168 -6.283 -5.117
472 1HD PRO 56 2HD PRO 56 -8.435 -8.284 -3.165
473 2HD PRO 56 1HD PRO 56 -9.455 -6.849 -2.935
474 H GLU 57 H GLU 57 -11.132 -10.074 -7.116
475 HA GLU 57 HA GLU 57 -10.557 -12.779 -5.972
476 1HB GLU 57 2HB GLU 57 -11.892 -13.525 -8.144
477 2HB GLU 57 1HB GLU 57 -12.746 -13.122 -6.658
478 1HG GLU 57 2HG GLU 57 -13.733 -11.310 -7.593
479 2HG GLU 57 1HG GLU 57 -12.234 -10.775 -8.347
480 H ALA 58 H ALA 58 -10.627 -11.131 -9.170
481 HA ALA 58 HA ALA 58 -8.326 -12.687 -10.092
482 1HB ALA 58 1HB ALA 58 -9.764 -10.310 -11.322
483 2HB ALA 58 3HB ALA 58 -8.514 -11.260 -12.126
484 3HB ALA 58 2HB ALA 58 -10.053 -12.008 -11.702
485 H SER 59 H SER 59 -8.988 -9.348 -9.054
486 HA SER 59 HA SER 59 -6.277 -8.406 -9.453
487 1HB SER 59 2HB SER 59 -8.741 -7.359 -8.114
488 2HB SER 59 1HB SER 59 -7.194 -6.633 -7.689
489 HG SER 59 HG SER 59 -8.326 -5.681 -9.529
490 H ALA 60 H ALA 60 -8.005 -9.980 -6.803
491 HA ALA 60 HA ALA 60 -6.215 -9.416 -4.664
492 1HB ALA 60 3HB ALA 60 -7.999 -11.784 -5.256
493 2HB ALA 60 2HB ALA 60 -7.027 -11.695 -3.786
494 3HB ALA 60 1HB ALA 60 -8.266 -10.479 -4.099
495 H PHE 61 H PHE 61 -6.130 -11.980 -7.140
496 HA PHE 61 HA PHE 61 -3.782 -13.310 -6.123
497 1HB PHE 61 2HB PHE 61 -5.283 -13.298 -8.719
498 2HB PHE 61 1HB PHE 61 -3.669 -14.007 -8.682
499 HD1 PHE 61 HD2 PHE 61 -6.895 -14.046 -6.758
500 HD2 PHE 61 HD1 PHE 61 -3.422 -16.233 -8.026
501 HE1 PHE 61 HE2 PHE 61 -7.819 -16.105 -5.733
502 HE2 PHE 61 HE1 PHE 61 -4.346 -18.292 -6.999
503 HZ PHE 61 HZ PHE 61 -6.543 -18.229 -5.854
504 H THR 62 H THR 62 -4.286 -10.462 -8.082
505 HA THR 62 HA THR 62 -1.518 -10.310 -9.039
506 HB THR 62 HB THR 62 -3.262 -7.889 -9.034
507 HG1 THR 62 HG1 THR 62 -3.767 -10.173 -10.645
508 1HG2 THR 62 1HG2 THR 62 -0.964 -8.191 -10.141
509 2HG2 THR 62 3HG2 THR 62 -1.796 -9.208 -11.318
510 3HG2 THR 62 2HG2 THR 62 -2.247 -7.512 -11.141
511 H LYS 63 H LYS 63 -3.478 -8.915 -6.439
512 HA LYS 63 HA LYS 63 -1.385 -7.091 -5.554
513 1HB LYS 63 2HB LYS 63 -3.893 -8.001 -4.116
514 2HB LYS 63 1HB LYS 63 -2.888 -6.621 -3.676
515 1HG LYS 63 2HG LYS 63 -4.279 -6.915 -6.355
516 2HG LYS 63 1HG LYS 63 -4.931 -5.994 -5.003
517 1HD LYS 63 2HD LYS 63 -3.717 -4.224 -5.678
518 2HD LYS 63 1HD LYS 63 -2.251 -5.137 -5.324
519 1HE LYS 63 2HE LYS 63 -1.940 -4.679 -7.582
520 2HE LYS 63 1HE LYS 63 -2.745 -6.244 -7.673
521 1HZ LYS 63 1HZ LYS 63 -4.862 -5.075 -7.935
522 2HZ LYS 63 3HZ LYS 63 -4.049 -3.587 -7.914
523 3HZ LYS 63 2HZ LYS 63 -3.771 -4.686 -9.178
524 H LYS 64 H LYS 64 -1.748 -10.462 -5.193
525 HA LYS 64 HA LYS 64 -0.663 -10.635 -2.493
526 1HB LYS 64 2HB LYS 64 -0.746 -13.006 -2.809
527 2HB LYS 64 1HB LYS 64 -2.186 -12.370 -3.601
528 1HG LYS 64 2HG LYS 64 -1.344 -13.804 -5.238
529 2HG LYS 64 1HG LYS 64 -0.635 -12.262 -5.712
530 1HD LYS 64 2HD LYS 64 1.398 -13.133 -5.506
531 2HD LYS 64 1HD LYS 64 1.090 -13.420 -3.794
532 1HE LYS 64 2HE LYS 64 -0.047 -15.573 -4.424
533 2HE LYS 64 1HE LYS 64 0.467 -15.302 -6.089
534 1HZ LYS 64 3HZ LYS 64 2.270 -15.530 -3.738
535 2HZ LYS 64 2HZ LYS 64 2.011 -16.734 -4.909
536 3HZ LYS 64 1HZ LYS 64 2.763 -15.273 -5.341
537 H MET 65 H MET 65 0.541 -10.300 -5.735
538 HA MET 65 HA MET 65 3.099 -11.480 -5.546
539 1HB MET 65 2HB MET 65 3.763 -10.012 -7.347
540 2HB MET 65 1HB MET 65 2.088 -10.484 -7.622
541 1HG MET 65 2HG MET 65 1.620 -8.284 -7.781
542 2HG MET 65 1HG MET 65 1.888 -8.191 -6.042
543 1HE MET 65 1HE MET 65 2.952 -7.921 -9.457
544 2HE MET 65 3HE MET 65 2.918 -6.183 -9.131
545 3HE MET 65 2HE MET 65 4.437 -6.978 -9.538
546 H LEU 66 H LEU 66 1.818 -8.607 -4.070
547 HA LEU 66 HA LEU 66 4.421 -7.486 -3.323
548 1HB LEU 66 2HB LEU 66 2.075 -6.295 -3.690
549 2HB LEU 66 1HB LEU 66 1.848 -6.705 -1.991
550 HG LEU 66 HG LEU 66 4.485 -5.536 -2.613
551 1HD1 LEU 66 3HD1 LEU 66 1.917 -3.981 -3.002
552 2HD1 LEU 66 2HD1 LEU 66 3.472 -3.211 -2.697
553 3HD1 LEU 66 1HD1 LEU 66 3.237 -4.177 -4.151
554 1HD2 LEU 66 2HD2 LEU 66 2.299 -5.153 -0.555
555 2HD2 LEU 66 1HD2 LEU 66 3.908 -5.835 -0.318
556 3HD2 LEU 66 3HD2 LEU 66 3.717 -4.107 -0.610
557 H GLU 67 H GLU 67 2.207 -9.851 -2.063
558 HA GLU 67 HA GLU 67 3.085 -9.579 0.723
559 1HB GLU 67 2HB GLU 67 1.025 -11.015 -0.727
560 2HB GLU 67 1HB GLU 67 1.901 -12.115 0.338
561 1HG GLU 67 2HG GLU 67 0.763 -9.445 1.223
562 2HG GLU 67 1HG GLU 67 -0.057 -10.990 1.446
563 H ASN 68 H ASN 68 3.963 -11.413 -2.126
564 HA ASN 68 HA ASN 68 6.065 -12.814 -0.519
565 1HB ASN 68 2HB ASN 68 5.906 -14.690 -2.003
566 2HB ASN 68 1HB ASN 68 4.263 -14.273 -1.530
567 1HD2 ASN 68 2HD2 ASN 68 3.459 -12.974 -4.841
568 2HD2 ASN 68 1HD2 ASN 68 3.154 -12.601 -3.212
569 H ALA 69 H ALA 69 5.961 -10.166 -2.171
570 HA ALA 69 HA ALA 69 7.928 -10.610 -4.311
571 1HB ALA 69 1HB ALA 69 6.119 -8.522 -3.487
572 2HB ALA 69 3HB ALA 69 7.740 -7.858 -3.653
573 3HB ALA 69 2HB ALA 69 6.984 -8.688 -5.012
574 H LYS 70 H LYS 70 10.119 -10.353 -4.155
575 HA LYS 70 HA LYS 70 11.222 -9.688 -1.458
576 1HB LYS 70 2HB LYS 70 11.732 -11.907 -2.756
577 2HB LYS 70 1HB LYS 70 12.828 -10.896 -3.698
578 1HG LYS 70 2HG LYS 70 13.989 -10.201 -1.655
579 2HG LYS 70 1HG LYS 70 12.864 -11.144 -0.675
580 1HD LYS 70 2HD LYS 70 13.635 -13.124 -2.244
581 2HD LYS 70 1HD LYS 70 15.047 -12.098 -2.500
582 1HE LYS 70 2HE LYS 70 14.090 -12.568 0.304
583 2HE LYS 70 1HE LYS 70 15.011 -13.834 -0.507
584 1HZ LYS 70 1HZ LYS 70 15.879 -11.011 -0.184
585 2HZ LYS 70 3HZ LYS 70 16.449 -12.326 0.724
586 3HZ LYS 70 2HZ LYS 70 16.768 -12.244 -0.943
587 H LYS 71 H LYS 71 12.022 -9.184 -4.918
588 HA LYS 71 HA LYS 71 13.522 -6.708 -4.170
589 1HB LYS 71 2HB LYS 71 13.329 -8.289 -6.759
590 2HB LYS 71 1HB LYS 71 14.171 -6.745 -6.632
591 1HG LYS 71 2HG LYS 71 14.806 -9.059 -4.794
592 2HG LYS 71 1HG LYS 71 15.598 -8.870 -6.357
593 1HD LYS 71 2HD LYS 71 17.008 -7.354 -5.479
594 2HD LYS 71 1HD LYS 71 15.643 -6.337 -5.016
595 1HE LYS 71 2HE LYS 71 16.622 -6.772 -2.941
596 2HE LYS 71 1HE LYS 71 15.405 -8.044 -3.029
597 1HZ LYS 71 3HZ LYS 71 18.246 -8.357 -3.840
598 2HZ LYS 71 2HZ LYS 71 17.596 -8.875 -2.358
599 3HZ LYS 71 1HZ LYS 71 17.066 -9.577 -3.811
600 H ILE 72 H ILE 72 11.830 -5.256 -3.753
601 HA ILE 72 HA ILE 72 9.572 -5.065 -5.592
602 HB ILE 72 HB ILE 72 10.310 -3.533 -3.115
603 1HG1 ILE 72 2HG1 ILE 72 7.857 -4.970 -2.906
604 2HG1 ILE 72 1HG1 ILE 72 9.063 -6.071 -3.566
605 1HG2 ILE 72 3HG2 ILE 72 8.177 -3.138 -5.131
606 2HG2 ILE 72 2HG2 ILE 72 7.679 -3.041 -3.442
607 3HG2 ILE 72 1HG2 ILE 72 8.936 -1.968 -4.052
608 1HD1 ILE 72 3HD1 ILE 72 9.707 -4.337 -1.193
609 2HD1 ILE 72 2HD1 ILE 72 8.872 -5.877 -0.988
610 3HD1 ILE 72 1HD1 ILE 72 10.481 -5.836 -1.707
611 H GLU 73 H GLU 73 10.285 -4.293 -7.467
612 HA GLU 73 HA GLU 73 11.989 -1.926 -7.631
613 1HB GLU 73 2HB GLU 73 10.723 -3.852 -9.533
614 2HB GLU 73 1HB GLU 73 11.045 -2.236 -10.149
615 1HG GLU 73 2HG GLU 73 12.997 -3.603 -10.591
616 2HG GLU 73 1HG GLU 73 13.411 -2.459 -9.316
617 H VAL 74 H VAL 74 10.324 -0.881 -6.117
618 HA VAL 74 HA VAL 74 7.689 -0.222 -6.785
619 HB VAL 74 HB VAL 74 8.946 2.159 -5.701
620 1HG1 VAL 74 3HG1 VAL 74 6.587 1.385 -5.436
621 2HG1 VAL 74 2HG1 VAL 74 7.175 0.082 -4.402
622 3HG1 VAL 74 1HG1 VAL 74 7.375 1.762 -3.904
623 1HG2 VAL 74 3HG2 VAL 74 9.736 -0.489 -4.488
624 2HG2 VAL 74 2HG2 VAL 74 10.749 0.917 -4.811
625 3HG2 VAL 74 1HG2 VAL 74 9.578 0.959 -3.498
626 H GLU 75 H GLU 75 7.076 0.410 -8.758
627 HA GLU 75 HA GLU 75 8.754 2.203 -10.356
628 1HB GLU 75 2HB GLU 75 6.787 0.227 -10.890
629 2HB GLU 75 1HB GLU 75 6.143 1.749 -11.499
630 1HG GLU 75 2HG GLU 75 7.580 1.733 -13.233
631 2HG GLU 75 1HG GLU 75 8.955 1.522 -12.150
632 H PHE 76 H PHE 76 8.529 3.911 -8.639
633 HA PHE 76 HA PHE 76 6.115 5.577 -9.194
634 1HB PHE 76 2HB PHE 76 5.830 6.106 -6.938
635 2HB PHE 76 1HB PHE 76 6.310 4.418 -6.844
636 HD1 PHE 76 HD1 PHE 76 8.901 3.983 -6.663
637 HD2 PHE 76 HD2 PHE 76 6.987 7.697 -5.668
638 HE1 PHE 76 HE1 PHE 76 10.848 4.608 -5.272
639 HE2 PHE 76 HE2 PHE 76 8.934 8.323 -4.276
640 HZ PHE 76 HZ PHE 76 10.868 6.784 -4.076
641 H ASP 77 H ASP 77 9.004 5.447 -10.191
642 HA ASP 77 HA ASP 77 10.805 6.855 -10.632
643 1HB ASP 77 2HB ASP 77 10.097 9.107 -11.444
644 2HB ASP 77 1HB ASP 77 9.147 7.791 -12.116
645 H LYS 78 H LYS 78 11.034 9.707 -10.034
646 HA LYS 78 HA LYS 78 12.398 9.568 -7.552
647 1HB LYS 78 2HB LYS 78 12.606 11.356 -9.377
648 2HB LYS 78 1HB LYS 78 11.178 12.102 -8.662
649 1HG LYS 78 2HG LYS 78 13.019 13.187 -7.620
650 2HG LYS 78 1HG LYS 78 12.445 12.020 -6.429
651 1HD LYS 78 2HD LYS 78 14.250 10.535 -7.913
652 2HD LYS 78 1HD LYS 78 15.010 12.125 -7.853
653 1HE LYS 78 2HE LYS 78 15.796 11.131 -5.882
654 2HE LYS 78 1HE LYS 78 14.398 12.039 -5.309
655 1HZ LYS 78 3HZ LYS 78 14.273 9.189 -6.126
656 2HZ LYS 78 2HZ LYS 78 14.522 9.692 -4.522
657 3HZ LYS 78 1HZ LYS 78 13.077 10.087 -5.323
658 H GLY 79 H GLY 79 9.077 10.639 -8.273
659 1HA GLY 79 2HA GLY 79 7.800 9.778 -6.000
660 2HA GLY 79 1HA GLY 79 8.514 11.306 -5.482
661 H GLN 80 H GLN 80 5.642 10.318 -6.171
662 HA GLN 80 HA GLN 80 4.801 11.976 -8.405
663 1HB GLN 80 2HB GLN 80 3.345 10.486 -6.220
664 2HB GLN 80 1HB GLN 80 2.477 11.567 -7.308
665 1HG GLN 80 2HG GLN 80 2.330 9.434 -8.339
666 2HG GLN 80 1HG GLN 80 3.598 10.276 -9.227
667 1HE2 GLN 80 2HE2 GLN 80 4.993 7.578 -6.453
668 2HE2 GLN 80 1HE2 GLN 80 3.761 8.650 -6.010
669 H ARG 81 H ARG 81 4.260 12.228 -4.867
670 HA ARG 81 HA ARG 81 3.873 14.093 -3.511
671 1HB ARG 81 2HB ARG 81 6.206 14.516 -4.542
672 2HB ARG 81 1HB ARG 81 5.390 15.689 -5.575
673 1HG ARG 81 2HG ARG 81 5.897 17.094 -3.824
674 2HG ARG 81 1HG ARG 81 4.377 16.453 -3.198
675 1HD ARG 81 2HD ARG 81 6.949 15.000 -2.636
676 2HD ARG 81 1HD ARG 81 6.512 16.411 -1.671
677 HE ARG 81 HE ARG 81 4.225 14.855 -1.607
678 1HH1 ARG 81 2HH1 ARG 81 5.588 12.355 -1.845
679 2HH1 ARG 81 1HH1 ARG 81 6.189 12.023 -0.254
680 1HH2 ARG 81 1HH2 ARG 81 5.855 15.302 0.845
681 2HH2 ARG 81 2HH2 ARG 81 6.340 13.695 1.272
682 H THR 82 H THR 82 1.826 13.454 -5.342
683 HA THR 82 HA THR 82 0.688 16.149 -5.971
684 HB THR 82 HB THR 82 -0.013 13.633 -7.445
685 HG1 THR 82 HG1 THR 82 1.990 13.681 -8.099
686 1HG2 THR 82 2HG2 THR 82 -1.175 16.070 -7.498
687 2HG2 THR 82 1HG2 THR 82 0.068 16.315 -8.725
688 3HG2 THR 82 3HG2 THR 82 -1.112 15.018 -8.912
689 H ASP 83 H ASP 83 -1.741 14.155 -6.749
690 HA ASP 83 HA ASP 83 -3.810 13.802 -5.668
691 1HB ASP 83 2HB ASP 83 -1.974 11.850 -5.190
692 2HB ASP 83 1HB ASP 83 -2.410 12.284 -3.540
693 H LYS 84 H LYS 84 -3.929 13.146 -2.705
694 HA LYS 84 HA LYS 84 -4.358 15.882 -1.764
695 1HB LYS 84 2HB LYS 84 -5.510 13.441 -1.164
696 2HB LYS 84 1HB LYS 84 -4.476 13.721 0.237
697 1HG LYS 84 2HG LYS 84 -5.853 16.160 -0.519
698 2HG LYS 84 1HG LYS 84 -7.005 14.855 -0.242
699 1HD LYS 84 2HD LYS 84 -6.738 15.703 1.916
700 2HD LYS 84 1HD LYS 84 -5.553 14.397 1.899
701 1HE LYS 84 2HE LYS 84 -3.786 15.830 1.983
702 2HE LYS 84 1HE LYS 84 -4.545 16.983 0.887
703 1HZ LYS 84 1HZ LYS 84 -5.266 16.612 3.745
704 2HZ LYS 84 3HZ LYS 84 -4.298 17.866 3.139
705 3HZ LYS 84 2HZ LYS 84 -5.931 17.761 2.683
706 H TYR 85 H TYR 85 -2.265 13.125 -0.854
707 HA TYR 85 HA TYR 85 -0.516 15.018 0.659
708 1HB TYR 85 2HB TYR 85 -0.233 12.015 0.718
709 2HB TYR 85 1HB TYR 85 0.236 13.192 1.942
710 HD1 TYR 85 HD2 TYR 85 -1.609 14.453 3.192
711 HD2 TYR 85 HD1 TYR 85 -2.366 10.989 0.765
712 HE1 TYR 85 HE2 TYR 85 -3.791 14.134 4.326
713 HE2 TYR 85 HE1 TYR 85 -4.548 10.671 1.899
714 HH TYR 85 HH TYR 85 -5.388 11.627 4.569
715 H GLY 86 H GLY 86 -0.661 12.780 -2.049
716 1HA GLY 86 2HA GLY 86 0.780 12.578 -3.897
717 2HA GLY 86 1HA GLY 86 1.761 13.884 -3.221
718 H ARG 87 H ARG 87 0.816 10.716 -1.901
719 HA ARG 87 HA ARG 87 3.486 10.239 -0.850
720 1HB ARG 87 2HB ARG 87 2.534 8.175 -0.005
721 2HB ARG 87 1HB ARG 87 1.356 9.464 0.228
722 1HG ARG 87 2HG ARG 87 0.688 8.582 -2.276
723 2HG ARG 87 1HG ARG 87 1.213 7.082 -1.510
724 1HD ARG 87 2HD ARG 87 -0.319 8.404 0.436
725 2HD ARG 87 1HD ARG 87 -1.217 8.595 -1.073
726 HE ARG 87 HE ARG 87 -0.617 5.929 -1.126
727 1HH1 ARG 87 2HH1 ARG 87 -0.393 5.975 1.852
728 2HH1 ARG 87 1HH1 ARG 87 -2.028 5.702 2.355
729 1HH2 ARG 87 1HH2 ARG 87 -3.383 6.481 -0.744
730 2HH2 ARG 87 2HH2 ARG 87 -3.728 6.002 0.883
731 H VAL 88 H VAL 88 3.313 7.307 -1.545
732 HA VAL 88 HA VAL 88 4.759 7.508 -4.105
733 HB VAL 88 HB VAL 88 4.263 5.140 -2.282
734 1HG1 VAL 88 3HG1 VAL 88 5.393 5.361 -4.927
735 2HG1 VAL 88 2HG1 VAL 88 6.629 4.828 -3.789
736 3HG1 VAL 88 1HG1 VAL 88 5.130 3.914 -3.955
737 1HG2 VAL 88 2HG2 VAL 88 6.627 7.020 -2.540
738 2HG2 VAL 88 1HG2 VAL 88 5.566 6.854 -1.141
739 3HG2 VAL 88 3HG2 VAL 88 6.638 5.531 -1.597
740 H LEU 89 H LEU 89 2.267 8.173 -4.703
741 HA LEU 89 HA LEU 89 0.504 5.929 -5.238
742 1HB LEU 89 2HB LEU 89 0.477 8.794 -6.237
743 2HB LEU 89 1HB LEU 89 -0.808 7.625 -6.537
744 HG LEU 89 HG LEU 89 0.063 8.814 -3.902
745 1HD1 LEU 89 3HD1 LEU 89 -1.701 9.901 -5.353
746 2HD1 LEU 89 2HD1 LEU 89 -2.683 8.454 -5.124
747 3HD1 LEU 89 1HD1 LEU 89 -2.250 9.455 -3.737
748 1HD2 LEU 89 1HD2 LEU 89 -1.340 6.212 -4.459
749 2HD2 LEU 89 3HD2 LEU 89 -0.125 6.577 -3.236
750 3HD2 LEU 89 2HD2 LEU 89 -1.781 7.146 -3.030
751 H ALA 90 H ALA 90 2.074 4.586 -6.375
752 HA ALA 90 HA ALA 90 2.007 5.113 -9.281
753 1HB ALA 90 1HB ALA 90 4.187 6.004 -8.328
754 2HB ALA 90 3HB ALA 90 4.592 4.341 -7.911
755 3HB ALA 90 2HB ALA 90 4.356 4.797 -9.599
756 H TYR 91 H TYR 91 4.220 2.623 -8.229
757 HA TYR 91 HA TYR 91 2.160 0.613 -7.855
758 1HB TYR 91 2HB TYR 91 3.187 1.129 -10.541
759 2HB TYR 91 1HB TYR 91 3.306 -0.563 -10.045
760 HD1 TYR 91 HD1 TYR 91 1.085 -0.990 -8.279
761 HD2 TYR 91 HD2 TYR 91 1.248 1.387 -11.851
762 HE1 TYR 91 HE1 TYR 91 -1.354 -1.237 -8.542
763 HE2 TYR 91 HE2 TYR 91 -1.195 1.135 -12.121
764 HH TYR 91 HH TYR 91 -2.944 -0.985 -11.111
765 H ILE 92 H ILE 92 3.041 -1.627 -7.796
766 HA ILE 92 HA ILE 92 5.900 -1.682 -6.897
767 HB ILE 92 HB ILE 92 3.793 -3.393 -5.607
768 1HG1 ILE 92 2HG1 ILE 92 2.953 -1.032 -5.498
769 2HG1 ILE 92 1HG1 ILE 92 3.338 -1.704 -3.917
770 1HG2 ILE 92 3HG2 ILE 92 6.354 -3.559 -5.305
771 2HG2 ILE 92 2HG2 ILE 92 6.188 -2.100 -4.328
772 3HG2 ILE 92 1HG2 ILE 92 5.344 -3.576 -3.861
773 1HD1 ILE 92 1HD1 ILE 92 5.422 -0.162 -5.435
774 2HD1 ILE 92 3HD1 ILE 92 4.187 0.695 -4.513
775 3HD1 ILE 92 2HD1 ILE 92 5.281 -0.423 -3.698
776 H TYR 93 H TYR 93 7.011 -3.228 -8.083
777 HA TYR 93 HA TYR 93 5.518 -5.688 -8.889
778 1HB TYR 93 2HB TYR 93 7.531 -4.354 -10.705
779 2HB TYR 93 1HB TYR 93 6.466 -5.700 -11.084
780 HD1 TYR 93 HD1 TYR 93 3.839 -4.970 -10.253
781 HD2 TYR 93 HD2 TYR 93 6.953 -2.488 -11.828
782 HE1 TYR 93 HE1 TYR 93 2.157 -3.341 -11.027
783 HE2 TYR 93 HE2 TYR 93 5.288 -0.857 -12.608
784 HH TYR 93 HH TYR 93 2.838 -0.889 -13.238
785 H ALA 94 H ALA 94 6.673 -6.558 -6.975
786 HA ALA 94 HA ALA 94 9.568 -6.891 -7.447
787 1HB ALA 94 2HB ALA 94 7.904 -6.763 -5.070
788 2HB ALA 94 1HB ALA 94 8.911 -8.210 -5.069
789 3HB ALA 94 3HB ALA 94 9.649 -6.626 -5.205
790 H ASP 95 H ASP 95 9.859 -8.576 -8.857
791 HA ASP 95 HA ASP 95 9.786 -10.768 -9.708
792 1HB ASP 95 2HB ASP 95 8.597 -11.392 -6.988
793 2HB ASP 95 1HB ASP 95 9.217 -12.575 -8.136
794 H GLY 96 H GLY 96 7.241 -8.839 -9.325
795 1HA GLY 96 2HA GLY 96 5.179 -10.835 -10.135
796 2HA GLY 96 1HA GLY 96 4.827 -9.266 -9.407
797 H LYS 97 H LYS 97 6.055 -7.450 -10.672
798 HA LYS 97 HA LYS 97 5.588 -6.098 -12.589
799 1HB LYS 97 2HB LYS 97 6.876 -6.805 -14.558
800 2HB LYS 97 1HB LYS 97 7.812 -7.095 -13.095
801 1HG LYS 97 2HG LYS 97 7.299 -9.446 -13.143
802 2HG LYS 97 1HG LYS 97 6.130 -9.219 -14.444
803 1HD LYS 97 2HD LYS 97 8.378 -8.100 -15.541
804 2HD LYS 97 1HD LYS 97 9.074 -9.397 -14.571
805 1HE LYS 97 2HE LYS 97 7.977 -11.066 -15.767
806 2HE LYS 97 1HE LYS 97 6.685 -9.985 -16.289
807 1HZ LYS 97 3HZ LYS 97 8.267 -8.850 -17.726
808 2HZ LYS 97 2HZ LYS 97 9.503 -9.907 -17.230
809 3HZ LYS 97 1HZ LYS 97 8.177 -10.499 -18.111
810 H MET 98 H MET 98 3.460 -7.698 -11.802
811 HA MET 98 HA MET 98 2.125 -8.466 -14.354
812 1HB MET 98 2HB MET 98 0.670 -9.871 -12.720
813 2HB MET 98 1HB MET 98 2.292 -10.464 -13.081
814 1HG MET 98 2HG MET 98 3.152 -9.430 -11.017
815 2HG MET 98 1HG MET 98 1.553 -8.782 -10.660
816 1HE MET 98 3HE MET 98 3.439 -11.666 -11.810
817 2HE MET 98 2HE MET 98 3.758 -12.269 -10.186
818 3HE MET 98 1HE MET 98 2.635 -13.132 -11.233
819 H VAL 99 H VAL 99 1.733 -7.057 -11.111
820 HA VAL 99 HA VAL 99 -0.950 -6.151 -11.347
821 HB VAL 99 HB VAL 99 1.417 -4.923 -9.880
822 1HG1 VAL 99 1HG1 VAL 99 -1.549 -4.341 -9.771
823 2HG1 VAL 99 3HG1 VAL 99 -0.422 -3.851 -8.505
824 3HG1 VAL 99 2HG1 VAL 99 -0.243 -3.214 -10.140
825 1HG2 VAL 99 3HG2 VAL 99 0.633 -7.284 -9.274
826 2HG2 VAL 99 2HG2 VAL 99 0.620 -6.107 -7.960
827 3HG2 VAL 99 1HG2 VAL 99 -0.886 -6.544 -8.767
828 H ASN 100 H ASN 100 2.061 -5.094 -12.737
829 HA ASN 100 HA ASN 100 1.498 -2.406 -13.427
830 1HB ASN 100 2HB ASN 100 3.162 -2.596 -15.110
831 2HB ASN 100 1HB ASN 100 3.635 -3.768 -13.882
832 1HD2 ASN 100 2HD2 ASN 100 2.840 -5.056 -17.609
833 2HD2 ASN 100 1HD2 ASN 100 2.960 -3.409 -17.217
834 H GLU 101 H GLU 101 0.254 -5.369 -14.913
835 HA GLU 101 HA GLU 101 -0.968 -4.020 -17.183
836 1HB GLU 101 2HB GLU 101 -1.289 -6.770 -15.964
837 2HB GLU 101 1HB GLU 101 -2.256 -6.236 -17.338
838 1HG GLU 101 2HG GLU 101 -0.520 -6.428 -18.785
839 2HG GLU 101 1HG GLU 101 0.621 -5.705 -17.650
840 H ALA 102 H ALA 102 -2.041 -5.010 -13.946
841 HA ALA 102 HA ALA 102 -4.836 -4.572 -14.266
842 1HB ALA 102 2HB ALA 102 -3.701 -5.656 -12.281
843 2HB ALA 102 1HB ALA 102 -3.232 -4.043 -11.750
844 3HB ALA 102 3HB ALA 102 -4.938 -4.474 -11.857
845 H LEU 103 HN LEU 103 -5.992 -2.727 -14.519
846 HA LEU 103 HA LEU 103 -4.729 -0.131 -13.743
847 1HB LEU 103 2HB LEU 103 -5.856 0.866 -15.787
848 2HB LEU 103 1HB LEU 103 -4.511 -0.219 -16.133
849 HG LEU 103 HG LEU 103 -6.874 -1.814 -15.979
850 1HD1 LEU 103 1HD1 LEU 103 -8.089 0.326 -16.389
851 2HD1 LEU 103 3HD1 LEU 103 -7.143 0.549 -17.861
852 3HD1 LEU 103 2HD1 LEU 103 -8.255 -0.813 -17.726
853 1HD2 LEU 103 3HD2 LEU 103 -4.610 -1.785 -17.431
854 2HD2 LEU 103 2HD2 LEU 103 -6.052 -2.649 -17.962
855 3HD2 LEU 103 1HD2 LEU 103 -5.694 -1.047 -18.609
No H/Q in entry = 855
Start of MODEL 7
Raw file had 866 H/Q atoms
Start of MODEL 7
1 1H ALA 1 2H ALA 1 15.620 13.248 -11.331
2 2H ALA 1 1H ALA 1 14.287 13.866 -10.478
3 3H ALA 1 3H ALA 1 14.854 12.301 -10.147
4 HA ALA 1 HA ALA 1 14.221 11.557 -12.349
5 1HB ALA 1 2HB ALA 1 12.597 11.650 -10.337
6 2HB ALA 1 1HB ALA 1 11.866 13.028 -11.162
7 3HB ALA 1 3HB ALA 1 11.893 11.446 -11.942
8 H THR 2 H THR 2 13.632 12.073 -14.451
9 HA THR 2 HA THR 2 13.936 14.863 -15.271
10 HB THR 2 HB THR 2 13.637 13.981 -17.565
11 HG1 THR 2 HG1 THR 2 13.413 11.408 -16.436
12 1HG2 THR 2 2HG2 THR 2 15.842 13.831 -16.371
13 2HG2 THR 2 1HG2 THR 2 15.433 12.174 -15.926
14 3HG2 THR 2 3HG2 THR 2 15.626 12.609 -17.625
15 H SER 3 H SER 3 12.237 15.640 -17.028
16 HA SER 3 HA SER 3 9.585 15.504 -15.716
17 1HB SER 3 2HB SER 3 10.822 17.414 -17.703
18 2HB SER 3 1HB SER 3 9.100 17.442 -17.335
19 HG SER 3 HG SER 3 10.137 18.847 -15.947
20 H THR 4 H THR 4 10.614 13.300 -17.402
21 HA THR 4 HA THR 4 8.336 13.183 -19.306
22 HB THR 4 HB THR 4 10.444 13.875 -20.523
23 HG1 THR 4 HG1 THR 4 9.219 12.934 -21.946
24 1HG2 THR 4 3HG2 THR 4 11.912 12.397 -19.030
25 2HG2 THR 4 2HG2 THR 4 11.356 11.041 -20.010
26 3HG2 THR 4 1HG2 THR 4 12.260 12.356 -20.758
27 H LYS 5 H LYS 5 9.401 11.885 -16.635
28 HA LYS 5 HA LYS 5 9.595 9.055 -17.359
29 1HB LYS 5 2HB LYS 5 10.390 10.570 -15.168
30 2HB LYS 5 1HB LYS 5 9.039 9.623 -14.547
31 1HG LYS 5 2HG LYS 5 10.605 7.995 -14.269
32 2HG LYS 5 1HG LYS 5 10.381 7.732 -15.998
33 1HD LYS 5 2HD LYS 5 12.701 7.990 -15.850
34 2HD LYS 5 1HD LYS 5 12.177 9.626 -16.250
35 1HE LYS 5 2HE LYS 5 12.371 10.347 -13.980
36 2HE LYS 5 1HE LYS 5 12.530 8.692 -13.394
37 1HZ LYS 5 3HZ LYS 5 14.625 8.527 -14.633
38 2HZ LYS 5 2HZ LYS 5 14.480 10.156 -15.090
39 3HZ LYS 5 1HZ LYS 5 14.675 9.745 -13.454
40 H LYS 6 H LYS 6 8.092 7.593 -15.827
41 HA LYS 6 HA LYS 6 5.393 8.410 -15.315
42 1HB LYS 6 2HB LYS 6 4.250 7.280 -17.201
43 2HB LYS 6 1HB LYS 6 5.247 8.617 -17.764
44 1HG LYS 6 2HG LYS 6 6.157 5.722 -17.744
45 2HG LYS 6 1HG LYS 6 5.470 6.529 -19.152
46 1HD LYS 6 2HD LYS 6 7.339 8.341 -18.582
47 2HD LYS 6 1HD LYS 6 8.119 6.950 -17.829
48 1HE LYS 6 2HE LYS 6 8.907 6.524 -19.921
49 2HE LYS 6 1HE LYS 6 7.292 5.882 -20.222
50 1HZ LYS 6 3HZ LYS 6 6.610 8.068 -20.999
51 2HZ LYS 6 2HZ LYS 6 8.170 8.678 -20.718
52 3HZ LYS 6 1HZ LYS 6 7.921 7.489 -21.906
53 H LEU 7 H LEU 7 7.613 5.782 -16.163
54 HA LEU 7 HA LEU 7 6.410 4.142 -14.012
55 1HB LEU 7 2HB LEU 7 6.686 3.336 -16.913
56 2HB LEU 7 1HB LEU 7 6.680 2.128 -15.634
57 HG LEU 7 HG LEU 7 4.493 4.170 -16.147
58 1HD1 LEU 7 1HD1 LEU 7 4.585 1.165 -16.550
59 2HD1 LEU 7 3HD1 LEU 7 3.154 2.175 -16.761
60 3HD1 LEU 7 2HD1 LEU 7 4.545 2.382 -17.827
61 1HD2 LEU 7 3HD2 LEU 7 4.881 3.460 -13.720
62 2HD2 LEU 7 2HD2 LEU 7 3.274 3.130 -14.360
63 3HD2 LEU 7 1HD2 LEU 7 4.452 1.827 -14.225
64 H HIS 8 H HIS 8 8.323 4.619 -12.837
65 HA HIS 8 HA HIS 8 10.943 3.929 -14.010
66 1HB HIS 8 2HB HIS 8 10.153 5.861 -12.235
67 2HB HIS 8 1HB HIS 8 10.808 4.640 -11.145
68 HD1 HIS 8 HD1 HIS 8 11.974 5.781 -14.604
69 HD2 HIS 8 HD2 HIS 8 13.432 5.380 -10.719
70 HE1 HIS 8 HE1 HIS 8 14.429 6.389 -14.695
71 H LYS 9 H LYS 9 12.231 3.035 -11.619
72 HA LYS 9 HA LYS 9 10.906 0.724 -10.500
73 1HB LYS 9 2HB LYS 9 12.632 -0.896 -11.589
74 2HB LYS 9 1HB LYS 9 11.223 -0.422 -12.532
75 1HG LYS 9 2HG LYS 9 12.755 0.113 -14.130
76 2HG LYS 9 1HG LYS 9 12.987 1.577 -13.177
77 1HD LYS 9 2HD LYS 9 15.131 0.976 -12.864
78 2HD LYS 9 1HD LYS 9 14.565 -0.413 -11.937
79 1HE LYS 9 2HE LYS 9 15.771 -1.493 -13.599
80 2HE LYS 9 1HE LYS 9 14.176 -1.449 -14.348
81 1HZ LYS 9 1HZ LYS 9 16.316 0.569 -14.773
82 2HZ LYS 9 3HZ LYS 9 15.938 -0.687 -15.848
83 3HZ LYS 9 2HZ LYS 9 14.800 0.535 -15.539
84 H GLU 10 H GLU 10 11.899 0.297 -8.579
85 HA GLU 10 HA GLU 10 14.785 0.565 -8.209
86 1HB GLU 10 2HB GLU 10 13.536 2.926 -7.958
87 2HB GLU 10 1HB GLU 10 13.191 2.289 -6.351
88 1HG GLU 10 2HG GLU 10 15.967 1.826 -7.116
89 2HG GLU 10 1HG GLU 10 15.557 3.540 -7.159
90 HA PRO 11 HA PRO 11 13.696 -2.840 -5.642
91 1HB PRO 11 2HB PRO 11 16.016 -2.191 -3.982
92 2HB PRO 11 1HB PRO 11 15.699 -3.624 -4.971
93 1HG PRO 11 2HG PRO 11 17.494 -1.555 -5.610
94 2HG PRO 11 1HG PRO 11 16.906 -2.802 -6.718
95 1HD PRO 11 2HD PRO 11 16.265 0.040 -6.694
96 2HD PRO 11 1HD PRO 11 15.812 -1.188 -7.894
97 H ALA 12 H ALA 12 12.562 -3.133 -3.815
98 HA ALA 12 HA ALA 12 12.426 -0.956 -1.774
99 1HB ALA 12 3HB ALA 12 10.138 -2.457 -3.073
100 2HB ALA 12 2HB ALA 12 9.969 -1.398 -1.677
101 3HB ALA 12 1HB ALA 12 10.490 -0.737 -3.222
102 H THR 13 H THR 13 10.386 -2.450 -0.260
103 HA THR 13 HA THR 13 11.558 -5.086 0.281
104 HB THR 13 HB THR 13 13.043 -3.631 1.589
105 HG1 THR 13 HG1 THR 13 12.796 -5.377 2.762
106 1HG2 THR 13 2HG2 THR 13 10.828 -2.012 1.868
107 2HG2 THR 13 1HG2 THR 13 10.985 -2.723 3.474
108 3HG2 THR 13 3HG2 THR 13 12.335 -1.836 2.766
109 H LEU 14 H LEU 14 9.921 -6.425 0.817
110 HA LEU 14 HA LEU 14 7.216 -5.628 0.954
111 1HB LEU 14 2HB LEU 14 7.327 -7.879 0.533
112 2HB LEU 14 1HB LEU 14 8.765 -8.097 1.524
113 HG LEU 14 HG LEU 14 6.451 -7.383 3.143
114 1HD1 LEU 14 2HD1 LEU 14 6.176 -9.528 1.107
115 2HD1 LEU 14 1HD1 LEU 14 5.644 -9.919 2.742
116 3HD1 LEU 14 3HD1 LEU 14 4.934 -8.549 1.887
117 1HD2 LEU 14 1HD2 LEU 14 8.739 -8.489 3.719
118 2HD2 LEU 14 3HD2 LEU 14 7.296 -9.084 4.537
119 3HD2 LEU 14 2HD2 LEU 14 7.973 -9.983 3.180
120 H ILE 15 H ILE 15 6.302 -4.377 2.512
121 HA ILE 15 HA ILE 15 7.098 -4.945 5.324
122 HB ILE 15 HB ILE 15 6.681 -2.464 5.784
123 1HG1 ILE 15 2HG1 ILE 15 7.276 -2.056 2.865
124 2HG1 ILE 15 1HG1 ILE 15 5.604 -2.268 3.389
125 1HG2 ILE 15 1HG2 ILE 15 8.932 -3.493 5.695
126 2HG2 ILE 15 3HG2 ILE 15 8.984 -3.207 3.956
127 3HG2 ILE 15 2HG2 ILE 15 8.948 -1.843 5.073
128 1HD1 ILE 15 3HD1 ILE 15 6.339 -0.470 5.221
129 2HD1 ILE 15 2HD1 ILE 15 7.503 -0.038 3.969
130 3HD1 ILE 15 1HD1 ILE 15 5.774 0.022 3.626
131 H LYS 16 H LYS 16 4.856 -5.992 3.810
132 HA LYS 16 HA LYS 16 2.732 -6.692 4.592
133 1HB LYS 16 2HB LYS 16 2.617 -4.071 6.117
134 2HB LYS 16 1HB LYS 16 1.420 -5.359 6.181
135 1HG LYS 16 2HG LYS 16 4.239 -6.145 6.728
136 2HG LYS 16 1HG LYS 16 3.430 -5.182 7.964
137 1HD LYS 16 2HD LYS 16 1.566 -6.796 8.011
138 2HD LYS 16 1HD LYS 16 2.368 -7.760 6.771
139 1HE LYS 16 2HE LYS 16 4.341 -7.977 8.324
140 2HE LYS 16 1HE LYS 16 3.374 -7.195 9.573
141 1HZ LYS 16 3HZ LYS 16 1.711 -8.960 9.290
142 2HZ LYS 16 2HZ LYS 16 2.731 -9.734 8.172
143 3HZ LYS 16 1HZ LYS 16 3.213 -9.567 9.792
144 H ALA 17 H ALA 17 0.406 -5.793 4.287
145 HA ALA 17 HA ALA 17 0.265 -3.672 2.208
146 1HB ALA 17 1HB ALA 17 -0.740 -6.515 1.850
147 2HB ALA 17 3HB ALA 17 -1.147 -5.173 0.781
148 3HB ALA 17 2HB ALA 17 0.523 -5.721 0.908
149 H ILE 18 H ILE 18 -1.615 -2.544 2.285
150 HA ILE 18 HA ILE 18 -3.271 -2.730 4.623
151 HB ILE 18 HB ILE 18 -3.256 -1.130 2.092
152 1HG1 ILE 18 2HG1 ILE 18 -3.572 0.569 4.218
153 2HG1 ILE 18 1HG1 ILE 18 -2.716 -0.775 4.975
154 1HG2 ILE 18 1HG2 ILE 18 -5.595 -1.470 3.964
155 2HG2 ILE 18 3HG2 ILE 18 -5.314 0.084 3.178
156 3HG2 ILE 18 2HG2 ILE 18 -5.593 -1.359 2.204
157 1HD1 ILE 18 2HD1 ILE 18 -1.087 -0.659 3.004
158 2HD1 ILE 18 1HD1 ILE 18 -1.839 0.885 2.606
159 3HD1 ILE 18 3HD1 ILE 18 -1.014 0.679 4.150
160 H ASP 19 H ASP 19 -4.257 -3.112 1.187
161 HA ASP 19 HA ASP 19 -5.661 -5.587 1.615
162 1HB ASP 19 2HB ASP 19 -7.034 -3.520 2.726
163 2HB ASP 19 1HB ASP 19 -7.648 -3.433 1.078
164 H GLY 20 H GLY 20 -7.758 -4.949 -0.397
165 1HA GLY 20 2HA GLY 20 -6.057 -5.086 -2.794
166 2HA GLY 20 1HA GLY 20 -7.807 -5.306 -2.749
167 H ASP 21 H ASP 21 -5.911 -2.562 -1.493
168 HA ASP 21 HA ASP 21 -6.960 -0.800 -3.633
169 1HB ASP 21 2HB ASP 21 -7.159 0.157 -0.789
170 2HB ASP 21 1HB ASP 21 -8.056 0.695 -2.206
171 H THR 22 H THR 22 -5.069 -0.932 -0.607
172 HA THR 22 HA THR 22 -2.978 0.735 -1.947
173 HB THR 22 HB THR 22 -3.155 0.812 1.019
174 HG1 THR 22 HG1 THR 22 -5.247 1.194 0.795
175 1HG2 THR 22 3HG2 THR 22 -2.475 2.662 -1.242
176 2HG2 THR 22 2HG2 THR 22 -2.843 3.324 0.351
177 3HG2 THR 22 1HG2 THR 22 -1.497 2.202 0.151
178 H VAL 23 H VAL 23 -0.791 0.417 -0.612
179 HA VAL 23 HA VAL 23 -0.489 -2.303 0.503
180 HB VAL 23 HB VAL 23 1.596 -2.528 -1.081
181 1HG1 VAL 23 1HG1 VAL 23 -0.559 -3.921 -0.994
182 2HG1 VAL 23 3HG1 VAL 23 -1.129 -2.916 -2.326
183 3HG1 VAL 23 2HG1 VAL 23 0.312 -3.911 -2.528
184 1HG2 VAL 23 3HG2 VAL 23 1.167 -0.197 -2.030
185 2HG2 VAL 23 2HG2 VAL 23 1.379 -1.478 -3.224
186 3HG2 VAL 23 1HG2 VAL 23 -0.239 -0.885 -2.843
187 H LYS 24 H LYS 24 1.703 -2.606 1.537
188 HA LYS 24 HA LYS 24 2.742 0.052 2.421
189 1HB LYS 24 2HB LYS 24 1.931 -2.075 3.954
190 2HB LYS 24 1HB LYS 24 3.668 -2.362 3.848
191 1HG LYS 24 2HG LYS 24 4.179 -0.211 4.749
192 2HG LYS 24 1HG LYS 24 2.515 0.338 4.561
193 1HD LYS 24 2HD LYS 24 1.941 -0.499 6.571
194 2HD LYS 24 1HD LYS 24 2.607 -2.079 6.158
195 1HE LYS 24 2HE LYS 24 3.870 -1.336 8.037
196 2HE LYS 24 1HE LYS 24 4.912 -1.070 6.640
197 1HZ LYS 24 3HZ LYS 24 3.175 0.995 7.884
198 2HZ LYS 24 2HZ LYS 24 4.848 0.845 8.142
199 3HZ LYS 24 1HZ LYS 24 4.256 1.234 6.598
200 H LEU 25 H LEU 25 4.705 0.656 1.652
201 HA LEU 25 HA LEU 25 6.660 -1.451 0.898
202 1HB LEU 25 2HB LEU 25 5.227 -0.754 -1.097
203 2HB LEU 25 1HB LEU 25 5.968 0.835 -0.963
204 HG LEU 25 HG LEU 25 7.035 -0.813 -2.618
205 1HD1 LEU 25 2HD1 LEU 25 8.066 1.252 -1.140
206 2HD1 LEU 25 1HD1 LEU 25 9.189 -0.051 -0.760
207 3HD1 LEU 25 3HD1 LEU 25 8.925 0.423 -2.437
208 1HD2 LEU 25 2HD2 LEU 25 6.925 -2.631 -0.691
209 2HD2 LEU 25 1HD2 LEU 25 8.261 -2.627 -1.841
210 3HD2 LEU 25 3HD2 LEU 25 8.477 -1.929 -0.237
211 H MET 26 H MET 26 8.714 -0.893 1.454
212 HA MET 26 HA MET 26 9.245 1.952 2.226
213 1HB MET 26 2HB MET 26 9.318 0.325 4.125
214 2HB MET 26 1HB MET 26 10.578 -0.567 3.280
215 1HG MET 26 2HG MET 26 11.855 1.683 3.216
216 2HG MET 26 1HG MET 26 10.712 2.205 4.452
217 1HE MET 26 3HE MET 26 13.327 0.265 3.183
218 2HE MET 26 2HE MET 26 14.444 0.452 4.533
219 3HE MET 26 1HE MET 26 13.655 -1.100 4.259
220 H TYR 27 H TYR 27 10.038 2.622 0.210
221 HA TYR 27 HA TYR 27 12.178 1.029 -1.079
222 1HB TYR 27 2HB TYR 27 11.768 2.266 -3.038
223 2HB TYR 27 1HB TYR 27 10.170 2.127 -2.310
224 HD1 TYR 27 HD2 TYR 27 9.327 4.055 -0.851
225 HD2 TYR 27 HD1 TYR 27 12.750 4.381 -3.424
226 HE1 TYR 27 HE2 TYR 27 9.175 6.523 -0.735
227 HE2 TYR 27 HE1 TYR 27 12.600 6.852 -3.307
228 HH TYR 27 HH TYR 27 10.100 8.510 -2.561
229 H LYS 28 H LYS 28 11.748 4.219 0.472
230 HA LYS 28 HA LYS 28 14.675 4.644 0.169
231 1HB LYS 28 2HB LYS 28 14.290 7.010 0.412
232 2HB LYS 28 1HB LYS 28 13.152 6.403 -0.785
233 1HG LYS 28 2HG LYS 28 11.419 7.124 0.455
234 2HG LYS 28 1HG LYS 28 11.970 6.161 1.826
235 1HD LYS 28 2HD LYS 28 12.101 8.301 2.726
236 2HD LYS 28 1HD LYS 28 13.733 8.117 2.086
237 1HE LYS 28 2HE LYS 28 13.288 9.468 0.213
238 2HE LYS 28 1HE LYS 28 11.543 9.273 0.371
239 1HZ LYS 28 1HZ LYS 28 11.673 10.533 2.467
240 2HZ LYS 28 3HZ LYS 28 13.325 10.801 2.190
241 3HZ LYS 28 2HZ LYS 28 12.171 11.445 1.122
242 H GLY 29 H GLY 29 13.405 2.946 2.209
243 1HA GLY 29 2HA GLY 29 14.136 2.489 4.416
244 2HA GLY 29 1HA GLY 29 14.773 4.126 4.520
245 H GLN 30 H GLN 30 11.793 4.748 3.389
246 HA GLN 30 HA GLN 30 10.659 4.843 6.142
247 1HB GLN 30 2HB GLN 30 9.567 6.886 5.619
248 2HB GLN 30 1HB GLN 30 11.198 7.048 4.977
249 1HG GLN 30 2HG GLN 30 10.334 6.368 2.729
250 2HG GLN 30 1HG GLN 30 8.705 6.348 3.399
251 1HE2 GLN 30 2HE2 GLN 30 9.522 9.735 1.862
252 2HE2 GLN 30 1HE2 GLN 30 9.704 8.157 1.266
253 HA PRO 31 HA PRO 31 7.674 1.975 4.464
254 1HB PRO 31 2HB PRO 31 6.307 1.925 6.960
255 2HB PRO 31 1HB PRO 31 7.501 0.756 6.383
256 1HG PRO 31 2HG PRO 31 7.810 2.735 8.481
257 2HG PRO 31 1HG PRO 31 8.963 1.498 7.964
258 1HD PRO 31 2HD PRO 31 9.068 4.339 7.460
259 2HD PRO 31 1HD PRO 31 10.237 3.097 6.965
260 H MET 32 H MET 32 6.010 2.816 3.229
261 HA MET 32 HA MET 32 4.201 4.828 4.510
262 1HB MET 32 2HB MET 32 5.197 4.842 1.646
263 2HB MET 32 1HB MET 32 4.060 5.995 2.343
264 1HG MET 32 2HG MET 32 5.873 6.481 4.095
265 2HG MET 32 1HG MET 32 6.976 5.613 3.028
266 1HE MET 32 1HE MET 32 6.758 6.075 0.342
267 2HE MET 32 3HE MET 32 7.448 7.663 -0.021
268 3HE MET 32 2HE MET 32 8.210 6.620 1.177
269 H THR 33 H THR 33 2.490 5.022 2.182
270 HA THR 33 HA THR 33 1.361 2.269 2.031
271 HB THR 33 HB THR 33 -0.916 3.383 2.018
272 HG1 THR 33 HG1 THR 33 -0.763 5.461 1.797
273 1HG2 THR 33 1HG2 THR 33 0.263 2.314 4.040
274 2HG2 THR 33 3HG2 THR 33 0.580 3.967 4.570
275 3HG2 THR 33 2HG2 THR 33 -1.081 3.406 4.377
276 H PHE 34 H PHE 34 2.086 1.852 0.009
277 HA PHE 34 HA PHE 34 1.957 3.780 -2.172
278 1HB PHE 34 2HB PHE 34 2.669 0.856 -1.947
279 2HB PHE 34 1HB PHE 34 2.668 1.707 -3.489
280 HD1 PHE 34 HD1 PHE 34 3.766 2.700 -0.023
281 HD2 PHE 34 HD2 PHE 34 4.842 2.129 -4.139
282 HE1 PHE 34 HE1 PHE 34 6.026 3.605 0.442
283 HE2 PHE 34 HE2 PHE 34 7.107 3.035 -3.674
284 HZ PHE 34 HZ PHE 34 7.694 3.772 -1.382
285 H ARG 35 H ARG 35 0.579 3.569 -4.066
286 HA ARG 35 HA ARG 35 -2.060 2.532 -3.437
287 1HB ARG 35 2HB ARG 35 -2.793 3.635 -5.381
288 2HB ARG 35 1HB ARG 35 -1.511 4.665 -4.771
289 1HG ARG 35 2HG ARG 35 -0.003 3.175 -6.372
290 2HG ARG 35 1HG ARG 35 -1.539 2.913 -7.200
291 1HD ARG 35 2HD ARG 35 -1.420 5.664 -6.581
292 2HD ARG 35 1HD ARG 35 0.155 5.243 -7.230
293 HE ARG 35 HE ARG 35 -2.125 5.664 -8.782
294 1HH1 ARG 35 2HH1 ARG 35 -3.002 3.166 -9.354
295 2HH1 ARG 35 1HH1 ARG 35 -1.867 2.446 -10.434
296 1HH2 ARG 35 1HH2 ARG 35 0.674 4.694 -9.694
297 2HH2 ARG 35 2HH2 ARG 35 0.224 3.310 -10.628
298 H LEU 36 H LEU 36 -2.620 0.466 -3.735
299 HA LEU 36 HA LEU 36 -1.044 -1.486 -5.141
300 1HB LEU 36 2HB LEU 36 -2.503 -2.393 -3.519
301 2HB LEU 36 1HB LEU 36 -3.856 -1.398 -4.043
302 HG LEU 36 HG LEU 36 -2.868 -3.200 -6.140
303 1HD1 LEU 36 3HD1 LEU 36 -4.085 -4.344 -3.609
304 2HD1 LEU 36 2HD1 LEU 36 -3.839 -5.233 -5.111
305 3HD1 LEU 36 1HD1 LEU 36 -2.450 -4.648 -4.196
306 1HD2 LEU 36 1HD2 LEU 36 -5.027 -1.807 -6.032
307 2HD2 LEU 36 3HD2 LEU 36 -5.202 -3.488 -6.536
308 3HD2 LEU 36 2HD2 LEU 36 -5.615 -3.013 -4.889
309 H LEU 37 H LEU 37 -3.747 0.561 -5.956
310 HA LEU 37 HA LEU 37 -3.177 0.500 -8.807
311 1HB LEU 37 2HB LEU 37 -4.679 -1.587 -8.225
312 2HB LEU 37 1HB LEU 37 -5.961 -0.390 -8.048
313 HG LEU 37 HG LEU 37 -4.592 0.250 -10.447
314 1HD1 LEU 37 3HD1 LEU 37 -3.690 -2.061 -10.386
315 2HD1 LEU 37 2HD1 LEU 37 -5.335 -2.688 -10.272
316 3HD1 LEU 37 1HD1 LEU 37 -4.814 -1.838 -11.726
317 1HD2 LEU 37 2HD2 LEU 37 -7.016 0.556 -9.882
318 2HD2 LEU 37 1HD2 LEU 37 -6.768 -0.206 -11.453
319 3HD2 LEU 37 3HD2 LEU 37 -7.241 -1.182 -10.062
320 H LEU 38 H LEU 38 -3.320 2.319 -6.520
321 HA LEU 38 HA LEU 38 -4.112 4.385 -5.870
322 1HB LEU 38 2HB LEU 38 -4.251 5.916 -7.531
323 2HB LEU 38 1HB LEU 38 -3.606 4.581 -8.468
324 HG LEU 38 HG LEU 38 -6.404 4.217 -8.500
325 1HD1 LEU 38 1HD1 LEU 38 -6.024 6.851 -7.848
326 2HD1 LEU 38 3HD1 LEU 38 -6.040 6.930 -9.610
327 3HD1 LEU 38 2HD1 LEU 38 -7.416 6.242 -8.746
328 1HD2 LEU 38 3HD2 LEU 38 -4.791 3.706 -10.311
329 2HD2 LEU 38 2HD2 LEU 38 -6.134 4.683 -10.903
330 3HD2 LEU 38 1HD2 LEU 38 -4.569 5.434 -10.590
331 H VAL 39 H VAL 39 -5.883 1.922 -5.879
332 HA VAL 39 HA VAL 39 -8.615 2.778 -6.195
333 HB VAL 39 HB VAL 39 -7.404 0.574 -4.489
334 1HG1 VAL 39 2HG1 VAL 39 -10.227 1.396 -5.100
335 2HG1 VAL 39 1HG1 VAL 39 -9.863 -0.322 -4.947
336 3HG1 VAL 39 3HG1 VAL 39 -9.546 0.769 -3.600
337 1HG2 VAL 39 2HG2 VAL 39 -7.944 0.877 -7.352
338 2HG2 VAL 39 1HG2 VAL 39 -7.013 -0.364 -6.513
339 3HG2 VAL 39 3HG2 VAL 39 -8.762 -0.526 -6.665
340 H ASP 40 H ASP 40 -9.027 4.699 -5.095
341 HA ASP 40 HA ASP 40 -9.338 4.510 -2.187
342 1HB ASP 40 2HB ASP 40 -6.896 5.284 -2.780
343 2HB ASP 40 1HB ASP 40 -7.670 6.824 -3.148
344 H THR 41 H THR 41 -11.222 4.823 -4.280
345 HA THR 41 HA THR 41 -12.089 7.658 -3.953
346 HB THR 41 HB THR 41 -12.403 5.657 -6.185
347 HG1 THR 41 HG1 THR 41 -10.793 7.042 -6.560
348 1HG2 THR 41 3HG2 THR 41 -14.258 7.886 -5.425
349 2HG2 THR 41 2HG2 THR 41 -13.984 7.526 -7.130
350 3HG2 THR 41 1HG2 THR 41 -14.638 6.284 -6.060
351 HA PRO 42 HA PRO 42 -15.094 5.570 -1.304
352 1HB PRO 42 2HB PRO 42 -16.161 8.159 -0.665
353 2HB PRO 42 1HB PRO 42 -15.134 7.130 0.344
354 1HG PRO 42 2HG PRO 42 -14.401 9.579 -0.994
355 2HG PRO 42 1HG PRO 42 -13.384 8.552 0.024
356 1HD PRO 42 2HD PRO 42 -13.282 8.857 -2.845
357 2HD PRO 42 1HD PRO 42 -12.251 7.844 -1.815
358 H GLU 43 H GLU 43 -17.617 5.985 -1.126
359 HA GLU 43 HA GLU 43 -18.865 7.248 -3.441
360 1HB GLU 43 2HB GLU 43 -19.842 5.222 -4.388
361 2HB GLU 43 1HB GLU 43 -18.087 5.073 -4.385
362 1HG GLU 43 2HG GLU 43 -18.389 3.100 -3.325
363 2HG GLU 43 1HG GLU 43 -18.823 4.049 -1.903
364 H THR 44 H THR 44 -21.075 7.563 -3.118
365 HA THR 44 HA THR 44 -22.028 7.054 -0.362
366 HB THR 44 HB THR 44 -22.224 9.337 -1.406
367 HG1 THR 44 HG1 THR 44 -23.773 9.448 -0.022
368 1HG2 THR 44 2HG2 THR 44 -22.853 8.312 -3.695
369 2HG2 THR 44 1HG2 THR 44 -24.484 8.180 -3.037
370 3HG2 THR 44 3HG2 THR 44 -23.718 9.762 -3.188
371 H LYS 45 H LYS 45 -24.008 5.965 0.082
372 HA LYS 45 HA LYS 45 -25.501 4.695 -2.112
373 1HB LYS 45 2HB LYS 45 -23.346 3.295 -1.096
374 2HB LYS 45 1HB LYS 45 -24.689 2.676 -0.138
375 1HG LYS 45 2HG LYS 45 -25.936 2.442 -2.394
376 2HG LYS 45 1HG LYS 45 -24.346 2.624 -3.136
377 1HD LYS 45 2HD LYS 45 -24.822 0.609 -0.940
378 2HD LYS 45 1HD LYS 45 -25.159 0.220 -2.626
379 1HE LYS 45 2HE LYS 45 -22.845 0.742 -3.241
380 2HE LYS 45 1HE LYS 45 -22.493 1.222 -1.581
381 1HZ LYS 45 3HZ LYS 45 -23.437 -1.484 -2.350
382 2HZ LYS 45 2HZ LYS 45 -21.801 -1.076 -2.154
383 3HZ LYS 45 1HZ LYS 45 -22.864 -0.990 -0.832
384 H HIS 46 H HIS 46 -27.366 3.396 -1.200
385 HA HIS 46 HA HIS 46 -28.611 4.894 0.983
386 1HB HIS 46 2HB HIS 46 -30.603 3.590 0.480
387 2HB HIS 46 1HB HIS 46 -29.880 4.117 -1.035
388 HD1 HIS 46 HD1 HIS 46 -28.650 2.294 -2.475
389 HD2 HIS 46 HD2 HIS 46 -30.566 0.794 0.910
390 HE1 HIS 46 HE1 HIS 46 -28.735 -0.221 -2.756
391 HA PRO 47 HA PRO 47 -27.765 2.331 4.423
392 1HB PRO 47 2HB PRO 47 -30.493 2.023 5.293
393 2HB PRO 47 1HB PRO 47 -29.266 3.132 5.921
394 1HG PRO 47 2HG PRO 47 -31.567 3.783 4.312
395 2HG PRO 47 1HG PRO 47 -30.336 4.887 4.940
396 1HD PRO 47 2HD PRO 47 -30.710 4.029 2.215
397 2HD PRO 47 1HD PRO 47 -29.470 5.128 2.850
398 H LYS 48 H LYS 48 -27.178 0.246 3.989
399 HA LYS 48 HA LYS 48 -29.225 -1.845 3.819
400 1HB LYS 48 2HB LYS 48 -28.450 -2.758 1.666
401 2HB LYS 48 1HB LYS 48 -29.059 -1.118 1.455
402 1HG LYS 48 2HG LYS 48 -26.774 -0.232 1.490
403 2HG LYS 48 1HG LYS 48 -26.132 -1.848 1.786
404 1HD LYS 48 2HD LYS 48 -27.810 -2.067 -0.484
405 2HD LYS 48 1HD LYS 48 -26.831 -0.619 -0.728
406 1HE LYS 48 2HE LYS 48 -24.785 -1.880 -0.351
407 2HE LYS 48 1HE LYS 48 -25.709 -3.324 0.060
408 1HZ LYS 48 3HZ LYS 48 -25.821 -1.946 -2.568
409 2HZ LYS 48 2HZ LYS 48 -24.882 -3.324 -2.242
410 3HZ LYS 48 1HZ LYS 48 -26.576 -3.409 -2.159
411 H LYS 49 H LYS 49 -28.237 -4.024 3.953
412 HA LYS 49 HA LYS 49 -25.970 -4.077 5.738
413 1HB LYS 49 2HB LYS 49 -26.155 -6.515 5.601
414 2HB LYS 49 1HB LYS 49 -27.760 -5.805 5.762
415 1HG LYS 49 2HG LYS 49 -28.309 -7.047 3.949
416 2HG LYS 49 1HG LYS 49 -27.395 -5.860 3.017
417 1HD LYS 49 2HD LYS 49 -25.581 -7.251 2.763
418 2HD LYS 49 1HD LYS 49 -25.832 -8.035 4.324
419 1HE LYS 49 2HE LYS 49 -27.807 -9.218 3.383
420 2HE LYS 49 1HE LYS 49 -27.477 -8.482 1.815
421 1HZ LYS 49 3HZ LYS 49 -25.601 -10.230 3.317
422 2HZ LYS 49 2HZ LYS 49 -26.546 -10.716 1.991
423 3HZ LYS 49 1HZ LYS 49 -25.324 -9.553 1.787
424 H GLY 50 H GLY 50 -23.815 -4.667 5.325
425 1HA GLY 50 2HA GLY 50 -22.975 -4.425 2.486
426 2HA GLY 50 1HA GLY 50 -21.923 -4.232 3.887
427 H VAL 51 H VAL 51 -20.378 -5.752 3.214
428 HA VAL 51 HA VAL 51 -21.030 -8.547 3.761
429 HB VAL 51 HB VAL 51 -21.718 -8.285 1.370
430 1HG1 VAL 51 1HG1 VAL 51 -19.932 -6.500 0.927
431 2HG1 VAL 51 3HG1 VAL 51 -18.786 -7.832 0.784
432 3HG1 VAL 51 2HG1 VAL 51 -20.147 -7.718 -0.329
433 1HG2 VAL 51 1HG2 VAL 51 -20.757 -10.426 2.311
434 2HG2 VAL 51 3HG2 VAL 51 -20.551 -10.242 0.570
435 3HG2 VAL 51 2HG2 VAL 51 -19.194 -9.940 1.655
436 H GLU 52 H GLU 52 -19.196 -9.655 4.415
437 HA GLU 52 HA GLU 52 -16.856 -8.166 5.122
438 1HB GLU 52 2HB GLU 52 -17.591 -10.233 6.299
439 2HB GLU 52 1HB GLU 52 -17.158 -11.177 4.874
440 1HG GLU 52 2HG GLU 52 -15.348 -11.232 6.558
441 2HG GLU 52 1HG GLU 52 -14.815 -10.434 5.080
442 H LYS 53 H LYS 53 -15.141 -7.602 3.887
443 HA LYS 53 HA LYS 53 -14.489 -9.246 1.482
444 1HB LYS 53 2HB LYS 53 -15.233 -6.375 1.620
445 2HB LYS 53 1HB LYS 53 -13.844 -6.759 0.604
446 1HG LYS 53 2HG LYS 53 -16.149 -8.584 0.289
447 2HG LYS 53 1HG LYS 53 -16.442 -6.926 -0.234
448 1HD LYS 53 2HD LYS 53 -15.526 -7.774 -2.177
449 2HD LYS 53 1HD LYS 53 -14.049 -7.246 -1.369
450 1HE LYS 53 2HE LYS 53 -14.141 -9.670 -0.310
451 2HE LYS 53 1HE LYS 53 -15.121 -10.021 -1.732
452 1HZ LYS 53 1HZ LYS 53 -13.336 -9.105 -3.110
453 2HZ LYS 53 3HZ LYS 53 -12.386 -8.865 -1.725
454 3HZ LYS 53 2HZ LYS 53 -12.814 -10.440 -2.199
455 H TYR 54 H TYR 54 -12.329 -9.645 1.271
456 HA TYR 54 HA TYR 54 -10.403 -7.964 2.820
457 1HB TYR 54 2HB TYR 54 -10.667 -10.977 2.828
458 2HB TYR 54 1HB TYR 54 -9.157 -10.178 3.261
459 HD1 TYR 54 HD2 TYR 54 -9.781 -7.914 4.829
460 HD2 TYR 54 HD1 TYR 54 -11.854 -11.673 4.699
461 HE1 TYR 54 HE2 TYR 54 -10.648 -7.515 7.118
462 HE2 TYR 54 HE1 TYR 54 -12.720 -11.275 6.987
463 HH TYR 54 HH TYR 54 -11.657 -9.618 9.093
464 H GLY 55 H GLY 55 -10.529 -10.689 0.481
465 1HA GLY 55 2HA GLY 55 -8.484 -9.227 -1.144
466 2HA GLY 55 1HA GLY 55 -8.409 -10.972 -0.914
467 HA PRO 56 HA PRO 56 -11.763 -9.450 -4.157
468 1HB PRO 56 2HB PRO 56 -9.945 -8.539 -6.179
469 2HB PRO 56 1HB PRO 56 -11.153 -7.592 -5.302
470 1HG PRO 56 2HG PRO 56 -8.284 -7.497 -5.013
471 2HG PRO 56 1HG PRO 56 -9.495 -6.537 -4.155
472 1HD PRO 56 2HD PRO 56 -7.907 -8.716 -3.127
473 2HD PRO 56 1HD PRO 56 -9.101 -7.729 -2.262
474 H GLU 57 H GLU 57 -11.006 -9.924 -6.924
475 HA GLU 57 HA GLU 57 -10.044 -12.752 -6.754
476 1HB GLU 57 2HB GLU 57 -11.457 -12.880 -9.011
477 2HB GLU 57 1HB GLU 57 -12.219 -13.116 -7.443
478 1HG GLU 57 2HG GLU 57 -12.069 -10.295 -8.328
479 2HG GLU 57 1HG GLU 57 -13.089 -11.328 -9.324
480 H ALA 58 H ALA 58 -10.469 -10.172 -9.229
481 HA ALA 58 HA ALA 58 -8.087 -11.121 -10.666
482 1HB ALA 58 2HB ALA 58 -9.886 -8.718 -11.113
483 2HB ALA 58 1HB ALA 58 -8.581 -9.212 -12.192
484 3HB ALA 58 3HB ALA 58 -9.980 -10.261 -11.962
485 H SER 59 H SER 59 -9.070 -8.165 -8.902
486 HA SER 59 HA SER 59 -6.431 -6.971 -9.022
487 1HB SER 59 2HB SER 59 -7.414 -5.531 -7.103
488 2HB SER 59 1HB SER 59 -8.172 -5.415 -8.687
489 HG SER 59 HG SER 59 -9.735 -5.700 -7.075
490 H ALA 60 H ALA 60 -7.867 -9.430 -7.042
491 HA ALA 60 HA ALA 60 -6.388 -9.131 -4.624
492 1HB ALA 60 2HB ALA 60 -7.858 -11.305 -5.980
493 2HB ALA 60 1HB ALA 60 -6.574 -11.850 -4.899
494 3HB ALA 60 3HB ALA 60 -7.870 -10.825 -4.282
495 H PHE 61 H PHE 61 -5.504 -10.516 -7.766
496 HA PHE 61 HA PHE 61 -3.073 -11.810 -7.005
497 1HB PHE 61 2HB PHE 61 -3.889 -10.457 -9.596
498 2HB PHE 61 1HB PHE 61 -2.402 -11.387 -9.413
499 HD1 PHE 61 HD2 PHE 61 -2.751 -13.788 -8.278
500 HD2 PHE 61 HD1 PHE 61 -5.784 -11.574 -10.364
501 HE1 PHE 61 HE2 PHE 61 -4.015 -15.886 -8.670
502 HE2 PHE 61 HE1 PHE 61 -7.046 -13.671 -10.755
503 HZ PHE 61 HZ PHE 61 -6.162 -15.827 -9.908
504 H THR 62 H THR 62 -3.803 -8.453 -7.878
505 HA THR 62 HA THR 62 -1.069 -7.512 -7.743
506 HB THR 62 HB THR 62 -3.686 -5.988 -7.500
507 HG1 THR 62 HG1 THR 62 -3.725 -6.525 -9.526
508 1HG2 THR 62 3HG2 THR 62 -0.829 -5.079 -7.886
509 2HG2 THR 62 2HG2 THR 62 -2.224 -4.051 -8.207
510 3HG2 THR 62 1HG2 THR 62 -1.923 -4.644 -6.575
511 H LYS 63 H LYS 63 -3.671 -7.991 -5.409
512 HA LYS 63 HA LYS 63 -2.694 -6.436 -3.233
513 1HB LYS 63 2HB LYS 63 -4.873 -7.948 -3.522
514 2HB LYS 63 1HB LYS 63 -3.860 -9.154 -2.728
515 1HG LYS 63 2HG LYS 63 -3.556 -7.777 -0.801
516 2HG LYS 63 1HG LYS 63 -4.216 -6.363 -1.622
517 1HD LYS 63 2HD LYS 63 -6.013 -7.095 -0.286
518 2HD LYS 63 1HD LYS 63 -6.380 -7.780 -1.869
519 1HE LYS 63 2HE LYS 63 -6.373 -9.840 -0.969
520 2HE LYS 63 1HE LYS 63 -4.685 -9.627 -0.510
521 1HZ LYS 63 2HZ LYS 63 -7.002 -8.675 1.086
522 2HZ LYS 63 1HZ LYS 63 -6.145 -10.109 1.389
523 3HZ LYS 63 3HZ LYS 63 -5.366 -8.610 1.539
524 H LYS 64 H LYS 64 -1.827 -9.617 -4.464
525 HA LYS 64 HA LYS 64 0.124 -10.159 -2.366
526 1HB LYS 64 2HB LYS 64 -0.697 -11.513 -4.949
527 2HB LYS 64 1HB LYS 64 0.702 -12.067 -4.030
528 1HG LYS 64 2HG LYS 64 -0.734 -13.297 -2.809
529 2HG LYS 64 1HG LYS 64 -1.272 -11.776 -2.099
530 1HD LYS 64 2HD LYS 64 -3.141 -11.631 -3.475
531 2HD LYS 64 1HD LYS 64 -2.421 -12.638 -4.731
532 1HE LYS 64 2HE LYS 64 -3.893 -14.167 -3.817
533 2HE LYS 64 1HE LYS 64 -2.485 -14.472 -2.800
534 1HZ LYS 64 3HZ LYS 64 -3.385 -12.907 -1.174
535 2HZ LYS 64 2HZ LYS 64 -4.757 -12.672 -2.149
536 3HZ LYS 64 1HZ LYS 64 -4.455 -14.193 -1.456
537 H MET 65 H MET 65 1.938 -11.160 -4.789
538 HA MET 65 HA MET 65 3.744 -10.317 -6.001
539 1HB MET 65 2HB MET 65 2.611 -8.955 -7.450
540 2HB MET 65 1HB MET 65 1.686 -8.185 -6.170
541 1HG MET 65 2HG MET 65 4.524 -7.488 -6.039
542 2HG MET 65 1HG MET 65 3.797 -7.044 -7.580
543 1HE MET 65 2HE MET 65 2.246 -5.452 -8.058
544 2HE MET 65 1HE MET 65 0.881 -6.154 -7.193
545 3HE MET 65 3HE MET 65 1.284 -4.446 -6.979
546 H LEU 66 H LEU 66 2.720 -7.666 -3.820
547 HA LEU 66 HA LEU 66 5.495 -7.260 -2.941
548 1HB LEU 66 2HB LEU 66 4.451 -5.197 -3.143
549 2HB LEU 66 1HB LEU 66 2.879 -5.828 -2.670
550 HG LEU 66 HG LEU 66 4.003 -6.143 -0.317
551 1HD1 LEU 66 1HD1 LEU 66 5.777 -4.060 -1.623
552 2HD1 LEU 66 3HD1 LEU 66 5.720 -4.385 0.108
553 3HD1 LEU 66 2HD1 LEU 66 6.290 -5.629 -1.003
554 1HD2 LEU 66 3HD2 LEU 66 2.203 -4.470 -1.111
555 2HD2 LEU 66 2HD2 LEU 66 3.111 -4.055 0.342
556 3HD2 LEU 66 1HD2 LEU 66 3.518 -3.299 -1.198
557 H GLU 67 H GLU 67 2.651 -9.018 -1.885
558 HA GLU 67 HA GLU 67 3.449 -9.041 0.937
559 1HB GLU 67 2HB GLU 67 1.513 -10.282 1.339
560 2HB GLU 67 1HB GLU 67 1.061 -9.311 -0.060
561 1HG GLU 67 2HG GLU 67 1.231 -11.134 -1.537
562 2HG GLU 67 1HG GLU 67 2.246 -12.058 -0.434
563 H ASN 68 H ASN 68 4.708 -10.630 -1.748
564 HA ASN 68 HA ASN 68 5.805 -12.772 0.017
565 1HB ASN 68 2HB ASN 68 5.583 -14.414 -1.766
566 2HB ASN 68 1HB ASN 68 4.007 -13.702 -1.425
567 1HD2 ASN 68 2HD2 ASN 68 3.941 -11.867 -4.560
568 2HD2 ASN 68 1HD2 ASN 68 3.451 -11.717 -2.940
569 H ALA 69 H ALA 69 6.302 -10.783 -2.902
570 HA ALA 69 HA ALA 69 8.930 -11.770 -3.525
571 1HB ALA 69 3HB ALA 69 7.482 -10.417 -5.067
572 2HB ALA 69 2HB ALA 69 7.841 -9.001 -4.079
573 3HB ALA 69 1HB ALA 69 9.139 -9.829 -4.942
574 H LYS 70 H LYS 70 10.968 -10.934 -3.044
575 HA LYS 70 HA LYS 70 11.114 -9.371 -0.508
576 1HB LYS 70 2HB LYS 70 12.342 -11.644 -0.931
577 2HB LYS 70 1HB LYS 70 13.469 -10.670 -1.874
578 1HG LYS 70 2HG LYS 70 13.798 -9.189 0.100
579 2HG LYS 70 1HG LYS 70 12.740 -10.244 1.039
580 1HD LYS 70 2HD LYS 70 15.033 -11.501 -0.412
581 2HD LYS 70 1HD LYS 70 15.387 -10.578 1.049
582 1HE LYS 70 2HE LYS 70 14.202 -12.027 2.421
583 2HE LYS 70 1HE LYS 70 13.136 -12.554 1.118
584 1HZ LYS 70 1HZ LYS 70 16.019 -13.230 1.344
585 2HZ LYS 70 3HZ LYS 70 14.740 -14.266 1.753
586 3HZ LYS 70 2HZ LYS 70 14.953 -13.776 0.140
587 H LYS 71 H LYS 71 12.610 -9.526 -3.749
588 HA LYS 71 HA LYS 71 13.658 -6.768 -3.471
589 1HB LYS 71 2HB LYS 71 14.204 -9.062 -5.169
590 2HB LYS 71 1HB LYS 71 13.898 -7.632 -6.155
591 1HG LYS 71 2HG LYS 71 15.595 -6.374 -4.952
592 2HG LYS 71 1HG LYS 71 15.832 -7.708 -3.821
593 1HD LYS 71 2HD LYS 71 16.815 -9.090 -5.476
594 2HD LYS 71 1HD LYS 71 16.220 -8.077 -6.792
595 1HE LYS 71 2HE LYS 71 18.458 -7.418 -6.663
596 2HE LYS 71 1HE LYS 71 17.668 -6.209 -5.652
597 1HZ LYS 71 1HZ LYS 71 18.902 -8.712 -4.636
598 2HZ LYS 71 3HZ LYS 71 19.650 -7.190 -4.610
599 3HZ LYS 71 2HZ LYS 71 18.239 -7.458 -3.701
600 H ILE 72 H ILE 72 12.684 -4.961 -4.563
601 HA ILE 72 HA ILE 72 10.399 -5.563 -6.315
602 HB ILE 72 HB ILE 72 10.192 -4.173 -3.669
603 1HG1 ILE 72 2HG1 ILE 72 8.613 -6.343 -5.074
604 2HG1 ILE 72 1HG1 ILE 72 9.685 -6.552 -3.691
605 1HG2 ILE 72 3HG2 ILE 72 9.200 -2.874 -5.756
606 2HG2 ILE 72 2HG2 ILE 72 7.920 -4.075 -5.612
607 3HG2 ILE 72 1HG2 ILE 72 8.282 -3.004 -4.260
608 1HD1 ILE 72 3HD1 ILE 72 7.886 -4.564 -2.888
609 2HD1 ILE 72 2HD1 ILE 72 6.894 -5.743 -3.748
610 3HD1 ILE 72 1HD1 ILE 72 7.880 -6.252 -2.379
611 H GLU 73 H GLU 73 10.664 -4.357 -8.032
612 HA GLU 73 HA GLU 73 12.188 -1.838 -7.923
613 1HB GLU 73 2HB GLU 73 10.954 -3.413 -10.204
614 2HB GLU 73 1HB GLU 73 11.796 -1.881 -10.426
615 1HG GLU 73 2HG GLU 73 13.358 -3.705 -8.784
616 2HG GLU 73 1HG GLU 73 12.966 -4.427 -10.344
617 H VAL 74 H VAL 74 10.528 -0.781 -6.545
618 HA VAL 74 HA VAL 74 7.822 -0.397 -7.162
619 HB VAL 74 HB VAL 74 9.000 2.137 -6.312
620 1HG1 VAL 74 1HG1 VAL 74 6.801 0.357 -5.709
621 2HG1 VAL 74 3HG1 VAL 74 7.554 0.965 -4.234
622 3HG1 VAL 74 2HG1 VAL 74 6.940 2.096 -5.443
623 1HG2 VAL 74 1HG2 VAL 74 9.795 -0.388 -4.869
624 2HG2 VAL 74 3HG2 VAL 74 10.814 0.973 -5.336
625 3HG2 VAL 74 2HG2 VAL 74 9.649 1.152 -4.026
626 H GLU 75 H GLU 75 6.950 0.207 -9.034
627 HA GLU 75 HA GLU 75 8.384 2.154 -10.774
628 1HB GLU 75 2HB GLU 75 7.815 -0.035 -11.773
629 2HB GLU 75 1HB GLU 75 6.119 0.217 -11.370
630 1HG GLU 75 2HG GLU 75 5.841 1.867 -12.985
631 2HG GLU 75 1HG GLU 75 7.553 2.277 -13.009
632 H PHE 76 H PHE 76 7.704 4.188 -10.009
633 HA PHE 76 HA PHE 76 4.790 4.682 -10.215
634 1HB PHE 76 2HB PHE 76 4.807 5.985 -8.100
635 2HB PHE 76 1HB PHE 76 5.107 4.268 -7.887
636 HD1 PHE 76 HD1 PHE 76 7.502 3.459 -7.554
637 HD2 PHE 76 HD2 PHE 76 6.374 7.600 -7.355
638 HE1 PHE 76 HE1 PHE 76 9.612 3.979 -6.359
639 HE2 PHE 76 HE2 PHE 76 8.485 8.120 -6.167
640 HZ PHE 76 HZ PHE 76 10.103 6.308 -5.665
641 H ASP 77 H ASP 77 6.327 5.467 -12.209
642 HA ASP 77 HA ASP 77 7.175 7.248 -13.459
643 1HB ASP 77 2HB ASP 77 5.651 9.056 -13.651
644 2HB ASP 77 1HB ASP 77 4.678 7.669 -13.187
645 H LYS 78 H LYS 78 7.611 9.831 -13.256
646 HA LYS 78 HA LYS 78 9.916 10.040 -11.524
647 1HB LYS 78 2HB LYS 78 10.012 12.395 -12.308
648 2HB LYS 78 1HB LYS 78 9.793 11.274 -13.647
649 1HG LYS 78 2HG LYS 78 7.187 11.904 -12.782
650 2HG LYS 78 1HG LYS 78 8.063 13.434 -12.772
651 1HD LYS 78 2HD LYS 78 8.712 13.156 -15.081
652 2HD LYS 78 1HD LYS 78 8.071 11.513 -15.112
653 1HE LYS 78 2HE LYS 78 5.797 12.402 -14.693
654 2HE LYS 78 1HE LYS 78 6.446 14.042 -14.711
655 1HZ LYS 78 2HZ LYS 78 6.572 12.107 -16.962
656 2HZ LYS 78 1HZ LYS 78 5.521 13.438 -16.857
657 3HZ LYS 78 3HZ LYS 78 7.194 13.688 -16.979
658 H GLY 79 H GLY 79 9.332 9.852 -9.315
659 1HA GLY 79 2HA GLY 79 8.860 10.906 -7.250
660 2HA GLY 79 1HA GLY 79 8.120 12.242 -8.130
661 H GLN 80 H GLN 80 6.967 11.054 -5.862
662 HA GLN 80 HA GLN 80 4.923 9.122 -6.529
663 1HB GLN 80 2HB GLN 80 5.425 10.967 -4.205
664 2HB GLN 80 1HB GLN 80 3.903 10.081 -4.322
665 1HG GLN 80 2HG GLN 80 4.949 7.997 -4.156
666 2HG GLN 80 1HG GLN 80 6.511 8.627 -4.679
667 1HE2 GLN 80 2HE2 GLN 80 5.423 9.619 -0.829
668 2HE2 GLN 80 1HE2 GLN 80 4.252 9.691 -2.055
669 H ARG 81 H ARG 81 5.079 12.650 -6.565
670 HA ARG 81 HA ARG 81 3.704 14.147 -7.762
671 1HB ARG 81 2HB ARG 81 3.020 12.032 -9.113
672 2HB ARG 81 1HB ARG 81 1.589 12.026 -8.084
673 1HG ARG 81 2HG ARG 81 0.965 13.298 -9.992
674 2HG ARG 81 1HG ARG 81 1.298 14.489 -8.735
675 1HD ARG 81 2HD ARG 81 3.774 13.966 -10.010
676 2HD ARG 81 1HD ARG 81 2.588 14.159 -11.298
677 HE ARG 81 HE ARG 81 3.691 16.331 -10.046
678 1HH1 ARG 81 1HH2 ARG 81 1.978 16.729 -7.897
679 2HH1 ARG 81 2HH2 ARG 81 0.535 17.439 -8.542
680 1HH2 ARG 81 2HH1 ARG 81 1.207 16.479 -11.814
681 2HH2 ARG 81 1HH1 ARG 81 0.098 17.298 -10.765
682 H THR 82 H THR 82 2.016 11.910 -5.526
683 HA THR 82 HA THR 82 0.327 14.163 -4.591
684 HB THR 82 HB THR 82 -0.601 12.207 -3.094
685 HG1 THR 82 HG1 THR 82 0.201 10.337 -3.545
686 1HG2 THR 82 3HG2 THR 82 -0.999 12.432 -6.087
687 2HG2 THR 82 2HG2 THR 82 -2.079 11.551 -5.008
688 3HG2 THR 82 1HG2 THR 82 -1.890 13.295 -4.835
689 H ASP 83 H ASP 83 1.307 11.626 -2.376
690 HA ASP 83 HA ASP 83 2.513 11.675 -0.386
691 1HB ASP 83 2HB ASP 83 4.303 12.540 -2.033
692 2HB ASP 83 1HB ASP 83 3.931 14.142 -1.398
693 H LYS 84 H LYS 84 0.209 13.837 -1.145
694 HA LYS 84 HA LYS 84 0.299 15.063 1.559
695 1HB LYS 84 2HB LYS 84 -0.277 16.569 -1.015
696 2HB LYS 84 1HB LYS 84 -0.459 17.233 0.608
697 1HG LYS 84 2HG LYS 84 2.160 16.084 -0.381
698 2HG LYS 84 1HG LYS 84 1.735 17.781 -0.592
699 1HD LYS 84 2HD LYS 84 1.827 18.234 1.686
700 2HD LYS 84 1HD LYS 84 1.482 16.565 2.137
701 1HE LYS 84 2HE LYS 84 3.882 16.408 0.711
702 2HE LYS 84 1HE LYS 84 4.056 17.860 1.697
703 1HZ LYS 84 1HZ LYS 84 3.410 16.562 3.640
704 2HZ LYS 84 3HZ LYS 84 3.281 15.166 2.683
705 3HZ LYS 84 2HZ LYS 84 4.793 15.910 2.898
706 H TYR 85 H TYR 85 -1.232 12.895 0.015
707 HA TYR 85 HA TYR 85 -3.690 12.896 1.264
708 1HB TYR 85 2HB TYR 85 -4.634 14.815 0.328
709 2HB TYR 85 1HB TYR 85 -3.703 14.670 -1.162
710 HD1 TYR 85 HD1 TYR 85 -6.470 13.040 0.765
711 HD2 TYR 85 HD2 TYR 85 -4.659 13.685 -3.078
712 HE1 TYR 85 HE1 TYR 85 -8.363 11.868 -0.323
713 HE2 TYR 85 HE2 TYR 85 -6.556 12.518 -4.166
714 HH TYR 85 HH TYR 85 -8.419 10.537 -2.983
715 H GLY 86 H GLY 86 -2.223 12.512 -1.956
716 1HA GLY 86 2HA GLY 86 -3.715 10.056 -2.511
717 2HA GLY 86 1HA GLY 86 -2.476 10.774 -3.533
718 H ARG 87 H ARG 87 -1.362 10.551 -0.336
719 HA ARG 87 HA ARG 87 0.272 9.202 0.660
720 1HB ARG 87 2HB ARG 87 -0.941 6.962 -0.964
721 2HB ARG 87 1HB ARG 87 -0.049 6.826 0.544
722 1HG ARG 87 2HG ARG 87 -2.019 6.850 1.582
723 2HG ARG 87 1HG ARG 87 -2.118 8.557 1.159
724 1HD ARG 87 2HD ARG 87 -4.125 7.153 0.454
725 2HD ARG 87 1HD ARG 87 -3.368 8.080 -0.839
726 HE ARG 87 HE ARG 87 -2.093 5.612 -0.957
727 1HH1 ARG 87 2HH1 ARG 87 -4.713 4.561 0.146
728 2HH1 ARG 87 1HH1 ARG 87 -5.584 4.212 -1.309
729 1HH2 ARG 87 1HH2 ARG 87 -3.482 6.097 -3.333
730 2HH2 ARG 87 2HH2 ARG 87 -4.884 5.082 -3.285
731 H VAL 88 H VAL 88 1.261 6.753 -0.703
732 HA VAL 88 HA VAL 88 3.237 8.043 -2.477
733 HB VAL 88 HB VAL 88 3.050 5.238 -1.366
734 1HG1 VAL 88 2HG1 VAL 88 4.991 6.676 -3.095
735 2HG1 VAL 88 1HG1 VAL 88 5.700 5.715 -1.801
736 3HG1 VAL 88 3HG1 VAL 88 4.645 4.953 -2.989
737 1HG2 VAL 88 1HG2 VAL 88 4.412 7.734 -0.328
738 2HG2 VAL 88 3HG2 VAL 88 3.267 6.689 0.513
739 3HG2 VAL 88 2HG2 VAL 88 4.901 6.118 0.180
740 H LEU 89 H LEU 89 1.343 8.230 -4.134
741 HA LEU 89 HA LEU 89 0.091 5.962 -5.304
742 1HB LEU 89 2HB LEU 89 1.036 8.497 -6.711
743 2HB LEU 89 1HB LEU 89 -0.137 7.349 -7.353
744 HG LEU 89 HG LEU 89 -0.476 8.908 -4.774
745 1HD1 LEU 89 1HD1 LEU 89 -1.608 9.302 -7.554
746 2HD1 LEU 89 3HD1 LEU 89 -2.273 10.077 -6.115
747 3HD1 LEU 89 2HD1 LEU 89 -0.624 10.436 -6.628
748 1HD2 LEU 89 3HD2 LEU 89 -1.645 6.717 -4.823
749 2HD2 LEU 89 2HD2 LEU 89 -2.785 8.062 -4.858
750 3HD2 LEU 89 1HD2 LEU 89 -2.419 7.178 -6.338
751 H ALA 90 H ALA 90 1.441 4.207 -5.577
752 HA ALA 90 HA ALA 90 3.384 4.301 -7.766
753 1HB ALA 90 3HB ALA 90 4.181 3.829 -4.884
754 2HB ALA 90 2HB ALA 90 5.202 3.387 -6.251
755 3HB ALA 90 1HB ALA 90 4.790 5.078 -5.967
756 H TYR 91 H TYR 91 3.642 2.294 -8.704
757 HA TYR 91 HA TYR 91 2.008 0.073 -7.670
758 1HB TYR 91 2HB TYR 91 3.491 0.659 -10.190
759 2HB TYR 91 1HB TYR 91 3.306 -1.039 -9.749
760 HD1 TYR 91 HD2 TYR 91 0.849 -1.654 -8.839
761 HD2 TYR 91 HD1 TYR 91 1.788 1.629 -11.446
762 HE1 TYR 91 HE2 TYR 91 -1.509 -1.586 -9.606
763 HE2 TYR 91 HE1 TYR 91 -0.570 1.695 -12.207
764 HH TYR 91 HH TYR 91 -2.546 -0.355 -12.238
765 H ILE 92 H ILE 92 3.171 -2.180 -7.582
766 HA ILE 92 HA ILE 92 5.941 -1.806 -6.487
767 HB ILE 92 HB ILE 92 3.906 -3.650 -5.206
768 1HG1 ILE 92 2HG1 ILE 92 3.153 -1.260 -5.052
769 2HG1 ILE 92 1HG1 ILE 92 3.568 -1.950 -3.485
770 1HG2 ILE 92 2HG2 ILE 92 6.581 -2.507 -4.350
771 2HG2 ILE 92 1HG2 ILE 92 5.534 -3.472 -3.311
772 3HG2 ILE 92 3HG2 ILE 92 6.236 -4.188 -4.760
773 1HD1 ILE 92 1HD1 ILE 92 5.976 -0.883 -4.508
774 2HD1 ILE 92 3HD1 ILE 92 4.738 0.331 -4.830
775 3HD1 ILE 92 2HD1 ILE 92 5.007 -0.240 -3.184
776 H TYR 93 H TYR 93 7.182 -2.929 -7.898
777 HA TYR 93 HA TYR 93 6.086 -5.501 -8.913
778 1HB TYR 93 2HB TYR 93 8.137 -3.670 -10.165
779 2HB TYR 93 1HB TYR 93 7.562 -5.183 -10.864
780 HD1 TYR 93 HD2 TYR 93 4.662 -4.555 -9.559
781 HD2 TYR 93 HD1 TYR 93 7.318 -2.530 -12.244
782 HE1 TYR 93 HE2 TYR 93 2.747 -3.388 -10.546
783 HE2 TYR 93 HE1 TYR 93 5.398 -1.363 -13.245
784 HH TYR 93 HH TYR 93 2.993 -0.689 -12.417
785 H ALA 94 H ALA 94 7.583 -7.231 -9.336
786 HA ALA 94 HA ALA 94 10.197 -7.147 -8.042
787 1HB ALA 94 1HB ALA 94 8.467 -7.743 -6.268
788 2HB ALA 94 3HB ALA 94 8.159 -9.214 -7.190
789 3HB ALA 94 2HB ALA 94 9.753 -8.928 -6.491
790 H ASP 95 H ASP 95 10.106 -10.175 -8.001
791 HA ASP 95 HA ASP 95 11.164 -10.655 -10.617
792 1HB ASP 95 2HB ASP 95 11.580 -11.969 -8.466
793 2HB ASP 95 1HB ASP 95 10.036 -12.765 -8.770
794 H GLY 96 H GLY 96 9.597 -9.999 -12.177
795 1HA GLY 96 2HA GLY 96 7.897 -10.447 -13.753
796 2HA GLY 96 1HA GLY 96 7.654 -12.012 -12.974
797 H LYS 97 H LYS 97 7.607 -9.134 -11.051
798 HA LYS 97 HA LYS 97 4.681 -9.491 -10.753
799 1HB LYS 97 2HB LYS 97 6.794 -9.246 -8.839
800 2HB LYS 97 1HB LYS 97 5.711 -7.864 -8.675
801 1HG LYS 97 2HG LYS 97 4.652 -9.420 -7.326
802 2HG LYS 97 1HG LYS 97 3.827 -9.678 -8.863
803 1HD LYS 97 2HD LYS 97 5.551 -11.485 -9.352
804 2HD LYS 97 1HD LYS 97 6.074 -11.327 -7.675
805 1HE LYS 97 2HE LYS 97 4.059 -12.155 -6.828
806 2HE LYS 97 1HE LYS 97 3.160 -11.741 -8.288
807 1HZ LYS 97 3HZ LYS 97 4.368 -13.474 -9.471
808 2HZ LYS 97 2HZ LYS 97 5.213 -13.876 -8.054
809 3HZ LYS 97 1HZ LYS 97 3.534 -14.116 -8.140
810 H MET 98 H MET 98 5.023 -8.115 -12.885
811 HA MET 98 HA MET 98 5.250 -5.238 -12.285
812 1HB MET 98 2HB MET 98 5.693 -6.883 -14.620
813 2HB MET 98 1HB MET 98 4.442 -5.698 -14.985
814 1HG MET 98 2HG MET 98 6.520 -4.642 -15.513
815 2HG MET 98 1HG MET 98 5.996 -3.941 -13.982
816 1HE MET 98 1HE MET 98 8.144 -3.065 -14.155
817 2HE MET 98 3HE MET 98 9.367 -3.649 -13.018
818 3HE MET 98 2HE MET 98 9.517 -4.004 -14.737
819 H VAL 99 H VAL 99 3.183 -7.121 -11.263
820 HA VAL 99 HA VAL 99 0.936 -7.234 -10.916
821 HB VAL 99 HB VAL 99 1.703 -4.576 -11.102
822 1HG1 VAL 99 2HG1 VAL 99 0.521 -4.704 -13.433
823 2HG1 VAL 99 1HG1 VAL 99 -0.972 -4.771 -12.497
824 3HG1 VAL 99 3HG1 VAL 99 0.098 -3.377 -12.352
825 1HG2 VAL 99 2HG2 VAL 99 0.243 -6.017 -9.492
826 2HG2 VAL 99 1HG2 VAL 99 -0.008 -4.273 -9.578
827 3HG2 VAL 99 3HG2 VAL 99 -1.103 -5.364 -10.425
828 H ASN 100 H ASN 100 2.299 -8.077 -13.473
829 HA ASN 100 HA ASN 100 0.274 -7.691 -15.576
830 1HB ASN 100 2HB ASN 100 1.713 -9.180 -16.912
831 2HB ASN 100 1HB ASN 100 2.657 -7.899 -16.156
832 1HD2 ASN 100 2HD2 ASN 100 4.692 -10.154 -14.374
833 2HD2 ASN 100 1HD2 ASN 100 4.424 -8.562 -14.894
834 H GLU 101 H GLU 101 0.025 -9.475 -12.855
835 HA GLU 101 HA GLU 101 -0.578 -12.119 -13.640
836 1HB GLU 101 2HB GLU 101 -0.760 -10.660 -11.284
837 2HB GLU 101 1HB GLU 101 -2.439 -11.073 -11.632
838 1HG GLU 101 2HG GLU 101 -0.109 -13.009 -11.438
839 2HG GLU 101 1HG GLU 101 -1.440 -12.854 -10.293
840 H ALA 102 H ALA 102 -2.716 -9.250 -13.585
841 HA ALA 102 HA ALA 102 -5.017 -10.707 -14.600
842 1HB ALA 102 2HB ALA 102 -4.437 -7.727 -14.532
843 2HB ALA 102 1HB ALA 102 -6.002 -8.449 -14.906
844 3HB ALA 102 3HB ALA 102 -5.304 -8.641 -13.297
845 H LEU 103 HN LEU 103 -5.262 -11.373 -16.669
846 HA LEU 103 HA LEU 103 -3.928 -9.806 -18.841
847 1HB LEU 103 2HB LEU 103 -2.834 -12.055 -18.267
848 2HB LEU 103 1HB LEU 103 -4.293 -12.809 -18.909
849 HG LEU 103 HG LEU 103 -3.209 -10.731 -20.675
850 1HD1 LEU 103 3HD1 LEU 103 -1.552 -13.188 -20.031
851 2HD1 LEU 103 2HD1 LEU 103 -1.304 -12.167 -21.447
852 3HD1 LEU 103 1HD1 LEU 103 -1.064 -11.506 -19.830
853 1HD2 LEU 103 3HD2 LEU 103 -3.886 -13.672 -21.015
854 2HD2 LEU 103 2HD2 LEU 103 -4.963 -12.315 -21.342
855 3HD2 LEU 103 1HD2 LEU 103 -3.526 -12.559 -22.335
No H/Q in entry = 855
Start of MODEL 8
Raw file had 866 H/Q atoms
Start of MODEL 8
1 1H ALA 1 1H ALA 1 7.141 13.434 -24.323
2 2H ALA 1 3H ALA 1 5.603 13.941 -23.814
3 3H ALA 1 2H ALA 1 6.968 14.887 -23.457
4 HA ALA 1 HA ALA 1 6.253 13.684 -21.495
5 1HB ALA 1 3HB ALA 1 6.729 11.265 -23.268
6 2HB ALA 1 2HB ALA 1 6.454 11.190 -21.527
7 3HB ALA 1 1HB ALA 1 5.183 11.785 -22.596
8 H THR 2 H THR 2 7.921 13.591 -20.019
9 HA THR 2 HA THR 2 10.630 12.800 -20.984
10 HB THR 2 HB THR 2 11.511 14.761 -19.548
11 HG1 THR 2 HG1 THR 2 10.065 16.020 -18.730
12 1HG2 THR 2 1HG2 THR 2 11.615 14.679 -22.019
13 2HG2 THR 2 3HG2 THR 2 9.992 15.363 -22.101
14 3HG2 THR 2 2HG2 THR 2 11.317 16.318 -21.437
15 H SER 3 H SER 3 9.049 13.985 -17.977
16 HA SER 3 HA SER 3 9.793 11.459 -16.643
17 1HB SER 3 2HB SER 3 10.792 12.763 -14.717
18 2HB SER 3 1HB SER 3 11.750 12.790 -16.193
19 HG SER 3 HG SER 3 11.251 14.854 -16.493
20 H THR 4 H THR 4 7.277 11.787 -17.146
21 HA THR 4 HA THR 4 6.070 12.764 -14.596
22 HB THR 4 HB THR 4 4.052 13.458 -16.020
23 HG1 THR 4 HG1 THR 4 4.322 12.821 -18.013
24 1HG2 THR 4 1HG2 THR 4 5.715 15.030 -14.980
25 2HG2 THR 4 3HG2 THR 4 6.616 15.000 -16.496
26 3HG2 THR 4 2HG2 THR 4 4.977 15.651 -16.457
27 H LYS 5 H LYS 5 5.524 10.841 -13.671
28 HA LYS 5 HA LYS 5 4.514 8.757 -13.355
29 1HB LYS 5 2HB LYS 5 2.664 10.385 -14.647
30 2HB LYS 5 1HB LYS 5 2.661 8.914 -15.619
31 1HG LYS 5 2HG LYS 5 1.051 8.510 -13.924
32 2HG LYS 5 1HG LYS 5 2.490 7.645 -13.384
33 1HD LYS 5 2HD LYS 5 1.952 8.785 -11.438
34 2HD LYS 5 1HD LYS 5 3.026 9.960 -12.196
35 1HE LYS 5 2HE LYS 5 1.236 11.346 -11.755
36 2HE LYS 5 1HE LYS 5 0.738 10.749 -13.337
37 1HZ LYS 5 1HZ LYS 5 -0.528 8.996 -12.201
38 2HZ LYS 5 3HZ LYS 5 -0.107 9.670 -10.701
39 3HZ LYS 5 2HZ LYS 5 -1.069 10.553 -11.787
40 H LYS 6 H LYS 6 6.860 8.745 -14.933
41 HA LYS 6 HA LYS 6 6.402 7.085 -17.306
42 1HB LYS 6 2HB LYS 6 8.813 7.113 -17.555
43 2HB LYS 6 1HB LYS 6 8.276 8.741 -17.144
44 1HG LYS 6 2HG LYS 6 8.735 8.029 -14.687
45 2HG LYS 6 1HG LYS 6 9.684 6.727 -15.399
46 1HD LYS 6 2HD LYS 6 10.109 9.564 -16.308
47 2HD LYS 6 1HD LYS 6 10.865 8.994 -14.820
48 1HE LYS 6 2HE LYS 6 11.146 7.646 -17.523
49 2HE LYS 6 1HE LYS 6 12.348 8.714 -16.803
50 1HZ LYS 6 1HZ LYS 6 11.943 6.992 -14.810
51 2HZ LYS 6 3HZ LYS 6 11.667 5.974 -16.137
52 3HZ LYS 6 2HZ LYS 6 13.147 6.795 -15.992
53 H LEU 7 H LEU 7 6.967 6.567 -13.933
54 HA LEU 7 HA LEU 7 7.041 4.613 -12.660
55 1HB LEU 7 2HB LEU 7 5.957 3.672 -15.252
56 2HB LEU 7 1HB LEU 7 6.722 2.429 -14.265
57 HG LEU 7 HG LEU 7 5.237 3.846 -12.407
58 1HD1 LEU 7 1HD1 LEU 7 3.641 3.607 -14.977
59 2HD1 LEU 7 3HD1 LEU 7 2.969 4.008 -13.396
60 3HD1 LEU 7 2HD1 LEU 7 4.100 5.111 -14.179
61 1HD2 LEU 7 1HD2 LEU 7 5.439 1.247 -13.346
62 2HD2 LEU 7 3HD2 LEU 7 4.395 1.774 -12.026
63 3HD2 LEU 7 2HD2 LEU 7 3.750 1.645 -13.662
64 H HIS 8 H HIS 8 9.295 5.066 -12.314
65 HA HIS 8 HA HIS 8 11.324 3.908 -14.071
66 1HB HIS 8 2HB HIS 8 11.367 6.010 -12.370
67 2HB HIS 8 1HB HIS 8 12.025 4.771 -11.303
68 HD1 HIS 8 HD1 HIS 8 13.480 7.272 -12.974
69 HD2 HIS 8 HD2 HIS 8 13.873 3.167 -13.566
70 HE1 HIS 8 HE1 HIS 8 15.689 6.929 -14.160
71 H LYS 9 H LYS 9 12.864 3.091 -11.454
72 HA LYS 9 HA LYS 9 11.403 0.760 -10.497
73 1HB LYS 9 2HB LYS 9 13.344 -0.776 -11.381
74 2HB LYS 9 1HB LYS 9 12.004 -0.371 -12.452
75 1HG LYS 9 2HG LYS 9 13.301 1.385 -13.509
76 2HG LYS 9 1HG LYS 9 14.611 1.174 -12.347
77 1HD LYS 9 2HD LYS 9 15.468 -0.138 -14.024
78 2HD LYS 9 1HD LYS 9 14.443 -1.356 -13.265
79 1HE LYS 9 2HE LYS 9 13.806 -1.510 -15.515
80 2HE LYS 9 1HE LYS 9 12.588 -0.420 -14.856
81 1HZ LYS 9 3HZ LYS 9 13.926 1.457 -15.615
82 2HZ LYS 9 2HZ LYS 9 15.067 0.388 -16.280
83 3HZ LYS 9 1HZ LYS 9 13.490 0.449 -16.907
84 H GLU 10 H GLU 10 12.199 0.157 -8.510
85 HA GLU 10 HA GLU 10 14.980 0.546 -7.737
86 1HB GLU 10 2HB GLU 10 13.695 2.851 -7.543
87 2HB GLU 10 1HB GLU 10 13.009 2.118 -6.093
88 1HG GLU 10 2HG GLU 10 15.974 1.966 -6.493
89 2HG GLU 10 1HG GLU 10 15.278 3.502 -5.981
90 HA PRO 11 HA PRO 11 13.505 -2.984 -5.516
91 1HB PRO 11 2HB PRO 11 15.763 -2.699 -3.699
92 2HB PRO 11 1HB PRO 11 15.448 -3.965 -4.894
93 1HG PRO 11 2HG PRO 11 17.374 -1.887 -5.107
94 2HG PRO 11 1HG PRO 11 16.897 -3.024 -6.375
95 1HD PRO 11 2HD PRO 11 16.308 -0.187 -6.198
96 2HD PRO 11 1HD PRO 11 15.919 -1.312 -7.516
97 H ALA 12 H ALA 12 12.474 -3.391 -3.535
98 HA ALA 12 HA ALA 12 12.382 -1.168 -1.548
99 1HB ALA 12 1HB ALA 12 10.377 -1.713 -3.424
100 2HB ALA 12 3HB ALA 12 9.793 -2.424 -1.919
101 3HB ALA 12 2HB ALA 12 10.226 -0.717 -1.978
102 H THR 13 H THR 13 10.276 -2.463 0.003
103 HA THR 13 HA THR 13 11.311 -5.154 0.634
104 HB THR 13 HB THR 13 12.734 -3.622 1.977
105 HG1 THR 13 HG1 THR 13 12.425 -5.463 3.038
106 1HG2 THR 13 3HG2 THR 13 10.603 -1.988 2.125
107 2HG2 THR 13 2HG2 THR 13 10.423 -2.818 3.669
108 3HG2 THR 13 1HG2 THR 13 11.912 -1.945 3.306
109 H LEU 14 H LEU 14 9.585 -6.433 1.107
110 HA LEU 14 HA LEU 14 6.926 -5.358 1.129
111 1HB LEU 14 2HB LEU 14 6.171 -7.613 1.516
112 2HB LEU 14 1HB LEU 14 7.535 -7.690 0.406
113 HG LEU 14 HG LEU 14 8.781 -7.866 2.856
114 1HD1 LEU 14 3HD1 LEU 14 6.179 -8.194 3.559
115 2HD1 LEU 14 2HD1 LEU 14 6.598 -9.861 3.168
116 3HD1 LEU 14 1HD1 LEU 14 7.509 -8.989 4.399
117 1HD2 LEU 14 3HD2 LEU 14 7.967 -9.723 0.694
118 2HD2 LEU 14 2HD2 LEU 14 9.566 -9.411 1.369
119 3HD2 LEU 14 1HD2 LEU 14 8.447 -10.485 2.211
120 H ILE 15 H ILE 15 6.052 -4.231 2.765
121 HA ILE 15 HA ILE 15 6.774 -5.074 5.539
122 HB ILE 15 HB ILE 15 5.916 -2.555 5.989
123 1HG1 ILE 15 2HG1 ILE 15 7.272 -2.399 3.279
124 2HG1 ILE 15 1HG1 ILE 15 5.539 -2.218 3.521
125 1HG2 ILE 15 1HG2 ILE 15 8.691 -3.325 5.032
126 2HG2 ILE 15 3HG2 ILE 15 8.300 -1.904 6.000
127 3HG2 ILE 15 2HG2 ILE 15 8.078 -3.518 6.674
128 1HD1 ILE 15 3HD1 ILE 15 6.300 -0.416 5.308
129 2HD1 ILE 15 2HD1 ILE 15 7.761 -0.382 4.322
130 3HD1 ILE 15 1HD1 ILE 15 6.201 0.004 3.598
131 H LYS 16 H LYS 16 4.735 -6.359 4.175
132 HA LYS 16 HA LYS 16 2.625 -7.202 4.745
133 1HB LYS 16 2HB LYS 16 3.227 -5.937 7.023
134 2HB LYS 16 1HB LYS 16 1.919 -4.885 6.481
135 1HG LYS 16 2HG LYS 16 0.481 -6.404 7.326
136 2HG LYS 16 1HG LYS 16 0.968 -7.477 6.013
137 1HD LYS 16 2HD LYS 16 1.368 -8.761 7.952
138 2HD LYS 16 1HD LYS 16 2.958 -8.115 7.547
139 1HE LYS 16 2HE LYS 16 2.490 -6.208 9.141
140 2HE LYS 16 1HE LYS 16 1.039 -7.072 9.649
141 1HZ LYS 16 3HZ LYS 16 3.810 -8.139 9.777
142 2HZ LYS 16 2HZ LYS 16 2.924 -7.538 11.097
143 3HZ LYS 16 1HZ LYS 16 2.409 -8.944 10.294
144 H ALA 17 H ALA 17 0.742 -7.032 3.641
145 HA ALA 17 HA ALA 17 0.270 -4.576 2.046
146 1HB ALA 17 1HB ALA 17 -0.286 -7.415 1.748
147 2HB ALA 17 3HB ALA 17 -1.740 -6.456 1.477
148 3HB ALA 17 2HB ALA 17 -0.291 -6.148 0.523
149 H ILE 18 H ILE 18 -2.425 -4.466 1.731
150 HA ILE 18 HA ILE 18 -3.647 -4.403 4.442
151 HB ILE 18 HB ILE 18 -3.139 -2.047 2.636
152 1HG1 ILE 18 2HG1 ILE 18 -3.090 -1.491 5.444
153 2HG1 ILE 18 1HG1 ILE 18 -2.187 -2.978 5.164
154 1HG2 ILE 18 2HG2 ILE 18 -5.404 -2.418 4.607
155 2HG2 ILE 18 1HG2 ILE 18 -4.778 -0.819 4.207
156 3HG2 ILE 18 3HG2 ILE 18 -5.488 -1.828 2.946
157 1HD1 ILE 18 3HD1 ILE 18 -1.411 -1.286 3.071
158 2HD1 ILE 18 2HD1 ILE 18 -1.469 -0.241 4.490
159 3HD1 ILE 18 1HD1 ILE 18 -0.459 -1.687 4.502
160 H ASP 19 H ASP 19 -4.361 -3.408 1.051
161 HA ASP 19 HA ASP 19 -6.776 -5.145 1.105
162 1HB ASP 19 2HB ASP 19 -7.013 -2.473 1.648
163 2HB ASP 19 1HB ASP 19 -7.207 -2.476 -0.104
164 H GLY 20 H GLY 20 -7.713 -3.866 -1.442
165 1HA GLY 20 2HA GLY 20 -6.516 -5.528 -3.358
166 2HA GLY 20 1HA GLY 20 -7.356 -4.032 -3.760
167 H ASP 21 H ASP 21 -6.081 -2.039 -3.852
168 HA ASP 21 HA ASP 21 -3.272 -2.568 -4.630
169 1HB ASP 21 2HB ASP 21 -5.137 -0.233 -5.005
170 2HB ASP 21 1HB ASP 21 -3.397 -0.002 -5.152
171 H THR 22 H THR 22 -4.909 -1.805 -1.818
172 HA THR 22 HA THR 22 -3.059 0.165 -0.745
173 HB THR 22 HB THR 22 -4.800 -1.587 0.958
174 HG1 THR 22 HG1 THR 22 -5.631 0.529 -0.726
175 1HG2 THR 22 1HG2 THR 22 -3.909 1.295 1.039
176 2HG2 THR 22 3HG2 THR 22 -5.078 0.602 2.164
177 3HG2 THR 22 2HG2 THR 22 -3.423 -0.005 2.126
178 H VAL 23 H VAL 23 -0.954 -0.520 -0.458
179 HA VAL 23 HA VAL 23 -0.498 -2.915 1.231
180 HB VAL 23 HB VAL 23 1.276 -3.745 -0.311
181 1HG1 VAL 23 2HG1 VAL 23 -1.236 -4.449 -0.343
182 2HG1 VAL 23 1HG1 VAL 23 -1.290 -3.574 -1.874
183 3HG1 VAL 23 3HG1 VAL 23 -0.199 -4.945 -1.680
184 1HG2 VAL 23 1HG2 VAL 23 0.159 -1.547 -2.077
185 2HG2 VAL 23 3HG2 VAL 23 1.828 -1.755 -1.543
186 3HG2 VAL 23 2HG2 VAL 23 1.126 -2.883 -2.702
187 H LYS 24 H LYS 24 1.575 -2.897 2.287
188 HA LYS 24 HA LYS 24 2.748 -0.172 2.424
189 1HB LYS 24 2HB LYS 24 2.015 -1.872 4.425
190 2HB LYS 24 1HB LYS 24 3.724 -2.275 4.264
191 1HG LYS 24 2HG LYS 24 4.198 0.225 4.356
192 2HG LYS 24 1HG LYS 24 2.511 0.438 4.830
193 1HD LYS 24 2HD LYS 24 2.876 -1.097 6.748
194 2HD LYS 24 1HD LYS 24 4.575 -1.234 6.294
195 1HE LYS 24 2HE LYS 24 4.565 1.376 6.415
196 2HE LYS 24 1HE LYS 24 3.100 1.158 7.372
197 1HZ LYS 24 1HZ LYS 24 4.362 -0.336 8.834
198 2HZ LYS 24 3HZ LYS 24 5.769 -0.016 7.943
199 3HZ LYS 24 2HZ LYS 24 5.009 1.234 8.807
200 H LEU 25 H LEU 25 4.901 0.220 1.900
201 HA LEU 25 HA LEU 25 6.753 -1.988 1.405
202 1HB LEU 25 2HB LEU 25 5.551 -2.023 -0.706
203 2HB LEU 25 1HB LEU 25 5.741 -0.283 -0.884
204 HG LEU 25 HG LEU 25 8.256 -1.791 -0.482
205 1HD1 LEU 25 3HD1 LEU 25 6.339 -2.448 -2.627
206 2HD1 LEU 25 2HD1 LEU 25 7.963 -2.062 -3.195
207 3HD1 LEU 25 1HD1 LEU 25 7.721 -3.366 -2.033
208 1HD2 LEU 25 2HD2 LEU 25 7.266 0.671 -1.708
209 2HD2 LEU 25 1HD2 LEU 25 8.886 0.280 -1.138
210 3HD2 LEU 25 3HD2 LEU 25 8.386 -0.189 -2.762
211 H MET 26 H MET 26 8.670 -1.271 2.164
212 HA MET 26 HA MET 26 9.146 1.657 2.328
213 1HB MET 26 2HB MET 26 9.653 -0.475 4.085
214 2HB MET 26 1HB MET 26 11.240 -0.003 3.477
215 1HG MET 26 2HG MET 26 11.021 2.207 4.267
216 2HG MET 26 1HG MET 26 9.270 2.072 4.422
217 1HE MET 26 2HE MET 26 12.532 0.782 5.192
218 2HE MET 26 1HE MET 26 12.700 1.352 6.850
219 3HE MET 26 3HE MET 26 12.343 -0.351 6.528
220 H TYR 27 H TYR 27 9.880 2.279 0.308
221 HA TYR 27 HA TYR 27 12.128 0.746 -0.906
222 1HB TYR 27 2HB TYR 27 11.571 1.724 -2.974
223 2HB TYR 27 1HB TYR 27 10.001 1.470 -2.218
224 HD1 TYR 27 HD2 TYR 27 8.878 3.399 -1.028
225 HD2 TYR 27 HD1 TYR 27 12.345 3.913 -3.503
226 HE1 TYR 27 HE2 TYR 27 8.423 5.829 -1.159
227 HE2 TYR 27 HE1 TYR 27 11.893 6.343 -3.634
228 HH TYR 27 HH TYR 27 10.563 8.059 -2.006
229 H LYS 28 H LYS 28 11.291 3.923 0.424
230 HA LYS 28 HA LYS 28 14.150 4.712 0.123
231 1HB LYS 28 2HB LYS 28 11.888 6.078 -0.759
232 2HB LYS 28 1HB LYS 28 12.325 6.904 0.734
233 1HG LYS 28 2HG LYS 28 13.554 7.996 -1.006
234 2HG LYS 28 1HG LYS 28 14.714 6.979 -0.152
235 1HD LYS 28 2HD LYS 28 13.641 5.295 -2.106
236 2HD LYS 28 1HD LYS 28 13.837 6.842 -2.929
237 1HE LYS 28 2HE LYS 28 16.150 6.888 -2.573
238 2HE LYS 28 1HE LYS 28 16.062 5.769 -1.212
239 1HZ LYS 28 1HZ LYS 28 15.227 4.109 -2.951
240 2HZ LYS 28 3HZ LYS 28 15.862 5.184 -4.100
241 3HZ LYS 28 2HZ LYS 28 16.885 4.483 -2.938
242 H GLY 29 H GLY 29 12.967 3.097 2.263
243 1HA GLY 29 2HA GLY 29 13.349 2.929 4.567
244 2HA GLY 29 1HA GLY 29 14.098 4.521 4.515
245 H GLN 30 H GLN 30 11.039 4.704 3.092
246 HA GLN 30 HA GLN 30 9.880 5.667 5.664
247 1HB GLN 30 2HB GLN 30 8.561 7.261 4.356
248 2HB GLN 30 1HB GLN 30 10.271 7.452 3.980
249 1HG GLN 30 2HG GLN 30 9.573 5.603 2.109
250 2HG GLN 30 1HG GLN 30 8.054 6.482 2.265
251 1HE2 GLN 30 2HE2 GLN 30 9.484 8.664 -0.168
252 2HE2 GLN 30 1HE2 GLN 30 8.360 7.415 0.079
253 HA PRO 31 HA PRO 31 6.926 2.395 5.121
254 1HB PRO 31 2HB PRO 31 5.230 3.447 7.144
255 2HB PRO 31 1HB PRO 31 6.476 2.209 7.348
256 1HG PRO 31 2HG PRO 31 6.516 4.960 8.278
257 2HG PRO 31 1HG PRO 31 7.700 3.683 8.583
258 1HD PRO 31 2HD PRO 31 7.955 5.945 6.808
259 2HD PRO 31 1HD PRO 31 9.147 4.668 7.128
260 H MET 32 H MET 32 5.555 2.563 3.343
261 HA MET 32 HA MET 32 3.612 4.854 3.319
262 1HB MET 32 2HB MET 32 3.760 4.848 0.865
263 2HB MET 32 1HB MET 32 5.334 5.153 1.596
264 1HG MET 32 2HG MET 32 5.514 2.499 1.446
265 2HG MET 32 1HG MET 32 4.349 2.733 0.147
266 1HE MET 32 3HE MET 32 6.990 4.535 1.810
267 2HE MET 32 2HE MET 32 8.442 4.094 0.919
268 3HE MET 32 1HE MET 32 7.615 5.604 0.549
269 H THR 33 H THR 33 1.702 4.400 1.849
270 HA THR 33 HA THR 33 0.861 1.540 1.961
271 HB THR 33 HB THR 33 -0.934 3.926 2.444
272 HG1 THR 33 HG1 THR 33 0.074 3.849 4.305
273 1HG2 THR 33 1HG2 THR 33 -1.327 0.935 2.628
274 2HG2 THR 33 3HG2 THR 33 -2.463 2.103 3.302
275 3HG2 THR 33 2HG2 THR 33 -2.168 2.064 1.565
276 H PHE 34 H PHE 34 1.770 1.676 -0.238
277 HA PHE 34 HA PHE 34 1.248 3.261 -2.371
278 1HB PHE 34 2HB PHE 34 1.358 0.282 -2.136
279 2HB PHE 34 1HB PHE 34 1.019 1.019 -3.703
280 HD1 PHE 34 HD1 PHE 34 3.431 1.017 -0.863
281 HD2 PHE 34 HD2 PHE 34 2.732 2.011 -4.978
282 HE1 PHE 34 HE1 PHE 34 5.831 1.541 -1.146
283 HE2 PHE 34 HE2 PHE 34 5.136 2.531 -5.263
284 HZ PHE 34 HZ PHE 34 6.685 2.301 -3.338
285 H ARG 35 H ARG 35 -0.465 3.990 -3.536
286 HA ARG 35 HA ARG 35 -2.936 2.387 -3.631
287 1HB ARG 35 2HB ARG 35 -2.665 4.542 -1.907
288 2HB ARG 35 1HB ARG 35 -3.525 5.210 -3.291
289 1HG ARG 35 2HG ARG 35 -5.366 4.339 -2.273
290 2HG ARG 35 1HG ARG 35 -4.812 2.820 -2.971
291 1HD ARG 35 2HD ARG 35 -4.593 1.987 -0.897
292 2HD ARG 35 1HD ARG 35 -3.337 3.183 -0.578
293 HE ARG 35 HE ARG 35 -5.639 4.614 -0.150
294 1HH1 ARG 35 2HH1 ARG 35 -7.223 2.335 0.601
295 2HH1 ARG 35 1HH1 ARG 35 -6.820 2.053 2.262
296 1HH2 ARG 35 1HH2 ARG 35 -3.902 3.942 2.146
297 2HH2 ARG 35 2HH2 ARG 35 -4.932 2.968 3.139
298 H LEU 36 H LEU 36 -0.644 3.571 -5.490
299 HA LEU 36 HA LEU 36 -0.528 4.805 -7.549
300 1HB LEU 36 2HB LEU 36 -2.155 3.591 -9.210
301 2HB LEU 36 1HB LEU 36 -0.862 2.672 -8.460
302 HG LEU 36 HG LEU 36 -3.338 2.738 -6.875
303 1HD1 LEU 36 2HD1 LEU 36 -3.332 1.858 -9.715
304 2HD1 LEU 36 1HD1 LEU 36 -4.136 0.810 -8.549
305 3HD1 LEU 36 3HD1 LEU 36 -4.655 2.483 -8.732
306 1HD2 LEU 36 2HD2 LEU 36 -1.039 1.055 -7.391
307 2HD2 LEU 36 1HD2 LEU 36 -2.166 1.007 -6.037
308 3HD2 LEU 36 3HD2 LEU 36 -2.528 0.122 -7.517
309 H LEU 37 H LEU 37 -3.837 4.243 -8.405
310 HA LEU 37 HA LEU 37 -4.403 7.120 -8.422
311 1HB LEU 37 2HB LEU 37 -5.269 5.437 -10.162
312 2HB LEU 37 1HB LEU 37 -6.326 4.809 -8.899
313 HG LEU 37 HG LEU 37 -6.926 7.413 -8.654
314 1HD1 LEU 37 1HD1 LEU 37 -6.183 7.058 -11.576
315 2HD1 LEU 37 3HD1 LEU 37 -7.015 8.454 -10.892
316 3HD1 LEU 37 2HD1 LEU 37 -5.351 8.105 -10.426
317 1HD2 LEU 37 2HD2 LEU 37 -8.009 5.454 -10.699
318 2HD2 LEU 37 1HD2 LEU 37 -8.589 5.703 -9.052
319 3HD2 LEU 37 3HD2 LEU 37 -8.822 6.959 -10.268
320 H LEU 38 H LEU 38 -5.728 4.173 -6.941
321 HA LEU 38 HA LEU 38 -5.622 4.227 -4.416
322 1HB LEU 38 2HB LEU 38 -6.978 5.786 -3.213
323 2HB LEU 38 1HB LEU 38 -5.844 6.650 -4.222
324 HG LEU 38 HG LEU 38 -7.643 7.895 -4.841
325 1HD1 LEU 38 3HD1 LEU 38 -7.941 5.421 -6.466
326 2HD1 LEU 38 2HD1 LEU 38 -9.300 6.536 -6.465
327 3HD1 LEU 38 1HD1 LEU 38 -7.708 7.089 -6.976
328 1HD2 LEU 38 1HD2 LEU 38 -9.154 5.687 -3.533
329 2HD2 LEU 38 3HD2 LEU 38 -9.173 7.417 -3.202
330 3HD2 LEU 38 2HD2 LEU 38 -10.046 6.775 -4.593
331 H VAL 39 H VAL 39 -6.335 2.184 -5.092
332 HA VAL 39 HA VAL 39 -8.726 1.318 -6.112
333 HB VAL 39 HB VAL 39 -6.728 0.206 -4.293
334 1HG1 VAL 39 3HG1 VAL 39 -9.613 -0.618 -3.949
335 2HG1 VAL 39 2HG1 VAL 39 -8.298 -1.764 -3.696
336 3HG1 VAL 39 1HG1 VAL 39 -8.399 -0.308 -2.710
337 1HG2 VAL 39 3HG2 VAL 39 -7.269 -0.213 -6.800
338 2HG2 VAL 39 2HG2 VAL 39 -6.849 -1.604 -5.800
339 3HG2 VAL 39 1HG2 VAL 39 -8.536 -1.281 -6.198
340 H ASP 40 H ASP 40 -8.359 2.070 -2.579
341 HA ASP 40 HA ASP 40 -11.140 2.979 -2.524
342 1HB ASP 40 2HB ASP 40 -11.710 1.346 -0.611
343 2HB ASP 40 1HB ASP 40 -11.737 0.714 -2.251
344 H THR 41 H THR 41 -9.451 4.754 -1.976
345 HA THR 41 HA THR 41 -8.449 4.729 0.782
346 HB THR 41 HB THR 41 -8.410 6.819 -1.418
347 HG1 THR 41 HG1 THR 41 -7.104 4.882 -1.615
348 1HG2 THR 41 3HG2 THR 41 -7.072 6.819 1.294
349 2HG2 THR 41 2HG2 THR 41 -6.797 8.004 0.016
350 3HG2 THR 41 1HG2 THR 41 -8.380 7.886 0.783
351 HA PRO 42 HA PRO 42 -12.426 6.428 2.086
352 1HB PRO 42 2HB PRO 42 -11.565 6.367 4.795
353 2HB PRO 42 1HB PRO 42 -12.576 5.169 3.977
354 1HG PRO 42 2HG PRO 42 -9.817 4.893 4.834
355 2HG PRO 42 1HG PRO 42 -10.868 3.667 4.112
356 1HD PRO 42 2HD PRO 42 -8.676 5.076 2.869
357 2HD PRO 42 1HD PRO 42 -9.718 3.830 2.158
358 H GLU 43 H GLU 43 -12.800 8.641 2.131
359 HA GLU 43 HA GLU 43 -10.592 10.402 3.084
360 1HB GLU 43 2HB GLU 43 -11.479 12.116 1.651
361 2HB GLU 43 1HB GLU 43 -11.426 10.634 0.701
362 1HG GLU 43 2HG GLU 43 -13.698 10.507 0.535
363 2HG GLU 43 1HG GLU 43 -13.950 11.067 2.187
364 H THR 44 H THR 44 -12.276 12.724 3.392
365 HA THR 44 HA THR 44 -13.838 11.931 5.817
366 HB THR 44 HB THR 44 -13.268 14.287 6.636
367 HG1 THR 44 HG1 THR 44 -12.385 15.421 5.100
368 1HG2 THR 44 3HG2 THR 44 -12.164 12.265 7.509
369 2HG2 THR 44 2HG2 THR 44 -10.989 12.337 6.195
370 3HG2 THR 44 1HG2 THR 44 -11.029 13.612 7.414
371 H LYS 45 H LYS 45 -15.684 11.744 4.297
372 HA LYS 45 HA LYS 45 -17.115 14.314 4.090
373 1HB LYS 45 2HB LYS 45 -15.987 12.903 1.759
374 2HB LYS 45 1HB LYS 45 -17.705 13.265 1.611
375 1HG LYS 45 2HG LYS 45 -15.768 15.377 2.545
376 2HG LYS 45 1HG LYS 45 -16.004 15.067 0.825
377 1HD LYS 45 2HD LYS 45 -18.322 15.623 0.941
378 2HD LYS 45 1HD LYS 45 -18.316 15.587 2.704
379 1HE LYS 45 2HE LYS 45 -16.464 17.485 1.312
380 2HE LYS 45 1HE LYS 45 -18.177 17.894 1.398
381 1HZ LYS 45 1HZ LYS 45 -16.445 17.216 3.715
382 2HZ LYS 45 3HZ LYS 45 -16.954 18.777 3.287
383 3HZ LYS 45 2HZ LYS 45 -18.093 17.622 3.793
384 H HIS 46 H HIS 46 -17.571 11.104 2.560
385 HA HIS 46 HA HIS 46 -19.822 10.556 4.417
386 1HB HIS 46 2HB HIS 46 -20.040 10.865 1.421
387 2HB HIS 46 1HB HIS 46 -21.172 9.849 2.314
388 HD1 HIS 46 HD1 HIS 46 -20.173 13.421 1.788
389 HD2 HIS 46 HD2 HIS 46 -22.927 11.276 4.069
390 HE1 HIS 46 HE1 HIS 46 -21.787 15.120 2.746
391 HA PRO 47 HA PRO 47 -17.092 6.909 3.674
392 1HB PRO 47 2HB PRO 47 -17.770 6.070 6.334
393 2HB PRO 47 1HB PRO 47 -16.218 6.691 5.757
394 1HG PRO 47 2HG PRO 47 -18.132 8.029 7.454
395 2HG PRO 47 1HG PRO 47 -16.571 8.635 6.890
396 1HD PRO 47 2HD PRO 47 -19.199 9.453 6.030
397 2HD PRO 47 1HD PRO 47 -17.629 10.062 5.469
398 H LYS 48 H LYS 48 -17.906 4.969 2.916
399 HA LYS 48 HA LYS 48 -20.784 4.527 2.936
400 1HB LYS 48 2HB LYS 48 -18.923 3.867 1.148
401 2HB LYS 48 1HB LYS 48 -18.881 2.377 2.091
402 1HG LYS 48 2HG LYS 48 -21.263 2.039 1.768
403 2HG LYS 48 1HG LYS 48 -21.416 3.605 0.971
404 1HD LYS 48 2HD LYS 48 -19.623 2.670 -0.680
405 2HD LYS 48 1HD LYS 48 -20.103 1.095 -0.046
406 1HE LYS 48 2HE LYS 48 -22.174 3.065 -1.004
407 2HE LYS 48 1HE LYS 48 -21.349 1.998 -2.141
408 1HZ LYS 48 1HZ LYS 48 -22.067 0.101 -0.819
409 2HZ LYS 48 3HZ LYS 48 -22.875 1.132 0.259
410 3HZ LYS 48 2HZ LYS 48 -23.400 1.010 -1.352
411 H LYS 49 H LYS 49 -21.916 3.395 4.428
412 HA LYS 49 HA LYS 49 -20.395 1.675 6.350
413 1HB LYS 49 2HB LYS 49 -22.930 3.297 6.650
414 2HB LYS 49 1HB LYS 49 -22.470 2.053 7.813
415 1HG LYS 49 2HG LYS 49 -20.322 3.965 7.099
416 2HG LYS 49 1HG LYS 49 -21.677 4.655 7.993
417 1HD LYS 49 2HD LYS 49 -20.652 2.052 8.993
418 2HD LYS 49 1HD LYS 49 -19.581 3.437 9.201
419 1HE LYS 49 2HE LYS 49 -20.818 3.698 11.120
420 2HE LYS 49 1HE LYS 49 -21.884 4.567 10.016
421 1HZ LYS 49 3HZ LYS 49 -22.126 1.669 10.610
422 2HZ LYS 49 2HZ LYS 49 -23.016 2.876 11.409
423 3HZ LYS 49 1HZ LYS 49 -23.219 2.632 9.740
424 H GLY 50 H GLY 50 -21.701 -0.202 7.222
425 1HA GLY 50 2HA GLY 50 -23.950 -1.429 6.498
426 2HA GLY 50 1HA GLY 50 -23.079 -1.563 4.971
427 H VAL 51 H VAL 51 -22.046 -3.478 4.739
428 HA VAL 51 HA VAL 51 -20.714 -4.688 7.116
429 HB VAL 51 HB VAL 51 -21.493 -6.953 6.094
430 1HG1 VAL 51 3HG1 VAL 51 -22.181 -6.069 8.302
431 2HG1 VAL 51 2HG1 VAL 51 -23.466 -5.147 7.522
432 3HG1 VAL 51 1HG1 VAL 51 -23.509 -6.910 7.502
433 1HG2 VAL 51 2HG2 VAL 51 -22.493 -5.786 4.064
434 2HG2 VAL 51 1HG2 VAL 51 -23.566 -6.923 4.882
435 3HG2 VAL 51 3HG2 VAL 51 -23.760 -5.188 5.136
436 H GLU 52 H GLU 52 -19.738 -3.223 4.743
437 HA GLU 52 HA GLU 52 -18.543 -5.063 2.885
438 1HB GLU 52 2HB GLU 52 -17.139 -3.091 2.252
439 2HB GLU 52 1HB GLU 52 -18.865 -2.738 2.270
440 1HG GLU 52 2HG GLU 52 -17.779 -2.256 4.893
441 2HG GLU 52 1HG GLU 52 -16.812 -1.393 3.697
442 H LYS 53 H LYS 53 -16.996 -6.510 3.416
443 HA LYS 53 HA LYS 53 -14.619 -5.677 4.916
444 1HB LYS 53 2HB LYS 53 -16.780 -6.761 6.356
445 2HB LYS 53 1HB LYS 53 -15.628 -8.085 6.191
446 1HG LYS 53 2HG LYS 53 -13.831 -6.632 7.065
447 2HG LYS 53 1HG LYS 53 -14.987 -5.311 7.239
448 1HD LYS 53 2HD LYS 53 -15.580 -7.956 8.530
449 2HD LYS 53 1HD LYS 53 -14.444 -6.854 9.306
450 1HE LYS 53 2HE LYS 53 -16.071 -5.337 9.840
451 2HE LYS 53 1HE LYS 53 -16.977 -5.632 8.356
452 1HZ LYS 53 3HZ LYS 53 -16.867 -7.469 10.690
453 2HZ LYS 53 2HZ LYS 53 -18.156 -6.424 10.323
454 3HZ LYS 53 1HZ LYS 53 -17.774 -7.705 9.275
455 H TYR 54 H TYR 54 -14.958 -6.607 2.255
456 HA TYR 54 HA TYR 54 -14.293 -9.461 2.161
457 1HB TYR 54 2HB TYR 54 -15.249 -7.545 0.312
458 2HB TYR 54 1HB TYR 54 -13.673 -8.057 -0.287
459 HD1 TYR 54 HD2 TYR 54 -13.417 -10.826 0.452
460 HD2 TYR 54 HD1 TYR 54 -16.925 -8.703 -0.826
461 HE1 TYR 54 HE2 TYR 54 -14.415 -12.953 -0.342
462 HE2 TYR 54 HE1 TYR 54 -17.922 -10.829 -1.621
463 HH TYR 54 HH TYR 54 -16.396 -13.428 -2.322
464 H GLY 55 H GLY 55 -12.551 -6.385 1.599
465 1HA GLY 55 2HA GLY 55 -10.262 -5.908 1.895
466 2HA GLY 55 1HA GLY 55 -10.048 -7.534 2.537
467 HA PRO 56 HA PRO 56 -7.656 -8.327 -1.098
468 1HB PRO 56 2HB PRO 56 -8.178 -11.164 -0.763
469 2HB PRO 56 1HB PRO 56 -6.676 -10.277 -0.477
470 1HG PRO 56 2HG PRO 56 -8.468 -11.336 1.496
471 2HG PRO 56 1HG PRO 56 -7.003 -10.385 1.773
472 1HD PRO 56 2HD PRO 56 -9.730 -9.554 2.142
473 2HD PRO 56 1HD PRO 56 -8.261 -8.592 2.386
474 H GLU 57 H GLU 57 -10.175 -10.860 -0.898
475 HA GLU 57 HA GLU 57 -11.579 -11.704 -2.569
476 1HB GLU 57 2HB GLU 57 -13.269 -10.101 -3.291
477 2HB GLU 57 1HB GLU 57 -12.872 -9.822 -1.599
478 1HG GLU 57 2HG GLU 57 -11.401 -7.956 -2.234
479 2HG GLU 57 1HG GLU 57 -11.748 -8.243 -3.937
480 H ALA 58 H ALA 58 -9.047 -11.618 -3.607
481 HA ALA 58 HA ALA 58 -8.050 -11.932 -5.713
482 1HB ALA 58 1HB ALA 58 -10.593 -12.132 -6.429
483 2HB ALA 58 3HB ALA 58 -10.283 -10.555 -7.153
484 3HB ALA 58 2HB ALA 58 -9.325 -11.952 -7.641
485 H SER 59 H SER 59 -9.158 -8.886 -4.535
486 HA SER 59 HA SER 59 -7.760 -7.258 -6.522
487 1HB SER 59 2HB SER 59 -9.803 -6.683 -4.885
488 2HB SER 59 1HB SER 59 -8.487 -6.169 -3.835
489 HG SER 59 HG SER 59 -9.150 -4.464 -5.169
490 H ALA 60 H ALA 60 -7.221 -8.112 -3.077
491 HA ALA 60 HA ALA 60 -4.659 -6.811 -2.890
492 1HB ALA 60 1HB ALA 60 -6.051 -7.518 -0.918
493 2HB ALA 60 3HB ALA 60 -5.630 -9.191 -1.283
494 3HB ALA 60 2HB ALA 60 -4.372 -8.048 -0.821
495 H PHE 61 H PHE 61 -5.682 -9.950 -4.105
496 HA PHE 61 HA PHE 61 -3.207 -11.346 -4.033
497 1HB PHE 61 2HB PHE 61 -5.730 -11.537 -5.567
498 2HB PHE 61 1HB PHE 61 -4.320 -12.228 -6.367
499 HD1 PHE 61 HD1 PHE 61 -2.749 -13.682 -4.772
500 HD2 PHE 61 HD2 PHE 61 -6.910 -12.879 -4.070
501 HE1 PHE 61 HE1 PHE 61 -2.884 -15.670 -3.294
502 HE2 PHE 61 HE2 PHE 61 -7.045 -14.866 -2.593
503 HZ PHE 61 HZ PHE 61 -5.032 -16.262 -2.205
504 H THR 62 H THR 62 -4.271 -8.689 -6.014
505 HA THR 62 HA THR 62 -2.298 -9.014 -8.132
506 HB THR 62 HB THR 62 -3.698 -6.449 -7.338
507 HG1 THR 62 HG1 THR 62 -5.470 -7.477 -7.739
508 1HG2 THR 62 1HG2 THR 62 -1.829 -6.838 -9.220
509 2HG2 THR 62 3HG2 THR 62 -3.247 -7.327 -10.145
510 3HG2 THR 62 2HG2 THR 62 -3.168 -5.711 -9.446
511 H LYS 63 H LYS 63 -2.608 -6.737 -5.380
512 HA LYS 63 HA LYS 63 0.137 -5.824 -5.749
513 1HB LYS 63 2HB LYS 63 -2.142 -5.093 -3.985
514 2HB LYS 63 1HB LYS 63 -0.517 -4.666 -3.450
515 1HG LYS 63 2HG LYS 63 -0.623 -4.023 -6.199
516 2HG LYS 63 1HG LYS 63 -2.123 -3.421 -5.499
517 1HD LYS 63 2HD LYS 63 -0.766 -2.331 -3.690
518 2HD LYS 63 1HD LYS 63 0.690 -2.812 -4.560
519 1HE LYS 63 2HE LYS 63 -0.945 -1.600 -6.494
520 2HE LYS 63 1HE LYS 63 -1.085 -0.573 -5.068
521 1HZ LYS 63 3HZ LYS 63 1.349 -0.541 -4.935
522 2HZ LYS 63 2HZ LYS 63 1.437 -1.451 -6.366
523 3HZ LYS 63 1HZ LYS 63 0.782 0.117 -6.390
524 H LYS 64 H LYS 64 -1.152 -8.539 -4.128
525 HA LYS 64 HA LYS 64 0.612 -8.523 -1.835
526 1HB LYS 64 2HB LYS 64 -0.075 -10.827 -1.499
527 2HB LYS 64 1HB LYS 64 -1.494 -9.883 -1.950
528 1HG LYS 64 2HG LYS 64 -1.672 -11.790 -3.311
529 2HG LYS 64 1HG LYS 64 -0.919 -10.607 -4.378
530 1HD LYS 64 2HD LYS 64 0.901 -11.886 -4.609
531 2HD LYS 64 1HD LYS 64 1.101 -11.983 -2.859
532 1HE LYS 64 2HE LYS 64 -0.881 -13.710 -3.015
533 2HE LYS 64 1HE LYS 64 -0.375 -13.842 -4.699
534 1HZ LYS 64 3HZ LYS 64 1.424 -14.183 -2.361
535 2HZ LYS 64 2HZ LYS 64 0.730 -15.458 -3.243
536 3HZ LYS 64 1HZ LYS 64 1.836 -14.408 -3.991
537 H MET 65 H MET 65 1.092 -9.113 -5.181
538 HA MET 65 HA MET 65 3.101 -11.088 -5.193
539 1HB MET 65 2HB MET 65 2.001 -9.355 -7.069
540 2HB MET 65 1HB MET 65 3.694 -8.871 -6.997
541 1HG MET 65 2HG MET 65 2.581 -11.615 -7.612
542 2HG MET 65 1HG MET 65 3.567 -10.591 -8.655
543 1HE MET 65 2HE MET 65 4.002 -13.421 -8.310
544 2HE MET 65 1HE MET 65 5.379 -13.964 -7.352
545 3HE MET 65 3HE MET 65 3.796 -13.752 -6.591
546 H LEU 66 H LEU 66 3.232 -7.691 -4.256
547 HA LEU 66 HA LEU 66 6.156 -7.706 -3.996
548 1HB LEU 66 2HB LEU 66 6.000 -5.420 -3.544
549 2HB LEU 66 1HB LEU 66 4.596 -5.675 -4.576
550 HG LEU 66 HG LEU 66 3.602 -6.215 -2.042
551 1HD1 LEU 66 1HD1 LEU 66 5.811 -4.199 -1.907
552 2HD1 LEU 66 3HD1 LEU 66 4.356 -3.905 -0.957
553 3HD1 LEU 66 2HD1 LEU 66 5.296 -5.373 -0.700
554 1HD2 LEU 66 2HD2 LEU 66 3.151 -4.422 -4.159
555 2HD2 LEU 66 1HD2 LEU 66 2.106 -4.684 -2.763
556 3HD2 LEU 66 3HD2 LEU 66 3.319 -3.405 -2.728
557 H GLU 67 H GLU 67 3.497 -8.702 -2.047
558 HA GLU 67 HA GLU 67 4.774 -8.175 0.535
559 1HB GLU 67 2HB GLU 67 2.240 -9.333 -0.463
560 2HB GLU 67 1HB GLU 67 2.850 -10.057 1.024
561 1HG GLU 67 2HG GLU 67 1.369 -8.153 1.504
562 2HG GLU 67 1HG GLU 67 3.011 -7.837 2.053
563 H ASN 68 H ASN 68 4.448 -10.833 -1.737
564 HA ASN 68 HA ASN 68 6.030 -12.609 0.051
565 1HB ASN 68 2HB ASN 68 5.160 -14.439 -1.167
566 2HB ASN 68 1HB ASN 68 3.804 -13.322 -1.033
567 1HD2 ASN 68 2HD2 ASN 68 3.964 -12.421 -4.551
568 2HD2 ASN 68 1HD2 ASN 68 3.618 -11.718 -3.043
569 H ALA 69 H ALA 69 6.503 -10.545 -2.623
570 HA ALA 69 HA ALA 69 8.588 -12.112 -3.956
571 1HB ALA 69 1HB ALA 69 7.648 -9.251 -4.188
572 2HB ALA 69 3HB ALA 69 9.040 -9.858 -5.085
573 3HB ALA 69 2HB ALA 69 7.446 -10.563 -5.350
574 H LYS 70 H LYS 70 10.817 -11.274 -4.155
575 HA LYS 70 HA LYS 70 11.792 -10.123 -1.562
576 1HB LYS 70 2HB LYS 70 12.441 -12.542 -2.194
577 2HB LYS 70 1HB LYS 70 13.435 -11.817 -3.457
578 1HG LYS 70 2HG LYS 70 13.766 -10.571 -0.805
579 2HG LYS 70 1HG LYS 70 14.273 -12.259 -0.877
580 1HD LYS 70 2HD LYS 70 15.960 -11.837 -2.399
581 2HD LYS 70 1HD LYS 70 15.120 -10.456 -3.105
582 1HE LYS 70 2HE LYS 70 15.876 -10.133 -0.263
583 2HE LYS 70 1HE LYS 70 17.231 -10.236 -1.387
584 1HZ LYS 70 3HZ LYS 70 16.206 -8.483 -2.712
585 2HZ LYS 70 2HZ LYS 70 14.927 -8.371 -1.598
586 3HZ LYS 70 1HZ LYS 70 16.506 -7.958 -1.127
587 H LYS 71 H LYS 71 12.355 -10.295 -5.072
588 HA LYS 71 HA LYS 71 14.024 -7.835 -4.974
589 1HB LYS 71 2HB LYS 71 13.359 -9.874 -7.097
590 2HB LYS 71 1HB LYS 71 14.009 -8.299 -7.552
591 1HG LYS 71 2HG LYS 71 15.363 -9.934 -5.415
592 2HG LYS 71 1HG LYS 71 15.678 -10.263 -7.119
593 1HD LYS 71 2HD LYS 71 15.792 -7.407 -6.328
594 2HD LYS 71 1HD LYS 71 17.069 -8.431 -5.672
595 1HE LYS 71 2HE LYS 71 17.472 -9.285 -8.014
596 2HE LYS 71 1HE LYS 71 16.347 -8.055 -8.590
597 1HZ LYS 71 2HZ LYS 71 17.747 -6.359 -7.578
598 2HZ LYS 71 1HZ LYS 71 18.839 -7.550 -7.053
599 3HZ LYS 71 3HZ LYS 71 18.621 -7.273 -8.712
600 H ILE 72 H ILE 72 13.105 -5.828 -5.442
601 HA ILE 72 HA ILE 72 10.459 -5.848 -6.808
602 HB ILE 72 HB ILE 72 11.121 -3.982 -4.522
603 1HG1 ILE 72 2HG1 ILE 72 9.440 -6.486 -4.277
604 2HG1 ILE 72 1HG1 ILE 72 11.145 -6.458 -3.846
605 1HG2 ILE 72 1HG2 ILE 72 8.764 -4.578 -6.232
606 2HG2 ILE 72 3HG2 ILE 72 8.443 -4.248 -4.529
607 3HG2 ILE 72 2HG2 ILE 72 9.281 -3.051 -5.516
608 1HD1 ILE 72 3HD1 ILE 72 9.733 -4.199 -2.687
609 2HD1 ILE 72 2HD1 ILE 72 8.999 -5.729 -2.205
610 3HD1 ILE 72 1HD1 ILE 72 10.707 -5.433 -1.889
611 H GLU 73 H GLU 73 9.921 -3.588 -7.567
612 HA GLU 73 HA GLU 73 12.218 -1.826 -8.028
613 1HB GLU 73 2HB GLU 73 11.037 -3.594 -10.125
614 2HB GLU 73 1HB GLU 73 11.316 -1.918 -10.596
615 1HG GLU 73 2HG GLU 73 13.636 -2.063 -10.200
616 2HG GLU 73 1HG GLU 73 13.467 -3.502 -9.197
617 H VAL 74 H VAL 74 10.620 -0.733 -6.561
618 HA VAL 74 HA VAL 74 7.975 -0.068 -7.219
619 HB VAL 74 HB VAL 74 9.265 2.299 -6.138
620 1HG1 VAL 74 1HG1 VAL 74 6.932 0.736 -5.822
621 2HG1 VAL 74 3HG1 VAL 74 7.720 0.791 -4.246
622 3HG1 VAL 74 2HG1 VAL 74 7.301 2.289 -5.076
623 1HG2 VAL 74 3HG2 VAL 74 9.980 -0.363 -4.917
624 2HG2 VAL 74 2HG2 VAL 74 11.025 1.025 -5.226
625 3HG2 VAL 74 1HG2 VAL 74 9.836 1.089 -3.930
626 H GLU 75 H GLU 75 7.433 0.505 -9.232
627 HA GLU 75 HA GLU 75 9.069 2.446 -10.732
628 1HB GLU 75 2HB GLU 75 6.498 1.037 -11.515
629 2HB GLU 75 1HB GLU 75 7.578 1.916 -12.596
630 1HG GLU 75 2HG GLU 75 9.361 0.200 -11.550
631 2HG GLU 75 1HG GLU 75 7.913 -0.775 -11.360
632 H PHE 76 H PHE 76 8.734 4.399 -9.646
633 HA PHE 76 HA PHE 76 5.980 5.508 -9.870
634 1HB PHE 76 2HB PHE 76 5.995 6.419 -7.669
635 2HB PHE 76 1HB PHE 76 6.501 4.747 -7.496
636 HD1 PHE 76 HD2 PHE 76 9.222 4.498 -7.840
637 HD2 PHE 76 HD1 PHE 76 7.162 7.971 -6.375
638 HE1 PHE 76 HE2 PHE 76 11.285 5.231 -6.694
639 HE2 PHE 76 HE1 PHE 76 9.227 8.698 -5.223
640 HZ PHE 76 HZ PHE 76 11.290 7.336 -5.383
641 H ASP 77 H ASP 77 7.667 6.040 -11.813
642 HA ASP 77 HA ASP 77 8.638 7.777 -13.033
643 1HB ASP 77 2HB ASP 77 6.696 9.039 -11.914
644 2HB ASP 77 1HB ASP 77 7.883 9.610 -10.745
645 H LYS 78 H LYS 78 10.471 9.478 -12.830
646 HA LYS 78 HA LYS 78 12.745 8.335 -11.593
647 1HB LYS 78 2HB LYS 78 13.797 10.607 -11.889
648 2HB LYS 78 1HB LYS 78 13.031 9.982 -13.347
649 1HG LYS 78 2HG LYS 78 11.451 11.617 -13.365
650 2HG LYS 78 1HG LYS 78 11.228 11.550 -11.618
651 1HD LYS 78 2HD LYS 78 13.744 12.721 -12.786
652 2HD LYS 78 1HD LYS 78 12.280 13.698 -12.652
653 1HE LYS 78 2HE LYS 78 12.195 12.954 -10.197
654 2HE LYS 78 1HE LYS 78 13.845 12.378 -10.428
655 1HZ LYS 78 2HZ LYS 78 14.366 14.666 -11.265
656 2HZ LYS 78 1HZ LYS 78 12.837 15.151 -10.704
657 3HZ LYS 78 3HZ LYS 78 13.995 14.570 -9.610
658 H GLY 79 H GLY 79 10.257 10.394 -10.273
659 1HA GLY 79 2HA GLY 79 10.815 9.828 -7.574
660 2HA GLY 79 1HA GLY 79 11.623 11.353 -7.946
661 H GLN 80 H GLN 80 8.582 9.879 -7.232
662 HA GLN 80 HA GLN 80 6.917 12.004 -8.307
663 1HB GLN 80 2HB GLN 80 6.497 9.602 -6.567
664 2HB GLN 80 1HB GLN 80 5.270 10.867 -6.550
665 1HG GLN 80 2HG GLN 80 5.161 10.747 -9.039
666 2HG GLN 80 1HG GLN 80 6.299 9.402 -8.995
667 1HE2 GLN 80 2HE2 GLN 80 3.742 7.404 -7.109
668 2HE2 GLN 80 1HE2 GLN 80 5.290 7.975 -6.732
669 H ARG 81 H ARG 81 5.264 12.661 -6.121
670 HA ARG 81 HA ARG 81 7.145 13.842 -4.152
671 1HB ARG 81 2HB ARG 81 6.389 16.040 -4.519
672 2HB ARG 81 1HB ARG 81 6.663 15.369 -6.124
673 1HG ARG 81 2HG ARG 81 4.463 15.477 -6.681
674 2HG ARG 81 1HG ARG 81 3.934 14.922 -5.094
675 1HD ARG 81 2HD ARG 81 5.035 17.704 -5.519
676 2HD ARG 81 1HD ARG 81 3.324 17.337 -5.742
677 HE ARG 81 HE ARG 81 3.882 16.316 -3.231
678 1HH1 ARG 81 2HH1 ARG 81 5.994 18.356 -2.909
679 2HH1 ARG 81 1HH1 ARG 81 5.123 19.728 -2.312
680 1HH2 ARG 81 1HH2 ARG 81 2.015 18.512 -3.283
681 2HH2 ARG 81 2HH2 ARG 81 2.864 19.817 -2.524
682 H THR 82 H THR 82 4.786 11.781 -4.235
683 HA THR 82 HA THR 82 3.095 13.061 -2.146
684 HB THR 82 HB THR 82 2.082 10.527 -2.556
685 HG1 THR 82 HG1 THR 82 2.639 11.619 -5.107
686 1HG2 THR 82 2HG2 THR 82 1.350 13.184 -3.797
687 2HG2 THR 82 1HG2 THR 82 0.311 11.760 -3.865
688 3HG2 THR 82 3HG2 THR 82 0.714 12.483 -2.308
689 H ASP 83 H ASP 83 3.431 12.511 -0.090
690 HA ASP 83 HA ASP 83 4.384 9.912 0.765
691 1HB ASP 83 2HB ASP 83 6.459 10.977 -0.154
692 2HB ASP 83 1HB ASP 83 6.300 12.231 1.074
693 H LYS 84 H LYS 84 2.151 11.180 1.476
694 HA LYS 84 HA LYS 84 2.431 11.513 4.364
695 1HB LYS 84 2HB LYS 84 2.468 13.845 2.725
696 2HB LYS 84 1HB LYS 84 0.875 13.777 3.478
697 1HG LYS 84 2HG LYS 84 3.094 13.128 5.307
698 2HG LYS 84 1HG LYS 84 3.130 14.780 4.688
699 1HD LYS 84 2HD LYS 84 1.614 15.262 6.294
700 2HD LYS 84 1HD LYS 84 0.449 14.392 5.296
701 1HE LYS 84 2HE LYS 84 0.227 13.236 7.296
702 2HE LYS 84 1HE LYS 84 1.475 12.273 6.509
703 1HZ LYS 84 1HZ LYS 84 2.075 14.537 8.329
704 2HZ LYS 84 3HZ LYS 84 1.957 12.929 8.856
705 3HZ LYS 84 2HZ LYS 84 3.157 13.368 7.735
706 H TYR 85 H TYR 85 0.273 12.202 1.626
707 HA TYR 85 HA TYR 85 -1.862 10.573 2.945
708 1HB TYR 85 2HB TYR 85 -3.515 11.995 1.901
709 2HB TYR 85 1HB TYR 85 -2.349 13.058 2.688
710 HD1 TYR 85 HD2 TYR 85 -0.642 14.271 1.348
711 HD2 TYR 85 HD1 TYR 85 -3.705 11.899 -0.510
712 HE1 TYR 85 HE2 TYR 85 -0.153 15.343 -0.833
713 HE2 TYR 85 HE1 TYR 85 -3.214 12.970 -2.689
714 HH TYR 85 HH TYR 85 -1.702 15.727 -3.083
715 H GLY 86 H GLY 86 -0.151 11.374 -0.052
716 1HA GLY 86 2HA GLY 86 -1.569 9.195 -1.487
717 2HA GLY 86 1HA GLY 86 -0.638 10.479 -2.249
718 H ARG 87 H ARG 87 1.483 9.906 0.003
719 HA ARG 87 HA ARG 87 3.594 8.884 -0.181
720 1HB ARG 87 2HB ARG 87 3.548 6.535 0.363
721 2HB ARG 87 1HB ARG 87 2.252 7.337 1.239
722 1HG ARG 87 2HG ARG 87 1.603 6.181 -1.440
723 2HG ARG 87 1HG ARG 87 1.834 5.066 -0.095
724 1HD ARG 87 2HD ARG 87 -0.003 5.865 1.056
725 2HD ARG 87 1HD ARG 87 0.137 7.476 0.376
726 HE ARG 87 HE ARG 87 -0.510 5.685 -1.755
727 1HH1 ARG 87 1HH2 ARG 87 -2.037 4.793 0.884
728 2HH1 ARG 87 2HH2 ARG 87 -3.584 5.503 0.568
729 1HH2 ARG 87 2HH1 ARG 87 -2.440 7.512 -2.015
730 2HH2 ARG 87 1HH1 ARG 87 -3.814 7.036 -1.078
731 H VAL 88 H VAL 88 3.728 6.116 -1.569
732 HA VAL 88 HA VAL 88 4.636 7.236 -4.100
733 HB VAL 88 HB VAL 88 4.392 4.349 -3.250
734 1HG1 VAL 88 2HG1 VAL 88 5.894 5.810 -5.447
735 2HG1 VAL 88 1HG1 VAL 88 6.342 4.185 -4.931
736 3HG1 VAL 88 3HG1 VAL 88 4.747 4.482 -5.625
737 1HG2 VAL 88 1HG2 VAL 88 6.710 6.307 -3.013
738 2HG2 VAL 88 3HG2 VAL 88 5.774 5.652 -1.670
739 3HG2 VAL 88 2HG2 VAL 88 6.795 4.587 -2.637
740 H LEU 89 H LEU 89 2.740 8.021 -5.088
741 HA LEU 89 HA LEU 89 0.451 6.256 -5.573
742 1HB LEU 89 2HB LEU 89 1.156 9.032 -6.554
743 2HB LEU 89 1HB LEU 89 -0.345 8.201 -6.971
744 HG LEU 89 HG LEU 89 0.615 8.950 -4.202
745 1HD1 LEU 89 1HD1 LEU 89 -1.776 9.762 -5.873
746 2HD1 LEU 89 3HD1 LEU 89 -1.509 10.241 -4.197
747 3HD1 LEU 89 2HD1 LEU 89 -0.396 10.779 -5.456
748 1HD2 LEU 89 3HD2 LEU 89 -1.547 7.091 -5.166
749 2HD2 LEU 89 2HD2 LEU 89 -0.414 6.873 -3.836
750 3HD2 LEU 89 1HD2 LEU 89 -1.770 7.987 -3.666
751 H ALA 90 H ALA 90 2.175 4.687 -6.593
752 HA ALA 90 HA ALA 90 1.903 5.004 -9.520
753 1HB ALA 90 2HB ALA 90 4.124 5.948 -8.925
754 2HB ALA 90 1HB ALA 90 4.562 4.404 -8.193
755 3HB ALA 90 3HB ALA 90 4.256 4.503 -9.927
756 H TYR 91 H TYR 91 4.171 2.603 -8.637
757 HA TYR 91 HA TYR 91 2.251 0.554 -7.899
758 1HB TYR 91 2HB TYR 91 2.867 1.000 -10.724
759 2HB TYR 91 1HB TYR 91 3.095 -0.668 -10.192
760 HD1 TYR 91 HD2 TYR 91 1.189 -1.436 -8.417
761 HD2 TYR 91 HD1 TYR 91 0.716 1.523 -11.491
762 HE1 TYR 91 HE2 TYR 91 -1.257 -1.769 -8.353
763 HE2 TYR 91 HE1 TYR 91 -1.737 1.188 -11.427
764 HH TYR 91 HH TYR 91 -3.224 -1.229 -10.497
765 H ILE 92 H ILE 92 3.168 -1.547 -7.600
766 HA ILE 92 HA ILE 92 6.092 -1.393 -7.005
767 HB ILE 92 HB ILE 92 4.147 -3.528 -6.086
768 1HG1 ILE 92 2HG1 ILE 92 3.432 -1.223 -5.344
769 2HG1 ILE 92 1HG1 ILE 92 3.861 -2.299 -4.017
770 1HG2 ILE 92 1HG2 ILE 92 6.947 -2.680 -5.371
771 2HG2 ILE 92 3HG2 ILE 92 5.955 -3.569 -4.215
772 3HG2 ILE 92 2HG2 ILE 92 6.348 -4.289 -5.775
773 1HD1 ILE 92 3HD1 ILE 92 6.261 -1.255 -4.337
774 2HD1 ILE 92 2HD1 ILE 92 5.364 0.053 -5.103
775 3HD1 ILE 92 1HD1 ILE 92 5.031 -0.380 -3.427
776 H TYR 93 H TYR 93 7.486 -2.972 -7.897
777 HA TYR 93 HA TYR 93 6.221 -4.859 -9.831
778 1HB TYR 93 2HB TYR 93 8.467 -2.906 -10.307
779 2HB TYR 93 1HB TYR 93 8.214 -4.311 -11.346
780 HD1 TYR 93 HD2 TYR 93 6.334 -1.398 -9.855
781 HD2 TYR 93 HD1 TYR 93 6.689 -4.194 -13.089
782 HE1 TYR 93 HE2 TYR 93 4.560 -0.221 -11.079
783 HE2 TYR 93 HE1 TYR 93 4.913 -3.022 -14.313
784 HH TYR 93 HH TYR 93 2.768 -1.233 -13.169
785 H ALA 94 H ALA 94 6.677 -6.279 -7.867
786 HA ALA 94 HA ALA 94 9.474 -7.196 -7.861
787 1HB ALA 94 3HB ALA 94 8.399 -6.300 -5.705
788 2HB ALA 94 2HB ALA 94 7.430 -7.770 -5.716
789 3HB ALA 94 1HB ALA 94 9.186 -7.873 -5.597
790 H ASP 95 H ASP 95 9.832 -9.165 -8.684
791 HA ASP 95 HA ASP 95 9.469 -11.246 -9.700
792 1HB ASP 95 2HB ASP 95 9.294 -11.621 -7.171
793 2HB ASP 95 1HB ASP 95 7.549 -11.706 -7.415
794 H GLY 96 H GLY 96 8.248 -10.189 -11.527
795 1HA GLY 96 2HA GLY 96 6.443 -10.138 -13.033
796 2HA GLY 96 1HA GLY 96 5.903 -11.615 -12.236
797 H LYS 97 H LYS 97 6.320 -8.480 -10.689
798 HA LYS 97 HA LYS 97 3.613 -8.659 -9.690
799 1HB LYS 97 2HB LYS 97 5.243 -7.693 -8.220
800 2HB LYS 97 1HB LYS 97 5.764 -6.553 -9.453
801 1HG LYS 97 2HG LYS 97 4.340 -5.469 -7.750
802 2HG LYS 97 1HG LYS 97 3.594 -5.409 -9.340
803 1HD LYS 97 2HD LYS 97 1.799 -6.538 -8.599
804 2HD LYS 97 1HD LYS 97 2.817 -7.828 -7.969
805 1HE LYS 97 2HE LYS 97 1.634 -6.889 -6.093
806 2HE LYS 97 1HE LYS 97 3.305 -6.341 -5.978
807 1HZ LYS 97 2HZ LYS 97 1.058 -4.790 -7.154
808 2HZ LYS 97 1HZ LYS 97 1.748 -4.522 -5.626
809 3HZ LYS 97 3HZ LYS 97 2.667 -4.262 -7.027
810 H MET 98 H MET 98 4.693 -5.516 -10.849
811 HA MET 98 HA MET 98 3.696 -4.056 -12.375
812 1HB MET 98 2HB MET 98 3.017 -6.519 -14.001
813 2HB MET 98 1HB MET 98 3.345 -4.891 -14.587
814 1HG MET 98 2HG MET 98 5.532 -5.377 -14.778
815 2HG MET 98 1HG MET 98 5.608 -5.788 -13.064
816 1HE MET 98 2HE MET 98 4.066 -6.982 -16.360
817 2HE MET 98 1HE MET 98 5.799 -7.070 -16.663
818 3HE MET 98 3HE MET 98 4.826 -8.547 -16.633
819 H VAL 99 H VAL 99 2.115 -5.791 -10.321
820 HA VAL 99 HA VAL 99 -0.059 -6.149 -9.668
821 HB VAL 99 HB VAL 99 0.410 -3.507 -10.298
822 1HG1 VAL 99 2HG1 VAL 99 -0.962 -4.123 -12.454
823 2HG1 VAL 99 1HG1 VAL 99 -2.348 -4.016 -11.371
824 3HG1 VAL 99 3HG1 VAL 99 -1.297 -2.619 -11.600
825 1HG2 VAL 99 2HG2 VAL 99 -1.381 -5.088 -8.676
826 2HG2 VAL 99 1HG2 VAL 99 -0.693 -3.500 -8.350
827 3HG2 VAL 99 3HG2 VAL 99 -2.207 -3.637 -9.243
828 H ASN 100 H ASN 100 0.874 -7.448 -12.172
829 HA ASN 100 HA ASN 100 -1.265 -7.387 -14.127
830 1HB ASN 100 2HB ASN 100 1.257 -8.839 -13.714
831 2HB ASN 100 1HB ASN 100 0.014 -9.787 -14.528
832 1HD2 ASN 100 2HD2 ASN 100 0.097 -7.844 -17.501
833 2HD2 ASN 100 1HD2 ASN 100 -0.731 -9.048 -16.638
834 H GLU 101 H GLU 101 -1.110 -8.887 -11.037
835 HA GLU 101 HA GLU 101 -2.758 -11.201 -11.739
836 1HB GLU 101 2HB GLU 101 -1.141 -10.494 -9.560
837 2HB GLU 101 1HB GLU 101 -2.782 -10.529 -8.913
838 1HG GLU 101 2HG GLU 101 -2.569 -12.775 -10.620
839 2HG GLU 101 1HG GLU 101 -1.089 -12.747 -9.662
840 H ALA 102 H ALA 102 -3.744 -8.260 -12.128
841 HA ALA 102 HA ALA 102 -6.047 -8.078 -10.334
842 1HB ALA 102 3HB ALA 102 -4.907 -6.061 -11.271
843 2HB ALA 102 2HB ALA 102 -5.463 -6.531 -12.877
844 3HB ALA 102 1HB ALA 102 -6.634 -6.096 -11.632
845 H LEU 103 HN LEU 103 -8.297 -8.032 -11.190
846 HA LEU 103 HA LEU 103 -8.873 -10.373 -12.781
847 1HB LEU 103 2HB LEU 103 -10.560 -8.124 -11.678
848 2HB LEU 103 1HB LEU 103 -11.260 -9.363 -12.721
849 HG LEU 103 HG LEU 103 -9.582 -10.524 -10.632
850 1HD1 LEU 103 2HD1 LEU 103 -11.585 -8.457 -9.904
851 2HD1 LEU 103 1HD1 LEU 103 -11.684 -9.972 -9.006
852 3HD1 LEU 103 3HD1 LEU 103 -10.187 -9.039 -9.001
853 1HD2 LEU 103 2HD2 LEU 103 -11.277 -11.681 -12.093
854 2HD2 LEU 103 1HD2 LEU 103 -11.515 -11.967 -10.370
855 3HD2 LEU 103 3HD2 LEU 103 -12.544 -10.816 -11.223
No H/Q in entry = 855
Start of MODEL 9
Raw file had 866 H/Q atoms
Start of MODEL 9
1 1H ALA 1 1H ALA 1 12.081 12.005 -19.721
2 2H ALA 1 3H ALA 1 12.602 13.491 -20.353
3 3H ALA 1 2H ALA 1 13.743 12.324 -19.877
4 HA ALA 1 HA ALA 1 13.070 12.539 -17.578
5 1HB ALA 1 1HB ALA 1 14.863 14.002 -18.438
6 2HB ALA 1 3HB ALA 1 13.658 15.199 -18.918
7 3HB ALA 1 2HB ALA 1 13.908 14.835 -17.210
8 H THR 2 H THR 2 11.104 12.488 -16.601
9 HA THR 2 HA THR 2 9.300 14.833 -16.941
10 HB THR 2 HB THR 2 7.341 13.190 -16.945
11 HG1 THR 2 HG1 THR 2 8.186 11.275 -16.449
12 1HG2 THR 2 2HG2 THR 2 8.226 14.442 -18.954
13 2HG2 THR 2 1HG2 THR 2 9.165 13.003 -19.352
14 3HG2 THR 2 3HG2 THR 2 7.402 12.930 -19.334
15 H SER 3 H SER 3 8.810 15.607 -14.952
16 HA SER 3 HA SER 3 9.227 13.871 -12.591
17 1HB SER 3 2HB SER 3 9.078 15.998 -11.306
18 2HB SER 3 1HB SER 3 10.320 16.059 -12.553
19 HG SER 3 HG SER 3 9.199 17.524 -13.589
20 H THR 4 H THR 4 6.922 13.285 -14.155
21 HA THR 4 HA THR 4 4.837 13.665 -12.109
22 HB THR 4 HB THR 4 4.432 15.613 -13.498
23 HG1 THR 4 HG1 THR 4 2.463 14.985 -13.154
24 1HG2 THR 4 1HG2 THR 4 5.679 14.667 -15.502
25 2HG2 THR 4 3HG2 THR 4 4.208 13.776 -15.891
26 3HG2 THR 4 2HG2 THR 4 4.194 15.538 -15.879
27 H LYS 5 H LYS 5 5.619 12.327 -15.337
28 HA LYS 5 HA LYS 5 4.191 9.828 -14.527
29 1HB LYS 5 2HB LYS 5 4.216 11.173 -17.249
30 2HB LYS 5 1HB LYS 5 3.608 9.544 -16.959
31 1HG LYS 5 2HG LYS 5 1.645 10.346 -16.198
32 2HG LYS 5 1HG LYS 5 2.469 11.397 -15.045
33 1HD LYS 5 2HD LYS 5 1.292 12.888 -16.464
34 2HD LYS 5 1HD LYS 5 2.951 12.932 -17.060
35 1HE LYS 5 2HE LYS 5 2.298 12.171 -19.076
36 2HE LYS 5 1HE LYS 5 1.514 10.776 -18.338
37 1HZ LYS 5 3HZ LYS 5 0.328 13.487 -18.602
38 2HZ LYS 5 2HZ LYS 5 -0.065 12.137 -19.556
39 3HZ LYS 5 1HZ LYS 5 -0.428 12.142 -17.897
40 H LYS 6 H LYS 6 6.113 8.758 -13.942
41 HA LYS 6 HA LYS 6 8.009 8.247 -16.183
42 1HB LYS 6 2HB LYS 6 8.854 9.816 -14.318
43 2HB LYS 6 1HB LYS 6 8.878 8.378 -13.297
44 1HG LYS 6 2HG LYS 6 10.996 8.163 -14.129
45 2HG LYS 6 1HG LYS 6 10.153 7.413 -15.485
46 1HD LYS 6 2HD LYS 6 10.164 10.309 -15.740
47 2HD LYS 6 1HD LYS 6 11.804 9.681 -15.592
48 1HE LYS 6 2HE LYS 6 11.449 8.153 -17.442
49 2HE LYS 6 1HE LYS 6 9.744 8.591 -17.529
50 1HZ LYS 6 1HZ LYS 6 11.961 10.526 -17.905
51 2HZ LYS 6 3HZ LYS 6 11.189 9.723 -19.184
52 3HZ LYS 6 2HZ LYS 6 10.306 10.785 -18.194
53 H LEU 7 H LEU 7 7.242 7.029 -12.886
54 HA LEU 7 HA LEU 7 6.976 4.841 -12.095
55 1HB LEU 7 2HB LEU 7 5.555 4.984 -14.521
56 2HB LEU 7 1HB LEU 7 6.504 3.504 -14.642
57 HG LEU 7 HG LEU 7 5.662 2.954 -12.282
58 1HD1 LEU 7 3HD1 LEU 7 4.868 5.228 -11.728
59 2HD1 LEU 7 2HD1 LEU 7 3.672 5.123 -13.020
60 3HD1 LEU 7 1HD1 LEU 7 3.556 4.054 -11.621
61 1HD2 LEU 7 2HD2 LEU 7 3.654 3.142 -14.551
62 2HD2 LEU 7 1HD2 LEU 7 4.813 1.834 -14.311
63 3HD2 LEU 7 3HD2 LEU 7 3.512 2.085 -13.147
64 H HIS 8 H HIS 8 9.476 5.322 -12.052
65 HA HIS 8 HA HIS 8 11.092 3.768 -13.926
66 1HB HIS 8 2HB HIS 8 11.723 5.963 -12.677
67 2HB HIS 8 1HB HIS 8 12.103 4.905 -11.321
68 HD1 HIS 8 HD1 HIS 8 12.831 4.830 -15.081
69 HD2 HIS 8 HD2 HIS 8 14.758 4.180 -11.441
70 HE1 HIS 8 HE1 HIS 8 15.218 4.195 -15.638
71 H LYS 9 H LYS 9 12.627 3.186 -11.043
72 HA LYS 9 HA LYS 9 11.176 1.014 -9.901
73 1HB LYS 9 2HB LYS 9 12.694 -0.832 -10.862
74 2HB LYS 9 1HB LYS 9 11.413 -0.228 -11.909
75 1HG LYS 9 2HG LYS 9 12.985 1.217 -13.081
76 2HG LYS 9 1HG LYS 9 14.277 0.774 -11.964
77 1HD LYS 9 2HD LYS 9 14.665 -0.605 -13.841
78 2HD LYS 9 1HD LYS 9 13.819 -1.662 -12.712
79 1HE LYS 9 2HE LYS 9 12.754 -1.972 -14.836
80 2HE LYS 9 1HE LYS 9 11.659 -0.978 -13.878
81 1HZ LYS 9 3HZ LYS 9 13.663 0.188 -15.722
82 2HZ LYS 9 2HZ LYS 9 12.093 -0.218 -16.224
83 3HZ LYS 9 1HZ LYS 9 12.323 0.952 -15.014
84 H GLU 10 H GLU 10 12.200 0.362 -8.020
85 HA GLU 10 HA GLU 10 15.091 0.599 -7.647
86 1HB GLU 10 2HB GLU 10 13.186 2.655 -6.611
87 2HB GLU 10 1HB GLU 10 14.429 2.095 -5.495
88 1HG GLU 10 2HG GLU 10 16.007 3.301 -6.550
89 2HG GLU 10 1HG GLU 10 15.583 2.585 -8.103
90 HA PRO 11 HA PRO 11 13.790 -2.987 -5.378
91 1HB PRO 11 2HB PRO 11 16.275 -2.659 -3.866
92 2HB PRO 11 1HB PRO 11 15.737 -4.000 -4.889
93 1HG PRO 11 2HG PRO 11 17.677 -2.098 -5.588
94 2HG PRO 11 1HG PRO 11 16.855 -3.197 -6.703
95 1HD PRO 11 2HD PRO 11 16.546 -0.309 -6.460
96 2HD PRO 11 1HD PRO 11 15.850 -1.399 -7.679
97 H ALA 12 H ALA 12 12.557 -3.146 -3.657
98 HA ALA 12 HA ALA 12 12.798 -1.152 -1.439
99 1HB ALA 12 3HB ALA 12 10.678 -1.476 -3.182
100 2HB ALA 12 2HB ALA 12 10.179 -2.426 -1.783
101 3HB ALA 12 1HB ALA 12 10.586 -0.721 -1.593
102 H THR 13 H THR 13 10.784 -2.549 0.168
103 HA THR 13 HA THR 13 11.925 -5.248 0.569
104 HB THR 13 HB THR 13 13.333 -3.811 1.985
105 HG1 THR 13 HG1 THR 13 12.928 -5.764 2.885
106 1HG2 THR 13 2HG2 THR 13 11.559 -2.007 2.224
107 2HG2 THR 13 1HG2 THR 13 10.810 -3.024 3.455
108 3HG2 THR 13 3HG2 THR 13 12.442 -2.401 3.699
109 H LEU 14 H LEU 14 10.286 -6.629 0.944
110 HA LEU 14 HA LEU 14 7.562 -5.828 1.083
111 1HB LEU 14 2HB LEU 14 8.590 -8.122 0.439
112 2HB LEU 14 1HB LEU 14 8.575 -8.457 2.169
113 HG LEU 14 HG LEU 14 6.156 -7.593 0.574
114 1HD1 LEU 14 3HD1 LEU 14 7.394 -10.231 1.070
115 2HD1 LEU 14 2HD1 LEU 14 5.664 -10.150 1.398
116 3HD1 LEU 14 1HD1 LEU 14 6.278 -9.732 -0.202
117 1HD2 LEU 14 1HD2 LEU 14 6.674 -8.300 3.448
118 2HD2 LEU 14 3HD2 LEU 14 5.655 -7.023 2.780
119 3HD2 LEU 14 2HD2 LEU 14 5.107 -8.698 2.745
120 H ILE 15 H ILE 15 6.707 -4.688 2.781
121 HA ILE 15 HA ILE 15 7.686 -5.358 5.517
122 HB ILE 15 HB ILE 15 6.180 -2.929 4.495
123 1HG1 ILE 15 2HG1 ILE 15 8.938 -3.000 5.714
124 2HG1 ILE 15 1HG1 ILE 15 8.709 -3.320 3.996
125 1HG2 ILE 15 1HG2 ILE 15 7.131 -3.697 7.269
126 2HG2 ILE 15 3HG2 ILE 15 6.703 -2.047 6.819
127 3HG2 ILE 15 2HG2 ILE 15 5.483 -3.319 6.768
128 1HD1 ILE 15 1HD1 ILE 15 7.320 -1.128 3.992
129 2HD1 ILE 15 3HD1 ILE 15 8.112 -0.802 5.532
130 3HD1 ILE 15 2HD1 ILE 15 9.077 -0.996 4.070
131 H LYS 16 H LYS 16 4.548 -4.274 4.132
132 HA LYS 16 HA LYS 16 3.195 -6.633 5.210
133 1HB LYS 16 2HB LYS 16 3.543 -4.920 7.145
134 2HB LYS 16 1HB LYS 16 2.284 -3.988 6.334
135 1HG LYS 16 2HG LYS 16 1.419 -6.709 6.443
136 2HG LYS 16 1HG LYS 16 1.974 -6.253 8.055
137 1HD LYS 16 2HD LYS 16 0.561 -4.193 7.905
138 2HD LYS 16 1HD LYS 16 -0.066 -4.779 6.364
139 1HE LYS 16 2HE LYS 16 -1.268 -6.498 7.347
140 2HE LYS 16 1HE LYS 16 -0.175 -6.615 8.727
141 1HZ LYS 16 3HZ LYS 16 -1.038 -4.499 9.532
142 2HZ LYS 16 2HZ LYS 16 -2.106 -4.415 8.214
143 3HZ LYS 16 1HZ LYS 16 -2.280 -5.644 9.374
144 H ALA 17 H ALA 17 1.960 -7.077 3.453
145 HA ALA 17 HA ALA 17 0.795 -4.880 1.849
146 1HB ALA 17 2HB ALA 17 1.838 -7.063 0.900
147 2HB ALA 17 1HB ALA 17 0.333 -7.830 1.398
148 3HB ALA 17 3HB ALA 17 0.305 -6.524 0.215
149 H ILE 18 H ILE 18 -0.906 -3.995 2.837
150 HA ILE 18 HA ILE 18 -2.802 -5.530 4.442
151 HB ILE 18 HB ILE 18 -2.504 -2.665 3.574
152 1HG1 ILE 18 2HG1 ILE 18 -2.939 -2.993 6.362
153 2HG1 ILE 18 1HG1 ILE 18 -1.817 -4.261 5.870
154 1HG2 ILE 18 1HG2 ILE 18 -4.914 -3.987 4.824
155 2HG2 ILE 18 3HG2 ILE 18 -4.554 -2.286 5.118
156 3HG2 ILE 18 2HG2 ILE 18 -4.860 -2.850 3.476
157 1HD1 ILE 18 2HD1 ILE 18 -0.551 -2.402 4.606
158 2HD1 ILE 18 1HD1 ILE 18 -1.515 -1.271 5.556
159 3HD1 ILE 18 3HD1 ILE 18 -0.427 -2.401 6.364
160 H ASP 19 H ASP 19 -3.186 -3.497 1.508
161 HA ASP 19 HA ASP 19 -4.968 -5.496 0.294
162 1HB ASP 19 2HB ASP 19 -6.050 -3.410 1.860
163 2HB ASP 19 1HB ASP 19 -6.298 -2.919 0.186
164 H GLY 20 H GLY 20 -6.051 -3.636 -1.643
165 1HA GLY 20 2HA GLY 20 -3.943 -3.534 -3.557
166 2HA GLY 20 1HA GLY 20 -5.468 -2.658 -3.696
167 H ASP 21 H ASP 21 -5.599 -0.521 -2.783
168 HA ASP 21 HA ASP 21 -3.436 1.228 -3.149
169 1HB ASP 21 2HB ASP 21 -5.978 1.465 -1.605
170 2HB ASP 21 1HB ASP 21 -4.714 2.628 -1.267
171 H THR 22 H THR 22 -4.343 -0.670 -0.330
172 HA THR 22 HA THR 22 -2.369 0.679 1.298
173 HB THR 22 HB THR 22 -3.717 -1.822 2.195
174 HG1 THR 22 HG1 THR 22 -4.889 0.757 2.048
175 1HG2 THR 22 2HG2 THR 22 -2.027 -0.606 3.583
176 2HG2 THR 22 1HG2 THR 22 -3.098 0.794 3.578
177 3HG2 THR 22 3HG2 THR 22 -3.614 -0.707 4.344
178 H VAL 23 H VAL 23 -0.402 0.154 0.152
179 HA VAL 23 HA VAL 23 0.604 -2.578 0.761
180 HB VAL 23 HB VAL 23 1.911 -2.552 -1.381
181 1HG1 VAL 23 1HG1 VAL 23 -1.107 -2.586 -1.414
182 2HG1 VAL 23 3HG1 VAL 23 -0.156 -3.009 -2.836
183 3HG1 VAL 23 2HG1 VAL 23 0.000 -3.957 -1.358
184 1HG2 VAL 23 1HG2 VAL 23 0.038 -0.260 -2.043
185 2HG2 VAL 23 3HG2 VAL 23 1.783 -0.140 -1.830
186 3HG2 VAL 23 2HG2 VAL 23 1.126 -1.057 -3.181
187 H LYS 24 H LYS 24 2.225 -2.295 2.202
188 HA LYS 24 HA LYS 24 3.689 0.281 2.110
189 1HB LYS 24 2HB LYS 24 2.617 -1.257 4.204
190 2HB LYS 24 1HB LYS 24 4.369 -1.402 4.364
191 1HG LYS 24 2HG LYS 24 4.651 0.966 4.461
192 2HG LYS 24 1HG LYS 24 2.990 1.253 3.945
193 1HD LYS 24 2HD LYS 24 2.449 1.382 6.132
194 2HD LYS 24 1HD LYS 24 2.717 -0.359 6.204
195 1HE LYS 24 2HE LYS 24 5.175 0.153 6.613
196 2HE LYS 24 1HE LYS 24 4.704 1.839 6.821
197 1HZ LYS 24 1HZ LYS 24 3.172 1.132 8.575
198 2HZ LYS 24 3HZ LYS 24 3.702 -0.469 8.400
199 3HZ LYS 24 2HZ LYS 24 4.781 0.727 8.942
200 H LEU 25 H LEU 25 5.824 0.428 1.726
201 HA LEU 25 HA LEU 25 7.643 -1.792 2.037
202 1HB LEU 25 2HB LEU 25 8.321 -2.137 -0.240
203 2HB LEU 25 1HB LEU 25 6.577 -2.322 -0.190
204 HG LEU 25 HG LEU 25 7.090 -1.050 -2.150
205 1HD1 LEU 25 3HD1 LEU 25 5.236 -0.217 -0.543
206 2HD1 LEU 25 2HD1 LEU 25 6.333 1.127 -0.226
207 3HD1 LEU 25 1HD1 LEU 25 5.749 0.833 -1.862
208 1HD2 LEU 25 3HD2 LEU 25 9.276 -0.115 -0.647
209 2HD2 LEU 25 2HD2 LEU 25 8.887 0.280 -2.320
210 3HD2 LEU 25 1HD2 LEU 25 8.308 1.312 -1.013
211 H MET 26 H MET 26 9.852 -1.096 1.939
212 HA MET 26 HA MET 26 10.136 1.795 2.408
213 1HB MET 26 2HB MET 26 11.268 -0.193 3.711
214 2HB MET 26 1HB MET 26 12.452 -0.123 2.406
215 1HG MET 26 2HG MET 26 13.028 2.133 2.913
216 2HG MET 26 1HG MET 26 11.620 2.337 3.954
217 1HE MET 26 2HE MET 26 12.617 3.219 5.843
218 2HE MET 26 1HE MET 26 11.659 1.910 6.528
219 3HE MET 26 3HE MET 26 13.285 2.235 7.143
220 H TYR 27 H TYR 27 10.115 2.922 0.496
221 HA TYR 27 HA TYR 27 11.928 2.005 -1.690
222 1HB TYR 27 2HB TYR 27 10.561 3.110 -3.236
223 2HB TYR 27 1HB TYR 27 9.396 2.497 -2.071
224 HD1 TYR 27 HD2 TYR 27 8.699 4.111 -0.135
225 HD2 TYR 27 HD1 TYR 27 10.629 5.394 -3.755
226 HE1 TYR 27 HE2 TYR 27 7.873 6.418 0.238
227 HE2 TYR 27 HE1 TYR 27 9.800 7.699 -3.381
228 HH TYR 27 HH TYR 27 7.467 8.573 -1.776
229 H LYS 28 H LYS 28 11.305 4.637 0.554
230 HA LYS 28 HA LYS 28 13.911 5.813 -0.182
231 1HB LYS 28 2HB LYS 28 11.475 6.953 -1.023
232 2HB LYS 28 1HB LYS 28 11.998 7.930 0.347
233 1HG LYS 28 2HG LYS 28 13.422 8.977 -1.048
234 2HG LYS 28 1HG LYS 28 14.332 7.470 -1.145
235 1HD LYS 28 2HD LYS 28 12.883 6.731 -3.019
236 2HD LYS 28 1HD LYS 28 12.023 8.269 -2.942
237 1HE LYS 28 2HE LYS 28 13.565 9.105 -4.356
238 2HE LYS 28 1HE LYS 28 14.737 8.971 -3.046
239 1HZ LYS 28 2HZ LYS 28 15.184 6.687 -3.753
240 2HZ LYS 28 1HZ LYS 28 14.102 6.872 -5.050
241 3HZ LYS 28 3HZ LYS 28 15.518 7.803 -4.990
242 H GLY 29 H GLY 29 13.354 4.244 2.039
243 1HA GLY 29 2HA GLY 29 13.687 4.253 4.361
244 2HA GLY 29 1HA GLY 29 14.162 5.945 4.211
245 H GLN 30 H GLN 30 11.049 5.100 2.939
246 HA GLN 30 HA GLN 30 9.690 5.926 5.439
247 1HB GLN 30 2HB GLN 30 8.237 7.494 4.062
248 2HB GLN 30 1HB GLN 30 9.896 8.029 4.310
249 1HG GLN 30 2HG GLN 30 10.318 6.737 2.034
250 2HG GLN 30 1HG GLN 30 8.590 7.001 1.816
251 1HE2 GLN 30 2HE2 GLN 30 9.005 10.388 0.954
252 2HE2 GLN 30 1HE2 GLN 30 7.988 9.029 0.999
253 HA PRO 31 HA PRO 31 7.617 2.286 3.611
254 1HB PRO 31 2HB PRO 31 6.626 1.704 6.230
255 2HB PRO 31 1HB PRO 31 7.919 0.874 5.360
256 1HG PRO 31 2HG PRO 31 8.163 2.641 7.639
257 2HG PRO 31 1HG PRO 31 9.443 1.750 6.805
258 1HD PRO 31 2HD PRO 31 8.913 4.578 6.704
259 2HD PRO 31 1HD PRO 31 10.187 3.678 5.856
260 H MET 32 H MET 32 5.612 2.629 2.696
261 HA MET 32 HA MET 32 3.361 3.583 4.303
262 1HB MET 32 2HB MET 32 2.907 5.576 2.921
263 2HB MET 32 1HB MET 32 4.463 5.714 3.738
264 1HG MET 32 2HG MET 32 5.479 4.714 1.588
265 2HG MET 32 1HG MET 32 3.926 5.078 0.835
266 1HE MET 32 3HE MET 32 2.850 7.093 0.625
267 2HE MET 32 2HE MET 32 2.993 7.910 2.180
268 3HE MET 32 1HE MET 32 3.525 8.726 0.714
269 H THR 33 H THR 33 1.317 3.611 3.011
270 HA THR 33 HA THR 33 1.049 1.338 1.334
271 HB THR 33 HB THR 33 -1.219 2.009 0.983
272 HG1 THR 33 HG1 THR 33 -1.805 4.014 0.832
273 1HG2 THR 33 2HG2 THR 33 -0.480 1.492 3.375
274 2HG2 THR 33 1HG2 THR 33 -0.566 3.230 3.661
275 3HG2 THR 33 3HG2 THR 33 -2.015 2.341 3.192
276 H PHE 34 H PHE 34 0.897 1.275 -0.986
277 HA PHE 34 HA PHE 34 2.158 3.684 -2.214
278 1HB PHE 34 2HB PHE 34 3.003 1.039 -1.825
279 2HB PHE 34 1HB PHE 34 2.783 1.248 -3.558
280 HD1 PHE 34 HD1 PHE 34 4.130 3.119 -0.606
281 HD2 PHE 34 HD2 PHE 34 4.550 2.096 -4.749
282 HE1 PHE 34 HE1 PHE 34 6.261 4.399 -0.707
283 HE2 PHE 34 HE2 PHE 34 6.679 3.374 -4.861
284 HZ PHE 34 HZ PHE 34 7.530 4.525 -2.837
285 H ARG 35 H ARG 35 -0.771 3.276 -2.438
286 HA ARG 35 HA ARG 35 -0.878 3.532 -5.351
287 1HB ARG 35 2HB ARG 35 -3.040 1.764 -4.930
288 2HB ARG 35 1HB ARG 35 -1.613 1.496 -5.917
289 1HG ARG 35 2HG ARG 35 -0.872 1.038 -3.197
290 2HG ARG 35 1HG ARG 35 -2.369 0.182 -3.504
291 1HD ARG 35 2HD ARG 35 -0.356 -1.172 -4.023
292 2HD ARG 35 1HD ARG 35 -1.415 -0.932 -5.423
293 HE ARG 35 HE ARG 35 0.289 1.112 -5.773
294 1HH1 ARG 35 2HH1 ARG 35 0.366 -2.230 -6.085
295 2HH1 ARG 35 1HH1 ARG 35 2.071 -2.339 -6.327
296 1HH2 ARG 35 1HH2 ARG 35 2.634 1.028 -5.589
297 2HH2 ARG 35 2HH2 ARG 35 3.367 -0.451 -6.083
298 H LEU 36 H LEU 36 -2.890 4.359 -6.136
299 HA LEU 36 HA LEU 36 -4.697 5.466 -4.025
300 1HB LEU 36 2HB LEU 36 -2.920 6.975 -5.511
301 2HB LEU 36 1HB LEU 36 -4.412 7.123 -6.438
302 HG LEU 36 HG LEU 36 -4.236 8.907 -4.735
303 1HD1 LEU 36 3HD1 LEU 36 -6.459 7.818 -5.392
304 2HD1 LEU 36 2HD1 LEU 36 -6.364 6.943 -3.863
305 3HD1 LEU 36 1HD1 LEU 36 -6.444 8.706 -3.868
306 1HD2 LEU 36 1HD2 LEU 36 -3.041 7.039 -3.166
307 2HD2 LEU 36 3HD2 LEU 36 -3.760 8.519 -2.533
308 3HD2 LEU 36 2HD2 LEU 36 -4.672 7.010 -2.495
309 H LEU 37 H LEU 37 -4.336 4.312 -7.364
310 HA LEU 37 HA LEU 37 -7.236 4.553 -7.857
311 1HB LEU 37 2HB LEU 37 -6.699 3.760 -10.123
312 2HB LEU 37 1HB LEU 37 -5.662 5.111 -9.672
313 HG LEU 37 HG LEU 37 -4.510 2.542 -8.888
314 1HD1 LEU 37 1HD1 LEU 37 -5.112 3.059 -11.814
315 2HD1 LEU 37 3HD1 LEU 37 -3.945 1.871 -11.237
316 3HD1 LEU 37 2HD1 LEU 37 -5.655 1.684 -10.853
317 1HD2 LEU 37 3HD2 LEU 37 -3.439 4.875 -9.116
318 2HD2 LEU 37 2HD2 LEU 37 -2.533 3.519 -9.785
319 3HD2 LEU 37 1HD2 LEU 37 -3.449 4.580 -10.854
320 H LEU 38 H LEU 38 -5.022 2.132 -6.729
321 HA LEU 38 HA LEU 38 -6.427 -0.204 -7.650
322 1HB LEU 38 2HB LEU 38 -4.031 0.151 -6.482
323 2HB LEU 38 1HB LEU 38 -4.950 -0.299 -5.052
324 HG LEU 38 HG LEU 38 -4.003 -2.309 -6.028
325 1HD1 LEU 38 3HD1 LEU 38 -6.472 -2.206 -5.202
326 2HD1 LEU 38 2HD1 LEU 38 -6.882 -2.371 -6.909
327 3HD1 LEU 38 1HD1 LEU 38 -5.942 -3.627 -6.103
328 1HD2 LEU 38 1HD2 LEU 38 -5.380 -1.383 -8.569
329 2HD2 LEU 38 3HD2 LEU 38 -3.644 -1.549 -8.306
330 3HD2 LEU 38 2HD2 LEU 38 -4.668 -2.982 -8.355
331 H VAL 39 H VAL 39 -6.210 0.492 -4.158
332 HA VAL 39 HA VAL 39 -8.989 -0.433 -3.843
333 HB VAL 39 HB VAL 39 -6.795 0.238 -1.840
334 1HG1 VAL 39 3HG1 VAL 39 -9.771 0.268 -1.420
335 2HG1 VAL 39 2HG1 VAL 39 -8.751 -0.461 -0.180
336 3HG1 VAL 39 1HG1 VAL 39 -8.516 1.227 -0.633
337 1HG2 VAL 39 3HG2 VAL 39 -7.142 -2.046 -2.939
338 2HG2 VAL 39 2HG2 VAL 39 -7.154 -2.034 -1.176
339 3HG2 VAL 39 1HG2 VAL 39 -8.672 -2.135 -2.067
340 H ASP 40 H ASP 40 -10.097 1.223 -4.959
341 HA ASP 40 HA ASP 40 -10.752 3.560 -3.315
342 1HB ASP 40 2HB ASP 40 -8.728 3.790 -5.300
343 2HB ASP 40 1HB ASP 40 -10.157 4.597 -5.942
344 H THR 41 H THR 41 -12.157 1.221 -4.429
345 HA THR 41 HA THR 41 -13.797 2.197 -6.637
346 HB THR 41 HB THR 41 -13.630 -0.328 -5.029
347 HG1 THR 41 HG1 THR 41 -12.444 -0.325 -6.846
348 1HG2 THR 41 2HG2 THR 41 -16.007 0.611 -6.630
349 2HG2 THR 41 1HG2 THR 41 -15.648 -1.104 -6.425
350 3HG2 THR 41 3HG2 THR 41 -15.985 -0.099 -5.015
351 HA PRO 42 HA PRO 42 -17.191 2.197 -3.159
352 1HB PRO 42 2HB PRO 42 -15.918 2.421 -0.599
353 2HB PRO 42 1HB PRO 42 -16.907 1.085 -1.203
354 1HG PRO 42 2HG PRO 42 -14.042 1.137 -0.804
355 2HG PRO 42 1HG PRO 42 -15.045 -0.215 -1.344
356 1HD PRO 42 2HD PRO 42 -13.228 1.358 -2.916
357 2HD PRO 42 1HD PRO 42 -14.264 0.026 -3.463
358 H GLU 43 H GLU 43 -17.286 4.321 -4.110
359 HA GLU 43 HA GLU 43 -16.532 6.504 -2.257
360 1HB GLU 43 2HB GLU 43 -15.612 6.349 -5.144
361 2HB GLU 43 1HB GLU 43 -15.572 7.828 -4.185
362 1HG GLU 43 2HG GLU 43 -14.203 6.503 -2.470
363 2HG GLU 43 1HG GLU 43 -14.030 5.268 -3.718
364 H THR 44 H THR 44 -19.070 5.291 -3.137
365 HA THR 44 HA THR 44 -20.396 7.775 -4.071
366 HB THR 44 HB THR 44 -21.743 6.463 -5.741
367 HG1 THR 44 HG1 THR 44 -21.526 4.394 -5.258
368 1HG2 THR 44 3HG2 THR 44 -19.687 7.814 -6.342
369 2HG2 THR 44 2HG2 THR 44 -18.774 6.306 -6.300
370 3HG2 THR 44 1HG2 THR 44 -20.077 6.515 -7.469
371 H LYS 45 H LYS 45 -22.951 7.116 -4.194
372 HA LYS 45 HA LYS 45 -23.630 6.285 -1.469
373 1HB LYS 45 2HB LYS 45 -25.118 7.380 -3.830
374 2HB LYS 45 1HB LYS 45 -26.036 6.538 -2.582
375 1HG LYS 45 2HG LYS 45 -24.205 8.273 -1.258
376 2HG LYS 45 1HG LYS 45 -24.995 9.210 -2.526
377 1HD LYS 45 2HD LYS 45 -26.456 9.424 -0.683
378 2HD LYS 45 1HD LYS 45 -27.195 8.153 -1.658
379 1HE LYS 45 2HE LYS 45 -25.390 6.788 -0.021
380 2HE LYS 45 1HE LYS 45 -26.099 8.005 1.040
381 1HZ LYS 45 1HZ LYS 45 -27.623 6.109 -0.666
382 2HZ LYS 45 3HZ LYS 45 -27.404 5.966 1.010
383 3HZ LYS 45 2HZ LYS 45 -28.294 7.268 0.380
384 H HIS 46 H HIS 46 -24.222 5.057 -4.767
385 HA HIS 46 HA HIS 46 -24.680 2.350 -3.584
386 1HB HIS 46 2HB HIS 46 -26.169 3.624 -5.908
387 2HB HIS 46 1HB HIS 46 -26.336 1.942 -5.409
388 HD1 HIS 46 HD1 HIS 46 -27.794 1.448 -3.375
389 HD2 HIS 46 HD2 HIS 46 -27.198 5.532 -3.970
390 HE1 HIS 46 HE1 HIS 46 -29.364 2.641 -1.786
391 HA PRO 47 HA PRO 47 -21.131 2.254 -6.508
392 1HB PRO 47 2HB PRO 47 -19.970 0.184 -4.933
393 2HB PRO 47 1HB PRO 47 -19.500 1.888 -4.972
394 1HG PRO 47 2HG PRO 47 -20.868 0.458 -2.851
395 2HG PRO 47 1HG PRO 47 -20.302 2.133 -2.854
396 1HD PRO 47 2HD PRO 47 -23.017 1.182 -3.078
397 2HD PRO 47 1HD PRO 47 -22.445 2.862 -3.061
398 H LYS 48 H LYS 48 -23.338 1.142 -7.511
399 HA LYS 48 HA LYS 48 -24.277 -0.673 -8.655
400 1HB LYS 48 2HB LYS 48 -21.304 -1.176 -8.871
401 2HB LYS 48 1HB LYS 48 -22.489 -2.173 -9.715
402 1HG LYS 48 2HG LYS 48 -23.439 0.159 -10.508
403 2HG LYS 48 1HG LYS 48 -21.810 0.719 -10.132
404 1HD LYS 48 2HD LYS 48 -20.825 -0.837 -11.672
405 2HD LYS 48 1HD LYS 48 -22.355 -1.687 -11.885
406 1HE LYS 48 2HE LYS 48 -23.294 0.528 -12.767
407 2HE LYS 48 1HE LYS 48 -21.622 1.084 -12.843
408 1HZ LYS 48 1HZ LYS 48 -21.103 -0.812 -14.260
409 2HZ LYS 48 3HZ LYS 48 -22.721 -1.319 -14.203
410 3HZ LYS 48 2HZ LYS 48 -22.318 0.153 -14.950
411 H LYS 49 H LYS 49 -24.099 -1.021 -5.752
412 HA LYS 49 HA LYS 49 -24.298 -2.691 -4.119
413 1HB LYS 49 2HB LYS 49 -26.102 -3.255 -5.893
414 2HB LYS 49 1HB LYS 49 -25.016 -4.553 -6.388
415 1HG LYS 49 2HG LYS 49 -26.344 -5.636 -4.802
416 2HG LYS 49 1HG LYS 49 -24.972 -5.119 -3.821
417 1HD LYS 49 2HD LYS 49 -26.427 -2.929 -3.508
418 2HD LYS 49 1HD LYS 49 -27.757 -4.013 -3.915
419 1HE LYS 49 2HE LYS 49 -27.321 -5.428 -2.063
420 2HE LYS 49 1HE LYS 49 -25.717 -4.739 -1.810
421 1HZ LYS 49 1HZ LYS 49 -26.755 -2.643 -1.195
422 2HZ LYS 49 3HZ LYS 49 -28.296 -3.313 -1.429
423 3HZ LYS 49 2HZ LYS 49 -27.294 -3.903 -0.190
424 H GLY 50 H GLY 50 -21.718 -2.423 -4.448
425 1HA GLY 50 2HA GLY 50 -20.459 -4.799 -3.762
426 2HA GLY 50 1HA GLY 50 -20.349 -4.758 -5.521
427 H VAL 51 H VAL 51 -18.416 -4.276 -3.081
428 HA VAL 51 HA VAL 51 -17.051 -1.940 -4.337
429 HB VAL 51 HB VAL 51 -16.365 -1.197 -2.054
430 1HG1 VAL 51 3HG1 VAL 51 -18.365 -0.242 -3.199
431 2HG1 VAL 51 2HG1 VAL 51 -19.368 -1.436 -2.375
432 3HG1 VAL 51 1HG1 VAL 51 -18.506 -0.213 -1.442
433 1HG2 VAL 51 3HG2 VAL 51 -16.653 -3.450 -0.978
434 2HG2 VAL 51 2HG2 VAL 51 -17.441 -2.148 -0.089
435 3HG2 VAL 51 1HG2 VAL 51 -18.400 -3.234 -1.093
436 H GLU 52 H GLU 52 -14.798 -2.034 -2.576
437 HA GLU 52 HA GLU 52 -13.343 -4.271 -3.746
438 1HB GLU 52 2HB GLU 52 -12.672 -1.769 -2.603
439 2HB GLU 52 1HB GLU 52 -11.912 -2.989 -1.583
440 1HG GLU 52 2HG GLU 52 -10.282 -2.728 -3.220
441 2HG GLU 52 1HG GLU 52 -11.223 -4.053 -3.906
442 H LYS 53 H LYS 53 -13.276 -6.285 -2.890
443 HA LYS 53 HA LYS 53 -13.994 -6.633 -0.012
444 1HB LYS 53 2HB LYS 53 -14.249 -8.378 -2.449
445 2HB LYS 53 1HB LYS 53 -14.175 -9.121 -0.850
446 1HG LYS 53 2HG LYS 53 -16.063 -7.680 -0.118
447 2HG LYS 53 1HG LYS 53 -16.163 -7.014 -1.748
448 1HD LYS 53 2HD LYS 53 -16.934 -9.020 -2.665
449 2HD LYS 53 1HD LYS 53 -16.267 -9.991 -1.353
450 1HE LYS 53 2HE LYS 53 -18.535 -10.005 -0.815
451 2HE LYS 53 1HE LYS 53 -17.964 -8.631 0.132
452 1HZ LYS 53 3HZ LYS 53 -19.164 -8.461 -2.581
453 2HZ LYS 53 2HZ LYS 53 -19.972 -8.109 -1.128
454 3HZ LYS 53 1HZ LYS 53 -18.662 -7.151 -1.628
455 H TYR 54 H TYR 54 -11.795 -5.988 0.596
456 HA TYR 54 HA TYR 54 -9.474 -6.308 0.899
457 1HB TYR 54 2HB TYR 54 -9.092 -8.578 2.046
458 2HB TYR 54 1HB TYR 54 -10.275 -7.501 2.780
459 HD1 TYR 54 HD1 TYR 54 -12.682 -7.971 2.631
460 HD2 TYR 54 HD2 TYR 54 -9.779 -10.626 0.900
461 HE1 TYR 54 HE1 TYR 54 -14.417 -9.728 2.411
462 HE2 TYR 54 HE2 TYR 54 -11.517 -12.379 0.677
463 HH TYR 54 HH TYR 54 -14.005 -12.702 2.186
464 H GLY 55 H GLY 55 -9.749 -6.466 -1.772
465 1HA GLY 55 2HA GLY 55 -8.381 -7.196 -3.571
466 2HA GLY 55 1HA GLY 55 -7.713 -8.446 -2.519
467 HA PRO 56 HA PRO 56 -12.113 -9.876 -4.194
468 1HB PRO 56 2HB PRO 56 -12.286 -8.642 -6.796
469 2HB PRO 56 1HB PRO 56 -13.392 -8.470 -5.427
470 1HG PRO 56 2HG PRO 56 -11.518 -6.524 -6.424
471 2HG PRO 56 1HG PRO 56 -12.612 -6.365 -5.044
472 1HD PRO 56 2HD PRO 56 -9.752 -6.685 -4.995
473 2HD PRO 56 1HD PRO 56 -10.853 -6.535 -3.614
474 H GLU 57 H GLU 57 -10.289 -8.996 -7.157
475 HA GLU 57 HA GLU 57 -9.139 -11.708 -7.314
476 1HB GLU 57 2HB GLU 57 -10.024 -11.703 -9.825
477 2HB GLU 57 1HB GLU 57 -11.004 -12.359 -8.518
478 1HG GLU 57 2HG GLU 57 -11.465 -9.518 -8.707
479 2HG GLU 57 1HG GLU 57 -11.679 -10.251 -10.294
480 H ALA 58 H ALA 58 -9.695 -9.024 -9.650
481 HA ALA 58 HA ALA 58 -7.037 -9.134 -10.716
482 1HB ALA 58 1HB ALA 58 -9.004 -6.819 -10.676
483 2HB ALA 58 3HB ALA 58 -7.566 -6.915 -11.693
484 3HB ALA 58 2HB ALA 58 -8.891 -8.053 -11.930
485 H SER 59 H SER 59 -8.533 -7.060 -8.229
486 HA SER 59 HA SER 59 -6.108 -5.585 -7.642
487 1HB SER 59 2HB SER 59 -8.679 -6.001 -6.095
488 2HB SER 59 1HB SER 59 -7.375 -4.962 -5.531
489 HG SER 59 HG SER 59 -9.192 -4.615 -7.593
490 H ALA 60 H ALA 60 -7.596 -8.559 -6.420
491 HA ALA 60 HA ALA 60 -5.957 -8.917 -4.100
492 1HB ALA 60 3HB ALA 60 -8.035 -10.306 -5.278
493 2HB ALA 60 2HB ALA 60 -6.667 -11.392 -5.518
494 3HB ALA 60 1HB ALA 60 -7.099 -10.866 -3.892
495 H PHE 61 H PHE 61 -5.489 -9.906 -7.500
496 HA PHE 61 HA PHE 61 -3.050 -11.373 -7.045
497 1HB PHE 61 2HB PHE 61 -4.019 -9.989 -9.569
498 2HB PHE 61 1HB PHE 61 -2.727 -11.184 -9.490
499 HD1 PHE 61 HD2 PHE 61 -3.984 -13.022 -7.400
500 HD2 PHE 61 HD1 PHE 61 -5.596 -11.167 -10.926
501 HE1 PHE 61 HE2 PHE 61 -5.664 -14.836 -7.588
502 HE2 PHE 61 HE1 PHE 61 -7.273 -12.984 -11.112
503 HZ PHE 61 HZ PHE 61 -7.308 -14.817 -9.443
504 H THR 62 H THR 62 -3.753 -7.965 -7.515
505 HA THR 62 HA THR 62 -0.941 -7.228 -7.933
506 HB THR 62 HB THR 62 -3.386 -5.514 -7.360
507 HG1 THR 62 HG1 THR 62 -3.680 -6.213 -9.349
508 1HG2 THR 62 1HG2 THR 62 -0.503 -4.871 -7.889
509 2HG2 THR 62 3HG2 THR 62 -1.760 -3.769 -8.453
510 3HG2 THR 62 2HG2 THR 62 -1.614 -4.135 -6.734
511 H LYS 63 H LYS 63 -3.244 -7.431 -5.281
512 HA LYS 63 HA LYS 63 -1.511 -6.079 -3.357
513 1HB LYS 63 2HB LYS 63 -3.923 -5.961 -3.064
514 2HB LYS 63 1HB LYS 63 -4.042 -7.719 -3.033
515 1HG LYS 63 2HG LYS 63 -2.128 -6.690 -1.069
516 2HG LYS 63 1HG LYS 63 -3.758 -6.078 -0.814
517 1HD LYS 63 2HD LYS 63 -3.366 -8.999 -1.368
518 2HD LYS 63 1HD LYS 63 -3.056 -8.377 0.253
519 1HE LYS 63 2HE LYS 63 -5.262 -8.214 0.688
520 2HE LYS 63 1HE LYS 63 -5.541 -7.308 -0.799
521 1HZ LYS 63 3HZ LYS 63 -5.285 -10.262 -0.615
522 2HZ LYS 63 2HZ LYS 63 -6.748 -9.413 -0.768
523 3HZ LYS 63 1HZ LYS 63 -5.605 -9.375 -2.024
524 H LYS 64 H LYS 64 -1.840 -9.343 -4.565
525 HA LYS 64 HA LYS 64 -0.664 -10.585 -2.211
526 1HB LYS 64 2HB LYS 64 -0.867 -12.633 -3.413
527 2HB LYS 64 1HB LYS 64 -2.286 -11.690 -3.865
528 1HG LYS 64 2HG LYS 64 -1.513 -12.433 -5.938
529 2HG LYS 64 1HG LYS 64 -0.773 -10.841 -5.810
530 1HD LYS 64 2HD LYS 64 1.229 -11.776 -6.043
531 2HD LYS 64 1HD LYS 64 0.972 -12.628 -4.522
532 1HE LYS 64 2HE LYS 64 -0.221 -14.430 -5.782
533 2HE LYS 64 1HE LYS 64 0.185 -13.602 -7.285
534 1HZ LYS 64 2HZ LYS 64 2.539 -13.797 -6.682
535 2HZ LYS 64 1HZ LYS 64 2.108 -14.675 -5.292
536 3HZ LYS 64 3HZ LYS 64 1.792 -15.317 -6.830
537 H MET 65 H MET 65 0.447 -9.311 -5.322
538 HA MET 65 HA MET 65 3.046 -10.471 -5.346
539 1HB MET 65 2HB MET 65 3.603 -8.893 -6.994
540 2HB MET 65 1HB MET 65 1.857 -9.046 -7.165
541 1HG MET 65 2HG MET 65 1.836 -7.057 -5.417
542 2HG MET 65 1HG MET 65 3.462 -6.779 -6.041
543 1HE MET 65 1HE MET 65 3.907 -7.134 -8.604
544 2HE MET 65 3HE MET 65 2.589 -8.196 -9.117
545 3HE MET 65 2HE MET 65 2.811 -6.628 -9.888
546 H LEU 66 H LEU 66 1.663 -7.915 -3.441
547 HA LEU 66 HA LEU 66 4.220 -6.895 -2.427
548 1HB LEU 66 2HB LEU 66 1.315 -6.351 -1.992
549 2HB LEU 66 1HB LEU 66 2.381 -6.015 -0.636
550 HG LEU 66 HG LEU 66 1.960 -4.070 -2.203
551 1HD1 LEU 66 1HD1 LEU 66 3.942 -4.308 -0.650
552 2HD1 LEU 66 3HD1 LEU 66 4.864 -4.891 -2.035
553 3HD1 LEU 66 2HD1 LEU 66 4.206 -3.255 -2.039
554 1HD2 LEU 66 2HD2 LEU 66 2.200 -5.663 -4.248
555 2HD2 LEU 66 1HD2 LEU 66 2.853 -4.031 -4.364
556 3HD2 LEU 66 3HD2 LEU 66 3.931 -5.391 -4.050
557 H GLU 67 H GLU 67 1.990 -9.470 -1.705
558 HA GLU 67 HA GLU 67 2.843 -9.794 1.081
559 1HB GLU 67 2HB GLU 67 1.038 -11.391 -0.748
560 2HB GLU 67 1HB GLU 67 1.403 -11.879 0.907
561 1HG GLU 67 2HG GLU 67 0.517 -9.740 1.746
562 2HG GLU 67 1HG GLU 67 0.172 -9.229 0.093
563 H ASN 68 H ASN 68 3.761 -11.102 -2.056
564 HA ASN 68 HA ASN 68 5.533 -13.042 -0.601
565 1HB ASN 68 2HB ASN 68 5.168 -14.661 -2.306
566 2HB ASN 68 1HB ASN 68 3.582 -14.018 -1.888
567 1HD2 ASN 68 2HD2 ASN 68 3.307 -12.191 -5.037
568 2HD2 ASN 68 1HD2 ASN 68 2.922 -11.989 -3.390
569 H ALA 69 H ALA 69 5.704 -10.306 -2.591
570 HA ALA 69 HA ALA 69 8.021 -11.188 -4.167
571 1HB ALA 69 3HB ALA 69 6.362 -9.444 -4.932
572 2HB ALA 69 2HB ALA 69 7.071 -8.351 -3.744
573 3HB ALA 69 1HB ALA 69 8.055 -8.980 -5.063
574 H LYS 70 H LYS 70 10.160 -10.646 -3.849
575 HA LYS 70 HA LYS 70 10.844 -9.560 -1.142
576 1HB LYS 70 2HB LYS 70 11.786 -11.863 -2.632
577 2HB LYS 70 1HB LYS 70 13.127 -10.775 -2.272
578 1HG LYS 70 2HG LYS 70 11.122 -11.603 -0.166
579 2HG LYS 70 1HG LYS 70 12.584 -12.534 -0.488
580 1HD LYS 70 2HD LYS 70 13.856 -11.070 0.658
581 2HD LYS 70 1HD LYS 70 13.202 -9.708 -0.253
582 1HE LYS 70 2HE LYS 70 11.361 -10.895 1.744
583 2HE LYS 70 1HE LYS 70 12.776 -10.082 2.410
584 1HZ LYS 70 2HZ LYS 70 12.156 -8.215 0.790
585 2HZ LYS 70 1HZ LYS 70 10.633 -8.965 0.718
586 3HZ LYS 70 3HZ LYS 70 11.225 -8.394 2.200
587 H LYS 71 H LYS 71 12.063 -9.696 -4.509
588 HA LYS 71 HA LYS 71 13.605 -7.199 -4.109
589 1HB LYS 71 2HB LYS 71 13.715 -9.404 -5.936
590 2HB LYS 71 1HB LYS 71 13.418 -7.944 -6.878
591 1HG LYS 71 2HG LYS 71 15.574 -8.113 -4.762
592 2HG LYS 71 1HG LYS 71 15.870 -8.494 -6.458
593 1HD LYS 71 2HD LYS 71 14.557 -6.084 -6.643
594 2HD LYS 71 1HD LYS 71 15.494 -5.876 -5.164
595 1HE LYS 71 2HE LYS 71 16.890 -7.091 -7.503
596 2HE LYS 71 1HE LYS 71 16.537 -5.365 -7.579
597 1HZ LYS 71 1HZ LYS 71 17.938 -6.711 -5.332
598 2HZ LYS 71 3HZ LYS 71 18.706 -5.847 -6.573
599 3HZ LYS 71 2HZ LYS 71 17.666 -5.043 -5.497
600 H ILE 72 H ILE 72 12.538 -5.244 -4.322
601 HA ILE 72 HA ILE 72 10.107 -5.217 -6.050
602 HB ILE 72 HB ILE 72 10.697 -3.772 -3.481
603 1HG1 ILE 72 2HG1 ILE 72 8.206 -5.328 -3.866
604 2HG1 ILE 72 1HG1 ILE 72 9.694 -6.273 -3.802
605 1HG2 ILE 72 2HG2 ILE 72 8.675 -3.255 -5.601
606 2HG2 ILE 72 1HG2 ILE 72 8.162 -3.089 -3.921
607 3HG2 ILE 72 3HG2 ILE 72 9.499 -2.120 -4.535
608 1HD1 ILE 72 1HD1 ILE 72 10.258 -4.880 -1.697
609 2HD1 ILE 72 3HD1 ILE 72 8.552 -4.431 -1.704
610 3HD1 ILE 72 2HD1 ILE 72 9.018 -6.125 -1.542
611 H GLU 73 H GLU 73 10.792 -4.244 -7.876
612 HA GLU 73 HA GLU 73 12.559 -1.885 -7.742
613 1HB GLU 73 2HB GLU 73 11.701 -3.805 -9.804
614 2HB GLU 73 1HB GLU 73 11.688 -2.136 -10.372
615 1HG GLU 73 2HG GLU 73 13.893 -2.970 -10.803
616 2HG GLU 73 1HG GLU 73 14.033 -1.913 -9.398
617 H VAL 74 H VAL 74 10.584 -1.140 -6.294
618 HA VAL 74 HA VAL 74 8.057 -0.478 -7.131
619 HB VAL 74 HB VAL 74 8.923 1.963 -6.017
620 1HG1 VAL 74 2HG1 VAL 74 6.801 0.817 -5.625
621 2HG1 VAL 74 1HG1 VAL 74 7.652 -0.431 -4.712
622 3HG1 VAL 74 3HG1 VAL 74 7.603 1.224 -4.107
623 1HG2 VAL 74 1HG2 VAL 74 10.208 -0.430 -4.679
624 2HG2 VAL 74 3HG2 VAL 74 11.032 0.989 -5.324
625 3HG2 VAL 74 2HG2 VAL 74 9.997 1.139 -3.906
626 H GLU 75 H GLU 75 7.333 0.326 -8.953
627 HA GLU 75 HA GLU 75 8.993 2.278 -10.451
628 1HB GLU 75 2HB GLU 75 6.969 1.797 -12.160
629 2HB GLU 75 1HB GLU 75 8.392 0.772 -12.070
630 1HG GLU 75 2HG GLU 75 6.021 0.193 -10.323
631 2HG GLU 75 1HG GLU 75 6.030 -0.328 -12.004
632 H PHE 76 H PHE 76 8.591 4.171 -9.374
633 HA PHE 76 HA PHE 76 5.769 5.103 -9.286
634 1HB PHE 76 2HB PHE 76 6.669 6.657 -7.434
635 2HB PHE 76 1HB PHE 76 6.471 4.957 -7.022
636 HD1 PHE 76 HD1 PHE 76 9.016 7.423 -8.247
637 HD2 PHE 76 HD2 PHE 76 8.294 3.704 -6.216
638 HE1 PHE 76 HE1 PHE 76 11.420 7.276 -7.657
639 HE2 PHE 76 HE2 PHE 76 10.698 3.559 -5.629
640 HZ PHE 76 HZ PHE 76 12.260 5.345 -6.348
641 H ASP 77 H ASP 77 5.757 7.597 -9.257
642 HA ASP 77 HA ASP 77 7.218 8.522 -11.634
643 1HB ASP 77 2HB ASP 77 5.286 10.080 -9.890
644 2HB ASP 77 1HB ASP 77 5.793 10.481 -11.530
645 H LYS 78 H LYS 78 9.049 9.725 -11.566
646 HA LYS 78 HA LYS 78 10.381 10.277 -9.070
647 1HB LYS 78 2HB LYS 78 12.085 11.382 -10.449
648 2HB LYS 78 1HB LYS 78 11.604 9.856 -11.188
649 1HG LYS 78 2HG LYS 78 9.933 11.226 -12.572
650 2HG LYS 78 1HG LYS 78 10.803 12.654 -12.012
651 1HD LYS 78 2HD LYS 78 12.606 10.567 -12.989
652 2HD LYS 78 1HD LYS 78 11.472 11.110 -14.225
653 1HE LYS 78 2HE LYS 78 12.995 12.778 -14.534
654 2HE LYS 78 1HE LYS 78 12.193 13.500 -13.140
655 1HZ LYS 78 3HZ LYS 78 14.572 11.723 -13.017
656 2HZ LYS 78 2HZ LYS 78 14.604 13.415 -12.871
657 3HZ LYS 78 1HZ LYS 78 13.816 12.473 -11.695
658 H GLY 79 H GLY 79 10.312 12.078 -7.798
659 1HA GLY 79 2HA GLY 79 10.040 14.394 -7.279
660 2HA GLY 79 1HA GLY 79 9.384 14.657 -8.893
661 H GLN 80 H GLN 80 7.552 12.195 -8.321
662 HA GLN 80 HA GLN 80 5.343 13.761 -7.252
663 1HB GLN 80 2HB GLN 80 5.001 12.222 -9.155
664 2HB GLN 80 1HB GLN 80 5.489 10.861 -8.150
665 1HG GLN 80 2HG GLN 80 3.411 12.395 -6.833
666 2HG GLN 80 1HG GLN 80 2.889 11.902 -8.443
667 1HE2 GLN 80 2HE2 GLN 80 2.648 9.180 -5.628
668 2HE2 GLN 80 1HE2 GLN 80 2.521 10.859 -5.427
669 H ARG 81 H ARG 81 6.010 10.362 -6.405
670 HA ARG 81 HA ARG 81 6.284 9.300 -4.339
671 1HB ARG 81 2HB ARG 81 6.911 12.102 -3.357
672 2HB ARG 81 1HB ARG 81 7.104 10.632 -2.405
673 1HG ARG 81 2HG ARG 81 8.762 9.771 -3.936
674 2HG ARG 81 1HG ARG 81 8.464 11.085 -5.075
675 1HD ARG 81 2HD ARG 81 10.452 11.678 -3.872
676 2HD ARG 81 1HD ARG 81 9.160 12.689 -3.227
677 HE ARG 81 HE ARG 81 9.170 10.456 -1.568
678 1HH1 ARG 81 1HH2 ARG 81 12.121 10.384 -2.266
679 2HH1 ARG 81 2HH2 ARG 81 12.799 11.358 -1.003
680 1HH2 ARG 81 2HH1 ARG 81 9.752 12.758 -0.089
681 2HH2 ARG 81 1HH1 ARG 81 11.453 12.707 0.232
682 H THR 82 H THR 82 4.451 12.352 -4.136
683 HA THR 82 HA THR 82 2.120 10.949 -3.008
684 HB THR 82 HB THR 82 1.978 12.539 -1.073
685 HG1 THR 82 HG1 THR 82 4.729 12.985 -1.600
686 1HG2 THR 82 2HG2 THR 82 2.923 10.157 -0.974
687 2HG2 THR 82 1HG2 THR 82 4.516 10.911 -0.928
688 3HG2 THR 82 3HG2 THR 82 3.349 11.238 0.353
689 H ASP 83 H ASP 83 0.282 11.942 -3.812
690 HA ASP 83 HA ASP 83 0.300 13.908 -5.785
691 1HB ASP 83 2HB ASP 83 -1.727 12.621 -5.243
692 2HB ASP 83 1HB ASP 83 -1.858 13.456 -3.695
693 H LYS 84 H LYS 84 -0.528 14.500 -2.392
694 HA LYS 84 HA LYS 84 0.876 17.116 -2.525
695 1HB LYS 84 2HB LYS 84 -1.806 17.098 -2.582
696 2HB LYS 84 1HB LYS 84 -1.594 16.878 -0.844
697 1HG LYS 84 2HG LYS 84 0.234 18.895 -1.565
698 2HG LYS 84 1HG LYS 84 -1.251 19.280 -2.433
699 1HD LYS 84 2HD LYS 84 -2.092 20.113 -0.520
700 2HD LYS 84 1HD LYS 84 -2.057 18.485 0.155
701 1HE LYS 84 2HE LYS 84 -0.708 19.574 1.690
702 2HE LYS 84 1HE LYS 84 0.513 19.067 0.525
703 1HZ LYS 84 1HZ LYS 84 -0.833 21.715 0.575
704 2HZ LYS 84 3HZ LYS 84 0.748 21.402 1.101
705 3HZ LYS 84 2HZ LYS 84 0.351 21.225 -0.541
706 H TYR 85 H TYR 85 1.242 14.230 -1.480
707 HA TYR 85 HA TYR 85 2.726 13.553 0.283
708 1HB TYR 85 2HB TYR 85 2.918 15.919 1.208
709 2HB TYR 85 1HB TYR 85 1.408 15.615 2.078
710 HD1 TYR 85 HD2 TYR 85 4.596 13.746 1.377
711 HD2 TYR 85 HD1 TYR 85 1.662 14.918 4.288
712 HE1 TYR 85 HE2 TYR 85 5.822 12.479 3.118
713 HE2 TYR 85 HE1 TYR 85 2.885 13.647 6.030
714 HH TYR 85 HH TYR 85 4.816 11.367 5.632
715 H GLY 86 H GLY 86 0.221 12.782 -0.774
716 1HA GLY 86 2HA GLY 86 -1.176 11.796 1.644
717 2HA GLY 86 1HA GLY 86 -1.940 12.053 0.082
718 H ARG 87 H ARG 87 0.371 10.763 -1.382
719 HA ARG 87 HA ARG 87 0.581 8.048 -0.398
720 1HB ARG 87 2HB ARG 87 -1.897 8.690 -1.291
721 2HB ARG 87 1HB ARG 87 -1.149 8.066 -2.759
722 1HG ARG 87 2HG ARG 87 -2.079 6.137 -1.724
723 2HG ARG 87 1HG ARG 87 -0.368 6.078 -1.303
724 1HD ARG 87 2HD ARG 87 -2.229 7.534 0.535
725 2HD ARG 87 1HD ARG 87 -2.245 5.775 0.557
726 HE ARG 87 HE ARG 87 0.455 6.431 0.720
727 1HH1 ARG 87 2HH1 ARG 87 -1.641 5.393 2.883
728 2HH1 ARG 87 1HH1 ARG 87 -1.183 6.413 4.205
729 1HH2 ARG 87 1HH2 ARG 87 0.730 8.550 2.244
730 2HH2 ARG 87 2HH2 ARG 87 0.162 8.204 3.843
731 H VAL 88 H VAL 88 1.827 6.729 -1.718
732 HA VAL 88 HA VAL 88 3.198 8.064 -3.971
733 HB VAL 88 HB VAL 88 3.707 5.264 -2.951
734 1HG1 VAL 88 1HG1 VAL 88 5.094 7.285 -4.660
735 2HG1 VAL 88 3HG1 VAL 88 6.109 6.277 -3.629
736 3HG1 VAL 88 2HG1 VAL 88 5.040 5.530 -4.817
737 1HG2 VAL 88 3HG2 VAL 88 4.068 7.779 -1.528
738 2HG2 VAL 88 2HG2 VAL 88 4.335 6.133 -0.960
739 3HG2 VAL 88 1HG2 VAL 88 5.619 6.990 -1.811
740 H LEU 89 H LEU 89 1.113 8.004 -5.235
741 HA LEU 89 HA LEU 89 -0.143 5.583 -6.053
742 1HB LEU 89 2HB LEU 89 -0.868 6.948 -8.086
743 2HB LEU 89 1HB LEU 89 -1.291 7.634 -6.520
744 HG LEU 89 HG LEU 89 1.346 8.526 -7.305
745 1HD1 LEU 89 1HD1 LEU 89 0.404 8.094 -9.598
746 2HD1 LEU 89 3HD1 LEU 89 -0.885 9.238 -9.228
747 3HD1 LEU 89 2HD1 LEU 89 0.789 9.788 -9.293
748 1HD2 LEU 89 2HD2 LEU 89 -0.208 9.589 -5.659
749 2HD2 LEU 89 1HD2 LEU 89 0.341 10.717 -6.899
750 3HD2 LEU 89 3HD2 LEU 89 -1.277 10.022 -6.993
751 H ALA 90 H ALA 90 1.449 4.052 -6.499
752 HA ALA 90 HA ALA 90 2.670 4.227 -9.188
753 1HB ALA 90 3HB ALA 90 4.246 3.761 -6.633
754 2HB ALA 90 2HB ALA 90 4.886 3.514 -8.257
755 3HB ALA 90 1HB ALA 90 4.417 5.128 -7.732
756 H TYR 91 H TYR 91 4.230 1.856 -8.957
757 HA TYR 91 HA TYR 91 2.359 -0.164 -7.896
758 1HB TYR 91 2HB TYR 91 2.949 0.254 -10.771
759 2HB TYR 91 1HB TYR 91 2.762 -1.407 -10.183
760 HD1 TYR 91 HD1 TYR 91 0.778 -1.804 -8.504
761 HD2 TYR 91 HD2 TYR 91 0.989 1.493 -11.251
762 HE1 TYR 91 HE1 TYR 91 -1.656 -1.440 -8.244
763 HE2 TYR 91 HE2 TYR 91 -1.453 1.848 -10.999
764 HH TYR 91 HH TYR 91 -3.522 -0.114 -10.124
765 H ILE 92 H ILE 92 3.226 -2.301 -7.744
766 HA ILE 92 HA ILE 92 6.204 -2.274 -7.403
767 HB ILE 92 HB ILE 92 4.298 -4.154 -5.974
768 1HG1 ILE 92 2HG1 ILE 92 3.507 -1.977 -5.283
769 2HG1 ILE 92 1HG1 ILE 92 4.458 -2.657 -3.976
770 1HG2 ILE 92 2HG2 ILE 92 7.123 -3.765 -6.069
771 2HG2 ILE 92 1HG2 ILE 92 6.560 -3.433 -4.432
772 3HG2 ILE 92 3HG2 ILE 92 6.206 -4.985 -5.189
773 1HD1 ILE 92 2HD1 ILE 92 5.889 -0.947 -5.956
774 2HD1 ILE 92 1HD1 ILE 92 4.820 -0.146 -4.806
775 3HD1 ILE 92 3HD1 ILE 92 6.158 -1.134 -4.223
776 H TYR 93 H TYR 93 7.058 -3.503 -9.064
777 HA TYR 93 HA TYR 93 5.519 -5.903 -9.972
778 1HB TYR 93 2HB TYR 93 7.857 -4.536 -11.342
779 2HB TYR 93 1HB TYR 93 6.844 -5.814 -12.010
780 HD1 TYR 93 HD2 TYR 93 4.284 -4.494 -10.522
781 HD2 TYR 93 HD1 TYR 93 7.266 -3.137 -13.287
782 HE1 TYR 93 HE2 TYR 93 2.749 -2.762 -11.339
783 HE2 TYR 93 HE1 TYR 93 5.733 -1.404 -14.110
784 HH TYR 93 HH TYR 93 2.705 -1.380 -13.916
785 H ALA 94 H ALA 94 6.696 -6.036 -7.557
786 HA ALA 94 HA ALA 94 9.370 -7.093 -7.715
787 1HB ALA 94 3HB ALA 94 8.565 -5.879 -5.725
788 2HB ALA 94 2HB ALA 94 7.335 -7.112 -5.467
789 3HB ALA 94 1HB ALA 94 9.041 -7.521 -5.297
790 H ASP 95 H ASP 95 9.630 -9.064 -8.626
791 HA ASP 95 HA ASP 95 9.285 -11.332 -9.168
792 1HB ASP 95 2HB ASP 95 7.961 -11.129 -6.460
793 2HB ASP 95 1HB ASP 95 8.170 -12.655 -7.314
794 H GLY 96 H GLY 96 7.084 -9.187 -9.726
795 1HA GLY 96 2HA GLY 96 4.914 -11.143 -10.352
796 2HA GLY 96 1HA GLY 96 4.546 -9.540 -9.719
797 H LYS 97 H LYS 97 5.849 -7.789 -10.996
798 HA LYS 97 HA LYS 97 5.730 -6.556 -13.017
799 1HB LYS 97 2HB LYS 97 7.664 -8.289 -13.342
800 2HB LYS 97 1HB LYS 97 6.537 -9.085 -14.439
801 1HG LYS 97 2HG LYS 97 6.328 -7.046 -15.765
802 2HG LYS 97 1HG LYS 97 7.358 -6.174 -14.631
803 1HD LYS 97 2HD LYS 97 8.440 -8.688 -15.830
804 2HD LYS 97 1HD LYS 97 8.348 -7.261 -16.863
805 1HE LYS 97 2HE LYS 97 9.574 -5.967 -15.109
806 2HE LYS 97 1HE LYS 97 9.759 -7.458 -14.187
807 1HZ LYS 97 1HZ LYS 97 10.922 -8.431 -16.078
808 2HZ LYS 97 3HZ LYS 97 10.766 -6.978 -16.940
809 3HZ LYS 97 2HZ LYS 97 11.709 -7.030 -15.528
810 H MET 98 H MET 98 3.375 -8.138 -12.113
811 HA MET 98 HA MET 98 2.008 -8.982 -14.578
812 1HB MET 98 2HB MET 98 0.063 -9.301 -12.927
813 2HB MET 98 1HB MET 98 1.473 -10.327 -12.670
814 1HG MET 98 2HG MET 98 2.257 -8.950 -10.862
815 2HG MET 98 1HG MET 98 1.092 -7.684 -11.236
816 1HE MET 98 2HE MET 98 -1.060 -7.631 -11.085
817 2HE MET 98 1HE MET 98 -1.943 -9.121 -11.411
818 3HE MET 98 3HE MET 98 -2.025 -8.369 -9.811
819 H VAL 99 H VAL 99 1.872 -6.450 -12.117
820 HA VAL 99 HA VAL 99 -0.261 -4.967 -13.411
821 HB VAL 99 HB VAL 99 1.786 -4.194 -11.294
822 1HG1 VAL 99 2HG1 VAL 99 -0.374 -2.683 -12.687
823 2HG1 VAL 99 1HG1 VAL 99 -0.162 -2.410 -10.959
824 3HG1 VAL 99 3HG1 VAL 99 1.176 -2.114 -12.069
825 1HG2 VAL 99 1HG2 VAL 99 -1.141 -4.983 -11.174
826 2HG2 VAL 99 3HG2 VAL 99 0.223 -5.887 -10.515
827 3HG2 VAL 99 2HG2 VAL 99 -0.231 -4.337 -9.808
828 H ASN 100 H ASN 100 3.179 -5.349 -13.701
829 HA ASN 100 HA ASN 100 4.013 -2.940 -14.930
830 1HB ASN 100 2HB ASN 100 5.622 -4.680 -14.427
831 2HB ASN 100 1HB ASN 100 4.808 -5.807 -15.507
832 1HD2 ASN 100 2HD2 ASN 100 7.270 -2.935 -17.090
833 2HD2 ASN 100 1HD2 ASN 100 6.772 -2.812 -15.474
834 H GLU 101 H GLU 101 2.216 -5.664 -16.340
835 HA GLU 101 HA GLU 101 2.352 -5.046 -19.074
836 1HB GLU 101 2HB GLU 101 1.189 -7.035 -18.074
837 2HB GLU 101 1HB GLU 101 -0.135 -5.971 -17.602
838 1HG GLU 101 2HG GLU 101 0.577 -5.614 -20.407
839 2HG GLU 101 1HG GLU 101 0.134 -7.284 -20.057
840 H ALA 102 H ALA 102 0.067 -3.733 -16.649
841 HA ALA 102 HA ALA 102 -1.245 -1.957 -18.517
842 1HB ALA 102 2HB ALA 102 -1.097 -1.953 -15.486
843 2HB ALA 102 1HB ALA 102 -2.110 -0.852 -16.420
844 3HB ALA 102 3HB ALA 102 -2.405 -2.590 -16.483
845 H LEU 103 HN LEU 103 -0.179 -0.313 -19.484
846 HA LEU 103 HA LEU 103 1.020 1.687 -19.716
847 1HB LEU 103 2HB LEU 103 0.148 1.958 -17.207
848 2HB LEU 103 1HB LEU 103 1.859 1.734 -16.845
849 HG LEU 103 HG LEU 103 1.082 3.657 -19.012
850 1HD1 LEU 103 1HD1 LEU 103 1.021 4.261 -16.038
851 2HD1 LEU 103 3HD1 LEU 103 0.888 5.457 -17.327
852 3HD1 LEU 103 2HD1 LEU 103 -0.377 4.246 -17.115
853 1HD2 LEU 103 1HD2 LEU 103 3.312 3.428 -16.969
854 2HD2 LEU 103 3HD2 LEU 103 3.438 3.239 -18.719
855 3HD2 LEU 103 2HD2 LEU 103 3.112 4.827 -18.024
No H/Q in entry = 855
Start of MODEL 10
Raw file had 866 H/Q atoms
Start of MODEL 10
1 1H ALA 1 2H ALA 1 18.076 15.518 -23.602
2 2H ALA 1 1H ALA 1 17.504 14.001 -24.114
3 3H ALA 1 3H ALA 1 16.656 14.871 -22.929
4 HA ALA 1 HA ALA 1 17.900 13.083 -21.909
5 1HB ALA 1 2HB ALA 1 20.238 14.477 -23.245
6 2HB ALA 1 1HB ALA 1 20.414 13.250 -21.991
7 3HB ALA 1 3HB ALA 1 19.676 12.832 -23.537
8 H THR 2 H THR 2 17.233 13.924 -19.970
9 HA THR 2 HA THR 2 18.862 16.135 -18.811
10 HB THR 2 HB THR 2 16.783 17.125 -17.831
11 HG1 THR 2 HG1 THR 2 15.440 15.452 -19.683
12 1HG2 THR 2 2HG2 THR 2 17.843 17.913 -19.999
13 2HG2 THR 2 1HG2 THR 2 16.613 16.974 -20.847
14 3HG2 THR 2 3HG2 THR 2 16.137 18.316 -19.806
15 H SER 3 H SER 3 18.861 16.131 -16.453
16 HA SER 3 HA SER 3 18.725 13.432 -15.347
17 1HB SER 3 2HB SER 3 19.458 14.613 -13.218
18 2HB SER 3 1HB SER 3 20.545 14.803 -14.589
19 HG SER 3 HG SER 3 18.906 16.649 -13.314
20 H THR 4 H THR 4 16.488 12.917 -15.432
21 HA THR 4 HA THR 4 14.935 13.874 -13.146
22 HB THR 4 HB THR 4 14.453 15.622 -14.845
23 HG1 THR 4 HG1 THR 4 12.716 15.386 -13.642
24 1HG2 THR 4 1HG2 THR 4 14.806 13.994 -16.794
25 2HG2 THR 4 3HG2 THR 4 13.160 13.442 -16.488
26 3HG2 THR 4 2HG2 THR 4 13.456 15.119 -16.944
27 H LYS 5 H LYS 5 13.259 12.412 -12.607
28 HA LYS 5 HA LYS 5 13.475 9.775 -13.900
29 1HB LYS 5 2HB LYS 5 12.258 10.841 -11.385
30 2HB LYS 5 1HB LYS 5 11.637 9.324 -12.034
31 1HG LYS 5 2HG LYS 5 14.514 9.298 -12.148
32 2HG LYS 5 1HG LYS 5 13.998 9.706 -10.512
33 1HD LYS 5 2HD LYS 5 12.511 7.499 -11.832
34 2HD LYS 5 1HD LYS 5 14.187 7.156 -11.404
35 1HE LYS 5 2HE LYS 5 13.798 7.356 -9.136
36 2HE LYS 5 1HE LYS 5 12.485 8.510 -9.356
37 1HZ LYS 5 3HZ LYS 5 11.333 6.466 -10.464
38 2HZ LYS 5 2HZ LYS 5 12.434 5.580 -9.521
39 3HZ LYS 5 1HZ LYS 5 11.335 6.639 -8.777
40 H LYS 6 H LYS 6 10.934 8.723 -13.691
41 HA LYS 6 HA LYS 6 8.843 10.369 -14.787
42 1HB LYS 6 2HB LYS 6 8.856 9.596 -17.111
43 2HB LYS 6 1HB LYS 6 10.379 10.401 -16.747
44 1HG LYS 6 2HG LYS 6 9.981 7.392 -16.652
45 2HG LYS 6 1HG LYS 6 10.660 8.257 -18.028
46 1HD LYS 6 2HD LYS 6 12.217 9.255 -16.043
47 2HD LYS 6 1HD LYS 6 11.877 7.654 -15.385
48 1HE LYS 6 2HE LYS 6 13.561 6.924 -16.711
49 2HE LYS 6 1HE LYS 6 12.433 7.126 -18.051
50 1HZ LYS 6 2HZ LYS 6 13.214 9.415 -18.294
51 2HZ LYS 6 1HZ LYS 6 14.339 9.170 -17.042
52 3HZ LYS 6 3HZ LYS 6 14.480 8.298 -18.490
53 H LEU 7 H LEU 7 10.251 7.134 -14.530
54 HA LEU 7 HA LEU 7 7.988 5.958 -13.277
55 1HB LEU 7 2HB LEU 7 7.554 6.274 -16.019
56 2HB LEU 7 1HB LEU 7 8.117 4.612 -15.888
57 HG LEU 7 HG LEU 7 5.657 4.742 -15.694
58 1HD1 LEU 7 2HD1 LEU 7 6.961 3.010 -14.441
59 2HD1 LEU 7 1HD1 LEU 7 6.916 4.061 -13.025
60 3HD1 LEU 7 3HD1 LEU 7 5.417 3.409 -13.689
61 1HD2 LEU 7 3HD2 LEU 7 6.237 6.424 -13.234
62 2HD2 LEU 7 2HD2 LEU 7 5.478 6.994 -14.722
63 3HD2 LEU 7 1HD2 LEU 7 4.649 5.818 -13.703
64 H HIS 8 H HIS 8 10.601 5.929 -12.624
65 HA HIS 8 HA HIS 8 11.878 3.478 -13.657
66 1HB HIS 8 2HB HIS 8 13.025 5.784 -13.076
67 2HB HIS 8 1HB HIS 8 13.037 5.128 -11.440
68 HD1 HIS 8 HD1 HIS 8 14.707 3.287 -10.919
69 HD2 HIS 8 HD2 HIS 8 14.532 4.178 -14.988
70 HE1 HIS 8 HE1 HIS 8 16.615 2.028 -12.011
71 H LYS 9 H LYS 9 12.679 1.835 -12.163
72 HA LYS 9 HA LYS 9 10.834 1.459 -9.858
73 1HB LYS 9 2HB LYS 9 12.311 -0.920 -10.667
74 2HB LYS 9 1HB LYS 9 10.577 -0.692 -10.479
75 1HG LYS 9 2HG LYS 9 10.540 -0.973 -12.738
76 2HG LYS 9 1HG LYS 9 11.025 0.719 -12.776
77 1HD LYS 9 2HD LYS 9 12.995 0.170 -13.708
78 2HD LYS 9 1HD LYS 9 13.358 -0.909 -12.363
79 1HE LYS 9 2HE LYS 9 11.770 -2.584 -13.533
80 2HE LYS 9 1HE LYS 9 11.945 -1.550 -14.950
81 1HZ LYS 9 3HZ LYS 9 14.377 -1.802 -14.721
82 2HZ LYS 9 2HZ LYS 9 14.124 -2.915 -13.463
83 3HZ LYS 9 1HZ LYS 9 13.586 -3.269 -15.034
84 H GLU 10 H GLU 10 11.751 0.218 -7.998
85 HA GLU 10 HA GLU 10 14.638 0.138 -7.622
86 1HB GLU 10 2HB GLU 10 14.437 1.685 -5.543
87 2HB GLU 10 1HB GLU 10 14.530 2.453 -7.125
88 1HG GLU 10 2HG GLU 10 11.775 1.843 -6.508
89 2HG GLU 10 1HG GLU 10 12.489 2.760 -5.183
90 HA PRO 11 HA PRO 11 13.114 -3.286 -5.298
91 1HB PRO 11 2HB PRO 11 15.511 -3.094 -3.636
92 2HB PRO 11 1HB PRO 11 15.004 -4.381 -4.740
93 1HG PRO 11 2HG PRO 11 17.053 -2.507 -5.224
94 2HG PRO 11 1HG PRO 11 16.318 -3.583 -6.419
95 1HD PRO 11 2HD PRO 11 16.038 -0.695 -6.181
96 2HD PRO 11 1HD PRO 11 15.424 -1.764 -7.460
97 H ALA 12 H ALA 12 12.067 -3.638 -3.386
98 HA ALA 12 HA ALA 12 12.178 -1.541 -1.262
99 1HB ALA 12 3HB ALA 12 10.190 -1.427 -2.896
100 2HB ALA 12 2HB ALA 12 9.635 -2.898 -2.101
101 3HB ALA 12 1HB ALA 12 9.837 -1.419 -1.170
102 H THR 13 H THR 13 10.019 -3.007 0.218
103 HA THR 13 HA THR 13 11.076 -5.701 0.680
104 HB THR 13 HB THR 13 12.665 -4.443 2.011
105 HG1 THR 13 HG1 THR 13 10.664 -5.300 3.819
106 1HG2 THR 13 3HG2 THR 13 10.579 -2.593 2.237
107 2HG2 THR 13 2HG2 THR 13 10.822 -3.187 3.878
108 3HG2 THR 13 1HG2 THR 13 12.168 -2.478 2.989
109 H LEU 14 H LEU 14 9.265 -6.918 1.048
110 HA LEU 14 HA LEU 14 6.705 -5.683 1.562
111 1HB LEU 14 2HB LEU 14 5.799 -7.909 1.633
112 2HB LEU 14 1HB LEU 14 7.052 -7.918 0.397
113 HG LEU 14 HG LEU 14 8.503 -8.596 2.617
114 1HD1 LEU 14 1HD1 LEU 14 6.091 -8.690 3.720
115 2HD1 LEU 14 3HD1 LEU 14 6.029 -10.264 2.928
116 3HD1 LEU 14 2HD1 LEU 14 7.298 -9.917 4.102
117 1HD2 LEU 14 1HD2 LEU 14 7.100 -10.173 0.487
118 2HD2 LEU 14 3HD2 LEU 14 8.826 -9.903 0.720
119 3HD2 LEU 14 2HD2 LEU 14 7.963 -11.034 1.761
120 H ILE 15 H ILE 15 6.089 -4.868 3.488
121 HA ILE 15 HA ILE 15 7.354 -6.057 5.918
122 HB ILE 15 HB ILE 15 6.114 -3.304 5.674
123 1HG1 ILE 15 2HG1 ILE 15 8.992 -3.312 5.935
124 2HG1 ILE 15 1HG1 ILE 15 8.532 -4.264 4.525
125 1HG2 ILE 15 1HG2 ILE 15 7.665 -4.787 7.781
126 2HG2 ILE 15 3HG2 ILE 15 7.775 -3.030 7.688
127 3HG2 ILE 15 2HG2 ILE 15 6.214 -3.802 7.957
128 1HD1 ILE 15 1HD1 ILE 15 7.503 -1.473 5.100
129 2HD1 ILE 15 3HD1 ILE 15 8.843 -1.832 4.013
130 3HD1 ILE 15 2HD1 ILE 15 7.223 -2.420 3.639
131 H LYS 16 H LYS 16 4.211 -5.050 4.606
132 HA LYS 16 HA LYS 16 2.683 -6.926 6.087
133 1HB LYS 16 2HB LYS 16 3.590 -5.079 7.844
134 2HB LYS 16 1HB LYS 16 2.132 -4.260 7.295
135 1HG LYS 16 2HG LYS 16 1.156 -5.522 8.940
136 2HG LYS 16 1HG LYS 16 1.128 -6.743 7.667
137 1HD LYS 16 2HD LYS 16 3.508 -7.362 8.530
138 2HD LYS 16 1HD LYS 16 3.037 -6.479 9.982
139 1HE LYS 16 2HE LYS 16 1.266 -8.623 8.807
140 2HE LYS 16 1HE LYS 16 2.564 -9.019 9.933
141 1HZ LYS 16 3HZ LYS 16 1.585 -7.434 11.511
142 2HZ LYS 16 2HZ LYS 16 0.300 -7.161 10.434
143 3HZ LYS 16 1HZ LYS 16 0.519 -8.696 11.128
144 H ALA 17 H ALA 17 1.557 -6.971 4.024
145 HA ALA 17 HA ALA 17 0.407 -4.614 2.815
146 1HB ALA 17 3HB ALA 17 0.762 -6.904 1.709
147 2HB ALA 17 2HB ALA 17 -0.694 -7.429 2.553
148 3HB ALA 17 1HB ALA 17 -0.781 -6.118 1.376
149 H ILE 18 H ILE 18 -1.678 -3.787 2.947
150 HA ILE 18 HA ILE 18 -3.081 -4.395 5.486
151 HB ILE 18 HB ILE 18 -3.055 -2.081 3.561
152 1HG1 ILE 18 2HG1 ILE 18 -2.866 -1.262 6.245
153 2HG1 ILE 18 1HG1 ILE 18 -1.905 -2.739 6.144
154 1HG2 ILE 18 3HG2 ILE 18 -5.157 -2.827 5.572
155 2HG2 ILE 18 2HG2 ILE 18 -4.726 -1.126 5.402
156 3HG2 ILE 18 1HG2 ILE 18 -5.340 -2.021 4.014
157 1HD1 ILE 18 3HD1 ILE 18 -1.644 -0.490 4.137
158 2HD1 ILE 18 2HD1 ILE 18 -0.666 -0.573 5.603
159 3HD1 ILE 18 1HD1 ILE 18 -0.547 -1.849 4.390
160 H ASP 19 H ASP 19 -4.449 -3.270 2.364
161 HA ASP 19 HA ASP 19 -5.992 -5.711 1.978
162 1HB ASP 19 2HB ASP 19 -7.306 -4.753 3.794
163 2HB ASP 19 1HB ASP 19 -7.379 -3.199 2.964
164 H GLY 20 H GLY 20 -6.890 -5.774 -0.082
165 1HA GLY 20 2HA GLY 20 -7.304 -5.152 -2.302
166 2HA GLY 20 1HA GLY 20 -7.283 -3.469 -1.767
167 H ASP 21 H ASP 21 -5.526 -2.269 -2.257
168 HA ASP 21 HA ASP 21 -3.011 -3.682 -3.046
169 1HB ASP 21 2HB ASP 21 -4.686 -2.216 -4.772
170 2HB ASP 21 1HB ASP 21 -3.307 -1.168 -4.451
171 H THR 22 H THR 22 -4.205 -1.885 -0.679
172 HA THR 22 HA THR 22 -2.314 0.333 -0.639
173 HB THR 22 HB THR 22 -3.656 -0.630 1.856
174 HG1 THR 22 HG1 THR 22 -5.519 -0.564 0.923
175 1HG2 THR 22 2HG2 THR 22 -2.180 1.413 1.702
176 2HG2 THR 22 1HG2 THR 22 -3.403 2.131 0.656
177 3HG2 THR 22 3HG2 THR 22 -3.800 1.720 2.324
178 H VAL 23 H VAL 23 -0.144 -0.088 -0.217
179 HA VAL 23 HA VAL 23 0.490 -2.145 1.851
180 HB VAL 23 HB VAL 23 2.475 -2.788 0.353
181 1HG1 VAL 23 3HG1 VAL 23 0.314 -4.099 0.751
182 2HG1 VAL 23 2HG1 VAL 23 -0.245 -3.448 -0.789
183 3HG1 VAL 23 1HG1 VAL 23 1.187 -4.476 -0.734
184 1HG2 VAL 23 3HG2 VAL 23 1.743 -0.682 -1.164
185 2HG2 VAL 23 2HG2 VAL 23 2.560 -2.090 -1.839
186 3HG2 VAL 23 1HG2 VAL 23 0.809 -1.943 -1.970
187 H LYS 24 H LYS 24 2.110 -1.606 3.238
188 HA LYS 24 HA LYS 24 3.209 1.107 3.149
189 1HB LYS 24 2HB LYS 24 3.923 0.711 5.366
190 2HB LYS 24 1HB LYS 24 2.425 -0.193 5.230
191 1HG LYS 24 2HG LYS 24 5.195 -1.410 4.941
192 2HG LYS 24 1HG LYS 24 4.223 -1.463 6.398
193 1HD LYS 24 2HD LYS 24 3.583 -3.460 5.504
194 2HD LYS 24 1HD LYS 24 2.410 -2.436 4.689
195 1HE LYS 24 2HE LYS 24 4.235 -2.206 2.842
196 2HE LYS 24 1HE LYS 24 4.959 -3.612 3.591
197 1HZ LYS 24 2HZ LYS 24 2.100 -3.674 2.950
198 2HZ LYS 24 1HZ LYS 24 3.216 -3.844 1.683
199 3HZ LYS 24 3HZ LYS 24 3.228 -4.943 2.971
200 H LEU 25 H LEU 25 4.071 -0.026 0.911
201 HA LEU 25 HA LEU 25 6.591 -1.425 1.163
202 1HB LEU 25 2HB LEU 25 4.907 -1.602 -0.733
203 2HB LEU 25 1HB LEU 25 5.445 -0.014 -1.263
204 HG LEU 25 HG LEU 25 6.515 -2.152 -2.316
205 1HD1 LEU 25 3HD1 LEU 25 7.215 0.384 -2.347
206 2HD1 LEU 25 2HD1 LEU 25 8.526 -0.169 -1.309
207 3HD1 LEU 25 1HD1 LEU 25 8.338 -0.844 -2.926
208 1HD2 LEU 25 1HD2 LEU 25 7.017 -2.960 0.131
209 2HD2 LEU 25 3HD2 LEU 25 8.227 -3.215 -1.125
210 3HD2 LEU 25 2HD2 LEU 25 8.403 -1.877 0.010
211 H MET 26 H MET 26 8.402 -0.397 1.862
212 HA MET 26 HA MET 26 8.741 2.496 1.532
213 1HB MET 26 2HB MET 26 10.907 2.161 2.670
214 2HB MET 26 1HB MET 26 9.606 1.374 3.559
215 1HG MET 26 2HG MET 26 10.246 -0.785 2.793
216 2HG MET 26 1HG MET 26 11.304 -0.116 1.552
217 1HE MET 26 1HE MET 26 10.579 -0.989 5.053
218 2HE MET 26 3HE MET 26 11.985 -0.549 6.033
219 3HE MET 26 2HE MET 26 10.852 0.692 5.504
220 H TYR 27 H TYR 27 9.952 3.494 -0.045
221 HA TYR 27 HA TYR 27 10.833 1.795 -2.269
222 1HB TYR 27 2HB TYR 27 11.545 4.426 -2.927
223 2HB TYR 27 1HB TYR 27 10.131 3.547 -3.495
224 HD1 TYR 27 HD2 TYR 27 7.966 3.700 -2.173
225 HD2 TYR 27 HD1 TYR 27 11.351 6.232 -1.404
226 HE1 TYR 27 HE2 TYR 27 6.507 5.279 -0.936
227 HE2 TYR 27 HE1 TYR 27 9.891 7.811 -0.168
228 HH TYR 27 HH TYR 27 6.961 8.175 -0.408
229 H LYS 28 H LYS 28 12.430 4.547 -0.672
230 HA LYS 28 HA LYS 28 14.755 3.045 0.030
231 1HB LYS 28 2HB LYS 28 14.803 3.259 -2.617
232 2HB LYS 28 1HB LYS 28 15.402 4.877 -2.259
233 1HG LYS 28 2HG LYS 28 17.410 3.735 -2.289
234 2HG LYS 28 1HG LYS 28 16.986 3.525 -0.588
235 1HD LYS 28 2HD LYS 28 15.925 1.345 -1.148
236 2HD LYS 28 1HD LYS 28 16.441 1.546 -2.823
237 1HE LYS 28 2HE LYS 28 18.665 1.965 -1.004
238 2HE LYS 28 1HE LYS 28 17.926 0.387 -0.737
239 1HZ LYS 28 3HZ LYS 28 18.093 -0.031 -3.128
240 2HZ LYS 28 2HZ LYS 28 18.866 1.467 -3.341
241 3HZ LYS 28 1HZ LYS 28 19.615 0.243 -2.432
242 H GLY 29 H GLY 29 13.224 4.770 1.393
243 1HA GLY 29 2HA GLY 29 14.991 6.486 2.684
244 2HA GLY 29 1HA GLY 29 14.336 7.474 1.383
245 H GLN 30 H GLN 30 11.723 5.722 1.799
246 HA GLN 30 HA GLN 30 10.822 6.715 4.408
247 1HB GLN 30 2HB GLN 30 10.690 8.677 2.768
248 2HB GLN 30 1HB GLN 30 9.405 7.777 1.961
249 1HG GLN 30 2HG GLN 30 8.066 7.755 3.979
250 2HG GLN 30 1HG GLN 30 9.384 8.463 4.913
251 1HE2 GLN 30 2HE2 GLN 30 7.269 10.876 2.335
252 2HE2 GLN 30 1HE2 GLN 30 7.267 9.198 2.084
253 HA PRO 31 HA PRO 31 8.622 2.885 3.420
254 1HB PRO 31 2HB PRO 31 7.941 2.695 6.193
255 2HB PRO 31 1HB PRO 31 9.173 1.766 5.329
256 1HG PRO 31 2HG PRO 31 9.579 3.872 7.269
257 2HG PRO 31 1HG PRO 31 10.806 2.909 6.434
258 1HD PRO 31 2HD PRO 31 10.108 5.672 5.972
259 2HD PRO 31 1HD PRO 31 11.350 4.707 5.149
260 H MET 32 H MET 32 6.690 3.517 2.447
261 HA MET 32 HA MET 32 4.645 4.776 4.247
262 1HB MET 32 2HB MET 32 5.415 5.599 1.443
263 2HB MET 32 1HB MET 32 3.896 6.088 2.196
264 1HG MET 32 2HG MET 32 6.460 6.517 3.693
265 2HG MET 32 1HG MET 32 6.032 7.630 2.394
266 1HE MET 32 3HE MET 32 3.501 8.449 2.144
267 2HE MET 32 2HE MET 32 3.048 9.532 3.460
268 3HE MET 32 1HE MET 32 4.652 9.650 2.742
269 H THR 33 H THR 33 2.411 4.463 3.516
270 HA THR 33 HA THR 33 2.084 1.869 2.110
271 HB THR 33 HB THR 33 1.101 2.124 4.404
272 HG1 THR 33 HG1 THR 33 0.097 0.615 3.244
273 1HG2 THR 33 3HG2 THR 33 0.467 4.576 3.971
274 2HG2 THR 33 2HG2 THR 33 -0.927 3.942 3.097
275 3HG2 THR 33 1HG2 THR 33 -0.724 3.587 4.812
276 H PHE 34 H PHE 34 1.184 1.797 0.073
277 HA PHE 34 HA PHE 34 -0.603 3.978 -0.769
278 1HB PHE 34 2HB PHE 34 0.842 4.315 -2.879
279 2HB PHE 34 1HB PHE 34 1.316 5.125 -1.392
280 HD1 PHE 34 HD1 PHE 34 3.091 4.023 0.074
281 HD2 PHE 34 HD2 PHE 34 2.306 2.809 -3.967
282 HE1 PHE 34 HE1 PHE 34 5.323 2.980 -0.043
283 HE2 PHE 34 HE2 PHE 34 4.545 1.767 -4.077
284 HZ PHE 34 HZ PHE 34 6.055 1.843 -2.120
285 H ARG 35 H ARG 35 -0.988 3.653 -3.311
286 HA ARG 35 HA ARG 35 -1.235 0.740 -3.886
287 1HB ARG 35 2HB ARG 35 -3.480 2.738 -4.237
288 2HB ARG 35 1HB ARG 35 -3.553 1.009 -4.567
289 1HG ARG 35 2HG ARG 35 -4.178 0.664 -2.438
290 2HG ARG 35 1HG ARG 35 -2.615 1.280 -1.912
291 1HD ARG 35 2HD ARG 35 -3.501 3.242 -1.223
292 2HD ARG 35 1HD ARG 35 -4.460 3.414 -2.690
293 HE ARG 35 HE ARG 35 -5.746 1.415 -1.247
294 1HH1 ARG 35 2HH1 ARG 35 -6.401 4.494 -1.777
295 2HH1 ARG 35 1HH1 ARG 35 -6.944 4.920 -0.190
296 1HH2 ARG 35 1HH2 ARG 35 -5.756 2.015 1.289
297 2HH2 ARG 35 2HH2 ARG 35 -6.579 3.517 1.548
298 H LEU 36 H LEU 36 -1.966 0.396 -6.215
299 HA LEU 36 HA LEU 36 -0.187 1.708 -8.038
300 1HB LEU 36 2HB LEU 36 -2.769 0.338 -8.856
301 2HB LEU 36 1HB LEU 36 -1.268 0.445 -9.763
302 HG LEU 36 HG LEU 36 -1.654 -1.102 -7.183
303 1HD1 LEU 36 1HD1 LEU 36 -1.399 -1.967 -10.074
304 2HD1 LEU 36 3HD1 LEU 36 -1.264 -3.070 -8.704
305 3HD1 LEU 36 2HD1 LEU 36 -2.779 -2.219 -9.006
306 1HD2 LEU 36 2HD2 LEU 36 0.722 -0.729 -9.027
307 2HD2 LEU 36 1HD2 LEU 36 0.624 -0.330 -7.312
308 3HD2 LEU 36 3HD2 LEU 36 0.625 -2.017 -7.827
309 H LEU 37 H LEU 37 -3.744 1.779 -8.225
310 HA LEU 37 HA LEU 37 -3.622 4.723 -8.744
311 1HB LEU 37 2HB LEU 37 -4.261 3.145 -10.737
312 2HB LEU 37 1HB LEU 37 -5.777 2.918 -9.866
313 HG LEU 37 HG LEU 37 -5.354 5.685 -9.811
314 1HD1 LEU 37 3HD1 LEU 37 -3.597 5.332 -11.557
315 2HD1 LEU 37 2HD1 LEU 37 -4.822 4.605 -12.596
316 3HD1 LEU 37 1HD1 LEU 37 -4.952 6.303 -12.135
317 1HD2 LEU 37 3HD2 LEU 37 -7.045 3.989 -11.679
318 2HD2 LEU 37 2HD2 LEU 37 -7.515 4.546 -10.074
319 3HD2 LEU 37 1HD2 LEU 37 -7.286 5.710 -11.379
320 H LEU 38 H LEU 38 -3.712 4.184 -6.254
321 HA LEU 38 HA LEU 38 -4.866 3.956 -4.253
322 1HB LEU 38 2HB LEU 38 -7.096 5.358 -4.284
323 2HB LEU 38 1HB LEU 38 -5.530 6.149 -4.326
324 HG LEU 38 HG LEU 38 -5.916 5.879 -6.976
325 1HD1 LEU 38 2HD1 LEU 38 -8.134 4.741 -6.563
326 2HD1 LEU 38 1HD1 LEU 38 -8.712 6.253 -5.865
327 3HD1 LEU 38 3HD1 LEU 38 -8.245 6.189 -7.564
328 1HD2 LEU 38 3HD2 LEU 38 -5.663 7.949 -5.381
329 2HD2 LEU 38 2HD2 LEU 38 -6.357 8.174 -6.986
330 3HD2 LEU 38 1HD2 LEU 38 -7.410 8.076 -5.575
331 H VAL 39 H VAL 39 -5.106 1.766 -5.739
332 HA VAL 39 HA VAL 39 -7.450 0.635 -6.579
333 HB VAL 39 HB VAL 39 -5.393 -0.591 -4.718
334 1HG1 VAL 39 3HG1 VAL 39 -7.691 -1.763 -6.290
335 2HG1 VAL 39 2HG1 VAL 39 -6.232 -2.716 -6.017
336 3HG1 VAL 39 1HG1 VAL 39 -7.172 -2.130 -4.645
337 1HG2 VAL 39 2HG2 VAL 39 -5.630 -0.184 -7.695
338 2HG2 VAL 39 1HG2 VAL 39 -4.229 0.041 -6.649
339 3HG2 VAL 39 3HG2 VAL 39 -4.756 -1.586 -7.081
340 H ASP 40 H ASP 40 -6.745 1.316 -3.144
341 HA ASP 40 HA ASP 40 -9.350 0.059 -2.424
342 1HB ASP 40 2HB ASP 40 -6.899 -0.255 -1.254
343 2HB ASP 40 1HB ASP 40 -7.593 1.016 -0.249
344 H THR 41 H THR 41 -9.453 2.578 -3.719
345 HA THR 41 HA THR 41 -10.256 4.385 -1.483
346 HB THR 41 HB THR 41 -9.140 4.937 -4.234
347 HG1 THR 41 HG1 THR 41 -8.506 5.610 -1.567
348 1HG2 THR 41 2HG2 THR 41 -10.972 6.594 -2.583
349 2HG2 THR 41 1HG2 THR 41 -9.591 7.411 -3.317
350 3HG2 THR 41 3HG2 THR 41 -10.752 6.557 -4.333
351 HA PRO 42 HA PRO 42 -14.181 3.111 -3.510
352 1HB PRO 42 2HB PRO 42 -15.517 3.482 -1.029
353 2HB PRO 42 1HB PRO 42 -15.047 1.941 -1.760
354 1HG PRO 42 2HG PRO 42 -13.890 3.249 0.561
355 2HG PRO 42 1HG PRO 42 -13.511 1.654 -0.102
356 1HD PRO 42 2HD PRO 42 -11.923 4.055 -0.266
357 2HD PRO 42 1HD PRO 42 -11.553 2.453 -0.933
358 H GLU 43 H GLU 43 -15.415 4.704 -4.490
359 HA GLU 43 HA GLU 43 -16.152 7.130 -2.988
360 1HB GLU 43 2HB GLU 43 -15.259 8.660 -4.661
361 2HB GLU 43 1HB GLU 43 -13.949 7.642 -4.068
362 1HG GLU 43 2HG GLU 43 -13.676 6.597 -6.077
363 2HG GLU 43 1HG GLU 43 -15.407 6.561 -6.409
364 H THR 44 H THR 44 -17.230 8.593 -5.062
365 HA THR 44 HA THR 44 -19.499 6.872 -5.871
366 HB THR 44 HB THR 44 -19.191 9.867 -6.260
367 HG1 THR 44 HG1 THR 44 -20.333 8.400 -4.114
368 1HG2 THR 44 1HG2 THR 44 -21.601 8.029 -6.177
369 2HG2 THR 44 3HG2 THR 44 -21.668 9.784 -6.334
370 3HG2 THR 44 2HG2 THR 44 -20.943 8.812 -7.613
371 H LYS 45 H LYS 45 -18.268 5.688 -7.493
372 HA LYS 45 HA LYS 45 -18.384 6.959 -10.130
373 1HB LYS 45 2HB LYS 45 -16.053 7.421 -8.930
374 2HB LYS 45 1HB LYS 45 -15.712 5.778 -9.468
375 1HG LYS 45 2HG LYS 45 -15.283 6.561 -11.532
376 2HG LYS 45 1HG LYS 45 -16.947 7.133 -11.646
377 1HD LYS 45 2HD LYS 45 -15.722 9.107 -11.947
378 2HD LYS 45 1HD LYS 45 -16.086 9.152 -10.222
379 1HE LYS 45 2HE LYS 45 -13.794 9.594 -10.221
380 2HE LYS 45 1HE LYS 45 -13.815 7.845 -9.992
381 1HZ LYS 45 2HZ LYS 45 -13.538 9.213 -12.616
382 2HZ LYS 45 1HZ LYS 45 -12.251 8.555 -11.723
383 3HZ LYS 45 3HZ LYS 45 -13.461 7.538 -12.339
384 H HIS 46 H HIS 46 -16.880 4.159 -8.456
385 HA HIS 46 HA HIS 46 -17.971 2.393 -10.595
386 1HB HIS 46 2HB HIS 46 -15.783 2.010 -8.537
387 2HB HIS 46 1HB HIS 46 -16.404 0.688 -9.527
388 HD1 HIS 46 HD1 HIS 46 -14.706 4.068 -9.887
389 HD2 HIS 46 HD2 HIS 46 -15.395 0.621 -12.129
390 HE1 HIS 46 HE1 HIS 46 -13.366 4.321 -12.021
391 HA PRO 47 HA PRO 47 -21.173 1.369 -7.655
392 1HB PRO 47 2HB PRO 47 -21.998 -0.777 -9.383
393 2HB PRO 47 1HB PRO 47 -22.764 0.803 -9.171
394 1HG PRO 47 2HG PRO 47 -21.254 -0.131 -11.444
395 2HG PRO 47 1HG PRO 47 -22.030 1.444 -11.228
396 1HD PRO 47 2HD PRO 47 -19.211 0.842 -11.165
397 2HD PRO 47 1HD PRO 47 -19.994 2.419 -10.948
398 H LYS 48 H LYS 48 -20.476 0.253 -5.875
399 HA LYS 48 HA LYS 48 -19.877 -2.625 -6.122
400 1HB LYS 48 2HB LYS 48 -17.693 -1.277 -6.376
401 2HB LYS 48 1HB LYS 48 -17.898 -0.857 -4.675
402 1HG LYS 48 2HG LYS 48 -17.494 -3.006 -3.949
403 2HG LYS 48 1HG LYS 48 -18.158 -3.738 -5.410
404 1HD LYS 48 2HD LYS 48 -16.148 -2.894 -6.665
405 2HD LYS 48 1HD LYS 48 -15.468 -2.372 -5.123
406 1HE LYS 48 2HE LYS 48 -14.524 -4.487 -5.310
407 2HE LYS 48 1HE LYS 48 -15.989 -4.863 -4.405
408 1HZ LYS 48 1HZ LYS 48 -15.825 -4.974 -7.365
409 2HZ LYS 48 3HZ LYS 48 -15.560 -6.318 -6.366
410 3HZ LYS 48 2HZ LYS 48 -17.078 -5.555 -6.375
411 H LYS 49 H LYS 49 -20.786 -3.673 -4.415
412 HA LYS 49 HA LYS 49 -21.984 -2.089 -2.243
413 1HB LYS 49 2HB LYS 49 -22.430 -4.681 -3.457
414 2HB LYS 49 1HB LYS 49 -22.317 -4.839 -1.705
415 1HG LYS 49 2HG LYS 49 -23.967 -2.613 -2.853
416 2HG LYS 49 1HG LYS 49 -24.631 -4.247 -2.837
417 1HD LYS 49 2HD LYS 49 -24.161 -4.387 -0.396
418 2HD LYS 49 1HD LYS 49 -23.590 -2.718 -0.433
419 1HE LYS 49 2HE LYS 49 -25.779 -1.931 -1.142
420 2HE LYS 49 1HE LYS 49 -26.367 -3.587 -1.284
421 1HZ LYS 49 1HZ LYS 49 -26.002 -3.881 1.089
422 2HZ LYS 49 3HZ LYS 49 -25.450 -2.283 1.222
423 3HZ LYS 49 2HZ LYS 49 -27.065 -2.588 0.796
424 H GLY 50 H GLY 50 -21.554 -2.500 0.019
425 1HA GLY 50 2HA GLY 50 -18.722 -3.057 0.560
426 2HA GLY 50 1HA GLY 50 -19.911 -2.496 1.734
427 H VAL 51 H VAL 51 -18.910 -5.379 -0.103
428 HA VAL 51 HA VAL 51 -19.818 -7.050 2.197
429 HB VAL 51 HB VAL 51 -19.980 -8.347 -0.450
430 1HG1 VAL 51 2HG1 VAL 51 -21.470 -8.266 2.141
431 2HG1 VAL 51 1HG1 VAL 51 -22.328 -8.827 0.707
432 3HG1 VAL 51 3HG1 VAL 51 -20.865 -9.656 1.238
433 1HG2 VAL 51 1HG2 VAL 51 -21.861 -6.089 0.302
434 2HG2 VAL 51 3HG2 VAL 51 -20.875 -6.209 -1.155
435 3HG2 VAL 51 2HG2 VAL 51 -22.235 -7.307 -0.917
436 H GLU 52 H GLU 52 -18.900 -9.505 0.927
437 HA GLU 52 HA GLU 52 -16.026 -9.204 1.450
438 1HB GLU 52 2HB GLU 52 -17.424 -11.163 2.260
439 2HB GLU 52 1HB GLU 52 -17.510 -11.703 0.584
440 1HG GLU 52 2HG GLU 52 -14.822 -11.265 0.853
441 2HG GLU 52 1HG GLU 52 -15.243 -11.798 2.480
442 H LYS 53 H LYS 53 -15.519 -7.849 -0.414
443 HA LYS 53 HA LYS 53 -14.817 -9.439 -2.783
444 1HB LYS 53 2HB LYS 53 -17.266 -8.378 -2.934
445 2HB LYS 53 1HB LYS 53 -16.348 -6.945 -3.397
446 1HG LYS 53 2HG LYS 53 -16.635 -7.947 -5.473
447 2HG LYS 53 1HG LYS 53 -15.094 -8.652 -4.986
448 1HD LYS 53 2HD LYS 53 -16.257 -10.567 -5.597
449 2HD LYS 53 1HD LYS 53 -16.648 -10.489 -3.879
450 1HE LYS 53 2HE LYS 53 -18.728 -9.203 -4.484
451 2HE LYS 53 1HE LYS 53 -18.361 -9.515 -6.181
452 1HZ LYS 53 1HZ LYS 53 -18.774 -11.589 -4.094
453 2HZ LYS 53 3HZ LYS 53 -19.900 -11.151 -5.284
454 3HZ LYS 53 2HZ LYS 53 -18.434 -11.884 -5.733
455 H TYR 54 H TYR 54 -13.302 -8.023 -0.754
456 HA TYR 54 HA TYR 54 -12.310 -5.574 -2.083
457 1HB TYR 54 2HB TYR 54 -12.299 -6.624 0.607
458 2HB TYR 54 1HB TYR 54 -10.649 -6.254 0.111
459 HD1 TYR 54 HD2 TYR 54 -10.957 -3.974 -1.687
460 HD2 TYR 54 HD1 TYR 54 -13.025 -4.863 1.973
461 HE1 TYR 54 HE2 TYR 54 -11.397 -1.558 -1.347
462 HE2 TYR 54 HE1 TYR 54 -13.463 -2.447 2.311
463 HH TYR 54 HH TYR 54 -11.915 -0.108 1.076
464 H GLY 55 H GLY 55 -11.205 -8.863 -1.305
465 1HA GLY 55 2HA GLY 55 -8.809 -8.397 -3.041
466 2HA GLY 55 1HA GLY 55 -8.848 -9.559 -1.715
467 HA PRO 56 HA PRO 56 -11.291 -11.142 -5.646
468 1HB PRO 56 2HB PRO 56 -9.479 -10.662 -7.794
469 2HB PRO 56 1HB PRO 56 -11.061 -9.915 -7.547
470 1HG PRO 56 2HG PRO 56 -8.452 -8.691 -7.275
471 2HG PRO 56 1HG PRO 56 -10.040 -7.931 -7.100
472 1HD PRO 56 2HD PRO 56 -8.164 -8.633 -5.017
473 2HD PRO 56 1HD PRO 56 -9.736 -7.827 -4.850
474 H GLU 57 H GLU 57 -9.862 -12.562 -7.675
475 HA GLU 57 HA GLU 57 -7.942 -14.203 -6.066
476 1HB GLU 57 2HB GLU 57 -9.890 -15.558 -6.330
477 2HB GLU 57 1HB GLU 57 -10.096 -15.065 -8.012
478 1HG GLU 57 2HG GLU 57 -8.224 -16.323 -8.733
479 2HG GLU 57 1HG GLU 57 -7.613 -16.509 -7.086
480 H ALA 58 H ALA 58 -8.952 -13.964 -9.498
481 HA ALA 58 HA ALA 58 -6.270 -14.375 -10.486
482 1HB ALA 58 2HB ALA 58 -8.279 -14.942 -11.826
483 2HB ALA 58 1HB ALA 58 -8.706 -13.233 -11.896
484 3HB ALA 58 3HB ALA 58 -7.238 -13.807 -12.684
485 H SER 59 H SER 59 -8.304 -11.544 -9.846
486 HA SER 59 HA SER 59 -6.329 -9.667 -10.919
487 1HB SER 59 2HB SER 59 -8.980 -9.408 -9.521
488 2HB SER 59 1HB SER 59 -7.927 -8.005 -9.675
489 HG SER 59 HG SER 59 -8.252 -7.984 -11.777
490 H ALA 60 H ALA 60 -6.999 -11.189 -7.836
491 HA ALA 60 HA ALA 60 -5.642 -9.196 -6.198
492 1HB ALA 60 3HB ALA 60 -6.497 -12.054 -5.715
493 2HB ALA 60 2HB ALA 60 -5.641 -11.107 -4.498
494 3HB ALA 60 1HB ALA 60 -7.221 -10.580 -5.075
495 H PHE 61 H PHE 61 -4.538 -11.752 -8.252
496 HA PHE 61 HA PHE 61 -2.128 -12.488 -6.923
497 1HB PHE 61 2HB PHE 61 -1.562 -13.579 -8.892
498 2HB PHE 61 1HB PHE 61 -3.306 -13.447 -9.073
499 HD1 PHE 61 HD1 PHE 61 -3.797 -10.737 -9.962
500 HD2 PHE 61 HD2 PHE 61 -0.546 -13.360 -10.954
501 HE1 PHE 61 HE1 PHE 61 -3.461 -9.515 -12.093
502 HE2 PHE 61 HE2 PHE 61 -0.207 -12.136 -13.085
503 HZ PHE 61 HZ PHE 61 -1.665 -10.213 -13.654
504 H THR 62 H THR 62 -2.993 -9.590 -8.626
505 HA THR 62 HA THR 62 -0.248 -8.680 -9.066
506 HB THR 62 HB THR 62 -2.985 -7.724 -9.667
507 HG1 THR 62 HG1 THR 62 -0.442 -7.643 -10.897
508 1HG2 THR 62 1HG2 THR 62 -0.801 -5.840 -8.835
509 2HG2 THR 62 3HG2 THR 62 -1.904 -5.375 -10.130
510 3HG2 THR 62 2HG2 THR 62 -2.534 -5.744 -8.526
511 H LYS 63 H LYS 63 -2.889 -7.950 -6.777
512 HA LYS 63 HA LYS 63 -1.460 -5.900 -5.361
513 1HB LYS 63 2HB LYS 63 -3.276 -5.838 -3.918
514 2HB LYS 63 1HB LYS 63 -4.011 -6.515 -5.366
515 1HG LYS 63 2HG LYS 63 -3.388 -8.821 -4.304
516 2HG LYS 63 1HG LYS 63 -3.263 -7.906 -2.804
517 1HD LYS 63 2HD LYS 63 -5.646 -7.008 -3.944
518 2HD LYS 63 1HD LYS 63 -5.644 -8.740 -4.269
519 1HE LYS 63 2HE LYS 63 -4.838 -7.866 -1.533
520 2HE LYS 63 1HE LYS 63 -6.547 -7.741 -1.953
521 1HZ LYS 63 2HZ LYS 63 -4.895 -10.192 -2.246
522 2HZ LYS 63 1HZ LYS 63 -5.984 -9.896 -0.976
523 3HZ LYS 63 3HZ LYS 63 -6.559 -10.058 -2.563
524 H LYS 64 H LYS 64 -1.688 -9.418 -4.881
525 HA LYS 64 HA LYS 64 -0.106 -9.341 -2.428
526 1HB LYS 64 2HB LYS 64 -1.178 -11.551 -4.180
527 2HB LYS 64 1HB LYS 64 -0.046 -11.892 -2.874
528 1HG LYS 64 2HG LYS 64 -2.836 -10.770 -2.696
529 2HG LYS 64 1HG LYS 64 -2.157 -12.169 -1.867
530 1HD LYS 64 2HD LYS 64 -0.563 -10.475 -0.734
531 2HD LYS 64 1HD LYS 64 -1.695 -9.244 -1.297
532 1HE LYS 64 2HE LYS 64 -3.538 -10.614 -0.188
533 2HE LYS 64 1HE LYS 64 -2.256 -11.556 0.573
534 1HZ LYS 64 2HZ LYS 64 -2.582 -8.611 0.795
535 2HZ LYS 64 1HZ LYS 64 -3.014 -9.739 1.989
536 3HZ LYS 64 3HZ LYS 64 -1.386 -9.544 1.559
537 H MET 65 H MET 65 0.603 -9.218 -5.768
538 HA MET 65 HA MET 65 2.933 -10.725 -6.086
539 1HB MET 65 2HB MET 65 1.667 -9.099 -7.725
540 2HB MET 65 1HB MET 65 2.848 -7.920 -7.154
541 1HG MET 65 2HG MET 65 3.670 -9.063 -9.176
542 2HG MET 65 1HG MET 65 4.681 -9.450 -7.786
543 1HE MET 65 2HE MET 65 5.051 -11.436 -6.772
544 2HE MET 65 1HE MET 65 4.742 -13.021 -7.473
545 3HE MET 65 3HE MET 65 5.703 -11.830 -8.359
546 H LEU 66 H LEU 66 2.583 -7.565 -4.468
547 HA LEU 66 HA LEU 66 5.485 -7.517 -3.909
548 1HB LEU 66 2HB LEU 66 5.227 -5.268 -3.282
549 2HB LEU 66 1HB LEU 66 4.049 -5.457 -4.576
550 HG LEU 66 HG LEU 66 2.651 -6.190 -2.256
551 1HD1 LEU 66 1HD1 LEU 66 4.738 -5.005 -1.157
552 2HD1 LEU 66 3HD1 LEU 66 3.924 -3.529 -1.675
553 3HD1 LEU 66 2HD1 LEU 66 3.116 -4.640 -0.571
554 1HD2 LEU 66 2HD2 LEU 66 2.061 -4.739 -4.352
555 2HD2 LEU 66 1HD2 LEU 66 1.262 -4.376 -2.823
556 3HD2 LEU 66 3HD2 LEU 66 2.616 -3.387 -3.367
557 H GLU 67 H GLU 67 2.701 -8.777 -2.413
558 HA GLU 67 HA GLU 67 3.629 -8.335 0.341
559 1HB GLU 67 2HB GLU 67 1.328 -8.455 0.365
560 2HB GLU 67 1HB GLU 67 1.265 -9.544 -1.015
561 1HG GLU 67 2HG GLU 67 0.632 -10.988 0.664
562 2HG GLU 67 1HG GLU 67 2.373 -11.239 0.702
563 H ASN 68 H ASN 68 3.587 -10.889 -2.078
564 HA ASN 68 HA ASN 68 4.933 -12.784 -0.245
565 1HB ASN 68 2HB ASN 68 4.342 -14.477 -1.766
566 2HB ASN 68 1HB ASN 68 2.985 -13.358 -1.849
567 1HD2 ASN 68 2HD2 ASN 68 3.936 -12.161 -5.159
568 2HD2 ASN 68 1HD2 ASN 68 3.267 -11.586 -3.706
569 H ALA 69 H ALA 69 5.677 -10.922 -3.182
570 HA ALA 69 HA ALA 69 8.157 -12.260 -3.798
571 1HB ALA 69 3HB ALA 69 7.027 -9.560 -4.495
572 2HB ALA 69 2HB ALA 69 8.627 -10.059 -5.038
573 3HB ALA 69 1HB ALA 69 7.199 -10.970 -5.533
574 H LYS 70 H LYS 70 10.320 -11.379 -3.551
575 HA LYS 70 HA LYS 70 10.646 -9.986 -0.928
576 1HB LYS 70 2HB LYS 70 13.111 -10.788 -1.265
577 2HB LYS 70 1HB LYS 70 11.894 -11.963 -0.777
578 1HG LYS 70 2HG LYS 70 12.218 -11.613 -3.706
579 2HG LYS 70 1HG LYS 70 13.589 -12.338 -2.871
580 1HD LYS 70 2HD LYS 70 10.778 -13.313 -2.373
581 2HD LYS 70 1HD LYS 70 11.724 -13.922 -3.731
582 1HE LYS 70 2HE LYS 70 13.240 -13.883 -1.223
583 2HE LYS 70 1HE LYS 70 11.810 -14.910 -1.141
584 1HZ LYS 70 1HZ LYS 70 12.533 -16.011 -3.172
585 2HZ LYS 70 3HZ LYS 70 13.915 -15.030 -3.234
586 3HZ LYS 70 2HZ LYS 70 13.717 -16.135 -1.960
587 H LYS 71 H LYS 71 11.765 -9.948 -4.301
588 HA LYS 71 HA LYS 71 13.149 -7.362 -3.902
589 1HB LYS 71 2HB LYS 71 12.570 -8.840 -6.498
590 2HB LYS 71 1HB LYS 71 13.730 -7.533 -6.265
591 1HG LYS 71 2HG LYS 71 13.886 -10.211 -4.847
592 2HG LYS 71 1HG LYS 71 14.785 -9.815 -6.311
593 1HD LYS 71 2HD LYS 71 15.930 -7.991 -5.169
594 2HD LYS 71 1HD LYS 71 14.962 -8.251 -3.718
595 1HE LYS 71 2HE LYS 71 16.771 -10.362 -4.923
596 2HE LYS 71 1HE LYS 71 17.267 -9.279 -3.624
597 1HZ LYS 71 3HZ LYS 71 15.137 -10.125 -2.480
598 2HZ LYS 71 2HZ LYS 71 15.234 -11.413 -3.585
599 3HZ LYS 71 1HZ LYS 71 16.505 -11.125 -2.497
600 H ILE 72 H ILE 72 12.141 -5.371 -4.375
601 HA ILE 72 HA ILE 72 9.492 -5.522 -5.732
602 HB ILE 72 HB ILE 72 10.177 -4.169 -3.145
603 1HG1 ILE 72 2HG1 ILE 72 7.635 -5.617 -3.477
604 2HG1 ILE 72 1HG1 ILE 72 9.068 -6.625 -3.669
605 1HG2 ILE 72 3HG2 ILE 72 7.992 -3.563 -5.107
606 2HG2 ILE 72 2HG2 ILE 72 7.702 -3.349 -3.380
607 3HG2 ILE 72 1HG2 ILE 72 8.988 -2.445 -4.177
608 1HD1 ILE 72 1HD1 ILE 72 9.816 -5.280 -1.477
609 2HD1 ILE 72 3HD1 ILE 72 8.069 -5.192 -1.262
610 3HD1 ILE 72 2HD1 ILE 72 8.863 -6.761 -1.389
611 H GLU 73 H GLU 73 10.177 -4.611 -7.580
612 HA GLU 73 HA GLU 73 11.809 -2.185 -7.619
613 1HB GLU 73 2HB GLU 73 10.481 -3.897 -9.722
614 2HB GLU 73 1HB GLU 73 11.198 -2.345 -10.139
615 1HG GLU 73 2HG GLU 73 13.197 -3.435 -8.634
616 2HG GLU 73 1HG GLU 73 12.514 -4.880 -9.383
617 H VAL 74 H VAL 74 10.365 -0.816 -6.332
618 HA VAL 74 HA VAL 74 7.650 -0.248 -7.031
619 HB VAL 74 HB VAL 74 8.780 2.192 -6.073
620 1HG1 VAL 74 3HG1 VAL 74 6.543 1.279 -5.587
621 2HG1 VAL 74 2HG1 VAL 74 7.284 0.034 -4.582
622 3HG1 VAL 74 1HG1 VAL 74 7.410 1.730 -4.120
623 1HG2 VAL 74 2HG2 VAL 74 9.832 -0.256 -4.639
624 2HG2 VAL 74 1HG2 VAL 74 10.769 1.069 -5.326
625 3HG2 VAL 74 3HG2 VAL 74 9.757 1.348 -3.913
626 H GLU 75 H GLU 75 7.425 0.037 -9.277
627 HA GLU 75 HA GLU 75 9.039 2.148 -10.574
628 1HB GLU 75 2HB GLU 75 8.276 -0.161 -11.620
629 2HB GLU 75 1HB GLU 75 6.790 0.726 -11.960
630 1HG GLU 75 2HG GLU 75 8.102 2.477 -13.109
631 2HG GLU 75 1HG GLU 75 9.578 1.575 -12.791
632 H PHE 76 H PHE 76 8.173 3.835 -9.228
633 HA PHE 76 HA PHE 76 5.432 4.675 -10.045
634 1HB PHE 76 2HB PHE 76 4.892 5.228 -7.886
635 2HB PHE 76 1HB PHE 76 5.945 3.845 -7.607
636 HD1 PHE 76 HD1 PHE 76 8.466 4.330 -7.180
637 HD2 PHE 76 HD2 PHE 76 5.374 7.297 -6.963
638 HE1 PHE 76 HE1 PHE 76 9.946 5.786 -5.832
639 HE2 PHE 76 HE2 PHE 76 6.845 8.754 -5.618
640 HZ PHE 76 HZ PHE 76 9.144 7.998 -5.043
641 H ASP 77 H ASP 77 8.481 5.427 -10.748
642 HA ASP 77 HA ASP 77 9.570 7.325 -11.500
643 1HB ASP 77 2HB ASP 77 8.282 8.776 -12.644
644 2HB ASP 77 1HB ASP 77 6.943 7.749 -12.165
645 H LYS 78 H LYS 78 10.365 9.481 -10.761
646 HA LYS 78 HA LYS 78 11.357 9.535 -8.205
647 1HB LYS 78 2HB LYS 78 11.008 11.488 -10.286
648 2HB LYS 78 1HB LYS 78 10.721 12.251 -8.722
649 1HG LYS 78 2HG LYS 78 13.082 10.427 -9.025
650 2HG LYS 78 1HG LYS 78 13.181 12.062 -9.678
651 1HD LYS 78 2HD LYS 78 12.890 13.056 -7.561
652 2HD LYS 78 1HD LYS 78 12.219 11.584 -6.862
653 1HE LYS 78 2HE LYS 78 14.412 11.624 -6.008
654 2HE LYS 78 1HE LYS 78 14.542 10.538 -7.390
655 1HZ LYS 78 2HZ LYS 78 15.142 13.445 -7.476
656 2HZ LYS 78 1HZ LYS 78 16.313 12.227 -7.307
657 3HZ LYS 78 3HZ LYS 78 15.388 12.319 -8.725
658 H GLY 79 H GLY 79 8.395 11.402 -9.025
659 1HA GLY 79 2HA GLY 79 7.441 10.921 -6.241
660 2HA GLY 79 1HA GLY 79 7.377 12.540 -6.944
661 H GLN 80 H GLN 80 5.318 10.296 -6.186
662 HA GLN 80 HA GLN 80 3.923 9.467 -8.510
663 1HB GLN 80 2HB GLN 80 2.291 10.313 -6.151
664 2HB GLN 80 1HB GLN 80 2.190 8.842 -7.107
665 1HG GLN 80 2HG GLN 80 3.137 7.898 -5.256
666 2HG GLN 80 1HG GLN 80 4.630 8.494 -5.971
667 1HE2 GLN 80 2HE2 GLN 80 5.124 10.087 -2.828
668 2HE2 GLN 80 1HE2 GLN 80 5.623 8.826 -3.846
669 H ARG 81 H ARG 81 3.553 12.312 -6.461
670 HA ARG 81 HA ARG 81 3.345 14.469 -7.910
671 1HB ARG 81 2HB ARG 81 2.119 13.455 -9.735
672 2HB ARG 81 1HB ARG 81 0.874 12.865 -8.637
673 1HG ARG 81 2HG ARG 81 0.983 15.629 -8.160
674 2HG ARG 81 1HG ARG 81 1.123 15.474 -9.911
675 1HD ARG 81 2HD ARG 81 -0.984 14.004 -8.315
676 2HD ARG 81 1HD ARG 81 -1.258 15.608 -8.995
677 HE ARG 81 HE ARG 81 -0.369 14.142 -11.162
678 1HH1 ARG 81 2HH1 ARG 81 -1.454 11.685 -9.968
679 2HH1 ARG 81 1HH1 ARG 81 -3.114 11.702 -10.459
680 1HH2 ARG 81 1HH2 ARG 81 -3.109 15.078 -11.285
681 2HH2 ARG 81 2HH2 ARG 81 -4.055 13.629 -11.206
682 H THR 82 H THR 82 0.598 12.694 -6.447
683 HA THR 82 HA THR 82 0.787 14.178 -3.964
684 HB THR 82 HB THR 82 -1.668 15.087 -4.275
685 HG1 THR 82 HG1 THR 82 -2.283 15.381 -6.280
686 1HG2 THR 82 2HG2 THR 82 0.749 16.259 -4.124
687 2HG2 THR 82 1HG2 THR 82 0.293 16.765 -5.751
688 3HG2 THR 82 3HG2 THR 82 -0.737 17.173 -4.379
689 H ASP 83 H ASP 83 -2.208 13.158 -5.544
690 HA ASP 83 HA ASP 83 -3.240 10.924 -5.314
691 1HB ASP 83 2HB ASP 83 -1.500 9.944 -3.887
692 2HB ASP 83 1HB ASP 83 -1.928 11.032 -2.573
693 H LYS 84 H LYS 84 -5.235 10.464 -3.751
694 HA LYS 84 HA LYS 84 -6.657 12.986 -3.429
695 1HB LYS 84 2HB LYS 84 -7.341 10.211 -3.595
696 2HB LYS 84 1HB LYS 84 -8.002 10.835 -2.086
697 1HG LYS 84 2HG LYS 84 -9.532 12.123 -3.153
698 2HG LYS 84 1HG LYS 84 -8.367 12.657 -4.365
699 1HD LYS 84 2HD LYS 84 -9.104 9.812 -4.589
700 2HD LYS 84 1HD LYS 84 -10.446 10.925 -4.855
701 1HE LYS 84 2HE LYS 84 -9.234 12.087 -6.589
702 2HE LYS 84 1HE LYS 84 -7.757 11.196 -6.225
703 1HZ LYS 84 3HZ LYS 84 -10.288 10.011 -7.234
704 2HZ LYS 84 2HZ LYS 84 -8.889 10.287 -8.155
705 3HZ LYS 84 1HZ LYS 84 -8.865 9.155 -6.889
706 H TYR 85 H TYR 85 -5.224 10.550 -1.277
707 HA TYR 85 HA TYR 85 -5.843 12.175 1.121
708 1HB TYR 85 2HB TYR 85 -4.136 9.671 0.982
709 2HB TYR 85 1HB TYR 85 -4.938 10.350 2.397
710 HD1 TYR 85 HD2 TYR 85 -7.425 10.250 2.601
711 HD2 TYR 85 HD1 TYR 85 -5.319 8.306 -0.599
712 HE1 TYR 85 HE2 TYR 85 -9.437 8.887 2.102
713 HE2 TYR 85 HE1 TYR 85 -7.325 6.951 -1.096
714 HH TYR 85 HH TYR 85 -10.194 7.577 -0.398
715 H GLY 86 H GLY 86 -3.311 11.624 -1.188
716 1HA GLY 86 2HA GLY 86 -1.414 13.027 -1.514
717 2HA GLY 86 1HA GLY 86 -1.612 13.645 0.127
718 H ARG 87 H ARG 87 -1.403 10.236 -0.986
719 HA ARG 87 HA ARG 87 0.888 9.905 0.888
720 1HB ARG 87 2HB ARG 87 0.275 7.479 0.831
721 2HB ARG 87 1HB ARG 87 -1.000 8.515 1.466
722 1HG ARG 87 2HG ARG 87 -2.391 7.689 -0.083
723 2HG ARG 87 1HG ARG 87 -1.382 8.420 -1.332
724 1HD ARG 87 2HD ARG 87 -0.056 6.455 -1.545
725 2HD ARG 87 1HD ARG 87 -0.741 5.749 -0.083
726 HE ARG 87 HE ARG 87 -1.768 5.293 -2.600
727 1HH1 ARG 87 1HH2 ARG 87 -2.949 5.192 0.450
728 2HH1 ARG 87 2HH2 ARG 87 -4.591 5.583 0.068
729 1HH2 ARG 87 2HH1 ARG 87 -3.891 6.504 -3.206
730 2HH2 ARG 87 1HH1 ARG 87 -5.126 6.320 -2.008
731 H VAL 88 H VAL 88 1.338 7.233 -0.575
732 HA VAL 88 HA VAL 88 3.141 8.399 -2.636
733 HB VAL 88 HB VAL 88 3.269 5.627 -1.472
734 1HG1 VAL 88 3HG1 VAL 88 4.644 6.790 -3.531
735 2HG1 VAL 88 2HG1 VAL 88 5.707 7.133 -2.167
736 3HG1 VAL 88 1HG1 VAL 88 5.261 5.469 -2.540
737 1HG2 VAL 88 3HG2 VAL 88 4.217 8.262 -0.346
738 2HG2 VAL 88 2HG2 VAL 88 3.377 6.948 0.479
739 3HG2 VAL 88 1HG2 VAL 88 5.074 6.766 0.029
740 H LEU 89 H LEU 89 0.714 8.196 -3.853
741 HA LEU 89 HA LEU 89 -0.168 5.717 -4.837
742 1HB LEU 89 2HB LEU 89 -0.116 8.473 -5.997
743 2HB LEU 89 1HB LEU 89 -0.538 7.129 -7.061
744 HG LEU 89 HG LEU 89 -1.883 7.895 -4.460
745 1HD1 LEU 89 3HD1 LEU 89 -2.648 7.925 -7.384
746 2HD1 LEU 89 2HD1 LEU 89 -3.878 7.900 -6.120
747 3HD1 LEU 89 1HD1 LEU 89 -2.737 9.242 -6.214
748 1HD2 LEU 89 1HD2 LEU 89 -2.096 5.421 -6.189
749 2HD2 LEU 89 3HD2 LEU 89 -1.896 5.522 -4.440
750 3HD2 LEU 89 2HD2 LEU 89 -3.440 5.948 -5.175
751 H ALA 90 H ALA 90 1.397 4.196 -5.267
752 HA ALA 90 HA ALA 90 3.138 4.711 -7.628
753 1HB ALA 90 3HB ALA 90 3.955 3.926 -4.852
754 2HB ALA 90 2HB ALA 90 4.896 3.347 -6.222
755 3HB ALA 90 1HB ALA 90 4.709 5.079 -5.945
756 H TYR 91 H TYR 91 4.093 2.665 -8.477
757 HA TYR 91 HA TYR 91 2.165 0.416 -8.153
758 1HB TYR 91 2HB TYR 91 3.927 1.275 -10.454
759 2HB TYR 91 1HB TYR 91 3.132 -0.301 -10.406
760 HD1 TYR 91 HD2 TYR 91 2.256 3.285 -9.689
761 HD2 TYR 91 HD1 TYR 91 1.048 -0.441 -11.450
762 HE1 TYR 91 HE2 TYR 91 0.118 4.314 -10.385
763 HE2 TYR 91 HE1 TYR 91 -1.096 0.590 -12.146
764 HH TYR 91 HH TYR 91 -1.679 3.518 -12.562
765 H ILE 92 H ILE 92 2.923 -1.637 -7.671
766 HA ILE 92 HA ILE 92 5.820 -1.806 -6.934
767 HB ILE 92 HB ILE 92 3.721 -3.492 -5.599
768 1HG1 ILE 92 2HG1 ILE 92 2.861 -1.152 -5.497
769 2HG1 ILE 92 1HG1 ILE 92 3.329 -1.761 -3.912
770 1HG2 ILE 92 1HG2 ILE 92 6.365 -2.274 -4.772
771 2HG2 ILE 92 3HG2 ILE 92 5.319 -3.188 -3.685
772 3HG2 ILE 92 2HG2 ILE 92 6.030 -3.975 -5.094
773 1HD1 ILE 92 2HD1 ILE 92 5.630 -0.560 -5.119
774 2HD1 ILE 92 1HD1 ILE 92 4.285 0.571 -5.246
775 3HD1 ILE 92 3HD1 ILE 92 4.767 -0.052 -3.668
776 H TYR 93 H TYR 93 6.853 -3.194 -8.289
777 HA TYR 93 HA TYR 93 5.366 -5.623 -9.224
778 1HB TYR 93 2HB TYR 93 7.854 -4.595 -10.578
779 2HB TYR 93 1HB TYR 93 6.584 -5.625 -11.228
780 HD1 TYR 93 HD2 TYR 93 4.191 -4.044 -10.250
781 HD2 TYR 93 HD1 TYR 93 7.841 -2.855 -12.149
782 HE1 TYR 93 HE2 TYR 93 3.068 -2.043 -11.152
783 HE2 TYR 93 HE1 TYR 93 6.723 -0.860 -13.059
784 HH TYR 93 HH TYR 93 4.643 0.584 -12.348
785 H ALA 94 H ALA 94 5.988 -6.604 -7.183
786 HA ALA 94 HA ALA 94 8.843 -7.006 -6.751
787 1HB ALA 94 2HB ALA 94 7.214 -6.528 -4.882
788 2HB ALA 94 1HB ALA 94 6.515 -8.115 -5.173
789 3HB ALA 94 3HB ALA 94 8.189 -7.977 -4.638
790 H ASP 95 H ASP 95 9.797 -8.605 -7.838
791 HA ASP 95 HA ASP 95 10.117 -10.597 -9.060
792 1HB ASP 95 2HB ASP 95 8.487 -11.397 -6.663
793 2HB ASP 95 1HB ASP 95 9.019 -12.593 -7.841
794 H GLY 96 H GLY 96 7.758 -8.926 -9.842
795 1HA GLY 96 2HA GLY 96 6.187 -11.072 -11.194
796 2HA GLY 96 1HA GLY 96 5.360 -9.731 -10.407
797 H LYS 97 H LYS 97 6.714 -7.571 -11.070
798 HA LYS 97 HA LYS 97 6.763 -5.988 -12.831
799 1HB LYS 97 2HB LYS 97 8.017 -8.365 -14.240
800 2HB LYS 97 1HB LYS 97 8.008 -6.720 -14.876
801 1HG LYS 97 2HG LYS 97 9.736 -6.120 -13.561
802 2HG LYS 97 1HG LYS 97 8.937 -6.758 -12.125
803 1HD LYS 97 2HD LYS 97 10.454 -8.423 -12.108
804 2HD LYS 97 1HD LYS 97 9.727 -9.022 -13.598
805 1HE LYS 97 2HE LYS 97 11.965 -8.717 -14.224
806 2HE LYS 97 1HE LYS 97 11.219 -7.212 -14.759
807 1HZ LYS 97 1HZ LYS 97 12.637 -7.614 -12.178
808 2HZ LYS 97 3HZ LYS 97 13.264 -6.810 -13.533
809 3HZ LYS 97 2HZ LYS 97 11.928 -6.163 -12.706
810 H MET 98 H MET 98 4.463 -7.925 -12.488
811 HA MET 98 HA MET 98 3.341 -8.242 -15.186
812 1HB MET 98 2HB MET 98 1.353 -9.139 -13.900
813 2HB MET 98 1HB MET 98 2.850 -10.018 -13.598
814 1HG MET 98 2HG MET 98 3.200 -8.666 -11.530
815 2HG MET 98 1HG MET 98 1.663 -7.856 -11.823
816 1HE MET 98 3HE MET 98 3.520 -11.098 -11.420
817 2HE MET 98 2HE MET 98 2.335 -12.304 -10.923
818 3HE MET 98 1HE MET 98 2.362 -11.741 -12.592
819 H VAL 99 H VAL 99 2.814 -6.402 -12.215
820 HA VAL 99 HA VAL 99 0.647 -4.786 -13.239
821 HB VAL 99 HB VAL 99 2.631 -4.248 -11.000
822 1HG1 VAL 99 1HG1 VAL 99 1.474 -2.243 -11.879
823 2HG1 VAL 99 3HG1 VAL 99 -0.073 -3.033 -11.579
824 3HG1 VAL 99 2HG1 VAL 99 0.989 -2.629 -10.229
825 1HG2 VAL 99 3HG2 VAL 99 -0.109 -5.535 -11.055
826 2HG2 VAL 99 2HG2 VAL 99 1.403 -6.259 -10.507
827 3HG2 VAL 99 1HG2 VAL 99 0.660 -4.960 -9.575
828 H ASN 100 H ASN 100 4.066 -4.894 -13.629
829 HA ASN 100 HA ASN 100 4.716 -2.193 -14.243
830 1HB ASN 100 2HB ASN 100 6.230 -4.315 -14.106
831 2HB ASN 100 1HB ASN 100 5.849 -4.505 -15.814
832 1HD2 ASN 100 2HD2 ASN 100 7.548 -1.369 -16.681
833 2HD2 ASN 100 1HD2 ASN 100 6.106 -2.183 -17.048
834 H GLU 101 H GLU 101 2.646 -1.534 -15.292
835 HA GLU 101 HA GLU 101 2.000 -2.504 -17.960
836 1HB GLU 101 2HB GLU 101 0.715 -0.968 -15.983
837 2HB GLU 101 1HB GLU 101 0.914 0.118 -17.357
838 1HG GLU 101 2HG GLU 101 -0.270 -1.334 -18.819
839 2HG GLU 101 1HG GLU 101 -0.160 -2.687 -17.689
840 H ALA 102 H ALA 102 4.136 -0.063 -16.679
841 HA ALA 102 HA ALA 102 4.263 1.782 -18.818
842 1HB ALA 102 2HB ALA 102 5.445 2.011 -16.613
843 2HB ALA 102 1HB ALA 102 6.611 0.808 -17.164
844 3HB ALA 102 3HB ALA 102 6.477 2.353 -18.002
845 H LEU 103 HN LEU 103 5.166 1.717 -20.835
846 HA LEU 103 HA LEU 103 5.781 -0.782 -22.060
847 1HB LEU 103 2HB LEU 103 6.219 0.429 -24.057
848 2HB LEU 103 1HB LEU 103 4.960 1.323 -23.221
849 HG LEU 103 HG LEU 103 6.488 2.954 -24.029
850 1HD1 LEU 103 3HD1 LEU 103 5.809 3.345 -21.696
851 2HD1 LEU 103 2HD1 LEU 103 7.231 2.469 -21.134
852 3HD1 LEU 103 1HD1 LEU 103 7.421 3.981 -22.013
853 1HD2 LEU 103 3HD2 LEU 103 8.357 0.962 -24.026
854 2HD2 LEU 103 2HD2 LEU 103 8.721 2.665 -24.293
855 3HD2 LEU 103 1HD2 LEU 103 8.922 1.963 -22.688
No H/Q in entry = 855
No H/Q in entry = 855