NMR Restraints Grid
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NMR Restraints Grid |
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Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
10949 |
1qn0   |
4435 | cing | 1-original | 4 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 H1 VAL 1 H1 VAL 1 8.717 9.367 17.528
2 H2 VAL 1 H2 VAL 1 8.717 7.711 17.528
3 H3 VAL 1 H3 VAL 1 9.946 8.539 18.266
4 HA VAL 1 HA VAL 1 11.085 8.782 16.477
5 HB VAL 1 HB VAL 1 10.626 6.484 16.235
6 1HG1 VAL 1 1HG1 VAL 1 7.895 7.395 15.387
7 2HG1 VAL 1 2HG1 VAL 1 8.519 5.840 14.787
8 3HG1 VAL 1 3HG1 VAL 1 8.367 6.123 16.538
9 1HG2 VAL 1 1HG2 VAL 1 11.518 7.802 14.209
10 2HG2 VAL 1 2HG2 VAL 1 10.927 6.147 13.930
11 3HG2 VAL 1 3HG2 VAL 1 9.908 7.541 13.498
12 H ASP 2 H ASP 2 7.883 9.923 16.562
13 HA ASP 2 HA ASP 2 6.808 11.471 15.492
14 1HB ASP 2 1HB ASP 2 9.628 12.163 15.103
15 2HB ASP 2 2HB ASP 2 8.672 12.713 13.741
16 H VAL 3 H VAL 3 5.385 10.875 13.851
17 HA VAL 3 HA VAL 3 6.005 9.083 11.849
18 HB VAL 3 HB VAL 3 3.764 10.048 12.850
19 1HG1 VAL 3 1HG1 VAL 3 4.099 11.669 10.303
20 2HG1 VAL 3 2HG1 VAL 3 2.592 11.508 11.237
21 3HG1 VAL 3 3HG1 VAL 3 4.007 12.309 11.962
22 1HG2 VAL 3 1HG2 VAL 3 3.967 8.060 11.418
23 2HG2 VAL 3 2HG2 VAL 3 2.543 9.034 10.980
24 3HG2 VAL 3 3HG2 VAL 3 4.010 9.101 9.974
25 HA PRO 4 HA PRO 4 8.810 11.247 9.232
26 1HB PRO 4 1HB PRO 4 7.399 9.455 7.227
27 2HB PRO 4 2HB PRO 4 9.147 9.749 7.503
28 1HG PRO 4 1HG PRO 4 8.163 7.464 8.623
29 2HG PRO 4 2HG PRO 4 9.385 8.557 9.351
30 1HD PRO 4 1HD PRO 4 6.412 8.250 9.939
31 2HD PRO 4 2HD PRO 4 7.762 8.558 11.073
32 H ALA 5 H ALA 5 8.639 12.648 7.207
33 HA ALA 5 HA ALA 5 6.072 13.987 7.256
34 1HB ALA 5 1HB ALA 5 7.862 15.496 7.364
35 2HB ALA 5 3HB ALA 5 8.837 14.578 6.191
36 3HB ALA 5 2HB ALA 5 7.436 15.526 5.636
37 H ASP 6 H ASP 6 4.825 14.418 5.315
38 HA ASP 6 HA ASP 6 4.424 12.194 3.785
39 1HB ASP 6 1HB ASP 6 2.801 13.465 2.679
40 2HB ASP 6 2HB ASP 6 2.997 14.382 4.160
41 H GLY 7 H GLY 7 4.264 13.256 1.057
42 1HA GLY 7 2HA GLY 7 6.736 14.342 0.192
43 2HA GLY 7 1HA GLY 7 5.489 13.610 -0.799
44 H ALA 8 H ALA 8 5.538 11.044 0.833
45 HA ALA 8 HA ALA 8 8.215 10.050 0.334
46 1HB ALA 8 1HB ALA 8 5.757 9.146 1.798
47 2HB ALA 8 2HB ALA 8 7.453 9.189 2.336
48 3HB ALA 8 3HB ALA 8 6.900 7.905 1.233
49 H LYS 9 H LYS 9 8.787 8.648 -1.317
50 HA LYS 9 HA LYS 9 6.622 7.995 -3.193
51 1HB LYS 9 1HB LYS 9 9.485 8.809 -3.760
52 2HB LYS 9 2HB LYS 9 8.414 8.118 -4.962
53 1HG LYS 9 1HG LYS 9 6.962 9.987 -4.947
54 2HG LYS 9 2HG LYS 9 7.465 10.497 -3.348
55 1HD LYS 9 1HD LYS 9 9.810 10.917 -4.411
56 2HD LYS 9 2HD LYS 9 9.003 10.768 -5.960
57 1HE LYS 9 2HE LYS 9 9.015 13.120 -5.430
58 2HE LYS 9 1HE LYS 9 7.366 12.575 -5.194
59 1HZ LYS 9 1HZ LYS 9 8.490 12.155 -2.796
60 2HZ LYS 9 2HZ LYS 9 9.233 13.528 -3.272
61 3HZ LYS 9 3HZ LYS 9 7.603 13.467 -3.196
62 H ILE 10 H ILE 10 6.517 5.887 -3.980
63 HA ILE 10 HA ILE 10 8.434 4.048 -2.725
64 HB ILE 10 HB ILE 10 5.555 3.532 -3.474
65 1HG1 ILE 10 1HG1 ILE 10 6.545 3.651 -0.646
66 2HG1 ILE 10 2HG1 ILE 10 6.179 5.148 -1.479
67 1HG2 ILE 10 1HG2 ILE 10 7.138 1.580 -3.566
68 2HG2 ILE 10 2HG2 ILE 10 7.422 1.816 -1.824
69 3HG2 ILE 10 3HG2 ILE 10 5.791 1.414 -2.414
70 1HD1 ILE 10 1HD1 ILE 10 3.948 3.794 -2.162
71 2HD1 ILE 10 2HD1 ILE 10 4.334 2.927 -0.656
72 3HD1 ILE 10 3HD1 ILE 10 4.075 4.688 -0.628
73 H ASP 11 H ASP 11 9.581 2.673 -4.030
74 HA ASP 11 HA ASP 11 8.640 2.086 -6.634
75 1HB ASP 11 1HB ASP 11 9.578 4.130 -7.359
76 2HB ASP 11 2HB ASP 11 10.880 4.065 -6.188
77 H PHE 12 H PHE 12 8.919 -0.091 -5.732
78 HA PHE 12 HA PHE 12 11.727 -0.822 -5.287
79 1HB PHE 12 1HB PHE 12 9.101 -2.126 -4.351
80 2HB PHE 12 2HB PHE 12 10.705 -2.655 -3.885
81 HD1 PHE 12 HD1 PHE 12 11.947 0.046 -3.378
82 HD2 PHE 12 HD2 PHE 12 8.182 -1.564 -2.267
83 HE1 PHE 12 HE1 PHE 12 11.877 1.582 -1.394
84 HE2 PHE 12 HE2 PHE 12 8.111 -0.028 -0.282
85 HZ PHE 12 HZ PHE 12 9.960 1.526 0.130
86 H ILE 13 H ILE 13 8.748 -1.382 -7.099
87 HA ILE 13 HA ILE 13 9.926 -3.769 -8.308
88 HB ILE 13 HB ILE 13 7.124 -2.647 -8.384
89 1HG1 ILE 13 1HG1 ILE 13 8.069 -5.219 -7.107
90 2HG1 ILE 13 2HG1 ILE 13 8.008 -3.705 -6.227
91 1HG2 ILE 13 1HG2 ILE 13 8.450 -4.829 -9.926
92 2HG2 ILE 13 2HG2 ILE 13 6.787 -5.098 -9.350
93 3HG2 ILE 13 3HG2 ILE 13 7.152 -3.708 -10.401
94 1HD1 ILE 13 1HD1 ILE 13 5.594 -4.755 -7.754
95 2HD1 ILE 13 2HD1 ILE 13 5.926 -5.223 -6.070
96 3HD1 ILE 13 3HD1 ILE 13 5.633 -3.516 -6.478
97 H ALA 14 H ALA 14 11.451 -3.030 -9.762
98 HA ALA 14 HA ALA 14 10.951 -0.733 -11.370
99 1HB ALA 14 1HB ALA 14 13.099 -2.791 -11.021
100 2HB ALA 14 2HB ALA 14 13.208 -1.014 -11.019
101 3HB ALA 14 3HB ALA 14 13.059 -1.895 -12.559
102 H GLY 15 H GLY 15 11.397 -1.091 -13.909
103 1HA GLY 15 2HA GLY 15 9.308 -1.819 -15.252
104 2HA GLY 15 1HA GLY 15 9.881 -3.427 -14.852
105 H GLY 16 H GLY 16 9.802 -3.135 -17.458
106 1HA GLY 16 2HA GLY 16 10.929 -2.839 -19.405
107 2HA GLY 16 1HA GLY 16 12.200 -3.658 -18.519
108 H GLU 17 H GLU 17 10.747 -0.329 -18.773
109 HA GLU 17 HA GLU 17 13.356 0.762 -18.232
110 1HB GLU 17 1HB GLU 17 12.887 0.337 -20.826
111 2HB GLU 17 2HB GLU 17 11.949 1.810 -20.687
112 1HG GLU 17 1HG GLU 17 14.274 2.324 -21.357
113 2HG GLU 17 2HG GLU 17 13.919 3.019 -19.788
114 H LYS 18 H LYS 18 10.608 0.612 -16.974
115 HA LYS 18 HA LYS 18 10.295 3.494 -16.630
116 1HB LYS 18 1HB LYS 18 8.428 1.820 -18.009
117 2HB LYS 18 2HB LYS 18 7.704 2.296 -16.486
118 1HG LYS 18 1HG LYS 18 8.245 4.690 -16.975
119 2HG LYS 18 2HG LYS 18 8.974 4.217 -18.496
120 1HD LYS 18 1HD LYS 18 6.880 3.529 -19.429
121 2HD LYS 18 2HD LYS 18 6.105 3.444 -17.859
122 1HE LYS 18 1HE LYS 18 6.326 5.942 -17.634
123 2HE LYS 18 2HE LYS 18 7.056 6.009 -19.226
124 1HZ LYS 18 1HZ LYS 18 4.462 4.723 -18.883
125 2HZ LYS 18 2HZ LYS 18 4.554 6.351 -18.985
126 3HZ LYS 18 3HZ LYS 18 5.091 5.423 -20.217
127 H ASN 19 H ASN 19 8.166 3.353 -14.762
128 HA ASN 19 HA ASN 19 8.469 1.382 -12.874
129 1HB ASN 19 1HB ASN 19 9.707 2.770 -11.092
130 2HB ASN 19 2HB ASN 19 10.712 2.137 -12.380
131 2HD2 ASN 19 2HD2 ASN 19 11.894 4.043 -11.209
132 1HD2 ASN 19 1HD2 ASN 19 11.819 5.573 -12.019
133 H LEU 20 H LEU 20 6.544 1.601 -11.709
134 HA LEU 20 HA LEU 20 5.153 4.128 -11.890
135 1HB LEU 20 1HB LEU 20 4.378 1.401 -10.854
136 2HB LEU 20 2HB LEU 20 3.325 2.801 -10.785
137 HG LEU 20 HG LEU 20 4.373 1.411 -13.261
138 1HD1 LEU 20 1HD1 LEU 20 1.907 1.277 -11.702
139 2HD1 LEU 20 2HD1 LEU 20 1.621 1.618 -13.426
140 3HD1 LEU 20 3HD1 LEU 20 2.545 0.175 -12.946
141 1HD2 LEU 20 1HD2 LEU 20 3.436 4.167 -12.914
142 2HD2 LEU 20 2HD2 LEU 20 4.314 3.408 -14.263
143 3HD2 LEU 20 3HD2 LEU 20 2.544 3.257 -14.156
144 H THR 21 H THR 21 6.059 5.642 -10.533
145 HA THR 21 HA THR 21 6.732 4.832 -7.820
146 HB THR 21 HB THR 21 6.943 7.643 -8.936
147 HG1 THR 21 HG1 THR 21 8.991 6.748 -9.911
148 1HG2 THR 21 1HG2 THR 21 7.847 6.538 -6.595
149 2HG2 THR 21 2HG2 THR 21 9.215 6.152 -7.666
150 3HG2 THR 21 3HG2 THR 21 8.710 7.844 -7.443
151 H VAL 22 H VAL 22 5.165 4.690 -6.345
152 HA VAL 22 HA VAL 22 2.875 6.475 -6.643
153 HB VAL 22 HB VAL 22 3.379 3.978 -5.020
154 1HG1 VAL 22 1HG1 VAL 22 1.214 6.027 -4.834
155 2HG1 VAL 22 2HG1 VAL 22 0.747 4.313 -4.714
156 3HG1 VAL 22 3HG1 VAL 22 1.930 4.996 -3.573
157 1HG2 VAL 22 1HG2 VAL 22 2.209 4.550 -7.648
158 2HG2 VAL 22 2HG2 VAL 22 2.779 3.013 -6.955
159 3HG2 VAL 22 3HG2 VAL 22 1.137 3.596 -6.595
160 H VAL 23 H VAL 23 2.326 8.027 -5.108
161 HA VAL 23 HA VAL 23 4.446 8.577 -3.172
162 HB VAL 23 HB VAL 23 2.214 10.295 -4.274
163 1HG1 VAL 23 1HG1 VAL 23 3.487 10.617 -1.852
164 2HG1 VAL 23 2HG1 VAL 23 4.473 11.622 -2.940
165 3HG1 VAL 23 3HG1 VAL 23 2.723 11.915 -2.801
166 1HG2 VAL 23 1HG2 VAL 23 4.836 9.616 -5.287
167 2HG2 VAL 23 2HG2 VAL 23 3.555 10.602 -6.030
168 3HG2 VAL 23 3HG2 VAL 23 4.738 11.358 -4.936
169 H PHE 24 H PHE 24 4.021 8.787 -0.951
170 HA PHE 24 HA PHE 24 1.277 8.198 -0.132
171 1HB PHE 24 1HB PHE 24 2.782 6.123 -0.172
172 2HB PHE 24 2HB PHE 24 3.889 6.944 0.910
173 HD1 PHE 24 HD1 PHE 24 0.240 6.137 0.757
174 HD2 PHE 24 HD2 PHE 24 3.743 6.397 3.137
175 HE1 PHE 24 HE1 PHE 24 -1.036 5.256 2.731
176 HE2 PHE 24 HE2 PHE 24 2.468 5.517 5.111
177 HZ PHE 24 HZ PHE 24 0.093 4.957 4.885
178 H ASN 25 H ASN 25 0.767 8.898 2.067
179 HA ASN 25 HA ASN 25 2.788 10.643 3.206
180 1HB ASN 25 1HB ASN 25 1.266 12.116 1.926
181 2HB ASN 25 2HB ASN 25 -0.138 11.367 2.659
182 2HD2 ASN 25 2HD2 ASN 25 -0.457 13.747 3.067
183 1HD2 ASN 25 1HD2 ASN 25 0.109 14.389 4.573
184 H HIS 26 H HIS 26 2.717 10.649 5.529
185 HA HIS 26 HA HIS 26 1.036 8.596 6.659
186 1HB HIS 26 1HB HIS 26 3.500 10.065 7.457
187 2HB HIS 26 2HB HIS 26 2.463 9.506 8.754
188 HD1 HIS 26 HD1 HIS 26 4.504 8.187 5.831
189 HD2 HIS 26 HD2 HIS 26 2.555 6.770 9.265
190 HE1 HIS 26 HE1 HIS 26 5.202 5.747 6.094
191 H SER 27 H SER 27 1.118 12.065 6.283
192 HA SER 27 HA SER 27 -0.470 12.567 8.590
193 1HB SER 27 1HB SER 27 -0.482 14.655 6.511
194 2HB SER 27 2HB SER 27 0.031 14.751 8.184
195 HG SER 27 HG SER 27 1.548 14.360 5.878
196 H THR 28 H THR 28 -1.175 10.889 5.885
197 HA THR 28 HA THR 28 -3.783 12.156 5.427
198 HB THR 28 HB THR 28 -2.140 10.092 3.868
199 HG1 THR 28 HG1 THR 28 -2.137 12.032 2.422
200 1HG2 THR 28 1HG2 THR 28 -4.914 10.352 3.770
201 2HG2 THR 28 2HG2 THR 28 -4.381 11.535 2.552
202 3HG2 THR 28 3HG2 THR 28 -3.899 9.828 2.405
203 H HIS 29 H HIS 29 -2.188 9.114 6.464
204 HA HIS 29 HA HIS 29 -4.841 8.055 7.052
205 1HB HIS 29 2HB HIS 29 -2.152 6.656 7.036
206 2HB HIS 29 1HB HIS 29 -3.710 5.894 7.287
207 HD1 HIS 29 HD1 HIS 29 -1.639 7.573 4.587
208 HD2 HIS 29 HD2 HIS 29 -5.157 5.321 4.967
209 HE1 HIS 29 HE1 HIS 29 -2.347 6.947 2.217
210 H LYS 30 H LYS 30 -3.372 10.261 8.552
211 HA LYS 30 HA LYS 30 -2.301 9.289 10.912
212 1HB LYS 30 2HB LYS 30 -2.622 11.510 11.768
213 2HB LYS 30 1HB LYS 30 -2.142 11.620 10.087
214 1HG LYS 30 1HG LYS 30 -4.760 11.639 9.626
215 2HG LYS 30 2HG LYS 30 -4.869 12.111 11.310
216 1HD LYS 30 1HD LYS 30 -2.792 13.714 10.175
217 2HD LYS 30 2HD LYS 30 -4.099 13.720 9.007
218 1HE LYS 30 1HE LYS 30 -5.557 14.095 11.282
219 2HE LYS 30 2HE LYS 30 -4.044 14.807 11.805
220 1HZ LYS 30 1HZ LYS 30 -5.227 15.524 9.228
221 2HZ LYS 30 2HZ LYS 30 -5.683 16.275 10.605
222 3HZ LYS 30 3HZ LYS 30 -4.129 16.355 10.107
223 H ASP 31 H ASP 31 -5.552 9.172 9.693
224 HA ASP 31 HA ASP 31 -6.685 8.976 12.319
225 1HB ASP 31 2HB ASP 31 -8.785 8.977 11.233
226 2HB ASP 31 1HB ASP 31 -7.798 9.987 10.195
227 H VAL 32 H VAL 32 -4.778 6.996 10.492
228 HA VAL 32 HA VAL 32 -6.288 4.574 11.200
229 HB VAL 32 HB VAL 32 -4.270 5.042 8.995
230 1HG1 VAL 32 1HG1 VAL 32 -5.572 2.559 10.071
231 2HG1 VAL 32 2HG1 VAL 32 -5.223 2.679 8.330
232 3HG1 VAL 32 3HG1 VAL 32 -3.902 2.821 9.515
233 1HG2 VAL 32 1HG2 VAL 32 -7.205 5.210 9.126
234 2HG2 VAL 32 2HG2 VAL 32 -6.068 5.865 7.924
235 3HG2 VAL 32 3HG2 VAL 32 -6.597 4.168 7.817
236 H LYS 33 H LYS 33 -5.377 3.208 12.671
237 HA LYS 33 HA LYS 33 -3.268 4.007 14.233
238 1HB LYS 33 1HB LYS 33 -4.331 1.213 13.725
239 2HB LYS 33 2HB LYS 33 -3.259 1.651 15.040
240 1HG LYS 33 1HG LYS 33 -4.993 2.438 16.272
241 2HG LYS 33 2HG LYS 33 -5.479 3.521 14.983
242 1HD LYS 33 1HD LYS 33 -6.876 1.848 13.955
243 2HD LYS 33 2HD LYS 33 -6.157 0.555 14.894
244 1HE LYS 33 2HE LYS 33 -8.297 1.019 15.907
245 2HE LYS 33 1HE LYS 33 -7.087 1.666 16.997
246 1HZ LYS 33 1HZ LYS 33 -7.434 3.815 15.762
247 2HZ LYS 33 2HZ LYS 33 -8.778 3.143 15.123
248 3HZ LYS 33 3HZ LYS 33 -8.651 3.335 16.739
249 H CYS 34 H CYS 34 -1.080 3.040 14.495
250 HA CYS 34 HA CYS 34 0.248 3.083 11.991
251 1HB CYS 34 2HB CYS 34 1.462 2.280 14.632
252 2HB CYS 34 1HB CYS 34 2.265 2.956 13.229
253 H ASP 35 H ASP 35 -0.596 0.618 14.497
254 HA ASP 35 HA ASP 35 0.792 -1.468 13.309
255 1HB ASP 35 1HB ASP 35 -0.776 -2.919 14.671
256 2HB ASP 35 2HB ASP 35 0.033 -1.669 15.595
257 H ASP 36 H ASP 36 -1.927 0.320 12.263
258 HA ASP 36 HA ASP 36 -3.562 -1.668 11.244
259 1HB ASP 36 1HB ASP 36 -3.870 0.949 11.490
260 2HB ASP 36 2HB ASP 36 -3.167 1.018 9.887
261 H CYS 37 H CYS 37 -0.413 -0.495 10.333
262 HA CYS 37 HA CYS 37 -0.626 -1.956 7.809
263 1HB CYS 37 1HB CYS 37 0.733 0.727 8.215
264 2HB CYS 37 2HB CYS 37 0.956 -0.283 6.801
265 H HIS 38 H HIS 38 1.512 -0.459 10.335
266 HA HIS 38 HA HIS 38 3.668 -2.208 9.684
267 1HB HIS 38 1HB HIS 38 3.255 -0.333 12.030
268 2HB HIS 38 2HB HIS 38 4.753 -1.160 11.649
269 HD1 HIS 38 HD1 HIS 38 5.756 -0.542 9.131
270 HD2 HIS 38 HD2 HIS 38 3.010 2.125 10.846
271 HE1 HIS 38 HE1 HIS 38 6.029 1.666 7.882
272 H HIS 39 H HIS 39 2.620 -4.306 9.852
273 HA HIS 39 HA HIS 39 1.784 -5.030 12.539
274 1HB HIS 39 1HB HIS 39 0.677 -6.851 11.592
275 2HB HIS 39 2HB HIS 39 0.430 -5.551 10.442
276 HD1 HIS 39 HD1 HIS 39 1.492 -9.009 10.624
277 HD2 HIS 39 HD2 HIS 39 2.405 -5.730 8.173
278 HE1 HIS 39 HE1 HIS 39 2.545 -9.970 8.508
279 H GLN 40 H GLN 40 4.492 -4.404 12.415
280 HA GLN 40 HA GLN 40 5.752 -7.025 12.272
281 1HB GLN 40 1HB GLN 40 6.781 -4.204 11.935
282 2HB GLN 40 2HB GLN 40 7.893 -5.460 12.442
283 1HG GLN 40 1HG GLN 40 7.588 -4.998 9.873
284 2HG GLN 40 2HG GLN 40 7.688 -6.657 10.427
285 2HE2 GLN 40 2HE2 GLN 40 5.878 -7.960 10.483
286 1HE2 GLN 40 1HE2 GLN 40 4.405 -7.583 9.653
287 HA PRO 41 HA PRO 41 6.179 -7.425 16.601
288 1HB PRO 41 1HB PRO 41 8.858 -8.282 16.701
289 2HB PRO 41 2HB PRO 41 7.445 -9.314 16.309
290 1HG PRO 41 1HG PRO 41 9.380 -8.114 14.303
291 2HG PRO 41 2HG PRO 41 8.583 -9.712 14.474
292 1HD PRO 41 1HD PRO 41 7.624 -7.706 12.828
293 2HD PRO 41 2HD PRO 41 6.538 -8.856 13.664
294 H GLY 42 H GLY 42 7.104 -6.310 18.472
295 1HA GLY 42 2HA GLY 42 8.191 -4.654 19.547
296 2HA GLY 42 1HA GLY 42 7.716 -3.672 18.176
297 H ASP 43 H ASP 43 9.925 -2.694 19.090
298 HA ASP 43 HA ASP 43 12.087 -2.411 18.921
299 1HB ASP 43 1HB ASP 43 11.960 -5.194 18.770
300 2HB ASP 43 2HB ASP 43 12.784 -4.785 17.279
301 H LYS 44 H LYS 44 10.922 -4.307 16.024
302 HA LYS 44 HA LYS 44 11.891 -2.099 14.344
303 1HB LYS 44 1HB LYS 44 12.875 -4.610 14.292
304 2HB LYS 44 2HB LYS 44 11.539 -4.814 13.177
305 1HG LYS 44 2HG LYS 44 13.317 -4.111 11.776
306 2HG LYS 44 1HG LYS 44 12.389 -2.644 12.017
307 1HD LYS 44 1HD LYS 44 14.529 -3.173 14.045
308 2HD LYS 44 2HD LYS 44 15.091 -2.812 12.424
309 1HE LYS 44 1HE LYS 44 13.193 -0.858 12.688
310 2HE LYS 44 2HE LYS 44 13.642 -1.052 14.371
311 1HZ LYS 44 1HZ LYS 44 15.547 -0.585 12.182
312 2HZ LYS 44 2HZ LYS 44 15.017 0.556 13.223
313 3HZ LYS 44 3HZ LYS 44 15.920 -0.690 13.768
314 H GLN 45 H GLN 45 9.300 -2.323 15.779
315 HA GLN 45 HA GLN 45 7.235 -3.296 14.450
316 1HB GLN 45 1HB GLN 45 7.374 -1.699 16.529
317 2HB GLN 45 2HB GLN 45 7.138 -0.408 15.368
318 1HG GLN 45 2HG GLN 45 4.909 -0.809 15.433
319 2HG GLN 45 1HG GLN 45 5.199 -2.368 14.687
320 2HE2 GLN 45 2HE2 GLN 45 3.218 -2.792 15.989
321 1HE2 GLN 45 1HE2 GLN 45 3.406 -3.386 17.605
322 H TYR 46 H TYR 46 9.166 -0.476 13.541
323 HA TYR 46 HA TYR 46 7.570 -0.191 11.044
324 1HB TYR 46 1HB TYR 46 9.592 1.761 12.164
325 2HB TYR 46 2HB TYR 46 8.342 2.054 10.942
326 HD1 TYR 46 HD1 TYR 46 5.916 2.055 11.637
327 HD2 TYR 46 HD2 TYR 46 9.138 2.016 14.477
328 HE1 TYR 46 HE1 TYR 46 4.361 2.822 13.411
329 HE2 TYR 46 HE2 TYR 46 7.584 2.783 16.251
330 HH TYR 46 HH TYR 46 5.102 2.775 16.736
331 H ALA 47 H ALA 47 8.599 -1.966 9.881
332 HA ALA 47 HA ALA 47 11.365 -1.294 9.154
333 1HB ALA 47 1HB ALA 47 10.675 -3.457 10.696
334 2HB ALA 47 3HB ALA 47 10.594 -4.154 9.061
335 3HB ALA 47 2HB ALA 47 12.099 -3.392 9.630
336 H GLY 48 H GLY 48 11.942 -2.484 6.992
337 1HA GLY 48 2HA GLY 48 11.552 -2.671 4.788
338 2HA GLY 48 1HA GLY 48 10.223 -1.549 5.000
339 H CYS 49 H CYS 49 8.711 -2.560 3.638
340 HA CYS 49 HA CYS 49 7.412 -4.825 4.796
341 1HB CYS 49 1HB CYS 49 6.773 -3.513 2.154
342 2HB CYS 49 2HB CYS 49 5.719 -4.496 3.153
343 H THR 50 H THR 50 9.696 -4.075 2.178
344 HA THR 50 HA THR 50 9.415 -6.748 1.047
345 HB THR 50 HB THR 50 10.830 -5.815 -0.737
346 HG1 THR 50 HG1 THR 50 10.878 -3.378 0.855
347 1HG2 THR 50 1HG2 THR 50 8.447 -4.344 0.221
348 2HG2 THR 50 2HG2 THR 50 9.577 -3.304 -0.679
349 3HG2 THR 50 3HG2 THR 50 8.912 -4.767 -1.444
350 H THR 51 H THR 51 10.501 -6.102 3.850
351 HA THR 51 HA THR 51 13.283 -6.624 3.746
352 HB THR 51 HB THR 51 11.283 -7.084 6.018
353 HG1 THR 51 HG1 THR 51 12.841 -4.755 5.143
354 1HG2 THR 51 1HG2 THR 51 13.720 -7.805 6.369
355 2HG2 THR 51 2HG2 THR 51 14.185 -6.115 6.060
356 3HG2 THR 51 3HG2 THR 51 13.166 -6.515 7.463
357 H ASP 52 H ASP 52 14.416 -8.550 4.466
358 HA ASP 52 HA ASP 52 13.684 -10.743 3.036
359 1HB ASP 52 1HB ASP 52 15.814 -9.979 4.695
360 2HB ASP 52 2HB ASP 52 15.175 -11.393 5.508
361 H GLY 53 H GLY 53 12.901 -12.914 3.785
362 1HA GLY 53 2HA GLY 53 11.993 -13.480 6.355
363 2HA GLY 53 1HA GLY 53 11.470 -14.259 4.874
364 H CYS 54 H CYS 54 10.679 -11.348 3.906
365 HA CYS 54 HA CYS 54 8.075 -11.435 5.232
366 1HB CYS 54 1HB CYS 54 9.459 -8.841 4.500
367 2HB CYS 54 2HB CYS 54 7.961 -9.044 5.385
368 H HIS 55 H HIS 55 7.818 -8.821 3.351
369 HA HIS 55 HA HIS 55 6.894 -10.383 1.098
370 1HB HIS 55 1HB HIS 55 6.577 -7.408 1.518
371 2HB HIS 55 2HB HIS 55 5.634 -8.460 0.481
372 HD1 HIS 55 HD1 HIS 55 4.052 -10.262 1.777
373 HD2 HIS 55 HD2 HIS 55 5.597 -7.116 4.082
374 HE1 HIS 55 HE1 HIS 55 2.642 -10.173 3.902
375 H ASN 56 H ASN 56 9.625 -10.552 1.205
376 HA ASN 56 HA ASN 56 10.714 -8.428 -0.376
377 1HB ASN 56 1HB ASN 56 12.081 -9.518 1.406
378 2HB ASN 56 2HB ASN 56 11.915 -11.070 0.609
379 2HD2 ASN 56 2HD2 ASN 56 14.327 -9.689 1.257
380 1HD2 ASN 56 1HD2 ASN 56 15.192 -9.372 -0.209
381 H ILE 57 H ILE 57 8.945 -9.085 -2.110
382 HA ILE 57 HA ILE 57 10.196 -11.024 -3.909
383 HB ILE 57 HB ILE 57 7.229 -10.867 -3.374
384 1HG1 ILE 57 1HG1 ILE 57 8.762 -11.833 -1.516
385 2HG1 ILE 57 2HG1 ILE 57 7.346 -12.735 -2.019
386 1HG2 ILE 57 1HG2 ILE 57 8.939 -12.435 -5.279
387 2HG2 ILE 57 2HG2 ILE 57 7.417 -13.125 -4.666
388 3HG2 ILE 57 3HG2 ILE 57 7.400 -11.586 -5.561
389 1HD1 ILE 57 1HD1 ILE 57 9.900 -13.274 -3.510
390 2HD1 ILE 57 2HD1 ILE 57 9.774 -13.884 -1.842
391 3HD1 ILE 57 3HD1 ILE 57 8.587 -14.391 -3.068
392 H LEU 58 H LEU 58 10.911 -9.800 -5.573
393 HA LEU 58 HA LEU 58 9.279 -7.498 -6.337
394 1HB LEU 58 1HB LEU 58 12.119 -8.213 -7.078
395 2HB LEU 58 2HB LEU 58 11.272 -6.745 -7.526
396 HG LEU 58 HG LEU 58 12.073 -7.592 -4.730
397 1HD1 LEU 58 1HD1 LEU 58 13.243 -5.798 -6.780
398 2HD1 LEU 58 2HD1 LEU 58 13.234 -5.193 -5.107
399 3HD1 LEU 58 3HD1 LEU 58 14.023 -6.742 -5.488
400 1HD2 LEU 58 1HD2 LEU 58 9.994 -5.770 -5.602
401 2HD2 LEU 58 2HD2 LEU 58 10.410 -6.333 -3.966
402 3HD2 LEU 58 3HD2 LEU 58 11.247 -4.924 -4.662
403 H ASP 59 H ASP 59 7.623 -8.955 -7.273
404 HA ASP 59 HA ASP 59 8.183 -9.306 -10.025
405 1HB ASP 59 1HB ASP 59 8.866 -11.493 -8.569
406 2HB ASP 59 2HB ASP 59 7.151 -11.817 -8.725
407 H LYS 60 H LYS 60 6.253 -8.646 -10.989
408 HA LYS 60 HA LYS 60 3.870 -8.606 -9.347
409 1HB LYS 60 1HB LYS 60 4.035 -7.588 -12.171
410 2HB LYS 60 2HB LYS 60 3.034 -7.028 -10.847
411 1HG LYS 60 1HG LYS 60 4.599 -5.434 -10.450
412 2HG LYS 60 2HG LYS 60 5.653 -6.708 -9.869
413 1HD LYS 60 2HD LYS 60 6.938 -5.629 -11.554
414 2HD LYS 60 1HD LYS 60 6.336 -7.072 -12.344
415 1HE LYS 60 1HE LYS 60 4.337 -5.032 -12.688
416 2HE LYS 60 2HE LYS 60 5.885 -4.301 -13.064
417 1HZ LYS 60 1HZ LYS 60 5.407 -6.937 -14.140
418 2HZ LYS 60 2HZ LYS 60 4.544 -5.715 -14.795
419 3HZ LYS 60 3HZ LYS 60 6.176 -5.662 -14.811
420 H ALA 61 H ALA 61 4.602 -11.223 -9.751
421 HA ALA 61 HA ALA 61 2.316 -12.327 -10.834
422 1HB ALA 61 1HB ALA 61 3.816 -13.448 -12.821
423 2HB ALA 61 3HB ALA 61 4.486 -11.800 -12.794
424 3HB ALA 61 2HB ALA 61 2.743 -12.047 -13.054
425 H ASP 62 H ASP 62 3.336 -12.807 -8.472
426 HA ASP 62 HA ASP 62 4.922 -15.231 -8.811
427 1HB ASP 62 1HB ASP 62 5.904 -13.252 -7.475
428 2HB ASP 62 2HB ASP 62 4.658 -13.552 -6.279
429 H LYS 63 H LYS 63 4.506 -16.666 -6.590
430 HA LYS 63 HA LYS 63 1.643 -16.576 -5.986
431 1HB LYS 63 1HB LYS 63 2.575 -18.339 -7.809
432 2HB LYS 63 2HB LYS 63 2.865 -19.262 -6.348
433 1HG LYS 63 1HG LYS 63 0.638 -19.625 -5.996
434 2HG LYS 63 2HG LYS 63 0.225 -17.951 -6.310
435 1HD LYS 63 1HD LYS 63 -0.023 -18.295 -8.629
436 2HD LYS 63 2HD LYS 63 1.030 -19.696 -8.643
437 1HE LYS 63 1HE LYS 63 -0.723 -20.968 -7.322
438 2HE LYS 63 2HE LYS 63 -1.782 -19.578 -7.452
439 1HZ LYS 63 1HZ LYS 63 -0.928 -20.056 -9.990
440 2HZ LYS 63 2HZ LYS 63 -1.208 -21.546 -9.381
441 3HZ LYS 63 3HZ LYS 63 -2.396 -20.426 -9.376
442 H SER 64 H SER 64 2.249 -15.564 -3.984
443 HA SER 64 HA SER 64 2.664 -17.398 -1.953
444 1HB SER 64 1HB SER 64 5.094 -16.667 -3.148
445 2HB SER 64 2HB SER 64 5.003 -15.617 -1.748
446 HG SER 64 HG SER 64 5.866 -18.054 -1.683
447 H VAL 65 H VAL 65 2.719 -16.266 0.230
448 HA VAL 65 HA VAL 65 1.160 -13.856 0.046
449 HB VAL 65 HB VAL 65 0.479 -15.550 1.582
450 1HG1 VAL 65 1HG1 VAL 65 3.334 -15.432 2.542
451 2HG1 VAL 65 2HG1 VAL 65 2.036 -16.012 3.613
452 3HG1 VAL 65 3HG1 VAL 65 2.357 -16.844 2.073
453 1HG2 VAL 65 1HG2 VAL 65 0.795 -12.907 2.260
454 2HG2 VAL 65 2HG2 VAL 65 -0.122 -14.108 3.202
455 3HG2 VAL 65 3HG2 VAL 65 1.565 -13.737 3.634
456 H ASN 66 H ASN 66 4.359 -14.383 -0.367
457 HA ASN 66 HA ASN 66 5.212 -12.245 1.381
458 1HB ASN 66 2HB ASN 66 6.858 -13.954 -0.558
459 2HB ASN 66 1HB ASN 66 7.505 -12.892 0.676
460 2HD2 ASN 66 2HD2 ASN 66 6.541 -13.301 2.929
461 1HD2 ASN 66 1HD2 ASN 66 6.487 -14.949 3.459
462 H SER 67 H SER 67 3.531 -12.252 -1.338
463 HA SER 67 HA SER 67 5.250 -10.863 -3.118
464 1HB SER 67 1HB SER 67 2.934 -10.432 -4.285
465 2HB SER 67 2HB SER 67 3.592 -12.056 -4.254
466 HG SER 67 HG SER 67 1.347 -12.029 -3.628
467 H TRP 68 H TRP 68 5.460 -8.631 -3.403
468 HA TRP 68 HA TRP 68 4.136 -6.997 -1.382
469 1HB TRP 68 1HB TRP 68 6.415 -6.621 -1.315
470 2HB TRP 68 2HB TRP 68 6.603 -6.723 -3.054
471 HD1 TRP 68 HD1 TRP 68 6.863 -4.402 -4.228
472 HE1 TRP 68 HE1 TRP 68 6.377 -1.860 -3.712
473 HE3 TRP 68 HE3 TRP 68 4.516 -5.210 0.210
474 HZ2 TRP 68 HZ2 TRP 68 5.094 -0.503 -1.554
475 HZ3 TRP 68 HZ3 TRP 68 3.677 -3.222 1.458
476 HH2 TRP 68 HH2 TRP 68 3.934 -0.932 0.644
477 H TYR 69 H TYR 69 3.089 -8.245 -4.019
478 HA TYR 69 HA TYR 69 2.014 -5.708 -5.159
479 1HB TYR 69 1HB TYR 69 3.459 -6.653 -6.799
480 2HB TYR 69 2HB TYR 69 2.853 -8.290 -6.497
481 HD1 TYR 69 HD1 TYR 69 0.530 -8.906 -7.219
482 HD2 TYR 69 HD2 TYR 69 2.375 -5.190 -8.333
483 HE1 TYR 69 HE1 TYR 69 -1.134 -8.625 -9.036
484 HE2 TYR 69 HE2 TYR 69 0.711 -4.909 -10.151
485 HH TYR 69 HH TYR 69 -2.118 -6.868 -10.456
486 H LYS 70 H LYS 70 1.293 -8.390 -3.252
487 HA LYS 70 HA LYS 70 -1.418 -8.552 -4.361
488 1HB LYS 70 1HB LYS 70 0.024 -10.649 -4.168
489 2HB LYS 70 2HB LYS 70 -0.130 -10.492 -2.430
490 1HG LYS 70 1HG LYS 70 -2.753 -10.232 -3.100
491 2HG LYS 70 2HG LYS 70 -2.223 -11.189 -4.470
492 1HD LYS 70 1HD LYS 70 -1.420 -12.031 -1.671
493 2HD LYS 70 2HD LYS 70 -3.038 -12.386 -2.243
494 1HE LYS 70 1HE LYS 70 -0.400 -13.307 -3.463
495 2HE LYS 70 2HE LYS 70 -1.659 -14.309 -2.767
496 1HZ LYS 70 1HZ LYS 70 -3.068 -13.158 -4.602
497 2HZ LYS 70 2HZ LYS 70 -1.620 -12.955 -5.329
498 3HZ LYS 70 3HZ LYS 70 -2.143 -14.456 -4.956
499 H VAL 71 H VAL 71 0.568 -7.959 -1.431
500 HA VAL 71 HA VAL 71 -1.662 -7.621 0.279
501 HB VAL 71 HB VAL 71 0.007 -6.682 1.816
502 1HG1 VAL 71 1HG1 VAL 71 -0.274 -9.106 1.686
503 2HG1 VAL 71 2HG1 VAL 71 0.918 -9.192 0.367
504 3HG1 VAL 71 3HG1 VAL 71 1.429 -8.692 1.997
505 1HG2 VAL 71 1HG2 VAL 71 1.360 -5.917 -0.493
506 2HG2 VAL 71 2HG2 VAL 71 1.969 -5.815 1.176
507 3HG2 VAL 71 3HG2 VAL 71 2.356 -7.233 0.171
508 H VAL 72 H VAL 72 -0.665 -5.867 -2.399
509 HA VAL 72 HA VAL 72 -1.529 -3.324 -1.223
510 HB VAL 72 HB VAL 72 0.019 -3.983 -3.735
511 1HG1 VAL 72 1HG1 VAL 72 -1.665 -1.916 -3.640
512 2HG1 VAL 72 2HG1 VAL 72 -0.299 -1.171 -2.775
513 3HG1 VAL 72 3HG1 VAL 72 -0.071 -1.802 -4.424
514 1HG2 VAL 72 1HG2 VAL 72 1.289 -4.200 -1.626
515 2HG2 VAL 72 2HG2 VAL 72 1.880 -2.856 -2.633
516 3HG2 VAL 72 3HG2 VAL 72 0.864 -2.522 -1.210
517 H HIS 73 H HIS 73 -1.993 -5.566 -4.026
518 HA HIS 73 HA HIS 73 -4.506 -4.172 -4.554
519 1HB HIS 73 1HB HIS 73 -3.041 -6.136 -6.333
520 2HB HIS 73 2HB HIS 73 -4.422 -5.146 -6.764
521 HD1 HIS 73 HD1 HIS 73 -0.705 -4.915 -6.077
522 HD2 HIS 73 HD2 HIS 73 -3.836 -2.496 -7.473
523 HE1 HIS 73 HE1 HIS 73 0.384 -2.807 -7.016
524 H ASP 74 H ASP 74 -4.121 -5.969 -2.258
525 HA ASP 74 HA ASP 74 -5.300 -8.442 -3.033
526 1HB ASP 74 1HB ASP 74 -4.007 -7.296 -0.690
527 2HB ASP 74 2HB ASP 74 -5.523 -8.030 -0.205
528 H ALA 75 H ALA 75 -7.459 -8.176 -3.746
529 HA ALA 75 HA ALA 75 -9.185 -6.263 -2.514
530 1HB ALA 75 1HB ALA 75 -10.367 -8.400 -4.183
531 2HB ALA 75 3HB ALA 75 -9.038 -7.509 -4.963
532 3HB ALA 75 2HB ALA 75 -10.462 -6.631 -4.354
533 H LYS 76 H LYS 76 -8.376 -9.688 -2.107
534 HA LYS 76 HA LYS 76 -10.740 -10.317 -0.649
535 1HB LYS 76 1HB LYS 76 -9.214 -11.894 -1.985
536 2HB LYS 76 2HB LYS 76 -8.133 -11.843 -0.608
537 1HG LYS 76 1HG LYS 76 -10.315 -12.407 0.792
538 2HG LYS 76 2HG LYS 76 -10.957 -12.933 -0.751
539 1HD LYS 76 1HD LYS 76 -9.201 -14.580 -1.031
540 2HD LYS 76 2HD LYS 76 -8.267 -13.912 0.293
541 1HE LYS 76 1HE LYS 76 -10.518 -14.451 1.679
542 2HE LYS 76 2HE LYS 76 -10.753 -15.616 0.391
543 1HZ LYS 76 1HZ LYS 76 -8.103 -15.588 1.453
544 2HZ LYS 76 2HZ LYS 76 -9.239 -16.021 2.543
545 3HZ LYS 76 3HZ LYS 76 -9.089 -16.853 1.146
546 H GLY 77 H GLY 77 -10.920 -10.705 1.641
547 1HA GLY 77 2HA GLY 77 -10.704 -10.008 3.772
548 2HA GLY 77 1HA GLY 77 -9.668 -8.709 3.214
549 H GLY 78 H GLY 78 -9.421 -10.524 5.610
550 1HA GLY 78 2HA GLY 78 -6.659 -11.386 5.085
551 2HA GLY 78 1HA GLY 78 -7.799 -12.529 5.766
552 H ALA 79 H ALA 79 -5.604 -12.005 7.290
553 HA ALA 79 HA ALA 79 -6.581 -11.299 9.722
554 1HB ALA 79 1HB ALA 79 -4.093 -10.813 10.230
555 2HB ALA 79 3HB ALA 79 -4.503 -12.427 9.601
556 3HB ALA 79 2HB ALA 79 -3.802 -11.202 8.517
557 H LYS 80 H LYS 80 -5.681 -9.213 7.031
558 HA LYS 80 HA LYS 80 -6.733 -6.959 8.444
559 1HB LYS 80 1HB LYS 80 -4.474 -5.694 7.782
560 2HB LYS 80 2HB LYS 80 -4.733 -6.414 9.358
561 1HG LYS 80 1HG LYS 80 -3.609 -8.518 8.566
562 2HG LYS 80 2HG LYS 80 -3.325 -7.769 7.008
563 1HD LYS 80 2HD LYS 80 -2.212 -6.839 9.695
564 2HD LYS 80 1HD LYS 80 -1.303 -7.576 8.391
565 1HE LYS 80 1HE LYS 80 -1.950 -5.621 6.905
566 2HE LYS 80 2HE LYS 80 -2.720 -4.871 8.289
567 1HZ LYS 80 1HZ LYS 80 0.036 -5.749 8.552
568 2HZ LYS 80 2HZ LYS 80 -0.267 -4.376 7.721
569 3HZ LYS 80 3HZ LYS 80 -0.728 -4.504 9.283
570 HA PRO 81 HA PRO 81 -7.749 -5.831 4.342
571 1HB PRO 81 1HB PRO 81 -8.006 -3.112 4.573
572 2HB PRO 81 2HB PRO 81 -9.104 -4.260 5.407
573 1HG PRO 81 2HG PRO 81 -6.855 -2.843 6.295
574 2HG PRO 81 1HG PRO 81 -8.325 -3.008 7.310
575 1HD PRO 81 1HD PRO 81 -6.055 -4.477 7.774
576 2HD PRO 81 2HD PRO 81 -7.682 -5.184 8.009
577 H THR 82 H THR 82 -7.077 -3.916 2.603
578 HA THR 82 HA THR 82 -4.163 -3.585 2.797
579 HB THR 82 HB THR 82 -4.097 -4.241 0.342
580 HG1 THR 82 HG1 THR 82 -6.777 -5.201 1.033
581 1HG2 THR 82 1HG2 THR 82 -4.459 -6.003 2.596
582 2HG2 THR 82 2HG2 THR 82 -5.406 -6.663 1.240
583 3HG2 THR 82 3HG2 THR 82 -3.661 -6.368 1.047
584 H CYS 83 H CYS 83 -3.842 -2.322 0.284
585 HA CYS 83 HA CYS 83 -4.808 0.256 1.025
586 1HB CYS 83 1HB CYS 83 -3.408 -0.379 -1.558
587 2HB CYS 83 2HB CYS 83 -3.404 1.114 -0.641
588 H ILE 84 H ILE 84 -6.237 -2.385 -0.428
589 HA ILE 84 HA ILE 84 -7.839 -0.697 -2.222
590 HB ILE 84 HB ILE 84 -6.906 -3.533 -2.394
591 1HG1 ILE 84 1HG1 ILE 84 -5.653 -1.779 -3.556
592 2HG1 ILE 84 2HG1 ILE 84 -6.383 -2.906 -4.682
593 1HG2 ILE 84 1HG2 ILE 84 -9.483 -2.439 -3.523
594 2HG2 ILE 84 2HG2 ILE 84 -8.618 -3.806 -4.267
595 3HG2 ILE 84 3HG2 ILE 84 -9.213 -3.933 -2.594
596 1HD1 ILE 84 1HD1 ILE 84 -8.391 -1.018 -4.437
597 2HD1 ILE 84 2HD1 ILE 84 -6.925 -0.019 -4.283
598 3HD1 ILE 84 3HD1 ILE 84 -7.164 -1.032 -5.727
599 H SER 85 H SER 85 -7.865 -3.334 0.241
600 HA SER 85 HA SER 85 -10.553 -3.716 0.364
601 1HB SER 85 2HB SER 85 -8.974 -3.658 2.930
602 2HB SER 85 1HB SER 85 -10.145 -4.839 2.380
603 HG SER 85 HG SER 85 -8.622 -5.918 1.271
604 H CYS 86 H CYS 86 -8.573 -1.520 2.499
605 HA CYS 86 HA CYS 86 -10.771 -0.346 3.724
606 1HB CYS 86 1HB CYS 86 -8.348 -0.298 4.489
607 2HB CYS 86 2HB CYS 86 -8.071 0.967 3.308
608 H HIS 87 H HIS 87 -8.589 0.907 1.084
609 HA HIS 87 HA HIS 87 -9.884 3.203 0.512
610 1HB HIS 87 1HB HIS 87 -8.329 1.247 -1.143
611 2HB HIS 87 2HB HIS 87 -9.123 2.586 -1.948
612 HD1 HIS 87 HD1 HIS 87 -7.015 3.902 -2.546
613 HD2 HIS 87 HD2 HIS 87 -7.321 3.037 1.547
614 HE1 HIS 87 HE1 HIS 87 -5.186 5.255 -1.391
615 H LYS 88 H LYS 88 -10.808 -0.136 -0.411
616 HA LYS 88 HA LYS 88 -12.795 0.556 -2.241
617 1HB LYS 88 1HB LYS 88 -12.059 -1.853 -0.645
618 2HB LYS 88 2HB LYS 88 -13.679 -1.803 -1.310
619 1HG LYS 88 1HG LYS 88 -11.198 -1.236 -2.990
620 2HG LYS 88 2HG LYS 88 -11.867 -2.845 -2.812
621 1HD LYS 88 1HD LYS 88 -14.084 -1.182 -3.456
622 2HD LYS 88 2HD LYS 88 -12.787 -0.647 -4.506
623 1HE LYS 88 1HE LYS 88 -12.565 -2.764 -5.544
624 2HE LYS 88 2HE LYS 88 -13.292 -3.617 -4.197
625 1HZ LYS 88 1HZ LYS 88 -15.045 -1.711 -5.366
626 2HZ LYS 88 2HZ LYS 88 -14.571 -2.855 -6.431
627 3HZ LYS 88 3HZ LYS 88 -15.299 -3.290 -5.035
628 H ASP 89 H ASP 89 -12.903 -0.005 1.332
629 HA ASP 89 HA ASP 89 -15.601 0.246 1.628
630 1HB ASP 89 1HB ASP 89 -13.578 -0.220 3.321
631 2HB ASP 89 2HB ASP 89 -13.727 1.495 3.646
632 H LYS 90 H LYS 90 -12.978 2.713 1.419
633 HA LYS 90 HA LYS 90 -14.537 4.927 2.142
634 1HB LYS 90 1HB LYS 90 -11.870 4.413 0.979
635 2HB LYS 90 2HB LYS 90 -12.575 5.954 0.532
636 1HG LYS 90 1HG LYS 90 -12.189 4.905 3.374
637 2HG LYS 90 2HG LYS 90 -11.275 6.192 2.614
638 1HD LYS 90 1HD LYS 90 -13.797 7.173 2.249
639 2HD LYS 90 2HD LYS 90 -14.070 6.230 3.701
640 1HE LYS 90 1HE LYS 90 -12.176 7.406 4.830
641 2HE LYS 90 2HE LYS 90 -11.879 8.337 3.376
642 1HZ LYS 90 1HZ LYS 90 -14.492 8.730 3.811
643 2HZ LYS 90 2HZ LYS 90 -13.913 8.670 5.337
644 3HZ LYS 90 3HZ LYS 90 -13.306 9.752 4.276
645 H ALA 91 H ALA 91 -13.824 3.345 -1.020
646 HA ALA 91 HA ALA 91 -15.581 5.254 -2.336
647 1HB ALA 91 1HB ALA 91 -14.327 2.963 -3.788
648 2HB ALA 91 3HB ALA 91 -14.484 4.671 -4.264
649 3HB ALA 91 2HB ALA 91 -13.226 4.183 -3.104
650 H GLY 92 H GLY 92 -16.450 3.141 -0.283
651 1HA GLY 92 2HA GLY 92 -17.899 1.370 -0.135
652 2HA GLY 92 1HA GLY 92 -17.972 1.255 -1.882
653 H ASP 93 H ASP 93 -18.950 3.441 -2.942
654 HA ASP 93 HA ASP 93 -21.559 3.464 -2.513
655 1HB ASP 93 1HB ASP 93 -21.833 5.718 -1.212
656 2HB ASP 93 2HB ASP 93 -21.570 4.248 -0.294
657 H ASP 94 H ASP 94 -18.936 6.003 -2.468
658 HA ASP 94 HA ASP 94 -20.240 7.488 -4.500
659 1HB ASP 94 1HB ASP 94 -18.889 8.636 -2.812
660 2HB ASP 94 2HB ASP 94 -17.482 7.671 -3.210
661 H LYS 95 H LYS 95 -19.983 7.137 -6.716
662 HA LYS 95 HA LYS 95 -18.268 5.056 -7.606
663 1HB LYS 95 1HB LYS 95 -20.107 7.019 -8.983
664 2HB LYS 95 2HB LYS 95 -19.101 5.906 -9.888
665 1HG LYS 95 1HG LYS 95 -20.104 3.986 -8.605
666 2HG LYS 95 2HG LYS 95 -21.139 5.115 -7.753
667 1HD LYS 95 1HD LYS 95 -22.553 4.417 -9.489
668 2HD LYS 95 2HD LYS 95 -21.884 5.889 -10.164
669 1HE LYS 95 1HE LYS 95 -20.158 3.571 -10.723
670 2HE LYS 95 2HE LYS 95 -21.786 3.315 -11.320
671 1HZ LYS 95 1HZ LYS 95 -21.531 5.652 -12.250
672 2HZ LYS 95 2HZ LYS 95 -19.927 5.455 -12.014
673 3HZ LYS 95 3HZ LYS 95 -20.736 4.442 -13.006
674 H GLU 96 H GLU 96 -18.165 8.637 -7.543
675 HA GLU 96 HA GLU 96 -15.966 8.845 -9.249
676 1HB GLU 96 1HB GLU 96 -17.525 10.716 -8.706
677 2HB GLU 96 2HB GLU 96 -16.918 10.747 -7.062
678 1HG GLU 96 1HG GLU 96 -15.656 12.444 -8.120
679 2HG GLU 96 2HG GLU 96 -14.558 11.078 -8.131
680 H LEU 97 H LEU 97 -16.336 7.979 -5.860
681 HA LEU 97 HA LEU 97 -13.627 8.606 -5.165
682 1HB LEU 97 1HB LEU 97 -15.772 8.528 -3.694
683 2HB LEU 97 2HB LEU 97 -15.451 6.807 -3.605
684 HG LEU 97 HG LEU 97 -14.472 7.675 -1.677
685 1HD1 LEU 97 1HD1 LEU 97 -12.976 6.176 -3.019
686 2HD1 LEU 97 2HD1 LEU 97 -12.141 7.634 -3.607
687 3HD1 LEU 97 3HD1 LEU 97 -12.133 7.242 -1.871
688 1HD2 LEU 97 1HD2 LEU 97 -14.659 10.056 -2.326
689 2HD2 LEU 97 2HD2 LEU 97 -13.114 9.668 -1.532
690 3HD2 LEU 97 3HD2 LEU 97 -13.177 9.884 -3.298
691 H LYS 98 H LYS 98 -15.326 6.022 -6.767
692 HA LYS 98 HA LYS 98 -13.296 4.068 -6.117
693 1HB LYS 98 1HB LYS 98 -15.771 3.559 -6.320
694 2HB LYS 98 2HB LYS 98 -15.615 3.814 -8.047
695 1HG LYS 98 1HG LYS 98 -14.752 1.736 -8.328
696 2HG LYS 98 2HG LYS 98 -13.466 2.073 -7.185
697 1HD LYS 98 2HD LYS 98 -14.628 0.223 -6.234
698 2HD LYS 98 1HD LYS 98 -15.188 1.605 -5.313
699 1HE LYS 98 2HE LYS 98 -17.185 0.424 -5.845
700 2HE LYS 98 1HE LYS 98 -17.157 1.744 -6.997
701 1HZ LYS 98 1HZ LYS 98 -15.749 -0.495 -7.975
702 2HZ LYS 98 2HZ LYS 98 -17.281 -0.901 -7.584
703 3HZ LYS 98 3HZ LYS 98 -17.003 0.308 -8.646
704 H LYS 99 H LYS 99 -12.702 6.685 -7.568
705 HA LYS 99 HA LYS 99 -11.221 5.417 -9.725
706 1HB LYS 99 1HB LYS 99 -13.410 7.396 -10.087
707 2HB LYS 99 2HB LYS 99 -11.951 7.676 -11.015
708 1HG LYS 99 1HG LYS 99 -12.063 5.249 -11.790
709 2HG LYS 99 2HG LYS 99 -13.615 5.116 -10.986
710 1HD LYS 99 1HD LYS 99 -14.298 7.220 -12.395
711 2HD LYS 99 2HD LYS 99 -12.883 6.863 -13.364
712 1HE LYS 99 1HE LYS 99 -14.833 5.782 -14.380
713 2HE LYS 99 2HE LYS 99 -13.755 4.543 -13.769
714 1HZ LYS 99 1HZ LYS 99 -15.840 5.534 -12.009
715 2HZ LYS 99 2HZ LYS 99 -16.264 4.511 -13.210
716 3HZ LYS 99 3HZ LYS 99 -15.172 4.046 -12.088
717 H LYS 100 H LYS 100 -10.192 6.038 -7.254
718 HA LYS 100 HA LYS 100 -8.192 7.898 -7.960
719 1HB LYS 100 1HB LYS 100 -8.820 9.373 -5.841
720 2HB LYS 100 2HB LYS 100 -9.403 9.751 -7.449
721 1HG LYS 100 1HG LYS 100 -11.470 8.298 -6.898
722 2HG LYS 100 2HG LYS 100 -10.908 8.288 -5.239
723 1HD LYS 100 1HD LYS 100 -11.309 10.885 -6.779
724 2HD LYS 100 2HD LYS 100 -12.618 10.123 -5.899
725 1HE LYS 100 1HE LYS 100 -11.260 10.211 -3.797
726 2HE LYS 100 2HE LYS 100 -9.947 10.968 -4.676
727 1HZ LYS 100 1HZ LYS 100 -12.625 12.142 -4.681
728 2HZ LYS 100 2HZ LYS 100 -11.570 12.452 -3.474
729 3HZ LYS 100 3HZ LYS 100 -11.198 12.867 -5.009
730 H LEU 101 H LEU 101 -9.986 6.228 -5.307
731 HA LEU 101 HA LEU 101 -7.470 5.784 -3.928
732 1HB LEU 101 1HB LEU 101 -10.311 5.069 -3.189
733 2HB LEU 101 2HB LEU 101 -8.903 4.825 -2.175
734 HG LEU 101 HG LEU 101 -10.292 7.378 -2.918
735 1HD1 LEU 101 1HD1 LEU 101 -10.737 6.022 -0.802
736 2HD1 LEU 101 2HD1 LEU 101 -9.128 6.553 -0.259
737 3HD1 LEU 101 3HD1 LEU 101 -10.393 7.757 -0.603
738 1HD2 LEU 101 1HD2 LEU 101 -7.366 7.078 -2.273
739 2HD2 LEU 101 2HD2 LEU 101 -8.153 8.060 -3.531
740 3HD2 LEU 101 3HD2 LEU 101 -8.266 8.546 -1.823
741 H THR 102 H THR 102 -9.879 4.124 -5.951
742 HA THR 102 HA THR 102 -8.173 1.726 -5.810
743 HB THR 102 HB THR 102 -10.184 0.376 -5.886
744 HG1 THR 102 HG1 THR 102 -11.559 1.487 -7.280
745 1HG2 THR 102 1HG2 THR 102 -9.782 1.592 -3.635
746 2HG2 THR 102 2HG2 THR 102 -11.014 2.761 -4.166
747 3HG2 THR 102 3HG2 THR 102 -11.451 1.051 -3.935
748 H GLY 103 H GLY 103 -8.925 4.355 -7.641
749 1HA GLY 103 2HA GLY 103 -8.692 4.823 -9.826
750 2HA GLY 103 1HA GLY 103 -9.656 3.392 -10.137
751 H CYS 104 H CYS 104 -8.707 1.799 -11.330
752 HA CYS 104 HA CYS 104 -6.144 0.855 -10.854
753 1HB CYS 104 1HB CYS 104 -8.225 0.463 -12.924
754 2HB CYS 104 2HB CYS 104 -6.589 0.057 -13.402
755 H LYS 105 H LYS 105 -7.490 3.144 -13.324
756 HA LYS 105 HA LYS 105 -4.735 4.049 -13.785
757 1HB LYS 105 1HB LYS 105 -5.303 2.835 -15.738
758 2HB LYS 105 2HB LYS 105 -6.924 3.495 -15.790
759 1HG LYS 105 1HG LYS 105 -5.599 5.831 -15.935
760 2HG LYS 105 2HG LYS 105 -4.314 4.807 -16.544
761 1HD LYS 105 1HD LYS 105 -7.074 4.429 -17.700
762 2HD LYS 105 2HD LYS 105 -6.182 5.861 -18.174
763 1HE LYS 105 1HE LYS 105 -4.278 4.465 -18.935
764 2HE LYS 105 2HE LYS 105 -5.089 3.014 -18.380
765 1HZ LYS 105 1HZ LYS 105 -6.875 3.520 -19.936
766 2HZ LYS 105 2HZ LYS 105 -6.056 4.822 -20.485
767 3HZ LYS 105 3HZ LYS 105 -5.447 3.322 -20.701
768 H GLY 106 H GLY 106 -4.392 6.223 -13.564
769 1HA GLY 106 2HA GLY 106 -6.515 8.125 -13.870
770 2HA GLY 106 1HA GLY 106 -4.863 8.431 -13.372
771 H SER 107 H SER 107 -4.607 6.757 -11.102
772 HA SER 107 HA SER 107 -6.685 7.858 -9.375
773 1HB SER 107 1HB SER 107 -6.056 5.951 -7.810
774 2HB SER 107 2HB SER 107 -6.842 5.467 -9.299
775 HG SER 107 HG SER 107 -4.922 4.179 -8.730
776 H ALA 108 H ALA 108 -5.690 7.875 -6.918
777 HA ALA 108 HA ALA 108 -3.586 9.784 -7.046
778 1HB ALA 108 1HB ALA 108 -4.244 10.265 -4.918
779 2HB ALA 108 3HB ALA 108 -5.660 9.275 -5.346
780 3HB ALA 108 2HB ALA 108 -4.309 8.552 -4.440
781 H CYS 109 H CYS 109 -3.618 6.424 -7.313
782 HA CYS 109 HA CYS 109 -1.064 6.157 -5.923
783 1HB CYS 109 1HB CYS 109 -3.034 4.070 -6.905
784 2HB CYS 109 2HB CYS 109 -1.449 3.685 -6.266
785 H HIS 110 H HIS 110 -2.802 5.571 -9.049
786 HA HIS 110 HA HIS 110 -0.169 5.500 -10.335
787 1HB HIS 110 1HB HIS 110 -2.732 4.121 -11.185
788 2HB HIS 110 2HB HIS 110 -1.240 4.132 -12.104
789 HD1 HIS 110 HD1 HIS 110 0.906 3.374 -10.177
790 HD2 HIS 110 HD2 HIS 110 -2.930 1.688 -9.987
791 HE1 HIS 110 HE1 HIS 110 1.157 1.164 -8.925
792 HA PRO 111 HA PRO 111 -2.215 9.212 -11.965
793 1HB PRO 111 1HB PRO 111 -0.282 11.010 -11.355
794 2HB PRO 111 2HB PRO 111 -1.369 10.353 -10.089
795 1HG PRO 111 1HG PRO 111 1.153 9.590 -11.113
796 2HG PRO 111 2HG PRO 111 1.189 9.601 -9.320
797 1HD PRO 111 1HD PRO 111 1.050 7.257 -10.610
798 2HD PRO 111 2HD PRO 111 -0.060 7.535 -9.234
799 H SER 112 H SER 112 -1.654 7.673 -13.955
800 HA SER 112 HA SER 112 -0.177 9.225 -15.717
801 1HB SER 112 1HB SER 112 1.453 7.486 -14.176
802 2HB SER 112 2HB SER 112 1.305 6.709 -15.739
803 HG SER 112 HG SER 112 2.623 8.169 -16.569
No H/Q in entry = 803
Start of MODEL 2
1 H1 VAL 1 H1 VAL 1 8.206 8.345 17.453
2 H2 VAL 1 H2 VAL 1 9.389 7.454 18.194
3 H3 VAL 1 H3 VAL 1 9.450 9.109 18.234
4 HA VAL 1 HA VAL 1 11.000 8.532 16.703
5 HB VAL 1 HB VAL 1 10.547 6.250 16.415
6 1HG1 VAL 1 1HG1 VAL 1 7.797 7.169 15.894
7 2HG1 VAL 1 2HG1 VAL 1 8.336 5.842 14.837
8 3HG1 VAL 1 3HG1 VAL 1 8.387 5.647 16.605
9 1HG2 VAL 1 1HG2 VAL 1 11.420 7.576 14.392
10 2HG2 VAL 1 2HG2 VAL 1 10.807 5.931 14.097
11 3HG2 VAL 1 3HG2 VAL 1 9.798 7.342 13.698
12 H ASP 2 H ASP 2 7.799 9.695 16.724
13 HA ASP 2 HA ASP 2 6.769 11.271 15.652
14 1HB ASP 2 1HB ASP 2 9.612 11.920 15.279
15 2HB ASP 2 2HB ASP 2 8.649 12.523 13.945
16 H VAL 3 H VAL 3 5.378 10.833 13.933
17 HA VAL 3 HA VAL 3 5.943 8.983 11.967
18 HB VAL 3 HB VAL 3 3.744 10.144 12.876
19 1HG1 VAL 3 1HG1 VAL 3 4.295 11.649 10.295
20 2HG1 VAL 3 2HG1 VAL 3 2.746 11.631 11.172
21 3HG1 VAL 3 3HG1 VAL 3 4.189 12.349 11.929
22 1HG2 VAL 3 1HG2 VAL 3 3.874 8.098 11.500
23 2HG2 VAL 3 2HG2 VAL 3 2.516 9.144 11.017
24 3HG2 VAL 3 3HG2 VAL 3 4.000 9.101 10.035
25 HA PRO 4 HA PRO 4 8.997 10.899 9.440
26 1HB PRO 4 2HB PRO 4 7.494 9.232 7.392
27 2HB PRO 4 1HB PRO 4 9.253 9.387 7.706
28 1HG PRO 4 1HG PRO 4 8.064 7.188 8.808
29 2HG PRO 4 2HG PRO 4 9.346 8.176 9.580
30 1HD PRO 4 2HD PRO 4 6.340 8.114 10.067
31 2HD PRO 4 1HD PRO 4 7.672 8.316 11.245
32 H ALA 5 H ALA 5 9.011 12.308 7.412
33 HA ALA 5 HA ALA 5 6.732 14.019 7.478
34 1HB ALA 5 1HB ALA 5 8.120 15.499 6.424
35 2HB ALA 5 3HB ALA 5 8.768 14.267 5.315
36 3HB ALA 5 2HB ALA 5 9.376 14.370 6.985
37 H ASP 6 H ASP 6 5.282 14.491 5.715
38 HA ASP 6 HA ASP 6 4.453 12.178 4.393
39 1HB ASP 6 1HB ASP 6 2.652 13.486 3.635
40 2HB ASP 6 2HB ASP 6 3.128 14.328 5.096
41 H GLY 7 H GLY 7 3.853 12.681 1.785
42 1HA GLY 7 2HA GLY 7 5.815 14.099 0.305
43 2HA GLY 7 1HA GLY 7 4.630 12.964 -0.311
44 H ALA 8 H ALA 8 5.282 10.590 1.074
45 HA ALA 8 HA ALA 8 8.115 10.161 0.513
46 1HB ALA 8 1HB ALA 8 5.986 8.634 2.046
47 2HB ALA 8 3HB ALA 8 7.461 9.404 2.678
48 3HB ALA 8 2HB ALA 8 7.581 7.939 1.674
49 H LYS 9 H LYS 9 8.665 9.449 -1.480
50 HA LYS 9 HA LYS 9 6.628 8.343 -3.179
51 1HB LYS 9 1HB LYS 9 7.959 8.999 -4.863
52 2HB LYS 9 2HB LYS 9 8.799 9.918 -3.631
53 1HG LYS 9 1HG LYS 9 10.091 7.569 -3.287
54 2HG LYS 9 2HG LYS 9 9.600 7.332 -4.953
55 1HD LYS 9 1HD LYS 9 10.546 9.952 -4.998
56 2HD LYS 9 2HD LYS 9 11.613 9.201 -3.828
57 1HE LYS 9 2HE LYS 9 11.122 8.313 -6.704
58 2HE LYS 9 1HE LYS 9 12.615 8.932 -6.029
59 1HZ LYS 9 1HZ LYS 9 11.351 6.485 -5.027
60 2HZ LYS 9 2HZ LYS 9 12.441 6.473 -6.243
61 3HZ LYS 9 3HZ LYS 9 12.876 7.003 -4.761
62 H ILE 10 H ILE 10 6.443 6.216 -3.899
63 HA ILE 10 HA ILE 10 8.226 4.320 -2.533
64 HB ILE 10 HB ILE 10 5.305 3.937 -3.194
65 1HG1 ILE 10 1HG1 ILE 10 6.410 4.245 -0.410
66 2HG1 ILE 10 2HG1 ILE 10 5.976 5.658 -1.352
67 1HG2 ILE 10 1HG2 ILE 10 7.454 2.167 -2.178
68 2HG2 ILE 10 2HG2 ILE 10 5.883 2.060 -1.349
69 3HG2 ILE 10 3HG2 ILE 10 5.984 1.786 -3.105
70 1HD1 ILE 10 1HD1 ILE 10 4.025 3.350 -1.116
71 2HD1 ILE 10 2HD1 ILE 10 4.158 4.556 0.186
72 3HD1 ILE 10 3HD1 ILE 10 3.691 5.066 -1.454
73 H ASP 11 H ASP 11 9.338 2.930 -3.822
74 HA ASP 11 HA ASP 11 8.268 2.151 -6.320
75 1HB ASP 11 1HB ASP 11 9.127 4.183 -7.205
76 2HB ASP 11 2HB ASP 11 10.531 4.158 -6.157
77 H PHE 12 H PHE 12 8.673 -0.010 -5.606
78 HA PHE 12 HA PHE 12 11.485 -0.623 -5.022
79 1HB PHE 12 1HB PHE 12 8.835 -1.962 -4.207
80 2HB PHE 12 2HB PHE 12 10.412 -2.593 -3.778
81 HD1 PHE 12 HD1 PHE 12 11.876 -0.197 -2.961
82 HD2 PHE 12 HD2 PHE 12 7.840 -1.286 -2.229
83 HE1 PHE 12 HE1 PHE 12 11.873 1.210 -0.882
84 HE2 PHE 12 HE2 PHE 12 7.838 0.120 -0.150
85 HZ PHE 12 HZ PHE 12 9.855 1.352 0.499
86 H ILE 13 H ILE 13 8.606 -1.305 -6.966
87 HA ILE 13 HA ILE 13 9.892 -3.645 -8.128
88 HB ILE 13 HB ILE 13 7.131 -2.461 -8.398
89 1HG1 ILE 13 1HG1 ILE 13 8.008 -5.102 -7.200
90 2HG1 ILE 13 2HG1 ILE 13 7.748 -3.647 -6.259
91 1HG2 ILE 13 1HG2 ILE 13 8.542 -4.129 -10.244
92 2HG2 ILE 13 2HG2 ILE 13 7.242 -5.080 -9.486
93 3HG2 ILE 13 3HG2 ILE 13 6.861 -3.549 -10.309
94 1HD1 ILE 13 1HD1 ILE 13 5.396 -3.566 -7.416
95 2HD1 ILE 13 2HD1 ILE 13 5.719 -5.268 -7.824
96 3HD1 ILE 13 3HD1 ILE 13 5.665 -4.756 -6.120
97 H ALA 14 H ALA 14 11.545 -2.982 -9.457
98 HA ALA 14 HA ALA 14 11.350 -0.630 -11.024
99 1HB ALA 14 1HB ALA 14 13.518 -1.327 -10.365
100 2HB ALA 14 2HB ALA 14 13.436 -1.702 -12.103
101 3HB ALA 14 3HB ALA 14 13.237 -3.000 -10.902
102 H GLY 15 H GLY 15 11.884 -0.923 -13.547
103 1HA GLY 15 2HA GLY 15 9.775 -1.426 -14.995
104 2HA GLY 15 1HA GLY 15 10.257 -3.082 -14.685
105 H GLY 16 H GLY 16 11.478 0.079 -15.950
106 1HA GLY 16 2HA GLY 16 12.744 -1.250 -18.165
107 2HA GLY 16 1HA GLY 16 13.889 -0.627 -16.994
108 H GLU 17 H GLU 17 12.174 0.120 -19.793
109 HA GLU 17 HA GLU 17 13.147 2.561 -20.154
110 1HB GLU 17 1HB GLU 17 11.922 1.328 -21.884
111 2HB GLU 17 2HB GLU 17 10.412 1.526 -21.017
112 1HG GLU 17 1HG GLU 17 10.987 4.124 -21.196
113 2HG GLU 17 2HG GLU 17 12.024 3.607 -22.510
114 H LYS 18 H LYS 18 10.436 1.670 -18.048
115 HA LYS 18 HA LYS 18 10.444 4.380 -17.014
116 1HB LYS 18 2HB LYS 18 8.097 4.728 -17.217
117 2HB LYS 18 1HB LYS 18 8.703 4.321 -18.810
118 1HG LYS 18 1HG LYS 18 7.753 2.155 -18.774
119 2HG LYS 18 2HG LYS 18 7.679 2.102 -17.024
120 1HD LYS 18 1HD LYS 18 5.644 3.157 -16.948
121 2HD LYS 18 2HD LYS 18 6.087 4.317 -18.185
122 1HE LYS 18 1HE LYS 18 5.946 1.929 -19.629
123 2HE LYS 18 2HE LYS 18 4.662 1.732 -18.453
124 1HZ LYS 18 1HZ LYS 18 4.878 4.273 -19.843
125 2HZ LYS 18 2HZ LYS 18 4.254 2.997 -20.650
126 3HZ LYS 18 3HZ LYS 18 3.549 3.516 -19.271
127 H ASN 19 H ASN 19 8.044 3.851 -15.379
128 HA ASN 19 HA ASN 19 8.078 1.487 -14.074
129 1HB ASN 19 1HB ASN 19 9.382 2.457 -11.912
130 2HB ASN 19 2HB ASN 19 10.221 1.548 -13.154
131 2HD2 ASN 19 2HD2 ASN 19 9.036 4.877 -12.666
132 1HD2 ASN 19 1HD2 ASN 19 10.481 5.697 -13.156
133 H LEU 20 H LEU 20 6.261 1.599 -12.700
134 HA LEU 20 HA LEU 20 4.984 4.135 -12.421
135 1HB LEU 20 1HB LEU 20 4.319 1.326 -11.563
136 2HB LEU 20 2HB LEU 20 3.324 2.697 -11.115
137 HG LEU 20 HG LEU 20 3.851 1.596 -13.876
138 1HD1 LEU 20 1HD1 LEU 20 1.508 1.761 -12.026
139 2HD1 LEU 20 2HD1 LEU 20 1.222 1.822 -13.782
140 3HD1 LEU 20 3HD1 LEU 20 2.061 0.426 -13.065
141 1HD2 LEU 20 1HD2 LEU 20 3.117 4.358 -13.091
142 2HD2 LEU 20 2HD2 LEU 20 3.910 3.746 -14.562
143 3HD2 LEU 20 3HD2 LEU 20 2.143 3.620 -14.385
144 H THR 21 H THR 21 4.886 5.484 -10.661
145 HA THR 21 HA THR 21 6.218 4.523 -8.218
146 HB THR 21 HB THR 21 6.441 7.371 -9.275
147 HG1 THR 21 HG1 THR 21 8.281 6.579 -10.436
148 1HG2 THR 21 1HG2 THR 21 7.773 5.645 -7.203
149 2HG2 THR 21 2HG2 THR 21 8.835 6.718 -8.146
150 3HG2 THR 21 3HG2 THR 21 7.494 7.403 -7.197
151 H VAL 22 H VAL 22 4.912 4.523 -6.509
152 HA VAL 22 HA VAL 22 2.506 6.167 -6.684
153 HB VAL 22 HB VAL 22 3.292 3.843 -4.917
154 1HG1 VAL 22 1HG1 VAL 22 1.819 5.493 -3.757
155 2HG1 VAL 22 2HG1 VAL 22 0.613 5.266 -5.046
156 3HG1 VAL 22 3HG1 VAL 22 1.059 3.901 -3.995
157 1HG2 VAL 22 1HG2 VAL 22 2.421 3.837 -7.545
158 2HG2 VAL 22 2HG2 VAL 22 2.302 2.480 -6.399
159 3HG2 VAL 22 3HG2 VAL 22 0.921 3.581 -6.622
160 H VAL 23 H VAL 23 1.870 7.552 -4.916
161 HA VAL 23 HA VAL 23 4.177 8.377 -3.294
162 HB VAL 23 HB VAL 23 1.908 9.939 -4.525
163 1HG1 VAL 23 1HG1 VAL 23 3.775 10.685 -2.278
164 2HG1 VAL 23 2HG1 VAL 23 3.142 11.924 -3.389
165 3HG1 VAL 23 3HG1 VAL 23 2.019 10.940 -2.419
166 1HG2 VAL 23 1HG2 VAL 23 4.866 9.735 -4.959
167 2HG2 VAL 23 2HG2 VAL 23 3.542 9.859 -6.142
168 3HG2 VAL 23 3HG2 VAL 23 4.066 11.300 -5.237
169 H PHE 24 H PHE 24 3.863 8.741 -1.068
170 HA PHE 24 HA PHE 24 1.201 8.012 -0.078
171 1HB PHE 24 1HB PHE 24 3.010 6.174 0.054
172 2HB PHE 24 2HB PHE 24 3.963 7.255 1.050
173 HD1 PHE 24 HD1 PHE 24 0.359 6.248 1.045
174 HD2 PHE 24 HD2 PHE 24 3.975 6.573 3.243
175 HE1 PHE 24 HE1 PHE 24 -0.809 5.391 3.094
176 HE2 PHE 24 HE2 PHE 24 2.806 5.715 5.292
177 HZ PHE 24 HZ PHE 24 0.428 5.134 5.193
178 H ASN 25 H ASN 25 1.091 8.572 2.416
179 HA ASN 25 HA ASN 25 2.774 10.702 3.214
180 1HB ASN 25 1HB ASN 25 0.303 11.998 3.517
181 2HB ASN 25 2HB ASN 25 1.525 12.409 2.331
182 2HD2 ASN 25 2HD2 ASN 25 1.237 11.966 0.220
183 1HD2 ASN 25 1HD2 ASN 25 -0.194 11.273 -0.467
184 H HIS 26 H HIS 26 2.913 10.384 5.443
185 HA HIS 26 HA HIS 26 1.060 8.637 6.706
186 1HB HIS 26 1HB HIS 26 3.576 10.060 7.459
187 2HB HIS 26 2HB HIS 26 2.526 9.526 8.756
188 HD1 HIS 26 HD1 HIS 26 4.544 8.153 5.840
189 HD2 HIS 26 HD2 HIS 26 2.582 6.796 9.291
190 HE1 HIS 26 HE1 HIS 26 5.203 5.704 6.121
191 H SER 27 H SER 27 1.027 11.954 5.928
192 HA SER 27 HA SER 27 -0.464 12.667 8.291
193 1HB SER 27 1HB SER 27 -0.421 14.961 7.334
194 2HB SER 27 2HB SER 27 1.188 14.279 7.462
195 HG SER 27 HG SER 27 1.155 13.798 5.202
196 H THR 28 H THR 28 -1.371 10.709 6.077
197 HA THR 28 HA THR 28 -3.868 12.123 5.400
198 HB THR 28 HB THR 28 -2.156 10.143 3.821
199 HG1 THR 28 HG1 THR 28 -1.636 12.164 3.077
200 1HG2 THR 28 1HG2 THR 28 -4.804 9.809 3.750
201 2HG2 THR 28 2HG2 THR 28 -4.763 11.325 2.819
202 3HG2 THR 28 3HG2 THR 28 -3.885 9.894 2.228
203 H HIS 29 H HIS 29 -2.282 9.106 6.489
204 HA HIS 29 HA HIS 29 -4.940 8.039 7.049
205 1HB HIS 29 2HB HIS 29 -2.263 6.621 7.090
206 2HB HIS 29 1HB HIS 29 -3.840 5.878 7.271
207 HD1 HIS 29 HD1 HIS 29 -1.585 7.460 4.680
208 HD2 HIS 29 HD2 HIS 29 -5.255 5.439 4.882
209 HE1 HIS 29 HE1 HIS 29 -2.220 6.890 2.276
210 H LYS 30 H LYS 30 -3.513 10.257 8.547
211 HA LYS 30 HA LYS 30 -2.435 9.308 10.915
212 1HB LYS 30 1HB LYS 30 -2.913 11.545 11.788
213 2HB LYS 30 2HB LYS 30 -2.223 11.615 10.179
214 1HG LYS 30 1HG LYS 30 -4.537 11.859 9.219
215 2HG LYS 30 2HG LYS 30 -5.198 11.840 10.842
216 1HD LYS 30 1HD LYS 30 -5.016 14.155 10.306
217 2HD LYS 30 2HD LYS 30 -3.648 13.844 11.356
218 1HE LYS 30 1HE LYS 30 -2.858 13.276 8.623
219 2HE LYS 30 2HE LYS 30 -3.617 14.855 8.666
220 1HZ LYS 30 1HZ LYS 30 -1.536 14.055 10.572
221 2HZ LYS 30 2HZ LYS 30 -1.205 14.810 9.162
222 3HZ LYS 30 3HZ LYS 30 -2.107 15.560 10.298
223 H ASP 31 H ASP 31 -5.677 9.137 9.683
224 HA ASP 31 HA ASP 31 -6.830 8.955 12.298
225 1HB ASP 31 1HB ASP 31 -8.305 9.923 10.726
226 2HB ASP 31 2HB ASP 31 -7.832 8.819 9.450
227 H VAL 32 H VAL 32 -4.931 6.972 10.389
228 HA VAL 32 HA VAL 32 -6.367 4.537 11.191
229 HB VAL 32 HB VAL 32 -4.307 4.917 9.009
230 1HG1 VAL 32 1HG1 VAL 32 -4.896 2.603 10.293
231 2HG1 VAL 32 2HG1 VAL 32 -6.139 2.582 9.018
232 3HG1 VAL 32 3HG1 VAL 32 -4.417 2.693 8.581
233 1HG2 VAL 32 1HG2 VAL 32 -6.769 5.962 8.861
234 2HG2 VAL 32 2HG2 VAL 32 -5.952 5.231 7.458
235 3HG2 VAL 32 3HG2 VAL 32 -7.155 4.293 8.376
236 H LYS 33 H LYS 33 -5.433 3.232 12.698
237 HA LYS 33 HA LYS 33 -3.325 4.089 14.225
238 1HB LYS 33 1HB LYS 33 -4.398 1.289 13.781
239 2HB LYS 33 2HB LYS 33 -3.265 1.717 15.046
240 1HG LYS 33 1HG LYS 33 -5.898 3.209 14.718
241 2HG LYS 33 2HG LYS 33 -5.808 1.715 15.631
242 1HD LYS 33 2HD LYS 33 -5.025 2.845 17.431
243 2HD LYS 33 1HD LYS 33 -3.624 3.361 16.513
244 1HE LYS 33 1HE LYS 33 -4.973 5.279 15.582
245 2HE LYS 33 2HE LYS 33 -6.332 4.779 16.568
246 1HZ LYS 33 1HZ LYS 33 -4.438 4.906 18.390
247 2HZ LYS 33 2HZ LYS 33 -3.882 6.051 17.366
248 3HZ LYS 33 3HZ LYS 33 -5.380 6.182 18.002
249 H CYS 34 H CYS 34 -1.130 3.100 14.507
250 HA CYS 34 HA CYS 34 0.200 3.152 12.005
251 1HB CYS 34 2HB CYS 34 1.400 2.339 14.651
252 2HB CYS 34 1HB CYS 34 2.218 3.000 13.249
253 H ASP 35 H ASP 35 -0.647 0.673 14.497
254 HA ASP 35 HA ASP 35 0.736 -1.408 13.296
255 1HB ASP 35 1HB ASP 35 -0.833 -2.864 14.651
256 2HB ASP 35 2HB ASP 35 -0.020 -1.622 15.582
257 H ASP 36 H ASP 36 -1.969 0.394 12.252
258 HA ASP 36 HA ASP 36 -3.621 -1.577 11.232
259 1HB ASP 36 1HB ASP 36 -3.871 1.061 11.465
260 2HB ASP 36 2HB ASP 36 -3.210 1.085 9.842
261 H CYS 37 H CYS 37 -0.459 -0.435 10.321
262 HA CYS 37 HA CYS 37 -0.685 -1.898 7.799
263 1HB CYS 37 1HB CYS 37 0.693 0.774 8.212
264 2HB CYS 37 2HB CYS 37 0.934 -0.243 6.805
265 H HIS 38 H HIS 38 1.460 -0.436 10.339
266 HA HIS 38 HA HIS 38 3.603 -2.198 9.689
267 1HB HIS 38 1HB HIS 38 3.185 -0.343 12.050
268 2HB HIS 38 2HB HIS 38 4.678 -1.182 11.677
269 HD1 HIS 38 HD1 HIS 38 5.764 -0.529 9.225
270 HD2 HIS 38 HD2 HIS 38 2.928 2.108 10.838
271 HE1 HIS 38 HE1 HIS 38 6.059 1.682 7.988
272 H HIS 39 H HIS 39 2.834 -4.339 9.873
273 HA HIS 39 HA HIS 39 1.901 -5.075 12.544
274 1HB HIS 39 1HB HIS 39 0.735 -6.849 11.597
275 2HB HIS 39 2HB HIS 39 0.504 -5.544 10.450
276 HD1 HIS 39 HD1 HIS 39 1.424 -9.027 10.590
277 HD2 HIS 39 HD2 HIS 39 2.518 -5.765 8.191
278 HE1 HIS 39 HE1 HIS 39 2.450 -10.010 8.470
279 H GLN 40 H GLN 40 4.601 -4.479 12.400
280 HA GLN 40 HA GLN 40 5.841 -7.101 12.149
281 1HB GLN 40 1HB GLN 40 6.874 -4.277 11.879
282 2HB GLN 40 2HB GLN 40 7.991 -5.541 12.353
283 1HG GLN 40 1HG GLN 40 7.678 -5.030 9.798
284 2HG GLN 40 2HG GLN 40 7.772 -6.701 10.316
285 2HE2 GLN 40 2HE2 GLN 40 5.945 -7.990 10.370
286 1HE2 GLN 40 1HE2 GLN 40 4.475 -7.589 9.545
287 HA PRO 41 HA PRO 41 6.227 -7.074 16.560
288 1HB PRO 41 1HB PRO 41 7.388 -9.459 16.903
289 2HB PRO 41 2HB PRO 41 5.787 -9.365 16.099
290 1HG PRO 41 1HG PRO 41 8.530 -9.407 14.748
291 2HG PRO 41 2HG PRO 41 7.187 -10.519 14.325
292 1HD PRO 41 1HD PRO 41 7.683 -8.209 12.923
293 2HD PRO 41 2HD PRO 41 6.013 -8.787 13.208
294 H GLY 42 H GLY 42 7.880 -6.668 18.179
295 1HA GLY 42 2HA GLY 42 10.637 -6.535 17.153
296 2HA GLY 42 1HA GLY 42 10.147 -6.621 18.834
297 H ASP 43 H ASP 43 11.662 -4.708 19.024
298 HA ASP 43 HA ASP 43 10.234 -2.409 19.364
299 1HB ASP 43 1HB ASP 43 12.700 -3.235 20.085
300 2HB ASP 43 2HB ASP 43 13.178 -2.240 18.724
301 H LYS 44 H LYS 44 11.539 -3.859 16.480
302 HA LYS 44 HA LYS 44 11.694 -1.334 15.052
303 1HB LYS 44 1HB LYS 44 12.515 -4.169 14.470
304 2HB LYS 44 2HB LYS 44 12.325 -3.025 13.156
305 1HG LYS 44 1HG LYS 44 13.983 -1.524 14.093
306 2HG LYS 44 2HG LYS 44 14.004 -2.388 15.618
307 1HD LYS 44 1HD LYS 44 14.780 -4.458 14.227
308 2HD LYS 44 2HD LYS 44 15.087 -3.319 12.931
309 1HE LYS 44 1HE LYS 44 16.367 -1.995 14.921
310 2HE LYS 44 2HE LYS 44 16.495 -3.616 15.575
311 1HZ LYS 44 1HZ LYS 44 17.100 -3.635 12.839
312 2HZ LYS 44 2HZ LYS 44 18.021 -2.515 13.590
313 3HZ LYS 44 3HZ LYS 44 18.045 -4.067 14.099
314 H GLN 45 H GLN 45 9.130 -1.975 16.145
315 HA GLN 45 HA GLN 45 7.409 -3.376 14.694
316 1HB GLN 45 1HB GLN 45 6.951 -1.885 16.714
317 2HB GLN 45 2HB GLN 45 6.832 -0.528 15.612
318 1HG GLN 45 2HG GLN 45 4.606 -1.110 15.583
319 2HG GLN 45 1HG GLN 45 5.136 -2.230 14.344
320 2HE2 GLN 45 2HE2 GLN 45 3.087 -3.233 15.173
321 1HE2 GLN 45 1HE2 GLN 45 3.214 -4.406 16.441
322 H TYR 46 H TYR 46 9.082 -0.466 13.734
323 HA TYR 46 HA TYR 46 7.524 -0.345 11.202
324 1HB TYR 46 1HB TYR 46 9.484 1.706 12.252
325 2HB TYR 46 2HB TYR 46 8.236 1.912 11.012
326 HD1 TYR 46 HD1 TYR 46 5.854 2.085 11.642
327 HD2 TYR 46 HD2 TYR 46 8.958 1.844 14.600
328 HE1 TYR 46 HE1 TYR 46 4.268 2.888 13.371
329 HE2 TYR 46 HE2 TYR 46 7.373 2.647 16.330
330 HH TYR 46 HH TYR 46 4.452 4.109 15.696
331 H ALA 47 H ALA 47 8.523 -1.901 9.858
332 HA ALA 47 HA ALA 47 11.346 -1.327 9.314
333 1HB ALA 47 1HB ALA 47 10.530 -3.534 10.739
334 2HB ALA 47 3HB ALA 47 10.524 -4.160 9.072
335 3HB ALA 47 2HB ALA 47 12.009 -3.453 9.752
336 H GLY 48 H GLY 48 11.842 -2.896 7.183
337 1HA GLY 48 2HA GLY 48 11.576 -2.839 4.939
338 2HA GLY 48 1HA GLY 48 10.256 -1.701 5.130
339 H CYS 49 H CYS 49 8.780 -2.672 3.699
340 HA CYS 49 HA CYS 49 7.425 -4.948 4.778
341 1HB CYS 49 1HB CYS 49 6.845 -3.576 2.156
342 2HB CYS 49 2HB CYS 49 5.762 -4.549 3.131
343 H THR 50 H THR 50 9.707 -4.127 2.161
344 HA THR 50 HA THR 50 9.445 -6.774 0.979
345 HB THR 50 HB THR 50 11.074 -5.757 -0.676
346 HG1 THR 50 HG1 THR 50 11.514 -3.450 -0.215
347 1HG2 THR 50 1HG2 THR 50 8.643 -4.044 0.060
348 2HG2 THR 50 2HG2 THR 50 9.597 -3.828 -1.427
349 3HG2 THR 50 3HG2 THR 50 8.696 -5.339 -1.160
350 H THR 51 H THR 51 10.510 -6.195 3.812
351 HA THR 51 HA THR 51 13.287 -6.746 3.719
352 HB THR 51 HB THR 51 11.290 -7.258 5.979
353 HG1 THR 51 HG1 THR 51 12.724 -4.887 5.006
354 1HG2 THR 51 1HG2 THR 51 14.271 -6.829 5.742
355 2HG2 THR 51 2HG2 THR 51 13.434 -6.091 7.129
356 3HG2 THR 51 3HG2 THR 51 13.370 -7.853 6.885
357 H ASP 52 H ASP 52 14.387 -8.701 4.433
358 HA ASP 52 HA ASP 52 13.637 -10.859 2.949
359 1HB ASP 52 1HB ASP 52 15.766 -10.147 4.643
360 2HB ASP 52 2HB ASP 52 15.115 -11.587 5.400
361 H GLY 53 H GLY 53 12.853 -13.046 3.678
362 1HA GLY 53 2HA GLY 53 11.934 -13.649 6.228
363 2HA GLY 53 1HA GLY 53 11.391 -14.386 4.733
364 H CYS 54 H CYS 54 10.639 -11.442 3.836
365 HA CYS 54 HA CYS 54 8.047 -11.510 5.191
366 1HB CYS 54 2HB CYS 54 9.465 -8.935 4.456
367 2HB CYS 54 1HB CYS 54 7.971 -9.116 5.352
368 H HIS 55 H HIS 55 7.875 -8.865 3.303
369 HA HIS 55 HA HIS 55 6.873 -10.407 1.060
370 1HB HIS 55 2HB HIS 55 6.588 -7.433 1.517
371 2HB HIS 55 1HB HIS 55 5.628 -8.462 0.472
372 HD1 HIS 55 HD1 HIS 55 4.053 -10.282 1.763
373 HD2 HIS 55 HD2 HIS 55 5.613 -7.154 4.081
374 HE1 HIS 55 HE1 HIS 55 2.654 -10.206 3.895
375 H ASN 56 H ASN 56 9.614 -10.586 1.154
376 HA ASN 56 HA ASN 56 10.710 -8.462 -0.411
377 1HB ASN 56 1HB ASN 56 12.048 -9.665 1.353
378 2HB ASN 56 2HB ASN 56 11.902 -11.154 0.441
379 2HD2 ASN 56 2HD2 ASN 56 14.291 -9.776 1.215
380 1HD2 ASN 56 1HD2 ASN 56 15.166 -9.351 -0.218
381 H ILE 57 H ILE 57 8.905 -9.052 -2.135
382 HA ILE 57 HA ILE 57 10.089 -10.993 -3.981
383 HB ILE 57 HB ILE 57 7.134 -10.721 -3.424
384 1HG1 ILE 57 1HG1 ILE 57 8.681 -11.817 -1.626
385 2HG1 ILE 57 2HG1 ILE 57 7.181 -12.594 -2.092
386 1HG2 ILE 57 1HG2 ILE 57 8.738 -12.458 -5.304
387 2HG2 ILE 57 2HG2 ILE 57 7.073 -12.848 -4.810
388 3HG2 ILE 57 3HG2 ILE 57 7.411 -11.335 -5.685
389 1HD1 ILE 57 1HD1 ILE 57 9.836 -13.250 -3.435
390 2HD1 ILE 57 2HD1 ILE 57 9.243 -14.115 -1.997
391 3HD1 ILE 57 3HD1 ILE 57 8.316 -14.173 -3.517
392 H LEU 58 H LEU 58 10.862 -9.762 -5.614
393 HA LEU 58 HA LEU 58 9.284 -7.414 -6.368
394 1HB LEU 58 1HB LEU 58 12.162 -8.138 -6.934
395 2HB LEU 58 2HB LEU 58 11.351 -6.699 -7.519
396 HG LEU 58 HG LEU 58 11.967 -7.402 -4.639
397 1HD1 LEU 58 1HD1 LEU 58 13.277 -5.770 -6.699
398 2HD1 LEU 58 2HD1 LEU 58 13.032 -4.928 -5.150
399 3HD1 LEU 58 3HD1 LEU 58 13.923 -6.468 -5.195
400 1HD2 LEU 58 1HD2 LEU 58 9.950 -5.595 -5.751
401 2HD2 LEU 58 2HD2 LEU 58 10.156 -6.215 -4.095
402 3HD2 LEU 58 3HD2 LEU 58 11.081 -4.793 -4.634
403 H ASP 59 H ASP 59 8.682 -10.325 -6.994
404 HA ASP 59 HA ASP 59 8.915 -10.083 -9.891
405 1HB ASP 59 1HB ASP 59 9.590 -12.226 -8.144
406 2HB ASP 59 2HB ASP 59 8.109 -12.731 -8.934
407 H LYS 60 H LYS 60 6.907 -8.696 -9.756
408 HA LYS 60 HA LYS 60 4.569 -9.355 -8.539
409 1HB LYS 60 1HB LYS 60 3.507 -7.855 -10.053
410 2HB LYS 60 2HB LYS 60 5.119 -7.239 -9.754
411 1HG LYS 60 1HG LYS 60 5.325 -9.031 -11.985
412 2HG LYS 60 2HG LYS 60 3.919 -8.026 -12.277
413 1HD LYS 60 1HD LYS 60 5.166 -6.045 -12.351
414 2HD LYS 60 2HD LYS 60 6.419 -6.661 -11.292
415 1HE LYS 60 1HE LYS 60 7.402 -7.991 -13.051
416 2HE LYS 60 2HE LYS 60 5.998 -7.806 -14.083
417 1HZ LYS 60 1HZ LYS 60 7.171 -5.329 -13.291
418 2HZ LYS 60 2HZ LYS 60 8.172 -6.265 -14.179
419 3HZ LYS 60 3HZ LYS 60 6.712 -5.837 -14.774
420 H ALA 61 H ALA 61 2.722 -10.594 -9.028
421 HA ALA 61 HA ALA 61 1.490 -12.146 -10.058
422 1HB ALA 61 1HB ALA 61 3.459 -12.701 -12.238
423 2HB ALA 61 3HB ALA 61 1.691 -12.512 -12.315
424 3HB ALA 61 2HB ALA 61 2.734 -11.075 -12.197
425 H ASP 62 H ASP 62 3.098 -12.717 -7.888
426 HA ASP 62 HA ASP 62 4.412 -15.200 -8.622
427 1HB ASP 62 1HB ASP 62 5.644 -13.457 -7.248
428 2HB ASP 62 2HB ASP 62 4.457 -13.672 -5.977
429 H LYS 63 H LYS 63 4.169 -16.909 -6.633
430 HA LYS 63 HA LYS 63 1.347 -16.880 -5.814
431 1HB LYS 63 1HB LYS 63 2.312 -18.566 -7.679
432 2HB LYS 63 2HB LYS 63 2.723 -19.486 -6.246
433 1HG LYS 63 1HG LYS 63 0.535 -19.969 -5.772
434 2HG LYS 63 2HG LYS 63 -0.003 -18.339 -6.124
435 1HD LYS 63 1HD LYS 63 -0.521 -18.833 -8.310
436 2HD LYS 63 2HD LYS 63 0.886 -19.857 -8.523
437 1HE LYS 63 1HE LYS 63 -1.587 -20.685 -6.931
438 2HE LYS 63 2HE LYS 63 -1.334 -21.093 -8.616
439 1HZ LYS 63 1HZ LYS 63 0.563 -21.791 -6.486
440 2HZ LYS 63 2HZ LYS 63 -0.599 -22.800 -7.032
441 3HZ LYS 63 3HZ LYS 63 0.593 -22.309 -8.034
442 H SER 64 H SER 64 2.043 -15.800 -3.842
443 HA SER 64 HA SER 64 2.501 -17.608 -1.804
444 1HB SER 64 1HB SER 64 4.874 -17.302 -2.970
445 2HB SER 64 2HB SER 64 4.907 -15.798 -2.071
446 HG SER 64 HG SER 64 5.850 -17.341 -0.735
447 H VAL 65 H VAL 65 2.685 -16.432 0.364
448 HA VAL 65 HA VAL 65 1.223 -13.939 0.154
449 HB VAL 65 HB VAL 65 0.349 -15.613 1.619
450 1HG1 VAL 65 1HG1 VAL 65 3.163 -15.957 2.370
451 2HG1 VAL 65 2HG1 VAL 65 2.063 -15.908 3.768
452 3HG1 VAL 65 3HG1 VAL 65 1.800 -17.097 2.471
453 1HG2 VAL 65 1HG2 VAL 65 0.652 -13.041 2.320
454 2HG2 VAL 65 2HG2 VAL 65 -0.157 -14.234 3.364
455 3HG2 VAL 65 3HG2 VAL 65 1.543 -13.798 3.661
456 H ASN 66 H ASN 66 3.915 -13.826 -0.813
457 HA ASN 66 HA ASN 66 5.019 -12.093 1.250
458 1HB ASN 66 1HB ASN 66 6.624 -13.862 -0.670
459 2HB ASN 66 2HB ASN 66 7.308 -12.790 0.535
460 2HD2 ASN 66 2HD2 ASN 66 6.361 -13.122 2.803
461 1HD2 ASN 66 1HD2 ASN 66 6.261 -14.755 3.370
462 H SER 67 H SER 67 3.417 -12.122 -1.556
463 HA SER 67 HA SER 67 5.192 -10.716 -3.259
464 1HB SER 67 1HB SER 67 2.744 -10.239 -4.349
465 2HB SER 67 2HB SER 67 3.638 -11.724 -4.601
466 HG SER 67 HG SER 67 1.478 -12.197 -3.939
467 H TRP 68 H TRP 68 5.383 -8.478 -3.565
468 HA TRP 68 HA TRP 68 4.068 -6.849 -1.545
469 1HB TRP 68 1HB TRP 68 6.369 -6.478 -1.598
470 2HB TRP 68 2HB TRP 68 6.441 -6.492 -3.349
471 HD1 TRP 68 HD1 TRP 68 6.556 -4.113 -4.429
472 HE1 TRP 68 HE1 TRP 68 6.057 -1.612 -3.754
473 HE3 TRP 68 HE3 TRP 68 4.569 -5.187 0.127
474 HZ2 TRP 68 HZ2 TRP 68 4.913 -0.390 -1.442
475 HZ3 TRP 68 HZ3 TRP 68 3.785 -3.282 1.530
476 HH2 TRP 68 HH2 TRP 68 3.932 -0.950 0.812
477 H TYR 69 H TYR 69 3.002 -8.139 -4.182
478 HA TYR 69 HA TYR 69 1.853 -5.631 -5.318
479 1HB TYR 69 1HB TYR 69 3.276 -6.750 -6.930
480 2HB TYR 69 2HB TYR 69 2.475 -8.300 -6.623
481 HD1 TYR 69 HD1 TYR 69 -0.012 -8.508 -7.203
482 HD2 TYR 69 HD2 TYR 69 2.466 -5.278 -8.575
483 HE1 TYR 69 HE1 TYR 69 -1.644 -8.022 -9.006
484 HE2 TYR 69 HE2 TYR 69 0.833 -4.791 -10.377
485 HH TYR 69 HH TYR 69 -0.990 -5.890 -11.636
486 H LYS 70 H LYS 70 1.234 -8.456 -3.451
487 HA LYS 70 HA LYS 70 -1.544 -8.532 -4.359
488 1HB LYS 70 1HB LYS 70 -0.051 -10.626 -4.138
489 2HB LYS 70 2HB LYS 70 -0.244 -10.434 -2.407
490 1HG LYS 70 1HG LYS 70 -2.861 -10.155 -3.277
491 2HG LYS 70 2HG LYS 70 -2.231 -11.295 -4.449
492 1HD LYS 70 2HD LYS 70 -2.234 -11.591 -1.413
493 2HD LYS 70 1HD LYS 70 -3.126 -12.560 -2.570
494 1HE LYS 70 1HE LYS 70 -1.187 -13.696 -3.325
495 2HE LYS 70 2HE LYS 70 -0.106 -12.430 -2.777
496 1HZ LYS 70 1HZ LYS 70 -0.688 -13.040 -0.504
497 2HZ LYS 70 2HZ LYS 70 -1.619 -14.264 -1.051
498 3HZ LYS 70 3HZ LYS 70 -0.007 -14.286 -1.310
499 H VAL 71 H VAL 71 0.536 -8.076 -1.441
500 HA VAL 71 HA VAL 71 -1.610 -7.606 0.308
501 HB VAL 71 HB VAL 71 0.141 -6.671 1.768
502 1HG1 VAL 71 1HG1 VAL 71 0.658 -9.291 0.351
503 2HG1 VAL 71 2HG1 VAL 71 1.633 -8.758 1.742
504 3HG1 VAL 71 3HG1 VAL 71 -0.120 -9.009 1.927
505 1HG2 VAL 71 1HG2 VAL 71 1.455 -5.563 -0.049
506 2HG2 VAL 71 2HG2 VAL 71 2.445 -6.526 1.073
507 3HG2 VAL 71 3HG2 VAL 71 2.049 -7.168 -0.539
508 H VAL 72 H VAL 72 -0.534 -5.856 -2.388
509 HA VAL 72 HA VAL 72 -1.395 -3.311 -1.217
510 HB VAL 72 HB VAL 72 0.187 -3.988 -3.701
511 1HG1 VAL 72 1HG1 VAL 72 -1.019 -1.396 -2.754
512 2HG1 VAL 72 2HG1 VAL 72 0.500 -1.397 -3.682
513 3HG1 VAL 72 3HG1 VAL 72 -0.976 -2.096 -4.391
514 1HG2 VAL 72 1HG2 VAL 72 1.078 -3.894 -1.135
515 2HG2 VAL 72 2HG2 VAL 72 2.072 -3.489 -2.555
516 3HG2 VAL 72 3HG2 VAL 72 1.289 -2.194 -1.617
517 H HIS 73 H HIS 73 -1.865 -5.555 -4.015
518 HA HIS 73 HA HIS 73 -4.345 -4.116 -4.580
519 1HB HIS 73 2HB HIS 73 -2.861 -6.088 -6.337
520 2HB HIS 73 1HB HIS 73 -4.249 -5.118 -6.789
521 HD1 HIS 73 HD1 HIS 73 -0.537 -4.879 -6.152
522 HD2 HIS 73 HD2 HIS 73 -3.693 -2.423 -7.419
523 HE1 HIS 73 HE1 HIS 73 0.535 -2.752 -7.068
524 H ASP 74 H ASP 74 -4.056 -5.890 -2.275
525 HA ASP 74 HA ASP 74 -5.246 -8.357 -3.068
526 1HB ASP 74 1HB ASP 74 -4.012 -7.201 -0.681
527 2HB ASP 74 2HB ASP 74 -5.519 -7.986 -0.256
528 H ALA 75 H ALA 75 -7.423 -8.241 -3.688
529 HA ALA 75 HA ALA 75 -9.136 -6.233 -2.546
530 1HB ALA 75 1HB ALA 75 -9.100 -8.073 -4.837
531 2HB ALA 75 3HB ALA 75 -10.697 -7.970 -4.058
532 3HB ALA 75 2HB ALA 75 -9.901 -6.494 -4.655
533 H LYS 76 H LYS 76 -8.330 -9.645 -2.062
534 HA LYS 76 HA LYS 76 -10.713 -10.233 -0.605
535 1HB LYS 76 1HB LYS 76 -9.188 -11.839 -1.928
536 2HB LYS 76 2HB LYS 76 -8.135 -11.802 -0.528
537 1HG LYS 76 1HG LYS 76 -10.321 -12.337 0.844
538 2HG LYS 76 2HG LYS 76 -10.996 -12.805 -0.704
539 1HD LYS 76 1HD LYS 76 -9.804 -14.748 -0.761
540 2HD LYS 76 2HD LYS 76 -8.312 -13.945 -0.314
541 1HE LYS 76 1HE LYS 76 -8.487 -14.767 1.791
542 2HE LYS 76 2HE LYS 76 -10.000 -13.911 2.010
543 1HZ LYS 76 1HZ LYS 76 -10.616 -16.049 0.446
544 2HZ LYS 76 2HZ LYS 76 -9.577 -16.655 1.550
545 3HZ LYS 76 3HZ LYS 76 -10.934 -15.891 2.040
546 H GLY 77 H GLY 77 -10.869 -10.627 1.697
547 1HA GLY 77 2HA GLY 77 -10.648 -9.882 3.813
548 2HA GLY 77 1HA GLY 77 -9.578 -8.619 3.238
549 H GLY 78 H GLY 78 -9.392 -10.432 5.652
550 1HA GLY 78 2HA GLY 78 -6.651 -11.372 5.138
551 2HA GLY 78 1HA GLY 78 -7.823 -12.470 5.838
552 H ALA 79 H ALA 79 -5.606 -11.984 7.346
553 HA ALA 79 HA ALA 79 -6.551 -11.223 9.772
554 1HB ALA 79 1HB ALA 79 -4.057 -10.794 10.271
555 2HB ALA 79 3HB ALA 79 -4.495 -12.399 9.637
556 3HB ALA 79 2HB ALA 79 -3.773 -11.182 8.558
557 H LYS 80 H LYS 80 -5.619 -9.190 7.051
558 HA LYS 80 HA LYS 80 -6.611 -6.896 8.449
559 1HB LYS 80 1HB LYS 80 -4.332 -5.693 7.730
560 2HB LYS 80 2HB LYS 80 -4.590 -6.375 9.323
561 1HG LYS 80 1HG LYS 80 -3.531 -8.525 8.552
562 2HG LYS 80 2HG LYS 80 -3.235 -7.801 6.984
563 1HD LYS 80 1HD LYS 80 -2.062 -6.929 9.661
564 2HD LYS 80 2HD LYS 80 -1.194 -7.615 8.302
565 1HE LYS 80 1HE LYS 80 -1.900 -5.593 6.918
566 2HE LYS 80 2HE LYS 80 -2.587 -4.897 8.372
567 1HZ LYS 80 1HZ LYS 80 0.135 -5.828 8.568
568 2HZ LYS 80 2HZ LYS 80 -0.107 -4.502 7.647
569 3HZ LYS 80 3HZ LYS 80 -0.561 -4.501 9.216
570 HA PRO 81 HA PRO 81 -7.611 -5.801 4.327
571 1HB PRO 81 1HB PRO 81 -7.904 -3.092 4.541
572 2HB PRO 81 2HB PRO 81 -8.976 -4.240 5.407
573 1HG PRO 81 2HG PRO 81 -6.751 -2.783 6.247
574 2HG PRO 81 1HG PRO 81 -8.180 -2.978 7.313
575 1HD PRO 81 1HD PRO 81 -5.839 -4.386 7.679
576 2HD PRO 81 2HD PRO 81 -7.438 -5.105 8.035
577 H THR 82 H THR 82 -6.951 -3.898 2.578
578 HA THR 82 HA THR 82 -4.040 -3.547 2.773
579 HB THR 82 HB THR 82 -3.961 -4.209 0.328
580 HG1 THR 82 HG1 THR 82 -6.660 -5.138 0.985
581 1HG2 THR 82 1HG2 THR 82 -4.397 -5.980 2.573
582 2HG2 THR 82 2HG2 THR 82 -5.294 -6.624 1.177
583 3HG2 THR 82 3HG2 THR 82 -3.542 -6.333 1.052
584 H CYS 83 H CYS 83 -3.709 -2.270 0.279
585 HA CYS 83 HA CYS 83 -4.697 0.299 1.020
586 1HB CYS 83 2HB CYS 83 -3.271 -0.333 -1.552
587 2HB CYS 83 1HB CYS 83 -3.295 1.168 -0.648
588 H ILE 84 H ILE 84 -6.082 -2.353 -0.477
589 HA ILE 84 HA ILE 84 -7.686 -0.667 -2.270
590 HB ILE 84 HB ILE 84 -6.698 -3.474 -2.446
591 1HG1 ILE 84 1HG1 ILE 84 -5.514 -1.756 -3.671
592 2HG1 ILE 84 2HG1 ILE 84 -6.331 -2.829 -4.791
593 1HG2 ILE 84 1HG2 ILE 84 -9.130 -3.736 -2.495
594 2HG2 ILE 84 2HG2 ILE 84 -9.243 -2.509 -3.780
595 3HG2 ILE 84 3HG2 ILE 84 -8.409 -4.050 -4.092
596 1HD1 ILE 84 1HD1 ILE 84 -8.245 -0.832 -4.252
597 2HD1 ILE 84 2HD1 ILE 84 -6.702 0.046 -4.378
598 3HD1 ILE 84 3HD1 ILE 84 -7.255 -0.980 -5.723
599 H SER 85 H SER 85 -7.721 -3.297 0.199
600 HA SER 85 HA SER 85 -10.410 -3.688 0.299
601 1HB SER 85 1HB SER 85 -8.852 -3.629 2.877
602 2HB SER 85 2HB SER 85 -10.015 -4.814 2.315
603 HG SER 85 HG SER 85 -8.453 -5.929 1.350
604 H CYS 86 H CYS 86 -8.454 -1.498 2.462
605 HA CYS 86 HA CYS 86 -10.655 -0.329 3.676
606 1HB CYS 86 1HB CYS 86 -8.207 -0.266 4.408
607 2HB CYS 86 2HB CYS 86 -7.984 1.036 3.256
608 H HIS 87 H HIS 87 -8.496 0.912 1.012
609 HA HIS 87 HA HIS 87 -9.815 3.205 0.445
610 1HB HIS 87 1HB HIS 87 -8.229 1.268 -1.204
611 2HB HIS 87 2HB HIS 87 -9.037 2.597 -2.011
612 HD1 HIS 87 HD1 HIS 87 -6.924 3.917 -2.605
613 HD2 HIS 87 HD2 HIS 87 -7.271 3.093 1.493
614 HE1 HIS 87 HE1 HIS 87 -5.121 5.298 -1.444
615 H LYS 88 H LYS 88 -10.682 -0.148 -0.494
616 HA LYS 88 HA LYS 88 -12.672 0.510 -2.328
617 1HB LYS 88 1HB LYS 88 -11.905 -1.880 -0.722
618 2HB LYS 88 2HB LYS 88 -13.531 -1.855 -1.374
619 1HG LYS 88 1HG LYS 88 -11.103 -1.223 -3.103
620 2HG LYS 88 2HG LYS 88 -11.664 -2.867 -2.869
621 1HD LYS 88 1HD LYS 88 -14.023 -1.507 -3.503
622 2HD LYS 88 2HD LYS 88 -12.836 -0.695 -4.505
623 1HE LYS 88 1HE LYS 88 -13.118 -3.734 -4.388
624 2HE LYS 88 2HE LYS 88 -13.950 -2.741 -5.568
625 1HZ LYS 88 1HZ LYS 88 -11.273 -2.006 -5.538
626 2HZ LYS 88 2HZ LYS 88 -11.337 -3.634 -5.648
627 3HZ LYS 88 3HZ LYS 88 -12.113 -2.711 -6.749
628 H ASP 89 H ASP 89 -12.797 -0.040 1.248
629 HA ASP 89 HA ASP 89 -15.495 0.175 1.533
630 1HB ASP 89 1HB ASP 89 -13.471 -0.236 3.237
631 2HB ASP 89 2HB ASP 89 -13.650 1.481 3.542
632 H LYS 90 H LYS 90 -12.915 2.690 1.324
633 HA LYS 90 HA LYS 90 -14.534 4.879 2.000
634 1HB LYS 90 1HB LYS 90 -11.833 4.413 0.892
635 2HB LYS 90 2HB LYS 90 -12.561 5.938 0.431
636 1HG LYS 90 1HG LYS 90 -12.212 4.899 3.282
637 2HG LYS 90 2HG LYS 90 -11.303 6.200 2.539
638 1HD LYS 90 1HD LYS 90 -13.837 7.135 2.120
639 2HD LYS 90 2HD LYS 90 -14.117 6.195 3.572
640 1HE LYS 90 1HE LYS 90 -12.246 7.410 4.716
641 2HE LYS 90 2HE LYS 90 -11.972 8.352 3.264
642 1HZ LYS 90 1HZ LYS 90 -14.648 8.303 4.393
643 2HZ LYS 90 2HZ LYS 90 -13.512 9.221 5.124
644 3HZ LYS 90 3HZ LYS 90 -13.899 9.491 3.561
645 H ALA 91 H ALA 91 -13.742 3.260 -1.120
646 HA ALA 91 HA ALA 91 -15.526 5.119 -2.484
647 1HB ALA 91 1HB ALA 91 -14.131 2.896 -3.913
648 2HB ALA 91 3HB ALA 91 -14.357 4.596 -4.388
649 3HB ALA 91 2HB ALA 91 -13.106 4.163 -3.198
650 H GLY 92 H GLY 92 -16.353 2.969 -0.460
651 1HA GLY 92 2HA GLY 92 -17.722 1.134 -0.349
652 2HA GLY 92 1HA GLY 92 -17.739 1.014 -2.098
653 H ASP 93 H ASP 93 -18.768 3.187 -3.172
654 HA ASP 93 HA ASP 93 -21.390 3.081 -2.845
655 1HB ASP 93 1HB ASP 93 -21.821 5.297 -1.524
656 2HB ASP 93 2HB ASP 93 -21.518 3.829 -0.616
657 H ASP 94 H ASP 94 -18.899 5.744 -2.660
658 HA ASP 94 HA ASP 94 -20.191 7.212 -4.703
659 1HB ASP 94 1HB ASP 94 -18.901 8.350 -2.951
660 2HB ASP 94 2HB ASP 94 -17.455 7.456 -3.374
661 H LYS 95 H LYS 95 -19.886 6.900 -6.918
662 HA LYS 95 HA LYS 95 -18.077 4.899 -7.809
663 1HB LYS 95 1HB LYS 95 -19.973 6.806 -9.185
664 2HB LYS 95 2HB LYS 95 -18.907 5.752 -10.092
665 1HG LYS 95 1HG LYS 95 -19.846 3.779 -8.794
666 2HG LYS 95 2HG LYS 95 -20.988 4.871 -8.037
667 1HD LYS 95 1HD LYS 95 -20.746 4.505 -11.060
668 2HD LYS 95 2HD LYS 95 -21.896 3.632 -10.065
669 1HE LYS 95 1HE LYS 95 -23.329 5.389 -10.122
670 2HE LYS 95 2HE LYS 95 -22.118 6.435 -9.406
671 1HZ LYS 95 1HZ LYS 95 -21.313 6.138 -11.973
672 2HZ LYS 95 2HZ LYS 95 -22.937 6.255 -12.104
673 3HZ LYS 95 3HZ LYS 95 -22.091 7.435 -11.357
674 H GLU 96 H GLU 96 -18.119 8.480 -7.696
675 HA GLU 96 HA GLU 96 -15.896 8.792 -9.359
676 1HB GLU 96 1HB GLU 96 -17.020 10.622 -7.193
677 2HB GLU 96 2HB GLU 96 -15.827 11.108 -8.381
678 1HG GLU 96 1HG GLU 96 -17.355 10.954 -10.184
679 2HG GLU 96 2HG GLU 96 -18.420 9.860 -9.324
680 H LEU 97 H LEU 97 -16.302 7.886 -5.985
681 HA LEU 97 HA LEU 97 -13.633 8.616 -5.232
682 1HB LEU 97 1HB LEU 97 -15.796 8.461 -3.801
683 2HB LEU 97 2HB LEU 97 -15.430 6.750 -3.717
684 HG LEU 97 HG LEU 97 -14.528 7.665 -1.759
685 1HD1 LEU 97 1HD1 LEU 97 -12.997 6.158 -3.094
686 2HD1 LEU 97 2HD1 LEU 97 -12.123 7.627 -3.591
687 3HD1 LEU 97 3HD1 LEU 97 -12.212 7.183 -1.869
688 1HD2 LEU 97 1HD2 LEU 97 -14.692 10.023 -2.348
689 2HD2 LEU 97 2HD2 LEU 97 -13.089 9.651 -1.671
690 3HD2 LEU 97 3HD2 LEU 97 -13.285 9.870 -3.427
691 H LYS 98 H LYS 98 -15.206 5.974 -6.872
692 HA LYS 98 HA LYS 98 -13.121 4.093 -6.185
693 1HB LYS 98 1HB LYS 98 -15.599 3.535 -6.473
694 2HB LYS 98 2HB LYS 98 -15.351 3.734 -8.196
695 1HG LYS 98 1HG LYS 98 -13.295 2.088 -7.803
696 2HG LYS 98 2HG LYS 98 -14.161 1.658 -6.341
697 1HD LYS 98 1HD LYS 98 -15.496 1.657 -9.083
698 2HD LYS 98 2HD LYS 98 -14.670 0.249 -8.445
699 1HE LYS 98 1HE LYS 98 -16.904 1.682 -6.935
700 2HE LYS 98 2HE LYS 98 -17.200 0.340 -8.022
701 1HZ LYS 98 1HZ LYS 98 -15.346 -0.738 -6.565
702 2HZ LYS 98 2HZ LYS 98 -15.866 0.341 -5.454
703 3HZ LYS 98 3HZ LYS 98 -16.907 -0.748 -6.084
704 H LYS 99 H LYS 99 -12.609 6.742 -7.628
705 HA LYS 99 HA LYS 99 -11.047 5.530 -9.766
706 1HB LYS 99 1HB LYS 99 -13.292 7.427 -10.133
707 2HB LYS 99 2HB LYS 99 -11.821 7.836 -10.991
708 1HG LYS 99 1HG LYS 99 -12.534 4.955 -11.150
709 2HG LYS 99 2HG LYS 99 -13.728 6.017 -11.869
710 1HD LYS 99 1HD LYS 99 -11.524 7.161 -12.934
711 2HD LYS 99 2HD LYS 99 -10.861 5.561 -12.670
712 1HE LYS 99 1HE LYS 99 -12.685 4.539 -13.989
713 2HE LYS 99 2HE LYS 99 -13.473 6.094 -14.165
714 1HZ LYS 99 1HZ LYS 99 -10.742 5.590 -15.112
715 2HZ LYS 99 2HZ LYS 99 -12.061 5.394 -16.055
716 3HZ LYS 99 3HZ LYS 99 -11.694 6.871 -15.463
717 H LYS 100 H LYS 100 -10.085 6.138 -7.255
718 HA LYS 100 HA LYS 100 -8.102 8.043 -7.902
719 1HB LYS 100 1HB LYS 100 -8.794 9.464 -5.763
720 2HB LYS 100 2HB LYS 100 -9.352 9.864 -7.375
721 1HG LYS 100 1HG LYS 100 -11.403 8.364 -6.893
722 2HG LYS 100 2HG LYS 100 -10.873 8.331 -5.223
723 1HD LYS 100 1HD LYS 100 -11.260 10.962 -6.702
724 2HD LYS 100 2HD LYS 100 -12.604 10.154 -5.920
725 1HE LYS 100 1HE LYS 100 -11.313 10.160 -3.753
726 2HE LYS 100 2HE LYS 100 -10.019 11.034 -4.548
727 1HZ LYS 100 1HZ LYS 100 -12.562 12.235 -4.946
728 2HZ LYS 100 2HZ LYS 100 -12.156 12.150 -3.367
729 3HZ LYS 100 3HZ LYS 100 -11.167 12.905 -4.425
730 H LEU 101 H LEU 101 -9.901 6.236 -5.351
731 HA LEU 101 HA LEU 101 -7.387 5.817 -3.944
732 1HB LEU 101 1HB LEU 101 -10.216 5.056 -3.203
733 2HB LEU 101 2HB LEU 101 -8.799 4.867 -2.190
734 HG LEU 101 HG LEU 101 -10.244 7.382 -2.979
735 1HD1 LEU 101 1HD1 LEU 101 -10.623 5.942 -0.836
736 2HD1 LEU 101 2HD1 LEU 101 -9.132 6.731 -0.268
737 3HD1 LEU 101 3HD1 LEU 101 -10.545 7.716 -0.716
738 1HD2 LEU 101 1HD2 LEU 101 -7.335 7.138 -2.240
739 2HD2 LEU 101 2HD2 LEU 101 -8.098 8.097 -3.531
740 3HD2 LEU 101 3HD2 LEU 101 -8.275 8.593 -1.831
741 H THR 102 H THR 102 -9.799 4.181 -5.985
742 HA THR 102 HA THR 102 -8.084 1.786 -5.885
743 HB THR 102 HB THR 102 -10.077 0.424 -5.926
744 HG1 THR 102 HG1 THR 102 -11.410 1.556 -7.374
745 1HG2 THR 102 1HG2 THR 102 -9.684 1.705 -3.693
746 2HG2 THR 102 2HG2 THR 102 -10.977 2.800 -4.236
747 3HG2 THR 102 3HG2 THR 102 -11.325 1.075 -3.971
748 H GLY 103 H GLY 103 -8.750 4.428 -7.668
749 1HA GLY 103 2HA GLY 103 -8.601 4.923 -9.853
750 2HA GLY 103 1HA GLY 103 -9.543 3.481 -10.174
751 H CYS 104 H CYS 104 -8.572 1.769 -11.208
752 HA CYS 104 HA CYS 104 -6.031 0.874 -10.812
753 1HB CYS 104 1HB CYS 104 -8.091 0.550 -12.892
754 2HB CYS 104 2HB CYS 104 -6.456 0.231 -13.436
755 H LYS 105 H LYS 105 -7.273 3.171 -13.343
756 HA LYS 105 HA LYS 105 -4.515 4.146 -13.606
757 1HB LYS 105 1HB LYS 105 -4.919 2.910 -15.589
758 2HB LYS 105 2HB LYS 105 -6.543 3.545 -15.762
759 1HG LYS 105 1HG LYS 105 -5.255 5.901 -15.822
760 2HG LYS 105 2HG LYS 105 -3.904 4.902 -16.318
761 1HD LYS 105 1HD LYS 105 -6.055 3.941 -17.868
762 2HD LYS 105 2HD LYS 105 -6.307 5.675 -17.834
763 1HE LYS 105 1HE LYS 105 -4.878 5.162 -19.739
764 2HE LYS 105 2HE LYS 105 -3.906 6.006 -18.550
765 1HZ LYS 105 1HZ LYS 105 -3.761 3.320 -17.955
766 2HZ LYS 105 2HZ LYS 105 -3.542 3.440 -19.569
767 3HZ LYS 105 3HZ LYS 105 -2.575 4.273 -18.549
768 H GLY 106 H GLY 106 -4.238 6.362 -13.526
769 1HA GLY 106 2HA GLY 106 -6.429 8.170 -13.895
770 2HA GLY 106 1HA GLY 106 -4.795 8.553 -13.392
771 H SER 107 H SER 107 -4.532 6.899 -11.080
772 HA SER 107 HA SER 107 -6.616 8.052 -9.394
773 1HB SER 107 1HB SER 107 -6.167 6.149 -7.821
774 2HB SER 107 2HB SER 107 -6.795 5.629 -9.373
775 HG SER 107 HG SER 107 -5.044 4.281 -8.859
776 H ALA 108 H ALA 108 -5.628 8.008 -6.913
777 HA ALA 108 HA ALA 108 -3.476 9.871 -7.029
778 1HB ALA 108 1HB ALA 108 -3.836 9.151 -4.369
779 2HB ALA 108 3HB ALA 108 -5.435 8.844 -5.090
780 3HB ALA 108 2HB ALA 108 -4.696 10.458 -5.219
781 H CYS 109 H CYS 109 -3.574 6.534 -7.351
782 HA CYS 109 HA CYS 109 -1.051 6.186 -5.920
783 1HB CYS 109 1HB CYS 109 -3.100 4.180 -6.902
784 2HB CYS 109 2HB CYS 109 -1.510 3.716 -6.330
785 H HIS 110 H HIS 110 -2.774 5.651 -9.064
786 HA HIS 110 HA HIS 110 -0.132 5.543 -10.328
787 1HB HIS 110 1HB HIS 110 -2.701 4.168 -11.161
788 2HB HIS 110 2HB HIS 110 -1.231 4.196 -12.115
789 HD1 HIS 110 HD1 HIS 110 0.980 3.381 -10.352
790 HD2 HIS 110 HD2 HIS 110 -2.868 1.783 -9.869
791 HE1 HIS 110 HE1 HIS 110 1.272 1.180 -9.094
792 HA PRO 111 HA PRO 111 -2.138 9.253 -12.007
793 1HB PRO 111 1HB PRO 111 -0.296 11.086 -11.302
794 2HB PRO 111 2HB PRO 111 -1.371 10.360 -10.064
795 1HG PRO 111 2HG PRO 111 1.257 9.643 -11.007
796 2HG PRO 111 1HG PRO 111 1.132 9.657 -9.217
797 1HD PRO 111 1HD PRO 111 1.104 7.319 -10.586
798 2HD PRO 111 2HD PRO 111 -0.029 7.561 -9.222
799 H SER 112 H SER 112 -1.499 7.763 -13.995
800 HA SER 112 HA SER 112 0.323 9.327 -15.521
801 1HB SER 112 1HB SER 112 1.477 7.206 -14.181
802 2HB SER 112 2HB SER 112 1.041 6.445 -15.698
803 HG SER 112 HG SER 112 3.053 7.293 -16.095
No H/Q in entry = 803
Start of MODEL 3
1 H1 VAL 1 H1 VAL 1 6.352 7.460 16.098
2 H2 VAL 1 H2 VAL 1 7.056 6.322 15.123
3 H3 VAL 1 H3 VAL 1 6.605 5.926 16.666
4 HA VAL 1 HA VAL 1 8.189 7.291 17.621
5 HB VAL 1 HB VAL 1 9.925 5.900 17.294
6 1HG1 VAL 1 1HG1 VAL 1 7.911 4.465 17.293
7 2HG1 VAL 1 2HG1 VAL 1 7.903 4.498 15.513
8 3HG1 VAL 1 3HG1 VAL 1 9.257 3.738 16.383
9 1HG2 VAL 1 1HG2 VAL 1 9.536 6.432 14.354
10 2HG2 VAL 1 2HG2 VAL 1 10.947 6.763 15.387
11 3HG2 VAL 1 3HG2 VAL 1 10.570 5.092 14.902
12 H ASP 2 H ASP 2 7.246 8.089 14.424
13 HA ASP 2 HA ASP 2 7.958 10.639 14.506
14 1HB ASP 2 1HB ASP 2 10.295 10.348 14.643
15 2HB ASP 2 2HB ASP 2 10.282 8.926 13.619
16 H VAL 3 H VAL 3 5.856 10.167 13.336
17 HA VAL 3 HA VAL 3 5.674 8.772 10.969
18 HB VAL 3 HB VAL 3 4.000 10.153 12.613
19 1HG1 VAL 3 1HG1 VAL 3 4.556 12.309 11.578
20 2HG1 VAL 3 2HG1 VAL 3 4.068 11.679 9.987
21 3HG1 VAL 3 3HG1 VAL 3 2.858 11.869 11.278
22 1HG2 VAL 3 1HG2 VAL 3 3.683 8.833 9.940
23 2HG2 VAL 3 2HG2 VAL 3 3.072 8.341 11.538
24 3HG2 VAL 3 3HG2 VAL 3 2.285 9.672 10.656
25 HA PRO 4 HA PRO 4 8.557 11.057 8.461
26 1HB PRO 4 2HB PRO 4 7.069 9.432 6.387
27 2HB PRO 4 1HB PRO 4 8.828 9.624 6.681
28 1HG PRO 4 1HG PRO 4 7.655 7.420 7.473
29 2HG PRO 4 2HG PRO 4 8.979 8.080 8.486
30 1HD PRO 4 2HD PRO 4 5.979 8.155 8.877
31 2HD PRO 4 1HD PRO 4 7.283 8.151 10.103
32 H ALA 5 H ALA 5 8.314 12.582 6.541
33 HA ALA 5 HA ALA 5 5.774 13.944 6.785
34 1HB ALA 5 1HB ALA 5 7.029 15.762 6.350
35 2HB ALA 5 2HB ALA 5 7.673 15.039 4.856
36 3HB ALA 5 3HB ALA 5 8.454 14.699 6.419
37 H ASP 6 H ASP 6 4.409 14.465 4.960
38 HA ASP 6 HA ASP 6 3.856 12.347 3.359
39 1HB ASP 6 1HB ASP 6 2.274 13.749 2.317
40 2HB ASP 6 2HB ASP 6 2.517 14.535 3.864
41 H GLY 7 H GLY 7 3.656 13.177 0.672
42 1HA GLY 7 2HA GLY 7 5.950 14.404 -0.400
43 2HA GLY 7 1HA GLY 7 4.797 13.397 -1.253
44 H ALA 8 H ALA 8 5.073 10.950 0.237
45 HA ALA 8 HA ALA 8 7.908 10.306 -0.139
46 1HB ALA 8 1HB ALA 8 6.442 9.896 2.049
47 2HB ALA 8 3HB ALA 8 5.935 8.444 1.152
48 3HB ALA 8 2HB ALA 8 7.657 8.710 1.516
49 H LYS 9 H LYS 9 8.361 9.548 -2.146
50 HA LYS 9 HA LYS 9 6.258 8.261 -3.655
51 1HB LYS 9 2HB LYS 9 7.379 8.971 -5.457
52 2HB LYS 9 1HB LYS 9 8.297 9.957 -4.337
53 1HG LYS 9 1HG LYS 9 9.761 7.738 -4.060
54 2HG LYS 9 2HG LYS 9 9.064 7.325 -5.614
55 1HD LYS 9 1HD LYS 9 10.949 8.485 -6.330
56 2HD LYS 9 2HD LYS 9 9.799 9.806 -6.269
57 1HE LYS 9 1HE LYS 9 10.603 10.121 -3.790
58 2HE LYS 9 2HE LYS 9 11.958 9.108 -4.245
59 1HZ LYS 9 1HZ LYS 9 11.188 11.529 -5.718
60 2HZ LYS 9 2HZ LYS 9 12.330 11.501 -4.550
61 3HZ LYS 9 3HZ LYS 9 12.546 10.646 -5.925
62 H ILE 10 H ILE 10 6.158 6.089 -4.203
63 HA ILE 10 HA ILE 10 8.154 4.411 -2.849
64 HB ILE 10 HB ILE 10 5.267 3.779 -3.470
65 1HG1 ILE 10 1HG1 ILE 10 6.351 4.185 -0.698
66 2HG1 ILE 10 2HG1 ILE 10 5.885 5.578 -1.654
67 1HG2 ILE 10 1HG2 ILE 10 6.830 1.837 -3.450
68 2HG2 ILE 10 2HG2 ILE 10 7.252 2.248 -1.770
69 3HG2 ILE 10 3HG2 ILE 10 5.584 1.780 -2.180
70 1HD1 ILE 10 1HD1 ILE 10 4.029 3.190 -1.326
71 2HD1 ILE 10 2HD1 ILE 10 4.063 4.527 -0.152
72 3HD1 ILE 10 3HD1 ILE 10 3.617 4.842 -1.846
73 H ASP 11 H ASP 11 9.341 3.008 -4.067
74 HA ASP 11 HA ASP 11 8.338 2.132 -6.573
75 1HB ASP 11 1HB ASP 11 9.192 4.154 -7.480
76 2HB ASP 11 2HB ASP 11 10.555 4.186 -6.379
77 H PHE 12 H PHE 12 8.736 0.007 -5.711
78 HA PHE 12 HA PHE 12 11.550 -0.558 -5.089
79 1HB PHE 12 1HB PHE 12 8.913 -1.916 -4.262
80 2HB PHE 12 2HB PHE 12 10.498 -2.473 -3.765
81 HD1 PHE 12 HD1 PHE 12 11.788 0.162 -3.156
82 HD2 PHE 12 HD2 PHE 12 7.927 -1.330 -2.224
83 HE1 PHE 12 HE1 PHE 12 11.690 1.669 -1.151
84 HE2 PHE 12 HE2 PHE 12 7.829 0.176 -0.218
85 HZ PHE 12 HZ PHE 12 9.712 1.658 0.294
86 H ILE 13 H ILE 13 8.693 -1.353 -7.028
87 HA ILE 13 HA ILE 13 10.010 -3.725 -8.082
88 HB ILE 13 HB ILE 13 7.251 -2.561 -8.453
89 1HG1 ILE 13 1HG1 ILE 13 8.044 -5.176 -7.157
90 2HG1 ILE 13 2HG1 ILE 13 7.905 -3.682 -6.251
91 1HG2 ILE 13 1HG2 ILE 13 8.276 -3.747 -10.491
92 2HG2 ILE 13 2HG2 ILE 13 8.148 -5.233 -9.519
93 3HG2 ILE 13 3HG2 ILE 13 6.686 -4.296 -9.909
94 1HD1 ILE 13 1HD1 ILE 13 5.556 -3.896 -7.895
95 2HD1 ILE 13 2HD1 ILE 13 5.802 -5.462 -7.085
96 3HD1 ILE 13 3HD1 ILE 13 5.667 -3.972 -6.120
97 H ALA 14 H ALA 14 11.813 -2.572 -9.067
98 HA ALA 14 HA ALA 14 11.475 -0.497 -10.889
99 1HB ALA 14 1HB ALA 14 13.600 -1.317 -9.754
100 2HB ALA 14 3HB ALA 14 13.754 -0.947 -11.489
101 3HB ALA 14 2HB ALA 14 13.631 -2.638 -10.947
102 H GLY 15 H GLY 15 12.253 -0.870 -13.335
103 1HA GLY 15 2HA GLY 15 10.243 -1.856 -14.809
104 2HA GLY 15 1HA GLY 15 11.187 -3.301 -14.504
105 H GLY 16 H GLY 16 12.296 0.121 -14.962
106 1HA GLY 16 2HA GLY 16 13.812 -0.811 -17.327
107 2HA GLY 16 1HA GLY 16 14.442 0.317 -16.144
108 H GLU 17 H GLU 17 13.764 2.514 -16.139
109 HA GLU 17 HA GLU 17 12.849 4.353 -16.869
110 1HB GLU 17 1HB GLU 17 14.456 3.608 -18.768
111 2HB GLU 17 2HB GLU 17 13.014 3.191 -19.673
112 1HG GLU 17 2HG GLU 17 13.533 5.433 -20.328
113 2HG GLU 17 1HG GLU 17 12.177 5.582 -19.229
114 H LYS 18 H LYS 18 10.974 2.145 -16.190
115 HA LYS 18 HA LYS 18 8.621 3.358 -17.219
116 1HB LYS 18 2HB LYS 18 7.704 1.532 -18.461
117 2HB LYS 18 1HB LYS 18 9.266 1.925 -19.151
118 1HG LYS 18 1HG LYS 18 10.226 -0.067 -18.483
119 2HG LYS 18 2HG LYS 18 9.338 -0.115 -16.972
120 1HD LYS 18 1HD LYS 18 7.285 -0.437 -18.796
121 2HD LYS 18 2HD LYS 18 8.603 -1.226 -19.639
122 1HE LYS 18 1HE LYS 18 8.675 -2.977 -18.156
123 2HE LYS 18 2HE LYS 18 8.471 -1.935 -16.761
124 1HZ LYS 18 1HZ LYS 18 6.103 -1.731 -17.505
125 2HZ LYS 18 2HZ LYS 18 6.382 -2.967 -18.535
126 3HZ LYS 18 3HZ LYS 18 6.540 -3.194 -16.925
127 H ASN 19 H ASN 19 9.638 3.217 -14.657
128 HA ASN 19 HA ASN 19 8.186 1.004 -13.462
129 1HB ASN 19 1HB ASN 19 9.445 2.059 -11.334
130 2HB ASN 19 2HB ASN 19 10.288 0.984 -12.432
131 2HD2 ASN 19 2HD2 ASN 19 9.362 4.423 -12.241
132 1HD2 ASN 19 1HD2 ASN 19 10.888 5.088 -12.719
133 H LEU 20 H LEU 20 6.313 1.453 -12.239
134 HA LEU 20 HA LEU 20 5.313 4.132 -12.328
135 1HB LEU 20 1HB LEU 20 4.235 1.546 -11.207
136 2HB LEU 20 2HB LEU 20 3.372 3.069 -11.125
137 HG LEU 20 HG LEU 20 4.193 1.612 -13.652
138 1HD1 LEU 20 1HD1 LEU 20 2.184 0.874 -12.066
139 2HD1 LEU 20 2HD1 LEU 20 1.349 2.167 -12.959
140 3HD1 LEU 20 3HD1 LEU 20 2.076 0.803 -13.841
141 1HD2 LEU 20 1HD2 LEU 20 2.864 4.292 -13.241
142 2HD2 LEU 20 2HD2 LEU 20 4.310 3.898 -14.200
143 3HD2 LEU 20 3HD2 LEU 20 2.704 3.363 -14.750
144 H THR 21 H THR 21 5.232 5.646 -10.706
145 HA THR 21 HA THR 21 6.392 4.808 -8.129
146 HB THR 21 HB THR 21 6.597 7.611 -9.289
147 HG1 THR 21 HG1 THR 21 7.344 5.875 -10.823
148 1HG2 THR 21 1HG2 THR 21 8.185 5.868 -7.354
149 2HG2 THR 21 2HG2 THR 21 8.922 7.286 -8.137
150 3HG2 THR 21 3HG2 THR 21 7.511 7.491 -7.071
151 H VAL 22 H VAL 22 4.830 4.641 -6.648
152 HA VAL 22 HA VAL 22 2.500 6.351 -6.914
153 HB VAL 22 HB VAL 22 3.213 4.006 -5.152
154 1HG1 VAL 22 1HG1 VAL 22 1.166 6.064 -4.778
155 2HG1 VAL 22 2HG1 VAL 22 0.483 4.423 -4.875
156 3HG1 VAL 22 3HG1 VAL 22 1.733 4.796 -3.664
157 1HG2 VAL 22 1HG2 VAL 22 2.353 4.051 -7.756
158 2HG2 VAL 22 2HG2 VAL 22 2.102 2.706 -6.618
159 3HG2 VAL 22 3HG2 VAL 22 0.817 3.912 -6.867
160 H VAL 23 H VAL 23 1.822 7.852 -5.312
161 HA VAL 23 HA VAL 23 4.032 8.715 -3.587
162 HB VAL 23 HB VAL 23 1.717 10.157 -4.874
163 1HG1 VAL 23 1HG1 VAL 23 3.216 10.838 -2.419
164 2HG1 VAL 23 2HG1 VAL 23 3.130 12.138 -3.633
165 3HG1 VAL 23 3HG1 VAL 23 1.634 11.412 -2.999
166 1HG2 VAL 23 1HG2 VAL 23 4.118 9.639 -5.933
167 2HG2 VAL 23 2HG2 VAL 23 3.254 11.166 -6.231
168 3HG2 VAL 23 3HG2 VAL 23 4.547 11.098 -5.009
169 H PHE 24 H PHE 24 3.827 8.547 -1.405
170 HA PHE 24 HA PHE 24 1.117 8.021 -0.401
171 1HB PHE 24 1HB PHE 24 2.908 6.107 -0.482
172 2HB PHE 24 2HB PHE 24 3.810 7.033 0.701
173 HD1 PHE 24 HD1 PHE 24 0.229 6.020 0.296
174 HD2 PHE 24 HD2 PHE 24 3.631 6.189 2.827
175 HE1 PHE 24 HE1 PHE 24 -1.090 4.945 2.141
176 HE2 PHE 24 HE2 PHE 24 2.312 5.115 4.672
177 HZ PHE 24 HZ PHE 24 -0.033 4.505 4.307
178 H ASN 25 H ASN 25 0.984 8.464 2.069
179 HA ASN 25 HA ASN 25 2.843 10.415 2.996
180 1HB ASN 25 1HB ASN 25 1.428 11.953 1.768
181 2HB ASN 25 2HB ASN 25 -0.035 11.135 2.279
182 2HD2 ASN 25 2HD2 ASN 25 -0.869 13.083 3.046
183 1HD2 ASN 25 1HD2 ASN 25 -0.370 13.789 4.547
184 H HIS 26 H HIS 26 2.695 10.587 5.333
185 HA HIS 26 HA HIS 26 1.063 8.522 6.519
186 1HB HIS 26 1HB HIS 26 3.463 10.103 7.299
187 2HB HIS 26 2HB HIS 26 2.417 9.568 8.599
188 HD1 HIS 26 HD1 HIS 26 4.634 8.221 5.835
189 HD2 HIS 26 HD2 HIS 26 2.511 6.829 9.175
190 HE1 HIS 26 HE1 HIS 26 5.382 5.810 6.204
191 H SER 27 H SER 27 1.168 12.025 6.130
192 HA SER 27 HA SER 27 -0.519 12.553 8.333
193 1HB SER 27 1HB SER 27 -0.673 14.634 6.339
194 2HB SER 27 2HB SER 27 0.137 14.668 7.893
195 HG SER 27 HG SER 27 1.231 14.497 5.388
196 H THR 28 H THR 28 -1.087 10.865 5.535
197 HA THR 28 HA THR 28 -3.716 12.022 5.003
198 HB THR 28 HB THR 28 -2.023 9.856 3.650
199 HG1 THR 28 HG1 THR 28 -2.075 11.714 2.042
200 1HG2 THR 28 1HG2 THR 28 -4.650 9.739 3.387
201 2HG2 THR 28 2HG2 THR 28 -4.456 11.253 2.471
202 3HG2 THR 28 3HG2 THR 28 -3.652 9.767 1.913
203 H HIS 29 H HIS 29 -2.155 9.071 6.315
204 HA HIS 29 HA HIS 29 -4.837 8.096 6.946
205 1HB HIS 29 1HB HIS 29 -2.222 6.569 7.018
206 2HB HIS 29 2HB HIS 29 -3.836 5.908 7.189
207 HD1 HIS 29 HD1 HIS 29 -1.442 7.267 4.608
208 HD2 HIS 29 HD2 HIS 29 -5.261 5.538 4.781
209 HE1 HIS 29 HE1 HIS 29 -2.075 6.689 2.205
210 H LYS 30 H LYS 30 -3.329 10.323 8.326
211 HA LYS 30 HA LYS 30 -2.204 9.437 10.697
212 1HB LYS 30 2HB LYS 30 -2.520 11.700 11.479
213 2HB LYS 30 1HB LYS 30 -2.021 11.725 9.799
214 1HG LYS 30 2HG LYS 30 -3.798 13.245 9.749
215 2HG LYS 30 1HG LYS 30 -4.620 11.767 9.292
216 1HD LYS 30 2HD LYS 30 -6.040 12.167 11.023
217 2HD LYS 30 1HD LYS 30 -4.733 11.677 12.082
218 1HE LYS 30 1HE LYS 30 -4.398 14.465 11.216
219 2HE LYS 30 2HE LYS 30 -5.959 14.225 11.975
220 1HZ LYS 30 1HZ LYS 30 -4.724 13.097 13.793
221 2HZ LYS 30 2HZ LYS 30 -3.329 13.611 13.117
222 3HZ LYS 30 3HZ LYS 30 -4.422 14.697 13.658
223 H ASP 31 H ASP 31 -5.487 9.311 9.561
224 HA ASP 31 HA ASP 31 -6.552 9.219 12.222
225 1HB ASP 31 1HB ASP 31 -8.055 10.223 10.706
226 2HB ASP 31 2HB ASP 31 -7.661 9.105 9.416
227 H VAL 32 H VAL 32 -4.784 7.149 10.297
228 HA VAL 32 HA VAL 32 -6.304 4.775 11.123
229 HB VAL 32 HB VAL 32 -4.207 5.057 8.962
230 1HG1 VAL 32 1HG1 VAL 32 -4.509 2.790 10.048
231 2HG1 VAL 32 2HG1 VAL 32 -6.171 2.792 9.411
232 3HG1 VAL 32 3HG1 VAL 32 -4.789 2.842 8.291
233 1HG2 VAL 32 1HG2 VAL 32 -7.132 5.533 8.957
234 2HG2 VAL 32 2HG2 VAL 32 -5.862 6.155 7.876
235 3HG2 VAL 32 3HG2 VAL 32 -6.515 4.517 7.632
236 H LYS 33 H LYS 33 -5.379 3.325 12.528
237 HA LYS 33 HA LYS 33 -3.289 4.140 14.133
238 1HB LYS 33 1HB LYS 33 -4.381 1.358 13.619
239 2HB LYS 33 2HB LYS 33 -3.298 1.774 14.931
240 1HG LYS 33 1HG LYS 33 -5.863 3.346 14.545
241 2HG LYS 33 2HG LYS 33 -5.913 1.783 15.335
242 1HD LYS 33 1HD LYS 33 -3.744 3.528 16.352
243 2HD LYS 33 2HD LYS 33 -5.340 4.214 16.581
244 1HE LYS 33 1HE LYS 33 -6.008 1.863 17.517
245 2HE LYS 33 2HE LYS 33 -4.287 1.549 17.605
246 1HZ LYS 33 1HZ LYS 33 -4.824 4.064 18.690
247 2HZ LYS 33 2HZ LYS 33 -5.816 2.971 19.390
248 3HZ LYS 33 3HZ LYS 33 -4.198 2.749 19.429
249 H CYS 34 H CYS 34 -1.120 3.093 14.424
250 HA CYS 34 HA CYS 34 0.236 3.157 11.931
251 1HB CYS 34 2HB CYS 34 1.414 2.306 14.572
252 2HB CYS 34 1HB CYS 34 2.238 2.991 13.186
253 H ASP 35 H ASP 35 -0.692 0.681 14.392
254 HA ASP 35 HA ASP 35 0.685 -1.417 13.216
255 1HB ASP 35 1HB ASP 35 -0.943 -2.853 14.523
256 2HB ASP 35 2HB ASP 35 -0.132 -1.630 15.480
257 H ASP 36 H ASP 36 -1.978 0.429 12.125
258 HA ASP 36 HA ASP 36 -3.622 -1.518 11.045
259 1HB ASP 36 1HB ASP 36 -3.865 1.115 11.307
260 2HB ASP 36 2HB ASP 36 -3.158 1.161 9.704
261 H CYS 37 H CYS 37 -0.433 -0.381 10.218
262 HA CYS 37 HA CYS 37 -0.607 -1.821 7.679
263 1HB CYS 37 1HB CYS 37 0.767 0.846 8.137
264 2HB CYS 37 2HB CYS 37 1.023 -0.158 6.724
265 H HIS 38 H HIS 38 1.487 -0.372 10.268
266 HA HIS 38 HA HIS 38 3.643 -2.130 9.651
267 1HB HIS 38 1HB HIS 38 3.177 -0.285 12.010
268 2HB HIS 38 2HB HIS 38 4.677 -1.125 11.669
269 HD1 HIS 38 HD1 HIS 38 5.797 -0.476 9.221
270 HD2 HIS 38 HD2 HIS 38 2.972 2.179 10.823
271 HE1 HIS 38 HE1 HIS 38 6.129 1.741 8.003
272 H HIS 39 H HIS 39 2.428 -4.186 9.741
273 HA HIS 39 HA HIS 39 1.531 -4.958 12.378
274 1HB HIS 39 2HB HIS 39 0.481 -6.767 11.353
275 2HB HIS 39 1HB HIS 39 0.313 -5.466 10.191
276 HD1 HIS 39 HD1 HIS 39 1.534 -8.905 10.530
277 HD2 HIS 39 HD2 HIS 39 2.253 -5.666 7.964
278 HE1 HIS 39 HE1 HIS 39 2.673 -9.871 8.461
279 H GLN 40 H GLN 40 3.979 -4.480 12.973
280 HA GLN 40 HA GLN 40 5.263 -7.084 12.874
281 1HB GLN 40 1HB GLN 40 6.478 -4.407 12.147
282 2HB GLN 40 2HB GLN 40 7.493 -5.676 12.803
283 1HG GLN 40 2HG GLN 40 5.749 -5.876 10.304
284 2HG GLN 40 1HG GLN 40 7.498 -5.777 10.338
285 2HE2 GLN 40 2HE2 GLN 40 4.880 -7.795 10.162
286 1HE2 GLN 40 1HE2 GLN 40 5.604 -9.311 10.586
287 HA PRO 41 HA PRO 41 5.679 -6.780 17.213
288 1HB PRO 41 1HB PRO 41 8.256 -7.788 17.543
289 2HB PRO 41 2HB PRO 41 6.814 -8.788 17.172
290 1HG PRO 41 1HG PRO 41 8.784 -7.539 15.268
291 2HG PRO 41 2HG PRO 41 8.423 -9.288 15.097
292 1HD PRO 41 1HD PRO 41 7.066 -7.739 13.518
293 2HD PRO 41 2HD PRO 41 6.051 -8.724 14.614
294 H GLY 42 H GLY 42 6.672 -5.435 18.889
295 1HA GLY 42 2HA GLY 42 7.863 -3.698 19.692
296 2HA GLY 42 1HA GLY 42 7.435 -2.920 18.181
297 H ASP 43 H ASP 43 9.700 -1.933 18.926
298 HA ASP 43 HA ASP 43 11.845 -1.731 18.630
299 1HB ASP 43 1HB ASP 43 11.856 -4.204 19.511
300 2HB ASP 43 2HB ASP 43 12.109 -4.655 17.837
301 H LYS 44 H LYS 44 10.878 -4.409 16.338
302 HA LYS 44 HA LYS 44 11.825 -2.707 14.140
303 1HB LYS 44 1HB LYS 44 11.816 -5.705 14.513
304 2HB LYS 44 2HB LYS 44 11.973 -4.972 12.929
305 1HG LYS 44 1HG LYS 44 13.978 -3.730 13.645
306 2HG LYS 44 2HG LYS 44 13.782 -4.290 15.294
307 1HD LYS 44 1HD LYS 44 13.827 -6.704 14.044
308 2HD LYS 44 2HD LYS 44 14.762 -5.787 12.880
309 1HE LYS 44 1HE LYS 44 15.857 -4.962 15.318
310 2HE LYS 44 2HE LYS 44 15.495 -6.651 15.616
311 1HZ LYS 44 1HZ LYS 44 16.578 -6.693 13.165
312 2HZ LYS 44 2HZ LYS 44 17.444 -5.511 13.886
313 3HZ LYS 44 3HZ LYS 44 17.388 -7.003 14.549
314 H GLN 45 H GLN 45 9.160 -2.699 15.596
315 HA GLN 45 HA GLN 45 7.293 -3.989 13.997
316 1HB GLN 45 1HB GLN 45 6.664 -3.243 16.201
317 2HB GLN 45 2HB GLN 45 7.120 -1.587 15.854
318 1HG GLN 45 1HG GLN 45 5.188 -1.152 14.637
319 2HG GLN 45 2HG GLN 45 5.062 -2.794 14.037
320 2HE2 GLN 45 2HE2 GLN 45 2.835 -1.600 14.884
321 1HE2 GLN 45 1HE2 GLN 45 2.272 -2.246 16.389
322 H TYR 46 H TYR 46 9.180 -1.129 13.580
323 HA TYR 46 HA TYR 46 7.517 -0.309 11.245
324 1HB TYR 46 2HB TYR 46 9.518 1.302 12.864
325 2HB TYR 46 1HB TYR 46 8.532 1.900 11.519
326 HD1 TYR 46 HD1 TYR 46 6.122 2.267 11.787
327 HD2 TYR 46 HD2 TYR 46 8.561 0.933 15.062
328 HE1 TYR 46 HE1 TYR 46 4.312 2.859 13.375
329 HE2 TYR 46 HE2 TYR 46 6.750 1.525 16.650
330 HH TYR 46 HH TYR 46 3.898 3.309 15.701
331 H ALA 47 H ALA 47 8.796 -2.327 10.288
332 HA ALA 47 HA ALA 47 11.419 -1.343 9.397
333 1HB ALA 47 1HB ALA 47 11.286 -3.483 10.785
334 2HB ALA 47 3HB ALA 47 10.429 -4.215 9.408
335 3HB ALA 47 2HB ALA 47 12.098 -3.629 9.208
336 H GLY 48 H GLY 48 11.913 -2.644 7.135
337 1HA GLY 48 2HA GLY 48 11.499 -2.519 4.924
338 2HA GLY 48 1HA GLY 48 10.145 -1.457 5.258
339 H CYS 49 H CYS 49 8.761 -2.476 3.710
340 HA CYS 49 HA CYS 49 7.448 -4.788 4.766
341 1HB CYS 49 2HB CYS 49 6.869 -3.439 2.133
342 2HB CYS 49 1HB CYS 49 5.796 -4.425 3.106
343 H THR 50 H THR 50 9.766 -3.907 2.206
344 HA THR 50 HA THR 50 9.580 -6.546 0.994
345 HB THR 50 HB THR 50 11.293 -5.464 -0.573
346 HG1 THR 50 HG1 THR 50 12.122 -3.582 0.244
347 1HG2 THR 50 1HG2 THR 50 8.728 -5.211 -0.895
348 2HG2 THR 50 2HG2 THR 50 8.899 -3.623 -0.110
349 3HG2 THR 50 3HG2 THR 50 9.741 -3.953 -1.643
350 H THR 51 H THR 51 10.566 -5.966 3.861
351 HA THR 51 HA THR 51 13.352 -6.486 3.830
352 HB THR 51 HB THR 51 11.307 -7.019 6.042
353 HG1 THR 51 HG1 THR 51 11.443 -4.750 6.339
354 1HG2 THR 51 1HG2 THR 51 13.772 -7.654 6.416
355 2HG2 THR 51 2HG2 THR 51 14.165 -5.936 6.168
356 3HG2 THR 51 3HG2 THR 51 13.137 -6.425 7.536
357 H ASP 52 H ASP 52 14.452 -8.433 4.577
358 HA ASP 52 HA ASP 52 13.763 -10.595 3.069
359 1HB ASP 52 1HB ASP 52 15.734 -9.908 5.091
360 2HB ASP 52 2HB ASP 52 15.179 -11.546 5.378
361 H GLY 53 H GLY 53 12.970 -12.784 3.765
362 1HA GLY 53 2HA GLY 53 11.999 -13.415 6.286
363 2HA GLY 53 1HA GLY 53 11.486 -14.136 4.774
364 H CYS 54 H CYS 54 10.716 -11.232 3.847
365 HA CYS 54 HA CYS 54 8.115 -11.297 5.181
366 1HB CYS 54 1HB CYS 54 9.549 -8.723 4.466
367 2HB CYS 54 2HB CYS 54 8.025 -8.894 5.315
368 H HIS 55 H HIS 55 7.969 -8.654 3.278
369 HA HIS 55 HA HIS 55 7.002 -10.208 1.026
370 1HB HIS 55 2HB HIS 55 6.688 -7.237 1.490
371 2HB HIS 55 1HB HIS 55 5.761 -8.262 0.412
372 HD1 HIS 55 HD1 HIS 55 4.171 -10.109 1.649
373 HD2 HIS 55 HD2 HIS 55 5.646 -6.987 4.031
374 HE1 HIS 55 HE1 HIS 55 2.719 -10.063 3.747
375 H ASN 56 H ASN 56 9.723 -10.399 1.122
376 HA ASN 56 HA ASN 56 10.839 -8.257 -0.411
377 1HB ASN 56 1HB ASN 56 12.135 -9.505 1.378
378 2HB ASN 56 2HB ASN 56 12.047 -10.955 0.399
379 2HD2 ASN 56 2HD2 ASN 56 14.377 -9.534 1.304
380 1HD2 ASN 56 1HD2 ASN 56 15.282 -9.038 -0.087
381 H ILE 57 H ILE 57 9.025 -8.873 -2.137
382 HA ILE 57 HA ILE 57 10.246 -10.784 -3.991
383 HB ILE 57 HB ILE 57 7.289 -10.555 -3.426
384 1HG1 ILE 57 1HG1 ILE 57 8.867 -11.668 -1.663
385 2HG1 ILE 57 2HG1 ILE 57 7.368 -12.448 -2.128
386 1HG2 ILE 57 1HG2 ILE 57 8.881 -11.836 -5.556
387 2HG2 ILE 57 2HG2 ILE 57 7.636 -12.867 -4.809
388 3HG2 ILE 57 3HG2 ILE 57 7.181 -11.309 -5.540
389 1HD1 ILE 57 1HD1 ILE 57 9.806 -13.096 -3.764
390 2HD1 ILE 57 2HD1 ILE 57 9.711 -13.770 -2.119
391 3HD1 ILE 57 3HD1 ILE 57 8.437 -14.138 -3.307
392 H LEU 58 H LEU 58 11.003 -9.544 -5.624
393 HA LEU 58 HA LEU 58 9.400 -7.209 -6.370
394 1HB LEU 58 2HB LEU 58 12.279 -7.880 -6.996
395 2HB LEU 58 1HB LEU 58 11.437 -6.416 -7.465
396 HG LEU 58 HG LEU 58 12.161 -7.292 -4.660
397 1HD1 LEU 58 1HD1 LEU 58 13.400 -5.566 -6.655
398 2HD1 LEU 58 2HD1 LEU 58 13.115 -4.728 -5.111
399 3HD1 LEU 58 3HD1 LEU 58 14.060 -6.235 -5.144
400 1HD2 LEU 58 1HD2 LEU 58 10.125 -5.365 -5.599
401 2HD2 LEU 58 2HD2 LEU 58 10.267 -6.238 -4.054
402 3HD2 LEU 58 3HD2 LEU 58 11.229 -4.768 -4.338
403 H ASP 59 H ASP 59 8.750 -10.069 -7.012
404 HA ASP 59 HA ASP 59 9.064 -9.863 -9.903
405 1HB ASP 59 1HB ASP 59 9.595 -12.016 -8.106
406 2HB ASP 59 2HB ASP 59 8.142 -12.474 -8.972
407 H LYS 60 H LYS 60 7.101 -8.412 -9.845
408 HA LYS 60 HA LYS 60 4.708 -9.002 -8.680
409 1HB LYS 60 1HB LYS 60 3.720 -7.501 -10.301
410 2HB LYS 60 2HB LYS 60 5.274 -6.878 -9.785
411 1HG LYS 60 1HG LYS 60 6.182 -8.233 -11.900
412 2HG LYS 60 2HG LYS 60 4.517 -8.122 -12.437
413 1HD LYS 60 1HD LYS 60 5.229 -5.519 -11.476
414 2HD LYS 60 2HD LYS 60 6.575 -6.068 -12.455
415 1HE LYS 60 1HE LYS 60 5.150 -5.049 -14.045
416 2HE LYS 60 2HE LYS 60 4.773 -6.751 -14.222
417 1HZ LYS 60 1HZ LYS 60 3.155 -5.759 -12.221
418 2HZ LYS 60 2HZ LYS 60 3.079 -4.684 -13.449
419 3HZ LYS 60 3HZ LYS 60 2.708 -6.252 -13.712
420 H ALA 61 H ALA 61 2.848 -10.189 -9.223
421 HA ALA 61 HA ALA 61 1.604 -11.712 -10.272
422 1HB ALA 61 1HB ALA 61 3.552 -12.206 -12.487
423 2HB ALA 61 3HB ALA 61 1.783 -12.013 -12.542
424 3HB ALA 61 2HB ALA 61 2.830 -10.582 -12.385
425 H ASP 62 H ASP 62 3.355 -12.320 -8.158
426 HA ASP 62 HA ASP 62 4.565 -14.822 -8.986
427 1HB ASP 62 1HB ASP 62 5.790 -13.035 -7.567
428 2HB ASP 62 2HB ASP 62 4.718 -13.479 -6.253
429 H LYS 63 H LYS 63 4.397 -16.500 -6.900
430 HA LYS 63 HA LYS 63 1.588 -16.473 -6.043
431 1HB LYS 63 1HB LYS 63 3.149 -18.587 -7.452
432 2HB LYS 63 2HB LYS 63 2.064 -19.113 -6.180
433 1HG LYS 63 1HG LYS 63 1.090 -17.146 -8.275
434 2HG LYS 63 2HG LYS 63 1.154 -18.857 -8.649
435 1HD LYS 63 1HD LYS 63 -0.156 -19.194 -6.405
436 2HD LYS 63 2HD LYS 63 -0.478 -17.473 -6.489
437 1HE LYS 63 1HE LYS 63 -1.926 -17.685 -8.277
438 2HE LYS 63 2HE LYS 63 -0.990 -18.964 -9.025
439 1HZ LYS 63 1HZ LYS 63 -2.161 -19.732 -6.546
440 2HZ LYS 63 2HZ LYS 63 -3.270 -19.313 -7.669
441 3HZ LYS 63 3HZ LYS 63 -2.189 -20.494 -7.990
442 H SER 64 H SER 64 2.231 -15.472 -4.052
443 HA SER 64 HA SER 64 2.839 -17.315 -2.079
444 1HB SER 64 1HB SER 64 5.165 -16.097 -3.340
445 2HB SER 64 2HB SER 64 5.072 -15.594 -1.664
446 HG SER 64 HG SER 64 5.987 -17.919 -2.585
447 H VAL 65 H VAL 65 2.991 -16.195 0.125
448 HA VAL 65 HA VAL 65 1.324 -13.832 0.035
449 HB VAL 65 HB VAL 65 0.689 -15.618 1.500
450 1HG1 VAL 65 1HG1 VAL 65 3.536 -15.436 2.466
451 2HG1 VAL 65 2HG1 VAL 65 2.260 -16.062 3.538
452 3HG1 VAL 65 3HG1 VAL 65 2.591 -16.866 1.985
453 1HG2 VAL 65 1HG2 VAL 65 0.593 -13.101 2.213
454 2HG2 VAL 65 2HG2 VAL 65 0.215 -14.373 3.400
455 3HG2 VAL 65 3HG2 VAL 65 1.812 -13.587 3.415
456 H ASN 66 H ASN 66 4.404 -14.088 -0.645
457 HA ASN 66 HA ASN 66 5.269 -12.060 1.252
458 1HB ASN 66 2HB ASN 66 6.937 -13.734 -0.699
459 2HB ASN 66 1HB ASN 66 7.581 -12.637 0.507
460 2HD2 ASN 66 2HD2 ASN 66 6.644 -13.032 2.782
461 1HD2 ASN 66 1HD2 ASN 66 6.643 -14.672 3.338
462 H SER 67 H SER 67 3.625 -12.125 -1.519
463 HA SER 67 HA SER 67 5.300 -10.665 -3.265
464 1HB SER 67 1HB SER 67 2.872 -10.223 -4.322
465 2HB SER 67 2HB SER 67 3.690 -11.764 -4.495
466 HG SER 67 HG SER 67 1.431 -11.924 -3.762
467 H TRP 68 H TRP 68 5.463 -8.425 -3.547
468 HA TRP 68 HA TRP 68 4.164 -6.827 -1.487
469 1HB TRP 68 1HB TRP 68 6.445 -6.417 -1.511
470 2HB TRP 68 2HB TRP 68 6.555 -6.476 -3.259
471 HD1 TRP 68 HD1 TRP 68 6.690 -4.127 -4.398
472 HE1 TRP 68 HE1 TRP 68 6.177 -1.609 -3.799
473 HE3 TRP 68 HE3 TRP 68 4.611 -5.083 0.142
474 HZ2 TRP 68 HZ2 TRP 68 4.985 -0.328 -1.544
475 HZ3 TRP 68 HZ3 TRP 68 3.798 -3.143 1.479
476 HH2 TRP 68 HH2 TRP 68 3.959 -0.830 0.704
477 H TYR 69 H TYR 69 3.086 -8.087 -4.124
478 HA TYR 69 HA TYR 69 1.922 -5.568 -5.220
479 1HB TYR 69 1HB TYR 69 3.325 -6.560 -6.889
480 2HB TYR 69 2HB TYR 69 2.673 -8.176 -6.568
481 HD1 TYR 69 HD1 TYR 69 0.152 -8.547 -7.035
482 HD2 TYR 69 HD2 TYR 69 2.403 -5.227 -8.574
483 HE1 TYR 69 HE1 TYR 69 -1.555 -8.209 -8.802
484 HE2 TYR 69 HE2 TYR 69 0.695 -4.889 -10.341
485 HH TYR 69 HH TYR 69 -1.236 -6.742 -11.495
486 H LYS 70 H LYS 70 1.339 -8.448 -3.428
487 HA LYS 70 HA LYS 70 -1.434 -8.542 -4.351
488 1HB LYS 70 1HB LYS 70 -0.005 -10.633 -4.245
489 2HB LYS 70 2HB LYS 70 -0.013 -10.472 -2.501
490 1HG LYS 70 1HG LYS 70 -2.675 -10.241 -2.906
491 2HG LYS 70 2HG LYS 70 -2.288 -11.141 -4.359
492 1HD LYS 70 1HD LYS 70 -1.308 -12.042 -1.620
493 2HD LYS 70 2HD LYS 70 -2.887 -12.502 -2.224
494 1HE LYS 70 2HE LYS 70 -0.192 -13.120 -3.519
495 2HE LYS 70 1HE LYS 70 -1.282 -14.271 -2.772
496 1HZ LYS 70 1HZ LYS 70 -2.846 -13.080 -4.582
497 2HZ LYS 70 2HZ LYS 70 -1.412 -13.093 -5.362
498 3HZ LYS 70 3HZ LYS 70 -2.059 -14.491 -4.821
499 H VAL 71 H VAL 71 0.637 -8.092 -1.432
500 HA VAL 71 HA VAL 71 -1.506 -7.734 0.344
501 HB VAL 71 HB VAL 71 0.231 -6.729 1.792
502 1HG1 VAL 71 1HG1 VAL 71 -0.140 -9.277 1.317
503 2HG1 VAL 71 2HG1 VAL 71 1.452 -9.171 0.526
504 3HG1 VAL 71 3HG1 VAL 71 1.283 -8.747 2.247
505 1HG2 VAL 71 1HG2 VAL 71 1.458 -5.929 -0.508
506 2HG2 VAL 71 2HG2 VAL 71 2.256 -6.026 1.081
507 3HG2 VAL 71 3HG2 VAL 71 2.428 -7.360 -0.085
508 H VAL 72 H VAL 72 -0.528 -5.893 -2.331
509 HA VAL 72 HA VAL 72 -1.459 -3.401 -1.107
510 HB VAL 72 HB VAL 72 0.062 -3.990 -3.652
511 1HG1 VAL 72 1HG1 VAL 72 -1.636 -2.016 -3.658
512 2HG1 VAL 72 2HG1 VAL 72 -0.458 -1.218 -2.589
513 3HG1 VAL 72 3HG1 VAL 72 0.027 -1.730 -4.223
514 1HG2 VAL 72 1HG2 VAL 72 1.013 -3.874 -1.085
515 2HG2 VAL 72 2HG2 VAL 72 1.964 -3.510 -2.544
516 3HG2 VAL 72 3HG2 VAL 72 1.212 -2.188 -1.619
517 H HIS 73 H HIS 73 -1.849 -5.455 -4.078
518 HA HIS 73 HA HIS 73 -4.387 -4.124 -4.548
519 1HB HIS 73 2HB HIS 73 -2.948 -6.171 -6.255
520 2HB HIS 73 1HB HIS 73 -4.333 -5.203 -6.721
521 HD1 HIS 73 HD1 HIS 73 -0.611 -4.971 -6.133
522 HD2 HIS 73 HD2 HIS 73 -3.762 -2.545 -7.467
523 HE1 HIS 73 HE1 HIS 73 0.467 -2.890 -7.143
524 H ASP 74 H ASP 74 -3.865 -5.995 -2.234
525 HA ASP 74 HA ASP 74 -5.175 -8.404 -2.920
526 1HB ASP 74 1HB ASP 74 -3.832 -7.227 -0.614
527 2HB ASP 74 2HB ASP 74 -5.345 -7.949 -0.102
528 H ALA 75 H ALA 75 -7.413 -8.740 -2.952
529 HA ALA 75 HA ALA 75 -9.071 -6.579 -1.861
530 1HB ALA 75 1HB ALA 75 -9.873 -8.721 -3.860
531 2HB ALA 75 3HB ALA 75 -9.132 -7.177 -4.347
532 3HB ALA 75 2HB ALA 75 -10.698 -7.185 -3.502
533 H LYS 76 H LYS 76 -7.818 -9.582 -1.065
534 HA LYS 76 HA LYS 76 -10.257 -10.643 0.071
535 1HB LYS 76 1HB LYS 76 -8.363 -11.985 -1.058
536 2HB LYS 76 2HB LYS 76 -7.468 -11.744 0.429
537 1HG LYS 76 1HG LYS 76 -9.645 -12.625 1.620
538 2HG LYS 76 2HG LYS 76 -10.092 -13.221 0.034
539 1HD LYS 76 2HD LYS 76 -8.879 -15.073 0.594
540 2HD LYS 76 1HD LYS 76 -7.477 -14.099 0.200
541 1HE LYS 76 1HE LYS 76 -7.191 -13.432 2.539
542 2HE LYS 76 2HE LYS 76 -8.717 -14.168 2.989
543 1HZ LYS 76 1HZ LYS 76 -6.573 -15.750 1.779
544 2HZ LYS 76 2HZ LYS 76 -6.630 -15.484 3.390
545 3HZ LYS 76 3HZ LYS 76 -7.852 -16.276 2.649
546 H GLY 77 H GLY 77 -10.517 -11.058 2.375
547 1HA GLY 77 2HA GLY 77 -10.667 -9.379 4.188
548 2HA GLY 77 1HA GLY 77 -8.932 -9.191 4.037
549 H GLY 78 H GLY 78 -9.046 -9.791 6.422
550 1HA GLY 78 2HA GLY 78 -8.428 -12.599 6.696
551 2HA GLY 78 1HA GLY 78 -9.895 -12.110 7.520
552 H ALA 79 H ALA 79 -6.364 -11.507 7.244
553 HA ALA 79 HA ALA 79 -6.199 -11.059 10.053
554 1HB ALA 79 1HB ALA 79 -3.759 -10.658 9.446
555 2HB ALA 79 3HB ALA 79 -4.217 -10.946 7.751
556 3HB ALA 79 2HB ALA 79 -4.418 -12.238 8.958
557 H LYS 80 H LYS 80 -5.829 -9.037 7.070
558 HA LYS 80 HA LYS 80 -6.788 -6.756 8.473
559 1HB LYS 80 1HB LYS 80 -4.524 -5.513 7.798
560 2HB LYS 80 2HB LYS 80 -4.778 -6.226 9.378
561 1HG LYS 80 1HG LYS 80 -3.727 -8.382 8.471
562 2HG LYS 80 2HG LYS 80 -3.310 -7.491 7.020
563 1HD LYS 80 1HD LYS 80 -2.409 -6.797 9.856
564 2HD LYS 80 2HD LYS 80 -1.410 -7.533 8.619
565 1HE LYS 80 1HE LYS 80 -2.750 -4.809 8.285
566 2HE LYS 80 2HE LYS 80 -1.116 -5.009 8.886
567 1HZ LYS 80 1HZ LYS 80 -1.381 -6.509 6.566
568 2HZ LYS 80 2HZ LYS 80 -1.967 -5.017 6.256
569 3HZ LYS 80 3HZ LYS 80 -0.444 -5.195 6.816
570 HA PRO 81 HA PRO 81 -7.859 -5.653 4.384
571 1HB PRO 81 1HB PRO 81 -7.981 -2.914 4.572
572 2HB PRO 81 2HB PRO 81 -9.128 -4.001 5.421
573 1HG PRO 81 1HG PRO 81 -6.801 -2.675 6.310
574 2HG PRO 81 2HG PRO 81 -8.309 -2.762 7.279
575 1HD PRO 81 1HD PRO 81 -6.139 -4.339 7.828
576 2HD PRO 81 2HD PRO 81 -7.805 -4.974 7.990
577 H THR 82 H THR 82 -7.138 -3.638 2.680
578 HA THR 82 HA THR 82 -4.216 -3.471 2.783
579 HB THR 82 HB THR 82 -4.218 -4.187 0.334
580 HG1 THR 82 HG1 THR 82 -6.368 -5.442 -0.039
581 1HG2 THR 82 1HG2 THR 82 -4.562 -5.878 2.656
582 2HG2 THR 82 2HG2 THR 82 -5.509 -6.573 1.318
583 3HG2 THR 82 3HG2 THR 82 -3.764 -6.283 1.117
584 H CYS 83 H CYS 83 -3.856 -2.273 0.265
585 HA CYS 83 HA CYS 83 -4.759 0.344 0.932
586 1HB CYS 83 2HB CYS 83 -3.390 -0.401 -1.639
587 2HB CYS 83 1HB CYS 83 -3.344 1.118 -0.767
588 H ILE 84 H ILE 84 -6.244 -2.305 -0.476
589 HA ILE 84 HA ILE 84 -7.822 -0.615 -2.288
590 HB ILE 84 HB ILE 84 -6.911 -3.451 -2.421
591 1HG1 ILE 84 1HG1 ILE 84 -5.781 -1.597 -3.658
592 2HG1 ILE 84 2HG1 ILE 84 -6.365 -2.900 -4.674
593 1HG2 ILE 84 1HG2 ILE 84 -9.573 -2.428 -3.369
594 2HG2 ILE 84 2HG2 ILE 84 -8.712 -3.691 -4.281
595 3HG2 ILE 84 3HG2 ILE 84 -9.160 -3.971 -2.582
596 1HD1 ILE 84 1HD1 ILE 84 -8.380 -0.773 -4.256
597 2HD1 ILE 84 2HD1 ILE 84 -6.901 -0.208 -5.070
598 3HD1 ILE 84 3HD1 ILE 84 -7.843 -1.549 -5.765
599 H SER 85 H SER 85 -7.897 -3.206 0.223
600 HA SER 85 HA SER 85 -10.594 -3.518 0.364
601 1HB SER 85 1HB SER 85 -8.491 -4.572 1.690
602 2HB SER 85 2HB SER 85 -9.040 -3.469 2.937
603 HG SER 85 HG SER 85 -10.183 -5.341 3.317
604 H CYS 86 H CYS 86 -8.554 -1.368 2.490
605 HA CYS 86 HA CYS 86 -10.703 -0.116 3.707
606 1HB CYS 86 1HB CYS 86 -8.219 -0.120 4.378
607 2HB CYS 86 2HB CYS 86 -8.019 1.201 3.244
608 H HIS 87 H HIS 87 -8.549 1.008 0.988
609 HA HIS 87 HA HIS 87 -9.801 3.340 0.411
610 1HB HIS 87 1HB HIS 87 -8.310 1.330 -1.245
611 2HB HIS 87 2HB HIS 87 -9.068 2.695 -2.041
612 HD1 HIS 87 HD1 HIS 87 -6.785 3.759 -2.674
613 HD2 HIS 87 HD2 HIS 87 -7.360 3.270 1.453
614 HE1 HIS 87 HE1 HIS 87 -4.941 5.102 -1.531
615 H LYS 88 H LYS 88 -10.802 0.004 -0.420
616 HA LYS 88 HA LYS 88 -12.794 0.703 -2.252
617 1HB LYS 88 1HB LYS 88 -12.044 -1.695 -0.658
618 2HB LYS 88 2HB LYS 88 -13.695 -1.634 -1.243
619 1HG LYS 88 1HG LYS 88 -12.848 -1.194 -3.564
620 2HG LYS 88 2HG LYS 88 -11.201 -1.276 -2.973
621 1HD LYS 88 1HD LYS 88 -11.247 -3.518 -3.300
622 2HD LYS 88 2HD LYS 88 -12.426 -3.645 -2.011
623 1HE LYS 88 1HE LYS 88 -14.217 -3.060 -3.803
624 2HE LYS 88 2HE LYS 88 -12.964 -3.345 -4.995
625 1HZ LYS 88 1HZ LYS 88 -12.849 -5.476 -3.297
626 2HZ LYS 88 2HZ LYS 88 -14.447 -5.222 -3.521
627 3HZ LYS 88 3HZ LYS 88 -13.471 -5.466 -4.807
628 H ASP 89 H ASP 89 -12.874 0.171 1.328
629 HA ASP 89 HA ASP 89 -15.564 0.479 1.646
630 1HB ASP 89 1HB ASP 89 -13.539 -0.025 3.324
631 2HB ASP 89 2HB ASP 89 -13.644 1.695 3.642
632 H LYS 90 H LYS 90 -12.889 2.891 1.421
633 HA LYS 90 HA LYS 90 -14.350 5.144 2.165
634 1HB LYS 90 1HB LYS 90 -11.764 4.545 0.879
635 2HB LYS 90 2HB LYS 90 -12.449 6.093 0.426
636 1HG LYS 90 2HG LYS 90 -11.960 5.105 3.275
637 2HG LYS 90 1HG LYS 90 -11.043 6.342 2.439
638 1HD LYS 90 1HD LYS 90 -13.527 7.414 2.159
639 2HD LYS 90 2HD LYS 90 -13.799 6.494 3.626
640 1HE LYS 90 1HE LYS 90 -11.842 7.603 4.703
641 2HE LYS 90 2HE LYS 90 -11.524 8.497 3.230
642 1HZ LYS 90 1HZ LYS 90 -14.173 8.901 3.849
643 2HZ LYS 90 2HZ LYS 90 -13.354 9.087 5.250
644 3HZ LYS 90 3HZ LYS 90 -12.955 9.985 3.945
645 H ALA 91 H ALA 91 -13.930 3.462 -0.985
646 HA ALA 91 HA ALA 91 -15.654 5.442 -2.245
647 1HB ALA 91 1HB ALA 91 -14.772 3.139 -3.845
648 2HB ALA 91 3HB ALA 91 -14.557 4.881 -4.139
649 3HB ALA 91 2HB ALA 91 -13.422 4.010 -3.080
650 H GLY 92 H GLY 92 -16.528 3.468 -0.083
651 1HA GLY 92 2HA GLY 92 -18.064 1.797 0.222
652 2HA GLY 92 1HA GLY 92 -18.222 1.597 -1.512
653 H ASP 93 H ASP 93 -19.059 3.885 -2.595
654 HA ASP 93 HA ASP 93 -21.677 4.039 -2.023
655 1HB ASP 93 1HB ASP 93 -21.736 6.396 -0.915
656 2HB ASP 93 2HB ASP 93 -21.443 5.010 0.117
657 H ASP 94 H ASP 94 -18.941 6.434 -2.374
658 HA ASP 94 HA ASP 94 -20.306 7.741 -4.500
659 1HB ASP 94 1HB ASP 94 -18.868 8.990 -2.915
660 2HB ASP 94 2HB ASP 94 -17.478 8.029 -3.382
661 H LYS 95 H LYS 95 -20.072 7.211 -6.687
662 HA LYS 95 HA LYS 95 -18.398 5.016 -7.390
663 1HB LYS 95 1HB LYS 95 -20.747 5.813 -8.311
664 2HB LYS 95 2HB LYS 95 -19.765 6.758 -9.413
665 1HG LYS 95 1HG LYS 95 -18.506 4.653 -10.033
666 2HG LYS 95 2HG LYS 95 -19.582 3.736 -8.998
667 1HD LYS 95 1HD LYS 95 -21.528 4.360 -10.357
668 2HD LYS 95 2HD LYS 95 -20.566 5.475 -11.307
669 1HE LYS 95 1HE LYS 95 -20.171 3.768 -12.753
670 2HE LYS 95 2HE LYS 95 -19.159 3.043 -11.519
671 1HZ LYS 95 1HZ LYS 95 -21.646 2.380 -10.747
672 2HZ LYS 95 2HZ LYS 95 -21.760 2.288 -12.373
673 3HZ LYS 95 3HZ LYS 95 -20.632 1.411 -11.583
674 H GLU 96 H GLU 96 -18.338 8.586 -7.805
675 HA GLU 96 HA GLU 96 -16.152 8.581 -9.535
676 1HB GLU 96 1HB GLU 96 -17.727 10.493 -9.233
677 2HB GLU 96 2HB GLU 96 -17.103 10.755 -7.617
678 1HG GLU 96 1HG GLU 96 -14.747 10.843 -8.899
679 2HG GLU 96 2HG GLU 96 -15.755 11.244 -10.275
680 H LEU 97 H LEU 97 -16.486 8.238 -6.039
681 HA LEU 97 HA LEU 97 -13.798 8.984 -5.446
682 1HB LEU 97 1HB LEU 97 -15.874 9.061 -3.945
683 2HB LEU 97 2HB LEU 97 -15.638 7.338 -3.725
684 HG LEU 97 HG LEU 97 -14.678 8.534 -1.867
685 1HD1 LEU 97 1HD1 LEU 97 -13.474 6.523 -3.101
686 2HD1 LEU 97 2HD1 LEU 97 -12.207 7.749 -3.348
687 3HD1 LEU 97 3HD1 LEU 97 -12.741 7.340 -1.700
688 1HD2 LEU 97 1HD2 LEU 97 -13.887 10.417 -3.863
689 2HD2 LEU 97 2HD2 LEU 97 -13.803 10.557 -2.090
690 3HD2 LEU 97 3HD2 LEU 97 -12.434 9.866 -2.994
691 H LYS 98 H LYS 98 -15.371 6.199 -6.793
692 HA LYS 98 HA LYS 98 -13.306 4.382 -5.902
693 1HB LYS 98 1HB LYS 98 -15.762 3.785 -6.126
694 2HB LYS 98 2HB LYS 98 -15.554 3.868 -7.864
695 1HG LYS 98 1HG LYS 98 -13.486 2.250 -7.403
696 2HG LYS 98 2HG LYS 98 -14.325 1.918 -5.901
697 1HD LYS 98 1HD LYS 98 -15.604 1.675 -8.665
698 2HD LYS 98 2HD LYS 98 -14.919 0.327 -7.778
699 1HE LYS 98 1HE LYS 98 -16.604 0.372 -6.125
700 2HE LYS 98 2HE LYS 98 -16.983 2.060 -6.404
701 1HZ LYS 98 1HZ LYS 98 -17.553 0.978 -8.764
702 2HZ LYS 98 2HZ LYS 98 -17.947 -0.258 -7.771
703 3HZ LYS 98 3HZ LYS 98 -18.649 1.203 -7.575
704 H LYS 99 H LYS 99 -12.745 6.864 -7.588
705 HA LYS 99 HA LYS 99 -11.238 5.421 -9.631
706 1HB LYS 99 1HB LYS 99 -13.240 7.609 -10.092
707 2HB LYS 99 2HB LYS 99 -11.815 7.532 -11.108
708 1HG LYS 99 1HG LYS 99 -13.090 6.078 -12.347
709 2HG LYS 99 2HG LYS 99 -12.538 4.900 -11.172
710 1HD LYS 99 1HD LYS 99 -14.586 5.357 -9.781
711 2HD LYS 99 2HD LYS 99 -15.144 6.488 -10.998
712 1HE LYS 99 1HE LYS 99 -15.846 4.820 -12.405
713 2HE LYS 99 2HE LYS 99 -14.409 3.854 -12.136
714 1HZ LYS 99 1HZ LYS 99 -16.039 3.975 -9.829
715 2HZ LYS 99 2HZ LYS 99 -16.863 3.379 -11.107
716 3HZ LYS 99 3HZ LYS 99 -15.473 2.669 -10.628
717 H LYS 100 H LYS 100 -10.185 6.086 -7.190
718 HA LYS 100 HA LYS 100 -8.139 7.890 -7.968
719 1HB LYS 100 1HB LYS 100 -8.675 9.352 -5.814
720 2HB LYS 100 2HB LYS 100 -9.301 9.759 -7.399
721 1HG LYS 100 1HG LYS 100 -11.428 8.567 -6.884
722 2HG LYS 100 2HG LYS 100 -10.802 8.104 -5.314
723 1HD LYS 100 2HD LYS 100 -12.192 10.051 -4.967
724 2HD LYS 100 1HD LYS 100 -10.531 10.570 -4.760
725 1HE LYS 100 1HE LYS 100 -11.705 12.212 -6.147
726 2HE LYS 100 2HE LYS 100 -10.503 11.399 -7.130
727 1HZ LYS 100 1HZ LYS 100 -13.356 10.698 -7.037
728 2HZ LYS 100 2HZ LYS 100 -12.624 11.533 -8.235
729 3HZ LYS 100 3HZ LYS 100 -12.232 9.969 -7.971
730 H LEU 101 H LEU 101 -9.878 6.266 -5.243
731 HA LEU 101 HA LEU 101 -7.319 5.732 -3.981
732 1HB LEU 101 2HB LEU 101 -10.061 4.918 -3.034
733 2HB LEU 101 1HB LEU 101 -8.581 5.018 -2.102
734 HG LEU 101 HG LEU 101 -10.304 7.266 -3.134
735 1HD1 LEU 101 1HD1 LEU 101 -10.391 5.940 -0.780
736 2HD1 LEU 101 2HD1 LEU 101 -9.238 7.234 -0.373
737 3HD1 LEU 101 3HD1 LEU 101 -10.859 7.646 -0.983
738 1HD2 LEU 101 1HD2 LEU 101 -7.904 7.732 -3.674
739 2HD2 LEU 101 2HD2 LEU 101 -8.651 8.888 -2.545
740 3HD2 LEU 101 3HD2 LEU 101 -7.550 7.630 -1.932
741 H THR 102 H THR 102 -9.805 4.198 -5.976
742 HA THR 102 HA THR 102 -8.235 1.709 -5.836
743 HB THR 102 HB THR 102 -10.322 0.471 -5.939
744 HG1 THR 102 HG1 THR 102 -11.569 1.748 -7.347
745 1HG2 THR 102 1HG2 THR 102 -9.819 1.661 -3.674
746 2HG2 THR 102 2HG2 THR 102 -11.044 2.853 -4.173
747 3HG2 THR 102 3HG2 THR 102 -11.500 1.146 -3.952
748 H GLY 103 H GLY 103 -8.733 4.372 -7.649
749 1HA GLY 103 2HA GLY 103 -8.536 4.841 -9.837
750 2HA GLY 103 1HA GLY 103 -9.531 3.435 -10.161
751 H CYS 104 H CYS 104 -8.603 1.869 -11.399
752 HA CYS 104 HA CYS 104 -6.113 0.789 -10.882
753 1HB CYS 104 1HB CYS 104 -8.190 0.524 -12.917
754 2HB CYS 104 2HB CYS 104 -6.582 0.275 -13.569
755 H LYS 105 H LYS 105 -7.184 3.029 -13.551
756 HA LYS 105 HA LYS 105 -4.408 3.985 -13.660
757 1HB LYS 105 2HB LYS 105 -4.699 4.306 -16.076
758 2HB LYS 105 1HB LYS 105 -4.853 2.622 -15.616
759 1HG LYS 105 1HG LYS 105 -7.048 2.515 -16.258
760 2HG LYS 105 2HG LYS 105 -7.435 4.066 -15.540
761 1HD LYS 105 1HD LYS 105 -6.258 5.189 -17.503
762 2HD LYS 105 2HD LYS 105 -6.078 3.609 -18.237
763 1HE LYS 105 1HE LYS 105 -8.073 4.578 -19.189
764 2HE LYS 105 2HE LYS 105 -8.611 3.329 -18.083
765 1HZ LYS 105 1HZ LYS 105 -8.479 5.468 -16.498
766 2HZ LYS 105 2HZ LYS 105 -8.938 6.159 -17.905
767 3HZ LYS 105 3HZ LYS 105 -9.837 4.963 -17.250
768 H GLY 106 H GLY 106 -4.101 6.208 -13.682
769 1HA GLY 106 2HA GLY 106 -6.255 8.023 -14.189
770 2HA GLY 106 1HA GLY 106 -4.636 8.406 -13.636
771 H SER 107 H SER 107 -4.515 6.784 -11.265
772 HA SER 107 HA SER 107 -6.622 8.057 -9.699
773 1HB SER 107 1HB SER 107 -6.636 6.191 -8.209
774 2HB SER 107 2HB SER 107 -6.634 5.501 -9.820
775 HG SER 107 HG SER 107 -4.969 4.378 -9.037
776 H ALA 108 H ALA 108 -5.706 7.964 -7.160
777 HA ALA 108 HA ALA 108 -3.513 9.785 -7.221
778 1HB ALA 108 1HB ALA 108 -4.106 10.219 -5.027
779 2HB ALA 108 3HB ALA 108 -5.641 9.558 -5.636
780 3HB ALA 108 2HB ALA 108 -4.539 8.525 -4.694
781 H CYS 109 H CYS 109 -3.678 6.452 -7.542
782 HA CYS 109 HA CYS 109 -1.212 6.045 -6.031
783 1HB CYS 109 1HB CYS 109 -3.298 4.109 -7.061
784 2HB CYS 109 2HB CYS 109 -1.725 3.579 -6.500
785 H HIS 110 H HIS 110 -2.841 5.531 -9.230
786 HA HIS 110 HA HIS 110 -0.161 5.391 -10.408
787 1HB HIS 110 1HB HIS 110 -2.712 4.019 -11.298
788 2HB HIS 110 2HB HIS 110 -1.225 4.045 -12.226
789 HD1 HIS 110 HD1 HIS 110 0.951 3.251 -10.395
790 HD2 HIS 110 HD2 HIS 110 -2.898 1.623 -10.030
791 HE1 HIS 110 HE1 HIS 110 1.223 1.050 -9.133
792 HA PRO 111 HA PRO 111 -2.091 9.097 -12.181
793 1HB PRO 111 1HB PRO 111 -0.290 10.938 -11.408
794 2HB PRO 111 2HB PRO 111 -1.401 10.205 -10.205
795 1HG PRO 111 2HG PRO 111 1.260 9.495 -11.043
796 2HG PRO 111 1HG PRO 111 1.066 9.507 -9.259
797 1HD PRO 111 1HD PRO 111 1.094 7.171 -10.635
798 2HD PRO 111 2HD PRO 111 -0.086 7.408 -9.310
799 H SER 112 H SER 112 -1.372 7.602 -14.135
800 HA SER 112 HA SER 112 0.358 9.171 -15.686
801 1HB SER 112 1HB SER 112 1.618 7.095 -14.158
802 2HB SER 112 2HB SER 112 1.615 6.569 -15.829
803 HG SER 112 HG SER 112 2.328 9.089 -16.024
No H/Q in entry = 803
Start of MODEL 4
1 H1 VAL 1 H1 VAL 1 8.749 9.748 18.107
2 H2 VAL 1 H2 VAL 1 8.158 8.254 17.708
3 H3 VAL 1 H3 VAL 1 9.537 8.383 18.615
4 HA VAL 1 HA VAL 1 10.816 9.078 16.924
5 HB VAL 1 HB VAL 1 10.640 6.849 16.511
6 1HG1 VAL 1 1HG1 VAL 1 7.746 7.371 16.564
7 2HG1 VAL 1 2HG1 VAL 1 8.229 6.111 15.404
8 3HG1 VAL 1 3HG1 VAL 1 8.669 5.955 17.122
9 1HG2 VAL 1 1HG2 VAL 1 11.066 8.007 14.372
10 2HG2 VAL 1 2HG2 VAL 1 10.220 6.458 14.136
11 3HG2 VAL 1 3HG2 VAL 1 9.320 7.990 14.024
12 H ASP 2 H ASP 2 7.535 10.057 16.812
13 HA ASP 2 HA ASP 2 6.482 11.594 15.704
14 1HB ASP 2 1HB ASP 2 9.104 12.534 15.784
15 2HB ASP 2 2HB ASP 2 8.746 12.610 14.071
16 H VAL 3 H VAL 3 5.143 11.013 13.988
17 HA VAL 3 HA VAL 3 5.851 9.172 12.061
18 HB VAL 3 HB VAL 3 3.569 10.158 12.920
19 1HG1 VAL 3 1HG1 VAL 3 3.933 12.417 12.002
20 2HG1 VAL 3 2HG1 VAL 3 3.994 11.735 10.359
21 3HG1 VAL 3 3HG1 VAL 3 2.489 11.644 11.305
22 1HG2 VAL 3 1HG2 VAL 3 3.946 8.172 11.432
23 2HG2 VAL 3 2HG2 VAL 3 2.440 9.061 11.101
24 3HG2 VAL 3 3HG2 VAL 3 3.849 9.267 10.033
25 HA PRO 4 HA PRO 4 8.812 11.270 9.560
26 1HB PRO 4 1HB PRO 4 7.521 9.418 7.529
27 2HB PRO 4 2HB PRO 4 9.250 9.726 7.894
28 1HG PRO 4 1HG PRO 4 8.209 7.471 9.023
29 2HG PRO 4 2HG PRO 4 9.381 8.587 9.797
30 1HD PRO 4 2HD PRO 4 6.376 8.290 10.200
31 2HD PRO 4 1HD PRO 4 7.651 8.628 11.410
32 H ALA 5 H ALA 5 8.759 12.607 7.484
33 HA ALA 5 HA ALA 5 6.208 13.965 7.359
34 1HB ALA 5 1HB ALA 5 7.456 15.756 6.749
35 2HB ALA 5 3HB ALA 5 8.391 14.817 5.561
36 3HB ALA 5 2HB ALA 5 8.844 14.776 7.282
37 H ASP 6 H ASP 6 5.020 14.301 5.375
38 HA ASP 6 HA ASP 6 4.657 12.030 3.919
39 1HB ASP 6 2HB ASP 6 3.112 13.280 2.670
40 2HB ASP 6 1HB ASP 6 3.231 14.225 4.140
41 H GLY 7 H GLY 7 4.634 12.824 1.150
42 1HA GLY 7 2HA GLY 7 7.123 13.909 0.306
43 2HA GLY 7 1HA GLY 7 5.929 13.086 -0.678
44 H ALA 8 H ALA 8 5.853 10.594 0.906
45 HA ALA 8 HA ALA 8 8.594 9.621 0.656
46 1HB ALA 8 1HB ALA 8 6.289 9.066 2.349
47 2HB ALA 8 2HB ALA 8 6.898 7.575 1.590
48 3HB ALA 8 3HB ALA 8 7.991 8.589 2.562
49 H LYS 9 H LYS 9 9.016 9.233 -1.500
50 HA LYS 9 HA LYS 9 7.004 8.204 -3.227
51 1HB LYS 9 2HB LYS 9 8.486 8.625 -4.901
52 2HB LYS 9 1HB LYS 9 9.164 9.678 -3.676
53 1HG LYS 9 2HG LYS 9 11.120 8.553 -3.904
54 2HG LYS 9 1HG LYS 9 10.349 7.179 -3.137
55 1HD LYS 9 1HD LYS 9 9.844 6.132 -5.200
56 2HD LYS 9 2HD LYS 9 9.929 7.633 -6.101
57 1HE LYS 9 1HE LYS 9 12.370 7.710 -5.871
58 2HE LYS 9 2HE LYS 9 12.359 6.346 -4.771
59 1HZ LYS 9 1HZ LYS 9 11.029 5.704 -7.164
60 2HZ LYS 9 2HZ LYS 9 12.535 6.246 -7.487
61 3HZ LYS 9 3HZ LYS 9 12.322 4.978 -6.480
62 H ILE 10 H ILE 10 6.824 6.104 -4.134
63 HA ILE 10 HA ILE 10 8.382 4.062 -2.712
64 HB ILE 10 HB ILE 10 5.460 3.855 -3.437
65 1HG1 ILE 10 1HG1 ILE 10 6.530 4.187 -0.636
66 2HG1 ILE 10 2HG1 ILE 10 6.112 5.577 -1.618
67 1HG2 ILE 10 1HG2 ILE 10 7.239 1.837 -3.068
68 2HG2 ILE 10 2HG2 ILE 10 6.661 2.084 -1.403
69 3HG2 ILE 10 3HG2 ILE 10 5.500 1.730 -2.704
70 1HD1 ILE 10 1HD1 ILE 10 4.150 3.283 -1.306
71 2HD1 ILE 10 2HD1 ILE 10 4.273 4.555 -0.067
72 3HD1 ILE 10 3HD1 ILE 10 3.821 4.979 -1.735
73 H ASP 11 H ASP 11 9.485 2.718 -4.039
74 HA ASP 11 HA ASP 11 8.384 1.960 -6.524
75 1HB ASP 11 1HB ASP 11 9.224 4.018 -7.393
76 2HB ASP 11 2HB ASP 11 10.667 3.953 -6.402
77 H PHE 12 H PHE 12 8.796 -0.188 -5.725
78 HA PHE 12 HA PHE 12 11.630 -0.801 -5.259
79 1HB PHE 12 1HB PHE 12 9.019 -2.137 -4.320
80 2HB PHE 12 2HB PHE 12 10.619 -2.731 -3.921
81 HD1 PHE 12 HD1 PHE 12 12.100 -0.372 -3.156
82 HD2 PHE 12 HD2 PHE 12 8.039 -1.338 -2.392
83 HE1 PHE 12 HE1 PHE 12 12.135 1.092 -1.118
84 HE2 PHE 12 HE2 PHE 12 8.074 0.127 -0.354
85 HZ PHE 12 HZ PHE 12 10.122 1.324 0.258
86 H ILE 13 H ILE 13 8.719 -1.439 -7.134
87 HA ILE 13 HA ILE 13 9.952 -3.819 -8.295
88 HB ILE 13 HB ILE 13 7.163 -2.679 -8.491
89 1HG1 ILE 13 1HG1 ILE 13 8.071 -5.257 -7.191
90 2HG1 ILE 13 2HG1 ILE 13 7.917 -3.751 -6.309
91 1HG2 ILE 13 1HG2 ILE 13 8.445 -5.048 -9.854
92 2HG2 ILE 13 2HG2 ILE 13 6.689 -4.930 -9.593
93 3HG2 ILE 13 3HG2 ILE 13 7.527 -3.704 -10.575
94 1HD1 ILE 13 1HD1 ILE 13 5.521 -3.585 -7.018
95 2HD1 ILE 13 2HD1 ILE 13 5.687 -5.143 -7.863
96 3HD1 ILE 13 3HD1 ILE 13 5.849 -5.069 -6.092
97 H ALA 14 H ALA 14 11.581 -3.018 -9.623
98 HA ALA 14 HA ALA 14 11.294 -0.728 -11.208
99 1HB ALA 14 1HB ALA 14 13.479 -1.526 -10.668
100 2HB ALA 14 2HB ALA 14 13.288 -1.777 -12.419
101 3HB ALA 14 3HB ALA 14 13.123 -3.151 -11.300
102 H GLY 15 H GLY 15 11.636 -0.985 -13.761
103 1HA GLY 15 2HA GLY 15 9.416 -1.437 -15.058
104 2HA GLY 15 1HA GLY 15 9.908 -3.102 -14.822
105 H GLY 16 H GLY 16 9.673 -2.241 -17.415
106 1HA GLY 16 2HA GLY 16 10.762 -1.926 -19.363
107 2HA GLY 16 1HA GLY 16 12.010 -2.919 -18.637
108 H GLU 17 H GLU 17 10.823 0.478 -18.934
109 HA GLU 17 HA GLU 17 13.511 1.351 -18.246
110 1HB GLU 17 1HB GLU 17 13.112 1.203 -20.786
111 2HB GLU 17 2HB GLU 17 11.954 2.505 -20.594
112 1HG GLU 17 1HG GLU 17 13.895 3.768 -19.355
113 2HG GLU 17 2HG GLU 17 14.948 2.567 -20.075
114 H LYS 18 H LYS 18 10.882 1.268 -16.797
115 HA LYS 18 HA LYS 18 10.896 4.031 -15.991
116 1HB LYS 18 1HB LYS 18 8.924 3.112 -17.850
117 2HB LYS 18 2HB LYS 18 8.130 3.387 -16.313
118 1HG LYS 18 1HG LYS 18 9.152 5.668 -16.189
119 2HG LYS 18 2HG LYS 18 9.953 5.393 -17.723
120 1HD LYS 18 1HD LYS 18 6.937 5.109 -17.488
121 2HD LYS 18 2HD LYS 18 7.667 6.688 -17.702
122 1HE LYS 18 1HE LYS 18 7.583 6.234 -19.938
123 2HE LYS 18 2HE LYS 18 8.979 5.214 -19.652
124 1HZ LYS 18 1HZ LYS 18 7.388 3.404 -19.178
125 2HZ LYS 18 2HZ LYS 18 6.167 4.373 -19.666
126 3HZ LYS 18 3HZ LYS 18 7.335 3.937 -20.721
127 H ASN 19 H ASN 19 8.456 3.827 -14.440
128 HA ASN 19 HA ASN 19 8.344 1.471 -13.007
129 1HB ASN 19 2HB ASN 19 9.564 1.962 -10.979
130 2HB ASN 19 1HB ASN 19 10.678 2.294 -12.290
131 2HD2 ASN 19 2HD2 ASN 19 10.130 4.654 -13.250
132 1HD2 ASN 19 1HD2 ASN 19 10.215 5.920 -12.071
133 H LEU 20 H LEU 20 6.390 1.602 -11.832
134 HA LEU 20 HA LEU 20 4.966 4.071 -11.943
135 1HB LEU 20 1HB LEU 20 4.320 1.366 -10.769
136 2HB LEU 20 2HB LEU 20 3.210 2.722 -10.762
137 HG LEU 20 HG LEU 20 4.270 1.203 -13.150
138 1HD1 LEU 20 1HD1 LEU 20 1.775 1.236 -11.612
139 2HD1 LEU 20 2HD1 LEU 20 1.537 1.393 -13.369
140 3HD1 LEU 20 3HD1 LEU 20 2.436 0.004 -12.713
141 1HD2 LEU 20 1HD2 LEU 20 3.249 3.974 -13.000
142 2HD2 LEU 20 2HD2 LEU 20 4.284 3.187 -14.215
143 3HD2 LEU 20 3HD2 LEU 20 2.520 2.947 -14.258
144 H THR 21 H THR 21 6.150 5.583 -10.702
145 HA THR 21 HA THR 21 6.768 4.939 -7.957
146 HB THR 21 HB THR 21 6.927 7.715 -9.139
147 HG1 THR 21 HG1 THR 21 8.422 6.957 -10.637
148 1HG2 THR 21 1HG2 THR 21 8.597 5.913 -7.349
149 2HG2 THR 21 2HG2 THR 21 9.372 7.255 -8.225
150 3HG2 THR 21 3HG2 THR 21 8.069 7.589 -7.059
151 H VAL 22 H VAL 22 5.260 4.880 -6.420
152 HA VAL 22 HA VAL 22 2.962 6.664 -6.744
153 HB VAL 22 HB VAL 22 3.435 4.145 -5.150
154 1HG1 VAL 22 1HG1 VAL 22 1.191 6.156 -4.985
155 2HG1 VAL 22 2HG1 VAL 22 0.922 4.438 -4.604
156 3HG1 VAL 22 3HG1 VAL 22 2.108 5.382 -3.671
157 1HG2 VAL 22 1HG2 VAL 22 2.133 4.815 -7.711
158 2HG2 VAL 22 2HG2 VAL 22 2.789 3.268 -7.123
159 3HG2 VAL 22 3HG2 VAL 22 1.159 3.787 -6.632
160 H VAL 23 H VAL 23 2.345 8.113 -5.084
161 HA VAL 23 HA VAL 23 4.523 8.664 -3.199
162 HB VAL 23 HB VAL 23 2.346 10.405 -4.368
163 1HG1 VAL 23 1HG1 VAL 23 3.724 10.686 -1.877
164 2HG1 VAL 23 2HG1 VAL 23 4.320 11.939 -2.992
165 3HG1 VAL 23 3HG1 VAL 23 2.578 11.806 -2.651
166 1HG2 VAL 23 1HG2 VAL 23 4.689 9.667 -5.531
167 2HG2 VAL 23 2HG2 VAL 23 3.875 11.223 -5.822
168 3HG2 VAL 23 3HG2 VAL 23 5.208 11.122 -4.646
169 H PHE 24 H PHE 24 4.144 8.711 -0.989
170 HA PHE 24 HA PHE 24 1.376 8.230 -0.163
171 1HB PHE 24 1HB PHE 24 2.911 6.140 -0.279
172 2HB PHE 24 2HB PHE 24 3.931 6.905 0.922
173 HD1 PHE 24 HD1 PHE 24 0.521 5.581 0.344
174 HD2 PHE 24 HD2 PHE 24 3.409 6.770 3.217
175 HE1 PHE 24 HE1 PHE 24 -0.893 4.601 2.171
176 HE2 PHE 24 HE2 PHE 24 1.994 5.791 5.044
177 HZ PHE 24 HZ PHE 24 -0.140 4.718 4.499
178 H ASN 25 H ASN 25 0.856 8.970 1.993
179 HA ASN 25 HA ASN 25 2.944 10.587 3.201
180 1HB ASN 25 1HB ASN 25 1.514 12.148 1.917
181 2HB ASN 25 2HB ASN 25 0.065 11.458 2.622
182 2HD2 ASN 25 2HD2 ASN 25 -0.306 13.726 3.171
183 1HD2 ASN 25 1HD2 ASN 25 0.326 14.363 4.652
184 H HIS 26 H HIS 26 2.728 10.718 5.547
185 HA HIS 26 HA HIS 26 1.039 8.641 6.625
186 1HB HIS 26 1HB HIS 26 3.421 10.188 7.537
187 2HB HIS 26 2HB HIS 26 2.338 9.583 8.775
188 HD1 HIS 26 HD1 HIS 26 4.569 8.355 5.951
189 HD2 HIS 26 HD2 HIS 26 2.510 6.852 9.282
190 HE1 HIS 26 HE1 HIS 26 5.342 5.941 6.239
191 H SER 27 H SER 27 1.152 12.137 6.291
192 HA SER 27 HA SER 27 -0.548 12.655 8.484
193 1HB SER 27 1HB SER 27 -0.723 14.752 6.529
194 2HB SER 27 2HB SER 27 0.143 14.759 8.052
195 HG SER 27 HG SER 27 1.809 15.005 6.671
196 H THR 28 H THR 28 -1.091 10.993 5.653
197 HA THR 28 HA THR 28 -3.738 12.125 5.150
198 HB THR 28 HB THR 28 -2.194 9.896 3.725
199 HG1 THR 28 HG1 THR 28 -1.268 12.195 3.923
200 1HG2 THR 28 1HG2 THR 28 -4.766 10.273 3.311
201 2HG2 THR 28 2HG2 THR 28 -4.262 11.811 2.570
202 3HG2 THR 28 3HG2 THR 28 -3.687 10.268 1.895
203 H HIS 29 H HIS 29 -2.126 9.156 6.362
204 HA HIS 29 HA HIS 29 -4.787 8.114 6.965
205 1HB HIS 29 2HB HIS 29 -2.123 6.670 6.991
206 2HB HIS 29 1HB HIS 29 -3.705 5.947 7.204
207 HD1 HIS 29 HD1 HIS 29 -1.511 7.538 4.552
208 HD2 HIS 29 HD2 HIS 29 -5.114 5.411 4.848
209 HE1 HIS 29 HE1 HIS 29 -2.173 6.916 2.167
210 H LYS 30 H LYS 30 -3.316 10.344 8.403
211 HA LYS 30 HA LYS 30 -2.214 9.417 10.771
212 1HB LYS 30 2HB LYS 30 -2.513 11.658 11.580
213 2HB LYS 30 1HB LYS 30 -2.055 11.730 9.890
214 1HG LYS 30 1HG LYS 30 -4.361 12.149 9.202
215 2HG LYS 30 2HG LYS 30 -4.960 11.828 10.817
216 1HD LYS 30 1HD LYS 30 -2.990 14.077 10.210
217 2HD LYS 30 2HD LYS 30 -4.727 14.306 10.175
218 1HE LYS 30 1HE LYS 30 -4.325 13.015 12.628
219 2HE LYS 30 2HE LYS 30 -2.916 14.048 12.500
220 1HZ LYS 30 1HZ LYS 30 -5.423 15.264 11.783
221 2HZ LYS 30 2HZ LYS 30 -5.248 14.891 13.363
222 3HZ LYS 30 3HZ LYS 30 -4.172 15.879 12.633
223 H ASP 31 H ASP 31 -5.465 9.250 9.583
224 HA ASP 31 HA ASP 31 -6.570 9.119 12.231
225 1HB ASP 31 1HB ASP 31 -8.686 9.128 11.176
226 2HB ASP 31 2HB ASP 31 -7.706 10.123 10.118
227 H VAL 32 H VAL 32 -4.726 7.103 10.362
228 HA VAL 32 HA VAL 32 -6.255 4.702 11.093
229 HB VAL 32 HB VAL 32 -4.163 5.091 8.942
230 1HG1 VAL 32 1HG1 VAL 32 -4.452 2.784 10.112
231 2HG1 VAL 32 2HG1 VAL 32 -5.983 2.703 9.207
232 3HG1 VAL 32 3HG1 VAL 32 -4.440 2.858 8.333
233 1HG2 VAL 32 1HG2 VAL 32 -7.033 5.572 8.975
234 2HG2 VAL 32 2HG2 VAL 32 -5.827 5.951 7.722
235 3HG2 VAL 32 3HG2 VAL 32 -6.589 4.343 7.767
236 H LYS 33 H LYS 33 -5.373 3.308 12.561
237 HA LYS 33 HA LYS 33 -3.290 4.094 14.169
238 1HB LYS 33 1HB LYS 33 -4.786 1.560 13.692
239 2HB LYS 33 2HB LYS 33 -3.278 1.438 14.576
240 1HG LYS 33 2HG LYS 33 -4.965 1.812 16.238
241 2HG LYS 33 1HG LYS 33 -4.119 3.338 16.080
242 1HD LYS 33 1HD LYS 33 -5.887 4.282 14.705
243 2HD LYS 33 2HD LYS 33 -6.660 2.721 14.513
244 1HE LYS 33 1HE LYS 33 -6.278 3.931 17.276
245 2HE LYS 33 2HE LYS 33 -7.641 4.394 16.278
246 1HZ LYS 33 1HZ LYS 33 -7.031 1.578 16.781
247 2HZ LYS 33 2HZ LYS 33 -7.932 2.450 17.828
248 3HZ LYS 33 3HZ LYS 33 -8.443 2.237 16.291
249 H CYS 34 H CYS 34 -1.103 3.187 14.451
250 HA CYS 34 HA CYS 34 0.268 3.210 11.984
251 1HB CYS 34 2HB CYS 34 1.421 2.371 14.641
252 2HB CYS 34 1HB CYS 34 2.260 3.049 13.260
253 H ASP 35 H ASP 35 -0.540 0.716 14.487
254 HA ASP 35 HA ASP 35 0.822 -1.358 13.279
255 1HB ASP 35 1HB ASP 35 -0.761 -2.821 14.609
256 2HB ASP 35 2HB ASP 35 0.036 -1.579 15.555
257 H ASP 36 H ASP 36 -1.890 0.441 12.225
258 HA ASP 36 HA ASP 36 -3.518 -1.529 11.170
259 1HB ASP 36 1HB ASP 36 -3.806 1.092 11.424
260 2HB ASP 36 2HB ASP 36 -3.092 1.157 9.825
261 H CYS 37 H CYS 37 -0.351 -0.370 10.302
262 HA CYS 37 HA CYS 37 -0.542 -1.821 7.770
263 1HB CYS 37 1HB CYS 37 0.812 0.861 8.202
264 2HB CYS 37 2HB CYS 37 1.066 -0.148 6.792
265 H HIS 38 H HIS 38 1.580 -0.333 10.317
266 HA HIS 38 HA HIS 38 3.733 -2.093 9.687
267 1HB HIS 38 1HB HIS 38 3.310 -0.227 12.039
268 2HB HIS 38 2HB HIS 38 4.809 -1.048 11.652
269 HD1 HIS 38 HD1 HIS 38 5.775 -0.423 9.105
270 HD2 HIS 38 HD2 HIS 38 3.098 2.255 10.909
271 HE1 HIS 38 HE1 HIS 38 6.054 1.800 7.883
272 H HIS 39 H HIS 39 2.710 -4.193 9.847
273 HA HIS 39 HA HIS 39 1.833 -4.915 12.524
274 1HB HIS 39 2HB HIS 39 0.726 -6.728 11.566
275 2HB HIS 39 1HB HIS 39 0.499 -5.430 10.411
276 HD1 HIS 39 HD1 HIS 39 1.640 -8.884 10.657
277 HD2 HIS 39 HD2 HIS 39 2.400 -5.631 8.119
278 HE1 HIS 39 HE1 HIS 39 2.685 -9.856 8.542
279 H GLN 40 H GLN 40 4.560 -4.290 12.370
280 HA GLN 40 HA GLN 40 5.801 -6.922 12.272
281 1HB GLN 40 1HB GLN 40 6.847 -4.113 11.888
282 2HB GLN 40 2HB GLN 40 7.952 -5.368 12.413
283 1HG GLN 40 1HG GLN 40 7.639 -4.943 9.836
284 2HG GLN 40 2HG GLN 40 7.741 -6.593 10.417
285 2HE2 GLN 40 2HE2 GLN 40 5.923 -7.889 10.518
286 1HE2 GLN 40 1HE2 GLN 40 4.450 -7.527 9.682
287 HA PRO 41 HA PRO 41 6.273 -7.291 16.597
288 1HB PRO 41 1HB PRO 41 8.998 -8.016 16.690
289 2HB PRO 41 2HB PRO 41 7.628 -9.118 16.335
290 1HG PRO 41 1HG PRO 41 9.432 -7.734 14.425
291 2HG PRO 41 2HG PRO 41 8.889 -9.439 14.311
292 1HD PRO 41 1HD PRO 41 7.677 -7.571 12.816
293 2HD PRO 41 2HD PRO 41 6.657 -8.738 13.711
294 H GLY 42 H GLY 42 7.135 -6.120 18.461
295 1HA GLY 42 2HA GLY 42 8.128 -4.403 19.528
296 2HA GLY 42 1HA GLY 42 7.640 -3.458 18.136
297 H ASP 43 H ASP 43 9.810 -2.413 19.119
298 HA ASP 43 HA ASP 43 11.948 -2.021 18.951
299 1HB ASP 43 1HB ASP 43 11.928 -4.825 18.858
300 2HB ASP 43 2HB ASP 43 12.819 -4.394 17.413
301 H LYS 44 H LYS 44 10.990 -4.091 16.096
302 HA LYS 44 HA LYS 44 11.902 -1.903 14.359
303 1HB LYS 44 1HB LYS 44 12.375 -3.604 12.671
304 2HB LYS 44 2HB LYS 44 13.287 -3.896 14.139
305 1HG LYS 44 1HG LYS 44 11.505 -5.552 14.858
306 2HG LYS 44 2HG LYS 44 10.709 -5.314 13.316
307 1HD LYS 44 1HD LYS 44 12.623 -6.196 12.095
308 2HD LYS 44 2HD LYS 44 13.623 -6.188 13.534
309 1HE LYS 44 2HE LYS 44 12.997 -8.363 13.804
310 2HE LYS 44 1HE LYS 44 11.454 -7.735 14.349
311 1HZ LYS 44 1HZ LYS 44 11.952 -8.090 11.497
312 2HZ LYS 44 2HZ LYS 44 11.509 -9.365 12.415
313 3HZ LYS 44 3HZ LYS 44 10.526 -8.067 12.292
314 H GLN 45 H GLN 45 9.270 -2.237 15.767
315 HA GLN 45 HA GLN 45 7.288 -3.287 14.363
316 1HB GLN 45 1HB GLN 45 7.062 -1.948 16.464
317 2HB GLN 45 2HB GLN 45 7.271 -0.473 15.542
318 1HG GLN 45 1HG GLN 45 5.140 -0.547 14.675
319 2HG GLN 45 2HG GLN 45 5.168 -2.287 14.470
320 2HE2 GLN 45 2HE2 GLN 45 2.950 -2.002 15.278
321 1HE2 GLN 45 1HE2 GLN 45 2.661 -2.045 16.986
322 H TYR 46 H TYR 46 9.110 -0.362 13.564
323 HA TYR 46 HA TYR 46 7.551 -0.065 11.049
324 1HB TYR 46 1HB TYR 46 9.559 1.881 12.201
325 2HB TYR 46 2HB TYR 46 8.291 2.187 11.002
326 HD1 TYR 46 HD1 TYR 46 5.889 2.218 11.713
327 HD2 TYR 46 HD2 TYR 46 9.118 2.013 14.539
328 HE1 TYR 46 HE1 TYR 46 4.351 2.932 13.523
329 HE2 TYR 46 HE2 TYR 46 7.579 2.726 16.349
330 HH TYR 46 HH TYR 46 4.094 3.138 15.826
331 H ALA 47 H ALA 47 8.607 -1.830 9.881
332 HA ALA 47 HA ALA 47 11.381 -1.136 9.198
333 1HB ALA 47 1HB ALA 47 10.547 -3.400 10.590
334 2HB ALA 47 3HB ALA 47 10.675 -3.970 8.909
335 3HB ALA 47 2HB ALA 47 12.080 -3.221 9.704
336 H GLY 48 H GLY 48 11.848 -2.702 7.052
337 1HA GLY 48 2HA GLY 48 11.537 -2.628 4.813
338 2HA GLY 48 1HA GLY 48 10.198 -1.520 5.039
339 H CYS 49 H CYS 49 8.744 -2.536 3.602
340 HA CYS 49 HA CYS 49 7.430 -4.820 4.711
341 1HB CYS 49 2HB CYS 49 6.821 -3.507 2.066
342 2HB CYS 49 1HB CYS 49 5.755 -4.468 3.072
343 H THR 50 H THR 50 9.700 -3.999 2.084
344 HA THR 50 HA THR 50 9.477 -6.662 0.932
345 HB THR 50 HB THR 50 11.118 -5.635 -0.718
346 HG1 THR 50 HG1 THR 50 11.974 -4.151 0.986
347 1HG2 THR 50 1HG2 THR 50 8.547 -4.140 -0.031
348 2HG2 THR 50 2HG2 THR 50 9.576 -3.643 -1.396
349 3HG2 THR 50 3HG2 THR 50 8.834 -5.261 -1.383
350 H THR 51 H THR 51 10.535 -6.020 3.762
351 HA THR 51 HA THR 51 13.316 -6.552 3.678
352 HB THR 51 HB THR 51 11.318 -7.034 5.945
353 HG1 THR 51 HG1 THR 51 11.465 -4.762 6.191
354 1HG2 THR 51 1HG2 THR 51 14.273 -6.245 5.808
355 2HG2 THR 51 2HG2 THR 51 13.289 -6.110 7.285
356 3HG2 THR 51 3HG2 THR 51 13.593 -7.707 6.560
357 H ASP 52 H ASP 52 14.433 -8.484 4.418
358 HA ASP 52 HA ASP 52 13.703 -10.674 2.976
359 1HB ASP 52 1HB ASP 52 15.929 -10.006 4.257
360 2HB ASP 52 2HB ASP 52 15.247 -10.942 5.573
361 H GLY 53 H GLY 53 12.926 -12.849 3.733
362 1HA GLY 53 2HA GLY 53 12.008 -13.427 6.287
363 2HA GLY 53 1HA GLY 53 11.465 -14.180 4.801
364 H CYS 54 H CYS 54 10.671 -11.302 3.822
365 HA CYS 54 HA CYS 54 8.094 -11.344 5.200
366 1HB CYS 54 1HB CYS 54 9.499 -8.771 4.434
367 2HB CYS 54 2HB CYS 54 8.004 -8.948 5.331
368 H HIS 55 H HIS 55 7.885 -8.728 3.288
369 HA HIS 55 HA HIS 55 6.896 -10.299 1.063
370 1HB HIS 55 1HB HIS 55 6.608 -7.321 1.486
371 2HB HIS 55 2HB HIS 55 5.652 -8.359 0.447
372 HD1 HIS 55 HD1 HIS 55 4.058 -10.153 1.737
373 HD2 HIS 55 HD2 HIS 55 5.640 -7.036 4.056
374 HE1 HIS 55 HE1 HIS 55 2.657 -10.064 3.868
375 H ASN 56 H ASN 56 9.617 -10.505 1.120
376 HA ASN 56 HA ASN 56 10.702 -8.393 -0.487
377 1HB ASN 56 1HB ASN 56 12.052 -9.519 1.320
378 2HB ASN 56 2HB ASN 56 11.933 -11.038 0.455
379 2HD2 ASN 56 2HD2 ASN 56 14.307 -9.648 1.182
380 1HD2 ASN 56 1HD2 ASN 56 15.176 -9.237 -0.259
381 H ILE 57 H ILE 57 8.905 -9.071 -2.188
382 HA ILE 57 HA ILE 57 10.126 -11.042 -3.974
383 HB ILE 57 HB ILE 57 7.164 -10.839 -3.426
384 1HG1 ILE 57 1HG1 ILE 57 8.709 -11.792 -1.561
385 2HG1 ILE 57 2HG1 ILE 57 7.260 -12.664 -2.023
386 1HG2 ILE 57 1HG2 ILE 57 8.828 -12.290 -5.408
387 2HG2 ILE 57 2HG2 ILE 57 7.504 -13.208 -4.651
388 3HG2 ILE 57 3HG2 ILE 57 7.155 -11.694 -5.519
389 1HD1 ILE 57 1HD1 ILE 57 9.767 -13.312 -3.546
390 2HD1 ILE 57 2HD1 ILE 57 9.665 -13.871 -1.860
391 3HD1 ILE 57 3HD1 ILE 57 8.436 -14.382 -3.041
392 H LEU 58 H LEU 58 10.850 -9.845 -5.654
393 HA LEU 58 HA LEU 58 9.234 -7.540 -6.445
394 1HB LEU 58 2HB LEU 58 12.070 -8.288 -7.173
395 2HB LEU 58 1HB LEU 58 11.234 -6.825 -7.654
396 HG LEU 58 HG LEU 58 12.051 -7.619 -4.848
397 1HD1 LEU 58 1HD1 LEU 58 13.498 -6.374 -6.866
398 2HD1 LEU 58 2HD1 LEU 58 12.937 -5.030 -5.843
399 3HD1 LEU 58 3HD1 LEU 58 13.869 -6.366 -5.126
400 1HD2 LEU 58 1HD2 LEU 58 9.849 -6.530 -4.808
401 2HD2 LEU 58 2HD2 LEU 58 11.112 -5.510 -4.077
402 3HD2 LEU 58 3HD2 LEU 58 10.517 -5.152 -5.716
403 H ASP 59 H ASP 59 7.580 -9.069 -7.326
404 HA ASP 59 HA ASP 59 8.109 -9.421 -10.088
405 1HB ASP 59 1HB ASP 59 8.832 -11.589 -8.611
406 2HB ASP 59 2HB ASP 59 7.123 -11.939 -8.773
407 H LYS 60 H LYS 60 6.162 -8.759 -11.012
408 HA LYS 60 HA LYS 60 3.797 -8.766 -9.345
409 1HB LYS 60 1HB LYS 60 3.929 -7.734 -12.169
410 2HB LYS 60 2HB LYS 60 2.915 -7.203 -10.842
411 1HG LYS 60 1HG LYS 60 4.446 -5.582 -10.426
412 2HG LYS 60 2HG LYS 60 5.533 -6.837 -9.867
413 1HD LYS 60 1HD LYS 60 6.649 -5.499 -11.600
414 2HD LYS 60 2HD LYS 60 6.405 -7.131 -12.189
415 1HE LYS 60 1HE LYS 60 4.570 -6.476 -13.593
416 2HE LYS 60 2HE LYS 60 4.362 -4.950 -12.758
417 1HZ LYS 60 1HZ LYS 60 6.973 -5.178 -13.778
418 2HZ LYS 60 2HZ LYS 60 5.881 -5.399 -14.972
419 3HZ LYS 60 3HZ LYS 60 5.848 -4.033 -14.079
420 H ALA 61 H ALA 61 4.564 -11.372 -9.770
421 HA ALA 61 HA ALA 61 2.273 -12.484 -10.868
422 1HB ALA 61 1HB ALA 61 3.977 -13.599 -12.776
423 2HB ALA 61 3HB ALA 61 2.707 -12.389 -13.080
424 3HB ALA 61 2HB ALA 61 4.386 -11.867 -12.806
425 H ASP 62 H ASP 62 3.272 -12.911 -8.470
426 HA ASP 62 HA ASP 62 4.832 -15.359 -8.743
427 1HB ASP 62 1HB ASP 62 5.808 -13.349 -7.433
428 2HB ASP 62 2HB ASP 62 4.559 -13.641 -6.239
429 H LYS 63 H LYS 63 4.381 -16.724 -6.472
430 HA LYS 63 HA LYS 63 1.518 -16.589 -5.892
431 1HB LYS 63 1HB LYS 63 2.888 -18.680 -7.394
432 2HB LYS 63 2HB LYS 63 2.115 -19.319 -5.957
433 1HG LYS 63 1HG LYS 63 0.426 -17.354 -7.390
434 2HG LYS 63 2HG LYS 63 0.839 -18.742 -8.377
435 1HD LYS 63 1HD LYS 63 -0.019 -20.285 -6.650
436 2HD LYS 63 2HD LYS 63 -0.317 -18.948 -5.557
437 1HE LYS 63 1HE LYS 63 -2.262 -18.341 -6.617
438 2HE LYS 63 2HE LYS 63 -1.592 -18.600 -8.216
439 1HZ LYS 63 1HZ LYS 63 -2.028 -20.964 -6.626
440 2HZ LYS 63 2HZ LYS 63 -3.371 -20.191 -7.143
441 3HZ LYS 63 3HZ LYS 63 -2.267 -20.723 -8.223
442 H SER 64 H SER 64 2.118 -15.584 -3.894
443 HA SER 64 HA SER 64 2.522 -17.412 -1.853
444 1HB SER 64 1HB SER 64 4.971 -16.343 -3.019
445 2HB SER 64 2HB SER 64 4.823 -15.812 -1.355
446 HG SER 64 HG SER 64 5.121 -18.440 -2.403
447 H VAL 65 H VAL 65 2.705 -16.218 0.337
448 HA VAL 65 HA VAL 65 1.118 -13.810 0.132
449 HB VAL 65 HB VAL 65 0.402 -15.507 1.658
450 1HG1 VAL 65 1HG1 VAL 65 3.236 -15.380 2.689
451 2HG1 VAL 65 2HG1 VAL 65 1.909 -15.984 3.710
452 3HG1 VAL 65 3HG1 VAL 65 2.288 -16.795 2.171
453 1HG2 VAL 65 1HG2 VAL 65 0.652 -12.877 2.310
454 2HG2 VAL 65 2HG2 VAL 65 -0.190 -14.083 3.312
455 3HG2 VAL 65 3HG2 VAL 65 1.495 -13.640 3.680
456 H ASN 66 H ASN 66 4.211 -14.209 -0.469
457 HA ASN 66 HA ASN 66 5.118 -12.142 1.361
458 1HB ASN 66 1HB ASN 66 6.753 -13.889 -0.553
459 2HB ASN 66 2HB ASN 66 7.411 -12.807 0.659
460 2HD2 ASN 66 2HD2 ASN 66 6.457 -13.167 2.922
461 1HD2 ASN 66 1HD2 ASN 66 6.391 -14.804 3.483
462 H SER 67 H SER 67 3.462 -12.192 -1.388
463 HA SER 67 HA SER 67 5.194 -10.820 -3.163
464 1HB SER 67 1HB SER 67 2.913 -10.404 -4.373
465 2HB SER 67 2HB SER 67 3.527 -12.042 -4.273
466 HG SER 67 HG SER 67 1.307 -12.017 -3.679
467 H TRP 68 H TRP 68 5.417 -8.592 -3.468
468 HA TRP 68 HA TRP 68 4.115 -6.930 -1.462
469 1HB TRP 68 1HB TRP 68 6.400 -6.557 -1.464
470 2HB TRP 68 2HB TRP 68 6.534 -6.660 -3.208
471 HD1 TRP 68 HD1 TRP 68 6.747 -4.340 -4.392
472 HE1 TRP 68 HE1 TRP 68 6.265 -1.800 -3.864
473 HE3 TRP 68 HE3 TRP 68 4.541 -5.153 0.117
474 HZ2 TRP 68 HZ2 TRP 68 5.042 -0.446 -1.670
475 HZ3 TRP 68 HZ3 TRP 68 3.730 -3.167 1.388
476 HH2 TRP 68 HH2 TRP 68 3.952 -0.877 0.563
477 H TYR 69 H TYR 69 3.046 -8.221 -4.090
478 HA TYR 69 HA TYR 69 1.923 -5.704 -5.230
479 1HB TYR 69 1HB TYR 69 3.342 -6.684 -6.879
480 2HB TYR 69 2HB TYR 69 2.722 -8.310 -6.549
481 HD1 TYR 69 HD1 TYR 69 0.382 -8.908 -7.225
482 HD2 TYR 69 HD2 TYR 69 2.245 -5.223 -8.407
483 HE1 TYR 69 HE1 TYR 69 -1.311 -8.627 -9.016
484 HE2 TYR 69 HE2 TYR 69 0.552 -4.941 -10.197
485 HH TYR 69 HH TYR 69 -1.467 -7.365 -11.300
486 H LYS 70 H LYS 70 1.257 -8.380 -3.280
487 HA LYS 70 HA LYS 70 -1.477 -8.567 -4.324
488 1HB LYS 70 1HB LYS 70 -0.070 -10.660 -4.136
489 2HB LYS 70 2HB LYS 70 -0.091 -10.448 -2.397
490 1HG LYS 70 1HG LYS 70 -2.792 -10.158 -3.105
491 2HG LYS 70 2HG LYS 70 -2.228 -11.412 -4.192
492 1HD LYS 70 1HD LYS 70 -1.742 -11.460 -1.178
493 2HD LYS 70 2HD LYS 70 -3.108 -12.245 -1.945
494 1HE LYS 70 1HE LYS 70 -0.186 -12.828 -2.629
495 2HE LYS 70 2HE LYS 70 -1.152 -13.794 -1.532
496 1HZ LYS 70 1HZ LYS 70 -2.464 -13.361 -4.004
497 2HZ LYS 70 2HZ LYS 70 -1.020 -14.096 -4.210
498 3HZ LYS 70 3HZ LYS 70 -2.145 -14.764 -3.233
499 H VAL 71 H VAL 71 0.546 -7.947 -1.416
500 HA VAL 71 HA VAL 71 -1.665 -7.548 0.302
501 HB VAL 71 HB VAL 71 0.029 -6.589 1.803
502 1HG1 VAL 71 1HG1 VAL 71 -0.196 -9.210 0.926
503 2HG1 VAL 71 2HG1 VAL 71 1.556 -8.901 0.857
504 3HG1 VAL 71 3HG1 VAL 71 0.668 -8.659 2.381
505 1HG2 VAL 71 1HG2 VAL 71 1.593 -6.462 -0.717
506 2HG2 VAL 71 2HG2 VAL 71 1.649 -5.422 0.727
507 3HG2 VAL 71 3HG2 VAL 71 2.483 -6.995 0.729
508 H VAL 72 H VAL 72 -0.650 -5.842 -2.410
509 HA VAL 72 HA VAL 72 -1.484 -3.273 -1.273
510 HB VAL 72 HB VAL 72 0.063 -4.030 -3.754
511 1HG1 VAL 72 1HG1 VAL 72 -1.502 -1.621 -3.179
512 2HG1 VAL 72 2HG1 VAL 72 0.208 -1.272 -3.526
513 3HG1 VAL 72 3HG1 VAL 72 -0.772 -2.178 -4.704
514 1HG2 VAL 72 1HG2 VAL 72 0.951 -3.715 -1.186
515 2HG2 VAL 72 2HG2 VAL 72 1.938 -3.449 -2.643
516 3HG2 VAL 72 3HG2 VAL 72 1.154 -2.070 -1.834
517 H HIS 73 H HIS 73 -1.988 -5.517 -4.075
518 HA HIS 73 HA HIS 73 -4.504 -4.121 -4.571
519 1HB HIS 73 2HB HIS 73 -3.083 -6.122 -6.345
520 2HB HIS 73 1HB HIS 73 -4.457 -5.120 -6.770
521 HD1 HIS 73 HD1 HIS 73 -0.728 -4.944 -6.171
522 HD2 HIS 73 HD2 HIS 73 -3.850 -2.466 -7.478
523 HE1 HIS 73 HE1 HIS 73 0.374 -2.855 -7.138
524 H ASP 74 H ASP 74 -4.097 -5.901 -2.260
525 HA ASP 74 HA ASP 74 -5.292 -8.376 -2.978
526 1HB ASP 74 1HB ASP 74 -4.002 -7.181 -0.663
527 2HB ASP 74 2HB ASP 74 -5.528 -7.883 -0.160
528 H ALA 75 H ALA 75 -7.449 -8.139 -3.702
529 HA ALA 75 HA ALA 75 -9.183 -6.201 -2.502
530 1HB ALA 75 1HB ALA 75 -9.161 -8.056 -4.802
531 2HB ALA 75 3HB ALA 75 -10.759 -7.859 -4.043
532 3HB ALA 75 2HB ALA 75 -9.879 -6.434 -4.647
533 H LYS 76 H LYS 76 -8.303 -9.573 -1.998
534 HA LYS 76 HA LYS 76 -10.711 -10.216 -0.587
535 1HB LYS 76 1HB LYS 76 -9.156 -11.789 -1.923
536 2HB LYS 76 2HB LYS 76 -8.123 -11.767 -0.507
537 1HG LYS 76 1HG LYS 76 -10.321 -12.338 0.828
538 2HG LYS 76 2HG LYS 76 -10.976 -12.782 -0.736
539 1HD LYS 76 1HD LYS 76 -8.269 -13.882 0.009
540 2HD LYS 76 2HD LYS 76 -9.671 -14.557 0.816
541 1HE LYS 76 1HE LYS 76 -10.241 -14.317 -2.025
542 2HE LYS 76 2HE LYS 76 -8.712 -15.147 -1.819
543 1HZ LYS 76 1HZ LYS 76 -10.940 -15.935 -0.133
544 2HZ LYS 76 2HZ LYS 76 -10.936 -16.425 -1.690
545 3HZ LYS 76 3HZ LYS 76 -9.703 -16.837 -0.701
546 H GLY 77 H GLY 77 -10.929 -10.542 1.693
547 1HA GLY 77 2HA GLY 77 -10.696 -9.874 3.828
548 2HA GLY 77 1HA GLY 77 -9.671 -8.569 3.266
549 H GLY 78 H GLY 78 -9.408 -10.373 5.667
550 1HA GLY 78 2HA GLY 78 -6.645 -11.232 5.134
551 2HA GLY 78 1HA GLY 78 -7.779 -12.366 5.841
552 H ALA 79 H ALA 79 -5.622 -11.887 7.377
553 HA ALA 79 HA ALA 79 -6.558 -11.135 9.792
554 1HB ALA 79 1HB ALA 79 -4.392 -11.425 10.479
555 2HB ALA 79 3HB ALA 79 -3.730 -10.393 9.189
556 3HB ALA 79 2HB ALA 79 -4.210 -12.069 8.830
557 H LYS 80 H LYS 80 -5.624 -9.056 7.089
558 HA LYS 80 HA LYS 80 -6.723 -6.802 8.474
559 1HB LYS 80 1HB LYS 80 -4.459 -5.531 7.822
560 2HB LYS 80 2HB LYS 80 -4.744 -6.226 9.405
561 1HG LYS 80 1HG LYS 80 -3.594 -8.333 8.681
562 2HG LYS 80 2HG LYS 80 -3.300 -7.627 7.104
563 1HD LYS 80 1HD LYS 80 -2.211 -6.625 9.775
564 2HD LYS 80 2HD LYS 80 -1.289 -7.382 8.491
565 1HE LYS 80 1HE LYS 80 -1.961 -5.460 6.962
566 2HE LYS 80 2HE LYS 80 -2.719 -4.686 8.339
567 1HZ LYS 80 1HZ LYS 80 0.058 -5.550 8.525
568 2HZ LYS 80 2HZ LYS 80 -0.304 -4.147 7.771
569 3HZ LYS 80 3HZ LYS 80 -0.703 -4.357 9.341
570 HA PRO 81 HA PRO 81 -7.711 -5.698 4.360
571 1HB PRO 81 1HB PRO 81 -7.936 -2.971 4.564
572 2HB PRO 81 2HB PRO 81 -9.057 -4.100 5.392
573 1HG PRO 81 2HG PRO 81 -6.798 -2.704 6.294
574 2HG PRO 81 1HG PRO 81 -8.285 -2.837 7.288
575 1HD PRO 81 1HD PRO 81 -6.053 -4.334 7.809
576 2HD PRO 81 2HD PRO 81 -7.693 -5.024 8.006
577 H THR 82 H THR 82 -7.013 -3.785 2.616
578 HA THR 82 HA THR 82 -4.098 -3.487 2.817
579 HB THR 82 HB THR 82 -4.020 -4.175 0.371
580 HG1 THR 82 HG1 THR 82 -6.719 -5.085 1.064
581 1HG2 THR 82 1HG2 THR 82 -4.380 -5.900 2.641
582 2HG2 THR 82 2HG2 THR 82 -5.372 -6.566 1.321
583 3HG2 THR 82 3HG2 THR 82 -3.627 -6.310 1.081
584 H CYS 83 H CYS 83 -3.747 -2.256 0.294
585 HA CYS 83 HA CYS 83 -4.691 0.338 0.996
586 1HB CYS 83 1HB CYS 83 -3.304 -0.342 -1.583
587 2HB CYS 83 2HB CYS 83 -3.277 1.159 -0.679
588 H ILE 84 H ILE 84 -6.131 -2.314 -0.448
589 HA ILE 84 HA ILE 84 -7.722 -0.630 -2.253
590 HB ILE 84 HB ILE 84 -6.806 -3.470 -2.388
591 1HG1 ILE 84 1HG1 ILE 84 -5.663 -1.558 -3.579
592 2HG1 ILE 84 2HG1 ILE 84 -6.146 -2.909 -4.585
593 1HG2 ILE 84 1HG2 ILE 84 -9.401 -2.401 -3.494
594 2HG2 ILE 84 2HG2 ILE 84 -8.542 -3.770 -4.240
595 3HG2 ILE 84 3HG2 ILE 84 -9.108 -3.886 -2.557
596 1HD1 ILE 84 1HD1 ILE 84 -8.308 -0.938 -4.366
597 2HD1 ILE 84 2HD1 ILE 84 -6.810 -0.208 -4.992
598 3HD1 ILE 84 3HD1 ILE 84 -7.533 -1.607 -5.822
599 H SER 85 H SER 85 -7.786 -3.246 0.234
600 HA SER 85 HA SER 85 -10.476 -3.588 0.365
601 1HB SER 85 2HB SER 85 -8.910 -3.519 2.937
602 2HB SER 85 1HB SER 85 -10.080 -4.702 2.384
603 HG SER 85 HG SER 85 -8.438 -5.872 1.692
604 H CYS 86 H CYS 86 -8.468 -1.387 2.468
605 HA CYS 86 HA CYS 86 -10.649 -0.173 3.684
606 1HB CYS 86 1HB CYS 86 -8.176 -0.147 4.383
607 2HB CYS 86 2HB CYS 86 -7.973 1.171 3.245
608 H HIS 87 H HIS 87 -8.482 0.980 0.988
609 HA HIS 87 HA HIS 87 -9.760 3.295 0.398
610 1HB HIS 87 1HB HIS 87 -8.232 1.305 -1.250
611 2HB HIS 87 2HB HIS 87 -8.991 2.670 -2.044
612 HD1 HIS 87 HD1 HIS 87 -6.749 3.808 -2.644
613 HD2 HIS 87 HD2 HIS 87 -7.282 3.177 1.469
614 HE1 HIS 87 HE1 HIS 87 -4.915 5.140 -1.473
615 H LYS 88 H LYS 88 -10.769 -0.045 -0.310
616 HA LYS 88 HA LYS 88 -12.751 0.647 -2.196
617 1HB LYS 88 1HB LYS 88 -11.946 -1.771 -0.658
618 2HB LYS 88 2HB LYS 88 -13.594 -1.732 -1.250
619 1HG LYS 88 1HG LYS 88 -12.761 -1.239 -3.555
620 2HG LYS 88 2HG LYS 88 -11.110 -1.257 -2.967
621 1HD LYS 88 1HD LYS 88 -11.084 -3.484 -3.412
622 2HD LYS 88 2HD LYS 88 -12.141 -3.692 -2.029
623 1HE LYS 88 1HE LYS 88 -14.030 -3.007 -3.837
624 2HE LYS 88 2HE LYS 88 -12.837 -3.626 -4.961
625 1HZ LYS 88 1HZ LYS 88 -12.979 -5.407 -2.862
626 2HZ LYS 88 2HZ LYS 88 -14.521 -5.062 -3.275
627 3HZ LYS 88 3HZ LYS 88 -13.484 -5.636 -4.398
628 H ASP 89 H ASP 89 -12.802 0.015 1.369
629 HA ASP 89 HA ASP 89 -15.502 0.276 1.694
630 1HB ASP 89 1HB ASP 89 -13.462 -0.273 3.350
631 2HB ASP 89 2HB ASP 89 -13.608 1.427 3.749
632 H LYS 90 H LYS 90 -12.851 2.707 1.512
633 HA LYS 90 HA LYS 90 -14.293 4.925 2.384
634 1HB LYS 90 1HB LYS 90 -11.752 4.388 0.982
635 2HB LYS 90 2HB LYS 90 -12.456 5.953 0.628
636 1HG LYS 90 1HG LYS 90 -12.072 4.884 3.463
637 2HG LYS 90 2HG LYS 90 -10.902 5.905 2.651
638 1HD LYS 90 1HD LYS 90 -12.346 7.785 2.635
639 2HD LYS 90 2HD LYS 90 -13.790 6.806 2.808
640 1HE LYS 90 1HE LYS 90 -11.674 7.271 4.964
641 2HE LYS 90 2HE LYS 90 -13.277 7.979 4.928
642 1HZ LYS 90 1HZ LYS 90 -13.875 5.424 4.731
643 2HZ LYS 90 2HZ LYS 90 -12.492 5.294 5.590
644 3HZ LYS 90 3HZ LYS 90 -13.729 6.191 6.166
645 H ALA 91 H ALA 91 -13.925 3.406 -0.863
646 HA ALA 91 HA ALA 91 -15.303 5.416 -2.255
647 1HB ALA 91 1HB ALA 91 -14.077 2.848 -2.749
648 2HB ALA 91 3HB ALA 91 -14.452 4.150 -3.904
649 3HB ALA 91 2HB ALA 91 -15.671 2.905 -3.540
650 H GLY 92 H GLY 92 -16.525 2.039 -1.794
651 1HA GLY 92 2HA GLY 92 -18.920 2.892 -0.480
652 2HA GLY 92 1HA GLY 92 -18.535 1.289 -1.074
653 H ASP 93 H ASP 93 -20.680 3.796 -1.439
654 HA ASP 93 HA ASP 93 -21.612 2.723 -3.887
655 1HB ASP 93 1HB ASP 93 -23.042 5.094 -3.366
656 2HB ASP 93 2HB ASP 93 -23.529 3.468 -2.933
657 H ASP 94 H ASP 94 -20.032 5.735 -2.693
658 HA ASP 94 HA ASP 94 -20.382 7.341 -4.852
659 1HB ASP 94 1HB ASP 94 -19.258 7.878 -2.622
660 2HB ASP 94 2HB ASP 94 -17.813 7.089 -3.220
661 H LYS 95 H LYS 95 -20.052 6.561 -6.968
662 HA LYS 95 HA LYS 95 -18.012 4.693 -7.573
663 1HB LYS 95 1HB LYS 95 -19.993 6.299 -9.174
664 2HB LYS 95 2HB LYS 95 -18.723 5.402 -9.982
665 1HG LYS 95 1HG LYS 95 -19.452 3.307 -8.874
666 2HG LYS 95 2HG LYS 95 -20.669 4.182 -7.967
667 1HD LYS 95 1HD LYS 95 -21.956 4.668 -9.937
668 2HD LYS 95 2HD LYS 95 -20.629 4.262 -11.007
669 1HE LYS 95 1HE LYS 95 -21.974 2.227 -9.170
670 2HE LYS 95 2HE LYS 95 -22.467 2.491 -10.830
671 1HZ LYS 95 1HZ LYS 95 -19.652 2.047 -10.391
672 2HZ LYS 95 2HZ LYS 95 -20.629 0.760 -10.157
673 3HZ LYS 95 3HZ LYS 95 -20.614 1.521 -11.602
674 H GLU 96 H GLU 96 -18.282 8.239 -7.550
675 HA GLU 96 HA GLU 96 -16.056 8.705 -9.164
676 1HB GLU 96 1HB GLU 96 -17.774 10.418 -8.688
677 2HB GLU 96 2HB GLU 96 -17.328 10.430 -6.994
678 1HG GLU 96 1HG GLU 96 -14.890 10.957 -7.951
679 2HG GLU 96 2HG GLU 96 -15.777 11.478 -9.370
680 H LEU 97 H LEU 97 -16.493 8.008 -5.693
681 HA LEU 97 HA LEU 97 -13.812 8.741 -5.015
682 1HB LEU 97 1HB LEU 97 -15.929 8.753 -3.553
683 2HB LEU 97 2HB LEU 97 -15.671 7.028 -3.386
684 HG LEU 97 HG LEU 97 -14.697 7.963 -1.478
685 1HD1 LEU 97 1HD1 LEU 97 -13.252 6.342 -2.826
686 2HD1 LEU 97 2HD1 LEU 97 -12.280 7.765 -3.273
687 3HD1 LEU 97 3HD1 LEU 97 -12.447 7.303 -1.562
688 1HD2 LEU 97 1HD2 LEU 97 -14.066 10.207 -3.259
689 2HD2 LEU 97 2HD2 LEU 97 -14.413 10.180 -1.514
690 3HD2 LEU 97 3HD2 LEU 97 -12.772 9.818 -2.101
691 H LYS 98 H LYS 98 -15.491 5.910 -6.275
692 HA LYS 98 HA LYS 98 -13.326 4.142 -5.550
693 1HB LYS 98 1HB LYS 98 -15.731 3.449 -5.523
694 2HB LYS 98 2HB LYS 98 -15.771 3.622 -7.266
695 1HG LYS 98 1HG LYS 98 -13.494 2.062 -6.895
696 2HG LYS 98 2HG LYS 98 -14.537 1.490 -5.609
697 1HD LYS 98 1HD LYS 98 -15.564 1.792 -8.458
698 2HD LYS 98 2HD LYS 98 -14.733 0.338 -7.940
699 1HE LYS 98 1HE LYS 98 -17.190 1.483 -6.528
700 2HE LYS 98 2HE LYS 98 -17.265 0.223 -7.745
701 1HZ LYS 98 1HZ LYS 98 -15.494 -0.839 -6.165
702 2HZ LYS 98 2HZ LYS 98 -16.242 0.086 -5.045
703 3HZ LYS 98 3HZ LYS 98 -17.094 -1.019 -5.892
704 H LYS 99 H LYS 99 -12.932 6.607 -7.301
705 HA LYS 99 HA LYS 99 -11.591 5.156 -9.452
706 1HB LYS 99 1HB LYS 99 -13.712 7.227 -9.745
707 2HB LYS 99 2HB LYS 99 -12.327 7.362 -10.809
708 1HG LYS 99 1HG LYS 99 -12.821 4.657 -10.980
709 2HG LYS 99 2HG LYS 99 -14.445 5.260 -10.711
710 1HD LYS 99 1HD LYS 99 -14.355 6.683 -12.659
711 2HD LYS 99 2HD LYS 99 -12.619 6.494 -12.812
712 1HE LYS 99 1HE LYS 99 -12.801 4.250 -13.601
713 2HE LYS 99 2HE LYS 99 -14.428 4.061 -12.978
714 1HZ LYS 99 1HZ LYS 99 -15.038 5.857 -14.602
715 2HZ LYS 99 2HZ LYS 99 -13.575 5.634 -15.293
716 3HZ LYS 99 3HZ LYS 99 -14.651 4.406 -15.246
717 H LYS 100 H LYS 100 -10.434 5.926 -7.026
718 HA LYS 100 HA LYS 100 -8.411 7.671 -8.001
719 1HB LYS 100 1HB LYS 100 -8.850 9.185 -5.833
720 2HB LYS 100 2HB LYS 100 -9.475 9.580 -7.421
721 1HG LYS 100 1HG LYS 100 -11.615 8.375 -6.851
722 2HG LYS 100 2HG LYS 100 -10.988 8.056 -5.246
723 1HD LYS 100 2HD LYS 100 -12.296 10.012 -4.949
724 2HD LYS 100 1HD LYS 100 -10.658 10.627 -5.037
725 1HE LYS 100 1HE LYS 100 -10.979 11.127 -7.473
726 2HE LYS 100 2HE LYS 100 -12.620 10.519 -7.379
727 1HZ LYS 100 1HZ LYS 100 -12.764 12.237 -5.465
728 2HZ LYS 100 2HZ LYS 100 -11.513 12.945 -6.240
729 3HZ LYS 100 3HZ LYS 100 -12.932 12.718 -7.016
730 H LEU 101 H LEU 101 -9.984 6.242 -5.065
731 HA LEU 101 HA LEU 101 -7.389 5.754 -3.908
732 1HB LEU 101 1HB LEU 101 -10.088 4.860 -2.904
733 2HB LEU 101 2HB LEU 101 -8.593 4.989 -1.998
734 HG LEU 101 HG LEU 101 -10.396 7.193 -2.982
735 1HD1 LEU 101 1HD1 LEU 101 -10.714 6.049 -0.740
736 2HD1 LEU 101 2HD1 LEU 101 -9.173 6.793 -0.248
737 3HD1 LEU 101 3HD1 LEU 101 -10.551 7.821 -0.711
738 1HD2 LEU 101 1HD2 LEU 101 -7.515 7.484 -2.096
739 2HD2 LEU 101 2HD2 LEU 101 -8.211 7.913 -3.677
740 3HD2 LEU 101 3HD2 LEU 101 -8.679 8.824 -2.221
741 H THR 102 H THR 102 -9.820 4.097 -5.860
742 HA THR 102 HA THR 102 -8.177 1.657 -5.662
743 HB THR 102 HB THR 102 -10.234 0.370 -5.820
744 HG1 THR 102 HG1 THR 102 -11.606 1.506 -7.171
745 1HG2 THR 102 1HG2 THR 102 -9.862 1.440 -3.533
746 2HG2 THR 102 2HG2 THR 102 -10.908 2.782 -4.057
747 3HG2 THR 102 3HG2 THR 102 -11.574 1.137 -3.912
748 H GLY 103 H GLY 103 -8.911 4.294 -7.551
749 1HA GLY 103 2HA GLY 103 -8.498 4.729 -9.720
750 2HA GLY 103 1HA GLY 103 -9.573 3.384 -10.046
751 H CYS 104 H CYS 104 -8.649 2.074 -11.564
752 HA CYS 104 HA CYS 104 -6.159 0.837 -10.935
753 1HB CYS 104 1HB CYS 104 -8.337 0.455 -12.884
754 2HB CYS 104 2HB CYS 104 -6.744 0.039 -13.483
755 H LYS 105 H LYS 105 -7.466 3.040 -13.514
756 HA LYS 105 HA LYS 105 -4.688 3.838 -14.039
757 1HB LYS 105 1HB LYS 105 -5.360 2.584 -15.935
758 2HB LYS 105 2HB LYS 105 -6.951 3.318 -15.971
759 1HG LYS 105 1HG LYS 105 -5.508 5.582 -16.221
760 2HG LYS 105 2HG LYS 105 -4.305 4.471 -16.844
761 1HD LYS 105 1HD LYS 105 -7.060 4.067 -17.920
762 2HD LYS 105 2HD LYS 105 -6.316 5.592 -18.359
763 1HE LYS 105 1HE LYS 105 -4.286 4.338 -19.177
764 2HE LYS 105 2HE LYS 105 -5.085 2.826 -18.790
765 1HZ LYS 105 1HZ LYS 105 -6.886 3.555 -20.295
766 2HZ LYS 105 2HZ LYS 105 -5.964 4.823 -20.753
767 3HZ LYS 105 3HZ LYS 105 -5.460 3.297 -21.048
768 H GLY 106 H GLY 106 -4.251 5.962 -13.716
769 1HA GLY 106 2HA GLY 106 -6.238 7.986 -14.147
770 2HA GLY 106 1HA GLY 106 -4.597 8.197 -13.569
771 H SER 107 H SER 107 -4.576 6.502 -11.285
772 HA SER 107 HA SER 107 -6.698 7.688 -9.676
773 1HB SER 107 2HB SER 107 -6.569 5.810 -8.215
774 2HB SER 107 1HB SER 107 -6.501 5.135 -9.830
775 HG SER 107 HG SER 107 -4.800 4.124 -8.911
776 H ALA 108 H ALA 108 -5.851 7.819 -7.189
777 HA ALA 108 HA ALA 108 -3.787 9.747 -7.232
778 1HB ALA 108 1HB ALA 108 -4.619 10.224 -5.186
779 2HB ALA 108 3HB ALA 108 -5.875 9.017 -5.552
780 3HB ALA 108 2HB ALA 108 -4.431 8.545 -4.626
781 H CYS 109 H CYS 109 -3.727 6.352 -7.424
782 HA CYS 109 HA CYS 109 -1.170 6.203 -6.029
783 1HB CYS 109 1HB CYS 109 -3.071 4.040 -6.982
784 2HB CYS 109 2HB CYS 109 -1.472 3.710 -6.343
785 H HIS 110 H HIS 110 -2.861 5.539 -9.161
786 HA HIS 110 HA HIS 110 -0.214 5.510 -10.422
787 1HB HIS 110 2HB HIS 110 -2.733 4.068 -11.300
788 2HB HIS 110 1HB HIS 110 -1.214 4.084 -12.173
789 HD1 HIS 110 HD1 HIS 110 0.857 3.451 -10.066
790 HD2 HIS 110 HD2 HIS 110 -2.905 1.597 -10.166
791 HE1 HIS 110 HE1 HIS 110 1.109 1.253 -8.795
792 HA PRO 111 HA PRO 111 -2.330 9.133 -12.149
793 1HB PRO 111 1HB PRO 111 -0.525 11.023 -11.484
794 2HB PRO 111 2HB PRO 111 -1.583 10.295 -10.232
795 1HG PRO 111 2HG PRO 111 1.513 9.516 -10.491
796 2HG PRO 111 1HG PRO 111 0.151 9.833 -9.368
797 1HD PRO 111 1HD PRO 111 0.976 7.311 -10.732
798 2HD PRO 111 2HD PRO 111 -0.151 7.533 -9.359
799 H SER 112 H SER 112 -1.635 7.600 -14.104
800 HA SER 112 HA SER 112 0.515 9.031 -15.449
801 1HB SER 112 1HB SER 112 0.311 6.158 -14.850
802 2HB SER 112 2HB SER 112 0.501 6.450 -16.568
803 HG SER 112 HG SER 112 2.190 7.905 -14.785
No H/Q in entry = 803
Start of MODEL 5
1 H1 VAL 1 H1 VAL 1 8.280 8.713 17.123
2 H2 VAL 1 H2 VAL 1 9.083 7.345 17.600
3 H3 VAL 1 H3 VAL 1 9.670 8.837 18.015
4 HA VAL 1 HA VAL 1 11.003 8.580 16.344
5 HB VAL 1 HB VAL 1 10.528 6.278 16.054
6 1HG1 VAL 1 1HG1 VAL 1 7.926 7.155 14.766
7 2HG1 VAL 1 2HG1 VAL 1 8.561 5.494 14.699
8 3HG1 VAL 1 3HG1 VAL 1 8.137 6.222 16.267
9 1HG2 VAL 1 1HG2 VAL 1 11.420 7.793 14.052
10 2HG2 VAL 1 2HG2 VAL 1 11.160 6.042 13.865
11 3HG2 VAL 1 3HG2 VAL 1 9.939 7.192 13.269
12 H ASP 2 H ASP 2 7.813 9.731 16.386
13 HA ASP 2 HA ASP 2 6.779 11.324 15.342
14 1HB ASP 2 1HB ASP 2 9.486 11.954 14.073
15 2HB ASP 2 2HB ASP 2 8.100 13.026 14.057
16 H VAL 3 H VAL 3 5.343 10.855 13.670
17 HA VAL 3 HA VAL 3 5.868 9.019 11.683
18 HB VAL 3 HB VAL 3 3.688 10.193 12.658
19 1HG1 VAL 3 1HG1 VAL 3 4.127 12.371 11.613
20 2HG1 VAL 3 2HG1 VAL 3 4.118 11.609 10.005
21 3HG1 VAL 3 3HG1 VAL 3 2.630 11.644 10.981
22 1HG2 VAL 3 1HG2 VAL 3 4.055 8.905 9.941
23 2HG2 VAL 3 2HG2 VAL 3 3.552 8.142 11.469
24 3HG2 VAL 3 3HG2 VAL 3 2.455 9.267 10.633
25 HA PRO 4 HA PRO 4 8.817 10.941 9.048
26 1HB PRO 4 2HB PRO 4 7.220 9.325 7.032
27 2HB PRO 4 1HB PRO 4 8.991 9.449 7.289
28 1HG PRO 4 1HG PRO 4 7.810 7.248 8.393
29 2HG PRO 4 2HG PRO 4 9.138 8.212 9.119
30 1HD PRO 4 1HD PRO 4 6.157 8.173 9.745
31 2HD PRO 4 2HD PRO 4 7.545 8.342 10.862
32 H ALA 5 H ALA 5 8.768 12.392 7.057
33 HA ALA 5 HA ALA 5 6.346 13.974 7.152
34 1HB ALA 5 1HB ALA 5 8.569 15.039 7.298
35 2HB ALA 5 3HB ALA 5 8.995 14.372 5.703
36 3HB ALA 5 2HB ALA 5 7.693 15.577 5.845
37 H ASP 6 H ASP 6 5.119 14.551 5.239
38 HA ASP 6 HA ASP 6 4.492 12.397 3.679
39 1HB ASP 6 1HB ASP 6 2.989 13.839 2.593
40 2HB ASP 6 2HB ASP 6 3.246 14.663 4.118
41 H GLY 7 H GLY 7 4.391 13.326 0.971
42 1HA GLY 7 2HA GLY 7 6.877 14.324 0.036
43 2HA GLY 7 1HA GLY 7 5.601 13.586 -0.911
44 H ALA 8 H ALA 8 5.594 11.078 0.794
45 HA ALA 8 HA ALA 8 8.243 9.998 0.366
46 1HB ALA 8 1HB ALA 8 6.674 9.591 2.387
47 2HB ALA 8 3HB ALA 8 5.781 8.501 1.299
48 3HB ALA 8 2HB ALA 8 7.491 8.180 1.674
49 H LYS 9 H LYS 9 8.836 8.589 -1.264
50 HA LYS 9 HA LYS 9 6.711 7.949 -3.191
51 1HB LYS 9 1HB LYS 9 9.600 8.715 -3.685
52 2HB LYS 9 2HB LYS 9 8.555 8.024 -4.910
53 1HG LYS 9 1HG LYS 9 7.126 9.912 -4.954
54 2HG LYS 9 2HG LYS 9 7.598 10.437 -3.351
55 1HD LYS 9 1HD LYS 9 9.967 10.827 -4.347
56 2HD LYS 9 2HD LYS 9 9.220 10.633 -5.921
57 1HE LYS 9 1HE LYS 9 9.190 12.991 -5.506
58 2HE LYS 9 2HE LYS 9 7.543 12.461 -5.226
59 1HZ LYS 9 1HZ LYS 9 8.204 12.260 -2.842
60 2HZ LYS 9 2HZ LYS 9 9.585 13.050 -3.209
61 3HZ LYS 9 3HZ LYS 9 8.143 13.786 -3.421
62 H ILE 10 H ILE 10 6.503 5.826 -3.831
63 HA ILE 10 HA ILE 10 8.437 3.979 -2.615
64 HB ILE 10 HB ILE 10 5.514 3.501 -3.203
65 1HG1 ILE 10 1HG1 ILE 10 6.575 3.657 -0.416
66 2HG1 ILE 10 2HG1 ILE 10 6.338 5.165 -1.276
67 1HG2 ILE 10 1HG2 ILE 10 7.203 1.553 -3.229
68 2HG2 ILE 10 2HG2 ILE 10 7.300 1.805 -1.470
69 3HG2 ILE 10 3HG2 ILE 10 5.741 1.398 -2.226
70 1HD1 ILE 10 1HD1 ILE 10 3.978 4.382 -1.845
71 2HD1 ILE 10 2HD1 ILE 10 4.250 3.008 -0.746
72 3HD1 ILE 10 3HD1 ILE 10 4.274 4.672 -0.114
73 H ASP 11 H ASP 11 9.631 2.767 -3.990
74 HA ASP 11 HA ASP 11 8.498 1.999 -6.490
75 1HB ASP 11 1HB ASP 11 9.339 4.081 -7.289
76 2HB ASP 11 2HB ASP 11 10.763 4.003 -6.271
77 H PHE 12 H PHE 12 8.900 -0.161 -5.671
78 HA PHE 12 HA PHE 12 11.742 -0.790 -5.278
79 1HB PHE 12 1HB PHE 12 9.170 -2.167 -4.293
80 2HB PHE 12 2HB PHE 12 10.794 -2.686 -3.886
81 HD1 PHE 12 HD1 PHE 12 12.044 -0.012 -3.349
82 HD2 PHE 12 HD2 PHE 12 8.289 -1.617 -2.195
83 HE1 PHE 12 HE1 PHE 12 12.020 1.489 -1.337
84 HE2 PHE 12 HE2 PHE 12 8.265 -0.116 -0.184
85 HZ PHE 12 HZ PHE 12 10.131 1.419 0.221
86 H ILE 13 H ILE 13 8.763 -1.428 -7.057
87 HA ILE 13 HA ILE 13 9.970 -3.795 -8.273
88 HB ILE 13 HB ILE 13 7.166 -2.680 -8.365
89 1HG1 ILE 13 1HG1 ILE 13 8.070 -5.277 -7.119
90 2HG1 ILE 13 2HG1 ILE 13 8.081 -3.774 -6.217
91 1HG2 ILE 13 1HG2 ILE 13 8.495 -4.890 -9.882
92 2HG2 ILE 13 2HG2 ILE 13 6.804 -5.091 -9.364
93 3HG2 ILE 13 3HG2 ILE 13 7.259 -3.721 -10.404
94 1HD1 ILE 13 1HD1 ILE 13 5.646 -4.970 -7.619
95 2HD1 ILE 13 2HD1 ILE 13 5.957 -5.000 -5.867
96 3HD1 ILE 13 3HD1 ILE 13 5.659 -3.451 -6.692
97 H ALA 14 H ALA 14 11.613 -2.721 -9.497
98 HA ALA 14 HA ALA 14 11.013 -0.559 -11.202
99 1HB ALA 14 1HB ALA 14 13.278 -2.175 -10.415
100 2HB ALA 14 2HB ALA 14 13.256 -1.997 -12.186
101 3HB ALA 14 3HB ALA 14 13.258 -0.552 -11.146
102 H GLY 15 H GLY 15 11.655 -0.924 -13.716
103 1HA GLY 15 2HA GLY 15 9.708 -1.750 -15.189
104 2HA GLY 15 1HA GLY 15 10.281 -3.333 -14.703
105 H GLY 16 H GLY 16 11.709 -0.190 -15.866
106 1HA GLY 16 2HA GLY 16 13.071 -1.660 -17.999
107 2HA GLY 16 1HA GLY 16 14.067 -0.805 -16.838
108 H GLU 17 H GLU 17 11.404 -0.407 -19.233
109 HA GLU 17 HA GLU 17 12.524 1.892 -20.277
110 1HB GLU 17 1HB GLU 17 10.825 0.263 -21.333
111 2HB GLU 17 2HB GLU 17 9.582 1.140 -20.463
112 1HG GLU 17 1HG GLU 17 10.656 3.287 -21.553
113 2HG GLU 17 2HG GLU 17 11.416 2.159 -22.658
114 H LYS 18 H LYS 18 10.413 1.354 -17.511
115 HA LYS 18 HA LYS 18 10.652 4.109 -16.787
116 1HB LYS 18 1HB LYS 18 8.348 3.331 -18.278
117 2HB LYS 18 2HB LYS 18 7.835 3.602 -16.625
118 1HG LYS 18 1HG LYS 18 8.991 5.829 -16.639
119 2HG LYS 18 2HG LYS 18 9.479 5.559 -18.300
120 1HD LYS 18 1HD LYS 18 6.782 5.096 -18.518
121 2HD LYS 18 2HD LYS 18 6.785 6.253 -17.201
122 1HE LYS 18 1HE LYS 18 8.440 6.821 -19.677
123 2HE LYS 18 2HE LYS 18 6.711 7.101 -19.719
124 1HZ LYS 18 1HZ LYS 18 6.977 8.487 -17.748
125 2HZ LYS 18 2HZ LYS 18 8.596 8.272 -17.793
126 3HZ LYS 18 3HZ LYS 18 7.841 9.057 -19.011
127 H ASN 19 H ASN 19 8.510 4.040 -14.831
128 HA ASN 19 HA ASN 19 8.613 1.666 -13.378
129 1HB ASN 19 1HB ASN 19 9.949 2.594 -11.399
130 2HB ASN 19 2HB ASN 19 10.912 2.214 -12.813
131 2HD2 ASN 19 2HD2 ASN 19 12.146 3.795 -11.232
132 1HD2 ASN 19 1HD2 ASN 19 12.137 5.459 -11.712
133 H LEU 20 H LEU 20 6.704 1.783 -12.175
134 HA LEU 20 HA LEU 20 5.358 4.293 -11.979
135 1HB LEU 20 1HB LEU 20 4.708 1.499 -11.048
136 2HB LEU 20 2HB LEU 20 3.654 2.872 -10.770
137 HG LEU 20 HG LEU 20 4.415 1.605 -13.402
138 1HD1 LEU 20 1HD1 LEU 20 2.439 0.888 -11.795
139 2HD1 LEU 20 2HD1 LEU 20 1.620 2.263 -12.576
140 3HD1 LEU 20 3HD1 LEU 20 2.242 0.919 -13.564
141 1HD2 LEU 20 1HD2 LEU 20 3.485 4.385 -12.866
142 2HD2 LEU 20 2HD2 LEU 20 4.531 3.748 -14.157
143 3HD2 LEU 20 3HD2 LEU 20 2.769 3.518 -14.245
144 H THR 21 H THR 21 5.208 5.675 -10.257
145 HA THR 21 HA THR 21 6.486 4.772 -7.761
146 HB THR 21 HB THR 21 6.589 7.659 -8.639
147 HG1 THR 21 HG1 THR 21 7.169 6.055 -10.442
148 1HG2 THR 21 1HG2 THR 21 7.816 6.058 -6.623
149 2HG2 THR 21 2HG2 THR 21 9.084 6.362 -7.835
150 3HG2 THR 21 3HG2 THR 21 8.244 7.729 -7.063
151 H VAL 22 H VAL 22 5.028 4.573 -6.191
152 HA VAL 22 HA VAL 22 2.632 6.231 -6.370
153 HB VAL 22 HB VAL 22 3.326 3.771 -4.756
154 1HG1 VAL 22 1HG1 VAL 22 0.849 5.509 -4.763
155 2HG1 VAL 22 2HG1 VAL 22 0.820 3.807 -4.242
156 3HG1 VAL 22 3HG1 VAL 22 1.837 4.984 -3.378
157 1HG2 VAL 22 1HG2 VAL 22 2.089 4.233 -7.385
158 2HG2 VAL 22 2HG2 VAL 22 2.818 2.761 -6.700
159 3HG2 VAL 22 3HG2 VAL 22 1.133 3.182 -6.312
160 H VAL 23 H VAL 23 2.315 7.957 -5.049
161 HA VAL 23 HA VAL 23 4.378 8.461 -3.061
162 HB VAL 23 HB VAL 23 2.157 10.210 -4.137
163 1HG1 VAL 23 1HG1 VAL 23 3.844 10.519 -1.863
164 2HG1 VAL 23 2HG1 VAL 23 4.389 11.676 -3.100
165 3HG1 VAL 23 3HG1 VAL 23 2.694 11.687 -2.558
166 1HG2 VAL 23 1HG2 VAL 23 3.798 9.533 -5.869
167 2HG2 VAL 23 2HG2 VAL 23 3.859 11.276 -5.510
168 3HG2 VAL 23 3HG2 VAL 23 5.108 10.188 -4.857
169 H PHE 24 H PHE 24 3.985 8.628 -0.849
170 HA PHE 24 HA PHE 24 1.225 8.098 -0.020
171 1HB PHE 24 1HB PHE 24 2.810 6.057 -0.001
172 2HB PHE 24 2HB PHE 24 3.832 6.928 1.125
173 HD1 PHE 24 HD1 PHE 24 0.232 5.973 0.786
174 HD2 PHE 24 HD2 PHE 24 3.578 6.431 3.356
175 HE1 PHE 24 HE1 PHE 24 -1.118 5.076 2.703
176 HE2 PHE 24 HE2 PHE 24 2.228 5.535 5.273
177 HZ PHE 24 HZ PHE 24 -0.104 4.868 4.924
178 H ASN 25 H ASN 25 0.595 9.050 1.976
179 HA ASN 25 HA ASN 25 2.616 10.815 3.110
180 1HB ASN 25 2HB ASN 25 -0.077 11.872 3.480
181 2HB ASN 25 1HB ASN 25 1.299 12.644 2.718
182 2HD2 ASN 25 2HD2 ASN 25 1.871 11.688 0.504
183 1HD2 ASN 25 1HD2 ASN 25 0.560 11.458 -0.604
184 H HIS 26 H HIS 26 2.834 10.452 5.330
185 HA HIS 26 HA HIS 26 1.093 8.581 6.577
186 1HB HIS 26 1HB HIS 26 3.611 10.012 7.247
187 2HB HIS 26 2HB HIS 26 2.621 9.514 8.604
188 HD1 HIS 26 HD1 HIS 26 4.557 8.087 5.672
189 HD2 HIS 26 HD2 HIS 26 2.608 6.771 9.146
190 HE1 HIS 26 HE1 HIS 26 5.190 5.632 5.961
191 H SER 27 H SER 27 1.105 12.013 6.099
192 HA SER 27 HA SER 27 -0.419 12.507 8.482
193 1HB SER 27 1HB SER 27 -0.449 14.872 7.632
194 2HB SER 27 2HB SER 27 1.167 14.219 7.817
195 HG SER 27 HG SER 27 -0.296 14.268 5.316
196 H THR 28 H THR 28 -1.276 10.762 6.019
197 HA THR 28 HA THR 28 -3.799 12.188 5.484
198 HB THR 28 HB THR 28 -2.149 10.219 3.820
199 HG1 THR 28 HG1 THR 28 -1.800 12.691 4.063
200 1HG2 THR 28 1HG2 THR 28 -4.918 10.320 3.770
201 2HG2 THR 28 2HG2 THR 28 -4.498 11.620 2.629
202 3HG2 THR 28 3HG2 THR 28 -3.910 9.964 2.348
203 H HIS 29 H HIS 29 -2.230 9.183 6.567
204 HA HIS 29 HA HIS 29 -4.892 8.063 6.999
205 1HB HIS 29 2HB HIS 29 -2.179 6.712 7.039
206 2HB HIS 29 1HB HIS 29 -3.721 5.914 7.276
207 HD1 HIS 29 HD1 HIS 29 -1.630 7.588 4.599
208 HD2 HIS 29 HD2 HIS 29 -5.168 5.359 4.938
209 HE1 HIS 29 HE1 HIS 29 -2.310 6.959 2.221
210 H LYS 30 H LYS 30 -3.513 10.267 8.582
211 HA LYS 30 HA LYS 30 -2.523 9.274 10.970
212 1HB LYS 30 1HB LYS 30 -2.914 11.484 11.844
213 2HB LYS 30 2HB LYS 30 -2.341 11.614 10.193
214 1HG LYS 30 1HG LYS 30 -4.823 11.738 9.480
215 2HG LYS 30 2HG LYS 30 -5.209 11.922 11.180
216 1HD LYS 30 1HD LYS 30 -3.465 13.873 11.169
217 2HD LYS 30 2HD LYS 30 -3.574 13.790 9.422
218 1HE LYS 30 1HE LYS 30 -6.029 14.168 9.532
219 2HE LYS 30 2HE LYS 30 -5.968 14.176 11.283
220 1HZ LYS 30 1HZ LYS 30 -4.338 16.031 9.718
221 2HZ LYS 30 2HZ LYS 30 -5.889 16.379 10.091
222 3HZ LYS 30 3HZ LYS 30 -4.794 16.152 11.281
223 H ASP 31 H ASP 31 -5.710 9.111 9.617
224 HA ASP 31 HA ASP 31 -6.971 8.916 12.179
225 1HB ASP 31 2HB ASP 31 -9.008 8.839 10.983
226 2HB ASP 31 1HB ASP 31 -7.994 9.856 9.979
227 H VAL 32 H VAL 32 -4.944 6.950 10.433
228 HA VAL 32 HA VAL 32 -6.388 4.508 11.206
229 HB VAL 32 HB VAL 32 -4.352 4.838 8.997
230 1HG1 VAL 32 1HG1 VAL 32 -4.955 2.557 10.282
231 2HG1 VAL 32 2HG1 VAL 32 -6.276 2.565 9.089
232 3HG1 VAL 32 3HG1 VAL 32 -4.583 2.618 8.542
233 1HG2 VAL 32 1HG2 VAL 32 -7.142 5.561 9.043
234 2HG2 VAL 32 2HG2 VAL 32 -5.960 5.707 7.721
235 3HG2 VAL 32 3HG2 VAL 32 -6.890 4.203 7.921
236 H LYS 33 H LYS 33 -5.417 3.232 12.714
237 HA LYS 33 HA LYS 33 -3.282 4.125 14.184
238 1HB LYS 33 2HB LYS 33 -4.205 1.259 13.823
239 2HB LYS 33 1HB LYS 33 -3.242 1.875 15.151
240 1HG LYS 33 1HG LYS 33 -5.394 3.641 15.136
241 2HG LYS 33 2HG LYS 33 -6.157 2.140 14.652
242 1HD LYS 33 1HD LYS 33 -4.233 1.969 16.949
243 2HD LYS 33 2HD LYS 33 -5.731 2.825 17.257
244 1HE LYS 33 1HE LYS 33 -6.240 0.342 15.779
245 2HE LYS 33 2HE LYS 33 -5.346 0.016 17.251
246 1HZ LYS 33 1HZ LYS 33 -7.652 1.797 17.333
247 2HZ LYS 33 2HZ LYS 33 -7.877 0.180 17.336
248 3HZ LYS 33 3HZ LYS 33 -7.016 0.887 18.530
249 H CYS 34 H CYS 34 -1.075 3.164 14.433
250 HA CYS 34 HA CYS 34 0.199 3.170 11.903
251 1HB CYS 34 1HB CYS 34 1.466 2.413 14.533
252 2HB CYS 34 2HB CYS 34 2.244 3.061 13.102
253 H ASP 35 H ASP 35 -0.662 0.740 14.424
254 HA ASP 35 HA ASP 35 0.738 -1.362 13.260
255 1HB ASP 35 1HB ASP 35 -0.818 -2.795 14.656
256 2HB ASP 35 2HB ASP 35 0.004 -1.536 15.556
257 H ASP 36 H ASP 36 -1.961 0.423 12.191
258 HA ASP 36 HA ASP 36 -3.625 -1.572 11.227
259 1HB ASP 36 1HB ASP 36 -3.904 1.056 11.428
260 2HB ASP 36 2HB ASP 36 -3.227 1.082 9.812
261 H CYS 37 H CYS 37 -0.474 -0.442 10.275
262 HA CYS 37 HA CYS 37 -0.720 -1.934 7.772
263 1HB CYS 37 1HB CYS 37 0.661 0.741 8.147
264 2HB CYS 37 2HB CYS 37 0.901 -0.292 6.752
265 H HIS 38 H HIS 38 1.442 -0.454 10.285
266 HA HIS 38 HA HIS 38 3.581 -2.221 9.637
267 1HB HIS 38 1HB HIS 38 3.168 -0.346 11.983
268 2HB HIS 38 2HB HIS 38 4.658 -1.196 11.625
269 HD1 HIS 38 HD1 HIS 38 5.765 -0.574 9.179
270 HD2 HIS 38 HD2 HIS 38 2.921 2.089 10.734
271 HE1 HIS 38 HE1 HIS 38 6.074 1.621 7.915
272 H HIS 39 H HIS 39 2.735 -4.350 9.821
273 HA HIS 39 HA HIS 39 1.815 -5.075 12.493
274 1HB HIS 39 2HB HIS 39 0.693 -6.881 11.543
275 2HB HIS 39 1HB HIS 39 0.453 -5.580 10.393
276 HD1 HIS 39 HD1 HIS 39 1.558 -9.039 10.602
277 HD2 HIS 39 HD2 HIS 39 2.362 -5.775 8.094
278 HE1 HIS 39 HE1 HIS 39 2.586 -10.007 8.477
279 H GLN 40 H GLN 40 4.262 -4.640 12.998
280 HA GLN 40 HA GLN 40 5.519 -7.244 12.845
281 1HB GLN 40 1HB GLN 40 6.811 -4.619 12.009
282 2HB GLN 40 2HB GLN 40 7.758 -6.025 12.449
283 1HG GLN 40 1HG GLN 40 5.687 -5.889 10.208
284 2HG GLN 40 2HG GLN 40 7.426 -5.937 9.999
285 2HE2 GLN 40 2HE2 GLN 40 4.877 -7.729 9.556
286 1HE2 GLN 40 1HE2 GLN 40 5.426 -9.320 9.966
287 HA PRO 41 HA PRO 41 6.507 -7.244 17.084
288 1HB PRO 41 2HB PRO 41 9.384 -6.691 16.328
289 2HB PRO 41 1HB PRO 41 8.672 -7.974 17.360
290 1HG PRO 41 1HG PRO 41 9.354 -7.811 14.717
291 2HG PRO 41 2HG PRO 41 8.725 -9.435 15.143
292 1HD PRO 41 1HD PRO 41 7.432 -7.854 13.349
293 2HD PRO 41 2HD PRO 41 6.500 -8.800 14.548
294 H GLY 42 H GLY 42 6.534 -5.629 18.710
295 1HA GLY 42 2HA GLY 42 6.712 -3.580 19.620
296 2HA GLY 42 1HA GLY 42 6.227 -2.984 18.044
297 H ASP 43 H ASP 43 9.236 -4.623 19.276
298 HA ASP 43 HA ASP 43 10.888 -2.594 19.510
299 1HB ASP 43 1HB ASP 43 11.153 -5.348 19.180
300 2HB ASP 43 2HB ASP 43 12.073 -4.733 17.821
301 H LYS 44 H LYS 44 10.587 -4.461 16.381
302 HA LYS 44 HA LYS 44 11.481 -2.057 14.972
303 1HB LYS 44 1HB LYS 44 11.484 -4.989 14.213
304 2HB LYS 44 2HB LYS 44 11.854 -3.702 13.082
305 1HG LYS 44 1HG LYS 44 13.838 -3.092 14.203
306 2HG LYS 44 2HG LYS 44 13.303 -3.751 15.735
307 1HD LYS 44 1HD LYS 44 14.262 -5.758 15.285
308 2HD LYS 44 2HD LYS 44 13.401 -5.887 13.764
309 1HE LYS 44 2HE LYS 44 15.436 -5.663 12.762
310 2HE LYS 44 1HE LYS 44 15.324 -3.963 13.170
311 1HZ LYS 44 1HZ LYS 44 16.380 -5.902 15.087
312 2HZ LYS 44 2HZ LYS 44 17.340 -5.224 13.953
313 3HZ LYS 44 3HZ LYS 44 16.594 -4.284 15.061
314 H GLN 45 H GLN 45 8.837 -2.095 16.071
315 HA GLN 45 HA GLN 45 6.821 -3.037 14.663
316 1HB GLN 45 1HB GLN 45 6.709 -1.442 16.619
317 2HB GLN 45 2HB GLN 45 7.022 -0.116 15.517
318 1HG GLN 45 1HG GLN 45 4.946 -0.418 14.366
319 2HG GLN 45 2HG GLN 45 4.728 -2.039 14.996
320 2HE2 GLN 45 2HE2 GLN 45 4.899 1.376 15.886
321 1HE2 GLN 45 1HE2 GLN 45 3.862 1.307 17.272
322 H TYR 46 H TYR 46 8.844 -0.254 13.745
323 HA TYR 46 HA TYR 46 7.497 -0.143 11.102
324 1HB TYR 46 2HB TYR 46 9.551 1.788 12.191
325 2HB TYR 46 1HB TYR 46 8.360 2.051 10.905
326 HD1 TYR 46 HD1 TYR 46 5.887 2.111 11.537
327 HD2 TYR 46 HD2 TYR 46 9.055 2.324 14.430
328 HE1 TYR 46 HE1 TYR 46 4.310 3.071 13.193
329 HE2 TYR 46 HE2 TYR 46 7.478 3.283 16.086
330 HH TYR 46 HH TYR 46 5.299 4.501 16.151
331 H ALA 47 H ALA 47 8.442 -1.702 9.757
332 HA ALA 47 HA ALA 47 11.334 -1.402 9.422
333 1HB ALA 47 1HB ALA 47 9.825 -3.787 10.335
334 2HB ALA 47 3HB ALA 47 11.544 -3.373 10.538
335 3HB ALA 47 2HB ALA 47 10.975 -4.086 9.009
336 H GLY 48 H GLY 48 11.801 -3.088 7.347
337 1HA GLY 48 2HA GLY 48 11.708 -2.930 5.079
338 2HA GLY 48 1HA GLY 48 10.370 -1.805 5.199
339 H CYS 49 H CYS 49 8.804 -2.685 3.873
340 HA CYS 49 HA CYS 49 7.505 -5.029 4.811
341 1HB CYS 49 2HB CYS 49 6.951 -3.640 2.196
342 2HB CYS 49 1HB CYS 49 5.858 -4.594 3.178
343 H THR 50 H THR 50 9.829 -4.124 2.257
344 HA THR 50 HA THR 50 9.623 -6.755 1.024
345 HB THR 50 HB THR 50 11.355 -5.630 -0.534
346 HG1 THR 50 HG1 THR 50 12.143 -3.853 0.548
347 1HG2 THR 50 1HG2 THR 50 8.802 -5.537 -0.931
348 2HG2 THR 50 2HG2 THR 50 8.835 -3.950 -0.126
349 3HG2 THR 50 3HG2 THR 50 9.739 -4.199 -1.639
350 H THR 51 H THR 51 10.640 -6.214 3.875
351 HA THR 51 HA THR 51 13.437 -6.734 3.774
352 HB THR 51 HB THR 51 11.365 -7.086 6.005
353 HG1 THR 51 HG1 THR 51 11.835 -4.946 4.704
354 1HG2 THR 51 1HG2 THR 51 13.760 -8.070 6.335
355 2HG2 THR 51 2HG2 THR 51 14.326 -6.385 6.238
356 3HG2 THR 51 3HG2 THR 51 13.210 -6.876 7.535
357 H ASP 52 H ASP 52 14.535 -8.681 4.511
358 HA ASP 52 HA ASP 52 13.794 -10.856 3.062
359 1HB ASP 52 1HB ASP 52 15.982 -10.180 4.494
360 2HB ASP 52 2HB ASP 52 15.268 -11.277 5.659
361 H GLY 53 H GLY 53 12.926 -12.999 3.759
362 1HA GLY 53 2HA GLY 53 11.995 -13.619 6.297
363 2HA GLY 53 1HA GLY 53 11.421 -14.308 4.791
364 H CYS 54 H CYS 54 10.593 -11.572 3.736
365 HA CYS 54 HA CYS 54 8.072 -11.499 5.188
366 1HB CYS 54 1HB CYS 54 9.576 -8.962 4.478
367 2HB CYS 54 2HB CYS 54 8.038 -9.083 5.309
368 H HIS 55 H HIS 55 7.972 -8.839 3.296
369 HA HIS 55 HA HIS 55 6.941 -10.362 1.048
370 1HB HIS 55 1HB HIS 55 6.663 -7.394 1.553
371 2HB HIS 55 2HB HIS 55 5.717 -8.393 0.468
372 HD1 HIS 55 HD1 HIS 55 4.196 -10.318 1.746
373 HD2 HIS 55 HD2 HIS 55 5.570 -7.094 4.052
374 HE1 HIS 55 HE1 HIS 55 2.742 -10.267 3.842
375 H ASN 56 H ASN 56 9.638 -10.615 1.064
376 HA ASN 56 HA ASN 56 10.731 -8.462 -0.497
377 1HB ASN 56 1HB ASN 56 12.049 -9.636 1.338
378 2HB ASN 56 2HB ASN 56 12.010 -11.104 0.382
379 2HD2 ASN 56 2HD2 ASN 56 14.350 -9.857 1.204
380 1HD2 ASN 56 1HD2 ASN 56 15.223 -9.264 -0.169
381 H ILE 57 H ILE 57 8.988 -9.109 -2.237
382 HA ILE 57 HA ILE 57 10.216 -11.090 -4.006
383 HB ILE 57 HB ILE 57 7.251 -10.879 -3.480
384 1HG1 ILE 57 1HG1 ILE 57 8.770 -11.862 -1.618
385 2HG1 ILE 57 2HG1 ILE 57 7.335 -12.739 -2.113
386 1HG2 ILE 57 1HG2 ILE 57 8.923 -12.354 -5.452
387 2HG2 ILE 57 2HG2 ILE 57 7.537 -13.214 -4.741
388 3HG2 ILE 57 3HG2 ILE 57 7.284 -11.679 -5.606
389 1HD1 ILE 57 1HD1 ILE 57 9.851 -13.347 -3.628
390 2HD1 ILE 57 2HD1 ILE 57 9.765 -13.914 -1.943
391 3HD1 ILE 57 3HD1 ILE 57 8.538 -14.436 -3.122
392 H LEU 58 H LEU 58 10.936 -9.932 -5.709
393 HA LEU 58 HA LEU 58 9.343 -7.611 -6.508
394 1HB LEU 58 1HB LEU 58 12.201 -8.358 -7.141
395 2HB LEU 58 2HB LEU 58 11.376 -6.923 -7.715
396 HG LEU 58 HG LEU 58 12.115 -7.595 -4.858
397 1HD1 LEU 58 1HD1 LEU 58 13.927 -6.751 -6.321
398 2HD1 LEU 58 2HD1 LEU 58 12.965 -5.285 -6.626
399 3HD1 LEU 58 3HD1 LEU 58 13.537 -5.648 -4.980
400 1HD2 LEU 58 1HD2 LEU 58 10.403 -5.330 -5.908
401 2HD2 LEU 58 2HD2 LEU 58 9.952 -6.590 -4.733
402 3HD2 LEU 58 3HD2 LEU 58 11.153 -5.352 -4.294
403 H ASP 59 H ASP 59 7.786 -9.415 -7.301
404 HA ASP 59 HA ASP 59 8.379 -9.725 -10.095
405 1HB ASP 59 1HB ASP 59 8.874 -11.870 -8.424
406 2HB ASP 59 2HB ASP 59 7.199 -12.165 -8.845
407 H LYS 60 H LYS 60 6.576 -8.432 -10.675
408 HA LYS 60 HA LYS 60 4.125 -8.565 -9.261
409 1HB LYS 60 2HB LYS 60 3.325 -7.018 -10.960
410 2HB LYS 60 1HB LYS 60 4.904 -6.530 -10.377
411 1HG LYS 60 1HG LYS 60 5.226 -8.349 -12.628
412 2HG LYS 60 2HG LYS 60 4.129 -7.059 -13.076
413 1HD LYS 60 1HD LYS 60 5.772 -5.456 -13.012
414 2HD LYS 60 2HD LYS 60 6.501 -6.116 -11.561
415 1HE LYS 60 2HE LYS 60 8.158 -6.518 -13.196
416 2HE LYS 60 1HE LYS 60 7.337 -8.064 -13.100
417 1HZ LYS 60 1HZ LYS 60 6.259 -6.161 -14.979
418 2HZ LYS 60 2HZ LYS 60 7.714 -6.799 -15.355
419 3HZ LYS 60 3HZ LYS 60 6.430 -7.780 -15.117
420 H ALA 61 H ALA 61 4.390 -11.132 -9.518
421 HA ALA 61 HA ALA 61 2.220 -12.112 -10.719
422 1HB ALA 61 1HB ALA 61 3.404 -13.151 -12.862
423 2HB ALA 61 3HB ALA 61 4.414 -11.692 -12.730
424 3HB ALA 61 2HB ALA 61 2.651 -11.539 -12.922
425 H ASP 62 H ASP 62 3.242 -12.828 -8.454
426 HA ASP 62 HA ASP 62 4.698 -15.290 -9.026
427 1HB ASP 62 1HB ASP 62 5.887 -13.416 -7.668
428 2HB ASP 62 2HB ASP 62 4.750 -13.775 -6.384
429 H LYS 63 H LYS 63 4.374 -16.763 -6.784
430 HA LYS 63 HA LYS 63 1.546 -16.565 -6.040
431 1HB LYS 63 1HB LYS 63 2.695 -18.546 -7.728
432 2HB LYS 63 2HB LYS 63 2.352 -19.319 -6.194
433 1HG LYS 63 1HG LYS 63 0.048 -17.898 -6.462
434 2HG LYS 63 2HG LYS 63 0.456 -18.065 -8.158
435 1HD LYS 63 1HD LYS 63 0.896 -20.627 -6.924
436 2HD LYS 63 2HD LYS 63 -0.663 -20.048 -6.371
437 1HE LYS 63 1HE LYS 63 -1.599 -20.078 -8.504
438 2HE LYS 63 2HE LYS 63 -0.080 -19.713 -9.298
439 1HZ LYS 63 1HZ LYS 63 -0.766 -22.294 -8.070
440 2HZ LYS 63 2HZ LYS 63 -0.749 -21.977 -9.672
441 3HZ LYS 63 3HZ LYS 63 0.644 -21.952 -8.820
442 H SER 64 H SER 64 2.188 -15.578 -4.057
443 HA SER 64 HA SER 64 2.689 -17.409 -2.041
444 1HB SER 64 1HB SER 64 5.061 -16.812 -3.281
445 2HB SER 64 2HB SER 64 5.020 -15.542 -2.074
446 HG SER 64 HG SER 64 5.858 -17.093 -0.830
447 H VAL 65 H VAL 65 2.753 -16.295 0.136
448 HA VAL 65 HA VAL 65 1.191 -13.881 -0.009
449 HB VAL 65 HB VAL 65 0.503 -15.583 1.508
450 1HG1 VAL 65 1HG1 VAL 65 3.386 -15.599 2.313
451 2HG1 VAL 65 2HG1 VAL 65 2.163 -15.988 3.547
452 3HG1 VAL 65 3HG1 VAL 65 2.260 -16.953 2.054
453 1HG2 VAL 65 1HG2 VAL 65 0.793 -12.974 2.217
454 2HG2 VAL 65 2HG2 VAL 65 -0.026 -14.198 3.217
455 3HG2 VAL 65 3HG2 VAL 65 1.672 -13.774 3.542
456 H ASN 66 H ASN 66 4.378 -14.397 -0.467
457 HA ASN 66 HA ASN 66 5.250 -12.292 1.314
458 1HB ASN 66 2HB ASN 66 6.877 -13.986 -0.653
459 2HB ASN 66 1HB ASN 66 7.538 -12.933 0.582
460 2HD2 ASN 66 2HD2 ASN 66 6.599 -13.356 2.841
461 1HD2 ASN 66 1HD2 ASN 66 6.543 -15.008 3.360
462 H SER 67 H SER 67 3.569 -12.287 -1.419
463 HA SER 67 HA SER 67 5.275 -10.879 -3.187
464 1HB SER 67 1HB SER 67 2.896 -10.393 -4.273
465 2HB SER 67 2HB SER 67 3.618 -11.987 -4.371
466 HG SER 67 HG SER 67 1.362 -12.015 -3.668
467 H TRP 68 H TRP 68 5.516 -8.648 -3.437
468 HA TRP 68 HA TRP 68 4.229 -7.023 -1.389
469 1HB TRP 68 1HB TRP 68 6.523 -6.686 -1.367
470 2HB TRP 68 2HB TRP 68 6.664 -6.733 -3.113
471 HD1 TRP 68 HD1 TRP 68 6.926 -4.377 -4.210
472 HE1 TRP 68 HE1 TRP 68 6.466 -1.850 -3.603
473 HE3 TRP 68 HE3 TRP 68 4.654 -5.313 0.241
474 HZ2 TRP 68 HZ2 TRP 68 5.232 -0.556 -1.380
475 HZ3 TRP 68 HZ3 TRP 68 3.851 -3.362 1.568
476 HH2 TRP 68 HH2 TRP 68 4.109 -1.048 0.824
477 H TYR 69 H TYR 69 3.158 -8.234 -4.047
478 HA TYR 69 HA TYR 69 2.071 -5.676 -5.129
479 1HB TYR 69 1HB TYR 69 3.503 -6.609 -6.794
480 2HB TYR 69 2HB TYR 69 2.874 -8.243 -6.521
481 HD1 TYR 69 HD1 TYR 69 0.536 -8.808 -7.239
482 HD2 TYR 69 HD2 TYR 69 2.431 -5.099 -8.289
483 HE1 TYR 69 HE1 TYR 69 -1.135 -8.464 -9.038
484 HE2 TYR 69 HE2 TYR 69 0.759 -4.755 -10.089
485 HH TYR 69 HH TYR 69 -1.064 -5.595 -11.173
486 H LYS 70 H LYS 70 1.368 -8.403 -3.269
487 HA LYS 70 HA LYS 70 -1.358 -8.533 -4.345
488 1HB LYS 70 1HB LYS 70 0.026 -10.645 -4.243
489 2HB LYS 70 2HB LYS 70 0.007 -10.507 -2.496
490 1HG LYS 70 1HG LYS 70 -2.692 -10.162 -3.197
491 2HG LYS 70 2HG LYS 70 -2.137 -11.379 -4.329
492 1HD LYS 70 1HD LYS 70 -1.547 -11.585 -1.348
493 2HD LYS 70 2HD LYS 70 -3.037 -12.202 -2.033
494 1HE LYS 70 1HE LYS 70 -0.215 -13.046 -2.851
495 2HE LYS 70 2HE LYS 70 -1.326 -13.993 -1.881
496 1HZ LYS 70 1HZ LYS 70 -2.868 -13.694 -3.882
497 2HZ LYS 70 2HZ LYS 70 -1.509 -13.330 -4.712
498 3HZ LYS 70 3HZ LYS 70 -1.657 -14.785 -3.984
499 H VAL 71 H VAL 71 0.644 -8.097 -1.383
500 HA VAL 71 HA VAL 71 -1.541 -7.772 0.354
501 HB VAL 71 HB VAL 71 0.162 -6.773 1.848
502 1HG1 VAL 71 1HG1 VAL 71 -0.196 -9.311 1.374
503 2HG1 VAL 71 2HG1 VAL 71 1.391 -9.212 0.575
504 3HG1 VAL 71 3HG1 VAL 71 1.234 -8.790 2.297
505 1HG2 VAL 71 1HG2 VAL 71 1.472 -6.121 -0.543
506 2HG2 VAL 71 2HG2 VAL 71 2.084 -5.901 1.114
507 3HG2 VAL 71 3HG2 VAL 71 2.482 -7.380 0.207
508 H VAL 72 H VAL 72 -0.491 -5.898 -2.277
509 HA VAL 72 HA VAL 72 -1.467 -3.423 -1.053
510 HB VAL 72 HB VAL 72 0.109 -3.973 -3.574
511 1HG1 VAL 72 1HG1 VAL 72 -1.422 -1.616 -2.717
512 2HG1 VAL 72 2HG1 VAL 72 0.280 -1.261 -3.096
513 3HG1 VAL 72 3HG1 VAL 72 -0.760 -2.037 -4.314
514 1HG2 VAL 72 1HG2 VAL 72 0.928 -3.739 -0.886
515 2HG2 VAL 72 2HG2 VAL 72 1.953 -3.729 -2.341
516 3HG2 VAL 72 3HG2 VAL 72 1.355 -2.196 -1.663
517 H HIS 73 H HIS 73 -1.785 -5.468 -4.037
518 HA HIS 73 HA HIS 73 -4.309 -4.132 -4.566
519 1HB HIS 73 2HB HIS 73 -2.818 -6.163 -6.248
520 2HB HIS 73 1HB HIS 73 -4.200 -5.205 -6.743
521 HD1 HIS 73 HD1 HIS 73 -0.498 -4.927 -6.033
522 HD2 HIS 73 HD2 HIS 73 -3.632 -2.555 -7.497
523 HE1 HIS 73 HE1 HIS 73 0.586 -2.837 -7.016
524 H ASP 74 H ASP 74 -3.847 -6.012 -2.250
525 HA ASP 74 HA ASP 74 -5.127 -8.423 -2.981
526 1HB ASP 74 1HB ASP 74 -3.845 -7.257 -0.641
527 2HB ASP 74 2HB ASP 74 -5.379 -7.957 -0.164
528 H ALA 75 H ALA 75 -7.268 -8.111 -3.740
529 HA ALA 75 HA ALA 75 -8.977 -6.153 -2.566
530 1HB ALA 75 1HB ALA 75 -10.086 -8.359 -4.238
531 2HB ALA 75 3HB ALA 75 -8.832 -7.348 -4.994
532 3HB ALA 75 2HB ALA 75 -10.319 -6.599 -4.365
533 H LYS 76 H LYS 76 -7.867 -9.183 -1.542
534 HA LYS 76 HA LYS 76 -10.199 -9.430 0.211
535 1HB LYS 76 1HB LYS 76 -10.175 -11.093 -1.762
536 2HB LYS 76 2HB LYS 76 -8.818 -11.850 -0.953
537 1HG LYS 76 1HG LYS 76 -10.365 -11.826 1.180
538 2HG LYS 76 2HG LYS 76 -11.671 -11.550 0.045
539 1HD LYS 76 1HD LYS 76 -9.727 -13.800 -0.505
540 2HD LYS 76 2HD LYS 76 -10.949 -14.031 0.729
541 1HE LYS 76 1HE LYS 76 -11.762 -12.967 -1.991
542 2HE LYS 76 2HE LYS 76 -11.472 -14.683 -1.788
543 1HZ LYS 76 1HZ LYS 76 -13.036 -14.538 0.133
544 2HZ LYS 76 2HZ LYS 76 -13.434 -13.035 -0.367
545 3HZ LYS 76 3HZ LYS 76 -13.716 -14.319 -1.335
546 H GLY 77 H GLY 77 -9.717 -9.940 2.354
547 1HA GLY 77 2HA GLY 77 -7.234 -9.197 3.348
548 2HA GLY 77 1HA GLY 77 -7.197 -10.941 3.181
549 H GLY 78 H GLY 78 -7.247 -11.481 5.389
550 1HA GLY 78 2HA GLY 78 -8.889 -12.304 6.953
551 2HA GLY 78 1HA GLY 78 -9.777 -10.805 6.763
552 H ALA 79 H ALA 79 -6.490 -12.024 7.714
553 HA ALA 79 HA ALA 79 -6.378 -11.079 10.213
554 1HB ALA 79 1HB ALA 79 -4.048 -11.331 10.057
555 2HB ALA 79 3HB ALA 79 -3.999 -10.746 8.377
556 3HB ALA 79 2HB ALA 79 -4.650 -12.363 8.737
557 H LYS 80 H LYS 80 -5.921 -9.183 7.192
558 HA LYS 80 HA LYS 80 -6.661 -6.801 8.549
559 1HB LYS 80 1HB LYS 80 -4.412 -5.662 7.856
560 2HB LYS 80 2HB LYS 80 -4.543 -6.502 9.388
561 1HG LYS 80 1HG LYS 80 -3.587 -8.571 8.296
562 2HG LYS 80 2HG LYS 80 -3.385 -7.664 6.810
563 1HD LYS 80 2HD LYS 80 -2.064 -7.032 9.492
564 2HD LYS 80 1HD LYS 80 -1.268 -7.716 8.089
565 1HE LYS 80 1HE LYS 80 -1.874 -5.631 6.782
566 2HE LYS 80 2HE LYS 80 -2.552 -4.947 8.246
567 1HZ LYS 80 1HZ LYS 80 0.111 -5.968 8.524
568 2HZ LYS 80 2HZ LYS 80 -0.021 -4.686 7.521
569 3HZ LYS 80 3HZ LYS 80 -0.531 -4.569 9.068
570 HA PRO 81 HA PRO 81 -7.774 -5.817 4.433
571 1HB PRO 81 1HB PRO 81 -7.975 -3.090 4.590
572 2HB PRO 81 2HB PRO 81 -9.071 -4.190 5.487
573 1HG PRO 81 1HG PRO 81 -6.786 -2.745 6.351
574 2HG PRO 81 2HG PRO 81 -8.288 -2.956 7.309
575 1HD PRO 81 1HD PRO 81 -5.949 -4.389 7.761
576 2HD PRO 81 2HD PRO 81 -7.575 -5.059 8.089
577 H THR 82 H THR 82 -7.101 -3.739 2.747
578 HA THR 82 HA THR 82 -4.180 -3.557 2.816
579 HB THR 82 HB THR 82 -4.210 -4.228 0.352
580 HG1 THR 82 HG1 THR 82 -6.354 -5.500 -0.006
581 1HG2 THR 82 1HG2 THR 82 -4.506 -5.962 2.651
582 2HG2 THR 82 2HG2 THR 82 -5.463 -6.643 1.313
583 3HG2 THR 82 3HG2 THR 82 -3.724 -6.332 1.095
584 H CYS 83 H CYS 83 -3.844 -2.306 0.329
585 HA CYS 83 HA CYS 83 -4.776 0.288 1.047
586 1HB CYS 83 1HB CYS 83 -3.391 -0.394 -1.534
587 2HB CYS 83 2HB CYS 83 -3.368 1.111 -0.637
588 H ILE 84 H ILE 84 -6.212 -2.356 -0.436
589 HA ILE 84 HA ILE 84 -7.812 -0.648 -2.209
590 HB ILE 84 HB ILE 84 -6.911 -3.494 -2.386
591 1HG1 ILE 84 1HG1 ILE 84 -5.723 -1.566 -3.514
592 2HG1 ILE 84 2HG1 ILE 84 -6.191 -2.900 -4.550
593 1HG2 ILE 84 1HG2 ILE 84 -9.509 -2.376 -3.395
594 2HG2 ILE 84 2HG2 ILE 84 -8.640 -3.614 -4.334
595 3HG2 ILE 84 3HG2 ILE 84 -9.155 -3.961 -2.666
596 1HD1 ILE 84 1HD1 ILE 84 -8.029 -0.509 -4.194
597 2HD1 ILE 84 2HD1 ILE 84 -6.694 -0.477 -5.371
598 3HD1 ILE 84 3HD1 ILE 84 -7.988 -1.691 -5.524
599 H SER 85 H SER 85 -7.853 -3.279 0.257
600 HA SER 85 HA SER 85 -10.544 -3.645 0.380
601 1HB SER 85 1HB SER 85 -8.420 -4.668 1.706
602 2HB SER 85 2HB SER 85 -9.015 -3.605 2.966
603 HG SER 85 HG SER 85 -10.077 -5.558 3.268
604 H CYS 86 H CYS 86 -8.548 -1.471 2.523
605 HA CYS 86 HA CYS 86 -10.735 -0.280 3.749
606 1HB CYS 86 1HB CYS 86 -8.304 -0.253 4.503
607 2HB CYS 86 2HB CYS 86 -8.031 1.023 3.333
608 H HIS 87 H HIS 87 -8.571 0.904 1.065
609 HA HIS 87 HA HIS 87 -9.837 3.232 0.508
610 1HB HIS 87 1HB HIS 87 -8.325 1.252 -1.164
611 2HB HIS 87 2HB HIS 87 -9.090 2.620 -1.948
612 HD1 HIS 87 HD1 HIS 87 -6.811 3.705 -2.560
613 HD2 HIS 87 HD2 HIS 87 -7.402 3.171 1.558
614 HE1 HIS 87 HE1 HIS 87 -4.981 5.049 -1.395
615 H LYS 88 H LYS 88 -10.820 -0.100 -0.353
616 HA LYS 88 HA LYS 88 -12.803 0.603 -2.193
617 1HB LYS 88 1HB LYS 88 -12.045 -1.800 -0.615
618 2HB LYS 88 2HB LYS 88 -13.700 -1.744 -1.190
619 1HG LYS 88 1HG LYS 88 -12.899 -1.327 -3.512
620 2HG LYS 88 2HG LYS 88 -11.238 -1.324 -2.952
621 1HD LYS 88 1HD LYS 88 -11.135 -3.590 -3.022
622 2HD LYS 88 2HD LYS 88 -12.560 -3.741 -2.013
623 1HE LYS 88 1HE LYS 88 -12.776 -3.077 -4.978
624 2HE LYS 88 2HE LYS 88 -12.676 -4.734 -4.417
625 1HZ LYS 88 1HZ LYS 88 -14.561 -3.516 -2.850
626 2HZ LYS 88 2HZ LYS 88 -14.878 -3.004 -4.368
627 3HZ LYS 88 3HZ LYS 88 -14.826 -4.603 -4.039
628 H ASP 89 H ASP 89 -12.883 0.088 1.387
629 HA ASP 89 HA ASP 89 -15.581 0.366 1.698
630 1HB ASP 89 1HB ASP 89 -13.549 -0.113 3.380
631 2HB ASP 89 2HB ASP 89 -13.681 1.606 3.697
632 H LYS 90 H LYS 90 -12.929 2.794 1.436
633 HA LYS 90 HA LYS 90 -14.436 5.037 2.170
634 1HB LYS 90 1HB LYS 90 -11.811 4.481 0.917
635 2HB LYS 90 2HB LYS 90 -12.506 6.041 0.528
636 1HG LYS 90 1HG LYS 90 -12.028 4.926 3.331
637 2HG LYS 90 2HG LYS 90 -11.130 6.220 2.564
638 1HD LYS 90 1HD LYS 90 -13.643 7.245 2.319
639 2HD LYS 90 2HD LYS 90 -13.888 6.261 3.748
640 1HE LYS 90 1HE LYS 90 -11.942 7.373 4.856
641 2HE LYS 90 2HE LYS 90 -11.675 8.345 3.422
642 1HZ LYS 90 1HZ LYS 90 -14.253 8.354 4.807
643 2HZ LYS 90 2HZ LYS 90 -13.038 9.350 5.253
644 3HZ LYS 90 3HZ LYS 90 -13.671 9.455 3.751
645 H ALA 91 H ALA 91 -13.917 3.333 -0.950
646 HA ALA 91 HA ALA 91 -15.649 5.286 -2.256
647 1HB ALA 91 1HB ALA 91 -14.532 3.001 -3.785
648 2HB ALA 91 3HB ALA 91 -14.546 4.739 -4.169
649 3HB ALA 91 2HB ALA 91 -13.323 4.084 -3.054
650 H GLY 92 H GLY 92 -16.523 3.257 -0.155
651 1HA GLY 92 2HA GLY 92 -17.988 1.508 0.068
652 2HA GLY 92 1HA GLY 92 -18.076 1.331 -1.673
653 H ASP 93 H ASP 93 -19.010 3.538 -2.781
654 HA ASP 93 HA ASP 93 -21.627 3.589 -2.342
655 1HB ASP 93 1HB ASP 93 -21.846 5.903 -1.122
656 2HB ASP 93 2HB ASP 93 -21.626 4.456 -0.159
657 H ASP 94 H ASP 94 -18.945 6.062 -2.430
658 HA ASP 94 HA ASP 94 -20.256 7.495 -4.504
659 1HB ASP 94 1HB ASP 94 -18.853 8.628 -2.795
660 2HB ASP 94 2HB ASP 94 -17.450 7.717 -3.317
661 H LYS 95 H LYS 95 -19.998 7.065 -6.706
662 HA LYS 95 HA LYS 95 -18.280 4.943 -7.508
663 1HB LYS 95 1HB LYS 95 -20.099 6.839 -9.010
664 2HB LYS 95 2HB LYS 95 -19.147 5.603 -9.807
665 1HG LYS 95 1HG LYS 95 -20.215 3.883 -8.253
666 2HG LYS 95 2HG LYS 95 -21.263 5.153 -7.651
667 1HD LYS 95 1HD LYS 95 -21.066 4.424 -10.609
668 2HD LYS 95 2HD LYS 95 -22.244 3.709 -9.526
669 1HE LYS 95 1HE LYS 95 -21.978 6.729 -9.853
670 2HE LYS 95 2HE LYS 95 -23.011 5.770 -10.895
671 1HZ LYS 95 1HZ LYS 95 -23.240 5.546 -7.993
672 2HZ LYS 95 2HZ LYS 95 -23.989 6.758 -8.791
673 3HZ LYS 95 3HZ LYS 95 -24.356 5.204 -9.135
674 H GLU 96 H GLU 96 -18.240 8.529 -7.682
675 HA GLU 96 HA GLU 96 -16.030 8.653 -9.381
676 1HB GLU 96 1HB GLU 96 -17.643 10.526 -8.960
677 2HB GLU 96 2HB GLU 96 -17.005 10.699 -7.337
678 1HG GLU 96 2HG GLU 96 -15.754 12.311 -8.488
679 2HG GLU 96 1HG GLU 96 -14.666 10.939 -8.542
680 H LEU 97 H LEU 97 -16.416 8.086 -5.919
681 HA LEU 97 HA LEU 97 -13.732 8.801 -5.251
682 1HB LEU 97 1HB LEU 97 -15.845 8.798 -3.781
683 2HB LEU 97 2HB LEU 97 -15.580 7.072 -3.627
684 HG LEU 97 HG LEU 97 -14.650 8.153 -1.711
685 1HD1 LEU 97 1HD1 LEU 97 -13.352 6.291 -3.012
686 2HD1 LEU 97 2HD1 LEU 97 -12.171 7.591 -3.302
687 3HD1 LEU 97 3HD1 LEU 97 -12.591 7.125 -1.636
688 1HD2 LEU 97 1HD2 LEU 97 -14.190 10.309 -3.353
689 2HD2 LEU 97 2HD2 LEU 97 -13.619 10.135 -1.676
690 3HD2 LEU 97 3HD2 LEU 97 -12.545 9.709 -3.030
691 H LYS 98 H LYS 98 -15.319 6.081 -6.727
692 HA LYS 98 HA LYS 98 -13.251 4.227 -5.922
693 1HB LYS 98 1HB LYS 98 -15.690 3.616 -6.130
694 2HB LYS 98 2HB LYS 98 -15.539 3.812 -7.864
695 1HG LYS 98 1HG LYS 98 -13.383 2.194 -7.410
696 2HG LYS 98 2HG LYS 98 -14.410 1.679 -6.087
697 1HD LYS 98 1HD LYS 98 -15.354 1.832 -8.987
698 2HD LYS 98 2HD LYS 98 -14.719 0.372 -8.254
699 1HE LYS 98 1HE LYS 98 -17.008 1.868 -6.931
700 2HE LYS 98 2HE LYS 98 -17.326 0.778 -8.266
701 1HZ LYS 98 1HZ LYS 98 -15.678 -0.628 -6.655
702 2HZ LYS 98 2HZ LYS 98 -16.630 0.165 -5.592
703 3HZ LYS 98 3HZ LYS 98 -17.301 -0.792 -6.732
704 H LYS 99 H LYS 99 -12.698 6.772 -7.511
705 HA LYS 99 HA LYS 99 -11.195 5.413 -9.609
706 1HB LYS 99 1HB LYS 99 -13.278 7.522 -10.003
707 2HB LYS 99 2HB LYS 99 -11.830 7.610 -10.985
708 1HG LYS 99 1HG LYS 99 -12.856 4.857 -10.829
709 2HG LYS 99 2HG LYS 99 -14.072 5.960 -11.443
710 1HD LYS 99 1HD LYS 99 -13.013 6.121 -13.444
711 2HD LYS 99 2HD LYS 99 -11.512 6.589 -12.670
712 1HE LYS 99 1HE LYS 99 -12.156 3.707 -12.349
713 2HE LYS 99 2HE LYS 99 -11.943 4.192 -14.020
714 1HZ LYS 99 1HZ LYS 99 -9.952 5.382 -12.481
715 2HZ LYS 99 2HZ LYS 99 -9.985 3.789 -12.121
716 3HZ LYS 99 3HZ LYS 99 -9.788 4.272 -13.668
717 H LYS 100 H LYS 100 -10.116 6.009 -7.177
718 HA LYS 100 HA LYS 100 -8.095 7.841 -7.901
719 1HB LYS 100 1HB LYS 100 -8.647 9.311 -5.768
720 2HB LYS 100 2HB LYS 100 -9.287 9.703 -7.351
721 1HG LYS 100 1HG LYS 100 -11.381 8.407 -6.789
722 2HG LYS 100 2HG LYS 100 -10.742 8.115 -5.184
723 1HD LYS 100 2HD LYS 100 -12.185 10.023 -4.972
724 2HD LYS 100 1HD LYS 100 -10.551 10.653 -4.896
725 1HE LYS 100 1HE LYS 100 -10.656 11.254 -7.316
726 2HE LYS 100 2HE LYS 100 -12.275 10.592 -7.420
727 1HZ LYS 100 1HZ LYS 100 -11.546 12.752 -5.570
728 2HZ LYS 100 2HZ LYS 100 -12.163 13.012 -7.060
729 3HZ LYS 100 3HZ LYS 100 -13.050 12.230 -5.933
730 H LEU 101 H LEU 101 -9.867 6.160 -5.241
731 HA LEU 101 HA LEU 101 -7.328 5.652 -3.923
732 1HB LEU 101 1HB LEU 101 -10.108 4.856 -3.061
733 2HB LEU 101 2HB LEU 101 -8.649 4.853 -2.091
734 HG LEU 101 HG LEU 101 -10.260 7.210 -3.058
735 1HD1 LEU 101 1HD1 LEU 101 -10.862 6.077 -0.925
736 2HD1 LEU 101 2HD1 LEU 101 -9.248 6.487 -0.296
737 3HD1 LEU 101 3HD1 LEU 101 -10.391 7.782 -0.728
738 1HD2 LEU 101 1HD2 LEU 101 -7.417 7.260 -2.017
739 2HD2 LEU 101 2HD2 LEU 101 -8.005 7.823 -3.601
740 3HD2 LEU 101 3HD2 LEU 101 -8.483 8.682 -2.117
741 H THR 102 H THR 102 -9.839 4.070 -5.887
742 HA THR 102 HA THR 102 -8.191 1.628 -5.813
743 HB THR 102 HB THR 102 -10.243 0.332 -5.850
744 HG1 THR 102 HG1 THR 102 -11.459 1.686 -7.286
745 1HG2 THR 102 1HG2 THR 102 -9.689 1.667 -3.619
746 2HG2 THR 102 2HG2 THR 102 -11.103 2.645 -4.080
747 3HG2 THR 102 3HG2 THR 102 -11.284 0.897 -3.796
748 H GLY 103 H GLY 103 -8.467 4.219 -7.581
749 1HA GLY 103 2HA GLY 103 -8.473 4.722 -9.780
750 2HA GLY 103 1HA GLY 103 -9.431 3.288 -10.091
751 H CYS 104 H CYS 104 -8.469 1.809 -11.405
752 HA CYS 104 HA CYS 104 -5.940 0.781 -10.903
753 1HB CYS 104 1HB CYS 104 -8.021 0.486 -12.952
754 2HB CYS 104 2HB CYS 104 -6.399 0.220 -13.560
755 H LYS 105 H LYS 105 -7.150 3.091 -13.443
756 HA LYS 105 HA LYS 105 -4.385 4.057 -13.673
757 1HB LYS 105 2HB LYS 105 -4.745 4.427 -16.042
758 2HB LYS 105 1HB LYS 105 -5.014 2.741 -15.648
759 1HG LYS 105 1HG LYS 105 -7.413 2.986 -15.759
760 2HG LYS 105 2HG LYS 105 -7.313 4.736 -15.740
761 1HD LYS 105 1HD LYS 105 -7.360 4.683 -18.007
762 2HD LYS 105 2HD LYS 105 -5.745 4.004 -17.963
763 1HE LYS 105 1HE LYS 105 -8.274 2.303 -17.759
764 2HE LYS 105 2HE LYS 105 -7.469 2.643 -19.279
765 1HZ LYS 105 1HZ LYS 105 -5.638 1.745 -17.330
766 2HZ LYS 105 2HZ LYS 105 -6.844 0.662 -17.534
767 3HZ LYS 105 3HZ LYS 105 -5.947 1.137 -18.814
768 H GLY 106 H GLY 106 -4.083 6.276 -13.596
769 1HA GLY 106 2HA GLY 106 -6.245 8.114 -13.932
770 2HA GLY 106 1HA GLY 106 -4.611 8.466 -13.407
771 H SER 107 H SER 107 -4.450 6.694 -11.131
772 HA SER 107 HA SER 107 -6.533 7.848 -9.447
773 1HB SER 107 1HB SER 107 -6.194 5.936 -7.931
774 2HB SER 107 2HB SER 107 -6.591 5.377 -9.543
775 HG SER 107 HG SER 107 -4.838 4.141 -8.788
776 H ALA 108 H ALA 108 -5.611 7.863 -6.971
777 HA ALA 108 HA ALA 108 -3.478 9.734 -7.033
778 1HB ALA 108 1HB ALA 108 -3.775 9.255 -4.424
779 2HB ALA 108 3HB ALA 108 -5.268 8.464 -4.985
780 3HB ALA 108 2HB ALA 108 -4.984 10.185 -5.340
781 H CYS 109 H CYS 109 -3.545 6.369 -7.315
782 HA CYS 109 HA CYS 109 -1.025 6.062 -5.878
783 1HB CYS 109 1HB CYS 109 -2.987 4.011 -6.947
784 2HB CYS 109 2HB CYS 109 -1.421 3.599 -6.277
785 H HIS 110 H HIS 110 -2.681 5.528 -9.059
786 HA HIS 110 HA HIS 110 -0.015 5.482 -10.276
787 1HB HIS 110 1HB HIS 110 -2.542 4.081 -11.195
788 2HB HIS 110 2HB HIS 110 -1.033 4.122 -12.086
789 HD1 HIS 110 HD1 HIS 110 1.088 3.371 -10.131
790 HD2 HIS 110 HD2 HIS 110 -2.730 1.635 -10.022
791 HE1 HIS 110 HE1 HIS 110 1.345 1.153 -8.896
792 HA PRO 111 HA PRO 111 -2.058 9.173 -11.951
793 1HB PRO 111 1HB PRO 111 -0.239 11.023 -11.208
794 2HB PRO 111 2HB PRO 111 -1.337 10.285 -9.997
795 1HG PRO 111 1HG PRO 111 1.300 9.614 -10.905
796 2HG PRO 111 2HG PRO 111 1.176 9.601 -9.115
797 1HD PRO 111 1HD PRO 111 1.195 7.280 -10.501
798 2HD PRO 111 2HD PRO 111 0.036 7.489 -9.153
799 H SER 112 H SER 112 -1.374 7.715 -13.945
800 HA SER 112 HA SER 112 0.657 9.248 -15.310
801 1HB SER 112 1HB SER 112 0.897 6.392 -14.546
802 2HB SER 112 2HB SER 112 1.195 6.691 -16.247
803 HG SER 112 HG SER 112 3.146 7.309 -15.635
No H/Q in entry = 803
Start of MODEL 6
1 H1 VAL 1 H1 VAL 1 8.105 8.303 16.964
2 H2 VAL 1 H2 VAL 1 9.200 7.326 17.731
3 H3 VAL 1 H3 VAL 1 9.101 8.930 18.129
4 HA VAL 1 HA VAL 1 10.928 8.898 16.869
5 HB VAL 1 HB VAL 1 11.313 6.928 15.918
6 1HG1 VAL 1 1HG1 VAL 1 8.324 6.623 15.481
7 2HG1 VAL 1 2HG1 VAL 1 9.538 5.371 15.129
8 3HG1 VAL 1 3HG1 VAL 1 9.292 5.927 16.802
9 1HG2 VAL 1 1HG2 VAL 1 11.310 8.398 13.948
10 2HG2 VAL 1 2HG2 VAL 1 10.813 6.742 13.524
11 3HG2 VAL 1 3HG2 VAL 1 9.592 8.028 13.670
12 H ASP 2 H ASP 2 7.631 9.566 16.310
13 HA ASP 2 HA ASP 2 6.705 11.352 15.452
14 1HB ASP 2 1HB ASP 2 9.089 12.411 15.735
15 2HB ASP 2 2HB ASP 2 9.271 12.128 14.015
16 H VAL 3 H VAL 3 5.292 10.812 13.783
17 HA VAL 3 HA VAL 3 5.912 9.066 11.741
18 HB VAL 3 HB VAL 3 3.674 10.097 12.751
19 1HG1 VAL 3 1HG1 VAL 3 4.167 12.317 11.623
20 2HG1 VAL 3 2HG1 VAL 3 3.833 11.507 10.074
21 3HG1 VAL 3 3HG1 VAL 3 2.557 11.626 11.309
22 1HG2 VAL 3 1HG2 VAL 3 4.053 8.943 9.971
23 2HG2 VAL 3 2HG2 VAL 3 3.714 8.062 11.480
24 3HG2 VAL 3 3HG2 VAL 3 2.472 9.121 10.769
25 HA PRO 4 HA PRO 4 8.758 11.248 9.190
26 1HB PRO 4 2HB PRO 4 7.316 9.557 7.121
27 2HB PRO 4 1HB PRO 4 9.069 9.795 7.419
28 1HG PRO 4 1HG PRO 4 7.933 7.573 8.353
29 2HG PRO 4 2HG PRO 4 9.254 8.397 9.243
30 1HD PRO 4 2HD PRO 4 6.287 8.286 9.795
31 2HD PRO 4 1HD PRO 4 7.645 8.522 10.937
32 H ALA 5 H ALA 5 8.620 12.705 7.196
33 HA ALA 5 HA ALA 5 6.098 14.119 7.299
34 1HB ALA 5 1HB ALA 5 7.311 15.928 6.580
35 2HB ALA 5 3HB ALA 5 8.326 14.953 5.491
36 3HB ALA 5 2HB ALA 5 8.658 14.970 7.240
37 H ASP 6 H ASP 6 4.839 14.630 5.386
38 HA ASP 6 HA ASP 6 4.316 12.464 3.828
39 1HB ASP 6 2HB ASP 6 2.791 13.852 2.693
40 2HB ASP 6 1HB ASP 6 2.989 14.685 4.222
41 H GLY 7 H GLY 7 4.221 13.353 1.108
42 1HA GLY 7 2HA GLY 7 6.688 14.413 0.190
43 2HA GLY 7 1HA GLY 7 5.446 13.627 -0.764
44 H ALA 8 H ALA 8 5.452 11.122 0.888
45 HA ALA 8 HA ALA 8 8.149 10.117 0.531
46 1HB ALA 8 1HB ALA 8 6.609 9.679 2.549
47 2HB ALA 8 3HB ALA 8 5.700 8.594 1.470
48 3HB ALA 8 2HB ALA 8 7.413 8.266 1.824
49 H LYS 9 H LYS 9 8.799 8.730 -1.091
50 HA LYS 9 HA LYS 9 6.721 8.067 -3.060
51 1HB LYS 9 1HB LYS 9 9.644 8.764 -3.440
52 2HB LYS 9 2HB LYS 9 8.652 8.055 -4.698
53 1HG LYS 9 1HG LYS 9 7.249 9.957 -4.859
54 2HG LYS 9 2HG LYS 9 7.653 10.520 -3.249
55 1HD LYS 9 1HD LYS 9 10.075 10.842 -4.151
56 2HD LYS 9 2HD LYS 9 9.387 10.635 -5.749
57 1HE LYS 9 2HE LYS 9 9.418 13.009 -5.331
58 2HE LYS 9 1HE LYS 9 7.743 12.512 -5.201
59 1HZ LYS 9 1HZ LYS 9 8.840 12.203 -2.705
60 2HZ LYS 9 2HZ LYS 9 9.373 13.651 -3.239
61 3HZ LYS 9 3HZ LYS 9 7.771 13.342 -3.180
62 H ILE 10 H ILE 10 6.439 5.942 -3.626
63 HA ILE 10 HA ILE 10 8.276 4.057 -2.322
64 HB ILE 10 HB ILE 10 5.367 3.674 -3.041
65 1HG1 ILE 10 1HG1 ILE 10 6.382 3.845 -0.223
66 2HG1 ILE 10 2HG1 ILE 10 6.096 5.328 -1.113
67 1HG2 ILE 10 1HG2 ILE 10 6.935 1.653 -3.022
68 2HG2 ILE 10 2HG2 ILE 10 7.056 1.914 -1.266
69 3HG2 ILE 10 3HG2 ILE 10 5.474 1.572 -2.008
70 1HD1 ILE 10 1HD1 ILE 10 4.012 3.113 -0.938
71 2HD1 ILE 10 2HD1 ILE 10 4.111 4.440 0.244
72 3HD1 ILE 10 3HD1 ILE 10 3.773 4.795 -1.468
73 H ASP 11 H ASP 11 9.515 2.816 -3.625
74 HA ASP 11 HA ASP 11 8.483 2.011 -6.154
75 1HB ASP 11 1HB ASP 11 9.375 4.098 -6.925
76 2HB ASP 11 2HB ASP 11 10.785 3.975 -5.892
77 H PHE 12 H PHE 12 8.847 -0.146 -5.351
78 HA PHE 12 HA PHE 12 11.654 -0.776 -4.762
79 1HB PHE 12 1HB PHE 12 9.010 -2.139 -3.966
80 2HB PHE 12 2HB PHE 12 10.596 -2.696 -3.470
81 HD1 PHE 12 HD1 PHE 12 11.900 -0.127 -2.760
82 HD2 PHE 12 HD2 PHE 12 7.975 -1.534 -1.971
83 HE1 PHE 12 HE1 PHE 12 11.782 1.343 -0.729
84 HE2 PHE 12 HE2 PHE 12 7.856 -0.064 0.060
85 HZ PHE 12 HZ PHE 12 9.761 1.357 0.657
86 H ILE 13 H ILE 13 8.775 -1.463 -6.707
87 HA ILE 13 HA ILE 13 10.067 -3.811 -7.852
88 HB ILE 13 HB ILE 13 7.293 -2.653 -8.098
89 1HG1 ILE 13 1HG1 ILE 13 8.139 -5.327 -6.966
90 2HG1 ILE 13 2HG1 ILE 13 8.026 -3.883 -5.979
91 1HG2 ILE 13 1HG2 ILE 13 8.480 -5.070 -9.489
92 2HG2 ILE 13 2HG2 ILE 13 6.749 -4.660 -9.434
93 3HG2 ILE 13 3HG2 ILE 13 7.896 -3.572 -10.253
94 1HD1 ILE 13 1HD1 ILE 13 5.655 -4.345 -7.710
95 2HD1 ILE 13 2HD1 ILE 13 5.928 -5.599 -6.477
96 3HD1 ILE 13 3HD1 ILE 13 5.738 -3.897 -5.990
97 H ALA 14 H ALA 14 11.674 -3.206 -9.245
98 HA ALA 14 HA ALA 14 11.547 -0.839 -10.771
99 1HB ALA 14 1HB ALA 14 13.696 -1.671 -10.272
100 2HB ALA 14 2HB ALA 14 13.485 -2.063 -11.995
101 3HB ALA 14 3HB ALA 14 13.270 -3.328 -10.762
102 H GLY 15 H GLY 15 11.952 -1.118 -13.329
103 1HA GLY 15 2HA GLY 15 9.796 -1.373 -14.724
104 2HA GLY 15 1HA GLY 15 10.037 -3.079 -14.401
105 H GLY 16 H GLY 16 10.043 -2.085 -17.042
106 1HA GLY 16 2HA GLY 16 11.424 -2.918 -18.771
107 2HA GLY 16 1HA GLY 16 12.844 -2.609 -17.790
108 H GLU 17 H GLU 17 9.987 -0.777 -19.113
109 HA GLU 17 HA GLU 17 11.771 1.023 -20.402
110 1HB GLU 17 1HB GLU 17 8.743 0.853 -20.179
111 2HB GLU 17 2HB GLU 17 9.533 2.178 -21.010
112 1HG GLU 17 1HG GLU 17 10.472 0.744 -22.674
113 2HG GLU 17 2HG GLU 17 10.241 -0.694 -21.699
114 H LYS 18 H LYS 18 9.815 0.926 -17.431
115 HA LYS 18 HA LYS 18 11.224 3.161 -16.392
116 1HB LYS 18 1HB LYS 18 9.400 4.709 -16.125
117 2HB LYS 18 2HB LYS 18 9.597 4.348 -17.828
118 1HG LYS 18 1HG LYS 18 7.584 3.208 -17.970
119 2HG LYS 18 2HG LYS 18 7.707 2.562 -16.346
120 1HD LYS 18 2HD LYS 18 6.006 4.105 -16.003
121 2HD LYS 18 1HD LYS 18 7.385 5.123 -15.639
122 1HE LYS 18 1HE LYS 18 7.312 6.200 -17.774
123 2HE LYS 18 2HE LYS 18 6.323 4.937 -18.480
124 1HZ LYS 18 1HZ LYS 18 4.635 5.651 -16.738
125 2HZ LYS 18 2HZ LYS 18 5.519 7.017 -16.599
126 3HZ LYS 18 3HZ LYS 18 4.849 6.621 -18.034
127 H ASN 19 H ASN 19 9.156 3.783 -14.391
128 HA ASN 19 HA ASN 19 8.491 1.253 -13.247
129 1HB ASN 19 1HB ASN 19 9.690 2.228 -11.016
130 2HB ASN 19 2HB ASN 19 10.535 1.178 -12.136
131 2HD2 ASN 19 2HD2 ASN 19 9.626 4.622 -11.940
132 1HD2 ASN 19 1HD2 ASN 19 11.177 5.281 -12.341
133 H LEU 20 H LEU 20 6.586 1.549 -12.027
134 HA LEU 20 HA LEU 20 5.487 4.180 -11.937
135 1HB LEU 20 1HB LEU 20 4.530 1.486 -10.975
136 2HB LEU 20 2HB LEU 20 3.603 2.960 -10.775
137 HG LEU 20 HG LEU 20 4.412 1.649 -13.382
138 1HD1 LEU 20 1HD1 LEU 20 2.361 0.954 -11.801
139 2HD1 LEU 20 2HD1 LEU 20 1.585 2.272 -12.712
140 3HD1 LEU 20 3HD1 LEU 20 2.289 0.885 -13.579
141 1HD2 LEU 20 1HD2 LEU 20 3.278 4.381 -12.838
142 2HD2 LEU 20 2HD2 LEU 20 4.588 3.894 -13.940
143 3HD2 LEU 20 3HD2 LEU 20 2.896 3.517 -14.347
144 H THR 21 H THR 21 5.357 5.602 -10.239
145 HA THR 21 HA THR 21 6.509 4.662 -7.694
146 HB THR 21 HB THR 21 6.740 7.524 -8.666
147 HG1 THR 21 HG1 THR 21 8.722 6.713 -9.758
148 1HG2 THR 21 1HG2 THR 21 8.115 5.670 -6.745
149 2HG2 THR 21 2HG2 THR 21 9.173 6.766 -7.667
150 3HG2 THR 21 3HG2 THR 21 7.879 7.431 -6.641
151 H VAL 22 H VAL 22 5.073 4.604 -6.095
152 HA VAL 22 HA VAL 22 2.720 6.319 -6.363
153 HB VAL 22 HB VAL 22 3.305 3.850 -4.723
154 1HG1 VAL 22 1HG1 VAL 22 1.536 5.915 -4.051
155 2HG1 VAL 22 2HG1 VAL 22 0.514 4.659 -4.789
156 3HG1 VAL 22 3HG1 VAL 22 1.551 4.259 -3.399
157 1HG2 VAL 22 1HG2 VAL 22 2.140 4.336 -7.358
158 2HG2 VAL 22 2HG2 VAL 22 2.691 2.817 -6.612
159 3HG2 VAL 22 3HG2 VAL 22 1.048 3.422 -6.290
160 H VAL 23 H VAL 23 2.234 7.916 -4.876
161 HA VAL 23 HA VAL 23 4.363 8.456 -2.944
162 HB VAL 23 HB VAL 23 2.185 10.203 -4.108
163 1HG1 VAL 23 1HG1 VAL 23 4.207 10.658 -1.942
164 2HG1 VAL 23 2HG1 VAL 23 3.810 12.000 -3.042
165 3HG1 VAL 23 3HG1 VAL 23 2.527 11.230 -2.078
166 1HG2 VAL 23 1HG2 VAL 23 4.001 9.545 -5.688
167 2HG2 VAL 23 2HG2 VAL 23 3.946 11.293 -5.356
168 3HG2 VAL 23 3HG2 VAL 23 5.184 10.278 -4.578
169 H PHE 24 H PHE 24 3.989 8.476 -0.747
170 HA PHE 24 HA PHE 24 1.209 8.010 0.067
171 1HB PHE 24 1HB PHE 24 2.796 5.972 0.087
172 2HB PHE 24 2HB PHE 24 3.808 6.838 1.225
173 HD1 PHE 24 HD1 PHE 24 0.461 5.333 0.772
174 HD2 PHE 24 HD2 PHE 24 3.288 6.878 3.534
175 HE1 PHE 24 HE1 PHE 24 -0.902 4.426 2.674
176 HE2 PHE 24 HE2 PHE 24 1.925 5.970 5.436
177 HZ PHE 24 HZ PHE 24 -0.153 4.755 4.984
178 H ASN 25 H ASN 25 0.567 8.946 2.070
179 HA ASN 25 HA ASN 25 2.577 10.719 3.214
180 1HB ASN 25 1HB ASN 25 -0.113 11.760 3.607
181 2HB ASN 25 2HB ASN 25 1.245 12.534 2.815
182 2HD2 ASN 25 2HD2 ASN 25 1.758 11.711 0.587
183 1HD2 ASN 25 1HD2 ASN 25 0.435 11.417 -0.492
184 H HIS 26 H HIS 26 2.783 10.390 5.444
185 HA HIS 26 HA HIS 26 1.093 8.468 6.683
186 1HB HIS 26 1HB HIS 26 3.574 9.953 7.340
187 2HB HIS 26 2HB HIS 26 2.586 9.491 8.712
188 HD1 HIS 26 HD1 HIS 26 4.668 8.032 5.926
189 HD2 HIS 26 HD2 HIS 26 2.476 6.720 9.253
190 HE1 HIS 26 HE1 HIS 26 5.292 5.583 6.273
191 H SER 27 H SER 27 1.046 11.918 6.239
192 HA SER 27 HA SER 27 -0.547 12.342 8.590
193 1HB SER 27 1HB SER 27 -0.630 14.726 7.702
194 2HB SER 27 2HB SER 27 0.975 14.120 8.058
195 HG SER 27 HG SER 27 -0.011 13.734 5.411
196 H THR 28 H THR 28 -1.313 10.622 6.083
197 HA THR 28 HA THR 28 -3.825 12.031 5.464
198 HB THR 28 HB THR 28 -2.208 9.951 3.898
199 HG1 THR 28 HG1 THR 28 -2.970 12.757 3.483
200 1HG2 THR 28 1HG2 THR 28 -4.993 10.948 3.635
201 2HG2 THR 28 2HG2 THR 28 -4.005 11.221 2.180
202 3HG2 THR 28 3HG2 THR 28 -4.207 9.574 2.822
203 H HIS 29 H HIS 29 -2.310 9.012 6.612
204 HA HIS 29 HA HIS 29 -4.999 7.950 7.032
205 1HB HIS 29 1HB HIS 29 -2.325 6.527 7.126
206 2HB HIS 29 2HB HIS 29 -3.899 5.777 7.304
207 HD1 HIS 29 HD1 HIS 29 -1.695 7.448 4.707
208 HD2 HIS 29 HD2 HIS 29 -5.252 5.235 4.920
209 HE1 HIS 29 HE1 HIS 29 -2.305 6.842 2.305
210 H LYS 30 H LYS 30 -3.609 10.137 8.613
211 HA LYS 30 HA LYS 30 -2.633 9.154 11.008
212 1HB LYS 30 1HB LYS 30 -2.986 11.363 11.861
213 2HB LYS 30 2HB LYS 30 -2.474 11.499 10.191
214 1HG LYS 30 1HG LYS 30 -4.713 11.983 9.432
215 2HG LYS 30 2HG LYS 30 -5.423 11.469 10.949
216 1HD LYS 30 1HD LYS 30 -3.471 13.553 11.484
217 2HD LYS 30 2HD LYS 30 -4.551 14.100 10.217
218 1HE LYS 30 1HE LYS 30 -5.993 14.643 11.899
219 2HE LYS 30 2HE LYS 30 -6.332 12.927 12.000
220 1HZ LYS 30 1HZ LYS 30 -4.226 14.305 13.517
221 2HZ LYS 30 2HZ LYS 30 -5.678 13.858 14.116
222 3HZ LYS 30 3HZ LYS 30 -4.607 12.722 13.638
223 H ASP 31 H ASP 31 -5.834 9.036 9.654
224 HA ASP 31 HA ASP 31 -7.110 8.860 12.199
225 1HB ASP 31 1HB ASP 31 -8.539 9.744 10.557
226 2HB ASP 31 2HB ASP 31 -7.936 8.675 9.306
227 H VAL 32 H VAL 32 -5.092 6.851 10.432
228 HA VAL 32 HA VAL 32 -6.507 4.424 11.296
229 HB VAL 32 HB VAL 32 -4.413 4.629 9.134
230 1HG1 VAL 32 1HG1 VAL 32 -5.727 2.453 10.437
231 2HG1 VAL 32 2HG1 VAL 32 -6.302 2.518 8.754
232 3HG1 VAL 32 3HG1 VAL 32 -4.558 2.406 9.095
233 1HG2 VAL 32 1HG2 VAL 32 -7.305 5.294 9.048
234 2HG2 VAL 32 2HG2 VAL 32 -5.966 5.840 8.010
235 3HG2 VAL 32 3HG2 VAL 32 -6.705 4.244 7.742
236 H LYS 33 H LYS 33 -5.517 3.136 12.793
237 HA LYS 33 HA LYS 33 -3.407 4.096 14.279
238 1HB LYS 33 1HB LYS 33 -4.383 1.241 13.963
239 2HB LYS 33 2HB LYS 33 -3.335 1.814 15.245
240 1HG LYS 33 1HG LYS 33 -5.859 3.375 14.821
241 2HG LYS 33 2HG LYS 33 -6.059 1.750 15.446
242 1HD LYS 33 1HD LYS 33 -3.937 3.467 16.719
243 2HD LYS 33 2HD LYS 33 -5.608 3.868 17.062
244 1HE LYS 33 1HE LYS 33 -5.419 2.287 18.710
245 2HE LYS 33 2HE LYS 33 -5.687 1.142 17.411
246 1HZ LYS 33 1HZ LYS 33 -2.971 2.005 17.698
247 2HZ LYS 33 2HZ LYS 33 -3.544 1.151 18.966
248 3HZ LYS 33 3HZ LYS 33 -3.569 0.503 17.468
249 H CYS 34 H CYS 34 -1.196 3.153 14.563
250 HA CYS 34 HA CYS 34 0.101 3.125 12.049
251 1HB CYS 34 1HB CYS 34 1.351 2.385 14.690
252 2HB CYS 34 2HB CYS 34 2.131 3.040 13.264
253 H ASP 35 H ASP 35 -0.766 0.717 14.592
254 HA ASP 35 HA ASP 35 0.641 -1.395 13.467
255 1HB ASP 35 1HB ASP 35 -0.937 -2.816 14.846
256 2HB ASP 35 2HB ASP 35 -0.142 -1.543 15.751
257 H ASP 36 H ASP 36 -2.060 0.373 12.350
258 HA ASP 36 HA ASP 36 -3.690 -1.635 11.361
259 1HB ASP 36 1HB ASP 36 -3.951 1.013 11.534
260 2HB ASP 36 2HB ASP 36 -3.299 0.994 9.908
261 H CYS 37 H CYS 37 -0.533 -0.472 10.449
262 HA CYS 37 HA CYS 37 -0.728 -1.980 7.949
263 1HB CYS 37 1HB CYS 37 0.647 0.695 8.347
264 2HB CYS 37 2HB CYS 37 0.907 -0.338 6.956
265 H HIS 38 H HIS 38 1.392 -0.489 10.493
266 HA HIS 38 HA HIS 38 3.538 -2.264 9.889
267 1HB HIS 38 1HB HIS 38 3.098 -0.379 12.222
268 2HB HIS 38 2HB HIS 38 4.593 -1.226 11.878
269 HD1 HIS 38 HD1 HIS 38 5.736 -0.596 9.460
270 HD2 HIS 38 HD2 HIS 38 2.835 2.044 10.947
271 HE1 HIS 38 HE1 HIS 38 6.045 1.595 8.189
272 H HIS 39 H HIS 39 2.219 -4.287 10.022
273 HA HIS 39 HA HIS 39 1.355 -5.019 12.667
274 1HB HIS 39 1HB HIS 39 0.361 -6.890 11.667
275 2HB HIS 39 2HB HIS 39 0.140 -5.588 10.516
276 HD1 HIS 39 HD1 HIS 39 1.620 -8.958 10.883
277 HD2 HIS 39 HD2 HIS 39 1.901 -5.750 8.196
278 HE1 HIS 39 HE1 HIS 39 2.717 -9.886 8.775
279 H GLN 40 H GLN 40 3.725 -6.288 10.216
280 HA GLN 40 HA GLN 40 5.045 -7.643 12.413
281 1HB GLN 40 1HB GLN 40 4.529 -8.304 9.668
282 2HB GLN 40 2HB GLN 40 6.267 -8.188 9.852
283 1HG GLN 40 1HG GLN 40 5.267 -10.491 10.340
284 2HG GLN 40 2HG GLN 40 6.310 -9.846 11.593
285 2HE2 GLN 40 2HE2 GLN 40 3.016 -10.472 10.601
286 1HE2 GLN 40 1HE2 GLN 40 2.264 -10.368 12.158
287 HA PRO 41 HA PRO 41 8.053 -4.341 12.127
288 1HB PRO 41 1HB PRO 41 8.953 -4.465 14.653
289 2HB PRO 41 2HB PRO 41 7.260 -3.967 14.331
290 1HG PRO 41 2HG PRO 41 8.175 -6.851 15.187
291 2HG PRO 41 1HG PRO 41 6.877 -5.746 15.745
292 1HD PRO 41 1HD PRO 41 6.651 -7.788 13.760
293 2HD PRO 41 2HD PRO 41 5.495 -6.446 14.015
294 H GLY 42 H GLY 42 9.676 -5.110 10.702
295 1HA GLY 42 2HA GLY 42 11.628 -6.063 10.123
296 2HA GLY 42 1HA GLY 42 11.014 -7.515 10.891
297 H ASP 43 H ASP 43 12.187 -4.255 12.025
298 HA ASP 43 HA ASP 43 13.930 -5.735 13.835
299 1HB ASP 43 1HB ASP 43 14.613 -3.854 11.888
300 2HB ASP 43 2HB ASP 43 14.552 -2.875 13.340
301 H LYS 44 H LYS 44 11.712 -2.953 13.301
302 HA LYS 44 HA LYS 44 11.237 -2.863 16.172
303 1HB LYS 44 1HB LYS 44 12.080 -0.482 14.501
304 2HB LYS 44 2HB LYS 44 11.287 -0.334 16.056
305 1HG LYS 44 1HG LYS 44 13.103 -1.341 17.226
306 2HG LYS 44 2HG LYS 44 13.753 -2.080 15.777
307 1HD LYS 44 1HD LYS 44 15.021 -0.252 15.318
308 2HD LYS 44 2HD LYS 44 13.634 0.813 15.432
309 1HE LYS 44 1HE LYS 44 14.181 1.484 17.545
310 2HE LYS 44 2HE LYS 44 14.477 -0.157 18.083
311 1HZ LYS 44 1HZ LYS 44 16.354 1.443 16.483
312 2HZ LYS 44 2HZ LYS 44 16.471 1.184 18.091
313 3HZ LYS 44 3HZ LYS 44 16.629 -0.064 17.050
314 H GLN 45 H GLN 45 9.244 -1.309 16.558
315 HA GLN 45 HA GLN 45 7.075 -2.396 15.540
316 1HB GLN 45 1HB GLN 45 6.920 -0.768 17.313
317 2HB GLN 45 2HB GLN 45 7.540 0.514 16.292
318 1HG GLN 45 2HG GLN 45 5.180 0.875 16.355
319 2HG GLN 45 1HG GLN 45 5.478 0.150 14.787
320 2HE2 GLN 45 2HE2 GLN 45 2.998 0.049 15.717
321 1HE2 GLN 45 1HE2 GLN 45 2.543 -1.541 16.235
322 H TYR 46 H TYR 46 9.162 -0.082 13.944
323 HA TYR 46 HA TYR 46 7.416 -0.196 11.528
324 1HB TYR 46 1HB TYR 46 9.401 1.990 12.189
325 2HB TYR 46 2HB TYR 46 8.117 2.004 10.969
326 HD1 TYR 46 HD1 TYR 46 5.708 2.086 11.713
327 HD2 TYR 46 HD2 TYR 46 8.989 2.678 14.421
328 HE1 TYR 46 HE1 TYR 46 4.171 3.149 13.344
329 HE2 TYR 46 HE2 TYR 46 7.452 3.741 16.052
330 HH TYR 46 HH TYR 46 5.040 3.835 16.606
331 H ALA 47 H ALA 47 8.314 -1.275 9.793
332 HA ALA 47 HA ALA 47 11.177 -1.094 9.422
333 1HB ALA 47 1HB ALA 47 10.213 -3.214 10.902
334 2HB ALA 47 3HB ALA 47 10.216 -3.882 9.253
335 3HB ALA 47 2HB ALA 47 11.718 -3.230 9.951
336 H GLY 48 H GLY 48 11.584 -2.766 7.345
337 1HA GLY 48 2HA GLY 48 11.340 -2.707 5.092
338 2HA GLY 48 1HA GLY 48 10.025 -1.561 5.259
339 H CYS 49 H CYS 49 8.573 -2.577 3.821
340 HA CYS 49 HA CYS 49 7.176 -4.794 4.960
341 1HB CYS 49 1HB CYS 49 6.694 -3.471 2.288
342 2HB CYS 49 2HB CYS 49 5.582 -4.476 3.196
343 H THR 50 H THR 50 9.472 -4.098 2.302
344 HA THR 50 HA THR 50 9.241 -6.820 1.293
345 HB THR 50 HB THR 50 10.522 -5.954 -0.565
346 HG1 THR 50 HG1 THR 50 11.125 -3.986 1.502
347 1HG2 THR 50 1HG2 THR 50 8.165 -4.740 0.029
348 2HG2 THR 50 2HG2 THR 50 9.248 -3.341 0.223
349 3HG2 THR 50 3HG2 THR 50 9.180 -4.204 -1.332
350 H THR 51 H THR 51 10.293 -6.096 4.075
351 HA THR 51 HA THR 51 13.085 -6.558 4.015
352 HB THR 51 HB THR 51 11.080 -7.048 6.276
353 HG1 THR 51 HG1 THR 51 11.275 -4.753 6.531
354 1HG2 THR 51 1HG2 THR 51 13.560 -7.642 6.636
355 2HG2 THR 51 2HG2 THR 51 13.925 -5.926 6.331
356 3HG2 THR 51 3HG2 THR 51 12.920 -6.388 7.726
357 H ASP 52 H ASP 52 14.245 -8.448 4.816
358 HA ASP 52 HA ASP 52 13.618 -10.675 3.396
359 1HB ASP 52 1HB ASP 52 15.453 -9.964 5.614
360 2HB ASP 52 2HB ASP 52 15.048 -11.668 5.582
361 H GLY 53 H GLY 53 12.847 -12.851 4.137
362 1HA GLY 53 2HA GLY 53 11.864 -13.436 6.664
363 2HA GLY 53 1HA GLY 53 11.375 -14.201 5.165
364 H CYS 54 H CYS 54 10.561 -11.345 4.151
365 HA CYS 54 HA CYS 54 7.943 -11.431 5.444
366 1HB CYS 54 1HB CYS 54 9.334 -8.828 4.755
367 2HB CYS 54 2HB CYS 54 7.809 -9.037 5.593
368 H HIS 55 H HIS 55 7.642 -8.830 3.589
369 HA HIS 55 HA HIS 55 6.774 -10.378 1.316
370 1HB HIS 55 1HB HIS 55 6.496 -7.398 1.736
371 2HB HIS 55 2HB HIS 55 5.566 -8.425 0.663
372 HD1 HIS 55 HD1 HIS 55 3.937 -10.230 1.908
373 HD2 HIS 55 HD2 HIS 55 5.435 -7.099 4.264
374 HE1 HIS 55 HE1 HIS 55 2.466 -10.135 3.990
375 H ASN 56 H ASN 56 9.533 -10.532 1.525
376 HA ASN 56 HA ASN 56 10.677 -8.451 -0.051
377 1HB ASN 56 1HB ASN 56 11.994 -9.602 1.729
378 2HB ASN 56 2HB ASN 56 11.791 -11.139 0.912
379 2HD2 ASN 56 2HD2 ASN 56 14.197 -9.617 1.620
380 1HD2 ASN 56 1HD2 ASN 56 15.101 -9.385 0.161
381 H ILE 57 H ILE 57 8.973 -8.977 -1.854
382 HA ILE 57 HA ILE 57 10.158 -10.974 -3.636
383 HB ILE 57 HB ILE 57 7.204 -10.643 -3.097
384 1HG1 ILE 57 1HG1 ILE 57 8.749 -11.888 -1.398
385 2HG1 ILE 57 2HG1 ILE 57 7.222 -12.596 -1.886
386 1HG2 ILE 57 1HG2 ILE 57 8.744 -11.981 -5.259
387 2HG2 ILE 57 2HG2 ILE 57 7.358 -12.869 -4.580
388 3HG2 ILE 57 3HG2 ILE 57 7.122 -11.249 -5.279
389 1HD1 ILE 57 1HD1 ILE 57 9.524 -13.281 -3.650
390 2HD1 ILE 57 2HD1 ILE 57 9.623 -13.916 -1.990
391 3HD1 ILE 57 3HD1 ILE 57 8.226 -14.321 -3.017
392 H LEU 58 H LEU 58 11.007 -9.783 -5.259
393 HA LEU 58 HA LEU 58 9.508 -7.404 -6.082
394 1HB LEU 58 2HB LEU 58 12.386 -8.169 -6.596
395 2HB LEU 58 1HB LEU 58 11.607 -6.687 -7.112
396 HG LEU 58 HG LEU 58 12.206 -7.549 -4.273
397 1HD1 LEU 58 1HD1 LEU 58 14.123 -6.679 -5.510
398 2HD1 LEU 58 2HD1 LEU 58 13.204 -5.212 -5.925
399 3HD1 LEU 58 3HD1 LEU 58 13.620 -5.552 -4.228
400 1HD2 LEU 58 1HD2 LEU 58 10.243 -5.599 -5.298
401 2HD2 LEU 58 2HD2 LEU 58 10.335 -6.432 -3.728
402 3HD2 LEU 58 3HD2 LEU 58 11.330 -4.988 -4.028
403 H ASP 59 H ASP 59 8.822 -10.271 -6.715
404 HA ASP 59 HA ASP 59 9.235 -10.100 -9.596
405 1HB ASP 59 1HB ASP 59 9.649 -12.243 -7.761
406 2HB ASP 59 2HB ASP 59 8.206 -12.671 -8.660
407 H LYS 60 H LYS 60 7.312 -8.577 -9.582
408 HA LYS 60 HA LYS 60 4.877 -9.012 -8.515
409 1HB LYS 60 1HB LYS 60 5.815 -7.110 -10.034
410 2HB LYS 60 2HB LYS 60 5.129 -8.036 -11.353
411 1HG LYS 60 1HG LYS 60 3.062 -8.042 -9.469
412 2HG LYS 60 2HG LYS 60 3.763 -6.450 -9.259
413 1HD LYS 60 2HD LYS 60 2.456 -5.853 -11.036
414 2HD LYS 60 1HD LYS 60 3.696 -6.615 -12.012
415 1HE LYS 60 1HE LYS 60 2.395 -8.827 -11.712
416 2HE LYS 60 2HE LYS 60 1.095 -7.869 -11.030
417 1HZ LYS 60 1HZ LYS 60 1.820 -6.601 -13.339
418 2HZ LYS 60 2HZ LYS 60 1.809 -8.188 -13.724
419 3HZ LYS 60 3HZ LYS 60 0.473 -7.491 -13.093
420 H ALA 61 H ALA 61 2.857 -9.956 -9.293
421 HA ALA 61 HA ALA 61 1.644 -11.637 -10.064
422 1HB ALA 61 1HB ALA 61 2.224 -12.524 -12.359
423 2HB ALA 61 3HB ALA 61 2.089 -10.752 -12.266
424 3HB ALA 61 2HB ALA 61 3.694 -11.522 -12.309
425 H ASP 62 H ASP 62 3.097 -12.371 -7.954
426 HA ASP 62 HA ASP 62 4.422 -14.831 -8.773
427 1HB ASP 62 1HB ASP 62 5.668 -13.082 -7.359
428 2HB ASP 62 2HB ASP 62 4.547 -13.440 -6.061
429 H LYS 63 H LYS 63 4.202 -16.532 -6.735
430 HA LYS 63 HA LYS 63 1.384 -16.479 -5.905
431 1HB LYS 63 1HB LYS 63 2.996 -18.677 -7.168
432 2HB LYS 63 2HB LYS 63 1.717 -19.084 -6.043
433 1HG LYS 63 1HG LYS 63 0.065 -18.494 -7.513
434 2HG LYS 63 2HG LYS 63 0.891 -17.028 -8.002
435 1HD LYS 63 1HD LYS 63 2.531 -18.634 -9.284
436 2HD LYS 63 2HD LYS 63 1.285 -19.847 -9.065
437 1HE LYS 63 1HE LYS 63 -0.233 -17.741 -9.989
438 2HE LYS 63 2HE LYS 63 1.283 -17.420 -10.807
439 1HZ LYS 63 1HZ LYS 63 0.536 -20.164 -10.884
440 2HZ LYS 63 2HZ LYS 63 -0.560 -19.192 -11.606
441 3HZ LYS 63 3HZ LYS 63 0.996 -19.177 -12.101
442 H SER 64 H SER 64 2.045 -15.450 -3.918
443 HA SER 64 HA SER 64 2.565 -17.283 -1.914
444 1HB SER 64 1HB SER 64 4.951 -15.937 -3.071
445 2HB SER 64 2HB SER 64 4.836 -15.821 -1.327
446 HG SER 64 HG SER 64 4.273 -18.332 -1.711
447 H VAL 65 H VAL 65 2.648 -16.172 0.270
448 HA VAL 65 HA VAL 65 1.090 -13.749 0.130
449 HB VAL 65 HB VAL 65 0.383 -15.482 1.618
450 1HG1 VAL 65 1HG1 VAL 65 3.249 -15.486 2.456
451 2HG1 VAL 65 2HG1 VAL 65 2.024 -15.842 3.698
452 3HG1 VAL 65 3HG1 VAL 65 2.117 -16.841 2.227
453 1HG2 VAL 65 1HG2 VAL 65 0.469 -12.921 2.310
454 2HG2 VAL 65 2HG2 VAL 65 -0.108 -14.170 3.439
455 3HG2 VAL 65 3HG2 VAL 65 1.552 -13.543 3.578
456 H ASN 66 H ASN 66 4.244 -14.233 -0.371
457 HA ASN 66 HA ASN 66 5.129 -12.175 1.467
458 1HB ASN 66 1HB ASN 66 6.739 -13.904 -0.486
459 2HB ASN 66 2HB ASN 66 7.425 -12.819 0.707
460 2HD2 ASN 66 2HD2 ASN 66 6.520 -13.167 2.991
461 1HD2 ASN 66 1HD2 ASN 66 6.458 -14.802 3.560
462 H SER 67 H SER 67 3.518 -12.213 -1.346
463 HA SER 67 HA SER 67 5.244 -10.766 -3.049
464 1HB SER 67 1HB SER 67 2.938 -10.312 -4.237
465 2HB SER 67 2HB SER 67 3.605 -11.932 -4.234
466 HG SER 67 HG SER 67 1.344 -11.908 -3.634
467 H TRP 68 H TRP 68 5.389 -8.518 -3.377
468 HA TRP 68 HA TRP 68 4.077 -6.912 -1.321
469 1HB TRP 68 1HB TRP 68 6.359 -6.531 -1.257
470 2HB TRP 68 2HB TRP 68 6.539 -6.601 -2.999
471 HD1 TRP 68 HD1 TRP 68 6.768 -4.260 -4.139
472 HE1 TRP 68 HE1 TRP 68 6.270 -1.731 -3.575
473 HE3 TRP 68 HE3 TRP 68 4.470 -5.158 0.308
474 HZ2 TRP 68 HZ2 TRP 68 5.000 -0.419 -1.381
475 HZ3 TRP 68 HZ3 TRP 68 3.630 -3.197 1.598
476 HH2 TRP 68 HH2 TRP 68 3.865 -0.892 0.820
477 H TYR 69 H TYR 69 2.985 -8.144 -3.920
478 HA TYR 69 HA TYR 69 1.937 -5.603 -5.077
479 1HB TYR 69 1HB TYR 69 3.364 -6.627 -6.707
480 2HB TYR 69 2HB TYR 69 2.668 -8.228 -6.405
481 HD1 TYR 69 HD1 TYR 69 0.191 -8.588 -6.984
482 HD2 TYR 69 HD2 TYR 69 2.480 -5.229 -8.373
483 HE1 TYR 69 HE1 TYR 69 -1.459 -8.213 -8.797
484 HE2 TYR 69 HE2 TYR 69 0.830 -4.854 -10.186
485 HH TYR 69 HH TYR 69 -1.358 -5.391 -10.904
486 H LYS 70 H LYS 70 1.235 -8.412 -3.251
487 HA LYS 70 HA LYS 70 -1.509 -8.476 -4.268
488 1HB LYS 70 1HB LYS 70 -0.065 -10.587 -4.065
489 2HB LYS 70 2HB LYS 70 -0.248 -10.423 -2.331
490 1HG LYS 70 1HG LYS 70 -2.868 -10.084 -3.309
491 2HG LYS 70 2HG LYS 70 -2.203 -11.339 -4.336
492 1HD LYS 70 2HD LYS 70 -2.319 -11.351 -1.286
493 2HD LYS 70 1HD LYS 70 -3.230 -12.381 -2.372
494 1HE LYS 70 1HE LYS 70 -1.330 -13.664 -2.974
495 2HE LYS 70 2HE LYS 70 -0.204 -12.400 -2.520
496 1HZ LYS 70 1HZ LYS 70 -1.900 -13.749 -0.547
497 2HZ LYS 70 2HZ LYS 70 -0.420 -14.307 -0.953
498 3HZ LYS 70 3HZ LYS 70 -0.577 -12.832 -0.270
499 H VAL 71 H VAL 71 0.502 -8.007 -1.315
500 HA VAL 71 HA VAL 71 -1.672 -7.617 0.418
501 HB VAL 71 HB VAL 71 0.057 -6.568 1.867
502 1HG1 VAL 71 1HG1 VAL 71 -0.308 -9.191 1.236
503 2HG1 VAL 71 2HG1 VAL 71 1.427 -9.003 0.889
504 3HG1 VAL 71 3HG1 VAL 71 0.795 -8.608 2.505
505 1HG2 VAL 71 1HG2 VAL 71 1.368 -5.564 -0.039
506 2HG2 VAL 71 2HG2 VAL 71 2.346 -6.408 1.185
507 3HG2 VAL 71 3HG2 VAL 71 2.001 -7.193 -0.375
508 H VAL 72 H VAL 72 -0.668 -5.829 -2.274
509 HA VAL 72 HA VAL 72 -1.634 -3.322 -1.101
510 HB VAL 72 HB VAL 72 0.025 -3.932 -3.551
511 1HG1 VAL 72 1HG1 VAL 72 -1.569 -2.077 -3.980
512 2HG1 VAL 72 2HG1 VAL 72 -0.914 -1.217 -2.567
513 3HG1 VAL 72 3HG1 VAL 72 0.129 -1.542 -3.972
514 1HG2 VAL 72 1HG2 VAL 72 0.914 -3.844 -1.035
515 2HG2 VAL 72 2HG2 VAL 72 1.859 -3.196 -2.398
516 3HG2 VAL 72 3HG2 VAL 72 0.912 -2.095 -1.368
517 H HIS 73 H HIS 73 -1.876 -5.399 -4.071
518 HA HIS 73 HA HIS 73 -4.405 -4.094 -4.655
519 1HB HIS 73 2HB HIS 73 -2.893 -6.132 -6.309
520 2HB HIS 73 1HB HIS 73 -4.238 -5.137 -6.829
521 HD1 HIS 73 HD1 HIS 73 -0.549 -4.948 -6.015
522 HD2 HIS 73 HD2 HIS 73 -3.586 -2.506 -7.568
523 HE1 HIS 73 HE1 HIS 73 0.610 -2.882 -6.963
524 H ASP 74 H ASP 74 -3.987 -5.941 -2.317
525 HA ASP 74 HA ASP 74 -5.170 -8.393 -3.034
526 1HB ASP 74 1HB ASP 74 -4.069 -7.111 -0.664
527 2HB ASP 74 2HB ASP 74 -5.607 -7.844 -0.255
528 H ALA 75 H ALA 75 -7.294 -8.296 -3.846
529 HA ALA 75 HA ALA 75 -9.138 -6.362 -2.734
530 1HB ALA 75 1HB ALA 75 -9.025 -8.212 -5.098
531 2HB ALA 75 3HB ALA 75 -10.621 -7.681 -4.514
532 3HB ALA 75 2HB ALA 75 -9.416 -6.476 -5.027
533 H LYS 76 H LYS 76 -7.977 -9.378 -1.832
534 HA LYS 76 HA LYS 76 -10.581 -10.291 -0.868
535 1HB LYS 76 1HB LYS 76 -8.955 -11.789 -2.178
536 2HB LYS 76 2HB LYS 76 -7.966 -11.799 -0.733
537 1HG LYS 76 1HG LYS 76 -10.239 -12.441 0.487
538 2HG LYS 76 2HG LYS 76 -10.758 -12.908 -1.120
539 1HD LYS 76 1HD LYS 76 -8.058 -13.884 -0.216
540 2HD LYS 76 2HD LYS 76 -9.463 -14.612 0.538
541 1HE LYS 76 1HE LYS 76 -9.852 -15.878 -1.304
542 2HE LYS 76 2HE LYS 76 -9.954 -14.448 -2.310
543 1HZ LYS 76 1HZ LYS 76 -7.345 -15.456 -1.483
544 2HZ LYS 76 2HZ LYS 76 -8.122 -16.140 -2.746
545 3HZ LYS 76 3HZ LYS 76 -7.728 -14.556 -2.790
546 H GLY 77 H GLY 77 -10.945 -10.719 1.372
547 1HA GLY 77 2HA GLY 77 -10.856 -10.158 3.548
548 2HA GLY 77 1HA GLY 77 -9.813 -8.817 3.117
549 H GLY 78 H GLY 78 -9.480 -10.349 5.511
550 1HA GLY 78 2HA GLY 78 -6.758 -11.309 5.068
551 2HA GLY 78 1HA GLY 78 -7.907 -12.461 5.717
552 H ALA 79 H ALA 79 -5.796 -11.934 7.329
553 HA ALA 79 HA ALA 79 -6.850 -11.222 9.715
554 1HB ALA 79 1HB ALA 79 -4.772 -11.772 10.379
555 2HB ALA 79 3HB ALA 79 -4.070 -10.376 9.527
556 3HB ALA 79 2HB ALA 79 -4.331 -11.909 8.661
557 H LYS 80 H LYS 80 -5.866 -9.120 7.057
558 HA LYS 80 HA LYS 80 -7.023 -6.885 8.429
559 1HB LYS 80 1HB LYS 80 -4.768 -5.580 7.830
560 2HB LYS 80 2HB LYS 80 -5.064 -6.297 9.400
561 1HG LYS 80 1HG LYS 80 -3.879 -8.385 8.654
562 2HG LYS 80 2HG LYS 80 -3.558 -7.636 7.103
563 1HD LYS 80 1HD LYS 80 -2.569 -6.634 9.814
564 2HD LYS 80 2HD LYS 80 -1.593 -7.425 8.593
565 1HE LYS 80 1HE LYS 80 -2.131 -5.541 6.993
566 2HE LYS 80 2HE LYS 80 -3.015 -4.738 8.275
567 1HZ LYS 80 1HZ LYS 80 -0.217 -5.538 8.608
568 2HZ LYS 80 2HZ LYS 80 -0.632 -4.094 7.967
569 3HZ LYS 80 3HZ LYS 80 -1.069 -4.465 9.497
570 HA PRO 81 HA PRO 81 -8.006 -5.766 4.324
571 1HB PRO 81 1HB PRO 81 -8.132 -3.024 4.515
572 2HB PRO 81 2HB PRO 81 -9.304 -4.115 5.323
573 1HG PRO 81 1HG PRO 81 -6.995 -2.806 6.268
574 2HG PRO 81 2HG PRO 81 -8.519 -2.862 7.213
575 1HD PRO 81 1HD PRO 81 -6.411 -4.466 7.837
576 2HD PRO 81 2HD PRO 81 -8.082 -5.104 7.909
577 H THR 82 H THR 82 -7.249 -3.720 2.655
578 HA THR 82 HA THR 82 -4.332 -3.561 2.817
579 HB THR 82 HB THR 82 -4.294 -4.256 0.354
580 HG1 THR 82 HG1 THR 82 -6.420 -5.545 -0.037
581 1HG2 THR 82 1HG2 THR 82 -4.617 -5.955 2.668
582 2HG2 THR 82 2HG2 THR 82 -5.559 -6.662 1.333
583 3HG2 THR 82 3HG2 THR 82 -3.818 -6.350 1.128
584 H CYS 83 H CYS 83 -3.918 -2.352 0.311
585 HA CYS 83 HA CYS 83 -4.832 0.262 0.970
586 1HB CYS 83 1HB CYS 83 -3.423 -0.468 -1.583
587 2HB CYS 83 2HB CYS 83 -3.383 1.042 -0.693
588 H ILE 84 H ILE 84 -6.289 -2.383 -0.482
589 HA ILE 84 HA ILE 84 -7.836 -0.682 -2.311
590 HB ILE 84 HB ILE 84 -6.962 -3.538 -2.432
591 1HG1 ILE 84 1HG1 ILE 84 -5.716 -1.707 -3.590
592 2HG1 ILE 84 2HG1 ILE 84 -6.291 -2.979 -4.649
593 1HG2 ILE 84 1HG2 ILE 84 -9.581 -2.455 -3.360
594 2HG2 ILE 84 2HG2 ILE 84 -8.707 -3.572 -4.435
595 3HG2 ILE 84 3HG2 ILE 84 -9.144 -4.083 -2.787
596 1HD1 ILE 84 1HD1 ILE 84 -8.443 -1.254 -4.703
597 2HD1 ILE 84 2HD1 ILE 84 -7.083 -0.119 -4.526
598 3HD1 ILE 84 3HD1 ILE 84 -7.123 -1.253 -5.898
599 H SER 85 H SER 85 -7.957 -3.292 0.180
600 HA SER 85 HA SER 85 -10.656 -3.603 0.271
601 1HB SER 85 1HB SER 85 -8.573 -4.662 1.630
602 2HB SER 85 2HB SER 85 -9.154 -3.572 2.874
603 HG SER 85 HG SER 85 -11.359 -4.579 2.381
604 H CYS 86 H CYS 86 -8.651 -1.461 2.438
605 HA CYS 86 HA CYS 86 -10.823 -0.218 3.626
606 1HB CYS 86 1HB CYS 86 -8.349 -0.230 4.340
607 2HB CYS 86 2HB CYS 86 -8.133 1.105 3.226
608 H HIS 87 H HIS 87 -8.610 0.934 0.968
609 HA HIS 87 HA HIS 87 -9.848 3.267 0.379
610 1HB HIS 87 1HB HIS 87 -8.339 1.264 -1.272
611 2HB HIS 87 2HB HIS 87 -9.068 2.649 -2.060
612 HD1 HIS 87 HD1 HIS 87 -6.759 3.694 -2.633
613 HD2 HIS 87 HD2 HIS 87 -7.423 3.154 1.473
614 HE1 HIS 87 HE1 HIS 87 -4.924 5.000 -1.435
615 H LYS 88 H LYS 88 -10.838 -0.062 -0.501
616 HA LYS 88 HA LYS 88 -12.790 0.647 -2.367
617 1HB LYS 88 1HB LYS 88 -12.083 -1.752 -0.759
618 2HB LYS 88 2HB LYS 88 -13.725 -1.684 -1.368
619 1HG LYS 88 1HG LYS 88 -12.856 -1.267 -3.676
620 2HG LYS 88 2HG LYS 88 -11.213 -1.324 -3.071
621 1HD LYS 88 1HD LYS 88 -11.190 -3.604 -3.029
622 2HD LYS 88 2HD LYS 88 -12.747 -3.689 -2.230
623 1HE LYS 88 1HE LYS 88 -13.947 -3.740 -4.250
624 2HE LYS 88 2HE LYS 88 -12.701 -2.887 -5.140
625 1HZ LYS 88 1HZ LYS 88 -11.505 -5.175 -4.307
626 2HZ LYS 88 2HZ LYS 88 -13.004 -5.663 -4.735
627 3HZ LYS 88 3HZ LYS 88 -12.064 -4.873 -5.812
628 H ASP 89 H ASP 89 -12.936 0.152 1.214
629 HA ASP 89 HA ASP 89 -15.627 0.441 1.495
630 1HB ASP 89 1HB ASP 89 -13.619 0.007 3.208
631 2HB ASP 89 2HB ASP 89 -13.740 1.734 3.476
632 H LYS 90 H LYS 90 -12.983 2.890 1.258
633 HA LYS 90 HA LYS 90 -14.539 5.130 1.892
634 1HB LYS 90 1HB LYS 90 -11.888 4.629 0.600
635 2HB LYS 90 2HB LYS 90 -12.604 6.218 0.416
636 1HG LYS 90 1HG LYS 90 -12.339 4.850 3.129
637 2HG LYS 90 2HG LYS 90 -11.082 5.877 2.470
638 1HD LYS 90 1HD LYS 90 -12.488 7.821 2.497
639 2HD LYS 90 2HD LYS 90 -13.948 6.869 2.678
640 1HE LYS 90 1HE LYS 90 -11.740 7.124 4.777
641 2HE LYS 90 2HE LYS 90 -13.279 7.961 4.823
642 1HZ LYS 90 1HZ LYS 90 -13.757 5.248 4.451
643 2HZ LYS 90 2HZ LYS 90 -12.720 5.406 5.703
644 3HZ LYS 90 3HZ LYS 90 -14.158 6.180 5.732
645 H ALA 91 H ALA 91 -13.842 3.414 -1.195
646 HA ALA 91 HA ALA 91 -15.536 5.316 -2.605
647 1HB ALA 91 1HB ALA 91 -13.326 3.514 -3.243
648 2HB ALA 91 3HB ALA 91 -13.957 4.905 -4.157
649 3HB ALA 91 2HB ALA 91 -14.695 3.298 -4.361
650 H GLY 92 H GLY 92 -16.484 3.327 -0.474
651 1HA GLY 92 2HA GLY 92 -17.974 1.594 -0.266
652 2HA GLY 92 1HA GLY 92 -18.043 1.415 -2.008
653 H ASP 93 H ASP 93 -18.924 3.638 -3.130
654 HA ASP 93 HA ASP 93 -21.539 3.736 -2.761
655 1HB ASP 93 1HB ASP 93 -21.786 6.004 -1.483
656 2HB ASP 93 2HB ASP 93 -21.576 4.538 -0.547
657 H ASP 94 H ASP 94 -18.880 6.238 -2.651
658 HA ASP 94 HA ASP 94 -20.088 7.731 -4.727
659 1HB ASP 94 1HB ASP 94 -18.729 8.834 -3.006
660 2HB ASP 94 2HB ASP 94 -17.340 7.843 -3.404
661 H LYS 95 H LYS 95 -19.763 7.415 -6.944
662 HA LYS 95 HA LYS 95 -18.100 5.264 -7.790
663 1HB LYS 95 1HB LYS 95 -19.863 7.266 -9.207
664 2HB LYS 95 2HB LYS 95 -18.866 6.129 -10.091
665 1HG LYS 95 1HG LYS 95 -19.962 4.222 -9.009
666 2HG LYS 95 2HG LYS 95 -20.836 5.280 -7.919
667 1HD LYS 95 1HD LYS 95 -22.086 6.268 -9.807
668 2HD LYS 95 2HD LYS 95 -21.143 5.341 -10.957
669 1HE LYS 95 2HE LYS 95 -22.693 3.691 -10.791
670 2HE LYS 95 1HE LYS 95 -22.130 3.399 -9.157
671 1HZ LYS 95 1HZ LYS 95 -24.219 5.328 -9.901
672 2HZ LYS 95 2HZ LYS 95 -24.476 3.866 -9.220
673 3HZ LYS 95 3HZ LYS 95 -23.703 5.034 -8.379
674 H GLU 96 H GLU 96 -17.932 8.851 -7.804
675 HA GLU 96 HA GLU 96 -15.682 8.983 -9.441
676 1HB GLU 96 1HB GLU 96 -17.302 10.865 -8.829
677 2HB GLU 96 2HB GLU 96 -16.487 10.976 -7.281
678 1HG GLU 96 2HG GLU 96 -15.401 12.608 -8.635
679 2HG GLU 96 1HG GLU 96 -14.286 11.256 -8.611
680 H LEU 97 H LEU 97 -16.152 8.189 -6.043
681 HA LEU 97 HA LEU 97 -13.457 8.774 -5.282
682 1HB LEU 97 1HB LEU 97 -15.633 8.728 -3.867
683 2HB LEU 97 2HB LEU 97 -15.354 7.000 -3.778
684 HG LEU 97 HG LEU 97 -14.421 7.865 -1.814
685 1HD1 LEU 97 1HD1 LEU 97 -12.950 6.292 -3.135
686 2HD1 LEU 97 2HD1 LEU 97 -12.010 7.719 -3.633
687 3HD1 LEU 97 3HD1 LEU 97 -12.125 7.286 -1.910
688 1HD2 LEU 97 1HD2 LEU 97 -14.227 10.257 -3.184
689 2HD2 LEU 97 2HD2 LEU 97 -13.680 9.947 -1.519
690 3HD2 LEU 97 3HD2 LEU 97 -12.529 9.825 -2.871
691 H LYS 98 H LYS 98 -15.135 6.196 -6.921
692 HA LYS 98 HA LYS 98 -13.142 4.227 -6.210
693 1HB LYS 98 1HB LYS 98 -15.573 3.682 -6.451
694 2HB LYS 98 2HB LYS 98 -15.453 4.037 -8.163
695 1HG LYS 98 1HG LYS 98 -14.565 1.993 -8.588
696 2HG LYS 98 2HG LYS 98 -13.283 2.254 -7.422
697 1HD LYS 98 1HD LYS 98 -14.398 0.379 -6.529
698 2HD LYS 98 2HD LYS 98 -15.093 1.699 -5.608
699 1HE LYS 98 1HE LYS 98 -16.949 0.341 -6.320
700 2HE LYS 98 2HE LYS 98 -16.994 1.778 -7.322
701 1HZ LYS 98 1HZ LYS 98 -15.515 0.308 -8.845
702 2HZ LYS 98 2HZ LYS 98 -16.235 -0.923 -8.048
703 3HZ LYS 98 3HZ LYS 98 -17.141 0.158 -8.872
704 H LYS 99 H LYS 99 -12.426 6.815 -7.610
705 HA LYS 99 HA LYS 99 -10.927 5.532 -9.745
706 1HB LYS 99 1HB LYS 99 -12.956 7.710 -10.138
707 2HB LYS 99 2HB LYS 99 -11.510 7.702 -11.127
708 1HG LYS 99 1HG LYS 99 -11.998 5.519 -12.022
709 2HG LYS 99 2HG LYS 99 -13.207 5.198 -10.794
710 1HD LYS 99 1HD LYS 99 -14.494 7.244 -11.761
711 2HD LYS 99 2HD LYS 99 -13.396 7.149 -13.123
712 1HE LYS 99 1HE LYS 99 -15.019 4.750 -12.167
713 2HE LYS 99 2HE LYS 99 -15.628 5.878 -13.362
714 1HZ LYS 99 1HZ LYS 99 -13.023 5.084 -14.027
715 2HZ LYS 99 2HZ LYS 99 -13.953 3.761 -13.799
716 3HZ LYS 99 3HZ LYS 99 -14.401 4.897 -14.884
717 H LYS 100 H LYS 100 -9.917 6.073 -7.267
718 HA LYS 100 HA LYS 100 -7.876 7.918 -7.894
719 1HB LYS 100 1HB LYS 100 -8.448 9.383 -5.799
720 2HB LYS 100 2HB LYS 100 -9.153 9.750 -7.361
721 1HG LYS 100 1HG LYS 100 -11.212 8.480 -6.744
722 2HG LYS 100 2HG LYS 100 -10.507 8.077 -5.191
723 1HD LYS 100 2HD LYS 100 -11.965 9.980 -4.841
724 2HD LYS 100 1HD LYS 100 -10.317 10.557 -4.689
725 1HE LYS 100 1HE LYS 100 -10.372 11.374 -7.047
726 2HE LYS 100 2HE LYS 100 -12.007 10.770 -7.228
727 1HZ LYS 100 1HZ LYS 100 -11.280 12.702 -5.146
728 2HZ LYS 100 2HZ LYS 100 -11.780 13.160 -6.632
729 3HZ LYS 100 3HZ LYS 100 -12.778 12.305 -5.661
730 H LEU 101 H LEU 101 -9.726 6.203 -5.306
731 HA LEU 101 HA LEU 101 -7.222 5.653 -3.939
732 1HB LEU 101 1HB LEU 101 -10.031 4.879 -3.154
733 2HB LEU 101 2HB LEU 101 -8.595 4.833 -2.151
734 HG LEU 101 HG LEU 101 -10.185 7.213 -3.072
735 1HD1 LEU 101 1HD1 LEU 101 -10.515 5.885 -0.861
736 2HD1 LEU 101 2HD1 LEU 101 -9.052 6.747 -0.328
737 3HD1 LEU 101 3HD1 LEU 101 -10.495 7.665 -0.823
738 1HD2 LEU 101 1HD2 LEU 101 -7.857 7.715 -3.660
739 2HD2 LEU 101 2HD2 LEU 101 -8.430 8.721 -2.307
740 3HD2 LEU 101 3HD2 LEU 101 -7.355 7.337 -1.995
741 H THR 102 H THR 102 -9.692 4.130 -5.994
742 HA THR 102 HA THR 102 -8.087 1.660 -5.896
743 HB THR 102 HB THR 102 -10.161 0.406 -6.051
744 HG1 THR 102 HG1 THR 102 -11.364 1.732 -7.473
745 1HG2 THR 102 1HG2 THR 102 -9.768 1.370 -3.742
746 2HG2 THR 102 2HG2 THR 102 -10.737 2.788 -4.212
747 3HG2 THR 102 3HG2 THR 102 -11.496 1.180 -4.123
748 H GLY 103 H GLY 103 -8.489 4.340 -7.655
749 1HA GLY 103 2HA GLY 103 -8.293 4.857 -9.834
750 2HA GLY 103 1HA GLY 103 -9.277 3.454 -10.202
751 H CYS 104 H CYS 104 -8.325 1.879 -11.415
752 HA CYS 104 HA CYS 104 -5.837 0.816 -10.885
753 1HB CYS 104 1HB CYS 104 -7.862 0.592 -12.992
754 2HB CYS 104 2HB CYS 104 -6.232 0.302 -13.566
755 H LYS 105 H LYS 105 -6.891 3.140 -13.485
756 HA LYS 105 HA LYS 105 -4.112 4.087 -13.561
757 1HB LYS 105 1HB LYS 105 -4.403 2.834 -15.558
758 2HB LYS 105 2HB LYS 105 -5.997 3.501 -15.849
759 1HG LYS 105 1HG LYS 105 -4.655 5.830 -15.829
760 2HG LYS 105 2HG LYS 105 -3.297 4.797 -16.229
761 1HD LYS 105 1HD LYS 105 -5.667 4.106 -17.826
762 2HD LYS 105 2HD LYS 105 -5.242 5.795 -18.019
763 1HE LYS 105 1HE LYS 105 -2.797 4.965 -18.377
764 2HE LYS 105 2HE LYS 105 -3.486 3.363 -18.545
765 1HZ LYS 105 1HZ LYS 105 -5.040 4.830 -20.147
766 2HZ LYS 105 2HZ LYS 105 -3.597 5.567 -20.348
767 3HZ LYS 105 3HZ LYS 105 -3.746 3.969 -20.648
768 H GLY 106 H GLY 106 -3.813 6.311 -13.538
769 1HA GLY 106 2HA GLY 106 -5.968 8.127 -14.035
770 2HA GLY 106 1HA GLY 106 -4.358 8.506 -13.459
771 H SER 107 H SER 107 -4.254 6.842 -11.116
772 HA SER 107 HA SER 107 -6.385 8.075 -9.550
773 1HB SER 107 2HB SER 107 -6.385 6.184 -8.083
774 2HB SER 107 1HB SER 107 -6.393 5.528 -9.708
775 HG SER 107 HG SER 107 -4.728 4.386 -8.948
776 H ALA 108 H ALA 108 -5.494 7.944 -7.004
777 HA ALA 108 HA ALA 108 -3.312 9.780 -7.011
778 1HB ALA 108 1HB ALA 108 -3.801 9.012 -4.377
779 2HB ALA 108 2HB ALA 108 -4.572 10.369 -5.233
780 3HB ALA 108 3HB ALA 108 -5.375 8.781 -5.177
781 H CYS 109 H CYS 109 -3.464 6.445 -7.371
782 HA CYS 109 HA CYS 109 -1.009 6.029 -5.844
783 1HB CYS 109 1HB CYS 109 -3.061 4.089 -6.942
784 2HB CYS 109 2HB CYS 109 -1.498 3.572 -6.340
785 H HIS 110 H HIS 110 -2.597 5.570 -9.071
786 HA HIS 110 HA HIS 110 0.098 5.460 -10.219
787 1HB HIS 110 1HB HIS 110 -2.432 4.091 -11.172
788 2HB HIS 110 2HB HIS 110 -0.926 4.132 -12.066
789 HD1 HIS 110 HD1 HIS 110 1.196 3.362 -10.115
790 HD2 HIS 110 HD2 HIS 110 -2.625 1.633 -10.023
791 HE1 HIS 110 HE1 HIS 110 1.449 1.133 -8.899
792 HA PRO 111 HA PRO 111 -1.828 9.177 -11.967
793 1HB PRO 111 1HB PRO 111 -0.051 11.018 -11.138
794 2HB PRO 111 2HB PRO 111 -1.177 10.261 -9.965
795 1HG PRO 111 1HG PRO 111 1.909 9.443 -10.056
796 2HG PRO 111 2HG PRO 111 0.485 9.734 -9.005
797 1HD PRO 111 1HD PRO 111 1.358 7.259 -10.430
798 2HD PRO 111 2HD PRO 111 0.169 7.437 -9.104
799 H SER 112 H SER 112 -1.094 7.754 -13.950
800 HA SER 112 HA SER 112 0.828 9.329 -15.333
801 1HB SER 112 1HB SER 112 1.745 6.971 -14.028
802 2HB SER 112 2HB SER 112 1.635 6.556 -15.726
803 HG SER 112 HG SER 112 2.802 8.767 -16.007
No H/Q in entry = 803
Start of MODEL 7
1 H1 VAL 1 H1 VAL 1 8.670 9.365 17.629
2 H2 VAL 1 H2 VAL 1 8.386 7.741 17.473
3 H3 VAL 1 H3 VAL 1 9.662 8.275 18.383
4 HA VAL 1 HA VAL 1 10.980 8.602 16.709
5 HB VAL 1 HB VAL 1 10.450 6.339 16.396
6 1HG1 VAL 1 1HG1 VAL 1 7.803 7.375 15.475
7 2HG1 VAL 1 2HG1 VAL 1 8.391 5.851 14.768
8 3HG1 VAL 1 3HG1 VAL 1 8.192 5.995 16.531
9 1HG2 VAL 1 1HG2 VAL 1 11.627 7.400 14.494
10 2HG2 VAL 1 2HG2 VAL 1 10.642 6.005 13.991
11 3HG2 VAL 1 3HG2 VAL 1 10.061 7.660 13.689
12 H ASP 2 H ASP 2 7.905 9.985 16.581
13 HA ASP 2 HA ASP 2 7.018 11.600 15.441
14 1HB ASP 2 1HB ASP 2 9.865 12.015 14.413
15 2HB ASP 2 2HB ASP 2 8.558 13.149 14.132
16 H VAL 3 H VAL 3 5.622 10.885 13.814
17 HA VAL 3 HA VAL 3 6.311 9.132 11.800
18 HB VAL 3 HB VAL 3 4.035 10.043 12.783
19 1HG1 VAL 3 1HG1 VAL 3 4.459 12.323 11.731
20 2HG1 VAL 3 2HG1 VAL 3 4.132 11.554 10.160
21 3HG1 VAL 3 3HG1 VAL 3 2.868 11.592 11.413
22 1HG2 VAL 3 1HG2 VAL 3 4.551 8.943 10.013
23 2HG2 VAL 3 2HG2 VAL 3 4.048 8.073 11.483
24 3HG2 VAL 3 3HG2 VAL 3 2.906 9.161 10.658
25 HA PRO 4 HA PRO 4 9.091 11.354 9.216
26 1HB PRO 4 2HB PRO 4 7.655 9.624 7.172
27 2HB PRO 4 1HB PRO 4 9.406 9.912 7.433
28 1HG PRO 4 1HG PRO 4 8.343 7.669 8.405
29 2HG PRO 4 2HG PRO 4 9.655 8.516 9.288
30 1HD PRO 4 1HD PRO 4 6.700 8.341 9.865
31 2HD PRO 4 2HD PRO 4 8.060 8.630 10.992
32 H ALA 5 H ALA 5 8.918 12.823 7.244
33 HA ALA 5 HA ALA 5 6.365 14.180 7.350
34 1HB ALA 5 1HB ALA 5 7.572 16.013 6.771
35 2HB ALA 5 2HB ALA 5 8.468 15.142 5.503
36 3HB ALA 5 3HB ALA 5 8.981 15.015 7.203
37 H ASP 6 H ASP 6 5.131 14.713 5.408
38 HA ASP 6 HA ASP 6 4.611 12.540 3.860
39 1HB ASP 6 2HB ASP 6 3.109 13.930 2.696
40 2HB ASP 6 1HB ASP 6 3.293 14.770 4.223
41 H GLY 7 H GLY 7 4.551 13.419 1.132
42 1HA GLY 7 2HA GLY 7 7.055 14.437 0.249
43 2HA GLY 7 1HA GLY 7 5.799 13.699 -0.725
44 H ALA 8 H ALA 8 5.682 11.163 0.814
45 HA ALA 8 HA ALA 8 8.363 10.085 0.498
46 1HB ALA 8 1HB ALA 8 5.764 9.113 1.715
47 2HB ALA 8 2HB ALA 8 7.326 9.414 2.515
48 3HB ALA 8 3HB ALA 8 7.134 8.011 1.437
49 H LYS 9 H LYS 9 8.975 8.686 -1.133
50 HA LYS 9 HA LYS 9 6.883 8.099 -3.112
51 1HB LYS 9 1HB LYS 9 9.814 8.759 -3.501
52 2HB LYS 9 2HB LYS 9 8.799 8.092 -4.764
53 1HG LYS 9 1HG LYS 9 7.433 10.022 -4.879
54 2HG LYS 9 2HG LYS 9 7.852 10.543 -3.260
55 1HD LYS 9 1HD LYS 9 9.518 11.838 -4.083
56 2HD LYS 9 2HD LYS 9 10.297 10.427 -4.771
57 1HE LYS 9 1HE LYS 9 9.790 12.114 -6.526
58 2HE LYS 9 2HE LYS 9 8.928 10.617 -6.822
59 1HZ LYS 9 1HZ LYS 9 7.476 12.432 -5.182
60 2HZ LYS 9 2HZ LYS 9 7.805 13.044 -6.660
61 3HZ LYS 9 3HZ LYS 9 6.998 11.631 -6.522
62 H ILE 10 H ILE 10 6.629 5.988 -3.789
63 HA ILE 10 HA ILE 10 8.438 4.062 -2.503
64 HB ILE 10 HB ILE 10 5.522 3.695 -3.193
65 1HG1 ILE 10 1HG1 ILE 10 6.540 3.875 -0.379
66 2HG1 ILE 10 2HG1 ILE 10 6.268 5.358 -1.273
67 1HG2 ILE 10 1HG2 ILE 10 7.365 1.745 -2.984
68 2HG2 ILE 10 2HG2 ILE 10 6.920 1.922 -1.270
69 3HG2 ILE 10 3HG2 ILE 10 5.668 1.556 -2.480
70 1HD1 ILE 10 1HD1 ILE 10 3.931 4.594 -1.794
71 2HD1 ILE 10 2HD1 ILE 10 4.217 3.146 -0.800
72 3HD1 ILE 10 3HD1 ILE 10 4.229 4.759 -0.047
73 H ASP 11 H ASP 11 9.639 2.823 -3.846
74 HA ASP 11 HA ASP 11 8.561 2.052 -6.359
75 1HB ASP 11 1HB ASP 11 9.407 4.149 -7.143
76 2HB ASP 11 2HB ASP 11 10.840 4.045 -6.140
77 H PHE 12 H PHE 12 8.970 -0.109 -5.588
78 HA PHE 12 HA PHE 12 11.802 -0.715 -5.100
79 1HB PHE 12 1HB PHE 12 9.180 -2.030 -4.166
80 2HB PHE 12 2HB PHE 12 10.767 -2.678 -3.803
81 HD1 PHE 12 HD1 PHE 12 12.259 -0.214 -3.120
82 HD2 PHE 12 HD2 PHE 12 8.319 -1.413 -2.095
83 HE1 PHE 12 HE1 PHE 12 12.365 1.203 -1.051
84 HE2 PHE 12 HE2 PHE 12 8.426 0.004 -0.026
85 HZ PHE 12 HZ PHE 12 10.448 1.296 0.471
86 H ILE 13 H ILE 13 8.849 -1.425 -6.921
87 HA ILE 13 HA ILE 13 10.113 -3.763 -8.119
88 HB ILE 13 HB ILE 13 7.317 -2.640 -8.280
89 1HG1 ILE 13 1HG1 ILE 13 8.232 -5.254 -7.066
90 2HG1 ILE 13 2HG1 ILE 13 8.126 -3.773 -6.136
91 1HG2 ILE 13 1HG2 ILE 13 8.229 -3.788 -10.391
92 2HG2 ILE 13 2HG2 ILE 13 8.188 -5.285 -9.430
93 3HG2 ILE 13 3HG2 ILE 13 6.689 -4.370 -9.716
94 1HD1 ILE 13 1HD1 ILE 13 5.760 -4.678 -7.801
95 2HD1 ILE 13 2HD1 ILE 13 6.055 -5.382 -6.193
96 3HD1 ILE 13 3HD1 ILE 13 5.779 -3.632 -6.361
97 H ALA 14 H ALA 14 11.638 -3.153 -9.596
98 HA ALA 14 HA ALA 14 11.299 -0.798 -11.167
99 1HB ALA 14 1HB ALA 14 13.263 -2.934 -11.903
100 2HB ALA 14 3HB ALA 14 13.484 -1.172 -11.778
101 3HB ALA 14 2HB ALA 14 13.442 -2.171 -10.305
102 H GLY 15 H GLY 15 9.333 -1.010 -12.326
103 1HA GLY 15 2HA GLY 15 8.545 -3.285 -13.748
104 2HA GLY 15 1HA GLY 15 9.520 -2.300 -14.821
105 H GLY 16 H GLY 16 7.280 -2.271 -15.952
106 1HA GLY 16 2HA GLY 16 5.337 -0.480 -14.742
107 2HA GLY 16 1HA GLY 16 5.200 -1.348 -16.258
108 H GLU 17 H GLU 17 6.547 -0.573 -18.142
109 HA GLU 17 HA GLU 17 6.980 1.036 -19.545
110 1HB GLU 17 1HB GLU 17 5.370 2.442 -17.554
111 2HB GLU 17 2HB GLU 17 6.576 3.517 -18.233
112 1HG GLU 17 1HG GLU 17 4.339 3.393 -19.494
113 2HG GLU 17 2HG GLU 17 5.782 3.197 -20.469
114 H LYS 18 H LYS 18 7.917 2.052 -16.185
115 HA LYS 18 HA LYS 18 10.678 1.942 -16.910
116 1HB LYS 18 1HB LYS 18 11.060 4.380 -16.245
117 2HB LYS 18 2HB LYS 18 10.432 4.068 -17.851
118 1HG LYS 18 1HG LYS 18 8.081 4.433 -16.914
119 2HG LYS 18 2HG LYS 18 8.821 4.936 -15.407
120 1HD LYS 18 1HD LYS 18 9.708 6.907 -16.329
121 2HD LYS 18 2HD LYS 18 9.767 6.252 -17.954
122 1HE LYS 18 1HE LYS 18 7.654 6.971 -18.435
123 2HE LYS 18 2HE LYS 18 7.008 6.345 -16.932
124 1HZ LYS 18 1HZ LYS 18 8.592 8.499 -16.284
125 2HZ LYS 18 2HZ LYS 18 7.688 8.974 -17.558
126 3HZ LYS 18 3HZ LYS 18 6.963 8.407 -16.210
127 H ASN 19 H ASN 19 8.246 3.273 -14.570
128 HA ASN 19 HA ASN 19 8.825 1.523 -12.589
129 1HB ASN 19 1HB ASN 19 10.180 3.023 -11.006
130 2HB ASN 19 2HB ASN 19 11.086 2.369 -12.357
131 2HD2 ASN 19 2HD2 ASN 19 12.289 4.369 -11.363
132 1HD2 ASN 19 1HD2 ASN 19 12.086 5.857 -12.225
133 H LEU 20 H LEU 20 6.709 1.744 -11.814
134 HA LEU 20 HA LEU 20 5.421 4.289 -11.794
135 1HB LEU 20 1HB LEU 20 4.613 1.564 -10.773
136 2HB LEU 20 2HB LEU 20 3.578 2.978 -10.717
137 HG LEU 20 HG LEU 20 4.596 1.517 -13.159
138 1HD1 LEU 20 1HD1 LEU 20 2.155 1.480 -11.617
139 2HD1 LEU 20 2HD1 LEU 20 1.830 1.977 -13.295
140 3HD1 LEU 20 3HD1 LEU 20 2.665 0.440 -12.968
141 1HD2 LEU 20 1HD2 LEU 20 3.231 4.216 -13.028
142 2HD2 LEU 20 2HD2 LEU 20 4.836 3.839 -13.697
143 3HD2 LEU 20 3HD2 LEU 20 3.371 3.228 -14.502
144 H THR 21 H THR 21 6.012 5.831 -10.359
145 HA THR 21 HA THR 21 6.820 4.956 -7.682
146 HB THR 21 HB THR 21 7.018 7.788 -8.743
147 HG1 THR 21 HG1 THR 21 9.072 6.921 -9.734
148 1HG2 THR 21 1HG2 THR 21 8.574 5.952 -6.887
149 2HG2 THR 21 2HG2 THR 21 9.406 7.306 -7.689
150 3HG2 THR 21 3HG2 THR 21 8.033 7.624 -6.603
151 H VAL 22 H VAL 22 5.259 4.793 -6.204
152 HA VAL 22 HA VAL 22 2.951 6.557 -6.488
153 HB VAL 22 HB VAL 22 3.480 4.049 -4.890
154 1HG1 VAL 22 1HG1 VAL 22 2.039 5.725 -3.668
155 2HG1 VAL 22 2HG1 VAL 22 0.869 5.585 -5.002
156 3HG1 VAL 22 3HG1 VAL 22 1.261 4.161 -4.009
157 1HG2 VAL 22 1HG2 VAL 22 2.540 4.525 -7.544
158 2HG2 VAL 22 2HG2 VAL 22 2.699 2.977 -6.681
159 3HG2 VAL 22 3HG2 VAL 22 1.180 3.900 -6.580
160 H VAL 23 H VAL 23 2.559 8.238 -5.108
161 HA VAL 23 HA VAL 23 4.602 8.711 -3.086
162 HB VAL 23 HB VAL 23 2.430 10.478 -4.232
163 1HG1 VAL 23 1HG1 VAL 23 3.248 10.970 -1.853
164 2HG1 VAL 23 2HG1 VAL 23 4.813 11.376 -2.599
165 3HG1 VAL 23 3HG1 VAL 23 3.353 12.294 -3.038
166 1HG2 VAL 23 1HG2 VAL 23 4.267 9.764 -5.813
167 2HG2 VAL 23 2HG2 VAL 23 4.125 11.520 -5.556
168 3HG2 VAL 23 3HG2 VAL 23 5.416 10.604 -4.743
169 H PHE 24 H PHE 24 4.150 8.927 -0.877
170 HA PHE 24 HA PHE 24 1.378 8.362 -0.115
171 1HB PHE 24 1HB PHE 24 2.966 6.337 -0.033
172 2HB PHE 24 2HB PHE 24 3.978 7.231 1.084
173 HD1 PHE 24 HD1 PHE 24 0.393 6.227 0.738
174 HD2 PHE 24 HD2 PHE 24 3.706 6.795 3.327
175 HE1 PHE 24 HE1 PHE 24 -0.962 5.356 2.662
176 HE2 PHE 24 HE2 PHE 24 2.351 5.924 5.252
177 HZ PHE 24 HZ PHE 24 0.033 5.215 4.896
178 H ASN 25 H ASN 25 0.887 8.994 2.172
179 HA ASN 25 HA ASN 25 2.788 10.899 3.232
180 1HB ASN 25 1HB ASN 25 0.090 11.941 3.578
181 2HB ASN 25 2HB ASN 25 1.469 12.723 2.829
182 2HD2 ASN 25 2HD2 ASN 25 2.058 11.765 0.614
183 1HD2 ASN 25 1HD2 ASN 25 0.754 11.544 -0.504
184 H HIS 26 H HIS 26 2.944 10.556 5.465
185 HA HIS 26 HA HIS 26 1.217 8.630 6.651
186 1HB HIS 26 1HB HIS 26 3.693 10.097 7.384
187 2HB HIS 26 2HB HIS 26 2.679 9.590 8.721
188 HD1 HIS 26 HD1 HIS 26 4.735 8.193 5.865
189 HD2 HIS 26 HD2 HIS 26 2.651 6.835 9.242
190 HE1 HIS 26 HE1 HIS 26 5.383 5.743 6.167
191 H SER 27 H SER 27 1.119 12.043 6.155
192 HA SER 27 HA SER 27 -0.458 12.493 8.520
193 1HB SER 27 1HB SER 27 -0.554 14.869 7.589
194 2HB SER 27 2HB SER 27 1.044 14.279 7.996
195 HG SER 27 HG SER 27 1.534 13.976 5.817
196 H THR 28 H THR 28 -1.200 10.759 6.006
197 HA THR 28 HA THR 28 -3.737 12.136 5.410
198 HB THR 28 HB THR 28 -2.153 10.085 3.773
199 HG1 THR 28 HG1 THR 28 -1.938 12.165 2.477
200 1HG2 THR 28 1HG2 THR 28 -4.818 10.477 3.520
201 2HG2 THR 28 2HG2 THR 28 -4.263 11.933 2.660
202 3HG2 THR 28 3HG2 THR 28 -3.767 10.321 2.093
203 H HIS 29 H HIS 29 -2.151 9.238 6.667
204 HA HIS 29 HA HIS 29 -4.816 8.073 7.017
205 1HB HIS 29 1HB HIS 29 -2.126 6.676 7.014
206 2HB HIS 29 2HB HIS 29 -3.690 5.906 7.198
207 HD1 HIS 29 HD1 HIS 29 -1.652 7.824 4.606
208 HD2 HIS 29 HD2 HIS 29 -4.976 5.275 4.830
209 HE1 HIS 29 HE1 HIS 29 -2.272 7.245 2.200
210 H LYS 30 H LYS 30 -3.364 10.227 8.619
211 HA LYS 30 HA LYS 30 -2.354 9.165 10.969
212 1HB LYS 30 2HB LYS 30 -2.693 11.366 11.896
213 2HB LYS 30 1HB LYS 30 -2.129 11.513 10.244
214 1HG LYS 30 1HG LYS 30 -4.756 11.554 9.698
215 2HG LYS 30 2HG LYS 30 -4.876 12.069 11.369
216 1HD LYS 30 1HD LYS 30 -2.825 13.687 10.505
217 2HD LYS 30 2HD LYS 30 -3.732 13.512 9.015
218 1HE LYS 30 1HE LYS 30 -5.841 14.122 10.384
219 2HE LYS 30 2HE LYS 30 -4.756 14.569 11.686
220 1HZ LYS 30 1HZ LYS 30 -3.658 16.070 10.107
221 2HZ LYS 30 2HZ LYS 30 -4.789 15.717 8.983
222 3HZ LYS 30 3HZ LYS 30 -5.221 16.465 10.370
223 H ASP 31 H ASP 31 -5.573 9.117 9.672
224 HA ASP 31 HA ASP 31 -6.808 8.916 12.238
225 1HB ASP 31 1HB ASP 31 -8.234 9.871 10.622
226 2HB ASP 31 2HB ASP 31 -7.699 8.785 9.356
227 H VAL 32 H VAL 32 -4.860 6.911 10.388
228 HA VAL 32 HA VAL 32 -6.315 4.490 11.198
229 HB VAL 32 HB VAL 32 -4.212 4.747 9.047
230 1HG1 VAL 32 1HG1 VAL 32 -5.212 2.509 10.321
231 2HG1 VAL 32 2HG1 VAL 32 -6.221 2.614 8.858
232 3HG1 VAL 32 3HG1 VAL 32 -4.448 2.538 8.714
233 1HG2 VAL 32 1HG2 VAL 32 -6.230 6.159 8.564
234 2HG2 VAL 32 2HG2 VAL 32 -5.955 4.847 7.393
235 3HG2 VAL 32 3HG2 VAL 32 -7.218 4.680 8.637
236 H LYS 33 H LYS 33 -5.354 3.131 12.655
237 HA LYS 33 HA LYS 33 -3.260 4.010 14.205
238 1HB LYS 33 1HB LYS 33 -4.204 1.163 13.751
239 2HB LYS 33 2HB LYS 33 -3.219 1.709 15.092
240 1HG LYS 33 1HG LYS 33 -5.141 3.448 15.521
241 2HG LYS 33 2HG LYS 33 -6.104 2.431 14.468
242 1HD LYS 33 1HD LYS 33 -5.188 0.473 16.052
243 2HD LYS 33 2HD LYS 33 -4.942 1.789 17.183
244 1HE LYS 33 1HE LYS 33 -7.562 2.104 15.990
245 2HE LYS 33 2HE LYS 33 -7.404 0.445 16.533
246 1HZ LYS 33 1HZ LYS 33 -6.406 2.381 18.385
247 2HZ LYS 33 2HZ LYS 33 -8.012 2.495 18.111
248 3HZ LYS 33 3HZ LYS 33 -7.373 1.091 18.646
249 H CYS 34 H CYS 34 -1.049 3.107 14.467
250 HA CYS 34 HA CYS 34 0.271 3.151 11.966
251 1HB CYS 34 2HB CYS 34 1.492 2.368 14.610
252 2HB CYS 34 1HB CYS 34 2.294 3.039 13.204
253 H ASP 35 H ASP 35 -0.615 0.672 14.429
254 HA ASP 35 HA ASP 35 0.830 -1.396 13.258
255 1HB ASP 35 1HB ASP 35 -0.740 -2.867 14.601
256 2HB ASP 35 2HB ASP 35 0.058 -1.619 15.536
257 H ASP 36 H ASP 36 -1.870 0.378 12.170
258 HA ASP 36 HA ASP 36 -3.497 -1.615 11.145
259 1HB ASP 36 1HB ASP 36 -3.784 1.017 11.372
260 2HB ASP 36 2HB ASP 36 -3.098 1.053 9.760
261 H CYS 37 H CYS 37 -0.342 -0.427 10.258
262 HA CYS 37 HA CYS 37 -0.526 -1.898 7.736
263 1HB CYS 37 1HB CYS 37 0.824 0.785 8.165
264 2HB CYS 37 2HB CYS 37 1.089 -0.228 6.760
265 H HIS 38 H HIS 38 1.563 -0.435 10.318
266 HA HIS 38 HA HIS 38 3.730 -2.184 9.684
267 1HB HIS 38 1HB HIS 38 3.290 -0.318 12.033
268 2HB HIS 38 2HB HIS 38 4.790 -1.147 11.666
269 HD1 HIS 38 HD1 HIS 38 5.832 -0.514 9.169
270 HD2 HIS 38 HD2 HIS 38 3.061 2.146 10.856
271 HE1 HIS 38 HE1 HIS 38 6.125 1.700 7.936
272 H HIS 39 H HIS 39 2.588 -4.258 9.820
273 HA HIS 39 HA HIS 39 1.731 -4.994 12.491
274 1HB HIS 39 2HB HIS 39 0.633 -6.806 11.515
275 2HB HIS 39 1HB HIS 39 0.416 -5.501 10.367
276 HD1 HIS 39 HD1 HIS 39 1.499 -8.962 10.574
277 HD2 HIS 39 HD2 HIS 39 2.390 -5.683 8.114
278 HE1 HIS 39 HE1 HIS 39 2.575 -9.920 8.468
279 H GLN 40 H GLN 40 4.460 -4.380 12.377
280 HA GLN 40 HA GLN 40 5.683 -7.023 12.308
281 1HB GLN 40 1HB GLN 40 6.772 -4.229 11.900
282 2HB GLN 40 2HB GLN 40 7.852 -5.511 12.410
283 1HG GLN 40 1HG GLN 40 7.513 -5.065 9.835
284 2HG GLN 40 2HG GLN 40 7.602 -6.718 10.411
285 2HE2 GLN 40 2HE2 GLN 40 5.816 -8.018 10.433
286 1HE2 GLN 40 1HE2 GLN 40 4.320 -7.625 9.653
287 HA PRO 41 HA PRO 41 6.206 -7.391 16.622
288 1HB PRO 41 1HB PRO 41 9.009 -7.840 16.697
289 2HB PRO 41 2HB PRO 41 7.736 -9.073 16.422
290 1HG PRO 41 2HG PRO 41 9.464 -7.952 14.039
291 2HG PRO 41 1HG PRO 41 8.706 -9.429 14.720
292 1HD PRO 41 1HD PRO 41 7.541 -7.639 12.834
293 2HD PRO 41 2HD PRO 41 6.645 -8.828 13.829
294 H GLY 42 H GLY 42 6.639 -5.994 18.396
295 1HA GLY 42 2HA GLY 42 7.442 -4.198 19.499
296 2HA GLY 42 1HA GLY 42 7.095 -3.344 18.008
297 H ASP 43 H ASP 43 9.566 -5.907 18.712
298 HA ASP 43 HA ASP 43 11.734 -4.493 19.171
299 1HB ASP 43 1HB ASP 43 11.607 -6.988 18.867
300 2HB ASP 43 2HB ASP 43 11.567 -6.761 17.130
301 H LYS 44 H LYS 44 9.918 -4.685 16.117
302 HA LYS 44 HA LYS 44 11.425 -2.473 15.070
303 1HB LYS 44 1HB LYS 44 12.080 -3.556 12.993
304 2HB LYS 44 2HB LYS 44 12.835 -4.343 14.364
305 1HG LYS 44 1HG LYS 44 10.994 -6.083 14.323
306 2HG LYS 44 2HG LYS 44 10.351 -5.324 12.881
307 1HD LYS 44 1HD LYS 44 12.802 -5.628 11.930
308 2HD LYS 44 2HD LYS 44 12.981 -6.797 13.224
309 1HE LYS 44 1HE LYS 44 11.181 -8.168 12.377
310 2HE LYS 44 2HE LYS 44 10.624 -6.905 11.297
311 1HZ LYS 44 1HZ LYS 44 13.322 -7.502 10.798
312 2HZ LYS 44 2HZ LYS 44 12.430 -8.868 10.726
313 3HZ LYS 44 3HZ LYS 44 12.047 -7.592 9.782
314 H GLN 45 H GLN 45 8.898 -2.349 16.003
315 HA GLN 45 HA GLN 45 6.806 -3.158 14.597
316 1HB GLN 45 1HB GLN 45 6.791 -1.639 16.607
317 2HB GLN 45 2HB GLN 45 7.193 -0.290 15.563
318 1HG GLN 45 1HG GLN 45 5.069 -0.157 14.683
319 2HG GLN 45 2HG GLN 45 4.867 -1.897 14.630
320 2HE2 GLN 45 2HE2 GLN 45 4.942 0.910 16.772
321 1HE2 GLN 45 1HE2 GLN 45 3.873 0.301 17.992
322 H TYR 46 H TYR 46 8.813 -0.298 13.816
323 HA TYR 46 HA TYR 46 7.514 -0.112 11.161
324 1HB TYR 46 2HB TYR 46 9.582 1.759 12.326
325 2HB TYR 46 1HB TYR 46 8.391 2.081 11.054
326 HD1 TYR 46 HD1 TYR 46 5.919 2.133 11.693
327 HD2 TYR 46 HD2 TYR 46 9.094 2.209 14.586
328 HE1 TYR 46 HE1 TYR 46 4.352 3.037 13.390
329 HE2 TYR 46 HE2 TYR 46 7.527 3.112 16.282
330 HH TYR 46 HH TYR 46 4.054 3.525 15.631
331 H ALA 47 H ALA 47 8.456 -1.713 9.836
332 HA ALA 47 HA ALA 47 11.333 -1.357 9.439
333 1HB ALA 47 1HB ALA 47 10.278 -3.503 10.842
334 2HB ALA 47 3HB ALA 47 10.403 -4.139 9.184
335 3HB ALA 47 2HB ALA 47 11.845 -3.488 9.998
336 H GLY 48 H GLY 48 11.815 -3.008 7.362
337 1HA GLY 48 2HA GLY 48 11.654 -2.951 5.105
338 2HA GLY 48 1HA GLY 48 10.369 -1.765 5.225
339 H CYS 49 H CYS 49 8.900 -2.695 3.768
340 HA CYS 49 HA CYS 49 7.442 -4.922 4.818
341 1HB CYS 49 2HB CYS 49 6.981 -3.536 2.178
342 2HB CYS 49 1HB CYS 49 5.841 -4.480 3.118
343 H THR 50 H THR 50 9.780 -4.169 2.216
344 HA THR 50 HA THR 50 9.489 -6.831 1.076
345 HB THR 50 HB THR 50 10.991 -5.902 -0.656
346 HG1 THR 50 HG1 THR 50 10.961 -3.451 0.901
347 1HG2 THR 50 1HG2 THR 50 8.752 -4.100 0.329
348 2HG2 THR 50 2HG2 THR 50 9.790 -3.566 -1.015
349 3HG2 THR 50 3HG2 THR 50 8.831 -5.058 -1.169
350 H THR 51 H THR 51 10.555 -6.197 3.907
351 HA THR 51 HA THR 51 13.318 -6.783 3.855
352 HB THR 51 HB THR 51 11.296 -7.291 6.093
353 HG1 THR 51 HG1 THR 51 11.945 -4.939 6.485
354 1HG2 THR 51 1HG2 THR 51 14.221 -7.231 5.896
355 2HG2 THR 51 2HG2 THR 51 13.637 -5.934 6.966
356 3HG2 THR 51 3HG2 THR 51 13.207 -7.628 7.304
357 H ASP 52 H ASP 52 14.401 -8.740 4.592
358 HA ASP 52 HA ASP 52 13.679 -10.898 3.102
359 1HB ASP 52 1HB ASP 52 15.918 -10.806 3.894
360 2HB ASP 52 2HB ASP 52 15.422 -10.530 5.552
361 H GLY 53 H GLY 53 12.847 -13.071 3.798
362 1HA GLY 53 2HA GLY 53 11.859 -13.667 6.328
363 2HA GLY 53 1HA GLY 53 11.358 -14.406 4.819
364 H CYS 54 H CYS 54 10.678 -11.408 3.950
365 HA CYS 54 HA CYS 54 8.034 -11.482 5.202
366 1HB CYS 54 2HB CYS 54 9.481 -8.910 4.518
367 2HB CYS 54 1HB CYS 54 7.969 -9.094 5.385
368 H HIS 55 H HIS 55 7.833 -8.851 3.357
369 HA HIS 55 HA HIS 55 6.911 -10.363 1.074
370 1HB HIS 55 2HB HIS 55 6.678 -7.383 1.518
371 2HB HIS 55 1HB HIS 55 5.720 -8.395 0.455
372 HD1 HIS 55 HD1 HIS 55 4.043 -10.138 1.692
373 HD2 HIS 55 HD2 HIS 55 5.690 -7.112 4.086
374 HE1 HIS 55 HE1 HIS 55 2.611 -10.035 3.801
375 H ASN 56 H ASN 56 9.667 -10.560 1.276
376 HA ASN 56 HA ASN 56 10.835 -8.476 -0.279
377 1HB ASN 56 1HB ASN 56 12.134 -9.663 1.495
378 2HB ASN 56 2HB ASN 56 11.925 -11.185 0.651
379 2HD2 ASN 56 2HD2 ASN 56 14.357 -9.798 1.387
380 1HD2 ASN 56 1HD2 ASN 56 15.261 -9.507 -0.062
381 H ILE 57 H ILE 57 9.056 -9.035 -2.043
382 HA ILE 57 HA ILE 57 10.262 -10.971 -3.877
383 HB ILE 57 HB ILE 57 7.306 -10.731 -3.306
384 1HG1 ILE 57 1HG1 ILE 57 8.880 -11.894 -1.582
385 2HG1 ILE 57 2HG1 ILE 57 7.385 -12.669 -2.068
386 1HG2 ILE 57 1HG2 ILE 57 8.900 -12.186 -5.384
387 2HG2 ILE 57 2HG2 ILE 57 7.401 -12.912 -4.757
388 3HG2 ILE 57 3HG2 ILE 57 7.358 -11.309 -5.530
389 1HD1 ILE 57 1HD1 ILE 57 9.776 -13.274 -3.765
390 2HD1 ILE 57 2HD1 ILE 57 9.787 -13.937 -2.113
391 3HD1 ILE 57 3HD1 ILE 57 8.461 -14.347 -3.228
392 H LEU 58 H LEU 58 11.048 -9.721 -5.490
393 HA LEU 58 HA LEU 58 9.452 -7.388 -6.256
394 1HB LEU 58 2HB LEU 58 12.340 -8.040 -6.858
395 2HB LEU 58 1HB LEU 58 11.497 -6.568 -7.295
396 HG LEU 58 HG LEU 58 12.233 -7.510 -4.517
397 1HD1 LEU 58 1HD1 LEU 58 13.988 -6.433 -5.963
398 2HD1 LEU 58 2HD1 LEU 58 12.997 -4.955 -5.943
399 3HD1 LEU 58 3HD1 LEU 58 13.655 -5.606 -4.423
400 1HD2 LEU 58 1HD2 LEU 58 10.521 -5.135 -5.299
401 2HD2 LEU 58 2HD2 LEU 58 10.003 -6.573 -4.387
402 3HD2 LEU 58 3HD2 LEU 58 11.179 -5.443 -3.674
403 H ASP 59 H ASP 59 8.764 -10.208 -6.920
404 HA ASP 59 HA ASP 59 9.155 -10.011 -9.804
405 1HB ASP 59 1HB ASP 59 9.642 -12.170 -8.000
406 2HB ASP 59 2HB ASP 59 8.203 -12.619 -8.895
407 H LYS 60 H LYS 60 7.201 -8.562 -9.809
408 HA LYS 60 HA LYS 60 4.780 -9.143 -8.683
409 1HB LYS 60 2HB LYS 60 3.850 -7.574 -10.212
410 2HB LYS 60 1HB LYS 60 5.471 -7.027 -9.831
411 1HG LYS 60 2HG LYS 60 5.998 -7.054 -12.033
412 2HG LYS 60 1HG LYS 60 5.720 -8.783 -12.080
413 1HD LYS 60 1HD LYS 60 3.159 -8.096 -12.227
414 2HD LYS 60 2HD LYS 60 3.789 -6.541 -12.731
415 1HE LYS 60 1HE LYS 60 5.270 -8.029 -14.392
416 2HE LYS 60 2HE LYS 60 4.010 -9.217 -14.122
417 1HZ LYS 60 1HZ LYS 60 2.732 -6.834 -14.564
418 2HZ LYS 60 2HZ LYS 60 3.915 -6.901 -15.688
419 3HZ LYS 60 3HZ LYS 60 2.820 -8.108 -15.583
420 H ALA 61 H ALA 61 2.917 -10.303 -9.289
421 HA ALA 61 HA ALA 61 1.691 -11.813 -10.377
422 1HB ALA 61 1HB ALA 61 3.433 -12.569 -12.574
423 2HB ALA 61 3HB ALA 61 1.851 -11.755 -12.618
424 3HB ALA 61 2HB ALA 61 3.340 -10.797 -12.435
425 H ASP 62 H ASP 62 3.307 -12.469 -8.205
426 HA ASP 62 HA ASP 62 4.478 -15.005 -9.013
427 1HB ASP 62 1HB ASP 62 5.826 -13.258 -7.678
428 2HB ASP 62 2HB ASP 62 4.755 -13.581 -6.330
429 H LYS 63 H LYS 63 4.283 -16.641 -6.909
430 HA LYS 63 HA LYS 63 1.495 -16.480 -5.998
431 1HB LYS 63 1HB LYS 63 2.080 -18.196 -7.855
432 2HB LYS 63 2HB LYS 63 2.895 -19.086 -6.585
433 1HG LYS 63 1HG LYS 63 0.496 -18.494 -5.347
434 2HG LYS 63 2HG LYS 63 -0.021 -18.642 -7.015
435 1HD LYS 63 1HD LYS 63 1.235 -20.874 -7.110
436 2HD LYS 63 2HD LYS 63 1.489 -20.732 -5.382
437 1HE LYS 63 1HE LYS 63 -0.587 -21.550 -4.982
438 2HE LYS 63 2HE LYS 63 -1.305 -20.231 -5.885
439 1HZ LYS 63 1HZ LYS 63 -0.172 -22.585 -7.214
440 2HZ LYS 63 2HZ LYS 63 -1.732 -22.518 -6.737
441 3HZ LYS 63 3HZ LYS 63 -1.172 -21.462 -7.849
442 H SER 64 H SER 64 2.198 -15.424 -4.054
443 HA SER 64 HA SER 64 2.776 -17.215 -2.021
444 1HB SER 64 1HB SER 64 5.097 -16.799 -3.261
445 2HB SER 64 2HB SER 64 5.089 -15.300 -2.354
446 HG SER 64 HG SER 64 4.474 -17.651 -0.887
447 H VAL 65 H VAL 65 2.746 -16.115 0.119
448 HA VAL 65 HA VAL 65 1.212 -13.695 -0.032
449 HB VAL 65 HB VAL 65 0.551 -15.401 1.501
450 1HG1 VAL 65 1HG1 VAL 65 3.412 -15.568 2.050
451 2HG1 VAL 65 2HG1 VAL 65 2.444 -15.503 3.542
452 3HG1 VAL 65 3HG1 VAL 65 2.123 -16.763 2.327
453 1HG2 VAL 65 1HG2 VAL 65 0.722 -12.799 2.162
454 2HG2 VAL 65 2HG2 VAL 65 0.035 -14.032 3.245
455 3HG2 VAL 65 3HG2 VAL 65 1.716 -13.491 3.466
456 H ASN 66 H ASN 66 4.437 -14.270 -0.404
457 HA ASN 66 HA ASN 66 5.285 -12.112 1.314
458 1HB ASN 66 1HB ASN 66 6.886 -13.905 -0.588
459 2HB ASN 66 2HB ASN 66 7.587 -12.757 0.535
460 2HD2 ASN 66 2HD2 ASN 66 8.703 -14.242 1.708
461 1HD2 ASN 66 1HD2 ASN 66 7.974 -15.410 2.759
462 H SER 67 H SER 67 3.605 -12.113 -1.399
463 HA SER 67 HA SER 67 5.335 -10.746 -3.187
464 1HB SER 67 1HB SER 67 3.040 -10.312 -4.372
465 2HB SER 67 2HB SER 67 3.661 -11.949 -4.301
466 HG SER 67 HG SER 67 1.419 -11.874 -3.693
467 H TRP 68 H TRP 68 5.566 -8.517 -3.474
468 HA TRP 68 HA TRP 68 4.283 -6.866 -1.448
469 1HB TRP 68 1HB TRP 68 6.575 -6.510 -1.474
470 2HB TRP 68 2HB TRP 68 6.682 -6.578 -3.222
471 HD1 TRP 68 HD1 TRP 68 6.896 -4.234 -4.355
472 HE1 TRP 68 HE1 TRP 68 6.422 -1.704 -3.770
473 HE3 TRP 68 HE3 TRP 68 4.725 -5.137 0.154
474 HZ2 TRP 68 HZ2 TRP 68 5.219 -0.395 -1.538
475 HZ3 TRP 68 HZ3 TRP 68 3.929 -3.177 1.473
476 HH2 TRP 68 HH2 TRP 68 4.147 -0.871 0.695
477 H TYR 69 H TYR 69 3.214 -8.135 -4.099
478 HA TYR 69 HA TYR 69 2.097 -5.607 -5.221
479 1HB TYR 69 1HB TYR 69 3.503 -6.665 -6.858
480 2HB TYR 69 2HB TYR 69 2.778 -8.250 -6.541
481 HD1 TYR 69 HD1 TYR 69 0.292 -8.567 -7.092
482 HD2 TYR 69 HD2 TYR 69 2.621 -5.248 -8.511
483 HE1 TYR 69 HE1 TYR 69 -1.375 -8.164 -8.884
484 HE2 TYR 69 HE2 TYR 69 0.954 -4.845 -10.303
485 HH TYR 69 HH TYR 69 -2.140 -6.381 -10.400
486 H LYS 70 H LYS 70 1.436 -8.403 -3.356
487 HA LYS 70 HA LYS 70 -1.320 -8.503 -4.325
488 1HB LYS 70 1HB LYS 70 -0.058 -10.626 -4.174
489 2HB LYS 70 2HB LYS 70 0.171 -10.369 -2.456
490 1HG LYS 70 1HG LYS 70 -2.182 -10.561 -1.996
491 2HG LYS 70 2HG LYS 70 -2.612 -10.370 -3.684
492 1HD LYS 70 1HD LYS 70 -2.252 -12.583 -4.161
493 2HD LYS 70 2HD LYS 70 -0.782 -12.651 -3.209
494 1HE LYS 70 2HE LYS 70 -3.652 -12.946 -2.246
495 2HE LYS 70 1HE LYS 70 -2.336 -14.091 -2.083
496 1HZ LYS 70 1HZ LYS 70 -1.301 -12.080 -0.794
497 2HZ LYS 70 2HZ LYS 70 -2.871 -11.705 -0.547
498 3HZ LYS 70 3HZ LYS 70 -2.290 -13.150 -0.057
499 H VAL 71 H VAL 71 0.696 -7.977 -1.376
500 HA VAL 71 HA VAL 71 -1.488 -7.493 0.323
501 HB VAL 71 HB VAL 71 0.224 -6.522 1.801
502 1HG1 VAL 71 1HG1 VAL 71 0.670 -9.173 0.451
503 2HG1 VAL 71 2HG1 VAL 71 1.797 -8.615 1.710
504 3HG1 VAL 71 3HG1 VAL 71 0.070 -8.818 2.088
505 1HG2 VAL 71 1HG2 VAL 71 1.615 -6.087 -0.664
506 2HG2 VAL 71 2HG2 VAL 71 2.062 -5.567 0.979
507 3HG2 VAL 71 3HG2 VAL 71 2.606 -7.148 0.367
508 H VAL 72 H VAL 72 -0.345 -5.775 -2.377
509 HA VAL 72 HA VAL 72 -1.227 -3.213 -1.273
510 HB VAL 72 HB VAL 72 0.341 -3.967 -3.744
511 1HG1 VAL 72 1HG1 VAL 72 -1.089 -1.471 -3.033
512 2HG1 VAL 72 2HG1 VAL 72 0.594 -1.264 -3.575
513 3HG1 VAL 72 3HG1 VAL 72 -0.582 -2.096 -4.621
514 1HG2 VAL 72 1HG2 VAL 72 1.445 -4.007 -1.434
515 2HG2 VAL 72 2HG2 VAL 72 2.224 -3.011 -2.685
516 3HG2 VAL 72 3HG2 VAL 72 1.232 -2.240 -1.424
517 H HIS 73 H HIS 73 -1.706 -5.489 -4.048
518 HA HIS 73 HA HIS 73 -4.201 -4.074 -4.605
519 1HB HIS 73 1HB HIS 73 -2.732 -6.073 -6.342
520 2HB HIS 73 2HB HIS 73 -4.121 -5.108 -6.798
521 HD1 HIS 73 HD1 HIS 73 -0.404 -4.867 -6.199
522 HD2 HIS 73 HD2 HIS 73 -3.567 -2.422 -7.471
523 HE1 HIS 73 HE1 HIS 73 0.664 -2.756 -7.155
524 H ASP 74 H ASP 74 -3.891 -5.809 -2.273
525 HA ASP 74 HA ASP 74 -5.085 -8.289 -3.017
526 1HB ASP 74 1HB ASP 74 -3.816 -7.104 -0.667
527 2HB ASP 74 2HB ASP 74 -5.327 -7.862 -0.205
528 H ALA 75 H ALA 75 -7.280 -8.254 -3.556
529 HA ALA 75 HA ALA 75 -8.980 -6.213 -2.420
530 1HB ALA 75 1HB ALA 75 -9.220 -8.332 -4.561
531 2HB ALA 75 3HB ALA 75 -10.670 -7.513 -3.933
532 3HB ALA 75 2HB ALA 75 -9.377 -6.565 -4.705
533 H LYS 76 H LYS 76 -8.043 -9.536 -1.836
534 HA LYS 76 HA LYS 76 -10.452 -10.237 -0.461
535 1HB LYS 76 1HB LYS 76 -8.752 -11.764 -1.701
536 2HB LYS 76 2HB LYS 76 -7.813 -11.675 -0.224
537 1HG LYS 76 1HG LYS 76 -10.041 -12.322 0.995
538 2HG LYS 76 2HG LYS 76 -10.622 -12.781 -0.593
539 1HD LYS 76 2HD LYS 76 -9.712 -14.807 0.138
540 2HD LYS 76 1HD LYS 76 -8.354 -14.142 -0.748
541 1HE LYS 76 1HE LYS 76 -7.469 -13.179 1.426
542 2HE LYS 76 2HE LYS 76 -8.778 -13.976 2.274
543 1HZ LYS 76 1HZ LYS 76 -7.448 -15.782 0.578
544 2HZ LYS 76 2HZ LYS 76 -6.382 -15.070 1.589
545 3HZ LYS 76 3HZ LYS 76 -7.674 -15.865 2.193
546 H GLY 77 H GLY 77 -10.602 -10.675 1.860
547 1HA GLY 77 2HA GLY 77 -10.419 -8.933 3.657
548 2HA GLY 77 1HA GLY 77 -8.685 -9.075 3.445
549 H GLY 78 H GLY 78 -8.590 -9.723 5.742
550 1HA GLY 78 2HA GLY 78 -8.377 -12.496 6.082
551 2HA GLY 78 1HA GLY 78 -9.913 -11.986 6.753
552 H ALA 79 H ALA 79 -6.359 -11.420 6.865
553 HA ALA 79 HA ALA 79 -6.488 -11.087 9.696
554 1HB ALA 79 1HB ALA 79 -4.100 -11.079 9.566
555 2HB ALA 79 3HB ALA 79 -4.124 -10.606 7.850
556 3HB ALA 79 2HB ALA 79 -4.657 -12.234 8.332
557 H LYS 80 H LYS 80 -5.736 -8.974 6.849
558 HA LYS 80 HA LYS 80 -6.751 -6.716 8.296
559 1HB LYS 80 1HB LYS 80 -4.445 -5.516 7.684
560 2HB LYS 80 2HB LYS 80 -4.742 -6.264 9.240
561 1HG LYS 80 1HG LYS 80 -3.677 -8.381 8.420
562 2HG LYS 80 2HG LYS 80 -3.369 -7.621 6.871
563 1HD LYS 80 1HD LYS 80 -2.221 -6.778 9.571
564 2HD LYS 80 2HD LYS 80 -1.339 -7.504 8.242
565 1HE LYS 80 1HE LYS 80 -1.963 -5.490 6.813
566 2HE LYS 80 2HE LYS 80 -2.675 -4.756 8.236
567 1HZ LYS 80 1HZ LYS 80 0.034 -5.739 8.479
568 2HZ LYS 80 2HZ LYS 80 -0.188 -4.386 7.591
569 3HZ LYS 80 3HZ LYS 80 -0.660 -4.424 9.154
570 HA PRO 81 HA PRO 81 -7.642 -5.479 4.190
571 1HB PRO 81 1HB PRO 81 -7.962 -2.794 4.474
572 2HB PRO 81 2HB PRO 81 -9.025 -3.961 5.327
573 1HG PRO 81 1HG PRO 81 -6.775 -2.639 6.063
574 2HG PRO 81 2HG PRO 81 -8.078 -2.616 7.296
575 1HD PRO 81 1HD PRO 81 -5.967 -4.220 7.664
576 2HD PRO 81 2HD PRO 81 -7.602 -4.908 7.906
577 H THR 82 H THR 82 -6.886 -3.845 2.382
578 HA THR 82 HA THR 82 -4.006 -3.339 2.738
579 HB THR 82 HB THR 82 -3.803 -4.041 0.316
580 HG1 THR 82 HG1 THR 82 -6.504 -5.038 0.818
581 1HG2 THR 82 1HG2 THR 82 -4.291 -5.779 2.556
582 2HG2 THR 82 2HG2 THR 82 -5.183 -6.446 1.168
583 3HG2 THR 82 3HG2 THR 82 -3.428 -6.170 1.049
584 H CYS 83 H CYS 83 -3.657 -2.129 0.172
585 HA CYS 83 HA CYS 83 -4.661 0.453 0.856
586 1HB CYS 83 1HB CYS 83 -3.240 -0.170 -1.712
587 2HB CYS 83 2HB CYS 83 -3.220 1.301 -0.760
588 H ILE 84 H ILE 84 -6.087 -2.211 -0.502
589 HA ILE 84 HA ILE 84 -7.642 -0.598 -2.403
590 HB ILE 84 HB ILE 84 -6.709 -3.432 -2.428
591 1HG1 ILE 84 1HG1 ILE 84 -5.493 -1.738 -3.705
592 2HG1 ILE 84 2HG1 ILE 84 -6.232 -2.927 -4.759
593 1HG2 ILE 84 1HG2 ILE 84 -9.406 -2.510 -3.232
594 2HG2 ILE 84 2HG2 ILE 84 -8.533 -3.515 -4.413
595 3HG2 ILE 84 3HG2 ILE 84 -8.827 -4.128 -2.768
596 1HD1 ILE 84 1HD1 ILE 84 -8.244 -1.249 -4.894
597 2HD1 ILE 84 2HD1 ILE 84 -7.081 -0.059 -4.262
598 3HD1 ILE 84 3HD1 ILE 84 -6.764 -0.878 -5.810
599 H SER 85 H SER 85 -7.760 -3.167 0.139
600 HA SER 85 HA SER 85 -10.456 -3.460 0.251
601 1HB SER 85 1HB SER 85 -8.533 -4.658 1.548
602 2HB SER 85 2HB SER 85 -8.731 -3.398 2.750
603 HG SER 85 HG SER 85 -10.297 -4.625 3.531
604 H CYS 86 H CYS 86 -8.418 -1.248 2.312
605 HA CYS 86 HA CYS 86 -10.585 0.013 3.511
606 1HB CYS 86 1HB CYS 86 -8.044 0.010 4.126
607 2HB CYS 86 2HB CYS 86 -7.949 1.405 3.070
608 H HIS 87 H HIS 87 -8.370 1.154 0.847
609 HA HIS 87 HA HIS 87 -9.650 3.450 0.210
610 1HB HIS 87 1HB HIS 87 -8.096 1.453 -1.413
611 2HB HIS 87 2HB HIS 87 -8.823 2.837 -2.205
612 HD1 HIS 87 HD1 HIS 87 -6.535 3.924 -2.748
613 HD2 HIS 87 HD2 HIS 87 -7.203 3.314 1.348
614 HE1 HIS 87 HE1 HIS 87 -4.715 5.229 -1.525
615 H LYS 88 H LYS 88 -10.659 0.107 -0.436
616 HA LYS 88 HA LYS 88 -12.602 0.781 -2.383
617 1HB LYS 88 1HB LYS 88 -11.869 -1.640 -0.786
618 2HB LYS 88 2HB LYS 88 -13.452 -1.595 -1.535
619 1HG LYS 88 1HG LYS 88 -10.940 -0.919 -3.114
620 2HG LYS 88 2HG LYS 88 -11.472 -2.577 -2.921
621 1HD LYS 88 1HD LYS 88 -13.752 -0.952 -3.684
622 2HD LYS 88 2HD LYS 88 -12.434 -0.622 -4.790
623 1HE LYS 88 1HE LYS 88 -12.964 -3.507 -4.103
624 2HE LYS 88 2HE LYS 88 -14.122 -2.705 -5.145
625 1HZ LYS 88 1HZ LYS 88 -11.380 -2.239 -5.829
626 2HZ LYS 88 2HZ LYS 88 -11.861 -3.790 -5.993
627 3HZ LYS 88 3HZ LYS 88 -12.648 -2.603 -6.792
628 H ASP 89 H ASP 89 -12.728 0.084 1.173
629 HA ASP 89 HA ASP 89 -15.423 0.344 1.460
630 1HB ASP 89 1HB ASP 89 -13.404 -0.192 3.146
631 2HB ASP 89 2HB ASP 89 -13.571 1.505 3.547
632 H LYS 90 H LYS 90 -12.794 2.801 1.324
633 HA LYS 90 HA LYS 90 -14.249 5.004 2.192
634 1HB LYS 90 1HB LYS 90 -11.718 4.494 0.753
635 2HB LYS 90 2HB LYS 90 -12.436 6.060 0.437
636 1HG LYS 90 1HG LYS 90 -12.008 4.946 3.248
637 2HG LYS 90 2HG LYS 90 -10.853 5.985 2.437
638 1HD LYS 90 1HD LYS 90 -12.322 7.855 2.447
639 2HD LYS 90 2HD LYS 90 -13.747 6.860 2.673
640 1HE LYS 90 1HE LYS 90 -11.555 7.327 4.751
641 2HE LYS 90 2HE LYS 90 -13.151 8.049 4.771
642 1HZ LYS 90 1HZ LYS 90 -13.708 5.449 4.564
643 2HZ LYS 90 2HZ LYS 90 -12.361 5.403 5.488
644 3HZ LYS 90 3HZ LYS 90 -13.656 6.271 5.974
645 H ALA 91 H ALA 91 -13.918 3.473 -1.049
646 HA ALA 91 HA ALA 91 -15.559 5.504 -2.258
647 1HB ALA 91 1HB ALA 91 -15.191 3.080 -3.822
648 2HB ALA 91 3HB ALA 91 -14.583 4.725 -4.127
649 3HB ALA 91 2HB ALA 91 -13.650 3.606 -3.104
650 H GLY 92 H GLY 92 -15.939 1.913 -2.456
651 1HA GLY 92 2HA GLY 92 -18.169 1.474 -0.993
652 2HA GLY 92 1HA GLY 92 -17.826 0.672 -2.513
653 H ASP 93 H ASP 93 -18.910 1.290 -4.435
654 HA ASP 93 HA ASP 93 -20.815 1.830 -5.413
655 1HB ASP 93 2HB ASP 93 -22.630 2.592 -4.237
656 2HB ASP 93 1HB ASP 93 -21.613 2.283 -2.844
657 H ASP 94 H ASP 94 -19.288 4.537 -3.518
658 HA ASP 94 HA ASP 94 -19.845 6.570 -5.241
659 1HB ASP 94 1HB ASP 94 -18.739 6.642 -2.920
660 2HB ASP 94 2HB ASP 94 -17.228 6.235 -3.708
661 H LYS 95 H LYS 95 -19.521 6.102 -7.483
662 HA LYS 95 HA LYS 95 -17.200 4.781 -8.415
663 1HB LYS 95 1HB LYS 95 -19.495 6.241 -9.714
664 2HB LYS 95 2HB LYS 95 -18.124 5.704 -10.664
665 1HG LYS 95 1HG LYS 95 -19.071 3.600 -8.832
666 2HG LYS 95 2HG LYS 95 -20.345 4.147 -9.903
667 1HD LYS 95 1HD LYS 95 -19.447 2.847 -11.530
668 2HD LYS 95 2HD LYS 95 -18.077 3.939 -11.577
669 1HE LYS 95 2HE LYS 95 -16.756 2.256 -10.825
670 2HE LYS 95 1HE LYS 95 -17.629 2.286 -9.306
671 1HZ LYS 95 1HZ LYS 95 -18.633 0.823 -11.638
672 2HZ LYS 95 2HZ LYS 95 -17.627 0.139 -10.547
673 3HZ LYS 95 3HZ LYS 95 -19.099 0.669 -10.080
674 H GLU 96 H GLU 96 -18.151 8.183 -7.890
675 HA GLU 96 HA GLU 96 -16.052 9.265 -9.382
676 1HB GLU 96 1HB GLU 96 -17.647 10.438 -7.061
677 2HB GLU 96 2HB GLU 96 -16.588 11.367 -8.104
678 1HG GLU 96 1HG GLU 96 -17.987 11.101 -9.995
679 2HG GLU 96 2HG GLU 96 -18.755 9.661 -9.355
680 H LEU 97 H LEU 97 -16.321 7.945 -6.106
681 HA LEU 97 HA LEU 97 -13.695 9.015 -5.424
682 1HB LEU 97 1HB LEU 97 -15.737 9.132 -3.898
683 2HB LEU 97 2HB LEU 97 -15.540 7.405 -3.670
684 HG LEU 97 HG LEU 97 -14.539 8.590 -1.826
685 1HD1 LEU 97 1HD1 LEU 97 -13.384 6.549 -3.085
686 2HD1 LEU 97 2HD1 LEU 97 -12.085 7.748 -3.291
687 3HD1 LEU 97 3HD1 LEU 97 -12.656 7.326 -1.659
688 1HD2 LEU 97 1HD2 LEU 97 -13.658 10.408 -3.875
689 2HD2 LEU 97 2HD2 LEU 97 -13.673 10.612 -2.107
690 3HD2 LEU 97 3HD2 LEU 97 -12.268 9.865 -2.905
691 H LYS 98 H LYS 98 -15.289 6.189 -6.678
692 HA LYS 98 HA LYS 98 -13.191 4.407 -5.794
693 1HB LYS 98 1HB LYS 98 -15.586 3.718 -5.882
694 2HB LYS 98 2HB LYS 98 -15.553 3.895 -7.625
695 1HG LYS 98 1HG LYS 98 -13.280 2.287 -6.712
696 2HG LYS 98 2HG LYS 98 -14.786 1.612 -6.123
697 1HD LYS 98 1HD LYS 98 -15.603 2.034 -8.632
698 2HD LYS 98 2HD LYS 98 -13.885 2.030 -8.980
699 1HE LYS 98 1HE LYS 98 -14.681 -0.246 -9.253
700 2HE LYS 98 2HE LYS 98 -13.702 -0.209 -7.800
701 1HZ LYS 98 1HZ LYS 98 -16.443 0.385 -7.317
702 2HZ LYS 98 2HZ LYS 98 -16.221 -1.107 -7.944
703 3HZ LYS 98 3HZ LYS 98 -15.462 -0.681 -6.563
704 H LYS 99 H LYS 99 -12.664 6.842 -7.541
705 HA LYS 99 HA LYS 99 -11.208 5.357 -9.588
706 1HB LYS 99 1HB LYS 99 -13.303 7.430 -10.053
707 2HB LYS 99 2HB LYS 99 -11.863 7.510 -11.048
708 1HG LYS 99 1HG LYS 99 -12.869 4.749 -10.774
709 2HG LYS 99 2HG LYS 99 -14.071 5.823 -11.460
710 1HD LYS 99 1HD LYS 99 -12.671 6.418 -13.304
711 2HD LYS 99 2HD LYS 99 -11.219 5.851 -12.504
712 1HE LYS 99 1HE LYS 99 -11.545 4.010 -13.854
713 2HE LYS 99 2HE LYS 99 -12.593 3.509 -12.542
714 1HZ LYS 99 1HZ LYS 99 -14.249 4.997 -13.950
715 2HZ LYS 99 2HZ LYS 99 -13.292 4.461 -15.160
716 3HZ LYS 99 3HZ LYS 99 -14.066 3.394 -14.197
717 H LYS 100 H LYS 100 -10.079 6.076 -7.211
718 HA LYS 100 HA LYS 100 -8.076 7.880 -8.081
719 1HB LYS 100 1HB LYS 100 -8.538 9.418 -5.991
720 2HB LYS 100 2HB LYS 100 -9.286 9.741 -7.542
721 1HG LYS 100 1HG LYS 100 -11.321 8.452 -6.803
722 2HG LYS 100 2HG LYS 100 -10.574 8.201 -5.238
723 1HD LYS 100 1HD LYS 100 -12.082 10.109 -5.065
724 2HD LYS 100 2HD LYS 100 -10.437 10.696 -4.925
725 1HE LYS 100 1HE LYS 100 -10.445 11.355 -7.326
726 2HE LYS 100 2HE LYS 100 -12.065 10.714 -7.513
727 1HZ LYS 100 1HZ LYS 100 -11.372 12.845 -5.614
728 2HZ LYS 100 2HZ LYS 100 -11.978 13.113 -7.107
729 3HZ LYS 100 3HZ LYS 100 -12.873 12.324 -5.992
730 H LEU 101 H LEU 101 -9.731 6.316 -5.271
731 HA LEU 101 HA LEU 101 -7.154 5.859 -4.031
732 1HB LEU 101 1HB LEU 101 -9.863 4.948 -3.077
733 2HB LEU 101 2HB LEU 101 -8.387 5.109 -2.146
734 HG LEU 101 HG LEU 101 -10.159 7.305 -3.224
735 1HD1 LEU 101 1HD1 LEU 101 -10.585 6.070 -0.996
736 2HD1 LEU 101 2HD1 LEU 101 -9.175 6.977 -0.398
737 3HD1 LEU 101 3HD1 LEU 101 -10.602 7.850 -1.006
738 1HD2 LEU 101 1HD2 LEU 101 -7.271 7.385 -2.677
739 2HD2 LEU 101 2HD2 LEU 101 -8.305 8.505 -3.596
740 3HD2 LEU 101 3HD2 LEU 101 -8.216 8.628 -1.823
741 H THR 102 H THR 102 -9.588 4.208 -6.001
742 HA THR 102 HA THR 102 -7.946 1.768 -5.807
743 HB THR 102 HB THR 102 -10.018 0.495 -6.030
744 HG1 THR 102 HG1 THR 102 -11.409 1.667 -7.317
745 1HG2 THR 102 1HG2 THR 102 -9.595 1.591 -3.719
746 2HG2 THR 102 2HG2 THR 102 -10.765 2.836 -4.216
747 3HG2 THR 102 3HG2 THR 102 -11.280 1.139 -4.070
748 H GLY 103 H GLY 103 -8.653 4.417 -7.694
749 1HA GLY 103 2HA GLY 103 -8.230 4.865 -9.858
750 2HA GLY 103 1HA GLY 103 -9.268 3.497 -10.205
751 H CYS 104 H CYS 104 -8.337 2.044 -11.568
752 HA CYS 104 HA CYS 104 -5.847 0.889 -10.939
753 1HB CYS 104 1HB CYS 104 -7.937 0.553 -12.991
754 2HB CYS 104 2HB CYS 104 -6.319 0.145 -13.526
755 H LYS 105 H LYS 105 -7.035 3.125 -13.549
756 HA LYS 105 HA LYS 105 -4.244 3.974 -13.893
757 1HB LYS 105 1HB LYS 105 -4.727 4.307 -16.285
758 2HB LYS 105 2HB LYS 105 -4.859 2.628 -15.803
759 1HG LYS 105 1HG LYS 105 -7.209 2.613 -15.972
760 2HG LYS 105 2HG LYS 105 -7.347 4.342 -15.719
761 1HD LYS 105 1HD LYS 105 -7.295 4.731 -17.953
762 2HD LYS 105 2HD LYS 105 -5.773 3.878 -18.112
763 1HE LYS 105 1HE LYS 105 -8.532 2.561 -18.063
764 2HE LYS 105 2HE LYS 105 -7.572 2.841 -19.502
765 1HZ LYS 105 1HZ LYS 105 -5.807 1.525 -18.240
766 2HZ LYS 105 2HZ LYS 105 -7.040 1.001 -17.305
767 3HZ LYS 105 3HZ LYS 105 -7.051 0.706 -18.911
768 H GLY 106 H GLY 106 -3.873 6.139 -13.685
769 1HA GLY 106 2HA GLY 106 -5.926 8.075 -14.194
770 2HA GLY 106 1HA GLY 106 -4.305 8.362 -13.595
771 H SER 107 H SER 107 -4.267 6.714 -11.271
772 HA SER 107 HA SER 107 -6.420 7.924 -9.720
773 1HB SER 107 1HB SER 107 -6.381 6.052 -8.252
774 2HB SER 107 2HB SER 107 -6.280 5.362 -9.859
775 HG SER 107 HG SER 107 -4.599 4.332 -8.969
776 H ALA 108 H ALA 108 -5.579 7.960 -7.192
777 HA ALA 108 HA ALA 108 -3.475 9.863 -7.210
778 1HB ALA 108 1HB ALA 108 -4.141 10.267 -5.043
779 2HB ALA 108 3HB ALA 108 -5.606 9.446 -5.635
780 3HB ALA 108 2HB ALA 108 -4.402 8.542 -4.685
781 H CYS 109 H CYS 109 -3.480 6.493 -7.468
782 HA CYS 109 HA CYS 109 -0.975 6.251 -5.988
783 1HB CYS 109 1HB CYS 109 -2.925 4.166 -7.007
784 2HB CYS 109 2HB CYS 109 -1.341 3.764 -6.376
785 H HIS 110 H HIS 110 -2.594 5.636 -9.172
786 HA HIS 110 HA HIS 110 0.085 5.585 -10.362
787 1HB HIS 110 1HB HIS 110 -2.428 4.170 -11.295
788 2HB HIS 110 2HB HIS 110 -0.903 4.191 -12.157
789 HD1 HIS 110 HD1 HIS 110 1.171 3.485 -10.119
790 HD2 HIS 110 HD2 HIS 110 -2.639 1.729 -10.113
791 HE1 HIS 110 HE1 HIS 110 1.400 1.284 -8.849
792 HA PRO 111 HA PRO 111 -1.943 9.248 -12.113
793 1HB PRO 111 1HB PRO 111 -0.129 11.108 -11.396
794 2HB PRO 111 2HB PRO 111 -1.222 10.385 -10.171
795 1HG PRO 111 2HG PRO 111 1.438 9.686 -11.059
796 2HG PRO 111 1HG PRO 111 1.268 9.723 -9.274
797 1HD PRO 111 1HD PRO 111 1.297 7.367 -10.613
798 2HD PRO 111 2HD PRO 111 0.133 7.614 -9.276
799 H SER 112 H SER 112 -1.276 7.779 -14.092
800 HA SER 112 HA SER 112 0.709 9.300 -15.507
801 1HB SER 112 1HB SER 112 1.211 6.608 -14.488
802 2HB SER 112 2HB SER 112 1.288 6.621 -16.238
803 HG SER 112 HG SER 112 3.247 7.300 -14.684
No H/Q in entry = 803
Start of MODEL 8
1 H1 VAL 1 H1 VAL 1 6.756 7.964 16.439
2 H2 VAL 1 H2 VAL 1 7.272 7.247 17.840
3 H3 VAL 1 H3 VAL 1 7.206 8.898 17.730
4 HA VAL 1 HA VAL 1 9.417 8.233 17.584
5 HB VAL 1 HB VAL 1 10.087 6.404 16.521
6 1HG1 VAL 1 1HG1 VAL 1 7.851 5.741 17.566
7 2HG1 VAL 1 2HG1 VAL 1 7.190 5.775 15.913
8 3HG1 VAL 1 3HG1 VAL 1 8.509 4.652 16.321
9 1HG2 VAL 1 1HG2 VAL 1 8.435 7.406 14.200
10 2HG2 VAL 1 2HG2 VAL 1 10.205 7.284 14.349
11 3HG2 VAL 1 3HG2 VAL 1 9.224 5.811 14.163
12 H ASP 2 H ASP 2 7.013 9.878 16.127
13 HA ASP 2 HA ASP 2 7.110 11.823 15.105
14 1HB ASP 2 2HB ASP 2 9.880 11.364 13.983
15 2HB ASP 2 1HB ASP 2 9.116 12.878 14.425
16 H VAL 3 H VAL 3 5.566 10.832 13.607
17 HA VAL 3 HA VAL 3 6.222 9.134 11.536
18 HB VAL 3 HB VAL 3 3.963 10.063 12.563
19 1HG1 VAL 3 1HG1 VAL 3 4.214 12.338 11.689
20 2HG1 VAL 3 2HG1 VAL 3 4.281 11.704 10.027
21 3HG1 VAL 3 3HG1 VAL 3 2.789 11.540 10.982
22 1HG2 VAL 3 1HG2 VAL 3 4.274 9.126 9.690
23 2HG2 VAL 3 2HG2 VAL 3 4.158 8.091 11.134
24 3HG2 VAL 3 3HG2 VAL 3 2.767 9.085 10.637
25 HA PRO 4 HA PRO 4 9.013 11.440 9.029
26 1HB PRO 4 1HB PRO 4 7.650 9.719 6.934
27 2HB PRO 4 2HB PRO 4 9.391 10.011 7.253
28 1HG PRO 4 1HG PRO 4 8.317 7.746 8.148
29 2HG PRO 4 2HG PRO 4 9.604 8.600 9.061
30 1HD PRO 4 2HD PRO 4 6.637 8.390 9.582
31 2HD PRO 4 1HD PRO 4 7.976 8.653 10.740
32 H ALA 5 H ALA 5 8.831 12.881 7.013
33 HA ALA 5 HA ALA 5 6.322 14.286 7.165
34 1HB ALA 5 1HB ALA 5 7.531 16.047 6.378
35 2HB ALA 5 3HB ALA 5 8.359 15.062 5.149
36 3HB ALA 5 2HB ALA 5 8.929 15.044 6.835
37 H ASP 6 H ASP 6 4.916 14.697 5.348
38 HA ASP 6 HA ASP 6 4.322 12.465 3.898
39 1HB ASP 6 1HB ASP 6 2.655 13.773 2.889
40 2HB ASP 6 2HB ASP 6 2.978 14.675 4.356
41 H GLY 7 H GLY 7 3.963 13.365 1.176
42 1HA GLY 7 2HA GLY 7 6.268 14.477 0.010
43 2HA GLY 7 1HA GLY 7 5.022 13.547 -0.799
44 H ALA 8 H ALA 8 5.192 11.047 0.516
45 HA ALA 8 HA ALA 8 7.988 10.258 0.175
46 1HB ALA 8 1HB ALA 8 5.581 8.938 1.485
47 2HB ALA 8 3HB ALA 8 7.021 9.608 2.287
48 3HB ALA 8 2HB ALA 8 7.161 8.142 1.288
49 H LYS 9 H LYS 9 8.628 8.793 -1.410
50 HA LYS 9 HA LYS 9 6.511 8.071 -3.315
51 1HB LYS 9 1HB LYS 9 9.421 8.778 -3.763
52 2HB LYS 9 2HB LYS 9 8.420 8.022 -4.986
53 1HG LYS 9 1HG LYS 9 6.990 9.904 -5.176
54 2HG LYS 9 2HG LYS 9 7.417 10.518 -3.592
55 1HD LYS 9 1HD LYS 9 9.621 11.212 -4.357
56 2HD LYS 9 2HD LYS 9 9.431 10.358 -5.876
57 1HE LYS 9 1HE LYS 9 7.371 12.450 -5.188
58 2HE LYS 9 2HE LYS 9 8.964 13.007 -5.662
59 1HZ LYS 9 1HZ LYS 9 8.278 11.030 -7.434
60 2HZ LYS 9 2HZ LYS 9 6.939 11.951 -7.274
61 3HZ LYS 9 3HZ LYS 9 8.351 12.634 -7.727
62 H ILE 10 H ILE 10 6.292 5.934 -3.932
63 HA ILE 10 HA ILE 10 8.132 4.081 -2.584
64 HB ILE 10 HB ILE 10 5.226 3.640 -3.274
65 1HG1 ILE 10 1HG1 ILE 10 6.225 3.937 -0.463
66 2HG1 ILE 10 2HG1 ILE 10 5.929 5.382 -1.410
67 1HG2 ILE 10 1HG2 ILE 10 7.382 1.876 -2.460
68 2HG2 ILE 10 2HG2 ILE 10 6.040 1.855 -1.291
69 3HG2 ILE 10 3HG2 ILE 10 5.732 1.492 -3.007
70 1HD1 ILE 10 1HD1 ILE 10 3.824 3.213 -1.378
71 2HD1 ILE 10 2HD1 ILE 10 3.973 4.304 0.020
72 3HD1 ILE 10 3HD1 ILE 10 3.628 4.969 -1.595
73 H ASP 11 H ASP 11 9.340 2.789 -3.873
74 HA ASP 11 HA ASP 11 8.291 1.934 -6.368
75 1HB ASP 11 1HB ASP 11 9.117 4.023 -7.205
76 2HB ASP 11 2HB ASP 11 10.554 3.953 -6.204
77 H PHE 12 H PHE 12 8.742 -0.215 -5.653
78 HA PHE 12 HA PHE 12 11.564 -0.758 -5.045
79 1HB PHE 12 1HB PHE 12 8.900 -2.003 -4.152
80 2HB PHE 12 2HB PHE 12 10.431 -2.806 -3.864
81 HD1 PHE 12 HD1 PHE 12 12.173 -0.583 -3.066
82 HD2 PHE 12 HD2 PHE 12 8.122 -1.355 -2.068
83 HE1 PHE 12 HE1 PHE 12 12.452 0.713 -0.935
84 HE2 PHE 12 HE2 PHE 12 8.400 -0.059 0.064
85 HZ PHE 12 HZ PHE 12 10.562 0.960 0.604
86 H ILE 13 H ILE 13 8.660 -1.595 -6.918
87 HA ILE 13 HA ILE 13 9.938 -3.940 -8.028
88 HB ILE 13 HB ILE 13 7.246 -2.640 -8.396
89 1HG1 ILE 13 1HG1 ILE 13 7.947 -5.369 -7.289
90 2HG1 ILE 13 2HG1 ILE 13 7.789 -3.941 -6.286
91 1HG2 ILE 13 1HG2 ILE 13 8.652 -4.402 -10.210
92 2HG2 ILE 13 2HG2 ILE 13 7.180 -5.178 -9.578
93 3HG2 ILE 13 3HG2 ILE 13 7.074 -3.598 -10.392
94 1HD1 ILE 13 1HD1 ILE 13 5.457 -3.637 -7.451
95 2HD1 ILE 13 2HD1 ILE 13 5.657 -5.342 -7.924
96 3HD1 ILE 13 3HD1 ILE 13 5.628 -4.894 -6.202
97 H ALA 14 H ALA 14 11.832 -2.782 -8.887
98 HA ALA 14 HA ALA 14 11.791 -0.675 -10.604
99 1HB ALA 14 1HB ALA 14 13.881 -1.505 -9.880
100 2HB ALA 14 3HB ALA 14 13.847 -1.885 -11.618
101 3HB ALA 14 2HB ALA 14 13.514 -3.160 -10.422
102 H GLY 15 H GLY 15 12.357 -0.878 -13.094
103 1HA GLY 15 2HA GLY 15 10.028 -1.894 -14.361
104 2HA GLY 15 1HA GLY 15 11.394 -2.950 -14.660
105 H GLY 16 H GLY 16 13.582 -1.453 -15.037
106 1HA GLY 16 2HA GLY 16 13.293 -0.351 -17.573
107 2HA GLY 16 1HA GLY 16 14.659 -0.129 -16.497
108 H GLU 17 H GLU 17 13.232 1.793 -18.367
109 HA GLU 17 HA GLU 17 13.012 3.895 -16.410
110 1HB GLU 17 1HB GLU 17 13.424 3.770 -19.398
111 2HB GLU 17 2HB GLU 17 12.806 5.253 -18.698
112 1HG GLU 17 1HG GLU 17 15.398 3.842 -17.912
113 2HG GLU 17 2HG GLU 17 15.273 5.328 -18.832
114 H LYS 18 H LYS 18 10.882 1.812 -16.688
115 HA LYS 18 HA LYS 18 8.684 3.673 -17.151
116 1HB LYS 18 1HB LYS 18 7.428 1.949 -18.396
117 2HB LYS 18 2HB LYS 18 8.853 2.504 -19.252
118 1HG LYS 18 1HG LYS 18 10.038 0.452 -18.043
119 2HG LYS 18 2HG LYS 18 8.401 -0.142 -17.848
120 1HD LYS 18 2HD LYS 18 8.404 -0.874 -19.991
121 2HD LYS 18 1HD LYS 18 8.620 0.770 -20.558
122 1HE LYS 18 1HE LYS 18 11.177 0.304 -19.841
123 2HE LYS 18 2HE LYS 18 10.698 -1.364 -20.083
124 1HZ LYS 18 1HZ LYS 18 9.896 0.476 -22.145
125 2HZ LYS 18 2HZ LYS 18 11.502 0.201 -22.031
126 3HZ LYS 18 3HZ LYS 18 10.475 -1.046 -22.272
127 H ASN 19 H ASN 19 9.669 3.231 -14.669
128 HA ASN 19 HA ASN 19 8.120 1.031 -13.597
129 1HB ASN 19 1HB ASN 19 9.400 1.933 -11.414
130 2HB ASN 19 2HB ASN 19 10.223 0.909 -12.573
131 2HD2 ASN 19 2HD2 ASN 19 9.367 4.347 -12.170
132 1HD2 ASN 19 1HD2 ASN 19 10.905 5.009 -12.612
133 H LEU 20 H LEU 20 6.271 1.451 -12.320
134 HA LEU 20 HA LEU 20 5.319 4.150 -12.278
135 1HB LEU 20 1HB LEU 20 4.208 1.520 -11.304
136 2HB LEU 20 2HB LEU 20 3.376 3.047 -11.085
137 HG LEU 20 HG LEU 20 4.142 1.835 -13.756
138 1HD1 LEU 20 1HD1 LEU 20 1.906 1.345 -12.002
139 2HD1 LEU 20 2HD1 LEU 20 1.349 2.069 -13.529
140 3HD1 LEU 20 3HD1 LEU 20 2.324 0.580 -13.554
141 1HD2 LEU 20 1HD2 LEU 20 3.146 4.498 -12.974
142 2HD2 LEU 20 2HD2 LEU 20 4.011 3.970 -14.437
143 3HD2 LEU 20 3HD2 LEU 20 2.255 3.718 -14.302
144 H THR 21 H THR 21 5.260 5.582 -10.579
145 HA THR 21 HA THR 21 6.417 4.599 -8.052
146 HB THR 21 HB THR 21 6.701 7.437 -9.119
147 HG1 THR 21 HG1 THR 21 8.344 6.631 -10.428
148 1HG2 THR 21 1HG2 THR 21 8.003 5.680 -7.044
149 2HG2 THR 21 2HG2 THR 21 9.061 6.787 -7.949
150 3HG2 THR 21 3HG2 THR 21 7.698 7.433 -7.004
151 H VAL 22 H VAL 22 4.912 4.465 -6.518
152 HA VAL 22 HA VAL 22 2.611 6.236 -6.717
153 HB VAL 22 HB VAL 22 3.245 3.806 -5.038
154 1HG1 VAL 22 1HG1 VAL 22 0.784 5.579 -5.031
155 2HG1 VAL 22 2HG1 VAL 22 0.836 3.942 -4.333
156 3HG1 VAL 22 3HG1 VAL 22 1.875 5.227 -3.671
157 1HG2 VAL 22 1HG2 VAL 22 2.103 4.194 -7.662
158 2HG2 VAL 22 2HG2 VAL 22 2.487 2.680 -6.808
159 3HG2 VAL 22 3HG2 VAL 22 0.902 3.456 -6.574
160 H VAL 23 H VAL 23 2.112 7.827 -5.208
161 HA VAL 23 HA VAL 23 4.295 8.429 -3.349
162 HB VAL 23 HB VAL 23 2.123 10.147 -4.562
163 1HG1 VAL 23 1HG1 VAL 23 4.063 10.643 -2.342
164 2HG1 VAL 23 2HG1 VAL 23 3.764 11.961 -3.500
165 3HG1 VAL 23 3HG1 VAL 23 2.411 11.260 -2.581
166 1HG2 VAL 23 1HG2 VAL 23 4.991 9.629 -5.209
167 2HG2 VAL 23 2HG2 VAL 23 3.617 9.982 -6.284
168 3HG2 VAL 23 3HG2 VAL 23 4.396 11.299 -5.373
169 H PHE 24 H PHE 24 3.917 8.656 -1.139
170 HA PHE 24 HA PHE 24 1.171 8.046 -0.298
171 1HB PHE 24 1HB PHE 24 2.963 6.193 -0.068
172 2HB PHE 24 2HB PHE 24 3.852 7.265 0.995
173 HD1 PHE 24 HD1 PHE 24 0.463 5.741 0.650
174 HD2 PHE 24 HD2 PHE 24 3.504 7.107 3.275
175 HE1 PHE 24 HE1 PHE 24 -0.844 4.879 2.612
176 HE2 PHE 24 HE2 PHE 24 2.198 6.245 5.238
177 HZ PHE 24 HZ PHE 24 0.039 5.142 4.883
178 H ASN 25 H ASN 25 1.034 8.549 2.254
179 HA ASN 25 HA ASN 25 2.642 10.759 3.027
180 1HB ASN 25 1HB ASN 25 0.028 11.820 3.397
181 2HB ASN 25 2HB ASN 25 1.256 12.425 2.303
182 2HD2 ASN 25 2HD2 ASN 25 1.076 12.148 0.161
183 1HD2 ASN 25 1HD2 ASN 25 -0.241 11.361 -0.643
184 H HIS 26 H HIS 26 2.878 10.444 5.248
185 HA HIS 26 HA HIS 26 1.179 8.580 6.562
186 1HB HIS 26 1HB HIS 26 3.657 10.105 7.195
187 2HB HIS 26 2HB HIS 26 2.681 9.593 8.557
188 HD1 HIS 26 HD1 HIS 26 4.792 8.236 5.740
189 HD2 HIS 26 HD2 HIS 26 2.646 6.814 9.052
190 HE1 HIS 26 HE1 HIS 26 5.479 5.798 6.044
191 H SER 27 H SER 27 1.147 12.006 5.987
192 HA SER 27 HA SER 27 -0.407 12.539 8.341
193 1HB SER 27 2HB SER 27 -0.447 14.878 7.461
194 2HB SER 27 1HB SER 27 1.179 14.243 7.614
195 HG SER 27 HG SER 27 1.153 15.153 5.589
196 H THR 28 H THR 28 -1.217 10.717 5.917
197 HA THR 28 HA THR 28 -3.754 12.093 5.320
198 HB THR 28 HB THR 28 -2.208 9.980 3.726
199 HG1 THR 28 HG1 THR 28 -2.157 12.075 2.337
200 1HG2 THR 28 1HG2 THR 28 -4.853 10.269 3.491
201 2HG2 THR 28 2HG2 THR 28 -4.405 11.782 2.667
202 3HG2 THR 28 3HG2 THR 28 -3.836 10.220 2.030
203 H HIS 29 H HIS 29 -2.159 9.134 6.496
204 HA HIS 29 HA HIS 29 -4.826 8.042 7.002
205 1HB HIS 29 2HB HIS 29 -2.159 6.603 6.979
206 2HB HIS 29 1HB HIS 29 -3.737 5.868 7.179
207 HD1 HIS 29 HD1 HIS 29 -1.679 7.720 4.556
208 HD2 HIS 29 HD2 HIS 29 -5.041 5.226 4.825
209 HE1 HIS 29 HE1 HIS 29 -2.320 7.123 2.159
210 H LYS 30 H LYS 30 -3.398 10.225 8.526
211 HA LYS 30 HA LYS 30 -2.280 9.236 10.859
212 1HB LYS 30 2HB LYS 30 -2.597 11.434 11.741
213 2HB LYS 30 1HB LYS 30 -2.197 11.590 10.042
214 1HG LYS 30 2HG LYS 30 -4.022 13.027 10.139
215 2HG LYS 30 1HG LYS 30 -4.848 11.539 9.723
216 1HD LYS 30 2HD LYS 30 -6.127 11.903 11.572
217 2HD LYS 30 1HD LYS 30 -4.737 11.373 12.499
218 1HE LYS 30 1HE LYS 30 -4.346 13.470 13.305
219 2HE LYS 30 2HE LYS 30 -4.466 14.191 11.712
220 1HZ LYS 30 1HZ LYS 30 -6.978 13.310 12.687
221 2HZ LYS 30 2HZ LYS 30 -6.291 14.409 13.681
222 3HZ LYS 30 3HZ LYS 30 -6.546 14.775 12.110
223 H ASP 31 H ASP 31 -5.541 9.083 9.671
224 HA ASP 31 HA ASP 31 -6.662 8.850 12.292
225 1HB ASP 31 1HB ASP 31 -8.180 9.808 10.768
226 2HB ASP 31 2HB ASP 31 -7.680 8.763 9.453
227 H VAL 32 H VAL 32 -4.752 6.905 10.364
228 HA VAL 32 HA VAL 32 -6.162 4.448 11.145
229 HB VAL 32 HB VAL 32 -4.083 4.809 8.982
230 1HG1 VAL 32 1HG1 VAL 32 -4.738 2.511 10.188
231 2HG1 VAL 32 2HG1 VAL 32 -6.062 2.575 9.000
232 3HG1 VAL 32 3HG1 VAL 32 -4.370 2.607 8.449
233 1HG2 VAL 32 1HG2 VAL 32 -7.111 4.783 8.751
234 2HG2 VAL 32 2HG2 VAL 32 -6.020 6.140 8.380
235 3HG2 VAL 32 3HG2 VAL 32 -5.980 4.667 7.381
236 H LYS 33 H LYS 33 -5.207 3.134 12.632
237 HA LYS 33 HA LYS 33 -3.102 3.999 14.160
238 1HB LYS 33 1HB LYS 33 -3.961 1.126 13.710
239 2HB LYS 33 2HB LYS 33 -3.078 1.748 15.090
240 1HG LYS 33 1HG LYS 33 -5.454 3.367 14.705
241 2HG LYS 33 2HG LYS 33 -5.921 1.678 14.701
242 1HD LYS 33 1HD LYS 33 -4.426 1.450 16.833
243 2HD LYS 33 2HD LYS 33 -4.447 3.201 16.883
244 1HE LYS 33 1HE LYS 33 -7.142 2.614 16.511
245 2HE LYS 33 2HE LYS 33 -6.617 1.271 17.507
246 1HZ LYS 33 1HZ LYS 33 -5.840 3.987 18.227
247 2HZ LYS 33 2HZ LYS 33 -7.330 3.440 18.612
248 3HZ LYS 33 3HZ LYS 33 -6.006 2.678 19.189
249 H CYS 34 H CYS 34 -0.881 3.150 14.396
250 HA CYS 34 HA CYS 34 0.418 3.185 11.887
251 1HB CYS 34 1HB CYS 34 1.660 2.441 14.534
252 2HB CYS 34 2HB CYS 34 2.455 3.091 13.113
253 H ASP 35 H ASP 35 -0.481 0.714 14.342
254 HA ASP 35 HA ASP 35 0.996 -1.348 13.167
255 1HB ASP 35 1HB ASP 35 -0.519 -2.827 14.557
256 2HB ASP 35 2HB ASP 35 0.277 -1.559 15.466
257 H ASP 36 H ASP 36 -1.697 0.408 12.086
258 HA ASP 36 HA ASP 36 -3.347 -1.612 11.124
259 1HB ASP 36 1HB ASP 36 -3.646 1.024 11.344
260 2HB ASP 36 2HB ASP 36 -3.009 1.048 9.712
261 H CYS 37 H CYS 37 -0.221 -0.401 10.170
262 HA CYS 37 HA CYS 37 -0.448 -1.873 7.652
263 1HB CYS 37 1HB CYS 37 0.900 0.813 8.064
264 2HB CYS 37 2HB CYS 37 1.153 -0.197 6.655
265 H HIS 38 H HIS 38 1.676 -0.424 10.211
266 HA HIS 38 HA HIS 38 3.836 -2.164 9.531
267 1HB HIS 38 1HB HIS 38 3.437 -0.305 11.892
268 2HB HIS 38 2HB HIS 38 4.931 -1.131 11.495
269 HD1 HIS 38 HD1 HIS 38 5.951 -0.479 9.006
270 HD2 HIS 38 HD2 HIS 38 3.158 2.151 10.702
271 HE1 HIS 38 HE1 HIS 38 6.212 1.736 7.767
272 H HIS 39 H HIS 39 2.761 -4.254 9.686
273 HA HIS 39 HA HIS 39 1.963 -4.993 12.384
274 1HB HIS 39 2HB HIS 39 0.773 -6.756 11.449
275 2HB HIS 39 1HB HIS 39 0.558 -5.456 10.293
276 HD1 HIS 39 HD1 HIS 39 1.426 -8.949 10.451
277 HD2 HIS 39 HD2 HIS 39 2.576 -5.716 8.038
278 HE1 HIS 39 HE1 HIS 39 2.441 -9.959 8.339
279 H GLN 40 H GLN 40 4.661 -4.430 12.256
280 HA GLN 40 HA GLN 40 5.879 -7.062 11.997
281 1HB GLN 40 1HB GLN 40 6.929 -4.247 11.726
282 2HB GLN 40 2HB GLN 40 8.040 -5.506 12.226
283 1HG GLN 40 1HG GLN 40 7.772 -5.026 9.666
284 2HG GLN 40 2HG GLN 40 7.833 -6.695 10.200
285 2HE2 GLN 40 2HE2 GLN 40 5.983 -7.955 10.240
286 1HE2 GLN 40 1HE2 GLN 40 4.535 -7.541 9.384
287 HA PRO 41 HA PRO 41 6.239 -7.059 16.410
288 1HB PRO 41 1HB PRO 41 7.368 -9.461 16.747
289 2HB PRO 41 2HB PRO 41 5.771 -9.342 15.939
290 1HG PRO 41 2HG PRO 41 8.514 -9.402 14.610
291 2HG PRO 41 1HG PRO 41 7.177 -10.509 14.157
292 1HD PRO 41 1HD PRO 41 7.685 -8.203 12.771
293 2HD PRO 41 2HD PRO 41 6.008 -8.757 13.057
294 H GLY 42 H GLY 42 7.881 -6.644 18.027
295 1HA GLY 42 2HA GLY 42 10.650 -6.574 17.028
296 2HA GLY 42 1HA GLY 42 10.141 -6.626 18.705
297 H ASP 43 H ASP 43 11.724 -4.737 18.824
298 HA ASP 43 HA ASP 43 10.323 -2.405 19.136
299 1HB ASP 43 1HB ASP 43 13.181 -3.247 19.122
300 2HB ASP 43 2HB ASP 43 12.935 -1.544 18.791
301 H LYS 44 H LYS 44 11.580 -3.938 16.285
302 HA LYS 44 HA LYS 44 11.825 -1.443 14.814
303 1HB LYS 44 1HB LYS 44 12.664 -2.871 13.002
304 2HB LYS 44 2HB LYS 44 13.567 -3.096 14.486
305 1HG LYS 44 1HG LYS 44 12.392 -5.175 14.982
306 2HG LYS 44 2HG LYS 44 11.243 -4.904 13.687
307 1HD LYS 44 1HD LYS 44 12.658 -6.283 12.510
308 2HD LYS 44 2HD LYS 44 13.542 -4.796 12.234
309 1HE LYS 44 1HE LYS 44 14.123 -6.408 14.732
310 2HE LYS 44 2HE LYS 44 14.787 -6.943 13.200
311 1HZ LYS 44 1HZ LYS 44 15.093 -4.143 13.826
312 2HZ LYS 44 2HZ LYS 44 15.982 -5.186 14.714
313 3HZ LYS 44 3HZ LYS 44 16.131 -5.165 13.088
314 H GLN 45 H GLN 45 9.237 -2.038 15.931
315 HA GLN 45 HA GLN 45 7.487 -3.388 14.462
316 1HB GLN 45 1HB GLN 45 7.043 -1.938 16.503
317 2HB GLN 45 2HB GLN 45 6.984 -0.545 15.441
318 1HG GLN 45 1HG GLN 45 4.838 -1.007 14.877
319 2HG GLN 45 2HG GLN 45 5.292 -2.604 14.316
320 2HE2 GLN 45 2HE2 GLN 45 2.889 -2.366 15.381
321 1HE2 GLN 45 1HE2 GLN 45 2.778 -3.069 16.961
322 H TYR 46 H TYR 46 9.220 -0.504 13.541
323 HA TYR 46 HA TYR 46 7.657 -0.306 11.017
324 1HB TYR 46 2HB TYR 46 9.675 1.673 12.096
325 2HB TYR 46 1HB TYR 46 8.439 1.933 10.854
326 HD1 TYR 46 HD1 TYR 46 6.064 2.178 11.473
327 HD2 TYR 46 HD2 TYR 46 9.139 1.781 14.446
328 HE1 TYR 46 HE1 TYR 46 4.494 3.002 13.207
329 HE2 TYR 46 HE2 TYR 46 7.569 2.605 16.180
330 HH TYR 46 HH TYR 46 4.893 2.662 16.446
331 H ALA 47 H ALA 47 8.625 -1.941 9.715
332 HA ALA 47 HA ALA 47 11.450 -1.404 9.130
333 1HB ALA 47 1HB ALA 47 10.086 -4.047 9.723
334 2HB ALA 47 3HB ALA 47 11.542 -3.357 10.478
335 3HB ALA 47 2HB ALA 47 11.606 -3.954 8.803
336 H GLY 48 H GLY 48 11.894 -2.984 6.993
337 1HA GLY 48 2HA GLY 48 11.616 -2.898 4.749
338 2HA GLY 48 1HA GLY 48 10.304 -1.755 4.957
339 H CYS 49 H CYS 49 8.840 -2.730 3.503
340 HA CYS 49 HA CYS 49 7.463 -4.990 4.594
341 1HB CYS 49 1HB CYS 49 6.891 -3.631 1.964
342 2HB CYS 49 2HB CYS 49 5.801 -4.582 2.953
343 H THR 50 H THR 50 9.757 -4.192 1.980
344 HA THR 50 HA THR 50 9.476 -6.839 0.801
345 HB THR 50 HB THR 50 11.262 -5.773 -0.764
346 HG1 THR 50 HG1 THR 50 12.029 -4.012 0.393
347 1HG2 THR 50 1HG2 THR 50 8.418 -4.928 -0.395
348 2HG2 THR 50 2HG2 THR 50 9.429 -3.782 -1.307
349 3HG2 THR 50 3HG2 THR 50 9.255 -5.460 -1.873
350 H THR 51 H THR 51 10.538 -6.264 3.637
351 HA THR 51 HA THR 51 13.311 -6.845 3.549
352 HB THR 51 HB THR 51 11.315 -7.333 5.815
353 HG1 THR 51 HG1 THR 51 12.796 -4.947 4.960
354 1HG2 THR 51 1HG2 THR 51 14.239 -7.284 5.577
355 2HG2 THR 51 2HG2 THR 51 13.672 -5.989 6.658
356 3HG2 THR 51 3HG2 THR 51 13.243 -7.683 6.997
357 H ASP 52 H ASP 52 14.385 -8.809 4.279
358 HA ASP 52 HA ASP 52 13.608 -10.967 2.806
359 1HB ASP 52 1HB ASP 52 15.349 -12.184 3.961
360 2HB ASP 52 2HB ASP 52 15.888 -10.524 3.812
361 H GLY 53 H GLY 53 12.793 -13.136 3.545
362 1HA GLY 53 2HA GLY 53 11.877 -13.716 6.101
363 2HA GLY 53 1HA GLY 53 11.320 -14.453 4.612
364 H CYS 54 H CYS 54 10.602 -11.505 3.703
365 HA CYS 54 HA CYS 54 8.018 -11.528 5.074
366 1HB CYS 54 1HB CYS 54 9.463 -8.980 4.297
367 2HB CYS 54 2HB CYS 54 7.973 -9.131 5.207
368 H HIS 55 H HIS 55 7.895 -8.898 3.144
369 HA HIS 55 HA HIS 55 6.851 -10.456 0.928
370 1HB HIS 55 2HB HIS 55 6.592 -7.477 1.358
371 2HB HIS 55 1HB HIS 55 5.619 -8.507 0.328
372 HD1 HIS 55 HD1 HIS 55 4.039 -10.305 1.646
373 HD2 HIS 55 HD2 HIS 55 5.630 -7.161 3.922
374 HE1 HIS 55 HE1 HIS 55 2.650 -10.196 3.784
375 H ASN 56 H ASN 56 9.577 -10.678 0.985
376 HA ASN 56 HA ASN 56 10.703 -8.570 -0.579
377 1HB ASN 56 1HB ASN 56 12.013 -9.846 1.173
378 2HB ASN 56 2HB ASN 56 11.856 -11.299 0.206
379 2HD2 ASN 56 2HD2 ASN 56 14.241 -9.901 1.048
380 1HD2 ASN 56 1HD2 ASN 56 15.127 -9.455 -0.373
381 H ILE 57 H ILE 57 8.832 -9.139 -2.263
382 HA ILE 57 HA ILE 57 9.970 -11.065 -4.155
383 HB ILE 57 HB ILE 57 7.029 -10.776 -3.535
384 1HG1 ILE 57 1HG1 ILE 57 8.604 -11.906 -1.784
385 2HG1 ILE 57 2HG1 ILE 57 7.089 -12.667 -2.229
386 1HG2 ILE 57 1HG2 ILE 57 8.570 -12.535 -5.452
387 2HG2 ILE 57 2HG2 ILE 57 6.893 -12.860 -4.953
388 3HG2 ILE 57 3HG2 ILE 57 7.288 -11.357 -5.820
389 1HD1 ILE 57 1HD1 ILE 57 9.504 -13.360 -3.882
390 2HD1 ILE 57 2HD1 ILE 57 9.409 -14.025 -2.233
391 3HD1 ILE 57 3HD1 ILE 57 8.122 -14.378 -3.411
392 H LEU 58 H LEU 58 10.717 -9.827 -5.794
393 HA LEU 58 HA LEU 58 9.157 -7.450 -6.484
394 1HB LEU 58 2HB LEU 58 11.986 -8.207 -7.227
395 2HB LEU 58 1HB LEU 58 11.175 -6.709 -7.639
396 HG LEU 58 HG LEU 58 11.995 -7.654 -4.884
397 1HD1 LEU 58 1HD1 LEU 58 13.318 -6.138 -6.885
398 2HD1 LEU 58 2HD1 LEU 58 12.895 -5.025 -5.562
399 3HD1 LEU 58 3HD1 LEU 58 13.849 -6.489 -5.222
400 1HD2 LEU 58 1HD2 LEU 58 10.172 -5.399 -5.698
401 2HD2 LEU 58 2HD2 LEU 58 9.951 -6.629 -4.431
402 3HD2 LEU 58 3HD2 LEU 58 11.136 -5.321 -4.204
403 H ASP 59 H ASP 59 8.880 -10.552 -7.159
404 HA ASP 59 HA ASP 59 8.925 -10.237 -10.041
405 1HB ASP 59 1HB ASP 59 8.332 -12.772 -9.903
406 2HB ASP 59 2HB ASP 59 9.956 -12.282 -9.465
407 H LYS 60 H LYS 60 6.964 -8.712 -9.701
408 HA LYS 60 HA LYS 60 4.614 -9.292 -8.557
409 1HB LYS 60 1HB LYS 60 4.774 -7.201 -9.548
410 2HB LYS 60 2HB LYS 60 5.338 -7.837 -11.080
411 1HG LYS 60 1HG LYS 60 3.039 -8.918 -11.381
412 2HG LYS 60 2HG LYS 60 2.511 -8.057 -9.949
413 1HD LYS 60 2HD LYS 60 1.909 -6.444 -11.474
414 2HD LYS 60 1HD LYS 60 3.588 -5.966 -11.319
415 1HE LYS 60 1HE LYS 60 3.943 -7.813 -13.238
416 2HE LYS 60 2HE LYS 60 2.248 -7.497 -13.551
417 1HZ LYS 60 1HZ LYS 60 3.878 -5.161 -13.195
418 2HZ LYS 60 2HZ LYS 60 4.215 -6.039 -14.530
419 3HZ LYS 60 3HZ LYS 60 2.707 -5.458 -14.293
420 H ALA 61 H ALA 61 2.524 -10.144 -9.403
421 HA ALA 61 HA ALA 61 1.292 -11.774 -10.250
422 1HB ALA 61 1HB ALA 61 3.267 -12.275 -12.468
423 2HB ALA 61 3HB ALA 61 1.489 -12.234 -12.521
424 3HB ALA 61 2HB ALA 61 2.410 -10.716 -12.400
425 H ASP 62 H ASP 62 2.982 -12.429 -8.132
426 HA ASP 62 HA ASP 62 4.145 -14.964 -8.927
427 1HB ASP 62 1HB ASP 62 5.402 -13.212 -7.505
428 2HB ASP 62 2HB ASP 62 4.289 -13.592 -6.207
429 H LYS 63 H LYS 63 3.897 -16.637 -6.856
430 HA LYS 63 HA LYS 63 1.089 -16.518 -6.005
431 1HB LYS 63 1HB LYS 63 2.598 -18.773 -7.310
432 2HB LYS 63 2HB LYS 63 1.279 -19.116 -6.208
433 1HG LYS 63 1HG LYS 63 -0.002 -18.913 -8.106
434 2HG LYS 63 2HG LYS 63 0.071 -17.204 -7.725
435 1HD LYS 63 1HD LYS 63 1.574 -16.735 -9.434
436 2HD LYS 63 2HD LYS 63 2.363 -18.295 -9.322
437 1HE LYS 63 1HE LYS 63 -0.502 -18.168 -10.295
438 2HE LYS 63 2HE LYS 63 0.789 -17.727 -11.394
439 1HZ LYS 63 1HZ LYS 63 1.505 -20.074 -10.091
440 2HZ LYS 63 2HZ LYS 63 -0.014 -20.265 -10.662
441 3HZ LYS 63 3HZ LYS 63 1.196 -19.854 -11.680
442 H SER 64 H SER 64 1.798 -15.571 -4.004
443 HA SER 64 HA SER 64 2.320 -17.470 -2.060
444 1HB SER 64 1HB SER 64 4.684 -16.686 -3.354
445 2HB SER 64 2HB SER 64 4.663 -15.690 -1.912
446 HG SER 64 HG SER 64 3.951 -18.103 -1.052
447 H VAL 65 H VAL 65 2.659 -16.341 0.161
448 HA VAL 65 HA VAL 65 1.072 -13.911 0.116
449 HB VAL 65 HB VAL 65 0.350 -15.667 1.571
450 1HG1 VAL 65 1HG1 VAL 65 3.222 -15.878 2.194
451 2HG1 VAL 65 2HG1 VAL 65 2.157 -15.983 3.616
452 3HG1 VAL 65 3HG1 VAL 65 1.938 -17.109 2.255
453 1HG2 VAL 65 1HG2 VAL 65 0.881 -13.050 2.407
454 2HG2 VAL 65 2HG2 VAL 65 -0.249 -14.206 3.153
455 3HG2 VAL 65 3HG2 VAL 65 1.420 -14.075 3.759
456 H ASN 66 H ASN 66 3.961 -14.049 -0.814
457 HA ASN 66 HA ASN 66 5.004 -12.169 1.157
458 1HB ASN 66 1HB ASN 66 6.580 -13.936 -0.789
459 2HB ASN 66 2HB ASN 66 7.285 -12.844 0.386
460 2HD2 ASN 66 2HD2 ASN 66 6.389 -13.159 2.681
461 1HD2 ASN 66 1HD2 ASN 66 6.323 -14.787 3.269
462 H SER 67 H SER 67 3.336 -12.201 -1.603
463 HA SER 67 HA SER 67 5.056 -10.811 -3.367
464 1HB SER 67 1HB SER 67 2.641 -10.314 -4.430
465 2HB SER 67 2HB SER 67 3.419 -11.875 -4.591
466 HG SER 67 HG SER 67 1.167 -11.995 -3.863
467 H TRP 68 H TRP 68 5.274 -8.578 -3.676
468 HA TRP 68 HA TRP 68 4.030 -6.927 -1.625
469 1HB TRP 68 1HB TRP 68 6.334 -6.600 -1.696
470 2HB TRP 68 2HB TRP 68 6.394 -6.623 -3.448
471 HD1 TRP 68 HD1 TRP 68 6.562 -4.251 -4.535
472 HE1 TRP 68 HE1 TRP 68 6.118 -1.737 -3.869
473 HE3 TRP 68 HE3 TRP 68 4.561 -5.264 0.029
474 HZ2 TRP 68 HZ2 TRP 68 5.005 -0.481 -1.560
475 HZ3 TRP 68 HZ3 TRP 68 3.821 -3.336 1.426
476 HH2 TRP 68 HH2 TRP 68 4.017 -1.011 0.698
477 H TYR 69 H TYR 69 2.908 -8.189 -4.252
478 HA TYR 69 HA TYR 69 1.796 -5.655 -5.367
479 1HB TYR 69 1HB TYR 69 3.157 -6.738 -7.025
480 2HB TYR 69 2HB TYR 69 2.426 -8.314 -6.680
481 HD1 TYR 69 HD1 TYR 69 -0.121 -8.551 -7.117
482 HD2 TYR 69 HD2 TYR 69 2.300 -5.392 -8.732
483 HE1 TYR 69 HE1 TYR 69 -1.821 -8.149 -8.878
484 HE2 TYR 69 HE2 TYR 69 0.601 -4.990 -10.493
485 HH TYR 69 HH TYR 69 -1.846 -7.105 -11.289
486 H LYS 70 H LYS 70 1.153 -8.531 -3.559
487 HA LYS 70 HA LYS 70 -1.635 -8.537 -4.429
488 1HB LYS 70 1HB LYS 70 -0.246 -10.665 -4.288
489 2HB LYS 70 2HB LYS 70 -0.270 -10.474 -2.546
490 1HG LYS 70 1HG LYS 70 -2.934 -10.153 -3.062
491 2HG LYS 70 2HG LYS 70 -2.507 -11.185 -4.413
492 1HD LYS 70 1HD LYS 70 -1.738 -11.844 -1.535
493 2HD LYS 70 2HD LYS 70 -3.239 -12.386 -2.258
494 1HE LYS 70 2HE LYS 70 -0.414 -13.054 -3.205
495 2HE LYS 70 1HE LYS 70 -1.564 -14.161 -2.483
496 1HZ LYS 70 1HZ LYS 70 -2.901 -13.090 -4.574
497 2HZ LYS 70 2HZ LYS 70 -1.389 -13.277 -5.163
498 3HZ LYS 70 3HZ LYS 70 -2.189 -14.560 -4.547
499 H VAL 71 H VAL 71 0.476 -8.119 -1.531
500 HA VAL 71 HA VAL 71 -1.646 -7.645 0.247
501 HB VAL 71 HB VAL 71 0.128 -6.727 1.690
502 1HG1 VAL 71 1HG1 VAL 71 -0.018 -9.372 0.561
503 2HG1 VAL 71 2HG1 VAL 71 1.674 -8.986 0.959
504 3HG1 VAL 71 3HG1 VAL 71 0.416 -8.875 2.214
505 1HG2 VAL 71 1HG2 VAL 71 1.375 -5.813 -0.466
506 2HG2 VAL 71 2HG2 VAL 71 2.270 -6.246 1.011
507 3HG2 VAL 71 3HG2 VAL 71 2.212 -7.380 -0.360
508 H VAL 72 H VAL 72 -0.586 -5.885 -2.452
509 HA VAL 72 HA VAL 72 -1.421 -3.343 -1.258
510 HB VAL 72 HB VAL 72 0.129 -4.019 -3.763
511 1HG1 VAL 72 1HG1 VAL 72 -1.541 -1.852 -3.495
512 2HG1 VAL 72 2HG1 VAL 72 0.014 -1.197 -2.930
513 3HG1 VAL 72 3HG1 VAL 72 -0.109 -1.924 -4.550
514 1HG2 VAL 72 1HG2 VAL 72 0.921 -2.669 -1.161
515 2HG2 VAL 72 2HG2 VAL 72 1.463 -4.255 -1.758
516 3HG2 VAL 72 3HG2 VAL 72 1.952 -2.770 -2.609
517 H HIS 73 H HIS 73 -1.941 -5.574 -4.056
518 HA HIS 73 HA HIS 73 -4.408 -4.107 -4.602
519 1HB HIS 73 2HB HIS 73 -2.973 -6.123 -6.350
520 2HB HIS 73 1HB HIS 73 -4.354 -5.142 -6.799
521 HD1 HIS 73 HD1 HIS 73 -0.633 -4.939 -6.206
522 HD2 HIS 73 HD2 HIS 73 -3.774 -2.464 -7.473
523 HE1 HIS 73 HE1 HIS 73 0.454 -2.838 -7.162
524 H ASP 74 H ASP 74 -4.093 -5.885 -2.285
525 HA ASP 74 HA ASP 74 -5.372 -8.319 -3.048
526 1HB ASP 74 1HB ASP 74 -4.033 -7.204 -0.693
527 2HB ASP 74 2HB ASP 74 -5.541 -7.968 -0.230
528 H ALA 75 H ALA 75 -7.570 -8.163 -3.571
529 HA ALA 75 HA ALA 75 -9.187 -6.087 -2.442
530 1HB ALA 75 1HB ALA 75 -9.941 -8.483 -4.163
531 2HB ALA 75 3HB ALA 75 -9.382 -6.914 -4.792
532 3HB ALA 75 2HB ALA 75 -10.914 -7.018 -3.892
533 H LYS 76 H LYS 76 -8.290 -9.376 -1.647
534 HA LYS 76 HA LYS 76 -10.428 -9.398 0.369
535 1HB LYS 76 1HB LYS 76 -10.484 -11.128 -1.569
536 2HB LYS 76 2HB LYS 76 -9.148 -11.893 -0.734
537 1HG LYS 76 1HG LYS 76 -10.669 -11.733 1.403
538 2HG LYS 76 2HG LYS 76 -11.978 -11.440 0.275
539 1HD LYS 76 1HD LYS 76 -11.557 -13.576 -0.863
540 2HD LYS 76 2HD LYS 76 -10.109 -13.847 0.086
541 1HE LYS 76 1HE LYS 76 -11.675 -15.147 1.256
542 2HE LYS 76 2HE LYS 76 -11.725 -13.651 2.167
543 1HZ LYS 76 1HZ LYS 76 -13.560 -13.062 0.487
544 2HZ LYS 76 2HZ LYS 76 -13.662 -14.675 0.255
545 3HZ LYS 76 3HZ LYS 76 -13.912 -14.047 1.741
546 H GLY 77 H GLY 77 -9.851 -9.886 2.502
547 1HA GLY 77 2HA GLY 77 -7.314 -9.138 3.353
548 2HA GLY 77 1HA GLY 77 -7.304 -10.886 3.231
549 H GLY 78 H GLY 78 -7.402 -11.571 5.354
550 1HA GLY 78 2HA GLY 78 -8.924 -12.265 7.039
551 2HA GLY 78 1HA GLY 78 -9.803 -10.760 6.862
552 H ALA 79 H ALA 79 -6.448 -11.940 7.628
553 HA ALA 79 HA ALA 79 -6.208 -11.021 10.128
554 1HB ALA 79 1HB ALA 79 -3.711 -10.492 9.212
555 2HB ALA 79 3HB ALA 79 -4.327 -12.142 9.469
556 3HB ALA 79 2HB ALA 79 -4.344 -11.430 7.838
557 H LYS 80 H LYS 80 -5.743 -9.078 7.111
558 HA LYS 80 HA LYS 80 -6.589 -6.729 8.483
559 1HB LYS 80 1HB LYS 80 -4.327 -5.561 7.788
560 2HB LYS 80 2HB LYS 80 -4.512 -6.339 9.347
561 1HG LYS 80 1HG LYS 80 -3.499 -8.440 8.396
562 2HG LYS 80 2HG LYS 80 -3.273 -7.620 6.864
563 1HD LYS 80 2HD LYS 80 -1.990 -6.879 9.533
564 2HD LYS 80 1HD LYS 80 -1.176 -7.540 8.129
565 1HE LYS 80 1HE LYS 80 -1.930 -5.461 6.830
566 2HE LYS 80 2HE LYS 80 -2.497 -4.796 8.349
567 1HZ LYS 80 1HZ LYS 80 0.178 -5.808 8.431
568 2HZ LYS 80 2HZ LYS 80 -0.022 -4.534 7.429
569 3HZ LYS 80 3HZ LYS 80 -0.423 -4.404 9.007
570 HA PRO 81 HA PRO 81 -7.628 -5.705 4.354
571 1HB PRO 81 1HB PRO 81 -7.898 -2.989 4.538
572 2HB PRO 81 2HB PRO 81 -8.976 -4.121 5.418
573 1HG PRO 81 2HG PRO 81 -6.737 -2.692 6.199
574 2HG PRO 81 1HG PRO 81 -8.137 -2.817 7.313
575 1HD PRO 81 1HD PRO 81 -5.844 -4.266 7.694
576 2HD PRO 81 2HD PRO 81 -7.451 -4.971 8.045
577 H THR 82 H THR 82 -6.966 -3.842 2.571
578 HA THR 82 HA THR 82 -4.049 -3.508 2.745
579 HB THR 82 HB THR 82 -3.993 -4.194 0.308
580 HG1 THR 82 HG1 THR 82 -6.705 -5.069 0.987
581 1HG2 THR 82 1HG2 THR 82 -4.441 -5.940 2.567
582 2HG2 THR 82 2HG2 THR 82 -5.362 -6.581 1.185
583 3HG2 THR 82 3HG2 THR 82 -3.607 -6.321 1.041
584 H CYS 83 H CYS 83 -3.740 -2.262 0.224
585 HA CYS 83 HA CYS 83 -4.683 0.327 0.956
586 1HB CYS 83 1HB CYS 83 -3.310 -0.337 -1.635
587 2HB CYS 83 2HB CYS 83 -3.291 1.164 -0.731
588 H ILE 84 H ILE 84 -6.096 -2.331 -0.532
589 HA ILE 84 HA ILE 84 -7.715 -0.639 -2.304
590 HB ILE 84 HB ILE 84 -6.758 -3.457 -2.465
591 1HG1 ILE 84 1HG1 ILE 84 -5.621 -1.679 -3.714
592 2HG1 ILE 84 2HG1 ILE 84 -6.348 -2.863 -4.781
593 1HG2 ILE 84 1HG2 ILE 84 -9.438 -2.477 -3.423
594 2HG2 ILE 84 2HG2 ILE 84 -8.559 -3.758 -4.293
595 3HG2 ILE 84 3HG2 ILE 84 -9.018 -3.993 -2.589
596 1HD1 ILE 84 1HD1 ILE 84 -8.423 -1.227 -4.779
597 2HD1 ILE 84 2HD1 ILE 84 -7.237 -0.027 -4.212
598 3HD1 ILE 84 3HD1 ILE 84 -7.002 -0.838 -5.779
599 H SER 85 H SER 85 -7.753 -3.247 0.189
600 HA SER 85 HA SER 85 -10.445 -3.601 0.329
601 1HB SER 85 2HB SER 85 -8.859 -3.538 2.889
602 2HB SER 85 1HB SER 85 -10.036 -4.717 2.345
603 HG SER 85 HG SER 85 -8.396 -5.891 1.653
604 H CYS 86 H CYS 86 -8.427 -1.406 2.429
605 HA CYS 86 HA CYS 86 -10.594 -0.201 3.671
606 1HB CYS 86 1HB CYS 86 -8.083 -0.160 4.295
607 2HB CYS 86 2HB CYS 86 -7.958 1.199 3.195
608 H HIS 87 H HIS 87 -8.462 1.005 0.968
609 HA HIS 87 HA HIS 87 -9.776 3.297 0.394
610 1HB HIS 87 1HB HIS 87 -8.246 1.329 -1.279
611 2HB HIS 87 2HB HIS 87 -9.030 2.688 -2.060
612 HD1 HIS 87 HD1 HIS 87 -6.870 3.930 -2.676
613 HD2 HIS 87 HD2 HIS 87 -7.226 3.130 1.426
614 HE1 HIS 87 HE1 HIS 87 -5.021 5.260 -1.525
615 H LYS 88 H LYS 88 -10.690 -0.059 -0.471
616 HA LYS 88 HA LYS 88 -12.696 0.591 -2.295
617 1HB LYS 88 1HB LYS 88 -11.917 -1.783 -0.676
618 2HB LYS 88 2HB LYS 88 -13.559 -1.756 -1.287
619 1HG LYS 88 1HG LYS 88 -12.705 -1.343 -3.596
620 2HG LYS 88 2HG LYS 88 -11.059 -1.334 -2.994
621 1HD LYS 88 1HD LYS 88 -11.134 -3.559 -3.578
622 2HD LYS 88 2HD LYS 88 -11.845 -3.732 -1.986
623 1HE LYS 88 1HE LYS 88 -13.990 -4.082 -2.819
624 2HE LYS 88 2HE LYS 88 -13.739 -3.051 -4.214
625 1HZ LYS 88 1HZ LYS 88 -12.419 -5.654 -3.902
626 2HZ LYS 88 2HZ LYS 88 -13.837 -5.458 -4.687
627 3HZ LYS 88 3HZ LYS 88 -12.486 -4.734 -5.250
628 H ASP 89 H ASP 89 -12.778 0.083 1.288
629 HA ASP 89 HA ASP 89 -15.472 0.333 1.602
630 1HB ASP 89 1HB ASP 89 -13.439 -0.098 3.287
631 2HB ASP 89 2HB ASP 89 -13.582 1.624 3.580
632 H LYS 90 H LYS 90 -12.859 2.812 1.359
633 HA LYS 90 HA LYS 90 -14.412 5.030 2.050
634 1HB LYS 90 1HB LYS 90 -11.779 4.527 0.768
635 2HB LYS 90 2HB LYS 90 -12.507 6.087 0.445
636 1HG LYS 90 1HG LYS 90 -12.016 4.888 3.212
637 2HG LYS 90 2HG LYS 90 -11.081 6.174 2.475
638 1HD LYS 90 1HD LYS 90 -13.566 7.271 2.250
639 2HD LYS 90 2HD LYS 90 -13.840 6.263 3.657
640 1HE LYS 90 1HE LYS 90 -11.856 7.295 4.784
641 2HE LYS 90 2HE LYS 90 -11.579 8.302 3.377
642 1HZ LYS 90 1HZ LYS 90 -14.250 8.462 4.323
643 2HZ LYS 90 2HZ LYS 90 -13.167 8.920 5.456
644 3HZ LYS 90 3HZ LYS 90 -13.190 9.661 4.001
645 H ALA 91 H ALA 91 -13.831 3.324 -1.060
646 HA ALA 91 HA ALA 91 -15.597 5.229 -2.389
647 1HB ALA 91 1HB ALA 91 -14.436 2.953 -3.895
648 2HB ALA 91 3HB ALA 91 -14.470 4.688 -4.289
649 3HB ALA 91 2HB ALA 91 -13.246 4.056 -3.162
650 H GLY 92 H GLY 92 -16.414 3.163 -0.277
651 1HA GLY 92 2HA GLY 92 -17.855 1.397 -0.052
652 2HA GLY 92 1HA GLY 92 -17.943 1.220 -1.793
653 H ASP 93 H ASP 93 -18.920 3.408 -2.898
654 HA ASP 93 HA ASP 93 -21.539 3.411 -2.439
655 1HB ASP 93 1HB ASP 93 -21.817 5.707 -1.234
656 2HB ASP 93 2HB ASP 93 -21.492 4.293 -0.250
657 H ASP 94 H ASP 94 -18.964 6.000 -2.528
658 HA ASP 94 HA ASP 94 -20.300 7.351 -4.630
659 1HB ASP 94 1HB ASP 94 -18.952 8.578 -2.971
660 2HB ASP 94 2HB ASP 94 -17.522 7.660 -3.401
661 H LYS 95 H LYS 95 -20.006 6.951 -6.837
662 HA LYS 95 HA LYS 95 -18.254 4.850 -7.627
663 1HB LYS 95 1HB LYS 95 -20.105 6.714 -9.129
664 2HB LYS 95 2HB LYS 95 -19.116 5.512 -9.934
665 1HG LYS 95 1HG LYS 95 -20.221 3.690 -8.839
666 2HG LYS 95 2HG LYS 95 -20.911 4.731 -7.609
667 1HD LYS 95 1HD LYS 95 -22.528 5.643 -9.097
668 2HD LYS 95 2HD LYS 95 -21.626 5.171 -10.524
669 1HE LYS 95 1HE LYS 95 -22.754 3.092 -8.606
670 2HE LYS 95 2HE LYS 95 -23.729 3.763 -9.898
671 1HZ LYS 95 1HZ LYS 95 -21.098 2.798 -10.606
672 2HZ LYS 95 2HZ LYS 95 -22.226 1.674 -10.243
673 3HZ LYS 95 3HZ LYS 95 -22.492 2.736 -11.455
674 H GLU 96 H GLU 96 -18.278 8.439 -7.824
675 HA GLU 96 HA GLU 96 -16.063 8.601 -9.505
676 1HB GLU 96 1HB GLU 96 -17.642 10.468 -9.154
677 2HB GLU 96 2HB GLU 96 -17.161 10.594 -7.473
678 1HG GLU 96 1HG GLU 96 -14.727 10.913 -8.428
679 2HG GLU 96 2HG GLU 96 -15.529 11.248 -9.950
680 H LEU 97 H LEU 97 -16.440 7.996 -6.052
681 HA LEU 97 HA LEU 97 -13.773 8.756 -5.370
682 1HB LEU 97 1HB LEU 97 -15.900 8.681 -3.910
683 2HB LEU 97 2HB LEU 97 -15.573 6.966 -3.763
684 HG LEU 97 HG LEU 97 -14.674 8.031 -1.841
685 1HD1 LEU 97 1HD1 LEU 97 -13.272 6.285 -3.148
686 2HD1 LEU 97 2HD1 LEU 97 -12.198 7.659 -3.505
687 3HD1 LEU 97 3HD1 LEU 97 -12.513 7.191 -1.817
688 1HD2 LEU 97 1HD2 LEU 97 -13.756 10.084 -3.780
689 2HD2 LEU 97 2HD2 LEU 97 -14.388 10.258 -2.125
690 3HD2 LEU 97 3HD2 LEU 97 -12.697 9.765 -2.386
691 H LYS 98 H LYS 98 -15.315 6.010 -6.859
692 HA LYS 98 HA LYS 98 -13.202 4.196 -6.081
693 1HB LYS 98 1HB LYS 98 -15.655 3.567 -6.306
694 2HB LYS 98 2HB LYS 98 -15.459 3.719 -8.040
695 1HG LYS 98 1HG LYS 98 -13.413 2.106 -7.751
696 2HG LYS 98 2HG LYS 98 -14.076 1.765 -6.165
697 1HD LYS 98 1HD LYS 98 -15.613 1.461 -8.789
698 2HD LYS 98 2HD LYS 98 -14.849 0.141 -7.925
699 1HE LYS 98 1HE LYS 98 -16.376 0.261 -6.113
700 2HE LYS 98 2HE LYS 98 -16.823 1.918 -6.465
701 1HZ LYS 98 1HZ LYS 98 -17.600 0.773 -8.683
702 2HZ LYS 98 2HZ LYS 98 -17.760 -0.516 -7.693
703 3HZ LYS 98 3HZ LYS 98 -18.567 0.866 -7.370
704 H LYS 99 H LYS 99 -12.709 6.763 -7.652
705 HA LYS 99 HA LYS 99 -11.178 5.453 -9.759
706 1HB LYS 99 1HB LYS 99 -13.363 7.436 -10.152
707 2HB LYS 99 2HB LYS 99 -11.905 7.681 -11.092
708 1HG LYS 99 2HG LYS 99 -12.929 6.201 -12.530
709 2HG LYS 99 1HG LYS 99 -12.188 5.009 -11.481
710 1HD LYS 99 1HD LYS 99 -14.281 4.893 -10.121
711 2HD LYS 99 2HD LYS 99 -15.024 6.098 -11.154
712 1HE LYS 99 2HE LYS 99 -15.688 4.455 -12.566
713 2HE LYS 99 1HE LYS 99 -14.010 4.088 -12.911
714 1HZ LYS 99 1HZ LYS 99 -14.070 2.742 -10.821
715 2HZ LYS 99 2HZ LYS 99 -15.694 2.912 -10.823
716 3HZ LYS 99 3HZ LYS 99 -14.951 2.152 -12.063
717 H LYS 100 H LYS 100 -10.158 6.116 -7.293
718 HA LYS 100 HA LYS 100 -8.172 7.989 -8.029
719 1HB LYS 100 1HB LYS 100 -8.802 9.446 -5.891
720 2HB LYS 100 2HB LYS 100 -9.388 9.830 -7.497
721 1HG LYS 100 1HG LYS 100 -11.430 8.314 -6.929
722 2HG LYS 100 2HG LYS 100 -10.876 8.387 -5.268
723 1HD LYS 100 1HD LYS 100 -11.241 10.945 -6.862
724 2HD LYS 100 2HD LYS 100 -12.627 10.165 -6.125
725 1HE LYS 100 1HE LYS 100 -11.411 10.216 -3.899
726 2HE LYS 100 2HE LYS 100 -10.113 11.110 -4.666
727 1HZ LYS 100 1HZ LYS 100 -12.547 12.323 -5.283
728 2HZ LYS 100 2HZ LYS 100 -12.472 12.111 -3.666
729 3HZ LYS 100 3HZ LYS 100 -11.292 12.936 -4.437
730 H LEU 101 H LEU 101 -9.918 6.280 -5.370
731 HA LEU 101 HA LEU 101 -7.373 5.853 -4.031
732 1HB LEU 101 1HB LEU 101 -10.157 5.049 -3.184
733 2HB LEU 101 2HB LEU 101 -8.704 5.009 -2.204
734 HG LEU 101 HG LEU 101 -10.266 7.406 -3.152
735 1HD1 LEU 101 1HD1 LEU 101 -10.602 6.013 -0.923
736 2HD1 LEU 101 2HD1 LEU 101 -9.252 7.033 -0.369
737 3HD1 LEU 101 3HD1 LEU 101 -10.755 7.786 -0.957
738 1HD2 LEU 101 1HD2 LEU 101 -7.856 7.796 -3.626
739 2HD2 LEU 101 2HD2 LEU 101 -8.531 8.891 -2.397
740 3HD2 LEU 101 3HD2 LEU 101 -7.509 7.520 -1.903
741 H THR 102 H THR 102 -9.835 4.196 -5.990
742 HA THR 102 HA THR 102 -8.161 1.774 -5.842
743 HB THR 102 HB THR 102 -10.208 0.469 -5.963
744 HG1 THR 102 HG1 THR 102 -11.505 1.681 -7.371
745 1HG2 THR 102 1HG2 THR 102 -9.736 1.836 -3.721
746 2HG2 THR 102 2HG2 THR 102 -11.161 2.772 -4.234
747 3HG2 THR 102 3HG2 THR 102 -11.303 1.021 -3.942
748 H GLY 103 H GLY 103 -8.768 4.408 -7.687
749 1HA GLY 103 2HA GLY 103 -8.510 4.861 -9.872
750 2HA GLY 103 1HA GLY 103 -9.510 3.458 -10.193
751 H CYS 104 H CYS 104 -8.583 1.890 -11.429
752 HA CYS 104 HA CYS 104 -6.078 0.825 -10.893
753 1HB CYS 104 1HB CYS 104 -8.149 0.527 -12.961
754 2HB CYS 104 2HB CYS 104 -6.526 0.173 -13.519
755 H LYS 105 H LYS 105 -7.235 3.101 -13.486
756 HA LYS 105 HA LYS 105 -4.454 4.012 -13.726
757 1HB LYS 105 2HB LYS 105 -4.811 4.319 -16.127
758 2HB LYS 105 1HB LYS 105 -4.994 2.640 -15.660
759 1HG LYS 105 1HG LYS 105 -7.255 2.604 -16.130
760 2HG LYS 105 2HG LYS 105 -7.509 4.246 -15.571
761 1HD LYS 105 2HD LYS 105 -7.575 4.898 -17.743
762 2HD LYS 105 1HD LYS 105 -5.861 4.548 -17.842
763 1HE LYS 105 1HE LYS 105 -6.896 3.282 -19.607
764 2HE LYS 105 2HE LYS 105 -6.475 2.118 -18.366
765 1HZ LYS 105 1HZ LYS 105 -8.971 3.012 -17.719
766 2HZ LYS 105 2HZ LYS 105 -9.017 2.805 -19.338
767 3HZ LYS 105 3HZ LYS 105 -8.591 1.563 -18.368
768 H GLY 106 H GLY 106 -4.141 6.205 -13.596
769 1HA GLY 106 2HA GLY 106 -6.272 8.058 -14.110
770 2HA GLY 106 1HA GLY 106 -4.651 8.414 -13.547
771 H SER 107 H SER 107 -4.489 6.842 -11.193
772 HA SER 107 HA SER 107 -6.627 8.051 -9.616
773 1HB SER 107 2HB SER 107 -6.602 6.178 -8.135
774 2HB SER 107 1HB SER 107 -6.595 5.496 -9.750
775 HG SER 107 HG SER 107 -4.890 4.409 -9.025
776 H ALA 108 H ALA 108 -5.699 7.956 -7.080
777 HA ALA 108 HA ALA 108 -3.544 9.821 -7.134
778 1HB ALA 108 1HB ALA 108 -3.865 9.665 -4.615
779 2HB ALA 108 3HB ALA 108 -5.147 8.471 -4.933
780 3HB ALA 108 2HB ALA 108 -5.310 10.136 -5.541
781 H CYS 109 H CYS 109 -3.640 6.489 -7.486
782 HA CYS 109 HA CYS 109 -1.146 6.130 -6.006
783 1HB CYS 109 1HB CYS 109 -3.208 4.144 -6.992
784 2HB CYS 109 2HB CYS 109 -1.618 3.655 -6.442
785 H HIS 110 H HIS 110 -2.827 5.595 -9.172
786 HA HIS 110 HA HIS 110 -0.168 5.464 -10.399
787 1HB HIS 110 1HB HIS 110 -2.739 4.108 -11.256
788 2HB HIS 110 2HB HIS 110 -1.265 4.132 -12.204
789 HD1 HIS 110 HD1 HIS 110 0.937 3.298 -10.445
790 HD2 HIS 110 HD2 HIS 110 -2.922 1.726 -9.962
791 HE1 HIS 110 HE1 HIS 110 1.215 1.094 -9.189
792 HA PRO 111 HA PRO 111 -2.110 9.192 -12.111
793 1HB PRO 111 1HB PRO 111 -0.262 11.008 -11.386
794 2HB PRO 111 2HB PRO 111 -1.350 10.288 -10.155
795 1HG PRO 111 1HG PRO 111 1.291 9.539 -11.068
796 2HG PRO 111 2HG PRO 111 1.124 9.565 -9.281
797 1HD PRO 111 1HD PRO 111 1.092 7.221 -10.649
798 2HD PRO 111 2HD PRO 111 -0.053 7.482 -9.298
799 H SER 112 H SER 112 -1.482 7.714 -14.099
800 HA SER 112 HA SER 112 0.866 8.951 -15.311
801 1HB SER 112 1HB SER 112 1.270 6.847 -16.534
802 2HB SER 112 2HB SER 112 1.308 6.575 -14.803
803 HG SER 112 HG SER 112 -0.913 6.021 -16.581
No H/Q in entry = 803
Start of MODEL 9
1 H1 VAL 1 H1 VAL 1 8.385 9.471 18.034
2 H2 VAL 1 H2 VAL 1 7.947 7.921 17.652
3 H3 VAL 1 H3 VAL 1 9.231 8.193 18.661
4 HA VAL 1 HA VAL 1 10.617 8.820 17.069
5 HB VAL 1 HB VAL 1 10.330 6.551 16.686
6 1HG1 VAL 1 1HG1 VAL 1 7.544 7.296 16.122
7 2HG1 VAL 1 2HG1 VAL 1 8.181 6.042 15.032
8 3HG1 VAL 1 3HG1 VAL 1 8.218 5.791 16.794
9 1HG2 VAL 1 1HG2 VAL 1 11.095 8.027 14.661
10 2HG2 VAL 1 2HG2 VAL 1 10.784 6.290 14.428
11 3HG2 VAL 1 3HG2 VAL 1 9.563 7.488 13.933
12 H ASP 2 H ASP 2 7.459 9.986 16.840
13 HA ASP 2 HA ASP 2 6.519 11.567 15.694
14 1HB ASP 2 1HB ASP 2 9.264 12.170 14.500
15 2HB ASP 2 2HB ASP 2 7.901 13.269 14.561
16 H VAL 3 H VAL 3 5.179 10.939 13.996
17 HA VAL 3 HA VAL 3 5.892 9.120 12.050
18 HB VAL 3 HB VAL 3 3.607 10.090 12.916
19 1HG1 VAL 3 1HG1 VAL 3 4.046 12.367 11.979
20 2HG1 VAL 3 2HG1 VAL 3 3.958 11.666 10.345
21 3HG1 VAL 3 3HG1 VAL 3 2.529 11.633 11.405
22 1HG2 VAL 3 1HG2 VAL 3 4.038 9.145 10.061
23 2HG2 VAL 3 2HG2 VAL 3 3.840 8.114 11.499
24 3HG2 VAL 3 3HG2 VAL 3 2.488 9.127 10.937
25 HA PRO 4 HA PRO 4 8.865 11.276 9.604
26 1HB PRO 4 2HB PRO 4 7.636 9.389 7.563
27 2HB PRO 4 1HB PRO 4 9.354 9.741 7.941
28 1HG PRO 4 1HG PRO 4 8.361 7.464 9.077
29 2HG PRO 4 2HG PRO 4 9.487 8.612 9.872
30 1HD PRO 4 2HD PRO 4 6.478 8.250 10.202
31 2HD PRO 4 1HD PRO 4 7.716 8.611 11.444
32 H ALA 5 H ALA 5 8.816 12.600 7.516
33 HA ALA 5 HA ALA 5 6.254 13.927 7.364
34 1HB ALA 5 1HB ALA 5 7.839 15.564 7.315
35 2HB ALA 5 3HB ALA 5 9.088 14.479 6.659
36 3HB ALA 5 2HB ALA 5 7.874 15.198 5.574
37 H ASP 6 H ASP 6 5.064 14.232 5.375
38 HA ASP 6 HA ASP 6 4.720 11.935 3.949
39 1HB ASP 6 2HB ASP 6 3.147 13.147 2.704
40 2HB ASP 6 1HB ASP 6 3.273 14.124 4.154
41 H GLY 7 H GLY 7 4.666 12.763 1.167
42 1HA GLY 7 2HA GLY 7 7.155 13.838 0.318
43 2HA GLY 7 1HA GLY 7 5.953 13.026 -0.665
44 H ALA 8 H ALA 8 5.886 10.529 0.929
45 HA ALA 8 HA ALA 8 8.618 9.547 0.665
46 1HB ALA 8 1HB ALA 8 6.142 8.766 2.144
47 2HB ALA 8 2HB ALA 8 7.842 8.747 2.670
48 3HB ALA 8 3HB ALA 8 7.219 7.448 1.625
49 H LYS 9 H LYS 9 9.012 9.263 -1.527
50 HA LYS 9 HA LYS 9 7.023 8.228 -3.265
51 1HB LYS 9 2HB LYS 9 8.492 8.718 -4.923
52 2HB LYS 9 1HB LYS 9 9.197 9.716 -3.667
53 1HG LYS 9 1HG LYS 9 11.132 8.586 -4.093
54 2HG LYS 9 2HG LYS 9 10.419 7.281 -3.166
55 1HD LYS 9 1HD LYS 9 9.445 6.326 -5.270
56 2HD LYS 9 2HD LYS 9 10.171 7.626 -6.193
57 1HE LYS 9 1HE LYS 9 11.691 5.786 -6.402
58 2HE LYS 9 2HE LYS 9 12.447 6.875 -5.255
59 1HZ LYS 9 1HZ LYS 9 10.740 5.099 -3.916
60 2HZ LYS 9 2HZ LYS 9 11.783 4.254 -4.846
61 3HZ LYS 9 3HZ LYS 9 12.349 5.307 -3.733
62 H ILE 10 H ILE 10 6.770 6.144 -4.122
63 HA ILE 10 HA ILE 10 8.382 4.086 -2.782
64 HB ILE 10 HB ILE 10 5.444 3.898 -3.449
65 1HG1 ILE 10 1HG1 ILE 10 6.546 4.114 -0.656
66 2HG1 ILE 10 2HG1 ILE 10 6.200 5.560 -1.584
67 1HG2 ILE 10 1HG2 ILE 10 7.400 1.922 -2.904
68 2HG2 ILE 10 2HG2 ILE 10 6.354 2.040 -1.469
69 3HG2 ILE 10 3HG2 ILE 10 5.639 1.724 -3.069
70 1HD1 ILE 10 1HD1 ILE 10 4.130 3.351 -1.346
71 2HD1 ILE 10 2HD1 ILE 10 4.305 4.590 -0.079
72 3HD1 ILE 10 3HD1 ILE 10 3.881 5.069 -1.740
73 H ASP 11 H ASP 11 9.538 2.874 -4.176
74 HA ASP 11 HA ASP 11 8.368 2.117 -6.650
75 1HB ASP 11 1HB ASP 11 9.211 4.203 -7.468
76 2HB ASP 11 2HB ASP 11 10.677 4.083 -6.515
77 H PHE 12 H PHE 12 8.775 -0.042 -5.851
78 HA PHE 12 HA PHE 12 11.616 -0.681 -5.473
79 1HB PHE 12 1HB PHE 12 9.033 -2.022 -4.468
80 2HB PHE 12 2HB PHE 12 10.647 -2.594 -4.098
81 HD1 PHE 12 HD1 PHE 12 12.094 -0.165 -3.410
82 HD2 PHE 12 HD2 PHE 12 8.102 -1.273 -2.490
83 HE1 PHE 12 HE1 PHE 12 12.152 1.310 -1.380
84 HE2 PHE 12 HE2 PHE 12 8.160 0.202 -0.461
85 HZ PHE 12 HZ PHE 12 10.184 1.477 0.070
86 H ILE 13 H ILE 13 8.621 -1.319 -7.230
87 HA ILE 13 HA ILE 13 9.819 -3.682 -8.458
88 HB ILE 13 HB ILE 13 7.016 -2.564 -8.529
89 1HG1 ILE 13 1HG1 ILE 13 7.914 -5.172 -7.305
90 2HG1 ILE 13 2HG1 ILE 13 7.957 -3.675 -6.394
91 1HG2 ILE 13 1HG2 ILE 13 8.300 -4.847 -10.005
92 2HG2 ILE 13 2HG2 ILE 13 6.575 -4.899 -9.567
93 3HG2 ILE 13 3HG2 ILE 13 7.192 -3.588 -10.601
94 1HD1 ILE 13 1HD1 ILE 13 5.405 -4.014 -7.827
95 2HD1 ILE 13 2HD1 ILE 13 5.736 -5.346 -6.694
96 3HD1 ILE 13 3HD1 ILE 13 5.701 -3.666 -6.106
97 H ALA 14 H ALA 14 11.354 -2.925 -9.898
98 HA ALA 14 HA ALA 14 10.803 -0.646 -11.533
99 1HB ALA 14 1HB ALA 14 13.029 -2.665 -11.241
100 2HB ALA 14 2HB ALA 14 13.064 -0.905 -10.982
101 3HB ALA 14 3HB ALA 14 12.998 -1.560 -12.636
102 H GLY 15 H GLY 15 10.671 -0.681 -13.899
103 1HA GLY 15 2HA GLY 15 8.710 -2.075 -15.019
104 2HA GLY 15 1HA GLY 15 10.016 -3.238 -15.135
105 H GLY 16 H GLY 16 10.901 -3.229 -17.151
106 1HA GLY 16 2HA GLY 16 10.593 -1.454 -19.146
107 2HA GLY 16 1HA GLY 16 12.039 -2.420 -18.934
108 H GLU 17 H GLU 17 11.528 0.462 -19.903
109 HA GLU 17 HA GLU 17 13.693 1.570 -18.361
110 1HB GLU 17 1HB GLU 17 12.455 2.114 -21.048
111 2HB GLU 17 2HB GLU 17 13.295 3.435 -20.262
112 1HG GLU 17 1HG GLU 17 14.509 0.670 -20.720
113 2HG GLU 17 2HG GLU 17 14.767 2.042 -21.780
114 H LYS 18 H LYS 18 10.836 1.305 -17.327
115 HA LYS 18 HA LYS 18 10.596 4.092 -16.508
116 1HB LYS 18 2HB LYS 18 8.216 4.149 -16.900
117 2HB LYS 18 1HB LYS 18 9.045 3.800 -18.404
118 1HG LYS 18 1HG LYS 18 8.562 1.376 -18.137
119 2HG LYS 18 2HG LYS 18 7.793 1.681 -16.592
120 1HD LYS 18 1HD LYS 18 5.848 2.376 -17.566
121 2HD LYS 18 2HD LYS 18 6.685 3.388 -18.726
122 1HE LYS 18 1HE LYS 18 6.406 1.835 -20.358
123 2HE LYS 18 2HE LYS 18 7.204 0.613 -19.388
124 1HZ LYS 18 1HZ LYS 18 4.969 0.530 -18.179
125 2HZ LYS 18 2HZ LYS 18 4.365 1.257 -19.511
126 3HZ LYS 18 3HZ LYS 18 5.095 -0.199 -19.634
127 H ASN 19 H ASN 19 8.226 3.686 -14.945
128 HA ASN 19 HA ASN 19 8.149 1.446 -13.447
129 1HB ASN 19 1HB ASN 19 9.419 2.246 -11.341
130 2HB ASN 19 2HB ASN 19 10.417 1.686 -12.668
131 2HD2 ASN 19 2HD2 ASN 19 11.780 3.109 -11.073
132 1HD2 ASN 19 1HD2 ASN 19 12.036 4.746 -11.577
133 H LEU 20 H LEU 20 6.251 1.726 -12.229
134 HA LEU 20 HA LEU 20 5.082 4.327 -12.163
135 1HB LEU 20 1HB LEU 20 4.216 1.637 -11.106
136 2HB LEU 20 2HB LEU 20 3.253 3.092 -10.954
137 HG LEU 20 HG LEU 20 4.042 1.656 -13.495
138 1HD1 LEU 20 1HD1 LEU 20 2.055 0.940 -11.987
139 2HD1 LEU 20 2HD1 LEU 20 1.253 2.387 -12.644
140 3HD1 LEU 20 3HD1 LEU 20 1.806 1.100 -13.743
141 1HD2 LEU 20 1HD2 LEU 20 2.790 4.392 -13.177
142 2HD2 LEU 20 2HD2 LEU 20 4.297 3.965 -14.023
143 3HD2 LEU 20 3HD2 LEU 20 2.728 3.440 -14.679
144 H THR 21 H THR 21 5.489 5.869 -10.681
145 HA THR 21 HA THR 21 6.546 4.978 -8.085
146 HB THR 21 HB THR 21 6.687 7.825 -9.097
147 HG1 THR 21 HG1 THR 21 8.443 7.111 -10.468
148 1HG2 THR 21 1HG2 THR 21 8.156 6.020 -7.236
149 2HG2 THR 21 2HG2 THR 21 9.210 6.974 -8.307
150 3HG2 THR 21 3HG2 THR 21 8.050 7.797 -7.236
151 H VAL 22 H VAL 22 5.083 4.824 -6.511
152 HA VAL 22 HA VAL 22 2.762 6.592 -6.663
153 HB VAL 22 HB VAL 22 3.351 4.073 -5.100
154 1HG1 VAL 22 1HG1 VAL 22 1.483 6.176 -4.510
155 2HG1 VAL 22 2HG1 VAL 22 0.587 4.717 -4.995
156 3HG1 VAL 22 3HG1 VAL 22 1.753 4.640 -3.652
157 1HG2 VAL 22 1HG2 VAL 22 2.002 4.682 -7.661
158 2HG2 VAL 22 2HG2 VAL 22 2.764 3.178 -7.089
159 3HG2 VAL 22 3HG2 VAL 22 1.109 3.589 -6.577
160 H VAL 23 H VAL 23 2.237 8.048 -5.006
161 HA VAL 23 HA VAL 23 4.453 8.543 -3.150
162 HB VAL 23 HB VAL 23 2.290 10.341 -4.259
163 1HG1 VAL 23 1HG1 VAL 23 4.464 10.917 -2.221
164 2HG1 VAL 23 2HG1 VAL 23 3.528 12.170 -3.071
165 3HG1 VAL 23 3HG1 VAL 23 2.703 11.023 -1.987
166 1HG2 VAL 23 1HG2 VAL 23 4.681 9.552 -5.408
167 2HG2 VAL 23 2HG2 VAL 23 3.759 11.020 -5.813
168 3HG2 VAL 23 3HG2 VAL 23 5.095 11.104 -4.641
169 H PHE 24 H PHE 24 4.080 8.687 -0.924
170 HA PHE 24 HA PHE 24 1.324 8.181 -0.077
171 1HB PHE 24 1HB PHE 24 2.846 6.094 -0.163
172 2HB PHE 24 2HB PHE 24 3.907 6.886 0.984
173 HD1 PHE 24 HD1 PHE 24 0.280 6.040 0.649
174 HD2 PHE 24 HD2 PHE 24 3.658 6.324 3.201
175 HE1 PHE 24 HE1 PHE 24 -1.075 5.108 2.545
176 HE2 PHE 24 HE2 PHE 24 2.304 5.392 5.097
177 HZ PHE 24 HZ PHE 24 -0.047 4.796 4.747
178 H ASN 25 H ASN 25 0.807 8.955 2.066
179 HA ASN 25 HA ASN 25 2.887 10.623 3.223
180 1HB ASN 25 1HB ASN 25 1.352 12.099 1.922
181 2HB ASN 25 2HB ASN 25 -0.035 11.418 2.749
182 2HD2 ASN 25 2HD2 ASN 25 -0.201 13.854 3.060
183 1HD2 ASN 25 1HD2 ASN 25 0.446 14.507 4.529
184 H HIS 26 H HIS 26 2.768 10.713 5.561
185 HA HIS 26 HA HIS 26 1.105 8.647 6.699
186 1HB HIS 26 1HB HIS 26 3.533 10.170 7.517
187 2HB HIS 26 2HB HIS 26 2.491 9.586 8.799
188 HD1 HIS 26 HD1 HIS 26 4.680 8.347 5.965
189 HD2 HIS 26 HD2 HIS 26 2.565 6.824 9.252
190 HE1 HIS 26 HE1 HIS 26 5.411 5.916 6.221
191 H SER 27 H SER 27 1.130 12.104 6.256
192 HA SER 27 HA SER 27 -0.502 12.607 8.540
193 1HB SER 27 2HB SER 27 -0.405 14.650 6.385
194 2HB SER 27 1HB SER 27 -0.104 14.823 8.102
195 HG SER 27 HG SER 27 1.692 14.330 6.008
196 H THR 28 H THR 28 -1.144 10.884 5.869
197 HA THR 28 HA THR 28 -3.740 12.143 5.317
198 HB THR 28 HB THR 28 -2.108 10.023 3.821
199 HG1 THR 28 HG1 THR 28 -1.441 12.401 3.972
200 1HG2 THR 28 1HG2 THR 28 -4.742 10.127 3.532
201 2HG2 THR 28 2HG2 THR 28 -4.407 11.670 2.709
202 3HG2 THR 28 3HG2 THR 28 -3.715 10.156 2.078
203 H HIS 29 H HIS 29 -2.156 9.126 6.438
204 HA HIS 29 HA HIS 29 -4.825 8.082 7.000
205 1HB HIS 29 1HB HIS 29 -2.165 6.630 7.006
206 2HB HIS 29 2HB HIS 29 -3.749 5.905 7.195
207 HD1 HIS 29 HD1 HIS 29 -1.540 7.556 4.592
208 HD2 HIS 29 HD2 HIS 29 -5.148 5.428 4.821
209 HE1 HIS 29 HE1 HIS 29 -2.192 6.993 2.190
210 H LYS 30 H LYS 30 -3.350 10.268 8.504
211 HA LYS 30 HA LYS 30 -2.271 9.281 10.856
212 1HB LYS 30 2HB LYS 30 -2.602 11.504 11.729
213 2HB LYS 30 1HB LYS 30 -2.084 11.609 10.058
214 1HG LYS 30 1HG LYS 30 -4.655 11.687 9.497
215 2HG LYS 30 2HG LYS 30 -4.863 12.068 11.195
216 1HD LYS 30 1HD LYS 30 -2.941 13.870 10.689
217 2HD LYS 30 2HD LYS 30 -3.501 13.688 9.039
218 1HE LYS 30 1HE LYS 30 -5.858 13.908 10.635
219 2HE LYS 30 2HE LYS 30 -4.754 15.123 11.248
220 1HZ LYS 30 1HZ LYS 30 -4.456 15.445 8.645
221 2HZ LYS 30 2HZ LYS 30 -6.012 14.951 8.675
222 3HZ LYS 30 3HZ LYS 30 -5.557 16.267 9.528
223 H ASP 31 H ASP 31 -5.518 9.161 9.644
224 HA ASP 31 HA ASP 31 -6.661 8.992 12.265
225 1HB ASP 31 1HB ASP 31 -8.121 9.990 10.691
226 2HB ASP 31 2HB ASP 31 -7.684 8.864 9.422
227 H VAL 32 H VAL 32 -4.779 6.989 10.383
228 HA VAL 32 HA VAL 32 -6.255 4.572 11.169
229 HB VAL 32 HB VAL 32 -4.163 4.859 9.009
230 1HG1 VAL 32 1HG1 VAL 32 -4.994 2.592 10.256
231 2HG1 VAL 32 2HG1 VAL 32 -6.181 2.690 8.934
232 3HG1 VAL 32 3HG1 VAL 32 -4.440 2.657 8.566
233 1HG2 VAL 32 1HG2 VAL 32 -6.273 6.227 8.620
234 2HG2 VAL 32 2HG2 VAL 32 -5.879 5.019 7.373
235 3HG2 VAL 32 3HG2 VAL 32 -7.155 4.682 8.568
236 H LYS 33 H LYS 33 -5.312 3.200 12.622
237 HA LYS 33 HA LYS 33 -3.214 4.032 14.181
238 1HB LYS 33 1HB LYS 33 -4.118 1.181 13.680
239 2HB LYS 33 2HB LYS 33 -3.200 1.748 15.060
240 1HG LYS 33 1HG LYS 33 -5.254 3.489 15.250
241 2HG LYS 33 2HG LYS 33 -6.097 2.224 14.378
242 1HD LYS 33 1HD LYS 33 -5.347 0.564 16.129
243 2HD LYS 33 2HD LYS 33 -4.596 1.875 17.017
244 1HE LYS 33 1HE LYS 33 -7.546 1.948 16.258
245 2HE LYS 33 2HE LYS 33 -6.995 1.171 17.729
246 1HZ LYS 33 1HZ LYS 33 -5.745 3.496 17.880
247 2HZ LYS 33 2HZ LYS 33 -7.091 3.962 17.081
248 3HZ LYS 33 3HZ LYS 33 -7.217 3.223 18.532
249 H CYS 34 H CYS 34 -1.021 3.004 14.453
250 HA CYS 34 HA CYS 34 0.316 3.129 11.950
251 1HB CYS 34 1HB CYS 34 1.519 2.283 14.584
252 2HB CYS 34 2HB CYS 34 2.333 2.974 13.194
253 H ASP 35 H ASP 35 -0.620 0.614 14.355
254 HA ASP 35 HA ASP 35 0.813 -1.447 13.149
255 1HB ASP 35 1HB ASP 35 -0.770 -2.928 14.464
256 2HB ASP 35 2HB ASP 35 0.037 -1.703 15.423
257 H ASP 36 H ASP 36 -1.850 0.380 12.080
258 HA ASP 36 HA ASP 36 -3.500 -1.581 11.017
259 1HB ASP 36 1HB ASP 36 -3.783 1.040 11.308
260 2HB ASP 36 2HB ASP 36 -3.079 1.121 9.705
261 H CYS 37 H CYS 37 -0.333 -0.412 10.168
262 HA CYS 37 HA CYS 37 -0.524 -1.821 7.613
263 1HB CYS 37 1HB CYS 37 0.840 0.847 8.091
264 2HB CYS 37 2HB CYS 37 1.088 -0.138 6.663
265 H HIS 38 H HIS 38 1.583 -0.398 10.205
266 HA HIS 38 HA HIS 38 3.737 -2.149 9.543
267 1HB HIS 38 1HB HIS 38 3.317 -0.320 11.924
268 2HB HIS 38 2HB HIS 38 4.813 -1.142 11.528
269 HD1 HIS 38 HD1 HIS 38 5.799 -0.477 9.003
270 HD2 HIS 38 HD2 HIS 38 3.110 2.177 10.824
271 HE1 HIS 38 HE1 HIS 38 6.090 1.762 7.815
272 H HIS 39 H HIS 39 2.192 -4.099 9.658
273 HA HIS 39 HA HIS 39 1.412 -4.899 12.282
274 1HB HIS 39 1HB HIS 39 0.397 -6.729 11.252
275 2HB HIS 39 2HB HIS 39 0.239 -5.435 10.082
276 HD1 HIS 39 HD1 HIS 39 1.531 -8.854 10.483
277 HD2 HIS 39 HD2 HIS 39 2.169 -5.639 7.865
278 HE1 HIS 39 HE1 HIS 39 2.700 -9.823 8.432
279 H GLN 40 H GLN 40 3.904 -4.365 12.825
280 HA GLN 40 HA GLN 40 5.178 -6.982 12.818
281 1HB GLN 40 1HB GLN 40 6.377 -4.308 12.067
282 2HB GLN 40 2HB GLN 40 7.398 -5.535 12.788
283 1HG GLN 40 1HG GLN 40 5.716 -5.868 10.260
284 2HG GLN 40 2HG GLN 40 7.458 -5.689 10.317
285 2HE2 GLN 40 2HE2 GLN 40 4.883 -7.819 10.282
286 1HE2 GLN 40 1HE2 GLN 40 5.686 -9.290 10.724
287 HA PRO 41 HA PRO 41 5.556 -6.621 17.157
288 1HB PRO 41 1HB PRO 41 8.110 -7.604 17.568
289 2HB PRO 41 2HB PRO 41 6.712 -8.627 17.103
290 1HG PRO 41 2HG PRO 41 8.726 -7.296 15.231
291 2HG PRO 41 1HG PRO 41 8.419 -9.058 15.098
292 1HD PRO 41 1HD PRO 41 7.024 -7.568 13.483
293 2HD PRO 41 2HD PRO 41 6.041 -8.587 14.578
294 H GLY 42 H GLY 42 6.524 -5.258 18.839
295 1HA GLY 42 2HA GLY 42 7.658 -3.483 19.637
296 2HA GLY 42 1HA GLY 42 7.269 -2.736 18.100
297 H ASP 43 H ASP 43 9.526 -1.758 18.980
298 HA ASP 43 HA ASP 43 11.695 -1.602 18.808
299 1HB ASP 43 1HB ASP 43 11.383 -4.404 19.043
300 2HB ASP 43 2HB ASP 43 12.400 -4.204 17.631
301 H LYS 44 H LYS 44 10.862 -4.085 16.261
302 HA LYS 44 HA LYS 44 11.846 -2.185 14.254
303 1HB LYS 44 1HB LYS 44 13.013 -4.428 14.574
304 2HB LYS 44 2HB LYS 44 11.564 -5.182 13.941
305 1HG LYS 44 1HG LYS 44 12.631 -4.893 11.923
306 2HG LYS 44 2HG LYS 44 11.917 -3.295 12.015
307 1HD LYS 44 2HD LYS 44 13.999 -2.402 11.960
308 2HD LYS 44 1HD LYS 44 14.319 -3.121 13.526
309 1HE LYS 44 1HE LYS 44 14.538 -4.952 11.156
310 2HE LYS 44 2HE LYS 44 15.769 -3.712 11.295
311 1HZ LYS 44 1HZ LYS 44 15.072 -5.357 13.605
312 2HZ LYS 44 2HZ LYS 44 16.122 -5.908 12.481
313 3HZ LYS 44 3HZ LYS 44 16.457 -4.543 13.312
314 H GLN 45 H GLN 45 9.127 -2.325 15.634
315 HA GLN 45 HA GLN 45 7.216 -3.465 14.135
316 1HB GLN 45 1HB GLN 45 6.854 -2.174 16.240
317 2HB GLN 45 2HB GLN 45 7.116 -0.676 15.369
318 1HG GLN 45 1HG GLN 45 5.089 -0.833 14.193
319 2HG GLN 45 2HG GLN 45 5.033 -2.581 14.302
320 2HE2 GLN 45 2HE2 GLN 45 2.800 -2.094 14.918
321 1HE2 GLN 45 1HE2 GLN 45 2.418 -1.805 16.583
322 H TYR 46 H TYR 46 9.043 -0.508 13.479
323 HA TYR 46 HA TYR 46 7.592 -0.151 10.912
324 1HB TYR 46 1HB TYR 46 9.618 1.724 12.142
325 2HB TYR 46 2HB TYR 46 8.375 2.081 10.931
326 HD1 TYR 46 HD1 TYR 46 5.966 2.162 11.605
327 HD2 TYR 46 HD2 TYR 46 9.141 1.814 14.477
328 HE1 TYR 46 HE1 TYR 46 4.417 2.877 13.404
329 HE2 TYR 46 HE2 TYR 46 7.591 2.530 16.277
330 HH TYR 46 HH TYR 46 4.291 3.628 15.616
331 H ALA 47 H ALA 47 8.605 -1.833 9.646
332 HA ALA 47 HA ALA 47 11.404 -1.200 9.045
333 1HB ALA 47 1HB ALA 47 10.323 -3.619 10.251
334 2HB ALA 47 3HB ALA 47 12.018 -3.162 9.958
335 3HB ALA 47 2HB ALA 47 11.083 -3.976 8.682
336 H GLY 48 H GLY 48 11.982 -2.556 6.897
337 1HA GLY 48 2HA GLY 48 11.658 -2.613 4.670
338 2HA GLY 48 1HA GLY 48 10.311 -1.510 4.872
339 H CYS 49 H CYS 49 8.745 -2.465 3.573
340 HA CYS 49 HA CYS 49 7.486 -4.775 4.641
341 1HB CYS 49 1HB CYS 49 6.872 -3.459 1.997
342 2HB CYS 49 2HB CYS 49 5.810 -4.436 2.992
343 H THR 50 H THR 50 9.819 -3.988 2.082
344 HA THR 50 HA THR 50 9.568 -6.649 0.912
345 HB THR 50 HB THR 50 11.169 -5.650 -0.763
346 HG1 THR 50 HG1 THR 50 12.279 -4.157 0.582
347 1HG2 THR 50 1HG2 THR 50 8.523 -4.463 -0.087
348 2HG2 THR 50 2HG2 THR 50 9.592 -3.374 -1.004
349 3HG2 THR 50 3HG2 THR 50 9.161 -4.967 -1.670
350 H THR 51 H THR 51 10.557 -6.115 3.740
351 HA THR 51 HA THR 51 13.363 -6.626 3.658
352 HB THR 51 HB THR 51 11.294 -6.942 5.897
353 HG1 THR 51 HG1 THR 51 11.748 -4.826 4.535
354 1HG2 THR 51 1HG2 THR 51 14.330 -6.755 5.792
355 2HG2 THR 51 2HG2 THR 51 13.439 -6.134 7.202
356 3HG2 THR 51 3HG2 THR 51 13.322 -7.855 6.762
357 H ASP 52 H ASP 52 14.457 -8.563 4.400
358 HA ASP 52 HA ASP 52 13.693 -10.761 3.003
359 1HB ASP 52 1HB ASP 52 15.930 -10.140 4.240
360 2HB ASP 52 2HB ASP 52 15.228 -10.965 5.618
361 H GLY 53 H GLY 53 12.863 -12.908 3.777
362 1HA GLY 53 2HA GLY 53 11.925 -13.443 6.332
363 2HA GLY 53 1HA GLY 53 11.368 -14.196 4.850
364 H CYS 54 H CYS 54 10.561 -11.435 3.743
365 HA CYS 54 HA CYS 54 8.005 -11.375 5.138
366 1HB CYS 54 2HB CYS 54 9.458 -8.822 4.393
367 2HB CYS 54 1HB CYS 54 7.950 -8.979 5.272
368 H HIS 55 H HIS 55 7.918 -8.745 3.206
369 HA HIS 55 HA HIS 55 6.933 -10.307 0.964
370 1HB HIS 55 1HB HIS 55 6.637 -7.330 1.392
371 2HB HIS 55 2HB HIS 55 5.695 -8.370 0.343
372 HD1 HIS 55 HD1 HIS 55 4.107 -10.185 1.630
373 HD2 HIS 55 HD2 HIS 55 5.618 -7.022 3.935
374 HE1 HIS 55 HE1 HIS 55 2.674 -10.089 3.739
375 H ASN 56 H ASN 56 9.628 -10.552 1.024
376 HA ASN 56 HA ASN 56 10.780 -8.412 -0.492
377 1HB ASN 56 1HB ASN 56 12.070 -9.666 1.286
378 2HB ASN 56 2HB ASN 56 11.941 -11.128 0.328
379 2HD2 ASN 56 2HD2 ASN 56 14.314 -9.771 1.189
380 1HD2 ASN 56 1HD2 ASN 56 15.217 -9.307 -0.215
381 H ILE 57 H ILE 57 8.917 -9.040 -2.190
382 HA ILE 57 HA ILE 57 10.139 -10.913 -4.081
383 HB ILE 57 HB ILE 57 7.182 -10.760 -3.491
384 1HG1 ILE 57 1HG1 ILE 57 8.769 -11.787 -1.694
385 2HG1 ILE 57 2HG1 ILE 57 7.310 -12.637 -2.165
386 1HG2 ILE 57 1HG2 ILE 57 7.726 -11.328 -5.813
387 2HG2 ILE 57 2HG2 ILE 57 8.771 -12.652 -5.246
388 3HG2 ILE 57 3HG2 ILE 57 7.018 -12.711 -4.944
389 1HD1 ILE 57 1HD1 ILE 57 10.022 -13.161 -3.457
390 2HD1 ILE 57 2HD1 ILE 57 9.401 -14.083 -2.067
391 3HD1 ILE 57 3HD1 ILE 57 8.541 -14.134 -3.624
392 H LEU 58 H LEU 58 10.716 -9.778 -5.847
393 HA LEU 58 HA LEU 58 9.107 -7.409 -6.477
394 1HB LEU 58 2HB LEU 58 11.931 -8.066 -7.323
395 2HB LEU 58 1HB LEU 58 11.061 -6.577 -7.637
396 HG LEU 58 HG LEU 58 11.915 -7.600 -4.915
397 1HD1 LEU 58 1HD1 LEU 58 13.018 -5.472 -6.749
398 2HD1 LEU 58 2HD1 LEU 58 13.341 -5.484 -4.999
399 3HD1 LEU 58 3HD1 LEU 58 13.857 -6.856 -6.009
400 1HD2 LEU 58 1HD2 LEU 58 9.847 -5.756 -5.614
401 2HD2 LEU 58 2HD2 LEU 58 10.426 -6.237 -4.001
402 3HD2 LEU 58 3HD2 LEU 58 11.175 -4.858 -4.840
403 H ASP 59 H ASP 59 7.451 -8.856 -7.424
404 HA ASP 59 HA ASP 59 7.984 -9.149 -10.190
405 1HB ASP 59 1HB ASP 59 8.719 -11.354 -8.824
406 2HB ASP 59 2HB ASP 59 6.999 -11.686 -8.884
407 H LYS 60 H LYS 60 6.030 -8.560 -11.163
408 HA LYS 60 HA LYS 60 3.673 -8.494 -9.483
409 1HB LYS 60 2HB LYS 60 4.106 -7.450 -12.298
410 2HB LYS 60 1HB LYS 60 2.723 -7.128 -11.272
411 1HG LYS 60 1HG LYS 60 3.854 -5.588 -9.997
412 2HG LYS 60 2HG LYS 60 5.329 -6.534 -9.975
413 1HD LYS 60 1HD LYS 60 4.437 -5.141 -12.523
414 2HD LYS 60 2HD LYS 60 5.298 -4.251 -11.283
415 1HE LYS 60 1HE LYS 60 7.115 -6.054 -11.373
416 2HE LYS 60 2HE LYS 60 6.286 -6.735 -12.758
417 1HZ LYS 60 1HZ LYS 60 6.444 -4.325 -13.618
418 2HZ LYS 60 2HZ LYS 60 7.665 -4.187 -12.541
419 3HZ LYS 60 3HZ LYS 60 7.744 -5.308 -13.726
420 H ALA 61 H ALA 61 4.426 -11.117 -9.856
421 HA ALA 61 HA ALA 61 2.130 -12.267 -10.851
422 1HB ALA 61 1HB ALA 61 4.119 -13.115 -12.832
423 2HB ALA 61 3HB ALA 61 2.425 -12.618 -13.059
424 3HB ALA 61 2HB ALA 61 3.710 -11.389 -12.975
425 H ASP 62 H ASP 62 3.229 -12.717 -8.526
426 HA ASP 62 HA ASP 62 4.875 -15.095 -8.894
427 1HB ASP 62 1HB ASP 62 5.803 -13.090 -7.560
428 2HB ASP 62 2HB ASP 62 4.577 -13.431 -6.354
429 H LYS 63 H LYS 63 4.533 -16.556 -6.680
430 HA LYS 63 HA LYS 63 1.676 -16.568 -6.041
431 1HB LYS 63 1HB LYS 63 2.664 -18.292 -7.884
432 2HB LYS 63 2HB LYS 63 2.967 -19.214 -6.425
433 1HG LYS 63 1HG LYS 63 0.426 -18.371 -5.890
434 2HG LYS 63 2HG LYS 63 0.355 -18.382 -7.641
435 1HD LYS 63 1HD LYS 63 1.391 -20.773 -7.491
436 2HD LYS 63 2HD LYS 63 0.988 -20.710 -5.786
437 1HE LYS 63 1HE LYS 63 -1.417 -20.170 -6.449
438 2HE LYS 63 2HE LYS 63 -0.964 -20.439 -8.120
439 1HZ LYS 63 1HZ LYS 63 -0.665 -22.428 -5.978
440 2HZ LYS 63 2HZ LYS 63 -1.879 -22.406 -7.070
441 3HZ LYS 63 3HZ LYS 63 -0.344 -22.669 -7.561
442 H SER 64 H SER 64 2.277 -15.549 -4.040
443 HA SER 64 HA SER 64 2.780 -17.384 -2.028
444 1HB SER 64 2HB SER 64 4.983 -16.590 -1.209
445 2HB SER 64 1HB SER 64 5.113 -17.332 -2.792
446 HG SER 64 HG SER 64 4.652 -14.532 -2.761
447 H VAL 65 H VAL 65 2.922 -16.224 0.172
448 HA VAL 65 HA VAL 65 1.253 -13.872 0.021
449 HB VAL 65 HB VAL 65 0.638 -15.625 1.535
450 1HG1 VAL 65 1HG1 VAL 65 3.502 -15.455 2.376
451 2HG1 VAL 65 2HG1 VAL 65 2.291 -15.879 3.610
452 3HG1 VAL 65 3HG1 VAL 65 2.457 -16.877 2.145
453 1HG2 VAL 65 1HG2 VAL 65 0.845 -12.964 2.223
454 2HG2 VAL 65 2HG2 VAL 65 -0.053 -14.202 3.133
455 3HG2 VAL 65 3HG2 VAL 65 1.610 -13.780 3.608
456 H ASN 66 H ASN 66 4.392 -14.208 -0.559
457 HA ASN 66 HA ASN 66 5.221 -12.094 1.249
458 1HB ASN 66 1HB ASN 66 6.870 -13.850 -0.646
459 2HB ASN 66 2HB ASN 66 7.542 -12.670 0.462
460 2HD2 ASN 66 2HD2 ASN 66 8.706 -14.101 1.651
461 1HD2 ASN 66 1HD2 ASN 66 8.019 -15.283 2.714
462 H SER 67 H SER 67 3.521 -12.121 -1.434
463 HA SER 67 HA SER 67 5.201 -10.745 -3.259
464 1HB SER 67 1HB SER 67 2.827 -10.306 -4.346
465 2HB SER 67 2HB SER 67 3.530 -11.911 -4.380
466 HG SER 67 HG SER 67 1.335 -12.018 -3.674
467 H TRP 68 H TRP 68 5.419 -8.517 -3.552
468 HA TRP 68 HA TRP 68 4.147 -6.866 -1.516
469 1HB TRP 68 1HB TRP 68 6.435 -6.503 -1.530
470 2HB TRP 68 2HB TRP 68 6.555 -6.592 -3.276
471 HD1 TRP 68 HD1 TRP 68 6.781 -4.261 -4.436
472 HE1 TRP 68 HE1 TRP 68 6.308 -1.724 -3.885
473 HE3 TRP 68 HE3 TRP 68 4.576 -5.106 0.067
474 HZ2 TRP 68 HZ2 TRP 68 5.092 -0.386 -1.678
475 HZ3 TRP 68 HZ3 TRP 68 3.774 -3.129 1.357
476 HH2 TRP 68 HH2 TRP 68 4.002 -0.833 0.552
477 H TYR 69 H TYR 69 3.047 -8.135 -4.136
478 HA TYR 69 HA TYR 69 1.897 -5.608 -5.226
479 1HB TYR 69 1HB TYR 69 3.351 -6.496 -6.898
480 2HB TYR 69 2HB TYR 69 2.768 -8.147 -6.628
481 HD1 TYR 69 HD1 TYR 69 0.440 -8.771 -7.333
482 HD2 TYR 69 HD2 TYR 69 2.235 -5.014 -8.389
483 HE1 TYR 69 HE1 TYR 69 -1.248 -8.468 -9.124
484 HE2 TYR 69 HE2 TYR 69 0.547 -4.711 -10.180
485 HH TYR 69 HH TYR 69 -2.133 -5.863 -10.479
486 H LYS 70 H LYS 70 1.283 -8.344 -3.356
487 HA LYS 70 HA LYS 70 -1.444 -8.555 -4.420
488 1HB LYS 70 1HB LYS 70 0.070 -10.616 -4.298
489 2HB LYS 70 2HB LYS 70 -0.082 -10.508 -2.556
490 1HG LYS 70 1HG LYS 70 -2.717 -10.297 -3.231
491 2HG LYS 70 2HG LYS 70 -2.152 -11.227 -4.605
492 1HD LYS 70 1HD LYS 70 -1.349 -12.068 -1.806
493 2HD LYS 70 2HD LYS 70 -2.950 -12.466 -2.398
494 1HE LYS 70 1HE LYS 70 -0.280 -13.280 -3.631
495 2HE LYS 70 2HE LYS 70 -1.472 -14.338 -2.903
496 1HZ LYS 70 1HZ LYS 70 -2.998 -13.372 -4.692
497 2HZ LYS 70 2HZ LYS 70 -1.621 -12.926 -5.448
498 3HZ LYS 70 3HZ LYS 70 -1.903 -14.502 -5.129
499 H VAL 71 H VAL 71 0.594 -7.908 -1.549
500 HA VAL 71 HA VAL 71 -1.635 -7.673 0.208
501 HB VAL 71 HB VAL 71 0.062 -6.750 1.750
502 1HG1 VAL 71 1HG1 VAL 71 -0.337 -9.275 1.190
503 2HG1 VAL 71 2HG1 VAL 71 1.286 -9.179 0.464
504 3HG1 VAL 71 3HG1 VAL 71 1.058 -8.800 2.188
505 1HG2 VAL 71 1HG2 VAL 71 1.483 -6.244 -0.689
506 2HG2 VAL 71 2HG2 VAL 71 1.906 -5.770 0.974
507 3HG2 VAL 71 3HG2 VAL 71 2.456 -7.335 0.327
508 H VAL 72 H VAL 72 -0.720 -5.868 -2.438
509 HA VAL 72 HA VAL 72 -1.511 -3.341 -1.178
510 HB VAL 72 HB VAL 72 -0.028 -3.984 -3.730
511 1HG1 VAL 72 1HG1 VAL 72 -1.268 -1.418 -2.763
512 2HG1 VAL 72 2HG1 VAL 72 0.232 -1.379 -3.721
513 3HG1 VAL 72 3HG1 VAL 72 -1.238 -2.120 -4.398
514 1HG2 VAL 72 1HG2 VAL 72 1.278 -4.151 -1.635
515 2HG2 VAL 72 2HG2 VAL 72 1.836 -2.819 -2.675
516 3HG2 VAL 72 3HG2 VAL 72 0.839 -2.471 -1.242
517 H HIS 73 H HIS 73 -2.000 -5.333 -4.178
518 HA HIS 73 HA HIS 73 -4.513 -3.940 -4.580
519 1HB HIS 73 2HB HIS 73 -3.167 -6.010 -6.334
520 2HB HIS 73 1HB HIS 73 -4.525 -4.990 -6.766
521 HD1 HIS 73 HD1 HIS 73 -0.789 -4.876 -6.207
522 HD2 HIS 73 HD2 HIS 73 -3.876 -2.359 -7.521
523 HE1 HIS 73 HE1 HIS 73 0.343 -2.825 -7.218
524 H ASP 74 H ASP 74 -3.984 -5.867 -2.302
525 HA ASP 74 HA ASP 74 -5.283 -8.261 -2.937
526 1HB ASP 74 1HB ASP 74 -3.881 -7.201 -0.757
527 2HB ASP 74 2HB ASP 74 -5.510 -7.346 -0.129
528 H ALA 75 H ALA 75 -7.512 -8.852 -2.602
529 HA ALA 75 HA ALA 75 -9.275 -6.669 -1.735
530 1HB ALA 75 1HB ALA 75 -9.309 -8.323 -4.246
531 2HB ALA 75 3HB ALA 75 -10.860 -7.832 -3.522
532 3HB ALA 75 2HB ALA 75 -9.677 -6.597 -4.017
533 H LYS 76 H LYS 76 -7.977 -9.190 -0.498
534 HA LYS 76 HA LYS 76 -10.520 -10.383 0.354
535 1HB LYS 76 1HB LYS 76 -8.990 -11.800 -1.199
536 2HB LYS 76 2HB LYS 76 -7.957 -11.962 0.207
537 1HG LYS 76 1HG LYS 76 -10.141 -12.666 1.478
538 2HG LYS 76 2HG LYS 76 -10.839 -12.876 -0.115
539 1HD LYS 76 1HD LYS 76 -9.576 -14.750 -0.579
540 2HD LYS 76 2HD LYS 76 -8.154 -14.126 0.234
541 1HE LYS 76 1HE LYS 76 -8.863 -15.953 1.595
542 2HE LYS 76 2HE LYS 76 -9.410 -14.530 2.459
543 1HZ LYS 76 1HZ LYS 76 -11.135 -15.948 0.562
544 2HZ LYS 76 2HZ LYS 76 -11.068 -16.346 2.144
545 3HZ LYS 76 3HZ LYS 76 -11.576 -14.859 1.696
546 H GLY 77 H GLY 77 -10.552 -11.128 2.598
547 1HA GLY 77 2HA GLY 77 -10.298 -9.946 4.675
548 2HA GLY 77 1HA GLY 77 -8.636 -9.594 4.246
549 H GLY 78 H GLY 78 -8.893 -10.703 6.675
550 1HA GLY 78 2HA GLY 78 -8.144 -13.535 6.260
551 2HA GLY 78 1HA GLY 78 -9.139 -13.003 7.600
552 H ALA 79 H ALA 79 -7.786 -10.488 8.167
553 HA ALA 79 HA ALA 79 -6.051 -11.100 10.072
554 1HB ALA 79 1HB ALA 79 -3.812 -10.596 8.622
555 2HB ALA 79 3HB ALA 79 -4.764 -11.490 7.413
556 3HB ALA 79 2HB ALA 79 -4.394 -12.239 8.984
557 H LYS 80 H LYS 80 -5.970 -9.086 7.048
558 HA LYS 80 HA LYS 80 -6.668 -6.758 8.496
559 1HB LYS 80 1HB LYS 80 -4.371 -5.645 7.741
560 2HB LYS 80 2HB LYS 80 -4.588 -6.374 9.319
561 1HG LYS 80 1HG LYS 80 -3.711 -8.568 8.312
562 2HG LYS 80 2HG LYS 80 -3.302 -7.661 6.870
563 1HD LYS 80 2HD LYS 80 -2.185 -7.278 9.679
564 2HD LYS 80 1HD LYS 80 -1.307 -7.754 8.239
565 1HE LYS 80 2HE LYS 80 -0.756 -5.500 8.262
566 2HE LYS 80 1HE LYS 80 -2.224 -5.406 7.309
567 1HZ LYS 80 1HZ LYS 80 -2.233 -5.143 10.229
568 2HZ LYS 80 2HZ LYS 80 -2.077 -3.862 9.229
569 3HZ LYS 80 3HZ LYS 80 -3.436 -4.767 9.192
570 HA PRO 81 HA PRO 81 -7.811 -5.595 4.438
571 1HB PRO 81 1HB PRO 81 -7.898 -2.864 4.673
572 2HB PRO 81 2HB PRO 81 -9.028 -3.947 5.548
573 1HG PRO 81 1HG PRO 81 -6.678 -2.654 6.363
574 2HG PRO 81 2HG PRO 81 -8.130 -2.757 7.411
575 1HD PRO 81 1HD PRO 81 -5.913 -4.336 7.799
576 2HD PRO 81 2HD PRO 81 -7.566 -4.957 8.092
577 H THR 82 H THR 82 -7.094 -3.527 2.775
578 HA THR 82 HA THR 82 -4.177 -3.381 2.817
579 HB THR 82 HB THR 82 -4.192 -4.123 0.381
580 HG1 THR 82 HG1 THR 82 -6.370 -5.411 0.089
581 1HG2 THR 82 1HG2 THR 82 -4.275 -5.767 2.653
582 2HG2 THR 82 2HG2 THR 82 -5.573 -6.426 1.629
583 3HG2 THR 82 3HG2 THR 82 -3.912 -6.318 0.999
584 H CYS 83 H CYS 83 -3.835 -2.191 0.305
585 HA CYS 83 HA CYS 83 -4.762 0.419 0.954
586 1HB CYS 83 1HB CYS 83 -3.406 -0.321 -1.624
587 2HB CYS 83 2HB CYS 83 -3.359 1.196 -0.748
588 H ILE 84 H ILE 84 -6.215 -2.259 -0.450
589 HA ILE 84 HA ILE 84 -7.831 -0.589 -2.247
590 HB ILE 84 HB ILE 84 -6.893 -3.421 -2.388
591 1HG1 ILE 84 1HG1 ILE 84 -5.722 -1.610 -3.606
592 2HG1 ILE 84 2HG1 ILE 84 -6.373 -2.846 -4.664
593 1HG2 ILE 84 1HG2 ILE 84 -9.505 -2.378 -3.489
594 2HG2 ILE 84 2HG2 ILE 84 -8.646 -3.764 -4.203
595 3HG2 ILE 84 3HG2 ILE 84 -9.207 -3.838 -2.515
596 1HD1 ILE 84 1HD1 ILE 84 -8.435 -0.882 -4.314
597 2HD1 ILE 84 2HD1 ILE 84 -6.921 -0.016 -4.670
598 3HD1 ILE 84 3HD1 ILE 84 -7.520 -1.260 -5.794
599 H SER 85 H SER 85 -7.844 -3.177 0.266
600 HA SER 85 HA SER 85 -10.536 -3.541 0.416
601 1HB SER 85 1HB SER 85 -8.380 -4.525 1.748
602 2HB SER 85 2HB SER 85 -9.015 -3.474 2.998
603 HG SER 85 HG SER 85 -9.872 -5.924 2.360
604 H CYS 86 H CYS 86 -8.527 -1.369 2.550
605 HA CYS 86 HA CYS 86 -10.693 -0.153 3.772
606 1HB CYS 86 1HB CYS 86 -8.243 -0.118 4.483
607 2HB CYS 86 2HB CYS 86 -8.003 1.160 3.308
608 H HIS 87 H HIS 87 -8.554 1.026 1.064
609 HA HIS 87 HA HIS 87 -9.837 3.337 0.495
610 1HB HIS 87 1HB HIS 87 -8.322 1.352 -1.164
611 2HB HIS 87 2HB HIS 87 -9.113 2.693 -1.967
612 HD1 HIS 87 HD1 HIS 87 -6.979 3.957 -2.607
613 HD2 HIS 87 HD2 HIS 87 -7.279 3.176 1.503
614 HE1 HIS 87 HE1 HIS 87 -5.125 5.305 -1.486
615 H LYS 88 H LYS 88 -10.785 -0.007 -0.396
616 HA LYS 88 HA LYS 88 -12.796 0.677 -2.199
617 1HB LYS 88 1HB LYS 88 -12.036 -1.719 -0.601
618 2HB LYS 88 2HB LYS 88 -13.676 -1.670 -1.216
619 1HG LYS 88 1HG LYS 88 -12.805 -1.235 -3.519
620 2HG LYS 88 2HG LYS 88 -11.163 -1.267 -2.908
621 1HD LYS 88 2HD LYS 88 -11.179 -3.499 -3.340
622 2HD LYS 88 1HD LYS 88 -12.209 -3.665 -1.932
623 1HE LYS 88 1HE LYS 88 -13.561 -4.689 -3.528
624 2HE LYS 88 2HE LYS 88 -14.155 -3.045 -3.654
625 1HZ LYS 88 1HZ LYS 88 -12.097 -3.016 -5.339
626 2HZ LYS 88 2HZ LYS 88 -12.611 -4.555 -5.525
627 3HZ LYS 88 3HZ LYS 88 -13.640 -3.314 -5.785
628 H ASP 89 H ASP 89 -12.862 0.143 1.380
629 HA ASP 89 HA ASP 89 -15.553 0.410 1.711
630 1HB ASP 89 1HB ASP 89 -13.511 -0.047 3.381
631 2HB ASP 89 2HB ASP 89 -13.642 1.673 3.688
632 H LYS 90 H LYS 90 -12.925 2.868 1.444
633 HA LYS 90 HA LYS 90 -14.476 5.092 2.158
634 1HB LYS 90 1HB LYS 90 -11.814 4.561 0.994
635 2HB LYS 90 2HB LYS 90 -12.518 6.096 0.526
636 1HG LYS 90 2HG LYS 90 -12.129 5.088 3.383
637 2HG LYS 90 1HG LYS 90 -11.214 6.362 2.603
638 1HD LYS 90 1HD LYS 90 -13.747 7.329 2.228
639 2HD LYS 90 2HD LYS 90 -13.997 6.425 3.709
640 1HE LYS 90 1HE LYS 90 -12.080 7.637 4.773
641 2HE LYS 90 2HE LYS 90 -11.826 8.538 3.292
642 1HZ LYS 90 1HZ LYS 90 -14.451 8.558 4.560
643 2HZ LYS 90 2HZ LYS 90 -13.269 9.533 5.123
644 3HZ LYS 90 3HZ LYS 90 -13.778 9.676 3.578
645 H ALA 91 H ALA 91 -13.776 3.480 -0.992
646 HA ALA 91 HA ALA 91 -15.540 5.377 -2.318
647 1HB ALA 91 1HB ALA 91 -14.248 3.063 -3.720
648 2HB ALA 91 3HB ALA 91 -14.482 4.741 -4.265
649 3HB ALA 91 2HB ALA 91 -13.192 4.356 -3.101
650 H GLY 92 H GLY 92 -16.487 3.390 -0.244
651 1HA GLY 92 2HA GLY 92 -18.032 1.751 0.014
652 2HA GLY 92 1HA GLY 92 -17.867 1.320 -1.677
653 H ASP 93 H ASP 93 -19.497 1.864 -3.084
654 HA ASP 93 HA ASP 93 -21.623 2.390 -3.474
655 1HB ASP 93 1HB ASP 93 -21.795 2.847 -0.869
656 2HB ASP 93 2HB ASP 93 -21.646 4.532 -1.326
657 H ASP 94 H ASP 94 -18.918 4.518 -2.900
658 HA ASP 94 HA ASP 94 -20.094 6.660 -4.432
659 1HB ASP 94 1HB ASP 94 -18.607 6.945 -2.321
660 2HB ASP 94 2HB ASP 94 -17.255 6.486 -3.337
661 H LYS 95 H LYS 95 -19.917 6.467 -6.671
662 HA LYS 95 HA LYS 95 -17.979 4.701 -7.811
663 1HB LYS 95 1HB LYS 95 -20.449 5.334 -8.549
664 2HB LYS 95 2HB LYS 95 -19.626 6.595 -9.445
665 1HG LYS 95 1HG LYS 95 -18.019 4.497 -10.103
666 2HG LYS 95 2HG LYS 95 -19.504 3.616 -9.805
667 1HD LYS 95 1HD LYS 95 -19.885 6.080 -11.422
668 2HD LYS 95 2HD LYS 95 -18.850 4.891 -12.187
669 1HE LYS 95 1HE LYS 95 -20.777 3.880 -12.868
670 2HE LYS 95 2HE LYS 95 -20.913 3.297 -11.222
671 1HZ LYS 95 1HZ LYS 95 -21.998 5.584 -10.846
672 2HZ LYS 95 2HZ LYS 95 -22.246 5.565 -12.460
673 3HZ LYS 95 3HZ LYS 95 -22.874 4.383 -11.523
674 H GLU 96 H GLU 96 -18.411 8.231 -7.378
675 HA GLU 96 HA GLU 96 -16.355 8.957 -9.110
676 1HB GLU 96 1HB GLU 96 -18.102 10.524 -8.326
677 2HB GLU 96 2HB GLU 96 -17.503 10.408 -6.684
678 1HG GLU 96 1HG GLU 96 -15.194 11.162 -7.761
679 2HG GLU 96 2HG GLU 96 -16.199 11.722 -9.083
680 H LEU 97 H LEU 97 -16.456 8.022 -5.654
681 HA LEU 97 HA LEU 97 -13.719 8.758 -5.224
682 1HB LEU 97 1HB LEU 97 -15.722 8.694 -3.568
683 2HB LEU 97 2HB LEU 97 -15.350 6.986 -3.436
684 HG LEU 97 HG LEU 97 -14.277 8.077 -1.626
685 1HD1 LEU 97 1HD1 LEU 97 -12.973 6.343 -2.975
686 2HD1 LEU 97 2HD1 LEU 97 -12.026 7.713 -3.603
687 3HD1 LEU 97 3HD1 LEU 97 -12.049 7.374 -1.856
688 1HD2 LEU 97 1HD2 LEU 97 -13.286 10.058 -3.677
689 2HD2 LEU 97 2HD2 LEU 97 -14.277 10.352 -2.228
690 3HD2 LEU 97 3HD2 LEU 97 -12.562 9.908 -2.058
691 H LYS 98 H LYS 98 -15.401 6.141 -6.704
692 HA LYS 98 HA LYS 98 -13.352 4.201 -6.066
693 1HB LYS 98 1HB LYS 98 -15.820 3.668 -6.224
694 2HB LYS 98 2HB LYS 98 -15.706 3.929 -7.953
695 1HG LYS 98 1HG LYS 98 -13.523 2.226 -7.340
696 2HG LYS 98 2HG LYS 98 -14.848 1.614 -6.370
697 1HD LYS 98 1HD LYS 98 -15.035 2.181 -9.367
698 2HD LYS 98 2HD LYS 98 -14.726 0.598 -8.683
699 1HE LYS 98 1HE LYS 98 -16.897 0.434 -7.732
700 2HE LYS 98 2HE LYS 98 -17.153 2.167 -7.766
701 1HZ LYS 98 1HZ LYS 98 -16.728 1.426 -10.362
702 2HZ LYS 98 2HZ LYS 98 -17.716 0.275 -9.757
703 3HZ LYS 98 3HZ LYS 98 -18.153 1.847 -9.685
704 H LYS 99 H LYS 99 -12.750 6.795 -7.518
705 HA LYS 99 HA LYS 99 -11.314 5.522 -9.700
706 1HB LYS 99 1HB LYS 99 -13.457 7.581 -10.033
707 2HB LYS 99 2HB LYS 99 -12.028 7.716 -11.039
708 1HG LYS 99 1HG LYS 99 -12.927 4.934 -10.927
709 2HG LYS 99 2HG LYS 99 -14.244 5.977 -11.426
710 1HD LYS 99 1HD LYS 99 -12.165 7.011 -12.926
711 2HD LYS 99 2HD LYS 99 -11.703 5.322 -12.842
712 1HE LYS 99 1HE LYS 99 -14.575 5.996 -13.510
713 2HE LYS 99 2HE LYS 99 -13.358 6.207 -14.753
714 1HZ LYS 99 1HZ LYS 99 -12.900 3.764 -13.549
715 2HZ LYS 99 2HZ LYS 99 -14.502 3.840 -13.859
716 3HZ LYS 99 3HZ LYS 99 -13.425 4.047 -15.069
717 H LYS 100 H LYS 100 -10.231 6.133 -7.260
718 HA LYS 100 HA LYS 100 -8.248 7.998 -7.996
719 1HB LYS 100 1HB LYS 100 -8.835 9.465 -5.859
720 2HB LYS 100 2HB LYS 100 -9.450 9.849 -7.454
721 1HG LYS 100 1HG LYS 100 -11.509 8.406 -6.873
722 2HG LYS 100 2HG LYS 100 -10.911 8.365 -5.226
723 1HD LYS 100 1HD LYS 100 -11.269 11.012 -6.677
724 2HD LYS 100 2HD LYS 100 -12.630 10.232 -5.898
725 1HE LYS 100 1HE LYS 100 -11.297 10.158 -3.743
726 2HE LYS 100 2HE LYS 100 -10.017 11.049 -4.541
727 1HZ LYS 100 1HZ LYS 100 -12.691 12.149 -4.682
728 2HZ LYS 100 2HZ LYS 100 -11.913 12.248 -3.250
729 3HZ LYS 100 3HZ LYS 100 -11.255 12.919 -4.585
730 H LEU 101 H LEU 101 -9.990 6.308 -5.322
731 HA LEU 101 HA LEU 101 -7.439 5.849 -4.006
732 1HB LEU 101 1HB LEU 101 -10.261 5.166 -3.172
733 2HB LEU 101 2HB LEU 101 -8.822 4.927 -2.202
734 HG LEU 101 HG LEU 101 -10.203 7.489 -2.949
735 1HD1 LEU 101 1HD1 LEU 101 -10.521 6.039 -0.780
736 2HD1 LEU 101 2HD1 LEU 101 -9.020 6.851 -0.273
737 3HD1 LEU 101 3HD1 LEU 101 -10.456 7.816 -0.691
738 1HD2 LEU 101 1HD2 LEU 101 -7.301 7.216 -2.132
739 2HD2 LEU 101 2HD2 LEU 101 -7.958 7.970 -3.604
740 3HD2 LEU 101 3HD2 LEU 101 -8.234 8.728 -2.017
741 H THR 102 H THR 102 -9.923 4.226 -5.962
742 HA THR 102 HA THR 102 -8.256 1.798 -5.855
743 HB THR 102 HB THR 102 -10.288 0.482 -5.874
744 HG1 THR 102 HG1 THR 102 -11.606 1.669 -7.299
745 1HG2 THR 102 1HG2 THR 102 -9.815 1.719 -3.642
746 2HG2 THR 102 2HG2 THR 102 -11.058 2.887 -4.154
747 3HG2 THR 102 3HG2 THR 102 -11.493 1.180 -3.897
748 H GLY 103 H GLY 103 -8.861 4.427 -7.665
749 1HA GLY 103 2HA GLY 103 -8.745 4.891 -9.860
750 2HA GLY 103 1HA GLY 103 -9.706 3.455 -10.152
751 H CYS 104 H CYS 104 -8.764 1.893 -11.387
752 HA CYS 104 HA CYS 104 -6.214 0.919 -10.932
753 1HB CYS 104 1HB CYS 104 -8.312 0.577 -12.978
754 2HB CYS 104 2HB CYS 104 -6.685 0.230 -13.530
755 H LYS 105 H LYS 105 -7.514 3.214 -13.431
756 HA LYS 105 HA LYS 105 -4.754 4.147 -13.804
757 1HB LYS 105 1HB LYS 105 -6.901 3.839 -15.924
758 2HB LYS 105 2HB LYS 105 -5.338 4.591 -16.170
759 1HG LYS 105 1HG LYS 105 -5.725 1.715 -15.215
760 2HG LYS 105 2HG LYS 105 -5.427 2.165 -16.882
761 1HD LYS 105 1HD LYS 105 -3.272 3.283 -16.140
762 2HD LYS 105 2HD LYS 105 -3.560 2.681 -14.520
763 1HE LYS 105 1HE LYS 105 -3.427 0.363 -15.269
764 2HE LYS 105 2HE LYS 105 -3.427 0.845 -16.954
765 1HZ LYS 105 1HZ LYS 105 -1.334 1.636 -15.052
766 2HZ LYS 105 2HZ LYS 105 -1.220 0.338 -16.038
767 3HZ LYS 105 3HZ LYS 105 -1.316 1.840 -16.673
768 H GLY 106 H GLY 106 -4.427 6.346 -13.674
769 1HA GLY 106 2HA GLY 106 -6.575 8.216 -13.962
770 2HA GLY 106 1HA GLY 106 -4.923 8.546 -13.479
771 H SER 107 H SER 107 -4.682 6.819 -11.207
772 HA SER 107 HA SER 107 -6.726 7.962 -9.468
773 1HB SER 107 1HB SER 107 -6.175 6.046 -7.916
774 2HB SER 107 2HB SER 107 -6.894 5.553 -9.436
775 HG SER 107 HG SER 107 -5.047 4.235 -8.873
776 H ALA 108 H ALA 108 -5.740 7.997 -7.023
777 HA ALA 108 HA ALA 108 -3.608 9.863 -7.151
778 1HB ALA 108 1HB ALA 108 -4.604 10.432 -5.221
779 2HB ALA 108 3HB ALA 108 -5.610 8.966 -5.290
780 3HB ALA 108 2HB ALA 108 -4.022 8.918 -4.488
781 H CYS 109 H CYS 109 -3.690 6.491 -7.400
782 HA CYS 109 HA CYS 109 -1.125 6.194 -6.043
783 1HB CYS 109 1HB CYS 109 -3.114 4.132 -7.041
784 2HB CYS 109 2HB CYS 109 -1.533 3.730 -6.400
785 H HIS 110 H HIS 110 -2.878 5.631 -9.166
786 HA HIS 110 HA HIS 110 -0.250 5.580 -10.464
787 1HB HIS 110 1HB HIS 110 -2.798 4.170 -11.308
788 2HB HIS 110 2HB HIS 110 -1.303 4.191 -12.222
789 HD1 HIS 110 HD1 HIS 110 0.828 3.497 -10.217
790 HD2 HIS 110 HD2 HIS 110 -2.963 1.703 -10.169
791 HE1 HIS 110 HE1 HIS 110 1.100 1.285 -8.975
792 HA PRO 111 HA PRO 111 -2.355 9.245 -12.119
793 1HB PRO 111 1HB PRO 111 -0.542 11.117 -11.436
794 2HB PRO 111 2HB PRO 111 -1.590 10.370 -10.185
795 1HG PRO 111 1HG PRO 111 1.030 9.716 -11.161
796 2HG PRO 111 2HG PRO 111 0.948 9.713 -9.369
797 1HD PRO 111 1HD PRO 111 0.948 7.385 -10.748
798 2HD PRO 111 2HD PRO 111 -0.169 7.591 -9.365
799 H SER 112 H SER 112 -1.707 7.768 -14.114
800 HA SER 112 HA SER 112 0.025 9.378 -15.681
801 1HB SER 112 1HB SER 112 1.266 7.275 -14.323
802 2HB SER 112 2HB SER 112 0.932 6.574 -15.894
803 HG SER 112 HG SER 112 2.242 8.044 -16.897
No H/Q in entry = 803
Start of MODEL 10
1 H1 VAL 1 H1 VAL 1 8.835 9.129 17.699
2 H2 VAL 1 H2 VAL 1 9.647 7.762 18.161
3 H3 VAL 1 H3 VAL 1 10.452 8.978 17.377
4 HA VAL 1 HA VAL 1 10.184 7.808 15.597
5 HB VAL 1 HB VAL 1 9.344 5.988 17.186
6 1HG1 VAL 1 1HG1 VAL 1 6.997 7.447 17.123
7 2HG1 VAL 1 2HG1 VAL 1 6.657 6.099 16.010
8 3HG1 VAL 1 3HG1 VAL 1 7.166 5.766 17.683
9 1HG2 VAL 1 1HG2 VAL 1 8.841 6.220 14.247
10 2HG2 VAL 1 2HG2 VAL 1 9.933 5.137 15.141
11 3HG2 VAL 1 3HG2 VAL 1 8.185 4.804 15.102
12 H ASP 2 H ASP 2 9.007 10.438 16.316
13 HA ASP 2 HA ASP 2 6.549 10.982 15.622
14 1HB ASP 2 1HB ASP 2 7.300 13.116 14.778
15 2HB ASP 2 2HB ASP 2 8.436 12.628 16.020
16 H VAL 3 H VAL 3 5.190 10.668 13.833
17 HA VAL 3 HA VAL 3 5.938 9.060 11.722
18 HB VAL 3 HB VAL 3 3.633 9.900 12.714
19 1HG1 VAL 3 1HG1 VAL 3 3.928 12.225 11.903
20 2HG1 VAL 3 2HG1 VAL 3 3.927 11.622 10.229
21 3HG1 VAL 3 3HG1 VAL 3 2.471 11.447 11.238
22 1HG2 VAL 3 1HG2 VAL 3 3.931 7.999 11.195
23 2HG2 VAL 3 2HG2 VAL 3 2.512 8.969 10.731
24 3HG2 VAL 3 3HG2 VAL 3 4.026 9.109 9.807
25 HA PRO 4 HA PRO 4 8.780 11.576 9.460
26 1HB PRO 4 1HB PRO 4 7.682 9.771 7.280
27 2HB PRO 4 2HB PRO 4 9.373 10.190 7.707
28 1HG PRO 4 1HG PRO 4 8.415 7.856 8.531
29 2HG PRO 4 2HG PRO 4 9.560 8.773 9.564
30 1HD PRO 4 1HD PRO 4 6.577 8.375 9.814
31 2HD PRO 4 2HD PRO 4 7.788 8.701 11.090
32 H ALA 5 H ALA 5 8.639 13.001 7.424
33 HA ALA 5 HA ALA 5 6.035 14.233 7.406
34 1HB ALA 5 1HB ALA 5 7.326 16.038 7.068
35 2HB ALA 5 3HB ALA 5 7.828 15.381 5.492
36 3HB ALA 5 2HB ALA 5 8.765 14.996 6.955
37 H ASP 6 H ASP 6 4.745 14.567 5.485
38 HA ASP 6 HA ASP 6 4.350 12.325 4.017
39 1HB ASP 6 1HB ASP 6 2.797 13.598 2.767
40 2HB ASP 6 2HB ASP 6 2.895 14.464 4.288
41 H GLY 7 H GLY 7 4.271 12.917 1.273
42 1HA GLY 7 2HA GLY 7 6.690 14.095 0.312
43 2HA GLY 7 1HA GLY 7 5.492 13.205 -0.607
44 H ALA 8 H ALA 8 5.461 10.714 0.769
45 HA ALA 8 HA ALA 8 8.249 9.826 0.585
46 1HB ALA 8 1HB ALA 8 5.856 9.051 2.179
47 2HB ALA 8 2HB ALA 8 7.582 9.012 2.612
48 3HB ALA 8 3HB ALA 8 6.885 7.712 1.616
49 H LYS 9 H LYS 9 8.583 9.517 -1.616
50 HA LYS 9 HA LYS 9 6.577 8.369 -3.264
51 1HB LYS 9 1HB LYS 9 8.014 8.789 -5.001
52 2HB LYS 9 2HB LYS 9 8.582 9.961 -3.830
53 1HG LYS 9 2HG LYS 9 10.639 9.015 -3.882
54 2HG LYS 9 1HG LYS 9 9.967 7.522 -3.257
55 1HD LYS 9 2HD LYS 9 10.391 6.526 -5.247
56 2HD LYS 9 1HD LYS 9 9.229 7.594 -6.008
57 1HE LYS 9 1HE LYS 9 11.047 9.330 -6.273
58 2HE LYS 9 2HE LYS 9 12.197 8.197 -5.591
59 1HZ LYS 9 1HZ LYS 9 11.618 6.673 -7.392
60 2HZ LYS 9 2HZ LYS 9 10.637 7.801 -8.049
61 3HZ LYS 9 3HZ LYS 9 12.244 8.075 -7.950
62 H ILE 10 H ILE 10 6.478 6.261 -4.172
63 HA ILE 10 HA ILE 10 8.177 4.301 -2.798
64 HB ILE 10 HB ILE 10 5.247 3.948 -3.429
65 1HG1 ILE 10 1HG1 ILE 10 6.397 4.347 -0.667
66 2HG1 ILE 10 2HG1 ILE 10 5.859 5.705 -1.636
67 1HG2 ILE 10 1HG2 ILE 10 7.398 2.191 -2.410
68 2HG2 ILE 10 2HG2 ILE 10 5.845 2.106 -1.543
69 3HG2 ILE 10 3HG2 ILE 10 5.905 1.798 -3.296
70 1HD1 ILE 10 1HD1 ILE 10 4.073 3.286 -1.174
71 2HD1 ILE 10 2HD1 ILE 10 4.127 4.650 -0.032
72 3HD1 ILE 10 3HD1 ILE 10 3.602 4.917 -1.712
73 H ASP 11 H ASP 11 9.294 2.998 -4.156
74 HA ASP 11 HA ASP 11 8.153 2.198 -6.612
75 1HB ASP 11 1HB ASP 11 8.885 4.260 -7.533
76 2HB ASP 11 2HB ASP 11 10.326 4.305 -6.538
77 H PHE 12 H PHE 12 8.666 0.073 -5.792
78 HA PHE 12 HA PHE 12 11.535 -0.435 -5.429
79 1HB PHE 12 1HB PHE 12 9.011 -1.862 -4.392
80 2HB PHE 12 2HB PHE 12 10.646 -2.387 -4.042
81 HD1 PHE 12 HD1 PHE 12 12.044 0.059 -3.362
82 HD2 PHE 12 HD2 PHE 12 8.073 -1.108 -2.423
83 HE1 PHE 12 HE1 PHE 12 12.086 1.543 -1.337
84 HE2 PHE 12 HE2 PHE 12 8.116 0.375 -0.398
85 HZ PHE 12 HZ PHE 12 10.122 1.683 0.120
86 H ILE 13 H ILE 13 8.538 -1.275 -7.120
87 HA ILE 13 HA ILE 13 9.853 -3.571 -8.350
88 HB ILE 13 HB ILE 13 6.997 -2.604 -8.317
89 1HG1 ILE 13 1HG1 ILE 13 7.997 -5.261 -7.324
90 2HG1 ILE 13 2HG1 ILE 13 8.160 -3.835 -6.318
91 1HG2 ILE 13 1HG2 ILE 13 8.367 -4.477 -10.144
92 2HG2 ILE 13 2HG2 ILE 13 6.856 -5.077 -9.419
93 3HG2 ILE 13 3HG2 ILE 13 6.856 -3.559 -10.348
94 1HD1 ILE 13 1HD1 ILE 13 5.495 -4.472 -7.618
95 2HD1 ILE 13 2HD1 ILE 13 5.983 -5.280 -6.109
96 3HD1 ILE 13 3HD1 ILE 13 5.823 -3.507 -6.159
97 H ALA 14 H ALA 14 11.332 -2.737 -9.809
98 HA ALA 14 HA ALA 14 10.861 -0.461 -11.364
99 1HB ALA 14 1HB ALA 14 12.645 -2.503 -12.523
100 2HB ALA 14 2HB ALA 14 13.000 -0.838 -12.003
101 3HB ALA 14 3HB ALA 14 12.977 -2.157 -10.809
102 H GLY 15 H GLY 15 11.001 -0.697 -13.934
103 1HA GLY 15 2HA GLY 15 8.683 -1.232 -15.036
104 2HA GLY 15 1HA GLY 15 9.284 -2.871 -14.882
105 H GLY 16 H GLY 16 11.870 -2.928 -15.536
106 1HA GLY 16 2HA GLY 16 11.900 -2.489 -18.328
107 2HA GLY 16 1HA GLY 16 13.243 -2.987 -17.319
108 H GLU 17 H GLU 17 11.544 -0.248 -18.797
109 HA GLU 17 HA GLU 17 13.900 1.349 -18.223
110 1HB GLU 17 1HB GLU 17 12.130 1.026 -20.531
111 2HB GLU 17 2HB GLU 17 12.273 2.716 -20.090
112 1HG GLU 17 1HG GLU 17 14.041 1.826 -21.730
113 2HG GLU 17 2HG GLU 17 14.654 2.708 -20.345
114 H LYS 18 H LYS 18 10.277 1.506 -18.274
115 HA LYS 18 HA LYS 18 10.343 4.015 -16.849
116 1HB LYS 18 1HB LYS 18 7.949 4.004 -17.134
117 2HB LYS 18 2HB LYS 18 8.713 3.602 -18.658
118 1HG LYS 18 1HG LYS 18 8.409 1.101 -17.901
119 2HG LYS 18 2HG LYS 18 7.273 1.745 -16.733
120 1HD LYS 18 1HD LYS 18 7.087 2.377 -19.711
121 2HD LYS 18 2HD LYS 18 6.289 0.991 -18.994
122 1HE LYS 18 1HE LYS 18 5.877 3.845 -17.991
123 2HE LYS 18 2HE LYS 18 4.853 3.105 -19.205
124 1HZ LYS 18 1HZ LYS 18 5.287 1.590 -16.786
125 2HZ LYS 18 2HZ LYS 18 4.357 2.926 -16.652
126 3HZ LYS 18 3HZ LYS 18 3.937 1.740 -17.693
127 H ASN 19 H ASN 19 8.122 3.695 -15.124
128 HA ASN 19 HA ASN 19 8.172 1.485 -13.538
129 1HB ASN 19 1HB ASN 19 9.506 2.361 -11.547
130 2HB ASN 19 2HB ASN 19 10.491 1.927 -12.929
131 2HD2 ASN 19 2HD2 ASN 19 11.728 3.470 -11.292
132 1HD2 ASN 19 1HD2 ASN 19 11.819 5.126 -11.793
133 H LEU 20 H LEU 20 6.339 1.739 -12.212
134 HA LEU 20 HA LEU 20 5.059 4.300 -12.224
135 1HB LEU 20 1HB LEU 20 4.327 1.610 -11.072
136 2HB LEU 20 2HB LEU 20 3.319 3.034 -10.908
137 HG LEU 20 HG LEU 20 4.059 1.576 -13.452
138 1HD1 LEU 20 1HD1 LEU 20 1.597 1.849 -11.781
139 2HD1 LEU 20 2HD1 LEU 20 1.418 1.702 -13.546
140 3HD1 LEU 20 3HD1 LEU 20 2.261 0.431 -12.629
141 1HD2 LEU 20 1HD2 LEU 20 2.991 4.349 -13.073
142 2HD2 LEU 20 2HD2 LEU 20 4.156 3.723 -14.263
143 3HD2 LEU 20 3HD2 LEU 20 2.421 3.371 -14.446
144 H THR 21 H THR 21 4.962 5.808 -10.605
145 HA THR 21 HA THR 21 6.305 5.070 -8.087
146 HB THR 21 HB THR 21 6.275 7.898 -9.158
147 HG1 THR 21 HG1 THR 21 8.110 5.729 -9.887
148 1HG2 THR 21 1HG2 THR 21 8.210 6.115 -7.604
149 2HG2 THR 21 2HG2 THR 21 8.711 7.673 -8.305
150 3HG2 THR 21 3HG2 THR 21 7.445 7.626 -7.056
151 H VAL 22 H VAL 22 4.897 4.897 -6.468
152 HA VAL 22 HA VAL 22 2.481 6.541 -6.624
153 HB VAL 22 HB VAL 22 3.195 4.035 -5.097
154 1HG1 VAL 22 1HG1 VAL 22 1.337 6.066 -4.346
155 2HG1 VAL 22 2HG1 VAL 22 0.410 4.650 -4.894
156 3HG1 VAL 22 3HG1 VAL 22 1.612 4.477 -3.593
157 1HG2 VAL 22 1HG2 VAL 22 2.245 4.390 -7.687
158 2HG2 VAL 22 2HG2 VAL 22 2.159 2.895 -6.723
159 3HG2 VAL 22 3HG2 VAL 22 0.781 4.022 -6.743
160 H VAL 23 H VAL 23 2.095 8.176 -5.181
161 HA VAL 23 HA VAL 23 4.242 8.693 -3.275
162 HB VAL 23 HB VAL 23 1.998 10.406 -4.359
163 1HG1 VAL 23 1HG1 VAL 23 4.199 11.031 -2.371
164 2HG1 VAL 23 2HG1 VAL 23 3.306 12.284 -3.266
165 3HG1 VAL 23 3HG1 VAL 23 2.439 11.197 -2.155
166 1HG2 VAL 23 1HG2 VAL 23 4.574 9.715 -5.402
167 2HG2 VAL 23 2HG2 VAL 23 3.356 10.823 -6.077
168 3HG2 VAL 23 3HG2 VAL 23 4.590 11.436 -4.950
169 H PHE 24 H PHE 24 3.955 8.614 -1.074
170 HA PHE 24 HA PHE 24 1.207 8.159 -0.157
171 1HB PHE 24 1HB PHE 24 2.787 6.093 -0.324
172 2HB PHE 24 2HB PHE 24 3.801 6.870 0.875
173 HD1 PHE 24 HD1 PHE 24 0.299 5.712 0.352
174 HD2 PHE 24 HD2 PHE 24 3.413 6.479 3.131
175 HE1 PHE 24 HE1 PHE 24 -1.083 4.691 2.182
176 HE2 PHE 24 HE2 PHE 24 2.031 5.458 4.961
177 HZ PHE 24 HZ PHE 24 -0.200 4.576 4.465
178 H ASN 25 H ASN 25 0.762 8.861 2.040
179 HA ASN 25 HA ASN 25 2.864 10.487 3.197
180 1HB ASN 25 1HB ASN 25 1.501 12.110 1.976
181 2HB ASN 25 2HB ASN 25 0.013 11.389 2.556
182 2HD2 ASN 25 2HD2 ASN 25 -0.597 13.445 3.319
183 1HD2 ASN 25 1HD2 ASN 25 0.003 14.087 4.812
184 H HIS 26 H HIS 26 2.659 10.639 5.547
185 HA HIS 26 HA HIS 26 0.978 8.571 6.647
186 1HB HIS 26 1HB HIS 26 3.343 10.151 7.549
187 2HB HIS 26 2HB HIS 26 2.267 9.537 8.788
188 HD1 HIS 26 HD1 HIS 26 4.673 8.394 6.112
189 HD2 HIS 26 HD2 HIS 26 2.318 6.744 9.166
190 HE1 HIS 26 HE1 HIS 26 5.434 5.973 6.372
191 H SER 27 H SER 27 1.111 12.083 6.338
192 HA SER 27 HA SER 27 -0.629 12.583 8.501
193 1HB SER 27 1HB SER 27 -0.776 14.706 6.582
194 2HB SER 27 2HB SER 27 0.095 14.681 8.102
195 HG SER 27 HG SER 27 1.531 15.089 6.322
196 H THR 28 H THR 28 -1.133 10.945 5.650
197 HA THR 28 HA THR 28 -3.758 12.097 5.097
198 HB THR 28 HB THR 28 -2.151 9.876 3.726
199 HG1 THR 28 HG1 THR 28 -2.646 12.724 3.201
200 1HG2 THR 28 1HG2 THR 28 -4.859 10.907 3.338
201 2HG2 THR 28 2HG2 THR 28 -3.839 11.327 1.941
202 3HG2 THR 28 3HG2 THR 28 -4.019 9.626 2.432
203 H HIS 29 H HIS 29 -2.213 9.096 6.328
204 HA HIS 29 HA HIS 29 -4.899 8.104 6.903
205 1HB HIS 29 1HB HIS 29 -2.265 6.610 6.983
206 2HB HIS 29 2HB HIS 29 -3.867 5.920 7.150
207 HD1 HIS 29 HD1 HIS 29 -1.545 7.430 4.569
208 HD2 HIS 29 HD2 HIS 29 -5.245 5.462 4.751
209 HE1 HIS 29 HE1 HIS 29 -2.161 6.841 2.164
210 H LYS 30 H LYS 30 -3.425 10.314 8.359
211 HA LYS 30 HA LYS 30 -2.360 9.386 10.741
212 1HB LYS 30 1HB LYS 30 -2.640 11.624 11.539
213 2HB LYS 30 2HB LYS 30 -2.203 11.703 9.844
214 1HG LYS 30 1HG LYS 30 -4.474 12.190 9.174
215 2HG LYS 30 2HG LYS 30 -5.112 11.748 10.745
216 1HD LYS 30 1HD LYS 30 -3.085 13.831 11.042
217 2HD LYS 30 2HD LYS 30 -4.295 14.335 9.879
218 1HE LYS 30 1HE LYS 30 -5.506 13.043 12.239
219 2HE LYS 30 2HE LYS 30 -4.539 14.436 12.680
220 1HZ LYS 30 1HZ LYS 30 -5.822 15.428 10.634
221 2HZ LYS 30 2HZ LYS 30 -6.935 14.319 11.078
222 3HZ LYS 30 3HZ LYS 30 -6.448 15.458 12.142
223 H ASP 31 H ASP 31 -5.603 9.243 9.518
224 HA ASP 31 HA ASP 31 -6.733 9.101 12.155
225 1HB ASP 31 1HB ASP 31 -8.837 9.139 11.083
226 2HB ASP 31 2HB ASP 31 -7.839 10.121 10.029
227 H VAL 32 H VAL 32 -4.861 7.086 10.337
228 HA VAL 32 HA VAL 32 -6.414 4.690 11.038
229 HB VAL 32 HB VAL 32 -4.310 5.043 8.894
230 1HG1 VAL 32 1HG1 VAL 32 -4.630 2.746 10.002
231 2HG1 VAL 32 2HG1 VAL 32 -6.222 2.723 9.205
232 3HG1 VAL 32 3HG1 VAL 32 -4.738 2.826 8.227
233 1HG2 VAL 32 1HG2 VAL 32 -6.970 5.922 8.855
234 2HG2 VAL 32 2HG2 VAL 32 -5.889 5.703 7.458
235 3HG2 VAL 32 3HG2 VAL 32 -6.981 4.387 7.954
236 H LYS 33 H LYS 33 -5.509 3.237 12.446
237 HA LYS 33 HA LYS 33 -3.441 4.018 14.084
238 1HB LYS 33 1HB LYS 33 -4.463 1.224 13.491
239 2HB LYS 33 2HB LYS 33 -3.450 1.658 14.852
240 1HG LYS 33 1HG LYS 33 -5.291 3.441 15.400
241 2HG LYS 33 2HG LYS 33 -6.303 2.544 14.286
242 1HD LYS 33 1HD LYS 33 -5.993 0.476 15.617
243 2HD LYS 33 2HD LYS 33 -4.889 1.306 16.696
244 1HE LYS 33 1HE LYS 33 -7.578 2.586 16.334
245 2HE LYS 33 2HE LYS 33 -7.566 1.056 17.188
246 1HZ LYS 33 1HZ LYS 33 -5.470 2.559 18.168
247 2HZ LYS 33 2HZ LYS 33 -6.767 3.551 18.120
248 3HZ LYS 33 3HZ LYS 33 -6.847 2.142 18.942
249 H CYS 34 H CYS 34 -1.260 3.020 14.372
250 HA CYS 34 HA CYS 34 0.121 3.136 11.897
251 1HB CYS 34 1HB CYS 34 1.268 2.277 14.551
252 2HB CYS 34 2HB CYS 34 2.115 2.961 13.177
253 H ASP 35 H ASP 35 -0.820 0.612 14.300
254 HA ASP 35 HA ASP 35 0.608 -1.446 13.093
255 1HB ASP 35 1HB ASP 35 -0.992 -2.929 14.388
256 2HB ASP 35 2HB ASP 35 -0.187 -1.712 15.358
257 H ASP 36 H ASP 36 -2.066 0.381 12.025
258 HA ASP 36 HA ASP 36 -3.705 -1.569 10.940
259 1HB ASP 36 1HB ASP 36 -3.968 1.057 11.223
260 2HB ASP 36 2HB ASP 36 -3.260 1.126 9.622
261 H CYS 37 H CYS 37 -0.528 -0.400 10.107
262 HA CYS 37 HA CYS 37 -0.708 -1.811 7.551
263 1HB CYS 37 1HB CYS 37 0.677 0.841 8.054
264 2HB CYS 37 2HB CYS 37 0.936 -0.142 6.627
265 H HIS 38 H HIS 38 1.408 -0.407 10.149
266 HA HIS 38 HA HIS 38 3.546 -2.177 9.505
267 1HB HIS 38 1HB HIS 38 3.111 -0.370 11.900
268 2HB HIS 38 2HB HIS 38 4.605 -1.200 11.515
269 HD1 HIS 38 HD1 HIS 38 5.651 -0.509 9.031
270 HD2 HIS 38 HD2 HIS 38 2.913 2.131 10.800
271 HE1 HIS 38 HE1 HIS 38 5.968 1.738 7.864
272 H HIS 39 H HIS 39 2.305 -4.222 9.576
273 HA HIS 39 HA HIS 39 1.421 -5.018 12.210
274 1HB HIS 39 1HB HIS 39 0.322 -6.780 11.173
275 2HB HIS 39 2HB HIS 39 0.197 -5.482 10.002
276 HD1 HIS 39 HD1 HIS 39 1.112 -8.968 10.260
277 HD2 HIS 39 HD2 HIS 39 2.359 -5.730 7.903
278 HE1 HIS 39 HE1 HIS 39 2.298 -9.972 8.236
279 H GLN 40 H GLN 40 4.045 -4.457 12.463
280 HA GLN 40 HA GLN 40 5.330 -7.066 12.240
281 1HB GLN 40 1HB GLN 40 6.304 -4.278 11.843
282 2HB GLN 40 2HB GLN 40 7.399 -5.321 12.727
283 1HG GLN 40 1HG GLN 40 7.675 -5.316 10.175
284 2HG GLN 40 2HG GLN 40 7.549 -6.894 10.926
285 2HE2 GLN 40 2HE2 GLN 40 5.743 -8.151 10.655
286 1HE2 GLN 40 1HE2 GLN 40 4.517 -7.836 9.473
287 HA PRO 41 HA PRO 41 5.956 -7.314 16.584
288 1HB PRO 41 1HB PRO 41 8.912 -7.567 16.317
289 2HB PRO 41 2HB PRO 41 7.680 -8.781 16.792
290 1HG PRO 41 1HG PRO 41 9.031 -8.682 14.684
291 2HG PRO 41 2HG PRO 41 7.582 -9.606 14.171
292 1HD PRO 41 2HD PRO 41 8.359 -6.804 13.587
293 2HD PRO 41 1HD PRO 41 7.032 -7.769 12.874
294 H GLY 42 H GLY 42 6.473 -6.037 18.465
295 1HA GLY 42 2HA GLY 42 7.237 -4.258 19.622
296 2HA GLY 42 1HA GLY 42 6.765 -3.349 18.200
297 H ASP 43 H ASP 43 9.432 -5.737 18.860
298 HA ASP 43 HA ASP 43 11.507 -4.171 19.175
299 1HB ASP 43 1HB ASP 43 12.791 -5.878 17.645
300 2HB ASP 43 2HB ASP 43 12.007 -6.462 19.099
301 H LYS 44 H LYS 44 10.092 -5.103 15.953
302 HA LYS 44 HA LYS 44 11.280 -2.666 14.845
303 1HB LYS 44 1HB LYS 44 12.472 -4.969 14.319
304 2HB LYS 44 2HB LYS 44 11.161 -5.151 13.171
305 1HG LYS 44 1HG LYS 44 12.681 -4.008 11.834
306 2HG LYS 44 2HG LYS 44 11.805 -2.645 12.501
307 1HD LYS 44 1HD LYS 44 13.569 -1.978 13.842
308 2HD LYS 44 2HD LYS 44 14.096 -3.619 14.158
309 1HE LYS 44 2HE LYS 44 15.826 -2.938 12.763
310 2HE LYS 44 1HE LYS 44 14.731 -3.576 11.554
311 1HZ LYS 44 1HZ LYS 44 14.877 -0.756 12.368
312 2HZ LYS 44 2HZ LYS 44 15.504 -1.379 10.994
313 3HZ LYS 44 3HZ LYS 44 13.886 -1.360 11.219
314 H GLN 45 H GLN 45 8.848 -2.356 15.770
315 HA GLN 45 HA GLN 45 6.730 -3.372 14.407
316 1HB GLN 45 1HB GLN 45 6.967 -1.673 16.459
317 2HB GLN 45 2HB GLN 45 6.696 -0.467 15.217
318 1HG GLN 45 1HG GLN 45 4.558 -1.429 14.609
319 2HG GLN 45 2HG GLN 45 4.870 -2.886 15.533
320 2HE2 GLN 45 2HE2 GLN 45 2.582 -1.787 16.056
321 1HE2 GLN 45 1HE2 GLN 45 2.545 -0.916 17.552
322 H TYR 46 H TYR 46 8.741 -0.524 13.664
323 HA TYR 46 HA TYR 46 7.376 -0.259 11.038
324 1HB TYR 46 2HB TYR 46 9.372 1.662 12.240
325 2HB TYR 46 1HB TYR 46 8.144 1.970 11.000
326 HD1 TYR 46 HD1 TYR 46 5.740 2.119 11.633
327 HD2 TYR 46 HD2 TYR 46 8.855 1.798 14.572
328 HE1 TYR 46 HE1 TYR 46 4.168 2.902 13.384
329 HE2 TYR 46 HE2 TYR 46 7.283 2.581 16.324
330 HH TYR 46 HH TYR 46 4.552 2.545 16.577
331 H ALA 47 H ALA 47 8.371 -1.683 9.586
332 HA ALA 47 HA ALA 47 11.218 -1.206 9.191
333 1HB ALA 47 1HB ALA 47 9.960 -3.944 9.629
334 2HB ALA 47 3HB ALA 47 11.146 -3.138 10.684
335 3HB ALA 47 2HB ALA 47 11.620 -3.665 9.052
336 H GLY 48 H GLY 48 11.798 -2.770 7.104
337 1HA GLY 48 2HA GLY 48 11.569 -2.816 4.861
338 2HA GLY 48 1HA GLY 48 10.257 -1.660 4.988
339 H CYS 49 H CYS 49 8.735 -2.611 3.622
340 HA CYS 49 HA CYS 49 7.358 -4.856 4.709
341 1HB CYS 49 1HB CYS 49 6.859 -3.519 2.049
342 2HB CYS 49 2HB CYS 49 5.746 -4.496 2.985
343 H THR 50 H THR 50 9.748 -4.157 2.168
344 HA THR 50 HA THR 50 9.468 -6.848 1.068
345 HB THR 50 HB THR 50 10.860 -5.954 -0.733
346 HG1 THR 50 HG1 THR 50 11.020 -3.534 0.890
347 1HG2 THR 50 1HG2 THR 50 8.496 -4.490 0.175
348 2HG2 THR 50 2HG2 THR 50 9.667 -3.371 -0.563
349 3HG2 THR 50 3HG2 THR 50 9.062 -4.764 -1.491
350 H THR 51 H THR 51 10.513 -6.148 3.872
351 HA THR 51 HA THR 51 13.298 -6.659 3.819
352 HB THR 51 HB THR 51 11.262 -7.091 6.064
353 HG1 THR 51 HG1 THR 51 12.672 -4.815 4.883
354 1HG2 THR 51 1HG2 THR 51 14.238 -6.375 5.984
355 2HG2 THR 51 2HG2 THR 51 13.225 -6.222 7.440
356 3HG2 THR 51 3HG2 THR 51 13.512 -7.825 6.719
357 H ASP 52 H ASP 52 14.417 -8.572 4.632
358 HA ASP 52 HA ASP 52 13.749 -10.788 3.206
359 1HB ASP 52 1HB ASP 52 15.541 -10.182 5.529
360 2HB ASP 52 2HB ASP 52 15.187 -11.879 5.272
361 H GLY 53 H GLY 53 12.955 -12.956 3.964
362 1HA GLY 53 2HA GLY 53 11.942 -13.485 6.501
363 2HA GLY 53 1HA GLY 53 11.483 -14.290 5.013
364 H CYS 54 H CYS 54 10.748 -11.346 4.020
365 HA CYS 54 HA CYS 54 8.084 -11.438 5.229
366 1HB CYS 54 1HB CYS 54 9.477 -8.852 4.489
367 2HB CYS 54 2HB CYS 54 7.961 -9.051 5.345
368 H HIS 55 H HIS 55 7.856 -8.871 3.301
369 HA HIS 55 HA HIS 55 7.037 -10.479 1.040
370 1HB HIS 55 1HB HIS 55 6.666 -7.502 1.384
371 2HB HIS 55 2HB HIS 55 5.761 -8.596 0.357
372 HD1 HIS 55 HD1 HIS 55 4.155 -10.364 1.653
373 HD2 HIS 55 HD2 HIS 55 5.641 -7.169 3.930
374 HE1 HIS 55 HE1 HIS 55 2.700 -10.239 3.746
375 H ASN 56 H ASN 56 9.777 -10.583 1.271
376 HA ASN 56 HA ASN 56 10.935 -8.469 -0.236
377 1HB ASN 56 1HB ASN 56 12.209 -9.729 1.522
378 2HB ASN 56 2HB ASN 56 12.043 -11.205 0.591
379 2HD2 ASN 56 2HD2 ASN 56 14.414 -9.715 1.462
380 1HD2 ASN 56 1HD2 ASN 56 15.347 -9.366 0.045
381 H ILE 57 H ILE 57 9.169 -8.984 -2.030
382 HA ILE 57 HA ILE 57 10.394 -10.867 -3.908
383 HB ILE 57 HB ILE 57 7.429 -10.612 -3.399
384 1HG1 ILE 57 1HG1 ILE 57 8.949 -11.802 -1.639
385 2HG1 ILE 57 2HG1 ILE 57 7.454 -12.550 -2.164
386 1HG2 ILE 57 1HG2 ILE 57 9.043 -11.832 -5.543
387 2HG2 ILE 57 2HG2 ILE 57 7.792 -12.890 -4.848
388 3HG2 ILE 57 3HG2 ILE 57 7.341 -11.309 -5.530
389 1HD1 ILE 57 1HD1 ILE 57 9.807 -13.208 -3.863
390 2HD1 ILE 57 2HD1 ILE 57 9.901 -13.803 -2.188
391 3HD1 ILE 57 3HD1 ILE 57 8.531 -14.272 -3.223
392 H LEU 58 H LEU 58 11.223 -9.564 -5.459
393 HA LEU 58 HA LEU 58 9.703 -7.167 -6.147
394 1HB LEU 58 1HB LEU 58 12.547 -7.987 -6.750
395 2HB LEU 58 2HB LEU 58 11.792 -6.509 -7.313
396 HG LEU 58 HG LEU 58 12.437 -7.283 -4.461
397 1HD1 LEU 58 1HD1 LEU 58 13.688 -5.597 -6.506
398 2HD1 LEU 58 2HD1 LEU 58 13.460 -4.777 -4.943
399 3HD1 LEU 58 3HD1 LEU 58 14.367 -6.306 -5.022
400 1HD2 LEU 58 1HD2 LEU 58 10.752 -4.982 -5.471
401 2HD2 LEU 58 2HD2 LEU 58 10.293 -6.259 -4.319
402 3HD2 LEU 58 3HD2 LEU 58 11.495 -5.031 -3.855
403 H ASP 59 H ASP 59 8.025 -8.571 -7.177
404 HA ASP 59 HA ASP 59 8.554 -8.691 -9.936
405 1HB ASP 59 2HB ASP 59 8.621 -10.974 -10.355
406 2HB ASP 59 1HB ASP 59 9.451 -10.938 -8.812
407 H LYS 60 H LYS 60 6.484 -9.129 -11.132
408 HA LYS 60 HA LYS 60 4.158 -8.963 -9.344
409 1HB LYS 60 2HB LYS 60 3.077 -7.575 -11.002
410 2HB LYS 60 1HB LYS 60 4.611 -6.862 -10.546
411 1HG LYS 60 1HG LYS 60 5.515 -7.143 -12.636
412 2HG LYS 60 2HG LYS 60 4.823 -8.741 -12.833
413 1HD LYS 60 1HD LYS 60 2.655 -7.815 -13.459
414 2HD LYS 60 2HD LYS 60 3.153 -6.194 -13.014
415 1HE LYS 60 1HE LYS 60 4.682 -6.031 -14.864
416 2HE LYS 60 2HE LYS 60 4.648 -7.759 -15.154
417 1HZ LYS 60 1HZ LYS 60 2.185 -6.211 -15.351
418 2HZ LYS 60 2HZ LYS 60 3.237 -6.231 -16.600
419 3HZ LYS 60 3HZ LYS 60 2.568 -7.625 -16.074
420 H ALA 61 H ALA 61 4.859 -11.470 -9.601
421 HA ALA 61 HA ALA 61 2.772 -12.723 -10.843
422 1HB ALA 61 1HB ALA 61 4.905 -13.554 -12.632
423 2HB ALA 61 3HB ALA 61 3.272 -12.963 -13.021
424 3HB ALA 61 2HB ALA 61 4.604 -11.806 -12.788
425 H ASP 62 H ASP 62 3.660 -13.123 -8.421
426 HA ASP 62 HA ASP 62 5.403 -15.452 -8.627
427 1HB ASP 62 1HB ASP 62 6.228 -13.433 -7.277
428 2HB ASP 62 2HB ASP 62 4.903 -13.716 -6.166
429 H LYS 63 H LYS 63 4.938 -16.919 -6.464
430 HA LYS 63 HA LYS 63 2.052 -16.952 -5.975
431 1HB LYS 63 1HB LYS 63 2.381 -18.560 -7.735
432 2HB LYS 63 2HB LYS 63 3.748 -19.281 -6.910
433 1HG LYS 63 1HG LYS 63 2.085 -19.736 -4.945
434 2HG LYS 63 2HG LYS 63 0.817 -19.373 -6.098
435 1HD LYS 63 1HD LYS 63 0.978 -21.453 -6.982
436 2HD LYS 63 2HD LYS 63 2.664 -21.183 -7.376
437 1HE LYS 63 1HE LYS 63 3.297 -21.831 -5.026
438 2HE LYS 63 2HE LYS 63 1.610 -22.143 -4.671
439 1HZ LYS 63 1HZ LYS 63 2.892 -23.456 -6.941
440 2HZ LYS 63 2HZ LYS 63 3.074 -24.055 -5.433
441 3HZ LYS 63 3HZ LYS 63 1.584 -23.934 -6.089
442 H SER 64 H SER 64 2.625 -15.896 -3.957
443 HA SER 64 HA SER 64 2.954 -17.721 -1.907
444 1HB SER 64 1HB SER 64 5.154 -17.102 -1.010
445 2HB SER 64 2HB SER 64 5.329 -17.758 -2.625
446 HG SER 64 HG SER 64 6.537 -15.699 -2.079
447 H VAL 65 H VAL 65 3.104 -16.521 0.288
448 HA VAL 65 HA VAL 65 1.578 -14.072 0.022
449 HB VAL 65 HB VAL 65 0.739 -15.777 1.488
450 1HG1 VAL 65 1HG1 VAL 65 3.535 -15.766 2.568
451 2HG1 VAL 65 2HG1 VAL 65 2.193 -16.159 3.669
452 3HG1 VAL 65 3HG1 VAL 65 2.456 -17.133 2.202
453 1HG2 VAL 65 1HG2 VAL 65 0.850 -13.191 2.124
454 2HG2 VAL 65 2HG2 VAL 65 0.137 -14.401 3.217
455 3HG2 VAL 65 3HG2 VAL 65 1.799 -13.826 3.490
456 H ASN 66 H ASN 66 4.274 -13.881 -0.902
457 HA ASN 66 HA ASN 66 5.304 -12.114 1.172
458 1HB ASN 66 1HB ASN 66 6.971 -13.840 -0.735
459 2HB ASN 66 2HB ASN 66 7.620 -12.736 0.461
460 2HD2 ASN 66 2HD2 ASN 66 6.655 -13.078 2.730
461 1HD2 ASN 66 1HD2 ASN 66 6.613 -14.708 3.312
462 H SER 67 H SER 67 3.729 -12.191 -1.652
463 HA SER 67 HA SER 67 5.470 -10.736 -3.343
464 1HB SER 67 1HB SER 67 3.111 -10.324 -4.525
465 2HB SER 67 2HB SER 67 3.911 -11.880 -4.612
466 HG SER 67 HG SER 67 1.751 -12.239 -3.998
467 H TRP 68 H TRP 68 5.617 -8.495 -3.642
468 HA TRP 68 HA TRP 68 4.214 -6.898 -1.646
469 1HB TRP 68 1HB TRP 68 6.501 -6.491 -1.561
470 2HB TRP 68 2HB TRP 68 6.686 -6.525 -3.303
471 HD1 TRP 68 HD1 TRP 68 6.824 -4.161 -4.419
472 HE1 TRP 68 HE1 TRP 68 6.280 -1.654 -3.802
473 HE3 TRP 68 HE3 TRP 68 4.631 -5.188 0.052
474 HZ2 TRP 68 HZ2 TRP 68 5.021 -0.410 -1.563
475 HZ3 TRP 68 HZ3 TRP 68 3.771 -3.270 1.391
476 HH2 TRP 68 HH2 TRP 68 3.938 -0.946 0.650
477 H TYR 69 H TYR 69 3.201 -8.174 -4.260
478 HA TYR 69 HA TYR 69 2.110 -5.665 -5.448
479 1HB TYR 69 1HB TYR 69 3.606 -6.665 -7.038
480 2HB TYR 69 2HB TYR 69 2.923 -8.275 -6.757
481 HD1 TYR 69 HD1 TYR 69 0.561 -8.761 -7.500
482 HD2 TYR 69 HD2 TYR 69 2.651 -5.180 -8.622
483 HE1 TYR 69 HE1 TYR 69 -1.048 -8.403 -9.352
484 HE2 TYR 69 HE2 TYR 69 1.041 -4.821 -10.474
485 HH TYR 69 HH TYR 69 -1.903 -6.342 -10.754
486 H LYS 70 H LYS 70 1.425 -8.399 -3.556
487 HA LYS 70 HA LYS 70 -1.308 -8.511 -4.622
488 1HB LYS 70 1HB LYS 70 0.125 -10.623 -4.570
489 2HB LYS 70 2HB LYS 70 0.016 -10.551 -2.823
490 1HG LYS 70 1HG LYS 70 -2.645 -10.171 -3.719
491 2HG LYS 70 2HG LYS 70 -2.000 -11.415 -4.770
492 1HD LYS 70 1HD LYS 70 -2.035 -11.454 -1.718
493 2HD LYS 70 2HD LYS 70 -2.987 -12.467 -2.785
494 1HE LYS 70 1HE LYS 70 -1.138 -13.782 -3.424
495 2HE LYS 70 2HE LYS 70 0.022 -12.516 -3.072
496 1HZ LYS 70 1HZ LYS 70 -0.664 -12.828 -0.693
497 2HZ LYS 70 2HZ LYS 70 -1.414 -14.202 -1.158
498 3HZ LYS 70 3HZ LYS 70 0.199 -14.046 -1.354
499 H VAL 71 H VAL 71 0.735 -8.155 -1.681
500 HA VAL 71 HA VAL 71 -1.413 -7.903 0.107
501 HB VAL 71 HB VAL 71 0.292 -6.942 1.600
502 1HG1 VAL 71 1HG1 VAL 71 0.023 -9.433 1.161
503 2HG1 VAL 71 2HG1 VAL 71 1.452 -9.309 0.107
504 3HG1 VAL 71 3HG1 VAL 71 1.587 -8.920 1.839
505 1HG2 VAL 71 1HG2 VAL 71 1.517 -5.643 -0.136
506 2HG2 VAL 71 2HG2 VAL 71 2.586 -6.634 0.886
507 3HG2 VAL 71 3HG2 VAL 71 2.184 -7.169 -0.764
508 H VAL 72 H VAL 72 -0.449 -5.942 -2.496
509 HA VAL 72 HA VAL 72 -1.424 -3.512 -1.189
510 HB VAL 72 HB VAL 72 0.065 -3.995 -3.775
511 1HG1 VAL 72 1HG1 VAL 72 -1.296 -1.565 -2.681
512 2HG1 VAL 72 2HG1 VAL 72 0.266 -1.357 -3.509
513 3HG1 VAL 72 3HG1 VAL 72 -1.102 -2.110 -4.365
514 1HG2 VAL 72 1HG2 VAL 72 1.223 -4.164 -1.447
515 2HG2 VAL 72 2HG2 VAL 72 1.981 -3.188 -2.728
516 3HG2 VAL 72 3HG2 VAL 72 1.063 -2.391 -1.429
517 H HIS 73 H HIS 73 -1.860 -5.559 -4.151
518 HA HIS 73 HA HIS 73 -4.413 -4.226 -4.569
519 1HB HIS 73 2HB HIS 73 -2.984 -6.211 -6.355
520 2HB HIS 73 1HB HIS 73 -4.379 -5.236 -6.771
521 HD1 HIS 73 HD1 HIS 73 -0.650 -4.999 -6.225
522 HD2 HIS 73 HD2 HIS 73 -3.831 -2.561 -7.462
523 HE1 HIS 73 HE1 HIS 73 0.403 -2.887 -7.196
524 H ASP 74 H ASP 74 -3.863 -6.111 -2.299
525 HA ASP 74 HA ASP 74 -5.198 -8.510 -3.056
526 1HB ASP 74 1HB ASP 74 -3.701 -7.474 -0.762
527 2HB ASP 74 2HB ASP 74 -5.170 -8.262 -0.221
528 H ALA 75 H ALA 75 -7.444 -8.712 -3.074
529 HA ALA 75 HA ALA 75 -8.980 -6.614 -1.737
530 1HB ALA 75 1HB ALA 75 -9.297 -8.326 -4.149
531 2HB ALA 75 3HB ALA 75 -10.781 -8.031 -3.212
532 3HB ALA 75 2HB ALA 75 -9.842 -6.659 -3.848
533 H LYS 76 H LYS 76 -7.747 -9.694 -1.149
534 HA LYS 76 HA LYS 76 -10.104 -10.733 0.151
535 1HB LYS 76 1HB LYS 76 -8.210 -12.019 -1.134
536 2HB LYS 76 2HB LYS 76 -7.349 -11.914 0.388
537 1HG LYS 76 1HG LYS 76 -9.542 -12.830 1.479
538 2HG LYS 76 2HG LYS 76 -10.031 -13.245 -0.152
539 1HD LYS 76 1HD LYS 76 -7.344 -14.121 0.984
540 2HD LYS 76 2HD LYS 76 -8.797 -15.070 1.222
541 1HE LYS 76 1HE LYS 76 -8.845 -15.795 -0.959
542 2HE LYS 76 2HE LYS 76 -8.379 -14.231 -1.597
543 1HZ LYS 76 1HZ LYS 76 -6.166 -15.034 -0.323
544 2HZ LYS 76 2HZ LYS 76 -6.737 -16.449 -0.903
545 3HZ LYS 76 3HZ LYS 76 -6.434 -15.211 -1.924
546 H GLY 77 H GLY 77 -10.146 -11.272 2.470
547 1HA GLY 77 2HA GLY 77 -10.109 -10.512 4.595
548 2HA GLY 77 1HA GLY 77 -9.308 -9.052 4.048
549 H GLY 78 H GLY 78 -8.599 -10.313 6.485
550 1HA GLY 78 2HA GLY 78 -5.814 -11.011 5.887
551 2HA GLY 78 1HA GLY 78 -6.773 -12.149 6.814
552 H ALA 79 H ALA 79 -4.592 -11.205 8.104
553 HA ALA 79 HA ALA 79 -5.419 -10.296 10.476
554 1HB ALA 79 1HB ALA 79 -2.980 -9.091 10.336
555 2HB ALA 79 3HB ALA 79 -3.205 -10.843 10.553
556 3HB ALA 79 2HB ALA 79 -2.878 -10.182 8.933
557 H LYS 80 H LYS 80 -4.532 -8.248 7.629
558 HA LYS 80 HA LYS 80 -6.223 -6.165 8.722
559 1HB LYS 80 2HB LYS 80 -4.523 -4.435 8.550
560 2HB LYS 80 1HB LYS 80 -4.038 -5.662 9.704
561 1HG LYS 80 1HG LYS 80 -2.321 -6.467 8.353
562 2HG LYS 80 2HG LYS 80 -3.158 -6.079 6.863
563 1HD LYS 80 1HD LYS 80 -2.584 -3.747 7.014
564 2HD LYS 80 2HD LYS 80 -2.123 -3.884 8.699
565 1HE LYS 80 1HE LYS 80 -0.022 -4.669 8.199
566 2HE LYS 80 2HE LYS 80 -0.602 -5.700 6.906
567 1HZ LYS 80 1HZ LYS 80 -0.965 -3.080 6.108
568 2HZ LYS 80 2HZ LYS 80 0.553 -3.182 6.703
569 3HZ LYS 80 3HZ LYS 80 0.080 -4.177 5.497
570 HA PRO 81 HA PRO 81 -7.526 -5.738 4.597
571 1HB PRO 81 1HB PRO 81 -7.837 -2.954 4.515
572 2HB PRO 81 2HB PRO 81 -8.987 -4.099 5.278
573 1HG PRO 81 1HG PRO 81 -6.842 -2.635 6.269
574 2HG PRO 81 2HG PRO 81 -8.337 -2.571 7.259
575 1HD PRO 81 1HD PRO 81 -6.492 -4.141 8.185
576 2HD PRO 81 2HD PRO 81 -8.034 -4.974 7.822
577 H THR 82 H THR 82 -7.014 -3.877 2.652
578 HA THR 82 HA THR 82 -4.084 -3.587 2.670
579 HB THR 82 HB THR 82 -4.205 -4.271 0.230
580 HG1 THR 82 HG1 THR 82 -6.414 -5.427 -0.106
581 1HG2 THR 82 1HG2 THR 82 -4.512 -5.999 2.515
582 2HG2 THR 82 2HG2 THR 82 -5.577 -6.618 1.230
583 3HG2 THR 82 3HG2 THR 82 -3.836 -6.415 0.922
584 H CYS 83 H CYS 83 -3.846 -2.335 0.168
585 HA CYS 83 HA CYS 83 -4.737 0.269 0.937
586 1HB CYS 83 2HB CYS 83 -3.374 -0.417 -1.657
587 2HB CYS 83 1HB CYS 83 -3.356 1.097 -0.775
588 H ILE 84 H ILE 84 -6.225 -2.352 -0.506
589 HA ILE 84 HA ILE 84 -7.825 -0.635 -2.273
590 HB ILE 84 HB ILE 84 -6.871 -3.446 -2.480
591 1HG1 ILE 84 1HG1 ILE 84 -5.866 -1.507 -3.727
592 2HG1 ILE 84 2HG1 ILE 84 -6.391 -2.850 -4.723
593 1HG2 ILE 84 1HG2 ILE 84 -9.611 -2.512 -3.240
594 2HG2 ILE 84 2HG2 ILE 84 -8.753 -3.648 -4.309
595 3HG2 ILE 84 3HG2 ILE 84 -9.069 -4.087 -2.613
596 1HD1 ILE 84 1HD1 ILE 84 -8.650 -1.534 -4.942
597 2HD1 ILE 84 2HD1 ILE 84 -7.703 -0.141 -4.366
598 3HD1 ILE 84 3HD1 ILE 84 -7.241 -0.969 -5.872
599 H SER 85 H SER 85 -7.851 -3.238 0.219
600 HA SER 85 HA SER 85 -10.538 -3.605 0.377
601 1HB SER 85 1HB SER 85 -8.462 -4.667 1.669
602 2HB SER 85 2HB SER 85 -8.892 -3.504 2.908
603 HG SER 85 HG SER 85 -10.027 -5.895 2.440
604 H CYS 86 H CYS 86 -8.532 -1.384 2.461
605 HA CYS 86 HA CYS 86 -10.720 -0.173 3.672
606 1HB CYS 86 1HB CYS 86 -8.271 -0.141 4.406
607 2HB CYS 86 2HB CYS 86 -8.027 1.143 3.240
608 H HIS 87 H HIS 87 -8.541 0.983 0.987
609 HA HIS 87 HA HIS 87 -9.800 3.297 0.385
610 1HB HIS 87 1HB HIS 87 -8.296 1.284 -1.253
611 2HB HIS 87 2HB HIS 87 -9.058 2.638 -2.062
612 HD1 HIS 87 HD1 HIS 87 -6.785 3.718 -2.694
613 HD2 HIS 87 HD2 HIS 87 -7.360 3.239 1.433
614 HE1 HIS 87 HE1 HIS 87 -4.950 5.076 -1.554
615 H LYS 88 H LYS 88 -10.836 -0.039 -0.342
616 HA LYS 88 HA LYS 88 -12.824 0.670 -2.205
617 1HB LYS 88 1HB LYS 88 -12.049 -1.750 -0.652
618 2HB LYS 88 2HB LYS 88 -13.694 -1.693 -1.251
619 1HG LYS 88 1HG LYS 88 -11.256 -1.156 -3.008
620 2HG LYS 88 2HG LYS 88 -11.990 -2.739 -2.844
621 1HD LYS 88 1HD LYS 88 -14.102 -0.851 -3.394
622 2HD LYS 88 2HD LYS 88 -12.812 -0.552 -4.541
623 1HE LYS 88 2HE LYS 88 -14.043 -2.227 -5.640
624 2HE LYS 88 1HE LYS 88 -12.790 -3.168 -4.857
625 1HZ LYS 88 1HZ LYS 88 -14.925 -2.812 -3.092
626 2HZ LYS 88 2HZ LYS 88 -15.504 -3.389 -4.505
627 3HZ LYS 88 3HZ LYS 88 -14.334 -4.204 -3.708
628 H ASP 89 H ASP 89 -12.867 0.063 1.364
629 HA ASP 89 HA ASP 89 -15.553 0.331 1.719
630 1HB ASP 89 1HB ASP 89 -13.503 -0.162 3.367
631 2HB ASP 89 2HB ASP 89 -13.625 1.554 3.705
632 H LYS 90 H LYS 90 -12.921 2.794 1.509
633 HA LYS 90 HA LYS 90 -14.420 5.010 2.289
634 1HB LYS 90 1HB LYS 90 -11.842 4.498 0.915
635 2HB LYS 90 2HB LYS 90 -12.561 6.067 0.616
636 1HG LYS 90 1HG LYS 90 -12.193 4.905 3.415
637 2HG LYS 90 2HG LYS 90 -11.012 5.946 2.646
638 1HD LYS 90 1HD LYS 90 -12.454 7.830 2.669
639 2HD LYS 90 2HD LYS 90 -13.899 6.849 2.812
640 1HE LYS 90 1HE LYS 90 -11.785 7.235 4.986
641 2HE LYS 90 2HE LYS 90 -13.374 7.974 4.963
642 1HZ LYS 90 1HZ LYS 90 -14.164 5.557 4.791
643 2HZ LYS 90 2HZ LYS 90 -12.685 5.175 5.369
644 3HZ LYS 90 3HZ LYS 90 -13.683 6.128 6.244
645 H ALA 91 H ALA 91 -14.023 3.340 -0.862
646 HA ALA 91 HA ALA 91 -15.723 5.331 -2.129
647 1HB ALA 91 1HB ALA 91 -15.039 3.089 -3.811
648 2HB ALA 91 2HB ALA 91 -13.585 3.632 -2.939
649 3HB ALA 91 3HB ALA 91 -14.507 4.783 -3.935
650 H GLY 92 H GLY 92 -16.636 3.437 0.079
651 1HA GLY 92 2HA GLY 92 -18.198 1.785 0.415
652 2HA GLY 92 1HA GLY 92 -18.413 1.605 -1.315
653 H ASP 93 H ASP 93 -19.178 3.964 -2.337
654 HA ASP 93 HA ASP 93 -21.781 4.191 -1.706
655 1HB ASP 93 1HB ASP 93 -21.731 6.527 -0.553
656 2HB ASP 93 2HB ASP 93 -21.467 5.112 0.446
657 H ASP 94 H ASP 94 -18.976 6.503 -2.069
658 HA ASP 94 HA ASP 94 -20.341 7.883 -4.150
659 1HB ASP 94 1HB ASP 94 -18.855 9.073 -2.565
660 2HB ASP 94 2HB ASP 94 -17.494 8.087 -3.062
661 H LYS 95 H LYS 95 -20.129 7.411 -6.355
662 HA LYS 95 HA LYS 95 -18.529 5.179 -7.117
663 1HB LYS 95 1HB LYS 95 -20.860 6.037 -7.999
664 2HB LYS 95 2HB LYS 95 -19.879 7.010 -9.075
665 1HG LYS 95 1HG LYS 95 -18.597 4.794 -9.609
666 2HG LYS 95 2HG LYS 95 -19.942 3.978 -8.837
667 1HD LYS 95 1HD LYS 95 -21.528 5.098 -10.422
668 2HD LYS 95 2HD LYS 95 -20.179 5.905 -11.198
669 1HE LYS 95 1HE LYS 95 -19.962 4.100 -12.556
670 2HE LYS 95 2HE LYS 95 -19.435 3.174 -11.165
671 1HZ LYS 95 1HZ LYS 95 -22.242 3.465 -11.204
672 2HZ LYS 95 2HZ LYS 95 -21.709 2.782 -12.588
673 3HZ LYS 95 3HZ LYS 95 -21.346 2.101 -11.149
674 H GLU 96 H GLU 96 -18.388 8.755 -7.506
675 HA GLU 96 HA GLU 96 -16.210 8.719 -9.238
676 1HB GLU 96 1HB GLU 96 -17.724 10.669 -8.903
677 2HB GLU 96 2HB GLU 96 -17.100 10.883 -7.279
678 1HG GLU 96 1HG GLU 96 -14.737 10.936 -8.547
679 2HG GLU 96 2HG GLU 96 -15.726 11.384 -9.922
680 H LEU 97 H LEU 97 -16.524 8.324 -5.746
681 HA LEU 97 HA LEU 97 -13.821 9.000 -5.153
682 1HB LEU 97 1HB LEU 97 -15.874 9.078 -3.632
683 2HB LEU 97 2HB LEU 97 -15.693 7.342 -3.475
684 HG LEU 97 HG LEU 97 -14.684 8.417 -1.580
685 1HD1 LEU 97 1HD1 LEU 97 -13.522 6.451 -2.929
686 2HD1 LEU 97 2HD1 LEU 97 -12.235 7.667 -3.112
687 3HD1 LEU 97 3HD1 LEU 97 -12.772 7.177 -1.487
688 1HD2 LEU 97 1HD2 LEU 97 -13.814 10.352 -3.526
689 2HD2 LEU 97 2HD2 LEU 97 -13.837 10.459 -1.749
690 3HD2 LEU 97 3HD2 LEU 97 -12.424 9.768 -2.581
691 H LYS 98 H LYS 98 -15.482 6.242 -6.497
692 HA LYS 98 HA LYS 98 -13.397 4.401 -5.709
693 1HB LYS 98 1HB LYS 98 -15.868 3.830 -5.846
694 2HB LYS 98 2HB LYS 98 -15.720 3.920 -7.589
695 1HG LYS 98 1HG LYS 98 -13.635 2.289 -7.176
696 2HG LYS 98 2HG LYS 98 -14.477 1.936 -5.680
697 1HD LYS 98 1HD LYS 98 -15.838 1.806 -8.408
698 2HD LYS 98 2HD LYS 98 -15.049 0.422 -7.677
699 1HE LYS 98 1HE LYS 98 -17.226 2.006 -6.242
700 2HE LYS 98 2HE LYS 98 -17.586 0.633 -7.271
701 1HZ LYS 98 1HZ LYS 98 -15.686 0.465 -5.044
702 2HZ LYS 98 2HZ LYS 98 -17.278 0.144 -4.870
703 3HZ LYS 98 3HZ LYS 98 -16.365 -0.769 -5.871
704 H LYS 99 H LYS 99 -12.901 6.901 -7.403
705 HA LYS 99 HA LYS 99 -11.492 5.464 -9.522
706 1HB LYS 99 1HB LYS 99 -13.555 7.586 -9.854
707 2HB LYS 99 2HB LYS 99 -12.124 7.717 -10.856
708 1HG LYS 99 1HG LYS 99 -12.495 5.609 -11.897
709 2HG LYS 99 2HG LYS 99 -13.554 5.053 -10.616
710 1HD LYS 99 1HD LYS 99 -15.133 7.014 -11.332
711 2HD LYS 99 2HD LYS 99 -14.159 7.095 -12.787
712 1HE LYS 99 2HE LYS 99 -15.506 5.465 -13.630
713 2HE LYS 99 1HE LYS 99 -14.674 4.356 -12.559
714 1HZ LYS 99 1HZ LYS 99 -16.337 5.043 -10.849
715 2HZ LYS 99 2HZ LYS 99 -17.176 5.788 -12.035
716 3HZ LYS 99 3HZ LYS 99 -16.937 4.173 -12.094
717 H LYS 100 H LYS 100 -10.372 6.110 -7.074
718 HA LYS 100 HA LYS 100 -8.308 7.874 -7.920
719 1HB LYS 100 1HB LYS 100 -8.660 9.392 -5.846
720 2HB LYS 100 2HB LYS 100 -9.570 9.712 -7.309
721 1HG LYS 100 1HG LYS 100 -11.451 8.256 -6.319
722 2HG LYS 100 2HG LYS 100 -10.556 8.264 -4.812
723 1HD LYS 100 1HD LYS 100 -11.714 10.673 -6.280
724 2HD LYS 100 2HD LYS 100 -12.193 10.059 -4.711
725 1HE LYS 100 1HE LYS 100 -9.443 11.222 -5.365
726 2HE LYS 100 2HE LYS 100 -10.724 12.085 -4.538
727 1HZ LYS 100 1HZ LYS 100 -10.287 9.614 -3.297
728 2HZ LYS 100 2HZ LYS 100 -8.868 10.413 -3.418
729 3HZ LYS 100 3HZ LYS 100 -10.137 11.114 -2.668
730 H LEU 101 H LEU 101 -9.965 6.278 -5.125
731 HA LEU 101 HA LEU 101 -7.385 5.693 -3.953
732 1HB LEU 101 2HB LEU 101 -10.112 4.847 -2.986
733 2HB LEU 101 1HB LEU 101 -8.616 4.906 -2.075
734 HG LEU 101 HG LEU 101 -10.324 7.209 -3.017
735 1HD1 LEU 101 1HD1 LEU 101 -9.344 6.321 -0.291
736 2HD1 LEU 101 2HD1 LEU 101 -10.266 7.809 -0.614
737 3HD1 LEU 101 3HD1 LEU 101 -11.005 6.220 -0.924
738 1HD2 LEU 101 1HD2 LEU 101 -7.484 7.343 -1.971
739 2HD2 LEU 101 2HD2 LEU 101 -8.070 7.854 -3.572
740 3HD2 LEU 101 3HD2 LEU 101 -8.587 8.733 -2.113
741 H THR 102 H THR 102 -9.959 4.151 -5.861
742 HA THR 102 HA THR 102 -8.355 1.678 -5.823
743 HB THR 102 HB THR 102 -10.468 0.457 -5.997
744 HG1 THR 102 HG1 THR 102 -11.692 1.878 -7.304
745 1HG2 THR 102 1HG2 THR 102 -10.629 2.746 -3.973
746 2HG2 THR 102 2HG2 THR 102 -11.819 1.423 -4.034
747 3HG2 THR 102 3HG2 THR 102 -10.114 1.070 -3.665
748 H GLY 103 H GLY 103 -8.720 4.359 -7.569
749 1HA GLY 103 2HA GLY 103 -8.549 4.877 -9.750
750 2HA GLY 103 1HA GLY 103 -9.574 3.501 -10.106
751 H CYS 104 H CYS 104 -8.679 1.932 -11.365
752 HA CYS 104 HA CYS 104 -6.192 0.817 -10.867
753 1HB CYS 104 1HB CYS 104 -8.301 0.566 -12.874
754 2HB CYS 104 2HB CYS 104 -6.703 0.293 -13.541
755 H LYS 105 H LYS 105 -7.285 3.043 -13.540
756 HA LYS 105 HA LYS 105 -4.503 3.979 -13.694
757 1HB LYS 105 1HB LYS 105 -4.873 2.686 -15.652
758 2HB LYS 105 2HB LYS 105 -6.465 3.369 -15.910
759 1HG LYS 105 1HG LYS 105 -5.095 5.678 -15.986
760 2HG LYS 105 2HG LYS 105 -3.761 4.619 -16.397
761 1HD LYS 105 1HD LYS 105 -4.931 3.750 -18.342
762 2HD LYS 105 2HD LYS 105 -6.437 4.501 -17.854
763 1HE LYS 105 1HE LYS 105 -5.473 6.754 -18.195
764 2HE LYS 105 2HE LYS 105 -3.906 6.061 -18.562
765 1HZ LYS 105 1HZ LYS 105 -6.330 5.468 -20.110
766 2HZ LYS 105 2HZ LYS 105 -5.258 6.631 -20.517
767 3HZ LYS 105 3HZ LYS 105 -4.795 5.065 -20.495
768 H GLY 106 H GLY 106 -4.175 6.200 -13.736
769 1HA GLY 106 2HA GLY 106 -6.309 8.038 -14.217
770 2HA GLY 106 1HA GLY 106 -4.685 8.402 -13.670
771 H SER 107 H SER 107 -4.577 6.774 -11.300
772 HA SER 107 HA SER 107 -6.671 8.060 -9.727
773 1HB SER 107 1HB SER 107 -6.706 6.197 -8.253
774 2HB SER 107 2HB SER 107 -6.651 5.491 -9.856
775 HG SER 107 HG SER 107 -4.971 4.411 -9.066
776 H ALA 108 H ALA 108 -5.760 8.011 -7.200
777 HA ALA 108 HA ALA 108 -3.576 9.830 -7.267
778 1HB ALA 108 1HB ALA 108 -4.118 10.212 -5.037
779 2HB ALA 108 3HB ALA 108 -5.672 9.618 -5.670
780 3HB ALA 108 2HB ALA 108 -4.606 8.524 -4.756
781 H CYS 109 H CYS 109 -3.806 6.427 -7.397
782 HA CYS 109 HA CYS 109 -1.298 6.058 -5.974
783 1HB CYS 109 1HB CYS 109 -3.343 4.102 -7.056
784 2HB CYS 109 2HB CYS 109 -1.781 3.599 -6.441
785 H HIS 110 H HIS 110 -2.899 5.541 -9.188
786 HA HIS 110 HA HIS 110 -0.209 5.458 -10.349
787 1HB HIS 110 1HB HIS 110 -2.718 4.047 -11.298
788 2HB HIS 110 2HB HIS 110 -1.191 4.071 -12.158
789 HD1 HIS 110 HD1 HIS 110 0.878 3.365 -10.114
790 HD2 HIS 110 HD2 HIS 110 -2.927 1.601 -10.125
791 HE1 HIS 110 HE1 HIS 110 1.109 1.162 -8.849
792 HA PRO 111 HA PRO 111 -2.200 9.116 -12.145
793 1HB PRO 111 1HB PRO 111 -0.441 10.994 -11.368
794 2HB PRO 111 2HB PRO 111 -1.539 10.239 -10.167
795 1HG PRO 111 2HG PRO 111 1.094 9.610 -10.999
796 2HG PRO 111 1HG PRO 111 0.964 9.573 -9.210
797 1HD PRO 111 1HD PRO 111 1.029 7.268 -10.614
798 2HD PRO 111 2HD PRO 111 -0.148 7.445 -9.277
799 H SER 112 H SER 112 -1.422 7.604 -14.079
800 HA SER 112 HA SER 112 0.716 9.094 -15.354
801 1HB SER 112 1HB SER 112 0.812 6.287 -14.557
802 2HB SER 112 2HB SER 112 0.953 6.426 -16.298
803 HG SER 112 HG SER 112 2.995 6.943 -15.941
No H/Q in entry = 803
Start of MODEL 11
1 H1 VAL 1 H1 VAL 1 7.892 8.096 17.441
2 H2 VAL 1 H2 VAL 1 9.045 7.264 18.290
3 H3 VAL 1 H3 VAL 1 8.976 8.916 18.387
4 HA VAL 1 HA VAL 1 10.737 8.491 17.037
5 HB VAL 1 HB VAL 1 10.529 6.233 16.557
6 1HG1 VAL 1 1HG1 VAL 1 7.748 6.922 15.651
7 2HG1 VAL 1 2HG1 VAL 1 8.539 5.456 15.024
8 3HG1 VAL 1 3HG1 VAL 1 8.300 5.658 16.776
9 1HG2 VAL 1 1HG2 VAL 1 11.340 7.741 14.628
10 2HG2 VAL 1 2HG2 VAL 1 10.925 6.052 14.249
11 3HG2 VAL 1 3HG2 VAL 1 9.783 7.359 13.854
12 H ASP 2 H ASP 2 7.545 9.563 16.804
13 HA ASP 2 HA ASP 2 6.585 11.180 15.727
14 1HB ASP 2 1HB ASP 2 8.676 12.455 16.167
15 2HB ASP 2 2HB ASP 2 9.393 11.814 14.702
16 H VAL 3 H VAL 3 5.266 10.767 13.947
17 HA VAL 3 HA VAL 3 5.899 8.930 11.992
18 HB VAL 3 HB VAL 3 3.675 10.131 12.817
19 1HG1 VAL 3 1HG1 VAL 3 4.207 12.311 11.837
20 2HG1 VAL 3 2HG1 VAL 3 4.328 11.571 10.223
21 3HG1 VAL 3 3HG1 VAL 3 2.763 11.608 11.070
22 1HG2 VAL 3 1HG2 VAL 3 4.222 8.852 10.128
23 2HG2 VAL 3 2HG2 VAL 3 3.577 8.097 11.605
24 3HG2 VAL 3 3HG2 VAL 3 2.580 9.251 10.688
25 HA PRO 4 HA PRO 4 9.103 10.925 9.694
26 1HB PRO 4 1HB PRO 4 7.870 9.099 7.602
27 2HB PRO 4 2HB PRO 4 9.585 9.361 8.058
28 1HG PRO 4 1HG PRO 4 8.381 7.178 9.077
29 2HG PRO 4 2HG PRO 4 9.558 8.147 10.022
30 1HD PRO 4 2HD PRO 4 6.528 8.034 10.168
31 2HD PRO 4 1HD PRO 4 7.716 8.317 11.476
32 H ALA 5 H ALA 5 9.210 12.215 7.573
33 HA ALA 5 HA ALA 5 6.957 13.908 7.429
34 1HB ALA 5 1HB ALA 5 8.253 14.979 5.606
35 2HB ALA 5 3HB ALA 5 9.384 13.605 5.613
36 3HB ALA 5 2HB ALA 5 9.264 14.666 7.037
37 H ASP 6 H ASP 6 5.474 14.228 5.662
38 HA ASP 6 HA ASP 6 4.683 11.765 4.525
39 1HB ASP 6 1HB ASP 6 2.721 12.884 3.946
40 2HB ASP 6 2HB ASP 6 3.274 13.880 5.278
41 H GLY 7 H GLY 7 3.865 12.169 1.958
42 1HA GLY 7 2HA GLY 7 5.603 13.706 0.324
43 2HA GLY 7 1HA GLY 7 4.471 12.472 -0.191
44 H ALA 8 H ALA 8 5.499 10.251 1.377
45 HA ALA 8 HA ALA 8 8.284 10.011 0.631
46 1HB ALA 8 1HB ALA 8 6.705 9.058 2.712
47 2HB ALA 8 3HB ALA 8 6.912 7.628 1.671
48 3HB ALA 8 2HB ALA 8 8.339 8.487 2.298
49 H LYS 9 H LYS 9 8.802 9.482 -1.430
50 HA LYS 9 HA LYS 9 6.878 8.325 -3.165
51 1HB LYS 9 2HB LYS 9 8.356 8.816 -4.832
52 2HB LYS 9 1HB LYS 9 8.931 9.930 -3.608
53 1HG LYS 9 2HG LYS 9 10.971 8.954 -3.800
54 2HG LYS 9 1HG LYS 9 10.295 7.541 -3.013
55 1HD LYS 9 1HD LYS 9 10.470 6.333 -4.923
56 2HD LYS 9 2HD LYS 9 9.492 7.498 -5.794
57 1HE LYS 9 1HE LYS 9 11.740 7.259 -6.830
58 2HE LYS 9 2HE LYS 9 11.481 8.893 -6.251
59 1HZ LYS 9 1HZ LYS 9 12.882 6.824 -4.706
60 2HZ LYS 9 2HZ LYS 9 13.634 7.942 -5.629
61 3HZ LYS 9 3HZ LYS 9 12.762 8.409 -4.330
62 H ILE 10 H ILE 10 6.806 6.221 -4.061
63 HA ILE 10 HA ILE 10 8.493 4.269 -2.661
64 HB ILE 10 HB ILE 10 5.567 3.929 -3.322
65 1HG1 ILE 10 1HG1 ILE 10 6.648 4.166 -0.527
66 2HG1 ILE 10 2HG1 ILE 10 6.287 5.615 -1.444
67 1HG2 ILE 10 1HG2 ILE 10 7.619 2.047 -2.788
68 2HG2 ILE 10 2HG2 ILE 10 6.570 2.111 -1.352
69 3HG2 ILE 10 3HG2 ILE 10 5.869 1.765 -2.951
70 1HD1 ILE 10 1HD1 ILE 10 4.228 3.404 -1.353
71 2HD1 ILE 10 2HD1 ILE 10 4.410 4.488 0.047
72 3HD1 ILE 10 3HD1 ILE 10 3.990 5.157 -1.548
73 H ASP 11 H ASP 11 9.680 3.042 -4.023
74 HA ASP 11 HA ASP 11 8.558 2.280 -6.526
75 1HB ASP 11 1HB ASP 11 9.441 4.358 -7.314
76 2HB ASP 11 2HB ASP 11 10.875 4.229 -6.314
77 H PHE 12 H PHE 12 8.923 0.114 -5.728
78 HA PHE 12 HA PHE 12 11.748 -0.555 -5.283
79 1HB PHE 12 1HB PHE 12 9.132 -1.869 -4.328
80 2HB PHE 12 2HB PHE 12 10.734 -2.451 -3.921
81 HD1 PHE 12 HD1 PHE 12 12.122 0.096 -3.300
82 HD2 PHE 12 HD2 PHE 12 8.223 -1.232 -2.282
83 HE1 PHE 12 HE1 PHE 12 12.146 1.578 -1.275
84 HE2 PHE 12 HE2 PHE 12 8.247 0.250 -0.257
85 HZ PHE 12 HZ PHE 12 10.208 1.637 0.223
86 H ILE 13 H ILE 13 8.773 -1.174 -7.086
87 HA ILE 13 HA ILE 13 10.040 -3.496 -8.344
88 HB ILE 13 HB ILE 13 7.172 -2.564 -8.246
89 1HG1 ILE 13 1HG1 ILE 13 8.346 -5.140 -7.188
90 2HG1 ILE 13 2HG1 ILE 13 8.255 -3.687 -6.213
91 1HG2 ILE 13 1HG2 ILE 13 8.412 -4.873 -9.762
92 2HG2 ILE 13 2HG2 ILE 13 6.668 -4.685 -9.457
93 3HG2 ILE 13 3HG2 ILE 13 7.537 -3.476 -10.434
94 1HD1 ILE 13 1HD1 ILE 13 5.739 -4.429 -7.648
95 2HD1 ILE 13 2HD1 ILE 13 6.249 -5.523 -6.340
96 3HD1 ILE 13 3HD1 ILE 13 5.965 -3.800 -5.998
97 H ALA 14 H ALA 14 11.383 -2.785 -9.944
98 HA ALA 14 HA ALA 14 10.541 -0.518 -11.548
99 1HB ALA 14 1HB ALA 14 13.065 -2.075 -11.076
100 2HB ALA 14 2HB ALA 14 12.888 -1.200 -12.616
101 3HB ALA 14 3HB ALA 14 12.795 -0.316 -11.073
102 H GLY 15 H GLY 15 10.132 -0.619 -13.802
103 1HA GLY 15 2HA GLY 15 9.056 -3.157 -14.678
104 2HA GLY 15 1HA GLY 15 10.476 -2.631 -15.560
105 H GLY 16 H GLY 16 8.322 -2.835 -17.122
106 1HA GLY 16 2HA GLY 16 6.602 -0.571 -17.150
107 2HA GLY 16 1HA GLY 16 6.824 -1.759 -18.419
108 H GLU 17 H GLU 17 6.482 0.649 -19.443
109 HA GLU 17 HA GLU 17 8.585 1.153 -20.989
110 1HB GLU 17 1HB GLU 17 6.389 2.160 -21.361
111 2HB GLU 17 2HB GLU 17 6.541 3.144 -19.919
112 1HG GLU 17 1HG GLU 17 8.779 3.991 -21.132
113 2HG GLU 17 2HG GLU 17 7.953 3.434 -22.573
114 H LYS 18 H LYS 18 8.132 2.188 -17.622
115 HA LYS 18 HA LYS 18 10.894 3.043 -17.576
116 1HB LYS 18 1HB LYS 18 10.118 5.169 -16.305
117 2HB LYS 18 2HB LYS 18 10.121 5.166 -18.057
118 1HG LYS 18 2HG LYS 18 7.896 5.591 -18.085
119 2HG LYS 18 1HG LYS 18 7.582 4.107 -17.208
120 1HD LYS 18 2HD LYS 18 6.847 5.443 -15.515
121 2HD LYS 18 1HD LYS 18 8.539 5.760 -15.188
122 1HE LYS 18 1HE LYS 18 7.404 7.424 -17.378
123 2HE LYS 18 2HE LYS 18 6.653 7.696 -15.818
124 1HZ LYS 18 1HZ LYS 18 9.376 7.539 -15.403
125 2HZ LYS 18 2HZ LYS 18 9.161 8.526 -16.686
126 3HZ LYS 18 3HZ LYS 18 8.421 8.857 -15.269
127 H ASN 19 H ASN 19 8.020 3.519 -15.413
128 HA ASN 19 HA ASN 19 8.217 1.342 -13.893
129 1HB ASN 19 1HB ASN 19 9.567 2.503 -11.861
130 2HB ASN 19 2HB ASN 19 10.391 1.531 -13.064
131 2HD2 ASN 19 2HD2 ASN 19 9.125 4.852 -12.758
132 1HD2 ASN 19 1HD2 ASN 19 10.524 5.676 -13.362
133 H LEU 20 H LEU 20 6.373 1.525 -12.587
134 HA LEU 20 HA LEU 20 5.110 4.075 -12.389
135 1HB LEU 20 1HB LEU 20 4.430 1.299 -11.438
136 2HB LEU 20 2HB LEU 20 3.440 2.690 -11.041
137 HG LEU 20 HG LEU 20 3.944 1.451 -13.742
138 1HD1 LEU 20 1HD1 LEU 20 1.491 2.022 -12.073
139 2HD1 LEU 20 2HD1 LEU 20 1.413 1.580 -13.796
140 3HD1 LEU 20 3HD1 LEU 20 2.123 0.449 -12.618
141 1HD2 LEU 20 1HD2 LEU 20 2.921 4.236 -13.162
142 2HD2 LEU 20 2HD2 LEU 20 4.268 3.747 -14.219
143 3HD2 LEU 20 3HD2 LEU 20 2.591 3.371 -14.682
144 H THR 21 H THR 21 5.025 5.483 -10.677
145 HA THR 21 HA THR 21 6.391 4.603 -8.220
146 HB THR 21 HB THR 21 6.498 7.469 -9.182
147 HG1 THR 21 HG1 THR 21 8.198 5.222 -10.003
148 1HG2 THR 21 1HG2 THR 21 7.704 6.004 -7.093
149 2HG2 THR 21 2HG2 THR 21 8.970 6.099 -8.341
150 3HG2 THR 21 3HG2 THR 21 8.240 7.590 -7.698
151 H VAL 22 H VAL 22 5.124 4.606 -6.481
152 HA VAL 22 HA VAL 22 2.683 6.214 -6.638
153 HB VAL 22 HB VAL 22 3.469 3.829 -4.956
154 1HG1 VAL 22 1HG1 VAL 22 2.055 5.349 -3.650
155 2HG1 VAL 22 2HG1 VAL 22 0.857 5.379 -4.966
156 3HG1 VAL 22 3HG1 VAL 22 1.172 3.866 -4.083
157 1HG2 VAL 22 1HG2 VAL 22 2.805 3.662 -7.491
158 2HG2 VAL 22 2HG2 VAL 22 2.113 2.527 -6.307
159 3HG2 VAL 22 3HG2 VAL 22 1.156 3.918 -6.872
160 H VAL 23 H VAL 23 2.055 7.557 -4.841
161 HA VAL 23 HA VAL 23 4.368 8.343 -3.208
162 HB VAL 23 HB VAL 23 2.066 9.909 -4.370
163 1HG1 VAL 23 1HG1 VAL 23 3.555 10.398 -1.899
164 2HG1 VAL 23 2HG1 VAL 23 3.692 11.740 -3.060
165 3HG1 VAL 23 3HG1 VAL 23 2.087 11.185 -2.527
166 1HG2 VAL 23 1HG2 VAL 23 4.536 9.352 -5.413
167 2HG2 VAL 23 2HG2 VAL 23 3.556 10.781 -5.820
168 3HG2 VAL 23 3HG2 VAL 23 4.837 10.901 -4.590
169 H PHE 24 H PHE 24 4.070 8.664 -0.966
170 HA PHE 24 HA PHE 24 1.427 7.919 0.047
171 1HB PHE 24 1HB PHE 24 3.092 5.979 0.044
172 2HB PHE 24 2HB PHE 24 4.198 6.959 0.986
173 HD1 PHE 24 HD1 PHE 24 0.567 6.077 1.214
174 HD2 PHE 24 HD2 PHE 24 4.314 6.335 3.190
175 HE1 PHE 24 HE1 PHE 24 -0.491 5.237 3.330
176 HE2 PHE 24 HE2 PHE 24 3.256 5.495 5.306
177 HZ PHE 24 HZ PHE 24 0.867 4.955 5.350
178 H ASN 25 H ASN 25 0.865 8.857 2.079
179 HA ASN 25 HA ASN 25 2.834 10.722 3.120
180 1HB ASN 25 1HB ASN 25 0.360 12.011 3.506
181 2HB ASN 25 2HB ASN 25 1.579 12.468 2.333
182 2HD2 ASN 25 2HD2 ASN 25 1.140 12.355 0.250
183 1HD2 ASN 25 1HD2 ASN 25 -0.242 11.604 -0.475
184 H HIS 26 H HIS 26 2.989 10.432 5.356
185 HA HIS 26 HA HIS 26 1.223 8.608 6.621
186 1HB HIS 26 1HB HIS 26 3.691 10.112 7.329
187 2HB HIS 26 2HB HIS 26 2.662 9.631 8.663
188 HD1 HIS 26 HD1 HIS 26 4.885 8.223 5.969
189 HD2 HIS 26 HD2 HIS 26 2.539 6.846 9.162
190 HE1 HIS 26 HE1 HIS 26 5.520 5.777 6.319
191 H SER 27 H SER 27 1.220 12.026 6.022
192 HA SER 27 HA SER 27 -0.369 12.611 8.330
193 1HB SER 27 1HB SER 27 -0.485 14.916 7.255
194 2HB SER 27 2HB SER 27 1.129 14.351 7.640
195 HG SER 27 HG SER 27 0.180 15.137 5.242
196 H THR 28 H THR 28 -1.086 10.775 5.811
197 HA THR 28 HA THR 28 -3.647 12.084 5.192
198 HB THR 28 HB THR 28 -1.944 9.995 3.742
199 HG1 THR 28 HG1 THR 28 -1.591 12.464 3.762
200 1HG2 THR 28 1HG2 THR 28 -4.786 10.324 3.609
201 2HG2 THR 28 2HG2 THR 28 -4.115 11.161 2.189
202 3HG2 THR 28 3HG2 THR 28 -3.752 9.440 2.461
203 H HIS 29 H HIS 29 -2.099 9.064 6.360
204 HA HIS 29 HA HIS 29 -4.777 8.071 6.965
205 1HB HIS 29 1HB HIS 29 -2.142 6.578 7.023
206 2HB HIS 29 2HB HIS 29 -3.744 5.888 7.192
207 HD1 HIS 29 HD1 HIS 29 -1.390 7.334 4.619
208 HD2 HIS 29 HD2 HIS 29 -5.167 5.518 4.786
209 HE1 HIS 29 HE1 HIS 29 -2.022 6.778 2.211
210 H LYS 30 H LYS 30 -3.259 10.275 8.409
211 HA LYS 30 HA LYS 30 -2.192 9.330 10.783
212 1HB LYS 30 1HB LYS 30 -2.433 11.572 11.584
213 2HB LYS 30 2HB LYS 30 -2.004 11.644 9.887
214 1HG LYS 30 1HG LYS 30 -4.269 12.168 9.229
215 2HG LYS 30 2HG LYS 30 -4.907 11.734 10.802
216 1HD LYS 30 1HD LYS 30 -2.840 13.793 11.065
217 2HD LYS 30 2HD LYS 30 -4.083 14.310 9.943
218 1HE LYS 30 1HE LYS 30 -5.615 13.211 11.975
219 2HE LYS 30 2HE LYS 30 -4.258 13.853 12.880
220 1HZ LYS 30 1HZ LYS 30 -4.724 15.880 11.302
221 2HZ LYS 30 2HZ LYS 30 -6.236 15.262 11.323
222 3HZ LYS 30 3HZ LYS 30 -5.511 15.693 12.721
223 H ASP 31 H ASP 31 -5.452 9.260 9.585
224 HA ASP 31 HA ASP 31 -6.573 9.145 12.221
225 1HB ASP 31 1HB ASP 31 -8.030 10.178 10.675
226 2HB ASP 31 2HB ASP 31 -7.626 9.057 9.390
227 H VAL 32 H VAL 32 -4.773 7.081 10.325
228 HA VAL 32 HA VAL 32 -6.323 4.711 11.109
229 HB VAL 32 HB VAL 32 -4.234 5.024 8.944
230 1HG1 VAL 32 1HG1 VAL 32 -6.049 2.702 9.675
231 2HG1 VAL 32 2HG1 VAL 32 -5.042 2.789 8.210
232 3HG1 VAL 32 3HG1 VAL 32 -4.276 2.761 9.816
233 1HG2 VAL 32 1HG2 VAL 32 -7.035 5.705 8.970
234 2HG2 VAL 32 2HG2 VAL 32 -5.844 5.874 7.658
235 3HG2 VAL 32 3HG2 VAL 32 -6.753 4.356 7.844
236 H LYS 33 H LYS 33 -5.434 3.287 12.552
237 HA LYS 33 HA LYS 33 -3.349 4.058 14.161
238 1HB LYS 33 2HB LYS 33 -4.357 1.251 13.604
239 2HB LYS 33 1HB LYS 33 -3.384 1.732 14.980
240 1HG LYS 33 1HG LYS 33 -5.772 3.443 14.607
241 2HG LYS 33 2HG LYS 33 -6.176 1.758 14.870
242 1HD LYS 33 1HD LYS 33 -4.854 1.709 16.948
243 2HD LYS 33 2HD LYS 33 -4.264 3.333 16.657
244 1HE LYS 33 1HE LYS 33 -6.436 4.309 17.015
245 2HE LYS 33 2HE LYS 33 -7.246 2.761 16.872
246 1HZ LYS 33 1HZ LYS 33 -6.029 2.083 18.889
247 2HZ LYS 33 2HZ LYS 33 -5.468 3.608 19.049
248 3HZ LYS 33 3HZ LYS 33 -7.072 3.314 19.144
249 H CYS 34 H CYS 34 -1.167 3.095 14.443
250 HA CYS 34 HA CYS 34 0.198 3.155 11.960
251 1HB CYS 34 1HB CYS 34 1.365 2.335 14.617
252 2HB CYS 34 2HB CYS 34 2.198 3.007 13.229
253 H ASP 35 H ASP 35 -0.744 0.673 14.404
254 HA ASP 35 HA ASP 35 0.681 -1.409 13.241
255 1HB ASP 35 1HB ASP 35 -0.927 -2.865 14.549
256 2HB ASP 35 2HB ASP 35 -0.138 -1.627 15.505
257 H ASP 36 H ASP 36 -1.988 0.406 12.130
258 HA ASP 36 HA ASP 36 -3.617 -1.559 11.058
259 1HB ASP 36 1HB ASP 36 -3.882 1.071 11.303
260 2HB ASP 36 2HB ASP 36 -3.164 1.116 9.705
261 H CYS 37 H CYS 37 -0.435 -0.401 10.232
262 HA CYS 37 HA CYS 37 -0.592 -1.855 7.699
263 1HB CYS 37 1HB CYS 37 0.784 0.812 8.155
264 2HB CYS 37 2HB CYS 37 1.033 -0.194 6.742
265 H HIS 38 H HIS 38 1.478 -0.405 10.306
266 HA HIS 38 HA HIS 38 3.634 -2.177 9.701
267 1HB HIS 38 1HB HIS 38 3.194 -0.301 12.042
268 2HB HIS 38 2HB HIS 38 4.691 -1.138 11.679
269 HD1 HIS 38 HD1 HIS 38 5.719 -0.521 9.163
270 HD2 HIS 38 HD2 HIS 38 3.005 2.173 10.887
271 HE1 HIS 38 HE1 HIS 38 6.034 1.694 7.936
272 H HIS 39 H HIS 39 2.753 -4.296 9.879
273 HA HIS 39 HA HIS 39 1.794 -4.995 12.546
274 1HB HIS 39 2HB HIS 39 0.650 -6.787 11.594
275 2HB HIS 39 1HB HIS 39 0.436 -5.484 10.441
276 HD1 HIS 39 HD1 HIS 39 1.380 -8.965 10.610
277 HD2 HIS 39 HD2 HIS 39 2.460 -5.705 8.201
278 HE1 HIS 39 HE1 HIS 39 2.433 -9.949 8.505
279 H GLN 40 H GLN 40 4.505 -4.419 12.450
280 HA GLN 40 HA GLN 40 5.728 -7.056 12.274
281 1HB GLN 40 1HB GLN 40 6.792 -4.244 11.984
282 2HB GLN 40 2HB GLN 40 7.886 -5.511 12.501
283 1HG GLN 40 1HG GLN 40 7.631 -5.033 9.932
284 2HG GLN 40 2HG GLN 40 7.703 -6.697 10.476
285 2HE2 GLN 40 2HE2 GLN 40 5.857 -7.968 10.529
286 1HE2 GLN 40 1HE2 GLN 40 4.411 -7.572 9.661
287 HA PRO 41 HA PRO 41 6.124 -7.562 16.594
288 1HB PRO 41 1HB PRO 41 8.820 -8.380 16.695
289 2HB PRO 41 2HB PRO 41 7.421 -9.425 16.286
290 1HG PRO 41 1HG PRO 41 9.313 -8.073 14.406
291 2HG PRO 41 2HG PRO 41 8.661 -9.742 14.320
292 1HD PRO 41 1HD PRO 41 7.578 -7.762 12.824
293 2HD PRO 41 2HD PRO 41 6.505 -8.929 13.655
294 H GLY 42 H GLY 42 6.880 -6.392 18.465
295 1HA GLY 42 2HA GLY 42 7.947 -4.762 19.605
296 2HA GLY 42 1HA GLY 42 7.526 -3.772 18.222
297 H ASP 43 H ASP 43 9.641 -2.695 19.060
298 HA ASP 43 HA ASP 43 11.824 -2.425 19.032
299 1HB ASP 43 1HB ASP 43 11.776 -5.171 18.996
300 2HB ASP 43 2HB ASP 43 12.503 -4.863 17.431
301 H LYS 44 H LYS 44 10.733 -4.324 16.110
302 HA LYS 44 HA LYS 44 11.771 -2.133 14.450
303 1HB LYS 44 1HB LYS 44 11.680 -5.112 13.908
304 2HB LYS 44 2HB LYS 44 12.007 -3.914 12.673
305 1HG LYS 44 1HG LYS 44 13.982 -3.106 13.899
306 2HG LYS 44 2HG LYS 44 13.613 -4.147 15.259
307 1HD LYS 44 2HD LYS 44 15.087 -5.577 14.230
308 2HD LYS 44 1HD LYS 44 13.680 -6.029 13.288
309 1HE LYS 44 1HE LYS 44 14.503 -3.869 11.833
310 2HE LYS 44 2HE LYS 44 16.049 -4.369 12.490
311 1HZ LYS 44 1HZ LYS 44 14.256 -6.322 11.260
312 2HZ LYS 44 2HZ LYS 44 15.265 -5.421 10.345
313 3HZ LYS 44 3HZ LYS 44 15.870 -6.422 11.485
314 H GLN 45 H GLN 45 9.132 -2.368 15.826
315 HA GLN 45 HA GLN 45 7.101 -3.311 14.431
316 1HB GLN 45 1HB GLN 45 6.958 -1.932 16.520
317 2HB GLN 45 2HB GLN 45 7.222 -0.483 15.570
318 1HG GLN 45 1HG GLN 45 5.141 -0.765 14.371
319 2HG GLN 45 2HG GLN 45 4.943 -2.407 14.951
320 2HE2 GLN 45 2HE2 GLN 45 2.823 -1.541 15.547
321 1HE2 GLN 45 1HE2 GLN 45 2.613 -0.785 17.091
322 H TYR 46 H TYR 46 9.031 -0.450 13.622
323 HA TYR 46 HA TYR 46 7.521 -0.157 11.075
324 1HB TYR 46 2HB TYR 46 9.512 1.792 12.248
325 2HB TYR 46 1HB TYR 46 8.265 2.090 11.025
326 HD1 TYR 46 HD1 TYR 46 5.848 2.121 11.699
327 HD2 TYR 46 HD2 TYR 46 9.035 1.962 14.574
328 HE1 TYR 46 HE1 TYR 46 4.281 2.856 13.475
329 HE2 TYR 46 HE2 TYR 46 7.469 2.698 16.351
330 HH TYR 46 HH TYR 46 4.926 4.178 16.148
331 H ALA 47 H ALA 47 8.587 -1.916 9.922
332 HA ALA 47 HA ALA 47 11.378 -1.241 9.299
333 1HB ALA 47 1HB ALA 47 11.278 -3.207 10.793
334 2HB ALA 47 3HB ALA 47 10.167 -4.013 9.660
335 3HB ALA 47 2HB ALA 47 11.841 -3.661 9.167
336 H GLY 48 H GLY 48 11.878 -2.875 7.196
337 1HA GLY 48 2HA GLY 48 11.606 -2.881 4.954
338 2HA GLY 48 1HA GLY 48 10.312 -1.710 5.117
339 H CYS 49 H CYS 49 8.788 -2.665 3.737
340 HA CYS 49 HA CYS 49 7.385 -4.880 4.864
341 1HB CYS 49 1HB CYS 49 6.871 -3.543 2.206
342 2HB CYS 49 2HB CYS 49 5.757 -4.507 3.155
343 H THR 50 H THR 50 9.650 -4.192 2.178
344 HA THR 50 HA THR 50 9.356 -6.897 1.140
345 HB THR 50 HB THR 50 10.612 -6.031 -0.730
346 HG1 THR 50 HG1 THR 50 11.274 -4.045 1.315
347 1HG2 THR 50 1HG2 THR 50 8.326 -4.895 -0.430
348 2HG2 THR 50 2HG2 THR 50 9.185 -3.560 0.375
349 3HG2 THR 50 3HG2 THR 50 9.522 -3.935 -1.333
350 H THR 51 H THR 51 10.489 -6.173 3.912
351 HA THR 51 HA THR 51 13.263 -6.708 3.795
352 HB THR 51 HB THR 51 11.288 -7.150 6.092
353 HG1 THR 51 HG1 THR 51 12.762 -4.825 5.067
354 1HG2 THR 51 1HG2 THR 51 13.720 -7.837 6.457
355 2HG2 THR 51 2HG2 THR 51 14.187 -6.165 6.065
356 3HG2 THR 51 3HG2 THR 51 13.187 -6.496 7.500
357 H ASP 52 H ASP 52 14.394 -8.626 4.582
358 HA ASP 52 HA ASP 52 13.690 -10.837 3.168
359 1HB ASP 52 1HB ASP 52 15.923 -10.234 4.321
360 2HB ASP 52 2HB ASP 52 15.241 -10.893 5.794
361 H GLY 53 H GLY 53 12.908 -13.006 3.941
362 1HA GLY 53 2HA GLY 53 11.947 -13.541 6.494
363 2HA GLY 53 1HA GLY 53 11.447 -14.334 5.013
364 H CYS 54 H CYS 54 10.706 -11.380 4.054
365 HA CYS 54 HA CYS 54 8.071 -11.465 5.323
366 1HB CYS 54 2HB CYS 54 9.469 -8.883 4.576
367 2HB CYS 54 1HB CYS 54 7.965 -9.076 5.456
368 H HIS 55 H HIS 55 7.797 -8.885 3.428
369 HA HIS 55 HA HIS 55 6.913 -10.465 1.176
370 1HB HIS 55 2HB HIS 55 6.600 -7.484 1.550
371 2HB HIS 55 1HB HIS 55 5.659 -8.552 0.529
372 HD1 HIS 55 HD1 HIS 55 4.057 -10.316 1.842
373 HD2 HIS 55 HD2 HIS 55 5.621 -7.154 4.112
374 HE1 HIS 55 HE1 HIS 55 2.641 -10.189 3.961
375 H ASN 56 H ASN 56 9.682 -10.565 1.392
376 HA ASN 56 HA ASN 56 10.803 -8.482 -0.185
377 1HB ASN 56 1HB ASN 56 12.136 -9.651 1.569
378 2HB ASN 56 2HB ASN 56 11.925 -11.181 0.738
379 2HD2 ASN 56 2HD2 ASN 56 14.354 -9.749 1.437
380 1HD2 ASN 56 1HD2 ASN 56 15.241 -9.474 -0.025
381 H ILE 57 H ILE 57 9.050 -9.024 -1.961
382 HA ILE 57 HA ILE 57 10.246 -10.967 -3.793
383 HB ILE 57 HB ILE 57 7.284 -10.689 -3.276
384 1HG1 ILE 57 1HG1 ILE 57 8.783 -11.815 -1.471
385 2HG1 ILE 57 2HG1 ILE 57 7.308 -12.603 -1.993
386 1HG2 ILE 57 1HG2 ILE 57 7.915 -11.241 -5.610
387 2HG2 ILE 57 2HG2 ILE 57 8.781 -12.674 -5.008
388 3HG2 ILE 57 3HG2 ILE 57 7.019 -12.544 -4.793
389 1HD1 ILE 57 1HD1 ILE 57 10.069 -13.200 -3.152
390 2HD1 ILE 57 2HD1 ILE 57 9.269 -14.168 -1.890
391 3HD1 ILE 57 3HD1 ILE 57 8.558 -14.066 -3.519
392 H LEU 58 H LEU 58 11.056 -9.723 -5.398
393 HA LEU 58 HA LEU 58 9.526 -7.344 -6.143
394 1HB LEU 58 1HB LEU 58 12.375 -8.143 -6.756
395 2HB LEU 58 2HB LEU 58 11.598 -6.665 -7.288
396 HG LEU 58 HG LEU 58 12.264 -7.468 -4.447
397 1HD1 LEU 58 1HD1 LEU 58 13.252 -5.215 -6.217
398 2HD1 LEU 58 2HD1 LEU 58 13.664 -5.433 -4.499
399 3HD1 LEU 58 3HD1 LEU 58 14.168 -6.650 -5.697
400 1HD2 LEU 58 1HD2 LEU 58 10.243 -5.592 -5.442
401 2HD2 LEU 58 2HD2 LEU 58 10.471 -6.291 -3.821
402 3HD2 LEU 58 3HD2 LEU 58 11.407 -4.859 -4.312
403 H ASP 59 H ASP 59 9.268 -10.458 -6.825
404 HA ASP 59 HA ASP 59 9.388 -10.151 -9.702
405 1HB ASP 59 1HB ASP 59 8.708 -12.683 -9.535
406 2HB ASP 59 2HB ASP 59 10.348 -12.216 -9.134
407 H LYS 60 H LYS 60 7.442 -8.575 -9.371
408 HA LYS 60 HA LYS 60 5.041 -9.177 -8.323
409 1HB LYS 60 1HB LYS 60 4.076 -7.660 -10.013
410 2HB LYS 60 2HB LYS 60 5.541 -7.025 -9.290
411 1HG LYS 60 1HG LYS 60 6.870 -7.696 -11.245
412 2HG LYS 60 2HG LYS 60 5.498 -8.532 -11.945
413 1HD LYS 60 1HD LYS 60 5.102 -5.633 -11.260
414 2HD LYS 60 2HD LYS 60 6.163 -5.983 -12.611
415 1HE LYS 60 1HE LYS 60 4.236 -7.567 -13.440
416 2HE LYS 60 2HE LYS 60 3.227 -6.703 -12.297
417 1HZ LYS 60 1HZ LYS 60 4.553 -4.750 -13.610
418 2HZ LYS 60 2HZ LYS 60 4.238 -5.832 -14.792
419 3HZ LYS 60 3HZ LYS 60 3.016 -5.218 -13.899
420 H ALA 61 H ALA 61 3.174 -10.334 -8.874
421 HA ALA 61 HA ALA 61 1.883 -11.763 -10.010
422 1HB ALA 61 1HB ALA 61 3.902 -12.274 -12.168
423 2HB ALA 61 3HB ALA 61 2.135 -12.087 -12.280
424 3HB ALA 61 2HB ALA 61 3.170 -10.653 -12.077
425 H ASP 62 H ASP 62 3.339 -12.537 -7.832
426 HA ASP 62 HA ASP 62 4.532 -15.059 -8.660
427 1HB ASP 62 1HB ASP 62 5.853 -13.380 -7.226
428 2HB ASP 62 2HB ASP 62 4.709 -13.695 -5.936
429 H LYS 63 H LYS 63 4.217 -16.761 -6.637
430 HA LYS 63 HA LYS 63 1.406 -16.569 -5.808
431 1HB LYS 63 1HB LYS 63 1.808 -18.171 -7.712
432 2HB LYS 63 2HB LYS 63 2.829 -19.111 -6.643
433 1HG LYS 63 1HG LYS 63 0.934 -19.410 -5.058
434 2HG LYS 63 2HG LYS 63 -0.093 -18.420 -6.076
435 1HD LYS 63 1HD LYS 63 0.212 -20.063 -7.955
436 2HD LYS 63 2HD LYS 63 1.198 -21.062 -6.906
437 1HE LYS 63 1HE LYS 63 -0.640 -21.614 -5.487
438 2HE LYS 63 2HE LYS 63 -1.600 -20.258 -6.043
439 1HZ LYS 63 1HZ LYS 63 -0.855 -22.046 -8.132
440 2HZ LYS 63 2HZ LYS 63 -1.777 -22.753 -6.984
441 3HZ LYS 63 3HZ LYS 63 -2.321 -21.426 -7.767
442 H SER 64 H SER 64 2.112 -15.621 -3.802
443 HA SER 64 HA SER 64 2.547 -17.518 -1.836
444 1HB SER 64 2HB SER 64 4.818 -16.846 -1.052
445 2HB SER 64 1HB SER 64 4.858 -17.621 -2.624
446 HG SER 64 HG SER 64 5.104 -15.579 -3.635
447 H VAL 65 H VAL 65 2.788 -16.420 0.379
448 HA VAL 65 HA VAL 65 1.332 -13.916 0.280
449 HB VAL 65 HB VAL 65 0.482 -15.640 1.704
450 1HG1 VAL 65 1HG1 VAL 65 3.311 -15.997 2.404
451 2HG1 VAL 65 2HG1 VAL 65 2.226 -16.007 3.814
452 3HG1 VAL 65 3HG1 VAL 65 1.956 -17.149 2.475
453 1HG2 VAL 65 1HG2 VAL 65 0.904 -13.068 2.502
454 2HG2 VAL 65 2HG2 VAL 65 -0.047 -14.264 3.415
455 3HG2 VAL 65 3HG2 VAL 65 1.655 -13.966 3.842
456 H ASN 66 H ASN 66 3.990 -13.755 -0.741
457 HA ASN 66 HA ASN 66 5.124 -12.070 1.340
458 1HB ASN 66 1HB ASN 66 6.721 -13.859 -0.568
459 2HB ASN 66 2HB ASN 66 7.411 -12.783 0.631
460 2HD2 ASN 66 2HD2 ASN 66 6.458 -13.093 2.900
461 1HD2 ASN 66 1HD2 ASN 66 6.345 -14.721 3.478
462 H SER 67 H SER 67 3.520 -12.061 -1.451
463 HA SER 67 HA SER 67 5.318 -10.684 -3.159
464 1HB SER 67 1HB SER 67 2.949 -10.192 -4.320
465 2HB SER 67 2HB SER 67 3.734 -11.754 -4.447
466 HG SER 67 HG SER 67 1.526 -12.019 -3.826
467 H TRP 68 H TRP 68 5.556 -8.452 -3.438
468 HA TRP 68 HA TRP 68 4.220 -6.809 -1.441
469 1HB TRP 68 1HB TRP 68 6.518 -6.463 -1.412
470 2HB TRP 68 2HB TRP 68 6.661 -6.506 -3.158
471 HD1 TRP 68 HD1 TRP 68 6.896 -4.146 -4.253
472 HE1 TRP 68 HE1 TRP 68 6.411 -1.625 -3.641
473 HE3 TRP 68 HE3 TRP 68 4.636 -5.113 0.198
474 HZ2 TRP 68 HZ2 TRP 68 5.164 -0.347 -1.415
475 HZ3 TRP 68 HZ3 TRP 68 3.813 -3.172 1.529
476 HH2 TRP 68 HH2 TRP 68 4.047 -0.855 0.788
477 H TYR 69 H TYR 69 3.193 -8.066 -4.101
478 HA TYR 69 HA TYR 69 2.104 -5.532 -5.238
479 1HB TYR 69 1HB TYR 69 3.580 -6.576 -6.837
480 2HB TYR 69 2HB TYR 69 2.822 -8.156 -6.581
481 HD1 TYR 69 HD1 TYR 69 0.311 -8.373 -7.179
482 HD2 TYR 69 HD2 TYR 69 2.820 -5.162 -8.539
483 HE1 TYR 69 HE1 TYR 69 -1.283 -7.907 -9.020
484 HE2 TYR 69 HE2 TYR 69 1.226 -4.696 -10.380
485 HH TYR 69 HH TYR 69 -0.692 -6.316 -11.687
486 H LYS 70 H LYS 70 1.436 -8.440 -3.503
487 HA LYS 70 HA LYS 70 -1.308 -8.487 -4.507
488 1HB LYS 70 1HB LYS 70 0.230 -10.574 -4.264
489 2HB LYS 70 2HB LYS 70 -0.126 -10.451 -2.553
490 1HG LYS 70 1HG LYS 70 -2.602 -10.443 -3.124
491 2HG LYS 70 2HG LYS 70 -2.176 -10.715 -4.802
492 1HD LYS 70 1HD LYS 70 -2.661 -12.882 -3.857
493 2HD LYS 70 2HD LYS 70 -0.924 -12.811 -4.076
494 1HE LYS 70 1HE LYS 70 -1.406 -13.736 -1.859
495 2HE LYS 70 2HE LYS 70 -0.652 -12.166 -1.666
496 1HZ LYS 70 1HZ LYS 70 -3.405 -11.816 -1.864
497 2HZ LYS 70 2HZ LYS 70 -3.124 -12.974 -0.747
498 3HZ LYS 70 3HZ LYS 70 -2.434 -11.502 -0.589
499 H VAL 71 H VAL 71 0.665 -8.099 -1.510
500 HA VAL 71 HA VAL 71 -1.532 -7.721 0.191
501 HB VAL 71 HB VAL 71 0.170 -6.747 1.705
502 1HG1 VAL 71 1HG1 VAL 71 0.507 -9.392 0.345
503 2HG1 VAL 71 2HG1 VAL 71 1.755 -8.869 1.500
504 3HG1 VAL 71 3HG1 VAL 71 0.061 -9.017 2.027
505 1HG2 VAL 71 1HG2 VAL 71 1.516 -6.098 -0.651
506 2HG2 VAL 71 2HG2 VAL 71 2.140 -5.946 1.009
507 3HG2 VAL 71 3HG2 VAL 71 2.484 -7.412 0.060
508 H VAL 72 H VAL 72 -0.465 -5.881 -2.440
509 HA VAL 72 HA VAL 72 -1.418 -3.390 -1.224
510 HB VAL 72 HB VAL 72 0.205 -3.926 -3.719
511 1HG1 VAL 72 1HG1 VAL 72 -1.305 -1.964 -3.944
512 2HG1 VAL 72 2HG1 VAL 72 -0.560 -1.256 -2.491
513 3HG1 VAL 72 3HG1 VAL 72 0.419 -1.521 -3.954
514 1HG2 VAL 72 1HG2 VAL 72 1.344 -4.250 -1.482
515 2HG2 VAL 72 2HG2 VAL 72 2.079 -3.027 -2.546
516 3HG2 VAL 72 3HG2 VAL 72 1.064 -2.519 -1.175
517 H HIS 73 H HIS 73 -1.760 -5.583 -4.077
518 HA HIS 73 HA HIS 73 -4.240 -4.178 -4.707
519 1HB HIS 73 2HB HIS 73 -2.684 -6.159 -6.392
520 2HB HIS 73 1HB HIS 73 -4.080 -5.228 -6.899
521 HD1 HIS 73 HD1 HIS 73 -0.392 -4.907 -6.199
522 HD2 HIS 73 HD2 HIS 73 -3.572 -2.519 -7.532
523 HE1 HIS 73 HE1 HIS 73 0.656 -2.769 -7.116
524 H ASP 74 H ASP 74 -3.925 -5.992 -2.386
525 HA ASP 74 HA ASP 74 -5.212 -8.405 -3.230
526 1HB ASP 74 1HB ASP 74 -3.855 -7.376 -0.828
527 2HB ASP 74 2HB ASP 74 -5.328 -8.230 -0.413
528 H ALA 75 H ALA 75 -7.419 -8.212 -3.696
529 HA ALA 75 HA ALA 75 -8.986 -6.193 -2.367
530 1HB ALA 75 1HB ALA 75 -9.082 -7.763 -4.797
531 2HB ALA 75 3HB ALA 75 -10.617 -7.927 -3.911
532 3HB ALA 75 2HB ALA 75 -10.016 -6.312 -4.359
533 H LYS 76 H LYS 76 -8.295 -9.657 -2.121
534 HA LYS 76 HA LYS 76 -10.610 -10.308 -0.627
535 1HB LYS 76 1HB LYS 76 -9.262 -11.931 -1.939
536 2HB LYS 76 2HB LYS 76 -7.941 -11.738 -0.806
537 1HG LYS 76 1HG LYS 76 -8.901 -13.438 0.367
538 2HG LYS 76 2HG LYS 76 -10.073 -12.250 0.902
539 1HD LYS 76 1HD LYS 76 -10.393 -13.892 -1.653
540 2HD LYS 76 2HD LYS 76 -11.072 -14.369 -0.109
541 1HE LYS 76 1HE LYS 76 -12.901 -13.154 -0.740
542 2HE LYS 76 2HE LYS 76 -11.954 -11.750 -0.290
543 1HZ LYS 76 1HZ LYS 76 -11.086 -11.832 -2.625
544 2HZ LYS 76 2HZ LYS 76 -12.272 -12.904 -2.962
545 3HZ LYS 76 3HZ LYS 76 -12.652 -11.396 -2.464
546 H GLY 77 H GLY 77 -10.849 -10.618 1.640
547 1HA GLY 77 2HA GLY 77 -10.640 -9.934 3.774
548 2HA GLY 77 1HA GLY 77 -9.559 -8.667 3.230
549 H GLY 78 H GLY 78 -9.341 -10.371 5.655
550 1HA GLY 78 2HA GLY 78 -6.624 -11.366 5.158
551 2HA GLY 78 1HA GLY 78 -7.804 -12.458 5.854
552 H ALA 79 H ALA 79 -5.569 -11.933 7.356
553 HA ALA 79 HA ALA 79 -6.543 -11.166 9.779
554 1HB ALA 79 1HB ALA 79 -4.329 -11.333 10.515
555 2HB ALA 79 3HB ALA 79 -3.671 -10.630 9.018
556 3HB ALA 79 2HB ALA 79 -4.299 -12.295 9.017
557 H LYS 80 H LYS 80 -5.631 -9.163 7.041
558 HA LYS 80 HA LYS 80 -6.587 -6.851 8.431
559 1HB LYS 80 1HB LYS 80 -4.322 -5.655 7.690
560 2HB LYS 80 2HB LYS 80 -4.544 -6.354 9.281
561 1HG LYS 80 1HG LYS 80 -3.507 -8.500 8.452
562 2HG LYS 80 2HG LYS 80 -3.228 -7.741 6.897
563 1HD LYS 80 1HD LYS 80 -2.019 -6.941 9.580
564 2HD LYS 80 2HD LYS 80 -1.171 -7.582 8.186
565 1HE LYS 80 1HE LYS 80 -1.912 -5.517 6.879
566 2HE LYS 80 2HE LYS 80 -2.563 -4.869 8.372
567 1HZ LYS 80 1HZ LYS 80 0.140 -5.806 8.550
568 2HZ LYS 80 2HZ LYS 80 -0.067 -4.518 7.568
569 3HZ LYS 80 3HZ LYS 80 -0.529 -4.435 9.132
570 HA PRO 81 HA PRO 81 -7.687 -5.785 4.333
571 1HB PRO 81 1HB PRO 81 -7.858 -3.054 4.510
572 2HB PRO 81 2HB PRO 81 -8.967 -4.151 5.396
573 1HG PRO 81 1HG PRO 81 -6.667 -2.725 6.302
574 2HG PRO 81 2HG PRO 81 -8.197 -2.954 7.209
575 1HD PRO 81 1HD PRO 81 -5.864 -4.403 7.686
576 2HD PRO 81 2HD PRO 81 -7.502 -5.062 7.982
577 H THR 82 H THR 82 -7.001 -3.688 2.666
578 HA THR 82 HA THR 82 -4.077 -3.549 2.718
579 HB THR 82 HB THR 82 -4.134 -4.185 0.246
580 HG1 THR 82 HG1 THR 82 -6.316 -5.446 -0.069
581 1HG2 THR 82 1HG2 THR 82 -5.103 -6.132 2.378
582 2HG2 THR 82 2HG2 THR 82 -4.919 -6.654 0.686
583 3HG2 THR 82 3HG2 THR 82 -3.508 -6.059 1.593
584 H CYS 83 H CYS 83 -3.762 -2.278 0.225
585 HA CYS 83 HA CYS 83 -4.643 0.323 0.993
586 1HB CYS 83 1HB CYS 83 -3.271 -0.368 -1.595
587 2HB CYS 83 2HB CYS 83 -3.250 1.147 -0.715
588 H ILE 84 H ILE 84 -6.112 -2.286 -0.531
589 HA ILE 84 HA ILE 84 -7.711 -0.527 -2.258
590 HB ILE 84 HB ILE 84 -6.866 -3.393 -2.492
591 1HG1 ILE 84 1HG1 ILE 84 -5.669 -1.355 -3.548
592 2HG1 ILE 84 2HG1 ILE 84 -5.970 -2.773 -4.533
593 1HG2 ILE 84 1HG2 ILE 84 -9.293 -2.137 -3.799
594 2HG2 ILE 84 2HG2 ILE 84 -8.532 -3.659 -4.322
595 3HG2 ILE 84 3HG2 ILE 84 -9.256 -3.537 -2.700
596 1HD1 ILE 84 1HD1 ILE 84 -7.868 -0.387 -4.442
597 2HD1 ILE 84 2HD1 ILE 84 -6.562 -0.559 -5.639
598 3HD1 ILE 84 3HD1 ILE 84 -7.891 -1.742 -5.596
599 H SER 85 H SER 85 -7.753 -3.203 0.159
600 HA SER 85 HA SER 85 -10.442 -3.568 0.290
601 1HB SER 85 1HB SER 85 -8.309 -4.598 1.603
602 2HB SER 85 2HB SER 85 -8.911 -3.553 2.874
603 HG SER 85 HG SER 85 -10.948 -5.007 1.635
604 H CYS 86 H CYS 86 -8.456 -1.444 2.494
605 HA CYS 86 HA CYS 86 -10.639 -0.261 3.720
606 1HB CYS 86 1HB CYS 86 -8.244 -0.236 4.516
607 2HB CYS 86 2HB CYS 86 -7.909 1.001 3.322
608 H HIS 87 H HIS 87 -8.484 0.939 1.036
609 HA HIS 87 HA HIS 87 -9.726 3.286 0.513
610 1HB HIS 87 1HB HIS 87 -8.233 1.306 -1.163
611 2HB HIS 87 2HB HIS 87 -9.028 2.643 -1.969
612 HD1 HIS 87 HD1 HIS 87 -6.867 3.867 -2.626
613 HD2 HIS 87 HD2 HIS 87 -7.216 3.182 1.498
614 HE1 HIS 87 HE1 HIS 87 -5.021 5.234 -1.516
615 H LYS 88 H LYS 88 -10.743 -0.025 -0.417
616 HA LYS 88 HA LYS 88 -12.746 0.724 -2.206
617 1HB LYS 88 1HB LYS 88 -11.951 -1.702 -0.710
618 2HB LYS 88 2HB LYS 88 -13.644 -1.632 -1.157
619 1HG LYS 88 1HG LYS 88 -13.031 -1.209 -3.526
620 2HG LYS 88 2HG LYS 88 -11.331 -1.181 -3.103
621 1HD LYS 88 1HD LYS 88 -11.214 -3.438 -3.274
622 2HD LYS 88 2HD LYS 88 -12.459 -3.624 -2.054
623 1HE LYS 88 1HE LYS 88 -14.213 -3.680 -3.658
624 2HE LYS 88 2HE LYS 88 -13.246 -2.895 -4.891
625 1HZ LYS 88 1HZ LYS 88 -12.731 -5.592 -3.843
626 2HZ LYS 88 2HZ LYS 88 -13.482 -5.265 -5.256
627 3HZ LYS 88 3HZ LYS 88 -11.913 -4.861 -5.053
628 H ASP 89 H ASP 89 -12.776 0.202 1.370
629 HA ASP 89 HA ASP 89 -15.463 0.475 1.737
630 1HB ASP 89 1HB ASP 89 -13.396 0.029 3.381
631 2HB ASP 89 2HB ASP 89 -13.527 1.751 3.678
632 H LYS 90 H LYS 90 -12.830 2.928 1.440
633 HA LYS 90 HA LYS 90 -14.374 5.158 2.147
634 1HB LYS 90 1HB LYS 90 -11.724 4.622 0.946
635 2HB LYS 90 2HB LYS 90 -12.432 6.165 0.512
636 1HG LYS 90 1HG LYS 90 -12.006 5.115 3.349
637 2HG LYS 90 2HG LYS 90 -11.091 6.391 2.573
638 1HD LYS 90 1HD LYS 90 -13.606 7.399 2.244
639 2HD LYS 90 2HD LYS 90 -13.870 6.459 3.700
640 1HE LYS 90 1HE LYS 90 -11.945 7.614 4.802
641 2HE LYS 90 2HE LYS 90 -11.662 8.544 3.344
642 1HZ LYS 90 1HZ LYS 90 -14.233 8.578 4.756
643 2HZ LYS 90 2HZ LYS 90 -13.034 9.641 5.075
644 3HZ LYS 90 3HZ LYS 90 -13.722 9.606 3.594
645 H ALA 91 H ALA 91 -13.767 3.462 -0.966
646 HA ALA 91 HA ALA 91 -15.104 5.399 -2.534
647 1HB ALA 91 1HB ALA 91 -13.582 3.025 -2.900
648 2HB ALA 91 3HB ALA 91 -14.157 4.157 -4.147
649 3HB ALA 91 2HB ALA 91 -15.153 2.754 -3.693
650 H GLY 92 H GLY 92 -16.135 1.953 -2.173
651 1HA GLY 92 2HA GLY 92 -18.660 2.609 -1.015
652 2HA GLY 92 1HA GLY 92 -18.142 1.059 -1.645
653 H ASP 93 H ASP 93 -20.394 3.473 -2.057
654 HA ASP 93 HA ASP 93 -21.112 2.446 -4.596
655 1HB ASP 93 1HB ASP 93 -22.688 4.730 -4.076
656 2HB ASP 93 2HB ASP 93 -23.125 3.063 -3.759
657 H ASP 94 H ASP 94 -19.756 5.477 -3.199
658 HA ASP 94 HA ASP 94 -20.058 7.152 -5.313
659 1HB ASP 94 1HB ASP 94 -19.096 7.651 -3.000
660 2HB ASP 94 2HB ASP 94 -17.581 6.954 -3.538
661 H LYS 95 H LYS 95 -19.590 6.410 -7.425
662 HA LYS 95 HA LYS 95 -17.395 4.704 -7.960
663 1HB LYS 95 1HB LYS 95 -19.428 6.179 -9.613
664 2HB LYS 95 2HB LYS 95 -18.046 5.436 -10.392
665 1HG LYS 95 1HG LYS 95 -18.656 3.245 -9.673
666 2HG LYS 95 2HG LYS 95 -19.704 3.848 -8.406
667 1HD LYS 95 1HD LYS 95 -20.805 4.965 -10.737
668 2HD LYS 95 2HD LYS 95 -20.299 3.370 -11.257
669 1HE LYS 95 1HE LYS 95 -21.550 3.140 -8.648
670 2HE LYS 95 2HE LYS 95 -22.606 4.067 -9.695
671 1HZ LYS 95 1HZ LYS 95 -22.285 2.280 -11.358
672 2HZ LYS 95 2HZ LYS 95 -21.507 1.398 -10.224
673 3HZ LYS 95 3HZ LYS 95 -23.076 1.802 -10.011
674 H GLU 96 H GLU 96 -17.926 8.222 -7.908
675 HA GLU 96 HA GLU 96 -15.657 8.870 -9.397
676 1HB GLU 96 1HB GLU 96 -17.678 10.351 -8.780
677 2HB GLU 96 2HB GLU 96 -16.912 10.588 -7.221
678 1HG GLU 96 1HG GLU 96 -16.159 12.433 -8.520
679 2HG GLU 96 2HG GLU 96 -14.801 11.325 -8.530
680 H LEU 97 H LEU 97 -16.142 7.772 -6.102
681 HA LEU 97 HA LEU 97 -13.570 8.784 -5.234
682 1HB LEU 97 1HB LEU 97 -15.718 8.712 -3.851
683 2HB LEU 97 2HB LEU 97 -15.449 6.985 -3.717
684 HG LEU 97 HG LEU 97 -14.564 7.868 -1.747
685 1HD1 LEU 97 1HD1 LEU 97 -13.026 6.334 -3.126
686 2HD1 LEU 97 2HD1 LEU 97 -12.054 7.798 -3.412
687 3HD1 LEU 97 3HD1 LEU 97 -12.323 7.219 -1.751
688 1HD2 LEU 97 1HD2 LEU 97 -13.914 10.184 -3.423
689 2HD2 LEU 97 2HD2 LEU 97 -14.317 10.088 -1.692
690 3HD2 LEU 97 3HD2 LEU 97 -12.651 9.780 -2.236
691 H LYS 98 H LYS 98 -15.107 5.832 -6.465
692 HA LYS 98 HA LYS 98 -12.899 4.171 -5.689
693 1HB LYS 98 1HB LYS 98 -15.356 3.482 -5.907
694 2HB LYS 98 2HB LYS 98 -15.108 3.498 -7.641
695 1HG LYS 98 1HG LYS 98 -13.356 1.809 -7.489
696 2HG LYS 98 2HG LYS 98 -13.316 1.922 -5.741
697 1HD LYS 98 2HD LYS 98 -14.608 -0.030 -6.161
698 2HD LYS 98 1HD LYS 98 -15.802 1.194 -5.779
699 1HE LYS 98 2HE LYS 98 -16.657 0.132 -7.735
700 2HE LYS 98 1HE LYS 98 -15.968 1.630 -8.326
701 1HZ LYS 98 1HZ LYS 98 -13.897 0.278 -8.707
702 2HZ LYS 98 2HZ LYS 98 -14.818 -1.054 -8.490
703 3HZ LYS 98 3HZ LYS 98 -15.153 -0.019 -9.708
704 H LYS 99 H LYS 99 -12.919 6.696 -7.688
705 HA LYS 99 HA LYS 99 -11.268 5.313 -9.686
706 1HB LYS 99 1HB LYS 99 -13.444 7.306 -9.994
707 2HB LYS 99 2HB LYS 99 -12.016 7.586 -10.968
708 1HG LYS 99 1HG LYS 99 -13.300 4.832 -10.837
709 2HG LYS 99 2HG LYS 99 -13.903 6.053 -11.939
710 1HD LYS 99 1HD LYS 99 -11.092 6.102 -12.292
711 2HD LYS 99 2HD LYS 99 -11.488 4.401 -12.147
712 1HE LYS 99 1HE LYS 99 -11.928 4.602 -14.400
713 2HE LYS 99 2HE LYS 99 -13.493 5.145 -13.828
714 1HZ LYS 99 1HZ LYS 99 -12.394 7.423 -13.796
715 2HZ LYS 99 2HZ LYS 99 -11.251 6.765 -14.759
716 3HZ LYS 99 3HZ LYS 99 -12.809 6.797 -15.246
717 H LYS 100 H LYS 100 -10.165 5.999 -7.235
718 HA LYS 100 HA LYS 100 -8.135 7.779 -8.076
719 1HB LYS 100 1HB LYS 100 -8.663 9.316 -5.965
720 2HB LYS 100 2HB LYS 100 -9.268 9.678 -7.568
721 1HG LYS 100 1HG LYS 100 -11.361 8.289 -6.938
722 2HG LYS 100 2HG LYS 100 -10.765 8.314 -5.291
723 1HD LYS 100 1HD LYS 100 -11.078 10.892 -6.872
724 2HD LYS 100 2HD LYS 100 -12.445 10.180 -6.038
725 1HE LYS 100 1HE LYS 100 -11.123 10.210 -3.892
726 2HE LYS 100 2HE LYS 100 -9.797 10.982 -4.739
727 1HZ LYS 100 1HZ LYS 100 -12.361 12.243 -5.050
728 2HZ LYS 100 2HZ LYS 100 -11.729 12.311 -3.546
729 3HZ LYS 100 3HZ LYS 100 -10.892 12.914 -4.811
730 H LEU 101 H LEU 101 -9.867 6.252 -5.294
731 HA LEU 101 HA LEU 101 -7.325 5.793 -3.985
732 1HB LEU 101 2HB LEU 101 -10.140 5.070 -3.159
733 2HB LEU 101 1HB LEU 101 -8.701 4.903 -2.172
734 HG LEU 101 HG LEU 101 -10.132 7.410 -3.021
735 1HD1 LEU 101 1HD1 LEU 101 -10.718 6.204 -0.903
736 2HD1 LEU 101 2HD1 LEU 101 -9.077 6.562 -0.313
737 3HD1 LEU 101 3HD1 LEU 101 -10.200 7.892 -0.684
738 1HD2 LEU 101 1HD2 LEU 101 -7.252 7.207 -2.115
739 2HD2 LEU 101 2HD2 LEU 101 -7.885 7.935 -3.611
740 3HD2 LEU 101 3HD2 LEU 101 -8.214 8.703 -2.039
741 H THR 102 H THR 102 -9.727 4.135 -5.992
742 HA THR 102 HA THR 102 -8.073 1.706 -5.779
743 HB THR 102 HB THR 102 -10.120 0.399 -5.915
744 HG1 THR 102 HG1 THR 102 -11.379 1.625 -7.357
745 1HG2 THR 102 1HG2 THR 102 -9.721 1.528 -3.641
746 2HG2 THR 102 2HG2 THR 102 -10.847 2.803 -4.167
747 3HG2 THR 102 3HG2 THR 102 -11.421 1.128 -3.986
748 H GLY 103 H GLY 103 -8.601 4.318 -7.649
749 1HA GLY 103 2HA GLY 103 -8.320 4.750 -9.835
750 2HA GLY 103 1HA GLY 103 -9.338 3.361 -10.158
751 H CYS 104 H CYS 104 -8.362 2.031 -11.620
752 HA CYS 104 HA CYS 104 -5.884 0.844 -10.969
753 1HB CYS 104 1HB CYS 104 -7.975 0.520 -12.995
754 2HB CYS 104 2HB CYS 104 -6.364 0.221 -13.616
755 H LYS 105 H LYS 105 -7.032 3.069 -13.614
756 HA LYS 105 HA LYS 105 -4.247 3.974 -13.859
757 1HB LYS 105 2HB LYS 105 -4.675 4.331 -16.257
758 2HB LYS 105 1HB LYS 105 -4.809 2.645 -15.799
759 1HG LYS 105 1HG LYS 105 -7.125 2.592 -16.097
760 2HG LYS 105 2HG LYS 105 -7.328 4.286 -15.699
761 1HD LYS 105 1HD LYS 105 -6.683 5.016 -17.859
762 2HD LYS 105 2HD LYS 105 -5.817 3.534 -18.213
763 1HE LYS 105 1HE LYS 105 -8.002 2.289 -18.275
764 2HE LYS 105 2HE LYS 105 -8.853 3.788 -17.963
765 1HZ LYS 105 1HZ LYS 105 -7.007 3.586 -20.216
766 2HZ LYS 105 2HZ LYS 105 -8.542 3.045 -20.352
767 3HZ LYS 105 3HZ LYS 105 -8.257 4.616 -20.011
768 H GLY 106 H GLY 106 -3.903 6.144 -13.635
769 1HA GLY 106 2HA GLY 106 -5.982 8.056 -14.146
770 2HA GLY 106 1HA GLY 106 -4.365 8.362 -13.544
771 H SER 107 H SER 107 -4.297 6.713 -11.228
772 HA SER 107 HA SER 107 -6.459 7.898 -9.668
773 1HB SER 107 1HB SER 107 -6.384 6.012 -8.189
774 2HB SER 107 2HB SER 107 -6.390 5.357 -9.814
775 HG SER 107 HG SER 107 -4.753 4.243 -8.824
776 H ALA 108 H ALA 108 -5.626 7.909 -7.142
777 HA ALA 108 HA ALA 108 -3.511 9.794 -7.133
778 1HB ALA 108 1HB ALA 108 -3.990 8.912 -4.501
779 2HB ALA 108 2HB ALA 108 -4.719 10.321 -5.310
780 3HB ALA 108 3HB ALA 108 -5.552 8.748 -5.338
781 H CYS 109 H CYS 109 -3.539 6.421 -7.418
782 HA CYS 109 HA CYS 109 -1.032 6.152 -5.950
783 1HB CYS 109 1HB CYS 109 -2.981 4.080 -6.998
784 2HB CYS 109 2HB CYS 109 -1.406 3.676 -6.344
785 H HIS 110 H HIS 110 -2.658 5.585 -9.138
786 HA HIS 110 HA HIS 110 0.018 5.533 -10.333
787 1HB HIS 110 1HB HIS 110 -2.502 4.126 -11.259
788 2HB HIS 110 2HB HIS 110 -0.991 4.165 -12.145
789 HD1 HIS 110 HD1 HIS 110 1.134 3.404 -10.223
790 HD2 HIS 110 HD2 HIS 110 -2.698 1.708 -10.033
791 HE1 HIS 110 HE1 HIS 110 1.390 1.198 -8.966
792 HA PRO 111 HA PRO 111 -2.008 9.213 -12.051
793 1HB PRO 111 1HB PRO 111 -0.224 11.078 -11.293
794 2HB PRO 111 2HB PRO 111 -1.306 10.320 -10.080
795 1HG PRO 111 2HG PRO 111 1.371 9.652 -10.957
796 2HG PRO 111 1HG PRO 111 1.171 9.665 -9.175
797 1HD PRO 111 1HD PRO 111 1.230 7.328 -10.558
798 2HD PRO 111 2HD PRO 111 0.061 7.547 -9.221
799 H SER 112 H SER 112 -1.331 7.793 -14.051
800 HA SER 112 HA SER 112 0.427 9.386 -15.566
801 1HB SER 112 1HB SER 112 1.609 7.182 -14.162
802 2HB SER 112 2HB SER 112 1.551 6.734 -15.856
803 HG SER 112 HG SER 112 2.681 8.682 -16.395
No H/Q in entry = 803
Start of MODEL 12
1 H1 VAL 1 H1 VAL 1 9.248 9.899 17.743
2 H2 VAL 1 H2 VAL 1 8.655 8.379 17.463
3 H3 VAL 1 H3 VAL 1 10.073 8.573 18.295
4 HA VAL 1 HA VAL 1 11.274 9.140 16.514
5 HB VAL 1 HB VAL 1 11.059 6.910 16.180
6 1HG1 VAL 1 1HG1 VAL 1 8.071 7.319 15.836
7 2HG1 VAL 1 2HG1 VAL 1 8.897 5.753 15.651
8 3HG1 VAL 1 3HG1 VAL 1 8.914 6.588 17.223
9 1HG2 VAL 1 1HG2 VAL 1 9.599 8.027 13.761
10 2HG2 VAL 1 2HG2 VAL 1 11.362 7.896 13.971
11 3HG2 VAL 1 3HG2 VAL 1 10.368 6.424 13.854
12 H ASP 2 H ASP 2 7.972 10.122 16.468
13 HA ASP 2 HA ASP 2 6.880 11.605 15.327
14 1HB ASP 2 1HB ASP 2 9.719 12.345 14.691
15 2HB ASP 2 2HB ASP 2 8.488 13.055 13.665
16 H VAL 3 H VAL 3 5.540 10.850 13.681
17 HA VAL 3 HA VAL 3 6.326 9.043 11.751
18 HB VAL 3 HB VAL 3 4.004 9.856 12.665
19 1HG1 VAL 3 1HG1 VAL 3 4.326 12.152 11.625
20 2HG1 VAL 3 2HG1 VAL 3 4.075 11.375 10.044
21 3HG1 VAL 3 3HG1 VAL 3 2.782 11.343 11.267
22 1HG2 VAL 3 1HG2 VAL 3 4.505 7.913 11.139
23 2HG2 VAL 3 2HG2 VAL 3 2.911 8.667 10.895
24 3HG2 VAL 3 3HG2 VAL 3 4.241 9.009 9.762
25 HA PRO 4 HA PRO 4 9.048 11.282 9.115
26 1HB PRO 4 2HB PRO 4 7.744 9.387 7.131
27 2HB PRO 4 1HB PRO 4 9.473 9.772 7.414
28 1HG PRO 4 1HG PRO 4 8.498 7.526 8.471
29 2HG PRO 4 2HG PRO 4 9.749 8.483 9.329
30 1HD PRO 4 2HD PRO 4 6.795 8.186 9.868
31 2HD PRO 4 1HD PRO 4 8.120 8.594 11.001
32 H ALA 5 H ALA 5 8.840 12.646 7.074
33 HA ALA 5 HA ALA 5 6.220 13.872 7.069
34 1HB ALA 5 1HB ALA 5 7.631 15.630 6.929
35 2HB ALA 5 2HB ALA 5 8.992 14.603 6.418
36 3HB ALA 5 3HB ALA 5 7.818 15.188 5.215
37 H ASP 6 H ASP 6 4.986 14.232 5.094
38 HA ASP 6 HA ASP 6 4.641 11.958 3.633
39 1HB ASP 6 2HB ASP 6 3.037 13.179 2.427
40 2HB ASP 6 1HB ASP 6 3.165 14.113 3.904
41 H GLY 7 H GLY 7 4.525 12.826 0.868
42 1HA GLY 7 2HA GLY 7 7.108 13.836 0.077
43 2HA GLY 7 1HA GLY 7 5.789 13.326 -0.958
44 H ALA 8 H ALA 8 6.149 10.877 1.317
45 HA ALA 8 HA ALA 8 8.462 9.562 0.493
46 1HB ALA 8 1HB ALA 8 6.007 8.987 2.041
47 2HB ALA 8 2HB ALA 8 7.703 8.572 2.388
48 3HB ALA 8 3HB ALA 8 6.748 7.558 1.279
49 H LYS 9 H LYS 9 8.941 8.183 -1.198
50 HA LYS 9 HA LYS 9 6.743 7.719 -3.092
51 1HB LYS 9 1HB LYS 9 9.651 8.365 -3.645
52 2HB LYS 9 2HB LYS 9 8.533 7.784 -4.862
53 1HG LYS 9 1HG LYS 9 7.209 9.744 -4.784
54 2HG LYS 9 2HG LYS 9 7.748 10.170 -3.172
55 1HD LYS 9 1HD LYS 9 10.105 10.495 -4.206
56 2HD LYS 9 2HD LYS 9 9.324 10.392 -5.771
57 1HE LYS 9 1HE LYS 9 7.740 12.266 -4.968
58 2HE LYS 9 2HE LYS 9 8.801 12.456 -3.586
59 1HZ LYS 9 1HZ LYS 9 10.559 12.507 -5.537
60 2HZ LYS 9 2HZ LYS 9 9.278 13.116 -6.345
61 3HZ LYS 9 3HZ LYS 9 9.812 13.852 -4.990
62 H ILE 10 H ILE 10 6.466 5.636 -3.868
63 HA ILE 10 HA ILE 10 8.281 3.656 -2.680
64 HB ILE 10 HB ILE 10 5.384 3.319 -3.460
65 1HG1 ILE 10 1HG1 ILE 10 6.254 3.296 -0.609
66 2HG1 ILE 10 2HG1 ILE 10 6.165 4.857 -1.401
67 1HG2 ILE 10 1HG2 ILE 10 6.836 1.280 -3.551
68 2HG2 ILE 10 2HG2 ILE 10 7.152 1.497 -1.813
69 3HG2 ILE 10 3HG2 ILE 10 5.495 1.189 -2.384
70 1HD1 ILE 10 1HD1 ILE 10 3.820 4.374 -2.106
71 2HD1 ILE 10 2HD1 ILE 10 3.912 2.798 -1.284
72 3HD1 ILE 10 3HD1 ILE 10 4.006 4.303 -0.338
73 H ASP 11 H ASP 11 9.483 2.429 -4.040
74 HA ASP 11 HA ASP 11 8.480 1.818 -6.624
75 1HB ASP 11 1HB ASP 11 9.378 3.921 -7.297
76 2HB ASP 11 2HB ASP 11 10.757 3.780 -6.225
77 H PHE 12 H PHE 12 8.809 -0.358 -5.732
78 HA PHE 12 HA PHE 12 11.633 -1.048 -5.325
79 1HB PHE 12 2HB PHE 12 9.035 -2.427 -4.417
80 2HB PHE 12 1HB PHE 12 10.651 -2.921 -3.952
81 HD1 PHE 12 HD1 PHE 12 11.858 -0.252 -3.355
82 HD2 PHE 12 HD2 PHE 12 8.057 -1.863 -2.373
83 HE1 PHE 12 HE1 PHE 12 11.740 1.251 -1.349
84 HE2 PHE 12 HE2 PHE 12 7.939 -0.360 -0.366
85 HZ PHE 12 HZ PHE 12 9.782 1.179 0.122
86 H ILE 13 H ILE 13 8.652 -1.651 -7.130
87 HA ILE 13 HA ILE 13 9.813 -4.031 -8.342
88 HB ILE 13 HB ILE 13 7.078 -2.768 -8.471
89 1HG1 ILE 13 1HG1 ILE 13 7.810 -5.502 -7.423
90 2HG1 ILE 13 2HG1 ILE 13 7.903 -4.080 -6.403
91 1HG2 ILE 13 1HG2 ILE 13 8.327 -4.391 -10.437
92 2HG2 ILE 13 2HG2 ILE 13 7.122 -5.396 -9.596
93 3HG2 ILE 13 3HG2 ILE 13 6.631 -3.859 -10.347
94 1HD1 ILE 13 1HD1 ILE 13 5.492 -3.562 -6.996
95 2HD1 ILE 13 2HD1 ILE 13 5.431 -5.116 -7.861
96 3HD1 ILE 13 3HD1 ILE 13 5.708 -5.086 -6.103
97 H ALA 14 H ALA 14 11.335 -3.556 -9.856
98 HA ALA 14 HA ALA 14 12.233 -2.756 -11.713
99 1HB ALA 14 1HB ALA 14 10.251 -3.475 -12.871
100 2HB ALA 14 3HB ALA 14 10.652 -1.851 -13.480
101 3HB ALA 14 2HB ALA 14 9.333 -2.059 -12.304
102 H GLY 15 H GLY 15 12.295 -0.510 -13.131
103 1HA GLY 15 2HA GLY 15 13.449 1.408 -11.646
104 2HA GLY 15 1HA GLY 15 11.752 1.817 -11.493
105 H GLY 16 H GLY 16 14.140 3.106 -12.968
106 1HA GLY 16 2HA GLY 16 13.478 2.882 -15.763
107 2HA GLY 16 1HA GLY 16 14.644 3.957 -15.016
108 H GLU 17 H GLU 17 12.570 4.550 -17.087
109 HA GLU 17 HA GLU 17 11.455 6.816 -15.710
110 1HB GLU 17 1HB GLU 17 12.273 6.172 -18.444
111 2HB GLU 17 2HB GLU 17 10.670 6.882 -18.429
112 1HG GLU 17 2HG GLU 17 13.198 8.069 -17.196
113 2HG GLU 17 1HG GLU 17 12.337 8.671 -18.599
114 H LYS 18 H LYS 18 10.453 3.797 -17.348
115 HA LYS 18 HA LYS 18 7.656 4.508 -17.060
116 1HB LYS 18 1HB LYS 18 7.225 2.486 -18.320
117 2HB LYS 18 2HB LYS 18 8.438 3.451 -19.136
118 1HG LYS 18 1HG LYS 18 9.974 1.785 -18.986
119 2HG LYS 18 2HG LYS 18 9.737 1.641 -17.256
120 1HD LYS 18 1HD LYS 18 8.598 -0.295 -17.551
121 2HD LYS 18 2HD LYS 18 7.404 0.536 -18.527
122 1HE LYS 18 1HE LYS 18 8.144 -0.759 -20.253
123 2HE LYS 18 2HE LYS 18 9.526 0.317 -20.309
124 1HZ LYS 18 1HZ LYS 18 9.877 -1.600 -18.294
125 2HZ LYS 18 2HZ LYS 18 9.541 -2.348 -19.706
126 3HZ LYS 18 3HZ LYS 18 10.802 -1.315 -19.609
127 H ASN 19 H ASN 19 8.848 4.559 -14.586
128 HA ASN 19 HA ASN 19 8.227 1.954 -13.461
129 1HB ASN 19 1HB ASN 19 9.314 3.113 -11.352
130 2HB ASN 19 2HB ASN 19 10.363 2.595 -12.656
131 2HD2 ASN 19 2HD2 ASN 19 11.512 4.344 -11.216
132 1HD2 ASN 19 1HD2 ASN 19 11.511 5.950 -11.865
133 H LEU 20 H LEU 20 6.398 1.759 -12.115
134 HA LEU 20 HA LEU 20 4.696 4.067 -11.900
135 1HB LEU 20 1HB LEU 20 4.407 1.161 -11.157
136 2HB LEU 20 2HB LEU 20 3.191 2.360 -10.767
137 HG LEU 20 HG LEU 20 4.017 1.300 -13.455
138 1HD1 LEU 20 1HD1 LEU 20 1.396 1.643 -11.988
139 2HD1 LEU 20 2HD1 LEU 20 1.504 1.205 -13.710
140 3HD1 LEU 20 3HD1 LEU 20 2.205 0.133 -12.473
141 1HD2 LEU 20 1HD2 LEU 20 2.809 4.004 -12.891
142 2HD2 LEU 20 2HD2 LEU 20 4.170 3.578 -13.956
143 3HD2 LEU 20 3HD2 LEU 20 2.507 3.141 -14.418
144 H THR 21 H THR 21 5.775 5.522 -10.517
145 HA THR 21 HA THR 21 6.511 4.543 -7.874
146 HB THR 21 HB THR 21 6.735 7.411 -8.833
147 HG1 THR 21 HG1 THR 21 8.126 6.685 -10.405
148 1HG2 THR 21 1HG2 THR 21 7.706 6.050 -6.602
149 2HG2 THR 21 2HG2 THR 21 9.068 5.928 -7.742
150 3HG2 THR 21 3HG2 THR 21 8.433 7.525 -7.281
151 H VAL 22 H VAL 22 4.985 4.348 -6.363
152 HA VAL 22 HA VAL 22 2.703 6.160 -6.517
153 HB VAL 22 HB VAL 22 3.222 3.592 -5.011
154 1HG1 VAL 22 1HG1 VAL 22 0.908 5.529 -4.873
155 2HG1 VAL 22 2HG1 VAL 22 0.702 3.799 -4.505
156 3HG1 VAL 22 3HG1 VAL 22 1.830 4.785 -3.544
157 1HG2 VAL 22 1HG2 VAL 22 2.163 4.212 -7.633
158 2HG2 VAL 22 2HG2 VAL 22 2.516 2.630 -6.896
159 3HG2 VAL 22 3HG2 VAL 22 0.931 3.398 -6.637
160 H VAL 23 H VAL 23 2.521 7.886 -5.179
161 HA VAL 23 HA VAL 23 4.572 8.205 -3.155
162 HB VAL 23 HB VAL 23 2.427 10.047 -4.228
163 1HG1 VAL 23 1HG1 VAL 23 4.268 10.285 -1.935
164 2HG1 VAL 23 2HG1 VAL 23 4.306 11.663 -3.061
165 3HG1 VAL 23 3HG1 VAL 23 2.770 11.173 -2.306
166 1HG2 VAL 23 1HG2 VAL 23 4.806 9.208 -5.415
167 2HG2 VAL 23 2HG2 VAL 23 3.848 10.644 -5.850
168 3HG2 VAL 23 3HG2 VAL 23 5.206 10.792 -4.708
169 H PHE 24 H PHE 24 4.134 8.549 -0.919
170 HA PHE 24 HA PHE 24 1.389 7.996 -0.094
171 1HB PHE 24 1HB PHE 24 2.782 5.870 -0.110
172 2HB PHE 24 2HB PHE 24 3.983 6.661 0.892
173 HD1 PHE 24 HD1 PHE 24 0.353 5.799 0.900
174 HD2 PHE 24 HD2 PHE 24 3.878 6.389 3.188
175 HE1 PHE 24 HE1 PHE 24 -0.853 5.020 2.960
176 HE2 PHE 24 HE2 PHE 24 2.672 5.610 5.247
177 HZ PHE 24 HZ PHE 24 0.321 4.935 5.108
178 H ASN 25 H ASN 25 0.830 8.860 1.981
179 HA ASN 25 HA ASN 25 2.923 10.502 3.159
180 1HB ASN 25 1HB ASN 25 1.420 11.973 1.820
181 2HB ASN 25 2HB ASN 25 0.015 11.315 2.635
182 2HD2 ASN 25 2HD2 ASN 25 -0.112 13.769 2.895
183 1HD2 ASN 25 1HD2 ASN 25 0.510 14.432 4.369
184 H HIS 26 H HIS 26 2.801 10.595 5.490
185 HA HIS 26 HA HIS 26 1.089 8.578 6.638
186 1HB HIS 26 1HB HIS 26 3.527 10.084 7.474
187 2HB HIS 26 2HB HIS 26 2.469 9.497 8.741
188 HD1 HIS 26 HD1 HIS 26 4.671 8.260 5.914
189 HD2 HIS 26 HD2 HIS 26 2.540 6.737 9.190
190 HE1 HIS 26 HE1 HIS 26 5.393 5.826 6.168
191 H SER 27 H SER 27 1.160 12.022 6.143
192 HA SER 27 HA SER 27 -0.477 12.581 8.413
193 1HB SER 27 2HB SER 27 -0.338 14.601 6.241
194 2HB SER 27 1HB SER 27 -0.031 14.782 7.957
195 HG SER 27 HG SER 27 1.750 14.046 5.861
196 H THR 28 H THR 28 -1.130 10.826 5.772
197 HA THR 28 HA THR 28 -3.703 12.119 5.186
198 HB THR 28 HB THR 28 -2.092 9.969 3.709
199 HG1 THR 28 HG1 THR 28 -1.394 12.345 3.867
200 1HG2 THR 28 1HG2 THR 28 -4.726 10.132 3.402
201 2HG2 THR 28 2HG2 THR 28 -4.344 11.655 2.565
202 3HG2 THR 28 3HG2 THR 28 -3.685 10.117 1.958
203 H HIS 29 H HIS 29 -2.162 9.075 6.303
204 HA HIS 29 HA HIS 29 -4.841 8.056 6.848
205 1HB HIS 29 1HB HIS 29 -2.182 6.604 6.912
206 2HB HIS 29 2HB HIS 29 -3.767 5.880 7.096
207 HD1 HIS 29 HD1 HIS 29 -1.490 7.418 4.499
208 HD2 HIS 29 HD2 HIS 29 -5.186 5.444 4.708
209 HE1 HIS 29 HE1 HIS 29 -2.129 6.840 2.097
210 H LYS 30 H LYS 30 -3.395 10.256 8.359
211 HA LYS 30 HA LYS 30 -2.359 9.297 10.740
212 1HB LYS 30 1HB LYS 30 -2.734 11.530 11.588
213 2HB LYS 30 2HB LYS 30 -2.161 11.616 9.935
214 1HG LYS 30 1HG LYS 30 -4.749 11.641 9.329
215 2HG LYS 30 2HG LYS 30 -4.950 12.132 10.999
216 1HD LYS 30 1HD LYS 30 -2.872 13.571 9.351
217 2HD LYS 30 2HD LYS 30 -4.558 13.928 9.032
218 1HE LYS 30 1HE LYS 30 -4.060 13.878 11.917
219 2HE LYS 30 2HE LYS 30 -2.950 14.980 11.126
220 1HZ LYS 30 1HZ LYS 30 -5.354 15.448 9.950
221 2HZ LYS 30 2HZ LYS 30 -5.725 15.254 11.529
222 3HZ LYS 30 3HZ LYS 30 -4.633 16.382 11.079
223 H ASP 31 H ASP 31 -5.589 9.166 9.473
224 HA ASP 31 HA ASP 31 -6.771 9.000 12.077
225 1HB ASP 31 2HB ASP 31 -8.849 8.960 10.948
226 2HB ASP 31 1HB ASP 31 -7.850 9.967 9.918
227 H VAL 32 H VAL 32 -4.823 7.000 10.304
228 HA VAL 32 HA VAL 32 -6.318 4.582 11.056
229 HB VAL 32 HB VAL 32 -4.223 4.872 8.898
230 1HG1 VAL 32 1HG1 VAL 32 -4.863 2.603 10.118
231 2HG1 VAL 32 2HG1 VAL 32 -6.245 2.667 8.998
232 3HG1 VAL 32 3HG1 VAL 32 -4.583 2.668 8.362
233 1HG2 VAL 32 1HG2 VAL 32 -7.159 5.360 8.858
234 2HG2 VAL 32 2HG2 VAL 32 -5.863 6.057 7.857
235 3HG2 VAL 32 3HG2 VAL 32 -6.481 4.426 7.503
236 H LYS 33 H LYS 33 -5.367 3.197 12.497
237 HA LYS 33 HA LYS 33 -3.270 4.056 14.060
238 1HB LYS 33 1HB LYS 33 -4.323 1.252 13.588
239 2HB LYS 33 2HB LYS 33 -3.228 1.697 14.881
240 1HG LYS 33 1HG LYS 33 -4.847 3.024 15.986
241 2HG LYS 33 2HG LYS 33 -5.795 3.263 14.533
242 1HD LYS 33 1HD LYS 33 -6.069 0.595 14.674
243 2HD LYS 33 2HD LYS 33 -5.700 0.865 16.366
244 1HE LYS 33 1HE LYS 33 -7.832 2.511 14.950
245 2HE LYS 33 2HE LYS 33 -8.208 0.936 15.619
246 1HZ LYS 33 1HZ LYS 33 -6.801 2.801 17.327
247 2HZ LYS 33 2HZ LYS 33 -8.380 3.098 17.034
248 3HZ LYS 33 3HZ LYS 33 -7.927 1.684 17.714
249 H CYS 34 H CYS 34 -1.100 2.934 14.359
250 HA CYS 34 HA CYS 34 0.255 3.056 11.861
251 1HB CYS 34 2HB CYS 34 1.429 2.167 14.493
252 2HB CYS 34 1HB CYS 34 2.261 2.854 13.112
253 H ASP 35 H ASP 35 -0.669 0.542 14.286
254 HA ASP 35 HA ASP 35 0.698 -1.537 13.062
255 1HB ASP 35 1HB ASP 35 -0.915 -2.994 14.364
256 2HB ASP 35 2HB ASP 35 -0.096 -1.785 15.332
257 H ASP 36 H ASP 36 -1.955 0.335 12.012
258 HA ASP 36 HA ASP 36 -3.620 -1.594 10.924
259 1HB ASP 36 1HB ASP 36 -3.853 1.037 11.231
260 2HB ASP 36 2HB ASP 36 -3.168 1.104 9.619
261 H CYS 37 H CYS 37 -0.433 -0.471 10.095
262 HA CYS 37 HA CYS 37 -0.639 -1.854 7.528
263 1HB CYS 37 1HB CYS 37 0.734 0.802 8.035
264 2HB CYS 37 2HB CYS 37 1.021 -0.181 6.613
265 H HIS 38 H HIS 38 1.502 -0.461 10.112
266 HA HIS 38 HA HIS 38 3.622 -2.250 9.450
267 1HB HIS 38 1HB HIS 38 3.238 -0.421 11.837
268 2HB HIS 38 2HB HIS 38 4.721 -1.260 11.428
269 HD1 HIS 38 HD1 HIS 38 5.688 -0.600 8.889
270 HD2 HIS 38 HD2 HIS 38 3.065 2.086 10.760
271 HE1 HIS 38 HE1 HIS 38 6.001 1.642 7.712
272 H HIS 39 H HIS 39 2.345 -4.277 9.557
273 HA HIS 39 HA HIS 39 1.497 -5.042 12.210
274 1HB HIS 39 2HB HIS 39 0.371 -6.807 11.206
275 2HB HIS 39 1HB HIS 39 0.233 -5.513 10.031
276 HD1 HIS 39 HD1 HIS 39 1.225 -8.999 10.337
277 HD2 HIS 39 HD2 HIS 39 2.262 -5.789 7.845
278 HE1 HIS 39 HE1 HIS 39 2.342 -10.021 8.283
279 H GLN 40 H GLN 40 4.219 -4.464 12.195
280 HA GLN 40 HA GLN 40 5.429 -7.111 12.085
281 1HB GLN 40 1HB GLN 40 6.516 -4.317 11.743
282 2HB GLN 40 2HB GLN 40 7.592 -5.568 12.331
283 1HG GLN 40 1HG GLN 40 7.409 -5.173 9.741
284 2HG GLN 40 2HG GLN 40 7.463 -6.819 10.342
285 2HE2 GLN 40 2HE2 GLN 40 5.650 -8.107 10.321
286 1HE2 GLN 40 1HE2 GLN 40 4.217 -7.732 9.424
287 HA PRO 41 HA PRO 41 5.660 -7.451 16.439
288 1HB PRO 41 1HB PRO 41 8.201 -8.589 16.663
289 2HB PRO 41 2HB PRO 41 6.727 -9.472 16.150
290 1HG PRO 41 1HG PRO 41 8.796 -8.241 14.506
291 2HG PRO 41 2HG PRO 41 8.156 -9.888 14.197
292 1HD PRO 41 1HD PRO 41 7.222 -7.892 12.717
293 2HD PRO 41 2HD PRO 41 6.016 -8.959 13.498
294 H GLY 42 H GLY 42 6.569 -6.335 18.289
295 1HA GLY 42 2HA GLY 42 7.820 -4.800 19.375
296 2HA GLY 42 1HA GLY 42 7.473 -3.803 17.976
297 H ASP 43 H ASP 43 9.692 -2.908 18.719
298 HA ASP 43 HA ASP 43 11.890 -2.851 18.648
299 1HB ASP 43 2HB ASP 43 12.069 -5.515 17.204
300 2HB ASP 43 1HB ASP 43 13.280 -4.749 18.213
301 H LYS 44 H LYS 44 10.478 -4.682 15.829
302 HA LYS 44 HA LYS 44 11.695 -2.670 14.067
303 1HB LYS 44 1HB LYS 44 12.765 -4.949 13.968
304 2HB LYS 44 2HB LYS 44 11.238 -5.590 13.396
305 1HG LYS 44 1HG LYS 44 11.944 -5.046 11.304
306 2HG LYS 44 2HG LYS 44 11.610 -3.380 11.734
307 1HD LYS 44 1HD LYS 44 13.828 -2.841 11.859
308 2HD LYS 44 2HD LYS 44 14.224 -4.291 12.761
309 1HE LYS 44 1HE LYS 44 15.000 -5.326 10.893
310 2HE LYS 44 2HE LYS 44 13.504 -5.021 10.035
311 1HZ LYS 44 1HZ LYS 44 14.361 -2.727 9.689
312 2HZ LYS 44 2HZ LYS 44 15.807 -3.222 10.265
313 3HZ LYS 44 3HZ LYS 44 15.196 -3.893 8.908
314 H GLN 45 H GLN 45 9.115 -2.520 15.446
315 HA GLN 45 HA GLN 45 6.989 -3.419 14.082
316 1HB GLN 45 1HB GLN 45 7.004 -2.017 16.191
317 2HB GLN 45 2HB GLN 45 7.255 -0.594 15.200
318 1HG GLN 45 1HG GLN 45 5.126 -0.988 14.013
319 2HG GLN 45 2HG GLN 45 4.891 -2.500 14.866
320 2HE2 GLN 45 2HE2 GLN 45 2.846 -1.466 15.423
321 1HE2 GLN 45 1HE2 GLN 45 2.750 -0.449 16.822
322 H TYR 46 H TYR 46 8.924 -0.501 13.385
323 HA TYR 46 HA TYR 46 7.491 -0.172 10.807
324 1HB TYR 46 1HB TYR 46 9.538 1.700 12.004
325 2HB TYR 46 2HB TYR 46 8.279 2.054 10.809
326 HD1 TYR 46 HD1 TYR 46 5.852 2.035 11.543
327 HD2 TYR 46 HD2 TYR 46 9.127 1.929 14.321
328 HE1 TYR 46 HE1 TYR 46 4.334 2.773 13.361
329 HE2 TYR 46 HE2 TYR 46 7.609 2.666 16.139
330 HH TYR 46 HH TYR 46 4.589 2.443 16.299
331 H ALA 47 H ALA 47 8.505 -1.923 9.608
332 HA ALA 47 HA ALA 47 11.315 -1.319 9.007
333 1HB ALA 47 1HB ALA 47 10.247 -3.652 10.274
334 2HB ALA 47 3HB ALA 47 11.920 -3.349 9.749
335 3HB ALA 47 2HB ALA 47 10.763 -4.113 8.633
336 H GLY 48 H GLY 48 11.786 -2.919 6.881
337 1HA GLY 48 2HA GLY 48 11.525 -2.809 4.632
338 2HA GLY 48 1HA GLY 48 10.163 -1.725 4.838
339 H CYS 49 H CYS 49 8.624 -2.691 3.512
340 HA CYS 49 HA CYS 49 7.374 -5.016 4.554
341 1HB CYS 49 1HB CYS 49 6.786 -3.722 1.895
342 2HB CYS 49 2HB CYS 49 5.716 -4.687 2.894
343 H THR 50 H THR 50 9.705 -4.197 1.991
344 HA THR 50 HA THR 50 9.510 -6.865 0.837
345 HB THR 50 HB THR 50 11.160 -5.834 -0.799
346 HG1 THR 50 HG1 THR 50 12.170 -4.220 0.414
347 1HG2 THR 50 1HG2 THR 50 8.627 -5.507 -1.094
348 2HG2 THR 50 2HG2 THR 50 8.812 -3.952 -0.249
349 3HG2 THR 50 3HG2 THR 50 9.633 -4.222 -1.805
350 H THR 51 H THR 51 10.463 -6.312 3.675
351 HA THR 51 HA THR 51 13.276 -6.807 3.617
352 HB THR 51 HB THR 51 11.196 -7.106 5.848
353 HG1 THR 51 HG1 THR 51 11.645 -5.003 4.461
354 1HG2 THR 51 1HG2 THR 51 14.224 -6.642 5.847
355 2HG2 THR 51 2HG2 THR 51 13.185 -6.460 7.281
356 3HG2 THR 51 3HG2 THR 51 13.375 -8.057 6.516
357 H ASP 52 H ASP 52 14.360 -8.734 4.426
358 HA ASP 52 HA ASP 52 13.613 -10.952 3.038
359 1HB ASP 52 1HB ASP 52 15.827 -10.269 4.355
360 2HB ASP 52 2HB ASP 52 15.115 -11.203 5.656
361 H GLY 53 H GLY 53 12.822 -13.107 3.867
362 1HA GLY 53 2HA GLY 53 11.860 -13.597 6.417
363 2HA GLY 53 1HA GLY 53 11.319 -14.381 4.946
364 H CYS 54 H CYS 54 10.528 -11.598 3.819
365 HA CYS 54 HA CYS 54 7.953 -11.545 5.189
366 1HB CYS 54 1HB CYS 54 9.403 -9.006 4.394
367 2HB CYS 54 2HB CYS 54 7.886 -9.143 5.259
368 H HIS 55 H HIS 55 7.892 -8.955 3.186
369 HA HIS 55 HA HIS 55 6.908 -10.574 0.981
370 1HB HIS 55 1HB HIS 55 6.592 -7.591 1.353
371 2HB HIS 55 2HB HIS 55 5.667 -8.652 0.309
372 HD1 HIS 55 HD1 HIS 55 4.081 -10.461 1.609
373 HD2 HIS 55 HD2 HIS 55 5.541 -7.249 3.877
374 HE1 HIS 55 HE1 HIS 55 2.624 -10.342 3.701
375 H ASN 56 H ASN 56 9.604 -10.803 1.056
376 HA ASN 56 HA ASN 56 10.759 -8.688 -0.489
377 1HB ASN 56 1HB ASN 56 12.038 -9.940 1.305
378 2HB ASN 56 2HB ASN 56 11.914 -11.402 0.347
379 2HD2 ASN 56 2HD2 ASN 56 14.270 -9.983 1.229
380 1HD2 ASN 56 1HD2 ASN 56 15.183 -9.540 -0.175
381 H ILE 57 H ILE 57 8.937 -9.278 -2.213
382 HA ILE 57 HA ILE 57 10.118 -11.231 -4.050
383 HB ILE 57 HB ILE 57 7.167 -10.921 -3.488
384 1HG1 ILE 57 1HG1 ILE 57 8.751 -12.089 -1.744
385 2HG1 ILE 57 2HG1 ILE 57 7.201 -12.788 -2.166
386 1HG2 ILE 57 1HG2 ILE 57 8.665 -12.816 -5.318
387 2HG2 ILE 57 2HG2 ILE 57 6.921 -12.872 -4.964
388 3HG2 ILE 57 3HG2 ILE 57 7.613 -11.469 -5.814
389 1HD1 ILE 57 1HD1 ILE 57 9.721 -13.546 -3.687
390 2HD1 ILE 57 2HD1 ILE 57 9.264 -14.363 -2.173
391 3HD1 ILE 57 3HD1 ILE 57 8.182 -14.434 -3.584
392 H LEU 58 H LEU 58 10.904 -10.036 -5.701
393 HA LEU 58 HA LEU 58 9.399 -7.641 -6.446
394 1HB LEU 58 1HB LEU 58 12.231 -8.490 -7.066
395 2HB LEU 58 2HB LEU 58 11.471 -7.023 -7.649
396 HG LEU 58 HG LEU 58 12.153 -7.730 -4.787
397 1HD1 LEU 58 1HD1 LEU 58 14.010 -6.934 -6.198
398 2HD1 LEU 58 2HD1 LEU 58 13.088 -5.454 -6.557
399 3HD1 LEU 58 3HD1 LEU 58 13.611 -5.794 -4.890
400 1HD2 LEU 58 1HD2 LEU 58 10.532 -5.394 -5.829
401 2HD2 LEU 58 2HD2 LEU 58 10.005 -6.665 -4.700
402 3HD2 LEU 58 3HD2 LEU 58 11.240 -5.485 -4.199
403 H ASP 59 H ASP 59 8.198 -10.112 -7.081
404 HA ASP 59 HA ASP 59 8.452 -9.967 -9.967
405 1HB ASP 59 1HB ASP 59 9.350 -12.153 -8.424
406 2HB ASP 59 2HB ASP 59 7.776 -12.667 -8.999
407 H LYS 60 H LYS 60 6.404 -9.092 -10.416
408 HA LYS 60 HA LYS 60 4.162 -9.608 -8.770
409 1HB LYS 60 2HB LYS 60 2.945 -8.272 -10.398
410 2HB LYS 60 1HB LYS 60 4.464 -7.504 -9.983
411 1HG LYS 60 1HG LYS 60 4.785 -9.338 -12.258
412 2HG LYS 60 2HG LYS 60 3.550 -8.137 -12.579
413 1HD LYS 60 1HD LYS 60 5.099 -6.496 -12.835
414 2HD LYS 60 2HD LYS 60 5.837 -6.868 -11.289
415 1HE LYS 60 1HE LYS 60 7.231 -8.609 -12.281
416 2HE LYS 60 2HE LYS 60 6.359 -8.524 -13.799
417 1HZ LYS 60 1HZ LYS 60 7.380 -6.001 -13.014
418 2HZ LYS 60 2HZ LYS 60 8.568 -7.112 -13.162
419 3HZ LYS 60 3HZ LYS 60 7.575 -6.805 -14.422
420 H ALA 61 H ALA 61 4.831 -12.097 -9.013
421 HA ALA 61 HA ALA 61 2.698 -13.310 -10.334
422 1HB ALA 61 1HB ALA 61 3.708 -14.338 -12.227
423 2HB ALA 61 3HB ALA 61 5.341 -13.839 -11.726
424 3HB ALA 61 2HB ALA 61 4.181 -12.625 -12.316
425 H ASP 62 H ASP 62 3.380 -13.486 -7.767
426 HA ASP 62 HA ASP 62 4.910 -15.962 -7.600
427 1HB ASP 62 1HB ASP 62 5.808 -13.937 -6.354
428 2HB ASP 62 2HB ASP 62 4.339 -13.923 -5.398
429 H LYS 63 H LYS 63 4.120 -17.312 -5.537
430 HA LYS 63 HA LYS 63 1.186 -17.160 -5.456
431 1HB LYS 63 1HB LYS 63 2.741 -19.220 -6.467
432 2HB LYS 63 2HB LYS 63 2.372 -19.771 -4.845
433 1HG LYS 63 1HG LYS 63 -0.091 -18.819 -5.584
434 2HG LYS 63 2HG LYS 63 0.529 -19.288 -7.154
435 1HD LYS 63 1HD LYS 63 0.805 -21.572 -6.503
436 2HD LYS 63 2HD LYS 63 0.738 -21.190 -4.794
437 1HE LYS 63 2HE LYS 63 -1.478 -21.680 -4.845
438 2HE LYS 63 1HE LYS 63 -1.721 -20.233 -5.803
439 1HZ LYS 63 1HZ LYS 63 -0.922 -22.770 -7.029
440 2HZ LYS 63 2HZ LYS 63 -2.490 -22.380 -6.791
441 3HZ LYS 63 3HZ LYS 63 -1.556 -21.456 -7.761
442 H SER 64 H SER 64 4.259 -17.408 -3.713
443 HA SER 64 HA SER 64 3.208 -18.170 -1.263
444 1HB SER 64 2HB SER 64 5.600 -16.328 -1.519
445 2HB SER 64 1HB SER 64 5.341 -17.627 -0.372
446 HG SER 64 HG SER 64 6.804 -17.877 -2.454
447 H VAL 65 H VAL 65 3.113 -16.728 0.749
448 HA VAL 65 HA VAL 65 1.592 -14.364 0.073
449 HB VAL 65 HB VAL 65 0.676 -15.866 1.690
450 1HG1 VAL 65 1HG1 VAL 65 3.412 -15.728 2.899
451 2HG1 VAL 65 2HG1 VAL 65 2.019 -15.966 3.981
452 3HG1 VAL 65 3HG1 VAL 65 2.331 -17.123 2.665
453 1HG2 VAL 65 1HG2 VAL 65 1.140 -13.124 2.172
454 2HG2 VAL 65 2HG2 VAL 65 -0.155 -14.145 2.841
455 3HG2 VAL 65 3HG2 VAL 65 1.372 -13.945 3.734
456 H ASN 66 H ASN 66 4.282 -14.138 -0.740
457 HA ASN 66 HA ASN 66 5.216 -12.203 1.230
458 1HB ASN 66 1HB ASN 66 6.902 -13.983 -0.609
459 2HB ASN 66 2HB ASN 66 7.556 -12.736 0.434
460 2HD2 ASN 66 2HD2 ASN 66 8.769 -14.099 1.664
461 1HD2 ASN 66 1HD2 ASN 66 8.118 -15.238 2.795
462 H SER 67 H SER 67 3.557 -12.364 -1.497
463 HA SER 67 HA SER 67 5.202 -10.986 -3.335
464 1HB SER 67 1HB SER 67 3.174 -10.840 -4.704
465 2HB SER 67 2HB SER 67 3.320 -12.452 -4.034
466 HG SER 67 HG SER 67 1.500 -12.184 -2.925
467 H TRP 68 H TRP 68 5.407 -8.764 -3.677
468 HA TRP 68 HA TRP 68 4.089 -7.077 -1.693
469 1HB TRP 68 1HB TRP 68 6.396 -6.754 -1.649
470 2HB TRP 68 2HB TRP 68 6.547 -6.807 -3.395
471 HD1 TRP 68 HD1 TRP 68 6.783 -4.454 -4.506
472 HE1 TRP 68 HE1 TRP 68 6.304 -1.928 -3.910
473 HE3 TRP 68 HE3 TRP 68 4.522 -5.390 -0.049
474 HZ2 TRP 68 HZ2 TRP 68 5.060 -0.635 -1.691
475 HZ3 TRP 68 HZ3 TRP 68 3.704 -3.439 1.270
476 HH2 TRP 68 HH2 TRP 68 3.943 -1.127 0.516
477 H TYR 69 H TYR 69 3.034 -8.390 -4.284
478 HA TYR 69 HA TYR 69 1.975 -5.881 -5.499
479 1HB TYR 69 1HB TYR 69 3.427 -6.857 -7.111
480 2HB TYR 69 2HB TYR 69 2.830 -8.490 -6.771
481 HD1 TYR 69 HD1 TYR 69 0.506 -9.132 -7.478
482 HD2 TYR 69 HD2 TYR 69 2.348 -5.448 -8.695
483 HE1 TYR 69 HE1 TYR 69 -1.153 -8.908 -9.308
484 HE2 TYR 69 HE2 TYR 69 0.690 -5.223 -10.525
485 HH TYR 69 HH TYR 69 -1.370 -7.739 -11.541
486 H LYS 70 H LYS 70 1.266 -8.599 -3.592
487 HA LYS 70 HA LYS 70 -1.462 -8.708 -4.667
488 1HB LYS 70 1HB LYS 70 0.097 -10.807 -4.446
489 2HB LYS 70 2HB LYS 70 -0.327 -10.725 -2.748
490 1HG LYS 70 1HG LYS 70 -2.813 -10.519 -3.642
491 2HG LYS 70 2HG LYS 70 -2.152 -11.170 -5.129
492 1HD LYS 70 1HD LYS 70 -2.895 -13.076 -3.882
493 2HD LYS 70 2HD LYS 70 -1.149 -13.076 -3.728
494 1HE LYS 70 2HE LYS 70 -2.136 -13.488 -1.525
495 2HE LYS 70 1HE LYS 70 -1.354 -11.920 -1.508
496 1HZ LYS 70 1HZ LYS 70 -3.924 -11.492 -2.364
497 2HZ LYS 70 2HZ LYS 70 -4.054 -12.521 -1.103
498 3HZ LYS 70 3HZ LYS 70 -3.288 -11.091 -0.914
499 H VAL 71 H VAL 71 0.554 -8.330 -1.706
500 HA VAL 71 HA VAL 71 -1.614 -8.013 0.047
501 HB VAL 71 HB VAL 71 0.076 -7.087 1.560
502 1HG1 VAL 71 1HG1 VAL 71 -0.132 -9.640 0.712
503 2HG1 VAL 71 2HG1 VAL 71 1.568 -9.324 0.289
504 3HG1 VAL 71 3HG1 VAL 71 1.014 -9.116 1.969
505 1HG2 VAL 71 1HG2 VAL 71 1.298 -5.838 -0.312
506 2HG2 VAL 71 2HG2 VAL 71 2.305 -6.615 0.934
507 3HG2 VAL 71 3HG2 VAL 71 2.110 -7.384 -0.660
508 H VAL 72 H VAL 72 -0.616 -6.122 -2.582
509 HA VAL 72 HA VAL 72 -1.561 -3.654 -1.321
510 HB VAL 72 HB VAL 72 -0.032 -4.188 -3.875
511 1HG1 VAL 72 1HG1 VAL 72 -1.700 -2.221 -3.883
512 2HG1 VAL 72 2HG1 VAL 72 -0.594 -1.455 -2.717
513 3HG1 VAL 72 3HG1 VAL 72 -0.013 -1.887 -4.343
514 1HG2 VAL 72 1HG2 VAL 72 0.757 -3.046 -1.182
515 2HG2 VAL 72 2HG2 VAL 72 1.424 -4.470 -2.016
516 3HG2 VAL 72 3HG2 VAL 72 1.739 -2.838 -2.652
517 H HIS 73 H HIS 73 -2.058 -5.898 -4.102
518 HA HIS 73 HA HIS 73 -4.578 -4.503 -4.608
519 1HB HIS 73 1HB HIS 73 -3.111 -6.431 -6.425
520 2HB HIS 73 2HB HIS 73 -4.512 -5.460 -6.829
521 HD1 HIS 73 HD1 HIS 73 -0.789 -5.190 -6.223
522 HD2 HIS 73 HD2 HIS 73 -3.980 -2.779 -7.489
523 HE1 HIS 73 HE1 HIS 73 0.253 -3.053 -7.149
524 H ASP 74 H ASP 74 -4.230 -6.255 -2.320
525 HA ASP 74 HA ASP 74 -5.604 -8.652 -3.194
526 1HB ASP 74 1HB ASP 74 -3.956 -9.359 -1.719
527 2HB ASP 74 2HB ASP 74 -3.954 -7.849 -0.828
528 H ALA 75 H ALA 75 -7.840 -8.771 -2.893
529 HA ALA 75 HA ALA 75 -9.064 -6.689 -1.247
530 1HB ALA 75 1HB ALA 75 -9.652 -7.941 -3.776
531 2HB ALA 75 3HB ALA 75 -10.997 -8.245 -2.650
532 3HB ALA 75 2HB ALA 75 -10.478 -6.576 -2.987
533 H LYS 76 H LYS 76 -7.718 -9.552 -0.623
534 HA LYS 76 HA LYS 76 -9.987 -10.752 0.738
535 1HB LYS 76 1HB LYS 76 -8.196 -12.002 -0.659
536 2HB LYS 76 2HB LYS 76 -7.155 -11.790 0.734
537 1HG LYS 76 1HG LYS 76 -9.163 -12.768 2.118
538 2HG LYS 76 2HG LYS 76 -9.782 -13.308 0.570
539 1HD LYS 76 1HD LYS 76 -7.731 -14.600 0.138
540 2HD LYS 76 2HD LYS 76 -6.976 -13.958 1.583
541 1HE LYS 76 2HE LYS 76 -7.896 -15.617 2.823
542 2HE LYS 76 1HE LYS 76 -9.503 -15.075 2.382
543 1HZ LYS 76 1HZ LYS 76 -7.964 -16.666 0.488
544 2HZ LYS 76 2HZ LYS 76 -8.732 -17.407 1.724
545 3HZ LYS 76 3HZ LYS 76 -9.584 -16.532 0.640
546 H GLY 77 H GLY 77 -9.920 -11.238 3.048
547 1HA GLY 77 2HA GLY 77 -9.770 -10.487 5.169
548 2HA GLY 77 1HA GLY 77 -9.053 -9.003 4.574
549 H GLY 78 H GLY 78 -8.150 -10.192 6.966
550 1HA GLY 78 2HA GLY 78 -5.389 -10.824 6.207
551 2HA GLY 78 1HA GLY 78 -6.253 -11.966 7.216
552 H ALA 79 H ALA 79 -4.039 -10.962 8.367
553 HA ALA 79 HA ALA 79 -4.785 -9.973 10.751
554 1HB ALA 79 1HB ALA 79 -2.436 -9.208 10.975
555 2HB ALA 79 3HB ALA 79 -2.227 -9.362 9.215
556 3HB ALA 79 2HB ALA 79 -2.539 -10.809 10.204
557 H LYS 80 H LYS 80 -4.524 -8.218 7.686
558 HA LYS 80 HA LYS 80 -5.937 -6.021 8.797
559 1HB LYS 80 1HB LYS 80 -4.207 -4.299 8.362
560 2HB LYS 80 2HB LYS 80 -3.803 -5.369 9.689
561 1HG LYS 80 1HG LYS 80 -2.003 -6.280 8.587
562 2HG LYS 80 2HG LYS 80 -2.836 -6.325 7.046
563 1HD LYS 80 1HD LYS 80 -1.902 -3.694 8.258
564 2HD LYS 80 2HD LYS 80 -0.820 -4.687 7.301
565 1HE LYS 80 1HE LYS 80 -2.534 -4.640 5.422
566 2HE LYS 80 2HE LYS 80 -3.490 -3.524 6.376
567 1HZ LYS 80 1HZ LYS 80 -0.691 -2.901 5.911
568 2HZ LYS 80 2HZ LYS 80 -1.756 -2.659 4.697
569 3HZ LYS 80 3HZ LYS 80 -1.954 -1.888 6.122
570 HA PRO 81 HA PRO 81 -7.365 -5.795 4.694
571 1HB PRO 81 1HB PRO 81 -7.802 -3.043 4.516
572 2HB PRO 81 2HB PRO 81 -8.864 -4.193 5.393
573 1HG PRO 81 2HG PRO 81 -6.723 -2.576 6.227
574 2HG PRO 81 1HG PRO 81 -8.211 -2.561 7.230
575 1HD PRO 81 1HD PRO 81 -6.216 -3.986 8.152
576 2HD PRO 81 2HD PRO 81 -7.754 -4.876 7.942
577 H THR 82 H THR 82 -6.983 -3.975 2.677
578 HA THR 82 HA THR 82 -4.059 -3.632 2.577
579 HB THR 82 HB THR 82 -4.271 -4.319 0.155
580 HG1 THR 82 HG1 THR 82 -6.926 -5.145 1.059
581 1HG2 THR 82 1HG2 THR 82 -5.477 -6.306 2.152
582 2HG2 THR 82 2HG2 THR 82 -4.887 -6.731 0.528
583 3HG2 THR 82 3HG2 THR 82 -3.748 -6.141 1.762
584 H CYS 83 H CYS 83 -3.956 -2.372 0.063
585 HA CYS 83 HA CYS 83 -4.861 0.221 0.889
586 1HB CYS 83 2HB CYS 83 -3.518 -0.387 -1.730
587 2HB CYS 83 1HB CYS 83 -3.493 1.095 -0.797
588 H ILE 84 H ILE 84 -6.391 -2.379 -0.445
589 HA ILE 84 HA ILE 84 -7.990 -0.705 -2.255
590 HB ILE 84 HB ILE 84 -7.109 -3.557 -2.393
591 1HG1 ILE 84 1HG1 ILE 84 -5.865 -1.859 -3.634
592 2HG1 ILE 84 2HG1 ILE 84 -6.661 -2.984 -4.716
593 1HG2 ILE 84 1HG2 ILE 84 -9.756 -2.478 -3.287
594 2HG2 ILE 84 2HG2 ILE 84 -8.919 -3.687 -4.291
595 3HG2 ILE 84 3HG2 ILE 84 -9.337 -4.068 -2.604
596 1HD1 ILE 84 1HD1 ILE 84 -8.633 -1.147 -4.580
597 2HD1 ILE 84 2HD1 ILE 84 -7.253 -0.084 -4.214
598 3HD1 ILE 84 3HD1 ILE 84 -7.289 -1.003 -5.738
599 H SER 85 H SER 85 -7.995 -3.270 0.279
600 HA SER 85 HA SER 85 -10.686 -3.609 0.474
601 1HB SER 85 2HB SER 85 -8.846 -3.527 2.893
602 2HB SER 85 1HB SER 85 -10.267 -4.527 2.661
603 HG SER 85 HG SER 85 -8.865 -5.298 0.655
604 H CYS 86 H CYS 86 -8.626 -1.409 2.528
605 HA CYS 86 HA CYS 86 -10.783 -0.160 3.754
606 1HB CYS 86 1HB CYS 86 -8.360 -0.154 4.503
607 2HB CYS 86 2HB CYS 86 -8.051 1.069 3.287
608 H HIS 87 H HIS 87 -8.603 0.978 1.061
609 HA HIS 87 HA HIS 87 -9.839 3.299 0.458
610 1HB HIS 87 1HB HIS 87 -8.354 1.266 -1.163
611 2HB HIS 87 2HB HIS 87 -9.136 2.591 -2.002
612 HD1 HIS 87 HD1 HIS 87 -6.989 3.816 -2.678
613 HD2 HIS 87 HD2 HIS 87 -7.302 3.160 1.454
614 HE1 HIS 87 HE1 HIS 87 -5.127 5.183 -1.594
615 H LYS 88 H LYS 88 -10.860 -0.031 -0.410
616 HA LYS 88 HA LYS 88 -12.856 0.680 -2.217
617 1HB LYS 88 1HB LYS 88 -12.205 -1.717 -0.552
618 2HB LYS 88 2HB LYS 88 -13.803 -1.627 -1.266
619 1HG LYS 88 1HG LYS 88 -11.354 -1.058 -2.965
620 2HG LYS 88 2HG LYS 88 -11.823 -2.714 -2.637
621 1HD LYS 88 1HD LYS 88 -13.665 -2.606 -4.004
622 2HD LYS 88 2HD LYS 88 -14.088 -0.989 -3.478
623 1HE LYS 88 1HE LYS 88 -13.397 -1.106 -5.905
624 2HE LYS 88 2HE LYS 88 -12.438 0.018 -4.962
625 1HZ LYS 88 1HZ LYS 88 -11.585 -2.754 -5.360
626 2HZ LYS 88 2HZ LYS 88 -11.212 -1.579 -6.431
627 3HZ LYS 88 3HZ LYS 88 -10.681 -1.479 -4.890
628 H ASP 89 H ASP 89 -12.963 0.146 1.365
629 HA ASP 89 HA ASP 89 -15.633 0.490 1.696
630 1HB ASP 89 1HB ASP 89 -13.607 0.023 3.374
631 2HB ASP 89 2HB ASP 89 -13.690 1.753 3.643
632 H LYS 90 H LYS 90 -12.966 2.903 1.398
633 HA LYS 90 HA LYS 90 -14.486 5.162 2.066
634 1HB LYS 90 1HB LYS 90 -11.830 4.577 0.903
635 2HB LYS 90 2HB LYS 90 -12.512 6.123 0.440
636 1HG LYS 90 2HG LYS 90 -12.129 5.105 3.295
637 2HG LYS 90 1HG LYS 90 -11.196 6.365 2.513
638 1HD LYS 90 1HD LYS 90 -13.743 7.343 2.152
639 2HD LYS 90 2HD LYS 90 -13.951 6.479 3.662
640 1HE LYS 90 1HE LYS 90 -11.991 7.707 4.630
641 2HE LYS 90 2HE LYS 90 -11.793 8.576 3.122
642 1HZ LYS 90 1HZ LYS 90 -14.423 8.865 3.819
643 2HZ LYS 90 2HZ LYS 90 -13.592 9.085 5.208
644 3HZ LYS 90 3HZ LYS 90 -13.255 10.004 3.900
645 H ALA 91 H ALA 91 -13.778 3.504 -1.061
646 HA ALA 91 HA ALA 91 -15.516 5.398 -2.422
647 1HB ALA 91 1HB ALA 91 -14.276 3.059 -3.813
648 2HB ALA 91 3HB ALA 91 -14.428 4.753 -4.339
649 3HB ALA 91 2HB ALA 91 -13.172 4.294 -3.163
650 H GLY 92 H GLY 92 -16.397 3.320 -0.326
651 1HA GLY 92 2HA GLY 92 -17.863 1.566 -0.149
652 2HA GLY 92 1HA GLY 92 -17.948 1.433 -1.894
653 H ASP 93 H ASP 93 -18.885 3.658 -2.952
654 HA ASP 93 HA ASP 93 -21.497 3.705 -2.535
655 1HB ASP 93 1HB ASP 93 -21.750 5.954 -1.221
656 2HB ASP 93 2HB ASP 93 -21.507 4.476 -0.311
657 H ASP 94 H ASP 94 -18.856 6.226 -2.455
658 HA ASP 94 HA ASP 94 -20.131 7.742 -4.476
659 1HB ASP 94 1HB ASP 94 -18.747 8.843 -2.781
660 2HB ASP 94 2HB ASP 94 -17.361 7.859 -3.205
661 H LYS 95 H LYS 95 -19.855 7.464 -6.705
662 HA LYS 95 HA LYS 95 -18.211 5.335 -7.628
663 1HB LYS 95 1HB LYS 95 -19.980 7.379 -8.978
664 2HB LYS 95 2HB LYS 95 -19.015 6.240 -9.894
665 1HG LYS 95 1HG LYS 95 -20.087 4.358 -8.546
666 2HG LYS 95 2HG LYS 95 -21.144 5.550 -7.816
667 1HD LYS 95 1HD LYS 95 -20.996 5.571 -10.813
668 2HD LYS 95 2HD LYS 95 -21.781 4.183 -10.087
669 1HE LYS 95 1HE LYS 95 -23.657 5.449 -9.891
670 2HE LYS 95 2HE LYS 95 -22.831 6.370 -8.650
671 1HZ LYS 95 1HZ LYS 95 -22.455 6.985 -11.485
672 2HZ LYS 95 2HZ LYS 95 -23.703 7.612 -10.639
673 3HZ LYS 95 3HZ LYS 95 -22.167 7.943 -10.194
674 H GLU 96 H GLU 96 -18.032 8.924 -7.586
675 HA GLU 96 HA GLU 96 -15.809 9.078 -9.252
676 1HB GLU 96 1HB GLU 96 -17.446 10.939 -8.504
677 2HB GLU 96 2HB GLU 96 -16.487 11.053 -7.042
678 1HG GLU 96 2HG GLU 96 -15.699 12.702 -8.696
679 2HG GLU 96 1HG GLU 96 -14.447 11.514 -8.394
680 H LEU 97 H LEU 97 -16.220 8.178 -5.883
681 HA LEU 97 HA LEU 97 -13.498 8.741 -5.166
682 1HB LEU 97 1HB LEU 97 -15.651 8.723 -3.705
683 2HB LEU 97 2HB LEU 97 -15.382 6.994 -3.620
684 HG LEU 97 HG LEU 97 -14.382 7.815 -1.686
685 1HD1 LEU 97 1HD1 LEU 97 -12.914 6.298 -3.033
686 2HD1 LEU 97 2HD1 LEU 97 -12.051 7.741 -3.616
687 3HD1 LEU 97 3HD1 LEU 97 -12.047 7.343 -1.881
688 1HD2 LEU 97 1HD2 LEU 97 -14.516 10.218 -2.409
689 2HD2 LEU 97 2HD2 LEU 97 -13.068 9.790 -1.467
690 3HD2 LEU 97 3HD2 LEU 97 -12.955 9.990 -3.232
691 H LYS 98 H LYS 98 -15.281 6.195 -6.755
692 HA LYS 98 HA LYS 98 -13.295 4.194 -6.115
693 1HB LYS 98 1HB LYS 98 -15.735 3.678 -6.256
694 2HB LYS 98 2HB LYS 98 -15.690 4.044 -7.969
695 1HG LYS 98 1HG LYS 98 -14.840 1.997 -8.454
696 2HG LYS 98 2HG LYS 98 -13.515 2.222 -7.330
697 1HD LYS 98 2HD LYS 98 -14.765 0.283 -6.588
698 2HD LYS 98 1HD LYS 98 -15.072 1.570 -5.438
699 1HE LYS 98 1HE LYS 98 -17.154 2.105 -6.997
700 2HE LYS 98 2HE LYS 98 -16.917 0.468 -7.576
701 1HZ LYS 98 1HZ LYS 98 -17.049 1.029 -4.711
702 2HZ LYS 98 2HZ LYS 98 -18.410 0.822 -5.588
703 3HZ LYS 98 3HZ LYS 98 -17.315 -0.384 -5.484
704 H LYS 99 H LYS 99 -12.661 6.795 -7.591
705 HA LYS 99 HA LYS 99 -11.226 5.478 -9.752
706 1HB LYS 99 1HB LYS 99 -13.389 7.474 -10.104
707 2HB LYS 99 2HB LYS 99 -11.924 7.784 -11.014
708 1HG LYS 99 1HG LYS 99 -12.981 4.964 -11.023
709 2HG LYS 99 2HG LYS 99 -13.879 6.160 -11.937
710 1HD LYS 99 1HD LYS 99 -11.690 6.822 -13.073
711 2HD LYS 99 2HD LYS 99 -10.922 5.471 -12.263
712 1HE LYS 99 1HE LYS 99 -13.452 4.868 -13.770
713 2HE LYS 99 2HE LYS 99 -12.043 5.266 -14.734
714 1HZ LYS 99 1HZ LYS 99 -11.798 3.328 -12.572
715 2HZ LYS 99 2HZ LYS 99 -12.430 2.863 -14.004
716 3HZ LYS 99 3HZ LYS 99 -10.912 3.462 -13.937
717 H LYS 100 H LYS 100 -10.155 6.077 -7.295
718 HA LYS 100 HA LYS 100 -8.115 7.883 -8.025
719 1HB LYS 100 1HB LYS 100 -8.685 9.376 -5.900
720 2HB LYS 100 2HB LYS 100 -9.270 9.769 -7.504
721 1HG LYS 100 1HG LYS 100 -11.372 8.378 -6.939
722 2HG LYS 100 2HG LYS 100 -10.797 8.343 -5.284
723 1HD LYS 100 1HD LYS 100 -11.138 10.958 -6.811
724 2HD LYS 100 2HD LYS 100 -12.460 10.229 -5.920
725 1HE LYS 100 1HE LYS 100 -11.075 10.270 -3.833
726 2HE LYS 100 2HE LYS 100 -9.752 10.997 -4.724
727 1HZ LYS 100 1HZ LYS 100 -11.960 12.526 -5.259
728 2HZ LYS 100 2HZ LYS 100 -12.025 12.234 -3.654
729 3HZ LYS 100 3HZ LYS 100 -10.696 12.925 -4.305
730 H LEU 101 H LEU 101 -9.925 6.233 -5.374
731 HA LEU 101 HA LEU 101 -7.402 5.728 -4.022
732 1HB LEU 101 2HB LEU 101 -10.245 5.094 -3.218
733 2HB LEU 101 1HB LEU 101 -8.819 4.852 -2.229
734 HG LEU 101 HG LEU 101 -10.171 7.417 -3.014
735 1HD1 LEU 101 1HD1 LEU 101 -10.506 5.988 -0.830
736 2HD1 LEU 101 2HD1 LEU 101 -9.009 6.808 -0.323
737 3HD1 LEU 101 3HD1 LEU 101 -10.443 7.766 -0.764
738 1HD2 LEU 101 1HD2 LEU 101 -7.844 7.753 -3.658
739 2HD2 LEU 101 2HD2 LEU 101 -8.246 8.703 -2.207
740 3HD2 LEU 101 3HD2 LEU 101 -7.304 7.201 -2.055
741 H THR 102 H THR 102 -9.927 4.137 -5.965
742 HA THR 102 HA THR 102 -8.300 1.682 -5.852
743 HB THR 102 HB THR 102 -10.358 0.407 -5.875
744 HG1 THR 102 HG1 THR 102 -11.599 1.659 -7.340
745 1HG2 THR 102 1HG2 THR 102 -9.947 2.376 -3.820
746 2HG2 THR 102 2HG2 THR 102 -11.686 2.372 -4.201
747 3HG2 THR 102 3HG2 THR 102 -10.881 0.866 -3.700
748 H GLY 103 H GLY 103 -8.753 4.301 -7.671
749 1HA GLY 103 2HA GLY 103 -8.617 4.754 -9.868
750 2HA GLY 103 1HA GLY 103 -9.646 3.366 -10.160
751 H CYS 104 H CYS 104 -8.782 1.685 -11.304
752 HA CYS 104 HA CYS 104 -6.293 0.608 -10.858
753 1HB CYS 104 1HB CYS 104 -8.408 0.351 -12.876
754 2HB CYS 104 2HB CYS 104 -6.807 -0.010 -13.492
755 H LYS 105 H LYS 105 -7.424 2.898 -13.451
756 HA LYS 105 HA LYS 105 -4.628 3.755 -13.712
757 1HB LYS 105 1HB LYS 105 -4.954 4.022 -16.104
758 2HB LYS 105 2HB LYS 105 -5.253 2.362 -15.630
759 1HG LYS 105 1HG LYS 105 -7.580 2.538 -15.945
760 2HG LYS 105 2HG LYS 105 -7.592 4.273 -15.696
761 1HD LYS 105 1HD LYS 105 -7.604 4.507 -17.954
762 2HD LYS 105 2HD LYS 105 -5.944 3.948 -17.953
763 1HE LYS 105 1HE LYS 105 -6.906 1.540 -17.985
764 2HE LYS 105 2HE LYS 105 -8.461 2.270 -18.331
765 1HZ LYS 105 1HZ LYS 105 -6.084 2.870 -19.936
766 2HZ LYS 105 2HZ LYS 105 -7.072 1.616 -20.282
767 3HZ LYS 105 3HZ LYS 105 -7.648 3.144 -20.317
768 H GLY 106 H GLY 106 -4.270 5.954 -13.665
769 1HA GLY 106 2HA GLY 106 -6.381 7.833 -14.146
770 2HA GLY 106 1HA GLY 106 -4.744 8.169 -13.621
771 H SER 107 H SER 107 -4.541 6.653 -11.247
772 HA SER 107 HA SER 107 -6.626 7.918 -9.644
773 1HB SER 107 2HB SER 107 -6.558 6.065 -8.106
774 2HB SER 107 1HB SER 107 -6.714 5.387 -9.714
775 HG SER 107 HG SER 107 -5.069 4.185 -8.921
776 H ALA 108 H ALA 108 -5.644 7.824 -7.125
777 HA ALA 108 HA ALA 108 -3.449 9.639 -7.247
778 1HB ALA 108 1HB ALA 108 -3.716 9.524 -4.724
779 2HB ALA 108 3HB ALA 108 -5.019 8.342 -4.990
780 3HB ALA 108 2HB ALA 108 -5.180 9.999 -5.619
781 H CYS 109 H CYS 109 -3.629 6.306 -7.563
782 HA CYS 109 HA CYS 109 -1.115 5.899 -6.131
783 1HB CYS 109 1HB CYS 109 -3.171 3.908 -7.137
784 2HB CYS 109 2HB CYS 109 -1.619 3.453 -6.463
785 H HIS 110 H HIS 110 -2.858 5.324 -9.263
786 HA HIS 110 HA HIS 110 -0.221 5.201 -10.536
787 1HB HIS 110 2HB HIS 110 -2.783 3.819 -11.384
788 2HB HIS 110 1HB HIS 110 -1.269 3.784 -12.266
789 HD1 HIS 110 HD1 HIS 110 0.813 3.078 -10.233
790 HD2 HIS 110 HD2 HIS 110 -3.033 1.406 -10.152
791 HE1 HIS 110 HE1 HIS 110 1.008 0.899 -8.918
792 HA PRO 111 HA PRO 111 -2.261 8.856 -12.295
793 1HB PRO 111 1HB PRO 111 -0.471 10.735 -11.599
794 2HB PRO 111 2HB PRO 111 -1.531 10.000 -10.353
795 1HG PRO 111 2HG PRO 111 1.083 9.332 -11.281
796 2HG PRO 111 1HG PRO 111 1.008 9.344 -9.489
797 1HD PRO 111 1HD PRO 111 1.001 7.002 -10.827
798 2HD PRO 111 2HD PRO 111 -0.139 7.232 -9.466
799 H SER 112 H SER 112 -1.524 7.283 -14.217
800 HA SER 112 HA SER 112 0.598 8.741 -15.567
801 1HB SER 112 1HB SER 112 0.454 5.823 -14.971
802 2HB SER 112 2HB SER 112 0.894 6.218 -16.620
803 HG SER 112 HG SER 112 2.247 7.801 -14.767
No H/Q in entry = 803
Start of MODEL 13
1 H1 VAL 1 H1 VAL 1 8.090 8.577 17.327
2 H2 VAL 1 H2 VAL 1 9.149 7.662 18.212
3 H3 VAL 1 H3 VAL 1 9.367 9.299 18.095
4 HA VAL 1 HA VAL 1 10.923 8.356 16.725
5 HB VAL 1 HB VAL 1 10.123 6.157 16.540
6 1HG1 VAL 1 1HG1 VAL 1 7.587 7.434 15.982
7 2HG1 VAL 1 2HG1 VAL 1 7.935 6.182 14.766
8 3HG1 VAL 1 3HG1 VAL 1 7.927 5.764 16.496
9 1HG2 VAL 1 1HG2 VAL 1 11.319 7.188 14.516
10 2HG2 VAL 1 2HG2 VAL 1 10.452 5.655 14.260
11 3HG2 VAL 1 3HG2 VAL 1 9.724 7.189 13.726
12 H ASP 2 H ASP 2 8.014 10.066 16.558
13 HA ASP 2 HA ASP 2 7.288 11.705 15.340
14 1HB ASP 2 1HB ASP 2 9.579 12.623 15.694
15 2HB ASP 2 2HB ASP 2 10.146 11.788 14.261
16 H VAL 3 H VAL 3 5.810 10.927 13.804
17 HA VAL 3 HA VAL 3 6.403 9.098 11.816
18 HB VAL 3 HB VAL 3 4.174 10.022 12.850
19 1HG1 VAL 3 1HG1 VAL 3 4.671 12.311 11.733
20 2HG1 VAL 3 2HG1 VAL 3 4.086 11.534 10.242
21 3HG1 VAL 3 3HG1 VAL 3 3.015 11.663 11.658
22 1HG2 VAL 3 1HG2 VAL 3 4.578 8.109 11.187
23 2HG2 VAL 3 2HG2 VAL 3 2.962 8.855 11.200
24 3HG2 VAL 3 3HG2 VAL 3 4.126 9.276 9.920
25 HA PRO 4 HA PRO 4 9.125 11.205 9.081
26 1HB PRO 4 1HB PRO 4 7.557 9.479 7.131
27 2HB PRO 4 2HB PRO 4 9.324 9.733 7.303
28 1HG PRO 4 1HG PRO 4 8.272 7.521 8.383
29 2HG PRO 4 2HG PRO 4 9.633 8.378 9.176
30 1HD PRO 4 2HD PRO 4 6.704 8.260 9.894
31 2HD PRO 4 1HD PRO 4 8.120 8.550 10.950
32 H ALA 5 H ALA 5 8.918 12.679 7.134
33 HA ALA 5 HA ALA 5 6.371 14.053 7.284
34 1HB ALA 5 1HB ALA 5 7.526 15.869 6.264
35 2HB ALA 5 3HB ALA 5 8.823 14.808 5.663
36 3HB ALA 5 2HB ALA 5 8.689 15.150 7.405
37 H ASP 6 H ASP 6 5.171 14.655 5.321
38 HA ASP 6 HA ASP 6 4.581 12.516 3.768
39 1HB ASP 6 1HB ASP 6 3.198 13.984 2.534
40 2HB ASP 6 2HB ASP 6 3.355 14.790 4.082
41 H GLY 7 H GLY 7 4.632 13.196 1.045
42 1HA GLY 7 2HA GLY 7 7.150 14.172 0.148
43 2HA GLY 7 1HA GLY 7 5.917 13.366 -0.801
44 H ALA 8 H ALA 8 5.727 10.903 0.737
45 HA ALA 8 HA ALA 8 8.436 9.826 0.594
46 1HB ALA 8 1HB ALA 8 5.951 9.252 2.088
47 2HB ALA 8 2HB ALA 8 7.649 8.953 2.533
48 3HB ALA 8 3HB ALA 8 6.789 7.803 1.481
49 H LYS 9 H LYS 9 9.070 9.037 -1.348
50 HA LYS 9 HA LYS 9 7.016 8.138 -3.194
51 1HB LYS 9 2HB LYS 9 8.391 8.866 -4.793
52 2HB LYS 9 1HB LYS 9 9.331 9.606 -3.513
53 1HG LYS 9 1HG LYS 9 10.496 7.255 -3.309
54 2HG LYS 9 2HG LYS 9 9.800 6.936 -4.885
55 1HD LYS 9 1HD LYS 9 10.874 9.128 -5.688
56 2HD LYS 9 2HD LYS 9 11.720 9.192 -4.155
57 1HE LYS 9 1HE LYS 9 12.326 6.630 -4.872
58 2HE LYS 9 2HE LYS 9 12.116 7.320 -6.469
59 1HZ LYS 9 1HZ LYS 9 13.585 9.147 -5.076
60 2HZ LYS 9 2HZ LYS 9 14.223 7.706 -4.650
61 3HZ LYS 9 3HZ LYS 9 14.136 8.127 -6.226
62 H ILE 10 H ILE 10 6.651 6.023 -3.748
63 HA ILE 10 HA ILE 10 8.397 4.068 -2.421
64 HB ILE 10 HB ILE 10 5.457 3.842 -3.079
65 1HG1 ILE 10 1HG1 ILE 10 6.614 3.969 -0.302
66 2HG1 ILE 10 2HG1 ILE 10 6.263 5.444 -1.181
67 1HG2 ILE 10 1HG2 ILE 10 7.443 1.938 -1.844
68 2HG2 ILE 10 2HG2 ILE 10 5.695 1.813 -1.530
69 3HG2 ILE 10 3HG2 ILE 10 6.313 1.668 -3.193
70 1HD1 ILE 10 1HD1 ILE 10 4.199 3.225 -0.897
71 2HD1 ILE 10 2HD1 ILE 10 4.378 4.517 0.314
72 3HD1 ILE 10 3HD1 ILE 10 3.929 4.922 -1.361
73 H ASP 11 H ASP 11 9.703 3.017 -3.809
74 HA ASP 11 HA ASP 11 8.550 2.126 -6.284
75 1HB ASP 11 1HB ASP 11 9.481 4.212 -7.049
76 2HB ASP 11 2HB ASP 11 10.930 4.009 -6.083
77 H PHE 12 H PHE 12 8.884 -0.041 -5.509
78 HA PHE 12 HA PHE 12 11.682 -0.729 -4.943
79 1HB PHE 12 1HB PHE 12 9.015 -2.039 -4.138
80 2HB PHE 12 2HB PHE 12 10.590 -2.641 -3.662
81 HD1 PHE 12 HD1 PHE 12 11.963 -0.107 -2.944
82 HD2 PHE 12 HD2 PHE 12 8.017 -1.433 -2.123
83 HE1 PHE 12 HE1 PHE 12 11.900 1.346 -0.897
84 HE2 PHE 12 HE2 PHE 12 7.954 0.019 -0.077
85 HZ PHE 12 HZ PHE 12 9.896 1.391 0.512
86 H ILE 13 H ILE 13 8.794 -1.326 -6.893
87 HA ILE 13 HA ILE 13 10.042 -3.690 -8.064
88 HB ILE 13 HB ILE 13 7.273 -2.513 -8.295
89 1HG1 ILE 13 1HG1 ILE 13 8.212 -5.102 -7.026
90 2HG1 ILE 13 2HG1 ILE 13 7.872 -3.629 -6.139
91 1HG2 ILE 13 1HG2 ILE 13 8.575 -4.809 -9.750
92 2HG2 ILE 13 2HG2 ILE 13 6.817 -4.746 -9.478
93 3HG2 ILE 13 3HG2 ILE 13 7.621 -3.457 -10.404
94 1HD1 ILE 13 1HD1 ILE 13 5.548 -3.742 -7.455
95 2HD1 ILE 13 2HD1 ILE 13 5.964 -5.469 -7.573
96 3HD1 ILE 13 3HD1 ILE 13 5.808 -4.699 -5.976
97 H ALA 14 H ALA 14 11.794 -2.599 -9.135
98 HA ALA 14 HA ALA 14 11.455 -0.399 -10.799
99 1HB ALA 14 1HB ALA 14 13.604 -1.378 -9.889
100 2HB ALA 14 3HB ALA 14 13.651 -0.963 -11.619
101 3HB ALA 14 2HB ALA 14 13.465 -2.660 -11.116
102 H GLY 15 H GLY 15 12.036 -0.652 -13.314
103 1HA GLY 15 2HA GLY 15 9.985 -1.252 -14.799
104 2HA GLY 15 1HA GLY 15 10.529 -2.886 -14.478
105 H GLY 16 H GLY 16 11.031 0.012 -16.342
106 1HA GLY 16 2HA GLY 16 12.598 -1.202 -18.280
107 2HA GLY 16 1HA GLY 16 13.710 -0.436 -17.164
108 H GLU 17 H GLU 17 11.153 0.072 -19.567
109 HA GLU 17 HA GLU 17 12.127 2.423 -20.463
110 1HB GLU 17 1HB GLU 17 9.300 1.307 -20.482
111 2HB GLU 17 2HB GLU 17 9.705 2.795 -21.315
112 1HG GLU 17 1HG GLU 17 11.194 1.699 -22.821
113 2HG GLU 17 2HG GLU 17 11.358 0.293 -21.787
114 H LYS 18 H LYS 18 10.046 1.815 -17.648
115 HA LYS 18 HA LYS 18 10.526 4.482 -16.728
116 1HB LYS 18 2HB LYS 18 8.256 5.233 -16.591
117 2HB LYS 18 1HB LYS 18 8.594 4.814 -18.259
118 1HG LYS 18 1HG LYS 18 7.639 2.431 -17.563
119 2HG LYS 18 2HG LYS 18 6.912 3.313 -16.236
120 1HD LYS 18 1HD LYS 18 5.338 4.256 -17.587
121 2HD LYS 18 2HD LYS 18 6.530 4.731 -18.780
122 1HE LYS 18 1HE LYS 18 6.514 2.480 -19.777
123 2HE LYS 18 2HE LYS 18 5.470 1.879 -18.504
124 1HZ LYS 18 1HZ LYS 18 4.678 4.092 -20.256
125 2HZ LYS 18 2HZ LYS 18 4.360 2.531 -20.615
126 3HZ LYS 18 3HZ LYS 18 3.722 3.206 -19.272
127 H ASN 19 H ASN 19 8.368 4.404 -14.756
128 HA ASN 19 HA ASN 19 8.400 1.919 -13.473
129 1HB ASN 19 1HB ASN 19 9.716 2.722 -11.418
130 2HB ASN 19 2HB ASN 19 10.691 2.391 -12.837
131 2HD2 ASN 19 2HD2 ASN 19 11.970 3.856 -11.215
132 1HD2 ASN 19 1HD2 ASN 19 11.989 5.545 -11.597
133 H LEU 20 H LEU 20 6.507 1.968 -12.233
134 HA LEU 20 HA LEU 20 5.151 4.462 -11.925
135 1HB LEU 20 1HB LEU 20 4.505 1.641 -11.066
136 2HB LEU 20 2HB LEU 20 3.441 3.009 -10.805
137 HG LEU 20 HG LEU 20 4.270 1.760 -13.427
138 1HD1 LEU 20 1HD1 LEU 20 1.939 1.638 -11.708
139 2HD1 LEU 20 2HD1 LEU 20 1.511 2.198 -13.342
140 3HD1 LEU 20 3HD1 LEU 20 2.368 0.652 -13.127
141 1HD2 LEU 20 1HD2 LEU 20 2.978 4.457 -12.973
142 2HD2 LEU 20 2HD2 LEU 20 4.470 4.085 -13.869
143 3HD2 LEU 20 3HD2 LEU 20 2.893 3.570 -14.514
144 H THR 21 H THR 21 5.574 5.907 -10.353
145 HA THR 21 HA THR 21 6.612 4.844 -7.810
146 HB THR 21 HB THR 21 6.906 7.720 -8.717
147 HG1 THR 21 HG1 THR 21 8.893 6.808 -9.821
148 1HG2 THR 21 1HG2 THR 21 7.864 6.326 -6.525
149 2HG2 THR 21 2HG2 THR 21 9.191 6.100 -7.689
150 3HG2 THR 21 3HG2 THR 21 8.677 7.742 -7.234
151 H VAL 22 H VAL 22 5.094 4.666 -6.290
152 HA VAL 22 HA VAL 22 2.815 6.465 -6.423
153 HB VAL 22 HB VAL 22 3.450 3.994 -4.804
154 1HG1 VAL 22 1HG1 VAL 22 1.470 6.092 -4.331
155 2HG1 VAL 22 2HG1 VAL 22 0.725 4.489 -4.544
156 3HG1 VAL 22 3HG1 VAL 22 1.969 4.733 -3.295
157 1HG2 VAL 22 1HG2 VAL 22 2.844 3.899 -7.324
158 2HG2 VAL 22 2HG2 VAL 22 1.967 2.839 -6.194
159 3HG2 VAL 22 3HG2 VAL 22 1.203 4.332 -6.789
160 H VAL 23 H VAL 23 2.285 7.969 -4.810
161 HA VAL 23 HA VAL 23 4.500 8.532 -2.970
162 HB VAL 23 HB VAL 23 2.364 10.299 -4.175
163 1HG1 VAL 23 1HG1 VAL 23 4.205 10.711 -1.869
164 2HG1 VAL 23 2HG1 VAL 23 4.034 12.058 -3.019
165 3HG1 VAL 23 3HG1 VAL 23 2.598 11.403 -2.196
166 1HG2 VAL 23 1HG2 VAL 23 5.234 9.760 -4.773
167 2HG2 VAL 23 2HG2 VAL 23 3.894 10.190 -5.862
168 3HG2 VAL 23 3HG2 VAL 23 4.683 11.450 -4.883
169 H PHE 24 H PHE 24 4.148 8.570 -0.769
170 HA PHE 24 HA PHE 24 1.367 8.163 0.075
171 1HB PHE 24 1HB PHE 24 2.970 6.109 0.074
172 2HB PHE 24 2HB PHE 24 3.932 6.958 1.268
173 HD1 PHE 24 HD1 PHE 24 0.407 5.866 0.700
174 HD2 PHE 24 HD2 PHE 24 3.519 6.551 3.503
175 HE1 PHE 24 HE1 PHE 24 -1.034 4.928 2.529
176 HE2 PHE 24 HE2 PHE 24 2.078 5.613 5.332
177 HZ PHE 24 HZ PHE 24 -0.181 4.813 4.823
178 H ASN 25 H ASN 25 0.790 9.064 2.132
179 HA ASN 25 HA ASN 25 2.849 10.761 3.286
180 1HB ASN 25 1HB ASN 25 0.174 11.953 3.508
181 2HB ASN 25 2HB ASN 25 1.653 12.682 2.914
182 2HD2 ASN 25 2HD2 ASN 25 -1.388 11.499 2.139
183 1HD2 ASN 25 1HD2 ASN 25 -1.278 11.472 0.410
184 H HIS 26 H HIS 26 2.933 10.436 5.525
185 HA HIS 26 HA HIS 26 1.059 8.650 6.698
186 1HB HIS 26 1HB HIS 26 3.569 10.036 7.527
187 2HB HIS 26 2HB HIS 26 2.494 9.492 8.800
188 HD1 HIS 26 HD1 HIS 26 4.545 8.146 5.896
189 HD2 HIS 26 HD2 HIS 26 2.505 6.751 9.285
190 HE1 HIS 26 HE1 HIS 26 5.171 5.685 6.144
191 H SER 27 H SER 27 0.998 11.970 5.998
192 HA SER 27 HA SER 27 -0.507 12.625 8.370
193 1HB SER 27 1HB SER 27 -0.571 14.938 7.237
194 2HB SER 27 2HB SER 27 0.997 14.357 7.760
195 HG SER 27 HG SER 27 1.309 15.098 5.671
196 H THR 28 H THR 28 -1.320 10.759 5.975
197 HA THR 28 HA THR 28 -3.838 12.154 5.339
198 HB THR 28 HB THR 28 -2.241 10.058 3.774
199 HG1 THR 28 HG1 THR 28 -1.668 12.500 4.010
200 1HG2 THR 28 1HG2 THR 28 -5.033 10.942 3.581
201 2HG2 THR 28 2HG2 THR 28 -4.115 11.421 2.134
202 3HG2 THR 28 3HG2 THR 28 -4.185 9.710 2.617
203 H HIS 29 H HIS 29 -2.279 9.121 6.427
204 HA HIS 29 HA HIS 29 -4.951 8.066 6.946
205 1HB HIS 29 1HB HIS 29 -2.278 6.638 6.985
206 2HB HIS 29 2HB HIS 29 -3.854 5.896 7.174
207 HD1 HIS 29 HD1 HIS 29 -1.665 7.569 4.567
208 HD2 HIS 29 HD2 HIS 29 -5.233 5.376 4.799
209 HE1 HIS 29 HE1 HIS 29 -2.300 6.982 2.166
210 H LYS 30 H LYS 30 -3.498 10.257 8.478
211 HA LYS 30 HA LYS 30 -2.469 9.269 10.851
212 1HB LYS 30 2HB LYS 30 -2.777 11.486 11.707
213 2HB LYS 30 1HB LYS 30 -2.294 11.606 10.027
214 1HG LYS 30 2HG LYS 30 -4.086 13.122 10.110
215 2HG LYS 30 1HG LYS 30 -4.878 11.674 9.521
216 1HD LYS 30 1HD LYS 30 -6.288 11.763 11.292
217 2HD LYS 30 2HD LYS 30 -4.932 11.453 12.357
218 1HE LYS 30 1HE LYS 30 -5.245 14.275 11.369
219 2HE LYS 30 2HE LYS 30 -6.444 13.709 12.515
220 1HZ LYS 30 1HZ LYS 30 -4.453 12.930 13.843
221 2HZ LYS 30 2HZ LYS 30 -3.553 13.898 12.885
222 3HZ LYS 30 3HZ LYS 30 -4.742 14.536 13.804
223 H ASP 31 H ASP 31 -5.702 9.179 9.580
224 HA ASP 31 HA ASP 31 -6.893 9.001 12.175
225 1HB ASP 31 1HB ASP 31 -8.302 10.002 10.545
226 2HB ASP 31 2HB ASP 31 -7.866 8.835 9.312
227 H VAL 32 H VAL 32 -4.964 6.994 10.355
228 HA VAL 32 HA VAL 32 -6.454 4.579 11.124
229 HB VAL 32 HB VAL 32 -4.369 4.915 8.959
230 1HG1 VAL 32 1HG1 VAL 32 -4.499 2.647 9.931
231 2HG1 VAL 32 2HG1 VAL 32 -6.240 2.600 9.564
232 3HG1 VAL 32 3HG1 VAL 32 -5.054 2.684 8.240
233 1HG2 VAL 32 1HG2 VAL 32 -7.028 5.801 8.917
234 2HG2 VAL 32 2HG2 VAL 32 -5.951 5.563 7.520
235 3HG2 VAL 32 3HG2 VAL 32 -7.044 4.256 8.035
236 H LYS 33 H LYS 33 -5.529 3.226 12.603
237 HA LYS 33 HA LYS 33 -3.436 4.070 14.166
238 1HB LYS 33 1HB LYS 33 -4.401 1.232 13.698
239 2HB LYS 33 2HB LYS 33 -3.430 1.771 15.053
240 1HG LYS 33 1HG LYS 33 -5.372 3.547 15.397
241 2HG LYS 33 2HG LYS 33 -6.313 2.449 14.407
242 1HD LYS 33 1HD LYS 33 -5.561 0.570 16.022
243 2HD LYS 33 2HD LYS 33 -4.962 1.840 17.070
244 1HE LYS 33 1HE LYS 33 -7.812 1.969 16.038
245 2HE LYS 33 2HE LYS 33 -7.427 0.923 17.391
246 1HZ LYS 33 1HZ LYS 33 -6.472 2.855 18.500
247 2HZ LYS 33 2HZ LYS 33 -6.920 3.814 17.256
248 3HZ LYS 33 3HZ LYS 33 -8.056 3.072 18.164
249 H CYS 34 H CYS 34 -1.244 3.099 14.455
250 HA CYS 34 HA CYS 34 0.098 3.138 11.957
251 1HB CYS 34 1HB CYS 34 1.297 2.368 14.614
252 2HB CYS 34 2HB CYS 34 2.111 3.024 13.208
253 H ASP 35 H ASP 35 -0.799 0.688 14.450
254 HA ASP 35 HA ASP 35 0.626 -1.401 13.292
255 1HB ASP 35 1HB ASP 35 -0.947 -2.848 14.656
256 2HB ASP 35 2HB ASP 35 -0.139 -1.594 15.576
257 H ASP 36 H ASP 36 -2.071 0.379 12.201
258 HA ASP 36 HA ASP 36 -3.711 -1.617 11.200
259 1HB ASP 36 1HB ASP 36 -4.007 1.006 11.413
260 2HB ASP 36 2HB ASP 36 -3.301 1.049 9.810
261 H CYS 37 H CYS 37 -0.554 -0.457 10.294
262 HA CYS 37 HA CYS 37 -0.759 -1.936 7.778
263 1HB CYS 37 1HB CYS 37 0.616 0.736 8.194
264 2HB CYS 37 2HB CYS 37 0.869 -0.285 6.792
265 H HIS 38 H HIS 38 1.356 -0.479 10.343
266 HA HIS 38 HA HIS 38 3.505 -2.246 9.710
267 1HB HIS 38 1HB HIS 38 3.081 -0.376 12.058
268 2HB HIS 38 2HB HIS 38 4.574 -1.218 11.693
269 HD1 HIS 38 HD1 HIS 38 5.666 -0.579 9.240
270 HD2 HIS 38 HD2 HIS 38 2.831 2.070 10.835
271 HE1 HIS 38 HE1 HIS 38 5.967 1.627 7.992
272 H HIS 39 H HIS 39 2.585 -4.362 9.876
273 HA HIS 39 HA HIS 39 1.627 -5.082 12.529
274 1HB HIS 39 2HB HIS 39 0.582 -6.928 11.548
275 2HB HIS 39 1HB HIS 39 0.336 -5.622 10.407
276 HD1 HIS 39 HD1 HIS 39 1.590 -9.045 10.637
277 HD2 HIS 39 HD2 HIS 39 2.232 -5.753 8.118
278 HE1 HIS 39 HE1 HIS 39 2.671 -9.967 8.518
279 H GLN 40 H GLN 40 4.097 -4.574 13.033
280 HA GLN 40 HA GLN 40 5.416 -7.165 12.870
281 1HB GLN 40 1HB GLN 40 6.514 -4.442 12.182
282 2HB GLN 40 2HB GLN 40 7.596 -5.616 12.904
283 1HG GLN 40 1HG GLN 40 5.997 -5.936 10.327
284 2HG GLN 40 2HG GLN 40 7.740 -5.840 10.482
285 2HE2 GLN 40 2HE2 GLN 40 4.998 -7.830 10.462
286 1HE2 GLN 40 1HE2 GLN 40 5.732 -9.347 10.861
287 HA PRO 41 HA PRO 41 6.252 -6.770 17.168
288 1HB PRO 41 2HB PRO 41 9.135 -7.385 16.843
289 2HB PRO 41 1HB PRO 41 7.802 -8.397 17.488
290 1HG PRO 41 1HG PRO 41 9.101 -8.671 15.345
291 2HG PRO 41 2HG PRO 41 7.570 -9.550 15.026
292 1HD PRO 41 1HD PRO 41 8.500 -6.926 14.012
293 2HD PRO 41 2HD PRO 41 7.068 -7.876 13.510
294 H GLY 42 H GLY 42 7.035 -5.288 18.793
295 1HA GLY 42 2HA GLY 42 8.139 -3.486 19.609
296 2HA GLY 42 1HA GLY 42 7.516 -2.720 18.161
297 H ASP 43 H ASP 43 10.136 -5.155 18.856
298 HA ASP 43 HA ASP 43 12.294 -3.690 18.596
299 1HB ASP 43 1HB ASP 43 11.577 -6.464 17.984
300 2HB ASP 43 2HB ASP 43 12.860 -5.919 16.922
301 H LYS 44 H LYS 44 10.149 -4.817 15.927
302 HA LYS 44 HA LYS 44 11.577 -2.984 14.133
303 1HB LYS 44 1HB LYS 44 10.718 -5.832 13.643
304 2HB LYS 44 2HB LYS 44 10.864 -4.699 12.315
305 1HG LYS 44 1HG LYS 44 13.120 -5.053 14.324
306 2HG LYS 44 2HG LYS 44 12.956 -6.132 12.953
307 1HD LYS 44 1HD LYS 44 12.672 -3.567 11.821
308 2HD LYS 44 2HD LYS 44 13.920 -3.350 13.032
309 1HE LYS 44 1HE LYS 44 13.958 -5.582 10.945
310 2HE LYS 44 2HE LYS 44 14.785 -4.049 10.744
311 1HZ LYS 44 1HZ LYS 44 15.250 -5.729 13.095
312 2HZ LYS 44 2HZ LYS 44 16.091 -5.942 11.711
313 3HZ LYS 44 3HZ LYS 44 16.186 -4.524 12.514
314 H GLN 45 H GLN 45 9.372 -2.327 15.847
315 HA GLN 45 HA GLN 45 6.896 -2.650 15.009
316 1HB GLN 45 1HB GLN 45 7.635 -1.155 16.873
317 2HB GLN 45 2HB GLN 45 8.128 0.054 15.704
318 1HG GLN 45 1HG GLN 45 6.012 0.857 15.625
319 2HG GLN 45 2HG GLN 45 5.436 -0.691 15.039
320 2HE2 GLN 45 2HE2 GLN 45 3.719 0.639 16.483
321 1HE2 GLN 45 1HE2 GLN 45 3.532 0.016 18.088
322 H TYR 46 H TYR 46 9.202 -0.300 13.604
323 HA TYR 46 HA TYR 46 7.474 -0.170 11.176
324 1HB TYR 46 1HB TYR 46 9.444 1.937 12.087
325 2HB TYR 46 2HB TYR 46 8.165 2.082 10.870
326 HD1 TYR 46 HD1 TYR 46 5.744 2.020 11.624
327 HD2 TYR 46 HD2 TYR 46 9.028 2.414 14.365
328 HE1 TYR 46 HE1 TYR 46 4.194 2.884 13.356
329 HE2 TYR 46 HE2 TYR 46 7.478 3.277 16.098
330 HH TYR 46 HH TYR 46 5.332 4.095 16.489
331 H ALA 47 H ALA 47 8.495 -1.900 10.012
332 HA ALA 47 HA ALA 47 11.309 -1.329 9.379
333 1HB ALA 47 1HB ALA 47 10.222 -3.601 10.661
334 2HB ALA 47 3HB ALA 47 10.557 -4.107 8.988
335 3HB ALA 47 2HB ALA 47 11.860 -3.421 9.988
336 H GLY 48 H GLY 48 11.772 -2.843 7.221
337 1HA GLY 48 2HA GLY 48 11.531 -2.664 4.973
338 2HA GLY 48 1HA GLY 48 10.164 -1.591 5.199
339 H CYS 49 H CYS 49 8.628 -2.517 3.845
340 HA CYS 49 HA CYS 49 7.385 -4.879 4.806
341 1HB CYS 49 2HB CYS 49 6.796 -3.523 2.180
342 2HB CYS 49 1HB CYS 49 5.725 -4.496 3.169
343 H THR 50 H THR 50 9.708 -3.965 2.263
344 HA THR 50 HA THR 50 9.536 -6.603 1.037
345 HB THR 50 HB THR 50 11.216 -5.491 -0.548
346 HG1 THR 50 HG1 THR 50 11.826 -3.983 1.310
347 1HG2 THR 50 1HG2 THR 50 8.421 -4.939 -0.265
348 2HG2 THR 50 2HG2 THR 50 9.216 -3.370 -0.537
349 3HG2 THR 50 3HG2 THR 50 9.423 -4.689 -1.714
350 H THR 51 H THR 51 10.503 -6.095 3.888
351 HA THR 51 HA THR 51 13.315 -6.560 3.813
352 HB THR 51 HB THR 51 11.243 -6.967 6.034
353 HG1 THR 51 HG1 THR 51 11.686 -4.813 4.697
354 1HG2 THR 51 1HG2 THR 51 14.269 -6.777 5.927
355 2HG2 THR 51 2HG2 THR 51 13.406 -6.083 7.320
356 3HG2 THR 51 3HG2 THR 51 13.251 -7.817 6.951
357 H ASP 52 H ASP 52 14.436 -8.493 4.537
358 HA ASP 52 HA ASP 52 13.725 -10.675 3.084
359 1HB ASP 52 1HB ASP 52 15.960 -10.621 3.823
360 2HB ASP 52 2HB ASP 52 15.516 -10.208 5.467
361 H GLY 53 H GLY 53 12.896 -12.836 3.783
362 1HA GLY 53 2HA GLY 53 11.961 -13.460 6.320
363 2HA GLY 53 1HA GLY 53 11.414 -14.171 4.815
364 H CYS 54 H CYS 54 10.577 -11.398 3.781
365 HA CYS 54 HA CYS 54 8.025 -11.393 5.186
366 1HB CYS 54 1HB CYS 54 9.455 -8.814 4.486
367 2HB CYS 54 2HB CYS 54 7.947 -8.997 5.359
368 H HIS 55 H HIS 55 7.871 -8.733 3.316
369 HA HIS 55 HA HIS 55 6.897 -10.259 1.049
370 1HB HIS 55 1HB HIS 55 6.588 -7.293 1.536
371 2HB HIS 55 2HB HIS 55 5.648 -8.314 0.466
372 HD1 HIS 55 HD1 HIS 55 4.072 -10.164 1.718
373 HD2 HIS 55 HD2 HIS 55 5.575 -7.046 4.088
374 HE1 HIS 55 HE1 HIS 55 2.644 -10.121 3.832
375 H ASN 56 H ASN 56 9.598 -10.485 1.094
376 HA ASN 56 HA ASN 56 10.698 -8.319 -0.437
377 1HB ASN 56 1HB ASN 56 12.014 -9.510 1.375
378 2HB ASN 56 2HB ASN 56 11.952 -10.980 0.423
379 2HD2 ASN 56 2HD2 ASN 56 14.295 -9.678 1.262
380 1HD2 ASN 56 1HD2 ASN 56 15.179 -9.130 -0.124
381 H ILE 57 H ILE 57 8.946 -8.945 -2.187
382 HA ILE 57 HA ILE 57 10.182 -10.894 -3.988
383 HB ILE 57 HB ILE 57 7.225 -10.684 -3.406
384 1HG1 ILE 57 1HG1 ILE 57 8.846 -11.819 -1.695
385 2HG1 ILE 57 2HG1 ILE 57 7.340 -12.596 -2.141
386 1HG2 ILE 57 1HG2 ILE 57 8.782 -12.422 -5.337
387 2HG2 ILE 57 2HG2 ILE 57 7.079 -12.683 -4.890
388 3HG2 ILE 57 3HG2 ILE 57 7.560 -11.188 -5.727
389 1HD1 ILE 57 1HD1 ILE 57 10.018 -13.178 -3.486
390 2HD1 ILE 57 2HD1 ILE 57 9.314 -14.158 -2.177
391 3HD1 ILE 57 3HD1 ILE 57 8.486 -14.046 -3.749
392 H LEU 58 H LEU 58 10.954 -9.660 -5.620
393 HA LEU 58 HA LEU 58 9.347 -7.348 -6.416
394 1HB LEU 58 2HB LEU 58 12.222 -8.039 -7.036
395 2HB LEU 58 1HB LEU 58 11.385 -6.580 -7.528
396 HG LEU 58 HG LEU 58 12.105 -7.413 -4.708
397 1HD1 LEU 58 1HD1 LEU 58 13.090 -5.254 -6.574
398 2HD1 LEU 58 2HD1 LEU 58 13.344 -5.187 -4.814
399 3HD1 LEU 58 3HD1 LEU 58 14.017 -6.536 -5.760
400 1HD2 LEU 58 1HD2 LEU 58 10.013 -5.603 -5.650
401 2HD2 LEU 58 2HD2 LEU 58 10.310 -6.277 -4.029
402 3HD2 LEU 58 3HD2 LEU 58 11.177 -4.815 -4.558
403 H ASP 59 H ASP 59 8.675 -10.209 -7.010
404 HA ASP 59 HA ASP 59 8.984 -10.050 -9.906
405 1HB ASP 59 1HB ASP 59 9.484 -12.188 -8.059
406 2HB ASP 59 2HB ASP 59 8.064 -12.648 -8.976
407 H LYS 60 H LYS 60 7.023 -8.597 -9.858
408 HA LYS 60 HA LYS 60 4.629 -9.206 -8.676
409 1HB LYS 60 2HB LYS 60 3.646 -7.646 -10.213
410 2HB LYS 60 1HB LYS 60 5.237 -7.062 -9.768
411 1HG LYS 60 1HG LYS 60 5.318 -8.825 -12.135
412 2HG LYS 60 2HG LYS 60 4.283 -7.432 -12.382
413 1HD LYS 60 1HD LYS 60 6.062 -6.023 -12.526
414 2HD LYS 60 2HD LYS 60 6.752 -6.630 -11.033
415 1HE LYS 60 1HE LYS 60 7.633 -8.636 -12.324
416 2HE LYS 60 2HE LYS 60 7.051 -7.892 -13.800
417 1HZ LYS 60 1HZ LYS 60 8.420 -5.903 -12.955
418 2HZ LYS 60 2HZ LYS 60 9.204 -7.016 -12.053
419 3HZ LYS 60 3HZ LYS 60 9.185 -7.150 -13.680
420 H ALA 61 H ALA 61 2.779 -10.394 -9.236
421 HA ALA 61 HA ALA 61 1.531 -11.880 -10.338
422 1HB ALA 61 1HB ALA 61 3.563 -12.287 -12.517
423 2HB ALA 61 3HB ALA 61 1.787 -12.239 -12.614
424 3HB ALA 61 2HB ALA 61 2.708 -10.729 -12.423
425 H ASP 62 H ASP 62 3.210 -12.538 -8.198
426 HA ASP 62 HA ASP 62 4.364 -15.069 -9.044
427 1HB ASP 62 1HB ASP 62 5.717 -13.314 -7.709
428 2HB ASP 62 2HB ASP 62 4.679 -13.682 -6.346
429 H LYS 63 H LYS 63 4.215 -16.710 -6.930
430 HA LYS 63 HA LYS 63 1.439 -16.570 -5.980
431 1HB LYS 63 1HB LYS 63 1.866 -18.249 -7.838
432 2HB LYS 63 2HB LYS 63 2.897 -19.118 -6.720
433 1HG LYS 63 1HG LYS 63 1.115 -19.736 -5.325
434 2HG LYS 63 2HG LYS 63 0.138 -18.353 -5.774
435 1HD LYS 63 1HD LYS 63 -0.705 -19.378 -7.677
436 2HD LYS 63 2HD LYS 63 0.772 -20.266 -7.990
437 1HE LYS 63 1HE LYS 63 -0.479 -22.052 -7.247
438 2HE LYS 63 2HE LYS 63 0.044 -21.489 -5.672
439 1HZ LYS 63 1HZ LYS 63 -2.162 -19.998 -6.336
440 2HZ LYS 63 2HZ LYS 63 -2.542 -21.537 -6.729
441 3HZ LYS 63 3HZ LYS 63 -2.069 -21.176 -5.209
442 H SER 64 H SER 64 2.145 -15.535 -4.034
443 HA SER 64 HA SER 64 2.777 -17.336 -2.027
444 1HB SER 64 1HB SER 64 5.081 -16.585 -3.394
445 2HB SER 64 2HB SER 64 5.054 -15.441 -2.067
446 HG SER 64 HG SER 64 4.799 -18.311 -1.755
447 H VAL 65 H VAL 65 2.812 -16.238 0.128
448 HA VAL 65 HA VAL 65 1.237 -13.835 0.020
449 HB VAL 65 HB VAL 65 0.607 -15.560 1.544
450 1HG1 VAL 65 1HG1 VAL 65 3.481 -15.425 2.449
451 2HG1 VAL 65 2HG1 VAL 65 2.210 -16.046 3.529
452 3HG1 VAL 65 3HG1 VAL 65 2.515 -16.840 1.965
453 1HG2 VAL 65 1HG2 VAL 65 0.936 -12.920 2.260
454 2HG2 VAL 65 2HG2 VAL 65 0.023 -14.137 3.184
455 3HG2 VAL 65 3HG2 VAL 65 1.715 -13.782 3.609
456 H ASN 66 H ASN 66 4.431 -14.332 -0.475
457 HA ASN 66 HA ASN 66 5.311 -12.218 1.287
458 1HB ASN 66 2HB ASN 66 6.910 -13.889 -0.723
459 2HB ASN 66 1HB ASN 66 7.591 -12.826 0.493
460 2HD2 ASN 66 2HD2 ASN 66 6.698 -13.256 2.776
461 1HD2 ASN 66 1HD2 ASN 66 6.681 -14.907 3.299
462 H SER 67 H SER 67 3.599 -12.262 -1.451
463 HA SER 67 HA SER 67 5.248 -10.798 -3.221
464 1HB SER 67 1HB SER 67 2.817 -10.351 -4.248
465 2HB SER 67 2HB SER 67 3.612 -11.904 -4.417
466 HG SER 67 HG SER 67 1.321 -11.932 -3.632
467 H TRP 68 H TRP 68 5.417 -8.557 -3.486
468 HA TRP 68 HA TRP 68 4.109 -6.970 -1.416
469 1HB TRP 68 1HB TRP 68 6.388 -6.577 -1.370
470 2HB TRP 68 2HB TRP 68 6.554 -6.641 -3.113
471 HD1 TRP 68 HD1 TRP 68 6.751 -4.297 -4.256
472 HE1 TRP 68 HE1 TRP 68 6.255 -1.771 -3.677
473 HE3 TRP 68 HE3 TRP 68 4.530 -5.213 0.226
474 HZ2 TRP 68 HZ2 TRP 68 5.018 -0.468 -1.460
475 HZ3 TRP 68 HZ3 TRP 68 3.706 -3.258 1.534
476 HH2 TRP 68 HH2 TRP 68 3.921 -0.950 0.759
477 H TYR 69 H TYR 69 3.063 -8.187 -4.076
478 HA TYR 69 HA TYR 69 1.979 -5.641 -5.190
479 1HB TYR 69 1HB TYR 69 3.430 -6.724 -6.798
480 2HB TYR 69 2HB TYR 69 2.619 -8.279 -6.547
481 HD1 TYR 69 HD1 TYR 69 0.139 -8.458 -7.179
482 HD2 TYR 69 HD2 TYR 69 2.667 -5.220 -8.434
483 HE1 TYR 69 HE1 TYR 69 -1.451 -7.924 -9.005
484 HE2 TYR 69 HE2 TYR 69 1.077 -4.686 -10.260
485 HH TYR 69 HH TYR 69 -1.969 -5.558 -10.442
486 H LYS 70 H LYS 70 1.283 -8.454 -3.365
487 HA LYS 70 HA LYS 70 -1.467 -8.513 -4.364
488 1HB LYS 70 1HB LYS 70 -0.088 -10.635 -4.202
489 2HB LYS 70 2HB LYS 70 -0.130 -10.452 -2.460
490 1HG LYS 70 1HG LYS 70 -2.760 -10.199 -2.853
491 2HG LYS 70 2HG LYS 70 -2.413 -11.019 -4.362
492 1HD LYS 70 1HD LYS 70 -1.416 -12.109 -1.700
493 2HD LYS 70 2HD LYS 70 -3.020 -12.486 -2.297
494 1HE LYS 70 1HE LYS 70 -0.393 -13.058 -3.753
495 2HE LYS 70 2HE LYS 70 -1.398 -14.248 -2.949
496 1HZ LYS 70 1HZ LYS 70 -3.033 -12.872 -4.677
497 2HZ LYS 70 2HZ LYS 70 -1.674 -13.199 -5.521
498 3HZ LYS 70 3HZ LYS 70 -2.513 -14.413 -4.822
499 H VAL 71 H VAL 71 0.551 -8.059 -1.410
500 HA VAL 71 HA VAL 71 -1.627 -7.636 0.313
501 HB VAL 71 HB VAL 71 0.109 -6.638 1.782
502 1HG1 VAL 71 1HG1 VAL 71 -0.031 -9.321 0.742
503 2HG1 VAL 71 2HG1 VAL 71 1.652 -8.932 1.174
504 3HG1 VAL 71 3HG1 VAL 71 0.361 -8.769 2.388
505 1HG2 VAL 71 1HG2 VAL 71 1.438 -5.651 -0.145
506 2HG2 VAL 71 2HG2 VAL 71 2.388 -6.456 1.127
507 3HG2 VAL 71 3HG2 VAL 71 2.086 -7.286 -0.419
508 H VAL 72 H VAL 72 -0.529 -5.849 -2.355
509 HA VAL 72 HA VAL 72 -1.410 -3.316 -1.183
510 HB VAL 72 HB VAL 72 0.162 -4.039 -3.656
511 1HG1 VAL 72 1HG1 VAL 72 -1.472 -2.174 -4.088
512 2HG1 VAL 72 2HG1 VAL 72 -0.654 -1.242 -2.811
513 3HG1 VAL 72 3HG1 VAL 72 0.240 -1.722 -4.274
514 1HG2 VAL 72 1HG2 VAL 72 0.823 -3.194 -0.942
515 2HG2 VAL 72 2HG2 VAL 72 1.868 -3.863 -2.218
516 3HG2 VAL 72 3HG2 VAL 72 1.526 -2.117 -2.172
517 H HIS 73 H HIS 73 -1.806 -5.302 -4.206
518 HA HIS 73 HA HIS 73 -4.327 -3.947 -4.654
519 1HB HIS 73 1HB HIS 73 -2.920 -6.004 -6.375
520 2HB HIS 73 2HB HIS 73 -4.281 -5.002 -6.838
521 HD1 HIS 73 HD1 HIS 73 -0.560 -4.838 -6.189
522 HD2 HIS 73 HD2 HIS 73 -3.648 -2.367 -7.590
523 HE1 HIS 73 HE1 HIS 73 0.569 -2.775 -7.180
524 H ASP 74 H ASP 74 -3.839 -5.864 -2.362
525 HA ASP 74 HA ASP 74 -5.113 -8.267 -3.033
526 1HB ASP 74 1HB ASP 74 -3.916 -7.018 -0.711
527 2HB ASP 74 2HB ASP 74 -5.485 -7.643 -0.244
528 H ALA 75 H ALA 75 -7.332 -8.626 -3.266
529 HA ALA 75 HA ALA 75 -9.117 -6.543 -2.205
530 1HB ALA 75 1HB ALA 75 -8.787 -7.650 -4.838
531 2HB ALA 75 3HB ALA 75 -10.391 -8.118 -4.222
532 3HB ALA 75 2HB ALA 75 -9.931 -6.400 -4.292
533 H LYS 76 H LYS 76 -7.872 -9.365 -1.284
534 HA LYS 76 HA LYS 76 -10.357 -10.171 -0.022
535 1HB LYS 76 1HB LYS 76 -9.986 -11.472 -2.227
536 2HB LYS 76 2HB LYS 76 -8.676 -12.275 -1.384
537 1HG LYS 76 1HG LYS 76 -10.450 -12.691 0.516
538 2HG LYS 76 2HG LYS 76 -11.638 -12.302 -0.711
539 1HD LYS 76 1HD LYS 76 -11.449 -14.371 -1.618
540 2HD LYS 76 2HD LYS 76 -9.727 -14.147 -1.860
541 1HE LYS 76 1HE LYS 76 -9.416 -14.743 0.627
542 2HE LYS 76 2HE LYS 76 -11.107 -15.201 0.650
543 1HZ LYS 76 1HZ LYS 76 -9.608 -16.318 -1.517
544 2HZ LYS 76 2HZ LYS 76 -9.127 -16.824 -0.041
545 3HZ LYS 76 3HZ LYS 76 -10.677 -17.034 -0.512
546 H GLY 77 H GLY 77 -9.344 -9.176 1.831
547 1HA GLY 77 2HA GLY 77 -7.264 -9.056 3.141
548 2HA GLY 77 1HA GLY 77 -7.095 -10.782 2.894
549 H GLY 78 H GLY 78 -7.143 -11.239 5.168
550 1HA GLY 78 2HA GLY 78 -8.843 -12.318 6.567
551 2HA GLY 78 1HA GLY 78 -9.813 -10.869 6.393
552 H ALA 79 H ALA 79 -6.547 -11.981 7.512
553 HA ALA 79 HA ALA 79 -6.636 -11.080 10.032
554 1HB ALA 79 1HB ALA 79 -4.295 -11.282 10.037
555 2HB ALA 79 3HB ALA 79 -4.142 -10.670 8.372
556 3HB ALA 79 2HB ALA 79 -4.781 -12.305 8.664
557 H LYS 80 H LYS 80 -5.897 -9.127 7.091
558 HA LYS 80 HA LYS 80 -6.782 -6.775 8.462
559 1HB LYS 80 1HB LYS 80 -4.478 -5.657 7.741
560 2HB LYS 80 2HB LYS 80 -4.724 -6.359 9.327
561 1HG LYS 80 1HG LYS 80 -3.754 -8.531 8.485
562 2HG LYS 80 2HG LYS 80 -3.449 -7.771 6.936
563 1HD LYS 80 2HD LYS 80 -2.231 -6.996 9.624
564 2HD LYS 80 1HD LYS 80 -1.394 -7.701 8.256
565 1HE LYS 80 1HE LYS 80 -2.084 -5.622 6.903
566 2HE LYS 80 2HE LYS 80 -2.637 -4.919 8.410
567 1HZ LYS 80 1HZ LYS 80 -0.004 -6.015 8.545
568 2HZ LYS 80 2HZ LYS 80 -0.141 -4.773 7.494
569 3HZ LYS 80 3HZ LYS 80 -0.557 -4.567 9.059
570 HA PRO 81 HA PRO 81 -7.774 -5.703 4.333
571 1HB PRO 81 1HB PRO 81 -7.959 -2.980 4.514
572 2HB PRO 81 2HB PRO 81 -9.072 -4.076 5.396
573 1HG PRO 81 1HG PRO 81 -6.792 -2.672 6.256
574 2HG PRO 81 2HG PRO 81 -8.265 -2.852 7.265
575 1HD PRO 81 1HD PRO 81 -5.943 -4.314 7.667
576 2HD PRO 81 2HD PRO 81 -7.569 -4.971 8.025
577 H THR 82 H THR 82 -7.049 -3.627 2.676
578 HA THR 82 HA THR 82 -4.133 -3.441 2.814
579 HB THR 82 HB THR 82 -4.100 -4.137 0.351
580 HG1 THR 82 HG1 THR 82 -6.222 -5.468 -0.003
581 1HG2 THR 82 1HG2 THR 82 -4.320 -5.827 2.657
582 2HG2 THR 82 2HG2 THR 82 -5.361 -6.541 1.401
583 3HG2 THR 82 3HG2 THR 82 -3.635 -6.254 1.070
584 H CYS 83 H CYS 83 -3.767 -2.236 0.289
585 HA CYS 83 HA CYS 83 -4.702 0.369 0.959
586 1HB CYS 83 1HB CYS 83 -3.300 -0.361 -1.600
587 2HB CYS 83 2HB CYS 83 -3.288 1.164 -0.737
588 H ILE 84 H ILE 84 -6.092 -2.312 -0.540
589 HA ILE 84 HA ILE 84 -7.697 -0.626 -2.330
590 HB ILE 84 HB ILE 84 -6.773 -3.465 -2.466
591 1HG1 ILE 84 1HG1 ILE 84 -5.550 -1.644 -3.630
592 2HG1 ILE 84 2HG1 ILE 84 -6.162 -2.881 -4.709
593 1HG2 ILE 84 1HG2 ILE 84 -9.447 -2.476 -3.244
594 2HG2 ILE 84 2HG2 ILE 84 -8.572 -3.396 -4.493
595 3HG2 ILE 84 3HG2 ILE 84 -8.879 -4.128 -2.899
596 1HD1 ILE 84 1HD1 ILE 84 -8.224 -1.375 -5.067
597 2HD1 ILE 84 2HD1 ILE 84 -7.301 -0.099 -4.237
598 3HD1 ILE 84 3HD1 ILE 84 -6.690 -0.792 -5.759
599 H SER 85 H SER 85 -7.753 -3.232 0.164
600 HA SER 85 HA SER 85 -10.447 -3.597 0.268
601 1HB SER 85 1HB SER 85 -8.322 -4.600 1.624
602 2HB SER 85 2HB SER 85 -8.953 -3.542 2.870
603 HG SER 85 HG SER 85 -10.811 -5.216 1.496
604 H CYS 86 H CYS 86 -8.461 -1.407 2.404
605 HA CYS 86 HA CYS 86 -10.641 -0.211 3.626
606 1HB CYS 86 1HB CYS 86 -8.134 -0.159 4.268
607 2HB CYS 86 2HB CYS 86 -8.010 1.204 3.172
608 H HIS 87 H HIS 87 -8.504 0.991 0.926
609 HA HIS 87 HA HIS 87 -9.819 3.285 0.350
610 1HB HIS 87 1HB HIS 87 -8.271 1.323 -1.312
611 2HB HIS 87 2HB HIS 87 -9.059 2.674 -2.101
612 HD1 HIS 87 HD1 HIS 87 -6.891 3.913 -2.710
613 HD2 HIS 87 HD2 HIS 87 -7.287 3.151 1.395
614 HE1 HIS 87 HE1 HIS 87 -5.060 5.261 -1.553
615 H LYS 88 H LYS 88 -10.715 -0.074 -0.526
616 HA LYS 88 HA LYS 88 -12.725 0.586 -2.350
617 1HB LYS 88 1HB LYS 88 -11.930 -1.808 -0.764
618 2HB LYS 88 2HB LYS 88 -13.563 -1.785 -1.397
619 1HG LYS 88 1HG LYS 88 -11.163 -1.134 -3.155
620 2HG LYS 88 2HG LYS 88 -11.704 -2.783 -2.915
621 1HD LYS 88 1HD LYS 88 -13.968 -1.036 -3.557
622 2HD LYS 88 2HD LYS 88 -12.723 -0.908 -4.783
623 1HE LYS 88 1HE LYS 88 -13.408 -3.680 -3.840
624 2HE LYS 88 2HE LYS 88 -14.612 -2.859 -4.813
625 1HZ LYS 88 1HZ LYS 88 -12.446 -2.349 -6.211
626 2HZ LYS 88 2HZ LYS 88 -11.991 -3.776 -5.561
627 3HZ LYS 88 3HZ LYS 88 -13.357 -3.683 -6.451
628 H ASP 89 H ASP 89 -12.789 0.030 1.225
629 HA ASP 89 HA ASP 89 -15.480 0.223 1.562
630 1HB ASP 89 1HB ASP 89 -13.420 -0.154 3.230
631 2HB ASP 89 2HB ASP 89 -13.608 1.563 3.526
632 H LYS 90 H LYS 90 -12.935 2.766 1.280
633 HA LYS 90 HA LYS 90 -14.552 4.943 1.984
634 1HB LYS 90 1HB LYS 90 -11.891 4.499 0.765
635 2HB LYS 90 2HB LYS 90 -12.653 6.021 0.351
636 1HG LYS 90 1HG LYS 90 -12.166 4.959 3.174
637 2HG LYS 90 2HG LYS 90 -11.306 6.277 2.403
638 1HD LYS 90 1HD LYS 90 -13.867 7.186 2.108
639 2HD LYS 90 2HD LYS 90 -14.069 6.231 3.563
640 1HE LYS 90 1HE LYS 90 -12.163 7.458 4.632
641 2HE LYS 90 2HE LYS 90 -11.964 8.414 3.177
642 1HZ LYS 90 1HZ LYS 90 -14.509 8.816 3.629
643 2HZ LYS 90 2HZ LYS 90 -14.041 8.548 5.171
644 3HZ LYS 90 3HZ LYS 90 -13.349 9.747 4.304
645 H ALA 91 H ALA 91 -13.894 3.268 -1.131
646 HA ALA 91 HA ALA 91 -15.676 5.130 -2.483
647 1HB ALA 91 1HB ALA 91 -14.334 2.764 -3.780
648 2HB ALA 91 3HB ALA 91 -14.704 4.368 -4.457
649 3HB ALA 91 2HB ALA 91 -13.357 4.175 -3.309
650 H GLY 92 H GLY 92 -16.492 3.084 -0.338
651 1HA GLY 92 2HA GLY 92 -17.940 1.328 -0.091
652 2HA GLY 92 1HA GLY 92 -18.035 1.134 -1.830
653 H ASP 93 H ASP 93 -18.954 3.407 -2.908
654 HA ASP 93 HA ASP 93 -21.589 3.399 -2.486
655 1HB ASP 93 1HB ASP 93 -21.876 5.668 -1.245
656 2HB ASP 93 2HB ASP 93 -21.544 4.245 -0.278
657 H ASP 94 H ASP 94 -18.985 5.960 -2.520
658 HA ASP 94 HA ASP 94 -20.294 7.366 -4.601
659 1HB ASP 94 1HB ASP 94 -18.933 8.552 -2.931
660 2HB ASP 94 2HB ASP 94 -17.519 7.605 -3.352
661 H LYS 95 H LYS 95 -20.073 6.889 -6.794
662 HA LYS 95 HA LYS 95 -18.319 4.817 -7.616
663 1HB LYS 95 1HB LYS 95 -20.190 6.690 -9.077
664 2HB LYS 95 2HB LYS 95 -19.197 5.516 -9.916
665 1HG LYS 95 1HG LYS 95 -20.192 3.693 -8.479
666 2HG LYS 95 2HG LYS 95 -21.231 4.886 -7.725
667 1HD LYS 95 1HD LYS 95 -22.649 4.081 -9.400
668 2HD LYS 95 2HD LYS 95 -21.940 5.462 -10.214
669 1HE LYS 95 1HE LYS 95 -21.332 4.009 -11.859
670 2HE LYS 95 2HE LYS 95 -20.090 3.443 -10.760
671 1HZ LYS 95 1HZ LYS 95 -22.782 2.353 -10.544
672 2HZ LYS 95 2HZ LYS 95 -21.785 1.800 -11.714
673 3HZ LYS 95 3HZ LYS 95 -21.357 1.663 -10.144
674 H GLU 96 H GLU 96 -18.299 8.400 -7.727
675 HA GLU 96 HA GLU 96 -16.122 8.579 -9.460
676 1HB GLU 96 1HB GLU 96 -17.122 10.545 -7.353
677 2HB GLU 96 2HB GLU 96 -15.980 10.939 -8.623
678 1HG GLU 96 1HG GLU 96 -17.597 10.724 -10.337
679 2HG GLU 96 2HG GLU 96 -18.633 9.690 -9.374
680 H LEU 97 H LEU 97 -16.438 7.908 -6.011
681 HA LEU 97 HA LEU 97 -13.741 8.612 -5.379
682 1HB LEU 97 1HB LEU 97 -15.852 8.544 -3.878
683 2HB LEU 97 2HB LEU 97 -15.520 6.829 -3.744
684 HG LEU 97 HG LEU 97 -14.567 7.853 -1.841
685 1HD1 LEU 97 1HD1 LEU 97 -13.166 6.162 -3.166
686 2HD1 LEU 97 2HD1 LEU 97 -12.164 7.556 -3.638
687 3HD1 LEU 97 3HD1 LEU 97 -12.343 7.129 -1.919
688 1HD2 LEU 97 1HD2 LEU 97 -13.719 9.969 -3.757
689 2HD2 LEU 97 2HD2 LEU 97 -14.378 10.101 -2.109
690 3HD2 LEU 97 3HD2 LEU 97 -12.671 9.657 -2.353
691 H LYS 98 H LYS 98 -15.362 5.929 -6.887
692 HA LYS 98 HA LYS 98 -13.279 4.055 -6.171
693 1HB LYS 98 1HB LYS 98 -15.726 3.454 -6.345
694 2HB LYS 98 2HB LYS 98 -15.605 3.686 -8.077
695 1HG LYS 98 1HG LYS 98 -14.687 1.629 -8.337
696 2HG LYS 98 2HG LYS 98 -13.388 2.028 -7.231
697 1HD LYS 98 2HD LYS 98 -14.522 0.123 -6.285
698 2HD LYS 98 1HD LYS 98 -14.968 1.501 -5.299
699 1HE LYS 98 1HE LYS 98 -17.027 1.701 -6.952
700 2HE LYS 98 2HE LYS 98 -16.642 0.042 -7.366
701 1HZ LYS 98 1HZ LYS 98 -16.687 0.548 -4.557
702 2HZ LYS 98 2HZ LYS 98 -18.130 0.782 -5.284
703 3HZ LYS 98 3HZ LYS 98 -17.378 -0.662 -5.409
704 H LYS 99 H LYS 99 -12.724 6.627 -7.687
705 HA LYS 99 HA LYS 99 -11.235 5.328 -9.821
706 1HB LYS 99 1HB LYS 99 -13.405 7.346 -10.216
707 2HB LYS 99 2HB LYS 99 -11.966 7.492 -11.205
708 1HG LYS 99 1HG LYS 99 -13.069 4.723 -10.954
709 2HG LYS 99 2HG LYS 99 -14.085 5.859 -11.819
710 1HD LYS 99 1HD LYS 99 -12.472 6.234 -13.508
711 2HD LYS 99 2HD LYS 99 -11.137 5.726 -12.493
712 1HE LYS 99 1HE LYS 99 -13.160 3.597 -12.939
713 2HE LYS 99 2HE LYS 99 -12.384 4.143 -14.412
714 1HZ LYS 99 1HZ LYS 99 -10.565 3.770 -12.252
715 2HZ LYS 99 2HZ LYS 99 -11.339 2.396 -12.678
716 3HZ LYS 99 3HZ LYS 99 -10.479 3.227 -13.790
717 H LYS 100 H LYS 100 -10.179 5.994 -7.388
718 HA LYS 100 HA LYS 100 -8.221 7.881 -8.138
719 1HB LYS 100 1HB LYS 100 -8.845 9.364 -6.022
720 2HB LYS 100 2HB LYS 100 -9.453 9.719 -7.626
721 1HG LYS 100 1HG LYS 100 -11.490 8.236 -7.035
722 2HG LYS 100 2HG LYS 100 -10.907 8.254 -5.383
723 1HD LYS 100 1HD LYS 100 -11.314 10.849 -6.914
724 2HD LYS 100 2HD LYS 100 -12.659 10.063 -6.112
725 1HE LYS 100 1HE LYS 100 -11.355 10.099 -3.951
726 2HE LYS 100 2HE LYS 100 -10.061 10.953 -4.768
727 1HZ LYS 100 1HZ LYS 100 -11.948 12.557 -5.402
728 2HZ LYS 100 2HZ LYS 100 -12.740 11.895 -4.136
729 3HZ LYS 100 3HZ LYS 100 -11.304 12.637 -3.903
730 H LEU 101 H LEU 101 -9.951 6.204 -5.446
731 HA LEU 101 HA LEU 101 -7.406 5.810 -4.103
732 1HB LEU 101 2HB LEU 101 -10.204 5.015 -3.286
733 2HB LEU 101 1HB LEU 101 -8.763 4.907 -2.295
734 HG LEU 101 HG LEU 101 -10.239 7.376 -3.199
735 1HD1 LEU 101 1HD1 LEU 101 -10.722 5.977 -1.040
736 2HD1 LEU 101 2HD1 LEU 101 -9.281 6.813 -0.414
737 3HD1 LEU 101 3HD1 LEU 101 -10.684 7.755 -0.972
738 1HD2 LEU 101 1HD2 LEU 101 -7.355 7.101 -2.562
739 2HD2 LEU 101 2HD2 LEU 101 -8.210 8.301 -3.561
740 3HD2 LEU 101 3HD2 LEU 101 -8.218 8.452 -1.788
741 H THR 102 H THR 102 -9.796 4.121 -6.108
742 HA THR 102 HA THR 102 -8.088 1.727 -5.932
743 HB THR 102 HB THR 102 -10.101 0.374 -6.030
744 HG1 THR 102 HG1 THR 102 -11.486 1.483 -7.410
745 1HG2 THR 102 1HG2 THR 102 -9.746 2.229 -3.910
746 2HG2 THR 102 2HG2 THR 102 -11.464 2.363 -4.357
747 3HG2 THR 102 3HG2 THR 102 -10.787 0.785 -3.886
748 H GLY 103 H GLY 103 -8.835 4.340 -7.791
749 1HA GLY 103 2HA GLY 103 -8.607 4.792 -9.980
750 2HA GLY 103 1HA GLY 103 -9.526 3.332 -10.288
751 H CYS 104 H CYS 104 -8.509 1.871 -11.579
752 HA CYS 104 HA CYS 104 -5.954 0.920 -11.025
753 1HB CYS 104 1HB CYS 104 -7.975 0.557 -13.149
754 2HB CYS 104 2HB CYS 104 -6.322 0.225 -13.629
755 H LYS 105 H LYS 105 -7.235 3.215 -13.533
756 HA LYS 105 HA LYS 105 -4.484 4.199 -13.834
757 1HB LYS 105 2HB LYS 105 -4.903 4.579 -16.189
758 2HB LYS 105 1HB LYS 105 -5.158 2.889 -15.801
759 1HG LYS 105 1HG LYS 105 -7.385 2.977 -16.322
760 2HG LYS 105 2HG LYS 105 -7.616 4.502 -15.490
761 1HD LYS 105 1HD LYS 105 -6.287 4.242 -18.228
762 2HD LYS 105 2HD LYS 105 -7.983 4.620 -17.998
763 1HE LYS 105 1HE LYS 105 -5.627 6.283 -16.983
764 2HE LYS 105 2HE LYS 105 -6.660 6.690 -18.339
765 1HZ LYS 105 1HZ LYS 105 -8.477 6.377 -16.493
766 2HZ LYS 105 2HZ LYS 105 -7.240 6.799 -15.514
767 3HZ LYS 105 3HZ LYS 105 -7.711 7.802 -16.714
768 H GLY 106 H GLY 106 -4.197 6.416 -13.732
769 1HA GLY 106 2HA GLY 106 -6.366 8.248 -14.019
770 2HA GLY 106 1HA GLY 106 -4.731 8.598 -13.495
771 H SER 107 H SER 107 -4.569 6.777 -11.249
772 HA SER 107 HA SER 107 -6.662 7.876 -9.544
773 1HB SER 107 1HB SER 107 -6.046 5.962 -7.991
774 2HB SER 107 2HB SER 107 -6.767 5.476 -9.512
775 HG SER 107 HG SER 107 -4.904 4.180 -9.018
776 H ALA 108 H ALA 108 -5.721 7.883 -7.067
777 HA ALA 108 HA ALA 108 -3.639 9.824 -7.133
778 1HB ALA 108 1HB ALA 108 -4.127 10.096 -4.837
779 2HB ALA 108 3HB ALA 108 -5.687 9.632 -5.557
780 3HB ALA 108 2HB ALA 108 -4.722 8.426 -4.674
781 H CYS 109 H CYS 109 -3.616 6.475 -7.438
782 HA CYS 109 HA CYS 109 -1.107 6.223 -5.965
783 1HB CYS 109 1HB CYS 109 -3.054 4.144 -7.001
784 2HB CYS 109 2HB CYS 109 -1.462 3.739 -6.389
785 H HIS 110 H HIS 110 -2.738 5.651 -9.149
786 HA HIS 110 HA HIS 110 -0.065 5.633 -10.353
787 1HB HIS 110 1HB HIS 110 -2.572 4.202 -11.281
788 2HB HIS 110 2HB HIS 110 -1.060 4.258 -12.166
789 HD1 HIS 110 HD1 HIS 110 1.041 3.576 -10.122
790 HD2 HIS 110 HD2 HIS 110 -2.718 1.715 -10.183
791 HE1 HIS 110 HE1 HIS 110 1.324 1.352 -8.903
792 HA PRO 111 HA PRO 111 -2.138 9.302 -12.042
793 1HB PRO 111 1HB PRO 111 -0.319 11.162 -11.313
794 2HB PRO 111 2HB PRO 111 -1.420 10.432 -10.100
795 1HG PRO 111 2HG PRO 111 1.218 9.767 -11.003
796 2HG PRO 111 1HG PRO 111 1.095 9.764 -9.214
797 1HD PRO 111 1HD PRO 111 1.127 7.435 -10.581
798 2HD PRO 111 2HD PRO 111 -0.036 7.647 -9.237
799 H SER 112 H SER 112 -1.459 7.847 -14.036
800 HA SER 112 HA SER 112 0.678 9.316 -15.344
801 1HB SER 112 1HB SER 112 1.028 6.710 -14.462
802 2HB SER 112 2HB SER 112 0.494 6.454 -16.111
803 HG SER 112 HG SER 112 2.466 8.462 -15.720
No H/Q in entry = 803
Start of MODEL 14
1 H1 VAL 1 H1 VAL 1 6.134 7.213 15.570
2 H2 VAL 1 H2 VAL 1 7.040 6.105 14.737
3 H3 VAL 1 H3 VAL 1 6.313 5.676 16.162
4 HA VAL 1 HA VAL 1 7.645 7.093 17.406
5 HB VAL 1 HB VAL 1 9.446 5.740 17.439
6 1HG1 VAL 1 1HG1 VAL 1 7.340 4.361 16.952
7 2HG1 VAL 1 2HG1 VAL 1 7.998 4.151 15.311
8 3HG1 VAL 1 3HG1 VAL 1 8.911 3.557 16.719
9 1HG2 VAL 1 1HG2 VAL 1 9.594 6.234 14.478
10 2HG2 VAL 1 2HG2 VAL 1 10.812 6.524 15.743
11 3HG2 VAL 1 3HG2 VAL 1 10.482 4.865 15.189
12 H ASP 2 H ASP 2 7.383 7.815 14.055
13 HA ASP 2 HA ASP 2 8.220 10.395 14.384
14 1HB ASP 2 1HB ASP 2 10.484 8.982 14.459
15 2HB ASP 2 2HB ASP 2 10.284 8.934 12.719
16 H VAL 3 H VAL 3 6.060 10.056 13.182
17 HA VAL 3 HA VAL 3 5.852 8.862 10.712
18 HB VAL 3 HB VAL 3 4.261 10.329 12.447
19 1HG1 VAL 3 1HG1 VAL 3 4.424 11.741 9.765
20 2HG1 VAL 3 2HG1 VAL 3 3.104 11.955 10.940
21 3HG1 VAL 3 3HG1 VAL 3 4.765 12.429 11.371
22 1HG2 VAL 3 1HG2 VAL 3 3.858 8.867 9.865
23 2HG2 VAL 3 2HG2 VAL 3 3.252 8.497 11.497
24 3HG2 VAL 3 3HG2 VAL 3 2.497 9.794 10.539
25 HA PRO 4 HA PRO 4 8.870 11.241 8.452
26 1HB PRO 4 2HB PRO 4 7.501 9.727 6.227
27 2HB PRO 4 1HB PRO 4 9.239 9.866 6.651
28 1HG PRO 4 1HG PRO 4 7.965 7.657 7.229
29 2HG PRO 4 2HG PRO 4 9.237 8.210 8.368
30 1HD PRO 4 2HD PRO 4 6.219 8.377 8.556
31 2HD PRO 4 1HD PRO 4 7.431 8.237 9.866
32 H ALA 5 H ALA 5 8.715 12.851 6.597
33 HA ALA 5 HA ALA 5 6.180 14.218 6.790
34 1HB ALA 5 1HB ALA 5 7.358 16.038 5.720
35 2HB ALA 5 2HB ALA 5 8.689 14.959 5.238
36 3HB ALA 5 3HB ALA 5 8.434 15.343 6.957
37 H ASP 6 H ASP 6 4.881 14.821 4.936
38 HA ASP 6 HA ASP 6 4.312 12.769 3.273
39 1HB ASP 6 2HB ASP 6 2.842 14.257 2.182
40 2HB ASP 6 1HB ASP 6 3.046 14.999 3.756
41 H GLY 7 H GLY 7 4.277 13.485 0.601
42 1HA GLY 7 2HA GLY 7 6.804 14.560 -0.272
43 2HA GLY 7 1HA GLY 7 5.501 13.935 -1.263
44 H ALA 8 H ALA 8 5.958 11.611 1.104
45 HA ALA 8 HA ALA 8 8.336 10.367 0.336
46 1HB ALA 8 1HB ALA 8 5.859 9.675 1.854
47 2HB ALA 8 2HB ALA 8 7.568 9.542 2.332
48 3HB ALA 8 3HB ALA 8 6.844 8.314 1.265
49 H LYS 9 H LYS 9 8.846 8.849 -1.242
50 HA LYS 9 HA LYS 9 6.665 8.223 -3.109
51 1HB LYS 9 1HB LYS 9 9.544 8.943 -3.729
52 2HB LYS 9 2HB LYS 9 8.425 8.275 -4.899
53 1HG LYS 9 1HG LYS 9 7.048 10.198 -4.892
54 2HG LYS 9 2HG LYS 9 7.593 10.710 -3.307
55 1HD LYS 9 1HD LYS 9 9.929 11.050 -4.391
56 2HD LYS 9 2HD LYS 9 9.123 10.869 -5.937
57 1HE LYS 9 2HE LYS 9 8.874 13.153 -5.749
58 2HE LYS 9 1HE LYS 9 7.455 12.704 -4.825
59 1HZ LYS 9 1HZ LYS 9 9.477 12.611 -3.030
60 2HZ LYS 9 2HZ LYS 9 9.843 13.923 -3.932
61 3HZ LYS 9 3HZ LYS 9 8.393 13.822 -3.188
62 H ILE 10 H ILE 10 6.452 6.091 -3.737
63 HA ILE 10 HA ILE 10 8.369 4.256 -2.478
64 HB ILE 10 HB ILE 10 5.467 3.786 -3.172
65 1HG1 ILE 10 1HG1 ILE 10 6.468 3.926 -0.356
66 2HG1 ILE 10 2HG1 ILE 10 6.211 5.432 -1.214
67 1HG2 ILE 10 1HG2 ILE 10 6.906 1.772 -3.256
68 2HG2 ILE 10 2HG2 ILE 10 7.387 2.075 -1.569
69 3HG2 ILE 10 3HG2 ILE 10 5.689 1.711 -1.959
70 1HD1 ILE 10 1HD1 ILE 10 4.106 3.229 -1.076
71 2HD1 ILE 10 2HD1 ILE 10 4.192 4.577 0.083
72 3HD1 ILE 10 3HD1 ILE 10 3.884 4.903 -1.640
73 H ASP 11 H ASP 11 9.509 2.867 -3.757
74 HA ASP 11 HA ASP 11 8.517 2.128 -6.295
75 1HB ASP 11 1HB ASP 11 9.351 4.193 -7.126
76 2HB ASP 11 2HB ASP 11 10.731 4.180 -6.045
77 H PHE 12 H PHE 12 8.935 -0.025 -5.513
78 HA PHE 12 HA PHE 12 11.760 -0.598 -4.951
79 1HB PHE 12 1HB PHE 12 9.149 -2.009 -4.130
80 2HB PHE 12 2HB PHE 12 10.749 -2.550 -3.662
81 HD1 PHE 12 HD1 PHE 12 12.048 0.000 -2.930
82 HD2 PHE 12 HD2 PHE 12 8.122 -1.401 -2.136
83 HE1 PHE 12 HE1 PHE 12 11.942 1.454 -0.886
84 HE2 PHE 12 HE2 PHE 12 8.016 0.052 -0.093
85 HZ PHE 12 HZ PHE 12 9.927 1.463 0.508
86 H ILE 13 H ILE 13 8.880 -1.332 -6.874
87 HA ILE 13 HA ILE 13 10.224 -3.638 -8.051
88 HB ILE 13 HB ILE 13 7.402 -2.590 -8.270
89 1HG1 ILE 13 1HG1 ILE 13 8.348 -5.188 -7.047
90 2HG1 ILE 13 2HG1 ILE 13 8.204 -3.713 -6.112
91 1HG2 ILE 13 1HG2 ILE 13 8.541 -3.807 -10.321
92 2HG2 ILE 13 2HG2 ILE 13 8.208 -5.259 -9.346
93 3HG2 ILE 13 3HG2 ILE 13 6.874 -4.182 -9.823
94 1HD1 ILE 13 1HD1 ILE 13 5.930 -4.915 -7.755
95 2HD1 ILE 13 2HD1 ILE 13 6.149 -5.161 -6.006
96 3HD1 ILE 13 3HD1 ILE 13 5.819 -3.531 -6.641
97 H ALA 14 H ALA 14 11.776 -2.949 -9.471
98 HA ALA 14 HA ALA 14 11.354 -0.611 -11.063
99 1HB ALA 14 1HB ALA 14 13.518 -2.119 -12.076
100 2HB ALA 14 2HB ALA 14 13.596 -0.741 -10.953
101 3HB ALA 14 3HB ALA 14 13.516 -2.403 -10.319
102 H GLY 15 H GLY 15 9.658 -0.781 -12.505
103 1HA GLY 15 2HA GLY 15 8.710 -3.007 -13.772
104 2HA GLY 15 1HA GLY 15 10.047 -2.487 -14.778
105 H GLY 16 H GLY 16 7.564 -2.430 -15.928
106 1HA GLY 16 2HA GLY 16 6.242 0.091 -15.559
107 2HA GLY 16 1HA GLY 16 5.924 -1.120 -16.785
108 H GLU 17 H GLU 17 5.719 1.167 -17.944
109 HA GLU 17 HA GLU 17 7.447 1.314 -19.929
110 1HB GLU 17 1HB GLU 17 5.538 3.154 -18.691
111 2HB GLU 17 2HB GLU 17 6.861 4.036 -19.428
112 1HG GLU 17 1HG GLU 17 5.062 1.978 -20.785
113 2HG GLU 17 2HG GLU 17 5.104 3.701 -21.099
114 H LYS 18 H LYS 18 7.801 3.096 -16.790
115 HA LYS 18 HA LYS 18 10.669 3.231 -17.347
116 1HB LYS 18 1HB LYS 18 10.645 5.565 -16.368
117 2HB LYS 18 2HB LYS 18 9.998 5.398 -17.988
118 1HG LYS 18 1HG LYS 18 7.686 5.042 -16.672
119 2HG LYS 18 2HG LYS 18 8.527 5.904 -15.399
120 1HD LYS 18 1HD LYS 18 8.324 7.893 -16.486
121 2HD LYS 18 2HD LYS 18 8.955 7.223 -17.977
122 1HE LYS 18 1HE LYS 18 6.233 6.244 -17.397
123 2HE LYS 18 2HE LYS 18 6.292 7.993 -17.498
124 1HZ LYS 18 1HZ LYS 18 7.760 6.609 -19.539
125 2HZ LYS 18 2HZ LYS 18 6.141 6.403 -19.599
126 3HZ LYS 18 3HZ LYS 18 6.776 7.907 -19.660
127 H ASN 19 H ASN 19 8.099 3.935 -14.872
128 HA ASN 19 HA ASN 19 8.814 1.976 -13.156
129 1HB ASN 19 1HB ASN 19 10.081 3.337 -11.375
130 2HB ASN 19 2HB ASN 19 11.016 2.910 -12.794
131 2HD2 ASN 19 2HD2 ASN 19 12.122 4.826 -11.568
132 1HD2 ASN 19 1HD2 ASN 19 11.831 6.399 -12.231
133 H LEU 20 H LEU 20 6.808 1.917 -12.132
134 HA LEU 20 HA LEU 20 5.248 4.294 -11.893
135 1HB LEU 20 1HB LEU 20 4.842 1.429 -11.045
136 2HB LEU 20 2HB LEU 20 3.672 2.692 -10.721
137 HG LEU 20 HG LEU 20 4.496 1.511 -13.363
138 1HD1 LEU 20 1HD1 LEU 20 2.163 1.439 -11.625
139 2HD1 LEU 20 2HD1 LEU 20 1.748 1.922 -13.287
140 3HD1 LEU 20 3HD1 LEU 20 2.608 0.392 -12.994
141 1HD2 LEU 20 1HD2 LEU 20 3.480 4.279 -12.854
142 2HD2 LEU 20 2HD2 LEU 20 4.631 3.684 -14.074
143 3HD2 LEU 20 3HD2 LEU 20 2.887 3.390 -14.277
144 H THR 21 H THR 21 5.636 5.815 -10.380
145 HA THR 21 HA THR 21 6.638 4.876 -7.774
146 HB THR 21 HB THR 21 6.829 7.719 -8.837
147 HG1 THR 21 HG1 THR 21 8.603 5.418 -9.261
148 1HG2 THR 21 1HG2 THR 21 8.399 5.929 -6.932
149 2HG2 THR 21 2HG2 THR 21 9.146 7.368 -7.667
150 3HG2 THR 21 3HG2 THR 21 7.720 7.544 -6.617
151 H VAL 22 H VAL 22 5.102 4.690 -6.274
152 HA VAL 22 HA VAL 22 2.759 6.403 -6.516
153 HB VAL 22 HB VAL 22 3.403 3.967 -4.849
154 1HG1 VAL 22 1HG1 VAL 22 1.900 5.656 -3.695
155 2HG1 VAL 22 2HG1 VAL 22 0.722 5.372 -5.000
156 3HG1 VAL 22 3HG1 VAL 22 1.207 4.033 -3.931
157 1HG2 VAL 22 1HG2 VAL 22 2.227 4.398 -7.487
158 2HG2 VAL 22 2HG2 VAL 22 2.798 2.896 -6.720
159 3HG2 VAL 22 3HG2 VAL 22 1.147 3.483 -6.408
160 H VAL 23 H VAL 23 2.354 8.110 -5.174
161 HA VAL 23 HA VAL 23 4.427 8.689 -3.209
162 HB VAL 23 HB VAL 23 2.199 10.377 -4.367
163 1HG1 VAL 23 1HG1 VAL 23 4.111 10.819 -2.162
164 2HG1 VAL 23 2HG1 VAL 23 4.057 12.123 -3.372
165 3HG1 VAL 23 3HG1 VAL 23 2.569 11.629 -2.529
166 1HG2 VAL 23 1HG2 VAL 23 4.884 9.694 -5.312
167 2HG2 VAL 23 2HG2 VAL 23 3.531 10.474 -6.167
168 3HG2 VAL 23 3HG2 VAL 23 4.630 11.450 -5.163
169 H PHE 24 H PHE 24 4.089 8.590 -1.029
170 HA PHE 24 HA PHE 24 1.309 8.193 -0.175
171 1HB PHE 24 1HB PHE 24 2.922 6.139 -0.228
172 2HB PHE 24 2HB PHE 24 3.872 6.961 0.993
173 HD1 PHE 24 HD1 PHE 24 0.350 5.885 0.375
174 HD2 PHE 24 HD2 PHE 24 3.446 6.490 3.213
175 HE1 PHE 24 HE1 PHE 24 -1.102 4.898 2.169
176 HE2 PHE 24 HE2 PHE 24 1.995 5.504 5.007
177 HZ PHE 24 HZ PHE 24 -0.262 4.720 4.464
178 H ASN 25 H ASN 25 0.696 9.174 1.794
179 HA ASN 25 HA ASN 25 2.776 10.844 2.970
180 1HB ASN 25 2HB ASN 25 0.118 11.977 3.361
181 2HB ASN 25 1HB ASN 25 1.514 12.716 2.601
182 2HD2 ASN 25 2HD2 ASN 25 2.045 11.763 0.373
183 1HD2 ASN 25 1HD2 ASN 25 0.721 11.589 -0.731
184 H HIS 26 H HIS 26 2.945 10.530 5.208
185 HA HIS 26 HA HIS 26 1.214 8.634 6.426
186 1HB HIS 26 1HB HIS 26 3.706 10.083 7.110
187 2HB HIS 26 2HB HIS 26 2.694 9.650 8.474
188 HD1 HIS 26 HD1 HIS 26 4.651 8.083 5.627
189 HD2 HIS 26 HD2 HIS 26 2.661 6.935 9.137
190 HE1 HIS 26 HE1 HIS 26 5.264 5.639 6.029
191 H SER 27 H SER 27 1.190 12.075 5.960
192 HA SER 27 HA SER 27 -0.393 12.544 8.304
193 1HB SER 27 1HB SER 27 -0.488 14.906 7.373
194 2HB SER 27 2HB SER 27 1.125 14.308 7.707
195 HG SER 27 HG SER 27 1.172 15.274 5.657
196 H THR 28 H THR 28 -1.152 10.795 5.787
197 HA THR 28 HA THR 28 -3.693 12.164 5.201
198 HB THR 28 HB THR 28 -2.138 10.051 3.615
199 HG1 THR 28 HG1 THR 28 -2.646 12.935 3.386
200 1HG2 THR 28 1HG2 THR 28 -4.818 11.356 3.306
201 2HG2 THR 28 2HG2 THR 28 -3.783 11.375 1.857
202 3HG2 THR 28 3HG2 THR 28 -4.220 9.826 2.618
203 H HIS 29 H HIS 29 -2.125 9.194 6.383
204 HA HIS 29 HA HIS 29 -4.797 8.093 6.826
205 1HB HIS 29 2HB HIS 29 -2.110 6.691 6.881
206 2HB HIS 29 1HB HIS 29 -3.677 5.931 7.075
207 HD1 HIS 29 HD1 HIS 29 -1.488 7.581 4.461
208 HD2 HIS 29 HD2 HIS 29 -5.076 5.422 4.701
209 HE1 HIS 29 HE1 HIS 29 -2.126 6.986 2.063
210 H LYS 30 H LYS 30 -3.345 10.289 8.374
211 HA LYS 30 HA LYS 30 -2.359 9.290 10.762
212 1HB LYS 30 2HB LYS 30 -2.689 11.518 11.621
213 2HB LYS 30 1HB LYS 30 -2.115 11.615 9.969
214 1HG LYS 30 1HG LYS 30 -3.873 13.111 9.802
215 2HG LYS 30 2HG LYS 30 -4.753 11.643 9.424
216 1HD LYS 30 1HD LYS 30 -6.100 12.630 11.090
217 2HD LYS 30 2HD LYS 30 -5.168 11.459 12.002
218 1HE LYS 30 2HE LYS 30 -4.379 13.129 13.318
219 2HE LYS 30 1HE LYS 30 -3.582 13.837 11.927
220 1HZ LYS 30 1HZ LYS 30 -5.944 14.727 11.455
221 2HZ LYS 30 2HZ LYS 30 -6.182 14.478 13.051
222 3HZ LYS 30 3HZ LYS 30 -4.995 15.482 12.550
223 H ASP 31 H ASP 31 -5.568 9.223 9.443
224 HA ASP 31 HA ASP 31 -6.823 9.103 12.004
225 1HB ASP 31 2HB ASP 31 -8.859 9.021 10.808
226 2HB ASP 31 1HB ASP 31 -7.826 9.976 9.764
227 H VAL 32 H VAL 32 -4.865 7.037 10.246
228 HA VAL 32 HA VAL 32 -6.339 4.648 11.119
229 HB VAL 32 HB VAL 32 -4.238 4.819 8.958
230 1HG1 VAL 32 1HG1 VAL 32 -5.304 2.636 10.302
231 2HG1 VAL 32 2HG1 VAL 32 -6.254 2.706 8.799
232 3HG1 VAL 32 3HG1 VAL 32 -4.479 2.603 8.725
233 1HG2 VAL 32 1HG2 VAL 32 -7.046 5.635 8.891
234 2HG2 VAL 32 2HG2 VAL 32 -5.748 5.898 7.702
235 3HG2 VAL 32 3HG2 VAL 32 -6.669 4.374 7.693
236 H LYS 33 H LYS 33 -5.338 3.244 12.530
237 HA LYS 33 HA LYS 33 -3.255 4.181 14.086
238 1HB LYS 33 1HB LYS 33 -4.254 1.346 13.680
239 2HB LYS 33 2HB LYS 33 -3.190 1.857 14.974
240 1HG LYS 33 1HG LYS 33 -4.857 3.158 16.026
241 2HG LYS 33 2HG LYS 33 -5.781 3.358 14.550
242 1HD LYS 33 1HD LYS 33 -6.058 0.713 14.705
243 2HD LYS 33 2HD LYS 33 -5.651 0.958 16.392
244 1HE LYS 33 1HE LYS 33 -7.500 2.788 16.407
245 2HE LYS 33 2HE LYS 33 -8.004 2.140 14.859
246 1HZ LYS 33 1HZ LYS 33 -8.014 -0.071 16.079
247 2HZ LYS 33 2HZ LYS 33 -8.001 0.806 17.456
248 3HZ LYS 33 3HZ LYS 33 -9.230 0.973 16.394
249 H CYS 34 H CYS 34 -1.060 3.151 14.387
250 HA CYS 34 HA CYS 34 0.269 3.207 11.877
251 1HB CYS 34 1HB CYS 34 1.487 2.418 14.521
252 2HB CYS 34 2HB CYS 34 2.288 3.090 13.114
253 H ASP 35 H ASP 35 -0.626 0.754 14.368
254 HA ASP 35 HA ASP 35 0.786 -1.339 13.205
255 1HB ASP 35 1HB ASP 35 -0.792 -2.783 14.563
256 2HB ASP 35 2HB ASP 35 0.014 -1.532 15.487
257 H ASP 36 H ASP 36 -1.889 0.459 12.103
258 HA ASP 36 HA ASP 36 -3.552 -1.514 11.102
259 1HB ASP 36 1HB ASP 36 -3.763 1.138 11.282
260 2HB ASP 36 2HB ASP 36 -3.108 1.111 9.657
261 H CYS 37 H CYS 37 -0.374 -0.397 10.195
262 HA CYS 37 HA CYS 37 -0.581 -1.920 7.707
263 1HB CYS 37 1HB CYS 37 0.841 0.740 8.052
264 2HB CYS 37 2HB CYS 37 1.002 -0.300 6.651
265 H HIS 38 H HIS 38 1.556 -0.385 10.211
266 HA HIS 38 HA HIS 38 3.720 -2.122 9.620
267 1HB HIS 38 1HB HIS 38 3.205 -0.294 11.982
268 2HB HIS 38 2HB HIS 38 4.720 -1.116 11.662
269 HD1 HIS 38 HD1 HIS 38 5.924 -0.427 9.295
270 HD2 HIS 38 HD2 HIS 38 2.932 2.141 10.728
271 HE1 HIS 38 HE1 HIS 38 6.232 1.787 8.064
272 H HIS 39 H HIS 39 2.288 -4.129 9.688
273 HA HIS 39 HA HIS 39 1.550 -4.956 12.346
274 1HB HIS 39 1HB HIS 39 0.359 -6.663 11.342
275 2HB HIS 39 2HB HIS 39 0.247 -5.373 10.160
276 HD1 HIS 39 HD1 HIS 39 0.930 -8.881 10.362
277 HD2 HIS 39 HD2 HIS 39 2.471 -5.716 8.081
278 HE1 HIS 39 HE1 HIS 39 2.065 -9.944 8.339
279 H GLN 40 H GLN 40 4.211 -4.429 12.448
280 HA GLN 40 HA GLN 40 5.457 -7.041 12.114
281 1HB GLN 40 1HB GLN 40 6.493 -4.217 12.006
282 2HB GLN 40 2HB GLN 40 7.585 -5.462 12.577
283 1HG GLN 40 1HG GLN 40 7.531 -4.952 10.015
284 2HG GLN 40 2HG GLN 40 7.558 -6.629 10.523
285 2HE2 GLN 40 2HE2 GLN 40 5.736 -7.907 10.359
286 1HE2 GLN 40 1HE2 GLN 40 4.359 -7.484 9.397
287 HA PRO 41 HA PRO 41 5.479 -7.214 16.547
288 1HB PRO 41 1HB PRO 41 6.335 -9.730 16.847
289 2HB PRO 41 2HB PRO 41 4.804 -9.419 15.964
290 1HG PRO 41 2HG PRO 41 7.595 -9.712 14.794
291 2HG PRO 41 1HG PRO 41 6.197 -10.666 14.199
292 1HD PRO 41 1HD PRO 41 7.016 -8.373 12.953
293 2HD PRO 41 2HD PRO 41 5.276 -8.763 13.108
294 H GLY 42 H GLY 42 7.099 -7.253 18.304
295 1HA GLY 42 2HA GLY 42 9.882 -7.548 17.578
296 2HA GLY 42 1HA GLY 42 9.214 -7.206 19.161
297 H ASP 43 H ASP 43 11.051 -5.605 19.253
298 HA ASP 43 HA ASP 43 10.225 -3.085 19.166
299 1HB ASP 43 1HB ASP 43 12.675 -4.422 19.564
300 2HB ASP 43 2HB ASP 43 13.040 -3.259 18.305
301 H LYS 44 H LYS 44 11.296 -5.120 16.468
302 HA LYS 44 HA LYS 44 11.624 -2.879 14.674
303 1HB LYS 44 1HB LYS 44 12.986 -5.092 14.732
304 2HB LYS 44 2HB LYS 44 11.617 -5.790 13.890
305 1HG LYS 44 1HG LYS 44 11.814 -3.855 12.202
306 2HG LYS 44 2HG LYS 44 13.329 -3.436 12.976
307 1HD LYS 44 1HD LYS 44 13.591 -6.193 12.555
308 2HD LYS 44 2HD LYS 44 12.717 -5.664 11.130
309 1HE LYS 44 1HE LYS 44 14.719 -3.693 11.508
310 2HE LYS 44 2HE LYS 44 15.524 -5.211 11.854
311 1HZ LYS 44 1HZ LYS 44 13.821 -5.182 9.530
312 2HZ LYS 44 2HZ LYS 44 15.190 -4.298 9.425
313 3HZ LYS 44 3HZ LYS 44 15.273 -5.897 9.750
314 H GLN 45 H GLN 45 9.140 -2.637 15.757
315 HA GLN 45 HA GLN 45 7.233 -4.073 14.236
316 1HB GLN 45 1HB GLN 45 6.508 -3.409 16.394
317 2HB GLN 45 2HB GLN 45 7.121 -1.778 16.209
318 1HG GLN 45 1HG GLN 45 5.373 -1.219 14.598
319 2HG GLN 45 2HG GLN 45 4.852 -2.889 14.498
320 2HE2 GLN 45 2HE2 GLN 45 2.883 -1.367 14.994
321 1HE2 GLN 45 1HE2 GLN 45 2.387 -1.317 16.653
322 H TYR 46 H TYR 46 9.214 -1.344 13.740
323 HA TYR 46 HA TYR 46 7.519 -0.454 11.452
324 1HB TYR 46 1HB TYR 46 9.451 1.128 13.180
325 2HB TYR 46 2HB TYR 46 8.625 1.752 11.742
326 HD1 TYR 46 HD1 TYR 46 8.199 0.652 15.245
327 HD2 TYR 46 HD2 TYR 46 6.282 2.342 11.792
328 HE1 TYR 46 HE1 TYR 46 6.259 1.307 16.643
329 HE2 TYR 46 HE2 TYR 46 4.341 2.997 13.191
330 HH TYR 46 HH TYR 46 3.315 2.050 15.579
331 H ALA 47 H ALA 47 8.801 -2.450 10.476
332 HA ALA 47 HA ALA 47 11.435 -1.461 9.623
333 1HB ALA 47 1HB ALA 47 10.527 -3.989 10.689
334 2HB ALA 47 3HB ALA 47 12.179 -3.479 10.267
335 3HB ALA 47 2HB ALA 47 11.135 -4.225 9.033
336 H GLY 48 H GLY 48 11.903 -2.870 7.363
337 1HA GLY 48 2HA GLY 48 11.524 -2.673 5.143
338 2HA GLY 48 1HA GLY 48 10.166 -1.616 5.475
339 H CYS 49 H CYS 49 8.784 -2.623 3.922
340 HA CYS 49 HA CYS 49 7.461 -4.935 4.954
341 1HB CYS 49 1HB CYS 49 6.927 -3.602 2.303
342 2HB CYS 49 2HB CYS 49 5.836 -4.574 3.270
343 H THR 50 H THR 50 9.858 -4.083 2.468
344 HA THR 50 HA THR 50 9.672 -6.721 1.246
345 HB THR 50 HB THR 50 11.412 -5.661 -0.293
346 HG1 THR 50 HG1 THR 50 12.080 -4.190 1.552
347 1HG2 THR 50 1HG2 THR 50 8.789 -4.198 0.256
348 2HG2 THR 50 2HG2 THR 50 9.886 -3.698 -1.054
349 3HG2 THR 50 3HG2 THR 50 9.155 -5.321 -1.076
350 H THR 51 H THR 51 10.562 -6.203 4.131
351 HA THR 51 HA THR 51 13.358 -6.734 4.162
352 HB THR 51 HB THR 51 11.244 -7.192 6.329
353 HG1 THR 51 HG1 THR 51 11.948 -4.875 6.756
354 1HG2 THR 51 1HG2 THR 51 13.726 -7.901 6.705
355 2HG2 THR 51 2HG2 THR 51 14.106 -6.166 6.588
356 3HG2 THR 51 3HG2 THR 51 13.033 -6.757 7.879
357 H ASP 52 H ASP 52 14.408 -8.692 4.949
358 HA ASP 52 HA ASP 52 13.711 -10.856 3.447
359 1HB ASP 52 1HB ASP 52 15.175 -11.038 6.112
360 2HB ASP 52 2HB ASP 52 15.386 -12.075 4.715
361 H GLY 53 H GLY 53 12.891 -13.037 4.166
362 1HA GLY 53 2HA GLY 53 11.849 -13.613 6.670
363 2HA GLY 53 1HA GLY 53 11.365 -14.354 5.158
364 H CYS 54 H CYS 54 10.651 -11.456 4.167
365 HA CYS 54 HA CYS 54 8.013 -11.479 5.425
366 1HB CYS 54 1HB CYS 54 9.482 -8.919 4.738
367 2HB CYS 54 2HB CYS 54 7.944 -9.081 5.561
368 H HIS 55 H HIS 55 7.991 -8.838 3.496
369 HA HIS 55 HA HIS 55 7.075 -10.395 1.221
370 1HB HIS 55 2HB HIS 55 6.758 -7.421 1.653
371 2HB HIS 55 1HB HIS 55 5.853 -8.457 0.567
372 HD1 HIS 55 HD1 HIS 55 4.230 -10.285 1.793
373 HD2 HIS 55 HD2 HIS 55 5.652 -7.128 4.161
374 HE1 HIS 55 HE1 HIS 55 2.727 -10.204 3.853
375 H ASN 56 H ASN 56 9.786 -10.603 1.405
376 HA ASN 56 HA ASN 56 10.989 -8.464 -0.053
377 1HB ASN 56 1HB ASN 56 12.210 -9.792 1.724
378 2HB ASN 56 2HB ASN 56 12.094 -11.219 0.714
379 2HD2 ASN 56 2HD2 ASN 56 14.430 -9.801 1.715
380 1HD2 ASN 56 1HD2 ASN 56 15.388 -9.342 0.347
381 H ILE 57 H ILE 57 9.232 -8.948 -1.860
382 HA ILE 57 HA ILE 57 10.446 -10.835 -3.740
383 HB ILE 57 HB ILE 57 7.486 -10.571 -3.203
384 1HG1 ILE 57 1HG1 ILE 57 9.015 -11.823 -1.505
385 2HG1 ILE 57 2HG1 ILE 57 7.522 -12.563 -2.047
386 1HG2 ILE 57 1HG2 ILE 57 9.023 -11.645 -5.448
387 2HG2 ILE 57 2HG2 ILE 57 7.895 -12.825 -4.739
388 3HG2 ILE 57 3HG2 ILE 57 7.292 -11.253 -5.318
389 1HD1 ILE 57 1HD1 ILE 57 9.950 -13.120 -3.714
390 2HD1 ILE 57 2HD1 ILE 57 9.897 -13.863 -2.098
391 3HD1 ILE 57 3HD1 ILE 57 8.602 -14.196 -3.273
392 H LEU 58 H LEU 58 11.078 -9.759 -5.525
393 HA LEU 58 HA LEU 58 9.616 -7.289 -6.150
394 1HB LEU 58 1HB LEU 58 12.487 -8.028 -6.735
395 2HB LEU 58 2HB LEU 58 11.693 -6.550 -7.242
396 HG LEU 58 HG LEU 58 12.324 -7.409 -4.408
397 1HD1 LEU 58 1HD1 LEU 58 14.165 -6.479 -5.869
398 2HD1 LEU 58 2HD1 LEU 58 13.258 -4.948 -5.896
399 3HD1 LEU 58 3HD1 LEU 58 13.855 -5.601 -4.352
400 1HD2 LEU 58 1HD2 LEU 58 10.772 -4.978 -5.342
401 2HD2 LEU 58 2HD2 LEU 58 10.139 -6.352 -4.404
402 3HD2 LEU 58 3HD2 LEU 58 11.351 -5.266 -3.683
403 H ASP 59 H ASP 59 9.469 -10.413 -6.891
404 HA ASP 59 HA ASP 59 9.638 -10.068 -9.755
405 1HB ASP 59 1HB ASP 59 8.929 -12.606 -9.606
406 2HB ASP 59 2HB ASP 59 10.570 -12.141 -9.204
407 H LYS 60 H LYS 60 7.685 -8.498 -9.492
408 HA LYS 60 HA LYS 60 5.260 -9.044 -8.513
409 1HB LYS 60 1HB LYS 60 5.913 -6.958 -9.647
410 2HB LYS 60 2HB LYS 60 5.845 -7.765 -11.200
411 1HG LYS 60 1HG LYS 60 3.391 -8.082 -9.537
412 2HG LYS 60 2HG LYS 60 3.725 -6.434 -10.031
413 1HD LYS 60 1HD LYS 60 3.937 -8.612 -12.112
414 2HD LYS 60 2HD LYS 60 2.337 -8.111 -11.601
415 1HE LYS 60 1HE LYS 60 2.704 -5.834 -12.304
416 2HE LYS 60 2HE LYS 60 4.435 -6.072 -12.446
417 1HZ LYS 60 1HZ LYS 60 3.193 -7.941 -14.062
418 2HZ LYS 60 2HZ LYS 60 2.487 -6.502 -14.373
419 3HZ LYS 60 3HZ LYS 60 4.105 -6.667 -14.521
420 H ALA 61 H ALA 61 3.276 -10.010 -9.285
421 HA ALA 61 HA ALA 61 2.055 -11.589 -10.245
422 1HB ALA 61 1HB ALA 61 3.843 -12.294 -12.469
423 2HB ALA 61 3HB ALA 61 2.180 -11.659 -12.500
424 3HB ALA 61 2HB ALA 61 3.557 -10.542 -12.338
425 H ASP 62 H ASP 62 3.679 -12.287 -8.106
426 HA ASP 62 HA ASP 62 4.886 -14.792 -8.935
427 1HB ASP 62 1HB ASP 62 6.090 -13.042 -7.444
428 2HB ASP 62 2HB ASP 62 4.976 -13.506 -6.174
429 H LYS 63 H LYS 63 4.623 -16.486 -6.860
430 HA LYS 63 HA LYS 63 1.788 -16.419 -6.098
431 1HB LYS 63 1HB LYS 63 2.921 -18.182 -7.929
432 2HB LYS 63 2HB LYS 63 2.899 -19.104 -6.439
433 1HG LYS 63 1HG LYS 63 0.475 -17.572 -7.486
434 2HG LYS 63 2HG LYS 63 0.774 -19.259 -7.855
435 1HD LYS 63 1HD LYS 63 0.156 -19.965 -5.761
436 2HD LYS 63 2HD LYS 63 0.978 -18.640 -4.961
437 1HE LYS 63 1HE LYS 63 -1.670 -18.332 -6.454
438 2HE LYS 63 2HE LYS 63 -1.556 -18.605 -4.727
439 1HZ LYS 63 1HZ LYS 63 -0.232 -16.590 -4.573
440 2HZ LYS 63 2HZ LYS 63 -0.397 -16.327 -6.176
441 3HZ LYS 63 3HZ LYS 63 -1.707 -16.283 -5.203
442 H SER 64 H SER 64 2.401 -15.458 -4.075
443 HA SER 64 HA SER 64 2.901 -17.340 -2.111
444 1HB SER 64 1HB SER 64 5.296 -16.188 -3.292
445 2HB SER 64 2HB SER 64 5.171 -15.684 -1.618
446 HG SER 64 HG SER 64 6.281 -17.818 -2.125
447 H VAL 65 H VAL 65 3.041 -16.244 0.112
448 HA VAL 65 HA VAL 65 1.422 -13.852 0.016
449 HB VAL 65 HB VAL 65 0.738 -15.620 1.471
450 1HG1 VAL 65 1HG1 VAL 65 3.607 -15.656 2.233
451 2HG1 VAL 65 2HG1 VAL 65 2.444 -15.932 3.552
452 3HG1 VAL 65 3HG1 VAL 65 2.430 -16.986 2.118
453 1HG2 VAL 65 1HG2 VAL 65 0.908 -13.032 2.228
454 2HG2 VAL 65 2HG2 VAL 65 0.163 -14.302 3.228
455 3HG2 VAL 65 3HG2 VAL 65 1.840 -13.793 3.540
456 H ASN 66 H ASN 66 4.527 -14.186 -0.600
457 HA ASN 66 HA ASN 66 5.395 -12.166 1.301
458 1HB ASN 66 1HB ASN 66 7.048 -13.868 -0.639
459 2HB ASN 66 2HB ASN 66 7.706 -12.774 0.561
460 2HD2 ASN 66 2HD2 ASN 66 6.772 -13.138 2.836
461 1HD2 ASN 66 1HD2 ASN 66 6.738 -14.774 3.404
462 H SER 67 H SER 67 3.793 -12.214 -1.507
463 HA SER 67 HA SER 67 5.510 -10.750 -3.209
464 1HB SER 67 1HB SER 67 3.294 -10.365 -4.482
465 2HB SER 67 2HB SER 67 3.846 -12.019 -4.316
466 HG SER 67 HG SER 67 1.619 -11.923 -3.794
467 H TRP 68 H TRP 68 5.659 -8.505 -3.504
468 HA TRP 68 HA TRP 68 4.319 -6.915 -1.459
469 1HB TRP 68 1HB TRP 68 6.604 -6.516 -1.417
470 2HB TRP 68 2HB TRP 68 6.759 -6.557 -3.163
471 HD1 TRP 68 HD1 TRP 68 6.929 -4.195 -4.272
472 HE1 TRP 68 HE1 TRP 68 6.405 -1.682 -3.658
473 HE3 TRP 68 HE3 TRP 68 4.729 -5.197 0.202
474 HZ2 TRP 68 HZ2 TRP 68 5.158 -0.424 -1.421
475 HZ3 TRP 68 HZ3 TRP 68 3.885 -3.269 1.538
476 HH2 TRP 68 HH2 TRP 68 4.071 -0.949 0.794
477 H TYR 69 H TYR 69 3.309 -8.160 -4.127
478 HA TYR 69 HA TYR 69 2.192 -5.634 -5.251
479 1HB TYR 69 1HB TYR 69 3.629 -6.630 -6.884
480 2HB TYR 69 2HB TYR 69 2.966 -8.245 -6.578
481 HD1 TYR 69 HD1 TYR 69 0.454 -8.607 -7.105
482 HD2 TYR 69 HD2 TYR 69 2.756 -5.303 -8.599
483 HE1 TYR 69 HE1 TYR 69 -1.207 -8.269 -8.915
484 HE2 TYR 69 HE2 TYR 69 1.095 -4.964 -10.409
485 HH TYR 69 HH TYR 69 -1.103 -5.504 -11.095
486 H LYS 70 H LYS 70 1.543 -8.526 -3.493
487 HA LYS 70 HA LYS 70 -1.200 -8.609 -4.492
488 1HB LYS 70 1HB LYS 70 0.155 -10.712 -4.349
489 2HB LYS 70 2HB LYS 70 0.217 -10.516 -2.609
490 1HG LYS 70 1HG LYS 70 -2.385 -10.376 -2.706
491 2HG LYS 70 2HG LYS 70 -2.240 -10.977 -4.346
492 1HD LYS 70 2HD LYS 70 -2.475 -12.983 -3.166
493 2HD LYS 70 1HD LYS 70 -0.729 -12.857 -3.251
494 1HE LYS 70 1HE LYS 70 -1.530 -13.425 -0.945
495 2HE LYS 70 2HE LYS 70 -0.619 -11.928 -0.982
496 1HZ LYS 70 1HZ LYS 70 -3.503 -11.806 -1.315
497 2HZ LYS 70 2HZ LYS 70 -2.897 -12.039 0.183
498 3HZ LYS 70 3HZ LYS 70 -2.491 -10.703 -0.663
499 H VAL 71 H VAL 71 0.763 -8.157 -1.496
500 HA VAL 71 HA VAL 71 -1.432 -7.764 0.197
501 HB VAL 71 HB VAL 71 0.261 -6.726 1.683
502 1HG1 VAL 71 1HG1 VAL 71 0.811 -9.379 0.349
503 2HG1 VAL 71 2HG1 VAL 71 1.804 -8.795 1.705
504 3HG1 VAL 71 3HG1 VAL 71 0.057 -9.051 1.928
505 1HG2 VAL 71 1HG2 VAL 71 1.577 -5.677 -0.210
506 2HG2 VAL 71 2HG2 VAL 71 2.546 -6.488 1.044
507 3HG2 VAL 71 3HG2 VAL 71 2.265 -7.289 -0.520
508 H VAL 72 H VAL 72 -0.364 -5.952 -2.465
509 HA VAL 72 HA VAL 72 -1.396 -3.464 -1.306
510 HB VAL 72 HB VAL 72 0.305 -3.993 -3.750
511 1HG1 VAL 72 1HG1 VAL 72 -1.434 -1.892 -3.430
512 2HG1 VAL 72 2HG1 VAL 72 0.075 -1.228 -2.761
513 3HG1 VAL 72 3HG1 VAL 72 0.042 -1.862 -4.424
514 1HG2 VAL 72 1HG2 VAL 72 0.976 -2.739 -1.066
515 2HG2 VAL 72 2HG2 VAL 72 1.547 -4.309 -1.680
516 3HG2 VAL 72 3HG2 VAL 72 2.063 -2.802 -2.474
517 H HIS 73 H HIS 73 -1.668 -5.784 -4.049
518 HA HIS 73 HA HIS 73 -4.153 -4.425 -4.781
519 1HB HIS 73 2HB HIS 73 -2.494 -6.353 -6.429
520 2HB HIS 73 1HB HIS 73 -3.911 -5.473 -6.966
521 HD1 HIS 73 HD1 HIS 73 -0.252 -5.016 -6.184
522 HD2 HIS 73 HD2 HIS 73 -3.485 -2.753 -7.607
523 HE1 HIS 73 HE1 HIS 73 0.738 -2.846 -7.089
524 H ASP 74 H ASP 74 -3.955 -6.125 -2.435
525 HA ASP 74 HA ASP 74 -5.174 -8.585 -3.334
526 1HB ASP 74 1HB ASP 74 -3.704 -9.150 -1.630
527 2HB ASP 74 2HB ASP 74 -3.858 -7.595 -0.836
528 H ALA 75 H ALA 75 -7.420 -8.882 -3.178
529 HA ALA 75 HA ALA 75 -8.900 -6.806 -1.714
530 1HB ALA 75 1HB ALA 75 -9.780 -8.519 -4.073
531 2HB ALA 75 3HB ALA 75 -9.203 -6.839 -4.190
532 3HB ALA 75 2HB ALA 75 -10.708 -7.204 -3.311
533 H LYS 76 H LYS 76 -7.624 -9.331 -0.658
534 HA LYS 76 HA LYS 76 -10.109 -10.644 0.200
535 1HB LYS 76 1HB LYS 76 -8.457 -11.961 -1.288
536 2HB LYS 76 2HB LYS 76 -7.414 -12.000 0.120
537 1HG LYS 76 1HG LYS 76 -9.542 -12.862 1.403
538 2HG LYS 76 2HG LYS 76 -10.192 -13.190 -0.191
539 1HD LYS 76 1HD LYS 76 -8.368 -14.707 -0.722
540 2HD LYS 76 2HD LYS 76 -7.460 -14.214 0.694
541 1HE LYS 76 1HE LYS 76 -8.399 -16.149 1.554
542 2HE LYS 76 2HE LYS 76 -9.685 -15.034 1.974
543 1HZ LYS 76 1HZ LYS 76 -9.802 -16.195 -0.666
544 2HZ LYS 76 2HZ LYS 76 -10.101 -17.203 0.585
545 3HZ LYS 76 3HZ LYS 76 -11.011 -15.862 0.380
546 H GLY 77 H GLY 77 -10.173 -11.350 2.449
547 1HA GLY 77 2HA GLY 77 -10.055 -10.066 4.502
548 2HA GLY 77 1HA GLY 77 -8.375 -9.721 4.142
549 H GLY 78 H GLY 78 -8.814 -10.787 6.592
550 1HA GLY 78 2HA GLY 78 -8.030 -13.624 6.282
551 2HA GLY 78 1HA GLY 78 -9.073 -13.047 7.567
552 H ALA 79 H ALA 79 -7.708 -10.516 8.088
553 HA ALA 79 HA ALA 79 -6.059 -11.084 10.088
554 1HB ALA 79 1HB ALA 79 -3.747 -10.691 8.804
555 2HB ALA 79 3HB ALA 79 -4.636 -11.474 7.476
556 3HB ALA 79 2HB ALA 79 -4.425 -12.321 9.028
557 H LYS 80 H LYS 80 -5.853 -9.168 7.007
558 HA LYS 80 HA LYS 80 -6.545 -6.787 8.392
559 1HB LYS 80 1HB LYS 80 -4.253 -5.716 7.591
560 2HB LYS 80 2HB LYS 80 -4.443 -6.424 9.182
561 1HG LYS 80 1HG LYS 80 -3.591 -8.632 8.206
562 2HG LYS 80 2HG LYS 80 -3.231 -7.770 6.724
563 1HD LYS 80 2HD LYS 80 -2.016 -7.306 9.479
564 2HD LYS 80 1HD LYS 80 -1.190 -7.828 8.024
565 1HE LYS 80 1HE LYS 80 -0.641 -5.537 8.111
566 2HE LYS 80 2HE LYS 80 -1.994 -5.548 6.998
567 1HZ LYS 80 1HZ LYS 80 -2.893 -5.354 9.656
568 2HZ LYS 80 2HZ LYS 80 -1.821 -4.164 9.337
569 3HZ LYS 80 3HZ LYS 80 -3.152 -4.335 8.406
570 HA PRO 81 HA PRO 81 -7.676 -5.742 4.293
571 1HB PRO 81 1HB PRO 81 -7.827 -3.015 4.466
572 2HB PRO 81 2HB PRO 81 -8.924 -4.097 5.384
573 1HG PRO 81 1HG PRO 81 -6.614 -2.695 6.193
574 2HG PRO 81 2HG PRO 81 -8.075 -2.893 7.215
575 1HD PRO 81 1HD PRO 81 -5.726 -4.349 7.556
576 2HD PRO 81 2HD PRO 81 -7.342 -4.996 7.972
577 H THR 82 H THR 82 -6.986 -3.641 2.625
578 HA THR 82 HA THR 82 -4.063 -3.518 2.649
579 HB THR 82 HB THR 82 -4.115 -4.200 0.198
580 HG1 THR 82 HG1 THR 82 -6.318 -5.436 -0.114
581 1HG2 THR 82 1HG2 THR 82 -4.214 -5.901 2.428
582 2HG2 THR 82 2HG2 THR 82 -5.528 -6.510 1.392
583 3HG2 THR 82 3HG2 THR 82 -3.867 -6.413 0.759
584 H CYS 83 H CYS 83 -3.735 -2.270 0.161
585 HA CYS 83 HA CYS 83 -4.630 0.335 0.889
586 1HB CYS 83 1HB CYS 83 -3.258 -0.381 -1.692
587 2HB CYS 83 2HB CYS 83 -3.235 1.141 -0.825
588 H ILE 84 H ILE 84 -6.087 -2.298 -0.613
589 HA ILE 84 HA ILE 84 -7.692 -0.563 -2.356
590 HB ILE 84 HB ILE 84 -6.794 -3.406 -2.572
591 1HG1 ILE 84 1HG1 ILE 84 -5.701 -1.354 -3.697
592 2HG1 ILE 84 2HG1 ILE 84 -5.996 -2.788 -4.659
593 1HG2 ILE 84 1HG2 ILE 84 -9.375 -2.271 -3.641
594 2HG2 ILE 84 2HG2 ILE 84 -8.526 -3.608 -4.453
595 3HG2 ILE 84 3HG2 ILE 84 -9.091 -3.800 -2.776
596 1HD1 ILE 84 1HD1 ILE 84 -8.127 -0.644 -4.528
597 2HD1 ILE 84 2HD1 ILE 84 -6.714 -0.421 -5.587
598 3HD1 ILE 84 3HD1 ILE 84 -7.792 -1.817 -5.824
599 H SER 85 H SER 85 -7.727 -3.217 0.084
600 HA SER 85 HA SER 85 -10.414 -3.589 0.219
601 1HB SER 85 1HB SER 85 -8.266 -4.582 1.552
602 2HB SER 85 2HB SER 85 -8.906 -3.546 2.811
603 HG SER 85 HG SER 85 -9.955 -5.924 1.727
604 H CYS 86 H CYS 86 -8.439 -1.438 2.405
605 HA CYS 86 HA CYS 86 -10.631 -0.249 3.612
606 1HB CYS 86 1HB CYS 86 -8.242 -0.215 4.424
607 2HB CYS 86 2HB CYS 86 -7.899 1.010 3.219
608 H HIS 87 H HIS 87 -8.457 0.942 0.940
609 HA HIS 87 HA HIS 87 -9.696 3.280 0.388
610 1HB HIS 87 1HB HIS 87 -8.213 1.280 -1.279
611 2HB HIS 87 2HB HIS 87 -8.989 2.630 -2.083
612 HD1 HIS 87 HD1 HIS 87 -6.723 3.715 -2.737
613 HD2 HIS 87 HD2 HIS 87 -7.266 3.249 1.396
614 HE1 HIS 87 HE1 HIS 87 -4.886 5.085 -1.615
615 H LYS 88 H LYS 88 -10.717 -0.037 -0.518
616 HA LYS 88 HA LYS 88 -12.712 0.698 -2.321
617 1HB LYS 88 1HB LYS 88 -11.929 -1.712 -0.796
618 2HB LYS 88 2HB LYS 88 -13.621 -1.642 -1.244
619 1HG LYS 88 1HG LYS 88 -13.007 -1.250 -3.617
620 2HG LYS 88 2HG LYS 88 -11.307 -1.222 -3.194
621 1HD LYS 88 2HD LYS 88 -11.597 -3.440 -3.935
622 2HD LYS 88 1HD LYS 88 -11.727 -3.612 -2.196
623 1HE LYS 88 1HE LYS 88 -14.334 -3.161 -2.691
624 2HE LYS 88 2HE LYS 88 -13.901 -3.747 -4.285
625 1HZ LYS 88 1HZ LYS 88 -13.311 -5.185 -1.792
626 2HZ LYS 88 2HZ LYS 88 -14.588 -5.500 -2.759
627 3HZ LYS 88 3HZ LYS 88 -13.069 -5.739 -3.309
628 H ASP 89 H ASP 89 -12.761 0.216 1.261
629 HA ASP 89 HA ASP 89 -15.449 0.507 1.609
630 1HB ASP 89 1HB ASP 89 -13.394 0.063 3.269
631 2HB ASP 89 2HB ASP 89 -13.515 1.788 3.550
632 H LYS 90 H LYS 90 -12.798 2.942 1.315
633 HA LYS 90 HA LYS 90 -14.314 5.190 1.998
634 1HB LYS 90 1HB LYS 90 -11.685 4.619 0.764
635 2HB LYS 90 2HB LYS 90 -12.385 6.165 0.331
636 1HG LYS 90 1HG LYS 90 -11.932 5.129 3.169
637 2HG LYS 90 2HG LYS 90 -11.009 6.388 2.371
638 1HD LYS 90 1HD LYS 90 -13.507 7.435 2.067
639 2HD LYS 90 2HD LYS 90 -13.778 6.500 3.524
640 1HE LYS 90 1HE LYS 90 -11.826 7.622 4.615
641 2HE LYS 90 2HE LYS 90 -11.539 8.548 3.155
642 1HZ LYS 90 1HZ LYS 90 -14.180 8.640 4.367
643 2HZ LYS 90 2HZ LYS 90 -12.974 9.509 5.044
644 3HZ LYS 90 3HZ LYS 90 -13.405 9.781 3.492
645 H ALA 91 H ALA 91 -13.788 3.437 -1.094
646 HA ALA 91 HA ALA 91 -15.470 5.376 -2.464
647 1HB ALA 91 1HB ALA 91 -14.669 3.113 -4.070
648 2HB ALA 91 2HB ALA 91 -13.265 3.722 -3.161
649 3HB ALA 91 3HB ALA 91 -14.185 4.819 -4.219
650 H GLY 92 H GLY 92 -16.396 3.453 -0.259
651 1HA GLY 92 2HA GLY 92 -17.954 1.805 0.054
652 2HA GLY 92 1HA GLY 92 -18.079 1.565 -1.677
653 H ASP 93 H ASP 93 -18.951 3.719 -2.881
654 HA ASP 93 HA ASP 93 -21.549 3.939 -2.341
655 1HB ASP 93 1HB ASP 93 -21.622 6.331 -1.308
656 2HB ASP 93 2HB ASP 93 -21.355 4.976 -0.229
657 H ASP 94 H ASP 94 -18.807 6.323 -2.713
658 HA ASP 94 HA ASP 94 -20.133 7.534 -4.928
659 1HB ASP 94 1HB ASP 94 -18.797 8.882 -3.338
660 2HB ASP 94 2HB ASP 94 -17.364 7.943 -3.705
661 H LYS 95 H LYS 95 -19.796 6.927 -7.081
662 HA LYS 95 HA LYS 95 -18.039 4.754 -7.632
663 1HB LYS 95 1HB LYS 95 -19.850 6.472 -9.343
664 2HB LYS 95 2HB LYS 95 -18.852 5.194 -10.008
665 1HG LYS 95 1HG LYS 95 -20.233 3.557 -9.223
666 2HG LYS 95 2HG LYS 95 -20.328 4.282 -7.631
667 1HD LYS 95 1HD LYS 95 -21.780 5.766 -9.779
668 2HD LYS 95 2HD LYS 95 -22.426 4.179 -9.411
669 1HE LYS 95 1HE LYS 95 -23.186 4.823 -7.341
670 2HE LYS 95 2HE LYS 95 -21.746 5.759 -6.992
671 1HZ LYS 95 1HZ LYS 95 -23.526 6.781 -9.031
672 2HZ LYS 95 2HZ LYS 95 -24.029 6.884 -7.481
673 3HZ LYS 95 3HZ LYS 95 -22.629 7.591 -7.933
674 H GLU 96 H GLU 96 -18.058 8.306 -8.215
675 HA GLU 96 HA GLU 96 -15.797 8.293 -9.836
676 1HB GLU 96 1HB GLU 96 -17.425 10.175 -9.679
677 2HB GLU 96 2HB GLU 96 -16.887 10.509 -8.045
678 1HG GLU 96 1HG GLU 96 -14.477 10.643 -9.177
679 2HG GLU 96 2HG GLU 96 -15.394 10.904 -10.648
680 H LEU 97 H LEU 97 -16.269 8.089 -6.343
681 HA LEU 97 HA LEU 97 -13.640 8.933 -5.658
682 1HB LEU 97 1HB LEU 97 -15.759 8.981 -4.241
683 2HB LEU 97 2HB LEU 97 -15.516 7.263 -3.994
684 HG LEU 97 HG LEU 97 -14.655 8.482 -2.105
685 1HD1 LEU 97 1HD1 LEU 97 -13.354 6.488 -3.307
686 2HD1 LEU 97 2HD1 LEU 97 -12.094 7.739 -3.432
687 3HD1 LEU 97 3HD1 LEU 97 -12.741 7.284 -1.837
688 1HD2 LEU 97 1HD2 LEU 97 -13.722 10.326 -4.116
689 2HD2 LEU 97 2HD2 LEU 97 -13.866 10.540 -2.355
690 3HD2 LEU 97 3HD2 LEU 97 -12.382 9.845 -3.048
691 H LYS 98 H LYS 98 -15.074 6.022 -6.937
692 HA LYS 98 HA LYS 98 -12.943 4.341 -5.948
693 1HB LYS 98 1HB LYS 98 -15.390 3.653 -6.220
694 2HB LYS 98 2HB LYS 98 -15.094 3.619 -7.946
695 1HG LYS 98 1HG LYS 98 -13.327 1.941 -7.679
696 2HG LYS 98 2HG LYS 98 -13.395 2.077 -5.933
697 1HD LYS 98 2HD LYS 98 -14.641 0.094 -6.517
698 2HD LYS 98 1HD LYS 98 -15.818 1.299 -6.033
699 1HE LYS 98 1HE LYS 98 -16.716 0.378 -8.039
700 2HE LYS 98 2HE LYS 98 -16.023 1.906 -8.543
701 1HZ LYS 98 1HZ LYS 98 -13.974 0.160 -8.751
702 2HZ LYS 98 2HZ LYS 98 -15.252 -0.721 -9.258
703 3HZ LYS 98 3HZ LYS 98 -14.898 0.696 -9.987
704 H LYS 99 H LYS 99 -12.632 6.801 -7.846
705 HA LYS 99 HA LYS 99 -11.027 5.333 -9.816
706 1HB LYS 99 1HB LYS 99 -13.094 7.433 -10.245
707 2HB LYS 99 2HB LYS 99 -11.627 7.570 -11.193
708 1HG LYS 99 2HG LYS 99 -12.589 6.062 -12.605
709 2HG LYS 99 1HG LYS 99 -12.168 4.856 -11.405
710 1HD LYS 99 1HD LYS 99 -14.518 5.820 -10.339
711 2HD LYS 99 2HD LYS 99 -14.831 6.044 -12.048
712 1HE LYS 99 1HE LYS 99 -13.619 3.410 -11.327
713 2HE LYS 99 2HE LYS 99 -15.234 3.676 -10.701
714 1HZ LYS 99 1HZ LYS 99 -15.836 4.342 -13.008
715 2HZ LYS 99 2HZ LYS 99 -14.382 3.785 -13.503
716 3HZ LYS 99 3HZ LYS 99 -15.460 2.763 -12.824
717 H LYS 100 H LYS 100 -10.014 6.028 -7.325
718 HA LYS 100 HA LYS 100 -7.914 7.768 -8.116
719 1HB LYS 100 1HB LYS 100 -8.534 9.213 -5.907
720 2HB LYS 100 2HB LYS 100 -8.917 9.696 -7.547
721 1HG LYS 100 1HG LYS 100 -11.178 8.869 -7.378
722 2HG LYS 100 2HG LYS 100 -10.823 7.971 -5.915
723 1HD LYS 100 2HD LYS 100 -11.905 9.869 -5.052
724 2HD LYS 100 1HD LYS 100 -10.220 10.321 -4.888
725 1HE LYS 100 1HE LYS 100 -11.992 11.093 -7.256
726 2HE LYS 100 2HE LYS 100 -11.642 12.142 -5.897
727 1HZ LYS 100 1HZ LYS 100 -9.205 11.400 -6.632
728 2HZ LYS 100 2HZ LYS 100 -9.954 11.391 -8.083
729 3HZ LYS 100 3HZ LYS 100 -9.945 12.750 -7.179
730 H LEU 101 H LEU 101 -9.715 6.248 -5.369
731 HA LEU 101 HA LEU 101 -7.192 5.691 -4.059
732 1HB LEU 101 1HB LEU 101 -9.962 4.908 -3.169
733 2HB LEU 101 2HB LEU 101 -8.503 5.002 -2.202
734 HG LEU 101 HG LEU 101 -10.187 7.254 -3.289
735 1HD1 LEU 101 1HD1 LEU 101 -10.351 5.965 -0.935
736 2HD1 LEU 101 2HD1 LEU 101 -9.152 7.210 -0.508
737 3HD1 LEU 101 3HD1 LEU 101 -10.745 7.689 -1.142
738 1HD2 LEU 101 1HD2 LEU 101 -7.278 7.261 -2.764
739 2HD2 LEU 101 2HD2 LEU 101 -8.275 8.337 -3.772
740 3HD2 LEU 101 3HD2 LEU 101 -8.202 8.583 -2.010
741 H THR 102 H THR 102 -9.683 4.127 -6.043
742 HA THR 102 HA THR 102 -8.107 1.643 -5.868
743 HB THR 102 HB THR 102 -10.193 0.405 -5.963
744 HG1 THR 102 HG1 THR 102 -11.356 1.725 -7.446
745 1HG2 THR 102 1HG2 THR 102 -9.716 1.615 -3.712
746 2HG2 THR 102 2HG2 THR 102 -10.908 2.825 -4.242
747 3HG2 THR 102 3HG2 THR 102 -11.403 1.131 -4.005
748 H GLY 103 H GLY 103 -8.432 4.255 -7.708
749 1HA GLY 103 2HA GLY 103 -8.274 4.701 -9.906
750 2HA GLY 103 1HA GLY 103 -9.266 3.291 -10.223
751 H CYS 104 H CYS 104 -8.253 2.017 -11.716
752 HA CYS 104 HA CYS 104 -5.791 0.819 -11.058
753 1HB CYS 104 1HB CYS 104 -7.838 0.562 -13.123
754 2HB CYS 104 2HB CYS 104 -6.220 0.332 -13.757
755 H LYS 105 H LYS 105 -6.839 3.077 -13.722
756 HA LYS 105 HA LYS 105 -4.062 4.035 -13.799
757 1HB LYS 105 1HB LYS 105 -4.385 4.432 -16.213
758 2HB LYS 105 2HB LYS 105 -4.490 2.736 -15.787
759 1HG LYS 105 1HG LYS 105 -6.836 2.661 -16.089
760 2HG LYS 105 2HG LYS 105 -7.025 4.389 -15.866
761 1HD LYS 105 1HD LYS 105 -6.083 4.872 -18.045
762 2HD LYS 105 2HD LYS 105 -5.502 3.230 -18.237
763 1HE LYS 105 1HE LYS 105 -8.466 3.906 -17.962
764 2HE LYS 105 2HE LYS 105 -7.656 3.818 -19.514
765 1HZ LYS 105 1HZ LYS 105 -6.904 1.534 -18.578
766 2HZ LYS 105 2HZ LYS 105 -8.232 1.682 -17.640
767 3HZ LYS 105 3HZ LYS 105 -8.375 1.702 -19.266
768 H GLY 106 H GLY 106 -3.741 6.261 -13.796
769 1HA GLY 106 2HA GLY 106 -5.871 8.104 -14.260
770 2HA GLY 106 1HA GLY 106 -4.259 8.457 -13.670
771 H SER 107 H SER 107 -4.257 6.686 -11.357
772 HA SER 107 HA SER 107 -6.381 7.930 -9.793
773 1HB SER 107 2HB SER 107 -6.289 6.037 -8.293
774 2HB SER 107 1HB SER 107 -6.393 5.409 -9.926
775 HG SER 107 HG SER 107 -4.759 4.226 -8.990
776 H ALA 108 H ALA 108 -5.514 7.824 -7.244
777 HA ALA 108 HA ALA 108 -3.352 9.689 -7.236
778 1HB ALA 108 1HB ALA 108 -4.292 10.267 -5.272
779 2HB ALA 108 3HB ALA 108 -5.551 9.055 -5.610
780 3HB ALA 108 2HB ALA 108 -4.129 8.612 -4.635
781 H CYS 109 H CYS 109 -3.440 6.371 -7.611
782 HA CYS 109 HA CYS 109 -1.023 5.983 -6.015
783 1HB CYS 109 1HB CYS 109 -2.999 3.991 -7.164
784 2HB CYS 109 2HB CYS 109 -1.466 3.527 -6.453
785 H HIS 110 H HIS 110 -2.545 5.447 -9.265
786 HA HIS 110 HA HIS 110 0.172 5.381 -10.363
787 1HB HIS 110 1HB HIS 110 -2.309 3.965 -11.379
788 2HB HIS 110 2HB HIS 110 -0.757 3.989 -12.193
789 HD1 HIS 110 HD1 HIS 110 1.260 3.269 -10.118
790 HD2 HIS 110 HD2 HIS 110 -2.560 1.537 -10.180
791 HE1 HIS 110 HE1 HIS 110 1.451 1.070 -8.837
792 HA PRO 111 HA PRO 111 -1.807 9.034 -12.192
793 1HB PRO 111 1HB PRO 111 -0.104 10.931 -11.341
794 2HB PRO 111 2HB PRO 111 -1.232 10.152 -10.184
795 1HG PRO 111 2HG PRO 111 1.463 9.545 -10.932
796 2HG PRO 111 1HG PRO 111 1.239 9.525 -9.152
797 1HD PRO 111 1HD PRO 111 1.381 7.209 -10.539
798 2HD PRO 111 2HD PRO 111 0.149 7.390 -9.254
799 H SER 112 H SER 112 -0.929 7.532 -14.098
800 HA SER 112 HA SER 112 1.320 8.997 -15.227
801 1HB SER 112 1HB SER 112 1.304 6.247 -14.494
802 2HB SER 112 2HB SER 112 1.183 6.268 -16.242
803 HG SER 112 HG SER 112 3.040 7.926 -16.062
No H/Q in entry = 803
Start of MODEL 15
1 H1 VAL 1 H1 VAL 1 9.254 9.561 17.433
2 H2 VAL 1 H2 VAL 1 8.647 8.046 17.150
3 H3 VAL 1 H3 VAL 1 10.057 8.227 17.998
4 HA VAL 1 HA VAL 1 11.296 8.713 16.240
5 HB VAL 1 HB VAL 1 10.692 6.437 16.058
6 1HG1 VAL 1 1HG1 VAL 1 8.247 6.728 16.338
7 2HG1 VAL 1 2HG1 VAL 1 8.137 7.280 14.649
8 3HG1 VAL 1 3HG1 VAL 1 8.655 5.616 15.010
9 1HG2 VAL 1 1HG2 VAL 1 11.613 7.782 13.971
10 2HG2 VAL 1 2HG2 VAL 1 11.188 6.058 13.844
11 3HG2 VAL 1 3HG2 VAL 1 10.055 7.300 13.259
12 H ASP 2 H ASP 2 8.179 10.054 16.288
13 HA ASP 2 HA ASP 2 7.192 11.625 15.168
14 1HB ASP 2 1HB ASP 2 9.879 12.349 15.183
15 2HB ASP 2 2HB ASP 2 9.497 12.440 13.476
16 H VAL 3 H VAL 3 5.749 10.943 13.575
17 HA VAL 3 HA VAL 3 6.357 9.146 11.575
18 HB VAL 3 HB VAL 3 4.122 10.109 12.599
19 1HG1 VAL 3 1HG1 VAL 3 4.436 11.707 10.036
20 2HG1 VAL 3 2HG1 VAL 3 2.921 11.527 10.954
21 3HG1 VAL 3 3HG1 VAL 3 4.315 12.355 11.689
22 1HG2 VAL 3 1HG2 VAL 3 4.523 8.977 9.819
23 2HG2 VAL 3 2HG2 VAL 3 4.106 8.112 11.318
24 3HG2 VAL 3 3HG2 VAL 3 2.915 9.191 10.552
25 HA PRO 4 HA PRO 4 9.105 11.273 8.878
26 1HB PRO 4 1HB PRO 4 7.579 9.538 6.905
27 2HB PRO 4 2HB PRO 4 9.342 9.799 7.109
28 1HG PRO 4 1HG PRO 4 8.316 7.553 8.201
29 2HG PRO 4 2HG PRO 4 9.631 8.501 8.970
30 1HD PRO 4 2HD PRO 4 6.683 8.315 9.646
31 2HD PRO 4 1HD PRO 4 8.078 8.602 10.730
32 H ALA 5 H ALA 5 8.908 12.723 6.900
33 HA ALA 5 HA ALA 5 6.374 14.116 7.045
34 1HB ALA 5 1HB ALA 5 7.588 15.931 6.415
35 2HB ALA 5 2HB ALA 5 8.469 15.029 5.158
36 3HB ALA 5 3HB ALA 5 8.989 14.926 6.857
37 H ASP 6 H ASP 6 5.111 14.646 5.122
38 HA ASP 6 HA ASP 6 4.540 12.468 3.599
39 1HB ASP 6 2HB ASP 6 3.028 13.863 2.462
40 2HB ASP 6 1HB ASP 6 3.262 14.726 3.969
41 H GLY 7 H GLY 7 4.441 13.329 0.866
42 1HA GLY 7 2HA GLY 7 6.928 14.321 -0.079
43 2HA GLY 7 1HA GLY 7 5.659 13.559 -1.016
44 H ALA 8 H ALA 8 5.592 11.059 0.604
45 HA ALA 8 HA ALA 8 8.267 9.984 0.281
46 1HB ALA 8 1HB ALA 8 5.658 8.945 1.439
47 2HB ALA 8 2HB ALA 8 7.152 9.373 2.306
48 3HB ALA 8 3HB ALA 8 7.109 7.929 1.266
49 H LYS 9 H LYS 9 8.887 8.528 -1.307
50 HA LYS 9 HA LYS 9 6.813 7.919 -3.300
51 1HB LYS 9 1HB LYS 9 9.738 8.602 -3.704
52 2HB LYS 9 2HB LYS 9 8.710 7.939 -4.958
53 1HG LYS 9 1HG LYS 9 7.348 9.870 -5.060
54 2HG LYS 9 2HG LYS 9 7.769 10.381 -3.438
55 1HD LYS 9 1HD LYS 9 10.160 10.770 -4.285
56 2HD LYS 9 2HD LYS 9 9.560 10.479 -5.906
57 1HE LYS 9 1HE LYS 9 7.774 12.324 -5.353
58 2HE LYS 9 2HE LYS 9 8.824 12.742 -4.014
59 1HZ LYS 9 1HZ LYS 9 9.837 12.521 -6.753
60 2HZ LYS 9 2HZ LYS 9 9.225 13.916 -6.166
61 3HZ LYS 9 3HZ LYS 9 10.546 13.250 -5.476
62 H ILE 10 H ILE 10 6.576 5.796 -3.929
63 HA ILE 10 HA ILE 10 8.411 3.913 -2.617
64 HB ILE 10 HB ILE 10 5.509 3.511 -3.349
65 1HG1 ILE 10 1HG1 ILE 10 6.525 3.693 -0.530
66 2HG1 ILE 10 2HG1 ILE 10 6.194 5.166 -1.419
67 1HG2 ILE 10 1HG2 ILE 10 7.617 1.670 -2.722
68 2HG2 ILE 10 2HG2 ILE 10 6.407 1.652 -1.416
69 3HG2 ILE 10 3HG2 ILE 10 5.907 1.346 -3.097
70 1HD1 ILE 10 1HD1 ILE 10 3.896 4.069 -2.007
71 2HD1 ILE 10 2HD1 ILE 10 4.269 2.940 -0.683
72 3HD1 ILE 10 3HD1 ILE 10 4.133 4.684 -0.354
73 H ASP 11 H ASP 11 9.658 2.684 -3.925
74 HA ASP 11 HA ASP 11 8.637 1.936 -6.484
75 1HB ASP 11 1HB ASP 11 9.604 4.002 -7.204
76 2HB ASP 11 2HB ASP 11 10.979 3.834 -6.131
77 H PHE 12 H PHE 12 8.907 -0.236 -5.640
78 HA PHE 12 HA PHE 12 11.694 -0.972 -5.081
79 1HB PHE 12 2HB PHE 12 9.021 -2.257 -4.254
80 2HB PHE 12 1HB PHE 12 10.599 -2.824 -3.745
81 HD1 PHE 12 HD1 PHE 12 11.870 -0.142 -3.172
82 HD2 PHE 12 HD2 PHE 12 8.056 -1.717 -2.181
83 HE1 PHE 12 HE1 PHE 12 11.767 1.367 -1.169
84 HE2 PHE 12 HE2 PHE 12 7.953 -0.207 -0.179
85 HZ PHE 12 HZ PHE 12 9.810 1.317 0.304
86 H ILE 13 H ILE 13 8.809 -1.494 -7.039
87 HA ILE 13 HA ILE 13 10.014 -3.895 -8.194
88 HB ILE 13 HB ILE 13 7.237 -2.731 -8.413
89 1HG1 ILE 13 1HG1 ILE 13 8.121 -5.299 -7.075
90 2HG1 ILE 13 2HG1 ILE 13 7.941 -3.783 -6.214
91 1HG2 ILE 13 1HG2 ILE 13 8.225 -3.992 -10.453
92 2HG2 ILE 13 2HG2 ILE 13 8.040 -5.441 -9.437
93 3HG2 ILE 13 3HG2 ILE 13 6.618 -4.450 -9.840
94 1HD1 ILE 13 1HD1 ILE 13 5.703 -4.974 -7.906
95 2HD1 ILE 13 2HD1 ILE 13 5.899 -5.323 -6.171
96 3HD1 ILE 13 3HD1 ILE 13 5.583 -3.657 -6.714
97 H ALA 14 H ALA 14 11.725 -2.867 -9.351
98 HA ALA 14 HA ALA 14 11.313 -0.663 -11.027
99 1HB ALA 14 1HB ALA 14 13.528 -1.168 -10.340
100 2HB ALA 14 2HB ALA 14 13.488 -1.564 -12.075
101 3HB ALA 14 3HB ALA 14 13.393 -2.864 -10.863
102 H GLY 15 H GLY 15 11.876 -0.950 -13.541
103 1HA GLY 15 2HA GLY 15 9.873 -1.605 -15.025
104 2HA GLY 15 1HA GLY 15 10.372 -3.236 -14.623
105 H GLY 16 H GLY 16 11.988 -0.122 -15.609
106 1HA GLY 16 2HA GLY 16 13.153 -1.467 -17.913
107 2HA GLY 16 1HA GLY 16 14.281 -0.936 -16.682
108 H GLU 17 H GLU 17 11.684 0.163 -18.920
109 HA GLU 17 HA GLU 17 13.122 2.446 -19.593
110 1HB GLU 17 1HB GLU 17 10.571 1.182 -20.313
111 2HB GLU 17 2HB GLU 17 10.446 2.930 -20.318
112 1HG GLU 17 2HG GLU 17 12.465 1.236 -21.857
113 2HG GLU 17 1HG GLU 17 11.162 2.191 -22.535
114 H LYS 18 H LYS 18 10.243 1.911 -17.464
115 HA LYS 18 HA LYS 18 10.922 4.404 -16.116
116 1HB LYS 18 1HB LYS 18 8.722 4.146 -17.916
117 2HB LYS 18 2HB LYS 18 8.067 4.242 -16.294
118 1HG LYS 18 1HG LYS 18 9.448 6.285 -15.858
119 2HG LYS 18 2HG LYS 18 10.102 6.190 -17.481
120 1HD LYS 18 1HD LYS 18 7.608 6.248 -18.279
121 2HD LYS 18 2HD LYS 18 7.236 6.778 -16.651
122 1HE LYS 18 1HE LYS 18 9.462 8.358 -17.506
123 2HE LYS 18 2HE LYS 18 8.349 8.316 -18.859
124 1HZ LYS 18 1HZ LYS 18 7.300 8.809 -16.191
125 2HZ LYS 18 2HZ LYS 18 8.039 10.028 -16.989
126 3HZ LYS 18 3HZ LYS 18 6.722 9.308 -17.635
127 H ASN 19 H ASN 19 8.565 4.310 -14.413
128 HA ASN 19 HA ASN 19 8.333 1.729 -13.340
129 1HB ASN 19 2HB ASN 19 9.587 1.938 -11.301
130 2HB ASN 19 1HB ASN 19 10.684 2.491 -12.551
131 2HD2 ASN 19 2HD2 ASN 19 10.246 4.932 -13.123
132 1HD2 ASN 19 1HD2 ASN 19 10.251 6.015 -11.771
133 H LEU 20 H LEU 20 6.401 1.731 -12.114
134 HA LEU 20 HA LEU 20 4.979 4.199 -11.951
135 1HB LEU 20 1HB LEU 20 4.359 1.373 -11.098
136 2HB LEU 20 2HB LEU 20 3.253 2.711 -10.857
137 HG LEU 20 HG LEU 20 4.219 1.560 -13.481
138 1HD1 LEU 20 1HD1 LEU 20 1.517 1.730 -12.131
139 2HD1 LEU 20 2HD1 LEU 20 1.740 1.292 -13.842
140 3HD1 LEU 20 3HD1 LEU 20 2.445 0.273 -12.563
141 1HD2 LEU 20 1HD2 LEU 20 3.214 4.263 -12.883
142 2HD2 LEU 20 2HD2 LEU 20 4.125 3.651 -14.285
143 3HD2 LEU 20 3HD2 LEU 20 2.361 3.424 -14.201
144 H THR 21 H THR 21 6.002 5.632 -10.549
145 HA THR 21 HA THR 21 6.657 4.676 -7.877
146 HB THR 21 HB THR 21 6.974 7.531 -8.827
147 HG1 THR 21 HG1 THR 21 8.511 5.142 -9.577
148 1HG2 THR 21 1HG2 THR 21 8.289 5.617 -6.944
149 2HG2 THR 21 2HG2 THR 21 9.409 6.602 -7.915
150 3HG2 THR 21 3HG2 THR 21 8.204 7.393 -6.871
151 H VAL 22 H VAL 22 5.098 4.543 -6.394
152 HA VAL 22 HA VAL 22 2.825 6.337 -6.644
153 HB VAL 22 HB VAL 22 3.412 3.889 -4.978
154 1HG1 VAL 22 1HG1 VAL 22 1.042 5.772 -4.877
155 2HG1 VAL 22 2HG1 VAL 22 0.964 4.089 -4.304
156 3HG1 VAL 22 3HG1 VAL 22 2.090 5.237 -3.540
157 1HG2 VAL 22 1HG2 VAL 22 2.007 4.439 -7.520
158 2HG2 VAL 22 2HG2 VAL 22 2.763 2.943 -6.922
159 3HG2 VAL 22 3HG2 VAL 22 1.127 3.389 -6.383
160 H VAL 23 H VAL 23 2.325 7.960 -5.178
161 HA VAL 23 HA VAL 23 4.457 8.533 -3.252
162 HB VAL 23 HB VAL 23 2.364 10.292 -4.543
163 1HG1 VAL 23 1HG1 VAL 23 3.950 10.669 -2.139
164 2HG1 VAL 23 2HG1 VAL 23 4.341 11.896 -3.368
165 3HG1 VAL 23 3HG1 VAL 23 2.659 11.686 -2.823
166 1HG2 VAL 23 1HG2 VAL 23 5.340 9.951 -4.986
167 2HG2 VAL 23 2HG2 VAL 23 4.018 9.780 -6.165
168 3HG2 VAL 23 3HG2 VAL 23 4.441 11.388 -5.530
169 H PHE 24 H PHE 24 4.042 8.622 -1.068
170 HA PHE 24 HA PHE 24 1.234 8.231 -0.304
171 1HB PHE 24 1HB PHE 24 2.899 6.228 -0.135
172 2HB PHE 24 2HB PHE 24 3.777 7.166 1.056
173 HD1 PHE 24 HD1 PHE 24 0.235 6.141 0.419
174 HD2 PHE 24 HD2 PHE 24 3.352 6.652 3.253
175 HE1 PHE 24 HE1 PHE 24 -1.261 5.249 2.226
176 HE2 PHE 24 HE2 PHE 24 1.855 5.760 5.060
177 HZ PHE 24 HZ PHE 24 -0.433 5.069 4.524
178 H ASN 25 H ASN 25 0.924 8.765 2.146
179 HA ASN 25 HA ASN 25 2.761 10.773 3.059
180 1HB ASN 25 1HB ASN 25 -0.004 11.762 3.316
181 2HB ASN 25 2HB ASN 25 1.417 12.607 2.736
182 2HD2 ASN 25 2HD2 ASN 25 -1.462 10.974 1.934
183 1HD2 ASN 25 1HD2 ASN 25 -1.362 11.047 0.207
184 H HIS 26 H HIS 26 2.934 10.481 5.297
185 HA HIS 26 HA HIS 26 1.174 8.621 6.548
186 1HB HIS 26 1HB HIS 26 3.697 10.041 7.230
187 2HB HIS 26 2HB HIS 26 2.691 9.549 8.577
188 HD1 HIS 26 HD1 HIS 26 4.621 8.101 5.645
189 HD2 HIS 26 HD2 HIS 26 2.696 6.817 9.144
190 HE1 HIS 26 HE1 HIS 26 5.252 5.647 5.949
191 H SER 27 H SER 27 1.202 12.034 6.000
192 HA SER 27 HA SER 27 -0.312 12.594 8.375
193 1HB SER 27 1HB SER 27 -0.285 14.930 7.555
194 2HB SER 27 2HB SER 27 1.329 14.248 7.578
195 HG SER 27 HG SER 27 1.135 13.841 5.275
196 H THR 28 H THR 28 -1.182 10.791 5.957
197 HA THR 28 HA THR 28 -3.710 12.206 5.413
198 HB THR 28 HB THR 28 -2.202 10.122 3.746
199 HG1 THR 28 HG1 THR 28 -2.671 13.016 3.681
200 1HG2 THR 28 1HG2 THR 28 -4.927 11.256 3.602
201 2HG2 THR 28 2HG2 THR 28 -3.969 11.615 2.145
202 3HG2 THR 28 3HG2 THR 28 -4.213 9.927 2.657
203 H HIS 29 H HIS 29 -2.116 9.241 6.547
204 HA HIS 29 HA HIS 29 -4.779 8.128 7.029
205 1HB HIS 29 2HB HIS 29 -2.093 6.725 6.968
206 2HB HIS 29 1HB HIS 29 -3.648 5.959 7.224
207 HD1 HIS 29 HD1 HIS 29 -1.760 7.890 4.521
208 HD2 HIS 29 HD2 HIS 29 -4.969 5.219 4.919
209 HE1 HIS 29 HE1 HIS 29 -2.454 7.247 2.151
210 H LYS 30 H LYS 30 -3.275 10.295 8.568
211 HA LYS 30 HA LYS 30 -2.219 9.258 10.908
212 1HB LYS 30 1HB LYS 30 -2.513 11.471 11.810
213 2HB LYS 30 2HB LYS 30 -2.007 11.599 10.137
214 1HG LYS 30 1HG LYS 30 -4.497 11.811 9.518
215 2HG LYS 30 2HG LYS 30 -4.831 11.955 11.233
216 1HD LYS 30 1HD LYS 30 -2.648 13.742 10.328
217 2HD LYS 30 2HD LYS 30 -4.171 14.061 9.521
218 1HE LYS 30 1HE LYS 30 -4.811 13.659 12.279
219 2HE LYS 30 2HE LYS 30 -3.391 14.685 12.258
220 1HZ LYS 30 1HZ LYS 30 -5.319 15.432 10.308
221 2HZ LYS 30 2HZ LYS 30 -5.911 15.504 11.828
222 3HZ LYS 30 3HZ LYS 30 -4.570 16.349 11.434
223 H ASP 31 H ASP 31 -5.464 9.201 9.684
224 HA ASP 31 HA ASP 31 -6.641 9.043 12.282
225 1HB ASP 31 1HB ASP 31 -8.080 9.998 10.664
226 2HB ASP 31 2HB ASP 31 -7.610 8.853 9.424
227 H VAL 32 H VAL 32 -4.749 7.006 10.409
228 HA VAL 32 HA VAL 32 -6.200 4.602 11.276
229 HB VAL 32 HB VAL 32 -4.160 4.874 9.063
230 1HG1 VAL 32 1HG1 VAL 32 -4.787 2.617 10.361
231 2HG1 VAL 32 2HG1 VAL 32 -6.135 2.641 9.199
232 3HG1 VAL 32 3HG1 VAL 32 -4.455 2.654 8.612
233 1HG2 VAL 32 1HG2 VAL 32 -6.359 6.154 8.735
234 2HG2 VAL 32 2HG2 VAL 32 -5.896 4.988 7.472
235 3HG2 VAL 32 3HG2 VAL 32 -7.141 4.556 8.669
236 H LYS 33 H LYS 33 -5.244 3.307 12.780
237 HA LYS 33 HA LYS 33 -3.105 4.176 14.257
238 1HB LYS 33 2HB LYS 33 -4.035 1.313 13.884
239 2HB LYS 33 1HB LYS 33 -3.089 1.929 15.224
240 1HG LYS 33 1HG LYS 33 -5.467 3.582 14.842
241 2HG LYS 33 2HG LYS 33 -5.927 1.897 14.983
242 1HD LYS 33 1HD LYS 33 -4.497 1.739 17.076
243 2HD LYS 33 2HD LYS 33 -4.198 3.462 16.956
244 1HE LYS 33 1HE LYS 33 -7.076 2.787 16.778
245 2HE LYS 33 2HE LYS 33 -6.350 2.268 18.287
246 1HZ LYS 33 1HZ LYS 33 -5.756 4.941 17.320
247 2HZ LYS 33 2HZ LYS 33 -7.216 4.667 17.999
248 3HZ LYS 33 3HZ LYS 33 -5.853 4.394 18.856
249 H CYS 34 H CYS 34 -0.908 3.183 14.513
250 HA CYS 34 HA CYS 34 0.373 3.191 11.983
251 1HB CYS 34 1HB CYS 34 1.627 2.434 14.620
252 2HB CYS 34 2HB CYS 34 2.415 3.067 13.189
253 H ASP 35 H ASP 35 -0.513 0.769 14.502
254 HA ASP 35 HA ASP 35 0.878 -1.342 13.331
255 1HB ASP 35 1HB ASP 35 -0.673 -2.766 14.744
256 2HB ASP 35 2HB ASP 35 0.169 -1.513 15.634
257 H ASP 36 H ASP 36 -1.807 0.460 12.273
258 HA ASP 36 HA ASP 36 -3.498 -1.529 11.333
259 1HB ASP 36 1HB ASP 36 -3.752 1.105 11.531
260 2HB ASP 36 2HB ASP 36 -3.100 1.117 9.904
261 H CYS 37 H CYS 37 -0.350 -0.410 10.347
262 HA CYS 37 HA CYS 37 -0.625 -1.915 7.855
263 1HB CYS 37 1HB CYS 37 0.770 0.758 8.193
264 2HB CYS 37 2HB CYS 37 0.972 -0.281 6.797
265 H HIS 38 H HIS 38 1.567 -0.414 10.330
266 HA HIS 38 HA HIS 38 3.696 -2.190 9.671
267 1HB HIS 38 1HB HIS 38 3.326 -0.293 12.006
268 2HB HIS 38 2HB HIS 38 4.810 -1.140 11.619
269 HD1 HIS 38 HD1 HIS 38 5.835 -0.539 9.122
270 HD2 HIS 38 HD2 HIS 38 3.061 2.143 10.769
271 HE1 HIS 38 HE1 HIS 38 6.111 1.652 7.843
272 H HIS 39 H HIS 39 2.537 -4.255 9.858
273 HA HIS 39 HA HIS 39 1.741 -4.959 12.553
274 1HB HIS 39 2HB HIS 39 0.623 -6.780 11.621
275 2HB HIS 39 1HB HIS 39 0.393 -5.493 10.454
276 HD1 HIS 39 HD1 HIS 39 1.510 -8.949 10.723
277 HD2 HIS 39 HD2 HIS 39 2.296 -5.722 8.160
278 HE1 HIS 39 HE1 HIS 39 2.545 -9.946 8.614
279 H GLN 40 H GLN 40 4.455 -4.349 12.425
280 HA GLN 40 HA GLN 40 5.690 -6.986 12.339
281 1HB GLN 40 1HB GLN 40 6.746 -4.189 11.903
282 2HB GLN 40 2HB GLN 40 7.848 -5.438 12.448
283 1HG GLN 40 1HG GLN 40 7.545 -5.067 9.868
284 2HG GLN 40 2HG GLN 40 7.612 -6.709 10.478
285 2HE2 GLN 40 2HE2 GLN 40 5.804 -7.989 10.520
286 1HE2 GLN 40 1HE2 GLN 40 4.328 -7.603 9.699
287 HA PRO 41 HA PRO 41 6.179 -7.289 16.667
288 1HB PRO 41 1HB PRO 41 8.902 -8.026 16.757
289 2HB PRO 41 2HB PRO 41 7.524 -9.127 16.432
290 1HG PRO 41 1HG PRO 41 9.317 -7.769 14.516
291 2HG PRO 41 2HG PRO 41 8.789 -9.479 14.384
292 1HD PRO 41 1HD PRO 41 7.567 -7.636 12.885
293 2HD PRO 41 2HD PRO 41 6.542 -8.783 13.801
294 H GLY 42 H GLY 42 7.087 -6.111 18.515
295 1HA GLY 42 2HA GLY 42 8.095 -4.383 19.549
296 2HA GLY 42 1HA GLY 42 7.587 -3.451 18.154
297 H ASP 43 H ASP 43 9.783 -2.417 19.120
298 HA ASP 43 HA ASP 43 11.912 -2.016 18.898
299 1HB ASP 43 1HB ASP 43 11.892 -4.820 18.871
300 2HB ASP 43 2HB ASP 43 12.764 -4.424 17.404
301 H LYS 44 H LYS 44 11.086 -4.212 16.095
302 HA LYS 44 HA LYS 44 11.968 -2.068 14.298
303 1HB LYS 44 1HB LYS 44 12.417 -3.784 12.670
304 2HB LYS 44 2HB LYS 44 13.220 -4.197 14.172
305 1HG LYS 44 1HG LYS 44 11.215 -5.672 14.747
306 2HG LYS 44 2HG LYS 44 10.592 -5.360 13.139
307 1HD LYS 44 1HD LYS 44 11.768 -7.307 12.693
308 2HD LYS 44 2HD LYS 44 13.047 -6.147 12.394
309 1HE LYS 44 1HE LYS 44 13.476 -6.444 15.030
310 2HE LYS 44 2HE LYS 44 12.655 -7.970 14.770
311 1HZ LYS 44 1HZ LYS 44 14.827 -7.162 12.997
312 2HZ LYS 44 2HZ LYS 44 15.157 -7.853 14.439
313 3HZ LYS 44 3HZ LYS 44 14.281 -8.665 13.326
314 H GLN 45 H GLN 45 9.319 -2.352 15.771
315 HA GLN 45 HA GLN 45 7.288 -3.303 14.394
316 1HB GLN 45 1HB GLN 45 7.184 -1.904 16.490
317 2HB GLN 45 2HB GLN 45 7.356 -0.464 15.507
318 1HG GLN 45 1HG GLN 45 5.185 -0.547 14.769
319 2HG GLN 45 2HG GLN 45 5.218 -2.286 14.553
320 2HE2 GLN 45 2HE2 GLN 45 3.032 -2.026 15.452
321 1HE2 GLN 45 1HE2 GLN 45 2.812 -2.079 17.170
322 H TYR 46 H TYR 46 9.230 -0.480 13.532
323 HA TYR 46 HA TYR 46 7.648 -0.141 11.036
324 1HB TYR 46 1HB TYR 46 9.723 1.730 12.205
325 2HB TYR 46 2HB TYR 46 8.532 2.077 10.940
326 HD1 TYR 46 HD1 TYR 46 6.069 2.115 11.558
327 HD2 TYR 46 HD2 TYR 46 9.208 2.045 14.489
328 HE1 TYR 46 HE1 TYR 46 4.481 2.933 13.278
329 HE2 TYR 46 HE2 TYR 46 7.621 2.863 16.209
330 HH TYR 46 HH TYR 46 5.437 4.108 16.340
331 H ALA 47 H ALA 47 8.668 -2.046 9.988
332 HA ALA 47 HA ALA 47 11.448 -1.441 9.240
333 1HB ALA 47 1HB ALA 47 10.263 -3.798 10.441
334 2HB ALA 47 3HB ALA 47 11.972 -3.457 10.081
335 3HB ALA 47 2HB ALA 47 10.931 -4.196 8.841
336 H GLY 48 H GLY 48 11.841 -3.028 7.099
337 1HA GLY 48 2HA GLY 48 11.531 -2.938 4.860
338 2HA GLY 48 1HA GLY 48 10.231 -1.785 5.087
339 H CYS 49 H CYS 49 8.703 -2.726 3.694
340 HA CYS 49 HA CYS 49 7.326 -4.970 4.796
341 1HB CYS 49 2HB CYS 49 6.767 -3.614 2.159
342 2HB CYS 49 1HB CYS 49 5.669 -4.569 3.135
343 H THR 50 H THR 50 9.628 -4.243 2.173
344 HA THR 50 HA THR 50 9.307 -6.912 1.044
345 HB THR 50 HB THR 50 10.950 -5.940 -0.645
346 HG1 THR 50 HG1 THR 50 11.732 -3.887 -0.143
347 1HG2 THR 50 1HG2 THR 50 8.243 -4.889 -0.058
348 2HG2 THR 50 2HG2 THR 50 9.272 -3.712 -0.909
349 3HG2 THR 50 3HG2 THR 50 8.969 -5.312 -1.627
350 H THR 51 H THR 51 10.415 -6.279 3.845
351 HA THR 51 HA THR 51 13.188 -6.853 3.726
352 HB THR 51 HB THR 51 11.204 -7.274 6.018
353 HG1 THR 51 HG1 THR 51 12.675 -4.978 4.932
354 1HG2 THR 51 1HG2 THR 51 14.197 -6.731 5.797
355 2HG2 THR 51 2HG2 THR 51 13.284 -6.292 7.260
356 3HG2 THR 51 3HG2 THR 51 13.377 -7.993 6.747
357 H ASP 52 H ASP 52 14.284 -8.799 4.464
358 HA ASP 52 HA ASP 52 13.504 -10.984 3.045
359 1HB ASP 52 1HB ASP 52 15.644 -10.252 4.728
360 2HB ASP 52 2HB ASP 52 14.987 -11.683 5.497
361 H GLY 53 H GLY 53 12.719 -13.153 3.838
362 1HA GLY 53 2HA GLY 53 11.796 -13.672 6.406
363 2HA GLY 53 1HA GLY 53 11.260 -14.460 4.936
364 H CYS 54 H CYS 54 10.535 -11.506 3.979
365 HA CYS 54 HA CYS 54 7.923 -11.555 5.295
366 1HB CYS 54 1HB CYS 54 9.343 -8.990 4.531
367 2HB CYS 54 2HB CYS 54 7.849 -9.163 5.429
368 H HIS 55 H HIS 55 7.724 -8.951 3.382
369 HA HIS 55 HA HIS 55 6.767 -10.524 1.146
370 1HB HIS 55 2HB HIS 55 6.477 -7.543 1.537
371 2HB HIS 55 1HB HIS 55 5.517 -8.601 0.522
372 HD1 HIS 55 HD1 HIS 55 3.947 -10.388 1.867
373 HD2 HIS 55 HD2 HIS 55 5.502 -7.190 4.091
374 HE1 HIS 55 HE1 HIS 55 2.549 -10.252 3.997
375 H ASN 56 H ASN 56 9.521 -10.675 1.298
376 HA ASN 56 HA ASN 56 10.617 -8.585 -0.312
377 1HB ASN 56 1HB ASN 56 11.976 -9.675 1.476
378 2HB ASN 56 2HB ASN 56 11.795 -11.231 0.690
379 2HD2 ASN 56 2HD2 ASN 56 14.225 -9.899 1.325
380 1HD2 ASN 56 1HD2 ASN 56 15.092 -9.588 -0.142
381 H ILE 57 H ILE 57 8.881 -9.201 -2.069
382 HA ILE 57 HA ILE 57 10.090 -11.206 -3.828
383 HB ILE 57 HB ILE 57 7.127 -10.906 -3.328
384 1HG1 ILE 57 1HG1 ILE 57 8.643 -11.987 -1.497
385 2HG1 ILE 57 2HG1 ILE 57 7.147 -12.765 -1.975
386 1HG2 ILE 57 1HG2 ILE 57 7.677 -11.524 -5.634
387 2HG2 ILE 57 2HG2 ILE 57 8.658 -12.885 -5.038
388 3HG2 ILE 57 3HG2 ILE 57 6.899 -12.867 -4.761
389 1HD1 ILE 57 1HD1 ILE 57 9.914 -13.451 -3.071
390 2HD1 ILE 57 2HD1 ILE 57 9.008 -14.400 -1.868
391 3HD1 ILE 57 3HD1 ILE 57 8.392 -14.252 -3.531
392 H LEU 58 H LEU 58 10.898 -10.036 -5.487
393 HA LEU 58 HA LEU 58 9.354 -7.699 -6.339
394 1HB LEU 58 1HB LEU 58 12.238 -8.452 -6.833
395 2HB LEU 58 2HB LEU 58 11.446 -7.019 -7.456
396 HG LEU 58 HG LEU 58 11.981 -7.671 -4.547
397 1HD1 LEU 58 1HD1 LEU 58 13.320 -5.975 -6.592
398 2HD1 LEU 58 2HD1 LEU 58 13.203 -5.327 -4.938
399 3HD1 LEU 58 3HD1 LEU 58 14.001 -6.892 -5.227
400 1HD2 LEU 58 1HD2 LEU 58 10.078 -5.805 -5.777
401 2HD2 LEU 58 2HD2 LEU 58 10.170 -6.432 -4.114
402 3HD2 LEU 58 3HD2 LEU 58 11.180 -5.049 -4.601
403 H ASP 59 H ASP 59 7.881 -9.624 -7.157
404 HA ASP 59 HA ASP 59 8.498 -9.807 -9.952
405 1HB ASP 59 1HB ASP 59 9.178 -11.962 -8.350
406 2HB ASP 59 2HB ASP 59 7.539 -12.387 -8.803
407 H LYS 60 H LYS 60 6.584 -8.700 -10.528
408 HA LYS 60 HA LYS 60 4.165 -9.046 -9.101
409 1HB LYS 60 2HB LYS 60 3.240 -7.513 -10.676
410 2HB LYS 60 1HB LYS 60 4.864 -6.972 -10.304
411 1HG LYS 60 1HG LYS 60 5.448 -8.550 -12.435
412 2HG LYS 60 2HG LYS 60 3.792 -8.158 -12.850
413 1HD LYS 60 1HD LYS 60 4.773 -6.309 -13.811
414 2HD LYS 60 2HD LYS 60 4.639 -5.665 -12.187
415 1HE LYS 60 1HE LYS 60 6.905 -5.258 -12.712
416 2HE LYS 60 2HE LYS 60 6.994 -6.737 -11.777
417 1HZ LYS 60 1HZ LYS 60 6.565 -7.471 -14.394
418 2HZ LYS 60 2HZ LYS 60 7.728 -6.326 -14.434
419 3HZ LYS 60 3HZ LYS 60 7.931 -7.664 -13.521
420 H ALA 61 H ALA 61 4.627 -11.578 -9.344
421 HA ALA 61 HA ALA 61 2.524 -12.665 -10.679
422 1HB ALA 61 1HB ALA 61 4.552 -13.670 -12.451
423 2HB ALA 61 3HB ALA 61 3.054 -12.798 -12.856
424 3HB ALA 61 2HB ALA 61 4.553 -11.893 -12.539
425 H ASP 62 H ASP 62 3.315 -13.173 -8.247
426 HA ASP 62 HA ASP 62 4.864 -15.635 -8.465
427 1HB ASP 62 1HB ASP 62 5.843 -13.668 -7.100
428 2HB ASP 62 2HB ASP 62 4.532 -13.921 -5.965
429 H LYS 63 H LYS 63 4.279 -17.011 -6.237
430 HA LYS 63 HA LYS 63 1.404 -16.790 -5.755
431 1HB LYS 63 1HB LYS 63 2.847 -19.293 -6.673
432 2HB LYS 63 2HB LYS 63 1.236 -19.286 -5.983
433 1HG LYS 63 1HG LYS 63 0.380 -17.888 -7.790
434 2HG LYS 63 2HG LYS 63 1.995 -17.590 -8.403
435 1HD LYS 63 1HD LYS 63 1.821 -20.398 -8.351
436 2HD LYS 63 2HD LYS 63 0.219 -19.899 -8.858
437 1HE LYS 63 1HE LYS 63 2.382 -18.382 -10.202
438 2HE LYS 63 2HE LYS 63 2.457 -20.104 -10.517
439 1HZ LYS 63 1HZ LYS 63 -0.185 -19.063 -10.668
440 2HZ LYS 63 2HZ LYS 63 0.825 -18.373 -11.750
441 3HZ LYS 63 3HZ LYS 63 0.628 -19.994 -11.735
442 H SER 64 H SER 64 2.033 -15.831 -3.725
443 HA SER 64 HA SER 64 2.249 -17.702 -1.702
444 1HB SER 64 1HB SER 64 4.521 -16.972 -0.790
445 2HB SER 64 2HB SER 64 4.567 -18.014 -2.198
446 HG SER 64 HG SER 64 4.663 -15.131 -2.401
447 H VAL 65 H VAL 65 2.531 -16.531 0.513
448 HA VAL 65 HA VAL 65 1.133 -14.001 0.294
449 HB VAL 65 HB VAL 65 0.215 -15.637 1.770
450 1HG1 VAL 65 1HG1 VAL 65 3.015 -15.805 2.887
451 2HG1 VAL 65 2HG1 VAL 65 1.602 -16.307 3.847
452 3HG1 VAL 65 3HG1 VAL 65 1.958 -17.112 2.300
453 1HG2 VAL 65 1HG2 VAL 65 0.464 -13.114 2.451
454 2HG2 VAL 65 2HG2 VAL 65 -0.155 -14.300 3.624
455 3HG2 VAL 65 3HG2 VAL 65 1.540 -13.763 3.711
456 H ASN 66 H ASN 66 3.795 -13.917 -0.698
457 HA ASN 66 HA ASN 66 4.960 -12.220 1.359
458 1HB ASN 66 2HB ASN 66 6.524 -14.029 -0.557
459 2HB ASN 66 1HB ASN 66 7.227 -12.979 0.657
460 2HD2 ASN 66 2HD2 ASN 66 6.288 -13.300 2.920
461 1HD2 ASN 66 1HD2 ASN 66 6.136 -14.933 3.478
462 H SER 67 H SER 67 3.352 -12.232 -1.446
463 HA SER 67 HA SER 67 5.160 -10.871 -3.154
464 1HB SER 67 1HB SER 67 2.739 -10.369 -4.275
465 2HB SER 67 2HB SER 67 3.596 -11.882 -4.488
466 HG SER 67 HG SER 67 1.391 -12.241 -3.838
467 H TRP 68 H TRP 68 5.398 -8.640 -3.458
468 HA TRP 68 HA TRP 68 4.060 -6.978 -1.477
469 1HB TRP 68 1HB TRP 68 6.353 -6.630 -1.429
470 2HB TRP 68 2HB TRP 68 6.517 -6.707 -3.172
471 HD1 TRP 68 HD1 TRP 68 6.739 -4.372 -4.330
472 HE1 TRP 68 HE1 TRP 68 6.270 -1.837 -3.767
473 HE3 TRP 68 HE3 TRP 68 4.510 -5.237 0.158
474 HZ2 TRP 68 HZ2 TRP 68 5.047 -0.508 -1.557
475 HZ3 TRP 68 HZ3 TRP 68 3.707 -3.265 1.455
476 HH2 TRP 68 HH2 TRP 68 3.946 -0.964 0.665
477 H TYR 69 H TYR 69 2.999 -8.252 -4.092
478 HA TYR 69 HA TYR 69 1.944 -5.724 -5.271
479 1HB TYR 69 1HB TYR 69 3.374 -6.736 -6.892
480 2HB TYR 69 2HB TYR 69 2.720 -8.350 -6.564
481 HD1 TYR 69 HD1 TYR 69 0.366 -8.898 -7.260
482 HD2 TYR 69 HD2 TYR 69 2.342 -5.277 -8.460
483 HE1 TYR 69 HE1 TYR 69 -1.292 -8.596 -9.078
484 HE2 TYR 69 HE2 TYR 69 0.683 -4.975 -10.278
485 HH TYR 69 HH TYR 69 -2.039 -7.239 -10.762
486 H LYS 70 H LYS 70 1.212 -8.405 -3.338
487 HA LYS 70 HA LYS 70 -1.523 -8.503 -4.397
488 1HB LYS 70 1HB LYS 70 -0.126 -10.632 -4.254
489 2HB LYS 70 2HB LYS 70 -0.232 -10.486 -2.512
490 1HG LYS 70 1HG LYS 70 -2.888 -10.107 -3.380
491 2HG LYS 70 2HG LYS 70 -2.279 -11.365 -4.437
492 1HD LYS 70 1HD LYS 70 -2.274 -11.387 -1.385
493 2HD LYS 70 2HD LYS 70 -3.239 -12.403 -2.438
494 1HE LYS 70 1HE LYS 70 -1.390 -13.717 -3.100
495 2HE LYS 70 2HE LYS 70 -0.227 -12.460 -2.729
496 1HZ LYS 70 1HZ LYS 70 -1.786 -13.954 -0.734
497 2HZ LYS 70 2HZ LYS 70 -0.211 -14.205 -1.089
498 3HZ LYS 70 3HZ LYS 70 -0.680 -12.800 -0.400
499 H VAL 71 H VAL 71 0.507 -8.088 -1.450
500 HA VAL 71 HA VAL 71 -1.655 -7.707 0.300
501 HB VAL 71 HB VAL 71 0.065 -6.746 1.781
502 1HG1 VAL 71 1HG1 VAL 71 -0.142 -9.360 0.831
503 2HG1 VAL 71 2HG1 VAL 71 1.605 -9.019 0.795
504 3HG1 VAL 71 3HG1 VAL 71 0.692 -8.828 2.311
505 1HG2 VAL 71 1HG2 VAL 71 1.477 -6.391 -0.752
506 2HG2 VAL 71 2HG2 VAL 71 1.756 -5.627 0.831
507 3HG2 VAL 71 3HG2 VAL 71 2.474 -7.215 0.471
508 H VAL 72 H VAL 72 -0.635 -5.884 -2.367
509 HA VAL 72 HA VAL 72 -1.535 -3.376 -1.154
510 HB VAL 72 HB VAL 72 0.025 -4.030 -3.655
511 1HG1 VAL 72 1HG1 VAL 72 -1.306 -1.469 -2.796
512 2HG1 VAL 72 2HG1 VAL 72 0.208 -1.426 -3.731
513 3HG1 VAL 72 3HG1 VAL 72 -1.233 -2.224 -4.406
514 1HG2 VAL 72 1HG2 VAL 72 0.683 -3.005 -0.937
515 2HG2 VAL 72 2HG2 VAL 72 1.634 -4.025 -2.044
516 3HG2 VAL 72 3HG2 VAL 72 1.545 -2.267 -2.309
517 H HIS 73 H HIS 73 -1.949 -5.422 -4.128
518 HA HIS 73 HA HIS 73 -4.476 -4.066 -4.587
519 1HB HIS 73 2HB HIS 73 -3.069 -6.116 -6.317
520 2HB HIS 73 1HB HIS 73 -4.429 -5.108 -6.771
521 HD1 HIS 73 HD1 HIS 73 -0.705 -4.947 -6.121
522 HD2 HIS 73 HD2 HIS 73 -3.790 -2.483 -7.538
523 HE1 HIS 73 HE1 HIS 73 0.425 -2.888 -7.117
524 H ASP 74 H ASP 74 -3.974 -5.953 -2.287
525 HA ASP 74 HA ASP 74 -5.284 -8.355 -2.987
526 1HB ASP 74 1HB ASP 74 -3.960 -7.184 -0.669
527 2HB ASP 74 2HB ASP 74 -5.483 -7.893 -0.169
528 H ALA 75 H ALA 75 -7.436 -8.030 -3.710
529 HA ALA 75 HA ALA 75 -9.113 -6.122 -2.337
530 1HB ALA 75 1HB ALA 75 -10.035 -8.058 -4.461
531 2HB ALA 75 3HB ALA 75 -8.968 -6.701 -4.898
532 3HB ALA 75 2HB ALA 75 -10.555 -6.383 -4.156
533 H LYS 76 H LYS 76 -7.997 -9.133 -1.558
534 HA LYS 76 HA LYS 76 -10.587 -10.074 -0.576
535 1HB LYS 76 1HB LYS 76 -8.997 -11.536 -1.976
536 2HB LYS 76 2HB LYS 76 -7.984 -11.607 -0.548
537 1HG LYS 76 1HG LYS 76 -10.229 -12.279 0.693
538 2HG LYS 76 2HG LYS 76 -10.802 -12.662 -0.918
539 1HD LYS 76 1HD LYS 76 -9.259 -14.411 -1.211
540 2HD LYS 76 2HD LYS 76 -8.101 -13.724 -0.089
541 1HE LYS 76 1HE LYS 76 -9.734 -14.233 1.802
542 2HE LYS 76 2HE LYS 76 -10.750 -15.061 0.638
543 1HZ LYS 76 1HZ LYS 76 -8.533 -16.275 0.119
544 2HZ LYS 76 2HZ LYS 76 -8.139 -15.824 1.639
545 3HZ LYS 76 3HZ LYS 76 -9.461 -16.747 1.377
546 H GLY 77 H GLY 77 -11.008 -10.332 1.624
547 1HA GLY 77 2HA GLY 77 -10.834 -9.888 3.819
548 2HA GLY 77 1HA GLY 77 -9.748 -8.580 3.395
549 H GLY 78 H GLY 78 -9.493 -10.247 5.750
550 1HA GLY 78 2HA GLY 78 -6.807 -11.309 5.238
551 2HA GLY 78 1HA GLY 78 -8.004 -12.380 5.940
552 H ALA 79 H ALA 79 -5.777 -11.925 7.450
553 HA ALA 79 HA ALA 79 -6.714 -11.139 9.871
554 1HB ALA 79 1HB ALA 79 -4.326 -10.947 10.507
555 2HB ALA 79 3HB ALA 79 -4.620 -12.375 9.486
556 3HB ALA 79 2HB ALA 79 -3.876 -10.917 8.785
557 H LYS 80 H LYS 80 -5.747 -9.132 7.142
558 HA LYS 80 HA LYS 80 -6.696 -6.816 8.540
559 1HB LYS 80 1HB LYS 80 -4.420 -5.640 7.809
560 2HB LYS 80 2HB LYS 80 -4.646 -6.350 9.394
561 1HG LYS 80 1HG LYS 80 -3.623 -8.493 8.561
562 2HG LYS 80 2HG LYS 80 -3.359 -7.744 6.998
563 1HD LYS 80 2HD LYS 80 -2.114 -6.928 9.661
564 2HD LYS 80 1HD LYS 80 -1.285 -7.596 8.269
565 1HE LYS 80 1HE LYS 80 -2.031 -5.540 6.942
566 2HE LYS 80 2HE LYS 80 -2.640 -4.865 8.440
567 1HZ LYS 80 1HZ LYS 80 0.050 -5.840 8.577
568 2HZ LYS 80 2HZ LYS 80 -0.155 -4.566 7.576
569 3HZ LYS 80 3HZ LYS 80 -0.584 -4.448 9.148
570 HA PRO 81 HA PRO 81 -7.794 -5.721 4.451
571 1HB PRO 81 1HB PRO 81 -7.930 -2.989 4.637
572 2HB PRO 81 2HB PRO 81 -9.051 -4.075 5.522
573 1HG PRO 81 1HG PRO 81 -6.718 -2.704 6.399
574 2HG PRO 81 2HG PRO 81 -8.232 -2.866 7.346
575 1HD PRO 81 1HD PRO 81 -5.964 -4.385 7.822
576 2HD PRO 81 2HD PRO 81 -7.617 -5.018 8.092
577 H THR 82 H THR 82 -7.083 -3.618 2.796
578 HA THR 82 HA THR 82 -4.157 -3.523 2.841
579 HB THR 82 HB THR 82 -4.232 -4.139 0.363
580 HG1 THR 82 HG1 THR 82 -6.407 -5.345 -0.002
581 1HG2 THR 82 1HG2 THR 82 -4.553 -5.913 2.632
582 2HG2 THR 82 2HG2 THR 82 -5.524 -6.545 1.281
583 3HG2 THR 82 3HG2 THR 82 -3.779 -6.263 1.068
584 H CYS 83 H CYS 83 -3.820 -2.238 0.363
585 HA CYS 83 HA CYS 83 -4.658 0.370 1.146
586 1HB CYS 83 2HB CYS 83 -3.312 -0.348 -1.452
587 2HB CYS 83 1HB CYS 83 -3.277 1.177 -0.590
588 H ILE 84 H ILE 84 -6.141 -2.219 -0.442
589 HA ILE 84 HA ILE 84 -7.744 -0.416 -2.117
590 HB ILE 84 HB ILE 84 -6.953 -3.296 -2.386
591 1HG1 ILE 84 1HG1 ILE 84 -5.743 -1.210 -3.411
592 2HG1 ILE 84 2HG1 ILE 84 -5.967 -2.668 -4.358
593 1HG2 ILE 84 1HG2 ILE 84 -9.330 -1.961 -3.707
594 2HG2 ILE 84 2HG2 ILE 84 -8.613 -3.508 -4.218
595 3HG2 ILE 84 3HG2 ILE 84 -9.352 -3.359 -2.606
596 1HD1 ILE 84 1HD1 ILE 84 -7.791 -0.219 -4.430
597 2HD1 ILE 84 2HD1 ILE 84 -6.593 -0.663 -5.669
598 3HD1 ILE 84 3HD1 ILE 84 -8.014 -1.699 -5.394
599 H SER 85 H SER 85 -7.822 -3.157 0.233
600 HA SER 85 HA SER 85 -10.505 -3.480 0.386
601 1HB SER 85 1HB SER 85 -8.360 -4.524 1.692
602 2HB SER 85 2HB SER 85 -8.995 -3.514 2.975
603 HG SER 85 HG SER 85 -11.127 -4.576 2.545
604 H CYS 86 H CYS 86 -8.488 -1.393 2.596
605 HA CYS 86 HA CYS 86 -10.634 -0.213 3.872
606 1HB CYS 86 1HB CYS 86 -8.175 -0.183 4.546
607 2HB CYS 86 2HB CYS 86 -7.956 1.123 3.398
608 H HIS 87 H HIS 87 -8.573 0.998 1.121
609 HA HIS 87 HA HIS 87 -9.843 3.342 0.643
610 1HB HIS 87 1HB HIS 87 -8.427 1.365 -1.117
611 2HB HIS 87 2HB HIS 87 -9.208 2.753 -1.849
612 HD1 HIS 87 HD1 HIS 87 -6.956 3.834 -2.545
613 HD2 HIS 87 HD2 HIS 87 -7.351 3.221 1.586
614 HE1 HIS 87 HE1 HIS 87 -5.057 5.136 -1.444
615 H LYS 88 H LYS 88 -10.930 0.031 -0.107
616 HA LYS 88 HA LYS 88 -12.955 0.722 -1.906
617 1HB LYS 88 1HB LYS 88 -11.922 -1.620 -0.681
618 2HB LYS 88 2HB LYS 88 -13.642 -1.600 -0.347
619 1HG LYS 88 1HG LYS 88 -13.413 -2.700 -2.467
620 2HG LYS 88 2HG LYS 88 -14.022 -1.099 -2.834
621 1HD LYS 88 1HD LYS 88 -11.396 -0.518 -2.986
622 2HD LYS 88 2HD LYS 88 -11.269 -2.237 -3.302
623 1HE LYS 88 1HE LYS 88 -13.439 -1.389 -4.910
624 2HE LYS 88 2HE LYS 88 -12.262 -0.099 -5.054
625 1HZ LYS 88 1HZ LYS 88 -11.705 -2.951 -5.492
626 2HZ LYS 88 2HZ LYS 88 -11.876 -1.824 -6.661
627 3HZ LYS 88 3HZ LYS 88 -10.612 -1.747 -5.630
628 H ASP 89 H ASP 89 -12.912 0.365 1.691
629 HA ASP 89 HA ASP 89 -15.578 0.685 2.118
630 1HB ASP 89 1HB ASP 89 -13.471 0.325 3.727
631 2HB ASP 89 2HB ASP 89 -13.577 2.064 3.920
632 H LYS 90 H LYS 90 -12.948 3.111 1.617
633 HA LYS 90 HA LYS 90 -14.491 5.378 2.216
634 1HB LYS 90 1HB LYS 90 -11.887 4.850 0.821
635 2HB LYS 90 2HB LYS 90 -12.613 6.439 0.692
636 1HG LYS 90 1HG LYS 90 -12.210 5.043 3.374
637 2HG LYS 90 2HG LYS 90 -10.986 6.074 2.661
638 1HD LYS 90 1HD LYS 90 -12.360 8.023 2.806
639 2HD LYS 90 2HD LYS 90 -13.830 7.087 2.994
640 1HE LYS 90 1HE LYS 90 -11.573 7.279 5.048
641 2HE LYS 90 2HE LYS 90 -13.118 8.099 5.155
642 1HZ LYS 90 1HZ LYS 90 -13.722 5.475 4.737
643 2HZ LYS 90 2HZ LYS 90 -12.489 5.438 5.807
644 3HZ LYS 90 3HZ LYS 90 -13.841 6.287 6.149
645 H ALA 91 H ALA 91 -13.918 3.487 -0.784
646 HA ALA 91 HA ALA 91 -15.641 5.332 -2.241
647 1HB ALA 91 1HB ALA 91 -14.408 2.882 -3.461
648 2HB ALA 91 3HB ALA 91 -14.645 4.504 -4.154
649 3HB ALA 91 2HB ALA 91 -13.332 4.218 -2.987
650 H GLY 92 H GLY 92 -16.583 3.528 0.001
651 1HA GLY 92 2HA GLY 92 -18.150 1.939 0.411
652 2HA GLY 92 1HA GLY 92 -18.043 1.394 -1.252
653 H ASP 93 H ASP 93 -19.694 1.893 -2.653
654 HA ASP 93 HA ASP 93 -21.820 2.440 -3.019
655 1HB ASP 93 1HB ASP 93 -21.884 3.086 -0.435
656 2HB ASP 93 2HB ASP 93 -21.761 4.728 -1.034
657 H ASP 94 H ASP 94 -19.056 4.540 -2.648
658 HA ASP 94 HA ASP 94 -20.226 6.606 -4.285
659 1HB ASP 94 1HB ASP 94 -18.672 6.981 -2.231
660 2HB ASP 94 2HB ASP 94 -17.361 6.443 -3.262
661 H LYS 95 H LYS 95 -20.092 6.306 -6.514
662 HA LYS 95 HA LYS 95 -18.236 4.411 -7.589
663 1HB LYS 95 1HB LYS 95 -20.709 5.101 -8.307
664 2HB LYS 95 2HB LYS 95 -19.848 6.246 -9.314
665 1HG LYS 95 1HG LYS 95 -18.357 4.039 -9.849
666 2HG LYS 95 2HG LYS 95 -19.861 3.242 -9.432
667 1HD LYS 95 1HD LYS 95 -20.736 3.765 -11.455
668 2HD LYS 95 2HD LYS 95 -20.506 5.474 -11.141
669 1HE LYS 95 1HE LYS 95 -17.916 4.693 -11.724
670 2HE LYS 95 2HE LYS 95 -18.831 3.603 -12.746
671 1HZ LYS 95 1HZ LYS 95 -20.090 5.859 -13.220
672 2HZ LYS 95 2HZ LYS 95 -18.612 6.467 -12.884
673 3HZ LYS 95 3HZ LYS 95 -18.792 5.376 -14.086
674 H GLU 96 H GLU 96 -18.525 7.958 -7.282
675 HA GLU 96 HA GLU 96 -16.493 8.524 -9.120
676 1HB GLU 96 1HB GLU 96 -18.302 10.100 -8.191
677 2HB GLU 96 2HB GLU 96 -17.316 10.248 -6.750
678 1HG GLU 96 2HG GLU 96 -16.763 12.100 -8.229
679 2HG GLU 96 1HG GLU 96 -15.387 11.016 -8.184
680 H LEU 97 H LEU 97 -16.571 8.050 -5.541
681 HA LEU 97 HA LEU 97 -13.837 8.680 -5.186
682 1HB LEU 97 1HB LEU 97 -15.824 8.664 -3.521
683 2HB LEU 97 2HB LEU 97 -15.465 6.958 -3.343
684 HG LEU 97 HG LEU 97 -14.385 8.103 -1.565
685 1HD1 LEU 97 1HD1 LEU 97 -13.109 6.303 -2.873
686 2HD1 LEU 97 2HD1 LEU 97 -12.125 7.644 -3.506
687 3HD1 LEU 97 3HD1 LEU 97 -12.184 7.334 -1.755
688 1HD2 LEU 97 1HD2 LEU 97 -13.807 10.119 -3.628
689 2HD2 LEU 97 2HD2 LEU 97 -14.067 10.299 -1.877
690 3HD2 LEU 97 3HD2 LEU 97 -12.469 9.814 -2.494
691 H LYS 98 H LYS 98 -15.504 5.987 -6.556
692 HA LYS 98 HA LYS 98 -13.422 4.100 -5.869
693 1HB LYS 98 1HB LYS 98 -15.838 3.471 -5.943
694 2HB LYS 98 2HB LYS 98 -15.840 3.772 -7.669
695 1HG LYS 98 2HG LYS 98 -14.998 1.705 -8.052
696 2HG LYS 98 1HG LYS 98 -13.573 2.093 -7.109
697 1HD LYS 98 1HD LYS 98 -14.411 0.278 -5.896
698 2HD LYS 98 2HD LYS 98 -15.139 1.612 -5.025
699 1HE LYS 98 1HE LYS 98 -16.909 0.026 -5.422
700 2HE LYS 98 2HE LYS 98 -17.198 1.360 -6.521
701 1HZ LYS 98 1HZ LYS 98 -15.809 -1.128 -7.242
702 2HZ LYS 98 2HZ LYS 98 -17.362 -0.778 -7.607
703 3HZ LYS 98 3HZ LYS 98 -16.150 0.102 -8.259
704 H LYS 99 H LYS 99 -12.870 6.645 -7.425
705 HA LYS 99 HA LYS 99 -11.466 5.303 -9.592
706 1HB LYS 99 1HB LYS 99 -13.603 7.362 -9.927
707 2HB LYS 99 2HB LYS 99 -12.186 7.496 -10.949
708 1HG LYS 99 1HG LYS 99 -12.564 4.891 -11.337
709 2HG LYS 99 2HG LYS 99 -14.191 5.232 -10.783
710 1HD LYS 99 1HD LYS 99 -14.392 7.026 -12.538
711 2HD LYS 99 2HD LYS 99 -12.784 6.628 -13.109
712 1HE LYS 99 1HE LYS 99 -13.539 4.825 -14.281
713 2HE LYS 99 2HE LYS 99 -14.443 4.215 -12.908
714 1HZ LYS 99 1HZ LYS 99 -15.396 6.475 -14.513
715 2HZ LYS 99 2HZ LYS 99 -15.765 4.928 -14.879
716 3HZ LYS 99 3HZ LYS 99 -16.248 5.568 -13.456
717 H LYS 100 H LYS 100 -10.332 5.951 -7.185
718 HA LYS 100 HA LYS 100 -8.347 7.786 -7.996
719 1HB LYS 100 1HB LYS 100 -8.874 9.281 -5.860
720 2HB LYS 100 2HB LYS 100 -9.517 9.655 -7.447
721 1HG LYS 100 1HG LYS 100 -11.602 8.333 -6.854
722 2HG LYS 100 2HG LYS 100 -10.962 8.118 -5.237
723 1HD LYS 100 1HD LYS 100 -12.389 10.016 -5.053
724 2HD LYS 100 2HD LYS 100 -10.776 10.696 -5.116
725 1HE LYS 100 1HE LYS 100 -11.039 11.123 -7.563
726 2HE LYS 100 2HE LYS 100 -12.642 10.416 -7.521
727 1HZ LYS 100 1HZ LYS 100 -12.305 12.427 -5.552
728 2HZ LYS 100 2HZ LYS 100 -12.047 13.003 -7.058
729 3HZ LYS 100 3HZ LYS 100 -13.464 12.278 -6.693
730 H LEU 101 H LEU 101 -10.032 6.217 -5.204
731 HA LEU 101 HA LEU 101 -7.457 5.734 -3.963
732 1HB LEU 101 1HB LEU 101 -10.237 5.002 -3.036
733 2HB LEU 101 2HB LEU 101 -8.762 4.906 -2.095
734 HG LEU 101 HG LEU 101 -10.283 7.351 -2.976
735 1HD1 LEU 101 1HD1 LEU 101 -10.689 6.074 -0.780
736 2HD1 LEU 101 2HD1 LEU 101 -9.134 6.761 -0.254
737 3HD1 LEU 101 3HD1 LEU 101 -10.477 7.839 -0.703
738 1HD2 LEU 101 1HD2 LEU 101 -7.943 7.746 -3.601
739 2HD2 LEU 101 2HD2 LEU 101 -8.449 8.775 -2.240
740 3HD2 LEU 101 3HD2 LEU 101 -7.433 7.343 -1.944
741 H THR 102 H THR 102 -10.002 4.082 -5.821
742 HA THR 102 HA THR 102 -8.336 1.652 -5.718
743 HB THR 102 HB THR 102 -10.379 0.347 -5.687
744 HG1 THR 102 HG1 THR 102 -11.636 1.630 -7.141
745 1HG2 THR 102 1HG2 THR 102 -10.735 2.814 -3.906
746 2HG2 THR 102 2HG2 THR 102 -11.728 1.342 -3.781
747 3HG2 THR 102 3HG2 THR 102 -9.983 1.271 -3.435
748 H GLY 103 H GLY 103 -8.672 4.203 -7.547
749 1HA GLY 103 2HA GLY 103 -8.703 4.649 -9.757
750 2HA GLY 103 1HA GLY 103 -9.661 3.205 -10.018
751 H CYS 104 H CYS 104 -8.665 2.002 -11.585
752 HA CYS 104 HA CYS 104 -6.114 0.905 -11.013
753 1HB CYS 104 1HB CYS 104 -8.246 0.513 -13.003
754 2HB CYS 104 2HB CYS 104 -6.630 0.230 -13.618
755 H LYS 105 H LYS 105 -7.482 3.125 -13.551
756 HA LYS 105 HA LYS 105 -4.740 4.096 -13.974
757 1HB LYS 105 1HB LYS 105 -5.520 2.824 -15.905
758 2HB LYS 105 2HB LYS 105 -6.980 3.788 -15.995
759 1HG LYS 105 2HG LYS 105 -5.438 4.694 -17.624
760 2HG LYS 105 1HG LYS 105 -5.530 5.852 -16.311
761 1HD LYS 105 2HD LYS 105 -3.278 5.722 -16.099
762 2HD LYS 105 1HD LYS 105 -3.460 4.067 -15.554
763 1HE LYS 105 1HE LYS 105 -1.930 4.096 -17.463
764 2HE LYS 105 2HE LYS 105 -3.409 3.289 -17.945
765 1HZ LYS 105 1HZ LYS 105 -3.787 5.957 -18.450
766 2HZ LYS 105 2HZ LYS 105 -2.282 5.626 -18.988
767 3HZ LYS 105 3HZ LYS 105 -3.555 4.770 -19.547
768 H GLY 106 H GLY 106 -4.390 6.249 -13.656
769 1HA GLY 106 2HA GLY 106 -6.493 8.178 -13.923
770 2HA GLY 106 1HA GLY 106 -4.845 8.452 -13.394
771 H SER 107 H SER 107 -4.662 6.662 -11.184
772 HA SER 107 HA SER 107 -6.758 7.714 -9.451
773 1HB SER 107 1HB SER 107 -6.198 5.780 -7.944
774 2HB SER 107 2HB SER 107 -6.819 5.290 -9.508
775 HG SER 107 HG SER 107 -4.896 4.085 -8.782
776 H ALA 108 H ALA 108 -5.851 7.784 -7.002
777 HA ALA 108 HA ALA 108 -3.765 9.698 -7.045
778 1HB ALA 108 1HB ALA 108 -4.730 10.203 -5.081
779 2HB ALA 108 3HB ALA 108 -5.821 8.814 -5.293
780 3HB ALA 108 2HB ALA 108 -4.285 8.613 -4.417
781 H CYS 109 H CYS 109 -3.741 6.328 -7.338
782 HA CYS 109 HA CYS 109 -1.193 6.100 -5.933
783 1HB CYS 109 1HB CYS 109 -3.136 3.998 -6.930
784 2HB CYS 109 2HB CYS 109 -1.536 3.617 -6.326
785 H HIS 110 H HIS 110 -2.891 5.523 -9.080
786 HA HIS 110 HA HIS 110 -0.246 5.499 -10.342
787 1HB HIS 110 1HB HIS 110 -2.782 4.083 -11.210
788 2HB HIS 110 2HB HIS 110 -1.299 4.143 -12.141
789 HD1 HIS 110 HD1 HIS 110 0.880 3.409 -10.237
790 HD2 HIS 110 HD2 HIS 110 -2.911 1.624 -10.056
791 HE1 HIS 110 HE1 HIS 110 1.194 1.187 -9.024
792 HA PRO 111 HA PRO 111 -2.327 9.185 -11.977
793 1HB PRO 111 1HB PRO 111 -0.505 11.040 -11.271
794 2HB PRO 111 2HB PRO 111 -1.565 10.290 -10.032
795 1HG PRO 111 1HG PRO 111 1.062 9.622 -11.005
796 2HG PRO 111 2HG PRO 111 0.963 9.619 -9.213
797 1HD PRO 111 1HD PRO 111 0.955 7.291 -10.591
798 2HD PRO 111 2HD PRO 111 -0.176 7.508 -9.221
799 H SER 112 H SER 112 -1.676 7.720 -13.982
800 HA SER 112 HA SER 112 0.151 9.321 -15.483
801 1HB SER 112 1HB SER 112 1.108 6.931 -14.265
802 2HB SER 112 2HB SER 112 0.886 6.542 -15.959
803 HG SER 112 HG SER 112 2.750 8.245 -14.740
No H/Q in entry = 803
Start of MODEL 16
1 H1 VAL 1 H1 VAL 1 8.211 8.966 17.172
2 H2 VAL 1 H2 VAL 1 8.801 7.478 17.597
3 H3 VAL 1 H3 VAL 1 9.522 8.851 18.176
4 HA VAL 1 HA VAL 1 10.939 8.680 16.588
5 HB VAL 1 HB VAL 1 10.567 6.420 16.186
6 1HG1 VAL 1 1HG1 VAL 1 7.825 7.232 15.788
7 2HG1 VAL 1 2HG1 VAL 1 8.352 6.183 14.449
8 3HG1 VAL 1 3HG1 VAL 1 8.487 5.616 16.131
9 1HG2 VAL 1 1HG2 VAL 1 11.593 7.624 14.266
10 2HG2 VAL 1 2HG2 VAL 1 10.732 6.143 13.783
11 3HG2 VAL 1 3HG2 VAL 1 9.985 7.735 13.512
12 H ASP 2 H ASP 2 7.814 9.937 16.403
13 HA ASP 2 HA ASP 2 6.921 11.575 15.301
14 1HB ASP 2 1HB ASP 2 9.831 12.007 14.805
15 2HB ASP 2 2HB ASP 2 8.774 12.805 13.656
16 H VAL 3 H VAL 3 5.514 10.970 13.647
17 HA VAL 3 HA VAL 3 6.135 9.161 11.658
18 HB VAL 3 HB VAL 3 3.897 10.191 12.614
19 1HG1 VAL 3 1HG1 VAL 3 4.320 12.438 11.630
20 2HG1 VAL 3 2HG1 VAL 3 4.216 11.715 10.007
21 3HG1 VAL 3 3HG1 VAL 3 2.794 11.708 11.078
22 1HG2 VAL 3 1HG2 VAL 3 4.264 9.134 9.792
23 2HG2 VAL 3 2HG2 VAL 3 3.984 8.183 11.270
24 3HG2 VAL 3 3HG2 VAL 3 2.702 9.244 10.639
25 HA PRO 4 HA PRO 4 9.042 11.256 9.098
26 1HB PRO 4 2HB PRO 4 7.619 9.503 7.065
27 2HB PRO 4 1HB PRO 4 9.369 9.756 7.366
28 1HG PRO 4 1HG PRO 4 8.315 7.494 8.470
29 2HG PRO 4 2HG PRO 4 9.547 8.554 9.229
30 1HD PRO 4 2HD PRO 4 6.554 8.321 9.748
31 2HD PRO 4 1HD PRO 4 7.885 8.591 10.913
32 H ALA 5 H ALA 5 8.945 12.662 7.070
33 HA ALA 5 HA ALA 5 6.439 14.100 7.095
34 1HB ALA 5 1HB ALA 5 7.958 15.753 6.902
35 2HB ALA 5 2HB ALA 5 9.250 14.608 6.469
36 3HB ALA 5 3HB ALA 5 8.166 15.244 5.209
37 H ASP 6 H ASP 6 5.166 14.526 5.183
38 HA ASP 6 HA ASP 6 4.662 12.303 3.689
39 1HB ASP 6 2HB ASP 6 3.076 13.622 2.578
40 2HB ASP 6 1HB ASP 6 3.317 14.538 4.052
41 H GLY 7 H GLY 7 4.505 13.245 0.948
42 1HA GLY 7 2HA GLY 7 6.970 14.276 0.004
43 2HA GLY 7 1HA GLY 7 5.707 13.508 -0.938
44 H ALA 8 H ALA 8 5.780 11.023 0.833
45 HA ALA 8 HA ALA 8 8.434 9.985 0.460
46 1HB ALA 8 1HB ALA 8 5.988 9.311 1.910
47 2HB ALA 8 2HB ALA 8 6.686 7.888 1.099
48 3HB ALA 8 3HB ALA 8 7.671 8.835 2.240
49 H LYS 9 H LYS 9 9.130 8.542 -1.120
50 HA LYS 9 HA LYS 9 7.170 8.033 -3.250
51 1HB LYS 9 1HB LYS 9 10.134 8.629 -3.410
52 2HB LYS 9 2HB LYS 9 9.214 7.977 -4.751
53 1HG LYS 9 1HG LYS 9 8.233 10.463 -3.314
54 2HG LYS 9 2HG LYS 9 9.501 10.594 -4.516
55 1HD LYS 9 1HD LYS 9 7.586 8.949 -5.760
56 2HD LYS 9 2HD LYS 9 6.615 10.120 -4.889
57 1HE LYS 9 2HE LYS 9 8.815 10.723 -6.918
58 2HE LYS 9 1HE LYS 9 7.097 11.002 -7.122
59 1HZ LYS 9 1HZ LYS 9 8.049 12.246 -4.781
60 2HZ LYS 9 2HZ LYS 9 8.907 12.741 -6.079
61 3HZ LYS 9 3HZ LYS 9 7.283 12.910 -6.062
62 H ILE 10 H ILE 10 6.845 5.937 -3.896
63 HA ILE 10 HA ILE 10 8.554 3.946 -2.572
64 HB ILE 10 HB ILE 10 5.645 3.677 -3.335
65 1HG1 ILE 10 1HG1 ILE 10 6.624 3.853 -0.500
66 2HG1 ILE 10 2HG1 ILE 10 6.360 5.326 -1.412
67 1HG2 ILE 10 1HG2 ILE 10 7.066 1.594 -3.306
68 2HG2 ILE 10 2HG2 ILE 10 7.314 1.879 -1.566
69 3HG2 ILE 10 3HG2 ILE 10 5.674 1.594 -2.197
70 1HD1 ILE 10 1HD1 ILE 10 4.268 3.121 -1.149
71 2HD1 ILE 10 2HD1 ILE 10 4.343 4.550 -0.091
72 3HD1 ILE 10 3HD1 ILE 10 4.031 4.747 -1.833
73 H ASP 11 H ASP 11 9.725 2.643 -3.882
74 HA ASP 11 HA ASP 11 8.687 1.933 -6.429
75 1HB ASP 11 1HB ASP 11 9.640 3.973 -7.208
76 2HB ASP 11 2HB ASP 11 11.017 3.850 -6.132
77 H PHE 12 H PHE 12 8.972 -0.235 -5.588
78 HA PHE 12 HA PHE 12 11.766 -0.969 -5.061
79 1HB PHE 12 1HB PHE 12 9.096 -2.239 -4.201
80 2HB PHE 12 2HB PHE 12 10.674 -2.832 -3.725
81 HD1 PHE 12 HD1 PHE 12 12.056 -0.287 -3.069
82 HD2 PHE 12 HD2 PHE 12 8.112 -1.587 -2.194
83 HE1 PHE 12 HE1 PHE 12 12.010 1.209 -1.054
84 HE2 PHE 12 HE2 PHE 12 8.066 -0.090 -0.179
85 HZ PHE 12 HZ PHE 12 10.016 1.290 0.366
86 H ILE 13 H ILE 13 8.844 -1.521 -6.967
87 HA ILE 13 HA ILE 13 10.021 -3.929 -8.124
88 HB ILE 13 HB ILE 13 7.274 -2.697 -8.344
89 1HG1 ILE 13 1HG1 ILE 13 8.143 -5.287 -7.031
90 2HG1 ILE 13 2HG1 ILE 13 7.903 -3.783 -6.165
91 1HG2 ILE 13 1HG2 ILE 13 8.558 -4.981 -9.808
92 2HG2 ILE 13 2HG2 ILE 13 6.821 -5.032 -9.422
93 3HG2 ILE 13 3HG2 ILE 13 7.475 -3.703 -10.410
94 1HD1 ILE 13 1HD1 ILE 13 5.556 -3.949 -7.630
95 2HD1 ILE 13 2HD1 ILE 13 5.898 -5.659 -7.275
96 3HD1 ILE 13 3HD1 ILE 13 5.744 -4.488 -5.944
97 H ALA 14 H ALA 14 11.649 -3.281 -9.500
98 HA ALA 14 HA ALA 14 11.523 -0.945 -11.044
99 1HB ALA 14 1HB ALA 14 13.181 -3.064 -12.176
100 2HB ALA 14 2HB ALA 14 13.664 -1.519 -11.435
101 3HB ALA 14 3HB ALA 14 13.385 -2.948 -10.411
102 H GLY 15 H GLY 15 11.678 -1.043 -13.558
103 1HA GLY 15 2HA GLY 15 9.356 -1.491 -14.744
104 2HA GLY 15 1HA GLY 15 9.999 -3.121 -14.732
105 H GLY 16 H GLY 16 9.454 -1.572 -17.119
106 1HA GLY 16 2HA GLY 16 10.446 -1.343 -19.138
107 2HA GLY 16 1HA GLY 16 11.961 -1.896 -18.453
108 H GLU 17 H GLU 17 13.272 -0.318 -17.144
109 HA GLU 17 HA GLU 17 14.380 1.558 -17.102
110 1HB GLU 17 1HB GLU 17 12.932 1.816 -19.624
111 2HB GLU 17 2HB GLU 17 13.124 3.387 -18.871
112 1HG GLU 17 1HG GLU 17 15.333 1.395 -19.549
113 2HG GLU 17 2HG GLU 17 15.075 2.970 -20.274
114 H LYS 18 H LYS 18 10.843 2.214 -17.607
115 HA LYS 18 HA LYS 18 10.915 4.431 -15.799
116 1HB LYS 18 2HB LYS 18 8.547 4.601 -16.260
117 2HB LYS 18 1HB LYS 18 9.425 4.369 -17.758
118 1HG LYS 18 1HG LYS 18 8.516 2.282 -18.135
119 2HG LYS 18 2HG LYS 18 8.544 1.844 -16.438
120 1HD LYS 18 2HD LYS 18 6.268 2.111 -16.599
121 2HD LYS 18 1HD LYS 18 6.648 3.803 -16.345
122 1HE LYS 18 1HE LYS 18 6.905 3.929 -18.953
123 2HE LYS 18 2HE LYS 18 6.070 2.389 -18.975
124 1HZ LYS 18 1HZ LYS 18 5.010 4.743 -17.582
125 2HZ LYS 18 2HZ LYS 18 4.635 4.381 -19.130
126 3HZ LYS 18 3HZ LYS 18 4.220 3.356 -17.928
127 H ASN 19 H ASN 19 8.513 4.027 -14.327
128 HA ASN 19 HA ASN 19 8.407 1.617 -13.016
129 1HB ASN 19 1HB ASN 19 9.602 2.006 -10.938
130 2HB ASN 19 2HB ASN 19 10.735 2.349 -12.230
131 2HD2 ASN 19 2HD2 ASN 19 10.221 4.762 -13.116
132 1HD2 ASN 19 1HD2 ASN 19 10.346 5.983 -11.894
133 H LEU 20 H LEU 20 6.443 1.690 -11.856
134 HA LEU 20 HA LEU 20 5.040 4.174 -11.821
135 1HB LEU 20 1HB LEU 20 4.372 1.392 -10.862
136 2HB LEU 20 2HB LEU 20 3.273 2.749 -10.719
137 HG LEU 20 HG LEU 20 4.262 1.392 -13.225
138 1HD1 LEU 20 1HD1 LEU 20 2.029 0.985 -11.668
139 2HD1 LEU 20 2HD1 LEU 20 1.421 2.056 -12.953
140 3HD1 LEU 20 3HD1 LEU 20 2.212 0.518 -13.376
141 1HD2 LEU 20 1HD2 LEU 20 3.346 4.202 -12.890
142 2HD2 LEU 20 2HD2 LEU 20 4.447 3.480 -14.089
143 3HD2 LEU 20 3HD2 LEU 20 2.687 3.288 -14.268
144 H THR 21 H THR 21 6.161 5.614 -10.466
145 HA THR 21 HA THR 21 6.768 4.780 -7.763
146 HB THR 21 HB THR 21 6.964 7.638 -8.674
147 HG1 THR 21 HG1 THR 21 8.598 5.397 -9.633
148 1HG2 THR 21 1HG2 THR 21 8.509 5.652 -7.040
149 2HG2 THR 21 2HG2 THR 21 9.484 6.789 -8.002
150 3HG2 THR 21 3HG2 THR 21 8.321 7.406 -6.803
151 H VAL 22 H VAL 22 5.268 4.664 -6.224
152 HA VAL 22 HA VAL 22 2.942 6.413 -6.491
153 HB VAL 22 HB VAL 22 3.499 3.889 -4.934
154 1HG1 VAL 22 1HG1 VAL 22 1.362 5.943 -4.577
155 2HG1 VAL 22 2HG1 VAL 22 0.879 4.231 -4.503
156 3HG1 VAL 22 3HG1 VAL 22 2.120 4.854 -3.390
157 1HG2 VAL 22 1HG2 VAL 22 1.764 4.600 -7.303
158 2HG2 VAL 22 2HG2 VAL 22 2.992 3.319 -7.154
159 3HG2 VAL 22 3HG2 VAL 22 1.436 3.164 -6.303
160 H VAL 23 H VAL 23 2.271 7.789 -4.772
161 HA VAL 23 HA VAL 23 4.454 8.380 -2.900
162 HB VAL 23 HB VAL 23 2.241 10.118 -4.009
163 1HG1 VAL 23 1HG1 VAL 23 4.291 10.579 -1.855
164 2HG1 VAL 23 2HG1 VAL 23 3.747 11.934 -2.873
165 3HG1 VAL 23 3HG1 VAL 23 2.568 11.024 -1.897
166 1HG2 VAL 23 1HG2 VAL 23 4.765 9.402 -5.082
167 2HG2 VAL 23 2HG2 VAL 23 3.632 10.643 -5.670
168 3HG2 VAL 23 3HG2 VAL 23 4.907 11.082 -4.509
169 H PHE 24 H PHE 24 3.937 8.786 -0.673
170 HA PHE 24 HA PHE 24 1.216 8.122 0.119
171 1HB PHE 24 1HB PHE 24 2.581 6.006 0.122
172 2HB PHE 24 2HB PHE 24 3.833 6.800 1.056
173 HD1 PHE 24 HD1 PHE 24 0.133 6.299 1.331
174 HD2 PHE 24 HD2 PHE 24 3.905 6.217 3.274
175 HE1 PHE 24 HE1 PHE 24 -0.977 5.550 3.454
176 HE2 PHE 24 HE2 PHE 24 2.795 5.468 5.397
177 HZ PHE 24 HZ PHE 24 0.367 5.144 5.462
178 H ASN 25 H ASN 25 0.517 9.363 1.825
179 HA ASN 25 HA ASN 25 2.597 10.942 3.118
180 1HB ASN 25 1HB ASN 25 -0.211 11.870 3.412
181 2HB ASN 25 2HB ASN 25 1.217 12.788 2.977
182 2HD2 ASN 25 2HD2 ASN 25 -1.560 12.605 1.876
183 1HD2 ASN 25 1HD2 ASN 25 -1.385 12.329 0.175
184 H HIS 26 H HIS 26 2.842 10.547 5.331
185 HA HIS 26 HA HIS 26 1.136 8.647 6.572
186 1HB HIS 26 1HB HIS 26 3.639 10.102 7.231
187 2HB HIS 26 2HB HIS 26 2.665 9.597 8.597
188 HD1 HIS 26 HD1 HIS 26 4.639 8.202 5.685
189 HD2 HIS 26 HD2 HIS 26 2.629 6.836 9.105
190 HE1 HIS 26 HE1 HIS 26 5.282 5.748 5.960
191 H SER 27 H SER 27 1.057 12.071 6.107
192 HA SER 27 HA SER 27 -0.442 12.523 8.516
193 1HB SER 27 2HB SER 27 -0.511 14.889 7.717
194 2HB SER 27 1HB SER 27 1.122 14.259 7.810
195 HG SER 27 HG SER 27 1.165 13.987 5.542
196 H THR 28 H THR 28 -1.265 10.803 5.998
197 HA THR 28 HA THR 28 -3.829 12.172 5.512
198 HB THR 28 HB THR 28 -2.230 10.173 3.828
199 HG1 THR 28 HG1 THR 28 -3.081 12.961 3.490
200 1HG2 THR 28 1HG2 THR 28 -4.924 10.301 3.708
201 2HG2 THR 28 2HG2 THR 28 -4.565 11.794 2.806
202 3HG2 THR 28 3HG2 THR 28 -3.941 10.231 2.226
203 H HIS 29 H HIS 29 -2.203 9.148 6.496
204 HA HIS 29 HA HIS 29 -4.845 8.008 6.987
205 1HB HIS 29 1HB HIS 29 -2.117 6.689 6.928
206 2HB HIS 29 2HB HIS 29 -3.636 5.866 7.219
207 HD1 HIS 29 HD1 HIS 29 -1.798 7.755 4.468
208 HD2 HIS 29 HD2 HIS 29 -5.045 5.143 4.943
209 HE1 HIS 29 HE1 HIS 29 -2.529 7.090 2.116
210 H LYS 30 H LYS 30 -3.476 10.202 8.576
211 HA LYS 30 HA LYS 30 -2.404 9.197 10.922
212 1HB LYS 30 1HB LYS 30 -2.806 11.377 11.836
213 2HB LYS 30 2HB LYS 30 -2.329 11.561 10.160
214 1HG LYS 30 1HG LYS 30 -4.755 11.747 9.512
215 2HG LYS 30 2HG LYS 30 -5.202 11.618 11.201
216 1HD LYS 30 1HD LYS 30 -3.172 13.720 10.486
217 2HD LYS 30 2HD LYS 30 -4.823 14.004 9.972
218 1HE LYS 30 1HE LYS 30 -5.469 13.387 12.448
219 2HE LYS 30 2HE LYS 30 -3.773 13.650 12.801
220 1HZ LYS 30 1HZ LYS 30 -4.100 15.840 11.622
221 2HZ LYS 30 2HZ LYS 30 -5.707 15.578 11.757
222 3HZ LYS 30 3HZ LYS 30 -4.782 15.692 13.098
223 H ASP 31 H ASP 31 -5.659 9.074 9.668
224 HA ASP 31 HA ASP 31 -6.826 8.756 12.252
225 1HB ASP 31 1HB ASP 31 -8.285 9.733 10.660
226 2HB ASP 31 2HB ASP 31 -7.792 8.634 9.387
227 H VAL 32 H VAL 32 -4.848 6.867 10.332
228 HA VAL 32 HA VAL 32 -6.230 4.379 11.063
229 HB VAL 32 HB VAL 32 -4.214 4.918 8.873
230 1HG1 VAL 32 1HG1 VAL 32 -5.101 2.464 10.136
231 2HG1 VAL 32 2HG1 VAL 32 -5.546 2.485 8.413
232 3HG1 VAL 32 3HG1 VAL 32 -3.849 2.716 8.896
233 1HG2 VAL 32 1HG2 VAL 32 -7.219 4.520 8.803
234 2HG2 VAL 32 2HG2 VAL 32 -6.289 5.936 8.256
235 3HG2 VAL 32 3HG2 VAL 32 -6.173 4.397 7.368
236 H LYS 33 H LYS 33 -5.297 3.130 12.607
237 HA LYS 33 HA LYS 33 -3.188 3.998 14.118
238 1HB LYS 33 1HB LYS 33 -4.097 1.135 13.692
239 2HB LYS 33 2HB LYS 33 -3.150 1.725 15.043
240 1HG LYS 33 1HG LYS 33 -5.242 3.491 15.144
241 2HG LYS 33 2HG LYS 33 -6.061 2.105 14.453
242 1HD LYS 33 1HD LYS 33 -5.398 0.681 16.322
243 2HD LYS 33 2HD LYS 33 -4.325 1.914 16.954
244 1HE LYS 33 1HE LYS 33 -6.034 3.075 17.957
245 2HE LYS 33 2HE LYS 33 -7.113 2.865 16.592
246 1HZ LYS 33 1HZ LYS 33 -6.730 0.381 17.741
247 2HZ LYS 33 2HZ LYS 33 -7.046 1.418 18.962
248 3HZ LYS 33 3HZ LYS 33 -8.097 1.274 17.721
249 H CYS 34 H CYS 34 -0.975 3.092 14.382
250 HA CYS 34 HA CYS 34 0.337 3.119 11.874
251 1HB CYS 34 1HB CYS 34 1.574 2.367 14.519
252 2HB CYS 34 2HB CYS 34 2.364 3.033 13.103
253 H ASP 35 H ASP 35 -0.524 0.665 14.373
254 HA ASP 35 HA ASP 35 0.918 -1.411 13.208
255 1HB ASP 35 1HB ASP 35 -0.599 -2.874 14.598
256 2HB ASP 35 2HB ASP 35 0.166 -1.585 15.506
257 H ASP 36 H ASP 36 -1.799 0.341 12.133
258 HA ASP 36 HA ASP 36 -3.428 -1.678 11.151
259 1HB ASP 36 1HB ASP 36 -3.762 0.939 11.372
260 2HB ASP 36 2HB ASP 36 -3.068 0.998 9.764
261 H CYS 37 H CYS 37 -0.299 -0.465 10.211
262 HA CYS 37 HA CYS 37 -0.506 -1.951 7.700
263 1HB CYS 37 1HB CYS 37 0.819 0.749 8.095
264 2HB CYS 37 2HB CYS 37 1.082 -0.270 6.694
265 H HIS 38 H HIS 38 1.621 -0.440 10.224
266 HA HIS 38 HA HIS 38 3.788 -2.178 9.574
267 1HB HIS 38 1HB HIS 38 3.373 -0.298 11.915
268 2HB HIS 38 2HB HIS 38 4.874 -1.114 11.525
269 HD1 HIS 38 HD1 HIS 38 5.883 -0.480 9.025
270 HD2 HIS 38 HD2 HIS 38 3.074 2.145 10.704
271 HE1 HIS 38 HE1 HIS 38 6.123 1.725 7.765
272 H HIS 39 H HIS 39 2.726 -4.275 9.752
273 HA HIS 39 HA HIS 39 1.932 -4.991 12.455
274 1HB HIS 39 1HB HIS 39 0.760 -6.773 11.538
275 2HB HIS 39 2HB HIS 39 0.543 -5.494 10.360
276 HD1 HIS 39 HD1 HIS 39 1.441 -8.976 10.582
277 HD2 HIS 39 HD2 HIS 39 2.574 -5.773 8.121
278 HE1 HIS 39 HE1 HIS 39 2.477 -10.012 8.493
279 H GLN 40 H GLN 40 4.594 -4.417 12.426
280 HA GLN 40 HA GLN 40 5.863 -7.024 12.146
281 1HB GLN 40 1HB GLN 40 6.853 -4.194 11.885
282 2HB GLN 40 2HB GLN 40 7.985 -5.402 12.461
283 1HG GLN 40 1HG GLN 40 7.837 -5.002 9.890
284 2HG GLN 40 2HG GLN 40 7.879 -6.660 10.458
285 2HE2 GLN 40 2HE2 GLN 40 6.049 -7.937 10.407
286 1HE2 GLN 40 1HE2 GLN 40 4.640 -7.547 9.478
287 HA PRO 41 HA PRO 41 6.154 -7.071 16.562
288 1HB PRO 41 1HB PRO 41 7.367 -9.432 16.891
289 2HB PRO 41 2HB PRO 41 5.785 -9.364 16.048
290 1HG PRO 41 1HG PRO 41 8.560 -9.309 14.765
291 2HG PRO 41 2HG PRO 41 7.258 -10.449 14.292
292 1HD PRO 41 1HD PRO 41 7.720 -8.105 12.939
293 2HD PRO 41 2HD PRO 41 6.060 -8.728 13.181
294 H GLY 42 H GLY 42 7.804 -6.812 18.265
295 1HA GLY 42 2HA GLY 42 10.575 -6.625 17.363
296 2HA GLY 42 1HA GLY 42 9.981 -6.578 19.011
297 H ASP 43 H ASP 43 11.579 -4.675 19.045
298 HA ASP 43 HA ASP 43 10.171 -2.340 19.202
299 1HB ASP 43 1HB ASP 43 12.986 -3.205 19.355
300 2HB ASP 43 2HB ASP 43 12.844 -1.573 18.732
301 H LYS 44 H LYS 44 11.534 -4.010 16.455
302 HA LYS 44 HA LYS 44 11.744 -1.613 14.840
303 1HB LYS 44 1HB LYS 44 13.435 -3.437 14.708
304 2HB LYS 44 2HB LYS 44 12.197 -4.521 14.107
305 1HG LYS 44 2HG LYS 44 13.016 -3.768 12.075
306 2HG LYS 44 1HG LYS 44 11.796 -2.538 12.338
307 1HD LYS 44 1HD LYS 44 13.380 -0.919 12.397
308 2HD LYS 44 2HD LYS 44 14.198 -1.721 13.722
309 1HE LYS 44 1HE LYS 44 14.634 -3.060 11.113
310 2HE LYS 44 2HE LYS 44 15.215 -1.406 11.140
311 1HZ LYS 44 1HZ LYS 44 15.843 -3.153 13.380
312 2HZ LYS 44 2HZ LYS 44 16.693 -3.306 11.995
313 3HZ LYS 44 3HZ LYS 44 16.685 -1.882 12.795
314 H GLN 45 H GLN 45 9.182 -1.840 15.870
315 HA GLN 45 HA GLN 45 7.416 -3.356 14.458
316 1HB GLN 45 1HB GLN 45 6.999 -1.869 16.501
317 2HB GLN 45 2HB GLN 45 6.885 -0.509 15.403
318 1HG GLN 45 1HG GLN 45 5.198 -2.376 14.201
319 2HG GLN 45 2HG GLN 45 4.943 -2.694 15.906
320 2HE2 GLN 45 2HE2 GLN 45 2.775 -1.916 15.227
321 1HE2 GLN 45 1HE2 GLN 45 2.425 -0.224 15.350
322 H TYR 46 H TYR 46 9.194 -0.512 13.529
323 HA TYR 46 HA TYR 46 7.641 -0.309 10.996
324 1HB TYR 46 1HB TYR 46 9.629 1.695 12.080
325 2HB TYR 46 2HB TYR 46 8.383 1.938 10.844
326 HD1 TYR 46 HD1 TYR 46 6.005 2.140 11.479
327 HD2 TYR 46 HD2 TYR 46 9.109 1.810 14.431
328 HE1 TYR 46 HE1 TYR 46 4.434 2.945 13.222
329 HE2 TYR 46 HE2 TYR 46 7.538 2.615 16.173
330 HH TYR 46 HH TYR 46 4.183 2.805 15.763
331 H ALA 47 H ALA 47 8.607 -1.769 9.555
332 HA ALA 47 HA ALA 47 11.430 -1.240 9.029
333 1HB ALA 47 1HB ALA 47 10.232 -3.750 10.070
334 2HB ALA 47 3HB ALA 47 11.907 -3.157 10.163
335 3HB ALA 47 2HB ALA 47 11.324 -3.947 8.678
336 H GLY 48 H GLY 48 11.974 -2.715 6.908
337 1HA GLY 48 2HA GLY 48 11.662 -2.747 4.675
338 2HA GLY 48 1HA GLY 48 10.304 -1.655 4.867
339 H CYS 49 H CYS 49 8.708 -2.619 3.628
340 HA CYS 49 HA CYS 49 7.508 -4.953 4.709
341 1HB CYS 49 2HB CYS 49 6.813 -3.650 2.080
342 2HB CYS 49 1HB CYS 49 5.787 -4.625 3.113
343 H THR 50 H THR 50 9.795 -4.129 2.128
344 HA THR 50 HA THR 50 9.548 -6.785 0.941
345 HB THR 50 HB THR 50 11.081 -5.766 -0.770
346 HG1 THR 50 HG1 THR 50 11.907 -3.703 -0.272
347 1HG2 THR 50 1HG2 THR 50 8.577 -5.285 -0.919
348 2HG2 THR 50 2HG2 THR 50 8.873 -3.790 0.002
349 3HG2 THR 50 3HG2 THR 50 9.600 -4.002 -1.609
350 H THR 51 H THR 51 10.575 -6.267 3.752
351 HA THR 51 HA THR 51 13.388 -6.750 3.610
352 HB THR 51 HB THR 51 11.374 -7.071 5.898
353 HG1 THR 51 HG1 THR 51 11.765 -4.956 4.523
354 1HG2 THR 51 1HG2 THR 51 14.405 -6.662 5.784
355 2HG2 THR 51 2HG2 THR 51 13.435 -6.379 7.249
356 3HG2 THR 51 3HG2 THR 51 13.536 -8.013 6.551
357 H ASP 52 H ASP 52 14.502 -8.681 4.355
358 HA ASP 52 HA ASP 52 13.726 -10.887 2.975
359 1HB ASP 52 1HB ASP 52 15.903 -10.139 4.515
360 2HB ASP 52 2HB ASP 52 15.228 -11.427 5.493
361 H GLY 53 H GLY 53 12.928 -13.039 3.779
362 1HA GLY 53 2HA GLY 53 12.029 -13.566 6.348
363 2HA GLY 53 1HA GLY 53 11.452 -14.327 4.879
364 H CYS 54 H CYS 54 10.615 -11.574 3.773
365 HA CYS 54 HA CYS 54 8.082 -11.521 5.209
366 1HB CYS 54 2HB CYS 54 9.504 -8.963 4.426
367 2HB CYS 54 1HB CYS 54 8.017 -9.127 5.338
368 H HIS 55 H HIS 55 7.929 -8.904 3.274
369 HA HIS 55 HA HIS 55 6.929 -10.483 1.051
370 1HB HIS 55 2HB HIS 55 6.604 -7.509 1.472
371 2HB HIS 55 1HB HIS 55 5.654 -8.567 0.448
372 HD1 HIS 55 HD1 HIS 55 4.102 -10.380 1.771
373 HD2 HIS 55 HD2 HIS 55 5.645 -7.208 4.041
374 HE1 HIS 55 HE1 HIS 55 2.714 -10.290 3.910
375 H ASN 56 H ASN 56 9.614 -10.714 1.044
376 HA ASN 56 HA ASN 56 10.709 -8.559 -0.504
377 1HB ASN 56 1HB ASN 56 12.049 -9.761 1.277
378 2HB ASN 56 2HB ASN 56 11.942 -11.237 0.338
379 2HD2 ASN 56 2HD2 ASN 56 14.312 -9.901 1.133
380 1HD2 ASN 56 1HD2 ASN 56 15.179 -9.403 -0.281
381 H ILE 57 H ILE 57 8.864 -9.221 -2.185
382 HA ILE 57 HA ILE 57 10.084 -11.118 -4.050
383 HB ILE 57 HB ILE 57 7.130 -10.991 -3.446
384 1HG1 ILE 57 1HG1 ILE 57 8.715 -11.947 -1.621
385 2HG1 ILE 57 2HG1 ILE 57 7.285 -12.847 -2.086
386 1HG2 ILE 57 1HG2 ILE 57 8.748 -12.231 -5.552
387 2HG2 ILE 57 2HG2 ILE 57 7.657 -13.367 -4.723
388 3HG2 ILE 57 3HG2 ILE 57 7.001 -11.898 -5.484
389 1HD1 ILE 57 1HD1 ILE 57 9.713 -13.431 -3.717
390 2HD1 ILE 57 2HD1 ILE 57 9.799 -13.924 -2.008
391 3HD1 ILE 57 3HD1 ILE 57 8.495 -14.544 -3.048
392 H LEU 58 H LEU 58 10.738 -9.873 -5.722
393 HA LEU 58 HA LEU 58 9.051 -7.586 -6.418
394 1HB LEU 58 1HB LEU 58 11.879 -8.195 -7.281
395 2HB LEU 58 2HB LEU 58 10.986 -6.713 -7.557
396 HG LEU 58 HG LEU 58 11.879 -7.772 -4.862
397 1HD1 LEU 58 1HD1 LEU 58 13.060 -5.864 -6.814
398 2HD1 LEU 58 2HD1 LEU 58 13.149 -5.430 -5.090
399 3HD1 LEU 58 3HD1 LEU 58 13.844 -6.968 -5.658
400 1HD2 LEU 58 1HD2 LEU 58 9.776 -5.967 -5.492
401 2HD2 LEU 58 2HD2 LEU 58 10.427 -6.407 -3.895
402 3HD2 LEU 58 3HD2 LEU 58 11.108 -5.023 -4.782
403 H ASP 59 H ASP 59 7.450 -9.186 -7.307
404 HA ASP 59 HA ASP 59 7.989 -9.460 -10.090
405 1HB ASP 59 1HB ASP 59 8.689 -11.644 -8.615
406 2HB ASP 59 2HB ASP 59 6.984 -11.990 -8.820
407 H LYS 60 H LYS 60 6.046 -8.827 -11.046
408 HA LYS 60 HA LYS 60 3.671 -8.815 -9.394
409 1HB LYS 60 1HB LYS 60 4.025 -7.757 -12.210
410 2HB LYS 60 2HB LYS 60 2.741 -7.375 -11.081
411 1HG LYS 60 1HG LYS 60 4.005 -5.813 -10.003
412 2HG LYS 60 2HG LYS 60 5.388 -6.885 -9.896
413 1HD LYS 60 1HD LYS 60 4.594 -5.368 -12.426
414 2HD LYS 60 2HD LYS 60 5.802 -4.809 -11.286
415 1HE LYS 60 1HE LYS 60 5.949 -7.510 -12.707
416 2HE LYS 60 2HE LYS 60 6.737 -6.061 -13.299
417 1HZ LYS 60 1HZ LYS 60 7.287 -6.544 -10.560
418 2HZ LYS 60 2HZ LYS 60 7.761 -7.789 -11.505
419 3HZ LYS 60 3HZ LYS 60 8.323 -6.283 -11.795
420 H ALA 61 H ALA 61 4.427 -11.424 -9.779
421 HA ALA 61 HA ALA 61 2.153 -12.561 -10.853
422 1HB ALA 61 1HB ALA 61 3.912 -13.616 -12.792
423 2HB ALA 61 3HB ALA 61 2.517 -12.547 -13.072
424 3HB ALA 61 2HB ALA 61 4.141 -11.852 -12.852
425 H ASP 62 H ASP 62 3.181 -13.003 -8.484
426 HA ASP 62 HA ASP 62 4.779 -15.421 -8.799
427 1HB ASP 62 1HB ASP 62 5.747 -13.406 -7.491
428 2HB ASP 62 2HB ASP 62 4.522 -13.725 -6.279
429 H LYS 63 H LYS 63 4.385 -16.812 -6.536
430 HA LYS 63 HA LYS 63 1.530 -16.723 -5.907
431 1HB LYS 63 1HB LYS 63 2.994 -18.882 -7.308
432 2HB LYS 63 2HB LYS 63 1.982 -19.410 -5.979
433 1HG LYS 63 1HG LYS 63 0.020 -18.299 -6.946
434 2HG LYS 63 2HG LYS 63 0.999 -17.544 -8.187
435 1HD LYS 63 2HD LYS 63 0.310 -19.347 -9.439
436 2HD LYS 63 1HD LYS 63 1.665 -20.139 -8.659
437 1HE LYS 63 1HE LYS 63 0.035 -20.844 -6.793
438 2HE LYS 63 2HE LYS 63 -1.265 -20.255 -7.811
439 1HZ LYS 63 1HZ LYS 63 0.116 -21.788 -9.497
440 2HZ LYS 63 2HZ LYS 63 0.330 -22.606 -8.100
441 3HZ LYS 63 3HZ LYS 63 -1.179 -22.298 -8.643
442 H SER 64 H SER 64 2.158 -15.715 -3.914
443 HA SER 64 HA SER 64 2.612 -17.548 -1.890
444 1HB SER 64 1HB SER 64 5.034 -16.266 -3.023
445 2HB SER 64 2HB SER 64 4.889 -16.076 -1.288
446 HG SER 64 HG SER 64 5.969 -18.114 -2.291
447 H VAL 65 H VAL 65 2.770 -16.385 0.300
448 HA VAL 65 HA VAL 65 1.169 -13.991 0.136
449 HB VAL 65 HB VAL 65 0.509 -15.690 1.677
450 1HG1 VAL 65 1HG1 VAL 65 3.369 -15.554 2.631
451 2HG1 VAL 65 2HG1 VAL 65 2.073 -16.175 3.681
452 3HG1 VAL 65 3HG1 VAL 65 2.417 -16.970 2.126
453 1HG2 VAL 65 1HG2 VAL 65 0.576 -13.125 2.320
454 2HG2 VAL 65 2HG2 VAL 65 0.070 -14.356 3.502
455 3HG2 VAL 65 3HG2 VAL 65 1.722 -13.694 3.557
456 H ASN 66 H ASN 66 4.312 -14.429 -0.431
457 HA ASN 66 HA ASN 66 5.202 -12.317 1.345
458 1HB ASN 66 2HB ASN 66 6.824 -14.045 -0.598
459 2HB ASN 66 1HB ASN 66 7.490 -12.956 0.602
460 2HD2 ASN 66 2HD2 ASN 66 6.545 -13.326 2.881
461 1HD2 ASN 66 1HD2 ASN 66 6.519 -14.964 3.443
462 H SER 67 H SER 67 3.480 -12.339 -1.342
463 HA SER 67 HA SER 67 5.170 -10.967 -3.163
464 1HB SER 67 1HB SER 67 2.853 -10.546 -4.308
465 2HB SER 67 2HB SER 67 3.478 -12.181 -4.240
466 HG SER 67 HG SER 67 1.276 -12.174 -3.584
467 H TRP 68 H TRP 68 5.410 -8.742 -3.436
468 HA TRP 68 HA TRP 68 4.105 -7.089 -1.420
469 1HB TRP 68 1HB TRP 68 6.399 -6.753 -1.377
470 2HB TRP 68 2HB TRP 68 6.558 -6.821 -3.121
471 HD1 TRP 68 HD1 TRP 68 6.816 -4.478 -4.250
472 HE1 TRP 68 HE1 TRP 68 6.354 -1.945 -3.675
473 HE3 TRP 68 HE3 TRP 68 4.531 -5.362 0.205
474 HZ2 TRP 68 HZ2 TRP 68 5.112 -0.624 -1.471
475 HZ3 TRP 68 HZ3 TRP 68 3.724 -3.395 1.507
476 HH2 TRP 68 HH2 TRP 68 3.983 -1.090 0.735
477 H TYR 69 H TYR 69 3.055 -8.340 -4.065
478 HA TYR 69 HA TYR 69 1.997 -5.797 -5.211
479 1HB TYR 69 1HB TYR 69 3.410 -6.770 -6.856
480 2HB TYR 69 2HB TYR 69 2.803 -8.401 -6.524
481 HD1 TYR 69 HD1 TYR 69 0.463 -9.015 -7.204
482 HD2 TYR 69 HD2 TYR 69 2.321 -5.334 -8.409
483 HE1 TYR 69 HE1 TYR 69 -1.219 -8.757 -9.009
484 HE2 TYR 69 HE2 TYR 69 0.639 -5.076 -10.214
485 HH TYR 69 HH TYR 69 -0.938 -6.793 -11.599
486 H LYS 70 H LYS 70 1.258 -8.492 -3.303
487 HA LYS 70 HA LYS 70 -1.467 -8.602 -4.381
488 1HB LYS 70 1HB LYS 70 0.043 -10.706 -4.113
489 2HB LYS 70 2HB LYS 70 -0.310 -10.559 -2.403
490 1HG LYS 70 1HG LYS 70 -2.778 -10.548 -2.950
491 2HG LYS 70 2HG LYS 70 -2.380 -10.794 -4.638
492 1HD LYS 70 1HD LYS 70 -2.873 -12.972 -3.712
493 2HD LYS 70 2HD LYS 70 -1.142 -12.914 -3.977
494 1HE LYS 70 2HE LYS 70 -1.561 -13.870 -1.765
495 2HE LYS 70 1HE LYS 70 -0.808 -12.302 -1.560
496 1HZ LYS 70 1HZ LYS 70 -3.682 -12.294 -1.667
497 2HZ LYS 70 2HZ LYS 70 -3.031 -13.007 -0.350
498 3HZ LYS 70 3HZ LYS 70 -2.672 -11.452 -0.698
499 H VAL 71 H VAL 71 0.529 -8.131 -1.420
500 HA VAL 71 HA VAL 71 -1.673 -7.726 0.287
501 HB VAL 71 HB VAL 71 0.031 -6.784 1.801
502 1HG1 VAL 71 1HG1 VAL 71 -0.341 -9.347 1.171
503 2HG1 VAL 71 2HG1 VAL 71 1.348 -9.198 0.628
504 3HG1 VAL 71 3HG1 VAL 71 0.920 -8.832 2.316
505 1HG2 VAL 71 1HG2 VAL 71 1.425 -6.263 -0.627
506 2HG2 VAL 71 2HG2 VAL 71 1.905 -5.853 1.037
507 3HG2 VAL 71 3HG2 VAL 71 2.406 -7.405 0.324
508 H VAL 72 H VAL 72 -0.618 -5.959 -2.381
509 HA VAL 72 HA VAL 72 -1.476 -3.419 -1.198
510 HB VAL 72 HB VAL 72 0.104 -4.105 -3.680
511 1HG1 VAL 72 1HG1 VAL 72 -1.593 -1.883 -3.316
512 2HG1 VAL 72 2HG1 VAL 72 0.062 -1.282 -3.053
513 3HG1 VAL 72 3HG1 VAL 72 -0.353 -2.112 -4.572
514 1HG2 VAL 72 1HG2 VAL 72 0.818 -2.703 -1.085
515 2HG2 VAL 72 2HG2 VAL 72 1.442 -4.258 -1.687
516 3HG2 VAL 72 3HG2 VAL 72 1.867 -2.745 -2.522
517 H HIS 73 H HIS 73 -1.989 -5.692 -3.958
518 HA HIS 73 HA HIS 73 -4.490 -4.265 -4.482
519 1HB HIS 73 1HB HIS 73 -3.032 -6.175 -6.324
520 2HB HIS 73 2HB HIS 73 -4.404 -5.159 -6.719
521 HD1 HIS 73 HD1 HIS 73 -0.694 -4.932 -5.924
522 HD2 HIS 73 HD2 HIS 73 -3.785 -2.544 -7.453
523 HE1 HIS 73 HE1 HIS 73 0.415 -2.819 -6.827
524 H ASP 74 H ASP 74 -4.192 -6.042 -2.218
525 HA ASP 74 HA ASP 74 -5.358 -8.517 -3.080
526 1HB ASP 74 1HB ASP 74 -4.019 -7.465 -0.694
527 2HB ASP 74 2HB ASP 74 -5.492 -8.305 -0.249
528 H ALA 75 H ALA 75 -7.495 -7.958 -3.817
529 HA ALA 75 HA ALA 75 -9.152 -6.143 -2.442
530 1HB ALA 75 1HB ALA 75 -9.409 -8.146 -4.661
531 2HB ALA 75 3HB ALA 75 -10.902 -7.551 -3.896
532 3HB ALA 75 2HB ALA 75 -9.770 -6.403 -4.650
533 H LYS 76 H LYS 76 -8.429 -9.601 -2.105
534 HA LYS 76 HA LYS 76 -10.740 -10.219 -0.588
535 1HB LYS 76 1HB LYS 76 -9.192 -11.789 -1.914
536 2HB LYS 76 2HB LYS 76 -8.116 -11.716 -0.533
537 1HG LYS 76 1HG LYS 76 -10.242 -12.319 0.888
538 2HG LYS 76 2HG LYS 76 -10.959 -12.785 -0.641
539 1HD LYS 76 1HD LYS 76 -8.357 -13.954 -0.625
540 2HD LYS 76 2HD LYS 76 -9.005 -14.223 0.981
541 1HE LYS 76 1HE LYS 76 -10.998 -14.715 -1.154
542 2HE LYS 76 2HE LYS 76 -9.589 -15.748 -1.291
543 1HZ LYS 76 1HZ LYS 76 -10.838 -15.404 1.315
544 2HZ LYS 76 2HZ LYS 76 -11.523 -16.417 0.232
545 3HZ LYS 76 3HZ LYS 76 -9.992 -16.675 0.738
546 H GLY 77 H GLY 77 -10.850 -10.667 1.722
547 1HA GLY 77 2HA GLY 77 -10.662 -9.886 3.833
548 2HA GLY 77 1HA GLY 77 -9.600 -8.615 3.260
549 H GLY 78 H GLY 78 -9.341 -10.306 5.697
550 1HA GLY 78 2HA GLY 78 -6.616 -11.266 5.179
551 2HA GLY 78 1HA GLY 78 -7.775 -12.375 5.884
552 H ALA 79 H ALA 79 -5.589 -11.886 7.410
553 HA ALA 79 HA ALA 79 -6.516 -11.143 9.828
554 1HB ALA 79 1HB ALA 79 -4.175 -10.910 10.476
555 2HB ALA 79 3HB ALA 79 -3.697 -10.665 8.779
556 3HB ALA 79 2HB ALA 79 -4.332 -12.242 9.306
557 H LYS 80 H LYS 80 -5.620 -9.051 7.122
558 HA LYS 80 HA LYS 80 -6.718 -6.808 8.542
559 1HB LYS 80 1HB LYS 80 -4.466 -5.544 7.758
560 2HB LYS 80 2HB LYS 80 -4.729 -6.161 9.377
561 1HG LYS 80 1HG LYS 80 -3.621 -8.323 8.707
562 2HG LYS 80 2HG LYS 80 -3.315 -7.654 7.116
563 1HD LYS 80 1HD LYS 80 -2.243 -6.561 9.760
564 2HD LYS 80 2HD LYS 80 -1.313 -7.423 8.550
565 1HE LYS 80 1HE LYS 80 -1.845 -5.593 6.888
566 2HE LYS 80 2HE LYS 80 -2.685 -4.720 8.154
567 1HZ LYS 80 1HZ LYS 80 0.100 -5.567 8.472
568 2HZ LYS 80 2HZ LYS 80 -0.292 -4.147 7.767
569 3HZ LYS 80 3HZ LYS 80 -0.711 -4.431 9.320
570 HA PRO 81 HA PRO 81 -7.692 -5.747 4.387
571 1HB PRO 81 1HB PRO 81 -8.474 -3.200 4.619
572 2HB PRO 81 2HB PRO 81 -9.258 -4.457 5.630
573 1HG PRO 81 1HG PRO 81 -7.006 -2.907 6.015
574 2HG PRO 81 2HG PRO 81 -8.019 -2.657 7.474
575 1HD PRO 81 1HD PRO 81 -6.016 -4.287 7.787
576 2HD PRO 81 2HD PRO 81 -7.615 -5.013 8.135
577 H THR 82 H THR 82 -6.779 -4.844 2.453
578 HA THR 82 HA THR 82 -4.105 -3.751 2.853
579 HB THR 82 HB THR 82 -3.771 -4.443 0.551
580 HG1 THR 82 HG1 THR 82 -6.643 -4.985 0.530
581 1HG2 THR 82 1HG2 THR 82 -4.961 -6.294 2.439
582 2HG2 THR 82 2HG2 THR 82 -5.601 -6.650 0.817
583 3HG2 THR 82 3HG2 THR 82 -3.844 -6.658 1.102
584 H CYS 83 H CYS 83 -4.012 -2.398 0.275
585 HA CYS 83 HA CYS 83 -4.950 0.116 1.202
586 1HB CYS 83 1HB CYS 83 -3.916 -0.410 -1.572
587 2HB CYS 83 2HB CYS 83 -3.816 1.058 -0.619
588 H ILE 84 H ILE 84 -5.670 -2.049 -1.635
589 HA ILE 84 HA ILE 84 -7.804 -0.487 -2.572
590 HB ILE 84 HB ILE 84 -6.453 -2.939 -3.237
591 1HG1 ILE 84 1HG1 ILE 84 -6.959 -2.276 -5.476
592 2HG1 ILE 84 2HG1 ILE 84 -8.284 -1.254 -4.957
593 1HG2 ILE 84 1HG2 ILE 84 -9.472 -2.998 -3.304
594 2HG2 ILE 84 2HG2 ILE 84 -8.465 -3.983 -4.391
595 3HG2 ILE 84 3HG2 ILE 84 -8.348 -4.201 -2.628
596 1HD1 ILE 84 1HD1 ILE 84 -5.613 -0.661 -3.736
597 2HD1 ILE 84 2HD1 ILE 84 -5.802 -0.288 -5.466
598 3HD1 ILE 84 3HD1 ILE 84 -6.892 0.456 -4.271
599 H SER 85 H SER 85 -7.546 -3.172 -0.211
600 HA SER 85 HA SER 85 -10.183 -3.804 -0.004
601 1HB SER 85 2HB SER 85 -8.285 -3.618 2.370
602 2HB SER 85 1HB SER 85 -9.641 -4.712 2.179
603 HG SER 85 HG SER 85 -8.396 -6.072 1.094
604 H CYS 86 H CYS 86 -8.343 -1.474 2.115
605 HA CYS 86 HA CYS 86 -10.635 -0.502 3.372
606 1HB CYS 86 1HB CYS 86 -8.220 -0.329 4.166
607 2HB CYS 86 2HB CYS 86 -8.025 1.003 3.043
608 H HIS 87 H HIS 87 -8.495 0.977 0.816
609 HA HIS 87 HA HIS 87 -9.900 3.207 0.289
610 1HB HIS 87 1HB HIS 87 -8.322 1.358 -1.487
611 2HB HIS 87 2HB HIS 87 -9.095 2.780 -2.158
612 HD1 HIS 87 HD1 HIS 87 -6.847 3.959 -2.669
613 HD2 HIS 87 HD2 HIS 87 -7.393 3.021 1.383
614 HE1 HIS 87 HE1 HIS 87 -5.022 5.207 -1.394
615 H LYS 88 H LYS 88 -10.670 -0.145 -0.728
616 HA LYS 88 HA LYS 88 -12.676 0.488 -2.549
617 1HB LYS 88 1HB LYS 88 -11.906 -1.912 -0.938
618 2HB LYS 88 2HB LYS 88 -13.486 -1.904 -1.696
619 1HG LYS 88 1HG LYS 88 -11.004 -1.152 -3.283
620 2HG LYS 88 2HG LYS 88 -11.441 -2.833 -3.055
621 1HD LYS 88 1HD LYS 88 -13.834 -1.436 -3.829
622 2HD LYS 88 2HD LYS 88 -12.560 -0.916 -4.914
623 1HE LYS 88 1HE LYS 88 -13.157 -3.848 -4.298
624 2HE LYS 88 2HE LYS 88 -13.821 -2.994 -5.676
625 1HZ LYS 88 1HZ LYS 88 -10.969 -2.799 -5.340
626 2HZ LYS 88 2HZ LYS 88 -11.534 -4.277 -5.746
627 3HZ LYS 88 3HZ LYS 88 -11.848 -2.991 -6.703
628 H ASP 89 H ASP 89 -12.830 -0.196 1.008
629 HA ASP 89 HA ASP 89 -15.541 0.024 1.246
630 1HB ASP 89 1HB ASP 89 -13.560 -0.530 2.963
631 2HB ASP 89 2HB ASP 89 -13.723 1.164 3.377
632 H LYS 90 H LYS 90 -12.920 2.503 1.247
633 HA LYS 90 HA LYS 90 -14.451 4.677 2.076
634 1HB LYS 90 1HB LYS 90 -11.824 4.216 0.805
635 2HB LYS 90 2HB LYS 90 -12.536 5.779 0.459
636 1HG LYS 90 1HG LYS 90 -12.069 4.586 3.232
637 2HG LYS 90 2HG LYS 90 -11.170 5.906 2.510
638 1HD LYS 90 1HD LYS 90 -13.693 6.919 2.271
639 2HD LYS 90 2HD LYS 90 -13.934 5.901 3.678
640 1HE LYS 90 1HE LYS 90 -12.001 7.003 4.817
641 2HE LYS 90 2HE LYS 90 -11.735 8.009 3.406
642 1HZ LYS 90 1HZ LYS 90 -14.210 7.971 4.991
643 2HZ LYS 90 2HZ LYS 90 -13.050 9.116 5.084
644 3HZ LYS 90 3HZ LYS 90 -13.915 8.939 3.710
645 H ALA 91 H ALA 91 -13.920 3.183 -1.151
646 HA ALA 91 HA ALA 91 -15.656 5.196 -2.341
647 1HB ALA 91 1HB ALA 91 -13.434 3.576 -3.193
648 2HB ALA 91 3HB ALA 91 -14.270 4.875 -4.077
649 3HB ALA 91 2HB ALA 91 -14.846 3.196 -4.208
650 H GLY 92 H GLY 92 -16.514 3.052 -0.322
651 1HA GLY 92 2HA GLY 92 -17.993 1.296 -0.187
652 2HA GLY 92 1HA GLY 92 -18.167 1.281 -1.931
653 H ASP 93 H ASP 93 -19.108 3.582 -2.797
654 HA ASP 93 HA ASP 93 -21.701 3.645 -2.173
655 1HB ASP 93 1HB ASP 93 -21.808 5.862 -0.814
656 2HB ASP 93 2HB ASP 93 -21.461 4.383 0.060
657 H ASP 94 H ASP 94 -19.019 6.123 -2.286
658 HA ASP 94 HA ASP 94 -20.437 7.599 -4.271
659 1HB ASP 94 1HB ASP 94 -19.081 8.753 -2.556
660 2HB ASP 94 2HB ASP 94 -17.644 7.893 -3.072
661 H LYS 95 H LYS 95 -20.139 7.337 -6.501
662 HA LYS 95 HA LYS 95 -18.375 5.287 -7.403
663 1HB LYS 95 1HB LYS 95 -20.280 7.191 -8.776
664 2HB LYS 95 2HB LYS 95 -19.256 6.089 -9.674
665 1HG LYS 95 1HG LYS 95 -20.209 4.164 -8.361
666 2HG LYS 95 2HG LYS 95 -21.265 5.280 -7.519
667 1HD LYS 95 1HD LYS 95 -22.597 5.680 -9.408
668 2HD LYS 95 2HD LYS 95 -21.300 5.330 -10.533
669 1HE LYS 95 1HE LYS 95 -21.437 2.882 -9.791
670 2HE LYS 95 2HE LYS 95 -22.870 3.303 -8.876
671 1HZ LYS 95 1HZ LYS 95 -22.704 4.007 -11.700
672 2HZ LYS 95 2HZ LYS 95 -23.112 2.487 -11.264
673 3HZ LYS 95 3HZ LYS 95 -24.031 3.748 -10.783
674 H GLU 96 H GLU 96 -18.457 8.885 -7.476
675 HA GLU 96 HA GLU 96 -16.236 9.137 -9.134
676 1HB GLU 96 1HB GLU 96 -18.047 10.884 -8.370
677 2HB GLU 96 2HB GLU 96 -16.976 11.173 -7.014
678 1HG GLU 96 1HG GLU 96 -16.448 12.762 -8.803
679 2HG GLU 96 2HG GLU 96 -15.101 11.660 -8.601
680 H LEU 97 H LEU 97 -16.617 8.407 -5.706
681 HA LEU 97 HA LEU 97 -13.985 9.205 -4.962
682 1HB LEU 97 1HB LEU 97 -16.068 9.014 -3.506
683 2HB LEU 97 2HB LEU 97 -15.796 7.283 -3.512
684 HG LEU 97 HG LEU 97 -14.897 8.199 -1.490
685 1HD1 LEU 97 1HD1 LEU 97 -13.569 6.475 -3.007
686 2HD1 LEU 97 2HD1 LEU 97 -12.365 7.786 -3.014
687 3HD1 LEU 97 3HD1 LEU 97 -12.908 7.085 -1.470
688 1HD2 LEU 97 1HD2 LEU 97 -13.517 10.172 -3.304
689 2HD2 LEU 97 2HD2 LEU 97 -14.571 10.476 -1.902
690 3HD2 LEU 97 3HD2 LEU 97 -12.927 9.839 -1.658
691 H LYS 98 H LYS 98 -15.430 6.453 -6.569
692 HA LYS 98 HA LYS 98 -13.222 4.712 -5.901
693 1HB LYS 98 1HB LYS 98 -15.633 3.964 -6.116
694 2HB LYS 98 2HB LYS 98 -15.495 4.229 -7.843
695 1HG LYS 98 1HG LYS 98 -13.310 2.723 -7.608
696 2HG LYS 98 2HG LYS 98 -14.066 2.190 -6.120
697 1HD LYS 98 1HD LYS 98 -15.673 2.219 -8.692
698 2HD LYS 98 2HD LYS 98 -14.559 0.902 -8.382
699 1HE LYS 98 1HE LYS 98 -16.819 1.765 -6.513
700 2HE LYS 98 2HE LYS 98 -16.874 0.382 -7.588
701 1HZ LYS 98 1HZ LYS 98 -14.547 0.288 -6.034
702 2HZ LYS 98 2HZ LYS 98 -15.841 0.466 -5.054
703 3HZ LYS 98 3HZ LYS 98 -15.775 -0.786 -6.100
704 H LYS 99 H LYS 99 -12.868 7.366 -7.361
705 HA LYS 99 HA LYS 99 -11.398 6.210 -9.614
706 1HB LYS 99 1HB LYS 99 -13.432 8.413 -9.680
707 2HB LYS 99 2HB LYS 99 -12.048 8.509 -10.751
708 1HG LYS 99 1HG LYS 99 -12.579 6.373 -11.779
709 2HG LYS 99 2HG LYS 99 -13.772 6.002 -10.551
710 1HD LYS 99 1HD LYS 99 -14.630 8.482 -11.565
711 2HD LYS 99 2HD LYS 99 -14.045 7.641 -12.987
712 1HE LYS 99 1HE LYS 99 -15.747 6.099 -12.937
713 2HE LYS 99 2HE LYS 99 -15.671 5.921 -11.196
714 1HZ LYS 99 1HZ LYS 99 -16.612 8.479 -11.959
715 2HZ LYS 99 2HZ LYS 99 -17.549 7.290 -12.569
716 3HZ LYS 99 3HZ LYS 99 -17.292 7.382 -10.959
717 H LYS 100 H LYS 100 -10.161 6.492 -7.231
718 HA LYS 100 HA LYS 100 -8.136 8.330 -7.815
719 1HB LYS 100 1HB LYS 100 -8.570 9.712 -5.625
720 2HB LYS 100 2HB LYS 100 -9.303 10.184 -7.145
721 1HG LYS 100 1HG LYS 100 -11.359 8.811 -6.479
722 2HG LYS 100 2HG LYS 100 -10.626 8.591 -4.903
723 1HD LYS 100 1HD LYS 100 -12.095 10.482 -4.688
724 2HD LYS 100 2HD LYS 100 -10.470 11.137 -4.712
725 1HE LYS 100 1HE LYS 100 -10.710 11.618 -7.165
726 2HE LYS 100 2HE LYS 100 -12.342 10.983 -7.124
727 1HZ LYS 100 1HZ LYS 100 -12.657 12.693 -5.273
728 2HZ LYS 100 2HZ LYS 100 -11.313 13.404 -5.871
729 3HZ LYS 100 3HZ LYS 100 -12.629 13.218 -6.820
730 H LEU 101 H LEU 101 -9.939 6.459 -5.324
731 HA LEU 101 HA LEU 101 -7.419 5.828 -4.017
732 1HB LEU 101 2HB LEU 101 -10.192 4.942 -3.237
733 2HB LEU 101 1HB LEU 101 -8.741 4.937 -2.255
734 HG LEU 101 HG LEU 101 -10.469 7.259 -3.068
735 1HD1 LEU 101 1HD1 LEU 101 -10.655 5.827 -0.890
736 2HD1 LEU 101 2HD1 LEU 101 -9.261 6.799 -0.360
737 3HD1 LEU 101 3HD1 LEU 101 -10.786 7.600 -0.810
738 1HD2 LEU 101 1HD2 LEU 101 -7.537 7.332 -2.421
739 2HD2 LEU 101 2HD2 LEU 101 -8.456 8.235 -3.649
740 3HD2 LEU 101 3HD2 LEU 101 -8.601 8.672 -1.930
741 H THR 102 H THR 102 -9.915 4.449 -6.141
742 HA THR 102 HA THR 102 -8.211 2.073 -6.406
743 HB THR 102 HB THR 102 -10.076 0.613 -6.128
744 HG1 THR 102 HG1 THR 102 -11.861 1.429 -7.152
745 1HG2 THR 102 1HG2 THR 102 -9.518 2.011 -3.965
746 2HG2 THR 102 2HG2 THR 102 -11.023 2.886 -4.337
747 3HG2 THR 102 3HG2 THR 102 -11.066 1.135 -4.019
748 H GLY 103 H GLY 103 -9.082 4.788 -7.855
749 1HA GLY 103 2HA GLY 103 -8.823 5.283 -10.076
750 2HA GLY 103 1HA GLY 103 -10.423 4.569 -10.105
751 H CYS 104 H CYS 104 -7.044 3.241 -9.797
752 HA CYS 104 HA CYS 104 -6.277 1.301 -10.630
753 1HB CYS 104 1HB CYS 104 -8.879 0.787 -11.055
754 2HB CYS 104 2HB CYS 104 -8.363 0.962 -12.720
755 H LYS 105 H LYS 105 -7.871 3.703 -12.799
756 HA LYS 105 HA LYS 105 -5.356 3.845 -14.291
757 1HB LYS 105 1HB LYS 105 -6.833 2.490 -15.646
758 2HB LYS 105 2HB LYS 105 -8.139 3.646 -15.475
759 1HG LYS 105 1HG LYS 105 -7.207 4.161 -17.598
760 2HG LYS 105 2HG LYS 105 -6.535 5.387 -16.542
761 1HD LYS 105 1HD LYS 105 -4.391 4.454 -16.576
762 2HD LYS 105 2HD LYS 105 -4.982 2.824 -16.831
763 1HE LYS 105 1HE LYS 105 -5.718 3.587 -19.183
764 2HE LYS 105 2HE LYS 105 -4.824 5.066 -18.893
765 1HZ LYS 105 1HZ LYS 105 -3.622 2.399 -18.651
766 2HZ LYS 105 2HZ LYS 105 -3.563 3.291 -20.017
767 3HZ LYS 105 3HZ LYS 105 -2.844 3.834 -18.655
768 H GLY 106 H GLY 106 -4.648 5.748 -13.356
769 1HA GLY 106 2HA GLY 106 -6.156 8.130 -14.083
770 2HA GLY 106 1HA GLY 106 -4.509 8.042 -13.491
771 H SER 107 H SER 107 -4.786 6.517 -11.132
772 HA SER 107 HA SER 107 -6.743 8.038 -9.612
773 1HB SER 107 2HB SER 107 -6.659 6.285 -7.960
774 2HB SER 107 1HB SER 107 -6.795 5.508 -9.525
775 HG SER 107 HG SER 107 -5.121 4.381 -8.724
776 H ALA 108 H ALA 108 -5.637 7.844 -7.033
777 HA ALA 108 HA ALA 108 -3.547 9.803 -7.238
778 1HB ALA 108 1HB ALA 108 -4.126 10.316 -5.082
779 2HB ALA 108 3HB ALA 108 -5.612 9.446 -5.531
780 3HB ALA 108 2HB ALA 108 -4.333 8.611 -4.616
781 H CYS 109 H CYS 109 -3.532 6.539 -7.670
782 HA CYS 109 HA CYS 109 -0.997 6.226 -6.234
783 1HB CYS 109 1HB CYS 109 -3.023 4.132 -7.082
784 2HB CYS 109 2HB CYS 109 -1.428 3.754 -6.463
785 H HIS 110 H HIS 110 -2.849 5.442 -9.259
786 HA HIS 110 HA HIS 110 -0.266 5.384 -10.646
787 1HB HIS 110 2HB HIS 110 -2.804 3.877 -11.339
788 2HB HIS 110 1HB HIS 110 -1.319 3.857 -12.269
789 HD1 HIS 110 HD1 HIS 110 0.840 3.334 -10.235
790 HD2 HIS 110 HD2 HIS 110 -2.920 1.484 -10.046
791 HE1 HIS 110 HE1 HIS 110 1.155 1.212 -8.853
792 HA PRO 111 HA PRO 111 -2.505 8.888 -12.456
793 1HB PRO 111 1HB PRO 111 -0.718 10.837 -11.963
794 2HB PRO 111 2HB PRO 111 -1.686 10.143 -10.623
795 1HG PRO 111 2HG PRO 111 1.408 9.399 -10.998
796 2HG PRO 111 1HG PRO 111 0.094 9.750 -9.828
797 1HD PRO 111 1HD PRO 111 0.890 7.179 -11.119
798 2HD PRO 111 2HD PRO 111 -0.165 7.448 -9.699
799 H SER 112 H SER 112 -1.723 7.123 -14.274
800 HA SER 112 HA SER 112 0.294 8.563 -15.812
801 1HB SER 112 1HB SER 112 0.287 5.812 -14.946
802 2HB SER 112 2HB SER 112 0.117 5.826 -16.690
803 HG SER 112 HG SER 112 2.271 6.762 -15.069
No H/Q in entry = 803
Start of MODEL 17
1 H1 VAL 1 H1 VAL 1 5.924 7.275 15.916
2 H2 VAL 1 H2 VAL 1 6.530 5.750 15.694
3 H3 VAL 1 H3 VAL 1 5.831 6.161 17.138
4 HA VAL 1 HA VAL 1 7.564 7.189 17.919
5 HB VAL 1 HB VAL 1 9.203 5.711 17.729
6 1HG1 VAL 1 1HG1 VAL 1 7.397 4.569 15.573
7 2HG1 VAL 1 2HG1 VAL 1 8.759 3.694 16.312
8 3HG1 VAL 1 3HG1 VAL 1 7.375 4.195 17.313
9 1HG2 VAL 1 1HG2 VAL 1 9.284 6.384 14.773
10 2HG2 VAL 1 2HG2 VAL 1 10.392 6.933 16.053
11 3HG2 VAL 1 3HG2 VAL 1 10.389 5.226 15.551
12 H ASP 2 H ASP 2 6.907 7.710 14.517
13 HA ASP 2 HA ASP 2 7.498 10.362 14.629
14 1HB ASP 2 1HB ASP 2 9.872 8.720 14.249
15 2HB ASP 2 2HB ASP 2 9.589 9.661 12.798
16 H VAL 3 H VAL 3 5.535 10.323 13.354
17 HA VAL 3 HA VAL 3 5.192 8.712 11.096
18 HB VAL 3 HB VAL 3 3.653 10.346 12.644
19 1HG1 VAL 3 1HG1 VAL 3 3.951 11.701 9.942
20 2HG1 VAL 3 2HG1 VAL 3 2.665 12.045 11.125
21 3HG1 VAL 3 3HG1 VAL 3 4.365 12.385 11.533
22 1HG2 VAL 3 1HG2 VAL 3 3.298 8.693 10.237
23 2HG2 VAL 3 2HG2 VAL 3 2.353 8.746 11.745
24 3HG2 VAL 3 3HG2 VAL 3 2.035 9.929 10.453
25 HA PRO 4 HA PRO 4 8.274 10.412 8.407
26 1HB PRO 4 1HB PRO 4 6.278 9.225 6.448
27 2HB PRO 4 2HB PRO 4 8.064 9.080 6.526
28 1HG PRO 4 1HG PRO 4 6.640 7.025 7.519
29 2HG PRO 4 2HG PRO 4 8.158 7.577 8.298
30 1HD PRO 4 2HD PRO 4 5.260 8.033 9.082
31 2HD PRO 4 1HD PRO 4 6.702 7.850 10.127
32 H ALA 5 H ALA 5 8.249 12.008 6.513
33 HA ALA 5 HA ALA 5 6.079 13.885 6.964
34 1HB ALA 5 1HB ALA 5 7.537 15.479 5.883
35 2HB ALA 5 3HB ALA 5 8.601 14.181 5.288
36 3HB ALA 5 2HB ALA 5 8.519 14.536 7.030
37 H ASP 6 H ASP 6 4.795 14.762 5.230
38 HA ASP 6 HA ASP 6 3.834 12.890 3.506
39 1HB ASP 6 1HB ASP 6 2.510 14.831 3.976
40 2HB ASP 6 2HB ASP 6 3.791 15.927 3.500
41 H GLY 7 H GLY 7 3.808 13.244 0.950
42 1HA GLY 7 2HA GLY 7 6.086 14.483 -0.246
43 2HA GLY 7 1HA GLY 7 4.887 13.469 -1.023
44 H ALA 8 H ALA 8 5.072 11.061 0.430
45 HA ALA 8 HA ALA 8 7.897 10.326 0.260
46 1HB ALA 8 1HB ALA 8 6.477 9.860 2.325
47 2HB ALA 8 3HB ALA 8 5.567 8.697 1.333
48 3HB ALA 8 2HB ALA 8 7.305 8.448 1.626
49 H LYS 9 H LYS 9 8.593 9.521 -1.650
50 HA LYS 9 HA LYS 9 6.619 8.429 -3.473
51 1HB LYS 9 2HB LYS 9 7.960 9.182 -5.093
52 2HB LYS 9 1HB LYS 9 8.807 10.053 -3.830
53 1HG LYS 9 1HG LYS 9 10.125 7.762 -3.521
54 2HG LYS 9 2HG LYS 9 9.552 7.427 -5.143
55 1HD LYS 9 1HD LYS 9 10.493 9.757 -5.795
56 2HD LYS 9 2HD LYS 9 11.298 9.754 -4.238
57 1HE LYS 9 1HE LYS 9 12.114 7.323 -5.037
58 2HE LYS 9 2HE LYS 9 11.785 7.975 -6.630
59 1HZ LYS 9 1HZ LYS 9 13.486 9.300 -4.635
60 2HZ LYS 9 2HZ LYS 9 14.048 8.380 -5.861
61 3HZ LYS 9 3HZ LYS 9 13.258 9.774 -6.181
62 H ILE 10 H ILE 10 6.472 6.284 -4.083
63 HA ILE 10 HA ILE 10 8.328 4.478 -2.694
64 HB ILE 10 HB ILE 10 5.419 3.969 -3.317
65 1HG1 ILE 10 1HG1 ILE 10 6.513 4.441 -0.552
66 2HG1 ILE 10 2HG1 ILE 10 6.026 5.795 -1.553
67 1HG2 ILE 10 1HG2 ILE 10 7.640 2.337 -2.221
68 2HG2 ILE 10 2HG2 ILE 10 6.067 2.197 -1.399
69 3HG2 ILE 10 3HG2 ILE 10 6.194 1.854 -3.141
70 1HD1 ILE 10 1HD1 ILE 10 4.210 3.401 -1.047
71 2HD1 ILE 10 2HD1 ILE 10 4.209 4.854 -0.020
72 3HD1 ILE 10 3HD1 ILE 10 3.761 4.978 -1.738
73 H ASP 11 H ASP 11 9.564 3.252 -4.011
74 HA ASP 11 HA ASP 11 8.456 2.328 -6.468
75 1HB ASP 11 1HB ASP 11 9.260 4.416 -7.333
76 2HB ASP 11 2HB ASP 11 10.717 4.354 -6.361
77 H PHE 12 H PHE 12 8.927 0.189 -5.730
78 HA PHE 12 HA PHE 12 11.763 -0.336 -5.174
79 1HB PHE 12 1HB PHE 12 9.158 -1.695 -4.253
80 2HB PHE 12 2HB PHE 12 10.753 -2.308 -3.865
81 HD1 PHE 12 HD1 PHE 12 12.209 0.153 -3.170
82 HD2 PHE 12 HD2 PHE 12 8.243 -1.027 -2.228
83 HE1 PHE 12 HE1 PHE 12 12.266 1.599 -1.119
84 HE2 PHE 12 HE2 PHE 12 8.300 0.419 -0.178
85 HZ PHE 12 HZ PHE 12 10.310 1.715 0.353
86 H ILE 13 H ILE 13 8.848 -1.157 -7.015
87 HA ILE 13 HA ILE 13 10.256 -3.424 -8.213
88 HB ILE 13 HB ILE 13 7.356 -2.589 -8.255
89 1HG1 ILE 13 1HG1 ILE 13 8.566 -5.089 -7.063
90 2HG1 ILE 13 2HG1 ILE 13 8.384 -3.610 -6.140
91 1HG2 ILE 13 1HG2 ILE 13 8.851 -4.673 -9.811
92 2HG2 ILE 13 2HG2 ILE 13 7.170 -4.974 -9.308
93 3HG2 ILE 13 3HG2 ILE 13 7.555 -3.569 -10.331
94 1HD1 ILE 13 1HD1 ILE 13 6.094 -5.006 -7.599
95 2HD1 ILE 13 2HD1 ILE 13 6.445 -5.184 -5.864
96 3HD1 ILE 13 3HD1 ILE 13 5.959 -3.601 -6.515
97 H ALA 14 H ALA 14 11.644 -2.670 -9.759
98 HA ALA 14 HA ALA 14 10.811 -0.450 -11.417
99 1HB ALA 14 1HB ALA 14 13.327 -1.963 -10.833
100 2HB ALA 14 2HB ALA 14 13.193 -1.181 -12.426
101 3HB ALA 14 3HB ALA 14 13.048 -0.208 -10.942
102 H GLY 15 H GLY 15 10.097 -0.592 -13.521
103 1HA GLY 15 2HA GLY 15 9.167 -3.121 -14.446
104 2HA GLY 15 1HA GLY 15 10.599 -2.618 -15.323
105 H GLY 16 H GLY 16 8.163 -2.886 -16.674
106 1HA GLY 16 2HA GLY 16 6.553 -0.615 -16.810
107 2HA GLY 16 1HA GLY 16 6.798 -1.793 -18.084
108 H GLU 17 H GLU 17 6.409 0.853 -18.803
109 HA GLU 17 HA GLU 17 8.307 1.375 -20.562
110 1HB GLU 17 1HB GLU 17 6.221 2.932 -19.222
111 2HB GLU 17 2HB GLU 17 7.570 3.955 -19.675
112 1HG GLU 17 1HG GLU 17 5.738 3.646 -21.454
113 2HG GLU 17 2HG GLU 17 7.386 3.384 -21.992
114 H LYS 18 H LYS 18 8.296 2.584 -17.145
115 HA LYS 18 HA LYS 18 11.192 2.754 -17.300
116 1HB LYS 18 1HB LYS 18 11.125 5.034 -16.233
117 2HB LYS 18 2HB LYS 18 10.669 4.978 -17.924
118 1HG LYS 18 1HG LYS 18 8.206 4.694 -16.970
119 2HG LYS 18 2HG LYS 18 8.892 5.352 -15.497
120 1HD LYS 18 1HD LYS 18 9.213 7.453 -16.411
121 2HD LYS 18 2HD LYS 18 9.602 6.826 -18.000
122 1HE LYS 18 2HE LYS 18 7.461 7.977 -18.153
123 2HE LYS 18 1HE LYS 18 7.163 6.260 -18.340
124 1HZ LYS 18 1HZ LYS 18 6.976 7.576 -15.730
125 2HZ LYS 18 2HZ LYS 18 5.703 7.494 -16.750
126 3HZ LYS 18 3HZ LYS 18 6.374 6.123 -16.169
127 H ASN 19 H ASN 19 8.337 3.511 -15.176
128 HA ASN 19 HA ASN 19 8.510 1.457 -13.510
129 1HB ASN 19 1HB ASN 19 9.814 2.733 -11.521
130 2HB ASN 19 2HB ASN 19 10.666 1.696 -12.648
131 2HD2 ASN 19 2HD2 ASN 19 9.399 5.029 -12.543
132 1HD2 ASN 19 1HD2 ASN 19 10.809 5.818 -13.168
133 H LEU 20 H LEU 20 6.599 1.725 -12.330
134 HA LEU 20 HA LEU 20 5.376 4.301 -12.275
135 1HB LEU 20 1HB LEU 20 4.587 1.598 -11.193
136 2HB LEU 20 2HB LEU 20 3.597 3.032 -11.012
137 HG LEU 20 HG LEU 20 4.393 1.690 -13.608
138 1HD1 LEU 20 1HD1 LEU 20 1.953 1.682 -11.902
139 2HD1 LEU 20 2HD1 LEU 20 1.724 1.714 -13.667
140 3HD1 LEU 20 3HD1 LEU 20 2.658 0.399 -12.914
141 1HD2 LEU 20 1HD2 LEU 20 2.861 4.264 -13.158
142 2HD2 LEU 20 2HD2 LEU 20 4.410 4.056 -14.010
143 3HD2 LEU 20 3HD2 LEU 20 2.916 3.375 -14.700
144 H THR 21 H THR 21 5.251 5.772 -10.621
145 HA THR 21 HA THR 21 6.509 4.960 -8.083
146 HB THR 21 HB THR 21 6.647 7.784 -9.185
147 HG1 THR 21 HG1 THR 21 8.035 7.007 -10.731
148 1HG2 THR 21 1HG2 THR 21 7.605 6.716 -6.861
149 2HG2 THR 21 2HG2 THR 21 8.954 6.306 -7.948
150 3HG2 THR 21 3HG2 THR 21 8.461 8.004 -7.742
151 H VAL 22 H VAL 22 5.002 4.796 -6.551
152 HA VAL 22 HA VAL 22 2.626 6.454 -6.795
153 HB VAL 22 HB VAL 22 3.391 4.114 -5.045
154 1HG1 VAL 22 1HG1 VAL 22 1.105 6.030 -4.851
155 2HG1 VAL 22 2HG1 VAL 22 0.771 4.303 -4.578
156 3HG1 VAL 22 3HG1 VAL 22 1.973 5.146 -3.573
157 1HG2 VAL 22 1HG2 VAL 22 2.006 4.438 -7.615
158 2HG2 VAL 22 2HG2 VAL 22 2.743 2.994 -6.881
159 3HG2 VAL 22 3HG2 VAL 22 1.090 3.476 -6.430
160 H VAL 23 H VAL 23 2.070 8.091 -5.363
161 HA VAL 23 HA VAL 23 4.226 8.862 -3.535
162 HB VAL 23 HB VAL 23 1.983 10.425 -4.826
163 1HG1 VAL 23 1HG1 VAL 23 3.040 10.993 -2.372
164 2HG1 VAL 23 2HG1 VAL 23 4.138 11.898 -3.442
165 3HG1 VAL 23 3HG1 VAL 23 2.386 12.205 -3.499
166 1HG2 VAL 23 1HG2 VAL 23 3.904 9.764 -6.292
167 2HG2 VAL 23 2HG2 VAL 23 3.708 11.523 -6.100
168 3HG2 VAL 23 3HG2 VAL 23 4.984 10.667 -5.203
169 H PHE 24 H PHE 24 3.930 8.720 -1.365
170 HA PHE 24 HA PHE 24 1.163 8.318 -0.464
171 1HB PHE 24 1HB PHE 24 2.931 6.376 -0.401
172 2HB PHE 24 2HB PHE 24 3.779 7.325 0.804
173 HD1 PHE 24 HD1 PHE 24 0.227 6.300 0.216
174 HD2 PHE 24 HD2 PHE 24 3.456 6.593 2.954
175 HE1 PHE 24 HE1 PHE 24 -1.207 5.297 2.015
176 HE2 PHE 24 HE2 PHE 24 2.022 5.590 4.753
177 HZ PHE 24 HZ PHE 24 -0.293 4.954 4.262
178 H ASN 25 H ASN 25 1.212 8.646 2.155
179 HA ASN 25 HA ASN 25 2.968 10.651 3.035
180 1HB ASN 25 2HB ASN 25 0.371 11.923 3.297
181 2HB ASN 25 1HB ASN 25 1.816 12.561 2.539
182 2HD2 ASN 25 2HD2 ASN 25 1.877 12.814 0.424
183 1HD2 ASN 25 1HD2 ASN 25 0.728 12.209 -0.723
184 H HIS 26 H HIS 26 3.021 10.366 5.284
185 HA HIS 26 HA HIS 26 1.146 8.577 6.450
186 1HB HIS 26 1HB HIS 26 3.650 9.962 7.268
187 2HB HIS 26 2HB HIS 26 2.559 9.494 8.557
188 HD1 HIS 26 HD1 HIS 26 4.216 7.851 5.509
189 HD2 HIS 26 HD2 HIS 26 2.902 6.912 9.380
190 HE1 HIS 26 HE1 HIS 26 4.900 5.428 5.928
191 H SER 27 H SER 27 1.221 11.966 5.843
192 HA SER 27 HA SER 27 -0.349 12.619 8.148
193 1HB SER 27 1HB SER 27 -0.161 14.574 5.911
194 2HB SER 27 2HB SER 27 0.102 14.812 7.627
195 HG SER 27 HG SER 27 2.206 14.536 7.347
196 H THR 28 H THR 28 -1.106 10.766 5.654
197 HA THR 28 HA THR 28 -3.671 12.098 5.085
198 HB THR 28 HB THR 28 -2.298 9.891 3.477
199 HG1 THR 28 HG1 THR 28 -2.233 12.825 3.385
200 1HG2 THR 28 1HG2 THR 28 -4.655 11.723 3.132
201 2HG2 THR 28 2HG2 THR 28 -3.599 11.524 1.713
202 3HG2 THR 28 3HG2 THR 28 -4.377 10.102 2.451
203 H HIS 29 H HIS 29 -2.048 9.208 6.349
204 HA HIS 29 HA HIS 29 -4.707 8.084 6.845
205 1HB HIS 29 2HB HIS 29 -2.040 6.647 6.797
206 2HB HIS 29 1HB HIS 29 -3.616 5.912 7.010
207 HD1 HIS 29 HD1 HIS 29 -1.595 7.784 4.368
208 HD2 HIS 29 HD2 HIS 29 -4.924 5.248 4.668
209 HE1 HIS 29 HE1 HIS 29 -2.252 7.180 1.977
210 H LYS 30 H LYS 30 -3.101 10.251 8.325
211 HA LYS 30 HA LYS 30 -2.056 9.206 10.670
212 1HB LYS 30 1HB LYS 30 -2.167 11.430 11.512
213 2HB LYS 30 2HB LYS 30 -1.803 11.540 9.802
214 1HG LYS 30 1HG LYS 30 -4.695 11.628 10.690
215 2HG LYS 30 2HG LYS 30 -3.706 13.062 10.885
216 1HD LYS 30 1HD LYS 30 -3.051 12.397 8.308
217 2HD LYS 30 2HD LYS 30 -4.679 11.750 8.375
218 1HE LYS 30 2HE LYS 30 -5.017 13.986 7.667
219 2HE LYS 30 1HE LYS 30 -5.368 14.056 9.382
220 1HZ LYS 30 1HZ LYS 30 -2.899 14.616 9.576
221 2HZ LYS 30 2HZ LYS 30 -2.984 14.983 7.986
222 3HZ LYS 30 3HZ LYS 30 -3.921 15.781 9.060
223 H ASP 31 H ASP 31 -5.313 9.263 9.483
224 HA ASP 31 HA ASP 31 -6.458 9.193 12.102
225 1HB ASP 31 2HB ASP 31 -8.549 9.228 11.003
226 2HB ASP 31 1HB ASP 31 -7.518 10.145 9.922
227 H VAL 32 H VAL 32 -4.699 7.055 10.214
228 HA VAL 32 HA VAL 32 -6.275 4.728 11.066
229 HB VAL 32 HB VAL 32 -4.126 4.858 8.949
230 1HG1 VAL 32 1HG1 VAL 32 -4.704 2.639 10.040
231 2HG1 VAL 32 2HG1 VAL 32 -6.322 2.803 9.316
232 3HG1 VAL 32 3HG1 VAL 32 -4.885 2.707 8.270
233 1HG2 VAL 32 1HG2 VAL 32 -7.099 5.330 8.753
234 2HG2 VAL 32 2HG2 VAL 32 -5.761 6.269 8.050
235 3HG2 VAL 32 3HG2 VAL 32 -6.178 4.675 7.378
236 H LYS 33 H LYS 33 -5.397 3.287 12.509
237 HA LYS 33 HA LYS 33 -3.307 4.075 14.119
238 1HB LYS 33 1HB LYS 33 -4.346 1.267 13.631
239 2HB LYS 33 2HB LYS 33 -3.393 1.783 15.007
240 1HG LYS 33 1HG LYS 33 -5.182 2.773 16.035
241 2HG LYS 33 2HG LYS 33 -5.753 3.507 14.550
242 1HD LYS 33 1HD LYS 33 -6.791 1.388 13.839
243 2HD LYS 33 2HD LYS 33 -6.105 0.546 15.215
244 1HE LYS 33 1HE LYS 33 -7.403 2.509 16.565
245 2HE LYS 33 2HE LYS 33 -8.403 2.488 15.126
246 1HZ LYS 33 1HZ LYS 33 -8.045 -0.126 15.743
247 2HZ LYS 33 2HZ LYS 33 -8.242 0.582 17.202
248 3HZ LYS 33 3HZ LYS 33 -9.384 0.758 16.048
249 H CYS 34 H CYS 34 -1.157 2.998 14.442
250 HA CYS 34 HA CYS 34 0.223 3.012 11.961
251 1HB CYS 34 1HB CYS 34 1.388 2.165 14.605
252 2HB CYS 34 2HB CYS 34 2.206 2.872 13.226
253 H ASP 35 H ASP 35 -0.838 0.591 14.410
254 HA ASP 35 HA ASP 35 0.550 -1.550 13.314
255 1HB ASP 35 1HB ASP 35 -1.147 -2.937 14.586
256 2HB ASP 35 2HB ASP 35 -0.347 -1.714 15.553
257 H ASP 36 H ASP 36 -2.032 0.333 12.106
258 HA ASP 36 HA ASP 36 -3.685 -1.592 11.001
259 1HB ASP 36 1HB ASP 36 -3.864 1.054 11.207
260 2HB ASP 36 2HB ASP 36 -3.110 1.047 9.625
261 H CYS 37 H CYS 37 -0.443 -0.542 10.263
262 HA CYS 37 HA CYS 37 -0.544 -2.074 7.780
263 1HB CYS 37 1HB CYS 37 0.897 0.582 8.087
264 2HB CYS 37 2HB CYS 37 0.957 -0.463 6.681
265 H HIS 38 H HIS 38 1.452 -0.456 10.344
266 HA HIS 38 HA HIS 38 3.684 -2.145 9.856
267 1HB HIS 38 1HB HIS 38 3.025 -0.263 12.138
268 2HB HIS 38 2HB HIS 38 4.559 -1.087 11.947
269 HD1 HIS 38 HD1 HIS 38 5.821 -0.526 9.526
270 HD2 HIS 38 HD2 HIS 38 2.918 2.174 10.896
271 HE1 HIS 38 HE1 HIS 38 6.226 1.658 8.270
272 H HIS 39 H HIS 39 2.409 -4.215 9.909
273 HA HIS 39 HA HIS 39 1.555 -5.007 12.554
274 1HB HIS 39 1HB HIS 39 0.491 -6.809 11.533
275 2HB HIS 39 2HB HIS 39 0.302 -5.499 10.384
276 HD1 HIS 39 HD1 HIS 39 1.352 -8.960 10.587
277 HD2 HIS 39 HD2 HIS 39 2.386 -5.660 8.213
278 HE1 HIS 39 HE1 HIS 39 2.507 -9.903 8.516
279 H GLN 40 H GLN 40 4.262 -4.370 12.561
280 HA GLN 40 HA GLN 40 5.534 -6.988 12.444
281 1HB GLN 40 1HB GLN 40 6.570 -4.164 12.155
282 2HB GLN 40 2HB GLN 40 7.663 -5.418 12.706
283 1HG GLN 40 1HG GLN 40 7.465 -4.957 10.128
284 2HG GLN 40 2HG GLN 40 7.544 -6.616 10.685
285 2HE2 GLN 40 2HE2 GLN 40 5.758 -7.932 10.620
286 1HE2 GLN 40 1HE2 GLN 40 4.313 -7.552 9.744
287 HA PRO 41 HA PRO 41 5.734 -7.323 16.803
288 1HB PRO 41 1HB PRO 41 8.246 -8.492 17.057
289 2HB PRO 41 2HB PRO 41 6.782 -9.356 16.484
290 1HG PRO 41 2HG PRO 41 8.921 -8.103 14.848
291 2HG PRO 41 1HG PRO 41 8.250 -9.748 14.602
292 1HD PRO 41 1HD PRO 41 7.345 -7.732 13.090
293 2HD PRO 41 2HD PRO 41 6.147 -8.828 13.843
294 H GLY 42 H GLY 42 6.836 -6.375 18.712
295 1HA GLY 42 2HA GLY 42 8.109 -4.853 19.786
296 2HA GLY 42 1HA GLY 42 7.638 -3.792 18.473
297 H ASP 43 H ASP 43 9.919 -2.938 19.205
298 HA ASP 43 HA ASP 43 12.059 -2.711 18.872
299 1HB ASP 43 2HB ASP 43 12.213 -5.482 17.616
300 2HB ASP 43 1HB ASP 43 13.519 -4.578 18.355
301 H LYS 44 H LYS 44 10.850 -4.911 16.216
302 HA LYS 44 HA LYS 44 11.777 -2.895 14.291
303 1HB LYS 44 2HB LYS 44 12.071 -4.727 12.705
304 2HB LYS 44 1HB LYS 44 13.035 -4.979 14.146
305 1HG LYS 44 1HG LYS 44 11.134 -6.442 15.049
306 2HG LYS 44 2HG LYS 44 10.373 -6.313 13.476
307 1HD LYS 44 1HD LYS 44 12.094 -7.531 12.390
308 2HD LYS 44 2HD LYS 44 13.263 -7.207 13.655
309 1HE LYS 44 1HE LYS 44 12.588 -9.002 14.909
310 2HE LYS 44 2HE LYS 44 10.888 -8.666 14.650
311 1HZ LYS 44 1HZ LYS 44 12.619 -9.847 12.594
312 2HZ LYS 44 2HZ LYS 44 11.704 -10.731 13.618
313 3HZ LYS 44 3HZ LYS 44 10.992 -9.717 12.555
314 H GLN 45 H GLN 45 9.203 -2.997 15.847
315 HA GLN 45 HA GLN 45 7.171 -4.005 14.303
316 1HB GLN 45 1HB GLN 45 6.617 -3.337 16.505
317 2HB GLN 45 2HB GLN 45 7.355 -1.758 16.323
318 1HG GLN 45 1HG GLN 45 5.571 -1.138 14.659
319 2HG GLN 45 2HG GLN 45 4.819 -2.702 14.903
320 2HE2 GLN 45 2HE2 GLN 45 2.991 -1.303 15.467
321 1HE2 GLN 45 1HE2 GLN 45 2.803 -0.766 17.103
322 H TYR 46 H TYR 46 9.253 -1.310 13.817
323 HA TYR 46 HA TYR 46 7.551 -0.366 11.557
324 1HB TYR 46 1HB TYR 46 9.462 1.209 13.315
325 2HB TYR 46 2HB TYR 46 8.594 1.849 11.908
326 HD1 TYR 46 HD1 TYR 46 8.299 0.737 15.406
327 HD2 TYR 46 HD2 TYR 46 6.199 2.292 11.997
328 HE1 TYR 46 HE1 TYR 46 6.369 1.309 16.855
329 HE2 TYR 46 HE2 TYR 46 4.269 2.863 13.446
330 HH TYR 46 HH TYR 46 3.465 1.748 16.065
331 H ALA 47 H ALA 47 8.865 -2.316 10.538
332 HA ALA 47 HA ALA 47 11.477 -1.251 9.706
333 1HB ALA 47 1HB ALA 47 10.635 -3.830 10.745
334 2HB ALA 47 3HB ALA 47 12.277 -3.232 10.404
335 3HB ALA 47 2HB ALA 47 11.327 -4.009 9.114
336 H GLY 48 H GLY 48 12.005 -2.616 7.446
337 1HA GLY 48 2HA GLY 48 11.609 -2.494 5.230
338 2HA GLY 48 1HA GLY 48 10.256 -1.427 5.549
339 H CYS 49 H CYS 49 8.884 -2.456 3.995
340 HA CYS 49 HA CYS 49 7.558 -4.759 5.057
341 1HB CYS 49 1HB CYS 49 7.000 -3.414 2.416
342 2HB CYS 49 2HB CYS 49 5.921 -4.406 3.376
343 H THR 50 H THR 50 9.926 -3.906 2.544
344 HA THR 50 HA THR 50 9.730 -6.542 1.322
345 HB THR 50 HB THR 50 11.478 -5.475 -0.216
346 HG1 THR 50 HG1 THR 50 12.119 -3.985 1.618
347 1HG2 THR 50 1HG2 THR 50 8.751 -4.267 0.290
348 2HG2 THR 50 2HG2 THR 50 9.859 -3.413 -0.811
349 3HG2 THR 50 3HG2 THR 50 9.363 -5.085 -1.167
350 H THR 51 H THR 51 10.663 -5.991 4.204
351 HA THR 51 HA THR 51 13.448 -6.530 4.220
352 HB THR 51 HB THR 51 11.357 -7.041 6.395
353 HG1 THR 51 HG1 THR 51 11.630 -4.758 6.755
354 1HG2 THR 51 1HG2 THR 51 14.333 -6.340 6.366
355 2HG2 THR 51 2HG2 THR 51 13.309 -6.108 7.803
356 3HG2 THR 51 3HG2 THR 51 13.559 -7.742 7.143
357 H ASP 52 H ASP 52 14.520 -8.486 4.969
358 HA ASP 52 HA ASP 52 13.831 -10.640 3.452
359 1HB ASP 52 1HB ASP 52 15.870 -9.934 5.286
360 2HB ASP 52 2HB ASP 52 15.205 -11.422 5.930
361 H GLY 53 H GLY 53 13.022 -12.830 4.144
362 1HA GLY 53 2HA GLY 53 11.999 -13.440 6.651
363 2HA GLY 53 1HA GLY 53 11.517 -14.172 5.134
364 H CYS 54 H CYS 54 10.790 -11.246 4.196
365 HA CYS 54 HA CYS 54 8.150 -11.312 5.451
366 1HB CYS 54 2HB CYS 54 9.593 -8.733 4.784
367 2HB CYS 54 1HB CYS 54 8.063 -8.919 5.618
368 H HIS 55 H HIS 55 8.069 -8.658 3.561
369 HA HIS 55 HA HIS 55 7.164 -10.195 1.272
370 1HB HIS 55 2HB HIS 55 6.837 -7.227 1.736
371 2HB HIS 55 1HB HIS 55 5.934 -8.254 0.641
372 HD1 HIS 55 HD1 HIS 55 4.306 -10.086 1.839
373 HD2 HIS 55 HD2 HIS 55 5.755 -6.983 4.262
374 HE1 HIS 55 HE1 HIS 55 2.814 -10.039 3.908
375 H ASN 56 H ASN 56 9.891 -10.370 1.467
376 HA ASN 56 HA ASN 56 11.038 -8.224 -0.039
377 1HB ASN 56 1HB ASN 56 12.302 -9.423 1.790
378 2HB ASN 56 2HB ASN 56 12.229 -10.903 0.856
379 2HD2 ASN 56 2HD2 ASN 56 14.560 -9.537 1.753
380 1HD2 ASN 56 1HD2 ASN 56 15.493 -9.064 0.373
381 H ILE 57 H ILE 57 9.267 -8.891 -1.806
382 HA ILE 57 HA ILE 57 10.582 -10.778 -3.620
383 HB ILE 57 HB ILE 57 7.604 -10.618 -3.153
384 1HG1 ILE 57 1HG1 ILE 57 9.131 -11.653 -1.305
385 2HG1 ILE 57 2HG1 ILE 57 7.680 -12.489 -1.819
386 1HG2 ILE 57 1HG2 ILE 57 8.329 -11.186 -5.466
387 2HG2 ILE 57 2HG2 ILE 57 9.205 -12.588 -4.805
388 3HG2 ILE 57 3HG2 ILE 57 7.435 -12.490 -4.649
389 1HD1 ILE 57 1HD1 ILE 57 10.389 -13.041 -3.095
390 2HD1 ILE 57 2HD1 ILE 57 9.816 -13.913 -1.653
391 3HD1 ILE 57 3HD1 ILE 57 8.915 -14.034 -3.183
392 H LEU 58 H LEU 58 11.359 -9.512 -5.225
393 HA LEU 58 HA LEU 58 9.751 -7.198 -5.999
394 1HB LEU 58 1HB LEU 58 12.621 -7.909 -6.622
395 2HB LEU 58 2HB LEU 58 11.797 -6.451 -7.135
396 HG LEU 58 HG LEU 58 12.493 -7.256 -4.301
397 1HD1 LEU 58 1HD1 LEU 58 14.246 -6.279 -5.924
398 2HD1 LEU 58 2HD1 LEU 58 13.357 -4.749 -5.727
399 3HD1 LEU 58 3HD1 LEU 58 14.076 -5.550 -4.309
400 1HD2 LEU 58 1HD2 LEU 58 10.476 -5.355 -5.306
401 2HD2 LEU 58 2HD2 LEU 58 10.635 -6.140 -3.716
402 3HD2 LEU 58 3HD2 LEU 58 11.599 -4.692 -4.093
403 H ASP 59 H ASP 59 9.603 -10.328 -6.659
404 HA ASP 59 HA ASP 59 9.723 -10.047 -9.536
405 1HB ASP 59 1HB ASP 59 9.079 -12.595 -9.325
406 2HB ASP 59 2HB ASP 59 10.715 -12.087 -8.959
407 H LYS 60 H LYS 60 7.741 -8.509 -9.238
408 HA LYS 60 HA LYS 60 5.345 -9.153 -8.200
409 1HB LYS 60 2HB LYS 60 4.364 -7.635 -9.831
410 2HB LYS 60 1HB LYS 60 5.883 -7.003 -9.231
411 1HG LYS 60 1HG LYS 60 7.008 -8.053 -11.293
412 2HG LYS 60 2HG LYS 60 5.401 -8.382 -11.909
413 1HD LYS 60 1HD LYS 60 5.226 -5.692 -11.164
414 2HD LYS 60 2HD LYS 60 6.869 -5.815 -11.761
415 1HE LYS 60 1HE LYS 60 5.819 -5.441 -13.787
416 2HE LYS 60 2HE LYS 60 5.654 -7.186 -13.747
417 1HZ LYS 60 1HZ LYS 60 3.628 -5.302 -12.754
418 2HZ LYS 60 2HZ LYS 60 3.572 -6.059 -14.200
419 3HZ LYS 60 3HZ LYS 60 3.476 -6.927 -12.820
420 H ALA 61 H ALA 61 3.498 -10.341 -8.769
421 HA ALA 61 HA ALA 61 2.252 -11.818 -9.889
422 1HB ALA 61 1HB ALA 61 4.330 -12.217 -12.033
423 2HB ALA 61 3HB ALA 61 2.555 -12.220 -12.160
424 3HB ALA 61 2HB ALA 61 3.431 -10.683 -11.965
425 H ASP 62 H ASP 62 3.779 -12.522 -7.709
426 HA ASP 62 HA ASP 62 5.041 -15.012 -8.520
427 1HB ASP 62 1HB ASP 62 6.282 -13.310 -7.062
428 2HB ASP 62 2HB ASP 62 5.111 -13.631 -5.798
429 H LYS 63 H LYS 63 4.742 -16.750 -6.538
430 HA LYS 63 HA LYS 63 1.908 -16.669 -5.766
431 1HB LYS 63 1HB LYS 63 2.957 -18.380 -7.625
432 2HB LYS 63 2HB LYS 63 3.140 -19.327 -6.162
433 1HG LYS 63 1HG LYS 63 0.664 -18.675 -5.647
434 2HG LYS 63 2HG LYS 63 0.581 -18.154 -7.318
435 1HD LYS 63 1HD LYS 63 1.737 -20.642 -7.618
436 2HD LYS 63 2HD LYS 63 0.748 -20.915 -6.198
437 1HE LYS 63 1HE LYS 63 -0.530 -19.459 -8.506
438 2HE LYS 63 2HE LYS 63 -0.232 -21.175 -8.705
439 1HZ LYS 63 1HZ LYS 63 -1.488 -20.250 -6.251
440 2HZ LYS 63 2HZ LYS 63 -2.391 -20.355 -7.608
441 3HZ LYS 63 3HZ LYS 63 -1.649 -21.684 -7.016
442 H SER 64 H SER 64 2.552 -15.672 -3.751
443 HA SER 64 HA SER 64 2.986 -17.543 -1.761
444 1HB SER 64 1HB SER 64 5.427 -16.175 -2.810
445 2HB SER 64 2HB SER 64 5.268 -16.204 -1.065
446 HG SER 64 HG SER 64 5.627 -18.330 -1.025
447 H VAL 65 H VAL 65 3.154 -16.421 0.450
448 HA VAL 65 HA VAL 65 1.645 -13.950 0.295
449 HB VAL 65 HB VAL 65 0.796 -15.689 1.706
450 1HG1 VAL 65 1HG1 VAL 65 3.618 -15.850 2.642
451 2HG1 VAL 65 2HG1 VAL 65 2.349 -16.120 3.861
452 3HG1 VAL 65 3HG1 VAL 65 2.411 -17.135 2.400
453 1HG2 VAL 65 1HG2 VAL 65 0.933 -13.153 2.451
454 2HG2 VAL 65 2HG2 VAL 65 0.279 -14.399 3.540
455 3HG2 VAL 65 3HG2 VAL 65 1.951 -13.823 3.747
456 H ASN 66 H ASN 66 4.332 -13.750 -0.652
457 HA ASN 66 HA ASN 66 5.378 -12.036 1.453
458 1HB ASN 66 2HB ASN 66 7.063 -13.770 -0.430
459 2HB ASN 66 1HB ASN 66 7.691 -12.703 0.810
460 2HD2 ASN 66 2HD2 ASN 66 6.666 -13.076 3.041
461 1HD2 ASN 66 1HD2 ASN 66 6.573 -14.717 3.585
462 H SER 67 H SER 67 3.841 -12.067 -1.383
463 HA SER 67 HA SER 67 5.644 -10.640 -3.042
464 1HB SER 67 1HB SER 67 3.262 -10.200 -4.233
465 2HB SER 67 2HB SER 67 4.130 -11.713 -4.395
466 HG SER 67 HG SER 67 1.908 -12.072 -3.809
467 H TRP 68 H TRP 68 5.815 -8.399 -3.334
468 HA TRP 68 HA TRP 68 4.429 -6.793 -1.346
469 1HB TRP 68 1HB TRP 68 6.706 -6.356 -1.330
470 2HB TRP 68 2HB TRP 68 6.849 -6.426 -3.075
471 HD1 TRP 68 HD1 TRP 68 6.961 -4.085 -4.236
472 HE1 TRP 68 HE1 TRP 68 6.409 -1.569 -3.662
473 HE3 TRP 68 HE3 TRP 68 4.843 -5.033 0.289
474 HZ2 TRP 68 HZ2 TRP 68 5.175 -0.287 -1.431
475 HZ3 TRP 68 HZ3 TRP 68 3.990 -3.093 1.601
476 HH2 TRP 68 HH2 TRP 68 4.130 -0.785 0.809
477 H TYR 69 H TYR 69 3.440 -8.094 -4.008
478 HA TYR 69 HA TYR 69 2.259 -5.604 -5.148
479 1HB TYR 69 1HB TYR 69 3.747 -6.631 -6.749
480 2HB TYR 69 2HB TYR 69 3.025 -8.224 -6.470
481 HD1 TYR 69 HD1 TYR 69 0.539 -8.531 -7.071
482 HD2 TYR 69 HD2 TYR 69 2.916 -5.221 -8.428
483 HE1 TYR 69 HE1 TYR 69 -1.082 -8.118 -8.902
484 HE2 TYR 69 HE2 TYR 69 1.295 -4.807 -10.259
485 HH TYR 69 HH TYR 69 -1.785 -6.467 -10.479
486 H LYS 70 H LYS 70 1.677 -8.473 -3.341
487 HA LYS 70 HA LYS 70 -1.072 -8.618 -4.328
488 1HB LYS 70 1HB LYS 70 0.435 -10.678 -4.139
489 2HB LYS 70 2HB LYS 70 0.281 -10.515 -2.401
490 1HG LYS 70 1HG LYS 70 -2.368 -10.269 -3.322
491 2HG LYS 70 2HG LYS 70 -1.683 -11.500 -4.365
492 1HD LYS 70 2HD LYS 70 -1.738 -11.517 -1.314
493 2HD LYS 70 1HD LYS 70 -2.626 -12.583 -2.385
494 1HE LYS 70 1HE LYS 70 -0.698 -13.802 -3.002
495 2HE LYS 70 2HE LYS 70 0.390 -12.486 -2.608
496 1HZ LYS 70 1HZ LYS 70 -1.189 -13.828 -0.540
497 2HZ LYS 70 2HZ LYS 70 0.270 -14.394 -1.007
498 3HZ LYS 70 3HZ LYS 70 0.143 -12.903 -0.351
499 H VAL 71 H VAL 71 0.922 -8.135 -1.357
500 HA VAL 71 HA VAL 71 -1.273 -7.780 0.356
501 HB VAL 71 HB VAL 71 0.414 -6.775 1.854
502 1HG1 VAL 71 1HG1 VAL 71 0.126 -9.366 1.167
503 2HG1 VAL 71 2HG1 VAL 71 1.839 -9.136 0.739
504 3HG1 VAL 71 3HG1 VAL 71 1.283 -8.804 2.397
505 1HG2 VAL 71 1HG2 VAL 71 1.696 -5.925 -0.381
506 2HG2 VAL 71 2HG2 VAL 71 2.472 -6.079 1.214
507 3HG2 VAL 71 3HG2 VAL 71 2.655 -7.374 0.006
508 H VAL 72 H VAL 72 -0.249 -5.954 -2.303
509 HA VAL 72 HA VAL 72 -1.210 -3.457 -1.111
510 HB VAL 72 HB VAL 72 0.394 -4.068 -3.598
511 1HG1 VAL 72 1HG1 VAL 72 -0.634 -1.392 -2.592
512 2HG1 VAL 72 2HG1 VAL 72 0.542 -1.616 -3.910
513 3HG1 VAL 72 3HG1 VAL 72 -1.121 -2.225 -4.088
514 1HG2 VAL 72 1HG2 VAL 72 1.326 -3.976 -1.088
515 2HG2 VAL 72 2HG2 VAL 72 2.255 -3.364 -2.478
516 3HG2 VAL 72 3HG2 VAL 72 1.347 -2.232 -1.447
517 H HIS 73 H HIS 73 -1.539 -5.559 -4.053
518 HA HIS 73 HA HIS 73 -4.072 -4.234 -4.587
519 1HB HIS 73 1HB HIS 73 -2.563 -6.247 -6.275
520 2HB HIS 73 2HB HIS 73 -3.959 -5.307 -6.765
521 HD1 HIS 73 HD1 HIS 73 -0.256 -4.991 -6.089
522 HD2 HIS 73 HD2 HIS 73 -3.429 -2.640 -7.502
523 HE1 HIS 73 HE1 HIS 73 0.797 -2.885 -7.072
524 H ASP 74 H ASP 74 -3.591 -6.099 -2.270
525 HA ASP 74 HA ASP 74 -4.848 -8.526 -2.999
526 1HB ASP 74 1HB ASP 74 -3.579 -7.338 -0.651
527 2HB ASP 74 2HB ASP 74 -5.086 -8.103 -0.186
528 H ALA 75 H ALA 75 -7.046 -8.518 -3.520
529 HA ALA 75 HA ALA 75 -8.755 -6.501 -2.328
530 1HB ALA 75 1HB ALA 75 -8.613 -7.929 -4.800
531 2HB ALA 75 3HB ALA 75 -10.150 -8.365 -4.014
532 3HB ALA 75 2HB ALA 75 -9.764 -6.656 -4.327
533 H LYS 76 H LYS 76 -7.575 -9.553 -1.501
534 HA LYS 76 HA LYS 76 -10.061 -10.528 -0.391
535 1HB LYS 76 1HB LYS 76 -8.180 -11.923 -1.498
536 2HB LYS 76 2HB LYS 76 -7.326 -11.733 0.020
537 1HG LYS 76 1HG LYS 76 -9.551 -12.552 1.141
538 2HG LYS 76 2HG LYS 76 -10.005 -13.086 -0.465
539 1HD LYS 76 1HD LYS 76 -7.986 -14.504 -0.611
540 2HD LYS 76 2HD LYS 76 -7.412 -13.900 0.931
541 1HE LYS 76 1HE LYS 76 -8.600 -15.504 2.006
542 2HE LYS 76 2HE LYS 76 -10.089 -14.838 1.366
543 1HZ LYS 76 1HZ LYS 76 -9.720 -16.145 -0.634
544 2HZ LYS 76 2HZ LYS 76 -8.369 -16.797 0.010
545 3HZ LYS 76 3HZ LYS 76 -9.823 -17.097 0.689
546 H GLY 77 H GLY 77 -10.346 -10.951 1.915
547 1HA GLY 77 2HA GLY 77 -10.445 -9.227 3.714
548 2HA GLY 77 1HA GLY 77 -8.697 -9.166 3.603
549 H GLY 78 H GLY 78 -9.025 -9.741 6.011
550 1HA GLY 78 2HA GLY 78 -8.523 -12.567 6.311
551 2HA GLY 78 1HA GLY 78 -10.029 -12.035 7.031
552 H ALA 79 H ALA 79 -6.470 -11.530 7.006
553 HA ALA 79 HA ALA 79 -6.497 -11.099 9.826
554 1HB ALA 79 1HB ALA 79 -4.095 -11.083 9.594
555 2HB ALA 79 3HB ALA 79 -4.212 -10.770 7.845
556 3HB ALA 79 2HB ALA 79 -4.732 -12.339 8.506
557 H LYS 80 H LYS 80 -5.822 -9.094 6.885
558 HA LYS 80 HA LYS 80 -6.751 -6.772 8.278
559 1HB LYS 80 1HB LYS 80 -4.455 -5.612 7.624
560 2HB LYS 80 2HB LYS 80 -4.706 -6.364 9.186
561 1HG LYS 80 1HG LYS 80 -3.687 -8.491 8.303
562 2HG LYS 80 2HG LYS 80 -3.395 -7.697 6.769
563 1HD LYS 80 2HD LYS 80 -2.219 -6.886 9.468
564 2HD LYS 80 1HD LYS 80 -1.352 -7.649 8.151
565 1HE LYS 80 1HE LYS 80 -1.869 -5.652 6.694
566 2HE LYS 80 2HE LYS 80 -2.655 -4.886 8.060
567 1HZ LYS 80 1HZ LYS 80 0.025 -5.862 8.499
568 2HZ LYS 80 2HZ LYS 80 -0.123 -4.557 7.529
569 3HZ LYS 80 3HZ LYS 80 -0.695 -4.507 9.057
570 HA PRO 81 HA PRO 81 -7.751 -5.644 4.173
571 1HB PRO 81 1HB PRO 81 -7.855 -2.910 4.378
572 2HB PRO 81 2HB PRO 81 -9.014 -3.989 5.221
573 1HG PRO 81 1HG PRO 81 -6.695 -2.671 6.131
574 2HG PRO 81 2HG PRO 81 -8.205 -2.788 7.093
575 1HD PRO 81 1HD PRO 81 -5.992 -4.349 7.597
576 2HD PRO 81 2HD PRO 81 -7.655 -4.972 7.820
577 H THR 82 H THR 82 -6.986 -3.615 2.501
578 HA THR 82 HA THR 82 -4.063 -3.490 2.638
579 HB THR 82 HB THR 82 -4.051 -4.169 0.178
580 HG1 THR 82 HG1 THR 82 -6.206 -5.380 -0.249
581 1HG2 THR 82 1HG2 THR 82 -4.516 -5.902 2.478
582 2HG2 THR 82 2HG2 THR 82 -5.341 -6.569 1.049
583 3HG2 THR 82 3HG2 THR 82 -3.591 -6.251 0.998
584 H CYS 83 H CYS 83 -3.658 -2.261 0.143
585 HA CYS 83 HA CYS 83 -4.540 0.358 0.838
586 1HB CYS 83 1HB CYS 83 -3.106 -0.403 -1.699
587 2HB CYS 83 2HB CYS 83 -3.105 1.137 -0.864
588 H ILE 84 H ILE 84 -6.034 -2.250 -0.627
589 HA ILE 84 HA ILE 84 -7.564 -0.511 -2.436
590 HB ILE 84 HB ILE 84 -6.635 -3.334 -2.640
591 1HG1 ILE 84 1HG1 ILE 84 -5.592 -1.330 -3.817
592 2HG1 ILE 84 2HG1 ILE 84 -5.986 -2.721 -4.807
593 1HG2 ILE 84 1HG2 ILE 84 -9.343 -2.366 -3.413
594 2HG2 ILE 84 2HG2 ILE 84 -8.471 -3.397 -4.573
595 3HG2 ILE 84 3HG2 ILE 84 -8.793 -3.987 -2.924
596 1HD1 ILE 84 1HD1 ILE 84 -8.036 -0.520 -4.477
597 2HD1 ILE 84 2HD1 ILE 84 -6.685 -0.308 -5.616
598 3HD1 ILE 84 3HD1 ILE 84 -7.822 -1.661 -5.826
599 H SER 85 H SER 85 -7.686 -3.171 -0.001
600 HA SER 85 HA SER 85 -10.378 -3.500 0.084
601 1HB SER 85 1HB SER 85 -8.287 -4.547 1.444
602 2HB SER 85 2HB SER 85 -8.894 -3.481 2.696
603 HG SER 85 HG SER 85 -10.246 -5.667 1.392
604 H CYS 86 H CYS 86 -8.408 -1.371 2.295
605 HA CYS 86 HA CYS 86 -10.583 -0.161 3.494
606 1HB CYS 86 1HB CYS 86 -8.123 -0.130 4.208
607 2HB CYS 86 2HB CYS 86 -7.904 1.184 3.069
608 H HIS 87 H HIS 87 -8.425 1.033 0.809
609 HA HIS 87 HA HIS 87 -9.696 3.353 0.247
610 1HB HIS 87 1HB HIS 87 -8.196 1.367 -1.429
611 2HB HIS 87 2HB HIS 87 -8.963 2.735 -2.211
612 HD1 HIS 87 HD1 HIS 87 -6.758 3.911 -2.831
613 HD2 HIS 87 HD2 HIS 87 -7.182 3.194 1.280
614 HE1 HIS 87 HE1 HIS 87 -4.900 5.229 -1.680
615 H LYS 88 H LYS 88 -10.653 0.018 -0.675
616 HA LYS 88 HA LYS 88 -12.662 0.733 -2.472
617 1HB LYS 88 1HB LYS 88 -11.826 -1.681 -0.980
618 2HB LYS 88 2HB LYS 88 -13.518 -1.642 -1.433
619 1HG LYS 88 1HG LYS 88 -11.267 -1.053 -3.407
620 2HG LYS 88 2HG LYS 88 -11.916 -2.662 -3.163
621 1HD LYS 88 1HD LYS 88 -14.223 -1.117 -3.512
622 2HD LYS 88 2HD LYS 88 -13.087 -0.363 -4.613
623 1HE LYS 88 1HE LYS 88 -12.913 -2.253 -5.964
624 2HE LYS 88 2HE LYS 88 -13.168 -3.366 -4.635
625 1HZ LYS 88 1HZ LYS 88 -15.436 -1.737 -5.107
626 2HZ LYS 88 2HZ LYS 88 -15.026 -2.596 -6.434
627 3HZ LYS 88 3HZ LYS 88 -15.328 -3.365 -5.025
628 H ASP 89 H ASP 89 -12.694 0.204 1.102
629 HA ASP 89 HA ASP 89 -15.394 0.438 1.446
630 1HB ASP 89 1HB ASP 89 -13.340 -0.025 3.102
631 2HB ASP 89 2HB ASP 89 -13.485 1.690 3.428
632 H LYS 90 H LYS 90 -12.770 2.911 1.236
633 HA LYS 90 HA LYS 90 -14.307 5.123 1.973
634 1HB LYS 90 1HB LYS 90 -11.705 4.659 0.582
635 2HB LYS 90 2HB LYS 90 -12.431 6.246 0.431
636 1HG LYS 90 1HG LYS 90 -12.062 4.856 3.121
637 2HG LYS 90 2HG LYS 90 -10.848 5.915 2.430
638 1HD LYS 90 1HD LYS 90 -12.299 7.829 2.521
639 2HD LYS 90 2HD LYS 90 -13.727 6.841 2.762
640 1HE LYS 90 1HE LYS 90 -11.433 7.135 4.762
641 2HE LYS 90 2HE LYS 90 -12.984 7.940 4.881
642 1HZ LYS 90 1HZ LYS 90 -13.460 5.239 4.518
643 2HZ LYS 90 2HZ LYS 90 -12.328 5.370 5.688
644 3HZ LYS 90 3HZ LYS 90 -13.759 6.140 5.847
645 H ALA 91 H ALA 91 -13.875 3.377 -1.118
646 HA ALA 91 HA ALA 91 -15.591 5.349 -2.427
647 1HB ALA 91 1HB ALA 91 -14.420 3.016 -3.886
648 2HB ALA 91 3HB ALA 91 -14.588 4.714 -4.392
649 3HB ALA 91 2HB ALA 91 -13.285 4.244 -3.276
650 H GLY 92 H GLY 92 -16.416 3.299 -0.305
651 1HA GLY 92 2HA GLY 92 -17.877 1.547 -0.067
652 2HA GLY 92 1HA GLY 92 -18.021 1.402 -1.808
653 H ASP 93 H ASP 93 -18.897 3.763 -2.774
654 HA ASP 93 HA ASP 93 -21.529 3.783 -2.305
655 1HB ASP 93 1HB ASP 93 -21.748 6.002 -0.969
656 2HB ASP 93 2HB ASP 93 -21.420 4.537 -0.066
657 H ASP 94 H ASP 94 -18.870 6.286 -2.293
658 HA ASP 94 HA ASP 94 -20.188 7.812 -4.277
659 1HB ASP 94 1HB ASP 94 -18.714 8.837 -2.564
660 2HB ASP 94 2HB ASP 94 -17.345 7.922 -3.165
661 H LYS 95 H LYS 95 -20.029 7.453 -6.500
662 HA LYS 95 HA LYS 95 -18.365 5.357 -7.460
663 1HB LYS 95 1HB LYS 95 -20.235 7.334 -8.780
664 2HB LYS 95 2HB LYS 95 -19.298 6.174 -9.700
665 1HG LYS 95 1HG LYS 95 -20.607 4.410 -9.051
666 2HG LYS 95 2HG LYS 95 -20.683 4.951 -7.387
667 1HD LYS 95 1HD LYS 95 -22.198 6.892 -8.670
668 2HD LYS 95 2HD LYS 95 -22.561 5.473 -9.632
669 1HE LYS 95 1HE LYS 95 -22.591 4.839 -6.762
670 2HE LYS 95 2HE LYS 95 -23.691 6.153 -7.129
671 1HZ LYS 95 1HZ LYS 95 -24.581 4.744 -8.922
672 2HZ LYS 95 2HZ LYS 95 -23.647 3.508 -8.402
673 3HZ LYS 95 3HZ LYS 95 -24.813 4.115 -7.433
674 H GLU 96 H GLU 96 -18.275 8.946 -7.462
675 HA GLU 96 HA GLU 96 -16.131 9.127 -9.236
676 1HB GLU 96 1HB GLU 96 -17.079 11.052 -7.068
677 2HB GLU 96 2HB GLU 96 -15.918 11.462 -8.315
678 1HG GLU 96 1HG GLU 96 -17.523 11.333 -10.050
679 2HG GLU 96 2HG GLU 96 -18.592 10.296 -9.126
680 H LEU 97 H LEU 97 -16.390 8.420 -5.782
681 HA LEU 97 HA LEU 97 -13.677 9.052 -5.184
682 1HB LEU 97 1HB LEU 97 -15.733 8.976 -3.638
683 2HB LEU 97 2HB LEU 97 -15.480 7.243 -3.597
684 HG LEU 97 HG LEU 97 -14.466 8.186 -1.657
685 1HD1 LEU 97 1HD1 LEU 97 -13.221 6.418 -3.126
686 2HD1 LEU 97 2HD1 LEU 97 -12.054 7.737 -3.382
687 3HD1 LEU 97 3HD1 LEU 97 -12.402 7.165 -1.733
688 1HD2 LEU 97 1HD2 LEU 97 -13.000 10.068 -3.525
689 2HD2 LEU 97 2HD2 LEU 97 -14.251 10.490 -2.330
690 3HD2 LEU 97 3HD2 LEU 97 -12.666 9.890 -1.785
691 H LYS 98 H LYS 98 -15.358 6.414 -6.724
692 HA LYS 98 HA LYS 98 -13.264 4.515 -6.122
693 1HB LYS 98 1HB LYS 98 -15.662 3.859 -6.211
694 2HB LYS 98 2HB LYS 98 -15.696 4.260 -7.916
695 1HG LYS 98 1HG LYS 98 -14.793 2.252 -8.457
696 2HG LYS 98 2HG LYS 98 -13.405 2.556 -7.431
697 1HD LYS 98 1HD LYS 98 -14.468 0.544 -6.606
698 2HD LYS 98 2HD LYS 98 -14.784 1.808 -5.434
699 1HE LYS 98 1HE LYS 98 -16.993 2.192 -6.878
700 2HE LYS 98 2HE LYS 98 -16.687 0.557 -7.429
701 1HZ LYS 98 1HZ LYS 98 -16.436 0.857 -4.609
702 2HZ LYS 98 2HZ LYS 98 -17.935 1.209 -5.154
703 3HZ LYS 98 3HZ LYS 98 -17.274 -0.252 -5.467
704 H LYS 99 H LYS 99 -12.751 7.132 -7.588
705 HA LYS 99 HA LYS 99 -11.373 5.881 -9.834
706 1HB LYS 99 1HB LYS 99 -13.434 8.041 -9.999
707 2HB LYS 99 2HB LYS 99 -12.035 8.162 -11.047
708 1HG LYS 99 1HG LYS 99 -12.528 6.142 -12.175
709 2HG LYS 99 2HG LYS 99 -13.488 5.514 -10.850
710 1HD LYS 99 1HD LYS 99 -15.389 6.715 -11.460
711 2HD LYS 99 2HD LYS 99 -14.470 8.045 -12.138
712 1HE LYS 99 1HE LYS 99 -13.931 5.619 -13.661
713 2HE LYS 99 2HE LYS 99 -15.663 5.859 -13.541
714 1HZ LYS 99 1HZ LYS 99 -14.123 8.215 -14.130
715 2HZ LYS 99 2HZ LYS 99 -14.149 7.083 -15.307
716 3HZ LYS 99 3HZ LYS 99 -15.548 7.718 -14.753
717 H LYS 100 H LYS 100 -10.188 6.331 -7.406
718 HA LYS 100 HA LYS 100 -8.159 8.158 -8.123
719 1HB LYS 100 1HB LYS 100 -8.613 9.515 -5.879
720 2HB LYS 100 2HB LYS 100 -9.258 10.019 -7.428
721 1HG LYS 100 1HG LYS 100 -11.338 8.555 -6.835
722 2HG LYS 100 2HG LYS 100 -10.702 8.528 -5.203
723 1HD LYS 100 1HD LYS 100 -11.085 11.152 -6.695
724 2HD LYS 100 2HD LYS 100 -12.411 10.403 -5.829
725 1HE LYS 100 1HE LYS 100 -11.043 10.407 -3.730
726 2HE LYS 100 2HE LYS 100 -9.718 11.159 -4.597
727 1HZ LYS 100 1HZ LYS 100 -11.863 12.720 -5.147
728 2HZ LYS 100 2HZ LYS 100 -12.064 12.345 -3.570
729 3HZ LYS 100 3HZ LYS 100 -10.681 13.056 -4.071
730 H LEU 101 H LEU 101 -9.863 6.311 -5.542
731 HA LEU 101 HA LEU 101 -7.298 5.735 -4.302
732 1HB LEU 101 2HB LEU 101 -10.091 4.943 -3.469
733 2HB LEU 101 1HB LEU 101 -8.625 4.736 -2.532
734 HG LEU 101 HG LEU 101 -10.139 7.257 -3.151
735 1HD1 LEU 101 1HD1 LEU 101 -10.557 5.863 -1.087
736 2HD1 LEU 101 2HD1 LEU 101 -8.919 6.310 -0.552
737 3HD1 LEU 101 3HD1 LEU 101 -10.149 7.572 -0.801
738 1HD2 LEU 101 1HD2 LEU 101 -7.227 7.112 -2.330
739 2HD2 LEU 101 2HD2 LEU 101 -7.897 7.825 -3.816
740 3HD2 LEU 101 3HD2 LEU 101 -8.240 8.572 -2.238
741 H THR 102 H THR 102 -9.861 4.257 -6.289
742 HA THR 102 HA THR 102 -8.139 1.883 -6.521
743 HB THR 102 HB THR 102 -10.090 0.466 -6.363
744 HG1 THR 102 HG1 THR 102 -11.628 1.667 -7.536
745 1HG2 THR 102 1HG2 THR 102 -9.382 1.836 -4.160
746 2HG2 THR 102 2HG2 THR 102 -10.967 2.606 -4.413
747 3HG2 THR 102 3HG2 THR 102 -10.861 0.845 -4.174
748 H GLY 103 H GLY 103 -8.972 4.589 -8.040
749 1HA GLY 103 2HA GLY 103 -8.670 5.062 -10.256
750 2HA GLY 103 1HA GLY 103 -10.243 4.294 -10.333
751 H CYS 104 H CYS 104 -6.798 3.165 -9.958
752 HA CYS 104 HA CYS 104 -5.942 1.217 -10.709
753 1HB CYS 104 1HB CYS 104 -8.456 0.522 -11.141
754 2HB CYS 104 2HB CYS 104 -8.028 0.820 -12.814
755 H LYS 105 H LYS 105 -7.538 3.567 -12.921
756 HA LYS 105 HA LYS 105 -5.005 3.732 -14.384
757 1HB LYS 105 1HB LYS 105 -6.367 2.434 -15.829
758 2HB LYS 105 2HB LYS 105 -7.781 3.426 -15.535
759 1HG LYS 105 1HG LYS 105 -6.202 5.378 -16.483
760 2HG LYS 105 2HG LYS 105 -5.352 4.036 -17.223
761 1HD LYS 105 1HD LYS 105 -8.334 3.985 -17.493
762 2HD LYS 105 2HD LYS 105 -7.517 5.273 -18.357
763 1HE LYS 105 1HE LYS 105 -7.595 3.441 -19.898
764 2HE LYS 105 2HE LYS 105 -5.942 3.476 -19.318
765 1HZ LYS 105 1HZ LYS 105 -6.640 1.802 -17.657
766 2HZ LYS 105 2HZ LYS 105 -8.083 1.685 -18.413
767 3HZ LYS 105 3HZ LYS 105 -6.713 1.273 -19.200
768 H GLY 106 H GLY 106 -4.216 5.670 -13.719
769 1HA GLY 106 2HA GLY 106 -5.699 8.044 -14.367
770 2HA GLY 106 1HA GLY 106 -4.087 7.935 -13.687
771 H SER 107 H SER 107 -4.576 6.373 -11.351
772 HA SER 107 HA SER 107 -6.568 7.949 -9.943
773 1HB SER 107 2HB SER 107 -6.644 6.196 -8.312
774 2HB SER 107 1HB SER 107 -6.622 5.400 -9.873
775 HG SER 107 HG SER 107 -4.951 4.321 -9.080
776 H ALA 108 H ALA 108 -5.641 7.794 -7.312
777 HA ALA 108 HA ALA 108 -3.507 9.707 -7.400
778 1HB ALA 108 1HB ALA 108 -4.286 10.285 -5.346
779 2HB ALA 108 3HB ALA 108 -5.682 9.269 -5.780
780 3HB ALA 108 2HB ALA 108 -4.364 8.595 -4.792
781 H CYS 109 H CYS 109 -3.539 6.416 -7.768
782 HA CYS 109 HA CYS 109 -1.110 6.067 -6.173
783 1HB CYS 109 1HB CYS 109 -3.135 4.062 -7.199
784 2HB CYS 109 2HB CYS 109 -1.560 3.586 -6.595
785 H HIS 110 H HIS 110 -2.693 5.417 -9.375
786 HA HIS 110 HA HIS 110 0.002 5.358 -10.527
787 1HB HIS 110 1HB HIS 110 -2.477 3.861 -11.420
788 2HB HIS 110 2HB HIS 110 -0.965 3.906 -12.303
789 HD1 HIS 110 HD1 HIS 110 1.162 3.296 -10.302
790 HD2 HIS 110 HD2 HIS 110 -2.606 1.458 -10.153
791 HE1 HIS 110 HE1 HIS 110 1.472 1.138 -8.977
792 HA PRO 111 HA PRO 111 -2.057 8.919 -12.438
793 1HB PRO 111 1HB PRO 111 -0.329 10.852 -11.712
794 2HB PRO 111 2HB PRO 111 -1.432 10.122 -10.500
795 1HG PRO 111 2HG PRO 111 1.681 9.400 -10.563
796 2HG PRO 111 1HG PRO 111 0.248 9.689 -9.523
797 1HD PRO 111 1HD PRO 111 1.204 7.184 -10.844
798 2HD PRO 111 2HD PRO 111 0.020 7.378 -9.516
799 H SER 112 H SER 112 -1.181 7.300 -14.283
800 HA SER 112 HA SER 112 0.304 8.892 -15.997
801 1HB SER 112 1HB SER 112 1.946 7.423 -14.211
802 2HB SER 112 2HB SER 112 2.018 6.541 -15.723
803 HG SER 112 HG SER 112 2.414 8.778 -16.714
No H/Q in entry = 803
Start of MODEL 18
1 H1 VAL 1 H1 VAL 1 9.616 9.305 17.556
2 H2 VAL 1 H2 VAL 1 8.529 8.237 16.907
3 H3 VAL 1 H3 VAL 1 9.812 7.678 17.792
4 HA VAL 1 HA VAL 1 11.346 8.472 16.209
5 HB VAL 1 HB VAL 1 10.691 6.211 15.988
6 1HG1 VAL 1 1HG1 VAL 1 8.267 6.478 16.174
7 2HG1 VAL 1 2HG1 VAL 1 8.203 7.184 14.541
8 3HG1 VAL 1 3HG1 VAL 1 8.681 5.483 14.758
9 1HG2 VAL 1 1HG2 VAL 1 11.895 7.293 14.049
10 2HG2 VAL 1 2HG2 VAL 1 11.002 5.805 13.652
11 3HG2 VAL 1 3HG2 VAL 1 10.323 7.393 13.220
12 H ASP 2 H ASP 2 8.292 9.920 16.176
13 HA ASP 2 HA ASP 2 7.397 11.536 15.043
14 1HB ASP 2 1HB ASP 2 10.282 11.931 14.696
15 2HB ASP 2 2HB ASP 2 9.406 12.551 13.311
16 H VAL 3 H VAL 3 5.940 10.883 13.449
17 HA VAL 3 HA VAL 3 6.512 9.069 11.449
18 HB VAL 3 HB VAL 3 4.297 10.096 12.471
19 1HG1 VAL 3 1HG1 VAL 3 4.725 12.331 11.402
20 2HG1 VAL 3 2HG1 VAL 3 4.465 11.560 9.819
21 3HG1 VAL 3 3HG1 VAL 3 3.144 11.613 11.011
22 1HG2 VAL 3 1HG2 VAL 3 4.480 8.068 11.071
23 2HG2 VAL 3 2HG2 VAL 3 3.039 9.033 10.670
24 3HG2 VAL 3 3HG2 VAL 3 4.469 9.087 9.611
25 HA PRO 4 HA PRO 4 9.306 11.144 8.760
26 1HB PRO 4 1HB PRO 4 7.763 9.439 6.776
27 2HB PRO 4 2HB PRO 4 9.529 9.659 7.001
28 1HG PRO 4 1HG PRO 4 8.404 7.469 8.033
29 2HG PRO 4 2HG PRO 4 9.762 8.297 8.863
30 1HD PRO 4 2HD PRO 4 6.811 8.238 9.505
31 2HD PRO 4 1HD PRO 4 8.205 8.481 10.600
32 H ALA 5 H ALA 5 9.135 12.570 6.749
33 HA ALA 5 HA ALA 5 6.644 14.034 6.902
34 1HB ALA 5 1HB ALA 5 7.902 15.804 6.233
35 2HB ALA 5 2HB ALA 5 8.736 14.863 4.975
36 3HB ALA 5 3HB ALA 5 9.280 14.765 6.667
37 H ASP 6 H ASP 6 5.355 14.556 5.002
38 HA ASP 6 HA ASP 6 4.732 12.368 3.506
39 1HB ASP 6 1HB ASP 6 3.205 13.769 2.394
40 2HB ASP 6 2HB ASP 6 3.472 14.631 3.896
41 H GLY 7 H GLY 7 4.575 13.274 0.771
42 1HA GLY 7 2HA GLY 7 7.059 14.222 -0.218
43 2HA GLY 7 1HA GLY 7 5.755 13.495 -1.135
44 H ALA 8 H ALA 8 5.754 11.013 0.627
45 HA ALA 8 HA ALA 8 8.372 9.885 0.135
46 1HB ALA 8 1HB ALA 8 5.887 9.152 1.643
47 2HB ALA 8 2HB ALA 8 7.590 9.109 2.159
48 3HB ALA 8 3HB ALA 8 6.948 7.829 1.101
49 H LYS 9 H LYS 9 8.888 8.425 -1.479
50 HA LYS 9 HA LYS 9 6.694 7.796 -3.330
51 1HB LYS 9 1HB LYS 9 9.592 8.462 -3.914
52 2HB LYS 9 2HB LYS 9 8.496 7.776 -5.096
53 1HG LYS 9 1HG LYS 9 7.126 9.705 -5.153
54 2HG LYS 9 2HG LYS 9 7.648 10.250 -3.571
55 1HD LYS 9 1HD LYS 9 9.829 10.039 -5.596
56 2HD LYS 9 2HD LYS 9 8.609 11.244 -5.959
57 1HE LYS 9 1HE LYS 9 10.048 11.046 -3.271
58 2HE LYS 9 2HE LYS 9 10.554 12.108 -4.569
59 1HZ LYS 9 1HZ LYS 9 7.809 12.196 -3.574
60 2HZ LYS 9 2HZ LYS 9 8.998 13.015 -2.810
61 3HZ LYS 9 3HZ LYS 9 8.643 13.354 -4.368
62 H ILE 10 H ILE 10 6.424 5.667 -3.943
63 HA ILE 10 HA ILE 10 8.301 3.789 -2.686
64 HB ILE 10 HB ILE 10 5.378 3.375 -3.321
65 1HG1 ILE 10 1HG1 ILE 10 6.409 3.576 -0.521
66 2HG1 ILE 10 2HG1 ILE 10 6.180 5.063 -1.420
67 1HG2 ILE 10 1HG2 ILE 10 7.094 1.406 -3.234
68 2HG2 ILE 10 2HG2 ILE 10 7.010 1.664 -1.475
69 3HG2 ILE 10 3HG2 ILE 10 5.533 1.273 -2.390
70 1HD1 ILE 10 1HD1 ILE 10 4.007 2.937 -1.297
71 2HD1 ILE 10 2HD1 ILE 10 4.162 4.200 -0.053
72 3HD1 ILE 10 3HD1 ILE 10 3.845 4.652 -1.745
73 H ASP 11 H ASP 11 9.483 2.520 -4.019
74 HA ASP 11 HA ASP 11 8.378 1.722 -6.515
75 1HB ASP 11 1HB ASP 11 9.243 3.811 -7.314
76 2HB ASP 11 2HB ASP 11 10.689 3.685 -6.332
77 H PHE 12 H PHE 12 8.764 -0.426 -5.673
78 HA PHE 12 HA PHE 12 11.594 -1.058 -5.212
79 1HB PHE 12 1HB PHE 12 8.988 -2.399 -4.269
80 2HB PHE 12 2HB PHE 12 10.594 -2.952 -3.840
81 HD1 PHE 12 HD1 PHE 12 11.932 -0.369 -3.239
82 HD2 PHE 12 HD2 PHE 12 8.053 -1.765 -2.232
83 HE1 PHE 12 HE1 PHE 12 11.913 1.135 -1.229
84 HE2 PHE 12 HE2 PHE 12 8.034 -0.262 -0.222
85 HZ PHE 12 HZ PHE 12 9.965 1.170 0.255
86 H ILE 13 H ILE 13 8.631 -1.749 -7.018
87 HA ILE 13 HA ILE 13 9.875 -4.112 -8.197
88 HB ILE 13 HB ILE 13 7.071 -3.003 -8.300
89 1HG1 ILE 13 1HG1 ILE 13 7.913 -5.671 -7.187
90 2HG1 ILE 13 2HG1 ILE 13 8.053 -4.222 -6.211
91 1HG2 ILE 13 1HG2 ILE 13 7.989 -4.162 -10.434
92 2HG2 ILE 13 2HG2 ILE 13 7.871 -5.654 -9.470
93 3HG2 ILE 13 3HG2 ILE 13 6.418 -4.671 -9.770
94 1HD1 ILE 13 1HD1 ILE 13 5.481 -5.089 -7.610
95 2HD1 ILE 13 2HD1 ILE 13 5.861 -5.422 -5.904
96 3HD1 ILE 13 3HD1 ILE 13 5.663 -3.743 -6.460
97 H ALA 14 H ALA 14 11.363 -3.526 -9.717
98 HA ALA 14 HA ALA 14 12.099 -2.797 -11.679
99 1HB ALA 14 1HB ALA 14 10.501 -3.015 -13.240
100 2HB ALA 14 3HB ALA 14 9.913 -1.384 -12.840
101 3HB ALA 14 2HB ALA 14 9.235 -2.803 -12.007
102 H GLY 15 H GLY 15 12.144 -0.518 -13.045
103 1HA GLY 15 2HA GLY 15 13.371 1.334 -11.427
104 2HA GLY 15 1HA GLY 15 11.690 1.826 -11.476
105 H GLY 16 H GLY 16 14.315 2.931 -12.706
106 1HA GLY 16 2HA GLY 16 13.769 2.739 -15.562
107 2HA GLY 16 1HA GLY 16 15.119 3.538 -14.780
108 H GLU 17 H GLU 17 12.659 4.251 -16.733
109 HA GLU 17 HA GLU 17 12.135 6.775 -15.367
110 1HB GLU 17 1HB GLU 17 13.531 7.053 -17.381
111 2HB GLU 17 2HB GLU 17 12.355 6.189 -18.352
112 1HG GLU 17 1HG GLU 17 10.679 8.052 -17.402
113 2HG GLU 17 2HG GLU 17 12.160 8.955 -17.152
114 H LYS 18 H LYS 18 10.822 3.993 -17.145
115 HA LYS 18 HA LYS 18 8.143 5.154 -16.952
116 1HB LYS 18 2HB LYS 18 7.482 3.445 -18.557
117 2HB LYS 18 1HB LYS 18 8.824 4.389 -19.172
118 1HG LYS 18 1HG LYS 18 10.223 2.584 -19.225
119 2HG LYS 18 2HG LYS 18 9.738 2.047 -17.629
120 1HD LYS 18 1HD LYS 18 7.522 1.664 -19.472
121 2HD LYS 18 2HD LYS 18 8.967 0.949 -20.159
122 1HE LYS 18 1HE LYS 18 8.387 0.428 -17.243
123 2HE LYS 18 2HE LYS 18 7.408 -0.405 -18.434
124 1HZ LYS 18 1HZ LYS 18 10.161 -0.476 -19.089
125 2HZ LYS 18 2HZ LYS 18 9.878 -1.132 -17.620
126 3HZ LYS 18 3HZ LYS 18 9.101 -1.709 -18.935
127 H ASN 19 H ASN 19 9.214 4.576 -14.488
128 HA ASN 19 HA ASN 19 8.170 1.937 -13.873
129 1HB ASN 19 1HB ASN 19 9.287 2.652 -11.535
130 2HB ASN 19 2HB ASN 19 10.270 2.022 -12.842
131 2HD2 ASN 19 2HD2 ASN 19 8.796 5.116 -11.857
132 1HD2 ASN 19 1HD2 ASN 19 10.181 6.118 -12.137
133 H LEU 20 H LEU 20 6.341 1.751 -12.493
134 HA LEU 20 HA LEU 20 4.819 4.125 -12.077
135 1HB LEU 20 1HB LEU 20 4.417 1.215 -11.408
136 2HB LEU 20 2HB LEU 20 3.279 2.455 -10.917
137 HG LEU 20 HG LEU 20 3.952 1.502 -13.693
138 1HD1 LEU 20 1HD1 LEU 20 2.082 0.569 -12.127
139 2HD1 LEU 20 2HD1 LEU 20 1.205 2.040 -12.612
140 3HD1 LEU 20 3HD1 LEU 20 1.738 0.874 -13.847
141 1HD2 LEU 20 1HD2 LEU 20 2.973 4.208 -12.884
142 2HD2 LEU 20 2HD2 LEU 20 4.035 3.724 -14.228
143 3HD2 LEU 20 3HD2 LEU 20 2.280 3.445 -14.335
144 H THR 21 H THR 21 5.520 5.571 -10.576
145 HA THR 21 HA THR 21 6.475 4.480 -8.020
146 HB THR 21 HB THR 21 6.741 7.361 -8.946
147 HG1 THR 21 HG1 THR 21 7.759 6.394 -10.677
148 1HG2 THR 21 1HG2 THR 21 7.625 6.118 -6.673
149 2HG2 THR 21 2HG2 THR 21 8.974 5.736 -7.769
150 3HG2 THR 21 3HG2 THR 21 8.529 7.432 -7.462
151 H VAL 22 H VAL 22 4.998 4.299 -6.463
152 HA VAL 22 HA VAL 22 2.703 6.089 -6.564
153 HB VAL 22 HB VAL 22 3.327 3.583 -4.995
154 1HG1 VAL 22 1HG1 VAL 22 1.157 5.604 -4.691
155 2HG1 VAL 22 2HG1 VAL 22 0.688 3.889 -4.605
156 3HG1 VAL 22 3HG1 VAL 22 1.910 4.535 -3.484
157 1HG2 VAL 22 1HG2 VAL 22 2.583 3.783 -7.602
158 2HG2 VAL 22 2HG2 VAL 22 2.164 2.414 -6.545
159 3HG2 VAL 22 3HG2 VAL 22 0.989 3.725 -6.811
160 H VAL 23 H VAL 23 2.427 7.782 -5.179
161 HA VAL 23 HA VAL 23 4.568 8.205 -3.247
162 HB VAL 23 HB VAL 23 2.406 10.039 -4.302
163 1HG1 VAL 23 1HG1 VAL 23 3.295 10.556 -1.990
164 2HG1 VAL 23 2HG1 VAL 23 4.891 10.796 -2.740
165 3HG1 VAL 23 3HG1 VAL 23 3.525 11.839 -3.203
166 1HG2 VAL 23 1HG2 VAL 23 5.148 9.358 -5.239
167 2HG2 VAL 23 2HG2 VAL 23 3.719 9.894 -6.155
168 3HG2 VAL 23 3HG2 VAL 23 4.699 11.080 -5.259
169 H PHE 24 H PHE 24 4.184 8.524 -1.020
170 HA PHE 24 HA PHE 24 1.436 7.995 -0.157
171 1HB PHE 24 1HB PHE 24 2.957 5.939 -0.078
172 2HB PHE 24 2HB PHE 24 4.071 6.835 0.935
173 HD1 PHE 24 HD1 PHE 24 0.469 5.848 0.857
174 HD2 PHE 24 HD2 PHE 24 3.919 6.568 3.221
175 HE1 PHE 24 HE1 PHE 24 -0.771 5.081 2.901
176 HE2 PHE 24 HE2 PHE 24 2.679 5.801 5.265
177 HZ PHE 24 HZ PHE 24 0.349 5.067 5.080
178 H ASN 25 H ASN 25 0.845 8.949 1.869
179 HA ASN 25 HA ASN 25 2.870 10.746 2.937
180 1HB ASN 25 2HB ASN 25 0.154 11.811 3.239
181 2HB ASN 25 1HB ASN 25 1.566 12.591 2.553
182 2HD2 ASN 25 2HD2 ASN 25 2.257 11.519 0.374
183 1HD2 ASN 25 1HD2 ASN 25 0.999 11.345 -0.804
184 H HIS 26 H HIS 26 3.074 10.428 5.165
185 HA HIS 26 HA HIS 26 1.301 8.613 6.448
186 1HB HIS 26 1HB HIS 26 3.835 10.026 7.100
187 2HB HIS 26 2HB HIS 26 2.833 9.562 8.460
188 HD1 HIS 26 HD1 HIS 26 4.784 8.069 5.575
189 HD2 HIS 26 HD2 HIS 26 2.769 6.823 9.036
190 HE1 HIS 26 HE1 HIS 26 5.384 5.611 5.905
191 H SER 27 H SER 27 1.344 12.024 5.873
192 HA SER 27 HA SER 27 -0.160 12.608 8.247
193 1HB SER 27 1HB SER 27 -0.242 14.945 7.153
194 2HB SER 27 2HB SER 27 1.331 14.350 7.645
195 HG SER 27 HG SER 27 0.512 15.104 5.166
196 H THR 28 H THR 28 -1.023 10.816 5.794
197 HA THR 28 HA THR 28 -3.541 12.240 5.237
198 HB THR 28 HB THR 28 -1.956 10.151 3.654
199 HG1 THR 28 HG1 THR 28 -1.623 12.023 2.352
200 1HG2 THR 28 1HG2 THR 28 -4.642 10.198 3.532
201 2HG2 THR 28 2HG2 THR 28 -4.341 11.672 2.581
202 3HG2 THR 28 3HG2 THR 28 -3.670 10.113 2.044
203 H HIS 29 H HIS 29 -2.018 9.215 6.367
204 HA HIS 29 HA HIS 29 -4.699 8.185 6.895
205 1HB HIS 29 2HB HIS 29 -2.028 6.752 6.938
206 2HB HIS 29 1HB HIS 29 -3.598 6.012 7.185
207 HD1 HIS 29 HD1 HIS 29 -1.517 7.679 4.474
208 HD2 HIS 29 HD2 HIS 29 -4.990 5.359 4.866
209 HE1 HIS 29 HE1 HIS 29 -2.198 7.005 2.109
210 H LYS 30 H LYS 30 -3.247 10.394 8.392
211 HA LYS 30 HA LYS 30 -2.219 9.446 10.782
212 1HB LYS 30 1HB LYS 30 -2.584 11.686 11.614
213 2HB LYS 30 2HB LYS 30 -2.006 11.759 9.962
214 1HG LYS 30 1HG LYS 30 -4.603 11.782 9.362
215 2HG LYS 30 2HG LYS 30 -4.786 12.314 11.021
216 1HD LYS 30 1HD LYS 30 -2.620 13.761 9.644
217 2HD LYS 30 2HD LYS 30 -4.151 13.935 8.808
218 1HE LYS 30 1HE LYS 30 -3.986 15.727 10.450
219 2HE LYS 30 2HE LYS 30 -5.228 14.616 10.990
220 1HZ LYS 30 1HZ LYS 30 -3.385 13.539 12.301
221 2HZ LYS 30 2HZ LYS 30 -2.496 14.876 12.000
222 3HZ LYS 30 3HZ LYS 30 -3.899 14.997 12.827
223 H ASP 31 H ASP 31 -5.445 9.318 9.509
224 HA ASP 31 HA ASP 31 -6.637 9.183 12.110
225 1HB ASP 31 1HB ASP 31 -8.054 10.168 10.482
226 2HB ASP 31 2HB ASP 31 -7.612 9.002 9.250
227 H VAL 32 H VAL 32 -4.701 7.155 10.337
228 HA VAL 32 HA VAL 32 -6.193 4.752 11.140
229 HB VAL 32 HB VAL 32 -4.164 5.077 8.920
230 1HG1 VAL 32 1HG1 VAL 32 -4.301 2.818 10.028
231 2HG1 VAL 32 2HG1 VAL 32 -5.996 2.729 9.492
232 3HG1 VAL 32 3HG1 VAL 32 -4.686 2.826 8.291
233 1HG2 VAL 32 1HG2 VAL 32 -6.929 5.778 8.981
234 2HG2 VAL 32 2HG2 VAL 32 -5.808 5.792 7.598
235 3HG2 VAL 32 3HG2 VAL 32 -6.753 4.328 7.963
236 H LYS 33 H LYS 33 -5.232 3.394 12.597
237 HA LYS 33 HA LYS 33 -3.103 4.266 14.110
238 1HB LYS 33 1HB LYS 33 -4.134 1.441 13.715
239 2HB LYS 33 2HB LYS 33 -3.085 1.962 15.018
240 1HG LYS 33 1HG LYS 33 -5.550 3.609 14.643
241 2HG LYS 33 2HG LYS 33 -5.832 1.958 15.159
242 1HD LYS 33 1HD LYS 33 -4.558 2.231 17.161
243 2HD LYS 33 2HD LYS 33 -3.740 3.658 16.557
244 1HE LYS 33 1HE LYS 33 -6.677 3.987 16.617
245 2HE LYS 33 2HE LYS 33 -6.012 3.638 18.200
246 1HZ LYS 33 1HZ LYS 33 -4.533 5.560 16.673
247 2HZ LYS 33 2HZ LYS 33 -6.033 6.043 17.103
248 3HZ LYS 33 3HZ LYS 33 -4.962 5.587 18.248
249 H CYS 34 H CYS 34 -0.916 3.260 14.372
250 HA CYS 34 HA CYS 34 0.374 3.255 11.846
251 1HB CYS 34 1HB CYS 34 1.617 2.496 14.486
252 2HB CYS 34 2HB CYS 34 2.411 3.126 13.057
253 H ASP 35 H ASP 35 -0.491 0.844 14.390
254 HA ASP 35 HA ASP 35 0.876 -1.276 13.223
255 1HB ASP 35 1HB ASP 35 -0.680 -2.689 14.637
256 2HB ASP 35 2HB ASP 35 0.155 -1.430 15.525
257 H ASP 36 H ASP 36 -1.824 0.525 12.174
258 HA ASP 36 HA ASP 36 -3.508 -1.459 11.227
259 1HB ASP 36 1HB ASP 36 -3.750 1.179 11.413
260 2HB ASP 36 2HB ASP 36 -3.102 1.178 9.785
261 H CYS 37 H CYS 37 -0.360 -0.337 10.235
262 HA CYS 37 HA CYS 37 -0.639 -1.841 7.741
263 1HB CYS 37 1HB CYS 37 0.767 0.821 8.112
264 2HB CYS 37 2HB CYS 37 1.013 -0.219 6.722
265 H HIS 38 H HIS 38 1.559 -0.393 10.241
266 HA HIS 38 HA HIS 38 3.666 -2.195 9.581
267 1HB HIS 38 1HB HIS 38 3.307 -0.311 11.928
268 2HB HIS 38 2HB HIS 38 4.781 -1.179 11.548
269 HD1 HIS 38 HD1 HIS 38 5.881 -0.557 9.108
270 HD2 HIS 38 HD2 HIS 38 3.049 2.118 10.664
271 HE1 HIS 38 HE1 HIS 38 6.192 1.633 7.837
272 H HIS 39 H HIS 39 2.441 -4.234 9.740
273 HA HIS 39 HA HIS 39 1.629 -4.953 12.424
274 1HB HIS 39 2HB HIS 39 0.480 -6.739 11.470
275 2HB HIS 39 1HB HIS 39 0.292 -5.444 10.303
276 HD1 HIS 39 HD1 HIS 39 1.181 -8.932 10.504
277 HD2 HIS 39 HD2 HIS 39 2.365 -5.703 8.103
278 HE1 HIS 39 HE1 HIS 39 2.259 -9.945 8.425
279 H GLN 40 H GLN 40 4.304 -4.410 12.466
280 HA GLN 40 HA GLN 40 5.534 -7.044 12.264
281 1HB GLN 40 1HB GLN 40 6.563 -4.247 11.909
282 2HB GLN 40 2HB GLN 40 7.669 -5.415 12.604
283 1HG GLN 40 1HG GLN 40 7.669 -5.193 10.025
284 2HG GLN 40 2HG GLN 40 7.608 -6.816 10.681
285 2HE2 GLN 40 2HE2 GLN 40 5.744 -8.029 10.569
286 1HE2 GLN 40 1HE2 GLN 40 4.404 -7.632 9.546
287 HA PRO 41 HA PRO 41 6.284 -7.228 16.594
288 1HB PRO 41 1HB PRO 41 9.181 -7.749 16.262
289 2HB PRO 41 2HB PRO 41 7.850 -8.865 16.712
290 1HG PRO 41 1HG PRO 41 9.231 -8.794 14.566
291 2HG PRO 41 2HG PRO 41 7.713 -9.653 14.148
292 1HD PRO 41 2HD PRO 41 8.590 -6.893 13.486
293 2HD PRO 41 1HD PRO 41 7.196 -7.812 12.842
294 H GLY 42 H GLY 42 6.968 -5.948 18.410
295 1HA GLY 42 2HA GLY 42 8.024 -4.261 19.495
296 2HA GLY 42 1HA GLY 42 7.434 -3.318 18.141
297 H ASP 43 H ASP 43 9.992 -5.891 18.295
298 HA ASP 43 HA ASP 43 12.204 -4.492 18.462
299 1HB ASP 43 1HB ASP 43 11.663 -7.033 17.746
300 2HB ASP 43 2HB ASP 43 12.075 -6.431 16.153
301 H LYS 44 H LYS 44 10.382 -5.092 15.361
302 HA LYS 44 HA LYS 44 11.726 -2.724 14.254
303 1HB LYS 44 2HB LYS 44 11.530 -3.796 12.044
304 2HB LYS 44 1HB LYS 44 12.541 -4.709 13.144
305 1HG LYS 44 1HG LYS 44 10.462 -6.117 13.710
306 2HG LYS 44 2HG LYS 44 9.649 -5.311 12.383
307 1HD LYS 44 2HD LYS 44 10.583 -6.780 10.934
308 2HD LYS 44 1HD LYS 44 12.171 -6.168 11.350
309 1HE LYS 44 1HE LYS 44 11.066 -7.999 13.402
310 2HE LYS 44 2HE LYS 44 11.251 -8.761 11.835
311 1HZ LYS 44 1HZ LYS 44 13.524 -7.298 12.211
312 2HZ LYS 44 2HZ LYS 44 13.242 -7.995 13.661
313 3HZ LYS 44 3HZ LYS 44 13.378 -8.921 12.323
314 H GLN 45 H GLN 45 9.602 -2.162 15.802
315 HA GLN 45 HA GLN 45 7.103 -2.465 15.032
316 1HB GLN 45 1HB GLN 45 7.747 -1.063 16.930
317 2HB GLN 45 2HB GLN 45 8.445 0.142 15.866
318 1HG GLN 45 1HG GLN 45 6.377 1.130 16.160
319 2HG GLN 45 2HG GLN 45 5.967 0.107 14.798
320 2HE2 GLN 45 2HE2 GLN 45 3.825 0.568 15.870
321 1HE2 GLN 45 1HE2 GLN 45 3.244 -0.580 17.030
322 H TYR 46 H TYR 46 9.544 -0.492 13.414
323 HA TYR 46 HA TYR 46 7.670 -0.136 11.128
324 1HB TYR 46 2HB TYR 46 9.714 1.903 12.053
325 2HB TYR 46 1HB TYR 46 8.491 2.095 10.786
326 HD1 TYR 46 HD1 TYR 46 6.035 2.095 11.450
327 HD2 TYR 46 HD2 TYR 46 9.229 2.419 14.305
328 HE1 TYR 46 HE1 TYR 46 4.449 3.014 13.120
329 HE2 TYR 46 HE2 TYR 46 7.643 3.338 15.975
330 HH TYR 46 HH TYR 46 5.338 4.598 15.913
331 H ALA 47 H ALA 47 8.653 -1.996 10.061
332 HA ALA 47 HA ALA 47 11.433 -1.454 9.267
333 1HB ALA 47 1HB ALA 47 10.226 -3.755 10.519
334 2HB ALA 47 3HB ALA 47 11.927 -3.495 10.061
335 3HB ALA 47 2HB ALA 47 10.788 -4.203 8.890
336 H GLY 48 H GLY 48 11.817 -2.940 7.107
337 1HA GLY 48 2HA GLY 48 11.482 -2.827 4.873
338 2HA GLY 48 1HA GLY 48 10.155 -1.712 5.131
339 H CYS 49 H CYS 49 8.699 -2.707 3.671
340 HA CYS 49 HA CYS 49 7.347 -4.972 4.771
341 1HB CYS 49 1HB CYS 49 6.783 -3.660 2.115
342 2HB CYS 49 2HB CYS 49 5.694 -4.603 3.112
343 H THR 50 H THR 50 9.668 -4.200 2.178
344 HA THR 50 HA THR 50 9.411 -6.861 1.026
345 HB THR 50 HB THR 50 11.133 -5.849 -0.581
346 HG1 THR 50 HG1 THR 50 12.070 -4.088 0.389
347 1HG2 THR 50 1HG2 THR 50 8.353 -5.084 -0.236
348 2HG2 THR 50 2HG2 THR 50 9.285 -3.652 -0.735
349 3HG2 THR 50 3HG2 THR 50 9.305 -5.121 -1.740
350 H THR 51 H THR 51 10.438 -6.238 3.868
351 HA THR 51 HA THR 51 13.212 -6.812 3.824
352 HB THR 51 HB THR 51 11.161 -7.246 6.055
353 HG1 THR 51 HG1 THR 51 11.720 -4.941 6.429
354 1HG2 THR 51 1HG2 THR 51 14.163 -6.862 5.891
355 2HG2 THR 51 2HG2 THR 51 13.283 -6.180 7.280
356 3HG2 THR 51 3HG2 THR 51 13.229 -7.931 6.965
357 H ASP 52 H ASP 52 14.284 -8.763 4.598
358 HA ASP 52 HA ASP 52 13.545 -10.941 3.138
359 1HB ASP 52 1HB ASP 52 15.672 -10.220 4.784
360 2HB ASP 52 2HB ASP 52 14.977 -11.565 5.667
361 H GLY 53 H GLY 53 12.719 -13.103 3.883
362 1HA GLY 53 2HA GLY 53 11.748 -13.655 6.427
363 2HA GLY 53 1HA GLY 53 11.230 -14.415 4.935
364 H CYS 54 H CYS 54 10.528 -11.469 3.982
365 HA CYS 54 HA CYS 54 7.907 -11.495 5.281
366 1HB CYS 54 2HB CYS 54 9.357 -8.945 4.521
367 2HB CYS 54 1HB CYS 54 7.849 -9.100 5.400
368 H HIS 55 H HIS 55 7.772 -8.890 3.347
369 HA HIS 55 HA HIS 55 6.806 -10.465 1.113
370 1HB HIS 55 2HB HIS 55 6.541 -7.481 1.509
371 2HB HIS 55 1HB HIS 55 5.592 -8.519 0.464
372 HD1 HIS 55 HD1 HIS 55 3.946 -10.271 1.736
373 HD2 HIS 55 HD2 HIS 55 5.548 -7.175 4.070
374 HE1 HIS 55 HE1 HIS 55 2.514 -10.151 3.844
375 H ASN 56 H ASN 56 9.534 -10.681 1.245
376 HA ASN 56 HA ASN 56 10.700 -8.592 -0.311
377 1HB ASN 56 1HB ASN 56 11.977 -9.845 1.468
378 2HB ASN 56 2HB ASN 56 11.814 -11.319 0.535
379 2HD2 ASN 56 2HD2 ASN 56 14.198 -9.893 1.382
380 1HD2 ASN 56 1HD2 ASN 56 15.113 -9.508 -0.038
381 H ILE 57 H ILE 57 8.889 -9.139 -2.050
382 HA ILE 57 HA ILE 57 10.055 -11.085 -3.902
383 HB ILE 57 HB ILE 57 7.109 -10.798 -3.298
384 1HG1 ILE 57 1HG1 ILE 57 8.688 -11.995 -1.600
385 2HG1 ILE 57 2HG1 ILE 57 7.173 -12.741 -2.068
386 1HG2 ILE 57 1HG2 ILE 57 8.627 -12.497 -5.287
387 2HG2 ILE 57 2HG2 ILE 57 6.949 -12.823 -4.792
388 3HG2 ILE 57 3HG2 ILE 57 7.356 -11.294 -5.607
389 1HD1 ILE 57 1HD1 ILE 57 9.614 -13.361 -3.723
390 2HD1 ILE 57 2HD1 ILE 57 9.459 -14.121 -2.121
391 3HD1 ILE 57 3HD1 ILE 57 8.206 -14.386 -3.357
392 H LEU 58 H LEU 58 10.839 -9.854 -5.529
393 HA LEU 58 HA LEU 58 9.283 -7.488 -6.272
394 1HB LEU 58 2HB LEU 58 12.139 -8.196 -6.952
395 2HB LEU 58 1HB LEU 58 11.318 -6.693 -7.322
396 HG LEU 58 HG LEU 58 12.183 -7.727 -4.619
397 1HD1 LEU 58 1HD1 LEU 58 13.690 -6.401 -6.298
398 2HD1 LEU 58 2HD1 LEU 58 12.757 -4.999 -5.723
399 3HD1 LEU 58 3HD1 LEU 58 13.686 -5.984 -4.568
400 1HD2 LEU 58 1HD2 LEU 58 9.992 -5.849 -5.272
401 2HD2 LEU 58 2HD2 LEU 58 10.269 -6.845 -3.824
402 3HD2 LEU 58 3HD2 LEU 58 11.138 -5.305 -4.023
403 H ASP 59 H ASP 59 8.719 -10.423 -6.921
404 HA ASP 59 HA ASP 59 8.963 -10.161 -9.813
405 1HB ASP 59 1HB ASP 59 9.587 -12.313 -8.065
406 2HB ASP 59 2HB ASP 59 8.101 -12.796 -8.859
407 H LYS 60 H LYS 60 6.974 -8.724 -9.651
408 HA LYS 60 HA LYS 60 4.611 -9.353 -8.485
409 1HB LYS 60 1HB LYS 60 4.877 -7.229 -9.479
410 2HB LYS 60 2HB LYS 60 5.265 -7.902 -11.049
411 1HG LYS 60 1HG LYS 60 2.910 -8.897 -11.113
412 2HG LYS 60 2HG LYS 60 2.555 -8.005 -9.646
413 1HD LYS 60 2HD LYS 60 1.778 -6.625 -11.452
414 2HD LYS 60 1HD LYS 60 3.254 -5.873 -10.880
415 1HE LYS 60 1HE LYS 60 3.685 -7.914 -13.004
416 2HE LYS 60 2HE LYS 60 2.733 -6.537 -13.523
417 1HZ LYS 60 1HZ LYS 60 5.294 -6.267 -12.115
418 2HZ LYS 60 2HZ LYS 60 5.159 -6.269 -13.743
419 3HZ LYS 60 3HZ LYS 60 4.452 -5.086 -12.866
420 H ALA 61 H ALA 61 2.597 -10.318 -9.282
421 HA ALA 61 HA ALA 61 1.404 -11.926 -10.228
422 1HB ALA 61 1HB ALA 61 3.476 -12.316 -12.390
423 2HB ALA 61 3HB ALA 61 1.702 -12.414 -12.498
424 3HB ALA 61 2HB ALA 61 2.499 -10.830 -12.343
425 H ASP 62 H ASP 62 3.108 -12.538 -8.080
426 HA ASP 62 HA ASP 62 4.278 -15.075 -8.865
427 1HB ASP 62 1HB ASP 62 5.560 -13.306 -7.489
428 2HB ASP 62 2HB ASP 62 4.468 -13.665 -6.167
429 H LYS 63 H LYS 63 4.068 -16.723 -6.770
430 HA LYS 63 HA LYS 63 1.270 -16.601 -5.886
431 1HB LYS 63 1HB LYS 63 1.685 -18.231 -7.774
432 2HB LYS 63 2HB LYS 63 2.733 -19.128 -6.694
433 1HG LYS 63 1HG LYS 63 0.161 -18.489 -5.415
434 2HG LYS 63 2HG LYS 63 -0.068 -19.378 -6.907
435 1HD LYS 63 1HD LYS 63 0.947 -21.293 -6.095
436 2HD LYS 63 2HD LYS 63 2.110 -20.403 -5.133
437 1HE LYS 63 2HE LYS 63 0.710 -21.376 -3.494
438 2HE LYS 63 1HE LYS 63 0.081 -19.745 -3.621
439 1HZ LYS 63 1HZ LYS 63 -1.374 -20.892 -5.448
440 2HZ LYS 63 2HZ LYS 63 -1.087 -22.221 -4.544
441 3HZ LYS 63 3HZ LYS 63 -1.806 -20.918 -3.873
442 H SER 64 H SER 64 1.984 -15.606 -3.912
443 HA SER 64 HA SER 64 2.550 -17.461 -1.935
444 1HB SER 64 1HB SER 64 4.887 -16.694 -3.258
445 2HB SER 64 2HB SER 64 4.861 -15.620 -1.874
446 HG SER 64 HG SER 64 5.953 -17.628 -1.396
447 H VAL 65 H VAL 65 2.698 -16.364 0.257
448 HA VAL 65 HA VAL 65 1.105 -13.964 0.189
449 HB VAL 65 HB VAL 65 0.493 -15.705 1.707
450 1HG1 VAL 65 1HG1 VAL 65 3.395 -15.703 2.366
451 2HG1 VAL 65 2HG1 VAL 65 2.269 -16.009 3.710
452 3HG1 VAL 65 3HG1 VAL 65 2.238 -17.052 2.268
453 1HG2 VAL 65 1HG2 VAL 65 0.621 -13.128 2.405
454 2HG2 VAL 65 2HG2 VAL 65 0.043 -14.389 3.522
455 3HG2 VAL 65 3HG2 VAL 65 1.715 -13.788 3.645
456 H ASN 66 H ASN 66 4.258 -14.415 -0.421
457 HA ASN 66 HA ASN 66 5.171 -12.321 1.360
458 1HB ASN 66 1HB ASN 66 6.747 -14.031 -0.636
459 2HB ASN 66 2HB ASN 66 7.448 -12.939 0.542
460 2HD2 ASN 66 2HD2 ASN 66 6.597 -13.307 2.849
461 1HD2 ASN 66 1HD2 ASN 66 6.581 -14.944 3.414
462 H SER 67 H SER 67 3.452 -12.392 -1.376
463 HA SER 67 HA SER 67 5.088 -10.963 -3.176
464 1HB SER 67 1HB SER 67 2.753 -10.519 -4.272
465 2HB SER 67 2HB SER 67 3.368 -12.159 -4.231
466 HG SER 67 HG SER 67 1.150 -12.074 -3.539
467 H TRP 68 H TRP 68 5.281 -8.727 -3.483
468 HA TRP 68 HA TRP 68 4.038 -7.092 -1.407
469 1HB TRP 68 1HB TRP 68 6.325 -6.745 -1.388
470 2HB TRP 68 2HB TRP 68 6.472 -6.834 -3.132
471 HD1 TRP 68 HD1 TRP 68 6.723 -4.507 -4.296
472 HE1 TRP 68 HE1 TRP 68 6.279 -1.964 -3.747
473 HE3 TRP 68 HE3 TRP 68 4.487 -5.326 0.196
474 HZ2 TRP 68 HZ2 TRP 68 5.069 -0.611 -1.544
475 HZ3 TRP 68 HZ3 TRP 68 3.703 -3.339 1.483
476 HH2 TRP 68 HH2 TRP 68 3.964 -1.045 0.681
477 H TYR 69 H TYR 69 2.924 -8.317 -4.028
478 HA TYR 69 HA TYR 69 1.873 -5.761 -5.152
479 1HB TYR 69 1HB TYR 69 3.287 -6.831 -6.784
480 2HB TYR 69 2HB TYR 69 2.514 -8.400 -6.502
481 HD1 TYR 69 HD1 TYR 69 -0.010 -8.590 -7.043
482 HD2 TYR 69 HD2 TYR 69 2.503 -5.411 -8.470
483 HE1 TYR 69 HE1 TYR 69 -1.641 -8.110 -8.848
484 HE2 TYR 69 HE2 TYR 69 0.872 -4.931 -10.275
485 HH TYR 69 HH TYR 69 -1.815 -5.372 -10.573
486 H LYS 70 H LYS 70 1.173 -8.619 -3.368
487 HA LYS 70 HA LYS 70 -1.590 -8.623 -4.327
488 1HB LYS 70 1HB LYS 70 -0.198 -10.756 -4.183
489 2HB LYS 70 2HB LYS 70 -0.290 -10.599 -2.440
490 1HG LYS 70 1HG LYS 70 -2.946 -10.228 -3.195
491 2HG LYS 70 2HG LYS 70 -2.393 -11.398 -4.375
492 1HD LYS 70 1HD LYS 70 -1.853 -11.757 -1.400
493 2HD LYS 70 2HD LYS 70 -3.344 -12.313 -2.135
494 1HE LYS 70 1HE LYS 70 -0.532 -13.160 -2.986
495 2HE LYS 70 2HE LYS 70 -1.637 -14.129 -2.031
496 1HZ LYS 70 1HZ LYS 70 -3.048 -13.361 -4.240
497 2HZ LYS 70 2HZ LYS 70 -1.575 -13.772 -4.813
498 3HZ LYS 70 3HZ LYS 70 -2.439 -14.846 -3.936
499 H VAL 71 H VAL 71 0.458 -8.243 -1.381
500 HA VAL 71 HA VAL 71 -1.688 -7.822 0.374
501 HB VAL 71 HB VAL 71 0.073 -6.828 1.821
502 1HG1 VAL 71 1HG1 VAL 71 -0.405 -9.341 1.507
503 2HG1 VAL 71 2HG1 VAL 71 1.110 -9.377 0.573
504 3HG1 VAL 71 3HG1 VAL 71 1.129 -8.876 2.281
505 1HG2 VAL 71 1HG2 VAL 71 1.374 -5.833 -0.117
506 2HG2 VAL 71 2HG2 VAL 71 2.344 -6.660 1.126
507 3HG2 VAL 71 3HG2 VAL 71 2.006 -7.469 -0.423
508 H VAL 72 H VAL 72 -0.618 -6.000 -2.290
509 HA VAL 72 HA VAL 72 -1.475 -3.480 -1.081
510 HB VAL 72 HB VAL 72 0.015 -4.189 -3.609
511 1HG1 VAL 72 1HG1 VAL 72 -1.288 -1.607 -2.779
512 2HG1 VAL 72 2HG1 VAL 72 0.224 -1.579 -3.718
513 3HG1 VAL 72 3HG1 VAL 72 -1.220 -2.383 -4.380
514 1HG2 VAL 72 1HG2 VAL 72 0.769 -2.737 -1.057
515 2HG2 VAL 72 2HG2 VAL 72 1.442 -4.256 -1.695
516 3HG2 VAL 72 3HG2 VAL 72 1.766 -2.718 -2.531
517 H HIS 73 H HIS 73 -1.978 -5.467 -4.086
518 HA HIS 73 HA HIS 73 -4.498 -4.087 -4.466
519 1HB HIS 73 2HB HIS 73 -3.182 -6.173 -6.222
520 2HB HIS 73 1HB HIS 73 -4.525 -5.132 -6.647
521 HD1 HIS 73 HD1 HIS 73 -0.786 -5.044 -6.042
522 HD2 HIS 73 HD2 HIS 73 -3.836 -2.548 -7.477
523 HE1 HIS 73 HE1 HIS 73 0.374 -3.022 -7.080
524 H ASP 74 H ASP 74 -3.954 -6.004 -2.183
525 HA ASP 74 HA ASP 74 -5.346 -8.368 -2.842
526 1HB ASP 74 1HB ASP 74 -3.933 -7.227 -0.561
527 2HB ASP 74 2HB ASP 74 -5.454 -7.909 -0.021
528 H ALA 75 H ALA 75 -7.589 -8.741 -2.680
529 HA ALA 75 HA ALA 75 -9.176 -6.535 -1.558
530 1HB ALA 75 1HB ALA 75 -9.419 -8.230 -4.010
531 2HB ALA 75 3HB ALA 75 -10.926 -7.800 -3.166
532 3HB ALA 75 2HB ALA 75 -9.840 -6.519 -3.757
533 H LYS 76 H LYS 76 -7.962 -9.550 -0.866
534 HA LYS 76 HA LYS 76 -10.436 -10.570 0.280
535 1HB LYS 76 1HB LYS 76 -8.453 -11.849 -1.037
536 2HB LYS 76 2HB LYS 76 -7.865 -12.029 0.604
537 1HG LYS 76 1HG LYS 76 -9.259 -13.860 0.606
538 2HG LYS 76 2HG LYS 76 -10.474 -12.670 1.030
539 1HD LYS 76 2HD LYS 76 -9.860 -13.710 -1.775
540 2HD LYS 76 1HD LYS 76 -11.291 -14.061 -0.827
541 1HE LYS 76 1HE LYS 76 -10.524 -11.212 -1.594
542 2HE LYS 76 2HE LYS 76 -11.507 -12.220 -2.637
543 1HZ LYS 76 1HZ LYS 76 -13.055 -12.479 -0.801
544 2HZ LYS 76 2HZ LYS 76 -12.149 -11.497 0.138
545 3HZ LYS 76 3HZ LYS 76 -12.872 -10.906 -1.202
546 H GLY 77 H GLY 77 -10.043 -11.624 2.594
547 1HA GLY 77 2HA GLY 77 -10.157 -10.040 4.589
548 2HA GLY 77 1HA GLY 77 -8.466 -9.746 4.235
549 H GLY 78 H GLY 78 -8.806 -10.674 6.699
550 1HA GLY 78 2HA GLY 78 -8.120 -13.546 6.510
551 2HA GLY 78 1HA GLY 78 -9.175 -12.913 7.758
552 H ALA 79 H ALA 79 -7.839 -10.407 8.288
553 HA ALA 79 HA ALA 79 -6.187 -10.956 10.292
554 1HB ALA 79 1HB ALA 79 -3.915 -10.431 8.826
555 2HB ALA 79 3HB ALA 79 -4.819 -11.500 7.727
556 3HB ALA 79 2HB ALA 79 -4.422 -12.047 9.374
557 H LYS 80 H LYS 80 -5.978 -9.021 7.221
558 HA LYS 80 HA LYS 80 -6.742 -6.661 8.599
559 1HB LYS 80 1HB LYS 80 -4.459 -5.535 7.871
560 2HB LYS 80 2HB LYS 80 -4.662 -6.278 9.445
561 1HG LYS 80 1HG LYS 80 -3.739 -8.445 8.446
562 2HG LYS 80 2HG LYS 80 -3.375 -7.548 6.985
563 1HD LYS 80 1HD LYS 80 -2.243 -7.040 9.773
564 2HD LYS 80 2HD LYS 80 -1.365 -7.622 8.372
565 1HE LYS 80 1HE LYS 80 -2.717 -4.885 8.544
566 2HE LYS 80 2HE LYS 80 -1.009 -5.164 8.825
567 1HZ LYS 80 1HZ LYS 80 -1.458 -6.363 6.459
568 2HZ LYS 80 2HZ LYS 80 -2.422 -5.047 6.367
569 3HZ LYS 80 3HZ LYS 80 -0.824 -4.871 6.655
570 HA PRO 81 HA PRO 81 -7.839 -5.610 4.498
571 1HB PRO 81 1HB PRO 81 -7.944 -2.875 4.657
572 2HB PRO 81 2HB PRO 81 -9.077 -3.939 5.553
573 1HG PRO 81 2HG PRO 81 -6.735 -2.627 6.332
574 2HG PRO 81 1HG PRO 81 -8.179 -2.677 7.397
575 1HD PRO 81 1HD PRO 81 -5.988 -4.256 7.848
576 2HD PRO 81 2HD PRO 81 -7.643 -4.872 8.135
577 H THR 82 H THR 82 -7.114 -3.605 2.777
578 HA THR 82 HA THR 82 -4.190 -3.475 2.845
579 HB THR 82 HB THR 82 -4.218 -4.211 0.407
580 HG1 THR 82 HG1 THR 82 -6.401 -5.425 0.056
581 1HG2 THR 82 1HG2 THR 82 -4.582 -5.882 2.735
582 2HG2 THR 82 2HG2 THR 82 -5.568 -6.559 1.416
583 3HG2 THR 82 3HG2 THR 82 -3.820 -6.319 1.187
584 H CYS 83 H CYS 83 -3.845 -2.294 0.316
585 HA CYS 83 HA CYS 83 -4.715 0.336 0.979
586 1HB CYS 83 1HB CYS 83 -3.367 -0.435 -1.595
587 2HB CYS 83 2HB CYS 83 -3.303 1.089 -0.733
588 H ILE 84 H ILE 84 -6.185 -2.325 -0.473
589 HA ILE 84 HA ILE 84 -7.772 -0.623 -2.263
590 HB ILE 84 HB ILE 84 -6.906 -3.478 -2.376
591 1HG1 ILE 84 1HG1 ILE 84 -5.685 -1.709 -3.604
592 2HG1 ILE 84 2HG1 ILE 84 -6.364 -2.937 -4.654
593 1HG2 ILE 84 1HG2 ILE 84 -9.511 -2.384 -3.420
594 2HG2 ILE 84 2HG2 ILE 84 -8.673 -3.726 -4.236
595 3HG2 ILE 84 3HG2 ILE 84 -9.192 -3.900 -2.542
596 1HD1 ILE 84 1HD1 ILE 84 -8.416 -1.008 -4.417
597 2HD1 ILE 84 2HD1 ILE 84 -6.912 -0.069 -4.581
598 3HD1 ILE 84 3HD1 ILE 84 -7.353 -1.266 -5.821
599 H SER 85 H SER 85 -7.858 -3.182 0.276
600 HA SER 85 HA SER 85 -10.559 -3.481 0.419
601 1HB SER 85 1HB SER 85 -8.451 -4.525 1.758
602 2HB SER 85 2HB SER 85 -9.015 -3.420 2.995
603 HG SER 85 HG SER 85 -11.043 -4.944 1.756
604 H CYS 86 H CYS 86 -8.507 -1.333 2.535
605 HA CYS 86 HA CYS 86 -10.640 -0.056 3.744
606 1HB CYS 86 1HB CYS 86 -8.133 -0.062 4.374
607 2HB CYS 86 2HB CYS 86 -7.971 1.275 3.253
608 H HIS 87 H HIS 87 -8.492 1.056 1.015
609 HA HIS 87 HA HIS 87 -9.751 3.377 0.420
610 1HB HIS 87 1HB HIS 87 -8.284 1.353 -1.247
611 2HB HIS 87 2HB HIS 87 -9.019 2.743 -2.022
612 HD1 HIS 87 HD1 HIS 87 -6.708 3.757 -2.649
613 HD2 HIS 87 HD2 HIS 87 -7.299 3.252 1.473
614 HE1 HIS 87 HE1 HIS 87 -4.837 5.052 -1.494
615 H LYS 88 H LYS 88 -10.725 0.032 -0.445
616 HA LYS 88 HA LYS 88 -12.730 0.718 -2.254
617 1HB LYS 88 1HB LYS 88 -12.004 -1.671 -0.625
618 2HB LYS 88 2HB LYS 88 -13.633 -1.612 -1.267
619 1HG LYS 88 1HG LYS 88 -11.183 -1.088 -3.005
620 2HG LYS 88 2HG LYS 88 -11.832 -2.699 -2.769
621 1HD LYS 88 1HD LYS 88 -14.131 -1.333 -3.421
622 2HD LYS 88 2HD LYS 88 -12.951 -0.412 -4.332
623 1HE LYS 88 1HE LYS 88 -12.959 -3.449 -4.460
624 2HE LYS 88 2HE LYS 88 -14.061 -2.517 -5.454
625 1HZ LYS 88 1HZ LYS 88 -11.720 -1.272 -5.832
626 2HZ LYS 88 2HZ LYS 88 -11.243 -2.829 -5.704
627 3HZ LYS 88 3HZ LYS 88 -12.346 -2.403 -6.830
628 H ASP 89 H ASP 89 -12.806 0.209 1.329
629 HA ASP 89 HA ASP 89 -15.492 0.501 1.658
630 1HB ASP 89 1HB ASP 89 -13.454 0.050 3.333
631 2HB ASP 89 2HB ASP 89 -13.574 1.774 3.620
632 H LYS 90 H LYS 90 -12.849 2.943 1.378
633 HA LYS 90 HA LYS 90 -14.373 5.184 2.072
634 1HB LYS 90 1HB LYS 90 -11.740 4.628 0.837
635 2HB LYS 90 2HB LYS 90 -12.444 6.177 0.422
636 1HG LYS 90 1HG LYS 90 -12.010 5.113 3.253
637 2HG LYS 90 2HG LYS 90 -11.061 6.360 2.470
638 1HD LYS 90 1HD LYS 90 -13.598 7.392 2.158
639 2HD LYS 90 2HD LYS 90 -13.790 6.525 3.669
640 1HE LYS 90 1HE LYS 90 -11.798 7.712 4.609
641 2HE LYS 90 2HE LYS 90 -11.594 8.573 3.097
642 1HZ LYS 90 1HZ LYS 90 -14.234 8.771 4.130
643 2HZ LYS 90 2HZ LYS 90 -13.117 9.380 5.154
644 3HZ LYS 90 3HZ LYS 90 -13.224 9.952 3.628
645 H ALA 91 H ALA 91 -13.758 3.512 -1.061
646 HA ALA 91 HA ALA 91 -15.517 5.416 -2.386
647 1HB ALA 91 1HB ALA 91 -14.282 3.069 -3.782
648 2HB ALA 91 3HB ALA 91 -14.497 4.746 -4.340
649 3HB ALA 91 2HB ALA 91 -13.194 4.350 -3.193
650 H GLY 92 H GLY 92 -16.478 3.506 -0.270
651 1HA GLY 92 2HA GLY 92 -18.053 1.911 0.051
652 2HA GLY 92 1HA GLY 92 -17.877 1.397 -1.615
653 H ASP 93 H ASP 93 -19.490 1.888 -3.061
654 HA ASP 93 HA ASP 93 -21.609 2.414 -3.494
655 1HB ASP 93 1HB ASP 93 -21.778 3.017 -0.909
656 2HB ASP 93 2HB ASP 93 -21.642 4.671 -1.472
657 H ASP 94 H ASP 94 -18.891 4.550 -2.993
658 HA ASP 94 HA ASP 94 -20.031 6.618 -4.648
659 1HB ASP 94 1HB ASP 94 -18.555 6.979 -2.529
660 2HB ASP 94 2HB ASP 94 -17.201 6.496 -3.531
661 H LYS 95 H LYS 95 -19.881 6.200 -6.864
662 HA LYS 95 HA LYS 95 -17.911 4.409 -7.880
663 1HB LYS 95 1HB LYS 95 -20.131 6.063 -9.063
664 2HB LYS 95 2HB LYS 95 -18.947 5.301 -10.106
665 1HG LYS 95 1HG LYS 95 -19.463 3.083 -9.152
666 2HG LYS 95 2HG LYS 95 -20.546 3.803 -7.977
667 1HD LYS 95 1HD LYS 95 -22.251 4.047 -9.497
668 2HD LYS 95 2HD LYS 95 -21.172 4.558 -10.780
669 1HE LYS 95 1HE LYS 95 -21.389 2.496 -11.702
670 2HE LYS 95 2HE LYS 95 -20.501 1.843 -10.339
671 1HZ LYS 95 1HZ LYS 95 -23.367 2.359 -10.118
672 2HZ LYS 95 2HZ LYS 95 -22.823 0.977 -10.797
673 3HZ LYS 95 3HZ LYS 95 -22.446 1.329 -9.248
674 H GLU 96 H GLU 96 -18.318 7.943 -7.584
675 HA GLU 96 HA GLU 96 -16.271 8.582 -9.376
676 1HB GLU 96 1HB GLU 96 -18.041 10.173 -8.650
677 2HB GLU 96 2HB GLU 96 -17.388 10.173 -7.024
678 1HG GLU 96 1HG GLU 96 -15.126 10.882 -8.188
679 2HG GLU 96 2HG GLU 96 -16.144 11.302 -9.552
680 H LEU 97 H LEU 97 -16.390 7.978 -5.828
681 HA LEU 97 HA LEU 97 -13.671 8.707 -5.424
682 1HB LEU 97 1HB LEU 97 -15.683 8.651 -3.786
683 2HB LEU 97 2HB LEU 97 -15.287 6.954 -3.601
684 HG LEU 97 HG LEU 97 -14.266 8.154 -1.811
685 1HD1 LEU 97 1HD1 LEU 97 -12.960 6.333 -3.070
686 2HD1 LEU 97 2HD1 LEU 97 -11.960 7.669 -3.690
687 3HD1 LEU 97 3HD1 LEU 97 -12.068 7.377 -1.937
688 1HD2 LEU 97 1HD2 LEU 97 -13.852 10.190 -3.808
689 2HD2 LEU 97 2HD2 LEU 97 -13.762 10.302 -2.034
690 3HD2 LEU 97 3HD2 LEU 97 -12.324 9.828 -2.970
691 H LYS 98 H LYS 98 -15.239 6.029 -6.888
692 HA LYS 98 HA LYS 98 -13.187 4.136 -6.135
693 1HB LYS 98 1HB LYS 98 -15.659 3.590 -6.412
694 2HB LYS 98 2HB LYS 98 -15.425 3.771 -8.139
695 1HG LYS 98 1HG LYS 98 -13.779 1.978 -8.193
696 2HG LYS 98 2HG LYS 98 -13.695 1.918 -6.443
697 1HD LYS 98 1HD LYS 98 -15.105 0.090 -7.006
698 2HD LYS 98 2HD LYS 98 -16.223 1.336 -6.491
699 1HE LYS 98 1HE LYS 98 -17.123 0.426 -8.535
700 2HE LYS 98 2HE LYS 98 -16.486 2.007 -8.942
701 1HZ LYS 98 1HZ LYS 98 -14.795 -0.356 -9.210
702 2HZ LYS 98 2HZ LYS 98 -15.868 0.021 -10.382
703 3HZ LYS 98 3HZ LYS 98 -14.684 1.076 -9.988
704 H LYS 99 H LYS 99 -12.566 6.718 -7.603
705 HA LYS 99 HA LYS 99 -11.030 5.432 -9.712
706 1HB LYS 99 1HB LYS 99 -13.120 7.544 -10.140
707 2HB LYS 99 2HB LYS 99 -11.677 7.558 -11.133
708 1HG LYS 99 1HG LYS 99 -12.587 4.830 -10.991
709 2HG LYS 99 2HG LYS 99 -13.985 5.827 -11.341
710 1HD LYS 99 1HD LYS 99 -13.176 6.498 -13.408
711 2HD LYS 99 2HD LYS 99 -11.505 6.492 -12.881
712 1HE LYS 99 1HE LYS 99 -11.657 3.919 -12.818
713 2HE LYS 99 2HE LYS 99 -13.208 4.070 -13.619
714 1HZ LYS 99 1HZ LYS 99 -11.393 5.652 -14.983
715 2HZ LYS 99 2HZ LYS 99 -10.680 4.201 -14.752
716 3HZ LYS 99 3HZ LYS 99 -12.127 4.290 -15.505
717 H LYS 100 H LYS 100 -9.982 6.016 -7.286
718 HA LYS 100 HA LYS 100 -8.017 7.923 -7.948
719 1HB LYS 100 1HB LYS 100 -8.628 9.374 -5.836
720 2HB LYS 100 2HB LYS 100 -9.306 9.733 -7.411
721 1HG LYS 100 1HG LYS 100 -11.355 8.425 -6.839
722 2HG LYS 100 2HG LYS 100 -10.677 8.038 -5.270
723 1HD LYS 100 1HD LYS 100 -12.176 9.915 -4.957
724 2HD LYS 100 2HD LYS 100 -10.543 10.520 -4.769
725 1HE LYS 100 2HE LYS 100 -11.829 12.067 -6.183
726 2HE LYS 100 1HE LYS 100 -10.562 11.323 -7.139
727 1HZ LYS 100 1HZ LYS 100 -12.983 9.830 -7.150
728 2HZ LYS 100 2HZ LYS 100 -13.169 11.333 -7.760
729 3HZ LYS 100 3HZ LYS 100 -12.060 10.323 -8.404
730 H LEU 101 H LEU 101 -9.785 6.171 -5.330
731 HA LEU 101 HA LEU 101 -7.224 5.675 -4.028
732 1HB LEU 101 2HB LEU 101 -9.983 4.936 -3.064
733 2HB LEU 101 1HB LEU 101 -8.496 4.979 -2.138
734 HG LEU 101 HG LEU 101 -10.140 7.292 -3.158
735 1HD1 LEU 101 1HD1 LEU 101 -10.573 6.118 -0.924
736 2HD1 LEU 101 2HD1 LEU 101 -9.044 6.853 -0.382
737 3HD1 LEU 101 3HD1 LEU 101 -10.393 7.889 -0.906
738 1HD2 LEU 101 1HD2 LEU 101 -7.297 7.420 -2.116
739 2HD2 LEU 101 2HD2 LEU 101 -7.855 7.833 -3.755
740 3HD2 LEU 101 3HD2 LEU 101 -8.371 8.818 -2.365
741 H THR 102 H THR 102 -9.710 4.176 -6.032
742 HA THR 102 HA THR 102 -8.169 1.672 -5.893
743 HB THR 102 HB THR 102 -10.227 0.424 -5.839
744 HG1 THR 102 HG1 THR 102 -11.494 1.598 -7.330
745 1HG2 THR 102 1HG2 THR 102 -9.710 1.905 -3.689
746 2HG2 THR 102 2HG2 THR 102 -11.118 2.845 -4.239
747 3HG2 THR 102 3HG2 THR 102 -11.300 1.119 -3.845
748 H GLY 103 H GLY 103 -8.691 4.314 -7.703
749 1HA GLY 103 2HA GLY 103 -8.638 4.770 -9.903
750 2HA GLY 103 1HA GLY 103 -9.592 3.326 -10.180
751 H CYS 104 H CYS 104 -8.650 1.701 -11.340
752 HA CYS 104 HA CYS 104 -6.118 0.736 -10.922
753 1HB CYS 104 1HB CYS 104 -8.209 0.434 -12.962
754 2HB CYS 104 2HB CYS 104 -6.589 0.141 -13.564
755 H LYS 105 H LYS 105 -7.337 3.018 -13.484
756 HA LYS 105 HA LYS 105 -4.572 3.977 -13.738
757 1HB LYS 105 1HB LYS 105 -4.956 4.327 -16.112
758 2HB LYS 105 2HB LYS 105 -5.195 2.643 -15.695
759 1HG LYS 105 1HG LYS 105 -7.578 2.816 -15.841
760 2HG LYS 105 2HG LYS 105 -7.548 4.565 -15.741
761 1HD LYS 105 1HD LYS 105 -7.775 4.449 -18.022
762 2HD LYS 105 2HD LYS 105 -6.037 4.226 -17.993
763 1HE LYS 105 1HE LYS 105 -8.084 1.954 -17.966
764 2HE LYS 105 2HE LYS 105 -7.215 2.498 -19.388
765 1HZ LYS 105 1HZ LYS 105 -5.177 2.076 -17.881
766 2HZ LYS 105 2HZ LYS 105 -6.193 1.095 -17.061
767 3HZ LYS 105 3HZ LYS 105 -5.898 0.825 -18.644
768 H GLY 106 H GLY 106 -4.267 6.196 -13.691
769 1HA GLY 106 2HA GLY 106 -6.439 8.028 -14.032
770 2HA GLY 106 1HA GLY 106 -4.796 8.391 -13.542
771 H SER 107 H SER 107 -4.563 6.695 -11.235
772 HA SER 107 HA SER 107 -6.615 7.881 -9.534
773 1HB SER 107 1HB SER 107 -6.169 5.978 -7.964
774 2HB SER 107 2HB SER 107 -6.799 5.456 -9.513
775 HG SER 107 HG SER 107 -4.995 4.146 -8.830
776 H ALA 108 H ALA 108 -5.615 7.845 -7.061
777 HA ALA 108 HA ALA 108 -3.448 9.690 -7.197
778 1HB ALA 108 1HB ALA 108 -3.980 10.128 -4.989
779 2HB ALA 108 3HB ALA 108 -5.524 9.438 -5.546
780 3HB ALA 108 2HB ALA 108 -4.376 8.429 -4.633
781 H CYS 109 H CYS 109 -3.578 6.352 -7.494
782 HA CYS 109 HA CYS 109 -1.059 5.989 -6.060
783 1HB CYS 109 1HB CYS 109 -3.115 3.990 -7.044
784 2HB CYS 109 2HB CYS 109 -1.536 3.524 -6.445
785 H HIS 110 H HIS 110 -2.783 5.430 -9.202
786 HA HIS 110 HA HIS 110 -0.140 5.312 -10.464
787 1HB HIS 110 1HB HIS 110 -2.706 3.931 -11.298
788 2HB HIS 110 2HB HIS 110 -1.223 3.937 -12.231
789 HD1 HIS 110 HD1 HIS 110 0.940 3.205 -10.305
790 HD2 HIS 110 HD2 HIS 110 -2.886 1.499 -10.093
791 HE1 HIS 110 HE1 HIS 110 1.208 1.004 -9.043
792 HA PRO 111 HA PRO 111 -2.151 8.997 -12.191
793 1HB PRO 111 1HB PRO 111 -0.336 10.851 -11.492
794 2HB PRO 111 2HB PRO 111 -1.394 10.116 -10.244
795 1HG PRO 111 2HG PRO 111 1.227 9.418 -11.184
796 2HG PRO 111 1HG PRO 111 1.120 9.435 -9.394
797 1HD PRO 111 1HD PRO 111 1.097 7.093 -10.748
798 2HD PRO 111 2HD PRO 111 -0.036 7.334 -9.384
799 H SER 112 H SER 112 -1.477 7.471 -14.151
800 HA SER 112 HA SER 112 0.198 9.048 -15.766
801 1HB SER 112 1HB SER 112 1.371 6.701 -14.410
802 2HB SER 112 2HB SER 112 1.548 6.633 -16.152
803 HG SER 112 HG SER 112 2.831 8.410 -16.154
No H/Q in entry = 803
Start of MODEL 19
1 H1 VAL 1 H1 VAL 1 8.569 8.967 16.937
2 H2 VAL 1 H2 VAL 1 9.611 8.010 17.797
3 H3 VAL 1 H3 VAL 1 9.850 9.647 17.735
4 HA VAL 1 HA VAL 1 11.398 8.824 16.328
5 HB VAL 1 HB VAL 1 10.775 6.582 16.165
6 1HG1 VAL 1 1HG1 VAL 1 8.313 7.007 16.452
7 2HG1 VAL 1 2HG1 VAL 1 8.225 7.339 14.705
8 3HG1 VAL 1 3HG1 VAL 1 8.713 5.727 15.282
9 1HG2 VAL 1 1HG2 VAL 1 11.891 7.441 14.139
10 2HG2 VAL 1 2HG2 VAL 1 10.800 6.084 13.772
11 3HG2 VAL 1 3HG2 VAL 1 10.301 7.752 13.402
12 H ASP 2 H ASP 2 8.377 10.336 16.138
13 HA ASP 2 HA ASP 2 7.576 11.938 14.919
14 1HB ASP 2 1HB ASP 2 10.184 12.576 15.046
15 2HB ASP 2 2HB ASP 2 10.121 12.263 13.323
16 H VAL 3 H VAL 3 6.069 11.133 13.435
17 HA VAL 3 HA VAL 3 6.590 9.212 11.526
18 HB VAL 3 HB VAL 3 4.399 10.226 12.543
19 1HG1 VAL 3 1HG1 VAL 3 4.680 12.470 11.577
20 2HG1 VAL 3 2HG1 VAL 3 4.622 11.776 9.940
21 3HG1 VAL 3 3HG1 VAL 3 3.189 11.693 10.993
22 1HG2 VAL 3 1HG2 VAL 3 4.631 8.219 11.054
23 2HG2 VAL 3 2HG2 VAL 3 3.108 9.116 10.845
24 3HG2 VAL 3 3HG2 VAL 3 4.418 9.297 9.654
25 HA PRO 4 HA PRO 4 9.319 11.147 8.666
26 1HB PRO 4 1HB PRO 4 7.762 9.297 6.828
27 2HB PRO 4 2HB PRO 4 9.529 9.555 7.001
28 1HG PRO 4 1HG PRO 4 8.481 7.403 8.224
29 2HG PRO 4 2HG PRO 4 9.823 8.358 8.934
30 1HD PRO 4 2HD PRO 4 6.883 8.263 9.650
31 2HD PRO 4 1HD PRO 4 8.295 8.599 10.697
32 H ALA 5 H ALA 5 9.098 12.458 6.593
33 HA ALA 5 HA ALA 5 6.515 13.799 6.639
34 1HB ALA 5 1HB ALA 5 7.880 15.372 5.062
35 2HB ALA 5 2HB ALA 5 8.281 15.337 6.795
36 3HB ALA 5 3HB ALA 5 9.290 14.447 5.630
37 H ASP 6 H ASP 6 5.584 14.470 4.454
38 HA ASP 6 HA ASP 6 4.975 12.227 3.022
39 1HB ASP 6 2HB ASP 6 3.721 13.656 1.643
40 2HB ASP 6 1HB ASP 6 3.869 14.605 3.108
41 H GLY 7 H GLY 7 5.272 13.218 0.234
42 1HA GLY 7 2HA GLY 7 7.962 13.787 -0.404
43 2HA GLY 7 1HA GLY 7 6.715 13.209 -1.492
44 H ALA 8 H ALA 8 6.272 10.822 0.480
45 HA ALA 8 HA ALA 8 8.749 9.368 0.186
46 1HB ALA 8 1HB ALA 8 6.648 9.362 2.003
47 2HB ALA 8 2HB ALA 8 6.356 7.889 1.048
48 3HB ALA 8 3HB ALA 8 7.915 8.118 1.875
49 H LYS 9 H LYS 9 9.242 8.675 -1.848
50 HA LYS 9 HA LYS 9 7.050 7.820 -3.562
51 1HB LYS 9 1HB LYS 9 8.288 8.602 -5.241
52 2HB LYS 9 2HB LYS 9 9.344 9.299 -4.030
53 1HG LYS 9 1HG LYS 9 10.522 6.964 -3.986
54 2HG LYS 9 2HG LYS 9 9.657 6.641 -5.476
55 1HD LYS 9 2HD LYS 9 11.607 7.557 -6.352
56 2HD LYS 9 1HD LYS 9 10.640 9.012 -6.210
57 1HE LYS 9 1HE LYS 9 12.821 9.490 -5.253
58 2HE LYS 9 2HE LYS 9 11.672 9.422 -3.931
59 1HZ LYS 9 1HZ LYS 9 12.546 6.864 -4.247
60 2HZ LYS 9 2HZ LYS 9 13.895 7.768 -4.420
61 3HZ LYS 9 3HZ LYS 9 12.989 7.902 -3.067
62 H ILE 10 H ILE 10 6.635 5.710 -4.071
63 HA ILE 10 HA ILE 10 8.470 3.753 -2.879
64 HB ILE 10 HB ILE 10 5.523 3.475 -3.476
65 1HG1 ILE 10 1HG1 ILE 10 6.574 3.551 -0.686
66 2HG1 ILE 10 2HG1 ILE 10 6.478 5.075 -1.545
67 1HG2 ILE 10 1HG2 ILE 10 7.627 1.614 -2.481
68 2HG2 ILE 10 2HG2 ILE 10 6.010 1.516 -1.743
69 3HG2 ILE 10 3HG2 ILE 10 6.201 1.304 -3.500
70 1HD1 ILE 10 1HD1 ILE 10 4.062 3.431 -1.936
71 2HD1 ILE 10 2HD1 ILE 10 4.366 3.816 -0.225
72 3HD1 ILE 10 3HD1 ILE 10 4.207 5.127 -1.418
73 H ASP 11 H ASP 11 9.675 2.589 -4.271
74 HA ASP 11 HA ASP 11 8.483 1.808 -6.756
75 1HB ASP 11 1HB ASP 11 9.446 3.845 -7.550
76 2HB ASP 11 2HB ASP 11 10.868 3.672 -6.541
77 H PHE 12 H PHE 12 8.758 -0.357 -5.878
78 HA PHE 12 HA PHE 12 11.562 -1.147 -5.512
79 1HB PHE 12 1HB PHE 12 8.928 -2.307 -4.421
80 2HB PHE 12 2HB PHE 12 10.516 -2.953 -4.056
81 HD1 PHE 12 HD1 PHE 12 11.974 -0.335 -3.655
82 HD2 PHE 12 HD2 PHE 12 8.198 -1.692 -2.274
83 HE1 PHE 12 HE1 PHE 12 12.145 1.202 -1.678
84 HE2 PHE 12 HE2 PHE 12 8.369 -0.155 -0.297
85 HZ PHE 12 HZ PHE 12 10.340 1.273 -0.023
86 H ILE 13 H ILE 13 8.485 -1.685 -7.170
87 HA ILE 13 HA ILE 13 9.500 -4.159 -8.331
88 HB ILE 13 HB ILE 13 6.802 -2.810 -8.413
89 1HG1 ILE 13 1HG1 ILE 13 7.514 -5.474 -7.180
90 2HG1 ILE 13 2HG1 ILE 13 7.647 -3.976 -6.280
91 1HG2 ILE 13 1HG2 ILE 13 7.911 -5.107 -9.969
92 2HG2 ILE 13 2HG2 ILE 13 6.227 -5.194 -9.400
93 3HG2 ILE 13 3HG2 ILE 13 6.745 -3.851 -10.447
94 1HD1 ILE 13 1HD1 ILE 13 5.085 -4.098 -7.689
95 2HD1 ILE 13 2HD1 ILE 13 5.314 -5.520 -6.644
96 3HD1 ILE 13 3HD1 ILE 13 5.406 -3.883 -5.951
97 H ALA 14 H ALA 14 10.968 -3.781 -9.927
98 HA ALA 14 HA ALA 14 11.672 -3.200 -11.954
99 1HB ALA 14 1HB ALA 14 10.016 -3.101 -13.467
100 2HB ALA 14 2HB ALA 14 8.845 -2.857 -12.148
101 3HB ALA 14 3HB ALA 14 9.604 -1.453 -12.935
102 H GLY 15 H GLY 15 11.911 -0.916 -13.349
103 1HA GLY 15 2HA GLY 15 13.259 0.818 -11.499
104 2HA GLY 15 1HA GLY 15 11.803 1.535 -12.160
105 H GLY 16 H GLY 16 12.144 2.782 -13.939
106 1HA GLY 16 2HA GLY 16 13.709 1.791 -16.141
107 2HA GLY 16 1HA GLY 16 14.485 3.107 -15.282
108 H GLU 17 H GLU 17 12.848 5.028 -14.714
109 HA GLU 17 HA GLU 17 11.788 6.731 -15.558
110 1HB GLU 17 1HB GLU 17 12.705 5.369 -17.983
111 2HB GLU 17 2HB GLU 17 11.185 6.195 -18.266
112 1HG GLU 17 1HG GLU 17 13.319 7.586 -18.637
113 2HG GLU 17 2HG GLU 17 12.081 8.322 -17.639
114 H LYS 18 H LYS 18 10.545 3.683 -17.101
115 HA LYS 18 HA LYS 18 7.835 4.635 -16.780
116 1HB LYS 18 1HB LYS 18 7.223 2.625 -18.009
117 2HB LYS 18 2HB LYS 18 8.489 3.501 -18.846
118 1HG LYS 18 1HG LYS 18 10.166 1.925 -18.238
119 2HG LYS 18 2HG LYS 18 9.222 1.287 -16.906
120 1HD LYS 18 1HD LYS 18 7.651 0.208 -18.441
121 2HD LYS 18 2HD LYS 18 8.373 1.005 -19.824
122 1HE LYS 18 1HE LYS 18 10.565 -0.271 -18.636
123 2HE LYS 18 2HE LYS 18 9.266 -1.416 -18.376
124 1HZ LYS 18 1HZ LYS 18 8.758 -1.208 -20.754
125 2HZ LYS 18 2HZ LYS 18 10.076 -0.265 -20.953
126 3HZ LYS 18 3HZ LYS 18 10.247 -1.818 -20.476
127 H ASN 19 H ASN 19 8.908 4.642 -14.298
128 HA ASN 19 HA ASN 19 8.174 2.083 -13.145
129 1HB ASN 19 1HB ASN 19 9.136 3.414 -11.012
130 2HB ASN 19 2HB ASN 19 10.218 2.645 -12.157
131 2HD2 ASN 19 2HD2 ASN 19 8.348 5.670 -11.874
132 1HD2 ASN 19 1HD2 ASN 19 9.609 6.753 -12.362
133 H LEU 20 H LEU 20 6.301 1.936 -11.847
134 HA LEU 20 HA LEU 20 4.589 4.245 -11.797
135 1HB LEU 20 1HB LEU 20 4.281 1.374 -10.934
136 2HB LEU 20 2HB LEU 20 3.048 2.584 -10.641
137 HG LEU 20 HG LEU 20 3.984 1.431 -13.256
138 1HD1 LEU 20 1HD1 LEU 20 1.337 1.714 -11.836
139 2HD1 LEU 20 2HD1 LEU 20 1.450 1.321 -13.568
140 3HD1 LEU 20 3HD1 LEU 20 2.176 0.234 -12.360
141 1HD2 LEU 20 1HD2 LEU 20 2.625 4.098 -12.849
142 2HD2 LEU 20 2HD2 LEU 20 4.103 3.731 -13.770
143 3HD2 LEU 20 3HD2 LEU 20 2.521 3.181 -14.371
144 H THR 21 H THR 21 6.104 5.585 -10.487
145 HA THR 21 HA THR 21 6.595 4.789 -7.781
146 HB THR 21 HB THR 21 6.816 7.650 -8.665
147 HG1 THR 21 HG1 THR 21 8.417 5.413 -9.685
148 1HG2 THR 21 1HG2 THR 21 7.934 6.406 -6.593
149 2HG2 THR 21 2HG2 THR 21 9.068 5.797 -7.823
150 3HG2 THR 21 3HG2 THR 21 8.904 7.549 -7.552
151 H VAL 22 H VAL 22 5.095 4.676 -6.241
152 HA VAL 22 HA VAL 22 2.793 6.461 -6.485
153 HB VAL 22 HB VAL 22 3.308 3.920 -4.937
154 1HG1 VAL 22 1HG1 VAL 22 1.938 5.586 -3.637
155 2HG1 VAL 22 2HG1 VAL 22 0.736 5.527 -4.949
156 3HG1 VAL 22 3HG1 VAL 22 1.102 4.060 -4.010
157 1HG2 VAL 22 1HG2 VAL 22 2.533 4.281 -7.557
158 2HG2 VAL 22 2HG2 VAL 22 2.221 2.831 -6.574
159 3HG2 VAL 22 3HG2 VAL 22 0.976 4.095 -6.717
160 H VAL 23 H VAL 23 2.449 8.127 -5.074
161 HA VAL 23 HA VAL 23 4.532 8.534 -3.076
162 HB VAL 23 HB VAL 23 2.375 10.401 -4.080
163 1HG1 VAL 23 1HG1 VAL 23 3.915 10.623 -1.810
164 2HG1 VAL 23 2HG1 VAL 23 4.876 11.521 -3.010
165 3HG1 VAL 23 3HG1 VAL 23 3.185 11.981 -2.699
166 1HG2 VAL 23 1HG2 VAL 23 4.864 9.516 -5.312
167 2HG2 VAL 23 2HG2 VAL 23 3.540 10.497 -5.987
168 3HG2 VAL 23 3HG2 VAL 23 4.839 11.277 -5.052
169 H PHE 24 H PHE 24 4.047 8.941 -0.856
170 HA PHE 24 HA PHE 24 1.288 8.437 -0.064
171 1HB PHE 24 1HB PHE 24 2.534 6.258 -0.021
172 2HB PHE 24 2HB PHE 24 3.843 7.002 0.875
173 HD1 PHE 24 HD1 PHE 24 0.260 6.076 1.104
174 HD2 PHE 24 HD2 PHE 24 3.793 7.090 3.224
175 HE1 PHE 24 HE1 PHE 24 -0.849 5.430 3.261
176 HE2 PHE 24 HE2 PHE 24 2.684 6.444 5.381
177 HZ PHE 24 HZ PHE 24 0.377 5.621 5.374
178 H ASN 25 H ASN 25 0.756 9.263 2.055
179 HA ASN 25 HA ASN 25 2.868 10.899 3.206
180 1HB ASN 25 1HB ASN 25 0.784 11.999 1.778
181 2HB ASN 25 2HB ASN 25 0.059 11.944 3.372
182 2HD2 ASN 25 2HD2 ASN 25 2.522 12.182 4.835
183 1HD2 ASN 25 1HD2 ASN 25 3.080 13.816 4.693
184 H HIS 26 H HIS 26 3.020 10.536 5.439
185 HA HIS 26 HA HIS 26 1.226 8.682 6.620
186 1HB HIS 26 1HB HIS 26 3.723 10.106 7.395
187 2HB HIS 26 2HB HIS 26 2.694 9.557 8.703
188 HD1 HIS 26 HD1 HIS 26 4.628 8.203 5.716
189 HD2 HIS 26 HD2 HIS 26 2.794 6.834 9.231
190 HE1 HIS 26 HE1 HIS 26 5.301 5.755 5.966
191 H SER 27 H SER 27 1.173 12.076 6.095
192 HA SER 27 HA SER 27 -0.333 12.608 8.482
193 1HB SER 27 2HB SER 27 -0.410 14.945 7.586
194 2HB SER 27 1HB SER 27 1.222 14.325 7.730
195 HG SER 27 HG SER 27 -0.005 15.288 5.522
196 H THR 28 H THR 28 -1.123 10.840 5.952
197 HA THR 28 HA THR 28 -3.700 12.174 5.448
198 HB THR 28 HB THR 28 -2.165 10.083 3.815
199 HG1 THR 28 HG1 THR 28 -1.972 12.110 2.460
200 1HG2 THR 28 1HG2 THR 28 -4.883 11.277 3.618
201 2HG2 THR 28 2HG2 THR 28 -3.902 11.481 2.147
202 3HG2 THR 28 3HG2 THR 28 -4.215 9.851 2.789
203 H HIS 29 H HIS 29 -2.065 9.214 6.568
204 HA HIS 29 HA HIS 29 -4.712 8.087 7.090
205 1HB HIS 29 1HB HIS 29 -2.010 6.715 7.015
206 2HB HIS 29 2HB HIS 29 -3.551 5.931 7.298
207 HD1 HIS 29 HD1 HIS 29 -1.685 7.814 4.555
208 HD2 HIS 29 HD2 HIS 29 -4.931 5.198 5.017
209 HE1 HIS 29 HE1 HIS 29 -2.411 7.152 2.200
210 H LYS 30 H LYS 30 -3.256 10.283 8.611
211 HA LYS 30 HA LYS 30 -2.158 9.282 10.948
212 1HB LYS 30 2HB LYS 30 -2.526 11.495 11.850
213 2HB LYS 30 1HB LYS 30 -1.984 11.616 10.188
214 1HG LYS 30 1HG LYS 30 -3.774 13.068 10.043
215 2HG LYS 30 2HG LYS 30 -4.641 11.583 9.705
216 1HD LYS 30 2HD LYS 30 -5.979 12.436 11.408
217 2HD LYS 30 1HD LYS 30 -4.874 11.466 12.362
218 1HE LYS 30 1HE LYS 30 -3.466 13.466 12.811
219 2HE LYS 30 2HE LYS 30 -4.504 14.448 11.797
220 1HZ LYS 30 1HZ LYS 30 -5.421 13.018 14.195
221 2HZ LYS 30 2HZ LYS 30 -5.032 14.604 14.154
222 3HZ LYS 30 3HZ LYS 30 -6.304 14.052 13.290
223 H ASP 31 H ASP 31 -5.424 9.191 9.755
224 HA ASP 31 HA ASP 31 -6.553 8.974 12.372
225 1HB ASP 31 2HB ASP 31 -8.648 8.917 11.275
226 2HB ASP 31 1HB ASP 31 -7.675 9.935 10.231
227 H VAL 32 H VAL 32 -4.677 6.994 10.434
228 HA VAL 32 HA VAL 32 -6.116 4.560 11.233
229 HB VAL 32 HB VAL 32 -4.076 4.957 9.035
230 1HG1 VAL 32 1HG1 VAL 32 -4.145 2.676 10.028
231 2HG1 VAL 32 2HG1 VAL 32 -5.875 2.580 9.618
232 3HG1 VAL 32 3HG1 VAL 32 -4.659 2.713 8.325
233 1HG2 VAL 32 1HG2 VAL 32 -7.082 5.043 9.047
234 2HG2 VAL 32 2HG2 VAL 32 -5.917 6.080 8.189
235 3HG2 VAL 32 3HG2 VAL 32 -6.219 4.420 7.619
236 H LYS 33 H LYS 33 -5.165 3.212 12.697
237 HA LYS 33 HA LYS 33 -3.050 4.059 14.230
238 1HB LYS 33 2HB LYS 33 -4.009 1.218 13.770
239 2HB LYS 33 1HB LYS 33 -3.025 1.762 15.114
240 1HG LYS 33 1HG LYS 33 -5.129 3.573 15.196
241 2HG LYS 33 2HG LYS 33 -5.937 2.122 14.637
242 1HD LYS 33 1HD LYS 33 -4.292 1.145 16.673
243 2HD LYS 33 2HD LYS 33 -4.760 2.717 17.290
244 1HE LYS 33 1HE LYS 33 -6.573 1.478 18.046
245 2HE LYS 33 2HE LYS 33 -7.200 1.946 16.479
246 1HZ LYS 33 1HZ LYS 33 -5.778 -0.570 17.017
247 2HZ LYS 33 2HZ LYS 33 -7.400 -0.418 16.896
248 3HZ LYS 33 3HZ LYS 33 -6.454 -0.137 15.595
249 H CYS 34 H CYS 34 -0.857 3.046 14.491
250 HA CYS 34 HA CYS 34 0.451 3.116 11.970
251 1HB CYS 34 2HB CYS 34 1.686 2.328 14.606
252 2HB CYS 34 1HB CYS 34 2.482 2.990 13.191
253 H ASP 35 H ASP 35 -0.427 0.652 14.454
254 HA ASP 35 HA ASP 35 0.982 -1.432 13.266
255 1HB ASP 35 1HB ASP 35 -0.571 -2.886 14.644
256 2HB ASP 35 2HB ASP 35 0.249 -1.636 15.559
257 H ASP 36 H ASP 36 -1.722 0.360 12.221
258 HA ASP 36 HA ASP 36 -3.378 -1.630 11.229
259 1HB ASP 36 1HB ASP 36 -3.666 0.997 11.472
260 2HB ASP 36 2HB ASP 36 -3.001 1.046 9.851
261 H CYS 37 H CYS 37 -0.240 -0.445 10.284
262 HA CYS 37 HA CYS 37 -0.473 -1.914 7.766
263 1HB CYS 37 1HB CYS 37 0.869 0.779 8.160
264 2HB CYS 37 2HB CYS 37 1.112 -0.236 6.752
265 H HIS 38 H HIS 38 1.673 -0.425 10.286
266 HA HIS 38 HA HIS 38 3.827 -2.175 9.613
267 1HB HIS 38 1HB HIS 38 3.445 -0.285 11.952
268 2HB HIS 38 2HB HIS 38 4.937 -1.115 11.556
269 HD1 HIS 38 HD1 HIS 38 5.865 -0.528 8.983
270 HD2 HIS 38 HD2 HIS 38 3.229 2.185 10.798
271 HE1 HIS 38 HE1 HIS 38 6.135 1.679 7.730
272 H HIS 39 H HIS 39 2.480 -4.193 9.797
273 HA HIS 39 HA HIS 39 1.728 -4.917 12.476
274 1HB HIS 39 2HB HIS 39 0.681 -6.777 11.524
275 2HB HIS 39 1HB HIS 39 0.441 -5.490 10.359
276 HD1 HIS 39 HD1 HIS 39 1.889 -8.872 10.736
277 HD2 HIS 39 HD2 HIS 39 2.142 -5.706 7.996
278 HE1 HIS 39 HE1 HIS 39 2.920 -9.844 8.614
279 H GLN 40 H GLN 40 4.201 -4.402 12.971
280 HA GLN 40 HA GLN 40 5.486 -7.009 12.928
281 1HB GLN 40 1HB GLN 40 6.666 -4.358 12.063
282 2HB GLN 40 2HB GLN 40 7.708 -5.590 12.745
283 1HG GLN 40 2HG GLN 40 5.900 -5.909 10.304
284 2HG GLN 40 1HG GLN 40 7.649 -5.799 10.288
285 2HE2 GLN 40 2HE2 GLN 40 5.007 -7.829 10.349
286 1HE2 GLN 40 1HE2 GLN 40 5.764 -9.323 10.789
287 HA PRO 41 HA PRO 41 6.085 -6.584 17.233
288 1HB PRO 41 1HB PRO 41 8.722 -7.432 17.496
289 2HB PRO 41 2HB PRO 41 7.334 -8.525 17.186
290 1HG PRO 41 2HG PRO 41 9.148 -7.231 15.152
291 2HG PRO 41 1HG PRO 41 8.870 -9.001 15.062
292 1HD PRO 41 1HD PRO 41 7.346 -7.587 13.512
293 2HD PRO 41 2HD PRO 41 6.446 -8.574 14.702
294 H GLY 42 H GLY 42 7.069 -5.148 18.843
295 1HA GLY 42 2HA GLY 42 8.154 -3.308 19.556
296 2HA GLY 42 1HA GLY 42 7.664 -2.609 18.025
297 H ASP 43 H ASP 43 9.914 -1.518 18.790
298 HA ASP 43 HA ASP 43 12.045 -1.233 18.466
299 1HB ASP 43 1HB ASP 43 11.908 -4.025 18.923
300 2HB ASP 43 2HB ASP 43 12.871 -3.871 17.467
301 H LYS 44 H LYS 44 11.190 -3.931 16.153
302 HA LYS 44 HA LYS 44 12.079 -2.190 13.968
303 1HB LYS 44 1HB LYS 44 13.094 -4.565 14.526
304 2HB LYS 44 2HB LYS 44 11.681 -5.149 13.670
305 1HG LYS 44 1HG LYS 44 12.372 -3.358 11.840
306 2HG LYS 44 2HG LYS 44 13.937 -3.414 12.627
307 1HD LYS 44 1HD LYS 44 12.560 -5.999 11.839
308 2HD LYS 44 2HD LYS 44 13.414 -5.066 10.626
309 1HE LYS 44 1HE LYS 44 15.480 -5.604 11.476
310 2HE LYS 44 2HE LYS 44 14.956 -5.424 13.139
311 1HZ LYS 44 1HZ LYS 44 14.340 -7.726 11.418
312 2HZ LYS 44 2HZ LYS 44 15.463 -7.702 12.604
313 3HZ LYS 44 3HZ LYS 44 13.880 -7.560 12.976
314 H GLN 45 H GLN 45 9.421 -2.198 15.477
315 HA GLN 45 HA GLN 45 7.455 -3.417 14.069
316 1HB GLN 45 1HB GLN 45 7.106 -2.176 16.178
317 2HB GLN 45 2HB GLN 45 7.414 -0.655 15.364
318 1HG GLN 45 1HG GLN 45 5.390 -0.742 14.136
319 2HG GLN 45 2HG GLN 45 5.243 -2.480 14.302
320 2HE2 GLN 45 2HE2 GLN 45 5.177 0.576 16.075
321 1HE2 GLN 45 1HE2 GLN 45 4.085 0.094 17.330
322 H TYR 46 H TYR 46 9.251 -0.464 13.341
323 HA TYR 46 HA TYR 46 7.691 -0.101 10.838
324 1HB TYR 46 1HB TYR 46 9.747 1.778 12.018
325 2HB TYR 46 2HB TYR 46 8.486 2.135 10.825
326 HD1 TYR 46 HD1 TYR 46 6.084 2.203 11.538
327 HD2 TYR 46 HD2 TYR 46 9.308 1.878 14.358
328 HE1 TYR 46 HE1 TYR 46 4.562 2.917 13.360
329 HE2 TYR 46 HE2 TYR 46 7.786 2.591 16.181
330 HH TYR 46 HH TYR 46 5.509 2.871 16.753
331 H ALA 47 H ALA 47 8.739 -1.944 9.720
332 HA ALA 47 HA ALA 47 11.493 -1.245 8.962
333 1HB ALA 47 1HB ALA 47 10.915 -3.387 10.473
334 2HB ALA 47 3HB ALA 47 10.561 -4.091 8.877
335 3HB ALA 47 2HB ALA 47 12.177 -3.428 9.218
336 H GLY 48 H GLY 48 11.902 -2.869 6.827
337 1HA GLY 48 2HA GLY 48 11.555 -2.806 4.592
338 2HA GLY 48 1HA GLY 48 10.229 -1.685 4.829
339 H CYS 49 H CYS 49 8.714 -2.688 3.460
340 HA CYS 49 HA CYS 49 7.410 -4.952 4.610
341 1HB CYS 49 1HB CYS 49 6.767 -3.667 1.959
342 2HB CYS 49 2HB CYS 49 5.710 -4.605 2.995
343 H THR 50 H THR 50 9.660 -4.195 1.952
344 HA THR 50 HA THR 50 9.380 -6.865 0.827
345 HB THR 50 HB THR 50 11.150 -5.816 -0.773
346 HG1 THR 50 HG1 THR 50 11.899 -4.004 0.301
347 1HG2 THR 50 1HG2 THR 50 8.480 -4.360 -0.389
348 2HG2 THR 50 2HG2 THR 50 9.503 -4.259 -1.842
349 3HG2 THR 50 3HG2 THR 50 8.733 -5.803 -1.401
350 H THR 51 H THR 51 10.473 -6.224 3.639
351 HA THR 51 HA THR 51 13.247 -6.794 3.531
352 HB THR 51 HB THR 51 11.242 -7.200 5.810
353 HG1 THR 51 HG1 THR 51 11.444 -4.945 6.012
354 1HG2 THR 51 1HG2 THR 51 14.197 -6.387 5.771
355 2HG2 THR 51 2HG2 THR 51 13.178 -6.549 7.221
356 3HG2 THR 51 3HG2 THR 51 13.594 -7.988 6.261
357 H ASP 52 H ASP 52 14.340 -8.738 4.288
358 HA ASP 52 HA ASP 52 13.566 -10.928 2.867
359 1HB ASP 52 1HB ASP 52 15.362 -12.066 3.939
360 2HB ASP 52 2HB ASP 52 15.838 -10.380 3.956
361 H GLY 53 H GLY 53 12.741 -13.075 3.634
362 1HA GLY 53 2HA GLY 53 11.845 -13.626 6.203
363 2HA GLY 53 1HA GLY 53 11.272 -14.375 4.727
364 H CYS 54 H CYS 54 10.512 -11.503 3.730
365 HA CYS 54 HA CYS 54 7.956 -11.481 5.144
366 1HB CYS 54 2HB CYS 54 9.408 -8.945 4.341
367 2HB CYS 54 1HB CYS 54 7.911 -9.079 5.243
368 H HIS 55 H HIS 55 7.764 -8.880 3.213
369 HA HIS 55 HA HIS 55 6.718 -10.452 1.016
370 1HB HIS 55 2HB HIS 55 6.494 -7.465 1.425
371 2HB HIS 55 1HB HIS 55 5.513 -8.485 0.392
372 HD1 HIS 55 HD1 HIS 55 3.914 -10.271 1.710
373 HD2 HIS 55 HD2 HIS 55 5.522 -7.133 3.983
374 HE1 HIS 55 HE1 HIS 55 2.519 -10.144 3.843
375 H ASN 56 H ASN 56 9.431 -10.718 1.031
376 HA ASN 56 HA ASN 56 10.552 -8.640 -0.589
377 1HB ASN 56 1HB ASN 56 11.889 -9.836 1.188
378 2HB ASN 56 2HB ASN 56 11.711 -11.336 0.299
379 2HD2 ASN 56 2HD2 ASN 56 14.123 -9.946 1.029
380 1HD2 ASN 56 1HD2 ASN 56 14.987 -9.566 -0.423
381 H ILE 57 H ILE 57 8.681 -9.262 -2.247
382 HA ILE 57 HA ILE 57 9.812 -11.243 -4.082
383 HB ILE 57 HB ILE 57 6.873 -10.967 -3.450
384 1HG1 ILE 57 1HG1 ILE 57 8.446 -12.002 -1.654
385 2HG1 ILE 57 2HG1 ILE 57 6.962 -12.825 -2.088
386 1HG2 ILE 57 1HG2 ILE 57 7.474 -11.621 -5.787
387 2HG2 ILE 57 2HG2 ILE 57 8.296 -13.052 -5.121
388 3HG2 ILE 57 3HG2 ILE 57 6.543 -12.847 -4.893
389 1HD1 ILE 57 1HD1 ILE 57 9.562 -13.460 -3.524
390 2HD1 ILE 57 2HD1 ILE 57 9.143 -14.238 -1.979
391 3HD1 ILE 57 3HD1 ILE 57 8.092 -14.457 -3.399
392 H LEU 58 H LEU 58 10.511 -10.072 -5.787
393 HA LEU 58 HA LEU 58 8.948 -7.708 -6.513
394 1HB LEU 58 2HB LEU 58 11.746 -8.532 -7.303
395 2HB LEU 58 1HB LEU 58 10.940 -7.049 -7.776
396 HG LEU 58 HG LEU 58 11.796 -7.852 -4.986
397 1HD1 LEU 58 1HD1 LEU 58 13.487 -6.973 -6.707
398 2HD1 LEU 58 2HD1 LEU 58 12.656 -5.409 -6.529
399 3HD1 LEU 58 3HD1 LEU 58 13.421 -6.176 -5.116
400 1HD2 LEU 58 1HD2 LEU 58 10.191 -5.440 -5.871
401 2HD2 LEU 58 2HD2 LEU 58 9.672 -6.741 -4.773
402 3HD2 LEU 58 3HD2 LEU 58 10.963 -5.620 -4.277
403 H ASP 59 H ASP 59 8.692 -10.861 -7.087
404 HA ASP 59 HA ASP 59 8.662 -10.670 -9.968
405 1HB ASP 59 1HB ASP 59 7.845 -13.171 -9.595
406 2HB ASP 59 2HB ASP 59 9.536 -12.753 -9.405
407 H LYS 60 H LYS 60 6.788 -9.006 -9.643
408 HA LYS 60 HA LYS 60 4.398 -9.511 -8.488
409 1HB LYS 60 1HB LYS 60 3.450 -7.920 -10.056
410 2HB LYS 60 2HB LYS 60 5.038 -7.390 -9.541
411 1HG LYS 60 1HG LYS 60 5.762 -8.828 -11.740
412 2HG LYS 60 2HG LYS 60 4.141 -8.377 -12.230
413 1HD LYS 60 1HD LYS 60 4.639 -6.102 -12.321
414 2HD LYS 60 2HD LYS 60 5.845 -6.199 -11.054
415 1HE LYS 60 1HE LYS 60 7.462 -7.236 -12.575
416 2HE LYS 60 2HE LYS 60 6.251 -7.406 -13.829
417 1HZ LYS 60 1HZ LYS 60 6.055 -4.916 -13.678
418 2HZ LYS 60 2HZ LYS 60 7.444 -4.935 -12.818
419 3HZ LYS 60 3HZ LYS 60 7.425 -5.497 -14.351
420 H ALA 61 H ALA 61 2.460 -10.578 -9.005
421 HA ALA 61 HA ALA 61 1.102 -11.996 -10.059
422 1HB ALA 61 1HB ALA 61 2.821 -12.680 -12.356
423 2HB ALA 61 3HB ALA 61 1.153 -12.058 -12.322
424 3HB ALA 61 2HB ALA 61 2.525 -10.933 -12.179
425 H ASP 62 H ASP 62 2.814 -12.779 -8.000
426 HA ASP 62 HA ASP 62 3.798 -15.354 -8.932
427 1HB ASP 62 1HB ASP 62 5.303 -13.681 -7.643
428 2HB ASP 62 2HB ASP 62 4.324 -14.037 -6.234
429 H LYS 63 H LYS 63 3.676 -16.993 -6.801
430 HA LYS 63 HA LYS 63 0.931 -16.750 -5.780
431 1HB LYS 63 1HB LYS 63 2.403 -19.235 -6.703
432 2HB LYS 63 2HB LYS 63 0.873 -19.252 -5.851
433 1HG LYS 63 1HG LYS 63 0.220 -17.484 -7.803
434 2HG LYS 63 2HG LYS 63 1.477 -18.356 -8.657
435 1HD LYS 63 1HD LYS 63 0.071 -20.091 -9.036
436 2HD LYS 63 2HD LYS 63 -0.188 -20.297 -7.315
437 1HE LYS 63 1HE LYS 63 -1.720 -18.038 -7.849
438 2HE LYS 63 2HE LYS 63 -1.904 -18.950 -9.334
439 1HZ LYS 63 1HZ LYS 63 -2.117 -20.676 -7.147
440 2HZ LYS 63 2HZ LYS 63 -3.139 -19.421 -6.928
441 3HZ LYS 63 3HZ LYS 63 -3.237 -20.327 -8.283
442 H SER 64 H SER 64 1.686 -15.656 -3.883
443 HA SER 64 HA SER 64 2.315 -17.395 -1.821
444 1HB SER 64 1HB SER 64 4.615 -16.581 -3.264
445 2HB SER 64 2HB SER 64 4.619 -15.595 -1.815
446 HG SER 64 HG SER 64 5.057 -18.344 -2.110
447 H VAL 65 H VAL 65 2.326 -16.247 0.285
448 HA VAL 65 HA VAL 65 0.823 -13.809 0.107
449 HB VAL 65 HB VAL 65 0.153 -15.458 1.688
450 1HG1 VAL 65 1HG1 VAL 65 3.053 -15.493 2.412
451 2HG1 VAL 65 2HG1 VAL 65 1.868 -15.805 3.703
452 3HG1 VAL 65 3HG1 VAL 65 1.894 -16.834 2.251
453 1HG2 VAL 65 1HG2 VAL 65 0.430 -12.847 2.307
454 2HG2 VAL 65 2HG2 VAL 65 -0.294 -14.042 3.409
455 3HG2 VAL 65 3HG2 VAL 65 1.409 -13.565 3.608
456 H ASN 66 H ASN 66 4.024 -14.423 -0.328
457 HA ASN 66 HA ASN 66 4.944 -12.260 1.345
458 1HB ASN 66 2HB ASN 66 6.504 -14.036 -0.604
459 2HB ASN 66 1HB ASN 66 7.210 -12.947 0.573
460 2HD2 ASN 66 2HD2 ASN 66 6.312 -13.273 2.870
461 1HD2 ASN 66 1HD2 ASN 66 6.256 -14.904 3.451
462 H SER 67 H SER 67 3.213 -12.312 -1.360
463 HA SER 67 HA SER 67 4.898 -10.974 -3.197
464 1HB SER 67 1HB SER 67 2.492 -10.473 -4.232
465 2HB SER 67 2HB SER 67 3.200 -12.074 -4.323
466 HG SER 67 HG SER 67 0.965 -12.077 -3.560
467 H TRP 68 H TRP 68 5.142 -8.750 -3.541
468 HA TRP 68 HA TRP 68 3.945 -7.050 -1.497
469 1HB TRP 68 1HB TRP 68 6.246 -6.751 -1.555
470 2HB TRP 68 2HB TRP 68 6.328 -6.839 -3.303
471 HD1 TRP 68 HD1 TRP 68 6.598 -4.510 -4.455
472 HE1 TRP 68 HE1 TRP 68 6.186 -1.965 -3.893
473 HE3 TRP 68 HE3 TRP 68 4.428 -5.319 0.072
474 HZ2 TRP 68 HZ2 TRP 68 5.025 -0.606 -1.668
475 HZ3 TRP 68 HZ3 TRP 68 3.683 -3.329 1.375
476 HH2 TRP 68 HH2 TRP 68 3.952 -1.035 0.573
477 H TYR 69 H TYR 69 2.761 -8.322 -4.069
478 HA TYR 69 HA TYR 69 1.707 -5.781 -5.221
479 1HB TYR 69 1HB TYR 69 3.087 -6.926 -6.848
480 2HB TYR 69 2HB TYR 69 2.257 -8.460 -6.536
481 HD1 TYR 69 HD1 TYR 69 -0.241 -8.613 -7.093
482 HD2 TYR 69 HD2 TYR 69 2.298 -5.442 -8.490
483 HE1 TYR 69 HE1 TYR 69 -1.877 -8.091 -8.883
484 HE2 TYR 69 HE2 TYR 69 0.662 -4.920 -10.280
485 HH TYR 69 HH TYR 69 -2.285 -5.560 -10.404
486 H LYS 70 H LYS 70 1.017 -8.564 -3.334
487 HA LYS 70 HA LYS 70 -1.759 -8.599 -4.249
488 1HB LYS 70 1HB LYS 70 -0.419 -10.733 -4.046
489 2HB LYS 70 2HB LYS 70 -0.391 -10.483 -2.312
490 1HG LYS 70 1HG LYS 70 -3.086 -10.126 -2.883
491 2HG LYS 70 2HG LYS 70 -2.636 -11.343 -4.060
492 1HD LYS 70 1HD LYS 70 -1.945 -11.574 -1.097
493 2HD LYS 70 2HD LYS 70 -3.420 -12.228 -1.781
494 1HE LYS 70 1HE LYS 70 -0.577 -12.984 -2.611
495 2HE LYS 70 2HE LYS 70 -1.665 -13.974 -1.656
496 1HZ LYS 70 1HZ LYS 70 -3.024 -13.249 -3.941
497 2HZ LYS 70 2HZ LYS 70 -1.541 -13.729 -4.427
498 3HZ LYS 70 3HZ LYS 70 -2.473 -14.733 -3.539
499 H VAL 71 H VAL 71 0.329 -8.070 -1.356
500 HA VAL 71 HA VAL 71 -1.805 -7.547 0.394
501 HB VAL 71 HB VAL 71 -0.066 -6.614 1.834
502 1HG1 VAL 71 1HG1 VAL 71 -0.400 -9.166 1.291
503 2HG1 VAL 71 2HG1 VAL 71 1.216 -9.015 0.561
504 3HG1 VAL 71 3HG1 VAL 71 0.978 -8.628 2.282
505 1HG2 VAL 71 1HG2 VAL 71 1.214 -5.959 -0.585
506 2HG2 VAL 71 2HG2 VAL 71 1.820 -5.698 1.068
507 3HG2 VAL 71 3HG2 VAL 71 2.248 -7.184 0.187
508 H VAL 72 H VAL 72 -0.736 -5.877 -2.361
509 HA VAL 72 HA VAL 72 -1.588 -3.298 -1.264
510 HB VAL 72 HB VAL 72 -0.082 -4.025 -3.784
511 1HG1 VAL 72 1HG1 VAL 72 -1.495 -2.037 -4.111
512 2HG1 VAL 72 2HG1 VAL 72 -0.773 -1.285 -2.668
513 3HG1 VAL 72 3HG1 VAL 72 0.234 -1.615 -4.099
514 1HG2 VAL 72 1HG2 VAL 72 0.877 -3.950 -1.211
515 2HG2 VAL 72 2HG2 VAL 72 1.849 -3.686 -2.679
516 3HG2 VAL 72 3HG2 VAL 72 1.202 -2.294 -1.777
517 H HIS 73 H HIS 73 -2.101 -5.633 -3.977
518 HA HIS 73 HA HIS 73 -4.596 -4.215 -4.539
519 1HB HIS 73 2HB HIS 73 -3.124 -6.198 -6.293
520 2HB HIS 73 1HB HIS 73 -4.523 -5.240 -6.736
521 HD1 HIS 73 HD1 HIS 73 -0.802 -4.999 -6.212
522 HD2 HIS 73 HD2 HIS 73 -3.992 -2.525 -7.353
523 HE1 HIS 73 HE1 HIS 73 0.245 -2.872 -7.155
524 H ASP 74 H ASP 74 -4.292 -5.924 -2.209
525 HA ASP 74 HA ASP 74 -5.436 -8.433 -2.941
526 1HB ASP 74 1HB ASP 74 -4.217 -7.200 -0.587
527 2HB ASP 74 2HB ASP 74 -5.715 -7.991 -0.138
528 H ALA 75 H ALA 75 -7.660 -8.995 -2.704
529 HA ALA 75 HA ALA 75 -9.403 -6.970 -1.503
530 1HB ALA 75 1HB ALA 75 -9.138 -7.476 -4.287
531 2HB ALA 75 3HB ALA 75 -10.676 -8.216 -3.781
532 3HB ALA 75 2HB ALA 75 -10.374 -6.489 -3.470
533 H LYS 76 H LYS 76 -8.138 -9.865 -1.066
534 HA LYS 76 HA LYS 76 -10.696 -11.220 -0.598
535 1HB LYS 76 1HB LYS 76 -8.822 -12.246 -2.062
536 2HB LYS 76 2HB LYS 76 -7.980 -12.532 -0.552
537 1HG LYS 76 1HG LYS 76 -10.238 -13.611 0.254
538 2HG LYS 76 2HG LYS 76 -10.660 -13.648 -1.446
539 1HD LYS 76 1HD LYS 76 -8.045 -14.813 -0.397
540 2HD LYS 76 2HD LYS 76 -9.517 -15.759 -0.489
541 1HE LYS 76 1HE LYS 76 -9.397 -14.595 -3.026
542 2HE LYS 76 2HE LYS 76 -7.706 -14.880 -2.665
543 1HZ LYS 76 1HZ LYS 76 -8.866 -17.151 -1.860
544 2HZ LYS 76 2HZ LYS 76 -9.783 -16.767 -3.156
545 3HZ LYS 76 3HZ LYS 76 -8.167 -16.933 -3.320
546 H GLY 77 H GLY 77 -10.444 -9.233 1.153
547 1HA GLY 77 2HA GLY 77 -10.695 -10.163 3.614
548 2HA GLY 77 1HA GLY 77 -9.925 -8.622 3.292
549 H GLY 78 H GLY 78 -9.469 -10.841 5.389
550 1HA GLY 78 2HA GLY 78 -6.558 -11.096 4.931
551 2HA GLY 78 1HA GLY 78 -7.527 -12.419 5.548
552 H ALA 79 H ALA 79 -5.568 -11.860 7.216
553 HA ALA 79 HA ALA 79 -6.717 -11.226 9.601
554 1HB ALA 79 1HB ALA 79 -4.675 -11.851 10.301
555 2HB ALA 79 3HB ALA 79 -3.930 -10.416 9.557
556 3HB ALA 79 2HB ALA 79 -4.160 -11.898 8.598
557 H LYS 80 H LYS 80 -5.693 -9.082 7.010
558 HA LYS 80 HA LYS 80 -6.799 -6.859 8.450
559 1HB LYS 80 1HB LYS 80 -4.545 -5.572 7.823
560 2HB LYS 80 2HB LYS 80 -4.805 -6.325 9.383
561 1HG LYS 80 1HG LYS 80 -3.659 -8.400 8.571
562 2HG LYS 80 2HG LYS 80 -3.394 -7.641 7.014
563 1HD LYS 80 1HD LYS 80 -2.263 -6.723 9.697
564 2HD LYS 80 2HD LYS 80 -1.360 -7.434 8.374
565 1HE LYS 80 1HE LYS 80 -2.053 -5.467 6.919
566 2HE LYS 80 2HE LYS 80 -2.807 -4.743 8.325
567 1HZ LYS 80 1HZ LYS 80 -0.025 -5.592 8.479
568 2HZ LYS 80 2HZ LYS 80 -0.394 -4.178 7.751
569 3HZ LYS 80 3HZ LYS 80 -0.790 -4.417 9.317
570 HA PRO 81 HA PRO 81 -7.831 -5.665 4.374
571 1HB PRO 81 1HB PRO 81 -8.041 -2.941 4.641
572 2HB PRO 81 2HB PRO 81 -9.161 -4.084 5.451
573 1HG PRO 81 2HG PRO 81 -6.879 -2.758 6.306
574 2HG PRO 81 1HG PRO 81 -8.310 -2.822 7.387
575 1HD PRO 81 1HD PRO 81 -6.160 -4.398 7.857
576 2HD PRO 81 2HD PRO 81 -7.807 -5.079 8.019
577 H THR 82 H THR 82 -7.137 -3.823 2.611
578 HA THR 82 HA THR 82 -4.223 -3.488 2.813
579 HB THR 82 HB THR 82 -4.151 -4.164 0.370
580 HG1 THR 82 HG1 THR 82 -6.852 -5.078 1.036
581 1HG2 THR 82 1HG2 THR 82 -4.602 -5.918 2.628
582 2HG2 THR 82 2HG2 THR 82 -5.494 -6.567 1.232
583 3HG2 THR 82 3HG2 THR 82 -3.740 -6.283 1.114
584 H CYS 83 H CYS 83 -3.907 -2.246 0.282
585 HA CYS 83 HA CYS 83 -4.835 0.347 1.015
586 1HB CYS 83 1HB CYS 83 -3.496 -0.303 -1.593
587 2HB CYS 83 2HB CYS 83 -3.435 1.177 -0.657
588 H ILE 84 H ILE 84 -6.316 -2.288 -0.400
589 HA ILE 84 HA ILE 84 -7.924 -0.594 -2.182
590 HB ILE 84 HB ILE 84 -7.131 -3.488 -2.313
591 1HG1 ILE 84 1HG1 ILE 84 -5.645 -1.907 -3.402
592 2HG1 ILE 84 2HG1 ILE 84 -6.473 -2.886 -4.597
593 1HG2 ILE 84 1HG2 ILE 84 -9.605 -2.195 -3.393
594 2HG2 ILE 84 2HG2 ILE 84 -8.772 -3.427 -4.371
595 3HG2 ILE 84 3HG2 ILE 84 -9.358 -3.832 -2.739
596 1HD1 ILE 84 1HD1 ILE 84 -8.241 -0.823 -4.446
597 2HD1 ILE 84 2HD1 ILE 84 -6.742 0.035 -4.016
598 3HD1 ILE 84 3HD1 ILE 84 -6.858 -0.832 -5.566
599 H SER 85 H SER 85 -7.953 -3.211 0.303
600 HA SER 85 HA SER 85 -10.646 -3.544 0.472
601 1HB SER 85 2HB SER 85 -9.040 -3.504 3.018
602 2HB SER 85 1HB SER 85 -10.221 -4.678 2.472
603 HG SER 85 HG SER 85 -8.407 -5.797 2.062
604 H CYS 86 H CYS 86 -8.584 -1.363 2.543
605 HA CYS 86 HA CYS 86 -10.738 -0.146 3.808
606 1HB CYS 86 1HB CYS 86 -8.261 -0.142 4.477
607 2HB CYS 86 2HB CYS 86 -8.054 1.172 3.335
608 H HIS 87 H HIS 87 -8.590 1.043 1.111
609 HA HIS 87 HA HIS 87 -9.872 3.359 0.553
610 1HB HIS 87 1HB HIS 87 -8.368 1.383 -1.136
611 2HB HIS 87 2HB HIS 87 -9.127 2.765 -1.901
612 HD1 HIS 87 HD1 HIS 87 -6.965 4.004 -2.493
613 HD2 HIS 87 HD2 HIS 87 -7.301 3.103 1.590
614 HE1 HIS 87 HE1 HIS 87 -5.090 5.279 -1.323
615 H LYS 88 H LYS 88 -10.856 0.022 -0.268
616 HA LYS 88 HA LYS 88 -12.844 0.709 -2.115
617 1HB LYS 88 1HB LYS 88 -12.123 -1.689 -0.490
618 2HB LYS 88 2HB LYS 88 -13.740 -1.630 -1.162
619 1HG LYS 88 1HG LYS 88 -11.400 -0.940 -2.950
620 2HG LYS 88 2HG LYS 88 -11.703 -2.625 -2.576
621 1HD LYS 88 1HD LYS 88 -13.659 -2.696 -3.804
622 2HD LYS 88 2HD LYS 88 -14.121 -1.062 -3.371
623 1HE LYS 88 2HE LYS 88 -13.590 -0.718 -5.608
624 2HE LYS 88 1HE LYS 88 -12.020 -0.402 -4.896
625 1HZ LYS 88 1HZ LYS 88 -11.779 -2.954 -5.211
626 2HZ LYS 88 2HZ LYS 88 -12.915 -2.736 -6.363
627 3HZ LYS 88 3HZ LYS 88 -11.495 -1.934 -6.454
628 H ASP 89 H ASP 89 -12.952 0.125 1.460
629 HA ASP 89 HA ASP 89 -15.645 0.455 1.750
630 1HB ASP 89 1HB ASP 89 -13.637 -0.110 3.438
631 2HB ASP 89 2HB ASP 89 -13.749 1.599 3.807
632 H LYS 90 H LYS 90 -12.941 2.831 1.580
633 HA LYS 90 HA LYS 90 -14.361 5.088 2.387
634 1HB LYS 90 1HB LYS 90 -11.792 4.477 1.080
635 2HB LYS 90 2HB LYS 90 -12.455 6.040 0.649
636 1HG LYS 90 2HG LYS 90 -11.959 5.005 3.479
637 2HG LYS 90 1HG LYS 90 -11.047 6.256 2.658
638 1HD LYS 90 1HD LYS 90 -13.535 7.331 2.418
639 2HD LYS 90 2HD LYS 90 -13.790 6.390 3.874
640 1HE LYS 90 1HE LYS 90 -11.823 7.485 4.947
641 2HE LYS 90 2HE LYS 90 -11.518 8.399 3.483
642 1HZ LYS 90 1HZ LYS 90 -14.154 8.812 4.111
643 2HZ LYS 90 2HZ LYS 90 -13.349 8.943 5.526
644 3HZ LYS 90 3HZ LYS 90 -12.927 9.880 4.257
645 H ALA 91 H ALA 91 -13.915 3.538 -0.839
646 HA ALA 91 HA ALA 91 -15.386 5.576 -2.183
647 1HB ALA 91 1HB ALA 91 -13.762 3.297 -2.822
648 2HB ALA 91 3HB ALA 91 -14.340 4.586 -3.905
649 3HB ALA 91 2HB ALA 91 -15.323 3.122 -3.659
650 H GLY 92 H GLY 92 -16.167 2.047 -2.166
651 1HA GLY 92 2HA GLY 92 -18.728 2.466 -0.923
652 2HA GLY 92 1HA GLY 92 -18.083 0.976 -1.581
653 H ASP 93 H ASP 93 -20.557 3.137 -1.944
654 HA ASP 93 HA ASP 93 -21.180 2.125 -4.499
655 1HB ASP 93 1HB ASP 93 -22.885 4.327 -3.917
656 2HB ASP 93 2HB ASP 93 -23.244 2.624 -3.714
657 H ASP 94 H ASP 94 -19.954 5.191 -3.089
658 HA ASP 94 HA ASP 94 -20.404 6.900 -5.148
659 1HB ASP 94 1HB ASP 94 -19.377 7.385 -2.859
660 2HB ASP 94 2HB ASP 94 -17.855 6.768 -3.472
661 H LYS 95 H LYS 95 -19.960 6.308 -7.302
662 HA LYS 95 HA LYS 95 -17.757 4.664 -7.978
663 1HB LYS 95 1HB LYS 95 -19.812 6.228 -9.533
664 2HB LYS 95 2HB LYS 95 -18.468 5.456 -10.349
665 1HG LYS 95 1HG LYS 95 -19.095 3.263 -9.336
666 2HG LYS 95 2HG LYS 95 -20.423 4.027 -8.485
667 1HD LYS 95 1HD LYS 95 -21.455 3.107 -10.414
668 2HD LYS 95 2HD LYS 95 -21.265 4.802 -10.819
669 1HE LYS 95 1HE LYS 95 -18.957 4.062 -11.856
670 2HE LYS 95 2HE LYS 95 -19.620 2.441 -11.793
671 1HZ LYS 95 1HZ LYS 95 -21.565 3.362 -13.007
672 2HZ LYS 95 2HZ LYS 95 -20.726 4.746 -13.228
673 3HZ LYS 95 3HZ LYS 95 -20.174 3.347 -13.864
674 H GLU 96 H GLU 96 -18.350 8.178 -7.793
675 HA GLU 96 HA GLU 96 -16.113 8.919 -9.275
676 1HB GLU 96 1HB GLU 96 -18.028 10.240 -7.403
677 2HB GLU 96 2HB GLU 96 -16.482 11.043 -7.588
678 1HG GLU 96 2HG GLU 96 -18.419 10.297 -9.826
679 2HG GLU 96 1HG GLU 96 -18.054 11.914 -9.259
680 H LEU 97 H LEU 97 -16.548 7.759 -5.976
681 HA LEU 97 HA LEU 97 -13.929 8.712 -5.175
682 1HB LEU 97 1HB LEU 97 -16.093 8.660 -3.759
683 2HB LEU 97 2HB LEU 97 -15.754 6.951 -3.566
684 HG LEU 97 HG LEU 97 -14.854 7.948 -1.656
685 1HD1 LEU 97 1HD1 LEU 97 -13.307 6.388 -2.920
686 2HD1 LEU 97 2HD1 LEU 97 -12.427 7.840 -3.453
687 3HD1 LEU 97 3HD1 LEU 97 -12.544 7.457 -1.719
688 1HD2 LEU 97 1HD2 LEU 97 -14.609 10.255 -3.295
689 2HD2 LEU 97 2HD2 LEU 97 -14.423 10.117 -1.530
690 3HD2 LEU 97 3HD2 LEU 97 -13.008 9.919 -2.592
691 H LYS 98 H LYS 98 -15.507 5.892 -6.542
692 HA LYS 98 HA LYS 98 -13.359 4.130 -5.747
693 1HB LYS 98 1HB LYS 98 -15.823 3.490 -5.895
694 2HB LYS 98 2HB LYS 98 -15.648 3.546 -7.638
695 1HG LYS 98 1HG LYS 98 -13.586 1.962 -7.275
696 2HG LYS 98 2HG LYS 98 -14.245 1.700 -5.672
697 1HD LYS 98 1HD LYS 98 -15.263 -0.034 -6.881
698 2HD LYS 98 2HD LYS 98 -16.506 1.200 -6.932
699 1HE LYS 98 2HE LYS 98 -16.315 0.417 -9.187
700 2HE LYS 98 1HE LYS 98 -15.495 1.966 -9.174
701 1HZ LYS 98 1HZ LYS 98 -13.653 0.018 -8.480
702 2HZ LYS 98 2HZ LYS 98 -14.439 -0.514 -9.809
703 3HZ LYS 98 3HZ LYS 98 -13.685 0.934 -9.831
704 H LYS 99 H LYS 99 -12.948 6.636 -7.455
705 HA LYS 99 HA LYS 99 -11.464 5.242 -9.546
706 1HB LYS 99 1HB LYS 99 -13.643 7.234 -9.942
707 2HB LYS 99 2HB LYS 99 -12.215 7.417 -10.940
708 1HG LYS 99 1HG LYS 99 -13.279 4.627 -10.677
709 2HG LYS 99 2HG LYS 99 -14.288 5.749 -11.568
710 1HD LYS 99 1HD LYS 99 -11.972 6.376 -12.765
711 2HD LYS 99 2HD LYS 99 -11.499 4.783 -12.211
712 1HE LYS 99 1HE LYS 99 -14.186 4.752 -13.416
713 2HE LYS 99 2HE LYS 99 -12.987 5.375 -14.532
714 1HZ LYS 99 1HZ LYS 99 -11.962 3.145 -13.186
715 2HZ LYS 99 2HZ LYS 99 -13.405 2.757 -13.845
716 3HZ LYS 99 3HZ LYS 99 -12.209 3.347 -14.788
717 H LYS 100 H LYS 100 -10.432 6.035 -7.084
718 HA LYS 100 HA LYS 100 -8.437 7.856 -7.957
719 1HB LYS 100 1HB LYS 100 -9.032 9.362 -5.823
720 2HB LYS 100 2HB LYS 100 -9.597 9.727 -7.441
721 1HG LYS 100 1HG LYS 100 -11.670 8.260 -6.871
722 2HG LYS 100 2HG LYS 100 -11.128 8.336 -5.206
723 1HD LYS 100 1HD LYS 100 -11.503 10.859 -6.868
724 2HD LYS 100 2HD LYS 100 -12.842 10.127 -6.006
725 1HE LYS 100 1HE LYS 100 -11.512 10.279 -3.867
726 2HE LYS 100 2HE LYS 100 -10.223 11.078 -4.746
727 1HZ LYS 100 1HZ LYS 100 -12.242 12.583 -5.451
728 2HZ LYS 100 2HZ LYS 100 -12.819 12.090 -4.005
729 3HZ LYS 100 3HZ LYS 100 -11.384 12.864 -4.091
730 H LEU 101 H LEU 101 -10.109 6.296 -5.155
731 HA LEU 101 HA LEU 101 -7.530 5.891 -3.889
732 1HB LEU 101 2HB LEU 101 -10.290 5.117 -2.939
733 2HB LEU 101 1HB LEU 101 -8.811 5.114 -1.998
734 HG LEU 101 HG LEU 101 -10.399 7.475 -2.992
735 1HD1 LEU 101 1HD1 LEU 101 -10.742 6.195 -0.730
736 2HD1 LEU 101 2HD1 LEU 101 -9.314 7.129 -0.220
737 3HD1 LEU 101 3HD1 LEU 101 -10.777 7.974 -0.779
738 1HD2 LEU 101 1HD2 LEU 101 -8.057 7.920 -3.562
739 2HD2 LEU 101 2HD2 LEU 101 -8.625 8.971 -2.243
740 3HD2 LEU 101 3HD2 LEU 101 -7.581 7.576 -1.882
741 H THR 102 H THR 102 -9.977 4.198 -5.804
742 HA THR 102 HA THR 102 -8.323 1.771 -5.581
743 HB THR 102 HB THR 102 -10.350 0.458 -5.577
744 HG1 THR 102 HG1 THR 102 -11.653 1.552 -7.076
745 1HG2 THR 102 1HG2 THR 102 -9.974 1.695 -3.376
746 2HG2 THR 102 2HG2 THR 102 -11.065 2.967 -3.975
747 3HG2 THR 102 3HG2 THR 102 -11.682 1.319 -3.706
748 H GLY 103 H GLY 103 -8.974 4.345 -7.496
749 1HA GLY 103 2HA GLY 103 -8.745 4.729 -9.697
750 2HA GLY 103 1HA GLY 103 -9.765 3.328 -9.954
751 H CYS 104 H CYS 104 -8.848 1.899 -11.354
752 HA CYS 104 HA CYS 104 -6.319 0.791 -10.779
753 1HB CYS 104 1HB CYS 104 -8.440 0.405 -12.814
754 2HB CYS 104 2HB CYS 104 -6.822 -0.070 -13.291
755 H LYS 105 H LYS 105 -7.647 3.049 -13.287
756 HA LYS 105 HA LYS 105 -4.878 3.867 -13.819
757 1HB LYS 105 1HB LYS 105 -5.522 2.614 -15.727
758 2HB LYS 105 2HB LYS 105 -7.120 3.332 -15.772
759 1HG LYS 105 1HG LYS 105 -5.717 5.613 -16.002
760 2HG LYS 105 2HG LYS 105 -4.475 4.530 -16.597
761 1HD LYS 105 1HD LYS 105 -7.203 4.078 -17.734
762 2HD LYS 105 2HD LYS 105 -6.462 5.607 -18.165
763 1HE LYS 105 1HE LYS 105 -4.378 4.318 -18.873
764 2HE LYS 105 2HE LYS 105 -5.258 2.830 -18.586
765 1HZ LYS 105 1HZ LYS 105 -6.931 3.664 -20.170
766 2HZ LYS 105 2HZ LYS 105 -5.958 4.930 -20.515
767 3HZ LYS 105 3HZ LYS 105 -5.468 3.408 -20.849
768 H GLY 106 H GLY 106 -4.474 6.015 -13.565
769 1HA GLY 106 2HA GLY 106 -6.521 7.988 -13.940
770 2HA GLY 106 1HA GLY 106 -4.869 8.241 -13.413
771 H SER 107 H SER 107 -4.736 6.561 -11.123
772 HA SER 107 HA SER 107 -6.818 7.735 -9.453
773 1HB SER 107 2HB SER 107 -6.477 5.862 -7.907
774 2HB SER 107 1HB SER 107 -6.821 5.250 -9.513
775 HG SER 107 HG SER 107 -5.043 4.106 -8.577
776 H ALA 108 H ALA 108 -5.899 7.847 -6.991
777 HA ALA 108 HA ALA 108 -3.810 9.748 -7.091
778 1HB ALA 108 1HB ALA 108 -4.072 9.687 -4.606
779 2HB ALA 108 3HB ALA 108 -5.169 8.297 -4.785
780 3HB ALA 108 2HB ALA 108 -5.621 9.881 -5.461
781 H CYS 109 H CYS 109 -3.799 6.362 -7.301
782 HA CYS 109 HA CYS 109 -1.222 6.164 -5.949
783 1HB CYS 109 1HB CYS 109 -3.150 4.023 -6.901
784 2HB CYS 109 2HB CYS 109 -1.559 3.685 -6.248
785 H HIS 110 H HIS 110 -2.975 5.523 -9.055
786 HA HIS 110 HA HIS 110 -0.352 5.482 -10.363
787 1HB HIS 110 2HB HIS 110 -2.895 4.064 -11.206
788 2HB HIS 110 1HB HIS 110 -1.385 4.065 -12.097
789 HD1 HIS 110 HD1 HIS 110 0.711 3.387 -10.052
790 HD2 HIS 110 HD2 HIS 110 -3.090 1.614 -10.035
791 HE1 HIS 110 HE1 HIS 110 0.952 1.191 -8.775
792 HA PRO 111 HA PRO 111 -2.476 9.129 -12.033
793 1HB PRO 111 1HB PRO 111 -0.644 11.002 -11.398
794 2HB PRO 111 2HB PRO 111 -1.682 10.278 -10.127
795 1HG PRO 111 2HG PRO 111 0.922 9.597 -11.135
796 2HG PRO 111 1HG PRO 111 0.870 9.626 -9.342
797 1HD PRO 111 1HD PRO 111 0.838 7.273 -10.669
798 2HD PRO 111 2HD PRO 111 -0.269 7.514 -9.283
799 H SER 112 H SER 112 -1.848 7.615 -14.014
800 HA SER 112 HA SER 112 -0.344 9.206 -15.734
801 1HB SER 112 1HB SER 112 1.299 7.576 -14.189
802 2HB SER 112 2HB SER 112 1.074 6.608 -15.633
803 HG SER 112 HG SER 112 1.795 8.428 -16.915
No H/Q in entry = 803
Start of MODEL 20
1 H1 VAL 1 H1 VAL 1 7.604 8.506 17.740
2 H2 VAL 1 H2 VAL 1 8.453 7.221 18.349
3 H3 VAL 1 H3 VAL 1 8.867 8.766 18.780
4 HA VAL 1 HA VAL 1 10.415 8.523 17.289
5 HB VAL 1 HB VAL 1 10.224 6.268 16.845
6 1HG1 VAL 1 1HG1 VAL 1 7.437 6.870 15.834
7 2HG1 VAL 1 2HG1 VAL 1 8.252 5.321 15.509
8 3HG1 VAL 1 3HG1 VAL 1 7.931 5.822 17.186
9 1HG2 VAL 1 1HG2 VAL 1 11.144 7.461 14.908
10 2HG2 VAL 1 2HG2 VAL 1 10.264 5.998 14.403
11 3HG2 VAL 1 3HG2 VAL 1 9.513 7.600 14.209
12 H ASP 2 H ASP 2 7.215 9.584 16.990
13 HA ASP 2 HA ASP 2 6.266 11.172 15.862
14 1HB ASP 2 1HB ASP 2 9.082 11.811 14.862
15 2HB ASP 2 2HB ASP 2 7.695 12.858 14.637
16 H VAL 3 H VAL 3 4.978 10.656 14.088
17 HA VAL 3 HA VAL 3 5.696 8.815 12.165
18 HB VAL 3 HB VAL 3 3.422 9.930 12.949
19 1HG1 VAL 3 1HG1 VAL 3 4.056 12.127 11.875
20 2HG1 VAL 3 2HG1 VAL 3 3.878 11.325 10.295
21 3HG1 VAL 3 3HG1 VAL 3 2.477 11.469 11.383
22 1HG2 VAL 3 1HG2 VAL 3 4.025 8.711 10.241
23 2HG2 VAL 3 2HG2 VAL 3 3.451 7.893 11.714
24 3HG2 VAL 3 3HG2 VAL 3 2.373 9.003 10.834
25 HA PRO 4 HA PRO 4 8.827 10.815 9.800
26 1HB PRO 4 1HB PRO 4 7.523 9.063 7.689
27 2HB PRO 4 2HB PRO 4 9.250 9.283 8.119
28 1HG PRO 4 1HG PRO 4 8.070 7.056 9.170
29 2HG PRO 4 2HG PRO 4 9.261 8.108 10.002
30 1HD PRO 4 2HD PRO 4 6.232 7.943 10.294
31 2HD PRO 4 1HD PRO 4 7.476 8.195 11.555
32 H ALA 5 H ALA 5 8.907 12.181 7.739
33 HA ALA 5 HA ALA 5 6.457 13.697 7.580
34 1HB ALA 5 1HB ALA 5 8.800 14.672 7.750
35 2HB ALA 5 3HB ALA 5 9.072 14.106 6.084
36 3HB ALA 5 2HB ALA 5 7.805 15.310 6.419
37 H ASP 6 H ASP 6 5.298 14.112 5.595
38 HA ASP 6 HA ASP 6 4.829 11.847 4.126
39 1HB ASP 6 1HB ASP 6 3.283 13.152 2.941
40 2HB ASP 6 2HB ASP 6 3.460 14.074 4.421
41 H GLY 7 H GLY 7 4.759 12.838 1.371
42 1HA GLY 7 2HA GLY 7 7.278 13.825 0.527
43 2HA GLY 7 1HA GLY 7 6.030 13.102 -0.469
44 H ALA 8 H ALA 8 5.961 10.577 1.210
45 HA ALA 8 HA ALA 8 8.597 9.476 1.003
46 1HB ALA 8 1HB ALA 8 6.352 8.958 2.513
47 2HB ALA 8 2HB ALA 8 6.294 7.647 1.310
48 3HB ALA 8 3HB ALA 8 7.736 7.853 2.333
49 H LYS 9 H LYS 9 9.441 8.191 -0.618
50 HA LYS 9 HA LYS 9 7.711 7.892 -2.969
51 1HB LYS 9 1HB LYS 9 10.701 8.241 -2.681
52 2HB LYS 9 2HB LYS 9 9.962 7.673 -4.165
53 1HG LYS 9 1HG LYS 9 8.939 10.200 -2.830
54 2HG LYS 9 2HG LYS 9 10.376 10.258 -3.831
55 1HD LYS 9 1HD LYS 9 8.552 8.766 -5.374
56 2HD LYS 9 2HD LYS 9 7.553 10.000 -4.632
57 1HE LYS 9 1HE LYS 9 9.226 11.746 -5.418
58 2HE LYS 9 2HE LYS 9 10.091 10.479 -6.265
59 1HZ LYS 9 1HZ LYS 9 7.255 10.657 -6.768
60 2HZ LYS 9 2HZ LYS 9 8.178 11.859 -7.377
61 3HZ LYS 9 3HZ LYS 9 8.475 10.308 -7.796
62 H ILE 10 H ILE 10 7.173 5.878 -3.669
63 HA ILE 10 HA ILE 10 8.627 3.655 -2.413
64 HB ILE 10 HB ILE 10 5.706 3.713 -3.167
65 1HG1 ILE 10 1HG1 ILE 10 6.669 3.707 -0.327
66 2HG1 ILE 10 2HG1 ILE 10 6.596 5.228 -1.194
67 1HG2 ILE 10 1HG2 ILE 10 7.449 1.567 -2.726
68 2HG2 ILE 10 2HG2 ILE 10 6.515 1.732 -1.220
69 3HG2 ILE 10 3HG2 ILE 10 5.670 1.528 -2.773
70 1HD1 ILE 10 1HD1 ILE 10 4.259 3.275 -0.984
71 2HD1 ILE 10 2HD1 ILE 10 4.480 4.699 0.062
72 3HD1 ILE 10 3HD1 ILE 10 4.216 4.910 -1.686
73 H ASP 11 H ASP 11 9.756 2.444 -3.829
74 HA ASP 11 HA ASP 11 8.604 1.783 -6.325
75 1HB ASP 11 1HB ASP 11 9.467 3.896 -7.078
76 2HB ASP 11 2HB ASP 11 10.951 3.707 -6.165
77 H PHE 12 H PHE 12 9.003 -0.404 -5.651
78 HA PHE 12 HA PHE 12 11.834 -1.065 -5.232
79 1HB PHE 12 1HB PHE 12 9.218 -2.413 -4.324
80 2HB PHE 12 2HB PHE 12 10.815 -3.041 -3.969
81 HD1 PHE 12 HD1 PHE 12 12.376 -0.888 -3.019
82 HD2 PHE 12 HD2 PHE 12 8.221 -1.534 -2.452
83 HE1 PHE 12 HE1 PHE 12 12.449 0.486 -0.919
84 HE2 PHE 12 HE2 PHE 12 8.294 -0.161 -0.352
85 HZ PHE 12 HZ PHE 12 10.407 0.833 0.389
86 H ILE 13 H ILE 13 8.873 -1.626 -7.071
87 HA ILE 13 HA ILE 13 10.084 -3.947 -8.363
88 HB ILE 13 HB ILE 13 7.294 -2.797 -8.474
89 1HG1 ILE 13 1HG1 ILE 13 8.124 -5.451 -7.303
90 2HG1 ILE 13 2HG1 ILE 13 8.168 -3.984 -6.346
91 1HG2 ILE 13 1HG2 ILE 13 8.655 -4.564 -10.295
92 2HG2 ILE 13 2HG2 ILE 13 7.331 -5.428 -9.478
93 3HG2 ILE 13 3HG2 ILE 13 6.997 -3.920 -10.363
94 1HD1 ILE 13 1HD1 ILE 13 5.650 -4.327 -7.881
95 2HD1 ILE 13 2HD1 ILE 13 5.942 -5.587 -6.658
96 3HD1 ILE 13 3HD1 ILE 13 5.891 -3.874 -6.177
97 H ALA 14 H ALA 14 11.591 -3.287 -9.838
98 HA ALA 14 HA ALA 14 11.165 -0.885 -11.350
99 1HB ALA 14 1HB ALA 14 13.293 -3.051 -11.299
100 2HB ALA 14 2HB ALA 14 13.407 -1.383 -10.690
101 3HB ALA 14 3HB ALA 14 13.333 -1.687 -12.442
102 H GLY 15 H GLY 15 9.248 -1.203 -12.561
103 1HA GLY 15 2HA GLY 15 8.286 -3.301 -13.885
104 2HA GLY 15 1HA GLY 15 9.625 -2.859 -14.925
105 H GLY 16 H GLY 16 6.881 -2.739 -15.748
106 1HA GLY 16 2HA GLY 16 5.775 -0.150 -15.483
107 2HA GLY 16 1HA GLY 16 5.361 -1.364 -16.677
108 H GLU 17 H GLU 17 5.288 1.155 -17.620
109 HA GLU 17 HA GLU 17 6.771 1.191 -19.805
110 1HB GLU 17 1HB GLU 17 5.313 3.188 -18.239
111 2HB GLU 17 2HB GLU 17 6.657 3.925 -19.089
112 1HG GLU 17 1HG GLU 17 4.433 2.235 -20.320
113 2HG GLU 17 2HG GLU 17 4.677 3.957 -20.535
114 H LYS 18 H LYS 18 7.748 2.675 -16.644
115 HA LYS 18 HA LYS 18 10.518 2.321 -17.448
116 1HB LYS 18 1HB LYS 18 11.017 4.677 -16.635
117 2HB LYS 18 2HB LYS 18 10.261 4.529 -18.208
118 1HG LYS 18 1HG LYS 18 8.016 4.944 -17.143
119 2HG LYS 18 2HG LYS 18 8.807 5.151 -15.594
120 1HD LYS 18 1HD LYS 18 10.279 6.934 -16.963
121 2HD LYS 18 2HD LYS 18 8.879 6.949 -18.017
122 1HE LYS 18 1HE LYS 18 7.665 7.118 -15.538
123 2HE LYS 18 2HE LYS 18 9.163 7.974 -15.231
124 1HZ LYS 18 1HZ LYS 18 7.817 8.630 -17.692
125 2HZ LYS 18 2HZ LYS 18 7.068 9.106 -16.322
126 3HZ LYS 18 3HZ LYS 18 8.591 9.605 -16.635
127 H ASN 19 H ASN 19 8.174 3.438 -14.923
128 HA ASN 19 HA ASN 19 8.832 1.540 -13.116
129 1HB ASN 19 1HB ASN 19 10.235 2.913 -11.458
130 2HB ASN 19 2HB ASN 19 11.096 2.372 -12.885
131 2HD2 ASN 19 2HD2 ASN 19 12.328 4.290 -11.770
132 1HD2 ASN 19 1HD2 ASN 19 12.098 5.842 -12.505
133 H LEU 20 H LEU 20 6.789 1.668 -12.162
134 HA LEU 20 HA LEU 20 5.448 4.176 -11.938
135 1HB LEU 20 1HB LEU 20 4.791 1.355 -11.108
136 2HB LEU 20 2HB LEU 20 3.742 2.711 -10.744
137 HG LEU 20 HG LEU 20 4.443 1.543 -13.432
138 1HD1 LEU 20 1HD1 LEU 20 2.468 0.815 -11.877
139 2HD1 LEU 20 2HD1 LEU 20 1.696 2.295 -12.496
140 3HD1 LEU 20 3HD1 LEU 20 2.210 1.020 -13.626
141 1HD2 LEU 20 1HD2 LEU 20 3.406 4.312 -12.839
142 2HD2 LEU 20 2HD2 LEU 20 4.731 3.814 -13.919
143 3HD2 LEU 20 3HD2 LEU 20 3.041 3.476 -14.368
144 H THR 21 H THR 21 5.760 5.651 -10.368
145 HA THR 21 HA THR 21 6.826 4.661 -7.807
146 HB THR 21 HB THR 21 6.989 7.550 -8.668
147 HG1 THR 21 HG1 THR 21 8.635 5.300 -9.589
148 1HG2 THR 21 1HG2 THR 21 8.465 5.617 -6.939
149 2HG2 THR 21 2HG2 THR 21 9.506 6.664 -7.933
150 3HG2 THR 21 3HG2 THR 21 8.339 7.387 -6.800
151 H VAL 22 H VAL 22 5.419 4.543 -6.186
152 HA VAL 22 HA VAL 22 3.061 6.270 -6.350
153 HB VAL 22 HB VAL 22 3.649 3.704 -4.869
154 1HG1 VAL 22 1HG1 VAL 22 1.582 5.765 -4.400
155 2HG1 VAL 22 2HG1 VAL 22 0.968 4.100 -4.544
156 3HG1 VAL 22 3HG1 VAL 22 2.203 4.491 -3.323
157 1HG2 VAL 22 1HG2 VAL 22 2.405 4.376 -7.427
158 2HG2 VAL 22 2HG2 VAL 22 2.961 2.805 -6.801
159 3HG2 VAL 22 3HG2 VAL 22 1.338 3.405 -6.384
160 H VAL 23 H VAL 23 2.519 7.693 -4.674
161 HA VAL 23 HA VAL 23 4.697 8.124 -2.756
162 HB VAL 23 HB VAL 23 2.602 9.986 -3.891
163 1HG1 VAL 23 1HG1 VAL 23 4.723 10.457 -1.775
164 2HG1 VAL 23 2HG1 VAL 23 3.886 11.763 -2.647
165 3HG1 VAL 23 3HG1 VAL 23 2.960 10.645 -1.616
166 1HG2 VAL 23 1HG2 VAL 23 5.601 9.765 -4.290
167 2HG2 VAL 23 2HG2 VAL 23 4.319 9.573 -5.510
168 3HG2 VAL 23 3HG2 VAL 23 4.635 11.172 -4.794
169 H PHE 24 H PHE 24 4.141 8.610 -0.529
170 HA PHE 24 HA PHE 24 1.395 7.965 0.203
171 1HB PHE 24 1HB PHE 24 2.809 5.870 0.292
172 2HB PHE 24 2HB PHE 24 3.991 6.707 1.278
173 HD1 PHE 24 HD1 PHE 24 0.349 5.879 1.303
174 HD2 PHE 24 HD2 PHE 24 3.898 6.419 3.565
175 HE1 PHE 24 HE1 PHE 24 -0.861 5.145 3.376
176 HE2 PHE 24 HE2 PHE 24 2.689 5.685 5.638
177 HZ PHE 24 HZ PHE 24 0.324 5.056 5.519
178 H ASN 25 H ASN 25 0.704 8.927 2.167
179 HA ASN 25 HA ASN 25 2.712 10.656 3.382
180 1HB ASN 25 1HB ASN 25 -0.093 11.608 3.576
181 2HB ASN 25 2HB ASN 25 1.353 12.508 3.163
182 2HD2 ASN 25 2HD2 ASN 25 -1.524 11.302 2.055
183 1HD2 ASN 25 1HD2 ASN 25 -1.265 11.356 0.343
184 H HIS 26 H HIS 26 2.874 10.268 5.603
185 HA HIS 26 HA HIS 26 1.109 8.388 6.790
186 1HB HIS 26 1HB HIS 26 3.605 9.814 7.521
187 2HB HIS 26 2HB HIS 26 2.577 9.352 8.863
188 HD1 HIS 26 HD1 HIS 26 4.686 7.890 6.097
189 HD2 HIS 26 HD2 HIS 26 2.410 6.580 9.368
190 HE1 HIS 26 HE1 HIS 26 5.258 5.424 6.425
191 H SER 27 H SER 27 1.105 11.823 6.334
192 HA SER 27 HA SER 27 -0.496 12.285 8.673
193 1HB SER 27 1HB SER 27 -0.527 14.660 7.813
194 2HB SER 27 2HB SER 27 1.080 14.024 8.104
195 HG SER 27 HG SER 27 1.082 15.068 6.078
196 H THR 28 H THR 28 -1.240 10.580 6.127
197 HA THR 28 HA THR 28 -3.733 12.009 5.484
198 HB THR 28 HB THR 28 -2.081 9.920 3.974
199 HG1 THR 28 HG1 THR 28 -2.960 12.686 3.520
200 1HG2 THR 28 1HG2 THR 28 -4.786 10.013 3.755
201 2HG2 THR 28 2HG2 THR 28 -4.384 11.418 2.739
202 3HG2 THR 28 3HG2 THR 28 -3.738 9.811 2.331
203 H HIS 29 H HIS 29 -2.290 8.940 6.627
204 HA HIS 29 HA HIS 29 -5.000 7.944 7.049
205 1HB HIS 29 1HB HIS 29 -2.349 6.483 7.205
206 2HB HIS 29 2HB HIS 29 -3.937 5.759 7.369
207 HD1 HIS 29 HD1 HIS 29 -1.698 7.411 4.779
208 HD2 HIS 29 HD2 HIS 29 -5.229 5.154 4.976
209 HE1 HIS 29 HE1 HIS 29 -2.271 6.768 2.377
210 H LYS 30 H LYS 30 -3.617 10.133 8.624
211 HA LYS 30 HA LYS 30 -2.683 9.180 11.045
212 1HB LYS 30 2HB LYS 30 -3.077 11.403 11.874
213 2HB LYS 30 1HB LYS 30 -2.494 11.509 10.225
214 1HG LYS 30 1HG LYS 30 -4.791 11.850 9.385
215 2HG LYS 30 2HG LYS 30 -5.450 11.601 10.990
216 1HD LYS 30 1HD LYS 30 -3.502 13.621 11.343
217 2HD LYS 30 2HD LYS 30 -4.274 14.026 9.822
218 1HE LYS 30 2HE LYS 30 -5.720 15.093 11.311
219 2HE LYS 30 1HE LYS 30 -6.525 13.544 11.161
220 1HZ LYS 30 1HZ LYS 30 -5.232 12.844 13.135
221 2HZ LYS 30 2HZ LYS 30 -4.721 14.385 13.316
222 3HZ LYS 30 3HZ LYS 30 -6.311 14.033 13.434
223 H ASP 31 H ASP 31 -5.888 9.115 9.659
224 HA ASP 31 HA ASP 31 -7.160 8.901 12.208
225 1HB ASP 31 1HB ASP 31 -8.539 9.896 10.565
226 2HB ASP 31 2HB ASP 31 -8.023 8.785 9.313
227 H VAL 32 H VAL 32 -5.175 6.907 10.420
228 HA VAL 32 HA VAL 32 -6.672 4.485 11.154
229 HB VAL 32 HB VAL 32 -4.562 4.832 9.016
230 1HG1 VAL 32 1HG1 VAL 32 -6.394 2.512 9.709
231 2HG1 VAL 32 2HG1 VAL 32 -5.366 2.601 8.258
232 3HG1 VAL 32 3HG1 VAL 32 -4.622 2.567 9.875
233 1HG2 VAL 32 1HG2 VAL 32 -7.002 5.926 8.817
234 2HG2 VAL 32 2HG2 VAL 32 -6.163 5.189 7.431
235 3HG2 VAL 32 3HG2 VAL 32 -7.405 4.268 8.313
236 H LYS 33 H LYS 33 -5.727 3.062 12.571
237 HA LYS 33 HA LYS 33 -3.653 3.929 14.179
238 1HB LYS 33 1HB LYS 33 -4.712 1.128 13.701
239 2HB LYS 33 2HB LYS 33 -3.643 1.579 15.014
240 1HG LYS 33 1HG LYS 33 -6.200 3.146 14.603
241 2HG LYS 33 2HG LYS 33 -6.286 1.569 15.361
242 1HD LYS 33 1HD LYS 33 -4.247 2.566 16.823
243 2HD LYS 33 2HD LYS 33 -4.978 4.091 16.365
244 1HE LYS 33 1HE LYS 33 -7.027 3.595 17.463
245 2HE LYS 33 2HE LYS 33 -6.728 1.868 17.456
246 1HZ LYS 33 1HZ LYS 33 -4.655 2.860 18.856
247 2HZ LYS 33 2HZ LYS 33 -5.885 3.821 19.333
248 3HZ LYS 33 3HZ LYS 33 -6.001 2.201 19.503
249 H CYS 34 H CYS 34 -1.486 2.841 14.498
250 HA CYS 34 HA CYS 34 -0.110 2.925 12.014
251 1HB CYS 34 1HB CYS 34 1.041 2.053 14.661
252 2HB CYS 34 2HB CYS 34 1.883 2.736 13.284
253 H ASP 35 H ASP 35 -1.042 0.433 14.462
254 HA ASP 35 HA ASP 35 0.329 -1.660 13.280
255 1HB ASP 35 1HB ASP 35 -1.319 -3.101 14.559
256 2HB ASP 35 2HB ASP 35 -0.514 -1.886 15.533
257 H ASP 36 H ASP 36 -2.321 0.200 12.176
258 HA ASP 36 HA ASP 36 -3.957 -1.735 11.064
259 1HB ASP 36 1HB ASP 36 -4.193 0.899 11.339
260 2HB ASP 36 2HB ASP 36 -3.472 0.951 9.743
261 H CYS 37 H CYS 37 -0.754 -0.616 10.285
262 HA CYS 37 HA CYS 37 -0.915 -2.014 7.720
263 1HB CYS 37 1HB CYS 37 0.478 0.625 8.262
264 2HB CYS 37 2HB CYS 37 0.796 -0.363 6.850
265 H HIS 38 H HIS 38 1.185 -0.652 10.354
266 HA HIS 38 HA HIS 38 3.309 -2.440 9.741
267 1HB HIS 38 1HB HIS 38 2.825 -0.653 12.141
268 2HB HIS 38 2HB HIS 38 4.315 -1.515 11.814
269 HD1 HIS 38 HD1 HIS 38 5.601 -0.786 9.521
270 HD2 HIS 38 HD2 HIS 38 2.608 1.805 10.908
271 HE1 HIS 38 HE1 HIS 38 5.984 1.445 8.342
272 H HIS 39 H HIS 39 1.386 -4.211 9.799
273 HA HIS 39 HA HIS 39 0.475 -5.119 12.240
274 1HB HIS 39 2HB HIS 39 -0.167 -7.088 11.101
275 2HB HIS 39 1HB HIS 39 -0.323 -5.773 9.953
276 HD1 HIS 39 HD1 HIS 39 1.525 -8.956 10.575
277 HD2 HIS 39 HD2 HIS 39 1.628 -5.776 7.841
278 HE1 HIS 39 HE1 HIS 39 2.968 -9.739 8.622
279 H GLN 40 H GLN 40 3.305 -6.333 10.300
280 HA GLN 40 HA GLN 40 4.338 -7.365 12.824
281 1HB GLN 40 1HB GLN 40 3.813 -9.006 10.924
282 2HB GLN 40 2HB GLN 40 5.130 -8.275 10.028
283 1HG GLN 40 1HG GLN 40 6.588 -8.747 12.144
284 2HG GLN 40 2HG GLN 40 5.280 -9.792 12.660
285 2HE2 GLN 40 2HE2 GLN 40 6.464 -11.651 12.519
286 1HE2 GLN 40 1HE2 GLN 40 6.952 -12.381 11.025
287 HA PRO 41 HA PRO 41 7.539 -4.344 12.208
288 1HB PRO 41 1HB PRO 41 8.670 -4.478 14.629
289 2HB PRO 41 2HB PRO 41 6.953 -3.976 14.484
290 1HG PRO 41 1HG PRO 41 7.694 -6.956 15.449
291 2HG PRO 41 2HG PRO 41 6.728 -5.481 15.776
292 1HD PRO 41 1HD PRO 41 6.142 -7.737 13.982
293 2HD PRO 41 2HD PRO 41 5.118 -6.314 14.341
294 H GLY 42 H GLY 42 9.315 -4.794 10.908
295 1HA GLY 42 2HA GLY 42 11.084 -5.896 10.059
296 2HA GLY 42 1HA GLY 42 10.500 -7.358 10.827
297 H ASP 43 H ASP 43 12.456 -4.390 11.294
298 HA ASP 43 HA ASP 43 14.100 -5.868 13.108
299 1HB ASP 43 1HB ASP 43 15.534 -3.797 13.021
300 2HB ASP 43 2HB ASP 43 15.214 -4.493 11.445
301 H LYS 44 H LYS 44 11.763 -3.153 13.049
302 HA LYS 44 HA LYS 44 11.630 -3.249 15.940
303 1HB LYS 44 1HB LYS 44 11.795 -0.758 16.105
304 2HB LYS 44 2HB LYS 44 13.300 -1.566 15.718
305 1HG LYS 44 1HG LYS 44 12.686 -1.124 13.218
306 2HG LYS 44 2HG LYS 44 11.481 -0.013 13.838
307 1HD LYS 44 1HD LYS 44 14.429 0.140 14.612
308 2HD LYS 44 2HD LYS 44 13.754 1.024 13.258
309 1HE LYS 44 1HE LYS 44 12.125 1.388 15.678
310 2HE LYS 44 2HE LYS 44 13.792 1.848 15.963
311 1HZ LYS 44 1HZ LYS 44 12.397 2.757 13.562
312 2HZ LYS 44 2HZ LYS 44 12.223 3.553 14.978
313 3HZ LYS 44 3HZ LYS 44 13.700 3.415 14.295
314 H GLN 45 H GLN 45 9.755 -1.602 16.624
315 HA GLN 45 HA GLN 45 7.449 -2.553 15.786
316 1HB GLN 45 1HB GLN 45 7.606 -0.983 17.640
317 2HB GLN 45 2HB GLN 45 8.073 0.324 16.570
318 1HG GLN 45 1HG GLN 45 5.878 0.856 16.371
319 2HG GLN 45 2HG GLN 45 5.652 -0.630 15.471
320 2HE2 GLN 45 2HE2 GLN 45 3.499 -0.022 16.623
321 1HE2 GLN 45 1HE2 GLN 45 3.180 -0.854 18.108
322 H TYR 46 H TYR 46 9.455 -0.226 14.098
323 HA TYR 46 HA TYR 46 7.541 -0.280 11.814
324 1HB TYR 46 2HB TYR 46 9.324 2.036 12.626
325 2HB TYR 46 1HB TYR 46 8.133 2.011 11.315
326 HD1 TYR 46 HD1 TYR 46 5.677 1.806 11.889
327 HD2 TYR 46 HD2 TYR 46 8.698 2.577 14.844
328 HE1 TYR 46 HE1 TYR 46 3.937 2.627 13.453
329 HE2 TYR 46 HE2 TYR 46 6.957 3.398 16.409
330 HH TYR 46 HH TYR 46 3.547 3.041 15.813
331 H ALA 47 H ALA 47 8.439 -1.278 10.036
332 HA ALA 47 HA ALA 47 11.258 -0.791 9.527
333 1HB ALA 47 1HB ALA 47 11.019 -2.886 10.959
334 2HB ALA 47 3HB ALA 47 10.134 -3.614 9.597
335 3HB ALA 47 2HB ALA 47 11.830 -3.115 9.391
336 H GLY 48 H GLY 48 11.679 -2.305 7.322
337 1HA GLY 48 2HA GLY 48 11.336 -2.080 5.089
338 2HA GLY 48 1HA GLY 48 9.936 -1.071 5.395
339 H CYS 49 H CYS 49 8.629 -2.166 3.827
340 HA CYS 49 HA CYS 49 7.375 -4.504 4.891
341 1HB CYS 49 2HB CYS 49 6.839 -3.183 2.230
342 2HB CYS 49 1HB CYS 49 5.782 -4.254 3.128
343 H THR 50 H THR 50 9.759 -3.603 2.407
344 HA THR 50 HA THR 50 9.692 -6.269 1.237
345 HB THR 50 HB THR 50 11.468 -5.135 -0.262
346 HG1 THR 50 HG1 THR 50 11.887 -3.529 1.533
347 1HG2 THR 50 1HG2 THR 50 8.890 -5.097 -0.715
348 2HG2 THR 50 2HG2 THR 50 8.938 -3.446 -0.051
349 3HG2 THR 50 3HG2 THR 50 9.875 -3.845 -1.511
350 H THR 51 H THR 51 10.511 -5.711 4.116
351 HA THR 51 HA THR 51 13.330 -6.100 4.198
352 HB THR 51 HB THR 51 11.203 -6.649 6.330
353 HG1 THR 51 HG1 THR 51 12.724 -4.252 5.583
354 1HG2 THR 51 1HG2 THR 51 13.791 -7.183 6.653
355 2HG2 THR 51 2HG2 THR 51 13.945 -5.411 6.732
356 3HG2 THR 51 3HG2 THR 51 12.924 -6.270 7.911
357 H ASP 52 H ASP 52 14.469 -7.999 4.987
358 HA ASP 52 HA ASP 52 13.898 -10.200 3.491
359 1HB ASP 52 1HB ASP 52 15.671 -9.529 5.780
360 2HB ASP 52 2HB ASP 52 15.297 -11.238 5.666
361 H GLY 53 H GLY 53 13.147 -12.404 4.184
362 1HA GLY 53 2HA GLY 53 12.119 -13.053 6.672
363 2HA GLY 53 1HA GLY 53 11.659 -13.785 5.148
364 H CYS 54 H CYS 54 10.787 -11.006 4.105
365 HA CYS 54 HA CYS 54 8.176 -11.098 5.402
366 1HB CYS 54 1HB CYS 54 9.552 -8.481 4.737
367 2HB CYS 54 2HB CYS 54 8.013 -8.702 5.545
368 H HIS 55 H HIS 55 8.061 -8.445 3.487
369 HA HIS 55 HA HIS 55 7.193 -10.021 1.207
370 1HB HIS 55 2HB HIS 55 6.785 -7.061 1.668
371 2HB HIS 55 1HB HIS 55 5.924 -8.106 0.555
372 HD1 HIS 55 HD1 HIS 55 4.339 -9.996 1.730
373 HD2 HIS 55 HD2 HIS 55 5.652 -6.848 4.172
374 HE1 HIS 55 HE1 HIS 55 2.816 -9.996 3.777
375 H ASN 56 H ASN 56 9.897 -10.169 1.360
376 HA ASN 56 HA ASN 56 11.005 -7.987 -0.135
377 1HB ASN 56 1HB ASN 56 12.278 -9.168 1.715
378 2HB ASN 56 2HB ASN 56 12.275 -10.632 0.751
379 2HD2 ASN 56 2HD2 ASN 56 14.531 -9.159 1.711
380 1HD2 ASN 56 1HD2 ASN 56 15.464 -8.633 0.350
381 H ILE 57 H ILE 57 9.020 -9.067 -1.692
382 HA ILE 57 HA ILE 57 10.468 -10.801 -3.571
383 HB ILE 57 HB ILE 57 7.481 -10.762 -3.340
384 1HG1 ILE 57 1HG1 ILE 57 8.536 -11.196 -1.067
385 2HG1 ILE 57 2HG1 ILE 57 7.436 -12.417 -1.675
386 1HG2 ILE 57 1HG2 ILE 57 9.566 -12.416 -4.659
387 2HG2 ILE 57 2HG2 ILE 57 8.152 -13.274 -4.001
388 3HG2 ILE 57 3HG2 ILE 57 7.928 -11.975 -5.198
389 1HD1 ILE 57 1HD1 ILE 57 10.479 -12.537 -1.898
390 2HD1 ILE 57 2HD1 ILE 57 9.491 -13.441 -0.726
391 3HD1 ILE 57 3HD1 ILE 57 9.347 -13.787 -2.466
392 H LEU 58 H LEU 58 10.401 -10.244 -5.764
393 HA LEU 58 HA LEU 58 9.076 -7.679 -6.312
394 1HB LEU 58 2HB LEU 58 11.737 -8.647 -7.366
395 2HB LEU 58 1HB LEU 58 10.930 -7.162 -7.828
396 HG LEU 58 HG LEU 58 12.159 -7.859 -5.158
397 1HD1 LEU 58 1HD1 LEU 58 13.111 -6.526 -7.461
398 2HD1 LEU 58 2HD1 LEU 58 12.857 -5.282 -6.214
399 3HD1 LEU 58 3HD1 LEU 58 13.898 -6.685 -5.872
400 1HD2 LEU 58 1HD2 LEU 58 10.047 -5.853 -5.795
401 2HD2 LEU 58 2HD2 LEU 58 10.347 -6.777 -4.303
402 3HD2 LEU 58 3HD2 LEU 58 11.358 -5.365 -4.694
403 H ASP 59 H ASP 59 7.191 -8.587 -7.182
404 HA ASP 59 HA ASP 59 7.453 -9.407 -9.852
405 1HB ASP 59 1HB ASP 59 7.834 -11.629 -9.245
406 2HB ASP 59 2HB ASP 59 6.983 -11.471 -7.721
407 H LYS 60 H LYS 60 5.118 -9.930 -10.741
408 HA LYS 60 HA LYS 60 3.321 -8.041 -9.559
409 1HB LYS 60 1HB LYS 60 1.946 -8.467 -11.506
410 2HB LYS 60 2HB LYS 60 3.611 -8.224 -11.992
411 1HG LYS 60 1HG LYS 60 3.092 -11.055 -11.422
412 2HG LYS 60 2HG LYS 60 1.966 -10.443 -12.617
413 1HD LYS 60 1HD LYS 60 3.949 -9.486 -13.898
414 2HD LYS 60 2HD LYS 60 5.013 -10.280 -12.753
415 1HE LYS 60 1HE LYS 60 4.234 -12.482 -13.411
416 2HE LYS 60 2HE LYS 60 2.891 -11.813 -14.316
417 1HZ LYS 60 1HZ LYS 60 4.830 -10.622 -15.556
418 2HZ LYS 60 2HZ LYS 60 5.696 -11.900 -15.021
419 3HZ LYS 60 3HZ LYS 60 4.380 -12.140 -15.959
420 H ALA 61 H ALA 61 3.643 -9.620 -7.494
421 HA ALA 61 HA ALA 61 2.464 -10.757 -5.994
422 1HB ALA 61 1HB ALA 61 0.476 -9.990 -7.930
423 2HB ALA 61 3HB ALA 61 0.130 -11.646 -7.377
424 3HB ALA 61 2HB ALA 61 0.270 -10.324 -6.193
425 H ASP 62 H ASP 62 4.295 -12.267 -6.320
426 HA ASP 62 HA ASP 62 4.078 -14.359 -8.145
427 1HB ASP 62 1HB ASP 62 6.159 -13.498 -6.882
428 2HB ASP 62 2HB ASP 62 5.586 -14.402 -5.494
429 H LYS 63 H LYS 63 4.284 -16.793 -7.049
430 HA LYS 63 HA LYS 63 1.758 -17.172 -5.733
431 1HB LYS 63 1HB LYS 63 2.523 -18.615 -7.595
432 2HB LYS 63 2HB LYS 63 3.859 -19.176 -6.610
433 1HG LYS 63 1HG LYS 63 2.480 -20.786 -5.802
434 2HG LYS 63 2HG LYS 63 1.614 -19.527 -4.945
435 1HD LYS 63 1HD LYS 63 0.213 -19.164 -7.048
436 2HD LYS 63 2HD LYS 63 0.999 -20.564 -7.751
437 1HE LYS 63 2HE LYS 63 -1.053 -21.379 -6.800
438 2HE LYS 63 1HE LYS 63 0.215 -21.911 -5.714
439 1HZ LYS 63 1HZ LYS 63 -1.050 -19.344 -5.211
440 2HZ LYS 63 2HZ LYS 63 -1.863 -20.704 -4.816
441 3HZ LYS 63 3HZ LYS 63 -0.403 -20.404 -4.150
442 H SER 64 H SER 64 2.432 -15.856 -3.798
443 HA SER 64 HA SER 64 3.022 -17.577 -1.715
444 1HB SER 64 1HB SER 64 5.363 -16.501 -3.013
445 2HB SER 64 2HB SER 64 5.236 -15.759 -1.431
446 HG SER 64 HG SER 64 5.770 -17.614 -0.500
447 H VAL 65 H VAL 65 2.941 -16.415 0.407
448 HA VAL 65 HA VAL 65 1.411 -13.971 0.111
449 HB VAL 65 HB VAL 65 0.490 -15.688 1.494
450 1HG1 VAL 65 1HG1 VAL 65 3.256 -15.896 2.505
451 2HG1 VAL 65 2HG1 VAL 65 1.996 -16.006 3.757
452 3HG1 VAL 65 3HG1 VAL 65 1.981 -17.131 2.378
453 1HG2 VAL 65 1HG2 VAL 65 0.707 -13.102 2.253
454 2HG2 VAL 65 2HG2 VAL 65 -0.209 -14.323 3.167
455 3HG2 VAL 65 3HG2 VAL 65 1.446 -13.897 3.663
456 H ASN 66 H ASN 66 4.126 -13.703 -0.677
457 HA ASN 66 HA ASN 66 5.023 -11.967 1.477
458 1HB ASN 66 1HB ASN 66 6.823 -13.694 -0.303
459 2HB ASN 66 2HB ASN 66 7.388 -12.577 0.923
460 2HD2 ASN 66 2HD2 ASN 66 6.440 -12.907 3.141
461 1HD2 ASN 66 1HD2 ASN 66 6.310 -14.531 3.729
462 H SER 67 H SER 67 3.637 -12.031 -1.434
463 HA SER 67 HA SER 67 5.478 -10.613 -3.035
464 1HB SER 67 1HB SER 67 3.064 -10.109 -4.210
465 2HB SER 67 2HB SER 67 3.978 -11.583 -4.457
466 HG SER 67 HG SER 67 1.884 -12.201 -3.879
467 H TRP 68 H TRP 68 5.562 -8.357 -3.488
468 HA TRP 68 HA TRP 68 4.270 -6.717 -1.452
469 1HB TRP 68 1HB TRP 68 6.562 -6.317 -1.507
470 2HB TRP 68 2HB TRP 68 6.642 -6.372 -3.257
471 HD1 TRP 68 HD1 TRP 68 6.771 -4.017 -4.379
472 HE1 TRP 68 HE1 TRP 68 6.238 -1.505 -3.771
473 HE3 TRP 68 HE3 TRP 68 4.705 -5.004 0.161
474 HZ2 TRP 68 HZ2 TRP 68 5.040 -0.241 -1.510
475 HZ3 TRP 68 HZ3 TRP 68 3.878 -3.075 1.505
476 HH2 TRP 68 HH2 TRP 68 4.020 -0.758 0.737
477 H TYR 69 H TYR 69 3.187 -8.050 -4.047
478 HA TYR 69 HA TYR 69 2.000 -5.568 -5.199
479 1HB TYR 69 1HB TYR 69 3.473 -6.650 -6.802
480 2HB TYR 69 2HB TYR 69 2.684 -8.212 -6.524
481 HD1 TYR 69 HD1 TYR 69 0.090 -8.270 -6.986
482 HD2 TYR 69 HD2 TYR 69 2.784 -5.333 -8.587
483 HE1 TYR 69 HE1 TYR 69 -1.527 -7.777 -8.801
484 HE2 TYR 69 HE2 TYR 69 1.168 -4.839 -10.402
485 HH TYR 69 HH TYR 69 -0.853 -5.343 -11.334
486 H LYS 70 H LYS 70 1.480 -8.572 -3.502
487 HA LYS 70 HA LYS 70 -1.302 -8.651 -4.364
488 1HB LYS 70 1HB LYS 70 0.163 -10.721 -4.254
489 2HB LYS 70 2HB LYS 70 0.144 -10.558 -2.509
490 1HG LYS 70 1HG LYS 70 -2.501 -10.398 -2.860
491 2HG LYS 70 2HG LYS 70 -2.146 -11.195 -4.379
492 1HD LYS 70 1HD LYS 70 -1.177 -12.238 -1.679
493 2HD LYS 70 2HD LYS 70 -2.675 -12.757 -2.426
494 1HE LYS 70 1HE LYS 70 0.050 -12.975 -3.789
495 2HE LYS 70 2HE LYS 70 -0.679 -14.278 -2.872
496 1HZ LYS 70 1HZ LYS 70 -2.014 -12.977 -5.139
497 2HZ LYS 70 2HZ LYS 70 -1.117 -14.334 -5.281
498 3HZ LYS 70 3HZ LYS 70 -2.477 -14.344 -4.376
499 H VAL 71 H VAL 71 0.769 -8.163 -1.451
500 HA VAL 71 HA VAL 71 -1.379 -7.832 0.327
501 HB VAL 71 HB VAL 71 0.315 -6.887 1.807
502 1HG1 VAL 71 1HG1 VAL 71 1.064 -9.353 0.223
503 2HG1 VAL 71 2HG1 VAL 71 1.985 -8.824 1.651
504 3HG1 VAL 71 3HG1 VAL 71 0.264 -9.248 1.809
505 1HG2 VAL 71 1HG2 VAL 71 2.035 -6.856 -0.688
506 2HG2 VAL 71 2HG2 VAL 71 1.602 -5.489 0.366
507 3HG2 VAL 71 3HG2 VAL 71 2.700 -6.758 0.960
508 H VAL 72 H VAL 72 -0.436 -5.989 -2.353
509 HA VAL 72 HA VAL 72 -1.417 -3.512 -1.129
510 HB VAL 72 HB VAL 72 0.185 -4.057 -3.634
511 1HG1 VAL 72 1HG1 VAL 72 -1.519 -1.822 -2.994
512 2HG1 VAL 72 2HG1 VAL 72 0.180 -1.290 -3.031
513 3HG1 VAL 72 3HG1 VAL 72 -0.529 -2.106 -4.446
514 1HG2 VAL 72 1HG2 VAL 72 1.124 -4.018 -1.114
515 2HG2 VAL 72 2HG2 VAL 72 2.052 -3.406 -2.505
516 3HG2 VAL 72 3HG2 VAL 72 1.163 -2.272 -1.460
517 H HIS 73 H HIS 73 -1.692 -5.555 -4.120
518 HA HIS 73 HA HIS 73 -4.251 -4.277 -4.633
519 1HB HIS 73 2HB HIS 73 -2.729 -6.251 -6.353
520 2HB HIS 73 1HB HIS 73 -4.112 -5.285 -6.828
521 HD1 HIS 73 HD1 HIS 73 -0.409 -5.029 -6.136
522 HD2 HIS 73 HD2 HIS 73 -3.552 -2.603 -7.490
523 HE1 HIS 73 HE1 HIS 73 0.671 -2.911 -7.062
524 H ASP 74 H ASP 74 -3.854 -6.084 -2.316
525 HA ASP 74 HA ASP 74 -4.999 -8.565 -3.074
526 1HB ASP 74 1HB ASP 74 -3.814 -7.348 -0.711
527 2HB ASP 74 2HB ASP 74 -5.337 -8.092 -0.266
528 H ALA 75 H ALA 75 -7.169 -8.563 -3.718
529 HA ALA 75 HA ALA 75 -8.973 -6.628 -2.517
530 1HB ALA 75 1HB ALA 75 -9.233 -8.618 -4.806
531 2HB ALA 75 3HB ALA 75 -10.538 -7.532 -4.271
532 3HB ALA 75 2HB ALA 75 -9.030 -6.854 -4.930
533 H LYS 76 H LYS 76 -7.722 -9.561 -1.622
534 HA LYS 76 HA LYS 76 -10.280 -10.617 -0.682
535 1HB LYS 76 1HB LYS 76 -8.572 -12.037 -1.953
536 2HB LYS 76 2HB LYS 76 -7.573 -11.954 -0.517
537 1HG LYS 76 1HG LYS 76 -9.753 -12.736 0.753
538 2HG LYS 76 2HG LYS 76 -10.311 -13.223 -0.835
539 1HD LYS 76 1HD LYS 76 -7.528 -14.073 -0.142
540 2HD LYS 76 2HD LYS 76 -8.796 -14.815 0.812
541 1HE LYS 76 1HE LYS 76 -9.079 -14.696 -2.205
542 2HE LYS 76 2HE LYS 76 -8.049 -15.917 -1.484
543 1HZ LYS 76 1HZ LYS 76 -10.662 -15.613 -0.309
544 2HZ LYS 76 2HZ LYS 76 -10.625 -16.241 -1.816
545 3HZ LYS 76 3HZ LYS 76 -9.805 -16.971 -0.608
546 H GLY 77 H GLY 77 -10.618 -11.095 1.566
547 1HA GLY 77 2HA GLY 77 -10.583 -10.537 3.744
548 2HA GLY 77 1HA GLY 77 -9.689 -9.093 3.311
549 H GLY 78 H GLY 78 -9.173 -10.519 5.713
550 1HA GLY 78 2HA GLY 78 -6.385 -11.280 5.234
551 2HA GLY 78 1HA GLY 78 -7.431 -12.455 6.006
552 H ALA 79 H ALA 79 -5.291 -11.650 7.478
553 HA ALA 79 HA ALA 79 -6.238 -10.923 9.871
554 1HB ALA 79 1HB ALA 79 -3.793 -9.784 10.012
555 2HB ALA 79 3HB ALA 79 -4.034 -11.547 9.971
556 3HB ALA 79 2HB ALA 79 -3.605 -10.672 8.481
557 H LYS 80 H LYS 80 -5.197 -8.679 7.235
558 HA LYS 80 HA LYS 80 -6.920 -6.662 8.384
559 1HB LYS 80 2HB LYS 80 -5.291 -4.996 8.703
560 2HB LYS 80 1HB LYS 80 -4.649 -6.423 9.491
561 1HG LYS 80 1HG LYS 80 -2.838 -6.463 8.120
562 2HG LYS 80 2HG LYS 80 -3.844 -6.402 6.687
563 1HD LYS 80 1HD LYS 80 -4.093 -3.890 7.059
564 2HD LYS 80 2HD LYS 80 -2.926 -4.018 8.360
565 1HE LYS 80 1HE LYS 80 -1.169 -4.723 6.855
566 2HE LYS 80 2HE LYS 80 -2.302 -5.028 5.554
567 1HZ LYS 80 1HZ LYS 80 -2.416 -2.361 6.546
568 2HZ LYS 80 2HZ LYS 80 -0.958 -2.746 5.920
569 3HZ LYS 80 3HZ LYS 80 -2.304 -2.894 5.006
570 HA PRO 81 HA PRO 81 -7.920 -5.860 4.232
571 1HB PRO 81 1HB PRO 81 -8.107 -3.060 4.359
572 2HB PRO 81 2HB PRO 81 -9.363 -4.212 4.917
573 1HG PRO 81 2HG PRO 81 -7.242 -2.958 6.182
574 2HG PRO 81 1HG PRO 81 -8.771 -2.864 7.116
575 1HD PRO 81 1HD PRO 81 -7.142 -4.633 8.018
576 2HD PRO 81 2HD PRO 81 -8.667 -5.354 7.421
577 H THR 82 H THR 82 -7.201 -3.903 2.466
578 HA THR 82 HA THR 82 -4.287 -3.643 2.737
579 HB THR 82 HB THR 82 -4.156 -4.318 0.299
580 HG1 THR 82 HG1 THR 82 -6.905 -5.150 0.880
581 1HG2 THR 82 1HG2 THR 82 -4.729 -6.069 2.533
582 2HG2 THR 82 2HG2 THR 82 -5.585 -6.690 1.102
583 3HG2 THR 82 3HG2 THR 82 -3.822 -6.448 1.049
584 H CYS 83 H CYS 83 -3.876 -2.397 0.224
585 HA CYS 83 HA CYS 83 -4.792 0.208 0.938
586 1HB CYS 83 2HB CYS 83 -3.359 -0.448 -1.618
587 2HB CYS 83 1HB CYS 83 -3.316 1.027 -0.673
588 H ILE 84 H ILE 84 -6.221 -2.412 -0.584
589 HA ILE 84 HA ILE 84 -7.747 -0.684 -2.405
590 HB ILE 84 HB ILE 84 -6.841 -3.522 -2.559
591 1HG1 ILE 84 1HG1 ILE 84 -5.715 -1.562 -3.719
592 2HG1 ILE 84 2HG1 ILE 84 -6.130 -2.939 -4.721
593 1HG2 ILE 84 1HG2 ILE 84 -9.298 -3.662 -2.661
594 2HG2 ILE 84 2HG2 ILE 84 -9.300 -2.480 -3.992
595 3HG2 ILE 84 3HG2 ILE 84 -8.529 -4.069 -4.214
596 1HD1 ILE 84 1HD1 ILE 84 -8.040 -0.593 -4.424
597 2HD1 ILE 84 2HD1 ILE 84 -6.725 -0.578 -5.623
598 3HD1 ILE 84 3HD1 ILE 84 -7.992 -1.826 -5.708
599 H SER 85 H SER 85 -7.903 -3.318 0.057
600 HA SER 85 HA SER 85 -10.600 -3.635 0.110
601 1HB SER 85 2HB SER 85 -9.100 -3.611 2.722
602 2HB SER 85 1HB SER 85 -10.270 -4.772 2.129
603 HG SER 85 HG SER 85 -8.594 -5.957 1.543
604 H CYS 86 H CYS 86 -8.627 -1.484 2.296
605 HA CYS 86 HA CYS 86 -10.826 -0.256 3.463
606 1HB CYS 86 1HB CYS 86 -8.347 -0.271 4.200
607 2HB CYS 86 2HB CYS 86 -8.145 1.095 3.122
608 H HIS 87 H HIS 87 -8.557 0.929 0.865
609 HA HIS 87 HA HIS 87 -9.799 3.255 0.263
610 1HB HIS 87 1HB HIS 87 -8.258 1.274 -1.393
611 2HB HIS 87 2HB HIS 87 -8.946 2.697 -2.151
612 HD1 HIS 87 HD1 HIS 87 -6.601 3.713 -2.632
613 HD2 HIS 87 HD2 HIS 87 -7.389 3.067 1.438
614 HE1 HIS 87 HE1 HIS 87 -4.778 4.951 -1.345
615 H LYS 88 H LYS 88 -10.768 -0.072 -0.614
616 HA LYS 88 HA LYS 88 -12.673 0.639 -2.540
617 1HB LYS 88 1HB LYS 88 -12.007 -1.773 -0.922
618 2HB LYS 88 2HB LYS 88 -13.614 -1.706 -1.618
619 1HG LYS 88 1HG LYS 88 -12.642 -1.288 -3.872
620 2HG LYS 88 2HG LYS 88 -11.027 -1.289 -3.191
621 1HD LYS 88 2HD LYS 88 -11.122 -3.504 -3.866
622 2HD LYS 88 1HD LYS 88 -11.789 -3.691 -2.256
623 1HE LYS 88 1HE LYS 88 -14.048 -3.026 -3.754
624 2HE LYS 88 2HE LYS 88 -13.120 -3.983 -4.891
625 1HZ LYS 88 1HZ LYS 88 -13.802 -4.819 -2.157
626 2HZ LYS 88 2HZ LYS 88 -14.540 -5.340 -3.517
627 3HZ LYS 88 3HZ LYS 88 -12.974 -5.713 -3.243
628 H ASP 89 H ASP 89 -12.920 0.045 1.025
629 HA ASP 89 HA ASP 89 -15.620 0.361 1.222
630 1HB ASP 89 1HB ASP 89 -13.677 -0.180 2.984
631 2HB ASP 89 2HB ASP 89 -13.793 1.534 3.328
632 H LYS 90 H LYS 90 -12.930 2.767 1.174
633 HA LYS 90 HA LYS 90 -14.443 5.009 1.873
634 1HB LYS 90 1HB LYS 90 -11.769 4.437 0.760
635 2HB LYS 90 2HB LYS 90 -12.422 5.999 0.309
636 1HG LYS 90 2HG LYS 90 -12.126 4.920 3.151
637 2HG LYS 90 1HG LYS 90 -11.164 6.190 2.421
638 1HD LYS 90 1HD LYS 90 -13.642 7.246 2.010
639 2HD LYS 90 2HD LYS 90 -13.987 6.288 3.436
640 1HE LYS 90 1HE LYS 90 -12.093 7.388 4.642
641 2HE LYS 90 2HE LYS 90 -11.728 8.336 3.215
642 1HZ LYS 90 1HZ LYS 90 -13.952 9.271 3.363
643 2HZ LYS 90 2HZ LYS 90 -14.249 8.417 4.723
644 3HZ LYS 90 3HZ LYS 90 -13.092 9.569 4.719
645 H ALA 91 H ALA 91 -13.795 3.382 -1.266
646 HA ALA 91 HA ALA 91 -15.433 5.385 -2.607
647 1HB ALA 91 1HB ALA 91 -13.144 3.876 -3.294
648 2HB ALA 91 3HB ALA 91 -14.089 4.950 -4.354
649 3HB ALA 91 2HB ALA 91 -14.473 3.214 -4.277
650 H GLY 92 H GLY 92 -16.432 3.330 -0.572
651 1HA GLY 92 2HA GLY 92 -17.959 1.627 -0.436
652 2HA GLY 92 1HA GLY 92 -17.990 1.487 -2.183
653 H ASP 93 H ASP 93 -18.812 3.753 -3.270
654 HA ASP 93 HA ASP 93 -21.456 3.867 -2.865
655 1HB ASP 93 1HB ASP 93 -21.634 6.186 -1.696
656 2HB ASP 93 2HB ASP 93 -21.380 4.777 -0.686
657 H ASP 94 H ASP 94 -18.740 6.308 -2.963
658 HA ASP 94 HA ASP 94 -19.981 7.654 -5.142
659 1HB ASP 94 1HB ASP 94 -18.689 8.890 -3.432
660 2HB ASP 94 2HB ASP 94 -17.251 7.963 -3.809
661 H LYS 95 H LYS 95 -19.583 7.188 -7.320
662 HA LYS 95 HA LYS 95 -17.821 5.045 -7.961
663 1HB LYS 95 1HB LYS 95 -20.106 5.793 -9.028
664 2HB LYS 95 2HB LYS 95 -19.096 6.839 -10.006
665 1HG LYS 95 1HG LYS 95 -17.659 4.560 -10.274
666 2HG LYS 95 2HG LYS 95 -19.218 3.832 -9.940
667 1HD LYS 95 1HD LYS 95 -20.065 5.600 -11.774
668 2HD LYS 95 2HD LYS 95 -18.387 5.553 -12.278
669 1HE LYS 95 1HE LYS 95 -18.840 3.644 -13.417
670 2HE LYS 95 2HE LYS 95 -19.085 2.835 -11.882
671 1HZ LYS 95 1HZ LYS 95 -21.169 4.309 -13.339
672 2HZ LYS 95 2HZ LYS 95 -21.004 2.684 -13.326
673 3HZ LYS 95 3HZ LYS 95 -21.380 3.477 -11.949
674 H GLU 96 H GLU 96 -17.804 8.627 -8.304
675 HA GLU 96 HA GLU 96 -15.495 8.705 -9.856
676 1HB GLU 96 1HB GLU 96 -17.108 10.586 -9.636
677 2HB GLU 96 2HB GLU 96 -16.642 10.803 -7.961
678 1HG GLU 96 1HG GLU 96 -15.377 12.427 -9.188
679 2HG GLU 96 2HG GLU 96 -14.236 11.160 -8.781
680 H LEU 97 H LEU 97 -16.072 8.250 -6.407
681 HA LEU 97 HA LEU 97 -13.452 9.030 -5.596
682 1HB LEU 97 1HB LEU 97 -15.622 9.025 -4.244
683 2HB LEU 97 2HB LEU 97 -15.387 7.297 -4.074
684 HG LEU 97 HG LEU 97 -14.575 8.410 -2.105
685 1HD1 LEU 97 1HD1 LEU 97 -13.242 6.485 -3.352
686 2HD1 LEU 97 2HD1 LEU 97 -11.986 7.744 -3.431
687 3HD1 LEU 97 3HD1 LEU 97 -12.637 7.235 -1.855
688 1HD2 LEU 97 1HD2 LEU 97 -13.496 10.320 -4.029
689 2HD2 LEU 97 2HD2 LEU 97 -13.888 10.520 -2.304
690 3HD2 LEU 97 3HD2 LEU 97 -12.311 9.849 -2.786
691 H LYS 98 H LYS 98 -14.892 6.228 -7.086
692 HA LYS 98 HA LYS 98 -12.825 4.450 -6.130
693 1HB LYS 98 1HB LYS 98 -15.264 3.814 -6.508
694 2HB LYS 98 2HB LYS 98 -14.937 3.901 -8.227
695 1HG LYS 98 1HG LYS 98 -13.176 2.189 -8.034
696 2HG LYS 98 2HG LYS 98 -13.324 2.178 -6.288
697 1HD LYS 98 2HD LYS 98 -14.590 0.288 -6.999
698 2HD LYS 98 1HD LYS 98 -15.797 1.505 -6.635
699 1HE LYS 98 2HE LYS 98 -16.431 0.560 -8.756
700 2HE LYS 98 1HE LYS 98 -15.776 2.145 -9.113
701 1HZ LYS 98 1HZ LYS 98 -14.280 -0.377 -9.295
702 2HZ LYS 98 2HZ LYS 98 -14.875 0.468 -10.560
703 3HZ LYS 98 3HZ LYS 98 -13.682 1.102 -9.643
704 H LYS 99 H LYS 99 -12.308 6.994 -7.789
705 HA LYS 99 HA LYS 99 -10.678 5.619 -9.797
706 1HB LYS 99 1HB LYS 99 -12.741 7.714 -10.230
707 2HB LYS 99 2HB LYS 99 -11.229 7.933 -11.087
708 1HG LYS 99 2HG LYS 99 -12.416 6.594 -12.600
709 2HG LYS 99 1HG LYS 99 -11.499 5.384 -11.726
710 1HD LYS 99 1HD LYS 99 -13.766 5.628 -10.136
711 2HD LYS 99 2HD LYS 99 -14.427 5.892 -11.737
712 1HE LYS 99 1HE LYS 99 -12.524 3.577 -11.308
713 2HE LYS 99 2HE LYS 99 -14.182 3.421 -10.763
714 1HZ LYS 99 1HZ LYS 99 -13.578 4.336 -13.473
715 2HZ LYS 99 2HZ LYS 99 -13.644 2.744 -13.116
716 3HZ LYS 99 3HZ LYS 99 -14.963 3.683 -12.907
717 H LYS 100 H LYS 100 -9.769 6.200 -7.242
718 HA LYS 100 HA LYS 100 -7.646 7.983 -7.864
719 1HB LYS 100 1HB LYS 100 -8.288 9.366 -5.674
720 2HB LYS 100 2HB LYS 100 -8.779 9.857 -7.282
721 1HG LYS 100 1HG LYS 100 -10.953 8.601 -6.957
722 2HG LYS 100 2HG LYS 100 -10.462 8.234 -5.316
723 1HD LYS 100 2HD LYS 100 -11.880 10.185 -5.194
724 2HD LYS 100 1HD LYS 100 -10.245 10.734 -4.890
725 1HE LYS 100 1HE LYS 100 -10.033 11.429 -7.289
726 2HE LYS 100 2HE LYS 100 -11.672 10.886 -7.589
727 1HZ LYS 100 1HZ LYS 100 -11.053 12.873 -5.526
728 2HZ LYS 100 2HZ LYS 100 -11.373 13.293 -7.072
729 3HZ LYS 100 3HZ LYS 100 -12.509 12.528 -6.181
730 H LEU 101 H LEU 101 -9.546 6.300 -5.287
731 HA LEU 101 HA LEU 101 -7.064 5.681 -3.915
732 1HB LEU 101 1HB LEU 101 -9.859 4.874 -3.134
733 2HB LEU 101 2HB LEU 101 -8.427 4.935 -2.126
734 HG LEU 101 HG LEU 101 -10.087 7.223 -3.174
735 1HD1 LEU 101 1HD1 LEU 101 -10.582 5.984 -0.988
736 2HD1 LEU 101 2HD1 LEU 101 -9.107 6.756 -0.360
737 3HD1 LEU 101 3HD1 LEU 101 -10.465 7.759 -0.926
738 1HD2 LEU 101 1HD2 LEU 101 -7.621 7.638 -3.571
739 2HD2 LEU 101 2HD2 LEU 101 -8.462 8.823 -2.543
740 3HD2 LEU 101 3HD2 LEU 101 -7.418 7.586 -1.803
741 H THR 102 H THR 102 -9.558 4.208 -5.985
742 HA THR 102 HA THR 102 -7.996 1.710 -5.893
743 HB THR 102 HB THR 102 -10.099 0.509 -6.119
744 HG1 THR 102 HG1 THR 102 -11.277 1.864 -7.516
745 1HG2 THR 102 1HG2 THR 102 -9.620 1.720 -3.806
746 2HG2 THR 102 2HG2 THR 102 -10.947 2.795 -4.307
747 3HG2 THR 102 3HG2 THR 102 -11.241 1.050 -4.110
748 H GLY 103 H GLY 103 -8.353 4.424 -7.643
749 1HA GLY 103 2HA GLY 103 -8.065 4.950 -9.808
750 2HA GLY 103 1HA GLY 103 -9.089 3.586 -10.209
751 H CYS 104 H CYS 104 -8.168 1.997 -11.427
752 HA CYS 104 HA CYS 104 -5.712 0.861 -10.860
753 1HB CYS 104 1HB CYS 104 -7.707 0.699 -13.021
754 2HB CYS 104 2HB CYS 104 -6.074 0.295 -13.512
755 H LYS 105 H LYS 105 -6.718 3.284 -13.377
756 HA LYS 105 HA LYS 105 -3.907 4.121 -13.493
757 1HB LYS 105 1HB LYS 105 -4.005 4.361 -15.853
758 2HB LYS 105 2HB LYS 105 -4.588 2.751 -15.485
759 1HG LYS 105 1HG LYS 105 -6.635 4.954 -15.624
760 2HG LYS 105 2HG LYS 105 -5.922 4.429 -17.136
761 1HD LYS 105 1HD LYS 105 -6.701 2.165 -15.398
762 2HD LYS 105 2HD LYS 105 -8.058 3.192 -15.816
763 1HE LYS 105 2HE LYS 105 -7.939 1.561 -17.569
764 2HE LYS 105 1HE LYS 105 -7.288 3.032 -18.264
765 1HZ LYS 105 1HZ LYS 105 -5.630 0.920 -17.072
766 2HZ LYS 105 2HZ LYS 105 -5.928 1.060 -18.672
767 3HZ LYS 105 3HZ LYS 105 -5.098 2.230 -17.890
768 H GLY 106 H GLY 106 -3.542 6.351 -13.540
769 1HA GLY 106 2HA GLY 106 -5.639 8.228 -13.991
770 2HA GLY 106 1HA GLY 106 -4.020 8.553 -13.402
771 H SER 107 H SER 107 -4.028 6.812 -11.080
772 HA SER 107 HA SER 107 -6.128 8.099 -9.518
773 1HB SER 107 2HB SER 107 -6.163 6.203 -8.064
774 2HB SER 107 1HB SER 107 -6.144 5.548 -9.689
775 HG SER 107 HG SER 107 -4.491 4.403 -8.915
776 H ALA 108 H ALA 108 -5.240 7.920 -6.960
777 HA ALA 108 HA ALA 108 -3.053 9.754 -6.945
778 1HB ALA 108 1HB ALA 108 -3.438 9.337 -4.368
779 2HB ALA 108 3HB ALA 108 -4.906 8.499 -4.926
780 3HB ALA 108 2HB ALA 108 -4.658 10.216 -5.320
781 H CYS 109 H CYS 109 -3.235 6.412 -7.307
782 HA CYS 109 HA CYS 109 -0.782 5.977 -5.785
783 1HB CYS 109 1HB CYS 109 -2.815 4.036 -6.922
784 2HB CYS 109 2HB CYS 109 -1.275 3.532 -6.253
785 H HIS 110 H HIS 110 -2.365 5.551 -9.019
786 HA HIS 110 HA HIS 110 0.332 5.415 -10.159
787 1HB HIS 110 1HB HIS 110 -2.215 4.111 -11.159
788 2HB HIS 110 2HB HIS 110 -0.685 4.111 -12.013
789 HD1 HIS 110 HD1 HIS 110 1.369 3.254 -10.046
790 HD2 HIS 110 HD2 HIS 110 -2.517 1.675 -9.989
791 HE1 HIS 110 HE1 HIS 110 1.522 1.020 -8.823
792 HA PRO 111 HA PRO 111 -1.530 9.185 -11.867
793 1HB PRO 111 1HB PRO 111 0.274 10.986 -11.016
794 2HB PRO 111 2HB PRO 111 -0.863 10.233 -9.850
795 1HG PRO 111 2HG PRO 111 1.790 9.526 -10.672
796 2HG PRO 111 1HG PRO 111 1.598 9.480 -8.889
797 1HD PRO 111 1HD PRO 111 1.612 7.188 -10.325
798 2HD PRO 111 2HD PRO 111 0.415 7.397 -9.010
799 H SER 112 H SER 112 -0.768 7.699 -13.830
800 HA SER 112 HA SER 112 1.505 9.101 -14.987
801 1HB SER 112 1HB SER 112 1.329 6.287 -14.360
802 2HB SER 112 2HB SER 112 1.364 6.456 -16.104
803 HG SER 112 HG SER 112 3.382 6.912 -14.229
No H/Q in entry = 803
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