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 |
|
|
15735 |
1yvc   |
6574 | cing | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 1H MET 1 1H MET 1 -16.855 23.221 0.646
2 2H MET 1 2H MET 1 -18.039 23.225 1.859
3 3H MET 1 3H MET 1 -18.349 23.969 0.365
4 HA MET 1 HA MET 1 -19.490 21.894 0.453
5 1HB MET 1 2HB MET 1 -18.578 22.570 -1.715
6 2HB MET 1 1HB MET 1 -17.046 21.800 -1.330
7 1HG MET 1 2HG MET 1 -18.371 20.443 -2.849
8 2HG MET 1 1HG MET 1 -18.122 19.622 -1.312
9 1HE MET 1 1HE MET 1 -21.686 18.403 -2.416
10 2HE MET 1 2HE MET 1 -20.066 17.905 -1.927
11 3HE MET 1 3HE MET 1 -20.308 18.737 -3.465
12 H ALA 2 H ALA 2 -19.548 20.471 2.064
13 HA ALA 2 HA ALA 2 -17.531 18.409 2.176
14 1HB ALA 2 1HB ALA 2 -16.547 20.138 3.618
15 2HB ALA 2 2HB ALA 2 -16.990 18.694 4.529
16 3HB ALA 2 3HB ALA 2 -18.008 20.133 4.608
17 H PHE 3 H PHE 3 -18.547 16.555 2.487
18 HA PHE 3 HA PHE 3 -21.237 16.557 3.626
19 1HB PHE 3 2HB PHE 3 -21.037 14.045 2.862
20 2HB PHE 3 1HB PHE 3 -21.329 15.313 1.678
21 HD1 PHE 3 1HD PHE 3 -19.730 15.823 -0.003
22 HD2 PHE 3 2HD PHE 3 -18.782 13.034 3.069
23 HE1 PHE 3 1HE PHE 3 -17.747 15.108 -1.270
24 HE2 PHE 3 2HE PHE 3 -16.795 12.317 1.808
25 HZ PHE 3 HZ PHE 3 -16.276 13.355 -0.365
26 H GLY 4 H GLY 4 -20.096 17.099 5.708
27 1HA GLY 4 2HA GLY 4 -19.819 16.190 7.878
28 2HA GLY 4 1HA GLY 4 -19.399 14.642 7.151
29 H LYS 5 H LYS 5 -17.390 14.776 5.720
30 HA LYS 5 HA LYS 5 -15.407 16.712 6.637
31 1HB LYS 5 2HB LYS 5 -15.057 13.707 6.754
32 2HB LYS 5 1HB LYS 5 -13.713 14.839 6.826
33 1HG LYS 5 2HG LYS 5 -14.666 15.815 8.864
34 2HG LYS 5 1HG LYS 5 -15.983 14.642 8.796
35 1HD LYS 5 2HD LYS 5 -14.385 12.816 9.025
36 2HD LYS 5 1HD LYS 5 -13.051 13.971 9.043
37 1HE LYS 5 2HE LYS 5 -13.906 14.958 11.089
38 2HE LYS 5 1HE LYS 5 -15.288 13.862 11.061
39 1HZ LYS 5 1HZ LYS 5 -13.667 12.003 11.210
40 2HZ LYS 5 2HZ LYS 5 -13.689 13.005 12.571
41 3HZ LYS 5 3HZ LYS 5 -12.431 13.139 11.448
42 HA PRO 6 HA PRO 6 -14.393 16.523 2.314
43 1HB PRO 6 2HB PRO 6 -11.707 17.461 2.792
44 2HB PRO 6 1HB PRO 6 -13.087 18.359 2.157
45 1HG PRO 6 2HG PRO 6 -11.945 18.814 4.610
46 2HG PRO 6 1HG PRO 6 -13.617 19.220 4.194
47 1HD PRO 6 2HD PRO 6 -12.553 16.895 5.744
48 2HD PRO 6 1HD PRO 6 -14.040 17.836 5.994
49 H ALA 7 H ALA 7 -14.343 14.291 2.017
50 HA ALA 7 HA ALA 7 -13.425 12.332 1.336
51 1HB ALA 7 1HB ALA 7 -11.148 12.327 0.498
52 2HB ALA 7 2HB ALA 7 -10.822 13.859 1.309
53 3HB ALA 7 3HB ALA 7 -11.979 13.792 -0.020
54 H MET 8 H MET 8 -11.013 11.084 1.925
55 HA MET 8 HA MET 8 -11.317 10.667 4.807
56 1HB MET 8 2HB MET 8 -11.564 8.739 3.198
57 2HB MET 8 1HB MET 8 -9.858 8.917 2.815
58 1HG MET 8 2HG MET 8 -9.258 8.413 5.110
59 2HG MET 8 1HG MET 8 -10.962 8.320 5.552
60 1HE MET 8 1HE MET 8 -8.710 6.035 6.093
61 2HE MET 8 2HE MET 8 -9.674 4.597 5.760
62 3HE MET 8 3HE MET 8 -10.379 5.939 6.658
63 H LYS 9 H LYS 9 -9.991 12.953 3.951
64 HA LYS 9 HA LYS 9 -8.184 14.208 4.510
65 1HB LYS 9 2HB LYS 9 -8.333 12.794 6.622
66 2HB LYS 9 1HB LYS 9 -7.065 11.792 5.931
67 1HG LYS 9 2HG LYS 9 -5.799 14.066 5.707
68 2HG LYS 9 1HG LYS 9 -6.931 14.583 6.958
69 1HD LYS 9 2HD LYS 9 -4.903 13.786 7.998
70 2HD LYS 9 1HD LYS 9 -6.215 12.658 8.342
71 1HE LYS 9 2HE LYS 9 -4.086 11.537 7.738
72 2HE LYS 9 1HE LYS 9 -5.419 11.133 6.657
73 1HZ LYS 9 1HZ LYS 9 -3.265 11.620 5.524
74 2HZ LYS 9 2HZ LYS 9 -3.396 13.225 6.054
75 3HZ LYS 9 3HZ LYS 9 -4.558 12.585 5.000
76 H ASN 10 H ASN 10 -8.249 12.382 2.168
77 HA ASN 10 HA ASN 10 -6.978 11.757 0.405
78 1HB ASN 10 2HB ASN 10 -5.437 13.970 1.606
79 2HB ASN 10 1HB ASN 10 -4.539 12.925 0.512
80 1HD2 ASN 10 1HD2 ASN 10 -5.169 12.786 -1.654
81 2HD2 ASN 10 2HD2 ASN 10 -6.151 14.015 -2.385
82 H VAL 11 H VAL 11 -6.666 9.639 0.691
83 HA VAL 11 HA VAL 11 -4.611 8.568 2.401
84 HB VAL 11 HB VAL 11 -6.051 7.156 0.144
85 1HG1 VAL 11 1HG1 VAL 11 -4.102 5.984 1.013
86 2HG1 VAL 11 2HG1 VAL 11 -5.587 5.139 1.449
87 3HG1 VAL 11 3HG1 VAL 11 -4.740 6.114 2.651
88 1HG2 VAL 11 1HG2 VAL 11 -7.679 6.404 1.815
89 2HG2 VAL 11 2HG2 VAL 11 -7.703 8.158 1.625
90 3HG2 VAL 11 3HG2 VAL 11 -6.907 7.434 3.023
91 HA PRO 12 HA PRO 12 -1.233 9.469 -0.365
92 1HB PRO 12 2HB PRO 12 0.482 7.558 0.671
93 2HB PRO 12 1HB PRO 12 0.259 9.179 1.319
94 1HG PRO 12 2HG PRO 12 -0.957 6.605 2.211
95 2HG PRO 12 1HG PRO 12 -0.339 7.951 3.185
96 1HD PRO 12 2HD PRO 12 -2.962 7.605 2.814
97 2HD PRO 12 1HD PRO 12 -2.249 9.233 2.847
98 H VAL 13 H VAL 13 -2.658 6.332 0.000
99 HA VAL 13 HA VAL 13 -1.463 5.494 -2.551
100 HB VAL 13 HB VAL 13 -2.002 3.143 -1.818
101 1HG1 VAL 13 1HG1 VAL 13 0.267 4.016 -1.678
102 2HG1 VAL 13 2HG1 VAL 13 -0.071 2.960 -0.306
103 3HG1 VAL 13 3HG1 VAL 13 -0.082 4.710 -0.094
104 1HG2 VAL 13 1HG2 VAL 13 -3.672 3.709 -0.112
105 2HG2 VAL 13 2HG2 VAL 13 -2.411 4.470 0.862
106 3HG2 VAL 13 3HG2 VAL 13 -2.366 2.730 0.559
107 H GLU 14 H GLU 14 -2.822 5.432 -4.206
108 HA GLU 14 HA GLU 14 -5.690 5.536 -3.634
109 1HB GLU 14 2HB GLU 14 -4.135 6.217 -6.131
110 2HB GLU 14 1HB GLU 14 -5.881 6.329 -5.983
111 1HG GLU 14 2HG GLU 14 -5.610 7.973 -4.178
112 2HG GLU 14 1HG GLU 14 -3.862 7.881 -4.380
113 H ALA 15 H ALA 15 -6.820 3.765 -3.811
114 HA ALA 15 HA ALA 15 -5.841 1.333 -4.834
115 1HB ALA 15 1HB ALA 15 -8.097 0.479 -4.475
116 2HB ALA 15 2HB ALA 15 -8.701 2.124 -4.272
117 3HB ALA 15 3HB ALA 15 -7.564 1.450 -3.102
118 H GLY 16 H GLY 16 -5.753 0.568 -6.820
119 1HA GLY 16 2HA GLY 16 -6.864 0.160 -8.954
120 2HA GLY 16 1HA GLY 16 -7.459 1.813 -8.889
121 H LYS 17 H LYS 17 -4.471 2.081 -7.725
122 HA LYS 17 HA LYS 17 -3.261 2.443 -10.386
123 1HB LYS 17 2HB LYS 17 -2.818 4.078 -7.880
124 2HB LYS 17 1HB LYS 17 -1.959 4.300 -9.399
125 1HG LYS 17 2HG LYS 17 -4.080 4.851 -10.500
126 2HG LYS 17 1HG LYS 17 -4.915 4.662 -8.957
127 1HD LYS 17 2HD LYS 17 -3.577 6.471 -8.007
128 2HD LYS 17 1HD LYS 17 -2.727 6.656 -9.541
129 1HE LYS 17 2HE LYS 17 -4.822 7.251 -10.640
130 2HE LYS 17 1HE LYS 17 -5.689 7.029 -9.121
131 1HZ LYS 17 1HZ LYS 17 -3.582 9.054 -9.649
132 2HZ LYS 17 2HZ LYS 17 -4.364 8.824 -8.165
133 3HZ LYS 17 3HZ LYS 17 -5.248 9.354 -9.514
134 H GLU 18 H GLU 18 -0.905 2.222 -10.447
135 HA GLU 18 HA GLU 18 0.061 0.413 -8.352
136 1HB GLU 18 2HB GLU 18 1.535 -0.467 -10.401
137 2HB GLU 18 1HB GLU 18 -0.028 -1.147 -9.988
138 1HG GLU 18 2HG GLU 18 -0.114 -0.889 -12.288
139 2HG GLU 18 1HG GLU 18 -0.991 0.511 -11.677
140 H TYR 19 H TYR 19 1.949 0.802 -7.463
141 HA TYR 19 HA TYR 19 3.505 3.101 -8.469
142 1HB TYR 19 2HB TYR 19 3.068 2.360 -5.568
143 2HB TYR 19 1HB TYR 19 3.873 3.795 -6.184
144 HD1 TYR 19 1HD TYR 19 2.555 5.646 -7.121
145 HD2 TYR 19 2HD TYR 19 0.669 2.218 -5.454
146 HE1 TYR 19 1HE TYR 19 0.440 6.890 -6.964
147 HE2 TYR 19 2HE TYR 19 -1.455 3.452 -5.300
148 HH TYR 19 HH TYR 19 -1.919 6.489 -6.817
149 H GLU 20 H GLU 20 5.773 2.975 -8.186
150 HA GLU 20 HA GLU 20 6.816 0.311 -7.715
151 1HB GLU 20 2HB GLU 20 8.172 2.896 -8.477
152 2HB GLU 20 1HB GLU 20 9.052 1.412 -8.139
153 1HG GLU 20 2HG GLU 20 8.896 1.253 -10.387
154 2HG GLU 20 1HG GLU 20 7.409 0.428 -9.940
155 H VAL 21 H VAL 21 7.388 -0.395 -5.827
156 HA VAL 21 HA VAL 21 8.097 1.531 -3.713
157 HB VAL 21 HB VAL 21 6.828 0.177 -2.090
158 1HG1 VAL 21 1HG1 VAL 21 5.167 1.155 -4.407
159 2HG1 VAL 21 2HG1 VAL 21 5.764 2.130 -3.066
160 3HG1 VAL 21 3HG1 VAL 21 4.579 0.860 -2.772
161 1HG2 VAL 21 1HG2 VAL 21 5.886 -1.330 -4.528
162 2HG2 VAL 21 2HG2 VAL 21 5.212 -1.495 -2.907
163 3HG2 VAL 21 3HG2 VAL 21 6.885 -1.963 -3.220
164 H THR 22 H THR 22 9.200 0.490 -1.878
165 HA THR 22 HA THR 22 10.823 -1.796 -2.755
166 HB THR 22 HB THR 22 11.473 0.129 -0.510
167 HG1 THR 22 1HG THR 22 11.312 1.126 -2.664
168 1HG2 THR 22 1HG2 THR 22 13.198 -1.771 -2.111
169 2HG2 THR 22 2HG2 THR 22 12.645 -2.034 -0.457
170 3HG2 THR 22 3HG2 THR 22 13.753 -0.708 -0.813
171 H ILE 23 H ILE 23 11.240 -3.462 -1.246
172 HA ILE 23 HA ILE 23 9.109 -3.795 0.738
173 HB ILE 23 HB ILE 23 10.593 -5.994 -0.724
174 1HG1 ILE 23 2HG1 ILE 23 9.219 -4.659 -2.264
175 2HG1 ILE 23 1HG1 ILE 23 8.562 -6.270 -2.051
176 1HG2 ILE 23 1HG2 ILE 23 8.804 -7.432 0.151
177 2HG2 ILE 23 2HG2 ILE 23 8.120 -6.050 1.009
178 3HG2 ILE 23 3HG2 ILE 23 9.714 -6.664 1.451
179 1HD1 ILE 23 1HD1 ILE 23 6.820 -4.561 -2.093
180 2HD1 ILE 23 2HD1 ILE 23 7.555 -3.779 -0.693
181 3HD1 ILE 23 3HD1 ILE 23 6.868 -5.397 -0.541
182 H GLU 24 H GLU 24 10.847 -2.435 1.697
183 HA GLU 24 HA GLU 24 13.291 -3.453 2.598
184 1HB GLU 24 2HB GLU 24 12.524 -1.057 2.570
185 2HB GLU 24 1HB GLU 24 11.548 -1.413 3.987
186 1HG GLU 24 2HG GLU 24 13.542 -1.923 5.264
187 2HG GLU 24 1HG GLU 24 14.544 -1.657 3.835
188 H ASP 25 H ASP 25 10.065 -4.050 3.673
189 HA ASP 25 HA ASP 25 11.108 -5.398 6.083
190 1HB ASP 25 2HB ASP 25 8.450 -3.965 5.859
191 2HB ASP 25 1HB ASP 25 9.053 -4.812 7.277
192 H MET 26 H MET 26 10.155 -7.338 6.669
193 HA MET 26 HA MET 26 8.104 -8.418 4.835
194 1HB MET 26 2HB MET 26 10.393 -9.878 6.172
195 2HB MET 26 1HB MET 26 9.062 -10.681 5.352
196 1HG MET 26 2HG MET 26 10.971 -8.752 4.064
197 2HG MET 26 1HG MET 26 11.094 -10.506 3.977
198 1HE MET 26 1HE MET 26 7.930 -11.463 1.916
199 2HE MET 26 2HE MET 26 8.102 -11.421 3.671
200 3HE MET 26 3HE MET 26 9.413 -12.046 2.672
201 H GLY 27 H GLY 27 6.490 -9.702 5.770
202 1HA GLY 27 2HA GLY 27 6.051 -9.080 8.601
203 2HA GLY 27 1HA GLY 27 4.825 -9.589 7.452
204 H LYS 28 H LYS 28 4.651 -10.783 9.741
205 HA LYS 28 HA LYS 28 6.360 -13.043 10.128
206 1HB LYS 28 2HB LYS 28 3.720 -12.315 11.374
207 2HB LYS 28 1HB LYS 28 4.770 -13.605 11.930
208 1HG LYS 28 2HG LYS 28 6.444 -12.059 12.618
209 2HG LYS 28 1HG LYS 28 5.606 -10.717 11.832
210 1HD LYS 28 2HD LYS 28 3.762 -10.909 13.386
211 2HD LYS 28 1HD LYS 28 4.488 -12.341 14.113
212 1HE LYS 28 2HE LYS 28 5.766 -9.613 14.096
213 2HE LYS 28 1HE LYS 28 4.808 -10.250 15.432
214 1HZ LYS 28 1HZ LYS 28 7.372 -11.337 14.394
215 2HZ LYS 28 2HZ LYS 28 6.405 -12.124 15.545
216 3HZ LYS 28 3HZ LYS 28 7.098 -10.619 15.905
217 H GLY 29 H GLY 29 4.601 -12.786 7.659
218 1HA GLY 29 2HA GLY 29 3.669 -15.562 7.701
219 2HA GLY 29 1HA GLY 29 2.507 -14.317 7.271
220 H GLY 30 H GLY 30 5.874 -14.101 6.388
221 1HA GLY 30 2HA GLY 30 6.931 -14.202 4.340
222 2HA GLY 30 1HA GLY 30 5.644 -15.276 3.812
223 H ASP 31 H ASP 31 4.736 -12.211 5.021
224 HA ASP 31 HA ASP 31 3.884 -11.395 2.344
225 1HB ASP 31 2HB ASP 31 2.246 -11.504 4.255
226 2HB ASP 31 1HB ASP 31 3.153 -10.215 5.036
227 H GLY 32 H GLY 32 4.449 -9.358 1.493
228 1HA GLY 32 2HA GLY 32 6.939 -8.310 2.644
229 2HA GLY 32 1HA GLY 32 6.411 -8.109 0.980
230 H ILE 33 H ILE 33 7.110 -6.295 3.429
231 HA ILE 33 HA ILE 33 4.657 -4.685 3.387
232 HB ILE 33 HB ILE 33 6.953 -4.771 5.327
233 1HG1 ILE 33 2HG1 ILE 33 5.064 -4.947 6.970
234 2HG1 ILE 33 1HG1 ILE 33 3.950 -5.001 5.609
235 1HG2 ILE 33 1HG2 ILE 33 6.059 -2.810 6.464
236 2HG2 ILE 33 2HG2 ILE 33 4.849 -2.612 5.198
237 3HG2 ILE 33 3HG2 ILE 33 6.559 -2.407 4.821
238 1HD1 ILE 33 1HD1 ILE 33 4.373 -7.214 6.490
239 2HD1 ILE 33 2HD1 ILE 33 6.104 -7.014 6.213
240 3HD1 ILE 33 3HD1 ILE 33 4.990 -7.070 4.846
241 H ALA 34 H ALA 34 4.746 -3.490 1.593
242 HA ALA 34 HA ALA 34 7.060 -1.840 1.025
243 1HB ALA 34 1HB ALA 34 5.635 -2.637 -0.806
244 2HB ALA 34 2HB ALA 34 5.648 -0.873 -0.722
245 3HB ALA 34 3HB ALA 34 4.264 -1.775 -0.102
246 H ARG 35 H ARG 35 6.916 0.505 1.053
247 HA ARG 35 HA ARG 35 4.990 1.556 2.975
248 1HB ARG 35 2HB ARG 35 7.610 0.845 3.675
249 2HB ARG 35 1HB ARG 35 7.611 2.592 3.553
250 1HG ARG 35 2HG ARG 35 5.639 2.632 5.078
251 2HG ARG 35 1HG ARG 35 5.835 0.889 5.279
252 1HD ARG 35 2HD ARG 35 7.792 3.052 6.035
253 2HD ARG 35 1HD ARG 35 6.896 1.995 7.123
254 HE ARG 35 HE ARG 35 8.233 0.135 6.065
255 1HH1 ARG 35 1HH1 ARG 35 9.444 3.411 6.275
256 2HH1 ARG 35 2HH1 ARG 35 11.113 2.936 6.250
257 1HH2 ARG 35 1HH2 ARG 35 10.412 -0.505 6.051
258 2HH2 ARG 35 2HH2 ARG 35 11.672 0.708 6.107
259 H ILE 36 H ILE 36 4.061 3.080 1.808
260 HA ILE 36 HA ILE 36 5.719 4.819 0.131
261 HB ILE 36 HB ILE 36 2.735 4.378 0.215
262 1HG1 ILE 36 2HG1 ILE 36 4.867 3.900 -1.871
263 2HG1 ILE 36 1HG1 ILE 36 3.977 2.677 -0.972
264 1HG2 ILE 36 1HG2 ILE 36 2.540 6.014 -1.594
265 2HG2 ILE 36 2HG2 ILE 36 4.261 6.381 -1.456
266 3HG2 ILE 36 3HG2 ILE 36 3.168 6.766 -0.125
267 1HD1 ILE 36 1HD1 ILE 36 2.821 4.597 -2.969
268 2HD1 ILE 36 2HD1 ILE 36 1.917 3.379 -2.068
269 3HD1 ILE 36 3HD1 ILE 36 3.145 2.884 -3.235
270 H ASP 37 H ASP 37 6.486 6.493 1.117
271 HA ASP 37 HA ASP 37 6.786 8.256 2.520
272 1HB ASP 37 2HB ASP 37 3.938 8.455 1.736
273 2HB ASP 37 1HB ASP 37 4.440 9.429 3.113
274 H GLY 38 H GLY 38 5.950 5.532 3.637
275 1HA GLY 38 2HA GLY 38 6.332 5.054 5.991
276 2HA GLY 38 1HA GLY 38 5.407 6.501 6.369
277 H PHE 39 H PHE 39 3.569 5.581 4.060
278 HA PHE 39 HA PHE 39 1.644 4.293 5.723
279 1HB PHE 39 2HB PHE 39 1.131 5.878 3.804
280 2HB PHE 39 1HB PHE 39 1.543 4.567 2.711
281 HD1 PHE 39 1HD PHE 39 0.136 2.539 2.629
282 HD2 PHE 39 2HD PHE 39 -0.935 5.952 4.944
283 HE1 PHE 39 1HE PHE 39 -2.169 1.712 2.787
284 HE2 PHE 39 2HE PHE 39 -3.240 5.125 5.101
285 HZ PHE 39 HZ PHE 39 -3.853 3.005 4.017
286 H VAL 40 H VAL 40 1.630 2.234 6.207
287 HA VAL 40 HA VAL 40 3.329 0.336 4.964
288 HB VAL 40 HB VAL 40 1.051 -0.201 6.871
289 1HG1 VAL 40 1HG1 VAL 40 1.886 -2.204 5.784
290 2HG1 VAL 40 2HG1 VAL 40 2.377 -2.184 7.480
291 3HG1 VAL 40 3HG1 VAL 40 3.541 -1.776 6.220
292 1HG2 VAL 40 1HG2 VAL 40 2.675 0.008 8.661
293 2HG2 VAL 40 2HG2 VAL 40 2.594 1.508 7.738
294 3HG2 VAL 40 3HG2 VAL 40 3.940 0.398 7.496
295 H VAL 41 H VAL 41 2.994 -0.668 3.140
296 HA VAL 41 HA VAL 41 0.231 -1.265 2.304
297 HB VAL 41 HB VAL 41 2.609 -0.689 0.512
298 1HG1 VAL 41 1HG1 VAL 41 -0.293 -1.160 -0.156
299 2HG1 VAL 41 2HG1 VAL 41 1.053 -2.240 -0.520
300 3HG1 VAL 41 3HG1 VAL 41 0.951 -0.661 -1.299
301 1HG2 VAL 41 1HG2 VAL 41 1.853 1.331 1.629
302 2HG2 VAL 41 2HG2 VAL 41 0.190 1.002 1.138
303 3HG2 VAL 41 3HG2 VAL 41 1.415 1.372 -0.078
304 H PHE 42 H PHE 42 -0.103 -3.372 2.609
305 HA PHE 42 HA PHE 42 2.092 -5.227 2.798
306 1HB PHE 42 2HB PHE 42 -0.897 -5.604 3.020
307 2HB PHE 42 1HB PHE 42 0.281 -6.889 3.275
308 HD1 PHE 42 1HD PHE 42 1.944 -6.647 5.139
309 HD2 PHE 42 2HD PHE 42 -1.432 -4.091 4.733
310 HE1 PHE 42 1HE PHE 42 2.165 -5.986 7.499
311 HE2 PHE 42 2HE PHE 42 -1.222 -3.432 7.093
312 HZ PHE 42 HZ PHE 42 0.579 -4.377 8.478
313 H VAL 43 H VAL 43 2.810 -6.589 1.312
314 HA VAL 43 HA VAL 43 1.249 -6.906 -1.170
315 HB VAL 43 HB VAL 43 4.260 -6.812 -1.107
316 1HG1 VAL 43 1HG1 VAL 43 2.249 -6.473 -3.321
317 2HG1 VAL 43 2HG1 VAL 43 3.264 -7.887 -3.028
318 3HG1 VAL 43 3HG1 VAL 43 4.000 -6.353 -3.493
319 1HG2 VAL 43 1HG2 VAL 43 4.104 -4.492 -1.953
320 2HG2 VAL 43 2HG2 VAL 43 3.542 -4.660 -0.290
321 3HG2 VAL 43 3HG2 VAL 43 2.374 -4.507 -1.605
322 HA PRO 44 HA PRO 44 1.625 -11.072 0.492
323 1HB PRO 44 2HB PRO 44 0.052 -12.245 -1.412
324 2HB PRO 44 1HB PRO 44 -0.581 -11.378 -0.017
325 1HG PRO 44 2HG PRO 44 -0.219 -10.429 -2.825
326 2HG PRO 44 1HG PRO 44 -1.588 -10.176 -1.726
327 1HD PRO 44 2HD PRO 44 0.247 -8.266 -2.154
328 2HD PRO 44 1HD PRO 44 -0.502 -8.495 -0.559
329 H ASN 45 H ASN 45 2.944 -9.949 -2.399
330 HA ASN 45 HA ASN 45 4.071 -12.560 -3.050
331 1HB ASN 45 2HB ASN 45 3.440 -11.885 -5.539
332 2HB ASN 45 1HB ASN 45 2.330 -12.783 -4.508
333 1HD2 ASN 45 1HD2 ASN 45 0.380 -12.104 -4.937
334 2HD2 ASN 45 2HD2 ASN 45 -0.128 -10.455 -5.001
335 H ALA 46 H ALA 46 4.953 -9.775 -2.167
336 HA ALA 46 HA ALA 46 6.874 -9.191 -4.285
337 1HB ALA 46 1HB ALA 46 6.402 -7.727 -1.694
338 2HB ALA 46 2HB ALA 46 5.639 -7.334 -3.233
339 3HB ALA 46 3HB ALA 46 7.384 -7.185 -3.055
340 H GLU 47 H GLU 47 9.136 -9.024 -3.816
341 HA GLU 47 HA GLU 47 10.021 -10.852 -1.708
342 1HB GLU 47 2HB GLU 47 11.459 -9.933 -4.211
343 2HB GLU 47 1HB GLU 47 12.042 -11.121 -3.062
344 1HG GLU 47 2HG GLU 47 10.162 -12.579 -3.608
345 2HG GLU 47 1HG GLU 47 9.592 -11.394 -4.781
346 H LYS 48 H LYS 48 11.727 -10.249 -0.340
347 HA LYS 48 HA LYS 48 11.655 -7.538 0.463
348 1HB LYS 48 2HB LYS 48 12.035 -9.531 1.955
349 2HB LYS 48 1HB LYS 48 13.669 -9.616 1.315
350 1HG LYS 48 2HG LYS 48 14.122 -7.370 2.169
351 2HG LYS 48 1HG LYS 48 12.480 -7.289 2.810
352 1HD LYS 48 2HD LYS 48 12.999 -9.314 4.179
353 2HD LYS 48 1HD LYS 48 14.676 -9.184 3.645
354 1HE LYS 48 2HE LYS 48 13.138 -7.075 5.160
355 2HE LYS 48 1HE LYS 48 14.331 -8.171 5.851
356 1HZ LYS 48 1HZ LYS 48 15.996 -7.194 4.361
357 2HZ LYS 48 2HZ LYS 48 15.325 -6.050 5.419
358 3HZ LYS 48 3HZ LYS 48 14.841 -6.087 3.795
359 H GLY 49 H GLY 49 13.014 -5.871 0.119
360 1HA GLY 49 2HA GLY 49 14.986 -4.767 -0.423
361 2HA GLY 49 1HA GLY 49 15.704 -6.312 -0.848
362 H SER 50 H SER 50 12.866 -6.279 -2.460
363 HA SER 50 HA SER 50 14.191 -5.438 -4.913
364 1HB SER 50 2HB SER 50 11.520 -6.802 -4.515
365 2HB SER 50 1HB SER 50 12.348 -6.563 -6.054
366 HG SER 50 HG SER 50 12.931 -8.562 -5.493
367 H VAL 51 H VAL 51 13.292 -3.949 -6.372
368 HA VAL 51 HA VAL 51 11.354 -2.074 -5.217
369 HB VAL 51 HB VAL 51 12.989 -1.775 -7.751
370 1HG1 VAL 51 1HG1 VAL 51 11.368 0.239 -6.194
371 2HG1 VAL 51 2HG1 VAL 51 10.936 -0.459 -7.756
372 3HG1 VAL 51 3HG1 VAL 51 12.352 0.582 -7.619
373 1HG2 VAL 51 1HG2 VAL 51 14.409 -0.253 -6.487
374 2HG2 VAL 51 2HG2 VAL 51 14.424 -1.861 -5.764
375 3HG2 VAL 51 3HG2 VAL 51 13.475 -0.571 -5.026
376 H ILE 52 H ILE 52 9.351 -2.756 -5.576
377 HA ILE 52 HA ILE 52 8.780 -4.103 -8.128
378 HB ILE 52 HB ILE 52 8.571 -5.788 -6.598
379 1HG1 ILE 52 2HG1 ILE 52 5.817 -4.561 -6.703
380 2HG1 ILE 52 1HG1 ILE 52 6.503 -5.716 -7.841
381 1HG2 ILE 52 1HG2 ILE 52 7.303 -3.871 -4.651
382 2HG2 ILE 52 2HG2 ILE 52 8.956 -4.485 -4.594
383 3HG2 ILE 52 3HG2 ILE 52 7.598 -5.587 -4.354
384 1HD1 ILE 52 1HD1 ILE 52 4.911 -6.714 -6.272
385 2HD1 ILE 52 2HD1 ILE 52 5.974 -6.274 -4.939
386 3HD1 ILE 52 3HD1 ILE 52 6.519 -7.425 -6.159
387 H ASN 53 H ASN 53 6.934 -3.703 -9.180
388 HA ASN 53 HA ASN 53 5.548 -1.226 -8.533
389 1HB ASN 53 2HB ASN 53 6.281 -1.700 -10.875
390 2HB ASN 53 1HB ASN 53 5.179 -3.074 -10.909
391 1HD2 ASN 53 1HD2 ASN 53 3.989 -2.230 -12.606
392 2HD2 ASN 53 2HD2 ASN 53 2.931 -0.861 -12.409
393 H VAL 54 H VAL 54 3.850 -1.319 -7.220
394 HA VAL 54 HA VAL 54 2.301 -3.828 -7.152
395 HB VAL 54 HB VAL 54 1.751 -3.331 -4.817
396 1HG1 VAL 54 1HG1 VAL 54 4.710 -3.353 -5.371
397 2HG1 VAL 54 2HG1 VAL 54 3.652 -4.761 -5.311
398 3HG1 VAL 54 3HG1 VAL 54 3.942 -3.814 -3.851
399 1HG2 VAL 54 1HG2 VAL 54 3.672 -1.025 -5.106
400 2HG2 VAL 54 2HG2 VAL 54 2.942 -1.575 -3.599
401 3HG2 VAL 54 3HG2 VAL 54 1.928 -0.900 -4.876
402 H LYS 55 H LYS 55 0.179 -3.754 -7.461
403 HA LYS 55 HA LYS 55 -1.083 -1.155 -7.888
404 1HB LYS 55 2HB LYS 55 -1.406 -2.993 -9.553
405 2HB LYS 55 1HB LYS 55 -2.212 -3.936 -8.306
406 1HG LYS 55 2HG LYS 55 -3.817 -1.952 -8.110
407 2HG LYS 55 1HG LYS 55 -3.138 -1.419 -9.645
408 1HD LYS 55 2HD LYS 55 -4.462 -4.089 -9.147
409 2HD LYS 55 1HD LYS 55 -5.224 -2.703 -9.920
410 1HE LYS 55 2HE LYS 55 -4.581 -3.967 -11.737
411 2HE LYS 55 1HE LYS 55 -3.223 -2.857 -11.572
412 1HZ LYS 55 1HZ LYS 55 -2.582 -5.210 -11.935
413 2HZ LYS 55 2HZ LYS 55 -3.266 -5.605 -10.431
414 3HZ LYS 55 3HZ LYS 55 -1.943 -4.550 -10.513
415 H VAL 56 H VAL 56 -1.871 -0.219 -6.093
416 HA VAL 56 HA VAL 56 -2.577 -1.696 -3.764
417 HB VAL 56 HB VAL 56 -3.253 1.160 -4.523
418 1HG1 VAL 56 1HG1 VAL 56 -3.513 -0.228 -1.853
419 2HG1 VAL 56 2HG1 VAL 56 -4.848 0.285 -2.883
420 3HG1 VAL 56 3HG1 VAL 56 -3.785 1.488 -2.154
421 1HG2 VAL 56 1HG2 VAL 56 -1.120 0.036 -2.698
422 2HG2 VAL 56 2HG2 VAL 56 -1.456 1.751 -2.945
423 3HG2 VAL 56 3HG2 VAL 56 -0.853 0.767 -4.282
424 H THR 57 H THR 57 -4.304 -2.956 -3.589
425 HA THR 57 HA THR 57 -6.580 -2.421 -5.369
426 HB THR 57 HB THR 57 -7.040 -4.939 -4.818
427 HG1 THR 57 1HG THR 57 -4.776 -5.914 -4.712
428 1HG2 THR 57 1HG2 THR 57 -4.809 -4.059 -6.653
429 2HG2 THR 57 2HG2 THR 57 -6.529 -4.082 -7.039
430 3HG2 THR 57 3HG2 THR 57 -5.673 -5.596 -6.747
431 H ALA 58 H ALA 58 -5.692 -2.816 -2.033
432 HA ALA 58 HA ALA 58 -8.490 -2.447 -1.293
433 1HB ALA 58 1HB ALA 58 -8.150 -4.867 -1.279
434 2HB ALA 58 2HB ALA 58 -8.445 -4.243 0.344
435 3HB ALA 58 3HB ALA 58 -6.808 -4.672 -0.153
436 H VAL 59 H VAL 59 -7.927 -0.385 -0.604
437 HA VAL 59 HA VAL 59 -6.001 -0.020 1.506
438 HB VAL 59 HB VAL 59 -8.167 1.930 0.713
439 1HG1 VAL 59 1HG1 VAL 59 -7.010 2.419 2.809
440 2HG1 VAL 59 2HG1 VAL 59 -6.605 3.604 1.565
441 3HG1 VAL 59 3HG1 VAL 59 -5.454 2.331 1.975
442 1HG2 VAL 59 1HG2 VAL 59 -6.931 1.278 -1.288
443 2HG2 VAL 59 2HG2 VAL 59 -5.409 1.645 -0.473
444 3HG2 VAL 59 3HG2 VAL 59 -6.557 2.937 -0.824
445 H LYS 60 H LYS 60 -6.336 -0.296 3.601
446 HA LYS 60 HA LYS 60 -9.085 -0.751 4.535
447 1HB LYS 60 2HB LYS 60 -6.416 -1.744 5.524
448 2HB LYS 60 1HB LYS 60 -7.878 -1.872 6.488
449 1HG LYS 60 2HG LYS 60 -7.500 -3.072 3.753
450 2HG LYS 60 1HG LYS 60 -7.360 -3.945 5.281
451 1HD LYS 60 2HD LYS 60 -9.711 -3.272 5.790
452 2HD LYS 60 1HD LYS 60 -9.819 -2.604 4.164
453 1HE LYS 60 2HE LYS 60 -9.203 -5.480 4.821
454 2HE LYS 60 1HE LYS 60 -10.785 -4.869 4.348
455 1HZ LYS 60 1HZ LYS 60 -9.820 -5.750 2.424
456 2HZ LYS 60 2HZ LYS 60 -8.324 -5.019 2.713
457 3HZ LYS 60 3HZ LYS 60 -9.655 -4.068 2.257
458 H GLU 61 H GLU 61 -8.540 -0.498 7.289
459 HA GLU 61 HA GLU 61 -9.039 2.255 7.574
460 1HB GLU 61 2HB GLU 61 -9.999 0.569 9.050
461 2HB GLU 61 1HB GLU 61 -8.400 0.164 9.657
462 1HG GLU 61 2HG GLU 61 -8.183 2.330 10.668
463 2HG GLU 61 1HG GLU 61 -9.709 2.853 9.958
464 H LYS 62 H LYS 62 -6.155 0.325 8.445
465 HA LYS 62 HA LYS 62 -4.777 2.877 9.011
466 1HB LYS 62 2HB LYS 62 -4.304 0.201 10.329
467 2HB LYS 62 1HB LYS 62 -3.477 1.702 10.711
468 1HG LYS 62 2HG LYS 62 -5.508 2.669 11.554
469 2HG LYS 62 1HG LYS 62 -6.435 1.263 11.031
470 1HD LYS 62 2HD LYS 62 -5.138 -0.143 12.579
471 2HD LYS 62 1HD LYS 62 -4.268 1.292 13.132
472 1HE LYS 62 2HE LYS 62 -6.340 2.268 13.933
473 2HE LYS 62 1HE LYS 62 -7.253 0.898 13.305
474 1HZ LYS 62 1HZ LYS 62 -5.165 0.693 15.411
475 2HZ LYS 62 2HZ LYS 62 -6.182 -0.546 14.868
476 3HZ LYS 62 3HZ LYS 62 -6.833 0.772 15.714
477 H PHE 63 H PHE 63 -4.915 0.620 6.740
478 HA PHE 63 HA PHE 63 -2.247 0.939 5.799
479 1HB PHE 63 2HB PHE 63 -1.754 -1.583 5.872
480 2HB PHE 63 1HB PHE 63 -1.556 -0.681 7.371
481 HD1 PHE 63 1HD PHE 63 -3.717 -3.070 5.568
482 HD2 PHE 63 2HD PHE 63 -2.900 -1.126 9.266
483 HE1 PHE 63 1HE PHE 63 -5.242 -4.618 6.718
484 HE2 PHE 63 2HE PHE 63 -4.429 -2.667 10.423
485 HZ PHE 63 HZ PHE 63 -5.599 -4.420 9.144
486 H ALA 64 H ALA 64 -1.895 -0.510 3.806
487 HA ALA 64 HA ALA 64 -4.487 -1.099 2.538
488 1HB ALA 64 1HB ALA 64 -3.747 -0.122 0.462
489 2HB ALA 64 2HB ALA 64 -2.181 0.274 1.166
490 3HB ALA 64 3HB ALA 64 -3.639 1.079 1.747
491 H PHE 65 H PHE 65 -4.388 -2.576 0.768
492 HA PHE 65 HA PHE 65 -2.064 -4.379 0.874
493 1HB PHE 65 2HB PHE 65 -4.969 -4.970 0.281
494 2HB PHE 65 1HB PHE 65 -3.668 -6.135 0.060
495 HD1 PHE 65 1HD PHE 65 -2.629 -7.211 1.931
496 HD2 PHE 65 2HD PHE 65 -5.652 -4.272 2.523
497 HE1 PHE 65 1HE PHE 65 -2.837 -7.903 4.280
498 HE2 PHE 65 2HE PHE 65 -5.862 -4.960 4.877
499 HZ PHE 65 HZ PHE 65 -4.454 -6.778 5.756
500 H ALA 66 H ALA 66 -1.053 -4.882 -0.978
501 HA ALA 66 HA ALA 66 -2.167 -3.815 -3.492
502 1HB ALA 66 1HB ALA 66 -0.371 -2.358 -2.618
503 2HB ALA 66 2HB ALA 66 0.030 -3.089 -4.171
504 3HB ALA 66 3HB ALA 66 0.738 -3.729 -2.687
505 H GLU 67 H GLU 67 -0.619 -4.734 -5.363
506 HA GLU 67 HA GLU 67 0.052 -7.523 -4.819
507 1HB GLU 67 2HB GLU 67 -1.131 -8.180 -6.956
508 2HB GLU 67 1HB GLU 67 -2.171 -7.771 -5.598
509 1HG GLU 67 2HG GLU 67 -2.597 -5.596 -6.531
510 2HG GLU 67 1HG GLU 67 -1.469 -5.903 -7.847
511 H ARG 68 H ARG 68 1.634 -8.359 -6.067
512 HA ARG 68 HA ARG 68 3.440 -6.616 -7.349
513 1HB ARG 68 2HB ARG 68 4.431 -8.464 -6.348
514 2HB ARG 68 1HB ARG 68 3.236 -9.582 -6.972
515 1HG ARG 68 2HG ARG 68 4.225 -9.559 -9.133
516 2HG ARG 68 1HG ARG 68 5.275 -8.205 -8.705
517 1HD ARG 68 2HD ARG 68 6.584 -9.521 -7.292
518 2HD ARG 68 1HD ARG 68 5.374 -10.800 -7.209
519 HE ARG 68 HE ARG 68 6.414 -10.380 -9.860
520 1HH1 ARG 68 1HH1 ARG 68 6.925 -12.021 -6.800
521 2HH1 ARG 68 2HH1 ARG 68 7.907 -13.274 -7.491
522 1HH2 ARG 68 1HH2 ARG 68 7.736 -12.022 -10.761
523 2HH2 ARG 68 2HH2 ARG 68 8.353 -13.288 -9.731
524 H VAL 69 H VAL 69 2.860 -5.618 -9.174
525 HA VAL 69 HA VAL 69 1.497 -7.010 -11.317
526 HB VAL 69 HB VAL 69 2.762 -4.294 -11.602
527 1HG1 VAL 69 1HG1 VAL 69 1.778 -5.310 -13.587
528 2HG1 VAL 69 2HG1 VAL 69 0.854 -3.896 -13.078
529 3HG1 VAL 69 3HG1 VAL 69 0.247 -5.515 -12.734
530 1HG2 VAL 69 1HG2 VAL 69 0.135 -4.889 -10.246
531 2HG2 VAL 69 2HG2 VAL 69 0.697 -3.288 -10.719
532 3HG2 VAL 69 3HG2 VAL 69 1.570 -4.200 -9.491
533 H LEU 70 H LEU 70 4.218 -7.797 -10.360
534 HA LEU 70 HA LEU 70 5.786 -7.379 -12.806
535 1HB LEU 70 2HB LEU 70 6.678 -8.420 -10.111
536 2HB LEU 70 1HB LEU 70 7.714 -8.197 -11.505
537 HG LEU 70 HG LEU 70 6.354 -6.039 -9.897
538 1HD1 LEU 70 1HD1 LEU 70 9.255 -6.748 -10.317
539 2HD1 LEU 70 2HD1 LEU 70 8.323 -6.976 -8.837
540 3HD1 LEU 70 3HD1 LEU 70 8.663 -5.348 -9.425
541 1HD2 LEU 70 1HD2 LEU 70 7.479 -4.456 -11.378
542 2HD2 LEU 70 2HD2 LEU 70 6.321 -5.451 -12.258
543 3HD2 LEU 70 3HD2 LEU 70 8.046 -5.792 -12.379
Start of MODEL 2
1 1H MET 1 1H MET 1 -26.076 17.836 0.032
2 2H MET 1 2H MET 1 -27.047 16.549 -0.490
3 3H MET 1 3H MET 1 -25.952 17.266 -1.560
4 HA MET 1 HA MET 1 -25.206 15.818 0.909
5 1HB MET 1 2HB MET 1 -25.313 14.949 -1.974
6 2HB MET 1 1HB MET 1 -24.269 14.153 -0.804
7 1HG MET 1 2HG MET 1 -26.378 12.965 -1.107
8 2HG MET 1 1HG MET 1 -26.175 13.545 0.544
9 1HE MET 1 1HE MET 1 -28.975 12.539 -0.519
10 2HE MET 1 2HE MET 1 -30.044 13.800 0.096
11 3HE MET 1 3HE MET 1 -28.727 13.193 1.102
12 H ALA 2 H ALA 2 -22.982 15.599 1.235
13 HA ALA 2 HA ALA 2 -21.377 17.581 -0.225
14 1HB ALA 2 1HB ALA 2 -21.598 17.972 2.188
15 2HB ALA 2 2HB ALA 2 -19.927 17.657 1.722
16 3HB ALA 2 3HB ALA 2 -20.877 16.393 2.499
17 H PHE 3 H PHE 3 -20.391 14.754 1.686
18 HA PHE 3 HA PHE 3 -18.762 13.953 -0.618
19 1HB PHE 3 2HB PHE 3 -17.888 13.951 2.276
20 2HB PHE 3 1HB PHE 3 -16.924 13.411 0.905
21 HD1 PHE 3 1HD PHE 3 -17.196 15.971 3.112
22 HD2 PHE 3 2HD PHE 3 -17.055 15.335 -1.093
23 HE1 PHE 3 1HE PHE 3 -16.386 18.272 2.793
24 HE2 PHE 3 2HE PHE 3 -16.242 17.634 -1.417
25 HZ PHE 3 HZ PHE 3 -15.906 19.107 0.527
26 H GLY 4 H GLY 4 -17.595 11.720 0.328
27 1HA GLY 4 2HA GLY 4 -18.377 9.554 1.290
28 2HA GLY 4 1HA GLY 4 -19.941 9.936 0.567
29 H LYS 5 H LYS 5 -18.635 11.185 -1.710
30 HA LYS 5 HA LYS 5 -17.433 8.880 -3.066
31 1HB LYS 5 2HB LYS 5 -19.250 10.975 -4.273
32 2HB LYS 5 1HB LYS 5 -18.386 9.750 -5.191
33 1HG LYS 5 2HG LYS 5 -20.446 9.184 -3.069
34 2HG LYS 5 1HG LYS 5 -20.747 9.183 -4.808
35 1HD LYS 5 2HD LYS 5 -18.724 7.416 -3.436
36 2HD LYS 5 1HD LYS 5 -20.369 6.918 -3.824
37 1HE LYS 5 2HE LYS 5 -19.942 7.278 -6.192
38 2HE LYS 5 1HE LYS 5 -18.312 7.846 -5.828
39 1HZ LYS 5 1HZ LYS 5 -19.318 5.123 -5.184
40 2HZ LYS 5 2HZ LYS 5 -17.725 5.685 -5.027
41 3HZ LYS 5 3HZ LYS 5 -18.413 5.506 -6.568
42 HA PRO 6 HA PRO 6 -14.880 12.675 -4.244
43 1HB PRO 6 2HB PRO 6 -15.914 15.166 -3.422
44 2HB PRO 6 1HB PRO 6 -15.986 14.488 -5.048
45 1HG PRO 6 2HG PRO 6 -18.178 14.974 -3.379
46 2HG PRO 6 1HG PRO 6 -18.179 13.946 -4.825
47 1HD PRO 6 2HD PRO 6 -17.925 13.175 -1.949
48 2HD PRO 6 1HD PRO 6 -18.794 12.357 -3.267
49 H ALA 7 H ALA 7 -13.270 14.036 -3.212
50 HA ALA 7 HA ALA 7 -11.910 14.732 -1.544
51 1HB ALA 7 1HB ALA 7 -13.828 16.167 -0.986
52 2HB ALA 7 2HB ALA 7 -12.865 15.733 0.426
53 3HB ALA 7 3HB ALA 7 -14.406 14.926 0.128
54 H MET 8 H MET 8 -12.954 11.799 -1.663
55 HA MET 8 HA MET 8 -12.182 11.004 1.051
56 1HB MET 8 2HB MET 8 -14.306 10.121 -0.064
57 2HB MET 8 1HB MET 8 -13.247 9.189 -1.115
58 1HG MET 8 2HG MET 8 -12.330 8.016 0.790
59 2HG MET 8 1HG MET 8 -13.297 8.997 1.889
60 1HE MET 8 1HE MET 8 -14.957 5.466 2.170
61 2HE MET 8 2HE MET 8 -14.226 6.806 3.053
62 3HE MET 8 3HE MET 8 -13.243 5.828 1.963
63 H LYS 9 H LYS 9 -10.262 12.036 -0.807
64 HA LYS 9 HA LYS 9 -8.659 9.641 -1.352
65 1HB LYS 9 2HB LYS 9 -7.406 10.903 -2.976
66 2HB LYS 9 1HB LYS 9 -9.117 11.056 -3.325
67 1HG LYS 9 2HG LYS 9 -7.685 13.170 -1.763
68 2HG LYS 9 1HG LYS 9 -7.594 13.124 -3.522
69 1HD LYS 9 2HD LYS 9 -10.163 13.031 -3.445
70 2HD LYS 9 1HD LYS 9 -9.991 13.553 -1.768
71 1HE LYS 9 2HE LYS 9 -8.875 15.002 -4.169
72 2HE LYS 9 1HE LYS 9 -10.357 15.437 -3.321
73 1HZ LYS 9 1HZ LYS 9 -7.649 15.401 -2.098
74 2HZ LYS 9 2HZ LYS 9 -9.080 15.892 -1.344
75 3HZ LYS 9 3HZ LYS 9 -8.457 16.789 -2.640
76 H ASN 10 H ASN 10 -9.010 10.958 1.225
77 HA ASN 10 HA ASN 10 -6.519 12.278 1.830
78 1HB ASN 10 2HB ASN 10 -7.321 12.213 4.177
79 2HB ASN 10 1HB ASN 10 -8.505 12.914 3.081
80 1HD2 ASN 10 1HD2 ASN 10 -8.690 11.556 5.738
81 2HD2 ASN 10 2HD2 ASN 10 -9.887 10.323 5.523
82 H VAL 11 H VAL 11 -5.647 10.169 0.698
83 HA VAL 11 HA VAL 11 -4.441 8.432 2.666
84 HB VAL 11 HB VAL 11 -6.376 7.311 0.608
85 1HG1 VAL 11 1HG1 VAL 11 -4.459 5.870 2.434
86 2HG1 VAL 11 2HG1 VAL 11 -4.403 5.932 0.673
87 3HG1 VAL 11 3HG1 VAL 11 -5.724 5.094 1.485
88 1HG2 VAL 11 1HG2 VAL 11 -7.529 6.298 2.510
89 2HG2 VAL 11 2HG2 VAL 11 -7.502 8.055 2.638
90 3HG2 VAL 11 3HG2 VAL 11 -6.402 7.084 3.616
91 HA PRO 12 HA PRO 12 -1.305 9.186 -0.408
92 1HB PRO 12 2HB PRO 12 0.312 7.050 0.362
93 2HB PRO 12 1HB PRO 12 0.355 8.673 1.048
94 1HG PRO 12 2HG PRO 12 -1.000 6.223 2.067
95 2HG PRO 12 1HG PRO 12 -0.165 7.503 2.967
96 1HD PRO 12 2HD PRO 12 -2.833 7.381 2.889
97 2HD PRO 12 1HD PRO 12 -1.985 8.942 2.846
98 H VAL 13 H VAL 13 -2.708 6.007 0.063
99 HA VAL 13 HA VAL 13 -1.844 5.227 -2.625
100 HB VAL 13 HB VAL 13 -2.561 2.914 -1.918
101 1HG1 VAL 13 1HG1 VAL 13 -0.417 4.254 -0.273
102 2HG1 VAL 13 2HG1 VAL 13 -0.222 3.613 -1.906
103 3HG1 VAL 13 3HG1 VAL 13 -0.562 2.519 -0.563
104 1HG2 VAL 13 1HG2 VAL 13 -2.712 4.228 0.794
105 2HG2 VAL 13 2HG2 VAL 13 -2.770 2.489 0.492
106 3HG2 VAL 13 3HG2 VAL 13 -4.064 3.531 -0.103
107 H GLU 14 H GLU 14 -3.249 5.192 -4.227
108 HA GLU 14 HA GLU 14 -6.107 5.347 -3.609
109 1HB GLU 14 2HB GLU 14 -4.517 6.021 -6.074
110 2HB GLU 14 1HB GLU 14 -6.262 5.866 -6.109
111 1HG GLU 14 2HG GLU 14 -6.374 7.630 -4.342
112 2HG GLU 14 1HG GLU 14 -4.635 7.854 -4.551
113 H ALA 15 H ALA 15 -7.310 3.601 -3.804
114 HA ALA 15 HA ALA 15 -6.363 1.116 -4.705
115 1HB ALA 15 1HB ALA 15 -8.259 1.356 -3.162
116 2HB ALA 15 2HB ALA 15 -8.678 0.361 -4.556
117 3HB ALA 15 3HB ALA 15 -9.231 2.033 -4.469
118 H GLY 16 H GLY 16 -5.754 0.684 -6.710
119 1HA GLY 16 2HA GLY 16 -6.731 0.157 -8.944
120 2HA GLY 16 1HA GLY 16 -7.355 1.801 -8.930
121 H LYS 17 H LYS 17 -4.677 2.544 -7.556
122 HA LYS 17 HA LYS 17 -3.283 2.994 -10.087
123 1HB LYS 17 2HB LYS 17 -3.212 4.316 -7.411
124 2HB LYS 17 1HB LYS 17 -1.791 4.421 -8.438
125 1HG LYS 17 2HG LYS 17 -3.027 6.361 -8.865
126 2HG LYS 17 1HG LYS 17 -3.322 5.304 -10.243
127 1HD LYS 17 2HD LYS 17 -5.466 4.649 -9.305
128 2HD LYS 17 1HD LYS 17 -5.166 5.646 -7.879
129 1HE LYS 17 2HE LYS 17 -5.480 6.599 -10.725
130 2HE LYS 17 1HE LYS 17 -6.625 6.825 -9.404
131 1HZ LYS 17 1HZ LYS 17 -5.287 8.808 -9.841
132 2HZ LYS 17 2HZ LYS 17 -3.873 7.951 -9.475
133 3HZ LYS 17 3HZ LYS 17 -5.034 8.222 -8.269
134 H GLU 18 H GLU 18 -0.916 2.885 -10.106
135 HA GLU 18 HA GLU 18 0.077 0.608 -8.516
136 1HB GLU 18 2HB GLU 18 0.917 1.381 -11.318
137 2HB GLU 18 1HB GLU 18 1.455 -0.021 -10.411
138 1HG GLU 18 2HG GLU 18 -0.650 -1.059 -10.583
139 2HG GLU 18 1HG GLU 18 -1.411 0.416 -11.173
140 H TYR 19 H TYR 19 1.836 0.997 -7.319
141 HA TYR 19 HA TYR 19 3.502 3.337 -7.985
142 1HB TYR 19 2HB TYR 19 2.777 2.445 -5.183
143 2HB TYR 19 1HB TYR 19 3.751 3.841 -5.620
144 HD1 TYR 19 1HD TYR 19 2.582 5.688 -7.017
145 HD2 TYR 19 2HD TYR 19 0.489 2.681 -4.848
146 HE1 TYR 19 1HE TYR 19 0.564 7.100 -7.013
147 HE2 TYR 19 2HE TYR 19 -1.535 4.076 -4.852
148 HH TYR 19 HH TYR 19 -1.925 6.723 -5.009
149 H GLU 20 H GLU 20 5.611 2.815 -8.227
150 HA GLU 20 HA GLU 20 6.507 0.169 -7.547
151 1HB GLU 20 2HB GLU 20 7.282 1.400 -9.591
152 2HB GLU 20 1HB GLU 20 8.182 2.478 -8.533
153 1HG GLU 20 2HG GLU 20 9.557 0.676 -7.764
154 2HG GLU 20 1HG GLU 20 8.581 -0.503 -8.637
155 H VAL 21 H VAL 21 7.332 -0.458 -5.705
156 HA VAL 21 HA VAL 21 8.207 1.585 -3.763
157 HB VAL 21 HB VAL 21 6.976 0.289 -2.004
158 1HG1 VAL 21 1HG1 VAL 21 5.293 1.382 -4.252
159 2HG1 VAL 21 2HG1 VAL 21 6.038 2.327 -2.964
160 3HG1 VAL 21 3HG1 VAL 21 4.770 1.161 -2.583
161 1HG2 VAL 21 1HG2 VAL 21 5.779 -1.114 -4.394
162 2HG2 VAL 21 2HG2 VAL 21 5.219 -1.264 -2.729
163 3HG2 VAL 21 3HG2 VAL 21 6.823 -1.844 -3.176
164 H THR 22 H THR 22 9.402 0.687 -1.933
165 HA THR 22 HA THR 22 11.087 -1.561 -2.750
166 HB THR 22 HB THR 22 11.513 0.286 -0.395
167 HG1 THR 22 1HG THR 22 11.645 0.849 -3.026
168 1HG2 THR 22 1HG2 THR 22 13.401 -1.456 -1.988
169 2HG2 THR 22 2HG2 THR 22 12.836 -1.767 -0.349
170 3HG2 THR 22 3HG2 THR 22 13.870 -0.379 -0.674
171 H ILE 23 H ILE 23 11.521 -3.290 -1.271
172 HA ILE 23 HA ILE 23 9.378 -3.737 0.685
173 HB ILE 23 HB ILE 23 10.631 -5.907 -1.002
174 1HG1 ILE 23 2HG1 ILE 23 9.383 -4.346 -2.447
175 2HG1 ILE 23 1HG1 ILE 23 8.596 -5.917 -2.350
176 1HG2 ILE 23 1HG2 ILE 23 9.700 -6.637 1.125
177 2HG2 ILE 23 2HG2 ILE 23 8.728 -7.236 -0.218
178 3HG2 ILE 23 3HG2 ILE 23 8.165 -5.862 0.733
179 1HD1 ILE 23 1HD1 ILE 23 6.987 -5.017 -0.762
180 2HD1 ILE 23 2HD1 ILE 23 6.990 -4.094 -2.264
181 3HD1 ILE 23 3HD1 ILE 23 7.789 -3.448 -0.830
182 H GLU 24 H GLU 24 11.184 -2.698 1.865
183 HA GLU 24 HA GLU 24 13.468 -4.399 2.467
184 1HB GLU 24 2HB GLU 24 13.654 -1.904 2.231
185 2HB GLU 24 1HB GLU 24 12.738 -1.746 3.722
186 1HG GLU 24 2HG GLU 24 14.470 -2.839 4.972
187 2HG GLU 24 1HG GLU 24 15.355 -3.215 3.490
188 H ASP 25 H ASP 25 10.355 -4.270 3.450
189 HA ASP 25 HA ASP 25 10.989 -5.277 6.142
190 1HB ASP 25 2HB ASP 25 8.557 -3.735 5.214
191 2HB ASP 25 1HB ASP 25 8.660 -4.553 6.767
192 H MET 26 H MET 26 10.234 -7.269 6.636
193 HA MET 26 HA MET 26 8.397 -8.524 4.699
194 1HB MET 26 2HB MET 26 10.767 -9.796 6.083
195 2HB MET 26 1HB MET 26 9.580 -10.673 5.127
196 1HG MET 26 2HG MET 26 11.410 -8.512 4.117
197 2HG MET 26 1HG MET 26 11.609 -10.243 3.866
198 1HE MET 26 1HE MET 26 8.586 -11.113 1.552
199 2HE MET 26 2HE MET 26 8.708 -11.267 3.305
200 3HE MET 26 3HE MET 26 10.078 -11.707 2.284
201 H GLY 27 H GLY 27 6.860 -9.927 5.495
202 1HA GLY 27 2HA GLY 27 6.293 -9.695 8.339
203 2HA GLY 27 1HA GLY 27 5.251 -10.417 7.119
204 H LYS 28 H LYS 28 6.664 -12.313 5.977
205 HA LYS 28 HA LYS 28 8.404 -13.740 7.696
206 1HB LYS 28 2HB LYS 28 6.170 -14.299 8.677
207 2HB LYS 28 1HB LYS 28 5.769 -15.065 7.146
208 1HG LYS 28 2HG LYS 28 6.448 -16.756 8.688
209 2HG LYS 28 1HG LYS 28 7.705 -16.586 7.461
210 1HD LYS 28 2HD LYS 28 8.975 -15.139 9.027
211 2HD LYS 28 1HD LYS 28 7.742 -15.441 10.253
212 1HE LYS 28 2HE LYS 28 8.223 -17.836 10.141
213 2HE LYS 28 1HE LYS 28 9.462 -17.532 8.927
214 1HZ LYS 28 1HZ LYS 28 10.579 -16.101 10.623
215 2HZ LYS 28 2HZ LYS 28 10.538 -17.753 11.002
216 3HZ LYS 28 3HZ LYS 28 9.474 -16.685 11.771
217 H GLY 29 H GLY 29 6.127 -14.915 5.352
218 1HA GLY 29 2HA GLY 29 8.436 -15.786 3.728
219 2HA GLY 29 1HA GLY 29 7.089 -16.854 4.077
220 H GLY 30 H GLY 30 7.797 -13.707 2.598
221 1HA GLY 30 2HA GLY 30 7.408 -13.453 0.207
222 2HA GLY 30 1HA GLY 30 6.016 -14.514 0.377
223 H ASP 31 H ASP 31 5.122 -13.271 2.810
224 HA ASP 31 HA ASP 31 3.692 -11.034 1.765
225 1HB ASP 31 2HB ASP 31 2.922 -10.825 4.193
226 2HB ASP 31 1HB ASP 31 2.520 -12.324 3.367
227 H GLY 32 H GLY 32 4.734 -9.229 1.345
228 1HA GLY 32 2HA GLY 32 6.911 -8.415 3.157
229 2HA GLY 32 1HA GLY 32 6.816 -8.001 1.452
230 H ILE 33 H ILE 33 7.260 -6.143 3.441
231 HA ILE 33 HA ILE 33 4.729 -4.648 3.498
232 HB ILE 33 HB ILE 33 7.042 -4.662 5.423
233 1HG1 ILE 33 2HG1 ILE 33 5.065 -4.755 7.063
234 2HG1 ILE 33 1HG1 ILE 33 4.077 -5.122 5.655
235 1HG2 ILE 33 1HG2 ILE 33 6.682 -2.342 4.964
236 2HG2 ILE 33 2HG2 ILE 33 6.003 -2.717 6.553
237 3HG2 ILE 33 3HG2 ILE 33 4.936 -2.529 5.159
238 1HD1 ILE 33 1HD1 ILE 33 6.437 -6.730 6.596
239 2HD1 ILE 33 2HD1 ILE 33 5.398 -7.108 5.224
240 3HD1 ILE 33 3HD1 ILE 33 4.740 -7.132 6.858
241 H ALA 34 H ALA 34 4.762 -3.284 1.813
242 HA ALA 34 HA ALA 34 7.231 -1.830 1.196
243 1HB ALA 34 1HB ALA 34 6.015 -1.004 -0.740
244 2HB ALA 34 2HB ALA 34 4.542 -1.785 -0.162
245 3HB ALA 34 3HB ALA 34 5.929 -2.763 -0.649
246 H ARG 35 H ARG 35 7.229 0.405 0.935
247 HA ARG 35 HA ARG 35 5.620 1.698 3.023
248 1HB ARG 35 2HB ARG 35 8.523 2.169 2.331
249 2HB ARG 35 1HB ARG 35 7.610 2.982 3.571
250 1HG ARG 35 2HG ARG 35 8.150 0.043 3.568
251 2HG ARG 35 1HG ARG 35 9.131 1.239 4.416
252 1HD ARG 35 2HD ARG 35 7.100 1.933 5.667
253 2HD ARG 35 1HD ARG 35 6.222 0.614 4.892
254 HE ARG 35 HE ARG 35 8.327 -0.667 5.987
255 1HH1 ARG 35 1HH1 ARG 35 6.086 1.674 7.333
256 2HH1 ARG 35 2HH1 ARG 35 6.123 0.989 8.931
257 1HH2 ARG 35 1HH2 ARG 35 8.416 -1.536 8.091
258 2HH2 ARG 35 2HH2 ARG 35 7.476 -0.828 9.368
259 H ILE 36 H ILE 36 4.202 2.886 1.802
260 HA ILE 36 HA ILE 36 5.353 4.592 -0.293
261 HB ILE 36 HB ILE 36 2.462 3.975 0.320
262 1HG1 ILE 36 2HG1 ILE 36 4.349 3.233 -1.914
263 2HG1 ILE 36 1HG1 ILE 36 3.600 2.148 -0.750
264 1HG2 ILE 36 1HG2 ILE 36 3.622 5.712 -1.860
265 2HG2 ILE 36 2HG2 ILE 36 2.724 6.295 -0.460
266 3HG2 ILE 36 3HG2 ILE 36 1.921 5.291 -1.668
267 1HD1 ILE 36 1HD1 ILE 36 2.200 3.699 -2.904
268 2HD1 ILE 36 2HD1 ILE 36 1.413 2.656 -1.722
269 3HD1 ILE 36 3HD1 ILE 36 2.529 1.968 -2.899
270 H ASP 37 H ASP 37 6.181 6.304 0.522
271 HA ASP 37 HA ASP 37 6.516 8.228 1.700
272 1HB ASP 37 2HB ASP 37 4.366 8.957 0.803
273 2HB ASP 37 1HB ASP 37 3.513 8.117 2.091
274 H GLY 38 H GLY 38 5.657 5.385 3.061
275 1HA GLY 38 2HA GLY 38 6.560 4.961 5.340
276 2HA GLY 38 1HA GLY 38 5.716 6.430 5.822
277 H PHE 39 H PHE 39 3.537 5.608 3.870
278 HA PHE 39 HA PHE 39 1.817 4.302 5.689
279 1HB PHE 39 2HB PHE 39 1.066 5.814 3.833
280 2HB PHE 39 1HB PHE 39 1.502 4.558 2.685
281 HD1 PHE 39 1HD PHE 39 0.190 2.509 2.528
282 HD2 PHE 39 2HD PHE 39 -0.912 5.676 5.151
283 HE1 PHE 39 1HE PHE 39 -2.064 1.548 2.748
284 HE2 PHE 39 2HE PHE 39 -3.160 4.719 5.374
285 HZ PHE 39 HZ PHE 39 -3.735 2.658 4.170
286 H VAL 40 H VAL 40 1.552 2.220 6.091
287 HA VAL 40 HA VAL 40 3.385 0.353 4.914
288 HB VAL 40 HB VAL 40 1.163 -0.180 6.888
289 1HG1 VAL 40 1HG1 VAL 40 2.043 -2.182 5.772
290 2HG1 VAL 40 2HG1 VAL 40 2.457 -2.148 7.485
291 3HG1 VAL 40 3HG1 VAL 40 3.674 -1.737 6.275
292 1HG2 VAL 40 1HG2 VAL 40 2.724 1.574 7.645
293 2HG2 VAL 40 2HG2 VAL 40 4.064 0.448 7.419
294 3HG2 VAL 40 3HG2 VAL 40 2.820 0.110 8.624
295 H VAL 41 H VAL 41 3.031 -0.552 3.039
296 HA VAL 41 HA VAL 41 0.284 -1.337 2.325
297 HB VAL 41 HB VAL 41 2.677 -0.894 0.507
298 1HG1 VAL 41 1HG1 VAL 41 -0.190 -1.588 -0.141
299 2HG1 VAL 41 2HG1 VAL 41 1.217 -2.629 -0.366
300 3HG1 VAL 41 3HG1 VAL 41 1.046 -1.155 -1.321
301 1HG2 VAL 41 1HG2 VAL 41 0.159 0.726 0.919
302 2HG2 VAL 41 2HG2 VAL 41 1.388 1.037 -0.308
303 3HG2 VAL 41 3HG2 VAL 41 1.791 1.188 1.402
304 H PHE 42 H PHE 42 -0.102 -3.385 2.769
305 HA PHE 42 HA PHE 42 2.014 -5.312 3.053
306 1HB PHE 42 2HB PHE 42 -0.978 -5.443 3.342
307 2HB PHE 42 1HB PHE 42 0.008 -6.900 3.379
308 HD1 PHE 42 1HD PHE 42 1.436 -7.385 5.234
309 HD2 PHE 42 2HD PHE 42 -0.834 -3.789 5.132
310 HE1 PHE 42 1HE PHE 42 1.881 -7.047 7.627
311 HE2 PHE 42 2HE PHE 42 -0.390 -3.443 7.528
312 HZ PHE 42 HZ PHE 42 0.969 -5.072 8.779
313 H VAL 43 H VAL 43 2.845 -6.472 1.497
314 HA VAL 43 HA VAL 43 1.253 -6.872 -0.949
315 HB VAL 43 HB VAL 43 4.257 -6.667 -0.880
316 1HG1 VAL 43 1HG1 VAL 43 2.223 -6.487 -3.084
317 2HG1 VAL 43 2HG1 VAL 43 3.375 -7.794 -2.803
318 3HG1 VAL 43 3HG1 VAL 43 3.949 -6.195 -3.277
319 1HG2 VAL 43 1HG2 VAL 43 3.997 -4.369 -1.740
320 2HG2 VAL 43 2HG2 VAL 43 3.434 -4.553 -0.080
321 3HG2 VAL 43 3HG2 VAL 43 2.269 -4.464 -1.401
322 HA PRO 44 HA PRO 44 2.004 -11.051 0.579
323 1HB PRO 44 2HB PRO 44 -0.001 -12.234 -0.771
324 2HB PRO 44 1HB PRO 44 -0.295 -11.206 0.630
325 1HG PRO 44 2HG PRO 44 -0.544 -10.548 -2.275
326 2HG PRO 44 1HG PRO 44 -1.631 -10.135 -0.935
327 1HD PRO 44 2HD PRO 44 0.207 -8.405 -1.981
328 2HD PRO 44 1HD PRO 44 -0.369 -8.332 -0.304
329 H ASN 45 H ASN 45 3.134 -9.810 -2.069
330 HA ASN 45 HA ASN 45 4.139 -12.309 -3.132
331 1HB ASN 45 2HB ASN 45 3.575 -11.297 -5.516
332 2HB ASN 45 1HB ASN 45 2.418 -12.308 -4.658
333 1HD2 ASN 45 1HD2 ASN 45 0.535 -11.423 -3.918
334 2HD2 ASN 45 2HD2 ASN 45 0.043 -9.804 -4.256
335 H ALA 46 H ALA 46 4.964 -9.756 -1.809
336 HA ALA 46 HA ALA 46 6.691 -8.412 -3.648
337 1HB ALA 46 1HB ALA 46 7.474 -7.214 -1.668
338 2HB ALA 46 2HB ALA 46 6.564 -8.318 -0.639
339 3HB ALA 46 3HB ALA 46 5.713 -7.242 -1.748
340 H GLU 47 H GLU 47 9.035 -8.162 -3.072
341 HA GLU 47 HA GLU 47 10.183 -10.706 -2.168
342 1HB GLU 47 2HB GLU 47 10.274 -9.749 -4.777
343 2HB GLU 47 1HB GLU 47 11.833 -9.287 -4.102
344 1HG GLU 47 2HG GLU 47 10.703 -12.067 -3.994
345 2HG GLU 47 1HG GLU 47 11.809 -11.492 -5.241
346 H LYS 48 H LYS 48 11.863 -10.539 -0.788
347 HA LYS 48 HA LYS 48 12.126 -8.140 0.684
348 1HB LYS 48 2HB LYS 48 12.401 -10.365 1.675
349 2HB LYS 48 1HB LYS 48 13.824 -10.649 0.688
350 1HG LYS 48 2HG LYS 48 13.780 -8.321 2.550
351 2HG LYS 48 1HG LYS 48 14.053 -9.942 3.186
352 1HD LYS 48 2HD LYS 48 15.925 -10.211 1.591
353 2HD LYS 48 1HD LYS 48 15.675 -8.548 1.061
354 1HE LYS 48 2HE LYS 48 17.475 -8.614 2.658
355 2HE LYS 48 1HE LYS 48 16.092 -7.784 3.368
356 1HZ LYS 48 1HZ LYS 48 16.787 -10.635 3.852
357 2HZ LYS 48 2HZ LYS 48 15.546 -9.760 4.603
358 3HZ LYS 48 3HZ LYS 48 17.166 -9.352 4.898
359 H GLY 49 H GLY 49 13.242 -6.404 0.211
360 1HA GLY 49 2HA GLY 49 15.133 -5.139 -0.261
361 2HA GLY 49 1HA GLY 49 15.966 -6.609 -0.744
362 H SER 50 H SER 50 13.009 -6.457 -2.273
363 HA SER 50 HA SER 50 14.322 -5.554 -4.736
364 1HB SER 50 2HB SER 50 13.324 -7.852 -4.656
365 2HB SER 50 1HB SER 50 11.742 -7.111 -4.435
366 HG SER 50 HG SER 50 13.354 -6.353 -6.623
367 H VAL 51 H VAL 51 12.937 -4.361 -6.294
368 HA VAL 51 HA VAL 51 11.161 -2.484 -4.872
369 HB VAL 51 HB VAL 51 12.755 -1.920 -7.385
370 1HG1 VAL 51 1HG1 VAL 51 10.704 -0.605 -7.133
371 2HG1 VAL 51 2HG1 VAL 51 12.146 0.402 -6.986
372 3HG1 VAL 51 3HG1 VAL 51 11.247 -0.069 -5.543
373 1HG2 VAL 51 1HG2 VAL 51 13.338 -1.141 -4.530
374 2HG2 VAL 51 2HG2 VAL 51 14.180 -0.509 -5.946
375 3HG2 VAL 51 3HG2 VAL 51 14.291 -2.223 -5.545
376 H ILE 52 H ILE 52 9.149 -3.186 -5.285
377 HA ILE 52 HA ILE 52 8.568 -4.249 -7.969
378 HB ILE 52 HB ILE 52 6.863 -5.614 -7.030
379 1HG1 ILE 52 2HG1 ILE 52 7.271 -4.028 -4.491
380 2HG1 ILE 52 1HG1 ILE 52 5.823 -4.104 -5.489
381 1HG2 ILE 52 1HG2 ILE 52 9.242 -5.643 -5.178
382 2HG2 ILE 52 2HG2 ILE 52 9.092 -6.515 -6.706
383 3HG2 ILE 52 3HG2 ILE 52 8.064 -6.948 -5.334
384 1HD1 ILE 52 1HD1 ILE 52 5.464 -6.390 -4.860
385 2HD1 ILE 52 2HD1 ILE 52 5.627 -5.385 -3.422
386 3HD1 ILE 52 3HD1 ILE 52 6.967 -6.406 -3.943
387 H ASN 53 H ASN 53 6.822 -3.506 -9.101
388 HA ASN 53 HA ASN 53 5.549 -1.061 -8.250
389 1HB ASN 53 2HB ASN 53 6.127 -1.364 -10.613
390 2HB ASN 53 1HB ASN 53 5.105 -2.794 -10.693
391 1HD2 ASN 53 1HD2 ASN 53 3.845 -1.913 -12.324
392 2HD2 ASN 53 2HD2 ASN 53 2.685 -0.669 -12.015
393 H VAL 54 H VAL 54 3.854 -1.069 -6.906
394 HA VAL 54 HA VAL 54 2.216 -3.510 -6.808
395 HB VAL 54 HB VAL 54 1.527 -2.837 -4.550
396 1HG1 VAL 54 1HG1 VAL 54 3.401 -4.352 -4.835
397 2HG1 VAL 54 2HG1 VAL 54 3.623 -3.327 -3.417
398 3HG1 VAL 54 3HG1 VAL 54 4.510 -2.982 -4.902
399 1HG2 VAL 54 1HG2 VAL 54 3.529 -0.603 -4.869
400 2HG2 VAL 54 2HG2 VAL 54 2.712 -1.045 -3.370
401 3HG2 VAL 54 3HG2 VAL 54 1.779 -0.425 -4.732
402 H LYS 55 H LYS 55 0.180 -3.455 -7.383
403 HA LYS 55 HA LYS 55 -1.142 -0.867 -7.734
404 1HB LYS 55 2HB LYS 55 -1.315 -2.401 -9.619
405 2HB LYS 55 1HB LYS 55 -1.958 -3.654 -8.575
406 1HG LYS 55 2HG LYS 55 -3.946 -2.279 -8.160
407 2HG LYS 55 1HG LYS 55 -3.299 -1.041 -9.238
408 1HD LYS 55 2HD LYS 55 -3.937 -3.882 -10.030
409 2HD LYS 55 1HD LYS 55 -4.963 -2.483 -10.348
410 1HE LYS 55 2HE LYS 55 -3.192 -1.483 -11.698
411 2HE LYS 55 1HE LYS 55 -2.147 -2.862 -11.361
412 1HZ LYS 55 1HZ LYS 55 -4.747 -2.999 -12.796
413 2HZ LYS 55 2HZ LYS 55 -3.682 -4.292 -12.524
414 3HZ LYS 55 3HZ LYS 55 -3.218 -3.011 -13.534
415 H VAL 56 H VAL 56 -1.977 -0.158 -5.880
416 HA VAL 56 HA VAL 56 -2.817 -1.851 -3.762
417 HB VAL 56 HB VAL 56 -3.537 1.055 -4.210
418 1HG1 VAL 56 1HG1 VAL 56 -3.518 -0.625 -1.707
419 2HG1 VAL 56 2HG1 VAL 56 -4.945 -0.033 -2.557
420 3HG1 VAL 56 3HG1 VAL 56 -3.844 1.107 -1.783
421 1HG2 VAL 56 1HG2 VAL 56 -1.218 -0.141 -2.696
422 2HG2 VAL 56 2HG2 VAL 56 -1.633 1.572 -2.774
423 3HG2 VAL 56 3HG2 VAL 56 -1.118 0.722 -4.231
424 H THR 57 H THR 57 -4.562 -3.100 -3.810
425 HA THR 57 HA THR 57 -6.807 -2.267 -5.513
426 HB THR 57 HB THR 57 -7.392 -4.739 -5.453
427 HG1 THR 57 1HG THR 57 -5.498 -6.077 -4.961
428 1HG2 THR 57 1HG2 THR 57 -6.360 -3.690 -7.403
429 2HG2 THR 57 2HG2 THR 57 -5.707 -5.311 -7.159
430 3HG2 THR 57 3HG2 THR 57 -4.762 -3.900 -6.685
431 H ALA 58 H ALA 58 -5.908 -2.849 -2.272
432 HA ALA 58 HA ALA 58 -8.682 -2.566 -1.433
433 1HB ALA 58 1HB ALA 58 -8.550 -4.396 0.160
434 2HB ALA 58 2HB ALA 58 -6.912 -4.767 -0.373
435 3HB ALA 58 3HB ALA 58 -8.268 -4.987 -1.478
436 H VAL 59 H VAL 59 -8.169 -0.515 -0.723
437 HA VAL 59 HA VAL 59 -6.124 -0.143 1.295
438 HB VAL 59 HB VAL 59 -8.256 1.851 0.523
439 1HG1 VAL 59 1HG1 VAL 59 -6.616 3.499 1.274
440 2HG1 VAL 59 2HG1 VAL 59 -5.479 2.206 1.655
441 3HG1 VAL 59 3HG1 VAL 59 -6.986 2.348 2.559
442 1HG2 VAL 59 1HG2 VAL 59 -6.684 2.769 -1.109
443 2HG2 VAL 59 2HG2 VAL 59 -7.123 1.109 -1.512
444 3HG2 VAL 59 3HG2 VAL 59 -5.560 1.453 -0.771
445 H LYS 60 H LYS 60 -6.431 -0.259 3.431
446 HA LYS 60 HA LYS 60 -9.186 -0.579 4.423
447 1HB LYS 60 2HB LYS 60 -6.567 -1.432 5.674
448 2HB LYS 60 1HB LYS 60 -8.154 -1.665 6.389
449 1HG LYS 60 2HG LYS 60 -7.203 -2.885 3.808
450 2HG LYS 60 1HG LYS 60 -7.302 -3.707 5.366
451 1HD LYS 60 2HD LYS 60 -9.751 -3.220 5.381
452 2HD LYS 60 1HD LYS 60 -9.584 -2.596 3.739
453 1HE LYS 60 2HE LYS 60 -8.723 -4.783 3.017
454 2HE LYS 60 1HE LYS 60 -8.944 -5.397 4.655
455 1HZ LYS 60 1HZ LYS 60 -11.344 -4.846 4.414
456 2HZ LYS 60 2HZ LYS 60 -10.805 -6.067 3.367
457 3HZ LYS 60 3HZ LYS 60 -11.059 -4.497 2.774
458 H GLU 61 H GLU 61 -8.914 -0.026 7.035
459 HA GLU 61 HA GLU 61 -8.767 2.823 7.050
460 1HB GLU 61 2HB GLU 61 -8.944 2.086 9.696
461 2HB GLU 61 1HB GLU 61 -10.293 2.424 8.624
462 1HG GLU 61 2HG GLU 61 -10.752 0.376 9.721
463 2HG GLU 61 1HG GLU 61 -10.346 -0.013 8.054
464 H LYS 62 H LYS 62 -6.741 0.238 8.361
465 HA LYS 62 HA LYS 62 -4.907 2.202 9.513
466 1HB LYS 62 2HB LYS 62 -4.690 -0.810 9.502
467 2HB LYS 62 1HB LYS 62 -3.730 0.304 10.460
468 1HG LYS 62 2HG LYS 62 -5.799 0.992 11.640
469 2HG LYS 62 1HG LYS 62 -6.671 -0.260 10.747
470 1HD LYS 62 2HD LYS 62 -5.061 -1.931 11.663
471 2HD LYS 62 1HD LYS 62 -4.377 -0.650 12.663
472 1HE LYS 62 2HE LYS 62 -5.923 -1.871 14.006
473 2HE LYS 62 1HE LYS 62 -6.646 -0.306 13.640
474 1HZ LYS 62 1HZ LYS 62 -8.227 -2.129 13.405
475 2HZ LYS 62 2HZ LYS 62 -7.253 -2.841 12.215
476 3HZ LYS 62 3HZ LYS 62 -7.980 -1.337 11.924
477 H PHE 63 H PHE 63 -4.948 -0.282 7.011
478 HA PHE 63 HA PHE 63 -2.514 0.838 5.849
479 1HB PHE 63 2HB PHE 63 -1.631 -1.559 5.609
480 2HB PHE 63 1HB PHE 63 -1.505 -0.812 7.197
481 HD1 PHE 63 1HD PHE 63 -2.440 -1.827 9.070
482 HD2 PHE 63 2HD PHE 63 -3.574 -3.152 5.186
483 HE1 PHE 63 1HE PHE 63 -3.636 -3.728 10.071
484 HE2 PHE 63 2HE PHE 63 -4.771 -5.056 6.184
485 HZ PHE 63 HZ PHE 63 -4.803 -5.344 8.629
486 H ALA 64 H ALA 64 -2.030 -0.971 3.871
487 HA ALA 64 HA ALA 64 -4.594 -1.394 2.520
488 1HB ALA 64 1HB ALA 64 -2.271 0.095 1.305
489 2HB ALA 64 2HB ALA 64 -3.825 0.787 1.769
490 3HB ALA 64 3HB ALA 64 -3.738 -0.387 0.455
491 H PHE 65 H PHE 65 -4.485 -2.837 0.723
492 HA PHE 65 HA PHE 65 -2.124 -4.603 0.752
493 1HB PHE 65 2HB PHE 65 -4.995 -5.249 0.026
494 2HB PHE 65 1HB PHE 65 -3.647 -6.374 -0.098
495 HD1 PHE 65 1HD PHE 65 -2.403 -6.970 2.038
496 HD2 PHE 65 2HD PHE 65 -6.193 -5.038 2.009
497 HE1 PHE 65 1HE PHE 65 -2.784 -7.689 4.362
498 HE2 PHE 65 2HE PHE 65 -6.579 -5.749 4.332
499 HZ PHE 65 HZ PHE 65 -4.873 -7.079 5.510
500 H ALA 66 H ALA 66 -1.141 -5.067 -1.177
501 HA ALA 66 HA ALA 66 -2.349 -4.048 -3.639
502 1HB ALA 66 1HB ALA 66 -0.355 -2.842 -4.277
503 2HB ALA 66 2HB ALA 66 0.437 -3.299 -2.769
504 3HB ALA 66 3HB ALA 66 -0.960 -2.224 -2.741
505 H GLU 67 H GLU 67 -1.289 -4.847 -5.577
506 HA GLU 67 HA GLU 67 0.121 -7.379 -5.071
507 1HB GLU 67 2HB GLU 67 -0.796 -8.188 -7.199
508 2HB GLU 67 1HB GLU 67 -2.071 -7.735 -6.077
509 1HG GLU 67 2HG GLU 67 -2.454 -5.686 -7.256
510 2HG GLU 67 1HG GLU 67 -1.067 -5.976 -8.299
511 H ARG 68 H ARG 68 2.005 -7.746 -5.988
512 HA ARG 68 HA ARG 68 3.489 -5.782 -7.368
513 1HB ARG 68 2HB ARG 68 4.780 -7.312 -6.186
514 2HB ARG 68 1HB ARG 68 3.839 -8.692 -6.709
515 1HG ARG 68 2HG ARG 68 4.841 -8.492 -8.945
516 2HG ARG 68 1HG ARG 68 5.804 -7.129 -8.372
517 1HD ARG 68 2HD ARG 68 6.906 -8.552 -6.746
518 2HD ARG 68 1HD ARG 68 5.890 -9.914 -7.217
519 HE ARG 68 HE ARG 68 7.009 -9.401 -9.538
520 1HH1 ARG 68 1HH1 ARG 68 8.480 -9.471 -6.361
521 2HH1 ARG 68 2HH1 ARG 68 10.066 -9.859 -6.960
522 1HH2 ARG 68 1HH2 ARG 68 9.079 -9.975 -10.323
523 2HH2 ARG 68 2HH2 ARG 68 10.394 -10.197 -9.204
524 H VAL 69 H VAL 69 3.030 -5.097 -9.346
525 HA VAL 69 HA VAL 69 1.443 -6.683 -11.166
526 HB VAL 69 HB VAL 69 2.632 -4.000 -11.823
527 1HG1 VAL 69 1HG1 VAL 69 0.542 -3.704 -13.067
528 2HG1 VAL 69 2HG1 VAL 69 0.021 -5.316 -12.569
529 3HG1 VAL 69 3HG1 VAL 69 1.433 -5.125 -13.611
530 1HG2 VAL 69 1HG2 VAL 69 0.722 -2.922 -10.752
531 2HG2 VAL 69 2HG2 VAL 69 1.700 -3.806 -9.577
532 3HG2 VAL 69 3HG2 VAL 69 0.173 -4.485 -10.146
533 H LEU 70 H LEU 70 4.255 -7.480 -10.596
534 HA LEU 70 HA LEU 70 5.092 -7.729 -13.382
535 1HB LEU 70 2HB LEU 70 7.488 -7.503 -12.692
536 2HB LEU 70 1HB LEU 70 6.563 -6.019 -12.652
537 HG LEU 70 HG LEU 70 6.993 -7.606 -10.138
538 1HD1 LEU 70 1HD1 LEU 70 8.982 -6.229 -9.699
539 2HD1 LEU 70 2HD1 LEU 70 8.868 -5.562 -11.327
540 3HD1 LEU 70 3HD1 LEU 70 9.207 -7.277 -11.103
541 1HD2 LEU 70 1HD2 LEU 70 6.739 -5.422 -9.096
542 2HD2 LEU 70 2HD2 LEU 70 5.357 -5.778 -10.132
543 3HD2 LEU 70 3HD2 LEU 70 6.609 -4.664 -10.683
Start of MODEL 3
1 1H MET 1 1H MET 1 -6.536 21.054 14.834
2 2H MET 1 2H MET 1 -7.500 19.678 14.620
3 3H MET 1 3H MET 1 -8.229 21.187 14.876
4 HA MET 1 HA MET 1 -7.320 21.998 12.795
5 1HB MET 1 2HB MET 1 -5.369 20.464 12.761
6 2HB MET 1 1HB MET 1 -6.454 19.124 12.413
7 1HG MET 1 2HG MET 1 -7.114 20.224 10.321
8 2HG MET 1 1HG MET 1 -5.988 21.533 10.671
9 1HE MET 1 1HE MET 1 -5.890 20.032 7.922
10 2HE MET 1 2HE MET 1 -4.162 19.729 7.739
11 3HE MET 1 3HE MET 1 -4.722 21.275 8.373
12 H ALA 2 H ALA 2 -8.685 18.734 13.313
13 HA ALA 2 HA ALA 2 -11.105 19.612 11.950
14 1HB ALA 2 1HB ALA 2 -9.717 18.645 10.176
15 2HB ALA 2 2HB ALA 2 -11.170 17.690 10.470
16 3HB ALA 2 3HB ALA 2 -9.613 17.139 11.089
17 H PHE 3 H PHE 3 -12.422 17.228 11.806
18 HA PHE 3 HA PHE 3 -12.990 16.739 14.596
19 1HB PHE 3 2HB PHE 3 -14.847 15.294 13.584
20 2HB PHE 3 1HB PHE 3 -14.929 17.025 13.288
21 HD1 PHE 3 1HD PHE 3 -14.544 17.927 11.068
22 HD2 PHE 3 2HD PHE 3 -14.387 13.733 11.788
23 HE1 PHE 3 1HE PHE 3 -14.683 17.509 8.649
24 HE2 PHE 3 2HE PHE 3 -14.523 13.310 9.369
25 HZ PHE 3 HZ PHE 3 -14.671 15.198 7.797
26 H GLY 4 H GLY 4 -10.547 15.823 14.241
27 1HA GLY 4 2HA GLY 4 -9.527 13.832 15.030
28 2HA GLY 4 1HA GLY 4 -10.882 12.912 14.388
29 H LYS 5 H LYS 5 -11.108 13.208 11.914
30 HA LYS 5 HA LYS 5 -8.437 13.043 10.688
31 1HB LYS 5 2HB LYS 5 -9.373 10.801 10.876
32 2HB LYS 5 1HB LYS 5 -10.869 11.329 10.120
33 1HG LYS 5 2HG LYS 5 -9.591 11.826 8.055
34 2HG LYS 5 1HG LYS 5 -8.156 11.151 8.828
35 1HD LYS 5 2HD LYS 5 -9.207 8.997 9.017
36 2HD LYS 5 1HD LYS 5 -10.734 9.645 8.413
37 1HE LYS 5 2HE LYS 5 -9.594 8.450 6.649
38 2HE LYS 5 1HE LYS 5 -9.642 10.171 6.275
39 1HZ LYS 5 1HZ LYS 5 -7.338 10.276 7.237
40 2HZ LYS 5 2HZ LYS 5 -7.483 9.442 5.771
41 3HZ LYS 5 3HZ LYS 5 -7.326 8.576 7.221
42 HA PRO 6 HA PRO 6 -10.484 16.051 8.056
43 1HB PRO 6 2HB PRO 6 -8.125 17.169 7.187
44 2HB PRO 6 1HB PRO 6 -8.966 17.623 8.668
45 1HG PRO 6 2HG PRO 6 -6.444 16.268 8.377
46 2HG PRO 6 1HG PRO 6 -7.234 16.824 9.860
47 1HD PRO 6 2HD PRO 6 -7.125 14.127 8.703
48 2HD PRO 6 1HD PRO 6 -7.549 14.629 10.354
49 H ALA 7 H ALA 7 -9.321 16.946 5.769
50 HA ALA 7 HA ALA 7 -9.518 14.596 4.037
51 1HB ALA 7 1HB ALA 7 -10.099 16.149 2.292
52 2HB ALA 7 2HB ALA 7 -9.666 17.519 3.315
53 3HB ALA 7 3HB ALA 7 -11.060 16.519 3.724
54 H MET 8 H MET 8 -8.315 16.300 1.849
55 HA MET 8 HA MET 8 -6.331 16.763 0.862
56 1HB MET 8 2HB MET 8 -5.246 16.794 3.686
57 2HB MET 8 1HB MET 8 -4.356 17.312 2.261
58 1HG MET 8 2HG MET 8 -5.906 19.106 1.881
59 2HG MET 8 1HG MET 8 -6.926 18.550 3.208
60 1HE MET 8 1HE MET 8 -5.379 21.934 4.499
61 2HE MET 8 2HE MET 8 -6.863 21.082 4.074
62 3HE MET 8 3HE MET 8 -5.730 21.561 2.810
63 H LYS 9 H LYS 9 -7.252 14.052 1.700
64 HA LYS 9 HA LYS 9 -6.622 11.883 1.633
65 1HB LYS 9 2HB LYS 9 -4.552 13.103 -0.181
66 2HB LYS 9 1HB LYS 9 -4.636 11.374 0.107
67 1HG LYS 9 2HG LYS 9 -6.857 13.054 -1.038
68 2HG LYS 9 1HG LYS 9 -5.755 12.043 -1.971
69 1HD LYS 9 2HD LYS 9 -7.736 11.110 0.111
70 2HD LYS 9 1HD LYS 9 -7.865 10.883 -1.632
71 1HE LYS 9 2HE LYS 9 -5.715 9.725 0.142
72 2HE LYS 9 1HE LYS 9 -7.110 8.848 -0.483
73 1HZ LYS 9 1HZ LYS 9 -5.050 8.477 -1.755
74 2HZ LYS 9 2HZ LYS 9 -5.032 10.112 -2.181
75 3HZ LYS 9 3HZ LYS 9 -6.301 9.116 -2.706
76 H ASN 10 H ASN 10 -6.129 11.838 3.900
77 HA ASN 10 HA ASN 10 -3.346 11.848 4.691
78 1HB ASN 10 2HB ASN 10 -5.929 11.162 6.065
79 2HB ASN 10 1HB ASN 10 -4.394 10.704 6.792
80 1HD2 ASN 10 1HD2 ASN 10 -2.927 13.003 5.947
81 2HD2 ASN 10 2HD2 ASN 10 -3.518 14.345 6.864
82 H VAL 11 H VAL 11 -3.730 10.328 2.520
83 HA VAL 11 HA VAL 11 -2.892 7.679 3.225
84 HB VAL 11 HB VAL 11 -5.578 8.119 1.880
85 1HG1 VAL 11 1HG1 VAL 11 -5.620 5.710 1.416
86 2HG1 VAL 11 2HG1 VAL 11 -3.973 5.567 2.029
87 3HG1 VAL 11 3HG1 VAL 11 -4.292 6.509 0.575
88 1HG2 VAL 11 1HG2 VAL 11 -6.399 6.516 3.557
89 2HG2 VAL 11 2HG2 VAL 11 -5.724 7.970 4.292
90 3HG2 VAL 11 3HG2 VAL 11 -4.792 6.473 4.283
91 HA PRO 12 HA PRO 12 -0.825 9.409 -0.379
92 1HB PRO 12 2HB PRO 12 1.172 7.565 -0.461
93 2HB PRO 12 1HB PRO 12 1.137 8.899 0.689
94 1HG PRO 12 2HG PRO 12 0.327 6.052 1.090
95 2HG PRO 12 1HG PRO 12 1.294 7.095 2.149
96 1HD PRO 12 2HD PRO 12 -1.317 6.635 2.604
97 2HD PRO 12 1HD PRO 12 -0.564 8.203 2.967
98 H VAL 13 H VAL 13 -1.752 6.085 0.024
99 HA VAL 13 HA VAL 13 -1.355 5.389 -2.735
100 HB VAL 13 HB VAL 13 -2.454 3.231 -2.036
101 1HG1 VAL 13 1HG1 VAL 13 -0.050 3.434 -2.021
102 2HG1 VAL 13 2HG1 VAL 13 -0.566 2.521 -0.601
103 3HG1 VAL 13 3HG1 VAL 13 -0.097 4.214 -0.441
104 1HG2 VAL 13 1HG2 VAL 13 -3.826 4.142 -0.227
105 2HG2 VAL 13 2HG2 VAL 13 -2.362 4.549 0.676
106 3HG2 VAL 13 3HG2 VAL 13 -2.771 2.859 0.365
107 H GLU 14 H GLU 14 -3.123 4.467 -4.024
108 HA GLU 14 HA GLU 14 -5.808 5.394 -3.408
109 1HB GLU 14 2HB GLU 14 -4.581 7.216 -4.706
110 2HB GLU 14 1HB GLU 14 -4.523 6.091 -6.055
111 1HG GLU 14 2HG GLU 14 -6.355 7.592 -6.371
112 2HG GLU 14 1HG GLU 14 -6.996 5.988 -6.013
113 H ALA 15 H ALA 15 -7.100 3.729 -3.777
114 HA ALA 15 HA ALA 15 -6.217 1.311 -4.864
115 1HB ALA 15 1HB ALA 15 -9.052 2.263 -4.500
116 2HB ALA 15 2HB ALA 15 -8.058 1.472 -3.277
117 3HB ALA 15 3HB ALA 15 -8.541 0.591 -4.726
118 H GLY 16 H GLY 16 -5.798 0.782 -6.868
119 1HA GLY 16 2HA GLY 16 -6.822 0.398 -9.084
120 2HA GLY 16 1HA GLY 16 -7.361 2.068 -9.021
121 H LYS 17 H LYS 17 -4.732 2.834 -7.768
122 HA LYS 17 HA LYS 17 -3.302 3.137 -10.291
123 1HB LYS 17 2HB LYS 17 -2.847 4.376 -7.572
124 2HB LYS 17 1HB LYS 17 -1.856 4.703 -8.985
125 1HG LYS 17 2HG LYS 17 -3.840 5.585 -10.140
126 2HG LYS 17 1HG LYS 17 -4.785 5.316 -8.675
127 1HD LYS 17 2HD LYS 17 -4.105 7.624 -8.749
128 2HD LYS 17 1HD LYS 17 -3.227 6.809 -7.455
129 1HE LYS 17 2HE LYS 17 -1.314 6.525 -9.033
130 2HE LYS 17 1HE LYS 17 -2.190 7.523 -10.194
131 1HZ LYS 17 1HZ LYS 17 -2.200 9.313 -8.501
132 2HZ LYS 17 2HZ LYS 17 -0.643 8.883 -9.014
133 3HZ LYS 17 3HZ LYS 17 -1.214 8.350 -7.512
134 H GLU 18 H GLU 18 -1.013 2.767 -10.428
135 HA GLU 18 HA GLU 18 -0.132 0.547 -8.703
136 1HB GLU 18 2HB GLU 18 0.721 1.082 -11.557
137 2HB GLU 18 1HB GLU 18 1.143 -0.312 -10.574
138 1HG GLU 18 2HG GLU 18 -1.248 -0.941 -10.518
139 2HG GLU 18 1HG GLU 18 -1.587 0.393 -11.613
140 H TYR 19 H TYR 19 1.694 0.813 -7.588
141 HA TYR 19 HA TYR 19 3.323 3.202 -8.168
142 1HB TYR 19 2HB TYR 19 2.593 2.074 -5.465
143 2HB TYR 19 1HB TYR 19 3.678 3.431 -5.741
144 HD1 TYR 19 1HD TYR 19 2.674 5.468 -6.995
145 HD2 TYR 19 2HD TYR 19 0.333 2.453 -5.123
146 HE1 TYR 19 1HE TYR 19 0.773 7.018 -6.887
147 HE2 TYR 19 2HE TYR 19 -1.574 3.988 -5.018
148 HH TYR 19 HH TYR 19 -1.869 6.566 -4.972
149 H GLU 20 H GLU 20 5.485 3.034 -8.001
150 HA GLU 20 HA GLU 20 6.667 0.399 -7.857
151 1HB GLU 20 2HB GLU 20 7.418 2.114 -9.479
152 2HB GLU 20 1HB GLU 20 7.925 3.138 -8.146
153 1HG GLU 20 2HG GLU 20 9.514 1.347 -7.472
154 2HG GLU 20 1HG GLU 20 9.087 0.490 -8.955
155 H VAL 21 H VAL 21 7.094 -0.500 -5.896
156 HA VAL 21 HA VAL 21 7.722 1.353 -3.679
157 HB VAL 21 HB VAL 21 6.524 -0.129 -2.140
158 1HG1 VAL 21 1HG1 VAL 21 5.324 1.742 -3.146
159 2HG1 VAL 21 2HG1 VAL 21 4.249 0.371 -2.864
160 3HG1 VAL 21 3HG1 VAL 21 4.834 0.709 -4.493
161 1HG2 VAL 21 1HG2 VAL 21 6.822 -2.232 -3.342
162 2HG2 VAL 21 2HG2 VAL 21 5.733 -1.667 -4.610
163 3HG2 VAL 21 3HG2 VAL 21 5.120 -1.941 -2.979
164 H THR 22 H THR 22 9.123 0.635 -2.068
165 HA THR 22 HA THR 22 10.915 -1.534 -2.864
166 HB THR 22 HB THR 22 11.296 0.464 -0.623
167 HG1 THR 22 1HG THR 22 11.207 1.022 -3.172
168 1HG2 THR 22 1HG2 THR 22 12.729 -1.477 -0.434
169 2HG2 THR 22 2HG2 THR 22 13.691 -0.088 -0.942
170 3HG2 THR 22 3HG2 THR 22 13.224 -1.314 -2.120
171 H ILE 23 H ILE 23 11.581 -3.107 -1.235
172 HA ILE 23 HA ILE 23 9.467 -3.656 0.724
173 HB ILE 23 HB ILE 23 10.944 -5.808 -0.789
174 1HG1 ILE 23 2HG1 ILE 23 9.660 -4.471 -2.422
175 2HG1 ILE 23 1HG1 ILE 23 8.979 -6.082 -2.224
176 1HG2 ILE 23 1HG2 ILE 23 9.082 -7.213 -0.013
177 2HG2 ILE 23 2HG2 ILE 23 8.404 -5.823 0.836
178 3HG2 ILE 23 3HG2 ILE 23 9.967 -6.478 1.324
179 1HD1 ILE 23 1HD1 ILE 23 7.245 -4.389 -2.373
180 2HD1 ILE 23 2HD1 ILE 23 7.921 -3.561 -0.969
181 3HD1 ILE 23 3HD1 ILE 23 7.231 -5.176 -0.794
182 H GLU 24 H GLU 24 11.224 -2.362 1.827
183 HA GLU 24 HA GLU 24 13.688 -3.592 2.494
184 1HB GLU 24 2HB GLU 24 12.134 -1.313 3.684
185 2HB GLU 24 1HB GLU 24 13.624 -1.884 4.425
186 1HG GLU 24 2HG GLU 24 13.316 -0.847 1.617
187 2HG GLU 24 1HG GLU 24 14.042 0.012 2.977
188 H ASP 25 H ASP 25 10.518 -4.132 3.601
189 HA ASP 25 HA ASP 25 11.570 -5.601 5.922
190 1HB ASP 25 2HB ASP 25 9.082 -3.899 5.792
191 2HB ASP 25 1HB ASP 25 9.392 -5.057 7.081
192 H MET 26 H MET 26 10.830 -7.606 6.234
193 HA MET 26 HA MET 26 8.621 -8.536 4.521
194 1HB MET 26 2HB MET 26 11.105 -10.000 5.411
195 2HB MET 26 1HB MET 26 9.711 -10.811 4.715
196 1HG MET 26 2HG MET 26 11.341 -8.682 3.348
197 2HG MET 26 1HG MET 26 11.502 -10.415 3.093
198 1HE MET 26 1HE MET 26 8.482 -11.407 3.173
199 2HE MET 26 2HE MET 26 9.663 -11.939 1.975
200 3HE MET 26 3HE MET 26 8.082 -11.351 1.458
201 H GLY 27 H GLY 27 7.059 -9.782 5.452
202 1HA GLY 27 2HA GLY 27 6.828 -9.580 8.326
203 2HA GLY 27 1HA GLY 27 5.624 -10.229 7.223
204 H LYS 28 H LYS 28 6.343 -12.328 6.145
205 HA LYS 28 HA LYS 28 8.205 -14.001 7.452
206 1HB LYS 28 2HB LYS 28 6.371 -13.874 9.159
207 2HB LYS 28 1HB LYS 28 5.339 -14.680 7.992
208 1HG LYS 28 2HG LYS 28 6.765 -16.628 8.007
209 2HG LYS 28 1HG LYS 28 7.895 -15.821 9.096
210 1HD LYS 28 2HD LYS 28 5.014 -16.423 9.747
211 2HD LYS 28 1HD LYS 28 6.383 -17.415 10.248
212 1HE LYS 28 2HE LYS 28 7.279 -15.622 11.564
213 2HE LYS 28 1HE LYS 28 6.074 -14.497 10.938
214 1HZ LYS 28 1HZ LYS 28 5.554 -15.316 13.176
215 2HZ LYS 28 2HZ LYS 28 5.447 -16.899 12.577
216 3HZ LYS 28 3HZ LYS 28 4.351 -15.712 12.051
217 H GLY 29 H GLY 29 8.567 -13.978 5.204
218 1HA GLY 29 2HA GLY 29 8.923 -15.477 3.465
219 2HA GLY 29 1HA GLY 29 7.594 -16.451 4.074
220 H GLY 30 H GLY 30 5.406 -15.167 3.882
221 1HA GLY 30 2HA GLY 30 5.276 -14.452 1.015
222 2HA GLY 30 1HA GLY 30 4.019 -15.325 1.875
223 H ASP 31 H ASP 31 5.748 -12.483 2.988
224 HA ASP 31 HA ASP 31 3.582 -10.696 2.352
225 1HB ASP 31 2HB ASP 31 2.704 -11.703 4.405
226 2HB ASP 31 1HB ASP 31 4.205 -11.344 5.246
227 H GLY 32 H GLY 32 4.601 -8.963 1.669
228 1HA GLY 32 2HA GLY 32 7.111 -8.203 3.024
229 2HA GLY 32 1HA GLY 32 6.772 -7.883 1.330
230 H ILE 33 H ILE 33 7.388 -6.131 3.687
231 HA ILE 33 HA ILE 33 4.925 -4.559 3.831
232 HB ILE 33 HB ILE 33 7.434 -4.515 5.503
233 1HG1 ILE 33 2HG1 ILE 33 5.680 -4.740 7.348
234 2HG1 ILE 33 1HG1 ILE 33 4.520 -5.061 6.067
235 1HG2 ILE 33 1HG2 ILE 33 6.477 -2.627 6.753
236 2HG2 ILE 33 2HG2 ILE 33 5.201 -2.493 5.543
237 3HG2 ILE 33 3HG2 ILE 33 6.883 -2.205 5.088
238 1HD1 ILE 33 1HD1 ILE 33 5.322 -7.112 7.082
239 2HD1 ILE 33 2HD1 ILE 33 6.981 -6.688 6.663
240 3HD1 ILE 33 3HD1 ILE 33 5.806 -7.014 5.390
241 H ALA 34 H ALA 34 4.871 -3.499 1.905
242 HA ALA 34 HA ALA 34 7.078 -1.640 1.352
243 1HB ALA 34 1HB ALA 34 5.971 -1.240 -0.771
244 2HB ALA 34 2HB ALA 34 4.598 -2.224 -0.263
245 3HB ALA 34 3HB ALA 34 6.170 -2.976 -0.530
246 H ARG 35 H ARG 35 6.979 0.346 1.947
247 HA ARG 35 HA ARG 35 4.380 1.302 2.892
248 1HB ARG 35 2HB ARG 35 6.311 2.714 4.278
249 2HB ARG 35 1HB ARG 35 5.256 1.475 4.915
250 1HG ARG 35 2HG ARG 35 7.003 -0.195 4.349
251 2HG ARG 35 1HG ARG 35 8.056 1.143 3.874
252 1HD ARG 35 2HD ARG 35 7.777 2.103 6.138
253 2HD ARG 35 1HD ARG 35 6.839 0.683 6.595
254 HE ARG 35 HE ARG 35 9.063 -0.505 5.853
255 1HH1 ARG 35 1HH1 ARG 35 8.713 2.498 7.627
256 2HH1 ARG 35 2HH1 ARG 35 10.178 2.275 8.532
257 1HH2 ARG 35 1HH2 ARG 35 11.007 -0.778 7.019
258 2HH2 ARG 35 2HH2 ARG 35 11.490 0.439 8.180
259 H ILE 36 H ILE 36 3.671 2.711 1.530
260 HA ILE 36 HA ILE 36 5.438 4.497 0.090
261 HB ILE 36 HB ILE 36 2.437 4.148 0.082
262 1HG1 ILE 36 2HG1 ILE 36 4.598 3.552 -1.943
263 2HG1 ILE 36 1HG1 ILE 36 3.695 2.372 -1.000
264 1HG2 ILE 36 1HG2 ILE 36 2.385 5.717 -1.810
265 2HG2 ILE 36 2HG2 ILE 36 4.098 6.063 -1.559
266 3HG2 ILE 36 3HG2 ILE 36 2.920 6.499 -0.322
267 1HD1 ILE 36 1HD1 ILE 36 1.645 3.051 -2.126
268 2HD1 ILE 36 2HD1 ILE 36 2.870 2.495 -3.267
269 3HD1 ILE 36 3HD1 ILE 36 2.562 4.221 -3.072
270 H ASP 37 H ASP 37 6.162 6.245 1.000
271 HA ASP 37 HA ASP 37 6.429 8.032 2.387
272 1HB ASP 37 2HB ASP 37 4.463 8.862 1.114
273 2HB ASP 37 1HB ASP 37 3.400 8.155 2.325
274 H GLY 38 H GLY 38 5.852 5.248 3.473
275 1HA GLY 38 2HA GLY 38 6.284 4.618 5.742
276 2HA GLY 38 1HA GLY 38 5.505 6.103 6.267
277 H PHE 39 H PHE 39 3.490 5.203 4.005
278 HA PHE 39 HA PHE 39 1.596 4.042 5.823
279 1HB PHE 39 2HB PHE 39 0.956 5.685 4.073
280 2HB PHE 39 1HB PHE 39 1.395 4.514 2.838
281 HD1 PHE 39 1HD PHE 39 -1.054 5.453 5.365
282 HD2 PHE 39 2HD PHE 39 0.003 2.599 2.390
283 HE1 PHE 39 1HE PHE 39 -3.352 4.579 5.392
284 HE2 PHE 39 2HE PHE 39 -2.290 1.726 2.414
285 HZ PHE 39 HZ PHE 39 -3.965 2.718 3.907
286 H VAL 40 H VAL 40 1.574 1.953 6.288
287 HA VAL 40 HA VAL 40 3.163 0.080 4.892
288 HB VAL 40 HB VAL 40 1.010 -0.548 6.907
289 1HG1 VAL 40 1HG1 VAL 40 2.416 -2.513 7.377
290 2HG1 VAL 40 2HG1 VAL 40 3.515 -2.023 6.088
291 3HG1 VAL 40 3HG1 VAL 40 1.859 -2.487 5.704
292 1HG2 VAL 40 1HG2 VAL 40 2.744 -0.370 8.614
293 2HG2 VAL 40 2HG2 VAL 40 2.511 1.172 7.786
294 3HG2 VAL 40 3HG2 VAL 40 3.901 0.159 7.395
295 H VAL 41 H VAL 41 2.684 -0.597 2.959
296 HA VAL 41 HA VAL 41 -0.059 -1.456 2.342
297 HB VAL 41 HB VAL 41 2.216 -1.023 0.386
298 1HG1 VAL 41 1HG1 VAL 41 0.441 -2.457 -0.422
299 2HG1 VAL 41 2HG1 VAL 41 0.407 -0.905 -1.263
300 3HG1 VAL 41 3HG1 VAL 41 -0.766 -1.243 0.011
301 1HG2 VAL 41 1HG2 VAL 41 0.032 0.906 1.176
302 2HG2 VAL 41 2HG2 VAL 41 1.159 1.130 -0.163
303 3HG2 VAL 41 3HG2 VAL 41 1.758 1.087 1.495
304 H PHE 42 H PHE 42 -0.318 -3.568 2.721
305 HA PHE 42 HA PHE 42 1.915 -5.340 2.975
306 1HB PHE 42 2HB PHE 42 -1.064 -5.730 3.162
307 2HB PHE 42 1HB PHE 42 0.062 -7.081 3.271
308 HD1 PHE 42 1HD PHE 42 -1.464 -4.327 5.015
309 HD2 PHE 42 2HD PHE 42 1.780 -7.082 5.087
310 HE1 PHE 42 1HE PHE 42 -1.135 -3.878 7.414
311 HE2 PHE 42 2HE PHE 42 2.113 -6.649 7.478
312 HZ PHE 42 HZ PHE 42 0.652 -5.039 8.649
313 H VAL 43 H VAL 43 2.655 -6.872 1.637
314 HA VAL 43 HA VAL 43 1.344 -7.107 -0.989
315 HB VAL 43 HB VAL 43 4.331 -6.933 -0.668
316 1HG1 VAL 43 1HG1 VAL 43 2.533 -6.598 -3.060
317 2HG1 VAL 43 2HG1 VAL 43 3.507 -8.020 -2.685
318 3HG1 VAL 43 3HG1 VAL 43 4.290 -6.486 -3.051
319 1HG2 VAL 43 1HG2 VAL 43 3.448 -4.806 0.094
320 2HG2 VAL 43 2HG2 VAL 43 2.445 -4.678 -1.353
321 3HG2 VAL 43 3HG2 VAL 43 4.202 -4.615 -1.490
322 HA PRO 44 HA PRO 44 1.974 -11.361 0.292
323 1HB PRO 44 2HB PRO 44 0.472 -12.496 -1.648
324 2HB PRO 44 1HB PRO 44 -0.235 -11.686 -0.246
325 1HG PRO 44 2HG PRO 44 0.144 -10.668 -3.035
326 2HG PRO 44 1HG PRO 44 -1.250 -10.475 -1.954
327 1HD PRO 44 2HD PRO 44 0.620 -8.536 -2.352
328 2HD PRO 44 1HD PRO 44 -0.296 -8.711 -0.842
329 H ASN 45 H ASN 45 3.095 -9.872 -2.556
330 HA ASN 45 HA ASN 45 4.501 -12.337 -3.352
331 1HB ASN 45 2HB ASN 45 3.492 -10.170 -5.199
332 2HB ASN 45 1HB ASN 45 4.387 -11.599 -5.691
333 1HD2 ASN 45 1HD2 ASN 45 2.940 -13.325 -3.792
334 2HD2 ASN 45 2HD2 ASN 45 1.365 -13.558 -4.481
335 H ALA 46 H ALA 46 5.046 -9.630 -1.853
336 HA ALA 46 HA ALA 46 7.138 -8.381 -3.307
337 1HB ALA 46 1HB ALA 46 7.583 -7.201 -1.197
338 2HB ALA 46 2HB ALA 46 6.443 -8.272 -0.380
339 3HB ALA 46 3HB ALA 46 5.876 -7.175 -1.637
340 H GLU 47 H GLU 47 9.364 -8.420 -2.924
341 HA GLU 47 HA GLU 47 10.386 -10.727 -1.437
342 1HB GLU 47 2HB GLU 47 11.359 -9.548 -4.043
343 2HB GLU 47 1HB GLU 47 12.194 -10.795 -3.142
344 1HG GLU 47 2HG GLU 47 10.306 -12.300 -3.433
345 2HG GLU 47 1HG GLU 47 9.435 -11.039 -4.302
346 H LYS 48 H LYS 48 12.211 -10.382 -0.208
347 HA LYS 48 HA LYS 48 12.542 -7.902 0.981
348 1HB LYS 48 2HB LYS 48 13.236 -10.066 1.978
349 2HB LYS 48 1HB LYS 48 14.588 -10.126 0.854
350 1HG LYS 48 2HG LYS 48 15.299 -7.889 1.848
351 2HG LYS 48 1HG LYS 48 14.133 -8.225 3.129
352 1HD LYS 48 2HD LYS 48 16.337 -8.940 3.820
353 2HD LYS 48 1HD LYS 48 15.298 -10.348 3.597
354 1HE LYS 48 2HE LYS 48 16.302 -10.821 1.465
355 2HE LYS 48 1HE LYS 48 17.236 -9.325 1.526
356 1HZ LYS 48 1HZ LYS 48 17.526 -11.593 3.427
357 2HZ LYS 48 2HZ LYS 48 18.459 -10.172 3.403
358 3HZ LYS 48 3HZ LYS 48 18.565 -11.276 2.122
359 H GLY 49 H GLY 49 13.588 -6.100 0.455
360 1HA GLY 49 2HA GLY 49 15.181 -4.682 -0.396
361 2HA GLY 49 1HA GLY 49 16.184 -6.094 -0.691
362 H SER 50 H SER 50 13.037 -6.000 -2.100
363 HA SER 50 HA SER 50 14.291 -5.454 -4.705
364 1HB SER 50 2HB SER 50 11.822 -7.110 -4.139
365 2HB SER 50 1HB SER 50 12.623 -6.917 -5.700
366 HG SER 50 HG SER 50 13.813 -8.045 -3.376
367 H VAL 51 H VAL 51 12.888 -4.406 -6.313
368 HA VAL 51 HA VAL 51 11.002 -2.552 -5.011
369 HB VAL 51 HB VAL 51 12.771 -1.963 -7.393
370 1HG1 VAL 51 1HG1 VAL 51 10.665 -0.758 -7.473
371 2HG1 VAL 51 2HG1 VAL 51 11.990 0.346 -7.102
372 3HG1 VAL 51 3HG1 VAL 51 10.907 -0.192 -5.819
373 1HG2 VAL 51 1HG2 VAL 51 14.089 -2.112 -5.351
374 2HG2 VAL 51 2HG2 VAL 51 12.982 -1.005 -4.540
375 3HG2 VAL 51 3HG2 VAL 51 13.971 -0.437 -5.887
376 H ILE 52 H ILE 52 9.071 -3.397 -5.529
377 HA ILE 52 HA ILE 52 8.675 -4.322 -8.296
378 HB ILE 52 HB ILE 52 7.270 -6.004 -7.595
379 1HG1 ILE 52 2HG1 ILE 52 6.683 -4.313 -5.160
380 2HG1 ILE 52 1HG1 ILE 52 5.572 -4.801 -6.439
381 1HG2 ILE 52 1HG2 ILE 52 9.436 -6.526 -6.692
382 2HG2 ILE 52 2HG2 ILE 52 8.202 -7.071 -5.550
383 3HG2 ILE 52 3HG2 ILE 52 9.103 -5.584 -5.237
384 1HD1 ILE 52 1HD1 ILE 52 5.069 -6.062 -4.514
385 2HD1 ILE 52 2HD1 ILE 52 6.755 -6.529 -4.293
386 3HD1 ILE 52 3HD1 ILE 52 5.839 -7.146 -5.670
387 H ASN 53 H ASN 53 6.678 -3.826 -9.307
388 HA ASN 53 HA ASN 53 5.545 -1.287 -8.416
389 1HB ASN 53 2HB ASN 53 6.280 -1.480 -10.754
390 2HB ASN 53 1HB ASN 53 5.196 -2.845 -10.995
391 1HD2 ASN 53 1HD2 ASN 53 3.081 -2.480 -11.418
392 2HD2 ASN 53 2HD2 ASN 53 2.411 -0.904 -11.649
393 H VAL 54 H VAL 54 3.670 -1.246 -7.315
394 HA VAL 54 HA VAL 54 2.072 -3.724 -7.349
395 HB VAL 54 HB VAL 54 1.351 -3.213 -5.075
396 1HG1 VAL 54 1HG1 VAL 54 3.434 -3.727 -3.932
397 2HG1 VAL 54 2HG1 VAL 54 4.344 -3.250 -5.366
398 3HG1 VAL 54 3HG1 VAL 54 3.279 -4.653 -5.427
399 1HG2 VAL 54 1HG2 VAL 54 3.284 -0.900 -5.235
400 2HG2 VAL 54 2HG2 VAL 54 2.481 -1.459 -3.768
401 3HG2 VAL 54 3HG2 VAL 54 1.528 -0.790 -5.096
402 H LYS 55 H LYS 55 -0.062 -3.644 -7.684
403 HA LYS 55 HA LYS 55 -1.307 -1.010 -8.039
404 1HB LYS 55 2HB LYS 55 -1.641 -2.648 -9.847
405 2HB LYS 55 1HB LYS 55 -2.343 -3.781 -8.702
406 1HG LYS 55 2HG LYS 55 -4.057 -1.921 -8.237
407 2HG LYS 55 1HG LYS 55 -3.469 -1.211 -9.738
408 1HD LYS 55 2HD LYS 55 -4.453 -4.048 -9.549
409 2HD LYS 55 1HD LYS 55 -5.517 -2.694 -9.913
410 1HE LYS 55 2HE LYS 55 -4.947 -3.602 -12.001
411 2HE LYS 55 1HE LYS 55 -3.941 -2.167 -11.835
412 1HZ LYS 55 1HZ LYS 55 -2.861 -4.791 -11.024
413 2HZ LYS 55 2HZ LYS 55 -2.041 -3.411 -11.603
414 3HZ LYS 55 3HZ LYS 55 -2.931 -4.381 -12.670
415 H VAL 56 H VAL 56 -2.076 -0.196 -6.161
416 HA VAL 56 HA VAL 56 -2.828 -1.839 -3.955
417 HB VAL 56 HB VAL 56 -3.437 1.087 -4.439
418 1HG1 VAL 56 1HG1 VAL 56 -3.821 1.201 -2.022
419 2HG1 VAL 56 2HG1 VAL 56 -3.563 -0.538 -1.896
420 3HG1 VAL 56 3HG1 VAL 56 -4.947 0.087 -2.793
421 1HG2 VAL 56 1HG2 VAL 56 -1.232 -0.224 -2.842
422 2HG2 VAL 56 2HG2 VAL 56 -1.532 1.512 -2.961
423 3HG2 VAL 56 3HG2 VAL 56 -1.035 0.601 -4.390
424 H THR 57 H THR 57 -4.591 -3.048 -3.895
425 HA THR 57 HA THR 57 -6.861 -2.329 -5.594
426 HB THR 57 HB THR 57 -7.535 -4.746 -5.110
427 HG1 THR 57 1HG THR 57 -5.695 -6.049 -4.429
428 1HG2 THR 57 1HG2 THR 57 -6.525 -4.036 -7.236
429 2HG2 THR 57 2HG2 THR 57 -5.966 -5.641 -6.764
430 3HG2 THR 57 3HG2 THR 57 -4.918 -4.242 -6.539
431 H ALA 58 H ALA 58 -5.970 -2.772 -2.255
432 HA ALA 58 HA ALA 58 -8.715 -2.207 -1.445
433 1HB ALA 58 1HB ALA 58 -8.481 -4.645 -1.429
434 2HB ALA 58 2HB ALA 58 -8.726 -3.993 0.192
435 3HB ALA 58 3HB ALA 58 -7.116 -4.499 -0.322
436 H VAL 59 H VAL 59 -8.078 -0.196 -0.778
437 HA VAL 59 HA VAL 59 -6.037 0.135 1.232
438 HB VAL 59 HB VAL 59 -8.170 2.118 0.398
439 1HG1 VAL 59 1HG1 VAL 59 -5.509 2.539 1.764
440 2HG1 VAL 59 2HG1 VAL 59 -7.093 2.655 2.532
441 3HG1 VAL 59 3HG1 VAL 59 -6.634 3.807 1.277
442 1HG2 VAL 59 1HG2 VAL 59 -6.466 3.087 -1.076
443 2HG2 VAL 59 2HG2 VAL 59 -6.864 1.432 -1.539
444 3HG2 VAL 59 3HG2 VAL 59 -5.368 1.769 -0.668
445 H LYS 60 H LYS 60 -6.309 0.118 3.399
446 HA LYS 60 HA LYS 60 -9.050 -0.171 4.433
447 1HB LYS 60 2HB LYS 60 -6.433 -1.308 5.411
448 2HB LYS 60 1HB LYS 60 -7.892 -1.316 6.389
449 1HG LYS 60 2HG LYS 60 -7.601 -2.613 3.690
450 2HG LYS 60 1HG LYS 60 -7.529 -3.447 5.245
451 1HD LYS 60 2HD LYS 60 -9.816 -2.770 5.731
452 2HD LYS 60 1HD LYS 60 -9.890 -1.874 4.213
453 1HE LYS 60 2HE LYS 60 -9.612 -3.945 2.963
454 2HE LYS 60 1HE LYS 60 -9.486 -4.853 4.471
455 1HZ LYS 60 1HZ LYS 60 -11.731 -4.259 5.018
456 2HZ LYS 60 2HZ LYS 60 -11.715 -4.953 3.472
457 3HZ LYS 60 3HZ LYS 60 -11.861 -3.271 3.646
458 H GLU 61 H GLU 61 -8.357 0.179 7.156
459 HA GLU 61 HA GLU 61 -8.762 2.966 7.244
460 1HB GLU 61 2HB GLU 61 -8.061 1.265 9.623
461 2HB GLU 61 1HB GLU 61 -9.065 2.707 9.574
462 1HG GLU 61 2HG GLU 61 -9.734 -0.036 8.539
463 2HG GLU 61 1HG GLU 61 -10.489 0.832 9.872
464 H LYS 62 H LYS 62 -5.978 0.963 8.237
465 HA LYS 62 HA LYS 62 -4.400 3.452 8.432
466 1HB LYS 62 2HB LYS 62 -4.084 0.966 10.124
467 2HB LYS 62 1HB LYS 62 -3.081 2.406 10.211
468 1HG LYS 62 2HG LYS 62 -5.040 3.709 10.912
469 2HG LYS 62 1HG LYS 62 -6.009 2.233 10.879
470 1HD LYS 62 2HD LYS 62 -4.533 1.232 12.557
471 2HD LYS 62 1HD LYS 62 -3.575 2.712 12.594
472 1HE LYS 62 2HE LYS 62 -6.477 2.439 13.360
473 2HE LYS 62 1HE LYS 62 -5.120 2.639 14.467
474 1HZ LYS 62 1HZ LYS 62 -6.217 4.614 12.550
475 2HZ LYS 62 2HZ LYS 62 -4.683 4.794 13.243
476 3HZ LYS 62 3HZ LYS 62 -6.059 4.759 14.232
477 H PHE 63 H PHE 63 -4.806 0.747 6.664
478 HA PHE 63 HA PHE 63 -2.107 0.730 5.655
479 1HB PHE 63 2HB PHE 63 -2.023 -1.842 5.926
480 2HB PHE 63 1HB PHE 63 -1.634 -0.849 7.325
481 HD1 PHE 63 1HD PHE 63 -3.056 -0.802 9.253
482 HD2 PHE 63 2HD PHE 63 -4.121 -3.099 5.829
483 HE1 PHE 63 1HE PHE 63 -4.776 -1.961 10.577
484 HE2 PHE 63 2HE PHE 63 -5.844 -4.264 7.147
485 HZ PHE 63 HZ PHE 63 -6.175 -3.693 9.522
486 H ALA 64 H ALA 64 -1.998 -1.105 3.868
487 HA ALA 64 HA ALA 64 -4.621 -1.404 2.601
488 1HB ALA 64 1HB ALA 64 -3.720 0.693 1.723
489 2HB ALA 64 2HB ALA 64 -3.822 -0.540 0.468
490 3HB ALA 64 3HB ALA 64 -2.263 -0.152 1.197
491 H PHE 65 H PHE 65 -4.524 -2.808 0.673
492 HA PHE 65 HA PHE 65 -2.343 -4.784 0.842
493 1HB PHE 65 2HB PHE 65 -5.210 -5.229 -0.038
494 2HB PHE 65 1HB PHE 65 -3.953 -6.458 0.025
495 HD1 PHE 65 1HD PHE 65 -6.480 -4.681 1.861
496 HD2 PHE 65 2HD PHE 65 -3.011 -7.116 2.258
497 HE1 PHE 65 1HE PHE 65 -7.107 -5.192 4.187
498 HE2 PHE 65 2HE PHE 65 -3.632 -7.632 4.581
499 HZ PHE 65 HZ PHE 65 -5.684 -6.671 5.547
500 H ALA 66 H ALA 66 -1.219 -5.166 -1.016
501 HA ALA 66 HA ALA 66 -2.234 -3.812 -3.427
502 1HB ALA 66 1HB ALA 66 -0.418 -2.550 -2.325
503 2HB ALA 66 2HB ALA 66 -0.039 -3.060 -3.968
504 3HB ALA 66 3HB ALA 66 0.649 -3.928 -2.597
505 H GLU 67 H GLU 67 -1.538 -4.592 -5.418
506 HA GLU 67 HA GLU 67 -0.899 -7.458 -5.441
507 1HB GLU 67 2HB GLU 67 -2.926 -7.104 -6.562
508 2HB GLU 67 1HB GLU 67 -2.375 -5.599 -7.282
509 1HG GLU 67 2HG GLU 67 -0.752 -7.033 -8.621
510 2HG GLU 67 1HG GLU 67 -1.716 -8.405 -8.083
511 H ARG 68 H ARG 68 1.189 -7.951 -5.941
512 HA ARG 68 HA ARG 68 2.979 -6.117 -7.103
513 1HB ARG 68 2HB ARG 68 4.075 -7.751 -5.880
514 2HB ARG 68 1HB ARG 68 3.107 -9.058 -6.545
515 1HG ARG 68 2HG ARG 68 4.288 -8.922 -8.649
516 2HG ARG 68 1HG ARG 68 5.168 -7.497 -8.101
517 1HD ARG 68 2HD ARG 68 6.405 -8.740 -6.534
518 2HD ARG 68 1HD ARG 68 5.335 -10.135 -6.677
519 HE ARG 68 HE ARG 68 6.382 -9.787 -9.182
520 1HH1 ARG 68 1HH1 ARG 68 7.677 -10.338 -5.973
521 2HH1 ARG 68 2HH1 ARG 68 9.128 -11.111 -6.550
522 1HH2 ARG 68 1HH2 ARG 68 8.238 -10.885 -9.943
523 2HH2 ARG 68 2HH2 ARG 68 9.423 -11.457 -8.805
524 H VAL 69 H VAL 69 2.545 -5.312 -9.010
525 HA VAL 69 HA VAL 69 1.930 -6.923 -11.332
526 HB VAL 69 HB VAL 69 3.067 -4.128 -11.394
527 1HG1 VAL 69 1HG1 VAL 69 1.142 -5.652 -13.122
528 2HG1 VAL 69 2HG1 VAL 69 2.714 -4.979 -13.561
529 3HG1 VAL 69 3HG1 VAL 69 1.351 -3.905 -13.243
530 1HG2 VAL 69 1HG2 VAL 69 0.197 -4.800 -10.754
531 2HG2 VAL 69 2HG2 VAL 69 0.839 -3.188 -11.067
532 3HG2 VAL 69 3HG2 VAL 69 1.369 -4.087 -9.645
533 H LEU 70 H LEU 70 3.771 -6.350 -13.230
534 HA LEU 70 HA LEU 70 5.914 -6.541 -13.953
535 1HB LEU 70 2HB LEU 70 7.067 -5.144 -12.614
536 2HB LEU 70 1HB LEU 70 6.310 -5.739 -11.156
537 HG LEU 70 HG LEU 70 8.475 -7.360 -12.467
538 1HD1 LEU 70 1HD1 LEU 70 8.897 -5.080 -10.537
539 2HD1 LEU 70 2HD1 LEU 70 9.323 -5.046 -12.248
540 3HD1 LEU 70 3HD1 LEU 70 10.136 -6.170 -11.159
541 1HD2 LEU 70 1HD2 LEU 70 7.189 -8.323 -10.603
542 2HD2 LEU 70 2HD2 LEU 70 7.639 -6.948 -9.595
543 3HD2 LEU 70 3HD2 LEU 70 8.879 -8.063 -10.171
Start of MODEL 4
1 1H MET 1 1H MET 1 -1.807 21.977 13.186
2 2H MET 1 2H MET 1 -1.965 20.486 13.971
3 3H MET 1 3H MET 1 -2.658 21.876 14.652
4 HA MET 1 HA MET 1 -4.390 20.614 13.669
5 1HB MET 1 2HB MET 1 -3.619 22.944 11.895
6 2HB MET 1 1HB MET 1 -5.218 22.216 11.971
7 1HG MET 1 2HG MET 1 -5.481 22.926 14.257
8 2HG MET 1 1HG MET 1 -3.828 23.537 14.291
9 1HE MET 1 1HE MET 1 -7.411 23.975 12.752
10 2HE MET 1 2HE MET 1 -6.402 23.846 11.311
11 3HE MET 1 3HE MET 1 -7.186 25.377 11.706
12 H ALA 2 H ALA 2 -2.156 21.579 11.050
13 HA ALA 2 HA ALA 2 -3.027 19.284 9.473
14 1HB ALA 2 1HB ALA 2 -2.803 21.459 8.365
15 2HB ALA 2 2HB ALA 2 -1.702 20.266 7.677
16 3HB ALA 2 3HB ALA 2 -1.089 21.494 8.784
17 H PHE 3 H PHE 3 -1.319 17.944 8.420
18 HA PHE 3 HA PHE 3 1.188 17.702 9.824
19 1HB PHE 3 2HB PHE 3 -0.405 16.553 11.342
20 2HB PHE 3 1HB PHE 3 -0.851 15.474 10.024
21 HD1 PHE 3 1HD PHE 3 0.389 13.538 9.591
22 HD2 PHE 3 2HD PHE 3 1.982 16.530 12.165
23 HE1 PHE 3 1HE PHE 3 2.206 12.009 10.240
24 HE2 PHE 3 2HE PHE 3 3.806 15.010 12.812
25 HZ PHE 3 HZ PHE 3 3.917 12.746 11.852
26 H GLY 4 H GLY 4 -1.101 16.438 7.488
27 1HA GLY 4 2HA GLY 4 -0.133 16.105 5.203
28 2HA GLY 4 1HA GLY 4 1.136 15.195 6.016
29 H LYS 5 H LYS 5 -1.097 14.334 7.907
30 HA LYS 5 HA LYS 5 -1.757 11.884 6.658
31 1HB LYS 5 2HB LYS 5 -1.422 12.221 9.109
32 2HB LYS 5 1HB LYS 5 -2.947 13.082 9.156
33 1HG LYS 5 2HG LYS 5 -4.164 11.108 8.581
34 2HG LYS 5 1HG LYS 5 -2.666 10.222 8.273
35 1HD LYS 5 2HD LYS 5 -3.454 11.384 10.947
36 2HD LYS 5 1HD LYS 5 -3.679 9.696 10.479
37 1HE LYS 5 2HE LYS 5 -1.361 9.310 10.354
38 2HE LYS 5 1HE LYS 5 -0.990 11.033 10.364
39 1HZ LYS 5 1HZ LYS 5 -2.177 9.562 12.658
40 2HZ LYS 5 2HZ LYS 5 -1.656 11.174 12.643
41 3HZ LYS 5 3HZ LYS 5 -0.527 9.917 12.494
42 HA PRO 6 HA PRO 6 -6.060 13.870 5.910
43 1HB PRO 6 2HB PRO 6 -5.801 16.732 6.397
44 2HB PRO 6 1HB PRO 6 -6.956 15.590 7.090
45 1HG PRO 6 2HG PRO 6 -5.007 16.736 8.570
46 2HG PRO 6 1HG PRO 6 -5.596 15.091 8.880
47 1HD PRO 6 2HD PRO 6 -3.151 15.960 7.370
48 2HD PRO 6 1HD PRO 6 -3.310 14.712 8.624
49 H ALA 7 H ALA 7 -6.878 15.401 4.149
50 HA ALA 7 HA ALA 7 -6.727 16.088 1.994
51 1HB ALA 7 1HB ALA 7 -5.387 17.929 2.863
52 2HB ALA 7 2HB ALA 7 -4.794 17.412 1.282
53 3HB ALA 7 3HB ALA 7 -3.931 16.941 2.745
54 H MET 8 H MET 8 -5.006 15.870 -0.019
55 HA MET 8 HA MET 8 -4.217 14.368 -1.538
56 1HB MET 8 2HB MET 8 -2.253 14.437 -0.028
57 2HB MET 8 1HB MET 8 -2.933 13.117 0.906
58 1HG MET 8 2HG MET 8 -1.182 12.347 -0.593
59 2HG MET 8 1HG MET 8 -2.739 11.630 -1.002
60 1HE MET 8 1HE MET 8 -0.311 11.467 -2.958
61 2HE MET 8 2HE MET 8 -1.037 11.920 -4.500
62 3HE MET 8 3HE MET 8 -1.909 10.862 -3.392
63 H LYS 9 H LYS 9 -6.734 13.922 -1.080
64 HA LYS 9 HA LYS 9 -8.433 12.441 -1.219
65 1HB LYS 9 2HB LYS 9 -6.145 10.573 -1.795
66 2HB LYS 9 1HB LYS 9 -7.812 10.016 -1.772
67 1HG LYS 9 2HG LYS 9 -6.853 12.265 -3.523
68 2HG LYS 9 1HG LYS 9 -6.871 10.575 -4.033
69 1HD LYS 9 2HD LYS 9 -9.356 11.812 -2.925
70 2HD LYS 9 1HD LYS 9 -8.886 12.151 -4.589
71 1HE LYS 9 2HE LYS 9 -10.466 10.272 -4.425
72 2HE LYS 9 1HE LYS 9 -8.921 9.789 -5.121
73 1HZ LYS 9 1HZ LYS 9 -9.658 9.386 -2.270
74 2HZ LYS 9 2HZ LYS 9 -8.291 8.772 -3.077
75 3HZ LYS 9 3HZ LYS 9 -9.832 8.205 -3.473
76 H ASN 10 H ASN 10 -6.611 12.750 1.257
77 HA ASN 10 HA ASN 10 -6.546 12.132 3.430
78 1HB ASN 10 2HB ASN 10 -9.035 12.452 3.180
79 2HB ASN 10 1HB ASN 10 -9.172 10.717 2.913
80 1HD2 ASN 10 1HD2 ASN 10 -8.342 13.198 5.239
81 2HD2 ASN 10 2HD2 ASN 10 -8.513 12.209 6.646
82 H VAL 11 H VAL 11 -5.740 10.341 1.147
83 HA VAL 11 HA VAL 11 -4.897 8.013 2.602
84 HB VAL 11 HB VAL 11 -6.852 7.687 0.303
85 1HG1 VAL 11 1HG1 VAL 11 -6.554 5.269 0.648
86 2HG1 VAL 11 2HG1 VAL 11 -5.309 5.608 1.850
87 3HG1 VAL 11 3HG1 VAL 11 -5.054 6.061 0.165
88 1HG2 VAL 11 1HG2 VAL 11 -7.120 6.802 3.176
89 2HG2 VAL 11 2HG2 VAL 11 -8.271 6.469 1.880
90 3HG2 VAL 11 3HG2 VAL 11 -8.002 8.128 2.417
91 HA PRO 12 HA PRO 12 -1.839 9.326 -0.403
92 1HB PRO 12 2HB PRO 12 0.149 7.680 0.451
93 2HB PRO 12 1HB PRO 12 -0.299 9.175 1.273
94 1HG PRO 12 2HG PRO 12 -1.063 6.362 1.925
95 2HG PRO 12 1HG PRO 12 -0.559 7.667 3.013
96 1HD PRO 12 2HD PRO 12 -3.150 6.987 2.692
97 2HD PRO 12 1HD PRO 12 -2.641 8.660 2.997
98 H VAL 13 H VAL 13 -3.282 6.281 -0.175
99 HA VAL 13 HA VAL 13 -1.893 5.366 -2.598
100 HB VAL 13 HB VAL 13 -2.450 3.025 -1.820
101 1HG1 VAL 13 1HG1 VAL 13 -0.197 3.898 -1.663
102 2HG1 VAL 13 2HG1 VAL 13 -0.566 2.912 -0.245
103 3HG1 VAL 13 3HG1 VAL 13 -0.583 4.671 -0.124
104 1HG2 VAL 13 1HG2 VAL 13 -2.975 4.466 0.779
105 2HG2 VAL 13 2HG2 VAL 13 -2.819 2.715 0.593
106 3HG2 VAL 13 3HG2 VAL 13 -4.158 3.569 -0.175
107 H GLU 14 H GLU 14 -3.158 5.225 -4.325
108 HA GLU 14 HA GLU 14 -6.038 5.406 -3.963
109 1HB GLU 14 2HB GLU 14 -4.184 5.893 -6.273
110 2HB GLU 14 1HB GLU 14 -5.914 5.698 -6.537
111 1HG GLU 14 2HG GLU 14 -4.688 7.730 -4.685
112 2HG GLU 14 1HG GLU 14 -5.190 8.056 -6.344
113 H ALA 15 H ALA 15 -7.293 3.719 -4.081
114 HA ALA 15 HA ALA 15 -6.350 1.130 -4.723
115 1HB ALA 15 1HB ALA 15 -8.674 0.421 -4.438
116 2HB ALA 15 2HB ALA 15 -9.191 2.108 -4.434
117 3HB ALA 15 3HB ALA 15 -8.166 1.496 -3.136
118 H GLY 16 H GLY 16 -5.597 0.914 -6.764
119 1HA GLY 16 2HA GLY 16 -6.853 0.094 -8.891
120 2HA GLY 16 1HA GLY 16 -7.296 1.793 -8.989
121 H LYS 17 H LYS 17 -4.677 2.646 -7.898
122 HA LYS 17 HA LYS 17 -3.246 2.419 -10.437
123 1HB LYS 17 2HB LYS 17 -2.952 4.366 -8.158
124 2HB LYS 17 1HB LYS 17 -1.812 4.280 -9.492
125 1HG LYS 17 2HG LYS 17 -3.827 4.641 -11.012
126 2HG LYS 17 1HG LYS 17 -4.689 5.104 -9.545
127 1HD LYS 17 2HD LYS 17 -3.925 7.151 -10.262
128 2HD LYS 17 1HD LYS 17 -2.618 6.669 -9.183
129 1HE LYS 17 2HE LYS 17 -2.625 6.290 -12.176
130 2HE LYS 17 1HE LYS 17 -1.825 7.612 -11.334
131 1HZ LYS 17 1HZ LYS 17 -1.165 4.721 -11.087
132 2HZ LYS 17 2HZ LYS 17 -0.420 5.962 -10.209
133 3HZ LYS 17 3HZ LYS 17 -0.251 5.893 -11.886
134 H GLU 18 H GLU 18 -0.850 2.512 -10.270
135 HA GLU 18 HA GLU 18 0.070 0.533 -8.308
136 1HB GLU 18 2HB GLU 18 1.865 0.280 -10.309
137 2HB GLU 18 1HB GLU 18 0.404 -0.686 -10.186
138 1HG GLU 18 2HG GLU 18 0.819 0.211 -12.444
139 2HG GLU 18 1HG GLU 18 -0.731 0.696 -11.767
140 H TYR 19 H TYR 19 2.144 0.779 -7.450
141 HA TYR 19 HA TYR 19 3.554 3.279 -8.062
142 1HB TYR 19 2HB TYR 19 2.985 2.291 -5.258
143 2HB TYR 19 1HB TYR 19 3.918 3.719 -5.684
144 HD1 TYR 19 1HD TYR 19 2.726 5.639 -6.823
145 HD2 TYR 19 2HD TYR 19 0.657 2.393 -5.024
146 HE1 TYR 19 1HE TYR 19 0.683 7.001 -6.737
147 HE2 TYR 19 2HE TYR 19 -1.394 3.737 -4.932
148 HH TYR 19 HH TYR 19 -1.798 6.466 -4.853
149 H GLU 20 H GLU 20 5.758 3.100 -8.019
150 HA GLU 20 HA GLU 20 6.924 0.481 -7.718
151 1HB GLU 20 2HB GLU 20 7.745 2.128 -9.406
152 2HB GLU 20 1HB GLU 20 8.301 3.156 -8.090
153 1HG GLU 20 2HG GLU 20 9.569 0.959 -7.377
154 2HG GLU 20 1HG GLU 20 9.396 0.587 -9.092
155 H VAL 21 H VAL 21 7.179 -0.308 -5.731
156 HA VAL 21 HA VAL 21 8.028 1.539 -3.595
157 HB VAL 21 HB VAL 21 6.866 0.065 -1.991
158 1HG1 VAL 21 1HG1 VAL 21 5.123 1.100 -4.222
159 2HG1 VAL 21 2HG1 VAL 21 5.693 2.010 -2.824
160 3HG1 VAL 21 3HG1 VAL 21 4.562 0.675 -2.604
161 1HG2 VAL 21 1HG2 VAL 21 5.306 -1.642 -2.822
162 2HG2 VAL 21 2HG2 VAL 21 6.980 -2.016 -3.233
163 3HG2 VAL 21 3HG2 VAL 21 5.892 -1.365 -4.461
164 H THR 22 H THR 22 9.225 0.467 -1.820
165 HA THR 22 HA THR 22 10.929 -1.691 -2.880
166 HB THR 22 HB THR 22 11.687 0.189 -0.638
167 HG1 THR 22 1HG THR 22 11.518 0.692 -3.332
168 1HG2 THR 22 1HG2 THR 22 13.312 -1.545 -2.508
169 2HG2 THR 22 2HG2 THR 22 13.004 -1.859 -0.801
170 3HG2 THR 22 3HG2 THR 22 13.976 -0.469 -1.282
171 H ILE 23 H ILE 23 11.317 -3.454 -1.637
172 HA ILE 23 HA ILE 23 9.507 -3.828 0.633
173 HB ILE 23 HB ILE 23 10.829 -5.968 -1.045
174 1HG1 ILE 23 2HG1 ILE 23 9.302 -4.572 -2.392
175 2HG1 ILE 23 1HG1 ILE 23 8.686 -6.201 -2.185
176 1HG2 ILE 23 1HG2 ILE 23 9.183 -7.454 -0.032
177 2HG2 ILE 23 2HG2 ILE 23 8.513 -6.105 0.886
178 3HG2 ILE 23 3HG2 ILE 23 10.154 -6.664 1.209
179 1HD1 ILE 23 1HD1 ILE 23 6.913 -4.565 -1.974
180 2HD1 ILE 23 2HD1 ILE 23 7.786 -3.766 -0.669
181 3HD1 ILE 23 3HD1 ILE 23 7.169 -5.402 -0.443
182 H GLU 24 H GLU 24 11.398 -2.469 1.414
183 HA GLU 24 HA GLU 24 13.896 -3.649 1.992
184 1HB GLU 24 2HB GLU 24 13.382 -1.192 2.022
185 2HB GLU 24 1HB GLU 24 12.516 -1.437 3.531
186 1HG GLU 24 2HG GLU 24 14.581 -2.218 4.584
187 2HG GLU 24 1HG GLU 24 15.447 -1.955 3.072
188 H ASP 25 H ASP 25 10.890 -4.458 3.170
189 HA ASP 25 HA ASP 25 12.058 -5.726 5.529
190 1HB ASP 25 2HB ASP 25 10.965 -3.578 6.215
191 2HB ASP 25 1HB ASP 25 9.439 -4.221 5.623
192 H MET 26 H MET 26 11.288 -7.715 5.949
193 HA MET 26 HA MET 26 9.010 -8.665 4.327
194 1HB MET 26 2HB MET 26 11.121 -9.652 3.549
195 2HB MET 26 1HB MET 26 11.475 -10.209 5.178
196 1HG MET 26 2HG MET 26 10.451 -12.107 4.717
197 2HG MET 26 1HG MET 26 8.939 -11.222 4.550
198 1HE MET 26 1HE MET 26 8.897 -10.447 0.700
199 2HE MET 26 2HE MET 26 9.568 -9.419 1.968
200 3HE MET 26 3HE MET 26 8.039 -10.262 2.230
201 H GLY 27 H GLY 27 7.326 -9.036 5.582
202 1HA GLY 27 2HA GLY 27 7.804 -9.888 8.368
203 2HA GLY 27 1HA GLY 27 6.430 -8.923 7.852
204 H LYS 28 H LYS 28 5.847 -11.084 9.277
205 HA LYS 28 HA LYS 28 4.532 -12.906 9.372
206 1HB LYS 28 2HB LYS 28 3.899 -12.065 6.573
207 2HB LYS 28 1HB LYS 28 2.924 -13.157 7.539
208 1HG LYS 28 2HG LYS 28 2.326 -11.401 9.035
209 2HG LYS 28 1HG LYS 28 3.500 -10.303 8.297
210 1HD LYS 28 2HD LYS 28 2.195 -10.647 6.134
211 2HD LYS 28 1HD LYS 28 0.936 -11.360 7.142
212 1HE LYS 28 2HE LYS 28 0.624 -9.332 8.333
213 2HE LYS 28 1HE LYS 28 2.076 -8.620 7.629
214 1HZ LYS 28 1HZ LYS 28 -0.407 -9.331 6.162
215 2HZ LYS 28 2HZ LYS 28 0.998 -8.693 5.452
216 3HZ LYS 28 3HZ LYS 28 0.107 -7.768 6.556
217 H GLY 29 H GLY 29 7.269 -13.057 7.956
218 1HA GLY 29 2HA GLY 29 8.553 -14.923 7.424
219 2HA GLY 29 1HA GLY 29 7.084 -15.883 7.378
220 H GLY 30 H GLY 30 6.054 -13.633 5.444
221 1HA GLY 30 2HA GLY 30 7.639 -13.967 3.093
222 2HA GLY 30 1HA GLY 30 6.285 -15.086 3.107
223 H ASP 31 H ASP 31 6.128 -11.885 4.504
224 HA ASP 31 HA ASP 31 4.385 -11.024 2.275
225 1HB ASP 31 2HB ASP 31 3.272 -11.494 4.551
226 2HB ASP 31 1HB ASP 31 4.135 -10.077 5.135
227 H GLY 32 H GLY 32 4.914 -9.091 1.356
228 1HA GLY 32 2HA GLY 32 7.435 -7.922 2.223
229 2HA GLY 32 1HA GLY 32 6.596 -7.591 0.715
230 H ILE 33 H ILE 33 7.637 -6.060 3.321
231 HA ILE 33 HA ILE 33 5.215 -4.460 3.689
232 HB ILE 33 HB ILE 33 7.744 -4.702 5.301
233 1HG1 ILE 33 2HG1 ILE 33 6.102 -4.995 7.169
234 2HG1 ILE 33 1HG1 ILE 33 4.799 -4.894 5.992
235 1HG2 ILE 33 1HG2 ILE 33 7.403 -2.323 5.050
236 2HG2 ILE 33 2HG2 ILE 33 6.984 -2.815 6.692
237 3HG2 ILE 33 3HG2 ILE 33 5.710 -2.486 5.518
238 1HD1 ILE 33 1HD1 ILE 33 5.258 -7.190 6.597
239 2HD1 ILE 33 2HD1 ILE 33 6.937 -7.003 6.089
240 3HD1 ILE 33 3HD1 ILE 33 5.641 -6.902 4.898
241 H ALA 34 H ALA 34 5.106 -3.183 1.905
242 HA ALA 34 HA ALA 34 7.307 -1.306 1.461
243 1HB ALA 34 1HB ALA 34 4.627 -1.541 0.087
244 2HB ALA 34 2HB ALA 34 6.150 -2.204 -0.503
245 3HB ALA 34 3HB ALA 34 5.938 -0.458 -0.380
246 H ARG 35 H ARG 35 6.956 1.005 1.747
247 HA ARG 35 HA ARG 35 4.600 1.678 3.334
248 1HB ARG 35 2HB ARG 35 6.661 1.055 4.784
249 2HB ARG 35 1HB ARG 35 7.287 2.618 4.279
250 1HG ARG 35 2HG ARG 35 5.723 3.785 5.461
251 2HG ARG 35 1HG ARG 35 4.538 2.481 5.395
252 1HD ARG 35 2HD ARG 35 5.222 2.503 7.621
253 2HD ARG 35 1HD ARG 35 6.150 1.190 6.905
254 HE ARG 35 HE ARG 35 7.173 3.800 7.764
255 1HH1 ARG 35 1HH1 ARG 35 7.785 0.610 6.460
256 2HH1 ARG 35 2HH1 ARG 35 9.483 0.648 6.806
257 1HH2 ARG 35 1HH2 ARG 35 9.412 3.833 8.261
258 2HH2 ARG 35 2HH2 ARG 35 10.406 2.465 7.849
259 H ILE 36 H ILE 36 3.687 3.142 2.103
260 HA ILE 36 HA ILE 36 5.305 4.913 0.474
261 HB ILE 36 HB ILE 36 2.333 4.420 0.593
262 1HG1 ILE 36 2HG1 ILE 36 4.505 3.804 -1.414
263 2HG1 ILE 36 1HG1 ILE 36 3.584 2.650 -0.456
264 1HG2 ILE 36 1HG2 ILE 36 2.088 5.920 -1.299
265 2HG2 ILE 36 2HG2 ILE 36 3.813 6.291 -1.258
266 3HG2 ILE 36 3HG2 ILE 36 2.773 6.790 0.076
267 1HD1 ILE 36 1HD1 ILE 36 1.572 3.235 -1.669
268 2HD1 ILE 36 2HD1 ILE 36 2.848 2.722 -2.775
269 3HD1 ILE 36 3HD1 ILE 36 2.469 4.435 -2.595
270 H ASP 37 H ASP 37 6.123 6.500 1.527
271 HA ASP 37 HA ASP 37 6.398 8.435 2.678
272 1HB ASP 37 2HB ASP 37 4.503 9.077 1.102
273 2HB ASP 37 1HB ASP 37 3.416 8.839 2.467
274 H GLY 38 H GLY 38 5.306 5.856 4.043
275 1HA GLY 38 2HA GLY 38 5.607 5.759 6.500
276 2HA GLY 38 1HA GLY 38 4.566 7.175 6.583
277 H PHE 39 H PHE 39 3.002 5.827 4.291
278 HA PHE 39 HA PHE 39 1.137 4.447 6.018
279 1HB PHE 39 2HB PHE 39 0.419 6.032 4.205
280 2HB PHE 39 1HB PHE 39 0.998 4.863 3.025
281 HD1 PHE 39 1HD PHE 39 -0.259 2.926 2.487
282 HD2 PHE 39 2HD PHE 39 -1.515 5.528 5.611
283 HE1 PHE 39 1HE PHE 39 -2.438 1.808 2.542
284 HE2 PHE 39 2HE PHE 39 -3.702 4.407 5.670
285 HZ PHE 39 HZ PHE 39 -4.157 2.548 4.128
286 H VAL 40 H VAL 40 1.222 2.353 6.391
287 HA VAL 40 HA VAL 40 3.169 0.726 5.093
288 HB VAL 40 HB VAL 40 1.027 -0.210 6.995
289 1HG1 VAL 40 1HG1 VAL 40 2.180 -2.000 5.843
290 2HG1 VAL 40 2HG1 VAL 40 2.676 -1.957 7.537
291 3HG1 VAL 40 3HG1 VAL 40 3.742 -1.310 6.287
292 1HG2 VAL 40 1HG2 VAL 40 2.204 1.665 7.995
293 2HG2 VAL 40 2HG2 VAL 40 3.754 0.915 7.617
294 3HG2 VAL 40 3HG2 VAL 40 2.671 0.159 8.786
295 H VAL 41 H VAL 41 2.910 -0.226 3.225
296 HA VAL 41 HA VAL 41 0.224 -1.123 2.424
297 HB VAL 41 HB VAL 41 2.580 -0.497 0.622
298 1HG1 VAL 41 1HG1 VAL 41 0.906 -0.649 -1.185
299 2HG1 VAL 41 2HG1 VAL 41 -0.283 -1.202 -0.006
300 3HG1 VAL 41 3HG1 VAL 41 1.148 -2.176 -0.341
301 1HG2 VAL 41 1HG2 VAL 41 1.318 1.478 -0.064
302 2HG2 VAL 41 2HG2 VAL 41 1.699 1.529 1.656
303 3HG2 VAL 41 3HG2 VAL 41 0.072 1.104 1.126
304 H PHE 42 H PHE 42 0.049 -3.214 2.883
305 HA PHE 42 HA PHE 42 2.353 -4.927 3.036
306 1HB PHE 42 2HB PHE 42 -0.600 -5.472 3.367
307 2HB PHE 42 1HB PHE 42 0.649 -6.696 3.571
308 HD1 PHE 42 1HD PHE 42 -1.110 -3.946 5.092
309 HD2 PHE 42 2HD PHE 42 2.343 -6.417 5.374
310 HE1 PHE 42 1HE PHE 42 -0.826 -3.278 7.443
311 HE2 PHE 42 2HE PHE 42 2.636 -5.750 7.724
312 HZ PHE 42 HZ PHE 42 1.047 -4.178 8.762
313 H VAL 43 H VAL 43 3.115 -6.224 1.521
314 HA VAL 43 HA VAL 43 1.528 -6.493 -0.948
315 HB VAL 43 HB VAL 43 4.531 -6.660 -0.864
316 1HG1 VAL 43 1HG1 VAL 43 4.287 -6.023 -3.228
317 2HG1 VAL 43 2HG1 VAL 43 2.535 -6.045 -3.032
318 3HG1 VAL 43 3HG1 VAL 43 3.463 -7.534 -2.840
319 1HG2 VAL 43 1HG2 VAL 43 4.625 -4.307 -1.553
320 2HG2 VAL 43 2HG2 VAL 43 3.966 -4.486 0.072
321 3HG2 VAL 43 3HG2 VAL 43 2.888 -4.165 -1.287
322 HA PRO 44 HA PRO 44 1.470 -10.655 0.800
323 1HB PRO 44 2HB PRO 44 -0.198 -11.029 -1.631
324 2HB PRO 44 1HB PRO 44 -0.552 -11.436 0.047
325 1HG PRO 44 2HG PRO 44 -1.720 -9.351 -1.096
326 2HG PRO 44 1HG PRO 44 -1.153 -9.249 0.584
327 1HD PRO 44 2HD PRO 44 0.099 -8.178 -1.913
328 2HD PRO 44 1HD PRO 44 -0.042 -7.423 -0.311
329 H ASN 45 H ASN 45 2.640 -9.670 -2.267
330 HA ASN 45 HA ASN 45 3.564 -12.386 -2.843
331 1HB ASN 45 2HB ASN 45 3.050 -11.554 -5.339
332 2HB ASN 45 1HB ASN 45 1.877 -12.423 -4.356
333 1HD2 ASN 45 1HD2 ASN 45 -0.004 -11.596 -4.903
334 2HD2 ASN 45 2HD2 ASN 45 -0.410 -9.919 -4.823
335 H ALA 46 H ALA 46 4.632 -9.439 -2.168
336 HA ALA 46 HA ALA 46 6.666 -9.198 -4.191
337 1HB ALA 46 1HB ALA 46 5.756 -7.227 -3.030
338 2HB ALA 46 2HB ALA 46 7.506 -7.358 -2.884
339 3HB ALA 46 3HB ALA 46 6.473 -7.805 -1.526
340 H GLU 47 H GLU 47 8.966 -9.285 -3.684
341 HA GLU 47 HA GLU 47 9.559 -11.382 -1.733
342 1HB GLU 47 2HB GLU 47 10.960 -10.556 -4.273
343 2HB GLU 47 1HB GLU 47 11.636 -11.691 -3.118
344 1HG GLU 47 2HG GLU 47 9.725 -13.170 -3.431
345 2HG GLU 47 1HG GLU 47 9.033 -12.030 -4.583
346 H LYS 48 H LYS 48 11.681 -11.232 -0.668
347 HA LYS 48 HA LYS 48 11.844 -8.783 0.729
348 1HB LYS 48 2HB LYS 48 12.381 -11.008 1.671
349 2HB LYS 48 1HB LYS 48 13.815 -11.073 0.657
350 1HG LYS 48 2HG LYS 48 14.739 -9.139 1.815
351 2HG LYS 48 1HG LYS 48 13.288 -9.045 2.819
352 1HD LYS 48 2HD LYS 48 13.755 -11.269 3.714
353 2HD LYS 48 1HD LYS 48 15.196 -11.382 2.701
354 1HE LYS 48 2HE LYS 48 16.176 -9.480 3.866
355 2HE LYS 48 1HE LYS 48 14.725 -9.324 4.856
356 1HZ LYS 48 1HZ LYS 48 16.394 -10.489 6.088
357 2HZ LYS 48 2HZ LYS 48 16.620 -11.613 4.835
358 3HZ LYS 48 3HZ LYS 48 15.160 -11.584 5.698
359 H GLY 49 H GLY 49 12.832 -6.964 0.203
360 1HA GLY 49 2HA GLY 49 14.517 -5.536 -0.432
361 2HA GLY 49 1HA GLY 49 15.519 -6.935 -0.763
362 H SER 50 H SER 50 12.431 -6.685 -2.328
363 HA SER 50 HA SER 50 13.850 -6.382 -4.865
364 1HB SER 50 2HB SER 50 11.723 -7.174 -5.886
365 2HB SER 50 1HB SER 50 12.384 -8.314 -4.715
366 HG SER 50 HG SER 50 10.849 -7.697 -3.245
367 H VAL 51 H VAL 51 13.175 -4.927 -6.464
368 HA VAL 51 HA VAL 51 11.679 -2.599 -5.495
369 HB VAL 51 HB VAL 51 13.308 -2.919 -8.032
370 1HG1 VAL 51 1HG1 VAL 51 12.033 -0.476 -6.809
371 2HG1 VAL 51 2HG1 VAL 51 11.525 -1.287 -8.289
372 3HG1 VAL 51 3HG1 VAL 51 13.091 -0.480 -8.218
373 1HG2 VAL 51 1HG2 VAL 51 13.970 -1.469 -5.474
374 2HG2 VAL 51 2HG2 VAL 51 14.947 -1.472 -6.942
375 3HG2 VAL 51 3HG2 VAL 51 14.709 -2.967 -6.036
376 H ILE 52 H ILE 52 9.548 -2.727 -5.873
377 HA ILE 52 HA ILE 52 8.683 -4.282 -8.211
378 HB ILE 52 HB ILE 52 8.457 -5.850 -6.562
379 1HG1 ILE 52 2HG1 ILE 52 5.810 -4.412 -6.640
380 2HG1 ILE 52 1HG1 ILE 52 6.336 -5.738 -7.674
381 1HG2 ILE 52 1HG2 ILE 52 7.619 -5.436 -4.289
382 2HG2 ILE 52 2HG2 ILE 52 7.469 -3.722 -4.680
383 3HG2 ILE 52 3HG2 ILE 52 9.058 -4.486 -4.666
384 1HD1 ILE 52 1HD1 ILE 52 5.864 -5.913 -4.708
385 2HD1 ILE 52 2HD1 ILE 52 6.344 -7.240 -5.766
386 3HD1 ILE 52 3HD1 ILE 52 4.765 -6.478 -5.963
387 H ASN 53 H ASN 53 6.815 -3.764 -9.147
388 HA ASN 53 HA ASN 53 5.627 -1.180 -8.456
389 1HB ASN 53 2HB ASN 53 6.264 -1.576 -10.820
390 2HB ASN 53 1HB ASN 53 5.173 -2.955 -10.874
391 1HD2 ASN 53 1HD2 ASN 53 3.893 -2.113 -12.485
392 2HD2 ASN 53 2HD2 ASN 53 2.844 -0.756 -12.230
393 H VAL 54 H VAL 54 3.989 -1.265 -7.060
394 HA VAL 54 HA VAL 54 2.339 -3.701 -7.034
395 HB VAL 54 HB VAL 54 1.758 -3.163 -4.719
396 1HG1 VAL 54 1HG1 VAL 54 4.721 -3.242 -5.240
397 2HG1 VAL 54 2HG1 VAL 54 3.636 -4.628 -5.122
398 3HG1 VAL 54 3HG1 VAL 54 3.945 -3.623 -3.704
399 1HG2 VAL 54 1HG2 VAL 54 2.953 -1.401 -3.498
400 2HG2 VAL 54 2HG2 VAL 54 1.945 -0.740 -4.785
401 3HG2 VAL 54 3HG2 VAL 54 3.690 -0.865 -5.009
402 H LYS 55 H LYS 55 0.285 -3.577 -7.590
403 HA LYS 55 HA LYS 55 -0.933 -0.933 -7.857
404 1HB LYS 55 2HB LYS 55 -1.091 -2.465 -9.790
405 2HB LYS 55 1HB LYS 55 -1.946 -3.632 -8.791
406 1HG LYS 55 2HG LYS 55 -3.875 -2.365 -8.729
407 2HG LYS 55 1HG LYS 55 -3.028 -0.865 -9.106
408 1HD LYS 55 2HD LYS 55 -3.673 -1.140 -11.217
409 2HD LYS 55 1HD LYS 55 -2.561 -2.504 -11.305
410 1HE LYS 55 2HE LYS 55 -5.406 -2.758 -10.354
411 2HE LYS 55 1HE LYS 55 -4.940 -2.939 -12.042
412 1HZ LYS 55 1HZ LYS 55 -4.136 -4.648 -9.749
413 2HZ LYS 55 2HZ LYS 55 -3.393 -4.732 -11.269
414 3HZ LYS 55 3HZ LYS 55 -5.040 -5.088 -11.117
415 H VAL 56 H VAL 56 -1.796 -0.232 -6.015
416 HA VAL 56 HA VAL 56 -2.673 -1.971 -3.932
417 HB VAL 56 HB VAL 56 -3.238 0.986 -4.262
418 1HG1 VAL 56 1HG1 VAL 56 -3.347 -0.795 -1.832
419 2HG1 VAL 56 2HG1 VAL 56 -4.719 -0.055 -2.655
420 3HG1 VAL 56 3HG1 VAL 56 -3.540 0.958 -1.821
421 1HG2 VAL 56 1HG2 VAL 56 -0.848 0.580 -4.278
422 2HG2 VAL 56 2HG2 VAL 56 -0.983 -0.410 -2.824
423 3HG2 VAL 56 3HG2 VAL 56 -1.323 1.319 -2.747
424 H THR 57 H THR 57 -4.488 -3.135 -4.038
425 HA THR 57 HA THR 57 -6.754 -2.013 -5.546
426 HB THR 57 HB THR 57 -7.481 -4.447 -5.757
427 HG1 THR 57 1HG THR 57 -5.029 -5.493 -5.657
428 1HG2 THR 57 1HG2 THR 57 -5.961 -4.864 -7.649
429 2HG2 THR 57 2HG2 THR 57 -4.908 -3.572 -7.076
430 3HG2 THR 57 3HG2 THR 57 -6.540 -3.200 -7.630
431 H ALA 58 H ALA 58 -5.740 -2.754 -2.436
432 HA ALA 58 HA ALA 58 -8.493 -2.756 -1.477
433 1HB ALA 58 1HB ALA 58 -7.873 -5.113 -1.611
434 2HB ALA 58 2HB ALA 58 -8.073 -4.601 0.067
435 3HB ALA 58 3HB ALA 58 -6.455 -4.801 -0.608
436 H VAL 59 H VAL 59 -8.167 -0.689 -0.719
437 HA VAL 59 HA VAL 59 -6.068 -0.213 1.246
438 HB VAL 59 HB VAL 59 -8.240 1.687 0.346
439 1HG1 VAL 59 1HG1 VAL 59 -7.214 2.301 2.457
440 2HG1 VAL 59 2HG1 VAL 59 -6.715 3.421 1.190
441 3HG1 VAL 59 3HG1 VAL 59 -5.608 2.163 1.743
442 1HG2 VAL 59 1HG2 VAL 59 -6.903 0.986 -1.573
443 2HG2 VAL 59 2HG2 VAL 59 -5.426 1.419 -0.709
444 3HG2 VAL 59 3HG2 VAL 59 -6.586 2.669 -1.156
445 H LYS 60 H LYS 60 -6.386 -0.254 3.400
446 HA LYS 60 HA LYS 60 -9.158 -0.506 4.364
447 1HB LYS 60 2HB LYS 60 -6.646 -1.533 5.705
448 2HB LYS 60 1HB LYS 60 -8.300 -1.787 6.247
449 1HG LYS 60 2HG LYS 60 -7.069 -2.866 3.714
450 2HG LYS 60 1HG LYS 60 -7.435 -3.782 5.177
451 1HD LYS 60 2HD LYS 60 -9.786 -3.444 4.877
452 2HD LYS 60 1HD LYS 60 -9.507 -2.317 3.551
453 1HE LYS 60 2HE LYS 60 -10.193 -4.471 2.680
454 2HE LYS 60 1HE LYS 60 -8.522 -4.141 2.230
455 1HZ LYS 60 1HZ LYS 60 -9.456 -5.947 4.401
456 2HZ LYS 60 2HZ LYS 60 -7.833 -5.556 4.108
457 3HZ LYS 60 3HZ LYS 60 -8.715 -6.401 2.940
458 H GLU 61 H GLU 61 -8.931 0.058 6.974
459 HA GLU 61 HA GLU 61 -8.812 2.888 6.821
460 1HB GLU 61 2HB GLU 61 -9.244 1.103 9.214
461 2HB GLU 61 1HB GLU 61 -9.523 2.840 9.175
462 1HG GLU 61 2HG GLU 61 -11.146 2.401 7.294
463 2HG GLU 61 1HG GLU 61 -11.000 0.691 7.690
464 H LYS 62 H LYS 62 -6.526 0.521 7.954
465 HA LYS 62 HA LYS 62 -4.914 2.694 9.144
466 1HB LYS 62 2HB LYS 62 -4.538 -0.237 9.731
467 2HB LYS 62 1HB LYS 62 -3.918 1.138 10.628
468 1HG LYS 62 2HG LYS 62 -6.795 0.286 10.455
469 2HG LYS 62 1HG LYS 62 -5.711 0.038 11.824
470 1HD LYS 62 2HD LYS 62 -5.496 2.468 12.080
471 2HD LYS 62 1HD LYS 62 -6.606 2.701 10.723
472 1HE LYS 62 2HE LYS 62 -8.301 1.382 11.999
473 2HE LYS 62 1HE LYS 62 -7.201 1.407 13.375
474 1HZ LYS 62 1HZ LYS 62 -8.369 3.790 12.037
475 2HZ LYS 62 2HZ LYS 62 -7.297 3.829 13.350
476 3HZ LYS 62 3HZ LYS 62 -8.841 3.161 13.539
477 H PHE 63 H PHE 63 -5.006 0.157 6.817
478 HA PHE 63 HA PHE 63 -2.380 0.792 5.804
479 1HB PHE 63 2HB PHE 63 -1.778 -1.720 5.895
480 2HB PHE 63 1HB PHE 63 -1.605 -0.781 7.375
481 HD1 PHE 63 1HD PHE 63 -3.004 -1.176 9.267
482 HD2 PHE 63 2HD PHE 63 -3.613 -3.339 5.652
483 HE1 PHE 63 1HE PHE 63 -4.480 -2.737 10.463
484 HE2 PHE 63 2HE PHE 63 -5.088 -4.910 6.841
485 HZ PHE 63 HZ PHE 63 -5.520 -4.613 9.247
486 H ALA 64 H ALA 64 -1.934 -0.702 3.833
487 HA ALA 64 HA ALA 64 -4.493 -1.392 2.550
488 1HB ALA 64 1HB ALA 64 -3.708 -0.398 0.453
489 2HB ALA 64 2HB ALA 64 -2.271 0.198 1.285
490 3HB ALA 64 3HB ALA 64 -3.866 0.800 1.737
491 H PHE 65 H PHE 65 -4.302 -2.823 0.737
492 HA PHE 65 HA PHE 65 -1.861 -4.476 0.786
493 1HB PHE 65 2HB PHE 65 -4.714 -5.308 0.192
494 2HB PHE 65 1HB PHE 65 -3.311 -6.359 0.063
495 HD1 PHE 65 1HD PHE 65 -2.108 -7.075 2.086
496 HD2 PHE 65 2HD PHE 65 -5.690 -4.786 2.305
497 HE1 PHE 65 1HE PHE 65 -2.357 -7.696 4.455
498 HE2 PHE 65 2HE PHE 65 -5.943 -5.401 4.672
499 HZ PHE 65 HZ PHE 65 -4.277 -6.857 5.750
500 H ALA 66 H ALA 66 -0.854 -4.833 -1.107
501 HA ALA 66 HA ALA 66 -2.158 -3.808 -3.544
502 1HB ALA 66 1HB ALA 66 0.765 -3.539 -2.859
503 2HB ALA 66 2HB ALA 66 -0.435 -2.257 -2.704
504 3HB ALA 66 3HB ALA 66 -0.049 -2.915 -4.293
505 H GLU 67 H GLU 67 -0.734 -4.598 -5.535
506 HA GLU 67 HA GLU 67 -0.130 -7.446 -5.104
507 1HB GLU 67 2HB GLU 67 -1.176 -7.960 -7.251
508 2HB GLU 67 1HB GLU 67 -2.330 -7.203 -6.159
509 1HG GLU 67 2HG GLU 67 -2.100 -5.101 -7.300
510 2HG GLU 67 1HG GLU 67 -0.826 -5.757 -8.325
511 H ARG 68 H ARG 68 1.600 -8.260 -6.139
512 HA ARG 68 HA ARG 68 3.553 -6.527 -7.254
513 1HB ARG 68 2HB ARG 68 4.211 -8.475 -6.011
514 2HB ARG 68 1HB ARG 68 3.321 -9.534 -7.087
515 1HG ARG 68 2HG ARG 68 4.883 -9.027 -8.891
516 2HG ARG 68 1HG ARG 68 5.760 -7.924 -7.825
517 1HD ARG 68 2HD ARG 68 6.146 -9.815 -6.283
518 2HD ARG 68 1HD ARG 68 5.402 -10.888 -7.465
519 HE ARG 68 HE ARG 68 8.034 -9.661 -7.608
520 1HH1 ARG 68 1HH1 ARG 68 5.515 -11.402 -9.321
521 2HH1 ARG 68 2HH1 ARG 68 6.620 -12.125 -10.454
522 1HH2 ARG 68 1HH2 ARG 68 9.479 -10.609 -9.070
523 2HH2 ARG 68 2HH2 ARG 68 8.877 -11.644 -10.335
524 H VAL 69 H VAL 69 2.884 -5.525 -9.112
525 HA VAL 69 HA VAL 69 1.749 -7.049 -11.297
526 HB VAL 69 HB VAL 69 2.779 -4.235 -11.551
527 1HG1 VAL 69 1HG1 VAL 69 2.042 -5.354 -13.582
528 2HG1 VAL 69 2HG1 VAL 69 0.959 -4.027 -13.163
529 3HG1 VAL 69 3HG1 VAL 69 0.477 -5.692 -12.839
530 1HG2 VAL 69 1HG2 VAL 69 0.121 -5.047 -10.379
531 2HG2 VAL 69 2HG2 VAL 69 0.597 -3.404 -10.809
532 3HG2 VAL 69 3HG2 VAL 69 1.444 -4.259 -9.520
533 H LEU 70 H LEU 70 3.778 -8.479 -11.125
534 HA LEU 70 HA LEU 70 5.789 -7.456 -13.009
535 1HB LEU 70 2HB LEU 70 6.363 -9.164 -10.580
536 2HB LEU 70 1HB LEU 70 7.536 -8.699 -11.794
537 HG LEU 70 HG LEU 70 6.144 -6.856 -9.845
538 1HD1 LEU 70 1HD1 LEU 70 8.384 -6.508 -8.953
539 2HD1 LEU 70 2HD1 LEU 70 9.041 -7.650 -10.126
540 3HD1 LEU 70 3HD1 LEU 70 7.936 -8.213 -8.872
541 1HD2 LEU 70 1HD2 LEU 70 7.547 -5.094 -10.784
542 2HD2 LEU 70 2HD2 LEU 70 6.441 -5.749 -11.990
543 3HD2 LEU 70 3HD2 LEU 70 8.142 -6.216 -12.006
Start of MODEL 5
1 1H MET 1 1H MET 1 0.960 21.294 8.690
2 2H MET 1 2H MET 1 1.057 22.138 7.223
3 3H MET 1 3H MET 1 2.404 21.275 7.795
4 HA MET 1 HA MET 1 1.341 20.070 6.020
5 1HB MET 1 2HB MET 1 0.979 18.871 8.769
6 2HB MET 1 1HB MET 1 0.806 17.951 7.282
7 1HG MET 1 2HG MET 1 3.311 19.383 8.136
8 2HG MET 1 1HG MET 1 2.994 17.667 8.382
9 1HE MET 1 1HE MET 1 5.632 18.500 6.972
10 2HE MET 1 2HE MET 1 5.641 17.395 5.596
11 3HE MET 1 3HE MET 1 5.094 16.831 7.174
12 H ALA 2 H ALA 2 -0.872 20.152 8.835
13 HA ALA 2 HA ALA 2 -3.039 19.398 7.022
14 1HB ALA 2 1HB ALA 2 -2.631 18.027 9.018
15 2HB ALA 2 2HB ALA 2 -4.252 18.725 8.997
16 3HB ALA 2 3HB ALA 2 -3.004 19.421 10.032
17 H PHE 3 H PHE 3 -1.864 22.283 7.962
18 HA PHE 3 HA PHE 3 -4.366 23.467 8.815
19 1HB PHE 3 2HB PHE 3 -2.159 24.286 9.680
20 2HB PHE 3 1HB PHE 3 -1.815 24.906 8.066
21 HD1 PHE 3 1HD PHE 3 -4.013 25.239 10.999
22 HD2 PHE 3 2HD PHE 3 -2.786 26.931 7.293
23 HE1 PHE 3 1HE PHE 3 -5.207 27.315 11.558
24 HE2 PHE 3 2HE PHE 3 -3.980 29.011 7.844
25 HZ PHE 3 HZ PHE 3 -5.191 29.204 9.982
26 H GLY 4 H GLY 4 -5.899 23.780 7.407
27 1HA GLY 4 2HA GLY 4 -6.378 25.292 5.395
28 2HA GLY 4 1HA GLY 4 -5.198 24.264 4.585
29 H LYS 5 H LYS 5 -5.804 21.825 5.655
30 HA LYS 5 HA LYS 5 -8.576 21.271 5.772
31 1HB LYS 5 2HB LYS 5 -8.764 19.834 3.780
32 2HB LYS 5 1HB LYS 5 -8.483 21.512 3.351
33 1HG LYS 5 2HG LYS 5 -6.431 21.091 2.472
34 2HG LYS 5 1HG LYS 5 -6.118 19.742 3.565
35 1HD LYS 5 2HD LYS 5 -8.165 18.712 2.176
36 2HD LYS 5 1HD LYS 5 -7.492 19.789 0.948
37 1HE LYS 5 2HE LYS 5 -6.507 17.562 0.795
38 2HE LYS 5 1HE LYS 5 -5.295 18.765 1.243
39 1HZ LYS 5 1HZ LYS 5 -6.570 16.727 2.976
40 2HZ LYS 5 2HZ LYS 5 -5.771 18.073 3.618
41 3HZ LYS 5 3HZ LYS 5 -4.917 16.965 2.665
42 HA PRO 6 HA PRO 6 -5.991 18.149 7.865
43 1HB PRO 6 2HB PRO 6 -7.945 18.263 9.992
44 2HB PRO 6 1HB PRO 6 -6.254 18.768 10.029
45 1HG PRO 6 2HG PRO 6 -8.366 20.499 10.192
46 2HG PRO 6 1HG PRO 6 -6.766 20.947 9.577
47 1HD PRO 6 2HD PRO 6 -9.260 20.262 8.065
48 2HD PRO 6 1HD PRO 6 -8.046 21.518 7.733
49 H ALA 7 H ALA 7 -8.172 17.791 5.905
50 HA ALA 7 HA ALA 7 -9.051 15.147 6.631
51 1HB ALA 7 1HB ALA 7 -11.128 17.300 6.190
52 2HB ALA 7 2HB ALA 7 -10.714 16.610 7.759
53 3HB ALA 7 3HB ALA 7 -11.431 15.592 6.512
54 H MET 8 H MET 8 -11.243 15.219 4.753
55 HA MET 8 HA MET 8 -11.805 15.160 2.568
56 1HB MET 8 2HB MET 8 -10.479 17.331 2.350
57 2HB MET 8 1HB MET 8 -9.143 16.337 1.788
58 1HG MET 8 2HG MET 8 -10.554 15.508 -0.042
59 2HG MET 8 1HG MET 8 -11.860 16.556 0.509
60 1HE MET 8 1HE MET 8 -12.160 17.726 -1.779
61 2HE MET 8 2HE MET 8 -10.939 16.662 -2.479
62 3HE MET 8 3HE MET 8 -10.841 18.405 -2.734
63 H LYS 9 H LYS 9 -10.052 13.306 4.148
64 HA LYS 9 HA LYS 9 -9.325 11.165 3.910
65 1HB LYS 9 2HB LYS 9 -10.905 11.374 1.338
66 2HB LYS 9 1HB LYS 9 -10.393 9.873 2.100
67 1HG LYS 9 2HG LYS 9 -11.827 10.217 3.955
68 2HG LYS 9 1HG LYS 9 -12.148 11.886 3.480
69 1HD LYS 9 2HD LYS 9 -14.050 10.502 2.922
70 2HD LYS 9 1HD LYS 9 -13.269 11.062 1.445
71 1HE LYS 9 2HE LYS 9 -12.166 8.913 1.189
72 2HE LYS 9 1HE LYS 9 -12.862 8.354 2.708
73 1HZ LYS 9 1HZ LYS 9 -14.113 7.523 0.821
74 2HZ LYS 9 2HZ LYS 9 -14.391 9.106 0.273
75 3HZ LYS 9 3HZ LYS 9 -15.068 8.583 1.739
76 H ASN 10 H ASN 10 -7.303 12.825 3.292
77 HA ASN 10 HA ASN 10 -6.274 12.253 0.657
78 1HB ASN 10 2HB ASN 10 -4.280 13.583 1.420
79 2HB ASN 10 1HB ASN 10 -5.809 14.450 1.471
80 1HD2 ASN 10 1HD2 ASN 10 -3.171 13.183 3.285
81 2HD2 ASN 10 2HD2 ASN 10 -3.629 13.849 4.813
82 H VAL 11 H VAL 11 -6.571 9.887 1.453
83 HA VAL 11 HA VAL 11 -4.489 8.661 2.936
84 HB VAL 11 HB VAL 11 -6.170 7.467 0.718
85 1HG1 VAL 11 1HG1 VAL 11 -4.221 6.108 1.203
86 2HG1 VAL 11 2HG1 VAL 11 -5.682 5.322 1.803
87 3HG1 VAL 11 3HG1 VAL 11 -4.600 6.147 2.925
88 1HG2 VAL 11 1HG2 VAL 11 -6.635 7.519 3.698
89 2HG2 VAL 11 2HG2 VAL 11 -7.612 6.640 2.525
90 3HG2 VAL 11 3HG2 VAL 11 -7.562 8.402 2.487
91 HA PRO 12 HA PRO 12 -1.095 9.392 0.189
92 1HB PRO 12 2HB PRO 12 0.443 7.231 1.017
93 2HB PRO 12 1HB PRO 12 0.409 8.820 1.781
94 1HG PRO 12 2HG PRO 12 -1.017 6.318 2.549
95 2HG PRO 12 1HG PRO 12 -0.278 7.555 3.582
96 1HD PRO 12 2HD PRO 12 -2.932 7.421 3.230
97 2HD PRO 12 1HD PRO 12 -2.095 8.980 3.387
98 H VAL 13 H VAL 13 -2.575 6.216 0.402
99 HA VAL 13 HA VAL 13 -1.472 5.516 -2.223
100 HB VAL 13 HB VAL 13 -2.332 3.197 -1.677
101 1HG1 VAL 13 1HG1 VAL 13 -0.454 2.687 -0.185
102 2HG1 VAL 13 2HG1 VAL 13 -0.273 4.404 0.170
103 3HG1 VAL 13 3HG1 VAL 13 0.022 3.806 -1.462
104 1HG2 VAL 13 1HG2 VAL 13 -2.650 4.426 1.061
105 2HG2 VAL 13 2HG2 VAL 13 -2.741 2.701 0.693
106 3HG2 VAL 13 3HG2 VAL 13 -3.948 3.808 0.038
107 H GLU 14 H GLU 14 -2.714 5.582 -3.958
108 HA GLU 14 HA GLU 14 -5.589 5.977 -3.626
109 1HB GLU 14 2HB GLU 14 -3.767 6.292 -6.016
110 2HB GLU 14 1HB GLU 14 -5.504 6.557 -6.060
111 1HG GLU 14 2HG GLU 14 -5.306 8.372 -4.476
112 2HG GLU 14 1HG GLU 14 -3.576 8.068 -4.311
113 H ALA 15 H ALA 15 -6.829 4.246 -3.652
114 HA ALA 15 HA ALA 15 -6.052 1.675 -4.402
115 1HB ALA 15 1HB ALA 15 -8.410 1.076 -4.206
116 2HB ALA 15 2HB ALA 15 -8.849 2.785 -4.206
117 3HB ALA 15 3HB ALA 15 -7.901 2.117 -2.875
118 H GLY 16 H GLY 16 -5.743 0.780 -6.302
119 1HA GLY 16 2HA GLY 16 -6.739 0.163 -8.456
120 2HA GLY 16 1HA GLY 16 -7.215 1.846 -8.634
121 H LYS 17 H LYS 17 -4.646 2.816 -7.574
122 HA LYS 17 HA LYS 17 -3.220 2.662 -10.102
123 1HB LYS 17 2HB LYS 17 -2.877 4.428 -7.681
124 2HB LYS 17 1HB LYS 17 -1.813 4.482 -9.080
125 1HG LYS 17 2HG LYS 17 -3.690 5.083 -10.504
126 2HG LYS 17 1HG LYS 17 -4.779 5.001 -9.118
127 1HD LYS 17 2HD LYS 17 -3.600 6.821 -8.043
128 2HD LYS 17 1HD LYS 17 -2.415 6.858 -9.350
129 1HE LYS 17 2HE LYS 17 -4.135 7.507 -10.930
130 2HE LYS 17 1HE LYS 17 -5.368 7.381 -9.675
131 1HZ LYS 17 1HZ LYS 17 -3.061 9.238 -9.525
132 2HZ LYS 17 2HZ LYS 17 -4.432 9.210 -8.518
133 3HZ LYS 17 3HZ LYS 17 -4.575 9.678 -10.144
134 H GLU 18 H GLU 18 -1.038 2.169 -10.292
135 HA GLU 18 HA GLU 18 -0.022 0.434 -8.153
136 1HB GLU 18 2HB GLU 18 1.373 -0.614 -9.929
137 2HB GLU 18 1HB GLU 18 -0.354 -0.798 -10.192
138 1HG GLU 18 2HG GLU 18 1.257 1.353 -11.518
139 2HG GLU 18 1HG GLU 18 1.080 -0.254 -12.210
140 H TYR 19 H TYR 19 2.061 0.644 -7.412
141 HA TYR 19 HA TYR 19 3.486 3.093 -8.236
142 1HB TYR 19 2HB TYR 19 3.142 2.101 -5.397
143 2HB TYR 19 1HB TYR 19 4.020 3.539 -5.894
144 HD1 TYR 19 1HD TYR 19 0.675 2.054 -5.462
145 HD2 TYR 19 2HD TYR 19 2.869 5.581 -6.404
146 HE1 TYR 19 1HE TYR 19 -1.358 3.396 -5.142
147 HE2 TYR 19 2HE TYR 19 0.835 6.929 -6.095
148 HH TYR 19 HH TYR 19 -1.509 6.734 -6.032
149 H GLU 20 H GLU 20 5.720 2.968 -8.240
150 HA GLU 20 HA GLU 20 6.960 0.369 -8.018
151 1HB GLU 20 2HB GLU 20 7.577 2.332 -9.618
152 2HB GLU 20 1HB GLU 20 8.422 2.996 -8.228
153 1HG GLU 20 2HG GLU 20 10.071 1.875 -9.406
154 2HG GLU 20 1HG GLU 20 9.633 0.747 -8.125
155 H VAL 21 H VAL 21 7.230 -0.420 -5.981
156 HA VAL 21 HA VAL 21 7.957 1.505 -3.865
157 HB VAL 21 HB VAL 21 6.750 0.118 -2.257
158 1HG1 VAL 21 1HG1 VAL 21 5.072 0.856 -4.648
159 2HG1 VAL 21 2HG1 VAL 21 5.579 1.946 -3.354
160 3HG1 VAL 21 3HG1 VAL 21 4.482 0.609 -3.003
161 1HG2 VAL 21 1HG2 VAL 21 5.314 -1.718 -3.013
162 2HG2 VAL 21 2HG2 VAL 21 7.014 -2.053 -3.330
163 3HG2 VAL 21 3HG2 VAL 21 5.956 -1.548 -4.646
164 H THR 22 H THR 22 8.929 0.427 -1.925
165 HA THR 22 HA THR 22 10.833 -1.667 -2.732
166 HB THR 22 HB THR 22 11.198 0.371 -0.518
167 HG1 THR 22 1HG THR 22 11.184 0.952 -3.002
168 1HG2 THR 22 1HG2 THR 22 13.561 -0.299 -0.652
169 2HG2 THR 22 2HG2 THR 22 13.149 -1.486 -1.890
170 3HG2 THR 22 3HG2 THR 22 12.523 -1.667 -0.250
171 H ILE 23 H ILE 23 11.417 -3.186 -0.992
172 HA ILE 23 HA ILE 23 9.163 -3.679 0.822
173 HB ILE 23 HB ILE 23 10.815 -5.799 -0.565
174 1HG1 ILE 23 2HG1 ILE 23 9.434 -4.570 -2.182
175 2HG1 ILE 23 1HG1 ILE 23 8.844 -6.212 -1.958
176 1HG2 ILE 23 1HG2 ILE 23 8.278 -6.006 1.055
177 2HG2 ILE 23 2HG2 ILE 23 9.885 -6.501 1.583
178 3HG2 ILE 23 3HG2 ILE 23 9.099 -7.340 0.247
179 1HD1 ILE 23 1HD1 ILE 23 7.089 -5.364 -0.477
180 2HD1 ILE 23 2HD1 ILE 23 7.007 -4.636 -2.080
181 3HD1 ILE 23 3HD1 ILE 23 7.680 -3.724 -0.730
182 H GLU 24 H GLU 24 10.734 -2.260 1.965
183 HA GLU 24 HA GLU 24 13.133 -3.361 3.015
184 1HB GLU 24 2HB GLU 24 12.984 -1.407 4.611
185 2HB GLU 24 1HB GLU 24 13.009 -1.007 2.901
186 1HG GLU 24 2HG GLU 24 10.512 -0.820 3.003
187 2HG GLU 24 1HG GLU 24 10.640 -0.995 4.752
188 H ASP 25 H ASP 25 9.931 -4.032 3.732
189 HA ASP 25 HA ASP 25 10.758 -5.383 6.209
190 1HB ASP 25 2HB ASP 25 8.258 -3.740 5.794
191 2HB ASP 25 1HB ASP 25 8.369 -4.971 7.045
192 H MET 26 H MET 26 9.636 -7.367 6.625
193 HA MET 26 HA MET 26 7.721 -8.226 4.576
194 1HB MET 26 2HB MET 26 10.073 -9.858 5.546
195 2HB MET 26 1HB MET 26 8.741 -10.501 4.597
196 1HG MET 26 2HG MET 26 9.376 -8.724 2.863
197 2HG MET 26 1HG MET 26 10.885 -8.585 3.769
198 1HE MET 26 1HE MET 26 9.384 -12.431 1.737
199 2HE MET 26 2HE MET 26 8.640 -10.848 1.509
200 3HE MET 26 3HE MET 26 8.573 -11.633 3.087
201 H GLY 27 H GLY 27 6.284 -9.899 5.253
202 1HA GLY 27 2HA GLY 27 5.748 -9.835 8.108
203 2HA GLY 27 1HA GLY 27 4.732 -10.562 6.868
204 H LYS 28 H LYS 28 7.726 -11.611 6.215
205 HA LYS 28 HA LYS 28 8.996 -13.435 6.583
206 1HB LYS 28 2HB LYS 28 8.912 -12.568 8.946
207 2HB LYS 28 1HB LYS 28 7.611 -13.711 9.240
208 1HG LYS 28 2HG LYS 28 9.102 -15.564 8.730
209 2HG LYS 28 1HG LYS 28 10.404 -14.430 8.377
210 1HD LYS 28 2HD LYS 28 10.313 -13.625 10.694
211 2HD LYS 28 1HD LYS 28 9.037 -14.794 11.043
212 1HE LYS 28 2HE LYS 28 11.243 -15.586 11.780
213 2HE LYS 28 1HE LYS 28 10.547 -16.629 10.541
214 1HZ LYS 28 1HZ LYS 28 12.600 -14.529 10.067
215 2HZ LYS 28 2HZ LYS 28 11.944 -15.568 8.894
216 3HZ LYS 28 3HZ LYS 28 12.897 -16.200 10.142
217 H GLY 29 H GLY 29 6.048 -13.498 5.771
218 1HA GLY 29 2HA GLY 29 5.835 -16.446 5.797
219 2HA GLY 29 1HA GLY 29 4.425 -15.412 5.985
220 H GLY 30 H GLY 30 6.975 -14.508 3.838
221 1HA GLY 30 2HA GLY 30 7.085 -14.782 1.480
222 2HA GLY 30 1HA GLY 30 5.425 -15.366 1.499
223 H ASP 31 H ASP 31 4.369 -13.326 3.137
224 HA ASP 31 HA ASP 31 3.896 -11.239 1.274
225 1HB ASP 31 2HB ASP 31 2.134 -11.776 2.780
226 2HB ASP 31 1HB ASP 31 3.191 -11.638 4.180
227 H GLY 32 H GLY 32 4.741 -9.237 1.123
228 1HA GLY 32 2HA GLY 32 6.888 -8.517 3.024
229 2HA GLY 32 1HA GLY 32 6.939 -8.131 1.308
230 H ILE 33 H ILE 33 7.174 -6.224 3.415
231 HA ILE 33 HA ILE 33 4.611 -4.796 3.198
232 HB ILE 33 HB ILE 33 6.692 -4.764 5.372
233 1HG1 ILE 33 2HG1 ILE 33 4.570 -4.959 6.785
234 2HG1 ILE 33 1HG1 ILE 33 3.716 -5.257 5.276
235 1HG2 ILE 33 1HG2 ILE 33 6.264 -2.435 4.854
236 2HG2 ILE 33 2HG2 ILE 33 5.532 -2.864 6.402
237 3HG2 ILE 33 3HG2 ILE 33 4.526 -2.710 4.963
238 1HD1 ILE 33 1HD1 ILE 33 5.952 -6.924 6.403
239 2HD1 ILE 33 2HD1 ILE 33 5.101 -7.224 4.891
240 3HD1 ILE 33 3HD1 ILE 33 4.236 -7.322 6.423
241 H ALA 34 H ALA 34 4.735 -3.434 1.554
242 HA ALA 34 HA ALA 34 7.092 -1.821 1.053
243 1HB ALA 34 1HB ALA 34 4.312 -1.631 -0.101
244 2HB ALA 34 2HB ALA 34 5.647 -2.554 -0.793
245 3HB ALA 34 3HB ALA 34 5.746 -0.795 -0.697
246 H ARG 35 H ARG 35 6.944 0.552 1.045
247 HA ARG 35 HA ARG 35 5.098 1.599 3.076
248 1HB ARG 35 2HB ARG 35 7.732 1.108 3.604
249 2HB ARG 35 1HB ARG 35 7.788 2.778 3.086
250 1HG ARG 35 2HG ARG 35 7.569 2.670 5.477
251 2HG ARG 35 1HG ARG 35 6.084 3.327 4.780
252 1HD ARG 35 2HD ARG 35 4.848 1.582 5.471
253 2HD ARG 35 1HD ARG 35 6.100 0.413 5.054
254 HE ARG 35 HE ARG 35 5.723 1.750 7.615
255 1HH1 ARG 35 1HH1 ARG 35 7.732 -0.268 5.585
256 2HH1 ARG 35 2HH1 ARG 35 8.654 -0.934 6.898
257 1HH2 ARG 35 1HH2 ARG 35 6.922 0.893 9.360
258 2HH2 ARG 35 2HH2 ARG 35 8.196 -0.251 9.060
259 H ILE 36 H ILE 36 3.870 2.877 1.798
260 HA ILE 36 HA ILE 36 5.258 4.725 -0.019
261 HB ILE 36 HB ILE 36 2.333 3.991 0.114
262 1HG1 ILE 36 2HG1 ILE 36 4.478 3.404 -1.937
263 2HG1 ILE 36 1HG1 ILE 36 3.769 2.239 -0.820
264 1HG2 ILE 36 1HG2 ILE 36 2.638 6.333 -0.537
265 2HG2 ILE 36 2HG2 ILE 36 2.062 5.359 -1.890
266 3HG2 ILE 36 3HG2 ILE 36 3.758 5.836 -1.805
267 1HD1 ILE 36 1HD1 ILE 36 1.619 2.498 -1.889
268 2HD1 ILE 36 2HD1 ILE 36 2.848 2.059 -3.074
269 3HD1 ILE 36 3HD1 ILE 36 2.284 3.726 -2.964
270 H ASP 37 H ASP 37 5.726 6.579 0.823
271 HA ASP 37 HA ASP 37 5.607 8.566 1.947
272 1HB ASP 37 2HB ASP 37 3.375 8.735 0.840
273 2HB ASP 37 1HB ASP 37 2.652 7.951 2.238
274 H GLY 38 H GLY 38 5.467 5.689 3.324
275 1HA GLY 38 2HA GLY 38 6.127 5.317 5.609
276 2HA GLY 38 1HA GLY 38 5.215 6.749 6.064
277 H PHE 39 H PHE 39 3.283 5.417 3.922
278 HA PHE 39 HA PHE 39 1.560 4.177 5.869
279 1HB PHE 39 2HB PHE 39 0.761 5.696 4.028
280 2HB PHE 39 1HB PHE 39 1.217 4.457 2.869
281 HD1 PHE 39 1HD PHE 39 -0.035 2.366 2.738
282 HD2 PHE 39 2HD PHE 39 -1.222 5.543 5.309
283 HE1 PHE 39 1HE PHE 39 -2.275 1.379 2.922
284 HE2 PHE 39 2HE PHE 39 -3.465 4.557 5.501
285 HZ PHE 39 HZ PHE 39 -3.987 2.476 4.296
286 H VAL 40 H VAL 40 1.154 2.030 6.057
287 HA VAL 40 HA VAL 40 3.172 0.278 4.972
288 HB VAL 40 HB VAL 40 0.871 -0.372 6.817
289 1HG1 VAL 40 1HG1 VAL 40 2.199 -2.329 7.425
290 2HG1 VAL 40 2HG1 VAL 40 3.430 -1.863 6.251
291 3HG1 VAL 40 3HG1 VAL 40 1.821 -2.330 5.701
292 1HG2 VAL 40 1HG2 VAL 40 2.487 -0.137 8.631
293 2HG2 VAL 40 2HG2 VAL 40 2.324 1.375 7.730
294 3HG2 VAL 40 3HG2 VAL 40 3.729 0.340 7.470
295 H VAL 41 H VAL 41 2.962 -0.843 3.177
296 HA VAL 41 HA VAL 41 0.254 -1.550 2.260
297 HB VAL 41 HB VAL 41 2.617 -0.833 0.506
298 1HG1 VAL 41 1HG1 VAL 41 -0.241 -1.507 -0.177
299 2HG1 VAL 41 2HG1 VAL 41 1.179 -2.494 -0.521
300 3HG1 VAL 41 3HG1 VAL 41 0.973 -0.935 -1.320
301 1HG2 VAL 41 1HG2 VAL 41 0.095 0.703 1.137
302 2HG2 VAL 41 2HG2 VAL 41 1.266 1.140 -0.108
303 3HG2 VAL 41 3HG2 VAL 41 1.744 1.146 1.590
304 H PHE 42 H PHE 42 -0.005 -3.659 2.494
305 HA PHE 42 HA PHE 42 2.220 -5.468 2.647
306 1HB PHE 42 2HB PHE 42 -0.767 -5.849 2.779
307 2HB PHE 42 1HB PHE 42 0.359 -7.202 2.838
308 HD1 PHE 42 1HD PHE 42 1.569 -7.711 4.788
309 HD2 PHE 42 2HD PHE 42 -0.763 -4.162 4.598
310 HE1 PHE 42 1HE PHE 42 1.831 -7.416 7.216
311 HE2 PHE 42 2HE PHE 42 -0.505 -3.856 7.025
312 HZ PHE 42 HZ PHE 42 0.796 -5.482 8.338
313 H VAL 43 H VAL 43 3.036 -6.722 1.134
314 HA VAL 43 HA VAL 43 1.624 -6.931 -1.448
315 HB VAL 43 HB VAL 43 4.626 -6.852 -1.160
316 1HG1 VAL 43 1HG1 VAL 43 4.547 -6.394 -3.557
317 2HG1 VAL 43 2HG1 VAL 43 2.790 -6.511 -3.520
318 3HG1 VAL 43 3HG1 VAL 43 3.775 -7.928 -3.160
319 1HG2 VAL 43 1HG2 VAL 43 4.556 -4.541 -1.936
320 2HG2 VAL 43 2HG2 VAL 43 3.726 -4.713 -0.389
321 3HG2 VAL 43 3HG2 VAL 43 2.795 -4.566 -1.882
322 HA PRO 44 HA PRO 44 1.543 -11.076 0.036
323 1HB PRO 44 2HB PRO 44 0.698 -11.698 -2.731
324 2HB PRO 44 1HB PRO 44 -0.113 -12.034 -1.198
325 1HG PRO 44 2HG PRO 44 -0.988 -10.105 -2.815
326 2HG PRO 44 1HG PRO 44 -1.007 -9.903 -1.052
327 1HD PRO 44 2HD PRO 44 0.895 -8.784 -3.071
328 2HD PRO 44 1HD PRO 44 0.211 -8.021 -1.622
329 H ASN 45 H ASN 45 3.290 -10.355 -2.956
330 HA ASN 45 HA ASN 45 4.847 -12.804 -2.511
331 1HB ASN 45 2HB ASN 45 3.453 -11.993 -5.032
332 2HB ASN 45 1HB ASN 45 4.939 -12.927 -5.120
333 1HD2 ASN 45 1HD2 ASN 45 1.586 -12.957 -4.326
334 2HD2 ASN 45 2HD2 ASN 45 1.455 -14.661 -4.037
335 H ALA 46 H ALA 46 5.303 -9.812 -2.189
336 HA ALA 46 HA ALA 46 7.546 -9.388 -3.986
337 1HB ALA 46 1HB ALA 46 6.069 -7.528 -3.304
338 2HB ALA 46 2HB ALA 46 7.771 -7.239 -2.950
339 3HB ALA 46 3HB ALA 46 6.667 -7.703 -1.654
340 H GLU 47 H GLU 47 9.647 -9.708 -3.541
341 HA GLU 47 HA GLU 47 10.373 -10.988 -1.050
342 1HB GLU 47 2HB GLU 47 11.960 -10.353 -3.542
343 2HB GLU 47 1HB GLU 47 12.590 -11.233 -2.163
344 1HG GLU 47 2HG GLU 47 10.301 -12.099 -3.909
345 2HG GLU 47 1HG GLU 47 11.945 -12.738 -3.954
346 H LYS 48 H LYS 48 12.197 -10.261 0.240
347 HA LYS 48 HA LYS 48 12.032 -7.508 0.873
348 1HB LYS 48 2HB LYS 48 12.647 -9.302 2.496
349 2HB LYS 48 1HB LYS 48 14.200 -9.452 1.681
350 1HG LYS 48 2HG LYS 48 14.597 -7.030 2.190
351 2HG LYS 48 1HG LYS 48 13.143 -7.077 3.189
352 1HD LYS 48 2HD LYS 48 14.144 -8.834 4.564
353 2HD LYS 48 1HD LYS 48 15.598 -8.791 3.562
354 1HE LYS 48 2HE LYS 48 14.514 -6.586 5.309
355 2HE LYS 48 1HE LYS 48 15.996 -7.507 5.554
356 1HZ LYS 48 1HZ LYS 48 16.582 -5.409 4.641
357 2HZ LYS 48 2HZ LYS 48 15.437 -5.538 3.402
358 3HZ LYS 48 3HZ LYS 48 16.790 -6.551 3.403
359 H GLY 49 H GLY 49 12.992 -5.838 -0.045
360 1HA GLY 49 2HA GLY 49 14.833 -4.616 -0.835
361 2HA GLY 49 1HA GLY 49 15.690 -6.125 -1.113
362 H SER 50 H SER 50 12.707 -6.592 -2.395
363 HA SER 50 HA SER 50 13.673 -6.202 -5.071
364 1HB SER 50 2HB SER 50 10.964 -7.091 -4.057
365 2HB SER 50 1HB SER 50 11.458 -7.095 -5.750
366 HG SER 50 HG SER 50 13.238 -8.385 -4.099
367 H VAL 51 H VAL 51 13.161 -4.641 -6.492
368 HA VAL 51 HA VAL 51 11.519 -2.401 -5.569
369 HB VAL 51 HB VAL 51 13.060 -2.666 -8.166
370 1HG1 VAL 51 1HG1 VAL 51 12.800 -0.233 -8.299
371 2HG1 VAL 51 2HG1 VAL 51 11.876 -0.249 -6.795
372 3HG1 VAL 51 3HG1 VAL 51 11.231 -1.038 -8.234
373 1HG2 VAL 51 1HG2 VAL 51 13.870 -1.329 -5.577
374 2HG2 VAL 51 2HG2 VAL 51 14.749 -1.204 -7.101
375 3HG2 VAL 51 3HG2 VAL 51 14.608 -2.764 -6.288
376 H ILE 52 H ILE 52 9.404 -2.821 -5.805
377 HA ILE 52 HA ILE 52 8.597 -4.286 -8.220
378 HB ILE 52 HB ILE 52 8.449 -5.913 -6.612
379 1HG1 ILE 52 2HG1 ILE 52 5.684 -4.698 -6.572
380 2HG1 ILE 52 1HG1 ILE 52 6.327 -5.713 -7.860
381 1HG2 ILE 52 1HG2 ILE 52 8.892 -4.529 -4.665
382 2HG2 ILE 52 2HG2 ILE 52 7.544 -5.623 -4.359
383 3HG2 ILE 52 3HG2 ILE 52 7.234 -3.923 -4.710
384 1HD1 ILE 52 1HD1 ILE 52 6.490 -7.581 -6.362
385 2HD1 ILE 52 2HD1 ILE 52 4.860 -6.912 -6.311
386 3HD1 ILE 52 3HD1 ILE 52 5.992 -6.575 -5.003
387 H ASN 53 H ASN 53 6.866 -3.747 -9.223
388 HA ASN 53 HA ASN 53 5.504 -1.279 -8.514
389 1HB ASN 53 2HB ASN 53 6.186 -1.679 -10.859
390 2HB ASN 53 1HB ASN 53 5.160 -3.108 -10.913
391 1HD2 ASN 53 1HD2 ASN 53 3.948 -2.289 -12.608
392 2HD2 ASN 53 2HD2 ASN 53 2.809 -1.006 -12.396
393 H VAL 54 H VAL 54 3.803 -1.357 -7.208
394 HA VAL 54 HA VAL 54 2.191 -3.829 -7.188
395 HB VAL 54 HB VAL 54 1.701 -3.415 -4.815
396 1HG1 VAL 54 1HG1 VAL 54 4.654 -3.509 -5.386
397 2HG1 VAL 54 2HG1 VAL 54 3.549 -4.881 -5.466
398 3HG1 VAL 54 3HG1 VAL 54 3.847 -4.079 -3.924
399 1HG2 VAL 54 1HG2 VAL 54 2.999 -1.772 -3.544
400 2HG2 VAL 54 2HG2 VAL 54 1.995 -0.990 -4.765
401 3HG2 VAL 54 3HG2 VAL 54 3.727 -1.188 -5.041
402 H LYS 55 H LYS 55 0.061 -3.651 -7.516
403 HA LYS 55 HA LYS 55 -1.046 -0.941 -7.738
404 1HB LYS 55 2HB LYS 55 -1.359 -2.512 -9.632
405 2HB LYS 55 1HB LYS 55 -2.242 -3.596 -8.566
406 1HG LYS 55 2HG LYS 55 -3.916 -1.799 -8.214
407 2HG LYS 55 1HG LYS 55 -3.046 -0.817 -9.403
408 1HD LYS 55 2HD LYS 55 -4.046 -3.579 -10.040
409 2HD LYS 55 1HD LYS 55 -5.063 -2.149 -10.235
410 1HE LYS 55 2HE LYS 55 -2.333 -2.351 -11.467
411 2HE LYS 55 1HE LYS 55 -3.775 -2.959 -12.283
412 1HZ LYS 55 1HZ LYS 55 -2.954 -0.541 -12.693
413 2HZ LYS 55 2HZ LYS 55 -3.772 -0.211 -11.244
414 3HZ LYS 55 3HZ LYS 55 -4.613 -0.863 -12.561
415 H VAL 56 H VAL 56 -1.813 -0.180 -5.859
416 HA VAL 56 HA VAL 56 -2.645 -1.896 -3.732
417 HB VAL 56 HB VAL 56 -3.085 1.084 -4.015
418 1HG1 VAL 56 1HG1 VAL 56 -3.099 -0.700 -1.584
419 2HG1 VAL 56 2HG1 VAL 56 -4.511 0.051 -2.328
420 3HG1 VAL 56 3HG1 VAL 56 -3.271 1.055 -1.573
421 1HG2 VAL 56 1HG2 VAL 56 -0.814 -0.428 -2.721
422 2HG2 VAL 56 2HG2 VAL 56 -1.063 1.315 -2.624
423 3HG2 VAL 56 3HG2 VAL 56 -0.714 0.558 -4.179
424 H THR 57 H THR 57 -4.468 -3.036 -3.889
425 HA THR 57 HA THR 57 -6.717 -1.898 -5.385
426 HB THR 57 HB THR 57 -7.521 -4.342 -5.288
427 HG1 THR 57 1HG THR 57 -5.589 -5.772 -5.109
428 1HG2 THR 57 1HG2 THR 57 -6.653 -3.264 -7.311
429 2HG2 THR 57 2HG2 THR 57 -6.128 -4.945 -7.212
430 3HG2 THR 57 3HG2 THR 57 -5.005 -3.646 -6.810
431 H ALA 58 H ALA 58 -5.764 -2.771 -2.198
432 HA ALA 58 HA ALA 58 -8.511 -2.378 -1.275
433 1HB ALA 58 1HB ALA 58 -6.721 -4.607 -0.311
434 2HB ALA 58 2HB ALA 58 -8.130 -4.796 -1.353
435 3HB ALA 58 3HB ALA 58 -8.330 -4.224 0.301
436 H VAL 59 H VAL 59 -7.984 -0.351 -0.574
437 HA VAL 59 HA VAL 59 -5.858 0.012 1.371
438 HB VAL 59 HB VAL 59 -7.917 2.015 0.428
439 1HG1 VAL 59 1HG1 VAL 59 -6.886 2.587 2.568
440 2HG1 VAL 59 2HG1 VAL 59 -6.371 3.693 1.289
441 3HG1 VAL 59 3HG1 VAL 59 -5.286 2.416 1.845
442 1HG2 VAL 59 1HG2 VAL 59 -6.121 2.896 -1.014
443 2HG2 VAL 59 2HG2 VAL 59 -6.612 1.263 -1.463
444 3HG2 VAL 59 3HG2 VAL 59 -5.115 1.521 -0.568
445 H LYS 60 H LYS 60 -6.193 -0.484 3.430
446 HA LYS 60 HA LYS 60 -8.887 -0.251 4.547
447 1HB LYS 60 2HB LYS 60 -6.390 -1.664 5.450
448 2HB LYS 60 1HB LYS 60 -7.664 -1.302 6.602
449 1HG LYS 60 2HG LYS 60 -7.878 -3.571 5.800
450 2HG LYS 60 1HG LYS 60 -9.245 -2.606 5.249
451 1HD LYS 60 2HD LYS 60 -8.299 -2.425 3.046
452 2HD LYS 60 1HD LYS 60 -6.815 -3.225 3.573
453 1HE LYS 60 2HE LYS 60 -8.300 -4.735 2.327
454 2HE LYS 60 1HE LYS 60 -8.032 -5.277 3.982
455 1HZ LYS 60 1HZ LYS 60 -10.369 -5.435 3.198
456 2HZ LYS 60 2HZ LYS 60 -10.425 -3.737 3.126
457 3HZ LYS 60 3HZ LYS 60 -10.176 -4.521 4.612
458 H GLU 61 H GLU 61 -8.294 0.260 7.186
459 HA GLU 61 HA GLU 61 -8.035 3.082 7.101
460 1HB GLU 61 2HB GLU 61 -8.078 1.242 9.495
461 2HB GLU 61 1HB GLU 61 -8.377 2.977 9.513
462 1HG GLU 61 2HG GLU 61 -10.369 2.704 8.207
463 2HG GLU 61 1HG GLU 61 -10.041 0.985 7.997
464 H LYS 62 H LYS 62 -5.976 0.571 8.581
465 HA LYS 62 HA LYS 62 -3.994 2.612 9.216
466 1HB LYS 62 2HB LYS 62 -4.150 -0.309 9.947
467 2HB LYS 62 1HB LYS 62 -2.883 0.786 10.479
468 1HG LYS 62 2HG LYS 62 -4.500 2.120 11.691
469 2HG LYS 62 1HG LYS 62 -5.812 1.088 11.106
470 1HD LYS 62 2HD LYS 62 -4.884 -0.816 12.266
471 2HD LYS 62 1HD LYS 62 -3.483 0.135 12.766
472 1HE LYS 62 2HE LYS 62 -4.953 1.604 14.062
473 2HE LYS 62 1HE LYS 62 -6.343 0.636 13.575
474 1HZ LYS 62 1HZ LYS 62 -5.409 0.123 15.822
475 2HZ LYS 62 2HZ LYS 62 -4.025 -0.486 15.050
476 3HZ LYS 62 3HZ LYS 62 -5.538 -1.212 14.782
477 H PHE 63 H PHE 63 -4.471 -0.036 7.031
478 HA PHE 63 HA PHE 63 -1.958 0.513 5.723
479 1HB PHE 63 2HB PHE 63 -1.371 -1.983 5.781
480 2HB PHE 63 1HB PHE 63 -1.067 -1.048 7.239
481 HD1 PHE 63 1HD PHE 63 -2.258 -1.477 9.263
482 HD2 PHE 63 2HD PHE 63 -3.244 -3.585 5.696
483 HE1 PHE 63 1HE PHE 63 -3.600 -3.063 10.578
484 HE2 PHE 63 2HE PHE 63 -4.588 -5.174 7.010
485 HZ PHE 63 HZ PHE 63 -4.768 -4.914 9.449
486 H ALA 64 H ALA 64 -1.724 -0.826 3.713
487 HA ALA 64 HA ALA 64 -4.387 -1.499 2.638
488 1HB ALA 64 1HB ALA 64 -3.622 0.697 1.821
489 2HB ALA 64 2HB ALA 64 -3.787 -0.490 0.526
490 3HB ALA 64 3HB ALA 64 -2.187 -0.076 1.144
491 H PHE 65 H PHE 65 -4.306 -2.885 0.725
492 HA PHE 65 HA PHE 65 -1.973 -4.683 0.738
493 1HB PHE 65 2HB PHE 65 -4.876 -5.315 0.146
494 2HB PHE 65 1HB PHE 65 -3.548 -6.453 -0.049
495 HD1 PHE 65 1HD PHE 65 -5.727 -4.744 2.319
496 HD2 PHE 65 2HD PHE 65 -2.409 -7.375 1.890
497 HE1 PHE 65 1HE PHE 65 -5.969 -5.425 4.669
498 HE2 PHE 65 2HE PHE 65 -2.647 -8.062 4.240
499 HZ PHE 65 HZ PHE 65 -4.427 -7.088 5.631
500 H ALA 66 H ALA 66 -0.922 -4.959 -1.148
501 HA ALA 66 HA ALA 66 -2.120 -3.666 -3.510
502 1HB ALA 66 1HB ALA 66 -0.313 -2.324 -2.520
503 2HB ALA 66 2HB ALA 66 0.053 -2.865 -4.157
504 3HB ALA 66 3HB ALA 66 0.799 -3.669 -2.775
505 H GLU 67 H GLU 67 -1.471 -4.435 -5.542
506 HA GLU 67 HA GLU 67 -0.947 -7.313 -5.515
507 1HB GLU 67 2HB GLU 67 -3.038 -6.632 -6.513
508 2HB GLU 67 1HB GLU 67 -2.209 -5.494 -7.565
509 1HG GLU 67 2HG GLU 67 -1.200 -7.258 -8.798
510 2HG GLU 67 1HG GLU 67 -1.779 -8.459 -7.650
511 H ARG 68 H ARG 68 1.082 -7.879 -5.910
512 HA ARG 68 HA ARG 68 3.091 -6.486 -7.181
513 1HB ARG 68 2HB ARG 68 3.886 -8.324 -6.069
514 2HB ARG 68 1HB ARG 68 2.552 -9.348 -6.544
515 1HG ARG 68 2HG ARG 68 3.553 -9.581 -8.782
516 2HG ARG 68 1HG ARG 68 4.898 -8.558 -8.269
517 1HD ARG 68 2HD ARG 68 5.592 -10.154 -6.649
518 2HD ARG 68 1HD ARG 68 4.129 -11.108 -6.867
519 HE ARG 68 HE ARG 68 6.328 -10.892 -8.828
520 1HH1 ARG 68 1HH1 ARG 68 3.569 -12.584 -7.491
521 2HH1 ARG 68 2HH1 ARG 68 3.827 -14.023 -8.421
522 1HH2 ARG 68 1HH2 ARG 68 6.678 -12.792 -10.057
523 2HH2 ARG 68 2HH2 ARG 68 5.601 -14.145 -9.882
524 H VAL 69 H VAL 69 2.923 -5.564 -9.132
525 HA VAL 69 HA VAL 69 1.394 -6.781 -11.259
526 HB VAL 69 HB VAL 69 3.133 -4.317 -11.474
527 1HG1 VAL 69 1HG1 VAL 69 0.698 -5.201 -13.021
528 2HG1 VAL 69 2HG1 VAL 69 2.363 -5.202 -13.608
529 3HG1 VAL 69 3HG1 VAL 69 1.557 -3.675 -13.241
530 1HG2 VAL 69 1HG2 VAL 69 0.245 -4.480 -10.619
531 2HG2 VAL 69 2HG2 VAL 69 1.147 -2.998 -10.938
532 3HG2 VAL 69 3HG2 VAL 69 1.610 -4.041 -9.592
533 H LEU 70 H LEU 70 4.069 -7.723 -10.083
534 HA LEU 70 HA LEU 70 5.726 -7.935 -12.448
535 1HB LEU 70 2HB LEU 70 6.043 -9.291 -9.766
536 2HB LEU 70 1HB LEU 70 7.246 -9.220 -11.037
537 HG LEU 70 HG LEU 70 6.251 -6.923 -9.356
538 1HD1 LEU 70 1HD1 LEU 70 7.842 -8.394 -8.245
539 2HD1 LEU 70 2HD1 LEU 70 8.566 -6.824 -8.594
540 3HD1 LEU 70 3HD1 LEU 70 8.962 -8.221 -9.598
541 1HD2 LEU 70 1HD2 LEU 70 7.860 -5.546 -10.581
542 2HD2 LEU 70 2HD2 LEU 70 6.594 -6.167 -11.638
543 3HD2 LEU 70 3HD2 LEU 70 8.197 -6.900 -11.657
Start of MODEL 6
1 1H MET 1 1H MET 1 0.033 21.765 13.581
2 2H MET 1 2H MET 1 -0.156 20.079 13.485
3 3H MET 1 3H MET 1 -0.771 20.929 14.818
4 HA MET 1 HA MET 1 -2.383 22.026 13.504
5 1HB MET 1 2HB MET 1 -0.910 20.726 11.234
6 2HB MET 1 1HB MET 1 -2.604 21.159 11.063
7 1HG MET 1 2HG MET 1 -2.082 23.479 11.546
8 2HG MET 1 1HG MET 1 -0.386 23.063 11.774
9 1HE MET 1 1HE MET 1 0.313 24.960 10.008
10 2HE MET 1 2HE MET 1 -1.394 25.366 9.839
11 3HE MET 1 3HE MET 1 -0.407 25.091 8.406
12 H ALA 2 H ALA 2 -3.678 20.865 14.840
13 HA ALA 2 HA ALA 2 -4.499 18.209 13.857
14 1HB ALA 2 1HB ALA 2 -4.848 19.415 16.605
15 2HB ALA 2 2HB ALA 2 -3.707 18.146 16.159
16 3HB ALA 2 3HB ALA 2 -5.443 17.834 16.099
17 H PHE 3 H PHE 3 -6.052 18.629 12.412
18 HA PHE 3 HA PHE 3 -7.880 20.845 12.776
19 1HB PHE 3 2HB PHE 3 -7.695 18.798 10.555
20 2HB PHE 3 1HB PHE 3 -8.662 20.268 10.527
21 HD1 PHE 3 1HD PHE 3 -7.346 22.493 10.856
22 HD2 PHE 3 2HD PHE 3 -5.568 18.817 9.660
23 HE1 PHE 3 1HE PHE 3 -5.445 23.729 9.904
24 HE2 PHE 3 2HE PHE 3 -3.663 20.045 8.705
25 HZ PHE 3 HZ PHE 3 -3.598 22.503 8.827
26 H GLY 4 H GLY 4 -8.197 18.888 14.744
27 1HA GLY 4 2HA GLY 4 -10.193 18.137 15.780
28 2HA GLY 4 1HA GLY 4 -10.933 17.996 14.189
29 H LYS 5 H LYS 5 -9.195 16.543 12.799
30 HA LYS 5 HA LYS 5 -8.989 14.014 14.284
31 1HB LYS 5 2HB LYS 5 -9.253 12.893 12.084
32 2HB LYS 5 1HB LYS 5 -10.655 13.854 12.529
33 1HG LYS 5 2HG LYS 5 -9.868 15.658 11.059
34 2HG LYS 5 1HG LYS 5 -8.493 14.657 10.594
35 1HD LYS 5 2HD LYS 5 -10.205 14.522 8.895
36 2HD LYS 5 1HD LYS 5 -10.064 12.966 9.715
37 1HE LYS 5 2HE LYS 5 -12.037 13.384 10.998
38 2HE LYS 5 1HE LYS 5 -12.114 15.053 10.429
39 1HZ LYS 5 1HZ LYS 5 -12.392 12.660 8.690
40 2HZ LYS 5 2HZ LYS 5 -12.584 14.280 8.219
41 3HZ LYS 5 3HZ LYS 5 -13.690 13.573 9.294
42 HA PRO 6 HA PRO 6 -4.573 14.436 13.481
43 1HB PRO 6 2HB PRO 6 -4.564 11.642 14.462
44 2HB PRO 6 1HB PRO 6 -3.669 13.044 15.059
45 1HG PRO 6 2HG PRO 6 -5.716 12.030 16.441
46 2HG PRO 6 1HG PRO 6 -5.430 13.780 16.370
47 1HD PRO 6 2HD PRO 6 -7.422 12.123 14.855
48 2HD PRO 6 1HD PRO 6 -7.635 13.707 15.634
49 H ALA 7 H ALA 7 -3.369 13.840 11.749
50 HA ALA 7 HA ALA 7 -2.857 12.997 9.704
51 1HB ALA 7 1HB ALA 7 -3.107 10.627 9.326
52 2HB ALA 7 2HB ALA 7 -4.281 10.504 10.635
53 3HB ALA 7 3HB ALA 7 -2.600 10.896 10.994
54 H MET 8 H MET 8 -4.577 10.989 8.293
55 HA MET 8 HA MET 8 -6.277 10.925 6.795
56 1HB MET 8 2HB MET 8 -7.594 12.731 8.825
57 2HB MET 8 1HB MET 8 -8.422 12.083 7.415
58 1HG MET 8 2HG MET 8 -7.194 10.466 9.636
59 2HG MET 8 1HG MET 8 -8.910 10.801 9.426
60 1HE MET 8 1HE MET 8 -7.757 7.841 9.781
61 2HE MET 8 2HE MET 8 -8.721 6.999 8.566
62 3HE MET 8 3HE MET 8 -9.464 8.238 9.579
63 H LYS 9 H LYS 9 -4.217 12.633 6.179
64 HA LYS 9 HA LYS 9 -5.647 14.848 4.886
65 1HB LYS 9 2HB LYS 9 -3.468 16.048 4.820
66 2HB LYS 9 1HB LYS 9 -4.064 15.752 6.446
67 1HG LYS 9 2HG LYS 9 -2.527 13.778 6.545
68 2HG LYS 9 1HG LYS 9 -1.834 14.332 5.018
69 1HD LYS 9 2HD LYS 9 -1.503 16.580 6.214
70 2HD LYS 9 1HD LYS 9 -1.791 15.676 7.703
71 1HE LYS 9 2HE LYS 9 0.567 15.784 7.350
72 2HE LYS 9 1HE LYS 9 0.046 14.130 7.033
73 1HZ LYS 9 1HZ LYS 9 1.584 14.867 5.348
74 2HZ LYS 9 2HZ LYS 9 0.611 16.211 4.990
75 3HZ LYS 9 3HZ LYS 9 0.052 14.648 4.654
76 H ASN 10 H ASN 10 -6.192 13.130 3.364
77 HA ASN 10 HA ASN 10 -6.156 12.391 1.244
78 1HB ASN 10 2HB ASN 10 -4.981 14.542 0.705
79 2HB ASN 10 1HB ASN 10 -3.449 13.693 0.918
80 1HD2 ASN 10 1HD2 ASN 10 -2.996 11.926 -0.473
81 2HD2 ASN 10 2HD2 ASN 10 -3.664 11.871 -2.069
82 H VAL 11 H VAL 11 -6.048 10.290 1.248
83 HA VAL 11 HA VAL 11 -4.073 8.687 2.401
84 HB VAL 11 HB VAL 11 -5.873 7.932 0.085
85 1HG1 VAL 11 1HG1 VAL 11 -4.547 6.246 2.203
86 2HG1 VAL 11 2HG1 VAL 11 -4.156 6.279 0.485
87 3HG1 VAL 11 3HG1 VAL 11 -5.715 5.662 1.019
88 1HG2 VAL 11 1HG2 VAL 11 -6.418 7.829 3.050
89 2HG2 VAL 11 2HG2 VAL 11 -7.455 7.148 1.797
90 3HG2 VAL 11 3HG2 VAL 11 -7.198 8.893 1.878
91 HA PRO 12 HA PRO 12 -0.759 9.370 -0.467
92 1HB PRO 12 2HB PRO 12 0.933 7.463 0.456
93 2HB PRO 12 1HB PRO 12 0.635 8.980 1.311
94 1HG PRO 12 2HG PRO 12 -0.539 6.273 1.800
95 2HG PRO 12 1HG PRO 12 0.074 7.456 2.972
96 1HD PRO 12 2HD PRO 12 -2.564 7.152 2.468
97 2HD PRO 12 1HD PRO 12 -1.853 8.720 2.894
98 H VAL 13 H VAL 13 -2.635 6.570 -0.332
99 HA VAL 13 HA VAL 13 -1.479 5.583 -2.841
100 HB VAL 13 HB VAL 13 -2.027 3.254 -2.112
101 1HG1 VAL 13 1HG1 VAL 13 -0.110 3.009 -0.560
102 2HG1 VAL 13 2HG1 VAL 13 -0.048 4.764 -0.411
103 3HG1 VAL 13 3HG1 VAL 13 0.266 4.002 -1.971
104 1HG2 VAL 13 1HG2 VAL 13 -2.375 2.809 0.263
105 2HG2 VAL 13 2HG2 VAL 13 -3.668 3.818 -0.391
106 3HG2 VAL 13 3HG2 VAL 13 -2.391 4.545 0.587
107 H GLU 14 H GLU 14 -2.960 5.173 -4.407
108 HA GLU 14 HA GLU 14 -5.781 5.399 -3.623
109 1HB GLU 14 2HB GLU 14 -4.444 6.021 -6.251
110 2HB GLU 14 1HB GLU 14 -6.175 6.028 -6.011
111 1HG GLU 14 2HG GLU 14 -5.850 8.212 -5.661
112 2HG GLU 14 1HG GLU 14 -5.417 7.681 -4.046
113 H ALA 15 H ALA 15 -7.177 3.824 -4.089
114 HA ALA 15 HA ALA 15 -6.304 1.252 -4.830
115 1HB ALA 15 1HB ALA 15 -9.109 2.359 -4.850
116 2HB ALA 15 2HB ALA 15 -8.292 1.664 -3.453
117 3HB ALA 15 3HB ALA 15 -8.660 0.653 -4.851
118 H GLY 16 H GLY 16 -5.723 0.572 -6.765
119 1HA GLY 16 2HA GLY 16 -6.471 0.051 -9.027
120 2HA GLY 16 1HA GLY 16 -7.134 1.674 -9.115
121 H LYS 17 H LYS 17 -4.370 2.211 -7.572
122 HA LYS 17 HA LYS 17 -2.982 2.928 -10.047
123 1HB LYS 17 2HB LYS 17 -2.165 3.548 -7.211
124 2HB LYS 17 1HB LYS 17 -1.560 4.295 -8.679
125 1HG LYS 17 2HG LYS 17 -4.406 4.530 -7.761
126 2HG LYS 17 1HG LYS 17 -3.127 5.659 -7.320
127 1HD LYS 17 2HD LYS 17 -4.031 5.045 -10.125
128 2HD LYS 17 1HD LYS 17 -4.444 6.487 -9.187
129 1HE LYS 17 2HE LYS 17 -1.650 5.652 -9.982
130 2HE LYS 17 1HE LYS 17 -2.608 6.900 -10.780
131 1HZ LYS 17 1HZ LYS 17 -1.714 6.963 -7.940
132 2HZ LYS 17 2HZ LYS 17 -2.624 8.162 -8.722
133 3HZ LYS 17 3HZ LYS 17 -1.032 7.853 -9.214
134 H GLU 18 H GLU 18 -0.775 2.406 -10.389
135 HA GLU 18 HA GLU 18 0.205 0.141 -8.776
136 1HB GLU 18 2HB GLU 18 1.285 0.788 -11.503
137 2HB GLU 18 1HB GLU 18 1.360 -0.726 -10.613
138 1HG GLU 18 2HG GLU 18 -0.294 -1.406 -11.907
139 2HG GLU 18 1HG GLU 18 -1.336 -0.341 -10.959
140 H TYR 19 H TYR 19 1.816 0.663 -7.457
141 HA TYR 19 HA TYR 19 3.402 3.048 -8.129
142 1HB TYR 19 2HB TYR 19 2.616 1.933 -5.435
143 2HB TYR 19 1HB TYR 19 3.804 3.219 -5.648
144 HD1 TYR 19 1HD TYR 19 0.425 2.553 -5.039
145 HD2 TYR 19 2HD TYR 19 2.957 5.218 -7.170
146 HE1 TYR 19 1HE TYR 19 -1.402 4.193 -5.141
147 HE2 TYR 19 2HE TYR 19 1.150 6.873 -7.271
148 HH TYR 19 HH TYR 19 -1.566 6.804 -5.411
149 H GLU 20 H GLU 20 5.544 3.004 -8.058
150 HA GLU 20 HA GLU 20 6.889 0.447 -7.997
151 1HB GLU 20 2HB GLU 20 7.420 2.117 -9.711
152 2HB GLU 20 1HB GLU 20 7.874 3.269 -8.468
153 1HG GLU 20 2HG GLU 20 9.705 1.739 -7.800
154 2HG GLU 20 1HG GLU 20 9.286 0.715 -9.176
155 H VAL 21 H VAL 21 7.144 -0.320 -5.954
156 HA VAL 21 HA VAL 21 7.943 1.610 -3.867
157 HB VAL 21 HB VAL 21 6.831 0.141 -2.234
158 1HG1 VAL 21 1HG1 VAL 21 5.073 1.022 -4.516
159 2HG1 VAL 21 2HG1 VAL 21 5.605 2.016 -3.157
160 3HG1 VAL 21 3HG1 VAL 21 4.520 0.651 -2.884
161 1HG2 VAL 21 1HG2 VAL 21 5.384 -1.669 -2.986
162 2HG2 VAL 21 2HG2 VAL 21 7.055 -1.967 -3.463
163 3HG2 VAL 21 3HG2 VAL 21 5.889 -1.395 -4.653
164 H THR 22 H THR 22 8.977 0.537 -1.947
165 HA THR 22 HA THR 22 10.883 -1.535 -2.825
166 HB THR 22 HB THR 22 11.314 0.523 -0.645
167 HG1 THR 22 1HG THR 22 11.253 0.989 -3.185
168 1HG2 THR 22 1HG2 THR 22 12.642 -1.532 -0.401
169 2HG2 THR 22 2HG2 THR 22 13.664 -0.151 -0.817
170 3HG2 THR 22 3HG2 THR 22 13.235 -1.337 -2.052
171 H ILE 23 H ILE 23 11.518 -3.073 -1.145
172 HA ILE 23 HA ILE 23 9.330 -3.561 0.743
173 HB ILE 23 HB ILE 23 10.858 -5.693 -0.772
174 1HG1 ILE 23 2HG1 ILE 23 9.423 -4.379 -2.277
175 2HG1 ILE 23 1HG1 ILE 23 8.809 -6.015 -2.069
176 1HG2 ILE 23 1HG2 ILE 23 9.102 -7.195 0.087
177 2HG2 ILE 23 2HG2 ILE 23 8.428 -5.854 1.012
178 3HG2 ILE 23 3HG2 ILE 23 10.042 -6.457 1.382
179 1HD1 ILE 23 1HD1 ILE 23 7.764 -3.547 -0.698
180 2HD1 ILE 23 2HD1 ILE 23 7.152 -5.187 -0.476
181 3HD1 ILE 23 3HD1 ILE 23 7.005 -4.396 -2.046
182 H GLU 24 H GLU 24 10.991 -2.211 1.858
183 HA GLU 24 HA GLU 24 13.402 -3.289 2.810
184 1HB GLU 24 2HB GLU 24 13.220 -1.583 4.600
185 2HB GLU 24 1HB GLU 24 12.957 -0.925 2.993
186 1HG GLU 24 2HG GLU 24 10.588 -0.844 3.350
187 2HG GLU 24 1HG GLU 24 10.750 -1.684 4.892
188 H ASP 25 H ASP 25 10.181 -4.123 3.580
189 HA ASP 25 HA ASP 25 11.133 -5.652 5.902
190 1HB ASP 25 2HB ASP 25 9.964 -3.511 6.591
191 2HB ASP 25 1HB ASP 25 8.500 -4.173 5.885
192 H MET 26 H MET 26 9.983 -7.594 6.312
193 HA MET 26 HA MET 26 7.838 -8.277 4.439
194 1HB MET 26 2HB MET 26 10.228 -10.015 5.066
195 2HB MET 26 1HB MET 26 8.779 -10.589 4.256
196 1HG MET 26 2HG MET 26 9.222 -8.839 2.496
197 2HG MET 26 1HG MET 26 10.797 -8.607 3.257
198 1HE MET 26 1HE MET 26 9.383 -12.587 1.431
199 2HE MET 26 2HE MET 26 8.450 -11.093 1.359
200 3HE MET 26 3HE MET 26 8.727 -11.882 2.912
201 H GLY 27 H GLY 27 6.385 -9.875 5.213
202 1HA GLY 27 2HA GLY 27 6.219 -9.956 8.122
203 2HA GLY 27 1HA GLY 27 5.000 -10.517 6.986
204 H LYS 28 H LYS 28 7.801 -11.727 5.888
205 HA LYS 28 HA LYS 28 8.748 -13.761 5.775
206 1HB LYS 28 2HB LYS 28 8.231 -13.440 8.693
207 2HB LYS 28 1HB LYS 28 9.062 -14.861 8.069
208 1HG LYS 28 2HG LYS 28 10.797 -13.462 7.123
209 2HG LYS 28 1HG LYS 28 9.933 -12.010 7.628
210 1HD LYS 28 2HD LYS 28 10.236 -12.630 9.965
211 2HD LYS 28 1HD LYS 28 11.073 -14.106 9.475
212 1HE LYS 28 2HE LYS 28 12.831 -12.800 8.433
213 2HE LYS 28 1HE LYS 28 11.973 -11.307 8.801
214 1HZ LYS 28 1HZ LYS 28 13.056 -13.200 10.819
215 2HZ LYS 28 2HZ LYS 28 12.269 -11.734 11.146
216 3HZ LYS 28 3HZ LYS 28 13.773 -11.731 10.359
217 H GLY 29 H GLY 29 5.811 -13.472 5.595
218 1HA GLY 29 2HA GLY 29 5.254 -16.353 5.593
219 2HA GLY 29 1HA GLY 29 4.067 -15.243 6.271
220 H GLY 30 H GLY 30 6.105 -14.624 3.468
221 1HA GLY 30 2HA GLY 30 5.465 -14.760 1.188
222 2HA GLY 30 1HA GLY 30 3.789 -14.919 1.691
223 H ASP 31 H ASP 31 3.651 -12.762 3.465
224 HA ASP 31 HA ASP 31 3.225 -10.637 1.607
225 1HB ASP 31 2HB ASP 31 3.016 -10.703 4.624
226 2HB ASP 31 1HB ASP 31 2.547 -9.329 3.631
227 H GLY 32 H GLY 32 4.567 -9.118 0.997
228 1HA GLY 32 2HA GLY 32 6.886 -8.460 2.698
229 2HA GLY 32 1HA GLY 32 6.767 -8.132 0.971
230 H ILE 33 H ILE 33 7.250 -6.295 3.301
231 HA ILE 33 HA ILE 33 4.771 -4.730 3.229
232 HB ILE 33 HB ILE 33 6.983 -4.877 5.261
233 1HG1 ILE 33 2HG1 ILE 33 4.981 -5.101 6.801
234 2HG1 ILE 33 1HG1 ILE 33 3.979 -5.212 5.360
235 1HG2 ILE 33 1HG2 ILE 33 4.896 -2.715 5.037
236 2HG2 ILE 33 2HG2 ILE 33 6.645 -2.519 4.929
237 3HG2 ILE 33 3HG2 ILE 33 5.903 -2.999 6.455
238 1HD1 ILE 33 1HD1 ILE 33 6.170 -7.114 6.161
239 2HD1 ILE 33 2HD1 ILE 33 5.207 -7.221 4.686
240 3HD1 ILE 33 3HD1 ILE 33 4.432 -7.403 6.260
241 H ALA 34 H ALA 34 4.912 -3.445 1.497
242 HA ALA 34 HA ALA 34 7.197 -1.675 1.188
243 1HB ALA 34 1HB ALA 34 4.493 -1.638 -0.169
244 2HB ALA 34 2HB ALA 34 5.934 -2.449 -0.787
245 3HB ALA 34 3HB ALA 34 5.909 -0.692 -0.637
246 H ARG 35 H ARG 35 6.940 0.670 1.487
247 HA ARG 35 HA ARG 35 4.621 1.426 3.085
248 1HB ARG 35 2HB ARG 35 6.647 0.712 4.540
249 2HB ARG 35 1HB ARG 35 7.346 2.243 4.044
250 1HG ARG 35 2HG ARG 35 5.759 3.482 5.168
251 2HG ARG 35 1HG ARG 35 4.597 2.152 5.198
252 1HD ARG 35 2HD ARG 35 6.113 0.942 6.750
253 2HD ARG 35 1HD ARG 35 7.146 2.369 6.793
254 HE ARG 35 HE ARG 35 4.488 3.072 7.456
255 1HH1 ARG 35 1HH1 ARG 35 7.299 1.431 8.780
256 2HH1 ARG 35 2HH1 ARG 35 6.854 1.773 10.431
257 1HH2 ARG 35 1HH2 ARG 35 3.924 3.517 9.616
258 2HH2 ARG 35 2HH2 ARG 35 4.940 2.943 10.904
259 H ILE 36 H ILE 36 3.781 3.148 2.239
260 HA ILE 36 HA ILE 36 5.523 4.994 0.756
261 HB ILE 36 HB ILE 36 2.604 4.319 0.398
262 1HG1 ILE 36 2HG1 ILE 36 5.057 4.100 -1.346
263 2HG1 ILE 36 1HG1 ILE 36 4.114 2.781 -0.664
264 1HG2 ILE 36 1HG2 ILE 36 2.524 6.010 -1.368
265 2HG2 ILE 36 2HG2 ILE 36 4.167 6.518 -0.964
266 3HG2 ILE 36 3HG2 ILE 36 2.859 6.746 0.199
267 1HD1 ILE 36 1HD1 ILE 36 2.210 3.460 -2.049
268 2HD1 ILE 36 2HD1 ILE 36 3.630 3.043 -3.007
269 3HD1 ILE 36 3HD1 ILE 36 3.203 4.735 -2.750
270 H ASP 37 H ASP 37 6.049 6.617 1.967
271 HA ASP 37 HA ASP 37 5.936 8.504 3.231
272 1HB ASP 37 2HB ASP 37 4.042 9.013 1.654
273 2HB ASP 37 1HB ASP 37 2.938 8.361 2.857
274 H GLY 38 H GLY 38 5.496 5.704 4.359
275 1HA GLY 38 2HA GLY 38 5.597 5.181 6.687
276 2HA GLY 38 1HA GLY 38 4.630 6.614 7.020
277 H PHE 39 H PHE 39 3.082 5.507 4.512
278 HA PHE 39 HA PHE 39 1.078 4.110 6.055
279 1HB PHE 39 2HB PHE 39 0.545 5.817 4.299
280 2HB PHE 39 1HB PHE 39 1.188 4.716 3.089
281 HD1 PHE 39 1HD PHE 39 -0.024 2.718 2.460
282 HD2 PHE 39 2HD PHE 39 -1.581 5.461 5.319
283 HE1 PHE 39 1HE PHE 39 -2.251 1.738 2.187
284 HE2 PHE 39 2HE PHE 39 -3.818 4.476 5.049
285 HZ PHE 39 HZ PHE 39 -4.145 2.617 3.472
286 H VAL 40 H VAL 40 1.092 1.971 6.315
287 HA VAL 40 HA VAL 40 3.105 0.386 5.031
288 HB VAL 40 HB VAL 40 0.867 -0.620 6.792
289 1HG1 VAL 40 1HG1 VAL 40 2.458 -2.396 7.335
290 2HG1 VAL 40 2HG1 VAL 40 3.624 -1.687 6.213
291 3HG1 VAL 40 3HG1 VAL 40 2.103 -2.343 5.607
292 1HG2 VAL 40 1HG2 VAL 40 2.009 1.211 7.921
293 2HG2 VAL 40 2HG2 VAL 40 3.565 0.442 7.616
294 3HG2 VAL 40 3HG2 VAL 40 2.394 -0.334 8.680
295 H VAL 41 H VAL 41 2.935 -0.684 3.194
296 HA VAL 41 HA VAL 41 0.245 -1.345 2.193
297 HB VAL 41 HB VAL 41 2.732 -0.808 0.547
298 1HG1 VAL 41 1HG1 VAL 41 1.213 -2.359 -0.543
299 2HG1 VAL 41 2HG1 VAL 41 1.181 -0.795 -1.359
300 3HG1 VAL 41 3HG1 VAL 41 -0.135 -1.255 -0.281
301 1HG2 VAL 41 1HG2 VAL 41 0.308 0.932 1.010
302 2HG2 VAL 41 2HG2 VAL 41 1.609 1.270 -0.131
303 3HG2 VAL 41 3HG2 VAL 41 1.941 1.239 1.601
304 H PHE 42 H PHE 42 -0.114 -3.444 2.497
305 HA PHE 42 HA PHE 42 2.064 -5.328 2.718
306 1HB PHE 42 2HB PHE 42 -0.931 -5.630 2.917
307 2HB PHE 42 1HB PHE 42 0.178 -6.992 3.041
308 HD1 PHE 42 1HD PHE 42 -1.287 -4.159 4.738
309 HD2 PHE 42 2HD PHE 42 1.793 -7.095 4.915
310 HE1 PHE 42 1HE PHE 42 -1.010 -3.724 7.144
311 HE2 PHE 42 2HE PHE 42 2.073 -6.663 7.318
312 HZ PHE 42 HZ PHE 42 0.669 -4.977 8.436
313 H VAL 43 H VAL 43 2.952 -6.294 1.074
314 HA VAL 43 HA VAL 43 1.345 -6.771 -1.352
315 HB VAL 43 HB VAL 43 4.349 -6.722 -1.303
316 1HG1 VAL 43 1HG1 VAL 43 2.320 -6.219 -3.464
317 2HG1 VAL 43 2HG1 VAL 43 3.276 -7.683 -3.247
318 3HG1 VAL 43 3HG1 VAL 43 4.068 -6.163 -3.663
319 1HG2 VAL 43 1HG2 VAL 43 2.553 -4.333 -1.704
320 2HG2 VAL 43 2HG2 VAL 43 4.285 -4.371 -2.023
321 3HG2 VAL 43 3HG2 VAL 43 3.688 -4.581 -0.378
322 HA PRO 44 HA PRO 44 1.796 -10.801 0.556
323 1HB PRO 44 2HB PRO 44 -0.023 -11.711 -1.565
324 2HB PRO 44 1HB PRO 44 -0.243 -11.706 0.185
325 1HG PRO 44 2HG PRO 44 -1.591 -10.017 -1.405
326 2HG PRO 44 1HG PRO 44 -1.042 -9.541 0.213
327 1HD PRO 44 2HD PRO 44 0.174 -8.917 -2.456
328 2HD PRO 44 1HD PRO 44 -0.080 -7.850 -1.056
329 H ASN 45 H ASN 45 3.146 -9.927 -2.320
330 HA ASN 45 HA ASN 45 4.379 -12.556 -2.606
331 1HB ASN 45 2HB ASN 45 2.949 -11.101 -4.819
332 2HB ASN 45 1HB ASN 45 4.237 -12.250 -5.162
333 1HD2 ASN 45 1HD2 ASN 45 0.967 -11.836 -4.159
334 2HD2 ASN 45 2HD2 ASN 45 0.544 -13.509 -4.143
335 H ALA 46 H ALA 46 5.014 -9.617 -1.848
336 HA ALA 46 HA ALA 46 7.069 -8.951 -3.781
337 1HB ALA 46 1HB ALA 46 6.421 -7.585 -1.183
338 2HB ALA 46 2HB ALA 46 5.644 -7.224 -2.725
339 3HB ALA 46 3HB ALA 46 7.374 -6.944 -2.520
340 H GLU 47 H GLU 47 9.205 -9.315 -3.587
341 HA GLU 47 HA GLU 47 10.162 -10.744 -1.245
342 1HB GLU 47 2HB GLU 47 11.466 -10.126 -3.895
343 2HB GLU 47 1HB GLU 47 12.218 -11.048 -2.606
344 1HG GLU 47 2HG GLU 47 10.333 -12.672 -2.777
345 2HG GLU 47 1HG GLU 47 9.788 -11.793 -4.204
346 H LYS 48 H LYS 48 11.893 -10.066 0.012
347 HA LYS 48 HA LYS 48 11.995 -7.301 0.578
348 1HB LYS 48 2HB LYS 48 12.382 -9.177 2.203
349 2HB LYS 48 1HB LYS 48 13.953 -9.428 1.458
350 1HG LYS 48 2HG LYS 48 14.486 -7.038 2.047
351 2HG LYS 48 1HG LYS 48 13.002 -7.042 3.009
352 1HD LYS 48 2HD LYS 48 13.841 -8.879 4.347
353 2HD LYS 48 1HD LYS 48 15.292 -8.976 3.350
354 1HE LYS 48 2HE LYS 48 15.940 -7.803 5.280
355 2HE LYS 48 1HE LYS 48 15.742 -6.574 4.036
356 1HZ LYS 48 1HZ LYS 48 13.766 -7.240 6.151
357 2HZ LYS 48 2HZ LYS 48 13.555 -6.071 4.948
358 3HZ LYS 48 3HZ LYS 48 14.760 -5.868 6.113
359 H GLY 49 H GLY 49 13.248 -5.729 -0.206
360 1HA GLY 49 2HA GLY 49 15.253 -4.745 -0.907
361 2HA GLY 49 1HA GLY 49 15.915 -6.347 -1.188
362 H SER 50 H SER 50 13.040 -6.512 -2.673
363 HA SER 50 HA SER 50 14.256 -5.873 -5.249
364 1HB SER 50 2HB SER 50 11.723 -7.407 -4.600
365 2HB SER 50 1HB SER 50 12.423 -7.219 -6.207
366 HG SER 50 HG SER 50 14.404 -8.153 -5.065
367 H VAL 51 H VAL 51 13.261 -4.557 -6.793
368 HA VAL 51 HA VAL 51 11.475 -2.527 -5.695
369 HB VAL 51 HB VAL 51 12.829 -2.603 -8.403
370 1HG1 VAL 51 1HG1 VAL 51 12.327 -0.205 -8.466
371 2HG1 VAL 51 2HG1 VAL 51 11.481 -0.344 -6.926
372 3HG1 VAL 51 3HG1 VAL 51 10.857 -1.173 -8.351
373 1HG2 VAL 51 1HG2 VAL 51 13.666 -1.201 -5.864
374 2HG2 VAL 51 2HG2 VAL 51 14.424 -0.991 -7.442
375 3HG2 VAL 51 3HG2 VAL 51 14.492 -2.556 -6.632
376 H ILE 52 H ILE 52 9.363 -2.891 -5.881
377 HA ILE 52 HA ILE 52 8.470 -4.557 -8.132
378 HB ILE 52 HB ILE 52 8.300 -5.975 -6.332
379 1HG1 ILE 52 2HG1 ILE 52 5.579 -4.669 -6.480
380 2HG1 ILE 52 1HG1 ILE 52 6.178 -5.934 -7.548
381 1HG2 ILE 52 1HG2 ILE 52 7.221 -3.700 -4.682
382 2HG2 ILE 52 2HG2 ILE 52 8.813 -4.447 -4.542
383 3HG2 ILE 52 3HG2 ILE 52 7.364 -5.366 -4.124
384 1HD1 ILE 52 1HD1 ILE 52 6.261 -7.490 -5.714
385 2HD1 ILE 52 2HD1 ILE 52 4.654 -6.769 -5.830
386 3HD1 ILE 52 3HD1 ILE 52 5.777 -6.223 -4.587
387 H ASN 53 H ASN 53 6.659 -4.123 -9.116
388 HA ASN 53 HA ASN 53 5.422 -1.515 -8.730
389 1HB ASN 53 2HB ASN 53 6.066 -2.341 -11.014
390 2HB ASN 53 1HB ASN 53 4.877 -3.624 -10.842
391 1HD2 ASN 53 1HD2 ASN 53 5.410 -0.284 -11.445
392 2HD2 ASN 53 2HD2 ASN 53 3.783 0.128 -11.863
393 H VAL 54 H VAL 54 3.748 -1.384 -7.362
394 HA VAL 54 HA VAL 54 2.135 -3.816 -6.972
395 HB VAL 54 HB VAL 54 1.660 -3.075 -4.705
396 1HG1 VAL 54 1HG1 VAL 54 3.575 -4.524 -5.098
397 2HG1 VAL 54 2HG1 VAL 54 3.871 -3.437 -3.742
398 3HG1 VAL 54 3HG1 VAL 54 4.611 -3.112 -5.310
399 1HG2 VAL 54 1HG2 VAL 54 1.794 -0.657 -5.016
400 2HG2 VAL 54 2HG2 VAL 54 3.534 -0.778 -5.279
401 3HG2 VAL 54 3HG2 VAL 54 2.851 -1.177 -3.703
402 H LYS 55 H LYS 55 0.075 -3.737 -7.473
403 HA LYS 55 HA LYS 55 -1.188 -1.137 -7.913
404 1HB LYS 55 2HB LYS 55 -1.471 -2.847 -9.664
405 2HB LYS 55 1HB LYS 55 -2.213 -3.925 -8.495
406 1HG LYS 55 2HG LYS 55 -3.986 -2.161 -8.169
407 2HG LYS 55 1HG LYS 55 -3.294 -1.336 -9.565
408 1HD LYS 55 2HD LYS 55 -4.430 -4.129 -9.519
409 2HD LYS 55 1HD LYS 55 -5.191 -2.704 -10.229
410 1HE LYS 55 2HE LYS 55 -3.284 -2.510 -11.792
411 2HE LYS 55 1HE LYS 55 -2.610 -3.991 -11.111
412 1HZ LYS 55 1HZ LYS 55 -4.613 -5.167 -11.816
413 2HZ LYS 55 2HZ LYS 55 -3.824 -4.456 -13.134
414 3HZ LYS 55 3HZ LYS 55 -5.224 -3.743 -12.501
415 H VAL 56 H VAL 56 -1.863 -0.269 -6.056
416 HA VAL 56 HA VAL 56 -2.688 -1.755 -3.785
417 HB VAL 56 HB VAL 56 -3.261 1.150 -4.437
418 1HG1 VAL 56 1HG1 VAL 56 -3.391 -0.349 -1.822
419 2HG1 VAL 56 2HG1 VAL 56 -4.761 0.295 -2.727
420 3HG1 VAL 56 3HG1 VAL 56 -3.579 1.393 -2.012
421 1HG2 VAL 56 1HG2 VAL 56 -1.045 -0.096 -2.809
422 2HG2 VAL 56 2HG2 VAL 56 -1.350 1.634 -2.973
423 3HG2 VAL 56 3HG2 VAL 56 -0.868 0.684 -4.381
424 H THR 57 H THR 57 -4.457 -2.966 -3.728
425 HA THR 57 HA THR 57 -6.735 -2.196 -5.411
426 HB THR 57 HB THR 57 -7.406 -4.645 -5.019
427 HG1 THR 57 1HG THR 57 -5.402 -5.934 -4.623
428 1HG2 THR 57 1HG2 THR 57 -5.902 -5.426 -6.804
429 2HG2 THR 57 2HG2 THR 57 -4.902 -3.991 -6.579
430 3HG2 THR 57 3HG2 THR 57 -6.561 -3.830 -7.155
431 H ALA 58 H ALA 58 -5.812 -2.824 -2.110
432 HA ALA 58 HA ALA 58 -8.559 -2.279 -1.271
433 1HB ALA 58 1HB ALA 58 -6.901 -4.562 -0.208
434 2HB ALA 58 2HB ALA 58 -8.329 -4.700 -1.234
435 3HB ALA 58 3HB ALA 58 -8.477 -4.057 0.402
436 H VAL 59 H VAL 59 -7.945 -0.249 -0.640
437 HA VAL 59 HA VAL 59 -5.844 0.154 1.303
438 HB VAL 59 HB VAL 59 -8.017 2.098 0.506
439 1HG1 VAL 59 1HG1 VAL 59 -5.272 2.548 1.667
440 2HG1 VAL 59 2HG1 VAL 59 -6.800 2.696 2.537
441 3HG1 VAL 59 3HG1 VAL 59 -6.423 3.805 1.218
442 1HG2 VAL 59 1HG2 VAL 59 -6.862 1.348 -1.496
443 2HG2 VAL 59 2HG2 VAL 59 -5.303 1.693 -0.744
444 3HG2 VAL 59 3HG2 VAL 59 -6.415 3.012 -1.113
445 H LYS 60 H LYS 60 -6.069 -0.075 3.456
446 HA LYS 60 HA LYS 60 -8.804 -0.155 4.551
447 1HB LYS 60 2HB LYS 60 -6.276 -1.386 5.676
448 2HB LYS 60 1HB LYS 60 -7.875 -1.494 6.398
449 1HG LYS 60 2HG LYS 60 -6.990 -2.685 3.778
450 2HG LYS 60 1HG LYS 60 -7.383 -3.547 5.266
451 1HD LYS 60 2HD LYS 60 -9.698 -2.751 5.103
452 2HD LYS 60 1HD LYS 60 -9.297 -1.905 3.609
453 1HE LYS 60 2HE LYS 60 -10.316 -3.923 2.946
454 2HE LYS 60 1HE LYS 60 -8.588 -4.151 2.685
455 1HZ LYS 60 1HZ LYS 60 -9.475 -6.097 3.711
456 2HZ LYS 60 2HZ LYS 60 -10.206 -5.195 4.945
457 3HZ LYS 60 3HZ LYS 60 -8.515 -5.306 4.864
458 H GLU 61 H GLU 61 -7.588 0.004 7.298
459 HA GLU 61 HA GLU 61 -7.927 2.810 7.574
460 1HB GLU 61 2HB GLU 61 -7.026 0.752 9.591
461 2HB GLU 61 1HB GLU 61 -7.471 2.411 9.970
462 1HG GLU 61 2HG GLU 61 -9.264 0.287 8.821
463 2HG GLU 61 1HG GLU 61 -9.302 0.928 10.465
464 H LYS 62 H LYS 62 -5.183 0.957 8.907
465 HA LYS 62 HA LYS 62 -3.521 3.342 8.511
466 1HB LYS 62 2HB LYS 62 -2.934 0.858 10.131
467 2HB LYS 62 1HB LYS 62 -2.009 2.350 10.138
468 1HG LYS 62 2HG LYS 62 -3.889 3.530 11.125
469 2HG LYS 62 1HG LYS 62 -4.850 2.050 11.076
470 1HD LYS 62 2HD LYS 62 -3.137 0.968 12.528
471 2HD LYS 62 1HD LYS 62 -2.332 2.533 12.667
472 1HE LYS 62 2HE LYS 62 -5.139 1.869 13.540
473 2HE LYS 62 1HE LYS 62 -3.751 2.137 14.596
474 1HZ LYS 62 1HZ LYS 62 -3.634 4.424 13.561
475 2HZ LYS 62 2HZ LYS 62 -4.949 4.139 14.588
476 3HZ LYS 62 3HZ LYS 62 -5.173 4.115 12.907
477 H PHE 63 H PHE 63 -4.215 0.650 6.845
478 HA PHE 63 HA PHE 63 -1.651 0.530 5.520
479 1HB PHE 63 2HB PHE 63 -1.525 -1.966 5.793
480 2HB PHE 63 1HB PHE 63 -1.222 -1.054 7.267
481 HD1 PHE 63 1HD PHE 63 -2.841 -1.053 9.086
482 HD2 PHE 63 2HD PHE 63 -3.472 -3.365 5.566
483 HE1 PHE 63 1HE PHE 63 -4.583 -2.340 10.253
484 HE2 PHE 63 2HE PHE 63 -5.218 -4.652 6.723
485 HZ PHE 63 HZ PHE 63 -5.776 -4.142 9.069
486 H ALA 64 H ALA 64 -1.734 -0.933 3.622
487 HA ALA 64 HA ALA 64 -4.456 -1.464 2.672
488 1HB ALA 64 1HB ALA 64 -3.978 -0.499 0.495
489 2HB ALA 64 2HB ALA 64 -2.367 -0.026 1.035
490 3HB ALA 64 3HB ALA 64 -3.794 0.719 1.756
491 H PHE 65 H PHE 65 -4.366 -2.754 0.587
492 HA PHE 65 HA PHE 65 -2.072 -4.605 0.637
493 1HB PHE 65 2HB PHE 65 -4.964 -5.202 -0.036
494 2HB PHE 65 1HB PHE 65 -3.637 -6.348 -0.185
495 HD1 PHE 65 1HD PHE 65 -2.577 -7.290 1.795
496 HD2 PHE 65 2HD PHE 65 -5.885 -4.626 2.105
497 HE1 PHE 65 1HE PHE 65 -2.914 -7.981 4.135
498 HE2 PHE 65 2HE PHE 65 -6.224 -5.311 4.441
499 HZ PHE 65 HZ PHE 65 -4.737 -6.989 5.459
500 H ALA 66 H ALA 66 -1.038 -4.945 -1.244
501 HA ALA 66 HA ALA 66 -2.253 -3.906 -3.711
502 1HB ALA 66 1HB ALA 66 -0.177 -2.848 -4.360
503 2HB ALA 66 2HB ALA 66 0.592 -3.377 -2.863
504 3HB ALA 66 3HB ALA 66 -0.721 -2.200 -2.811
505 H GLU 67 H GLU 67 -1.655 -4.977 -5.595
506 HA GLU 67 HA GLU 67 -0.563 -7.633 -5.089
507 1HB GLU 67 2HB GLU 67 -1.499 -8.271 -7.220
508 2HB GLU 67 1HB GLU 67 -2.720 -7.434 -6.274
509 1HG GLU 67 2HG GLU 67 -2.556 -5.493 -7.594
510 2HG GLU 67 1HG GLU 67 -1.066 -6.043 -8.356
511 H ARG 68 H ARG 68 1.199 -8.453 -6.037
512 HA ARG 68 HA ARG 68 3.180 -6.745 -7.150
513 1HB ARG 68 2HB ARG 68 4.092 -8.495 -5.946
514 2HB ARG 68 1HB ARG 68 2.919 -9.658 -6.519
515 1HG ARG 68 2HG ARG 68 4.068 -9.918 -8.583
516 2HG ARG 68 1HG ARG 68 5.105 -8.526 -8.253
517 1HD ARG 68 2HD ARG 68 6.330 -9.653 -6.650
518 2HD ARG 68 1HD ARG 68 5.060 -10.839 -6.362
519 HE ARG 68 HE ARG 68 6.185 -10.976 -9.011
520 1HH1 ARG 68 1HH1 ARG 68 6.610 -11.978 -5.674
521 2HH1 ARG 68 2HH1 ARG 68 7.479 -13.427 -6.079
522 1HH2 ARG 68 1HH2 ARG 68 7.338 -12.880 -9.550
523 2HH2 ARG 68 2HH2 ARG 68 7.911 -13.929 -8.287
524 H VAL 69 H VAL 69 3.012 -5.938 -9.107
525 HA VAL 69 HA VAL 69 1.385 -7.176 -11.137
526 HB VAL 69 HB VAL 69 3.041 -4.644 -11.264
527 1HG1 VAL 69 1HG1 VAL 69 1.594 -3.960 -13.086
528 2HG1 VAL 69 2HG1 VAL 69 0.697 -5.479 -12.973
529 3HG1 VAL 69 3HG1 VAL 69 2.387 -5.485 -13.483
530 1HG2 VAL 69 1HG2 VAL 69 1.400 -4.606 -9.443
531 2HG2 VAL 69 2HG2 VAL 69 0.121 -4.981 -10.598
532 3HG2 VAL 69 3HG2 VAL 69 0.998 -3.454 -10.717
533 H LEU 70 H LEU 70 4.143 -8.170 -10.206
534 HA LEU 70 HA LEU 70 5.077 -8.861 -12.873
535 1HB LEU 70 2HB LEU 70 7.457 -8.523 -12.203
536 2HB LEU 70 1HB LEU 70 6.544 -7.047 -12.409
537 HG LEU 70 HG LEU 70 7.014 -8.244 -9.684
538 1HD1 LEU 70 1HD1 LEU 70 8.911 -6.706 -9.460
539 2HD1 LEU 70 2HD1 LEU 70 8.746 -6.261 -11.159
540 3HD1 LEU 70 3HD1 LEU 70 9.193 -7.908 -10.718
541 1HD2 LEU 70 1HD2 LEU 70 6.440 -5.433 -10.607
542 2HD2 LEU 70 2HD2 LEU 70 6.630 -5.965 -8.937
543 3HD2 LEU 70 3HD2 LEU 70 5.264 -6.536 -9.896
Start of MODEL 7
1 1H MET 1 1H MET 1 -14.302 13.944 14.997
2 2H MET 1 2H MET 1 -12.855 14.569 15.609
3 3H MET 1 3H MET 1 -13.008 14.262 13.949
4 HA MET 1 HA MET 1 -14.414 16.330 15.526
5 1HB MET 1 2HB MET 1 -12.098 16.868 14.879
6 2HB MET 1 1HB MET 1 -12.491 16.530 13.199
7 1HG MET 1 2HG MET 1 -14.131 18.368 13.246
8 2HG MET 1 1HG MET 1 -13.646 18.722 14.903
9 1HE MET 1 1HE MET 1 -13.146 21.250 14.243
10 2HE MET 1 2HE MET 1 -13.664 20.893 12.597
11 3HE MET 1 3HE MET 1 -12.130 21.713 12.878
12 H ALA 2 H ALA 2 -14.043 14.815 12.331
13 HA ALA 2 HA ALA 2 -16.443 16.131 11.370
14 1HB ALA 2 1HB ALA 2 -14.717 14.061 10.015
15 2HB ALA 2 2HB ALA 2 -14.507 15.807 9.882
16 3HB ALA 2 3HB ALA 2 -15.970 15.044 9.257
17 H PHE 3 H PHE 3 -18.395 15.157 10.988
18 HA PHE 3 HA PHE 3 -18.896 12.890 12.726
19 1HB PHE 3 2HB PHE 3 -20.837 14.556 11.111
20 2HB PHE 3 1HB PHE 3 -21.258 13.407 12.377
21 HD1 PHE 3 1HD PHE 3 -20.186 16.764 11.627
22 HD2 PHE 3 2HD PHE 3 -20.604 13.886 14.733
23 HE1 PHE 3 1HE PHE 3 -19.991 18.553 13.303
24 HE2 PHE 3 2HE PHE 3 -20.420 15.672 16.415
25 HZ PHE 3 HZ PHE 3 -20.111 18.008 15.700
26 H GLY 4 H GLY 4 -18.980 10.869 12.061
27 1HA GLY 4 2HA GLY 4 -19.818 9.130 10.680
28 2HA GLY 4 1HA GLY 4 -19.950 10.281 9.356
29 H LYS 5 H LYS 5 -17.169 11.190 10.335
30 HA LYS 5 HA LYS 5 -15.027 10.955 9.661
31 1HB LYS 5 2HB LYS 5 -15.109 8.949 11.098
32 2HB LYS 5 1HB LYS 5 -15.633 7.994 9.719
33 1HG LYS 5 2HG LYS 5 -13.256 7.692 10.194
34 2HG LYS 5 1HG LYS 5 -13.518 8.406 8.602
35 1HD LYS 5 2HD LYS 5 -12.908 10.574 9.390
36 2HD LYS 5 1HD LYS 5 -12.894 10.022 11.066
37 1HE LYS 5 2HE LYS 5 -11.030 9.067 8.895
38 2HE LYS 5 1HE LYS 5 -10.629 10.261 10.125
39 1HZ LYS 5 1HZ LYS 5 -11.342 8.379 11.739
40 2HZ LYS 5 2HZ LYS 5 -9.801 8.339 11.039
41 3HZ LYS 5 3HZ LYS 5 -11.032 7.357 10.418
42 HA PRO 6 HA PRO 6 -15.970 10.577 5.241
43 1HB PRO 6 2HB PRO 6 -14.734 12.843 4.497
44 2HB PRO 6 1HB PRO 6 -16.336 12.866 5.245
45 1HG PRO 6 2HG PRO 6 -13.668 13.442 6.460
46 2HG PRO 6 1HG PRO 6 -15.217 14.269 6.707
47 1HD PRO 6 2HD PRO 6 -14.156 12.383 8.420
48 2HD PRO 6 1HD PRO 6 -15.881 12.786 8.307
49 H ALA 7 H ALA 7 -14.042 11.423 3.451
50 HA ALA 7 HA ALA 7 -12.041 9.379 3.833
51 1HB ALA 7 1HB ALA 7 -12.399 11.334 1.563
52 2HB ALA 7 2HB ALA 7 -13.088 9.714 1.641
53 3HB ALA 7 3HB ALA 7 -11.339 9.925 1.563
54 H MET 8 H MET 8 -11.804 12.821 2.928
55 HA MET 8 HA MET 8 -10.235 14.418 3.344
56 1HB MET 8 2HB MET 8 -9.844 12.800 5.871
57 2HB MET 8 1HB MET 8 -9.170 14.400 5.597
58 1HG MET 8 2HG MET 8 -11.381 15.355 5.467
59 2HG MET 8 1HG MET 8 -12.110 13.757 5.604
60 1HE MET 8 1HE MET 8 -8.961 15.044 7.565
61 2HE MET 8 2HE MET 8 -9.693 15.721 9.020
62 3HE MET 8 3HE MET 8 -9.954 16.497 7.457
63 H LYS 9 H LYS 9 -9.524 11.970 1.921
64 HA LYS 9 HA LYS 9 -7.784 10.822 1.082
65 1HB LYS 9 2HB LYS 9 -6.058 12.992 2.242
66 2HB LYS 9 1HB LYS 9 -5.556 11.807 1.047
67 1HG LYS 9 2HG LYS 9 -7.425 12.758 -0.415
68 2HG LYS 9 1HG LYS 9 -7.455 14.105 0.724
69 1HD LYS 9 2HD LYS 9 -6.022 14.774 -1.030
70 2HD LYS 9 1HD LYS 9 -4.962 14.325 0.310
71 1HE LYS 9 2HE LYS 9 -4.075 13.411 -1.733
72 2HE LYS 9 1HE LYS 9 -4.672 12.093 -0.724
73 1HZ LYS 9 1HZ LYS 9 -6.729 12.105 -2.066
74 2HZ LYS 9 2HZ LYS 9 -5.355 11.737 -2.983
75 3HZ LYS 9 3HZ LYS 9 -6.043 13.283 -3.078
76 H ASN 10 H ASN 10 -5.805 11.931 3.609
77 HA ASN 10 HA ASN 10 -4.817 10.986 5.413
78 1HB ASN 10 2HB ASN 10 -7.018 10.909 6.352
79 2HB ASN 10 1HB ASN 10 -7.450 9.505 5.393
80 1HD2 ASN 10 1HD2 ASN 10 -6.856 7.514 6.056
81 2HD2 ASN 10 2HD2 ASN 10 -6.220 7.178 7.630
82 H VAL 11 H VAL 11 -4.749 9.750 2.636
83 HA VAL 11 HA VAL 11 -3.200 7.385 3.179
84 HB VAL 11 HB VAL 11 -5.900 7.176 1.813
85 1HG1 VAL 11 1HG1 VAL 11 -4.267 5.970 0.497
86 2HG1 VAL 11 2HG1 VAL 11 -5.324 4.834 1.338
87 3HG1 VAL 11 3HG1 VAL 11 -3.691 5.132 1.937
88 1HG2 VAL 11 1HG2 VAL 11 -4.784 5.670 4.178
89 2HG2 VAL 11 2HG2 VAL 11 -6.370 5.425 3.445
90 3HG2 VAL 11 3HG2 VAL 11 -5.995 6.951 4.245
91 HA PRO 12 HA PRO 12 -1.587 9.247 -0.565
92 1HB PRO 12 2HB PRO 12 0.652 7.786 -0.738
93 2HB PRO 12 1HB PRO 12 0.427 8.986 0.533
94 1HG PRO 12 2HG PRO 12 0.068 6.023 0.669
95 2HG PRO 12 1HG PRO 12 0.904 7.096 1.806
96 1HD PRO 12 2HD PRO 12 -1.642 6.213 2.195
97 2HD PRO 12 1HD PRO 12 -1.057 7.775 2.802
98 H VAL 13 H VAL 13 -2.387 5.914 -0.163
99 HA VAL 13 HA VAL 13 -1.862 5.321 -2.977
100 HB VAL 13 HB VAL 13 -2.354 2.946 -2.284
101 1HG1 VAL 13 1HG1 VAL 13 -0.165 4.385 -0.794
102 2HG1 VAL 13 2HG1 VAL 13 -0.070 3.761 -2.442
103 3HG1 VAL 13 3HG1 VAL 13 -0.236 2.648 -1.084
104 1HG2 VAL 13 1HG2 VAL 13 -3.730 3.411 -0.336
105 2HG2 VAL 13 2HG2 VAL 13 -2.361 4.195 0.461
106 3HG2 VAL 13 3HG2 VAL 13 -2.318 2.459 0.131
107 H GLU 14 H GLU 14 -3.463 5.324 -4.421
108 HA GLU 14 HA GLU 14 -6.211 5.361 -3.398
109 1HB GLU 14 2HB GLU 14 -5.380 7.292 -4.788
110 2HB GLU 14 1HB GLU 14 -5.271 6.180 -6.146
111 1HG GLU 14 2HG GLU 14 -7.644 5.784 -6.066
112 2HG GLU 14 1HG GLU 14 -7.788 6.779 -4.617
113 H ALA 15 H ALA 15 -7.555 3.757 -3.808
114 HA ALA 15 HA ALA 15 -6.711 1.277 -4.714
115 1HB ALA 15 1HB ALA 15 -9.065 0.646 -4.740
116 2HB ALA 15 2HB ALA 15 -9.531 2.346 -4.676
117 3HB ALA 15 3HB ALA 15 -8.689 1.610 -3.312
118 H GLY 16 H GLY 16 -6.152 0.614 -6.653
119 1HA GLY 16 2HA GLY 16 -6.948 0.107 -8.910
120 2HA GLY 16 1HA GLY 16 -7.583 1.744 -8.977
121 H LYS 17 H LYS 17 -5.096 2.757 -7.626
122 HA LYS 17 HA LYS 17 -3.555 3.061 -10.065
123 1HB LYS 17 2HB LYS 17 -3.261 4.307 -7.330
124 2HB LYS 17 1HB LYS 17 -2.186 4.642 -8.677
125 1HG LYS 17 2HG LYS 17 -4.117 5.498 -9.956
126 2HG LYS 17 1HG LYS 17 -5.131 5.248 -8.532
127 1HD LYS 17 2HD LYS 17 -3.701 6.774 -7.252
128 2HD LYS 17 1HD LYS 17 -2.696 7.029 -8.678
129 1HE LYS 17 2HE LYS 17 -5.620 7.718 -8.422
130 2HE LYS 17 1HE LYS 17 -4.280 8.860 -8.349
131 1HZ LYS 17 1HZ LYS 17 -3.696 8.093 -10.650
132 2HZ LYS 17 2HZ LYS 17 -5.149 8.956 -10.520
133 3HZ LYS 17 3HZ LYS 17 -5.180 7.269 -10.683
134 H GLU 18 H GLU 18 -1.211 2.834 -10.041
135 HA GLU 18 HA GLU 18 -0.301 0.785 -8.154
136 1HB GLU 18 2HB GLU 18 0.912 -0.351 -9.931
137 2HB GLU 18 1HB GLU 18 -0.800 -0.282 -10.301
138 1HG GLU 18 2HG GLU 18 1.336 1.461 -11.493
139 2HG GLU 18 1HG GLU 18 0.584 0.077 -12.266
140 H TYR 19 H TYR 19 1.661 1.079 -7.268
141 HA TYR 19 HA TYR 19 3.192 3.435 -8.176
142 1HB TYR 19 2HB TYR 19 2.848 2.529 -5.312
143 2HB TYR 19 1HB TYR 19 3.733 3.944 -5.860
144 HD1 TYR 19 1HD TYR 19 2.337 5.764 -7.095
145 HD2 TYR 19 2HD TYR 19 0.649 2.718 -4.649
146 HE1 TYR 19 1HE TYR 19 0.325 7.141 -6.773
147 HE2 TYR 19 2HE TYR 19 -1.367 4.079 -4.332
148 HH TYR 19 HH TYR 19 -1.772 6.789 -4.424
149 H GLU 20 H GLU 20 5.483 3.383 -7.518
150 HA GLU 20 HA GLU 20 6.539 0.654 -7.614
151 1HB GLU 20 2HB GLU 20 7.392 2.252 -9.266
152 2HB GLU 20 1HB GLU 20 7.896 3.333 -7.975
153 1HG GLU 20 2HG GLU 20 9.482 1.647 -7.188
154 2HG GLU 20 1HG GLU 20 8.984 0.576 -8.498
155 H VAL 21 H VAL 21 7.310 -0.284 -5.811
156 HA VAL 21 HA VAL 21 7.954 1.469 -3.528
157 HB VAL 21 HB VAL 21 6.870 -0.081 -1.999
158 1HG1 VAL 21 1HG1 VAL 21 5.030 0.786 -4.227
159 2HG1 VAL 21 2HG1 VAL 21 5.544 1.766 -2.852
160 3HG1 VAL 21 3HG1 VAL 21 4.533 0.344 -2.594
161 1HG2 VAL 21 1HG2 VAL 21 7.163 -2.144 -3.259
162 2HG2 VAL 21 2HG2 VAL 21 6.002 -1.591 -4.466
163 3HG2 VAL 21 3HG2 VAL 21 5.471 -1.919 -2.815
164 H THR 22 H THR 22 9.118 0.266 -1.783
165 HA THR 22 HA THR 22 10.869 -1.820 -2.896
166 HB THR 22 HB THR 22 11.596 0.185 -0.745
167 HG1 THR 22 1HG THR 22 11.489 0.458 -3.423
168 1HG2 THR 22 1HG2 THR 22 13.289 -1.761 -2.320
169 2HG2 THR 22 2HG2 THR 22 12.838 -1.931 -0.625
170 3HG2 THR 22 3HG2 THR 22 13.886 -0.605 -1.130
171 H ILE 23 H ILE 23 11.349 -3.555 -1.515
172 HA ILE 23 HA ILE 23 9.388 -3.901 0.642
173 HB ILE 23 HB ILE 23 10.614 -6.136 -0.982
174 1HG1 ILE 23 2HG1 ILE 23 9.378 -4.663 -2.507
175 2HG1 ILE 23 1HG1 ILE 23 8.536 -6.191 -2.292
176 1HG2 ILE 23 1HG2 ILE 23 8.151 -6.002 0.758
177 2HG2 ILE 23 2HG2 ILE 23 9.681 -6.773 1.178
178 3HG2 ILE 23 3HG2 ILE 23 8.700 -7.420 -0.138
179 1HD1 ILE 23 1HD1 ILE 23 7.022 -5.099 -0.694
180 2HD1 ILE 23 2HD1 ILE 23 6.965 -4.371 -2.299
181 3HD1 ILE 23 3HD1 ILE 23 7.842 -3.568 -0.996
182 H GLU 24 H GLU 24 11.367 -2.722 1.558
183 HA GLU 24 HA GLU 24 13.671 -4.331 2.138
184 1HB GLU 24 2HB GLU 24 14.302 -2.368 3.615
185 2HB GLU 24 1HB GLU 24 14.123 -2.041 1.901
186 1HG GLU 24 2HG GLU 24 13.131 -0.227 2.996
187 2HG GLU 24 1HG GLU 24 11.791 -1.220 2.436
188 H ASP 25 H ASP 25 10.745 -4.780 3.252
189 HA ASP 25 HA ASP 25 11.728 -5.986 5.705
190 1HB ASP 25 2HB ASP 25 10.891 -3.715 6.357
191 2HB ASP 25 1HB ASP 25 9.307 -4.174 5.745
192 H MET 26 H MET 26 10.460 -7.765 6.387
193 HA MET 26 HA MET 26 8.265 -8.465 4.566
194 1HB MET 26 2HB MET 26 10.294 -10.372 5.727
195 2HB MET 26 1HB MET 26 8.894 -10.837 4.770
196 1HG MET 26 2HG MET 26 9.917 -9.253 2.987
197 2HG MET 26 1HG MET 26 11.394 -9.463 3.917
198 1HE MET 26 1HE MET 26 8.659 -11.154 1.737
199 2HE MET 26 2HE MET 26 8.466 -12.009 3.268
200 3HE MET 26 3HE MET 26 9.078 -12.864 1.852
201 H GLY 27 H GLY 27 6.596 -9.768 5.414
202 1HA GLY 27 2HA GLY 27 6.066 -9.095 8.188
203 2HA GLY 27 1HA GLY 27 4.917 -9.745 7.031
204 H LYS 28 H LYS 28 5.632 -12.082 6.290
205 HA LYS 28 HA LYS 28 6.787 -13.694 8.327
206 1HB LYS 28 2HB LYS 28 4.605 -14.951 8.614
207 2HB LYS 28 1HB LYS 28 4.820 -13.438 9.473
208 1HG LYS 28 2HG LYS 28 3.458 -12.275 7.875
209 2HG LYS 28 1HG LYS 28 3.327 -13.723 6.882
210 1HD LYS 28 2HD LYS 28 2.093 -14.842 8.658
211 2HD LYS 28 1HD LYS 28 2.259 -13.413 9.685
212 1HE LYS 28 2HE LYS 28 0.057 -13.548 8.552
213 2HE LYS 28 1HE LYS 28 0.966 -12.091 8.151
214 1HZ LYS 28 1HZ LYS 28 1.703 -13.235 6.094
215 2HZ LYS 28 2HZ LYS 28 0.030 -12.971 6.158
216 3HZ LYS 28 3HZ LYS 28 0.653 -14.517 6.467
217 H GLY 29 H GLY 29 7.917 -14.134 6.349
218 1HA GLY 29 2HA GLY 29 8.626 -15.841 4.987
219 2HA GLY 29 1HA GLY 29 7.322 -16.796 5.659
220 H GLY 30 H GLY 30 6.979 -13.830 3.775
221 1HA GLY 30 2HA GLY 30 6.939 -14.740 1.219
222 2HA GLY 30 1HA GLY 30 5.361 -15.224 1.830
223 H ASP 31 H ASP 31 4.643 -13.179 3.402
224 HA ASP 31 HA ASP 31 4.089 -11.091 1.491
225 1HB ASP 31 2HB ASP 31 2.800 -10.091 3.443
226 2HB ASP 31 1HB ASP 31 2.250 -11.666 2.879
227 H GLY 32 H GLY 32 4.650 -8.930 1.693
228 1HA GLY 32 2HA GLY 32 6.921 -8.419 3.497
229 2HA GLY 32 1HA GLY 32 6.990 -7.982 1.802
230 H ILE 33 H ILE 33 7.500 -6.032 3.463
231 HA ILE 33 HA ILE 33 5.000 -4.492 3.668
232 HB ILE 33 HB ILE 33 7.477 -4.411 5.382
233 1HG1 ILE 33 2HG1 ILE 33 5.667 -4.316 7.185
234 2HG1 ILE 33 1HG1 ILE 33 4.518 -4.685 5.908
235 1HG2 ILE 33 1HG2 ILE 33 7.051 -2.105 4.691
236 2HG2 ILE 33 2HG2 ILE 33 6.695 -2.340 6.404
237 3HG2 ILE 33 3HG2 ILE 33 5.378 -2.249 5.233
238 1HD1 ILE 33 1HD1 ILE 33 5.697 -6.777 5.465
239 2HD1 ILE 33 2HD1 ILE 33 5.128 -6.676 7.130
240 3HD1 ILE 33 3HD1 ILE 33 6.832 -6.403 6.763
241 H ALA 34 H ALA 34 4.802 -2.973 2.209
242 HA ALA 34 HA ALA 34 7.224 -1.561 1.299
243 1HB ALA 34 1HB ALA 34 6.154 -2.734 -0.529
244 2HB ALA 34 2HB ALA 34 5.947 -0.993 -0.730
245 3HB ALA 34 3HB ALA 34 4.607 -1.980 -0.142
246 H ARG 35 H ARG 35 7.355 0.453 2.101
247 HA ARG 35 HA ARG 35 4.903 1.538 3.293
248 1HB ARG 35 2HB ARG 35 6.899 1.036 4.758
249 2HB ARG 35 1HB ARG 35 7.721 2.365 3.955
250 1HG ARG 35 2HG ARG 35 6.324 3.956 4.885
251 2HG ARG 35 1HG ARG 35 5.059 2.778 5.243
252 1HD ARG 35 2HD ARG 35 6.147 3.419 7.293
253 2HD ARG 35 1HD ARG 35 6.547 1.745 6.920
254 HE ARG 35 HE ARG 35 8.378 4.012 6.422
255 1HH1 ARG 35 1HH1 ARG 35 7.763 0.702 7.388
256 2HH1 ARG 35 2HH1 ARG 35 9.424 0.359 7.759
257 1HH2 ARG 35 1HH2 ARG 35 10.562 3.588 6.979
258 2HH2 ARG 35 2HH2 ARG 35 11.007 2.006 7.547
259 H ILE 36 H ILE 36 3.935 2.960 2.086
260 HA ILE 36 HA ILE 36 5.509 4.763 0.394
261 HB ILE 36 HB ILE 36 2.576 4.050 0.368
262 1HG1 ILE 36 2HG1 ILE 36 4.847 3.615 -1.576
263 2HG1 ILE 36 1HG1 ILE 36 4.023 2.386 -0.622
264 1HG2 ILE 36 1HG2 ILE 36 2.853 6.448 -0.132
265 2HG2 ILE 36 2HG2 ILE 36 2.310 5.533 -1.540
266 3HG2 ILE 36 3HG2 ILE 36 3.996 6.037 -1.410
267 1HD1 ILE 36 1HD1 ILE 36 3.296 2.360 -2.934
268 2HD1 ILE 36 2HD1 ILE 36 2.790 4.046 -2.801
269 3HD1 ILE 36 3HD1 ILE 36 1.970 2.801 -1.858
270 H ASP 37 H ASP 37 6.051 6.557 1.313
271 HA ASP 37 HA ASP 37 6.061 8.462 2.562
272 1HB ASP 37 2HB ASP 37 3.159 8.274 1.781
273 2HB ASP 37 1HB ASP 37 3.772 9.628 2.723
274 H GLY 38 H GLY 38 5.703 5.895 4.005
275 1HA GLY 38 2HA GLY 38 5.819 5.691 6.382
276 2HA GLY 38 1HA GLY 38 4.728 7.062 6.523
277 H PHE 39 H PHE 39 3.252 5.594 4.208
278 HA PHE 39 HA PHE 39 1.367 4.280 5.973
279 1HB PHE 39 2HB PHE 39 0.561 5.821 4.240
280 2HB PHE 39 1HB PHE 39 1.305 4.829 2.996
281 HD1 PHE 39 1HD PHE 39 0.304 2.774 2.282
282 HD2 PHE 39 2HD PHE 39 -1.464 5.131 5.351
283 HE1 PHE 39 1HE PHE 39 -1.791 1.524 2.031
284 HE2 PHE 39 2HE PHE 39 -3.565 3.876 5.107
285 HZ PHE 39 HZ PHE 39 -3.720 2.077 3.436
286 H VAL 40 H VAL 40 0.976 2.110 6.036
287 HA VAL 40 HA VAL 40 3.088 0.466 4.892
288 HB VAL 40 HB VAL 40 0.879 -0.367 6.776
289 1HG1 VAL 40 1HG1 VAL 40 1.903 -2.230 5.586
290 2HG1 VAL 40 2HG1 VAL 40 2.368 -2.251 7.288
291 3HG1 VAL 40 3HG1 VAL 40 3.506 -1.676 6.069
292 1HG2 VAL 40 1HG2 VAL 40 3.701 0.508 7.394
293 2HG2 VAL 40 2HG2 VAL 40 2.542 -0.135 8.560
294 3HG2 VAL 40 3HG2 VAL 40 2.230 1.408 7.764
295 H VAL 41 H VAL 41 2.834 -0.412 2.983
296 HA VAL 41 HA VAL 41 0.168 -1.389 2.193
297 HB VAL 41 HB VAL 41 2.531 -0.793 0.393
298 1HG1 VAL 41 1HG1 VAL 41 1.040 -2.477 -0.519
299 2HG1 VAL 41 2HG1 VAL 41 0.882 -0.966 -1.416
300 3HG1 VAL 41 3HG1 VAL 41 -0.347 -1.426 -0.239
301 1HG2 VAL 41 1HG2 VAL 41 0.042 0.847 0.859
302 2HG2 VAL 41 2HG2 VAL 41 1.303 1.188 -0.326
303 3HG2 VAL 41 3HG2 VAL 41 1.669 1.262 1.398
304 H PHE 42 H PHE 42 -0.058 -3.529 2.324
305 HA PHE 42 HA PHE 42 2.301 -5.174 2.700
306 1HB PHE 42 2HB PHE 42 -0.648 -5.711 2.974
307 2HB PHE 42 1HB PHE 42 0.550 -6.996 3.079
308 HD1 PHE 42 1HD PHE 42 -0.922 -4.110 4.735
309 HD2 PHE 42 2HD PHE 42 2.127 -7.070 4.928
310 HE1 PHE 42 1HE PHE 42 -0.577 -3.597 7.116
311 HE2 PHE 42 2HE PHE 42 2.478 -6.563 7.309
312 HZ PHE 42 HZ PHE 42 1.124 -4.823 8.407
313 H VAL 43 H VAL 43 3.151 -6.527 1.303
314 HA VAL 43 HA VAL 43 1.771 -6.932 -1.265
315 HB VAL 43 HB VAL 43 4.073 -7.430 -2.171
316 1HG1 VAL 43 1HG1 VAL 43 3.641 -4.680 -1.021
317 2HG1 VAL 43 2HG1 VAL 43 2.973 -5.286 -2.536
318 3HG1 VAL 43 3HG1 VAL 43 4.715 -5.093 -2.357
319 1HG2 VAL 43 1HG2 VAL 43 4.956 -6.237 0.457
320 2HG2 VAL 43 2HG2 VAL 43 5.999 -6.625 -0.913
321 3HG2 VAL 43 3HG2 VAL 43 5.175 -7.916 -0.038
322 HA PRO 44 HA PRO 44 1.370 -11.113 0.172
323 1HB PRO 44 2HB PRO 44 0.504 -11.758 -2.551
324 2HB PRO 44 1HB PRO 44 -0.417 -11.796 -1.048
325 1HG PRO 44 2HG PRO 44 -0.870 -9.950 -2.953
326 2HG PRO 44 1HG PRO 44 -1.058 -9.591 -1.226
327 1HD PRO 44 2HD PRO 44 1.218 -8.927 -3.064
328 2HD PRO 44 1HD PRO 44 0.439 -7.922 -1.822
329 H ASN 45 H ASN 45 3.079 -10.373 -2.822
330 HA ASN 45 HA ASN 45 4.472 -12.937 -2.635
331 1HB ASN 45 2HB ASN 45 4.176 -12.991 -5.219
332 2HB ASN 45 1HB ASN 45 2.872 -13.539 -4.170
333 1HD2 ASN 45 1HD2 ASN 45 1.184 -13.102 -5.429
334 2HD2 ASN 45 2HD2 ASN 45 0.743 -11.520 -5.944
335 H ALA 46 H ALA 46 5.414 -10.227 -2.083
336 HA ALA 46 HA ALA 46 7.302 -9.679 -4.213
337 1HB ALA 46 1HB ALA 46 6.245 -7.832 -3.013
338 2HB ALA 46 2HB ALA 46 8.001 -7.808 -2.855
339 3HB ALA 46 3HB ALA 46 7.006 -8.378 -1.516
340 H GLU 47 H GLU 47 9.609 -9.564 -3.832
341 HA GLU 47 HA GLU 47 10.604 -11.386 -1.769
342 1HB GLU 47 2HB GLU 47 11.786 -10.337 -4.330
343 2HB GLU 47 1HB GLU 47 12.806 -11.016 -3.080
344 1HG GLU 47 2HG GLU 47 12.462 -12.782 -4.536
345 2HG GLU 47 1HG GLU 47 11.312 -13.084 -3.237
346 H LYS 48 H LYS 48 12.221 -10.708 -0.311
347 HA LYS 48 HA LYS 48 12.006 -8.010 0.532
348 1HB LYS 48 2HB LYS 48 13.593 -8.557 2.249
349 2HB LYS 48 1HB LYS 48 12.492 -9.913 2.059
350 1HG LYS 48 2HG LYS 48 14.171 -11.116 0.776
351 2HG LYS 48 1HG LYS 48 15.272 -9.744 0.912
352 1HD LYS 48 2HD LYS 48 15.915 -11.343 2.557
353 2HD LYS 48 1HD LYS 48 15.141 -10.001 3.399
354 1HE LYS 48 2HE LYS 48 14.416 -12.172 4.273
355 2HE LYS 48 1HE LYS 48 13.078 -11.263 3.571
356 1HZ LYS 48 1HZ LYS 48 13.142 -13.666 2.978
357 2HZ LYS 48 2HZ LYS 48 14.568 -13.367 2.103
358 3HZ LYS 48 3HZ LYS 48 13.121 -12.619 1.643
359 H GLY 49 H GLY 49 13.325 -6.286 0.304
360 1HA GLY 49 2HA GLY 49 15.088 -4.989 -0.404
361 2HA GLY 49 1HA GLY 49 15.991 -6.464 -0.712
362 H SER 50 H SER 50 12.964 -6.393 -2.250
363 HA SER 50 HA SER 50 14.283 -5.689 -4.778
364 1HB SER 50 2HB SER 50 13.271 -8.008 -4.490
365 2HB SER 50 1HB SER 50 11.695 -7.222 -4.468
366 HG SER 50 HG SER 50 13.305 -6.454 -6.570
367 H VAL 51 H VAL 51 13.181 -4.360 -6.273
368 HA VAL 51 HA VAL 51 11.264 -2.527 -5.000
369 HB VAL 51 HB VAL 51 12.974 -2.086 -7.462
370 1HG1 VAL 51 1HG1 VAL 51 12.316 0.266 -7.223
371 2HG1 VAL 51 2HG1 VAL 51 11.240 -0.177 -5.899
372 3HG1 VAL 51 3HG1 VAL 51 10.928 -0.779 -7.527
373 1HG2 VAL 51 1HG2 VAL 51 14.333 -2.243 -5.442
374 2HG2 VAL 51 2HG2 VAL 51 13.315 -1.035 -4.653
375 3HG2 VAL 51 3HG2 VAL 51 14.297 -0.585 -6.048
376 H ILE 52 H ILE 52 9.238 -3.142 -5.450
377 HA ILE 52 HA ILE 52 8.701 -4.206 -8.145
378 HB ILE 52 HB ILE 52 7.182 -5.742 -7.322
379 1HG1 ILE 52 2HG1 ILE 52 6.918 -3.983 -4.877
380 2HG1 ILE 52 1HG1 ILE 52 5.687 -4.357 -6.082
381 1HG2 ILE 52 1HG2 ILE 52 8.177 -6.858 -5.355
382 2HG2 ILE 52 2HG2 ILE 52 9.190 -5.435 -5.094
383 3HG2 ILE 52 3HG2 ILE 52 9.378 -6.395 -6.564
384 1HD1 ILE 52 1HD1 ILE 52 6.844 -6.253 -4.061
385 2HD1 ILE 52 2HD1 ILE 52 5.687 -6.689 -5.315
386 3HD1 ILE 52 3HD1 ILE 52 5.231 -5.546 -4.053
387 H ASN 53 H ASN 53 6.688 -3.655 -9.119
388 HA ASN 53 HA ASN 53 5.591 -1.106 -8.200
389 1HB ASN 53 2HB ASN 53 6.223 -1.305 -10.583
390 2HB ASN 53 1HB ASN 53 5.099 -2.645 -10.766
391 1HD2 ASN 53 1HD2 ASN 53 2.924 -2.234 -10.925
392 2HD2 ASN 53 2HD2 ASN 53 2.280 -0.642 -11.121
393 H VAL 54 H VAL 54 3.765 -1.087 -7.033
394 HA VAL 54 HA VAL 54 2.161 -3.559 -7.007
395 HB VAL 54 HB VAL 54 1.463 -2.944 -4.725
396 1HG1 VAL 54 1HG1 VAL 54 4.438 -3.152 -5.110
397 2HG1 VAL 54 2HG1 VAL 54 3.294 -4.494 -5.056
398 3HG1 VAL 54 3HG1 VAL 54 3.567 -3.506 -3.620
399 1HG2 VAL 54 1HG2 VAL 54 3.507 -0.742 -5.000
400 2HG2 VAL 54 2HG2 VAL 54 2.735 -1.229 -3.492
401 3HG2 VAL 54 3HG2 VAL 54 1.764 -0.542 -4.797
402 H LYS 55 H LYS 55 0.091 -3.455 -7.545
403 HA LYS 55 HA LYS 55 -1.143 -0.806 -7.798
404 1HB LYS 55 2HB LYS 55 -1.247 -2.338 -9.770
405 2HB LYS 55 1HB LYS 55 -2.180 -3.472 -8.798
406 1HG LYS 55 2HG LYS 55 -3.959 -1.850 -8.556
407 2HG LYS 55 1HG LYS 55 -3.009 -0.650 -9.434
408 1HD LYS 55 2HD LYS 55 -4.766 -1.697 -10.819
409 2HD LYS 55 1HD LYS 55 -3.145 -1.949 -11.456
410 1HE LYS 55 2HE LYS 55 -4.370 -4.020 -9.686
411 2HE LYS 55 1HE LYS 55 -4.871 -3.915 -11.373
412 1HZ LYS 55 1HZ LYS 55 -2.579 -4.196 -12.052
413 2HZ LYS 55 2HZ LYS 55 -3.052 -5.491 -11.057
414 3HZ LYS 55 3HZ LYS 55 -2.078 -4.256 -10.438
415 H VAL 56 H VAL 56 -2.139 -0.154 -6.019
416 HA VAL 56 HA VAL 56 -2.849 -1.971 -3.933
417 HB VAL 56 HB VAL 56 -3.591 0.949 -4.169
418 1HG1 VAL 56 1HG1 VAL 56 -3.765 0.863 -1.738
419 2HG1 VAL 56 2HG1 VAL 56 -3.365 -0.857 -1.764
420 3HG1 VAL 56 3HG1 VAL 56 -4.869 -0.287 -2.494
421 1HG2 VAL 56 1HG2 VAL 56 -1.174 0.670 -4.369
422 2HG2 VAL 56 2HG2 VAL 56 -1.157 -0.309 -2.901
423 3HG2 VAL 56 3HG2 VAL 56 -1.594 1.398 -2.818
424 H THR 57 H THR 57 -4.596 -3.203 -3.964
425 HA THR 57 HA THR 57 -6.953 -2.253 -5.432
426 HB THR 57 HB THR 57 -7.587 -4.748 -5.308
427 HG1 THR 57 1HG THR 57 -5.445 -5.965 -5.278
428 1HG2 THR 57 1HG2 THR 57 -5.192 -3.879 -6.931
429 2HG2 THR 57 2HG2 THR 57 -6.883 -3.624 -7.366
430 3HG2 THR 57 3HG2 THR 57 -6.230 -5.261 -7.285
431 H ALA 58 H ALA 58 -5.818 -2.956 -2.280
432 HA ALA 58 HA ALA 58 -8.554 -2.768 -1.253
433 1HB ALA 58 1HB ALA 58 -6.498 -4.719 -0.216
434 2HB ALA 58 2HB ALA 58 -7.898 -5.138 -1.204
435 3HB ALA 58 3HB ALA 58 -8.128 -4.479 0.416
436 H VAL 59 H VAL 59 -8.195 -0.662 -0.727
437 HA VAL 59 HA VAL 59 -6.032 0.066 1.063
438 HB VAL 59 HB VAL 59 -8.292 1.830 0.106
439 1HG1 VAL 59 1HG1 VAL 59 -7.070 2.719 1.990
440 2HG1 VAL 59 2HG1 VAL 59 -6.702 3.644 0.534
441 3HG1 VAL 59 3HG1 VAL 59 -5.538 2.470 1.149
442 1HG2 VAL 59 1HG2 VAL 59 -5.612 1.369 -1.192
443 2HG2 VAL 59 2HG2 VAL 59 -6.783 2.603 -1.662
444 3HG2 VAL 59 3HG2 VAL 59 -7.184 0.896 -1.836
445 H LYS 60 H LYS 60 -6.228 0.331 3.219
446 HA LYS 60 HA LYS 60 -8.944 0.386 4.362
447 1HB LYS 60 2HB LYS 60 -6.420 -0.646 5.670
448 2HB LYS 60 1HB LYS 60 -8.009 -0.585 6.414
449 1HG LYS 60 2HG LYS 60 -7.251 -2.231 4.017
450 2HG LYS 60 1HG LYS 60 -7.441 -2.827 5.665
451 1HD LYS 60 2HD LYS 60 -9.792 -2.123 5.633
452 2HD LYS 60 1HD LYS 60 -9.591 -1.564 3.971
453 1HE LYS 60 2HE LYS 60 -8.989 -3.870 3.314
454 2HE LYS 60 1HE LYS 60 -9.313 -4.393 4.967
455 1HZ LYS 60 1HZ LYS 60 -11.279 -3.165 3.110
456 2HZ LYS 60 2HZ LYS 60 -11.601 -3.622 4.710
457 3HZ LYS 60 3HZ LYS 60 -11.215 -4.804 3.553
458 H GLU 61 H GLU 61 -8.951 1.406 6.564
459 HA GLU 61 HA GLU 61 -7.895 4.040 6.523
460 1HB GLU 61 2HB GLU 61 -9.984 3.387 7.667
461 2HB GLU 61 1HB GLU 61 -9.038 2.421 8.792
462 1HG GLU 61 2HG GLU 61 -7.969 4.399 9.654
463 2HG GLU 61 1HG GLU 61 -8.812 5.402 8.473
464 H LYS 62 H LYS 62 -6.864 0.978 7.772
465 HA LYS 62 HA LYS 62 -4.401 2.175 8.691
466 1HB LYS 62 2HB LYS 62 -5.777 -0.169 10.036
467 2HB LYS 62 1HB LYS 62 -4.270 0.589 10.526
468 1HG LYS 62 2HG LYS 62 -5.645 2.701 10.891
469 2HG LYS 62 1HG LYS 62 -7.059 1.653 10.767
470 1HD LYS 62 2HD LYS 62 -4.812 1.468 12.767
471 2HD LYS 62 1HD LYS 62 -6.492 1.897 13.086
472 1HE LYS 62 2HE LYS 62 -7.215 -0.335 12.509
473 2HE LYS 62 1HE LYS 62 -5.574 -0.776 12.031
474 1HZ LYS 62 1HZ LYS 62 -6.575 -0.189 14.757
475 2HZ LYS 62 2HZ LYS 62 -4.924 -0.247 14.387
476 3HZ LYS 62 3HZ LYS 62 -5.886 -1.631 14.187
477 H PHE 63 H PHE 63 -3.945 1.699 6.575
478 HA PHE 63 HA PHE 63 -2.231 0.777 5.421
479 1HB PHE 63 2HB PHE 63 -1.219 -1.445 6.002
480 2HB PHE 63 1HB PHE 63 -1.124 -0.229 7.262
481 HD1 PHE 63 1HD PHE 63 -1.950 -0.645 9.395
482 HD2 PHE 63 2HD PHE 63 -2.978 -3.265 6.200
483 HE1 PHE 63 1HE PHE 63 -3.030 -2.158 10.987
484 HE2 PHE 63 2HE PHE 63 -4.044 -4.794 7.803
485 HZ PHE 63 HZ PHE 63 -4.062 -4.249 10.203
486 H ALA 64 H ALA 64 -1.978 -0.491 3.602
487 HA ALA 64 HA ALA 64 -4.566 -1.616 2.723
488 1HB ALA 64 1HB ALA 64 -4.173 -0.634 0.552
489 2HB ALA 64 2HB ALA 64 -2.607 -0.019 1.084
490 3HB ALA 64 3HB ALA 64 -4.091 0.613 1.798
491 H PHE 65 H PHE 65 -4.358 -2.928 0.717
492 HA PHE 65 HA PHE 65 -1.907 -4.563 0.748
493 1HB PHE 65 2HB PHE 65 -4.745 -5.457 0.181
494 2HB PHE 65 1HB PHE 65 -3.318 -6.485 0.114
495 HD1 PHE 65 1HD PHE 65 -2.318 -7.351 2.100
496 HD2 PHE 65 2HD PHE 65 -5.577 -4.619 2.344
497 HE1 PHE 65 1HE PHE 65 -2.586 -7.886 4.486
498 HE2 PHE 65 2HE PHE 65 -5.847 -5.152 4.731
499 HZ PHE 65 HZ PHE 65 -4.351 -6.788 5.804
500 H ALA 66 H ALA 66 -0.922 -4.889 -1.189
501 HA ALA 66 HA ALA 66 -2.340 -3.991 -3.600
502 1HB ALA 66 1HB ALA 66 -0.981 -2.126 -2.813
503 2HB ALA 66 2HB ALA 66 -0.382 -2.755 -4.345
504 3HB ALA 66 3HB ALA 66 0.452 -3.149 -2.845
505 H GLU 67 H GLU 67 -1.664 -4.927 -5.527
506 HA GLU 67 HA GLU 67 -0.303 -7.479 -5.148
507 1HB GLU 67 2HB GLU 67 -1.184 -7.993 -7.417
508 2HB GLU 67 1HB GLU 67 -2.441 -7.596 -6.252
509 1HG GLU 67 2HG GLU 67 -2.555 -5.332 -7.157
510 2HG GLU 67 1HG GLU 67 -1.309 -5.740 -8.332
511 H ARG 68 H ARG 68 1.640 -7.905 -5.904
512 HA ARG 68 HA ARG 68 3.336 -5.966 -7.038
513 1HB ARG 68 2HB ARG 68 4.253 -7.713 -5.687
514 2HB ARG 68 1HB ARG 68 3.569 -8.964 -6.707
515 1HG ARG 68 2HG ARG 68 5.067 -7.994 -8.554
516 2HG ARG 68 1HG ARG 68 5.902 -7.162 -7.237
517 1HD ARG 68 2HD ARG 68 6.024 -9.466 -6.126
518 2HD ARG 68 1HD ARG 68 5.605 -10.104 -7.711
519 HE ARG 68 HE ARG 68 7.732 -8.497 -8.206
520 1HH1 ARG 68 1HH1 ARG 68 7.094 -11.157 -6.046
521 2HH1 ARG 68 2HH1 ARG 68 8.746 -11.706 -6.007
522 1HH2 ARG 68 1HH2 ARG 68 9.940 -9.215 -8.158
523 2HH2 ARG 68 2HH2 ARG 68 10.349 -10.611 -7.205
524 H VAL 69 H VAL 69 2.946 -5.175 -8.990
525 HA VAL 69 HA VAL 69 1.845 -6.760 -11.134
526 HB VAL 69 HB VAL 69 2.955 -3.949 -11.291
527 1HG1 VAL 69 1HG1 VAL 69 0.899 -5.372 -12.979
528 2HG1 VAL 69 2HG1 VAL 69 2.559 -5.007 -13.451
529 3HG1 VAL 69 3HG1 VAL 69 1.413 -3.694 -13.166
530 1HG2 VAL 69 1HG2 VAL 69 0.148 -4.812 -10.598
531 2HG2 VAL 69 2HG2 VAL 69 0.677 -3.154 -10.892
532 3HG2 VAL 69 3HG2 VAL 69 1.303 -4.048 -9.506
533 H LEU 70 H LEU 70 3.788 -8.250 -10.800
534 HA LEU 70 HA LEU 70 5.764 -7.577 -12.861
535 1HB LEU 70 2HB LEU 70 6.392 -8.673 -10.114
536 2HB LEU 70 1HB LEU 70 7.518 -8.734 -11.454
537 HG LEU 70 HG LEU 70 6.446 -6.224 -10.154
538 1HD1 LEU 70 1HD1 LEU 70 9.196 -7.467 -10.126
539 2HD1 LEU 70 2HD1 LEU 70 8.072 -7.399 -8.768
540 3HD1 LEU 70 3HD1 LEU 70 8.759 -5.910 -9.416
541 1HD2 LEU 70 1HD2 LEU 70 8.054 -5.058 -11.589
542 2HD2 LEU 70 2HD2 LEU 70 6.811 -5.885 -12.529
543 3HD2 LEU 70 3HD2 LEU 70 8.427 -6.580 -12.397
Start of MODEL 8
1 1H MET 1 1H MET 1 -11.232 3.603 17.788
2 2H MET 1 2H MET 1 -11.456 5.274 17.971
3 3H MET 1 3H MET 1 -9.977 4.674 17.390
4 HA MET 1 HA MET 1 -11.081 3.816 15.427
5 1HB MET 1 2HB MET 1 -13.319 3.585 16.507
6 2HB MET 1 1HB MET 1 -13.483 5.335 16.473
7 1HG MET 1 2HG MET 1 -14.702 4.342 14.642
8 2HG MET 1 1HG MET 1 -13.347 5.289 14.027
9 1HE MET 1 1HE MET 1 -13.655 2.328 11.464
10 2HE MET 1 2HE MET 1 -13.591 4.082 11.649
11 3HE MET 1 3HE MET 1 -14.958 3.177 12.298
12 H ALA 2 H ALA 2 -12.093 6.986 16.764
13 HA ALA 2 HA ALA 2 -10.230 8.335 15.002
14 1HB ALA 2 1HB ALA 2 -12.171 8.015 13.540
15 2HB ALA 2 2HB ALA 2 -11.905 9.720 13.903
16 3HB ALA 2 3HB ALA 2 -13.192 8.834 14.720
17 H PHE 3 H PHE 3 -9.262 9.302 16.723
18 HA PHE 3 HA PHE 3 -10.939 10.991 18.448
19 1HB PHE 3 2HB PHE 3 -8.144 9.916 18.868
20 2HB PHE 3 1HB PHE 3 -8.914 11.080 19.936
21 HD1 PHE 3 1HD PHE 3 -8.454 7.641 19.172
22 HD2 PHE 3 2HD PHE 3 -11.108 10.391 21.043
23 HE1 PHE 3 1HE PHE 3 -9.466 5.794 20.445
24 HE2 PHE 3 2HE PHE 3 -12.122 8.552 22.320
25 HZ PHE 3 HZ PHE 3 -11.299 6.249 22.023
26 H GLY 4 H GLY 4 -10.972 13.087 18.012
27 1HA GLY 4 2HA GLY 4 -9.892 15.188 17.868
28 2HA GLY 4 1HA GLY 4 -8.461 14.384 17.246
29 H LYS 5 H LYS 5 -10.901 13.030 15.600
30 HA LYS 5 HA LYS 5 -11.465 13.067 13.397
31 1HB LYS 5 2HB LYS 5 -11.457 16.065 13.807
32 2HB LYS 5 1HB LYS 5 -12.182 15.224 12.445
33 1HG LYS 5 2HG LYS 5 -13.793 14.166 13.901
34 2HG LYS 5 1HG LYS 5 -13.022 14.886 15.317
35 1HD LYS 5 2HD LYS 5 -15.033 16.123 14.644
36 2HD LYS 5 1HD LYS 5 -13.579 17.114 14.514
37 1HE LYS 5 2HE LYS 5 -13.499 16.517 12.084
38 2HE LYS 5 1HE LYS 5 -15.072 15.749 12.283
39 1HZ LYS 5 1HZ LYS 5 -14.523 18.601 12.898
40 2HZ LYS 5 2HZ LYS 5 -16.042 17.836 12.865
41 3HZ LYS 5 3HZ LYS 5 -15.165 18.049 11.428
42 HA PRO 6 HA PRO 6 -7.145 14.081 12.255
43 1HB PRO 6 2HB PRO 6 -6.148 11.615 12.105
44 2HB PRO 6 1HB PRO 6 -6.472 12.377 13.665
45 1HG PRO 6 2HG PRO 6 -7.971 10.237 12.257
46 2HG PRO 6 1HG PRO 6 -7.793 10.529 13.994
47 1HD PRO 6 2HD PRO 6 -9.979 11.273 12.322
48 2HD PRO 6 1HD PRO 6 -9.741 11.680 14.034
49 H ALA 7 H ALA 7 -5.830 13.678 10.409
50 HA ALA 7 HA ALA 7 -5.266 13.170 8.281
51 1HB ALA 7 1HB ALA 7 -5.955 10.876 8.827
52 2HB ALA 7 2HB ALA 7 -6.242 11.289 7.136
53 3HB ALA 7 3HB ALA 7 -7.589 11.255 8.276
54 H MET 8 H MET 8 -5.495 14.449 6.609
55 HA MET 8 HA MET 8 -8.076 15.655 6.030
56 1HB MET 8 2HB MET 8 -6.836 17.117 4.498
57 2HB MET 8 1HB MET 8 -6.118 17.122 6.100
58 1HG MET 8 2HG MET 8 -5.085 15.530 3.764
59 2HG MET 8 1HG MET 8 -4.465 17.098 4.272
60 1HE MET 8 1HE MET 8 -2.461 14.789 3.905
61 2HE MET 8 2HE MET 8 -1.525 14.837 5.400
62 3HE MET 8 3HE MET 8 -1.989 16.337 4.601
63 H LYS 9 H LYS 9 -7.250 12.831 5.505
64 HA LYS 9 HA LYS 9 -7.700 11.185 4.031
65 1HB LYS 9 2HB LYS 9 -9.428 13.390 2.984
66 2HB LYS 9 1HB LYS 9 -9.298 11.885 2.085
67 1HG LYS 9 2HG LYS 9 -11.235 11.824 3.518
68 2HG LYS 9 1HG LYS 9 -10.045 10.647 4.071
69 1HD LYS 9 2HD LYS 9 -9.291 12.276 5.777
70 2HD LYS 9 1HD LYS 9 -10.576 13.370 5.257
71 1HE LYS 9 2HE LYS 9 -10.918 10.615 6.436
72 2HE LYS 9 1HE LYS 9 -11.273 12.149 7.227
73 1HZ LYS 9 1HZ LYS 9 -12.687 10.915 4.937
74 2HZ LYS 9 2HZ LYS 9 -12.891 12.544 5.365
75 3HZ LYS 9 3HZ LYS 9 -13.311 11.321 6.464
76 H ASN 10 H ASN 10 -5.388 12.962 3.600
77 HA ASN 10 HA ASN 10 -4.960 12.808 0.740
78 1HB ASN 10 2HB ASN 10 -4.012 14.646 2.254
79 2HB ASN 10 1HB ASN 10 -2.877 13.437 2.840
80 1HD2 ASN 10 1HD2 ASN 10 -2.549 12.141 0.253
81 2HD2 ASN 10 2HD2 ASN 10 -1.611 13.220 -0.720
82 H VAL 11 H VAL 11 -5.545 10.471 1.032
83 HA VAL 11 HA VAL 11 -3.755 8.623 2.162
84 HB VAL 11 HB VAL 11 -5.612 8.135 -0.174
85 1HG1 VAL 11 1HG1 VAL 11 -3.987 6.351 0.249
86 2HG1 VAL 11 2HG1 VAL 11 -5.632 5.833 0.611
87 3HG1 VAL 11 3HG1 VAL 11 -4.534 6.256 1.922
88 1HG2 VAL 11 1HG2 VAL 11 -6.831 9.166 1.684
89 2HG2 VAL 11 2HG2 VAL 11 -6.206 7.930 2.777
90 3HG2 VAL 11 3HG2 VAL 11 -7.295 7.479 1.465
91 HA PRO 12 HA PRO 12 -0.389 9.194 -0.675
92 1HB PRO 12 2HB PRO 12 0.592 6.653 0.410
93 2HB PRO 12 1HB PRO 12 1.316 8.257 0.491
94 1HG PRO 12 2HG PRO 12 0.208 7.008 2.635
95 2HG PRO 12 1HG PRO 12 0.279 8.764 2.454
96 1HD PRO 12 2HD PRO 12 -2.025 6.928 2.129
97 2HD PRO 12 1HD PRO 12 -1.986 8.614 2.666
98 H VAL 13 H VAL 13 -2.184 6.237 -0.303
99 HA VAL 13 HA VAL 13 -1.278 5.268 -2.925
100 HB VAL 13 HB VAL 13 -2.163 3.062 -2.160
101 1HG1 VAL 13 1HG1 VAL 13 -0.121 4.345 -0.353
102 2HG1 VAL 13 2HG1 VAL 13 0.199 3.545 -1.892
103 3HG1 VAL 13 3HG1 VAL 13 -0.388 2.611 -0.516
104 1HG2 VAL 13 1HG2 VAL 13 -3.815 3.891 -0.568
105 2HG2 VAL 13 2HG2 VAL 13 -2.519 4.509 0.462
106 3HG2 VAL 13 3HG2 VAL 13 -2.701 2.769 0.212
107 H GLU 14 H GLU 14 -2.839 4.567 -4.446
108 HA GLU 14 HA GLU 14 -5.616 5.310 -3.804
109 1HB GLU 14 2HB GLU 14 -3.965 6.481 -5.738
110 2HB GLU 14 1HB GLU 14 -5.037 5.417 -6.638
111 1HG GLU 14 2HG GLU 14 -5.866 7.601 -4.739
112 2HG GLU 14 1HG GLU 14 -5.975 7.636 -6.499
113 H ALA 15 H ALA 15 -7.182 3.901 -4.352
114 HA ALA 15 HA ALA 15 -6.406 1.194 -4.813
115 1HB ALA 15 1HB ALA 15 -8.789 0.701 -4.710
116 2HB ALA 15 2HB ALA 15 -9.159 2.424 -4.802
117 3HB ALA 15 3HB ALA 15 -8.312 1.778 -3.397
118 H GLY 16 H GLY 16 -5.676 0.599 -6.743
119 1HA GLY 16 2HA GLY 16 -6.557 -0.177 -8.928
120 2HA GLY 16 1HA GLY 16 -7.222 1.439 -9.118
121 H LYS 17 H LYS 17 -4.505 2.234 -7.713
122 HA LYS 17 HA LYS 17 -3.092 2.475 -10.275
123 1HB LYS 17 2HB LYS 17 -2.778 4.089 -7.736
124 2HB LYS 17 1HB LYS 17 -1.889 4.359 -9.230
125 1HG LYS 17 2HG LYS 17 -4.040 4.803 -10.375
126 2HG LYS 17 1HG LYS 17 -4.855 4.654 -8.818
127 1HD LYS 17 2HD LYS 17 -4.574 6.931 -8.954
128 2HD LYS 17 1HD LYS 17 -3.120 6.465 -8.073
129 1HE LYS 17 2HE LYS 17 -3.260 6.885 -11.055
130 2HE LYS 17 1HE LYS 17 -2.718 8.099 -9.902
131 1HZ LYS 17 1HZ LYS 17 -0.943 6.554 -9.230
132 2HZ LYS 17 2HZ LYS 17 -0.836 7.000 -10.859
133 3HZ LYS 17 3HZ LYS 17 -1.435 5.474 -10.441
134 H GLU 18 H GLU 18 -0.757 2.312 -10.290
135 HA GLU 18 HA GLU 18 0.176 0.362 -8.302
136 1HB GLU 18 2HB GLU 18 1.850 -0.220 -10.235
137 2HB GLU 18 1HB GLU 18 0.227 -0.889 -10.221
138 1HG GLU 18 2HG GLU 18 0.647 -0.223 -12.430
139 2HG GLU 18 1HG GLU 18 -0.439 0.988 -11.759
140 H TYR 19 H TYR 19 2.186 0.551 -7.405
141 HA TYR 19 HA TYR 19 3.605 3.083 -7.923
142 1HB TYR 19 2HB TYR 19 2.970 1.906 -5.209
143 2HB TYR 19 1HB TYR 19 3.936 3.347 -5.499
144 HD1 TYR 19 1HD TYR 19 2.901 5.443 -6.025
145 HD2 TYR 19 2HD TYR 19 0.548 1.930 -5.571
146 HE1 TYR 19 1HE TYR 19 0.873 6.823 -5.926
147 HE2 TYR 19 2HE TYR 19 -1.488 3.296 -5.477
148 HH TYR 19 HH TYR 19 -1.500 6.613 -6.324
149 H GLU 20 H GLU 20 5.796 2.999 -7.830
150 HA GLU 20 HA GLU 20 7.081 0.425 -7.671
151 1HB GLU 20 2HB GLU 20 8.315 3.179 -7.879
152 2HB GLU 20 1HB GLU 20 9.126 1.648 -8.180
153 1HG GLU 20 2HG GLU 20 7.801 1.243 -10.113
154 2HG GLU 20 1HG GLU 20 6.764 2.618 -9.749
155 H VAL 21 H VAL 21 7.089 -0.405 -5.678
156 HA VAL 21 HA VAL 21 7.833 1.356 -3.437
157 HB VAL 21 HB VAL 21 6.663 -0.233 -1.965
158 1HG1 VAL 21 1HG1 VAL 21 5.448 1.691 -2.784
159 2HG1 VAL 21 2HG1 VAL 21 4.370 0.301 -2.684
160 3HG1 VAL 21 3HG1 VAL 21 4.997 0.816 -4.247
161 1HG2 VAL 21 1HG2 VAL 21 6.943 -2.252 -3.319
162 2HG2 VAL 21 2HG2 VAL 21 5.830 -1.600 -4.522
163 3HG2 VAL 21 3HG2 VAL 21 5.250 -1.986 -2.902
164 H THR 22 H THR 22 9.133 0.503 -1.772
165 HA THR 22 HA THR 22 10.933 -1.645 -2.640
166 HB THR 22 HB THR 22 11.374 0.387 -0.438
167 HG1 THR 22 1HG THR 22 11.198 1.316 -2.591
168 1HG2 THR 22 1HG2 THR 22 12.730 -1.641 -0.222
169 2HG2 THR 22 2HG2 THR 22 13.735 -0.263 -0.669
170 3HG2 THR 22 3HG2 THR 22 13.284 -1.457 -1.886
171 H ILE 23 H ILE 23 11.523 -3.263 -1.112
172 HA ILE 23 HA ILE 23 9.427 -3.777 0.864
173 HB ILE 23 HB ILE 23 10.942 -5.880 -0.700
174 1HG1 ILE 23 2HG1 ILE 23 9.501 -4.570 -2.202
175 2HG1 ILE 23 1HG1 ILE 23 8.879 -6.200 -1.991
176 1HG2 ILE 23 1HG2 ILE 23 10.127 -6.624 1.472
177 2HG2 ILE 23 2HG2 ILE 23 9.219 -7.397 0.171
178 3HG2 ILE 23 3HG2 ILE 23 8.505 -6.058 1.071
179 1HD1 ILE 23 1HD1 ILE 23 7.848 -3.717 -0.640
180 2HD1 ILE 23 2HD1 ILE 23 7.229 -5.350 -0.393
181 3HD1 ILE 23 3HD1 ILE 23 7.081 -4.581 -1.975
182 H GLU 24 H GLU 24 11.060 -2.428 1.943
183 HA GLU 24 HA GLU 24 13.570 -3.360 2.752
184 1HB GLU 24 2HB GLU 24 13.357 -1.738 4.600
185 2HB GLU 24 1HB GLU 24 12.887 -1.043 3.055
186 1HG GLU 24 2HG GLU 24 10.595 -1.136 3.596
187 2HG GLU 24 1HG GLU 24 10.888 -2.182 4.983
188 H ASP 25 H ASP 25 10.411 -4.345 3.721
189 HA ASP 25 HA ASP 25 11.528 -5.784 6.035
190 1HB ASP 25 2HB ASP 25 10.277 -3.552 6.530
191 2HB ASP 25 1HB ASP 25 8.828 -4.484 6.185
192 H MET 26 H MET 26 10.414 -7.699 6.625
193 HA MET 26 HA MET 26 8.269 -8.530 4.792
194 1HB MET 26 2HB MET 26 10.485 -10.324 5.796
195 2HB MET 26 1HB MET 26 9.127 -10.820 4.799
196 1HG MET 26 2HG MET 26 10.106 -8.919 3.219
197 2HG MET 26 1HG MET 26 11.583 -9.352 4.072
198 1HE MET 26 1HE MET 26 9.058 -12.210 1.488
199 2HE MET 26 2HE MET 26 8.847 -10.460 1.527
200 3HE MET 26 3HE MET 26 8.448 -11.426 2.945
201 H GLY 27 H GLY 27 6.903 -10.243 5.645
202 1HA GLY 27 2HA GLY 27 6.631 -10.034 8.570
203 2HA GLY 27 1HA GLY 27 5.335 -10.446 7.457
204 H LYS 28 H LYS 28 4.755 -12.501 7.482
205 HA LYS 28 HA LYS 28 6.339 -14.486 8.802
206 1HB LYS 28 2HB LYS 28 3.688 -14.476 7.430
207 2HB LYS 28 1HB LYS 28 4.434 -15.997 7.891
208 1HG LYS 28 2HG LYS 28 3.786 -13.732 9.767
209 2HG LYS 28 1HG LYS 28 2.843 -15.213 9.570
210 1HD LYS 28 2HD LYS 28 4.758 -16.537 10.300
211 2HD LYS 28 1HD LYS 28 5.718 -15.067 10.472
212 1HE LYS 28 2HE LYS 28 4.172 -14.263 12.185
213 2HE LYS 28 1HE LYS 28 3.212 -15.732 12.011
214 1HZ LYS 28 1HZ LYS 28 4.714 -15.854 13.903
215 2HZ LYS 28 2HZ LYS 28 6.049 -15.620 12.888
216 3HZ LYS 28 3HZ LYS 28 5.109 -17.026 12.743
217 H GLY 29 H GLY 29 7.232 -13.300 6.171
218 1HA GLY 29 2HA GLY 29 8.912 -14.374 4.843
219 2HA GLY 29 1HA GLY 29 8.022 -15.878 5.009
220 H GLY 30 H GLY 30 5.460 -15.020 4.288
221 1HA GLY 30 2HA GLY 30 5.887 -14.511 1.423
222 2HA GLY 30 1HA GLY 30 4.453 -15.241 2.136
223 H ASP 31 H ASP 31 5.752 -12.515 3.723
224 HA ASP 31 HA ASP 31 3.730 -10.767 2.485
225 1HB ASP 31 2HB ASP 31 4.533 -10.876 5.407
226 2HB ASP 31 1HB ASP 31 3.477 -9.660 4.704
227 H GLY 32 H GLY 32 4.782 -9.284 1.360
228 1HA GLY 32 2HA GLY 32 7.332 -8.245 2.362
229 2HA GLY 32 1HA GLY 32 6.654 -7.965 0.760
230 H ILE 33 H ILE 33 7.394 -6.407 3.497
231 HA ILE 33 HA ILE 33 4.929 -4.847 3.627
232 HB ILE 33 HB ILE 33 7.277 -5.063 5.496
233 1HG1 ILE 33 2HG1 ILE 33 5.441 -5.449 7.158
234 2HG1 ILE 33 1HG1 ILE 33 4.290 -5.391 5.833
235 1HG2 ILE 33 1HG2 ILE 33 6.336 -3.254 6.851
236 2HG2 ILE 33 2HG2 ILE 33 5.134 -2.944 5.599
237 3HG2 ILE 33 3HG2 ILE 33 6.847 -2.678 5.263
238 1HD1 ILE 33 1HD1 ILE 33 5.323 -7.352 4.838
239 2HD1 ILE 33 2HD1 ILE 33 4.795 -7.672 6.490
240 3HD1 ILE 33 3HD1 ILE 33 6.504 -7.398 6.148
241 H ALA 34 H ALA 34 4.968 -3.557 1.884
242 HA ALA 34 HA ALA 34 7.144 -1.591 1.749
243 1HB ALA 34 1HB ALA 34 4.769 -2.008 -0.069
244 2HB ALA 34 2HB ALA 34 6.414 -2.555 -0.389
245 3HB ALA 34 3HB ALA 34 6.059 -0.830 -0.312
246 H ARG 35 H ARG 35 6.509 0.658 1.561
247 HA ARG 35 HA ARG 35 4.018 1.347 2.779
248 1HB ARG 35 2HB ARG 35 5.098 2.466 4.711
249 2HB ARG 35 1HB ARG 35 5.122 0.730 4.778
250 1HG ARG 35 2HG ARG 35 7.463 0.750 4.080
251 2HG ARG 35 1HG ARG 35 7.421 2.516 4.025
252 1HD ARG 35 2HD ARG 35 6.847 2.576 6.398
253 2HD ARG 35 1HD ARG 35 6.886 0.816 6.454
254 HE ARG 35 HE ARG 35 9.358 1.421 5.555
255 1HH1 ARG 35 1HH1 ARG 35 7.467 2.601 8.261
256 2HH1 ARG 35 2HH1 ARG 35 8.854 2.872 9.274
257 1HH2 ARG 35 1HH2 ARG 35 11.175 1.777 6.865
258 2HH2 ARG 35 2HH2 ARG 35 10.979 2.443 8.464
259 H ILE 36 H ILE 36 3.362 3.111 1.900
260 HA ILE 36 HA ILE 36 5.288 4.728 0.419
261 HB ILE 36 HB ILE 36 2.297 4.421 0.180
262 1HG1 ILE 36 2HG1 ILE 36 4.633 3.745 -1.615
263 2HG1 ILE 36 1HG1 ILE 36 3.590 2.608 -0.766
264 1HG2 ILE 36 1HG2 ILE 36 2.863 6.759 -0.208
265 2HG2 ILE 36 2HG2 ILE 36 2.414 5.969 -1.721
266 3HG2 ILE 36 3HG2 ILE 36 4.113 6.284 -1.358
267 1HD1 ILE 36 1HD1 ILE 36 1.708 3.314 -2.127
268 2HD1 ILE 36 2HD1 ILE 36 3.044 2.730 -3.120
269 3HD1 ILE 36 3HD1 ILE 36 2.748 4.463 -2.966
270 H ASP 37 H ASP 37 6.017 6.407 1.387
271 HA ASP 37 HA ASP 37 6.273 8.219 2.725
272 1HB ASP 37 2HB ASP 37 4.362 8.904 1.117
273 2HB ASP 37 1HB ASP 37 3.313 8.707 2.516
274 H GLY 38 H GLY 38 5.620 5.648 3.945
275 1HA GLY 38 2HA GLY 38 5.780 5.274 6.308
276 2HA GLY 38 1HA GLY 38 4.763 6.684 6.561
277 H PHE 39 H PHE 39 3.043 5.671 4.287
278 HA PHE 39 HA PHE 39 1.151 4.304 5.943
279 1HB PHE 39 2HB PHE 39 0.530 5.971 4.202
280 2HB PHE 39 1HB PHE 39 1.084 4.851 2.968
281 HD1 PHE 39 1HD PHE 39 -1.494 5.520 5.481
282 HD2 PHE 39 2HD PHE 39 -0.232 2.988 2.303
283 HE1 PHE 39 1HE PHE 39 -3.748 4.546 5.363
284 HE2 PHE 39 2HE PHE 39 -2.479 2.008 2.192
285 HZ PHE 39 HZ PHE 39 -4.233 2.793 3.709
286 H VAL 40 H VAL 40 1.290 2.206 6.361
287 HA VAL 40 HA VAL 40 3.049 0.485 4.967
288 HB VAL 40 HB VAL 40 0.918 -0.278 6.965
289 1HG1 VAL 40 1HG1 VAL 40 3.437 -1.694 6.098
290 2HG1 VAL 40 2HG1 VAL 40 1.782 -2.190 5.742
291 3HG1 VAL 40 3HG1 VAL 40 2.372 -2.212 7.404
292 1HG2 VAL 40 1HG2 VAL 40 3.808 0.459 7.434
293 2HG2 VAL 40 2HG2 VAL 40 2.658 -0.080 8.659
294 3HG2 VAL 40 3HG2 VAL 40 2.415 1.463 7.837
295 H VAL 41 H VAL 41 2.745 -0.683 3.250
296 HA VAL 41 HA VAL 41 0.007 -1.372 2.408
297 HB VAL 41 HB VAL 41 2.352 -0.811 0.576
298 1HG1 VAL 41 1HG1 VAL 41 0.718 -2.324 -0.380
299 2HG1 VAL 41 2HG1 VAL 41 0.645 -0.753 -1.181
300 3HG1 VAL 41 3HG1 VAL 41 -0.582 -1.194 0.006
301 1HG2 VAL 41 1HG2 VAL 41 1.701 1.246 1.698
302 2HG2 VAL 41 2HG2 VAL 41 0.015 0.977 1.249
303 3HG2 VAL 41 3HG2 VAL 41 1.221 1.286 0.000
304 H PHE 42 H PHE 42 -0.227 -3.489 2.748
305 HA PHE 42 HA PHE 42 2.047 -5.233 2.961
306 1HB PHE 42 2HB PHE 42 -0.922 -5.716 3.180
307 2HB PHE 42 1HB PHE 42 0.272 -7.000 3.341
308 HD1 PHE 42 1HD PHE 42 -1.301 -4.146 4.924
309 HD2 PHE 42 2HD PHE 42 1.842 -6.997 5.227
310 HE1 PHE 42 1HE PHE 42 -1.039 -3.599 7.309
311 HE2 PHE 42 2HE PHE 42 2.108 -6.461 7.613
312 HZ PHE 42 HZ PHE 42 0.666 -4.758 8.657
313 H VAL 43 H VAL 43 2.951 -6.374 1.424
314 HA VAL 43 HA VAL 43 1.406 -6.898 -1.034
315 HB VAL 43 HB VAL 43 4.396 -6.671 -1.009
316 1HG1 VAL 43 1HG1 VAL 43 4.063 -6.103 -3.350
317 2HG1 VAL 43 2HG1 VAL 43 2.319 -6.218 -3.132
318 3HG1 VAL 43 3HG1 VAL 43 3.327 -7.653 -2.950
319 1HG2 VAL 43 1HG2 VAL 43 4.198 -4.313 -1.697
320 2HG2 VAL 43 2HG2 VAL 43 3.655 -4.582 -0.040
321 3HG2 VAL 43 3HG2 VAL 43 2.473 -4.370 -1.334
322 HA PRO 44 HA PRO 44 2.442 -10.997 0.652
323 1HB PRO 44 2HB PRO 44 0.487 -12.344 -0.640
324 2HB PRO 44 1HB PRO 44 0.185 -11.388 0.812
325 1HG PRO 44 2HG PRO 44 -0.291 -10.683 -2.053
326 2HG PRO 44 1HG PRO 44 -1.324 -10.386 -0.644
327 1HD PRO 44 2HD PRO 44 0.278 -8.480 -1.753
328 2HD PRO 44 1HD PRO 44 -0.156 -8.504 -0.033
329 H ASN 45 H ASN 45 2.895 -9.740 -2.380
330 HA ASN 45 HA ASN 45 3.875 -12.299 -3.459
331 1HB ASN 45 2HB ASN 45 2.613 -10.049 -5.040
332 2HB ASN 45 1HB ASN 45 3.247 -11.545 -5.707
333 1HD2 ASN 45 1HD2 ASN 45 2.165 -13.156 -3.497
334 2HD2 ASN 45 2HD2 ASN 45 0.470 -13.278 -3.818
335 H ALA 46 H ALA 46 4.955 -9.637 -2.151
336 HA ALA 46 HA ALA 46 6.779 -8.749 -4.239
337 1HB ALA 46 1HB ALA 46 5.651 -7.073 -2.884
338 2HB ALA 46 2HB ALA 46 7.400 -6.993 -2.682
339 3HB ALA 46 3HB ALA 46 6.400 -7.734 -1.433
340 H GLU 47 H GLU 47 9.015 -8.668 -3.992
341 HA GLU 47 HA GLU 47 10.141 -10.681 -2.180
342 1HB GLU 47 2HB GLU 47 10.851 -9.702 -4.894
343 2HB GLU 47 1HB GLU 47 12.185 -10.133 -3.836
344 1HG GLU 47 2HG GLU 47 9.884 -11.971 -4.429
345 2HG GLU 47 1HG GLU 47 11.386 -11.948 -5.355
346 H LYS 48 H LYS 48 11.638 -10.132 -0.688
347 HA LYS 48 HA LYS 48 11.860 -7.430 0.106
348 1HB LYS 48 2HB LYS 48 11.980 -9.204 1.737
349 2HB LYS 48 1HB LYS 48 13.381 -9.905 0.943
350 1HG LYS 48 2HG LYS 48 13.600 -7.117 1.946
351 2HG LYS 48 1HG LYS 48 13.593 -8.435 3.122
352 1HD LYS 48 2HD LYS 48 15.465 -9.481 2.031
353 2HD LYS 48 1HD LYS 48 15.431 -8.281 0.739
354 1HE LYS 48 2HE LYS 48 15.933 -6.527 2.405
355 2HE LYS 48 1HE LYS 48 16.048 -7.775 3.647
356 1HZ LYS 48 1HZ LYS 48 18.217 -7.081 2.700
357 2HZ LYS 48 2HZ LYS 48 17.732 -7.717 1.201
358 3HZ LYS 48 3HZ LYS 48 17.906 -8.741 2.538
359 H GLY 49 H GLY 49 13.389 -5.926 -0.221
360 1HA GLY 49 2HA GLY 49 15.277 -4.900 -1.046
361 2HA GLY 49 1HA GLY 49 16.000 -6.492 -1.196
362 H SER 50 H SER 50 12.981 -5.892 -2.758
363 HA SER 50 HA SER 50 14.374 -5.655 -5.339
364 1HB SER 50 2HB SER 50 13.344 -7.910 -4.959
365 2HB SER 50 1HB SER 50 11.772 -7.126 -4.822
366 HG SER 50 HG SER 50 11.899 -7.738 -6.910
367 H VAL 51 H VAL 51 13.453 -4.281 -6.862
368 HA VAL 51 HA VAL 51 11.601 -2.308 -5.775
369 HB VAL 51 HB VAL 51 13.035 -2.303 -8.441
370 1HG1 VAL 51 1HG1 VAL 51 11.527 -0.129 -6.988
371 2HG1 VAL 51 2HG1 VAL 51 11.036 -0.933 -8.479
372 3HG1 VAL 51 3HG1 VAL 51 12.468 0.096 -8.463
373 1HG2 VAL 51 1HG2 VAL 51 14.624 -2.226 -6.602
374 2HG2 VAL 51 2HG2 VAL 51 13.731 -0.897 -5.865
375 3HG2 VAL 51 3HG2 VAL 51 14.543 -0.662 -7.411
376 H ILE 52 H ILE 52 9.566 -2.988 -5.866
377 HA ILE 52 HA ILE 52 8.624 -4.202 -8.375
378 HB ILE 52 HB ILE 52 8.471 -5.966 -6.938
379 1HG1 ILE 52 2HG1 ILE 52 5.814 -4.578 -6.544
380 2HG1 ILE 52 1HG1 ILE 52 6.253 -5.632 -7.886
381 1HG2 ILE 52 1HG2 ILE 52 9.228 -4.861 -4.932
382 2HG2 ILE 52 2HG2 ILE 52 7.811 -5.845 -4.568
383 3HG2 ILE 52 3HG2 ILE 52 7.653 -4.096 -4.727
384 1HD1 ILE 52 1HD1 ILE 52 4.845 -6.727 -6.212
385 2HD1 ILE 52 2HD1 ILE 52 6.108 -6.478 -5.007
386 3HD1 ILE 52 3HD1 ILE 52 6.410 -7.514 -6.402
387 H ASN 53 H ASN 53 6.776 -3.527 -9.221
388 HA ASN 53 HA ASN 53 5.563 -1.167 -7.998
389 1HB ASN 53 2HB ASN 53 4.581 -0.673 -10.163
390 2HB ASN 53 1HB ASN 53 6.316 -0.891 -10.322
391 1HD2 ASN 53 1HD2 ASN 53 3.256 -1.875 -11.326
392 2HD2 ASN 53 2HD2 ASN 53 3.750 -3.150 -12.376
393 H VAL 54 H VAL 54 3.785 -1.365 -6.918
394 HA VAL 54 HA VAL 54 2.260 -3.860 -7.240
395 HB VAL 54 HB VAL 54 1.592 -3.606 -4.888
396 1HG1 VAL 54 1HG1 VAL 54 4.574 -3.547 -5.333
397 2HG1 VAL 54 2HG1 VAL 54 3.533 -4.966 -5.457
398 3HG1 VAL 54 3HG1 VAL 54 3.760 -4.171 -3.899
399 1HG2 VAL 54 1HG2 VAL 54 2.742 -1.968 -3.457
400 2HG2 VAL 54 2HG2 VAL 54 1.744 -1.183 -4.682
401 3HG2 VAL 54 3HG2 VAL 54 3.494 -1.261 -4.887
402 H LYS 55 H LYS 55 0.094 -3.830 -7.404
403 HA LYS 55 HA LYS 55 -1.166 -1.231 -7.871
404 1HB LYS 55 2HB LYS 55 -1.389 -3.130 -9.517
405 2HB LYS 55 1HB LYS 55 -2.297 -4.005 -8.292
406 1HG LYS 55 2HG LYS 55 -3.842 -1.945 -8.284
407 2HG LYS 55 1HG LYS 55 -3.073 -1.560 -9.826
408 1HD LYS 55 2HD LYS 55 -4.594 -4.062 -9.113
409 2HD LYS 55 1HD LYS 55 -5.070 -2.818 -10.269
410 1HE LYS 55 2HE LYS 55 -3.378 -3.445 -11.789
411 2HE LYS 55 1HE LYS 55 -2.540 -4.413 -10.576
412 1HZ LYS 55 1HZ LYS 55 -3.699 -5.866 -12.055
413 2HZ LYS 55 2HZ LYS 55 -5.153 -5.019 -11.846
414 3HZ LYS 55 3HZ LYS 55 -4.491 -5.904 -10.554
415 H VAL 56 H VAL 56 -1.957 -0.319 -6.052
416 HA VAL 56 HA VAL 56 -2.708 -1.839 -3.754
417 HB VAL 56 HB VAL 56 -3.313 1.060 -4.391
418 1HG1 VAL 56 1HG1 VAL 56 -3.378 -0.423 -1.765
419 2HG1 VAL 56 2HG1 VAL 56 -4.777 0.170 -2.658
420 3HG1 VAL 56 3HG1 VAL 56 -3.619 1.310 -1.974
421 1HG2 VAL 56 1HG2 VAL 56 -1.363 1.599 -3.052
422 2HG2 VAL 56 2HG2 VAL 56 -0.900 0.536 -4.381
423 3HG2 VAL 56 3HG2 VAL 56 -1.066 -0.113 -2.748
424 H THR 57 H THR 57 -4.509 -3.003 -3.602
425 HA THR 57 HA THR 57 -6.774 -2.264 -5.331
426 HB THR 57 HB THR 57 -7.346 -4.786 -4.927
427 HG1 THR 57 1HG THR 57 -4.573 -5.123 -4.843
428 1HG2 THR 57 1HG2 THR 57 -6.787 -3.827 -7.104
429 2HG2 THR 57 2HG2 THR 57 -6.009 -5.398 -6.898
430 3HG2 THR 57 3HG2 THR 57 -5.071 -3.915 -6.713
431 H ALA 58 H ALA 58 -5.828 -2.540 -2.079
432 HA ALA 58 HA ALA 58 -8.595 -2.304 -1.216
433 1HB ALA 58 1HB ALA 58 -8.406 -4.036 0.479
434 2HB ALA 58 2HB ALA 58 -6.766 -4.406 -0.056
435 3HB ALA 58 3HB ALA 58 -8.134 -4.718 -1.125
436 H VAL 59 H VAL 59 -8.153 -0.213 -0.601
437 HA VAL 59 HA VAL 59 -6.075 0.302 1.370
438 HB VAL 59 HB VAL 59 -8.198 2.224 0.398
439 1HG1 VAL 59 1HG1 VAL 59 -5.514 2.675 1.697
440 2HG1 VAL 59 2HG1 VAL 59 -7.091 2.884 2.456
441 3HG1 VAL 59 3HG1 VAL 59 -6.609 3.939 1.127
442 1HG2 VAL 59 1HG2 VAL 59 -5.424 1.793 -0.706
443 2HG2 VAL 59 2HG2 VAL 59 -6.548 3.063 -1.187
444 3HG2 VAL 59 3HG2 VAL 59 -6.938 1.375 -1.508
445 H LYS 60 H LYS 60 -6.402 0.106 3.498
446 HA LYS 60 HA LYS 60 -9.183 0.032 4.459
447 1HB LYS 60 2HB LYS 60 -6.698 -1.198 5.671
448 2HB LYS 60 1HB LYS 60 -8.297 -1.239 6.398
449 1HG LYS 60 2HG LYS 60 -7.452 -2.539 3.822
450 2HG LYS 60 1HG LYS 60 -7.860 -3.337 5.342
451 1HD LYS 60 2HD LYS 60 -10.149 -2.327 5.144
452 2HD LYS 60 1HD LYS 60 -9.702 -1.801 3.519
453 1HE LYS 60 2HE LYS 60 -10.877 -3.843 3.271
454 2HE LYS 60 1HE LYS 60 -9.171 -4.211 3.012
455 1HZ LYS 60 1HZ LYS 60 -10.176 -5.872 4.420
456 2HZ LYS 60 2HZ LYS 60 -10.714 -4.688 5.503
457 3HZ LYS 60 3HZ LYS 60 -9.052 -4.979 5.328
458 H GLU 61 H GLU 61 -8.635 0.321 7.177
459 HA GLU 61 HA GLU 61 -8.713 3.119 7.398
460 1HB GLU 61 2HB GLU 61 -8.207 1.133 9.623
461 2HB GLU 61 1HB GLU 61 -8.793 2.778 9.804
462 1HG GLU 61 2HG GLU 61 -10.669 1.399 10.071
463 2HG GLU 61 1HG GLU 61 -10.808 2.070 8.448
464 H LYS 62 H LYS 62 -6.201 0.814 8.424
465 HA LYS 62 HA LYS 62 -4.443 3.105 8.999
466 1HB LYS 62 2HB LYS 62 -4.237 0.283 10.061
467 2HB LYS 62 1HB LYS 62 -3.300 1.676 10.584
468 1HG LYS 62 2HG LYS 62 -5.301 2.723 11.471
469 2HG LYS 62 1HG LYS 62 -6.282 1.370 10.900
470 1HD LYS 62 2HD LYS 62 -5.012 -0.142 12.367
471 2HD LYS 62 1HD LYS 62 -4.074 1.236 12.955
472 1HE LYS 62 2HE LYS 62 -6.181 2.274 13.742
473 2HE LYS 62 1HE LYS 62 -7.049 0.820 13.248
474 1HZ LYS 62 1HZ LYS 62 -5.798 -0.462 14.836
475 2HZ LYS 62 2HZ LYS 62 -6.510 0.852 15.628
476 3HZ LYS 62 3HZ LYS 62 -4.856 0.886 15.252
477 H PHE 63 H PHE 63 -4.830 0.405 6.951
478 HA PHE 63 HA PHE 63 -2.220 0.818 5.765
479 1HB PHE 63 2HB PHE 63 -1.766 -1.685 5.842
480 2HB PHE 63 1HB PHE 63 -1.574 -0.817 7.362
481 HD1 PHE 63 1HD PHE 63 -2.969 -1.276 9.231
482 HD2 PHE 63 2HD PHE 63 -3.721 -3.147 5.482
483 HE1 PHE 63 1HE PHE 63 -4.521 -2.839 10.328
484 HE2 PHE 63 2HE PHE 63 -5.277 -4.710 6.570
485 HZ PHE 63 HZ PHE 63 -5.678 -4.560 8.995
486 H ALA 64 H ALA 64 -1.989 -0.831 3.851
487 HA ALA 64 HA ALA 64 -4.617 -1.343 2.655
488 1HB ALA 64 1HB ALA 64 -2.378 0.095 1.241
489 2HB ALA 64 2HB ALA 64 -3.888 0.818 1.795
490 3HB ALA 64 3HB ALA 64 -3.907 -0.401 0.521
491 H PHE 65 H PHE 65 -4.429 -2.686 0.666
492 HA PHE 65 HA PHE 65 -2.150 -4.551 0.833
493 1HB PHE 65 2HB PHE 65 -5.007 -5.163 0.036
494 2HB PHE 65 1HB PHE 65 -3.680 -6.319 0.069
495 HD1 PHE 65 1HD PHE 65 -2.631 -6.895 2.266
496 HD2 PHE 65 2HD PHE 65 -6.237 -4.659 1.963
497 HE1 PHE 65 1HE PHE 65 -3.153 -7.429 4.608
498 HE2 PHE 65 2HE PHE 65 -6.766 -5.189 4.305
499 HZ PHE 65 HZ PHE 65 -5.226 -6.576 5.631
500 H ALA 66 H ALA 66 -1.077 -4.988 -1.023
501 HA ALA 66 HA ALA 66 -2.206 -3.958 -3.540
502 1HB ALA 66 1HB ALA 66 -0.627 -2.305 -2.684
503 2HB ALA 66 2HB ALA 66 -0.030 -3.057 -4.166
504 3HB ALA 66 3HB ALA 66 0.627 -3.544 -2.605
505 H GLU 67 H GLU 67 -1.358 -4.942 -5.458
506 HA GLU 67 HA GLU 67 -0.294 -7.640 -4.938
507 1HB GLU 67 2HB GLU 67 -1.406 -8.369 -6.976
508 2HB GLU 67 1HB GLU 67 -2.567 -7.615 -5.895
509 1HG GLU 67 2HG GLU 67 -2.605 -5.623 -7.205
510 2HG GLU 67 1HG GLU 67 -1.260 -6.189 -8.195
511 H ARG 68 H ARG 68 1.416 -8.384 -6.074
512 HA ARG 68 HA ARG 68 3.212 -6.633 -7.338
513 1HB ARG 68 2HB ARG 68 4.280 -8.445 -6.425
514 2HB ARG 68 1HB ARG 68 3.004 -9.564 -6.858
515 1HG ARG 68 2HG ARG 68 3.775 -9.525 -9.185
516 2HG ARG 68 1HG ARG 68 5.063 -8.410 -8.730
517 1HD ARG 68 2HD ARG 68 6.103 -10.032 -7.360
518 2HD ARG 68 1HD ARG 68 4.712 -11.112 -7.462
519 HE ARG 68 HE ARG 68 5.523 -10.809 -10.055
520 1HH1 ARG 68 1HH1 ARG 68 7.020 -11.921 -7.085
521 2HH1 ARG 68 2HH1 ARG 68 8.171 -12.944 -7.896
522 1HH2 ARG 68 1HH2 ARG 68 6.987 -12.168 -11.116
523 2HH2 ARG 68 2HH2 ARG 68 8.145 -13.091 -10.205
524 H VAL 69 H VAL 69 2.884 -5.704 -9.267
525 HA VAL 69 HA VAL 69 1.293 -6.993 -11.305
526 HB VAL 69 HB VAL 69 2.886 -4.473 -11.710
527 1HG1 VAL 69 1HG1 VAL 69 1.083 -3.907 -13.266
528 2HG1 VAL 69 2HG1 VAL 69 0.278 -5.429 -12.886
529 3HG1 VAL 69 3HG1 VAL 69 1.846 -5.440 -13.693
530 1HG2 VAL 69 1HG2 VAL 69 1.676 -4.141 -9.648
531 2HG2 VAL 69 2HG2 VAL 69 0.186 -4.726 -10.389
532 3HG2 VAL 69 3HG2 VAL 69 0.905 -3.210 -10.934
533 H LEU 70 H LEU 70 4.162 -7.683 -10.313
534 HA LEU 70 HA LEU 70 5.690 -7.612 -12.766
535 1HB LEU 70 2HB LEU 70 6.336 -8.865 -10.092
536 2HB LEU 70 1HB LEU 70 7.440 -8.768 -11.449
537 HG LEU 70 HG LEU 70 6.348 -6.461 -9.843
538 1HD1 LEU 70 1HD1 LEU 70 9.135 -7.566 -10.169
539 2HD1 LEU 70 2HD1 LEU 70 8.120 -7.697 -8.731
540 3HD1 LEU 70 3HD1 LEU 70 8.705 -6.118 -9.258
541 1HD2 LEU 70 1HD2 LEU 70 6.492 -5.859 -12.197
542 2HD2 LEU 70 2HD2 LEU 70 8.159 -6.435 -12.253
543 3HD2 LEU 70 3HD2 LEU 70 7.741 -5.039 -11.258
Start of MODEL 9
1 1H MET 1 1H MET 1 1.907 22.524 -1.947
2 2H MET 1 2H MET 1 1.319 22.303 -3.523
3 3H MET 1 3H MET 1 1.848 20.968 -2.617
4 HA MET 1 HA MET 1 -0.492 22.677 -1.986
5 1HB MET 1 2HB MET 1 -0.401 19.778 -2.851
6 2HB MET 1 1HB MET 1 -1.841 20.723 -2.517
7 1HG MET 1 2HG MET 1 -1.739 20.645 -4.828
8 2HG MET 1 1HG MET 1 -1.077 22.228 -4.431
9 1HE MET 1 1HE MET 1 -0.703 20.855 -7.276
10 2HE MET 1 2HE MET 1 1.001 21.186 -7.589
11 3HE MET 1 3HE MET 1 -0.021 22.429 -6.866
12 H ALA 2 H ALA 2 -1.929 21.158 -0.479
13 HA ALA 2 HA ALA 2 -2.263 20.127 1.507
14 1HB ALA 2 1HB ALA 2 -0.735 18.362 2.195
15 2HB ALA 2 2HB ALA 2 0.465 18.934 1.036
16 3HB ALA 2 3HB ALA 2 -1.064 18.270 0.464
17 H PHE 3 H PHE 3 -0.944 22.770 1.390
18 HA PHE 3 HA PHE 3 0.915 22.722 3.613
19 1HB PHE 3 2HB PHE 3 1.147 24.223 1.557
20 2HB PHE 3 1HB PHE 3 -0.150 25.191 2.249
21 HD1 PHE 3 1HD PHE 3 3.196 23.794 3.078
22 HD2 PHE 3 2HD PHE 3 0.370 26.909 3.715
23 HE1 PHE 3 1HE PHE 3 4.856 25.018 4.419
24 HE2 PHE 3 2HE PHE 3 2.021 28.138 5.061
25 HZ PHE 3 HZ PHE 3 4.269 27.194 5.413
26 H GLY 4 H GLY 4 -0.944 21.751 4.906
27 1HA GLY 4 2HA GLY 4 -1.719 22.331 7.077
28 2HA GLY 4 1HA GLY 4 -1.977 23.974 6.518
29 H LYS 5 H LYS 5 -3.699 24.131 4.730
30 HA LYS 5 HA LYS 5 -6.045 22.852 5.888
31 1HB LYS 5 2HB LYS 5 -6.051 25.274 5.813
32 2HB LYS 5 1HB LYS 5 -5.805 25.249 4.076
33 1HG LYS 5 2HG LYS 5 -7.982 24.265 3.745
34 2HG LYS 5 1HG LYS 5 -8.230 24.168 5.488
35 1HD LYS 5 2HD LYS 5 -9.418 26.083 4.719
36 2HD LYS 5 1HD LYS 5 -7.989 26.666 5.569
37 1HE LYS 5 2HE LYS 5 -8.011 26.303 2.588
38 2HE LYS 5 1HE LYS 5 -8.621 27.774 3.337
39 1HZ LYS 5 1HZ LYS 5 -6.328 28.025 2.665
40 2HZ LYS 5 2HZ LYS 5 -5.857 26.702 3.605
41 3HZ LYS 5 3HZ LYS 5 -6.441 28.107 4.353
42 HA PRO 6 HA PRO 6 -6.834 21.856 1.265
43 1HB PRO 6 2HB PRO 6 -4.329 22.277 -0.178
44 2HB PRO 6 1HB PRO 6 -5.933 22.936 -0.512
45 1HG PRO 6 2HG PRO 6 -3.915 24.489 0.368
46 2HG PRO 6 1HG PRO 6 -5.604 24.782 0.827
47 1HD PRO 6 2HD PRO 6 -3.443 23.386 2.380
48 2HD PRO 6 1HD PRO 6 -4.592 24.630 2.924
49 H ALA 7 H ALA 7 -6.597 19.867 0.250
50 HA ALA 7 HA ALA 7 -6.041 17.686 0.072
51 1HB ALA 7 1HB ALA 7 -3.228 18.663 0.537
52 2HB ALA 7 2HB ALA 7 -4.049 18.575 -1.022
53 3HB ALA 7 3HB ALA 7 -3.691 17.096 -0.130
54 H MET 8 H MET 8 -7.243 17.363 2.036
55 HA MET 8 HA MET 8 -5.641 16.880 4.442
56 1HB MET 8 2HB MET 8 -7.857 18.182 4.427
57 2HB MET 8 1HB MET 8 -8.634 16.624 4.186
58 1HG MET 8 2HG MET 8 -8.683 17.260 6.518
59 2HG MET 8 1HG MET 8 -7.691 15.821 6.285
60 1HE MET 8 1HE MET 8 -6.577 19.476 5.350
61 2HE MET 8 2HE MET 8 -5.904 20.035 6.882
62 3HE MET 8 3HE MET 8 -7.632 19.717 6.741
63 H LYS 9 H LYS 9 -5.535 15.196 2.054
64 HA LYS 9 HA LYS 9 -7.004 12.800 2.614
65 1HB LYS 9 2HB LYS 9 -4.810 13.396 0.626
66 2HB LYS 9 1HB LYS 9 -5.654 11.857 0.731
67 1HG LYS 9 2HG LYS 9 -7.764 12.972 0.231
68 2HG LYS 9 1HG LYS 9 -6.924 14.520 0.129
69 1HD LYS 9 2HD LYS 9 -5.635 13.732 -1.759
70 2HD LYS 9 1HD LYS 9 -6.350 12.126 -1.611
71 1HE LYS 9 2HE LYS 9 -8.560 13.070 -2.078
72 2HE LYS 9 1HE LYS 9 -7.839 14.671 -2.249
73 1HZ LYS 9 1HZ LYS 9 -7.161 12.321 -3.933
74 2HZ LYS 9 2HZ LYS 9 -6.594 13.910 -4.139
75 3HZ LYS 9 3HZ LYS 9 -8.231 13.551 -4.382
76 H ASN 10 H ASN 10 -6.470 11.836 4.453
77 HA ASN 10 HA ASN 10 -3.731 11.509 5.293
78 1HB ASN 10 2HB ASN 10 -4.727 10.289 7.206
79 2HB ASN 10 1HB ASN 10 -5.443 11.878 6.973
80 1HD2 ASN 10 1HD2 ASN 10 -5.958 8.463 6.876
81 2HD2 ASN 10 2HD2 ASN 10 -7.675 8.520 6.677
82 H VAL 11 H VAL 11 -4.205 10.365 2.781
83 HA VAL 11 HA VAL 11 -3.478 7.600 3.165
84 HB VAL 11 HB VAL 11 -6.080 8.303 1.771
85 1HG1 VAL 11 1HG1 VAL 11 -4.635 5.658 1.868
86 2HG1 VAL 11 2HG1 VAL 11 -4.829 6.687 0.449
87 3HG1 VAL 11 3HG1 VAL 11 -6.239 5.928 1.190
88 1HG2 VAL 11 1HG2 VAL 11 -7.107 6.707 3.321
89 2HG2 VAL 11 2HG2 VAL 11 -6.336 8.039 4.183
90 3HG2 VAL 11 3HG2 VAL 11 -5.546 6.464 4.104
91 HA PRO 12 HA PRO 12 -1.375 9.313 -0.448
92 1HB PRO 12 2HB PRO 12 0.455 7.082 -0.112
93 2HB PRO 12 1HB PRO 12 0.757 8.799 0.107
94 1HG PRO 12 2HG PRO 12 0.724 7.031 2.163
95 2HG PRO 12 1HG PRO 12 0.278 8.735 2.345
96 1HD PRO 12 2HD PRO 12 -1.488 6.334 2.079
97 2HD PRO 12 1HD PRO 12 -1.661 7.749 3.141
98 H VAL 13 H VAL 13 -2.048 5.926 0.123
99 HA VAL 13 HA VAL 13 -1.472 5.082 -2.536
100 HB VAL 13 HB VAL 13 -2.562 2.918 -1.728
101 1HG1 VAL 13 1HG1 VAL 13 -0.645 2.381 -0.277
102 2HG1 VAL 13 2HG1 VAL 13 -0.253 4.099 -0.186
103 3HG1 VAL 13 3HG1 VAL 13 -0.157 3.253 -1.730
104 1HG2 VAL 13 1HG2 VAL 13 -2.900 2.705 0.676
105 2HG2 VAL 13 2HG2 VAL 13 -3.963 3.948 0.015
106 3HG2 VAL 13 3HG2 VAL 13 -2.504 4.410 0.897
107 H GLU 14 H GLU 14 -2.752 4.948 -4.244
108 HA GLU 14 HA GLU 14 -5.601 5.575 -3.930
109 1HB GLU 14 2HB GLU 14 -3.772 6.669 -5.607
110 2HB GLU 14 1HB GLU 14 -4.383 5.375 -6.627
111 1HG GLU 14 2HG GLU 14 -6.021 7.545 -5.336
112 2HG GLU 14 1HG GLU 14 -5.555 7.459 -7.033
113 H ALA 15 H ALA 15 -6.980 3.914 -3.998
114 HA ALA 15 HA ALA 15 -6.129 1.265 -4.576
115 1HB ALA 15 1HB ALA 15 -7.893 1.738 -2.947
116 2HB ALA 15 2HB ALA 15 -8.453 0.632 -4.201
117 3HB ALA 15 3HB ALA 15 -8.933 2.328 -4.244
118 H GLY 16 H GLY 16 -5.640 0.646 -6.563
119 1HA GLY 16 2HA GLY 16 -6.866 -0.134 -8.614
120 2HA GLY 16 1HA GLY 16 -7.386 1.539 -8.769
121 H LYS 17 H LYS 17 -4.657 2.403 -7.779
122 HA LYS 17 HA LYS 17 -3.326 2.110 -10.382
123 1HB LYS 17 2HB LYS 17 -3.145 4.255 -8.279
124 2HB LYS 17 1HB LYS 17 -1.970 4.114 -9.579
125 1HG LYS 17 2HG LYS 17 -3.959 4.220 -11.165
126 2HG LYS 17 1HG LYS 17 -4.892 4.752 -9.765
127 1HD LYS 17 2HD LYS 17 -4.070 6.658 -11.065
128 2HD LYS 17 1HD LYS 17 -3.364 6.631 -9.449
129 1HE LYS 17 2HE LYS 17 -1.674 7.170 -11.124
130 2HE LYS 17 1HE LYS 17 -1.324 5.623 -10.354
131 1HZ LYS 17 1HZ LYS 17 -0.970 5.355 -12.666
132 2HZ LYS 17 2HZ LYS 17 -2.454 6.080 -13.064
133 3HZ LYS 17 3HZ LYS 17 -2.426 4.557 -12.319
134 H GLU 18 H GLU 18 -0.912 2.227 -10.303
135 HA GLU 18 HA GLU 18 0.058 0.527 -8.114
136 1HB GLU 18 2HB GLU 18 1.569 -0.537 -9.732
137 2HB GLU 18 1HB GLU 18 -0.115 -0.740 -10.181
138 1HG GLU 18 2HG GLU 18 1.676 1.355 -11.368
139 2HG GLU 18 1HG GLU 18 1.459 -0.248 -12.060
140 H TYR 19 H TYR 19 2.199 0.779 -7.440
141 HA TYR 19 HA TYR 19 3.642 3.164 -8.353
142 1HB TYR 19 2HB TYR 19 3.150 2.503 -5.435
143 2HB TYR 19 1HB TYR 19 4.103 3.848 -6.048
144 HD1 TYR 19 1HD TYR 19 0.725 2.553 -5.497
145 HD2 TYR 19 2HD TYR 19 3.022 5.829 -6.940
146 HE1 TYR 19 1HE TYR 19 -1.282 3.964 -5.457
147 HE2 TYR 19 2HE TYR 19 1.022 7.254 -6.903
148 HH TYR 19 HH TYR 19 -1.355 7.104 -6.906
149 H GLU 20 H GLU 20 5.888 2.972 -8.161
150 HA GLU 20 HA GLU 20 6.849 0.271 -7.701
151 1HB GLU 20 2HB GLU 20 7.730 1.513 -9.619
152 2HB GLU 20 1HB GLU 20 8.334 2.770 -8.545
153 1HG GLU 20 2HG GLU 20 9.796 1.106 -7.477
154 2HG GLU 20 1HG GLU 20 9.243 -0.095 -8.642
155 H VAL 21 H VAL 21 7.224 -0.344 -5.688
156 HA VAL 21 HA VAL 21 8.205 1.655 -3.746
157 HB VAL 21 HB VAL 21 6.862 0.519 -2.021
158 1HG1 VAL 21 1HG1 VAL 21 4.656 1.283 -2.762
159 2HG1 VAL 21 2HG1 VAL 21 5.246 1.385 -4.420
160 3HG1 VAL 21 3HG1 VAL 21 5.913 2.448 -3.181
161 1HG2 VAL 21 1HG2 VAL 21 5.785 -1.106 -4.328
162 2HG2 VAL 21 2HG2 VAL 21 5.168 -1.131 -2.676
163 3HG2 VAL 21 3HG2 VAL 21 6.799 -1.707 -3.017
164 H THR 22 H THR 22 9.226 0.604 -1.795
165 HA THR 22 HA THR 22 10.893 -1.631 -2.718
166 HB THR 22 HB THR 22 11.434 0.163 -0.345
167 HG1 THR 22 1HG THR 22 11.316 1.026 -2.732
168 1HG2 THR 22 1HG2 THR 22 12.673 -1.957 -0.405
169 2HG2 THR 22 2HG2 THR 22 13.743 -0.581 -0.667
170 3HG2 THR 22 3HG2 THR 22 13.241 -1.577 -2.033
171 H ILE 23 H ILE 23 11.288 -3.386 -1.355
172 HA ILE 23 HA ILE 23 9.187 -3.862 0.636
173 HB ILE 23 HB ILE 23 10.612 -5.967 -1.002
174 1HG1 ILE 23 2HG1 ILE 23 9.295 -4.511 -2.478
175 2HG1 ILE 23 1HG1 ILE 23 8.573 -6.109 -2.361
176 1HG2 ILE 23 1HG2 ILE 23 8.149 -6.073 0.737
177 2HG2 ILE 23 2HG2 ILE 23 9.723 -6.785 1.098
178 3HG2 ILE 23 3HG2 ILE 23 8.759 -7.405 -0.243
179 1HD1 ILE 23 1HD1 ILE 23 6.873 -4.391 -2.319
180 2HD1 ILE 23 2HD1 ILE 23 7.652 -3.623 -0.935
181 3HD1 ILE 23 3HD1 ILE 23 6.930 -5.222 -0.763
182 H GLU 24 H GLU 24 10.953 -2.613 1.700
183 HA GLU 24 HA GLU 24 13.447 -3.715 2.362
184 1HB GLU 24 2HB GLU 24 12.733 -1.312 2.570
185 2HB GLU 24 1HB GLU 24 11.824 -1.765 4.004
186 1HG GLU 24 2HG GLU 24 13.910 -0.792 4.660
187 2HG GLU 24 1HG GLU 24 13.920 -2.508 5.062
188 H ASP 25 H ASP 25 10.347 -4.599 3.415
189 HA ASP 25 HA ASP 25 11.433 -6.161 5.623
190 1HB ASP 25 2HB ASP 25 10.712 -3.920 6.534
191 2HB ASP 25 1HB ASP 25 9.075 -4.313 6.035
192 H MET 26 H MET 26 10.070 -7.921 6.246
193 HA MET 26 HA MET 26 7.737 -8.316 4.512
194 1HB MET 26 2HB MET 26 9.675 -10.497 5.285
195 2HB MET 26 1HB MET 26 8.266 -10.664 4.247
196 1HG MET 26 2HG MET 26 9.451 -8.870 2.797
197 2HG MET 26 1HG MET 26 10.889 -9.371 3.683
198 1HE MET 26 1HE MET 26 8.286 -10.216 0.971
199 2HE MET 26 2HE MET 26 7.724 -11.248 2.288
200 3HE MET 26 3HE MET 26 8.401 -11.970 0.825
201 H GLY 27 H GLY 27 6.154 -9.822 5.328
202 1HA GLY 27 2HA GLY 27 5.718 -9.286 8.136
203 2HA GLY 27 1HA GLY 27 4.573 -10.010 7.017
204 H LYS 28 H LYS 28 5.909 -12.203 6.104
205 HA LYS 28 HA LYS 28 7.008 -13.706 8.298
206 1HB LYS 28 2HB LYS 28 4.482 -13.611 8.668
207 2HB LYS 28 1HB LYS 28 4.343 -14.604 7.227
208 1HG LYS 28 2HG LYS 28 5.747 -16.321 8.332
209 2HG LYS 28 1HG LYS 28 5.731 -15.335 9.794
210 1HD LYS 28 2HD LYS 28 3.308 -15.517 9.910
211 2HD LYS 28 1HD LYS 28 3.293 -16.459 8.418
212 1HE LYS 28 2HE LYS 28 4.687 -18.170 9.535
213 2HE LYS 28 1HE LYS 28 4.579 -17.242 11.029
214 1HZ LYS 28 1HZ LYS 28 2.963 -19.043 10.970
215 2HZ LYS 28 2HZ LYS 28 2.277 -18.404 9.559
216 3HZ LYS 28 3HZ LYS 28 2.187 -17.536 11.009
217 H GLY 29 H GLY 29 7.337 -13.011 5.356
218 1HA GLY 29 2HA GLY 29 9.121 -14.457 4.371
219 2HA GLY 29 1HA GLY 29 7.984 -15.779 4.552
220 H GLY 30 H GLY 30 5.660 -14.690 3.563
221 1HA GLY 30 2HA GLY 30 6.408 -14.378 0.726
222 2HA GLY 30 1HA GLY 30 4.872 -14.997 1.314
223 H ASP 31 H ASP 31 4.450 -12.975 3.272
224 HA ASP 31 HA ASP 31 3.527 -10.843 1.542
225 1HB ASP 31 2HB ASP 31 2.410 -9.995 3.605
226 2HB ASP 31 1HB ASP 31 1.964 -11.651 3.207
227 H GLY 32 H GLY 32 4.384 -8.853 1.414
228 1HA GLY 32 2HA GLY 32 6.712 -8.300 3.142
229 2HA GLY 32 1HA GLY 32 6.622 -7.825 1.455
230 H ILE 33 H ILE 33 7.167 -6.054 3.596
231 HA ILE 33 HA ILE 33 4.710 -4.438 3.658
232 HB ILE 33 HB ILE 33 7.074 -4.515 5.530
233 1HG1 ILE 33 2HG1 ILE 33 5.188 -4.579 7.236
234 2HG1 ILE 33 1HG1 ILE 33 4.088 -4.808 5.882
235 1HG2 ILE 33 1HG2 ILE 33 6.109 -2.534 6.670
236 2HG2 ILE 33 2HG2 ILE 33 5.008 -2.331 5.306
237 3HG2 ILE 33 3HG2 ILE 33 6.750 -2.184 5.064
238 1HD1 ILE 33 1HD1 ILE 33 5.237 -6.879 5.304
239 2HD1 ILE 33 2HD1 ILE 33 4.624 -6.911 6.958
240 3HD1 ILE 33 3HD1 ILE 33 6.341 -6.641 6.658
241 H ALA 34 H ALA 34 4.749 -3.186 1.918
242 HA ALA 34 HA ALA 34 7.165 -1.720 1.194
243 1HB ALA 34 1HB ALA 34 5.733 -2.616 -0.574
244 2HB ALA 34 2HB ALA 34 5.809 -0.853 -0.642
245 3HB ALA 34 3HB ALA 34 4.385 -1.652 0.029
246 H ARG 35 H ARG 35 7.220 0.587 1.157
247 HA ARG 35 HA ARG 35 5.362 1.801 3.087
248 1HB ARG 35 2HB ARG 35 8.042 1.405 3.494
249 2HB ARG 35 1HB ARG 35 8.004 3.040 2.862
250 1HG ARG 35 2HG ARG 35 7.903 3.177 5.232
251 2HG ARG 35 1HG ARG 35 6.299 3.582 4.611
252 1HD ARG 35 2HD ARG 35 5.595 1.249 5.023
253 2HD ARG 35 1HD ARG 35 7.176 0.923 5.729
254 HE ARG 35 HE ARG 35 5.474 3.024 6.882
255 1HH1 ARG 35 1HH1 ARG 35 7.165 -0.038 7.172
256 2HH1 ARG 35 2HH1 ARG 35 6.820 -0.210 8.871
257 1HH2 ARG 35 1HH2 ARG 35 5.032 2.802 9.117
258 2HH2 ARG 35 2HH2 ARG 35 5.579 1.388 9.967
259 H ILE 36 H ILE 36 4.088 3.155 2.027
260 HA ILE 36 HA ILE 36 5.320 4.849 -0.044
261 HB ILE 36 HB ILE 36 2.414 4.125 0.329
262 1HG1 ILE 36 2HG1 ILE 36 4.450 3.515 -1.816
263 2HG1 ILE 36 1HG1 ILE 36 3.703 2.369 -0.708
264 1HG2 ILE 36 1HG2 ILE 36 2.645 6.470 -0.360
265 2HG2 ILE 36 2HG2 ILE 36 1.964 5.477 -1.648
266 3HG2 ILE 36 3HG2 ILE 36 3.655 5.966 -1.716
267 1HD1 ILE 36 1HD1 ILE 36 1.546 2.751 -1.756
268 2HD1 ILE 36 2HD1 ILE 36 2.747 2.230 -2.939
269 3HD1 ILE 36 3HD1 ILE 36 2.283 3.929 -2.841
270 H ASP 37 H ASP 37 5.974 6.610 0.828
271 HA ASP 37 HA ASP 37 6.126 8.517 2.070
272 1HB ASP 37 2HB ASP 37 4.087 8.927 0.572
273 2HB ASP 37 1HB ASP 37 3.110 8.583 1.995
274 H GLY 38 H GLY 38 6.114 6.091 3.537
275 1HA GLY 38 2HA GLY 38 6.344 5.795 5.864
276 2HA GLY 38 1HA GLY 38 5.222 7.119 6.128
277 H PHE 39 H PHE 39 3.495 5.690 3.994
278 HA PHE 39 HA PHE 39 1.817 4.432 5.956
279 1HB PHE 39 2HB PHE 39 0.894 5.864 4.153
280 2HB PHE 39 1HB PHE 39 1.438 4.690 2.962
281 HD1 PHE 39 1HD PHE 39 -0.823 5.169 5.845
282 HD2 PHE 39 2HD PHE 39 0.115 2.859 2.398
283 HE1 PHE 39 1HE PHE 39 -2.972 3.990 6.055
284 HE2 PHE 39 2HE PHE 39 -2.026 1.675 2.605
285 HZ PHE 39 HZ PHE 39 -3.568 2.244 4.430
286 H VAL 40 H VAL 40 1.219 2.298 6.052
287 HA VAL 40 HA VAL 40 3.264 0.479 5.093
288 HB VAL 40 HB VAL 40 0.911 -0.213 6.842
289 1HG1 VAL 40 1HG1 VAL 40 2.136 -2.099 5.896
290 2HG1 VAL 40 2HG1 VAL 40 2.385 -2.002 7.640
291 3HG1 VAL 40 3HG1 VAL 40 3.645 -1.452 6.535
292 1HG2 VAL 40 1HG2 VAL 40 3.615 0.775 7.739
293 2HG2 VAL 40 2HG2 VAL 40 2.282 0.266 8.780
294 3HG2 VAL 40 3HG2 VAL 40 2.125 1.716 7.783
295 H VAL 41 H VAL 41 3.011 -0.459 3.188
296 HA VAL 41 HA VAL 41 0.299 -1.220 2.342
297 HB VAL 41 HB VAL 41 2.764 -0.866 0.611
298 1HG1 VAL 41 1HG1 VAL 41 1.217 -1.064 -1.265
299 2HG1 VAL 41 2HG1 VAL 41 -0.113 -1.362 -0.145
300 3HG1 VAL 41 3HG1 VAL 41 1.210 -2.520 -0.271
301 1HG2 VAL 41 1HG2 VAL 41 0.346 0.915 0.945
302 2HG2 VAL 41 2HG2 VAL 41 1.645 1.150 -0.228
303 3HG2 VAL 41 3HG2 VAL 41 1.985 1.263 1.499
304 H PHE 42 H PHE 42 -0.081 -3.258 2.910
305 HA PHE 42 HA PHE 42 2.020 -5.206 3.135
306 1HB PHE 42 2HB PHE 42 -0.972 -5.341 3.432
307 2HB PHE 42 1HB PHE 42 0.034 -6.784 3.496
308 HD1 PHE 42 1HD PHE 42 -1.082 -3.824 5.260
309 HD2 PHE 42 2HD PHE 42 1.678 -7.062 5.300
310 HE1 PHE 42 1HE PHE 42 -0.658 -3.433 7.651
311 HE2 PHE 42 2HE PHE 42 2.103 -6.679 7.691
312 HZ PHE 42 HZ PHE 42 0.934 -4.858 8.872
313 H VAL 43 H VAL 43 2.823 -6.331 1.557
314 HA VAL 43 HA VAL 43 1.243 -6.618 -0.915
315 HB VAL 43 HB VAL 43 4.247 -6.495 -0.728
316 1HG1 VAL 43 1HG1 VAL 43 4.082 -6.038 -3.133
317 2HG1 VAL 43 2HG1 VAL 43 2.341 -6.280 -3.043
318 3HG1 VAL 43 3HG1 VAL 43 3.439 -7.618 -2.697
319 1HG2 VAL 43 1HG2 VAL 43 4.046 -4.195 -1.623
320 2HG2 VAL 43 2HG2 VAL 43 3.425 -4.366 0.019
321 3HG2 VAL 43 3HG2 VAL 43 2.307 -4.275 -1.344
322 HA PRO 44 HA PRO 44 1.633 -10.887 0.580
323 1HB PRO 44 2HB PRO 44 -0.206 -11.336 -1.693
324 2HB PRO 44 1HB PRO 44 -0.393 -11.766 0.009
325 1HG PRO 44 2HG PRO 44 -1.800 -9.771 -1.053
326 2HG PRO 44 1HG PRO 44 -1.145 -9.644 0.592
327 1HD PRO 44 2HD PRO 44 -0.097 -8.464 -1.960
328 2HD PRO 44 1HD PRO 44 -0.250 -7.715 -0.356
329 H ASN 45 H ASN 45 2.594 -9.579 -2.416
330 HA ASN 45 HA ASN 45 3.731 -12.175 -3.213
331 1HB ASN 45 2HB ASN 45 2.987 -10.177 -5.311
332 2HB ASN 45 1HB ASN 45 3.090 -11.930 -5.426
333 1HD2 ASN 45 1HD2 ASN 45 1.364 -13.186 -4.525
334 2HD2 ASN 45 2HD2 ASN 45 -0.217 -12.507 -4.406
335 H ALA 46 H ALA 46 4.717 -9.647 -1.837
336 HA ALA 46 HA ALA 46 6.388 -8.227 -3.585
337 1HB ALA 46 1HB ALA 46 6.449 -8.490 -0.595
338 2HB ALA 46 2HB ALA 46 5.609 -7.261 -1.539
339 3HB ALA 46 3HB ALA 46 7.369 -7.311 -1.528
340 H GLU 47 H GLU 47 8.615 -8.150 -3.719
341 HA GLU 47 HA GLU 47 10.056 -10.618 -3.077
342 1HB GLU 47 2HB GLU 47 10.458 -8.436 -5.113
343 2HB GLU 47 1HB GLU 47 11.747 -9.553 -4.703
344 1HG GLU 47 2HG GLU 47 9.073 -10.561 -5.576
345 2HG GLU 47 1HG GLU 47 10.275 -10.029 -6.754
346 H LYS 48 H LYS 48 11.432 -10.539 -1.405
347 HA LYS 48 HA LYS 48 11.773 -8.236 0.175
348 1HB LYS 48 2HB LYS 48 11.992 -10.613 0.955
349 2HB LYS 48 1HB LYS 48 13.549 -10.686 0.143
350 1HG LYS 48 2HG LYS 48 14.376 -8.881 1.577
351 2HG LYS 48 1HG LYS 48 12.817 -8.834 2.402
352 1HD LYS 48 2HD LYS 48 13.138 -11.179 3.087
353 2HD LYS 48 1HD LYS 48 14.721 -11.174 2.309
354 1HE LYS 48 2HE LYS 48 13.886 -9.352 4.563
355 2HE LYS 48 1HE LYS 48 14.843 -10.819 4.751
356 1HZ LYS 48 1HZ LYS 48 16.118 -8.674 4.655
357 2HZ LYS 48 2HZ LYS 48 15.695 -8.564 3.016
358 3HZ LYS 48 3HZ LYS 48 16.629 -9.873 3.569
359 H GLY 49 H GLY 49 13.050 -6.537 -0.063
360 1HA GLY 49 2HA GLY 49 15.084 -5.422 -0.386
361 2HA GLY 49 1HA GLY 49 15.716 -6.847 -1.198
362 H SER 50 H SER 50 13.454 -7.067 -3.016
363 HA SER 50 HA SER 50 14.455 -5.394 -5.086
364 1HB SER 50 2HB SER 50 11.929 -7.061 -5.065
365 2HB SER 50 1HB SER 50 12.789 -6.468 -6.486
366 HG SER 50 HG SER 50 14.358 -7.917 -6.181
367 H VAL 51 H VAL 51 13.241 -3.835 -6.305
368 HA VAL 51 HA VAL 51 11.316 -2.363 -4.645
369 HB VAL 51 HB VAL 51 12.768 -1.355 -7.102
370 1HG1 VAL 51 1HG1 VAL 51 10.713 -0.154 -6.560
371 2HG1 VAL 51 2HG1 VAL 51 12.129 0.858 -6.272
372 3HG1 VAL 51 3HG1 VAL 51 11.289 0.108 -4.914
373 1HG2 VAL 51 1HG2 VAL 51 14.258 -0.163 -5.567
374 2HG2 VAL 51 2HG2 VAL 51 14.403 -1.912 -5.393
375 3HG2 VAL 51 3HG2 VAL 51 13.499 -0.978 -4.200
376 H ILE 52 H ILE 52 9.469 -3.510 -5.112
377 HA ILE 52 HA ILE 52 8.932 -4.180 -7.897
378 HB ILE 52 HB ILE 52 7.682 -5.938 -7.208
379 1HG1 ILE 52 2HG1 ILE 52 6.749 -4.267 -4.872
380 2HG1 ILE 52 1HG1 ILE 52 5.826 -4.706 -6.306
381 1HG2 ILE 52 1HG2 ILE 52 9.723 -6.345 -6.039
382 2HG2 ILE 52 2HG2 ILE 52 8.387 -6.861 -5.000
383 3HG2 ILE 52 3HG2 ILE 52 9.215 -5.331 -4.688
384 1HD1 ILE 52 1HD1 ILE 52 6.658 -6.448 -4.023
385 2HD1 ILE 52 2HD1 ILE 52 6.119 -7.105 -5.565
386 3HD1 ILE 52 3HD1 ILE 52 5.036 -6.092 -4.616
387 H ASN 53 H ASN 53 7.153 -3.513 -9.003
388 HA ASN 53 HA ASN 53 5.812 -1.137 -8.067
389 1HB ASN 53 2HB ASN 53 6.513 -1.248 -10.392
390 2HB ASN 53 1HB ASN 53 5.586 -2.723 -10.637
391 1HD2 ASN 53 1HD2 ASN 53 3.400 -2.602 -10.946
392 2HD2 ASN 53 2HD2 ASN 53 2.569 -1.109 -11.204
393 H VAL 54 H VAL 54 4.127 -1.278 -6.766
394 HA VAL 54 HA VAL 54 2.486 -3.725 -6.825
395 HB VAL 54 HB VAL 54 1.729 -3.129 -4.581
396 1HG1 VAL 54 1HG1 VAL 54 3.826 -3.468 -3.374
397 2HG1 VAL 54 2HG1 VAL 54 4.724 -3.084 -4.844
398 3HG1 VAL 54 3HG1 VAL 54 3.699 -4.519 -4.785
399 1HG2 VAL 54 1HG2 VAL 54 2.788 -1.274 -3.344
400 2HG2 VAL 54 2HG2 VAL 54 1.816 -0.707 -4.703
401 3HG2 VAL 54 3HG2 VAL 54 3.576 -0.755 -4.834
402 H LYS 55 H LYS 55 0.352 -3.642 -7.289
403 HA LYS 55 HA LYS 55 -0.819 -0.974 -7.664
404 1HB LYS 55 2HB LYS 55 -0.945 -2.652 -9.563
405 2HB LYS 55 1HB LYS 55 -2.022 -3.604 -8.545
406 1HG LYS 55 2HG LYS 55 -3.559 -1.680 -8.424
407 2HG LYS 55 1HG LYS 55 -2.501 -0.789 -9.514
408 1HD LYS 55 2HD LYS 55 -4.289 -1.686 -10.809
409 2HD LYS 55 1HD LYS 55 -2.840 -2.614 -11.195
410 1HE LYS 55 2HE LYS 55 -3.553 -4.435 -9.841
411 2HE LYS 55 1HE LYS 55 -4.864 -3.484 -9.145
412 1HZ LYS 55 1HZ LYS 55 -4.665 -4.301 -11.998
413 2HZ LYS 55 2HZ LYS 55 -5.935 -3.423 -11.298
414 3HZ LYS 55 3HZ LYS 55 -5.659 -5.029 -10.827
415 H VAL 56 H VAL 56 -1.821 -0.253 -5.913
416 HA VAL 56 HA VAL 56 -2.618 -1.903 -3.758
417 HB VAL 56 HB VAL 56 -3.478 0.934 -4.356
418 1HG1 VAL 56 1HG1 VAL 56 -3.504 -0.622 -1.774
419 2HG1 VAL 56 2HG1 VAL 56 -4.919 -0.162 -2.721
420 3HG1 VAL 56 3HG1 VAL 56 -3.925 1.080 -1.959
421 1HG2 VAL 56 1HG2 VAL 56 -1.669 1.591 -2.845
422 2HG2 VAL 56 2HG2 VAL 56 -1.046 0.712 -4.240
423 3HG2 VAL 56 3HG2 VAL 56 -1.191 -0.096 -2.680
424 H THR 57 H THR 57 -4.335 -3.171 -3.624
425 HA THR 57 HA THR 57 -6.509 -2.743 -5.546
426 HB THR 57 HB THR 57 -7.059 -5.175 -4.938
427 HG1 THR 57 1HG THR 57 -4.585 -5.907 -4.345
428 1HG2 THR 57 1HG2 THR 57 -4.456 -4.532 -6.332
429 2HG2 THR 57 2HG2 THR 57 -6.057 -4.542 -7.071
430 3HG2 THR 57 3HG2 THR 57 -5.351 -6.045 -6.480
431 H ALA 58 H ALA 58 -5.824 -2.786 -2.153
432 HA ALA 58 HA ALA 58 -8.575 -2.194 -1.530
433 1HB ALA 58 1HB ALA 58 -7.272 -4.658 -0.384
434 2HB ALA 58 2HB ALA 58 -8.611 -4.632 -1.535
435 3HB ALA 58 3HB ALA 58 -8.835 -3.996 0.095
436 H VAL 59 H VAL 59 -8.024 -0.316 -0.605
437 HA VAL 59 HA VAL 59 -6.012 -0.204 1.489
438 HB VAL 59 HB VAL 59 -7.944 1.982 0.706
439 1HG1 VAL 59 1HG1 VAL 59 -6.799 2.309 2.836
440 2HG1 VAL 59 2HG1 VAL 59 -6.236 3.470 1.634
441 3HG1 VAL 59 3HG1 VAL 59 -5.242 2.072 2.047
442 1HG2 VAL 59 1HG2 VAL 59 -5.209 1.437 -0.435
443 2HG2 VAL 59 2HG2 VAL 59 -6.196 2.861 -0.761
444 3HG2 VAL 59 3HG2 VAL 59 -6.745 1.269 -1.287
445 H LYS 60 H LYS 60 -6.464 -0.654 3.562
446 HA LYS 60 HA LYS 60 -9.263 -0.555 4.436
447 1HB LYS 60 2HB LYS 60 -6.852 -2.007 5.504
448 2HB LYS 60 1HB LYS 60 -8.284 -1.771 6.496
449 1HG LYS 60 2HG LYS 60 -8.471 -3.921 5.556
450 2HG LYS 60 1HG LYS 60 -9.598 -2.900 4.666
451 1HD LYS 60 2HD LYS 60 -7.803 -2.624 2.927
452 2HD LYS 60 1HD LYS 60 -6.889 -3.868 3.778
453 1HE LYS 60 2HE LYS 60 -9.630 -4.184 2.556
454 2HE LYS 60 1HE LYS 60 -8.122 -4.822 1.907
455 1HZ LYS 60 1HZ LYS 60 -8.241 -5.784 4.472
456 2HZ LYS 60 2HZ LYS 60 -8.569 -6.649 3.052
457 3HZ LYS 60 3HZ LYS 60 -9.836 -5.914 3.907
458 H GLU 61 H GLU 61 -8.960 -0.224 7.136
459 HA GLU 61 HA GLU 61 -8.942 2.556 7.300
460 1HB GLU 61 2HB GLU 61 -8.648 0.576 9.561
461 2HB GLU 61 1HB GLU 61 -9.118 2.261 9.726
462 1HG GLU 61 2HG GLU 61 -10.658 0.037 8.428
463 2HG GLU 61 1HG GLU 61 -11.083 0.952 9.872
464 H LYS 62 H LYS 62 -6.429 0.254 8.376
465 HA LYS 62 HA LYS 62 -4.744 2.593 8.990
466 1HB LYS 62 2HB LYS 62 -4.620 -0.143 10.259
467 2HB LYS 62 1HB LYS 62 -3.661 1.260 10.708
468 1HG LYS 62 2HG LYS 62 -5.730 2.433 11.360
469 2HG LYS 62 1HG LYS 62 -6.647 0.973 10.979
470 1HD LYS 62 2HD LYS 62 -5.351 -0.258 12.670
471 2HD LYS 62 1HD LYS 62 -4.480 1.226 13.066
472 1HE LYS 62 2HE LYS 62 -7.438 0.724 13.367
473 2HE LYS 62 1HE LYS 62 -6.256 0.871 14.666
474 1HZ LYS 62 1HZ LYS 62 -7.492 2.916 14.398
475 2HZ LYS 62 2HZ LYS 62 -7.032 3.024 12.772
476 3HZ LYS 62 3HZ LYS 62 -5.867 3.171 13.987
477 H PHE 63 H PHE 63 -5.059 0.134 6.806
478 HA PHE 63 HA PHE 63 -2.384 0.388 5.848
479 1HB PHE 63 2HB PHE 63 -1.941 -2.133 5.998
480 2HB PHE 63 1HB PHE 63 -1.734 -1.191 7.470
481 HD1 PHE 63 1HD PHE 63 -3.076 -1.576 9.373
482 HD2 PHE 63 2HD PHE 63 -3.933 -3.585 5.726
483 HE1 PHE 63 1HE PHE 63 -4.616 -3.081 10.570
484 HE2 PHE 63 2HE PHE 63 -5.476 -5.090 6.910
485 HZ PHE 63 HZ PHE 63 -5.819 -4.843 9.334
486 H ALA 64 H ALA 64 -2.052 -0.721 3.827
487 HA ALA 64 HA ALA 64 -4.595 -1.443 2.515
488 1HB ALA 64 1HB ALA 64 -3.737 -0.411 0.464
489 2HB ALA 64 2HB ALA 64 -2.284 0.091 1.330
490 3HB ALA 64 3HB ALA 64 -3.854 0.758 1.780
491 H PHE 65 H PHE 65 -4.399 -2.894 0.697
492 HA PHE 65 HA PHE 65 -1.981 -4.571 0.807
493 1HB PHE 65 2HB PHE 65 -4.842 -5.354 0.209
494 2HB PHE 65 1HB PHE 65 -3.464 -6.420 -0.034
495 HD1 PHE 65 1HD PHE 65 -2.275 -7.375 1.847
496 HD2 PHE 65 2HD PHE 65 -5.634 -4.828 2.430
497 HE1 PHE 65 1HE PHE 65 -2.431 -8.128 4.185
498 HE2 PHE 65 2HE PHE 65 -5.798 -5.576 4.767
499 HZ PHE 65 HZ PHE 65 -4.195 -7.226 5.648
500 H ALA 66 H ALA 66 -0.951 -5.036 -1.078
501 HA ALA 66 HA ALA 66 -2.161 -4.094 -3.580
502 1HB ALA 66 1HB ALA 66 -0.745 -2.285 -2.708
503 2HB ALA 66 2HB ALA 66 -0.132 -2.942 -4.226
504 3HB ALA 66 3HB ALA 66 0.633 -3.386 -2.699
505 H GLU 67 H GLU 67 -1.268 -5.027 -5.479
506 HA GLU 67 HA GLU 67 -0.031 -7.641 -4.960
507 1HB GLU 67 2HB GLU 67 -0.880 -8.280 -7.179
508 2HB GLU 67 1HB GLU 67 -2.173 -7.727 -6.125
509 1HG GLU 67 2HG GLU 67 -2.278 -5.622 -7.245
510 2HG GLU 67 1HG GLU 67 -0.835 -5.991 -8.183
511 H ARG 68 H ARG 68 1.834 -8.273 -5.974
512 HA ARG 68 HA ARG 68 3.540 -6.313 -7.122
513 1HB ARG 68 2HB ARG 68 4.629 -8.075 -5.964
514 2HB ARG 68 1HB ARG 68 3.760 -9.314 -6.852
515 1HG ARG 68 2HG ARG 68 5.009 -8.900 -8.825
516 2HG ARG 68 1HG ARG 68 5.679 -7.409 -8.175
517 1HD ARG 68 2HD ARG 68 7.364 -9.121 -8.133
518 2HD ARG 68 1HD ARG 68 6.888 -8.739 -6.479
519 HE ARG 68 HE ARG 68 5.552 -10.804 -6.527
520 1HH1 ARG 68 1HH1 ARG 68 8.050 -10.430 -8.949
521 2HH1 ARG 68 2HH1 ARG 68 8.404 -12.128 -9.028
522 1HH2 ARG 68 1HH2 ARG 68 6.003 -13.045 -6.631
523 2HH2 ARG 68 2HH2 ARG 68 7.259 -13.610 -7.693
524 H VAL 69 H VAL 69 3.148 -5.452 -9.029
525 HA VAL 69 HA VAL 69 1.730 -6.876 -11.106
526 HB VAL 69 HB VAL 69 3.028 -4.168 -11.400
527 1HG1 VAL 69 1HG1 VAL 69 2.099 -5.157 -13.429
528 2HG1 VAL 69 2HG1 VAL 69 1.176 -3.741 -12.931
529 3HG1 VAL 69 3HG1 VAL 69 0.540 -5.357 -12.627
530 1HG2 VAL 69 1HG2 VAL 69 0.370 -4.784 -10.116
531 2HG2 VAL 69 2HG2 VAL 69 0.932 -3.176 -10.567
532 3HG2 VAL 69 3HG2 VAL 69 1.788 -4.093 -9.328
533 H LEU 70 H LEU 70 4.378 -7.851 -10.289
534 HA LEU 70 HA LEU 70 5.456 -8.230 -12.918
535 1HB LEU 70 2HB LEU 70 7.773 -7.591 -12.336
536 2HB LEU 70 1HB LEU 70 6.683 -6.226 -12.387
537 HG LEU 70 HG LEU 70 7.436 -7.538 -9.780
538 1HD1 LEU 70 1HD1 LEU 70 9.515 -6.887 -10.889
539 2HD1 LEU 70 2HD1 LEU 70 9.175 -5.832 -9.517
540 3HD1 LEU 70 3HD1 LEU 70 8.872 -5.267 -11.161
541 1HD2 LEU 70 1HD2 LEU 70 6.874 -5.330 -8.877
542 2HD2 LEU 70 2HD2 LEU 70 5.513 -6.056 -9.733
543 3HD2 LEU 70 3HD2 LEU 70 6.458 -4.778 -10.502
Start of MODEL 10
1 1H MET 1 1H MET 1 4.410 24.280 13.490
2 2H MET 1 2H MET 1 2.986 24.633 14.329
3 3H MET 1 3H MET 1 4.147 25.845 14.092
4 HA MET 1 HA MET 1 2.310 26.174 12.608
5 1HB MET 1 2HB MET 1 4.697 26.634 11.893
6 2HB MET 1 1HB MET 1 4.668 25.093 11.054
7 1HG MET 1 2HG MET 1 2.702 27.290 10.484
8 2HG MET 1 1HG MET 1 4.252 27.152 9.660
9 1HE MET 1 1HE MET 1 2.965 27.134 7.321
10 2HE MET 1 2HE MET 1 1.431 27.265 8.178
11 3HE MET 1 3HE MET 1 1.648 26.020 6.947
12 H ALA 2 H ALA 2 3.941 23.074 11.917
13 HA ALA 2 HA ALA 2 1.586 22.021 10.621
14 1HB ALA 2 1HB ALA 2 2.878 19.930 10.481
15 2HB ALA 2 2HB ALA 2 4.152 20.663 11.457
16 3HB ALA 2 3HB ALA 2 3.787 21.305 9.855
17 H PHE 3 H PHE 3 -0.089 21.240 11.722
18 HA PHE 3 HA PHE 3 0.131 20.975 14.590
19 1HB PHE 3 2HB PHE 3 -2.291 20.543 12.832
20 2HB PHE 3 1HB PHE 3 -2.283 20.799 14.575
21 HD1 PHE 3 1HD PHE 3 -2.460 22.340 11.373
22 HD2 PHE 3 2HD PHE 3 -1.402 23.036 15.436
23 HE1 PHE 3 1HE PHE 3 -2.666 24.765 11.007
24 HE2 PHE 3 2HE PHE 3 -1.605 25.462 15.078
25 HZ PHE 3 HZ PHE 3 -2.237 26.330 12.861
26 H GLY 4 H GLY 4 0.004 18.896 11.839
27 1HA GLY 4 2HA GLY 4 0.613 16.608 11.916
28 2HA GLY 4 1HA GLY 4 0.151 16.569 13.612
29 H LYS 5 H LYS 5 -2.349 18.056 12.861
30 HA LYS 5 HA LYS 5 -4.013 15.791 12.423
31 1HB LYS 5 2HB LYS 5 -4.660 18.731 12.589
32 2HB LYS 5 1HB LYS 5 -5.872 17.468 12.435
33 1HG LYS 5 2HG LYS 5 -5.186 16.508 14.550
34 2HG LYS 5 1HG LYS 5 -3.900 17.709 14.700
35 1HD LYS 5 2HD LYS 5 -6.821 18.416 14.483
36 2HD LYS 5 1HD LYS 5 -5.990 18.187 16.022
37 1HE LYS 5 2HE LYS 5 -4.461 19.993 15.497
38 2HE LYS 5 1HE LYS 5 -5.185 20.179 13.901
39 1HZ LYS 5 1HZ LYS 5 -6.661 20.555 16.448
40 2HZ LYS 5 2HZ LYS 5 -7.217 20.904 14.882
41 3HZ LYS 5 3HZ LYS 5 -5.963 21.824 15.559
42 HA PRO 6 HA PRO 6 -4.959 17.899 8.153
43 1HB PRO 6 2HB PRO 6 -2.532 19.523 7.684
44 2HB PRO 6 1HB PRO 6 -4.231 19.933 7.417
45 1HG PRO 6 2HG PRO 6 -2.889 21.038 9.429
46 2HG PRO 6 1HG PRO 6 -4.574 20.521 9.643
47 1HD PRO 6 2HD PRO 6 -2.056 19.102 10.454
48 2HD PRO 6 1HD PRO 6 -3.530 19.403 11.399
49 H ALA 7 H ALA 7 -4.387 17.033 6.175
50 HA ALA 7 HA ALA 7 -3.366 15.705 4.656
51 1HB ALA 7 1HB ALA 7 -0.829 16.066 6.238
52 2HB ALA 7 2HB ALA 7 -1.391 17.142 4.958
53 3HB ALA 7 3HB ALA 7 -0.973 15.469 4.584
54 H MET 8 H MET 8 -2.890 14.963 8.037
55 HA MET 8 HA MET 8 -2.398 12.160 7.538
56 1HB MET 8 2HB MET 8 -1.413 13.438 9.475
57 2HB MET 8 1HB MET 8 -3.024 13.512 10.171
58 1HG MET 8 2HG MET 8 -1.698 11.749 11.182
59 2HG MET 8 1HG MET 8 -3.087 11.086 10.320
60 1HE MET 8 1HE MET 8 -2.042 8.652 10.332
61 2HE MET 8 2HE MET 8 -0.679 9.279 11.259
62 3HE MET 8 3HE MET 8 -0.392 8.297 9.823
63 H LYS 9 H LYS 9 -4.892 13.588 6.718
64 HA LYS 9 HA LYS 9 -6.748 11.541 7.695
65 1HB LYS 9 2HB LYS 9 -7.056 13.935 8.713
66 2HB LYS 9 1HB LYS 9 -7.714 14.336 7.133
67 1HG LYS 9 2HG LYS 9 -9.619 13.798 8.286
68 2HG LYS 9 1HG LYS 9 -9.224 12.243 7.553
69 1HD LYS 9 2HD LYS 9 -8.531 13.092 10.370
70 2HD LYS 9 1HD LYS 9 -9.852 12.017 9.919
71 1HE LYS 9 2HE LYS 9 -8.285 10.384 9.076
72 2HE LYS 9 1HE LYS 9 -6.936 11.480 9.368
73 1HZ LYS 9 1HZ LYS 9 -8.631 10.104 11.368
74 2HZ LYS 9 2HZ LYS 9 -7.636 11.412 11.776
75 3HZ LYS 9 3HZ LYS 9 -6.953 9.990 11.158
76 H ASN 10 H ASN 10 -5.048 11.886 5.347
77 HA ASN 10 HA ASN 10 -7.048 11.810 3.240
78 1HB ASN 10 2HB ASN 10 -4.536 13.502 3.142
79 2HB ASN 10 1HB ASN 10 -5.599 13.198 1.773
80 1HD2 ASN 10 1HD2 ASN 10 -7.600 14.191 1.693
81 2HD2 ASN 10 2HD2 ASN 10 -8.007 15.538 2.703
82 H VAL 11 H VAL 11 -6.807 9.759 2.814
83 HA VAL 11 HA VAL 11 -4.885 7.935 2.816
84 HB VAL 11 HB VAL 11 -6.652 8.470 0.412
85 1HG1 VAL 11 1HG1 VAL 11 -4.797 6.925 -0.119
86 2HG1 VAL 11 2HG1 VAL 11 -6.373 6.139 -0.183
87 3HG1 VAL 11 3HG1 VAL 11 -5.314 5.883 1.207
88 1HG2 VAL 11 1HG2 VAL 11 -7.926 8.226 2.457
89 2HG2 VAL 11 2HG2 VAL 11 -7.067 6.734 2.842
90 3HG2 VAL 11 3HG2 VAL 11 -8.137 6.797 1.441
91 HA PRO 12 HA PRO 12 -1.573 10.058 0.602
92 1HB PRO 12 2HB PRO 12 0.424 8.494 1.497
93 2HB PRO 12 1HB PRO 12 -0.336 9.720 2.516
94 1HG PRO 12 2HG PRO 12 -0.816 6.769 2.434
95 2HG PRO 12 1HG PRO 12 -0.639 7.833 3.842
96 1HD PRO 12 2HD PRO 12 -3.052 7.002 2.902
97 2HD PRO 12 1HD PRO 12 -2.819 8.556 3.725
98 H VAL 13 H VAL 13 -2.935 7.097 0.138
99 HA VAL 13 HA VAL 13 -1.232 6.511 -2.184
100 HB VAL 13 HB VAL 13 -2.009 4.107 -1.882
101 1HG1 VAL 13 1HG1 VAL 13 -0.279 5.337 0.262
102 2HG1 VAL 13 2HG1 VAL 13 0.249 4.763 -1.322
103 3HG1 VAL 13 3HG1 VAL 13 -0.352 3.616 -0.123
104 1HG2 VAL 13 1HG2 VAL 13 -2.808 5.183 0.822
105 2HG2 VAL 13 2HG2 VAL 13 -2.690 3.471 0.407
106 3HG2 VAL 13 3HG2 VAL 13 -3.881 4.492 -0.399
107 H GLU 14 H GLU 14 -2.694 4.823 -3.575
108 HA GLU 14 HA GLU 14 -5.309 6.129 -3.925
109 1HB GLU 14 2HB GLU 14 -3.444 4.918 -5.979
110 2HB GLU 14 1HB GLU 14 -5.099 5.387 -6.330
111 1HG GLU 14 2HG GLU 14 -3.009 7.281 -5.304
112 2HG GLU 14 1HG GLU 14 -3.368 7.038 -7.011
113 H ALA 15 H ALA 15 -6.316 4.295 -5.734
114 HA ALA 15 HA ALA 15 -5.953 1.582 -4.853
115 1HB ALA 15 1HB ALA 15 -8.593 2.964 -4.349
116 2HB ALA 15 2HB ALA 15 -7.470 2.392 -3.115
117 3HB ALA 15 3HB ALA 15 -8.286 1.235 -4.166
118 H GLY 16 H GLY 16 -5.654 0.828 -6.815
119 1HA GLY 16 2HA GLY 16 -6.925 -0.002 -8.795
120 2HA GLY 16 1HA GLY 16 -7.508 1.649 -8.963
121 H LYS 17 H LYS 17 -4.685 2.462 -8.022
122 HA LYS 17 HA LYS 17 -3.523 2.437 -10.718
123 1HB LYS 17 2HB LYS 17 -2.839 4.227 -8.378
124 2HB LYS 17 1HB LYS 17 -2.245 4.389 -10.023
125 1HG LYS 17 2HG LYS 17 -4.624 4.742 -10.739
126 2HG LYS 17 1HG LYS 17 -5.044 4.825 -9.027
127 1HD LYS 17 2HD LYS 17 -3.425 6.679 -8.762
128 2HD LYS 17 1HD LYS 17 -3.124 6.628 -10.500
129 1HE LYS 17 2HE LYS 17 -5.744 7.244 -9.141
130 2HE LYS 17 1HE LYS 17 -4.703 8.389 -9.984
131 1HZ LYS 17 1HZ LYS 17 -6.421 7.822 -11.468
132 2HZ LYS 17 2HZ LYS 17 -6.280 6.163 -11.144
133 3HZ LYS 17 3HZ LYS 17 -5.060 6.959 -12.011
134 H GLU 18 H GLU 18 -1.114 2.399 -10.822
135 HA GLU 18 HA GLU 18 -0.064 0.464 -8.875
136 1HB GLU 18 2HB GLU 18 0.971 0.906 -11.675
137 2HB GLU 18 1HB GLU 18 1.389 -0.396 -10.575
138 1HG GLU 18 2HG GLU 18 -0.039 -1.482 -11.962
139 2HG GLU 18 1HG GLU 18 -1.173 -0.924 -10.733
140 H TYR 19 H TYR 19 1.893 0.776 -7.947
141 HA TYR 19 HA TYR 19 3.506 3.100 -8.759
142 1HB TYR 19 2HB TYR 19 2.884 2.238 -5.923
143 2HB TYR 19 1HB TYR 19 4.097 3.439 -6.356
144 HD1 TYR 19 1HD TYR 19 0.558 2.750 -5.942
145 HD2 TYR 19 2HD TYR 19 3.416 5.624 -7.235
146 HE1 TYR 19 1HE TYR 19 -1.161 4.486 -5.844
147 HE2 TYR 19 2HE TYR 19 1.703 7.381 -7.145
148 HH TYR 19 HH TYR 19 -0.738 7.571 -7.243
149 H GLU 20 H GLU 20 5.738 2.849 -7.478
150 HA GLU 20 HA GLU 20 6.494 0.006 -7.506
151 1HB GLU 20 2HB GLU 20 8.802 0.854 -8.233
152 2HB GLU 20 1HB GLU 20 7.529 0.822 -9.447
153 1HG GLU 20 2HG GLU 20 7.135 3.229 -8.970
154 2HG GLU 20 1HG GLU 20 8.571 3.204 -7.952
155 H VAL 21 H VAL 21 7.005 -0.620 -5.586
156 HA VAL 21 HA VAL 21 7.970 1.370 -3.634
157 HB VAL 21 HB VAL 21 6.845 0.005 -1.890
158 1HG1 VAL 21 1HG1 VAL 21 5.044 0.999 -4.098
159 2HG1 VAL 21 2HG1 VAL 21 5.728 1.967 -2.791
160 3HG1 VAL 21 3HG1 VAL 21 4.552 0.702 -2.431
161 1HG2 VAL 21 1HG2 VAL 21 5.206 -1.680 -2.551
162 2HG2 VAL 21 2HG2 VAL 21 6.823 -2.131 -3.086
163 3HG2 VAL 21 3HG2 VAL 21 5.664 -1.476 -4.240
164 H THR 22 H THR 22 8.959 0.184 -1.650
165 HA THR 22 HA THR 22 10.846 -1.832 -2.687
166 HB THR 22 HB THR 22 11.369 -0.028 -0.323
167 HG1 THR 22 1HG THR 22 11.077 0.816 -2.760
168 1HG2 THR 22 1HG2 THR 22 12.768 -2.040 -0.533
169 2HG2 THR 22 2HG2 THR 22 13.709 -0.570 -0.800
170 3HG2 THR 22 3HG2 THR 22 13.207 -1.560 -2.171
171 H ILE 23 H ILE 23 11.499 -3.484 -1.199
172 HA ILE 23 HA ILE 23 9.414 -4.103 0.769
173 HB ILE 23 HB ILE 23 11.020 -6.165 -0.741
174 1HG1 ILE 23 2HG1 ILE 23 9.736 -4.869 -2.374
175 2HG1 ILE 23 1HG1 ILE 23 9.047 -6.480 -2.187
176 1HG2 ILE 23 1HG2 ILE 23 8.446 -6.324 0.829
177 2HG2 ILE 23 2HG2 ILE 23 10.025 -6.916 1.348
178 3HG2 ILE 23 3HG2 ILE 23 9.209 -7.666 -0.024
179 1HD1 ILE 23 1HD1 ILE 23 7.990 -3.960 -0.924
180 2HD1 ILE 23 2HD1 ILE 23 7.289 -5.573 -0.770
181 3HD1 ILE 23 3HD1 ILE 23 7.323 -4.771 -2.340
182 H GLU 24 H GLU 24 11.108 -2.684 1.820
183 HA GLU 24 HA GLU 24 13.625 -3.699 2.590
184 1HB GLU 24 2HB GLU 24 11.845 -1.668 3.956
185 2HB GLU 24 1HB GLU 24 13.541 -1.937 4.332
186 1HG GLU 24 2HG GLU 24 12.609 -1.144 1.595
187 2HG GLU 24 1HG GLU 24 12.989 0.033 2.854
188 H ASP 25 H ASP 25 10.483 -4.545 3.589
189 HA ASP 25 HA ASP 25 11.537 -5.903 5.964
190 1HB ASP 25 2HB ASP 25 10.603 -3.725 6.660
191 2HB ASP 25 1HB ASP 25 9.064 -4.163 5.937
192 H MET 26 H MET 26 10.717 -7.880 6.287
193 HA MET 26 HA MET 26 8.363 -8.707 4.731
194 1HB MET 26 2HB MET 26 10.878 -10.121 5.500
195 2HB MET 26 1HB MET 26 9.400 -11.060 5.338
196 1HG MET 26 2HG MET 26 10.539 -9.277 3.203
197 2HG MET 26 1HG MET 26 10.779 -11.022 3.302
198 1HE MET 26 1HE MET 26 8.251 -10.338 0.314
199 2HE MET 26 2HE MET 26 9.807 -11.054 0.737
200 3HE MET 26 3HE MET 26 9.575 -9.310 0.871
201 H GLY 27 H GLY 27 6.688 -9.730 5.762
202 1HA GLY 27 2HA GLY 27 6.476 -9.550 8.599
203 2HA GLY 27 1HA GLY 27 5.365 -10.396 7.529
204 H LYS 28 H LYS 28 5.723 -12.595 7.079
205 HA LYS 28 HA LYS 28 8.144 -13.869 7.801
206 1HB LYS 28 2HB LYS 28 7.445 -15.264 9.551
207 2HB LYS 28 1HB LYS 28 6.866 -13.661 9.960
208 1HG LYS 28 2HG LYS 28 4.638 -14.221 9.278
209 2HG LYS 28 1HG LYS 28 5.175 -15.796 8.689
210 1HD LYS 28 2HD LYS 28 4.159 -16.118 10.831
211 2HD LYS 28 1HD LYS 28 5.900 -16.335 11.017
212 1HE LYS 28 2HE LYS 28 5.140 -15.036 12.861
213 2HE LYS 28 1HE LYS 28 6.029 -13.959 11.786
214 1HZ LYS 28 1HZ LYS 28 3.926 -13.014 12.639
215 2HZ LYS 28 2HZ LYS 28 3.070 -14.222 11.808
216 3HZ LYS 28 3HZ LYS 28 3.987 -13.083 10.947
217 H GLY 29 H GLY 29 4.990 -14.026 6.577
218 1HA GLY 29 2HA GLY 29 5.499 -16.664 5.389
219 2HA GLY 29 1HA GLY 29 3.912 -15.946 5.607
220 H GLY 30 H GLY 30 6.754 -14.369 4.205
221 1HA GLY 30 2HA GLY 30 7.245 -13.905 1.975
222 2HA GLY 30 1HA GLY 30 5.802 -14.788 1.504
223 H ASP 31 H ASP 31 4.658 -12.821 3.765
224 HA ASP 31 HA ASP 31 3.661 -10.904 1.847
225 1HB ASP 31 2HB ASP 31 2.401 -12.023 3.878
226 2HB ASP 31 1HB ASP 31 3.133 -10.712 4.795
227 H GLY 32 H GLY 32 4.660 -9.050 1.423
228 1HA GLY 32 2HA GLY 32 6.879 -8.276 3.182
229 2HA GLY 32 1HA GLY 32 6.699 -7.824 1.495
230 H ILE 33 H ILE 33 7.291 -6.116 3.717
231 HA ILE 33 HA ILE 33 4.859 -4.477 3.863
232 HB ILE 33 HB ILE 33 7.314 -4.574 5.610
233 1HG1 ILE 33 2HG1 ILE 33 5.512 -4.760 7.408
234 2HG1 ILE 33 1HG1 ILE 33 4.361 -4.998 6.098
235 1HG2 ILE 33 1HG2 ILE 33 6.375 -2.663 6.861
236 2HG2 ILE 33 2HG2 ILE 33 5.180 -2.450 5.579
237 3HG2 ILE 33 3HG2 ILE 33 6.901 -2.243 5.228
238 1HD1 ILE 33 1HD1 ILE 33 5.565 -6.994 5.399
239 2HD1 ILE 33 2HD1 ILE 33 5.053 -7.109 7.083
240 3HD1 ILE 33 3HD1 ILE 33 6.734 -6.748 6.693
241 H ALA 34 H ALA 34 4.765 -2.988 2.352
242 HA ALA 34 HA ALA 34 7.233 -1.610 1.535
243 1HB ALA 34 1HB ALA 34 5.936 -0.863 -0.426
244 2HB ALA 34 2HB ALA 34 4.544 -1.771 0.170
245 3HB ALA 34 3HB ALA 34 6.015 -2.621 -0.307
246 H ARG 35 H ARG 35 6.995 0.757 1.131
247 HA ARG 35 HA ARG 35 5.147 1.961 3.087
248 1HB ARG 35 2HB ARG 35 7.815 1.642 3.546
249 2HB ARG 35 1HB ARG 35 7.784 3.232 2.811
250 1HG ARG 35 2HG ARG 35 7.676 3.527 5.156
251 2HG ARG 35 1HG ARG 35 6.073 3.890 4.511
252 1HD ARG 35 2HD ARG 35 5.240 1.757 5.197
253 2HD ARG 35 1HD ARG 35 6.857 1.210 5.638
254 HE ARG 35 HE ARG 35 5.481 3.403 7.056
255 1HH1 ARG 35 1HH1 ARG 35 7.356 0.443 7.043
256 2HH1 ARG 35 2HH1 ARG 35 7.538 0.401 8.773
257 1HH2 ARG 35 1HH2 ARG 35 5.766 3.374 9.335
258 2HH2 ARG 35 2HH2 ARG 35 6.638 2.057 10.068
259 H ILE 36 H ILE 36 3.995 3.571 2.239
260 HA ILE 36 HA ILE 36 5.276 5.242 0.182
261 HB ILE 36 HB ILE 36 2.371 4.414 0.264
262 1HG1 ILE 36 2HG1 ILE 36 4.564 4.008 -1.778
263 2HG1 ILE 36 1HG1 ILE 36 3.854 2.767 -0.751
264 1HG2 ILE 36 1HG2 ILE 36 2.092 5.849 -1.719
265 2HG2 ILE 36 2HG2 ILE 36 3.742 6.433 -1.512
266 3HG2 ILE 36 3HG2 ILE 36 2.524 6.777 -0.284
267 1HD1 ILE 36 1HD1 ILE 36 1.711 3.072 -1.870
268 2HD1 ILE 36 2HD1 ILE 36 2.987 2.653 -3.012
269 3HD1 ILE 36 3HD1 ILE 36 2.427 4.321 -2.887
270 H ASP 37 H ASP 37 5.711 7.088 1.052
271 HA ASP 37 HA ASP 37 5.701 8.927 2.387
272 1HB ASP 37 2HB ASP 37 2.752 8.547 1.933
273 2HB ASP 37 1HB ASP 37 3.369 9.880 2.903
274 H GLY 38 H GLY 38 5.619 6.205 3.644
275 1HA GLY 38 2HA GLY 38 6.016 5.793 5.958
276 2HA GLY 38 1HA GLY 38 4.936 7.126 6.351
277 H PHE 39 H PHE 39 3.242 5.782 4.083
278 HA PHE 39 HA PHE 39 1.455 4.458 5.895
279 1HB PHE 39 2HB PHE 39 0.760 5.932 3.967
280 2HB PHE 39 1HB PHE 39 1.299 4.663 2.881
281 HD1 PHE 39 1HD PHE 39 -0.040 2.780 2.432
282 HD2 PHE 39 2HD PHE 39 -1.169 5.562 5.446
283 HE1 PHE 39 1HE PHE 39 -2.275 1.773 2.523
284 HE2 PHE 39 2HE PHE 39 -3.407 4.556 5.542
285 HZ PHE 39 HZ PHE 39 -3.958 2.663 4.075
286 H VAL 40 H VAL 40 0.995 2.296 6.001
287 HA VAL 40 HA VAL 40 3.130 0.571 5.048
288 HB VAL 40 HB VAL 40 0.828 -0.128 6.876
289 1HG1 VAL 40 1HG1 VAL 40 1.915 -2.056 5.846
290 2HG1 VAL 40 2HG1 VAL 40 2.265 -1.981 7.574
291 3HG1 VAL 40 3HG1 VAL 40 3.486 -1.479 6.404
292 1HG2 VAL 40 1HG2 VAL 40 3.617 0.774 7.589
293 2HG2 VAL 40 2HG2 VAL 40 2.377 0.241 8.724
294 3HG2 VAL 40 3HG2 VAL 40 2.144 1.721 7.789
295 H VAL 41 H VAL 41 2.929 -0.405 3.172
296 HA VAL 41 HA VAL 41 0.246 -1.276 2.312
297 HB VAL 41 HB VAL 41 2.617 -0.662 0.532
298 1HG1 VAL 41 1HG1 VAL 41 0.954 -0.718 -1.279
299 2HG1 VAL 41 2HG1 VAL 41 -0.274 -1.216 -0.115
300 3HG1 VAL 41 3HG1 VAL 41 1.099 -2.271 -0.456
301 1HG2 VAL 41 1HG2 VAL 41 1.803 1.377 1.603
302 2HG2 VAL 41 2HG2 VAL 41 0.163 1.008 1.067
303 3HG2 VAL 41 3HG2 VAL 41 1.419 1.365 -0.119
304 H PHE 42 H PHE 42 -0.032 -3.407 2.374
305 HA PHE 42 HA PHE 42 2.274 -5.143 2.716
306 1HB PHE 42 2HB PHE 42 -0.698 -5.652 2.899
307 2HB PHE 42 1HB PHE 42 0.515 -6.913 3.094
308 HD1 PHE 42 1HD PHE 42 2.079 -6.824 5.010
309 HD2 PHE 42 2HD PHE 42 -1.199 -4.136 4.635
310 HE1 PHE 42 1HE PHE 42 2.261 -6.275 7.400
311 HE2 PHE 42 2HE PHE 42 -1.026 -3.584 7.025
312 HZ PHE 42 HZ PHE 42 0.706 -4.654 8.411
313 H VAL 43 H VAL 43 2.858 -6.785 1.378
314 HA VAL 43 HA VAL 43 1.426 -7.101 -1.156
315 HB VAL 43 HB VAL 43 3.788 -7.191 -2.257
316 1HG1 VAL 43 1HG1 VAL 43 2.529 -4.574 -1.442
317 2HG1 VAL 43 2HG1 VAL 43 2.034 -5.579 -2.805
318 3HG1 VAL 43 3HG1 VAL 43 3.624 -4.818 -2.803
319 1HG2 VAL 43 1HG2 VAL 43 5.396 -5.632 -1.268
320 2HG2 VAL 43 2HG2 VAL 43 5.063 -6.975 -0.173
321 3HG2 VAL 43 3HG2 VAL 43 4.327 -5.399 0.116
322 HA PRO 44 HA PRO 44 2.221 -11.145 0.593
323 1HB PRO 44 2HB PRO 44 0.166 -12.154 -1.165
324 2HB PRO 44 1HB PRO 44 0.107 -11.917 0.582
325 1HG PRO 44 2HG PRO 44 -1.351 -10.445 -1.209
326 2HG PRO 44 1HG PRO 44 -0.867 -9.862 0.394
327 1HD PRO 44 2HD PRO 44 0.347 -9.288 -2.284
328 2HD PRO 44 1HD PRO 44 0.086 -8.199 -0.906
329 H ASN 45 H ASN 45 3.039 -10.129 -2.440
330 HA ASN 45 HA ASN 45 4.155 -12.762 -3.095
331 1HB ASN 45 2HB ASN 45 2.707 -10.969 -5.062
332 2HB ASN 45 1HB ASN 45 3.669 -12.369 -5.519
333 1HD2 ASN 45 1HD2 ASN 45 0.678 -11.251 -4.273
334 2HD2 ASN 45 2HD2 ASN 45 -0.117 -12.787 -4.169
335 H ALA 46 H ALA 46 5.173 -10.246 -1.944
336 HA ALA 46 HA ALA 46 6.895 -9.132 -3.984
337 1HB ALA 46 1HB ALA 46 7.685 -7.665 -2.212
338 2HB ALA 46 2HB ALA 46 6.772 -8.596 -1.025
339 3HB ALA 46 3HB ALA 46 5.922 -7.687 -2.276
340 H GLU 47 H GLU 47 9.219 -8.993 -3.676
341 HA GLU 47 HA GLU 47 10.367 -11.208 -2.135
342 1HB GLU 47 2HB GLU 47 11.317 -9.869 -4.672
343 2HB GLU 47 1HB GLU 47 12.277 -11.007 -3.748
344 1HG GLU 47 2HG GLU 47 10.642 -12.749 -4.125
345 2HG GLU 47 1HG GLU 47 9.601 -11.610 -4.976
346 H LYS 48 H LYS 48 11.944 -10.718 -0.675
347 HA LYS 48 HA LYS 48 11.917 -8.073 0.337
348 1HB LYS 48 2HB LYS 48 12.168 -9.978 1.818
349 2HB LYS 48 1HB LYS 48 13.678 -10.429 1.036
350 1HG LYS 48 2HG LYS 48 14.778 -8.487 1.887
351 2HG LYS 48 1HG LYS 48 13.259 -7.830 2.496
352 1HD LYS 48 2HD LYS 48 14.622 -8.813 4.286
353 2HD LYS 48 1HD LYS 48 13.084 -9.653 4.092
354 1HE LYS 48 2HE LYS 48 14.909 -11.236 4.420
355 2HE LYS 48 1HE LYS 48 14.199 -11.412 2.818
356 1HZ LYS 48 1HZ LYS 48 16.033 -10.357 1.824
357 2HZ LYS 48 2HZ LYS 48 16.692 -11.451 2.938
358 3HZ LYS 48 3HZ LYS 48 16.636 -9.800 3.310
359 H GLY 49 H GLY 49 13.362 -6.446 0.277
360 1HA GLY 49 2HA GLY 49 15.209 -5.216 -0.312
361 2HA GLY 49 1HA GLY 49 16.047 -6.726 -0.622
362 H SER 50 H SER 50 13.075 -5.696 -2.187
363 HA SER 50 HA SER 50 14.560 -5.027 -4.613
364 1HB SER 50 2HB SER 50 12.303 -7.045 -4.518
365 2HB SER 50 1HB SER 50 13.099 -6.461 -5.980
366 HG SER 50 HG SER 50 14.850 -7.410 -4.103
367 H VAL 51 H VAL 51 13.222 -3.941 -6.228
368 HA VAL 51 HA VAL 51 11.018 -2.431 -5.014
369 HB VAL 51 HB VAL 51 12.494 -1.961 -7.619
370 1HG1 VAL 51 1HG1 VAL 51 11.346 0.215 -7.639
371 2HG1 VAL 51 2HG1 VAL 51 10.424 -0.271 -6.215
372 3HG1 VAL 51 3HG1 VAL 51 10.213 -1.135 -7.739
373 1HG2 VAL 51 1HG2 VAL 51 12.670 -0.506 -4.986
374 2HG2 VAL 51 2HG2 VAL 51 13.484 -0.035 -6.477
375 3HG2 VAL 51 3HG2 VAL 51 13.906 -1.552 -5.683
376 H ILE 52 H ILE 52 8.977 -2.993 -5.494
377 HA ILE 52 HA ILE 52 8.564 -4.574 -7.944
378 HB ILE 52 HB ILE 52 7.035 -6.013 -6.929
379 1HG1 ILE 52 2HG1 ILE 52 6.915 -4.094 -4.593
380 2HG1 ILE 52 1HG1 ILE 52 5.644 -4.407 -5.773
381 1HG2 ILE 52 1HG2 ILE 52 9.288 -6.545 -6.220
382 2HG2 ILE 52 2HG2 ILE 52 8.146 -6.923 -4.930
383 3HG2 ILE 52 3HG2 ILE 52 9.133 -5.466 -4.833
384 1HD1 ILE 52 1HD1 ILE 52 5.474 -6.705 -4.957
385 2HD1 ILE 52 2HD1 ILE 52 5.153 -5.518 -3.696
386 3HD1 ILE 52 3HD1 ILE 52 6.704 -6.355 -3.745
387 H ASN 53 H ASN 53 6.833 -4.067 -9.204
388 HA ASN 53 HA ASN 53 5.511 -1.560 -8.766
389 1HB ASN 53 2HB ASN 53 6.105 -2.552 -11.042
390 2HB ASN 53 1HB ASN 53 4.768 -3.673 -10.803
391 1HD2 ASN 53 1HD2 ASN 53 5.694 -0.483 -11.637
392 2HD2 ASN 53 2HD2 ASN 53 4.111 0.125 -11.969
393 H VAL 54 H VAL 54 3.552 -1.252 -7.806
394 HA VAL 54 HA VAL 54 2.003 -3.661 -7.119
395 HB VAL 54 HB VAL 54 1.450 -2.650 -4.929
396 1HG1 VAL 54 1HG1 VAL 54 4.372 -3.149 -5.417
397 2HG1 VAL 54 2HG1 VAL 54 3.140 -4.365 -5.070
398 3HG1 VAL 54 3HG1 VAL 54 3.579 -3.176 -3.844
399 1HG2 VAL 54 1HG2 VAL 54 1.907 -0.312 -5.417
400 2HG2 VAL 54 2HG2 VAL 54 3.623 -0.676 -5.612
401 3HG2 VAL 54 3HG2 VAL 54 2.859 -0.853 -4.032
402 H LYS 55 H LYS 55 -0.034 -3.563 -7.705
403 HA LYS 55 HA LYS 55 -1.288 -0.939 -8.053
404 1HB LYS 55 2HB LYS 55 -1.571 -2.580 -9.881
405 2HB LYS 55 1HB LYS 55 -2.314 -3.702 -8.751
406 1HG LYS 55 2HG LYS 55 -4.090 -1.960 -8.353
407 2HG LYS 55 1HG LYS 55 -3.400 -1.064 -9.707
408 1HD LYS 55 2HD LYS 55 -4.406 -3.903 -9.869
409 2HD LYS 55 1HD LYS 55 -5.346 -2.483 -10.329
410 1HE LYS 55 2HE LYS 55 -2.672 -3.150 -11.536
411 2HE LYS 55 1HE LYS 55 -4.196 -3.722 -12.208
412 1HZ LYS 55 1HZ LYS 55 -4.889 -1.418 -12.490
413 2HZ LYS 55 2HZ LYS 55 -3.441 -1.720 -13.315
414 3HZ LYS 55 3HZ LYS 55 -3.417 -0.870 -11.851
415 H VAL 56 H VAL 56 -1.861 -0.214 -6.065
416 HA VAL 56 HA VAL 56 -2.751 -1.874 -3.944
417 HB VAL 56 HB VAL 56 -3.226 1.092 -4.335
418 1HG1 VAL 56 1HG1 VAL 56 -4.752 0.117 -2.702
419 2HG1 VAL 56 2HG1 VAL 56 -3.563 1.153 -1.913
420 3HG1 VAL 56 3HG1 VAL 56 -3.388 -0.600 -1.843
421 1HG2 VAL 56 1HG2 VAL 56 -0.845 0.560 -4.328
422 2HG2 VAL 56 2HG2 VAL 56 -1.040 -0.353 -2.830
423 3HG2 VAL 56 3HG2 VAL 56 -1.297 1.392 -2.839
424 H THR 57 H THR 57 -4.543 -3.053 -4.081
425 HA THR 57 HA THR 57 -6.810 -1.949 -5.581
426 HB THR 57 HB THR 57 -7.519 -4.407 -5.692
427 HG1 THR 57 1HG THR 57 -5.333 -5.660 -5.660
428 1HG2 THR 57 1HG2 THR 57 -4.998 -3.530 -7.106
429 2HG2 THR 57 2HG2 THR 57 -6.646 -3.164 -7.612
430 3HG2 THR 57 3HG2 THR 57 -6.072 -4.831 -7.621
431 H ALA 58 H ALA 58 -5.827 -2.735 -2.434
432 HA ALA 58 HA ALA 58 -8.587 -2.595 -1.515
433 1HB ALA 58 1HB ALA 58 -8.321 -4.508 -0.020
434 2HB ALA 58 2HB ALA 58 -6.713 -4.804 -0.683
435 3HB ALA 58 3HB ALA 58 -8.137 -4.982 -1.710
436 H VAL 59 H VAL 59 -8.150 -0.589 -0.679
437 HA VAL 59 HA VAL 59 -6.008 -0.232 1.250
438 HB VAL 59 HB VAL 59 -8.248 1.702 0.626
439 1HG1 VAL 59 1HG1 VAL 59 -7.023 2.209 2.664
440 2HG1 VAL 59 2HG1 VAL 59 -6.642 3.392 1.412
441 3HG1 VAL 59 3HG1 VAL 59 -5.494 2.109 1.793
442 1HG2 VAL 59 1HG2 VAL 59 -5.559 1.441 -0.705
443 2HG2 VAL 59 2HG2 VAL 59 -6.688 2.775 -0.939
444 3HG2 VAL 59 3HG2 VAL 59 -7.133 1.147 -1.445
445 H LYS 60 H LYS 60 -6.272 -0.005 3.465
446 HA LYS 60 HA LYS 60 -8.954 -0.576 4.517
447 1HB LYS 60 2HB LYS 60 -6.330 -1.831 5.334
448 2HB LYS 60 1HB LYS 60 -7.796 -1.956 6.295
449 1HG LYS 60 2HG LYS 60 -7.556 -2.887 3.445
450 2HG LYS 60 1HG LYS 60 -7.373 -3.925 4.861
451 1HD LYS 60 2HD LYS 60 -9.634 -3.509 5.535
452 2HD LYS 60 1HD LYS 60 -9.834 -2.282 4.284
453 1HE LYS 60 2HE LYS 60 -9.232 -5.171 3.695
454 2HE LYS 60 1HE LYS 60 -10.866 -4.521 3.790
455 1HZ LYS 60 1HZ LYS 60 -10.010 -4.622 1.508
456 2HZ LYS 60 2HZ LYS 60 -8.774 -3.542 1.928
457 3HZ LYS 60 3HZ LYS 60 -10.390 -3.037 1.985
458 H GLU 61 H GLU 61 -8.125 -0.551 7.229
459 HA GLU 61 HA GLU 61 -8.794 1.981 7.930
460 1HB GLU 61 2HB GLU 61 -6.965 0.362 9.678
461 2HB GLU 61 1HB GLU 61 -8.304 1.399 10.148
462 1HG GLU 61 2HG GLU 61 -8.455 -1.304 8.841
463 2HG GLU 61 1HG GLU 61 -8.964 -0.865 10.469
464 H LYS 62 H LYS 62 -5.461 0.765 8.341
465 HA LYS 62 HA LYS 62 -4.460 3.429 7.655
466 1HB LYS 62 2HB LYS 62 -2.891 3.354 9.574
467 2HB LYS 62 1HB LYS 62 -4.573 3.440 10.069
468 1HG LYS 62 2HG LYS 62 -4.540 1.003 10.474
469 2HG LYS 62 1HG LYS 62 -2.816 0.998 10.085
470 1HD LYS 62 2HD LYS 62 -2.417 2.595 11.908
471 2HD LYS 62 1HD LYS 62 -4.135 2.560 12.303
472 1HE LYS 62 2HE LYS 62 -3.961 0.157 12.774
473 2HE LYS 62 1HE LYS 62 -2.232 0.226 12.424
474 1HZ LYS 62 1HZ LYS 62 -2.007 1.847 14.238
475 2HZ LYS 62 2HZ LYS 62 -2.584 0.354 14.783
476 3HZ LYS 62 3HZ LYS 62 -3.652 1.656 14.606
477 H PHE 63 H PHE 63 -4.582 0.684 6.497
478 HA PHE 63 HA PHE 63 -1.874 0.593 5.523
479 1HB PHE 63 2HB PHE 63 -1.698 -1.894 5.968
480 2HB PHE 63 1HB PHE 63 -1.555 -0.871 7.390
481 HD1 PHE 63 1HD PHE 63 -3.571 -3.382 5.683
482 HD2 PHE 63 2HD PHE 63 -3.326 -0.800 9.056
483 HE1 PHE 63 1HE PHE 63 -5.358 -4.662 6.788
484 HE2 PHE 63 2HE PHE 63 -5.114 -2.072 10.165
485 HZ PHE 63 HZ PHE 63 -6.133 -4.007 9.033
486 H ALA 64 H ALA 64 -1.729 -0.679 3.562
487 HA ALA 64 HA ALA 64 -4.379 -1.273 2.414
488 1HB ALA 64 1HB ALA 64 -2.121 0.160 1.020
489 2HB ALA 64 2HB ALA 64 -3.630 0.887 1.572
490 3HB ALA 64 3HB ALA 64 -3.652 -0.317 0.286
491 H PHE 65 H PHE 65 -4.406 -2.797 0.714
492 HA PHE 65 HA PHE 65 -2.085 -4.600 0.711
493 1HB PHE 65 2HB PHE 65 -4.995 -5.166 0.089
494 2HB PHE 65 1HB PHE 65 -3.695 -6.342 -0.060
495 HD1 PHE 65 1HD PHE 65 -5.992 -4.699 2.174
496 HD2 PHE 65 2HD PHE 65 -2.475 -7.084 1.979
497 HE1 PHE 65 1HE PHE 65 -6.290 -5.323 4.536
498 HE2 PHE 65 2HE PHE 65 -2.769 -7.718 4.337
499 HZ PHE 65 HZ PHE 65 -4.678 -6.840 5.619
500 H ALA 66 H ALA 66 -0.948 -4.739 -1.093
501 HA ALA 66 HA ALA 66 -2.204 -3.845 -3.600
502 1HB ALA 66 1HB ALA 66 -0.212 -2.746 -4.273
503 2HB ALA 66 2HB ALA 66 0.677 -3.364 -2.882
504 3HB ALA 66 3HB ALA 66 -0.603 -2.173 -2.653
505 H GLU 67 H GLU 67 -1.457 -4.843 -5.502
506 HA GLU 67 HA GLU 67 -0.209 -7.446 -4.982
507 1HB GLU 67 2HB GLU 67 -1.362 -8.070 -7.187
508 2HB GLU 67 1HB GLU 67 -2.368 -7.884 -5.756
509 1HG GLU 67 2HG GLU 67 -2.755 -5.499 -6.563
510 2HG GLU 67 1HG GLU 67 -2.071 -6.037 -8.097
511 H ARG 68 H ARG 68 1.635 -7.907 -5.850
512 HA ARG 68 HA ARG 68 3.201 -6.079 -7.269
513 1HB ARG 68 2HB ARG 68 4.415 -7.610 -6.038
514 2HB ARG 68 1HB ARG 68 3.457 -8.980 -6.567
515 1HG ARG 68 2HG ARG 68 4.522 -8.932 -8.734
516 2HG ARG 68 1HG ARG 68 5.401 -7.464 -8.301
517 1HD ARG 68 2HD ARG 68 6.801 -8.570 -6.850
518 2HD ARG 68 1HD ARG 68 5.674 -9.904 -6.606
519 HE ARG 68 HE ARG 68 6.736 -9.687 -9.284
520 1HH1 ARG 68 1HH1 ARG 68 7.095 -11.134 -6.109
521 2HH1 ARG 68 2HH1 ARG 68 8.134 -12.402 -6.678
522 1HH2 ARG 68 1HH2 ARG 68 8.071 -11.350 -10.022
523 2HH2 ARG 68 2HH2 ARG 68 8.685 -12.532 -8.908
524 H VAL 69 H VAL 69 2.986 -5.437 -9.228
525 HA VAL 69 HA VAL 69 1.575 -6.934 -11.248
526 HB VAL 69 HB VAL 69 3.011 -4.282 -11.491
527 1HG1 VAL 69 1HG1 VAL 69 1.531 -3.833 -13.343
528 2HG1 VAL 69 2HG1 VAL 69 0.733 -5.391 -13.121
529 3HG1 VAL 69 3HG1 VAL 69 2.419 -5.328 -13.636
530 1HG2 VAL 69 1HG2 VAL 69 0.825 -3.243 -11.058
531 2HG2 VAL 69 2HG2 VAL 69 1.419 -4.163 -9.676
532 3HG2 VAL 69 3HG2 VAL 69 0.155 -4.838 -10.706
533 H LEU 70 H LEU 70 4.371 -7.567 -10.113
534 HA LEU 70 HA LEU 70 5.846 -7.697 -12.651
535 1HB LEU 70 2HB LEU 70 6.882 -8.065 -9.836
536 2HB LEU 70 1HB LEU 70 7.851 -8.099 -11.295
537 HG LEU 70 HG LEU 70 6.431 -5.715 -10.120
538 1HD1 LEU 70 1HD1 LEU 70 9.343 -6.366 -10.535
539 2HD1 LEU 70 2HD1 LEU 70 8.492 -6.290 -8.993
540 3HD1 LEU 70 3HD1 LEU 70 8.717 -4.827 -9.949
541 1HD2 LEU 70 1HD2 LEU 70 6.266 -5.670 -12.552
542 2HD2 LEU 70 2HD2 LEU 70 8.006 -5.929 -12.682
543 3HD2 LEU 70 3HD2 LEU 70 7.386 -4.439 -11.970
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