Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
9392 | 1nvo RC | 5747 | cing | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 1H ACE 0 H1 ACE 0 3.715 7.875 6.778
2 2H ACE 0 H2 ACE 0 2.862 6.784 5.657
3 3H ACE 0 H3 ACE 0 3.260 6.238 7.299
4 H ASP 1 H ASP 1 1.616 9.012 5.733
5 HA ASP 1 HA ASP 1 -0.792 8.547 7.446
6 1HB ASP 1 1HB ASP 1 0.324 10.489 8.354
7 2HB ASP 1 2HB ASP 1 0.436 11.251 6.765
8 H TYR 2 H TYR 2 -0.395 11.009 4.873
9 HA TYR 2 HA TYR 2 -2.610 10.310 3.366
10 1HB TYR 2 1HB TYR 2 -0.210 11.936 2.954
11 2HB TYR 2 2HB TYR 2 -0.847 11.230 1.483
12 HD1 TYR 2 HD1 TYR 2 -3.090 11.794 0.621
13 HD2 TYR 2 HD2 TYR 2 -1.887 12.910 4.551
14 HE1 TYR 2 HE1 TYR 2 -5.097 13.237 0.834
15 HE2 TYR 2 HE2 TYR 2 -3.913 14.322 4.823
16 HH TYR 2 HH TYR 2 -5.907 14.931 3.877
17 H LEU 3 H LEU 3 0.404 8.548 3.376
18 HA LEU 3 HA LEU 3 -0.539 7.078 1.012
19 1HB LEU 3 1HB LEU 3 2.312 7.581 1.955
20 2HB LEU 3 2HB LEU 3 1.829 6.815 0.439
21 HG LEU 3 HG LEU 3 1.251 9.736 1.152
22 1HD1 LEU 3 1HD1 LEU 3 3.658 9.337 0.929
23 2HD1 LEU 3 2HD1 LEU 3 3.397 8.561 -0.649
24 3HD1 LEU 3 3HD1 LEU 3 3.031 10.285 -0.430
25 1HD2 LEU 3 1HD2 LEU 3 0.996 8.214 -1.481
26 2HD2 LEU 3 2HD2 LEU 3 -0.360 8.807 -0.500
27 3HD2 LEU 3 3HD2 LEU 3 0.744 9.957 -1.259
28 H ARG 4 H ARG 4 -0.241 6.566 4.320
29 HA ARG 4 HA ARG 4 0.954 3.948 4.145
30 1HB ARG 4 1HB ARG 4 -0.333 3.394 6.204
31 2HB ARG 4 2HB ARG 4 0.829 4.715 6.339
32 1HG ARG 4 1HG ARG 4 -0.818 6.345 6.486
33 2HG ARG 4 2HG ARG 4 -2.113 5.325 5.846
34 1HD ARG 4 1HD ARG 4 -2.094 3.975 7.876
35 2HD ARG 4 2HD ARG 4 -0.667 4.866 8.485
36 HE ARG 4 HE ARG 4 -2.692 6.744 7.910
37 1HH1 ARG 4 1HH2 ARG 4 -2.171 4.055 10.113
38 2HH1 ARG 4 2HH2 ARG 4 -2.999 4.788 11.461
39 1HH2 ARG 4 1HH1 ARG 4 -3.710 7.772 9.651
40 2HH2 ARG 4 2HH1 ARG 4 -3.906 6.975 11.186
41 H GLU 5 H GLU 5 -2.269 5.257 3.538
42 HA GLU 5 HA GLU 5 -3.353 2.516 3.327
43 1HB GLU 5 1HB GLU 5 -4.637 5.249 3.416
44 2HB GLU 5 2HB GLU 5 -5.527 3.765 3.043
45 1HG GLU 5 1HG GLU 5 -5.257 2.847 5.150
46 2HG GLU 5 2HG GLU 5 -3.725 3.650 5.460
47 H LEU 6 H LEU 6 -2.189 5.047 1.209
48 HA LEU 6 HA LEU 6 -3.507 3.869 -1.132
49 1HB LEU 6 1HB LEU 6 -1.629 6.225 -0.796
50 2HB LEU 6 2HB LEU 6 -2.349 5.658 -2.308
51 HG LEU 6 HG LEU 6 -4.567 6.162 -1.619
52 1HD1 LEU 6 1HD1 LEU 6 -4.798 5.786 0.657
53 2HD1 LEU 6 2HD1 LEU 6 -3.398 6.779 1.090
54 3HD1 LEU 6 3HD1 LEU 6 -4.897 7.535 0.546
55 1HD2 LEU 6 1HD2 LEU 6 -2.810 7.849 -2.553
56 2HD2 LEU 6 2HD2 LEU 6 -4.333 8.468 -1.968
57 3HD2 LEU 6 3HD2 LEU 6 -2.882 8.582 -0.941
58 H LEU 7 H LEU 7 -0.302 3.625 0.426
59 HA LEU 7 HA LEU 7 0.497 1.970 -1.825
60 1HB LEU 7 1HB LEU 7 2.589 2.857 -2.126
61 2HB LEU 7 2HB LEU 7 1.520 4.241 -1.970
62 HG LEU 7 HG LEU 7 2.298 4.354 0.493
63 1HD1 LEU 7 1HD1 LEU 7 3.848 2.030 -0.280
64 2HD1 LEU 7 2HD1 LEU 7 4.945 3.364 0.084
65 3HD1 LEU 7 3HD1 LEU 7 3.768 2.856 1.288
66 1HD2 LEU 7 1HD2 LEU 7 4.316 4.938 -1.692
67 2HD2 LEU 7 2HD2 LEU 7 2.939 5.955 -1.279
68 3HD2 LEU 7 3HD2 LEU 7 4.227 5.694 -0.090
69 H LYS 8 H LYS 8 0.989 2.653 1.642
70 HA LYS 8 HA LYS 8 2.783 0.518 1.898
71 1HB LYS 8 1HB LYS 8 2.440 2.514 3.426
72 2HB LYS 8 2HB LYS 8 1.129 1.580 4.200
73 1HG LYS 8 1HG LYS 8 2.710 -0.135 4.878
74 2HG LYS 8 2HG LYS 8 4.025 0.691 4.011
75 1HD LYS 8 1HD LYS 8 3.726 2.713 5.396
76 2HD LYS 8 2HD LYS 8 2.351 1.970 6.235
77 1HE LYS 8 1HE LYS 8 3.832 0.245 7.190
78 2HE LYS 8 2HE LYS 8 5.217 0.919 6.306
79 1HZ LYS 8 1HZ LYS 8 4.944 2.945 7.527
80 2HZ LYS 8 2HZ LYS 8 3.638 2.348 8.334
81 3HZ LYS 8 3HZ LYS 8 5.127 1.683 8.570
82 H LEU 9 H LEU 9 -0.727 0.727 2.187
83 HA LEU 9 HA LEU 9 -1.141 -2.058 2.899
84 1HB LEU 9 1HB LEU 9 -2.915 -0.005 1.564
85 2HB LEU 9 2HB LEU 9 -3.418 -1.671 1.887
86 HG LEU 9 HG LEU 9 -2.536 0.285 4.049
87 1HD1 LEU 9 1HD1 LEU 9 -4.728 0.887 2.906
88 2HD1 LEU 9 2HD1 LEU 9 -5.332 -0.699 3.360
89 3HD1 LEU 9 3HD1 LEU 9 -4.901 0.464 4.620
90 1HD2 LEU 9 1HD2 LEU 9 -3.775 -2.510 4.159
91 2HD2 LEU 9 2HD2 LEU 9 -2.191 -2.023 4.809
92 3HD2 LEU 9 3HD2 LEU 9 -3.669 -1.414 5.550
93 H GLU 10 H GLU 10 -0.850 -0.300 -0.234
94 HA GLU 10 HA GLU 10 -1.585 -2.412 -1.938
95 1HB GLU 10 1HB GLU 10 0.558 -0.296 -2.337
96 2HB GLU 10 2HB GLU 10 -0.078 -1.319 -3.575
97 1HG GLU 10 1HG GLU 10 -1.872 0.631 -2.081
98 2HG GLU 10 2HG GLU 10 -0.953 1.027 -3.532
99 H LEU 11 H LEU 11 1.548 -1.693 -0.364
100 HA LEU 11 HA LEU 11 3.096 -3.694 -1.637
101 1HB LEU 11 1HB LEU 11 3.995 -1.975 -0.049
102 2HB LEU 11 2HB LEU 11 3.145 -2.777 1.277
103 HG LEU 11 HG LEU 11 4.544 -4.842 0.882
104 1HD1 LEU 11 1HD1 LEU 11 5.275 -4.403 -1.447
105 2HD1 LEU 11 2HD1 LEU 11 6.120 -2.933 -0.911
106 3HD1 LEU 11 3HD1 LEU 11 6.668 -4.532 -0.366
107 1HD2 LEU 11 1HD2 LEU 11 5.990 -2.256 1.575
108 2HD2 LEU 11 2HD2 LEU 11 5.007 -3.242 2.680
109 3HD2 LEU 11 3HD2 LEU 11 6.511 -3.899 2.014
110 H GLN 12 H GLN 12 1.011 -4.039 1.285
111 HA GLN 12 HA GLN 12 1.595 -6.862 1.559
112 1HB GLN 12 1HB GLN 12 -0.705 -5.158 2.630
113 2HB GLN 12 2HB GLN 12 -0.601 -6.895 2.859
114 1HG GLN 12 1HG GLN 12 0.293 -6.043 4.835
115 2HG GLN 12 2HG GLN 12 1.685 -6.613 3.907
116 1HE2 GLN 12 2HE2 GLN 12 -0.350 -3.659 4.218
117 2HE2 GLN 12 1HE2 GLN 12 1.002 -2.552 4.026
118 H LEU 13 H LEU 13 -0.627 -5.081 -0.545
119 HA LEU 13 HA LEU 13 -2.283 -7.418 -1.034
120 1HB LEU 13 1HB LEU 13 -2.097 -4.857 -2.650
121 2HB LEU 13 2HB LEU 13 -3.274 -6.156 -2.796
122 HG LEU 13 HG LEU 13 -2.971 -4.128 -0.587
123 1HD1 LEU 13 1HD1 LEU 13 -4.471 -3.795 -2.602
124 2HD1 LEU 13 2HD1 LEU 13 -5.390 -5.217 -2.047
125 3HD1 LEU 13 3HD1 LEU 13 -5.335 -3.770 -1.041
126 1HD2 LEU 13 1HD2 LEU 13 -4.528 -6.752 -0.368
127 2HD2 LEU 13 2HD2 LEU 13 -3.209 -6.214 0.705
128 3HD2 LEU 13 3HD2 LEU 13 -4.742 -5.347 0.691
129 H ILE 14 H ILE 14 0.384 -5.767 -2.793
130 HA ILE 14 HA ILE 14 0.588 -7.703 -4.927
131 HB ILE 14 HB ILE 14 2.702 -5.986 -3.478
132 1HG1 ILE 14 1HG1 ILE 14 1.070 -4.586 -4.475
133 2HG1 ILE 14 2HG1 ILE 14 2.488 -4.556 -5.510
134 1HG2 ILE 14 1HG2 ILE 14 3.900 -7.779 -4.624
135 2HG2 ILE 14 2HG2 ILE 14 2.965 -7.537 -6.105
136 3HG2 ILE 14 3HG2 ILE 14 4.084 -6.284 -5.541
137 1HD1 ILE 14 1HD1 ILE 14 1.239 -6.423 -6.882
138 2HD1 ILE 14 2HD1 ILE 14 -0.193 -5.897 -5.965
139 3HD1 ILE 14 3HD1 ILE 14 0.665 -4.763 -7.008
140 H LYS 15 H LYS 15 2.300 -7.568 -1.888
141 HA LYS 15 HA LYS 15 3.408 -10.132 -1.958
142 1HB LYS 15 1HB LYS 15 3.504 -8.175 -0.137
143 2HB LYS 15 2HB LYS 15 2.285 -9.152 0.668
144 1HG LYS 15 1HG LYS 15 4.467 -9.650 1.533
145 2HG LYS 15 2HG LYS 15 3.923 -11.082 0.645
146 1HD LYS 15 1HD LYS 15 5.411 -10.676 -1.169
147 2HD LYS 15 2HD LYS 15 5.616 -8.969 -0.763
148 1HE LYS 15 1HE LYS 15 6.661 -11.267 0.955
149 2HE LYS 15 2HE LYS 15 7.608 -10.424 -0.283
150 1HZ LYS 15 1HZ LYS 15 7.276 -8.386 0.900
151 2HZ LYS 15 2HZ LYS 15 6.422 -9.153 2.080
152 3HZ LYS 15 3HZ LYS 15 8.016 -9.504 1.854
153 H GLN 16 H GLN 16 0.096 -9.358 -0.760
154 HA GLN 16 HA GLN 16 -0.517 -12.131 -0.096
155 1HB GLN 16 1HB GLN 16 -2.106 -9.569 -0.256
156 2HB GLN 16 2HB GLN 16 -2.957 -11.085 -0.455
157 1HG GLN 16 1HG GLN 16 -3.126 -10.516 1.814
158 2HG GLN 16 2HG GLN 16 -2.104 -11.944 1.689
159 1HE2 GLN 16 2HE2 GLN 16 0.422 -11.244 1.527
160 2HE2 GLN 16 1HE2 GLN 16 0.861 -10.050 2.740
161 H TYR 17 H TYR 17 -0.671 -10.186 -3.014
162 HA TYR 17 HA TYR 17 -2.447 -11.846 -4.539
163 1HB TYR 17 1HB TYR 17 -0.498 -9.664 -5.088
164 2HB TYR 17 2HB TYR 17 -0.781 -10.784 -6.364
165 HD1 TYR 17 HD1 TYR 17 -1.717 -7.674 -5.279
166 HD2 TYR 17 HD2 TYR 17 -3.312 -11.307 -6.951
167 HE1 TYR 17 HE1 TYR 17 -3.558 -6.396 -6.288
168 HE2 TYR 17 HE2 TYR 17 -5.215 -10.034 -7.883
169 HH TYR 17 HH TYR 17 -6.303 -7.939 -7.952
170 H ARG 18 H ARG 18 0.870 -12.162 -3.562
171 HA ARG 18 HA ARG 18 1.514 -14.141 -5.644
172 1HB ARG 18 1HB ARG 18 3.124 -13.131 -3.263
173 2HB ARG 18 2HB ARG 18 3.642 -14.383 -4.402
174 1HG ARG 18 1HG ARG 18 3.259 -12.693 -6.288
175 2HG ARG 18 2HG ARG 18 3.000 -11.490 -5.027
176 1HD ARG 18 1HD ARG 18 5.221 -11.148 -5.442
177 2HD ARG 18 2HD ARG 18 5.391 -12.326 -4.151
178 HE ARG 18 HE ARG 18 5.887 -12.596 -7.058
179 1HH1 ARG 18 1HH2 ARG 18 5.682 -14.371 -4.010
180 2HH1 ARG 18 2HH2 ARG 18 6.557 -15.756 -4.597
181 1HH2 ARG 18 1HH1 ARG 18 7.034 -14.364 -7.828
182 2HH2 ARG 18 2HH1 ARG 18 7.352 -15.747 -6.820
183 H GLU 19 H GLU 19 0.374 -13.989 -2.352
184 HA GLU 19 HA GLU 19 0.680 -16.837 -1.847
185 1HB GLU 19 1HB GLU 19 0.388 -14.972 -0.079
186 2HB GLU 19 2HB GLU 19 -1.333 -15.023 -0.502
187 1HG GLU 19 1HG GLU 19 -1.295 -17.507 -0.053
188 2HG GLU 19 2HG GLU 19 0.383 -17.339 0.495
189 H ALA 20 H ALA 20 -2.018 -14.633 -2.855
190 HA ALA 20 HA ALA 20 -3.905 -16.803 -3.032
191 1HB ALA 20 1HB ALA 20 -4.499 -14.395 -2.813
192 2HB ALA 20 2HB ALA 20 -3.951 -14.172 -4.510
193 3HB ALA 20 3HB ALA 20 -5.349 -15.203 -4.146
194 H LEU 21 H LEU 21 -1.617 -15.410 -5.378
195 HA LEU 21 HA LEU 21 -2.350 -16.448 -7.767
196 1HB LEU 21 1HB LEU 21 -0.220 -15.214 -7.317
197 2HB LEU 21 2HB LEU 21 0.418 -16.652 -6.510
198 HG LEU 21 HG LEU 21 0.276 -17.909 -8.681
199 1HD1 LEU 21 1HD1 LEU 21 -1.491 -16.656 -9.806
200 2HD1 LEU 21 2HD1 LEU 21 -0.538 -15.164 -9.682
201 3HD1 LEU 21 3HD1 LEU 21 -0.011 -16.489 -10.752
202 1HD2 LEU 21 1HD2 LEU 21 1.882 -15.323 -8.691
203 2HD2 LEU 21 2HD2 LEU 21 2.366 -16.868 -7.963
204 3HD2 LEU 21 3HD2 LEU 21 2.186 -16.740 -9.721
205 H GLU 22 H GLU 22 -0.945 -18.327 -5.061
206 HA GLU 22 HA GLU 22 -0.559 -20.669 -6.743
207 1HB GLU 22 1HB GLU 22 -0.250 -20.394 -3.719
208 2HB GLU 22 2HB GLU 22 0.299 -21.719 -4.756
209 1HG GLU 22 1HG GLU 22 1.535 -19.710 -6.060
210 2HG GLU 22 2HG GLU 22 1.393 -18.916 -4.485
211 H TYR 23 H TYR 23 -2.689 -19.694 -4.035
212 HA TYR 23 HA TYR 23 -4.189 -22.086 -3.865
213 1HB TYR 23 1HB TYR 23 -4.640 -19.156 -3.181
214 2HB TYR 23 2HB TYR 23 -5.918 -20.316 -2.976
215 HD1 TYR 23 HD1 TYR 23 -3.236 -18.785 -1.284
216 HD2 TYR 23 HD2 TYR 23 -5.244 -22.578 -1.716
217 HE1 TYR 23 HE1 TYR 23 -2.450 -19.463 0.963
218 HE2 TYR 23 HE2 TYR 23 -4.423 -23.263 0.521
219 HH TYR 23 HH TYR 23 -2.461 -21.099 2.571
220 H VAL 24 H VAL 24 -4.626 -19.182 -5.870
221 HA VAL 24 HA VAL 24 -7.093 -20.326 -7.050
222 HB VAL 24 HB VAL 24 -5.762 -17.638 -7.484
223 1HG1 VAL 24 1HG1 VAL 24 -7.200 -18.127 -9.393
224 2HG1 VAL 24 2HG1 VAL 24 -8.467 -18.783 -8.335
225 3HG1 VAL 24 3HG1 VAL 24 -8.107 -17.051 -8.324
226 1HG2 VAL 24 1HG2 VAL 24 -8.136 -18.449 -5.752
227 2HG2 VAL 24 2HG2 VAL 24 -6.559 -17.897 -5.152
228 3HG2 VAL 24 3HG2 VAL 24 -7.592 -16.786 -6.048
229 H LYS 25 H LYS 25 -3.719 -20.325 -7.677
230 HA LYS 25 HA LYS 25 -2.439 -21.021 -9.364
231 1HB LYS 25 1HB LYS 25 -3.022 -23.250 -10.196
232 2HB LYS 25 2HB LYS 25 -3.123 -23.082 -8.444
233 1HG LYS 25 1HG LYS 25 -5.573 -22.963 -8.531
234 2HG LYS 25 2HG LYS 25 -5.519 -22.989 -10.302
235 1HD LYS 25 1HD LYS 25 -4.238 -25.270 -9.990
236 2HD LYS 25 2HD LYS 25 -4.765 -25.161 -8.303
237 1HE LYS 25 1HE LYS 25 -6.382 -26.516 -9.490
238 2HE LYS 25 2HE LYS 25 -7.158 -24.959 -9.141
239 1HZ LYS 25 1HZ LYS 25 -6.650 -24.291 -11.388
240 2HZ LYS 25 2HZ LYS 25 -5.907 -25.725 -11.693
241 3HZ LYS 25 3HZ LYS 25 -7.528 -25.683 -11.397
242 H LEU 26 H LEU 26 -3.402 -18.841 -10.367
243 HA LEU 26 HA LEU 26 -3.932 -19.566 -13.179
244 1HB LEU 26 1HB LEU 26 -5.936 -18.630 -11.439
245 2HB LEU 26 2HB LEU 26 -5.483 -17.192 -12.319
246 HG LEU 26 HG LEU 26 -5.825 -19.513 -14.138
247 1HD1 LEU 26 1HD1 LEU 26 -7.364 -20.284 -12.403
248 2HD1 LEU 26 2HD1 LEU 26 -8.195 -18.713 -12.415
249 3HD1 LEU 26 3HD1 LEU 26 -8.238 -19.759 -13.852
250 1HD2 LEU 26 1HD2 LEU 26 -7.260 -16.838 -13.910
251 2HD2 LEU 26 2HD2 LEU 26 -5.788 -17.160 -14.862
252 3HD2 LEU 26 3HD2 LEU 26 -7.317 -17.948 -15.292
253 HA PRO 27 HA PRO 27 -0.560 -16.674 -13.447
254 1HB PRO 27 1HB PRO 27 -0.468 -16.239 -16.163
255 2HB PRO 27 2HB PRO 27 0.122 -17.727 -15.373
256 1HG PRO 27 1HG PRO 27 -2.573 -17.275 -16.679
257 2HG PRO 27 2HG PRO 27 -1.460 -18.654 -16.912
258 1HD PRO 27 1HD PRO 27 -3.562 -18.808 -15.221
259 2HD PRO 27 2HD PRO 27 -1.999 -19.554 -14.765
260 H VAL 28 H VAL 28 -3.793 -16.044 -14.773
261 HA VAL 28 HA VAL 28 -3.573 -13.325 -15.344
262 HB VAL 28 HB VAL 28 -5.882 -14.852 -14.224
263 1HG1 VAL 28 1HG1 VAL 28 -6.337 -12.519 -13.795
264 2HG1 VAL 28 2HG1 VAL 28 -5.780 -12.055 -15.418
265 3HG1 VAL 28 3HG1 VAL 28 -7.274 -12.991 -15.215
266 1HG2 VAL 28 1HG2 VAL 28 -5.221 -13.949 -17.071
267 2HG2 VAL 28 2HG2 VAL 28 -5.022 -15.609 -16.485
268 3HG2 VAL 28 3HG2 VAL 28 -6.637 -14.897 -16.577
269 H LEU 29 H LEU 29 -3.757 -14.880 -12.065
270 HA LEU 29 HA LEU 29 -4.294 -12.389 -10.714
271 1HB LEU 29 1HB LEU 29 -3.307 -15.156 -9.924
272 2HB LEU 29 2HB LEU 29 -3.009 -13.787 -8.894
273 HG LEU 29 HG LEU 29 -5.618 -13.305 -9.218
274 1HD1 LEU 29 1HD1 LEU 29 -5.961 -15.140 -10.848
275 2HD1 LEU 29 2HD1 LEU 29 -5.363 -16.318 -9.656
276 3HD1 LEU 29 3HD1 LEU 29 -6.868 -15.430 -9.353
277 1HD2 LEU 29 1HD2 LEU 29 -4.532 -15.458 -7.370
278 2HD2 LEU 29 2HD2 LEU 29 -4.506 -13.705 -7.073
279 3HD2 LEU 29 3HD2 LEU 29 -6.053 -14.561 -7.168
280 H ALA 30 H ALA 30 -1.342 -14.283 -11.482
281 HA ALA 30 HA ALA 30 0.428 -12.375 -10.443
282 1HB ALA 30 1HB ALA 30 1.299 -14.553 -11.080
283 2HB ALA 30 2HB ALA 30 0.907 -14.263 -12.791
284 3HB ALA 30 3HB ALA 30 2.159 -13.306 -11.985
285 H LYS 31 H LYS 31 -1.273 -12.369 -13.564
286 HA LYS 31 HA LYS 31 0.340 -10.096 -14.519
287 1HB LYS 31 1HB LYS 31 -2.017 -11.588 -15.630
288 2HB LYS 31 2HB LYS 31 -1.730 -9.926 -16.134
289 1HG LYS 31 1HG LYS 31 -0.708 -11.300 -17.726
290 2HG LYS 31 2HG LYS 31 0.562 -10.452 -16.862
291 1HD LYS 31 1HD LYS 31 -0.254 -13.259 -16.029
292 2HD LYS 31 2HD LYS 31 0.720 -13.050 -17.481
293 1HE LYS 31 1HE LYS 31 1.580 -12.077 -14.717
294 2HE LYS 31 2HE LYS 31 2.088 -13.577 -15.487
295 1HZ LYS 31 1HZ LYS 31 3.035 -12.261 -17.256
296 2HZ LYS 31 2HZ LYS 31 2.592 -10.865 -16.494
297 3HZ LYS 31 3HZ LYS 31 3.682 -11.871 -15.793
298 H ILE 32 H ILE 32 -2.624 -10.487 -12.607
299 HA ILE 32 HA ILE 32 -3.400 -7.701 -13.011
300 HB ILE 32 HB ILE 32 -4.205 -9.881 -11.044
301 1HG1 ILE 32 1HG1 ILE 32 -5.785 -8.405 -13.212
302 2HG1 ILE 32 2HG1 ILE 32 -4.947 -9.919 -13.512
303 1HG2 ILE 32 1HG2 ILE 32 -4.335 -7.733 -9.863
304 2HG2 ILE 32 2HG2 ILE 32 -5.144 -7.012 -11.251
305 3HG2 ILE 32 3HG2 ILE 32 -5.970 -8.249 -10.280
306 1HD1 ILE 32 1HD1 ILE 32 -6.303 -11.014 -11.718
307 2HD1 ILE 32 2HD1 ILE 32 -7.240 -9.510 -11.555
308 3HD1 ILE 32 3HD1 ILE 32 -7.251 -10.391 -13.085
309 H LEU 33 H LEU 33 -1.646 -9.627 -10.553
310 HA LEU 33 HA LEU 33 -1.342 -7.533 -8.678
311 1HB LEU 33 1HB LEU 33 -0.075 -8.950 -7.482
312 2HB LEU 33 2HB LEU 33 -1.094 -10.027 -8.464
313 HG LEU 33 HG LEU 33 0.860 -10.370 -9.927
314 1HD1 LEU 33 1HD1 LEU 33 2.661 -9.087 -9.704
315 2HD1 LEU 33 2HD1 LEU 33 2.062 -8.403 -8.171
316 3HD1 LEU 33 3HD1 LEU 33 2.987 -9.922 -8.179
317 1HD2 LEU 33 1HD2 LEU 33 1.238 -11.130 -7.019
318 2HD2 LEU 33 2HD2 LEU 33 0.082 -11.922 -8.120
319 3HD2 LEU 33 3HD2 LEU 33 1.823 -12.029 -8.433
320 H GLU 34 H GLU 34 0.679 -8.688 -11.451
321 HA GLU 34 HA GLU 34 2.907 -7.012 -11.134
322 1HB GLU 34 1HB GLU 34 2.581 -8.956 -12.782
323 2HB GLU 34 2HB GLU 34 1.713 -7.831 -13.806
324 1HG GLU 34 1HG GLU 34 4.070 -6.432 -13.206
325 2HG GLU 34 2HG GLU 34 4.617 -8.105 -13.300
326 H ASP 35 H ASP 35 0.007 -6.544 -13.168
327 HA ASP 35 HA ASP 35 0.768 -4.018 -14.191
328 1HB ASP 35 1HB ASP 35 -1.126 -5.451 -15.039
329 2HB ASP 35 2HB ASP 35 -2.099 -4.877 -13.670
330 H GLU 36 H GLU 36 -1.162 -4.832 -11.267
331 HA GLU 36 HA GLU 36 -1.612 -2.153 -10.412
332 1HB GLU 36 1HB GLU 36 -1.211 -4.692 -8.769
333 2HB GLU 36 2HB GLU 36 -1.876 -3.178 -8.151
334 1HG GLU 36 1HG GLU 36 -3.220 -4.631 -10.471
335 2HG GLU 36 2HG GLU 36 -3.521 -5.059 -8.784
336 H GLU 37 H GLU 37 1.186 -4.374 -9.873
337 HA GLU 37 HA GLU 37 2.544 -2.994 -7.976
338 1HB GLU 37 1HB GLU 37 2.945 -5.225 -9.486
339 2HB GLU 37 2HB GLU 37 4.149 -4.192 -10.242
340 1HG GLU 37 1HG GLU 37 3.938 -4.508 -7.234
341 2HG GLU 37 2HG GLU 37 4.625 -5.775 -8.241
342 H LYS 38 H LYS 38 2.543 -2.318 -11.489
343 HA LYS 38 HA LYS 38 4.546 -0.252 -11.320
344 1HB LYS 38 1HB LYS 38 3.734 -1.552 -13.391
345 2HB LYS 38 2HB LYS 38 2.271 -0.573 -13.327
346 1HG LYS 38 1HG LYS 38 3.654 0.493 -14.936
347 2HG LYS 38 2HG LYS 38 3.803 1.502 -13.492
348 1HD LYS 38 1HD LYS 38 5.957 0.206 -12.942
349 2HD LYS 38 2HD LYS 38 5.779 -0.595 -14.512
350 1HE LYS 38 1HE LYS 38 5.834 1.694 -15.597
351 2HE LYS 38 2HE LYS 38 6.097 2.402 -13.989
352 1HZ LYS 38 1HZ LYS 38 8.100 1.120 -13.818
353 2HZ LYS 38 2HZ LYS 38 7.871 0.482 -15.322
354 3HZ LYS 38 3HZ LYS 38 8.143 2.097 -15.142
355 H HIS 39 H HIS 39 0.982 -0.130 -11.106
356 HA HIS 39 HA HIS 39 0.859 2.772 -11.016
357 1HB HIS 39 1HB HIS 39 -1.009 0.534 -10.122
358 2HB HIS 39 2HB HIS 39 -1.313 2.225 -9.774
359 HD1 HIS 39 HD1 HIS 39 -3.550 1.748 -11.403
360 HD2 HIS 39 HD2 HIS 39 0.284 1.940 -13.173
361 HE1 HIS 39 HE1 HIS 39 -3.886 2.336 -13.875
362 HE2 HIS 39 HE2 HIS 39 -1.569 2.375 -14.948
363 H ILE 40 H ILE 40 1.073 0.234 -8.570
364 HA ILE 40 HA ILE 40 0.954 1.886 -6.261
365 HB ILE 40 HB ILE 40 2.211 -0.836 -6.763
366 1HG1 ILE 40 1HG1 ILE 40 -0.379 -0.157 -5.352
367 2HG1 ILE 40 2HG1 ILE 40 -0.389 -0.363 -7.073
368 1HG2 ILE 40 1HG2 ILE 40 3.182 0.134 -4.717
369 2HG2 ILE 40 2HG2 ILE 40 1.568 0.575 -4.135
370 3HG2 ILE 40 3HG2 ILE 40 2.048 -1.132 -4.277
371 1HD1 ILE 40 1HD1 ILE 40 0.426 -2.597 -6.967
372 2HD1 ILE 40 2HD1 ILE 40 0.605 -2.542 -5.218
373 3HD1 ILE 40 3HD1 ILE 40 -1.013 -2.449 -5.946
374 H GLU 41 H GLU 41 3.686 0.630 -8.158
375 HA GLU 41 HA GLU 41 5.834 1.773 -6.858
376 1HB GLU 41 1HB GLU 41 5.871 0.209 -8.891
377 2HB GLU 41 2HB GLU 41 5.604 1.655 -9.884
378 1HG GLU 41 1HG GLU 41 7.683 2.637 -8.772
379 2HG GLU 41 2HG GLU 41 7.945 1.029 -8.071
380 H TRP 42 H TRP 42 3.589 3.364 -9.249
381 HA TRP 42 HA TRP 42 4.994 5.738 -9.532
382 1HB TRP 42 1HB TRP 42 2.795 4.799 -10.597
383 2HB TRP 42 2HB TRP 42 1.999 5.708 -9.327
384 HD1 TRP 42 HD1 TRP 42 4.065 6.190 -12.465
385 HE1 TRP 42 HE1 TRP 42 3.956 8.682 -13.247
386 HE3 TRP 42 HE3 TRP 42 1.691 8.027 -8.435
387 HZ2 TRP 42 HZ2 TRP 42 2.937 11.183 -12.124
388 HZ3 TRP 42 HZ3 TRP 42 1.124 10.477 -8.253
389 HH2 TRP 42 HH2 TRP 42 1.781 12.043 -10.079
390 H LEU 43 H LEU 43 2.899 4.660 -6.895
391 HA LEU 43 HA LEU 43 3.003 7.211 -5.428
392 1HB LEU 43 1HB LEU 43 2.183 4.455 -4.412
393 2HB LEU 43 2HB LEU 43 2.117 5.983 -3.551
394 HG LEU 43 HG LEU 43 0.685 6.612 -5.846
395 1HD1 LEU 43 1HD1 LEU 43 0.720 4.190 -6.498
396 2HD1 LEU 43 2HD1 LEU 43 -0.082 3.770 -4.974
397 3HD1 LEU 43 3HD1 LEU 43 -0.919 4.768 -6.178
398 1HD2 LEU 43 1HD2 LEU 43 -0.277 5.437 -3.190
399 2HD2 LEU 43 2HD2 LEU 43 0.082 7.150 -3.480
400 3HD2 LEU 43 3HD2 LEU 43 -1.288 6.386 -4.300
401 H GLU 44 H GLU 44 4.617 4.009 -5.296
402 HA GLU 44 HA GLU 44 6.314 4.836 -3.050
403 1HB GLU 44 1HB GLU 44 6.598 2.361 -4.794
404 2HB GLU 44 2HB GLU 44 7.356 2.687 -3.236
405 1HG GLU 44 1HG GLU 44 4.996 2.895 -2.273
406 2HG GLU 44 2HG GLU 44 4.409 2.162 -3.770
407 H THR 45 H THR 45 6.452 6.437 -5.589
408 HA THR 45 HA THR 45 9.372 6.647 -5.523
409 HB THR 45 HB THR 45 8.611 5.054 -7.378
410 HG1 THR 45 HG1 THR 45 10.359 5.661 -8.530
411 1HG2 THR 45 1HG2 THR 45 6.814 6.367 -8.375
412 2HG2 THR 45 2HG2 THR 45 8.000 7.567 -8.939
413 3HG2 THR 45 3HG2 THR 45 8.049 5.893 -9.530
414 H ILE 46 H ILE 46 6.404 7.754 -7.070
415 HA ILE 46 HA ILE 46 5.539 9.757 -7.489
416 HB ILE 46 HB ILE 46 4.820 9.294 -5.260
417 1HG1 ILE 46 1HG1 ILE 46 4.167 11.499 -4.491
418 2HG1 ILE 46 2HG1 ILE 46 5.339 12.270 -5.567
419 1HG2 ILE 46 1HG2 ILE 46 6.848 9.135 -3.966
420 2HG2 ILE 46 2HG2 ILE 46 7.188 10.866 -4.186
421 3HG2 ILE 46 3HG2 ILE 46 5.782 10.336 -3.253
422 1HD1 ILE 46 1HD1 ILE 46 4.112 11.456 -7.531
423 2HD1 ILE 46 2HD1 ILE 46 3.067 10.453 -6.492
424 3HD1 ILE 46 3HD1 ILE 46 2.967 12.224 -6.423
425 H LEU 47 H LEU 47 7.389 9.928 -8.918
426 HA LEU 47 HA LEU 47 8.763 11.191 -10.126
427 1HB LEU 47 1HB LEU 47 7.528 13.244 -9.304
428 2HB LEU 47 2HB LEU 47 8.720 13.369 -8.002
429 HG LEU 47 HG LEU 47 10.541 13.470 -9.777
430 1HD1 LEU 47 1HD1 LEU 47 9.290 12.612 -11.736
431 2HD1 LEU 47 2HD1 LEU 47 8.129 13.951 -11.594
432 3HD1 LEU 47 3HD1 LEU 47 9.823 14.269 -12.021
433 1HD2 LEU 47 1HD2 LEU 47 8.447 15.678 -9.695
434 2HD2 LEU 47 2HD2 LEU 47 9.767 15.431 -8.529
435 3HD2 LEU 47 3HD2 LEU 47 10.142 15.859 -10.207
436 H GLY 48 H GLY 48 9.555 11.467 -6.646
437 1HA GLY 48 1HA GLY 48 11.403 10.081 -5.808
438 2HA GLY 48 2HA GLY 48 12.358 10.535 -7.228
439 1HN NH2 49 1HN NH2 49 12.023 11.204 -4.011
440 2HN NH2 49 2HN NH2 49 12.532 12.914 -3.996
441 1H ACE 0 H1 ACE 0 -13.755 -16.707 -0.162
442 2H ACE 0 H2 ACE 0 -13.725 -17.587 1.380
443 3H ACE 0 H3 ACE 0 -12.656 -18.087 0.048
444 H ASP 1 H ASP 1 -11.231 -17.790 2.162
445 HA ASP 1 HA ASP 1 -10.550 -15.317 3.210
446 1HB ASP 1 1HB ASP 1 -9.718 -17.446 4.120
447 2HB ASP 1 2HB ASP 1 -8.699 -17.685 2.686
448 H TYR 2 H TYR 2 -9.044 -16.917 0.367
449 HA TYR 2 HA TYR 2 -7.169 -15.097 -0.408
450 1HB TYR 2 1HB TYR 2 -9.118 -16.352 -2.358
451 2HB TYR 2 2HB TYR 2 -7.407 -16.029 -2.551
452 HD1 TYR 2 HD1 TYR 2 -9.355 -18.657 -2.734
453 HD2 TYR 2 HD2 TYR 2 -6.229 -17.285 -0.087
454 HE1 TYR 2 HE1 TYR 2 -9.074 -20.953 -1.862
455 HE2 TYR 2 HE2 TYR 2 -6.015 -19.557 0.829
456 HH TYR 2 HH TYR 2 -6.713 -21.757 0.684
457 H LEU 3 H LEU 3 -10.689 -14.927 -0.992
458 HA LEU 3 HA LEU 3 -10.423 -12.466 -2.467
459 1HB LEU 3 1HB LEU 3 -12.912 -13.878 -1.392
460 2HB LEU 3 2HB LEU 3 -12.937 -12.532 -2.531
461 HG LEU 3 HG LEU 3 -11.602 -15.210 -3.156
462 1HD1 LEU 3 1HD1 LEU 3 -13.988 -15.573 -2.719
463 2HD1 LEU 3 2HD1 LEU 3 -14.411 -14.263 -3.844
464 3HD1 LEU 3 3HD1 LEU 3 -13.629 -15.739 -4.447
465 1HD2 LEU 3 1HD2 LEU 3 -12.533 -12.911 -4.943
466 2HD2 LEU 3 2HD2 LEU 3 -10.842 -13.305 -4.564
467 3HD2 LEU 3 3HD2 LEU 3 -11.827 -14.438 -5.499
468 H ARG 4 H ARG 4 -11.350 -13.302 0.867
469 HA ARG 4 HA ARG 4 -11.995 -10.650 1.702
470 1HB ARG 4 1HB ARG 4 -10.356 -12.739 3.184
471 2HB ARG 4 2HB ARG 4 -10.991 -11.276 3.893
472 1HG ARG 4 1HG ARG 4 -12.830 -13.348 2.598
473 2HG ARG 4 2HG ARG 4 -12.252 -13.469 4.265
474 1HD ARG 4 1HD ARG 4 -13.145 -11.124 4.655
475 2HD ARG 4 2HD ARG 4 -14.003 -11.278 3.099
476 HE ARG 4 HE ARG 4 -14.644 -13.585 4.470
477 1HH1 ARG 4 1HH2 ARG 4 -15.009 -10.145 5.115
478 2HH1 ARG 4 2HH2 ARG 4 -16.236 -10.346 6.340
479 1HH2 ARG 4 1HH1 ARG 4 -16.224 -13.889 6.071
480 2HH2 ARG 4 2HH1 ARG 4 -16.962 -12.537 6.878
481 H GLU 5 H GLU 5 -8.931 -12.177 0.810
482 HA GLU 5 HA GLU 5 -7.301 -10.024 1.951
483 1HB GLU 5 1HB GLU 5 -6.565 -12.454 0.288
484 2HB GLU 5 2HB GLU 5 -5.412 -11.278 0.916
485 1HG GLU 5 1HG GLU 5 -5.956 -11.806 3.206
486 2HG GLU 5 2HG GLU 5 -7.334 -12.799 2.737
487 H LEU 6 H LEU 6 -8.204 -11.122 -1.335
488 HA LEU 6 HA LEU 6 -6.913 -8.648 -2.403
489 1HB LEU 6 1HB LEU 6 -7.531 -11.306 -3.603
490 2HB LEU 6 2HB LEU 6 -6.914 -9.921 -4.536
491 HG LEU 6 HG LEU 6 -5.414 -11.076 -2.129
492 1HD1 LEU 6 1HD1 LEU 6 -5.823 -12.673 -3.980
493 2HD1 LEU 6 2HD1 LEU 6 -4.884 -11.591 -5.027
494 3HD1 LEU 6 3HD1 LEU 6 -4.162 -12.267 -3.525
495 1HD2 LEU 6 1HD2 LEU 6 -4.713 -9.043 -4.267
496 2HD2 LEU 6 2HD2 LEU 6 -4.721 -8.792 -2.514
497 3HD2 LEU 6 3HD2 LEU 6 -3.520 -9.858 -3.233
498 H LEU 7 H LEU 7 -9.702 -8.737 -1.222
499 HA LEU 7 HA LEU 7 -10.939 -7.367 -3.453
500 1HB LEU 7 1HB LEU 7 -11.716 -9.850 -3.296
501 2HB LEU 7 2HB LEU 7 -12.613 -9.329 -1.858
502 HG LEU 7 HG LEU 7 -13.001 -8.266 -4.670
503 1HD1 LEU 7 1HD1 LEU 7 -13.736 -10.571 -4.419
504 2HD1 LEU 7 2HD1 LEU 7 -14.529 -10.212 -2.870
505 3HD1 LEU 7 3HD1 LEU 7 -15.182 -9.543 -4.364
506 1HD2 LEU 7 1HD2 LEU 7 -14.474 -7.670 -2.055
507 2HD2 LEU 7 2HD2 LEU 7 -13.614 -6.502 -3.092
508 3HD2 LEU 7 3HD2 LEU 7 -15.090 -7.268 -3.671
509 H LYS 8 H LYS 8 -11.599 -8.437 -0.064
510 HA LYS 8 HA LYS 8 -12.938 -6.059 0.512
511 1HB LYS 8 1HB LYS 8 -12.704 -8.419 1.826
512 2HB LYS 8 2HB LYS 8 -11.570 -7.461 2.792
513 1HG LYS 8 1HG LYS 8 -13.438 -5.719 2.992
514 2HG LYS 8 2HG LYS 8 -14.505 -6.901 2.199
515 1HD LYS 8 1HD LYS 8 -13.760 -8.554 4.058
516 2HD LYS 8 2HD LYS 8 -13.082 -7.148 4.889
517 1HE LYS 8 1HE LYS 8 -16.006 -7.617 4.114
518 2HE LYS 8 2HE LYS 8 -15.329 -7.592 5.753
519 1HZ LYS 8 1HZ LYS 8 -14.800 -5.275 5.418
520 2HZ LYS 8 2HZ LYS 8 -15.460 -5.309 3.909
521 3HZ LYS 8 3HZ LYS 8 -16.414 -5.550 5.227
522 H LEU 9 H LEU 9 -9.593 -7.100 1.185
523 HA LEU 9 HA LEU 9 -8.852 -4.558 2.328
524 1HB LEU 9 1HB LEU 9 -7.297 -6.991 1.580
525 2HB LEU 9 2HB LEU 9 -6.503 -5.532 2.157
526 HG LEU 9 HG LEU 9 -8.792 -6.671 3.780
527 1HD1 LEU 9 1HD1 LEU 9 -7.582 -8.644 3.511
528 2HD1 LEU 9 2HD1 LEU 9 -5.997 -7.836 3.600
529 3HD1 LEU 9 3HD1 LEU 9 -7.014 -8.012 5.047
530 1HD2 LEU 9 1HD2 LEU 9 -6.201 -5.204 4.460
531 2HD2 LEU 9 2HD2 LEU 9 -7.864 -4.563 4.544
532 3HD2 LEU 9 3HD2 LEU 9 -7.350 -5.824 5.659
533 H GLU 10 H GLU 10 -8.951 -5.736 -1.053
534 HA GLU 10 HA GLU 10 -7.444 -3.550 -2.146
535 1HB GLU 10 1HB GLU 10 -9.728 -5.262 -3.212
536 2HB GLU 10 2HB GLU 10 -8.895 -4.015 -4.101
537 1HG GLU 10 1HG GLU 10 -7.448 -6.446 -2.971
538 2HG GLU 10 2HG GLU 10 -8.163 -6.401 -4.582
539 H LEU 11 H LEU 11 -10.930 -4.050 -1.341
540 HA LEU 11 HA LEU 11 -11.879 -1.800 -2.751
541 1HB LEU 11 1HB LEU 11 -13.282 -3.679 -1.782
542 2HB LEU 11 2HB LEU 11 -12.985 -3.017 -0.174
543 HG LEU 11 HG LEU 11 -14.084 -0.818 -1.100
544 1HD1 LEU 11 1HD1 LEU 11 -14.094 -1.515 -3.500
545 2HD1 LEU 11 2HD1 LEU 11 -15.170 -2.864 -3.086
546 3HD1 LEU 11 3HD1 LEU 11 -15.724 -1.190 -2.890
547 1HD2 LEU 11 1HD2 LEU 11 -15.712 -3.339 -0.627
548 2HD2 LEU 11 2HD2 LEU 11 -15.087 -2.233 0.617
549 3HD2 LEU 11 3HD2 LEU 11 -16.316 -1.670 -0.528
550 H GLN 12 H GLN 12 -10.954 -2.030 0.667
551 HA GLN 12 HA GLN 12 -11.516 0.604 1.480
552 1HB GLN 12 1HB GLN 12 -9.602 0.290 3.105
553 2HB GLN 12 2HB GLN 12 -10.870 -0.949 3.165
554 1HG GLN 12 1HG GLN 12 -9.561 -2.526 1.998
555 2HG GLN 12 2HG GLN 12 -8.398 -1.313 1.457
556 1HE2 GLN 12 2HE2 GLN 12 -6.816 -2.826 2.193
557 2HE2 GLN 12 1HE2 GLN 12 -6.352 -2.807 3.898
558 H LEU 13 H LEU 13 -8.908 -0.472 -0.689
559 HA LEU 13 HA LEU 13 -7.234 1.845 -0.250
560 1HB LEU 13 1HB LEU 13 -7.171 -0.013 -2.655
561 2HB LEU 13 2HB LEU 13 -5.958 1.116 -2.076
562 HG LEU 13 HG LEU 13 -6.742 -1.576 -0.972
563 1HD1 LEU 13 1HD1 LEU 13 -4.970 -1.451 -2.650
564 2HD1 LEU 13 2HD1 LEU 13 -4.131 -0.194 -1.710
565 3HD1 LEU 13 3HD1 LEU 13 -4.220 -1.832 -1.077
566 1HD2 LEU 13 1HD2 LEU 13 -4.956 0.351 0.522
567 2HD2 LEU 13 2HD2 LEU 13 -6.611 0.011 1.041
568 3HD2 LEU 13 3HD2 LEU 13 -5.427 -1.292 0.994
569 H ILE 14 H ILE 14 -9.503 0.714 -2.821
570 HA ILE 14 HA ILE 14 -9.380 3.129 -4.397
571 HB ILE 14 HB ILE 14 -11.346 0.816 -4.064
572 1HG1 ILE 14 1HG1 ILE 14 -10.727 0.312 -6.340
573 2HG1 ILE 14 2HG1 ILE 14 -9.865 1.841 -6.530
574 1HG2 ILE 14 1HG2 ILE 14 -12.835 2.710 -4.540
575 2HG2 ILE 14 2HG2 ILE 14 -11.772 3.252 -5.860
576 3HG2 ILE 14 3HG2 ILE 14 -12.651 1.722 -5.988
577 1HD1 ILE 14 1HD1 ILE 14 -8.097 1.102 -5.024
578 2HD1 ILE 14 2HD1 ILE 14 -9.011 -0.381 -4.640
579 3HD1 ILE 14 3HD1 ILE 14 -8.372 -0.095 -6.272
580 H LYS 15 H LYS 15 -11.272 2.259 -1.565
581 HA LYS 15 HA LYS 15 -12.838 4.652 -1.412
582 1HB LYS 15 1HB LYS 15 -12.547 2.261 0.066
583 2HB LYS 15 2HB LYS 15 -11.917 3.473 1.149
584 1HG LYS 15 1HG LYS 15 -14.170 3.294 1.699
585 2HG LYS 15 2HG LYS 15 -14.136 4.765 0.711
586 1HD LYS 15 1HD LYS 15 -14.942 3.478 -1.249
587 2HD LYS 15 2HD LYS 15 -14.780 1.958 -0.350
588 1HE LYS 15 1HE LYS 15 -16.491 2.765 1.295
589 2HE LYS 15 2HE LYS 15 -16.719 4.223 0.309
590 1HZ LYS 15 1HZ LYS 15 -17.400 2.801 -1.493
591 2HZ LYS 15 2HZ LYS 15 -17.167 1.454 -0.573
592 3HZ LYS 15 3HZ LYS 15 -18.338 2.536 -0.163
593 H GLN 16 H GLN 16 -9.671 3.752 0.058
594 HA GLN 16 HA GLN 16 -9.407 6.319 1.376
595 1HB GLN 16 1HB GLN 16 -7.513 3.983 0.897
596 2HB GLN 16 2HB GLN 16 -6.999 5.459 1.722
597 1HG GLN 16 1HG GLN 16 -9.394 3.812 2.649
598 2HG GLN 16 2HG GLN 16 -7.766 3.621 3.287
599 1HE2 GLN 16 2HE2 GLN 16 -10.688 5.414 3.536
600 2HE2 GLN 16 1HE2 GLN 16 -10.085 6.701 4.559
601 H TYR 17 H TYR 17 -8.419 5.101 -1.719
602 HA TYR 17 HA TYR 17 -6.581 7.151 -2.496
603 1HB TYR 17 1HB TYR 17 -8.348 5.097 -3.871
604 2HB TYR 17 2HB TYR 17 -7.648 6.359 -4.819
605 HD1 TYR 17 HD1 TYR 17 -7.163 3.076 -4.183
606 HD2 TYR 17 HD2 TYR 17 -5.041 6.807 -4.488
607 HE1 TYR 17 HE1 TYR 17 -5.225 1.881 -5.039
608 HE2 TYR 17 HE2 TYR 17 -3.103 5.596 -5.435
609 HH TYR 17 HH TYR 17 -2.972 2.046 -5.576
610 H ARG 18 H ARG 18 -10.142 6.833 -2.487
611 HA ARG 18 HA ARG 18 -10.482 9.316 -3.995
612 1HB ARG 18 1HB ARG 18 -12.415 7.457 -2.584
613 2HB ARG 18 2HB ARG 18 -12.886 9.092 -3.072
614 1HG ARG 18 1HG ARG 18 -12.148 8.639 -5.391
615 2HG ARG 18 2HG ARG 18 -11.763 6.967 -4.952
616 1HD ARG 18 1HD ARG 18 -14.531 8.204 -4.558
617 2HD ARG 18 2HD ARG 18 -14.020 7.440 -6.080
618 HE ARG 18 HE ARG 18 -13.448 5.612 -4.028
619 1HH1 ARG 18 1HH2 ARG 18 -16.248 7.150 -5.508
620 2HH1 ARG 18 2HH2 ARG 18 -17.253 5.728 -5.497
621 1HH2 ARG 18 1HH1 ARG 18 -14.716 3.704 -4.035
622 2HH2 ARG 18 2HH1 ARG 18 -16.351 3.708 -4.637
623 H GLU 19 H GLU 19 -10.649 8.297 -0.643
624 HA GLU 19 HA GLU 19 -11.178 10.815 0.528
625 1HB GLU 19 1HB GLU 19 -10.982 8.538 1.696
626 2HB GLU 19 2HB GLU 19 -9.233 8.838 1.734
627 1HG GLU 19 1HG GLU 19 -9.627 10.961 2.949
628 2HG GLU 19 2HG GLU 19 -11.374 10.659 2.910
629 H ALA 20 H ALA 20 -8.076 9.412 -0.619
630 HA ALA 20 HA ALA 20 -6.662 11.976 -0.003
631 1HB ALA 20 1HB ALA 20 -5.635 9.944 0.916
632 2HB ALA 20 2HB ALA 20 -5.810 9.132 -0.635
633 3HB ALA 20 3HB ALA 20 -4.635 10.442 -0.455
634 H LEU 21 H LEU 21 -8.593 11.433 -2.415
635 HA LEU 21 HA LEU 21 -6.717 11.814 -4.664
636 1HB LEU 21 1HB LEU 21 -8.665 10.522 -5.134
637 2HB LEU 21 2HB LEU 21 -9.733 11.715 -4.385
638 HG LEU 21 HG LEU 21 -9.315 13.301 -6.220
639 1HD1 LEU 21 1HD1 LEU 21 -7.041 12.632 -6.901
640 2HD1 LEU 21 2HD1 LEU 21 -7.640 11.028 -7.365
641 3HD1 LEU 21 3HD1 LEU 21 -8.151 12.474 -8.267
642 1HD2 LEU 21 1HD2 LEU 21 -10.180 10.509 -7.061
643 2HD2 LEU 21 2HD2 LEU 21 -11.195 11.726 -6.267
644 3HD2 LEU 21 3HD2 LEU 21 -10.580 12.031 -7.899
645 H GLU 22 H GLU 22 -9.398 13.604 -3.201
646 HA GLU 22 HA GLU 22 -9.010 15.930 -4.830
647 1HB GLU 22 1HB GLU 22 -10.588 15.479 -2.253
648 2HB GLU 22 2HB GLU 22 -10.675 16.965 -3.202
649 1HG GLU 22 1HG GLU 22 -11.283 14.279 -4.512
650 2HG GLU 22 2HG GLU 22 -12.491 15.134 -3.552
651 H TYR 23 H TYR 23 -8.047 15.065 -1.526
652 HA TYR 23 HA TYR 23 -6.849 17.573 -0.879
653 1HB TYR 23 1HB TYR 23 -6.732 14.722 0.094
654 2HB TYR 23 2HB TYR 23 -5.495 15.823 0.629
655 HD1 TYR 23 HD1 TYR 23 -6.316 18.165 1.557
656 HD2 TYR 23 HD2 TYR 23 -8.771 14.628 1.332
657 HE1 TYR 23 HE1 TYR 23 -7.853 19.117 3.258
658 HE2 TYR 23 HE2 TYR 23 -10.284 15.567 3.040
659 HH TYR 23 HH TYR 23 -10.726 17.347 4.424
660 H VAL 24 H VAL 24 -5.730 14.834 -2.855
661 HA VAL 24 HA VAL 24 -2.957 15.909 -2.787
662 HB VAL 24 HB VAL 24 -4.112 13.383 -3.968
663 1HG1 VAL 24 1HG1 VAL 24 -2.149 14.003 -5.294
664 2HG1 VAL 24 2HG1 VAL 24 -1.214 14.330 -3.821
665 3HG1 VAL 24 3HG1 VAL 24 -1.731 12.675 -4.213
666 1HG2 VAL 24 1HG2 VAL 24 -2.258 13.907 -1.580
667 2HG2 VAL 24 2HG2 VAL 24 -3.976 13.516 -1.439
668 3HG2 VAL 24 3HG2 VAL 24 -2.855 12.323 -2.111
669 H LYS 25 H LYS 25 -5.751 16.056 -4.888
670 HA LYS 25 HA LYS 25 -6.115 17.244 -6.790
671 1HB LYS 25 1HB LYS 25 -3.719 18.749 -5.683
672 2HB LYS 25 2HB LYS 25 -4.472 19.242 -7.183
673 1HG LYS 25 1HG LYS 25 -6.401 18.779 -5.000
674 2HG LYS 25 2HG LYS 25 -5.257 20.059 -4.652
675 1HD LYS 25 1HD LYS 25 -6.794 19.913 -7.287
676 2HD LYS 25 2HD LYS 25 -7.466 20.688 -5.845
677 1HE LYS 25 1HE LYS 25 -5.615 22.275 -5.726
678 2HE LYS 25 2HE LYS 25 -4.784 21.490 -7.077
679 1HZ LYS 25 1HZ LYS 25 -6.588 22.105 -8.491
680 2HZ LYS 25 2HZ LYS 25 -7.399 22.810 -7.240
681 3HZ LYS 25 3HZ LYS 25 -5.965 23.438 -7.753
682 H LEU 26 H LEU 26 -4.316 14.810 -6.991
683 HA LEU 26 HA LEU 26 -3.168 15.426 -9.693
684 1HB LEU 26 1HB LEU 26 -2.223 13.768 -7.511
685 2HB LEU 26 2HB LEU 26 -2.370 12.832 -8.990
686 HG LEU 26 HG LEU 26 -0.901 15.482 -8.908
687 1HD1 LEU 26 1HD1 LEU 26 0.179 14.000 -7.267
688 2HD1 LEU 26 2HD1 LEU 26 0.175 12.663 -8.429
689 3HD1 LEU 26 3HD1 LEU 26 1.190 14.087 -8.719
690 1HD2 LEU 26 1HD2 LEU 26 -0.464 13.074 -10.747
691 2HD2 LEU 26 2HD2 LEU 26 -1.519 14.424 -11.203
692 3HD2 LEU 26 3HD2 LEU 26 0.212 14.682 -10.921
693 HA PRO 27 HA PRO 27 -6.997 13.096 -10.709
694 1HB PRO 27 1HB PRO 27 -6.784 13.178 -13.453
695 2HB PRO 27 2HB PRO 27 -7.461 14.496 -12.459
696 1HG PRO 27 1HG PRO 27 -4.649 14.256 -13.539
697 2HG PRO 27 2HG PRO 27 -5.724 15.682 -13.588
698 1HD PRO 27 1HD PRO 27 -3.796 15.429 -11.725
699 2HD PRO 27 2HD PRO 27 -5.378 16.119 -11.262
700 H VAL 28 H VAL 28 -3.637 12.597 -11.739
701 HA VAL 28 HA VAL 28 -3.636 10.022 -12.715
702 HB VAL 28 HB VAL 28 -1.760 11.298 -10.777
703 1HG1 VAL 28 1HG1 VAL 28 -1.372 8.950 -10.487
704 2HG1 VAL 28 2HG1 VAL 28 -1.458 8.652 -12.241
705 3HG1 VAL 28 3HG1 VAL 28 -0.095 9.535 -11.543
706 1HG2 VAL 28 1HG2 VAL 28 -1.426 10.727 -13.764
707 2HG2 VAL 28 2HG2 VAL 28 -1.779 12.333 -13.080
708 3HG2 VAL 28 3HG2 VAL 28 -0.244 11.526 -12.729
709 H LEU 29 H LEU 29 -4.259 10.948 -9.239
710 HA LEU 29 HA LEU 29 -3.975 8.269 -8.298
711 1HB LEU 29 1HB LEU 29 -5.121 10.878 -7.254
712 2HB LEU 29 2HB LEU 29 -5.633 9.370 -6.540
713 HG LEU 29 HG LEU 29 -3.173 8.739 -6.284
714 1HD1 LEU 29 1HD1 LEU 29 -2.201 10.432 -7.816
715 2HD1 LEU 29 2HD1 LEU 29 -2.831 11.719 -6.758
716 3HD1 LEU 29 3HD1 LEU 29 -1.570 10.614 -6.171
717 1HD2 LEU 29 1HD2 LEU 29 -4.612 9.439 -4.398
718 2HD2 LEU 29 2HD2 LEU 29 -2.959 10.042 -4.195
719 3HD2 LEU 29 3HD2 LEU 29 -4.241 11.139 -4.749
720 H ALA 30 H ALA 30 -6.809 10.214 -9.377
721 HA ALA 30 HA ALA 30 -8.699 8.116 -8.840
722 1HB ALA 30 1HB ALA 30 -9.358 10.491 -9.236
723 2HB ALA 30 2HB ALA 30 -8.846 10.357 -10.928
724 3HB ALA 30 3HB ALA 30 -10.200 9.378 -10.329
725 H LYS 31 H LYS 31 -6.554 8.981 -11.601
726 HA LYS 31 HA LYS 31 -7.832 7.176 -13.427
727 1HB LYS 31 1HB LYS 31 -6.085 9.226 -13.780
728 2HB LYS 31 2HB LYS 31 -4.919 7.903 -13.750
729 1HG LYS 31 1HG LYS 31 -5.448 8.212 -16.023
730 2HG LYS 31 2HG LYS 31 -6.387 6.780 -15.562
731 1HD LYS 31 1HD LYS 31 -8.425 8.204 -15.305
732 2HD LYS 31 2HD LYS 31 -7.461 9.653 -15.646
733 1HE LYS 31 1HE LYS 31 -6.947 8.744 -17.922
734 2HE LYS 31 2HE LYS 31 -7.958 7.329 -17.565
735 1HZ LYS 31 1HZ LYS 31 -9.816 8.798 -17.298
736 2HZ LYS 31 2HZ LYS 31 -8.879 10.117 -17.616
737 3HZ LYS 31 3HZ LYS 31 -9.142 8.991 -18.791
738 H ILE 32 H ILE 32 -5.085 6.870 -11.281
739 HA ILE 32 HA ILE 32 -4.201 4.241 -12.022
740 HB ILE 32 HB ILE 32 -3.949 6.014 -9.565
741 1HG1 ILE 32 1HG1 ILE 32 -1.841 4.701 -11.337
742 2HG1 ILE 32 2HG1 ILE 32 -2.513 6.312 -11.615
743 1HG2 ILE 32 1HG2 ILE 32 -4.209 3.938 -8.472
744 2HG2 ILE 32 2HG2 ILE 32 -3.310 3.065 -9.716
745 3HG2 ILE 32 3HG2 ILE 32 -2.473 4.141 -8.581
746 1HD1 ILE 32 1HD1 ILE 32 -1.739 6.962 -9.287
747 2HD1 ILE 32 2HD1 ILE 32 -0.839 5.431 -9.227
748 3HD1 ILE 32 3HD1 ILE 32 -0.449 6.625 -10.464
749 H LEU 33 H LEU 33 -6.456 5.600 -9.558
750 HA LEU 33 HA LEU 33 -6.836 3.049 -8.524
751 1HB LEU 33 1HB LEU 33 -8.170 4.062 -6.866
752 2HB LEU 33 2HB LEU 33 -7.095 5.349 -7.409
753 HG LEU 33 HG LEU 33 -8.964 6.058 -8.932
754 1HD1 LEU 33 1HD1 LEU 33 -10.714 4.708 -9.156
755 2HD1 LEU 33 2HD1 LEU 33 -10.298 3.786 -7.699
756 3HD1 LEU 33 3HD1 LEU 33 -11.226 5.300 -7.578
757 1HD2 LEU 33 1HD2 LEU 33 -9.448 6.145 -5.963
758 2HD2 LEU 33 2HD2 LEU 33 -8.252 7.154 -6.830
759 3HD2 LEU 33 3HD2 LEU 33 -9.985 7.356 -7.151
760 H GLU 34 H GLU 34 -8.556 4.851 -10.994
761 HA GLU 34 HA GLU 34 -10.893 3.302 -11.213
762 1HB GLU 34 1HB GLU 34 -10.181 5.477 -12.463
763 2HB GLU 34 2HB GLU 34 -9.211 4.477 -13.508
764 1HG GLU 34 1HG GLU 34 -11.270 3.214 -14.198
765 2HG GLU 34 2HG GLU 34 -12.236 4.245 -13.130
766 H ASP 35 H ASP 35 -7.727 2.940 -12.715
767 HA ASP 35 HA ASP 35 -8.198 0.521 -14.132
768 1HB ASP 35 1HB ASP 35 -6.124 2.229 -13.989
769 2HB ASP 35 2HB ASP 35 -5.500 0.975 -12.898
770 H GLU 36 H GLU 36 -6.832 1.080 -10.855
771 HA GLU 36 HA GLU 36 -6.553 -1.603 -10.089
772 1HB GLU 36 1HB GLU 36 -7.347 0.685 -8.265
773 2HB GLU 36 2HB GLU 36 -6.683 -0.876 -7.799
774 1HG GLU 36 1HG GLU 36 -4.904 0.374 -9.764
775 2HG GLU 36 2HG GLU 36 -5.268 1.540 -8.495
776 H GLU 37 H GLU 37 -9.486 0.495 -9.856
777 HA GLU 37 HA GLU 37 -11.172 -1.263 -8.563
778 1HB GLU 37 1HB GLU 37 -11.286 1.280 -9.641
779 2HB GLU 37 2HB GLU 37 -12.270 0.445 -10.822
780 1HG GLU 37 1HG GLU 37 -12.656 0.222 -7.802
781 2HG GLU 37 2HG GLU 37 -13.275 1.555 -8.775
782 H LYS 38 H LYS 38 -10.449 -1.076 -12.076
783 HA LYS 38 HA LYS 38 -12.180 -3.246 -12.822
784 1HB LYS 38 1HB LYS 38 -11.064 -1.529 -14.350
785 2HB LYS 38 2HB LYS 38 -9.561 -2.442 -14.142
786 1HG LYS 38 1HG LYS 38 -10.857 -4.515 -14.951
787 2HG LYS 38 2HG LYS 38 -12.178 -3.407 -15.359
788 1HD LYS 38 1HD LYS 38 -10.616 -2.166 -16.885
789 2HD LYS 38 2HD LYS 38 -9.294 -3.233 -16.389
790 1HE LYS 38 1HE LYS 38 -10.157 -3.982 -18.546
791 2HE LYS 38 2HE LYS 38 -10.502 -5.202 -17.309
792 1HZ LYS 38 1HZ LYS 38 -12.731 -4.350 -17.177
793 2HZ LYS 38 2HZ LYS 38 -12.407 -3.200 -18.310
794 3HZ LYS 38 3HZ LYS 38 -12.383 -4.796 -18.722
795 H HIS 39 H HIS 39 -8.699 -3.176 -11.939
796 HA HIS 39 HA HIS 39 -8.193 -5.942 -12.310
797 1HB HIS 39 1HB HIS 39 -6.997 -3.840 -10.476
798 2HB HIS 39 2HB HIS 39 -6.442 -5.487 -10.435
799 HD1 HIS 39 HD1 HIS 39 -5.926 -6.380 -13.221
800 HD2 HIS 39 HD2 HIS 39 -5.593 -2.330 -12.108
801 HE1 HIS 39 HE1 HIS 39 -4.429 -5.263 -14.969
802 HE2 HIS 39 HE2 HIS 39 -4.223 -2.788 -14.261
803 H ILE 40 H ILE 40 -9.538 -4.246 -9.513
804 HA ILE 40 HA ILE 40 -9.626 -6.583 -7.805
805 HB ILE 40 HB ILE 40 -11.075 -3.909 -7.617
806 1HG1 ILE 40 1HG1 ILE 40 -8.628 -4.773 -6.070
807 2HG1 ILE 40 2HG1 ILE 40 -8.390 -4.051 -7.613
808 1HG2 ILE 40 1HG2 ILE 40 -12.115 -5.658 -6.144
809 2HG2 ILE 40 2HG2 ILE 40 -10.515 -6.091 -5.522
810 3HG2 ILE 40 3HG2 ILE 40 -11.215 -4.511 -5.154
811 1HD1 ILE 40 1HD1 ILE 40 -9.566 -2.027 -7.033
812 2HD1 ILE 40 2HD1 ILE 40 -9.988 -2.646 -5.438
813 3HD1 ILE 40 3HD1 ILE 40 -8.281 -2.366 -5.857
814 H GLU 41 H GLU 41 -11.837 -4.903 -10.047
815 HA GLU 41 HA GLU 41 -14.163 -6.288 -9.426
816 1HB GLU 41 1HB GLU 41 -13.884 -4.297 -11.041
817 2HB GLU 41 2HB GLU 41 -13.363 -5.482 -12.251
818 1HG GLU 41 1HG GLU 41 -15.744 -6.569 -11.253
819 2HG GLU 41 2HG GLU 41 -16.047 -4.832 -11.235
820 H TRP 42 H TRP 42 -11.402 -7.225 -11.575
821 HA TRP 42 HA TRP 42 -12.453 -9.529 -12.641
822 1HB TRP 42 1HB TRP 42 -10.141 -8.467 -12.937
823 2HB TRP 42 2HB TRP 42 -9.653 -9.343 -11.493
824 HD1 TRP 42 HD1 TRP 42 -11.149 -10.029 -14.901
825 HE1 TRP 42 HE1 TRP 42 -10.744 -12.529 -15.579
826 HE3 TRP 42 HE3 TRP 42 -9.002 -11.573 -10.643
827 HZ2 TRP 42 HZ2 TRP 42 -9.603 -14.889 -14.311
828 HZ3 TRP 42 HZ3 TRP 42 -8.343 -13.963 -10.295
829 HH2 TRP 42 HH2 TRP 42 -8.612 -15.613 -12.138
830 H LEU 43 H LEU 43 -11.079 -9.067 -9.386
831 HA LEU 43 HA LEU 43 -11.300 -11.893 -8.668
832 1HB LEU 43 1HB LEU 43 -10.987 -9.432 -6.896
833 2HB LEU 43 2HB LEU 43 -11.099 -11.088 -6.327
834 HG LEU 43 HG LEU 43 -9.111 -11.275 -8.294
835 1HD1 LEU 43 1HD1 LEU 43 -8.924 -8.837 -8.433
836 2HD1 LEU 43 2HD1 LEU 43 -8.694 -8.713 -6.683
837 3HD1 LEU 43 3HD1 LEU 43 -7.482 -9.534 -7.676
838 1HD2 LEU 43 1HD2 LEU 43 -8.984 -11.006 -5.284
839 2HD2 LEU 43 2HD2 LEU 43 -9.067 -12.495 -6.228
840 3HD2 LEU 43 3HD2 LEU 43 -7.599 -11.501 -6.284
841 H GLU 44 H GLU 44 -13.409 -9.016 -8.211
842 HA GLU 44 HA GLU 44 -15.060 -10.545 -6.473
843 1HB GLU 44 1HB GLU 44 -16.333 -8.634 -6.083
844 2HB GLU 44 2HB GLU 44 -14.719 -7.999 -6.474
845 1HG GLU 44 1HG GLU 44 -15.611 -7.790 -8.865
846 2HG GLU 44 2HG GLU 44 -17.201 -8.157 -8.208
847 H THR 45 H THR 45 -14.910 -10.551 -9.702
848 HA THR 45 HA THR 45 -17.737 -11.361 -10.232
849 HB THR 45 HB THR 45 -16.488 -9.266 -11.237
850 HG1 THR 45 HG1 THR 45 -17.930 -9.330 -12.898
851 1HG2 THR 45 1HG2 THR 45 -14.595 -10.465 -12.284
852 2HG2 THR 45 2HG2 THR 45 -15.745 -11.285 -13.367
853 3HG2 THR 45 3HG2 THR 45 -15.555 -9.527 -13.425
854 H ILE 46 H ILE 46 -14.371 -11.998 -10.753
855 HA ILE 46 HA ILE 46 -13.188 -13.691 -11.717
856 HB ILE 46 HB ILE 46 -13.158 -13.966 -9.425
857 1HG1 ILE 46 1HG1 ILE 46 -12.723 -16.251 -8.984
858 2HG1 ILE 46 2HG1 ILE 46 -13.607 -16.800 -10.402
859 1HG2 ILE 46 1HG2 ILE 46 -15.401 -13.787 -8.754
860 2HG2 ILE 46 2HG2 ILE 46 -15.850 -15.302 -9.569
861 3HG2 ILE 46 3HG2 ILE 46 -14.797 -15.308 -8.125
862 1HD1 ILE 46 1HD1 ILE 46 -11.989 -15.644 -11.876
863 2HD1 ILE 46 2HD1 ILE 46 -11.203 -14.917 -10.454
864 3HD1 ILE 46 3HD1 ILE 46 -11.112 -16.671 -10.726
865 H LEU 47 H LEU 47 -14.960 -13.222 -13.509
866 HA LEU 47 HA LEU 47 -16.665 -15.376 -14.238
867 1HB LEU 47 1HB LEU 47 -16.795 -12.938 -14.939
868 2HB LEU 47 2HB LEU 47 -15.466 -13.245 -16.054
869 HG LEU 47 HG LEU 47 -17.379 -15.308 -16.561
870 1HD1 LEU 47 1HD1 LEU 47 -19.025 -13.986 -15.263
871 2HD1 LEU 47 2HD1 LEU 47 -18.736 -12.589 -16.324
872 3HD1 LEU 47 3HD1 LEU 47 -19.454 -14.073 -16.983
873 1HD2 LEU 47 1HD2 LEU 47 -16.863 -12.709 -18.065
874 2HD2 LEU 47 2HD2 LEU 47 -15.950 -14.226 -18.244
875 3HD2 LEU 47 3HD2 LEU 47 -17.657 -14.158 -18.721
876 H GLY 48 H GLY 48 -13.354 -14.448 -15.295
877 1HA GLY 48 1HA GLY 48 -12.318 -16.962 -15.767
878 2HA GLY 48 2HA GLY 48 -13.138 -16.514 -17.283
879 1HN NH2 49 1HN NH2 49 -10.526 -16.792 -17.638
880 2HN NH2 49 2HN NH2 49 -9.686 -15.219 -17.691
Start of MODEL 2
1 1H ACE 0 H1 ACE 0 -2.412 4.608 5.058
2 2H ACE 0 H2 ACE 0 -1.093 3.709 5.839
3 3H ACE 0 H3 ACE 0 -2.745 3.050 5.846
4 H ASP 1 H ASP 1 -1.209 1.214 4.969
5 HA ASP 1 HA ASP 1 -0.393 1.533 2.189
6 1HB ASP 1 1HB ASP 1 0.743 0.209 4.091
7 2HB ASP 1 2HB ASP 1 -0.404 -1.078 3.726
8 H TYR 2 H TYR 2 -3.271 0.633 3.679
9 HA TYR 2 HA TYR 2 -4.683 -1.313 2.788
10 1HB TYR 2 1HB TYR 2 -6.571 0.075 2.688
11 2HB TYR 2 2HB TYR 2 -5.509 0.602 3.960
12 HD1 TYR 2 HD1 TYR 2 -7.019 1.564 0.739
13 HD2 TYR 2 HD2 TYR 2 -4.473 2.780 3.984
14 HE1 TYR 2 HE1 TYR 2 -7.006 3.902 -0.130
15 HE2 TYR 2 HE2 TYR 2 -4.368 5.070 3.056
16 HH TYR 2 HH TYR 2 -5.004 6.457 1.329
17 H LEU 3 H LEU 3 -4.148 1.349 0.464
18 HA LEU 3 HA LEU 3 -5.383 -0.087 -1.645
19 1HB LEU 3 1HB LEU 3 -3.564 2.313 -1.456
20 2HB LEU 3 2HB LEU 3 -3.583 1.529 -3.033
21 HG LEU 3 HG LEU 3 -6.176 2.305 -1.679
22 1HD1 LEU 3 1HD1 LEU 3 -4.785 4.344 -1.836
23 2HD1 LEU 3 2HD1 LEU 3 -4.454 4.000 -3.547
24 3HD1 LEU 3 3HD1 LEU 3 -6.103 4.395 -3.018
25 1HD2 LEU 3 1HD2 LEU 3 -5.389 1.878 -4.601
26 2HD2 LEU 3 2HD2 LEU 3 -6.292 0.724 -3.603
27 3HD2 LEU 3 3HD2 LEU 3 -7.006 2.294 -4.005
28 H ARG 4 H ARG 4 -1.916 0.044 -0.902
29 HA ARG 4 HA ARG 4 -1.319 -1.839 -3.052
30 1HB ARG 4 1HB ARG 4 0.328 -0.971 -0.648
31 2HB ARG 4 2HB ARG 4 0.876 -2.017 -1.966
32 1HG ARG 4 1HG ARG 4 0.146 -0.108 -3.567
33 2HG ARG 4 2HG ARG 4 0.079 0.920 -2.127
34 1HD ARG 4 1HD ARG 4 2.500 -0.670 -3.100
35 2HD ARG 4 2HD ARG 4 2.238 1.074 -3.338
36 HE ARG 4 HE ARG 4 2.040 0.513 -0.557
37 1HH1 ARG 4 1HH2 ARG 4 4.448 0.462 -3.121
38 2HH1 ARG 4 2HH2 ARG 4 5.778 0.949 -2.105
39 1HH2 ARG 4 1HH1 ARG 4 3.705 1.153 0.794
40 2HH2 ARG 4 2HH1 ARG 4 5.337 1.384 0.210
41 H GLU 5 H GLU 5 -2.864 -2.128 0.017
42 HA GLU 5 HA GLU 5 -1.778 -4.829 0.570
43 1HB GLU 5 1HB GLU 5 -4.239 -3.476 1.751
44 2HB GLU 5 2HB GLU 5 -3.659 -5.071 2.138
45 1HG GLU 5 1HG GLU 5 -1.477 -3.108 2.378
46 2HG GLU 5 2HG GLU 5 -2.861 -2.684 3.391
47 H LEU 6 H LEU 6 -4.519 -3.255 -1.067
48 HA LEU 6 HA LEU 6 -5.490 -5.900 -2.001
49 1HB LEU 6 1HB LEU 6 -6.744 -3.185 -2.026
50 2HB LEU 6 2HB LEU 6 -7.435 -4.612 -2.835
51 HG LEU 6 HG LEU 6 -6.801 -4.477 0.137
52 1HD1 LEU 6 1HD1 LEU 6 -8.594 -2.929 -0.681
53 2HD1 LEU 6 2HD1 LEU 6 -9.434 -4.343 -1.350
54 3HD1 LEU 6 3HD1 LEU 6 -9.154 -4.212 0.399
55 1HD2 LEU 6 1HD2 LEU 6 -8.058 -6.630 -1.572
56 2HD2 LEU 6 2HD2 LEU 6 -6.702 -6.780 -0.442
57 3HD2 LEU 6 3HD2 LEU 6 -8.318 -6.515 0.182
58 H LEU 7 H LEU 7 -2.950 -4.826 -2.907
59 HA LEU 7 HA LEU 7 -3.638 -5.281 -5.645
60 1HB LEU 7 1HB LEU 7 -3.474 -2.688 -5.279
61 2HB LEU 7 2HB LEU 7 -1.738 -2.951 -5.154
62 HG LEU 7 HG LEU 7 -2.320 -2.208 -7.357
63 1HD1 LEU 7 1HD1 LEU 7 -0.541 -3.990 -7.168
64 2HD1 LEU 7 2HD1 LEU 7 -1.761 -5.153 -7.759
65 3HD1 LEU 7 3HD1 LEU 7 -1.286 -3.782 -8.761
66 1HD2 LEU 7 1HD2 LEU 7 -3.771 -3.872 -8.820
67 2HD2 LEU 7 2HD2 LEU 7 -4.491 -4.305 -7.282
68 3HD2 LEU 7 3HD2 LEU 7 -4.519 -2.626 -7.795
69 H LYS 8 H LYS 8 -0.817 -4.605 -3.527
70 HA LYS 8 HA LYS 8 0.874 -6.017 -5.234
71 1HB LYS 8 1HB LYS 8 1.335 -4.307 -3.231
72 2HB LYS 8 2HB LYS 8 1.504 -5.790 -2.279
73 1HG LYS 8 1HG LYS 8 3.207 -6.573 -3.999
74 2HG LYS 8 2HG LYS 8 3.036 -4.996 -4.801
75 1HD LYS 8 1HD LYS 8 3.692 -3.891 -2.605
76 2HD LYS 8 2HD LYS 8 4.003 -5.511 -1.951
77 1HE LYS 8 1HE LYS 8 5.660 -5.891 -3.821
78 2HE LYS 8 2HE LYS 8 5.393 -4.220 -4.354
79 1HZ LYS 8 1HZ LYS 8 6.167 -3.495 -2.201
80 2HZ LYS 8 2HZ LYS 8 6.435 -5.056 -1.739
81 3HZ LYS 8 3HZ LYS 8 7.311 -4.400 -2.971
82 H LEU 9 H LEU 9 -0.864 -6.960 -2.294
83 HA LEU 9 HA LEU 9 0.014 -9.710 -2.229
84 1HB LEU 9 1HB LEU 9 -2.446 -8.316 -1.141
85 2HB LEU 9 2HB LEU 9 -2.145 -10.024 -0.895
86 HG LEU 9 HG LEU 9 0.020 -8.052 -0.116
87 1HD1 LEU 9 1HD1 LEU 9 -1.933 -7.133 1.002
88 2HD1 LEU 9 2HD1 LEU 9 -2.423 -8.740 1.573
89 3HD1 LEU 9 3HD1 LEU 9 -0.934 -7.981 2.184
90 1HD2 LEU 9 1HD2 LEU 9 -0.900 -10.714 1.071
91 2HD2 LEU 9 2HD2 LEU 9 0.432 -10.525 -0.087
92 3HD2 LEU 9 3HD2 LEU 9 0.554 -9.797 1.521
93 H GLU 10 H GLU 10 -2.798 -7.994 -3.728
94 HA GLU 10 HA GLU 10 -4.102 -10.246 -4.725
95 1HB GLU 10 1HB GLU 10 -3.945 -7.570 -6.104
96 2HB GLU 10 2HB GLU 10 -5.119 -8.872 -6.297
97 1HG GLU 10 1HG GLU 10 -4.826 -7.179 -3.818
98 2HG GLU 10 2HG GLU 10 -6.108 -7.038 -5.013
99 H LEU 11 H LEU 11 -1.342 -8.439 -6.163
100 HA LEU 11 HA LEU 11 -1.436 -9.803 -8.694
101 1HB LEU 11 1HB LEU 11 -0.121 -7.659 -8.046
102 2HB LEU 11 2HB LEU 11 1.045 -8.735 -7.274
103 HG LEU 11 HG LEU 11 1.173 -9.919 -9.621
104 1HD1 LEU 11 1HD1 LEU 11 -0.801 -8.752 -10.621
105 2HD1 LEU 11 2HD1 LEU 11 0.035 -7.198 -10.422
106 3HD1 LEU 11 3HD1 LEU 11 0.685 -8.426 -11.524
107 1HD2 LEU 11 1HD2 LEU 11 2.279 -7.117 -9.192
108 2HD2 LEU 11 2HD2 LEU 11 3.011 -8.642 -8.642
109 3HD2 LEU 11 3HD2 LEU 11 2.876 -8.303 -10.375
110 H GLN 12 H GLN 12 0.148 -10.628 -5.619
111 HA GLN 12 HA GLN 12 1.770 -12.786 -6.532
112 1HB GLN 12 1HB GLN 12 0.235 -12.548 -3.926
113 2HB GLN 12 2HB GLN 12 1.575 -13.655 -4.220
114 1HG GLN 12 1HG GLN 12 3.164 -11.849 -4.446
115 2HG GLN 12 2HG GLN 12 1.894 -10.629 -4.387
116 1HE2 GLN 12 2HE2 GLN 12 0.851 -12.852 -2.122
117 2HE2 GLN 12 1HE2 GLN 12 1.635 -12.146 -0.728
118 H LEU 13 H LEU 13 -1.671 -12.570 -5.820
119 HA LEU 13 HA LEU 13 -2.297 -15.327 -5.654
120 1HB LEU 13 1HB LEU 13 -4.167 -13.206 -6.758
121 2HB LEU 13 2HB LEU 13 -4.574 -14.710 -5.944
122 HG LEU 13 HG LEU 13 -3.197 -12.327 -4.637
123 1HD1 LEU 13 1HD1 LEU 13 -5.452 -11.844 -5.497
124 2HD1 LEU 13 2HD1 LEU 13 -6.079 -13.249 -4.650
125 3HD1 LEU 13 3HD1 LEU 13 -5.373 -11.863 -3.732
126 1HD2 LEU 13 1HD2 LEU 13 -4.321 -14.882 -3.446
127 2HD2 LEU 13 2HD2 LEU 13 -2.613 -14.414 -3.513
128 3HD2 LEU 13 3HD2 LEU 13 -3.735 -13.474 -2.537
129 H ILE 14 H ILE 14 -2.698 -12.967 -8.369
130 HA ILE 14 HA ILE 14 -3.502 -14.896 -10.283
131 HB ILE 14 HB ILE 14 -2.242 -12.120 -10.391
132 1HG1 ILE 14 1HG1 ILE 14 -4.373 -11.768 -11.741
133 2HG1 ILE 14 2HG1 ILE 14 -4.852 -13.415 -11.368
134 1HG2 ILE 14 1HG2 ILE 14 -1.157 -13.204 -12.310
135 2HG2 ILE 14 2HG2 ILE 14 -2.716 -13.870 -12.847
136 3HG2 ILE 14 3HG2 ILE 14 -2.434 -12.123 -12.867
137 1HD1 ILE 14 1HD1 ILE 14 -4.964 -12.834 -8.973
138 2HD1 ILE 14 2HD1 ILE 14 -4.276 -11.224 -9.326
139 3HD1 ILE 14 3HD1 ILE 14 -5.883 -11.673 -9.935
140 H LYS 15 H LYS 15 -0.274 -14.043 -9.173
141 HA LYS 15 HA LYS 15 1.100 -15.780 -11.019
142 1HB LYS 15 1HB LYS 15 1.922 -13.887 -9.188
143 2HB LYS 15 2HB LYS 15 2.268 -15.368 -8.299
144 1HG LYS 15 1HG LYS 15 4.244 -14.838 -9.459
145 2HG LYS 15 2HG LYS 15 3.530 -16.179 -10.368
146 1HD LYS 15 1HD LYS 15 2.572 -14.491 -12.001
147 2HD LYS 15 2HD LYS 15 3.306 -13.193 -11.048
148 1HE LYS 15 1HE LYS 15 5.560 -14.104 -11.513
149 2HE LYS 15 2HE LYS 15 4.845 -15.466 -12.399
150 1HZ LYS 15 1HZ LYS 15 3.945 -13.900 -13.958
151 2HZ LYS 15 2HZ LYS 15 4.605 -12.632 -13.138
152 3HZ LYS 15 3HZ LYS 15 5.582 -13.744 -13.863
153 H GLN 16 H GLN 16 -0.143 -16.271 -7.670
154 HA GLN 16 HA GLN 16 0.912 -18.967 -7.487
155 1HB GLN 16 1HB GLN 16 -1.135 -17.422 -5.862
156 2HB GLN 16 2HB GLN 16 -0.632 -19.076 -5.475
157 1HG GLN 16 1HG GLN 16 1.696 -18.403 -5.246
158 2HG GLN 16 2HG GLN 16 1.345 -16.767 -5.778
159 1HE2 GLN 16 2HE2 GLN 16 1.278 -18.973 -3.089
160 2HE2 GLN 16 1HE2 GLN 16 0.735 -17.787 -1.900
161 H TYR 17 H TYR 17 -2.058 -17.614 -8.710
162 HA TYR 17 HA TYR 17 -3.619 -19.996 -8.909
163 1HB TYR 17 1HB TYR 17 -3.642 -17.188 -10.008
164 2HB TYR 17 2HB TYR 17 -4.448 -18.361 -10.983
165 HD1 TYR 17 HD1 TYR 17 -4.622 -16.483 -7.816
166 HD2 TYR 17 HD2 TYR 17 -6.545 -19.413 -10.314
167 HE1 TYR 17 HE1 TYR 17 -6.691 -16.166 -6.562
168 HE2 TYR 17 HE2 TYR 17 -8.602 -19.205 -8.929
169 HH TYR 17 HH TYR 17 -8.856 -16.830 -6.264
170 H ARG 18 H ARG 18 -1.112 -18.512 -10.877
171 HA ARG 18 HA ARG 18 -1.548 -20.298 -13.169
172 1HB ARG 18 1HB ARG 18 0.683 -18.332 -12.492
173 2HB ARG 18 2HB ARG 18 0.729 -19.441 -13.867
174 1HG ARG 18 1HG ARG 18 -1.393 -18.510 -14.716
175 2HG ARG 18 2HG ARG 18 -1.434 -17.355 -13.379
176 1HD ARG 18 1HD ARG 18 0.069 -15.975 -14.321
177 2HD ARG 18 2HD ARG 18 1.144 -17.265 -14.840
178 HE ARG 18 HE ARG 18 -0.891 -15.923 -16.400
179 1HH1 ARG 18 1HH2 ARG 18 0.755 -19.000 -15.990
180 2HH1 ARG 18 2HH2 ARG 18 0.577 -19.515 -17.646
181 1HH2 ARG 18 1HH1 ARG 18 -1.201 -16.567 -18.569
182 2HH2 ARG 18 2HH1 ARG 18 -0.590 -18.091 -19.149
183 H GLU 19 H GLU 19 0.667 -19.915 -10.488
184 HA GLU 19 HA GLU 19 2.265 -22.180 -10.900
185 1HB GLU 19 1HB GLU 19 2.550 -20.302 -9.176
186 2HB GLU 19 2HB GLU 19 1.455 -21.243 -8.143
187 1HG GLU 19 1HG GLU 19 2.992 -23.171 -8.245
188 2HG GLU 19 2HG GLU 19 4.066 -22.277 -9.337
189 H ALA 20 H ALA 20 -0.938 -21.952 -9.196
190 HA ALA 20 HA ALA 20 -0.820 -24.876 -8.675
191 1HB ALA 20 1HB ALA 20 -1.833 -23.382 -7.074
192 2HB ALA 20 2HB ALA 20 -3.055 -22.904 -8.281
193 3HB ALA 20 3HB ALA 20 -2.982 -24.588 -7.696
194 H LEU 21 H LEU 21 -2.096 -22.843 -11.286
195 HA LEU 21 HA LEU 21 -4.115 -24.350 -12.266
196 1HB LEU 21 1HB LEU 21 -2.984 -22.227 -13.177
197 2HB LEU 21 2HB LEU 21 -1.986 -23.281 -14.168
198 HG LEU 21 HG LEU 21 -5.035 -23.404 -14.147
199 1HD1 LEU 21 1HD1 LEU 21 -4.417 -21.084 -14.591
200 2HD1 LEU 21 2HD1 LEU 21 -3.281 -21.605 -15.857
201 3HD1 LEU 21 3HD1 LEU 21 -5.025 -21.872 -16.049
202 1HD2 LEU 21 1HD2 LEU 21 -2.987 -24.204 -16.252
203 2HD2 LEU 21 2HD2 LEU 21 -4.083 -25.285 -15.358
204 3HD2 LEU 21 3HD2 LEU 21 -4.743 -24.143 -16.517
205 H GLU 22 H GLU 22 -0.689 -25.114 -12.672
206 HA GLU 22 HA GLU 22 -1.000 -27.296 -14.529
207 1HB GLU 22 1HB GLU 22 1.307 -27.960 -13.608
208 2HB GLU 22 2HB GLU 22 1.161 -26.458 -14.527
209 1HG GLU 22 1HG GLU 22 1.288 -25.102 -12.588
210 2HG GLU 22 2HG GLU 22 1.026 -26.481 -11.499
211 H TYR 23 H TYR 23 -0.967 -27.064 -10.992
212 HA TYR 23 HA TYR 23 -1.056 -29.927 -10.491
213 1HB TYR 23 1HB TYR 23 -1.193 -27.376 -8.904
214 2HB TYR 23 2HB TYR 23 -2.053 -28.725 -8.236
215 HD1 TYR 23 HD1 TYR 23 -0.872 -30.745 -7.466
216 HD2 TYR 23 HD2 TYR 23 1.275 -27.420 -9.182
217 HE1 TYR 23 HE1 TYR 23 1.274 -31.717 -6.682
218 HE2 TYR 23 HE2 TYR 23 3.407 -28.403 -8.426
219 HH TYR 23 HH TYR 23 4.416 -30.167 -7.361
220 H VAL 24 H VAL 24 -3.372 -27.268 -10.891
221 HA VAL 24 HA VAL 24 -5.636 -28.882 -10.056
222 HB VAL 24 HB VAL 24 -5.516 -26.203 -11.496
223 1HG1 VAL 24 1HG1 VAL 24 -7.696 -27.143 -11.924
224 2HG1 VAL 24 2HG1 VAL 24 -7.830 -27.779 -10.270
225 3HG1 VAL 24 3HG1 VAL 24 -7.898 -26.040 -10.563
226 1HG2 VAL 24 1HG2 VAL 24 -6.131 -26.918 -8.609
227 2HG2 VAL 24 2HG2 VAL 24 -4.566 -26.283 -9.122
228 3HG2 VAL 24 3HG2 VAL 24 -6.012 -25.277 -9.278
229 H LYS 25 H LYS 25 -4.152 -28.188 -13.181
230 HA LYS 25 HA LYS 25 -4.575 -28.870 -15.297
231 1HB LYS 25 1HB LYS 25 -5.754 -31.308 -13.890
232 2HB LYS 25 2HB LYS 25 -5.404 -31.187 -15.617
233 1HG LYS 25 1HG LYS 25 -3.024 -30.807 -15.149
234 2HG LYS 25 2HG LYS 25 -3.323 -30.955 -13.407
235 1HD LYS 25 1HD LYS 25 -3.869 -33.226 -13.529
236 2HD LYS 25 2HD LYS 25 -4.282 -33.162 -15.252
237 1HE LYS 25 1HE LYS 25 -1.922 -32.853 -15.864
238 2HE LYS 25 2HE LYS 25 -1.451 -32.874 -14.153
239 1HZ LYS 25 1HZ LYS 25 -2.253 -35.108 -14.018
240 2HZ LYS 25 2HZ LYS 25 -2.772 -35.081 -15.583
241 3HZ LYS 25 3HZ LYS 25 -1.160 -34.997 -15.248
242 H LEU 26 H LEU 26 -6.381 -26.952 -14.560
243 HA LEU 26 HA LEU 26 -8.707 -27.834 -16.153
244 1HB LEU 26 1HB LEU 26 -9.093 -28.063 -13.587
245 2HB LEU 26 2HB LEU 26 -9.124 -26.297 -13.587
246 HG LEU 26 HG LEU 26 -11.001 -26.476 -15.341
247 1HD1 LEU 26 1HD1 LEU 26 -10.651 -28.861 -16.037
248 2HD1 LEU 26 2HD1 LEU 26 -10.949 -29.382 -14.372
249 3HD1 LEU 26 3HD1 LEU 26 -12.252 -28.647 -15.321
250 1HD2 LEU 26 1HD2 LEU 26 -11.425 -27.710 -12.591
251 2HD2 LEU 26 2HD2 LEU 26 -11.378 -25.970 -12.931
252 3HD2 LEU 26 3HD2 LEU 26 -12.688 -26.965 -13.597
253 HA PRO 27 HA PRO 27 -7.501 -23.859 -17.838
254 1HB PRO 27 1HB PRO 27 -9.387 -23.536 -19.791
255 2HB PRO 27 2HB PRO 27 -8.039 -24.701 -19.920
256 1HG PRO 27 1HG PRO 27 -10.878 -25.265 -19.016
257 2HG PRO 27 2HG PRO 27 -9.922 -26.159 -20.234
258 1HD PRO 27 1HD PRO 27 -10.111 -27.011 -17.671
259 2HD PRO 27 2HD PRO 27 -8.560 -27.156 -18.548
260 H VAL 28 H VAL 28 -10.617 -24.596 -16.383
261 HA VAL 28 HA VAL 28 -11.786 -22.031 -16.392
262 HB VAL 28 HB VAL 28 -11.950 -24.128 -14.264
263 1HG1 VAL 28 1HG1 VAL 28 -12.864 -21.975 -13.503
264 2HG1 VAL 28 2HG1 VAL 28 -13.834 -21.840 -14.981
265 3HG1 VAL 28 3HG1 VAL 28 -14.178 -23.115 -13.792
266 1HG2 VAL 28 1HG2 VAL 28 -13.668 -23.688 -16.750
267 2HG2 VAL 28 2HG2 VAL 28 -12.606 -25.081 -16.471
268 3HG2 VAL 28 3HG2 VAL 28 -14.028 -24.846 -15.454
269 H LEU 29 H LEU 29 -9.021 -23.309 -14.492
270 HA LEU 29 HA LEU 29 -9.025 -21.248 -12.487
271 1HB LEU 29 1HB LEU 29 -7.180 -23.370 -13.515
272 2HB LEU 29 2HB LEU 29 -6.437 -21.989 -12.751
273 HG LEU 29 HG LEU 29 -6.952 -24.033 -11.346
274 1HD1 LEU 29 1HD1 LEU 29 -6.278 -21.881 -10.378
275 2HD1 LEU 29 2HD1 LEU 29 -7.978 -21.348 -10.348
276 3HD1 LEU 29 3HD1 LEU 29 -7.451 -22.711 -9.342
277 1HD2 LEU 29 1HD2 LEU 29 -9.795 -22.920 -11.297
278 2HD2 LEU 29 2HD2 LEU 29 -9.290 -24.437 -12.065
279 3HD2 LEU 29 3HD2 LEU 29 -9.166 -24.221 -10.307
280 H ALA 30 H ALA 30 -7.288 -21.597 -15.672
281 HA ALA 30 HA ALA 30 -6.317 -19.043 -15.722
282 1HB ALA 30 1HB ALA 30 -5.993 -20.754 -17.606
283 2HB ALA 30 2HB ALA 30 -7.599 -20.282 -18.190
284 3HB ALA 30 3HB ALA 30 -6.295 -19.093 -18.128
285 H LYS 31 H LYS 31 -9.673 -19.956 -16.354
286 HA LYS 31 HA LYS 31 -10.290 -17.231 -17.264
287 1HB LYS 31 1HB LYS 31 -12.176 -19.487 -16.500
288 2HB LYS 31 2HB LYS 31 -12.613 -17.947 -17.269
289 1HG LYS 31 1HG LYS 31 -10.974 -18.470 -19.121
290 2HG LYS 31 2HG LYS 31 -10.749 -20.079 -18.411
291 1HD LYS 31 1HD LYS 31 -13.158 -20.576 -18.759
292 2HD LYS 31 2HD LYS 31 -13.417 -18.927 -19.355
293 1HE LYS 31 1HE LYS 31 -13.234 -20.463 -21.256
294 2HE LYS 31 2HE LYS 31 -11.875 -19.328 -21.250
295 1HZ LYS 31 1HZ LYS 31 -10.528 -21.042 -20.263
296 2HZ LYS 31 2HZ LYS 31 -11.796 -22.096 -20.264
297 3HZ LYS 31 3HZ LYS 31 -11.168 -21.554 -21.690
298 H ILE 32 H ILE 32 -10.160 -18.849 -14.175
299 HA ILE 32 HA ILE 32 -11.835 -16.871 -12.796
300 HB ILE 32 HB ILE 32 -10.044 -19.156 -11.875
301 1HG1 ILE 32 1HG1 ILE 32 -13.033 -18.752 -11.452
302 2HG1 ILE 32 2HG1 ILE 32 -12.411 -19.525 -12.905
303 1HG2 ILE 32 1HG2 ILE 32 -9.793 -17.474 -10.184
304 2HG2 ILE 32 2HG2 ILE 32 -11.490 -17.022 -10.297
305 3HG2 ILE 32 3HG2 ILE 32 -11.027 -18.568 -9.557
306 1HD1 ILE 32 1HD1 ILE 32 -11.334 -21.271 -11.577
307 2HD1 ILE 32 2HD1 ILE 32 -11.902 -20.530 -10.066
308 3HD1 ILE 32 3HD1 ILE 32 -13.068 -21.183 -11.221
309 H LEU 33 H LEU 33 -8.369 -17.646 -13.289
310 HA LEU 33 HA LEU 33 -7.373 -15.625 -11.506
311 1HB LEU 33 1HB LEU 33 -5.368 -16.462 -11.998
312 2HB LEU 33 2HB LEU 33 -6.393 -17.832 -12.432
313 HG LEU 33 HG LEU 33 -6.113 -17.207 -14.800
314 1HD1 LEU 33 1HD1 LEU 33 -5.427 -15.058 -15.101
315 2HD1 LEU 33 2HD1 LEU 33 -4.487 -15.043 -13.587
316 3HD1 LEU 33 3HD1 LEU 33 -3.849 -15.848 -15.048
317 1HD2 LEU 33 1HD2 LEU 33 -3.647 -17.698 -13.079
318 2HD2 LEU 33 2HD2 LEU 33 -4.818 -18.944 -13.534
319 3HD2 LEU 33 3HD2 LEU 33 -3.816 -18.183 -14.785
320 H GLU 34 H GLU 34 -8.147 -15.741 -15.005
321 HA GLU 34 HA GLU 34 -7.270 -13.137 -15.672
322 1HB GLU 34 1HB GLU 34 -8.141 -15.052 -17.201
323 2HB GLU 34 2HB GLU 34 -9.757 -14.498 -16.799
324 1HG GLU 34 1HG GLU 34 -9.142 -12.205 -17.647
325 2HG GLU 34 2HG GLU 34 -7.554 -12.837 -18.106
326 H ASP 35 H ASP 35 -10.492 -14.285 -14.676
327 HA ASP 35 HA ASP 35 -11.765 -11.772 -14.743
328 1HB ASP 35 1HB ASP 35 -12.779 -14.131 -14.496
329 2HB ASP 35 2HB ASP 35 -12.485 -13.946 -12.760
330 H GLU 36 H GLU 36 -10.205 -13.444 -11.988
331 HA GLU 36 HA GLU 36 -10.478 -11.445 -10.027
332 1HB GLU 36 1HB GLU 36 -8.142 -13.352 -10.472
333 2HB GLU 36 2HB GLU 36 -8.453 -12.412 -9.015
334 1HG GLU 36 1HG GLU 36 -10.856 -13.929 -9.686
335 2HG GLU 36 2HG GLU 36 -9.451 -15.000 -9.658
336 H GLU 37 H GLU 37 -7.814 -11.888 -12.539
337 HA GLU 37 HA GLU 37 -6.295 -9.781 -11.808
338 1HB GLU 37 1HB GLU 37 -6.193 -11.641 -13.752
339 2HB GLU 37 2HB GLU 37 -6.769 -10.333 -14.777
340 1HG GLU 37 1HG GLU 37 -4.470 -9.920 -12.884
341 2HG GLU 37 2HG GLU 37 -4.257 -10.950 -14.299
342 H LYS 38 H LYS 38 -9.127 -9.684 -14.013
343 HA LYS 38 HA LYS 38 -8.976 -6.880 -14.504
344 1HB LYS 38 1HB LYS 38 -10.345 -8.514 -15.821
345 2HB LYS 38 2HB LYS 38 -11.348 -8.781 -14.403
346 1HG LYS 38 1HG LYS 38 -12.692 -7.420 -15.623
347 2HG LYS 38 2HG LYS 38 -11.964 -6.250 -14.537
348 1HD LYS 38 1HD LYS 38 -11.180 -6.790 -17.450
349 2HD LYS 38 2HD LYS 38 -12.155 -5.440 -16.849
350 1HE LYS 38 1HE LYS 38 -10.106 -4.771 -15.424
351 2HE LYS 38 2HE LYS 38 -9.184 -5.925 -16.421
352 1HZ LYS 38 1HZ LYS 38 -9.812 -4.714 -18.344
353 2HZ LYS 38 2HZ LYS 38 -10.689 -3.636 -17.448
354 3HZ LYS 38 3HZ LYS 38 -9.055 -3.733 -17.258
355 H HIS 39 H HIS 39 -10.779 -8.664 -11.985
356 HA HIS 39 HA HIS 39 -12.013 -6.388 -10.805
357 1HB HIS 39 1HB HIS 39 -11.351 -9.193 -9.944
358 2HB HIS 39 2HB HIS 39 -11.676 -8.042 -8.672
359 HD1 HIS 39 HD1 HIS 39 -14.137 -6.829 -8.755
360 HD2 HIS 39 HD2 HIS 39 -13.396 -9.790 -11.635
361 HE1 HIS 39 HE1 HIS 39 -16.367 -7.289 -9.872
362 HE2 HIS 39 HE2 HIS 39 -15.932 -9.164 -11.608
363 H ILE 40 H ILE 40 -8.848 -7.832 -10.194
364 HA ILE 40 HA ILE 40 -8.135 -6.029 -8.056
365 HB ILE 40 HB ILE 40 -6.706 -8.077 -9.766
366 1HG1 ILE 40 1HG1 ILE 40 -7.022 -8.048 -6.753
367 2HG1 ILE 40 2HG1 ILE 40 -8.411 -8.459 -7.707
368 1HG2 ILE 40 1HG2 ILE 40 -4.990 -6.374 -9.237
369 2HG2 ILE 40 2HG2 ILE 40 -5.450 -6.453 -7.522
370 3HG2 ILE 40 3HG2 ILE 40 -4.721 -7.859 -8.339
371 1HD1 ILE 40 1HD1 ILE 40 -7.356 -10.325 -8.749
372 2HD1 ILE 40 2HD1 ILE 40 -5.787 -9.947 -8.038
373 3HD1 ILE 40 3HD1 ILE 40 -7.140 -10.468 -7.005
374 H GLU 41 H GLU 41 -7.604 -6.156 -11.557
375 HA GLU 41 HA GLU 41 -5.765 -4.073 -11.870
376 1HB GLU 41 1HB GLU 41 -6.633 -5.685 -13.687
377 2HB GLU 41 2HB GLU 41 -8.077 -4.656 -13.770
378 1HG GLU 41 1HG GLU 41 -6.379 -2.720 -14.177
379 2HG GLU 41 2HG GLU 41 -5.204 -4.018 -14.458
380 H TRP 42 H TRP 42 -9.357 -3.999 -11.409
381 HA TRP 42 HA TRP 42 -9.862 -1.352 -11.938
382 1HB TRP 42 1HB TRP 42 -11.330 -3.313 -11.059
383 2HB TRP 42 2HB TRP 42 -10.885 -2.738 -9.456
384 HD1 TRP 42 HD1 TRP 42 -12.989 -1.928 -12.449
385 HE1 TRP 42 HE1 TRP 42 -14.598 0.030 -11.914
386 HE3 TRP 42 HE3 TRP 42 -11.001 -0.600 -8.026
387 HZ2 TRP 42 HZ2 TRP 42 -14.827 2.063 -9.809
388 HZ3 TRP 42 HZ3 TRP 42 -11.913 1.326 -6.707
389 HH2 TRP 42 HH2 TRP 42 -13.741 2.730 -7.660
390 H LEU 43 H LEU 43 -8.344 -2.733 -9.007
391 HA LEU 43 HA LEU 43 -8.172 -0.206 -7.616
392 1HB LEU 43 1HB LEU 43 -6.826 -2.942 -7.184
393 2HB LEU 43 2HB LEU 43 -6.520 -1.573 -6.156
394 HG LEU 43 HG LEU 43 -9.358 -1.837 -6.204
395 1HD1 LEU 43 1HD1 LEU 43 -9.032 -4.149 -7.055
396 2HD1 LEU 43 2HD1 LEU 43 -7.911 -4.498 -5.722
397 3HD1 LEU 43 3HD1 LEU 43 -9.616 -4.167 -5.382
398 1HD2 LEU 43 1HD2 LEU 43 -7.194 -2.549 -4.175
399 2HD2 LEU 43 2HD2 LEU 43 -8.050 -1.011 -4.300
400 3HD2 LEU 43 3HD2 LEU 43 -8.912 -2.473 -3.781
401 H GLU 44 H GLU 44 -6.250 -1.455 -10.193
402 HA GLU 44 HA GLU 44 -4.043 0.397 -9.410
403 1HB GLU 44 1HB GLU 44 -2.537 -0.849 -10.560
404 2HB GLU 44 2HB GLU 44 -3.660 -2.113 -10.058
405 1HG GLU 44 1HG GLU 44 -4.751 -1.908 -12.307
406 2HG GLU 44 2HG GLU 44 -3.462 -0.779 -12.761
407 H THR 45 H THR 45 -6.544 -0.136 -11.649
408 HA THR 45 HA THR 45 -5.570 1.748 -13.630
409 HB THR 45 HB THR 45 -7.334 -0.290 -13.768
410 HG1 THR 45 HG1 THR 45 -6.315 0.742 -15.487
411 1HG2 THR 45 1HG2 THR 45 -9.219 0.837 -12.639
412 2HG2 THR 45 2HG2 THR 45 -9.156 2.141 -13.850
413 3HG2 THR 45 3HG2 THR 45 -9.555 0.486 -14.337
414 H ILE 46 H ILE 46 -8.132 1.792 -11.152
415 HA ILE 46 HA ILE 46 -9.183 4.164 -10.994
416 HB ILE 46 HB ILE 46 -9.249 2.435 -9.294
417 1HG1 ILE 46 1HG1 ILE 46 -8.531 4.689 -7.507
418 2HG1 ILE 46 2HG1 ILE 46 -9.548 5.187 -8.874
419 1HG2 ILE 46 1HG2 ILE 46 -6.798 2.017 -9.165
420 2HG2 ILE 46 2HG2 ILE 46 -6.662 3.395 -8.064
421 3HG2 ILE 46 3HG2 ILE 46 -7.689 2.030 -7.632
422 1HD1 ILE 46 1HD1 ILE 46 -11.128 3.423 -8.440
423 2HD1 ILE 46 2HD1 ILE 46 -10.137 2.826 -7.078
424 3HD1 ILE 46 3HD1 ILE 46 -10.927 4.428 -6.984
425 H LEU 47 H LEU 47 -5.757 3.898 -9.849
426 HA LEU 47 HA LEU 47 -4.969 6.429 -10.835
427 1HB LEU 47 1HB LEU 47 -6.379 7.294 -8.983
428 2HB LEU 47 2HB LEU 47 -5.538 6.261 -7.830
429 HG LEU 47 HG LEU 47 -3.688 7.971 -9.402
430 1HD1 LEU 47 1HD1 LEU 47 -5.586 9.513 -9.407
431 2HD1 LEU 47 2HD1 LEU 47 -5.752 9.348 -7.644
432 3HD1 LEU 47 3HD1 LEU 47 -4.296 10.095 -8.341
433 1HD2 LEU 47 1HD2 LEU 47 -4.216 7.748 -6.402
434 2HD2 LEU 47 2HD2 LEU 47 -3.067 6.741 -7.309
435 3HD2 LEU 47 3HD2 LEU 47 -2.799 8.488 -7.174
436 H GLY 48 H GLY 48 -2.705 6.301 -10.922
437 1HA GLY 48 1HA GLY 48 -1.174 4.732 -9.027
438 2HA GLY 48 2HA GLY 48 -1.301 3.992 -10.643
439 1HN NH2 49 1HN NH2 49 1.217 4.697 -9.932
440 2HN NH2 49 2HN NH2 49 1.720 6.211 -10.731
441 1H ACE 0 H1 ACE 0 -3.627 -28.894 1.354
442 2H ACE 0 H2 ACE 0 -2.608 -27.453 1.425
443 3H ACE 0 H3 ACE 0 -3.490 -27.851 -0.066
444 H ASP 1 H ASP 1 0.102 -29.089 -0.422
445 HA ASP 1 HA ASP 1 -0.562 -26.688 0.942
446 1HB ASP 1 1HB ASP 1 1.724 -27.299 0.158
447 2HB ASP 1 2HB ASP 1 1.220 -26.963 -1.510
448 H TYR 2 H TYR 2 -0.914 -27.640 -2.449
449 HA TYR 2 HA TYR 2 -1.829 -25.643 -3.918
450 1HB TYR 2 1HB TYR 2 -1.863 -27.706 -4.946
451 2HB TYR 2 2HB TYR 2 -2.732 -28.477 -3.624
452 HD1 TYR 2 HD1 TYR 2 -3.808 -25.442 -5.577
453 HD2 TYR 2 HD2 TYR 2 -4.428 -29.630 -4.793
454 HE1 TYR 2 HE1 TYR 2 -6.168 -25.233 -6.314
455 HE2 TYR 2 HE2 TYR 2 -6.725 -29.453 -5.703
456 HH TYR 2 HH TYR 2 -8.174 -26.327 -6.634
457 H LEU 3 H LEU 3 -4.317 -27.451 -2.093
458 HA LEU 3 HA LEU 3 -6.196 -25.472 -2.708
459 1HB LEU 3 1HB LEU 3 -6.153 -27.566 -0.476
460 2HB LEU 3 2HB LEU 3 -7.552 -26.509 -0.684
461 HG LEU 3 HG LEU 3 -6.510 -28.203 -2.972
462 1HD1 LEU 3 1HD1 LEU 3 -7.008 -29.732 -1.125
463 2HD1 LEU 3 2HD1 LEU 3 -8.598 -28.970 -0.894
464 3HD1 LEU 3 3HD1 LEU 3 -8.244 -29.864 -2.388
465 1HD2 LEU 3 1HD2 LEU 3 -9.250 -26.984 -2.357
466 2HD2 LEU 3 2HD2 LEU 3 -8.098 -26.345 -3.541
467 3HD2 LEU 3 3HD2 LEU 3 -8.838 -27.930 -3.795
468 H ARG 4 H ARG 4 -4.318 -25.653 0.276
469 HA ARG 4 HA ARG 4 -5.637 -23.453 1.550
470 1HB ARG 4 1HB ARG 4 -2.730 -24.329 1.741
471 2HB ARG 4 2HB ARG 4 -3.574 -23.266 2.876
472 1HG ARG 4 1HG ARG 4 -5.183 -25.131 3.399
473 2HG ARG 4 2HG ARG 4 -4.301 -26.174 2.287
474 1HD ARG 4 1HD ARG 4 -2.209 -25.525 3.741
475 2HD ARG 4 2HD ARG 4 -3.408 -25.107 4.961
476 HE ARG 4 HE ARG 4 -4.337 -27.384 4.770
477 1HH1 ARG 4 1HH2 ARG 4 -0.938 -26.950 3.801
478 2HH1 ARG 4 2HH2 ARG 4 -0.627 -28.655 3.714
479 1HH2 ARG 4 1HH1 ARG 4 -3.917 -29.588 4.619
480 2HH2 ARG 4 2HH1 ARG 4 -2.337 -30.178 4.191
481 H GLU 5 H GLU 5 -3.435 -23.671 -1.179
482 HA GLU 5 HA GLU 5 -2.237 -21.050 -0.749
483 1HB GLU 5 1HB GLU 5 -1.176 -23.104 -1.951
484 2HB GLU 5 2HB GLU 5 -2.164 -22.626 -3.345
485 1HG GLU 5 1HG GLU 5 -1.112 -20.344 -3.231
486 2HG GLU 5 2HG GLU 5 -0.075 -20.930 -1.918
487 H LEU 6 H LEU 6 -4.867 -22.444 -2.712
488 HA LEU 6 HA LEU 6 -5.631 -19.650 -3.523
489 1HB LEU 6 1HB LEU 6 -6.697 -22.119 -4.820
490 2HB LEU 6 2HB LEU 6 -6.831 -20.435 -5.304
491 HG LEU 6 HG LEU 6 -4.177 -20.642 -5.699
492 1HD1 LEU 6 1HD1 LEU 6 -4.818 -23.268 -4.736
493 2HD1 LEU 6 2HD1 LEU 6 -4.601 -23.409 -6.471
494 3HD1 LEU 6 3HD1 LEU 6 -3.304 -22.714 -5.465
495 1HD2 LEU 6 1HD2 LEU 6 -6.398 -21.925 -7.342
496 2HD2 LEU 6 2HD2 LEU 6 -5.819 -20.251 -7.409
497 3HD2 LEU 6 3HD2 LEU 6 -4.781 -21.571 -7.965
498 H LEU 7 H LEU 7 -6.124 -20.758 -0.816
499 HA LEU 7 HA LEU 7 -8.976 -20.344 -0.878
500 1HB LEU 7 1HB LEU 7 -8.613 -22.835 -1.183
501 2HB LEU 7 2HB LEU 7 -7.967 -22.875 0.467
502 HG LEU 7 HG LEU 7 -10.789 -22.080 -0.381
503 1HD1 LEU 7 1HD1 LEU 7 -10.414 -24.421 -0.772
504 2HD1 LEU 7 2HD1 LEU 7 -9.544 -24.620 0.764
505 3HD1 LEU 7 3HD1 LEU 7 -11.285 -24.333 0.769
506 1HD2 LEU 7 1HD2 LEU 7 -9.534 -22.378 2.387
507 2HD2 LEU 7 2HD2 LEU 7 -10.359 -20.949 1.708
508 3HD2 LEU 7 3HD2 LEU 7 -11.282 -22.393 2.092
509 H LYS 8 H LYS 8 -6.465 -21.480 1.474
510 HA LYS 8 HA LYS 8 -7.581 -19.982 3.575
511 1HB LYS 8 1HB LYS 8 -4.853 -21.226 3.099
512 2HB LYS 8 2HB LYS 8 -5.116 -20.217 4.500
513 1HG LYS 8 1HG LYS 8 -7.251 -22.266 4.164
514 2HG LYS 8 2HG LYS 8 -5.630 -22.944 4.336
515 1HD LYS 8 1HD LYS 8 -6.593 -22.735 6.542
516 2HD LYS 8 2HD LYS 8 -5.232 -21.617 6.376
517 1HE LYS 8 1HE LYS 8 -6.944 -19.763 5.874
518 2HE LYS 8 2HE LYS 8 -8.213 -20.937 6.263
519 1HZ LYS 8 1HZ LYS 8 -7.196 -21.136 8.446
520 2HZ LYS 8 2HZ LYS 8 -6.064 -20.007 8.040
521 3HZ LYS 8 3HZ LYS 8 -7.652 -19.585 8.123
522 H LEU 9 H LEU 9 -4.970 -19.337 1.236
523 HA LEU 9 HA LEU 9 -4.390 -16.684 2.221
524 1HB LEU 9 1HB LEU 9 -4.082 -17.791 -0.591
525 2HB LEU 9 2HB LEU 9 -3.427 -16.264 -0.007
526 HG LEU 9 HG LEU 9 -2.615 -19.042 0.956
527 1HD1 LEU 9 1HD1 LEU 9 -1.706 -18.361 -1.265
528 2HD1 LEU 9 2HD1 LEU 9 -1.075 -16.873 -0.544
529 3HD1 LEU 9 3HD1 LEU 9 -0.440 -18.453 -0.035
530 1HD2 LEU 9 1HD2 LEU 9 -1.708 -16.277 1.886
531 2HD2 LEU 9 2HD2 LEU 9 -2.457 -17.549 2.883
532 3HD2 LEU 9 3HD2 LEU 9 -0.834 -17.781 2.235
533 H GLU 10 H GLU 10 -6.822 -17.961 -0.193
534 HA GLU 10 HA GLU 10 -7.563 -15.416 -1.078
535 1HB GLU 10 1HB GLU 10 -9.261 -17.916 -0.853
536 2HB GLU 10 2HB GLU 10 -9.603 -16.452 -1.759
537 1HG GLU 10 1HG GLU 10 -7.274 -18.301 -2.338
538 2HG GLU 10 2HG GLU 10 -8.801 -18.316 -3.220
539 H LEU 11 H LEU 11 -8.627 -17.360 1.692
540 HA LEU 11 HA LEU 11 -10.945 -15.880 2.398
541 1HB LEU 11 1HB LEU 11 -9.764 -18.137 3.374
542 2HB LEU 11 2HB LEU 11 -9.087 -16.994 4.526
543 HG LEU 11 HG LEU 11 -11.621 -16.213 4.784
544 1HD1 LEU 11 1HD1 LEU 11 -12.432 -17.642 2.875
545 2HD1 LEU 11 2HD1 LEU 11 -11.914 -19.087 3.762
546 3HD1 LEU 11 3HD1 LEU 11 -13.215 -18.068 4.407
547 1HD2 LEU 11 1HD2 LEU 11 -10.549 -18.844 5.898
548 2HD2 LEU 11 2HD2 LEU 11 -10.309 -17.222 6.588
549 3HD2 LEU 11 3HD2 LEU 11 -11.932 -17.936 6.552
550 H GLN 12 H GLN 12 -7.521 -15.385 3.300
551 HA GLN 12 HA GLN 12 -7.969 -13.225 5.078
552 1HB GLN 12 1HB GLN 12 -5.827 -14.687 4.731
553 2HB GLN 12 2HB GLN 12 -5.570 -13.778 3.243
554 1HG GLN 12 1HG GLN 12 -5.851 -11.746 5.121
555 2HG GLN 12 2HG GLN 12 -5.087 -13.023 6.059
556 1HE2 GLN 12 2HE2 GLN 12 -4.808 -11.445 2.793
557 2HE2 GLN 12 1HE2 GLN 12 -3.055 -11.416 2.815
558 H LEU 13 H LEU 13 -7.968 -13.369 1.569
559 HA LEU 13 HA LEU 13 -7.449 -10.551 1.139
560 1HB LEU 13 1HB LEU 13 -9.008 -12.373 -0.709
561 2HB LEU 13 2HB LEU 13 -8.133 -10.895 -1.082
562 HG LEU 13 HG LEU 13 -6.816 -13.472 -0.170
563 1HD1 LEU 13 1HD1 LEU 13 -8.052 -13.714 -2.289
564 2HD1 LEU 13 2HD1 LEU 13 -7.277 -12.274 -2.905
565 3HD1 LEU 13 3HD1 LEU 13 -6.300 -13.746 -2.532
566 1HD2 LEU 13 1HD2 LEU 13 -5.581 -10.984 -1.415
567 2HD2 LEU 13 2HD2 LEU 13 -5.482 -11.406 0.306
568 3HD2 LEU 13 3HD2 LEU 13 -4.739 -12.454 -0.892
569 H ILE 14 H ILE 14 -10.345 -12.706 1.094
570 HA ILE 14 HA ILE 14 -12.253 -10.630 0.721
571 HB ILE 14 HB ILE 14 -12.472 -13.328 2.207
572 1HG1 ILE 14 1HG1 ILE 14 -11.741 -13.800 0.024
573 2HG1 ILE 14 2HG1 ILE 14 -13.474 -14.061 -0.002
574 1HG2 ILE 14 1HG2 ILE 14 -14.426 -11.897 2.755
575 2HG2 ILE 14 2HG2 ILE 14 -14.708 -11.582 1.036
576 3HG2 ILE 14 3HG2 ILE 14 -14.892 -13.219 1.685
577 1HD1 ILE 14 1HD1 ILE 14 -13.645 -11.626 -0.923
578 2HD1 ILE 14 2HD1 ILE 14 -11.885 -11.744 -1.163
579 3HD1 ILE 14 3HD1 ILE 14 -12.970 -12.849 -1.997
580 H LYS 15 H LYS 15 -11.176 -12.044 3.773
581 HA LYS 15 HA LYS 15 -12.254 -10.185 5.534
582 1HB LYS 15 1HB LYS 15 -10.301 -12.280 5.580
583 2HB LYS 15 2HB LYS 15 -9.483 -10.876 6.160
584 1HG LYS 15 1HG LYS 15 -10.479 -11.909 8.099
585 2HG LYS 15 2HG LYS 15 -11.584 -10.578 7.722
586 1HD LYS 15 1HD LYS 15 -12.728 -12.446 6.140
587 2HD LYS 15 2HD LYS 15 -11.863 -13.565 7.198
588 1HE LYS 15 1HE LYS 15 -13.024 -12.485 9.175
589 2HE LYS 15 2HE LYS 15 -13.898 -11.441 8.035
590 1HZ LYS 15 1HZ LYS 15 -14.797 -13.428 7.025
591 2HZ LYS 15 2HZ LYS 15 -14.043 -14.369 8.147
592 3HZ LYS 15 3HZ LYS 15 -15.215 -13.310 8.613
593 H GLN 16 H GLN 16 -9.057 -9.820 3.839
594 HA GLN 16 HA GLN 16 -8.503 -7.257 5.060
595 1HB GLN 16 1HB GLN 16 -7.392 -8.808 2.707
596 2HB GLN 16 2HB GLN 16 -6.969 -7.117 2.871
597 1HG GLN 16 1HG GLN 16 -6.589 -8.964 5.235
598 2HG GLN 16 2HG GLN 16 -5.409 -8.883 3.916
599 1HE2 GLN 16 2HE2 GLN 16 -3.678 -7.787 4.898
600 2HE2 GLN 16 1HE2 GLN 16 -3.844 -6.141 5.483
601 H TYR 17 H TYR 17 -10.382 -8.267 2.333
602 HA TYR 17 HA TYR 17 -10.379 -5.744 0.928
603 1HB TYR 17 1HB TYR 17 -11.726 -8.435 0.659
604 2HB TYR 17 2HB TYR 17 -12.457 -7.064 -0.076
605 HD1 TYR 17 HD1 TYR 17 -11.426 -5.593 -1.706
606 HD2 TYR 17 HD2 TYR 17 -10.369 -9.663 -0.906
607 HE1 TYR 17 HE1 TYR 17 -10.445 -5.787 -3.964
608 HE2 TYR 17 HE2 TYR 17 -9.271 -9.829 -3.085
609 HH TYR 17 HH TYR 17 -8.935 -8.816 -5.104
610 H ARG 18 H ARG 18 -12.114 -7.158 3.558
611 HA ARG 18 HA ARG 18 -14.250 -5.109 3.524
612 1HB ARG 18 1HB ARG 18 -13.602 -7.366 5.465
613 2HB ARG 18 2HB ARG 18 -14.774 -6.083 5.791
614 1HG ARG 18 1HG ARG 18 -15.996 -6.676 3.699
615 2HG ARG 18 2HG ARG 18 -14.907 -8.061 3.473
616 1HD ARG 18 1HD ARG 18 -15.676 -9.079 5.535
617 2HD ARG 18 2HD ARG 18 -16.526 -7.587 6.012
618 HE ARG 18 HE ARG 18 -17.492 -8.595 3.494
619 1HH1 ARG 18 1HH2 ARG 18 -17.677 -9.124 6.970
620 2HH1 ARG 18 2HH2 ARG 18 -19.328 -9.683 6.961
621 1HH2 ARG 18 1HH1 ARG 18 -19.653 -9.311 3.438
622 2HH2 ARG 18 2HH1 ARG 18 -20.477 -9.804 4.889
623 H GLU 19 H GLU 19 -11.300 -5.983 5.215
624 HA GLU 19 HA GLU 19 -11.305 -3.875 7.089
625 1HB GLU 19 1HB GLU 19 -9.700 -5.864 6.966
626 2HB GLU 19 2HB GLU 19 -8.766 -4.899 5.804
627 1HG GLU 19 1HG GLU 19 -8.541 -3.093 7.473
628 2HG GLU 19 2HG GLU 19 -9.513 -4.024 8.627
629 H ALA 20 H ALA 20 -10.084 -3.903 3.686
630 HA ALA 20 HA ALA 20 -9.153 -1.136 3.974
631 1HB ALA 20 1HB ALA 20 -8.250 -2.846 2.298
632 2HB ALA 20 2HB ALA 20 -9.726 -2.445 1.356
633 3HB ALA 20 3HB ALA 20 -8.536 -1.190 1.722
634 H LEU 21 H LEU 21 -12.182 -2.668 2.919
635 HA LEU 21 HA LEU 21 -13.416 -0.795 1.434
636 1HB LEU 21 1HB LEU 21 -14.397 -2.969 2.261
637 2HB LEU 21 2HB LEU 21 -14.717 -2.179 3.813
638 HG LEU 21 HG LEU 21 -16.228 -0.548 2.666
639 1HD1 LEU 21 1HD1 LEU 21 -15.362 -0.582 0.396
640 2HD1 LEU 21 2HD1 LEU 21 -15.607 -2.330 0.282
641 3HD1 LEU 21 3HD1 LEU 21 -17.004 -1.226 0.345
642 1HD2 LEU 21 1HD2 LEU 21 -16.790 -3.527 2.446
643 2HD2 LEU 21 2HD2 LEU 21 -17.136 -2.458 3.811
644 3HD2 LEU 21 3HD2 LEU 21 -18.028 -2.253 2.293
645 H GLU 22 H GLU 22 -13.011 -0.574 4.944
646 HA GLU 22 HA GLU 22 -14.654 1.837 5.176
647 1HB GLU 22 1HB GLU 22 -13.944 1.670 7.608
648 2HB GLU 22 2HB GLU 22 -14.992 0.389 6.980
649 1HG GLU 22 1HG GLU 22 -13.173 -1.168 6.803
650 2HG GLU 22 2HG GLU 22 -11.980 0.114 7.111
651 H TYR 23 H TYR 23 -11.259 1.084 4.821
652 HA TYR 23 HA TYR 23 -10.331 3.731 5.616
653 1HB TYR 23 1HB TYR 23 -9.176 1.290 4.253
654 2HB TYR 23 2HB TYR 23 -8.414 2.832 4.004
655 HD1 TYR 23 HD1 TYR 23 -9.802 0.809 6.884
656 HD2 TYR 23 HD2 TYR 23 -6.653 3.385 5.454
657 HE1 TYR 23 HE1 TYR 23 -8.738 0.734 9.104
658 HE2 TYR 23 HE2 TYR 23 -5.533 3.223 7.658
659 HH TYR 23 HH TYR 23 -6.960 1.418 10.386
660 H VAL 24 H VAL 24 -11.371 2.057 2.643
661 HA VAL 24 HA VAL 24 -10.687 4.412 1.018
662 HB VAL 24 HB VAL 24 -11.931 1.762 0.211
663 1HG1 VAL 24 1HG1 VAL 24 -12.342 3.461 -1.510
664 2HG1 VAL 24 2HG1 VAL 24 -10.677 4.057 -1.382
665 3HG1 VAL 24 3HG1 VAL 24 -10.998 2.458 -2.066
666 1HG2 VAL 24 1HG2 VAL 24 -9.060 2.773 0.095
667 2HG2 VAL 24 2HG2 VAL 24 -9.631 1.508 1.196
668 3HG2 VAL 24 3HG2 VAL 24 -9.618 1.219 -0.544
669 H LYS 25 H LYS 25 -13.623 2.950 2.304
670 HA LYS 25 HA LYS 25 -15.777 3.544 2.329
671 1HB LYS 25 1HB LYS 25 -14.789 6.374 1.797
672 2HB LYS 25 2HB LYS 25 -16.350 5.892 2.471
673 1HG LYS 25 1HG LYS 25 -15.120 4.779 4.380
674 2HG LYS 25 2HG LYS 25 -13.607 5.452 3.749
675 1HD LYS 25 1HD LYS 25 -14.452 7.735 4.003
676 2HD LYS 25 2HD LYS 25 -16.035 7.124 4.536
677 1HE LYS 25 1HE LYS 25 -14.923 6.008 6.488
678 2HE LYS 25 2HE LYS 25 -13.369 6.681 5.973
679 1HZ LYS 25 1HZ LYS 25 -14.286 8.867 6.283
680 2HZ LYS 25 2HZ LYS 25 -15.743 8.242 6.735
681 3HZ LYS 25 3HZ LYS 25 -14.414 7.992 7.674
682 H LEU 26 H LEU 26 -15.057 2.361 0.007
683 HA LEU 26 HA LEU 26 -16.668 3.770 -2.097
684 1HB LEU 26 1HB LEU 26 -14.341 3.741 -2.746
685 2HB LEU 26 2HB LEU 26 -14.219 2.031 -2.328
686 HG LEU 26 HG LEU 26 -16.047 1.669 -4.169
687 1HD1 LEU 26 1HD1 LEU 26 -16.581 4.062 -4.621
688 2HD1 LEU 26 2HD1 LEU 26 -14.896 4.323 -5.124
689 3HD1 LEU 26 3HD1 LEU 26 -15.939 3.247 -6.055
690 1HD2 LEU 26 1HD2 LEU 26 -13.257 2.442 -5.044
691 2HD2 LEU 26 2HD2 LEU 26 -13.681 0.890 -4.289
692 3HD2 LEU 26 3HD2 LEU 26 -14.393 1.325 -5.831
693 HA PRO 27 HA PRO 27 -19.014 -0.054 -1.181
694 1HB PRO 27 1HB PRO 27 -21.071 0.238 -2.995
695 2HB PRO 27 2HB PRO 27 -20.994 1.061 -1.415
696 1HG PRO 27 1HG PRO 27 -20.199 2.170 -4.113
697 2HG PRO 27 2HG PRO 27 -21.190 2.955 -2.852
698 1HD PRO 27 1HD PRO 27 -18.556 3.503 -3.137
699 2HD PRO 27 2HD PRO 27 -19.271 3.395 -1.502
700 H VAL 28 H VAL 28 -18.210 1.032 -4.515
701 HA VAL 28 HA VAL 28 -18.366 -1.407 -5.852
702 HB VAL 28 HB VAL 28 -16.628 0.976 -6.235
703 1HG1 VAL 28 1HG1 VAL 28 -15.163 -0.768 -7.045
704 2HG1 VAL 28 2HG1 VAL 28 -16.517 -1.595 -7.857
705 3HG1 VAL 28 3HG1 VAL 28 -15.940 -0.032 -8.447
706 1HG2 VAL 28 1HG2 VAL 28 -18.745 -0.298 -7.998
707 2HG2 VAL 28 2HG2 VAL 28 -19.031 1.072 -6.893
708 3HG2 VAL 28 3HG2 VAL 28 -17.925 1.250 -8.269
709 H LEU 29 H LEU 29 -15.815 -0.393 -3.522
710 HA LEU 29 HA LEU 29 -13.976 -2.507 -4.235
711 1HB LEU 29 1HB LEU 29 -14.092 -0.370 -2.333
712 2HB LEU 29 2HB LEU 29 -14.047 -1.832 -1.357
713 HG LEU 29 HG LEU 29 -12.101 -1.223 -3.608
714 1HD1 LEU 29 1HD1 LEU 29 -11.974 0.439 -1.792
715 2HD1 LEU 29 2HD1 LEU 29 -11.771 -0.856 -0.594
716 3HD1 LEU 29 3HD1 LEU 29 -10.526 -0.587 -1.837
717 1HD2 LEU 29 1HD2 LEU 29 -11.997 -3.240 -1.307
718 2HD2 LEU 29 2HD2 LEU 29 -12.306 -3.652 -3.010
719 3HD2 LEU 29 3HD2 LEU 29 -10.746 -2.975 -2.538
720 H ALA 30 H ALA 30 -16.743 -2.336 -1.948
721 HA ALA 30 HA ALA 30 -16.011 -4.853 -1.004
722 1HB ALA 30 1HB ALA 30 -17.507 -3.524 0.381
723 2HB ALA 30 2HB ALA 30 -18.754 -3.443 -0.876
724 3HB ALA 30 3HB ALA 30 -18.409 -4.973 -0.045
725 H LYS 31 H LYS 31 -17.903 -3.551 -3.751
726 HA LYS 31 HA LYS 31 -19.410 -5.933 -4.388
727 1HB LYS 31 1HB LYS 31 -19.891 -3.509 -5.201
728 2HB LYS 31 2HB LYS 31 -18.654 -3.851 -6.431
729 1HG LYS 31 1HG LYS 31 -20.085 -6.090 -6.769
730 2HG LYS 31 2HG LYS 31 -21.360 -5.160 -5.988
731 1HD LYS 31 1HD LYS 31 -19.818 -4.453 -8.536
732 2HD LYS 31 2HD LYS 31 -21.479 -5.059 -8.445
733 1HE LYS 31 1HE LYS 31 -22.142 -2.996 -7.174
734 2HE LYS 31 2HE LYS 31 -20.491 -2.372 -7.368
735 1HZ LYS 31 1HZ LYS 31 -20.802 -2.476 -9.737
736 2HZ LYS 31 2HZ LYS 31 -22.343 -3.028 -9.549
737 3HZ LYS 31 3HZ LYS 31 -21.943 -1.514 -9.036
738 H ILE 32 H ILE 32 -16.251 -4.634 -5.295
739 HA ILE 32 HA ILE 32 -15.643 -6.496 -7.382
740 HB ILE 32 HB ILE 32 -14.058 -4.699 -5.513
741 1HG1 ILE 32 1HG1 ILE 32 -14.143 -4.782 -8.553
742 2HG1 ILE 32 2HG1 ILE 32 -15.325 -3.898 -7.585
743 1HG2 ILE 32 1HG2 ILE 32 -12.596 -6.598 -5.651
744 2HG2 ILE 32 2HG2 ILE 32 -12.853 -6.741 -7.388
745 3HG2 ILE 32 3HG2 ILE 32 -11.964 -5.363 -6.735
746 1HD1 ILE 32 1HD1 ILE 32 -13.466 -2.592 -6.535
747 2HD1 ILE 32 2HD1 ILE 32 -12.327 -3.382 -7.647
748 3HD1 ILE 32 3HD1 ILE 32 -13.633 -2.373 -8.284
749 H LEU 33 H LEU 33 -14.955 -6.333 -3.877
750 HA LEU 33 HA LEU 33 -13.858 -8.967 -3.926
751 1HB LEU 33 1HB LEU 33 -13.513 -8.655 -1.571
752 2HB LEU 33 2HB LEU 33 -13.620 -6.993 -2.188
753 HG LEU 33 HG LEU 33 -15.972 -6.980 -1.594
754 1HD1 LEU 33 1HD1 LEU 33 -16.882 -9.039 -1.148
755 2HD1 LEU 33 2HD1 LEU 33 -15.323 -9.676 -0.539
756 3HD1 LEU 33 3HD1 LEU 33 -16.363 -8.637 0.477
757 1HD2 LEU 33 1HD2 LEU 33 -14.259 -7.461 0.796
758 2HD2 LEU 33 2HD2 LEU 33 -14.208 -5.963 -0.223
759 3HD2 LEU 33 3HD2 LEU 33 -15.676 -6.411 0.663
760 H GLU 34 H GLU 34 -17.212 -8.089 -3.716
761 HA GLU 34 HA GLU 34 -18.034 -10.561 -2.693
762 1HB GLU 34 1HB GLU 34 -19.389 -8.434 -3.133
763 2HB GLU 34 2HB GLU 34 -19.515 -8.923 -4.812
764 1HG GLU 34 1HG GLU 34 -20.454 -10.649 -2.475
765 2HG GLU 34 2HG GLU 34 -21.496 -9.502 -3.329
766 H ASP 35 H ASP 35 -17.508 -9.417 -5.979
767 HA ASP 35 HA ASP 35 -18.108 -11.767 -7.438
768 1HB ASP 35 1HB ASP 35 -17.541 -9.408 -8.300
769 2HB ASP 35 2HB ASP 35 -15.839 -9.885 -8.179
770 H GLU 36 H GLU 36 -14.947 -10.689 -6.094
771 HA GLU 36 HA GLU 36 -13.471 -13.012 -6.771
772 1HB GLU 36 1HB GLU 36 -12.996 -11.230 -4.370
773 2HB GLU 36 2HB GLU 36 -11.891 -12.391 -5.111
774 1HG GLU 36 1HG GLU 36 -12.638 -10.882 -7.323
775 2HG GLU 36 2HG GLU 36 -12.645 -9.660 -6.047
776 H GLU 37 H GLU 37 -15.483 -12.409 -3.857
777 HA GLU 37 HA GLU 37 -14.960 -14.714 -2.441
778 1HB GLU 37 1HB GLU 37 -16.690 -12.555 -2.291
779 2HB GLU 37 2HB GLU 37 -17.845 -13.831 -2.613
780 1HG GLU 37 1HG GLU 37 -15.704 -14.047 -0.455
781 2HG GLU 37 2HG GLU 37 -17.163 -13.088 -0.237
782 H LYS 38 H LYS 38 -17.244 -14.338 -5.196
783 HA LYS 38 HA LYS 38 -18.108 -17.072 -5.195
784 1HB LYS 38 1HB LYS 38 -19.146 -15.083 -6.416
785 2HB LYS 38 2HB LYS 38 -17.843 -15.243 -7.604
786 1HG LYS 38 1HG LYS 38 -18.561 -17.714 -7.864
787 2HG LYS 38 2HG LYS 38 -19.976 -17.313 -6.881
788 1HD LYS 38 1HD LYS 38 -20.651 -15.623 -8.585
789 2HD LYS 38 2HD LYS 38 -19.186 -15.987 -9.523
790 1HE LYS 38 1HE LYS 38 -19.942 -18.376 -9.738
791 2HE LYS 38 2HE LYS 38 -21.433 -17.963 -8.875
792 1HZ LYS 38 1HZ LYS 38 -21.938 -16.427 -10.644
793 2HZ LYS 38 2HZ LYS 38 -20.550 -16.828 -11.438
794 3HZ LYS 38 3HZ LYS 38 -21.735 -17.955 -11.231
795 H HIS 39 H HIS 39 -15.396 -15.475 -6.934
796 HA HIS 39 HA HIS 39 -14.583 -17.781 -8.400
797 1HB HIS 39 1HB HIS 39 -13.016 -15.400 -7.335
798 2HB HIS 39 2HB HIS 39 -12.283 -16.672 -8.279
799 HD1 HIS 39 HD1 HIS 39 -13.784 -17.116 -10.742
800 HD2 HIS 39 HD2 HIS 39 -14.038 -13.409 -8.763
801 HE1 HIS 39 HE1 HIS 39 -14.701 -15.421 -12.444
802 HE2 HIS 39 HE2 HIS 39 -14.866 -13.174 -11.181
803 H ILE 40 H ILE 40 -13.805 -16.751 -5.096
804 HA ILE 40 HA ILE 40 -11.962 -18.925 -4.586
805 HB ILE 40 HB ILE 40 -13.436 -17.044 -2.721
806 1HG1 ILE 40 1HG1 ILE 40 -10.535 -16.932 -3.573
807 2HG1 ILE 40 2HG1 ILE 40 -11.698 -16.196 -4.610
808 1HG2 ILE 40 1HG2 ILE 40 -12.582 -19.056 -1.496
809 2HG2 ILE 40 2HG2 ILE 40 -10.996 -18.852 -2.253
810 3HG2 ILE 40 3HG2 ILE 40 -11.606 -17.645 -1.106
811 1HD1 ILE 40 1HD1 ILE 40 -12.569 -14.758 -2.932
812 2HD1 ILE 40 2HD1 ILE 40 -11.518 -15.421 -1.684
813 3HD1 ILE 40 3HD1 ILE 40 -10.815 -14.525 -3.055
814 H GLU 41 H GLU 41 -15.457 -18.368 -4.077
815 HA GLU 41 HA GLU 41 -16.117 -20.629 -2.590
816 1HB GLU 41 1HB GLU 41 -17.639 -18.673 -3.344
817 2HB GLU 41 2HB GLU 41 -17.824 -19.580 -4.862
818 1HG GLU 41 1HG GLU 41 -18.453 -21.582 -3.248
819 2HG GLU 41 2HG GLU 41 -18.740 -20.285 -2.080
820 H TRP 42 H TRP 42 -15.477 -20.286 -6.121
821 HA TRP 42 HA TRP 42 -16.296 -22.749 -7.019
822 1HB TRP 42 1HB TRP 42 -15.180 -20.707 -8.184
823 2HB TRP 42 2HB TRP 42 -13.667 -21.556 -7.890
824 HD1 TRP 42 HD1 TRP 42 -16.835 -21.739 -9.923
825 HE1 TRP 42 HE1 TRP 42 -16.738 -23.704 -11.594
826 HE3 TRP 42 HE3 TRP 42 -12.558 -23.830 -8.304
827 HZ2 TRP 42 HZ2 TRP 42 -15.050 -26.065 -11.998
828 HZ3 TRP 42 HZ3 TRP 42 -11.677 -25.963 -9.316
829 HH2 TRP 42 HH2 TRP 42 -13.034 -27.159 -11.020
830 H LEU 43 H LEU 43 -13.406 -21.934 -5.177
831 HA LEU 43 HA LEU 43 -12.244 -24.635 -5.316
832 1HB LEU 43 1HB LEU 43 -11.454 -22.180 -3.694
833 2HB LEU 43 2HB LEU 43 -10.646 -23.739 -3.665
834 HG LEU 43 HG LEU 43 -10.900 -23.106 -6.441
835 1HD1 LEU 43 1HD1 LEU 43 -11.382 -20.788 -5.902
836 2HD1 LEU 43 2HD1 LEU 43 -9.969 -20.681 -4.846
837 3HD1 LEU 43 3HD1 LEU 43 -9.756 -20.907 -6.590
838 1HD2 LEU 43 1HD2 LEU 43 -8.601 -23.038 -4.483
839 2HD2 LEU 43 2HD2 LEU 43 -9.094 -24.377 -5.523
840 3HD2 LEU 43 3HD2 LEU 43 -8.402 -22.911 -6.252
841 H GLU 44 H GLU 44 -14.064 -22.619 -2.961
842 HA GLU 44 HA GLU 44 -14.212 -24.882 -1.064
843 1HB GLU 44 1HB GLU 44 -15.673 -22.212 -0.988
844 2HB GLU 44 2HB GLU 44 -15.651 -23.453 0.264
845 1HG GLU 44 1HG GLU 44 -13.107 -23.239 0.264
846 2HG GLU 44 2HG GLU 44 -13.321 -21.737 -0.651
847 H THR 45 H THR 45 -15.195 -25.430 -3.741
848 HA THR 45 HA THR 45 -17.656 -26.679 -2.788
849 HB THR 45 HB THR 45 -18.175 -24.424 -3.866
850 HG1 THR 45 HG1 THR 45 -19.747 -26.077 -3.485
851 1HG2 THR 45 1HG2 THR 45 -16.886 -24.519 -5.847
852 2HG2 THR 45 2HG2 THR 45 -17.856 -25.863 -6.494
853 3HG2 THR 45 3HG2 THR 45 -18.589 -24.269 -6.197
854 H ILE 46 H ILE 46 -15.475 -26.094 -5.484
855 HA ILE 46 HA ILE 46 -14.910 -27.441 -7.249
856 HB ILE 46 HB ILE 46 -13.167 -27.606 -5.624
857 1HG1 ILE 46 1HG1 ILE 46 -12.017 -29.640 -6.308
858 2HG1 ILE 46 2HG1 ILE 46 -13.498 -30.298 -7.007
859 1HG2 ILE 46 1HG2 ILE 46 -14.279 -28.546 -3.685
860 2HG2 ILE 46 2HG2 ILE 46 -14.460 -30.114 -4.497
861 3HG2 ILE 46 3HG2 ILE 46 -12.854 -29.490 -4.103
862 1HD1 ILE 46 1HD1 ILE 46 -13.545 -28.467 -8.663
863 2HD1 ILE 46 2HD1 ILE 46 -12.176 -27.681 -7.836
864 3HD1 ILE 46 3HD1 ILE 46 -11.949 -29.232 -8.672
865 H LEU 47 H LEU 47 -17.215 -27.763 -7.738
866 HA LEU 47 HA LEU 47 -18.935 -28.977 -8.537
867 1HB LEU 47 1HB LEU 47 -16.915 -31.255 -8.498
868 2HB LEU 47 2HB LEU 47 -18.573 -31.503 -8.974
869 HG LEU 47 HG LEU 47 -17.137 -31.275 -10.861
870 1HD1 LEU 47 1HD1 LEU 47 -19.546 -30.650 -10.978
871 2HD1 LEU 47 2HD1 LEU 47 -19.091 -28.946 -10.766
872 3HD1 LEU 47 3HD1 LEU 47 -18.532 -29.843 -12.185
873 1HD2 LEU 47 1HD2 LEU 47 -16.707 -28.356 -10.128
874 2HD2 LEU 47 2HD2 LEU 47 -15.495 -29.650 -9.956
875 3HD2 LEU 47 3HD2 LEU 47 -16.112 -29.212 -11.560
876 H GLY 48 H GLY 48 -18.643 -28.510 -5.653
877 1HA GLY 48 1HA GLY 48 -20.665 -30.524 -4.722
878 2HA GLY 48 2HA GLY 48 -19.465 -29.715 -3.704
879 1HN NH2 49 1HN NH2 49 -21.439 -28.338 -6.392
880 2HN NH2 49 2HN NH2 49 -22.312 -27.162 -5.374
Start of MODEL 3
1 1H ACE 0 H1 ACE 0 2.099 -1.037 6.231
2 2H ACE 0 H2 ACE 0 0.763 -1.617 5.214
3 3H ACE 0 H3 ACE 0 2.206 -2.628 5.438
4 H ASP 1 H ASP 1 4.291 -1.328 4.902
5 HA ASP 1 HA ASP 1 4.948 0.710 3.401
6 1HB ASP 1 1HB ASP 1 6.556 -0.992 3.979
7 2HB ASP 1 2HB ASP 1 5.764 -2.193 2.950
8 H TYR 2 H TYR 2 3.827 -2.229 1.770
9 HA TYR 2 HA TYR 2 4.087 -1.284 -0.826
10 1HB TYR 2 1HB TYR 2 3.553 -3.631 0.318
11 2HB TYR 2 2HB TYR 2 1.906 -3.236 -0.147
12 HD1 TYR 2 HD1 TYR 2 5.374 -3.228 -1.662
13 HD2 TYR 2 HD2 TYR 2 1.209 -4.123 -2.237
14 HE1 TYR 2 HE1 TYR 2 5.985 -5.090 -3.184
15 HE2 TYR 2 HE2 TYR 2 1.821 -5.986 -3.771
16 HH TYR 2 HH TYR 2 5.135 -6.592 -4.856
17 H LEU 3 H LEU 3 1.491 -0.596 1.392
18 HA LEU 3 HA LEU 3 -0.025 0.699 -0.758
19 1HB LEU 3 1HB LEU 3 -1.147 -1.028 1.507
20 2HB LEU 3 2HB LEU 3 -2.160 -0.095 0.404
21 HG LEU 3 HG LEU 3 -0.352 -2.380 -0.493
22 1HD1 LEU 3 1HD1 LEU 3 -2.136 -3.173 1.019
23 2HD1 LEU 3 2HD1 LEU 3 -3.352 -2.321 0.042
24 3HD1 LEU 3 3HD1 LEU 3 -2.443 -3.680 -0.651
25 1HD2 LEU 3 1HD2 LEU 3 -2.597 -0.855 -1.898
26 2HD2 LEU 3 2HD2 LEU 3 -0.869 -0.763 -2.306
27 3HD2 LEU 3 3HD2 LEU 3 -1.752 -2.274 -2.547
28 H ARG 4 H ARG 4 1.110 1.069 2.496
29 HA ARG 4 HA ARG 4 -0.789 3.050 3.185
30 1HB ARG 4 1HB ARG 4 2.142 2.953 3.979
31 2HB ARG 4 2HB ARG 4 0.941 4.093 4.596
32 1HG ARG 4 1HG ARG 4 -0.447 1.892 5.171
33 2HG ARG 4 2HG ARG 4 1.136 1.128 5.039
34 1HD ARG 4 1HD ARG 4 0.975 1.678 7.314
35 2HD ARG 4 2HD ARG 4 1.989 2.973 6.635
36 HE ARG 4 HE ARG 4 -0.790 3.700 6.524
37 1HH1 ARG 4 1HH2 ARG 4 1.899 3.395 8.771
38 2HH1 ARG 4 2HH2 ARG 4 1.166 4.339 10.037
39 1HH2 ARG 4 1HH1 ARG 4 -1.833 4.869 8.192
40 2HH2 ARG 4 2HH1 ARG 4 -1.004 5.228 9.681
41 H GLU 5 H GLU 5 1.977 3.149 0.989
42 HA GLU 5 HA GLU 5 1.717 6.107 0.801
43 1HB GLU 5 1HB GLU 5 3.934 4.270 -0.149
44 2HB GLU 5 2HB GLU 5 3.771 5.992 -0.499
45 1HG GLU 5 1HG GLU 5 5.160 6.072 1.323
46 2HG GLU 5 2HG GLU 5 3.597 6.341 2.081
47 H LEU 6 H LEU 6 0.214 3.566 -0.627
48 HA LEU 6 HA LEU 6 0.042 4.925 -3.295
49 1HB LEU 6 1HB LEU 6 -0.246 1.973 -2.630
50 2HB LEU 6 2HB LEU 6 -0.433 2.783 -4.179
51 HG LEU 6 HG LEU 6 2.011 3.536 -3.985
52 1HD1 LEU 6 1HD1 LEU 6 2.945 3.274 -1.988
53 2HD1 LEU 6 2HD1 LEU 6 1.813 2.018 -1.460
54 3HD1 LEU 6 3HD1 LEU 6 3.201 1.604 -2.458
55 1HD2 LEU 6 1HD2 LEU 6 1.666 0.500 -4.016
56 2HD2 LEU 6 2HD2 LEU 6 0.844 1.456 -5.231
57 3HD2 LEU 6 3HD2 LEU 6 2.580 1.525 -5.152
58 H LEU 7 H LEU 7 -1.725 3.728 -0.515
59 HA LEU 7 HA LEU 7 -4.227 4.375 -1.853
60 1HB LEU 7 1HB LEU 7 -4.148 1.970 -1.732
61 2HB LEU 7 2HB LEU 7 -3.565 2.016 -0.065
62 HG LEU 7 HG LEU 7 -5.724 2.922 0.712
63 1HD1 LEU 7 1HD1 LEU 7 -7.639 3.138 -0.692
64 2HD1 LEU 7 2HD1 LEU 7 -6.384 4.080 -1.464
65 3HD1 LEU 7 3HD1 LEU 7 -6.784 2.476 -2.108
66 1HD2 LEU 7 1HD2 LEU 7 -5.989 0.387 -0.947
67 2HD2 LEU 7 2HD2 LEU 7 -5.324 0.503 0.697
68 3HD2 LEU 7 3HD2 LEU 7 -7.025 0.885 0.406
69 H LYS 8 H LYS 8 -2.560 3.916 1.292
70 HA LYS 8 HA LYS 8 -4.659 5.140 2.679
71 1HB LYS 8 1HB LYS 8 -2.973 3.511 3.591
72 2HB LYS 8 2HB LYS 8 -1.860 4.881 3.816
73 1HG LYS 8 1HG LYS 8 -4.675 4.935 4.922
74 2HG LYS 8 2HG LYS 8 -3.406 4.053 5.771
75 1HD LYS 8 1HD LYS 8 -2.194 5.950 6.330
76 2HD LYS 8 2HD LYS 8 -2.760 6.889 4.958
77 1HE LYS 8 1HE LYS 8 -4.996 7.113 5.901
78 2HE LYS 8 2HE LYS 8 -4.542 6.134 7.311
79 1HZ LYS 8 1HZ LYS 8 -2.938 7.817 7.868
80 2HZ LYS 8 2HZ LYS 8 -3.326 8.696 6.527
81 3HZ LYS 8 3HZ LYS 8 -4.436 8.491 7.725
82 H LEU 9 H LEU 9 -1.627 6.320 1.340
83 HA LEU 9 HA LEU 9 -1.928 9.075 2.119
84 1HB LEU 9 1HB LEU 9 -0.513 7.790 -0.239
85 2HB LEU 9 2HB LEU 9 -0.644 9.539 -0.049
86 HG LEU 9 HG LEU 9 0.724 7.682 1.928
87 1HD1 LEU 9 1HD1 LEU 9 1.908 8.108 -0.304
88 2HD1 LEU 9 2HD1 LEU 9 1.862 9.833 0.063
89 3HD1 LEU 9 3HD1 LEU 9 2.791 8.731 1.099
90 1HD2 LEU 9 1HD2 LEU 9 0.542 10.714 1.923
91 2HD2 LEU 9 2HD2 LEU 9 -0.135 9.627 3.165
92 3HD2 LEU 9 3HD2 LEU 9 1.607 9.750 2.956
93 H GLU 10 H GLU 10 -2.980 7.245 -0.847
94 HA GLU 10 HA GLU 10 -4.124 9.424 -2.170
95 1HB GLU 10 1HB GLU 10 -5.072 6.546 -2.060
96 2HB GLU 10 2HB GLU 10 -5.619 7.755 -3.191
97 1HG GLU 10 1HG GLU 10 -2.686 6.952 -3.053
98 2HG GLU 10 2HG GLU 10 -3.913 6.134 -4.036
99 H LEU 11 H LEU 11 -5.585 7.427 0.395
100 HA LEU 11 HA LEU 11 -8.218 8.565 0.304
101 1HB LEU 11 1HB LEU 11 -6.488 7.253 2.422
102 2HB LEU 11 2HB LEU 11 -7.905 8.122 2.990
103 HG LEU 11 HG LEU 11 -8.148 6.036 0.801
104 1HD1 LEU 11 1HD1 LEU 11 -7.064 4.920 2.691
105 2HD1 LEU 11 2HD1 LEU 11 -8.241 5.617 3.825
106 3HD1 LEU 11 3HD1 LEU 11 -8.761 4.428 2.609
107 1HD2 LEU 11 1HD2 LEU 11 -10.084 7.125 2.915
108 2HD2 LEU 11 2HD2 LEU 11 -10.082 7.593 1.203
109 3HD2 LEU 11 3HD2 LEU 11 -10.475 5.930 1.664
110 H GLN 12 H GLN 12 -5.385 9.742 2.237
111 HA GLN 12 HA GLN 12 -6.927 11.952 3.287
112 1HB GLN 12 1HB GLN 12 -4.779 12.993 3.895
113 2HB GLN 12 2HB GLN 12 -4.914 11.338 4.507
114 1HG GLN 12 1HG GLN 12 -3.364 10.506 3.001
115 2HG GLN 12 2HG GLN 12 -3.604 11.856 1.846
116 1HE2 GLN 12 2HE2 GLN 12 -1.449 12.125 1.511
117 2HE2 GLN 12 1HE2 GLN 12 -0.450 12.916 2.716
118 H LEU 13 H LEU 13 -5.509 11.399 0.142
119 HA LEU 13 HA LEU 13 -5.155 14.233 -0.463
120 1HB LEU 13 1HB LEU 13 -5.149 11.860 -2.359
121 2HB LEU 13 2HB LEU 13 -4.615 13.507 -2.673
122 HG LEU 13 HG LEU 13 -3.448 11.592 -0.645
123 1HD1 LEU 13 1HD1 LEU 13 -1.738 11.102 -1.926
124 2HD1 LEU 13 2HD1 LEU 13 -2.982 11.296 -3.190
125 3HD1 LEU 13 3HD1 LEU 13 -1.807 12.597 -2.866
126 1HD2 LEU 13 1HD2 LEU 13 -2.559 14.413 -1.371
127 2HD2 LEU 13 2HD2 LEU 13 -3.092 13.857 0.238
128 3HD2 LEU 13 3HD2 LEU 13 -1.589 13.242 -0.451
129 H ILE 14 H ILE 14 -7.423 11.617 -1.446
130 HA ILE 14 HA ILE 14 -9.268 13.326 -2.831
131 HB ILE 14 HB ILE 14 -9.669 10.759 -1.149
132 1HG1 ILE 14 1HG1 ILE 14 -8.176 10.292 -2.907
133 2HG1 ILE 14 2HG1 ILE 14 -9.739 9.682 -3.420
134 1HG2 ILE 14 1HG2 ILE 14 -11.751 10.422 -2.485
135 2HG2 ILE 14 2HG2 ILE 14 -11.871 11.846 -1.449
136 3HG2 ILE 14 3HG2 ILE 14 -11.583 12.037 -3.185
137 1HD1 ILE 14 1HD1 ILE 14 -9.980 11.940 -4.709
138 2HD1 ILE 14 2HD1 ILE 14 -8.241 12.147 -4.382
139 3HD1 ILE 14 3HD1 ILE 14 -8.813 10.775 -5.325
140 H LYS 15 H LYS 15 -9.123 12.392 0.507
141 HA LYS 15 HA LYS 15 -11.167 14.023 1.557
142 1HB LYS 15 1HB LYS 15 -9.343 12.322 2.668
143 2HB LYS 15 2HB LYS 15 -8.620 13.843 3.130
144 1HG LYS 15 1HG LYS 15 -9.964 13.268 4.940
145 2HG LYS 15 2HG LYS 15 -11.014 14.407 4.081
146 1HD LYS 15 1HD LYS 15 -12.221 12.483 3.032
147 2HD LYS 15 2HD LYS 15 -11.066 11.351 3.755
148 1HE LYS 15 1HE LYS 15 -11.796 12.065 6.035
149 2HE LYS 15 2HE LYS 15 -13.023 13.112 5.294
150 1HZ LYS 15 1HZ LYS 15 -13.979 11.150 4.300
151 2HZ LYS 15 2HZ LYS 15 -12.826 10.193 4.985
152 3HZ LYS 15 3HZ LYS 15 -13.905 10.989 5.939
153 H GLN 16 H GLN 16 -7.700 14.946 1.183
154 HA GLN 16 HA GLN 16 -8.052 17.638 2.136
155 1HB GLN 16 1HB GLN 16 -5.900 16.210 0.538
156 2HB GLN 16 2HB GLN 16 -5.813 17.945 0.799
157 1HG GLN 16 1HG GLN 16 -6.104 15.983 3.110
158 2HG GLN 16 2HG GLN 16 -4.540 16.520 2.484
159 1HE2 GLN 16 2HE2 GLN 16 -4.452 19.103 2.230
160 2HE2 GLN 16 1HE2 GLN 16 -5.072 19.948 3.639
161 H TYR 17 H TYR 17 -8.370 16.129 -1.017
162 HA TYR 17 HA TYR 17 -8.302 18.584 -2.557
163 1HB TYR 17 1HB TYR 17 -8.854 15.660 -3.031
164 2HB TYR 17 2HB TYR 17 -9.759 16.735 -4.005
165 HD1 TYR 17 HD1 TYR 17 -6.623 15.049 -3.823
166 HD2 TYR 17 HD2 TYR 17 -8.820 18.298 -5.616
167 HE1 TYR 17 HE1 TYR 17 -5.129 15.009 -5.764
168 HE2 TYR 17 HE2 TYR 17 -7.262 18.306 -7.510
169 HH TYR 17 HH TYR 17 -5.300 17.341 -8.427
170 H ARG 18 H ARG 18 -10.736 16.782 -0.754
171 HA ARG 18 HA ARG 18 -12.990 18.340 -1.815
172 1HB ARG 18 1HB ARG 18 -12.776 16.460 0.562
173 2HB ARG 18 2HB ARG 18 -14.230 17.361 0.104
174 1HG ARG 18 1HG ARG 18 -14.305 16.233 -2.075
175 2HG ARG 18 2HG ARG 18 -12.817 15.357 -1.698
176 1HD ARG 18 1HD ARG 18 -14.732 13.918 -1.338
177 2HD ARG 18 2HD ARG 18 -13.938 14.213 0.198
178 HE ARG 18 HE ARG 18 -16.583 15.163 -0.756
179 1HH1 ARG 18 1HH2 ARG 18 -14.176 15.397 1.820
180 2HH1 ARG 18 2HH2 ARG 18 -15.292 16.011 3.005
181 1HH2 ARG 18 1HH1 ARG 18 -18.040 15.990 0.756
182 2HH2 ARG 18 2HH1 ARG 18 -17.537 16.374 2.378
183 H GLU 19 H GLU 19 -10.990 18.229 1.072
184 HA GLU 19 HA GLU 19 -12.163 20.380 2.481
185 1HB GLU 19 1HB GLU 19 -10.307 18.795 3.287
186 2HB GLU 19 2HB GLU 19 -9.181 19.868 2.432
187 1HG GLU 19 1HG GLU 19 -10.054 21.792 3.782
188 2HG GLU 19 2HG GLU 19 -11.104 20.665 4.656
189 H ALA 20 H ALA 20 -9.661 20.394 -0.117
190 HA ALA 20 HA ALA 20 -9.436 23.327 0.051
191 1HB ALA 20 1HB ALA 20 -7.526 21.964 -0.548
192 2HB ALA 20 2HB ALA 20 -8.345 21.404 -2.026
193 3HB ALA 20 3HB ALA 20 -7.925 23.124 -1.828
194 H LEU 21 H LEU 21 -11.263 21.018 -1.989
195 HA LEU 21 HA LEU 21 -12.054 22.518 -4.087
196 1HB LEU 21 1HB LEU 21 -12.843 20.222 -3.655
197 2HB LEU 21 2HB LEU 21 -13.845 20.812 -2.323
198 HG LEU 21 HG LEU 21 -15.213 22.150 -3.928
199 1HD1 LEU 21 1HD1 LEU 21 -13.609 22.460 -5.745
200 2HD1 LEU 21 2HD1 LEU 21 -13.457 20.710 -5.951
201 3HD1 LEU 21 3HD1 LEU 21 -14.981 21.539 -6.359
202 1HD2 LEU 21 1HD2 LEU 21 -14.993 19.147 -4.312
203 2HD2 LEU 21 2HD2 LEU 21 -15.941 20.010 -3.094
204 3HD2 LEU 21 3HD2 LEU 21 -16.386 20.156 -4.798
205 H GLU 22 H GLU 22 -13.474 22.806 -0.847
206 HA GLU 22 HA GLU 22 -15.567 24.683 -1.610
207 1HB GLU 22 1HB GLU 22 -15.836 24.936 0.870
208 2HB GLU 22 2HB GLU 22 -16.139 23.328 0.195
209 1HG GLU 22 1HG GLU 22 -14.029 22.487 0.976
210 2HG GLU 22 2HG GLU 22 -13.494 24.113 1.453
211 H TYR 23 H TYR 23 -12.271 24.951 -0.454
212 HA TYR 23 HA TYR 23 -12.450 27.817 0.092
213 1HB TYR 23 1HB TYR 23 -10.275 25.683 0.028
214 2HB TYR 23 2HB TYR 23 -9.926 27.363 0.260
215 HD1 TYR 23 HD1 TYR 23 -13.076 26.638 1.917
216 HD2 TYR 23 HD2 TYR 23 -8.803 26.110 2.292
217 HE1 TYR 23 HE1 TYR 23 -13.317 26.416 4.329
218 HE2 TYR 23 HE2 TYR 23 -9.054 26.001 4.756
219 HH TYR 23 HH TYR 23 -12.251 26.128 6.337
220 H VAL 24 H VAL 24 -11.471 25.671 -2.551
221 HA VAL 24 HA VAL 24 -10.270 27.925 -4.038
222 HB VAL 24 HB VAL 24 -10.535 24.976 -4.719
223 1HG1 VAL 24 1HG1 VAL 24 -10.343 26.198 -6.811
224 2HG1 VAL 24 2HG1 VAL 24 -9.112 27.283 -6.130
225 3HG1 VAL 24 3HG1 VAL 24 -8.730 25.581 -6.425
226 1HG2 VAL 24 1HG2 VAL 24 -8.124 26.641 -3.857
227 2HG2 VAL 24 2HG2 VAL 24 -8.986 25.530 -2.784
228 3HG2 VAL 24 3HG2 VAL 24 -8.137 24.901 -4.201
229 H LYS 25 H LYS 25 -13.274 26.110 -4.041
230 HA LYS 25 HA LYS 25 -15.214 26.336 -5.140
231 1HB LYS 25 1HB LYS 25 -14.246 29.191 -5.577
232 2HB LYS 25 2HB LYS 25 -15.911 28.623 -5.747
233 1HG LYS 25 1HG LYS 25 -16.022 28.012 -3.396
234 2HG LYS 25 2HG LYS 25 -14.328 28.454 -3.140
235 1HD LYS 25 1HD LYS 25 -14.676 30.738 -3.478
236 2HD LYS 25 2HD LYS 25 -16.247 30.523 -4.262
237 1HE LYS 25 1HE LYS 25 -15.721 29.818 -1.335
238 2HE LYS 25 2HE LYS 25 -16.334 31.393 -1.872
239 1HZ LYS 25 1HZ LYS 25 -18.199 30.276 -2.859
240 2HZ LYS 25 2HZ LYS 25 -17.654 28.813 -2.334
241 3HZ LYS 25 3HZ LYS 25 -18.113 29.958 -1.243
242 H LEU 26 H LEU 26 -13.065 25.232 -6.727
243 HA LEU 26 HA LEU 26 -13.977 26.027 -9.467
244 1HB LEU 26 1HB LEU 26 -11.562 26.482 -9.026
245 2HB LEU 26 2HB LEU 26 -11.346 24.760 -8.705
246 HG LEU 26 HG LEU 26 -12.354 24.413 -11.106
247 1HD1 LEU 26 1HD1 LEU 26 -13.038 26.769 -11.533
248 2HD1 LEU 26 2HD1 LEU 26 -11.331 27.262 -11.403
249 3HD1 LEU 26 3HD1 LEU 26 -11.850 26.192 -12.710
250 1HD2 LEU 26 1HD2 LEU 26 -9.555 25.589 -10.755
251 2HD2 LEU 26 2HD2 LEU 26 -9.996 23.877 -10.624
252 3HD2 LEU 26 3HD2 LEU 26 -10.143 24.705 -12.172
253 HA PRO 27 HA PRO 27 -15.777 21.890 -8.829
254 1HB PRO 27 1HB PRO 27 -16.885 21.479 -11.324
255 2HB PRO 27 2HB PRO 27 -17.629 22.470 -10.039
256 1HG PRO 27 1HG PRO 27 -15.945 23.419 -12.367
257 2HG PRO 27 2HG PRO 27 -17.499 24.088 -11.793
258 1HD PRO 27 1HD PRO 27 -15.145 25.215 -11.112
259 2HD PRO 27 2HD PRO 27 -16.449 25.101 -9.895
260 H VAL 28 H VAL 28 -13.623 22.803 -11.530
261 HA VAL 28 HA VAL 28 -12.898 20.283 -12.432
262 HB VAL 28 HB VAL 28 -11.185 22.697 -12.141
263 1HG1 VAL 28 1HG1 VAL 28 -10.646 20.061 -13.534
264 2HG1 VAL 28 2HG1 VAL 28 -9.797 21.549 -13.963
265 3HG1 VAL 28 3HG1 VAL 28 -9.641 20.907 -12.326
266 1HG2 VAL 28 1HG2 VAL 28 -12.495 21.520 -14.616
267 2HG2 VAL 28 2HG2 VAL 28 -13.084 22.967 -13.746
268 3HG2 VAL 28 3HG2 VAL 28 -11.502 22.984 -14.545
269 H LEU 29 H LEU 29 -11.910 21.757 -9.252
270 HA LEU 29 HA LEU 29 -9.824 19.823 -8.778
271 1HB LEU 29 1HB LEU 29 -11.443 21.807 -7.137
272 2HB LEU 29 2HB LEU 29 -10.868 20.380 -6.328
273 HG LEU 29 HG LEU 29 -8.553 21.010 -7.499
274 1HD1 LEU 29 1HD1 LEU 29 -9.471 22.955 -8.677
275 2HD1 LEU 29 2HD1 LEU 29 -9.954 23.676 -7.125
276 3HD1 LEU 29 3HD1 LEU 29 -8.230 23.448 -7.510
277 1HD2 LEU 29 1HD2 LEU 29 -9.639 22.323 -4.967
278 2HD2 LEU 29 2HD2 LEU 29 -8.905 20.711 -5.074
279 3HD2 LEU 29 3HD2 LEU 29 -7.923 22.147 -5.391
280 H ALA 30 H ALA 30 -13.341 19.998 -8.100
281 HA ALA 30 HA ALA 30 -13.223 17.749 -6.491
282 1HB ALA 30 1HB ALA 30 -15.198 19.279 -6.541
283 2HB ALA 30 2HB ALA 30 -15.643 18.721 -8.152
284 3HB ALA 30 3HB ALA 30 -15.721 17.605 -6.775
285 H LYS 31 H LYS 31 -13.559 18.350 -10.024
286 HA LYS 31 HA LYS 31 -14.421 15.628 -10.756
287 1HB LYS 31 1HB LYS 31 -13.832 18.148 -12.287
288 2HB LYS 31 2HB LYS 31 -13.624 16.599 -13.104
289 1HG LYS 31 1HG LYS 31 -15.842 17.252 -13.571
290 2HG LYS 31 2HG LYS 31 -15.904 15.904 -12.451
291 1HD LYS 31 1HD LYS 31 -15.945 18.106 -10.712
292 2HD LYS 31 2HD LYS 31 -16.764 18.745 -12.131
293 1HE LYS 31 1HE LYS 31 -18.431 17.803 -10.662
294 2HE LYS 31 2HE LYS 31 -18.300 16.702 -12.045
295 1HZ LYS 31 1HZ LYS 31 -16.931 15.276 -10.694
296 2HZ LYS 31 2HZ LYS 31 -16.963 16.342 -9.442
297 3HZ LYS 31 3HZ LYS 31 -18.340 15.574 -9.917
298 H ILE 32 H ILE 32 -11.404 17.404 -10.576
299 HA ILE 32 HA ILE 32 -9.732 15.456 -11.904
300 HB ILE 32 HB ILE 32 -9.329 17.770 -9.991
301 1HG1 ILE 32 1HG1 ILE 32 -8.233 17.083 -12.767
302 2HG1 ILE 32 2HG1 ILE 32 -9.632 18.108 -12.457
303 1HG2 ILE 32 1HG2 ILE 32 -7.657 15.966 -9.286
304 2HG2 ILE 32 2HG2 ILE 32 -6.952 16.167 -10.909
305 3HG2 ILE 32 3HG2 ILE 32 -7.016 17.520 -9.793
306 1HD1 ILE 32 1HD1 ILE 32 -8.091 19.645 -11.125
307 2HD1 ILE 32 2HD1 ILE 32 -6.727 18.677 -11.734
308 3HD1 ILE 32 3HD1 ILE 32 -7.772 19.531 -12.872
309 H LEU 33 H LEU 33 -10.810 16.075 -8.484
310 HA LEU 33 HA LEU 33 -9.255 13.852 -7.608
311 1HB LEU 33 1HB LEU 33 -10.086 14.475 -5.428
312 2HB LEU 33 2HB LEU 33 -10.131 15.979 -6.366
313 HG LEU 33 HG LEU 33 -12.441 15.701 -6.730
314 1HD1 LEU 33 1HD1 LEU 33 -13.421 13.691 -6.413
315 2HD1 LEU 33 2HD1 LEU 33 -12.067 13.113 -5.396
316 3HD1 LEU 33 3HD1 LEU 33 -13.384 14.078 -4.695
317 1HD2 LEU 33 1HD2 LEU 33 -11.606 15.690 -3.854
318 2HD2 LEU 33 2HD2 LEU 33 -11.583 17.091 -4.983
319 3HD2 LEU 33 3HD2 LEU 33 -13.122 16.374 -4.492
320 H GLU 34 H GLU 34 -12.572 14.079 -8.799
321 HA GLU 34 HA GLU 34 -13.472 11.580 -7.909
322 1HB GLU 34 1HB GLU 34 -14.738 13.462 -9.151
323 2HB GLU 34 2HB GLU 34 -14.142 12.740 -10.642
324 1HG GLU 34 1HG GLU 34 -15.183 10.557 -9.972
325 2HG GLU 34 2HG GLU 34 -15.855 11.350 -8.537
326 H ASP 35 H ASP 35 -11.825 12.480 -10.918
327 HA ASP 35 HA ASP 35 -11.787 9.899 -12.075
328 1HB ASP 35 1HB ASP 35 -10.950 12.320 -12.977
329 2HB ASP 35 2HB ASP 35 -9.387 11.598 -12.540
330 H GLU 36 H GLU 36 -9.322 11.498 -10.017
331 HA GLU 36 HA GLU 36 -7.476 9.349 -9.855
332 1HB GLU 36 1HB GLU 36 -8.213 11.317 -7.647
333 2HB GLU 36 2HB GLU 36 -6.743 10.342 -7.730
334 1HG GLU 36 1HG GLU 36 -7.450 12.429 -9.828
335 2HG GLU 36 2HG GLU 36 -6.509 12.779 -8.377
336 H GLU 37 H GLU 37 -10.441 10.032 -7.889
337 HA GLU 37 HA GLU 37 -10.215 8.100 -5.994
338 1HB GLU 37 1HB GLU 37 -12.028 9.981 -6.694
339 2HB GLU 37 2HB GLU 37 -12.936 8.564 -7.198
340 1HG GLU 37 1HG GLU 37 -11.619 8.923 -4.467
341 2HG GLU 37 2HG GLU 37 -13.188 9.587 -4.897
342 H LYS 38 H LYS 38 -11.211 7.624 -9.389
343 HA LYS 38 HA LYS 38 -12.015 4.880 -9.009
344 1HB LYS 38 1HB LYS 38 -12.623 6.456 -10.953
345 2HB LYS 38 2HB LYS 38 -10.956 6.290 -11.491
346 1HG LYS 38 1HG LYS 38 -11.950 4.767 -12.855
347 2HG LYS 38 2HG LYS 38 -11.474 3.693 -11.544
348 1HD LYS 38 1HD LYS 38 -14.247 4.896 -12.041
349 2HD LYS 38 2HD LYS 38 -13.744 3.224 -12.340
350 1HE LYS 38 1HE LYS 38 -13.249 3.031 -9.839
351 2HE LYS 38 2HE LYS 38 -14.075 4.599 -9.642
352 1HZ LYS 38 1HZ LYS 38 -16.022 3.633 -10.583
353 2HZ LYS 38 2HZ LYS 38 -15.267 2.173 -10.756
354 3HZ LYS 38 3HZ LYS 38 -15.519 2.795 -9.254
355 H HIS 39 H HIS 39 -8.889 6.354 -9.931
356 HA HIS 39 HA HIS 39 -7.557 3.794 -10.318
357 1HB HIS 39 1HB HIS 39 -6.520 6.579 -9.606
358 2HB HIS 39 2HB HIS 39 -5.509 5.157 -9.825
359 HD1 HIS 39 HD1 HIS 39 -4.668 7.139 -11.802
360 HD2 HIS 39 HD2 HIS 39 -8.020 4.642 -12.423
361 HE1 HIS 39 HE1 HIS 39 -4.958 6.878 -14.333
362 HE2 HIS 39 HE2 HIS 39 -7.036 5.442 -14.698
363 H ILE 40 H ILE 40 -8.038 5.967 -7.564
364 HA ILE 40 HA ILE 40 -6.434 4.489 -5.717
365 HB ILE 40 HB ILE 40 -8.741 6.416 -5.291
366 1HG1 ILE 40 1HG1 ILE 40 -5.749 6.896 -5.126
367 2HG1 ILE 40 2HG1 ILE 40 -6.551 7.134 -6.633
368 1HG2 ILE 40 1HG2 ILE 40 -8.286 5.122 -3.222
369 2HG2 ILE 40 2HG2 ILE 40 -6.553 5.458 -3.395
370 3HG2 ILE 40 3HG2 ILE 40 -7.694 6.770 -3.033
371 1HD1 ILE 40 1HD1 ILE 40 -8.049 8.779 -5.763
372 2HD1 ILE 40 2HD1 ILE 40 -7.347 8.658 -4.149
373 3HD1 ILE 40 3HD1 ILE 40 -6.367 9.261 -5.501
374 H GLU 41 H GLU 41 -9.873 4.317 -6.642
375 HA GLU 41 HA GLU 41 -10.767 2.405 -4.793
376 1HB GLU 41 1HB GLU 41 -12.157 3.742 -6.507
377 2HB GLU 41 2HB GLU 41 -11.611 2.564 -7.716
378 1HG GLU 41 1HG GLU 41 -12.558 0.765 -6.141
379 2HG GLU 41 2HG GLU 41 -13.326 2.107 -5.271
380 H TRP 42 H TRP 42 -9.004 2.067 -7.931
381 HA TRP 42 HA TRP 42 -9.130 -0.657 -8.218
382 1HB TRP 42 1HB TRP 42 -8.024 1.259 -9.626
383 2HB TRP 42 2HB TRP 42 -6.562 0.812 -8.750
384 HD1 TRP 42 HD1 TRP 42 -8.971 -0.529 -11.337
385 HE1 TRP 42 HE1 TRP 42 -8.010 -2.679 -12.381
386 HE3 TRP 42 HE3 TRP 42 -5.039 -1.114 -8.259
387 HZ2 TRP 42 HZ2 TRP 42 -5.785 -4.509 -11.836
388 HZ3 TRP 42 HZ3 TRP 42 -3.442 -3.054 -8.521
389 HH2 TRP 42 HH2 TRP 42 -3.889 -4.793 -10.242
390 H LEU 43 H LEU 43 -7.017 1.237 -6.054
391 HA LEU 43 HA LEU 43 -5.530 -1.125 -5.157
392 1HB LEU 43 1HB LEU 43 -5.671 1.674 -3.996
393 2HB LEU 43 2HB LEU 43 -4.699 0.347 -3.364
394 HG LEU 43 HG LEU 43 -4.027 0.378 -6.096
395 1HD1 LEU 43 1HD1 LEU 43 -5.091 2.587 -6.361
396 2HD1 LEU 43 2HD1 LEU 43 -4.124 3.236 -5.025
397 3HD1 LEU 43 3HD1 LEU 43 -3.334 2.709 -6.521
398 1HD2 LEU 43 1HD2 LEU 43 -2.583 1.640 -3.729
399 2HD2 LEU 43 2HD2 LEU 43 -2.474 -0.057 -4.247
400 3HD2 LEU 43 3HD2 LEU 43 -1.848 1.223 -5.291
401 H GLU 44 H GLU 44 -8.557 0.381 -4.137
402 HA GLU 44 HA GLU 44 -8.631 -1.004 -1.533
403 1HB GLU 44 1HB GLU 44 -10.544 0.701 -3.155
404 2HB GLU 44 2HB GLU 44 -11.196 -0.318 -1.877
405 1HG GLU 44 1HG GLU 44 -8.823 1.399 -1.244
406 2HG GLU 44 2HG GLU 44 -10.414 2.166 -1.355
407 H THR 45 H THR 45 -9.350 -1.620 -4.655
408 HA THR 45 HA THR 45 -11.190 -3.930 -4.097
409 HB THR 45 HB THR 45 -11.487 -1.892 -5.815
410 HG1 THR 45 HG1 THR 45 -12.546 -4.512 -6.124
411 1HG2 THR 45 1HG2 THR 45 -9.761 -2.634 -7.410
412 2HG2 THR 45 2HG2 THR 45 -10.671 -4.141 -7.674
413 3HG2 THR 45 3HG2 THR 45 -11.383 -2.570 -8.101
414 H ILE 46 H ILE 46 -8.269 -3.204 -5.801
415 HA ILE 46 HA ILE 46 -6.876 -4.502 -7.124
416 HB ILE 46 HB ILE 46 -5.835 -4.011 -5.152
417 1HG1 ILE 46 1HG1 ILE 46 -4.284 -5.765 -4.660
418 2HG1 ILE 46 2HG1 ILE 46 -5.291 -6.994 -5.416
419 1HG2 ILE 46 1HG2 ILE 46 -7.479 -4.334 -3.528
420 2HG2 ILE 46 2HG2 ILE 46 -7.499 -6.092 -3.768
421 3HG2 ILE 46 3HG2 ILE 46 -6.089 -5.270 -3.030
422 1HD1 ILE 46 1HD1 ILE 46 -5.075 -5.842 -7.603
423 2HD1 ILE 46 2HD1 ILE 46 -4.208 -4.508 -6.809
424 3HD1 ILE 46 3HD1 ILE 46 -3.466 -6.120 -6.910
425 H LEU 47 H LEU 47 -8.638 -5.436 -8.352
426 HA LEU 47 HA LEU 47 -9.559 -7.062 -9.545
427 1HB LEU 47 1HB LEU 47 -6.958 -7.719 -9.544
428 2HB LEU 47 2HB LEU 47 -7.569 -9.133 -8.688
429 HG LEU 47 HG LEU 47 -9.369 -9.093 -10.729
430 1HD1 LEU 47 1HD1 LEU 47 -8.379 -7.003 -11.702
431 2HD1 LEU 47 2HD1 LEU 47 -6.857 -7.883 -11.962
432 3HD1 LEU 47 3HD1 LEU 47 -8.331 -8.382 -12.817
433 1HD2 LEU 47 1HD2 LEU 47 -6.554 -10.218 -10.957
434 2HD2 LEU 47 2HD2 LEU 47 -7.960 -11.006 -10.205
435 3HD2 LEU 47 3HD2 LEU 47 -7.955 -10.690 -11.946
436 H GLY 48 H GLY 48 -10.147 -6.968 -6.496
437 1HA GLY 48 1HA GLY 48 -12.050 -9.231 -6.581
438 2HA GLY 48 2HA GLY 48 -11.013 -8.981 -5.154
439 1HN NH2 49 1HN NH2 49 -12.841 -8.392 -3.814
440 2HN NH2 49 2HN NH2 49 -13.648 -6.813 -4.011
441 1H ACE 0 H1 ACE 0 1.450 28.355 -1.030
442 2H ACE 0 H2 ACE 0 0.238 29.438 -0.311
443 3H ACE 0 H3 ACE 0 1.559 28.783 0.689
444 H ASP 1 H ASP 1 -0.816 28.398 1.732
445 HA ASP 1 HA ASP 1 -0.847 25.894 2.567
446 1HB ASP 1 1HB ASP 1 -2.186 27.664 3.560
447 2HB ASP 1 2HB ASP 1 -3.345 27.582 2.220
448 H TYR 2 H TYR 2 -3.060 26.862 -0.099
449 HA TYR 2 HA TYR 2 -4.194 24.277 -0.591
450 1HB TYR 2 1HB TYR 2 -3.805 26.708 -2.360
451 2HB TYR 2 2HB TYR 2 -4.902 25.369 -2.628
452 HD1 TYR 2 HD1 TYR 2 -6.113 27.890 -2.853
453 HD2 TYR 2 HD2 TYR 2 -5.344 25.703 0.797
454 HE1 TYR 2 HE1 TYR 2 -7.762 29.286 -1.632
455 HE2 TYR 2 HE2 TYR 2 -6.765 27.254 2.029
456 HH TYR 2 HH TYR 2 -8.324 28.954 1.877
457 H LEU 3 H LEU 3 -1.234 25.849 -1.853
458 HA LEU 3 HA LEU 3 -0.801 23.498 -3.577
459 1HB LEU 3 1HB LEU 3 0.315 26.289 -3.896
460 2HB LEU 3 2HB LEU 3 0.477 24.942 -5.032
461 HG LEU 3 HG LEU 3 -2.122 26.383 -4.322
462 1HD1 LEU 3 1HD1 LEU 3 -0.558 27.692 -5.720
463 2HD1 LEU 3 2HD1 LEU 3 -0.469 26.346 -6.878
464 3HD1 LEU 3 3HD1 LEU 3 -2.002 27.207 -6.627
465 1HD2 LEU 3 1HD2 LEU 3 -1.593 24.107 -6.289
466 2HD2 LEU 3 2HD2 LEU 3 -2.631 24.030 -4.848
467 3HD2 LEU 3 3HD2 LEU 3 -3.088 25.058 -6.208
468 H ARG 4 H ARG 4 -0.033 23.768 -0.649
469 HA ARG 4 HA ARG 4 2.876 23.122 -1.101
470 1HB ARG 4 1HB ARG 4 3.322 23.610 1.169
471 2HB ARG 4 2HB ARG 4 2.505 25.012 0.454
472 1HG ARG 4 1HG ARG 4 0.412 24.351 1.483
473 2HG ARG 4 2HG ARG 4 1.105 22.861 2.130
474 1HD ARG 4 1HD ARG 4 2.655 24.170 3.514
475 2HD ARG 4 2HD ARG 4 1.880 25.679 2.952
476 HE ARG 4 HE ARG 4 -0.206 24.069 3.833
477 1HH1 ARG 4 1HH2 ARG 4 2.708 25.366 5.325
478 2HH1 ARG 4 2HH2 ARG 4 2.093 25.261 6.953
479 1HH2 ARG 4 1HH1 ARG 4 -1.043 23.948 5.888
480 2HH2 ARG 4 2HH1 ARG 4 -0.116 24.407 7.288
481 H GLU 5 H GLU 5 -0.108 21.647 -0.735
482 HA GLU 5 HA GLU 5 1.141 19.182 0.415
483 1HB GLU 5 1HB GLU 5 -1.151 20.815 1.483
484 2HB GLU 5 2HB GLU 5 -1.249 19.056 1.617
485 1HG GLU 5 1HG GLU 5 0.565 18.872 3.043
486 2HG GLU 5 2HG GLU 5 1.344 20.339 2.469
487 H LEU 6 H LEU 6 -1.752 20.563 -1.216
488 HA LEU 6 HA LEU 6 -2.880 18.122 -2.019
489 1HB LEU 6 1HB LEU 6 -2.915 20.878 -3.249
490 2HB LEU 6 2HB LEU 6 -3.887 19.552 -3.873
491 HG LEU 6 HG LEU 6 -5.285 19.418 -1.981
492 1HD1 LEU 6 1HD1 LEU 6 -3.763 19.716 -0.112
493 2HD1 LEU 6 2HD1 LEU 6 -3.541 21.435 -0.517
494 3HD1 LEU 6 3HD1 LEU 6 -5.121 20.831 -0.001
495 1HD2 LEU 6 1HD2 LEU 6 -4.784 22.020 -3.343
496 2HD2 LEU 6 2HD2 LEU 6 -6.257 21.061 -3.187
497 3HD2 LEU 6 3HD2 LEU 6 -5.723 22.133 -1.868
498 H LEU 7 H LEU 7 0.023 19.577 -3.216
499 HA LEU 7 HA LEU 7 0.016 17.684 -5.423
500 1HB LEU 7 1HB LEU 7 1.063 18.982 -6.903
501 2HB LEU 7 2HB LEU 7 -0.012 20.132 -6.131
502 HG LEU 7 HG LEU 7 2.952 19.851 -5.419
503 1HD1 LEU 7 1HD1 LEU 7 2.756 20.347 -7.794
504 2HD1 LEU 7 2HD1 LEU 7 1.625 21.673 -7.456
505 3HD1 LEU 7 3HD1 LEU 7 3.313 21.776 -6.911
506 1HD2 LEU 7 1HD2 LEU 7 0.953 22.133 -5.043
507 2HD2 LEU 7 2HD2 LEU 7 1.512 21.062 -3.738
508 3HD2 LEU 7 3HD2 LEU 7 2.662 22.131 -4.561
509 H LYS 8 H LYS 8 2.034 19.161 -2.881
510 HA LYS 8 HA LYS 8 4.336 17.706 -3.489
511 1HB LYS 8 1HB LYS 8 3.345 19.059 -0.974
512 2HB LYS 8 2HB LYS 8 4.825 18.096 -0.960
513 1HG LYS 8 1HG LYS 8 5.803 19.437 -2.761
514 2HG LYS 8 2HG LYS 8 4.357 20.465 -2.826
515 1HD LYS 8 1HD LYS 8 4.753 21.281 -0.587
516 2HD LYS 8 2HD LYS 8 5.989 20.061 -0.269
517 1HE LYS 8 1HE LYS 8 7.491 21.140 -1.888
518 2HE LYS 8 2HE LYS 8 6.218 22.293 -2.344
519 1HZ LYS 8 1HZ LYS 8 6.246 23.131 -0.122
520 2HZ LYS 8 2HZ LYS 8 7.399 22.048 0.336
521 3HZ LYS 8 3HZ LYS 8 7.759 23.219 -0.768
522 H LEU 9 H LEU 9 1.519 16.956 -1.426
523 HA LEU 9 HA LEU 9 2.641 14.529 -0.369
524 1HB LEU 9 1HB LEU 9 -0.269 15.318 -0.729
525 2HB LEU 9 2HB LEU 9 0.334 13.970 0.252
526 HG LEU 9 HG LEU 9 1.060 16.862 0.844
527 1HD1 LEU 9 1HD1 LEU 9 -1.383 16.562 0.993
528 2HD1 LEU 9 2HD1 LEU 9 -1.161 15.132 2.014
529 3HD1 LEU 9 3HD1 LEU 9 -0.675 16.727 2.610
530 1HD2 LEU 9 1HD2 LEU 9 1.255 14.299 2.484
531 2HD2 LEU 9 2HD2 LEU 9 2.616 15.226 1.814
532 3HD2 LEU 9 3HD2 LEU 9 1.602 15.934 3.077
533 H GLU 10 H GLU 10 1.060 15.336 -3.456
534 HA GLU 10 HA GLU 10 0.647 12.525 -4.271
535 1HB GLU 10 1HB GLU 10 1.013 14.993 -5.997
536 2HB GLU 10 2HB GLU 10 0.194 13.473 -6.363
537 1HG GLU 10 1HG GLU 10 -0.855 15.555 -4.412
538 2HG GLU 10 2HG GLU 10 -1.254 15.532 -6.127
539 H LEU 11 H LEU 11 3.107 15.093 -4.730
540 HA LEU 11 HA LEU 11 4.649 13.774 -6.608
541 1HB LEU 11 1HB LEU 11 4.819 16.126 -5.712
542 2HB LEU 11 2HB LEU 11 5.779 15.519 -4.363
543 HG LEU 11 HG LEU 11 6.549 15.070 -7.284
544 1HD1 LEU 11 1HD1 LEU 11 6.278 17.485 -6.914
545 2HD1 LEU 11 2HD1 LEU 11 7.306 17.398 -5.467
546 3HD1 LEU 11 3HD1 LEU 11 7.991 17.070 -7.074
547 1HD2 LEU 11 1HD2 LEU 11 8.162 15.078 -4.683
548 2HD2 LEU 11 2HD2 LEU 11 7.829 13.665 -5.709
549 3HD2 LEU 11 3HD2 LEU 11 8.860 14.959 -6.310
550 H GLN 12 H GLN 12 5.055 13.582 -3.030
551 HA GLN 12 HA GLN 12 7.121 11.597 -3.115
552 1HB GLN 12 1HB GLN 12 6.506 11.105 -0.776
553 2HB GLN 12 2HB GLN 12 6.694 12.841 -1.074
554 1HG GLN 12 1HG GLN 12 4.275 13.127 -1.183
555 2HG GLN 12 2HG GLN 12 4.014 11.381 -0.996
556 1HE2 GLN 12 2HE2 GLN 12 2.595 12.148 0.759
557 2HE2 GLN 12 1HE2 GLN 12 3.342 12.396 2.337
558 H LEU 13 H LEU 13 3.679 11.341 -3.535
559 HA LEU 13 HA LEU 13 3.385 8.540 -2.905
560 1HB LEU 13 1HB LEU 13 1.372 9.416 -2.469
561 2HB LEU 13 2HB LEU 13 1.709 10.834 -3.382
562 HG LEU 13 HG LEU 13 0.958 9.934 -5.397
563 1HD1 LEU 13 1HD1 LEU 13 1.368 7.396 -5.128
564 2HD1 LEU 13 2HD1 LEU 13 0.326 7.417 -3.699
565 3HD1 LEU 13 3HD1 LEU 13 -0.357 7.695 -5.300
566 1HD2 LEU 13 1HD2 LEU 13 -1.080 9.336 -3.256
567 2HD2 LEU 13 2HD2 LEU 13 -0.595 10.943 -3.833
568 3HD2 LEU 13 3HD2 LEU 13 -1.359 9.832 -4.950
569 H ILE 14 H ILE 14 3.454 10.504 -5.953
570 HA ILE 14 HA ILE 14 3.435 8.275 -7.741
571 HB ILE 14 HB ILE 14 4.164 11.183 -7.868
572 1HG1 ILE 14 1HG1 ILE 14 2.560 11.160 -9.688
573 2HG1 ILE 14 2HG1 ILE 14 2.535 9.397 -9.737
574 1HG2 ILE 14 1HG2 ILE 14 6.077 10.313 -9.084
575 2HG2 ILE 14 2HG2 ILE 14 5.035 9.211 -10.013
576 3HG2 ILE 14 3HG2 ILE 14 4.911 10.962 -10.228
577 1HD1 ILE 14 1HD1 ILE 14 1.316 9.263 -7.666
578 2HD1 ILE 14 2HD1 ILE 14 1.660 10.945 -7.276
579 3HD1 ILE 14 3HD1 ILE 14 0.558 10.550 -8.602
580 H LYS 15 H LYS 15 6.122 9.901 -6.082
581 HA LYS 15 HA LYS 15 8.179 8.279 -7.188
582 1HB LYS 15 1HB LYS 15 8.007 10.408 -5.359
583 2HB LYS 15 2HB LYS 15 8.504 9.066 -4.359
584 1HG LYS 15 1HG LYS 15 10.484 10.154 -5.134
585 2HG LYS 15 2HG LYS 15 10.380 8.666 -6.094
586 1HD LYS 15 1HD LYS 15 9.369 9.984 -7.981
587 2HD LYS 15 2HD LYS 15 9.398 11.439 -6.975
588 1HE LYS 15 1HE LYS 15 11.877 11.325 -6.868
589 2HE LYS 15 2HE LYS 15 11.856 9.853 -7.859
590 1HZ LYS 15 1HZ LYS 15 10.861 11.125 -9.617
591 2HZ LYS 15 2HZ LYS 15 10.868 12.490 -8.695
592 3HZ LYS 15 3HZ LYS 15 12.291 11.802 -9.156
593 H GLN 16 H GLN 16 6.123 7.838 -4.260
594 HA GLN 16 HA GLN 16 7.351 5.321 -3.543
595 1HB GLN 16 1HB GLN 16 4.738 6.665 -2.802
596 2HB GLN 16 2HB GLN 16 5.176 5.064 -2.205
597 1HG GLN 16 1HG GLN 16 7.063 7.439 -1.891
598 2HG GLN 16 2HG GLN 16 5.801 7.090 -0.717
599 1HE2 GLN 16 2HE2 GLN 16 9.041 6.424 -1.533
600 2HE2 GLN 16 1HE2 GLN 16 9.222 4.955 -0.598
601 H TYR 17 H TYR 17 4.709 6.155 -5.730
602 HA TYR 17 HA TYR 17 3.705 3.521 -6.141
603 1HB TYR 17 1HB TYR 17 3.660 6.139 -7.627
604 2HB TYR 17 2HB TYR 17 3.335 4.726 -8.569
605 HD1 TYR 17 HD1 TYR 17 1.553 7.144 -8.100
606 HD2 TYR 17 HD2 TYR 17 1.642 3.110 -6.671
607 HE1 TYR 17 HE1 TYR 17 -0.895 7.206 -7.825
608 HE2 TYR 17 HE2 TYR 17 -0.829 3.126 -6.493
609 HH TYR 17 HH TYR 17 -2.707 6.085 -6.755
610 H ARG 18 H ARG 18 6.658 5.125 -7.193
611 HA ARG 18 HA ARG 18 7.117 3.207 -9.350
612 1HB ARG 18 1HB ARG 18 8.944 5.283 -8.146
613 2HB ARG 18 2HB ARG 18 9.463 4.035 -9.275
614 1HG ARG 18 1HG ARG 18 7.311 4.886 -10.676
615 2HG ARG 18 2HG ARG 18 7.578 6.323 -9.715
616 1HD ARG 18 1HD ARG 18 8.832 6.517 -11.817
617 2HD ARG 18 2HD ARG 18 10.030 6.197 -10.539
618 HE ARG 18 HE ARG 18 8.915 3.809 -11.825
619 1HH1 ARG 18 1HH2 ARG 18 11.478 6.217 -12.064
620 2HH1 ARG 18 2HH2 ARG 18 12.557 5.191 -12.969
621 1HH2 ARG 18 1HH1 ARG 18 10.271 2.467 -13.013
622 2HH2 ARG 18 2HH1 ARG 18 11.840 3.002 -13.543
623 H GLU 19 H GLU 19 8.225 3.803 -6.092
624 HA GLU 19 HA GLU 19 9.942 1.597 -5.700
625 1HB GLU 19 1HB GLU 19 9.487 3.592 -4.159
626 2HB GLU 19 2HB GLU 19 8.080 2.689 -3.573
627 1HG GLU 19 1HG GLU 19 9.533 0.844 -2.853
628 2HG GLU 19 2HG GLU 19 10.953 1.691 -3.496
629 H ALA 20 H ALA 20 6.399 1.871 -5.263
630 HA ALA 20 HA ALA 20 6.177 -1.092 -4.905
631 1HB ALA 20 1HB ALA 20 5.155 0.115 -3.129
632 2HB ALA 20 2HB ALA 20 4.430 1.265 -4.239
633 3HB ALA 20 3HB ALA 20 3.821 -0.414 -4.156
634 H LEU 21 H LEU 21 6.700 0.352 -7.551
635 HA LEU 21 HA LEU 21 4.475 -0.958 -9.091
636 1HB LEU 21 1HB LEU 21 4.760 1.159 -10.042
637 2HB LEU 21 2HB LEU 21 6.495 1.166 -9.715
638 HG LEU 21 HG LEU 21 6.904 -0.447 -11.530
639 1HD1 LEU 21 1HD1 LEU 21 4.619 -1.513 -11.584
640 2HD1 LEU 21 2HD1 LEU 21 3.975 0.011 -12.219
641 3HD1 LEU 21 3HD1 LEU 21 5.154 -0.915 -13.164
642 1HD2 LEU 21 1HD2 LEU 21 5.418 2.090 -12.276
643 2HD2 LEU 21 2HD2 LEU 21 7.132 1.967 -11.835
644 3HD2 LEU 21 3HD2 LEU 21 6.550 1.187 -13.314
645 H GLU 22 H GLU 22 8.018 -0.602 -8.783
646 HA GLU 22 HA GLU 22 8.625 -2.638 -10.637
647 1HB GLU 22 1HB GLU 22 10.897 -2.635 -9.744
648 2HB GLU 22 2HB GLU 22 10.280 -1.021 -10.131
649 1HG GLU 22 1HG GLU 22 9.801 -0.633 -7.733
650 2HG GLU 22 2HG GLU 22 10.456 -2.237 -7.350
651 H TYR 23 H TYR 23 8.259 -2.695 -7.142
652 HA TYR 23 HA TYR 23 8.819 -5.514 -6.876
653 1HB TYR 23 1HB TYR 23 8.650 -3.244 -5.198
654 2HB TYR 23 2HB TYR 23 7.350 -4.274 -4.670
655 HD1 TYR 23 HD1 TYR 23 10.992 -3.857 -4.980
656 HD2 TYR 23 HD2 TYR 23 7.883 -6.607 -3.809
657 HE1 TYR 23 HE1 TYR 23 12.669 -5.267 -3.819
658 HE2 TYR 23 HE2 TYR 23 9.554 -7.996 -2.632
659 HH TYR 23 HH TYR 23 11.764 -8.232 -2.048
660 H VAL 24 H VAL 24 6.053 -3.841 -7.970
661 HA VAL 24 HA VAL 24 4.222 -6.082 -7.191
662 HB VAL 24 HB VAL 24 3.656 -3.369 -8.422
663 1HG1 VAL 24 1HG1 VAL 24 2.010 -4.910 -9.315
664 2HG1 VAL 24 2HG1 VAL 24 1.831 -5.728 -7.750
665 3HG1 VAL 24 3HG1 VAL 24 1.236 -4.079 -7.959
666 1HG2 VAL 24 1HG2 VAL 24 2.849 -4.607 -5.773
667 2HG2 VAL 24 2HG2 VAL 24 4.193 -3.453 -5.925
668 3HG2 VAL 24 3HG2 VAL 24 2.527 -2.953 -6.281
669 H LYS 25 H LYS 25 5.825 -4.673 -10.011
670 HA LYS 25 HA LYS 25 5.955 -5.284 -12.187
671 1HB LYS 25 1HB LYS 25 5.099 -8.073 -11.286
672 2HB LYS 25 2HB LYS 25 5.697 -7.608 -12.867
673 1HG LYS 25 1HG LYS 25 7.714 -6.684 -11.142
674 2HG LYS 25 2HG LYS 25 7.170 -8.201 -10.409
675 1HD LYS 25 1HD LYS 25 7.329 -9.244 -12.782
676 2HD LYS 25 2HD LYS 25 8.086 -7.728 -13.292
677 1HE LYS 25 1HE LYS 25 9.859 -9.265 -12.874
678 2HE LYS 25 2HE LYS 25 9.869 -8.136 -11.507
679 1HZ LYS 25 1HZ LYS 25 8.668 -9.789 -10.245
680 2HZ LYS 25 2HZ LYS 25 8.638 -10.812 -11.536
681 3HZ LYS 25 3HZ LYS 25 10.073 -10.427 -10.826
682 H LEU 26 H LEU 26 3.830 -3.777 -11.886
683 HA LEU 26 HA LEU 26 1.814 -5.117 -13.628
684 1HB LEU 26 1HB LEU 26 0.996 -5.145 -11.312
685 2HB LEU 26 2HB LEU 26 1.206 -3.392 -11.227
686 HG LEU 26 HG LEU 26 -0.418 -3.333 -13.282
687 1HD1 LEU 26 1HD1 LEU 26 -0.368 -5.791 -13.762
688 2HD1 LEU 26 2HD1 LEU 26 -1.075 -6.095 -12.166
689 3HD1 LEU 26 3HD1 LEU 26 -2.001 -5.214 -13.396
690 1HD2 LEU 26 1HD2 LEU 26 -1.352 -4.161 -10.506
691 2HD2 LEU 26 2HD2 LEU 26 -1.016 -2.506 -11.061
692 3HD2 LEU 26 3HD2 LEU 26 -2.372 -3.411 -11.754
693 HA PRO 27 HA PRO 27 3.003 -1.312 -15.758
694 1HB PRO 27 1HB PRO 27 1.486 -1.552 -18.036
695 2HB PRO 27 2HB PRO 27 3.006 -2.443 -17.749
696 1HG PRO 27 1HG PRO 27 0.179 -3.432 -17.322
697 2HG PRO 27 2HG PRO 27 1.525 -4.273 -18.143
698 1HD PRO 27 1HD PRO 27 0.867 -4.790 -15.568
699 2HD PRO 27 2HD PRO 27 2.584 -4.777 -16.069
700 H VAL 28 H VAL 28 -0.404 -2.325 -15.247
701 HA VAL 28 HA VAL 28 -1.701 0.125 -15.592
702 HB VAL 28 HB VAL 28 -2.211 -2.042 -13.599
703 1HG1 VAL 28 1HG1 VAL 28 -3.296 -0.081 -12.710
704 2HG1 VAL 28 2HG1 VAL 28 -3.960 0.335 -14.307
705 3HG1 VAL 28 3HG1 VAL 28 -4.528 -1.107 -13.436
706 1HG2 VAL 28 1HG2 VAL 28 -3.583 -1.383 -16.232
707 2HG2 VAL 28 2HG2 VAL 28 -2.452 -2.733 -15.978
708 3HG2 VAL 28 3HG2 VAL 28 -4.008 -2.712 -15.136
709 H LEU 29 H LEU 29 0.331 -0.949 -12.838
710 HA LEU 29 HA LEU 29 -0.390 1.238 -11.111
711 1HB LEU 29 1HB LEU 29 1.361 -1.061 -11.050
712 2HB LEU 29 2HB LEU 29 2.331 0.345 -10.635
713 HG LEU 29 HG LEU 29 -0.375 -0.043 -9.321
714 1HD1 LEU 29 1HD1 LEU 29 0.663 -2.201 -9.087
715 2HD1 LEU 29 2HD1 LEU 29 2.194 -1.467 -8.561
716 3HD1 LEU 29 3HD1 LEU 29 0.749 -1.345 -7.536
717 1HD2 LEU 29 1HD2 LEU 29 2.296 1.080 -8.337
718 2HD2 LEU 29 2HD2 LEU 29 0.975 2.065 -9.010
719 3HD2 LEU 29 3HD2 LEU 29 0.724 1.142 -7.512
720 H ALA 30 H ALA 30 2.215 0.774 -13.514
721 HA ALA 30 HA ALA 30 3.324 3.360 -13.124
722 1HB ALA 30 1HB ALA 30 4.449 1.489 -14.409
723 2HB ALA 30 2HB ALA 30 3.302 1.761 -15.731
724 3HB ALA 30 3HB ALA 30 4.434 3.041 -15.268
725 H LYS 31 H LYS 31 0.569 2.172 -15.015
726 HA LYS 31 HA LYS 31 0.268 4.622 -16.519
727 1HB LYS 31 1HB LYS 31 -0.631 2.304 -17.152
728 2HB LYS 31 2HB LYS 31 -1.912 2.584 -15.953
729 1HG LYS 31 1HG LYS 31 -2.517 4.701 -17.189
730 2HG LYS 31 2HG LYS 31 -1.299 4.291 -18.409
731 1HD LYS 31 1HD LYS 31 -2.503 2.144 -18.862
732 2HD LYS 31 2HD LYS 31 -3.710 2.579 -17.630
733 1HE LYS 31 1HE LYS 31 -4.272 4.644 -18.940
734 2HE LYS 31 2HE LYS 31 -3.120 4.142 -20.192
735 1HZ LYS 31 1HZ LYS 31 -4.437 2.167 -20.508
736 2HZ LYS 31 2HZ LYS 31 -5.504 2.649 -19.347
737 3HZ LYS 31 3HZ LYS 31 -5.347 3.522 -20.734
738 H ILE 32 H ILE 32 -0.833 3.506 -13.363
739 HA ILE 32 HA ILE 32 -2.908 5.519 -13.063
740 HB ILE 32 HB ILE 32 -1.521 3.547 -11.199
741 1HG1 ILE 32 1HG1 ILE 32 -4.461 3.852 -11.954
742 2HG1 ILE 32 2HG1 ILE 32 -3.345 2.825 -12.849
743 1HG2 ILE 32 1HG2 ILE 32 -1.848 5.492 -9.836
744 2HG2 ILE 32 2HG2 ILE 32 -3.454 5.788 -10.510
745 3HG2 ILE 32 3HG2 ILE 32 -3.162 4.396 -9.444
746 1HD1 ILE 32 1HD1 ILE 32 -2.874 1.529 -10.766
747 2HD1 ILE 32 2HD1 ILE 32 -4.114 2.479 -9.918
748 3HD1 ILE 32 3HD1 ILE 32 -4.571 1.459 -11.283
749 H LEU 33 H LEU 33 0.476 4.924 -11.984
750 HA LEU 33 HA LEU 33 0.668 7.382 -10.508
751 1HB LEU 33 1HB LEU 33 2.795 6.738 -10.064
752 2HB LEU 33 2HB LEU 33 2.030 5.197 -10.479
753 HG LEU 33 HG LEU 33 3.090 5.360 -12.692
754 1HD1 LEU 33 1HD1 LEU 33 3.832 7.395 -13.295
755 2HD1 LEU 33 2HD1 LEU 33 4.061 7.923 -11.611
756 3HD1 LEU 33 3HD1 LEU 33 5.278 6.899 -12.420
757 1HD2 LEU 33 1HD2 LEU 33 4.869 5.450 -10.232
758 2HD2 LEU 33 2HD2 LEU 33 3.925 4.039 -10.760
759 3HD2 LEU 33 3HD2 LEU 33 5.253 4.630 -11.771
760 H GLU 34 H GLU 34 1.329 6.585 -13.959
761 HA GLU 34 HA GLU 34 2.405 9.085 -14.695
762 1HB GLU 34 1HB GLU 34 2.263 6.885 -16.025
763 2HB GLU 34 2HB GLU 34 0.654 7.382 -16.512
764 1HG GLU 34 1HG GLU 34 3.219 9.002 -16.933
765 2HG GLU 34 2HG GLU 34 2.497 7.932 -18.140
766 H ASP 35 H ASP 35 -0.960 7.911 -15.004
767 HA ASP 35 HA ASP 35 -2.057 10.317 -16.016
768 1HB ASP 35 1HB ASP 35 -3.177 8.038 -15.858
769 2HB ASP 35 2HB ASP 35 -3.460 8.397 -14.142
770 H GLU 36 H GLU 36 -1.817 9.140 -12.633
771 HA GLU 36 HA GLU 36 -2.926 11.382 -11.347
772 1HB GLU 36 1HB GLU 36 -0.662 9.597 -10.397
773 2HB GLU 36 2HB GLU 36 -1.605 10.704 -9.396
774 1HG GLU 36 1HG GLU 36 -3.329 8.811 -10.895
775 2HG GLU 36 2HG GLU 36 -2.130 7.981 -9.893
776 H GLU 37 H GLU 37 0.472 10.807 -12.551
777 HA GLU 37 HA GLU 37 1.605 13.113 -11.471
778 1HB GLU 37 1HB GLU 37 2.402 10.994 -13.110
779 2HB GLU 37 2HB GLU 37 2.481 12.321 -14.241
780 1HG GLU 37 1HG GLU 37 3.701 12.392 -11.438
781 2HG GLU 37 2HG GLU 37 4.476 11.646 -12.833
782 H LYS 38 H LYS 38 -0.344 12.781 -14.461
783 HA LYS 38 HA LYS 38 0.044 15.515 -15.277
784 1HB LYS 38 1HB LYS 38 -0.907 13.696 -16.721
785 2HB LYS 38 2HB LYS 38 -2.375 13.727 -15.731
786 1HG LYS 38 1HG LYS 38 -2.602 16.207 -16.276
787 2HG LYS 38 2HG LYS 38 -1.255 16.025 -17.408
788 1HD LYS 38 1HD LYS 38 -2.575 14.440 -18.744
789 2HD LYS 38 2HD LYS 38 -3.856 14.418 -17.511
790 1HE LYS 38 1HE LYS 38 -4.250 16.857 -17.862
791 2HE LYS 38 2HE LYS 38 -2.997 16.881 -19.116
792 1HZ LYS 38 1HZ LYS 38 -4.325 15.349 -20.376
793 2HZ LYS 38 2HZ LYS 38 -5.476 15.304 -19.195
794 3HZ LYS 38 3HZ LYS 38 -5.195 16.703 -20.021
795 H HIS 39 H HIS 39 -2.302 13.909 -13.081
796 HA HIS 39 HA HIS 39 -3.897 16.261 -12.641
797 1HB HIS 39 1HB HIS 39 -3.545 13.746 -10.987
798 2HB HIS 39 2HB HIS 39 -4.604 15.069 -10.542
799 HD1 HIS 39 HD1 HIS 39 -6.986 14.140 -11.015
800 HD2 HIS 39 HD2 HIS 39 -4.236 13.499 -14.150
801 HE1 HIS 39 HE1 HIS 39 -8.329 13.369 -13.043
802 HE2 HIS 39 HE2 HIS 39 -6.617 12.828 -14.884
803 H ILE 40 H ILE 40 -0.942 15.027 -11.054
804 HA ILE 40 HA ILE 40 -0.800 17.072 -9.028
805 HB ILE 40 HB ILE 40 1.571 15.709 -10.382
806 1HG1 ILE 40 1HG1 ILE 40 -0.045 14.877 -7.969
807 2HG1 ILE 40 2HG1 ILE 40 -0.052 14.037 -9.484
808 1HG2 ILE 40 1HG2 ILE 40 1.984 17.763 -8.844
809 2HG2 ILE 40 2HG2 ILE 40 1.235 16.817 -7.546
810 3HG2 ILE 40 3HG2 ILE 40 2.744 16.280 -8.292
811 1HD1 ILE 40 1HD1 ILE 40 2.440 13.707 -9.374
812 2HD1 ILE 40 2HD1 ILE 40 2.368 14.220 -7.679
813 3HD1 ILE 40 3HD1 ILE 40 1.446 12.819 -8.217
814 H GLU 41 H GLU 41 0.591 16.767 -12.297
815 HA GLU 41 HA GLU 41 1.941 19.188 -12.439
816 1HB GLU 41 1HB GLU 41 1.961 17.235 -14.106
817 2HB GLU 41 2HB GLU 41 0.426 17.833 -14.723
818 1HG GLU 41 1HG GLU 41 2.322 20.029 -14.645
819 2HG GLU 41 2HG GLU 41 3.041 18.639 -15.464
820 H TRP 42 H TRP 42 -1.559 18.506 -12.992
821 HA TRP 42 HA TRP 42 -2.362 20.944 -13.983
822 1HB TRP 42 1HB TRP 42 -3.597 18.688 -13.388
823 2HB TRP 42 2HB TRP 42 -3.940 19.494 -11.858
824 HD1 TRP 42 HD1 TRP 42 -4.934 19.384 -15.461
825 HE1 TRP 42 HE1 TRP 42 -6.906 20.942 -15.919
826 HE3 TRP 42 HE3 TRP 42 -4.905 21.763 -11.014
827 HZ2 TRP 42 HZ2 TRP 42 -8.185 23.176 -14.511
828 HZ3 TRP 42 HZ3 TRP 42 -6.482 23.659 -10.538
829 HH2 TRP 42 HH2 TRP 42 -7.975 24.482 -12.330
830 H LEU 43 H LEU 43 -1.604 20.023 -10.631
831 HA LEU 43 HA LEU 43 -2.559 22.514 -9.479
832 1HB LEU 43 1HB LEU 43 -0.890 20.231 -8.327
833 2HB LEU 43 2HB LEU 43 -1.330 21.648 -7.408
834 HG LEU 43 HG LEU 43 -3.756 20.509 -8.516
835 1HD1 LEU 43 1HD1 LEU 43 -2.602 18.361 -8.520
836 2HD1 LEU 43 2HD1 LEU 43 -1.931 18.645 -6.907
837 3HD1 LEU 43 3HD1 LEU 43 -3.668 18.400 -7.109
838 1HD2 LEU 43 1HD2 LEU 43 -2.664 20.749 -5.673
839 2HD2 LEU 43 2HD2 LEU 43 -3.574 22.015 -6.525
840 3HD2 LEU 43 3HD2 LEU 43 -4.362 20.480 -6.111
841 H GLU 44 H GLU 44 0.324 21.690 -11.165
842 HA GLU 44 HA GLU 44 1.739 23.927 -9.815
843 1HB GLU 44 1HB GLU 44 3.733 23.045 -10.319
844 2HB GLU 44 2HB GLU 44 2.789 21.556 -10.213
845 1HG GLU 44 1HG GLU 44 2.572 21.615 -12.706
846 2HG GLU 44 2HG GLU 44 3.589 23.067 -12.721
847 H THR 45 H THR 45 0.622 22.801 -12.837
848 HA THR 45 HA THR 45 1.622 24.963 -14.405
849 HB THR 45 HB THR 45 0.618 22.599 -15.056
850 HG1 THR 45 HG1 THR 45 0.591 24.934 -16.660
851 1HG2 THR 45 1HG2 THR 45 -1.754 23.084 -14.614
852 2HG2 THR 45 2HG2 THR 45 -1.721 24.371 -15.842
853 3HG2 THR 45 3HG2 THR 45 -1.432 22.685 -16.304
854 H ILE 46 H ILE 46 -1.518 24.362 -12.945
855 HA ILE 46 HA ILE 46 -3.063 26.503 -13.396
856 HB ILE 46 HB ILE 46 -3.499 24.727 -11.730
857 1HG1 ILE 46 1HG1 ILE 46 -4.609 25.972 -9.972
858 2HG1 ILE 46 2HG1 ILE 46 -3.791 27.469 -10.444
859 1HG2 ILE 46 1HG2 ILE 46 -1.203 24.748 -10.779
860 2HG2 ILE 46 2HG2 ILE 46 -1.634 26.155 -9.806
861 3HG2 ILE 46 3HG2 ILE 46 -2.516 24.648 -9.594
862 1HD1 ILE 46 1HD1 ILE 46 -4.916 27.462 -12.603
863 2HD1 ILE 46 2HD1 ILE 46 -5.521 25.812 -12.336
864 3HD1 ILE 46 3HD1 ILE 46 -6.144 27.161 -11.360
865 H LEU 47 H LEU 47 -0.110 26.742 -11.351
866 HA LEU 47 HA LEU 47 -0.567 29.660 -10.963
867 1HB LEU 47 1HB LEU 47 0.102 28.161 -9.021
868 2HB LEU 47 2HB LEU 47 1.617 27.854 -9.871
869 HG LEU 47 HG LEU 47 1.786 30.529 -9.897
870 1HD1 LEU 47 1HD1 LEU 47 -0.490 30.885 -8.921
871 2HD1 LEU 47 2HD1 LEU 47 0.031 30.031 -7.453
872 3HD1 LEU 47 3HD1 LEU 47 0.801 31.562 -7.914
873 1HD2 LEU 47 1HD2 LEU 47 2.300 28.863 -7.408
874 2HD2 LEU 47 2HD2 LEU 47 3.390 29.047 -8.801
875 3HD2 LEU 47 3HD2 LEU 47 3.020 30.446 -7.780
876 H GLY 48 H GLY 48 1.730 27.273 -12.316
877 1HA GLY 48 1HA GLY 48 3.250 27.467 -14.027
878 2HA GLY 48 2HA GLY 48 2.734 29.133 -14.332
879 1HN NH2 49 1HN NH2 49 3.230 30.628 -12.219
880 2HN NH2 49 2HN NH2 49 4.905 30.477 -11.622
Start of MODEL 4
1 1H ACE 0 H1 ACE 0 0.643 -15.324 -14.047
2 2H ACE 0 H2 ACE 0 0.187 -14.633 -15.622
3 3H ACE 0 H3 ACE 0 -0.584 -14.044 -14.133
4 H ASP 1 H ASP 1 2.701 -14.557 -15.415
5 HA ASP 1 HA ASP 1 4.348 -13.137 -13.892
6 1HB ASP 1 1HB ASP 1 5.088 -14.308 -15.885
7 2HB ASP 1 2HB ASP 1 4.304 -13.122 -16.940
8 H TYR 2 H TYR 2 2.689 -11.499 -16.621
9 HA TYR 2 HA TYR 2 3.564 -8.902 -16.232
10 1HB TYR 2 1HB TYR 2 0.764 -9.641 -17.074
11 2HB TYR 2 2HB TYR 2 1.775 -8.303 -17.606
12 HD1 TYR 2 HD1 TYR 2 4.369 -9.685 -18.253
13 HD2 TYR 2 HD2 TYR 2 0.287 -10.814 -19.054
14 HE1 TYR 2 HE1 TYR 2 5.159 -11.473 -19.757
15 HE2 TYR 2 HE2 TYR 2 1.087 -12.522 -20.677
16 HH TYR 2 HH TYR 2 4.538 -12.952 -21.433
17 H LEU 3 H LEU 3 0.714 -10.473 -14.714
18 HA LEU 3 HA LEU 3 0.201 -8.082 -13.142
19 1HB LEU 3 1HB LEU 3 -1.211 -10.781 -13.258
20 2HB LEU 3 2HB LEU 3 -1.808 -9.392 -12.347
21 HG LEU 3 HG LEU 3 -1.434 -9.336 -15.377
22 1HD1 LEU 3 1HD1 LEU 3 -3.049 -11.086 -14.793
23 2HD1 LEU 3 2HD1 LEU 3 -3.926 -9.954 -13.742
24 3HD1 LEU 3 3HD1 LEU 3 -3.881 -9.688 -15.497
25 1HD2 LEU 3 1HD2 LEU 3 -1.540 -7.097 -14.242
26 2HD2 LEU 3 2HD2 LEU 3 -2.957 -7.410 -15.253
27 3HD2 LEU 3 3HD2 LEU 3 -3.077 -7.576 -13.492
28 H ARG 4 H ARG 4 2.413 -10.468 -12.766
29 HA ARG 4 HA ARG 4 2.307 -10.218 -9.783
30 1HB ARG 4 1HB ARG 4 4.075 -11.986 -11.489
31 2HB ARG 4 2HB ARG 4 3.987 -11.928 -9.729
32 1HG ARG 4 1HG ARG 4 1.295 -12.394 -10.735
33 2HG ARG 4 2HG ARG 4 2.403 -13.475 -11.579
34 1HD ARG 4 1HD ARG 4 1.632 -14.627 -9.651
35 2HD ARG 4 2HD ARG 4 3.318 -14.171 -9.310
36 HE ARG 4 HE ARG 4 1.574 -12.119 -8.369
37 1HH1 ARG 4 1HH2 ARG 4 2.466 -15.442 -7.648
38 2HH1 ARG 4 2HH2 ARG 4 1.866 -15.426 -6.012
39 1HH2 ARG 4 1HH1 ARG 4 0.739 -12.057 -6.248
40 2HH2 ARG 4 2HH1 ARG 4 0.866 -13.433 -5.188
41 H GLU 5 H GLU 5 3.629 -8.832 -12.628
42 HA GLU 5 HA GLU 5 6.090 -7.863 -11.177
43 1HB GLU 5 1HB GLU 5 5.394 -8.461 -14.035
44 2HB GLU 5 2HB GLU 5 6.404 -7.042 -13.734
45 1HG GLU 5 1HG GLU 5 7.693 -9.130 -14.182
46 2HG GLU 5 2HG GLU 5 8.100 -8.328 -12.662
47 H LEU 6 H LEU 6 3.524 -6.727 -13.357
48 HA LEU 6 HA LEU 6 4.034 -3.905 -12.678
49 1HB LEU 6 1HB LEU 6 2.104 -5.186 -14.668
50 2HB LEU 6 2HB LEU 6 2.426 -3.466 -14.441
51 HG LEU 6 HG LEU 6 4.915 -4.043 -15.129
52 1HD1 LEU 6 1HD1 LEU 6 4.495 -6.603 -15.108
53 2HD1 LEU 6 2HD1 LEU 6 3.481 -6.327 -16.522
54 3HD1 LEU 6 3HD1 LEU 6 5.223 -5.914 -16.525
55 1HD2 LEU 6 1HD2 LEU 6 2.611 -4.056 -17.056
56 2HD2 LEU 6 2HD2 LEU 6 3.368 -2.627 -16.310
57 3HD2 LEU 6 3HD2 LEU 6 4.343 -3.680 -17.337
58 H LEU 7 H LEU 7 3.025 -5.691 -10.668
59 HA LEU 7 HA LEU 7 0.666 -4.194 -9.949
60 1HB LEU 7 1HB LEU 7 -0.042 -6.396 -11.083
61 2HB LEU 7 2HB LEU 7 0.623 -7.217 -9.662
62 HG LEU 7 HG LEU 7 -1.558 -5.093 -9.600
63 1HD1 LEU 7 1HD1 LEU 7 -2.296 -7.080 -10.849
64 2HD1 LEU 7 2HD1 LEU 7 -1.814 -8.127 -9.495
65 3HD1 LEU 7 3HD1 LEU 7 -3.140 -6.961 -9.298
66 1HD2 LEU 7 1HD2 LEU 7 -0.413 -6.979 -7.486
67 2HD2 LEU 7 2HD2 LEU 7 -0.602 -5.209 -7.396
68 3HD2 LEU 7 3HD2 LEU 7 -2.018 -6.253 -7.319
69 H LYS 8 H LYS 8 2.842 -6.889 -8.940
70 HA LYS 8 HA LYS 8 2.620 -6.229 -6.239
71 1HB LYS 8 1HB LYS 8 3.850 -8.278 -7.719
72 2HB LYS 8 2HB LYS 8 5.190 -7.511 -6.865
73 1HG LYS 8 1HG LYS 8 3.649 -7.769 -4.752
74 2HG LYS 8 2HG LYS 8 2.650 -8.789 -5.798
75 1HD LYS 8 1HD LYS 8 4.044 -10.364 -4.767
76 2HD LYS 8 2HD LYS 8 4.885 -10.082 -6.302
77 1HE LYS 8 1HE LYS 8 6.376 -8.416 -5.108
78 2HE LYS 8 2HE LYS 8 5.509 -8.765 -3.603
79 1HZ LYS 8 1HZ LYS 8 6.248 -11.026 -3.777
80 2HZ LYS 8 2HZ LYS 8 7.084 -10.685 -5.159
81 3HZ LYS 8 3HZ LYS 8 7.518 -9.977 -3.735
82 H LEU 9 H LEU 9 5.104 -5.424 -8.696
83 HA LEU 9 HA LEU 9 6.762 -3.846 -6.927
84 1HB LEU 9 1HB LEU 9 6.466 -3.765 -9.933
85 2HB LEU 9 2HB LEU 9 7.638 -2.832 -8.996
86 HG LEU 9 HG LEU 9 7.586 -5.861 -8.863
87 1HD1 LEU 9 1HD1 LEU 9 7.993 -5.144 -11.185
88 2HD1 LEU 9 2HD1 LEU 9 9.249 -4.013 -10.620
89 3HD1 LEU 9 3HD1 LEU 9 9.483 -5.767 -10.453
90 1HD2 LEU 9 1HD2 LEU 9 9.645 -3.715 -8.114
91 2HD2 LEU 9 2HD2 LEU 9 8.798 -4.791 -6.990
92 3HD2 LEU 9 3HD2 LEU 9 9.970 -5.457 -8.125
93 H GLU 10 H GLU 10 3.967 -3.083 -9.023
94 HA GLU 10 HA GLU 10 4.006 -0.272 -8.608
95 1HB GLU 10 1HB GLU 10 1.638 -2.182 -8.978
96 2HB GLU 10 2HB GLU 10 1.587 -0.447 -8.920
97 1HG GLU 10 1HG GLU 10 3.123 -0.383 -10.973
98 2HG GLU 10 2HG GLU 10 2.807 -2.131 -11.151
99 H LEU 11 H LEU 11 2.435 -2.881 -6.716
100 HA LEU 11 HA LEU 11 1.164 -1.127 -4.830
101 1HB LEU 11 1HB LEU 11 0.396 -3.419 -5.119
102 2HB LEU 11 2HB LEU 11 1.995 -4.064 -4.742
103 HG LEU 11 HG LEU 11 1.804 -3.295 -2.401
104 1HD1 LEU 11 1HD1 LEU 11 0.294 -1.357 -2.671
105 2HD1 LEU 11 2HD1 LEU 11 -1.009 -2.432 -3.224
106 3HD1 LEU 11 3HD1 LEU 11 -0.409 -2.533 -1.555
107 1HD2 LEU 11 1HD2 LEU 11 -0.550 -4.967 -3.358
108 2HD2 LEU 11 2HD2 LEU 11 1.097 -5.561 -3.056
109 3HD2 LEU 11 3HD2 LEU 11 0.123 -4.937 -1.713
110 H GLN 12 H GLN 12 4.219 -2.996 -4.681
111 HA GLN 12 HA GLN 12 5.080 -2.105 -2.141
112 1HB GLN 12 1HB GLN 12 6.644 -2.852 -4.645
113 2HB GLN 12 2HB GLN 12 7.434 -2.329 -3.168
114 1HG GLN 12 1HG GLN 12 7.467 -4.407 -2.441
115 2HG GLN 12 2HG GLN 12 5.730 -4.283 -2.171
116 1HE2 GLN 12 2HE2 GLN 12 7.712 -4.574 -5.174
117 2HE2 GLN 12 1HE2 GLN 12 6.885 -5.998 -5.759
118 H LEU 13 H LEU 13 5.138 -0.360 -5.253
119 HA LEU 13 HA LEU 13 6.978 1.639 -4.312
120 1HB LEU 13 1HB LEU 13 5.016 1.792 -6.631
121 2HB LEU 13 2HB LEU 13 6.269 2.943 -6.219
122 HG LEU 13 HG LEU 13 6.435 0.427 -7.667
123 1HD1 LEU 13 1HD1 LEU 13 7.067 2.647 -8.536
124 2HD1 LEU 13 2HD1 LEU 13 8.357 2.776 -7.326
125 3HD1 LEU 13 3HD1 LEU 13 8.439 1.527 -8.580
126 1HD2 LEU 13 1HD2 LEU 13 8.715 0.896 -5.706
127 2HD2 LEU 13 2HD2 LEU 13 7.610 -0.488 -5.636
128 3HD2 LEU 13 3HD2 LEU 13 8.630 -0.304 -7.029
129 H ILE 14 H ILE 14 3.397 1.650 -4.811
130 HA ILE 14 HA ILE 14 2.924 4.171 -3.530
131 HB ILE 14 HB ILE 14 1.294 1.537 -3.539
132 1HG1 ILE 14 1HG1 ILE 14 1.470 2.226 -5.748
133 2HG1 ILE 14 2HG1 ILE 14 -0.100 2.833 -5.234
134 1HG2 ILE 14 1HG2 ILE 14 0.448 2.844 -1.684
135 2HG2 ILE 14 2HG2 ILE 14 0.412 4.321 -2.661
136 3HG2 ILE 14 3HG2 ILE 14 -0.693 2.980 -3.021
137 1HD1 ILE 14 1HD1 ILE 14 1.154 5.067 -4.736
138 2HD1 ILE 14 2HD1 ILE 14 2.468 4.376 -5.720
139 3HD1 ILE 14 3HD1 ILE 14 0.863 4.639 -6.419
140 H LYS 15 H LYS 15 3.386 1.043 -2.161
141 HA LYS 15 HA LYS 15 3.001 1.719 0.600
142 1HB LYS 15 1HB LYS 15 3.612 -0.610 -0.860
143 2HB LYS 15 2HB LYS 15 5.074 -0.312 0.026
144 1HG LYS 15 1HG LYS 15 3.769 -1.781 1.337
145 2HG LYS 15 2HG LYS 15 3.549 -0.213 2.134
146 1HD LYS 15 1HD LYS 15 1.377 0.083 0.980
147 2HD LYS 15 2HD LYS 15 1.621 -1.390 0.042
148 1HE LYS 15 1HE LYS 15 1.499 -1.395 3.093
149 2HE LYS 15 2HE LYS 15 0.063 -1.558 2.069
150 1HZ LYS 15 1HZ LYS 15 0.988 -3.495 1.092
151 2HZ LYS 15 2HZ LYS 15 2.369 -3.369 1.983
152 3HZ LYS 15 3HZ LYS 15 0.931 -3.671 2.726
153 H GLN 16 H GLN 16 5.935 1.630 -1.452
154 HA GLN 16 HA GLN 16 7.752 2.397 0.635
155 1HB GLN 16 1HB GLN 16 7.938 1.679 -2.164
156 2HB GLN 16 2HB GLN 16 8.731 3.224 -1.981
157 1HG GLN 16 1HG GLN 16 9.301 0.784 -0.242
158 2HG GLN 16 2HG GLN 16 10.208 1.224 -1.693
159 1HE2 GLN 16 2HE2 GLN 16 10.395 1.487 1.649
160 2HE2 GLN 16 1HE2 GLN 16 11.401 2.910 1.686
161 H TYR 17 H TYR 17 5.879 4.187 -1.731
162 HA TYR 17 HA TYR 17 7.067 6.754 -1.385
163 1HB TYR 17 1HB TYR 17 4.615 5.566 -2.640
164 2HB TYR 17 2HB TYR 17 4.453 7.212 -2.160
165 HD1 TYR 17 HD1 TYR 17 5.205 8.971 -3.549
166 HD2 TYR 17 HD2 TYR 17 6.711 4.983 -4.190
167 HE1 TYR 17 HE1 TYR 17 6.171 9.677 -5.694
168 HE2 TYR 17 HE2 TYR 17 7.480 5.644 -6.428
169 HH TYR 17 HH TYR 17 7.203 9.003 -7.645
170 H ARG 18 H ARG 18 4.563 4.971 0.365
171 HA ARG 18 HA ARG 18 3.704 7.326 1.895
172 1HB ARG 18 1HB ARG 18 3.137 4.368 2.311
173 2HB ARG 18 2HB ARG 18 2.508 5.669 3.338
174 1HG ARG 18 1HG ARG 18 1.410 6.719 1.368
175 2HG ARG 18 2HG ARG 18 2.032 5.429 0.349
176 1HD ARG 18 1HD ARG 18 -0.041 4.622 0.694
177 2HD ARG 18 2HD ARG 18 0.766 3.841 2.069
178 HE ARG 18 HE ARG 18 -0.160 6.347 2.968
179 1HH1 ARG 18 1HH2 ARG 18 -1.526 3.356 1.717
180 2HH1 ARG 18 2HH2 ARG 18 -3.144 3.661 2.285
181 1HH2 ARG 18 1HH1 ARG 18 -2.282 6.812 3.696
182 2HH2 ARG 18 2HH1 ARG 18 -3.576 5.672 3.457
183 H GLU 19 H GLU 19 5.732 4.504 2.369
184 HA GLU 19 HA GLU 19 6.661 5.099 4.971
185 1HB GLU 19 1HB GLU 19 7.045 2.986 3.572
186 2HB GLU 19 2HB GLU 19 8.388 3.862 2.816
187 1HG GLU 19 1HG GLU 19 9.463 4.140 5.015
188 2HG GLU 19 2HG GLU 19 8.077 3.372 5.809
189 H ALA 20 H ALA 20 7.920 6.213 1.753
190 HA ALA 20 HA ALA 20 10.094 7.630 3.100
191 1HB ALA 20 1HB ALA 20 10.547 6.640 1.030
192 2HB ALA 20 2HB ALA 20 9.195 7.498 0.246
193 3HB ALA 20 3HB ALA 20 10.637 8.397 0.790
194 H LEU 21 H LEU 21 6.816 8.467 2.191
195 HA LEU 21 HA LEU 21 6.954 11.170 1.873
196 1HB LEU 21 1HB LEU 21 4.926 9.676 1.892
197 2HB LEU 21 2HB LEU 21 4.861 9.841 3.647
198 HG LEU 21 HG LEU 21 5.068 12.374 2.008
199 1HD1 LEU 21 1HD1 LEU 21 3.464 10.968 0.736
200 2HD1 LEU 21 2HD1 LEU 21 2.493 10.774 2.206
201 3HD1 LEU 21 3HD1 LEU 21 2.727 12.396 1.501
202 1HD2 LEU 21 1HD2 LEU 21 3.344 11.624 4.404
203 2HD2 LEU 21 2HD2 LEU 21 4.856 12.557 4.470
204 3HD2 LEU 21 3HD2 LEU 21 3.446 13.223 3.640
205 H GLU 22 H GLU 22 7.252 9.440 4.949
206 HA GLU 22 HA GLU 22 7.256 11.872 6.547
207 1HB GLU 22 1HB GLU 22 7.731 8.922 7.127
208 2HB GLU 22 2HB GLU 22 8.025 10.167 8.349
209 1HG GLU 22 1HG GLU 22 5.355 9.886 6.899
210 2HG GLU 22 2HG GLU 22 5.723 9.123 8.452
211 H TYR 23 H TYR 23 9.720 9.637 5.192
212 HA TYR 23 HA TYR 23 11.914 10.839 6.588
213 1HB TYR 23 1HB TYR 23 11.608 9.149 4.072
214 2HB TYR 23 2HB TYR 23 13.132 9.806 4.584
215 HD1 TYR 23 HD1 TYR 23 11.383 6.828 4.656
216 HD2 TYR 23 HD2 TYR 23 13.637 9.431 7.257
217 HE1 TYR 23 HE1 TYR 23 11.840 4.934 6.161
218 HE2 TYR 23 HE2 TYR 23 14.062 7.535 8.774
219 HH TYR 23 HH TYR 23 13.748 5.292 9.159
220 H VAL 24 H VAL 24 10.166 11.603 3.612
221 HA VAL 24 HA VAL 24 12.168 13.672 2.884
222 HB VAL 24 HB VAL 24 9.690 12.659 1.471
223 1HG1 VAL 24 1HG1 VAL 24 10.162 14.946 0.725
224 2HG1 VAL 24 2HG1 VAL 24 11.885 14.565 0.536
225 3HG1 VAL 24 3HG1 VAL 24 10.680 13.816 -0.530
226 1HG2 VAL 24 1HG2 VAL 24 12.662 12.168 0.949
227 2HG2 VAL 24 2HG2 VAL 24 11.540 10.970 1.616
228 3HG2 VAL 24 3HG2 VAL 24 11.318 11.554 -0.035
229 H LYS 25 H LYS 25 8.922 13.473 4.245
230 HA LYS 25 HA LYS 25 7.409 14.955 4.934
231 1HB LYS 25 1HB LYS 25 9.798 16.759 5.488
232 2HB LYS 25 2HB LYS 25 8.144 16.973 6.075
233 1HG LYS 25 1HG LYS 25 8.440 14.493 6.967
234 2HG LYS 25 2HG LYS 25 10.167 14.863 6.834
235 1HD LYS 25 1HD LYS 25 9.767 16.901 8.295
236 2HD LYS 25 2HD LYS 25 8.050 16.466 8.367
237 1HE LYS 25 1HE LYS 25 8.977 15.638 10.394
238 2HE LYS 25 2HE LYS 25 8.734 14.220 9.362
239 1HZ LYS 25 1HZ LYS 25 11.065 14.351 8.784
240 2HZ LYS 25 2HZ LYS 25 11.269 15.646 9.785
241 3HZ LYS 25 3HZ LYS 25 10.857 14.178 10.409
242 H LEU 26 H LEU 26 6.914 14.845 2.530
243 HA LEU 26 HA LEU 26 6.697 17.640 1.498
244 1HB LEU 26 1HB LEU 26 8.583 16.622 0.380
245 2HB LEU 26 2HB LEU 26 7.635 15.175 0.031
246 HG LEU 26 HG LEU 26 6.088 16.735 -1.319
247 1HD1 LEU 26 1HD1 LEU 26 7.044 18.934 -0.554
248 2HD1 LEU 26 2HD1 LEU 26 8.590 18.491 -1.302
249 3HD1 LEU 26 3HD1 LEU 26 7.158 18.737 -2.308
250 1HD2 LEU 26 1HD2 LEU 26 8.913 16.201 -2.310
251 2HD2 LEU 26 2HD2 LEU 26 7.555 15.054 -2.357
252 3HD2 LEU 26 3HD2 LEU 26 7.497 16.519 -3.324
253 HA PRO 27 HA PRO 27 2.493 15.894 1.342
254 1HB PRO 27 1HB PRO 27 1.092 18.085 0.498
255 2HB PRO 27 2HB PRO 27 1.692 17.883 2.168
256 1HG PRO 27 1HG PRO 27 2.993 19.438 -0.081
257 2HG PRO 27 2HG PRO 27 2.708 19.973 1.598
258 1HD PRO 27 1HD PRO 27 5.107 18.995 0.794
259 2HD PRO 27 2HD PRO 27 4.479 18.611 2.423
260 H VAL 28 H VAL 28 4.009 17.731 -1.345
261 HA VAL 28 HA VAL 28 2.505 16.860 -3.526
262 HB VAL 28 HB VAL 28 5.430 17.341 -3.240
263 1HG1 VAL 28 1HG1 VAL 28 5.335 15.696 -5.012
264 2HG1 VAL 28 2HG1 VAL 28 4.011 16.591 -5.806
265 3HG1 VAL 28 3HG1 VAL 28 5.641 17.278 -5.713
266 1HG2 VAL 28 1HG2 VAL 28 3.374 18.867 -4.856
267 2HG2 VAL 28 2HG2 VAL 28 3.993 19.362 -3.255
268 3HG2 VAL 28 3HG2 VAL 28 5.081 19.274 -4.648
269 H LEU 29 H LEU 29 4.753 14.934 -1.472
270 HA LEU 29 HA LEU 29 5.093 12.843 -3.282
271 1HB LEU 29 1HB LEU 29 6.214 13.637 -0.947
272 2HB LEU 29 2HB LEU 29 5.192 12.367 -0.285
273 HG LEU 29 HG LEU 29 6.891 11.892 -2.718
274 1HD1 LEU 29 1HD1 LEU 29 8.470 12.995 -1.284
275 2HD1 LEU 29 2HD1 LEU 29 7.969 12.023 0.109
276 3HD1 LEU 29 3HD1 LEU 29 8.824 11.260 -1.246
277 1HD2 LEU 29 1HD2 LEU 29 5.277 10.152 -1.658
278 2HD2 LEU 29 2HD2 LEU 29 6.952 9.603 -1.866
279 3HD2 LEU 29 3HD2 LEU 29 6.379 10.126 -0.274
280 H ALA 30 H ALA 30 2.781 13.070 -0.495
281 HA ALA 30 HA ALA 30 1.409 10.666 -1.074
282 1HB ALA 30 1HB ALA 30 0.725 11.686 0.947
283 2HB ALA 30 2HB ALA 30 0.461 13.276 0.175
284 3HB ALA 30 3HB ALA 30 -0.643 11.919 -0.120
285 H LYS 31 H LYS 31 1.138 14.011 -2.502
286 HA LYS 31 HA LYS 31 -1.311 13.333 -3.922
287 1HB LYS 31 1HB LYS 31 0.652 15.599 -4.177
288 2HB LYS 31 2HB LYS 31 -0.606 15.373 -5.380
289 1HG LYS 31 1HG LYS 31 -1.627 15.279 -2.574
290 2HG LYS 31 2HG LYS 31 -0.817 16.776 -3.003
291 1HD LYS 31 1HD LYS 31 -2.855 17.402 -3.680
292 2HD LYS 31 2HD LYS 31 -2.377 16.667 -5.197
293 1HE LYS 31 1HE LYS 31 -4.022 15.279 -3.006
294 2HE LYS 31 2HE LYS 31 -4.706 16.143 -4.388
295 1HZ LYS 31 1HZ LYS 31 -3.635 14.602 -5.852
296 2HZ LYS 31 2HZ LYS 31 -3.022 13.756 -4.581
297 3HZ LYS 31 3HZ LYS 31 -4.643 13.835 -4.807
298 H ILE 32 H ILE 32 2.088 13.021 -4.674
299 HA ILE 32 HA ILE 32 1.741 12.472 -7.520
300 HB ILE 32 HB ILE 32 4.007 12.025 -5.519
301 1HG1 ILE 32 1HG1 ILE 32 3.710 13.736 -8.028
302 2HG1 ILE 32 2HG1 ILE 32 3.634 14.314 -6.383
303 1HG2 ILE 32 1HG2 ILE 32 4.083 10.082 -6.974
304 2HG2 ILE 32 2HG2 ILE 32 3.819 11.093 -8.401
305 3HG2 ILE 32 3HG2 ILE 32 5.347 11.175 -7.491
306 1HD1 ILE 32 1HD1 ILE 32 6.018 13.510 -6.048
307 2HD1 ILE 32 2HD1 ILE 32 6.088 13.194 -7.799
308 3HD1 ILE 32 3HD1 ILE 32 5.817 14.831 -7.218
309 H LEU 33 H LEU 33 2.142 10.602 -4.452
310 HA LEU 33 HA LEU 33 2.088 8.174 -5.880
311 1HB LEU 33 1HB LEU 33 2.412 7.152 -3.823
312 2HB LEU 33 2HB LEU 33 2.971 8.804 -3.537
313 HG LEU 33 HG LEU 33 0.792 9.299 -2.506
314 1HD1 LEU 33 1HD1 LEU 33 -0.873 7.863 -2.866
315 2HD1 LEU 33 2HD1 LEU 33 0.231 6.529 -3.251
316 3HD1 LEU 33 3HD1 LEU 33 -0.140 6.934 -1.555
317 1HD2 LEU 33 1HD2 LEU 33 2.437 7.075 -1.292
318 2HD2 LEU 33 2HD2 LEU 33 2.922 8.789 -1.324
319 3HD2 LEU 33 3HD2 LEU 33 1.490 8.299 -0.403
320 H GLU 34 H GLU 34 -0.506 10.152 -4.519
321 HA GLU 34 HA GLU 34 -2.614 8.282 -4.804
322 1HB GLU 34 1HB GLU 34 -2.530 10.573 -3.647
323 2HB GLU 34 2HB GLU 34 -2.811 11.303 -5.208
324 1HG GLU 34 1HG GLU 34 -4.672 9.153 -4.087
325 2HG GLU 34 2HG GLU 34 -4.839 10.848 -3.623
326 H ASP 35 H ASP 35 -1.279 10.730 -6.995
327 HA ASP 35 HA ASP 35 -3.014 10.237 -9.197
328 1HB ASP 35 1HB ASP 35 -1.243 12.099 -8.920
329 2HB ASP 35 2HB ASP 35 -0.068 10.932 -9.545
330 H GLU 36 H GLU 36 0.203 8.857 -8.483
331 HA GLU 36 HA GLU 36 0.352 6.952 -10.550
332 1HB GLU 36 1HB GLU 36 1.371 6.700 -7.684
333 2HB GLU 36 2HB GLU 36 1.923 5.734 -9.044
334 1HG GLU 36 1HG GLU 36 2.238 8.762 -9.109
335 2HG GLU 36 2HG GLU 36 3.369 7.736 -8.218
336 H GLU 37 H GLU 37 -1.240 6.643 -7.273
337 HA GLU 37 HA GLU 37 -1.570 3.967 -7.164
338 1HB GLU 37 1HB GLU 37 -1.759 5.415 -5.250
339 2HB GLU 37 2HB GLU 37 -2.937 6.444 -6.051
340 1HG GLU 37 1HG GLU 37 -4.580 4.924 -6.071
341 2HG GLU 37 2HG GLU 37 -3.479 3.610 -5.547
342 H LYS 38 H LYS 38 -3.534 6.499 -8.838
343 HA LYS 38 HA LYS 38 -5.717 4.644 -9.309
344 1HB LYS 38 1HB LYS 38 -5.630 7.281 -9.255
345 2HB LYS 38 2HB LYS 38 -5.207 7.135 -10.969
346 1HG LYS 38 1HG LYS 38 -7.311 5.856 -11.359
347 2HG LYS 38 2HG LYS 38 -7.641 5.867 -9.614
348 1HD LYS 38 1HD LYS 38 -7.658 8.384 -9.667
349 2HD LYS 38 2HD LYS 38 -7.529 8.312 -11.437
350 1HE LYS 38 1HE LYS 38 -9.668 7.045 -11.539
351 2HE LYS 38 2HE LYS 38 -9.751 7.017 -9.768
352 1HZ LYS 38 1HZ LYS 38 -9.886 9.393 -9.784
353 2HZ LYS 38 2HZ LYS 38 -9.836 9.431 -11.431
354 3HZ LYS 38 3HZ LYS 38 -11.115 8.731 -10.658
355 H HIS 39 H HIS 39 -2.872 5.617 -11.231
356 HA HIS 39 HA HIS 39 -3.698 4.032 -13.548
357 1HB HIS 39 1HB HIS 39 -1.054 5.179 -12.544
358 2HB HIS 39 2HB HIS 39 -1.181 4.161 -13.962
359 HD1 HIS 39 HD1 HIS 39 -0.259 7.223 -14.159
360 HD2 HIS 39 HD2 HIS 39 -4.158 5.714 -14.824
361 HE1 HIS 39 HE1 HIS 39 -1.418 8.795 -15.798
362 HE2 HIS 39 HE2 HIS 39 -3.787 7.909 -16.153
363 H ILE 40 H ILE 40 -1.722 3.449 -10.703
364 HA ILE 40 HA ILE 40 -1.012 0.752 -11.319
365 HB ILE 40 HB ILE 40 -1.199 2.459 -8.838
366 1HG1 ILE 40 1HG1 ILE 40 1.262 1.164 -10.093
367 2HG1 ILE 40 2HG1 ILE 40 0.631 2.667 -10.652
368 1HG2 ILE 40 1HG2 ILE 40 -1.791 0.400 -7.889
369 2HG2 ILE 40 2HG2 ILE 40 -0.616 -0.504 -8.843
370 3HG2 ILE 40 3HG2 ILE 40 -0.075 0.597 -7.551
371 1HD1 ILE 40 1HD1 ILE 40 0.857 3.537 -8.294
372 2HD1 ILE 40 2HD1 ILE 40 1.726 2.023 -7.913
373 3HD1 ILE 40 3HD1 ILE 40 2.376 3.140 -9.121
374 H GLU 41 H GLU 41 -3.855 2.272 -9.819
375 HA GLU 41 HA GLU 41 -5.021 -0.110 -8.859
376 1HB GLU 41 1HB GLU 41 -5.790 2.262 -8.304
377 2HB GLU 41 2HB GLU 41 -6.545 2.325 -9.905
378 1HG GLU 41 1HG GLU 41 -7.338 -0.115 -8.568
379 2HG GLU 41 2HG GLU 41 -7.527 1.245 -7.455
380 H TRP 42 H TRP 42 -4.996 1.446 -12.073
381 HA TRP 42 HA TRP 42 -6.996 -0.023 -13.303
382 1HB TRP 42 1HB TRP 42 -5.403 1.895 -14.111
383 2HB TRP 42 2HB TRP 42 -4.363 0.582 -14.660
384 HD1 TRP 42 HD1 TRP 42 -7.918 1.926 -15.139
385 HE1 TRP 42 HE1 TRP 42 -8.908 0.885 -17.271
386 HE3 TRP 42 HE3 TRP 42 -4.122 -1.107 -16.409
387 HZ2 TRP 42 HZ2 TRP 42 -7.926 -0.574 -19.590
388 HZ3 TRP 42 HZ3 TRP 42 -4.159 -2.414 -18.587
389 HH2 TRP 42 HH2 TRP 42 -6.052 -2.100 -20.174
390 H LEU 43 H LEU 43 -3.604 -0.966 -12.659
391 HA LEU 43 HA LEU 43 -3.900 -3.558 -14.001
392 1HB LEU 43 1HB LEU 43 -1.765 -2.401 -12.229
393 2HB LEU 43 2HB LEU 43 -1.677 -4.028 -12.888
394 HG LEU 43 HG LEU 43 -2.317 -2.099 -15.016
395 1HD1 LEU 43 1HD1 LEU 43 -0.934 -0.619 -13.453
396 2HD1 LEU 43 2HD1 LEU 43 0.409 -1.762 -13.766
397 3HD1 LEU 43 3HD1 LEU 43 -0.298 -0.836 -15.087
398 1HD2 LEU 43 1HD2 LEU 43 0.033 -3.991 -14.538
399 2HD2 LEU 43 2HD2 LEU 43 -1.445 -4.388 -15.419
400 3HD2 LEU 43 3HD2 LEU 43 -0.309 -3.168 -16.059
401 H GLU 44 H GLU 44 -4.751 -2.341 -10.855
402 HA GLU 44 HA GLU 44 -4.942 -5.126 -9.777
403 1HB GLU 44 1HB GLU 44 -5.512 -2.450 -8.434
404 2HB GLU 44 2HB GLU 44 -5.821 -4.042 -7.735
405 1HG GLU 44 1HG GLU 44 -3.315 -4.530 -8.309
406 2HG GLU 44 2HG GLU 44 -3.142 -2.771 -8.336
407 H THR 45 H THR 45 -6.750 -3.093 -11.619
408 HA THR 45 HA THR 45 -9.372 -4.091 -10.603
409 HB THR 45 HB THR 45 -8.520 -1.576 -11.178
410 HG1 THR 45 HG1 THR 45 -10.354 -1.096 -10.466
411 1HG2 THR 45 1HG2 THR 45 -8.531 -1.867 -13.626
412 2HG2 THR 45 2HG2 THR 45 -10.259 -2.266 -13.544
413 3HG2 THR 45 3HG2 THR 45 -9.675 -0.660 -13.043
414 H ILE 46 H ILE 46 -7.405 -3.836 -13.515
415 HA ILE 46 HA ILE 46 -8.991 -4.881 -15.456
416 HB ILE 46 HB ILE 46 -6.647 -4.038 -15.682
417 1HG1 ILE 46 1HG1 ILE 46 -5.848 -5.787 -17.394
418 2HG1 ILE 46 2HG1 ILE 46 -7.342 -6.666 -17.046
419 1HG2 ILE 46 1HG2 ILE 46 -5.736 -5.366 -13.783
420 2HG2 ILE 46 2HG2 ILE 46 -5.701 -6.791 -14.837
421 3HG2 ILE 46 3HG2 ILE 46 -4.737 -5.357 -15.242
422 1HD1 ILE 46 1HD1 ILE 46 -8.626 -4.564 -17.634
423 2HD1 ILE 46 2HD1 ILE 46 -7.077 -3.785 -18.007
424 3HD1 ILE 46 3HD1 ILE 46 -7.630 -5.170 -18.972
425 H LEU 47 H LEU 47 -7.358 -6.766 -12.955
426 HA LEU 47 HA LEU 47 -8.946 -9.180 -13.761
427 1HB LEU 47 1HB LEU 47 -6.433 -9.437 -13.976
428 2HB LEU 47 2HB LEU 47 -6.309 -9.168 -12.242
429 HG LEU 47 HG LEU 47 -8.280 -11.134 -12.356
430 1HD1 LEU 47 1HD1 LEU 47 -7.955 -11.351 -14.820
431 2HD1 LEU 47 2HD1 LEU 47 -6.251 -11.774 -14.541
432 3HD1 LEU 47 3HD1 LEU 47 -7.541 -12.839 -13.944
433 1HD2 LEU 47 1HD2 LEU 47 -5.272 -11.556 -12.184
434 2HD2 LEU 47 2HD2 LEU 47 -6.362 -11.139 -10.840
435 3HD2 LEU 47 3HD2 LEU 47 -6.524 -12.704 -11.658
436 H GLY 48 H GLY 48 -7.241 -7.768 -10.920
437 1HA GLY 48 1HA GLY 48 -7.844 -7.468 -8.763
438 2HA GLY 48 2HA GLY 48 -9.533 -7.361 -9.294
439 1HN NH2 49 1HN NH2 49 -10.640 -9.545 -9.692
440 2HN NH2 49 2HN NH2 49 -10.175 -10.899 -8.628
441 1H ACE 0 H1 ACE 0 20.148 10.372 -2.270
442 2H ACE 0 H2 ACE 0 19.950 10.330 -0.504
443 3H ACE 0 H3 ACE 0 21.240 9.381 -1.280
444 H ASP 1 H ASP 1 19.764 7.954 0.347
445 HA ASP 1 HA ASP 1 18.944 5.770 -1.057
446 1HB ASP 1 1HB ASP 1 19.355 5.678 1.335
447 2HB ASP 1 2HB ASP 1 17.930 6.686 1.663
448 H TYR 2 H TYR 2 16.652 8.217 0.262
449 HA TYR 2 HA TYR 2 14.260 7.203 -0.669
450 1HB TYR 2 1HB TYR 2 15.027 10.118 -0.609
451 2HB TYR 2 2HB TYR 2 13.445 9.387 -0.365
452 HD1 TYR 2 HD1 TYR 2 15.353 11.284 1.418
453 HD2 TYR 2 HD2 TYR 2 14.059 7.174 1.596
454 HE1 TYR 2 HE1 TYR 2 16.090 11.152 3.781
455 HE2 TYR 2 HE2 TYR 2 14.862 7.026 3.930
456 HH TYR 2 HH TYR 2 16.204 9.842 5.663
457 H LEU 3 H LEU 3 16.543 9.260 -2.509
458 HA LEU 3 HA LEU 3 14.801 9.295 -4.802
459 1HB LEU 3 1HB LEU 3 17.813 9.786 -4.688
460 2HB LEU 3 2HB LEU 3 16.721 10.285 -5.984
461 HG LEU 3 HG LEU 3 16.662 11.346 -3.111
462 1HD1 LEU 3 1HD1 LEU 3 18.672 12.027 -4.365
463 2HD1 LEU 3 2HD1 LEU 3 17.645 12.665 -5.669
464 3HD1 LEU 3 3HD1 LEU 3 17.585 13.390 -4.048
465 1HD2 LEU 3 1HD2 LEU 3 15.112 12.205 -5.597
466 2HD2 LEU 3 2HD2 LEU 3 14.426 11.485 -4.120
467 3HD2 LEU 3 3HD2 LEU 3 15.158 13.093 -4.062
468 H ARG 4 H ARG 4 17.671 7.423 -3.868
469 HA ARG 4 HA ARG 4 17.726 5.760 -6.211
470 1HB ARG 4 1HB ARG 4 18.692 5.219 -3.397
471 2HB ARG 4 2HB ARG 4 19.128 4.273 -4.809
472 1HG ARG 4 1HG ARG 4 19.738 7.243 -4.928
473 2HG ARG 4 2HG ARG 4 20.626 6.263 -3.770
474 1HD ARG 4 1HD ARG 4 22.011 6.182 -5.595
475 2HD ARG 4 2HD ARG 4 21.140 4.646 -5.721
476 HE ARG 4 HE ARG 4 19.862 6.789 -7.213
477 1HH1 ARG 4 1HH2 ARG 4 22.512 4.463 -7.307
478 2HH1 ARG 4 2HH2 ARG 4 22.849 4.675 -9.002
479 1HH2 ARG 4 1HH1 ARG 4 20.333 7.146 -9.432
480 2HH2 ARG 4 2HH1 ARG 4 21.577 6.235 -10.237
481 H GLU 5 H GLU 5 15.321 5.926 -3.816
482 HA GLU 5 HA GLU 5 14.501 3.060 -4.209
483 1HB GLU 5 1HB GLU 5 13.888 5.176 -2.130
484 2HB GLU 5 2HB GLU 5 12.748 3.857 -2.440
485 1HG GLU 5 1HG GLU 5 14.433 2.200 -1.884
486 2HG GLU 5 2HG GLU 5 15.661 3.460 -1.653
487 H LEU 6 H LEU 6 12.907 6.233 -3.818
488 HA LEU 6 HA LEU 6 10.564 5.327 -5.175
489 1HB LEU 6 1HB LEU 6 11.477 8.091 -4.323
490 2HB LEU 6 2HB LEU 6 9.915 7.740 -5.066
491 HG LEU 6 HG LEU 6 9.403 6.212 -2.997
492 1HD1 LEU 6 1HD1 LEU 6 11.864 6.134 -2.232
493 2HD1 LEU 6 2HD1 LEU 6 11.608 7.802 -1.677
494 3HD1 LEU 6 3HD1 LEU 6 10.617 6.435 -1.096
495 1HD2 LEU 6 1HD2 LEU 6 9.878 9.212 -2.728
496 2HD2 LEU 6 2HD2 LEU 6 8.451 8.437 -3.437
497 3HD2 LEU 6 3HD2 LEU 6 8.805 8.228 -1.724
498 H LEU 7 H LEU 7 13.556 6.440 -6.516
499 HA LEU 7 HA LEU 7 12.261 7.345 -8.961
500 1HB LEU 7 1HB LEU 7 14.115 8.679 -7.807
501 2HB LEU 7 2HB LEU 7 15.229 7.434 -8.402
502 HG LEU 7 HG LEU 7 13.421 9.174 -10.125
503 1HD1 LEU 7 1HD1 LEU 7 15.245 10.399 -8.968
504 2HD1 LEU 7 2HD1 LEU 7 16.429 9.245 -9.621
505 3HD1 LEU 7 3HD1 LEU 7 15.507 10.294 -10.713
506 1HD2 LEU 7 1HD2 LEU 7 15.543 7.113 -10.879
507 2HD2 LEU 7 2HD2 LEU 7 13.834 7.156 -11.381
508 3HD2 LEU 7 3HD2 LEU 7 14.947 8.372 -11.982
509 H LYS 8 H LYS 8 14.807 5.158 -7.688
510 HA LYS 8 HA LYS 8 15.350 4.004 -10.160
511 1HB LYS 8 1HB LYS 8 16.781 4.050 -8.055
512 2HB LYS 8 2HB LYS 8 15.799 2.696 -7.447
513 1HG LYS 8 1HG LYS 8 16.544 1.279 -9.295
514 2HG LYS 8 2HG LYS 8 17.381 2.647 -10.042
515 1HD LYS 8 1HD LYS 8 19.237 2.108 -8.890
516 2HD LYS 8 2HD LYS 8 18.407 2.586 -7.403
517 1HE LYS 8 1HE LYS 8 17.543 0.275 -7.126
518 2HE LYS 8 2HE LYS 8 18.387 -0.219 -8.612
519 1HZ LYS 8 1HZ LYS 8 20.447 0.400 -7.557
520 2HZ LYS 8 2HZ LYS 8 19.650 0.820 -6.175
521 3HZ LYS 8 3HZ LYS 8 19.654 -0.747 -6.680
522 H LEU 9 H LEU 9 13.240 3.005 -7.491
523 HA LEU 9 HA LEU 9 12.470 0.464 -8.695
524 1HB LEU 9 1HB LEU 9 11.239 2.192 -6.520
525 2HB LEU 9 2HB LEU 9 10.495 0.726 -7.125
526 HG LEU 9 HG LEU 9 13.359 0.533 -6.238
527 1HD1 LEU 9 1HD1 LEU 9 12.287 1.711 -4.371
528 2HD1 LEU 9 2HD1 LEU 9 10.958 0.533 -4.355
529 3HD1 LEU 9 3HD1 LEU 9 12.609 0.027 -3.930
530 1HD2 LEU 9 1HD2 LEU 9 10.958 -1.356 -6.021
531 2HD2 LEU 9 2HD2 LEU 9 12.150 -1.400 -7.332
532 3HD2 LEU 9 3HD2 LEU 9 12.649 -1.758 -5.669
533 H GLU 10 H GLU 10 11.245 3.824 -8.803
534 HA GLU 10 HA GLU 10 8.836 3.270 -10.260
535 1HB GLU 10 1HB GLU 10 10.612 5.652 -9.728
536 2HB GLU 10 2HB GLU 10 9.627 5.684 -11.151
537 1HG GLU 10 1HG GLU 10 8.651 5.412 -8.319
538 2HG GLU 10 2HG GLU 10 8.531 6.837 -9.350
539 H LEU 11 H LEU 11 12.150 4.079 -11.307
540 HA LEU 11 HA LEU 11 11.644 4.168 -14.061
541 1HB LEU 11 1HB LEU 11 13.693 4.835 -12.600
542 2HB LEU 11 2HB LEU 11 14.282 3.200 -12.870
543 HG LEU 11 HG LEU 11 13.418 4.917 -15.229
544 1HD1 LEU 11 1HD1 LEU 11 14.760 6.439 -13.878
545 2HD1 LEU 11 2HD1 LEU 11 16.048 5.224 -13.728
546 3HD1 LEU 11 3HD1 LEU 11 15.668 5.940 -15.311
547 1HD2 LEU 11 1HD2 LEU 11 15.713 2.935 -14.850
548 2HD2 LEU 11 2HD2 LEU 11 14.156 2.562 -15.624
549 3HD2 LEU 11 3HD2 LEU 11 15.253 3.740 -16.365
550 H GLN 12 H GLN 12 12.480 1.456 -11.898
551 HA GLN 12 HA GLN 12 12.622 -0.576 -13.810
552 1HB GLN 12 1HB GLN 12 12.916 -0.527 -11.109
553 2HB GLN 12 2HB GLN 12 11.263 -1.169 -11.196
554 1HG GLN 12 1HG GLN 12 12.261 -2.788 -12.988
555 2HG GLN 12 2HG GLN 12 13.831 -2.334 -12.318
556 1HE2 GLN 12 2HE2 GLN 12 13.103 -2.112 -9.542
557 2HE2 GLN 12 1HE2 GLN 12 12.664 -3.725 -8.994
558 H LEU 13 H LEU 13 9.710 0.986 -12.430
559 HA LEU 13 HA LEU 13 7.834 -0.987 -13.387
560 1HB LEU 13 1HB LEU 13 7.298 1.957 -12.796
561 2HB LEU 13 2HB LEU 13 6.142 0.674 -13.081
562 HG LEU 13 HG LEU 13 7.930 1.044 -10.682
563 1HD1 LEU 13 1HD1 LEU 13 5.892 2.410 -10.757
564 2HD1 LEU 13 2HD1 LEU 13 4.911 0.988 -11.157
565 3HD1 LEU 13 3HD1 LEU 13 5.646 1.126 -9.566
566 1HD2 LEU 13 1HD2 LEU 13 6.140 -1.349 -11.316
567 2HD2 LEU 13 2HD2 LEU 13 7.902 -1.367 -11.041
568 3HD2 LEU 13 3HD2 LEU 13 6.802 -0.947 -9.720
569 H ILE 14 H ILE 14 8.916 2.264 -14.530
570 HA ILE 14 HA ILE 14 7.309 2.205 -16.911
571 HB ILE 14 HB ILE 14 9.652 3.809 -15.925
572 1HG1 ILE 14 1HG1 ILE 14 8.067 5.621 -16.109
573 2HG1 ILE 14 2HG1 ILE 14 6.950 4.644 -17.059
574 1HG2 ILE 14 1HG2 ILE 14 10.261 3.600 -18.276
575 2HG2 ILE 14 2HG2 ILE 14 8.596 3.976 -18.776
576 3HG2 ILE 14 3HG2 ILE 14 9.590 5.203 -17.974
577 1HD1 ILE 14 1HD1 ILE 14 6.313 3.324 -15.150
578 2HD1 ILE 14 2HD1 ILE 14 7.645 3.977 -14.174
579 3HD1 ILE 14 3HD1 ILE 14 6.289 5.004 -14.650
580 H LYS 15 H LYS 15 10.603 1.030 -16.291
581 HA LYS 15 HA LYS 15 11.088 0.078 -18.953
582 1HB LYS 15 1HB LYS 15 12.861 0.370 -17.424
583 2HB LYS 15 2HB LYS 15 12.121 -0.644 -16.194
584 1HG LYS 15 1HG LYS 15 12.740 -1.949 -18.838
585 2HG LYS 15 2HG LYS 15 14.105 -1.469 -17.812
586 1HD LYS 15 1HD LYS 15 13.141 -2.669 -15.882
587 2HD LYS 15 2HD LYS 15 11.778 -3.206 -16.866
588 1HE LYS 15 1HE LYS 15 13.254 -4.475 -18.344
589 2HE LYS 15 2HE LYS 15 14.695 -3.861 -17.502
590 1HZ LYS 15 1HZ LYS 15 13.993 -4.986 -15.550
591 2HZ LYS 15 2HZ LYS 15 12.589 -5.475 -16.246
592 3HZ LYS 15 3HZ LYS 15 14.030 -6.068 -16.794
593 H GLN 16 H GLN 16 9.546 -1.450 -16.047
594 HA GLN 16 HA GLN 16 9.152 -3.964 -17.366
595 1HB GLN 16 1HB GLN 16 8.412 -2.812 -14.763
596 2HB GLN 16 2HB GLN 16 7.039 -3.601 -15.493
597 1HG GLN 16 1HG GLN 16 7.974 -5.331 -14.347
598 2HG GLN 16 2HG GLN 16 8.617 -5.607 -15.965
599 1HE2 GLN 16 2HE2 GLN 16 9.318 -4.317 -12.726
600 2HE2 GLN 16 1HE2 GLN 16 11.034 -4.658 -12.768
601 H TYR 17 H TYR 17 7.265 -1.025 -17.267
602 HA TYR 17 HA TYR 17 4.778 -1.958 -18.374
603 1HB TYR 17 1HB TYR 17 6.143 0.673 -17.911
604 2HB TYR 17 2HB TYR 17 4.818 0.575 -19.019
605 HD1 TYR 17 HD1 TYR 17 2.630 -0.535 -18.304
606 HD2 TYR 17 HD2 TYR 17 5.489 1.293 -15.676
607 HE1 TYR 17 HE1 TYR 17 0.799 0.210 -16.828
608 HE2 TYR 17 HE2 TYR 17 3.672 1.930 -14.133
609 HH TYR 17 HH TYR 17 1.245 1.280 -13.621
610 H ARG 18 H ARG 18 7.883 -1.041 -19.732
611 HA ARG 18 HA ARG 18 6.812 -0.843 -22.468
612 1HB ARG 18 1HB ARG 18 9.642 -0.839 -21.354
613 2HB ARG 18 2HB ARG 18 9.282 -0.948 -23.085
614 1HG ARG 18 1HG ARG 18 7.997 1.126 -23.013
615 2HG ARG 18 2HG ARG 18 8.286 1.296 -21.276
616 1HD ARG 18 1HD ARG 18 10.518 1.843 -21.529
617 2HD ARG 18 2HD ARG 18 10.707 1.013 -23.069
618 HE ARG 18 HE ARG 18 9.842 3.752 -22.619
619 1HH1 ARG 18 1HH2 ARG 18 9.601 1.025 -24.830
620 2HH1 ARG 18 2HH2 ARG 18 9.349 1.988 -26.259
621 1HH2 ARG 18 1HH1 ARG 18 9.452 5.055 -24.453
622 2HH2 ARG 18 2HH1 ARG 18 9.235 4.347 -26.028
623 H GLU 19 H GLU 19 8.519 -3.154 -20.462
624 HA GLU 19 HA GLU 19 8.639 -5.241 -22.408
625 1HB GLU 19 1HB GLU 19 9.722 -5.092 -19.997
626 2HB GLU 19 2HB GLU 19 8.214 -5.877 -19.496
627 1HG GLU 19 1HG GLU 19 8.671 -7.598 -21.352
628 2HG GLU 19 2HG GLU 19 10.275 -6.873 -21.511
629 H ALA 20 H ALA 20 6.107 -4.427 -19.950
630 HA ALA 20 HA ALA 20 4.467 -6.670 -20.815
631 1HB ALA 20 1HB ALA 20 3.051 -6.113 -19.030
632 2HB ALA 20 2HB ALA 20 4.645 -5.595 -18.516
633 3HB ALA 20 3HB ALA 20 3.488 -4.394 -19.131
634 H LEU 21 H LEU 21 4.849 -3.419 -22.022
635 HA LEU 21 HA LEU 21 2.409 -2.908 -23.155
636 1HB LEU 21 1HB LEU 21 4.467 -1.457 -23.251
637 2HB LEU 21 2HB LEU 21 5.078 -2.498 -24.543
638 HG LEU 21 HG LEU 21 3.153 -1.852 -25.976
639 1HD1 LEU 21 1HD1 LEU 21 1.421 -1.314 -24.307
640 2HD1 LEU 21 2HD1 LEU 21 2.458 -0.041 -23.625
641 3HD1 LEU 21 3HD1 LEU 21 1.767 0.129 -25.253
642 1HD2 LEU 21 1HD2 LEU 21 4.739 0.455 -24.768
643 2HD2 LEU 21 2HD2 LEU 21 5.265 -0.607 -26.086
644 3HD2 LEU 21 3HD2 LEU 21 3.896 0.492 -26.332
645 H GLU 22 H GLU 22 4.762 -5.313 -24.316
646 HA GLU 22 HA GLU 22 3.287 -5.742 -26.817
647 1HB GLU 22 1HB GLU 22 4.896 -7.700 -27.043
648 2HB GLU 22 2HB GLU 22 5.540 -6.062 -27.207
649 1HG GLU 22 1HG GLU 22 6.493 -6.091 -25.018
650 2HG GLU 22 2HG GLU 22 5.681 -7.624 -24.609
651 H TYR 23 H TYR 23 3.806 -7.396 -23.721
652 HA TYR 23 HA TYR 23 2.349 -9.722 -24.392
653 1HB TYR 23 1HB TYR 23 3.022 -8.366 -21.745
654 2HB TYR 23 2HB TYR 23 2.411 -9.989 -21.901
655 HD1 TYR 23 HD1 TYR 23 3.948 -11.222 -24.085
656 HD2 TYR 23 HD2 TYR 23 5.227 -8.658 -20.860
657 HE1 TYR 23 HE1 TYR 23 6.241 -12.115 -24.262
658 HE2 TYR 23 HE2 TYR 23 7.485 -9.587 -21.017
659 HH TYR 23 HH TYR 23 8.892 -10.999 -22.141
660 H VAL 24 H VAL 24 1.348 -6.621 -23.019
661 HA VAL 24 HA VAL 24 -1.440 -7.674 -22.697
662 HB VAL 24 HB VAL 24 -0.112 -5.206 -21.565
663 1HG1 VAL 24 1HG1 VAL 24 -2.507 -4.750 -21.885
664 2HG1 VAL 24 2HG1 VAL 24 -2.936 -6.347 -21.243
665 3HG1 VAL 24 3HG1 VAL 24 -2.250 -5.114 -20.175
666 1HG2 VAL 24 1HG2 VAL 24 -1.021 -7.801 -20.256
667 2HG2 VAL 24 2HG2 VAL 24 0.666 -7.305 -20.512
668 3HG2 VAL 24 3HG2 VAL 24 -0.366 -6.383 -19.413
669 H LYS 25 H LYS 25 0.467 -5.384 -24.636
670 HA LYS 25 HA LYS 25 -0.032 -4.218 -26.441
671 1HB LYS 25 1HB LYS 25 -0.670 -6.845 -26.796
672 2HB LYS 25 2HB LYS 25 -2.179 -6.085 -27.303
673 1HG LYS 25 1HG LYS 25 -0.672 -4.477 -28.660
674 2HG LYS 25 2HG LYS 25 0.664 -5.589 -28.287
675 1HD LYS 25 1HD LYS 25 -0.583 -7.451 -29.356
676 2HD LYS 25 2HD LYS 25 -1.928 -6.345 -29.720
677 1HE LYS 25 1HE LYS 25 -0.354 -4.921 -31.072
678 2HE LYS 25 2HE LYS 25 0.942 -6.093 -30.758
679 1HZ LYS 25 1HZ LYS 25 -0.371 -7.742 -31.881
680 2HZ LYS 25 2HZ LYS 25 -1.575 -6.650 -32.164
681 3HZ LYS 25 3HZ LYS 25 -0.098 -6.449 -32.868
682 H LEU 26 H LEU 26 -0.861 -2.539 -24.893
683 HA LEU 26 HA LEU 26 -3.516 -1.709 -25.871
684 1HB LEU 26 1HB LEU 26 -3.166 -2.956 -23.409
685 2HB LEU 26 2HB LEU 26 -3.082 -1.273 -22.942
686 HG LEU 26 HG LEU 26 -5.357 -1.978 -24.786
687 1HD1 LEU 26 1HD1 LEU 26 -5.294 -4.026 -23.513
688 2HD1 LEU 26 2HD1 LEU 26 -5.152 -3.136 -21.988
689 3HD1 LEU 26 3HD1 LEU 26 -6.649 -3.033 -22.945
690 1HD2 LEU 26 1HD2 LEU 26 -5.261 -0.588 -22.082
691 2HD2 LEU 26 2HD2 LEU 26 -5.055 0.238 -23.646
692 3HD2 LEU 26 3HD2 LEU 26 -6.595 -0.550 -23.252
693 HA PRO 27 HA PRO 27 -1.125 2.041 -26.151
694 1HB PRO 27 1HB PRO 27 -3.081 3.914 -26.585
695 2HB PRO 27 2HB PRO 27 -2.524 2.755 -27.823
696 1HG PRO 27 1HG PRO 27 -4.955 2.513 -26.038
697 2HG PRO 27 2HG PRO 27 -4.857 2.246 -27.801
698 1HD PRO 27 1HD PRO 27 -4.762 0.174 -26.045
699 2HD PRO 27 2HD PRO 27 -3.743 0.162 -27.513
700 H VAL 28 H VAL 28 -4.055 1.940 -24.027
701 HA VAL 28 HA VAL 28 -3.481 4.066 -22.344
702 HB VAL 28 HB VAL 28 -4.539 1.424 -21.443
703 1HG1 VAL 28 1HG1 VAL 28 -3.952 2.840 -19.554
704 2HG1 VAL 28 2HG1 VAL 28 -4.842 4.212 -20.243
705 3HG1 VAL 28 3HG1 VAL 28 -5.703 2.776 -19.662
706 1HG2 VAL 28 1HG2 VAL 28 -6.263 3.800 -22.244
707 2HG2 VAL 28 2HG2 VAL 28 -6.104 2.297 -23.200
708 3HG2 VAL 28 3HG2 VAL 28 -6.819 2.262 -21.591
709 H LEU 29 H LEU 29 -2.008 0.767 -22.290
710 HA LEU 29 HA LEU 29 -0.613 1.005 -19.868
711 1HB LEU 29 1HB LEU 29 -0.780 -0.806 -22.128
712 2HB LEU 29 2HB LEU 29 0.912 -0.424 -21.973
713 HG LEU 29 HG LEU 29 -0.158 -0.981 -19.353
714 1HD1 LEU 29 1HD1 LEU 29 -1.931 -2.209 -20.482
715 2HD1 LEU 29 2HD1 LEU 29 -0.737 -3.043 -21.498
716 3HD1 LEU 29 3HD1 LEU 29 -0.783 -3.349 -19.743
717 1HD2 LEU 29 1HD2 LEU 29 1.651 -2.748 -21.056
718 2HD2 LEU 29 2HD2 LEU 29 2.252 -1.263 -20.312
719 3HD2 LEU 29 3HD2 LEU 29 1.639 -2.589 -19.295
720 H ALA 30 H ALA 30 0.783 1.437 -23.118
721 HA ALA 30 HA ALA 30 3.053 2.676 -22.177
722 1HB ALA 30 1HB ALA 30 3.010 2.054 -24.512
723 2HB ALA 30 2HB ALA 30 1.621 3.117 -24.844
724 3HB ALA 30 3HB ALA 30 3.217 3.806 -24.490
725 H LYS 31 H LYS 31 -0.161 4.116 -22.594
726 HA LYS 31 HA LYS 31 0.902 6.821 -22.414
727 1HB LYS 31 1HB LYS 31 -1.321 5.910 -23.545
728 2HB LYS 31 2HB LYS 31 -2.018 6.292 -21.962
729 1HG LYS 31 1HG LYS 31 -1.324 8.630 -22.199
730 2HG LYS 31 2HG LYS 31 -0.311 8.239 -23.600
731 1HD LYS 31 1HD LYS 31 -2.302 7.547 -24.894
732 2HD LYS 31 2HD LYS 31 -3.349 8.029 -23.541
733 1HE LYS 31 1HE LYS 31 -2.586 10.363 -23.750
734 2HE LYS 31 2HE LYS 31 -1.395 9.903 -24.978
735 1HZ LYS 31 1HZ LYS 31 -3.169 9.267 -26.415
736 2HZ LYS 31 2HZ LYS 31 -4.303 9.662 -25.285
737 3HZ LYS 31 3HZ LYS 31 -3.352 10.835 -25.947
738 H ILE 32 H ILE 32 -0.172 4.371 -20.133
739 HA ILE 32 HA ILE 32 -0.473 6.195 -17.886
740 HB ILE 32 HB ILE 32 -0.197 3.176 -18.237
741 1HG1 ILE 32 1HG1 ILE 32 -2.343 4.829 -16.856
742 2HG1 ILE 32 2HG1 ILE 32 -2.416 4.446 -18.570
743 1HG2 ILE 32 1HG2 ILE 32 1.122 3.641 -16.270
744 2HG2 ILE 32 2HG2 ILE 32 -0.047 4.846 -15.714
745 3HG2 ILE 32 3HG2 ILE 32 -0.452 3.109 -15.713
746 1HD1 ILE 32 1HD1 ILE 32 -2.367 2.010 -18.031
747 2HD1 ILE 32 2HD1 ILE 32 -2.387 2.391 -16.298
748 3HD1 ILE 32 3HD1 ILE 32 -3.757 2.846 -17.299
749 H LEU 33 H LEU 33 1.977 3.846 -19.125
750 HA LEU 33 HA LEU 33 3.839 4.264 -17.070
751 1HB LEU 33 1HB LEU 33 5.329 3.039 -18.280
752 2HB LEU 33 2HB LEU 33 3.738 2.529 -18.869
753 HG LEU 33 HG LEU 33 4.072 3.955 -20.822
754 1HD1 LEU 33 1HD1 LEU 33 5.719 5.422 -20.956
755 2HD1 LEU 33 2HD1 LEU 33 6.473 4.795 -19.464
756 3HD1 LEU 33 3HD1 LEU 33 6.862 4.080 -21.041
757 1HD2 LEU 33 1HD2 LEU 33 6.124 1.792 -20.354
758 2HD2 LEU 33 2HD2 LEU 33 4.433 1.543 -20.872
759 3HD2 LEU 33 3HD2 LEU 33 5.570 2.361 -21.951
760 H GLU 34 H GLU 34 3.326 6.063 -20.155
761 HA GLU 34 HA GLU 34 5.493 7.814 -20.024
762 1HB GLU 34 1HB GLU 34 3.841 7.458 -21.942
763 2HB GLU 34 2HB GLU 34 2.714 8.499 -21.093
764 1HG GLU 34 1HG GLU 34 4.388 10.350 -21.146
765 2HG GLU 34 2HG GLU 34 5.509 9.290 -22.016
766 H ASP 35 H ASP 35 2.131 8.368 -18.951
767 HA ASP 35 HA ASP 35 2.518 10.954 -17.833
768 1HB ASP 35 1HB ASP 35 0.273 9.996 -18.101
769 2HB ASP 35 2HB ASP 35 0.641 8.763 -16.879
770 H GLU 36 H GLU 36 2.782 7.738 -16.280
771 HA GLU 36 HA GLU 36 3.486 8.595 -13.697
772 1HB GLU 36 1HB GLU 36 4.518 6.167 -15.191
773 2HB GLU 36 2HB GLU 36 4.563 6.386 -13.435
774 1HG GLU 36 1HG GLU 36 1.987 6.189 -15.065
775 2HG GLU 36 2HG GLU 36 2.786 4.825 -14.297
776 H GLU 37 H GLU 37 5.558 8.125 -16.645
777 HA GLU 37 HA GLU 37 8.027 8.384 -15.513
778 1HB GLU 37 1HB GLU 37 6.984 7.982 -18.001
779 2HB GLU 37 2HB GLU 37 7.478 9.651 -18.211
780 1HG GLU 37 1HG GLU 37 9.257 7.421 -17.119
781 2HG GLU 37 2HG GLU 37 9.000 7.750 -18.832
782 H LYS 38 H LYS 38 5.718 11.001 -16.192
783 HA LYS 38 HA LYS 38 7.631 13.130 -15.825
784 1HB LYS 38 1HB LYS 38 5.237 13.173 -16.845
785 2HB LYS 38 2HB LYS 38 4.670 13.224 -15.178
786 1HG LYS 38 1HG LYS 38 6.629 15.224 -15.152
787 2HG LYS 38 2HG LYS 38 6.131 15.267 -16.837
788 1HD LYS 38 1HD LYS 38 4.815 16.882 -15.710
789 2HD LYS 38 2HD LYS 38 3.715 15.519 -16.001
790 1HE LYS 38 1HE LYS 38 3.968 14.776 -13.658
791 2HE LYS 38 2HE LYS 38 5.251 15.967 -13.382
792 1HZ LYS 38 1HZ LYS 38 3.653 17.695 -13.741
793 2HZ LYS 38 2HZ LYS 38 2.452 16.593 -13.995
794 3HZ LYS 38 3HZ LYS 38 3.173 16.702 -12.517
795 H HIS 39 H HIS 39 5.534 11.292 -13.585
796 HA HIS 39 HA HIS 39 6.143 12.938 -11.279
797 1HB HIS 39 1HB HIS 39 5.068 10.114 -11.597
798 2HB HIS 39 2HB HIS 39 5.372 10.861 -10.043
799 HD1 HIS 39 HD1 HIS 39 4.141 13.511 -9.955
800 HD2 HIS 39 HD2 HIS 39 2.560 10.473 -12.414
801 HE1 HIS 39 HE1 HIS 39 1.679 14.125 -10.398
802 HE2 HIS 39 HE2 HIS 39 0.745 12.280 -11.908
803 H ILE 40 H ILE 40 7.658 10.117 -12.812
804 HA ILE 40 HA ILE 40 9.592 9.691 -10.718
805 HB ILE 40 HB ILE 40 10.027 9.015 -13.643
806 1HG1 ILE 40 1HG1 ILE 40 8.537 7.376 -11.553
807 2HG1 ILE 40 2HG1 ILE 40 7.796 8.174 -12.886
808 1HG2 ILE 40 1HG2 ILE 40 11.973 8.744 -12.076
809 2HG2 ILE 40 2HG2 ILE 40 10.965 7.764 -10.998
810 3HG2 ILE 40 3HG2 ILE 40 11.395 7.165 -12.605
811 1HD1 ILE 40 1HD1 ILE 40 9.293 6.961 -14.517
812 2HD1 ILE 40 2HD1 ILE 40 9.693 5.848 -13.227
813 3HD1 ILE 40 3HD1 ILE 40 8.000 6.083 -13.681
814 H GLU 41 H GLU 41 9.619 11.501 -13.785
815 HA GLU 41 HA GLU 41 12.184 12.540 -13.755
816 1HB GLU 41 1HB GLU 41 10.353 12.779 -15.563
817 2HB GLU 41 2HB GLU 41 9.708 14.111 -14.586
818 1HG GLU 41 1HG GLU 41 12.061 15.154 -14.746
819 2HG GLU 41 2HG GLU 41 12.385 13.927 -15.983
820 H TRP 42 H TRP 42 9.277 13.713 -11.957
821 HA TRP 42 HA TRP 42 10.358 16.060 -10.947
822 1HB TRP 42 1HB TRP 42 8.013 14.890 -10.745
823 2HB TRP 42 2HB TRP 42 8.664 14.225 -9.258
824 HD1 TRP 42 HD1 TRP 42 7.720 17.556 -10.854
825 HE1 TRP 42 HE1 TRP 42 7.521 19.384 -9.045
826 HE3 TRP 42 HE3 TRP 42 9.489 14.847 -7.013
827 HZ2 TRP 42 HZ2 TRP 42 8.060 19.533 -6.115
828 HZ3 TRP 42 HZ3 TRP 42 9.728 15.826 -4.707
829 HH2 TRP 42 HH2 TRP 42 9.010 18.170 -4.281
830 H LEU 43 H LEU 43 10.863 12.694 -9.862
831 HA LEU 43 HA LEU 43 12.400 13.437 -7.546
832 1HB LEU 43 1HB LEU 43 12.268 10.786 -9.005
833 2HB LEU 43 2HB LEU 43 13.245 11.086 -7.584
834 HG LEU 43 HG LEU 43 10.665 12.024 -6.866
835 1HD1 LEU 43 1HD1 LEU 43 9.682 10.737 -8.705
836 2HD1 LEU 43 2HD1 LEU 43 10.558 9.275 -8.206
837 3HD1 LEU 43 3HD1 LEU 43 9.300 9.960 -7.163
838 1HD2 LEU 43 1HD2 LEU 43 12.085 9.413 -6.186
839 2HD2 LEU 43 2HD2 LEU 43 12.338 10.970 -5.365
840 3HD2 LEU 43 3HD2 LEU 43 10.765 10.163 -5.260
841 H GLU 44 H GLU 44 13.272 13.741 -10.867
842 HA GLU 44 HA GLU 44 16.157 13.750 -10.150
843 1HB GLU 44 1HB GLU 44 14.756 14.131 -12.837
844 2HB GLU 44 2HB GLU 44 16.475 14.414 -12.535
845 1HG GLU 44 1HG GLU 44 16.574 12.017 -11.619
846 2HG GLU 44 2HG GLU 44 14.985 11.781 -12.390
847 H THR 45 H THR 45 13.486 15.730 -10.734
848 HA THR 45 HA THR 45 15.001 18.170 -11.164
849 HB THR 45 HB THR 45 12.450 17.447 -11.745
850 HG1 THR 45 HG1 THR 45 13.593 20.016 -11.513
851 1HG2 THR 45 1HG2 THR 45 11.524 17.824 -9.459
852 2HG2 THR 45 2HG2 THR 45 12.079 19.505 -9.535
853 3HG2 THR 45 3HG2 THR 45 10.860 18.905 -10.677
854 H ILE 46 H ILE 46 13.248 16.812 -8.478
855 HA ILE 46 HA ILE 46 13.450 18.703 -6.527
856 HB ILE 46 HB ILE 46 12.240 16.531 -6.431
857 1HG1 ILE 46 1HG1 ILE 46 12.500 16.008 -4.089
858 2HG1 ILE 46 2HG1 ILE 46 14.073 16.818 -4.006
859 1HG2 ILE 46 1HG2 ILE 46 14.015 15.179 -7.405
860 2HG2 ILE 46 2HG2 ILE 46 14.917 15.218 -5.890
861 3HG2 ILE 46 3HG2 ILE 46 13.315 14.471 -5.940
862 1HD1 ILE 46 1HD1 ILE 46 11.542 18.267 -4.874
863 2HD1 ILE 46 2HD1 ILE 46 12.028 18.139 -3.168
864 3HD1 ILE 46 3HD1 ILE 46 13.074 18.978 -4.328
865 H LEU 47 H LEU 47 16.054 16.457 -7.461
866 HA LEU 47 HA LEU 47 18.244 16.459 -7.092
867 1HB LEU 47 1HB LEU 47 17.484 19.023 -7.713
868 2HB LEU 47 2HB LEU 47 18.441 19.357 -6.299
869 HG LEU 47 HG LEU 47 19.323 17.651 -8.691
870 1HD1 LEU 47 1HD1 LEU 47 18.779 19.927 -9.405
871 2HD1 LEU 47 2HD1 LEU 47 19.840 20.600 -8.148
872 3HD1 LEU 47 3HD1 LEU 47 20.524 19.642 -9.483
873 1HD2 LEU 47 1HD2 LEU 47 20.982 18.986 -6.497
874 2HD2 LEU 47 2HD2 LEU 47 20.670 17.238 -6.639
875 3HD2 LEU 47 3HD2 LEU 47 21.614 18.073 -7.882
876 H GLY 48 H GLY 48 19.448 18.487 -4.915
877 1HA GLY 48 1HA GLY 48 19.790 18.480 -2.633
878 2HA GLY 48 2HA GLY 48 18.525 17.265 -2.412
879 1HN NH2 49 1HN NH2 49 19.168 15.030 -3.620
880 2HN NH2 49 2HN NH2 49 20.816 14.467 -3.232
Start of MODEL 5
1 1H ACE 0 H1 ACE 0 4.382 16.147 1.498
2 2H ACE 0 H2 ACE 0 5.386 17.578 1.311
3 3H ACE 0 H3 ACE 0 4.826 16.706 -0.109
4 H ASP 1 H ASP 1 5.538 14.182 1.920
5 HA ASP 1 HA ASP 1 8.355 14.145 1.086
6 1HB ASP 1 1HB ASP 1 8.451 13.134 3.449
7 2HB ASP 1 2HB ASP 1 8.356 14.901 3.249
8 H TYR 2 H TYR 2 6.493 11.785 3.041
9 HA TYR 2 HA TYR 2 7.917 9.679 1.885
10 1HB TYR 2 1HB TYR 2 6.549 8.334 3.304
11 2HB TYR 2 2HB TYR 2 7.056 9.788 4.118
12 HD1 TYR 2 HD1 TYR 2 5.477 11.153 5.254
13 HD2 TYR 2 HD2 TYR 2 4.114 8.153 2.478
14 HE1 TYR 2 HE1 TYR 2 3.131 11.700 5.803
15 HE2 TYR 2 HE2 TYR 2 1.782 8.579 3.161
16 HH TYR 2 HH TYR 2 0.363 10.042 4.262
17 H LEU 3 H LEU 3 4.599 10.780 1.515
18 HA LEU 3 HA LEU 3 3.855 8.731 -0.266
19 1HB LEU 3 1HB LEU 3 1.796 10.340 -0.713
20 2HB LEU 3 2HB LEU 3 2.008 9.420 0.774
21 HG LEU 3 HG LEU 3 2.844 11.230 1.968
22 1HD1 LEU 3 1HD1 LEU 3 4.072 12.619 0.473
23 2HD1 LEU 3 2HD1 LEU 3 2.680 12.812 -0.616
24 3HD1 LEU 3 3HD1 LEU 3 2.679 13.586 0.983
25 1HD2 LEU 3 1HD2 LEU 3 0.398 12.340 0.574
26 2HD2 LEU 3 2HD2 LEU 3 0.306 10.876 1.573
27 3HD2 LEU 3 3HD2 LEU 3 0.832 12.405 2.294
28 H ARG 4 H ARG 4 5.624 11.587 -0.934
29 HA ARG 4 HA ARG 4 4.817 12.018 -3.621
30 1HB ARG 4 1HB ARG 4 7.532 12.323 -2.271
31 2HB ARG 4 2HB ARG 4 7.199 12.779 -3.943
32 1HG ARG 4 1HG ARG 4 5.262 14.194 -3.114
33 2HG ARG 4 2HG ARG 4 5.824 13.913 -1.465
34 1HD ARG 4 1HD ARG 4 7.428 15.200 -3.730
35 2HD ARG 4 2HD ARG 4 6.567 16.068 -2.442
36 HE ARG 4 HE ARG 4 8.388 14.198 -1.274
37 1HH1 ARG 4 1HH2 ARG 4 8.303 17.224 -3.074
38 2HH1 ARG 4 2HH2 ARG 4 9.721 17.907 -2.333
39 1HH2 ARG 4 1HH1 ARG 4 10.249 15.089 -0.228
40 2HH2 ARG 4 2HH1 ARG 4 10.831 16.675 -0.655
41 H GLU 5 H GLU 5 6.798 9.411 -2.163
42 HA GLU 5 HA GLU 5 7.565 8.536 -4.906
43 1HB GLU 5 1HB GLU 5 8.429 7.543 -2.169
44 2HB GLU 5 2HB GLU 5 8.750 6.685 -3.680
45 1HG GLU 5 1HG GLU 5 9.723 8.907 -4.583
46 2HG GLU 5 2HG GLU 5 9.767 9.432 -2.891
47 H LEU 6 H LEU 6 4.858 8.208 -2.992
48 HA LEU 6 HA LEU 6 4.172 5.587 -4.258
49 1HB LEU 6 1HB LEU 6 3.616 6.690 -1.520
50 2HB LEU 6 2HB LEU 6 2.714 5.324 -2.206
51 HG LEU 6 HG LEU 6 5.754 5.244 -1.918
52 1HD1 LEU 6 1HD1 LEU 6 4.726 5.721 0.206
53 2HD1 LEU 6 2HD1 LEU 6 3.531 4.446 -0.022
54 3HD1 LEU 6 3HD1 LEU 6 5.270 4.046 0.128
55 1HD2 LEU 6 1HD2 LEU 6 3.627 3.271 -2.721
56 2HD2 LEU 6 2HD2 LEU 6 5.152 3.669 -3.508
57 3HD2 LEU 6 3HD2 LEU 6 5.165 2.768 -1.999
58 H LEU 7 H LEU 7 3.766 8.648 -4.920
59 HA LEU 7 HA LEU 7 0.986 8.245 -5.631
60 1HB LEU 7 1HB LEU 7 0.105 10.118 -4.762
61 2HB LEU 7 2HB LEU 7 1.324 9.801 -3.552
62 HG LEU 7 HG LEU 7 2.824 11.439 -4.944
63 1HD1 LEU 7 1HD1 LEU 7 0.730 11.451 -6.765
64 2HD1 LEU 7 2HD1 LEU 7 0.262 12.797 -5.741
65 3HD1 LEU 7 3HD1 LEU 7 1.840 12.814 -6.541
66 1HD2 LEU 7 1HD2 LEU 7 0.430 12.512 -3.423
67 2HD2 LEU 7 2HD2 LEU 7 1.944 11.923 -2.713
68 3HD2 LEU 7 3HD2 LEU 7 1.959 13.359 -3.751
69 H LYS 8 H LYS 8 3.988 10.158 -6.069
70 HA LYS 8 HA LYS 8 3.158 11.161 -8.519
71 1HB LYS 8 1HB LYS 8 4.998 11.932 -6.818
72 2HB LYS 8 2HB LYS 8 6.064 10.849 -7.739
73 1HG LYS 8 1HG LYS 8 5.337 12.092 -9.816
74 2HG LYS 8 2HG LYS 8 4.423 13.218 -8.785
75 1HD LYS 8 1HD LYS 8 6.396 14.034 -7.702
76 2HD LYS 8 2HD LYS 8 7.358 12.661 -8.253
77 1HE LYS 8 1HE LYS 8 6.418 13.856 -10.653
78 2HE LYS 8 2HE LYS 8 6.860 15.215 -9.613
79 1HZ LYS 8 1HZ LYS 8 9.009 14.245 -9.351
80 2HZ LYS 8 2HZ LYS 8 8.570 12.890 -10.179
81 3HZ LYS 8 3HZ LYS 8 8.672 14.333 -10.965
82 H LEU 9 H LEU 9 5.413 8.506 -7.692
83 HA LEU 9 HA LEU 9 5.791 7.552 -10.385
84 1HB LEU 9 1HB LEU 9 6.130 6.302 -7.645
85 2HB LEU 9 2HB LEU 9 6.346 5.363 -9.124
86 HG LEU 9 HG LEU 9 7.759 7.965 -9.225
87 1HD1 LEU 9 1HD1 LEU 9 8.172 7.698 -6.920
88 2HD1 LEU 9 2HD1 LEU 9 8.482 5.954 -7.071
89 3HD1 LEU 9 3HD1 LEU 9 9.635 7.131 -7.740
90 1HD2 LEU 9 1HD2 LEU 9 8.730 5.093 -9.587
91 2HD2 LEU 9 2HD2 LEU 9 8.021 6.092 -10.874
92 3HD2 LEU 9 3HD2 LEU 9 9.553 6.570 -10.126
93 H GLU 10 H GLU 10 3.395 6.752 -7.777
94 HA GLU 10 HA GLU 10 2.085 4.738 -9.199
95 1HB GLU 10 1HB GLU 10 1.004 6.826 -7.287
96 2HB GLU 10 2HB GLU 10 0.062 5.533 -7.966
97 1HG GLU 10 1HG GLU 10 2.545 4.982 -6.282
98 2HG GLU 10 2HG GLU 10 0.902 5.121 -5.642
99 H LEU 11 H LEU 11 1.703 8.308 -9.569
100 HA LEU 11 HA LEU 11 -0.587 8.264 -11.185
101 1HB LEU 11 1HB LEU 11 0.560 10.359 -10.363
102 2HB LEU 11 2HB LEU 11 1.853 10.064 -11.530
103 HG LEU 11 HG LEU 11 0.057 10.169 -13.380
104 1HD1 LEU 11 1HD1 LEU 11 -1.950 9.956 -11.945
105 2HD1 LEU 11 2HD1 LEU 11 -1.508 11.452 -11.096
106 3HD1 LEU 11 3HD1 LEU 11 -1.950 11.496 -12.815
107 1HD2 LEU 11 1HD2 LEU 11 0.658 12.670 -11.773
108 2HD2 LEU 11 2HD2 LEU 11 1.730 11.918 -12.977
109 3HD2 LEU 11 3HD2 LEU 11 0.171 12.589 -13.483
110 H GLN 12 H GLN 12 2.837 8.035 -12.311
111 HA GLN 12 HA GLN 12 2.104 7.781 -15.068
112 1HB GLN 12 1HB GLN 12 4.325 6.842 -15.461
113 2HB GLN 12 2HB GLN 12 4.423 8.342 -14.534
114 1HG GLN 12 1HG GLN 12 5.079 7.262 -12.585
115 2HG GLN 12 2HG GLN 12 4.337 5.717 -13.068
116 1HE2 GLN 12 2HE2 GLN 12 6.201 4.676 -12.310
117 2HE2 GLN 12 1HE2 GLN 12 7.603 4.575 -13.369
118 H LEU 13 H LEU 13 2.007 5.456 -12.435
119 HA LEU 13 HA LEU 13 2.006 3.123 -14.169
120 1HB LEU 13 1HB LEU 13 1.174 3.348 -11.258
121 2HB LEU 13 2HB LEU 13 1.389 1.893 -12.221
122 HG LEU 13 HG LEU 13 3.499 3.845 -11.274
123 1HD1 LEU 13 1HD1 LEU 13 2.748 2.064 -9.840
124 2HD1 LEU 13 2HD1 LEU 13 3.121 0.844 -11.095
125 3HD1 LEU 13 3HD1 LEU 13 4.423 1.800 -10.372
126 1HD2 LEU 13 1HD2 LEU 13 3.916 1.676 -13.376
127 2HD2 LEU 13 2HD2 LEU 13 4.132 3.423 -13.633
128 3HD2 LEU 13 3HD2 LEU 13 5.190 2.586 -12.518
129 H ILE 14 H ILE 14 -0.468 4.915 -12.241
130 HA ILE 14 HA ILE 14 -2.659 3.391 -13.243
131 HB ILE 14 HB ILE 14 -2.460 6.353 -12.412
132 1HG1 ILE 14 2HG1 ILE 14 -1.857 5.145 -10.502
133 2HG1 ILE 14 3HG1 ILE 14 -3.581 5.376 -10.284
134 1HG2 ILE 14 1HG2 ILE 14 -4.517 5.960 -13.749
135 2HG2 ILE 14 2HG2 ILE 14 -4.964 4.628 -12.667
136 3HG2 ILE 14 3HG2 ILE 14 -4.873 6.304 -12.063
137 1HD1 ILE 14 1HD1 ILE 14 -3.893 3.028 -11.288
138 2HD1 ILE 14 2HD1 ILE 14 -2.119 2.855 -11.182
139 3HD1 ILE 14 3HD1 ILE 14 -3.063 3.105 -9.726
140 H LYS 15 H LYS 15 -1.092 6.245 -14.613
141 HA LYS 15 HA LYS 15 -2.708 6.247 -16.952
142 1HB LYS 15 1HB LYS 15 -0.558 7.773 -15.939
143 2HB LYS 15 2HB LYS 15 0.094 7.036 -17.368
144 1HG LYS 15 1HG LYS 15 -0.890 8.916 -18.349
145 2HG LYS 15 2HG LYS 15 -2.331 7.894 -18.357
146 1HD LYS 15 1HD LYS 15 -2.743 8.839 -15.936
147 2HD LYS 15 2HD LYS 15 -1.495 10.021 -16.334
148 1HE LYS 15 1HE LYS 15 -3.353 10.025 -18.538
149 2HE LYS 15 2HE LYS 15 -4.322 9.965 -17.060
150 1HZ LYS 15 1HZ LYS 15 -3.087 11.882 -16.282
151 2HZ LYS 15 2HZ LYS 15 -2.260 11.949 -17.706
152 3HZ LYS 15 3HZ LYS 15 -3.889 12.187 -17.687
153 H GLN 16 H GLN 16 0.431 4.570 -16.340
154 HA GLN 16 HA GLN 16 0.737 3.523 -19.005
155 1HB GLN 16 1HB GLN 16 1.909 2.841 -16.308
156 2HB GLN 16 2HB GLN 16 2.217 1.787 -17.675
157 1HG GLN 16 1HG GLN 16 3.386 3.376 -18.895
158 2HG GLN 16 2HG GLN 16 2.690 4.741 -18.003
159 1HE2 GLN 16 2HE2 GLN 16 4.840 5.585 -17.660
160 2HE2 GLN 16 1HE2 GLN 16 5.870 4.889 -16.423
161 H TYR 17 H TYR 17 -1.046 2.436 -16.180
162 HA TYR 17 HA TYR 17 -1.347 -0.295 -17.056
163 1HB TYR 17 1HB TYR 17 -2.077 1.336 -14.753
164 2HB TYR 17 2HB TYR 17 -3.508 0.633 -15.380
165 HD1 TYR 17 HD1 TYR 17 -3.437 -1.931 -15.869
166 HD2 TYR 17 HD2 TYR 17 -1.037 0.173 -12.998
167 HE1 TYR 17 HE1 TYR 17 -3.392 -3.966 -14.407
168 HE2 TYR 17 HE2 TYR 17 -1.139 -1.792 -11.493
169 HH TYR 17 HH TYR 17 -2.542 -4.912 -12.458
170 H ARG 18 H ARG 18 -2.945 2.758 -17.704
171 HA ARG 18 HA ARG 18 -5.278 1.535 -18.991
172 1HB ARG 18 1HB ARG 18 -4.356 4.421 -18.844
173 2HB ARG 18 2HB ARG 18 -5.670 3.851 -19.879
174 1HG ARG 18 1HG ARG 18 -6.606 2.735 -17.712
175 2HG ARG 18 2HG ARG 18 -5.523 3.837 -16.870
176 1HD ARG 18 1HD ARG 18 -7.643 4.990 -17.019
177 2HD ARG 18 2HD ARG 18 -6.690 5.688 -18.322
178 HE ARG 18 HE ARG 18 -8.090 4.724 -19.888
179 1HH1 ARG 18 1HH2 ARG 18 -8.636 3.186 -16.764
180 2HH1 ARG 18 2HH2 ARG 18 -10.047 2.296 -17.262
181 1HH2 ARG 18 1HH1 ARG 18 -9.874 3.501 -20.611
182 2HH2 ARG 18 2HH1 ARG 18 -10.744 2.454 -19.524
183 H GLU 19 H GLU 19 -2.231 3.034 -19.859
184 HA GLU 19 HA GLU 19 -2.611 2.856 -22.685
185 1HB GLU 19 1HB GLU 19 -0.736 4.118 -21.317
186 2HB GLU 19 2HB GLU 19 0.146 2.586 -21.504
187 1HG GLU 19 1HG GLU 19 -0.301 2.731 -24.000
188 2HG GLU 19 2HG GLU 19 -1.050 4.312 -23.729
189 H ALA 20 H ALA 20 -1.330 0.484 -20.286
190 HA ALA 20 HA ALA 20 -0.599 -1.341 -22.469
191 1HB ALA 20 1HB ALA 20 0.795 -1.643 -20.717
192 2HB ALA 20 2HB ALA 20 -0.486 -1.475 -19.501
193 3HB ALA 20 3HB ALA 20 -0.389 -2.955 -20.510
194 H LEU 21 H LEU 21 -3.424 -0.912 -20.332
195 HA LEU 21 HA LEU 21 -4.843 -3.223 -20.704
196 1HB LEU 21 1HB LEU 21 -6.054 -1.801 -19.451
197 2HB LEU 21 2HB LEU 21 -5.444 -0.395 -20.270
198 HG LEU 21 HG LEU 21 -7.096 -0.749 -22.125
199 1HD1 LEU 21 1HD1 LEU 21 -7.509 -3.248 -21.414
200 2HD1 LEU 21 2HD1 LEU 21 -8.545 -2.568 -20.163
201 3HD1 LEU 21 3HD1 LEU 21 -8.900 -2.256 -21.876
202 1HD2 LEU 21 1HD2 LEU 21 -7.865 -0.182 -19.257
203 2HD2 LEU 21 2HD2 LEU 21 -7.483 0.960 -20.550
204 3HD2 LEU 21 3HD2 LEU 21 -9.005 0.047 -20.608
205 H GLU 22 H GLU 22 -4.442 -0.706 -23.185
206 HA GLU 22 HA GLU 22 -6.314 -1.972 -25.018
207 1HB GLU 22 1HB GLU 22 -5.473 -0.264 -26.654
208 2HB GLU 22 2HB GLU 22 -6.224 0.393 -25.192
209 1HG GLU 22 1HG GLU 22 -4.143 0.988 -24.243
210 2HG GLU 22 2HG GLU 22 -3.228 0.069 -25.473
211 H TYR 23 H TYR 23 -2.846 -2.117 -24.398
212 HA TYR 23 HA TYR 23 -2.266 -3.441 -26.935
213 1HB TYR 23 1HB TYR 23 -0.708 -2.530 -24.489
214 2HB TYR 23 2HB TYR 23 -0.025 -3.694 -25.596
215 HD1 TYR 23 HD1 TYR 23 0.213 -0.355 -24.879
216 HD2 TYR 23 HD2 TYR 23 -0.488 -2.977 -28.235
217 HE1 TYR 23 HE1 TYR 23 1.079 1.367 -26.417
218 HE2 TYR 23 HE2 TYR 23 0.287 -1.209 -29.776
219 HH TYR 23 HH TYR 23 1.417 1.964 -28.610
220 H VAL 24 H VAL 24 -2.989 -4.303 -23.616
221 HA VAL 24 HA VAL 24 -2.074 -7.097 -24.039
222 HB VAL 24 HB VAL 24 -3.278 -5.669 -21.686
223 1HG1 VAL 24 1HG1 VAL 24 -3.948 -7.991 -21.437
224 2HG1 VAL 24 2HG1 VAL 24 -2.381 -8.572 -22.033
225 3HG1 VAL 24 3HG1 VAL 24 -2.494 -7.824 -20.442
226 1HG2 VAL 24 1HG2 VAL 24 -0.476 -6.801 -22.045
227 2HG2 VAL 24 2HG2 VAL 24 -0.885 -5.090 -22.273
228 3HG2 VAL 24 3HG2 VAL 24 -1.081 -5.839 -20.683
229 H LYS 25 H LYS 25 -5.057 -5.228 -24.225
230 HA LYS 25 HA LYS 25 -7.141 -5.797 -24.901
231 1HB LYS 25 1HB LYS 25 -5.533 -8.022 -26.172
232 2HB LYS 25 2HB LYS 25 -7.288 -8.168 -26.132
233 1HG LYS 25 1HG LYS 25 -7.600 -6.067 -27.243
234 2HG LYS 25 2HG LYS 25 -5.849 -5.746 -27.254
235 1HD LYS 25 1HD LYS 25 -5.414 -7.571 -28.724
236 2HD LYS 25 2HD LYS 25 -7.010 -8.300 -28.467
237 1HE LYS 25 1HE LYS 25 -8.131 -6.526 -29.666
238 2HE LYS 25 2HE LYS 25 -6.640 -5.568 -29.770
239 1HZ LYS 25 1HZ LYS 25 -5.704 -7.263 -31.143
240 2HZ LYS 25 2HZ LYS 25 -7.067 -8.185 -31.040
241 3HZ LYS 25 3HZ LYS 25 -7.114 -6.722 -31.801
242 H LEU 26 H LEU 26 -7.167 -5.862 -22.404
243 HA LEU 26 HA LEU 26 -8.778 -8.261 -21.766
244 1HB LEU 26 1HB LEU 26 -6.350 -8.665 -21.102
245 2HB LEU 26 2HB LEU 26 -6.520 -7.286 -20.016
246 HG LEU 26 HG LEU 26 -8.563 -8.616 -19.047
247 1HD1 LEU 26 1HD1 LEU 26 -8.490 -10.381 -20.895
248 2HD1 LEU 26 2HD1 LEU 26 -6.955 -10.934 -20.201
249 3HD1 LEU 26 3HD1 LEU 26 -8.446 -11.021 -19.241
250 1HD2 LEU 26 1HD2 LEU 26 -5.656 -9.461 -18.661
251 2HD2 LEU 26 2HD2 LEU 26 -6.495 -8.151 -17.802
252 3HD2 LEU 26 3HD2 LEU 26 -6.982 -9.830 -17.542
253 HA PRO 27 HA PRO 27 -10.889 -4.657 -19.993
254 1HB PRO 27 1HB PRO 27 -13.171 -5.848 -19.065
255 2HB PRO 27 2HB PRO 27 -12.881 -5.450 -20.782
256 1HG PRO 27 1HG PRO 27 -12.607 -8.127 -19.422
257 2HG PRO 27 2HG PRO 27 -13.270 -7.762 -21.039
258 1HD PRO 27 1HD PRO 27 -10.694 -8.688 -20.578
259 2HD PRO 27 2HD PRO 27 -11.134 -7.696 -21.998
260 H VAL 28 H VAL 28 -10.500 -7.786 -18.283
261 HA VAL 28 HA VAL 28 -10.713 -7.000 -15.616
262 HB VAL 28 HB VAL 28 -8.753 -8.875 -16.847
263 1HG1 VAL 28 1HG1 VAL 28 -7.813 -8.286 -14.700
264 2HG1 VAL 28 2HG1 VAL 28 -9.385 -8.540 -13.897
265 3HG1 VAL 28 3HG1 VAL 28 -8.476 -9.901 -14.568
266 1HG2 VAL 28 1HG2 VAL 28 -11.171 -9.677 -15.219
267 2HG2 VAL 28 2HG2 VAL 28 -11.069 -9.765 -17.010
268 3HG2 VAL 28 3HG2 VAL 28 -10.012 -10.746 -15.993
269 H LEU 29 H LEU 29 -8.151 -6.093 -17.972
270 HA LEU 29 HA LEU 29 -6.244 -5.321 -15.975
271 1HB LEU 29 1HB LEU 29 -6.497 -5.253 -18.879
272 2HB LEU 29 2HB LEU 29 -5.835 -3.740 -18.297
273 HG LEU 29 HG LEU 29 -4.712 -6.311 -17.156
274 1HD1 LEU 29 1HD1 LEU 29 -4.447 -7.060 -19.276
275 2HD1 LEU 29 2HD1 LEU 29 -4.546 -5.435 -19.998
276 3HD1 LEU 29 3HD1 LEU 29 -3.045 -5.975 -19.206
277 1HD2 LEU 29 1HD2 LEU 29 -3.343 -3.771 -18.109
278 2HD2 LEU 29 2HD2 LEU 29 -4.140 -3.893 -16.527
279 3HD2 LEU 29 3HD2 LEU 29 -2.797 -4.993 -16.916
280 H ALA 30 H ALA 30 -8.566 -3.306 -17.885
281 HA ALA 30 HA ALA 30 -8.103 -0.930 -16.265
282 1HB ALA 30 1HB ALA 30 -9.633 -1.431 -18.530
283 2HB ALA 30 2HB ALA 30 -10.863 -1.297 -17.267
284 3HB ALA 30 3HB ALA 30 -9.714 0.028 -17.527
285 H LYS 31 H LYS 31 -10.124 -3.743 -15.700
286 HA LYS 31 HA LYS 31 -11.399 -2.379 -13.454
287 1HB LYS 31 1HB LYS 31 -11.678 -4.897 -14.882
288 2HB LYS 31 2HB LYS 31 -11.644 -5.213 -13.145
289 1HG LYS 31 1HG LYS 31 -13.545 -3.904 -12.738
290 2HG LYS 31 2HG LYS 31 -13.378 -2.961 -14.229
291 1HD LYS 31 1HD LYS 31 -14.121 -4.653 -15.634
292 2HD LYS 31 2HD LYS 31 -13.885 -5.936 -14.436
293 1HE LYS 31 1HE LYS 31 -15.914 -3.692 -14.007
294 2HE LYS 31 2HE LYS 31 -16.308 -5.175 -14.894
295 1HZ LYS 31 1HZ LYS 31 -15.566 -6.412 -12.942
296 2HZ LYS 31 2HZ LYS 31 -15.429 -5.002 -12.102
297 3HZ LYS 31 3HZ LYS 31 -16.899 -5.485 -12.670
298 H ILE 32 H ILE 32 -8.524 -4.370 -13.851
299 HA ILE 32 HA ILE 32 -8.095 -4.684 -10.979
300 HB ILE 32 HB ILE 32 -6.491 -5.138 -13.505
301 1HG1 ILE 32 2HG1 ILE 32 -7.327 -6.873 -11.128
302 2HG1 ILE 32 3HG1 ILE 32 -8.080 -6.831 -12.705
303 1HG2 ILE 32 1HG2 ILE 32 -4.836 -4.090 -12.093
304 2HG2 ILE 32 2HG2 ILE 32 -5.259 -5.145 -10.740
305 3HG2 ILE 32 3HG2 ILE 32 -4.515 -5.810 -12.206
306 1HD1 ILE 32 1HD1 ILE 32 -5.843 -7.614 -13.675
307 2HD1 ILE 32 2HD1 ILE 32 -5.308 -7.871 -11.997
308 3HD1 ILE 32 3HD1 ILE 32 -6.689 -8.772 -12.621
309 H LEU 33 H LEU 33 -6.874 -2.520 -13.540
310 HA LEU 33 HA LEU 33 -5.089 -1.156 -11.932
311 1HB LEU 33 1HB LEU 33 -4.646 0.212 -13.590
312 2HB LEU 33 2HB LEU 33 -5.311 -1.217 -14.401
313 HG LEU 33 HG LEU 33 -7.480 0.064 -14.521
314 1HD1 LEU 33 1HD1 LEU 33 -7.615 1.980 -13.423
315 2HD1 LEU 33 2HD1 LEU 33 -5.848 2.091 -13.210
316 3HD1 LEU 33 3HD1 LEU 33 -6.620 2.672 -14.706
317 1HD2 LEU 33 1HD2 LEU 33 -5.295 1.412 -16.081
318 2HD2 LEU 33 2HD2 LEU 33 -5.647 -0.314 -16.347
319 3HD2 LEU 33 3HD2 LEU 33 -6.905 0.904 -16.605
320 H GLU 34 H GLU 34 -8.573 -0.658 -12.619
321 HA GLU 34 HA GLU 34 -8.999 1.868 -11.469
322 1HB GLU 34 1HB GLU 34 -10.560 0.533 -12.907
323 2HB GLU 34 2HB GLU 34 -10.973 -0.453 -11.526
324 1HG GLU 34 1HG GLU 34 -11.189 2.585 -11.397
325 2HG GLU 34 2HG GLU 34 -12.437 1.633 -12.210
326 H ASP 35 H ASP 35 -9.458 -1.355 -10.097
327 HA ASP 35 HA ASP 35 -10.207 -0.602 -7.493
328 1HB ASP 35 1HB ASP 35 -9.657 -3.031 -8.770
329 2HB ASP 35 2HB ASP 35 -8.332 -2.915 -7.615
330 H GLU 36 H GLU 36 -6.956 -1.142 -8.871
331 HA GLU 36 HA GLU 36 -5.442 -0.462 -6.562
332 1HB GLU 36 1HB GLU 36 -4.679 -0.003 -9.470
333 2HB GLU 36 2HB GLU 36 -3.585 -0.061 -8.097
334 1HG GLU 36 1HG GLU 36 -5.334 -2.476 -8.728
335 2HG GLU 36 2HG GLU 36 -3.827 -2.178 -9.597
336 H GLU 37 H GLU 37 -6.736 1.612 -9.171
337 HA GLU 37 HA GLU 37 -5.515 3.967 -8.630
338 1HB GLU 37 1HB GLU 37 -7.534 3.078 -10.271
339 2HB GLU 37 2HB GLU 37 -8.466 4.148 -9.225
340 1HG GLU 37 1HG GLU 37 -5.862 5.068 -10.452
341 2HG GLU 37 2HG GLU 37 -7.270 4.861 -11.486
342 H LYS 38 H LYS 38 -8.277 2.561 -6.867
343 HA LYS 38 HA LYS 38 -8.716 4.857 -5.210
344 1HB LYS 38 1HB LYS 38 -10.323 3.047 -5.558
345 2HB LYS 38 2HB LYS 38 -9.283 1.911 -4.679
346 1HG LYS 38 1HG LYS 38 -9.568 3.047 -2.604
347 2HG LYS 38 2HG LYS 38 -10.055 4.555 -3.395
348 1HD LYS 38 1HD LYS 38 -12.181 3.394 -4.150
349 2HD LYS 38 2HD LYS 38 -11.729 2.039 -3.088
350 1HE LYS 38 1HE LYS 38 -11.553 3.710 -1.177
351 2HE LYS 38 2HE LYS 38 -12.123 4.979 -2.277
352 1HZ LYS 38 1HZ LYS 38 -14.161 3.842 -2.512
353 2HZ LYS 38 2HZ LYS 38 -13.636 2.553 -1.624
354 3HZ LYS 38 3HZ LYS 38 -13.851 4.021 -0.902
355 H HIS 39 H HIS 39 -6.597 2.003 -4.812
356 HA HIS 39 HA HIS 39 -5.678 2.623 -2.160
357 1HB HIS 39 1HB HIS 39 -4.401 1.061 -4.457
358 2HB HIS 39 2HB HIS 39 -3.649 1.294 -2.912
359 HD1 HIS 39 HD1 HIS 39 -5.788 0.689 -0.856
360 HD2 HIS 39 HD2 HIS 39 -5.639 -1.273 -4.575
361 HE1 HIS 39 HE1 HIS 39 -7.151 -1.484 -0.603
362 HE2 HIS 39 HE2 HIS 39 -7.092 -2.619 -2.909
363 H ILE 40 H ILE 40 -4.557 3.580 -5.401
364 HA ILE 40 HA ILE 40 -2.345 5.176 -4.445
365 HB ILE 40 HB ILE 40 -3.865 5.215 -7.096
366 1HG1 ILE 40 2HG1 ILE 40 -1.634 4.281 -7.893
367 2HG1 ILE 40 3HG1 ILE 40 -1.206 4.060 -6.174
368 1HG2 ILE 40 1HG2 ILE 40 -2.793 7.430 -6.731
369 2HG2 ILE 40 2HG2 ILE 40 -1.267 6.618 -6.328
370 3HG2 ILE 40 3HG2 ILE 40 -1.945 6.518 -7.966
371 1HD1 ILE 40 1HD1 ILE 40 -2.897 2.323 -6.009
372 2HD1 ILE 40 2HD1 ILE 40 -3.509 2.782 -7.630
373 3HD1 ILE 40 3HD1 ILE 40 -1.922 2.029 -7.451
374 H GLU 41 H GLU 41 -5.736 5.848 -5.224
375 HA GLU 41 HA GLU 41 -5.729 8.610 -4.936
376 1HB GLU 41 1HB GLU 41 -7.682 7.058 -5.695
377 2HB GLU 41 2HB GLU 41 -8.049 6.941 -3.959
378 1HG GLU 41 1HG GLU 41 -7.931 9.586 -4.067
379 2HG GLU 41 2HG GLU 41 -8.087 9.342 -5.808
380 H TRP 42 H TRP 42 -5.804 6.028 -2.384
381 HA TRP 42 HA TRP 42 -6.483 7.623 -0.224
382 1HB TRP 42 1HB TRP 42 -5.961 5.081 -0.476
383 2HB TRP 42 2HB TRP 42 -4.332 5.539 -0.014
384 HD1 TRP 42 HD1 TRP 42 -7.869 5.350 1.339
385 HE1 TRP 42 HE1 TRP 42 -7.867 5.743 3.952
386 HE3 TRP 42 HE3 TRP 42 -3.065 6.684 1.865
387 HZ2 TRP 42 HZ2 TRP 42 -5.917 6.439 5.949
388 HZ3 TRP 42 HZ3 TRP 42 -2.086 7.229 4.138
389 HH2 TRP 42 HH2 TRP 42 -3.530 7.126 6.158
390 H LEU 43 H LEU 43 -3.411 7.321 -1.945
391 HA LEU 43 HA LEU 43 -1.924 9.092 -0.139
392 1HB LEU 43 1HB LEU 43 -1.174 8.009 -2.886
393 2HB LEU 43 2HB LEU 43 -0.150 8.928 -1.795
394 HG LEU 43 HG LEU 43 -1.143 6.818 -0.179
395 1HD1 LEU 43 1HD1 LEU 43 -1.935 5.670 -2.187
396 2HD1 LEU 43 2HD1 LEU 43 -0.329 5.724 -2.909
397 3HD1 LEU 43 3HD1 LEU 43 -0.606 4.783 -1.441
398 1HD2 LEU 43 1HD2 LEU 43 1.499 7.318 -1.554
399 2HD2 LEU 43 2HD2 LEU 43 1.055 7.597 0.133
400 3HD2 LEU 43 3HD2 LEU 43 1.255 5.945 -0.447
401 H GLU 44 H GLU 44 -3.556 9.354 -3.319
402 HA GLU 44 HA GLU 44 -2.933 12.256 -3.466
403 1HB GLU 44 1HB GLU 44 -4.501 10.449 -5.352
404 2HB GLU 44 2HB GLU 44 -4.293 12.180 -5.551
405 1HG GLU 44 1HG GLU 44 -1.687 11.450 -5.221
406 2HG GLU 44 2HG GLU 44 -2.328 10.019 -6.046
407 H THR 45 H THR 45 -4.630 11.220 -1.195
408 HA THR 45 HA THR 45 -6.583 13.394 -1.473
409 HB THR 45 HB THR 45 -7.546 11.151 -2.341
410 HG1 THR 45 HG1 THR 45 -8.699 13.056 -0.661
411 1HG2 THR 45 1HG2 THR 45 -6.984 9.744 -0.384
412 2HG2 THR 45 2HG2 THR 45 -8.179 10.650 0.566
413 3HG2 THR 45 3HG2 THR 45 -8.680 9.715 -0.863
414 H ILE 46 H ILE 46 -5.462 10.687 0.450
415 HA ILE 46 HA ILE 46 -5.200 10.347 2.647
416 HB ILE 46 HB ILE 46 -3.113 11.260 1.927
417 1HG1 ILE 46 2HG1 ILE 46 -2.149 12.027 4.023
418 2HG1 ILE 46 3HG1 ILE 46 -3.747 12.259 4.732
419 1HG2 ILE 46 1HG2 ILE 46 -3.623 13.403 1.038
420 2HG2 ILE 46 2HG2 ILE 46 -4.132 14.027 2.623
421 3HG2 ILE 46 3HG2 ILE 46 -2.438 13.601 2.321
422 1HD1 ILE 46 1HD1 ILE 46 -3.218 9.571 3.521
423 2HD1 ILE 46 2HD1 ILE 46 -2.282 9.975 4.967
424 3HD1 ILE 46 3HD1 ILE 46 -4.057 9.991 5.031
425 H LEU 47 H LEU 47 -7.554 10.672 2.669
426 HA LEU 47 HA LEU 47 -9.463 11.366 3.696
427 1HB LEU 47 1HB LEU 47 -8.728 10.972 5.764
428 2HB LEU 47 2HB LEU 47 -7.417 12.112 5.744
429 HG LEU 47 HG LEU 47 -10.060 13.460 5.668
430 1HD1 LEU 47 1HD1 LEU 47 -10.753 11.577 7.018
431 2HD1 LEU 47 2HD1 LEU 47 -9.289 11.697 8.021
432 3HD1 LEU 47 3HD1 LEU 47 -10.511 12.984 8.067
433 1HD2 LEU 47 1HD2 LEU 47 -7.631 13.595 7.533
434 2HD2 LEU 47 2HD2 LEU 47 -7.850 14.602 6.097
435 3HD2 LEU 47 3HD2 LEU 47 -8.960 14.770 7.467
436 H GLY 48 H GLY 48 -9.832 12.391 1.726
437 1HA GLY 48 1HA GLY 48 -9.161 14.997 0.963
438 2HA GLY 48 2HA GLY 48 -10.658 14.151 0.529
439 1HN NH2 49 1HN NH2 49 -9.487 16.902 2.060
440 2HN NH2 49 2HN NH2 49 -10.883 17.252 3.114
441 1H ACE 0 H1 ACE 0 9.170 -8.461 -22.887
442 2H ACE 0 H2 ACE 0 7.669 -9.254 -22.350
443 3H ACE 0 H3 ACE 0 9.034 -9.071 -21.227
444 H ASP 1 H ASP 1 8.308 -6.460 -23.379
445 HA ASP 1 HA ASP 1 8.543 -4.454 -21.613
446 1HB ASP 1 1HB ASP 1 8.406 -4.093 -24.026
447 2HB ASP 1 2HB ASP 1 6.681 -4.503 -24.028
448 H TYR 2 H TYR 2 5.245 -5.504 -22.631
449 HA TYR 2 HA TYR 2 3.870 -3.930 -20.871
450 1HB TYR 2 1HB TYR 2 3.109 -6.694 -21.882
451 2HB TYR 2 2HB TYR 2 2.023 -5.453 -21.283
452 HD1 TYR 2 HD1 TYR 2 2.544 -2.983 -22.510
453 HD2 TYR 2 HD2 TYR 2 2.958 -6.937 -24.181
454 HE1 TYR 2 HE1 TYR 2 2.498 -2.029 -24.797
455 HE2 TYR 2 HE2 TYR 2 2.814 -5.985 -26.470
456 HH TYR 2 HH TYR 2 2.247 -4.074 -27.681
457 H LEU 3 H LEU 3 4.784 -7.379 -20.334
458 HA LEU 3 HA LEU 3 3.697 -7.416 -17.697
459 1HB LEU 3 1HB LEU 3 5.862 -9.105 -19.052
460 2HB LEU 3 2HB LEU 3 5.427 -9.305 -17.355
461 HG LEU 3 HG LEU 3 2.924 -9.348 -18.481
462 1HD1 LEU 3 1HD1 LEU 3 3.846 -9.335 -20.809
463 2HD1 LEU 3 2HD1 LEU 3 4.691 -10.858 -20.450
464 3HD1 LEU 3 3HD1 LEU 3 2.920 -10.795 -20.423
465 1HD2 LEU 3 1HD2 LEU 3 4.732 -11.769 -18.117
466 2HD2 LEU 3 2HD2 LEU 3 3.852 -10.933 -16.818
467 3HD2 LEU 3 3HD2 LEU 3 2.955 -11.750 -18.102
468 H ARG 4 H ARG 4 6.921 -6.433 -18.863
469 HA ARG 4 HA ARG 4 7.779 -5.887 -16.152
470 1HB ARG 4 1HB ARG 4 8.920 -5.208 -18.859
471 2HB ARG 4 2HB ARG 4 9.712 -4.783 -17.322
472 1HG ARG 4 1HG ARG 4 9.640 -7.185 -16.641
473 2HG ARG 4 2HG ARG 4 9.025 -7.625 -18.238
474 1HD ARG 4 1HD ARG 4 11.655 -6.097 -17.900
475 2HD ARG 4 2HD ARG 4 11.556 -7.843 -17.728
476 HE ARG 4 HE ARG 4 11.243 -8.171 -19.936
477 1HH1 ARG 4 1HH2 ARG 4 10.899 -4.715 -19.317
478 2HH1 ARG 4 2HH2 ARG 4 11.019 -4.247 -20.985
479 1HH2 ARG 4 1HH1 ARG 4 11.449 -7.603 -22.102
480 2HH2 ARG 4 2HH1 ARG 4 11.359 -5.937 -22.611
481 H GLU 5 H GLU 5 5.423 -4.331 -17.831
482 HA GLU 5 HA GLU 5 6.151 -1.635 -16.762
483 1HB GLU 5 1HB GLU 5 4.448 -2.520 -19.081
484 2HB GLU 5 2HB GLU 5 4.047 -1.034 -18.208
485 1HG GLU 5 1HG GLU 5 6.332 -0.180 -18.604
486 2HG GLU 5 2HG GLU 5 6.699 -1.628 -19.566
487 H LEU 6 H LEU 6 3.697 -4.228 -16.644
488 HA LEU 6 HA LEU 6 2.343 -2.663 -14.437
489 1HB LEU 6 1HB LEU 6 1.150 -4.905 -16.012
490 2HB LEU 6 2HB LEU 6 0.373 -3.797 -14.878
491 HG LEU 6 HG LEU 6 0.811 -1.944 -16.641
492 1HD1 LEU 6 1HD1 LEU 6 2.493 -2.930 -18.094
493 2HD1 LEU 6 2HD1 LEU 6 1.622 -4.504 -18.111
494 3HD1 LEU 6 3HD1 LEU 6 1.043 -3.132 -18.989
495 1HD2 LEU 6 1HD2 LEU 6 -0.791 -4.265 -17.753
496 2HD2 LEU 6 2HD2 LEU 6 -1.292 -3.453 -16.267
497 3HD2 LEU 6 3HD2 LEU 6 -1.189 -2.534 -17.764
498 H LEU 7 H LEU 7 4.763 -4.709 -14.557
499 HA LEU 7 HA LEU 7 3.843 -6.154 -12.216
500 1HB LEU 7 1HB LEU 7 3.985 -7.495 -14.458
501 2HB LEU 7 2HB LEU 7 5.731 -7.559 -14.110
502 HG LEU 7 HG LEU 7 3.499 -8.442 -12.251
503 1HD1 LEU 7 1HD1 LEU 7 3.759 -9.689 -14.486
504 2HD1 LEU 7 2HD1 LEU 7 5.337 -10.228 -13.896
505 3HD1 LEU 7 3HD1 LEU 7 3.842 -10.642 -13.020
506 1HD2 LEU 7 1HD2 LEU 7 6.171 -9.639 -11.840
507 2HD2 LEU 7 2HD2 LEU 7 6.193 -7.907 -11.581
508 3HD2 LEU 7 3HD2 LEU 7 5.056 -8.890 -10.677
509 H LYS 8 H LYS 8 6.861 -5.551 -14.137
510 HA LYS 8 HA LYS 8 8.488 -5.539 -11.908
511 1HB LYS 8 1HB LYS 8 9.064 -5.362 -14.509
512 2HB LYS 8 2HB LYS 8 9.067 -3.629 -14.179
513 1HG LYS 8 1HG LYS 8 11.264 -4.133 -13.900
514 2HG LYS 8 2HG LYS 8 10.688 -4.223 -12.238
515 1HD LYS 8 1HD LYS 8 10.349 -6.860 -13.457
516 2HD LYS 8 2HD LYS 8 11.917 -6.241 -13.965
517 1HE LYS 8 1HE LYS 8 11.988 -5.688 -11.240
518 2HE LYS 8 2HE LYS 8 10.965 -7.131 -11.281
519 1HZ LYS 8 1HZ LYS 8 12.729 -8.214 -12.521
520 2HZ LYS 8 2HZ LYS 8 13.643 -6.843 -12.455
521 3HZ LYS 8 3HZ LYS 8 13.276 -7.652 -11.070
522 H LEU 9 H LEU 9 6.874 -2.802 -13.477
523 HA LEU 9 HA LEU 9 7.744 -0.818 -11.551
524 1HB LEU 9 1HB LEU 9 5.587 -0.807 -13.665
525 2HB LEU 9 2HB LEU 9 6.017 0.604 -12.722
526 HG LEU 9 HG LEU 9 8.040 -0.830 -14.454
527 1HD1 LEU 9 1HD1 LEU 9 5.912 0.272 -15.661
528 2HD1 LEU 9 2HD1 LEU 9 6.777 1.763 -15.357
529 3HD1 LEU 9 3HD1 LEU 9 7.550 0.478 -16.299
530 1HD2 LEU 9 1HD2 LEU 9 7.988 2.079 -13.506
531 2HD2 LEU 9 2HD2 LEU 9 8.792 0.806 -12.586
532 3HD2 LEU 9 3HD2 LEU 9 9.347 1.189 -14.220
533 H GLU 10 H GLU 10 5.384 -3.302 -11.370
534 HA GLU 10 HA GLU 10 3.735 -1.799 -9.425
535 1HB GLU 10 1HB GLU 10 3.577 -4.607 -10.583
536 2HB GLU 10 2HB GLU 10 2.704 -4.007 -9.194
537 1HG GLU 10 1HG GLU 10 2.460 -2.801 -11.970
538 2HG GLU 10 2HG GLU 10 1.316 -3.941 -11.255
539 H LEU 11 H LEU 11 6.213 -4.385 -9.656
540 HA LEU 11 HA LEU 11 6.036 -5.141 -6.888
541 1HB LEU 11 1HB LEU 11 7.706 -5.853 -9.161
542 2HB LEU 11 2HB LEU 11 8.767 -5.373 -7.841
543 HG LEU 11 HG LEU 11 7.385 -6.947 -6.330
544 1HD1 LEU 11 1HD1 LEU 11 5.467 -7.215 -7.950
545 2HD1 LEU 11 2HD1 LEU 11 6.576 -8.052 -9.056
546 3HD1 LEU 11 3HD1 LEU 11 6.193 -8.762 -7.477
547 1HD2 LEU 11 1HD2 LEU 11 9.092 -8.028 -8.611
548 2HD2 LEU 11 2HD2 LEU 11 9.650 -7.492 -7.009
549 3HD2 LEU 11 3HD2 LEU 11 8.646 -8.946 -7.156
550 H GLN 12 H GLN 12 7.928 -2.680 -8.615
551 HA GLN 12 HA GLN 12 9.509 -1.766 -6.516
552 1HB GLN 12 1HB GLN 12 9.924 0.139 -7.752
553 2HB GLN 12 2HB GLN 12 9.374 -0.975 -9.015
554 1HG GLN 12 1HG GLN 12 7.055 0.033 -8.638
555 2HG GLN 12 2HG GLN 12 7.807 1.275 -7.653
556 1HE2 GLN 12 2HE2 GLN 12 6.332 1.704 -10.074
557 2HE2 GLN 12 1HE2 GLN 12 7.437 2.532 -11.166
558 H LEU 13 H LEU 13 6.018 -1.370 -6.888
559 HA LEU 13 HA LEU 13 5.771 0.928 -5.147
560 1HB LEU 13 1HB LEU 13 3.619 -1.085 -5.904
561 2HB LEU 13 2HB LEU 13 3.386 0.559 -5.322
562 HG LEU 13 HG LEU 13 4.666 -0.169 -7.967
563 1HD1 LEU 13 1HD1 LEU 13 2.268 -0.931 -7.608
564 2HD1 LEU 13 2HD1 LEU 13 1.811 0.761 -7.482
565 3HD1 LEU 13 3HD1 LEU 13 2.521 0.124 -8.973
566 1HD2 LEU 13 1HD2 LEU 13 3.456 2.515 -7.586
567 2HD2 LEU 13 2HD2 LEU 13 4.891 2.238 -6.611
568 3HD2 LEU 13 3HD2 LEU 13 4.982 2.057 -8.345
569 H ILE 14 H ILE 14 5.023 -2.588 -4.946
570 HA ILE 14 HA ILE 14 4.307 -2.512 -2.160
571 HB ILE 14 HB ILE 14 5.142 -4.673 -4.123
572 1HG1 ILE 14 2HG1 ILE 14 2.841 -5.460 -3.604
573 2HG1 ILE 14 3HG1 ILE 14 2.623 -4.140 -2.460
574 1HG2 ILE 14 1HG2 ILE 14 6.117 -5.463 -2.024
575 2HG2 ILE 14 2HG2 ILE 14 4.618 -5.079 -1.145
576 3HG2 ILE 14 3HG2 ILE 14 4.642 -6.365 -2.366
577 1HD1 ILE 14 1HD1 ILE 14 2.589 -2.512 -4.229
578 2HD1 ILE 14 2HD1 ILE 14 3.186 -3.714 -5.408
579 3HD1 ILE 14 3HD1 ILE 14 1.565 -3.856 -4.707
580 H LYS 15 H LYS 15 7.439 -2.673 -3.769
581 HA LYS 15 HA LYS 15 8.962 -3.126 -1.369
582 1HB LYS 15 1HB LYS 15 9.439 -2.912 -4.190
583 2HB LYS 15 2HB LYS 15 10.277 -1.573 -3.480
584 1HG LYS 15 1HG LYS 15 11.855 -3.247 -3.522
585 2HG LYS 15 2HG LYS 15 11.323 -3.338 -1.842
586 1HD LYS 15 1HD LYS 15 10.204 -5.396 -2.189
587 2HD LYS 15 2HD LYS 15 9.893 -5.061 -3.898
588 1HE LYS 15 1HE LYS 15 12.363 -5.305 -4.366
589 2HE LYS 15 2HE LYS 15 12.584 -5.839 -2.688
590 1HZ LYS 15 1HZ LYS 15 11.027 -7.634 -3.201
591 2HZ LYS 15 2HZ LYS 15 10.936 -7.116 -4.764
592 3HZ LYS 15 3HZ LYS 15 12.365 -7.670 -4.165
593 H GLN 16 H GLN 16 8.088 -0.190 -3.270
594 HA GLN 16 HA GLN 16 9.489 1.643 -1.523
595 1HB GLN 16 1HB GLN 16 7.531 1.879 -3.804
596 2HB GLN 16 2HB GLN 16 7.716 3.269 -2.750
597 1HG GLN 16 1HG GLN 16 9.832 3.751 -3.352
598 2HG GLN 16 2HG GLN 16 10.297 2.059 -3.583
599 1HE2 GLN 16 2HE2 GLN 16 11.452 3.078 -5.445
600 2HE2 GLN 16 1HE2 GLN 16 10.558 3.157 -6.955
601 H TYR 17 H TYR 17 6.331 0.208 -1.501
602 HA TYR 17 HA TYR 17 5.102 2.010 0.280
603 1HB TYR 17 1HB TYR 17 4.587 -0.831 -0.698
604 2HB TYR 17 2HB TYR 17 3.695 -0.282 0.679
605 HD1 TYR 17 HD1 TYR 17 2.884 -0.884 -2.534
606 HD2 TYR 17 HD2 TYR 17 2.968 2.371 0.249
607 HE1 TYR 17 HE1 TYR 17 1.192 0.295 -3.867
608 HE2 TYR 17 HE2 TYR 17 1.104 3.455 -0.960
609 HH TYR 17 HH TYR 17 0.164 2.392 -4.197
610 H ARG 18 H ARG 18 7.293 -0.652 0.674
611 HA ARG 18 HA ARG 18 6.891 -0.894 3.573
612 1HB ARG 18 1HB ARG 18 8.923 -2.131 1.689
613 2HB ARG 18 2HB ARG 18 8.885 -2.393 3.437
614 1HG ARG 18 1HG ARG 18 6.616 -3.284 3.322
615 2HG ARG 18 2HG ARG 18 6.510 -2.938 1.604
616 1HD ARG 18 1HD ARG 18 7.397 -4.887 1.070
617 2HD ARG 18 2HD ARG 18 8.876 -4.539 1.990
618 HE ARG 18 HE ARG 18 6.938 -5.277 3.874
619 1HH1 ARG 18 1HH2 ARG 18 8.542 -6.753 1.112
620 2HH1 ARG 18 2HH2 ARG 18 8.410 -8.387 1.706
621 1HH2 ARG 18 1HH1 ARG 18 6.733 -7.383 4.682
622 2HH2 ARG 18 2HH1 ARG 18 7.352 -8.753 3.802
623 H GLU 19 H GLU 19 9.074 0.556 1.256
624 HA GLU 19 HA GLU 19 10.917 1.559 3.211
625 1HB GLU 19 1HB GLU 19 11.340 1.189 0.716
626 2HB GLU 19 2HB GLU 19 10.553 2.765 0.465
627 1HG GLU 19 1HG GLU 19 12.219 3.869 1.849
628 2HG GLU 19 2HG GLU 19 12.884 2.315 2.381
629 H ALA 20 H ALA 20 7.913 2.943 1.795
630 HA ALA 20 HA ALA 20 8.413 5.491 3.278
631 1HB ALA 20 1HB ALA 20 7.152 5.292 1.023
632 2HB ALA 20 2HB ALA 20 5.783 4.811 2.090
633 3HB ALA 20 3HB ALA 20 6.574 6.374 2.287
634 H LEU 21 H LEU 21 6.692 2.395 3.789
635 HA LEU 21 HA LEU 21 4.938 3.104 5.728
636 1HB LEU 21 1HB LEU 21 6.146 0.682 4.887
637 2HB LEU 21 2HB LEU 21 6.330 0.666 6.617
638 HG LEU 21 HG LEU 21 3.653 1.435 5.507
639 1HD1 LEU 21 1HD1 LEU 21 4.084 -0.393 4.038
640 2HD1 LEU 21 2HD1 LEU 21 4.659 -1.422 5.374
641 3HD1 LEU 21 3HD1 LEU 21 2.961 -0.934 5.274
642 1HD2 LEU 21 1HD2 LEU 21 4.416 -0.365 7.831
643 2HD2 LEU 21 2HD2 LEU 21 3.935 1.348 7.945
644 3HD2 LEU 21 3HD2 LEU 21 2.776 0.134 7.389
645 H GLU 22 H GLU 22 8.404 2.862 6.210
646 HA GLU 22 HA GLU 22 8.382 3.008 9.067
647 1HB GLU 22 1HB GLU 22 10.766 3.873 8.754
648 2HB GLU 22 2HB GLU 22 10.396 2.230 8.215
649 1HG GLU 22 1HG GLU 22 10.413 2.793 5.957
650 2HG GLU 22 2HG GLU 22 10.266 4.540 6.266
651 H TYR 23 H TYR 23 8.165 5.394 6.527
652 HA TYR 23 HA TYR 23 8.480 7.746 8.272
653 1HB TYR 23 1HB TYR 23 8.534 7.142 5.356
654 2HB TYR 23 2HB TYR 23 7.706 8.608 5.793
655 HD1 TYR 23 HD1 TYR 23 10.839 6.799 6.848
656 HD2 TYR 23 HD2 TYR 23 9.033 10.560 5.753
657 HE1 TYR 23 HE1 TYR 23 12.986 7.940 7.244
658 HE2 TYR 23 HE2 TYR 23 11.196 11.704 6.150
659 HH TYR 23 HH TYR 23 14.074 9.958 7.333
660 H VAL 24 H VAL 24 5.995 5.857 6.625
661 HA VAL 24 HA VAL 24 3.910 7.870 6.908
662 HB VAL 24 HB VAL 24 3.779 4.916 6.318
663 1HG1 VAL 24 1HG1 VAL 24 1.602 5.303 6.753
664 2HG1 VAL 24 2HG1 VAL 24 1.666 7.044 6.395
665 3HG1 VAL 24 3HG1 VAL 24 1.544 5.858 5.091
666 1HG2 VAL 24 1HG2 VAL 24 3.290 6.557 3.995
667 2HG2 VAL 24 2HG2 VAL 24 4.873 6.961 4.695
668 3HG2 VAL 24 3HG2 VAL 24 4.486 5.301 4.241
669 H LYS 25 H LYS 25 4.809 4.882 8.605
670 HA LYS 25 HA LYS 25 4.272 3.989 10.602
671 1HB LYS 25 1HB LYS 25 3.554 6.836 11.367
672 2HB LYS 25 2HB LYS 25 3.967 5.544 12.480
673 1HG LYS 25 1HG LYS 25 6.245 5.700 12.072
674 2HG LYS 25 2HG LYS 25 6.025 6.106 10.380
675 1HD LYS 25 1HD LYS 25 5.132 8.376 11.112
676 2HD LYS 25 2HD LYS 25 5.761 8.027 12.733
677 1HE LYS 25 1HE LYS 25 7.484 7.774 10.236
678 2HE LYS 25 2HE LYS 25 7.201 9.360 10.935
679 1HZ LYS 25 1HZ LYS 25 8.288 8.695 12.872
680 2HZ LYS 25 2HZ LYS 25 8.302 7.096 12.443
681 3HZ LYS 25 3HZ LYS 25 9.225 8.181 11.619
682 H LEU 26 H LEU 26 2.309 3.449 8.815
683 HA LEU 26 HA LEU 26 -0.138 3.618 10.458
684 1HB LEU 26 1HB LEU 26 0.292 5.376 8.433
685 2HB LEU 26 2HB LEU 26 -0.514 4.111 7.521
686 HG LEU 26 HG LEU 26 -1.857 4.886 10.094
687 1HD1 LEU 26 1HD1 LEU 26 -0.841 7.043 9.490
688 2HD1 LEU 26 2HD1 LEU 26 -1.578 6.943 7.874
689 3HD1 LEU 26 3HD1 LEU 26 -2.602 7.070 9.323
690 1HD2 LEU 26 1HD2 LEU 26 -2.769 4.750 7.185
691 2HD2 LEU 26 2HD2 LEU 26 -2.994 3.503 8.442
692 3HD2 LEU 26 3HD2 LEU 26 -3.824 5.065 8.576
693 HA PRO 27 HA PRO 27 0.057 -0.643 9.215
694 1HB PRO 27 1HB PRO 27 -2.264 -1.631 10.265
695 2HB PRO 27 2HB PRO 27 -0.872 -1.132 11.265
696 1HG PRO 27 1HG PRO 27 -3.380 0.449 10.650
697 2HG PRO 27 2HG PRO 27 -2.565 0.242 12.225
698 1HD PRO 27 1HD PRO 27 -2.198 2.456 10.636
699 2HD PRO 27 2HD PRO 27 -0.896 1.809 11.679
700 H VAL 28 H VAL 28 -2.922 1.223 8.523
701 HA VAL 28 HA VAL 28 -4.150 -0.322 6.572
702 HB VAL 28 HB VAL 28 -3.719 2.641 6.512
703 1HG1 VAL 28 1HG1 VAL 28 -4.385 1.941 4.314
704 2HG1 VAL 28 2HG1 VAL 28 -5.717 0.959 4.969
705 3HG1 VAL 28 3HG1 VAL 28 -5.750 2.733 5.083
706 1HG2 VAL 28 1HG2 VAL 28 -6.087 1.006 7.524
707 2HG2 VAL 28 2HG2 VAL 28 -4.984 1.971 8.540
708 3HG2 VAL 28 3HG2 VAL 28 -6.059 2.772 7.384
709 H LEU 29 H LEU 29 -1.046 1.416 6.360
710 HA LEU 29 HA LEU 29 -0.935 1.468 3.544
711 1HB LEU 29 1HB LEU 29 0.667 2.401 5.634
712 2HB LEU 29 2HB LEU 29 1.663 1.141 4.893
713 HG LEU 29 HG LEU 29 0.380 3.556 3.574
714 1HD1 LEU 29 1HD1 LEU 29 2.497 3.723 5.021
715 2HD1 LEU 29 2HD1 LEU 29 3.347 2.867 3.731
716 3HD1 LEU 29 3HD1 LEU 29 2.558 4.414 3.373
717 1HD2 LEU 29 1HD2 LEU 29 2.229 1.531 2.241
718 2HD2 LEU 29 2HD2 LEU 29 0.487 1.607 1.917
719 3HD2 LEU 29 3HD2 LEU 29 1.474 3.015 1.565
720 H ALA 30 H ALA 30 0.218 -0.961 5.954
721 HA ALA 30 HA ALA 30 1.479 -2.665 3.899
722 1HB ALA 30 1HB ALA 30 2.033 -2.706 6.417
723 2HB ALA 30 2HB ALA 30 0.458 -3.491 6.659
724 3HB ALA 30 3HB ALA 30 1.702 -4.278 5.664
725 H LYS 31 H LYS 31 -1.784 -2.159 5.147
726 HA LYS 31 HA LYS 31 -2.713 -4.702 4.042
727 1HB LYS 31 1HB LYS 31 -3.641 -2.994 5.974
728 2HB LYS 31 2HB LYS 31 -4.669 -2.499 4.620
729 1HG LYS 31 1HG LYS 31 -5.425 -4.823 4.340
730 2HG LYS 31 2HG LYS 31 -4.248 -5.390 5.549
731 1HD LYS 31 1HD LYS 31 -5.337 -3.988 7.287
732 2HD LYS 31 2HD LYS 31 -6.539 -3.461 6.101
733 1HE LYS 31 1HE LYS 31 -7.801 -5.253 6.609
734 2HE LYS 31 2HE LYS 31 -6.559 -6.310 5.934
735 1HZ LYS 31 1HZ LYS 31 -5.999 -6.966 7.936
736 2HZ LYS 31 2HZ LYS 31 -5.951 -5.448 8.574
737 3HZ LYS 31 3HZ LYS 31 -7.380 -6.257 8.481
738 H ILE 32 H ILE 32 -2.850 -1.341 3.085
739 HA ILE 32 HA ILE 32 -4.204 -1.572 0.588
740 HB ILE 32 HB ILE 32 -2.146 0.389 1.709
741 1HG1 ILE 32 2HG1 ILE 32 -5.093 0.601 0.933
742 2HG1 ILE 32 3HG1 ILE 32 -4.466 0.439 2.558
743 1HG2 ILE 32 1HG2 ILE 32 -1.585 0.376 -0.613
744 2HG2 ILE 32 2HG2 ILE 32 -3.287 0.254 -1.073
745 3HG2 ILE 32 3HG2 ILE 32 -2.630 1.766 -0.407
746 1HD1 ILE 32 1HD1 ILE 32 -3.241 2.649 2.224
747 2HD1 ILE 32 2HD1 ILE 32 -4.141 2.837 0.698
748 3HD1 ILE 32 3HD1 ILE 32 -5.015 2.749 2.219
749 H LEU 33 H LEU 33 -0.698 -1.722 1.455
750 HA LEU 33 HA LEU 33 -0.037 -1.949 -1.157
751 1HB LEU 33 1HB LEU 33 2.223 -2.303 -0.546
752 2HB LEU 33 2HB LEU 33 1.451 -1.308 0.701
753 HG LEU 33 HG LEU 33 1.173 -3.388 1.999
754 1HD1 LEU 33 1HD1 LEU 33 1.610 -5.375 1.145
755 2HD1 LEU 33 2HD1 LEU 33 2.337 -4.663 -0.308
756 3HD1 LEU 33 3HD1 LEU 33 3.320 -4.956 1.140
757 1HD2 LEU 33 1HD2 LEU 33 3.970 -2.472 1.303
758 2HD2 LEU 33 2HD2 LEU 33 2.841 -1.628 2.390
759 3HD2 LEU 33 3HD2 LEU 33 3.474 -3.220 2.852
760 H GLU 34 H GLU 34 -0.827 -4.398 1.260
761 HA GLU 34 HA GLU 34 -0.044 -6.755 -0.075
762 1HB GLU 34 1HB GLU 34 -0.784 -6.369 2.360
763 2HB GLU 34 2HB GLU 34 -2.436 -6.520 1.802
764 1HG GLU 34 1HG GLU 34 -1.994 -8.812 1.054
765 2HG GLU 34 2HG GLU 34 -0.251 -8.600 1.291
766 H ASP 35 H ASP 35 -3.087 -5.003 0.046
767 HA ASP 35 HA ASP 35 -4.690 -6.575 -1.646
768 1HB ASP 35 1HB ASP 35 -5.154 -4.323 -0.303
769 2HB ASP 35 2HB ASP 35 -4.774 -3.558 -1.846
770 H GLU 36 H GLU 36 -2.484 -3.867 -2.500
771 HA GLU 36 HA GLU 36 -2.744 -4.134 -5.295
772 1HB GLU 36 1HB GLU 36 -0.307 -3.142 -3.771
773 2HB GLU 36 2HB GLU 36 -0.656 -2.913 -5.485
774 1HG GLU 36 1HG GLU 36 -2.980 -1.959 -4.177
775 2HG GLU 36 2HG GLU 36 -1.677 -1.470 -3.097
776 H GLU 37 H GLU 37 -0.256 -5.643 -3.172
777 HA GLU 37 HA GLU 37 1.194 -7.087 -4.948
778 1HB GLU 37 1HB GLU 37 0.866 -7.002 -2.220
779 2HB GLU 37 2HB GLU 37 0.293 -8.634 -2.547
780 1HG GLU 37 1HG GLU 37 2.922 -7.642 -3.714
781 2HG GLU 37 2HG GLU 37 2.787 -8.028 -2.002
782 H LYS 38 H LYS 38 -2.105 -7.933 -3.882
783 HA LYS 38 HA LYS 38 -2.091 -10.432 -5.361
784 1HB LYS 38 1HB LYS 38 -3.418 -9.915 -3.331
785 2HB LYS 38 2HB LYS 38 -4.408 -8.791 -4.267
786 1HG LYS 38 1HG LYS 38 -5.451 -10.513 -5.528
787 2HG LYS 38 2HG LYS 38 -4.018 -11.525 -5.484
788 1HD LYS 38 1HD LYS 38 -5.209 -12.838 -4.170
789 2HD LYS 38 2HD LYS 38 -4.618 -11.775 -2.891
790 1HE LYS 38 1HE LYS 38 -6.735 -10.476 -2.999
791 2HE LYS 38 2HE LYS 38 -7.298 -11.478 -4.351
792 1HZ LYS 38 1HZ LYS 38 -7.321 -13.358 -2.968
793 2HZ LYS 38 2HZ LYS 38 -6.641 -12.548 -1.706
794 3HZ LYS 38 3HZ LYS 38 -8.167 -12.169 -2.203
795 H HIS 39 H HIS 39 -3.469 -7.193 -6.012
796 HA HIS 39 HA HIS 39 -4.639 -7.820 -8.545
797 1HB HIS 39 1HB HIS 39 -3.590 -5.351 -7.188
798 2HB HIS 39 2HB HIS 39 -3.917 -5.273 -8.912
799 HD1 HIS 39 HD1 HIS 39 -6.529 -6.156 -9.565
800 HD2 HIS 39 HD2 HIS 39 -5.693 -4.977 -5.614
801 HE1 HIS 39 HE1 HIS 39 -8.800 -5.746 -8.443
802 HE2 HIS 39 HE2 HIS 39 -8.277 -5.036 -6.026
803 H ILE 40 H ILE 40 -1.312 -7.156 -7.602
804 HA ILE 40 HA ILE 40 -0.257 -7.109 -10.315
805 HB ILE 40 HB ILE 40 1.123 -7.439 -7.624
806 1HG1 ILE 40 2HG1 ILE 40 0.871 -4.945 -9.318
807 2HG1 ILE 40 3HG1 ILE 40 -0.315 -5.258 -8.113
808 1HG2 ILE 40 1HG2 ILE 40 2.588 -8.178 -9.451
809 2HG2 ILE 40 2HG2 ILE 40 2.179 -6.742 -10.407
810 3HG2 ILE 40 3HG2 ILE 40 3.136 -6.592 -8.926
811 1HD1 ILE 40 1HD1 ILE 40 1.228 -5.369 -6.309
812 2HD1 ILE 40 2HD1 ILE 40 2.624 -5.142 -7.346
813 3HD1 ILE 40 3HD1 ILE 40 1.429 -3.833 -7.162
814 H GLU 41 H GLU 41 -0.529 -9.490 -7.646
815 HA GLU 41 HA GLU 41 0.953 -11.551 -8.733
816 1HB GLU 41 1HB GLU 41 -0.162 -11.518 -6.476
817 2HB GLU 41 2HB GLU 41 -1.683 -11.947 -7.286
818 1HG GLU 41 1HG GLU 41 0.358 -13.759 -8.216
819 2HG GLU 41 2HG GLU 41 0.518 -13.625 -6.465
820 H TRP 42 H TRP 42 -2.399 -10.522 -9.616
821 HA TRP 42 HA TRP 42 -3.088 -12.619 -11.246
822 1HB TRP 42 1HB TRP 42 -4.323 -10.447 -10.611
823 2HB TRP 42 2HB TRP 42 -3.601 -9.766 -12.051
824 HD1 TRP 42 HD1 TRP 42 -5.920 -12.623 -11.036
825 HE1 TRP 42 HE1 TRP 42 -6.768 -13.826 -13.435
826 HE3 TRP 42 HE3 TRP 42 -3.491 -10.028 -14.566
827 HZ2 TRP 42 HZ2 TRP 42 -7.135 -13.147 -15.924
828 HZ3 TRP 42 HZ3 TRP 42 -4.008 -10.390 -17.017
829 HH2 TRP 42 HH2 TRP 42 -5.820 -11.976 -17.684
830 H LEU 43 H LEU 43 -0.855 -9.987 -11.928
831 HA LEU 43 HA LEU 43 -0.408 -10.719 -14.736
832 1HB LEU 43 1HB LEU 43 1.139 -8.820 -12.929
833 2HB LEU 43 2HB LEU 43 1.461 -9.148 -14.625
834 HG LEU 43 HG LEU 43 -1.275 -8.551 -14.666
835 1HD1 LEU 43 1HD1 LEU 43 -1.290 -7.696 -12.383
836 2HD1 LEU 43 2HD1 LEU 43 0.132 -6.690 -12.696
837 3HD1 LEU 43 3HD1 LEU 43 -1.395 -6.331 -13.508
838 1HD2 LEU 43 1HD2 LEU 43 1.173 -6.844 -15.150
839 2HD2 LEU 43 2HD2 LEU 43 0.318 -7.834 -16.345
840 3HD2 LEU 43 3HD2 LEU 43 -0.478 -6.398 -15.676
841 H GLU 44 H GLU 44 1.200 -11.342 -11.590
842 HA GLU 44 HA GLU 44 3.255 -13.038 -12.875
843 1HB GLU 44 1HB GLU 44 2.640 -12.184 -10.048
844 2HB GLU 44 2HB GLU 44 3.483 -13.694 -10.256
845 1HG GLU 44 1HG GLU 44 4.982 -12.090 -11.914
846 2HG GLU 44 2HG GLU 44 4.479 -10.986 -10.615
847 H THR 45 H THR 45 0.351 -13.730 -13.347
848 HA THR 45 HA THR 45 0.803 -16.597 -12.798
849 HB THR 45 HB THR 45 -0.440 -15.313 -10.862
850 HG1 THR 45 HG1 THR 45 -0.080 -17.495 -10.839
851 1HG2 THR 45 1HG2 THR 45 -2.214 -14.363 -12.172
852 2HG2 THR 45 2HG2 THR 45 -2.851 -15.984 -12.521
853 3HG2 THR 45 3HG2 THR 45 -2.785 -15.370 -10.849
854 H ILE 46 H ILE 46 -1.329 -14.158 -14.068
855 HA ILE 46 HA ILE 46 -2.815 -14.135 -15.761
856 HB ILE 46 HB ILE 46 -0.773 -13.289 -16.636
857 1HG1 ILE 46 2HG1 ILE 46 -1.022 -13.509 -19.023
858 2HG1 ILE 46 3HG1 ILE 46 -2.067 -14.916 -18.861
859 1HG2 ILE 46 1HG2 ILE 46 0.818 -15.026 -16.315
860 2HG2 ILE 46 2HG2 ILE 46 -0.020 -16.105 -17.456
861 3HG2 ILE 46 3HG2 ILE 46 0.787 -14.630 -18.028
862 1HD1 ILE 46 1HD1 ILE 46 -3.751 -13.551 -17.698
863 2HD1 ILE 46 2HD1 ILE 46 -2.624 -12.166 -17.694
864 3HD1 ILE 46 3HD1 ILE 46 -3.300 -12.768 -19.223
865 H LEU 47 H LEU 47 -3.560 -16.196 -14.450
866 HA LEU 47 HA LEU 47 -3.677 -18.569 -16.225
867 1HB LEU 47 1HB LEU 47 -3.003 -18.236 -13.545
868 2HB LEU 47 2HB LEU 47 -4.632 -18.865 -13.419
869 HG LEU 47 HG LEU 47 -2.702 -20.212 -15.336
870 1HD1 LEU 47 1HD1 LEU 47 -1.297 -19.802 -13.408
871 2HD1 LEU 47 2HD1 LEU 47 -2.508 -20.522 -12.328
872 3HD1 LEU 47 3HD1 LEU 47 -1.690 -21.523 -13.554
873 1HD2 LEU 47 1HD2 LEU 47 -4.374 -21.712 -13.358
874 2HD2 LEU 47 2HD2 LEU 47 -5.252 -20.840 -14.630
875 3HD2 LEU 47 3HD2 LEU 47 -4.037 -22.055 -15.065
876 H GLY 48 H GLY 48 -5.171 -17.726 -17.653
877 1HA GLY 48 1HA GLY 48 -7.997 -17.727 -16.701
878 2HA GLY 48 2HA GLY 48 -7.390 -16.405 -17.723
879 1HN NH2 49 1HN NH2 49 -9.462 -17.842 -18.743
880 2HN NH2 49 2HN NH2 49 -8.895 -18.940 -20.029
Start of MODEL 6
1 1H ACE 0 H1 ACE 0 2.350 -16.481 2.205
2 2H ACE 0 H2 ACE 0 3.834 -17.310 1.681
3 3H ACE 0 H3 ACE 0 2.534 -16.985 0.513
4 H ASP 1 H ASP 1 5.054 -15.548 2.477
5 HA ASP 1 HA ASP 1 4.848 -12.964 2.657
6 1HB ASP 1 1HB ASP 1 6.832 -14.290 3.273
7 2HB ASP 1 2HB ASP 1 7.324 -14.399 1.579
8 H TYR 2 H TYR 2 6.319 -14.238 -0.334
9 HA TYR 2 HA TYR 2 6.669 -11.798 -1.639
10 1HB TYR 2 1HB TYR 2 6.323 -14.660 -2.602
11 2HB TYR 2 2HB TYR 2 6.686 -13.320 -3.660
12 HD1 TYR 2 HD1 TYR 2 8.515 -12.721 -0.628
13 HD2 TYR 2 HD2 TYR 2 8.499 -14.836 -4.356
14 HE1 TYR 2 HE1 TYR 2 10.839 -13.482 -0.195
15 HE2 TYR 2 HE2 TYR 2 10.896 -15.453 -4.019
16 HH TYR 2 HH TYR 2 12.760 -14.981 -2.732
17 H LEU 3 H LEU 3 3.668 -13.580 -1.351
18 HA LEU 3 HA LEU 3 2.486 -11.743 -3.321
19 1HB LEU 3 1HB LEU 3 1.552 -14.564 -2.626
20 2HB LEU 3 2HB LEU 3 0.816 -13.525 -3.850
21 HG LEU 3 HG LEU 3 3.685 -14.563 -4.036
22 1HD1 LEU 3 1HD1 LEU 3 2.121 -16.454 -4.014
23 2HD1 LEU 3 2HD1 LEU 3 1.152 -15.687 -5.293
24 3HD1 LEU 3 3HD1 LEU 3 2.813 -16.220 -5.629
25 1HD2 LEU 3 1HD2 LEU 3 1.849 -13.482 -6.219
26 2HD2 LEU 3 2HD2 LEU 3 3.092 -12.509 -5.407
27 3HD2 LEU 3 3HD2 LEU 3 3.560 -13.922 -6.362
28 H ARG 4 H ARG 4 2.216 -13.080 -0.111
29 HA ARG 4 HA ARG 4 -0.259 -11.776 0.511
30 1HB ARG 4 1HB ARG 4 2.241 -12.217 2.175
31 2HB ARG 4 2HB ARG 4 0.711 -11.623 2.826
32 1HG ARG 4 1HG ARG 4 1.037 -14.326 1.423
33 2HG ARG 4 2HG ARG 4 1.131 -14.070 3.165
34 1HD ARG 4 1HD ARG 4 -1.073 -14.794 2.882
35 2HD ARG 4 2HD ARG 4 -1.233 -13.047 2.988
36 HE ARG 4 HE ARG 4 -1.997 -12.979 0.824
37 1HH1 ARG 4 1HH2 ARG 4 -0.427 -16.095 1.320
38 2HH1 ARG 4 2HH2 ARG 4 -1.025 -16.800 -0.157
39 1HH2 ARG 4 1HH1 ARG 4 -2.750 -13.853 -1.139
40 2HH2 ARG 4 2HH1 ARG 4 -2.365 -15.487 -1.589
41 H GLU 5 H GLU 5 3.062 -10.556 0.036
42 HA GLU 5 HA GLU 5 2.117 -7.877 0.938
43 1HB GLU 5 1HB GLU 5 4.955 -8.755 0.314
44 2HB GLU 5 2HB GLU 5 4.402 -7.180 0.892
45 1HG GLU 5 1HG GLU 5 3.255 -8.535 2.829
46 2HG GLU 5 2HG GLU 5 4.355 -9.840 2.353
47 H LEU 6 H LEU 6 2.981 -9.586 -2.022
48 HA LEU 6 HA LEU 6 2.588 -7.025 -3.537
49 1HB LEU 6 1HB LEU 6 4.161 -9.443 -4.431
50 2HB LEU 6 2HB LEU 6 3.967 -7.889 -5.214
51 HG LEU 6 HG LEU 6 5.104 -6.923 -2.951
52 1HD1 LEU 6 1HD1 LEU 6 5.135 -9.362 -1.942
53 2HD1 LEU 6 2HD1 LEU 6 6.451 -9.620 -3.087
54 3HD1 LEU 6 3HD1 LEU 6 6.565 -8.353 -1.840
55 1HD2 LEU 6 1HD2 LEU 6 6.605 -8.349 -5.142
56 2HD2 LEU 6 2HD2 LEU 6 5.864 -6.741 -5.250
57 3HD2 LEU 6 3HD2 LEU 6 7.149 -7.004 -4.079
58 H LEU 7 H LEU 7 0.412 -8.820 -2.585
59 HA LEU 7 HA LEU 7 -0.907 -8.784 -5.088
60 1HB LEU 7 1HB LEU 7 0.241 -11.077 -5.147
61 2HB LEU 7 2HB LEU 7 -0.748 -11.538 -3.761
62 HG LEU 7 HG LEU 7 -2.806 -11.234 -5.007
63 1HD1 LEU 7 1HD1 LEU 7 -2.680 -9.751 -6.731
64 2HD1 LEU 7 2HD1 LEU 7 -0.940 -9.976 -6.941
65 3HD1 LEU 7 3HD1 LEU 7 -2.051 -11.109 -7.671
66 1HD2 LEU 7 1HD2 LEU 7 -0.632 -12.993 -6.192
67 2HD2 LEU 7 2HD2 LEU 7 -1.691 -13.388 -4.842
68 3HD2 LEU 7 3HD2 LEU 7 -2.373 -13.238 -6.457
69 H LYS 8 H LYS 8 -1.165 -10.321 -1.851
70 HA LYS 8 HA LYS 8 -3.920 -9.848 -1.729
71 1HB LYS 8 1HB LYS 8 -2.657 -11.520 -0.364
72 2HB LYS 8 2HB LYS 8 -2.095 -10.181 0.665
73 1HG LYS 8 1HG LYS 8 -4.512 -9.568 1.051
74 2HG LYS 8 2HG LYS 8 -4.980 -11.045 0.187
75 1HD LYS 8 1HD LYS 8 -3.878 -12.436 1.856
76 2HD LYS 8 2HD LYS 8 -3.136 -11.020 2.624
77 1HE LYS 8 1HE LYS 8 -4.960 -10.585 3.872
78 2HE LYS 8 2HE LYS 8 -6.039 -10.650 2.475
79 1HZ LYS 8 1HZ LYS 8 -6.109 -13.007 2.671
80 2HZ LYS 8 2HZ LYS 8 -5.095 -12.983 3.972
81 3HZ LYS 8 3HZ LYS 8 -6.589 -12.293 4.076
82 H LEU 9 H LEU 9 -1.138 -8.005 -0.482
83 HA LEU 9 HA LEU 9 -2.689 -5.786 0.553
84 1HB LEU 9 1HB LEU 9 0.160 -5.918 -0.488
85 2HB LEU 9 2HB LEU 9 -0.567 -4.462 0.181
86 HG LEU 9 HG LEU 9 -0.112 -7.054 1.710
87 1HD1 LEU 9 1HD1 LEU 9 1.932 -5.621 1.161
88 2HD1 LEU 9 2HD1 LEU 9 1.175 -4.314 2.076
89 3HD1 LEU 9 3HD1 LEU 9 1.610 -5.833 2.889
90 1HD2 LEU 9 1HD2 LEU 9 -1.293 -4.383 2.594
91 2HD2 LEU 9 2HD2 LEU 9 -2.085 -5.976 2.657
92 3HD2 LEU 9 3HD2 LEU 9 -0.712 -5.634 3.710
93 H GLU 10 H GLU 10 -1.190 -6.490 -2.668
94 HA GLU 10 HA GLU 10 -1.840 -4.105 -3.877
95 1HB GLU 10 1HB GLU 10 -1.932 -6.791 -5.230
96 2HB GLU 10 2HB GLU 10 -1.822 -5.196 -5.941
97 1HG GLU 10 1HG GLU 10 0.320 -6.442 -4.225
98 2HG GLU 10 2HG GLU 10 0.385 -6.264 -5.978
99 H LEU 11 H LEU 11 -3.951 -6.927 -3.427
100 HA LEU 11 HA LEU 11 -6.199 -5.949 -4.924
101 1HB LEU 11 1HB LEU 11 -5.809 -7.880 -2.629
102 2HB LEU 11 2HB LEU 11 -7.449 -7.363 -2.996
103 HG LEU 11 HG LEU 11 -5.687 -8.348 -5.249
104 1HD1 LEU 11 1HD1 LEU 11 -5.454 -10.096 -3.579
105 2HD1 LEU 11 2HD1 LEU 11 -7.206 -10.104 -3.273
106 3HD1 LEU 11 3HD1 LEU 11 -6.566 -10.647 -4.841
107 1HD2 LEU 11 1HD2 LEU 11 -8.688 -8.554 -4.673
108 2HD2 LEU 11 2HD2 LEU 11 -7.942 -7.313 -5.699
109 3HD2 LEU 11 3HD2 LEU 11 -7.871 -9.018 -6.179
110 H GLN 12 H GLN 12 -5.307 -5.419 -1.470
111 HA GLN 12 HA GLN 12 -7.576 -3.868 -0.838
112 1HB GLN 12 1HB GLN 12 -5.897 -4.957 0.735
113 2HB GLN 12 2HB GLN 12 -4.742 -3.694 0.315
114 1HG GLN 12 1HG GLN 12 -7.289 -2.510 1.136
115 2HG GLN 12 2HG GLN 12 -6.699 -3.674 2.321
116 1HE2 GLN 12 2HE2 GLN 12 -5.380 -0.977 0.269
117 2HE2 GLN 12 1HE2 GLN 12 -4.292 -0.402 1.527
118 H LEU 13 H LEU 13 -4.725 -3.021 -2.728
119 HA LEU 13 HA LEU 13 -4.963 -0.147 -2.278
120 1HB LEU 13 1HB LEU 13 -3.621 -1.583 -4.580
121 2HB LEU 13 2HB LEU 13 -3.359 0.074 -4.058
122 HG LEU 13 HG LEU 13 -2.734 -2.330 -2.302
123 1HD1 LEU 13 1HD1 LEU 13 -1.557 -2.170 -4.619
124 2HD1 LEU 13 2HD1 LEU 13 -0.817 -0.753 -3.958
125 3HD1 LEU 13 3HD1 LEU 13 -0.575 -2.337 -3.159
126 1HD2 LEU 13 1HD2 LEU 13 -1.736 0.544 -2.141
127 2HD2 LEU 13 2HD2 LEU 13 -3.065 -0.090 -1.156
128 3HD2 LEU 13 3HD2 LEU 13 -1.462 -0.772 -0.969
129 H ILE 14 H ILE 14 -5.645 -2.453 -4.947
130 HA ILE 14 HA ILE 14 -6.952 -0.589 -6.670
131 HB ILE 14 HB ILE 14 -7.425 -3.601 -6.217
132 1HG1 ILE 14 1HG1 ILE 14 -5.144 -3.311 -6.791
133 2HG1 ILE 14 2HG1 ILE 14 -5.964 -3.828 -8.249
134 1HG2 ILE 14 1HG2 ILE 14 -9.322 -2.706 -7.453
135 2HG2 ILE 14 2HG2 ILE 14 -8.256 -1.823 -8.555
136 3HG2 ILE 14 3HG2 ILE 14 -8.283 -3.595 -8.567
137 1HD1 ILE 14 1HD1 ILE 14 -6.086 -1.310 -8.877
138 2HD1 ILE 14 2HD1 ILE 14 -4.946 -1.054 -7.532
139 3HD1 ILE 14 3HD1 ILE 14 -4.493 -2.074 -8.901
140 H LYS 15 H LYS 15 -8.212 -2.647 -4.166
141 HA LYS 15 HA LYS 15 -10.897 -1.746 -4.195
142 1HB LYS 15 1HB LYS 15 -9.553 -3.608 -2.737
143 2HB LYS 15 2HB LYS 15 -9.648 -2.345 -1.528
144 1HG LYS 15 1HG LYS 15 -11.466 -3.886 -1.270
145 2HG LYS 15 2HG LYS 15 -12.172 -2.368 -1.847
146 1HD LYS 15 1HD LYS 15 -12.577 -3.255 -4.021
147 2HD LYS 15 2HD LYS 15 -11.368 -4.539 -3.833
148 1HE LYS 15 1HE LYS 15 -12.767 -5.753 -2.275
149 2HE LYS 15 2HE LYS 15 -13.948 -4.428 -2.211
150 1HZ LYS 15 1HZ LYS 15 -14.441 -4.812 -4.495
151 2HZ LYS 15 2HZ LYS 15 -13.300 -5.998 -4.610
152 3HZ LYS 15 3HZ LYS 15 -14.623 -6.216 -3.653
153 H GLN 16 H GLN 16 -8.156 -0.450 -2.224
154 HA GLN 16 HA GLN 16 -9.723 1.640 -1.010
155 1HB GLN 16 1HB GLN 16 -6.742 1.167 -1.380
156 2HB GLN 16 2HB GLN 16 -7.322 2.702 -0.749
157 1HG GLN 16 1HG GLN 16 -8.045 0.025 0.503
158 2HG GLN 16 2HG GLN 16 -6.721 1.067 1.048
159 1HE2 GLN 16 2HE2 GLN 16 -7.429 3.463 1.506
160 2HE2 GLN 16 1HE2 GLN 16 -8.980 3.628 2.307
161 H TYR 17 H TYR 17 -8.034 1.411 -4.068
162 HA TYR 17 HA TYR 17 -7.974 4.234 -4.639
163 1HB TYR 17 1HB TYR 17 -7.341 1.667 -6.026
164 2HB TYR 17 2HB TYR 17 -8.060 2.840 -7.058
165 HD1 TYR 17 HD1 TYR 17 -7.026 4.930 -7.693
166 HD2 TYR 17 HD2 TYR 17 -5.031 1.992 -5.252
167 HE1 TYR 17 HE1 TYR 17 -4.824 5.909 -8.301
168 HE2 TYR 17 HE2 TYR 17 -2.865 2.860 -5.980
169 HH TYR 17 HH TYR 17 -1.743 4.527 -7.119
170 H ARG 18 H ARG 18 -10.378 1.687 -4.878
171 HA ARG 18 HA ARG 18 -12.115 3.274 -6.659
172 1HB ARG 18 1HB ARG 18 -12.688 0.670 -5.208
173 2HB ARG 18 2HB ARG 18 -13.816 1.545 -6.256
174 1HG ARG 18 1HG ARG 18 -12.059 1.434 -8.102
175 2HG ARG 18 2HG ARG 18 -11.141 0.358 -7.055
176 1HD ARG 18 1HD ARG 18 -12.296 -1.083 -8.454
177 2HD ARG 18 2HD ARG 18 -13.303 -1.101 -6.987
178 HE ARG 18 HE ARG 18 -14.341 0.953 -8.543
179 1HH1 ARG 18 1HH2 ARG 18 -13.826 -2.502 -8.977
180 2HH1 ARG 18 2HH2 ARG 18 -14.949 -2.669 -10.298
181 1HH2 ARG 18 1HH1 ARG 18 -15.800 0.787 -10.285
182 2HH2 ARG 18 2HH1 ARG 18 -16.116 -0.746 -11.048
183 H GLU 19 H GLU 19 -11.815 2.346 -3.295
184 HA GLU 19 HA GLU 19 -14.059 3.733 -2.278
185 1HB GLU 19 1HB GLU 19 -12.458 2.159 -1.000
186 2HB GLU 19 2HB GLU 19 -11.430 3.590 -0.792
187 1HG GLU 19 1HG GLU 19 -13.403 4.782 0.232
188 2HG GLU 19 2HG GLU 19 -14.326 3.277 0.100
189 H ALA 20 H ALA 20 -10.690 4.935 -2.878
190 HA ALA 20 HA ALA 20 -11.519 7.591 -1.875
191 1HB ALA 20 1HB ALA 20 -9.304 6.700 -1.373
192 2HB ALA 20 2HB ALA 20 -8.904 6.718 -3.103
193 3HB ALA 20 3HB ALA 20 -9.262 8.245 -2.233
194 H LEU 21 H LEU 21 -11.089 6.094 -5.073
195 HA LEU 21 HA LEU 21 -11.085 8.204 -6.817
196 1HB LEU 21 1HB LEU 21 -11.095 6.058 -7.725
197 2HB LEU 21 2HB LEU 21 -12.479 5.557 -6.755
198 HG LEU 21 HG LEU 21 -14.016 6.870 -8.170
199 1HD1 LEU 21 1HD1 LEU 21 -12.353 8.554 -9.051
200 2HD1 LEU 21 2HD1 LEU 21 -11.584 7.247 -9.966
201 3HD1 LEU 21 3HD1 LEU 21 -13.252 7.721 -10.330
202 1HD2 LEU 21 1HD2 LEU 21 -12.228 4.807 -9.488
203 2HD2 LEU 21 2HD2 LEU 21 -13.672 4.499 -8.512
204 3HD2 LEU 21 3HD2 LEU 21 -13.834 5.297 -10.086
205 H GLU 22 H GLU 22 -14.004 7.025 -5.087
206 HA GLU 22 HA GLU 22 -15.779 8.865 -6.448
207 1HB GLU 22 1HB GLU 22 -17.389 8.273 -4.622
208 2HB GLU 22 2HB GLU 22 -16.862 6.961 -5.687
209 1HG GLU 22 1HG GLU 22 -15.435 6.021 -4.043
210 2HG GLU 22 2HG GLU 22 -15.525 7.482 -3.035
211 H TYR 23 H TYR 23 -13.933 9.007 -3.422
212 HA TYR 23 HA TYR 23 -15.055 11.517 -2.533
213 1HB TYR 23 1HB TYR 23 -12.680 9.773 -1.824
214 2HB TYR 23 2HB TYR 23 -12.760 11.407 -1.259
215 HD1 TYR 23 HD1 TYR 23 -14.474 8.115 -1.167
216 HD2 TYR 23 HD2 TYR 23 -14.263 12.053 0.549
217 HE1 TYR 23 HE1 TYR 23 -16.000 7.399 0.630
218 HE2 TYR 23 HE2 TYR 23 -15.699 11.299 2.432
219 HH TYR 23 HH TYR 23 -17.043 7.997 2.584
220 H VAL 24 H VAL 24 -12.387 10.515 -4.654
221 HA VAL 24 HA VAL 24 -11.275 13.220 -4.780
222 HB VAL 24 HB VAL 24 -10.596 10.638 -6.216
223 1HG1 VAL 24 1HG1 VAL 24 -9.957 12.433 -7.738
224 2HG1 VAL 24 2HG1 VAL 24 -9.250 13.372 -6.408
225 3HG1 VAL 24 3HG1 VAL 24 -8.501 11.852 -6.925
226 1HG2 VAL 24 1HG2 VAL 24 -9.095 12.295 -4.135
227 2HG2 VAL 24 2HG2 VAL 24 -10.028 10.843 -3.748
228 3HG2 VAL 24 3HG2 VAL 24 -8.602 10.720 -4.789
229 H LYS 25 H LYS 25 -13.523 11.359 -6.761
230 HA LYS 25 HA LYS 25 -14.789 11.889 -8.561
231 1HB LYS 25 1HB LYS 25 -14.379 14.752 -7.619
232 2HB LYS 25 2HB LYS 25 -15.584 14.213 -8.795
233 1HG LYS 25 1HG LYS 25 -16.644 12.779 -7.066
234 2HG LYS 25 2HG LYS 25 -15.445 13.318 -5.887
235 1HD LYS 25 1HD LYS 25 -16.659 15.131 -5.410
236 2HD LYS 25 2HD LYS 25 -16.494 15.704 -7.073
237 1HE LYS 25 1HE LYS 25 -18.501 14.336 -7.718
238 2HE LYS 25 2HE LYS 25 -18.682 13.852 -6.019
239 1HZ LYS 25 1HZ LYS 25 -18.960 16.159 -5.461
240 2HZ LYS 25 2HZ LYS 25 -18.790 16.606 -7.038
241 3HZ LYS 25 3HZ LYS 25 -20.084 15.697 -6.575
242 H LEU 26 H LEU 26 -12.554 11.125 -9.594
243 HA LEU 26 HA LEU 26 -12.133 12.935 -11.900
244 1HB LEU 26 1HB LEU 26 -10.379 13.655 -10.384
245 2HB LEU 26 2HB LEU 26 -10.020 11.974 -9.984
246 HG LEU 26 HG LEU 26 -9.243 11.629 -12.331
247 1HD1 LEU 26 1HD1 LEU 26 -10.124 13.767 -13.427
248 2HD1 LEU 26 2HD1 LEU 26 -8.988 14.682 -12.424
249 3HD1 LEU 26 3HD1 LEU 26 -8.383 13.546 -13.622
250 1HD2 LEU 26 1HD2 LEU 26 -7.564 13.683 -10.864
251 2HD2 LEU 26 2HD2 LEU 26 -7.789 12.044 -10.254
252 3HD2 LEU 26 3HD2 LEU 26 -7.046 12.292 -11.830
253 HA PRO 27 HA PRO 27 -12.600 8.686 -13.400
254 1HB PRO 27 1HB PRO 27 -12.182 9.036 -16.099
255 2HB PRO 27 2HB PRO 27 -13.701 9.444 -15.254
256 1HG PRO 27 1HG PRO 27 -11.427 11.313 -15.965
257 2HG PRO 27 2HG PRO 27 -13.176 11.564 -16.230
258 1HD PRO 27 1HD PRO 27 -11.921 12.652 -14.103
259 2HD PRO 27 2HD PRO 27 -13.555 11.965 -13.903
260 H VAL 28 H VAL 28 -9.802 10.724 -14.354
261 HA VAL 28 HA VAL 28 -7.989 8.793 -15.160
262 HB VAL 28 HB VAL 28 -7.645 11.370 -13.739
263 1HG1 VAL 28 1HG1 VAL 28 -5.828 10.101 -12.767
264 2HG1 VAL 28 2HG1 VAL 28 -5.387 9.451 -14.370
265 3HG1 VAL 28 3HG1 VAL 28 -5.173 11.169 -14.004
266 1HG2 VAL 28 1HG2 VAL 28 -6.583 10.417 -16.408
267 2HG2 VAL 28 2HG2 VAL 28 -8.069 11.378 -16.185
268 3HG2 VAL 28 3HG2 VAL 28 -6.491 12.053 -15.745
269 H LEU 29 H LEU 29 -9.121 9.332 -11.769
270 HA LEU 29 HA LEU 29 -7.053 7.712 -10.554
271 1HB LEU 29 1HB LEU 29 -9.668 8.948 -9.820
272 2HB LEU 29 2HB LEU 29 -9.390 7.427 -9.036
273 HG LEU 29 HG LEU 29 -8.707 9.791 -8.043
274 1HD1 LEU 29 1HD1 LEU 29 -8.635 7.590 -6.895
275 2HD1 LEU 29 2HD1 LEU 29 -7.032 7.310 -7.608
276 3HD1 LEU 29 3HD1 LEU 29 -7.291 8.665 -6.477
277 1HD2 LEU 29 1HD2 LEU 29 -5.967 8.919 -9.007
278 2HD2 LEU 29 2HD2 LEU 29 -6.917 10.091 -9.931
279 3HD2 LEU 29 3HD2 LEU 29 -6.459 10.436 -8.250
280 H ALA 30 H ALA 30 -10.333 6.929 -11.779
281 HA ALA 30 HA ALA 30 -10.143 4.263 -10.853
282 1HB ALA 30 1HB ALA 30 -12.240 4.011 -11.723
283 2HB ALA 30 2HB ALA 30 -12.179 5.770 -11.991
284 3HB ALA 30 3HB ALA 30 -11.819 4.648 -13.312
285 H LYS 31 H LYS 31 -9.106 6.086 -13.775
286 HA LYS 31 HA LYS 31 -8.532 3.779 -15.457
287 1HB LYS 31 1HB LYS 31 -8.633 6.643 -15.770
288 2HB LYS 31 2HB LYS 31 -7.044 6.092 -16.318
289 1HG LYS 31 1HG LYS 31 -8.056 4.500 -17.851
290 2HG LYS 31 2HG LYS 31 -9.668 4.807 -17.169
291 1HD LYS 31 1HD LYS 31 -9.551 7.166 -17.911
292 2HD LYS 31 2HD LYS 31 -7.967 6.864 -18.660
293 1HE LYS 31 1HE LYS 31 -8.916 5.335 -20.268
294 2HE LYS 31 2HE LYS 31 -10.441 5.220 -19.373
295 1HZ LYS 31 1HZ LYS 31 -10.867 7.500 -19.877
296 2HZ LYS 31 2HZ LYS 31 -9.469 7.621 -20.745
297 3HZ LYS 31 3HZ LYS 31 -10.675 6.618 -21.254
298 H ILE 32 H ILE 32 -6.695 5.751 -13.223
299 HA ILE 32 HA ILE 32 -4.051 4.754 -13.868
300 HB ILE 32 HB ILE 32 -5.317 6.074 -11.421
301 1HG1 ILE 32 1HG1 ILE 32 -2.996 6.962 -13.176
302 2HG1 ILE 32 2HG1 ILE 32 -4.656 7.388 -13.520
303 1HG2 ILE 32 1HG2 ILE 32 -3.760 4.527 -10.438
304 2HG2 ILE 32 2HG2 ILE 32 -2.559 4.860 -11.692
305 3HG2 ILE 32 3HG2 ILE 32 -2.942 6.079 -10.458
306 1HD1 ILE 32 1HD1 ILE 32 -4.812 8.492 -11.269
307 2HD1 ILE 32 2HD1 ILE 32 -3.082 8.173 -11.019
308 3HD1 ILE 32 3HD1 ILE 32 -3.597 9.217 -12.342
309 H LEU 33 H LEU 33 -6.681 3.949 -11.486
310 HA LEU 33 HA LEU 33 -5.056 1.889 -10.461
311 1HB LEU 33 1HB LEU 33 -6.916 1.522 -8.952
312 2HB LEU 33 2HB LEU 33 -7.068 3.217 -9.459
313 HG LEU 33 HG LEU 33 -8.719 2.607 -11.046
314 1HD1 LEU 33 1HD1 LEU 33 -8.923 0.441 -11.664
315 2HD1 LEU 33 2HD1 LEU 33 -8.112 -0.136 -10.179
316 3HD1 LEU 33 3HD1 LEU 33 -9.849 0.252 -10.178
317 1HD2 LEU 33 1HD2 LEU 33 -9.384 1.732 -8.256
318 2HD2 LEU 33 2HD2 LEU 33 -9.207 3.440 -8.793
319 3HD2 LEU 33 3HD2 LEU 33 -10.495 2.425 -9.461
320 H GLU 34 H GLU 34 -7.279 1.895 -13.171
321 HA GLU 34 HA GLU 34 -7.598 -0.882 -13.455
322 1HB GLU 34 1HB GLU 34 -8.721 1.025 -14.712
323 2HB GLU 34 2HB GLU 34 -7.304 1.116 -15.740
324 1HG GLU 34 1HG GLU 34 -8.390 -1.646 -15.478
325 2HG GLU 34 2HG GLU 34 -9.528 -0.490 -16.174
326 H ASP 35 H ASP 35 -5.175 1.342 -14.785
327 HA ASP 35 HA ASP 35 -3.588 -0.562 -16.169
328 1HB ASP 35 1HB ASP 35 -3.368 1.965 -16.263
329 2HB ASP 35 2HB ASP 35 -2.482 1.888 -14.733
330 H GLU 36 H GLU 36 -3.182 0.716 -12.840
331 HA GLU 36 HA GLU 36 -1.078 -0.947 -11.984
332 1HB GLU 36 1HB GLU 36 -3.457 -0.051 -10.312
333 2HB GLU 36 2HB GLU 36 -1.886 -0.571 -9.704
334 1HG GLU 36 1HG GLU 36 -2.214 1.910 -11.464
335 2HG GLU 36 2HG GLU 36 -2.302 1.929 -9.704
336 H GLU 37 H GLU 37 -4.609 -1.667 -12.107
337 HA GLU 37 HA GLU 37 -4.622 -4.068 -10.778
338 1HB GLU 37 1HB GLU 37 -6.422 -2.503 -12.142
339 2HB GLU 37 2HB GLU 37 -6.289 -3.834 -13.284
340 1HG GLU 37 1HG GLU 37 -6.775 -4.221 -10.311
341 2HG GLU 37 2HG GLU 37 -8.049 -3.759 -11.434
342 H LYS 38 H LYS 38 -3.662 -3.412 -14.181
343 HA LYS 38 HA LYS 38 -3.376 -6.224 -14.814
344 1HB LYS 38 1HB LYS 38 -3.775 -4.372 -16.452
345 2HB LYS 38 2HB LYS 38 -2.108 -3.826 -16.193
346 1HG LYS 38 1HG LYS 38 -1.237 -6.011 -16.962
347 2HG LYS 38 2HG LYS 38 -2.882 -6.665 -17.042
348 1HD LYS 38 1HD LYS 38 -3.446 -5.001 -18.809
349 2HD LYS 38 2HD LYS 38 -1.767 -4.419 -18.779
350 1HE LYS 38 1HE LYS 38 -0.956 -6.676 -19.420
351 2HE LYS 38 2HE LYS 38 -2.610 -7.311 -19.354
352 1HZ LYS 38 1HZ LYS 38 -3.194 -5.838 -21.128
353 2HZ LYS 38 2HZ LYS 38 -1.656 -5.249 -21.208
354 3HZ LYS 38 3HZ LYS 38 -1.957 -6.828 -21.575
355 H HIS 39 H HIS 39 -1.112 -3.669 -13.779
356 HA HIS 39 HA HIS 39 1.298 -5.170 -13.840
357 1HB HIS 39 1HB HIS 39 0.273 -2.912 -12.071
358 2HB HIS 39 2HB HIS 39 1.802 -3.659 -11.774
359 HD1 HIS 39 HD1 HIS 39 3.627 -3.406 -13.838
360 HD2 HIS 39 HD2 HIS 39 0.018 -1.291 -14.201
361 HE1 HIS 39 HE1 HIS 39 3.928 -1.797 -15.791
362 HE2 HIS 39 HE2 HIS 39 1.685 -0.525 -16.028
363 H ILE 40 H ILE 40 -1.233 -4.998 -11.398
364 HA ILE 40 HA ILE 40 0.057 -6.812 -9.521
365 HB ILE 40 HB ILE 40 -2.691 -5.541 -9.756
366 1HG1 ILE 40 1HG1 ILE 40 -0.574 -5.103 -7.630
367 2HG1 ILE 40 2HG1 ILE 40 -0.436 -4.255 -9.137
368 1HG2 ILE 40 1HG2 ILE 40 -2.999 -7.671 -8.563
369 2HG2 ILE 40 2HG2 ILE 40 -1.616 -7.303 -7.515
370 3HG2 ILE 40 3HG2 ILE 40 -3.111 -6.336 -7.432
371 1HD1 ILE 40 1HD1 ILE 40 -2.565 -3.186 -8.929
372 2HD1 ILE 40 2HD1 ILE 40 -2.948 -4.047 -7.438
373 3HD1 ILE 40 3HD1 ILE 40 -1.612 -2.873 -7.474
374 H GLU 41 H GLU 41 -2.270 -7.047 -12.211
375 HA GLU 41 HA GLU 41 -3.420 -9.508 -11.553
376 1HB GLU 41 1HB GLU 41 -4.202 -7.967 -13.360
377 2HB GLU 41 2HB GLU 41 -2.819 -8.459 -14.360
378 1HG GLU 41 1HG GLU 41 -4.323 -10.758 -13.319
379 2HG GLU 41 2HG GLU 41 -5.358 -9.623 -14.192
380 H TRP 42 H TRP 42 -0.338 -8.638 -13.080
381 HA TRP 42 HA TRP 42 0.459 -11.110 -14.084
382 1HB TRP 42 1HB TRP 42 1.514 -8.704 -14.086
383 2HB TRP 42 2HB TRP 42 2.319 -9.221 -12.613
384 HD1 TRP 42 HD1 TRP 42 2.007 -10.082 -16.330
385 HE1 TRP 42 HE1 TRP 42 4.020 -11.473 -17.071
386 HE3 TRP 42 HE3 TRP 42 4.183 -10.653 -11.835
387 HZ2 TRP 42 HZ2 TRP 42 6.383 -12.667 -15.835
388 HZ3 TRP 42 HZ3 TRP 42 6.346 -11.952 -11.583
389 HH2 TRP 42 HH2 TRP 42 7.402 -12.988 -13.585
390 H LEU 43 H LEU 43 0.594 -9.861 -10.734
391 HA LEU 43 HA LEU 43 1.905 -12.231 -9.687
392 1HB LEU 43 1HB LEU 43 0.590 -9.831 -8.426
393 2HB LEU 43 2HB LEU 43 1.318 -11.121 -7.472
394 HG LEU 43 HG LEU 43 3.156 -10.086 -9.544
395 1HD1 LEU 43 1HD1 LEU 43 2.342 -7.914 -9.350
396 2HD1 LEU 43 2HD1 LEU 43 1.853 -8.092 -7.669
397 3HD1 LEU 43 3HD1 LEU 43 3.561 -7.942 -8.066
398 1HD2 LEU 43 1HD2 LEU 43 3.362 -10.279 -6.508
399 2HD2 LEU 43 2HD2 LEU 43 3.880 -11.509 -7.668
400 3HD2 LEU 43 3HD2 LEU 43 4.693 -9.934 -7.612
401 H GLU 44 H GLU 44 -1.419 -11.554 -10.487
402 HA GLU 44 HA GLU 44 -2.521 -13.631 -8.613
403 1HB GLU 44 1HB GLU 44 -3.715 -11.649 -10.581
404 2HB GLU 44 2HB GLU 44 -4.567 -13.145 -10.267
405 1HG GLU 44 1HG GLU 44 -3.915 -12.189 -7.684
406 2HG GLU 44 2HG GLU 44 -4.420 -10.761 -8.597
407 H THR 45 H THR 45 -1.606 -13.135 -11.634
408 HA THR 45 HA THR 45 -2.684 -15.485 -13.023
409 HB THR 45 HB THR 45 -1.582 -13.067 -13.861
410 HG1 THR 45 HG1 THR 45 -2.517 -13.581 -15.690
411 1HG2 THR 45 1HG2 THR 45 0.705 -13.969 -14.046
412 2HG2 THR 45 2HG2 THR 45 0.104 -15.184 -15.189
413 3HG2 THR 45 3HG2 THR 45 0.003 -13.450 -15.573
414 H ILE 46 H ILE 46 0.309 -14.757 -11.528
415 HA ILE 46 HA ILE 46 1.966 -16.470 -13.063
416 HB ILE 46 HB ILE 46 2.679 -14.495 -11.933
417 1HG1 ILE 46 1HG1 ILE 46 4.394 -16.497 -10.497
418 2HG1 ILE 46 2HG1 ILE 46 4.224 -16.696 -12.256
419 1HG2 ILE 46 1HG2 ILE 46 1.256 -14.621 -9.987
420 2HG2 ILE 46 2HG2 ILE 46 2.234 -15.892 -9.291
421 3HG2 ILE 46 3HG2 ILE 46 2.902 -14.250 -9.561
422 1HD1 ILE 46 1HD1 ILE 46 4.761 -14.396 -12.665
423 2HD1 ILE 46 2HD1 ILE 46 4.891 -14.069 -10.918
424 3HD1 ILE 46 3HD1 ILE 46 6.066 -15.159 -11.720
425 H LEU 47 H LEU 47 0.133 -17.138 -10.138
426 HA LEU 47 HA LEU 47 0.759 -19.989 -10.441
427 1HB LEU 47 1HB LEU 47 2.459 -18.831 -8.846
428 2HB LEU 47 2HB LEU 47 1.136 -18.762 -7.686
429 HG LEU 47 HG LEU 47 2.283 -21.248 -9.064
430 1HD1 LEU 47 1HD1 LEU 47 3.789 -20.237 -7.396
431 2HD1 LEU 47 2HD1 LEU 47 2.495 -20.297 -6.179
432 3HD1 LEU 47 3HD1 LEU 47 3.172 -21.802 -6.840
433 1HD2 LEU 47 1HD2 LEU 47 0.082 -21.017 -6.965
434 2HD2 LEU 47 2HD2 LEU 47 -0.041 -21.721 -8.596
435 3HD2 LEU 47 3HD2 LEU 47 0.925 -22.527 -7.361
436 H GLY 48 H GLY 48 -1.427 -19.594 -11.287
437 1HA GLY 48 1HA GLY 48 -3.604 -18.778 -9.682
438 2HA GLY 48 2HA GLY 48 -3.703 -19.838 -11.098
439 1HN NH2 49 1HN NH2 49 -1.865 -21.893 -9.781
440 2HN NH2 49 2HN NH2 49 -2.944 -22.754 -8.651
441 1H ACE 0 H1 ACE 0 -4.644 16.890 2.739
442 2H ACE 0 H2 ACE 0 -5.612 16.678 1.263
443 3H ACE 0 H3 ACE 0 -6.413 16.936 2.830
444 H ASP 1 H ASP 1 -7.568 15.008 2.914
445 HA ASP 1 HA ASP 1 -6.231 12.807 4.081
446 1HB ASP 1 1HB ASP 1 -8.565 13.270 4.569
447 2HB ASP 1 2HB ASP 1 -9.026 12.998 2.877
448 H TYR 2 H TYR 2 -7.777 13.022 0.850
449 HA TYR 2 HA TYR 2 -7.275 10.470 -0.049
450 1HB TYR 2 1HB TYR 2 -7.180 12.883 -1.863
451 2HB TYR 2 2HB TYR 2 -7.873 11.290 -2.137
452 HD1 TYR 2 HD1 TYR 2 -9.647 10.829 0.161
453 HD2 TYR 2 HD2 TYR 2 -8.907 14.472 -2.040
454 HE1 TYR 2 HE1 TYR 2 -11.630 11.857 1.190
455 HE2 TYR 2 HE2 TYR 2 -10.969 15.454 -1.084
456 HH TYR 2 HH TYR 2 -13.002 13.713 1.276
457 H LEU 3 H LEU 3 -5.200 13.343 -0.457
458 HA LEU 3 HA LEU 3 -3.125 12.021 -1.906
459 1HB LEU 3 1HB LEU 3 -2.933 14.463 -0.105
460 2HB LEU 3 2HB LEU 3 -1.781 13.978 -1.356
461 HG LEU 3 HG LEU 3 -4.678 14.853 -1.826
462 1HD1 LEU 3 1HD1 LEU 3 -3.173 16.689 -1.179
463 2HD1 LEU 3 2HD1 LEU 3 -2.046 16.229 -2.474
464 3HD1 LEU 3 3HD1 LEU 3 -3.670 16.821 -2.875
465 1HD2 LEU 3 1HD2 LEU 3 -2.511 14.064 -3.824
466 2HD2 LEU 3 2HD2 LEU 3 -4.059 13.228 -3.562
467 3HD2 LEU 3 3HD2 LEU 3 -4.042 14.855 -4.241
468 H ARG 4 H ARG 4 -3.784 12.406 1.593
469 HA ARG 4 HA ARG 4 -1.322 10.956 2.337
470 1HB ARG 4 1HB ARG 4 -3.686 11.984 3.930
471 2HB ARG 4 2HB ARG 4 -2.288 11.192 4.644
472 1HG ARG 4 1HG ARG 4 -1.885 13.682 2.939
473 2HG ARG 4 2HG ARG 4 -2.475 13.792 4.594
474 1HD ARG 4 1HD ARG 4 -0.153 14.072 4.753
475 2HD ARG 4 2HD ARG 4 -0.492 12.443 5.371
476 HE ARG 4 HE ARG 4 0.148 12.367 2.565
477 1HH1 ARG 4 1HH2 ARG 4 1.617 12.883 5.720
478 2HH1 ARG 4 2HH2 ARG 4 3.243 12.523 5.209
479 1HH2 ARG 4 1HH1 ARG 4 2.270 11.890 1.845
480 2HH2 ARG 4 2HH1 ARG 4 3.619 11.935 2.943
481 H GLU 5 H GLU 5 -3.646 9.762 0.631
482 HA GLU 5 HA GLU 5 -3.666 7.204 2.178
483 1HB GLU 5 1HB GLU 5 -5.878 8.355 2.159
484 2HB GLU 5 2HB GLU 5 -5.923 8.271 0.402
485 1HG GLU 5 1HG GLU 5 -6.528 6.075 0.405
486 2HG GLU 5 2HG GLU 5 -5.369 5.653 1.676
487 H LEU 6 H LEU 6 -4.238 8.501 -1.127
488 HA LEU 6 HA LEU 6 -3.266 5.963 -2.271
489 1HB LEU 6 1HB LEU 6 -4.150 8.455 -3.695
490 2HB LEU 6 2HB LEU 6 -3.903 6.862 -4.381
491 HG LEU 6 HG LEU 6 -5.990 6.304 -2.668
492 1HD1 LEU 6 1HD1 LEU 6 -6.723 8.388 -1.892
493 2HD1 LEU 6 2HD1 LEU 6 -5.996 9.305 -3.221
494 3HD1 LEU 6 3HD1 LEU 6 -7.480 8.445 -3.499
495 1HD2 LEU 6 1HD2 LEU 6 -5.874 7.272 -5.508
496 2HD2 LEU 6 2HD2 LEU 6 -5.825 5.623 -4.870
497 3HD2 LEU 6 3HD2 LEU 6 -7.330 6.546 -4.777
498 H LEU 7 H LEU 7 -1.387 7.807 -0.866
499 HA LEU 7 HA LEU 7 0.600 7.675 -2.967
500 1HB LEU 7 1HB LEU 7 -0.170 9.990 -3.073
501 2HB LEU 7 2HB LEU 7 0.266 10.242 -1.383
502 HG LEU 7 HG LEU 7 2.341 9.413 -3.442
503 1HD1 LEU 7 1HD1 LEU 7 1.291 11.375 -4.353
504 2HD1 LEU 7 2HD1 LEU 7 1.305 12.199 -2.781
505 3HD1 LEU 7 3HD1 LEU 7 2.827 11.877 -3.643
506 1HD2 LEU 7 1HD2 LEU 7 2.405 10.712 -0.680
507 2HD2 LEU 7 2HD2 LEU 7 3.246 9.243 -1.228
508 3HD2 LEU 7 3HD2 LEU 7 3.772 10.822 -1.801
509 H LYS 8 H LYS 8 0.173 8.556 0.489
510 HA LYS 8 HA LYS 8 2.689 7.634 1.209
511 1HB LYS 8 1HB LYS 8 1.932 7.600 3.518
512 2HB LYS 8 2HB LYS 8 1.531 9.071 2.644
513 1HG LYS 8 1HG LYS 8 -0.435 8.815 3.713
514 2HG LYS 8 2HG LYS 8 -0.810 7.919 2.251
515 1HD LYS 8 1HD LYS 8 -1.674 6.587 3.885
516 2HD LYS 8 2HD LYS 8 -0.124 5.779 3.645
517 1HE LYS 8 1HE LYS 8 -0.741 7.829 5.838
518 2HE LYS 8 2HE LYS 8 -0.867 6.078 6.028
519 1HZ LYS 8 1HZ LYS 8 1.192 6.794 6.854
520 2HZ LYS 8 2HZ LYS 8 1.469 5.913 5.489
521 3HZ LYS 8 3HZ LYS 8 1.590 7.558 5.452
522 H LEU 9 H LEU 9 -0.375 5.826 0.914
523 HA LEU 9 HA LEU 9 0.729 3.319 1.903
524 1HB LEU 9 1HB LEU 9 -1.595 3.890 0.013
525 2HB LEU 9 2HB LEU 9 -1.191 2.299 0.653
526 HG LEU 9 HG LEU 9 -1.941 4.679 2.403
527 1HD1 LEU 9 1HD1 LEU 9 -3.811 3.975 0.938
528 2HD1 LEU 9 2HD1 LEU 9 -3.649 2.312 1.538
529 3HD1 LEU 9 3HD1 LEU 9 -4.124 3.616 2.647
530 1HD2 LEU 9 1HD2 LEU 9 -1.672 1.694 3.014
531 2HD2 LEU 9 2HD2 LEU 9 -0.610 2.977 3.630
532 3HD2 LEU 9 3HD2 LEU 9 -2.299 2.915 4.136
533 H GLU 10 H GLU 10 0.578 5.035 -1.242
534 HA GLU 10 HA GLU 10 1.296 2.821 -2.789
535 1HB GLU 10 1HB GLU 10 1.885 5.699 -3.430
536 2HB GLU 10 2HB GLU 10 1.801 4.272 -4.469
537 1HG GLU 10 1HG GLU 10 -0.584 5.386 -2.971
538 2HG GLU 10 2HG GLU 10 -0.238 5.691 -4.676
539 H LEU 11 H LEU 11 3.243 5.276 -1.115
540 HA LEU 11 HA LEU 11 5.804 4.570 -2.186
541 1HB LEU 11 1HB LEU 11 4.767 5.958 0.254
542 2HB LEU 11 2HB LEU 11 6.350 5.222 0.478
543 HG LEU 11 HG LEU 11 5.767 6.989 -1.923
544 1HD1 LEU 11 1HD1 LEU 11 5.268 8.294 0.109
545 2HD1 LEU 11 2HD1 LEU 11 6.842 7.845 0.802
546 3HD1 LEU 11 3HD1 LEU 11 6.763 8.857 -0.658
547 1HD2 LEU 11 1HD2 LEU 11 8.346 6.246 -0.440
548 2HD2 LEU 11 2HD2 LEU 11 7.827 5.535 -1.978
549 3HD2 LEU 11 3HD2 LEU 11 8.233 7.256 -1.896
550 H GLN 12 H GLN 12 3.928 3.050 0.451
551 HA GLN 12 HA GLN 12 5.958 1.299 1.328
552 1HB GLN 12 1HB GLN 12 3.516 1.887 2.287
553 2HB GLN 12 2HB GLN 12 2.998 0.581 1.209
554 1HG GLN 12 1HG GLN 12 4.830 -0.825 2.367
555 2HG GLN 12 2HG GLN 12 4.868 0.451 3.590
556 1HE2 GLN 12 2HE2 GLN 12 2.683 -1.899 1.942
557 2HE2 GLN 12 1HE2 GLN 12 1.577 -2.033 3.298
558 H LEU 13 H LEU 13 3.968 1.256 -1.533
559 HA LEU 13 HA LEU 13 4.192 -1.571 -2.134
560 1HB LEU 13 1HB LEU 13 3.750 0.655 -4.168
561 2HB LEU 13 2HB LEU 13 3.280 -1.034 -4.243
562 HG LEU 13 HG LEU 13 2.122 0.980 -2.285
563 1HD1 LEU 13 1HD1 LEU 13 1.702 1.479 -4.702
564 2HD1 LEU 13 2HD1 LEU 13 1.046 -0.142 -4.911
565 3HD1 LEU 13 3HD1 LEU 13 0.237 1.045 -3.836
566 1HD2 LEU 13 1HD2 LEU 13 1.502 -1.901 -2.867
567 2HD2 LEU 13 2HD2 LEU 13 2.074 -1.208 -1.342
568 3HD2 LEU 13 3HD2 LEU 13 0.475 -0.785 -1.910
569 H ILE 14 H ILE 14 5.637 1.468 -3.385
570 HA ILE 14 HA ILE 14 7.442 0.151 -5.162
571 HB ILE 14 HB ILE 14 7.697 2.862 -3.696
572 1HG1 ILE 14 1HG1 ILE 14 5.591 2.973 -4.723
573 2HG1 ILE 14 2HG1 ILE 14 6.672 3.776 -5.836
574 1HG2 ILE 14 1HG2 ILE 14 9.802 2.207 -4.886
575 2HG2 ILE 14 2HG2 ILE 14 8.883 2.040 -6.390
576 3HG2 ILE 14 3HG2 ILE 14 9.022 3.619 -5.612
577 1HD1 ILE 14 1HD1 ILE 14 6.802 1.548 -7.125
578 2HD1 ILE 14 2HD1 ILE 14 5.481 0.981 -6.080
579 3HD1 ILE 14 3HD1 ILE 14 5.237 2.368 -7.137
580 H LYS 15 H LYS 15 7.762 1.046 -1.810
581 HA LYS 15 HA LYS 15 10.404 0.057 -1.391
582 1HB LYS 15 1HB LYS 15 8.498 1.370 0.155
583 2HB LYS 15 2HB LYS 15 8.454 -0.244 0.839
584 1HG LYS 15 1HG LYS 15 10.059 1.045 2.068
585 2HG LYS 15 2HG LYS 15 10.980 -0.085 1.074
586 1HD LYS 15 1HD LYS 15 12.149 1.691 0.296
587 2HD LYS 15 2HD LYS 15 10.705 2.189 -0.596
588 1HE LYS 15 1HE LYS 15 9.978 3.616 1.249
589 2HE LYS 15 2HE LYS 15 11.311 3.038 2.273
590 1HZ LYS 15 1HZ LYS 15 12.848 3.983 0.727
591 2HZ LYS 15 2HZ LYS 15 11.625 4.540 -0.227
592 3HZ LYS 15 3HZ LYS 15 11.819 5.134 1.297
593 H GLN 16 H GLN 16 7.200 -1.595 -0.918
594 HA GLN 16 HA GLN 16 8.378 -4.097 -0.120
595 1HB GLN 16 1HB GLN 16 5.659 -3.239 -1.171
596 2HB GLN 16 2HB GLN 16 6.020 -4.947 -1.000
597 1HG GLN 16 1HG GLN 16 6.323 -2.946 1.273
598 2HG GLN 16 2HG GLN 16 4.887 -3.951 1.004
599 1HE2 GLN 16 2HE2 GLN 16 6.683 -4.009 3.380
600 2HE2 GLN 16 1HE2 GLN 16 7.307 -5.652 3.397
601 H TYR 17 H TYR 17 7.626 -2.744 -3.234
602 HA TYR 17 HA TYR 17 7.872 -5.135 -4.807
603 1HB TYR 17 1HB TYR 17 7.698 -2.137 -5.285
604 2HB TYR 17 2HB TYR 17 8.239 -3.161 -6.563
605 HD1 TYR 17 HD1 TYR 17 6.748 -5.365 -6.927
606 HD2 TYR 17 HD2 TYR 17 5.380 -1.525 -5.606
607 HE1 TYR 17 HE1 TYR 17 4.508 -5.829 -7.896
608 HE2 TYR 17 HE2 TYR 17 3.092 -2.082 -6.351
609 HH TYR 17 HH TYR 17 1.720 -3.693 -7.315
610 H ARG 18 H ARG 18 10.081 -2.819 -3.452
611 HA ARG 18 HA ARG 18 12.315 -3.639 -5.187
612 1HB ARG 18 1HB ARG 18 12.082 -1.686 -2.880
613 2HB ARG 18 2HB ARG 18 13.643 -2.325 -3.422
614 1HG ARG 18 1HG ARG 18 13.169 -1.594 -5.728
615 2HG ARG 18 2HG ARG 18 11.652 -0.857 -5.196
616 1HD ARG 18 1HD ARG 18 12.737 0.967 -4.279
617 2HD ARG 18 2HD ARG 18 14.017 -0.028 -3.593
618 HE ARG 18 HE ARG 18 15.364 0.385 -5.355
619 1HH1 ARG 18 1HH2 ARG 18 12.059 1.072 -6.320
620 2HH1 ARG 18 2HH2 ARG 18 12.465 1.659 -7.910
621 1HH2 ARG 18 1HH1 ARG 18 15.947 1.071 -7.453
622 2HH2 ARG 18 2HH1 ARG 18 14.739 1.636 -8.573
623 H GLU 19 H GLU 19 11.123 -4.025 -1.913
624 HA GLU 19 HA GLU 19 13.092 -5.772 -0.924
625 1HB GLU 19 1HB GLU 19 11.041 -4.777 0.334
626 2HB GLU 19 2HB GLU 19 10.170 -6.194 -0.279
627 1HG GLU 19 1HG GLU 19 12.017 -7.636 0.729
628 2HG GLU 19 2HG GLU 19 12.637 -6.170 1.503
629 H ALA 20 H ALA 20 10.054 -6.586 -2.753
630 HA ALA 20 HA ALA 20 10.799 -9.385 -2.688
631 1HB ALA 20 1HB ALA 20 8.482 -8.310 -2.856
632 2HB ALA 20 2HB ALA 20 8.796 -8.275 -4.613
633 3HB ALA 20 3HB ALA 20 8.767 -9.815 -3.732
634 H LEU 21 H LEU 21 11.619 -6.769 -4.864
635 HA LEU 21 HA LEU 21 11.798 -7.832 -7.329
636 1HB LEU 21 1HB LEU 21 12.432 -5.529 -6.381
637 2HB LEU 21 2HB LEU 21 14.065 -6.135 -6.218
638 HG LEU 21 HG LEU 21 12.427 -5.942 -8.795
639 1HD1 LEU 21 1HD1 LEU 21 12.786 -3.752 -8.044
640 2HD1 LEU 21 2HD1 LEU 21 14.401 -4.112 -7.405
641 3HD1 LEU 21 3HD1 LEU 21 14.153 -4.004 -9.142
642 1HD2 LEU 21 1HD2 LEU 21 15.369 -6.599 -8.375
643 2HD2 LEU 21 2HD2 LEU 21 14.122 -7.649 -9.097
644 3HD2 LEU 21 3HD2 LEU 21 14.627 -6.191 -9.939
645 H GLU 22 H GLU 22 14.532 -7.981 -5.027
646 HA GLU 22 HA GLU 22 16.053 -9.713 -6.829
647 1HB GLU 22 1HB GLU 22 16.726 -8.659 -4.047
648 2HB GLU 22 2HB GLU 22 17.766 -9.685 -5.044
649 1HG GLU 22 1HG GLU 22 17.607 -7.921 -6.881
650 2HG GLU 22 2HG GLU 22 16.858 -6.851 -5.681
651 H TYR 23 H TYR 23 14.195 -9.956 -3.826
652 HA TYR 23 HA TYR 23 14.922 -12.611 -3.167
653 1HB TYR 23 1HB TYR 23 12.779 -10.661 -2.476
654 2HB TYR 23 2HB TYR 23 12.266 -12.314 -2.348
655 HD1 TYR 23 HD1 TYR 23 14.621 -13.760 -1.286
656 HD2 TYR 23 HD2 TYR 23 12.933 -9.927 -0.235
657 HE1 TYR 23 HE1 TYR 23 15.499 -14.002 0.992
658 HE2 TYR 23 HE2 TYR 23 13.772 -10.208 2.075
659 HH TYR 23 HH TYR 23 15.574 -13.119 3.103
660 H VAL 24 H VAL 24 12.700 -11.343 -5.563
661 HA VAL 24 HA VAL 24 11.754 -14.055 -6.316
662 HB VAL 24 HB VAL 24 11.088 -11.271 -7.320
663 1HG1 VAL 24 1HG1 VAL 24 10.763 -12.790 -9.194
664 2HG1 VAL 24 2HG1 VAL 24 9.970 -13.987 -8.148
665 3HG1 VAL 24 3HG1 VAL 24 9.175 -12.444 -8.499
666 1HG2 VAL 24 1HG2 VAL 24 9.348 -13.284 -5.845
667 2HG2 VAL 24 2HG2 VAL 24 10.204 -11.982 -5.002
668 3HG2 VAL 24 3HG2 VAL 24 8.959 -11.596 -6.197
669 H LYS 25 H LYS 25 13.983 -11.539 -7.397
670 HA LYS 25 HA LYS 25 15.548 -11.409 -8.992
671 1HB LYS 25 1HB LYS 25 15.397 -14.456 -8.993
672 2HB LYS 25 2HB LYS 25 16.394 -13.531 -10.107
673 1HG LYS 25 1HG LYS 25 17.242 -12.324 -7.889
674 2HG LYS 25 2HG LYS 25 16.707 -13.821 -7.127
675 1HD LYS 25 1HD LYS 25 18.551 -13.684 -9.575
676 2HD LYS 25 2HD LYS 25 19.158 -13.680 -7.916
677 1HE LYS 25 1HE LYS 25 18.299 -15.875 -7.467
678 2HE LYS 25 2HE LYS 25 17.359 -15.909 -8.969
679 1HZ LYS 25 1HZ LYS 25 19.344 -15.960 -10.209
680 2HZ LYS 25 2HZ LYS 25 20.290 -15.770 -8.872
681 3HZ LYS 25 3HZ LYS 25 19.422 -17.156 -9.080
682 H LEU 26 H LEU 26 13.688 -10.257 -9.944
683 HA LEU 26 HA LEU 26 13.347 -11.264 -12.712
684 1HB LEU 26 1HB LEU 26 11.466 -12.180 -11.427
685 2HB LEU 26 2HB LEU 26 11.129 -10.571 -10.780
686 HG LEU 26 HG LEU 26 10.757 -9.852 -13.228
687 1HD1 LEU 26 1HD1 LEU 26 11.719 -11.876 -14.334
688 2HD1 LEU 26 2HD1 LEU 26 10.477 -12.874 -13.559
689 3HD1 LEU 26 3HD1 LEU 26 10.015 -11.655 -14.760
690 1HD2 LEU 26 1HD2 LEU 26 8.420 -10.649 -13.127
691 2HD2 LEU 26 2HD2 LEU 26 8.882 -11.794 -11.845
692 3HD2 LEU 26 3HD2 LEU 26 8.980 -10.041 -11.572
693 HA PRO 27 HA PRO 27 14.001 -6.765 -12.974
694 1HB PRO 27 1HB PRO 27 14.209 -6.461 -15.676
695 2HB PRO 27 2HB PRO 27 15.511 -7.145 -14.664
696 1HG PRO 27 1HG PRO 27 13.457 -8.659 -16.290
697 2HG PRO 27 2HG PRO 27 15.222 -8.924 -16.231
698 1HD PRO 27 1HD PRO 27 13.478 -10.411 -14.760
699 2HD PRO 27 2HD PRO 27 15.081 -9.972 -14.106
700 H VAL 28 H VAL 28 11.531 -8.586 -14.839
701 HA VAL 28 HA VAL 28 9.803 -6.526 -15.574
702 HB VAL 28 HB VAL 28 9.270 -9.323 -14.699
703 1HG1 VAL 28 1HG1 VAL 28 7.244 -8.246 -14.069
704 2HG1 VAL 28 2HG1 VAL 28 7.209 -7.284 -15.571
705 3HG1 VAL 28 3HG1 VAL 28 6.940 -9.040 -15.609
706 1HG2 VAL 28 1HG2 VAL 28 8.908 -8.028 -17.409
707 2HG2 VAL 28 2HG2 VAL 28 10.310 -9.027 -16.931
708 3HG2 VAL 28 3HG2 VAL 28 8.689 -9.735 -17.001
709 H LEU 29 H LEU 29 10.327 -7.896 -12.318
710 HA LEU 29 HA LEU 29 8.079 -6.658 -11.030
711 1HB LEU 29 1HB LEU 29 10.419 -8.238 -10.296
712 2HB LEU 29 2HB LEU 29 10.321 -6.860 -9.212
713 HG LEU 29 HG LEU 29 7.844 -8.511 -9.785
714 1HD1 LEU 29 1HD1 LEU 29 9.534 -10.166 -9.181
715 2HD1 LEU 29 2HD1 LEU 29 10.008 -9.209 -7.762
716 3HD1 LEU 29 3HD1 LEU 29 8.389 -9.932 -7.853
717 1HD2 LEU 29 1HD2 LEU 29 8.852 -7.044 -7.299
718 2HD2 LEU 29 2HD2 LEU 29 7.809 -6.324 -8.547
719 3HD2 LEU 29 3HD2 LEU 29 7.223 -7.699 -7.577
720 H ALA 30 H ALA 30 11.475 -5.615 -10.883
721 HA ALA 30 HA ALA 30 11.139 -3.036 -10.193
722 1HB ALA 30 1HB ALA 30 13.304 -4.367 -11.068
723 2HB ALA 30 2HB ALA 30 12.964 -3.522 -12.573
724 3HB ALA 30 3HB ALA 30 13.273 -2.583 -11.104
725 H LYS 31 H LYS 31 10.473 -4.248 -13.468
726 HA LYS 31 HA LYS 31 10.019 -1.524 -14.472
727 1HB LYS 31 1HB LYS 31 9.383 -4.212 -15.715
728 2HB LYS 31 2HB LYS 31 9.103 -2.639 -16.484
729 1HG LYS 31 1HG LYS 31 11.489 -2.055 -16.222
730 2HG LYS 31 2HG LYS 31 11.817 -3.645 -15.508
731 1HD LYS 31 1HD LYS 31 11.027 -4.747 -17.592
732 2HD LYS 31 2HD LYS 31 10.710 -3.164 -18.321
733 1HE LYS 31 1HE LYS 31 13.448 -4.169 -17.387
734 2HE LYS 31 2HE LYS 31 12.881 -4.133 -19.065
735 1HZ LYS 31 1HZ LYS 31 12.688 -1.751 -18.883
736 2HZ LYS 31 2HZ LYS 31 13.265 -1.788 -17.341
737 3HZ LYS 31 3HZ LYS 31 14.229 -2.251 -18.591
738 H ILE 32 H ILE 32 8.029 -3.949 -12.881
739 HA ILE 32 HA ILE 32 5.517 -2.747 -13.682
740 HB ILE 32 HB ILE 32 6.402 -4.835 -11.647
741 1HG1 ILE 32 1HG1 ILE 32 4.354 -5.141 -13.871
742 2HG1 ILE 32 2HG1 ILE 32 6.080 -5.358 -14.146
743 1HG2 ILE 32 1HG2 ILE 32 4.767 -3.887 -10.354
744 2HG2 ILE 32 2HG2 ILE 32 3.860 -3.290 -11.739
745 3HG2 ILE 32 3HG2 ILE 32 3.772 -5.008 -11.297
746 1HD1 ILE 32 1HD1 ILE 32 6.130 -7.116 -12.384
747 2HD1 ILE 32 2HD1 ILE 32 4.379 -6.941 -12.163
748 3HD1 ILE 32 3HD1 ILE 32 5.012 -7.500 -13.712
749 H LEU 33 H LEU 33 7.722 -2.762 -10.851
750 HA LEU 33 HA LEU 33 6.087 -1.054 -9.233
751 1HB LEU 33 1HB LEU 33 7.724 -1.230 -7.706
752 2HB LEU 33 2HB LEU 33 8.025 -2.661 -8.718
753 HG LEU 33 HG LEU 33 9.838 -1.457 -9.788
754 1HD1 LEU 33 1HD1 LEU 33 10.073 0.731 -9.567
755 2HD1 LEU 33 2HD1 LEU 33 8.842 0.787 -8.276
756 3HD1 LEU 33 3HD1 LEU 33 10.529 0.448 -7.878
757 1HD2 LEU 33 1HD2 LEU 33 9.983 -1.721 -6.773
758 2HD2 LEU 33 2HD2 LEU 33 10.144 -3.060 -7.935
759 3HD2 LEU 33 3HD2 LEU 33 11.369 -1.777 -7.887
760 H GLU 34 H GLU 34 8.657 -0.379 -11.687
761 HA GLU 34 HA GLU 34 8.910 2.387 -11.296
762 1HB GLU 34 1HB GLU 34 10.203 0.833 -12.928
763 2HB GLU 34 2HB GLU 34 8.879 1.118 -14.049
764 1HG GLU 34 1HG GLU 34 9.327 3.682 -13.495
765 2HG GLU 34 2HG GLU 34 10.895 3.088 -12.943
766 H ASP 35 H ASP 35 6.713 0.627 -13.492
767 HA ASP 35 HA ASP 35 5.397 2.884 -14.583
768 1HB ASP 35 1HB ASP 35 5.165 0.487 -15.364
769 2HB ASP 35 2HB ASP 35 4.070 0.219 -13.990
770 H GLU 36 H GLU 36 4.566 0.905 -11.708
771 HA GLU 36 HA GLU 36 2.350 2.443 -10.882
772 1HB GLU 36 1HB GLU 36 4.310 1.061 -9.008
773 2HB GLU 36 2HB GLU 36 2.644 1.545 -8.697
774 1HG GLU 36 1HG GLU 36 2.475 -0.103 -11.009
775 2HG GLU 36 2HG GLU 36 3.694 -0.884 -10.002
776 H GLU 37 H GLU 37 5.867 2.945 -10.241
777 HA GLU 37 HA GLU 37 5.703 5.037 -8.429
778 1HB GLU 37 1HB GLU 37 7.662 3.648 -9.784
779 2HB GLU 37 2HB GLU 37 7.837 5.243 -10.516
780 1HG GLU 37 1HG GLU 37 7.706 4.826 -7.510
781 2HG GLU 37 2HG GLU 37 9.158 4.468 -8.437
782 H LYS 38 H LYS 38 5.610 5.208 -12.015
783 HA LYS 38 HA LYS 38 5.296 8.082 -12.107
784 1HB LYS 38 1HB LYS 38 5.972 6.651 -14.044
785 2HB LYS 38 2HB LYS 38 4.342 5.955 -14.070
786 1HG LYS 38 1HG LYS 38 3.395 8.264 -14.420
787 2HG LYS 38 2HG LYS 38 5.040 8.914 -14.467
788 1HD LYS 38 1HD LYS 38 5.518 7.667 -16.506
789 2HD LYS 38 2HD LYS 38 3.999 6.753 -16.360
790 1HE LYS 38 1HE LYS 38 2.683 8.837 -16.617
791 2HE LYS 38 2HE LYS 38 4.176 9.785 -16.748
792 1HZ LYS 38 1HZ LYS 38 4.690 8.593 -18.739
793 2HZ LYS 38 2HZ LYS 38 3.341 7.655 -18.593
794 3HZ LYS 38 3HZ LYS 38 3.194 9.273 -18.870
795 H HIS 39 H HIS 39 2.864 5.421 -12.039
796 HA HIS 39 HA HIS 39 0.647 7.212 -12.254
797 1HB HIS 39 1HB HIS 39 0.994 4.402 -11.183
798 2HB HIS 39 2HB HIS 39 -0.505 5.267 -10.891
799 HD1 HIS 39 HD1 HIS 39 -1.080 6.690 -13.538
800 HD2 HIS 39 HD2 HIS 39 0.609 2.843 -13.288
801 HE1 HIS 39 HE1 HIS 39 -1.588 5.530 -15.772
802 HE2 HIS 39 HE2 HIS 39 -0.492 3.208 -15.627
803 H ILE 40 H ILE 40 2.484 6.176 -9.418
804 HA ILE 40 HA ILE 40 0.806 7.518 -7.507
805 HB ILE 40 HB ILE 40 3.710 6.643 -7.364
806 1HG1 ILE 40 1HG1 ILE 40 1.280 5.247 -6.217
807 2HG1 ILE 40 2HG1 ILE 40 1.723 4.900 -7.836
808 1HG2 ILE 40 1HG2 ILE 40 3.162 8.281 -5.572
809 2HG2 ILE 40 2HG2 ILE 40 1.719 7.347 -5.149
810 3HG2 ILE 40 3HG2 ILE 40 3.340 6.669 -4.891
811 1HD1 ILE 40 1HD1 ILE 40 3.973 4.225 -7.265
812 2HD1 ILE 40 2HD1 ILE 40 3.698 4.527 -5.553
813 3HD1 ILE 40 3HD1 ILE 40 2.783 3.250 -6.395
814 H GLU 41 H GLU 41 3.783 8.410 -9.271
815 HA GLU 41 HA GLU 41 4.301 10.934 -8.229
816 1HB GLU 41 1HB GLU 41 5.616 9.648 -10.030
817 2HB GLU 41 2HB GLU 41 4.415 10.252 -11.184
818 1HG GLU 41 1HG GLU 41 5.119 12.592 -9.982
819 2HG GLU 41 2HG GLU 41 6.620 11.679 -9.806
820 H TRP 42 H TRP 42 1.765 9.945 -10.597
821 HA TRP 42 HA TRP 42 0.962 12.460 -11.400
822 1HB TRP 42 1HB TRP 42 0.219 10.065 -12.049
823 2HB TRP 42 2HB TRP 42 -1.036 10.285 -10.836
824 HD1 TRP 42 HD1 TRP 42 0.222 11.798 -14.083
825 HE1 TRP 42 HE1 TRP 42 -1.613 13.212 -15.205
826 HE3 TRP 42 HE3 TRP 42 -3.032 11.638 -10.313
827 HZ2 TRP 42 HZ2 TRP 42 -4.240 14.291 -14.363
828 HZ3 TRP 42 HZ3 TRP 42 -5.167 12.977 -10.355
829 HH2 TRP 42 HH2 TRP 42 -5.755 14.303 -12.390
830 H LEU 43 H LEU 43 0.293 10.774 -8.406
831 HA LEU 43 HA LEU 43 -1.697 12.670 -7.409
832 1HB LEU 43 1HB LEU 43 -0.301 10.344 -6.039
833 2HB LEU 43 2HB LEU 43 -1.472 11.407 -5.293
834 HG LEU 43 HG LEU 43 -2.774 10.586 -7.656
835 1HD1 LEU 43 1HD1 LEU 43 -1.176 8.760 -7.975
836 2HD1 LEU 43 2HD1 LEU 43 -1.386 8.221 -6.305
837 3HD1 LEU 43 3HD1 LEU 43 -2.729 8.092 -7.446
838 1HD2 LEU 43 1HD2 LEU 43 -2.898 9.729 -4.753
839 2HD2 LEU 43 2HD2 LEU 43 -3.893 10.971 -5.520
840 3HD2 LEU 43 3HD2 LEU 43 -4.149 9.262 -5.932
841 H GLU 44 H GLU 44 1.668 12.979 -7.750
842 HA GLU 44 HA GLU 44 1.799 14.751 -5.404
843 1HB GLU 44 1HB GLU 44 4.010 14.326 -5.215
844 2HB GLU 44 2HB GLU 44 3.576 12.836 -6.060
845 1HG GLU 44 1HG GLU 44 4.174 14.085 -8.238
846 2HG GLU 44 2HG GLU 44 4.721 15.396 -7.217
847 H THR 45 H THR 45 1.726 14.680 -8.831
848 HA THR 45 HA THR 45 2.628 17.386 -9.267
849 HB THR 45 HB THR 45 1.134 16.625 -11.435
850 HG1 THR 45 HG1 THR 45 0.547 14.648 -10.515
851 1HG2 THR 45 1HG2 THR 45 3.571 17.151 -11.548
852 2HG2 THR 45 2HG2 THR 45 3.917 15.545 -10.837
853 3HG2 THR 45 3HG2 THR 45 3.173 15.666 -12.442
854 H ILE 46 H ILE 46 -0.480 15.737 -9.237
855 HA ILE 46 HA ILE 46 -2.415 17.405 -9.792
856 HB ILE 46 HB ILE 46 -2.731 15.201 -8.876
857 1HG1 ILE 46 1HG1 ILE 46 -4.668 15.516 -7.381
858 2HG1 ILE 46 2HG1 ILE 46 -4.276 17.231 -7.197
859 1HG2 ILE 46 1HG2 ILE 46 -0.986 15.377 -7.083
860 2HG2 ILE 46 2HG2 ILE 46 -2.153 16.227 -6.071
861 3HG2 ILE 46 3HG2 ILE 46 -2.494 14.584 -6.600
862 1HD1 ILE 46 1HD1 ILE 46 -4.620 17.593 -9.607
863 2HD1 ILE 46 2HD1 ILE 46 -4.814 15.842 -9.862
864 3HD1 ILE 46 3HD1 ILE 46 -6.028 16.753 -8.934
865 H LEU 47 H LEU 47 -2.745 19.533 -9.532
866 HA LEU 47 HA LEU 47 -2.100 20.818 -6.916
867 1HB LEU 47 1HB LEU 47 -1.074 21.522 -9.312
868 2HB LEU 47 2HB LEU 47 -2.618 22.367 -9.437
869 HG LEU 47 HG LEU 47 -2.004 23.348 -7.077
870 1HD1 LEU 47 1HD1 LEU 47 -0.092 21.757 -6.633
871 2HD1 LEU 47 2HD1 LEU 47 0.761 22.437 -8.026
872 3HD1 LEU 47 3HD1 LEU 47 0.421 23.450 -6.611
873 1HD2 LEU 47 1HD2 LEU 47 -0.377 24.092 -9.548
874 2HD2 LEU 47 2HD2 LEU 47 -2.003 24.686 -9.141
875 3HD2 LEU 47 3HD2 LEU 47 -0.621 25.120 -8.119
876 H GLY 48 H GLY 48 -3.757 22.055 -5.936
877 1HA GLY 48 1HA GLY 48 -5.854 23.012 -5.680
878 2HA GLY 48 2HA GLY 48 -6.324 22.479 -7.298
879 1HN NH2 49 1HN NH2 49 -6.156 19.780 -7.339
880 2HN NH2 49 2HN NH2 49 -7.153 19.049 -6.053
Start of MODEL 7
1 1H ACE 0 H1 ACE 0 -7.860 16.640 5.992
2 2H ACE 0 H2 ACE 0 -7.107 17.131 4.460
3 3H ACE 0 H3 ACE 0 -8.285 15.798 4.487
4 H ASP 1 H ASP 1 -7.677 13.921 5.936
5 HA ASP 1 HA ASP 1 -5.015 13.698 6.896
6 1HB ASP 1 1HB ASP 1 -7.468 12.305 7.230
7 2HB ASP 1 2HB ASP 1 -6.349 11.092 6.635
8 H TYR 2 H TYR 2 -5.889 13.505 3.754
9 HA TYR 2 HA TYR 2 -5.262 11.544 2.259
10 1HB TYR 2 1HB TYR 2 -3.948 14.264 2.021
11 2HB TYR 2 2HB TYR 2 -4.187 13.084 0.741
12 HD1 TYR 2 HD1 TYR 2 -6.657 12.213 0.378
13 HD2 TYR 2 HD2 TYR 2 -5.637 15.928 2.316
14 HE1 TYR 2 HE1 TYR 2 -8.955 13.027 0.013
15 HE2 TYR 2 HE2 TYR 2 -7.987 16.676 2.081
16 HH TYR 2 HH TYR 2 -10.464 14.729 0.408
17 H LEU 3 H LEU 3 -2.499 13.345 3.670
18 HA LEU 3 HA LEU 3 -0.548 11.648 2.524
19 1HB LEU 3 1HB LEU 3 -0.508 13.297 5.104
20 2HB LEU 3 2HB LEU 3 0.948 12.586 4.405
21 HG LEU 3 HG LEU 3 -0.788 14.503 2.787
22 1HD1 LEU 3 1HD1 LEU 3 -0.236 15.667 4.869
23 2HD1 LEU 3 2HD1 LEU 3 1.477 15.231 4.685
24 3HD1 LEU 3 3HD1 LEU 3 0.703 16.326 3.519
25 1HD2 LEU 3 1HD2 LEU 3 2.180 13.790 2.685
26 2HD2 LEU 3 2HD2 LEU 3 0.941 13.172 1.574
27 3HD2 LEU 3 3HD2 LEU 3 1.328 14.899 1.593
28 H ARG 4 H ARG 4 -1.972 11.436 5.793
29 HA ARG 4 HA ARG 4 -0.542 8.907 6.283
30 1HB ARG 4 1HB ARG 4 -2.610 10.452 7.881
31 2HB ARG 4 2HB ARG 4 -1.876 8.927 8.395
32 1HG ARG 4 1HG ARG 4 0.384 9.933 8.246
33 2HG ARG 4 2HG ARG 4 -0.327 11.499 7.821
34 1HD ARG 4 1HD ARG 4 -0.885 9.964 10.403
35 2HD ARG 4 2HD ARG 4 0.291 11.285 10.219
36 HE ARG 4 HE ARG 4 -2.346 12.061 9.311
37 1HH1 ARG 4 1HH2 ARG 4 -0.497 11.466 12.247
38 2HH1 ARG 4 2HH2 ARG 4 -1.308 12.685 13.194
39 1HH2 ARG 4 1HH1 ARG 4 -3.411 13.658 10.489
40 2HH2 ARG 4 2HH1 ARG 4 -3.014 13.984 12.157
41 H GLU 5 H GLU 5 -2.967 9.580 4.180
42 HA GLU 5 HA GLU 5 -4.520 7.095 4.866
43 1HB GLU 5 1HB GLU 5 -5.253 9.605 3.384
44 2HB GLU 5 2HB GLU 5 -5.973 8.073 2.878
45 1HG GLU 5 1HG GLU 5 -5.985 8.960 5.786
46 2HG GLU 5 2HG GLU 5 -7.258 9.433 4.644
47 H LEU 6 H LEU 6 -3.295 8.767 1.883
48 HA LEU 6 HA LEU 6 -3.248 6.497 0.258
49 1HB LEU 6 1HB LEU 6 -1.489 8.957 0.392
50 2HB LEU 6 2HB LEU 6 -1.253 7.708 -0.826
51 HG LEU 6 HG LEU 6 -3.379 8.210 -1.930
52 1HD1 LEU 6 1HD1 LEU 6 -4.755 8.565 0.152
53 2HD1 LEU 6 2HD1 LEU 6 -4.103 10.229 0.168
54 3HD1 LEU 6 3HD1 LEU 6 -5.017 9.591 -1.220
55 1HD2 LEU 6 1HD2 LEU 6 -2.066 10.811 -1.157
56 2HD2 LEU 6 2HD2 LEU 6 -1.351 9.623 -2.267
57 3HD2 LEU 6 3HD2 LEU 6 -2.883 10.378 -2.677
58 H LEU 7 H LEU 7 -0.953 7.480 2.783
59 HA LEU 7 HA LEU 7 1.180 5.795 1.939
60 1HB LEU 7 1HB LEU 7 1.675 7.787 3.197
61 2HB LEU 7 2HB LEU 7 0.593 7.300 4.510
62 HG LEU 7 HG LEU 7 2.078 5.488 5.170
63 1HD1 LEU 7 1HD1 LEU 7 3.044 4.829 3.010
64 2HD1 LEU 7 2HD1 LEU 7 3.868 6.399 2.868
65 3HD1 LEU 7 3HD1 LEU 7 4.328 5.249 4.143
66 1HD2 LEU 7 1HD2 LEU 7 3.584 8.106 4.782
67 2HD2 LEU 7 2HD2 LEU 7 2.430 7.755 6.088
68 3HD2 LEU 7 3HD2 LEU 7 3.947 6.844 5.979
69 H LYS 8 H LYS 8 -1.273 5.695 4.496
70 HA LYS 8 HA LYS 8 -0.438 3.297 5.712
71 1HB LYS 8 1HB LYS 8 -1.632 4.983 6.948
72 2HB LYS 8 2HB LYS 8 -2.970 4.981 5.786
73 1HG LYS 8 1HG LYS 8 -3.782 2.888 6.519
74 2HG LYS 8 2HG LYS 8 -2.336 2.556 7.497
75 1HD LYS 8 1HD LYS 8 -2.859 4.223 9.092
76 2HD LYS 8 2HD LYS 8 -3.976 5.069 8.018
77 1HE LYS 8 1HE LYS 8 -4.537 2.265 9.090
78 2HE LYS 8 2HE LYS 8 -5.056 3.753 9.903
79 1HZ LYS 8 1HZ LYS 8 -6.261 4.367 7.949
80 2HZ LYS 8 2HZ LYS 8 -5.812 2.986 7.175
81 3HZ LYS 8 3HZ LYS 8 -6.774 2.907 8.511
82 H LEU 9 H LEU 9 -2.661 4.256 3.183
83 HA LEU 9 HA LEU 9 -3.999 1.663 2.945
84 1HB LEU 9 1HB LEU 9 -3.815 4.067 1.106
85 2HB LEU 9 2HB LEU 9 -4.741 2.605 0.758
86 HG LEU 9 HG LEU 9 -5.237 4.199 3.298
87 1HD1 LEU 9 1HD1 LEU 9 -5.567 5.699 1.347
88 2HD1 LEU 9 2HD1 LEU 9 -6.657 4.502 0.618
89 3HD1 LEU 9 3HD1 LEU 9 -7.097 5.299 2.142
90 1HD2 LEU 9 1HD2 LEU 9 -6.959 2.234 1.725
91 2HD2 LEU 9 2HD2 LEU 9 -6.170 1.904 3.280
92 3HD2 LEU 9 3HD2 LEU 9 -7.452 3.114 3.184
93 H GLU 10 H GLU 10 -1.301 3.309 1.280
94 HA GLU 10 HA GLU 10 -0.655 1.190 -0.583
95 1HB GLU 10 1HB GLU 10 0.918 3.413 0.674
96 2HB GLU 10 2HB GLU 10 1.604 2.160 -0.355
97 1HG GLU 10 1HG GLU 10 -0.644 4.002 -1.188
98 2HG GLU 10 2HG GLU 10 1.071 4.171 -1.625
99 H LEU 11 H LEU 11 0.448 1.837 2.785
100 HA LEU 11 HA LEU 11 2.330 -0.215 2.878
101 1HB LEU 11 1HB LEU 11 1.401 1.666 4.676
102 2HB LEU 11 2HB LEU 11 0.726 0.206 5.377
103 HG LEU 11 HG LEU 11 2.816 0.677 6.411
104 1HD1 LEU 11 1HD1 LEU 11 2.401 -1.733 5.885
105 2HD1 LEU 11 2HD1 LEU 11 3.431 -1.568 4.444
106 3HD1 LEU 11 3HD1 LEU 11 4.117 -1.319 6.054
107 1HD2 LEU 11 1HD2 LEU 11 4.166 0.758 3.676
108 2HD2 LEU 11 2HD2 LEU 11 3.756 2.164 4.676
109 3HD2 LEU 11 3HD2 LEU 11 4.934 0.976 5.255
110 H GLN 12 H GLN 12 -1.188 -0.389 3.408
111 HA GLN 12 HA GLN 12 -1.258 -3.136 4.229
112 1HB GLN 12 1HB GLN 12 -3.344 -1.310 3.009
113 2HB GLN 12 2HB GLN 12 -3.680 -2.975 3.491
114 1HG GLN 12 1HG GLN 12 -3.208 -2.574 5.774
115 2HG GLN 12 2HG GLN 12 -2.407 -1.032 5.451
116 1HE2 GLN 12 2HE2 GLN 12 -3.651 0.814 4.920
117 2HE2 GLN 12 1HE2 GLN 12 -5.387 0.875 5.265
118 H LEU 13 H LEU 13 -0.689 -1.768 1.049
119 HA LEU 13 HA LEU 13 -1.522 -4.127 -0.441
120 1HB LEU 13 1HB LEU 13 0.476 -1.971 -1.281
121 2HB LEU 13 2HB LEU 13 -0.244 -3.238 -2.248
122 HG LEU 13 HG LEU 13 -1.549 -0.738 -1.173
123 1HD1 LEU 13 1HD1 LEU 13 -0.315 -0.595 -3.292
124 2HD1 LEU 13 2HD1 LEU 13 -1.149 -2.000 -3.934
125 3HD1 LEU 13 3HD1 LEU 13 -2.048 -0.504 -3.660
126 1HD2 LEU 13 1HD2 LEU 13 -2.945 -3.175 -2.293
127 2HD2 LEU 13 2HD2 LEU 13 -3.207 -2.423 -0.708
128 3HD2 LEU 13 3HD2 LEU 13 -3.688 -1.569 -2.178
129 H ILE 14 H ILE 14 1.583 -2.679 0.682
130 HA ILE 14 HA ILE 14 3.180 -4.964 -0.109
131 HB ILE 14 HB ILE 14 3.598 -2.561 1.697
132 1HG1 ILE 14 1HG1 ILE 14 5.233 -1.941 0.023
133 2HG1 ILE 14 2HG1 ILE 14 5.116 -3.507 -0.786
134 1HG2 ILE 14 1HG2 ILE 14 4.977 -4.302 2.773
135 2HG2 ILE 14 2HG2 ILE 14 5.674 -4.742 1.195
136 3HG2 ILE 14 3HG2 ILE 14 5.990 -3.152 1.893
137 1HD1 ILE 14 1HD1 ILE 14 2.887 -2.958 -1.618
138 2HD1 ILE 14 2HD1 ILE 14 2.858 -1.482 -0.627
139 3HD1 ILE 14 3HD1 ILE 14 4.007 -1.660 -1.972
140 H LYS 15 H LYS 15 1.314 -4.249 2.860
141 HA LYS 15 HA LYS 15 2.303 -6.558 4.231
142 1HB LYS 15 1HB LYS 15 0.699 -4.394 4.902
143 2HB LYS 15 2HB LYS 15 -0.484 -5.686 4.786
144 1HG LYS 15 1HG LYS 15 0.243 -5.576 7.041
145 2HG LYS 15 2HG LYS 15 1.001 -7.030 6.372
146 1HD LYS 15 1HD LYS 15 3.148 -5.769 6.084
147 2HD LYS 15 2HD LYS 15 2.350 -4.279 6.606
148 1HE LYS 15 1HE LYS 15 1.965 -5.235 8.845
149 2HE LYS 15 2HE LYS 15 2.670 -6.781 8.332
150 1HZ LYS 15 1HZ LYS 15 4.739 -5.653 7.968
151 2HZ LYS 15 2HZ LYS 15 4.089 -4.210 8.422
152 3HZ LYS 15 3HZ LYS 15 4.232 -5.429 9.521
153 H GLN 16 H GLN 16 -0.595 -6.011 2.130
154 HA GLN 16 HA GLN 16 -1.482 -8.744 2.501
155 1HB GLN 16 1HB GLN 16 -2.362 -6.437 0.804
156 2HB GLN 16 2HB GLN 16 -2.692 -8.040 0.175
157 1HG GLN 16 1HG GLN 16 -4.590 -7.358 1.403
158 2HG GLN 16 2HG GLN 16 -3.835 -8.717 2.231
159 1HE2 GLN 16 2HE2 GLN 16 -5.636 -6.305 3.052
160 2HE2 GLN 16 1HE2 GLN 16 -4.827 -5.721 4.499
161 H TYR 17 H TYR 17 0.645 -7.205 0.195
162 HA TYR 17 HA TYR 17 0.857 -9.366 -1.677
163 1HB TYR 17 1HB TYR 17 2.616 -7.022 -0.825
164 2HB TYR 17 2HB TYR 17 3.177 -8.121 -2.030
165 HD1 TYR 17 HD1 TYR 17 2.790 -5.101 -2.205
166 HD2 TYR 17 HD2 TYR 17 0.574 -8.484 -3.662
167 HE1 TYR 17 HE1 TYR 17 2.226 -3.848 -4.225
168 HE2 TYR 17 HE2 TYR 17 0.155 -7.291 -5.767
169 HH TYR 17 HH TYR 17 0.736 -5.420 -7.054
170 H ARG 18 H ARG 18 2.420 -8.616 1.393
171 HA ARG 18 HA ARG 18 4.471 -10.699 1.066
172 1HB ARG 18 1HB ARG 18 3.598 -9.019 3.436
173 2HB ARG 18 2HB ARG 18 4.775 -10.344 3.553
174 1HG ARG 18 1HG ARG 18 6.278 -9.262 1.974
175 2HG ARG 18 2HG ARG 18 5.106 -7.985 1.665
176 1HD ARG 18 1HD ARG 18 6.706 -7.077 3.158
177 2HD ARG 18 2HD ARG 18 5.259 -7.322 4.116
178 HE ARG 18 HE ARG 18 7.863 -8.731 4.236
179 1HH1 ARG 18 1HH2 ARG 18 4.527 -8.764 5.389
180 2HH1 ARG 18 2HH2 ARG 18 4.869 -9.730 6.798
181 1HH2 ARG 18 1HH1 ARG 18 8.331 -9.995 6.035
182 2HH2 ARG 18 2HH1 ARG 18 7.092 -10.459 7.165
183 H GLU 19 H GLU 19 1.471 -10.213 2.805
184 HA GLU 19 HA GLU 19 1.134 -12.720 3.998
185 1HB GLU 19 1HB GLU 19 -0.319 -10.651 4.254
186 2HB GLU 19 2HB GLU 19 -1.075 -11.097 2.716
187 1HG GLU 19 1HG GLU 19 -1.835 -13.227 3.678
188 2HG GLU 19 2HG GLU 19 -1.007 -12.847 5.200
189 H ALA 20 H ALA 20 0.229 -11.676 0.630
190 HA ALA 20 HA ALA 20 -0.629 -14.454 0.120
191 1HB ALA 20 1HB ALA 20 -2.065 -12.891 -0.737
192 2HB ALA 20 2HB ALA 20 -0.754 -11.918 -1.421
193 3HB ALA 20 3HB ALA 20 -1.191 -13.479 -2.164
194 H LEU 21 H LEU 21 2.400 -12.788 -0.184
195 HA LEU 21 HA LEU 21 3.506 -13.838 -2.433
196 1HB LEU 21 1HB LEU 21 4.630 -12.312 -0.779
197 2HB LEU 21 2HB LEU 21 4.902 -13.708 0.267
198 HG LEU 21 HG LEU 21 6.345 -14.726 -1.509
199 1HD1 LEU 21 1HD1 LEU 21 5.418 -13.617 -3.549
200 2HD1 LEU 21 2HD1 LEU 21 5.953 -12.042 -2.899
201 3HD1 LEU 21 3HD1 LEU 21 7.138 -13.267 -3.375
202 1HD2 LEU 21 1HD2 LEU 21 7.104 -11.873 -0.729
203 2HD2 LEU 21 2HD2 LEU 21 7.335 -13.320 0.279
204 3HD2 LEU 21 3HD2 LEU 21 8.225 -13.146 -1.246
205 H GLU 22 H GLU 22 2.879 -15.605 0.557
206 HA GLU 22 HA GLU 22 4.263 -18.025 -0.306
207 1HB GLU 22 1HB GLU 22 2.595 -17.257 2.117
208 2HB GLU 22 2HB GLU 22 3.054 -18.936 1.813
209 1HG GLU 22 1HG GLU 22 5.146 -16.726 1.909
210 2HG GLU 22 2HG GLU 22 4.599 -17.597 3.347
211 H TYR 23 H TYR 23 0.958 -16.760 -0.292
212 HA TYR 23 HA TYR 23 -0.356 -19.254 -0.920
213 1HB TYR 23 1HB TYR 23 -1.075 -16.420 -0.746
214 2HB TYR 23 2HB TYR 23 -1.723 -17.118 -2.208
215 HD1 TYR 23 HD1 TYR 23 -3.152 -19.223 -2.062
216 HD2 TYR 23 HD2 TYR 23 -2.125 -16.834 1.377
217 HE1 TYR 23 HE1 TYR 23 -5.159 -20.071 -0.865
218 HE2 TYR 23 HE2 TYR 23 -4.119 -17.683 2.565
219 HH TYR 23 HH TYR 23 -6.035 -18.944 2.405
220 H VAL 24 H VAL 24 1.254 -16.702 -2.787
221 HA VAL 24 HA VAL 24 0.524 -18.067 -5.321
222 HB VAL 24 HB VAL 24 2.029 -15.460 -4.979
223 1HG1 VAL 24 1HG1 VAL 24 2.138 -16.526 -7.255
224 2HG1 VAL 24 2HG1 VAL 24 0.373 -16.629 -7.277
225 3HG1 VAL 24 3HG1 VAL 24 1.174 -15.047 -7.276
226 1HG2 VAL 24 1HG2 VAL 24 -0.949 -16.058 -5.210
227 2HG2 VAL 24 2HG2 VAL 24 -0.164 -15.204 -3.878
228 3HG2 VAL 24 3HG2 VAL 24 -0.251 -14.443 -5.465
229 H LYS 25 H LYS 25 3.423 -17.540 -3.362
230 HA LYS 25 HA LYS 25 5.578 -18.128 -3.560
231 1HB LYS 25 1HB LYS 25 4.506 -20.474 -5.163
232 2HB LYS 25 2HB LYS 25 6.126 -20.319 -4.474
233 1HG LYS 25 1HG LYS 25 4.980 -20.009 -2.185
234 2HG LYS 25 2HG LYS 25 3.500 -20.597 -2.957
235 1HD LYS 25 1HD LYS 25 6.173 -22.078 -3.010
236 2HD LYS 25 2HD LYS 25 4.950 -22.349 -1.765
237 1HE LYS 25 1HE LYS 25 3.456 -23.394 -3.204
238 2HE LYS 25 2HE LYS 25 4.064 -22.582 -4.648
239 1HZ LYS 25 1HZ LYS 25 6.003 -23.899 -4.582
240 2HZ LYS 25 2HZ LYS 25 5.527 -24.663 -3.200
241 3HZ LYS 25 3HZ LYS 25 4.676 -24.871 -4.598
242 H LEU 26 H LEU 26 5.332 -16.065 -5.034
243 HA LEU 26 HA LEU 26 6.525 -16.698 -7.711
244 1HB LEU 26 1HB LEU 26 4.203 -16.152 -7.942
245 2HB LEU 26 2HB LEU 26 4.403 -14.700 -6.960
246 HG LEU 26 HG LEU 26 6.109 -13.963 -8.803
247 1HD1 LEU 26 1HD1 LEU 26 6.245 -16.170 -9.975
248 2HD1 LEU 26 2HD1 LEU 26 4.517 -16.052 -10.354
249 3HD1 LEU 26 3HD1 LEU 26 5.660 -14.888 -11.046
250 1HD2 LEU 26 1HD2 LEU 26 3.153 -14.114 -9.444
251 2HD2 LEU 26 2HD2 LEU 26 3.927 -12.905 -8.399
252 3HD2 LEU 26 3HD2 LEU 26 4.349 -12.970 -10.107
253 HA PRO 27 HA PRO 27 9.534 -13.812 -5.885
254 1HB PRO 27 1HB PRO 27 11.485 -13.903 -7.795
255 2HB PRO 27 2HB PRO 27 11.225 -15.187 -6.583
256 1HG PRO 27 1HG PRO 27 10.227 -15.127 -9.440
257 2HG PRO 27 2HG PRO 27 11.050 -16.469 -8.593
258 1HD PRO 27 1HD PRO 27 8.351 -16.361 -8.855
259 2HD PRO 27 2HD PRO 27 9.087 -17.002 -7.358
260 H VAL 28 H VAL 28 8.237 -13.621 -9.247
261 HA VAL 28 HA VAL 28 8.817 -10.895 -9.742
262 HB VAL 28 HB VAL 28 6.623 -12.710 -10.597
263 1HG1 VAL 28 1HG1 VAL 28 5.385 -10.624 -10.372
264 2HG1 VAL 28 2HG1 VAL 28 6.705 -9.721 -11.158
265 3HG1 VAL 28 3HG1 VAL 28 5.739 -10.888 -12.076
266 1HG2 VAL 28 1HG2 VAL 28 8.626 -11.061 -12.171
267 2HG2 VAL 28 2HG2 VAL 28 8.830 -12.780 -11.745
268 3HG2 VAL 28 3HG2 VAL 28 7.510 -12.274 -12.819
269 H LEU 29 H LEU 29 6.505 -12.349 -7.456
270 HA LEU 29 HA LEU 29 4.989 -9.918 -7.085
271 1HB LEU 29 1HB LEU 29 4.813 -12.619 -6.155
272 2HB LEU 29 2HB LEU 29 4.916 -11.585 -4.734
273 HG LEU 29 HG LEU 29 2.981 -11.005 -6.988
274 1HD1 LEU 29 1HD1 LEU 29 2.521 -13.283 -6.241
275 2HD1 LEU 29 2HD1 LEU 29 2.540 -12.771 -4.541
276 3HD1 LEU 29 3HD1 LEU 29 1.267 -12.191 -5.636
277 1HD2 LEU 29 1HD2 LEU 29 2.951 -10.325 -4.003
278 2HD2 LEU 29 2HD2 LEU 29 3.451 -9.201 -5.285
279 3HD2 LEU 29 3HD2 LEU 29 1.783 -9.798 -5.230
280 H ALA 30 H ALA 30 7.560 -11.546 -5.150
281 HA ALA 30 HA ALA 30 8.458 -9.362 -3.580
282 1HB ALA 30 1HB ALA 30 9.424 -11.651 -3.490
283 2HB ALA 30 2HB ALA 30 10.347 -11.248 -4.956
284 3HB ALA 30 3HB ALA 30 10.579 -10.309 -3.480
285 H LYS 31 H LYS 31 9.251 -9.669 -6.977
286 HA LYS 31 HA LYS 31 10.727 -7.133 -6.632
287 1HB LYS 31 1HB LYS 31 10.147 -8.885 -8.989
288 2HB LYS 31 2HB LYS 31 10.709 -7.224 -9.248
289 1HG LYS 31 1HG LYS 31 12.710 -7.502 -8.108
290 2HG LYS 31 2HG LYS 31 12.171 -8.914 -7.198
291 1HD LYS 31 1HD LYS 31 12.428 -9.052 -10.215
292 2HD LYS 31 2HD LYS 31 13.855 -9.242 -9.175
293 1HE LYS 31 1HE LYS 31 12.877 -11.109 -7.983
294 2HE LYS 31 2HE LYS 31 11.314 -10.883 -8.783
295 1HZ LYS 31 1HZ LYS 31 12.308 -11.465 -10.841
296 2HZ LYS 31 2HZ LYS 31 13.798 -11.624 -10.150
297 3HZ LYS 31 3HZ LYS 31 12.583 -12.659 -9.738
298 H ILE 32 H ILE 32 7.380 -7.851 -7.452
299 HA ILE 32 HA ILE 32 6.858 -5.161 -8.491
300 HB ILE 32 HB ILE 32 5.140 -7.483 -7.525
301 1HG1 ILE 32 1HG1 ILE 32 5.355 -6.077 -10.228
302 2HG1 ILE 32 2HG1 ILE 32 6.266 -7.520 -9.791
303 1HG2 ILE 32 1HG2 ILE 32 3.926 -5.543 -6.773
304 2HG2 ILE 32 2HG2 ILE 32 4.250 -4.689 -8.288
305 3HG2 ILE 32 3HG2 ILE 32 3.151 -6.084 -8.251
306 1HD1 ILE 32 1HD1 ILE 32 4.083 -8.719 -9.378
307 2HD1 ILE 32 2HD1 ILE 32 3.244 -7.314 -10.079
308 3HD1 ILE 32 3HD1 ILE 32 4.386 -8.238 -11.060
309 H LEU 33 H LEU 33 6.749 -6.923 -5.390
310 HA LEU 33 HA LEU 33 5.282 -4.849 -4.081
311 1HB LEU 33 1HB LEU 33 4.937 -6.385 -2.527
312 2HB LEU 33 2HB LEU 33 5.450 -7.455 -3.817
313 HG LEU 33 HG LEU 33 7.632 -7.645 -2.740
314 1HD1 LEU 33 1HD1 LEU 33 7.812 -5.692 -1.363
315 2HD1 LEU 33 2HD1 LEU 33 6.211 -6.016 -0.643
316 3HD1 LEU 33 3HD1 LEU 33 7.606 -7.082 -0.287
317 1HD2 LEU 33 1HD2 LEU 33 5.136 -8.184 -1.029
318 2HD2 LEU 33 2HD2 LEU 33 5.545 -9.157 -2.448
319 3HD2 LEU 33 3HD2 LEU 33 6.605 -9.167 -1.022
320 H GLU 34 H GLU 34 8.699 -5.824 -4.267
321 HA GLU 34 HA GLU 34 9.873 -3.867 -2.573
322 1HB GLU 34 1HB GLU 34 10.907 -5.886 -3.822
323 2HB GLU 34 2HB GLU 34 11.057 -4.819 -5.203
324 1HG GLU 34 1HG GLU 34 12.184 -4.190 -2.422
325 2HG GLU 34 2HG GLU 34 13.100 -5.016 -3.687
326 H ASP 35 H ASP 35 9.257 -3.748 -6.096
327 HA ASP 35 HA ASP 35 10.181 -1.127 -6.469
328 1HB ASP 35 1HB ASP 35 9.585 -2.773 -8.275
329 2HB ASP 35 2HB ASP 35 7.878 -2.384 -8.011
330 H GLU 36 H GLU 36 6.807 -2.194 -5.861
331 HA GLU 36 HA GLU 36 5.546 0.301 -5.620
332 1HB GLU 36 1HB GLU 36 5.078 -2.226 -3.997
333 2HB GLU 36 2HB GLU 36 4.015 -0.816 -4.054
334 1HG GLU 36 1HG GLU 36 4.602 -1.796 -6.764
335 2HG GLU 36 2HG GLU 36 3.928 -3.067 -5.744
336 H GLU 37 H GLU 37 7.401 -1.558 -3.038
337 HA GLU 37 HA GLU 37 6.825 0.129 -0.967
338 1HB GLU 37 1HB GLU 37 8.128 -2.199 -1.286
339 2HB GLU 37 2HB GLU 37 9.561 -1.189 -1.179
340 1HG GLU 37 1HG GLU 37 7.242 -1.080 0.781
341 2HG GLU 37 2HG GLU 37 8.467 -2.343 0.828
342 H LYS 38 H LYS 38 9.328 0.532 -3.491
343 HA LYS 38 HA LYS 38 10.476 2.878 -2.278
344 1HB LYS 38 1HB LYS 38 11.490 1.405 -4.128
345 2HB LYS 38 2HB LYS 38 10.353 2.175 -5.237
346 1HG LYS 38 1HG LYS 38 12.355 3.419 -5.500
347 2HG LYS 38 2HG LYS 38 11.338 4.437 -4.478
348 1HD LYS 38 1HD LYS 38 12.608 3.212 -2.474
349 2HD LYS 38 2HD LYS 38 13.760 2.762 -3.733
350 1HE LYS 38 1HE LYS 38 14.006 5.225 -4.284
351 2HE LYS 38 2HE LYS 38 12.878 5.591 -2.958
352 1HZ LYS 38 1HZ LYS 38 14.395 4.565 -1.444
353 2HZ LYS 38 2HZ LYS 38 15.463 4.241 -2.662
354 3HZ LYS 38 3HZ LYS 38 15.126 5.803 -2.251
355 H HIS 39 H HIS 39 7.882 2.503 -4.733
356 HA HIS 39 HA HIS 39 7.458 5.299 -5.180
357 1HB HIS 39 1HB HIS 39 5.585 2.895 -5.263
358 2HB HIS 39 2HB HIS 39 5.044 4.516 -5.603
359 HD1 HIS 39 HD1 HIS 39 6.455 5.758 -7.741
360 HD2 HIS 39 HD2 HIS 39 6.712 1.586 -7.225
361 HE1 HIS 39 HE1 HIS 39 7.349 4.799 -9.950
362 HE2 HIS 39 HE2 HIS 39 7.510 2.242 -9.601
363 H ILE 40 H ILE 40 6.219 3.086 -2.694
364 HA ILE 40 HA ILE 40 4.510 5.089 -1.547
365 HB ILE 40 HB ILE 40 5.535 2.462 -0.392
366 1HG1 ILE 40 1HG1 ILE 40 2.885 2.941 -1.803
367 2HG1 ILE 40 2HG1 ILE 40 4.235 2.454 -2.733
368 1HG2 ILE 40 1HG2 ILE 40 4.478 3.888 1.336
369 2HG2 ILE 40 2HG2 ILE 40 3.064 4.129 0.292
370 3HG2 ILE 40 3HG2 ILE 40 3.422 2.529 0.971
371 1HD1 ILE 40 1HD1 ILE 40 4.634 0.461 -1.459
372 2HD1 ILE 40 2HD1 ILE 40 3.278 0.790 -0.386
373 3HD1 ILE 40 3HD1 ILE 40 2.989 0.490 -2.115
374 H GLU 41 H GLU 41 7.805 3.926 -0.912
375 HA GLU 41 HA GLU 41 8.352 5.330 1.425
376 1HB GLU 41 1HB GLU 41 9.859 3.648 0.189
377 2HB GLU 41 2HB GLU 41 10.304 4.991 -0.879
378 1HG GLU 41 1HG GLU 41 10.707 6.086 1.637
379 2HG GLU 41 2HG GLU 41 11.110 4.389 1.902
380 H TRP 42 H TRP 42 8.221 6.465 -2.001
381 HA TRP 42 HA TRP 42 9.311 8.960 -1.739
382 1HB TRP 42 1HB TRP 42 8.209 7.710 -3.742
383 2HB TRP 42 2HB TRP 42 6.737 8.543 -3.245
384 HD1 TRP 42 HD1 TRP 42 10.179 9.195 -4.671
385 HE1 TRP 42 HE1 TRP 42 10.394 11.667 -5.411
386 HE3 TRP 42 HE3 TRP 42 5.787 10.849 -2.869
387 HZ2 TRP 42 HZ2 TRP 42 8.751 14.068 -5.270
388 HZ3 TRP 42 HZ3 TRP 42 5.075 13.252 -3.152
389 HH2 TRP 42 HH2 TRP 42 6.595 14.860 -4.291
390 H LEU 43 H LEU 43 6.015 7.930 -0.780
391 HA LEU 43 HA LEU 43 5.166 10.574 0.041
392 1HB LEU 43 1HB LEU 43 4.102 7.750 0.608
393 2HB LEU 43 2HB LEU 43 3.422 9.183 1.353
394 HG LEU 43 HG LEU 43 3.545 9.899 -1.338
395 1HD1 LEU 43 1HD1 LEU 43 4.054 7.542 -1.920
396 2HD1 LEU 43 2HD1 LEU 43 2.528 7.048 -1.150
397 3HD1 LEU 43 3HD1 LEU 43 2.517 8.121 -2.577
398 1HD2 LEU 43 1HD2 LEU 43 1.213 8.691 0.252
399 2HD2 LEU 43 2HD2 LEU 43 1.677 10.404 0.235
400 3HD2 LEU 43 3HD2 LEU 43 1.047 9.643 -1.235
401 H GLU 44 H GLU 44 6.853 7.928 1.734
402 HA GLU 44 HA GLU 44 6.325 9.297 4.264
403 1HB GLU 44 1HB GLU 44 6.904 7.391 5.360
404 2HB GLU 44 2HB GLU 44 6.317 6.740 3.820
405 1HG GLU 44 1HG GLU 44 8.751 6.735 3.073
406 2HG GLU 44 2HG GLU 44 9.183 7.177 4.728
407 H THR 45 H THR 45 8.854 9.174 1.977
408 HA THR 45 HA THR 45 10.840 10.351 3.828
409 HB THR 45 HB THR 45 11.162 8.499 1.999
410 HG1 THR 45 HG1 THR 45 13.278 8.937 2.109
411 1HG2 THR 45 1HG2 THR 45 10.474 9.777 0.015
412 2HG2 THR 45 2HG2 THR 45 11.812 10.923 0.297
413 3HG2 THR 45 3HG2 THR 45 12.145 9.225 -0.074
414 H ILE 46 H ILE 46 9.121 11.031 0.796
415 HA ILE 46 HA ILE 46 8.571 12.923 -0.269
416 HB ILE 46 HB ILE 46 6.803 12.443 1.116
417 1HG1 ILE 46 1HG1 ILE 46 5.599 14.439 1.499
418 2HG1 ILE 46 2HG1 ILE 46 7.046 15.438 1.449
419 1HG2 ILE 46 1HG2 ILE 46 7.726 12.093 3.247
420 2HG2 ILE 46 2HG2 ILE 46 8.180 13.800 3.426
421 3HG2 ILE 46 3HG2 ILE 46 6.468 13.289 3.417
422 1HD1 ILE 46 1HD1 ILE 46 7.408 14.788 -0.924
423 2HD1 ILE 46 2HD1 ILE 46 6.056 13.638 -0.814
424 3HD1 ILE 46 3HD1 ILE 46 5.752 15.386 -0.713
425 H LEU 47 H LEU 47 11.198 12.981 0.297
426 HA LEU 47 HA LEU 47 11.818 15.889 0.185
427 1HB LEU 47 1HB LEU 47 12.975 13.709 1.943
428 2HB LEU 47 2HB LEU 47 14.055 14.970 1.351
429 HG LEU 47 HG LEU 47 11.456 15.772 2.679
430 1HD1 LEU 47 1HD1 LEU 47 12.462 14.222 4.263
431 2HD1 LEU 47 2HD1 LEU 47 14.039 15.029 4.111
432 3HD1 LEU 47 3HD1 LEU 47 12.659 15.884 4.839
433 1HD2 LEU 47 1HD2 LEU 47 14.237 17.039 2.548
434 2HD2 LEU 47 2HD2 LEU 47 12.879 17.476 1.492
435 3HD2 LEU 47 3HD2 LEU 47 12.778 17.777 3.234
436 H GLY 48 H GLY 48 11.447 15.261 -2.085
437 1HA GLY 48 1HA GLY 48 12.453 15.008 -4.161
438 2HA GLY 48 2HA GLY 48 13.956 14.482 -3.391
439 1HN NH2 49 1HN NH2 49 12.663 10.981 -2.984
440 2HN NH2 49 2HN NH2 49 13.420 12.278 -2.025
441 1H ACE 0 H1 ACE 0 -7.898 -18.543 -6.158
442 2H ACE 0 H2 ACE 0 -8.351 -19.780 -4.965
443 3H ACE 0 H3 ACE 0 -6.701 -19.112 -4.975
444 H ASP 1 H ASP 1 -7.646 -18.929 -2.582
445 HA ASP 1 HA ASP 1 -9.493 -16.942 -1.862
446 1HB ASP 1 1HB ASP 1 -8.553 -18.554 -0.256
447 2HB ASP 1 2HB ASP 1 -6.952 -17.813 -0.428
448 H TYR 2 H TYR 2 -5.934 -16.624 -2.174
449 HA TYR 2 HA TYR 2 -5.516 -13.980 -1.656
450 1HB TYR 2 1HB TYR 2 -3.544 -14.228 -2.826
451 2HB TYR 2 2HB TYR 2 -3.887 -15.784 -2.115
452 HD1 TYR 2 HD1 TYR 2 -3.374 -13.905 -5.210
453 HD2 TYR 2 HD2 TYR 2 -4.536 -17.720 -3.565
454 HE1 TYR 2 HE1 TYR 2 -2.884 -14.984 -7.369
455 HE2 TYR 2 HE2 TYR 2 -4.080 -18.793 -5.748
456 HH TYR 2 HH TYR 2 -2.996 -16.930 -8.598
457 H LEU 3 H LEU 3 -6.644 -15.359 -4.708
458 HA LEU 3 HA LEU 3 -6.516 -12.984 -6.247
459 1HB LEU 3 1HB LEU 3 -7.694 -15.707 -6.555
460 2HB LEU 3 2HB LEU 3 -8.532 -14.478 -7.481
461 HG LEU 3 HG LEU 3 -5.531 -14.883 -7.637
462 1HD1 LEU 3 1HD1 LEU 3 -6.663 -16.971 -8.291
463 2HD1 LEU 3 2HD1 LEU 3 -7.732 -16.065 -9.384
464 3HD1 LEU 3 3HD1 LEU 3 -5.989 -16.162 -9.716
465 1HD2 LEU 3 1HD2 LEU 3 -7.541 -13.482 -9.461
466 2HD2 LEU 3 2HD2 LEU 3 -6.287 -12.697 -8.479
467 3HD2 LEU 3 3HD2 LEU 3 -5.824 -13.730 -9.835
468 H ARG 4 H ARG 4 -8.885 -13.714 -3.796
469 HA ARG 4 HA ARG 4 -10.925 -11.935 -4.903
470 1HB ARG 4 1HB ARG 4 -10.272 -12.988 -2.140
471 2HB ARG 4 2HB ARG 4 -11.455 -11.712 -2.347
472 1HG ARG 4 1HG ARG 4 -11.648 -14.363 -3.851
473 2HG ARG 4 2HG ARG 4 -12.343 -14.078 -2.250
474 1HD ARG 4 1HD ARG 4 -14.209 -13.430 -3.389
475 2HD ARG 4 2HD ARG 4 -13.375 -11.900 -3.493
476 HE ARG 4 HE ARG 4 -12.930 -12.207 -5.742
477 1HH1 ARG 4 1HH2 ARG 4 -14.231 -15.188 -4.402
478 2HH1 ARG 4 2HH2 ARG 4 -14.803 -15.814 -5.925
479 1HH2 ARG 4 1HH1 ARG 4 -13.592 -13.013 -7.756
480 2HH2 ARG 4 2HH1 ARG 4 -14.394 -14.554 -7.891
481 H GLU 5 H GLU 5 -7.832 -11.528 -3.359
482 HA GLU 5 HA GLU 5 -8.200 -8.576 -3.185
483 1HB GLU 5 1HB GLU 5 -6.577 -10.404 -1.355
484 2HB GLU 5 2HB GLU 5 -6.563 -8.630 -1.313
485 1HG GLU 5 1HG GLU 5 -9.004 -8.622 -0.818
486 2HG GLU 5 2HG GLU 5 -8.997 -10.392 -0.793
487 H LEU 6 H LEU 6 -5.375 -8.177 -2.823
488 HA LEU 6 HA LEU 6 -3.671 -7.641 -4.227
489 1HB LEU 6 1HB LEU 6 -3.914 -10.549 -5.064
490 2HB LEU 6 2HB LEU 6 -2.632 -9.427 -5.481
491 HG LEU 6 HG LEU 6 -2.365 -9.168 -2.788
492 1HD1 LEU 6 1HD1 LEU 6 -4.405 -10.583 -2.367
493 2HD1 LEU 6 2HD1 LEU 6 -3.481 -11.954 -2.989
494 3HD1 LEU 6 3HD1 LEU 6 -2.926 -11.040 -1.556
495 1HD2 LEU 6 1HD2 LEU 6 -1.408 -11.699 -4.162
496 2HD2 LEU 6 2HD2 LEU 6 -0.793 -10.116 -4.657
497 3HD2 LEU 6 3HD2 LEU 6 -0.551 -10.636 -3.017
498 H LEU 7 H LEU 7 -6.061 -6.751 -5.082
499 HA LEU 7 HA LEU 7 -5.487 -5.794 -7.550
500 1HB LEU 7 1HB LEU 7 -7.386 -6.691 -8.931
501 2HB LEU 7 2HB LEU 7 -5.916 -7.644 -8.840
502 HG LEU 7 HG LEU 7 -7.671 -8.672 -6.805
503 1HD1 LEU 7 1HD1 LEU 7 -9.540 -7.530 -8.010
504 2HD1 LEU 7 2HD1 LEU 7 -9.066 -8.383 -9.494
505 3HD1 LEU 7 3HD1 LEU 7 -9.640 -9.298 -8.085
506 1HD2 LEU 7 1HD2 LEU 7 -6.913 -9.716 -9.571
507 2HD2 LEU 7 2HD2 LEU 7 -6.020 -9.994 -8.062
508 3HD2 LEU 7 3HD2 LEU 7 -7.635 -10.677 -8.269
509 H LYS 8 H LYS 8 -8.525 -6.943 -5.995
510 HA LYS 8 HA LYS 8 -9.898 -4.677 -6.730
511 1HB LYS 8 1HB LYS 8 -10.515 -7.098 -5.509
512 2HB LYS 8 2HB LYS 8 -10.892 -5.973 -4.210
513 1HG LYS 8 1HG LYS 8 -11.920 -5.710 -7.079
514 2HG LYS 8 2HG LYS 8 -12.760 -6.627 -5.826
515 1HD LYS 8 1HD LYS 8 -13.096 -4.683 -4.450
516 2HD LYS 8 2HD LYS 8 -12.063 -3.672 -5.483
517 1HE LYS 8 1HE LYS 8 -13.607 -3.826 -7.341
518 2HE LYS 8 2HE LYS 8 -14.614 -5.012 -6.486
519 1HZ LYS 8 1HZ LYS 8 -15.153 -3.358 -4.889
520 2HZ LYS 8 2HZ LYS 8 -14.164 -2.248 -5.601
521 3HZ LYS 8 3HZ LYS 8 -15.503 -2.791 -6.395
522 H LEU 9 H LEU 9 -8.188 -5.309 -3.713
523 HA LEU 9 HA LEU 9 -8.963 -2.781 -2.481
524 1HB LEU 9 1HB LEU 9 -6.858 -4.866 -1.779
525 2HB LEU 9 2HB LEU 9 -7.131 -3.412 -0.821
526 HG LEU 9 HG LEU 9 -9.272 -5.523 -1.335
527 1HD1 LEU 9 1HD1 LEU 9 -7.371 -6.383 0.003
528 2HD1 LEU 9 2HD1 LEU 9 -7.527 -5.010 1.117
529 3HD1 LEU 9 3HD1 LEU 9 -8.832 -6.209 0.994
530 1HD2 LEU 9 1HD2 LEU 9 -9.152 -3.111 0.546
531 2HD2 LEU 9 2HD2 LEU 9 -10.277 -3.325 -0.811
532 3HD2 LEU 9 3HD2 LEU 9 -10.395 -4.373 0.603
533 H GLU 10 H GLU 10 -6.612 -3.729 -4.811
534 HA GLU 10 HA GLU 10 -4.756 -1.540 -4.278
535 1HB GLU 10 1HB GLU 10 -5.069 -3.487 -6.614
536 2HB GLU 10 2HB GLU 10 -3.868 -2.242 -6.431
537 1HG GLU 10 1HG GLU 10 -3.028 -4.521 -5.967
538 2HG GLU 10 2HG GLU 10 -2.726 -3.342 -4.710
539 H LEU 11 H LEU 11 -7.380 -2.378 -6.578
540 HA LEU 11 HA LEU 11 -7.151 -0.204 -8.348
541 1HB LEU 11 1HB LEU 11 -8.662 -2.228 -8.597
542 2HB LEU 11 2HB LEU 11 -9.678 -1.583 -7.310
543 HG LEU 11 HG LEU 11 -9.950 0.524 -8.868
544 1HD1 LEU 11 1HD1 LEU 11 -8.183 -0.153 -10.504
545 2HD1 LEU 11 2HD1 LEU 11 -9.129 -1.603 -10.900
546 3HD1 LEU 11 3HD1 LEU 11 -9.777 0.009 -11.263
547 1HD2 LEU 11 1HD2 LEU 11 -11.218 -2.159 -9.534
548 2HD2 LEU 11 2HD2 LEU 11 -11.761 -1.012 -8.288
549 3HD2 LEU 11 3HD2 LEU 11 -11.846 -0.562 -9.999
550 H GLN 12 H GLN 12 -9.091 -0.398 -5.345
551 HA GLN 12 HA GLN 12 -10.227 2.194 -5.516
552 1HB GLN 12 1HB GLN 12 -10.371 2.012 -2.985
553 2HB GLN 12 2HB GLN 12 -11.169 0.730 -3.907
554 1HG GLN 12 1HG GLN 12 -9.547 -0.854 -3.393
555 2HG GLN 12 2HG GLN 12 -8.315 0.372 -3.056
556 1HE2 GLN 12 2HE2 GLN 12 -7.774 -0.759 -1.145
557 2HE2 GLN 12 1HE2 GLN 12 -8.767 -0.562 0.303
558 H LEU 13 H LEU 13 -6.880 1.338 -4.708
559 HA LEU 13 HA LEU 13 -6.396 3.762 -3.169
560 1HB LEU 13 1HB LEU 13 -4.369 1.831 -4.381
561 2HB LEU 13 2HB LEU 13 -4.084 3.151 -3.262
562 HG LEU 13 HG LEU 13 -5.258 0.452 -2.760
563 1HD1 LEU 13 1HD1 LEU 13 -2.873 1.057 -2.322
564 2HD1 LEU 13 2HD1 LEU 13 -3.406 2.268 -1.159
565 3HD1 LEU 13 3HD1 LEU 13 -3.736 0.545 -0.857
566 1HD2 LEU 13 1HD2 LEU 13 -5.903 2.901 -1.066
567 2HD2 LEU 13 2HD2 LEU 13 -7.071 1.824 -1.835
568 3HD2 LEU 13 3HD2 LEU 13 -6.084 1.213 -0.515
569 H ILE 14 H ILE 14 -5.658 2.487 -6.438
570 HA ILE 14 HA ILE 14 -4.418 4.867 -7.455
571 HB ILE 14 HB ILE 14 -5.858 2.456 -8.606
572 1HG1 ILE 14 1HG1 ILE 14 -3.763 2.047 -9.648
573 2HG1 ILE 14 2HG1 ILE 14 -3.184 3.695 -9.378
574 1HG2 ILE 14 1HG2 ILE 14 -6.755 4.227 -10.048
575 2HG2 ILE 14 2HG2 ILE 14 -5.126 4.912 -10.264
576 3HG2 ILE 14 3HG2 ILE 14 -5.526 3.308 -10.907
577 1HD1 ILE 14 1HD1 ILE 14 -2.925 3.276 -6.978
578 2HD1 ILE 14 2HD1 ILE 14 -3.683 1.675 -7.156
579 3HD1 ILE 14 3HD1 ILE 14 -2.112 2.028 -7.901
580 H LYS 15 H LYS 15 -7.875 3.939 -7.278
581 HA LYS 15 HA LYS 15 -8.841 6.323 -8.447
582 1HB LYS 15 1HB LYS 15 -9.919 3.946 -7.347
583 2HB LYS 15 2HB LYS 15 -10.482 5.192 -6.268
584 1HG LYS 15 1HG LYS 15 -12.168 5.101 -7.892
585 2HG LYS 15 2HG LYS 15 -11.185 6.444 -8.491
586 1HD LYS 15 1HD LYS 15 -9.928 4.680 -9.935
587 2HD LYS 15 2HD LYS 15 -11.119 3.505 -9.370
588 1HE LYS 15 1HE LYS 15 -11.876 4.226 -11.510
589 2HE LYS 15 2HE LYS 15 -12.946 5.001 -10.331
590 1HZ LYS 15 1HZ LYS 15 -11.606 6.991 -10.565
591 2HZ LYS 15 2HZ LYS 15 -10.633 6.241 -11.664
592 3HZ LYS 15 3HZ LYS 15 -12.218 6.518 -12.020
593 H GLN 16 H GLN 16 -8.164 5.492 -5.019
594 HA GLN 16 HA GLN 16 -9.122 8.041 -4.023
595 1HB GLN 16 1HB GLN 16 -7.769 5.641 -2.816
596 2HB GLN 16 2HB GLN 16 -7.570 7.180 -1.989
597 1HG GLN 16 1HG GLN 16 -9.460 6.100 -1.032
598 2HG GLN 16 2HG GLN 16 -9.998 7.533 -1.903
599 1HE2 GLN 16 2HE2 GLN 16 -10.489 4.158 -1.479
600 2HE2 GLN 16 1HE2 GLN 16 -11.592 3.954 -2.828
601 H TYR 17 H TYR 17 -6.072 6.949 -5.288
602 HA TYR 17 HA TYR 17 -4.416 9.061 -4.238
603 1HB TYR 17 1HB TYR 17 -4.194 6.838 -6.193
604 2HB TYR 17 2HB TYR 17 -3.423 8.288 -6.728
605 HD1 TYR 17 HD1 TYR 17 -1.238 8.816 -6.113
606 HD2 TYR 17 HD2 TYR 17 -3.564 6.035 -3.762
607 HE1 TYR 17 HE1 TYR 17 0.816 8.031 -4.988
608 HE2 TYR 17 HE2 TYR 17 -1.557 5.425 -2.512
609 HH TYR 17 HH TYR 17 0.679 5.864 -2.193
610 H ARG 18 H ARG 18 -6.533 8.638 -7.042
611 HA ARG 18 HA ARG 18 -5.613 11.065 -8.408
612 1HB ARG 18 1HB ARG 18 -8.195 9.479 -8.759
613 2HB ARG 18 2HB ARG 18 -7.692 10.851 -9.755
614 1HG ARG 18 1HG ARG 18 -5.655 9.591 -10.463
615 2HG ARG 18 2HG ARG 18 -6.195 8.227 -9.483
616 1HD ARG 18 1HD ARG 18 -8.424 8.428 -10.887
617 2HD ARG 18 2HD ARG 18 -7.402 9.358 -12.009
618 HE ARG 18 HE ARG 18 -6.245 6.813 -11.186
619 1HH1 ARG 18 1HH2 ARG 18 -8.479 8.312 -13.468
620 2HH1 ARG 18 2HH2 ARG 18 -8.468 6.978 -14.587
621 1HH2 ARG 18 1HH1 ARG 18 -6.238 5.043 -12.607
622 2HH2 ARG 18 2HH1 ARG 18 -7.162 5.064 -14.079
623 H GLU 19 H GLU 19 -8.312 10.065 -6.430
624 HA GLU 19 HA GLU 19 -9.606 12.531 -6.076
625 1HB GLU 19 1HB GLU 19 -10.396 10.239 -5.311
626 2HB GLU 19 2HB GLU 19 -9.315 10.432 -3.918
627 1HG GLU 19 1HG GLU 19 -10.524 12.493 -3.265
628 2HG GLU 19 2HG GLU 19 -11.591 12.308 -4.669
629 H ALA 20 H ALA 20 -6.815 11.148 -4.164
630 HA ALA 20 HA ALA 20 -6.831 13.469 -2.413
631 1HB ALA 20 1HB ALA 20 -6.013 11.394 -1.649
632 2HB ALA 20 2HB ALA 20 -4.799 11.302 -2.945
633 3HB ALA 20 3HB ALA 20 -4.643 12.526 -1.656
634 H LEU 21 H LEU 21 -5.150 12.716 -5.470
635 HA LEU 21 HA LEU 21 -3.194 14.694 -5.345
636 1HB LEU 21 1HB LEU 21 -3.748 12.813 -7.084
637 2HB LEU 21 2HB LEU 21 -4.593 14.080 -7.966
638 HG LEU 21 HG LEU 21 -1.697 14.373 -7.012
639 1HD1 LEU 21 1HD1 LEU 21 -1.816 12.264 -8.231
640 2HD1 LEU 21 2HD1 LEU 21 -2.757 13.037 -9.518
641 3HD1 LEU 21 3HD1 LEU 21 -1.058 13.514 -9.247
642 1HD2 LEU 21 1HD2 LEU 21 -3.172 15.566 -9.405
643 2HD2 LEU 21 2HD2 LEU 21 -2.619 16.457 -7.964
644 3HD2 LEU 21 3HD2 LEU 21 -1.442 15.754 -9.064
645 H GLU 22 H GLU 22 -6.635 15.064 -5.951
646 HA GLU 22 HA GLU 22 -6.588 17.681 -7.148
647 1HB GLU 22 1HB GLU 22 -8.676 16.335 -5.373
648 2HB GLU 22 2HB GLU 22 -8.949 17.801 -6.313
649 1HG GLU 22 1HG GLU 22 -8.096 15.206 -7.681
650 2HG GLU 22 2HG GLU 22 -9.774 15.538 -7.263
651 H TYR 23 H TYR 23 -6.550 16.460 -3.834
652 HA TYR 23 HA TYR 23 -6.726 19.127 -2.630
653 1HB TYR 23 1HB TYR 23 -7.162 16.391 -1.805
654 2HB TYR 23 2HB TYR 23 -5.900 17.043 -0.792
655 HD1 TYR 23 HD1 TYR 23 -6.349 19.022 0.666
656 HD2 TYR 23 HD2 TYR 23 -9.444 17.266 -1.767
657 HE1 TYR 23 HE1 TYR 23 -8.068 20.171 2.024
658 HE2 TYR 23 HE2 TYR 23 -11.164 18.436 -0.417
659 HH TYR 23 HH TYR 23 -10.310 20.554 2.331
660 H VAL 24 H VAL 24 -4.301 16.620 -3.261
661 HA VAL 24 HA VAL 24 -2.325 18.014 -1.597
662 HB VAL 24 HB VAL 24 -2.123 15.419 -3.156
663 1HG1 VAL 24 1HG1 VAL 24 0.135 16.245 -2.764
664 2HG1 VAL 24 2HG1 VAL 24 -0.276 16.733 -1.106
665 3HG1 VAL 24 3HG1 VAL 24 -0.193 15.018 -1.533
666 1HG2 VAL 24 1HG2 VAL 24 -2.554 15.960 -0.178
667 2HG2 VAL 24 2HG2 VAL 24 -3.808 15.376 -1.281
668 3HG2 VAL 24 3HG2 VAL 24 -2.400 14.367 -0.946
669 H LYS 25 H LYS 25 -3.042 17.870 -4.998
670 HA LYS 25 HA LYS 25 -2.090 18.797 -6.834
671 1HB LYS 25 1HB LYS 25 -1.530 20.894 -4.709
672 2HB LYS 25 2HB LYS 25 -1.365 21.160 -6.445
673 1HG LYS 25 1HG LYS 25 -3.970 19.957 -5.873
674 2HG LYS 25 2HG LYS 25 -3.744 21.382 -4.869
675 1HD LYS 25 1HD LYS 25 -3.277 21.316 -7.889
676 2HD LYS 25 2HD LYS 25 -4.809 21.786 -7.139
677 1HE LYS 25 1HE LYS 25 -3.806 23.690 -6.028
678 2HE LYS 25 2HE LYS 25 -2.172 23.211 -6.502
679 1HZ LYS 25 1HZ LYS 25 -2.766 23.558 -8.773
680 2HZ LYS 25 2HZ LYS 25 -4.295 24.016 -8.354
681 3HZ LYS 25 3HZ LYS 25 -3.001 24.928 -7.891
682 H LEU 26 H LEU 26 -0.413 16.890 -6.510
683 HA LEU 26 HA LEU 26 2.240 18.169 -6.923
684 1HB LEU 26 1HB LEU 26 1.813 17.066 -4.604
685 2HB LEU 26 2HB LEU 26 2.036 15.533 -5.444
686 HG LEU 26 HG LEU 26 4.041 17.847 -5.529
687 1HD1 LEU 26 1HD1 LEU 26 3.687 17.123 -3.181
688 2HD1 LEU 26 2HD1 LEU 26 4.046 15.447 -3.649
689 3HD1 LEU 26 3HD1 LEU 26 5.298 16.703 -3.769
690 1HD2 LEU 26 1HD2 LEU 26 4.358 14.859 -6.031
691 2HD2 LEU 26 2HD2 LEU 26 4.368 16.112 -7.296
692 3HD2 LEU 26 3HD2 LEU 26 5.669 16.057 -6.111
693 HA PRO 27 HA PRO 27 1.128 15.900 -10.635
694 1HB PRO 27 1HB PRO 27 3.462 16.182 -12.117
695 2HB PRO 27 2HB PRO 27 2.192 17.424 -11.953
696 1HG PRO 27 1HG PRO 27 4.770 17.201 -10.389
697 2HG PRO 27 2HG PRO 27 4.059 18.657 -11.140
698 1HD PRO 27 1HD PRO 27 3.768 18.163 -8.505
699 2HD PRO 27 2HD PRO 27 2.391 18.821 -9.435
700 H VAL 28 H VAL 28 4.330 15.316 -9.140
701 HA VAL 28 HA VAL 28 4.855 12.801 -10.179
702 HB VAL 28 HB VAL 28 5.554 13.708 -7.420
703 1HG1 VAL 28 1HG1 VAL 28 5.989 11.362 -7.633
704 2HG1 VAL 28 2HG1 VAL 28 6.778 11.591 -9.210
705 3HG1 VAL 28 3HG1 VAL 28 7.528 12.207 -7.720
706 1HG2 VAL 28 1HG2 VAL 28 7.118 14.044 -10.009
707 2HG2 VAL 28 2HG2 VAL 28 6.380 15.369 -9.073
708 3HG2 VAL 28 3HG2 VAL 28 7.707 14.435 -8.383
709 H LEU 29 H LEU 29 2.266 13.562 -7.778
710 HA LEU 29 HA LEU 29 2.151 10.910 -6.685
711 1HB LEU 29 1HB LEU 29 0.338 13.317 -6.842
712 2HB LEU 29 2HB LEU 29 -0.356 11.775 -6.477
713 HG LEU 29 HG LEU 29 1.926 12.937 -4.851
714 1HD1 LEU 29 1HD1 LEU 29 -0.048 14.420 -4.737
715 2HD1 LEU 29 2HD1 LEU 29 -1.100 13.027 -4.404
716 3HD1 LEU 29 3HD1 LEU 29 0.132 13.513 -3.222
717 1HD2 LEU 29 1HD2 LEU 29 -0.091 10.690 -4.326
718 2HD2 LEU 29 2HD2 LEU 29 1.649 10.468 -4.594
719 3HD2 LEU 29 3HD2 LEU 29 1.083 11.302 -3.147
720 H ALA 30 H ALA 30 0.801 12.515 -9.612
721 HA ALA 30 HA ALA 30 -1.080 10.341 -10.064
722 1HB ALA 30 1HB ALA 30 -1.548 12.485 -11.220
723 2HB ALA 30 2HB ALA 30 0.062 12.494 -11.958
724 3HB ALA 30 3HB ALA 30 -1.142 11.290 -12.438
725 H LYS 31 H LYS 31 2.280 11.372 -10.926
726 HA LYS 31 HA LYS 31 2.605 9.384 -12.964
727 1HB LYS 31 1HB LYS 31 3.986 11.602 -12.547
728 2HB LYS 31 2HB LYS 31 4.942 10.594 -11.441
729 1HG LYS 31 1HG LYS 31 5.226 8.963 -13.421
730 2HG LYS 31 2HG LYS 31 4.462 10.205 -14.424
731 1HD LYS 31 1HD LYS 31 6.313 11.813 -13.574
732 2HD LYS 31 2HD LYS 31 7.063 10.392 -12.827
733 1HE LYS 31 1HE LYS 31 8.150 10.742 -14.949
734 2HE LYS 31 2HE LYS 31 7.139 9.297 -15.111
735 1HZ LYS 31 1HZ LYS 31 5.493 10.662 -16.193
736 2HZ LYS 31 2HZ LYS 31 6.424 12.008 -16.008
737 3HZ LYS 31 3HZ LYS 31 6.933 10.778 -16.978
738 H ILE 32 H ILE 32 3.077 9.384 -9.490
739 HA ILE 32 HA ILE 32 4.613 6.903 -9.394
740 HB ILE 32 HB ILE 32 2.977 8.479 -7.347
741 1HG1 ILE 32 1HG1 ILE 32 5.929 7.758 -7.250
742 2HG1 ILE 32 2HG1 ILE 32 5.380 9.169 -8.150
743 1HG2 ILE 32 1HG2 ILE 32 2.655 6.204 -6.690
744 2HG2 ILE 32 2HG2 ILE 32 4.281 5.757 -7.218
745 3HG2 ILE 32 3HG2 ILE 32 4.056 6.712 -5.738
746 1HD1 ILE 32 1HD1 ILE 32 4.343 10.111 -6.115
747 2HD1 ILE 32 2HD1 ILE 32 4.861 8.699 -5.172
748 3HD1 ILE 32 3HD1 ILE 32 6.067 9.781 -5.876
749 H LEU 33 H LEU 33 1.179 7.992 -9.007
750 HA LEU 33 HA LEU 33 0.411 5.381 -8.478
751 1HB LEU 33 1HB LEU 33 -1.811 6.228 -8.281
752 2HB LEU 33 2HB LEU 33 -0.773 7.626 -7.990
753 HG LEU 33 HG LEU 33 -1.102 8.264 -10.348
754 1HD1 LEU 33 1HD1 LEU 33 -1.941 6.688 -11.722
755 2HD1 LEU 33 2HD1 LEU 33 -2.801 5.860 -10.397
756 3HD1 LEU 33 3HD1 LEU 33 -3.473 7.329 -11.159
757 1HD2 LEU 33 1HD2 LEU 33 -3.640 8.101 -8.789
758 2HD2 LEU 33 2HD2 LEU 33 -2.288 9.221 -8.390
759 3HD2 LEU 33 3HD2 LEU 33 -3.150 9.370 -9.931
760 H GLU 34 H GLU 34 0.827 6.997 -11.541
761 HA GLU 34 HA GLU 34 -0.524 5.175 -13.208
762 1HB GLU 34 1HB GLU 34 0.716 7.393 -13.766
763 2HB GLU 34 2HB GLU 34 2.196 6.463 -13.764
764 1HG GLU 34 1HG GLU 34 1.195 4.954 -15.539
765 2HG GLU 34 2HG GLU 34 -0.202 6.043 -15.603
766 H ASP 35 H ASP 35 2.775 5.160 -11.932
767 HA ASP 35 HA ASP 35 3.633 2.694 -13.070
768 1HB ASP 35 1HB ASP 35 5.007 4.534 -11.839
769 2HB ASP 35 2HB ASP 35 4.582 3.662 -10.356
770 H GLU 36 H GLU 36 2.163 3.432 -9.891
771 HA GLU 36 HA GLU 36 1.962 0.791 -8.926
772 1HB GLU 36 1HB GLU 36 -0.058 3.003 -8.456
773 2HB GLU 36 2HB GLU 36 0.200 1.563 -7.464
774 1HG GLU 36 1HG GLU 36 2.310 3.738 -7.860
775 2HG GLU 36 2HG GLU 36 1.207 3.661 -6.509
776 H GLU 37 H GLU 37 -0.454 2.606 -10.950
777 HA GLU 37 HA GLU 37 -2.370 0.703 -11.255
778 1HB GLU 37 1HB GLU 37 -1.835 3.202 -12.244
779 2HB GLU 37 2HB GLU 37 -1.493 2.268 -13.690
780 1HG GLU 37 1HG GLU 37 -4.032 1.998 -12.024
781 2HG GLU 37 2HG GLU 37 -3.781 3.227 -13.263
782 H LYS 38 H LYS 38 0.741 0.973 -13.021
783 HA LYS 38 HA LYS 38 0.193 -1.209 -14.773
784 1HB LYS 38 1HB LYS 38 2.005 0.663 -14.922
785 2HB LYS 38 2HB LYS 38 2.950 -0.351 -13.829
786 1HG LYS 38 1HG LYS 38 3.707 -0.969 -15.983
787 2HG LYS 38 2HG LYS 38 2.587 -2.263 -15.530
788 1HD LYS 38 1HD LYS 38 0.771 -0.862 -16.818
789 2HD LYS 38 2HD LYS 38 2.131 0.074 -17.442
790 1HE LYS 38 1HE LYS 38 3.100 -2.024 -18.399
791 2HE LYS 38 2HE LYS 38 1.759 -2.955 -17.698
792 1HZ LYS 38 1HZ LYS 38 0.243 -1.708 -19.031
793 2HZ LYS 38 2HZ LYS 38 1.474 -0.845 -19.711
794 3HZ LYS 38 3HZ LYS 38 1.357 -2.469 -19.973
795 H HIS 39 H HIS 39 1.933 -1.085 -11.631
796 HA HIS 39 HA HIS 39 2.573 -3.867 -11.502
797 1HB HIS 39 1HB HIS 39 1.953 -1.822 -9.354
798 2HB HIS 39 2HB HIS 39 2.466 -3.457 -8.984
799 HD1 HIS 39 HD1 HIS 39 4.911 -4.058 -10.561
800 HD2 HIS 39 HD2 HIS 39 3.967 -0.148 -9.292
801 HE1 HIS 39 HE1 HIS 39 7.108 -2.721 -10.577
802 HE2 HIS 39 HE2 HIS 39 6.496 -0.339 -9.805
803 H ILE 40 H ILE 40 -0.424 -2.132 -10.734
804 HA ILE 40 HA ILE 40 -1.685 -4.453 -9.534
805 HB ILE 40 HB ILE 40 -2.787 -1.787 -10.467
806 1HG1 ILE 40 1HG1 ILE 40 -2.230 -2.772 -7.636
807 2HG1 ILE 40 2HG1 ILE 40 -0.994 -1.951 -8.536
808 1HG2 ILE 40 1HG2 ILE 40 -4.611 -3.439 -10.367
809 2HG2 ILE 40 2HG2 ILE 40 -4.065 -3.987 -8.772
810 3HG2 ILE 40 3HG2 ILE 40 -4.744 -2.362 -8.983
811 1HD1 ILE 40 1HD1 ILE 40 -2.324 0.010 -8.899
812 2HD1 ILE 40 2HD1 ILE 40 -3.688 -0.662 -8.000
813 3HD1 ILE 40 3HD1 ILE 40 -2.150 -0.337 -7.164
814 H GLU 41 H GLU 41 -1.784 -2.862 -12.695
815 HA GLU 41 HA GLU 41 -3.691 -4.314 -14.086
816 1HB GLU 41 1HB GLU 41 -2.218 -2.391 -14.945
817 2HB GLU 41 2HB GLU 41 -0.929 -3.589 -15.150
818 1HG GLU 41 1HG GLU 41 -2.673 -4.892 -16.581
819 2HG GLU 41 2HG GLU 41 -3.534 -3.343 -16.628
820 H TRP 42 H TRP 42 -0.248 -5.165 -13.394
821 HA TRP 42 HA TRP 42 -0.009 -7.529 -14.736
822 1HB TRP 42 1HB TRP 42 1.625 -6.164 -13.268
823 2HB TRP 42 2HB TRP 42 1.015 -7.110 -11.917
824 HD1 TRP 42 HD1 TRP 42 2.816 -7.566 -15.225
825 HE1 TRP 42 HE1 TRP 42 3.854 -9.928 -15.342
826 HE3 TRP 42 HE3 TRP 42 1.023 -9.356 -10.875
827 HZ2 TRP 42 HZ2 TRP 42 3.750 -12.374 -13.757
828 HZ3 TRP 42 HZ3 TRP 42 1.453 -11.736 -10.167
829 HH2 TRP 42 HH2 TRP 42 2.690 -13.266 -11.697
830 H LEU 43 H LEU 43 -1.651 -6.936 -11.694
831 HA LEU 43 HA LEU 43 -2.034 -9.755 -10.983
832 1HB LEU 43 1HB LEU 43 -3.445 -7.332 -9.824
833 2HB LEU 43 2HB LEU 43 -3.290 -8.941 -9.133
834 HG LEU 43 HG LEU 43 -0.832 -7.215 -9.656
835 1HD1 LEU 43 1HD1 LEU 43 -2.656 -6.062 -8.154
836 2HD1 LEU 43 2HD1 LEU 43 -2.145 -7.245 -6.940
837 3HD1 LEU 43 3HD1 LEU 43 -0.975 -6.121 -7.630
838 1HD2 LEU 43 1HD2 LEU 43 -1.384 -9.414 -7.622
839 2HD2 LEU 43 2HD2 LEU 43 -0.509 -9.638 -9.144
840 3HD2 LEU 43 3HD2 LEU 43 0.161 -8.578 -7.891
841 H GLU 44 H GLU 44 -3.999 -6.990 -12.143
842 HA GLU 44 HA GLU 44 -6.351 -8.684 -12.635
843 1HB GLU 44 1HB GLU 44 -5.822 -5.753 -13.305
844 2HB GLU 44 2HB GLU 44 -7.363 -6.606 -13.489
845 1HG GLU 44 1HG GLU 44 -7.299 -7.188 -11.068
846 2HG GLU 44 2HG GLU 44 -5.882 -6.130 -10.870
847 H THR 45 H THR 45 -4.007 -9.522 -14.026
848 HA THR 45 HA THR 45 -5.271 -9.838 -16.622
849 HB THR 45 HB THR 45 -3.828 -7.661 -16.563
850 HG1 THR 45 HG1 THR 45 -4.788 -8.481 -18.403
851 1HG2 THR 45 1HG2 THR 45 -1.755 -8.569 -15.735
852 2HG2 THR 45 2HG2 THR 45 -1.576 -9.557 -17.204
853 3HG2 THR 45 3HG2 THR 45 -1.581 -7.779 -17.296
854 H ILE 46 H ILE 46 -2.296 -10.221 -14.769
855 HA ILE 46 HA ILE 46 -0.832 -11.895 -14.535
856 HB ILE 46 HB ILE 46 -2.603 -12.262 -12.918
857 1HG1 ILE 46 1HG1 ILE 46 -2.014 -14.899 -12.647
858 2HG1 ILE 46 2HG1 ILE 46 -0.720 -14.398 -13.748
859 1HG2 ILE 46 1HG2 ILE 46 -4.529 -12.802 -14.125
860 2HG2 ILE 46 2HG2 ILE 46 -3.831 -14.293 -14.776
861 3HG2 ILE 46 3HG2 ILE 46 -4.165 -14.134 -13.042
862 1HD1 ILE 46 1HD1 ILE 46 -0.247 -12.470 -12.230
863 2HD1 ILE 46 2HD1 ILE 46 -1.413 -13.143 -11.072
864 3HD1 ILE 46 3HD1 ILE 46 0.047 -14.065 -11.494
865 H LEU 47 H LEU 47 -1.947 -14.814 -15.302
866 HA LEU 47 HA LEU 47 -1.158 -16.271 -16.899
867 1HB LEU 47 1HB LEU 47 -3.152 -14.413 -18.204
868 2HB LEU 47 2HB LEU 47 -2.589 -15.857 -19.045
869 HG LEU 47 HG LEU 47 -3.667 -16.127 -16.230
870 1HD1 LEU 47 1HD1 LEU 47 -5.389 -14.893 -17.455
871 2HD1 LEU 47 2HD1 LEU 47 -5.309 -16.062 -18.793
872 3HD1 LEU 47 3HD1 LEU 47 -5.895 -16.572 -17.193
873 1HD2 LEU 47 1HD2 LEU 47 -3.640 -17.988 -18.651
874 2HD2 LEU 47 2HD2 LEU 47 -2.498 -18.070 -17.296
875 3HD2 LEU 47 3HD2 LEU 47 -4.217 -18.389 -17.023
876 H GLY 48 H GLY 48 0.874 -14.367 -16.599
877 1HA GLY 48 1HA GLY 48 1.823 -13.481 -19.184
878 2HA GLY 48 2HA GLY 48 2.726 -13.524 -17.663
879 1HN NH2 49 1HN NH2 49 2.716 -16.924 -20.126
880 2HN NH2 49 2HN NH2 49 1.336 -15.795 -20.062
Start of MODEL 8
1 1H ACE 0 H1 ACE 0 2.879 -19.749 -6.773
2 2H ACE 0 H2 ACE 0 4.292 -20.818 -6.891
3 3H ACE 0 H3 ACE 0 3.059 -20.905 -8.162
4 H ASP 1 H ASP 1 5.915 -20.069 -7.963
5 HA ASP 1 HA ASP 1 6.176 -17.580 -8.945
6 1HB ASP 1 1HB ASP 1 8.198 -18.909 -8.654
7 2HB ASP 1 2HB ASP 1 7.452 -20.352 -9.308
8 H TYR 2 H TYR 2 4.965 -20.326 -10.635
9 HA TYR 2 HA TYR 2 4.489 -18.877 -13.051
10 1HB TYR 2 1HB TYR 2 3.954 -20.731 -13.930
11 2HB TYR 2 2HB TYR 2 4.968 -21.351 -12.653
12 HD1 TYR 2 HD1 TYR 2 3.446 -21.853 -10.389
13 HD2 TYR 2 HD2 TYR 2 1.611 -20.942 -14.004
14 HE1 TYR 2 HE1 TYR 2 1.426 -23.113 -9.705
15 HE2 TYR 2 HE2 TYR 2 -0.194 -22.633 -13.644
16 HH TYR 2 HH TYR 2 -0.618 -23.962 -10.360
17 H LEU 3 H LEU 3 2.179 -20.232 -10.622
18 HA LEU 3 HA LEU 3 0.585 -17.974 -10.510
19 1HB LEU 3 1HB LEU 3 -0.987 -18.070 -12.010
20 2HB LEU 3 2HB LEU 3 0.062 -19.217 -12.824
21 HG LEU 3 HG LEU 3 -1.035 -20.951 -11.421
22 1HD1 LEU 3 1HD1 LEU 3 -2.556 -19.178 -10.166
23 2HD1 LEU 3 2HD1 LEU 3 -3.384 -18.953 -11.692
24 3HD1 LEU 3 3HD1 LEU 3 -3.451 -20.530 -10.883
25 1HD2 LEU 3 1HD2 LEU 3 -1.208 -20.706 -13.951
26 2HD2 LEU 3 2HD2 LEU 3 -2.643 -21.441 -13.212
27 3HD2 LEU 3 3HD2 LEU 3 -2.660 -19.740 -13.723
28 H ARG 4 H ARG 4 1.712 -18.636 -8.529
29 HA ARG 4 HA ARG 4 -0.787 -18.718 -7.145
30 1HB ARG 4 1HB ARG 4 -0.172 -20.368 -5.263
31 2HB ARG 4 2HB ARG 4 -0.993 -20.870 -6.740
32 1HG ARG 4 1HG ARG 4 1.178 -21.563 -7.681
33 2HG ARG 4 2HG ARG 4 1.888 -21.328 -6.026
34 1HD ARG 4 1HD ARG 4 0.688 -23.134 -5.174
35 2HD ARG 4 2HD ARG 4 -0.214 -23.352 -6.699
36 HE ARG 4 HE ARG 4 2.341 -23.389 -7.583
37 1HH1 ARG 4 1HH2 ARG 4 0.857 -25.247 -4.981
38 2HH1 ARG 4 2HH2 ARG 4 1.984 -26.571 -5.105
39 1HH2 ARG 4 1HH1 ARG 4 3.779 -25.080 -7.788
40 2HH2 ARG 4 2HH1 ARG 4 3.685 -26.478 -6.759
41 H GLU 5 H GLU 5 2.278 -17.592 -7.423
42 HA GLU 5 HA GLU 5 2.414 -16.436 -4.709
43 1HB GLU 5 1HB GLU 5 4.098 -16.305 -7.218
44 2HB GLU 5 2HB GLU 5 4.120 -14.942 -6.115
45 1HG GLU 5 1HG GLU 5 5.924 -16.476 -5.569
46 2HG GLU 5 2HG GLU 5 4.775 -16.332 -4.235
47 H LEU 6 H LEU 6 1.274 -15.624 -7.934
48 HA LEU 6 HA LEU 6 0.863 -12.851 -7.433
49 1HB LEU 6 1HB LEU 6 -0.700 -14.147 -9.602
50 2HB LEU 6 2HB LEU 6 0.066 -12.568 -9.467
51 HG LEU 6 HG LEU 6 2.328 -13.954 -9.631
52 1HD1 LEU 6 1HD1 LEU 6 0.599 -16.098 -9.569
53 2HD1 LEU 6 2HD1 LEU 6 0.595 -15.774 -11.300
54 3HD1 LEU 6 3HD1 LEU 6 2.128 -16.132 -10.470
55 1HD2 LEU 6 1HD2 LEU 6 0.224 -13.234 -11.682
56 2HD2 LEU 6 2HD2 LEU 6 1.746 -12.441 -11.234
57 3HD2 LEU 6 3HD2 LEU 6 1.766 -13.892 -12.228
58 H LEU 7 H LEU 7 -0.638 -15.089 -5.796
59 HA LEU 7 HA LEU 7 -3.086 -13.552 -5.613
60 1HB LEU 7 1HB LEU 7 -4.151 -15.863 -4.872
61 2HB LEU 7 2HB LEU 7 -4.291 -15.237 -6.501
62 HG LEU 7 HG LEU 7 -1.993 -17.079 -5.863
63 1HD1 LEU 7 1HD1 LEU 7 -3.912 -18.202 -4.866
64 2HD1 LEU 7 2HD1 LEU 7 -4.846 -17.981 -6.362
65 3HD1 LEU 7 3HD1 LEU 7 -3.413 -19.032 -6.350
66 1HD2 LEU 7 1HD2 LEU 7 -3.789 -16.721 -8.316
67 2HD2 LEU 7 2HD2 LEU 7 -2.159 -16.062 -8.166
68 3HD2 LEU 7 3HD2 LEU 7 -2.420 -17.808 -8.229
69 H LYS 8 H LYS 8 -1.069 -16.099 -4.090
70 HA LYS 8 HA LYS 8 -2.039 -15.508 -1.559
71 1HB LYS 8 1HB LYS 8 -0.888 -17.607 -2.408
72 2HB LYS 8 2HB LYS 8 0.665 -16.767 -2.254
73 1HG LYS 8 1HG LYS 8 0.315 -16.546 0.184
74 2HG LYS 8 2HG LYS 8 -1.327 -17.208 0.016
75 1HD LYS 8 1HD LYS 8 -0.376 -19.320 -0.905
76 2HD LYS 8 2HD LYS 8 1.264 -18.700 -0.648
77 1HE LYS 8 1HE LYS 8 0.991 -18.709 1.745
78 2HE LYS 8 2HE LYS 8 -0.769 -18.895 1.623
79 1HZ LYS 8 1HZ LYS 8 -0.458 -21.057 0.724
80 2HZ LYS 8 2HZ LYS 8 1.184 -20.925 0.807
81 3HZ LYS 8 3HZ LYS 8 0.284 -20.943 2.189
82 H LEU 9 H LEU 9 0.892 -14.347 -3.251
83 HA LEU 9 HA LEU 9 1.808 -12.795 -0.957
84 1HB LEU 9 1HB LEU 9 2.561 -12.489 -3.875
85 2HB LEU 9 2HB LEU 9 3.341 -11.756 -2.470
86 HG LEU 9 HG LEU 9 3.244 -14.732 -3.108
87 1HD1 LEU 9 1HD1 LEU 9 4.834 -13.404 -4.502
88 2HD1 LEU 9 2HD1 LEU 9 5.586 -12.778 -3.016
89 3HD1 LEU 9 3HD1 LEU 9 5.695 -14.490 -3.397
90 1HD2 LEU 9 1HD2 LEU 9 4.878 -14.929 -1.192
91 2HD2 LEU 9 2HD2 LEU 9 4.466 -13.263 -0.736
92 3HD2 LEU 9 3HD2 LEU 9 3.228 -14.548 -0.701
93 H GLU 10 H GLU 10 -0.223 -12.262 -3.850
94 HA GLU 10 HA GLU 10 -0.469 -9.464 -3.555
95 1HB GLU 10 1HB GLU 10 -2.570 -11.393 -4.596
96 2HB GLU 10 2HB GLU 10 -2.454 -9.654 -4.800
97 1HG GLU 10 1HG GLU 10 -0.595 -11.689 -5.951
98 2HG GLU 10 2HG GLU 10 -1.717 -10.659 -6.858
99 H LEU 11 H LEU 11 -2.387 -12.131 -2.041
100 HA LEU 11 HA LEU 11 -4.236 -10.363 -0.719
101 1HB LEU 11 1HB LEU 11 -4.580 -12.770 -0.996
102 2HB LEU 11 2HB LEU 11 -3.208 -13.152 0.041
103 HG LEU 11 HG LEU 11 -5.329 -11.380 1.230
104 1HD1 LEU 11 1HD1 LEU 11 -6.717 -12.974 0.020
105 2HD1 LEU 11 2HD1 LEU 11 -5.796 -14.339 0.687
106 3HD1 LEU 11 3HD1 LEU 11 -6.783 -13.316 1.754
107 1HD2 LEU 11 1HD2 LEU 11 -3.828 -13.840 2.257
108 2HD2 LEU 11 2HD2 LEU 11 -3.374 -12.156 2.584
109 3HD2 LEU 11 3HD2 LEU 11 -4.898 -12.801 3.213
110 H GLN 12 H GLN 12 -0.969 -11.523 0.220
111 HA GLN 12 HA GLN 12 -1.015 -10.309 2.810
112 1HB GLN 12 1HB GLN 12 1.345 -10.947 1.004
113 2HB GLN 12 2HB GLN 12 1.470 -10.302 2.638
114 1HG GLN 12 1HG GLN 12 0.205 -12.231 3.532
115 2HG GLN 12 2HG GLN 12 0.163 -12.953 1.915
116 1HE2 GLN 12 2HE2 GLN 12 2.399 -13.237 0.864
117 2HE2 GLN 12 1HE2 GLN 12 3.722 -13.685 1.932
118 H LEU 13 H LEU 13 -0.887 -8.766 -0.336
119 HA LEU 13 HA LEU 13 0.454 -6.359 0.581
120 1HB LEU 13 1HB LEU 13 -1.438 -6.707 -1.795
121 2HB LEU 13 2HB LEU 13 -0.387 -5.351 -1.452
122 HG LEU 13 HG LEU 13 0.534 -8.167 -2.125
123 1HD1 LEU 13 1HD1 LEU 13 -0.576 -6.934 -3.945
124 2HD1 LEU 13 2HD1 LEU 13 0.475 -5.544 -3.693
125 3HD1 LEU 13 3HD1 LEU 13 1.141 -7.075 -4.284
126 1HD2 LEU 13 1HD2 LEU 13 1.921 -5.759 -1.059
127 2HD2 LEU 13 2HD2 LEU 13 2.293 -7.469 -0.847
128 3HD2 LEU 13 3HD2 LEU 13 2.752 -6.631 -2.343
129 H ILE 14 H ILE 14 -2.937 -7.179 -0.295
130 HA ILE 14 HA ILE 14 -4.108 -4.797 0.812
131 HB ILE 14 HB ILE 14 -5.117 -7.640 0.192
132 1HG1 ILE 14 1HG1 ILE 14 -6.591 -6.034 -1.338
133 2HG1 ILE 14 2HG1 ILE 14 -5.335 -4.854 -1.038
134 1HG2 ILE 14 1HG2 ILE 14 -6.492 -6.884 2.103
135 2HG2 ILE 14 2HG2 ILE 14 -6.777 -5.323 1.300
136 3HG2 ILE 14 3HG2 ILE 14 -7.427 -6.824 0.614
137 1HD1 ILE 14 1HD1 ILE 14 -3.674 -6.332 -2.083
138 2HD1 ILE 14 2HD1 ILE 14 -4.883 -7.636 -2.211
139 3HD1 ILE 14 3HD1 ILE 14 -5.068 -6.138 -3.143
140 H LYS 15 H LYS 15 -3.370 -7.895 2.211
141 HA LYS 15 HA LYS 15 -4.326 -7.299 4.839
142 1HB LYS 15 1HB LYS 15 -3.182 -9.509 3.766
143 2HB LYS 15 2HB LYS 15 -1.770 -8.868 4.580
144 1HG LYS 15 1HG LYS 15 -2.550 -10.089 6.326
145 2HG LYS 15 2HG LYS 15 -3.642 -8.727 6.611
146 1HD LYS 15 1HD LYS 15 -5.357 -9.864 5.141
147 2HD LYS 15 2HD LYS 15 -4.209 -11.190 4.881
148 1HE LYS 15 1HE LYS 15 -4.203 -11.621 7.368
149 2HE LYS 15 2HE LYS 15 -5.507 -10.429 7.529
150 1HZ LYS 15 1HZ LYS 15 -6.814 -11.790 6.037
151 2HZ LYS 15 2HZ LYS 15 -5.590 -12.884 5.910
152 3HZ LYS 15 3HZ LYS 15 -6.341 -12.657 7.356
153 H GLN 16 H GLN 16 -0.996 -6.796 3.535
154 HA GLN 16 HA GLN 16 0.007 -5.637 5.989
155 1HB GLN 16 1HB GLN 16 0.943 -5.641 3.092
156 2HB GLN 16 2HB GLN 16 1.796 -4.698 4.306
157 1HG GLN 16 1HG GLN 16 1.265 -7.664 4.719
158 2HG GLN 16 2HG GLN 16 2.676 -7.053 3.837
159 1HE2 GLN 16 2HE2 GLN 16 3.721 -8.341 5.733
160 2HE2 GLN 16 1HE2 GLN 16 4.056 -7.368 7.162
161 H TYR 17 H TYR 17 -1.583 -4.354 3.150
162 HA TYR 17 HA TYR 17 -1.012 -1.592 3.581
163 1HB TYR 17 1HB TYR 17 -3.117 -3.195 2.074
164 2HB TYR 17 2HB TYR 17 -3.262 -1.477 2.161
165 HD1 TYR 17 HD1 TYR 17 -0.487 -0.506 1.781
166 HD2 TYR 17 HD2 TYR 17 -2.812 -3.459 -0.311
167 HE1 TYR 17 HE1 TYR 17 0.794 -0.060 -0.271
168 HE2 TYR 17 HE2 TYR 17 -1.532 -2.999 -2.368
169 HH TYR 17 HH TYR 17 1.217 -0.750 -2.460
170 H ARG 18 H ARG 18 -3.263 -3.808 5.065
171 HA ARG 18 HA ARG 18 -4.953 -1.642 6.145
172 1HB ARG 18 1HB ARG 18 -4.906 -4.655 6.569
173 2HB ARG 18 2HB ARG 18 -5.859 -3.565 7.585
174 1HG ARG 18 1HG ARG 18 -7.050 -2.688 5.644
175 2HG ARG 18 2HG ARG 18 -6.100 -3.717 4.551
176 1HD ARG 18 1HD ARG 18 -7.028 -5.723 5.490
177 2HD ARG 18 2HD ARG 18 -7.809 -4.820 6.817
178 HE ARG 18 HE ARG 18 -8.745 -3.761 4.370
179 1HH1 ARG 18 1HH2 ARG 18 -8.915 -6.758 6.199
180 2HH1 ARG 18 2HH2 ARG 18 -10.517 -7.189 5.661
181 1HH2 ARG 18 1HH1 ARG 18 -10.847 -4.266 3.656
182 2HH2 ARG 18 2HH1 ARG 18 -11.646 -5.726 4.167
183 H GLU 19 H GLU 19 -2.348 -3.741 7.163
184 HA GLU 19 HA GLU 19 -2.186 -2.838 9.868
185 1HB GLU 19 1HB GLU 19 -1.017 -4.850 8.786
186 2HB GLU 19 2HB GLU 19 0.181 -3.700 8.181
187 1HG GLU 19 1HG GLU 19 0.659 -2.972 10.501
188 2HG GLU 19 2HG GLU 19 -0.563 -4.102 11.109
189 H ALA 20 H ALA 20 -0.561 -1.709 6.843
190 HA ALA 20 HA ALA 20 0.829 0.368 8.418
191 1HB ALA 20 1HB ALA 20 2.163 -0.585 6.789
192 2HB ALA 20 2HB ALA 20 0.887 -0.484 5.575
193 3HB ALA 20 3HB ALA 20 1.745 0.992 6.106
194 H LEU 21 H LEU 21 -2.169 0.269 6.560
195 HA LEU 21 HA LEU 21 -2.652 2.911 5.972
196 1HB LEU 21 1HB LEU 21 -4.288 1.221 5.514
197 2HB LEU 21 2HB LEU 21 -4.435 0.814 7.229
198 HG LEU 21 HG LEU 21 -5.536 2.976 7.678
199 1HD1 LEU 21 1HD1 LEU 21 -4.521 4.341 5.821
200 2HD1 LEU 21 2HD1 LEU 21 -5.417 3.352 4.656
201 3HD1 LEU 21 3HD1 LEU 21 -6.287 4.392 5.796
202 1HD2 LEU 21 1HD2 LEU 21 -6.753 1.356 5.401
203 2HD2 LEU 21 2HD2 LEU 21 -6.837 0.958 7.127
204 3HD2 LEU 21 3HD2 LEU 21 -7.638 2.418 6.520
205 H GLU 22 H GLU 22 -2.681 1.444 9.236
206 HA GLU 22 HA GLU 22 -3.781 3.828 10.471
207 1HB GLU 22 1HB GLU 22 -2.458 1.383 11.734
208 2HB GLU 22 2HB GLU 22 -3.284 2.697 12.588
209 1HG GLU 22 1HG GLU 22 -5.343 2.162 11.113
210 2HG GLU 22 2HG GLU 22 -4.508 0.659 10.682
211 H TYR 23 H TYR 23 -0.522 2.373 10.133
212 HA TYR 23 HA TYR 23 0.850 4.298 11.720
213 1HB TYR 23 1HB TYR 23 1.586 2.346 9.513
214 2HB TYR 23 2HB TYR 23 2.737 3.518 10.073
215 HD1 TYR 23 HD1 TYR 23 1.610 0.214 10.628
216 HD2 TYR 23 HD2 TYR 23 3.037 3.713 12.709
217 HE1 TYR 23 HE1 TYR 23 2.328 -1.200 12.526
218 HE2 TYR 23 HE2 TYR 23 3.715 2.301 14.617
219 HH TYR 23 HH TYR 23 3.832 0.172 15.465
220 H VAL 24 H VAL 24 -0.186 4.263 8.322
221 HA VAL 24 HA VAL 24 1.365 6.731 7.795
222 HB VAL 24 HB VAL 24 -0.297 4.985 5.968
223 1HG1 VAL 24 1HG1 VAL 24 -0.166 7.218 4.995
224 2HG1 VAL 24 2HG1 VAL 24 1.557 7.350 5.408
225 3HG1 VAL 24 3HG1 VAL 24 1.025 6.210 4.164
226 1HG2 VAL 24 1HG2 VAL 24 2.731 5.254 6.314
227 2HG2 VAL 24 2HG2 VAL 24 1.777 3.872 6.874
228 3HG2 VAL 24 3HG2 VAL 24 1.901 4.207 5.145
229 H LYS 25 H LYS 25 -2.001 5.861 8.390
230 HA LYS 25 HA LYS 25 -3.925 7.037 8.421
231 1HB LYS 25 1HB LYS 25 -2.055 9.254 9.354
232 2HB LYS 25 2HB LYS 25 -3.814 9.343 9.366
233 1HG LYS 25 1HG LYS 25 -3.358 6.918 10.657
234 2HG LYS 25 2HG LYS 25 -2.010 7.915 11.213
235 1HD LYS 25 1HD LYS 25 -3.683 9.731 11.796
236 2HD LYS 25 2HD LYS 25 -4.985 8.645 11.263
237 1HE LYS 25 1HE LYS 25 -4.219 6.976 13.008
238 2HE LYS 25 2HE LYS 25 -3.077 8.197 13.599
239 1HZ LYS 25 1HZ LYS 25 -4.965 9.642 13.996
240 2HZ LYS 25 2HZ LYS 25 -6.003 8.471 13.478
241 3HZ LYS 25 3HZ LYS 25 -5.106 8.231 14.839
242 H LEU 26 H LEU 26 -3.504 6.677 5.932
243 HA LEU 26 HA LEU 26 -4.116 9.304 4.627
244 1HB LEU 26 1HB LEU 26 -1.869 8.667 4.019
245 2HB LEU 26 2HB LEU 26 -2.401 7.036 3.633
246 HG LEU 26 HG LEU 26 -3.923 8.153 1.857
247 1HD1 LEU 26 1HD1 LEU 26 -3.609 10.538 2.560
248 2HD1 LEU 26 2HD1 LEU 26 -1.875 10.391 2.205
249 3HD1 LEU 26 3HD1 LEU 26 -3.058 10.268 0.901
250 1HD2 LEU 26 1HD2 LEU 26 -0.912 8.165 1.494
251 2HD2 LEU 26 2HD2 LEU 26 -1.979 6.757 1.294
252 3HD2 LEU 26 3HD2 LEU 26 -2.125 8.130 0.201
253 HA PRO 27 HA PRO 27 -7.770 6.683 3.874
254 1HB PRO 27 1HB PRO 27 -9.281 8.434 2.379
255 2HB PRO 27 2HB PRO 27 -9.158 8.479 4.160
256 1HG PRO 27 1HG PRO 27 -7.617 10.143 2.157
257 2HG PRO 27 2HG PRO 27 -8.437 10.695 3.645
258 1HD PRO 27 1HD PRO 27 -5.772 10.236 3.573
259 2HD PRO 27 2HD PRO 27 -6.713 9.796 5.027
260 H VAL 28 H VAL 28 -6.096 8.591 1.311
261 HA VAL 28 HA VAL 28 -6.773 7.060 -0.924
262 HB VAL 28 HB VAL 28 -4.370 8.640 -0.199
263 1HG1 VAL 28 1HG1 VAL 28 -3.313 6.759 -1.380
264 2HG1 VAL 28 2HG1 VAL 28 -4.527 6.887 -2.676
265 3HG1 VAL 28 3HG1 VAL 28 -3.350 8.183 -2.413
266 1HG2 VAL 28 1HG2 VAL 28 -6.212 8.751 -2.600
267 2HG2 VAL 28 2HG2 VAL 28 -6.381 9.749 -1.132
268 3HG2 VAL 28 3HG2 VAL 28 -4.952 9.916 -2.169
269 H LEU 29 H LEU 29 -4.609 6.098 1.791
270 HA LEU 29 HA LEU 29 -3.475 3.860 0.360
271 1HB LEU 29 1HB LEU 29 -3.124 5.087 2.898
272 2HB LEU 29 2HB LEU 29 -3.656 3.452 3.260
273 HG LEU 29 HG LEU 29 -1.431 4.046 1.287
274 1HD1 LEU 29 1HD1 LEU 29 -1.194 3.567 4.283
275 2HD1 LEU 29 2HD1 LEU 29 0.156 3.666 3.135
276 3HD1 LEU 29 3HD1 LEU 29 -0.862 5.088 3.425
277 1HD2 LEU 29 1HD2 LEU 29 -2.075 1.588 3.007
278 2HD2 LEU 29 2HD2 LEU 29 -2.433 1.729 1.271
279 3HD2 LEU 29 3HD2 LEU 29 -0.752 1.750 1.835
280 H ALA 30 H ALA 30 -6.182 4.260 2.691
281 HA ALA 30 HA ALA 30 -6.900 1.591 2.659
282 1HB ALA 30 1HB ALA 30 -7.836 3.242 4.263
283 2HB ALA 30 2HB ALA 30 -8.811 3.964 2.968
284 3HB ALA 30 3HB ALA 30 -9.120 2.296 3.488
285 H LYS 31 H LYS 31 -7.606 4.204 0.320
286 HA LYS 31 HA LYS 31 -9.599 2.629 -1.211
287 1HB LYS 31 1HB LYS 31 -8.361 5.358 -1.500
288 2HB LYS 31 2HB LYS 31 -9.030 4.550 -2.914
289 1HG LYS 31 1HG LYS 31 -10.675 5.993 -2.002
290 2HG LYS 31 2HG LYS 31 -11.222 4.326 -1.897
291 1HD LYS 31 1HD LYS 31 -9.838 5.554 0.497
292 2HD LYS 31 2HD LYS 31 -11.457 6.128 0.121
293 1HE LYS 31 1HE LYS 31 -10.785 3.184 0.606
294 2HE LYS 31 2HE LYS 31 -11.427 4.297 1.811
295 1HZ LYS 31 1HZ LYS 31 -13.347 4.606 0.430
296 2HZ LYS 31 2HZ LYS 31 -12.758 3.559 -0.699
297 3HZ LYS 31 3HZ LYS 31 -13.139 3.016 0.805
298 H ILE 32 H ILE 32 -6.160 3.300 -1.399
299 HA ILE 32 HA ILE 32 -5.719 2.218 -4.052
300 HB ILE 32 HB ILE 32 -3.975 2.708 -1.618
301 1HG1 ILE 32 1HG1 ILE 32 -3.810 3.662 -4.517
302 2HG1 ILE 32 2HG1 ILE 32 -4.596 4.541 -3.217
303 1HG2 ILE 32 1HG2 ILE 32 -3.102 0.587 -2.402
304 2HG2 ILE 32 2HG2 ILE 32 -3.106 1.152 -4.079
305 3HG2 ILE 32 3HG2 ILE 32 -1.995 1.847 -2.884
306 1HD1 ILE 32 1HD1 ILE 32 -2.369 4.559 -1.983
307 2HD1 ILE 32 2HD1 ILE 32 -1.623 3.927 -3.470
308 3HD1 ILE 32 3HD1 ILE 32 -2.423 5.497 -3.490
309 H LEU 33 H LEU 33 -5.745 0.892 -0.671
310 HA LEU 33 HA LEU 33 -4.870 -1.631 -1.608
311 1HB LEU 33 1HB LEU 33 -4.996 -2.232 0.658
312 2HB LEU 33 2HB LEU 33 -4.708 -0.477 0.661
313 HG LEU 33 HG LEU 33 -6.927 -0.063 1.273
314 1HD1 LEU 33 1HD1 LEU 33 -8.394 -1.708 0.604
315 2HD1 LEU 33 2HD1 LEU 33 -7.235 -3.021 0.959
316 3HD1 LEU 33 3HD1 LEU 33 -8.123 -2.204 2.274
317 1HD2 LEU 33 1HD2 LEU 33 -5.408 -2.114 2.920
318 2HD2 LEU 33 2HD2 LEU 33 -5.108 -0.362 2.885
319 3HD2 LEU 33 3HD2 LEU 33 -6.614 -0.983 3.581
320 H GLU 34 H GLU 34 -8.006 -0.135 -1.664
321 HA GLU 34 HA GLU 34 -9.545 -2.562 -1.799
322 1HB GLU 34 1HB GLU 34 -10.298 -0.201 -1.079
323 2HB GLU 34 2HB GLU 34 -10.320 0.215 -2.779
324 1HG GLU 34 1HG GLU 34 -11.733 -2.289 -2.514
325 2HG GLU 34 2HG GLU 34 -12.321 -1.200 -1.253
326 H ASP 35 H ASP 35 -8.462 -0.058 -4.102
327 HA ASP 35 HA ASP 35 -9.542 -1.260 -6.446
328 1HB ASP 35 1HB ASP 35 -8.686 1.077 -6.353
329 2HB ASP 35 2HB ASP 35 -7.027 0.447 -6.289
330 H GLU 36 H GLU 36 -6.307 -1.587 -4.962
331 HA GLU 36 HA GLU 36 -5.172 -3.442 -6.764
332 1HB GLU 36 1HB GLU 36 -4.898 -3.214 -3.735
333 2HB GLU 36 2HB GLU 36 -3.843 -4.191 -4.760
334 1HG GLU 36 1HG GLU 36 -4.139 -1.217 -5.322
335 2HG GLU 36 2HG GLU 36 -3.052 -1.816 -4.064
336 H GLU 37 H GLU 37 -7.316 -4.053 -3.885
337 HA GLU 37 HA GLU 37 -7.345 -6.759 -3.944
338 1HB GLU 37 1HB GLU 37 -8.562 -4.791 -2.497
339 2HB GLU 37 2HB GLU 37 -9.963 -5.293 -3.425
340 1HG GLU 37 1HG GLU 37 -8.198 -7.339 -2.068
341 2HG GLU 37 2HG GLU 37 -9.257 -6.302 -1.114
342 H LYS 38 H LYS 38 -9.483 -4.585 -5.856
343 HA LYS 38 HA LYS 38 -10.846 -6.730 -7.211
344 1HB LYS 38 1HB LYS 38 -11.560 -4.290 -7.084
345 2HB LYS 38 2HB LYS 38 -10.182 -3.891 -8.097
346 1HG LYS 38 1HG LYS 38 -11.852 -3.835 -9.623
347 2HG LYS 38 2HG LYS 38 -11.259 -5.466 -9.898
348 1HD LYS 38 1HD LYS 38 -13.690 -4.715 -8.180
349 2HD LYS 38 2HD LYS 38 -13.752 -5.184 -9.884
350 1HE LYS 38 1HE LYS 38 -12.675 -7.405 -9.228
351 2HE LYS 38 2HE LYS 38 -12.960 -6.945 -7.533
352 1HZ LYS 38 1HZ LYS 38 -15.261 -6.801 -7.978
353 2HZ LYS 38 2HZ LYS 38 -15.044 -7.172 -9.574
354 3HZ LYS 38 3HZ LYS 38 -14.692 -8.284 -8.412
355 H HIS 39 H HIS 39 -7.943 -4.897 -8.168
356 HA HIS 39 HA HIS 39 -7.513 -6.248 -10.629
357 1HB HIS 39 1HB HIS 39 -5.936 -4.567 -8.744
358 2HB HIS 39 2HB HIS 39 -4.970 -5.729 -9.624
359 HD1 HIS 39 HD1 HIS 39 -4.397 -5.118 -12.039
360 HD2 HIS 39 HD2 HIS 39 -7.533 -2.860 -10.376
361 HE1 HIS 39 HE1 HIS 39 -4.897 -3.274 -13.697
362 HE2 HIS 39 HE2 HIS 39 -6.836 -1.892 -12.704
363 H ILE 40 H ILE 40 -6.746 -7.207 -7.347
364 HA ILE 40 HA ILE 40 -5.256 -9.615 -8.149
365 HB ILE 40 HB ILE 40 -5.922 -8.173 -5.575
366 1HG1 ILE 40 1HG1 ILE 40 -3.214 -9.031 -6.650
367 2HG1 ILE 40 2HG1 ILE 40 -3.986 -7.638 -7.331
368 1HG2 ILE 40 1HG2 ILE 40 -6.132 -10.527 -4.971
369 2HG2 ILE 40 2HG2 ILE 40 -4.597 -10.902 -5.785
370 3HG2 ILE 40 3HG2 ILE 40 -4.641 -9.879 -4.325
371 1HD1 ILE 40 1HD1 ILE 40 -4.085 -6.448 -5.277
372 2HD1 ILE 40 2HD1 ILE 40 -3.525 -7.831 -4.333
373 3HD1 ILE 40 3HD1 ILE 40 -2.435 -7.034 -5.486
374 H GLU 41 H GLU 41 -8.540 -8.712 -7.343
375 HA GLU 41 HA GLU 41 -9.487 -11.178 -6.345
376 1HB GLU 41 1HB GLU 41 -10.754 -8.951 -6.448
377 2HB GLU 41 2HB GLU 41 -11.011 -9.278 -8.178
378 1HG GLU 41 1HG GLU 41 -11.946 -11.577 -7.339
379 2HG GLU 41 2HG GLU 41 -12.024 -10.783 -5.756
380 H TRP 42 H TRP 42 -8.975 -9.815 -9.572
381 HA TRP 42 HA TRP 42 -9.896 -11.804 -11.264
382 1HB TRP 42 1HB TRP 42 -8.712 -9.485 -11.608
383 2HB TRP 42 2HB TRP 42 -7.238 -10.417 -11.669
384 HD1 TRP 42 HD1 TRP 42 -10.474 -9.916 -13.592
385 HE1 TRP 42 HE1 TRP 42 -10.298 -10.998 -15.930
386 HE3 TRP 42 HE3 TRP 42 -6.051 -12.215 -12.984
387 HZ2 TRP 42 HZ2 TRP 42 -8.424 -12.759 -17.327
388 HZ3 TRP 42 HZ3 TRP 42 -5.052 -13.661 -14.799
389 HH2 TRP 42 HH2 TRP 42 -6.277 -13.959 -16.939
390 H LEU 43 H LEU 43 -7.135 -11.873 -9.155
391 HA LEU 43 HA LEU 43 -6.134 -14.364 -10.406
392 1HB LEU 43 1HB LEU 43 -4.827 -12.341 -8.500
393 2HB LEU 43 2HB LEU 43 -4.074 -13.885 -8.876
394 HG LEU 43 HG LEU 43 -4.857 -12.022 -11.119
395 1HD1 LEU 43 1HD1 LEU 43 -3.420 -10.758 -9.426
396 2HD1 LEU 43 2HD1 LEU 43 -2.126 -11.905 -9.808
397 3HD1 LEU 43 3HD1 LEU 43 -2.794 -10.886 -11.079
398 1HD2 LEU 43 1HD2 LEU 43 -2.673 -14.138 -10.717
399 2HD2 LEU 43 2HD2 LEU 43 -4.150 -14.354 -11.671
400 3HD2 LEU 43 3HD2 LEU 43 -2.917 -13.190 -12.187
401 H GLU 44 H GLU 44 -7.592 -13.201 -7.437
402 HA GLU 44 HA GLU 44 -7.043 -15.703 -5.978
403 1HB GLU 44 1HB GLU 44 -8.867 -13.326 -5.543
404 2HB GLU 44 2HB GLU 44 -8.974 -14.771 -4.531
405 1HG GLU 44 1HG GLU 44 -6.239 -13.548 -4.924
406 2HG GLU 44 2HG GLU 44 -7.398 -12.694 -3.901
407 H THR 45 H THR 45 -9.858 -14.269 -7.087
408 HA THR 45 HA THR 45 -11.786 -16.221 -6.784
409 HB THR 45 HB THR 45 -11.995 -13.823 -7.704
410 HG1 THR 45 HG1 THR 45 -13.716 -15.878 -8.601
411 1HG2 THR 45 1HG2 THR 45 -10.890 -14.131 -9.955
412 2HG2 THR 45 2HG2 THR 45 -12.266 -15.148 -10.426
413 3HG2 THR 45 3HG2 THR 45 -12.518 -13.454 -9.999
414 H ILE 46 H ILE 46 -9.784 -15.808 -9.464
415 HA ILE 46 HA ILE 46 -10.891 -17.105 -11.500
416 HB ILE 46 HB ILE 46 -9.051 -15.680 -11.720
417 1HG1 ILE 46 1HG1 ILE 46 -7.525 -18.059 -12.646
418 2HG1 ILE 46 2HG1 ILE 46 -9.168 -17.868 -13.308
419 1HG2 ILE 46 1HG2 ILE 46 -8.003 -15.641 -9.894
420 2HG2 ILE 46 2HG2 ILE 46 -7.582 -17.335 -9.770
421 3HG2 ILE 46 3HG2 ILE 46 -6.749 -16.306 -10.948
422 1HD1 ILE 46 1HD1 ILE 46 -8.750 -15.566 -13.925
423 2HD1 ILE 46 2HD1 ILE 46 -7.118 -15.636 -13.226
424 3HD1 ILE 46 3HD1 ILE 46 -7.521 -16.626 -14.661
425 H LEU 47 H LEU 47 -8.602 -18.812 -9.332
426 HA LEU 47 HA LEU 47 -9.858 -21.353 -9.956
427 1HB LEU 47 1HB LEU 47 -8.131 -21.172 -11.729
428 2HB LEU 47 2HB LEU 47 -6.868 -21.002 -10.510
429 HG LEU 47 HG LEU 47 -8.673 -23.349 -10.090
430 1HD1 LEU 47 1HD1 LEU 47 -8.661 -23.336 -12.550
431 2HD1 LEU 47 2HD1 LEU 47 -6.882 -23.301 -12.548
432 3HD1 LEU 47 3HD1 LEU 47 -7.751 -24.710 -11.900
433 1HD2 LEU 47 1HD2 LEU 47 -5.639 -23.126 -10.335
434 2HD2 LEU 47 2HD2 LEU 47 -6.552 -23.087 -8.815
435 3HD2 LEU 47 3HD2 LEU 47 -6.543 -24.554 -9.792
436 H GLY 48 H GLY 48 -10.546 -20.920 -7.832
437 1HA GLY 48 1HA GLY 48 -8.832 -21.777 -5.702
438 2HA GLY 48 2HA GLY 48 -9.064 -20.005 -5.709
439 1HN NH2 49 1HN NH2 49 -10.191 -20.768 -3.555
440 2HN NH2 49 2HN NH2 49 -11.934 -21.123 -3.695
441 1H ACE 0 H1 ACE 0 11.297 4.657 5.251
442 2H ACE 0 H2 ACE 0 10.306 4.913 6.705
443 3H ACE 0 H3 ACE 0 11.962 4.280 6.854
444 H ASP 1 H ASP 1 10.359 2.746 8.145
445 HA ASP 1 HA ASP 1 10.754 0.259 7.071
446 1HB ASP 1 1HB ASP 1 10.178 0.939 9.497
447 2HB ASP 1 2HB ASP 1 8.481 0.711 9.030
448 H TYR 2 H TYR 2 7.638 2.028 7.073
449 HA TYR 2 HA TYR 2 5.952 0.332 5.622
450 1HB TYR 2 1HB TYR 2 6.130 3.321 5.243
451 2HB TYR 2 2HB TYR 2 4.717 2.278 5.246
452 HD1 TYR 2 HD1 TYR 2 5.041 0.746 7.809
453 HD2 TYR 2 HD2 TYR 2 5.741 4.918 6.931
454 HE1 TYR 2 HE1 TYR 2 5.115 1.254 10.227
455 HE2 TYR 2 HE2 TYR 2 5.750 5.420 9.346
456 HH TYR 2 HH TYR 2 5.580 4.568 11.475
457 H LEU 3 H LEU 3 8.345 2.622 4.241
458 HA LEU 3 HA LEU 3 7.608 1.941 1.545
459 1HB LEU 3 1HB LEU 3 10.234 3.079 2.592
460 2HB LEU 3 2HB LEU 3 9.680 3.122 0.922
461 HG LEU 3 HG LEU 3 8.276 4.533 3.249
462 1HD1 LEU 3 1HD1 LEU 3 10.497 5.484 2.805
463 2HD1 LEU 3 2HD1 LEU 3 10.087 5.659 1.083
464 3HD1 LEU 3 3HD1 LEU 3 9.204 6.591 2.312
465 1HD2 LEU 3 1HD2 LEU 3 7.844 4.698 0.230
466 2HD2 LEU 3 2HD2 LEU 3 6.702 4.025 1.415
467 3HD2 LEU 3 3HD2 LEU 3 7.082 5.750 1.437
468 H ARG 4 H ARG 4 10.016 0.790 3.868
469 HA ARG 4 HA ARG 4 11.087 -1.241 2.070
470 1HB ARG 4 1HB ARG 4 11.493 -0.509 4.966
471 2HB ARG 4 2HB ARG 4 12.191 -1.990 4.312
472 1HG ARG 4 1HG ARG 4 12.580 0.658 2.872
473 2HG ARG 4 2HG ARG 4 13.605 0.229 4.241
474 1HD ARG 4 1HD ARG 4 14.712 -1.410 3.149
475 2HD ARG 4 2HD ARG 4 13.300 -1.950 2.222
476 HE ARG 4 HE ARG 4 13.819 0.471 1.091
477 1HH1 ARG 4 1HH2 ARG 4 15.790 -2.391 1.700
478 2HH1 ARG 4 2HH2 ARG 4 16.714 -2.254 0.231
479 1HH2 ARG 4 1HH1 ARG 4 14.974 0.648 -0.858
480 2HH2 ARG 4 2HH1 ARG 4 16.232 -0.483 -1.264
481 H GLU 5 H GLU 5 8.059 -1.090 3.193
482 HA GLU 5 HA GLU 5 7.854 -4.077 3.215
483 1HB GLU 5 1HB GLU 5 6.229 -2.041 4.794
484 2HB GLU 5 2HB GLU 5 5.749 -3.730 4.551
485 1HG GLU 5 1HG GLU 5 7.769 -4.511 5.692
486 2HG GLU 5 2HG GLU 5 8.334 -2.853 5.907
487 H LEU 6 H LEU 6 5.637 -1.296 2.929
488 HA LEU 6 HA LEU 6 3.939 -2.600 1.029
489 1HB LEU 6 1HB LEU 6 4.124 0.256 2.062
490 2HB LEU 6 2HB LEU 6 2.897 -0.318 0.932
491 HG LEU 6 HG LEU 6 1.875 -1.770 2.574
492 1HD1 LEU 6 1HD1 LEU 6 3.832 -2.400 3.925
493 2HD1 LEU 6 2HD1 LEU 6 3.927 -0.738 4.563
494 3HD1 LEU 6 3HD1 LEU 6 2.524 -1.790 4.888
495 1HD2 LEU 6 1HD2 LEU 6 2.314 0.976 3.782
496 2HD2 LEU 6 2HD2 LEU 6 1.523 0.801 2.215
497 3HD2 LEU 6 3HD2 LEU 6 0.798 0.049 3.605
498 H LEU 7 H LEU 7 6.947 -1.478 0.391
499 HA LEU 7 HA LEU 7 6.244 -1.018 -2.382
500 1HB LEU 7 1HB LEU 7 6.779 1.133 -2.106
501 2HB LEU 7 2HB LEU 7 7.740 0.862 -0.682
502 HG LEU 7 HG LEU 7 9.617 -0.006 -2.185
503 1HD1 LEU 7 1HD1 LEU 7 8.242 -0.535 -4.202
504 2HD1 LEU 7 2HD1 LEU 7 7.798 1.172 -4.339
505 3HD1 LEU 7 3HD1 LEU 7 9.484 0.670 -4.570
506 1HD2 LEU 7 1HD2 LEU 7 8.581 2.828 -2.479
507 2HD2 LEU 7 2HD2 LEU 7 9.646 2.200 -1.209
508 3HD2 LEU 7 3HD2 LEU 7 10.237 2.289 -2.874
509 H LYS 8 H LYS 8 8.994 -1.677 -0.186
510 HA LYS 8 HA LYS 8 10.508 -3.052 -2.031
511 1HB LYS 8 1HB LYS 8 11.441 -2.326 0.011
512 2HB LYS 8 2HB LYS 8 10.320 -3.307 0.968
513 1HG LYS 8 1HG LYS 8 12.102 -4.804 -0.914
514 2HG LYS 8 2HG LYS 8 12.889 -4.000 0.453
515 1HD LYS 8 1HD LYS 8 11.544 -5.152 2.086
516 2HD LYS 8 2HD LYS 8 10.455 -5.788 0.863
517 1HE LYS 8 1HE LYS 8 11.947 -7.538 1.626
518 2HE LYS 8 2HE LYS 8 12.216 -7.198 -0.090
519 1HZ LYS 8 1HZ LYS 8 14.120 -5.892 0.537
520 2HZ LYS 8 2HZ LYS 8 13.852 -6.188 2.138
521 3HZ LYS 8 3HZ LYS 8 14.259 -7.425 1.127
522 H LEU 9 H LEU 9 7.976 -4.408 0.122
523 HA LEU 9 HA LEU 9 8.430 -7.131 -0.843
524 1HB LEU 9 1HB LEU 9 6.123 -5.941 0.761
525 2HB LEU 9 2HB LEU 9 6.287 -7.637 0.369
526 HG LEU 9 HG LEU 9 8.389 -6.155 1.993
527 1HD1 LEU 9 1HD1 LEU 9 6.224 -6.089 3.165
528 2HD1 LEU 9 2HD1 LEU 9 6.023 -7.837 2.929
529 3HD1 LEU 9 3HD1 LEU 9 7.331 -7.219 3.962
530 1HD2 LEU 9 1HD2 LEU 9 7.767 -9.124 1.569
531 2HD2 LEU 9 2HD2 LEU 9 9.184 -8.267 0.931
532 3HD2 LEU 9 3HD2 LEU 9 8.997 -8.484 2.674
533 H GLU 10 H GLU 10 6.866 -4.351 -2.191
534 HA GLU 10 HA GLU 10 4.933 -5.924 -3.728
535 1HB GLU 10 1HB GLU 10 5.881 -3.139 -4.362
536 2HB GLU 10 2HB GLU 10 4.362 -3.956 -4.701
537 1HG GLU 10 1HG GLU 10 5.183 -3.136 -1.876
538 2HG GLU 10 2HG GLU 10 4.343 -2.064 -2.987
539 H LEU 11 H LEU 11 8.108 -4.334 -4.025
540 HA LEU 11 HA LEU 11 8.507 -4.425 -6.750
541 1HB LEU 11 1HB LEU 11 10.144 -3.945 -4.452
542 2HB LEU 11 2HB LEU 11 10.975 -5.213 -5.337
543 HG LEU 11 HG LEU 11 10.610 -3.675 -7.438
544 1HD1 LEU 11 1HD1 LEU 11 9.046 -2.095 -6.256
545 2HD1 LEU 11 2HD1 LEU 11 10.363 -1.660 -5.148
546 3HD1 LEU 11 3HD1 LEU 11 10.489 -1.269 -6.874
547 1HD2 LEU 11 1HD2 LEU 11 12.547 -2.958 -5.195
548 2HD2 LEU 11 2HD2 LEU 11 12.804 -4.164 -6.476
549 3HD2 LEU 11 3HD2 LEU 11 12.696 -2.445 -6.891
550 H GLN 12 H GLN 12 9.343 -7.003 -4.447
551 HA GLN 12 HA GLN 12 10.379 -8.889 -6.287
552 1HB GLN 12 1HB GLN 12 9.570 -10.599 -4.568
553 2HB GLN 12 2HB GLN 12 10.680 -9.360 -3.964
554 1HG GLN 12 1HG GLN 12 8.962 -8.168 -2.854
555 2HG GLN 12 2HG GLN 12 7.685 -8.992 -3.763
556 1HE2 GLN 12 2HE2 GLN 12 6.749 -9.215 -1.618
557 2HE2 GLN 12 1HE2 GLN 12 7.215 -10.626 -0.663
558 H LEU 13 H LEU 13 7.014 -7.987 -5.721
559 HA LEU 13 HA LEU 13 5.902 -10.433 -6.825
560 1HB LEU 13 1HB LEU 13 4.451 -7.803 -6.367
561 2HB LEU 13 2HB LEU 13 3.789 -9.428 -6.525
562 HG LEU 13 HG LEU 13 5.490 -8.345 -4.271
563 1HD1 LEU 13 1HD1 LEU 13 3.206 -7.612 -4.275
564 2HD1 LEU 13 2HD1 LEU 13 2.603 -9.285 -4.338
565 3HD1 LEU 13 3HD1 LEU 13 3.487 -8.719 -2.906
566 1HD2 LEU 13 1HD2 LEU 13 4.366 -11.134 -4.640
567 2HD2 LEU 13 2HD2 LEU 13 6.095 -10.724 -4.567
568 3HD2 LEU 13 3HD2 LEU 13 5.095 -10.507 -3.131
569 H ILE 14 H ILE 14 6.269 -6.978 -7.805
570 HA ILE 14 HA ILE 14 5.197 -7.344 -10.438
571 HB ILE 14 HB ILE 14 7.017 -5.345 -9.094
572 1HG1 ILE 14 1HG1 ILE 14 5.224 -3.836 -9.535
573 2HG1 ILE 14 2HG1 ILE 14 4.488 -4.906 -10.735
574 1HG2 ILE 14 1HG2 ILE 14 8.050 -5.469 -11.313
575 2HG2 ILE 14 2HG2 ILE 14 6.455 -5.360 -12.091
576 3HG2 ILE 14 3HG2 ILE 14 7.098 -3.991 -11.170
577 1HD1 ILE 14 1HD1 ILE 14 3.756 -6.448 -8.958
578 2HD1 ILE 14 2HD1 ILE 14 4.588 -5.445 -7.742
579 3HD1 ILE 14 3HD1 ILE 14 3.208 -4.812 -8.663
580 H LYS 15 H LYS 15 8.479 -8.034 -9.191
581 HA LYS 15 HA LYS 15 9.474 -8.863 -11.750
582 1HB LYS 15 1HB LYS 15 10.455 -8.519 -9.067
583 2HB LYS 15 2HB LYS 15 10.644 -10.211 -9.443
584 1HG LYS 15 1HG LYS 15 12.658 -9.113 -10.165
585 2HG LYS 15 2HG LYS 15 11.747 -9.448 -11.647
586 1HD LYS 15 1HD LYS 15 10.740 -7.024 -11.287
587 2HD LYS 15 2HD LYS 15 12.055 -6.814 -10.126
588 1HE LYS 15 1HE LYS 15 13.696 -7.367 -11.965
589 2HE LYS 15 2HE LYS 15 12.331 -7.523 -13.091
590 1HZ LYS 15 1HZ LYS 15 11.783 -5.238 -12.640
591 2HZ LYS 15 2HZ LYS 15 13.082 -5.087 -11.637
592 3HZ LYS 15 3HZ LYS 15 13.309 -5.379 -13.244
593 H GLN 16 H GLN 16 7.994 -10.667 -8.991
594 HA GLN 16 HA GLN 16 8.306 -13.215 -10.332
595 1HB GLN 16 1HB GLN 16 6.899 -12.272 -7.846
596 2HB GLN 16 2HB GLN 16 6.363 -13.781 -8.583
597 1HG GLN 16 1HG GLN 16 8.013 -14.317 -6.938
598 2HG GLN 16 2HG GLN 16 8.634 -14.695 -8.540
599 1HE2 GLN 16 2HE2 GLN 16 9.247 -12.982 -5.599
600 2HE2 GLN 16 1HE2 GLN 16 10.696 -12.168 -6.166
601 H TYR 17 H TYR 17 5.945 -10.709 -10.592
602 HA TYR 17 HA TYR 17 3.825 -12.186 -11.832
603 1HB TYR 17 1HB TYR 17 4.627 -9.307 -11.432
604 2HB TYR 17 2HB TYR 17 3.688 -9.642 -12.833
605 HD1 TYR 17 HD1 TYR 17 1.396 -10.517 -12.788
606 HD2 TYR 17 HD2 TYR 17 3.437 -8.882 -9.373
607 HE1 TYR 17 HE1 TYR 17 -0.768 -10.039 -11.713
608 HE2 TYR 17 HE2 TYR 17 1.284 -8.352 -8.333
609 HH TYR 17 HH TYR 17 -1.839 -9.346 -9.747
610 H ARG 18 H ARG 18 6.926 -10.881 -12.898
611 HA ARG 18 HA ARG 18 6.259 -11.100 -15.748
612 1HB ARG 18 1HB ARG 18 8.957 -10.719 -14.403
613 2HB ARG 18 2HB ARG 18 8.657 -10.769 -16.143
614 1HG ARG 18 1HG ARG 18 7.056 -8.825 -15.875
615 2HG ARG 18 2HG ARG 18 7.539 -8.756 -14.177
616 1HD ARG 18 1HD ARG 18 9.969 -8.550 -15.032
617 2HD ARG 18 2HD ARG 18 9.246 -8.307 -16.642
618 HE ARG 18 HE ARG 18 8.182 -6.592 -14.516
619 1HH1 ARG 18 1HH2 ARG 18 10.686 -6.889 -16.987
620 2HH1 ARG 18 2HH2 ARG 18 11.024 -5.182 -17.064
621 1HH2 ARG 18 1HH1 ARG 18 8.623 -4.373 -14.565
622 2HH2 ARG 18 2HH1 ARG 18 9.827 -3.711 -15.634
623 H GLU 19 H GLU 19 8.092 -12.783 -13.296
624 HA GLU 19 HA GLU 19 8.979 -15.017 -14.759
625 1HB GLU 19 1HB GLU 19 9.522 -14.259 -12.352
626 2HB GLU 19 2HB GLU 19 8.090 -15.196 -11.877
627 1HG GLU 19 1HG GLU 19 9.093 -17.235 -12.728
628 2HG GLU 19 2HG GLU 19 10.420 -16.336 -13.476
629 H ALA 20 H ALA 20 5.848 -14.499 -13.032
630 HA ALA 20 HA ALA 20 4.785 -17.035 -13.872
631 1HB ALA 20 1HB ALA 20 3.732 -16.121 -12.004
632 2HB ALA 20 2HB ALA 20 3.743 -14.492 -12.687
633 3HB ALA 20 3HB ALA 20 2.591 -15.710 -13.302
634 H LEU 21 H LEU 21 4.389 -13.738 -15.144
635 HA LEU 21 HA LEU 21 2.565 -14.189 -17.169
636 1HB LEU 21 1HB LEU 21 3.361 -11.984 -16.606
637 2HB LEU 21 2HB LEU 21 5.011 -12.425 -17.053
638 HG LEU 21 HG LEU 21 4.301 -12.621 -19.448
639 1HD1 LEU 21 1HD1 LEU 21 1.845 -12.939 -19.056
640 2HD1 LEU 21 2HD1 LEU 21 1.763 -11.290 -18.402
641 3HD1 LEU 21 3HD1 LEU 21 2.180 -11.552 -20.105
642 1HD2 LEU 21 1HD2 LEU 21 3.974 -9.999 -17.947
643 2HD2 LEU 21 2HD2 LEU 21 5.471 -10.685 -18.595
644 3HD2 LEU 21 3HD2 LEU 21 4.209 -10.138 -19.712
645 H GLU 22 H GLU 22 6.041 -15.050 -17.202
646 HA GLU 22 HA GLU 22 5.956 -15.588 -20.041
647 1HB GLU 22 1HB GLU 22 8.176 -16.563 -19.840
648 2HB GLU 22 2HB GLU 22 8.053 -14.886 -19.281
649 1HG GLU 22 1HG GLU 22 8.077 -15.569 -16.990
650 2HG GLU 22 2HG GLU 22 8.015 -17.293 -17.424
651 H TYR 23 H TYR 23 5.576 -17.503 -17.096
652 HA TYR 23 HA TYR 23 5.456 -20.083 -18.421
653 1HB TYR 23 1HB TYR 23 4.976 -18.967 -15.701
654 2HB TYR 23 2HB TYR 23 3.857 -20.233 -16.147
655 HD1 TYR 23 HD1 TYR 23 4.716 -22.482 -16.941
656 HD2 TYR 23 HD2 TYR 23 7.201 -19.551 -14.979
657 HE1 TYR 23 HE1 TYR 23 6.337 -24.259 -16.333
658 HE2 TYR 23 HE2 TYR 23 8.814 -21.322 -14.379
659 HH TYR 23 HH TYR 23 9.363 -23.543 -14.582
660 H VAL 24 H VAL 24 3.109 -17.603 -17.466
661 HA VAL 24 HA VAL 24 0.900 -19.408 -18.233
662 HB VAL 24 HB VAL 24 0.997 -16.853 -16.582
663 1HG1 VAL 24 1HG1 VAL 24 -1.220 -16.919 -17.675
664 2HG1 VAL 24 2HG1 VAL 24 -1.366 -18.659 -17.349
665 3HG1 VAL 24 3HG1 VAL 24 -1.397 -17.495 -16.016
666 1HG2 VAL 24 1HG2 VAL 24 0.459 -19.763 -15.902
667 2HG2 VAL 24 2HG2 VAL 24 1.942 -18.851 -15.525
668 3HG2 VAL 24 3HG2 VAL 24 0.407 -18.369 -14.803
669 H LYS 25 H LYS 25 2.455 -16.640 -19.623
670 HA LYS 25 HA LYS 25 2.019 -15.407 -21.470
671 1HB LYS 25 1HB LYS 25 1.131 -18.200 -22.281
672 2HB LYS 25 2HB LYS 25 1.301 -16.895 -23.453
673 1HG LYS 25 1HG LYS 25 3.575 -17.788 -21.639
674 2HG LYS 25 2HG LYS 25 3.279 -18.442 -23.251
675 1HD LYS 25 1HD LYS 25 3.412 -16.123 -24.214
676 2HD LYS 25 2HD LYS 25 3.855 -15.508 -22.606
677 1HE LYS 25 1HE LYS 25 5.843 -16.986 -22.579
678 2HE LYS 25 2HE LYS 25 5.438 -17.557 -24.208
679 1HZ LYS 25 1HZ LYS 25 5.651 -15.299 -24.977
680 2HZ LYS 25 2HZ LYS 25 6.026 -14.776 -23.458
681 3HZ LYS 25 3HZ LYS 25 7.046 -15.797 -24.252
682 H LEU 26 H LEU 26 0.279 -14.433 -19.945
683 HA LEU 26 HA LEU 26 -2.242 -14.310 -21.530
684 1HB LEU 26 1HB LEU 26 -2.213 -15.755 -19.413
685 2HB LEU 26 2HB LEU 26 -2.182 -14.251 -18.495
686 HG LEU 26 HG LEU 26 -4.298 -14.926 -20.601
687 1HD1 LEU 26 1HD1 LEU 26 -4.280 -16.697 -18.886
688 2HD1 LEU 26 2HD1 LEU 26 -4.354 -15.479 -17.598
689 3HD1 LEU 26 3HD1 LEU 26 -5.720 -15.684 -18.718
690 1HD2 LEU 26 1HD2 LEU 26 -4.270 -13.013 -18.221
691 2HD2 LEU 26 2HD2 LEU 26 -4.215 -12.544 -19.936
692 3HD2 LEU 26 3HD2 LEU 26 -5.667 -13.306 -19.280
693 HA PRO 27 HA PRO 27 -0.521 -10.186 -21.541
694 1HB PRO 27 1HB PRO 27 -2.667 -8.723 -22.545
695 2HB PRO 27 2HB PRO 27 -1.549 -9.711 -23.521
696 1HG PRO 27 1HG PRO 27 -4.272 -10.498 -22.467
697 2HG PRO 27 2HG PRO 27 -3.615 -10.744 -24.108
698 1HD PRO 27 1HD PRO 27 -3.606 -12.740 -22.300
699 2HD PRO 27 2HD PRO 27 -2.183 -12.508 -23.357
700 H VAL 28 H VAL 28 -3.798 -10.617 -20.218
701 HA VAL 28 HA VAL 28 -4.024 -8.282 -18.766
702 HB VAL 28 HB VAL 28 -5.140 -10.932 -17.955
703 1HG1 VAL 28 1HG1 VAL 28 -5.416 -9.246 -16.211
704 2HG1 VAL 28 2HG1 VAL 28 -6.079 -8.097 -17.388
705 3HG1 VAL 28 3HG1 VAL 28 -6.969 -9.577 -16.976
706 1HG2 VAL 28 1HG2 VAL 28 -6.220 -8.825 -19.881
707 2HG2 VAL 28 2HG2 VAL 28 -5.773 -10.492 -20.305
708 3HG2 VAL 28 3HG2 VAL 28 -7.160 -10.195 -19.261
709 H LEU 29 H LEU 29 -2.025 -11.155 -17.868
710 HA LEU 29 HA LEU 29 -1.719 -10.529 -15.103
711 1HB LEU 29 1HB LEU 29 -0.096 -11.955 -17.265
712 2HB LEU 29 2HB LEU 29 0.565 -11.706 -15.684
713 HG LEU 29 HG LEU 29 -2.077 -13.154 -16.143
714 1HD1 LEU 29 1HD1 LEU 29 -0.795 -15.220 -15.821
715 2HD1 LEU 29 2HD1 LEU 29 -0.166 -14.359 -17.242
716 3HD1 LEU 29 3HD1 LEU 29 0.718 -14.309 -15.700
717 1HD2 LEU 29 1HD2 LEU 29 -0.122 -12.928 -13.818
718 2HD2 LEU 29 2HD2 LEU 29 -1.774 -12.287 -13.846
719 3HD2 LEU 29 3HD2 LEU 29 -1.504 -14.041 -13.839
720 H ALA 30 H ALA 30 0.228 -9.659 -17.971
721 HA ALA 30 HA ALA 30 2.020 -8.023 -16.510
722 1HB ALA 30 1HB ALA 30 2.689 -7.140 -18.699
723 2HB ALA 30 2HB ALA 30 2.315 -8.862 -18.928
724 3HB ALA 30 3HB ALA 30 1.149 -7.635 -19.430
725 H LYS 31 H LYS 31 -1.224 -7.433 -17.811
726 HA LYS 31 HA LYS 31 -0.971 -4.549 -17.560
727 1HB LYS 31 1HB LYS 31 -2.467 -5.647 -19.179
728 2HB LYS 31 2HB LYS 31 -3.467 -6.238 -17.846
729 1HG LYS 31 1HG LYS 31 -2.894 -3.286 -17.898
730 2HG LYS 31 2HG LYS 31 -3.889 -3.880 -19.226
731 1HD LYS 31 1HD LYS 31 -4.517 -4.541 -16.317
732 2HD LYS 31 2HD LYS 31 -5.113 -3.077 -17.107
733 1HE LYS 31 1HE LYS 31 -6.351 -4.320 -18.755
734 2HE LYS 31 2HE LYS 31 -5.594 -5.851 -18.298
735 1HZ LYS 31 1HZ LYS 31 -6.653 -5.706 -16.181
736 2HZ LYS 31 2HZ LYS 31 -7.371 -4.277 -16.582
737 3HZ LYS 31 3HZ LYS 31 -7.767 -5.657 -17.392
738 H ILE 32 H ILE 32 -1.841 -7.183 -15.380
739 HA ILE 32 HA ILE 32 -3.087 -5.411 -13.442
740 HB ILE 32 HB ILE 32 -2.254 -8.340 -13.367
741 1HG1 ILE 32 1HG1 ILE 32 -5.049 -7.162 -13.091
742 2HG1 ILE 32 2HG1 ILE 32 -4.371 -7.511 -14.680
743 1HG2 ILE 32 1HG2 ILE 32 -1.977 -7.386 -11.123
744 2HG2 ILE 32 2HG2 ILE 32 -3.543 -6.589 -11.224
745 3HG2 ILE 32 3HG2 ILE 32 -3.460 -8.348 -11.135
746 1HD1 ILE 32 1HD1 ILE 32 -4.059 -9.880 -14.074
747 2HD1 ILE 32 2HD1 ILE 32 -4.738 -9.574 -12.460
748 3HD1 ILE 32 3HD1 ILE 32 -5.751 -9.371 -13.889
749 H LEU 33 H LEU 33 -0.006 -7.226 -13.904
750 HA LEU 33 HA LEU 33 1.245 -6.235 -11.519
751 1HB LEU 33 1HB LEU 33 3.130 -7.256 -12.236
752 2HB LEU 33 2HB LEU 33 1.910 -8.083 -13.217
753 HG LEU 33 HG LEU 33 2.478 -6.570 -15.081
754 1HD1 LEU 33 1HD1 LEU 33 3.718 -4.782 -14.648
755 2HD1 LEU 33 2HD1 LEU 33 4.353 -5.481 -13.134
756 3HD1 LEU 33 3HD1 LEU 33 5.083 -5.894 -14.709
757 1HD2 LEU 33 1HD2 LEU 33 4.764 -8.278 -14.098
758 2HD2 LEU 33 2HD2 LEU 33 3.273 -8.926 -14.846
759 3HD2 LEU 33 3HD2 LEU 33 4.359 -7.892 -15.784
760 H GLU 34 H GLU 34 0.911 -4.761 -14.799
761 HA GLU 34 HA GLU 34 2.627 -2.558 -14.327
762 1HB GLU 34 1HB GLU 34 1.557 -3.349 -16.502
763 2HB GLU 34 2HB GLU 34 0.118 -2.453 -16.041
764 1HG GLU 34 1HG GLU 34 2.935 -1.283 -16.296
765 2HG GLU 34 2HG GLU 34 1.725 -1.265 -17.586
766 H ASP 35 H ASP 35 -0.910 -2.834 -14.005
767 HA ASP 35 HA ASP 35 -1.410 -0.268 -12.909
768 1HB ASP 35 1HB ASP 35 -3.200 -1.729 -13.625
769 2HB ASP 35 2HB ASP 35 -2.803 -2.901 -12.345
770 H GLU 36 H GLU 36 -0.725 -3.337 -11.191
771 HA GLU 36 HA GLU 36 -0.585 -2.366 -8.554
772 1HB GLU 36 1HB GLU 36 1.124 -4.495 -9.877
773 2HB GLU 36 2HB GLU 36 0.982 -4.241 -8.143
774 1HG GLU 36 1HG GLU 36 -1.495 -4.843 -9.817
775 2HG GLU 36 2HG GLU 36 -0.407 -6.136 -9.297
776 H GLU 37 H GLU 37 2.038 -2.468 -11.123
777 HA GLU 37 HA GLU 37 4.081 -1.347 -9.650
778 1HB GLU 37 1HB GLU 37 3.675 -2.146 -12.261
779 2HB GLU 37 2HB GLU 37 3.842 -0.408 -12.475
780 1HG GLU 37 1HG GLU 37 5.792 -2.078 -10.842
781 2HG GLU 37 2HG GLU 37 5.818 -2.013 -12.600
782 H LYS 38 H LYS 38 1.418 0.347 -11.368
783 HA LYS 38 HA LYS 38 2.421 2.962 -10.761
784 1HB LYS 38 1HB LYS 38 0.673 2.378 -12.491
785 2HB LYS 38 2HB LYS 38 -0.463 2.108 -11.169
786 1HG LYS 38 1HG LYS 38 0.551 4.623 -10.525
787 2HG LYS 38 2HG LYS 38 0.611 4.673 -12.281
788 1HD LYS 38 1HD LYS 38 -1.782 4.268 -12.432
789 2HD LYS 38 2HD LYS 38 -1.878 3.823 -10.715
790 1HE LYS 38 1HE LYS 38 -1.249 6.097 -10.026
791 2HE LYS 38 2HE LYS 38 -1.110 6.603 -11.722
792 1HZ LYS 38 1HZ LYS 38 -3.435 6.153 -11.981
793 2HZ LYS 38 2HZ LYS 38 -3.562 5.625 -10.424
794 3HZ LYS 38 3HZ LYS 38 -3.206 7.205 -10.733
795 H HIS 39 H HIS 39 0.031 0.861 -9.031
796 HA HIS 39 HA HIS 39 -0.529 2.748 -6.951
797 1HB HIS 39 1HB HIS 39 -0.609 -0.277 -7.045
798 2HB HIS 39 2HB HIS 39 -1.033 0.626 -5.594
799 HD1 HIS 39 HD1 HIS 39 -3.152 2.398 -5.883
800 HD2 HIS 39 HD2 HIS 39 -2.536 -0.540 -8.822
801 HE1 HIS 39 HE1 HIS 39 -5.381 2.156 -7.152
802 HE2 HIS 39 HE2 HIS 39 -4.996 0.333 -8.921
803 H ILE 40 H ILE 40 2.011 0.293 -7.235
804 HA ILE 40 HA ILE 40 3.260 0.699 -4.685
805 HB ILE 40 HB ILE 40 4.312 -0.337 -7.342
806 1HG1 ILE 40 1HG1 ILE 40 3.459 -1.942 -4.917
807 2HG1 ILE 40 2HG1 ILE 40 2.283 -1.522 -6.106
808 1HG2 ILE 40 1HG2 ILE 40 6.191 0.303 -5.894
809 2HG2 ILE 40 2HG2 ILE 40 5.471 -0.575 -4.531
810 3HG2 ILE 40 3HG2 ILE 40 6.074 -1.449 -5.954
811 1HD1 ILE 40 1HD1 ILE 40 3.565 -2.600 -7.896
812 2HD1 ILE 40 2HD1 ILE 40 4.795 -3.112 -6.742
813 3HD1 ILE 40 3HD1 ILE 40 3.123 -3.713 -6.597
814 H GLU 41 H GLU 41 3.781 2.072 -7.929
815 HA GLU 41 HA GLU 41 5.993 3.698 -7.417
816 1HB GLU 41 1HB GLU 41 5.029 3.172 -9.661
817 2HB GLU 41 2HB GLU 41 3.678 4.254 -9.332
818 1HG GLU 41 1HG GLU 41 6.475 5.311 -9.080
819 2HG GLU 41 2HG GLU 41 5.787 5.016 -10.689
820 H TRP 42 H TRP 42 2.499 4.258 -6.755
821 HA TRP 42 HA TRP 42 2.624 6.925 -6.061
822 1HB TRP 42 1HB TRP 42 0.689 5.147 -6.171
823 2HB TRP 42 2HB TRP 42 1.015 4.943 -4.455
824 HD1 TRP 42 HD1 TRP 42 -0.332 7.468 -6.928
825 HE1 TRP 42 HE1 TRP 42 -1.360 9.465 -5.697
826 HE3 TRP 42 HE3 TRP 42 1.125 6.193 -2.278
827 HZ2 TRP 42 HZ2 TRP 42 -1.338 10.487 -2.888
828 HZ3 TRP 42 HZ3 TRP 42 0.576 7.632 -0.304
829 HH2 TRP 42 HH2 TRP 42 -0.521 9.840 -0.638
830 H LEU 43 H LEU 43 3.676 4.078 -4.236
831 HA LEU 43 HA LEU 43 4.234 5.534 -1.766
832 1HB LEU 43 1HB LEU 43 5.192 2.797 -2.695
833 2HB LEU 43 2HB LEU 43 5.574 3.551 -1.163
834 HG LEU 43 HG LEU 43 2.802 3.824 -1.220
835 1HD1 LEU 43 1HD1 LEU 43 2.608 2.406 -3.201
836 2HD1 LEU 43 2HD1 LEU 43 3.555 1.125 -2.430
837 3HD1 LEU 43 3HD1 LEU 43 1.953 1.551 -1.798
838 1HD2 LEU 43 1HD2 LEU 43 4.529 1.592 -0.062
839 2HD2 LEU 43 2HD2 LEU 43 4.150 3.136 0.718
840 3HD2 LEU 43 3HD2 LEU 43 2.858 1.956 0.432
841 H GLU 44 H GLU 44 5.987 5.053 -4.841
842 HA GLU 44 HA GLU 44 8.435 6.243 -3.617
843 1HB GLU 44 1HB GLU 44 7.904 5.210 -6.432
844 2HB GLU 44 2HB GLU 44 9.397 5.974 -5.870
845 1HG GLU 44 1HG GLU 44 9.545 4.240 -4.053
846 2HG GLU 44 2HG GLU 44 8.230 3.364 -4.870
847 H THR 45 H THR 45 5.754 7.681 -3.848
848 HA THR 45 HA THR 45 7.083 10.115 -4.891
849 HB THR 45 HB THR 45 5.518 8.807 -6.597
850 HG1 THR 45 HG1 THR 45 6.598 10.670 -7.080
851 1HG2 THR 45 1HG2 THR 45 3.452 8.879 -5.290
852 2HG2 THR 45 2HG2 THR 45 3.477 10.656 -5.360
853 3HG2 THR 45 3HG2 THR 45 3.334 9.687 -6.846
854 H ILE 46 H ILE 46 4.262 8.766 -3.353
855 HA ILE 46 HA ILE 46 2.974 9.404 -1.633
856 HB ILE 46 HB ILE 46 4.812 8.228 -0.671
857 1HG1 ILE 46 1HG1 ILE 46 4.700 8.765 1.611
858 2HG1 ILE 46 2HG1 ILE 46 4.231 10.439 1.321
859 1HG2 ILE 46 1HG2 ILE 46 6.768 9.477 -1.271
860 2HG2 ILE 46 2HG2 ILE 46 6.237 10.884 -0.314
861 3HG2 ILE 46 3HG2 ILE 46 6.706 9.368 0.483
862 1HD1 ILE 46 1HD1 ILE 46 2.065 9.682 0.409
863 2HD1 ILE 46 2HD1 ILE 46 2.609 7.984 0.553
864 3HD1 ILE 46 3HD1 ILE 46 2.332 8.970 2.008
865 H LEU 47 H LEU 47 3.097 11.473 -3.427
866 HA LEU 47 HA LEU 47 3.672 13.953 -2.052
867 1HB LEU 47 1HB LEU 47 4.089 13.363 -4.473
868 2HB LEU 47 2HB LEU 47 2.361 13.560 -4.767
869 HG LEU 47 HG LEU 47 3.511 15.862 -3.294
870 1HD1 LEU 47 1HD1 LEU 47 5.566 15.224 -4.478
871 2HD1 LEU 47 2HD1 LEU 47 4.692 15.217 -6.025
872 3HD1 LEU 47 3HD1 LEU 47 4.901 16.735 -5.122
873 1HD2 LEU 47 1HD2 LEU 47 2.175 15.655 -6.029
874 2HD2 LEU 47 2HD2 LEU 47 1.326 15.898 -4.487
875 3HD2 LEU 47 3HD2 LEU 47 2.437 17.140 -5.090
876 H GLY 48 H GLY 48 0.857 11.963 -2.281
877 1HA GLY 48 1HA GLY 48 -1.228 12.283 -1.318
878 2HA GLY 48 2HA GLY 48 -0.756 13.905 -0.811
879 1HN NH2 49 1HN NH2 49 -1.092 15.703 -2.246
880 2HN NH2 49 2HN NH2 49 -2.092 15.542 -3.715
Start of MODEL 9
1 1H ACE 0 H1 ACE 0 -5.885 5.134 9.528
2 2H ACE 0 H2 ACE 0 -6.521 3.768 10.474
3 3H ACE 0 H3 ACE 0 -5.843 5.188 11.307
4 H ASP 1 H ASP 1 -4.839 1.834 10.531
5 HA ASP 1 HA ASP 1 -2.289 2.063 9.925
6 1HB ASP 1 1HB ASP 1 -1.982 3.923 11.309
7 2HB ASP 1 2HB ASP 1 -2.721 3.012 12.646
8 H TYR 2 H TYR 2 -4.389 1.045 12.616
9 HA TYR 2 HA TYR 2 -3.585 -1.784 12.194
10 1HB TYR 2 1HB TYR 2 -5.418 -0.264 14.103
11 2HB TYR 2 2HB TYR 2 -5.639 -1.962 13.786
12 HD1 TYR 2 HD1 TYR 2 -3.927 0.363 15.866
13 HD2 TYR 2 HD2 TYR 2 -3.521 -3.523 14.029
14 HE1 TYR 2 HE1 TYR 2 -2.172 -0.234 17.502
15 HE2 TYR 2 HE2 TYR 2 -1.706 -4.077 15.610
16 HH TYR 2 HH TYR 2 -0.808 -1.908 18.293
17 H LEU 3 H LEU 3 -6.395 0.426 12.109
18 HA LEU 3 HA LEU 3 -8.050 -1.387 10.854
19 1HB LEU 3 1HB LEU 3 -8.365 1.631 10.657
20 2HB LEU 3 2HB LEU 3 -9.625 0.412 10.545
21 HG LEU 3 HG LEU 3 -8.398 -0.064 13.076
22 1HD1 LEU 3 1HD1 LEU 3 -7.335 2.156 12.921
23 2HD1 LEU 3 2HD1 LEU 3 -8.912 2.911 12.611
24 3HD1 LEU 3 3HD1 LEU 3 -8.580 2.147 14.179
25 1HD2 LEU 3 1HD2 LEU 3 -10.990 1.349 12.352
26 2HD2 LEU 3 2HD2 LEU 3 -10.737 -0.392 12.655
27 3HD2 LEU 3 3HD2 LEU 3 -10.555 0.770 13.975
28 H ARG 4 H ARG 4 -5.543 0.304 9.260
29 HA ARG 4 HA ARG 4 -6.570 0.509 6.628
30 1HB ARG 4 1HB ARG 4 -4.260 0.021 5.878
31 2HB ARG 4 2HB ARG 4 -4.369 1.339 7.052
32 1HG ARG 4 1HG ARG 4 -3.494 0.003 8.809
33 2HG ARG 4 2HG ARG 4 -3.641 -1.493 7.919
34 1HD ARG 4 1HD ARG 4 -1.627 -1.310 7.047
35 2HD ARG 4 2HD ARG 4 -2.017 0.268 6.332
36 HE ARG 4 HE ARG 4 -1.360 0.264 9.202
37 1HH1 ARG 4 1HH2 ARG 4 0.061 0.134 5.995
38 2HH1 ARG 4 2HH2 ARG 4 1.522 0.976 6.432
39 1HH2 ARG 4 1HH1 ARG 4 0.499 1.486 9.797
40 2HH2 ARG 4 2HH1 ARG 4 1.786 1.725 8.655
41 H GLU 5 H GLU 5 -5.609 -2.346 8.521
42 HA GLU 5 HA GLU 5 -5.824 -4.142 6.169
43 1HB GLU 5 1HB GLU 5 -5.024 -4.506 9.080
44 2HB GLU 5 2HB GLU 5 -5.295 -5.871 7.996
45 1HG GLU 5 1HG GLU 5 -3.584 -5.156 6.452
46 2HG GLU 5 2HG GLU 5 -3.390 -3.603 7.264
47 H LEU 6 H LEU 6 -8.061 -2.560 7.921
48 HA LEU 6 HA LEU 6 -9.989 -4.796 7.855
49 1HB LEU 6 1HB LEU 6 -9.689 -2.588 9.887
50 2HB LEU 6 2HB LEU 6 -11.106 -3.643 9.751
51 HG LEU 6 HG LEU 6 -8.309 -4.759 10.234
52 1HD1 LEU 6 1HD1 LEU 6 -8.873 -3.351 12.093
53 2HD1 LEU 6 2HD1 LEU 6 -10.544 -3.927 12.080
54 3HD1 LEU 6 3HD1 LEU 6 -9.243 -5.022 12.579
55 1HD2 LEU 6 1HD2 LEU 6 -10.394 -6.372 11.159
56 2HD2 LEU 6 2HD2 LEU 6 -10.904 -5.922 9.540
57 3HD2 LEU 6 3HD2 LEU 6 -9.330 -6.702 9.770
58 H LEU 7 H LEU 7 -9.345 -2.999 5.662
59 HA LEU 7 HA LEU 7 -11.995 -2.209 5.153
60 1HB LEU 7 1HB LEU 7 -11.568 0.203 4.566
61 2HB LEU 7 2HB LEU 7 -11.780 -0.201 6.256
62 HG LEU 7 HG LEU 7 -8.996 -0.288 5.966
63 1HD1 LEU 7 1HD1 LEU 7 -9.202 0.725 3.670
64 2HD1 LEU 7 2HD1 LEU 7 -10.052 2.101 4.392
65 3HD1 LEU 7 3HD1 LEU 7 -8.362 1.772 4.828
66 1HD2 LEU 7 1HD2 LEU 7 -10.749 2.080 6.761
67 2HD2 LEU 7 2HD2 LEU 7 -10.336 0.718 7.816
68 3HD2 LEU 7 3HD2 LEU 7 -9.061 1.809 7.247
69 H LYS 8 H LYS 8 -8.634 -1.522 4.066
70 HA LYS 8 HA LYS 8 -9.454 -1.322 1.422
71 1HB LYS 8 1HB LYS 8 -7.296 -0.559 2.637
72 2HB LYS 8 2HB LYS 8 -6.638 -2.155 2.258
73 1HG LYS 8 1HG LYS 8 -6.790 -1.703 -0.123
74 2HG LYS 8 2HG LYS 8 -7.818 -0.282 0.154
75 1HD LYS 8 1HD LYS 8 -6.008 0.877 1.337
76 2HD LYS 8 2HD LYS 8 -4.931 -0.517 1.121
77 1HE LYS 8 1HE LYS 8 -4.928 -0.215 -1.296
78 2HE LYS 8 2HE LYS 8 -6.207 1.013 -1.200
79 1HZ LYS 8 1HZ LYS 8 -4.725 2.429 -0.025
80 2HZ LYS 8 2HZ LYS 8 -3.523 1.300 -0.049
81 3HZ LYS 8 3HZ LYS 8 -4.045 1.983 -1.456
82 H LEU 9 H LEU 9 -8.071 -4.016 3.207
83 HA LEU 9 HA LEU 9 -8.126 -6.001 1.119
84 1HB LEU 9 1HB LEU 9 -8.355 -6.310 4.149
85 2HB LEU 9 2HB LEU 9 -8.015 -7.593 2.982
86 HG LEU 9 HG LEU 9 -6.183 -5.200 3.451
87 1HD1 LEU 9 1HD1 LEU 9 -6.350 -6.646 5.456
88 2HD1 LEU 9 2HD1 LEU 9 -5.953 -8.064 4.472
89 3HD1 LEU 9 3HD1 LEU 9 -4.759 -6.769 4.692
90 1HD2 LEU 9 1HD2 LEU 9 -5.778 -7.832 1.947
91 2HD2 LEU 9 2HD2 LEU 9 -5.885 -6.218 1.207
92 3HD2 LEU 9 3HD2 LEU 9 -4.520 -6.620 2.256
93 H GLU 10 H GLU 10 -10.433 -4.968 3.663
94 HA GLU 10 HA GLU 10 -12.427 -6.871 3.200
95 1HB GLU 10 1HB GLU 10 -12.899 -3.957 3.938
96 2HB GLU 10 2HB GLU 10 -13.919 -5.354 4.152
97 1HG GLU 10 1HG GLU 10 -11.378 -4.804 5.663
98 2HG GLU 10 2HG GLU 10 -13.017 -4.842 6.307
99 H LEU 11 H LEU 11 -11.885 -3.700 1.566
100 HA LEU 11 HA LEU 11 -14.283 -3.819 -0.020
101 1HB LEU 11 1HB LEU 11 -12.439 -1.893 0.400
102 2HB LEU 11 2HB LEU 11 -11.694 -2.577 -1.035
103 HG LEU 11 HG LEU 11 -13.002 -0.682 -1.629
104 1HD1 LEU 11 1HD1 LEU 11 -14.494 -1.477 -3.314
105 2HD1 LEU 11 2HD1 LEU 11 -13.157 -2.639 -3.210
106 3HD1 LEU 11 3HD1 LEU 11 -14.743 -3.017 -2.488
107 1HD2 LEU 11 1HD2 LEU 11 -15.466 -1.943 -0.352
108 2HD2 LEU 11 2HD2 LEU 11 -14.475 -0.654 0.357
109 3HD2 LEU 11 3HD2 LEU 11 -15.351 -0.368 -1.152
110 H GLN 12 H GLN 12 -10.971 -5.112 -0.535
111 HA GLN 12 HA GLN 12 -11.299 -6.038 -3.130
112 1HB GLN 12 1HB GLN 12 -9.244 -6.142 -1.380
113 2HB GLN 12 2HB GLN 12 -9.861 -7.791 -1.162
114 1HG GLN 12 1HG GLN 12 -9.855 -7.888 -3.765
115 2HG GLN 12 2HG GLN 12 -8.832 -6.451 -3.681
116 1HE2 GLN 12 2HE2 GLN 12 -9.050 -9.938 -2.912
117 2HE2 GLN 12 1HE2 GLN 12 -7.329 -10.133 -2.645
118 H LEU 13 H LEU 13 -12.826 -7.258 -0.210
119 HA LEU 13 HA LEU 13 -13.429 -9.922 -1.133
120 1HB LEU 13 1HB LEU 13 -14.858 -8.306 0.990
121 2HB LEU 13 2HB LEU 13 -14.985 -10.022 0.679
122 HG LEU 13 HG LEU 13 -12.482 -8.591 1.656
123 1HD1 LEU 13 1HD1 LEU 13 -14.430 -8.606 3.174
124 2HD1 LEU 13 2HD1 LEU 13 -14.577 -10.356 3.013
125 3HD1 LEU 13 3HD1 LEU 13 -13.169 -9.631 3.812
126 1HD2 LEU 13 1HD2 LEU 13 -13.095 -11.474 0.923
127 2HD2 LEU 13 2HD2 LEU 13 -11.748 -10.456 0.386
128 3HD2 LEU 13 3HD2 LEU 13 -11.788 -11.071 2.036
129 H ILE 14 H ILE 14 -15.414 -6.967 -0.579
130 HA ILE 14 HA ILE 14 -17.727 -7.974 -1.974
131 HB ILE 14 HB ILE 14 -16.705 -5.185 -1.160
132 1HG1 ILE 14 1HG1 ILE 14 -19.008 -5.413 0.096
133 2HG1 ILE 14 2HG1 ILE 14 -18.916 -7.118 -0.278
134 1HG2 ILE 14 1HG2 ILE 14 -17.979 -4.791 -3.239
135 2HG2 ILE 14 2HG2 ILE 14 -19.308 -5.810 -2.642
136 3HG2 ILE 14 3HG2 ILE 14 -18.924 -4.272 -1.848
137 1HD1 ILE 14 1HD1 ILE 14 -16.863 -7.317 1.041
138 2HD1 ILE 14 2HD1 ILE 14 -16.771 -5.542 1.218
139 3HD1 ILE 14 3HD1 ILE 14 -18.081 -6.464 1.979
140 H LYS 15 H LYS 15 -14.839 -6.301 -2.993
141 HA LYS 15 HA LYS 15 -15.739 -5.960 -5.710
142 1HB LYS 15 1HB LYS 15 -13.548 -5.060 -4.428
143 2HB LYS 15 2HB LYS 15 -12.810 -6.461 -5.197
144 1HG LYS 15 1HG LYS 15 -12.490 -4.490 -6.538
145 2HG LYS 15 2HG LYS 15 -13.592 -5.558 -7.425
146 1HD LYS 15 1HD LYS 15 -15.480 -4.166 -6.970
147 2HD LYS 15 2HD LYS 15 -14.688 -3.391 -5.583
148 1HE LYS 15 1HE LYS 15 -13.149 -2.202 -7.084
149 2HE LYS 15 2HE LYS 15 -13.863 -3.008 -8.497
150 1HZ LYS 15 1HZ LYS 15 -15.931 -1.944 -7.983
151 2HZ LYS 15 2HZ LYS 15 -15.293 -1.232 -6.643
152 3HZ LYS 15 3HZ LYS 15 -14.744 -0.812 -8.137
153 H GLN 16 H GLN 16 -13.759 -8.601 -4.258
154 HA GLN 16 HA GLN 16 -13.629 -9.993 -6.799
155 1HB GLN 16 1HB GLN 16 -12.549 -11.800 -5.661
156 2HB GLN 16 2HB GLN 16 -11.900 -10.259 -5.066
157 1HG GLN 16 1HG GLN 16 -13.455 -10.446 -3.144
158 2HG GLN 16 2HG GLN 16 -13.961 -12.028 -3.662
159 1HE2 GLN 16 2HE2 GLN 16 -13.165 -12.386 -1.307
160 2HE2 GLN 16 1HE2 GLN 16 -11.467 -12.785 -1.133
161 H TYR 17 H TYR 17 -15.897 -10.020 -4.120
162 HA TYR 17 HA TYR 17 -17.358 -12.393 -4.763
163 1HB TYR 17 1HB TYR 17 -17.909 -9.800 -3.302
164 2HB TYR 17 2HB TYR 17 -19.240 -10.818 -3.728
165 HD1 TYR 17 HD1 TYR 17 -18.926 -13.439 -3.137
166 HD2 TYR 17 HD2 TYR 17 -17.417 -10.043 -0.972
167 HE1 TYR 17 HE1 TYR 17 -18.614 -14.847 -1.113
168 HE2 TYR 17 HE2 TYR 17 -17.034 -11.458 1.006
169 HH TYR 17 HH TYR 17 -16.777 -13.707 1.678
170 H ARG 18 H ARG 18 -17.260 -9.204 -6.229
171 HA ARG 18 HA ARG 18 -19.816 -9.715 -7.635
172 1HB ARG 18 1HB ARG 18 -17.903 -7.345 -7.601
173 2HB ARG 18 2HB ARG 18 -19.099 -7.571 -8.888
174 1HG ARG 18 1HG ARG 18 -20.871 -7.837 -7.112
175 2HG ARG 18 2HG ARG 18 -19.684 -7.284 -5.915
176 1HD ARG 18 1HD ARG 18 -19.693 -5.100 -6.758
177 2HD ARG 18 2HD ARG 18 -20.154 -5.629 -8.394
178 HE ARG 18 HE ARG 18 -22.236 -6.195 -6.492
179 1HH1 ARG 18 1HH2 ARG 18 -20.797 -3.549 -8.304
180 2HH1 ARG 18 2HH2 ARG 18 -22.302 -2.727 -8.615
181 1HH2 ARG 18 1HH1 ARG 18 -24.229 -5.178 -6.897
182 2HH2 ARG 18 2HH1 ARG 18 -24.308 -3.676 -7.775
183 H GLU 19 H GLU 19 -16.381 -9.813 -8.207
184 HA GLU 19 HA GLU 19 -16.592 -10.524 -10.982
185 1HB GLU 19 1HB GLU 19 -14.446 -9.901 -9.634
186 2HB GLU 19 2HB GLU 19 -14.435 -11.613 -9.175
187 1HG GLU 19 1HG GLU 19 -14.606 -12.136 -11.691
188 2HG GLU 19 2HG GLU 19 -14.309 -10.415 -11.973
189 H ALA 20 H ALA 20 -16.413 -12.539 -7.951
190 HA ALA 20 HA ALA 20 -16.477 -14.927 -9.596
191 1HB ALA 20 1HB ALA 20 -15.458 -14.508 -7.246
192 2HB ALA 20 2HB ALA 20 -17.054 -15.030 -6.660
193 3HB ALA 20 3HB ALA 20 -16.059 -16.112 -7.644
194 H LEU 21 H LEU 21 -18.981 -13.005 -7.982
195 HA LEU 21 HA LEU 21 -21.200 -14.578 -7.913
196 1HB LEU 21 1HB LEU 21 -21.271 -12.252 -7.324
197 2HB LEU 21 2HB LEU 21 -20.837 -11.765 -8.965
198 HG LEU 21 HG LEU 21 -23.041 -12.543 -9.796
199 1HD1 LEU 21 1HD1 LEU 21 -23.548 -14.293 -8.127
200 2HD1 LEU 21 2HD1 LEU 21 -23.570 -13.071 -6.842
201 3HD1 LEU 21 3HD1 LEU 21 -24.813 -13.057 -8.113
202 1HD2 LEU 21 1HD2 LEU 21 -23.093 -10.582 -7.467
203 2HD2 LEU 21 2HD2 LEU 21 -22.671 -10.215 -9.150
204 3HD2 LEU 21 3HD2 LEU 21 -24.323 -10.714 -8.748
205 H GLU 22 H GLU 22 -19.868 -13.111 -10.928
206 HA GLU 22 HA GLU 22 -22.080 -14.135 -12.502
207 1HB GLU 22 1HB GLU 22 -19.441 -12.873 -13.367
208 2HB GLU 22 2HB GLU 22 -20.776 -13.336 -14.433
209 1HG GLU 22 1HG GLU 22 -22.291 -11.849 -12.958
210 2HG GLU 22 2HG GLU 22 -20.794 -11.197 -12.265
211 H TYR 23 H TYR 23 -18.685 -15.135 -11.913
212 HA TYR 23 HA TYR 23 -18.717 -17.291 -13.798
213 1HB TYR 23 1HB TYR 23 -17.097 -16.541 -11.334
214 2HB TYR 23 2HB TYR 23 -16.855 -18.064 -12.134
215 HD1 TYR 23 HD1 TYR 23 -15.637 -14.779 -12.025
216 HD2 TYR 23 HD2 TYR 23 -16.653 -17.897 -14.832
217 HE1 TYR 23 HE1 TYR 23 -14.111 -13.780 -13.703
218 HE2 TYR 23 HE2 TYR 23 -15.163 -16.869 -16.511
219 HH TYR 23 HH TYR 23 -13.682 -15.176 -16.963
220 H VAL 24 H VAL 24 -19.871 -16.933 -10.490
221 HA VAL 24 HA VAL 24 -20.301 -19.821 -10.162
222 HB VAL 24 HB VAL 24 -20.829 -17.398 -8.429
223 1HG1 VAL 24 1HG1 VAL 24 -22.468 -19.086 -7.774
224 2HG1 VAL 24 2HG1 VAL 24 -21.226 -20.356 -7.784
225 3HG1 VAL 24 3HG1 VAL 24 -21.171 -19.063 -6.571
226 1HG2 VAL 24 1HG2 VAL 24 -18.826 -19.698 -8.143
227 2HG2 VAL 24 2HG2 VAL 24 -18.401 -18.112 -8.791
228 3HG2 VAL 24 3HG2 VAL 24 -18.937 -18.260 -7.112
229 H LYS 25 H LYS 25 -22.268 -16.975 -10.963
230 HA LYS 25 HA LYS 25 -24.466 -16.701 -11.450
231 1HB LYS 25 1HB LYS 25 -23.998 -19.485 -12.557
232 2HB LYS 25 2HB LYS 25 -25.581 -18.732 -12.648
233 1HG LYS 25 1HG LYS 25 -23.488 -16.891 -13.561
234 2HG LYS 25 2HG LYS 25 -23.491 -18.411 -14.456
235 1HD LYS 25 1HD LYS 25 -25.977 -18.134 -14.839
236 2HD LYS 25 2HD LYS 25 -25.912 -16.597 -13.960
237 1HE LYS 25 1HE LYS 25 -25.899 -16.168 -16.356
238 2HE LYS 25 2HE LYS 25 -24.328 -15.702 -15.677
239 1HZ LYS 25 1HZ LYS 25 -23.436 -17.759 -16.468
240 2HZ LYS 25 2HZ LYS 25 -24.903 -18.242 -17.044
241 3HZ LYS 25 3HZ LYS 25 -24.136 -16.948 -17.718
242 H LEU 26 H LEU 26 -24.385 -16.763 -8.908
243 HA LEU 26 HA LEU 26 -26.841 -18.269 -8.222
244 1HB LEU 26 1HB LEU 26 -24.892 -19.656 -7.494
245 2HB LEU 26 2HB LEU 26 -24.338 -18.291 -6.518
246 HG LEU 26 HG LEU 26 -26.587 -18.430 -5.281
247 1HD1 LEU 26 1HD1 LEU 26 -27.830 -19.860 -6.919
248 2HD1 LEU 26 2HD1 LEU 26 -26.675 -21.169 -6.620
249 3HD1 LEU 26 3HD1 LEU 26 -27.737 -20.600 -5.316
250 1HD2 LEU 26 1HD2 LEU 26 -24.724 -20.843 -5.152
251 2HD2 LEU 26 2HD2 LEU 26 -24.400 -19.276 -4.392
252 3HD2 LEU 26 3HD2 LEU 26 -25.780 -20.254 -3.851
253 HA PRO 27 HA PRO 27 -27.277 -14.046 -6.566
254 1HB PRO 27 1HB PRO 27 -29.948 -13.993 -6.084
255 2HB PRO 27 2HB PRO 27 -29.294 -14.042 -7.739
256 1HG PRO 27 1HG PRO 27 -30.253 -16.391 -6.078
257 2HG PRO 27 2HG PRO 27 -30.759 -15.956 -7.736
258 1HD PRO 27 1HD PRO 27 -28.806 -17.787 -7.238
259 2HD PRO 27 2HD PRO 27 -28.694 -16.693 -8.647
260 H VAL 28 H VAL 28 -26.133 -16.090 -4.942
261 HA VAL 28 HA VAL 28 -27.254 -15.477 -2.251
262 HB VAL 28 HB VAL 28 -25.738 -17.841 -3.245
263 1HG1 VAL 28 1HG1 VAL 28 -24.524 -17.271 -1.290
264 2HG1 VAL 28 2HG1 VAL 28 -26.008 -16.882 -0.385
265 3HG1 VAL 28 3HG1 VAL 28 -25.631 -18.560 -0.818
266 1HG2 VAL 28 1HG2 VAL 28 -28.261 -17.599 -1.549
267 2HG2 VAL 28 2HG2 VAL 28 -28.249 -17.932 -3.294
268 3HG2 VAL 28 3HG2 VAL 28 -27.555 -19.108 -2.163
269 H LEU 29 H LEU 29 -24.337 -15.740 -4.399
270 HA LEU 29 HA LEU 29 -22.500 -14.651 -2.541
271 1HB LEU 29 1HB LEU 29 -22.662 -15.022 -5.549
272 2HB LEU 29 2HB LEU 29 -21.533 -13.859 -4.884
273 HG LEU 29 HG LEU 29 -20.656 -15.655 -3.334
274 1HD1 LEU 29 1HD1 LEU 29 -22.487 -17.260 -3.417
275 2HD1 LEU 29 2HD1 LEU 29 -22.298 -17.437 -5.176
276 3HD1 LEU 29 3HD1 LEU 29 -21.028 -18.011 -4.074
277 1HD2 LEU 29 1HD2 LEU 29 -20.340 -16.137 -6.323
278 2HD2 LEU 29 2HD2 LEU 29 -19.462 -14.919 -5.372
279 3HD2 LEU 29 3HD2 LEU 29 -19.213 -16.642 -5.047
280 H ALA 30 H ALA 30 -24.682 -13.196 -5.004
281 HA ALA 30 HA ALA 30 -23.823 -10.568 -4.506
282 1HB ALA 30 1HB ALA 30 -25.230 -11.174 -6.460
283 2HB ALA 30 2HB ALA 30 -26.606 -11.481 -5.375
284 3HB ALA 30 3HB ALA 30 -25.947 -9.840 -5.540
285 H LYS 31 H LYS 31 -25.854 -12.662 -2.565
286 HA LYS 31 HA LYS 31 -26.996 -10.388 -1.069
287 1HB LYS 31 1HB LYS 31 -27.917 -12.977 -1.556
288 2HB LYS 31 2HB LYS 31 -27.308 -13.082 0.103
289 1HG LYS 31 1HG LYS 31 -28.645 -10.961 0.605
290 2HG LYS 31 2HG LYS 31 -29.317 -11.100 -1.033
291 1HD LYS 31 1HD LYS 31 -30.044 -13.502 -0.346
292 2HD LYS 31 2HD LYS 31 -29.581 -13.049 1.303
293 1HE LYS 31 1HE LYS 31 -31.945 -12.662 1.131
294 2HE LYS 31 2HE LYS 31 -31.179 -11.066 1.113
295 1HZ LYS 31 1HZ LYS 31 -31.394 -11.092 -1.289
296 2HZ LYS 31 2HZ LYS 31 -32.108 -12.573 -1.237
297 3HZ LYS 31 3HZ LYS 31 -32.862 -11.272 -0.566
298 H ILE 32 H ILE 32 -24.554 -12.875 -0.853
299 HA ILE 32 HA ILE 32 -23.910 -12.520 1.974
300 HB ILE 32 HB ILE 32 -22.406 -13.766 -0.364
301 1HG1 ILE 32 1HG1 ILE 32 -23.566 -14.995 2.183
302 2HG1 ILE 32 2HG1 ILE 32 -24.420 -14.927 0.646
303 1HG2 ILE 32 1HG2 ILE 32 -20.647 -12.896 1.007
304 2HG2 ILE 32 2HG2 ILE 32 -21.481 -13.355 2.496
305 3HG2 ILE 32 3HG2 ILE 32 -20.770 -14.589 1.441
306 1HD1 ILE 32 1HD1 ILE 32 -22.546 -16.231 -0.416
307 2HD1 ILE 32 2HD1 ILE 32 -21.848 -16.464 1.202
308 3HD1 ILE 32 3HD1 ILE 32 -23.446 -17.105 0.844
309 H LEU 33 H LEU 33 -22.715 -11.202 -1.165
310 HA LEU 33 HA LEU 33 -20.486 -9.922 0.007
311 1HB LEU 33 1HB LEU 33 -20.060 -9.190 -2.133
312 2HB LEU 33 2HB LEU 33 -20.974 -10.690 -2.348
313 HG LEU 33 HG LEU 33 -22.948 -9.378 -2.901
314 1HD1 LEU 33 1HD1 LEU 33 -22.912 -7.201 -2.282
315 2HD1 LEU 33 2HD1 LEU 33 -21.130 -7.153 -2.205
316 3HD1 LEU 33 3HD1 LEU 33 -21.972 -6.965 -3.763
317 1HD2 LEU 33 1HD2 LEU 33 -20.346 -8.914 -4.429
318 2HD2 LEU 33 2HD2 LEU 33 -21.349 -10.373 -4.533
319 3HD2 LEU 33 3HD2 LEU 33 -21.969 -8.833 -5.155
320 H GLU 34 H GLU 34 -23.846 -9.014 -0.537
321 HA GLU 34 HA GLU 34 -23.685 -6.266 0.084
322 1HB GLU 34 1HB GLU 34 -25.613 -7.708 -0.962
323 2HB GLU 34 2HB GLU 34 -26.079 -8.075 0.679
324 1HG GLU 34 1HG GLU 34 -25.777 -5.233 -0.420
325 2HG GLU 34 2HG GLU 34 -27.305 -6.119 -0.347
326 H ASP 35 H ASP 35 -24.571 -9.060 2.126
327 HA ASP 35 HA ASP 35 -24.916 -7.581 4.501
328 1HB ASP 35 1HB ASP 35 -25.484 -10.029 4.164
329 2HB ASP 35 2HB ASP 35 -23.770 -10.403 4.430
330 H GLU 36 H GLU 36 -21.960 -9.270 3.355
331 HA GLU 36 HA GLU 36 -20.187 -8.476 5.371
332 1HB GLU 36 1HB GLU 36 -19.640 -8.806 2.398
333 2HB GLU 36 2HB GLU 36 -18.406 -8.761 3.662
334 1HG GLU 36 1HG GLU 36 -20.599 -10.880 3.697
335 2HG GLU 36 2HG GLU 36 -19.104 -11.069 2.780
336 H GLU 37 H GLU 37 -21.147 -6.616 2.392
337 HA GLU 37 HA GLU 37 -19.437 -4.538 2.645
338 1HB GLU 37 1HB GLU 37 -21.440 -5.240 0.958
339 2HB GLU 37 2HB GLU 37 -22.347 -4.034 1.852
340 1HG GLU 37 1HG GLU 37 -19.566 -3.453 0.817
341 2HG GLU 37 2HG GLU 37 -20.934 -3.549 -0.288
342 H LYS 38 H LYS 38 -22.574 -4.942 4.354
343 HA LYS 38 HA LYS 38 -22.431 -2.374 5.678
344 1HB LYS 38 1HB LYS 38 -24.477 -3.670 5.326
345 2HB LYS 38 2HB LYS 38 -23.893 -4.945 6.389
346 1HG LYS 38 1HG LYS 38 -24.385 -3.825 8.295
347 2HG LYS 38 2HG LYS 38 -23.805 -2.272 7.698
348 1HD LYS 38 1HD LYS 38 -26.425 -3.483 6.736
349 2HD LYS 38 2HD LYS 38 -26.348 -2.492 8.198
350 1HE LYS 38 1HE LYS 38 -25.297 -1.506 5.497
351 2HE LYS 38 2HE LYS 38 -26.960 -1.249 6.039
352 1HZ LYS 38 1HZ LYS 38 -26.126 -0.071 7.925
353 2HZ LYS 38 2HZ LYS 38 -24.563 -0.325 7.468
354 3HZ LYS 38 3HZ LYS 38 -25.544 0.600 6.539
355 H HIS 39 H HIS 39 -21.459 -5.658 6.651
356 HA HIS 39 HA HIS 39 -20.546 -5.098 9.277
357 1HB HIS 39 1HB HIS 39 -19.796 -7.087 7.123
358 2HB HIS 39 2HB HIS 39 -18.863 -7.060 8.546
359 HD1 HIS 39 HD1 HIS 39 -20.514 -7.597 10.910
360 HD2 HIS 39 HD2 HIS 39 -22.045 -8.302 7.063
361 HE1 HIS 39 HE1 HIS 39 -22.669 -9.067 11.114
362 HE2 HIS 39 HE2 HIS 39 -23.562 -9.407 8.826
363 H ILE 40 H ILE 40 -18.935 -4.670 6.166
364 HA ILE 40 HA ILE 40 -16.403 -3.771 7.320
365 HB ILE 40 HB ILE 40 -17.546 -4.194 4.559
366 1HG1 ILE 40 1HG1 ILE 40 -15.105 -5.443 5.873
367 2HG1 ILE 40 2HG1 ILE 40 -16.673 -6.018 6.319
368 1HG2 ILE 40 1HG2 ILE 40 -16.060 -2.248 4.335
369 2HG2 ILE 40 2HG2 ILE 40 -14.777 -3.109 5.209
370 3HG2 ILE 40 3HG2 ILE 40 -15.337 -3.673 3.611
371 1HD1 ILE 40 1HD1 ILE 40 -17.271 -6.696 4.118
372 2HD1 ILE 40 2HD1 ILE 40 -15.813 -6.007 3.406
373 3HD1 ILE 40 3HD1 ILE 40 -15.703 -7.383 4.532
374 H GLU 41 H GLU 41 -19.298 -2.344 5.929
375 HA GLU 41 HA GLU 41 -18.507 0.270 5.426
376 1HB GLU 41 1HB GLU 41 -20.810 -0.764 5.001
377 2HB GLU 41 2HB GLU 41 -21.135 -0.538 6.737
378 1HG GLU 41 1HG GLU 41 -20.555 1.945 6.306
379 2HG GLU 41 2HG GLU 41 -20.690 1.530 4.588
380 H TRP 42 H TRP 42 -19.418 -1.352 8.496
381 HA TRP 42 HA TRP 42 -19.501 0.699 10.276
382 1HB TRP 42 1HB TRP 42 -19.662 -1.856 10.584
383 2HB TRP 42 2HB TRP 42 -17.913 -1.843 10.789
384 HD1 TRP 42 HD1 TRP 42 -21.126 -0.818 12.422
385 HE1 TRP 42 HE1 TRP 42 -20.718 0.222 14.763
386 HE3 TRP 42 HE3 TRP 42 -16.106 -0.643 12.264
387 HZ2 TRP 42 HZ2 TRP 42 -18.424 1.255 16.233
388 HZ3 TRP 42 HZ3 TRP 42 -14.772 0.435 14.094
389 HH2 TRP 42 HH2 TRP 42 -15.948 1.477 16.019
390 H LEU 43 H LEU 43 -16.577 -0.757 8.913
391 HA LEU 43 HA LEU 43 -14.682 0.867 10.478
392 1HB LEU 43 1HB LEU 43 -14.445 -1.074 8.113
393 2HB LEU 43 2HB LEU 43 -13.082 -0.197 8.763
394 HG LEU 43 HG LEU 43 -14.673 -1.550 10.867
395 1HD1 LEU 43 1HD1 LEU 43 -15.143 -3.188 9.208
396 2HD1 LEU 43 2HD1 LEU 43 -13.454 -3.308 8.714
397 3HD1 LEU 43 3HD1 LEU 43 -13.947 -3.844 10.322
398 1HD2 LEU 43 1HD2 LEU 43 -11.744 -1.487 10.081
399 2HD2 LEU 43 2HD2 LEU 43 -12.566 -0.470 11.262
400 3HD2 LEU 43 3HD2 LEU 43 -12.384 -2.205 11.572
401 H GLU 44 H GLU 44 -15.873 0.646 7.151
402 HA GLU 44 HA GLU 44 -14.434 3.068 6.320
403 1HB GLU 44 1HB GLU 44 -16.508 1.417 4.823
404 2HB GLU 44 2HB GLU 44 -15.493 2.695 4.147
405 1HG GLU 44 1HG GLU 44 -13.467 1.387 4.880
406 2HG GLU 44 2HG GLU 44 -14.535 0.023 5.269
407 H THR 45 H THR 45 -16.416 3.394 8.506
408 HA THR 45 HA THR 45 -17.642 5.809 7.410
409 HB THR 45 HB THR 45 -19.173 3.763 7.067
410 HG1 THR 45 HG1 THR 45 -19.858 6.281 8.087
411 1HG2 THR 45 1HG2 THR 45 -19.116 2.865 9.385
412 2HG2 THR 45 2HG2 THR 45 -20.061 4.263 9.902
413 3HG2 THR 45 3HG2 THR 45 -20.720 3.128 8.711
414 H ILE 46 H ILE 46 -17.374 3.575 10.095
415 HA ILE 46 HA ILE 46 -17.173 3.824 12.313
416 HB ILE 46 HB ILE 46 -14.944 3.985 11.453
417 1HG1 ILE 46 1HG1 ILE 46 -13.736 4.993 13.284
418 2HG1 ILE 46 2HG1 ILE 46 -15.171 5.849 13.850
419 1HG2 ILE 46 1HG2 ILE 46 -14.949 5.923 10.036
420 2HG2 ILE 46 2HG2 ILE 46 -15.271 7.006 11.412
421 3HG2 ILE 46 3HG2 ILE 46 -13.725 6.153 11.274
422 1HD1 ILE 46 1HD1 ILE 46 -16.272 3.687 14.329
423 2HD1 ILE 46 2HD1 ILE 46 -14.891 2.833 13.592
424 3HD1 ILE 46 3HD1 ILE 46 -14.681 3.742 15.105
425 H LEU 47 H LEU 47 -19.412 4.968 11.690
426 HA LEU 47 HA LEU 47 -19.492 7.770 12.460
427 1HB LEU 47 1HB LEU 47 -20.955 6.173 10.715
428 2HB LEU 47 2HB LEU 47 -22.108 6.460 12.009
429 HG LEU 47 HG LEU 47 -20.513 8.605 10.537
430 1HD1 LEU 47 1HD1 LEU 47 -22.109 7.444 9.061
431 2HD1 LEU 47 2HD1 LEU 47 -23.420 7.744 10.223
432 3HD1 LEU 47 3HD1 LEU 47 -22.633 9.105 9.391
433 1HD2 LEU 47 1HD2 LEU 47 -22.877 8.846 12.464
434 2HD2 LEU 47 2HD2 LEU 47 -21.205 9.325 12.821
435 3HD2 LEU 47 3HD2 LEU 47 -22.117 10.181 11.573
436 H GLY 48 H GLY 48 -18.983 7.845 14.646
437 1HA GLY 48 1HA GLY 48 -21.183 6.930 16.486
438 2HA GLY 48 2HA GLY 48 -19.475 6.739 16.905
439 1HN NH2 49 1HN NH2 49 -20.836 9.515 15.086
440 2HN NH2 49 2HN NH2 49 -20.579 10.718 16.378
441 1H ACE 0 H1 ACE 0 -11.123 -24.605 -7.295
442 2H ACE 0 H2 ACE 0 -11.495 -24.046 -8.940
443 3H ACE 0 H3 ACE 0 -9.822 -24.461 -8.495
444 H ASP 1 H ASP 1 -9.956 -22.077 -9.598
445 HA ASP 1 HA ASP 1 -8.669 -20.303 -8.129
446 1HB ASP 1 1HB ASP 1 -10.522 -20.135 -10.497
447 2HB ASP 1 2HB ASP 1 -10.034 -18.647 -9.727
448 H TYR 2 H TYR 2 -12.198 -19.888 -8.644
449 HA TYR 2 HA TYR 2 -12.610 -17.806 -6.860
450 1HB TYR 2 1HB TYR 2 -14.529 -20.112 -7.407
451 2HB TYR 2 2HB TYR 2 -14.921 -18.436 -7.075
452 HD1 TYR 2 HD1 TYR 2 -15.103 -20.717 -9.604
453 HD2 TYR 2 HD2 TYR 2 -13.435 -16.793 -8.901
454 HE1 TYR 2 HE1 TYR 2 -14.828 -20.394 -12.032
455 HE2 TYR 2 HE2 TYR 2 -13.150 -16.490 -11.339
456 HH TYR 2 HH TYR 2 -14.016 -19.022 -13.704
457 H LEU 3 H LEU 3 -12.666 -21.294 -6.056
458 HA LEU 3 HA LEU 3 -13.517 -20.764 -3.363
459 1HB LEU 3 1HB LEU 3 -12.142 -23.184 -4.594
460 2HB LEU 3 2HB LEU 3 -12.824 -23.156 -2.968
461 HG LEU 3 HG LEU 3 -14.550 -22.520 -5.404
462 1HD1 LEU 3 1HD1 LEU 3 -13.533 -24.705 -5.827
463 2HD1 LEU 3 2HD1 LEU 3 -14.018 -25.265 -4.210
464 3HD1 LEU 3 3HD1 LEU 3 -15.252 -24.874 -5.428
465 1HD2 LEU 3 1HD2 LEU 3 -15.213 -23.629 -2.636
466 2HD2 LEU 3 2HD2 LEU 3 -15.477 -21.953 -3.158
467 3HD2 LEU 3 3HD2 LEU 3 -16.372 -23.270 -3.928
468 H ARG 4 H ARG 4 -10.328 -21.242 -4.903
469 HA ARG 4 HA ARG 4 -8.968 -20.817 -2.326
470 1HB ARG 4 1HB ARG 4 -6.923 -21.086 -3.477
471 2HB ARG 4 2HB ARG 4 -8.023 -22.370 -3.994
472 1HG ARG 4 1HG ARG 4 -8.463 -21.195 -6.092
473 2HG ARG 4 2HG ARG 4 -7.505 -19.798 -5.578
474 1HD ARG 4 1HD ARG 4 -6.108 -20.996 -7.020
475 2HD ARG 4 2HD ARG 4 -5.517 -21.347 -5.382
476 HE ARG 4 HE ARG 4 -7.473 -23.289 -6.261
477 1HH1 ARG 4 1HH2 ARG 4 -4.109 -22.335 -6.637
478 2HH1 ARG 4 2HH2 ARG 4 -3.564 -23.872 -7.253
479 1HH2 ARG 4 1HH1 ARG 4 -6.826 -25.300 -7.122
480 2HH2 ARG 4 2HH1 ARG 4 -5.163 -25.607 -7.548
481 H GLU 5 H GLU 5 -10.736 -18.682 -3.856
482 HA GLU 5 HA GLU 5 -8.795 -16.416 -3.428
483 1HB GLU 5 1HB GLU 5 -10.961 -16.877 -5.474
484 2HB GLU 5 2HB GLU 5 -10.464 -15.230 -5.045
485 1HG GLU 5 1HG GLU 5 -8.309 -15.517 -5.937
486 2HG GLU 5 2HG GLU 5 -8.374 -17.280 -5.806
487 H LEU 6 H LEU 6 -12.302 -17.045 -3.659
488 HA LEU 6 HA LEU 6 -12.906 -14.862 -1.904
489 1HB LEU 6 1HB LEU 6 -14.623 -17.048 -3.145
490 2HB LEU 6 2HB LEU 6 -15.234 -15.747 -2.116
491 HG LEU 6 HG LEU 6 -14.101 -14.112 -3.815
492 1HD1 LEU 6 1HD1 LEU 6 -12.919 -15.975 -5.120
493 2HD1 LEU 6 2HD1 LEU 6 -14.521 -16.443 -5.702
494 3HD1 LEU 6 3HD1 LEU 6 -13.826 -14.825 -6.029
495 1HD2 LEU 6 1HD2 LEU 6 -16.579 -15.679 -4.507
496 2HD2 LEU 6 2HD2 LEU 6 -16.459 -14.328 -3.357
497 3HD2 LEU 6 3HD2 LEU 6 -16.085 -14.044 -5.054
498 H LEU 7 H LEU 7 -11.683 -17.806 -1.019
499 HA LEU 7 HA LEU 7 -12.897 -17.578 1.612
500 1HB LEU 7 1HB LEU 7 -13.738 -19.590 1.424
501 2HB LEU 7 2HB LEU 7 -13.043 -19.801 -0.168
502 HG LEU 7 HG LEU 7 -10.953 -20.731 0.934
503 1HD1 LEU 7 1HD1 LEU 7 -12.738 -20.447 3.402
504 2HD1 LEU 7 2HD1 LEU 7 -11.432 -21.642 3.303
505 3HD1 LEU 7 3HD1 LEU 7 -11.054 -19.925 3.228
506 1HD2 LEU 7 1HD2 LEU 7 -13.646 -22.046 1.394
507 2HD2 LEU 7 2HD2 LEU 7 -12.672 -22.112 -0.083
508 3HD2 LEU 7 3HD2 LEU 7 -12.074 -22.888 1.389
509 H LYS 8 H LYS 8 -10.031 -18.814 -0.171
510 HA LYS 8 HA LYS 8 -8.364 -18.852 2.037
511 1HB LYS 8 1HB LYS 8 -7.757 -19.965 0.041
512 2HB LYS 8 2HB LYS 8 -7.791 -18.467 -0.896
513 1HG LYS 8 1HG LYS 8 -5.892 -18.530 1.416
514 2HG LYS 8 2HG LYS 8 -5.512 -19.606 0.062
515 1HD LYS 8 1HD LYS 8 -5.287 -17.877 -1.499
516 2HD LYS 8 2HD LYS 8 -6.240 -16.735 -0.568
517 1HE LYS 8 1HE LYS 8 -3.862 -16.134 -0.520
518 2HE LYS 8 2HE LYS 8 -4.507 -16.450 1.097
519 1HZ LYS 8 1HZ LYS 8 -3.526 -18.624 1.002
520 2HZ LYS 8 2HZ LYS 8 -2.934 -18.343 -0.513
521 3HZ LYS 8 3HZ LYS 8 -2.380 -17.466 0.769
522 H LEU 9 H LEU 9 -9.118 -16.136 -0.170
523 HA LEU 9 HA LEU 9 -7.218 -14.346 1.127
524 1HB LEU 9 1HB LEU 9 -9.486 -13.709 -0.806
525 2HB LEU 9 2HB LEU 9 -8.242 -12.591 -0.293
526 HG LEU 9 HG LEU 9 -7.562 -15.167 -1.770
527 1HD1 LEU 9 1HD1 LEU 9 -9.026 -13.830 -3.198
528 2HD1 LEU 9 2HD1 LEU 9 -8.041 -12.385 -2.904
529 3HD1 LEU 9 3HD1 LEU 9 -7.362 -13.765 -3.794
530 1HD2 LEU 9 1HD2 LEU 9 -6.033 -12.561 -1.304
531 2HD2 LEU 9 2HD2 LEU 9 -5.681 -14.116 -0.522
532 3HD2 LEU 9 3HD2 LEU 9 -5.461 -13.936 -2.268
533 H GLU 10 H GLU 10 -10.279 -15.565 2.065
534 HA GLU 10 HA GLU 10 -11.017 -13.162 3.609
535 1HB GLU 10 1HB GLU 10 -12.127 -16.000 3.619
536 2HB GLU 10 2HB GLU 10 -12.672 -14.630 4.531
537 1HG GLU 10 1HG GLU 10 -12.633 -14.460 1.477
538 2HG GLU 10 2HG GLU 10 -13.888 -15.374 2.304
539 H LEU 11 H LEU 11 -9.693 -16.450 3.945
540 HA LEU 11 HA LEU 11 -9.748 -16.636 6.778
541 1HB LEU 11 1HB LEU 11 -9.248 -18.327 4.798
542 2HB LEU 11 2HB LEU 11 -7.559 -17.912 5.058
543 HG LEU 11 HG LEU 11 -9.420 -18.914 7.270
544 1HD1 LEU 11 1HD1 LEU 11 -9.447 -20.545 5.432
545 2HD1 LEU 11 2HD1 LEU 11 -7.671 -20.557 5.390
546 3HD1 LEU 11 3HD1 LEU 11 -8.542 -21.179 6.810
547 1HD2 LEU 11 1HD2 LEU 11 -6.376 -18.956 6.956
548 2HD2 LEU 11 2HD2 LEU 11 -7.301 -17.963 8.104
549 3HD2 LEU 11 3HD2 LEU 11 -7.287 -19.722 8.274
550 H GLN 12 H GLN 12 -7.146 -15.325 4.716
551 HA GLN 12 HA GLN 12 -5.368 -14.682 6.881
552 1HB GLN 12 1HB GLN 12 -4.569 -12.862 5.212
553 2HB GLN 12 2HB GLN 12 -4.593 -14.487 4.516
554 1HG GLN 12 1HG GLN 12 -6.642 -14.056 3.327
555 2HG GLN 12 2HG GLN 12 -6.912 -12.537 4.188
556 1HE2 GLN 12 2HE2 GLN 12 -7.254 -11.696 2.049
557 2HE2 GLN 12 1HE2 GLN 12 -5.841 -11.134 1.153
558 H LEU 13 H LEU 13 -8.359 -13.184 6.021
559 HA LEU 13 HA LEU 13 -7.742 -10.603 7.145
560 1HB LEU 13 1HB LEU 13 -10.504 -11.706 6.574
561 2HB LEU 13 2HB LEU 13 -9.994 -10.053 6.874
562 HG LEU 13 HG LEU 13 -9.297 -11.712 4.446
563 1HD1 LEU 13 1HD1 LEU 13 -11.544 -10.999 4.362
564 2HD1 LEU 13 2HD1 LEU 13 -11.174 -9.403 5.028
565 3HD1 LEU 13 3HD1 LEU 13 -10.657 -9.790 3.384
566 1HD2 LEU 13 1HD2 LEU 13 -8.559 -8.822 5.049
567 2HD2 LEU 13 2HD2 LEU 13 -7.407 -10.178 4.956
568 3HD2 LEU 13 3HD2 LEU 13 -8.299 -9.701 3.516
569 H ILE 14 H ILE 14 -9.228 -13.740 8.066
570 HA ILE 14 HA ILE 14 -10.352 -12.735 10.491
571 HB ILE 14 HB ILE 14 -9.583 -15.597 9.639
572 1HG1 ILE 14 1HG1 ILE 14 -10.992 -14.863 7.975
573 2HG1 ILE 14 2HG1 ILE 14 -12.072 -15.656 9.100
574 1HG2 ILE 14 1HG2 ILE 14 -10.165 -15.419 12.125
575 2HG2 ILE 14 2HG2 ILE 14 -11.699 -14.660 11.671
576 3HG2 ILE 14 3HG2 ILE 14 -11.370 -16.322 11.191
577 1HD1 ILE 14 1HD1 ILE 14 -12.550 -13.323 10.086
578 2HD1 ILE 14 2HD1 ILE 14 -11.686 -12.669 8.676
579 3HD1 ILE 14 3HD1 ILE 14 -13.139 -13.636 8.445
580 H LYS 15 H LYS 15 -7.121 -14.365 10.148
581 HA LYS 15 HA LYS 15 -5.890 -13.805 12.464
582 1HB LYS 15 1HB LYS 15 -5.311 -14.153 9.512
583 2HB LYS 15 2HB LYS 15 -4.114 -13.378 10.477
584 1HG LYS 15 1HG LYS 15 -3.582 -15.658 10.296
585 2HG LYS 15 2HG LYS 15 -4.042 -15.390 11.981
586 1HD LYS 15 1HD LYS 15 -6.124 -16.538 11.696
587 2HD LYS 15 2HD LYS 15 -6.077 -16.382 9.927
588 1HE LYS 15 1HE LYS 15 -4.212 -17.920 9.738
589 2HE LYS 15 2HE LYS 15 -4.041 -18.028 11.502
590 1HZ LYS 15 1HZ LYS 15 -6.157 -19.079 11.600
591 2HZ LYS 15 2HZ LYS 15 -6.400 -18.890 9.982
592 3HZ LYS 15 3HZ LYS 15 -5.205 -19.885 10.524
593 H GLN 16 H GLN 16 -6.265 -11.606 9.517
594 HA GLN 16 HA GLN 16 -4.645 -9.562 10.809
595 1HB GLN 16 1HB GLN 16 -6.481 -9.502 8.403
596 2HB GLN 16 2HB GLN 16 -5.942 -8.017 9.150
597 1HG GLN 16 1HG GLN 16 -4.430 -8.286 7.466
598 2HG GLN 16 2HG GLN 16 -3.544 -8.803 8.901
599 1HE2 GLN 16 2HE2 GLN 16 -2.983 -11.062 9.083
600 2HE2 GLN 16 1HE2 GLN 16 -3.150 -12.137 7.695
601 H TYR 17 H TYR 17 -7.997 -10.411 10.910
602 HA TYR 17 HA TYR 17 -9.047 -7.876 11.824
603 1HB TYR 17 1HB TYR 17 -10.108 -10.660 11.344
604 2HB TYR 17 2HB TYR 17 -10.829 -9.787 12.631
605 HD1 TYR 17 HD1 TYR 17 -10.847 -10.191 9.045
606 HD2 TYR 17 HD2 TYR 17 -12.266 -7.865 12.362
607 HE1 TYR 17 HE1 TYR 17 -12.439 -9.111 7.575
608 HE2 TYR 17 HE2 TYR 17 -13.897 -6.756 10.860
609 HH TYR 17 HH TYR 17 -14.263 -7.706 7.445
610 H ARG 18 H ARG 18 -7.980 -10.949 13.190
611 HA ARG 18 HA ARG 18 -8.571 -10.267 15.949
612 1HB ARG 18 1HB ARG 18 -6.674 -12.303 14.745
613 2HB ARG 18 2HB ARG 18 -6.991 -12.133 16.484
614 1HG ARG 18 1HG ARG 18 -9.329 -12.696 16.214
615 2HG ARG 18 2HG ARG 18 -9.223 -12.589 14.467
616 1HD ARG 18 1HD ARG 18 -9.224 -14.861 14.824
617 2HD ARG 18 2HD ARG 18 -7.519 -14.547 14.573
618 HE ARG 18 HE ARG 18 -8.957 -15.364 17.017
619 1HH1 ARG 18 1HH2 ARG 18 -5.890 -14.129 15.789
620 2HH1 ARG 18 2HH2 ARG 18 -4.964 -14.634 17.176
621 1HH2 ARG 18 1HH1 ARG 18 -7.801 -15.993 18.834
622 2HH2 ARG 18 2HH1 ARG 18 -6.090 -15.705 18.968
623 H GLU 19 H GLU 19 -5.752 -10.142 13.903
624 HA GLU 19 HA GLU 19 -3.862 -9.039 15.673
625 1HB GLU 19 1HB GLU 19 -3.510 -10.079 13.343
626 2HB GLU 19 2HB GLU 19 -3.907 -8.465 12.715
627 1HG GLU 19 1HG GLU 19 -2.011 -7.506 13.945
628 2HG GLU 19 2HG GLU 19 -1.666 -9.079 14.683
629 H ALA 20 H ALA 20 -6.549 -7.483 13.901
630 HA ALA 20 HA ALA 20 -5.696 -4.875 15.151
631 1HB ALA 20 1HB ALA 20 -5.450 -4.826 12.751
632 2HB ALA 20 2HB ALA 20 -7.076 -5.477 12.518
633 3HB ALA 20 3HB ALA 20 -6.857 -3.846 13.202
634 H LEU 21 H LEU 21 -7.493 -7.138 16.194
635 HA LEU 21 HA LEU 21 -10.089 -5.732 16.470
636 1HB LEU 21 1HB LEU 21 -10.134 -8.054 15.981
637 2HB LEU 21 2HB LEU 21 -8.973 -8.449 17.237
638 HG LEU 21 HG LEU 21 -11.708 -8.732 17.178
639 1HD1 LEU 21 1HD1 LEU 21 -10.238 -10.214 18.340
640 2HD1 LEU 21 2HD1 LEU 21 -9.770 -8.945 19.495
641 3HD1 LEU 21 3HD1 LEU 21 -11.414 -9.598 19.516
642 1HD2 LEU 21 1HD2 LEU 21 -11.247 -6.772 19.437
643 2HD2 LEU 21 2HD2 LEU 21 -11.974 -6.355 17.865
644 3HD2 LEU 21 3HD2 LEU 21 -12.742 -7.560 18.902
645 H GLU 22 H GLU 22 -7.728 -7.282 18.598
646 HA GLU 22 HA GLU 22 -8.722 -5.714 20.846
647 1HB GLU 22 1HB GLU 22 -7.349 -7.306 22.241
648 2HB GLU 22 2HB GLU 22 -8.661 -8.058 21.329
649 1HG GLU 22 1HG GLU 22 -7.037 -8.795 19.593
650 2HG GLU 22 2HG GLU 22 -5.732 -8.007 20.511
651 H TYR 23 H TYR 23 -5.893 -6.091 18.799
652 HA TYR 23 HA TYR 23 -3.899 -4.821 20.336
653 1HB TYR 23 1HB TYR 23 -4.514 -5.072 17.376
654 2HB TYR 23 2HB TYR 23 -3.145 -4.178 17.972
655 HD1 TYR 23 HD1 TYR 23 -1.083 -5.190 17.947
656 HD2 TYR 23 HD2 TYR 23 -4.607 -7.648 18.349
657 HE1 TYR 23 HE1 TYR 23 0.292 -7.223 17.678
658 HE2 TYR 23 HE2 TYR 23 -3.215 -9.668 18.185
659 HH TYR 23 HH TYR 23 -1.113 -10.502 17.755
660 H VAL 24 H VAL 24 -6.772 -3.554 18.792
661 HA VAL 24 HA VAL 24 -5.802 -0.757 19.149
662 HB VAL 24 HB VAL 24 -6.687 -1.008 17.091
663 1HG1 VAL 24 1HG1 VAL 24 -8.009 -3.090 17.285
664 2HG1 VAL 24 2HG1 VAL 24 -9.392 -2.123 17.830
665 3HG1 VAL 24 3HG1 VAL 24 -8.676 -1.819 16.260
666 1HG2 VAL 24 1HG2 VAL 24 -9.078 0.235 18.402
667 2HG2 VAL 24 2HG2 VAL 24 -7.463 0.989 18.508
668 3HG2 VAL 24 3HG2 VAL 24 -8.225 0.706 16.931
669 H LYS 25 H LYS 25 -9.009 -1.868 19.577
670 HA LYS 25 HA LYS 25 -9.249 -2.299 22.333
671 1HB LYS 25 1HB LYS 25 -10.041 -0.082 23.219
672 2HB LYS 25 2HB LYS 25 -8.348 -0.105 22.843
673 1HG LYS 25 1HG LYS 25 -9.138 0.864 20.489
674 2HG LYS 25 2HG LYS 25 -10.600 1.291 21.368
675 1HD LYS 25 1HD LYS 25 -7.733 2.057 22.133
676 2HD LYS 25 2HD LYS 25 -8.810 3.067 21.159
677 1HE LYS 25 1HE LYS 25 -10.442 3.160 23.044
678 2HE LYS 25 2HE LYS 25 -9.321 2.213 24.044
679 1HZ LYS 25 1HZ LYS 25 -7.719 3.960 23.798
680 2HZ LYS 25 2HZ LYS 25 -8.740 4.833 22.842
681 3HZ LYS 25 3HZ LYS 25 -9.118 4.566 24.423
682 H LEU 26 H LEU 26 -10.620 -2.981 19.722
683 HA LEU 26 HA LEU 26 -13.326 -1.765 20.248
684 1HB LEU 26 1HB LEU 26 -12.041 -0.888 18.266
685 2HB LEU 26 2HB LEU 26 -12.266 -2.473 17.541
686 HG LEU 26 HG LEU 26 -14.835 -1.863 18.535
687 1HD1 LEU 26 1HD1 LEU 26 -15.352 0.399 17.947
688 2HD1 LEU 26 2HD1 LEU 26 -13.976 0.448 19.055
689 3HD1 LEU 26 3HD1 LEU 26 -13.715 0.684 17.313
690 1HD2 LEU 26 1HD2 LEU 26 -13.763 -1.336 15.745
691 2HD2 LEU 26 2HD2 LEU 26 -14.385 -2.876 16.389
692 3HD2 LEU 26 3HD2 LEU 26 -15.473 -1.498 16.216
693 HA PRO 27 HA PRO 27 -13.572 -6.373 20.670
694 1HB PRO 27 1HB PRO 27 -15.916 -6.449 22.179
695 2HB PRO 27 2HB PRO 27 -14.254 -6.351 22.817
696 1HG PRO 27 1HG PRO 27 -16.192 -4.081 22.349
697 2HG PRO 27 2HG PRO 27 -15.155 -4.367 23.779
698 1HD PRO 27 1HD PRO 27 -14.444 -2.604 21.884
699 2HD PRO 27 2HD PRO 27 -13.196 -3.668 22.589
700 H VAL 28 H VAL 28 -16.123 -4.104 19.679
701 HA VAL 28 HA VAL 28 -17.969 -5.736 18.424
702 HB VAL 28 HB VAL 28 -16.860 -3.069 17.652
703 1HG1 VAL 28 1HG1 VAL 28 -17.783 -3.923 15.587
704 2HG1 VAL 28 2HG1 VAL 28 -19.234 -4.524 16.424
705 3HG1 VAL 28 3HG1 VAL 28 -18.942 -2.779 16.256
706 1HG2 VAL 28 1HG2 VAL 28 -19.496 -3.886 18.942
707 2HG2 VAL 28 2HG2 VAL 28 -18.113 -3.172 19.801
708 3HG2 VAL 28 3HG2 VAL 28 -18.985 -2.227 18.584
709 H LEU 29 H LEU 29 -14.649 -5.115 17.322
710 HA LEU 29 HA LEU 29 -15.113 -5.671 14.557
711 1HB LEU 29 1HB LEU 29 -12.826 -5.113 16.327
712 2HB LEU 29 2HB LEU 29 -12.427 -6.347 15.151
713 HG LEU 29 HG LEU 29 -13.741 -3.696 14.400
714 1HD1 LEU 29 1HD1 LEU 29 -11.551 -3.315 15.594
715 2HD1 LEU 29 2HD1 LEU 29 -10.783 -4.390 14.424
716 3HD1 LEU 29 3HD1 LEU 29 -11.499 -2.852 13.891
717 1HD2 LEU 29 1HD2 LEU 29 -12.064 -5.690 12.827
718 2HD2 LEU 29 2HD2 LEU 29 -13.839 -5.585 12.756
719 3HD2 LEU 29 3HD2 LEU 29 -12.847 -4.242 12.191
720 H ALA 30 H ALA 30 -14.386 -7.651 17.376
721 HA ALA 30 HA ALA 30 -13.960 -10.060 15.879
722 1HB ALA 30 1HB ALA 30 -14.775 -9.540 18.798
723 2HB ALA 30 2HB ALA 30 -14.523 -11.169 18.149
724 3HB ALA 30 3HB ALA 30 -13.181 -10.030 18.199
725 H LYS 31 H LYS 31 -16.859 -8.318 16.880
726 HA LYS 31 HA LYS 31 -18.502 -10.733 16.403
727 1HB LYS 31 1HB LYS 31 -19.108 -7.921 17.259
728 2HB LYS 31 2HB LYS 31 -20.381 -8.886 16.481
729 1HG LYS 31 1HG LYS 31 -20.125 -10.687 18.043
730 2HG LYS 31 2HG LYS 31 -18.722 -9.936 18.816
731 1HD LYS 31 1HD LYS 31 -19.992 -8.422 20.000
732 2HD LYS 31 2HD LYS 31 -21.240 -8.299 18.743
733 1HE LYS 31 1HE LYS 31 -22.179 -10.456 19.330
734 2HE LYS 31 2HE LYS 31 -20.874 -10.783 20.485
735 1HZ LYS 31 1HZ LYS 31 -21.651 -9.003 21.821
736 2HZ LYS 31 2HZ LYS 31 -22.802 -8.579 20.716
737 3HZ LYS 31 3HZ LYS 31 -22.908 -10.021 21.510
738 H ILE 32 H ILE 32 -17.444 -7.966 14.458
739 HA ILE 32 HA ILE 32 -19.196 -8.490 12.293
740 HB ILE 32 HB ILE 32 -16.483 -7.075 12.428
741 1HG1 ILE 32 1HG1 ILE 32 -19.276 -5.833 12.687
742 2HG1 ILE 32 2HG1 ILE 32 -18.194 -6.062 14.045
743 1HG2 ILE 32 1HG2 ILE 32 -17.140 -6.129 10.327
744 2HG2 ILE 32 2HG2 ILE 32 -17.655 -7.820 10.195
745 3HG2 ILE 32 3HG2 ILE 32 -18.836 -6.563 10.620
746 1HD1 ILE 32 1HD1 ILE 32 -16.514 -4.582 13.053
747 2HD1 ILE 32 2HD1 ILE 32 -17.552 -4.324 11.639
748 3HD1 ILE 32 3HD1 ILE 32 -18.081 -3.768 13.227
749 H LEU 33 H LEU 33 -15.741 -9.210 13.126
750 HA LEU 33 HA LEU 33 -15.253 -10.700 10.803
751 1HB LEU 33 1HB LEU 33 -13.177 -11.098 11.618
752 2HB LEU 33 2HB LEU 33 -13.683 -9.734 12.615
753 HG LEU 33 HG LEU 33 -14.371 -11.406 14.357
754 1HD1 LEU 33 1HD1 LEU 33 -14.346 -13.549 13.870
755 2HD1 LEU 33 2HD1 LEU 33 -13.469 -13.264 12.346
756 3HD1 LEU 33 3HD1 LEU 33 -12.580 -13.472 13.876
757 1HD2 LEU 33 1HD2 LEU 33 -11.429 -11.449 13.704
758 2HD2 LEU 33 2HD2 LEU 33 -12.257 -9.986 14.327
759 3HD2 LEU 33 3HD2 LEU 33 -12.183 -11.463 15.306
760 H GLU 34 H GLU 34 -16.599 -11.774 13.966
761 HA GLU 34 HA GLU 34 -16.546 -14.541 13.418
762 1HB GLU 34 1HB GLU 34 -17.141 -13.310 15.589
763 2HB GLU 34 2HB GLU 34 -18.771 -13.143 14.958
764 1HG GLU 34 1HG GLU 34 -18.964 -15.600 14.815
765 2HG GLU 34 2HG GLU 34 -17.262 -15.783 15.274
766 H ASP 35 H ASP 35 -19.040 -12.105 12.821
767 HA ASP 35 HA ASP 35 -20.916 -13.745 11.481
768 1HB ASP 35 1HB ASP 35 -21.277 -11.358 12.189
769 2HB ASP 35 2HB ASP 35 -20.351 -10.845 10.769
770 H GLU 36 H GLU 36 -18.306 -11.716 9.923
771 HA GLU 36 HA GLU 36 -18.469 -12.726 7.396
772 1HB GLU 36 1HB GLU 36 -15.825 -12.109 8.756
773 2HB GLU 36 2HB GLU 36 -16.223 -12.092 7.040
774 1HG GLU 36 1HG GLU 36 -18.107 -10.304 8.108
775 2HG GLU 36 2HG GLU 36 -16.673 -10.013 9.080
776 H GLU 37 H GLU 37 -16.674 -14.315 10.179
777 HA GLU 37 HA GLU 37 -15.544 -16.386 8.767
778 1HB GLU 37 1HB GLU 37 -15.660 -15.546 11.354
779 2HB GLU 37 2HB GLU 37 -16.658 -16.998 11.469
780 1HG GLU 37 1HG GLU 37 -13.876 -16.842 10.218
781 2HG GLU 37 2HG GLU 37 -14.215 -17.092 11.926
782 H LYS 38 H LYS 38 -18.953 -16.028 9.753
783 HA LYS 38 HA LYS 38 -19.634 -18.747 8.977
784 1HB LYS 38 1HB LYS 38 -20.858 -17.173 10.613
785 2HB LYS 38 2HB LYS 38 -21.520 -16.378 9.176
786 1HG LYS 38 1HG LYS 38 -22.332 -18.693 8.407
787 2HG LYS 38 2HG LYS 38 -21.769 -19.321 9.963
788 1HD LYS 38 1HD LYS 38 -23.338 -17.631 11.088
789 2HD LYS 38 2HD LYS 38 -23.929 -17.210 9.472
790 1HE LYS 38 1HE LYS 38 -25.473 -18.818 10.415
791 2HE LYS 38 2HE LYS 38 -24.572 -19.638 9.129
792 1HZ LYS 38 1HZ LYS 38 -23.167 -20.590 10.824
793 2HZ LYS 38 2HZ LYS 38 -24.004 -19.813 12.009
794 3HZ LYS 38 3HZ LYS 38 -24.743 -20.972 11.100
795 H HIS 39 H HIS 39 -19.840 -15.538 7.359
796 HA HIS 39 HA HIS 39 -21.065 -16.529 4.950
797 1HB HIS 39 1HB HIS 39 -19.210 -14.170 5.453
798 2HB HIS 39 2HB HIS 39 -19.922 -14.531 3.888
799 HD1 HIS 39 HD1 HIS 39 -22.796 -14.753 4.038
800 HD2 HIS 39 HD2 HIS 39 -20.684 -12.631 7.002
801 HE1 HIS 39 HE1 HIS 39 -24.491 -13.180 5.175
802 HE2 HIS 39 HE2 HIS 39 -23.158 -11.882 6.964
803 H ILE 40 H ILE 40 -17.695 -16.309 6.005
804 HA ILE 40 HA ILE 40 -16.495 -17.257 3.592
805 HB ILE 40 HB ILE 40 -15.505 -17.331 6.470
806 1HG1 ILE 40 1HG1 ILE 40 -14.729 -15.386 4.302
807 2HG1 ILE 40 2HG1 ILE 40 -16.113 -15.015 5.266
808 1HG2 ILE 40 1HG2 ILE 40 -14.219 -18.888 5.046
809 2HG2 ILE 40 2HG2 ILE 40 -14.041 -17.640 3.802
810 3HG2 ILE 40 3HG2 ILE 40 -13.235 -17.461 5.372
811 1HD1 ILE 40 1HD1 ILE 40 -14.841 -14.988 7.317
812 2HD1 ILE 40 2HD1 ILE 40 -13.370 -15.498 6.485
813 3HD1 ILE 40 3HD1 ILE 40 -14.110 -13.914 6.141
814 H GLU 41 H GLU 41 -17.555 -18.867 6.636
815 HA GLU 41 HA GLU 41 -16.888 -21.477 5.983
816 1HB GLU 41 1HB GLU 41 -17.722 -20.645 8.165
817 2HB GLU 41 2HB GLU 41 -19.362 -20.564 7.514
818 1HG GLU 41 1HG GLU 41 -17.823 -23.150 7.333
819 2HG GLU 41 2HG GLU 41 -18.490 -22.632 8.889
820 H TRP 42 H TRP 42 -19.752 -19.575 4.820
821 HA TRP 42 HA TRP 42 -21.119 -21.626 3.606
822 1HB TRP 42 1HB TRP 42 -21.564 -19.078 3.794
823 2HB TRP 42 2HB TRP 42 -20.722 -18.959 2.256
824 HD1 TRP 42 HD1 TRP 42 -23.836 -20.495 3.766
825 HE1 TRP 42 HE1 TRP 42 -25.459 -21.225 1.876
826 HE3 TRP 42 HE3 TRP 42 -20.829 -19.544 -0.139
827 HZ2 TRP 42 HZ2 TRP 42 -25.321 -21.504 -1.065
828 HZ3 TRP 42 HZ3 TRP 42 -21.546 -20.028 -2.505
829 HH2 TRP 42 HH2 TRP 42 -23.722 -21.146 -2.920
830 H LEU 43 H LEU 43 -18.170 -20.005 2.558
831 HA LEU 43 HA LEU 43 -18.092 -21.305 -0.060
832 1HB LEU 43 1HB LEU 43 -15.932 -19.807 1.430
833 2HB LEU 43 2HB LEU 43 -15.749 -20.553 -0.154
834 HG LEU 43 HG LEU 43 -18.095 -19.011 -0.428
835 1HD1 LEU 43 1HD1 LEU 43 -17.654 -17.766 1.611
836 2HD1 LEU 43 2HD1 LEU 43 -15.979 -17.456 1.126
837 3HD1 LEU 43 3HD1 LEU 43 -17.312 -16.716 0.230
838 1HD2 LEU 43 1HD2 LEU 43 -15.230 -18.347 -1.213
839 2HD2 LEU 43 2HD2 LEU 43 -16.362 -19.336 -2.156
840 3HD2 LEU 43 3HD2 LEU 43 -16.694 -17.613 -1.905
841 H GLU 44 H GLU 44 -16.878 -22.140 3.259
842 HA GLU 44 HA GLU 44 -15.709 -24.614 2.078
843 1HB GLU 44 1HB GLU 44 -15.905 -23.689 4.968
844 2HB GLU 44 2HB GLU 44 -15.202 -25.207 4.397
845 1HG GLU 44 1HG GLU 44 -13.705 -23.806 2.867
846 2HG GLU 44 2HG GLU 44 -14.157 -22.415 3.879
847 H THR 45 H THR 45 -18.604 -24.078 1.645
848 HA THR 45 HA THR 45 -19.311 -26.804 2.536
849 HB THR 45 HB THR 45 -20.031 -24.900 4.195
850 HG1 THR 45 HG1 THR 45 -20.547 -27.008 4.547
851 1HG2 THR 45 1HG2 THR 45 -21.300 -23.556 2.655
852 2HG2 THR 45 2HG2 THR 45 -22.473 -24.863 2.448
853 3HG2 THR 45 3HG2 THR 45 -22.218 -24.095 4.046
854 H ILE 46 H ILE 46 -20.394 -23.954 0.813
855 HA ILE 46 HA ILE 46 -21.679 -23.717 -1.048
856 HB ILE 46 HB ILE 46 -19.397 -23.667 -1.740
857 1HG1 ILE 46 1HG1 ILE 46 -19.539 -24.083 -4.110
858 2HG1 ILE 46 2HG1 ILE 46 -20.966 -25.099 -3.926
859 1HG2 ILE 46 1HG2 ILE 46 -18.536 -25.829 -1.082
860 2HG2 ILE 46 2HG2 ILE 46 -19.521 -26.652 -2.309
861 3HG2 ILE 46 3HG2 ILE 46 -18.224 -25.552 -2.791
862 1HD1 ILE 46 1HD1 ILE 46 -22.262 -23.175 -3.120
863 2HD1 ILE 46 2HD1 ILE 46 -20.785 -22.173 -3.122
864 3HD1 ILE 46 3HD1 ILE 46 -21.475 -22.763 -4.650
865 H LEU 47 H LEU 47 -23.380 -25.045 0.082
866 HA LEU 47 HA LEU 47 -25.105 -26.528 0.016
867 1HB LEU 47 1HB LEU 47 -25.408 -25.646 -2.304
868 2HB LEU 47 2HB LEU 47 -24.381 -26.941 -2.905
869 HG LEU 47 HG LEU 47 -26.252 -28.382 -1.436
870 1HD1 LEU 47 1HD1 LEU 47 -27.616 -26.352 -1.039
871 2HD1 LEU 47 2HD1 LEU 47 -27.744 -26.105 -2.796
872 3HD1 LEU 47 3HD1 LEU 47 -28.456 -27.547 -2.043
873 1HD2 LEU 47 1HD2 LEU 47 -26.386 -27.598 -4.373
874 2HD2 LEU 47 2HD2 LEU 47 -25.417 -28.917 -3.681
875 3HD2 LEU 47 3HD2 LEU 47 -27.186 -28.997 -3.619
876 H GLY 48 H GLY 48 -23.305 -27.573 1.422
877 1HA GLY 48 1HA GLY 48 -22.071 -29.997 0.535
878 2HA GLY 48 2HA GLY 48 -22.348 -29.476 2.203
879 1HN NH2 49 1HN NH2 49 -24.168 -30.773 -0.665
880 2HN NH2 49 2HN NH2 49 -25.289 -31.771 0.299
Start of MODEL 10
1 1H ACE 0 H1 ACE 0 6.570 14.609 -3.408
2 2H ACE 0 H2 ACE 0 5.492 15.632 -4.377
3 3H ACE 0 H3 ACE 0 7.140 15.291 -4.949
4 H ASP 1 H ASP 1 5.474 14.755 -6.824
5 HA ASP 1 HA ASP 1 3.735 12.643 -6.570
6 1HB ASP 1 1HB ASP 1 3.882 14.401 -8.412
7 2HB ASP 1 2HB ASP 1 5.060 13.348 -9.211
8 H TYR 2 H TYR 2 7.099 12.407 -7.123
9 HA TYR 2 HA TYR 2 8.216 9.979 -7.608
10 1HB TYR 2 1HB TYR 2 8.237 11.960 -5.432
11 2HB TYR 2 2HB TYR 2 8.397 10.363 -4.764
12 HD1 TYR 2 HD1 TYR 2 9.937 8.825 -6.651
13 HD2 TYR 2 HD2 TYR 2 10.356 12.945 -5.457
14 HE1 TYR 2 HE1 TYR 2 12.367 8.646 -6.854
15 HE2 TYR 2 HE2 TYR 2 12.762 12.826 -5.946
16 HH TYR 2 HH TYR 2 14.147 10.055 -7.699
17 H LEU 3 H LEU 3 5.834 10.292 -4.866
18 HA LEU 3 HA LEU 3 5.991 7.597 -4.117
19 1HB LEU 3 1HB LEU 3 3.572 9.471 -3.929
20 2HB LEU 3 2HB LEU 3 3.583 7.827 -3.317
21 HG LEU 3 HG LEU 3 5.771 8.646 -2.014
22 1HD1 LEU 3 1HD1 LEU 3 5.756 10.955 -2.766
23 2HD1 LEU 3 2HD1 LEU 3 4.041 11.149 -2.317
24 3HD1 LEU 3 3HD1 LEU 3 5.271 10.928 -1.064
25 1HD2 LEU 3 1HD2 LEU 3 2.887 9.137 -1.167
26 2HD2 LEU 3 2HD2 LEU 3 3.779 7.611 -0.990
27 3HD2 LEU 3 3HD2 LEU 3 4.269 9.031 -0.058
28 H ARG 4 H ARG 4 4.236 8.820 -6.870
29 HA ARG 4 HA ARG 4 2.571 6.696 -7.511
30 1HB ARG 4 1HB ARG 4 2.727 7.427 -9.766
31 2HB ARG 4 2HB ARG 4 2.848 8.856 -8.733
32 1HG ARG 4 1HG ARG 4 5.438 8.559 -8.986
33 2HG ARG 4 2HG ARG 4 5.038 7.441 -10.308
34 1HD ARG 4 1HD ARG 4 3.715 9.336 -11.364
35 2HD ARG 4 2HD ARG 4 4.320 10.362 -10.047
36 HE ARG 4 HE ARG 4 6.441 8.957 -11.431
37 1HH1 ARG 4 1HH2 ARG 4 4.377 11.837 -11.545
38 2HH1 ARG 4 2HH2 ARG 4 5.477 12.747 -12.538
39 1HH2 ARG 4 1HH1 ARG 4 7.880 10.133 -12.711
40 2HH2 ARG 4 2HH1 ARG 4 7.517 11.755 -13.227
41 H GLU 5 H GLU 5 6.093 6.866 -7.609
42 HA GLU 5 HA GLU 5 6.484 4.617 -9.421
43 1HB GLU 5 1HB GLU 5 8.423 5.972 -7.488
44 2HB GLU 5 2HB GLU 5 8.849 4.814 -8.747
45 1HG GLU 5 1HG GLU 5 8.090 6.377 -10.494
46 2HG GLU 5 2HG GLU 5 7.543 7.529 -9.266
47 H LEU 6 H LEU 6 5.885 5.058 -6.021
48 HA LEU 6 HA LEU 6 7.087 2.479 -5.259
49 1HB LEU 6 1HB LEU 6 5.924 4.783 -3.631
50 2HB LEU 6 2HB LEU 6 6.631 3.284 -3.004
51 HG LEU 6 HG LEU 6 8.805 3.915 -4.100
52 1HD1 LEU 6 1HD1 LEU 6 7.422 6.025 -5.315
53 2HD1 LEU 6 2HD1 LEU 6 8.140 6.800 -3.938
54 3HD1 LEU 6 3HD1 LEU 6 9.158 5.902 -5.098
55 1HD2 LEU 6 1HD2 LEU 6 7.609 5.741 -1.951
56 2HD2 LEU 6 2HD2 LEU 6 8.240 4.125 -1.648
57 3HD2 LEU 6 3HD2 LEU 6 9.339 5.405 -2.166
58 H LEU 7 H LEU 7 4.154 3.444 -6.560
59 HA LEU 7 HA LEU 7 2.715 1.390 -5.101
60 1HB LEU 7 1HB LEU 7 0.767 2.735 -4.822
61 2HB LEU 7 2HB LEU 7 2.174 3.443 -4.045
62 HG LEU 7 HG LEU 7 2.340 4.824 -6.308
63 1HD1 LEU 7 1HD1 LEU 7 0.105 3.683 -7.163
64 2HD1 LEU 7 2HD1 LEU 7 -0.679 4.739 -5.995
65 3HD1 LEU 7 3HD1 LEU 7 0.279 5.442 -7.297
66 1HD2 LEU 7 1HD2 LEU 7 0.447 5.506 -4.029
67 2HD2 LEU 7 2HD2 LEU 7 2.198 5.783 -4.051
68 3HD2 LEU 7 3HD2 LEU 7 1.152 6.665 -5.173
69 H LYS 8 H LYS 8 2.615 3.534 -7.983
70 HA LYS 8 HA LYS 8 0.630 1.985 -9.174
71 1HB LYS 8 1HB LYS 8 1.302 4.428 -9.545
72 2HB LYS 8 2HB LYS 8 2.526 3.845 -10.673
73 1HG LYS 8 1HG LYS 8 0.928 3.271 -12.272
74 2HG LYS 8 2HG LYS 8 -0.264 2.794 -11.056
75 1HD LYS 8 1HD LYS 8 -0.682 5.128 -10.445
76 2HD LYS 8 2HD LYS 8 0.467 5.699 -11.661
77 1HE LYS 8 1HE LYS 8 -1.817 3.881 -12.505
78 2HE LYS 8 2HE LYS 8 -2.174 5.562 -12.114
79 1HZ LYS 8 1HZ LYS 8 -0.627 6.275 -13.737
80 2HZ LYS 8 2HZ LYS 8 -0.194 4.730 -14.111
81 3HZ LYS 8 3HZ LYS 8 -1.721 5.262 -14.429
82 H LEU 9 H LEU 9 4.139 1.942 -9.300
83 HA LEU 9 HA LEU 9 4.351 -0.193 -11.274
84 1HB LEU 9 1HB LEU 9 6.227 0.977 -9.216
85 2HB LEU 9 2HB LEU 9 6.651 -0.455 -10.148
86 HG LEU 9 HG LEU 9 5.786 2.056 -11.592
87 1HD1 LEU 9 1HD1 LEU 9 7.659 2.762 -10.167
88 2HD1 LEU 9 2HD1 LEU 9 8.616 1.366 -10.681
89 3HD1 LEU 9 3HD1 LEU 9 8.190 2.634 -11.843
90 1HD2 LEU 9 1HD2 LEU 9 7.624 -0.283 -12.317
91 2HD2 LEU 9 2HD2 LEU 9 5.948 -0.095 -12.866
92 3HD2 LEU 9 3HD2 LEU 9 7.181 1.059 -13.387
93 H GLU 10 H GLU 10 4.231 -0.012 -7.643
94 HA GLU 10 HA GLU 10 4.594 -2.720 -7.103
95 1HB GLU 10 1HB GLU 10 2.877 -0.750 -5.657
96 2HB GLU 10 2HB GLU 10 3.226 -2.406 -5.193
97 1HG GLU 10 1HG GLU 10 5.453 -0.366 -5.457
98 2HG GLU 10 2HG GLU 10 4.547 -0.652 -3.979
99 H LEU 11 H LEU 11 1.568 -1.046 -8.019
100 HA LEU 11 HA LEU 11 -0.221 -3.184 -7.705
101 1HB LEU 11 1HB LEU 11 -0.966 -0.982 -8.233
102 2HB LEU 11 2HB LEU 11 -0.132 -0.960 -9.785
103 HG LEU 11 HG LEU 11 -2.140 -3.160 -9.389
104 1HD1 LEU 11 1HD1 LEU 11 -3.322 -1.269 -8.386
105 2HD1 LEU 11 2HD1 LEU 11 -2.949 -0.254 -9.796
106 3HD1 LEU 11 3HD1 LEU 11 -4.018 -1.664 -9.966
107 1HD2 LEU 11 1HD2 LEU 11 -1.572 -1.224 -11.694
108 2HD2 LEU 11 2HD2 LEU 11 -0.909 -2.860 -11.571
109 3HD2 LEU 11 3HD2 LEU 11 -2.649 -2.631 -11.753
110 H GLN 12 H GLN 12 2.076 -2.606 -10.394
111 HA GLN 12 HA GLN 12 1.058 -4.709 -12.073
112 1HB GLN 12 1HB GLN 12 3.888 -3.597 -11.967
113 2HB GLN 12 2HB GLN 12 3.173 -4.581 -13.244
114 1HG GLN 12 1HG GLN 12 1.417 -2.778 -13.569
115 2HG GLN 12 2HG GLN 12 2.364 -1.741 -12.488
116 1HE2 GLN 12 2HE2 GLN 12 4.969 -2.178 -13.196
117 2HE2 GLN 12 1HE2 GLN 12 5.211 -1.800 -14.895
118 H LEU 13 H LEU 13 3.118 -4.701 -9.215
119 HA LEU 13 HA LEU 13 4.366 -7.266 -9.735
120 1HB LEU 13 1HB LEU 13 4.133 -5.857 -7.066
121 2HB LEU 13 2HB LEU 13 5.259 -7.110 -7.575
122 HG LEU 13 HG LEU 13 5.170 -4.238 -8.570
123 1HD1 LEU 13 1HD1 LEU 13 6.206 -5.255 -6.209
124 2HD1 LEU 13 2HD1 LEU 13 7.594 -5.360 -7.306
125 3HD1 LEU 13 3HD1 LEU 13 6.799 -3.818 -7.029
126 1HD2 LEU 13 1HD2 LEU 13 7.069 -6.480 -9.362
127 2HD2 LEU 13 2HD2 LEU 13 5.935 -5.620 -10.432
128 3HD2 LEU 13 3HD2 LEU 13 7.295 -4.747 -9.704
129 H ILE 14 H ILE 14 1.703 -6.015 -7.636
130 HA ILE 14 HA ILE 14 1.006 -8.645 -6.606
131 HB ILE 14 HB ILE 14 -0.288 -5.919 -6.669
132 1HG1 ILE 14 1HG1 ILE 14 -0.223 -6.216 -4.259
133 2HG1 ILE 14 2HG1 ILE 14 0.192 -7.928 -4.413
134 1HG2 ILE 14 1HG2 ILE 14 -2.231 -7.325 -7.134
135 2HG2 ILE 14 2HG2 ILE 14 -1.747 -8.474 -5.864
136 3HG2 ILE 14 3HG2 ILE 14 -2.254 -6.827 -5.443
137 1HD1 ILE 14 1HD1 ILE 14 2.423 -7.331 -5.299
138 2HD1 ILE 14 2HD1 ILE 14 1.968 -5.631 -5.318
139 3HD1 ILE 14 3HD1 ILE 14 2.115 -6.530 -3.779
140 H LYS 15 H LYS 15 -0.105 -6.780 -9.423
141 HA LYS 15 HA LYS 15 -1.956 -8.723 -10.388
142 1HB LYS 15 1HB LYS 15 -1.949 -6.503 -11.179
143 2HB LYS 15 2HB LYS 15 -0.262 -6.557 -11.661
144 1HG LYS 15 1HG LYS 15 -2.204 -8.449 -13.004
145 2HG LYS 15 2HG LYS 15 -2.247 -6.722 -13.403
146 1HD LYS 15 1HD LYS 15 0.216 -6.760 -13.840
147 2HD LYS 15 2HD LYS 15 0.208 -8.516 -13.617
148 1HE LYS 15 1HE LYS 15 -1.418 -8.762 -15.483
149 2HE LYS 15 2HE LYS 15 -1.444 -6.999 -15.698
150 1HZ LYS 15 1HZ LYS 15 0.888 -7.101 -16.215
151 2HZ LYS 15 2HZ LYS 15 0.888 -8.745 -16.043
152 3HZ LYS 15 3HZ LYS 15 0.009 -8.040 -17.243
153 H GLN 16 H GLN 16 1.595 -8.330 -10.948
154 HA GLN 16 HA GLN 16 1.728 -10.661 -12.636
155 1HB GLN 16 1HB GLN 16 3.792 -8.922 -11.262
156 2HB GLN 16 2HB GLN 16 4.282 -10.464 -11.939
157 1HG GLN 16 1HG GLN 16 2.840 -8.322 -13.541
158 2HG GLN 16 2HG GLN 16 4.594 -8.584 -13.534
159 1HE2 GLN 16 2HE2 GLN 16 3.152 -8.769 -15.981
160 2HE2 GLN 16 1HE2 GLN 16 3.100 -10.474 -16.432
161 H TYR 17 H TYR 17 1.921 -10.224 -9.150
162 HA TYR 17 HA TYR 17 2.976 -12.822 -8.575
163 1HB TYR 17 1HB TYR 17 1.503 -10.689 -7.025
164 2HB TYR 17 2HB TYR 17 1.700 -12.245 -6.310
165 HD1 TYR 17 HD1 TYR 17 2.782 -9.420 -5.488
166 HD2 TYR 17 HD2 TYR 17 4.412 -13.103 -6.913
167 HE1 TYR 17 HE1 TYR 17 4.914 -8.914 -4.332
168 HE2 TYR 17 HE2 TYR 17 6.556 -12.597 -5.811
169 HH TYR 17 HH TYR 17 7.763 -11.033 -4.553
170 H ARG 18 H ARG 18 -0.232 -11.596 -9.388
171 HA ARG 18 HA ARG 18 -1.542 -14.101 -8.527
172 1HB ARG 18 1HB ARG 18 -2.548 -11.707 -10.116
173 2HB ARG 18 2HB ARG 18 -3.423 -13.243 -9.999
174 1HG ARG 18 1HG ARG 18 -3.256 -13.078 -7.483
175 2HG ARG 18 2HG ARG 18 -2.677 -11.418 -7.684
176 1HD ARG 18 1HD ARG 18 -4.820 -10.659 -8.126
177 2HD ARG 18 2HD ARG 18 -5.119 -11.950 -9.274
178 HE ARG 18 HE ARG 18 -6.186 -13.202 -7.722
179 1HH1 ARG 18 1HH2 ARG 18 -4.365 -10.689 -6.074
180 2HH1 ARG 18 2HH2 ARG 18 -5.011 -11.023 -4.492
181 1HH2 ARG 18 1HH1 ARG 18 -7.011 -13.728 -5.658
182 2HH2 ARG 18 2HH1 ARG 18 -6.540 -12.814 -4.251
183 H GLU 19 H GLU 19 -0.547 -12.557 -11.502
184 HA GLU 19 HA GLU 19 -1.147 -14.588 -13.345
185 1HB GLU 19 1HB GLU 19 -0.278 -12.273 -13.811
186 2HB GLU 19 2HB GLU 19 1.345 -12.861 -13.415
187 1HG GLU 19 1HG GLU 19 1.375 -14.355 -15.271
188 2HG GLU 19 2HG GLU 19 -0.361 -14.152 -15.559
189 H ALA 20 H ALA 20 1.784 -14.205 -11.271
190 HA ALA 20 HA ALA 20 2.860 -16.714 -12.263
191 1HB ALA 20 1HB ALA 20 4.323 -14.860 -11.993
192 2HB ALA 20 2HB ALA 20 3.796 -14.624 -10.351
193 3HB ALA 20 3HB ALA 20 4.792 -16.049 -10.769
194 H LEU 21 H LEU 21 1.060 -15.790 -9.350
195 HA LEU 21 HA LEU 21 1.613 -17.861 -7.626
196 1HB LEU 21 1HB LEU 21 0.144 -16.121 -6.944
197 2HB LEU 21 2HB LEU 21 -0.980 -16.456 -8.268
198 HG LEU 21 HG LEU 21 -1.690 -18.539 -7.181
199 1HD1 LEU 21 1HD1 LEU 21 0.468 -18.941 -5.817
200 2HD1 LEU 21 2HD1 LEU 21 -0.110 -17.662 -4.728
201 3HD1 LEU 21 3HD1 LEU 21 -1.058 -19.125 -4.932
202 1HD2 LEU 21 1HD2 LEU 21 -1.786 -16.104 -5.341
203 2HD2 LEU 21 2HD2 LEU 21 -2.852 -16.376 -6.731
204 3HD2 LEU 21 3HD2 LEU 21 -2.917 -17.474 -5.343
205 H GLU 22 H GLU 22 -0.622 -18.030 -10.405
206 HA GLU 22 HA GLU 22 -1.536 -20.698 -9.776
207 1HB GLU 22 1HB GLU 22 -1.649 -19.015 -12.323
208 2HB GLU 22 2HB GLU 22 -2.340 -20.639 -12.204
209 1HG GLU 22 1HG GLU 22 -3.129 -18.347 -10.349
210 2HG GLU 22 2HG GLU 22 -4.005 -18.803 -11.816
211 H TYR 23 H TYR 23 0.881 -19.389 -12.057
212 HA TYR 23 HA TYR 23 1.596 -21.917 -13.173
213 1HB TYR 23 1HB TYR 23 2.066 -19.446 -13.922
214 2HB TYR 23 2HB TYR 23 3.498 -19.577 -12.912
215 HD1 TYR 23 HD1 TYR 23 1.674 -20.941 -15.853
216 HD2 TYR 23 HD2 TYR 23 5.446 -20.764 -13.777
217 HE1 TYR 23 HE1 TYR 23 2.831 -21.628 -17.916
218 HE2 TYR 23 HE2 TYR 23 6.608 -21.466 -15.847
219 HH TYR 23 HH TYR 23 4.859 -22.144 -18.888
220 H VAL 24 H VAL 24 2.600 -20.155 -10.290
221 HA VAL 24 HA VAL 24 4.848 -21.942 -9.726
222 HB VAL 24 HB VAL 24 3.651 -19.583 -8.194
223 1HG1 VAL 24 1HG1 VAL 24 6.152 -21.291 -7.696
224 2HG1 VAL 24 2HG1 VAL 24 5.890 -19.699 -6.969
225 3HG1 VAL 24 3HG1 VAL 24 4.797 -21.036 -6.581
226 1HG2 VAL 24 1HG2 VAL 24 6.281 -19.915 -9.756
227 2HG2 VAL 24 2HG2 VAL 24 4.865 -19.117 -10.432
228 3HG2 VAL 24 3HG2 VAL 24 5.667 -18.425 -9.016
229 H LYS 25 H LYS 25 1.453 -21.756 -8.780
230 HA LYS 25 HA LYS 25 0.164 -23.069 -7.481
231 1HB LYS 25 1HB LYS 25 2.152 -24.961 -8.675
232 2HB LYS 25 2HB LYS 25 1.233 -25.591 -7.316
233 1HG LYS 25 1HG LYS 25 -0.883 -24.982 -8.394
234 2HG LYS 25 2HG LYS 25 0.008 -24.393 -9.813
235 1HD LYS 25 1HD LYS 25 0.929 -26.605 -10.233
236 2HD LYS 25 2HD LYS 25 0.261 -27.231 -8.712
237 1HE LYS 25 1HE LYS 25 -2.050 -26.811 -9.548
238 2HE LYS 25 2HE LYS 25 -1.383 -26.220 -11.082
239 1HZ LYS 25 1HZ LYS 25 -0.430 -28.383 -11.423
240 2HZ LYS 25 2HZ LYS 25 -1.028 -28.926 -9.986
241 3HZ LYS 25 3HZ LYS 25 -2.058 -28.507 -11.202
242 H LEU 26 H LEU 26 1.511 -21.358 -5.957
243 HA LEU 26 HA LEU 26 2.247 -22.948 -3.512
244 1HB LEU 26 1HB LEU 26 4.236 -21.989 -4.402
245 2HB LEU 26 2HB LEU 26 3.442 -20.426 -4.614
246 HG LEU 26 HG LEU 26 3.203 -20.223 -2.132
247 1HD1 LEU 26 1HD1 LEU 26 3.287 -22.509 -1.335
248 2HD1 LEU 26 2HD1 LEU 26 4.869 -22.772 -2.097
249 3HD1 LEU 26 3HD1 LEU 26 4.716 -21.678 -0.715
250 1HD2 LEU 26 1HD2 LEU 26 6.084 -20.599 -2.953
251 2HD2 LEU 26 2HD2 LEU 26 5.083 -19.208 -3.420
252 3HD2 LEU 26 3HD2 LEU 26 5.390 -19.516 -1.721
253 HA PRO 27 HA PRO 27 -1.439 -20.469 -2.372
254 1HB PRO 27 1HB PRO 27 -1.792 -21.425 0.212
255 2HB PRO 27 2HB PRO 27 -2.420 -22.192 -1.272
256 1HG PRO 27 1HG PRO 27 0.126 -22.861 0.220
257 2HG PRO 27 2HG PRO 27 -1.109 -23.991 -0.406
258 1HD PRO 27 1HD PRO 27 1.161 -23.543 -1.763
259 2HD PRO 27 2HD PRO 27 -0.374 -23.656 -2.665
260 H VAL 28 H VAL 28 1.524 -20.806 -0.354
261 HA VAL 28 HA VAL 28 1.213 -18.562 1.302
262 HB VAL 28 HB VAL 28 3.674 -19.713 0.061
263 1HG1 VAL 28 1HG1 VAL 28 4.356 -17.508 0.474
264 2HG1 VAL 28 2HG1 VAL 28 3.350 -17.364 1.944
265 3HG1 VAL 28 3HG1 VAL 28 4.805 -18.334 1.968
266 1HG2 VAL 28 1HG2 VAL 28 2.732 -19.727 2.945
267 2HG2 VAL 28 2HG2 VAL 28 2.536 -21.101 1.819
268 3HG2 VAL 28 3HG2 VAL 28 4.157 -20.546 2.283
269 H LEU 29 H LEU 29 1.773 -18.634 -2.178
270 HA LEU 29 HA LEU 29 3.091 -16.073 -2.335
271 1HB LEU 29 1HB LEU 29 2.489 -18.170 -4.199
272 2HB LEU 29 2HB LEU 29 1.812 -16.668 -4.828
273 HG LEU 29 HG LEU 29 4.671 -16.853 -3.855
274 1HD1 LEU 29 1HD1 LEU 29 4.301 -18.524 -5.659
275 2HD1 LEU 29 2HD1 LEU 29 3.638 -17.251 -6.697
276 3HD1 LEU 29 3HD1 LEU 29 5.333 -17.189 -6.189
277 1HD2 LEU 29 1HD2 LEU 29 3.244 -14.977 -5.803
278 2HD2 LEU 29 2HD2 LEU 29 3.676 -14.559 -4.132
279 3HD2 LEU 29 3HD2 LEU 29 4.950 -14.892 -5.319
280 H ALA 30 H ALA 30 -0.339 -17.201 -2.019
281 HA ALA 30 HA ALA 30 -1.275 -14.830 -3.177
282 1HB ALA 30 1HB ALA 30 -2.582 -16.958 -3.157
283 2HB ALA 30 2HB ALA 30 -2.718 -16.854 -1.394
284 3HB ALA 30 3HB ALA 30 -3.491 -15.624 -2.415
285 H LYS 31 H LYS 31 -0.348 -16.086 -0.027
286 HA LYS 31 HA LYS 31 -1.803 -14.075 1.603
287 1HB LYS 31 1HB LYS 31 0.240 -16.249 2.198
288 2HB LYS 31 2HB LYS 31 -0.403 -15.173 3.449
289 1HG LYS 31 1HG LYS 31 -2.564 -15.996 3.291
290 2HG LYS 31 2HG LYS 31 -2.386 -16.544 1.623
291 1HD LYS 31 1HD LYS 31 -1.022 -18.420 2.257
292 2HD LYS 31 2HD LYS 31 -0.972 -17.892 3.956
293 1HE LYS 31 1HE LYS 31 -3.390 -18.207 4.178
294 2HE LYS 31 2HE LYS 31 -3.556 -18.539 2.444
295 1HZ LYS 31 1HZ LYS 31 -2.277 -20.508 2.731
296 2HZ LYS 31 2HZ LYS 31 -2.062 -20.208 4.339
297 3HZ LYS 31 3HZ LYS 31 -3.569 -20.524 3.752
298 H ILE 32 H ILE 32 1.245 -14.679 0.488
299 HA ILE 32 HA ILE 32 2.967 -12.550 1.474
300 HB ILE 32 HB ILE 32 3.035 -14.370 -0.938
301 1HG1 ILE 32 1HG1 ILE 32 4.993 -13.769 1.320
302 2HG1 ILE 32 2HG1 ILE 32 3.912 -15.162 1.197
303 1HG2 ILE 32 1HG2 ILE 32 3.788 -12.169 -1.903
304 2HG2 ILE 32 2HG2 ILE 32 5.064 -12.129 -0.677
305 3HG2 ILE 32 3HG2 ILE 32 5.009 -13.402 -1.898
306 1HD1 ILE 32 1HD1 ILE 32 5.164 -15.764 -0.978
307 2HD1 ILE 32 2HD1 ILE 32 6.360 -14.528 -0.509
308 3HD1 ILE 32 3HD1 ILE 32 6.058 -15.905 0.542
309 H LEU 33 H LEU 33 1.175 -12.979 -1.655
310 HA LEU 33 HA LEU 33 1.733 -10.256 -2.316
311 1HB LEU 33 1HB LEU 33 0.777 -10.805 -4.376
312 2HB LEU 33 2HB LEU 33 1.321 -12.366 -3.769
313 HG LEU 33 HG LEU 33 -0.984 -12.787 -3.030
314 1HD1 LEU 33 1HD1 LEU 33 -2.302 -10.963 -2.895
315 2HD1 LEU 33 2HD1 LEU 33 -1.347 -10.058 -4.097
316 3HD1 LEU 33 3HD1 LEU 33 -2.546 -11.264 -4.620
317 1HD2 LEU 33 1HD2 LEU 33 -0.521 -12.192 -5.966
318 2HD2 LEU 33 2HD2 LEU 33 0.099 -13.625 -5.114
319 3HD2 LEU 33 3HD2 LEU 33 -1.648 -13.404 -5.307
320 H GLU 34 H GLU 34 -0.978 -11.681 -0.606
321 HA GLU 34 HA GLU 34 -2.576 -9.335 -0.569
322 1HB GLU 34 1HB GLU 34 -3.047 -11.762 0.246
323 2HB GLU 34 2HB GLU 34 -2.308 -11.268 1.762
324 1HG GLU 34 1HG GLU 34 -3.993 -9.474 2.001
325 2HG GLU 34 2HG GLU 34 -4.689 -9.903 0.427
326 H ASP 35 H ASP 35 -0.039 -10.507 1.627
327 HA ASP 35 HA ASP 35 -0.085 -8.351 3.459
328 1HB ASP 35 1HB ASP 35 1.125 -10.563 3.749
329 2HB ASP 35 2HB ASP 35 2.373 -9.951 2.655
330 H GLU 36 H GLU 36 1.944 -8.833 0.528
331 HA GLU 36 HA GLU 36 3.231 -6.312 0.560
332 1HB GLU 36 1HB GLU 36 2.381 -7.949 -1.856
333 2HB GLU 36 2HB GLU 36 3.562 -6.628 -1.844
334 1HG GLU 36 1HG GLU 36 3.935 -9.193 -0.227
335 2HG GLU 36 2HG GLU 36 4.556 -8.939 -1.851
336 H GLU 37 H GLU 37 0.083 -7.259 -1.066
337 HA GLU 37 HA GLU 37 -0.675 -4.824 -2.001
338 1HB GLU 37 1HB GLU 37 -1.862 -7.299 -1.677
339 2HB GLU 37 2HB GLU 37 -2.840 -6.342 -0.584
340 1HG GLU 37 1HG GLU 37 -2.259 -5.369 -3.396
341 2HG GLU 37 2HG GLU 37 -3.358 -6.717 -3.123
342 H LYS 38 H LYS 38 -1.113 -5.962 1.374
343 HA LYS 38 HA LYS 38 -2.364 -3.566 2.319
344 1HB LYS 38 1HB LYS 38 -2.223 -5.906 3.406
345 2HB LYS 38 2HB LYS 38 -0.559 -5.520 3.799
346 1HG LYS 38 1HG LYS 38 -1.459 -5.030 5.769
347 2HG LYS 38 2HG LYS 38 -1.590 -3.424 5.063
348 1HD LYS 38 1HD LYS 38 -3.851 -5.496 4.990
349 2HD LYS 38 2HD LYS 38 -3.605 -4.407 6.357
350 1HE LYS 38 1HE LYS 38 -3.864 -2.431 4.870
351 2HE LYS 38 2HE LYS 38 -4.183 -3.505 3.500
352 1HZ LYS 38 1HZ LYS 38 -6.083 -4.327 4.609
353 2HZ LYS 38 2HZ LYS 38 -5.797 -3.389 5.936
354 3HZ LYS 38 3HZ LYS 38 -6.162 -2.685 4.490
355 H HIS 39 H HIS 39 1.086 -4.526 2.250
356 HA HIS 39 HA HIS 39 2.060 -2.098 3.393
357 1HB HIS 39 1HB HIS 39 3.249 -4.284 1.689
358 2HB HIS 39 2HB HIS 39 4.123 -2.784 1.866
359 HD1 HIS 39 HD1 HIS 39 4.621 -2.050 4.518
360 HD2 HIS 39 HD2 HIS 39 3.357 -5.984 3.758
361 HE1 HIS 39 HE1 HIS 39 5.066 -3.375 6.668
362 HE2 HIS 39 HE2 HIS 39 4.341 -5.798 6.161
363 H ILE 40 H ILE 40 1.172 -2.876 0.047
364 HA ILE 40 HA ILE 40 2.225 -0.416 -1.061
365 HB ILE 40 HB ILE 40 0.379 -2.511 -2.221
366 1HG1 ILE 40 1HG1 ILE 40 3.273 -2.119 -3.007
367 2HG1 ILE 40 2HG1 ILE 40 2.962 -3.023 -1.552
368 1HG2 ILE 40 1HG2 ILE 40 0.209 -0.394 -3.535
369 2HG2 ILE 40 2HG2 ILE 40 1.979 -0.311 -3.614
370 3HG2 ILE 40 3HG2 ILE 40 1.098 -1.604 -4.445
371 1HD1 ILE 40 1HD1 ILE 40 1.535 -4.588 -2.739
372 2HD1 ILE 40 2HD1 ILE 40 1.738 -3.699 -4.241
373 3HD1 ILE 40 3HD1 ILE 40 3.147 -4.484 -3.478
374 H GLU 41 H GLU 41 -0.903 -1.575 0.148
375 HA GLU 41 HA GLU 41 -2.646 0.392 -0.785
376 1HB GLU 41 1HB GLU 41 -3.268 -1.747 0.386
377 2HB GLU 41 2HB GLU 41 -2.649 -1.062 1.892
378 1HG GLU 41 1HG GLU 41 -4.470 0.865 0.852
379 2HG GLU 41 2HG GLU 41 -5.223 -0.716 0.615
380 H TRP 42 H TRP 42 -0.451 0.243 2.067
381 HA TRP 42 HA TRP 42 -1.062 2.591 3.342
382 1HB TRP 42 1HB TRP 42 0.740 0.739 3.712
383 2HB TRP 42 2HB TRP 42 1.790 1.782 2.769
384 HD1 TRP 42 HD1 TRP 42 0.008 1.606 6.104
385 HE1 TRP 42 HE1 TRP 42 0.936 3.426 7.678
386 HE3 TRP 42 HE3 TRP 42 2.772 4.113 2.733
387 HZ2 TRP 42 HZ2 TRP 42 2.779 5.699 7.453
388 HZ3 TRP 42 HZ3 TRP 42 4.043 6.195 3.367
389 HH2 TRP 42 HH2 TRP 42 4.059 6.952 5.740
390 H LEU 43 H LEU 43 0.714 2.203 0.300
391 HA LEU 43 HA LEU 43 1.383 5.064 0.114
392 1HB LEU 43 1HB LEU 43 1.827 2.857 -1.910
393 2HB LEU 43 2HB LEU 43 2.359 4.543 -1.999
394 HG LEU 43 HG LEU 43 3.427 3.812 0.442
395 1HD1 LEU 43 1HD1 LEU 43 2.759 1.452 0.103
396 2HD1 LEU 43 2HD1 LEU 43 3.626 1.413 -1.445
397 3HD1 LEU 43 3HD1 LEU 43 4.523 1.603 0.076
398 1HD2 LEU 43 1HD2 LEU 43 4.542 3.549 -2.347
399 2HD2 LEU 43 2HD2 LEU 43 4.644 4.999 -1.337
400 3HD2 LEU 43 3HD2 LEU 43 5.574 3.546 -0.898
401 H GLU 44 H GLU 44 -0.908 2.708 -1.342
402 HA GLU 44 HA GLU 44 -2.206 4.860 -2.924
403 1HB GLU 44 1HB GLU 44 -3.051 1.974 -2.457
404 2HB GLU 44 2HB GLU 44 -3.863 3.146 -3.492
405 1HG GLU 44 1HG GLU 44 -1.232 3.334 -4.334
406 2HG GLU 44 2HG GLU 44 -1.397 1.602 -4.020
407 H THR 45 H THR 45 -1.954 5.438 -0.171
408 HA THR 45 HA THR 45 -4.701 6.203 0.333
409 HB THR 45 HB THR 45 -4.086 3.739 1.204
410 HG1 THR 45 HG1 THR 45 -6.119 4.617 1.231
411 1HG2 THR 45 1HG2 THR 45 -2.399 4.378 2.744
412 2HG2 THR 45 2HG2 THR 45 -3.576 5.300 3.702
413 3HG2 THR 45 3HG2 THR 45 -3.737 3.529 3.503
414 H ILE 46 H ILE 46 -1.333 6.055 1.345
415 HA ILE 46 HA ILE 46 -1.425 8.157 3.172
416 HB ILE 46 HB ILE 46 0.594 6.801 2.649
417 1HG1 ILE 46 1HG1 ILE 46 2.252 8.646 3.037
418 2HG1 ILE 46 2HG1 ILE 46 0.915 9.804 2.916
419 1HG2 ILE 46 1HG2 ILE 46 0.566 7.332 0.123
420 2HG2 ILE 46 2HG2 ILE 46 1.375 8.840 0.578
421 3HG2 ILE 46 3HG2 ILE 46 2.124 7.286 0.971
422 1HD1 ILE 46 1HD1 ILE 46 -0.193 8.739 4.832
423 2HD1 ILE 46 2HD1 ILE 46 0.991 7.412 4.808
424 3HD1 ILE 46 3HD1 ILE 46 1.503 9.058 5.249
425 H LEU 47 H LEU 47 -2.851 9.693 2.757
426 HA LEU 47 HA LEU 47 -3.705 11.675 2.148
427 1HB LEU 47 1HB LEU 47 -1.119 12.018 0.605
428 2HB LEU 47 2HB LEU 47 -2.496 12.995 0.170
429 HG LEU 47 HG LEU 47 -0.918 14.069 1.712
430 1HD1 LEU 47 1HD1 LEU 47 -3.266 14.822 1.517
431 2HD1 LEU 47 2HD1 LEU 47 -3.713 13.790 2.891
432 3HD1 LEU 47 3HD1 LEU 47 -2.575 15.127 3.118
433 1HD2 LEU 47 1HD2 LEU 47 -1.970 12.172 3.850
434 2HD2 LEU 47 2HD2 LEU 47 -0.351 12.101 3.115
435 3HD2 LEU 47 3HD2 LEU 47 -0.835 13.517 4.068
436 H GLY 48 H GLY 48 -4.851 12.666 0.228
437 1HA GLY 48 1HA GLY 48 -5.293 11.102 -2.114
438 2HA GLY 48 2HA GLY 48 -6.525 10.756 -0.872
439 1HN NH2 49 1HN NH2 49 -7.513 11.934 -3.106
440 2HN NH2 49 2HN NH2 49 -7.837 13.667 -2.833
441 1H ACE 0 H1 ACE 0 13.426 -18.555 -14.979
442 2H ACE 0 H2 ACE 0 12.209 -19.169 -16.120
443 3H ACE 0 H3 ACE 0 13.650 -18.319 -16.724
444 H ASP 1 H ASP 1 11.333 -17.394 -17.641
445 HA ASP 1 HA ASP 1 11.593 -14.720 -17.278
446 1HB ASP 1 1HB ASP 1 10.427 -15.771 -19.181
447 2HB ASP 1 2HB ASP 1 9.028 -16.120 -18.146
448 H TYR 2 H TYR 2 8.785 -16.495 -15.891
449 HA TYR 2 HA TYR 2 7.512 -14.752 -14.201
450 1HB TYR 2 1HB TYR 2 8.485 -17.629 -13.844
451 2HB TYR 2 2HB TYR 2 7.471 -16.801 -12.689
452 HD1 TYR 2 HD1 TYR 2 7.594 -18.084 -16.154
453 HD2 TYR 2 HD2 TYR 2 5.144 -16.586 -12.986
454 HE1 TYR 2 HE1 TYR 2 5.560 -18.807 -17.373
455 HE2 TYR 2 HE2 TYR 2 3.092 -17.203 -14.273
456 HH TYR 2 HH TYR 2 3.282 -18.490 -17.596
457 H LEU 3 H LEU 3 10.544 -16.539 -13.412
458 HA LEU 3 HA LEU 3 10.631 -15.301 -10.835
459 1HB LEU 3 1HB LEU 3 12.925 -16.647 -12.369
460 2HB LEU 3 2HB LEU 3 12.908 -16.313 -10.639
461 HG LEU 3 HG LEU 3 11.041 -18.269 -12.065
462 1HD1 LEU 3 1HD1 LEU 3 13.396 -19.008 -12.081
463 2HD1 LEU 3 2HD1 LEU 3 13.497 -18.755 -10.325
464 3HD1 LEU 3 3HD1 LEU 3 12.423 -20.004 -10.987
465 1HD2 LEU 3 1HD2 LEU 3 11.493 -17.696 -9.096
466 2HD2 LEU 3 2HD2 LEU 3 10.003 -17.375 -10.013
467 3HD2 LEU 3 3HD2 LEU 3 10.533 -19.040 -9.746
468 H ARG 4 H ARG 4 12.431 -14.698 -13.839
469 HA ARG 4 HA ARG 4 13.839 -12.440 -12.770
470 1HB ARG 4 1HB ARG 4 12.988 -13.008 -15.637
471 2HB ARG 4 2HB ARG 4 14.094 -11.730 -15.105
472 1HG ARG 4 1HG ARG 4 15.497 -13.567 -13.983
473 2HG ARG 4 2HG ARG 4 14.512 -14.739 -14.876
474 1HD ARG 4 1HD ARG 4 15.204 -13.659 -17.012
475 2HD ARG 4 2HD ARG 4 16.163 -12.479 -16.081
476 HE ARG 4 HE ARG 4 16.873 -15.188 -15.408
477 1HH1 ARG 4 1HH2 ARG 4 17.310 -12.746 -17.907
478 2HH1 ARG 4 2HH2 ARG 4 18.883 -13.307 -18.402
479 1HH2 ARG 4 1HH1 ARG 4 18.899 -15.977 -16.049
480 2HH2 ARG 4 2HH1 ARG 4 19.801 -15.218 -17.329
481 H GLU 5 H GLU 5 10.444 -12.831 -13.493
482 HA GLU 5 HA GLU 5 10.062 -9.928 -14.030
483 1HB GLU 5 1HB GLU 5 8.139 -12.279 -13.882
484 2HB GLU 5 2HB GLU 5 7.598 -10.605 -13.967
485 1HG GLU 5 1HG GLU 5 8.684 -10.248 -16.087
486 2HG GLU 5 2HG GLU 5 9.513 -11.801 -16.010
487 H LEU 6 H LEU 6 8.735 -12.269 -11.648
488 HA LEU 6 HA LEU 6 8.008 -10.278 -9.724
489 1HB LEU 6 1HB LEU 6 8.458 -13.260 -9.523
490 2HB LEU 6 2HB LEU 6 7.883 -12.244 -8.199
491 HG LEU 6 HG LEU 6 5.715 -11.818 -9.314
492 1HD1 LEU 6 1HD1 LEU 6 6.445 -11.783 -11.685
493 2HD1 LEU 6 2HD1 LEU 6 6.695 -13.546 -11.605
494 3HD1 LEU 6 3HD1 LEU 6 5.089 -12.840 -11.354
495 1HD2 LEU 6 1HD2 LEU 6 6.434 -14.763 -9.525
496 2HD2 LEU 6 2HD2 LEU 6 6.457 -13.938 -7.966
497 3HD2 LEU 6 3HD2 LEU 6 4.973 -13.994 -8.853
498 H LEU 7 H LEU 7 11.164 -11.224 -10.640
499 HA LEU 7 HA LEU 7 12.223 -10.531 -8.024
500 1HB LEU 7 1HB LEU 7 13.146 -12.581 -8.921
501 2HB LEU 7 2HB LEU 7 13.623 -11.740 -10.414
502 HG LEU 7 HG LEU 7 15.240 -10.375 -9.238
503 1HD1 LEU 7 1HD1 LEU 7 14.232 -10.000 -7.068
504 2HD1 LEU 7 2HD1 LEU 7 14.186 -11.739 -6.725
505 3HD1 LEU 7 3HD1 LEU 7 15.740 -10.874 -6.806
506 1HD2 LEU 7 1HD2 LEU 7 15.468 -13.300 -8.439
507 2HD2 LEU 7 2HD2 LEU 7 15.847 -12.645 -10.044
508 3HD2 LEU 7 3HD2 LEU 7 16.803 -12.137 -8.644
509 H LYS 8 H LYS 8 12.962 -9.761 -11.520
510 HA LYS 8 HA LYS 8 14.585 -7.625 -10.704
511 1HB LYS 8 1HB LYS 8 13.379 -8.187 -13.436
512 2HB LYS 8 2HB LYS 8 14.521 -6.892 -13.084
513 1HG LYS 8 1HG LYS 8 16.197 -8.478 -12.278
514 2HG LYS 8 2HG LYS 8 15.115 -9.846 -12.609
515 1HD LYS 8 1HD LYS 8 15.151 -9.436 -14.971
516 2HD LYS 8 2HD LYS 8 15.875 -7.833 -14.770
517 1HE LYS 8 1HE LYS 8 17.968 -8.809 -13.941
518 2HE LYS 8 2HE LYS 8 17.292 -10.444 -14.059
519 1HZ LYS 8 1HZ LYS 8 17.112 -10.141 -16.408
520 2HZ LYS 8 2HZ LYS 8 17.667 -8.592 -16.310
521 3HZ LYS 8 3HZ LYS 8 18.663 -9.849 -15.934
522 H LEU 9 H LEU 9 11.149 -7.835 -11.609
523 HA LEU 9 HA LEU 9 10.782 -4.941 -11.775
524 1HB LEU 9 1HB LEU 9 8.767 -7.157 -11.279
525 2HB LEU 9 2HB LEU 9 8.377 -5.462 -11.529
526 HG LEU 9 HG LEU 9 9.947 -6.964 -13.637
527 1HD1 LEU 9 1HD1 LEU 9 7.864 -8.220 -13.266
528 2HD1 LEU 9 2HD1 LEU 9 6.918 -6.726 -13.394
529 3HD1 LEU 9 3HD1 LEU 9 7.805 -7.347 -14.804
530 1HD2 LEU 9 1HD2 LEU 9 8.105 -4.520 -13.719
531 2HD2 LEU 9 2HD2 LEU 9 9.875 -4.452 -13.760
532 3HD2 LEU 9 3HD2 LEU 9 8.991 -5.201 -15.093
533 H GLU 10 H GLU 10 10.900 -7.352 -9.178
534 HA GLU 10 HA GLU 10 9.778 -5.486 -7.203
535 1HB GLU 10 1HB GLU 10 11.389 -8.089 -6.991
536 2HB GLU 10 2HB GLU 10 10.880 -7.116 -5.648
537 1HG GLU 10 1HG GLU 10 8.952 -8.410 -7.627
538 2HG GLU 10 2HG GLU 10 9.450 -9.131 -6.096
539 H LEU 11 H LEU 11 13.019 -6.616 -8.115
540 HA LEU 11 HA LEU 11 14.466 -5.264 -6.155
541 1HB LEU 11 1HB LEU 11 15.248 -7.052 -7.872
542 2HB LEU 11 2HB LEU 11 15.469 -5.706 -8.990
543 HG LEU 11 HG LEU 11 16.877 -4.678 -6.949
544 1HD1 LEU 11 1HD1 LEU 11 16.275 -6.538 -5.374
545 2HD1 LEU 11 2HD1 LEU 11 17.086 -7.686 -6.455
546 3HD1 LEU 11 3HD1 LEU 11 18.022 -6.417 -5.641
547 1HD2 LEU 11 1HD2 LEU 11 17.907 -6.912 -8.743
548 2HD2 LEU 11 2HD2 LEU 11 17.811 -5.183 -9.150
549 3HD2 LEU 11 3HD2 LEU 11 18.911 -5.730 -7.873
550 H GLN 12 H GLN 12 13.542 -4.175 -9.431
551 HA GLN 12 HA GLN 12 14.857 -1.659 -9.455
552 1HB GLN 12 1HB GLN 12 12.313 -2.716 -10.734
553 2HB GLN 12 2HB GLN 12 12.879 -1.066 -11.022
554 1HG GLN 12 1HG GLN 12 14.947 -1.784 -11.970
555 2HG GLN 12 2HG GLN 12 14.699 -3.463 -11.469
556 1HE2 GLN 12 2HE2 GLN 12 12.655 -4.487 -12.322
557 2HE2 GLN 12 1HE2 GLN 12 12.228 -4.164 -14.006
558 H LEU 13 H LEU 13 11.688 -2.595 -8.104
559 HA LEU 13 HA LEU 13 10.791 0.030 -7.520
560 1HB LEU 13 1HB LEU 13 9.980 -2.587 -6.197
561 2HB LEU 13 2HB LEU 13 9.215 -1.030 -6.006
562 HG LEU 13 HG LEU 13 8.783 -3.061 -7.967
563 1HD1 LEU 13 1HD1 LEU 13 7.144 -1.701 -6.607
564 2HD1 LEU 13 2HD1 LEU 13 7.461 -0.320 -7.650
565 3HD1 LEU 13 3HD1 LEU 13 6.733 -1.807 -8.320
566 1HD2 LEU 13 1HD2 LEU 13 9.282 -0.325 -9.249
567 2HD2 LEU 13 2HD2 LEU 13 10.200 -1.795 -9.619
568 3HD2 LEU 13 3HD2 LEU 13 8.505 -1.725 -10.020
569 H ILE 14 H ILE 14 12.317 -2.523 -5.482
570 HA ILE 14 HA ILE 14 12.492 -0.907 -3.124
571 HB ILE 14 HB ILE 14 13.910 -3.348 -4.155
572 1HG1 ILE 14 1HG1 ILE 14 12.981 -4.337 -2.154
573 2HG1 ILE 14 2HG1 ILE 14 12.555 -2.758 -1.484
574 1HG2 ILE 14 1HG2 ILE 14 15.810 -2.200 -3.132
575 2HG2 ILE 14 2HG2 ILE 14 14.839 -1.840 -1.685
576 3HG2 ILE 14 3HG2 ILE 14 15.260 -3.510 -2.087
577 1HD1 ILE 14 1HD1 ILE 14 10.810 -2.447 -3.172
578 2HD1 ILE 14 2HD1 ILE 14 11.334 -3.926 -4.014
579 3HD1 ILE 14 3HD1 ILE 14 10.619 -4.010 -2.397
580 H LYS 15 H LYS 15 14.662 -0.920 -6.012
581 HA LYS 15 HA LYS 15 16.414 1.053 -4.885
582 1HB LYS 15 1HB LYS 15 16.097 -0.519 -7.314
583 2HB LYS 15 2HB LYS 15 16.194 1.160 -7.742
584 1HG LYS 15 1HG LYS 15 18.416 0.129 -7.716
585 2HG LYS 15 2HG LYS 15 18.335 1.313 -6.397
586 1HD LYS 15 1HD LYS 15 17.872 -0.554 -4.778
587 2HD LYS 15 2HD LYS 15 17.895 -1.714 -6.109
588 1HE LYS 15 1HE LYS 15 20.259 -1.280 -6.519
589 2HE LYS 15 2HE LYS 15 20.258 0.091 -5.392
590 1HZ LYS 15 1HZ LYS 15 19.812 -1.418 -3.616
591 2HZ LYS 15 2HZ LYS 15 19.780 -2.707 -4.641
592 3HZ LYS 15 3HZ LYS 15 21.181 -1.871 -4.410
593 H GLN 16 H GLN 16 13.399 1.288 -6.869
594 HA GLN 16 HA GLN 16 13.621 4.173 -7.180
595 1HB GLN 16 1HB GLN 16 11.377 2.176 -7.511
596 2HB GLN 16 2HB GLN 16 11.000 3.889 -7.397
597 1HG GLN 16 1HG GLN 16 11.139 3.329 -9.696
598 2HG GLN 16 2HG GLN 16 12.470 4.412 -9.297
599 1HE2 GLN 16 2HE2 GLN 16 14.670 3.373 -9.024
600 2HE2 GLN 16 1HE2 GLN 16 14.980 1.898 -9.931
601 H TYR 17 H TYR 17 12.285 2.103 -4.699
602 HA TYR 17 HA TYR 17 10.866 4.063 -3.190
603 1HB TYR 17 1HB TYR 17 11.895 1.263 -2.811
604 2HB TYR 17 2HB TYR 17 11.749 2.188 -1.358
605 HD1 TYR 17 HD1 TYR 17 9.745 2.277 -0.157
606 HD2 TYR 17 HD2 TYR 17 9.665 1.236 -4.343
607 HE1 TYR 17 HE1 TYR 17 7.475 1.334 0.115
608 HE2 TYR 17 HE2 TYR 17 7.355 0.438 -4.086
609 HH TYR 17 HH TYR 17 5.483 0.602 -2.645
610 H ARG 18 H ARG 18 14.251 3.117 -3.334
611 HA ARG 18 HA ARG 18 14.947 4.599 -0.883
612 1HB ARG 18 1HB ARG 18 16.605 3.209 -3.019
613 2HB ARG 18 2HB ARG 18 17.316 4.363 -1.880
614 1HG ARG 18 1HG ARG 18 16.370 3.052 0.024
615 2HG ARG 18 2HG ARG 18 15.838 1.813 -1.127
616 1HD ARG 18 1HD ARG 18 18.166 1.343 -1.749
617 2HD ARG 18 2HD ARG 18 18.724 2.797 -0.920
618 HE ARG 18 HE ARG 18 18.758 1.755 1.076
619 1HH1 ARG 18 1HH2 ARG 18 16.784 -0.174 -1.117
620 2HH1 ARG 18 2HH2 ARG 18 16.661 -1.543 -0.049
621 1HH2 ARG 18 1HH1 ARG 18 18.550 0.025 2.529
622 2HH2 ARG 18 2HH1 ARG 18 17.668 -1.411 2.093
623 H GLU 19 H GLU 19 15.119 4.996 -4.345
624 HA GLU 19 HA GLU 19 16.278 7.558 -4.473
625 1HB GLU 19 1HB GLU 19 15.514 5.849 -6.364
626 2HB GLU 19 2HB GLU 19 14.027 6.812 -6.330
627 1HG GLU 19 1HG GLU 19 15.563 8.867 -6.589
628 2HG GLU 19 2HG GLU 19 16.862 7.726 -6.945
629 H ALA 20 H ALA 20 12.833 6.605 -4.007
630 HA ALA 20 HA ALA 20 12.013 9.460 -3.931
631 1HB ALA 20 1HB ALA 20 10.657 7.571 -4.981
632 2HB ALA 20 2HB ALA 20 10.290 7.038 -3.354
633 3HB ALA 20 3HB ALA 20 9.767 8.641 -3.907
634 H LEU 21 H LEU 21 12.785 6.982 -1.540
635 HA LEU 21 HA LEU 21 11.616 7.747 0.719
636 1HB LEU 21 1HB LEU 21 13.474 5.997 0.325
637 2HB LEU 21 2HB LEU 21 14.633 7.271 0.642
638 HG LEU 21 HG LEU 21 14.376 5.824 2.521
639 1HD1 LEU 21 1HD1 LEU 21 14.633 8.279 3.071
640 2HD1 LEU 21 2HD1 LEU 21 12.878 8.297 3.418
641 3HD1 LEU 21 3HD1 LEU 21 13.952 7.250 4.344
642 1HD2 LEU 21 1HD2 LEU 21 11.428 6.491 2.483
643 2HD2 LEU 21 2HD2 LEU 21 12.162 4.902 2.146
644 3HD2 LEU 21 3HD2 LEU 21 12.234 5.615 3.775
645 H GLU 22 H GLU 22 14.504 9.407 -0.531
646 HA GLU 22 HA GLU 22 14.787 11.131 1.770
647 1HB GLU 22 1HB GLU 22 15.990 11.228 -1.036
648 2HB GLU 22 2HB GLU 22 16.425 12.347 0.262
649 1HG GLU 22 1HG GLU 22 16.728 9.313 0.482
650 2HG GLU 22 2HG GLU 22 18.018 10.427 0.018
651 H TYR 23 H TYR 23 13.177 11.405 -1.356
652 HA TYR 23 HA TYR 23 12.612 14.262 -1.083
653 1HB TYR 23 1HB TYR 23 12.091 12.076 -3.026
654 2HB TYR 23 2HB TYR 23 10.756 13.175 -2.852
655 HD1 TYR 23 HD1 TYR 23 14.465 13.069 -3.412
656 HD2 TYR 23 HD2 TYR 23 10.822 15.313 -3.945
657 HE1 TYR 23 HE1 TYR 23 15.627 14.580 -4.989
658 HE2 TYR 23 HE2 TYR 23 11.993 16.830 -5.523
659 HH TYR 23 HH TYR 23 15.407 16.347 -6.439
660 H VAL 24 H VAL 24 11.058 11.179 -0.284
661 HA VAL 24 HA VAL 24 8.552 12.521 0.429
662 HB VAL 24 HB VAL 24 9.448 9.644 0.709
663 1HG1 VAL 24 1HG1 VAL 24 7.620 10.043 2.286
664 2HG1 VAL 24 2HG1 VAL 24 6.707 10.953 1.068
665 3HG1 VAL 24 3HG1 VAL 24 6.952 9.208 0.881
666 1HG2 VAL 24 1HG2 VAL 24 7.644 11.054 -1.310
667 2HG2 VAL 24 2HG2 VAL 24 9.269 10.480 -1.662
668 3HG2 VAL 24 3HG2 VAL 24 8.003 9.313 -1.281
669 H LYS 25 H LYS 25 11.373 11.433 2.220
670 HA LYS 25 HA LYS 25 11.921 11.399 4.409
671 1HB LYS 25 1HB LYS 25 10.401 14.033 4.334
672 2HB LYS 25 2HB LYS 25 11.367 13.461 5.698
673 1HG LYS 25 1HG LYS 25 13.093 13.129 3.515
674 2HG LYS 25 2HG LYS 25 12.282 14.648 3.159
675 1HD LYS 25 1HD LYS 25 13.675 13.901 5.787
676 2HD LYS 25 2HD LYS 25 14.401 14.876 4.501
677 1HE LYS 25 1HE LYS 25 12.752 16.648 4.807
678 2HE LYS 25 2HE LYS 25 11.844 15.686 5.984
679 1HZ LYS 25 1HZ LYS 25 13.724 15.740 7.429
680 2HZ LYS 25 2HZ LYS 25 14.599 16.624 6.346
681 3HZ LYS 25 3HZ LYS 25 13.254 17.272 7.047
682 H LEU 26 H LEU 26 10.290 9.495 4.312
683 HA LEU 26 HA LEU 26 8.910 9.720 6.928
684 1HB LEU 26 1HB LEU 26 7.646 9.159 4.366
685 2HB LEU 26 2HB LEU 26 7.446 7.788 5.455
686 HG LEU 26 HG LEU 26 6.799 10.609 6.366
687 1HD1 LEU 26 1HD1 LEU 26 5.534 10.337 4.334
688 2HD1 LEU 26 2HD1 LEU 26 5.060 8.689 4.767
689 3HD1 LEU 26 3HD1 LEU 26 4.425 10.068 5.690
690 1HD2 LEU 26 1HD2 LEU 26 5.250 9.374 7.876
691 2HD2 LEU 26 2HD2 LEU 26 5.763 7.836 7.164
692 3HD2 LEU 26 3HD2 LEU 26 6.909 8.808 8.099
693 HA PRO 27 HA PRO 27 11.903 6.310 7.141
694 1HB PRO 27 1HB PRO 27 11.381 5.412 9.696
695 2HB PRO 27 2HB PRO 27 12.376 6.847 9.324
696 1HG PRO 27 1HG PRO 27 9.442 6.778 10.074
697 2HG PRO 27 2HG PRO 27 10.719 7.830 10.747
698 1HD PRO 27 1HD PRO 27 9.058 8.717 8.835
699 2HD PRO 27 2HD PRO 27 10.787 9.154 8.755
700 H VAL 28 H VAL 28 8.423 6.122 7.828
701 HA VAL 28 HA VAL 28 8.085 3.367 7.945
702 HB VAL 28 HB VAL 28 6.223 5.341 6.681
703 1HG1 VAL 28 1HG1 VAL 28 5.523 3.099 6.134
704 2HG1 VAL 28 2HG1 VAL 28 5.847 2.522 7.783
705 3HG1 VAL 28 3HG1 VAL 28 4.498 3.622 7.474
706 1HG2 VAL 28 1HG2 VAL 28 6.450 4.385 9.570
707 2HG2 VAL 28 2HG2 VAL 28 6.777 6.035 8.999
708 3HG2 VAL 28 3HG2 VAL 28 5.137 5.391 8.927
709 H LEU 29 H LEU 29 8.564 5.399 4.989
710 HA LEU 29 HA LEU 29 7.923 3.401 3.076
711 1HB LEU 29 1HB LEU 29 9.477 5.978 3.192
712 2HB LEU 29 2HB LEU 29 9.799 4.845 1.883
713 HG LEU 29 HG LEU 29 7.352 4.841 1.361
714 1HD1 LEU 29 1HD1 LEU 29 6.482 5.758 3.496
715 2HD1 LEU 29 2HD1 LEU 29 7.353 7.276 3.173
716 3HD1 LEU 29 3HD1 LEU 29 6.022 6.778 2.116
717 1HD2 LEU 29 1HD2 LEU 29 8.863 7.490 1.216
718 2HD2 LEU 29 2HD2 LEU 29 9.082 6.137 0.101
719 3HD2 LEU 29 3HD2 LEU 29 7.535 7.004 0.138
720 H ALA 30 H ALA 30 10.970 4.240 4.860
721 HA ALA 30 HA ALA 30 12.479 2.351 3.442
722 1HB ALA 30 1HB ALA 30 13.626 4.108 4.697
723 2HB ALA 30 2HB ALA 30 12.981 3.474 6.230
724 3HB ALA 30 3HB ALA 30 14.133 2.522 5.283
725 H LYS 31 H LYS 31 10.348 2.173 6.223
726 HA LYS 31 HA LYS 31 11.242 -0.447 7.117
727 1HB LYS 31 1HB LYS 31 9.865 1.396 8.404
728 2HB LYS 31 2HB LYS 31 8.464 0.688 7.579
729 1HG LYS 31 1HG LYS 31 9.246 -1.578 8.539
730 2HG LYS 31 2HG LYS 31 10.385 -0.636 9.518
731 1HD LYS 31 1HD LYS 31 8.309 0.740 10.295
732 2HD LYS 31 2HD LYS 31 7.331 -0.481 9.469
733 1HE LYS 31 1HE LYS 31 7.415 -1.098 11.789
734 2HE LYS 31 2HE LYS 31 8.437 -2.252 10.916
735 1HZ LYS 31 1HZ LYS 31 10.343 -0.960 11.604
736 2HZ LYS 31 2HZ LYS 31 9.378 0.117 12.392
737 3HZ LYS 31 3HZ LYS 31 9.473 -1.443 12.916
738 H ILE 32 H ILE 32 8.973 0.766 4.765
739 HA ILE 32 HA ILE 32 7.516 -1.759 4.473
740 HB ILE 32 HB ILE 32 7.455 0.756 2.741
741 1HG1 ILE 32 1HG1 ILE 32 5.231 -0.268 4.545
742 2HG1 ILE 32 2HG1 ILE 32 6.440 0.826 5.177
743 1HG2 ILE 32 1HG2 ILE 32 6.839 -1.152 1.389
744 2HG2 ILE 32 2HG2 ILE 32 5.970 -1.898 2.735
745 3HG2 ILE 32 3HG2 ILE 32 5.292 -0.481 1.921
746 1HD1 ILE 32 1HD1 ILE 32 5.836 2.531 3.513
747 2HD1 ILE 32 2HD1 ILE 32 4.662 1.436 2.764
748 3HD1 ILE 32 3HD1 ILE 32 4.405 2.000 4.413
749 H LEU 33 H LEU 33 9.969 0.170 2.689
750 HA LEU 33 HA LEU 33 10.350 -1.757 0.559
751 1HB LEU 33 1HB LEU 33 11.831 -0.288 -0.246
752 2HB LEU 33 2HB LEU 33 10.942 0.759 0.857
753 HG LEU 33 HG LEU 33 12.765 0.513 2.504
754 1HD1 LEU 33 1HD1 LEU 33 13.980 -1.440 1.833
755 2HD1 LEU 33 2HD1 LEU 33 14.092 -0.825 0.165
756 3HD1 LEU 33 3HD1 LEU 33 14.981 -0.030 1.499
757 1HD2 LEU 33 1HD2 LEU 33 13.498 1.545 -0.269
758 2HD2 LEU 33 2HD2 LEU 33 12.416 2.416 0.843
759 3HD2 LEU 33 3HD2 LEU 33 14.121 2.174 1.266
760 H GLU 34 H GLU 34 11.794 -1.474 3.811
761 HA GLU 34 HA GLU 34 13.588 -3.633 3.509
762 1HB GLU 34 1HB GLU 34 13.315 -1.940 5.442
763 2HB GLU 34 2HB GLU 34 12.050 -2.972 6.062
764 1HG GLU 34 1HG GLU 34 14.895 -3.924 5.486
765 2HG GLU 34 2HG GLU 34 14.363 -3.303 7.053
766 H ASP 35 H ASP 35 10.274 -3.626 4.805
767 HA ASP 35 HA ASP 35 9.953 -6.378 5.200
768 1HB ASP 35 1HB ASP 35 8.348 -4.527 5.845
769 2HB ASP 35 2HB ASP 35 7.748 -4.528 4.180
770 H GLU 36 H GLU 36 9.099 -4.513 2.277
771 HA GLU 36 HA GLU 36 8.369 -6.607 0.582
772 1HB GLU 36 1HB GLU 36 9.811 -4.040 -0.125
773 2HB GLU 36 2HB GLU 36 8.967 -5.094 -1.264
774 1HG GLU 36 1HG GLU 36 7.422 -3.932 1.083
775 2HG GLU 36 2HG GLU 36 7.813 -2.915 -0.308
776 H GLU 37 H GLU 37 11.758 -5.181 1.050
777 HA GLU 37 HA GLU 37 13.119 -6.745 -0.701
778 1HB GLU 37 1HB GLU 37 13.730 -4.860 1.185
779 2HB GLU 37 2HB GLU 37 14.362 -6.265 2.006
780 1HG GLU 37 1HG GLU 37 14.960 -5.496 -0.903
781 2HG GLU 37 2HG GLU 37 15.814 -4.871 0.502
782 H LYS 38 H LYS 38 12.078 -7.667 2.598
783 HA LYS 38 HA LYS 38 13.366 -10.241 2.533
784 1HB LYS 38 1HB LYS 38 12.520 -9.003 4.570
785 2HB LYS 38 2HB LYS 38 10.879 -9.378 4.047
786 1HG LYS 38 1HG LYS 38 12.145 -11.888 3.943
787 2HG LYS 38 2HG LYS 38 12.901 -11.129 5.344
788 1HD LYS 38 1HD LYS 38 10.701 -10.756 6.369
789 2HD LYS 38 2HD LYS 38 9.877 -11.287 4.886
790 1HE LYS 38 1HE LYS 38 10.827 -13.551 5.113
791 2HE LYS 38 2HE LYS 38 11.694 -13.065 6.581
792 1HZ LYS 38 1HZ LYS 38 9.590 -12.657 7.618
793 2HZ LYS 38 2HZ LYS 38 8.775 -13.068 6.246
794 3HZ LYS 38 3HZ LYS 38 9.652 -14.206 7.056
795 H HIS 39 H HIS 39 10.009 -9.167 1.754
796 HA HIS 39 HA HIS 39 9.031 -11.767 1.040
797 1HB HIS 39 1HB HIS 39 8.173 -8.964 0.322
798 2HB HIS 39 2HB HIS 39 7.422 -10.371 -0.418
799 HD1 HIS 39 HD1 HIS 39 5.247 -10.952 0.793
800 HD2 HIS 39 HD2 HIS 39 8.252 -9.456 3.335
801 HE1 HIS 39 HE1 HIS 39 4.306 -11.043 3.170
802 HE2 HIS 39 HE2 HIS 39 6.091 -9.998 4.685
803 H ILE 40 H ILE 40 11.015 -9.461 -0.753
804 HA ILE 40 HA ILE 40 10.734 -10.877 -3.280
805 HB ILE 40 HB ILE 40 12.696 -8.740 -2.413
806 1HG1 ILE 40 1HG1 ILE 40 10.220 -8.421 -4.125
807 2HG1 ILE 40 2HG1 ILE 40 10.035 -8.297 -2.430
808 1HG2 ILE 40 1HG2 ILE 40 13.466 -9.964 -4.449
809 2HG2 ILE 40 2HG2 ILE 40 11.873 -9.754 -5.192
810 3HG2 ILE 40 3HG2 ILE 40 12.910 -8.352 -4.896
811 1HD1 ILE 40 1HD1 ILE 40 11.533 -6.447 -2.197
812 2HD1 ILE 40 2HD1 ILE 40 12.033 -6.524 -3.883
813 3HD1 ILE 40 3HD1 ILE 40 10.359 -6.090 -3.461
814 H GLU 41 H GLU 41 13.194 -10.686 -0.680
815 HA GLU 41 HA GLU 41 15.096 -12.456 -1.627
816 1HB GLU 41 1HB GLU 41 15.132 -11.052 0.475
817 2HB GLU 41 2HB GLU 41 14.132 -12.261 1.268
818 1HG GLU 41 1HG GLU 41 16.672 -13.180 -0.087
819 2HG GLU 41 2HG GLU 41 16.798 -12.239 1.401
820 H TRP 42 H TRP 42 11.926 -13.119 -0.171
821 HA TRP 42 HA TRP 42 11.875 -15.790 0.305
822 1HB TRP 42 1HB TRP 42 10.136 -13.806 0.374
823 2HB TRP 42 2HB TRP 42 9.615 -14.509 -1.163
824 HD1 TRP 42 HD1 TRP 42 9.181 -14.731 2.452
825 HE1 TRP 42 HE1 TRP 42 7.543 -16.625 3.032
826 HE3 TRP 42 HE3 TRP 42 9.232 -17.055 -2.007
827 HZ2 TRP 42 HZ2 TRP 42 6.734 -19.135 1.788
828 HZ3 TRP 42 HZ3 TRP 42 8.216 -19.361 -2.272
829 HH2 TRP 42 HH2 TRP 42 7.098 -20.457 -0.343
830 H LEU 43 H LEU 43 11.772 -14.101 -2.851
831 HA LEU 43 HA LEU 43 11.267 -16.521 -4.430
832 1HB LEU 43 1HB LEU 43 11.836 -13.613 -5.178
833 2HB LEU 43 2HB LEU 43 11.602 -14.918 -6.328
834 HG LEU 43 HG LEU 43 9.410 -15.236 -4.589
835 1HD1 LEU 43 1HD1 LEU 43 10.002 -13.025 -3.598
836 2HD1 LEU 43 2HD1 LEU 43 9.783 -12.255 -5.181
837 3HD1 LEU 43 3HD1 LEU 43 8.407 -13.030 -4.359
838 1HD2 LEU 43 1HD2 LEU 43 9.605 -13.633 -7.203
839 2HD2 LEU 43 2HD2 LEU 43 9.391 -15.393 -7.096
840 3HD2 LEU 43 3HD2 LEU 43 8.117 -14.311 -6.506
841 H GLU 44 H GLU 44 14.016 -14.390 -3.609
842 HA GLU 44 HA GLU 44 15.934 -15.972 -5.172
843 1HB GLU 44 1HB GLU 44 16.244 -13.807 -3.065
844 2HB GLU 44 2HB GLU 44 17.596 -14.513 -3.938
845 1HG GLU 44 1HG GLU 44 15.366 -13.364 -5.600
846 2HG GLU 44 2HG GLU 44 16.448 -12.254 -4.749
847 H THR 45 H THR 45 14.268 -17.426 -3.092
848 HA THR 45 HA THR 45 16.539 -18.881 -1.976
849 HB THR 45 HB THR 45 15.823 -16.949 -0.418
850 HG1 THR 45 HG1 THR 45 16.967 -18.051 0.918
851 1HG2 THR 45 1HG2 THR 45 13.484 -17.265 -0.258
852 2HG2 THR 45 2HG2 THR 45 13.686 -18.878 0.479
853 3HG2 THR 45 3HG2 THR 45 14.242 -17.414 1.316
854 H ILE 46 H ILE 46 13.016 -18.484 -1.880
855 HA ILE 46 HA ILE 46 11.333 -19.913 -2.314
856 HB ILE 46 HB ILE 46 12.134 -19.143 -4.443
857 1HG1 ILE 46 1HG1 ILE 46 11.082 -20.561 -5.967
858 2HG1 ILE 46 2HG1 ILE 46 11.245 -21.988 -4.948
859 1HG2 ILE 46 1HG2 ILE 46 14.378 -19.958 -4.660
860 2HG2 ILE 46 2HG2 ILE 46 13.837 -21.654 -4.604
861 3HG2 ILE 46 3HG2 ILE 46 13.444 -20.619 -5.987
862 1HD1 ILE 46 1HD1 ILE 46 9.650 -21.053 -3.337
863 2HD1 ILE 46 2HD1 ILE 46 9.628 -19.505 -4.228
864 3HD1 ILE 46 3HD1 ILE 46 8.952 -20.971 -4.966
865 H LEU 47 H LEU 47 12.925 -20.987 -0.367
866 HA LEU 47 HA LEU 47 14.091 -23.233 -0.184
867 1HB LEU 47 1HB LEU 47 13.335 -22.003 1.770
868 2HB LEU 47 2HB LEU 47 11.665 -22.512 1.500
869 HG LEU 47 HG LEU 47 12.293 -24.875 1.999
870 1HD1 LEU 47 1HD1 LEU 47 14.680 -24.855 1.368
871 2HD1 LEU 47 2HD1 LEU 47 15.025 -23.674 2.650
872 3HD1 LEU 47 3HD1 LEU 47 14.496 -25.318 3.062
873 1HD2 LEU 47 1HD2 LEU 47 13.071 -22.860 4.139
874 2HD2 LEU 47 2HD2 LEU 47 11.420 -23.390 3.750
875 3HD2 LEU 47 3HD2 LEU 47 12.588 -24.549 4.408
876 H GLY 48 H GLY 48 10.517 -23.411 -0.396
877 1HA GLY 48 1HA GLY 48 10.625 -25.928 -1.873
878 2HA GLY 48 2HA GLY 48 10.016 -26.093 -0.213
879 1HN NH2 49 1HN NH2 49 9.722 -23.836 -3.032
880 2HN NH2 49 2HN NH2 49 7.959 -23.604 -2.884
Start of MODEL 11
1 1H ACE 0 H1 ACE 0 11.926 8.610 -5.850
2 2H ACE 0 H2 ACE 0 11.110 9.027 -7.362
3 3H ACE 0 H3 ACE 0 10.624 7.576 -6.482
4 H ASP 1 H ASP 1 8.769 9.614 -4.025
5 HA ASP 1 HA ASP 1 9.148 6.911 -4.989
6 1HB ASP 1 1HB ASP 1 11.341 7.425 -3.897
7 2HB ASP 1 2HB ASP 1 10.535 7.772 -2.380
8 H TYR 2 H TYR 2 8.789 8.561 -1.927
9 HA TYR 2 HA TYR 2 7.059 7.539 -0.382
10 1HB TYR 2 1HB TYR 2 8.035 9.906 -0.531
11 2HB TYR 2 2HB TYR 2 6.505 10.379 -1.263
12 HD1 TYR 2 HD1 TYR 2 8.275 10.750 1.574
13 HD2 TYR 2 HD2 TYR 2 4.399 9.213 0.425
14 HE1 TYR 2 HE1 TYR 2 7.350 11.389 3.767
15 HE2 TYR 2 HE2 TYR 2 3.493 9.884 2.592
16 HH TYR 2 HH TYR 2 3.939 10.815 4.655
17 H LEU 3 H LEU 3 5.787 9.158 -3.306
18 HA LEU 3 HA LEU 3 3.498 7.350 -3.242
19 1HB LEU 3 1HB LEU 3 3.282 10.336 -3.875
20 2HB LEU 3 2HB LEU 3 1.953 9.183 -4.013
21 HG LEU 3 HG LEU 3 3.338 9.871 -1.394
22 1HD1 LEU 3 1HD1 LEU 3 2.245 11.847 -2.376
23 2HD1 LEU 3 2HD1 LEU 3 0.718 10.935 -2.491
24 3HD1 LEU 3 3HD1 LEU 3 1.450 11.269 -0.902
25 1HD2 LEU 3 1HD2 LEU 3 0.680 8.471 -1.967
26 2HD2 LEU 3 2HD2 LEU 3 2.141 7.657 -1.393
27 3HD2 LEU 3 3HD2 LEU 3 1.332 8.843 -0.364
28 H ARG 4 H ARG 4 5.741 9.308 -5.120
29 HA ARG 4 HA ARG 4 4.572 8.828 -7.636
30 1HB ARG 4 1HB ARG 4 7.547 8.976 -7.002
31 2HB ARG 4 2HB ARG 4 6.768 9.185 -8.572
32 1HG ARG 4 1HG ARG 4 5.324 11.010 -7.142
33 2HG ARG 4 2HG ARG 4 6.833 11.056 -6.211
34 1HD ARG 4 1HD ARG 4 6.530 11.448 -9.218
35 2HD ARG 4 2HD ARG 4 6.762 12.747 -8.026
36 HE ARG 4 HE ARG 4 8.910 11.145 -7.533
37 1HH1 ARG 4 1HH2 ARG 4 7.639 12.773 -10.396
38 2HH1 ARG 4 2HH2 ARG 4 9.188 12.955 -11.169
39 1HH2 ARG 4 1HH1 ARG 4 10.924 11.355 -8.505
40 2HH2 ARG 4 2HH1 ARG 4 11.123 12.125 -10.055
41 H GLU 5 H GLU 5 6.163 6.593 -5.478
42 HA GLU 5 HA GLU 5 6.006 4.477 -7.582
43 1HB GLU 5 1HB GLU 5 7.842 4.603 -5.166
44 2HB GLU 5 2HB GLU 5 7.649 3.249 -6.285
45 1HG GLU 5 1HG GLU 5 8.330 4.696 -8.194
46 2HG GLU 5 2HG GLU 5 8.598 6.045 -7.092
47 H LEU 6 H LEU 6 4.903 5.594 -4.420
48 HA LEU 6 HA LEU 6 3.604 2.988 -3.943
49 1HB LEU 6 1HB LEU 6 4.040 5.187 -2.025
50 2HB LEU 6 2HB LEU 6 3.098 3.730 -1.736
51 HG LEU 6 HG LEU 6 6.018 3.825 -2.344
52 1HD1 LEU 6 1HD1 LEU 6 5.455 4.506 -0.075
53 2HD1 LEU 6 2HD1 LEU 6 4.337 3.134 0.104
54 3HD1 LEU 6 3HD1 LEU 6 6.073 2.844 0.015
55 1HD2 LEU 6 1HD2 LEU 6 4.205 1.420 -1.968
56 2HD2 LEU 6 2HD2 LEU 6 5.249 1.761 -3.370
57 3HD2 LEU 6 3HD2 LEU 6 5.971 1.347 -1.833
58 H LEU 7 H LEU 7 2.588 4.867 -6.016
59 HA LEU 7 HA LEU 7 -0.120 4.854 -5.044
60 1HB LEU 7 1HB LEU 7 0.691 7.080 -4.309
61 2HB LEU 7 2HB LEU 7 0.971 7.555 -5.984
62 HG LEU 7 HG LEU 7 -1.763 6.595 -5.112
63 1HD1 LEU 7 1HD1 LEU 7 -1.104 8.288 -3.463
64 2HD1 LEU 7 2HD1 LEU 7 -0.663 9.417 -4.754
65 3HD1 LEU 7 3HD1 LEU 7 -2.357 8.925 -4.530
66 1HD2 LEU 7 1HD2 LEU 7 -0.849 8.672 -7.164
67 2HD2 LEU 7 2HD2 LEU 7 -1.478 7.052 -7.553
68 3HD2 LEU 7 3HD2 LEU 7 -2.530 8.249 -6.813
69 H LYS 8 H LYS 8 1.517 6.461 -7.835
70 HA LYS 8 HA LYS 8 -0.594 5.696 -9.505
71 1HB LYS 8 1HB LYS 8 2.240 6.567 -10.172
72 2HB LYS 8 2HB LYS 8 0.953 6.390 -11.384
73 1HG LYS 8 1HG LYS 8 -0.447 8.046 -10.251
74 2HG LYS 8 2HG LYS 8 0.683 8.134 -8.896
75 1HD LYS 8 1HD LYS 8 2.449 8.892 -10.653
76 2HD LYS 8 2HD LYS 8 1.045 9.213 -11.697
77 1HE LYS 8 1HE LYS 8 0.064 10.633 -9.842
78 2HE LYS 8 2HE LYS 8 1.509 10.310 -8.866
79 1HZ LYS 8 1HZ LYS 8 2.811 11.363 -10.586
80 2HZ LYS 8 2HZ LYS 8 1.438 11.743 -11.419
81 3HZ LYS 8 3HZ LYS 8 1.699 12.383 -9.923
82 H LEU 9 H LEU 9 2.606 4.315 -8.994
83 HA LEU 9 HA LEU 9 2.346 2.187 -10.895
84 1HB LEU 9 1HB LEU 9 4.168 2.338 -8.482
85 2HB LEU 9 2HB LEU 9 4.294 1.197 -9.819
86 HG LEU 9 HG LEU 9 4.687 4.213 -9.946
87 1HD1 LEU 9 1HD1 LEU 9 6.529 2.788 -8.984
88 2HD1 LEU 9 2HD1 LEU 9 6.595 1.899 -10.515
89 3HD1 LEU 9 3HD1 LEU 9 7.000 3.630 -10.472
90 1HD2 LEU 9 1HD2 LEU 9 4.699 2.165 -12.207
91 2HD2 LEU 9 2HD2 LEU 9 3.651 3.597 -12.062
92 3HD2 LEU 9 3HD2 LEU 9 5.383 3.800 -12.332
93 H GLU 10 H GLU 10 1.459 2.569 -7.486
94 HA GLU 10 HA GLU 10 0.763 -0.157 -6.960
95 1HB GLU 10 1HB GLU 10 -0.361 2.480 -5.896
96 2HB GLU 10 2HB GLU 10 -0.818 0.917 -5.348
97 1HG GLU 10 1HG GLU 10 2.032 1.940 -5.245
98 2HG GLU 10 2HG GLU 10 0.841 2.102 -3.921
99 H LEU 11 H LEU 11 -1.146 2.646 -8.133
100 HA LEU 11 HA LEU 11 -3.635 1.245 -8.034
101 1HB LEU 11 1HB LEU 11 -3.116 3.775 -8.135
102 2HB LEU 11 2HB LEU 11 -3.010 3.598 -9.888
103 HG LEU 11 HG LEU 11 -5.439 2.964 -8.132
104 1HD1 LEU 11 1HD1 LEU 11 -4.830 5.378 -8.209
105 2HD1 LEU 11 2HD1 LEU 11 -4.909 5.328 -9.983
106 3HD1 LEU 11 3HD1 LEU 11 -6.372 5.051 -9.010
107 1HD2 LEU 11 1HD2 LEU 11 -5.115 2.931 -11.157
108 2HD2 LEU 11 2HD2 LEU 11 -5.756 1.654 -10.088
109 3HD2 LEU 11 3HD2 LEU 11 -6.687 3.117 -10.352
110 H GLN 12 H GLN 12 -1.346 1.779 -10.771
111 HA GLN 12 HA GLN 12 -3.025 0.499 -12.686
112 1HB GLN 12 1HB GLN 12 -0.927 0.047 -13.977
113 2HB GLN 12 2HB GLN 12 -1.158 1.748 -13.541
114 1HG GLN 12 1HG GLN 12 0.502 1.715 -11.937
115 2HG GLN 12 2HG GLN 12 0.374 -0.027 -11.683
116 1HE2 GLN 12 2HE2 GLN 12 2.614 -0.278 -11.757
117 2HE2 GLN 12 1HE2 GLN 12 3.486 -0.190 -13.289
118 H LEU 13 H LEU 13 -1.330 -1.017 -9.977
119 HA LEU 13 HA LEU 13 -1.109 -3.590 -11.340
120 1HB LEU 13 1HB LEU 13 -0.863 -3.015 -8.366
121 2HB LEU 13 2HB LEU 13 -0.506 -4.486 -9.252
122 HG LEU 13 HG LEU 13 1.072 -1.995 -8.983
123 1HD1 LEU 13 1HD1 LEU 13 1.526 -4.208 -7.865
124 2HD1 LEU 13 2HD1 LEU 13 1.929 -4.881 -9.445
125 3HD1 LEU 13 3HD1 LEU 13 2.896 -3.544 -8.785
126 1HD2 LEU 13 1HD2 LEU 13 1.344 -3.806 -11.456
127 2HD2 LEU 13 2HD2 LEU 13 0.801 -2.134 -11.534
128 3HD2 LEU 13 3HD2 LEU 13 2.437 -2.472 -10.998
129 H ILE 14 H ILE 14 -3.192 -2.148 -8.769
130 HA ILE 14 HA ILE 14 -5.088 -4.349 -8.642
131 HB ILE 14 HB ILE 14 -5.179 -1.316 -8.115
132 1HG1 ILE 14 1HG1 ILE 14 -5.845 -2.087 -5.867
133 2HG1 ILE 14 2HG1 ILE 14 -5.721 -3.777 -6.370
134 1HG2 ILE 14 1HG2 ILE 14 -7.419 -1.792 -9.084
135 2HG2 ILE 14 2HG2 ILE 14 -7.588 -3.203 -8.017
136 3HG2 ILE 14 3HG2 ILE 14 -7.535 -1.555 -7.360
137 1HD1 ILE 14 1HD1 ILE 14 -3.285 -3.510 -6.655
138 2HD1 ILE 14 2HD1 ILE 14 -3.431 -1.758 -6.338
139 3HD1 ILE 14 3HD1 ILE 14 -3.784 -2.934 -5.061
140 H LYS 15 H LYS 15 -5.195 -1.303 -10.493
141 HA LYS 15 HA LYS 15 -7.274 -2.054 -12.162
142 1HB LYS 15 1HB LYS 15 -5.606 0.102 -12.084
143 2HB LYS 15 2HB LYS 15 -4.946 -0.703 -13.490
144 1HG LYS 15 1HG LYS 15 -6.582 0.832 -14.311
145 2HG LYS 15 2HG LYS 15 -7.422 -0.730 -14.361
146 1HD LYS 15 1HD LYS 15 -8.444 -0.190 -12.103
147 2HD LYS 15 2HD LYS 15 -7.575 1.350 -12.107
148 1HE LYS 15 1HE LYS 15 -8.823 2.063 -14.127
149 2HE LYS 15 2HE LYS 15 -9.683 0.509 -14.148
150 1HZ LYS 15 1HZ LYS 15 -10.573 1.049 -11.997
151 2HZ LYS 15 2HZ LYS 15 -9.774 2.487 -11.978
152 3HZ LYS 15 3HZ LYS 15 -10.960 2.221 -13.089
153 H GLN 16 H GLN 16 -3.869 -2.988 -12.786
154 HA GLN 16 HA GLN 16 -4.531 -4.414 -15.239
155 1HB GLN 16 1HB GLN 16 -2.074 -4.239 -13.474
156 2HB GLN 16 2HB GLN 16 -2.225 -5.637 -14.503
157 1HG GLN 16 1HG GLN 16 -2.429 -2.803 -15.559
158 2HG GLN 16 2HG GLN 16 -0.964 -3.806 -15.603
159 1HE2 GLN 16 2HE2 GLN 16 -2.370 -2.769 -17.993
160 2HE2 GLN 16 1HE2 GLN 16 -2.971 -4.202 -18.830
161 H TYR 17 H TYR 17 -4.518 -5.222 -11.830
162 HA TYR 17 HA TYR 17 -4.403 -8.089 -12.207
163 1HB TYR 17 1HB TYR 17 -5.193 -6.184 -9.979
164 2HB TYR 17 2HB TYR 17 -5.698 -7.816 -9.866
165 HD1 TYR 17 HD1 TYR 17 -3.742 -6.045 -8.123
166 HD2 TYR 17 HD2 TYR 17 -3.557 -9.507 -10.661
167 HE1 TYR 17 HE1 TYR 17 -2.130 -7.092 -6.593
168 HE2 TYR 17 HE2 TYR 17 -1.763 -10.450 -9.244
169 HH TYR 17 HH TYR 17 -0.433 -10.121 -7.389
170 H ARG 18 H ARG 18 -6.889 -5.672 -12.483
171 HA ARG 18 HA ARG 18 -9.139 -7.554 -12.406
172 1HB ARG 18 1HB ARG 18 -8.945 -4.631 -13.244
173 2HB ARG 18 2HB ARG 18 -10.441 -5.572 -13.229
174 1HG ARG 18 1HG ARG 18 -10.252 -5.962 -10.824
175 2HG ARG 18 2HG ARG 18 -8.679 -5.148 -10.774
176 1HD ARG 18 1HD ARG 18 -9.720 -3.040 -11.506
177 2HD ARG 18 2HD ARG 18 -11.320 -3.831 -11.527
178 HE ARG 18 HE ARG 18 -10.185 -4.280 -8.988
179 1HH1 ARG 18 1HH2 ARG 18 -11.326 -1.554 -10.897
180 2HH1 ARG 18 2HH2 ARG 18 -11.700 -0.550 -9.516
181 1HH2 ARG 18 1HH1 ARG 18 -10.692 -3.026 -7.178
182 2HH2 ARG 18 2HH1 ARG 18 -11.285 -1.404 -7.322
183 H GLU 19 H GLU 19 -7.177 -5.883 -14.774
184 HA GLU 19 HA GLU 19 -8.501 -6.735 -17.137
185 1HB GLU 19 1HB GLU 19 -6.736 -4.946 -16.932
186 2HB GLU 19 2HB GLU 19 -5.527 -6.234 -16.815
187 1HG GLU 19 1HG GLU 19 -6.033 -7.031 -19.025
188 2HG GLU 19 2HG GLU 19 -7.441 -5.957 -19.148
189 H ALA 20 H ALA 20 -5.869 -8.249 -15.163
190 HA ALA 20 HA ALA 20 -5.712 -10.473 -17.113
191 1HB ALA 20 1HB ALA 20 -3.689 -9.846 -16.166
192 2HB ALA 20 2HB ALA 20 -4.367 -9.804 -14.531
193 3HB ALA 20 3HB ALA 20 -4.090 -11.372 -15.350
194 H LEU 21 H LEU 21 -7.481 -9.965 -14.100
195 HA LEU 21 HA LEU 21 -7.801 -12.346 -12.971
196 1HB LEU 21 1HB LEU 21 -8.962 -10.407 -12.194
197 2HB LEU 21 2HB LEU 21 -9.928 -10.301 -13.670
198 HG LEU 21 HG LEU 21 -11.211 -12.268 -13.094
199 1HD1 LEU 21 1HD1 LEU 21 -9.434 -13.607 -11.915
200 2HD1 LEU 21 2HD1 LEU 21 -9.483 -12.431 -10.598
201 3HD1 LEU 21 3HD1 LEU 21 -10.896 -13.457 -10.961
202 1HD2 LEU 21 1HD2 LEU 21 -10.934 -10.391 -10.710
203 2HD2 LEU 21 2HD2 LEU 21 -11.861 -10.052 -12.184
204 3HD2 LEU 21 3HD2 LEU 21 -12.354 -11.380 -11.121
205 H GLU 22 H GLU 22 -9.719 -11.454 -15.821
206 HA GLU 22 HA GLU 22 -11.073 -14.057 -15.907
207 1HB GLU 22 1HB GLU 22 -12.268 -13.149 -17.829
208 2HB GLU 22 2HB GLU 22 -12.372 -12.073 -16.427
209 1HG GLU 22 1HG GLU 22 -10.613 -10.624 -17.387
210 2HG GLU 22 2HG GLU 22 -10.460 -11.734 -18.765
211 H TYR 23 H TYR 23 -8.247 -12.660 -17.451
212 HA TYR 23 HA TYR 23 -8.091 -14.698 -19.527
213 1HB TYR 23 1HB TYR 23 -6.268 -12.581 -18.353
214 2HB TYR 23 2HB TYR 23 -5.591 -13.892 -19.267
215 HD1 TYR 23 HD1 TYR 23 -8.094 -11.110 -19.434
216 HD2 TYR 23 HD2 TYR 23 -5.713 -13.932 -21.666
217 HE1 TYR 23 HE1 TYR 23 -8.860 -10.088 -21.545
218 HE2 TYR 23 HE2 TYR 23 -6.438 -12.862 -23.782
219 HH TYR 23 HH TYR 23 -8.739 -10.134 -23.838
220 H VAL 24 H VAL 24 -7.082 -14.255 -16.145
221 HA VAL 24 HA VAL 24 -5.668 -16.832 -16.129
222 HB VAL 24 HB VAL 24 -6.350 -14.976 -13.828
223 1HG1 VAL 24 1HG1 VAL 24 -5.793 -17.200 -12.979
224 2HG1 VAL 24 2HG1 VAL 24 -4.452 -17.360 -14.126
225 3HG1 VAL 24 3HG1 VAL 24 -4.343 -16.211 -12.792
226 1HG2 VAL 24 1HG2 VAL 24 -3.823 -15.282 -15.508
227 2HG2 VAL 24 2HG2 VAL 24 -4.890 -13.881 -15.559
228 3HG2 VAL 24 3HG2 VAL 24 -3.994 -14.228 -14.086
229 H LYS 25 H LYS 25 -8.900 -15.716 -15.370
230 HA LYS 25 HA LYS 25 -10.831 -16.812 -15.006
231 1HB LYS 25 1HB LYS 25 -9.376 -19.398 -15.689
232 2HB LYS 25 2HB LYS 25 -11.117 -19.113 -15.685
233 1HG LYS 25 1HG LYS 25 -10.885 -17.486 -17.535
234 2HG LYS 25 2HG LYS 25 -9.131 -17.683 -17.510
235 1HD LYS 25 1HD LYS 25 -9.887 -18.964 -19.312
236 2HD LYS 25 2HD LYS 25 -9.407 -20.111 -18.053
237 1HE LYS 25 1HE LYS 25 -11.795 -20.447 -17.438
238 2HE LYS 25 2HE LYS 25 -12.282 -19.198 -18.603
239 1HZ LYS 25 1HZ LYS 25 -11.404 -20.577 -20.343
240 2HZ LYS 25 2HZ LYS 25 -10.976 -21.742 -19.259
241 3HZ LYS 25 3HZ LYS 25 -12.567 -21.374 -19.489
242 H LEU 26 H LEU 26 -8.951 -16.346 -12.808
243 HA LEU 26 HA LEU 26 -9.605 -18.623 -10.974
244 1HB LEU 26 1HB LEU 26 -7.254 -18.490 -11.538
245 2HB LEU 26 2HB LEU 26 -7.218 -16.797 -11.054
246 HG LEU 26 HG LEU 26 -7.972 -17.622 -8.714
247 1HD1 LEU 26 1HD1 LEU 26 -8.673 -19.913 -9.324
248 2HD1 LEU 26 2HD1 LEU 26 -7.021 -20.274 -9.866
249 3HD1 LEU 26 3HD1 LEU 26 -7.345 -19.949 -8.155
250 1HD2 LEU 26 1HD2 LEU 26 -5.227 -18.461 -9.692
251 2HD2 LEU 26 2HD2 LEU 26 -5.689 -16.810 -9.227
252 3HD2 LEU 26 3HD2 LEU 26 -5.719 -18.095 -8.021
253 HA PRO 27 HA PRO 27 -11.808 -15.063 -9.084
254 1HB PRO 27 1HB PRO 27 -13.260 -16.407 -7.193
255 2HB PRO 27 2HB PRO 27 -13.722 -16.313 -8.916
256 1HG PRO 27 1HG PRO 27 -12.239 -18.553 -7.523
257 2HG PRO 27 2HG PRO 27 -13.638 -18.688 -8.626
258 1HD PRO 27 1HD PRO 27 -11.098 -19.071 -9.480
259 2HD PRO 27 2HD PRO 27 -12.277 -18.243 -10.537
260 H VAL 28 H VAL 28 -9.843 -17.602 -7.473
261 HA VAL 28 HA VAL 28 -9.356 -16.135 -5.082
262 HB VAL 28 HB VAL 28 -7.727 -18.170 -6.532
263 1HG1 VAL 28 1HG1 VAL 28 -6.052 -16.784 -5.447
264 2HG1 VAL 28 2HG1 VAL 28 -7.016 -16.711 -3.955
265 3HG1 VAL 28 3HG1 VAL 28 -6.274 -18.236 -4.476
266 1HG2 VAL 28 1HG2 VAL 28 -9.143 -18.167 -3.834
267 2HG2 VAL 28 2HG2 VAL 28 -9.780 -18.908 -5.320
268 3HG2 VAL 28 3HG2 VAL 28 -8.300 -19.541 -4.575
269 H LEU 29 H LEU 29 -8.047 -15.634 -8.414
270 HA LEU 29 HA LEU 29 -6.000 -13.819 -7.558
271 1HB LEU 29 1HB LEU 29 -6.762 -14.910 -10.012
272 2HB LEU 29 2HB LEU 29 -7.319 -13.249 -10.173
273 HG LEU 29 HG LEU 29 -4.570 -14.212 -9.410
274 1HD1 LEU 29 1HD1 LEU 29 -5.303 -14.483 -11.798
275 2HD1 LEU 29 2HD1 LEU 29 -5.490 -12.725 -11.922
276 3HD1 LEU 29 3HD1 LEU 29 -3.885 -13.433 -11.627
277 1HD2 LEU 29 1HD2 LEU 29 -5.555 -11.336 -9.842
278 2HD2 LEU 29 2HD2 LEU 29 -4.898 -11.998 -8.331
279 3HD2 LEU 29 3HD2 LEU 29 -3.849 -11.810 -9.731
280 H ALA 30 H ALA 30 -9.448 -13.625 -8.519
281 HA ALA 30 HA ALA 30 -9.506 -10.931 -8.474
282 1HB ALA 30 1HB ALA 30 -11.490 -12.346 -9.173
283 2HB ALA 30 2HB ALA 30 -11.899 -12.566 -7.467
284 3HB ALA 30 3HB ALA 30 -11.935 -10.952 -8.181
285 H LYS 31 H LYS 31 -9.790 -13.307 -5.854
286 HA LYS 31 HA LYS 31 -10.472 -11.441 -3.749
287 1HB LYS 31 1HB LYS 31 -10.957 -13.858 -3.563
288 2HB LYS 31 2HB LYS 31 -9.211 -14.190 -3.470
289 1HG LYS 31 1HG LYS 31 -9.039 -12.817 -1.419
290 2HG LYS 31 2HG LYS 31 -10.756 -12.401 -1.528
291 1HD LYS 31 1HD LYS 31 -11.388 -14.743 -1.184
292 2HD LYS 31 2HD LYS 31 -9.682 -15.246 -1.250
293 1HE LYS 31 1HE LYS 31 -9.186 -13.882 0.768
294 2HE LYS 31 2HE LYS 31 -10.878 -13.360 0.844
295 1HZ LYS 31 1HZ LYS 31 -11.502 -15.635 1.183
296 2HZ LYS 31 2HZ LYS 31 -9.933 -16.133 1.077
297 3HZ LYS 31 3HZ LYS 31 -10.409 -15.169 2.324
298 H ILE 32 H ILE 32 -7.414 -12.735 -5.024
299 HA ILE 32 HA ILE 32 -5.776 -11.615 -2.917
300 HB ILE 32 HB ILE 32 -5.208 -12.332 -5.815
301 1HG1 ILE 32 1HG1 ILE 32 -4.287 -13.665 -3.217
302 2HG1 ILE 32 2HG1 ILE 32 -5.741 -14.145 -4.065
303 1HG2 ILE 32 1HG2 ILE 32 -2.834 -12.077 -5.415
304 2HG2 ILE 32 2HG2 ILE 32 -3.594 -10.537 -5.039
305 3HG2 ILE 32 3HG2 ILE 32 -3.113 -11.628 -3.734
306 1HD1 ILE 32 1HD1 ILE 32 -4.342 -14.617 -6.112
307 2HD1 ILE 32 2HD1 ILE 32 -2.897 -14.300 -5.123
308 3HD1 ILE 32 3HD1 ILE 32 -3.992 -15.626 -4.696
309 H LEU 33 H LEU 33 -7.001 -10.378 -6.067
310 HA LEU 33 HA LEU 33 -5.449 -8.008 -5.868
311 1HB LEU 33 1HB LEU 33 -6.319 -7.475 -7.880
312 2HB LEU 33 2HB LEU 33 -6.406 -9.257 -7.879
313 HG LEU 33 HG LEU 33 -8.749 -9.146 -7.604
314 1HD1 LEU 33 1HD1 LEU 33 -9.450 -7.215 -6.551
315 2HD1 LEU 33 2HD1 LEU 33 -8.240 -6.202 -7.408
316 3HD1 LEU 33 3HD1 LEU 33 -9.721 -6.776 -8.235
317 1HD2 LEU 33 1HD2 LEU 33 -7.761 -7.315 -9.793
318 2HD2 LEU 33 2HD2 LEU 33 -7.520 -9.088 -9.808
319 3HD2 LEU 33 3HD2 LEU 33 -9.157 -8.405 -9.883
320 H GLU 34 H GLU 34 -8.622 -8.896 -4.651
321 HA GLU 34 HA GLU 34 -9.596 -6.309 -4.152
322 1HB GLU 34 1HB GLU 34 -10.798 -8.576 -4.075
323 2HB GLU 34 2HB GLU 34 -10.165 -8.783 -2.457
324 1HG GLU 34 1HG GLU 34 -11.849 -6.385 -3.334
325 2HG GLU 34 2HG GLU 34 -12.522 -7.846 -2.599
326 H ASP 35 H ASP 35 -7.858 -8.605 -2.091
327 HA ASP 35 HA ASP 35 -7.758 -7.081 0.273
328 1HB ASP 35 1HB ASP 35 -6.992 -9.473 -0.023
329 2HB ASP 35 2HB ASP 35 -5.482 -8.851 -0.718
330 H GLU 36 H GLU 36 -5.386 -7.148 -2.419
331 HA GLU 36 HA GLU 36 -3.596 -5.212 -1.495
332 1HB GLU 36 1HB GLU 36 -4.480 -5.657 -4.361
333 2HB GLU 36 2HB GLU 36 -3.026 -4.831 -3.815
334 1HG GLU 36 1HG GLU 36 -3.161 -7.494 -2.581
335 2HG GLU 36 2HG GLU 36 -3.391 -7.635 -4.323
336 H GLU 37 H GLU 37 -6.733 -4.706 -3.157
337 HA GLU 37 HA GLU 37 -6.471 -2.061 -3.762
338 1HB GLU 37 1HB GLU 37 -8.308 -4.076 -4.119
339 2HB GLU 37 2HB GLU 37 -9.167 -3.261 -2.840
340 1HG GLU 37 1HG GLU 37 -8.051 -1.729 -5.201
341 2HG GLU 37 2HG GLU 37 -9.430 -2.797 -5.441
342 H LYS 38 H LYS 38 -7.432 -3.453 -0.622
343 HA LYS 38 HA LYS 38 -8.037 -0.920 0.604
344 1HB LYS 38 1HB LYS 38 -8.660 -3.185 1.498
345 2HB LYS 38 2HB LYS 38 -6.949 -3.464 1.860
346 1HG LYS 38 1HG LYS 38 -7.048 -1.261 3.249
347 2HG LYS 38 2HG LYS 38 -8.802 -1.339 3.056
348 1HD LYS 38 1HD LYS 38 -8.848 -3.493 4.245
349 2HD LYS 38 2HD LYS 38 -7.071 -3.567 4.240
350 1HE LYS 38 1HE LYS 38 -6.972 -1.474 5.602
351 2HE LYS 38 2HE LYS 38 -8.744 -1.433 5.662
352 1HZ LYS 38 1HZ LYS 38 -8.678 -3.533 6.802
353 2HZ LYS 38 2HZ LYS 38 -7.031 -3.575 6.719
354 3HZ LYS 38 3HZ LYS 38 -7.781 -2.411 7.612
355 H HIS 39 H HIS 39 -5.018 -2.878 0.490
356 HA HIS 39 HA HIS 39 -3.488 -1.183 2.201
357 1HB HIS 39 1HB HIS 39 -2.670 -3.009 -0.091
358 2HB HIS 39 2HB HIS 39 -1.534 -2.213 0.979
359 HD1 HIS 39 HD1 HIS 39 -2.002 -2.926 3.746
360 HD2 HIS 39 HD2 HIS 39 -3.576 -5.330 0.676
361 HE1 HIS 39 HE1 HIS 39 -2.507 -5.233 4.783
362 HE2 HIS 39 HE2 HIS 39 -3.437 -6.684 2.859
363 H ILE 40 H ILE 40 -4.030 -1.141 -1.309
364 HA ILE 40 HA ILE 40 -2.237 1.122 -1.705
365 HB ILE 40 HB ILE 40 -4.124 -0.466 -3.495
366 1HG1 ILE 40 1HG1 ILE 40 -1.876 -0.777 -4.675
367 2HG1 ILE 40 2HG1 ILE 40 -1.113 0.131 -3.350
368 1HG2 ILE 40 1HG2 ILE 40 -4.291 1.854 -4.299
369 2HG2 ILE 40 2HG2 ILE 40 -2.526 2.051 -4.205
370 3HG2 ILE 40 3HG2 ILE 40 -3.247 0.936 -5.383
371 1HD1 ILE 40 1HD1 ILE 40 -1.599 -1.707 -1.811
372 2HD1 ILE 40 2HD1 ILE 40 -2.512 -2.546 -3.099
373 3HD1 ILE 40 3HD1 ILE 40 -0.779 -2.307 -3.247
374 H GLU 41 H GLU 41 -5.732 0.704 -1.149
375 HA GLU 41 HA GLU 41 -6.576 3.330 -1.625
376 1HB GLU 41 1HB GLU 41 -8.023 1.305 -0.897
377 2HB GLU 41 2HB GLU 41 -7.486 1.674 0.754
378 1HG GLU 41 1HG GLU 41 -8.315 4.097 0.188
379 2HG GLU 41 2HG GLU 41 -9.201 3.293 -1.114
380 H TRP 42 H TRP 42 -4.931 1.864 1.263
381 HA TRP 42 HA TRP 42 -5.022 3.972 3.013
382 1HB TRP 42 1HB TRP 42 -3.950 1.584 3.125
383 2HB TRP 42 2HB TRP 42 -2.492 2.379 2.551
384 HD1 TRP 42 HD1 TRP 42 -4.749 2.193 5.556
385 HE1 TRP 42 HE1 TRP 42 -3.594 3.299 7.594
386 HE3 TRP 42 HE3 TRP 42 -0.814 4.188 3.149
387 HZ2 TRP 42 HZ2 TRP 42 -1.208 4.931 8.060
388 HZ3 TRP 42 HZ3 TRP 42 0.926 5.550 4.367
389 HH2 TRP 42 HH2 TRP 42 0.685 5.955 6.808
390 H LEU 43 H LEU 43 -2.990 3.580 0.153
391 HA LEU 43 HA LEU 43 -1.377 5.954 0.863
392 1HB LEU 43 1HB LEU 43 -1.226 3.887 -1.391
393 2HB LEU 43 2HB LEU 43 -0.136 5.265 -1.287
394 HG LEU 43 HG LEU 43 -0.310 3.367 1.063
395 1HD1 LEU 43 1HD1 LEU 43 -0.009 1.813 -0.670
396 2HD1 LEU 43 2HD1 LEU 43 1.022 2.896 -1.613
397 3HD1 LEU 43 3HD1 LEU 43 1.635 2.181 -0.121
398 1HD2 LEU 43 1HD2 LEU 43 1.921 5.073 -0.159
399 2HD2 LEU 43 2HD2 LEU 43 0.971 5.497 1.276
400 3HD2 LEU 43 3HD2 LEU 43 2.053 4.094 1.315
401 H GLU 44 H GLU 44 -4.141 5.223 -1.055
402 HA GLU 44 HA GLU 44 -3.772 7.647 -2.740
403 1HB GLU 44 1HB GLU 44 -6.051 5.649 -2.512
404 2HB GLU 44 2HB GLU 44 -6.035 7.076 -3.567
405 1HG GLU 44 1HG GLU 44 -4.023 6.236 -4.717
406 2HG GLU 44 2HG GLU 44 -3.960 4.826 -3.649
407 H THR 45 H THR 45 -5.987 6.412 -0.525
408 HA THR 45 HA THR 45 -7.708 8.579 -0.148
409 HB THR 45 HB THR 45 -7.816 6.202 0.796
410 HG1 THR 45 HG1 THR 45 -8.818 8.410 2.252
411 1HG2 THR 45 1HG2 THR 45 -5.916 6.258 2.379
412 2HG2 THR 45 2HG2 THR 45 -6.802 7.436 3.374
413 3HG2 THR 45 3HG2 THR 45 -7.451 5.813 3.123
414 H ILE 46 H ILE 46 -4.857 7.873 1.600
415 HA ILE 46 HA ILE 46 -4.601 9.598 3.661
416 HB ILE 46 HB ILE 46 -3.055 7.891 3.067
417 1HG1 ILE 46 1HG1 ILE 46 -1.093 10.090 2.934
418 2HG1 ILE 46 2HG1 ILE 46 -2.258 10.173 4.276
419 1HG2 ILE 46 1HG2 ILE 46 -3.132 7.902 0.783
420 2HG2 ILE 46 2HG2 ILE 46 -2.324 9.448 0.597
421 3HG2 ILE 46 3HG2 ILE 46 -1.443 8.061 1.254
422 1HD1 ILE 46 1HD1 ILE 46 -1.793 7.872 4.931
423 2HD1 ILE 46 2HD1 ILE 46 -0.676 7.673 3.568
424 3HD1 ILE 46 3HD1 ILE 46 -0.281 8.799 4.895
425 H LEU 47 H LEU 47 -4.048 10.588 0.237
426 HA LEU 47 HA LEU 47 -3.285 13.321 1.086
427 1HB LEU 47 1HB LEU 47 -3.261 11.769 -1.438
428 2HB LEU 47 2HB LEU 47 -3.880 13.400 -1.637
429 HG LEU 47 HG LEU 47 -1.465 13.204 -2.051
430 1HD1 LEU 47 1HD1 LEU 47 -2.489 15.366 -1.408
431 2HD1 LEU 47 2HD1 LEU 47 -2.092 15.051 0.292
432 3HD1 LEU 47 3HD1 LEU 47 -0.798 15.226 -0.903
433 1HD2 LEU 47 1HD2 LEU 47 -1.152 12.735 0.952
434 2HD2 LEU 47 2HD2 LEU 47 -0.886 11.533 -0.325
435 3HD2 LEU 47 3HD2 LEU 47 0.129 12.992 -0.233
436 H GLY 48 H GLY 48 -4.896 14.117 2.186
437 1HA GLY 48 1HA GLY 48 -7.447 13.702 2.462
438 2HA GLY 48 2HA GLY 48 -6.816 15.351 2.515
439 1HN NH2 49 1HN NH2 49 -8.389 12.918 0.406
440 2HN NH2 49 2HN NH2 49 -9.149 14.110 -0.683
441 1H ACE 0 H1 ACE 0 2.963 -16.460 -23.194
442 2H ACE 0 H2 ACE 0 2.953 -16.535 -21.418
443 3H ACE 0 H3 ACE 0 1.417 -16.461 -22.317
444 H ASP 1 H ASP 1 1.155 -14.614 -20.721
445 HA ASP 1 HA ASP 1 2.616 -12.125 -21.341
446 1HB ASP 1 1HB ASP 1 0.744 -12.133 -22.919
447 2HB ASP 1 2HB ASP 1 -0.416 -12.428 -21.622
448 H TYR 2 H TYR 2 -0.300 -13.271 -19.662
449 HA TYR 2 HA TYR 2 -0.580 -12.017 -17.348
450 1HB TYR 2 1HB TYR 2 -1.894 -13.924 -17.792
451 2HB TYR 2 2HB TYR 2 -0.488 -14.961 -18.008
452 HD1 TYR 2 HD1 TYR 2 -1.023 -12.763 -15.010
453 HD2 TYR 2 HD2 TYR 2 -1.227 -16.752 -16.645
454 HE1 TYR 2 HE1 TYR 2 -1.235 -13.688 -12.736
455 HE2 TYR 2 HE2 TYR 2 -1.526 -17.661 -14.367
456 HH TYR 2 HH TYR 2 -1.444 -15.602 -11.454
457 H LEU 3 H LEU 3 1.752 -14.741 -17.359
458 HA LEU 3 HA LEU 3 2.628 -14.030 -14.748
459 1HB LEU 3 1HB LEU 3 3.928 -15.837 -16.837
460 2HB LEU 3 2HB LEU 3 4.401 -15.789 -15.137
461 HG LEU 3 HG LEU 3 1.600 -16.559 -16.079
462 1HD1 LEU 3 1HD1 LEU 3 3.268 -18.170 -16.903
463 2HD1 LEU 3 2HD1 LEU 3 3.946 -18.323 -15.266
464 3HD1 LEU 3 3HD1 LEU 3 2.292 -18.877 -15.603
465 1HD2 LEU 3 1HD2 LEU 3 3.017 -16.828 -13.383
466 2HD2 LEU 3 2HD2 LEU 3 1.642 -15.761 -13.736
467 3HD2 LEU 3 3HD2 LEU 3 1.429 -17.513 -13.777
468 H ARG 4 H ARG 4 3.602 -12.530 -17.671
469 HA ARG 4 HA ARG 4 6.285 -11.799 -16.766
470 1HB ARG 4 1HB ARG 4 4.488 -10.302 -18.703
471 2HB ARG 4 2HB ARG 4 6.239 -10.172 -18.508
472 1HG ARG 4 1HG ARG 4 6.396 -12.618 -19.282
473 2HG ARG 4 2HG ARG 4 4.669 -12.509 -19.665
474 1HD ARG 4 1HD ARG 4 5.410 -10.286 -20.936
475 2HD ARG 4 2HD ARG 4 7.004 -11.079 -20.932
476 HE ARG 4 HE ARG 4 4.874 -12.823 -21.870
477 1HH1 ARG 4 1HH2 ARG 4 6.927 -10.136 -22.860
478 2HH1 ARG 4 2HH2 ARG 4 6.596 -10.325 -24.562
479 1HH2 ARG 4 1HH1 ARG 4 4.354 -13.035 -24.011
480 2HH2 ARG 4 2HH1 ARG 4 5.100 -12.057 -25.255
481 H GLU 5 H GLU 5 2.968 -10.848 -16.137
482 HA GLU 5 HA GLU 5 3.822 -8.431 -14.627
483 1HB GLU 5 1HB GLU 5 1.457 -7.578 -15.275
484 2HB GLU 5 2HB GLU 5 2.760 -7.488 -16.455
485 1HG GLU 5 1HG GLU 5 1.918 -9.438 -17.655
486 2HG GLU 5 2HG GLU 5 0.665 -9.681 -16.427
487 H LEU 6 H LEU 6 1.557 -7.944 -13.282
488 HA LEU 6 HA LEU 6 0.386 -8.468 -11.424
489 1HB LEU 6 1HB LEU 6 0.191 -11.186 -12.795
490 2HB LEU 6 2HB LEU 6 -0.509 -10.823 -11.237
491 HG LEU 6 HG LEU 6 -1.893 -8.956 -12.309
492 1HD1 LEU 6 1HD1 LEU 6 -0.533 -8.608 -14.344
493 2HD1 LEU 6 2HD1 LEU 6 -0.921 -10.260 -14.876
494 3HD1 LEU 6 3HD1 LEU 6 -2.187 -9.020 -14.711
495 1HD2 LEU 6 1HD2 LEU 6 -2.444 -11.642 -13.563
496 2HD2 LEU 6 2HD2 LEU 6 -2.475 -11.481 -11.804
497 3HD2 LEU 6 3HD2 LEU 6 -3.552 -10.508 -12.764
498 H LEU 7 H LEU 7 3.461 -9.494 -11.818
499 HA LEU 7 HA LEU 7 3.694 -10.508 -9.120
500 1HB LEU 7 1HB LEU 7 3.343 -12.483 -10.548
501 2HB LEU 7 2HB LEU 7 4.604 -11.953 -11.663
502 HG LEU 7 HG LEU 7 6.336 -12.322 -9.977
503 1HD1 LEU 7 1HD1 LEU 7 3.963 -12.506 -8.144
504 2HD1 LEU 7 2HD1 LEU 7 5.326 -13.547 -7.790
505 3HD1 LEU 7 3HD1 LEU 7 5.558 -11.792 -7.866
506 1HD2 LEU 7 1HD2 LEU 7 5.555 -14.239 -11.341
507 2HD2 LEU 7 2HD2 LEU 7 6.170 -14.737 -9.758
508 3HD2 LEU 7 3HD2 LEU 7 4.421 -14.687 -10.050
509 H LYS 8 H LYS 8 5.701 -10.011 -12.068
510 HA LYS 8 HA LYS 8 7.988 -9.189 -10.714
511 1HB LYS 8 1HB LYS 8 7.969 -9.789 -13.096
512 2HB LYS 8 2HB LYS 8 6.916 -8.411 -13.458
513 1HG LYS 8 1HG LYS 8 8.718 -6.861 -12.687
514 2HG LYS 8 2HG LYS 8 9.784 -8.246 -12.419
515 1HD LYS 8 1HD LYS 8 9.780 -8.772 -14.792
516 2HD LYS 8 2HD LYS 8 8.443 -7.647 -15.100
517 1HE LYS 8 1HE LYS 8 9.876 -5.731 -14.395
518 2HE LYS 8 2HE LYS 8 11.229 -6.839 -14.125
519 1HZ LYS 8 1HZ LYS 8 11.165 -7.384 -16.444
520 2HZ LYS 8 2HZ LYS 8 9.865 -6.400 -16.692
521 3HZ LYS 8 3HZ LYS 8 11.316 -5.754 -16.256
522 H LEU 9 H LEU 9 5.282 -7.404 -12.067
523 HA LEU 9 HA LEU 9 5.990 -4.755 -11.371
524 1HB LEU 9 1HB LEU 9 3.205 -5.965 -11.535
525 2HB LEU 9 2HB LEU 9 3.638 -4.252 -11.604
526 HG LEU 9 HG LEU 9 4.406 -6.345 -13.680
527 1HD1 LEU 9 1HD1 LEU 9 1.993 -5.725 -13.657
528 2HD1 LEU 9 2HD1 LEU 9 2.442 -4.016 -13.814
529 3HD1 LEU 9 3HD1 LEU 9 2.816 -5.156 -15.121
530 1HD2 LEU 9 1HD2 LEU 9 4.936 -3.342 -13.572
531 2HD2 LEU 9 2HD2 LEU 9 6.147 -4.646 -13.625
532 3HD2 LEU 9 3HD2 LEU 9 5.116 -4.348 -15.026
533 H GLU 10 H GLU 10 4.290 -7.302 -9.513
534 HA GLU 10 HA GLU 10 3.653 -5.642 -7.261
535 1HB GLU 10 1HB GLU 10 4.156 -8.649 -7.422
536 2HB GLU 10 2HB GLU 10 3.497 -7.729 -6.089
537 1HG GLU 10 1HG GLU 10 2.162 -7.990 -8.805
538 2HG GLU 10 2HG GLU 10 1.755 -8.951 -7.381
539 H LEU 11 H LEU 11 6.420 -7.768 -8.088
540 HA LEU 11 HA LEU 11 7.683 -7.671 -5.579
541 1HB LEU 11 1HB LEU 11 8.267 -9.266 -7.262
542 2HB LEU 11 2HB LEU 11 8.900 -8.030 -8.349
543 HG LEU 11 HG LEU 11 10.089 -8.167 -5.583
544 1HD1 LEU 11 1HD1 LEU 11 9.952 -10.536 -6.176
545 2HD1 LEU 11 2HD1 LEU 11 10.698 -10.209 -7.756
546 3HD1 LEU 11 3HD1 LEU 11 11.628 -9.973 -6.260
547 1HD2 LEU 11 1HD2 LEU 11 11.291 -7.809 -8.376
548 2HD2 LEU 11 2HD2 LEU 11 10.916 -6.486 -7.257
549 3HD2 LEU 11 3HD2 LEU 11 12.165 -7.662 -6.840
550 H GLN 12 H GLN 12 7.923 -5.404 -8.333
551 HA GLN 12 HA GLN 12 9.897 -3.691 -7.113
552 1HB GLN 12 1HB GLN 12 7.678 -3.188 -9.163
553 2HB GLN 12 2HB GLN 12 8.711 -1.899 -8.568
554 1HG GLN 12 1HG GLN 12 10.189 -2.352 -10.139
555 2HG GLN 12 2HG GLN 12 10.592 -3.837 -9.282
556 1HE2 GLN 12 2HE2 GLN 12 7.776 -2.829 -11.339
557 2HE2 GLN 12 1HE2 GLN 12 7.988 -4.142 -12.488
558 H LEU 13 H LEU 13 6.461 -3.885 -6.443
559 HA LEU 13 HA LEU 13 6.246 -1.380 -5.064
560 1HB LEU 13 1HB LEU 13 4.668 -3.930 -4.504
561 2HB LEU 13 2HB LEU 13 4.320 -2.289 -3.997
562 HG LEU 13 HG LEU 13 4.233 -3.314 -6.858
563 1HD1 LEU 13 1HD1 LEU 13 2.396 -4.198 -5.696
564 2HD1 LEU 13 2HD1 LEU 13 2.235 -2.816 -4.636
565 3HD1 LEU 13 3HD1 LEU 13 1.719 -2.673 -6.320
566 1HD2 LEU 13 1HD2 LEU 13 3.700 -0.539 -5.721
567 2HD2 LEU 13 2HD2 LEU 13 4.889 -0.993 -6.951
568 3HD2 LEU 13 3HD2 LEU 13 3.164 -1.081 -7.326
569 H ILE 14 H ILE 14 6.891 -4.788 -4.096
570 HA ILE 14 HA ILE 14 7.295 -4.147 -1.312
571 HB ILE 14 HB ILE 14 8.319 -6.502 -3.014
572 1HG1 ILE 14 1HG1 ILE 14 6.005 -6.561 -3.365
573 2HG1 ILE 14 2HG1 ILE 14 6.257 -7.692 -2.043
574 1HG2 ILE 14 1HG2 ILE 14 9.471 -6.656 -0.972
575 2HG2 ILE 14 2HG2 ILE 14 8.035 -6.201 -0.028
576 3HG2 ILE 14 3HG2 ILE 14 8.138 -7.785 -0.834
577 1HD1 ILE 14 1HD1 ILE 14 5.716 -5.696 -0.473
578 2HD1 ILE 14 2HD1 ILE 14 5.134 -4.883 -1.947
579 3HD1 ILE 14 3HD1 ILE 14 4.376 -6.379 -1.422
580 H LYS 15 H LYS 15 9.120 -2.864 -3.607
581 HA LYS 15 HA LYS 15 11.734 -3.241 -2.267
582 1HB LYS 15 1HB LYS 15 11.046 -3.815 -4.981
583 2HB LYS 15 2HB LYS 15 11.725 -2.202 -5.022
584 1HG LYS 15 1HG LYS 15 13.464 -3.763 -5.435
585 2HG LYS 15 2HG LYS 15 13.762 -3.140 -3.804
586 1HD LYS 15 1HD LYS 15 12.821 -5.174 -2.799
587 2HD LYS 15 2HD LYS 15 12.254 -5.757 -4.364
588 1HE LYS 15 1HE LYS 15 15.202 -5.309 -3.677
589 2HE LYS 15 2HE LYS 15 14.364 -6.863 -3.522
590 1HZ LYS 15 1HZ LYS 15 13.903 -6.815 -5.846
591 2HZ LYS 15 2HZ LYS 15 14.665 -5.366 -6.028
592 3HZ LYS 15 3HZ LYS 15 15.525 -6.700 -5.586
593 H GLN 16 H GLN 16 9.389 -1.305 -4.162
594 HA GLN 16 HA GLN 16 10.564 1.262 -3.563
595 1HB GLN 16 1HB GLN 16 7.837 0.329 -4.544
596 2HB GLN 16 2HB GLN 16 8.319 2.031 -4.451
597 1HG GLN 16 1HG GLN 16 10.086 1.750 -6.021
598 2HG GLN 16 2HG GLN 16 10.051 0.003 -5.954
599 1HE2 GLN 16 2HE2 GLN 16 9.639 2.084 -8.207
600 2HE2 GLN 16 1HE2 GLN 16 8.222 1.420 -9.020
601 H TYR 17 H TYR 17 8.303 -0.868 -1.947
602 HA TYR 17 HA TYR 17 7.328 0.998 -0.016
603 1HB TYR 17 1HB TYR 17 7.386 -2.036 -0.413
604 2HB TYR 17 2HB TYR 17 7.012 -1.448 1.163
605 HD1 TYR 17 HD1 TYR 17 5.298 -2.765 -1.455
606 HD2 TYR 17 HD2 TYR 17 5.311 0.665 1.106
607 HE1 TYR 17 HE1 TYR 17 2.902 -2.434 -1.886
608 HE2 TYR 17 HE2 TYR 17 2.865 0.808 0.955
609 HH TYR 17 HH TYR 17 0.998 -1.266 -1.299
610 H ARG 18 H ARG 18 10.150 -1.098 -0.200
611 HA ARG 18 HA ARG 18 10.771 -0.727 2.664
612 1HB ARG 18 1HB ARG 18 12.321 -2.067 0.417
613 2HB ARG 18 2HB ARG 18 12.878 -1.946 2.096
614 1HG ARG 18 1HG ARG 18 10.870 -3.178 2.882
615 2HG ARG 18 2HG ARG 18 10.267 -3.247 1.225
616 1HD ARG 18 1HD ARG 18 11.188 -5.350 1.585
617 2HD ARG 18 2HD ARG 18 12.390 -4.502 0.599
618 HE ARG 18 HE ARG 18 12.983 -4.147 3.388
619 1HH1 ARG 18 1HH2 ARG 18 13.002 -6.612 0.881
620 2HH1 ARG 18 2HH2 ARG 18 14.126 -7.668 1.688
621 1HH2 ARG 18 1HH1 ARG 18 14.418 -5.529 4.521
622 2HH2 ARG 18 2HH1 ARG 18 14.950 -7.031 3.818
623 H GLU 19 H GLU 19 11.747 0.406 -0.489
624 HA GLU 19 HA GLU 19 13.790 2.205 0.298
625 1HB GLU 19 1HB GLU 19 13.046 1.352 -2.055
626 2HB GLU 19 2HB GLU 19 11.910 2.710 -2.012
627 1HG GLU 19 1HG GLU 19 13.859 4.253 -1.681
628 2HG GLU 19 2HG GLU 19 14.948 2.857 -1.714
629 H ALA 20 H ALA 20 10.216 2.684 -0.127
630 HA ALA 20 HA ALA 20 10.426 5.442 0.698
631 1HB ALA 20 1HB ALA 20 8.633 4.880 -0.757
632 2HB ALA 20 2HB ALA 20 8.043 3.644 0.376
633 3HB ALA 20 3HB ALA 20 7.942 5.371 0.794
634 H LEU 21 H LEU 21 9.944 2.394 2.454
635 HA LEU 21 HA LEU 21 8.760 3.102 4.754
636 1HB LEU 21 1HB LEU 21 9.759 0.852 4.210
637 2HB LEU 21 2HB LEU 21 11.341 1.505 4.650
638 HG LEU 21 HG LEU 21 10.513 1.871 6.982
639 1HD1 LEU 21 1HD1 LEU 21 8.067 2.010 6.570
640 2HD1 LEU 21 2HD1 LEU 21 8.075 0.335 5.971
641 3HD1 LEU 21 3HD1 LEU 21 8.432 0.681 7.673
642 1HD2 LEU 21 1HD2 LEU 21 10.234 -0.964 5.889
643 2HD2 LEU 21 2HD2 LEU 21 11.757 -0.168 6.340
644 3HD2 LEU 21 3HD2 LEU 21 10.542 -0.525 7.582
645 H GLU 22 H GLU 22 12.121 3.953 3.938
646 HA GLU 22 HA GLU 22 12.637 5.127 6.553
647 1HB GLU 22 1HB GLU 22 14.291 5.214 3.993
648 2HB GLU 22 2HB GLU 22 14.785 5.778 5.597
649 1HG GLU 22 1HG GLU 22 14.295 3.399 6.448
650 2HG GLU 22 2HG GLU 22 14.189 2.913 4.746
651 H TYR 23 H TYR 23 11.863 6.289 3.276
652 HA TYR 23 HA TYR 23 12.180 9.097 3.793
653 1HB TYR 23 1HB TYR 23 10.972 7.379 1.694
654 2HB TYR 23 2HB TYR 23 10.113 8.879 1.944
655 HD1 TYR 23 HD1 TYR 23 10.831 10.837 0.863
656 HD2 TYR 23 HD2 TYR 23 13.606 7.577 1.403
657 HE1 TYR 23 HE1 TYR 23 12.518 12.043 -0.492
658 HE2 TYR 23 HE2 TYR 23 15.301 8.806 0.084
659 HH TYR 23 HH TYR 23 15.784 10.734 -1.076
660 H VAL 24 H VAL 24 9.552 6.800 4.349
661 HA VAL 24 HA VAL 24 7.709 8.973 5.136
662 HB VAL 24 HB VAL 24 7.245 5.982 4.971
663 1HG1 VAL 24 1HG1 VAL 24 5.575 7.180 6.350
664 2HG1 VAL 24 2HG1 VAL 24 5.350 8.385 5.080
665 3HG1 VAL 24 3HG1 VAL 24 4.833 6.713 4.812
666 1HG2 VAL 24 1HG2 VAL 24 6.519 8.126 2.945
667 2HG2 VAL 24 2HG2 VAL 24 7.859 7.013 2.711
668 3HG2 VAL 24 3HG2 VAL 24 6.207 6.396 2.794
669 H LYS 25 H LYS 25 9.516 6.304 6.641
670 HA LYS 25 HA LYS 25 9.718 5.533 8.730
671 1HB LYS 25 1HB LYS 25 9.316 8.442 9.528
672 2HB LYS 25 2HB LYS 25 9.822 7.127 10.589
673 1HG LYS 25 1HG LYS 25 11.707 6.767 8.721
674 2HG LYS 25 2HG LYS 25 11.353 8.465 8.373
675 1HD LYS 25 1HD LYS 25 11.686 8.989 10.817
676 2HD LYS 25 2HD LYS 25 12.061 7.276 11.109
677 1HE LYS 25 1HE LYS 25 13.992 7.476 9.494
678 2HE LYS 25 2HE LYS 25 13.665 9.215 9.388
679 1HZ LYS 25 1HZ LYS 25 14.018 9.339 11.766
680 2HZ LYS 25 2HZ LYS 25 14.349 7.726 11.831
681 3HZ LYS 25 3HZ LYS 25 15.349 8.737 11.002
682 H LEU 26 H LEU 26 7.638 4.417 8.144
683 HA LEU 26 HA LEU 26 5.730 4.903 10.361
684 1HB LEU 26 1HB LEU 26 5.214 5.415 7.619
685 2HB LEU 26 2HB LEU 26 4.359 3.932 7.952
686 HG LEU 26 HG LEU 26 3.968 6.105 9.991
687 1HD1 LEU 26 1HD1 LEU 26 4.052 7.529 8.050
688 2HD1 LEU 26 2HD1 LEU 26 3.003 6.432 7.125
689 3HD1 LEU 26 3HD1 LEU 26 2.363 7.324 8.522
690 1HD2 LEU 26 1HD2 LEU 26 2.031 4.396 8.365
691 2HD2 LEU 26 2HD2 LEU 26 2.694 3.947 9.954
692 3HD2 LEU 26 3HD2 LEU 26 1.636 5.363 9.795
693 HA PRO 27 HA PRO 27 6.858 0.551 10.650
694 1HB PRO 27 1HB PRO 27 5.187 -0.256 12.682
695 2HB PRO 27 2HB PRO 27 6.670 0.704 12.940
696 1HG PRO 27 1HG PRO 27 3.823 1.715 12.768
697 2HG PRO 27 2HG PRO 27 5.069 2.141 13.972
698 1HD PRO 27 1HD PRO 27 4.541 3.724 11.824
699 2HD PRO 27 2HD PRO 27 6.213 3.534 12.425
700 H VAL 28 H VAL 28 3.492 1.665 10.483
701 HA VAL 28 HA VAL 28 2.159 -0.661 9.766
702 HB VAL 28 HB VAL 28 1.616 2.086 8.711
703 1HG1 VAL 28 1HG1 VAL 28 0.292 0.353 7.583
704 2HG1 VAL 28 2HG1 VAL 28 -0.237 -0.291 9.149
705 3HG1 VAL 28 3HG1 VAL 28 -0.744 1.329 8.623
706 1HG2 VAL 28 1HG2 VAL 28 0.613 0.778 11.283
707 2HG2 VAL 28 2HG2 VAL 28 1.707 2.175 11.207
708 3HG2 VAL 28 3HG2 VAL 28 0.049 2.328 10.630
709 H LEU 29 H LEU 29 4.269 1.393 7.764
710 HA LEU 29 HA LEU 29 3.391 0.507 5.215
711 1HB LEU 29 1HB LEU 29 5.570 2.118 6.368
712 2HB LEU 29 2HB LEU 29 6.134 1.161 5.013
713 HG LEU 29 HG LEU 29 3.586 2.814 4.829
714 1HD1 LEU 29 1HD1 LEU 29 5.346 4.372 5.517
715 2HD1 LEU 29 2HD1 LEU 29 6.452 3.716 4.291
716 3HD1 LEU 29 3HD1 LEU 29 4.983 4.583 3.793
717 1HD2 LEU 29 1HD2 LEU 29 5.686 1.921 2.816
718 2HD2 LEU 29 2HD2 LEU 29 4.150 1.063 3.097
719 3HD2 LEU 29 3HD2 LEU 29 4.141 2.710 2.432
720 H ALA 30 H ALA 30 6.167 -0.664 7.201
721 HA ALA 30 HA ALA 30 6.787 -2.882 5.523
722 1HB ALA 30 1HB ALA 30 8.282 -2.048 7.314
723 2HB ALA 30 2HB ALA 30 7.105 -2.559 8.545
724 3HB ALA 30 3HB ALA 30 7.917 -3.771 7.529
725 H LYS 31 H LYS 31 4.217 -2.431 7.942
726 HA LYS 31 HA LYS 31 3.607 -5.298 8.040
727 1HB LYS 31 1HB LYS 31 2.856 -2.961 9.519
728 2HB LYS 31 2HB LYS 31 1.392 -3.537 8.733
729 1HG LYS 31 1HG LYS 31 1.403 -4.558 10.807
730 2HG LYS 31 2HG LYS 31 1.904 -5.853 9.724
731 1HD LYS 31 1HD LYS 31 3.902 -4.127 11.300
732 2HD LYS 31 2HD LYS 31 3.096 -5.536 12.004
733 1HE LYS 31 1HE LYS 31 4.021 -6.948 10.120
734 2HE LYS 31 2HE LYS 31 5.032 -5.562 9.653
735 1HZ LYS 31 1HZ LYS 31 6.018 -5.609 11.794
736 2HZ LYS 31 2HZ LYS 31 5.055 -6.862 12.274
737 3HZ LYS 31 3HZ LYS 31 6.155 -7.085 11.072
738 H ILE 32 H ILE 32 2.655 -2.603 6.041
739 HA ILE 32 HA ILE 32 0.350 -3.890 4.822
740 HB ILE 32 HB ILE 32 2.004 -1.388 4.264
741 1HG1 ILE 32 1HG1 ILE 32 -0.973 -1.696 4.813
742 2HG1 ILE 32 2HG1 ILE 32 0.219 -1.488 6.087
743 1HG2 ILE 32 1HG2 ILE 32 1.557 -2.158 2.064
744 2HG2 ILE 32 2HG2 ILE 32 -0.058 -2.716 2.512
745 3HG2 ILE 32 3HG2 ILE 32 0.291 -0.979 2.379
746 1HD1 ILE 32 1HD1 ILE 32 0.916 0.682 5.105
747 2HD1 ILE 32 2HD1 ILE 32 -0.321 0.513 3.842
748 3HD1 ILE 32 3HD1 ILE 32 -0.806 0.654 5.528
749 H LEU 33 H LEU 33 3.762 -3.151 3.963
750 HA LEU 33 HA LEU 33 3.653 -4.548 1.464
751 1HB LEU 33 1HB LEU 33 5.842 -3.921 1.226
752 2HB LEU 33 2HB LEU 33 5.286 -2.762 2.436
753 HG LEU 33 HG LEU 33 6.212 -4.316 4.161
754 1HD1 LEU 33 1HD1 LEU 33 6.983 -6.307 3.607
755 2HD1 LEU 33 2HD1 LEU 33 6.800 -5.958 1.876
756 3HD1 LEU 33 3HD1 LEU 33 8.299 -5.522 2.721
757 1HD2 LEU 33 1HD2 LEU 33 8.125 -3.101 2.144
758 2HD2 LEU 33 2HD2 LEU 33 7.249 -2.178 3.387
759 3HD2 LEU 33 3HD2 LEU 33 8.468 -3.373 3.869
760 H GLU 34 H GLU 34 4.402 -5.700 4.801
761 HA GLU 34 HA GLU 34 5.229 -8.291 4.005
762 1HB GLU 34 1HB GLU 34 5.242 -7.182 6.386
763 2HB GLU 34 2HB GLU 34 3.579 -7.720 6.499
764 1HG GLU 34 1HG GLU 34 4.694 -10.067 5.735
765 2HG GLU 34 2HG GLU 34 6.134 -9.319 6.431
766 H ASP 35 H ASP 35 2.018 -7.014 4.907
767 HA ASP 35 HA ASP 35 0.566 -9.427 4.552
768 1HB ASP 35 1HB ASP 35 -0.285 -7.265 5.564
769 2HB ASP 35 2HB ASP 35 -0.506 -6.657 3.913
770 H GLU 36 H GLU 36 1.163 -6.776 2.204
771 HA GLU 36 HA GLU 36 0.042 -8.024 -0.061
772 1HB GLU 36 1HB GLU 36 2.413 -6.120 0.127
773 2HB GLU 36 2HB GLU 36 1.547 -6.514 -1.364
774 1HG GLU 36 1HG GLU 36 0.197 -5.163 1.023
775 2HG GLU 36 2HG GLU 36 0.954 -4.342 -0.359
776 H GLU 37 H GLU 37 3.444 -8.390 1.293
777 HA GLU 37 HA GLU 37 4.596 -9.599 -0.844
778 1HB GLU 37 1HB GLU 37 5.815 -8.661 1.053
779 2HB GLU 37 2HB GLU 37 4.919 -9.648 2.193
780 1HG GLU 37 1HG GLU 37 5.755 -11.598 1.489
781 2HG GLU 37 2HG GLU 37 6.544 -10.844 0.068
782 H LYS 38 H LYS 38 2.501 -10.890 1.804
783 HA LYS 38 HA LYS 38 2.830 -13.611 0.907
784 1HB LYS 38 1HB LYS 38 1.927 -12.587 3.229
785 2HB LYS 38 2HB LYS 38 0.369 -12.724 2.406
786 1HG LYS 38 1HG LYS 38 0.659 -14.793 3.569
787 2HG LYS 38 2HG LYS 38 1.035 -15.150 1.876
788 1HD LYS 38 1HD LYS 38 3.547 -14.518 2.704
789 2HD LYS 38 2HD LYS 38 2.879 -14.915 4.281
790 1HE LYS 38 1HE LYS 38 2.291 -17.181 3.487
791 2HE LYS 38 2HE LYS 38 2.742 -16.747 1.827
792 1HZ LYS 38 1HZ LYS 38 4.980 -16.429 2.559
793 2HZ LYS 38 2HZ LYS 38 4.590 -16.872 4.099
794 3HZ LYS 38 3HZ LYS 38 4.468 -17.959 2.861
795 H HIS 39 H HIS 39 0.353 -11.135 0.213
796 HA HIS 39 HA HIS 39 -1.280 -12.806 -1.423
797 1HB HIS 39 1HB HIS 39 -0.854 -9.829 -1.141
798 2HB HIS 39 2HB HIS 39 -1.663 -10.401 -2.581
799 HD1 HIS 39 HD1 HIS 39 -3.758 -12.217 -2.024
800 HD2 HIS 39 HD2 HIS 39 -2.336 -9.778 1.091
801 HE1 HIS 39 HE1 HIS 39 -5.452 -12.441 -0.172
802 HE2 HIS 39 HE2 HIS 39 -4.606 -10.877 1.759
803 H ILE 40 H ILE 40 1.634 -10.982 -2.207
804 HA ILE 40 HA ILE 40 1.560 -11.593 -5.042
805 HB ILE 40 HB ILE 40 3.756 -10.553 -3.212
806 1HG1 ILE 40 1HG1 ILE 40 2.069 -8.958 -5.169
807 2HG1 ILE 40 2HG1 ILE 40 1.475 -9.209 -3.572
808 1HG2 ILE 40 1HG2 ILE 40 4.737 -11.464 -5.286
809 2HG2 ILE 40 2HG2 ILE 40 3.542 -10.592 -6.260
810 3HG2 ILE 40 3HG2 ILE 40 4.783 -9.707 -5.348
811 1HD1 ILE 40 1HD1 ILE 40 3.392 -8.209 -2.505
812 2HD1 ILE 40 2HD1 ILE 40 4.193 -7.939 -4.048
813 3HD1 ILE 40 3HD1 ILE 40 2.681 -7.083 -3.674
814 H GLU 41 H GLU 41 3.143 -12.936 -2.161
815 HA GLU 41 HA GLU 41 4.854 -14.796 -3.308
816 1HB GLU 41 1HB GLU 41 4.737 -14.223 -0.914
817 2HB GLU 41 2HB GLU 41 3.245 -15.163 -0.751
818 1HG GLU 41 1HG GLU 41 5.566 -16.573 -1.996
819 2HG GLU 41 2HG GLU 41 5.794 -16.042 -0.325
820 H TRP 42 H TRP 42 1.299 -14.963 -2.804
821 HA TRP 42 HA TRP 42 0.803 -17.576 -3.457
822 1HB TRP 42 1HB TRP 42 -0.724 -15.559 -2.845
823 2HB TRP 42 2HB TRP 42 -0.819 -15.294 -4.584
824 HD1 TRP 42 HD1 TRP 42 -1.988 -17.549 -1.839
825 HE1 TRP 42 HE1 TRP 42 -3.617 -19.334 -2.731
826 HE3 TRP 42 HE3 TRP 42 -1.394 -16.650 -6.759
827 HZ2 TRP 42 HZ2 TRP 42 -4.407 -20.370 -5.373
828 HZ3 TRP 42 HZ3 TRP 42 -2.603 -18.015 -8.495
829 HH2 TRP 42 HH2 TRP 42 -4.002 -19.943 -7.789
830 H LEU 43 H LEU 43 1.526 -14.889 -5.673
831 HA LEU 43 HA LEU 43 1.225 -16.497 -8.124
832 1HB LEU 43 1HB LEU 43 2.283 -13.706 -7.586
833 2HB LEU 43 2HB LEU 43 2.270 -14.469 -9.172
834 HG LEU 43 HG LEU 43 -0.382 -14.735 -8.178
835 1HD1 LEU 43 1HD1 LEU 43 0.096 -12.994 -6.497
836 2HD1 LEU 43 2HD1 LEU 43 0.701 -11.913 -7.766
837 3HD1 LEU 43 3HD1 LEU 43 -1.012 -12.374 -7.736
838 1HD2 LEU 43 1HD2 LEU 43 0.796 -12.764 -10.191
839 2HD2 LEU 43 2HD2 LEU 43 0.258 -14.412 -10.548
840 3HD2 LEU 43 3HD2 LEU 43 -0.919 -13.181 -10.048
841 H GLU 44 H GLU 44 3.824 -15.164 -6.070
842 HA GLU 44 HA GLU 44 5.978 -16.432 -7.545
843 1HB GLU 44 1HB GLU 44 5.633 -14.514 -5.378
844 2HB GLU 44 2HB GLU 44 6.799 -15.703 -4.861
845 1HG GLU 44 1HG GLU 44 7.221 -14.645 -7.628
846 2HG GLU 44 2HG GLU 44 7.298 -13.460 -6.324
847 H THR 45 H THR 45 3.830 -18.270 -6.555
848 HA THR 45 HA THR 45 5.683 -20.358 -5.670
849 HB THR 45 HB THR 45 4.777 -19.033 -3.664
850 HG1 THR 45 HG1 THR 45 5.028 -20.801 -2.456
851 1HG2 THR 45 1HG2 THR 45 2.418 -18.994 -4.203
852 2HG2 THR 45 2HG2 THR 45 2.321 -20.752 -3.995
853 3HG2 THR 45 3HG2 THR 45 2.738 -19.700 -2.628
854 H ILE 46 H ILE 46 2.371 -19.381 -6.209
855 HA ILE 46 HA ILE 46 0.598 -20.322 -7.188
856 HB ILE 46 HB ILE 46 1.806 -19.282 -8.978
857 1HG1 ILE 46 1HG1 ILE 46 0.802 -20.233 -10.897
858 2HG1 ILE 46 2HG1 ILE 46 0.565 -21.803 -10.123
859 1HG2 ILE 46 1HG2 ILE 46 3.918 -20.417 -9.062
860 2HG2 ILE 46 2HG2 ILE 46 3.147 -21.953 -9.520
861 3HG2 ILE 46 3HG2 ILE 46 3.139 -20.573 -10.631
862 1HD1 ILE 46 1HD1 ILE 46 -1.081 -20.826 -8.584
863 2HD1 ILE 46 2HD1 ILE 46 -0.684 -19.192 -9.180
864 3HD1 ILE 46 3HD1 ILE 46 -1.497 -20.363 -10.242
865 H LEU 47 H LEU 47 1.213 -21.940 -5.305
866 HA LEU 47 HA LEU 47 1.776 -24.634 -6.177
867 1HB LEU 47 1HB LEU 47 1.969 -23.145 -3.761
868 2HB LEU 47 2HB LEU 47 0.821 -24.403 -3.393
869 HG LEU 47 HG LEU 47 3.010 -25.090 -2.790
870 1HD1 LEU 47 1HD1 LEU 47 1.509 -26.838 -3.719
871 2HD1 LEU 47 2HD1 LEU 47 2.282 -26.646 -5.309
872 3HD1 LEU 47 3HD1 LEU 47 3.231 -27.210 -3.925
873 1HD2 LEU 47 1HD2 LEU 47 3.941 -24.680 -5.664
874 2HD2 LEU 47 2HD2 LEU 47 4.301 -23.618 -4.293
875 3HD2 LEU 47 3HD2 LEU 47 4.894 -25.287 -4.302
876 H GLY 48 H GLY 48 -0.180 -24.263 -7.730
877 1HA GLY 48 1HA GLY 48 -2.207 -26.138 -7.194
878 2HA GLY 48 2HA GLY 48 -2.832 -24.565 -6.657
879 1HN NH2 49 1HN NH2 49 -1.045 -26.021 -9.454
880 2HN NH2 49 2HN NH2 49 -1.931 -25.108 -10.704
Start of MODEL 12
1 1H ACE 0 H1 ACE 0 8.263 17.545 -5.225
2 2H ACE 0 H2 ACE 0 7.116 18.868 -4.947
3 3H ACE 0 H3 ACE 0 6.522 17.264 -5.426
4 H ASP 1 H ASP 1 5.461 18.450 -3.202
5 HA ASP 1 HA ASP 1 6.836 17.334 -0.805
6 1HB ASP 1 1HB ASP 1 6.140 19.709 -0.827
7 2HB ASP 1 2HB ASP 1 4.446 19.222 -0.959
8 H TYR 2 H TYR 2 3.436 17.633 -1.868
9 HA TYR 2 HA TYR 2 2.172 15.619 -0.562
10 1HB TYR 2 1HB TYR 2 0.814 16.839 -1.923
11 2HB TYR 2 2HB TYR 2 1.944 16.835 -3.279
12 HD1 TYR 2 HD1 TYR 2 0.145 14.104 -1.449
13 HD2 TYR 2 HD2 TYR 2 0.746 16.186 -5.159
14 HE1 TYR 2 HE1 TYR 2 -1.368 12.511 -2.586
15 HE2 TYR 2 HE2 TYR 2 -0.712 14.562 -6.308
16 HH TYR 2 HH TYR 2 -2.055 11.697 -4.670
17 H LEU 3 H LEU 3 3.657 15.090 -3.757
18 HA LEU 3 HA LEU 3 3.595 12.235 -3.265
19 1HB LEU 3 1HB LEU 3 4.428 12.166 -5.747
20 2HB LEU 3 2HB LEU 3 2.760 12.356 -5.228
21 HG LEU 3 HG LEU 3 2.850 14.746 -5.519
22 1HD1 LEU 3 1HD1 LEU 3 5.304 15.133 -5.231
23 2HD1 LEU 3 2HD1 LEU 3 5.603 14.275 -6.756
24 3HD1 LEU 3 3HD1 LEU 3 4.711 15.811 -6.759
25 1HD2 LEU 3 1HD2 LEU 3 3.648 13.179 -8.001
26 2HD2 LEU 3 2HD2 LEU 3 2.013 13.313 -7.321
27 3HD2 LEU 3 3HD2 LEU 3 2.812 14.745 -7.983
28 H ARG 4 H ARG 4 5.401 13.515 -1.570
29 HA ARG 4 HA ARG 4 8.114 13.311 -2.246
30 1HB ARG 4 1HB ARG 4 6.436 12.924 0.241
31 2HB ARG 4 2HB ARG 4 8.089 12.347 0.308
32 1HG ARG 4 1HG ARG 4 7.859 15.082 -0.831
33 2HG ARG 4 2HG ARG 4 7.272 14.943 0.830
34 1HD ARG 4 1HD ARG 4 9.704 15.525 0.654
35 2HD ARG 4 2HD ARG 4 9.323 14.082 1.624
36 HE ARG 4 HE ARG 4 9.918 13.511 -1.179
37 1HH1 ARG 4 1HH2 ARG 4 11.403 14.123 1.946
38 2HH1 ARG 4 2HH2 ARG 4 12.739 13.029 1.712
39 1HH2 ARG 4 1HH1 ARG 4 11.582 12.028 -1.512
40 2HH2 ARG 4 2HH1 ARG 4 12.873 11.834 -0.353
41 H GLU 5 H GLU 5 5.903 10.799 -1.120
42 HA GLU 5 HA GLU 5 7.858 8.654 -1.944
43 1HB GLU 5 1HB GLU 5 5.747 8.705 0.252
44 2HB GLU 5 2HB GLU 5 6.651 7.273 -0.265
45 1HG GLU 5 1HG GLU 5 8.795 8.423 0.276
46 2HG GLU 5 2HG GLU 5 7.896 9.836 0.840
47 H LEU 6 H LEU 6 4.669 9.935 -2.457
48 HA LEU 6 HA LEU 6 3.308 7.518 -2.992
49 1HB LEU 6 1HB LEU 6 2.627 10.341 -3.823
50 2HB LEU 6 2HB LEU 6 1.583 8.935 -3.969
51 HG LEU 6 HG LEU 6 1.163 8.715 -1.699
52 1HD1 LEU 6 1HD1 LEU 6 3.358 9.174 -0.667
53 2HD1 LEU 6 2HD1 LEU 6 3.260 10.871 -1.172
54 3HD1 LEU 6 3HD1 LEU 6 2.127 10.224 0.026
55 1HD2 LEU 6 1HD2 LEU 6 1.054 11.644 -2.041
56 2HD2 LEU 6 2HD2 LEU 6 0.222 10.600 -3.216
57 3HD2 LEU 6 3HD2 LEU 6 -0.187 10.461 -1.524
58 H LEU 7 H LEU 7 5.753 8.790 -4.841
59 HA LEU 7 HA LEU 7 4.659 7.706 -7.321
60 1HB LEU 7 1HB LEU 7 5.190 10.096 -7.414
61 2HB LEU 7 2HB LEU 7 6.856 9.795 -6.918
62 HG LEU 7 HG LEU 7 5.768 8.403 -9.372
63 1HD1 LEU 7 1HD1 LEU 7 5.071 10.767 -9.625
64 2HD1 LEU 7 2HD1 LEU 7 6.738 11.292 -9.309
65 3HD1 LEU 7 3HD1 LEU 7 6.356 10.351 -10.769
66 1HD2 LEU 7 1HD2 LEU 7 8.511 9.532 -8.657
67 2HD2 LEU 7 2HD2 LEU 7 8.066 7.815 -8.729
68 3HD2 LEU 7 3HD2 LEU 7 8.091 8.770 -10.205
69 H LYS 8 H LYS 8 7.612 7.872 -5.304
70 HA LYS 8 HA LYS 8 8.974 6.186 -7.075
71 1HB LYS 8 1HB LYS 8 9.999 7.854 -5.416
72 2HB LYS 8 2HB LYS 8 9.679 6.657 -4.146
73 1HG LYS 8 1HG LYS 8 11.045 4.996 -5.569
74 2HG LYS 8 2HG LYS 8 11.474 6.374 -6.599
75 1HD LYS 8 1HD LYS 8 12.435 7.522 -4.573
76 2HD LYS 8 2HD LYS 8 12.017 6.094 -3.601
77 1HE LYS 8 1HE LYS 8 13.453 4.690 -5.146
78 2HE LYS 8 2HE LYS 8 13.949 6.181 -5.971
79 1HZ LYS 8 1HZ LYS 8 14.832 6.947 -3.874
80 2HZ LYS 8 2HZ LYS 8 14.383 5.542 -3.137
81 3HZ LYS 8 3HZ LYS 8 15.522 5.519 -4.324
82 H LEU 9 H LEU 9 7.187 5.610 -4.075
83 HA LEU 9 HA LEU 9 8.017 2.789 -3.881
84 1HB LEU 9 1HB LEU 9 5.623 4.239 -2.682
85 2HB LEU 9 2HB LEU 9 6.116 2.578 -2.312
86 HG LEU 9 HG LEU 9 7.828 5.039 -1.761
87 1HD1 LEU 9 1HD1 LEU 9 5.755 4.993 -0.405
88 2HD1 LEU 9 2HD1 LEU 9 6.128 3.338 0.115
89 3HD1 LEU 9 3HD1 LEU 9 7.190 4.680 0.590
90 1HD2 LEU 9 1HD2 LEU 9 8.115 2.107 -0.934
91 2HD2 LEU 9 2HD2 LEU 9 9.210 3.004 -2.011
92 3HD2 LEU 9 3HD2 LEU 9 9.100 3.442 -0.306
93 H GLU 10 H GLU 10 5.299 4.664 -5.159
94 HA GLU 10 HA GLU 10 3.640 2.625 -6.030
95 1HB GLU 10 1HB GLU 10 4.171 5.537 -6.632
96 2HB GLU 10 2HB GLU 10 3.241 4.776 -7.842
97 1HG GLU 10 1HG GLU 10 1.679 5.653 -6.320
98 2HG GLU 10 2HG GLU 10 1.689 3.938 -5.930
99 H LEU 11 H LEU 11 6.302 4.196 -7.880
100 HA LEU 11 HA LEU 11 6.029 2.491 -10.188
101 1HB LEU 11 1HB LEU 11 7.283 4.622 -10.226
102 2HB LEU 11 2HB LEU 11 8.358 4.050 -8.948
103 HG LEU 11 HG LEU 11 9.297 2.327 -10.499
104 1HD1 LEU 11 1HD1 LEU 11 7.399 2.072 -12.062
105 2HD1 LEU 11 2HD1 LEU 11 7.578 3.764 -12.574
106 3HD1 LEU 11 3HD1 LEU 11 8.853 2.580 -12.931
107 1HD2 LEU 11 1HD2 LEU 11 9.420 5.208 -11.465
108 2HD2 LEU 11 2HD2 LEU 11 10.391 4.493 -10.159
109 3HD2 LEU 11 3HD2 LEU 11 10.602 3.930 -11.826
110 H GLN 12 H GLN 12 8.216 2.226 -7.304
111 HA GLN 12 HA GLN 12 9.636 0.009 -8.161
112 1HB GLN 12 1HB GLN 12 10.184 1.419 -6.259
113 2HB GLN 12 2HB GLN 12 8.769 0.872 -5.361
114 1HG GLN 12 1HG GLN 12 10.732 -1.210 -6.329
115 2HG GLN 12 2HG GLN 12 11.228 -0.107 -5.042
116 1HE2 GLN 12 2HE2 GLN 12 9.327 0.207 -3.285
117 2HE2 GLN 12 1HE2 GLN 12 8.706 -1.329 -2.701
118 H LEU 13 H LEU 13 6.428 0.092 -6.643
119 HA LEU 13 HA LEU 13 6.256 -2.681 -6.058
120 1HB LEU 13 1HB LEU 13 3.955 -0.783 -6.713
121 2HB LEU 13 2HB LEU 13 3.872 -2.358 -5.938
122 HG LEU 13 HG LEU 13 4.491 0.301 -4.832
123 1HD1 LEU 13 1HD1 LEU 13 2.531 -1.147 -4.309
124 2HD1 LEU 13 2HD1 LEU 13 3.631 -2.344 -3.586
125 3HD1 LEU 13 3HD1 LEU 13 3.516 -0.720 -2.890
126 1HD2 LEU 13 1HD2 LEU 13 6.061 -2.122 -3.779
127 2HD2 LEU 13 2HD2 LEU 13 6.777 -0.630 -4.419
128 3HD2 LEU 13 3HD2 LEU 13 5.851 -0.571 -2.932
129 H ILE 14 H ILE 14 5.002 -0.760 -8.832
130 HA ILE 14 HA ILE 14 3.934 -3.005 -10.282
131 HB ILE 14 HB ILE 14 4.797 -0.153 -10.915
132 1HG1 ILE 14 1HG1 ILE 14 2.490 0.135 -11.409
133 2HG1 ILE 14 2HG1 ILE 14 2.191 -1.599 -11.580
134 1HG2 ILE 14 1HG2 ILE 14 5.552 -1.376 -12.931
135 2HG2 ILE 14 2HG2 ILE 14 3.979 -2.202 -13.040
136 3HG2 ILE 14 3HG2 ILE 14 4.097 -0.449 -13.269
137 1HD1 ILE 14 1HD1 ILE 14 2.344 -1.932 -9.161
138 2HD1 ILE 14 2HD1 ILE 14 2.825 -0.233 -8.940
139 3HD1 ILE 14 3HD1 ILE 14 1.209 -0.652 -9.535
140 H LYS 15 H LYS 15 7.166 -1.535 -10.232
141 HA LYS 15 HA LYS 15 8.372 -3.363 -12.049
142 1HB LYS 15 1HB LYS 15 9.201 -1.217 -10.431
143 2HB LYS 15 2HB LYS 15 9.980 -2.582 -9.674
144 1HG LYS 15 1HG LYS 15 11.484 -1.626 -11.226
145 2HG LYS 15 2HG LYS 15 10.974 -3.161 -11.947
146 1HD LYS 15 1HD LYS 15 9.473 -2.036 -13.491
147 2HD LYS 15 2HD LYS 15 9.579 -0.510 -12.610
148 1HE LYS 15 1HE LYS 15 11.933 -1.814 -14.059
149 2HE LYS 15 2HE LYS 15 10.884 -0.570 -14.759
150 1HZ LYS 15 1HZ LYS 15 11.520 0.900 -12.995
151 2HZ LYS 15 2HZ LYS 15 12.529 -0.232 -12.353
152 3HZ LYS 15 3HZ LYS 15 12.838 0.395 -13.845
153 H GLN 16 H GLN 16 7.939 -3.642 -8.486
154 HA GLN 16 HA GLN 16 9.347 -6.167 -8.400
155 1HB GLN 16 1HB GLN 16 8.237 -4.272 -6.489
156 2HB GLN 16 2HB GLN 16 7.654 -5.884 -6.097
157 1HG GLN 16 1HG GLN 16 9.757 -5.343 -4.949
158 2HG GLN 16 2HG GLN 16 9.900 -6.755 -6.007
159 1HE2 GLN 16 2HE2 GLN 16 12.041 -6.752 -6.673
160 2HE2 GLN 16 1HE2 GLN 16 12.830 -5.354 -7.373
161 H TYR 17 H TYR 17 6.048 -5.276 -8.977
162 HA TYR 17 HA TYR 17 4.833 -7.844 -8.442
163 1HB TYR 17 1HB TYR 17 4.068 -5.244 -9.647
164 2HB TYR 17 2HB TYR 17 3.334 -6.595 -10.432
165 HD1 TYR 17 HD1 TYR 17 3.750 -5.021 -7.070
166 HD2 TYR 17 HD2 TYR 17 1.504 -7.802 -9.473
167 HE1 TYR 17 HE1 TYR 17 1.814 -4.735 -5.588
168 HE2 TYR 17 HE2 TYR 17 -0.456 -7.495 -7.986
169 HH TYR 17 HH TYR 17 -0.543 -4.865 -5.609
170 H ARG 18 H ARG 18 6.558 -6.384 -11.155
171 HA ARG 18 HA ARG 18 5.790 -8.494 -13.052
172 1HB ARG 18 1HB ARG 18 7.914 -6.320 -13.190
173 2HB ARG 18 2HB ARG 18 7.617 -7.514 -14.462
174 1HG ARG 18 1HG ARG 18 5.298 -6.756 -14.713
175 2HG ARG 18 2HG ARG 18 5.501 -5.596 -13.390
176 1HD ARG 18 1HD ARG 18 7.257 -4.423 -14.674
177 2HD ARG 18 2HD ARG 18 7.036 -5.572 -16.023
178 HE ARG 18 HE ARG 18 4.522 -4.426 -15.326
179 1HH1 ARG 18 1HH2 ARG 18 7.586 -3.507 -16.793
180 2HH1 ARG 18 2HH2 ARG 18 6.923 -2.201 -17.739
181 1HH2 ARG 18 1HH1 ARG 18 3.614 -2.735 -16.544
182 2HH2 ARG 18 2HH1 ARG 18 4.595 -1.749 -17.588
183 H GLU 19 H GLU 19 8.544 -7.614 -11.085
184 HA GLU 19 HA GLU 19 10.242 -9.795 -11.600
185 1HB GLU 19 1HB GLU 19 10.686 -7.701 -10.186
186 2HB GLU 19 2HB GLU 19 9.887 -8.566 -8.860
187 1HG GLU 19 1HG GLU 19 11.561 -10.378 -9.029
188 2HG GLU 19 2HG GLU 19 12.336 -9.537 -10.385
189 H ALA 20 H ALA 20 7.502 -9.553 -9.244
190 HA ALA 20 HA ALA 20 7.902 -12.322 -8.347
191 1HB ALA 20 1HB ALA 20 7.034 -10.857 -6.811
192 2HB ALA 20 2HB ALA 20 5.793 -10.227 -7.931
193 3HB ALA 20 3HB ALA 20 5.644 -11.868 -7.249
194 H LEU 21 H LEU 21 5.964 -10.852 -10.954
195 HA LEU 21 HA LEU 21 3.987 -12.701 -11.196
196 1HB LEU 21 1HB LEU 21 4.353 -10.646 -12.558
197 2HB LEU 21 2HB LEU 21 5.464 -11.537 -13.602
198 HG LEU 21 HG LEU 21 2.700 -12.661 -13.091
199 1HD1 LEU 21 1HD1 LEU 21 2.327 -10.243 -13.568
200 2HD1 LEU 21 2HD1 LEU 21 3.243 -10.415 -15.076
201 3HD1 LEU 21 3HD1 LEU 21 1.732 -11.324 -14.842
202 1HD2 LEU 21 1HD2 LEU 21 4.408 -12.572 -15.608
203 2HD2 LEU 21 2HD2 LEU 21 4.204 -13.984 -14.553
204 3HD2 LEU 21 3HD2 LEU 21 2.822 -13.350 -15.442
205 H GLU 22 H GLU 22 7.307 -13.178 -12.255
206 HA GLU 22 HA GLU 22 6.816 -15.650 -13.720
207 1HB GLU 22 1HB GLU 22 9.355 -15.812 -13.603
208 2HB GLU 22 2HB GLU 22 8.685 -14.452 -14.516
209 1HG GLU 22 1HG GLU 22 9.167 -12.893 -12.781
210 2HG GLU 22 2HG GLU 22 9.522 -14.183 -11.610
211 H TYR 23 H TYR 23 7.669 -14.765 -10.396
212 HA TYR 23 HA TYR 23 8.400 -17.466 -9.607
213 1HB TYR 23 1HB TYR 23 7.865 -14.806 -8.227
214 2HB TYR 23 2HB TYR 23 7.980 -16.264 -7.313
215 HD1 TYR 23 HD1 TYR 23 10.112 -17.807 -7.856
216 HD2 TYR 23 HD2 TYR 23 9.863 -13.556 -8.536
217 HE1 TYR 23 HE1 TYR 23 12.576 -17.622 -7.659
218 HE2 TYR 23 HE2 TYR 23 12.310 -13.377 -8.336
219 HH TYR 23 HH TYR 23 14.280 -14.502 -7.970
220 H VAL 24 H VAL 24 5.516 -15.399 -9.618
221 HA VAL 24 HA VAL 24 4.002 -17.392 -8.049
222 HB VAL 24 HB VAL 24 3.150 -14.739 -9.228
223 1HG1 VAL 24 1HG1 VAL 24 1.178 -16.113 -8.771
224 2HG1 VAL 24 2HG1 VAL 24 1.830 -16.606 -7.198
225 3HG1 VAL 24 3HG1 VAL 24 1.331 -14.931 -7.468
226 1HG2 VAL 24 1HG2 VAL 24 3.961 -15.476 -6.375
227 2HG2 VAL 24 2HG2 VAL 24 4.955 -14.517 -7.480
228 3HG2 VAL 24 3HG2 VAL 24 3.404 -13.885 -6.927
229 H LYS 25 H LYS 25 4.352 -16.482 -11.411
230 HA LYS 25 HA LYS 25 3.402 -17.122 -13.335
231 1HB LYS 25 1HB LYS 25 3.302 -19.825 -11.950
232 2HB LYS 25 2HB LYS 25 3.143 -19.520 -13.690
233 1HG LYS 25 1HG LYS 25 5.449 -18.252 -13.390
234 2HG LYS 25 2HG LYS 25 5.593 -19.256 -11.941
235 1HD LYS 25 1HD LYS 25 5.127 -20.202 -14.819
236 2HD LYS 25 2HD LYS 25 6.661 -20.281 -13.936
237 1HE LYS 25 1HE LYS 25 5.716 -21.870 -12.326
238 2HE LYS 25 2HE LYS 25 4.112 -21.742 -13.067
239 1HZ LYS 25 1HZ LYS 25 4.983 -22.654 -15.063
240 2HZ LYS 25 2HZ LYS 25 6.497 -22.770 -14.418
241 3HZ LYS 25 3HZ LYS 25 5.264 -23.676 -13.803
242 H LEU 26 H LEU 26 1.539 -15.689 -12.526
243 HA LEU 26 HA LEU 26 -0.903 -17.228 -13.142
244 1HB LEU 26 1HB LEU 26 -0.224 -16.159 -10.523
245 2HB LEU 26 2HB LEU 26 -1.638 -15.314 -11.122
246 HG LEU 26 HG LEU 26 -1.596 -18.329 -11.363
247 1HD1 LEU 26 1HD1 LEU 26 -0.774 -18.013 -9.106
248 2HD1 LEU 26 2HD1 LEU 26 -2.053 -16.833 -8.757
249 3HD1 LEU 26 3HD1 LEU 26 -2.466 -18.534 -9.057
250 1HD2 LEU 26 1HD2 LEU 26 -3.770 -16.372 -10.509
251 2HD2 LEU 26 2HD2 LEU 26 -3.493 -16.826 -12.203
252 3HD2 LEU 26 3HD2 LEU 26 -3.987 -18.053 -11.022
253 HA PRO 27 HA PRO 27 -1.245 -13.450 -15.584
254 1HB PRO 27 1HB PRO 27 -3.784 -13.778 -16.591
255 2HB PRO 27 2HB PRO 27 -2.324 -14.563 -17.254
256 1HG PRO 27 1HG PRO 27 -4.346 -15.734 -15.334
257 2HG PRO 27 2HG PRO 27 -3.650 -16.492 -16.796
258 1HD PRO 27 1HD PRO 27 -2.707 -17.053 -14.327
259 2HD PRO 27 2HD PRO 27 -1.576 -16.899 -15.698
260 H VAL 28 H VAL 28 -3.358 -14.549 -12.924
261 HA VAL 28 HA VAL 28 -4.747 -12.144 -12.481
262 HB VAL 28 HB VAL 28 -3.586 -13.951 -10.397
263 1HG1 VAL 28 1HG1 VAL 28 -4.116 -11.821 -9.355
264 2HG1 VAL 28 2HG1 VAL 28 -5.655 -11.716 -10.238
265 3HG1 VAL 28 3HG1 VAL 28 -5.440 -12.916 -8.968
266 1HG2 VAL 28 1HG2 VAL 28 -6.472 -13.806 -11.379
267 2HG2 VAL 28 2HG2 VAL 28 -5.335 -15.088 -11.856
268 3HG2 VAL 28 3HG2 VAL 28 -5.814 -14.905 -10.161
269 H LEU 29 H LEU 29 -1.186 -12.777 -12.089
270 HA LEU 29 HA LEU 29 -0.859 -10.453 -10.393
271 1HB LEU 29 1HB LEU 29 0.889 -12.432 -11.832
272 2HB LEU 29 2HB LEU 29 1.561 -10.868 -11.455
273 HG LEU 29 HG LEU 29 1.930 -12.722 -9.800
274 1HD1 LEU 29 1HD1 LEU 29 2.313 -10.337 -9.241
275 2HD1 LEU 29 2HD1 LEU 29 0.624 -10.177 -8.717
276 3HD1 LEU 29 3HD1 LEU 29 1.728 -11.243 -7.837
277 1HD2 LEU 29 1HD2 LEU 29 -0.987 -12.242 -9.109
278 2HD2 LEU 29 2HD2 LEU 29 -0.266 -13.734 -9.741
279 3HD2 LEU 29 3HD2 LEU 29 0.164 -13.142 -8.123
280 H ALA 30 H ALA 30 -0.163 -11.133 -13.868
281 HA ALA 30 HA ALA 30 0.266 -8.355 -14.566
282 1HB ALA 30 1HB ALA 30 0.652 -10.092 -16.283
283 2HB ALA 30 2HB ALA 30 -1.067 -10.554 -16.228
284 3HB ALA 30 3HB ALA 30 -0.578 -8.962 -16.837
285 H LYS 31 H LYS 31 -2.872 -10.053 -14.292
286 HA LYS 31 HA LYS 31 -4.063 -7.541 -15.175
287 1HB LYS 31 1HB LYS 31 -5.078 -10.249 -14.892
288 2HB LYS 31 2HB LYS 31 -6.151 -9.076 -14.114
289 1HG LYS 31 1HG LYS 31 -6.821 -9.270 -16.432
290 2HG LYS 31 2HG LYS 31 -6.133 -7.671 -16.148
291 1HD LYS 31 1HD LYS 31 -3.893 -8.652 -17.078
292 2HD LYS 31 2HD LYS 31 -4.861 -10.038 -17.594
293 1HE LYS 31 1HE LYS 31 -6.306 -8.468 -18.930
294 2HE LYS 31 2HE LYS 31 -5.321 -7.104 -18.364
295 1HZ LYS 31 1HZ LYS 31 -3.439 -8.063 -19.434
296 2HZ LYS 31 2HZ LYS 31 -4.331 -9.342 -19.976
297 3HZ LYS 31 3HZ LYS 31 -4.654 -7.818 -20.512
298 H ILE 32 H ILE 32 -3.288 -8.855 -11.973
299 HA ILE 32 HA ILE 32 -4.894 -6.683 -10.764
300 HB ILE 32 HB ILE 32 -2.583 -8.333 -9.710
301 1HG1 ILE 32 1HG1 ILE 32 -4.872 -9.432 -10.067
302 2HG1 ILE 32 2HG1 ILE 32 -4.184 -9.519 -8.440
303 1HG2 ILE 32 1HG2 ILE 32 -2.438 -6.222 -8.559
304 2HG2 ILE 32 2HG2 ILE 32 -4.187 -6.126 -8.406
305 3HG2 ILE 32 3HG2 ILE 32 -3.285 -7.330 -7.464
306 1HD1 ILE 32 1HD1 ILE 32 -5.751 -7.748 -7.711
307 2HD1 ILE 32 2HD1 ILE 32 -6.398 -7.647 -9.378
308 3HD1 ILE 32 3HD1 ILE 32 -6.591 -9.123 -8.430
309 H LEU 33 H LEU 33 -1.526 -7.061 -11.911
310 HA LEU 33 HA LEU 33 -0.623 -4.813 -10.508
311 1HB LEU 33 1HB LEU 33 1.429 -5.371 -11.203
312 2HB LEU 33 2HB LEU 33 0.544 -6.875 -11.360
313 HG LEU 33 HG LEU 33 0.436 -6.399 -13.841
314 1HD1 LEU 33 1HD1 LEU 33 0.974 -4.102 -14.062
315 2HD1 LEU 33 2HD1 LEU 33 2.331 -4.244 -12.921
316 3HD1 LEU 33 3HD1 LEU 33 2.423 -4.980 -14.546
317 1HD2 LEU 33 1HD2 LEU 33 3.185 -6.588 -12.541
318 2HD2 LEU 33 2HD2 LEU 33 2.034 -7.934 -12.475
319 3HD2 LEU 33 3HD2 LEU 33 2.664 -7.377 -14.038
320 H GLU 34 H GLU 34 -1.747 -5.355 -13.810
321 HA GLU 34 HA GLU 34 -1.132 -2.958 -15.126
322 1HB GLU 34 1HB GLU 34 -2.241 -5.209 -15.925
323 2HB GLU 34 2HB GLU 34 -3.755 -4.511 -15.441
324 1HG GLU 34 1HG GLU 34 -3.346 -2.578 -17.004
325 2HG GLU 34 2HG GLU 34 -1.775 -3.269 -17.436
326 H ASP 35 H ASP 35 -3.978 -3.729 -13.191
327 HA ASP 35 HA ASP 35 -5.295 -1.258 -13.678
328 1HB ASP 35 1HB ASP 35 -6.189 -3.468 -12.593
329 2HB ASP 35 2HB ASP 35 -5.648 -2.755 -11.070
330 H GLU 36 H GLU 36 -3.181 -2.268 -10.988
331 HA GLU 36 HA GLU 36 -3.085 0.137 -9.514
332 1HB GLU 36 1HB GLU 36 -0.826 -1.851 -9.983
333 2HB GLU 36 2HB GLU 36 -0.936 -0.662 -8.680
334 1HG GLU 36 1HG GLU 36 -2.896 -2.976 -9.041
335 2HG GLU 36 2HG GLU 36 -1.498 -2.972 -7.968
336 H GLU 37 H GLU 37 -1.160 -0.812 -12.427
337 HA GLU 37 HA GLU 37 0.565 1.301 -12.442
338 1HB GLU 37 1HB GLU 37 0.090 -0.936 -13.924
339 2HB GLU 37 2HB GLU 37 -0.614 0.214 -15.047
340 1HG GLU 37 1HG GLU 37 2.138 0.517 -13.776
341 2HG GLU 37 2HG GLU 37 1.823 -0.476 -15.197
342 H LYS 38 H LYS 38 -2.794 1.232 -13.654
343 HA LYS 38 HA LYS 38 -2.648 3.943 -14.722
344 1HB LYS 38 1HB LYS 38 -4.249 1.940 -15.348
345 2HB LYS 38 2HB LYS 38 -5.153 2.426 -13.915
346 1HG LYS 38 1HG LYS 38 -6.222 3.604 -15.668
347 2HG LYS 38 2HG LYS 38 -5.140 4.825 -14.973
348 1HD LYS 38 1HD LYS 38 -3.415 3.993 -16.795
349 2HD LYS 38 2HD LYS 38 -4.803 3.209 -17.542
350 1HE LYS 38 1HE LYS 38 -4.438 6.191 -16.962
351 2HE LYS 38 2HE LYS 38 -4.373 5.410 -18.545
352 1HZ LYS 38 1HZ LYS 38 -6.684 4.806 -18.256
353 2HZ LYS 38 2HZ LYS 38 -6.730 5.578 -16.799
354 3HZ LYS 38 3HZ LYS 38 -6.475 6.439 -18.179
355 H HIS 39 H HIS 39 -3.857 2.532 -11.677
356 HA HIS 39 HA HIS 39 -4.897 4.938 -10.564
357 1HB HIS 39 1HB HIS 39 -3.567 2.508 -9.328
358 2HB HIS 39 2HB HIS 39 -4.250 3.787 -8.355
359 HD1 HIS 39 HD1 HIS 39 -7.027 4.290 -9.657
360 HD2 HIS 39 HD2 HIS 39 -5.225 0.493 -9.345
361 HE1 HIS 39 HE1 HIS 39 -8.908 2.538 -9.859
362 HE2 HIS 39 HE2 HIS 39 -7.776 0.251 -9.694
363 H ILE 40 H ILE 40 -1.596 3.709 -10.742
364 HA ILE 40 HA ILE 40 -0.381 5.765 -9.089
365 HB ILE 40 HB ILE 40 0.625 3.600 -10.969
366 1HG1 ILE 40 1HG1 ILE 40 1.302 4.035 -8.073
367 2HG1 ILE 40 2HG1 ILE 40 -0.244 3.324 -8.461
368 1HG2 ILE 40 1HG2 ILE 40 2.276 5.309 -11.291
369 2HG2 ILE 40 2HG2 ILE 40 2.266 5.742 -9.566
370 3HG2 ILE 40 3HG2 ILE 40 2.952 4.196 -10.107
371 1HD1 ILE 40 1HD1 ILE 40 0.879 1.554 -9.767
372 2HD1 ILE 40 2HD1 ILE 40 2.454 2.192 -9.274
373 3HD1 ILE 40 3HD1 ILE 40 1.339 1.550 -8.051
374 H GLU 41 H GLU 41 -0.663 5.117 -12.590
375 HA GLU 41 HA GLU 41 0.724 7.208 -13.631
376 1HB GLU 41 1HB GLU 41 -0.611 5.397 -14.884
377 2HB GLU 41 2HB GLU 41 -2.033 6.441 -14.670
378 1HG GLU 41 1HG GLU 41 -0.582 8.285 -15.798
379 2HG GLU 41 2HG GLU 41 0.493 6.957 -16.258
380 H TRP 42 H TRP 42 -2.615 7.442 -12.247
381 HA TRP 42 HA TRP 42 -3.190 10.045 -12.990
382 1HB TRP 42 1HB TRP 42 -4.541 8.348 -11.631
383 2HB TRP 42 2HB TRP 42 -3.700 8.938 -10.214
384 HD1 TRP 42 HD1 TRP 42 -5.974 10.172 -12.969
385 HE1 TRP 42 HE1 TRP 42 -7.198 12.430 -12.220
386 HE3 TRP 42 HE3 TRP 42 -3.595 10.844 -8.625
387 HZ2 TRP 42 HZ2 TRP 42 -7.097 14.169 -9.902
388 HZ3 TRP 42 HZ3 TRP 42 -4.040 12.838 -7.167
389 HH2 TRP 42 HH2 TRP 42 -5.844 14.438 -7.769
390 H LEU 43 H LEU 43 -1.107 8.977 -10.355
391 HA LEU 43 HA LEU 43 -0.638 11.639 -9.227
392 1HB LEU 43 1HB LEU 43 0.829 8.975 -8.791
393 2HB LEU 43 2HB LEU 43 1.162 10.488 -7.963
394 HG LEU 43 HG LEU 43 -1.521 10.319 -7.503
395 1HD1 LEU 43 1HD1 LEU 43 -1.580 8.061 -8.647
396 2HD1 LEU 43 2HD1 LEU 43 -0.499 7.445 -7.384
397 3HD1 LEU 43 3HD1 LEU 43 -2.126 8.025 -6.975
398 1HD2 LEU 43 1HD2 LEU 43 0.656 8.925 -5.917
399 2HD2 LEU 43 2HD2 LEU 43 0.313 10.662 -5.815
400 3HD2 LEU 43 3HD2 LEU 43 -0.887 9.483 -5.249
401 H GLU 44 H GLU 44 1.044 9.343 -11.373
402 HA GLU 44 HA GLU 44 3.360 11.090 -11.652
403 1HB GLU 44 1HB GLU 44 2.653 8.710 -13.396
404 2HB GLU 44 2HB GLU 44 4.227 9.467 -13.139
405 1HG GLU 44 1HG GLU 44 3.969 8.826 -10.657
406 2HG GLU 44 2HG GLU 44 2.616 7.811 -11.151
407 H THR 45 H THR 45 0.563 12.123 -12.544
408 HA THR 45 HA THR 45 1.644 13.395 -14.959
409 HB THR 45 HB THR 45 0.360 11.283 -15.548
410 HG1 THR 45 HG1 THR 45 -0.220 12.208 -17.417
411 1HG2 THR 45 1HG2 THR 45 -1.628 11.503 -14.158
412 2HG2 THR 45 2HG2 THR 45 -2.136 12.928 -15.103
413 3HG2 THR 45 3HG2 THR 45 -2.003 11.334 -15.867
414 H ILE 46 H ILE 46 -1.219 13.017 -12.965
415 HA ILE 46 HA ILE 46 -2.540 14.272 -11.830
416 HB ILE 46 HB ILE 46 -0.601 14.317 -10.431
417 1HG1 ILE 46 1HG1 ILE 46 -1.015 16.287 -9.028
418 2HG1 ILE 46 2HG1 ILE 46 -2.091 16.953 -10.256
419 1HG2 ILE 46 1HG2 ILE 46 1.143 15.313 -11.622
420 2HG2 ILE 46 2HG2 ILE 46 0.247 16.844 -11.844
421 3HG2 ILE 46 3HG2 ILE 46 0.858 16.353 -10.249
422 1HD1 ILE 46 1HD1 ILE 46 -3.563 14.936 -9.965
423 2HD1 ILE 46 2HD1 ILE 46 -2.371 14.256 -8.835
424 3HD1 ILE 46 3HD1 ILE 46 -3.261 15.729 -8.408
425 H LEU 47 H LEU 47 -3.721 16.378 -11.529
426 HA LEU 47 HA LEU 47 -4.115 17.610 -14.170
427 1HB LEU 47 1HB LEU 47 -5.440 17.859 -11.465
428 2HB LEU 47 2HB LEU 47 -5.695 19.095 -12.691
429 HG LEU 47 HG LEU 47 -7.463 17.382 -12.633
430 1HD1 LEU 47 1HD1 LEU 47 -7.016 18.754 -14.656
431 2HD1 LEU 47 2HD1 LEU 47 -6.001 17.450 -15.306
432 3HD1 LEU 47 3HD1 LEU 47 -7.724 17.173 -15.022
433 1HD2 LEU 47 1HD2 LEU 47 -5.421 15.466 -13.835
434 2HD2 LEU 47 2HD2 LEU 47 -6.061 15.373 -12.178
435 3HD2 LEU 47 3HD2 LEU 47 -7.143 15.169 -13.568
436 H GLY 48 H GLY 48 -1.909 18.215 -14.350
437 1HA GLY 48 1HA GLY 48 -1.360 20.975 -13.787
438 2HA GLY 48 2HA GLY 48 -0.456 19.911 -12.684
439 1HN NH2 49 1HN NH2 49 0.170 17.695 -14.202
440 2HN NH2 49 2HN NH2 49 1.157 18.161 -15.613
441 1H ACE 0 H1 ACE 0 7.317 -16.786 1.876
442 2H ACE 0 H2 ACE 0 5.695 -16.124 1.586
443 3H ACE 0 H3 ACE 0 6.598 -16.869 0.250
444 H ASP 1 H ASP 1 8.934 -15.845 0.069
445 HA ASP 1 HA ASP 1 9.614 -13.257 0.741
446 1HB ASP 1 1HB ASP 1 11.169 -14.717 -0.389
447 2HB ASP 1 2HB ASP 1 10.168 -14.734 -1.856
448 H TYR 2 H TYR 2 7.876 -14.271 -2.236
449 HA TYR 2 HA TYR 2 7.427 -11.789 -3.343
450 1HB TYR 2 1HB TYR 2 5.434 -14.076 -3.424
451 2HB TYR 2 2HB TYR 2 5.828 -12.905 -4.672
452 HD1 TYR 2 HD1 TYR 2 6.089 -16.242 -4.045
453 HD2 TYR 2 HD2 TYR 2 8.680 -12.931 -5.025
454 HE1 TYR 2 HE1 TYR 2 7.973 -17.808 -4.392
455 HE2 TYR 2 HE2 TYR 2 10.562 -14.489 -5.310
456 HH TYR 2 HH TYR 2 11.240 -16.702 -5.280
457 H LEU 3 H LEU 3 5.403 -13.545 -0.966
458 HA LEU 3 HA LEU 3 3.360 -11.552 -0.991
459 1HB LEU 3 1HB LEU 3 4.055 -13.564 1.209
460 2HB LEU 3 2HB LEU 3 2.537 -12.676 1.093
461 HG LEU 3 HG LEU 3 3.506 -14.709 -0.974
462 1HD1 LEU 3 1HD1 LEU 3 3.048 -15.761 1.210
463 2HD1 LEU 3 2HD1 LEU 3 1.450 -14.986 1.257
464 3HD1 LEU 3 3HD1 LEU 3 1.816 -16.202 0.016
465 1HD2 LEU 3 1HD2 LEU 3 0.811 -13.315 -0.593
466 2HD2 LEU 3 2HD2 LEU 3 1.935 -13.069 -1.949
467 3HD2 LEU 3 3HD2 LEU 3 1.133 -14.630 -1.738
468 H ARG 4 H ARG 4 6.089 -12.052 1.285
469 HA ARG 4 HA ARG 4 5.319 -9.788 2.860
470 1HB ARG 4 1HB ARG 4 7.519 -9.797 3.818
471 2HB ARG 4 2HB ARG 4 6.912 -11.460 3.721
472 1HG ARG 4 1HG ARG 4 8.285 -11.918 1.813
473 2HG ARG 4 2HG ARG 4 8.756 -10.223 1.625
474 1HD ARG 4 1HD ARG 4 10.615 -11.061 2.549
475 2HD ARG 4 2HD ARG 4 9.796 -10.460 4.006
476 HE ARG 4 HE ARG 4 8.986 -13.131 3.672
477 1HH1 ARG 4 1HH2 ARG 4 11.987 -11.368 4.181
478 2HH1 ARG 4 2HH2 ARG 4 12.898 -12.734 4.753
479 1HH2 ARG 4 1HH1 ARG 4 10.151 -14.973 4.395
480 2HH2 ARG 4 2HH1 ARG 4 11.818 -14.842 4.886
481 H GLU 5 H GLU 5 6.464 -9.857 -0.373
482 HA GLU 5 HA GLU 5 7.701 -7.131 -0.176
483 1HB GLU 5 1HB GLU 5 7.553 -9.213 -2.380
484 2HB GLU 5 2HB GLU 5 8.091 -7.551 -2.658
485 1HG GLU 5 1HG GLU 5 9.947 -7.834 -1.123
486 2HG GLU 5 2HG GLU 5 9.369 -9.422 -0.615
487 H LEU 6 H LEU 6 5.414 -8.842 -2.314
488 HA LEU 6 HA LEU 6 4.334 -6.455 -3.391
489 1HB LEU 6 1HB LEU 6 3.315 -9.320 -3.406
490 2HB LEU 6 2HB LEU 6 2.537 -7.973 -4.239
491 HG LEU 6 HG LEU 6 4.606 -7.687 -5.692
492 1HD1 LEU 6 1HD1 LEU 6 6.230 -8.819 -4.161
493 2HD1 LEU 6 2HD1 LEU 6 5.526 -10.357 -4.731
494 3HD1 LEU 6 3HD1 LEU 6 6.254 -9.170 -5.853
495 1HD2 LEU 6 1HD2 LEU 6 3.214 -10.386 -5.713
496 2HD2 LEU 6 2HD2 LEU 6 2.520 -8.875 -6.335
497 3HD2 LEU 6 3HD2 LEU 6 3.948 -9.552 -7.094
498 H LEU 7 H LEU 7 3.628 -7.947 -0.313
499 HA LEU 7 HA LEU 7 0.960 -6.813 -0.285
500 1HB LEU 7 1HB LEU 7 1.380 -9.185 0.524
501 2HB LEU 7 2HB LEU 7 2.295 -8.473 1.863
502 HG LEU 7 HG LEU 7 0.127 -7.068 2.311
503 1HD1 LEU 7 1HD1 LEU 7 -0.938 -7.776 0.097
504 2HD1 LEU 7 2HD1 LEU 7 -1.096 -9.399 0.773
505 3HD1 LEU 7 3HD1 LEU 7 -1.942 -8.017 1.517
506 1HD2 LEU 7 1HD2 LEU 7 0.126 -10.068 2.822
507 2HD2 LEU 7 2HD2 LEU 7 1.012 -8.860 3.778
508 3HD2 LEU 7 3HD2 LEU 7 -0.752 -8.821 3.743
509 H LYS 8 H LYS 8 3.928 -6.767 1.746
510 HA LYS 8 HA LYS 8 2.929 -4.793 3.484
511 1HB LYS 8 1HB LYS 8 5.676 -5.890 2.925
512 2HB LYS 8 2HB LYS 8 5.465 -4.546 4.042
513 1HG LYS 8 1HG LYS 8 4.239 -5.733 5.580
514 2HG LYS 8 2HG LYS 8 3.736 -6.990 4.432
515 1HD LYS 8 1HD LYS 8 5.785 -8.098 4.493
516 2HD LYS 8 2HD LYS 8 6.683 -6.686 5.040
517 1HE LYS 8 1HE LYS 8 6.386 -8.490 6.789
518 2HE LYS 8 2HE LYS 8 5.868 -6.871 7.279
519 1HZ LYS 8 1HZ LYS 8 3.625 -7.495 6.840
520 2HZ LYS 8 2HZ LYS 8 4.072 -8.994 6.331
521 3HZ LYS 8 3HZ LYS 8 4.297 -8.553 7.901
522 H LEU 9 H LEU 9 4.992 -4.762 0.565
523 HA LEU 9 HA LEU 9 5.679 -1.955 0.837
524 1HB LEU 9 1HB LEU 9 5.712 -3.681 -1.658
525 2HB LEU 9 2HB LEU 9 6.540 -2.137 -1.421
526 HG LEU 9 HG LEU 9 7.166 -4.640 0.214
527 1HD1 LEU 9 1HD1 LEU 9 7.726 -4.903 -2.196
528 2HD1 LEU 9 2HD1 LEU 9 8.699 -3.422 -2.112
529 3HD1 LEU 9 3HD1 LEU 9 9.160 -4.845 -1.158
530 1HD2 LEU 9 1HD2 LEU 9 8.570 -1.950 0.018
531 2HD2 LEU 9 2HD2 LEU 9 7.749 -2.628 1.445
532 3HD2 LEU 9 3HD2 LEU 9 9.210 -3.397 0.825
533 H GLU 10 H GLU 10 3.017 -3.737 -0.654
534 HA GLU 10 HA GLU 10 1.722 -1.511 -1.926
535 1HB GLU 10 1HB GLU 10 0.952 -4.282 -1.039
536 2HB GLU 10 2HB GLU 10 -0.266 -3.099 -1.378
537 1HG GLU 10 1HG GLU 10 1.889 -3.880 -3.383
538 2HG GLU 10 2HG GLU 10 0.325 -4.675 -3.266
539 H LEU 11 H LEU 11 1.326 -3.033 1.305
540 HA LEU 11 HA LEU 11 -0.677 -1.323 2.263
541 1HB LEU 11 1HB LEU 11 1.229 -3.206 3.432
542 2HB LEU 11 2HB LEU 11 1.145 -1.761 4.430
543 HG LEU 11 HG LEU 11 -1.381 -1.982 4.420
544 1HD1 LEU 11 1HD1 LEU 11 -1.608 -3.453 2.418
545 2HD1 LEU 11 2HD1 LEU 11 -0.718 -4.736 3.260
546 3HD1 LEU 11 3HD1 LEU 11 -2.308 -4.214 3.855
547 1HD2 LEU 11 1HD2 LEU 11 0.247 -4.284 5.582
548 2HD2 LEU 11 2HD2 LEU 11 0.007 -2.688 6.326
549 3HD2 LEU 11 3HD2 LEU 11 -1.373 -3.780 6.114
550 H GLN 12 H GLN 12 2.860 -0.794 2.348
551 HA GLN 12 HA GLN 12 2.833 1.705 3.643
552 1HB GLN 12 1HB GLN 12 4.727 0.435 1.658
553 2HB GLN 12 2HB GLN 12 4.878 2.152 2.011
554 1HG GLN 12 1HG GLN 12 6.348 1.121 3.507
555 2HG GLN 12 2HG GLN 12 4.961 1.609 4.476
556 1HE2 GLN 12 2HE2 GLN 12 6.633 -1.149 2.958
557 2HE2 GLN 12 1HE2 GLN 12 5.848 -2.363 3.955
558 H LEU 13 H LEU 13 1.738 1.045 0.346
559 HA LEU 13 HA LEU 13 1.930 3.790 -0.555
560 1HB LEU 13 1HB LEU 13 0.046 1.638 -1.615
561 2HB LEU 13 2HB LEU 13 0.507 3.175 -2.326
562 HG LEU 13 HG LEU 13 2.106 0.657 -2.057
563 1HD1 LEU 13 1HD1 LEU 13 0.630 0.881 -3.995
564 2HD1 LEU 13 2HD1 LEU 13 1.258 2.490 -4.342
565 3HD1 LEU 13 3HD1 LEU 13 2.295 1.084 -4.573
566 1HD2 LEU 13 1HD2 LEU 13 3.194 3.424 -2.599
567 2HD2 LEU 13 2HD2 LEU 13 3.755 2.238 -1.412
568 3HD2 LEU 13 3HD2 LEU 13 4.013 1.944 -3.137
569 H ILE 14 H ILE 14 -0.733 1.640 0.565
570 HA ILE 14 HA ILE 14 -2.781 3.672 0.546
571 HB ILE 14 HB ILE 14 -2.417 0.990 1.936
572 1HG1 ILE 14 1HG1 ILE 14 -4.107 0.210 0.424
573 2HG1 ILE 14 2HG1 ILE 14 -4.479 1.836 -0.140
574 1HG2 ILE 14 1HG2 ILE 14 -3.869 2.236 3.455
575 2HG2 ILE 14 2HG2 ILE 14 -4.862 2.799 2.092
576 3HG2 ILE 14 3HG2 ILE 14 -4.838 1.084 2.530
577 1HD1 ILE 14 1HD1 ILE 14 -2.401 1.968 -1.369
578 2HD1 ILE 14 2HD1 ILE 14 -1.875 0.405 -0.683
579 3HD1 ILE 14 3HD1 ILE 14 -3.264 0.496 -1.784
580 H LYS 15 H LYS 15 -0.374 2.757 2.914
581 HA LYS 15 HA LYS 15 -1.279 4.430 5.058
582 1HB LYS 15 1HB LYS 15 0.699 2.490 4.762
583 2HB LYS 15 2HB LYS 15 1.652 3.959 4.769
584 1HG LYS 15 1HG LYS 15 1.568 3.315 7.006
585 2HG LYS 15 2HG LYS 15 0.332 4.581 6.923
586 1HD LYS 15 1HD LYS 15 -1.421 2.757 6.654
587 2HD LYS 15 2HD LYS 15 -0.130 1.549 6.757
588 1HE LYS 15 1HE LYS 15 0.449 2.392 9.048
589 2HE LYS 15 2HE LYS 15 -0.908 3.532 8.948
590 1HZ LYS 15 1HZ LYS 15 -2.370 1.644 8.714
591 2HZ LYS 15 2HZ LYS 15 -1.099 0.602 8.824
592 3HZ LYS 15 3HZ LYS 15 -1.502 1.545 10.112
593 H GLN 16 H GLN 16 1.200 4.869 2.443
594 HA GLN 16 HA GLN 16 1.746 7.579 3.325
595 1HB GLN 16 1HB GLN 16 2.593 5.890 0.984
596 2HB GLN 16 2HB GLN 16 2.730 7.640 0.863
597 1HG GLN 16 1HG GLN 16 4.818 6.766 1.682
598 2HG GLN 16 2HG GLN 16 4.058 7.784 2.901
599 1HE2 GLN 16 2HE2 GLN 16 5.435 4.694 2.268
600 2HE2 GLN 16 1HE2 GLN 16 5.005 3.973 3.815
601 H TYR 17 H TYR 17 -0.554 6.235 1.066
602 HA TYR 17 HA TYR 17 -1.458 8.648 -0.184
603 1HB TYR 17 1HB TYR 17 -2.632 5.885 0.335
604 2HB TYR 17 2HB TYR 17 -3.619 7.157 -0.305
605 HD1 TYR 17 HD1 TYR 17 -3.111 8.272 -2.523
606 HD2 TYR 17 HD2 TYR 17 -2.003 4.302 -1.398
607 HE1 TYR 17 HE1 TYR 17 -2.655 7.715 -4.853
608 HE2 TYR 17 HE2 TYR 17 -1.313 3.822 -3.643
609 HH TYR 17 HH TYR 17 -1.487 4.470 -5.809
610 H ARG 18 H ARG 18 -2.155 7.012 2.907
611 HA ARG 18 HA ARG 18 -4.395 8.742 3.568
612 1HB ARG 18 1HB ARG 18 -2.847 6.685 5.146
613 2HB ARG 18 2HB ARG 18 -3.815 7.919 5.956
614 1HG ARG 18 1HG ARG 18 -5.774 7.252 4.483
615 2HG ARG 18 2HG ARG 18 -4.820 5.842 3.979
616 1HD ARG 18 1HD ARG 18 -4.723 5.061 6.305
617 2HD ARG 18 2HD ARG 18 -5.430 6.594 6.873
618 HE ARG 18 HE ARG 18 -7.115 5.199 4.968
619 1HH1 ARG 18 1HH2 ARG 18 -6.215 5.365 8.374
620 2HH1 ARG 18 2HH2 ARG 18 -7.772 4.860 8.969
621 1HH2 ARG 18 1HH1 ARG 18 -9.156 4.533 5.711
622 2HH2 ARG 18 2HH1 ARG 18 -9.483 4.356 7.410
623 H GLU 19 H GLU 19 -1.009 8.528 4.431
624 HA GLU 19 HA GLU 19 -0.752 10.829 6.037
625 1HB GLU 19 1HB GLU 19 1.021 9.065 5.489
626 2HB GLU 19 2HB GLU 19 1.290 9.956 3.982
627 1HG GLU 19 1HG GLU 19 1.793 12.007 5.330
628 2HG GLU 19 2HG GLU 19 1.638 11.031 6.802
629 H ALA 20 H ALA 20 -0.672 10.505 2.443
630 HA ALA 20 HA ALA 20 -0.266 13.391 2.160
631 1HB ALA 20 1HB ALA 20 0.059 11.126 0.495
632 2HB ALA 20 2HB ALA 20 -1.025 12.262 -0.329
633 3HB ALA 20 3HB ALA 20 0.582 12.775 0.236
634 H LEU 21 H LEU 21 -3.062 11.311 2.369
635 HA LEU 21 HA LEU 21 -4.981 12.711 1.022
636 1HB LEU 21 1HB LEU 21 -5.011 10.604 2.770
637 2HB LEU 21 2HB LEU 21 -5.784 11.807 3.776
638 HG LEU 21 HG LEU 21 -7.528 10.666 2.757
639 1HD1 LEU 21 1HD1 LEU 21 -7.843 13.116 2.383
640 2HD1 LEU 21 2HD1 LEU 21 -7.182 12.929 0.739
641 3HD1 LEU 21 3HD1 LEU 21 -8.669 12.096 1.196
642 1HD2 LEU 21 1HD2 LEU 21 -5.823 10.625 0.255
643 2HD2 LEU 21 2HD2 LEU 21 -6.322 9.266 1.271
644 3HD2 LEU 21 3HD2 LEU 21 -7.528 10.118 0.296
645 H GLU 22 H GLU 22 -3.636 13.449 4.218
646 HA GLU 22 HA GLU 22 -5.592 15.530 4.739
647 1HB GLU 22 1HB GLU 22 -4.162 16.063 6.725
648 2HB GLU 22 2HB GLU 22 -4.942 14.475 6.702
649 1HG GLU 22 1HG GLU 22 -2.893 13.371 6.117
650 2HG GLU 22 2HG GLU 22 -2.061 14.923 5.850
651 H TYR 23 H TYR 23 -2.309 15.173 3.562
652 HA TYR 23 HA TYR 23 -1.479 17.878 3.639
653 1HB TYR 23 1HB TYR 23 -0.346 15.416 2.991
654 2HB TYR 23 2HB TYR 23 -0.394 16.221 1.428
655 HD1 TYR 23 HD1 TYR 23 1.362 15.784 4.513
656 HD2 TYR 23 HD2 TYR 23 0.637 18.675 1.391
657 HE1 TYR 23 HE1 TYR 23 3.406 17.013 5.170
658 HE2 TYR 23 HE2 TYR 23 2.674 19.907 2.070
659 HH TYR 23 HH TYR 23 4.687 19.706 3.301
660 H VAL 24 H VAL 24 -3.345 16.007 1.286
661 HA VAL 24 HA VAL 24 -3.442 18.403 -0.542
662 HB VAL 24 HB VAL 24 -4.145 15.513 -1.106
663 1HG1 VAL 24 1HG1 VAL 24 -5.377 17.107 -2.586
664 2HG1 VAL 24 2HG1 VAL 24 -3.852 17.924 -2.965
665 3HG1 VAL 24 3HG1 VAL 24 -4.119 16.247 -3.479
666 1HG2 VAL 24 1HG2 VAL 24 -1.700 17.228 -1.749
667 2HG2 VAL 24 2HG2 VAL 24 -1.736 15.734 -0.782
668 3HG2 VAL 24 3HG2 VAL 24 -2.083 15.684 -2.525
669 H LYS 25 H LYS 25 -5.654 16.149 1.094
670 HA LYS 25 HA LYS 25 -7.873 16.104 1.400
671 1HB LYS 25 1HB LYS 25 -7.684 19.119 1.052
672 2HB LYS 25 2HB LYS 25 -9.095 18.251 1.655
673 1HG LYS 25 1HG LYS 25 -7.935 17.439 3.576
674 2HG LYS 25 2HG LYS 25 -6.364 17.982 2.967
675 1HD LYS 25 1HD LYS 25 -6.899 20.279 3.161
676 2HD LYS 25 2HD LYS 25 -8.611 19.969 3.487
677 1HE LYS 25 1HE LYS 25 -6.331 19.046 5.307
678 2HE LYS 25 2HE LYS 25 -7.204 20.571 5.521
679 1HZ LYS 25 1HZ LYS 25 -9.226 19.338 5.761
680 2HZ LYS 25 2HZ LYS 25 -8.431 17.908 5.581
681 3HZ LYS 25 3HZ LYS 25 -8.120 18.863 6.885
682 H LEU 26 H LEU 26 -7.144 15.255 -1.057
683 HA LEU 26 HA LEU 26 -9.407 16.155 -2.796
684 1HB LEU 26 1HB LEU 26 -6.660 15.403 -3.411
685 2HB LEU 26 2HB LEU 26 -7.788 14.363 -4.262
686 HG LEU 26 HG LEU 26 -8.253 17.342 -4.351
687 1HD1 LEU 26 1HD1 LEU 26 -5.928 17.179 -4.988
688 2HD1 LEU 26 2HD1 LEU 26 -6.245 15.756 -5.997
689 3HD1 LEU 26 3HD1 LEU 26 -6.881 17.346 -6.469
690 1HD2 LEU 26 1HD2 LEU 26 -8.663 15.100 -6.397
691 2HD2 LEU 26 2HD2 LEU 26 -9.928 15.648 -5.281
692 3HD2 LEU 26 3HD2 LEU 26 -9.275 16.756 -6.500
693 HA PRO 27 HA PRO 27 -11.007 12.244 -1.115
694 1HB PRO 27 1HB PRO 27 -13.356 12.063 -2.545
695 2HB PRO 27 2HB PRO 27 -13.131 13.095 -1.108
696 1HG PRO 27 1HG PRO 27 -12.921 13.912 -4.013
697 2HG PRO 27 2HG PRO 27 -13.815 14.738 -2.706
698 1HD PRO 27 1HD PRO 27 -11.374 15.572 -3.462
699 2HD PRO 27 2HD PRO 27 -11.786 15.548 -1.725
700 H VAL 28 H VAL 28 -10.631 13.023 -4.570
701 HA VAL 28 HA VAL 28 -10.768 10.562 -5.810
702 HB VAL 28 HB VAL 28 -8.727 12.724 -6.182
703 1HG1 VAL 28 1HG1 VAL 28 -7.770 10.756 -7.173
704 2HG1 VAL 28 2HG1 VAL 28 -9.325 10.292 -7.907
705 3HG1 VAL 28 3HG1 VAL 28 -8.436 11.709 -8.495
706 1HG2 VAL 28 1HG2 VAL 28 -11.204 12.055 -7.830
707 2HG2 VAL 28 2HG2 VAL 28 -11.058 13.447 -6.725
708 3HG2 VAL 28 3HG2 VAL 28 -10.046 13.346 -8.173
709 H LEU 29 H LEU 29 -8.165 11.683 -3.549
710 HA LEU 29 HA LEU 29 -6.287 9.682 -4.266
711 1HB LEU 29 1HB LEU 29 -6.730 11.270 -1.698
712 2HB LEU 29 2HB LEU 29 -5.300 10.351 -2.148
713 HG LEU 29 HG LEU 29 -6.325 12.931 -3.339
714 1HD1 LEU 29 1HD1 LEU 29 -4.941 13.110 -1.333
715 2HD1 LEU 29 2HD1 LEU 29 -3.678 12.114 -2.084
716 3HD1 LEU 29 3HD1 LEU 29 -4.055 13.719 -2.743
717 1HD2 LEU 29 1HD2 LEU 29 -4.172 11.131 -4.503
718 2HD2 LEU 29 2HD2 LEU 29 -5.681 11.653 -5.291
719 3HD2 LEU 29 3HD2 LEU 29 -4.431 12.842 -4.925
720 H ALA 30 H ALA 30 -8.820 9.898 -1.724
721 HA ALA 30 HA ALA 30 -8.284 7.242 -0.600
722 1HB ALA 30 1HB ALA 30 -9.545 8.982 0.663
723 2HB ALA 30 2HB ALA 30 -10.820 8.954 -0.577
724 3HB ALA 30 3HB ALA 30 -10.504 7.514 0.409
725 H LYS 31 H LYS 31 -10.309 8.487 -3.311
726 HA LYS 31 HA LYS 31 -11.617 5.908 -3.488
727 1HB LYS 31 1HB LYS 31 -12.363 8.237 -4.417
728 2HB LYS 31 2HB LYS 31 -11.351 7.852 -5.822
729 1HG LYS 31 1HG LYS 31 -12.665 5.768 -6.167
730 2HG LYS 31 2HG LYS 31 -13.614 6.124 -4.709
731 1HD LYS 31 1HD LYS 31 -14.321 8.314 -5.767
732 2HD LYS 31 2HD LYS 31 -13.536 7.794 -7.269
733 1HE LYS 31 1HE LYS 31 -15.820 6.358 -5.813
734 2HE LYS 31 2HE LYS 31 -15.982 7.337 -7.280
735 1HZ LYS 31 1HZ LYS 31 -14.559 5.770 -8.403
736 2HZ LYS 31 2HZ LYS 31 -14.429 4.854 -7.040
737 3HZ LYS 31 3HZ LYS 31 -15.887 5.019 -7.782
738 H ILE 32 H ILE 32 -8.827 7.253 -5.145
739 HA ILE 32 HA ILE 32 -8.339 5.004 -6.895
740 HB ILE 32 HB ILE 32 -6.426 7.087 -5.726
741 1HG1 ILE 32 1HG1 ILE 32 -7.595 6.890 -8.547
742 2HG1 ILE 32 2HG1 ILE 32 -8.253 7.946 -7.303
743 1HG2 ILE 32 1HG2 ILE 32 -5.282 4.947 -6.458
744 2HG2 ILE 32 2HG2 ILE 32 -6.063 5.145 -8.033
745 3HG2 ILE 32 3HG2 ILE 32 -4.846 6.303 -7.480
746 1HD1 ILE 32 1HD1 ILE 32 -6.028 9.091 -7.119
747 2HD1 ILE 32 2HD1 ILE 32 -5.450 8.126 -8.493
748 3HD1 ILE 32 3HD1 ILE 32 -6.791 9.242 -8.717
749 H LEU 33 H LEU 33 -7.177 6.010 -3.603
750 HA LEU 33 HA LEU 33 -5.405 3.912 -3.564
751 1HB LEU 33 1HB LEU 33 -4.759 4.550 -1.405
752 2HB LEU 33 2HB LEU 33 -5.356 6.014 -2.191
753 HG LEU 33 HG LEU 33 -7.544 5.460 -1.076
754 1HD1 LEU 33 1HD1 LEU 33 -7.801 3.650 0.131
755 2HD1 LEU 33 2HD1 LEU 33 -6.097 3.228 -0.076
756 3HD1 LEU 33 3HD1 LEU 33 -6.597 4.256 1.279
757 1HD2 LEU 33 1HD2 LEU 33 -5.170 6.142 0.677
758 2HD2 LEU 33 2HD2 LEU 33 -5.919 7.289 -0.475
759 3HD2 LEU 33 3HD2 LEU 33 -6.830 6.703 0.934
760 H GLU 34 H GLU 34 -8.764 4.191 -2.506
761 HA GLU 34 HA GLU 34 -9.111 1.854 -0.972
762 1HB GLU 34 1HB GLU 34 -10.756 3.818 -1.401
763 2HB GLU 34 2HB GLU 34 -11.167 3.040 -2.906
764 1HG GLU 34 1HG GLU 34 -11.929 1.037 -1.654
765 2HG GLU 34 2HG GLU 34 -11.325 1.731 -0.140
766 H ASP 35 H ASP 35 -9.450 2.494 -4.410
767 HA ASP 35 HA ASP 35 -10.071 -0.086 -5.349
768 1HB ASP 35 1HB ASP 35 -9.620 2.336 -6.557
769 2HB ASP 35 2HB ASP 35 -8.145 1.493 -7.001
770 H GLU 36 H GLU 36 -6.839 1.436 -4.902
771 HA GLU 36 HA GLU 36 -5.351 -0.876 -5.533
772 1HB GLU 36 1HB GLU 36 -4.505 1.344 -3.630
773 2HB GLU 36 2HB GLU 36 -3.484 0.126 -4.396
774 1HG GLU 36 1HG GLU 36 -4.762 1.148 -6.610
775 2HG GLU 36 2HG GLU 36 -4.710 2.590 -5.595
776 H GLU 37 H GLU 37 -6.456 0.163 -2.232
777 HA GLU 37 HA GLU 37 -5.535 -1.889 -0.695
778 1HB GLU 37 1HB GLU 37 -7.205 0.235 -0.405
779 2HB GLU 37 2HB GLU 37 -8.399 -1.059 -0.313
780 1HG GLU 37 1HG GLU 37 -5.827 -1.022 1.322
781 2HG GLU 37 2HG GLU 37 -7.263 -0.107 1.756
782 H LYS 38 H LYS 38 -8.411 -2.074 -2.815
783 HA LYS 38 HA LYS 38 -9.032 -4.821 -2.134
784 1HB LYS 38 1HB LYS 38 -10.518 -3.055 -3.223
785 2HB LYS 38 2HB LYS 38 -9.575 -3.281 -4.701
786 1HG LYS 38 1HG LYS 38 -10.161 -5.758 -4.629
787 2HG LYS 38 2HG LYS 38 -11.226 -5.415 -3.254
788 1HD LYS 38 1HD LYS 38 -12.565 -3.888 -4.683
789 2HD LYS 38 2HD LYS 38 -11.435 -4.147 -6.031
790 1HE LYS 38 1HE LYS 38 -11.972 -6.590 -6.008
791 2HE LYS 38 2HE LYS 38 -13.133 -6.317 -4.695
792 1HZ LYS 38 1HZ LYS 38 -14.362 -4.896 -6.176
793 2HZ LYS 38 2HZ LYS 38 -13.273 -5.151 -7.389
794 3HZ LYS 38 3HZ LYS 38 -14.188 -6.401 -6.826
795 H HIS 39 H HIS 39 -6.987 -3.428 -4.733
796 HA HIS 39 HA HIS 39 -6.444 -5.958 -5.978
797 1HB HIS 39 1HB HIS 39 -4.956 -3.308 -5.875
798 2HB HIS 39 2HB HIS 39 -4.287 -4.707 -6.685
799 HD1 HIS 39 HD1 HIS 39 -6.176 -5.891 -8.484
800 HD2 HIS 39 HD2 HIS 39 -6.662 -1.868 -7.353
801 HE1 HIS 39 HE1 HIS 39 -7.788 -4.893 -10.162
802 HE2 HIS 39 HE2 HIS 39 -8.059 -2.384 -9.478
803 H ILE 40 H ILE 40 -5.133 -4.397 -3.147
804 HA ILE 40 HA ILE 40 -2.871 -6.215 -2.839
805 HB ILE 40 HB ILE 40 -4.074 -4.274 -0.815
806 1HG1 ILE 40 1HG1 ILE 40 -1.728 -3.845 -2.660
807 2HG1 ILE 40 2HG1 ILE 40 -3.272 -3.276 -3.122
808 1HG2 ILE 40 1HG2 ILE 40 -2.509 -5.971 0.156
809 2HG2 ILE 40 2HG2 ILE 40 -1.303 -5.584 -1.085
810 3HG2 ILE 40 3HG2 ILE 40 -1.727 -4.398 0.149
811 1HD1 ILE 40 1HD1 ILE 40 -3.534 -1.782 -1.316
812 2HD1 ILE 40 2HD1 ILE 40 -2.098 -2.344 -0.478
813 3HD1 ILE 40 3HD1 ILE 40 -1.956 -1.498 -2.033
814 H GLU 41 H GLU 41 -6.143 -5.760 -1.537
815 HA GLU 41 HA GLU 41 -6.179 -7.684 0.434
816 1HB GLU 41 1HB GLU 41 -7.987 -6.065 -0.085
817 2HB GLU 41 2HB GLU 41 -8.458 -7.033 -1.492
818 1HG GLU 41 1HG GLU 41 -8.308 -8.575 1.025
819 2HG GLU 41 2HG GLU 41 -9.488 -7.256 1.030
820 H TRP 42 H TRP 42 -6.623 -8.254 -3.134
821 HA TRP 42 HA TRP 42 -7.206 -10.904 -2.916
822 1HB TRP 42 1HB TRP 42 -7.032 -9.593 -5.015
823 2HB TRP 42 2HB TRP 42 -5.289 -9.717 -4.955
824 HD1 TRP 42 HD1 TRP 42 -8.050 -12.249 -4.477
825 HE1 TRP 42 HE1 TRP 42 -7.296 -14.593 -5.501
826 HE3 TRP 42 HE3 TRP 42 -3.563 -10.872 -6.182
827 HZ2 TRP 42 HZ2 TRP 42 -5.056 -15.548 -7.056
828 HZ3 TRP 42 HZ3 TRP 42 -1.993 -12.521 -7.195
829 HH2 TRP 42 HH2 TRP 42 -2.783 -14.812 -7.779
830 H LEU 43 H LEU 43 -4.050 -9.435 -2.664
831 HA LEU 43 HA LEU 43 -2.521 -11.942 -2.687
832 1HB LEU 43 1HB LEU 43 -1.730 -9.198 -1.604
833 2HB LEU 43 2HB LEU 43 -0.701 -10.625 -1.644
834 HG LEU 43 HG LEU 43 -1.555 -10.511 -4.277
835 1HD1 LEU 43 1HD1 LEU 43 -2.613 -8.294 -3.877
836 2HD1 LEU 43 2HD1 LEU 43 -1.038 -7.641 -3.370
837 3HD1 LEU 43 3HD1 LEU 43 -1.280 -8.195 -5.037
838 1HD2 LEU 43 1HD2 LEU 43 0.882 -9.191 -3.011
839 2HD2 LEU 43 2HD2 LEU 43 0.766 -10.890 -3.525
840 3HD2 LEU 43 3HD2 LEU 43 0.716 -9.595 -4.736
841 H GLU 44 H GLU 44 -4.174 -9.994 -0.202
842 HA GLU 44 HA GLU 44 -3.423 -11.909 1.919
843 1HB GLU 44 1HB GLU 44 -4.909 -9.311 1.717
844 2HB GLU 44 2HB GLU 44 -5.383 -10.358 3.043
845 1HG GLU 44 1HG GLU 44 -2.455 -9.921 2.602
846 2HG GLU 44 2HG GLU 44 -3.425 -8.634 3.349
847 H THR 45 H THR 45 -4.921 -12.967 -0.519
848 HA THR 45 HA THR 45 -6.734 -14.543 1.219
849 HB THR 45 HB THR 45 -7.816 -12.362 0.195
850 HG1 THR 45 HG1 THR 45 -8.924 -13.861 1.433
851 1HG2 THR 45 1HG2 THR 45 -7.316 -12.898 -2.134
852 2HG2 THR 45 2HG2 THR 45 -8.494 -14.216 -2.057
853 3HG2 THR 45 3HG2 THR 45 -8.993 -12.521 -1.777
854 H ILE 46 H ILE 46 -5.529 -13.983 -1.946
855 HA ILE 46 HA ILE 46 -5.078 -15.286 -3.732
856 HB ILE 46 HB ILE 46 -3.109 -15.163 -2.450
857 1HG1 ILE 46 1HG1 ILE 46 -1.775 -16.948 -3.249
858 2HG1 ILE 46 2HG1 ILE 46 -3.149 -18.039 -3.444
859 1HG2 ILE 46 1HG2 ILE 46 -3.705 -16.032 -0.299
860 2HG2 ILE 46 2HG2 ILE 46 -3.992 -17.658 -0.964
861 3HG2 ILE 46 3HG2 ILE 46 -2.353 -16.975 -0.911
862 1HD1 ILE 46 1HD1 ILE 46 -2.835 -15.396 -4.918
863 2HD1 ILE 46 2HD1 ILE 46 -2.327 -16.967 -5.580
864 3HD1 ILE 46 3HD1 ILE 46 -4.042 -16.676 -5.241
865 H LEU 47 H LEU 47 -7.539 -15.791 -3.285
866 HA LEU 47 HA LEU 47 -8.468 -18.369 -2.876
867 1HB LEU 47 1HB LEU 47 -9.870 -16.400 -3.266
868 2HB LEU 47 2HB LEU 47 -9.438 -16.372 -4.979
869 HG LEU 47 HG LEU 47 -10.658 -18.882 -3.781
870 1HD1 LEU 47 1HD1 LEU 47 -12.102 -17.061 -2.985
871 2HD1 LEU 47 2HD1 LEU 47 -12.229 -16.419 -4.638
872 3HD1 LEU 47 3HD1 LEU 47 -12.917 -18.007 -4.238
873 1HD2 LEU 47 1HD2 LEU 47 -10.937 -17.544 -6.520
874 2HD2 LEU 47 2HD2 LEU 47 -9.958 -18.981 -6.185
875 3HD2 LEU 47 3HD2 LEU 47 -11.708 -19.061 -6.029
876 H GLY 48 H GLY 48 -8.156 -20.260 -3.874
877 1HA GLY 48 1HA GLY 48 -7.943 -21.463 -6.103
878 2HA GLY 48 2HA GLY 48 -6.596 -20.355 -6.430
879 1HN NH2 49 1HN NH2 49 -5.425 -20.092 -3.886
880 2HN NH2 49 2HN NH2 49 -4.793 -21.677 -3.364
Start of MODEL 13
1 1H ACE 0 H1 ACE 0 -1.139 -11.919 2.265
2 2H ACE 0 H2 ACE 0 0.377 -12.672 1.722
3 3H ACE 0 H3 ACE 0 0.224 -12.071 3.391
4 H ASP 1 H ASP 1 2.205 -10.861 2.867
5 HA ASP 1 HA ASP 1 1.777 -8.162 2.699
6 1HB ASP 1 1HB ASP 1 3.878 -9.212 3.503
7 2HB ASP 1 2HB ASP 1 4.330 -9.588 1.827
8 H TYR 2 H TYR 2 2.676 -10.289 -0.026
9 HA TYR 2 HA TYR 2 3.104 -8.632 -2.107
10 1HB TYR 2 1HB TYR 2 1.290 -11.079 -2.172
11 2HB TYR 2 2HB TYR 2 2.282 -10.432 -3.467
12 HD1 TYR 2 HD1 TYR 2 2.136 -12.918 -0.972
13 HD2 TYR 2 HD2 TYR 2 4.902 -10.230 -2.903
14 HE1 TYR 2 HE1 TYR 2 4.038 -14.090 0.109
15 HE2 TYR 2 HE2 TYR 2 6.792 -11.416 -1.845
16 HH TYR 2 HH TYR 2 7.418 -13.056 -0.370
17 H LEU 3 H LEU 3 -0.109 -9.432 -0.724
18 HA LEU 3 HA LEU 3 -1.564 -8.204 -2.849
19 1HB LEU 3 1HB LEU 3 -2.287 -8.755 0.076
20 2HB LEU 3 2HB LEU 3 -3.465 -8.223 -1.118
21 HG LEU 3 HG LEU 3 -1.834 -10.751 -1.608
22 1HD1 LEU 3 1HD1 LEU 3 -2.847 -11.037 0.604
23 2HD1 LEU 3 2HD1 LEU 3 -4.429 -10.531 -0.028
24 3HD1 LEU 3 3HD1 LEU 3 -3.681 -12.041 -0.595
25 1HD2 LEU 3 1HD2 LEU 3 -4.598 -9.795 -2.455
26 2HD2 LEU 3 2HD2 LEU 3 -3.156 -9.783 -3.489
27 3HD2 LEU 3 3HD2 LEU 3 -3.844 -11.326 -2.949
28 H ARG 4 H ARG 4 -0.430 -6.958 0.276
29 HA ARG 4 HA ARG 4 -1.622 -4.344 -0.159
30 1HB ARG 4 1HB ARG 4 0.497 -5.445 1.717
31 2HB ARG 4 2HB ARG 4 0.203 -3.709 1.623
32 1HG ARG 4 1HG ARG 4 -2.059 -5.684 2.076
33 2HG ARG 4 2HG ARG 4 -1.113 -5.018 3.413
34 1HD ARG 4 1HD ARG 4 -2.089 -2.938 3.271
35 2HD ARG 4 2HD ARG 4 -2.062 -2.931 1.518
36 HE ARG 4 HE ARG 4 -4.182 -3.671 1.408
37 1HH1 ARG 4 1HH2 ARG 4 -2.950 -4.410 4.616
38 2HH1 ARG 4 2HH2 ARG 4 -4.490 -4.894 5.274
39 1HH2 ARG 4 1HH1 ARG 4 -6.199 -4.330 2.200
40 2HH2 ARG 4 2HH1 ARG 4 -6.394 -4.860 3.845
41 H GLU 5 H GLU 5 0.972 -5.954 -1.715
42 HA GLU 5 HA GLU 5 2.524 -3.430 -2.085
43 1HB GLU 5 1HB GLU 5 3.647 -5.585 -1.448
44 2HB GLU 5 2HB GLU 5 3.180 -6.262 -3.007
45 1HG GLU 5 1HG GLU 5 4.479 -4.495 -4.162
46 2HG GLU 5 2HG GLU 5 4.891 -3.774 -2.595
47 H LEU 6 H LEU 6 1.216 -6.092 -4.083
48 HA LEU 6 HA LEU 6 1.324 -4.585 -6.532
49 1HB LEU 6 1HB LEU 6 0.125 -7.269 -5.770
50 2HB LEU 6 2HB LEU 6 0.128 -6.580 -7.399
51 HG LEU 6 HG LEU 6 2.506 -6.737 -7.633
52 1HD1 LEU 6 1HD1 LEU 6 3.282 -6.376 -5.340
53 2HD1 LEU 6 2HD1 LEU 6 2.667 -7.991 -4.886
54 3HD1 LEU 6 3HD1 LEU 6 3.963 -7.794 -6.092
55 1HD2 LEU 6 1HD2 LEU 6 1.401 -9.344 -6.532
56 2HD2 LEU 6 2HD2 LEU 6 0.721 -8.564 -7.964
57 3HD2 LEU 6 3HD2 LEU 6 2.379 -9.080 -7.999
58 H LEU 7 H LEU 7 -0.737 -4.000 -4.093
59 HA LEU 7 HA LEU 7 -2.874 -3.296 -5.957
60 1HB LEU 7 1HB LEU 7 -3.664 -4.977 -4.281
61 2HB LEU 7 2HB LEU 7 -3.139 -3.885 -2.986
62 HG LEU 7 HG LEU 7 -4.804 -2.201 -3.676
63 1HD1 LEU 7 1HD1 LEU 7 -5.034 -2.645 -6.070
64 2HD1 LEU 7 2HD1 LEU 7 -5.608 -4.292 -5.745
65 3HD1 LEU 7 3HD1 LEU 7 -6.599 -2.892 -5.292
66 1HD2 LEU 7 1HD2 LEU 7 -5.899 -5.003 -3.218
67 2HD2 LEU 7 2HD2 LEU 7 -5.357 -3.870 -1.969
68 3HD2 LEU 7 3HD2 LEU 7 -6.790 -3.490 -2.942
69 H LYS 8 H LYS 8 -1.028 -2.298 -3.067
70 HA LYS 8 HA LYS 8 -2.489 0.094 -2.886
71 1HB LYS 8 1HB LYS 8 -1.429 -1.116 -1.007
72 2HB LYS 8 2HB LYS 8 0.166 -0.544 -1.554
73 1HG LYS 8 1HG LYS 8 -0.271 1.652 -0.893
74 2HG LYS 8 2HG LYS 8 -2.018 1.486 -1.078
75 1HD LYS 8 1HD LYS 8 -1.442 1.663 1.278
76 2HD LYS 8 2HD LYS 8 -2.154 0.079 0.928
77 1HE LYS 8 1HE LYS 8 0.140 -0.932 0.876
78 2HE LYS 8 2HE LYS 8 0.837 0.660 1.223
79 1HZ LYS 8 1HZ LYS 8 -0.363 0.649 3.294
80 2HZ LYS 8 2HZ LYS 8 -1.008 -0.830 2.957
81 3HZ LYS 8 3HZ LYS 8 0.618 -0.670 3.180
82 H LEU 9 H LEU 9 0.696 -0.837 -4.150
83 HA LEU 9 HA LEU 9 1.639 1.767 -4.895
84 1HB LEU 9 1HB LEU 9 2.191 -0.933 -6.152
85 2HB LEU 9 2HB LEU 9 3.108 0.558 -6.430
86 HG LEU 9 HG LEU 9 2.880 -0.778 -3.705
87 1HD1 LEU 9 1HD1 LEU 9 4.018 -2.251 -5.320
88 2HD1 LEU 9 2HD1 LEU 9 5.104 -0.927 -5.786
89 3HD1 LEU 9 3HD1 LEU 9 5.165 -1.594 -4.140
90 1HD2 LEU 9 1HD2 LEU 9 4.705 1.419 -4.793
91 2HD2 LEU 9 2HD2 LEU 9 3.442 1.621 -3.557
92 3HD2 LEU 9 3HD2 LEU 9 4.870 0.642 -3.207
93 H GLU 10 H GLU 10 -0.285 -0.676 -6.649
94 HA GLU 10 HA GLU 10 -0.623 0.695 -9.180
95 1HB GLU 10 1HB GLU 10 -2.446 -1.214 -7.643
96 2HB GLU 10 2HB GLU 10 -2.649 -0.634 -9.292
97 1HG GLU 10 1HG GLU 10 -1.840 -3.011 -9.023
98 2HG GLU 10 2HG GLU 10 -0.939 -2.012 -10.144
99 H LEU 11 H LEU 11 -2.579 0.701 -6.168
100 HA LEU 11 HA LEU 11 -4.578 2.441 -7.124
101 1HB LEU 11 1HB LEU 11 -4.452 1.020 -4.915
102 2HB LEU 11 2HB LEU 11 -3.599 2.410 -4.243
103 HG LEU 11 HG LEU 11 -5.688 3.775 -5.130
104 1HD1 LEU 11 1HD1 LEU 11 -6.679 1.853 -6.412
105 2HD1 LEU 11 2HD1 LEU 11 -6.846 0.951 -4.894
106 3HD1 LEU 11 3HD1 LEU 11 -7.771 2.442 -5.148
107 1HD2 LEU 11 1HD2 LEU 11 -5.122 3.503 -2.761
108 2HD2 LEU 11 2HD2 LEU 11 -6.870 3.313 -2.996
109 3HD2 LEU 11 3HD2 LEU 11 -5.848 1.880 -2.747
110 H GLN 12 H GLN 12 -1.543 3.243 -5.345
111 HA GLN 12 HA GLN 12 -1.960 6.087 -5.418
112 1HB GLN 12 1HB GLN 12 0.621 4.439 -5.356
113 2HB GLN 12 2HB GLN 12 0.594 6.190 -5.425
114 1HG GLN 12 1HG GLN 12 0.735 6.091 -3.208
115 2HG GLN 12 2HG GLN 12 -1.022 5.981 -3.307
116 1HE2 GLN 12 2HE2 GLN 12 1.727 3.666 -3.724
117 2HE2 GLN 12 1HE2 GLN 12 1.099 2.486 -2.594
118 H LEU 13 H LEU 13 -0.652 3.852 -7.870
119 HA LEU 13 HA LEU 13 0.360 5.928 -9.512
120 1HB LEU 13 1HB LEU 13 -0.371 3.142 -10.392
121 2HB LEU 13 2HB LEU 13 0.561 4.355 -11.254
122 HG LEU 13 HG LEU 13 1.329 2.561 -9.073
123 1HD1 LEU 13 1HD1 LEU 13 2.171 2.495 -11.435
124 2HD1 LEU 13 2HD1 LEU 13 3.002 4.034 -11.149
125 3HD1 LEU 13 3HD1 LEU 13 3.464 2.594 -10.221
126 1HD2 LEU 13 1HD2 LEU 13 2.572 5.363 -9.127
127 2HD2 LEU 13 2HD2 LEU 13 1.729 4.631 -7.744
128 3HD2 LEU 13 3HD2 LEU 13 3.249 3.956 -8.286
129 H ILE 14 H ILE 14 -2.739 4.139 -9.527
130 HA ILE 14 HA ILE 14 -3.928 5.507 -11.747
131 HB ILE 14 HB ILE 14 -5.209 4.456 -9.173
132 1HG1 ILE 14 1HG1 ILE 14 -4.195 2.628 -10.263
133 2HG1 ILE 14 2HG1 ILE 14 -5.884 2.559 -10.723
134 1HG2 ILE 14 1HG2 ILE 14 -6.774 6.029 -10.255
135 2HG2 ILE 14 2HG2 ILE 14 -6.580 5.192 -11.804
136 3HG2 ILE 14 3HG2 ILE 14 -7.327 4.366 -10.429
137 1HD1 ILE 14 1HD1 ILE 14 -5.161 3.836 -12.875
138 2HD1 ILE 14 2HD1 ILE 14 -3.495 3.441 -12.379
139 3HD1 ILE 14 3HD1 ILE 14 -4.652 2.155 -12.719
140 H LYS 15 H LYS 15 -3.953 6.409 -8.396
141 HA LYS 15 HA LYS 15 -5.082 8.957 -8.474
142 1HB LYS 15 1HB LYS 15 -3.826 7.321 -6.561
143 2HB LYS 15 2HB LYS 15 -2.739 8.671 -6.704
144 1HG LYS 15 1HG LYS 15 -4.125 9.383 -5.016
145 2HG LYS 15 2HG LYS 15 -4.960 10.119 -6.393
146 1HD LYS 15 1HD LYS 15 -6.493 8.099 -6.456
147 2HD LYS 15 2HD LYS 15 -5.600 7.415 -5.087
148 1HE LYS 15 1HE LYS 15 -6.213 9.465 -3.727
149 2HE LYS 15 2HE LYS 15 -7.256 9.979 -5.068
150 1HZ LYS 15 1HZ LYS 15 -8.465 7.917 -4.797
151 2HZ LYS 15 2HZ LYS 15 -7.492 7.477 -3.542
152 3HZ LYS 15 3HZ LYS 15 -8.468 8.795 -3.402
153 H GLN 16 H GLN 16 -1.602 8.010 -8.936
154 HA GLN 16 HA GLN 16 -0.689 10.700 -9.405
155 1HB GLN 16 1HB GLN 16 0.442 7.997 -9.512
156 2HB GLN 16 2HB GLN 16 0.964 8.931 -10.895
157 1HG GLN 16 1HG GLN 16 2.630 9.403 -9.464
158 2HG GLN 16 2HG GLN 16 1.581 10.769 -9.092
159 1HE2 GLN 16 2HE2 GLN 16 1.262 11.058 -6.861
160 2HE2 GLN 16 1HE2 GLN 16 1.511 9.776 -5.682
161 H TYR 17 H TYR 17 -2.024 8.198 -11.477
162 HA TYR 17 HA TYR 17 -1.388 9.366 -14.005
163 1HB TYR 17 1HB TYR 17 -3.125 7.133 -12.967
164 2HB TYR 17 2HB TYR 17 -3.595 7.856 -14.468
165 HD1 TYR 17 HD1 TYR 17 -2.222 7.879 -16.414
166 HD2 TYR 17 HD2 TYR 17 -1.581 5.270 -13.092
167 HE1 TYR 17 HE1 TYR 17 -1.081 6.279 -17.925
168 HE2 TYR 17 HE2 TYR 17 -0.585 3.597 -14.604
169 HH TYR 17 HH TYR 17 0.163 4.305 -18.022
170 H ARG 18 H ARG 18 -3.990 9.712 -11.693
171 HA ARG 18 HA ARG 18 -5.744 11.270 -13.444
172 1HB ARG 18 1HB ARG 18 -5.741 10.721 -10.450
173 2HB ARG 18 2HB ARG 18 -6.906 11.793 -11.234
174 1HG ARG 18 1HG ARG 18 -7.794 10.022 -12.590
175 2HG ARG 18 2HG ARG 18 -6.522 8.897 -12.098
176 1HD ARG 18 1HD ARG 18 -7.291 8.854 -9.818
177 2HD ARG 18 2HD ARG 18 -8.470 10.136 -10.092
178 HE ARG 18 HE ARG 18 -8.685 7.296 -10.735
179 1HH1 ARG 18 1HH2 ARG 18 -9.863 10.500 -11.598
180 2HH1 ARG 18 2HH2 ARG 18 -11.411 9.950 -12.182
181 1HH2 ARG 18 1HH1 ARG 18 -10.674 6.530 -11.522
182 2HH2 ARG 18 2HH1 ARG 18 -11.870 7.621 -12.160
183 H GLU 19 H GLU 19 -3.450 11.846 -10.859
184 HA GLU 19 HA GLU 19 -3.566 14.669 -10.760
185 1HB GLU 19 1HB GLU 19 -2.240 13.074 -9.236
186 2HB GLU 19 2HB GLU 19 -1.002 13.089 -10.503
187 1HG GLU 19 1HG GLU 19 -0.970 15.618 -10.322
188 2HG GLU 19 2HG GLU 19 -2.016 15.459 -8.899
189 H ALA 20 H ALA 20 -1.605 12.478 -12.895
190 HA ALA 20 HA ALA 20 -0.403 14.829 -14.181
191 1HB ALA 20 1HB ALA 20 0.899 12.900 -13.898
192 2HB ALA 20 2HB ALA 20 -0.292 11.866 -14.707
193 3HB ALA 20 3HB ALA 20 0.652 13.048 -15.646
194 H LEU 21 H LEU 21 -3.047 12.602 -15.018
195 HA LEU 21 HA LEU 21 -3.537 12.982 -17.638
196 1HB LEU 21 1HB LEU 21 -4.958 11.594 -16.317
197 2HB LEU 21 2HB LEU 21 -5.436 12.947 -15.288
198 HG LEU 21 HG LEU 21 -6.741 13.939 -17.131
199 1HD1 LEU 21 1HD1 LEU 21 -5.457 12.942 -19.073
200 2HD1 LEU 21 2HD1 LEU 21 -6.123 11.359 -18.617
201 3HD1 LEU 21 3HD1 LEU 21 -7.200 12.649 -19.168
202 1HD2 LEU 21 1HD2 LEU 21 -7.363 11.026 -16.494
203 2HD2 LEU 21 2HD2 LEU 21 -7.772 12.427 -15.485
204 3HD2 LEU 21 3HD2 LEU 21 -8.527 12.240 -17.079
205 H GLU 22 H GLU 22 -4.573 15.327 -15.138
206 HA GLU 22 HA GLU 22 -5.863 17.012 -17.114
207 1HB GLU 22 1HB GLU 22 -5.239 17.450 -14.162
208 2HB GLU 22 2HB GLU 22 -6.167 18.572 -15.170
209 1HG GLU 22 1HG GLU 22 -6.951 15.656 -14.673
210 2HG GLU 22 2HG GLU 22 -7.627 17.056 -13.833
211 H TYR 23 H TYR 23 -2.717 17.033 -15.440
212 HA TYR 23 HA TYR 23 -1.907 19.624 -16.412
213 1HB TYR 23 1HB TYR 23 -0.590 17.192 -15.187
214 2HB TYR 23 2HB TYR 23 0.412 18.335 -16.030
215 HD1 TYR 23 HD1 TYR 23 0.050 20.897 -15.421
216 HD2 TYR 23 HD2 TYR 23 -0.963 17.581 -12.860
217 HE1 TYR 23 HE1 TYR 23 0.090 22.400 -13.449
218 HE2 TYR 23 HE2 TYR 23 -0.880 19.072 -10.895
219 HH TYR 23 HH TYR 23 -0.557 21.224 -10.140
220 H VAL 24 H VAL 24 -1.839 16.317 -17.690
221 HA VAL 24 HA VAL 24 -0.171 17.117 -19.976
222 HB VAL 24 HB VAL 24 -1.480 14.499 -19.198
223 1HG1 VAL 24 1HG1 VAL 24 -1.197 14.462 -21.619
224 2HG1 VAL 24 2HG1 VAL 24 0.427 15.171 -21.488
225 3HG1 VAL 24 3HG1 VAL 24 0.124 13.524 -20.911
226 1HG2 VAL 24 1HG2 VAL 24 1.441 15.399 -19.152
227 2HG2 VAL 24 2HG2 VAL 24 0.414 15.291 -17.717
228 3HG2 VAL 24 3HG2 VAL 24 0.814 13.827 -18.620
229 H LYS 25 H LYS 25 -3.603 16.648 -19.355
230 HA LYS 25 HA LYS 25 -5.454 17.011 -20.563
231 1HB LYS 25 1HB LYS 25 -3.709 18.739 -22.364
232 2HB LYS 25 2HB LYS 25 -5.471 18.762 -22.243
233 1HG LYS 25 1HG LYS 25 -5.278 19.445 -19.844
234 2HG LYS 25 2HG LYS 25 -3.515 19.528 -20.029
235 1HD LYS 25 1HD LYS 25 -3.744 21.217 -21.807
236 2HD LYS 25 2HD LYS 25 -5.516 21.110 -21.713
237 1HE LYS 25 1HE LYS 25 -5.422 21.884 -19.336
238 2HE LYS 25 2HE LYS 25 -3.661 22.037 -19.467
239 1HZ LYS 25 1HZ LYS 25 -3.995 23.661 -21.191
240 2HZ LYS 25 2HZ LYS 25 -5.632 23.506 -21.083
241 3HZ LYS 25 3HZ LYS 25 -4.778 24.118 -19.815
242 H LEU 26 H LEU 26 -4.358 14.563 -21.100
243 HA LEU 26 HA LEU 26 -4.891 14.193 -24.035
244 1HB LEU 26 1HB LEU 26 -2.542 13.823 -23.602
245 2HB LEU 26 2HB LEU 26 -2.937 12.746 -22.265
246 HG LEU 26 HG LEU 26 -4.181 11.313 -24.045
247 1HD1 LEU 26 1HD1 LEU 26 -4.036 12.892 -25.990
248 2HD1 LEU 26 2HD1 LEU 26 -2.262 12.775 -25.917
249 3HD1 LEU 26 3HD1 LEU 26 -3.225 11.358 -26.321
250 1HD2 LEU 26 1HD2 LEU 26 -1.150 11.416 -24.139
251 2HD2 LEU 26 2HD2 LEU 26 -2.117 10.553 -22.919
252 3HD2 LEU 26 3HD2 LEU 26 -2.196 10.066 -24.596
253 HA PRO 27 HA PRO 27 -8.173 11.808 -21.953
254 1HB PRO 27 1HB PRO 27 -9.616 10.998 -24.147
255 2HB PRO 27 2HB PRO 27 -9.729 12.616 -23.403
256 1HG PRO 27 1HG PRO 27 -8.085 11.800 -25.807
257 2HG PRO 27 2HG PRO 27 -9.145 13.229 -25.634
258 1HD PRO 27 1HD PRO 27 -6.461 13.392 -25.302
259 2HD PRO 27 2HD PRO 27 -7.553 14.344 -24.253
260 H VAL 28 H VAL 28 -6.210 10.573 -24.712
261 HA VAL 28 HA VAL 28 -6.527 7.815 -24.387
262 HB VAL 28 HB VAL 28 -4.275 9.519 -25.263
263 1HG1 VAL 28 1HG1 VAL 28 -2.988 7.906 -23.910
264 2HG1 VAL 28 2HG1 VAL 28 -3.904 6.564 -24.637
265 3HG1 VAL 28 3HG1 VAL 28 -2.800 7.532 -25.617
266 1HG2 VAL 28 1HG2 VAL 28 -5.470 7.044 -26.532
267 2HG2 VAL 28 2HG2 VAL 28 -5.959 8.721 -26.901
268 3HG2 VAL 28 3HG2 VAL 28 -4.316 8.164 -27.259
269 H LEU 29 H LEU 29 -4.780 10.103 -22.256
270 HA LEU 29 HA LEU 29 -3.385 8.158 -20.758
271 1HB LEU 29 1HB LEU 29 -3.418 10.910 -21.034
272 2HB LEU 29 2HB LEU 29 -4.215 10.772 -19.479
273 HG LEU 29 HG LEU 29 -1.683 9.268 -20.053
274 1HD1 LEU 29 1HD1 LEU 29 -1.139 11.485 -20.861
275 2HD1 LEU 29 2HD1 LEU 29 -1.819 12.230 -19.397
276 3HD1 LEU 29 3HD1 LEU 29 -0.348 11.236 -19.295
277 1HD2 LEU 29 1HD2 LEU 29 -2.556 10.798 -17.544
278 2HD2 LEU 29 2HD2 LEU 29 -3.102 9.147 -17.884
279 3HD2 LEU 29 3HD2 LEU 29 -1.361 9.497 -17.684
280 H ALA 30 H ALA 30 -6.556 9.748 -20.271
281 HA ALA 30 HA ALA 30 -7.110 8.300 -17.856
282 1HB ALA 30 1HB ALA 30 -8.341 10.385 -18.531
283 2HB ALA 30 2HB ALA 30 -9.090 9.495 -19.867
284 3HB ALA 30 3HB ALA 30 -9.435 9.034 -18.187
285 H LYS 31 H LYS 31 -7.610 7.642 -21.348
286 HA LYS 31 HA LYS 31 -9.374 5.396 -20.818
287 1HB LYS 31 1HB LYS 31 -8.150 6.629 -23.214
288 2HB LYS 31 2HB LYS 31 -8.414 4.888 -23.352
289 1HG LYS 31 1HG LYS 31 -10.548 6.805 -22.340
290 2HG LYS 31 2HG LYS 31 -10.376 6.394 -24.053
291 1HD LYS 31 1HD LYS 31 -11.325 4.338 -23.811
292 2HD LYS 31 2HD LYS 31 -10.368 3.957 -22.385
293 1HE LYS 31 1HE LYS 31 -12.717 3.924 -21.812
294 2HE LYS 31 2HE LYS 31 -11.898 5.225 -20.938
295 1HZ LYS 31 1HZ LYS 31 -12.774 6.769 -22.530
296 2HZ LYS 31 2HZ LYS 31 -13.505 5.554 -23.377
297 3HZ LYS 31 3HZ LYS 31 -13.994 5.902 -21.842
298 H ILE 32 H ILE 32 -5.923 5.682 -21.272
299 HA ILE 32 HA ILE 32 -5.190 2.903 -21.215
300 HB ILE 32 HB ILE 32 -3.844 5.559 -20.561
301 1HG1 ILE 32 1HG1 ILE 32 -3.197 3.376 -22.588
302 2HG1 ILE 32 2HG1 ILE 32 -4.171 4.806 -22.916
303 1HG2 ILE 32 1HG2 ILE 32 -2.883 4.193 -18.865
304 2HG2 ILE 32 2HG2 ILE 32 -2.752 2.813 -19.959
305 3HG2 ILE 32 3HG2 ILE 32 -1.704 4.235 -20.157
306 1HD1 ILE 32 1HD1 ILE 32 -2.184 6.235 -22.245
307 2HD1 ILE 32 2HD1 ILE 32 -1.208 4.748 -22.219
308 3HD1 ILE 32 3HD1 ILE 32 -1.971 5.268 -23.719
309 H LEU 33 H LEU 33 -5.384 5.500 -18.719
310 HA LEU 33 HA LEU 33 -4.680 3.672 -16.733
311 1HB LEU 33 1HB LEU 33 -4.722 5.447 -15.259
312 2HB LEU 33 2HB LEU 33 -4.563 6.239 -16.822
313 HG LEU 33 HG LEU 33 -7.071 6.535 -16.771
314 1HD1 LEU 33 1HD1 LEU 33 -8.139 5.359 -15.202
315 2HD1 LEU 33 2HD1 LEU 33 -6.688 5.215 -14.182
316 3HD1 LEU 33 3HD1 LEU 33 -7.687 6.696 -14.143
317 1HD2 LEU 33 1HD2 LEU 33 -5.647 7.899 -14.503
318 2HD2 LEU 33 2HD2 LEU 33 -5.218 8.239 -16.207
319 3HD2 LEU 33 3HD2 LEU 33 -6.849 8.584 -15.601
320 H GLU 34 H GLU 34 -7.876 4.485 -17.997
321 HA GLU 34 HA GLU 34 -9.490 3.344 -15.995
322 1HB GLU 34 1HB GLU 34 -10.138 4.652 -18.130
323 2HB GLU 34 2HB GLU 34 -10.033 3.125 -18.986
324 1HG GLU 34 1HG GLU 34 -11.738 2.152 -17.443
325 2HG GLU 34 2HG GLU 34 -11.811 3.688 -16.562
326 H ASP 35 H ASP 35 -8.029 1.892 -18.882
327 HA ASP 35 HA ASP 35 -8.990 -0.760 -18.435
328 1HB ASP 35 1HB ASP 35 -8.006 0.025 -20.595
329 2HB ASP 35 2HB ASP 35 -6.402 0.027 -19.836
330 H GLU 36 H GLU 36 -5.931 0.832 -17.456
331 HA GLU 36 HA GLU 36 -4.815 -1.341 -16.020
332 1HB GLU 36 1HB GLU 36 -4.712 1.605 -15.226
333 2HB GLU 36 2HB GLU 36 -3.636 0.343 -14.657
334 1HG GLU 36 1HG GLU 36 -3.785 1.029 -17.624
335 2HG GLU 36 2HG GLU 36 -2.783 1.932 -16.483
336 H GLU 37 H GLU 37 -7.199 1.146 -14.940
337 HA GLU 37 HA GLU 37 -7.340 0.444 -12.303
338 1HB GLU 37 1HB GLU 37 -8.534 2.263 -13.975
339 2HB GLU 37 2HB GLU 37 -9.920 1.238 -13.634
340 1HG GLU 37 1HG GLU 37 -8.064 2.409 -11.504
341 2HG GLU 37 2HG GLU 37 -9.403 3.280 -12.239
342 H LYS 38 H LYS 38 -9.212 -1.024 -14.988
343 HA LYS 38 HA LYS 38 -10.639 -2.957 -13.342
344 1HB LYS 38 1HB LYS 38 -11.234 -2.296 -15.722
345 2HB LYS 38 2HB LYS 38 -9.705 -2.978 -16.251
346 1HG LYS 38 1HG LYS 38 -10.937 -4.742 -16.808
347 2HG LYS 38 2HG LYS 38 -10.721 -5.236 -15.137
348 1HD LYS 38 1HD LYS 38 -13.119 -3.740 -16.305
349 2HD LYS 38 2HD LYS 38 -13.045 -5.466 -15.912
350 1HE LYS 38 1HE LYS 38 -12.622 -4.850 -13.494
351 2HE LYS 38 2HE LYS 38 -12.881 -3.149 -13.931
352 1HZ LYS 38 1HZ LYS 38 -15.071 -3.721 -14.653
353 2HZ LYS 38 2HZ LYS 38 -14.842 -5.304 -14.246
354 3HZ LYS 38 3HZ LYS 38 -14.841 -4.141 -13.076
355 H HIS 39 H HIS 39 -7.540 -3.224 -15.109
356 HA HIS 39 HA HIS 39 -7.068 -5.944 -14.362
357 1HB HIS 39 1HB HIS 39 -5.375 -3.600 -15.248
358 2HB HIS 39 2HB HIS 39 -4.580 -4.950 -14.463
359 HD1 HIS 39 HD1 HIS 39 -3.404 -5.939 -16.552
360 HD2 HIS 39 HD2 HIS 39 -7.598 -5.614 -16.806
361 HE1 HIS 39 HE1 HIS 39 -4.153 -7.583 -18.362
362 HE2 HIS 39 HE2 HIS 39 -6.698 -7.270 -18.610
363 H ILE 40 H ILE 40 -6.448 -2.949 -12.654
364 HA ILE 40 HA ILE 40 -4.958 -4.114 -10.451
365 HB ILE 40 HB ILE 40 -6.214 -1.399 -10.900
366 1HG1 ILE 40 1HG1 ILE 40 -3.261 -2.112 -10.726
367 2HG1 ILE 40 2HG1 ILE 40 -4.102 -2.293 -12.244
368 1HG2 ILE 40 1HG2 ILE 40 -6.080 -1.828 -8.456
369 2HG2 ILE 40 2HG2 ILE 40 -4.386 -2.322 -8.632
370 3HG2 ILE 40 3HG2 ILE 40 -4.879 -0.642 -8.937
371 1HD1 ILE 40 1HD1 ILE 40 -4.773 0.017 -12.284
372 2HD1 ILE 40 2HD1 ILE 40 -3.966 0.343 -10.749
373 3HD1 ILE 40 3HD1 ILE 40 -3.007 -0.129 -12.166
374 H GLU 41 H GLU 41 -8.335 -3.207 -11.179
375 HA GLU 41 HA GLU 41 -9.428 -3.485 -8.641
376 1HB GLU 41 1HB GLU 41 -10.597 -2.707 -10.816
377 2HB GLU 41 2HB GLU 41 -10.828 -4.433 -11.174
378 1HG GLU 41 1HG GLU 41 -11.938 -4.586 -8.858
379 2HG GLU 41 2HG GLU 41 -11.907 -2.814 -8.850
380 H TRP 42 H TRP 42 -8.669 -6.093 -11.074
381 HA TRP 42 HA TRP 42 -9.824 -8.134 -9.680
382 1HB TRP 42 1HB TRP 42 -8.605 -8.432 -11.792
383 2HB TRP 42 2HB TRP 42 -7.071 -8.214 -10.965
384 HD1 TRP 42 HD1 TRP 42 -10.076 -10.205 -9.939
385 HE1 TRP 42 HE1 TRP 42 -9.310 -12.542 -8.983
386 HE3 TRP 42 HE3 TRP 42 -5.180 -9.690 -10.657
387 HZ2 TRP 42 HZ2 TRP 42 -6.800 -14.035 -8.873
388 HZ3 TRP 42 HZ3 TRP 42 -3.573 -11.532 -10.263
389 HH2 TRP 42 HH2 TRP 42 -4.353 -13.679 -9.258
390 H LEU 43 H LEU 43 -6.741 -6.607 -9.083
391 HA LEU 43 HA LEU 43 -5.877 -8.438 -6.991
392 1HB LEU 43 1HB LEU 43 -4.826 -5.676 -7.681
393 2HB LEU 43 2HB LEU 43 -4.128 -6.777 -6.501
394 HG LEU 43 HG LEU 43 -4.490 -8.297 -8.919
395 1HD1 LEU 43 1HD1 LEU 43 -4.550 -6.215 -10.153
396 2HD1 LEU 43 2HD1 LEU 43 -3.078 -5.625 -9.343
397 3HD1 LEU 43 3HD1 LEU 43 -3.003 -7.011 -10.452
398 1HD2 LEU 43 1HD2 LEU 43 -1.988 -7.190 -7.619
399 2HD2 LEU 43 2HD2 LEU 43 -2.781 -8.721 -7.190
400 3HD2 LEU 43 3HD2 LEU 43 -2.059 -8.511 -8.799
401 H GLU 44 H GLU 44 -8.370 -6.008 -6.939
402 HA GLU 44 HA GLU 44 -8.041 -5.750 -4.043
403 1HB GLU 44 1HB GLU 44 -9.380 -3.984 -4.062
404 2HB GLU 44 2HB GLU 44 -8.882 -3.903 -5.756
405 1HG GLU 44 1HG GLU 44 -11.020 -5.193 -6.311
406 2HG GLU 44 2HG GLU 44 -11.414 -5.133 -4.607
407 H THR 45 H THR 45 -9.532 -7.806 -6.267
408 HA THR 45 HA THR 45 -11.771 -8.539 -4.477
409 HB THR 45 HB THR 45 -11.997 -9.829 -6.891
410 HG1 THR 45 HG1 THR 45 -10.914 -7.308 -7.511
411 1HG2 THR 45 1HG2 THR 45 -13.800 -8.474 -5.780
412 2HG2 THR 45 2HG2 THR 45 -12.927 -6.984 -6.221
413 3HG2 THR 45 3HG2 THR 45 -13.635 -8.006 -7.492
414 H ILE 46 H ILE 46 -8.770 -9.703 -5.632
415 HA ILE 46 HA ILE 46 -8.919 -12.387 -5.751
416 HB ILE 46 HB ILE 46 -6.915 -11.235 -6.247
417 1HG1 ILE 46 1HG1 ILE 46 -5.151 -12.370 -4.875
418 2HG1 ILE 46 2HG1 ILE 46 -6.398 -12.957 -3.768
419 1HG2 ILE 46 1HG2 ILE 46 -7.141 -9.314 -4.707
420 2HG2 ILE 46 2HG2 ILE 46 -6.625 -10.333 -3.365
421 3HG2 ILE 46 3HG2 ILE 46 -5.528 -10.006 -4.726
422 1HD1 ILE 46 1HD1 ILE 46 -7.537 -14.027 -5.783
423 2HD1 ILE 46 2HD1 ILE 46 -6.156 -13.444 -6.740
424 3HD1 ILE 46 3HD1 ILE 46 -5.905 -14.646 -5.452
425 H LEU 47 H LEU 47 -10.189 -13.607 -4.447
426 HA LEU 47 HA LEU 47 -9.406 -14.081 -1.710
427 1HB LEU 47 1HB LEU 47 -10.984 -11.872 -1.882
428 2HB LEU 47 2HB LEU 47 -12.255 -13.067 -1.963
429 HG LEU 47 HG LEU 47 -12.001 -12.307 0.273
430 1HD1 LEU 47 1HD1 LEU 47 -12.424 -14.762 0.007
431 2HD1 LEU 47 2HD1 LEU 47 -10.682 -15.050 0.242
432 3HD1 LEU 47 3HD1 LEU 47 -11.642 -14.324 1.537
433 1HD2 LEU 47 1HD2 LEU 47 -9.061 -13.111 0.249
434 2HD2 LEU 47 2HD2 LEU 47 -9.677 -11.457 0.085
435 3HD2 LEU 47 3HD2 LEU 47 -9.967 -12.369 1.576
436 H GLY 48 H GLY 48 -12.178 -14.280 -3.968
437 1HA GLY 48 1HA GLY 48 -12.581 -16.574 -4.964
438 2HA GLY 48 2HA GLY 48 -12.509 -17.202 -3.312
439 1HN NH2 49 1HN NH2 49 -13.795 -15.044 -1.934
440 2HN NH2 49 2HN NH2 49 -15.510 -15.030 -2.426
441 1H ACE 0 H1 ACE 0 11.471 14.360 -13.553
442 2H ACE 0 H2 ACE 0 12.681 15.480 -14.197
443 3H ACE 0 H3 ACE 0 11.242 16.121 -13.391
444 H ASP 1 H ASP 1 9.118 15.396 -16.306
445 HA ASP 1 HA ASP 1 9.210 14.753 -13.402
446 1HB ASP 1 1HB ASP 1 8.879 17.144 -13.474
447 2HB ASP 1 2HB ASP 1 7.608 17.008 -14.686
448 H TYR 2 H TYR 2 6.218 15.539 -15.110
449 HA TYR 2 HA TYR 2 4.685 13.543 -14.462
450 1HB TYR 2 1HB TYR 2 4.829 14.833 -17.171
451 2HB TYR 2 2HB TYR 2 3.498 13.881 -16.531
452 HD1 TYR 2 HD1 TYR 2 2.466 14.572 -14.226
453 HD2 TYR 2 HD2 TYR 2 4.890 17.141 -16.681
454 HE1 TYR 2 HE1 TYR 2 1.717 16.532 -12.908
455 HE2 TYR 2 HE2 TYR 2 4.158 19.116 -15.337
456 HH TYR 2 HH TYR 2 1.892 18.811 -12.605
457 H LEU 3 H LEU 3 6.760 13.270 -17.372
458 HA LEU 3 HA LEU 3 5.822 10.671 -17.931
459 1HB LEU 3 1HB LEU 3 8.576 11.840 -18.623
460 2HB LEU 3 2HB LEU 3 7.818 10.471 -19.442
461 HG LEU 3 HG LEU 3 6.774 13.346 -19.489
462 1HD1 LEU 3 1HD1 LEU 3 8.913 13.067 -20.689
463 2HD1 LEU 3 2HD1 LEU 3 8.228 11.707 -21.605
464 3HD1 LEU 3 3HD1 LEU 3 7.574 13.344 -21.816
465 1HD2 LEU 3 1HD2 LEU 3 5.879 10.838 -20.987
466 2HD2 LEU 3 2HD2 LEU 3 4.933 11.732 -19.776
467 3HD2 LEU 3 3HD2 LEU 3 5.317 12.488 -21.327
468 H ARG 4 H ARG 4 8.721 11.563 -16.081
469 HA ARG 4 HA ARG 4 9.531 8.823 -15.661
470 1HB ARG 4 1HB ARG 4 9.976 11.308 -13.956
471 2HB ARG 4 2HB ARG 4 10.814 9.759 -13.764
472 1HG ARG 4 1HG ARG 4 11.709 9.953 -16.087
473 2HG ARG 4 2HG ARG 4 10.854 11.490 -16.273
474 1HD ARG 4 1HD ARG 4 12.254 12.041 -14.005
475 2HD ARG 4 2HD ARG 4 13.389 10.935 -14.784
476 HE ARG 4 HE ARG 4 12.754 13.644 -15.499
477 1HH1 ARG 4 1HH2 ARG 4 13.649 10.591 -17.000
478 2HH1 ARG 4 2HH2 ARG 4 13.900 11.275 -18.583
479 1HH2 ARG 4 1HH1 ARG 4 12.860 14.521 -17.519
480 2HH2 ARG 4 2HH1 ARG 4 13.526 13.631 -18.873
481 H GLU 5 H GLU 5 6.935 10.807 -14.457
482 HA GLU 5 HA GLU 5 6.917 9.494 -11.814
483 1HB GLU 5 1HB GLU 5 6.395 12.033 -12.415
484 2HB GLU 5 2HB GLU 5 4.793 11.415 -12.788
485 1HG GLU 5 1HG GLU 5 4.656 12.121 -10.559
486 2HG GLU 5 2HG GLU 5 4.851 10.371 -10.402
487 H LEU 6 H LEU 6 5.074 9.561 -14.859
488 HA LEU 6 HA LEU 6 3.437 7.231 -14.012
489 1HB LEU 6 1HB LEU 6 3.389 9.099 -16.413
490 2HB LEU 6 2HB LEU 6 2.387 7.653 -16.227
491 HG LEU 6 HG LEU 6 1.380 8.696 -14.122
492 1HD1 LEU 6 1HD1 LEU 6 3.147 10.468 -13.795
493 2HD1 LEU 6 2HD1 LEU 6 2.419 11.316 -15.172
494 3HD1 LEU 6 3HD1 LEU 6 1.482 10.898 -13.691
495 1HD2 LEU 6 1HD2 LEU 6 1.121 10.070 -16.853
496 2HD2 LEU 6 2HD2 LEU 6 0.384 8.520 -16.422
497 3HD2 LEU 6 3HD2 LEU 6 -0.144 9.989 -15.621
498 H LEU 7 H LEU 7 6.458 7.100 -14.536
499 HA LEU 7 HA LEU 7 6.208 4.899 -16.423
500 1HB LEU 7 1HB LEU 7 7.178 6.857 -17.670
501 2HB LEU 7 2HB LEU 7 8.538 6.835 -16.532
502 HG LEU 7 HG LEU 7 8.672 4.264 -17.315
503 1HD1 LEU 7 1HD1 LEU 7 6.510 4.544 -18.655
504 2HD1 LEU 7 2HD1 LEU 7 7.404 5.615 -19.734
505 3HD1 LEU 7 3HD1 LEU 7 7.886 3.908 -19.570
506 1HD2 LEU 7 1HD2 LEU 7 9.583 6.573 -19.081
507 2HD2 LEU 7 2HD2 LEU 7 10.445 5.945 -17.658
508 3HD2 LEU 7 3HD2 LEU 7 10.231 4.917 -19.082
509 H LYS 8 H LYS 8 8.644 6.434 -14.224
510 HA LYS 8 HA LYS 8 9.917 3.948 -13.896
511 1HB LYS 8 1HB LYS 8 10.191 6.459 -12.221
512 2HB LYS 8 2HB LYS 8 11.285 5.057 -12.223
513 1HG LYS 8 1HG LYS 8 11.257 5.526 -14.877
514 2HG LYS 8 2HG LYS 8 10.884 7.167 -14.362
515 1HD LYS 8 1HD LYS 8 13.291 5.523 -13.402
516 2HD LYS 8 2HD LYS 8 13.319 6.578 -14.810
517 1HE LYS 8 1HE LYS 8 14.317 7.726 -12.932
518 2HE LYS 8 2HE LYS 8 12.833 8.556 -13.416
519 1HZ LYS 8 1HZ LYS 8 11.725 7.540 -11.583
520 2HZ LYS 8 2HZ LYS 8 13.059 6.661 -11.179
521 3HZ LYS 8 3HZ LYS 8 13.074 8.303 -11.035
522 H LEU 9 H LEU 9 7.609 5.790 -11.900
523 HA LEU 9 HA LEU 9 7.374 3.885 -9.782
524 1HB LEU 9 1HB LEU 9 5.460 5.903 -10.950
525 2HB LEU 9 2HB LEU 9 5.001 4.864 -9.611
526 HG LEU 9 HG LEU 9 7.531 6.529 -9.416
527 1HD1 LEU 9 1HD1 LEU 9 5.845 8.178 -9.899
528 2HD1 LEU 9 2HD1 LEU 9 4.689 7.423 -8.780
529 3HD1 LEU 9 3HD1 LEU 9 6.153 8.223 -8.164
530 1HD2 LEU 9 1HD2 LEU 9 5.559 5.486 -7.326
531 2HD2 LEU 9 2HD2 LEU 9 7.104 4.711 -7.718
532 3HD2 LEU 9 3HD2 LEU 9 7.087 6.328 -7.003
533 H GLU 10 H GLU 10 5.760 4.046 -13.032
534 HA GLU 10 HA GLU 10 4.100 1.786 -12.566
535 1HB GLU 10 1HB GLU 10 5.331 2.487 -15.228
536 2HB GLU 10 2HB GLU 10 3.841 1.631 -14.808
537 1HG GLU 10 1HG GLU 10 4.275 4.595 -14.424
538 2HG GLU 10 2HG GLU 10 3.436 3.869 -15.794
539 H LEU 11 H LEU 11 7.440 2.106 -13.755
540 HA LEU 11 HA LEU 11 7.874 -0.556 -14.559
541 1HB LEU 11 1HB LEU 11 9.388 1.588 -14.819
542 2HB LEU 11 2HB LEU 11 9.997 1.158 -13.218
543 HG LEU 11 HG LEU 11 10.478 -1.191 -14.246
544 1HD1 LEU 11 1HD1 LEU 11 9.200 -0.846 -16.371
545 2HD1 LEU 11 2HD1 LEU 11 10.269 0.508 -16.784
546 3HD1 LEU 11 3HD1 LEU 11 10.915 -1.141 -16.688
547 1HD2 LEU 11 1HD2 LEU 11 12.037 1.284 -15.107
548 2HD2 LEU 11 2HD2 LEU 11 12.226 0.394 -13.581
549 3HD2 LEU 11 3HD2 LEU 11 12.658 -0.382 -15.115
550 H GLN 12 H GLN 12 8.253 0.976 -11.335
551 HA GLN 12 HA GLN 12 9.171 -1.393 -10.023
552 1HB GLN 12 1HB GLN 12 7.692 1.071 -9.014
553 2HB GLN 12 2HB GLN 12 8.034 -0.297 -7.974
554 1HG GLN 12 1HG GLN 12 10.003 0.572 -7.506
555 2HG GLN 12 2HG GLN 12 10.535 0.118 -9.120
556 1HE2 GLN 12 2HE2 GLN 12 8.533 2.745 -7.644
557 2HE2 GLN 12 1HE2 GLN 12 9.407 4.047 -8.442
558 H LEU 13 H LEU 13 5.909 -0.630 -11.150
559 HA LEU 13 HA LEU 13 4.601 -2.568 -9.434
560 1HB LEU 13 1HB LEU 13 3.630 -1.572 -12.151
561 2HB LEU 13 2HB LEU 13 2.758 -2.444 -10.909
562 HG LEU 13 HG LEU 13 3.716 0.418 -10.827
563 1HD1 LEU 13 1HD1 LEU 13 1.643 0.007 -12.066
564 2HD1 LEU 13 2HD1 LEU 13 1.000 -0.980 -10.741
565 3HD1 LEU 13 3HD1 LEU 13 1.206 0.752 -10.518
566 1HD2 LEU 13 1HD2 LEU 13 2.532 -1.208 -8.546
567 2HD2 LEU 13 2HD2 LEU 13 4.104 -0.386 -8.578
568 3HD2 LEU 13 3HD2 LEU 13 2.612 0.564 -8.602
569 H ILE 14 H ILE 14 5.562 -2.482 -12.903
570 HA ILE 14 HA ILE 14 5.037 -5.231 -13.510
571 HB ILE 14 HB ILE 14 7.361 -3.451 -14.515
572 1HG1 ILE 14 1HG1 ILE 14 5.491 -2.111 -14.912
573 2HG1 ILE 14 2HG1 ILE 14 5.847 -2.910 -16.436
574 1HG2 ILE 14 1HG2 ILE 14 7.229 -4.801 -16.575
575 2HG2 ILE 14 2HG2 ILE 14 7.637 -5.796 -15.180
576 3HG2 ILE 14 3HG2 ILE 14 5.991 -5.837 -15.835
577 1HD1 ILE 14 1HD1 ILE 14 4.063 -4.641 -15.785
578 2HD1 ILE 14 2HD1 ILE 14 3.591 -3.526 -14.485
579 3HD1 ILE 14 3HD1 ILE 14 3.495 -3.016 -16.175
580 H LYS 15 H LYS 15 7.964 -3.715 -12.467
581 HA LYS 15 HA LYS 15 9.509 -6.048 -12.049
582 1HB LYS 15 1HB LYS 15 10.195 -3.516 -11.726
583 2HB LYS 15 2HB LYS 15 9.746 -3.806 -10.045
584 1HG LYS 15 1HG LYS 15 12.018 -4.350 -10.024
585 2HG LYS 15 2HG LYS 15 11.315 -5.947 -10.318
586 1HD LYS 15 1HD LYS 15 11.595 -5.405 -12.856
587 2HD LYS 15 2HD LYS 15 12.523 -3.992 -12.332
588 1HE LYS 15 1HE LYS 15 14.050 -5.596 -11.049
589 2HE LYS 15 2HE LYS 15 13.177 -6.933 -11.828
590 1HZ LYS 15 1HZ LYS 15 13.829 -5.991 -13.949
591 2HZ LYS 15 2HZ LYS 15 14.680 -4.806 -13.184
592 3HZ LYS 15 3HZ LYS 15 15.139 -6.379 -13.029
593 H GLN 16 H GLN 16 7.330 -4.488 -9.619
594 HA GLN 16 HA GLN 16 7.866 -6.486 -7.559
595 1HB GLN 16 1HB GLN 16 5.846 -4.262 -7.926
596 2HB GLN 16 2HB GLN 16 5.459 -5.570 -6.830
597 1HG GLN 16 1HG GLN 16 6.426 -3.797 -5.573
598 2HG GLN 16 2HG GLN 16 7.459 -5.224 -5.503
599 1HE2 GLN 16 2HE2 GLN 16 9.385 -5.183 -7.127
600 2HE2 GLN 16 1HE2 GLN 16 10.146 -3.610 -7.322
601 H TYR 17 H TYR 17 5.644 -6.247 -10.252
602 HA TYR 17 HA TYR 17 3.849 -8.309 -9.399
603 1HB TYR 17 1HB TYR 17 4.494 -6.867 -11.994
604 2HB TYR 17 2HB TYR 17 3.516 -8.279 -12.021
605 HD1 TYR 17 HD1 TYR 17 3.133 -4.990 -12.412
606 HD2 TYR 17 HD2 TYR 17 1.539 -8.280 -10.165
607 HE1 TYR 17 HE1 TYR 17 0.972 -3.848 -12.309
608 HE2 TYR 17 HE2 TYR 17 -0.651 -7.117 -10.042
609 HH TYR 17 HH TYR 17 -1.262 -4.062 -11.772
610 H ARG 18 H ARG 18 6.922 -8.248 -11.069
611 HA ARG 18 HA ARG 18 6.768 -11.033 -11.995
612 1HB ARG 18 1HB ARG 18 9.140 -9.138 -11.796
613 2HB ARG 18 2HB ARG 18 9.203 -10.804 -12.401
614 1HG ARG 18 1HG ARG 18 7.629 -10.254 -14.216
615 2HG ARG 18 2HG ARG 18 7.503 -8.603 -13.616
616 1HD ARG 18 1HD ARG 18 8.994 -8.472 -15.404
617 2HD ARG 18 2HD ARG 18 10.027 -8.363 -13.993
618 HE ARG 18 HE ARG 18 9.762 -10.536 -15.988
619 1HH1 ARG 18 1HH2 ARG 18 11.173 -9.667 -12.876
620 2HH1 ARG 18 2HH2 ARG 18 12.470 -10.828 -12.973
621 1HH2 ARG 18 1HH1 ARG 18 11.414 -12.053 -16.139
622 2HH2 ARG 18 2HH1 ARG 18 12.596 -12.236 -14.874
623 H GLU 19 H GLU 19 8.274 -9.207 -9.413
624 HA GLU 19 HA GLU 19 9.520 -11.326 -8.022
625 1HB GLU 19 1HB GLU 19 9.743 -8.834 -7.577
626 2HB GLU 19 2HB GLU 19 8.194 -8.935 -6.722
627 1HG GLU 19 1HG GLU 19 9.185 -10.696 -5.228
628 2HG GLU 19 2HG GLU 19 10.747 -10.435 -6.026
629 H ALA 20 H ALA 20 6.149 -10.040 -7.752
630 HA ALA 20 HA ALA 20 5.596 -11.924 -5.568
631 1HB ALA 20 1HB ALA 20 4.536 -9.856 -5.397
632 2HB ALA 20 2HB ALA 20 4.017 -9.881 -7.079
633 3HB ALA 20 3HB ALA 20 3.216 -10.930 -5.885
634 H LEU 21 H LEU 21 5.485 -12.094 -9.037
635 HA LEU 21 HA LEU 21 3.352 -13.479 -9.671
636 1HB LEU 21 1HB LEU 21 5.380 -12.738 -11.085
637 2HB LEU 21 2HB LEU 21 6.098 -14.308 -10.763
638 HG LEU 21 HG LEU 21 4.978 -14.000 -12.958
639 1HD1 LEU 21 1HD1 LEU 21 5.176 -16.313 -12.011
640 2HD1 LEU 21 2HD1 LEU 21 3.504 -16.165 -11.411
641 3HD1 LEU 21 3HD1 LEU 21 3.829 -16.080 -13.142
642 1HD2 LEU 21 1HD2 LEU 21 2.325 -14.031 -11.450
643 2HD2 LEU 21 2HD2 LEU 21 3.110 -12.549 -12.085
644 3HD2 LEU 21 3HD2 LEU 21 2.639 -13.874 -13.154
645 H GLU 22 H GLU 22 6.288 -15.109 -8.476
646 HA GLU 22 HA GLU 22 4.979 -17.726 -8.700
647 1HB GLU 22 1HB GLU 22 7.842 -17.027 -7.926
648 2HB GLU 22 2HB GLU 22 7.155 -18.651 -8.074
649 1HG GLU 22 1HG GLU 22 6.532 -18.101 -10.476
650 2HG GLU 22 2HG GLU 22 7.487 -16.616 -10.318
651 H TYR 23 H TYR 23 5.536 -15.298 -6.247
652 HA TYR 23 HA TYR 23 5.278 -17.125 -3.999
653 1HB TYR 23 1HB TYR 23 5.079 -14.128 -4.457
654 2HB TYR 23 2HB TYR 23 4.420 -14.836 -3.015
655 HD1 TYR 23 HD1 TYR 23 7.330 -13.340 -4.268
656 HD2 TYR 23 HD2 TYR 23 6.006 -16.597 -1.769
657 HE1 TYR 23 HE1 TYR 23 9.473 -13.270 -3.026
658 HE2 TYR 23 HE2 TYR 23 8.170 -16.575 -0.587
659 HH TYR 23 HH TYR 23 10.181 -15.508 -0.331
660 H VAL 24 H VAL 24 3.159 -15.280 -6.191
661 HA VAL 24 HA VAL 24 0.786 -16.209 -4.650
662 HB VAL 24 HB VAL 24 1.058 -14.290 -6.940
663 1HG1 VAL 24 1HG1 VAL 24 -1.252 -15.160 -6.875
664 2HG1 VAL 24 2HG1 VAL 24 -1.292 -15.015 -5.107
665 3HG1 VAL 24 3HG1 VAL 24 -1.284 -13.564 -6.117
666 1HG2 VAL 24 1HG2 VAL 24 0.698 -13.797 -3.954
667 2HG2 VAL 24 2HG2 VAL 24 2.162 -13.445 -4.889
668 3HG2 VAL 24 3HG2 VAL 24 0.681 -12.545 -5.213
669 H LYS 25 H LYS 25 2.424 -16.980 -7.690
670 HA LYS 25 HA LYS 25 2.089 -18.634 -9.208
671 1HB LYS 25 1HB LYS 25 0.902 -19.805 -6.696
672 2HB LYS 25 2HB LYS 25 0.663 -20.674 -8.210
673 1HG LYS 25 1HG LYS 25 2.953 -20.937 -8.622
674 2HG LYS 25 2HG LYS 25 3.414 -19.830 -7.314
675 1HD LYS 25 1HD LYS 25 2.663 -21.281 -5.608
676 2HD LYS 25 2HD LYS 25 1.747 -22.308 -6.718
677 1HE LYS 25 1HE LYS 25 4.792 -22.049 -6.756
678 2HE LYS 25 2HE LYS 25 3.909 -23.317 -5.889
679 1HZ LYS 25 1HZ LYS 25 2.953 -24.012 -7.960
680 2HZ LYS 25 2HZ LYS 25 3.796 -22.862 -8.786
681 3HZ LYS 25 3HZ LYS 25 4.598 -24.080 -8.020
682 H LEU 26 H LEU 26 0.739 -16.855 -10.350
683 HA LEU 26 HA LEU 26 -1.719 -18.216 -11.120
684 1HB LEU 26 1HB LEU 26 -1.784 -16.244 -9.089
685 2HB LEU 26 2HB LEU 26 -2.424 -15.418 -10.493
686 HG LEU 26 HG LEU 26 -3.469 -18.203 -9.871
687 1HD1 LEU 26 1HD1 LEU 26 -3.433 -17.239 -7.671
688 2HD1 LEU 26 2HD1 LEU 26 -4.193 -15.743 -8.250
689 3HD1 LEU 26 3HD1 LEU 26 -5.098 -17.271 -8.275
690 1HD2 LEU 26 1HD2 LEU 26 -4.842 -15.628 -10.742
691 2HD2 LEU 26 2HD2 LEU 26 -4.231 -16.866 -11.858
692 3HD2 LEU 26 3HD2 LEU 26 -5.543 -17.257 -10.733
693 HA PRO 27 HA PRO 27 -0.398 -16.351 -14.939
694 1HB PRO 27 1HB PRO 27 -2.456 -17.091 -16.600
695 2HB PRO 27 2HB PRO 27 -1.145 -18.185 -16.080
696 1HG PRO 27 1HG PRO 27 -3.912 -17.912 -14.877
697 2HG PRO 27 2HG PRO 27 -3.057 -19.415 -15.330
698 1HD PRO 27 1HD PRO 27 -3.080 -18.558 -12.780
699 2HD PRO 27 2HD PRO 27 -1.577 -19.231 -13.466
700 H VAL 28 H VAL 28 -3.572 -15.680 -13.401
701 HA VAL 28 HA VAL 28 -4.261 -13.453 -15.036
702 HB VAL 28 HB VAL 28 -4.684 -13.697 -12.080
703 1HG1 VAL 28 1HG1 VAL 28 -5.236 -11.463 -12.954
704 2HG1 VAL 28 2HG1 VAL 28 -6.274 -12.178 -14.196
705 3HG1 VAL 28 3HG1 VAL 28 -6.718 -12.305 -12.490
706 1HG2 VAL 28 1HG2 VAL 28 -6.710 -14.609 -14.147
707 2HG2 VAL 28 2HG2 VAL 28 -5.671 -15.732 -13.249
708 3HG2 VAL 28 3HG2 VAL 28 -6.825 -14.714 -12.382
709 H LEU 29 H LEU 29 -1.947 -13.784 -12.338
710 HA LEU 29 HA LEU 29 -1.443 -10.938 -12.030
711 1HB LEU 29 1HB LEU 29 -0.240 -13.568 -11.117
712 2HB LEU 29 2HB LEU 29 0.844 -12.207 -11.255
713 HG LEU 29 HG LEU 29 -1.682 -12.108 -9.599
714 1HD1 LEU 29 1HD1 LEU 29 -0.274 -13.864 -8.770
715 2HD1 LEU 29 2HD1 LEU 29 1.170 -12.824 -8.863
716 3HD1 LEU 29 3HD1 LEU 29 -0.123 -12.434 -7.711
717 1HD2 LEU 29 1HD2 LEU 29 0.882 -10.453 -9.574
718 2HD2 LEU 29 2HD2 LEU 29 -0.648 -9.876 -10.272
719 3HD2 LEU 29 3HD2 LEU 29 -0.549 -10.235 -8.538
720 H ALA 30 H ALA 30 0.350 -13.698 -13.461
721 HA ALA 30 HA ALA 30 2.265 -12.232 -14.552
722 1HB ALA 30 1HB ALA 30 2.044 -14.817 -14.894
723 2HB ALA 30 2HB ALA 30 0.891 -14.484 -16.178
724 3HB ALA 30 3HB ALA 30 2.570 -13.962 -16.352
725 H LYS 31 H LYS 31 -1.037 -12.752 -15.959
726 HA LYS 31 HA LYS 31 -0.380 -11.357 -18.448
727 1HB LYS 31 1HB LYS 31 -2.939 -12.543 -17.336
728 2HB LYS 31 2HB LYS 31 -2.956 -11.421 -18.706
729 1HG LYS 31 1HG LYS 31 -1.316 -12.822 -19.919
730 2HG LYS 31 2HG LYS 31 -1.391 -14.028 -18.617
731 1HD LYS 31 1HD LYS 31 -3.763 -14.424 -19.075
732 2HD LYS 31 2HD LYS 31 -3.826 -13.047 -20.197
733 1HE LYS 31 1HE LYS 31 -2.251 -14.161 -21.732
734 2HE LYS 31 2HE LYS 31 -2.127 -15.548 -20.633
735 1HZ LYS 31 1HZ LYS 31 -4.459 -15.940 -20.976
736 2HZ LYS 31 2HZ LYS 31 -4.575 -14.638 -21.980
737 3HZ LYS 31 3HZ LYS 31 -3.659 -15.933 -22.417
738 H ILE 32 H ILE 32 -1.444 -10.365 -15.235
739 HA ILE 32 HA ILE 32 -2.563 -7.870 -16.371
740 HB ILE 32 HB ILE 32 -1.942 -8.761 -13.549
741 1HG1 ILE 32 1HG1 ILE 32 -4.530 -7.677 -14.762
742 2HG1 ILE 32 2HG1 ILE 32 -4.097 -9.381 -14.921
743 1HG2 ILE 32 1HG2 ILE 32 -1.261 -6.452 -13.575
744 2HG2 ILE 32 2HG2 ILE 32 -2.607 -5.989 -14.624
745 3HG2 ILE 32 3HG2 ILE 32 -2.905 -6.438 -12.938
746 1HD1 ILE 32 1HD1 ILE 32 -3.901 -9.565 -12.477
747 2HD1 ILE 32 2HD1 ILE 32 -4.442 -7.883 -12.295
748 3HD1 ILE 32 3HD1 ILE 32 -5.539 -9.079 -13.001
749 H LEU 33 H LEU 33 0.469 -9.180 -14.946
750 HA LEU 33 HA LEU 33 1.696 -6.656 -14.831
751 1HB LEU 33 1HB LEU 33 3.484 -7.683 -14.075
752 2HB LEU 33 2HB LEU 33 2.184 -8.848 -13.662
753 HG LEU 33 HG LEU 33 2.976 -10.364 -15.188
754 1HD1 LEU 33 1HD1 LEU 33 3.889 -9.394 -17.062
755 2HD1 LEU 33 2HD1 LEU 33 4.805 -8.183 -16.099
756 3HD1 LEU 33 3HD1 LEU 33 5.333 -9.892 -16.188
757 1HD2 LEU 33 1HD2 LEU 33 5.158 -9.071 -13.517
758 2HD2 LEU 33 2HD2 LEU 33 3.935 -10.229 -12.938
759 3HD2 LEU 33 3HD2 LEU 33 5.190 -10.758 -14.067
760 H GLU 34 H GLU 34 1.456 -9.047 -17.425
761 HA GLU 34 HA GLU 34 3.250 -7.758 -19.147
762 1HB GLU 34 1HB GLU 34 2.144 -10.098 -19.348
763 2HB GLU 34 2HB GLU 34 0.747 -9.284 -20.030
764 1HG GLU 34 1HG GLU 34 2.198 -8.313 -21.829
765 2HG GLU 34 2HG GLU 34 3.565 -9.238 -21.185
766 H ASP 35 H ASP 35 -0.316 -7.556 -18.963
767 HA ASP 35 HA ASP 35 -0.677 -5.792 -21.151
768 1HB ASP 35 1HB ASP 35 -2.521 -6.995 -19.989
769 2HB ASP 35 2HB ASP 35 -2.348 -5.860 -18.626
770 H GLU 36 H GLU 36 -0.143 -5.023 -17.676
771 HA GLU 36 HA GLU 36 -0.307 -2.200 -17.861
772 1HB GLU 36 1HB GLU 36 1.427 -3.982 -16.109
773 2HB GLU 36 2HB GLU 36 1.206 -2.241 -15.882
774 1HG GLU 36 1HG GLU 36 -1.424 -3.439 -16.090
775 2HG GLU 36 2HG GLU 36 -0.458 -4.466 -15.034
776 H GLU 37 H GLU 37 2.432 -4.434 -18.586
777 HA GLU 37 HA GLU 37 4.448 -2.583 -18.889
778 1HB GLU 37 1HB GLU 37 4.096 -5.317 -19.067
779 2HB GLU 37 2HB GLU 37 4.251 -4.993 -20.773
780 1HG GLU 37 1HG GLU 37 6.201 -3.958 -18.660
781 2HG GLU 37 2HG GLU 37 6.247 -5.603 -19.287
782 H LYS 38 H LYS 38 1.989 -3.497 -21.325
783 HA LYS 38 HA LYS 38 3.186 -1.875 -23.410
784 1HB LYS 38 1HB LYS 38 1.702 -3.821 -23.779
785 2HB LYS 38 2HB LYS 38 0.347 -2.934 -23.064
786 1HG LYS 38 1HG LYS 38 0.395 -1.275 -24.857
787 2HG LYS 38 2HG LYS 38 1.922 -1.925 -25.487
788 1HD LYS 38 1HD LYS 38 0.818 -4.038 -26.082
789 2HD LYS 38 2HD LYS 38 -0.717 -3.463 -25.394
790 1HE LYS 38 1HE LYS 38 -0.827 -1.647 -27.055
791 2HE LYS 38 2HE LYS 38 0.770 -2.088 -27.692
792 1HZ LYS 38 1HZ LYS 38 -0.127 -4.179 -28.370
793 2HZ LYS 38 2HZ LYS 38 -1.612 -3.802 -27.763
794 3HZ LYS 38 3HZ LYS 38 -0.997 -2.947 -29.033
795 H HIS 39 H HIS 39 0.627 -1.212 -20.997
796 HA HIS 39 HA HIS 39 -0.111 1.345 -22.083
797 1HB HIS 39 1HB HIS 39 -0.165 0.188 -19.278
798 2HB HIS 39 2HB HIS 39 -0.788 1.782 -19.656
799 HD1 HIS 39 HD1 HIS 39 -2.605 1.529 -22.012
800 HD2 HIS 39 HD2 HIS 39 -2.028 -1.650 -19.311
801 HE1 HIS 39 HE1 HIS 39 -4.641 -0.027 -22.257
802 HE2 HIS 39 HE2 HIS 39 -4.272 -1.951 -20.591
803 H ILE 40 H ILE 40 2.448 0.310 -19.889
804 HA ILE 40 HA ILE 40 3.356 2.958 -19.139
805 HB ILE 40 HB ILE 40 4.706 0.237 -18.957
806 1HG1 ILE 40 1HG1 ILE 40 3.313 1.873 -16.809
807 2HG1 ILE 40 2HG1 ILE 40 2.409 0.719 -17.717
808 1HG2 ILE 40 1HG2 ILE 40 6.337 2.151 -18.750
809 2HG2 ILE 40 2HG2 ILE 40 5.282 2.908 -17.541
810 3HG2 ILE 40 3HG2 ILE 40 6.099 1.383 -17.186
811 1HD1 ILE 40 1HD1 ILE 40 3.984 -1.097 -17.164
812 2HD1 ILE 40 2HD1 ILE 40 4.835 -0.026 -16.045
813 3HD1 ILE 40 3HD1 ILE 40 3.132 -0.439 -15.755
814 H GLU 41 H GLU 41 4.460 0.431 -21.407
815 HA GLU 41 HA GLU 41 6.530 1.667 -22.676
816 1HB GLU 41 1HB GLU 41 5.690 -0.639 -23.073
817 2HB GLU 41 2HB GLU 41 4.377 0.014 -24.062
818 1HG GLU 41 1HG GLU 41 7.120 0.893 -24.832
819 2HG GLU 41 2HG GLU 41 6.765 -0.830 -25.018
820 H TRP 42 H TRP 42 3.013 2.394 -23.388
821 HA TRP 42 HA TRP 42 3.495 3.994 -25.616
822 1HB TRP 42 1HB TRP 42 1.331 3.241 -24.398
823 2HB TRP 42 2HB TRP 42 1.485 4.720 -23.486
824 HD1 TRP 42 HD1 TRP 42 0.977 3.519 -27.067
825 HE1 TRP 42 HE1 TRP 42 -0.206 5.436 -28.487
826 HE3 TRP 42 HE3 TRP 42 1.118 7.115 -23.596
827 HZ2 TRP 42 HZ2 TRP 42 -0.864 8.230 -28.053
828 HZ3 TRP 42 HZ3 TRP 42 0.215 9.417 -24.040
829 HH2 TRP 42 HH2 TRP 42 -0.668 9.991 -26.308
830 H LEU 43 H LEU 43 3.895 4.797 -22.188
831 HA LEU 43 HA LEU 43 4.457 7.620 -22.588
832 1HB LEU 43 1HB LEU 43 5.050 5.767 -20.242
833 2HB LEU 43 2HB LEU 43 5.451 7.464 -20.280
834 HG LEU 43 HG LEU 43 2.736 7.462 -21.011
835 1HD1 LEU 43 1HD1 LEU 43 2.541 5.101 -20.334
836 2HD1 LEU 43 2HD1 LEU 43 3.241 5.462 -18.750
837 3HD1 LEU 43 3HD1 LEU 43 1.663 6.136 -19.192
838 1HD2 LEU 43 1HD2 LEU 43 4.135 7.900 -18.341
839 2HD2 LEU 43 2HD2 LEU 43 3.812 9.118 -19.580
840 3HD2 LEU 43 3HD2 LEU 43 2.462 8.391 -18.685
841 H GLU 44 H GLU 44 6.348 4.893 -23.395
842 HA GLU 44 HA GLU 44 8.872 6.495 -23.377
843 1HB GLU 44 1HB GLU 44 8.297 3.516 -23.616
844 2HB GLU 44 2HB GLU 44 9.851 4.202 -24.074
845 1HG GLU 44 1HG GLU 44 8.860 4.993 -21.377
846 2HG GLU 44 2HG GLU 44 9.303 3.287 -21.575
847 H THR 45 H THR 45 6.254 5.949 -25.276
848 HA THR 45 HA THR 45 7.800 5.880 -27.828
849 HB THR 45 HB THR 45 5.666 4.338 -26.937
850 HG1 THR 45 HG1 THR 45 7.048 3.750 -28.518
851 1HG2 THR 45 1HG2 THR 45 3.995 6.133 -27.319
852 2HG2 THR 45 2HG2 THR 45 4.537 6.243 -29.011
853 3HG2 THR 45 3HG2 THR 45 3.802 4.748 -28.393
854 H ILE 46 H ILE 46 5.266 7.595 -26.054
855 HA ILE 46 HA ILE 46 4.500 9.556 -27.670
856 HB ILE 46 HB ILE 46 3.763 9.126 -25.394
857 1HG1 ILE 46 1HG1 ILE 46 4.142 11.985 -25.004
858 2HG1 ILE 46 2HG1 ILE 46 3.966 11.648 -26.735
859 1HG2 ILE 46 1HG2 ILE 46 6.013 9.023 -24.298
860 2HG2 ILE 46 2HG2 ILE 46 6.037 10.794 -24.282
861 3HG2 ILE 46 3HG2 ILE 46 4.761 9.926 -23.425
862 1HD1 ILE 46 1HD1 ILE 46 1.971 10.328 -26.327
863 2HD1 ILE 46 2HD1 ILE 46 2.098 10.675 -24.576
864 3HD1 ILE 46 3HD1 ILE 46 1.777 11.995 -25.733
865 H LEU 47 H LEU 47 5.489 10.941 -28.989
866 HA LEU 47 HA LEU 47 8.113 12.149 -28.327
867 1HB LEU 47 1HB LEU 47 7.919 13.188 -30.533
868 2HB LEU 47 2HB LEU 47 7.937 11.432 -30.579
869 HG LEU 47 HG LEU 47 5.210 12.696 -30.532
870 1HD1 LEU 47 1HD1 LEU 47 6.404 14.222 -32.037
871 2HD1 LEU 47 2HD1 LEU 47 7.036 12.843 -32.965
872 3HD1 LEU 47 3HD1 LEU 47 5.292 13.187 -32.950
873 1HD2 LEU 47 1HD2 LEU 47 6.448 10.505 -32.269
874 2HD2 LEU 47 2HD2 LEU 47 5.566 10.194 -30.769
875 3HD2 LEU 47 3HD2 LEU 47 4.725 10.916 -32.148
876 H GLY 48 H GLY 48 6.556 12.845 -26.351
877 1HA GLY 48 1HA GLY 48 5.622 14.646 -25.220
878 2HA GLY 48 2HA GLY 48 6.276 15.696 -26.494
879 1HN NH2 49 1HN NH2 49 4.377 17.029 -26.617
880 2HN NH2 49 2HN NH2 49 2.834 16.407 -27.263
Start of MODEL 14
1 1H ACE 0 H1 ACE 0 -1.813 20.178 -2.869
2 2H ACE 0 H2 ACE 0 -1.704 18.517 -2.240
3 3H ACE 0 H3 ACE 0 -2.950 18.939 -3.433
4 H ASP 1 H ASP 1 0.490 19.837 -3.381
5 HA ASP 1 HA ASP 1 1.069 19.663 -6.049
6 1HB ASP 1 1HB ASP 1 2.658 20.532 -4.397
7 2HB ASP 1 2HB ASP 1 2.885 18.914 -3.709
8 H TYR 2 H TYR 2 1.601 16.985 -3.720
9 HA TYR 2 HA TYR 2 2.574 15.128 -5.490
10 1HB TYR 2 1HB TYR 2 1.072 14.994 -2.858
11 2HB TYR 2 2HB TYR 2 1.483 13.542 -3.725
12 HD1 TYR 2 HD1 TYR 2 2.653 15.616 -1.203
13 HD2 TYR 2 HD2 TYR 2 4.004 13.395 -4.633
14 HE1 TYR 2 HE1 TYR 2 4.851 15.267 -0.127
15 HE2 TYR 2 HE2 TYR 2 6.108 12.875 -3.464
16 HH TYR 2 HH TYR 2 6.942 14.356 -0.303
17 H LEU 3 H LEU 3 -0.812 16.150 -5.090
18 HA LEU 3 HA LEU 3 -1.933 13.638 -5.889
19 1HB LEU 3 1HB LEU 3 -3.227 16.388 -5.973
20 2HB LEU 3 2HB LEU 3 -4.050 14.829 -5.956
21 HG LEU 3 HG LEU 3 -2.408 16.004 -3.659
22 1HD1 LEU 3 1HD1 LEU 3 -4.580 17.121 -4.068
23 2HD1 LEU 3 2HD1 LEU 3 -5.403 15.551 -3.957
24 3HD1 LEU 3 3HD1 LEU 3 -4.569 16.224 -2.539
25 1HD2 LEU 3 1HD2 LEU 3 -3.991 13.401 -3.829
26 2HD2 LEU 3 2HD2 LEU 3 -2.234 13.554 -3.603
27 3HD2 LEU 3 3HD2 LEU 3 -3.337 14.108 -2.337
28 H ARG 4 H ARG 4 -0.329 16.045 -7.747
29 HA ARG 4 HA ARG 4 -1.772 15.434 -10.230
30 1HB ARG 4 1HB ARG 4 1.003 16.612 -9.804
31 2HB ARG 4 2HB ARG 4 0.092 16.523 -11.320
32 1HG ARG 4 1HG ARG 4 -1.777 17.768 -9.774
33 2HG ARG 4 2HG ARG 4 -0.319 18.318 -8.937
34 1HD ARG 4 1HD ARG 4 -0.995 18.578 -11.892
35 2HD ARG 4 2HD ARG 4 -0.981 19.905 -10.712
36 HE ARG 4 HE ARG 4 1.552 19.005 -10.482
37 1HH1 ARG 4 1HH2 ARG 4 -0.356 19.830 -13.337
38 2HH1 ARG 4 2HH2 ARG 4 1.016 20.262 -14.317
39 1HH2 ARG 4 1HH1 ARG 4 3.351 19.599 -11.718
40 2HH2 ARG 4 2HH1 ARG 4 3.184 20.148 -13.361
41 H GLU 5 H GLU 5 0.612 13.865 -8.263
42 HA GLU 5 HA GLU 5 1.588 12.076 -10.441
43 1HB GLU 5 1HB GLU 5 2.235 12.104 -7.461
44 2HB GLU 5 2HB GLU 5 3.111 11.236 -8.721
45 1HG GLU 5 1HG GLU 5 3.968 13.310 -9.662
46 2HG GLU 5 2HG GLU 5 2.980 14.284 -8.561
47 H LEU 6 H LEU 6 1.712 9.745 -9.191
48 HA LEU 6 HA LEU 6 0.560 7.903 -8.717
49 1HB LEU 6 1HB LEU 6 -0.789 9.757 -6.781
50 2HB LEU 6 2HB LEU 6 -1.120 8.020 -6.860
51 HG LEU 6 HG LEU 6 1.605 9.184 -6.286
52 1HD1 LEU 6 1HD1 LEU 6 -0.133 9.506 -4.515
53 2HD1 LEU 6 2HD1 LEU 6 -0.542 7.783 -4.603
54 3HD1 LEU 6 3HD1 LEU 6 1.034 8.289 -3.997
55 1HD2 LEU 6 1HD2 LEU 6 0.613 6.329 -6.527
56 2HD2 LEU 6 2HD2 LEU 6 1.988 7.075 -7.367
57 3HD2 LEU 6 3HD2 LEU 6 2.091 6.779 -5.651
58 H LEU 7 H LEU 7 -0.495 9.600 -10.975
59 HA LEU 7 HA LEU 7 -2.727 7.880 -11.430
60 1HB LEU 7 1HB LEU 7 -4.395 9.577 -12.064
61 2HB LEU 7 2HB LEU 7 -3.998 9.553 -10.361
62 HG LEU 7 HG LEU 7 -2.281 11.538 -11.203
63 1HD1 LEU 7 1HD1 LEU 7 -3.354 11.488 -13.543
64 2HD1 LEU 7 2HD1 LEU 7 -4.884 11.908 -12.764
65 3HD1 LEU 7 3HD1 LEU 7 -3.512 13.029 -12.686
66 1HD2 LEU 7 1HD2 LEU 7 -5.170 11.777 -10.299
67 2HD2 LEU 7 2HD2 LEU 7 -3.732 11.657 -9.262
68 3HD2 LEU 7 3HD2 LEU 7 -3.979 13.087 -10.281
69 H LYS 8 H LYS 8 -1.268 10.844 -12.811
70 HA LYS 8 HA LYS 8 -1.578 10.003 -15.419
71 1HB LYS 8 1HB LYS 8 -0.460 12.242 -14.064
72 2HB LYS 8 2HB LYS 8 0.866 11.650 -15.059
73 1HG LYS 8 1HG LYS 8 -1.955 12.209 -16.096
74 2HG LYS 8 2HG LYS 8 -0.654 13.406 -16.079
75 1HD LYS 8 1HD LYS 8 0.749 12.025 -17.523
76 2HD LYS 8 2HD LYS 8 -0.442 10.710 -17.516
77 1HE LYS 8 1HE LYS 8 -2.085 12.094 -18.662
78 2HE LYS 8 2HE LYS 8 -1.044 13.526 -18.540
79 1HZ LYS 8 1HZ LYS 8 0.534 12.451 -19.944
80 2HZ LYS 8 2HZ LYS 8 -0.392 11.090 -20.042
81 3HZ LYS 8 3HZ LYS 8 -0.934 12.505 -20.690
82 H LEU 9 H LEU 9 1.078 9.469 -13.186
83 HA LEU 9 HA LEU 9 2.766 7.984 -15.017
84 1HB LEU 9 1HB LEU 9 2.562 7.947 -11.971
85 2HB LEU 9 2HB LEU 9 3.839 7.158 -12.899
86 HG LEU 9 HG LEU 9 3.303 10.170 -12.949
87 1HD1 LEU 9 1HD1 LEU 9 4.036 9.425 -10.714
88 2HD1 LEU 9 2HD1 LEU 9 5.422 8.583 -11.438
89 3HD1 LEU 9 3HD1 LEU 9 5.305 10.352 -11.529
90 1HD2 LEU 9 1HD2 LEU 9 5.617 8.482 -14.018
91 2HD2 LEU 9 2HD2 LEU 9 4.459 9.413 -14.993
92 3HD2 LEU 9 3HD2 LEU 9 5.598 10.253 -13.941
93 H GLU 10 H GLU 10 0.038 7.144 -12.872
94 HA GLU 10 HA GLU 10 0.442 4.302 -13.036
95 1HB GLU 10 1HB GLU 10 -2.108 5.819 -12.485
96 2HB GLU 10 2HB GLU 10 -1.703 4.142 -12.115
97 1HG GLU 10 1HG GLU 10 -0.437 6.611 -10.827
98 2HG GLU 10 2HG GLU 10 -1.635 5.591 -10.062
99 H LEU 11 H LEU 11 -1.333 6.611 -15.082
100 HA LEU 11 HA LEU 11 -2.793 4.632 -16.534
101 1HB LEU 11 1HB LEU 11 -3.091 7.104 -16.788
102 2HB LEU 11 2HB LEU 11 -1.488 7.219 -17.525
103 HG LEU 11 HG LEU 11 -2.271 5.811 -19.440
104 1HD1 LEU 11 1HD1 LEU 11 -4.102 4.549 -18.377
105 2HD1 LEU 11 2HD1 LEU 11 -4.988 6.059 -18.063
106 3HD1 LEU 11 3HD1 LEU 11 -4.731 5.496 -19.727
107 1HD2 LEU 11 1HD2 LEU 11 -3.939 8.290 -18.870
108 2HD2 LEU 11 2HD2 LEU 11 -2.296 8.266 -19.550
109 3HD2 LEU 11 3HD2 LEU 11 -3.643 7.566 -20.466
110 H GLN 12 H GLN 12 0.634 5.581 -16.833
111 HA GLN 12 HA GLN 12 1.104 4.191 -19.275
112 1HB GLN 12 1HB GLN 12 3.291 4.800 -18.977
113 2HB GLN 12 2HB GLN 12 2.619 5.852 -17.732
114 1HG GLN 12 1HG GLN 12 3.111 3.884 -16.086
115 2HG GLN 12 2HG GLN 12 4.025 3.167 -17.409
116 1HE2 GLN 12 2HE2 GLN 12 3.855 5.724 -15.057
117 2HE2 GLN 12 1HE2 GLN 12 5.521 6.291 -15.251
118 H LEU 13 H LEU 13 0.646 3.026 -16.040
119 HA LEU 13 HA LEU 13 2.145 0.571 -16.275
120 1HB LEU 13 1HB LEU 13 -0.131 1.195 -14.352
121 2HB LEU 13 2HB LEU 13 1.120 -0.032 -14.193
122 HG LEU 13 HG LEU 13 1.648 2.977 -14.195
123 1HD1 LEU 13 1HD1 LEU 13 0.242 2.212 -12.301
124 2HD1 LEU 13 2HD1 LEU 13 1.378 0.914 -11.981
125 3HD1 LEU 13 3HD1 LEU 13 1.872 2.629 -11.755
126 1HD2 LEU 13 1HD2 LEU 13 3.443 0.590 -13.682
127 2HD2 LEU 13 2HD2 LEU 13 3.605 1.790 -14.967
128 3HD2 LEU 13 3HD2 LEU 13 3.849 2.280 -13.296
129 H ILE 14 H ILE 14 -1.341 1.493 -16.238
130 HA ILE 14 HA ILE 14 -2.329 -1.108 -16.822
131 HB ILE 14 HB ILE 14 -3.371 1.731 -17.058
132 1HG1 ILE 14 1HG1 ILE 14 -4.952 0.960 -15.428
133 2HG1 ILE 14 2HG1 ILE 14 -4.555 -0.740 -15.691
134 1HG2 ILE 14 1HG2 ILE 14 -4.405 0.659 -19.037
135 2HG2 ILE 14 2HG2 ILE 14 -4.867 -0.753 -18.055
136 3HG2 ILE 14 3HG2 ILE 14 -5.596 0.829 -17.740
137 1HD1 ILE 14 1HD1 ILE 14 -2.410 -0.461 -14.563
138 2HD1 ILE 14 2HD1 ILE 14 -2.700 1.297 -14.430
139 3HD1 ILE 14 3HD1 ILE 14 -3.734 0.136 -13.563
140 H LYS 15 H LYS 15 -1.230 1.449 -19.097
141 HA LYS 15 HA LYS 15 -1.593 -0.064 -21.441
142 1HB LYS 15 1HB LYS 15 -0.699 2.501 -20.797
143 2HB LYS 15 2HB LYS 15 0.793 1.721 -21.296
144 1HG LYS 15 1HG LYS 15 -0.142 2.759 -23.215
145 2HG LYS 15 2HG LYS 15 -0.404 1.019 -23.429
146 1HD LYS 15 1HD LYS 15 -2.775 1.318 -22.609
147 2HD LYS 15 2HD LYS 15 -2.463 3.043 -22.375
148 1HE LYS 15 1HE LYS 15 -2.109 3.351 -24.778
149 2HE LYS 15 2HE LYS 15 -2.203 1.601 -25.058
150 1HZ LYS 15 1HZ LYS 15 -4.463 1.650 -24.323
151 2HZ LYS 15 2HZ LYS 15 -4.394 3.273 -24.044
152 3HZ LYS 15 3HZ LYS 15 -4.250 2.693 -25.580
153 H GLN 16 H GLN 16 1.286 0.143 -19.256
154 HA GLN 16 HA GLN 16 2.893 -1.617 -20.900
155 1HB GLN 16 1HB GLN 16 3.083 -0.776 -17.986
156 2HB GLN 16 2HB GLN 16 4.177 -1.959 -18.709
157 1HG GLN 16 1HG GLN 16 4.912 -0.356 -20.402
158 2HG GLN 16 2HG GLN 16 3.811 0.870 -19.755
159 1HE2 GLN 16 2HE2 GLN 16 5.569 2.334 -19.230
160 2HE2 GLN 16 1HE2 GLN 16 6.656 1.969 -17.906
161 H TYR 17 H TYR 17 0.481 -2.157 -18.442
162 HA TYR 17 HA TYR 17 1.072 -4.907 -17.898
163 1HB TYR 17 1HB TYR 17 -1.169 -2.964 -17.301
164 2HB TYR 17 2HB TYR 17 -1.526 -4.655 -17.217
165 HD1 TYR 17 HD1 TYR 17 -0.261 -6.224 -15.755
166 HD2 TYR 17 HD2 TYR 17 -0.401 -1.959 -15.240
167 HE1 TYR 17 HE1 TYR 17 0.204 -6.470 -13.321
168 HE2 TYR 17 HE2 TYR 17 0.321 -2.200 -12.899
169 HH TYR 17 HH TYR 17 1.188 -3.698 -11.332
170 H ARG 18 H ARG 18 -0.800 -3.169 -20.325
171 HA ARG 18 HA ARG 18 -2.079 -5.631 -21.306
172 1HB ARG 18 1HB ARG 18 -1.955 -2.852 -22.518
173 2HB ARG 18 2HB ARG 18 -2.731 -4.261 -23.258
174 1HG ARG 18 1HG ARG 18 -4.115 -4.507 -21.106
175 2HG ARG 18 2HG ARG 18 -3.476 -2.939 -20.627
176 1HD ARG 18 1HD ARG 18 -5.589 -2.517 -21.675
177 2HD ARG 18 2HD ARG 18 -4.345 -2.027 -22.848
178 HE ARG 18 HE ARG 18 -5.195 -4.809 -23.106
179 1HH1 ARG 18 1HH2 ARG 18 -6.025 -1.510 -24.020
180 2HH1 ARG 18 2HH2 ARG 18 -6.972 -1.971 -25.409
181 1HH2 ARG 18 1HH1 ARG 18 -6.458 -5.449 -24.862
182 2HH2 ARG 18 2HH1 ARG 18 -7.240 -4.281 -25.890
183 H GLU 19 H GLU 19 0.574 -3.507 -22.157
184 HA GLU 19 HA GLU 19 1.514 -4.850 -24.467
185 1HB GLU 19 1HB GLU 19 2.299 -2.620 -23.490
186 2HB GLU 19 2HB GLU 19 3.318 -3.576 -22.396
187 1HG GLU 19 1HG GLU 19 4.415 -4.636 -24.355
188 2HG GLU 19 2HG GLU 19 3.404 -3.665 -25.440
189 H ALA 20 H ALA 20 2.162 -5.453 -20.980
190 HA ALA 20 HA ALA 20 3.974 -7.654 -21.598
191 1HB ALA 20 1HB ALA 20 4.362 -6.295 -19.646
192 2HB ALA 20 2HB ALA 20 2.752 -6.703 -19.021
193 3HB ALA 20 3HB ALA 20 4.007 -7.964 -19.149
194 H LEU 21 H LEU 21 0.521 -7.361 -20.747
195 HA LEU 21 HA LEU 21 -0.215 -9.805 -19.911
196 1HB LEU 21 1HB LEU 21 -1.717 -7.870 -20.409
197 2HB LEU 21 2HB LEU 21 -1.660 -8.270 -22.122
198 HG LEU 21 HG LEU 21 -3.712 -8.837 -20.963
199 1HD1 LEU 21 1HD1 LEU 21 -3.043 -10.137 -22.990
200 2HD1 LEU 21 2HD1 LEU 21 -2.528 -11.452 -21.897
201 3HD1 LEU 21 3HD1 LEU 21 -4.207 -10.915 -21.900
202 1HD2 LEU 21 1HD2 LEU 21 -2.132 -10.959 -19.452
203 2HD2 LEU 21 2HD2 LEU 21 -2.805 -9.447 -18.795
204 3HD2 LEU 21 3HD2 LEU 21 -3.882 -10.720 -19.404
205 H GLU 22 H GLU 22 0.494 -8.996 -23.293
206 HA GLU 22 HA GLU 22 -0.349 -11.568 -24.279
207 1HB GLU 22 1HB GLU 22 0.823 -10.794 -26.423
208 2HB GLU 22 2HB GLU 22 -0.586 -9.875 -25.874
209 1HG GLU 22 1HG GLU 22 0.768 -8.100 -25.007
210 2HG GLU 22 2HG GLU 22 2.260 -9.041 -25.231
211 H TYR 23 H TYR 23 2.773 -10.166 -23.372
212 HA TYR 23 HA TYR 23 4.422 -12.388 -24.232
213 1HB TYR 23 1HB TYR 23 4.734 -9.912 -22.599
214 2HB TYR 23 2HB TYR 23 5.657 -11.270 -21.996
215 HD1 TYR 23 HD1 TYR 23 5.160 -9.051 -24.939
216 HD2 TYR 23 HD2 TYR 23 7.560 -12.159 -23.154
217 HE1 TYR 23 HE1 TYR 23 6.904 -8.689 -26.653
218 HE2 TYR 23 HE2 TYR 23 9.313 -11.785 -24.871
219 HH TYR 23 HH TYR 23 8.961 -9.342 -27.448
220 H VAL 24 H VAL 24 2.639 -11.521 -21.303
221 HA VAL 24 HA VAL 24 3.640 -13.785 -19.767
222 HB VAL 24 HB VAL 24 1.465 -11.721 -19.277
223 1HG1 VAL 24 1HG1 VAL 24 0.893 -13.660 -17.935
224 2HG1 VAL 24 2HG1 VAL 24 2.578 -13.872 -17.418
225 3HG1 VAL 24 3HG1 VAL 24 1.642 -12.471 -16.868
226 1HG2 VAL 24 1HG2 VAL 24 4.255 -12.099 -18.104
227 2HG2 VAL 24 2HG2 VAL 24 3.864 -10.908 -19.357
228 3HG2 VAL 24 3HG2 VAL 24 3.161 -10.758 -17.747
229 H LYS 25 H LYS 25 0.910 -13.211 -21.921
230 HA LYS 25 HA LYS 25 -0.510 -14.535 -22.869
231 1HB LYS 25 1HB LYS 25 2.026 -15.657 -22.879
232 2HB LYS 25 2HB LYS 25 1.044 -17.005 -22.291
233 1HG LYS 25 1HG LYS 25 -0.480 -16.609 -24.210
234 2HG LYS 25 2HG LYS 25 0.567 -15.312 -24.809
235 1HD LYS 25 1HD LYS 25 1.871 -17.942 -24.176
236 2HD LYS 25 2HD LYS 25 0.850 -17.895 -25.624
237 1HE LYS 25 1HE LYS 25 3.098 -15.892 -25.088
238 2HE LYS 25 2HE LYS 25 3.339 -17.401 -25.983
239 1HZ LYS 25 1HZ LYS 25 1.688 -16.688 -27.548
240 2HZ LYS 25 2HZ LYS 25 1.468 -15.270 -26.735
241 3HZ LYS 25 3HZ LYS 25 2.915 -15.592 -27.453
242 H LEU 26 H LEU 26 -0.980 -14.119 -20.016
243 HA LEU 26 HA LEU 26 -2.675 -16.501 -19.405
244 1HB LEU 26 1HB LEU 26 -0.579 -16.536 -18.089
245 2HB LEU 26 2HB LEU 26 -0.913 -14.891 -17.549
246 HG LEU 26 HG LEU 26 -3.079 -15.793 -16.507
247 1HD1 LEU 26 1HD1 LEU 26 -3.155 -18.003 -17.655
248 2HD1 LEU 26 2HD1 LEU 26 -1.628 -18.447 -16.861
249 3HD1 LEU 26 3HD1 LEU 26 -3.087 -18.165 -15.892
250 1HD2 LEU 26 1HD2 LEU 26 -0.391 -16.755 -15.462
251 2HD2 LEU 26 2HD2 LEU 26 -1.074 -15.133 -15.232
252 3HD2 LEU 26 3HD2 LEU 26 -1.870 -16.538 -14.501
253 HA PRO 27 HA PRO 27 -5.360 -12.842 -19.349
254 1HB PRO 27 1HB PRO 27 -7.815 -14.026 -19.121
255 2HB PRO 27 2HB PRO 27 -6.831 -14.088 -20.605
256 1HG PRO 27 1HG PRO 27 -7.001 -16.188 -18.428
257 2HG PRO 27 2HG PRO 27 -7.191 -16.424 -20.190
258 1HD PRO 27 1HD PRO 27 -4.834 -16.877 -18.923
259 2HD PRO 27 2HD PRO 27 -4.856 -16.156 -20.560
260 H VAL 28 H VAL 28 -4.102 -14.081 -16.759
261 HA VAL 28 HA VAL 28 -6.092 -13.353 -14.704
262 HB VAL 28 HB VAL 28 -3.269 -14.341 -14.596
263 1HG1 VAL 28 1HG1 VAL 28 -3.482 -12.854 -12.727
264 2HG1 VAL 28 2HG1 VAL 28 -5.097 -13.483 -12.326
265 3HG1 VAL 28 3HG1 VAL 28 -3.653 -14.494 -12.105
266 1HG2 VAL 28 1HG2 VAL 28 -5.884 -15.587 -13.643
267 2HG2 VAL 28 2HG2 VAL 28 -5.023 -16.060 -15.122
268 3HG2 VAL 28 3HG2 VAL 28 -4.276 -16.329 -13.538
269 H LEU 29 H LEU 29 -3.121 -12.184 -16.365
270 HA LEU 29 HA LEU 29 -2.636 -10.063 -14.516
271 1HB LEU 29 1HB LEU 29 -1.570 -10.955 -17.157
272 2HB LEU 29 2HB LEU 29 -1.644 -9.213 -16.958
273 HG LEU 29 HG LEU 29 -0.024 -11.149 -15.311
274 1HD1 LEU 29 1HD1 LEU 29 0.777 -10.290 -17.547
275 2HD1 LEU 29 2HD1 LEU 29 0.651 -8.639 -16.926
276 3HD1 LEU 29 3HD1 LEU 29 1.798 -9.774 -16.189
277 1HD2 LEU 29 1HD2 LEU 29 -0.779 -8.264 -14.715
278 2HD2 LEU 29 2HD2 LEU 29 -0.715 -9.641 -13.591
279 3HD2 LEU 29 3HD2 LEU 29 0.776 -8.939 -14.192
280 H ALA 30 H ALA 30 -4.580 -10.389 -17.475
281 HA ALA 30 HA ALA 30 -5.196 -7.598 -17.548
282 1HB ALA 30 1HB ALA 30 -5.507 -8.984 -19.572
283 2HB ALA 30 2HB ALA 30 -6.729 -9.970 -18.731
284 3HB ALA 30 3HB ALA 30 -7.048 -8.261 -19.100
285 H LYS 31 H LYS 31 -6.367 -10.200 -15.566
286 HA LYS 31 HA LYS 31 -8.839 -8.742 -14.912
287 1HB LYS 31 1HB LYS 31 -8.225 -11.387 -14.811
288 2HB LYS 31 2HB LYS 31 -7.868 -10.939 -13.132
289 1HG LYS 31 1HG LYS 31 -10.148 -9.879 -12.995
290 2HG LYS 31 2HG LYS 31 -10.442 -10.363 -14.680
291 1HD LYS 31 1HD LYS 31 -10.079 -12.762 -14.019
292 2HD LYS 31 2HD LYS 31 -9.952 -12.236 -12.323
293 1HE LYS 31 1HE LYS 31 -12.248 -11.239 -12.486
294 2HE LYS 31 2HE LYS 31 -12.360 -11.794 -14.168
295 1HZ LYS 31 1HZ LYS 31 -12.138 -14.037 -13.376
296 2HZ LYS 31 2HZ LYS 31 -12.058 -13.517 -11.812
297 3HZ LYS 31 3HZ LYS 31 -13.437 -13.293 -12.686
298 H ILE 32 H ILE 32 -5.723 -9.494 -13.487
299 HA ILE 32 HA ILE 32 -5.963 -8.024 -11.047
300 HB ILE 32 HB ILE 32 -3.503 -8.580 -12.773
301 1HG1 ILE 32 1HG1 ILE 32 -4.343 -9.786 -10.101
302 2HG1 ILE 32 2HG1 ILE 32 -4.789 -10.513 -11.650
303 1HG2 ILE 32 1HG2 ILE 32 -2.973 -6.615 -11.461
304 2HG2 ILE 32 2HG2 ILE 32 -3.829 -7.267 -10.063
305 3HG2 ILE 32 3HG2 ILE 32 -2.281 -7.959 -10.561
306 1HD1 ILE 32 1HD1 ILE 32 -2.399 -10.733 -12.259
307 2HD1 ILE 32 2HD1 ILE 32 -1.932 -10.091 -10.674
308 3HD1 ILE 32 3HD1 ILE 32 -2.826 -11.610 -10.781
309 H LEU 33 H LEU 33 -4.726 -7.012 -14.249
310 HA LEU 33 HA LEU 33 -4.066 -4.442 -13.400
311 1HB LEU 33 1HB LEU 33 -3.418 -3.975 -15.558
312 2HB LEU 33 2HB LEU 33 -3.251 -5.720 -15.404
313 HG LEU 33 HG LEU 33 -5.558 -5.866 -16.460
314 1HD1 LEU 33 1HD1 LEU 33 -6.646 -3.895 -16.637
315 2HD1 LEU 33 2HD1 LEU 33 -5.144 -2.946 -16.568
316 3HD1 LEU 33 3HD1 LEU 33 -5.680 -3.698 -18.093
317 1HD2 LEU 33 1HD2 LEU 33 -3.381 -4.602 -18.152
318 2HD2 LEU 33 2HD2 LEU 33 -3.264 -6.274 -17.533
319 3HD2 LEU 33 3HD2 LEU 33 -4.552 -5.819 -18.670
320 H GLU 34 H GLU 34 -7.113 -5.806 -14.489
321 HA GLU 34 HA GLU 34 -8.540 -3.383 -14.968
322 1HB GLU 34 1HB GLU 34 -9.129 -5.860 -15.506
323 2HB GLU 34 2HB GLU 34 -9.725 -5.982 -13.878
324 1HG GLU 34 1HG GLU 34 -10.648 -3.905 -15.938
325 2HG GLU 34 2HG GLU 34 -11.472 -5.434 -15.615
326 H ASP 35 H ASP 35 -8.137 -5.461 -12.136
327 HA ASP 35 HA ASP 35 -9.565 -3.890 -10.263
328 1HB ASP 35 1HB ASP 35 -8.507 -6.266 -10.023
329 2HB ASP 35 2HB ASP 35 -7.060 -5.406 -9.470
330 H GLU 36 H GLU 36 -6.057 -3.812 -11.076
331 HA GLU 36 HA GLU 36 -5.344 -1.603 -9.489
332 1HB GLU 36 1HB GLU 36 -4.269 -2.419 -12.227
333 2HB GLU 36 2HB GLU 36 -3.518 -1.236 -11.159
334 1HG GLU 36 1HG GLU 36 -4.018 -4.103 -10.252
335 2HG GLU 36 2HG GLU 36 -2.532 -3.567 -11.042
336 H GLU 37 H GLU 37 -6.608 -1.509 -12.952
337 HA GLU 37 HA GLU 37 -6.528 1.146 -13.288
338 1HB GLU 37 1HB GLU 37 -7.382 -0.969 -14.703
339 2HB GLU 37 2HB GLU 37 -8.982 -0.493 -14.151
340 1HG GLU 37 1HG GLU 37 -7.088 1.517 -15.341
341 2HG GLU 37 2HG GLU 37 -7.825 0.296 -16.377
342 H LYS 38 H LYS 38 -9.021 -0.656 -11.464
343 HA LYS 38 HA LYS 38 -10.593 1.673 -10.838
344 1HB LYS 38 1HB LYS 38 -11.188 -0.866 -10.710
345 2HB LYS 38 2HB LYS 38 -10.319 -0.857 -9.176
346 1HG LYS 38 1HG LYS 38 -12.544 -0.487 -8.499
347 2HG LYS 38 2HG LYS 38 -11.874 1.149 -8.530
348 1HD LYS 38 1HD LYS 38 -12.780 1.195 -11.026
349 2HD LYS 38 2HD LYS 38 -13.722 -0.215 -10.524
350 1HE LYS 38 1HE LYS 38 -14.621 1.220 -8.595
351 2HE LYS 38 2HE LYS 38 -13.756 2.595 -9.315
352 1HZ LYS 38 1HZ LYS 38 -15.031 2.264 -11.309
353 2HZ LYS 38 2HZ LYS 38 -15.873 1.030 -10.608
354 3HZ LYS 38 3HZ LYS 38 -16.006 2.565 -10.016
355 H HIS 39 H HIS 39 -8.005 0.026 -8.945
356 HA HIS 39 HA HIS 39 -8.221 1.802 -6.705
357 1HB HIS 39 1HB HIS 39 -6.068 -0.020 -7.762
358 2HB HIS 39 2HB HIS 39 -5.632 1.190 -6.557
359 HD1 HIS 39 HD1 HIS 39 -6.792 1.011 -4.140
360 HD2 HIS 39 HD2 HIS 39 -7.667 -2.046 -6.895
361 HE1 HIS 39 HE1 HIS 39 -7.957 -0.840 -2.802
362 HE2 HIS 39 HE2 HIS 39 -8.457 -2.728 -4.500
363 H ILE 40 H ILE 40 -6.474 2.102 -9.747
364 HA ILE 40 HA ILE 40 -5.107 4.572 -9.036
365 HB ILE 40 HB ILE 40 -5.495 2.940 -11.553
366 1HG1 ILE 40 1HG1 ILE 40 -2.866 3.806 -10.329
367 2HG1 ILE 40 2HG1 ILE 40 -3.763 2.562 -9.500
368 1HG2 ILE 40 1HG2 ILE 40 -5.470 5.268 -12.349
369 2HG2 ILE 40 2HG2 ILE 40 -4.043 5.607 -11.347
370 3HG2 ILE 40 3HG2 ILE 40 -3.947 4.474 -12.723
371 1HD1 ILE 40 1HD1 ILE 40 -3.773 1.119 -11.420
372 2HD1 ILE 40 2HD1 ILE 40 -2.985 2.351 -12.419
373 3HD1 ILE 40 3HD1 ILE 40 -2.112 1.614 -11.054
374 H GLU 41 H GLU 41 -8.121 3.622 -10.741
375 HA GLU 41 HA GLU 41 -8.886 6.085 -11.654
376 1HB GLU 41 1HB GLU 41 -10.167 3.851 -11.924
377 2HB GLU 41 2HB GLU 41 -10.859 4.192 -10.326
378 1HG GLU 41 1HG GLU 41 -11.367 6.560 -11.565
379 2HG GLU 41 2HG GLU 41 -11.329 5.495 -12.971
380 H TRP 42 H TRP 42 -9.191 4.799 -8.280
381 HA TRP 42 HA TRP 42 -10.730 6.794 -7.161
382 1HB TRP 42 1HB TRP 42 -9.605 4.719 -6.146
383 2HB TRP 42 2HB TRP 42 -8.182 5.719 -5.909
384 HD1 TRP 42 HD1 TRP 42 -11.848 5.571 -4.932
385 HE1 TRP 42 HE1 TRP 42 -12.179 6.746 -2.610
386 HE3 TRP 42 HE3 TRP 42 -7.196 7.350 -4.356
387 HZ2 TRP 42 HZ2 TRP 42 -10.508 8.212 -0.728
388 HZ3 TRP 42 HZ3 TRP 42 -6.517 8.630 -2.285
389 HH2 TRP 42 HH2 TRP 42 -8.163 8.954 -0.445
390 H LEU 43 H LEU 43 -7.261 6.920 -7.952
391 HA LEU 43 HA LEU 43 -6.848 9.553 -6.809
392 1HB LEU 43 1HB LEU 43 -5.238 7.983 -8.854
393 2HB LEU 43 2HB LEU 43 -4.727 9.486 -8.115
394 HG LEU 43 HG LEU 43 -5.538 7.558 -6.044
395 1HD1 LEU 43 1HD1 LEU 43 -4.611 5.659 -6.752
396 2HD1 LEU 43 2HD1 LEU 43 -3.940 6.394 -8.202
397 3HD1 LEU 43 3HD1 LEU 43 -3.035 6.463 -6.697
398 1HD2 LEU 43 1HD2 LEU 43 -3.039 9.153 -6.654
399 2HD2 LEU 43 2HD2 LEU 43 -4.350 9.593 -5.560
400 3HD2 LEU 43 3HD2 LEU 43 -3.294 8.220 -5.166
401 H GLU 44 H GLU 44 -7.798 8.385 -10.102
402 HA GLU 44 HA GLU 44 -7.380 11.084 -11.159
403 1HB GLU 44 1HB GLU 44 -7.696 10.302 -13.219
404 2HB GLU 44 2HB GLU 44 -7.021 8.897 -12.377
405 1HG GLU 44 1HG GLU 44 -9.458 8.153 -12.075
406 2HG GLU 44 2HG GLU 44 -9.894 9.454 -13.177
407 H THR 45 H THR 45 -9.643 10.095 -9.056
408 HA THR 45 HA THR 45 -11.946 11.490 -10.385
409 HB THR 45 HB THR 45 -11.635 8.856 -9.974
410 HG1 THR 45 HG1 THR 45 -13.740 8.693 -10.495
411 1HG2 THR 45 1HG2 THR 45 -11.732 8.979 -7.521
412 2HG2 THR 45 2HG2 THR 45 -13.386 9.606 -7.643
413 3HG2 THR 45 3HG2 THR 45 -12.986 7.976 -8.244
414 H ILE 46 H ILE 46 -10.161 10.863 -7.445
415 HA ILE 46 HA ILE 46 -11.739 11.941 -5.510
416 HB ILE 46 HB ILE 46 -9.489 10.857 -5.361
417 1HG1 ILE 46 1HG1 ILE 46 -9.213 13.267 -3.606
418 2HG1 ILE 46 2HG1 ILE 46 -10.759 12.406 -3.507
419 1HG2 ILE 46 1HG2 ILE 46 -8.368 12.392 -6.998
420 2HG2 ILE 46 2HG2 ILE 46 -8.288 13.619 -5.732
421 3HG2 ILE 46 3HG2 ILE 46 -7.456 12.060 -5.520
422 1HD1 ILE 46 1HD1 ILE 46 -9.654 10.286 -3.167
423 2HD1 ILE 46 2HD1 ILE 46 -8.052 11.051 -3.301
424 3HD1 ILE 46 3HD1 ILE 46 -9.126 11.454 -1.931
425 H LEU 47 H LEU 47 -10.109 13.760 -8.007
426 HA LEU 47 HA LEU 47 -10.072 15.899 -8.651
427 1HB LEU 47 1HB LEU 47 -12.629 15.901 -7.079
428 2HB LEU 47 2HB LEU 47 -11.845 17.459 -7.306
429 HG LEU 47 HG LEU 47 -11.763 17.088 -9.756
430 1HD1 LEU 47 1HD1 LEU 47 -11.895 14.590 -9.785
431 2HD1 LEU 47 2HD1 LEU 47 -13.555 14.694 -9.154
432 3HD1 LEU 47 3HD1 LEU 47 -13.169 15.335 -10.760
433 1HD2 LEU 47 1HD2 LEU 47 -14.516 16.914 -8.458
434 2HD2 LEU 47 2HD2 LEU 47 -13.564 18.396 -8.690
435 3HD2 LEU 47 3HD2 LEU 47 -14.174 17.507 -10.098
436 H GLY 48 H GLY 48 -10.787 16.215 -5.144
437 1HA GLY 48 1HA GLY 48 -9.597 17.275 -3.474
438 2HA GLY 48 2HA GLY 48 -8.155 17.272 -4.502
439 1HN NH2 49 1HN NH2 49 -8.415 18.850 -6.537
440 2HN NH2 49 2HN NH2 49 -9.058 20.465 -6.138
441 1H ACE 0 H1 ACE 0 13.695 -11.341 -18.899
442 2H ACE 0 H2 ACE 0 12.043 -11.659 -19.478
443 3H ACE 0 H3 ACE 0 12.396 -11.691 -17.737
444 H ASP 1 H ASP 1 12.704 -9.476 -20.574
445 HA ASP 1 HA ASP 1 12.887 -7.084 -19.108
446 1HB ASP 1 1HB ASP 1 12.503 -7.882 -21.930
447 2HB ASP 1 2HB ASP 1 11.544 -6.471 -21.518
448 H TYR 2 H TYR 2 9.983 -8.539 -20.650
449 HA TYR 2 HA TYR 2 8.007 -6.889 -19.816
450 1HB TYR 2 1HB TYR 2 6.565 -8.670 -20.116
451 2HB TYR 2 2HB TYR 2 7.857 -8.883 -21.269
452 HD1 TYR 2 HD1 TYR 2 6.141 -10.280 -18.346
453 HD2 TYR 2 HD2 TYR 2 9.507 -10.752 -21.000
454 HE1 TYR 2 HE1 TYR 2 6.477 -12.598 -17.522
455 HE2 TYR 2 HE2 TYR 2 9.859 -13.047 -20.138
456 HH TYR 2 HH TYR 2 9.097 -14.699 -18.709
457 H LEU 3 H LEU 3 9.509 -9.520 -17.915
458 HA LEU 3 HA LEU 3 7.948 -8.997 -15.603
459 1HB LEU 3 1HB LEU 3 10.265 -10.742 -16.320
460 2HB LEU 3 2HB LEU 3 10.348 -10.188 -14.651
461 HG LEU 3 HG LEU 3 7.864 -11.463 -15.815
462 1HD1 LEU 3 1HD1 LEU 3 9.753 -13.048 -16.011
463 2HD1 LEU 3 2HD1 LEU 3 10.158 -12.791 -14.300
464 3HD1 LEU 3 3HD1 LEU 3 8.626 -13.572 -14.748
465 1HD2 LEU 3 1HD2 LEU 3 8.843 -11.092 -12.940
466 2HD2 LEU 3 2HD2 LEU 3 7.534 -10.170 -13.702
467 3HD2 LEU 3 3HD2 LEU 3 7.343 -11.906 -13.421
468 H ARG 4 H ARG 4 11.274 -7.905 -16.340
469 HA ARG 4 HA ARG 4 11.548 -6.436 -13.914
470 1HB ARG 4 1HB ARG 4 12.658 -5.965 -16.705
471 2HB ARG 4 2HB ARG 4 13.044 -4.926 -15.323
472 1HG ARG 4 1HG ARG 4 13.887 -6.831 -14.039
473 2HG ARG 4 2HG ARG 4 13.492 -7.943 -15.361
474 1HD ARG 4 1HD ARG 4 15.379 -5.557 -15.657
475 2HD ARG 4 2HD ARG 4 15.951 -7.157 -15.206
476 HE ARG 4 HE ARG 4 15.115 -6.233 -17.837
477 1HH1 ARG 4 1HH2 ARG 4 15.353 -9.087 -15.796
478 2HH1 ARG 4 2HH2 ARG 4 15.683 -10.196 -17.098
479 1HH2 ARG 4 1HH1 ARG 4 15.457 -7.660 -19.591
480 2HH2 ARG 4 2HH1 ARG 4 15.773 -9.348 -19.311
481 H GLU 5 H GLU 5 9.468 -5.854 -16.662
482 HA GLU 5 HA GLU 5 9.133 -2.973 -16.050
483 1HB GLU 5 1HB GLU 5 7.630 -4.801 -17.962
484 2HB GLU 5 2HB GLU 5 7.306 -3.086 -17.733
485 1HG GLU 5 1HG GLU 5 9.423 -2.432 -18.603
486 2HG GLU 5 2HG GLU 5 10.089 -4.062 -18.497
487 H LEU 6 H LEU 6 7.301 -6.020 -15.765
488 HA LEU 6 HA LEU 6 5.313 -4.690 -14.078
489 1HB LEU 6 1HB LEU 6 5.311 -7.399 -15.294
490 2HB LEU 6 2HB LEU 6 4.154 -6.831 -14.068
491 HG LEU 6 HG LEU 6 4.566 -5.582 -16.762
492 1HD1 LEU 6 1HD1 LEU 6 3.343 -7.769 -16.704
493 2HD1 LEU 6 2HD1 LEU 6 2.316 -7.171 -15.383
494 3HD1 LEU 6 3HD1 LEU 6 2.160 -6.481 -16.985
495 1HD2 LEU 6 1HD2 LEU 6 2.805 -4.696 -14.466
496 2HD2 LEU 6 2HD2 LEU 6 3.962 -3.727 -15.409
497 3HD2 LEU 6 3HD2 LEU 6 2.481 -4.266 -16.159
498 H LEU 7 H LEU 7 8.032 -4.918 -13.125
499 HA LEU 7 HA LEU 7 7.357 -6.066 -10.588
500 1HB LEU 7 1HB LEU 7 8.300 -8.018 -11.833
501 2HB LEU 7 2HB LEU 7 9.836 -7.175 -12.020
502 HG LEU 7 HG LEU 7 8.788 -7.440 -9.237
503 1HD1 LEU 7 1HD1 LEU 7 8.258 -9.665 -10.216
504 2HD1 LEU 7 2HD1 LEU 7 9.931 -9.808 -10.790
505 3HD1 LEU 7 3HD1 LEU 7 9.584 -9.775 -9.047
506 1HD2 LEU 7 1HD2 LEU 7 11.544 -7.835 -10.479
507 2HD2 LEU 7 2HD2 LEU 7 10.990 -6.415 -9.562
508 3HD2 LEU 7 3HD2 LEU 7 11.165 -7.968 -8.750
509 H LYS 8 H LYS 8 10.440 -5.044 -12.161
510 HA LYS 8 HA LYS 8 11.253 -3.985 -9.701
511 1HB LYS 8 1HB LYS 8 12.605 -4.749 -11.928
512 2HB LYS 8 2HB LYS 8 12.538 -3.013 -12.254
513 1HG LYS 8 1HG LYS 8 13.420 -2.813 -9.757
514 2HG LYS 8 2HG LYS 8 13.834 -4.523 -9.969
515 1HD LYS 8 1HD LYS 8 15.049 -3.743 -12.163
516 2HD LYS 8 2HD LYS 8 14.790 -2.100 -11.562
517 1HE LYS 8 1HE LYS 8 16.990 -2.687 -10.863
518 2HE LYS 8 2HE LYS 8 15.993 -2.818 -9.406
519 1HZ LYS 8 1HZ LYS 8 15.891 -5.197 -9.809
520 2HZ LYS 8 2HZ LYS 8 16.831 -5.036 -11.152
521 3HZ LYS 8 3HZ LYS 8 17.451 -4.688 -9.667
522 H LEU 9 H LEU 9 9.996 -2.563 -12.663
523 HA LEU 9 HA LEU 9 9.999 0.173 -11.701
524 1HB LEU 9 1HB LEU 9 8.724 -1.269 -14.026
525 2HB LEU 9 2HB LEU 9 8.232 0.379 -13.633
526 HG LEU 9 HG LEU 9 11.175 -0.313 -13.928
527 1HD1 LEU 9 1HD1 LEU 9 10.267 -1.106 -15.997
528 2HD1 LEU 9 2HD1 LEU 9 9.210 0.316 -16.167
529 3HD1 LEU 9 3HD1 LEU 9 10.975 0.476 -16.318
530 1HD2 LEU 9 1HD2 LEU 9 9.573 2.242 -14.438
531 2HD2 LEU 9 2HD2 LEU 9 10.533 1.928 -12.980
532 3HD2 LEU 9 3HD2 LEU 9 11.336 2.073 -14.549
533 H GLU 10 H GLU 10 7.495 -2.517 -11.766
534 HA GLU 10 HA GLU 10 5.503 -1.008 -10.607
535 1HB GLU 10 1HB GLU 10 6.176 -3.907 -9.997
536 2HB GLU 10 2HB GLU 10 4.691 -3.044 -9.615
537 1HG GLU 10 1HG GLU 10 5.675 -3.508 -12.392
538 2HG GLU 10 2HG GLU 10 4.427 -4.490 -11.583
539 H LEU 11 H LEU 11 8.251 -2.568 -8.865
540 HA LEU 11 HA LEU 11 7.152 -2.131 -6.255
541 1HB LEU 11 1HB LEU 11 9.059 -3.608 -6.848
542 2HB LEU 11 2HB LEU 11 10.105 -2.207 -7.082
543 HG LEU 11 HG LEU 11 8.652 -2.614 -4.440
544 1HD1 LEU 11 1HD1 LEU 11 9.703 -4.779 -4.938
545 2HD1 LEU 11 2HD1 LEU 11 11.252 -3.971 -5.264
546 3HD1 LEU 11 3HD1 LEU 11 10.560 -3.956 -3.627
547 1HD2 LEU 11 1HD2 LEU 11 11.379 -1.419 -5.154
548 2HD2 LEU 11 2HD2 LEU 11 9.942 -0.490 -4.691
549 3HD2 LEU 11 3HD2 LEU 11 10.710 -1.553 -3.516
550 H GLN 12 H GLN 12 9.114 0.004 -8.344
551 HA GLN 12 HA GLN 12 9.578 2.059 -6.521
552 1HB GLN 12 1HB GLN 12 10.561 1.737 -8.797
553 2HB GLN 12 2HB GLN 12 9.051 2.304 -9.515
554 1HG GLN 12 1HG GLN 12 10.143 4.158 -7.470
555 2HG GLN 12 2HG GLN 12 11.241 3.821 -8.807
556 1HE2 GLN 12 2HE2 GLN 12 7.744 4.695 -8.283
557 2HE2 GLN 12 1HE2 GLN 12 7.660 5.671 -9.741
558 H LEU 13 H LEU 13 6.541 1.125 -8.024
559 HA LEU 13 HA LEU 13 5.266 3.733 -7.903
560 1HB LEU 13 1HB LEU 13 3.955 0.987 -8.027
561 2HB LEU 13 2HB LEU 13 3.254 2.543 -8.466
562 HG LEU 13 HG LEU 13 5.609 1.222 -9.906
563 1HD1 LEU 13 1HD1 LEU 13 3.624 -0.194 -9.924
564 2HD1 LEU 13 2HD1 LEU 13 2.614 1.182 -10.274
565 3HD1 LEU 13 3HD1 LEU 13 3.776 0.583 -11.506
566 1HD2 LEU 13 1HD2 LEU 13 3.800 3.515 -10.764
567 2HD2 LEU 13 2HD2 LEU 13 5.461 3.702 -10.168
568 3HD2 LEU 13 3HD2 LEU 13 5.177 2.818 -11.657
569 H ILE 14 H ILE 14 4.803 0.629 -6.184
570 HA ILE 14 HA ILE 14 3.173 1.520 -4.025
571 HB ILE 14 HB ILE 14 5.182 -0.732 -4.519
572 1HG1 ILE 14 1HG1 ILE 14 3.269 -2.140 -4.165
573 2HG1 ILE 14 2HG1 ILE 14 2.257 -0.793 -3.623
574 1HG2 ILE 14 1HG2 ILE 14 5.611 -0.209 -2.160
575 2HG2 ILE 14 2HG2 ILE 14 3.863 -0.164 -1.825
576 3HG2 ILE 14 3HG2 ILE 14 4.662 -1.680 -2.282
577 1HD1 ILE 14 1HD1 ILE 14 2.237 0.125 -5.906
578 2HD1 ILE 14 2HD1 ILE 14 3.366 -1.153 -6.440
579 3HD1 ILE 14 3HD1 ILE 14 1.725 -1.565 -5.904
580 H LYS 15 H LYS 15 6.679 1.542 -4.499
581 HA LYS 15 HA LYS 15 7.260 2.715 -1.921
582 1HB LYS 15 1HB LYS 15 8.968 1.650 -3.112
583 2HB LYS 15 2HB LYS 15 8.764 2.659 -4.535
584 1HG LYS 15 1HG LYS 15 9.522 3.983 -1.923
585 2HG LYS 15 2HG LYS 15 10.742 3.045 -2.808
586 1HD LYS 15 1HD LYS 15 10.309 4.313 -4.867
587 2HD LYS 15 2HD LYS 15 9.103 5.298 -4.044
588 1HE LYS 15 1HE LYS 15 10.840 6.083 -2.413
589 2HE LYS 15 2HE LYS 15 12.067 5.176 -3.321
590 1HZ LYS 15 1HZ LYS 15 11.530 6.536 -5.229
591 2HZ LYS 15 2HZ LYS 15 10.416 7.379 -4.353
592 3HZ LYS 15 3HZ LYS 15 12.009 7.462 -3.954
593 H GLN 16 H GLN 16 6.582 4.294 -5.101
594 HA GLN 16 HA GLN 16 6.977 6.962 -4.091
595 1HB GLN 16 1HB GLN 16 6.322 5.792 -6.629
596 2HB GLN 16 2HB GLN 16 4.961 6.810 -6.250
597 1HG GLN 16 1HG GLN 16 7.508 8.232 -5.743
598 2HG GLN 16 2HG GLN 16 7.441 7.551 -7.361
599 1HE2 GLN 16 2HE2 GLN 16 5.270 9.369 -5.067
600 2HE2 GLN 16 1HE2 GLN 16 4.769 10.502 -6.320
601 H TYR 17 H TYR 17 4.254 4.783 -4.154
602 HA TYR 17 HA TYR 17 2.167 6.595 -3.458
603 1HB TYR 17 1HB TYR 17 2.650 3.627 -3.354
604 2HB TYR 17 2HB TYR 17 1.432 4.273 -2.314
605 HD1 TYR 17 HD1 TYR 17 2.093 3.121 -5.628
606 HD2 TYR 17 HD2 TYR 17 -0.548 5.512 -3.212
607 HE1 TYR 17 HE1 TYR 17 0.335 2.846 -7.306
608 HE2 TYR 17 HE2 TYR 17 -2.368 5.133 -4.853
609 HH TYR 17 HH TYR 17 -1.921 2.987 -7.668
610 H ARG 18 H ARG 18 4.753 5.197 -1.573
611 HA ARG 18 HA ARG 18 3.381 5.660 1.004
612 1HB ARG 18 1HB ARG 18 6.271 4.922 0.340
613 2HB ARG 18 2HB ARG 18 5.653 5.176 1.976
614 1HG ARG 18 1HG ARG 18 3.961 3.362 1.596
615 2HG ARG 18 2HG ARG 18 4.663 3.088 -0.001
616 1HD ARG 18 1HD ARG 18 5.560 1.446 1.431
617 2HD ARG 18 2HD ARG 18 6.875 2.611 1.159
618 HE ARG 18 HE ARG 18 5.468 3.423 3.477
619 1HH1 ARG 18 1HH2 ARG 18 7.409 0.687 2.410
620 2HH1 ARG 18 2HH2 ARG 18 7.874 0.182 4.010
621 1HH2 ARG 18 1HH1 ARG 18 6.036 2.791 5.592
622 2HH2 ARG 18 2HH1 ARG 18 7.075 1.421 5.871
623 H GLU 19 H GLU 19 5.864 7.077 -0.970
624 HA GLU 19 HA GLU 19 6.472 9.350 0.582
625 1HB GLU 19 1HB GLU 19 7.666 8.470 -1.473
626 2HB GLU 19 2HB GLU 19 6.420 9.270 -2.444
627 1HG GLU 19 1HG GLU 19 7.003 11.438 -1.540
628 2HG GLU 19 2HG GLU 19 8.173 10.726 -0.426
629 H ALA 20 H ALA 20 3.952 8.936 -1.989
630 HA ALA 20 HA ALA 20 2.870 11.631 -1.180
631 1HB ALA 20 1HB ALA 20 3.223 11.455 -3.539
632 2HB ALA 20 2HB ALA 20 2.385 9.938 -3.662
633 3HB ALA 20 3HB ALA 20 1.484 11.411 -3.275
634 H LEU 21 H LEU 21 2.556 8.916 0.367
635 HA LEU 21 HA LEU 21 -0.367 9.265 0.866
636 1HB LEU 21 1HB LEU 21 0.201 7.033 0.728
637 2HB LEU 21 2HB LEU 21 1.699 7.205 1.621
638 HG LEU 21 HG LEU 21 -0.410 6.044 2.567
639 1HD1 LEU 21 1HD1 LEU 21 0.420 6.241 4.809
640 2HD1 LEU 21 2HD1 LEU 21 1.767 6.152 3.669
641 3HD1 LEU 21 3HD1 LEU 21 1.309 7.708 4.400
642 1HD2 LEU 21 1HD2 LEU 21 -0.919 8.650 4.003
643 2HD2 LEU 21 2HD2 LEU 21 -1.833 8.221 2.546
644 3HD2 LEU 21 3HD2 LEU 21 -1.863 7.182 3.977
645 H GLU 22 H GLU 22 2.805 9.367 2.516
646 HA GLU 22 HA GLU 22 1.716 9.967 5.074
647 1HB GLU 22 1HB GLU 22 4.478 10.349 3.841
648 2HB GLU 22 2HB GLU 22 4.144 10.889 5.487
649 1HG GLU 22 1HG GLU 22 3.653 8.019 4.583
650 2HG GLU 22 2HG GLU 22 5.180 8.587 5.263
651 H TYR 23 H TYR 23 3.151 12.095 2.623
652 HA TYR 23 HA TYR 23 2.848 14.521 4.046
653 1HB TYR 23 1HB TYR 23 4.120 13.959 1.859
654 2HB TYR 23 2HB TYR 23 2.588 14.195 1.039
655 HD1 TYR 23 HD1 TYR 23 1.559 16.475 0.934
656 HD2 TYR 23 HD2 TYR 23 5.381 15.793 2.813
657 HE1 TYR 23 HE1 TYR 23 2.178 18.829 0.534
658 HE2 TYR 23 HE2 TYR 23 5.997 18.154 2.417
659 HH TYR 23 HH TYR 23 3.755 20.479 0.878
660 H VAL 24 H VAL 24 0.571 12.583 2.166
661 HA VAL 24 HA VAL 24 -1.386 14.789 1.926
662 HB VAL 24 HB VAL 24 -1.351 11.899 1.155
663 1HG1 VAL 24 1HG1 VAL 24 -3.707 12.526 1.395
664 2HG1 VAL 24 2HG1 VAL 24 -3.437 14.021 0.471
665 3HG1 VAL 24 3HG1 VAL 24 -3.323 12.440 -0.326
666 1HG2 VAL 24 1HG2 VAL 24 -1.058 14.442 -0.514
667 2HG2 VAL 24 2HG2 VAL 24 0.232 13.275 -0.158
668 3HG2 VAL 24 3HG2 VAL 24 -1.129 12.802 -1.180
669 H LYS 25 H LYS 25 -0.853 11.970 3.974
670 HA LYS 25 HA LYS 25 -1.934 11.066 5.724
671 1HB LYS 25 1HB LYS 25 -3.099 13.840 6.190
672 2HB LYS 25 2HB LYS 25 -3.067 12.475 7.317
673 1HG LYS 25 1HG LYS 25 -0.497 12.546 7.103
674 2HG LYS 25 2HG LYS 25 -0.728 14.117 6.323
675 1HD LYS 25 1HD LYS 25 -2.438 14.187 8.601
676 2HD LYS 25 2HD LYS 25 -1.004 13.323 9.175
677 1HE LYS 25 1HE LYS 25 0.408 15.240 8.443
678 2HE LYS 25 2HE LYS 25 -1.033 16.048 7.789
679 1HZ LYS 25 1HZ LYS 25 -1.950 16.089 9.988
680 2HZ LYS 25 2HZ LYS 25 -0.610 15.359 10.611
681 3HZ LYS 25 3HZ LYS 25 -0.498 16.868 9.954
682 H LEU 26 H LEU 26 -3.182 10.295 3.513
683 HA LEU 26 HA LEU 26 -6.060 10.297 4.367
684 1HB LEU 26 1HB LEU 26 -4.804 10.317 1.710
685 2HB LEU 26 2HB LEU 26 -6.023 9.056 1.901
686 HG LEU 26 HG LEU 26 -6.606 11.908 2.748
687 1HD1 LEU 26 1HD1 LEU 26 -5.941 12.109 0.450
688 2HD1 LEU 26 2HD1 LEU 26 -6.854 10.671 -0.020
689 3HD1 LEU 26 3HD1 LEU 26 -7.711 12.141 0.493
690 1HD2 LEU 26 1HD2 LEU 26 -8.370 9.561 1.864
691 2HD2 LEU 26 2HD2 LEU 26 -8.164 10.111 3.534
692 3HD2 LEU 26 3HD2 LEU 26 -8.945 11.164 2.352
693 HA PRO 27 HA PRO 27 -4.541 6.227 5.738
694 1HB PRO 27 1HB PRO 27 -6.869 5.250 6.820
695 2HB PRO 27 2HB PRO 27 -5.765 6.364 7.675
696 1HG PRO 27 1HG PRO 27 -8.281 7.061 6.146
697 2HG PRO 27 2HG PRO 27 -7.791 7.631 7.767
698 1HD PRO 27 1HD PRO 27 -7.412 9.137 5.561
699 2HD PRO 27 2HD PRO 27 -6.162 9.116 6.839
700 H VAL 28 H VAL 28 -7.476 6.990 3.803
701 HA VAL 28 HA VAL 28 -7.746 4.442 2.589
702 HB VAL 28 HB VAL 28 -8.285 7.125 1.376
703 1HG1 VAL 28 1HG1 VAL 28 -8.238 5.475 -0.374
704 2HG1 VAL 28 2HG1 VAL 28 -9.121 4.293 0.615
705 3HG1 VAL 28 3HG1 VAL 28 -9.944 5.732 -0.002
706 1HG2 VAL 28 1HG2 VAL 28 -10.149 5.216 2.854
707 2HG2 VAL 28 2HG2 VAL 28 -9.604 6.800 3.459
708 3HG2 VAL 28 3HG2 VAL 28 -10.639 6.708 2.029
709 H LEU 29 H LEU 29 -5.336 7.049 2.021
710 HA LEU 29 HA LEU 29 -4.456 5.879 -0.499
711 1HB LEU 29 1HB LEU 29 -3.852 8.290 1.012
712 2HB LEU 29 2HB LEU 29 -2.367 7.440 0.590
713 HG LEU 29 HG LEU 29 -4.469 7.890 -1.528
714 1HD1 LEU 29 1HD1 LEU 29 -4.105 10.096 -0.578
715 2HD1 LEU 29 2HD1 LEU 29 -2.340 9.875 -0.635
716 3HD1 LEU 29 3HD1 LEU 29 -3.280 9.982 -2.139
717 1HD2 LEU 29 1HD2 LEU 29 -1.419 7.672 -1.597
718 2HD2 LEU 29 2HD2 LEU 29 -2.546 6.350 -1.975
719 3HD2 LEU 29 3HD2 LEU 29 -2.496 7.797 -2.996
720 H ALA 30 H ALA 30 -3.248 5.910 2.949
721 HA ALA 30 HA ALA 30 -1.193 4.053 2.546
722 1HB ALA 30 1HB ALA 30 -1.583 5.088 4.745
723 2HB ALA 30 2HB ALA 30 -3.079 4.149 4.934
724 3HB ALA 30 3HB ALA 30 -1.510 3.327 4.869
725 H LYS 31 H LYS 31 -4.667 3.413 3.028
726 HA LYS 31 HA LYS 31 -4.273 0.607 3.128
727 1HB LYS 31 1HB LYS 31 -6.254 2.071 3.986
728 2HB LYS 31 2HB LYS 31 -6.935 1.855 2.362
729 1HG LYS 31 1HG LYS 31 -6.893 -0.603 2.678
730 2HG LYS 31 2HG LYS 31 -6.011 -0.403 4.203
731 1HD LYS 31 1HD LYS 31 -7.970 0.985 5.061
732 2HD LYS 31 2HD LYS 31 -8.876 0.460 3.627
733 1HE LYS 31 1HE LYS 31 -8.625 -1.902 4.318
734 2HE LYS 31 2HE LYS 31 -7.573 -1.424 5.665
735 1HZ LYS 31 1HZ LYS 31 -9.397 -0.218 6.604
736 2HZ LYS 31 2HZ LYS 31 -10.395 -0.685 5.378
737 3HZ LYS 31 3HZ LYS 31 -9.776 -1.808 6.414
738 H ILE 32 H ILE 32 -4.735 2.971 0.616
739 HA ILE 32 HA ILE 32 -5.590 0.993 -1.460
740 HB ILE 32 HB ILE 32 -4.752 3.893 -1.632
741 1HG1 ILE 32 1HG1 ILE 32 -7.183 2.362 -2.700
742 2HG1 ILE 32 2HG1 ILE 32 -7.136 3.111 -1.110
743 1HG2 ILE 32 1HG2 ILE 32 -3.583 2.893 -3.534
744 2HG2 ILE 32 2HG2 ILE 32 -5.026 1.971 -3.985
745 3HG2 ILE 32 3HG2 ILE 32 -4.991 3.733 -4.135
746 1HD1 ILE 32 1HD1 ILE 32 -6.660 5.322 -2.234
747 2HD1 ILE 32 2HD1 ILE 32 -6.972 4.538 -3.801
748 3HD1 ILE 32 3HD1 ILE 32 -8.252 4.613 -2.592
749 H LEU 33 H LEU 33 -2.568 2.544 -0.324
750 HA LEU 33 HA LEU 33 -1.079 1.584 -2.511
751 1HB LEU 33 1HB LEU 33 0.682 2.519 -1.596
752 2HB LEU 33 2HB LEU 33 -0.684 3.523 -1.001
753 HG LEU 33 HG LEU 33 -0.315 2.720 1.163
754 1HD1 LEU 33 1HD1 LEU 33 0.598 0.551 1.089
755 2HD1 LEU 33 2HD1 LEU 33 1.811 1.026 -0.141
756 3HD1 LEU 33 3HD1 LEU 33 1.959 1.570 1.557
757 1HD2 LEU 33 1HD2 LEU 33 2.237 3.562 -0.272
758 2HD2 LEU 33 2HD2 LEU 33 0.887 4.666 0.038
759 3HD2 LEU 33 3HD2 LEU 33 1.784 3.977 1.401
760 H GLU 34 H GLU 34 -1.916 0.238 0.591
761 HA GLU 34 HA GLU 34 -0.366 -2.123 0.529
762 1HB GLU 34 1HB GLU 34 -1.851 -1.031 2.406
763 2HB GLU 34 2HB GLU 34 -3.200 -1.844 1.667
764 1HG GLU 34 1HG GLU 34 -0.683 -3.294 2.623
765 2HG GLU 34 2HG GLU 34 -2.140 -3.084 3.604
766 H ASP 35 H ASP 35 -3.719 -1.556 -0.550
767 HA ASP 35 HA ASP 35 -4.217 -4.165 -1.436
768 1HB ASP 35 1HB ASP 35 -5.793 -2.056 -1.349
769 2HB ASP 35 2HB ASP 35 -5.297 -1.842 -3.036
770 H GLU 36 H GLU 36 -2.851 -1.429 -3.303
771 HA GLU 36 HA GLU 36 -2.512 -2.815 -5.770
772 1HB GLU 36 1HB GLU 36 -0.978 -0.463 -4.621
773 2HB GLU 36 2HB GLU 36 -0.803 -1.106 -6.260
774 1HG GLU 36 1HG GLU 36 -3.611 -0.833 -5.913
775 2HG GLU 36 2HG GLU 36 -2.921 0.615 -5.178
776 H GLU 37 H GLU 37 -0.274 -2.616 -2.927
777 HA GLU 37 HA GLU 37 1.913 -3.856 -3.991
778 1HB GLU 37 1HB GLU 37 1.066 -2.912 -1.533
779 2HB GLU 37 2HB GLU 37 0.820 -4.605 -1.189
780 1HG GLU 37 1HG GLU 37 3.407 -3.600 -2.383
781 2HG GLU 37 2HG GLU 37 3.027 -3.295 -0.688
782 H LYS 38 H LYS 38 -1.006 -5.526 -2.779
783 HA LYS 38 HA LYS 38 0.078 -8.147 -3.144
784 1HB LYS 38 1HB LYS 38 -1.913 -7.414 -1.774
785 2HB LYS 38 2HB LYS 38 -2.826 -7.252 -3.283
786 1HG LYS 38 1HG LYS 38 -2.392 -9.682 -3.778
787 2HG LYS 38 2HG LYS 38 -1.432 -9.801 -2.293
788 1HD LYS 38 1HD LYS 38 -3.447 -9.229 -0.951
789 2HD LYS 38 2HD LYS 38 -4.410 -9.135 -2.443
790 1HE LYS 38 1HE LYS 38 -3.875 -11.526 -2.933
791 2HE LYS 38 2HE LYS 38 -2.897 -11.613 -1.456
792 1HZ LYS 38 1HZ LYS 38 -4.868 -11.152 -0.195
793 2HZ LYS 38 2HZ LYS 38 -5.783 -11.080 -1.566
794 3HZ LYS 38 3HZ LYS 38 -5.071 -12.500 -1.122
795 H HIS 39 H HIS 39 -1.637 -5.985 -5.402
796 HA HIS 39 HA HIS 39 -2.017 -8.011 -7.430
797 1HB HIS 39 1HB HIS 39 -1.941 -4.981 -7.538
798 2HB HIS 39 2HB HIS 39 -2.310 -5.992 -8.919
799 HD1 HIS 39 HD1 HIS 39 -4.494 -7.874 -8.215
800 HD2 HIS 39 HD2 HIS 39 -4.028 -4.265 -6.099
801 HE1 HIS 39 HE1 HIS 39 -6.725 -7.394 -6.999
802 HE2 HIS 39 HE2 HIS 39 -6.409 -5.179 -5.767
803 H ILE 40 H ILE 40 0.629 -5.772 -6.643
804 HA ILE 40 HA ILE 40 2.180 -6.503 -9.016
805 HB ILE 40 HB ILE 40 2.848 -4.833 -6.561
806 1HG1 ILE 40 1HG1 ILE 40 3.066 -3.074 -8.283
807 2HG1 ILE 40 2HG1 ILE 40 2.703 -4.238 -9.573
808 1HG2 ILE 40 1HG2 ILE 40 4.989 -5.994 -7.416
809 2HG2 ILE 40 2HG2 ILE 40 4.607 -5.447 -9.048
810 3HG2 ILE 40 3HG2 ILE 40 4.996 -4.281 -7.783
811 1HD1 ILE 40 1HD1 ILE 40 0.361 -4.320 -8.799
812 2HD1 ILE 40 2HD1 ILE 40 0.794 -3.220 -7.455
813 3HD1 ILE 40 3HD1 ILE 40 0.905 -2.676 -9.127
814 H GLU 41 H GLU 41 2.080 -7.441 -5.578
815 HA GLU 41 HA GLU 41 4.149 -9.226 -5.400
816 1HB GLU 41 1HB GLU 41 2.405 -8.582 -3.605
817 2HB GLU 41 2HB GLU 41 1.406 -9.878 -4.302
818 1HG GLU 41 1HG GLU 41 3.500 -11.384 -3.947
819 2HG GLU 41 2HG GLU 41 4.062 -10.084 -2.886
820 H TRP 42 H TRP 42 0.927 -9.830 -6.966
821 HA TRP 42 HA TRP 42 1.123 -12.531 -7.389
822 1HB TRP 42 1HB TRP 42 -0.683 -10.804 -8.029
823 2HB TRP 42 2HB TRP 42 0.185 -10.634 -9.546
824 HD1 TRP 42 HD1 TRP 42 -1.944 -13.012 -7.585
825 HE1 TRP 42 HE1 TRP 42 -2.518 -15.138 -8.988
826 HE3 TRP 42 HE3 TRP 42 1.064 -12.111 -11.505
827 HZ2 TRP 42 HZ2 TRP 42 -1.542 -16.366 -11.466
828 HZ3 TRP 42 HZ3 TRP 42 1.302 -13.768 -13.386
829 HH2 TRP 42 HH2 TRP 42 0.162 -15.969 -13.228
830 H LEU 43 H LEU 43 2.722 -9.951 -9.183
831 HA LEU 43 HA LEU 43 3.929 -11.663 -11.240
832 1HB LEU 43 1HB LEU 43 4.372 -8.779 -10.358
833 2HB LEU 43 2HB LEU 43 5.324 -9.562 -11.594
834 HG LEU 43 HG LEU 43 2.399 -9.923 -12.005
835 1HD1 LEU 43 1HD1 LEU 43 2.121 -7.785 -11.053
836 2HD1 LEU 43 2HD1 LEU 43 3.536 -7.111 -11.858
837 3HD1 LEU 43 3HD1 LEU 43 2.109 -7.544 -12.805
838 1HD2 LEU 43 1HD2 LEU 43 4.752 -8.991 -13.691
839 2HD2 LEU 43 2HD2 LEU 43 3.996 -10.585 -13.676
840 3HD2 LEU 43 3HD2 LEU 43 3.103 -9.190 -14.307
841 H GLU 44 H GLU 44 4.904 -10.075 -8.198
842 HA GLU 44 HA GLU 44 7.588 -11.202 -8.277
843 1HB GLU 44 1HB GLU 44 6.287 -10.055 -5.796
844 2HB GLU 44 2HB GLU 44 7.988 -10.134 -6.245
845 1HG GLU 44 1HG GLU 44 7.212 -8.608 -8.282
846 2HG GLU 44 2HG GLU 44 5.833 -8.264 -7.245
847 H THR 45 H THR 45 5.268 -13.154 -8.319
848 HA THR 45 HA THR 45 6.480 -14.983 -6.359
849 HB THR 45 HB THR 45 4.519 -13.656 -5.345
850 HG1 THR 45 HG1 THR 45 5.407 -15.451 -4.345
851 1HG2 THR 45 1HG2 THR 45 2.874 -13.876 -7.041
852 2HG2 THR 45 2HG2 THR 45 2.792 -15.640 -6.812
853 3HG2 THR 45 3HG2 THR 45 2.314 -14.527 -5.508
854 H ILE 46 H ILE 46 3.952 -14.474 -8.746
855 HA ILE 46 HA ILE 46 3.213 -15.686 -10.475
856 HB ILE 46 HB ILE 46 5.127 -14.580 -11.370
857 1HG1 ILE 46 1HG1 ILE 46 5.577 -15.829 -13.340
858 2HG1 ILE 46 2HG1 ILE 46 5.062 -17.351 -12.603
859 1HG2 ILE 46 1HG2 ILE 46 6.988 -15.332 -10.049
860 2HG2 ILE 46 2HG2 ILE 46 6.819 -16.998 -10.648
861 3HG2 ILE 46 3HG2 ILE 46 7.311 -15.693 -11.738
862 1HD1 ILE 46 1HD1 ILE 46 2.751 -16.542 -12.476
863 2HD1 ILE 46 2HD1 ILE 46 3.281 -14.917 -12.986
864 3HD1 ILE 46 3HD1 ILE 46 3.356 -16.285 -14.119
865 H LEU 47 H LEU 47 2.548 -17.070 -8.592
866 HA LEU 47 HA LEU 47 3.897 -19.457 -7.990
867 1HB LEU 47 1HB LEU 47 2.334 -18.075 -6.602
868 2HB LEU 47 2HB LEU 47 0.967 -18.831 -7.413
869 HG LEU 47 HG LEU 47 3.140 -20.488 -6.046
870 1HD1 LEU 47 1HD1 LEU 47 2.443 -18.806 -4.412
871 2HD1 LEU 47 2HD1 LEU 47 0.733 -19.192 -4.706
872 3HD1 LEU 47 3HD1 LEU 47 1.811 -20.397 -3.963
873 1HD2 LEU 47 1HD2 LEU 47 0.157 -20.956 -6.531
874 2HD2 LEU 47 2HD2 LEU 47 1.497 -21.787 -7.353
875 3HD2 LEU 47 3HD2 LEU 47 1.227 -22.045 -5.629
876 H GLY 48 H GLY 48 4.277 -20.426 -10.041
877 1HA GLY 48 1HA GLY 48 2.476 -22.635 -10.517
878 2HA GLY 48 2HA GLY 48 2.428 -21.470 -11.857
879 1HN NH2 49 1HN NH2 49 4.762 -20.655 -12.522
880 2HN NH2 49 2HN NH2 49 5.974 -21.950 -12.711