Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
548659 | 2lsw RC | 18449 | cing | 1-original | 3 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 H SER 24 H SER 24 9.183 12.258 -21.910
2 HA SER 24 HA SER 24 8.114 9.767 -20.986
3 HB2 SER 24 2HB SER 24 10.562 9.695 -22.629
4 HB3 SER 24 1HB SER 24 10.705 8.845 -21.093
5 HG SER 24 HG SER 24 9.406 7.368 -21.831
6 H LYS 25 H LYS 25 11.113 11.730 -20.875
7 HA LYS 25 HA LYS 25 11.995 11.354 -18.298
8 HB2 LYS 25 2HB LYS 25 11.980 13.473 -20.301
9 HB3 LYS 25 1HB LYS 25 12.068 14.125 -18.665
10 HG2 LYS 25 2HG LYS 25 14.041 12.886 -18.166
11 HG3 LYS 25 1HG LYS 25 13.848 11.864 -19.591
12 HD2 LYS 25 2HD LYS 25 13.897 14.433 -20.646
13 HD3 LYS 25 1HD LYS 25 15.097 14.497 -19.354
14 HE2 LYS 25 2HE LYS 25 16.352 13.714 -21.201
15 HE3 LYS 25 1HE LYS 25 15.918 12.210 -20.365
16 HZ1 LYS 25 3HZ LYS 25 14.870 13.314 -22.852
17 HZ2 LYS 25 1HZ LYS 25 13.738 12.584 -21.820
18 HZ3 LYS 25 2HZ LYS 25 15.070 11.693 -22.383
19 H LYS 26 H LYS 26 10.405 10.967 -16.693
20 HA LYS 26 HA LYS 26 9.243 13.217 -15.388
21 HB2 LYS 26 2HB LYS 26 7.907 12.873 -17.604
22 HB3 LYS 26 1HB LYS 26 7.185 11.501 -16.763
23 HG2 LYS 26 2HG LYS 26 5.741 12.959 -15.829
24 HG3 LYS 26 1HG LYS 26 7.102 13.591 -14.901
25 HD2 LYS 26 2HD LYS 26 7.582 15.239 -16.614
26 HD3 LYS 26 1HD LYS 26 6.364 14.541 -17.684
27 HE2 LYS 26 2HE LYS 26 5.123 16.277 -16.751
28 HE3 LYS 26 1HE LYS 26 4.788 15.006 -15.556
29 HZ1 LYS 26 3HZ LYS 26 7.094 15.853 -14.633
30 HZ2 LYS 26 1HZ LYS 26 5.635 16.583 -14.171
31 HZ3 LYS 26 2HZ LYS 26 6.597 17.299 -15.374
32 H GLU 27 H GLU 27 9.874 12.246 -13.450
33 HA GLU 27 HA GLU 27 9.931 10.631 -11.709
34 HB2 GLU 27 2HB GLU 27 7.768 11.679 -11.430
35 HB3 GLU 27 1HB GLU 27 7.069 10.682 -12.705
36 HG2 GLU 27 2HG GLU 27 8.219 8.870 -10.881
37 HG3 GLU 27 1HG GLU 27 7.387 10.073 -9.895
38 H LYS 28 H LYS 28 11.274 9.016 -12.814
39 HA LYS 28 HA LYS 28 10.404 7.051 -14.621
40 HB2 LYS 28 2HB LYS 28 12.642 7.655 -12.954
41 HB3 LYS 28 1HB LYS 28 12.265 5.944 -12.748
42 HG2 LYS 28 2HG LYS 28 12.057 6.006 -15.389
43 HG3 LYS 28 1HG LYS 28 13.106 7.414 -15.219
44 HD2 LYS 28 2HD LYS 28 14.724 6.067 -13.939
45 HD3 LYS 28 1HD LYS 28 13.675 4.657 -14.088
46 HE2 LYS 28 2HE LYS 28 13.864 5.313 -16.701
47 HE3 LYS 28 1HE LYS 28 15.430 5.925 -16.131
48 HZ1 LYS 28 3HZ LYS 28 14.404 3.269 -15.325
49 HZ2 LYS 28 1HZ LYS 28 15.992 3.857 -15.226
50 HZ3 LYS 28 2HZ LYS 28 15.322 3.474 -16.740
51 H LYS 29 H LYS 29 10.798 4.556 -13.433
52 HA LYS 29 HA LYS 29 8.329 3.720 -12.545
53 HB2 LYS 29 2HB LYS 29 11.158 2.842 -12.230
54 HB3 LYS 29 1HB LYS 29 9.951 2.016 -11.244
55 HG2 LYS 29 2HG LYS 29 10.220 0.826 -13.365
56 HG3 LYS 29 1HG LYS 29 8.620 1.566 -13.304
57 HD2 LYS 29 2HD LYS 29 9.228 3.291 -14.796
58 HD3 LYS 29 1HD LYS 29 10.952 3.018 -14.548
59 HE2 LYS 29 2HE LYS 29 10.094 2.132 -16.756
60 HE3 LYS 29 1HE LYS 29 10.825 0.878 -15.733
61 HZ1 LYS 29 3HZ LYS 29 8.024 1.418 -15.221
62 HZ2 LYS 29 1HZ LYS 29 8.842 -0.065 -15.312
63 HZ3 LYS 29 2HZ LYS 29 8.346 0.717 -16.735
64 H LYS 30 H LYS 30 7.343 3.460 -10.472
65 HA LYS 30 HA LYS 30 7.540 5.467 -8.565
66 HB2 LYS 30 2HB LYS 30 6.529 2.683 -8.714
67 HB3 LYS 30 1HB LYS 30 6.701 3.349 -7.090
68 HG2 LYS 30 2HG LYS 30 5.332 4.910 -9.278
69 HG3 LYS 30 1HG LYS 30 4.450 3.733 -8.304
70 HD2 LYS 30 2HD LYS 30 4.744 4.950 -6.327
71 HD3 LYS 30 1HD LYS 30 6.139 5.827 -6.959
72 HE2 LYS 30 2HE LYS 30 3.953 6.418 -8.685
73 HE3 LYS 30 1HE LYS 30 3.378 6.622 -7.019
74 HZ1 LYS 30 3HZ LYS 30 4.563 8.600 -7.948
75 HZ2 LYS 30 1HZ LYS 30 5.979 7.668 -7.994
76 HZ3 LYS 30 2HZ LYS 30 5.228 7.996 -6.505
77 H GLY 31 H GLY 31 8.881 5.877 -6.819
78 HA2 GLY 31 2HA GLY 31 10.904 5.767 -5.612
79 HA3 GLY 31 1HA GLY 31 10.265 4.186 -5.173
80 HA PRO 32 HA PRO 32 14.301 3.587 -7.308
81 HB2 PRO 32 2HB PRO 32 15.217 1.738 -5.543
82 HB3 PRO 32 1HB PRO 32 15.441 3.492 -5.339
83 HG2 PRO 32 2HG PRO 32 13.407 1.695 -4.142
84 HG3 PRO 32 1HG PRO 32 14.343 2.998 -3.396
85 HD2 PRO 32 2HD PRO 32 11.775 3.320 -4.135
86 HD3 PRO 32 1HD PRO 32 12.961 4.644 -4.223
87 H GLU 33 H GLU 33 15.046 1.576 -8.395
88 HA GLU 33 HA GLU 33 12.851 -0.305 -8.805
89 HB2 GLU 33 2HB GLU 33 13.420 0.198 -10.948
90 HB3 GLU 33 1HB GLU 33 14.745 1.164 -10.291
91 HG2 GLU 33 2HG GLU 33 15.854 -0.357 -11.672
92 HG3 GLU 33 1HG GLU 33 16.014 -1.081 -10.077
93 H LYS 34 H LYS 34 15.039 -0.145 -6.780
94 HA LYS 34 HA LYS 34 16.880 -2.241 -6.892
95 HB2 LYS 34 2HB LYS 34 15.732 -0.330 -5.134
96 HB3 LYS 34 1HB LYS 34 15.838 -1.850 -4.289
97 HG2 LYS 34 2HG LYS 34 18.108 -0.595 -5.833
98 HG3 LYS 34 1HG LYS 34 17.896 -0.420 -4.091
99 HD2 LYS 34 2HD LYS 34 18.882 -2.415 -3.736
100 HD3 LYS 34 1HD LYS 34 17.715 -3.205 -4.796
101 HE2 LYS 34 2HE LYS 34 19.081 -2.530 -6.772
102 HE3 LYS 34 1HE LYS 34 20.287 -1.844 -5.666
103 HZ1 LYS 34 3HZ LYS 34 19.397 -4.506 -4.979
104 HZ2 LYS 34 1HZ LYS 34 20.967 -3.865 -5.013
105 HZ3 LYS 34 2HZ LYS 34 20.246 -4.420 -6.448
106 H THR 35 H THR 35 16.731 -4.402 -5.808
107 HA THR 35 HA THR 35 14.126 -5.402 -5.046
108 HB THR 35 HB THR 35 15.302 -6.794 -7.360
109 HG1 THR 35 1HG THR 35 13.731 -5.205 -8.502
110 HG21 THR 35 3HG2 THR 35 12.463 -6.159 -6.547
111 HG22 THR 35 1HG2 THR 35 13.310 -7.664 -6.190
112 HG23 THR 35 2HG2 THR 35 12.945 -7.232 -7.861
113 H ASP 36 H ASP 36 17.546 -5.945 -5.409
114 HA ASP 36 HA ASP 36 17.303 -8.590 -4.063
115 HB2 ASP 36 2HB ASP 36 18.745 -7.814 -6.226
116 HB3 ASP 36 1HB ASP 36 19.924 -7.538 -4.944
117 H GLU 37 H GLU 37 19.684 -6.041 -3.890
118 HA GLU 37 HA GLU 37 20.286 -6.491 -1.137
119 HB2 GLU 37 2HB GLU 37 20.882 -4.493 -3.259
120 HB3 GLU 37 1HB GLU 37 21.163 -3.984 -1.593
121 HG2 GLU 37 2HG GLU 37 22.243 -6.529 -1.642
122 HG3 GLU 37 1HG GLU 37 22.664 -5.898 -3.235
123 H TYR 38 H TYR 38 17.741 -4.984 -2.749
124 HA TYR 38 HA TYR 38 17.019 -3.026 -0.749
125 HB2 TYR 38 2HB TYR 38 15.715 -2.327 -2.456
126 HB3 TYR 38 1HB TYR 38 16.557 -3.532 -3.412
127 HD1 TYR 38 1HD TYR 38 15.515 -6.068 -2.659
128 HD2 TYR 38 2HD TYR 38 13.482 -2.311 -2.946
129 HE1 TYR 38 1HE TYR 38 13.364 -7.259 -2.990
130 HE2 TYR 38 2HE TYR 38 11.326 -3.488 -3.285
131 HH TYR 38 HH TYR 38 10.931 -6.791 -2.671
132 H LEU 39 H LEU 39 16.494 -6.418 -1.166
133 HA LEU 39 HA LEU 39 14.079 -6.966 0.048
134 HB2 LEU 39 2HB LEU 39 16.729 -8.178 -0.221
135 HB3 LEU 39 1HB LEU 39 15.880 -8.723 1.220
136 HG LEU 39 HG LEU 39 15.214 -10.224 -0.480
137 HD11 LEU 39 1HD1 LEU 39 13.362 -8.630 0.771
138 HD12 LEU 39 2HD1 LEU 39 12.981 -10.077 -0.163
139 HD13 LEU 39 3HD1 LEU 39 12.896 -8.487 -0.923
140 HD21 LEU 39 3HD2 LEU 39 14.963 -7.748 -2.178
141 HD22 LEU 39 1HD2 LEU 39 14.274 -9.294 -2.669
142 HD23 LEU 39 2HD2 LEU 39 16.017 -9.135 -2.441
143 H LEU 40 H LEU 40 17.192 -6.527 1.732
144 HA LEU 40 HA LEU 40 16.189 -6.488 4.367
145 HB2 LEU 40 2HB LEU 40 18.586 -5.444 2.906
146 HB3 LEU 40 1HB LEU 40 18.395 -5.102 4.627
147 HG LEU 40 HG LEU 40 19.683 -7.240 3.997
148 HD11 LEU 40 1HD1 LEU 40 19.200 -7.328 6.229
149 HD12 LEU 40 2HD1 LEU 40 17.993 -8.514 5.731
150 HD13 LEU 40 3HD1 LEU 40 17.526 -6.832 5.978
151 HD21 LEU 40 3HD2 LEU 40 16.840 -8.127 3.408
152 HD22 LEU 40 1HD2 LEU 40 18.217 -9.216 3.574
153 HD23 LEU 40 2HD2 LEU 40 18.167 -8.053 2.248
154 H ALA 41 H ALA 41 16.211 -4.063 1.882
155 HA ALA 41 HA ALA 41 15.822 -1.743 3.457
156 HB1 ALA 41 1HB ALA 41 15.363 -0.752 1.374
157 HB2 ALA 41 2HB ALA 41 14.539 -2.193 0.775
158 HB3 ALA 41 3HB ALA 41 16.298 -2.172 0.903
159 H ARG 42 H ARG 42 13.494 -3.899 1.837
160 HA ARG 42 HA ARG 42 11.233 -2.705 3.183
161 HB2 ARG 42 2HB ARG 42 11.812 -4.639 1.023
162 HB3 ARG 42 1HB ARG 42 10.272 -4.845 1.858
163 HG2 ARG 42 2HG ARG 42 10.614 -2.059 1.362
164 HG3 ARG 42 1HG ARG 42 10.953 -2.913 -0.143
165 HD2 ARG 42 2HD ARG 42 8.719 -4.247 0.785
166 HD3 ARG 42 1HD ARG 42 8.393 -2.567 1.258
167 HE ARG 42 HE ARG 42 9.404 -2.370 -1.328
168 HH11 ARG 42 1HH1 ARG 42 6.523 -2.989 0.308
169 HH12 ARG 42 2HH1 ARG 42 5.623 -3.444 -1.099
170 HH21 ARG 42 1HH2 ARG 42 8.381 -3.406 -3.200
171 HH22 ARG 42 2HH2 ARG 42 6.674 -3.677 -3.087
172 H PHE 43 H PHE 43 13.435 -5.230 3.748
173 HA PHE 43 HA PHE 43 12.173 -7.342 4.940
174 HB2 PHE 43 2HB PHE 43 14.641 -5.805 5.255
175 HB3 PHE 43 1HB PHE 43 14.178 -6.642 6.733
176 HD1 PHE 43 1HD PHE 43 13.237 -7.874 3.390
177 HD2 PHE 43 2HD PHE 43 16.024 -8.235 6.640
178 HE1 PHE 43 1HE PHE 43 14.093 -9.992 2.423
179 HE2 PHE 43 2HE PHE 43 16.876 -10.355 5.676
180 HZ PHE 43 HZ PHE 43 15.911 -11.233 3.566
181 H LYS 44 H LYS 44 12.662 -4.138 6.443
182 HA LYS 44 HA LYS 44 11.415 -4.832 8.881
183 HB2 LYS 44 2HB LYS 44 12.417 -2.377 7.532
184 HB3 LYS 44 1HB LYS 44 11.549 -2.243 9.065
185 HG2 LYS 44 2HG LYS 44 13.967 -2.462 9.444
186 HG3 LYS 44 1HG LYS 44 13.095 -3.852 10.082
187 HD2 LYS 44 2HD LYS 44 13.762 -5.239 8.299
188 HD3 LYS 44 1HD LYS 44 14.263 -3.865 7.311
189 HE2 LYS 44 2HE LYS 44 16.366 -4.127 8.120
190 HE3 LYS 44 1HE LYS 44 15.750 -3.701 9.729
191 HZ1 LYS 44 3HZ LYS 44 15.850 -6.392 8.485
192 HZ2 LYS 44 1HZ LYS 44 14.935 -6.052 9.872
193 HZ3 LYS 44 2HZ LYS 44 16.624 -5.879 9.907
194 H GLY 45 H GLY 45 9.896 -4.812 6.152
195 HA2 GLY 45 2HA GLY 45 7.455 -3.518 7.260
196 HA3 GLY 45 1HA GLY 45 7.906 -3.279 5.579
197 H ASP 46 H ASP 46 7.244 -4.747 4.114
198 HA ASP 46 HA ASP 46 5.526 -6.947 5.031
199 HB2 ASP 46 2HB ASP 46 6.223 -6.125 2.209
200 HB3 ASP 46 1HB ASP 46 4.743 -6.873 2.800
201 H GLY 47 H GLY 47 8.498 -7.213 5.359
202 HA2 GLY 47 2HA GLY 47 9.296 -9.112 3.266
203 HA3 GLY 47 1HA GLY 47 10.264 -8.644 4.664
204 H VAL 48 H VAL 48 8.667 -9.120 6.667
205 HA VAL 48 HA VAL 48 8.921 -11.839 7.273
206 HB VAL 48 HB VAL 48 8.776 -10.445 9.124
207 HG11 VAL 48 1HG1 VAL 48 6.965 -8.879 7.384
208 HG12 VAL 48 2HG1 VAL 48 8.240 -8.328 8.470
209 HG13 VAL 48 3HG1 VAL 48 6.661 -8.776 9.117
210 HG21 VAL 48 3HG2 VAL 48 6.988 -12.183 9.306
211 HG22 VAL 48 1HG2 VAL 48 5.847 -10.963 8.737
212 HG23 VAL 48 2HG2 VAL 48 6.703 -10.725 10.262
213 H LYS 49 H LYS 49 5.993 -10.020 6.313
214 HA LYS 49 HA LYS 49 4.027 -11.890 6.574
215 HB2 LYS 49 2HB LYS 49 3.165 -10.814 4.391
216 HB3 LYS 49 1HB LYS 49 3.496 -9.765 5.766
217 HG2 LYS 49 2HG LYS 49 4.991 -8.616 4.565
218 HG3 LYS 49 1HG LYS 49 5.904 -10.082 4.234
219 HD2 LYS 49 2HD LYS 49 5.119 -8.980 2.146
220 HD3 LYS 49 1HD LYS 49 4.428 -10.592 2.338
221 HE2 LYS 49 2HE LYS 49 2.349 -9.608 3.243
222 HE3 LYS 49 1HE LYS 49 3.041 -7.984 3.058
223 HZ1 LYS 49 3HZ LYS 49 3.483 -8.660 0.674
224 HZ2 LYS 49 1HZ LYS 49 1.863 -8.365 1.081
225 HZ3 LYS 49 2HZ LYS 49 2.426 -9.962 0.943
226 H TYR 50 H TYR 50 5.918 -11.681 3.494
227 HA TYR 50 HA TYR 50 4.965 -14.326 2.771
228 HB2 TYR 50 2HB TYR 50 6.110 -13.773 0.705
229 HB3 TYR 50 1HB TYR 50 5.120 -12.420 1.238
230 HD1 TYR 50 2HD TYR 50 8.598 -13.754 1.658
231 HD2 TYR 50 1HD TYR 50 6.055 -10.329 1.254
232 HE1 TYR 50 2HE TYR 50 10.597 -12.281 1.617
233 HE2 TYR 50 1HE TYR 50 8.048 -8.847 1.208
234 HH TYR 50 HH TYR 50 11.340 -10.189 1.537
235 H LYS 51 H LYS 51 7.897 -12.869 4.079
236 HA LYS 51 HA LYS 51 9.826 -14.782 3.501
237 HB2 LYS 51 2HB LYS 51 9.171 -12.926 5.719
238 HB3 LYS 51 1HB LYS 51 10.390 -14.150 6.055
239 HG2 LYS 51 2HG LYS 51 10.756 -12.890 3.441
240 HG3 LYS 51 1HG LYS 51 10.852 -11.736 4.772
241 HD2 LYS 51 2HD LYS 51 12.295 -14.327 5.098
242 HD3 LYS 51 1HD LYS 51 12.983 -13.148 3.981
243 HE2 LYS 51 2HE LYS 51 13.498 -11.654 5.661
244 HE3 LYS 51 1HE LYS 51 12.096 -12.123 6.644
245 HZ1 LYS 51 3HZ LYS 51 14.329 -12.936 7.459
246 HZ2 LYS 51 1HZ LYS 51 14.355 -13.964 6.110
247 HZ3 LYS 51 2HZ LYS 51 13.128 -14.123 7.274
248 H ALA 52 H ALA 52 7.655 -14.769 6.227
249 HA ALA 52 HA ALA 52 8.195 -17.253 7.360
250 HB1 ALA 52 1HB ALA 52 6.785 -15.684 8.463
251 HB2 ALA 52 2HB ALA 52 5.740 -17.049 8.068
252 HB3 ALA 52 3HB ALA 52 5.707 -15.594 7.070
253 H LYS 53 H LYS 53 5.691 -16.485 5.074
254 HA LYS 53 HA LYS 53 4.791 -19.134 4.600
255 HB2 LYS 53 2HB LYS 53 4.582 -16.467 3.219
256 HB3 LYS 53 1HB LYS 53 3.775 -17.893 2.581
257 HG2 LYS 53 2HG LYS 53 3.034 -18.064 5.183
258 HG3 LYS 53 1HG LYS 53 3.169 -16.313 5.010
259 HD2 LYS 53 2HD LYS 53 1.642 -18.021 3.036
260 HD3 LYS 53 1HD LYS 53 0.883 -17.314 4.462
261 HE2 LYS 53 2HE LYS 53 1.315 -15.084 3.713
262 HE3 LYS 53 1HE LYS 53 2.440 -15.649 2.464
263 HZ1 LYS 53 3HZ LYS 53 -0.492 -16.048 2.595
264 HZ2 LYS 53 1HZ LYS 53 0.500 -17.001 1.602
265 HZ3 LYS 53 2HZ LYS 53 0.413 -15.322 1.352
266 H LEU 54 H LEU 54 6.808 -17.013 2.470
267 HA LEU 54 HA LEU 54 7.257 -18.749 0.400
268 HB2 LEU 54 2HB LEU 54 8.954 -16.724 1.788
269 HB3 LEU 54 1HB LEU 54 9.340 -17.404 0.197
270 HG LEU 54 HG LEU 54 6.837 -15.932 0.987
271 HD11 LEU 54 1HD1 LEU 54 9.202 -14.936 0.206
272 HD12 LEU 54 2HD1 LEU 54 7.659 -14.186 -0.204
273 HD13 LEU 54 3HD1 LEU 54 8.467 -15.235 -1.369
274 HD21 LEU 54 3HD2 LEU 54 7.454 -17.738 -1.313
275 HD22 LEU 54 1HD2 LEU 54 6.431 -16.330 -1.600
276 HD23 LEU 54 2HD2 LEU 54 5.950 -17.544 -0.415
277 H ILE 55 H ILE 55 8.449 -18.909 3.630
278 HA ILE 55 HA ILE 55 10.690 -20.575 3.228
279 HB ILE 55 HB ILE 55 9.096 -19.178 5.199
280 HG12 ILE 55 2HG1 ILE 55 11.069 -18.371 5.899
281 HG13 ILE 55 1HG1 ILE 55 11.956 -19.862 5.580
282 HG21 ILE 55 1HG2 ILE 55 8.646 -21.124 6.246
283 HG22 ILE 55 2HG2 ILE 55 10.114 -20.561 7.049
284 HG23 ILE 55 3HG2 ILE 55 10.204 -21.830 5.823
285 HD11 ILE 55 3HD1 ILE 55 12.255 -17.731 4.023
286 HD12 ILE 55 1HD1 ILE 55 10.773 -18.339 3.285
287 HD13 ILE 55 2HD1 ILE 55 12.217 -19.351 3.326
288 H GLY 56 H GLY 56 7.506 -21.154 4.709
289 HA2 GLY 56 2HA GLY 56 6.320 -23.195 3.660
290 HA3 GLY 56 1HA GLY 56 7.801 -23.987 4.102
291 H ILE 57 H ILE 57 5.813 -21.697 5.837
292 HA ILE 57 HA ILE 57 6.078 -23.037 8.304
293 HB ILE 57 HB ILE 57 4.725 -21.110 8.988
294 HG12 ILE 57 2HG1 ILE 57 4.867 -19.990 6.238
295 HG13 ILE 57 1HG1 ILE 57 3.633 -21.224 6.502
296 HG21 ILE 57 1HG2 ILE 57 6.390 -19.424 8.108
297 HG22 ILE 57 2HG2 ILE 57 7.036 -20.718 7.099
298 HG23 ILE 57 3HG2 ILE 57 7.097 -20.856 8.856
299 HD11 ILE 57 3HD1 ILE 57 3.721 -19.307 8.695
300 HD12 ILE 57 1HD1 ILE 57 2.352 -19.805 7.701
301 HD13 ILE 57 2HD1 ILE 57 3.419 -18.514 7.149
302 H ASP 58 H ASP 58 3.220 -21.961 8.355
303 HA ASP 58 HA ASP 58 1.803 -24.361 8.741
304 HB2 ASP 58 2HB ASP 58 1.259 -21.959 9.451
305 HB3 ASP 58 1HB ASP 58 0.596 -21.744 7.824
Start of MODEL 2
1 H SER 24 H SER 24 5.041 13.230 35.294
2 HA SER 24 HA SER 24 7.365 13.844 36.848
3 HB2 SER 24 2HB SER 24 7.351 11.502 38.018
4 HB3 SER 24 1HB SER 24 6.407 12.808 38.729
5 HG SER 24 HG SER 24 5.524 10.486 38.007
6 H LYS 25 H LYS 25 5.836 10.873 35.529
7 HA LYS 25 HA LYS 25 8.084 9.678 34.400
8 HB2 LYS 25 2HB LYS 25 5.353 9.305 34.462
9 HB3 LYS 25 1HB LYS 25 5.658 9.568 32.745
10 HG2 LYS 25 2HG LYS 25 6.238 7.381 32.684
11 HG3 LYS 25 1HG LYS 25 7.730 7.893 33.474
12 HD2 LYS 25 2HD LYS 25 7.151 6.553 35.194
13 HD3 LYS 25 1HD LYS 25 5.876 7.717 35.556
14 HE2 LYS 25 2HE LYS 25 4.367 6.489 33.966
15 HE3 LYS 25 1HE LYS 25 5.635 5.258 33.789
16 HZ1 LYS 25 3HZ LYS 25 4.720 6.144 36.455
17 HZ2 LYS 25 1HZ LYS 25 5.537 4.718 36.037
18 HZ3 LYS 25 2HZ LYS 25 3.902 4.911 35.620
19 H LYS 26 H LYS 26 8.895 9.688 32.170
20 HA LYS 26 HA LYS 26 9.371 12.269 31.087
21 HB2 LYS 26 2HB LYS 26 9.567 9.515 29.833
22 HB3 LYS 26 1HB LYS 26 10.401 10.960 29.260
23 HG2 LYS 26 2HG LYS 26 10.916 10.668 32.065
24 HG3 LYS 26 1HG LYS 26 11.259 9.131 31.268
25 HD2 LYS 26 2HD LYS 26 12.692 10.282 29.632
26 HD3 LYS 26 1HD LYS 26 12.335 11.831 30.398
27 HE2 LYS 26 2HE LYS 26 13.344 9.700 32.214
28 HE3 LYS 26 1HE LYS 26 14.514 10.364 31.056
29 HZ1 LYS 26 3HZ LYS 26 12.726 12.253 32.379
30 HZ2 LYS 26 1HZ LYS 26 14.349 12.440 31.922
31 HZ3 LYS 26 2HZ LYS 26 13.958 11.577 33.334
32 H GLU 27 H GLU 27 6.626 10.265 30.833
33 HA GLU 27 HA GLU 27 4.670 10.402 29.528
34 HB2 GLU 27 2HB GLU 27 4.666 12.676 30.296
35 HB3 GLU 27 1HB GLU 27 5.948 13.122 29.173
36 HG2 GLU 27 2HG GLU 27 4.010 13.916 28.098
37 HG3 GLU 27 1HG GLU 27 4.272 12.354 27.324
38 H LYS 28 H LYS 28 4.369 9.358 27.606
39 HA LYS 28 HA LYS 28 6.187 8.649 25.700
40 HB2 LYS 28 2HB LYS 28 4.190 8.449 24.227
41 HB3 LYS 28 1HB LYS 28 3.869 7.892 25.869
42 HG2 LYS 28 2HG LYS 28 2.283 9.459 26.171
43 HG3 LYS 28 1HG LYS 28 3.368 10.739 25.628
44 HD2 LYS 28 2HD LYS 28 2.515 10.739 23.521
45 HD3 LYS 28 1HD LYS 28 2.389 8.980 23.473
46 HE2 LYS 28 2HE LYS 28 0.524 10.298 25.362
47 HE3 LYS 28 1HE LYS 28 0.216 10.619 23.643
48 HZ1 LYS 28 3HZ LYS 28 -0.854 8.563 24.300
49 HZ2 LYS 28 1HZ LYS 28 0.615 7.946 24.883
50 HZ3 LYS 28 2HZ LYS 28 0.416 8.231 23.220
51 H LYS 29 H LYS 29 7.690 10.417 25.269
52 HA LYS 29 HA LYS 29 7.043 12.995 24.381
53 HB2 LYS 29 2HB LYS 29 9.315 11.142 24.385
54 HB3 LYS 29 1HB LYS 29 9.372 12.308 23.063
55 HG2 LYS 29 2HG LYS 29 8.593 13.475 25.653
56 HG3 LYS 29 1HG LYS 29 10.229 12.818 25.624
57 HD2 LYS 29 2HD LYS 29 10.419 14.084 23.339
58 HD3 LYS 29 1HD LYS 29 9.049 15.016 23.945
59 HE2 LYS 29 2HE LYS 29 11.724 14.670 25.355
60 HE3 LYS 29 1HE LYS 29 11.135 16.150 24.573
61 HZ1 LYS 29 3HZ LYS 29 10.427 15.048 27.125
62 HZ2 LYS 29 1HZ LYS 29 9.062 15.363 26.169
63 HZ3 LYS 29 2HZ LYS 29 10.163 16.611 26.515
64 H LYS 30 H LYS 30 7.477 13.770 22.036
65 HA LYS 30 HA LYS 30 5.604 12.809 20.229
66 HB2 LYS 30 2HB LYS 30 6.852 14.184 18.651
67 HB3 LYS 30 1HB LYS 30 6.872 14.956 20.235
68 HG2 LYS 30 2HG LYS 30 9.097 13.416 20.433
69 HG3 LYS 30 1HG LYS 30 9.100 13.740 18.699
70 HD2 LYS 30 2HD LYS 30 9.050 16.127 19.074
71 HD3 LYS 30 1HD LYS 30 8.809 15.898 20.807
72 HE2 LYS 30 2HE LYS 30 11.065 14.573 20.709
73 HE3 LYS 30 1HE LYS 30 11.304 15.437 19.177
74 HZ1 LYS 30 3HZ LYS 30 12.124 16.932 20.721
75 HZ2 LYS 30 1HZ LYS 30 10.956 16.544 21.888
76 HZ3 LYS 30 2HZ LYS 30 10.523 17.469 20.531
77 H GLY 31 H GLY 31 5.715 10.468 20.106
78 HA2 GLY 31 2HA GLY 31 6.459 8.406 19.300
79 HA3 GLY 31 1HA GLY 31 7.098 9.360 17.968
80 HA PRO 32 HA PRO 32 10.507 7.436 20.569
81 HB2 PRO 32 2HB PRO 32 11.442 5.684 18.725
82 HB3 PRO 32 1HB PRO 32 10.183 5.276 19.916
83 HG2 PRO 32 2HG PRO 32 9.909 6.061 17.073
84 HG3 PRO 32 1HG PRO 32 9.058 4.810 17.991
85 HD2 PRO 32 2HD PRO 32 7.952 7.210 17.416
86 HD3 PRO 32 1HD PRO 32 7.568 6.301 18.896
87 H GLU 33 H GLU 33 12.809 7.853 20.182
88 HA GLU 33 HA GLU 33 13.261 9.821 18.080
89 HB2 GLU 33 2HB GLU 33 14.300 10.789 19.856
90 HB3 GLU 33 1HB GLU 33 13.908 9.330 20.773
91 HG2 GLU 33 2HG GLU 33 16.230 9.450 20.969
92 HG3 GLU 33 1HG GLU 33 16.006 8.306 19.651
93 H LYS 34 H LYS 34 13.227 6.827 18.055
94 HA LYS 34 HA LYS 34 15.786 5.818 17.303
95 HB2 LYS 34 2HB LYS 34 13.045 5.079 17.666
96 HB3 LYS 34 1HB LYS 34 13.670 4.338 16.216
97 HG2 LYS 34 2HG LYS 34 15.304 4.303 18.724
98 HG3 LYS 34 1HG LYS 34 13.977 3.155 18.548
99 HD2 LYS 34 2HD LYS 34 14.954 2.178 16.596
100 HD3 LYS 34 1HD LYS 34 16.122 3.491 16.443
101 HE2 LYS 34 2HE LYS 34 17.071 1.353 17.445
102 HE3 LYS 34 1HE LYS 34 17.268 2.784 18.475
103 HZ1 LYS 34 3HZ LYS 34 15.610 2.130 19.878
104 HZ2 LYS 34 1HZ LYS 34 16.179 0.602 19.412
105 HZ3 LYS 34 2HZ LYS 34 14.783 1.246 18.687
106 H THR 35 H THR 35 16.428 5.208 15.091
107 HA THR 35 HA THR 35 14.882 6.060 12.818
108 HB THR 35 HB THR 35 17.393 7.514 12.859
109 HG1 THR 35 1HG THR 35 16.428 9.128 14.287
110 HG21 THR 35 3HG2 THR 35 14.956 7.632 11.539
111 HG22 THR 35 1HG2 THR 35 16.249 8.826 11.432
112 HG23 THR 35 2HG2 THR 35 14.938 9.048 12.592
113 H ASP 36 H ASP 36 17.896 4.853 14.118
114 HA ASP 36 HA ASP 36 18.679 3.828 11.435
115 HB2 ASP 36 2HB ASP 36 20.310 5.111 12.818
116 HB3 ASP 36 1HB ASP 36 20.162 3.878 14.070
117 H GLU 37 H GLU 37 18.992 2.558 14.672
118 HA GLU 37 HA GLU 37 18.768 -0.172 13.935
119 HB2 GLU 37 2HB GLU 37 18.643 1.487 16.402
120 HB3 GLU 37 1HB GLU 37 18.006 -0.154 16.520
121 HG2 GLU 37 2HG GLU 37 20.473 -0.247 15.075
122 HG3 GLU 37 1HG GLU 37 20.734 0.668 16.560
123 H TYR 38 H TYR 38 16.504 2.328 14.217
124 HA TYR 38 HA TYR 38 14.149 0.739 14.771
125 HB2 TYR 38 2HB TYR 38 13.338 2.806 15.185
126 HB3 TYR 38 1HB TYR 38 14.984 3.363 14.943
127 HD1 TYR 38 2HD TYR 38 15.468 3.279 12.122
128 HD2 TYR 38 1HD TYR 38 11.861 4.241 14.222
129 HE1 TYR 38 2HE TYR 38 14.688 4.604 10.176
130 HE2 TYR 38 1HE TYR 38 11.074 5.577 12.289
131 HH TYR 38 HH TYR 38 11.473 5.715 9.869
132 H LEU 39 H LEU 39 15.984 1.505 11.952
133 HA LEU 39 HA LEU 39 14.205 1.549 9.844
134 HB2 LEU 39 2HB LEU 39 16.917 0.581 10.404
135 HB3 LEU 39 1HB LEU 39 16.160 -0.228 9.039
136 HG LEU 39 HG LEU 39 17.213 1.636 8.075
137 HD11 LEU 39 1HD1 LEU 39 14.687 3.100 8.491
138 HD12 LEU 39 2HD1 LEU 39 14.508 1.439 7.924
139 HD13 LEU 39 3HD1 LEU 39 15.462 2.592 6.990
140 HD21 LEU 39 3HD2 LEU 39 17.961 3.116 9.625
141 HD22 LEU 39 1HD2 LEU 39 16.565 2.860 10.670
142 HD23 LEU 39 2HD2 LEU 39 16.446 3.958 9.296
143 H LEU 40 H LEU 40 15.576 -1.435 11.265
144 HA LEU 40 HA LEU 40 13.887 -3.252 9.901
145 HB2 LEU 40 2HB LEU 40 15.546 -3.222 12.402
146 HB3 LEU 40 1HB LEU 40 14.589 -4.650 12.005
147 HG LEU 40 HG LEU 40 17.024 -4.544 11.136
148 HD11 LEU 40 1HD1 LEU 40 14.527 -5.402 9.839
149 HD12 LEU 40 2HD1 LEU 40 16.018 -6.304 10.107
150 HD13 LEU 40 3HD1 LEU 40 15.878 -5.224 8.720
151 HD21 LEU 40 3HD2 LEU 40 17.252 -3.378 8.953
152 HD22 LEU 40 1HD2 LEU 40 16.938 -2.245 10.267
153 HD23 LEU 40 2HD2 LEU 40 15.638 -2.699 9.163
154 H ALA 41 H ALA 41 13.461 -1.437 12.896
155 HA ALA 41 HA ALA 41 11.343 -2.703 14.134
156 HB1 ALA 41 1HB ALA 41 11.178 0.247 13.606
157 HB2 ALA 41 2HB ALA 41 12.599 -0.375 14.447
158 HB3 ALA 41 3HB ALA 41 10.991 -0.619 15.131
159 H ARG 42 H ARG 42 11.345 -0.901 11.119
160 HA ARG 42 HA ARG 42 8.479 -1.092 10.761
161 HB2 ARG 42 2HB ARG 42 10.808 0.151 9.351
162 HB3 ARG 42 1HB ARG 42 9.222 0.096 8.581
163 HG2 ARG 42 2HG ARG 42 9.151 1.017 11.373
164 HG3 ARG 42 1HG ARG 42 10.064 2.076 10.299
165 HD2 ARG 42 2HD ARG 42 8.181 2.400 8.856
166 HD3 ARG 42 1HD ARG 42 7.284 1.071 9.617
167 HE ARG 42 HE ARG 42 8.112 3.238 11.436
168 HH11 ARG 42 1HH2 ARG 42 5.804 1.316 11.862
169 HH12 ARG 42 2HH2 ARG 42 4.442 2.345 11.569
170 HH21 ARG 42 1HH1 ARG 42 6.309 4.812 10.003
171 HH22 ARG 42 2HH1 ARG 42 4.729 4.326 10.518
172 H PHE 43 H PHE 43 11.275 -2.875 9.890
173 HA PHE 43 HA PHE 43 10.785 -3.953 7.385
174 HB2 PHE 43 2HB PHE 43 12.134 -4.722 9.874
175 HB3 PHE 43 1HB PHE 43 11.668 -6.092 8.881
176 HD1 PHE 43 1HD PHE 43 12.770 -2.624 8.026
177 HD2 PHE 43 2HD PHE 43 13.531 -6.835 7.698
178 HE1 PHE 43 1HE PHE 43 14.675 -2.157 6.504
179 HE2 PHE 43 2HE PHE 43 15.437 -6.374 6.175
180 HZ PHE 43 HZ PHE 43 16.009 -4.034 5.578
181 H LYS 44 H LYS 44 8.840 -4.418 10.234
182 HA LYS 44 HA LYS 44 7.749 -6.922 9.622
183 HB2 LYS 44 2HB LYS 44 7.067 -4.586 11.323
184 HB3 LYS 44 1HB LYS 44 5.928 -5.932 11.209
185 HG2 LYS 44 2HG LYS 44 7.539 -6.216 13.078
186 HG3 LYS 44 1HG LYS 44 7.661 -7.499 11.877
187 HD2 LYS 44 2HD LYS 44 9.608 -6.480 10.887
188 HD3 LYS 44 1HD LYS 44 9.436 -5.053 11.910
189 HE2 LYS 44 2HE LYS 44 9.874 -7.849 13.018
190 HE3 LYS 44 1HE LYS 44 11.184 -6.684 12.742
191 HZ1 LYS 44 3HZ LYS 44 9.027 -6.614 14.702
192 HZ2 LYS 44 1HZ LYS 44 9.438 -5.134 13.983
193 HZ3 LYS 44 2HZ LYS 44 10.616 -6.027 14.817
194 H GLY 45 H GLY 45 7.551 -4.573 7.571
195 HA2 GLY 45 2HA GLY 45 4.659 -4.527 7.056
196 HA3 GLY 45 1HA GLY 45 5.875 -3.626 6.167
197 H ASP 46 H ASP 46 6.895 -4.601 4.441
198 HA ASP 46 HA ASP 46 5.583 -7.041 3.389
199 HB2 ASP 46 2HB ASP 46 7.436 -5.800 1.557
200 HB3 ASP 46 1HB ASP 46 5.685 -5.944 1.433
201 H GLY 47 H GLY 47 7.126 -7.913 5.277
202 HA2 GLY 47 2HA GLY 47 9.505 -9.011 3.874
203 HA3 GLY 47 1HA GLY 47 9.728 -8.280 5.466
204 H VAL 48 H VAL 48 8.451 -9.188 7.212
205 HA VAL 48 HA VAL 48 8.749 -11.934 7.583
206 HB VAL 48 HB VAL 48 8.515 -10.733 9.552
207 HG11 VAL 48 1HG1 VAL 48 6.504 -9.074 9.765
208 HG12 VAL 48 2HG1 VAL 48 6.529 -9.119 8.004
209 HG13 VAL 48 3HG1 VAL 48 7.953 -8.582 8.891
210 HG21 VAL 48 3HG2 VAL 48 6.811 -12.527 9.586
211 HG22 VAL 48 1HG2 VAL 48 5.629 -11.360 8.994
212 HG23 VAL 48 2HG2 VAL 48 6.371 -11.136 10.579
213 H LYS 49 H LYS 49 5.825 -10.126 6.651
214 HA LYS 49 HA LYS 49 3.849 -11.994 6.730
215 HB2 LYS 49 2HB LYS 49 3.185 -10.834 4.465
216 HB3 LYS 49 1HB LYS 49 3.285 -9.890 5.947
217 HG2 LYS 49 2HG LYS 49 5.022 -8.673 5.181
218 HG3 LYS 49 1HG LYS 49 5.846 -10.084 4.536
219 HD2 LYS 49 2HD LYS 49 5.289 -8.721 2.647
220 HD3 LYS 49 1HD LYS 49 4.138 -10.057 2.640
221 HE2 LYS 49 2HE LYS 49 2.499 -8.585 3.855
222 HE3 LYS 49 1HE LYS 49 3.638 -7.238 3.654
223 HZ1 LYS 49 3HZ LYS 49 2.015 -7.381 1.820
224 HZ2 LYS 49 1HZ LYS 49 2.605 -8.923 1.435
225 HZ3 LYS 49 2HZ LYS 49 3.617 -7.566 1.286
226 H TYR 50 H TYR 50 5.908 -11.686 3.746
227 HA TYR 50 HA TYR 50 5.020 -14.352 2.951
228 HB2 TYR 50 2HB TYR 50 6.195 -13.676 0.889
229 HB3 TYR 50 1HB TYR 50 5.005 -12.488 1.410
230 HD1 TYR 50 2HD TYR 50 8.621 -13.333 1.896
231 HD2 TYR 50 1HD TYR 50 5.634 -10.286 1.510
232 HE1 TYR 50 2HE TYR 50 10.395 -11.598 1.979
233 HE2 TYR 50 1HE TYR 50 7.396 -8.542 1.586
234 HH TYR 50 HH TYR 50 10.147 -8.678 0.931
235 H LYS 51 H LYS 51 7.903 -12.765 4.223
236 HA LYS 51 HA LYS 51 9.962 -14.466 3.537
237 HB2 LYS 51 2HB LYS 51 9.172 -12.832 5.867
238 HB3 LYS 51 1HB LYS 51 10.440 -14.005 6.162
239 HG2 LYS 51 2HG LYS 51 10.902 -12.641 3.655
240 HG3 LYS 51 1HG LYS 51 10.745 -11.482 4.975
241 HD2 LYS 51 2HD LYS 51 12.311 -13.617 5.973
242 HD3 LYS 51 1HD LYS 51 12.952 -13.233 4.376
243 HE2 LYS 51 2HE LYS 51 12.328 -11.010 6.318
244 HE3 LYS 51 1HE LYS 51 13.869 -11.884 6.416
245 HZ1 LYS 51 3HZ LYS 51 13.439 -11.435 3.731
246 HZ2 LYS 51 1HZ LYS 51 14.566 -10.644 4.722
247 HZ3 LYS 51 2HZ LYS 51 13.024 -9.971 4.485
248 H ALA 52 H ALA 52 7.880 -14.879 6.300
249 HA ALA 52 HA ALA 52 8.696 -17.449 7.084
250 HB1 ALA 52 1HB ALA 52 5.886 -16.849 7.518
251 HB2 ALA 52 2HB ALA 52 6.926 -15.468 7.869
252 HB3 ALA 52 3HB ALA 52 7.181 -17.001 8.705
253 H LYS 53 H LYS 53 5.886 -16.482 5.290
254 HA LYS 53 HA LYS 53 4.797 -18.985 4.678
255 HB2 LYS 53 2HB LYS 53 4.777 -16.253 3.419
256 HB3 LYS 53 1HB LYS 53 3.809 -17.566 2.761
257 HG2 LYS 53 2HG LYS 53 2.933 -17.890 5.161
258 HG3 LYS 53 1HG LYS 53 3.625 -16.301 5.489
259 HD2 LYS 53 2HD LYS 53 1.933 -15.253 4.428
260 HD3 LYS 53 1HD LYS 53 2.080 -16.305 3.021
261 HE2 LYS 53 2HE LYS 53 0.954 -18.079 4.672
262 HE3 LYS 53 1HE LYS 53 0.324 -16.600 5.423
263 HZ1 LYS 53 3HZ LYS 53 -0.161 -17.673 2.757
264 HZ2 LYS 53 1HZ LYS 53 0.026 -15.990 2.866
265 HZ3 LYS 53 2HZ LYS 53 -1.187 -16.769 3.765
266 H LEU 54 H LEU 54 6.946 -16.991 2.544
267 HA LEU 54 HA LEU 54 7.083 -18.648 0.365
268 HB2 LEU 54 2HB LEU 54 9.061 -16.916 1.774
269 HB3 LEU 54 1HB LEU 54 9.319 -17.559 0.143
270 HG LEU 54 HG LEU 54 7.003 -15.876 1.078
271 HD11 LEU 54 1HD1 LEU 54 8.514 -15.070 -1.265
272 HD12 LEU 54 2HD1 LEU 54 9.509 -15.178 0.188
273 HD13 LEU 54 3HD1 LEU 54 8.081 -14.143 0.172
274 HD21 LEU 54 3HD2 LEU 54 7.405 -17.608 -1.314
275 HD22 LEU 54 1HD2 LEU 54 6.576 -16.067 -1.546
276 HD23 LEU 54 2HD2 LEU 54 5.929 -17.259 -0.416
277 H ILE 55 H ILE 55 8.573 -19.036 3.481
278 HA ILE 55 HA ILE 55 10.444 -21.040 2.810
279 HB ILE 55 HB ILE 55 9.388 -19.403 4.945
280 HG12 ILE 55 2HG1 ILE 55 11.545 -18.979 5.387
281 HG13 ILE 55 1HG1 ILE 55 12.105 -20.596 4.959
282 HG21 ILE 55 1HG2 ILE 55 8.729 -21.236 6.081
283 HG22 ILE 55 2HG2 ILE 55 10.366 -20.956 6.681
284 HG23 ILE 55 3HG2 ILE 55 10.065 -22.215 5.480
285 HD11 ILE 55 3HD1 ILE 55 12.500 -18.461 3.373
286 HD12 ILE 55 1HD1 ILE 55 10.894 -18.921 2.809
287 HD13 ILE 55 2HD1 ILE 55 12.225 -20.074 2.713
288 H GLY 56 H GLY 56 7.418 -21.088 4.666
289 HA2 GLY 56 2HA GLY 56 5.722 -22.823 4.006
290 HA3 GLY 56 1HA GLY 56 7.087 -23.898 3.948
291 H ILE 57 H ILE 57 6.221 -21.495 6.314
292 HA ILE 57 HA ILE 57 6.872 -23.102 8.527
293 HB ILE 57 HB ILE 57 6.119 -21.053 9.664
294 HG12 ILE 57 2HG1 ILE 57 5.793 -19.596 7.129
295 HG13 ILE 57 1HG1 ILE 57 4.494 -20.750 7.437
296 HG21 ILE 57 1HG2 ILE 57 8.176 -20.310 9.173
297 HG22 ILE 57 2HG2 ILE 57 7.657 -19.856 7.549
298 HG23 ILE 57 3HG2 ILE 57 8.233 -21.493 7.867
299 HD11 ILE 57 3HD1 ILE 57 4.764 -18.185 8.555
300 HD12 ILE 57 1HD1 ILE 57 5.170 -19.303 9.856
301 HD13 ILE 57 2HD1 ILE 57 3.613 -19.432 9.038
302 H ASP 58 H ASP 58 4.366 -21.561 9.409
303 HA ASP 58 HA ASP 58 2.282 -22.269 10.346
304 HB2 ASP 58 2HB ASP 58 1.742 -21.537 8.080
305 HB3 ASP 58 1HB ASP 58 2.208 -23.117 7.432
Start of MODEL 3
1 H SER 24 H SER 24 -8.497 9.710 13.505
2 HA SER 24 HA SER 24 -5.803 9.196 12.680
3 HB2 SER 24 2HB SER 24 -7.236 10.392 10.373
4 HB3 SER 24 1HB SER 24 -5.887 9.260 10.390
5 HG SER 24 HG SER 24 -7.433 7.912 9.856
6 H LYS 25 H LYS 25 -6.813 10.864 14.598
7 HA LYS 25 HA LYS 25 -7.545 13.481 14.015
8 HB2 LYS 25 2HB LYS 25 -5.776 12.223 16.108
9 HB3 LYS 25 1HB LYS 25 -6.147 13.947 16.147
10 HG2 LYS 25 2HG LYS 25 -8.566 12.457 15.674
11 HG3 LYS 25 1HG LYS 25 -7.755 11.823 17.107
12 HD2 LYS 25 2HD LYS 25 -7.464 14.490 17.531
13 HD3 LYS 25 1HD LYS 25 -8.996 14.476 16.657
14 HE2 LYS 25 2HE LYS 25 -9.910 12.830 18.254
15 HE3 LYS 25 1HE LYS 25 -8.370 12.833 19.137
16 HZ1 LYS 25 3HZ LYS 25 -9.657 15.399 18.527
17 HZ2 LYS 25 1HZ LYS 25 -8.656 14.980 19.831
18 HZ3 LYS 25 2HZ LYS 25 -10.277 14.472 19.810
19 H LYS 26 H LYS 26 -6.424 15.367 13.427
20 HA LYS 26 HA LYS 26 -4.372 15.390 11.600
21 HB2 LYS 26 2HB LYS 26 -5.685 17.343 12.224
22 HB3 LYS 26 1HB LYS 26 -4.980 17.344 13.840
23 HG2 LYS 26 2HG LYS 26 -3.338 18.673 13.075
24 HG3 LYS 26 1HG LYS 26 -2.806 17.353 12.032
25 HD2 LYS 26 2HD LYS 26 -4.839 18.213 10.532
26 HD3 LYS 26 1HD LYS 26 -4.498 19.724 11.374
27 HE2 LYS 26 2HE LYS 26 -2.148 19.630 10.652
28 HE3 LYS 26 1HE LYS 26 -2.449 18.079 9.844
29 HZ1 LYS 26 3HZ LYS 26 -4.406 20.047 9.159
30 HZ2 LYS 26 1HZ LYS 26 -3.436 19.098 8.142
31 HZ3 LYS 26 2HZ LYS 26 -2.839 20.564 8.755
32 H GLU 27 H GLU 27 -3.750 16.199 15.033
33 HA GLU 27 HA GLU 27 -1.817 15.895 16.346
34 HB2 GLU 27 2HB GLU 27 -2.525 13.590 16.121
35 HB3 GLU 27 1HB GLU 27 -1.804 13.484 14.516
36 HG2 GLU 27 2HG GLU 27 -0.334 12.432 16.187
37 HG3 GLU 27 1HG GLU 27 0.437 13.867 15.508
38 H LYS 28 H LYS 28 0.612 15.837 16.203
39 HA LYS 28 HA LYS 28 1.702 17.665 14.415
40 HB2 LYS 28 2HB LYS 28 2.539 15.893 16.467
41 HB3 LYS 28 1HB LYS 28 3.652 15.673 15.116
42 HG2 LYS 28 2HG LYS 28 4.289 17.946 15.112
43 HG3 LYS 28 1HG LYS 28 2.884 18.431 16.062
44 HD2 LYS 28 2HD LYS 28 3.935 18.004 18.014
45 HD3 LYS 28 1HD LYS 28 4.512 16.438 17.443
46 HE2 LYS 28 2HE LYS 28 6.275 17.697 16.102
47 HE3 LYS 28 1HE LYS 28 5.793 19.150 17.000
48 HZ1 LYS 28 3HZ LYS 28 6.439 16.593 18.350
49 HZ2 LYS 28 1HZ LYS 28 6.303 18.135 19.043
50 HZ3 LYS 28 2HZ LYS 28 7.623 17.771 18.036
51 H LYS 29 H LYS 29 3.702 16.916 12.937
52 HA LYS 29 HA LYS 29 2.739 15.846 10.551
53 HB2 LYS 29 2HB LYS 29 5.286 16.547 11.810
54 HB3 LYS 29 1HB LYS 29 5.448 15.307 10.565
55 HG2 LYS 29 2HG LYS 29 3.655 17.223 9.522
56 HG3 LYS 29 1HG LYS 29 4.978 18.138 10.245
57 HD2 LYS 29 2HD LYS 29 5.205 15.935 8.175
58 HD3 LYS 29 1HD LYS 29 5.582 17.644 7.952
59 HE2 LYS 29 2HE LYS 29 7.232 17.212 9.993
60 HE3 LYS 29 1HE LYS 29 7.142 15.540 9.407
61 HZ1 LYS 29 3HZ LYS 29 7.846 17.954 7.828
62 HZ2 LYS 29 1HZ LYS 29 7.543 16.433 7.139
63 HZ3 LYS 29 2HZ LYS 29 8.859 16.641 8.194
64 H LYS 30 H LYS 30 4.547 13.876 9.774
65 HA LYS 30 HA LYS 30 3.306 11.451 10.340
66 HB2 LYS 30 2HB LYS 30 6.013 12.345 9.416
67 HB3 LYS 30 1HB LYS 30 5.706 10.623 9.643
68 HG2 LYS 30 2HG LYS 30 4.681 10.569 7.643
69 HG3 LYS 30 1HG LYS 30 3.467 11.690 8.260
70 HD2 LYS 30 2HD LYS 30 5.719 13.282 7.757
71 HD3 LYS 30 1HD LYS 30 5.627 12.184 6.380
72 HE2 LYS 30 2HE LYS 30 3.207 13.701 7.398
73 HE3 LYS 30 1HE LYS 30 4.273 14.337 6.132
74 HZ1 LYS 30 3HZ LYS 30 2.246 12.459 5.831
75 HZ2 LYS 30 1HZ LYS 30 3.702 11.611 5.636
76 HZ3 LYS 30 2HZ LYS 30 3.369 12.962 4.661
77 H GLY 31 H GLY 31 5.117 9.614 11.203
78 HA2 GLY 31 2HA GLY 31 4.901 9.587 13.978
79 HA3 GLY 31 1HA GLY 31 6.071 8.629 13.085
80 HA PRO 32 HA PRO 32 8.389 11.516 15.801
81 HB2 PRO 32 2HB PRO 32 10.259 9.681 16.506
82 HB3 PRO 32 1HB PRO 32 8.719 9.902 17.369
83 HG2 PRO 32 2HG PRO 32 9.448 7.916 15.290
84 HG3 PRO 32 1HG PRO 32 8.550 7.695 16.799
85 HD2 PRO 32 2HD PRO 32 7.309 7.853 14.419
86 HD3 PRO 32 1HD PRO 32 6.585 8.514 15.904
87 H GLU 33 H GLU 33 11.110 11.372 15.769
88 HA GLU 33 HA GLU 33 11.730 11.959 13.000
89 HB2 GLU 33 2HB GLU 33 12.864 13.589 14.107
90 HB3 GLU 33 1HB GLU 33 12.340 12.804 15.603
91 HG2 GLU 33 2HG GLU 33 14.661 12.823 15.828
92 HG3 GLU 33 1HG GLU 33 14.341 11.203 15.221
93 H LYS 34 H LYS 34 11.548 9.325 14.476
94 HA LYS 34 HA LYS 34 14.005 7.932 14.372
95 HB2 LYS 34 2HB LYS 34 11.207 7.582 14.798
96 HB3 LYS 34 1HB LYS 34 11.808 6.271 13.818
97 HG2 LYS 34 2HG LYS 34 13.091 7.206 16.383
98 HG3 LYS 34 1HG LYS 34 11.953 5.864 16.298
99 HD2 LYS 34 2HD LYS 34 13.442 4.516 15.071
100 HD3 LYS 34 1HD LYS 34 14.399 5.901 14.541
101 HE2 LYS 34 2HE LYS 34 15.796 5.571 16.289
102 HE3 LYS 34 1HE LYS 34 14.445 5.872 17.400
103 HZ1 LYS 34 3HZ LYS 34 13.833 3.631 17.380
104 HZ2 LYS 34 1HZ LYS 34 15.524 3.584 17.498
105 HZ3 LYS 34 2HZ LYS 34 14.769 3.281 16.006
106 H THR 35 H THR 35 15.174 7.722 12.439
107 HA THR 35 HA THR 35 13.648 6.880 10.064
108 HB THR 35 HB THR 35 15.831 8.634 9.440
109 HG1 THR 35 1HG THR 35 15.342 10.294 10.631
110 HG21 THR 35 3HG2 THR 35 12.870 8.910 8.949
111 HG22 THR 35 1HG2 THR 35 13.946 7.924 7.961
112 HG23 THR 35 2HG2 THR 35 14.171 9.672 8.034
113 H ASP 36 H ASP 36 16.457 6.561 11.966
114 HA ASP 36 HA ASP 36 17.835 4.985 9.840
115 HB2 ASP 36 2HB ASP 36 19.044 6.878 10.907
116 HB3 ASP 36 1HB ASP 36 18.836 6.092 12.471
117 H GLU 37 H GLU 37 17.786 4.808 13.324
118 HA GLU 37 HA GLU 37 18.016 1.979 13.456
119 HB2 GLU 37 2HB GLU 37 17.247 4.230 15.281
120 HB3 GLU 37 1HB GLU 37 17.028 2.572 15.840
121 HG2 GLU 37 2HG GLU 37 19.514 2.301 14.943
122 HG3 GLU 37 1HG GLU 37 19.559 4.044 15.214
123 H TYR 38 H TYR 38 15.462 4.073 12.743
124 HA TYR 38 HA TYR 38 13.253 2.389 13.562
125 HB2 TYR 38 2HB TYR 38 12.163 4.344 13.267
126 HB3 TYR 38 1HB TYR 38 13.756 5.041 13.027
127 HD1 TYR 38 2HD TYR 38 14.601 4.222 10.403
128 HD2 TYR 38 1HD TYR 38 10.679 5.255 11.792
129 HE1 TYR 38 2HE TYR 38 13.941 4.831 8.094
130 HE2 TYR 38 1HE TYR 38 10.013 5.877 9.489
131 HH TYR 38 HH TYR 38 11.516 6.697 7.307
132 H LEU 39 H LEU 39 15.306 2.570 10.799
133 HA LEU 39 HA LEU 39 13.771 1.778 8.646
134 HB2 LEU 39 2HB LEU 39 16.503 1.400 9.649
135 HB3 LEU 39 1HB LEU 39 15.998 0.149 8.525
136 HG LEU 39 HG LEU 39 16.889 1.749 7.097
137 HD11 LEU 39 1HD1 LEU 39 14.135 2.922 7.198
138 HD12 LEU 39 2HD1 LEU 39 14.363 1.246 6.699
139 HD13 LEU 39 3HD1 LEU 39 15.131 2.549 5.791
140 HD21 LEU 39 3HD2 LEU 39 15.848 3.677 9.127
141 HD22 LEU 39 1HD2 LEU 39 16.167 4.249 7.490
142 HD23 LEU 39 2HD2 LEU 39 17.469 3.541 8.446
143 H LEU 40 H LEU 40 15.319 -0.463 10.960
144 HA LEU 40 HA LEU 40 14.031 -2.811 10.052
145 HB2 LEU 40 2HB LEU 40 15.367 -1.846 12.561
146 HB3 LEU 40 1HB LEU 40 14.644 -3.453 12.521
147 HG LEU 40 HG LEU 40 17.132 -3.236 11.853
148 HD11 LEU 40 1HD1 LEU 40 16.560 -4.778 9.746
149 HD12 LEU 40 2HD1 LEU 40 14.939 -4.687 10.435
150 HD13 LEU 40 3HD1 LEU 40 16.270 -5.333 11.394
151 HD21 LEU 40 3HD2 LEU 40 17.476 -2.689 9.452
152 HD22 LEU 40 1HD2 LEU 40 16.886 -1.298 10.363
153 HD23 LEU 40 2HD2 LEU 40 15.782 -2.211 9.336
154 H ALA 41 H ALA 41 13.076 -0.373 12.434
155 HA ALA 41 HA ALA 41 10.942 -1.582 13.718
156 HB1 ALA 41 1HB ALA 41 10.266 0.628 14.155
157 HB2 ALA 41 2HB ALA 41 10.679 1.169 12.529
158 HB3 ALA 41 3HB ALA 41 11.955 0.853 13.703
159 H ARG 42 H ARG 42 11.131 -0.355 10.419
160 HA ARG 42 HA ARG 42 8.369 -0.991 9.824
161 HB2 ARG 42 2HB ARG 42 10.671 0.380 8.521
162 HB3 ARG 42 1HB ARG 42 9.332 -0.160 7.508
163 HG2 ARG 42 2HG ARG 42 7.846 1.021 9.327
164 HG3 ARG 42 1HG ARG 42 9.335 1.891 9.702
165 HD2 ARG 42 2HD ARG 42 9.320 3.045 7.709
166 HD3 ARG 42 1HD ARG 42 8.600 1.690 6.816
167 HE ARG 42 HE ARG 42 7.101 3.629 8.500
168 HH11 ARG 42 1HH2 ARG 42 6.184 0.677 8.530
169 HH12 ARG 42 2HH2 ARG 42 4.944 0.723 7.321
170 HH21 ARG 42 1HH1 ARG 42 5.946 3.784 6.035
171 HH22 ARG 42 2HH1 ARG 42 4.810 2.483 5.908
172 H PHE 43 H PHE 43 11.457 -2.485 9.541
173 HA PHE 43 HA PHE 43 11.389 -4.042 7.261
174 HB2 PHE 43 2HB PHE 43 12.439 -4.226 10.002
175 HB3 PHE 43 1HB PHE 43 12.259 -5.779 9.209
176 HD1 PHE 43 1HD PHE 43 12.967 -2.515 7.587
177 HD2 PHE 43 2HD PHE 43 14.527 -6.341 8.761
178 HE1 PHE 43 1HE PHE 43 15.032 -2.071 6.286
179 HE2 PHE 43 2HE PHE 43 16.591 -5.901 7.458
180 HZ PHE 43 HZ PHE 43 16.843 -3.764 6.220
181 H LYS 44 H LYS 44 9.344 -4.346 10.101
182 HA LYS 44 HA LYS 44 8.403 -6.948 9.543
183 HB2 LYS 44 2HB LYS 44 7.694 -4.683 11.336
184 HB3 LYS 44 1HB LYS 44 6.655 -6.111 11.274
185 HG2 LYS 44 2HG LYS 44 8.403 -6.294 13.026
186 HG3 LYS 44 1HG LYS 44 8.540 -7.549 11.796
187 HD2 LYS 44 2HD LYS 44 10.365 -6.447 10.739
188 HD3 LYS 44 1HD LYS 44 10.109 -4.975 11.676
189 HE2 LYS 44 2HE LYS 44 11.987 -6.156 12.669
190 HE3 LYS 44 1HE LYS 44 10.605 -6.352 13.766
191 HZ1 LYS 44 3HZ LYS 44 10.063 -8.423 12.556
192 HZ2 LYS 44 1HZ LYS 44 11.553 -8.502 13.360
193 HZ3 LYS 44 2HZ LYS 44 11.508 -8.264 11.679
194 H GLY 45 H GLY 45 8.009 -4.552 7.600
195 HA2 GLY 45 2HA GLY 45 5.098 -4.534 7.250
196 HA3 GLY 45 1HA GLY 45 6.255 -3.638 6.282
197 H ASP 46 H ASP 46 7.118 -4.596 4.472
198 HA ASP 46 HA ASP 46 5.706 -6.997 3.479
199 HB2 ASP 46 2HB ASP 46 7.564 -5.826 1.598
200 HB3 ASP 46 1HB ASP 46 5.809 -5.916 1.512
201 H GLY 47 H GLY 47 7.286 -7.919 5.323
202 HA2 GLY 47 2HA GLY 47 9.568 -9.105 3.824
203 HA3 GLY 47 1HA GLY 47 9.858 -8.423 5.426
204 H VAL 48 H VAL 48 8.629 -9.330 7.185
205 HA VAL 48 HA VAL 48 8.824 -12.084 7.504
206 HB VAL 48 HB VAL 48 8.673 -10.860 9.476
207 HG11 VAL 48 1HG1 VAL 48 8.040 -8.717 9.146
208 HG12 VAL 48 2HG1 VAL 48 6.425 -9.296 9.555
209 HG13 VAL 48 3HG1 VAL 48 6.909 -9.153 7.866
210 HG21 VAL 48 3HG2 VAL 48 6.895 -12.670 9.412
211 HG22 VAL 48 1HG2 VAL 48 5.743 -11.369 9.116
212 HG23 VAL 48 2HG2 VAL 48 6.680 -11.391 10.610
213 H LYS 49 H LYS 49 5.930 -10.182 6.701
214 HA LYS 49 HA LYS 49 3.912 -11.997 6.808
215 HB2 LYS 49 2HB LYS 49 3.187 -10.767 4.609
216 HB3 LYS 49 1HB LYS 49 3.391 -9.855 6.101
217 HG2 LYS 49 2HG LYS 49 5.092 -8.659 5.247
218 HG3 LYS 49 1HG LYS 49 5.887 -10.094 4.609
219 HD2 LYS 49 2HD LYS 49 5.296 -8.740 2.715
220 HD3 LYS 49 1HD LYS 49 4.153 -10.083 2.749
221 HE2 LYS 49 2HE LYS 49 3.201 -7.853 4.372
222 HE3 LYS 49 1HE LYS 49 3.475 -7.371 2.685
223 HZ1 LYS 49 3HZ LYS 49 2.269 -9.345 1.967
224 HZ2 LYS 49 1HZ LYS 49 1.284 -8.362 2.938
225 HZ3 LYS 49 2HZ LYS 49 1.973 -9.775 3.585
226 H TYR 50 H TYR 50 5.871 -11.691 3.760
227 HA TYR 50 HA TYR 50 4.843 -14.297 2.941
228 HB2 TYR 50 2HB TYR 50 5.965 -13.639 0.857
229 HB3 TYR 50 1HB TYR 50 4.859 -12.406 1.446
230 HD1 TYR 50 1HD TYR 50 8.449 -13.429 1.782
231 HD2 TYR 50 2HD TYR 50 5.596 -10.241 1.533
232 HE1 TYR 50 1HE TYR 50 10.306 -11.777 1.792
233 HE2 TYR 50 2HE TYR 50 7.440 -8.585 1.545
234 HH TYR 50 HH TYR 50 10.797 -9.566 1.295
235 H LYS 51 H LYS 51 7.856 -12.904 4.164
236 HA LYS 51 HA LYS 51 9.688 -14.842 3.299
237 HB2 LYS 51 2HB LYS 51 9.411 -12.885 5.448
238 HB3 LYS 51 1HB LYS 51 10.447 -14.237 5.870
239 HG2 LYS 51 2HG LYS 51 10.764 -12.877 3.216
240 HG3 LYS 51 1HG LYS 51 11.512 -12.194 4.658
241 HD2 LYS 51 2HD LYS 51 12.358 -14.670 5.019
242 HD3 LYS 51 1HD LYS 51 12.080 -14.796 3.281
243 HE2 LYS 51 2HE LYS 51 13.463 -12.317 3.913
244 HE3 LYS 51 1HE LYS 51 14.363 -13.725 4.512
245 HZ1 LYS 51 3HZ LYS 51 13.152 -13.601 1.806
246 HZ2 LYS 51 1HZ LYS 51 14.239 -14.760 2.399
247 HZ3 LYS 51 2HZ LYS 51 14.765 -13.169 2.115
248 H ALA 52 H ALA 52 7.603 -14.849 6.082
249 HA ALA 52 HA ALA 52 8.338 -17.279 7.264
250 HB1 ALA 52 1HB ALA 52 5.768 -17.123 7.911
251 HB2 ALA 52 2HB ALA 52 5.932 -15.535 7.160
252 HB3 ALA 52 3HB ALA 52 6.932 -15.962 8.549
253 H LYS 53 H LYS 53 5.691 -16.626 5.108
254 HA LYS 53 HA LYS 53 4.896 -19.323 4.692
255 HB2 LYS 53 2HB LYS 53 4.498 -16.731 3.188
256 HB3 LYS 53 1HB LYS 53 3.585 -18.199 2.871
257 HG2 LYS 53 2HG LYS 53 2.943 -18.191 5.335
258 HG3 LYS 53 1HG LYS 53 3.618 -16.563 5.407
259 HD2 LYS 53 2HD LYS 53 1.447 -16.007 4.881
260 HD3 LYS 53 1HD LYS 53 2.063 -16.250 3.246
261 HE2 LYS 53 2HE LYS 53 0.295 -17.702 3.067
262 HE3 LYS 53 1HE LYS 53 1.363 -18.816 3.945
263 HZ1 LYS 53 3HZ LYS 53 -0.564 -18.704 5.248
264 HZ2 LYS 53 1HZ LYS 53 -0.723 -17.027 5.046
265 HZ3 LYS 53 2HZ LYS 53 0.522 -17.650 6.021
266 H LEU 54 H LEU 54 6.620 -17.043 2.466
267 HA LEU 54 HA LEU 54 7.095 -18.753 0.369
268 HB2 LEU 54 2HB LEU 54 8.684 -16.579 1.658
269 HB3 LEU 54 1HB LEU 54 9.038 -17.231 0.049
270 HG LEU 54 HG LEU 54 6.480 -15.956 0.985
271 HD11 LEU 54 1HD1 LEU 54 8.798 -15.188 -0.631
272 HD12 LEU 54 2HD1 LEU 54 7.649 -14.178 0.246
273 HD13 LEU 54 3HD1 LEU 54 7.239 -14.796 -1.356
274 HD21 LEU 54 3HD2 LEU 54 7.070 -17.741 -1.343
275 HD22 LEU 54 1HD2 LEU 54 5.914 -16.425 -1.554
276 HD23 LEU 54 2HD2 LEU 54 5.629 -17.662 -0.330
277 H ILE 55 H ILE 55 8.463 -18.776 3.535
278 HA ILE 55 HA ILE 55 10.814 -20.252 3.031
279 HB ILE 55 HB ILE 55 9.206 -18.972 5.073
280 HG12 ILE 55 2HG1 ILE 55 11.128 -17.953 5.638
281 HG13 ILE 55 1HG1 ILE 55 12.138 -19.355 5.285
282 HG21 ILE 55 1HG2 ILE 55 10.567 -21.503 5.628
283 HG22 ILE 55 2HG2 ILE 55 9.022 -20.881 6.212
284 HG23 ILE 55 3HG2 ILE 55 10.534 -20.227 6.845
285 HD11 ILE 55 3HD1 ILE 55 10.677 -17.954 3.065
286 HD12 ILE 55 1HD1 ILE 55 12.174 -18.884 2.995
287 HD13 ILE 55 2HD1 ILE 55 12.175 -17.260 3.685
288 H GLY 56 H GLY 56 7.793 -21.060 4.734
289 HA2 GLY 56 2HA GLY 56 6.504 -23.029 4.605
290 HA3 GLY 56 1HA GLY 56 7.697 -23.661 3.517
291 H ILE 57 H ILE 57 7.887 -22.554 6.846
292 HA ILE 57 HA ILE 57 9.703 -24.530 7.665
293 HB ILE 57 HB ILE 57 9.238 -23.425 9.826
294 HG12 ILE 57 2HG1 ILE 57 7.622 -21.318 8.591
295 HG13 ILE 57 1HG1 ILE 57 6.775 -22.864 8.648
296 HG21 ILE 57 1HG2 ILE 57 10.733 -21.940 9.096
297 HG22 ILE 57 2HG2 ILE 57 9.479 -21.090 8.191
298 HG23 ILE 57 3HG2 ILE 57 10.354 -22.429 7.445
299 HD11 ILE 57 3HD1 ILE 57 7.262 -21.024 10.795
300 HD12 ILE 57 1HD1 ILE 57 8.104 -22.534 11.145
301 HD13 ILE 57 2HD1 ILE 57 6.367 -22.543 10.835
302 H ASP 58 H ASP 58 7.685 -24.350 9.980
303 HA ASP 58 HA ASP 58 6.972 -26.953 10.440
304 HB2 ASP 58 2HB ASP 58 6.552 -25.050 11.952
305 HB3 ASP 58 1HB ASP 58 5.262 -24.484 10.881
Start of MODEL 4
1 H SER 24 H SER 24 -10.177 4.461 -16.531
2 HA SER 24 HA SER 24 -8.591 4.113 -14.172
3 HB2 SER 24 2HB SER 24 -8.741 1.495 -15.580
4 HB3 SER 24 1HB SER 24 -8.498 1.834 -13.869
5 HG SER 24 HG SER 24 -10.651 0.966 -14.794
6 H LYS 25 H LYS 25 -8.756 2.643 -17.445
7 HA LYS 25 HA LYS 25 -7.083 2.563 -19.131
8 HB2 LYS 25 2HB LYS 25 -8.033 5.095 -18.592
9 HB3 LYS 25 1HB LYS 25 -6.286 5.332 -18.515
10 HG2 LYS 25 2HG LYS 25 -6.088 5.150 -20.752
11 HG3 LYS 25 1HG LYS 25 -7.009 3.646 -20.767
12 HD2 LYS 25 2HD LYS 25 -9.027 5.364 -20.310
13 HD3 LYS 25 1HD LYS 25 -7.941 6.443 -21.189
14 HE2 LYS 25 2HE LYS 25 -8.931 5.508 -23.039
15 HE3 LYS 25 1HE LYS 25 -7.803 4.173 -22.730
16 HZ1 LYS 25 3HZ LYS 25 -10.643 4.406 -22.001
17 HZ2 LYS 25 1HZ LYS 25 -9.616 3.485 -21.016
18 HZ3 LYS 25 2HZ LYS 25 -9.807 3.079 -22.654
19 H LYS 26 H LYS 26 -4.661 4.013 -19.303
20 HA LYS 26 HA LYS 26 -2.730 2.439 -18.140
21 HB2 LYS 26 2HB LYS 26 -2.621 4.442 -19.769
22 HB3 LYS 26 1HB LYS 26 -2.467 5.443 -18.324
23 HG2 LYS 26 2HG LYS 26 -0.234 4.955 -19.037
24 HG3 LYS 26 1HG LYS 26 -0.538 3.932 -17.632
25 HD2 LYS 26 2HD LYS 26 -0.385 2.027 -18.848
26 HD3 LYS 26 1HD LYS 26 -1.352 2.691 -20.165
27 HE2 LYS 26 2HE LYS 26 0.543 3.764 -21.155
28 HE3 LYS 26 1HE LYS 26 1.534 3.502 -19.705
29 HZ1 LYS 26 3HZ LYS 26 0.272 1.208 -21.052
30 HZ2 LYS 26 1HZ LYS 26 1.666 1.247 -20.086
31 HZ3 LYS 26 2HZ LYS 26 1.717 1.846 -21.675
32 H GLU 27 H GLU 27 -3.358 1.846 -15.948
33 HA GLU 27 HA GLU 27 -3.940 3.635 -13.858
34 HB2 GLU 27 2HB GLU 27 -3.580 1.711 -12.462
35 HB3 GLU 27 1HB GLU 27 -4.216 1.115 -13.996
36 HG2 GLU 27 2HG GLU 27 -1.578 1.082 -14.571
37 HG3 GLU 27 1HG GLU 27 -1.501 0.812 -12.829
38 H LYS 28 H LYS 28 -2.531 4.288 -12.047
39 HA LYS 28 HA LYS 28 -0.175 5.615 -12.714
40 HB2 LYS 28 2HB LYS 28 -1.743 5.421 -10.556
41 HB3 LYS 28 1HB LYS 28 -0.433 4.374 -10.011
42 HG2 LYS 28 2HG LYS 28 1.167 6.105 -10.141
43 HG3 LYS 28 1HG LYS 28 0.138 7.095 -11.180
44 HD2 LYS 28 2HD LYS 28 -1.507 7.125 -9.179
45 HD3 LYS 28 1HD LYS 28 -0.131 6.577 -8.221
46 HE2 LYS 28 2HE LYS 28 -0.047 8.950 -8.051
47 HE3 LYS 28 1HE LYS 28 1.142 8.577 -9.314
48 HZ1 LYS 28 3HZ LYS 28 -0.309 9.161 -10.989
49 HZ2 LYS 28 1HZ LYS 28 -0.697 10.311 -9.803
50 HZ3 LYS 28 2HZ LYS 28 -1.691 8.952 -10.023
51 H LYS 29 H LYS 29 1.909 4.943 -13.114
52 HA LYS 29 HA LYS 29 2.743 2.375 -13.630
53 HB2 LYS 29 2HB LYS 29 3.910 4.640 -13.918
54 HB3 LYS 29 1HB LYS 29 4.478 4.436 -12.259
55 HG2 LYS 29 2HG LYS 29 5.885 2.696 -12.805
56 HG3 LYS 29 1HG LYS 29 4.861 2.145 -14.131
57 HD2 LYS 29 2HD LYS 29 6.822 3.088 -15.140
58 HD3 LYS 29 1HD LYS 29 5.528 4.264 -15.371
59 HE2 LYS 29 2HE LYS 29 7.126 5.702 -14.520
60 HE3 LYS 29 1HE LYS 29 6.489 5.107 -12.974
61 HZ1 LYS 29 3HZ LYS 29 8.741 3.904 -14.498
62 HZ2 LYS 29 1HZ LYS 29 8.115 3.313 -13.037
63 HZ3 LYS 29 2HZ LYS 29 8.892 4.824 -13.077
64 H LYS 30 H LYS 30 2.387 0.646 -12.242
65 HA LYS 30 HA LYS 30 2.307 0.764 -9.412
66 HB2 LYS 30 2HB LYS 30 2.379 -1.236 -11.576
67 HB3 LYS 30 1HB LYS 30 2.980 -1.824 -10.025
68 HG2 LYS 30 2HG LYS 30 0.360 -0.337 -10.300
69 HG3 LYS 30 1HG LYS 30 0.473 -2.094 -10.403
70 HD2 LYS 30 2HD LYS 30 1.761 -0.720 -8.076
71 HD3 LYS 30 1HD LYS 30 0.007 -0.907 -8.077
72 HE2 LYS 30 2HE LYS 30 1.134 -3.399 -8.915
73 HE3 LYS 30 1HE LYS 30 1.973 -2.886 -7.437
74 HZ1 LYS 30 3HZ LYS 30 -0.308 -4.081 -7.247
75 HZ2 LYS 30 1HZ LYS 30 -0.945 -2.561 -7.648
76 HZ3 LYS 30 2HZ LYS 30 0.018 -2.738 -6.259
77 H GLY 31 H GLY 31 4.395 2.143 -9.212
78 HA2 GLY 31 2HA GLY 31 6.698 2.333 -8.776
79 HA3 GLY 31 1HA GLY 31 6.426 0.819 -7.916
80 HA PRO 32 HA PRO 32 9.422 0.087 -11.355
81 HB2 PRO 32 2HB PRO 32 11.245 -1.242 -9.851
82 HB3 PRO 32 1HB PRO 32 11.238 0.527 -10.048
83 HG2 PRO 32 2HG PRO 32 10.168 -1.129 -7.836
84 HG3 PRO 32 1HG PRO 32 11.085 0.384 -7.776
85 HD2 PRO 32 2HD PRO 32 8.411 0.295 -7.423
86 HD3 PRO 32 1HD PRO 32 9.230 1.679 -8.184
87 H GLU 33 H GLU 33 10.193 -2.126 -12.122
88 HA GLU 33 HA GLU 33 8.185 -4.142 -11.495
89 HB2 GLU 33 2HB GLU 33 8.309 -4.247 -13.766
90 HB3 GLU 33 1HB GLU 33 9.639 -3.086 -13.671
91 HG2 GLU 33 2HG GLU 33 10.601 -4.898 -14.790
92 HG3 GLU 33 1HG GLU 33 11.127 -5.125 -13.125
93 H LYS 34 H LYS 34 10.631 -3.334 -10.029
94 HA LYS 34 HA LYS 34 12.692 -5.161 -9.908
95 HB2 LYS 34 2HB LYS 34 11.443 -3.085 -8.439
96 HB3 LYS 34 1HB LYS 34 11.848 -4.363 -7.325
97 HG2 LYS 34 2HG LYS 34 13.738 -3.119 -9.327
98 HG3 LYS 34 1HG LYS 34 13.699 -2.731 -7.608
99 HD2 LYS 34 2HD LYS 34 14.854 -4.602 -7.053
100 HD3 LYS 34 1HD LYS 34 13.884 -5.610 -8.125
101 HE2 LYS 34 2HE LYS 34 15.340 -4.095 -9.922
102 HE3 LYS 34 1HE LYS 34 16.506 -4.373 -8.613
103 HZ1 LYS 34 3HZ LYS 34 14.780 -6.528 -9.688
104 HZ2 LYS 34 1HZ LYS 34 16.154 -6.683 -8.706
105 HZ3 LYS 34 2HZ LYS 34 16.321 -6.201 -10.326
106 H THR 35 H THR 35 12.982 -7.123 -8.683
107 HA THR 35 HA THR 35 10.736 -8.263 -7.240
108 HB THR 35 HB THR 35 11.580 -10.193 -9.133
109 HG1 THR 35 1HG THR 35 11.992 -8.853 -10.710
110 HG21 THR 35 3HG2 THR 35 9.080 -8.848 -8.275
111 HG22 THR 35 1HG2 THR 35 9.455 -10.569 -8.366
112 HG23 THR 35 2HG2 THR 35 9.045 -9.677 -9.832
113 H ASP 36 H ASP 36 14.059 -8.496 -8.298
114 HA ASP 36 HA ASP 36 14.577 -10.698 -6.373
115 HB2 ASP 36 2HB ASP 36 15.426 -10.255 -8.916
116 HB3 ASP 36 1HB ASP 36 16.748 -9.527 -8.004
117 H GLU 37 H GLU 37 16.393 -7.857 -7.282
118 HA GLU 37 HA GLU 37 17.656 -7.494 -4.766
119 HB2 GLU 37 2HB GLU 37 17.242 -6.001 -7.293
120 HB3 GLU 37 1HB GLU 37 17.665 -5.019 -5.890
121 HG2 GLU 37 2HG GLU 37 19.220 -7.496 -6.660
122 HG3 GLU 37 1HG GLU 37 19.629 -5.894 -7.272
123 H TYR 38 H TYR 38 14.507 -6.889 -5.846
124 HA TYR 38 HA TYR 38 13.860 -4.732 -4.023
125 HB2 TYR 38 2HB TYR 38 12.115 -4.549 -5.434
126 HB3 TYR 38 1HB TYR 38 12.961 -5.736 -6.410
127 HD1 TYR 38 1HD TYR 38 12.601 -8.251 -5.037
128 HD2 TYR 38 2HD TYR 38 9.874 -4.982 -5.496
129 HE1 TYR 38 1HE TYR 38 10.692 -9.803 -4.747
130 HE2 TYR 38 2HE TYR 38 7.957 -6.522 -5.215
131 HH TYR 38 HH TYR 38 7.660 -8.877 -4.006
132 H LEU 39 H LEU 39 13.952 -8.183 -3.800
133 HA LEU 39 HA LEU 39 11.995 -8.865 -1.977
134 HB2 LEU 39 2HB LEU 39 14.708 -9.671 -2.692
135 HB3 LEU 39 1HB LEU 39 14.321 -10.042 -1.015
136 HG LEU 39 HG LEU 39 13.623 -11.933 -2.270
137 HD11 LEU 39 1HD1 LEU 39 11.514 -12.107 -1.435
138 HD12 LEU 39 2HD1 LEU 39 10.973 -10.639 -2.248
139 HD13 LEU 39 3HD1 LEU 39 11.875 -10.530 -0.736
140 HD21 LEU 39 3HD2 LEU 39 13.666 -11.112 -4.500
141 HD22 LEU 39 1HD2 LEU 39 12.461 -9.876 -4.140
142 HD23 LEU 39 2HD2 LEU 39 11.988 -11.573 -4.210
143 H LEU 40 H LEU 40 15.244 -7.634 -1.131
144 HA LEU 40 HA LEU 40 14.767 -7.257 1.630
145 HB2 LEU 40 2HB LEU 40 16.622 -6.166 -0.463
146 HB3 LEU 40 1HB LEU 40 16.705 -5.544 1.186
147 HG LEU 40 HG LEU 40 18.214 -7.555 0.577
148 HD11 LEU 40 1HD1 LEU 40 17.023 -8.633 2.881
149 HD12 LEU 40 2HD1 LEU 40 16.659 -6.909 2.945
150 HD13 LEU 40 3HD1 LEU 40 18.333 -7.454 2.832
151 HD21 LEU 40 3HD2 LEU 40 17.084 -9.759 0.854
152 HD22 LEU 40 1HD2 LEU 40 16.517 -8.896 -0.576
153 HD23 LEU 40 2HD2 LEU 40 15.526 -8.931 0.882
154 H ALA 41 H ALA 41 14.165 -5.168 -1.159
155 HA ALA 41 HA ALA 41 13.676 -2.692 -0.048
156 HB1 ALA 41 1HB ALA 41 12.252 -2.365 -1.931
157 HB2 ALA 41 2HB ALA 41 11.726 -4.049 -1.917
158 HB3 ALA 41 3HB ALA 41 13.360 -3.640 -2.441
159 H ARG 42 H ARG 42 11.687 -5.595 0.177
160 HA ARG 42 HA ARG 42 9.628 -4.284 1.729
161 HB2 ARG 42 2HB ARG 42 10.108 -6.960 0.491
162 HB3 ARG 42 1HB ARG 42 8.806 -6.764 1.665
163 HG2 ARG 42 2HG ARG 42 9.159 -5.170 -0.892
164 HG3 ARG 42 1HG ARG 42 7.941 -6.414 -0.605
165 HD2 ARG 42 2HD ARG 42 6.612 -4.688 0.082
166 HD3 ARG 42 1HD ARG 42 7.599 -4.699 1.557
167 HE ARG 42 HE ARG 42 9.177 -3.188 0.021
168 HH11 ARG 42 1HH2 ARG 42 6.705 -2.220 1.758
169 HH12 ARG 42 2HH2 ARG 42 6.085 -1.004 0.691
170 HH21 ARG 42 1HH1 ARG 42 7.972 -2.050 -2.025
171 HH22 ARG 42 2HH1 ARG 42 6.808 -0.904 -1.449
172 H PHE 43 H PHE 43 12.486 -6.123 2.296
173 HA PHE 43 HA PHE 43 12.053 -7.560 4.623
174 HB2 PHE 43 2HB PHE 43 14.251 -6.075 3.343
175 HB3 PHE 43 1HB PHE 43 14.461 -6.312 5.067
176 HD1 PHE 43 2HD PHE 43 12.892 -8.431 2.410
177 HD2 PHE 43 1HD PHE 43 15.951 -8.078 5.404
178 HE1 PHE 43 2HE PHE 43 13.583 -10.774 1.981
179 HE2 PHE 43 1HE PHE 43 16.645 -10.418 4.974
180 HZ PHE 43 HZ PHE 43 15.459 -11.769 3.263
181 H LYS 44 H LYS 44 12.484 -4.038 4.334
182 HA LYS 44 HA LYS 44 12.483 -3.545 7.114
183 HB2 LYS 44 2HB LYS 44 12.299 -1.976 4.592
184 HB3 LYS 44 1HB LYS 44 12.116 -1.162 6.151
185 HG2 LYS 44 2HG LYS 44 14.471 -1.179 5.384
186 HG3 LYS 44 1HG LYS 44 14.254 -2.052 6.901
187 HD2 LYS 44 2HD LYS 44 14.361 -4.165 5.809
188 HD3 LYS 44 1HD LYS 44 14.230 -3.424 4.215
189 HE2 LYS 44 2HE LYS 44 16.539 -3.797 4.337
190 HE3 LYS 44 1HE LYS 44 16.439 -2.152 4.997
191 HZ1 LYS 44 3HZ LYS 44 17.677 -3.697 6.456
192 HZ2 LYS 44 1HZ LYS 44 16.272 -4.631 6.627
193 HZ3 LYS 44 2HZ LYS 44 16.305 -3.034 7.208
194 H GLY 45 H GLY 45 10.038 -4.789 5.617
195 HA2 GLY 45 2HA GLY 45 8.038 -3.761 7.417
196 HA3 GLY 45 1HA GLY 45 7.795 -3.135 5.797
197 H ASP 46 H ASP 46 7.072 -4.502 4.199
198 HA ASP 46 HA ASP 46 5.589 -6.831 5.057
199 HB2 ASP 46 2HB ASP 46 6.196 -6.068 2.208
200 HB3 ASP 46 1HB ASP 46 4.714 -6.733 2.886
201 H GLY 47 H GLY 47 8.492 -7.213 5.444
202 HA2 GLY 47 2HA GLY 47 9.281 -9.041 3.272
203 HA3 GLY 47 1HA GLY 47 10.265 -8.614 4.676
204 H VAL 48 H VAL 48 8.719 -9.113 6.697
205 HA VAL 48 HA VAL 48 8.901 -11.843 7.253
206 HB VAL 48 HB VAL 48 8.787 -10.481 9.131
207 HG11 VAL 48 1HG1 VAL 48 8.298 -8.338 8.537
208 HG12 VAL 48 2HG1 VAL 48 6.697 -8.767 9.143
209 HG13 VAL 48 3HG1 VAL 48 7.032 -8.835 7.413
210 HG21 VAL 48 3HG2 VAL 48 6.827 -12.181 9.087
211 HG22 VAL 48 1HG2 VAL 48 5.828 -10.741 8.890
212 HG23 VAL 48 2HG2 VAL 48 6.849 -10.915 10.319
213 H LYS 49 H LYS 49 6.031 -9.946 6.303
214 HA LYS 49 HA LYS 49 3.995 -11.735 6.571
215 HB2 LYS 49 2HB LYS 49 3.182 -10.637 4.381
216 HB3 LYS 49 1HB LYS 49 3.564 -9.597 5.741
217 HG2 LYS 49 2HG LYS 49 5.232 -8.584 4.641
218 HG3 LYS 49 1HG LYS 49 5.917 -10.105 4.107
219 HD2 LYS 49 2HD LYS 49 3.776 -8.442 2.789
220 HD3 LYS 49 1HD LYS 49 5.295 -8.996 2.104
221 HE2 LYS 49 2HE LYS 49 4.132 -10.727 1.199
222 HE3 LYS 49 1HE LYS 49 3.909 -11.346 2.844
223 HZ1 LYS 49 3HZ LYS 49 1.812 -10.819 1.554
224 HZ2 LYS 49 1HZ LYS 49 2.227 -9.184 1.726
225 HZ3 LYS 49 2HZ LYS 49 1.932 -10.133 3.103
226 H TYR 50 H TYR 50 5.892 -11.649 3.471
227 HA TYR 50 HA TYR 50 4.860 -14.288 2.822
228 HB2 TYR 50 2HB TYR 50 6.068 -13.826 0.740
229 HB3 TYR 50 1HB TYR 50 5.023 -12.489 1.202
230 HD1 TYR 50 1HD TYR 50 8.526 -13.692 1.758
231 HD2 TYR 50 2HD TYR 50 5.904 -10.367 1.131
232 HE1 TYR 50 1HE TYR 50 10.480 -12.169 1.720
233 HE2 TYR 50 2HE TYR 50 7.851 -8.831 1.095
234 HH TYR 50 HH TYR 50 10.340 -9.040 0.567
235 H LYS 51 H LYS 51 7.836 -12.872 4.065
236 HA LYS 51 HA LYS 51 9.749 -14.790 3.483
237 HB2 LYS 51 2HB LYS 51 9.148 -12.865 5.607
238 HB3 LYS 51 1HB LYS 51 10.193 -14.178 6.121
239 HG2 LYS 51 2HG LYS 51 10.857 -13.003 3.492
240 HG3 LYS 51 1HG LYS 51 11.114 -11.945 4.881
241 HD2 LYS 51 2HD LYS 51 12.431 -13.755 5.975
242 HD3 LYS 51 1HD LYS 51 12.240 -14.737 4.522
243 HE2 LYS 51 2HE LYS 51 13.378 -12.971 3.191
244 HE3 LYS 51 1HE LYS 51 13.617 -12.030 4.677
245 HZ1 LYS 51 3HZ LYS 51 14.582 -14.796 4.170
246 HZ2 LYS 51 1HZ LYS 51 14.721 -13.979 5.650
247 HZ3 LYS 51 2HZ LYS 51 15.546 -13.401 4.282
248 H ALA 52 H ALA 52 7.656 -14.808 6.270
249 HA ALA 52 HA ALA 52 8.202 -17.288 7.372
250 HB1 ALA 52 1HB ALA 52 5.539 -15.914 7.038
251 HB2 ALA 52 2HB ALA 52 6.720 -15.549 8.297
252 HB3 ALA 52 3HB ALA 52 5.914 -17.119 8.271
253 H LYS 53 H LYS 53 5.694 -16.575 5.069
254 HA LYS 53 HA LYS 53 4.852 -19.243 4.596
255 HB2 LYS 53 2HB LYS 53 4.584 -16.575 3.237
256 HB3 LYS 53 1HB LYS 53 3.841 -18.014 2.551
257 HG2 LYS 53 2HG LYS 53 3.024 -18.291 5.100
258 HG3 LYS 53 1HG LYS 53 3.154 -16.533 5.030
259 HD2 LYS 53 2HD LYS 53 1.844 -16.765 2.785
260 HD3 LYS 53 1HD LYS 53 1.399 -18.358 3.402
261 HE2 LYS 53 2HE LYS 53 1.098 -16.155 5.359
262 HE3 LYS 53 1HE LYS 53 -0.008 -16.088 3.973
263 HZ1 LYS 53 3HZ LYS 53 -0.345 -17.691 6.122
264 HZ2 LYS 53 1HZ LYS 53 0.409 -18.741 5.025
265 HZ3 LYS 53 2HZ LYS 53 -1.037 -17.959 4.595
266 H LEU 54 H LEU 54 6.847 -17.087 2.460
267 HA LEU 54 HA LEU 54 7.304 -18.825 0.392
268 HB2 LEU 54 2HB LEU 54 8.994 -16.793 1.776
269 HB3 LEU 54 1HB LEU 54 9.384 -17.473 0.187
270 HG LEU 54 HG LEU 54 6.898 -15.981 0.981
271 HD11 LEU 54 1HD1 LEU 54 8.232 -15.210 -1.452
272 HD12 LEU 54 2HD1 LEU 54 9.352 -15.207 -0.088
273 HD13 LEU 54 3HD1 LEU 54 7.875 -14.243 -0.021
274 HD21 LEU 54 3HD2 LEU 54 5.900 -17.520 -0.395
275 HD22 LEU 54 1HD2 LEU 54 7.406 -17.904 -1.227
276 HD23 LEU 54 2HD2 LEU 54 6.519 -16.437 -1.643
277 H ILE 55 H ILE 55 8.486 -19.005 3.621
278 HA ILE 55 HA ILE 55 10.743 -20.648 3.213
279 HB ILE 55 HB ILE 55 9.126 -19.293 5.186
280 HG12 ILE 55 2HG1 ILE 55 11.087 -18.508 5.937
281 HG13 ILE 55 1HG1 ILE 55 11.976 -19.997 5.602
282 HG21 ILE 55 1HG2 ILE 55 10.259 -21.940 5.820
283 HG22 ILE 55 2HG2 ILE 55 8.651 -21.293 6.152
284 HG23 ILE 55 3HG2 ILE 55 10.049 -20.689 7.045
285 HD11 ILE 55 3HD1 ILE 55 10.830 -18.367 3.349
286 HD12 ILE 55 1HD1 ILE 55 12.214 -19.461 3.334
287 HD13 ILE 55 2HD1 ILE 55 12.353 -17.874 4.092
288 H GLY 56 H GLY 56 7.544 -21.289 4.636
289 HA2 GLY 56 2HA GLY 56 6.363 -23.305 3.589
290 HA3 GLY 56 1HA GLY 56 7.870 -24.096 3.928
291 H ILE 57 H ILE 57 5.926 -21.932 5.866
292 HA ILE 57 HA ILE 57 6.313 -23.380 8.250
293 HB ILE 57 HB ILE 57 4.882 -21.555 9.063
294 HG12 ILE 57 2HG1 ILE 57 4.921 -20.203 6.440
295 HG13 ILE 57 1HG1 ILE 57 3.827 -21.586 6.516
296 HG21 ILE 57 1HG2 ILE 57 6.494 -19.809 7.723
297 HG22 ILE 57 2HG2 ILE 57 7.339 -21.338 7.478
298 HG23 ILE 57 3HG2 ILE 57 7.003 -20.770 9.112
299 HD11 ILE 57 3HD1 ILE 57 3.590 -18.958 7.783
300 HD12 ILE 57 1HD1 ILE 57 3.373 -20.284 8.924
301 HD13 ILE 57 2HD1 ILE 57 2.350 -20.179 7.491
302 H ASP 58 H ASP 58 3.396 -22.422 8.390
303 HA ASP 58 HA ASP 58 1.319 -23.543 8.740
304 HB2 ASP 58 2HB ASP 58 1.301 -23.003 6.364
305 HB3 ASP 58 1HB ASP 58 2.274 -24.436 5.999
Start of MODEL 5
1 H SER 24 H SER 24 7.599 11.046 10.407
2 HA SER 24 HA SER 24 9.849 11.511 8.695
3 HB2 SER 24 2HB SER 24 10.171 8.742 9.596
4 HB3 SER 24 1HB SER 24 11.391 9.993 9.385
5 HG SER 24 HG SER 24 11.384 9.877 11.505
6 H LYS 25 H LYS 25 6.904 11.096 8.716
7 HA LYS 25 HA LYS 25 5.923 8.703 7.750
8 HB2 LYS 25 2HB LYS 25 4.315 10.132 6.507
9 HB3 LYS 25 1HB LYS 25 4.627 10.762 8.126
10 HG2 LYS 25 2HG LYS 25 6.543 12.104 6.878
11 HG3 LYS 25 1HG LYS 25 5.512 11.833 5.472
12 HD2 LYS 25 2HD LYS 25 4.365 12.898 8.049
13 HD3 LYS 25 1HD LYS 25 5.104 13.980 6.868
14 HE2 LYS 25 2HE LYS 25 3.530 13.325 5.159
15 HE3 LYS 25 1HE LYS 25 2.898 12.012 6.172
16 HZ1 LYS 25 3HZ LYS 25 2.265 13.665 7.834
17 HZ2 LYS 25 1HZ LYS 25 1.490 13.963 6.355
18 HZ3 LYS 25 2HZ LYS 25 2.819 14.913 6.823
19 H LYS 26 H LYS 26 6.916 7.394 6.240
20 HA LYS 26 HA LYS 26 8.773 8.092 4.278
21 HB2 LYS 26 2HB LYS 26 7.236 5.858 5.100
22 HB3 LYS 26 1HB LYS 26 7.016 5.997 3.356
23 HG2 LYS 26 2HG LYS 26 9.180 5.453 2.913
24 HG3 LYS 26 1HG LYS 26 9.793 6.393 4.274
25 HD2 LYS 26 2HD LYS 26 8.318 3.784 4.670
26 HD3 LYS 26 1HD LYS 26 10.065 3.844 4.431
27 HE2 LYS 26 2HE LYS 26 9.935 5.686 6.347
28 HE3 LYS 26 1HE LYS 26 8.443 4.815 6.756
29 HZ1 LYS 26 3HZ LYS 26 10.724 3.969 7.656
30 HZ2 LYS 26 1HZ LYS 26 10.868 3.285 6.111
31 HZ3 LYS 26 2HZ LYS 26 9.560 2.860 7.109
32 H GLU 27 H GLU 27 8.347 9.842 2.921
33 HA GLU 27 HA GLU 27 6.065 10.921 1.912
34 HB2 GLU 27 2HB GLU 27 7.550 11.037 -0.331
35 HB3 GLU 27 1HB GLU 27 7.936 11.981 1.104
36 HG2 GLU 27 2HG GLU 27 9.874 10.692 0.049
37 HG3 GLU 27 1HG GLU 27 9.639 10.446 1.776
38 H LYS 28 H LYS 28 4.285 9.655 1.408
39 HA LYS 28 HA LYS 28 4.034 7.169 0.279
40 HB2 LYS 28 2HB LYS 28 2.345 9.093 0.945
41 HB3 LYS 28 1HB LYS 28 2.359 9.421 -0.788
42 HG2 LYS 28 2HG LYS 28 0.578 7.880 -0.485
43 HG3 LYS 28 1HG LYS 28 1.917 6.900 -1.089
44 HD2 LYS 28 2HD LYS 28 2.400 6.789 1.583
45 HD3 LYS 28 1HD LYS 28 0.640 6.908 1.583
46 HE2 LYS 28 2HE LYS 28 1.925 4.985 -0.329
47 HE3 LYS 28 1HE LYS 28 1.802 4.530 1.383
48 HZ1 LYS 28 3HZ LYS 28 -0.543 5.799 0.230
49 HZ2 LYS 28 1HZ LYS 28 -0.438 4.499 1.315
50 HZ3 LYS 28 2HZ LYS 28 -0.203 4.237 -0.348
51 H LYS 29 H LYS 29 4.869 10.155 -1.430
52 HA LYS 29 HA LYS 29 4.575 9.425 -4.091
53 HB2 LYS 29 2HB LYS 29 5.904 11.375 -2.512
54 HB3 LYS 29 1HB LYS 29 7.071 10.788 -3.698
55 HG2 LYS 29 2HG LYS 29 5.908 11.649 -5.467
56 HG3 LYS 29 1HG LYS 29 4.340 11.315 -4.729
57 HD2 LYS 29 2HD LYS 29 5.395 13.221 -3.035
58 HD3 LYS 29 1HD LYS 29 5.978 13.752 -4.614
59 HE2 LYS 29 2HE LYS 29 3.910 14.735 -4.765
60 HE3 LYS 29 1HE LYS 29 3.371 13.100 -5.194
61 HZ1 LYS 29 3HZ LYS 29 2.992 12.619 -2.879
62 HZ2 LYS 29 1HZ LYS 29 2.126 14.015 -3.297
63 HZ3 LYS 29 2HZ LYS 29 3.575 14.147 -2.420
64 H LYS 30 H LYS 30 6.852 9.168 -5.472
65 HA LYS 30 HA LYS 30 7.634 6.530 -5.465
66 HB2 LYS 30 2HB LYS 30 8.840 9.145 -6.235
67 HB3 LYS 30 1HB LYS 30 9.897 7.731 -6.280
68 HG2 LYS 30 2HG LYS 30 8.818 6.830 -8.066
69 HG3 LYS 30 1HG LYS 30 7.230 7.288 -7.451
70 HD2 LYS 30 2HD LYS 30 8.070 9.733 -8.048
71 HD3 LYS 30 1HD LYS 30 9.125 8.856 -9.160
72 HE2 LYS 30 2HE LYS 30 7.399 8.488 -10.584
73 HE3 LYS 30 1HE LYS 30 6.407 7.815 -9.275
74 HZ1 LYS 30 3HZ LYS 30 6.894 10.678 -9.175
75 HZ2 LYS 30 1HZ LYS 30 5.484 9.806 -8.815
76 HZ3 LYS 30 2HZ LYS 30 5.878 10.150 -10.431
77 H GLY 31 H GLY 31 8.608 5.278 -3.918
78 HA2 GLY 31 2HA GLY 31 9.462 6.037 -1.418
79 HA3 GLY 31 1HA GLY 31 10.143 4.644 -2.252
80 HA PRO 32 HA PRO 32 13.284 8.094 -1.623
81 HB2 PRO 32 2HB PRO 32 14.871 6.803 0.161
82 HB3 PRO 32 1HB PRO 32 13.526 7.868 0.634
83 HG2 PRO 32 2HG PRO 32 13.610 4.912 0.421
84 HG3 PRO 32 1HG PRO 32 12.886 5.936 1.670
85 HD2 PRO 32 2HD PRO 32 11.414 4.755 -0.255
86 HD3 PRO 32 1HD PRO 32 10.994 6.346 0.424
87 H GLU 33 H GLU 33 15.887 7.463 -1.678
88 HA GLU 33 HA GLU 33 16.129 5.761 -3.996
89 HB2 GLU 33 2HB GLU 33 17.681 7.361 -4.466
90 HB3 GLU 33 1HB GLU 33 17.232 8.083 -2.917
91 HG2 GLU 33 2HG GLU 33 18.974 7.020 -1.760
92 HG3 GLU 33 1HG GLU 33 19.233 5.843 -3.045
93 H LYS 34 H LYS 34 16.028 5.258 -0.950
94 HA LYS 34 HA LYS 34 18.224 3.591 -0.258
95 HB2 LYS 34 2HB LYS 34 15.746 4.621 0.722
96 HB3 LYS 34 1HB LYS 34 15.876 2.931 1.134
97 HG2 LYS 34 2HG LYS 34 18.282 4.640 1.512
98 HG3 LYS 34 1HG LYS 34 16.953 4.855 2.650
99 HD2 LYS 34 2HD LYS 34 17.031 2.531 3.295
100 HD3 LYS 34 1HD LYS 34 18.177 2.160 2.004
101 HE2 LYS 34 2HE LYS 34 19.499 2.345 3.999
102 HE3 LYS 34 1HE LYS 34 19.743 3.875 3.135
103 HZ1 LYS 34 3HZ LYS 34 19.060 4.752 5.086
104 HZ2 LYS 34 1HZ LYS 34 18.246 3.346 5.573
105 HZ3 LYS 34 2HZ LYS 34 17.512 4.415 4.474
106 H THR 35 H THR 35 18.217 1.232 -0.187
107 HA THR 35 HA THR 35 16.019 -0.271 -1.282
108 HB THR 35 HB THR 35 18.306 -0.699 -2.973
109 HG1 THR 35 1HG THR 35 17.026 1.752 -3.393
110 HG21 THR 35 3HG2 THR 35 16.587 -1.421 -4.216
111 HG22 THR 35 1HG2 THR 35 16.078 0.254 -4.423
112 HG23 THR 35 2HG2 THR 35 15.443 -0.702 -3.084
113 H ASP 36 H ASP 36 19.305 -0.181 -0.111
114 HA ASP 36 HA ASP 36 19.373 -3.138 0.138
115 HB2 ASP 36 2HB ASP 36 21.234 -1.059 -0.362
116 HB3 ASP 36 1HB ASP 36 21.671 -1.785 1.184
117 H GLU 37 H GLU 37 20.476 -0.581 2.241
118 HA GLU 37 HA GLU 37 20.003 -2.024 4.651
119 HB2 GLU 37 2HB GLU 37 20.757 0.697 3.784
120 HB3 GLU 37 1HB GLU 37 20.013 0.606 5.381
121 HG2 GLU 37 2HG GLU 37 21.773 -1.522 5.417
122 HG3 GLU 37 1HG GLU 37 22.663 -0.305 4.505
123 H TYR 38 H TYR 38 17.971 -0.425 2.489
124 HA TYR 38 HA TYR 38 15.890 0.361 4.341
125 HB2 TYR 38 2HB TYR 38 15.276 1.555 2.531
126 HB3 TYR 38 1HB TYR 38 16.762 0.978 1.798
127 HD1 TYR 38 1HD TYR 38 16.325 -1.763 1.090
128 HD2 TYR 38 2HD TYR 38 13.573 1.524 1.032
129 HE1 TYR 38 1HE TYR 38 14.974 -2.916 -0.643
130 HE2 TYR 38 2HE TYR 38 12.220 0.382 -0.700
131 HH TYR 38 HH TYR 38 11.959 -1.476 -1.898
132 H LEU 39 H LEU 39 16.752 -2.563 2.703
133 HA LEU 39 HA LEU 39 14.371 -3.914 2.302
134 HB2 LEU 39 2HB LEU 39 17.150 -4.503 2.993
135 HB3 LEU 39 1HB LEU 39 16.040 -5.732 3.583
136 HG LEU 39 HG LEU 39 16.576 -6.468 1.425
137 HD11 LEU 39 1HD1 LEU 39 14.516 -6.624 0.454
138 HD12 LEU 39 2HD1 LEU 39 14.249 -4.882 0.512
139 HD13 LEU 39 3HD1 LEU 39 14.010 -5.860 1.960
140 HD21 LEU 39 3HD2 LEU 39 17.651 -4.994 0.109
141 HD22 LEU 39 1HD2 LEU 39 16.937 -3.628 0.966
142 HD23 LEU 39 2HD2 LEU 39 16.065 -4.390 -0.365
143 H LEU 40 H LEU 40 16.239 -3.878 5.342
144 HA LEU 40 HA LEU 40 14.319 -5.135 6.983
145 HB2 LEU 40 2HB LEU 40 16.624 -3.241 7.326
146 HB3 LEU 40 1HB LEU 40 15.672 -3.716 8.733
147 HG LEU 40 HG LEU 40 17.756 -5.145 8.104
148 HD11 LEU 40 1HD1 LEU 40 15.031 -6.398 8.553
149 HD12 LEU 40 2HD1 LEU 40 16.106 -5.781 9.807
150 HD13 LEU 40 3HD1 LEU 40 16.574 -7.195 8.862
151 HD21 LEU 40 3HD2 LEU 40 15.701 -6.170 6.114
152 HD22 LEU 40 1HD2 LEU 40 17.218 -6.981 6.506
153 HD23 LEU 40 2HD2 LEU 40 17.240 -5.406 5.714
154 H ALA 41 H ALA 41 14.717 -1.769 6.005
155 HA ALA 41 HA ALA 41 13.032 -0.420 7.746
156 HB1 ALA 41 1HB ALA 41 14.367 0.228 5.547
157 HB2 ALA 41 2HB ALA 41 12.978 1.194 6.042
158 HB3 ALA 41 3HB ALA 41 12.801 -0.021 4.775
159 H ARG 42 H ARG 42 12.229 -2.574 5.075
160 HA ARG 42 HA ARG 42 9.377 -2.249 5.414
161 HB2 ARG 42 2HB ARG 42 11.216 -3.731 3.570
162 HB3 ARG 42 1HB ARG 42 9.472 -3.979 3.509
163 HG2 ARG 42 2HG ARG 42 9.842 -1.187 3.582
164 HG3 ARG 42 1HG ARG 42 11.030 -1.797 2.432
165 HD2 ARG 42 2HD ARG 42 9.379 -2.756 1.042
166 HD3 ARG 42 1HD ARG 42 8.157 -2.735 2.331
167 HE ARG 42 HE ARG 42 9.163 -0.073 1.712
168 HH11 ARG 42 1HH1 ARG 42 8.107 -1.501 -0.836
169 HH12 ARG 42 2HH1 ARG 42 6.482 -0.901 -0.867
170 HH21 ARG 42 1HH2 ARG 42 6.564 0.247 2.404
171 HH22 ARG 42 2HH2 ARG 42 5.609 0.090 0.967
172 H PHE 43 H PHE 43 11.864 -4.410 6.454
173 HA PHE 43 HA PHE 43 10.728 -6.895 6.753
174 HB2 PHE 43 2HB PHE 43 12.639 -5.189 8.172
175 HB3 PHE 43 1HB PHE 43 11.897 -6.388 9.214
176 HD1 PHE 43 2HD PHE 43 12.975 -6.358 5.620
177 HD2 PHE 43 1HD PHE 43 13.272 -8.242 9.468
178 HE1 PHE 43 2HE PHE 43 14.468 -8.089 4.658
179 HE2 PHE 43 1HE PHE 43 14.767 -9.971 8.508
180 HZ PHE 43 HZ PHE 43 15.363 -9.897 6.101
181 H LYS 44 H LYS 44 9.958 -3.982 8.621
182 HA LYS 44 HA LYS 44 8.265 -5.300 10.471
183 HB2 LYS 44 2HB LYS 44 8.992 -2.511 9.725
184 HB3 LYS 44 1HB LYS 44 7.704 -2.799 10.902
185 HG2 LYS 44 2HG LYS 44 9.894 -2.564 12.010
186 HG3 LYS 44 1HG LYS 44 9.219 -4.175 12.241
187 HD2 LYS 44 2HD LYS 44 10.694 -5.148 10.687
188 HD3 LYS 44 1HD LYS 44 11.117 -3.587 9.984
189 HE2 LYS 44 2HE LYS 44 12.667 -3.125 11.614
190 HE3 LYS 44 1HE LYS 44 11.701 -3.898 12.887
191 HZ1 LYS 44 3HZ LYS 44 12.267 -6.044 12.051
192 HZ2 LYS 44 1HZ LYS 44 13.715 -5.182 12.244
193 HZ3 LYS 44 2HZ LYS 44 13.048 -5.383 10.695
194 H GLY 45 H GLY 45 7.722 -5.157 7.410
195 HA2 GLY 45 2HA GLY 45 4.799 -4.963 7.686
196 HA3 GLY 45 1HA GLY 45 5.538 -3.836 6.559
197 H ASP 46 H ASP 46 6.286 -4.596 4.616
198 HA ASP 46 HA ASP 46 5.266 -7.202 3.749
199 HB2 ASP 46 2HB ASP 46 6.927 -5.720 1.842
200 HB3 ASP 46 1HB ASP 46 5.250 -6.235 1.710
201 H GLY 47 H GLY 47 7.077 -7.793 5.573
202 HA2 GLY 47 2HA GLY 47 9.453 -8.693 3.996
203 HA3 GLY 47 1HA GLY 47 9.630 -8.084 5.645
204 H VAL 48 H VAL 48 8.458 -9.225 7.309
205 HA VAL 48 HA VAL 48 8.927 -11.971 7.467
206 HB VAL 48 HB VAL 48 8.580 -10.932 9.521
207 HG11 VAL 48 1HG1 VAL 48 6.718 -9.257 7.962
208 HG12 VAL 48 2HG1 VAL 48 7.834 -8.802 9.251
209 HG13 VAL 48 3HG1 VAL 48 6.270 -9.516 9.647
210 HG21 VAL 48 3HG2 VAL 48 5.732 -11.646 8.906
211 HG22 VAL 48 1HG2 VAL 48 6.510 -11.612 10.486
212 HG23 VAL 48 2HG2 VAL 48 6.969 -12.840 9.303
213 H LYS 49 H LYS 49 5.958 -10.248 6.578
214 HA LYS 49 HA LYS 49 4.034 -12.153 6.516
215 HB2 LYS 49 2HB LYS 49 3.367 -10.913 4.320
216 HB3 LYS 49 1HB LYS 49 3.491 -10.003 5.821
217 HG2 LYS 49 2HG LYS 49 5.130 -8.718 4.984
218 HG3 LYS 49 1HG LYS 49 6.063 -10.130 4.495
219 HD2 LYS 49 2HD LYS 49 5.524 -8.836 2.511
220 HD3 LYS 49 1HD LYS 49 4.592 -10.331 2.477
221 HE2 LYS 49 2HE LYS 49 3.194 -8.175 3.899
222 HE3 LYS 49 1HE LYS 49 3.520 -7.781 2.202
223 HZ1 LYS 49 3HZ LYS 49 2.789 -10.474 2.317
224 HZ2 LYS 49 1HZ LYS 49 1.928 -9.194 1.617
225 HZ3 LYS 49 2HZ LYS 49 1.651 -9.618 3.237
226 H TYR 50 H TYR 50 6.142 -11.696 3.588
227 HA TYR 50 HA TYR 50 5.287 -14.339 2.700
228 HB2 TYR 50 2HB TYR 50 6.452 -13.625 0.668
229 HB3 TYR 50 1HB TYR 50 5.286 -12.428 1.220
230 HD1 TYR 50 2HD TYR 50 8.897 -13.312 1.768
231 HD2 TYR 50 1HD TYR 50 5.950 -10.251 1.214
232 HE1 TYR 50 2HE TYR 50 10.687 -11.594 1.826
233 HE2 TYR 50 1HE TYR 50 7.732 -8.530 1.248
234 HH TYR 50 HH TYR 50 10.770 -9.004 0.722
235 H LYS 51 H LYS 51 8.172 -12.810 4.054
236 HA LYS 51 HA LYS 51 10.126 -14.680 3.308
237 HB2 LYS 51 2HB LYS 51 9.648 -12.680 5.374
238 HB3 LYS 51 1HB LYS 51 10.676 -13.988 5.938
239 HG2 LYS 51 2HG LYS 51 11.324 -13.008 3.233
240 HG3 LYS 51 1HG LYS 51 11.587 -11.835 4.526
241 HD2 LYS 51 2HD LYS 51 12.831 -13.679 5.773
242 HD3 LYS 51 1HD LYS 51 12.777 -14.603 4.270
243 HE2 LYS 51 2HE LYS 51 14.273 -13.201 3.193
244 HE3 LYS 51 1HE LYS 51 13.769 -11.779 4.129
245 HZ1 LYS 51 3HZ LYS 51 14.742 -12.824 6.110
246 HZ2 LYS 51 1HZ LYS 51 15.908 -12.534 4.913
247 HZ3 LYS 51 2HZ LYS 51 15.310 -14.106 5.151
248 H ALA 52 H ALA 52 7.891 -14.765 5.968
249 HA ALA 52 HA ALA 52 8.685 -17.278 7.036
250 HB1 ALA 52 1HB ALA 52 7.272 -15.216 7.925
251 HB2 ALA 52 2HB ALA 52 7.005 -16.837 8.569
252 HB3 ALA 52 3HB ALA 52 5.933 -16.195 7.325
253 H LYS 53 H LYS 53 5.935 -16.259 5.195
254 HA LYS 53 HA LYS 53 4.667 -18.723 4.771
255 HB2 LYS 53 2HB LYS 53 4.812 -16.070 3.361
256 HB3 LYS 53 1HB LYS 53 3.786 -17.357 2.742
257 HG2 LYS 53 2HG LYS 53 2.949 -17.501 5.233
258 HG3 LYS 53 1HG LYS 53 3.577 -15.856 5.329
259 HD2 LYS 53 2HD LYS 53 2.120 -15.091 3.601
260 HD3 LYS 53 1HD LYS 53 1.689 -16.738 3.138
261 HE2 LYS 53 2HE LYS 53 0.821 -16.933 5.611
262 HE3 LYS 53 1HE LYS 53 0.792 -15.160 5.541
263 HZ1 LYS 53 3HZ LYS 53 -0.611 -17.088 3.787
264 HZ2 LYS 53 1HZ LYS 53 -0.340 -15.484 3.302
265 HZ3 LYS 53 2HZ LYS 53 -1.272 -15.807 4.685
266 H LEU 54 H LEU 54 6.899 -17.015 2.479
267 HA LEU 54 HA LEU 54 6.942 -18.841 0.432
268 HB2 LEU 54 2HB LEU 54 9.011 -17.108 1.701
269 HB3 LEU 54 1HB LEU 54 9.220 -17.882 0.120
270 HG LEU 54 HG LEU 54 6.988 -16.031 0.934
271 HD11 LEU 54 1HD1 LEU 54 9.498 -15.436 0.129
272 HD12 LEU 54 2HD1 LEU 54 8.093 -14.414 -0.177
273 HD13 LEU 54 3HD1 LEU 54 8.662 -15.530 -1.421
274 HD21 LEU 54 3HD2 LEU 54 7.332 -17.931 -1.335
275 HD22 LEU 54 1HD2 LEU 54 6.576 -16.374 -1.675
276 HD23 LEU 54 2HD2 LEU 54 5.866 -17.457 -0.478
277 H ILE 55 H ILE 55 8.434 -19.040 3.564
278 HA ILE 55 HA ILE 55 10.239 -21.145 3.061
279 HB ILE 55 HB ILE 55 9.235 -19.312 5.052
280 HG12 ILE 55 2HG1 ILE 55 11.401 -18.921 5.466
281 HG13 ILE 55 1HG1 ILE 55 11.907 -20.589 5.189
282 HG21 ILE 55 1HG2 ILE 55 10.166 -20.760 6.911
283 HG22 ILE 55 2HG2 ILE 55 9.790 -22.093 5.814
284 HG23 ILE 55 3HG2 ILE 55 8.512 -20.998 6.347
285 HD11 ILE 55 3HD1 ILE 55 10.803 -18.940 2.932
286 HD12 ILE 55 1HD1 ILE 55 11.924 -20.301 2.866
287 HD13 ILE 55 2HD1 ILE 55 12.483 -18.723 3.421
288 H GLY 56 H GLY 56 7.193 -20.965 4.878
289 HA2 GLY 56 2HA GLY 56 5.430 -22.641 4.528
290 HA3 GLY 56 1HA GLY 56 6.717 -23.773 4.244
291 H ILE 57 H ILE 57 6.192 -21.448 6.784
292 HA ILE 57 HA ILE 57 7.138 -23.093 8.850
293 HB ILE 57 HB ILE 57 6.431 -21.110 10.136
294 HG12 ILE 57 2HG1 ILE 57 5.767 -19.637 7.663
295 HG13 ILE 57 1HG1 ILE 57 4.548 -20.815 8.147
296 HG21 ILE 57 1HG2 ILE 57 8.296 -20.054 9.397
297 HG22 ILE 57 2HG2 ILE 57 7.698 -19.974 7.740
298 HG23 ILE 57 3HG2 ILE 57 8.446 -21.455 8.336
299 HD11 ILE 57 3HD1 ILE 57 4.650 -19.809 10.473
300 HD12 ILE 57 1HD1 ILE 57 3.985 -18.745 9.233
301 HD13 ILE 57 2HD1 ILE 57 5.643 -18.520 9.791
302 H ASP 58 H ASP 58 4.686 -21.679 10.056
303 HA ASP 58 HA ASP 58 3.225 -23.679 11.188
304 HB2 ASP 58 2HB ASP 58 2.958 -21.111 11.266
305 HB3 ASP 58 1HB ASP 58 1.853 -21.313 9.898
Start of MODEL 6
1 H SER 24 H SER 24 -2.514 13.317 22.997
2 HA SER 24 HA SER 24 -1.721 15.579 21.431
3 HB2 SER 24 2HB SER 24 0.575 14.635 20.799
4 HB3 SER 24 1HB SER 24 0.454 15.345 22.406
5 HG SER 24 HG SER 24 -0.057 12.605 21.975
6 H LYS 25 H LYS 25 -3.764 14.141 20.788
7 HA LYS 25 HA LYS 25 -3.770 11.661 19.616
8 HB2 LYS 25 2HB LYS 25 -5.325 13.977 19.586
9 HB3 LYS 25 1HB LYS 25 -5.006 13.659 17.880
10 HG2 LYS 25 2HG LYS 25 -6.138 11.674 19.875
11 HG3 LYS 25 1HG LYS 25 -7.041 12.482 18.594
12 HD2 LYS 25 2HD LYS 25 -5.583 11.421 16.902
13 HD3 LYS 25 1HD LYS 25 -4.697 10.601 18.187
14 HE2 LYS 25 2HE LYS 25 -7.695 10.293 17.890
15 HE3 LYS 25 1HE LYS 25 -6.550 9.225 17.053
16 HZ1 LYS 25 3HZ LYS 25 -7.206 8.438 19.311
17 HZ2 LYS 25 1HZ LYS 25 -6.442 9.803 19.964
18 HZ3 LYS 25 2HZ LYS 25 -5.533 8.650 19.110
19 H LYS 26 H LYS 26 -2.941 14.636 17.780
20 HA LYS 26 HA LYS 26 -1.657 14.882 15.806
21 HB2 LYS 26 2HB LYS 26 -0.332 13.297 17.838
22 HB3 LYS 26 1HB LYS 26 0.221 12.821 16.233
23 HG2 LYS 26 2HG LYS 26 0.523 15.312 15.749
24 HG3 LYS 26 1HG LYS 26 0.294 15.575 17.479
25 HD2 LYS 26 2HD LYS 26 2.470 13.953 16.137
26 HD3 LYS 26 1HD LYS 26 2.664 15.407 17.115
27 HE2 LYS 26 2HE LYS 26 2.996 14.005 18.877
28 HE3 LYS 26 1HE LYS 26 1.259 13.648 18.786
29 HZ1 LYS 26 3HZ LYS 26 1.851 12.035 16.972
30 HZ2 LYS 26 1HZ LYS 26 2.364 11.589 18.525
31 HZ3 LYS 26 2HZ LYS 26 3.478 12.232 17.416
32 H GLU 27 H GLU 27 -0.580 13.357 13.973
33 HA GLU 27 HA GLU 27 -2.592 11.986 12.621
34 HB2 GLU 27 2HB GLU 27 -0.050 12.756 12.131
35 HB3 GLU 27 1HB GLU 27 0.210 11.024 12.337
36 HG2 GLU 27 2HG GLU 27 -0.806 10.529 10.376
37 HG3 GLU 27 1HG GLU 27 -2.132 11.651 10.685
38 H LYS 28 H LYS 28 -1.933 9.435 12.002
39 HA LYS 28 HA LYS 28 -2.963 7.741 13.895
40 HB2 LYS 28 2HB LYS 28 -1.907 6.008 12.628
41 HB3 LYS 28 1HB LYS 28 -2.147 7.341 11.499
42 HG2 LYS 28 2HG LYS 28 0.060 7.348 11.084
43 HG3 LYS 28 1HG LYS 28 0.350 7.793 12.765
44 HD2 LYS 28 2HD LYS 28 1.490 5.804 12.786
45 HD3 LYS 28 1HD LYS 28 -0.123 5.148 13.074
46 HE2 LYS 28 2HE LYS 28 -0.408 4.817 10.620
47 HE3 LYS 28 1HE LYS 28 1.251 5.397 10.372
48 HZ1 LYS 28 3HZ LYS 28 0.349 2.862 11.360
49 HZ2 LYS 28 1HZ LYS 28 1.468 3.590 12.406
50 HZ3 LYS 28 2HZ LYS 28 1.881 3.311 10.783
51 H LYS 29 H LYS 29 -1.855 6.178 15.395
52 HA LYS 29 HA LYS 29 -0.184 7.470 17.272
53 HB2 LYS 29 2HB LYS 29 -1.807 5.553 17.575
54 HB3 LYS 29 1HB LYS 29 -0.583 4.503 16.859
55 HG2 LYS 29 2HG LYS 29 0.977 4.982 18.630
56 HG3 LYS 29 1HG LYS 29 -0.063 6.254 19.276
57 HD2 LYS 29 2HD LYS 29 -1.748 4.060 19.212
58 HD3 LYS 29 1HD LYS 29 -0.201 3.352 19.678
59 HE2 LYS 29 2HE LYS 29 -1.170 4.007 21.748
60 HE3 LYS 29 1HE LYS 29 -0.064 5.342 21.370
61 HZ1 LYS 29 3HZ LYS 29 -2.019 6.325 20.111
62 HZ2 LYS 29 1HZ LYS 29 -2.103 6.377 21.803
63 HZ3 LYS 29 2HZ LYS 29 -2.991 5.208 20.947
64 H LYS 30 H LYS 30 1.350 7.990 15.129
65 HA LYS 30 HA LYS 30 3.172 6.163 14.108
66 HB2 LYS 30 2HB LYS 30 4.475 8.119 13.632
67 HB3 LYS 30 1HB LYS 30 2.788 8.630 13.624
68 HG2 LYS 30 2HG LYS 30 2.965 9.612 15.786
69 HG3 LYS 30 1HG LYS 30 4.513 8.829 16.099
70 HD2 LYS 30 2HD LYS 30 4.864 11.188 15.524
71 HD3 LYS 30 1HD LYS 30 5.538 10.149 14.269
72 HE2 LYS 30 2HE LYS 30 3.222 10.413 13.104
73 HE3 LYS 30 1HE LYS 30 3.024 11.814 14.177
74 HZ1 LYS 30 3HZ LYS 30 5.300 12.509 13.456
75 HZ2 LYS 30 1HZ LYS 30 4.121 12.593 12.239
76 HZ3 LYS 30 2HZ LYS 30 5.230 11.306 12.258
77 H GLY 31 H GLY 31 5.256 5.450 14.798
78 HA2 GLY 31 2HA GLY 31 5.586 4.749 17.485
79 HA3 GLY 31 1HA GLY 31 6.888 4.770 16.307
80 HA PRO 32 HA PRO 32 7.924 7.887 19.502
81 HB2 PRO 32 2HB PRO 32 10.580 7.311 19.455
82 HB3 PRO 32 1HB PRO 32 9.403 6.473 20.495
83 HG2 PRO 32 2HG PRO 32 10.517 5.658 17.869
84 HG3 PRO 32 1HG PRO 32 10.248 4.696 19.328
85 HD2 PRO 32 2HD PRO 32 8.574 4.584 17.230
86 HD3 PRO 32 1HD PRO 32 7.991 4.447 18.906
87 H GLU 33 H GLU 33 10.277 9.263 19.140
88 HA GLU 33 HA GLU 33 9.729 10.716 16.708
89 HB2 GLU 33 2HB GLU 33 10.359 12.369 18.132
90 HB3 GLU 33 1HB GLU 33 10.671 11.087 19.308
91 HG2 GLU 33 2HG GLU 33 12.727 12.182 19.208
92 HG3 GLU 33 1HG GLU 33 12.956 10.832 18.102
93 H LYS 34 H LYS 34 11.222 8.104 17.112
94 HA LYS 34 HA LYS 34 13.848 8.247 16.116
95 HB2 LYS 34 2HB LYS 34 11.770 6.425 16.789
96 HB3 LYS 34 1HB LYS 34 12.490 5.917 15.287
97 HG2 LYS 34 2HG LYS 34 14.063 6.648 17.754
98 HG3 LYS 34 1HG LYS 34 13.607 4.993 17.351
99 HD2 LYS 34 2HD LYS 34 15.379 4.828 15.970
100 HD3 LYS 34 1HD LYS 34 14.785 6.200 15.034
101 HE2 LYS 34 2HE LYS 34 16.753 7.160 15.755
102 HE3 LYS 34 1HE LYS 34 15.791 7.500 17.208
103 HZ1 LYS 34 3HZ LYS 34 17.596 5.202 16.717
104 HZ2 LYS 34 1HZ LYS 34 16.432 5.190 17.950
105 HZ3 LYS 34 2HZ LYS 34 17.677 6.346 17.971
106 H THR 35 H THR 35 14.542 7.666 13.848
107 HA THR 35 HA THR 35 12.566 7.756 11.744
108 HB THR 35 HB THR 35 14.365 9.897 11.246
109 HG1 THR 35 1HG THR 35 14.456 10.797 13.118
110 HG21 THR 35 3HG2 THR 35 11.471 9.355 11.299
111 HG22 THR 35 1HG2 THR 35 12.432 10.210 10.091
112 HG23 THR 35 2HG2 THR 35 11.917 11.043 11.558
113 H ASP 36 H ASP 36 15.929 7.643 12.691
114 HA ASP 36 HA ASP 36 16.736 6.837 9.952
115 HB2 ASP 36 2HB ASP 36 18.001 7.920 12.385
116 HB3 ASP 36 1HB ASP 36 18.983 6.764 11.486
117 H GLU 37 H GLU 37 17.684 5.680 13.100
118 HA GLU 37 HA GLU 37 18.173 3.006 12.263
119 HB2 GLU 37 2HB GLU 37 17.931 4.555 14.785
120 HB3 GLU 37 1HB GLU 37 17.763 2.805 14.930
121 HG2 GLU 37 2HG GLU 37 20.022 3.853 13.278
122 HG3 GLU 37 1HG GLU 37 20.159 3.977 15.032
123 H TYR 38 H TYR 38 15.337 4.732 12.876
124 HA TYR 38 HA TYR 38 13.664 2.523 13.712
125 HB2 TYR 38 2HB TYR 38 12.315 4.232 14.280
126 HB3 TYR 38 1HB TYR 38 13.684 5.253 13.884
127 HD1 TYR 38 1HD TYR 38 13.817 5.286 11.009
128 HD2 TYR 38 2HD TYR 38 10.387 5.228 13.571
129 HE1 TYR 38 1HE TYR 38 12.470 6.355 9.224
130 HE2 TYR 38 2HE TYR 38 9.029 6.304 11.800
131 HH TYR 38 HH TYR 38 9.090 7.307 9.795
132 H LEU 39 H LEU 39 14.715 3.745 10.640
133 HA LEU 39 HA LEU 39 12.628 3.110 8.922
134 HB2 LEU 39 2HB LEU 39 15.550 3.263 8.874
135 HB3 LEU 39 1HB LEU 39 14.914 2.128 7.690
136 HG LEU 39 HG LEU 39 14.944 4.184 6.549
137 HD11 LEU 39 1HD1 LEU 39 12.779 4.308 5.869
138 HD12 LEU 39 2HD1 LEU 39 12.183 4.570 7.508
139 HD13 LEU 39 3HD1 LEU 39 12.567 2.939 6.959
140 HD21 LEU 39 3HD2 LEU 39 15.438 5.746 8.239
141 HD22 LEU 39 1HD2 LEU 39 14.014 5.300 9.178
142 HD23 LEU 39 2HD2 LEU 39 13.833 6.227 7.689
143 H LEU 40 H LEU 40 15.233 0.913 9.990
144 HA LEU 40 HA LEU 40 14.166 -1.470 8.915
145 HB2 LEU 40 2HB LEU 40 16.012 -0.686 11.150
146 HB3 LEU 40 1HB LEU 40 15.623 -2.388 10.892
147 HG LEU 40 HG LEU 40 17.701 -1.428 9.681
148 HD11 LEU 40 1HD1 LEU 40 16.451 -2.584 7.454
149 HD12 LEU 40 2HD1 LEU 40 15.617 -3.277 8.845
150 HD13 LEU 40 3HD1 LEU 40 17.368 -3.435 8.699
151 HD21 LEU 40 3HD2 LEU 40 15.461 -0.308 7.964
152 HD22 LEU 40 1HD2 LEU 40 17.151 -0.398 7.469
153 HD23 LEU 40 2HD2 LEU 40 16.683 0.627 8.826
154 H ALA 41 H ALA 41 13.354 0.344 11.778
155 HA ALA 41 HA ALA 41 12.072 -1.591 13.345
156 HB1 ALA 41 1HB ALA 41 12.510 1.024 13.557
157 HB2 ALA 41 2HB ALA 41 11.179 0.275 14.437
158 HB3 ALA 41 3HB ALA 41 10.868 1.125 12.923
159 H ARG 42 H ARG 42 10.979 0.182 10.496
160 HA ARG 42 HA ARG 42 8.367 -1.061 10.489
161 HB2 ARG 42 2HB ARG 42 9.838 0.977 8.851
162 HB3 ARG 42 1HB ARG 42 8.238 0.404 8.381
163 HG2 ARG 42 2HG ARG 42 8.697 1.357 11.191
164 HG3 ARG 42 1HG ARG 42 8.458 2.539 9.905
165 HD2 ARG 42 2HD ARG 42 6.553 0.222 10.358
166 HD3 ARG 42 1HD ARG 42 6.321 1.823 11.088
167 HE ARG 42 HE ARG 42 6.825 2.332 8.391
168 HH11 ARG 42 1HH2 ARG 42 4.267 1.784 10.460
169 HH12 ARG 42 2HH2 ARG 42 3.114 1.386 9.229
170 HH21 ARG 42 1HH1 ARG 42 5.471 1.265 6.690
171 HH22 ARG 42 2HH1 ARG 42 3.795 1.094 7.095
172 H PHE 43 H PHE 43 11.456 -1.595 9.098
173 HA PHE 43 HA PHE 43 11.097 -2.699 6.607
174 HB2 PHE 43 2HB PHE 43 12.860 -3.044 8.911
175 HB3 PHE 43 1HB PHE 43 12.778 -4.480 7.903
176 HD1 PHE 43 2HD PHE 43 12.693 -0.796 7.235
177 HD2 PHE 43 1HD PHE 43 14.555 -4.576 6.409
178 HE1 PHE 43 2HE PHE 43 14.189 0.302 5.588
179 HE2 PHE 43 1HE PHE 43 16.054 -3.478 4.762
180 HZ PHE 43 HZ PHE 43 15.870 -1.039 4.352
181 H LYS 44 H LYS 44 9.866 -3.998 9.624
182 HA LYS 44 HA LYS 44 9.454 -6.640 8.733
183 HB2 LYS 44 2HB LYS 44 8.568 -4.913 10.990
184 HB3 LYS 44 1HB LYS 44 7.892 -6.537 10.813
185 HG2 LYS 44 2HG LYS 44 9.900 -6.556 12.241
186 HG3 LYS 44 1HG LYS 44 10.151 -7.480 10.762
187 HD2 LYS 44 2HD LYS 44 11.482 -5.795 9.796
188 HD3 LYS 44 1HD LYS 44 10.934 -4.583 10.954
189 HE2 LYS 44 2HE LYS 44 12.146 -6.846 12.326
190 HE3 LYS 44 1HE LYS 44 13.273 -6.105 11.171
191 HZ1 LYS 44 3HZ LYS 44 13.269 -4.952 13.329
192 HZ2 LYS 44 1HZ LYS 44 11.620 -4.605 13.134
193 HZ3 LYS 44 2HZ LYS 44 12.758 -3.940 12.063
194 H GLY 45 H GLY 45 8.155 -4.165 7.353
195 HA2 GLY 45 2HA GLY 45 5.312 -4.662 7.454
196 HA3 GLY 45 1HA GLY 45 6.128 -3.629 6.294
197 H ASP 46 H ASP 46 7.069 -4.615 4.463
198 HA ASP 46 HA ASP 46 5.608 -7.014 3.548
199 HB2 ASP 46 2HB ASP 46 7.391 -5.843 1.588
200 HB3 ASP 46 1HB ASP 46 5.635 -5.951 1.568
201 H GLY 47 H GLY 47 7.273 -7.936 5.326
202 HA2 GLY 47 2HA GLY 47 9.465 -9.162 3.728
203 HA3 GLY 47 1HA GLY 47 9.845 -8.456 5.301
204 H VAL 48 H VAL 48 8.648 -9.308 7.134
205 HA VAL 48 HA VAL 48 8.855 -12.055 7.504
206 HB VAL 48 HB VAL 48 8.743 -10.809 9.467
207 HG11 VAL 48 1HG1 VAL 48 6.949 -9.115 7.870
208 HG12 VAL 48 2HG1 VAL 48 8.138 -8.661 9.090
209 HG13 VAL 48 3HG1 VAL 48 6.536 -9.212 9.580
210 HG21 VAL 48 3HG2 VAL 48 6.638 -11.169 10.596
211 HG22 VAL 48 1HG2 VAL 48 7.032 -12.583 9.618
212 HG23 VAL 48 2HG2 VAL 48 5.830 -11.423 9.046
213 H LYS 49 H LYS 49 5.952 -10.155 6.713
214 HA LYS 49 HA LYS 49 3.925 -11.964 6.867
215 HB2 LYS 49 2HB LYS 49 3.194 -10.763 4.646
216 HB3 LYS 49 1HB LYS 49 3.391 -9.836 6.129
217 HG2 LYS 49 2HG LYS 49 5.104 -8.649 5.278
218 HG3 LYS 49 1HG LYS 49 5.888 -10.086 4.630
219 HD2 LYS 49 2HD LYS 49 5.299 -8.739 2.738
220 HD3 LYS 49 1HD LYS 49 4.127 -10.058 2.786
221 HE2 LYS 49 2HE LYS 49 2.712 -8.377 4.246
222 HE3 LYS 49 1HE LYS 49 3.728 -7.153 3.453
223 HZ1 LYS 49 3HZ LYS 49 2.285 -9.322 2.022
224 HZ2 LYS 49 1HZ LYS 49 3.164 -8.054 1.319
225 HZ3 LYS 49 2HZ LYS 49 1.721 -7.725 2.153
226 H TYR 50 H TYR 50 5.850 -11.690 3.789
227 HA TYR 50 HA TYR 50 4.858 -14.336 3.041
228 HB2 TYR 50 2HB TYR 50 5.933 -13.697 0.920
229 HB3 TYR 50 1HB TYR 50 4.797 -12.482 1.495
230 HD1 TYR 50 1HD TYR 50 8.418 -13.392 1.793
231 HD2 TYR 50 2HD TYR 50 5.464 -10.300 1.526
232 HE1 TYR 50 1HE TYR 50 10.224 -11.683 1.734
233 HE2 TYR 50 2HE TYR 50 7.253 -8.586 1.470
234 HH TYR 50 HH TYR 50 9.442 -8.210 1.444
235 H LYS 51 H LYS 51 7.819 -12.807 4.190
236 HA LYS 51 HA LYS 51 9.780 -14.591 3.382
237 HB2 LYS 51 2HB LYS 51 9.221 -12.901 5.753
238 HB3 LYS 51 1HB LYS 51 10.535 -14.056 5.885
239 HG2 LYS 51 2HG LYS 51 10.407 -12.452 3.394
240 HG3 LYS 51 1HG LYS 51 10.920 -11.618 4.861
241 HD2 LYS 51 2HD LYS 51 12.296 -14.058 4.911
242 HD3 LYS 51 1HD LYS 51 12.382 -13.530 3.230
243 HE2 LYS 51 2HE LYS 51 13.061 -11.219 4.177
244 HE3 LYS 51 1HE LYS 51 13.369 -12.084 5.695
245 HZ1 LYS 51 3HZ LYS 51 14.409 -13.651 3.650
246 HZ2 LYS 51 1HZ LYS 51 15.274 -12.792 4.830
247 HZ3 LYS 51 2HZ LYS 51 14.929 -12.065 3.335
248 H ALA 52 H ALA 52 7.654 -14.854 6.125
249 HA ALA 52 HA ALA 52 8.468 -17.366 7.097
250 HB1 ALA 52 1HB ALA 52 6.248 -17.290 8.213
251 HB2 ALA 52 2HB ALA 52 5.807 -15.952 7.152
252 HB3 ALA 52 3HB ALA 52 7.105 -15.752 8.330
253 H LYS 53 H LYS 53 5.719 -16.518 5.145
254 HA LYS 53 HA LYS 53 4.757 -19.089 4.550
255 HB2 LYS 53 2HB LYS 53 4.618 -16.348 3.355
256 HB3 LYS 53 1HB LYS 53 3.875 -17.695 2.501
257 HG2 LYS 53 2HG LYS 53 3.271 -17.754 5.345
258 HG3 LYS 53 1HG LYS 53 2.729 -16.256 4.586
259 HD2 LYS 53 2HD LYS 53 2.184 -18.757 3.078
260 HD3 LYS 53 1HD LYS 53 1.258 -18.528 4.562
261 HE2 LYS 53 2HE LYS 53 1.200 -16.016 3.303
262 HE3 LYS 53 1HE LYS 53 0.937 -17.194 2.002
263 HZ1 LYS 53 3HZ LYS 53 -1.118 -16.588 3.248
264 HZ2 LYS 53 1HZ LYS 53 -0.441 -17.301 4.629
265 HZ3 LYS 53 2HZ LYS 53 -0.768 -18.250 3.258
266 H LEU 54 H LEU 54 6.843 -16.995 2.455
267 HA LEU 54 HA LEU 54 7.226 -18.705 0.345
268 HB2 LEU 54 2HB LEU 54 8.993 -16.768 1.770
269 HB3 LEU 54 1HB LEU 54 9.349 -17.422 0.162
270 HG LEU 54 HG LEU 54 6.912 -15.875 1.005
271 HD11 LEU 54 1HD1 LEU 54 8.440 -15.157 -1.383
272 HD12 LEU 54 2HD1 LEU 54 9.347 -15.037 0.126
273 HD13 LEU 54 3HD1 LEU 54 7.844 -14.134 -0.075
274 HD21 LEU 54 3HD2 LEU 54 6.401 -16.204 -1.550
275 HD22 LEU 54 1HD2 LEU 54 5.969 -17.472 -0.402
276 HD23 LEU 54 2HD2 LEU 54 7.432 -17.625 -1.373
277 H ILE 55 H ILE 55 8.591 -18.823 3.536
278 HA ILE 55 HA ILE 55 10.666 -20.675 3.068
279 HB ILE 55 HB ILE 55 9.349 -19.040 5.055
280 HG12 ILE 55 2HG1 ILE 55 11.425 -18.371 5.557
281 HG13 ILE 55 1HG1 ILE 55 12.153 -19.958 5.305
282 HG21 ILE 55 1HG2 ILE 55 10.249 -21.744 5.778
283 HG22 ILE 55 2HG2 ILE 55 8.799 -20.861 6.260
284 HG23 ILE 55 3HG2 ILE 55 10.373 -20.406 6.920
285 HD11 ILE 55 3HD1 ILE 55 12.366 -19.616 3.028
286 HD12 ILE 55 1HD1 ILE 55 12.488 -17.943 3.571
287 HD13 ILE 55 2HD1 ILE 55 10.955 -18.560 2.954
288 H GLY 56 H GLY 56 7.562 -20.931 4.779
289 HA2 GLY 56 2HA GLY 56 6.090 -22.866 4.095
290 HA3 GLY 56 1HA GLY 56 7.556 -23.792 4.205
291 H ILE 57 H ILE 57 6.211 -21.386 6.344
292 HA ILE 57 HA ILE 57 6.875 -22.762 8.700
293 HB ILE 57 HB ILE 57 5.725 -20.793 9.637
294 HG12 ILE 57 2HG1 ILE 57 5.439 -19.628 6.921
295 HG13 ILE 57 1HG1 ILE 57 4.232 -20.838 7.352
296 HG21 ILE 57 1HG2 ILE 57 7.273 -19.467 7.623
297 HG22 ILE 57 2HG2 ILE 57 8.035 -21.003 8.034
298 HG23 ILE 57 3HG2 ILE 57 7.710 -19.817 9.297
299 HD11 ILE 57 3HD1 ILE 57 4.298 -18.118 8.143
300 HD12 ILE 57 1HD1 ILE 57 4.649 -19.069 9.586
301 HD13 ILE 57 2HD1 ILE 57 3.168 -19.363 8.675
302 H ASP 58 H ASP 58 4.101 -21.564 9.269
303 HA ASP 58 HA ASP 58 2.047 -22.492 10.049
304 HB2 ASP 58 2HB ASP 58 1.445 -22.123 7.787
305 HB3 ASP 58 1HB ASP 58 2.499 -23.421 7.210
Start of MODEL 7
1 H SER 24 H SER 24 -8.242 -8.219 -9.250
2 HA SER 24 HA SER 24 -7.293 -7.833 -11.924
3 HB2 SER 24 2HB SER 24 -5.667 -6.048 -11.553
4 HB3 SER 24 1HB SER 24 -7.268 -5.464 -11.104
5 HG SER 24 HG SER 24 -5.542 -5.050 -9.553
6 H LYS 25 H LYS 25 -7.344 -9.991 -10.124
7 HA LYS 25 HA LYS 25 -5.947 -11.670 -9.221
8 HB2 LYS 25 2HB LYS 25 -5.018 -10.982 -11.602
9 HB3 LYS 25 1HB LYS 25 -3.671 -10.341 -10.659
10 HG2 LYS 25 2HG LYS 25 -2.832 -12.417 -10.451
11 HG3 LYS 25 1HG LYS 25 -4.303 -12.921 -9.618
12 HD2 LYS 25 2HD LYS 25 -5.075 -12.804 -12.288
13 HD3 LYS 25 1HD LYS 25 -3.445 -13.475 -12.355
14 HE2 LYS 25 2HE LYS 25 -4.643 -15.433 -11.988
15 HE3 LYS 25 1HE LYS 25 -4.398 -14.937 -10.302
16 HZ1 LYS 25 3HZ LYS 25 -6.482 -13.724 -10.382
17 HZ2 LYS 25 1HZ LYS 25 -6.745 -15.356 -10.763
18 HZ3 LYS 25 2HZ LYS 25 -6.723 -14.189 -11.998
19 H LYS 26 H LYS 26 -3.985 -11.977 -7.787
20 HA LYS 26 HA LYS 26 -3.899 -10.216 -5.623
21 HB2 LYS 26 2HB LYS 26 -2.344 -12.462 -6.717
22 HB3 LYS 26 1HB LYS 26 -1.417 -11.410 -5.645
23 HG2 LYS 26 2HG LYS 26 -4.136 -12.538 -4.931
24 HG3 LYS 26 1HG LYS 26 -2.614 -13.300 -4.469
25 HD2 LYS 26 2HD LYS 26 -2.044 -10.879 -3.567
26 HD3 LYS 26 1HD LYS 26 -3.801 -10.714 -3.529
27 HE2 LYS 26 2HE LYS 26 -4.019 -12.169 -1.776
28 HE3 LYS 26 1HE LYS 26 -2.759 -13.252 -2.400
29 HZ1 LYS 26 3HZ LYS 26 -1.274 -11.155 -1.894
30 HZ2 LYS 26 1HZ LYS 26 -1.612 -12.303 -0.692
31 HZ3 LYS 26 2HZ LYS 26 -2.490 -10.850 -0.747
32 H GLU 27 H GLU 27 -1.670 -9.146 -4.937
33 HA GLU 27 HA GLU 27 -0.169 -7.362 -5.266
34 HB2 GLU 27 2HB GLU 27 0.997 -9.010 -6.563
35 HB3 GLU 27 1HB GLU 27 -0.127 -8.830 -7.908
36 HG2 GLU 27 2HG GLU 27 1.189 -7.223 -8.769
37 HG3 GLU 27 1HG GLU 27 0.913 -6.246 -7.327
38 H LYS 28 H LYS 28 -0.900 -5.294 -5.387
39 HA LYS 28 HA LYS 28 -3.127 -4.320 -6.740
40 HB2 LYS 28 2HB LYS 28 -1.415 -3.344 -4.975
41 HB3 LYS 28 1HB LYS 28 -0.655 -2.644 -6.403
42 HG2 LYS 28 2HG LYS 28 -2.360 -1.155 -5.265
43 HG3 LYS 28 1HG LYS 28 -2.657 -1.442 -6.978
44 HD2 LYS 28 2HD LYS 28 -4.408 -2.974 -6.534
45 HD3 LYS 28 1HD LYS 28 -3.920 -3.172 -4.851
46 HE2 LYS 28 2HE LYS 28 -5.755 -1.713 -4.656
47 HE3 LYS 28 1HE LYS 28 -4.399 -0.570 -4.724
48 HZ1 LYS 28 3HZ LYS 28 -5.646 0.234 -6.438
49 HZ2 LYS 28 1HZ LYS 28 -6.341 -1.271 -6.801
50 HZ3 LYS 28 2HZ LYS 28 -4.750 -0.931 -7.293
51 H LYS 29 H LYS 29 -2.830 -2.446 -8.501
52 HA LYS 29 HA LYS 29 -2.481 -3.400 -11.026
53 HB2 LYS 29 2HB LYS 29 -2.944 -1.000 -9.926
54 HB3 LYS 29 1HB LYS 29 -1.280 -0.729 -10.441
55 HG2 LYS 29 2HG LYS 29 -1.809 -0.817 -12.669
56 HG3 LYS 29 1HG LYS 29 -3.084 -2.010 -12.426
57 HD2 LYS 29 2HD LYS 29 -4.202 0.014 -13.029
58 HD3 LYS 29 1HD LYS 29 -4.417 -0.150 -11.286
59 HE2 LYS 29 2HE LYS 29 -1.946 1.277 -12.010
60 HE3 LYS 29 1HE LYS 29 -3.425 2.110 -12.527
61 HZ1 LYS 29 3HZ LYS 29 -3.495 0.870 -9.897
62 HZ2 LYS 29 1HZ LYS 29 -4.153 2.345 -10.416
63 HZ3 LYS 29 2HZ LYS 29 -2.499 2.239 -10.040
64 H LYS 30 H LYS 30 -0.689 -3.263 -12.603
65 HA LYS 30 HA LYS 30 1.637 -4.602 -12.027
66 HB2 LYS 30 2HB LYS 30 0.707 -2.640 -14.028
67 HB3 LYS 30 1HB LYS 30 2.459 -2.810 -13.931
68 HG2 LYS 30 2HG LYS 30 0.610 -5.195 -14.120
69 HG3 LYS 30 1HG LYS 30 1.272 -4.395 -15.547
70 HD2 LYS 30 2HD LYS 30 3.464 -5.024 -15.050
71 HD3 LYS 30 1HD LYS 30 3.118 -5.241 -13.334
72 HE2 LYS 30 2HE LYS 30 2.208 -7.357 -13.644
73 HE3 LYS 30 1HE LYS 30 1.700 -7.005 -15.308
74 HZ1 LYS 30 3HZ LYS 30 4.556 -6.977 -14.570
75 HZ2 LYS 30 1HZ LYS 30 3.855 -7.189 -16.100
76 HZ3 LYS 30 2HZ LYS 30 3.788 -8.442 -14.954
77 H GLY 31 H GLY 31 2.514 -3.953 -9.956
78 HA2 GLY 31 2HA GLY 31 3.133 -1.378 -9.109
79 HA3 GLY 31 1HA GLY 31 4.049 -2.799 -8.628
80 HA PRO 32 HA PRO 32 6.736 0.026 -11.147
81 HB2 PRO 32 2HB PRO 32 8.787 0.092 -9.373
82 HB3 PRO 32 1HB PRO 32 7.429 1.243 -9.345
83 HG2 PRO 32 2HG PRO 32 7.848 -1.221 -7.745
84 HG3 PRO 32 1HG PRO 32 7.266 0.372 -7.236
85 HD2 PRO 32 2HD PRO 32 5.593 -1.696 -7.644
86 HD3 PRO 32 1HD PRO 32 5.128 -0.017 -8.011
87 H GLU 33 H GLU 33 9.379 -0.557 -11.298
88 HA GLU 33 HA GLU 33 9.383 -3.323 -12.157
89 HB2 GLU 33 2HB GLU 33 10.627 -2.363 -13.801
90 HB3 GLU 33 1HB GLU 33 10.348 -0.842 -12.946
91 HG2 GLU 33 2HG GLU 33 12.364 -1.054 -11.691
92 HG3 GLU 33 1HG GLU 33 12.612 -2.707 -12.249
93 H LYS 34 H LYS 34 9.794 -1.983 -9.450
94 HA LYS 34 HA LYS 34 12.303 -2.880 -8.414
95 HB2 LYS 34 2HB LYS 34 9.833 -1.572 -7.675
96 HB3 LYS 34 1HB LYS 34 10.515 -2.497 -6.379
97 HG2 LYS 34 2HG LYS 34 11.855 -0.315 -7.972
98 HG3 LYS 34 1HG LYS 34 11.428 -0.257 -6.262
99 HD2 LYS 34 2HD LYS 34 13.404 -1.188 -5.717
100 HD3 LYS 34 1HD LYS 34 13.040 -2.585 -6.730
101 HE2 LYS 34 2HE LYS 34 13.805 -1.217 -8.731
102 HE3 LYS 34 1HE LYS 34 14.401 -0.011 -7.574
103 HZ1 LYS 34 3HZ LYS 34 15.060 -2.871 -7.259
104 HZ2 LYS 34 1HZ LYS 34 15.864 -1.521 -6.620
105 HZ3 LYS 34 2HZ LYS 34 15.990 -1.879 -8.276
106 H THR 35 H THR 35 12.739 -4.861 -7.444
107 HA THR 35 HA THR 35 10.711 -6.585 -6.384
108 HB THR 35 HB THR 35 11.977 -7.974 -8.584
109 HG1 THR 35 1HG THR 35 11.773 -6.042 -9.651
110 HG21 THR 35 3HG2 THR 35 9.191 -7.601 -7.529
111 HG22 THR 35 1HG2 THR 35 10.176 -9.065 -7.532
112 HG23 THR 35 2HG2 THR 35 9.482 -8.464 -9.039
113 H ASP 36 H ASP 36 14.012 -6.092 -7.388
114 HA ASP 36 HA ASP 36 14.910 -8.369 -5.688
115 HB2 ASP 36 2HB ASP 36 15.665 -7.338 -8.198
116 HB3 ASP 36 1HB ASP 36 16.984 -6.936 -7.097
117 H GLU 37 H GLU 37 16.233 -5.229 -6.425
118 HA GLU 37 HA GLU 37 17.449 -4.832 -3.889
119 HB2 GLU 37 2HB GLU 37 16.674 -3.179 -6.263
120 HB3 GLU 37 1HB GLU 37 17.261 -2.361 -4.815
121 HG2 GLU 37 2HG GLU 37 19.394 -3.182 -5.051
122 HG3 GLU 37 1HG GLU 37 18.841 -4.698 -5.762
123 H TYR 38 H TYR 38 14.252 -4.667 -4.985
124 HA TYR 38 HA TYR 38 13.223 -2.741 -3.089
125 HB2 TYR 38 2HB TYR 38 11.508 -2.829 -4.555
126 HB3 TYR 38 1HB TYR 38 12.527 -3.891 -5.510
127 HD1 TYR 38 2HD TYR 38 12.551 -6.429 -4.217
128 HD2 TYR 38 1HD TYR 38 9.364 -3.575 -4.493
129 HE1 TYR 38 2HE TYR 38 10.885 -8.248 -3.894
130 HE2 TYR 38 1HE TYR 38 7.695 -5.383 -4.177
131 HH TYR 38 HH TYR 38 7.397 -7.608 -4.090
132 H LEU 39 H LEU 39 13.948 -6.119 -3.013
133 HA LEU 39 HA LEU 39 12.171 -7.256 -1.233
134 HB2 LEU 39 2HB LEU 39 15.011 -7.463 -1.934
135 HB3 LEU 39 1HB LEU 39 14.654 -8.042 -0.311
136 HG LEU 39 HG LEU 39 14.371 -9.922 -1.723
137 HD11 LEU 39 1HD1 LEU 39 11.523 -9.165 -1.774
138 HD12 LEU 39 2HD1 LEU 39 12.313 -9.010 -0.205
139 HD13 LEU 39 3HD1 LEU 39 12.302 -10.566 -1.038
140 HD21 LEU 39 3HD2 LEU 39 14.340 -8.670 -3.846
141 HD22 LEU 39 1HD2 LEU 39 12.696 -8.140 -3.497
142 HD23 LEU 39 2HD2 LEU 39 13.028 -9.847 -3.782
143 H LEU 40 H LEU 40 15.126 -5.476 -0.302
144 HA LEU 40 HA LEU 40 14.579 -5.350 2.476
145 HB2 LEU 40 2HB LEU 40 16.263 -3.869 0.479
146 HB3 LEU 40 1HB LEU 40 16.235 -3.345 2.163
147 HG LEU 40 HG LEU 40 18.037 -5.063 1.466
148 HD11 LEU 40 1HD1 LEU 40 16.206 -5.109 3.822
149 HD12 LEU 40 2HD1 LEU 40 17.936 -4.776 3.754
150 HD13 LEU 40 3HD1 LEU 40 17.354 -6.438 3.662
151 HD21 LEU 40 3HD2 LEU 40 15.591 -6.850 1.642
152 HD22 LEU 40 1HD2 LEU 40 17.257 -7.425 1.589
153 HD23 LEU 40 2HD2 LEU 40 16.574 -6.574 0.204
154 H ALA 41 H ALA 41 13.762 -3.151 -0.189
155 HA ALA 41 HA ALA 41 12.856 -0.905 1.147
156 HB1 ALA 41 1HB ALA 41 11.392 -2.362 -1.076
157 HB2 ALA 41 2HB ALA 41 12.866 -1.426 -1.332
158 HB3 ALA 41 3HB ALA 41 11.396 -0.623 -0.777
159 H ARG 42 H ARG 42 11.234 -4.029 0.785
160 HA ARG 42 HA ARG 42 8.946 -3.208 2.356
161 HB2 ARG 42 2HB ARG 42 9.802 -5.544 0.717
162 HB3 ARG 42 1HB ARG 42 8.457 -5.741 1.839
163 HG2 ARG 42 2HG ARG 42 7.666 -3.456 0.703
164 HG3 ARG 42 1HG ARG 42 8.637 -4.074 -0.632
165 HD2 ARG 42 2HD ARG 42 7.242 -5.897 -0.983
166 HD3 ARG 42 1HD ARG 42 6.699 -5.936 0.706
167 HE ARG 42 HE ARG 42 5.738 -3.525 -0.078
168 HH11 ARG 42 1HH1 ARG 42 4.363 -6.401 -0.146
169 HH12 ARG 42 2HH1 ARG 42 3.483 -6.233 -1.629
170 HH21 ARG 42 1HH2 ARG 42 5.192 -3.384 -2.625
171 HH22 ARG 42 2HH2 ARG 42 3.954 -4.525 -3.034
172 H PHE 43 H PHE 43 11.954 -4.776 2.887
173 HA PHE 43 HA PHE 43 11.585 -6.670 4.844
174 HB2 PHE 43 2HB PHE 43 13.586 -4.625 4.146
175 HB3 PHE 43 1HB PHE 43 13.698 -5.213 5.794
176 HD1 PHE 43 1HD PHE 43 12.488 -7.098 2.829
177 HD2 PHE 43 2HD PHE 43 15.658 -6.565 5.678
178 HE1 PHE 43 1HE PHE 43 13.580 -9.165 2.000
179 HE2 PHE 43 2HE PHE 43 16.750 -8.633 4.850
180 HZ PHE 43 HZ PHE 43 15.711 -9.932 3.011
181 H LYS 44 H LYS 44 11.527 -3.125 5.370
182 HA LYS 44 HA LYS 44 11.150 -3.300 8.158
183 HB2 LYS 44 2HB LYS 44 10.978 -1.218 6.042
184 HB3 LYS 44 1HB LYS 44 10.496 -0.825 7.697
185 HG2 LYS 44 2HG LYS 44 12.883 -0.341 7.316
186 HG3 LYS 44 1HG LYS 44 12.658 -1.603 8.526
187 HD2 LYS 44 2HD LYS 44 13.240 -3.320 6.996
188 HD3 LYS 44 1HD LYS 44 13.127 -2.225 5.616
189 HE2 LYS 44 2HE LYS 44 15.090 -1.661 7.837
190 HE3 LYS 44 1HE LYS 44 15.508 -2.777 6.521
191 HZ1 LYS 44 3HZ LYS 44 14.199 -0.303 5.736
192 HZ2 LYS 44 1HZ LYS 44 15.471 -1.138 4.988
193 HZ3 LYS 44 2HZ LYS 44 15.784 -0.135 6.323
194 H GLY 45 H GLY 45 9.073 -4.453 6.120
195 HA2 GLY 45 2HA GLY 45 6.767 -3.954 7.831
196 HA3 GLY 45 1HA GLY 45 6.607 -3.269 6.225
197 H ASP 46 H ASP 46 6.229 -4.611 4.508
198 HA ASP 46 HA ASP 46 5.077 -7.187 5.081
199 HB2 ASP 46 2HB ASP 46 5.831 -6.075 2.382
200 HB3 ASP 46 1HB ASP 46 4.459 -7.094 2.805
201 H GLY 47 H GLY 47 8.000 -7.127 5.692
202 HA2 GLY 47 2HA GLY 47 9.202 -8.696 3.511
203 HA3 GLY 47 1HA GLY 47 10.016 -8.192 4.993
204 H VAL 48 H VAL 48 8.447 -9.042 6.881
205 HA VAL 48 HA VAL 48 9.046 -11.744 7.293
206 HB VAL 48 HB VAL 48 8.642 -10.539 9.238
207 HG11 VAL 48 1HG1 VAL 48 7.852 -8.463 8.717
208 HG12 VAL 48 2HG1 VAL 48 6.329 -9.164 9.263
209 HG13 VAL 48 3HG1 VAL 48 6.697 -9.087 7.541
210 HG21 VAL 48 3HG2 VAL 48 6.944 -12.510 8.928
211 HG22 VAL 48 1HG2 VAL 48 5.770 -11.195 8.882
212 HG23 VAL 48 2HG2 VAL 48 6.803 -11.404 10.298
213 H LYS 49 H LYS 49 5.957 -10.248 6.319
214 HA LYS 49 HA LYS 49 4.212 -12.337 6.339
215 HB2 LYS 49 2HB LYS 49 3.325 -11.202 4.208
216 HB3 LYS 49 1HB LYS 49 3.509 -10.213 5.653
217 HG2 LYS 49 2HG LYS 49 4.891 -8.854 4.553
218 HG3 LYS 49 1HG LYS 49 5.991 -10.185 4.241
219 HD2 LYS 49 2HD LYS 49 5.187 -9.077 2.148
220 HD3 LYS 49 1HD LYS 49 4.748 -10.783 2.226
221 HE2 LYS 49 2HE LYS 49 2.594 -9.598 3.472
222 HE3 LYS 49 1HE LYS 49 3.004 -8.409 2.219
223 HZ1 LYS 49 3HZ LYS 49 3.345 -10.644 0.855
224 HZ2 LYS 49 1HZ LYS 49 1.848 -9.848 0.926
225 HZ3 LYS 49 2HZ LYS 49 2.148 -11.183 1.932
226 H TYR 50 H TYR 50 6.199 -11.704 3.365
227 HA TYR 50 HA TYR 50 5.494 -14.319 2.377
228 HB2 TYR 50 2HB TYR 50 6.843 -13.565 0.481
229 HB3 TYR 50 1HB TYR 50 5.664 -12.358 0.976
230 HD1 TYR 50 2HD TYR 50 9.202 -13.363 1.670
231 HD2 TYR 50 1HD TYR 50 6.359 -10.188 1.223
232 HE1 TYR 50 2HE TYR 50 11.032 -11.698 1.898
233 HE2 TYR 50 1HE TYR 50 8.183 -8.515 1.441
234 HH TYR 50 HH TYR 50 11.162 -9.199 2.659
235 H LYS 51 H LYS 51 8.405 -12.868 3.865
236 HA LYS 51 HA LYS 51 10.220 -14.950 3.333
237 HB2 LYS 51 2HB LYS 51 9.849 -12.759 5.221
238 HB3 LYS 51 1HB LYS 51 10.723 -14.112 5.935
239 HG2 LYS 51 2HG LYS 51 11.505 -13.268 3.187
240 HG3 LYS 51 1HG LYS 51 11.981 -12.222 4.526
241 HD2 LYS 51 2HD LYS 51 12.439 -15.064 5.080
242 HD3 LYS 51 1HD LYS 51 13.354 -14.480 3.690
243 HE2 LYS 51 2HE LYS 51 13.719 -12.422 5.477
244 HE3 LYS 51 1HE LYS 51 13.692 -13.837 6.549
245 HZ1 LYS 51 3HZ LYS 51 15.218 -14.941 4.964
246 HZ2 LYS 51 1HZ LYS 51 15.906 -13.582 5.711
247 HZ3 LYS 51 2HZ LYS 51 15.349 -13.480 4.108
248 H ALA 52 H ALA 52 7.911 -14.583 5.899
249 HA ALA 52 HA ALA 52 8.362 -16.997 7.284
250 HB1 ALA 52 1HB ALA 52 7.148 -15.366 8.420
251 HB2 ALA 52 2HB ALA 52 5.865 -16.468 7.919
252 HB3 ALA 52 3HB ALA 52 6.173 -14.995 6.999
253 H LYS 53 H LYS 53 5.870 -16.132 5.028
254 HA LYS 53 HA LYS 53 4.650 -18.679 4.781
255 HB2 LYS 53 2HB LYS 53 4.703 -16.094 3.262
256 HB3 LYS 53 1HB LYS 53 3.778 -17.461 2.653
257 HG2 LYS 53 2HG LYS 53 3.314 -17.138 5.480
258 HG3 LYS 53 1HG LYS 53 2.985 -15.626 4.634
259 HD2 LYS 53 2HD LYS 53 0.931 -16.775 4.493
260 HD3 LYS 53 1HD LYS 53 1.692 -17.116 2.939
261 HE2 LYS 53 2HE LYS 53 2.651 -19.235 4.057
262 HE3 LYS 53 1HE LYS 53 1.465 -18.939 5.344
263 HZ1 LYS 53 3HZ LYS 53 0.958 -20.159 2.944
264 HZ2 LYS 53 1HZ LYS 53 0.342 -18.593 2.736
265 HZ3 LYS 53 2HZ LYS 53 -0.204 -19.554 4.026
266 H LEU 54 H LEU 54 6.883 -16.994 2.487
267 HA LEU 54 HA LEU 54 7.008 -18.863 0.490
268 HB2 LEU 54 2HB LEU 54 9.009 -17.051 1.758
269 HB3 LEU 54 1HB LEU 54 9.277 -17.859 0.203
270 HG LEU 54 HG LEU 54 6.986 -16.037 0.919
271 HD11 LEU 54 1HD1 LEU 54 8.047 -14.974 -1.252
272 HD12 LEU 54 2HD1 LEU 54 9.480 -15.825 -0.669
273 HD13 LEU 54 3HD1 LEU 54 8.687 -14.625 0.353
274 HD21 LEU 54 3HD2 LEU 54 6.595 -16.473 -1.672
275 HD22 LEU 54 1HD2 LEU 54 5.913 -17.544 -0.449
276 HD23 LEU 54 2HD2 LEU 54 7.395 -17.997 -1.290
277 H ILE 55 H ILE 55 8.243 -19.095 3.698
278 HA ILE 55 HA ILE 55 10.191 -21.102 3.308
279 HB ILE 55 HB ILE 55 8.884 -19.415 5.254
280 HG12 ILE 55 2HG1 ILE 55 10.969 -18.955 5.933
281 HG13 ILE 55 1HG1 ILE 55 11.583 -20.583 5.640
282 HG21 ILE 55 1HG2 ILE 55 9.696 -20.940 7.124
283 HG22 ILE 55 2HG2 ILE 55 9.454 -22.212 5.922
284 HG23 ILE 55 3HG2 ILE 55 8.109 -21.172 6.395
285 HD11 ILE 55 3HD1 ILE 55 10.665 -18.875 3.345
286 HD12 ILE 55 1HD1 ILE 55 11.855 -20.175 3.352
287 HD13 ILE 55 2HD1 ILE 55 12.264 -18.603 4.039
288 H GLY 56 H GLY 56 6.958 -21.123 4.796
289 HA2 GLY 56 2HA GLY 56 5.257 -22.745 4.560
290 HA3 GLY 56 1HA GLY 56 6.376 -23.684 3.624
291 H ILE 57 H ILE 57 6.462 -22.483 6.919
292 HA ILE 57 HA ILE 57 7.721 -24.749 7.984
293 HB ILE 57 HB ILE 57 7.249 -23.484 10.055
294 HG12 ILE 57 2HG1 ILE 57 6.234 -21.169 8.549
295 HG13 ILE 57 1HG1 ILE 57 5.087 -22.506 8.631
296 HG21 ILE 57 1HG2 ILE 57 8.859 -22.895 7.867
297 HG22 ILE 57 2HG2 ILE 57 9.054 -22.276 9.507
298 HG23 ILE 57 3HG2 ILE 57 8.138 -21.351 8.317
299 HD11 ILE 57 3HD1 ILE 57 4.621 -21.267 10.583
300 HD12 ILE 57 1HD1 ILE 57 6.327 -20.951 10.896
301 HD13 ILE 57 2HD1 ILE 57 5.666 -22.565 11.162
302 H ASP 58 H ASP 58 5.518 -24.061 10.031
303 HA ASP 58 HA ASP 58 4.253 -26.449 10.458
304 HB2 ASP 58 2HB ASP 58 3.895 -24.619 11.946
305 HB3 ASP 58 1HB ASP 58 3.228 -23.609 10.655
Start of MODEL 8
1 H SER 24 H SER 24 -12.923 4.736 1.083
2 HA SER 24 HA SER 24 -12.186 7.502 1.086
3 HB2 SER 24 2HB SER 24 -13.666 7.522 3.077
4 HB3 SER 24 1HB SER 24 -12.684 6.258 3.812
5 HG SER 24 HG SER 24 -11.229 7.698 4.303
6 H LYS 25 H LYS 25 -10.269 6.787 0.110
7 HA LYS 25 HA LYS 25 -8.728 4.541 0.931
8 HB2 LYS 25 2HB LYS 25 -7.028 5.594 -0.543
9 HB3 LYS 25 1HB LYS 25 -8.630 5.610 -1.281
10 HG2 LYS 25 2HG LYS 25 -8.897 7.897 -0.985
11 HG3 LYS 25 1HG LYS 25 -7.795 7.952 0.392
12 HD2 LYS 25 2HD LYS 25 -6.199 8.667 -1.033
13 HD3 LYS 25 1HD LYS 25 -6.218 7.053 -1.743
14 HE2 LYS 25 2HE LYS 25 -7.529 7.711 -3.544
15 HE3 LYS 25 1HE LYS 25 -8.311 9.015 -2.628
16 HZ1 LYS 25 3HZ LYS 25 -6.600 9.794 -4.245
17 HZ2 LYS 25 1HZ LYS 25 -5.425 8.993 -3.321
18 HZ3 LYS 25 2HZ LYS 25 -6.310 10.275 -2.641
19 H LYS 26 H LYS 26 -9.149 7.567 2.433
20 HA LYS 26 HA LYS 26 -6.666 8.306 3.440
21 HB2 LYS 26 2HB LYS 26 -9.495 8.390 4.360
22 HB3 LYS 26 1HB LYS 26 -8.260 8.771 5.561
23 HG2 LYS 26 2HG LYS 26 -8.523 10.088 2.842
24 HG3 LYS 26 1HG LYS 26 -9.017 10.807 4.374
25 HD2 LYS 26 2HD LYS 26 -6.278 9.809 4.476
26 HD3 LYS 26 1HD LYS 26 -6.495 11.014 3.205
27 HE2 LYS 26 2HE LYS 26 -7.522 11.455 6.024
28 HE3 LYS 26 1HE LYS 26 -5.897 11.954 5.511
29 HZ1 LYS 26 3HZ LYS 26 -8.021 13.495 5.163
30 HZ2 LYS 26 1HZ LYS 26 -8.106 12.605 3.722
31 HZ3 LYS 26 2HZ LYS 26 -6.707 13.496 4.085
32 H GLU 27 H GLU 27 -6.226 8.000 6.001
33 HA GLU 27 HA GLU 27 -5.028 5.580 6.488
34 HB2 GLU 27 2HB GLU 27 -5.048 6.247 8.790
35 HB3 GLU 27 1HB GLU 27 -5.073 7.739 7.850
36 HG2 GLU 27 2HG GLU 27 -7.569 6.385 8.910
37 HG3 GLU 27 1HG GLU 27 -6.732 7.690 9.751
38 H LYS 28 H LYS 28 -5.663 3.539 7.220
39 HA LYS 28 HA LYS 28 -8.264 2.578 6.717
40 HB2 LYS 28 2HB LYS 28 -7.379 0.555 7.695
41 HB3 LYS 28 1HB LYS 28 -6.054 1.362 6.855
42 HG2 LYS 28 2HG LYS 28 -6.265 2.331 9.579
43 HG3 LYS 28 1HG LYS 28 -6.105 0.575 9.558
44 HD2 LYS 28 2HD LYS 28 -3.926 0.744 9.033
45 HD3 LYS 28 1HD LYS 28 -4.315 1.718 7.614
46 HE2 LYS 28 2HE LYS 28 -3.157 3.345 8.756
47 HE3 LYS 28 1HE LYS 28 -4.694 3.549 9.619
48 HZ1 LYS 28 3HZ LYS 28 -2.793 1.449 10.436
49 HZ2 LYS 28 1HZ LYS 28 -4.008 2.200 11.349
50 HZ3 LYS 28 2HZ LYS 28 -2.579 3.044 10.981
51 H LYS 29 H LYS 29 -9.070 1.112 8.911
52 HA LYS 29 HA LYS 29 -10.750 2.705 10.399
53 HB2 LYS 29 2HB LYS 29 -9.735 0.047 10.408
54 HB3 LYS 29 1HB LYS 29 -9.714 0.621 12.075
55 HG2 LYS 29 2HG LYS 29 -11.942 0.350 12.205
56 HG3 LYS 29 1HG LYS 29 -12.162 1.479 10.868
57 HD2 LYS 29 2HD LYS 29 -11.260 -1.268 10.158
58 HD3 LYS 29 1HD LYS 29 -12.926 -1.100 10.715
59 HE2 LYS 29 2HE LYS 29 -13.462 0.446 8.966
60 HE3 LYS 29 1HE LYS 29 -11.752 0.663 8.544
61 HZ1 LYS 29 3HZ LYS 29 -13.493 -1.663 8.086
62 HZ2 LYS 29 1HZ LYS 29 -11.829 -1.910 8.304
63 HZ3 LYS 29 2HZ LYS 29 -12.380 -0.930 7.031
64 H LYS 30 H LYS 30 -10.536 3.066 12.900
65 HA LYS 30 HA LYS 30 -8.688 5.034 13.526
66 HB2 LYS 30 2HB LYS 30 -10.321 3.024 15.007
67 HB3 LYS 30 1HB LYS 30 -9.116 3.917 15.935
68 HG2 LYS 30 2HG LYS 30 -10.211 5.922 15.687
69 HG3 LYS 30 1HG LYS 30 -10.826 5.505 14.087
70 HD2 LYS 30 2HD LYS 30 -12.717 4.542 14.922
71 HD3 LYS 30 1HD LYS 30 -11.873 3.851 16.309
72 HE2 LYS 30 2HE LYS 30 -12.099 6.820 16.282
73 HE3 LYS 30 1HE LYS 30 -13.602 5.917 16.561
74 HZ1 LYS 30 3HZ LYS 30 -12.364 6.279 18.632
75 HZ2 LYS 30 1HZ LYS 30 -11.035 5.445 17.986
76 HZ3 LYS 30 2HZ LYS 30 -12.498 4.626 18.260
77 H GLY 31 H GLY 31 -6.875 4.730 15.295
78 HA2 GLY 31 2HA GLY 31 -5.507 2.289 15.561
79 HA3 GLY 31 1HA GLY 31 -4.787 3.198 14.241
80 HA PRO 32 HA PRO 32 -3.032 4.549 18.349
81 HB2 PRO 32 2HB PRO 32 -0.439 3.980 17.795
82 HB3 PRO 32 1HB PRO 32 -1.558 2.818 18.546
83 HG2 PRO 32 2HG PRO 32 -0.730 3.080 15.712
84 HG3 PRO 32 1HG PRO 32 -0.929 1.627 16.703
85 HD2 PRO 32 2HD PRO 32 -2.776 2.414 14.898
86 HD3 PRO 32 1HD PRO 32 -3.211 1.579 16.409
87 H GLU 33 H GLU 33 -1.504 6.416 18.615
88 HA GLU 33 HA GLU 33 -1.490 8.101 16.242
89 HB2 GLU 33 2HB GLU 33 -2.166 9.595 17.823
90 HB3 GLU 33 1HB GLU 33 -2.055 8.258 18.972
91 HG2 GLU 33 2HG GLU 33 0.272 8.769 19.429
92 HG3 GLU 33 1HG GLU 33 0.250 10.062 18.230
93 H LYS 34 H LYS 34 0.348 5.942 17.236
94 HA LYS 34 HA LYS 34 2.940 6.895 17.771
95 HB2 LYS 34 2HB LYS 34 1.470 4.527 17.186
96 HB3 LYS 34 1HB LYS 34 2.962 4.504 16.279
97 HG2 LYS 34 2HG LYS 34 3.038 5.338 19.144
98 HG3 LYS 34 1HG LYS 34 2.857 3.622 18.782
99 HD2 LYS 34 2HD LYS 34 4.913 3.604 17.513
100 HD3 LYS 34 1HD LYS 34 5.050 5.360 17.618
101 HE2 LYS 34 2HE LYS 34 4.912 3.716 20.143
102 HE3 LYS 34 1HE LYS 34 6.454 3.916 19.287
103 HZ1 LYS 34 3HZ LYS 34 6.526 5.851 20.416
104 HZ2 LYS 34 1HZ LYS 34 4.852 5.892 20.688
105 HZ3 LYS 34 2HZ LYS 34 5.482 6.400 19.194
106 H THR 35 H THR 35 4.781 7.013 16.233
107 HA THR 35 HA THR 35 4.302 6.916 13.396
108 HB THR 35 HB THR 35 5.088 9.602 14.061
109 HG1 THR 35 1HG THR 35 3.313 10.246 15.108
110 HG21 THR 35 3HG2 THR 35 3.794 10.131 12.236
111 HG22 THR 35 1HG2 THR 35 2.549 8.955 12.657
112 HG23 THR 35 2HG2 THR 35 4.054 8.417 11.912
113 H ASP 36 H ASP 36 6.434 7.690 16.050
114 HA ASP 36 HA ASP 36 8.770 7.777 14.211
115 HB2 ASP 36 2HB ASP 36 8.064 8.759 16.903
116 HB3 ASP 36 1HB ASP 36 9.729 8.202 16.724
117 H GLU 37 H GLU 37 8.323 6.465 17.410
118 HA GLU 37 HA GLU 37 10.164 4.325 17.088
119 HB2 GLU 37 2HB GLU 37 8.057 5.193 18.988
120 HB3 GLU 37 1HB GLU 37 8.511 3.491 19.069
121 HG2 GLU 37 2HG GLU 37 10.934 4.263 19.173
122 HG3 GLU 37 1HG GLU 37 10.314 5.899 19.402
123 H TYR 38 H TYR 38 7.013 4.838 15.979
124 HA TYR 38 HA TYR 38 6.173 2.081 15.769
125 HB2 TYR 38 2HB TYR 38 4.190 3.112 15.456
126 HB3 TYR 38 1HB TYR 38 5.051 4.594 15.835
127 HD1 TYR 38 2HD TYR 38 6.624 5.233 13.529
128 HD2 TYR 38 1HD TYR 38 2.728 3.463 13.743
129 HE1 TYR 38 2HE TYR 38 6.114 6.077 11.255
130 HE2 TYR 38 1HE TYR 38 2.203 4.309 11.472
131 HH TYR 38 HH TYR 38 3.464 5.003 9.437
132 H LEU 39 H LEU 39 8.118 4.205 13.867
133 HA LEU 39 HA LEU 39 7.805 3.427 11.243
134 HB2 LEU 39 2HB LEU 39 9.934 4.319 13.030
135 HB3 LEU 39 1HB LEU 39 10.546 3.355 11.691
136 HG LEU 39 HG LEU 39 10.524 5.581 10.891
137 HD11 LEU 39 1HD1 LEU 39 9.472 5.127 8.953
138 HD12 LEU 39 2HD1 LEU 39 7.896 5.079 9.744
139 HD13 LEU 39 3HD1 LEU 39 8.918 3.641 9.724
140 HD21 LEU 39 3HD2 LEU 39 7.788 5.728 12.154
141 HD22 LEU 39 1HD2 LEU 39 8.411 6.968 11.067
142 HD23 LEU 39 2HD2 LEU 39 9.224 6.650 12.600
143 H LEU 40 H LEU 40 9.924 1.777 13.602
144 HA LEU 40 HA LEU 40 10.486 -0.490 11.995
145 HB2 LEU 40 2HB LEU 40 10.543 0.228 14.910
146 HB3 LEU 40 1HB LEU 40 10.954 -1.411 14.403
147 HG LEU 40 HG LEU 40 12.878 0.300 14.583
148 HD11 LEU 40 1HD1 LEU 40 12.253 -1.599 12.374
149 HD12 LEU 40 2HD1 LEU 40 13.574 -1.633 13.543
150 HD13 LEU 40 3HD1 LEU 40 13.655 -0.552 12.151
151 HD21 LEU 40 3HD2 LEU 40 11.583 1.181 11.985
152 HD22 LEU 40 1HD2 LEU 40 13.201 1.652 12.511
153 HD23 LEU 40 2HD2 LEU 40 11.789 2.164 13.436
154 H ALA 41 H ALA 41 7.906 0.148 14.354
155 HA ALA 41 HA ALA 41 6.778 -2.369 14.651
156 HB1 ALA 41 1HB ALA 41 4.866 -1.176 15.301
157 HB2 ALA 41 2HB ALA 41 5.060 0.013 14.013
158 HB3 ALA 41 3HB ALA 41 6.109 0.069 15.429
159 H ARG 42 H ARG 42 6.582 -0.157 11.906
160 HA ARG 42 HA ARG 42 4.886 -1.922 10.370
161 HB2 ARG 42 2HB ARG 42 6.132 0.785 10.002
162 HB3 ARG 42 1HB ARG 42 5.191 0.012 8.725
163 HG2 ARG 42 2HG ARG 42 3.520 -0.301 10.866
164 HG3 ARG 42 1HG ARG 42 4.282 1.241 11.255
165 HD2 ARG 42 2HD ARG 42 2.906 2.248 9.764
166 HD3 ARG 42 1HD ARG 42 3.652 1.292 8.469
167 HE ARG 42 HE ARG 42 1.048 0.812 9.448
168 HH11 ARG 42 1HH2 ARG 42 3.488 -0.659 7.737
169 HH12 ARG 42 2HH2 ARG 42 2.991 -2.288 8.054
170 HH21 ARG 42 1HH1 ARG 42 0.619 -1.384 10.418
171 HH22 ARG 42 2HH1 ARG 42 1.362 -2.698 9.569
172 H PHE 43 H PHE 43 8.250 -1.273 10.719
173 HA PHE 43 HA PHE 43 9.432 -1.689 8.269
174 HB2 PHE 43 2HB PHE 43 10.008 -2.304 11.096
175 HB3 PHE 43 1HB PHE 43 10.946 -3.233 9.940
176 HD1 PHE 43 2HD PHE 43 9.628 0.161 9.319
177 HD2 PHE 43 1HD PHE 43 13.082 -2.184 10.328
178 HE1 PHE 43 2HE PHE 43 11.082 2.134 8.930
179 HE2 PHE 43 1HE PHE 43 14.535 -0.213 9.942
180 HZ PHE 43 HZ PHE 43 13.536 1.946 9.242
181 H LYS 44 H LYS 44 8.154 -4.252 10.416
182 HA LYS 44 HA LYS 44 8.836 -6.370 8.674
183 HB2 LYS 44 2HB LYS 44 7.210 -5.967 11.133
184 HB3 LYS 44 1HB LYS 44 7.198 -7.538 10.326
185 HG2 LYS 44 2HG LYS 44 8.964 -7.409 12.052
186 HG3 LYS 44 1HG LYS 44 9.634 -7.635 10.437
187 HD2 LYS 44 2HD LYS 44 10.260 -5.346 10.270
188 HD3 LYS 44 1HD LYS 44 9.321 -4.914 11.699
189 HE2 LYS 44 2HE LYS 44 11.807 -6.663 11.653
190 HE3 LYS 44 1HE LYS 44 11.674 -5.031 12.339
191 HZ1 LYS 44 3HZ LYS 44 11.196 -6.244 14.190
192 HZ2 LYS 44 1HZ LYS 44 10.558 -7.553 13.320
193 HZ3 LYS 44 2HZ LYS 44 9.629 -6.148 13.540
194 H GLY 45 H GLY 45 6.844 -4.115 7.905
195 HA2 GLY 45 2HA GLY 45 4.291 -5.120 7.383
196 HA3 GLY 45 1HA GLY 45 5.086 -3.923 6.379
197 H ASP 46 H ASP 46 6.432 -4.695 4.678
198 HA ASP 46 HA ASP 46 5.472 -7.260 3.541
199 HB2 ASP 46 2HB ASP 46 7.028 -5.760 1.675
200 HB3 ASP 46 1HB ASP 46 5.290 -6.047 1.669
201 H GLY 47 H GLY 47 7.106 -8.059 5.278
202 HA2 GLY 47 2HA GLY 47 9.612 -8.709 3.836
203 HA3 GLY 47 1HA GLY 47 9.753 -8.032 5.461
204 H VAL 48 H VAL 48 8.367 -9.131 7.076
205 HA VAL 48 HA VAL 48 9.059 -11.867 7.346
206 HB VAL 48 HB VAL 48 8.842 -10.694 9.347
207 HG11 VAL 48 1HG1 VAL 48 6.716 -9.251 7.893
208 HG12 VAL 48 2HG1 VAL 48 7.924 -8.642 9.020
209 HG13 VAL 48 3HG1 VAL 48 6.467 -9.432 9.626
210 HG21 VAL 48 3HG2 VAL 48 7.007 -11.536 10.546
211 HG22 VAL 48 1HG2 VAL 48 7.320 -12.731 9.288
212 HG23 VAL 48 2HG2 VAL 48 5.994 -11.581 9.101
213 H LYS 49 H LYS 49 5.890 -10.322 6.716
214 HA LYS 49 HA LYS 49 4.161 -12.409 6.839
215 HB2 LYS 49 2HB LYS 49 3.051 -11.234 4.862
216 HB3 LYS 49 1HB LYS 49 3.431 -10.245 6.266
217 HG2 LYS 49 2HG LYS 49 4.596 -8.882 4.928
218 HG3 LYS 49 1HG LYS 49 5.734 -10.188 4.640
219 HD2 LYS 49 2HD LYS 49 4.701 -9.197 2.550
220 HD3 LYS 49 1HD LYS 49 4.491 -10.942 2.714
221 HE2 LYS 49 2HE LYS 49 2.211 -10.742 3.267
222 HE3 LYS 49 1HE LYS 49 2.386 -9.046 3.764
223 HZ1 LYS 49 3HZ LYS 49 1.414 -9.462 1.467
224 HZ2 LYS 49 1HZ LYS 49 2.975 -9.940 1.004
225 HZ3 LYS 49 2HZ LYS 49 2.704 -8.358 1.563
226 H TYR 50 H TYR 50 5.868 -11.708 3.715
227 HA TYR 50 HA TYR 50 5.095 -14.309 2.733
228 HB2 TYR 50 2HB TYR 50 6.289 -13.512 0.755
229 HB3 TYR 50 1HB TYR 50 5.172 -12.300 1.370
230 HD1 TYR 50 2HD TYR 50 8.730 -13.380 1.840
231 HD2 TYR 50 1HD TYR 50 5.926 -10.154 1.557
232 HE1 TYR 50 2HE TYR 50 10.601 -11.752 1.996
233 HE2 TYR 50 1HE TYR 50 7.783 -8.520 1.704
234 HH TYR 50 HH TYR 50 10.363 -8.611 1.122
235 H LYS 51 H LYS 51 8.003 -12.892 4.181
236 HA LYS 51 HA LYS 51 9.928 -14.783 3.452
237 HB2 LYS 51 2HB LYS 51 9.391 -12.875 5.583
238 HB3 LYS 51 1HB LYS 51 10.376 -14.232 6.120
239 HG2 LYS 51 2HG LYS 51 11.000 -12.861 3.527
240 HG3 LYS 51 1HG LYS 51 11.566 -12.175 5.050
241 HD2 LYS 51 2HD LYS 51 13.342 -13.569 4.600
242 HD3 LYS 51 1HD LYS 51 12.313 -14.688 5.490
243 HE2 LYS 51 2HE LYS 51 13.271 -15.569 3.276
244 HE3 LYS 51 1HE LYS 51 11.513 -15.699 3.450
245 HZ1 LYS 51 3HZ LYS 51 12.606 -14.540 1.362
246 HZ2 LYS 51 1HZ LYS 51 12.598 -13.197 2.396
247 HZ3 LYS 51 2HZ LYS 51 11.141 -13.987 2.021
248 H ALA 52 H ALA 52 7.821 -14.820 6.220
249 HA ALA 52 HA ALA 52 8.350 -17.362 7.242
250 HB1 ALA 52 1HB ALA 52 7.019 -16.094 8.622
251 HB2 ALA 52 2HB ALA 52 5.746 -17.017 7.823
252 HB3 ALA 52 3HB ALA 52 6.143 -15.393 7.262
253 H LYS 53 H LYS 53 5.758 -16.413 5.123
254 HA LYS 53 HA LYS 53 4.704 -18.979 4.582
255 HB2 LYS 53 2HB LYS 53 4.641 -16.255 3.320
256 HB3 LYS 53 1HB LYS 53 3.807 -17.601 2.555
257 HG2 LYS 53 2HG LYS 53 3.039 -17.868 5.183
258 HG3 LYS 53 1HG LYS 53 3.110 -16.116 4.986
259 HD2 LYS 53 2HD LYS 53 1.845 -16.709 2.703
260 HD3 LYS 53 1HD LYS 53 1.325 -18.101 3.653
261 HE2 LYS 53 2HE LYS 53 0.634 -16.463 5.478
262 HE3 LYS 53 1HE LYS 53 0.898 -15.169 4.293
263 HZ1 LYS 53 3HZ LYS 53 -0.921 -17.501 4.024
264 HZ2 LYS 53 1HZ LYS 53 -0.538 -16.454 2.745
265 HZ3 LYS 53 2HZ LYS 53 -1.362 -15.862 4.107
266 H LEU 54 H LEU 54 6.809 -16.947 2.431
267 HA LEU 54 HA LEU 54 7.129 -18.698 0.344
268 HB2 LEU 54 2HB LEU 54 8.947 -16.782 1.735
269 HB3 LEU 54 1HB LEU 54 9.302 -17.483 0.147
270 HG LEU 54 HG LEU 54 6.850 -15.911 0.914
271 HD11 LEU 54 1HD1 LEU 54 9.078 -14.773 0.431
272 HD12 LEU 54 2HD1 LEU 54 7.682 -14.240 -0.509
273 HD13 LEU 54 3HD1 LEU 54 8.866 -15.335 -1.226
274 HD21 LEU 54 3HD2 LEU 54 7.433 -17.769 -1.321
275 HD22 LEU 54 1HD2 LEU 54 6.641 -16.254 -1.757
276 HD23 LEU 54 2HD2 LEU 54 5.889 -17.339 -0.587
277 H ILE 55 H ILE 55 8.434 -18.850 3.545
278 HA ILE 55 HA ILE 55 10.466 -20.765 3.127
279 HB ILE 55 HB ILE 55 9.151 -19.077 5.077
280 HG12 ILE 55 2HG1 ILE 55 11.235 -18.490 5.654
281 HG13 ILE 55 1HG1 ILE 55 11.922 -20.091 5.374
282 HG21 ILE 55 1HG2 ILE 55 8.556 -20.703 6.428
283 HG22 ILE 55 2HG2 ILE 55 10.253 -20.587 6.903
284 HG23 ILE 55 3HG2 ILE 55 9.735 -21.831 5.768
285 HD11 ILE 55 3HD1 ILE 55 10.794 -18.618 3.036
286 HD12 ILE 55 1HD1 ILE 55 12.187 -19.697 3.112
287 HD13 ILE 55 2HD1 ILE 55 12.326 -18.036 3.691
288 H GLY 56 H GLY 56 7.428 -20.931 4.953
289 HA2 GLY 56 2HA GLY 56 5.882 -22.634 5.265
290 HA3 GLY 56 1HA GLY 56 6.381 -23.207 3.697
291 H ILE 57 H ILE 57 8.286 -22.934 6.599
292 HA ILE 57 HA ILE 57 9.419 -25.497 6.378
293 HB ILE 57 HB ILE 57 10.405 -24.749 8.525
294 HG12 ILE 57 2HG1 ILE 57 9.213 -22.058 8.148
295 HG13 ILE 57 1HG1 ILE 57 8.122 -23.278 8.809
296 HG21 ILE 57 1HG2 ILE 57 11.818 -23.912 7.003
297 HG22 ILE 57 2HG2 ILE 57 10.951 -22.385 7.165
298 HG23 ILE 57 3HG2 ILE 57 10.492 -23.533 5.906
299 HD11 ILE 57 3HD1 ILE 57 10.303 -23.785 10.313
300 HD12 ILE 57 1HD1 ILE 57 9.075 -22.611 10.786
301 HD13 ILE 57 2HD1 ILE 57 10.560 -22.067 10.008
302 H ASP 58 H ASP 58 8.833 -25.115 9.397
303 HA ASP 58 HA ASP 58 7.681 -26.467 10.999
304 HB2 ASP 58 2HB ASP 58 6.194 -24.572 10.569
305 HB3 ASP 58 1HB ASP 58 5.533 -25.385 9.144
Start of MODEL 9
1 H SER 24 H SER 24 1.623 6.028 2.421
2 HA SER 24 HA SER 24 -0.452 6.526 0.515
3 HB2 SER 24 2HB SER 24 0.214 8.500 -0.530
4 HB3 SER 24 1HB SER 24 0.638 8.862 1.140
5 HG SER 24 HG SER 24 2.256 8.256 -1.049
6 H LYS 25 H LYS 25 1.606 4.548 1.393
7 HA LYS 25 HA LYS 25 2.884 2.864 0.334
8 HB2 LYS 25 2HB LYS 25 0.970 3.571 -1.399
9 HB3 LYS 25 1HB LYS 25 2.365 4.142 -2.317
10 HG2 LYS 25 2HG LYS 25 3.259 1.698 -1.503
11 HG3 LYS 25 1HG LYS 25 1.534 1.376 -1.681
12 HD2 LYS 25 2HD LYS 25 1.626 1.533 -3.939
13 HD3 LYS 25 1HD LYS 25 2.652 2.968 -3.880
14 HE2 LYS 25 2HE LYS 25 4.115 1.388 -4.818
15 HE3 LYS 25 1HE LYS 25 4.497 1.226 -3.092
16 HZ1 LYS 25 3HZ LYS 25 3.025 -0.591 -2.882
17 HZ2 LYS 25 1HZ LYS 25 3.947 -0.912 -4.268
18 HZ3 LYS 25 2HZ LYS 25 2.355 -0.337 -4.424
19 H LYS 26 H LYS 26 3.353 5.704 -1.798
20 HA LYS 26 HA LYS 26 6.227 5.648 -1.080
21 HB2 LYS 26 2HB LYS 26 4.970 4.980 -3.506
22 HB3 LYS 26 1HB LYS 26 5.697 6.565 -3.772
23 HG2 LYS 26 2HG LYS 26 7.578 5.004 -2.308
24 HG3 LYS 26 1HG LYS 26 7.001 4.016 -3.653
25 HD2 LYS 26 2HD LYS 26 7.386 6.656 -4.646
26 HD3 LYS 26 1HD LYS 26 8.829 6.224 -3.727
27 HE2 LYS 26 2HE LYS 26 7.621 4.298 -5.724
28 HE3 LYS 26 1HE LYS 26 8.798 5.531 -6.218
29 HZ1 LYS 26 3HZ LYS 26 9.479 3.147 -5.191
30 HZ2 LYS 26 1HZ LYS 26 9.458 4.100 -3.788
31 HZ3 LYS 26 2HZ LYS 26 10.453 4.536 -5.094
32 H GLU 27 H GLU 27 7.227 7.709 -0.948
33 HA GLU 27 HA GLU 27 6.103 10.137 -1.864
34 HB2 GLU 27 2HB GLU 27 4.469 9.295 -0.038
35 HB3 GLU 27 1HB GLU 27 5.743 9.726 1.103
36 HG2 GLU 27 2HG GLU 27 5.667 12.021 0.489
37 HG3 GLU 27 1HG GLU 27 4.728 11.680 -0.963
38 H LYS 28 H LYS 28 7.841 8.801 0.959
39 HA LYS 28 HA LYS 28 9.546 10.838 1.659
40 HB2 LYS 28 2HB LYS 28 9.603 7.898 1.569
41 HB3 LYS 28 1HB LYS 28 11.208 8.629 1.615
42 HG2 LYS 28 2HG LYS 28 10.823 8.643 3.870
43 HG3 LYS 28 1HG LYS 28 9.966 10.137 3.487
44 HD2 LYS 28 2HD LYS 28 8.045 9.225 4.214
45 HD3 LYS 28 1HD LYS 28 8.187 7.957 2.995
46 HE2 LYS 28 2HE LYS 28 9.892 6.881 4.680
47 HE3 LYS 28 1HE LYS 28 9.073 7.912 5.872
48 HZ1 LYS 28 3HZ LYS 28 7.922 5.803 5.670
49 HZ2 LYS 28 1HZ LYS 28 7.753 6.020 3.997
50 HZ3 LYS 28 2HZ LYS 28 6.943 7.057 5.072
51 H LYS 29 H LYS 29 11.468 11.748 0.824
52 HA LYS 29 HA LYS 29 11.875 12.187 -1.851
53 HB2 LYS 29 2HB LYS 29 13.112 13.326 -0.116
54 HB3 LYS 29 1HB LYS 29 13.877 11.822 0.397
55 HG2 LYS 29 2HG LYS 29 15.121 11.667 -1.663
56 HG3 LYS 29 1HG LYS 29 14.221 13.011 -2.368
57 HD2 LYS 29 2HD LYS 29 16.360 13.865 -1.622
58 HD3 LYS 29 1HD LYS 29 15.119 14.481 -0.531
59 HE2 LYS 29 2HE LYS 29 15.665 12.788 1.136
60 HE3 LYS 29 1HE LYS 29 16.815 12.019 0.024
61 HZ1 LYS 29 3HZ LYS 29 18.148 13.445 1.260
62 HZ2 LYS 29 1HZ LYS 29 16.982 14.676 1.303
63 HZ3 LYS 29 2HZ LYS 29 17.824 14.355 -0.138
64 H LYS 30 H LYS 30 12.261 10.824 -3.553
65 HA LYS 30 HA LYS 30 12.513 8.111 -3.610
66 HB2 LYS 30 2HB LYS 30 13.415 10.390 -5.265
67 HB3 LYS 30 1HB LYS 30 14.182 8.845 -5.639
68 HG2 LYS 30 2HG LYS 30 12.181 7.847 -6.266
69 HG3 LYS 30 1HG LYS 30 11.214 8.918 -5.253
70 HD2 LYS 30 2HD LYS 30 12.357 10.699 -6.998
71 HD3 LYS 30 1HD LYS 30 12.134 9.285 -8.030
72 HE2 LYS 30 2HE LYS 30 9.733 9.292 -6.780
73 HE3 LYS 30 1HE LYS 30 10.088 11.031 -6.759
74 HZ1 LYS 30 3HZ LYS 30 9.250 10.826 -8.860
75 HZ2 LYS 30 1HZ LYS 30 9.779 9.225 -9.050
76 HZ3 LYS 30 2HZ LYS 30 10.886 10.507 -9.186
77 H GLY 31 H GLY 31 13.838 6.878 -2.329
78 HA2 GLY 31 2HA GLY 31 16.272 7.614 -1.175
79 HA3 GLY 31 1HA GLY 31 15.791 5.951 -1.469
80 HA PRO 32 HA PRO 32 19.513 6.768 -4.019
81 HB2 PRO 32 2HB PRO 32 20.601 4.317 -3.579
82 HB3 PRO 32 1HB PRO 32 20.867 5.717 -2.512
83 HG2 PRO 32 2HG PRO 32 18.937 3.475 -2.240
84 HG3 PRO 32 1HG PRO 32 19.977 4.224 -1.018
85 HD2 PRO 32 2HD PRO 32 17.360 4.802 -1.187
86 HD3 PRO 32 1HD PRO 32 18.564 6.033 -0.731
87 H GLU 33 H GLU 33 20.412 4.883 -5.696
88 HA GLU 33 HA GLU 33 18.065 4.150 -7.247
89 HB2 GLU 33 2HB GLU 33 19.494 4.901 -8.852
90 HB3 GLU 33 1HB GLU 33 20.697 5.083 -7.572
91 HG2 GLU 33 2HG GLU 33 21.770 3.661 -9.078
92 HG3 GLU 33 1HG GLU 33 21.117 2.545 -7.883
93 H LYS 34 H LYS 34 19.334 2.852 -4.865
94 HA LYS 34 HA LYS 34 20.288 0.264 -5.463
95 HB2 LYS 34 2HB LYS 34 19.538 1.963 -3.301
96 HB3 LYS 34 1HB LYS 34 18.922 0.356 -3.011
97 HG2 LYS 34 2HG LYS 34 21.654 0.414 -4.077
98 HG3 LYS 34 1HG LYS 34 21.497 1.189 -2.501
99 HD2 LYS 34 2HD LYS 34 20.182 -0.940 -1.822
100 HD3 LYS 34 1HD LYS 34 20.899 -1.669 -3.257
101 HE2 LYS 34 2HE LYS 34 22.503 -0.322 -1.052
102 HE3 LYS 34 1HE LYS 34 22.267 -2.075 -1.195
103 HZ1 LYS 34 3HZ LYS 34 23.454 -2.180 -3.133
104 HZ2 LYS 34 1HZ LYS 34 24.290 -0.927 -2.356
105 HZ3 LYS 34 2HZ LYS 34 23.144 -0.564 -3.555
106 H THR 35 H THR 35 19.119 -1.762 -5.393
107 HA THR 35 HA THR 35 16.229 -1.749 -5.192
108 HB THR 35 HB THR 35 16.839 -2.956 -7.663
109 HG1 THR 35 1HG THR 35 18.046 -1.532 -8.647
110 HG21 THR 35 3HG2 THR 35 15.139 -1.499 -8.488
111 HG22 THR 35 1HG2 THR 35 15.451 -0.322 -7.212
112 HG23 THR 35 2HG2 THR 35 14.697 -1.868 -6.821
113 H ASP 36 H ASP 36 19.200 -3.509 -5.766
114 HA ASP 36 HA ASP 36 17.890 -6.121 -5.331
115 HB2 ASP 36 2HB ASP 36 19.979 -5.214 -6.879
116 HB3 ASP 36 1HB ASP 36 20.810 -5.980 -5.524
117 H GLU 37 H GLU 37 20.862 -4.769 -4.095
118 HA GLU 37 HA GLU 37 20.843 -6.226 -1.649
119 HB2 GLU 37 2HB GLU 37 22.346 -4.066 -2.965
120 HB3 GLU 37 1HB GLU 37 22.386 -3.992 -1.202
121 HG2 GLU 37 2HG GLU 37 22.813 -6.668 -2.440
122 HG3 GLU 37 1HG GLU 37 24.118 -5.493 -2.613
123 H TYR 38 H TYR 38 19.107 -3.535 -2.713
124 HA TYR 38 HA TYR 38 18.664 -2.297 -0.117
125 HB2 TYR 38 2HB TYR 38 18.123 -0.583 -1.459
126 HB3 TYR 38 1HB TYR 38 18.662 -1.593 -2.786
127 HD1 TYR 38 2HD TYR 38 16.561 -3.569 -3.139
128 HD2 TYR 38 1HD TYR 38 16.298 0.573 -2.084
129 HE1 TYR 38 2HE TYR 38 14.262 -3.461 -4.089
130 HE2 TYR 38 1HE TYR 38 14.013 0.690 -3.025
131 HH TYR 38 HH TYR 38 12.624 -2.016 -4.796
132 H LEU 39 H LEU 39 17.281 -4.867 -1.921
133 HA LEU 39 HA LEU 39 14.589 -4.921 -1.217
134 HB2 LEU 39 2HB LEU 39 16.770 -6.826 -1.769
135 HB3 LEU 39 1HB LEU 39 15.478 -7.509 -0.803
136 HG LEU 39 HG LEU 39 14.272 -7.830 -2.674
137 HD11 LEU 39 1HD1 LEU 39 13.561 -5.847 -4.087
138 HD12 LEU 39 2HD1 LEU 39 14.555 -4.844 -3.033
139 HD13 LEU 39 3HD1 LEU 39 13.173 -5.713 -2.370
140 HD21 LEU 39 3HD2 LEU 39 16.233 -8.157 -3.932
141 HD22 LEU 39 1HD2 LEU 39 16.638 -6.441 -3.911
142 HD23 LEU 39 2HD2 LEU 39 15.293 -7.018 -4.895
143 H LEU 40 H LEU 40 17.290 -6.281 0.681
144 HA LEU 40 HA LEU 40 15.838 -6.890 3.017
145 HB2 LEU 40 2HB LEU 40 18.681 -6.243 2.292
146 HB3 LEU 40 1HB LEU 40 18.253 -6.549 3.975
147 HG LEU 40 HG LEU 40 19.020 -8.563 2.552
148 HD11 LEU 40 1HD1 LEU 40 16.724 -9.759 3.507
149 HD12 LEU 40 2HD1 LEU 40 16.806 -8.281 4.466
150 HD13 LEU 40 3HD1 LEU 40 18.158 -9.413 4.474
151 HD21 LEU 40 3HD2 LEU 40 16.191 -8.197 1.515
152 HD22 LEU 40 1HD2 LEU 40 17.174 -9.640 1.271
153 HD23 LEU 40 2HD2 LEU 40 17.671 -8.104 0.560
154 H ALA 41 H ALA 41 17.309 -3.895 1.881
155 HA ALA 41 HA ALA 41 17.296 -2.312 4.165
156 HB1 ALA 41 1HB ALA 41 16.129 -1.083 1.742
157 HB2 ALA 41 2HB ALA 41 17.615 -1.986 1.451
158 HB3 ALA 41 3HB ALA 41 17.605 -0.656 2.610
159 H ARG 42 H ARG 42 14.596 -3.133 2.013
160 HA ARG 42 HA ARG 42 12.649 -1.790 3.680
161 HB2 ARG 42 2HB ARG 42 12.709 -3.223 1.054
162 HB3 ARG 42 1HB ARG 42 11.169 -2.787 1.796
163 HG2 ARG 42 2HG ARG 42 13.420 -0.858 1.151
164 HG3 ARG 42 1HG ARG 42 11.922 -1.028 0.235
165 HD2 ARG 42 2HD ARG 42 10.917 0.428 1.643
166 HD3 ARG 42 1HD ARG 42 11.232 -0.677 2.996
167 HE ARG 42 HE ARG 42 13.531 0.383 3.120
168 HH11 ARG 42 1HH2 ARG 42 10.681 2.107 2.820
169 HH12 ARG 42 2HH2 ARG 42 11.425 3.631 2.473
170 HH21 ARG 42 1HH1 ARG 42 14.604 2.298 2.114
171 HH22 ARG 42 2HH1 ARG 42 13.643 3.739 2.068
172 H PHE 43 H PHE 43 13.942 -4.947 3.338
173 HA PHE 43 HA PHE 43 11.945 -6.765 3.809
174 HB2 PHE 43 2HB PHE 43 14.766 -6.413 4.507
175 HB3 PHE 43 1HB PHE 43 13.917 -7.486 5.609
176 HD1 PHE 43 2HD PHE 43 13.277 -6.884 1.993
177 HD2 PHE 43 1HD PHE 43 14.667 -9.638 4.977
178 HE1 PHE 43 2HE PHE 43 13.386 -8.678 0.282
179 HE2 PHE 43 1HE PHE 43 14.780 -11.435 3.268
180 HZ PHE 43 HZ PHE 43 14.135 -10.956 0.920
181 H LYS 44 H LYS 44 12.985 -4.248 6.030
182 HA LYS 44 HA LYS 44 11.901 -5.345 8.380
183 HB2 LYS 44 2HB LYS 44 12.828 -2.684 7.421
184 HB3 LYS 44 1HB LYS 44 12.101 -2.829 9.026
185 HG2 LYS 44 2HG LYS 44 14.565 -3.116 9.081
186 HG3 LYS 44 1HG LYS 44 13.705 -4.553 9.631
187 HD2 LYS 44 2HD LYS 44 14.051 -5.661 7.537
188 HD3 LYS 44 1HD LYS 44 14.674 -4.186 6.795
189 HE2 LYS 44 2HE LYS 44 16.076 -5.140 9.254
190 HE3 LYS 44 1HE LYS 44 16.334 -6.065 7.760
191 HZ1 LYS 44 3HZ LYS 44 17.043 -3.307 8.377
192 HZ2 LYS 44 1HZ LYS 44 16.443 -3.589 6.816
193 HZ3 LYS 44 2HZ LYS 44 17.818 -4.425 7.359
194 H GLY 45 H GLY 45 10.130 -4.794 5.857
195 HA2 GLY 45 2HA GLY 45 7.833 -3.679 7.392
196 HA3 GLY 45 1HA GLY 45 8.101 -3.259 5.706
197 H ASP 46 H ASP 46 7.281 -4.583 4.163
198 HA ASP 46 HA ASP 46 5.543 -6.783 4.973
199 HB2 ASP 46 2HB ASP 46 6.330 -6.030 2.164
200 HB3 ASP 46 1HB ASP 46 4.781 -6.615 2.761
201 H GLY 47 H GLY 47 8.448 -7.245 5.423
202 HA2 GLY 47 2HA GLY 47 9.186 -9.155 3.299
203 HA3 GLY 47 1HA GLY 47 10.186 -8.704 4.681
204 H VAL 48 H VAL 48 8.695 -9.136 6.748
205 HA VAL 48 HA VAL 48 8.842 -11.838 7.374
206 HB VAL 48 HB VAL 48 8.687 -10.438 9.219
207 HG11 VAL 48 1HG1 VAL 48 8.233 -8.313 8.526
208 HG12 VAL 48 2HG1 VAL 48 6.636 -8.703 9.170
209 HG13 VAL 48 3HG1 VAL 48 6.947 -8.835 7.438
210 HG21 VAL 48 3HG2 VAL 48 6.581 -10.649 10.318
211 HG22 VAL 48 1HG2 VAL 48 6.841 -12.121 9.381
212 HG23 VAL 48 2HG2 VAL 48 5.748 -10.872 8.778
213 H LYS 49 H LYS 49 5.977 -9.972 6.336
214 HA LYS 49 HA LYS 49 3.968 -11.806 6.588
215 HB2 LYS 49 2HB LYS 49 3.164 -10.724 4.377
216 HB3 LYS 49 1HB LYS 49 3.461 -9.688 5.768
217 HG2 LYS 49 2HG LYS 49 5.026 -8.544 4.648
218 HG3 LYS 49 1HG LYS 49 5.895 -10.023 4.249
219 HD2 LYS 49 2HD LYS 49 5.140 -8.830 2.201
220 HD3 LYS 49 1HD LYS 49 4.375 -10.412 2.344
221 HE2 LYS 49 2HE LYS 49 2.292 -9.505 2.878
222 HE3 LYS 49 1HE LYS 49 2.997 -8.009 3.521
223 HZ1 LYS 49 3HZ LYS 49 3.828 -7.575 1.218
224 HZ2 LYS 49 1HZ LYS 49 2.141 -7.496 1.381
225 HZ3 LYS 49 2HZ LYS 49 2.863 -8.867 0.682
226 H TYR 50 H TYR 50 5.913 -11.650 3.535
227 HA TYR 50 HA TYR 50 4.925 -14.298 2.841
228 HB2 TYR 50 2HB TYR 50 6.041 -13.769 0.750
229 HB3 TYR 50 1HB TYR 50 5.030 -12.433 1.276
230 HD1 TYR 50 1HD TYR 50 8.536 -13.684 1.670
231 HD2 TYR 50 2HD TYR 50 5.930 -10.310 1.228
232 HE1 TYR 50 1HE TYR 50 10.510 -12.184 1.569
233 HE2 TYR 50 2HE TYR 50 7.901 -8.801 1.126
234 HH TYR 50 HH TYR 50 10.112 -8.654 1.241
235 H LYS 51 H LYS 51 7.916 -12.837 4.044
236 HA LYS 51 HA LYS 51 9.811 -14.743 3.385
237 HB2 LYS 51 2HB LYS 51 9.267 -12.892 5.605
238 HB3 LYS 51 1HB LYS 51 10.407 -14.178 5.967
239 HG2 LYS 51 2HG LYS 51 10.696 -12.693 3.389
240 HG3 LYS 51 1HG LYS 51 11.260 -11.931 4.878
241 HD2 LYS 51 2HD LYS 51 13.129 -13.179 4.803
242 HD3 LYS 51 1HD LYS 51 12.149 -14.643 4.898
243 HE2 LYS 51 2HE LYS 51 12.092 -14.914 2.565
244 HE3 LYS 51 1HE LYS 51 12.454 -13.202 2.265
245 HZ1 LYS 51 3HZ LYS 51 14.389 -14.724 3.833
246 HZ2 LYS 51 1HZ LYS 51 14.647 -13.481 2.710
247 HZ3 LYS 51 2HZ LYS 51 14.324 -15.059 2.168
248 H ALA 52 H ALA 52 7.777 -14.795 6.216
249 HA ALA 52 HA ALA 52 8.356 -17.304 7.256
250 HB1 ALA 52 1HB ALA 52 6.966 -15.967 8.556
251 HB2 ALA 52 2HB ALA 52 5.793 -17.101 7.884
252 HB3 ALA 52 3HB ALA 52 5.986 -15.501 7.166
253 H LYS 53 H LYS 53 5.765 -16.486 5.090
254 HA LYS 53 HA LYS 53 4.812 -19.092 4.578
255 HB2 LYS 53 2HB LYS 53 4.670 -16.392 3.276
256 HB3 LYS 53 1HB LYS 53 3.908 -17.777 2.504
257 HG2 LYS 53 2HG LYS 53 3.238 -17.865 5.269
258 HG3 LYS 53 1HG LYS 53 2.937 -16.224 4.698
259 HD2 LYS 53 2HD LYS 53 1.360 -16.913 3.125
260 HD3 LYS 53 1HD LYS 53 2.018 -18.545 3.032
261 HE2 LYS 53 2HE LYS 53 1.277 -18.627 5.591
262 HE3 LYS 53 1HE LYS 53 0.138 -17.378 5.050
263 HZ1 LYS 53 3HZ LYS 53 -0.292 -19.990 4.712
264 HZ2 LYS 53 1HZ LYS 53 0.493 -19.629 3.252
265 HZ3 LYS 53 2HZ LYS 53 -0.923 -18.796 3.682
266 H LEU 54 H LEU 54 6.922 -17.045 2.442
267 HA LEU 54 HA LEU 54 7.299 -18.822 0.388
268 HB2 LEU 54 2HB LEU 54 9.093 -16.882 1.776
269 HB3 LEU 54 1HB LEU 54 9.453 -17.587 0.190
270 HG LEU 54 HG LEU 54 7.046 -15.960 0.966
271 HD11 LEU 54 1HD1 LEU 54 8.082 -14.277 -0.075
272 HD12 LEU 54 2HD1 LEU 54 8.479 -15.301 -1.458
273 HD13 LEU 54 3HD1 LEU 54 9.531 -15.282 -0.041
274 HD21 LEU 54 3HD2 LEU 54 6.499 -16.365 -1.556
275 HD22 LEU 54 1HD2 LEU 54 6.085 -17.612 -0.380
276 HD23 LEU 54 2HD2 LEU 54 7.533 -17.782 -1.371
277 H ILE 55 H ILE 55 8.545 -18.939 3.617
278 HA ILE 55 HA ILE 55 10.593 -20.847 3.231
279 HB ILE 55 HB ILE 55 9.263 -19.144 5.155
280 HG12 ILE 55 2HG1 ILE 55 11.343 -18.544 5.731
281 HG13 ILE 55 1HG1 ILE 55 12.033 -20.148 5.481
282 HG21 ILE 55 1HG2 ILE 55 9.863 -21.888 5.882
283 HG22 ILE 55 2HG2 ILE 55 8.672 -20.761 6.522
284 HG23 ILE 55 3HG2 ILE 55 10.364 -20.628 7.002
285 HD11 ILE 55 3HD1 ILE 55 10.933 -18.650 3.133
286 HD12 ILE 55 1HD1 ILE 55 12.259 -19.810 3.192
287 HD13 ILE 55 2HD1 ILE 55 12.501 -18.162 3.775
288 H GLY 56 H GLY 56 7.571 -21.029 5.073
289 HA2 GLY 56 2HA GLY 56 6.095 -22.778 5.483
290 HA3 GLY 56 1HA GLY 56 6.442 -23.254 3.840
291 H ILE 57 H ILE 57 8.639 -23.122 6.525
292 HA ILE 57 HA ILE 57 9.732 -25.670 6.051
293 HB ILE 57 HB ILE 57 10.989 -25.020 8.074
294 HG12 ILE 57 2HG1 ILE 57 9.735 -22.330 8.017
295 HG13 ILE 57 1HG1 ILE 57 8.761 -23.602 8.751
296 HG21 ILE 57 1HG2 ILE 57 11.388 -22.594 6.810
297 HG22 ILE 57 2HG2 ILE 57 10.692 -23.613 5.550
298 HG23 ILE 57 3HG2 ILE 57 12.163 -24.121 6.382
299 HD11 ILE 57 3HD1 ILE 57 11.551 -22.734 9.540
300 HD12 ILE 57 1HD1 ILE 57 10.799 -24.214 10.135
301 HD13 ILE 57 2HD1 ILE 57 10.084 -22.647 10.515
302 H ASP 58 H ASP 58 9.539 -25.442 9.128
303 HA ASP 58 HA ASP 58 8.624 -26.908 10.782
304 HB2 ASP 58 2HB ASP 58 7.153 -24.947 10.702
305 HB3 ASP 58 1HB ASP 58 6.236 -25.669 9.374
Start of MODEL 10
1 H SER 24 H SER 24 5.526 -4.648 -3.301
2 HA SER 24 HA SER 24 8.221 -5.461 -2.782
3 HB2 SER 24 2HB SER 24 6.556 -7.155 -4.591
4 HB3 SER 24 1HB SER 24 8.219 -6.846 -5.081
5 HG SER 24 HG SER 24 7.243 -8.434 -3.101
6 H LYS 25 H LYS 25 6.827 -5.436 -6.036
7 HA LYS 25 HA LYS 25 8.492 -3.572 -7.207
8 HB2 LYS 25 2HB LYS 25 5.610 -4.339 -7.559
9 HB3 LYS 25 1HB LYS 25 6.290 -3.061 -8.567
10 HG2 LYS 25 2HG LYS 25 7.007 -4.737 -9.910
11 HG3 LYS 25 1HG LYS 25 8.241 -5.012 -8.680
12 HD2 LYS 25 2HD LYS 25 7.062 -6.785 -7.704
13 HD3 LYS 25 1HD LYS 25 5.522 -6.262 -8.385
14 HE2 LYS 25 2HE LYS 25 7.348 -6.775 -10.549
15 HE3 LYS 25 1HE LYS 25 7.309 -8.186 -9.474
16 HZ1 LYS 25 3HZ LYS 25 4.886 -6.748 -10.413
17 HZ2 LYS 25 1HZ LYS 25 4.937 -8.199 -9.536
18 HZ3 LYS 25 2HZ LYS 25 5.487 -8.160 -11.142
19 H LYS 26 H LYS 26 5.199 -2.629 -6.144
20 HA LYS 26 HA LYS 26 4.407 -0.562 -5.313
21 HB2 LYS 26 2HB LYS 26 6.083 -1.450 -3.573
22 HB3 LYS 26 1HB LYS 26 7.229 -0.294 -4.253
23 HG2 LYS 26 2HG LYS 26 6.025 1.547 -3.514
24 HG3 LYS 26 1HG LYS 26 4.495 0.670 -3.495
25 HD2 LYS 26 2HD LYS 26 6.699 -0.153 -1.626
26 HD3 LYS 26 1HD LYS 26 5.684 1.231 -1.222
27 HE2 LYS 26 2HE LYS 26 3.813 -0.639 -2.017
28 HE3 LYS 26 1HE LYS 26 5.019 -1.633 -1.176
29 HZ1 LYS 26 3HZ LYS 26 3.737 -0.833 0.560
30 HZ2 LYS 26 1HZ LYS 26 3.500 0.683 -0.163
31 HZ3 LYS 26 2HZ LYS 26 5.008 0.293 0.515
32 H GLU 27 H GLU 27 5.628 -0.593 -7.998
33 HA GLU 27 HA GLU 27 7.449 1.316 -8.712
34 HB2 GLU 27 2HB GLU 27 5.777 1.759 -10.650
35 HB3 GLU 27 1HB GLU 27 6.322 0.100 -10.401
36 HG2 GLU 27 2HG GLU 27 4.279 -0.602 -9.612
37 HG3 GLU 27 1HG GLU 27 3.900 0.964 -8.895
38 H LYS 28 H LYS 28 4.252 1.944 -7.357
39 HA LYS 28 HA LYS 28 3.935 4.667 -7.974
40 HB2 LYS 28 2HB LYS 28 2.980 2.696 -6.021
41 HB3 LYS 28 1HB LYS 28 2.921 4.354 -5.421
42 HG2 LYS 28 2HG LYS 28 2.005 4.201 -8.176
43 HG3 LYS 28 1HG LYS 28 1.062 3.142 -7.128
44 HD2 LYS 28 2HD LYS 28 -0.043 5.233 -6.995
45 HD3 LYS 28 1HD LYS 28 0.924 5.155 -5.521
46 HE2 LYS 28 2HE LYS 28 1.386 7.321 -6.375
47 HE3 LYS 28 1HE LYS 28 2.759 6.357 -6.953
48 HZ1 LYS 28 3HZ LYS 28 1.827 7.534 -8.807
49 HZ2 LYS 28 1HZ LYS 28 0.267 6.974 -8.449
50 HZ3 LYS 28 2HZ LYS 28 1.458 5.885 -8.982
51 H LYS 29 H LYS 29 5.119 6.432 -7.397
52 HA LYS 29 HA LYS 29 7.053 7.524 -6.478
53 HB2 LYS 29 2HB LYS 29 5.011 8.331 -5.469
54 HB3 LYS 29 1HB LYS 29 4.999 6.989 -4.325
55 HG2 LYS 29 2HG LYS 29 7.516 8.120 -3.966
56 HG3 LYS 29 1HG LYS 29 6.467 9.518 -4.202
57 HD2 LYS 29 2HD LYS 29 5.813 7.274 -2.278
58 HD3 LYS 29 1HD LYS 29 6.678 8.734 -1.797
59 HE2 LYS 29 2HE LYS 29 4.619 9.923 -3.023
60 HE3 LYS 29 1HE LYS 29 3.810 8.408 -2.574
61 HZ1 LYS 29 3HZ LYS 29 5.045 8.795 -0.338
62 HZ2 LYS 29 1HZ LYS 29 3.594 9.617 -0.644
63 HZ3 LYS 29 2HZ LYS 29 5.080 10.418 -0.840
64 H LYS 30 H LYS 30 8.235 5.203 -6.715
65 HA LYS 30 HA LYS 30 8.718 3.610 -4.430
66 HB2 LYS 30 2HB LYS 30 10.404 2.661 -5.824
67 HB3 LYS 30 1HB LYS 30 9.143 3.227 -6.920
68 HG2 LYS 30 2HG LYS 30 10.634 5.468 -6.787
69 HG3 LYS 30 1HG LYS 30 11.898 4.270 -6.505
70 HD2 LYS 30 2HD LYS 30 11.747 3.414 -8.619
71 HD3 LYS 30 1HD LYS 30 10.001 3.655 -8.703
72 HE2 LYS 30 2HE LYS 30 11.031 6.254 -8.577
73 HE3 LYS 30 1HE LYS 30 12.131 5.392 -9.673
74 HZ1 LYS 30 3HZ LYS 30 10.252 4.552 -10.895
75 HZ2 LYS 30 1HZ LYS 30 10.146 6.244 -10.825
76 HZ3 LYS 30 2HZ LYS 30 9.164 5.291 -9.818
77 H GLY 31 H GLY 31 8.904 5.913 -3.104
78 HA2 GLY 31 2HA GLY 31 10.313 7.332 -1.861
79 HA3 GLY 31 1HA GLY 31 11.379 5.941 -1.870
80 HA PRO 32 HA PRO 32 13.731 9.273 -3.883
81 HB2 PRO 32 2HB PRO 32 16.126 8.290 -3.057
82 HB3 PRO 32 1HB PRO 32 15.115 9.388 -2.086
83 HG2 PRO 32 2HG PRO 32 15.327 6.428 -1.979
84 HG3 PRO 32 1HG PRO 32 15.289 7.604 -0.658
85 HD2 PRO 32 2HD PRO 32 13.116 6.185 -1.322
86 HD3 PRO 32 1HD PRO 32 12.986 7.883 -0.801
87 H GLU 33 H GLU 33 16.181 8.540 -4.953
88 HA GLU 33 HA GLU 33 15.354 7.023 -7.231
89 HB2 GLU 33 2HB GLU 33 16.946 8.363 -8.146
90 HB3 GLU 33 1HB GLU 33 17.119 9.013 -6.511
91 HG2 GLU 33 2HG GLU 33 18.928 7.596 -5.997
92 HG3 GLU 33 1HG GLU 33 18.609 6.544 -7.373
93 H LYS 34 H LYS 34 16.231 6.087 -4.419
94 HA LYS 34 HA LYS 34 18.178 4.047 -4.738
95 HB2 LYS 34 2HB LYS 34 16.387 5.199 -2.842
96 HB3 LYS 34 1HB LYS 34 16.349 3.463 -2.698
97 HG2 LYS 34 2HG LYS 34 19.039 4.585 -3.056
98 HG3 LYS 34 1HG LYS 34 18.244 5.107 -1.570
99 HD2 LYS 34 2HD LYS 34 17.713 2.655 -1.139
100 HD3 LYS 34 1HD LYS 34 18.813 2.273 -2.464
101 HE2 LYS 34 2HE LYS 34 19.652 4.009 -0.125
102 HE3 LYS 34 1HE LYS 34 19.867 2.248 -0.132
103 HZ1 LYS 34 3HZ LYS 34 20.824 4.092 -2.258
104 HZ2 LYS 34 1HZ LYS 34 21.061 2.412 -2.209
105 HZ3 LYS 34 2HZ LYS 34 21.807 3.408 -1.054
106 H THR 35 H THR 35 17.805 1.772 -5.093
107 HA THR 35 HA THR 35 15.132 0.742 -5.417
108 HB THR 35 HB THR 35 16.517 0.450 -7.922
109 HG1 THR 35 1HG THR 35 16.934 2.454 -8.342
110 HG21 THR 35 3HG2 THR 35 14.052 0.060 -7.309
111 HG22 THR 35 1HG2 THR 35 14.382 0.884 -8.834
112 HG23 THR 35 2HG2 THR 35 13.886 1.812 -7.420
113 H ASP 36 H ASP 36 18.578 0.269 -5.658
114 HA ASP 36 HA ASP 36 18.242 -2.667 -5.906
115 HB2 ASP 36 2HB ASP 36 19.872 -1.522 -7.339
116 HB3 ASP 36 1HB ASP 36 20.656 -0.846 -5.911
117 H GLU 37 H GLU 37 20.416 -0.696 -4.023
118 HA GLU 37 HA GLU 37 20.645 -2.541 -1.864
119 HB2 GLU 37 2HB GLU 37 21.418 0.233 -2.540
120 HB3 GLU 37 1HB GLU 37 21.338 -0.126 -0.815
121 HG2 GLU 37 2HG GLU 37 22.656 -2.242 -2.345
122 HG3 GLU 37 1HG GLU 37 23.485 -0.691 -2.480
123 H TYR 38 H TYR 38 18.224 -0.384 -2.788
124 HA TYR 38 HA TYR 38 17.143 0.190 -0.162
125 HB2 TYR 38 2HB TYR 38 16.087 1.789 -1.345
126 HB3 TYR 38 1HB TYR 38 17.121 1.292 -2.672
127 HD1 TYR 38 1HD TYR 38 16.031 -1.217 -3.600
128 HD2 TYR 38 2HD TYR 38 14.005 2.263 -2.137
129 HE1 TYR 38 1HE TYR 38 14.009 -1.853 -4.886
130 HE2 TYR 38 2HE TYR 38 11.981 1.643 -3.423
131 HH TYR 38 HH TYR 38 11.573 0.196 -5.607
132 H LEU 39 H LEU 39 16.809 -2.390 -2.436
133 HA LEU 39 HA LEU 39 14.219 -3.326 -2.042
134 HB2 LEU 39 2HB LEU 39 16.882 -4.383 -2.682
135 HB3 LEU 39 1HB LEU 39 15.826 -5.580 -1.952
136 HG LEU 39 HG LEU 39 15.246 -5.876 -4.147
137 HD11 LEU 39 1HD1 LEU 39 13.528 -3.437 -3.781
138 HD12 LEU 39 2HD1 LEU 39 13.246 -4.907 -2.850
139 HD13 LEU 39 3HD1 LEU 39 13.136 -4.944 -4.610
140 HD21 LEU 39 3HD2 LEU 39 16.353 -4.580 -5.604
141 HD22 LEU 39 1HD2 LEU 39 16.504 -3.289 -4.412
142 HD23 LEU 39 2HD2 LEU 39 15.063 -3.392 -5.423
143 H LEU 40 H LEU 40 17.089 -4.240 -0.127
144 HA LEU 40 HA LEU 40 15.683 -5.629 1.906
145 HB2 LEU 40 2HB LEU 40 18.357 -4.311 1.560
146 HB3 LEU 40 1HB LEU 40 17.927 -5.024 3.115
147 HG LEU 40 HG LEU 40 19.146 -6.526 1.401
148 HD11 LEU 40 1HD1 LEU 40 18.323 -7.680 3.243
149 HD12 LEU 40 2HD1 LEU 40 17.369 -8.414 1.954
150 HD13 LEU 40 3HD1 LEU 40 16.665 -7.148 2.959
151 HD21 LEU 40 3HD2 LEU 40 17.593 -7.661 -0.192
152 HD22 LEU 40 1HD2 LEU 40 17.816 -5.953 -0.569
153 HD23 LEU 40 2HD2 LEU 40 16.343 -6.494 0.238
154 H ALA 41 H ALA 41 16.493 -2.218 1.509
155 HA ALA 41 HA ALA 41 16.144 -1.175 4.046
156 HB1 ALA 41 1HB ALA 41 16.090 -0.295 1.368
157 HB2 ALA 41 2HB ALA 41 16.164 0.723 2.806
158 HB3 ALA 41 3HB ALA 41 14.604 0.319 2.091
159 H ARG 42 H ARG 42 13.664 -2.342 1.813
160 HA ARG 42 HA ARG 42 11.502 -1.723 3.632
161 HB2 ARG 42 2HB ARG 42 11.841 -2.752 0.852
162 HB3 ARG 42 1HB ARG 42 10.276 -2.921 1.649
163 HG2 ARG 42 2HG ARG 42 11.669 -0.261 1.686
164 HG3 ARG 42 1HG ARG 42 10.789 -0.758 0.240
165 HD2 ARG 42 2HD ARG 42 8.808 -0.272 1.223
166 HD3 ARG 42 1HD ARG 42 9.208 -1.294 2.618
167 HE ARG 42 HE ARG 42 10.542 1.350 2.460
168 HH11 ARG 42 1HH1 ARG 42 10.319 -0.439 4.920
169 HH12 ARG 42 2HH1 ARG 42 9.117 0.404 5.837
170 HH21 ARG 42 1HH2 ARG 42 8.042 2.329 3.161
171 HH22 ARG 42 2HH2 ARG 42 7.828 1.971 4.842
172 H PHE 43 H PHE 43 13.516 -4.417 2.896
173 HA PHE 43 HA PHE 43 11.997 -6.684 3.264
174 HB2 PHE 43 2HB PHE 43 14.737 -5.780 3.851
175 HB3 PHE 43 1HB PHE 43 14.224 -7.164 4.797
176 HD1 PHE 43 2HD PHE 43 13.360 -6.118 1.317
177 HD2 PHE 43 1HD PHE 43 15.216 -9.060 3.833
178 HE1 PHE 43 2HE PHE 43 13.721 -7.575 -0.658
179 HE2 PHE 43 1HE PHE 43 15.580 -10.519 1.860
180 HZ PHE 43 HZ PHE 43 14.830 -9.777 -0.386
181 H LYS 44 H LYS 44 12.952 -4.344 5.760
182 HA LYS 44 HA LYS 44 12.009 -5.908 7.925
183 HB2 LYS 44 2HB LYS 44 12.984 -3.133 7.467
184 HB3 LYS 44 1HB LYS 44 12.336 -3.587 9.048
185 HG2 LYS 44 2HG LYS 44 14.775 -3.944 8.933
186 HG3 LYS 44 1HG LYS 44 13.902 -5.456 9.172
187 HD2 LYS 44 2HD LYS 44 14.223 -6.131 6.941
188 HD3 LYS 44 1HD LYS 44 14.655 -4.501 6.422
189 HE2 LYS 44 2HE LYS 44 16.698 -4.683 7.947
190 HE3 LYS 44 1HE LYS 44 16.318 -6.413 8.085
191 HZ1 LYS 44 3HZ LYS 44 16.044 -6.101 5.482
192 HZ2 LYS 44 1HZ LYS 44 17.535 -6.495 6.187
193 HZ3 LYS 44 2HZ LYS 44 17.199 -4.886 5.758
194 H GLY 45 H GLY 45 10.228 -4.805 5.627
195 HA2 GLY 45 2HA GLY 45 8.026 -3.779 7.359
196 HA3 GLY 45 1HA GLY 45 8.206 -3.338 5.664
197 H ASP 46 H ASP 46 7.359 -4.674 4.125
198 HA ASP 46 HA ASP 46 5.561 -6.809 4.985
199 HB2 ASP 46 2HB ASP 46 6.356 -6.051 2.172
200 HB3 ASP 46 1HB ASP 46 4.811 -6.665 2.748
201 H GLY 47 H GLY 47 8.508 -7.287 5.357
202 HA2 GLY 47 2HA GLY 47 9.165 -9.248 3.268
203 HA3 GLY 47 1HA GLY 47 10.190 -8.802 4.633
204 H VAL 48 H VAL 48 8.716 -9.186 6.719
205 HA VAL 48 HA VAL 48 8.825 -11.881 7.364
206 HB VAL 48 HB VAL 48 8.698 -10.446 9.193
207 HG11 VAL 48 1HG1 VAL 48 6.561 -8.764 9.082
208 HG12 VAL 48 2HG1 VAL 48 7.010 -8.857 7.380
209 HG13 VAL 48 3HG1 VAL 48 8.192 -8.325 8.577
210 HG21 VAL 48 3HG2 VAL 48 6.699 -12.142 9.114
211 HG22 VAL 48 1HG2 VAL 48 5.748 -10.664 8.978
212 HG23 VAL 48 2HG2 VAL 48 6.794 -10.912 10.378
213 H LYS 49 H LYS 49 5.973 -9.981 6.347
214 HA LYS 49 HA LYS 49 3.954 -11.798 6.606
215 HB2 LYS 49 2HB LYS 49 3.146 -10.720 4.398
216 HB3 LYS 49 1HB LYS 49 3.456 -9.679 5.781
217 HG2 LYS 49 2HG LYS 49 5.052 -8.562 4.674
218 HG3 LYS 49 1HG LYS 49 5.863 -10.052 4.205
219 HD2 LYS 49 2HD LYS 49 5.043 -8.742 2.233
220 HD3 LYS 49 1HD LYS 49 4.317 -10.346 2.331
221 HE2 LYS 49 2HE LYS 49 2.322 -9.342 3.454
222 HE3 LYS 49 1HE LYS 49 3.044 -7.737 3.233
223 HZ1 LYS 49 3HZ LYS 49 2.262 -9.684 1.138
224 HZ2 LYS 49 1HZ LYS 49 3.292 -8.374 0.822
225 HZ3 LYS 49 2HZ LYS 49 1.700 -8.095 1.346
226 H TYR 50 H TYR 50 5.899 -11.664 3.557
227 HA TYR 50 HA TYR 50 4.920 -14.327 2.891
228 HB2 TYR 50 2HB TYR 50 5.961 -13.786 0.774
229 HB3 TYR 50 1HB TYR 50 4.983 -12.436 1.330
230 HD1 TYR 50 1HD TYR 50 8.473 -13.754 1.574
231 HD2 TYR 50 2HD TYR 50 5.914 -10.320 1.330
232 HE1 TYR 50 1HE TYR 50 10.469 -12.285 1.435
233 HE2 TYR 50 2HE TYR 50 7.909 -8.843 1.188
234 HH TYR 50 HH TYR 50 10.208 -8.813 1.639
235 H LYS 51 H LYS 51 7.878 -12.817 4.103
236 HA LYS 51 HA LYS 51 9.832 -14.666 3.415
237 HB2 LYS 51 2HB LYS 51 9.230 -12.876 5.684
238 HB3 LYS 51 1HB LYS 51 10.423 -14.127 5.999
239 HG2 LYS 51 2HG LYS 51 10.722 -12.701 3.423
240 HG3 LYS 51 1HG LYS 51 11.051 -11.747 4.871
241 HD2 LYS 51 2HD LYS 51 12.296 -14.438 4.232
242 HD3 LYS 51 1HD LYS 51 13.095 -12.877 4.036
243 HE2 LYS 51 2HE LYS 51 12.243 -12.687 6.630
244 HE3 LYS 51 1HE LYS 51 12.589 -14.424 6.506
245 HZ1 LYS 51 3HZ LYS 51 14.667 -13.545 6.938
246 HZ2 LYS 51 1HZ LYS 51 14.390 -12.140 6.028
247 HZ3 LYS 51 2HZ LYS 51 14.671 -13.619 5.241
248 H ALA 52 H ALA 52 7.733 -14.797 6.188
249 HA ALA 52 HA ALA 52 8.378 -17.316 7.206
250 HB1 ALA 52 1HB ALA 52 6.616 -16.850 8.594
251 HB2 ALA 52 2HB ALA 52 5.546 -16.494 7.237
252 HB3 ALA 52 3HB ALA 52 6.691 -15.277 7.801
253 H LYS 53 H LYS 53 5.766 -16.438 5.093
254 HA LYS 53 HA LYS 53 4.742 -18.998 4.535
255 HB2 LYS 53 2HB LYS 53 4.764 -16.314 3.175
256 HB3 LYS 53 1HB LYS 53 3.891 -17.673 2.481
257 HG2 LYS 53 2HG LYS 53 2.871 -17.922 4.873
258 HG3 LYS 53 1HG LYS 53 3.397 -16.250 5.078
259 HD2 LYS 53 2HD LYS 53 1.595 -15.544 3.935
260 HD3 LYS 53 1HD LYS 53 2.133 -16.460 2.527
261 HE2 LYS 53 2HE LYS 53 0.434 -17.528 4.811
262 HE3 LYS 53 1HE LYS 53 -0.098 -17.242 3.141
263 HZ1 LYS 53 3HZ LYS 53 1.619 -19.342 4.202
264 HZ2 LYS 53 1HZ LYS 53 2.086 -18.683 2.711
265 HZ3 LYS 53 2HZ LYS 53 0.546 -19.380 2.886
266 H LEU 54 H LEU 54 6.937 -17.017 2.431
267 HA LEU 54 HA LEU 54 7.303 -18.816 0.394
268 HB2 LEU 54 2HB LEU 54 9.114 -16.888 1.773
269 HB3 LEU 54 1HB LEU 54 9.468 -17.613 0.196
270 HG LEU 54 HG LEU 54 7.097 -15.931 0.952
271 HD11 LEU 54 1HD1 LEU 54 9.572 -15.272 -0.002
272 HD12 LEU 54 2HD1 LEU 54 8.118 -14.292 -0.195
273 HD13 LEU 54 3HD1 LEU 54 8.618 -15.393 -1.480
274 HD21 LEU 54 3HD2 LEU 54 7.518 -17.826 -1.333
275 HD22 LEU 54 1HD2 LEU 54 6.563 -16.364 -1.586
276 HD23 LEU 54 2HD2 LEU 54 6.066 -17.543 -0.374
277 H ILE 55 H ILE 55 8.577 -18.890 3.623
278 HA ILE 55 HA ILE 55 10.623 -20.793 3.249
279 HB ILE 55 HB ILE 55 9.279 -19.107 5.176
280 HG12 ILE 55 2HG1 ILE 55 11.356 -18.468 5.730
281 HG13 ILE 55 1HG1 ILE 55 12.063 -20.069 5.507
282 HG21 ILE 55 1HG2 ILE 55 8.679 -20.864 6.426
283 HG22 ILE 55 2HG2 ILE 55 10.282 -20.493 7.068
284 HG23 ILE 55 3HG2 ILE 55 10.070 -21.828 5.932
285 HD11 ILE 55 3HD1 ILE 55 10.959 -18.589 3.144
286 HD12 ILE 55 1HD1 ILE 55 12.261 -19.776 3.204
287 HD13 ILE 55 2HD1 ILE 55 12.542 -18.130 3.773
288 H GLY 56 H GLY 56 7.472 -20.975 4.898
289 HA2 GLY 56 2HA GLY 56 6.082 -22.993 4.059
290 HA3 GLY 56 1HA GLY 56 7.515 -23.862 4.519
291 H ILE 57 H ILE 57 5.768 -21.286 6.098
292 HA ILE 57 HA ILE 57 6.068 -22.351 8.682
293 HB ILE 57 HB ILE 57 4.747 -20.337 9.178
294 HG12 ILE 57 2HG1 ILE 57 4.849 -19.573 6.298
295 HG13 ILE 57 1HG1 ILE 57 3.581 -20.709 6.763
296 HG21 ILE 57 1HG2 ILE 57 7.115 -20.369 7.357
297 HG22 ILE 57 2HG2 ILE 57 7.030 -19.938 9.066
298 HG23 ILE 57 3HG2 ILE 57 6.416 -18.825 7.843
299 HD11 ILE 57 3HD1 ILE 57 3.470 -17.938 7.033
300 HD12 ILE 57 1HD1 ILE 57 3.830 -18.507 8.663
301 HD13 ILE 57 2HD1 ILE 57 2.400 -19.099 7.818
302 H ASP 58 H ASP 58 3.225 -21.213 8.677
303 HA ASP 58 HA ASP 58 1.124 -22.164 9.316
304 HB2 ASP 58 2HB ASP 58 1.060 -21.780 6.883
305 HB3 ASP 58 1HB ASP 58 1.767 -23.380 6.609
Start of MODEL 11
1 H SER 24 H SER 24 0.294 21.394 4.877
2 HA SER 24 HA SER 24 -1.444 23.535 4.101
3 HB2 SER 24 2HB SER 24 1.127 24.192 3.558
4 HB3 SER 24 1HB SER 24 0.728 23.326 2.078
5 HG SER 24 HG SER 24 0.167 25.491 1.856
6 H LYS 25 H LYS 25 -1.900 20.854 4.362
7 HA LYS 25 HA LYS 25 -2.808 18.999 3.213
8 HB2 LYS 25 2HB LYS 25 -3.552 21.366 1.989
9 HB3 LYS 25 1HB LYS 25 -2.915 20.419 0.644
10 HG2 LYS 25 2HG LYS 25 -5.026 19.486 2.611
11 HG3 LYS 25 1HG LYS 25 -5.328 20.001 0.952
12 HD2 LYS 25 2HD LYS 25 -4.110 18.152 0.053
13 HD3 LYS 25 1HD LYS 25 -3.429 17.747 1.629
14 HE2 LYS 25 2HE LYS 25 -5.377 16.270 0.879
15 HE3 LYS 25 1HE LYS 25 -5.597 17.044 2.461
16 HZ1 LYS 25 3HZ LYS 25 -6.409 18.486 0.033
17 HZ2 LYS 25 1HZ LYS 25 -7.020 18.611 1.611
18 HZ3 LYS 25 2HZ LYS 25 -7.431 17.275 0.644
19 H LYS 26 H LYS 26 0.110 19.286 3.258
20 HA LYS 26 HA LYS 26 1.482 18.965 0.866
21 HB2 LYS 26 2HB LYS 26 2.266 18.957 3.314
22 HB3 LYS 26 1HB LYS 26 1.918 17.228 3.301
23 HG2 LYS 26 2HG LYS 26 3.743 16.751 2.036
24 HG3 LYS 26 1HG LYS 26 3.487 18.144 0.984
25 HD2 LYS 26 2HD LYS 26 5.227 19.127 2.031
26 HD3 LYS 26 1HD LYS 26 4.191 19.253 3.453
27 HE2 LYS 26 2HE LYS 26 5.841 16.784 2.824
28 HE3 LYS 26 1HE LYS 26 6.389 18.083 3.903
29 HZ1 LYS 26 3HZ LYS 26 4.615 17.739 5.351
30 HZ2 LYS 26 1HZ LYS 26 5.098 16.162 4.953
31 HZ3 LYS 26 2HZ LYS 26 3.725 16.840 4.217
32 H GLU 27 H GLU 27 1.401 17.462 -0.760
33 HA GLU 27 HA GLU 27 -0.517 15.458 -1.000
34 HB2 GLU 27 2HB GLU 27 1.877 16.416 -2.335
35 HB3 GLU 27 1HB GLU 27 1.705 14.670 -2.519
36 HG2 GLU 27 2HG GLU 27 -0.685 15.059 -3.225
37 HG3 GLU 27 1HG GLU 27 -0.340 16.791 -3.230
38 H LYS 28 H LYS 28 2.848 14.409 -1.060
39 HA LYS 28 HA LYS 28 2.574 11.830 -0.169
40 HB2 LYS 28 2HB LYS 28 4.641 13.881 -0.241
41 HB3 LYS 28 1HB LYS 28 4.906 12.736 1.074
42 HG2 LYS 28 2HG LYS 28 5.454 11.072 -0.353
43 HG3 LYS 28 1HG LYS 28 4.078 11.419 -1.401
44 HD2 LYS 28 2HD LYS 28 5.510 13.531 -2.074
45 HD3 LYS 28 1HD LYS 28 6.854 12.550 -1.488
46 HE2 LYS 28 2HE LYS 28 5.189 10.879 -3.120
47 HE3 LYS 28 1HE LYS 28 5.549 12.367 -4.018
48 HZ1 LYS 28 3HZ LYS 28 7.666 11.028 -2.465
49 HZ2 LYS 28 1HZ LYS 28 7.814 12.066 -3.798
50 HZ3 LYS 28 2HZ LYS 28 7.282 10.468 -4.021
51 H LYS 29 H LYS 29 2.062 10.817 1.736
52 HA LYS 29 HA LYS 29 0.784 11.972 3.889
53 HB2 LYS 29 2HB LYS 29 1.325 9.500 3.191
54 HB3 LYS 29 1HB LYS 29 2.700 9.686 4.281
55 HG2 LYS 29 2HG LYS 29 1.190 8.992 5.851
56 HG3 LYS 29 1HG LYS 29 0.729 10.694 5.844
57 HD2 LYS 29 2HD LYS 29 -0.589 9.285 3.687
58 HD3 LYS 29 1HD LYS 29 -0.920 8.497 5.230
59 HE2 LYS 29 2HE LYS 29 -1.315 11.450 4.624
60 HE3 LYS 29 1HE LYS 29 -2.599 10.247 4.853
61 HZ1 LYS 29 3HZ LYS 29 -0.856 9.957 6.989
62 HZ2 LYS 29 1HZ LYS 29 -2.428 10.592 7.030
63 HZ3 LYS 29 2HZ LYS 29 -1.099 11.630 6.823
64 H LYS 30 H LYS 30 1.450 13.362 5.494
65 HA LYS 30 HA LYS 30 3.955 14.534 5.721
66 HB2 LYS 30 2HB LYS 30 3.095 15.300 7.849
67 HB3 LYS 30 1HB LYS 30 1.735 15.159 6.737
68 HG2 LYS 30 2HG LYS 30 0.747 13.845 8.276
69 HG3 LYS 30 1HG LYS 30 1.952 12.621 7.877
70 HD2 LYS 30 2HD LYS 30 3.240 13.082 9.735
71 HD3 LYS 30 1HD LYS 30 2.753 14.777 9.782
72 HE2 LYS 30 2HE LYS 30 0.572 14.187 10.688
73 HE3 LYS 30 1HE LYS 30 0.922 12.456 10.498
74 HZ1 LYS 30 3HZ LYS 30 2.018 14.372 12.416
75 HZ2 LYS 30 1HZ LYS 30 3.075 13.189 11.817
76 HZ3 LYS 30 2HZ LYS 30 1.651 12.726 12.620
77 H GLY 31 H GLY 31 5.857 14.005 6.872
78 HA2 GLY 31 2HA GLY 31 6.100 12.109 8.907
79 HA3 GLY 31 1HA GLY 31 6.432 11.298 7.384
80 HA PRO 32 HA PRO 32 10.299 13.316 8.965
81 HB2 PRO 32 2HB PRO 32 11.865 11.111 8.732
82 HB3 PRO 32 1HB PRO 32 10.943 11.515 10.200
83 HG2 PRO 32 2HG PRO 32 10.269 9.645 7.999
84 HG3 PRO 32 1HG PRO 32 10.086 9.447 9.748
85 HD2 PRO 32 2HD PRO 32 8.008 10.060 8.151
86 HD3 PRO 32 1HD PRO 32 8.136 10.668 9.819
87 H GLU 33 H GLU 33 12.332 13.626 7.677
88 HA GLU 33 HA GLU 33 11.768 13.502 4.834
89 HB2 GLU 33 2HB GLU 33 12.753 15.538 5.023
90 HB3 GLU 33 1HB GLU 33 12.968 15.163 6.734
91 HG2 GLU 33 2HG GLU 33 15.170 15.351 6.355
92 HG3 GLU 33 1HG GLU 33 15.072 13.800 5.545
93 H LYS 34 H LYS 34 12.799 11.425 6.779
94 HA LYS 34 HA LYS 34 15.324 10.450 6.004
95 HB2 LYS 34 2HB LYS 34 13.014 9.791 7.542
96 HB3 LYS 34 1HB LYS 34 13.550 8.372 6.683
97 HG2 LYS 34 2HG LYS 34 15.639 10.038 7.981
98 HG3 LYS 34 1HG LYS 34 14.584 9.118 9.051
99 HD2 LYS 34 2HD LYS 34 15.151 7.044 7.869
100 HD3 LYS 34 1HD LYS 34 16.169 7.949 6.746
101 HE2 LYS 34 2HE LYS 34 17.877 7.577 8.200
102 HE3 LYS 34 1HE LYS 34 17.072 8.725 9.287
103 HZ1 LYS 34 3HZ LYS 34 15.634 6.836 10.005
104 HZ2 LYS 34 1HZ LYS 34 17.262 6.678 10.455
105 HZ3 LYS 34 2HZ LYS 34 16.656 5.790 9.141
106 H THR 35 H THR 35 15.832 8.793 4.425
107 HA THR 35 HA THR 35 13.779 7.698 2.723
108 HB THR 35 HB THR 35 15.589 9.263 1.104
109 HG1 THR 35 1HG THR 35 15.414 11.037 2.185
110 HG21 THR 35 3HG2 THR 35 13.469 8.088 0.400
111 HG22 THR 35 1HG2 THR 35 13.585 9.773 -0.105
112 HG23 THR 35 2HG2 THR 35 12.582 9.333 1.278
113 H ASP 36 H ASP 36 17.163 8.065 3.486
114 HA ASP 36 HA ASP 36 17.878 5.878 1.607
115 HB2 ASP 36 2HB ASP 36 19.266 7.873 1.565
116 HB3 ASP 36 1HB ASP 36 19.489 7.781 3.313
117 H GLU 37 H GLU 37 18.950 6.672 4.831
118 HA GLU 37 HA GLU 37 19.432 3.975 5.613
119 HB2 GLU 37 2HB GLU 37 19.307 6.676 6.829
120 HB3 GLU 37 1HB GLU 37 19.123 5.325 7.948
121 HG2 GLU 37 2HG GLU 37 21.343 5.297 5.920
122 HG3 GLU 37 1HG GLU 37 21.530 6.212 7.415
123 H TYR 38 H TYR 38 16.623 5.812 5.259
124 HA TYR 38 HA TYR 38 14.981 4.497 7.246
125 HB2 TYR 38 2HB TYR 38 13.670 6.276 6.790
126 HB3 TYR 38 1HB TYR 38 15.010 6.846 5.813
127 HD1 TYR 38 1HD TYR 38 15.015 5.256 3.431
128 HD2 TYR 38 2HD TYR 38 11.688 6.672 5.732
129 HE1 TYR 38 1HE TYR 38 13.563 5.119 1.424
130 HE2 TYR 38 2HE TYR 38 10.231 6.544 3.731
131 HH TYR 38 HH TYR 38 11.297 5.014 0.788
132 H LEU 39 H LEU 39 15.946 3.785 4.009
133 HA LEU 39 HA LEU 39 13.830 2.353 2.925
134 HB2 LEU 39 2HB LEU 39 16.766 2.356 2.842
135 HB3 LEU 39 1HB LEU 39 16.062 0.806 2.413
136 HG LEU 39 HG LEU 39 16.110 1.837 0.351
137 HD11 LEU 39 1HD1 LEU 39 13.542 3.156 1.106
138 HD12 LEU 39 2HD1 LEU 39 13.662 1.401 1.241
139 HD13 LEU 39 3HD1 LEU 39 13.929 2.185 -0.316
140 HD21 LEU 39 3HD2 LEU 39 15.263 4.419 0.405
141 HD22 LEU 39 1HD2 LEU 39 16.954 3.936 0.544
142 HD23 LEU 39 2HD2 LEU 39 16.013 4.279 1.996
143 H LEU 40 H LEU 40 16.420 0.992 4.973
144 HA LEU 40 HA LEU 40 15.234 -1.548 5.357
145 HB2 LEU 40 2HB LEU 40 17.274 0.177 6.717
146 HB3 LEU 40 1HB LEU 40 16.821 -1.369 7.437
147 HG LEU 40 HG LEU 40 18.800 -1.358 5.783
148 HD11 LEU 40 1HD1 LEU 40 18.374 -3.571 5.849
149 HD12 LEU 40 2HD1 LEU 40 17.117 -3.376 4.626
150 HD13 LEU 40 3HD1 LEU 40 16.716 -3.219 6.337
151 HD21 LEU 40 3HD2 LEU 40 17.732 0.028 4.047
152 HD22 LEU 40 1HD2 LEU 40 16.473 -1.189 3.840
153 HD23 LEU 40 2HD2 LEU 40 18.139 -1.562 3.402
154 H ALA 41 H ALA 41 14.830 1.512 7.051
155 HA ALA 41 HA ALA 41 13.623 0.775 9.425
156 HB1 ALA 41 1HB ALA 41 13.995 3.063 8.049
157 HB2 ALA 41 2HB ALA 41 12.878 2.966 9.412
158 HB3 ALA 41 3HB ALA 41 12.267 2.848 7.761
159 H ARG 42 H ARG 42 12.245 0.712 6.164
160 HA ARG 42 HA ARG 42 9.678 -0.246 7.086
161 HB2 ARG 42 2HB ARG 42 10.925 0.489 4.459
162 HB3 ARG 42 1HB ARG 42 9.302 -0.192 4.552
163 HG2 ARG 42 2HG ARG 42 9.538 1.908 6.496
164 HG3 ARG 42 1HG ARG 42 10.075 2.516 4.932
165 HD2 ARG 42 2HD ARG 42 7.980 2.376 4.015
166 HD3 ARG 42 1HD ARG 42 7.597 0.873 4.877
167 HE ARG 42 HE ARG 42 7.468 3.604 6.082
168 HH11 ARG 42 1HH1 ARG 42 4.922 2.213 5.763
169 HH12 ARG 42 2HH1 ARG 42 4.712 1.397 7.277
170 HH21 ARG 42 1HH2 ARG 42 8.044 1.691 8.198
171 HH22 ARG 42 2HH2 ARG 42 6.480 1.105 8.657
172 H PHE 43 H PHE 43 12.625 -1.584 5.886
173 HA PHE 43 HA PHE 43 12.008 -3.856 4.483
174 HB2 PHE 43 2HB PHE 43 14.034 -2.982 6.410
175 HB3 PHE 43 1HB PHE 43 13.853 -4.728 6.350
176 HD1 PHE 43 1HD PHE 43 13.686 -1.975 3.791
177 HD2 PHE 43 2HD PHE 43 15.441 -5.711 4.979
178 HE1 PHE 43 1HE PHE 43 15.002 -2.026 1.690
179 HE2 PHE 43 2HE PHE 43 16.756 -5.763 2.878
180 HZ PHE 43 HZ PHE 43 16.538 -3.920 1.233
181 H LYS 44 H LYS 44 11.676 -3.495 8.041
182 HA LYS 44 HA LYS 44 10.792 -6.147 8.444
183 HB2 LYS 44 2HB LYS 44 10.894 -3.610 9.999
184 HB3 LYS 44 1HB LYS 44 10.108 -5.037 10.684
185 HG2 LYS 44 2HG LYS 44 12.493 -4.944 11.303
186 HG3 LYS 44 1HG LYS 44 12.133 -6.352 10.306
187 HD2 LYS 44 2HD LYS 44 13.061 -5.340 8.366
188 HD3 LYS 44 1HD LYS 44 13.150 -3.762 9.148
189 HE2 LYS 44 2HE LYS 44 14.602 -5.957 10.533
190 HE3 LYS 44 1HE LYS 44 15.288 -5.421 8.987
191 HZ1 LYS 44 3HZ LYS 44 15.772 -3.405 9.802
192 HZ2 LYS 44 1HZ LYS 44 15.636 -4.130 11.328
193 HZ3 LYS 44 2HZ LYS 44 14.317 -3.284 10.671
194 H GLY 45 H GLY 45 9.244 -4.091 6.669
195 HA2 GLY 45 2HA GLY 45 6.585 -4.173 7.906
196 HA3 GLY 45 1HA GLY 45 6.986 -3.406 6.379
197 H ASP 46 H ASP 46 6.737 -4.549 4.512
198 HA ASP 46 HA ASP 46 5.187 -7.006 4.656
199 HB2 ASP 46 2HB ASP 46 6.372 -5.883 2.140
200 HB3 ASP 46 1HB ASP 46 4.785 -6.591 2.410
201 H GLY 47 H GLY 47 7.927 -7.334 5.686
202 HA2 GLY 47 2HA GLY 47 9.236 -8.889 3.511
203 HA3 GLY 47 1HA GLY 47 10.011 -8.390 5.015
204 H VAL 48 H VAL 48 8.752 -9.252 6.965
205 HA VAL 48 HA VAL 48 9.086 -11.989 7.257
206 HB VAL 48 HB VAL 48 8.886 -10.847 9.263
207 HG11 VAL 48 1HG1 VAL 48 8.290 -8.683 8.812
208 HG12 VAL 48 2HG1 VAL 48 6.756 -9.241 9.482
209 HG13 VAL 48 3HG1 VAL 48 6.978 -9.162 7.734
210 HG21 VAL 48 3HG2 VAL 48 6.788 -11.291 10.349
211 HG22 VAL 48 1HG2 VAL 48 7.176 -12.648 9.291
212 HG23 VAL 48 2HG2 VAL 48 5.981 -11.451 8.788
213 H LYS 49 H LYS 49 6.120 -10.216 6.444
214 HA LYS 49 HA LYS 49 4.173 -12.115 6.535
215 HB2 LYS 49 2HB LYS 49 3.365 -10.905 4.391
216 HB3 LYS 49 1HB LYS 49 3.631 -9.954 5.850
217 HG2 LYS 49 2HG LYS 49 5.237 -8.750 4.862
218 HG3 LYS 49 1HG LYS 49 6.074 -10.184 4.299
219 HD2 LYS 49 2HD LYS 49 5.287 -8.741 2.416
220 HD3 LYS 49 1HD LYS 49 4.568 -10.350 2.375
221 HE2 LYS 49 2HE LYS 49 2.539 -9.460 3.513
222 HE3 LYS 49 1HE LYS 49 3.254 -7.836 3.471
223 HZ1 LYS 49 3HZ LYS 49 2.139 -9.410 1.313
224 HZ2 LYS 49 1HZ LYS 49 3.623 -8.675 0.946
225 HZ3 LYS 49 2HZ LYS 49 2.309 -7.726 1.452
226 H TYR 50 H TYR 50 6.116 -11.697 3.499
227 HA TYR 50 HA TYR 50 5.200 -14.300 2.616
228 HB2 TYR 50 2HB TYR 50 6.370 -13.622 0.593
229 HB3 TYR 50 1HB TYR 50 5.320 -12.340 1.178
230 HD1 TYR 50 1HD TYR 50 8.845 -13.522 1.738
231 HD2 TYR 50 2HD TYR 50 6.181 -10.220 1.103
232 HE1 TYR 50 1HE TYR 50 10.779 -11.973 1.746
233 HE2 TYR 50 2HE TYR 50 8.125 -8.667 1.092
234 HH TYR 50 HH TYR 50 10.851 -9.126 0.511
235 H LYS 51 H LYS 51 8.083 -12.885 4.046
236 HA LYS 51 HA LYS 51 9.996 -14.831 3.368
237 HB2 LYS 51 2HB LYS 51 9.529 -12.772 5.386
238 HB3 LYS 51 1HB LYS 51 10.509 -14.101 5.999
239 HG2 LYS 51 2HG LYS 51 11.202 -13.113 3.290
240 HG3 LYS 51 1HG LYS 51 11.557 -12.021 4.628
241 HD2 LYS 51 2HD LYS 51 12.979 -13.601 5.685
242 HD3 LYS 51 1HD LYS 51 12.371 -14.929 4.694
243 HE2 LYS 51 2HE LYS 51 14.515 -14.351 3.769
244 HE3 LYS 51 1HE LYS 51 13.317 -13.632 2.672
245 HZ1 LYS 51 3HZ LYS 51 14.691 -12.266 4.928
246 HZ2 LYS 51 1HZ LYS 51 13.448 -11.581 3.999
247 HZ3 LYS 51 2HZ LYS 51 14.933 -11.969 3.272
248 H ALA 52 H ALA 52 7.687 -14.750 5.965
249 HA ALA 52 HA ALA 52 8.317 -17.224 7.176
250 HB1 ALA 52 1HB ALA 52 5.533 -16.244 7.177
251 HB2 ALA 52 2HB ALA 52 6.757 -15.098 7.724
252 HB3 ALA 52 3HB ALA 52 6.571 -16.648 8.544
253 H LYS 53 H LYS 53 5.690 -16.338 5.070
254 HA LYS 53 HA LYS 53 4.598 -18.892 4.620
255 HB2 LYS 53 2HB LYS 53 4.620 -16.230 3.238
256 HB3 LYS 53 1HB LYS 53 3.802 -17.594 2.486
257 HG2 LYS 53 2HG LYS 53 3.085 -17.551 5.249
258 HG3 LYS 53 1HG LYS 53 2.852 -15.930 4.592
259 HD2 LYS 53 2HD LYS 53 1.025 -16.592 3.443
260 HD3 LYS 53 1HD LYS 53 1.917 -17.925 2.709
261 HE2 LYS 53 2HE LYS 53 -0.102 -18.568 4.189
262 HE3 LYS 53 1HE LYS 53 1.431 -19.386 4.556
263 HZ1 LYS 53 3HZ LYS 53 1.743 -18.184 6.430
264 HZ2 LYS 53 1HZ LYS 53 0.052 -18.063 6.394
265 HZ3 LYS 53 2HZ LYS 53 1.005 -16.789 5.801
266 H LEU 54 H LEU 54 6.787 -17.022 2.423
267 HA LEU 54 HA LEU 54 7.112 -18.896 0.438
268 HB2 LEU 54 2HB LEU 54 8.929 -16.920 1.743
269 HB3 LEU 54 1HB LEU 54 9.290 -17.708 0.196
270 HG LEU 54 HG LEU 54 6.849 -16.075 0.861
271 HD11 LEU 54 1HD1 LEU 54 8.049 -15.106 -1.411
272 HD12 LEU 54 2HD1 LEU 54 9.417 -15.577 -0.401
273 HD13 LEU 54 3HD1 LEU 54 8.220 -14.434 0.209
274 HD21 LEU 54 3HD2 LEU 54 7.490 -17.958 -1.375
275 HD22 LEU 54 1HD2 LEU 54 6.513 -16.528 -1.717
276 HD23 LEU 54 2HD2 LEU 54 5.966 -17.707 -0.525
277 H ILE 55 H ILE 55 8.473 -18.808 3.634
278 HA ILE 55 HA ILE 55 10.458 -20.789 3.328
279 HB ILE 55 HB ILE 55 9.210 -18.937 5.180
280 HG12 ILE 55 2HG1 ILE 55 11.321 -18.260 5.571
281 HG13 ILE 55 1HG1 ILE 55 12.017 -19.873 5.420
282 HG21 ILE 55 1HG2 ILE 55 10.161 -21.563 6.122
283 HG22 ILE 55 2HG2 ILE 55 8.674 -20.695 6.507
284 HG23 ILE 55 3HG2 ILE 55 10.221 -20.122 7.138
285 HD11 ILE 55 3HD1 ILE 55 10.796 -18.480 3.045
286 HD12 ILE 55 1HD1 ILE 55 12.008 -19.761 3.068
287 HD13 ILE 55 2HD1 ILE 55 12.452 -18.120 3.531
288 H GLY 56 H GLY 56 7.383 -20.710 5.104
289 HA2 GLY 56 2HA GLY 56 5.705 -22.459 4.912
290 HA3 GLY 56 1HA GLY 56 7.011 -23.542 4.541
291 H ILE 57 H ILE 57 6.595 -21.253 7.147
292 HA ILE 57 HA ILE 57 7.656 -22.965 9.118
293 HB ILE 57 HB ILE 57 7.172 -20.972 10.469
294 HG12 ILE 57 2HG1 ILE 57 6.396 -19.334 8.181
295 HG13 ILE 57 1HG1 ILE 57 5.174 -20.552 8.554
296 HG21 ILE 57 1HG2 ILE 57 8.937 -21.352 8.376
297 HG22 ILE 57 2HG2 ILE 57 9.050 -20.090 9.603
298 HG23 ILE 57 3HG2 ILE 57 8.260 -19.754 8.062
299 HD11 ILE 57 3HD1 ILE 57 5.550 -18.111 9.878
300 HD12 ILE 57 1HD1 ILE 57 6.206 -19.323 10.977
301 HD13 ILE 57 2HD1 ILE 57 4.538 -19.452 10.416
302 H ASP 58 H ASP 58 5.390 -21.460 10.540
303 HA ASP 58 HA ASP 58 2.949 -22.844 10.140
304 HB2 ASP 58 2HB ASP 58 4.737 -24.597 10.974
305 HB3 ASP 58 1HB ASP 58 4.391 -23.891 12.559
Start of MODEL 12
1 H SER 24 H SER 24 -3.441 22.572 -2.536
2 HA SER 24 HA SER 24 -3.639 24.659 -0.587
3 HB2 SER 24 2HB SER 24 -4.995 22.611 0.364
4 HB3 SER 24 1HB SER 24 -3.397 21.964 0.727
5 HG SER 24 HG SER 24 -4.691 24.254 1.715
6 H LYS 25 H LYS 25 -1.620 24.187 1.100
7 HA LYS 25 HA LYS 25 0.753 24.357 -0.352
8 HB2 LYS 25 2HB LYS 25 0.615 25.015 1.950
9 HB3 LYS 25 1HB LYS 25 0.129 23.393 2.445
10 HG2 LYS 25 2HG LYS 25 2.284 22.815 2.712
11 HG3 LYS 25 1HG LYS 25 2.599 23.189 1.017
12 HD2 LYS 25 2HD LYS 25 2.504 25.697 2.016
13 HD3 LYS 25 1HD LYS 25 3.091 24.836 3.439
14 HE2 LYS 25 2HE LYS 25 4.925 23.855 2.092
15 HE3 LYS 25 1HE LYS 25 4.347 24.750 0.672
16 HZ1 LYS 25 3HZ LYS 25 4.751 26.211 3.182
17 HZ2 LYS 25 1HZ LYS 25 4.900 26.756 1.583
18 HZ3 LYS 25 2HZ LYS 25 6.124 25.798 2.269
19 H LYS 26 H LYS 26 0.857 22.677 -1.981
20 HA LYS 26 HA LYS 26 0.528 19.911 -1.564
21 HB2 LYS 26 2HB LYS 26 2.339 21.487 -3.415
22 HB3 LYS 26 1HB LYS 26 1.976 19.771 -3.614
23 HG2 LYS 26 2HG LYS 26 -0.313 21.678 -3.322
24 HG3 LYS 26 1HG LYS 26 0.535 21.621 -4.869
25 HD2 LYS 26 2HD LYS 26 -0.822 19.868 -5.344
26 HD3 LYS 26 1HD LYS 26 0.226 18.946 -4.266
27 HE2 LYS 26 2HE LYS 26 -1.740 18.536 -3.146
28 HE3 LYS 26 1HE LYS 26 -1.452 20.147 -2.460
29 HZ1 LYS 26 3HZ LYS 26 -2.707 21.143 -4.215
30 HZ2 LYS 26 1HZ LYS 26 -3.663 19.921 -3.530
31 HZ3 LYS 26 2HZ LYS 26 -2.884 19.655 -5.016
32 H GLU 27 H GLU 27 3.094 18.870 -2.417
33 HA GLU 27 HA GLU 27 5.258 19.607 -0.774
34 HB2 GLU 27 2HB GLU 27 3.774 19.073 1.075
35 HB3 GLU 27 1HB GLU 27 3.375 17.517 0.348
36 HG2 GLU 27 2HG GLU 27 5.131 16.583 1.390
37 HG3 GLU 27 1HG GLU 27 6.212 17.689 0.540
38 H LYS 28 H LYS 28 6.283 18.957 -2.796
39 HA LYS 28 HA LYS 28 6.034 16.347 -3.917
40 HB2 LYS 28 2HB LYS 28 7.683 17.139 -5.395
41 HB3 LYS 28 1HB LYS 28 6.903 18.617 -4.843
42 HG2 LYS 28 2HG LYS 28 9.409 17.468 -3.578
43 HG3 LYS 28 1HG LYS 28 9.419 18.722 -4.816
44 HD2 LYS 28 2HD LYS 28 8.073 20.185 -3.369
45 HD3 LYS 28 1HD LYS 28 8.028 18.931 -2.130
46 HE2 LYS 28 2HE LYS 28 9.801 20.678 -1.717
47 HE3 LYS 28 1HE LYS 28 10.466 19.041 -1.879
48 HZ1 LYS 28 3HZ LYS 28 11.354 19.493 -3.887
49 HZ2 LYS 28 1HZ LYS 28 11.301 21.101 -3.351
50 HZ3 LYS 28 2HZ LYS 28 10.072 20.502 -4.358
51 H LYS 29 H LYS 29 7.652 17.427 -1.091
52 HA LYS 29 HA LYS 29 10.004 16.027 -0.874
53 HB2 LYS 29 2HB LYS 29 7.753 16.747 0.931
54 HB3 LYS 29 1HB LYS 29 8.949 15.620 1.569
55 HG2 LYS 29 2HG LYS 29 10.579 17.476 0.424
56 HG3 LYS 29 1HG LYS 29 9.224 18.493 0.913
57 HD2 LYS 29 2HD LYS 29 9.398 17.258 3.192
58 HD3 LYS 29 1HD LYS 29 11.004 16.779 2.639
59 HE2 LYS 29 2HE LYS 29 11.495 19.229 2.209
60 HE3 LYS 29 1HE LYS 29 9.966 19.605 3.028
61 HZ1 LYS 29 3HZ LYS 29 10.776 18.153 4.884
62 HZ2 LYS 29 1HZ LYS 29 11.633 19.605 4.692
63 HZ3 LYS 29 2HZ LYS 29 12.302 18.145 4.134
64 H LYS 30 H LYS 30 10.346 13.946 -1.605
65 HA LYS 30 HA LYS 30 8.467 11.898 -1.934
66 HB2 LYS 30 2HB LYS 30 11.427 12.119 -1.547
67 HB3 LYS 30 1HB LYS 30 10.701 10.511 -1.586
68 HG2 LYS 30 2HG LYS 30 10.296 10.629 -3.814
69 HG3 LYS 30 1HG LYS 30 9.706 12.287 -3.702
70 HD2 LYS 30 2HD LYS 30 12.264 12.827 -3.281
71 HD3 LYS 30 1HD LYS 30 12.501 11.296 -4.123
72 HE2 LYS 30 2HE LYS 30 12.517 12.990 -5.831
73 HE3 LYS 30 1HE LYS 30 10.912 12.237 -5.930
74 HZ1 LYS 30 3HZ LYS 30 9.957 13.955 -4.672
75 HZ2 LYS 30 1HZ LYS 30 10.953 14.750 -5.790
76 HZ3 LYS 30 2HZ LYS 30 11.465 14.563 -4.181
77 H GLY 31 H GLY 31 9.225 9.671 -0.556
78 HA2 GLY 31 2HA GLY 31 7.806 9.764 1.837
79 HA3 GLY 31 1HA GLY 31 8.993 8.522 1.464
80 HA PRO 32 HA PRO 32 10.464 10.928 5.121
81 HB2 PRO 32 2HB PRO 32 11.212 8.741 6.547
82 HB3 PRO 32 1HB PRO 32 9.577 9.443 6.604
83 HG2 PRO 32 2HG PRO 32 10.590 7.139 5.031
84 HG3 PRO 32 1HG PRO 32 9.079 7.312 5.937
85 HD2 PRO 32 2HD PRO 32 9.171 7.553 3.261
86 HD3 PRO 32 1HD PRO 32 8.055 8.518 4.258
87 H GLU 33 H GLU 33 12.716 11.203 5.763
88 HA GLU 33 HA GLU 33 14.579 10.251 3.766
89 HB2 GLU 33 2HB GLU 33 15.331 12.362 4.144
90 HB3 GLU 33 1HB GLU 33 14.072 12.482 5.377
91 HG2 GLU 33 2HG GLU 33 16.014 12.966 6.581
92 HG3 GLU 33 1HG GLU 33 15.756 11.257 6.921
93 H LYS 34 H LYS 34 13.406 8.953 6.262
94 HA LYS 34 HA LYS 34 15.547 8.078 7.925
95 HB2 LYS 34 2HB LYS 34 12.731 7.895 7.561
96 HB3 LYS 34 1HB LYS 34 13.361 6.288 7.828
97 HG2 LYS 34 2HG LYS 34 14.430 8.445 9.552
98 HG3 LYS 34 1HG LYS 34 12.752 7.978 9.830
99 HD2 LYS 34 2HD LYS 34 13.419 5.641 10.133
100 HD3 LYS 34 1HD LYS 34 15.097 6.054 9.773
101 HE2 LYS 34 2HE LYS 34 13.600 7.400 12.033
102 HE3 LYS 34 1HE LYS 34 14.479 5.878 12.270
103 HZ1 LYS 34 3HZ LYS 34 16.480 6.845 11.551
104 HZ2 LYS 34 1HZ LYS 34 15.808 7.990 12.607
105 HZ3 LYS 34 2HZ LYS 34 15.700 8.220 10.928
106 H THR 35 H THR 35 16.403 5.817 7.938
107 HA THR 35 HA THR 35 15.916 4.087 5.693
108 HB THR 35 HB THR 35 18.684 4.790 5.603
109 HG1 THR 35 1HG THR 35 18.122 6.902 4.588
110 HG21 THR 35 3HG2 THR 35 16.754 5.368 3.403
111 HG22 THR 35 1HG2 THR 35 16.992 3.692 3.897
112 HG23 THR 35 2HG2 THR 35 18.358 4.643 3.315
113 H ASP 36 H ASP 36 17.856 4.895 8.492
114 HA ASP 36 HA ASP 36 18.930 2.141 8.672
115 HB2 ASP 36 2HB ASP 36 20.510 3.878 9.098
116 HB3 ASP 36 1HB ASP 36 19.375 4.735 10.142
117 H GLU 37 H GLU 37 17.629 4.292 11.094
118 HA GLU 37 HA GLU 37 16.636 2.244 12.786
119 HB2 GLU 37 2HB GLU 37 16.209 5.192 12.409
120 HB3 GLU 37 1HB GLU 37 15.275 4.315 13.622
121 HG2 GLU 37 2HG GLU 37 17.035 4.290 15.030
122 HG3 GLU 37 1HG GLU 37 18.059 3.566 13.790
123 H TYR 38 H TYR 38 15.532 3.545 9.872
124 HA TYR 38 HA TYR 38 12.698 3.019 10.224
125 HB2 TYR 38 2HB TYR 38 12.644 4.473 8.508
126 HB3 TYR 38 1HB TYR 38 14.382 4.615 8.701
127 HD1 TYR 38 2HD TYR 38 15.503 2.174 7.634
128 HD2 TYR 38 1HD TYR 38 12.102 4.426 6.318
129 HE1 TYR 38 2HE TYR 38 15.775 1.267 5.330
130 HE2 TYR 38 1HE TYR 38 12.369 3.526 4.026
131 HH TYR 38 HH TYR 38 15.176 1.650 3.118
132 H LEU 39 H LEU 39 15.467 1.210 9.290
133 HA LEU 39 HA LEU 39 14.608 -0.687 7.469
134 HB2 LEU 39 2HB LEU 39 16.469 -0.478 9.713
135 HB3 LEU 39 1HB LEU 39 15.930 -2.124 9.448
136 HG LEU 39 HG LEU 39 17.141 -2.331 7.538
137 HD11 LEU 39 1HD1 LEU 39 17.417 -0.249 5.964
138 HD12 LEU 39 2HD1 LEU 39 16.094 0.418 6.922
139 HD13 LEU 39 3HD1 LEU 39 15.862 -1.081 6.023
140 HD21 LEU 39 3HD2 LEU 39 19.180 -1.332 7.790
141 HD22 LEU 39 1HD2 LEU 39 18.474 -0.831 9.327
142 HD23 LEU 39 2HD2 LEU 39 18.484 0.281 7.957
143 H LEU 40 H LEU 40 14.266 -0.984 11.021
144 HA LEU 40 HA LEU 40 12.577 -3.252 11.006
145 HB2 LEU 40 2HB LEU 40 13.227 -0.983 12.860
146 HB3 LEU 40 1HB LEU 40 11.995 -2.157 13.323
147 HG LEU 40 HG LEU 40 14.443 -2.627 14.027
148 HD11 LEU 40 1HD1 LEU 40 13.679 -4.736 14.332
149 HD12 LEU 40 2HD1 LEU 40 13.618 -5.029 12.595
150 HD13 LEU 40 3HD1 LEU 40 12.259 -4.252 13.406
151 HD21 LEU 40 3HD2 LEU 40 15.756 -3.835 12.297
152 HD22 LEU 40 1HD2 LEU 40 15.481 -2.150 11.850
153 HD23 LEU 40 2HD2 LEU 40 14.524 -3.430 11.102
154 H ALA 41 H ALA 41 11.848 0.218 10.890
155 HA ALA 41 HA ALA 41 9.122 0.314 11.299
156 HB1 ALA 41 1HB ALA 41 9.875 1.720 8.864
157 HB2 ALA 41 2HB ALA 41 11.141 1.857 10.084
158 HB3 ALA 41 3HB ALA 41 9.500 2.389 10.452
159 H ARG 42 H ARG 42 10.854 -0.950 8.505
160 HA ARG 42 HA ARG 42 8.428 -1.601 7.067
161 HB2 ARG 42 2HB ARG 42 11.359 -1.546 6.595
162 HB3 ARG 42 1HB ARG 42 10.373 -2.558 5.539
163 HG2 ARG 42 2HG ARG 42 8.860 -0.387 5.412
164 HG3 ARG 42 1HG ARG 42 10.364 0.421 5.857
165 HD2 ARG 42 2HD ARG 42 10.239 0.338 3.422
166 HD3 ARG 42 1HD ARG 42 11.482 -0.818 3.939
167 HE ARG 42 HE ARG 42 8.804 -1.981 3.801
168 HH11 ARG 42 1HH2 ARG 42 11.568 -3.246 3.246
169 HH12 ARG 42 2HH2 ARG 42 11.422 -3.578 1.552
170 HH21 ARG 42 1HH1 ARG 42 8.666 -1.518 1.116
171 HH22 ARG 42 2HH1 ARG 42 9.782 -2.597 0.345
172 H PHE 43 H PHE 43 10.612 -3.181 9.212
173 HA PHE 43 HA PHE 43 10.834 -5.794 8.471
174 HB2 PHE 43 2HB PHE 43 10.527 -4.277 10.945
175 HB3 PHE 43 1HB PHE 43 9.973 -5.933 11.109
176 HD1 PHE 43 1HD PHE 43 12.708 -4.435 9.031
177 HD2 PHE 43 2HD PHE 43 11.656 -7.128 12.209
178 HE1 PHE 43 1HE PHE 43 15.059 -5.215 9.151
179 HE2 PHE 43 2HE PHE 43 14.007 -7.908 12.329
180 HZ PHE 43 HZ PHE 43 15.709 -6.950 10.800
181 H LYS 44 H LYS 44 7.951 -4.714 10.339
182 HA LYS 44 HA LYS 44 6.498 -7.059 9.681
183 HB2 LYS 44 2HB LYS 44 6.033 -4.506 11.136
184 HB3 LYS 44 1HB LYS 44 4.687 -5.616 10.857
185 HG2 LYS 44 2HG LYS 44 5.812 -6.074 13.006
186 HG3 LYS 44 1HG LYS 44 5.947 -7.432 11.891
187 HD2 LYS 44 2HD LYS 44 8.201 -6.953 11.396
188 HD3 LYS 44 1HD LYS 44 8.087 -5.327 12.070
189 HE2 LYS 44 2HE LYS 44 7.852 -7.885 13.695
190 HE3 LYS 44 1HE LYS 44 9.293 -6.852 13.622
191 HZ1 LYS 44 3HZ LYS 44 6.796 -6.411 14.994
192 HZ2 LYS 44 1HZ LYS 44 7.300 -5.081 14.070
193 HZ3 LYS 44 2HZ LYS 44 8.321 -5.716 15.269
194 H GLY 45 H GLY 45 7.260 -4.870 7.614
195 HA2 GLY 45 2HA GLY 45 4.602 -4.230 6.511
196 HA3 GLY 45 1HA GLY 45 6.137 -3.622 5.911
197 H ASP 46 H ASP 46 7.145 -4.706 4.296
198 HA ASP 46 HA ASP 46 5.745 -7.078 3.181
199 HB2 ASP 46 2HB ASP 46 7.659 -5.988 1.365
200 HB3 ASP 46 1HB ASP 46 5.904 -5.949 1.253
201 H GLY 47 H GLY 47 7.150 -8.011 5.116
202 HA2 GLY 47 2HA GLY 47 9.549 -9.192 3.839
203 HA3 GLY 47 1HA GLY 47 9.764 -8.400 5.401
204 H VAL 48 H VAL 48 8.604 -9.248 7.203
205 HA VAL 48 HA VAL 48 8.755 -11.977 7.655
206 HB VAL 48 HB VAL 48 8.566 -10.644 9.563
207 HG11 VAL 48 1HG1 VAL 48 6.257 -9.125 9.469
208 HG12 VAL 48 2HG1 VAL 48 6.877 -9.011 7.824
209 HG13 VAL 48 3HG1 VAL 48 7.889 -8.529 9.184
210 HG21 VAL 48 3HG2 VAL 48 5.683 -11.336 9.070
211 HG22 VAL 48 1HG2 VAL 48 6.440 -11.028 10.632
212 HG23 VAL 48 2HG2 VAL 48 6.891 -12.458 9.700
213 H LYS 49 H LYS 49 5.887 -10.092 6.731
214 HA LYS 49 HA LYS 49 3.866 -11.906 6.861
215 HB2 LYS 49 2HB LYS 49 3.144 -10.721 4.652
216 HB3 LYS 49 1HB LYS 49 3.379 -9.767 6.112
217 HG2 LYS 49 2HG LYS 49 5.039 -8.590 5.165
218 HG3 LYS 49 1HG LYS 49 5.867 -10.054 4.644
219 HD2 LYS 49 2HD LYS 49 5.254 -8.777 2.669
220 HD3 LYS 49 1HD LYS 49 4.244 -10.219 2.737
221 HE2 LYS 49 2HE LYS 49 2.871 -8.255 4.243
222 HE3 LYS 49 1HE LYS 49 3.408 -7.456 2.751
223 HZ1 LYS 49 3HZ LYS 49 2.294 -8.932 1.437
224 HZ2 LYS 49 1HZ LYS 49 1.253 -8.932 2.776
225 HZ3 LYS 49 2HZ LYS 49 2.374 -10.192 2.574
226 H TYR 50 H TYR 50 5.848 -11.660 3.825
227 HA TYR 50 HA TYR 50 4.848 -14.292 3.056
228 HB2 TYR 50 2HB TYR 50 5.974 -13.680 0.966
229 HB3 TYR 50 1HB TYR 50 4.896 -12.406 1.524
230 HD1 TYR 50 1HD TYR 50 8.461 -13.501 1.934
231 HD2 TYR 50 2HD TYR 50 5.684 -10.263 1.528
232 HE1 TYR 50 1HE TYR 50 10.351 -11.894 1.937
233 HE2 TYR 50 2HE TYR 50 7.565 -8.647 1.527
234 HH TYR 50 HH TYR 50 9.913 -8.557 1.118
235 H LYS 51 H LYS 51 7.818 -12.835 4.283
236 HA LYS 51 HA LYS 51 9.772 -14.648 3.545
237 HB2 LYS 51 2HB LYS 51 9.183 -12.866 5.781
238 HB3 LYS 51 1HB LYS 51 10.241 -14.194 6.220
239 HG2 LYS 51 2HG LYS 51 10.833 -12.799 3.663
240 HG3 LYS 51 1HG LYS 51 11.196 -11.932 5.155
241 HD2 LYS 51 2HD LYS 51 12.557 -13.807 5.949
242 HD3 LYS 51 1HD LYS 51 12.151 -14.735 4.506
243 HE2 LYS 51 2HE LYS 51 13.108 -12.292 3.511
244 HE3 LYS 51 1HE LYS 51 14.208 -12.708 4.842
245 HZ1 LYS 51 3HZ LYS 51 13.425 -14.411 2.542
246 HZ2 LYS 51 1HZ LYS 51 14.202 -15.023 3.919
247 HZ3 LYS 51 2HZ LYS 51 14.984 -13.870 2.947
248 H ALA 52 H ALA 52 7.775 -14.918 6.386
249 HA ALA 52 HA ALA 52 8.458 -17.458 7.274
250 HB1 ALA 52 1HB ALA 52 6.729 -15.490 7.958
251 HB2 ALA 52 2HB ALA 52 6.702 -17.093 8.693
252 HB3 ALA 52 3HB ALA 52 5.608 -16.713 7.363
253 H LYS 53 H LYS 53 5.769 -16.623 5.232
254 HA LYS 53 HA LYS 53 4.912 -19.250 4.627
255 HB2 LYS 53 2HB LYS 53 4.563 -16.509 3.435
256 HB3 LYS 53 1HB LYS 53 3.749 -17.912 2.756
257 HG2 LYS 53 2HG LYS 53 3.357 -18.094 5.536
258 HG3 LYS 53 1HG LYS 53 3.079 -16.401 5.126
259 HD2 LYS 53 2HD LYS 53 1.551 -17.167 3.282
260 HD3 LYS 53 1HD LYS 53 1.733 -18.816 3.883
261 HE2 LYS 53 2HE LYS 53 0.755 -16.510 5.602
262 HE3 LYS 53 1HE LYS 53 -0.321 -17.657 4.781
263 HZ1 LYS 53 3HZ LYS 53 0.117 -18.510 6.951
264 HZ2 LYS 53 1HZ LYS 53 1.789 -18.287 6.775
265 HZ3 LYS 53 2HZ LYS 53 0.988 -19.465 5.848
266 H LEU 54 H LEU 54 6.785 -16.962 2.528
267 HA LEU 54 HA LEU 54 7.129 -18.543 0.321
268 HB2 LEU 54 2HB LEU 54 8.888 -16.611 1.762
269 HB3 LEU 54 1HB LEU 54 9.203 -17.178 0.113
270 HG LEU 54 HG LEU 54 6.744 -15.767 1.119
271 HD11 LEU 54 1HD1 LEU 54 9.142 -14.847 0.112
272 HD12 LEU 54 2HD1 LEU 54 7.630 -13.942 0.176
273 HD13 LEU 54 3HD1 LEU 54 8.067 -14.828 -1.285
274 HD21 LEU 54 3HD2 LEU 54 5.775 -17.284 -0.335
275 HD22 LEU 54 1HD2 LEU 54 7.229 -17.423 -1.323
276 HD23 LEU 54 2HD2 LEU 54 6.200 -15.996 -1.463
277 H ILE 55 H ILE 55 8.530 -18.904 3.457
278 HA ILE 55 HA ILE 55 10.725 -20.549 2.795
279 HB ILE 55 HB ILE 55 9.292 -19.262 4.950
280 HG12 ILE 55 2HG1 ILE 55 11.319 -18.531 5.571
281 HG13 ILE 55 1HG1 ILE 55 12.160 -20.006 5.090
282 HG21 ILE 55 1HG2 ILE 55 10.394 -20.763 6.649
283 HG22 ILE 55 2HG2 ILE 55 10.400 -21.958 5.348
284 HG23 ILE 55 3HG2 ILE 55 8.876 -21.262 5.905
285 HD11 ILE 55 3HD1 ILE 55 12.346 -17.754 3.667
286 HD12 ILE 55 1HD1 ILE 55 10.834 -18.350 2.981
287 HD13 ILE 55 2HD1 ILE 55 12.297 -19.330 2.875
288 H GLY 56 H GLY 56 7.645 -21.210 4.451
289 HA2 GLY 56 2HA GLY 56 6.285 -23.101 3.490
290 HA3 GLY 56 1HA GLY 56 7.798 -23.955 3.472
291 H ILE 57 H ILE 57 6.522 -21.929 5.994
292 HA ILE 57 HA ILE 57 7.043 -23.860 8.000
293 HB ILE 57 HB ILE 57 6.431 -21.951 9.386
294 HG12 ILE 57 2HG1 ILE 57 6.211 -20.099 7.126
295 HG13 ILE 57 1HG1 ILE 57 4.863 -21.231 7.202
296 HG21 ILE 57 1HG2 ILE 57 8.550 -21.350 9.008
297 HG22 ILE 57 2HG2 ILE 57 8.049 -20.505 7.540
298 HG23 ILE 57 3HG2 ILE 57 8.498 -22.210 7.468
299 HD11 ILE 57 3HD1 ILE 57 5.689 -19.130 9.163
300 HD12 ILE 57 1HD1 ILE 57 4.937 -20.600 9.785
301 HD13 ILE 57 2HD1 ILE 57 4.072 -19.589 8.627
302 H ASP 58 H ASP 58 4.643 -22.322 9.060
303 HA ASP 58 HA ASP 58 2.700 -24.475 8.759
304 HB2 ASP 58 2HB ASP 58 3.235 -23.546 10.964
305 HB3 ASP 58 1HB ASP 58 2.739 -21.938 10.415
Start of MODEL 13
1 H SER 24 H SER 24 -10.710 22.568 10.697
2 HA SER 24 HA SER 24 -12.316 23.168 12.990
3 HB2 SER 24 2HB SER 24 -14.175 23.637 11.655
4 HB3 SER 24 1HB SER 24 -13.701 22.477 10.417
5 HG SER 24 HG SER 24 -15.477 22.054 12.173
6 H LYS 25 H LYS 25 -10.385 21.681 13.421
7 HA LYS 25 HA LYS 25 -9.973 19.095 12.564
8 HB2 LYS 25 2HB LYS 25 -9.642 20.637 15.058
9 HB3 LYS 25 1HB LYS 25 -9.619 18.887 15.276
10 HG2 LYS 25 2HG LYS 25 -8.043 19.121 13.074
11 HG3 LYS 25 1HG LYS 25 -7.677 20.642 13.890
12 HD2 LYS 25 2HD LYS 25 -6.305 19.514 15.271
13 HD3 LYS 25 1HD LYS 25 -7.713 18.662 15.906
14 HE2 LYS 25 2HE LYS 25 -6.525 16.831 15.133
15 HE3 LYS 25 1HE LYS 25 -7.352 17.257 13.622
16 HZ1 LYS 25 3HZ LYS 25 -5.202 17.348 12.909
17 HZ2 LYS 25 1HZ LYS 25 -4.586 17.777 14.431
18 HZ3 LYS 25 2HZ LYS 25 -5.361 18.944 13.470
19 H LYS 26 H LYS 26 -11.442 17.456 12.294
20 HA LYS 26 HA LYS 26 -13.992 17.358 13.585
21 HB2 LYS 26 2HB LYS 26 -12.397 15.889 11.628
22 HB3 LYS 26 1HB LYS 26 -13.402 14.819 12.607
23 HG2 LYS 26 2HG LYS 26 -14.904 17.172 11.851
24 HG3 LYS 26 1HG LYS 26 -14.231 16.394 10.417
25 HD2 LYS 26 2HD LYS 26 -16.053 15.040 10.579
26 HD3 LYS 26 1HD LYS 26 -15.109 14.223 11.826
27 HE2 LYS 26 2HE LYS 26 -16.197 15.470 13.583
28 HE3 LYS 26 1HE LYS 26 -16.982 16.543 12.407
29 HZ1 LYS 26 3HZ LYS 26 -17.654 14.112 11.483
30 HZ2 LYS 26 1HZ LYS 26 -18.640 15.049 12.496
31 HZ3 LYS 26 2HZ LYS 26 -17.658 13.831 13.158
32 H GLU 27 H GLU 27 -12.524 17.626 15.786
33 HA GLU 27 HA GLU 27 -11.984 16.642 17.862
34 HB2 GLU 27 2HB GLU 27 -14.234 15.853 17.775
35 HB3 GLU 27 1HB GLU 27 -13.841 14.655 16.543
36 HG2 GLU 27 2HG GLU 27 -14.048 13.513 18.675
37 HG3 GLU 27 1HG GLU 27 -12.345 13.522 18.214
38 H LYS 28 H LYS 28 -10.602 14.987 18.819
39 HA LYS 28 HA LYS 28 -8.345 14.213 17.410
40 HB2 LYS 28 2HB LYS 28 -9.656 13.655 19.927
41 HB3 LYS 28 1HB LYS 28 -8.846 12.205 19.332
42 HG2 LYS 28 2HG LYS 28 -7.081 14.373 18.855
43 HG3 LYS 28 1HG LYS 28 -7.677 14.559 20.505
44 HD2 LYS 28 2HD LYS 28 -6.322 12.131 19.305
45 HD3 LYS 28 1HD LYS 28 -5.731 13.146 20.620
46 HE2 LYS 28 2HE LYS 28 -7.990 12.461 21.796
47 HE3 LYS 28 1HE LYS 28 -7.928 11.096 20.664
48 HZ1 LYS 28 3HZ LYS 28 -6.653 10.970 22.922
49 HZ2 LYS 28 1HZ LYS 28 -5.486 11.880 22.095
50 HZ3 LYS 28 2HZ LYS 28 -5.946 10.354 21.505
51 H LYS 29 H LYS 29 -8.942 13.335 15.310
52 HA LYS 29 HA LYS 29 -10.720 11.336 14.654
53 HB2 LYS 29 2HB LYS 29 -8.825 12.672 13.360
54 HB3 LYS 29 1HB LYS 29 -7.917 11.180 13.606
55 HG2 LYS 29 2HG LYS 29 -9.313 9.940 12.249
56 HG3 LYS 29 1HG LYS 29 -10.719 10.945 12.599
57 HD2 LYS 29 2HD LYS 29 -8.366 11.967 10.999
58 HD3 LYS 29 1HD LYS 29 -9.742 11.163 10.243
59 HE2 LYS 29 2HE LYS 29 -11.199 12.910 10.720
60 HE3 LYS 29 1HE LYS 29 -10.284 13.416 12.154
61 HZ1 LYS 29 3HZ LYS 29 -8.816 13.489 9.658
62 HZ2 LYS 29 1HZ LYS 29 -8.844 14.609 10.931
63 HZ3 LYS 29 2HZ LYS 29 -10.083 14.614 9.768
64 H LYS 30 H LYS 30 -10.847 9.108 14.988
65 HA LYS 30 HA LYS 30 -9.664 7.826 17.147
66 HB2 LYS 30 2HB LYS 30 -10.958 7.044 14.582
67 HB3 LYS 30 1HB LYS 30 -10.150 5.764 15.490
68 HG2 LYS 30 2HG LYS 30 -11.503 6.138 17.417
69 HG3 LYS 30 1HG LYS 30 -12.106 7.670 16.784
70 HD2 LYS 30 2HD LYS 30 -12.588 5.335 15.040
71 HD3 LYS 30 1HD LYS 30 -13.454 5.306 16.577
72 HE2 LYS 30 2HE LYS 30 -14.014 7.820 15.971
73 HE3 LYS 30 1HE LYS 30 -13.687 7.269 14.315
74 HZ1 LYS 30 3HZ LYS 30 -15.534 5.972 16.252
75 HZ2 LYS 30 1HZ LYS 30 -15.186 5.395 14.695
76 HZ3 LYS 30 2HZ LYS 30 -15.999 6.875 14.890
77 H GLY 31 H GLY 31 -8.047 6.001 17.107
78 HA2 GLY 31 2HA GLY 31 -5.802 5.386 16.824
79 HA3 GLY 31 1HA GLY 31 -6.244 5.366 15.120
80 HA PRO 32 HA PRO 32 -2.953 8.545 15.810
81 HB2 PRO 32 2HB PRO 32 -1.388 7.743 13.744
82 HB3 PRO 32 1HB PRO 32 -1.257 7.080 15.390
83 HG2 PRO 32 2HG PRO 32 -2.671 5.990 13.021
84 HG3 PRO 32 1HG PRO 32 -1.659 5.161 14.214
85 HD2 PRO 32 2HD PRO 32 -4.348 5.043 14.286
86 HD3 PRO 32 1HD PRO 32 -3.358 5.038 15.766
87 H GLU 33 H GLU 33 -2.358 10.308 14.247
88 HA GLU 33 HA GLU 33 -4.508 10.749 12.351
89 HB2 GLU 33 2HB GLU 33 -4.304 12.815 13.276
90 HB3 GLU 33 1HB GLU 33 -2.966 12.152 14.220
91 HG2 GLU 33 2HG GLU 33 -1.976 13.963 13.124
92 HG3 GLU 33 1HG GLU 33 -1.528 12.594 12.111
93 H LYS 34 H LYS 34 -1.838 9.263 12.210
94 HA LYS 34 HA LYS 34 -0.428 10.322 9.945
95 HB2 LYS 34 2HB LYS 34 -0.366 8.238 11.912
96 HB3 LYS 34 1HB LYS 34 0.107 7.628 10.353
97 HG2 LYS 34 2HG LYS 34 1.224 10.147 11.578
98 HG3 LYS 34 1HG LYS 34 1.995 8.570 11.749
99 HD2 LYS 34 2HD LYS 34 2.523 8.436 9.467
100 HD3 LYS 34 1HD LYS 34 1.290 9.614 9.018
101 HE2 LYS 34 2HE LYS 34 3.065 10.927 10.817
102 HE3 LYS 34 1HE LYS 34 4.057 10.099 9.599
103 HZ1 LYS 34 3HZ LYS 34 3.476 12.016 8.489
104 HZ2 LYS 34 1HZ LYS 34 1.945 12.113 9.212
105 HZ3 LYS 34 2HZ LYS 34 2.234 10.967 7.992
106 H THR 35 H THR 35 -0.645 9.659 7.790
107 HA THR 35 HA THR 35 -2.134 7.336 7.007
108 HB THR 35 HB THR 35 -3.493 9.637 5.921
109 HG1 THR 35 1HG THR 35 -3.028 10.474 7.981
110 HG21 THR 35 3HG2 THR 35 -4.577 7.377 7.599
111 HG22 THR 35 1HG2 THR 35 -4.204 7.207 5.883
112 HG23 THR 35 2HG2 THR 35 -5.449 8.342 6.407
113 H ASP 36 H ASP 36 -0.511 10.299 6.141
114 HA ASP 36 HA ASP 36 -0.307 9.427 3.306
115 HB2 ASP 36 2HB ASP 36 -0.577 11.896 4.668
116 HB3 ASP 36 1HB ASP 36 1.019 11.897 3.918
117 H GLU 37 H GLU 37 1.911 11.018 5.472
118 HA GLU 37 HA GLU 37 4.251 9.827 4.357
119 HB2 GLU 37 2HB GLU 37 3.465 11.526 6.640
120 HB3 GLU 37 1HB GLU 37 4.950 10.607 6.883
121 HG2 GLU 37 2HG GLU 37 5.052 11.654 4.249
122 HG3 GLU 37 1HG GLU 37 4.552 12.975 5.304
123 H TYR 38 H TYR 38 1.835 8.708 6.425
124 HA TYR 38 HA TYR 38 3.366 6.800 7.961
125 HB2 TYR 38 2HB TYR 38 1.431 6.813 9.128
126 HB3 TYR 38 1HB TYR 38 0.919 8.089 8.034
127 HD1 TYR 38 2HD TYR 38 0.275 6.886 5.548
128 HD2 TYR 38 1HD TYR 38 -0.218 5.303 9.499
129 HE1 TYR 38 2HE TYR 38 -1.537 5.397 4.729
130 HE2 TYR 38 1HE TYR 38 -2.032 3.815 8.693
131 HH TYR 38 HH TYR 38 -2.660 3.355 5.331
132 H LEU 39 H LEU 39 1.974 6.848 4.802
133 HA LEU 39 HA LEU 39 1.364 4.186 4.268
134 HB2 LEU 39 2HB LEU 39 2.314 6.572 2.842
135 HB3 LEU 39 1HB LEU 39 2.733 5.067 2.038
136 HG LEU 39 HG LEU 39 0.645 5.529 1.134
137 HD11 LEU 39 1HD1 LEU 39 -0.366 4.084 3.559
138 HD12 LEU 39 2HD1 LEU 39 0.764 3.294 2.459
139 HD13 LEU 39 3HD1 LEU 39 -0.801 3.849 1.865
140 HD21 LEU 39 3HD2 LEU 39 0.267 6.923 3.686
141 HD22 LEU 39 1HD2 LEU 39 -1.195 6.149 3.072
142 HD23 LEU 39 2HD2 LEU 39 -0.340 7.332 2.081
143 H LEU 40 H LEU 40 4.539 5.753 3.805
144 HA LEU 40 HA LEU 40 6.009 3.395 3.270
145 HB2 LEU 40 2HB LEU 40 6.562 6.178 4.248
146 HB3 LEU 40 1HB LEU 40 7.882 5.014 4.129
147 HG LEU 40 HG LEU 40 7.394 6.507 2.071
148 HD11 LEU 40 1HD1 LEU 40 7.687 4.398 0.559
149 HD12 LEU 40 2HD1 LEU 40 7.718 3.513 2.084
150 HD13 LEU 40 3HD1 LEU 40 8.930 4.753 1.758
151 HD21 LEU 40 3HD2 LEU 40 5.668 5.546 0.548
152 HD22 LEU 40 1HD2 LEU 40 4.963 6.212 2.020
153 HD23 LEU 40 2HD2 LEU 40 5.157 4.468 1.846
154 H ALA 41 H ALA 41 5.192 5.009 6.310
155 HA ALA 41 HA ALA 41 6.863 3.838 8.158
156 HB1 ALA 41 1HB ALA 41 3.963 3.689 8.777
157 HB2 ALA 41 2HB ALA 41 4.527 5.249 8.178
158 HB3 ALA 41 3HB ALA 41 5.245 4.550 9.630
159 H ARG 42 H ARG 42 4.157 2.322 6.456
160 HA ARG 42 HA ARG 42 4.506 -0.211 7.800
161 HB2 ARG 42 2HB ARG 42 2.686 0.845 5.653
162 HB3 ARG 42 1HB ARG 42 2.538 -0.767 6.352
163 HG2 ARG 42 2HG ARG 42 1.766 0.032 8.375
164 HG3 ARG 42 1HG ARG 42 2.668 1.541 8.238
165 HD2 ARG 42 2HD ARG 42 0.426 2.225 7.903
166 HD3 ARG 42 1HD ARG 42 1.027 2.032 6.242
167 HE ARG 42 HE ARG 42 0.133 -0.422 6.552
168 HH11 ARG 42 1HH1 ARG 42 -1.099 0.685 9.210
169 HH12 ARG 42 2HH1 ARG 42 -2.750 0.853 8.716
170 HH21 ARG 42 1HH2 ARG 42 -2.048 0.544 5.335
171 HH22 ARG 42 2HH2 ARG 42 -3.289 0.769 6.523
172 H PHE 43 H PHE 43 5.538 1.288 4.870
173 HA PHE 43 HA PHE 43 5.754 -0.663 2.959
174 HB2 PHE 43 2HB PHE 43 7.315 1.665 3.857
175 HB3 PHE 43 1HB PHE 43 8.230 0.520 2.894
176 HD1 PHE 43 2HD PHE 43 4.627 1.530 2.771
177 HD2 PHE 43 1HD PHE 43 8.403 1.401 0.726
178 HE1 PHE 43 2HE PHE 43 3.546 2.404 0.718
179 HE2 PHE 43 1HE PHE 43 7.321 2.278 -1.326
180 HZ PHE 43 HZ PHE 43 4.893 2.779 -1.329
181 H LYS 44 H LYS 44 8.083 -0.258 5.668
182 HA LYS 44 HA LYS 44 9.584 -2.554 4.998
183 HB2 LYS 44 2HB LYS 44 9.377 -0.624 7.251
184 HB3 LYS 44 1HB LYS 44 10.426 -2.038 7.410
185 HG2 LYS 44 2HG LYS 44 11.622 -0.073 6.481
186 HG3 LYS 44 1HG LYS 44 11.598 -1.442 5.371
187 HD2 LYS 44 2HD LYS 44 9.848 -0.458 4.064
188 HD3 LYS 44 1HD LYS 44 9.599 0.819 5.257
189 HE2 LYS 44 2HE LYS 44 10.922 1.730 3.409
190 HE3 LYS 44 1HE LYS 44 11.981 1.574 4.823
191 HZ1 LYS 44 3HZ LYS 44 12.106 0.191 2.330
192 HZ2 LYS 44 1HZ LYS 44 12.007 -0.900 3.624
193 HZ3 LYS 44 2HZ LYS 44 13.253 0.254 3.582
194 H GLY 45 H GLY 45 6.583 -2.712 5.839
195 HA2 GLY 45 2HA GLY 45 6.813 -4.734 7.981
196 HA3 GLY 45 1HA GLY 45 5.309 -4.001 7.430
197 H ASP 46 H ASP 46 6.585 -4.537 4.663
198 HA ASP 46 HA ASP 46 5.199 -7.088 4.241
199 HB2 ASP 46 2HB ASP 46 6.730 -5.822 2.037
200 HB3 ASP 46 1HB ASP 46 5.062 -6.379 2.079
201 H GLY 47 H GLY 47 7.408 -7.553 5.856
202 HA2 GLY 47 2HA GLY 47 9.419 -8.719 3.971
203 HA3 GLY 47 1HA GLY 47 9.786 -8.243 5.630
204 H VAL 48 H VAL 48 8.552 -9.393 7.301
205 HA VAL 48 HA VAL 48 8.936 -12.141 7.340
206 HB VAL 48 HB VAL 48 8.587 -11.192 9.434
207 HG11 VAL 48 1HG1 VAL 48 6.710 -9.442 7.948
208 HG12 VAL 48 2HG1 VAL 48 7.922 -9.022 9.160
209 HG13 VAL 48 3HG1 VAL 48 6.372 -9.702 9.659
210 HG21 VAL 48 3HG2 VAL 48 6.690 -12.090 10.365
211 HG22 VAL 48 1HG2 VAL 48 6.776 -13.001 8.857
212 HG23 VAL 48 2HG2 VAL 48 5.682 -11.623 8.993
213 H LYS 49 H LYS 49 6.029 -10.328 6.464
214 HA LYS 49 HA LYS 49 4.053 -12.171 6.328
215 HB2 LYS 49 2HB LYS 49 3.480 -10.857 4.131
216 HB3 LYS 49 1HB LYS 49 3.539 -10.016 5.674
217 HG2 LYS 49 2HG LYS 49 5.323 -8.772 5.060
218 HG3 LYS 49 1HG LYS 49 6.143 -10.148 4.327
219 HD2 LYS 49 2HD LYS 49 5.518 -8.385 2.663
220 HD3 LYS 49 1HD LYS 49 4.777 -9.948 2.319
221 HE2 LYS 49 2HE LYS 49 2.697 -9.188 3.476
222 HE3 LYS 49 1HE LYS 49 3.438 -7.589 3.691
223 HZ1 LYS 49 3HZ LYS 49 2.067 -8.316 1.501
224 HZ2 LYS 49 1HZ LYS 49 3.650 -8.696 1.023
225 HZ3 LYS 49 2HZ LYS 49 3.269 -7.115 1.516
226 H TYR 50 H TYR 50 6.211 -11.714 3.440
227 HA TYR 50 HA TYR 50 5.295 -14.324 2.511
228 HB2 TYR 50 2HB TYR 50 6.429 -13.609 0.481
229 HB3 TYR 50 1HB TYR 50 5.321 -12.381 1.069
230 HD1 TYR 50 1HD TYR 50 8.904 -13.395 1.558
231 HD2 TYR 50 2HD TYR 50 6.067 -10.222 1.030
232 HE1 TYR 50 1HE TYR 50 10.761 -11.746 1.551
233 HE2 TYR 50 2HE TYR 50 7.922 -8.568 1.008
234 HH TYR 50 HH TYR 50 11.056 -9.313 2.031
235 H LYS 51 H LYS 51 8.192 -12.856 3.883
236 HA LYS 51 HA LYS 51 10.087 -14.810 3.122
237 HB2 LYS 51 2HB LYS 51 9.712 -12.711 5.129
238 HB3 LYS 51 1HB LYS 51 10.784 -14.004 5.664
239 HG2 LYS 51 2HG LYS 51 11.172 -12.980 2.895
240 HG3 LYS 51 1HG LYS 51 11.684 -11.930 4.217
241 HD2 LYS 51 2HD LYS 51 12.563 -14.791 3.739
242 HD3 LYS 51 1HD LYS 51 13.555 -13.343 3.555
243 HE2 LYS 51 2HE LYS 51 14.168 -13.643 5.725
244 HE3 LYS 51 1HE LYS 51 12.518 -13.161 6.161
245 HZ1 LYS 51 3HZ LYS 51 13.661 -15.838 5.912
246 HZ2 LYS 51 1HZ LYS 51 12.057 -15.636 5.398
247 HZ3 LYS 51 2HZ LYS 51 12.490 -15.258 6.996
248 H ALA 52 H ALA 52 7.859 -14.675 5.773
249 HA ALA 52 HA ALA 52 8.624 -17.091 7.057
250 HB1 ALA 52 1HB ALA 52 6.185 -15.338 7.081
251 HB2 ALA 52 2HB ALA 52 7.487 -15.371 8.271
252 HB3 ALA 52 3HB ALA 52 6.361 -16.723 8.159
253 H LYS 53 H LYS 53 5.834 -16.245 5.168
254 HA LYS 53 HA LYS 53 4.672 -18.797 4.928
255 HB2 LYS 53 2HB LYS 53 4.608 -16.213 3.387
256 HB3 LYS 53 1HB LYS 53 3.632 -17.586 2.884
257 HG2 LYS 53 2HG LYS 53 2.951 -17.627 5.444
258 HG3 LYS 53 1HG LYS 53 3.423 -15.930 5.362
259 HD2 LYS 53 2HD LYS 53 1.810 -15.457 3.672
260 HD3 LYS 53 1HD LYS 53 1.521 -17.170 3.366
261 HE2 LYS 53 2HE LYS 53 0.893 -17.107 5.991
262 HE3 LYS 53 1HE LYS 53 0.469 -15.441 5.551
263 HZ1 LYS 53 3HZ LYS 53 -0.849 -16.239 3.736
264 HZ2 LYS 53 1HZ LYS 53 -1.354 -17.043 5.140
265 HZ3 LYS 53 2HZ LYS 53 -0.366 -17.844 4.014
266 H LEU 54 H LEU 54 6.706 -17.045 2.497
267 HA LEU 54 HA LEU 54 6.848 -18.965 0.537
268 HB2 LEU 54 2HB LEU 54 8.787 -17.007 1.683
269 HB3 LEU 54 1HB LEU 54 9.044 -17.842 0.140
270 HG LEU 54 HG LEU 54 6.649 -16.171 0.888
271 HD11 LEU 54 1HD1 LEU 54 8.826 -15.041 0.315
272 HD12 LEU 54 2HD1 LEU 54 7.457 -14.626 -0.719
273 HD13 LEU 54 3HD1 LEU 54 8.681 -15.764 -1.286
274 HD21 LEU 54 3HD2 LEU 54 7.136 -18.203 -1.194
275 HD22 LEU 54 1HD2 LEU 54 6.425 -16.697 -1.774
276 HD23 LEU 54 2HD2 LEU 54 5.616 -17.626 -0.513
277 H ILE 55 H ILE 55 8.415 -18.877 3.639
278 HA ILE 55 HA ILE 55 10.345 -20.892 3.215
279 HB ILE 55 HB ILE 55 9.266 -19.003 5.126
280 HG12 ILE 55 2HG1 ILE 55 11.411 -18.406 5.406
281 HG13 ILE 55 1HG1 ILE 55 12.040 -20.044 5.229
282 HG21 ILE 55 1HG2 ILE 55 10.340 -20.215 7.037
283 HG22 ILE 55 2HG2 ILE 55 10.160 -21.659 6.036
284 HG23 ILE 55 3HG2 ILE 55 8.739 -20.724 6.506
285 HD11 ILE 55 3HD1 ILE 55 10.722 -18.716 2.887
286 HD12 ILE 55 1HD1 ILE 55 12.013 -19.918 2.905
287 HD13 ILE 55 2HD1 ILE 55 12.367 -18.238 3.310
288 H GLY 56 H GLY 56 7.379 -20.767 5.166
289 HA2 GLY 56 2HA GLY 56 5.676 -22.481 5.137
290 HA3 GLY 56 1HA GLY 56 6.906 -23.577 4.588
291 H ILE 57 H ILE 57 6.779 -21.392 7.310
292 HA ILE 57 HA ILE 57 8.055 -23.146 9.095
293 HB ILE 57 HB ILE 57 7.595 -21.240 10.586
294 HG12 ILE 57 2HG1 ILE 57 6.472 -19.716 8.285
295 HG13 ILE 57 1HG1 ILE 57 5.370 -20.832 9.094
296 HG21 ILE 57 1HG2 ILE 57 9.204 -21.456 8.352
297 HG22 ILE 57 2HG2 ILE 57 9.361 -20.241 9.622
298 HG23 ILE 57 3HG2 ILE 57 8.442 -19.878 8.159
299 HD11 ILE 57 3HD1 ILE 57 6.680 -18.365 10.149
300 HD12 ILE 57 1HD1 ILE 57 6.406 -19.695 11.273
301 HD13 ILE 57 2HD1 ILE 57 5.045 -18.969 10.418
302 H ASP 58 H ASP 58 5.871 -21.815 10.790
303 HA ASP 58 HA ASP 58 4.581 -23.990 11.905
304 HB2 ASP 58 2HB ASP 58 4.514 -21.700 12.786
305 HB3 ASP 58 1HB ASP 58 3.506 -21.192 11.421
Start of MODEL 14
1 H SER 24 H SER 24 -7.491 -16.021 34.052
2 HA SER 24 HA SER 24 -5.876 -18.091 35.195
3 HB2 SER 24 2HB SER 24 -8.265 -18.969 33.545
4 HB3 SER 24 1HB SER 24 -6.910 -20.020 33.946
5 HG SER 24 HG SER 24 -8.859 -19.982 35.385
6 H LYS 25 H LYS 25 -7.500 -17.141 32.150
7 HA LYS 25 HA LYS 25 -5.726 -17.957 30.215
8 HB2 LYS 25 2HB LYS 25 -7.285 -15.413 30.637
9 HB3 LYS 25 1HB LYS 25 -6.348 -15.656 29.161
10 HG2 LYS 25 2HG LYS 25 -7.631 -17.521 28.507
11 HG3 LYS 25 1HG LYS 25 -8.271 -17.764 30.133
12 HD2 LYS 25 2HD LYS 25 -10.092 -16.743 29.126
13 HD3 LYS 25 1HD LYS 25 -9.246 -15.327 29.753
14 HE2 LYS 25 2HE LYS 25 -8.045 -15.201 27.496
15 HE3 LYS 25 1HE LYS 25 -9.233 -16.384 26.913
16 HZ1 LYS 25 3HZ LYS 25 -10.893 -14.787 28.096
17 HZ2 LYS 25 1HZ LYS 25 -10.346 -14.429 26.531
18 HZ3 LYS 25 2HZ LYS 25 -9.664 -13.637 27.870
19 H LYS 26 H LYS 26 -3.788 -17.075 29.281
20 HA LYS 26 HA LYS 26 -1.759 -16.225 31.016
21 HB2 LYS 26 2HB LYS 26 -0.617 -15.611 28.854
22 HB3 LYS 26 1HB LYS 26 -1.356 -17.213 28.839
23 HG2 LYS 26 2HG LYS 26 -3.245 -15.150 28.022
24 HG3 LYS 26 1HG LYS 26 -1.816 -15.174 26.989
25 HD2 LYS 26 2HD LYS 26 -2.885 -17.841 27.662
26 HD3 LYS 26 1HD LYS 26 -3.960 -16.846 26.679
27 HE2 LYS 26 2HE LYS 26 -2.704 -17.371 24.869
28 HE3 LYS 26 1HE LYS 26 -1.337 -16.522 25.616
29 HZ1 LYS 26 3HZ LYS 26 -0.605 -18.720 25.400
30 HZ2 LYS 26 1HZ LYS 26 -2.094 -19.369 25.886
31 HZ3 LYS 26 2HZ LYS 26 -1.089 -18.606 27.024
32 H GLU 27 H GLU 27 -1.126 -14.225 31.785
33 HA GLU 27 HA GLU 27 -2.797 -11.993 31.849
34 HB2 GLU 27 2HB GLU 27 -0.764 -12.593 33.253
35 HB3 GLU 27 1HB GLU 27 0.227 -11.968 31.933
36 HG2 GLU 27 2HG GLU 27 0.024 -9.973 33.000
37 HG3 GLU 27 1HG GLU 27 -1.586 -9.935 32.280
38 H LYS 28 H LYS 28 -3.533 -11.004 29.959
39 HA LYS 28 HA LYS 28 -2.105 -10.869 27.504
40 HB2 LYS 28 2HB LYS 28 -4.635 -10.370 28.420
41 HB3 LYS 28 1HB LYS 28 -4.051 -8.735 28.111
42 HG2 LYS 28 2HG LYS 28 -3.323 -10.592 25.976
43 HG3 LYS 28 1HG LYS 28 -5.069 -10.483 26.203
44 HD2 LYS 28 2HD LYS 28 -5.146 -8.387 25.363
45 HD3 LYS 28 1HD LYS 28 -3.765 -7.868 26.331
46 HE2 LYS 28 2HE LYS 28 -3.185 -9.708 24.050
47 HE3 LYS 28 1HE LYS 28 -3.610 -8.032 23.653
48 HZ1 LYS 28 3HZ LYS 28 -2.005 -7.668 25.750
49 HZ2 LYS 28 1HZ LYS 28 -1.455 -7.654 24.146
50 HZ3 LYS 28 2HZ LYS 28 -1.300 -9.063 25.083
51 H LYS 29 H LYS 29 -0.001 -9.972 27.782
52 HA LYS 29 HA LYS 29 0.839 -7.829 29.307
53 HB2 LYS 29 2HB LYS 29 2.089 -9.404 27.701
54 HB3 LYS 29 1HB LYS 29 1.678 -8.243 26.437
55 HG2 LYS 29 2HG LYS 29 2.689 -6.455 27.982
56 HG3 LYS 29 1HG LYS 29 3.374 -7.798 28.897
57 HD2 LYS 29 2HD LYS 29 3.951 -8.414 26.233
58 HD3 LYS 29 1HD LYS 29 4.234 -6.677 26.351
59 HE2 LYS 29 2HE LYS 29 5.879 -6.932 28.027
60 HE3 LYS 29 1HE LYS 29 5.324 -8.565 28.446
61 HZ1 LYS 29 3HZ LYS 29 5.816 -8.852 25.846
62 HZ2 LYS 29 1HZ LYS 29 6.967 -9.181 27.047
63 HZ3 LYS 29 2HZ LYS 29 6.995 -7.690 26.232
64 H LYS 30 H LYS 30 0.988 -5.538 28.934
65 HA LYS 30 HA LYS 30 -1.262 -4.361 27.572
66 HB2 LYS 30 2HB LYS 30 1.126 -3.457 29.146
67 HB3 LYS 30 1HB LYS 30 0.150 -2.259 28.295
68 HG2 LYS 30 2HG LYS 30 -1.879 -3.144 29.446
69 HG3 LYS 30 1HG LYS 30 -0.847 -4.249 30.355
70 HD2 LYS 30 2HD LYS 30 0.408 -2.301 31.254
71 HD3 LYS 30 1HD LYS 30 -0.692 -1.221 30.398
72 HE2 LYS 30 2HE LYS 30 -2.121 -1.337 32.150
73 HE3 LYS 30 1HE LYS 30 -2.287 -3.083 31.875
74 HZ1 LYS 30 3HZ LYS 30 -0.363 -1.660 33.599
75 HZ2 LYS 30 1HZ LYS 30 0.021 -3.191 32.979
76 HZ3 LYS 30 2HZ LYS 30 -1.344 -2.997 33.971
77 H GLY 31 H GLY 31 -1.085 -4.624 25.302
78 HA2 GLY 31 2HA GLY 31 1.131 -4.613 23.681
79 HA3 GLY 31 1HA GLY 31 -0.396 -3.907 23.166
80 HA PRO 32 HA PRO 32 3.011 -0.690 23.678
81 HB2 PRO 32 2HB PRO 32 3.495 -0.202 21.057
82 HB3 PRO 32 1HB PRO 32 4.384 -1.416 22.008
83 HG2 PRO 32 2HG PRO 32 2.120 -1.772 20.136
84 HG3 PRO 32 1HG PRO 32 3.578 -2.750 20.351
85 HD2 PRO 32 2HD PRO 32 1.161 -3.460 21.351
86 HD3 PRO 32 1HD PRO 32 2.700 -3.906 22.123
87 H GLU 33 H GLU 33 2.487 1.554 23.522
88 HA GLU 33 HA GLU 33 -0.163 2.137 22.474
89 HB2 GLU 33 2HB GLU 33 -0.250 3.241 24.465
90 HB3 GLU 33 1HB GLU 33 1.404 2.682 24.729
91 HG2 GLU 33 2HG GLU 33 2.337 4.643 23.742
92 HG3 GLU 33 1HG GLU 33 0.761 5.175 23.160
93 H LYS 34 H LYS 34 2.653 2.056 21.308
94 HA LYS 34 HA LYS 34 3.237 4.587 20.139
95 HB2 LYS 34 2HB LYS 34 4.134 1.878 20.286
96 HB3 LYS 34 1HB LYS 34 4.242 2.444 18.639
97 HG2 LYS 34 2HG LYS 34 5.135 4.366 20.689
98 HG3 LYS 34 1HG LYS 34 6.126 2.913 20.558
99 HD2 LYS 34 2HD LYS 34 6.348 3.308 18.117
100 HD3 LYS 34 1HD LYS 34 5.417 4.797 18.291
101 HE2 LYS 34 2HE LYS 34 7.915 5.169 18.292
102 HE3 LYS 34 1HE LYS 34 7.129 5.728 19.782
103 HZ1 LYS 34 3HZ LYS 34 9.173 4.117 19.895
104 HZ2 LYS 34 1HZ LYS 34 7.996 2.930 19.604
105 HZ3 LYS 34 2HZ LYS 34 7.868 3.935 20.969
106 H THR 35 H THR 35 2.864 5.211 17.901
107 HA THR 35 HA THR 35 1.287 3.553 16.145
108 HB THR 35 HB THR 35 -0.152 6.013 16.738
109 HG1 THR 35 1HG THR 35 -0.233 5.724 18.798
110 HG21 THR 35 3HG2 THR 35 -1.101 4.355 15.263
111 HG22 THR 35 1HG2 THR 35 -2.072 4.400 16.734
112 HG23 THR 35 2HG2 THR 35 -0.905 3.101 16.487
113 H ASP 36 H ASP 36 2.830 6.616 16.797
114 HA ASP 36 HA ASP 36 2.617 7.374 13.927
115 HB2 ASP 36 2HB ASP 36 2.001 9.035 15.654
116 HB3 ASP 36 1HB ASP 36 3.608 8.872 16.363
117 H GLU 37 H GLU 37 5.115 7.739 16.332
118 HA GLU 37 HA GLU 37 7.283 7.512 14.507
119 HB2 GLU 37 2HB GLU 37 6.828 7.459 17.449
120 HB3 GLU 37 1HB GLU 37 8.380 6.851 16.872
121 HG2 GLU 37 2HG GLU 37 8.280 9.095 15.414
122 HG3 GLU 37 1HG GLU 37 7.266 9.618 16.760
123 H TYR 38 H TYR 38 5.158 5.260 15.866
124 HA TYR 38 HA TYR 38 6.880 2.935 15.800
125 HB2 TYR 38 2HB TYR 38 5.194 2.138 17.067
126 HB3 TYR 38 1HB TYR 38 4.543 3.767 17.010
127 HD1 TYR 38 2HD TYR 38 3.439 4.112 14.392
128 HD2 TYR 38 1HD TYR 38 3.531 0.606 16.851
129 HE1 TYR 38 2HE TYR 38 1.447 3.225 13.205
130 HE2 TYR 38 1HE TYR 38 1.537 -0.286 15.682
131 HH TYR 38 HH TYR 38 -0.464 0.848 14.345
132 H LEU 39 H LEU 39 4.959 4.641 13.490
133 HA LEU 39 HA LEU 39 4.098 2.778 11.659
134 HB2 LEU 39 2HB LEU 39 5.080 5.522 11.702
135 HB3 LEU 39 1HB LEU 39 5.386 4.737 10.156
136 HG LEU 39 HG LEU 39 3.211 5.708 10.000
137 HD11 LEU 39 1HD1 LEU 39 2.158 3.074 10.667
138 HD12 LEU 39 2HD1 LEU 39 3.651 2.982 9.731
139 HD13 LEU 39 3HD1 LEU 39 2.265 3.870 9.097
140 HD21 LEU 39 3HD2 LEU 39 2.773 4.415 12.692
141 HD22 LEU 39 1HD2 LEU 39 1.453 5.063 11.720
142 HD23 LEU 39 2HD2 LEU 39 2.725 6.136 12.308
143 H LEU 40 H LEU 40 7.374 4.211 11.703
144 HA LEU 40 HA LEU 40 8.527 2.512 9.764
145 HB2 LEU 40 2HB LEU 40 9.458 4.193 12.070
146 HB3 LEU 40 1HB LEU 40 10.631 3.232 11.166
147 HG LEU 40 HG LEU 40 10.198 5.646 10.365
148 HD11 LEU 40 1HD1 LEU 40 9.888 4.527 7.891
149 HD12 LEU 40 2HD1 LEU 40 10.391 3.124 8.836
150 HD13 LEU 40 3HD1 LEU 40 11.416 4.557 8.771
151 HD21 LEU 40 3HD2 LEU 40 8.261 5.850 8.809
152 HD22 LEU 40 1HD2 LEU 40 7.751 5.599 10.479
153 HD23 LEU 40 2HD2 LEU 40 7.705 4.261 9.332
154 H ALA 41 H ALA 41 8.003 2.094 13.218
155 HA ALA 41 HA ALA 41 9.647 -0.138 13.693
156 HB1 ALA 41 1HB ALA 41 8.311 -0.368 15.648
157 HB2 ALA 41 2HB ALA 41 6.874 0.242 14.827
158 HB3 ALA 41 3HB ALA 41 8.183 1.345 15.249
159 H ARG 42 H ARG 42 6.360 0.139 12.425
160 HA ARG 42 HA ARG 42 6.100 -2.704 11.961
161 HB2 ARG 42 2HB ARG 42 4.412 -0.245 11.700
162 HB3 ARG 42 1HB ARG 42 3.855 -1.785 11.044
163 HG2 ARG 42 2HG ARG 42 4.899 -1.835 13.828
164 HG3 ARG 42 1HG ARG 42 3.354 -1.020 13.584
165 HD2 ARG 42 2HD ARG 42 2.616 -3.108 12.287
166 HD3 ARG 42 1HD ARG 42 4.053 -3.900 12.965
167 HE ARG 42 HE ARG 42 2.628 -2.517 15.045
168 HH11 ARG 42 1HH2 ARG 42 1.161 -4.571 12.922
169 HH12 ARG 42 2HH2 ARG 42 0.837 -5.839 14.056
170 HH21 ARG 42 1HH1 ARG 42 2.796 -4.461 16.564
171 HH22 ARG 42 2HH1 ARG 42 1.761 -5.777 16.119
172 H PHE 43 H PHE 43 7.113 0.070 10.242
173 HA PHE 43 HA PHE 43 6.376 -0.141 7.630
174 HB2 PHE 43 2HB PHE 43 8.724 0.656 9.158
175 HB3 PHE 43 1HB PHE 43 9.133 0.174 7.517
176 HD1 PHE 43 1HD PHE 43 5.885 1.596 8.580
177 HD2 PHE 43 2HD PHE 43 9.628 2.349 6.615
178 HE1 PHE 43 1HE PHE 43 5.007 3.759 7.741
179 HE2 PHE 43 2HE PHE 43 8.751 4.512 5.772
180 HZ PHE 43 HZ PHE 43 6.440 5.216 6.336
181 H LYS 44 H LYS 44 8.295 -2.547 9.355
182 HA LYS 44 HA LYS 44 9.314 -3.844 7.065
183 HB2 LYS 44 2HB LYS 44 9.029 -4.413 9.972
184 HB3 LYS 44 1HB LYS 44 9.645 -5.667 8.890
185 HG2 LYS 44 2HG LYS 44 11.481 -4.319 9.819
186 HG3 LYS 44 1HG LYS 44 11.362 -4.129 8.071
187 HD2 LYS 44 2HD LYS 44 10.400 -1.991 8.246
188 HD3 LYS 44 1HD LYS 44 9.981 -2.227 9.943
189 HE2 LYS 44 2HE LYS 44 12.851 -2.157 8.963
190 HE3 LYS 44 1HE LYS 44 11.997 -0.730 9.584
191 HZ1 LYS 44 3HZ LYS 44 12.794 -1.555 11.536
192 HZ2 LYS 44 1HZ LYS 44 12.813 -3.161 10.994
193 HZ3 LYS 44 2HZ LYS 44 11.347 -2.440 11.458
194 H GLY 45 H GLY 45 6.263 -3.517 7.623
195 HA2 GLY 45 2HA GLY 45 4.897 -5.876 7.931
196 HA3 GLY 45 1HA GLY 45 4.385 -4.659 6.772
197 H ASP 46 H ASP 46 5.641 -4.732 4.731
198 HA ASP 46 HA ASP 46 5.362 -7.299 3.472
199 HB2 ASP 46 2HB ASP 46 7.021 -5.591 1.871
200 HB3 ASP 46 1HB ASP 46 5.322 -5.997 1.634
201 H GLY 47 H GLY 47 6.898 -8.030 5.389
202 HA2 GLY 47 2HA GLY 47 9.553 -8.496 4.126
203 HA3 GLY 47 1HA GLY 47 9.493 -7.938 5.799
204 H VAL 48 H VAL 48 8.334 -9.286 7.313
205 HA VAL 48 HA VAL 48 9.107 -11.997 7.279
206 HB VAL 48 HB VAL 48 8.816 -11.102 9.403
207 HG11 VAL 48 1HG1 VAL 48 6.414 -9.939 9.795
208 HG12 VAL 48 2HG1 VAL 48 6.670 -9.556 8.094
209 HG13 VAL 48 3HG1 VAL 48 7.852 -9.047 9.299
210 HG21 VAL 48 3HG2 VAL 48 6.058 -12.153 8.841
211 HG22 VAL 48 1HG2 VAL 48 6.806 -11.985 10.429
212 HG23 VAL 48 2HG2 VAL 48 7.453 -13.147 9.267
213 H LYS 49 H LYS 49 5.911 -10.517 6.719
214 HA LYS 49 HA LYS 49 4.210 -12.622 6.632
215 HB2 LYS 49 2HB LYS 49 3.204 -11.337 4.633
216 HB3 LYS 49 1HB LYS 49 3.433 -10.467 6.147
217 HG2 LYS 49 2HG LYS 49 4.709 -8.971 5.083
218 HG3 LYS 49 1HG LYS 49 5.852 -10.243 4.662
219 HD2 LYS 49 2HD LYS 49 4.993 -9.074 2.654
220 HD3 LYS 49 1HD LYS 49 4.541 -10.778 2.657
221 HE2 LYS 49 2HE LYS 49 2.361 -10.186 2.522
222 HE3 LYS 49 1HE LYS 49 2.511 -9.306 4.057
223 HZ1 LYS 49 3HZ LYS 49 3.404 -7.420 2.899
224 HZ2 LYS 49 1HZ LYS 49 1.927 -7.837 2.178
225 HZ3 LYS 49 2HZ LYS 49 3.388 -8.256 1.420
226 H TYR 50 H TYR 50 6.049 -11.722 3.630
227 HA TYR 50 HA TYR 50 5.368 -14.302 2.498
228 HB2 TYR 50 2HB TYR 50 6.625 -13.373 0.599
229 HB3 TYR 50 1HB TYR 50 5.386 -12.275 1.195
230 HD1 TYR 50 2HD TYR 50 8.994 -13.092 1.837
231 HD2 TYR 50 1HD TYR 50 5.960 -10.093 1.457
232 HE1 TYR 50 2HE TYR 50 10.712 -11.323 2.155
233 HE2 TYR 50 1HE TYR 50 7.663 -8.319 1.761
234 HH TYR 50 HH TYR 50 10.351 -8.251 1.321
235 H LYS 51 H LYS 51 8.148 -12.871 4.129
236 HA LYS 51 HA LYS 51 10.121 -14.740 3.288
237 HB2 LYS 51 2HB LYS 51 9.649 -12.783 5.441
238 HB3 LYS 51 1HB LYS 51 10.780 -14.066 5.860
239 HG2 LYS 51 2HG LYS 51 11.286 -13.082 3.178
240 HG3 LYS 51 1HG LYS 51 11.349 -11.768 4.354
241 HD2 LYS 51 2HD LYS 51 12.699 -13.800 5.649
242 HD3 LYS 51 1HD LYS 51 13.192 -14.019 3.970
243 HE2 LYS 51 2HE LYS 51 13.188 -11.195 4.706
244 HE3 LYS 51 1HE LYS 51 14.266 -12.146 5.747
245 HZ1 LYS 51 3HZ LYS 51 15.408 -13.000 3.926
246 HZ2 LYS 51 1HZ LYS 51 15.180 -11.374 3.502
247 HZ3 LYS 51 2HZ LYS 51 14.186 -12.574 2.825
248 H ALA 52 H ALA 52 7.840 -14.747 5.897
249 HA ALA 52 HA ALA 52 8.565 -17.246 7.042
250 HB1 ALA 52 1HB ALA 52 6.904 -16.703 8.544
251 HB2 ALA 52 2HB ALA 52 5.819 -16.161 7.263
252 HB3 ALA 52 3HB ALA 52 7.135 -15.119 7.805
253 H LYS 53 H LYS 53 5.807 -16.251 5.174
254 HA LYS 53 HA LYS 53 4.600 -18.751 4.760
255 HB2 LYS 53 2HB LYS 53 4.656 -16.085 3.377
256 HB3 LYS 53 1HB LYS 53 3.715 -17.403 2.695
257 HG2 LYS 53 2HG LYS 53 2.978 -17.552 5.317
258 HG3 LYS 53 1HG LYS 53 3.232 -15.816 5.134
259 HD2 LYS 53 2HD LYS 53 1.794 -16.977 2.866
260 HD3 LYS 53 1HD LYS 53 0.939 -17.201 4.393
261 HE2 LYS 53 2HE LYS 53 1.910 -14.548 4.459
262 HE3 LYS 53 1HE LYS 53 1.227 -14.779 2.837
263 HZ1 LYS 53 3HZ LYS 53 -0.744 -15.755 3.845
264 HZ2 LYS 53 1HZ LYS 53 -0.505 -14.177 4.418
265 HZ3 LYS 53 2HZ LYS 53 -0.100 -15.506 5.397
266 H LEU 54 H LEU 54 6.752 -16.960 2.458
267 HA LEU 54 HA LEU 54 6.906 -18.819 0.441
268 HB2 LEU 54 2HB LEU 54 8.865 -16.971 1.728
269 HB3 LEU 54 1HB LEU 54 9.159 -17.766 0.169
270 HG LEU 54 HG LEU 54 6.774 -16.056 0.868
271 HD11 LEU 54 1HD1 LEU 54 8.735 -14.731 0.525
272 HD12 LEU 54 2HD1 LEU 54 7.733 -14.614 -0.923
273 HD13 LEU 54 3HD1 LEU 54 9.160 -15.653 -0.915
274 HD21 LEU 54 3HD2 LEU 54 7.419 -17.899 -1.386
275 HD22 LEU 54 1HD2 LEU 54 6.540 -16.414 -1.754
276 HD23 LEU 54 2HD2 LEU 54 5.871 -17.575 -0.607
277 H ILE 55 H ILE 55 8.406 -18.817 3.577
278 HA ILE 55 HA ILE 55 10.211 -20.955 3.209
279 HB ILE 55 HB ILE 55 9.244 -18.944 5.052
280 HG12 ILE 55 2HG1 ILE 55 11.418 -18.506 5.378
281 HG13 ILE 55 1HG1 ILE 55 11.932 -20.187 5.224
282 HG21 ILE 55 1HG2 ILE 55 10.386 -20.344 6.940
283 HG22 ILE 55 2HG2 ILE 55 9.642 -21.645 6.016
284 HG23 ILE 55 3HG2 ILE 55 8.651 -20.331 6.640
285 HD11 ILE 55 3HD1 ILE 55 10.725 -18.830 2.847
286 HD12 ILE 55 1HD1 ILE 55 11.977 -20.071 2.908
287 HD13 ILE 55 2HD1 ILE 55 12.375 -18.396 3.291
288 H GLY 56 H GLY 56 7.381 -20.636 5.317
289 HA2 GLY 56 2HA GLY 56 5.747 -22.140 5.988
290 HA3 GLY 56 1HA GLY 56 5.989 -22.900 4.438
291 H ILE 57 H ILE 57 8.302 -22.577 7.018
292 HA ILE 57 HA ILE 57 9.058 -25.294 6.947
293 HB ILE 57 HB ILE 57 10.550 -24.468 8.719
294 HG12 ILE 57 2HG1 ILE 57 9.537 -21.701 8.270
295 HG13 ILE 57 1HG1 ILE 57 8.584 -22.724 9.342
296 HG21 ILE 57 1HG2 ILE 57 10.205 -23.490 6.015
297 HG22 ILE 57 2HG2 ILE 57 11.678 -23.999 6.841
298 HG23 ILE 57 3HG2 ILE 57 11.090 -22.345 7.022
299 HD11 ILE 57 3HD1 ILE 57 10.714 -23.243 10.596
300 HD12 ILE 57 1HD1 ILE 57 10.200 -21.559 10.702
301 HD13 ILE 57 2HD1 ILE 57 11.515 -22.013 9.619
302 H ASP 58 H ASP 58 9.175 -24.544 9.921
303 HA ASP 58 HA ASP 58 7.536 -26.498 11.043
304 HB2 ASP 58 2HB ASP 58 9.364 -24.653 11.900
305 HB3 ASP 58 1HB ASP 58 7.877 -24.031 12.631
Start of MODEL 15
1 H SER 24 H SER 24 -2.543 -2.956 7.024
2 HA SER 24 HA SER 24 -1.389 -3.614 4.488
3 HB2 SER 24 2HB SER 24 -3.275 -4.986 4.041
4 HB3 SER 24 1HB SER 24 -4.387 -3.840 4.782
5 HG SER 24 HG SER 24 -4.243 -2.557 3.039
6 H LYS 25 H LYS 25 -1.088 -1.460 6.218
7 HA LYS 25 HA LYS 25 -2.595 0.830 6.047
8 HB2 LYS 25 2HB LYS 25 0.112 0.087 6.525
9 HB3 LYS 25 1HB LYS 25 0.138 1.499 5.467
10 HG2 LYS 25 2HG LYS 25 -1.598 2.512 7.090
11 HG3 LYS 25 1HG LYS 25 -1.110 1.234 8.203
12 HD2 LYS 25 2HD LYS 25 1.188 2.567 6.997
13 HD3 LYS 25 1HD LYS 25 0.157 3.693 7.881
14 HE2 LYS 25 2HE LYS 25 1.417 2.934 9.666
15 HE3 LYS 25 1HE LYS 25 0.208 1.635 9.653
16 HZ1 LYS 25 3HZ LYS 25 2.804 1.632 8.204
17 HZ2 LYS 25 1HZ LYS 25 1.622 0.422 8.080
18 HZ3 LYS 25 2HZ LYS 25 2.414 0.687 9.561
19 H LYS 26 H LYS 26 -2.812 2.553 4.512
20 HA LYS 26 HA LYS 26 -1.494 2.697 1.999
21 HB2 LYS 26 2HB LYS 26 -2.655 0.552 1.641
22 HB3 LYS 26 1HB LYS 26 -4.196 1.314 2.038
23 HG2 LYS 26 2HG LYS 26 -3.997 2.801 0.110
24 HG3 LYS 26 1HG LYS 26 -2.404 2.141 -0.264
25 HD2 LYS 26 2HD LYS 26 -4.826 0.354 -0.082
26 HD3 LYS 26 1HD LYS 26 -4.426 1.200 -1.577
27 HE2 LYS 26 2HE LYS 26 -2.064 0.194 -1.324
28 HE3 LYS 26 1HE LYS 26 -2.792 -0.893 -0.126
29 HZ1 LYS 26 3HZ LYS 26 -4.041 -0.448 -2.768
30 HZ2 LYS 26 1HZ LYS 26 -4.299 -1.724 -1.679
31 HZ3 LYS 26 2HZ LYS 26 -2.844 -1.635 -2.552
32 H GLU 27 H GLU 27 -4.752 3.089 3.421
33 HA GLU 27 HA GLU 27 -6.261 4.916 3.242
34 HB2 GLU 27 2HB GLU 27 -4.731 5.555 5.020
35 HB3 GLU 27 1HB GLU 27 -3.555 6.146 3.844
36 HG2 GLU 27 2HG GLU 27 -5.516 7.682 3.039
37 HG3 GLU 27 1HG GLU 27 -6.204 7.337 4.626
38 H LYS 28 H LYS 28 -6.685 4.732 0.929
39 HA LYS 28 HA LYS 28 -6.506 5.355 -1.357
40 HB2 LYS 28 2HB LYS 28 -7.929 6.914 -0.074
41 HB3 LYS 28 1HB LYS 28 -6.529 7.944 0.210
42 HG2 LYS 28 2HG LYS 28 -6.550 8.778 -1.921
43 HG3 LYS 28 1HG LYS 28 -7.022 7.230 -2.624
44 HD2 LYS 28 2HD LYS 28 -9.024 8.301 -2.923
45 HD3 LYS 28 1HD LYS 28 -9.279 7.812 -1.248
46 HE2 LYS 28 2HE LYS 28 -7.855 10.404 -1.787
47 HE3 LYS 28 1HE LYS 28 -9.624 10.344 -1.923
48 HZ1 LYS 28 3HZ LYS 28 -9.504 9.074 0.277
49 HZ2 LYS 28 1HZ LYS 28 -9.267 10.752 0.329
50 HZ3 LYS 28 2HZ LYS 28 -7.932 9.704 0.416
51 H LYS 29 H LYS 29 -4.845 8.294 -0.408
52 HA LYS 29 HA LYS 29 -2.876 8.240 -2.353
53 HB2 LYS 29 2HB LYS 29 -3.579 9.727 -0.060
54 HB3 LYS 29 1HB LYS 29 -1.863 9.356 0.111
55 HG2 LYS 29 2HG LYS 29 -2.457 10.102 -2.622
56 HG3 LYS 29 1HG LYS 29 -3.006 11.357 -1.510
57 HD2 LYS 29 2HD LYS 29 -0.471 10.488 -0.574
58 HD3 LYS 29 1HD LYS 29 -0.317 10.734 -2.313
59 HE2 LYS 29 2HE LYS 29 0.149 12.847 -1.138
60 HE3 LYS 29 1HE LYS 29 -1.377 12.999 -2.032
61 HZ1 LYS 29 3HZ LYS 29 -1.500 13.707 0.349
62 HZ2 LYS 29 1HZ LYS 29 -1.216 12.094 0.790
63 HZ3 LYS 29 2HZ LYS 29 -2.614 12.499 -0.085
64 H LYS 30 H LYS 30 -1.970 6.090 -2.561
65 HA LYS 30 HA LYS 30 -0.864 4.530 -0.503
66 HB2 LYS 30 2HB LYS 30 0.165 3.375 -2.381
67 HB3 LYS 30 1HB LYS 30 -1.450 3.910 -2.845
68 HG2 LYS 30 2HG LYS 30 0.185 6.079 -3.474
69 HG3 LYS 30 1HG LYS 30 1.133 4.672 -3.962
70 HD2 LYS 30 2HD LYS 30 -1.729 4.543 -4.678
71 HD3 LYS 30 1HD LYS 30 -0.819 5.813 -5.497
72 HE2 LYS 30 2HE LYS 30 0.412 3.083 -5.339
73 HE3 LYS 30 1HE LYS 30 -0.887 3.364 -6.518
74 HZ1 LYS 30 3HZ LYS 30 0.502 5.588 -6.829
75 HZ2 LYS 30 1HZ LYS 30 0.824 4.188 -7.729
76 HZ3 LYS 30 2HZ LYS 30 1.771 4.558 -6.369
77 H GLY 31 H GLY 31 0.589 5.525 0.916
78 HA2 GLY 31 2HA GLY 31 2.483 6.749 1.624
79 HA3 GLY 31 1HA GLY 31 3.275 5.689 0.465
80 HA PRO 32 HA PRO 32 4.026 10.031 -0.831
81 HB2 PRO 32 2HB PRO 32 6.637 9.622 -1.452
82 HB3 PRO 32 1HB PRO 32 6.071 10.064 0.177
83 HG2 PRO 32 2HG PRO 32 6.749 7.396 -0.930
84 HG3 PRO 32 1HG PRO 32 7.154 8.104 0.641
85 HD2 PRO 32 2HD PRO 32 5.164 6.314 0.353
86 HD3 PRO 32 1HD PRO 32 5.077 7.643 1.533
87 H GLU 33 H GLU 33 5.566 10.472 -3.020
88 HA GLU 33 HA GLU 33 4.162 9.042 -5.095
89 HB2 GLU 33 2HB GLU 33 4.340 11.112 -6.030
90 HB3 GLU 33 1HB GLU 33 5.168 11.567 -4.536
91 HG2 GLU 33 2HG GLU 33 7.313 11.084 -5.453
92 HG3 GLU 33 1HG GLU 33 6.604 10.322 -6.877
93 H LYS 34 H LYS 34 6.643 8.380 -3.414
94 HA LYS 34 HA LYS 34 8.754 7.653 -5.187
95 HB2 LYS 34 2HB LYS 34 7.982 7.686 -2.443
96 HB3 LYS 34 1HB LYS 34 8.680 6.130 -2.815
97 HG2 LYS 34 2HG LYS 34 9.946 8.743 -3.612
98 HG3 LYS 34 1HG LYS 34 10.315 7.933 -2.090
99 HD2 LYS 34 2HD LYS 34 11.581 6.333 -3.108
100 HD3 LYS 34 1HD LYS 34 10.460 6.186 -4.463
101 HE2 LYS 34 2HE LYS 34 12.394 7.117 -5.461
102 HE3 LYS 34 1HE LYS 34 11.382 8.542 -5.156
103 HZ1 LYS 34 3HZ LYS 34 12.661 9.207 -3.432
104 HZ2 LYS 34 1HZ LYS 34 13.866 8.339 -4.251
105 HZ3 LYS 34 2HZ LYS 34 13.043 7.623 -2.948
106 H THR 35 H THR 35 9.339 5.342 -5.706
107 HA THR 35 HA THR 35 7.403 3.252 -5.282
108 HB THR 35 HB THR 35 7.696 3.774 -8.139
109 HG1 THR 35 1HG THR 35 5.834 5.333 -7.793
110 HG21 THR 35 3HG2 THR 35 6.079 2.215 -7.970
111 HG22 THR 35 1HG2 THR 35 5.017 3.543 -7.503
112 HG23 THR 35 2HG2 THR 35 5.815 2.574 -6.264
113 H ASP 36 H ASP 36 10.385 4.313 -6.743
114 HA ASP 36 HA ASP 36 11.109 1.480 -7.327
115 HB2 ASP 36 2HB ASP 36 11.698 4.109 -8.451
116 HB3 ASP 36 1HB ASP 36 13.152 3.140 -8.203
117 H GLU 37 H GLU 37 12.939 4.257 -6.279
118 HA GLU 37 HA GLU 37 14.770 2.777 -4.684
119 HB2 GLU 37 2HB GLU 37 13.994 5.598 -5.164
120 HB3 GLU 37 1HB GLU 37 14.841 5.285 -3.649
121 HG2 GLU 37 2HG GLU 37 16.213 3.805 -5.619
122 HG3 GLU 37 1HG GLU 37 15.912 5.391 -6.328
123 H TYR 38 H TYR 38 11.555 3.705 -4.240
124 HA TYR 38 HA TYR 38 11.516 3.829 -1.352
125 HB2 TYR 38 2HB TYR 38 9.497 4.745 -1.789
126 HB3 TYR 38 1HB TYR 38 10.007 4.706 -3.467
127 HD1 TYR 38 2HD TYR 38 9.805 1.958 -4.295
128 HD2 TYR 38 1HD TYR 38 7.282 4.182 -1.639
129 HE1 TYR 38 2HE TYR 38 7.924 0.424 -4.798
130 HE2 TYR 38 1HE TYR 38 5.391 2.660 -2.145
131 HH TYR 38 HH TYR 38 4.934 0.525 -3.009
132 H LEU 39 H LEU 39 11.391 1.291 -3.690
133 HA LEU 39 HA LEU 39 9.830 -0.689 -2.567
134 HB2 LEU 39 2HB LEU 39 12.257 -0.463 -4.192
135 HB3 LEU 39 1HB LEU 39 12.163 -1.980 -3.311
136 HG LEU 39 HG LEU 39 11.048 -2.455 -5.313
137 HD11 LEU 39 1HD1 LEU 39 8.585 -1.521 -3.955
138 HD12 LEU 39 2HD1 LEU 39 9.628 -2.607 -3.038
139 HD13 LEU 39 3HD1 LEU 39 8.981 -3.115 -4.599
140 HD21 LEU 39 3HD2 LEU 39 10.681 -0.614 -6.582
141 HD22 LEU 39 1HD2 LEU 39 10.381 0.401 -5.170
142 HD23 LEU 39 2HD2 LEU 39 9.088 -0.606 -5.824
143 H LEU 40 H LEU 40 13.284 -0.152 -1.819
144 HA LEU 40 HA LEU 40 13.412 -1.954 0.369
145 HB2 LEU 40 2HB LEU 40 14.960 0.406 -0.656
146 HB3 LEU 40 1HB LEU 40 15.443 -0.370 0.853
147 HG LEU 40 HG LEU 40 16.507 -1.232 -1.346
148 HD11 LEU 40 1HD1 LEU 40 15.454 -2.641 1.005
149 HD12 LEU 40 2HD1 LEU 40 17.061 -2.716 0.283
150 HD13 LEU 40 3HD1 LEU 40 15.754 -3.706 -0.367
151 HD21 LEU 40 3HD2 LEU 40 15.157 -2.979 -2.486
152 HD22 LEU 40 1HD2 LEU 40 14.416 -1.385 -2.644
153 HD23 LEU 40 2HD2 LEU 40 13.773 -2.546 -1.483
154 H ALA 41 H ALA 41 12.227 1.299 0.102
155 HA ALA 41 HA ALA 41 12.431 2.197 2.753
156 HB1 ALA 41 1HB ALA 41 11.012 3.857 1.992
157 HB2 ALA 41 2HB ALA 41 9.937 2.704 1.201
158 HB3 ALA 41 3HB ALA 41 11.460 3.157 0.437
159 H ARG 42 H ARG 42 10.012 0.143 1.185
160 HA ARG 42 HA ARG 42 8.506 -0.237 3.626
161 HB2 ARG 42 2HB ARG 42 8.296 -0.947 0.738
162 HB3 ARG 42 1HB ARG 42 7.275 -1.794 1.900
163 HG2 ARG 42 2HG ARG 42 7.447 1.218 1.891
164 HG3 ARG 42 1HG ARG 42 6.335 0.369 0.816
165 HD2 ARG 42 2HD ARG 42 5.022 -0.419 2.573
166 HD3 ARG 42 1HD ARG 42 6.359 -0.347 3.738
167 HE ARG 42 HE ARG 42 4.630 1.892 2.989
168 HH11 ARG 42 1HH1 ARG 42 7.256 3.032 2.413
169 HH12 ARG 42 2HH1 ARG 42 7.808 3.582 3.959
170 HH21 ARG 42 1HH2 ARG 42 5.533 1.669 5.745
171 HH22 ARG 42 2HH2 ARG 42 6.837 2.805 5.848
172 H PHE 43 H PHE 43 11.046 -1.813 1.950
173 HA PHE 43 HA PHE 43 10.818 -4.512 2.259
174 HB2 PHE 43 2HB PHE 43 12.914 -2.481 2.386
175 HB3 PHE 43 1HB PHE 43 13.341 -3.938 3.271
176 HD1 PHE 43 2HD PHE 43 11.264 -3.487 0.187
177 HD2 PHE 43 1HD PHE 43 14.846 -5.117 1.908
178 HE1 PHE 43 2HE PHE 43 11.773 -4.633 -1.952
179 HE2 PHE 43 1HE PHE 43 15.357 -6.260 -0.233
180 HZ PHE 43 HZ PHE 43 13.819 -6.016 -2.164
181 H LYS 44 H LYS 44 11.385 -2.203 4.918
182 HA LYS 44 HA LYS 44 11.727 -4.185 6.908
183 HB2 LYS 44 2HB LYS 44 11.346 -1.238 6.767
184 HB3 LYS 44 1HB LYS 44 11.359 -2.046 8.338
185 HG2 LYS 44 2HG LYS 44 13.618 -1.302 7.685
186 HG3 LYS 44 1HG LYS 44 13.519 -3.056 7.819
187 HD2 LYS 44 2HD LYS 44 13.485 -3.348 5.479
188 HD3 LYS 44 1HD LYS 44 13.118 -1.646 5.192
189 HE2 LYS 44 2HE LYS 44 15.440 -1.312 6.492
190 HE3 LYS 44 1HE LYS 44 15.740 -2.928 5.820
191 HZ1 LYS 44 3HZ LYS 44 14.992 -0.456 4.369
192 HZ2 LYS 44 1HZ LYS 44 14.818 -1.994 3.676
193 HZ3 LYS 44 2HZ LYS 44 16.358 -1.438 4.129
194 H GLY 45 H GLY 45 9.087 -3.848 5.288
195 HA2 GLY 45 2HA GLY 45 7.298 -4.138 7.649
196 HA3 GLY 45 1HA GLY 45 6.786 -3.247 6.232
197 H ASP 46 H ASP 46 6.833 -4.496 4.204
198 HA ASP 46 HA ASP 46 5.303 -6.923 4.510
199 HB2 ASP 46 2HB ASP 46 6.534 -5.991 1.933
200 HB3 ASP 46 1HB ASP 46 4.945 -6.685 2.221
201 H GLY 47 H GLY 47 8.021 -7.281 5.587
202 HA2 GLY 47 2HA GLY 47 9.306 -8.997 3.530
203 HA3 GLY 47 1HA GLY 47 10.060 -8.466 5.036
204 H VAL 48 H VAL 48 8.674 -9.175 6.975
205 HA VAL 48 HA VAL 48 8.902 -11.902 7.417
206 HB VAL 48 HB VAL 48 8.653 -10.624 9.346
207 HG11 VAL 48 1HG1 VAL 48 6.919 -8.985 7.615
208 HG12 VAL 48 2HG1 VAL 48 8.071 -8.487 8.855
209 HG13 VAL 48 3HG1 VAL 48 6.456 -9.027 9.315
210 HG21 VAL 48 3HG2 VAL 48 5.721 -10.956 9.047
211 HG22 VAL 48 1HG2 VAL 48 6.754 -11.286 10.439
212 HG23 VAL 48 2HG2 VAL 48 6.735 -12.401 9.070
213 H LYS 49 H LYS 49 6.029 -10.079 6.404
214 HA LYS 49 HA LYS 49 4.020 -11.907 6.511
215 HB2 LYS 49 2HB LYS 49 3.320 -10.773 4.295
216 HB3 LYS 49 1HB LYS 49 3.584 -9.761 5.711
217 HG2 LYS 49 2HG LYS 49 5.279 -8.676 4.721
218 HG3 LYS 49 1HG LYS 49 6.051 -10.168 4.221
219 HD2 LYS 49 2HD LYS 49 5.425 -8.890 2.233
220 HD3 LYS 49 1HD LYS 49 4.415 -10.331 2.332
221 HE2 LYS 49 2HE LYS 49 2.601 -8.997 3.362
222 HE3 LYS 49 1HE LYS 49 3.613 -7.544 3.247
223 HZ1 LYS 49 3HZ LYS 49 3.540 -7.551 0.970
224 HZ2 LYS 49 1HZ LYS 49 1.994 -8.156 1.313
225 HZ3 LYS 49 2HZ LYS 49 3.240 -9.220 0.862
226 H TYR 50 H TYR 50 6.066 -11.709 3.528
227 HA TYR 50 HA TYR 50 5.104 -14.353 2.786
228 HB2 TYR 50 2HB TYR 50 6.193 -13.772 0.707
229 HB3 TYR 50 1HB TYR 50 5.218 -12.419 1.270
230 HD1 TYR 50 2HD TYR 50 8.704 -13.751 1.673
231 HD2 TYR 50 1HD TYR 50 6.161 -10.331 1.185
232 HE1 TYR 50 2HE TYR 50 10.706 -12.290 1.569
233 HE2 TYR 50 1HE TYR 50 8.167 -8.867 1.054
234 HH TYR 50 HH TYR 50 11.226 -9.970 0.512
235 H LYS 51 H LYS 51 8.011 -12.853 4.091
236 HA LYS 51 HA LYS 51 9.983 -14.713 3.487
237 HB2 LYS 51 2HB LYS 51 9.293 -12.866 5.689
238 HB3 LYS 51 1HB LYS 51 10.481 -14.099 6.086
239 HG2 LYS 51 2HG LYS 51 10.994 -12.890 3.481
240 HG3 LYS 51 1HG LYS 51 11.004 -11.700 4.782
241 HD2 LYS 51 2HD LYS 51 12.473 -13.477 6.033
242 HD3 LYS 51 1HD LYS 51 12.763 -14.107 4.412
243 HE2 LYS 51 2HE LYS 51 14.375 -12.521 4.200
244 HE3 LYS 51 1HE LYS 51 13.075 -11.313 4.182
245 HZ1 LYS 51 3HZ LYS 51 13.878 -12.461 6.756
246 HZ2 LYS 51 1HZ LYS 51 13.273 -10.915 6.408
247 HZ3 LYS 51 2HZ LYS 51 14.893 -11.290 6.057
248 H ALA 52 H ALA 52 7.782 -14.806 6.189
249 HA ALA 52 HA ALA 52 8.430 -17.328 7.233
250 HB1 ALA 52 1HB ALA 52 5.807 -17.016 7.834
251 HB2 ALA 52 2HB ALA 52 6.224 -15.377 7.334
252 HB3 ALA 52 3HB ALA 52 7.095 -16.142 8.663
253 H LYS 53 H LYS 53 5.787 -16.419 5.173
254 HA LYS 53 HA LYS 53 4.729 -18.982 4.668
255 HB2 LYS 53 2HB LYS 53 4.658 -16.276 3.371
256 HB3 LYS 53 1HB LYS 53 3.808 -17.629 2.635
257 HG2 LYS 53 2HG LYS 53 3.251 -17.651 5.438
258 HG3 LYS 53 1HG LYS 53 2.966 -16.020 4.831
259 HD2 LYS 53 2HD LYS 53 1.517 -16.914 3.057
260 HD3 LYS 53 1HD LYS 53 1.822 -18.557 3.625
261 HE2 LYS 53 2HE LYS 53 -0.230 -18.021 4.669
262 HE3 LYS 53 1HE LYS 53 0.953 -17.629 5.933
263 HZ1 LYS 53 3HZ LYS 53 0.435 -15.563 3.950
264 HZ2 LYS 53 1HZ LYS 53 0.710 -15.418 5.618
265 HZ3 LYS 53 2HZ LYS 53 -0.825 -15.871 5.047
266 H LEU 54 H LEU 54 6.852 -17.003 2.511
267 HA LEU 54 HA LEU 54 7.120 -18.737 0.407
268 HB2 LEU 54 2HB LEU 54 8.980 -16.854 1.784
269 HB3 LEU 54 1HB LEU 54 9.296 -17.543 0.181
270 HG LEU 54 HG LEU 54 6.888 -15.939 1.020
271 HD11 LEU 54 1HD1 LEU 54 8.600 -15.280 -1.298
272 HD12 LEU 54 2HD1 LEU 54 9.282 -15.021 0.310
273 HD13 LEU 54 3HD1 LEU 54 7.784 -14.214 -0.156
274 HD21 LEU 54 3HD2 LEU 54 7.363 -17.806 -1.233
275 HD22 LEU 54 1HD2 LEU 54 6.590 -16.273 -1.645
276 HD23 LEU 54 2HD2 LEU 54 5.853 -17.342 -0.451
277 H ILE 55 H ILE 55 8.458 -18.983 3.592
278 HA ILE 55 HA ILE 55 10.500 -20.863 3.081
279 HB ILE 55 HB ILE 55 9.189 -19.282 5.112
280 HG12 ILE 55 2HG1 ILE 55 11.274 -18.705 5.693
281 HG13 ILE 55 1HG1 ILE 55 11.969 -20.289 5.345
282 HG21 ILE 55 1HG2 ILE 55 10.164 -20.765 6.928
283 HG22 ILE 55 2HG2 ILE 55 9.983 -22.044 5.722
284 HG23 ILE 55 3HG2 ILE 55 8.575 -21.119 6.249
285 HD11 ILE 55 3HD1 ILE 55 12.384 -18.194 3.742
286 HD12 ILE 55 1HD1 ILE 55 10.820 -18.689 3.091
287 HD13 ILE 55 2HD1 ILE 55 12.176 -19.817 3.082
288 H GLY 56 H GLY 56 7.360 -21.101 4.727
289 HA2 GLY 56 2HA GLY 56 5.840 -22.949 3.958
290 HA3 GLY 56 1HA GLY 56 7.275 -23.928 4.008
291 H ILE 57 H ILE 57 6.127 -21.586 6.309
292 HA ILE 57 HA ILE 57 6.665 -23.207 8.548
293 HB ILE 57 HB ILE 57 5.830 -21.179 9.655
294 HG12 ILE 57 2HG1 ILE 57 5.663 -19.632 7.183
295 HG13 ILE 57 1HG1 ILE 57 4.400 -20.860 7.266
296 HG21 ILE 57 1HG2 ILE 57 7.851 -20.259 9.250
297 HG22 ILE 57 2HG2 ILE 57 7.506 -20.080 7.529
298 HG23 ILE 57 3HG2 ILE 57 8.088 -21.621 8.156
299 HD11 ILE 57 3HD1 ILE 57 4.381 -18.372 8.552
300 HD12 ILE 57 1HD1 ILE 57 4.745 -19.532 9.829
301 HD13 ILE 57 2HD1 ILE 57 3.284 -19.718 8.859
302 H ASP 58 H ASP 58 4.089 -21.692 9.276
303 HA ASP 58 HA ASP 58 1.926 -23.368 8.376
304 HB2 ASP 58 2HB ASP 58 3.233 -24.840 9.919
305 HB3 ASP 58 1HB ASP 58 2.938 -23.676 11.218
Start of MODEL 16
1 H SER 24 H SER 24 13.230 13.626 3.349
2 HA SER 24 HA SER 24 12.551 14.630 5.942
3 HB2 SER 24 2HB SER 24 14.347 16.452 4.315
4 HB3 SER 24 1HB SER 24 13.687 16.776 5.915
5 HG SER 24 HG SER 24 15.907 15.966 5.831
6 H LYS 25 H LYS 25 11.565 13.910 3.145
7 HA LYS 25 HA LYS 25 10.536 16.164 1.790
8 HB2 LYS 25 2HB LYS 25 8.978 14.487 0.836
9 HB3 LYS 25 1HB LYS 25 10.625 13.859 0.925
10 HG2 LYS 25 2HG LYS 25 10.134 12.539 2.838
11 HG3 LYS 25 1HG LYS 25 8.624 13.400 3.140
12 HD2 LYS 25 2HD LYS 25 7.639 12.473 1.113
13 HD3 LYS 25 1HD LYS 25 9.164 11.695 0.692
14 HE2 LYS 25 2HE LYS 25 9.033 10.351 2.792
15 HE3 LYS 25 1HE LYS 25 7.448 11.079 3.125
16 HZ1 LYS 25 3HZ LYS 25 6.937 10.385 0.713
17 HZ2 LYS 25 1HZ LYS 25 6.890 9.197 1.921
18 HZ3 LYS 25 2HZ LYS 25 8.241 9.312 0.897
19 H LYS 26 H LYS 26 9.711 14.981 4.891
20 HA LYS 26 HA LYS 26 7.540 16.900 5.120
21 HB2 LYS 26 2HB LYS 26 6.553 14.859 4.045
22 HB3 LYS 26 1HB LYS 26 7.021 13.937 5.474
23 HG2 LYS 26 2HG LYS 26 5.262 14.711 6.660
24 HG3 LYS 26 1HG LYS 26 5.583 16.377 6.175
25 HD2 LYS 26 2HD LYS 26 4.193 14.311 4.443
26 HD3 LYS 26 1HD LYS 26 3.370 15.571 5.364
27 HE2 LYS 26 2HE LYS 26 3.716 17.026 3.665
28 HE3 LYS 26 1HE LYS 26 5.469 16.800 3.834
29 HZ1 LYS 26 3HZ LYS 26 3.584 15.427 2.069
30 HZ2 LYS 26 1HZ LYS 26 4.863 14.513 2.704
31 HZ3 LYS 26 2HZ LYS 26 5.191 15.900 1.779
32 H GLU 27 H GLU 27 7.152 17.437 7.303
33 HA GLU 27 HA GLU 27 9.101 17.217 9.228
34 HB2 GLU 27 2HB GLU 27 6.195 17.727 9.086
35 HB3 GLU 27 1HB GLU 27 6.794 17.312 10.687
36 HG2 GLU 27 2HG GLU 27 7.484 19.448 10.892
37 HG3 GLU 27 1HG GLU 27 8.686 19.104 9.648
38 H LYS 28 H LYS 28 6.744 14.781 8.329
39 HA LYS 28 HA LYS 28 6.677 13.155 10.613
40 HB2 LYS 28 2HB LYS 28 6.193 12.969 7.734
41 HB3 LYS 28 1HB LYS 28 6.679 11.426 8.439
42 HG2 LYS 28 2HG LYS 28 4.928 12.194 10.323
43 HG3 LYS 28 1HG LYS 28 4.237 13.058 8.949
44 HD2 LYS 28 2HD LYS 28 4.941 10.113 8.875
45 HD3 LYS 28 1HD LYS 28 3.334 10.716 9.284
46 HE2 LYS 28 2HE LYS 28 4.154 12.055 6.899
47 HE3 LYS 28 1HE LYS 28 4.443 10.319 6.672
48 HZ1 LYS 28 3HZ LYS 28 2.050 11.366 6.363
49 HZ2 LYS 28 1HZ LYS 28 1.988 11.118 8.039
50 HZ3 LYS 28 2HZ LYS 28 2.269 9.805 6.998
51 H LYS 29 H LYS 29 9.334 13.804 8.515
52 HA LYS 29 HA LYS 29 11.386 12.624 8.139
53 HB2 LYS 29 2HB LYS 29 11.728 14.223 9.871
54 HB3 LYS 29 1HB LYS 29 10.942 13.194 11.067
55 HG2 LYS 29 2HG LYS 29 12.985 12.381 11.586
56 HG3 LYS 29 1HG LYS 29 13.006 11.613 9.998
57 HD2 LYS 29 2HD LYS 29 14.837 12.897 9.619
58 HD3 LYS 29 1HD LYS 29 13.677 14.204 9.378
59 HE2 LYS 29 2HE LYS 29 15.096 15.131 11.005
60 HE3 LYS 29 1HE LYS 29 13.835 14.407 12.020
61 HZ1 LYS 29 3HZ LYS 29 16.450 13.223 11.270
62 HZ2 LYS 29 1HZ LYS 29 15.192 12.322 11.966
63 HZ3 LYS 29 2HZ LYS 29 15.898 13.604 12.831
64 H LYS 30 H LYS 30 10.017 10.525 7.616
65 HA LYS 30 HA LYS 30 9.582 8.443 9.431
66 HB2 LYS 30 2HB LYS 30 10.173 8.740 6.523
67 HB3 LYS 30 1HB LYS 30 10.232 7.111 7.197
68 HG2 LYS 30 2HG LYS 30 7.894 8.927 7.758
69 HG3 LYS 30 1HG LYS 30 7.958 7.967 6.280
70 HD2 LYS 30 2HD LYS 30 8.576 6.026 8.009
71 HD3 LYS 30 1HD LYS 30 7.677 7.067 9.114
72 HE2 LYS 30 2HE LYS 30 5.939 5.773 8.237
73 HE3 LYS 30 1HE LYS 30 5.938 7.126 7.089
74 HZ1 LYS 30 3HZ LYS 30 7.864 5.020 6.561
75 HZ2 LYS 30 1HZ LYS 30 6.889 5.891 5.481
76 HZ3 LYS 30 2HZ LYS 30 6.237 4.581 6.346
77 H GLY 31 H GLY 31 10.954 7.167 10.606
78 HA2 GLY 31 2HA GLY 31 12.971 6.382 11.504
79 HA3 GLY 31 1HA GLY 31 13.309 5.970 9.827
80 HA PRO 32 HA PRO 32 16.399 9.081 11.388
81 HB2 PRO 32 2HB PRO 32 18.594 7.625 10.746
82 HB3 PRO 32 1HB PRO 32 17.764 7.514 12.317
83 HG2 PRO 32 2HG PRO 32 17.533 5.768 9.934
84 HG3 PRO 32 1HG PRO 32 17.639 5.334 11.645
85 HD2 PRO 32 2HD PRO 32 15.309 5.319 10.296
86 HD3 PRO 32 1HD PRO 32 15.407 5.745 12.021
87 H GLU 33 H GLU 33 18.659 9.425 9.896
88 HA GLU 33 HA GLU 33 17.606 10.281 7.350
89 HB2 GLU 33 2HB GLU 33 19.100 11.932 7.814
90 HB3 GLU 33 1HB GLU 33 19.483 11.011 9.273
91 HG2 GLU 33 2HG GLU 33 21.572 11.230 8.249
92 HG3 GLU 33 1HG GLU 33 21.051 9.627 7.741
93 H LYS 34 H LYS 34 18.596 7.557 8.338
94 HA LYS 34 HA LYS 34 20.576 6.575 6.562
95 HB2 LYS 34 2HB LYS 34 18.868 5.823 8.693
96 HB3 LYS 34 1HB LYS 34 18.730 4.618 7.446
97 HG2 LYS 34 2HG LYS 34 21.409 5.653 8.287
98 HG3 LYS 34 1HG LYS 34 20.613 4.393 9.226
99 HD2 LYS 34 2HD LYS 34 20.688 2.847 7.451
100 HD3 LYS 34 1HD LYS 34 20.926 4.111 6.244
101 HE2 LYS 34 2HE LYS 34 23.067 4.218 8.187
102 HE3 LYS 34 1HE LYS 34 22.947 2.587 7.498
103 HZ1 LYS 34 3HZ LYS 34 23.273 3.344 5.385
104 HZ2 LYS 34 1HZ LYS 34 24.192 4.500 6.219
105 HZ3 LYS 34 2HZ LYS 34 22.618 4.879 5.703
106 H THR 35 H THR 35 20.102 4.933 4.796
107 HA THR 35 HA THR 35 17.449 4.825 3.663
108 HB THR 35 HB THR 35 19.455 6.191 1.966
109 HG1 THR 35 1HG THR 35 17.665 7.579 3.636
110 HG21 THR 35 3HG2 THR 35 16.875 7.248 1.660
111 HG22 THR 35 1HG2 THR 35 16.657 5.509 1.860
112 HG23 THR 35 2HG2 THR 35 17.697 6.126 0.574
113 H ASP 36 H ASP 36 20.826 3.972 3.468
114 HA ASP 36 HA ASP 36 20.229 2.011 1.306
115 HB2 ASP 36 2HB ASP 36 22.532 3.582 2.212
116 HB3 ASP 36 1HB ASP 36 22.929 1.905 1.838
117 H GLU 37 H GLU 37 22.387 1.951 4.049
118 HA GLU 37 HA GLU 37 22.142 -0.845 4.508
119 HB2 GLU 37 2HB GLU 37 23.162 1.564 5.950
120 HB3 GLU 37 1HB GLU 37 22.996 0.065 6.863
121 HG2 GLU 37 2HG GLU 37 24.556 -1.071 5.525
122 HG3 GLU 37 1HG GLU 37 24.382 0.070 4.192
123 H TYR 38 H TYR 38 20.139 1.802 5.142
124 HA TYR 38 HA TYR 38 18.732 0.764 7.435
125 HB2 TYR 38 2HB TYR 38 18.011 2.897 7.477
126 HB3 TYR 38 1HB TYR 38 19.156 3.171 6.176
127 HD1 TYR 38 1HD TYR 38 17.988 2.012 3.826
128 HD2 TYR 38 2HD TYR 38 16.084 4.040 7.083
129 HE1 TYR 38 1HE TYR 38 16.094 2.621 2.341
130 HE2 TYR 38 2HE TYR 38 14.189 4.660 5.609
131 HH TYR 38 HH TYR 38 13.586 4.844 3.376
132 H LEU 39 H LEU 39 18.552 0.262 4.030
133 HA LEU 39 HA LEU 39 15.918 -0.310 3.454
134 HB2 LEU 39 2HB LEU 39 18.588 -1.258 2.696
135 HB3 LEU 39 1HB LEU 39 17.327 -2.453 2.417
136 HG LEU 39 HG LEU 39 17.451 -1.148 0.431
137 HD11 LEU 39 1HD1 LEU 39 15.226 -0.819 0.239
138 HD12 LEU 39 2HD1 LEU 39 15.222 0.404 1.510
139 HD13 LEU 39 3HD1 LEU 39 15.142 -1.308 1.930
140 HD21 LEU 39 3HD2 LEU 39 17.277 1.342 0.513
141 HD22 LEU 39 1HD2 LEU 39 18.728 0.731 1.306
142 HD23 LEU 39 2HD2 LEU 39 17.348 1.247 2.272
143 H LEU 40 H LEU 40 18.258 -2.596 4.882
144 HA LEU 40 HA LEU 40 16.406 -4.637 5.536
145 HB2 LEU 40 2HB LEU 40 19.118 -3.729 6.447
146 HB3 LEU 40 1HB LEU 40 18.335 -5.088 7.256
147 HG LEU 40 HG LEU 40 19.862 -5.628 5.253
148 HD11 LEU 40 1HD1 LEU 40 17.727 -7.093 4.337
149 HD12 LEU 40 2HD1 LEU 40 17.173 -6.623 5.943
150 HD13 LEU 40 3HD1 LEU 40 18.684 -7.513 5.758
151 HD21 LEU 40 3HD2 LEU 40 17.412 -4.581 3.801
152 HD22 LEU 40 1HD2 LEU 40 18.738 -5.465 3.045
153 HD23 LEU 40 2HD2 LEU 40 19.026 -3.873 3.746
154 H ALA 41 H ALA 41 17.221 -1.624 7.105
155 HA ALA 41 HA ALA 41 16.271 -2.128 9.710
156 HB1 ALA 41 1HB ALA 41 17.491 -0.092 8.624
157 HB2 ALA 41 2HB ALA 41 16.325 0.234 9.907
158 HB3 ALA 41 3HB ALA 41 15.868 0.464 8.220
159 H ARG 42 H ARG 42 14.630 -1.113 6.749
160 HA ARG 42 HA ARG 42 12.015 -1.111 7.989
161 HB2 ARG 42 2HB ARG 42 13.260 -0.368 5.389
162 HB3 ARG 42 1HB ARG 42 11.516 -0.629 5.434
163 HG2 ARG 42 2HG ARG 42 12.944 1.191 7.386
164 HG3 ARG 42 1HG ARG 42 12.279 1.768 5.856
165 HD2 ARG 42 2HD ARG 42 10.430 0.119 7.493
166 HD3 ARG 42 1HD ARG 42 10.828 1.719 8.151
167 HE ARG 42 HE ARG 42 9.276 1.229 5.746
168 HH11 ARG 42 1HH2 ARG 42 10.278 3.570 7.871
169 HH12 ARG 42 2HH2 ARG 42 10.383 4.854 6.712
170 HH21 ARG 42 1HH1 ARG 42 9.963 2.769 3.972
171 HH22 ARG 42 2HH1 ARG 42 10.206 4.399 4.504
172 H PHE 43 H PHE 43 14.024 -3.295 6.297
173 HA PHE 43 HA PHE 43 12.458 -4.910 4.732
174 HB2 PHE 43 2HB PHE 43 14.766 -5.157 6.498
175 HB3 PHE 43 1HB PHE 43 13.895 -6.676 6.332
176 HD1 PHE 43 1HD PHE 43 14.244 -3.907 3.860
177 HD2 PHE 43 2HD PHE 43 15.274 -7.946 4.895
178 HE1 PHE 43 1HE PHE 43 15.259 -4.222 1.618
179 HE2 PHE 43 2HE PHE 43 16.288 -8.262 2.652
180 HZ PHE 43 HZ PHE 43 16.280 -6.400 1.015
181 H LYS 44 H LYS 44 12.170 -4.488 8.210
182 HA LYS 44 HA LYS 44 10.652 -6.799 8.739
183 HB2 LYS 44 2HB LYS 44 11.305 -4.226 10.078
184 HB3 LYS 44 1HB LYS 44 10.132 -5.317 10.823
185 HG2 LYS 44 2HG LYS 44 12.450 -5.749 11.598
186 HG3 LYS 44 1HG LYS 44 11.739 -7.135 10.774
187 HD2 LYS 44 2HD LYS 44 12.938 -6.625 8.744
188 HD3 LYS 44 1HD LYS 44 13.539 -5.114 9.429
189 HE2 LYS 44 2HE LYS 44 15.269 -6.899 9.541
190 HE3 LYS 44 1HE LYS 44 14.763 -6.412 11.170
191 HZ1 LYS 44 3HZ LYS 44 13.108 -8.439 9.939
192 HZ2 LYS 44 1HZ LYS 44 13.712 -8.349 11.521
193 HZ3 LYS 44 2HZ LYS 44 14.696 -8.945 10.270
194 H GLY 45 H GLY 45 9.701 -4.623 6.700
195 HA2 GLY 45 2HA GLY 45 7.012 -4.054 7.754
196 HA3 GLY 45 1HA GLY 45 7.661 -3.468 6.224
197 H ASP 46 H ASP 46 7.269 -4.630 4.402
198 HA ASP 46 HA ASP 46 5.375 -6.863 4.572
199 HB2 ASP 46 2HB ASP 46 6.682 -5.913 2.047
200 HB3 ASP 46 1HB ASP 46 5.013 -6.394 2.333
201 H GLY 47 H GLY 47 8.169 -7.327 5.550
202 HA2 GLY 47 2HA GLY 47 9.268 -9.080 3.420
203 HA3 GLY 47 1HA GLY 47 10.114 -8.601 4.893
204 H VAL 48 H VAL 48 8.887 -9.321 6.903
205 HA VAL 48 HA VAL 48 9.010 -12.058 7.254
206 HB VAL 48 HB VAL 48 8.930 -10.857 9.238
207 HG11 VAL 48 1HG1 VAL 48 6.878 -9.128 9.434
208 HG12 VAL 48 2HG1 VAL 48 7.141 -9.078 7.690
209 HG13 VAL 48 3HG1 VAL 48 8.457 -8.671 8.793
210 HG21 VAL 48 3HG2 VAL 48 7.080 -11.487 10.411
211 HG22 VAL 48 1HG2 VAL 48 6.862 -12.492 8.978
212 HG23 VAL 48 2HG2 VAL 48 5.977 -10.973 9.133
213 H LYS 49 H LYS 49 6.150 -10.097 6.463
214 HA LYS 49 HA LYS 49 4.098 -11.875 6.664
215 HB2 LYS 49 2HB LYS 49 3.307 -10.692 4.491
216 HB3 LYS 49 1HB LYS 49 3.624 -9.724 5.925
217 HG2 LYS 49 2HG LYS 49 5.327 -8.635 4.939
218 HG3 LYS 49 1HG LYS 49 6.002 -10.106 4.257
219 HD2 LYS 49 2HD LYS 49 5.276 -8.708 2.414
220 HD3 LYS 49 1HD LYS 49 4.156 -10.063 2.535
221 HE2 LYS 49 2HE LYS 49 3.335 -7.822 4.228
222 HE3 LYS 49 1HE LYS 49 3.429 -7.374 2.514
223 HZ1 LYS 49 3HZ LYS 49 1.304 -8.356 2.865
224 HZ2 LYS 49 1HZ LYS 49 1.970 -9.675 3.696
225 HZ3 LYS 49 2HZ LYS 49 2.243 -9.499 2.028
226 H TYR 50 H TYR 50 5.982 -11.671 3.568
227 HA TYR 50 HA TYR 50 4.917 -14.276 2.844
228 HB2 TYR 50 2HB TYR 50 5.990 -13.727 0.735
229 HB3 TYR 50 1HB TYR 50 5.017 -12.384 1.313
230 HD1 TYR 50 2HD TYR 50 8.515 -13.675 1.722
231 HD2 TYR 50 1HD TYR 50 5.952 -10.285 1.119
232 HE1 TYR 50 2HE TYR 50 10.507 -12.216 1.563
233 HE2 TYR 50 1HE TYR 50 7.956 -8.823 0.931
234 HH TYR 50 HH TYR 50 11.167 -10.108 0.710
235 H LYS 51 H LYS 51 7.892 -12.892 4.083
236 HA LYS 51 HA LYS 51 9.756 -14.864 3.369
237 HB2 LYS 51 2HB LYS 51 9.362 -12.820 5.432
238 HB3 LYS 51 1HB LYS 51 10.404 -14.138 5.946
239 HG2 LYS 51 2HG LYS 51 10.938 -13.150 3.218
240 HG3 LYS 51 1HG LYS 51 11.272 -11.988 4.501
241 HD2 LYS 51 2HD LYS 51 12.217 -14.692 5.130
242 HD3 LYS 51 1HD LYS 51 12.981 -14.008 3.694
243 HE2 LYS 51 2HE LYS 51 12.867 -11.924 5.633
244 HE3 LYS 51 1HE LYS 51 13.508 -13.368 6.443
245 HZ1 LYS 51 3HZ LYS 51 15.175 -11.984 5.160
246 HZ2 LYS 51 1HZ LYS 51 14.410 -12.530 3.749
247 HZ3 LYS 51 2HZ LYS 51 15.144 -13.644 4.801
248 H ALA 52 H ALA 52 7.500 -14.759 6.003
249 HA ALA 52 HA ALA 52 8.137 -17.154 7.321
250 HB1 ALA 52 1HB ALA 52 5.724 -15.428 6.978
251 HB2 ALA 52 2HB ALA 52 6.693 -15.685 8.430
252 HB3 ALA 52 3HB ALA 52 5.581 -16.938 7.876
253 H LYS 53 H LYS 53 5.635 -16.520 4.991
254 HA LYS 53 HA LYS 53 4.811 -19.210 4.597
255 HB2 LYS 53 2HB LYS 53 4.481 -16.564 3.231
256 HB3 LYS 53 1HB LYS 53 3.805 -18.021 2.509
257 HG2 LYS 53 2HG LYS 53 3.280 -17.860 5.370
258 HG3 LYS 53 1HG LYS 53 2.604 -16.491 4.487
259 HD2 LYS 53 2HD LYS 53 2.126 -18.884 2.977
260 HD3 LYS 53 1HD LYS 53 1.581 -19.144 4.634
261 HE2 LYS 53 2HE LYS 53 -0.113 -17.610 4.450
262 HE3 LYS 53 1HE LYS 53 0.859 -16.515 3.447
263 HZ1 LYS 53 3HZ LYS 53 -0.027 -19.158 2.457
264 HZ2 LYS 53 1HZ LYS 53 0.528 -17.830 1.560
265 HZ3 LYS 53 2HZ LYS 53 -1.005 -17.780 2.291
266 H LEU 54 H LEU 54 6.753 -17.057 2.420
267 HA LEU 54 HA LEU 54 7.270 -18.821 0.386
268 HB2 LEU 54 2HB LEU 54 8.888 -16.717 1.751
269 HB3 LEU 54 1HB LEU 54 9.315 -17.411 0.177
270 HG LEU 54 HG LEU 54 6.765 -15.998 0.922
271 HD11 LEU 54 1HD1 LEU 54 7.542 -14.263 -0.312
272 HD12 LEU 54 2HD1 LEU 54 8.368 -15.322 -1.457
273 HD13 LEU 54 3HD1 LEU 54 9.102 -14.966 0.107
274 HD21 LEU 54 3HD2 LEU 54 6.316 -16.467 -1.623
275 HD22 LEU 54 1HD2 LEU 54 5.954 -17.712 -0.428
276 HD23 LEU 54 2HD2 LEU 54 7.438 -17.805 -1.374
277 H ILE 55 H ILE 55 8.457 -18.859 3.622
278 HA ILE 55 HA ILE 55 10.728 -20.503 3.287
279 HB ILE 55 HB ILE 55 9.100 -19.054 5.198
280 HG12 ILE 55 2HG1 ILE 55 11.056 -18.181 5.869
281 HG13 ILE 55 1HG1 ILE 55 11.968 -19.669 5.619
282 HG21 ILE 55 1HG2 ILE 55 10.227 -20.377 7.072
283 HG22 ILE 55 2HG2 ILE 55 10.186 -21.678 5.878
284 HG23 ILE 55 3HG2 ILE 55 8.688 -20.894 6.383
285 HD11 ILE 55 3HD1 ILE 55 10.780 -18.331 3.229
286 HD12 ILE 55 1HD1 ILE 55 12.296 -19.219 3.377
287 HD13 ILE 55 2HD1 ILE 55 12.182 -17.561 3.972
288 H GLY 56 H GLY 56 7.594 -21.068 4.863
289 HA2 GLY 56 2HA GLY 56 6.176 -22.918 4.865
290 HA3 GLY 56 1HA GLY 56 7.137 -23.549 3.566
291 H ILE 57 H ILE 57 7.954 -22.824 6.898
292 HA ILE 57 HA ILE 57 9.510 -25.137 7.267
293 HB ILE 57 HB ILE 57 9.568 -24.185 9.551
294 HG12 ILE 57 2HG1 ILE 57 8.146 -21.763 8.597
295 HG13 ILE 57 1HG1 ILE 57 7.114 -23.148 8.955
296 HG21 ILE 57 1HG2 ILE 57 10.122 -21.784 8.243
297 HG22 ILE 57 2HG2 ILE 57 10.350 -23.044 7.029
298 HG23 ILE 57 3HG2 ILE 57 11.248 -23.106 8.543
299 HD11 ILE 57 3HD1 ILE 57 9.227 -22.138 10.871
300 HD12 ILE 57 1HD1 ILE 57 7.933 -23.287 11.205
301 HD13 ILE 57 2HD1 ILE 57 7.552 -21.590 10.917
302 H ASP 58 H ASP 58 7.857 -24.807 9.873
303 HA ASP 58 HA ASP 58 5.522 -26.450 9.400
304 HB2 ASP 58 2HB ASP 58 7.814 -27.822 9.492
305 HB3 ASP 58 1HB ASP 58 7.527 -27.691 11.233
Start of MODEL 17
1 H SER 24 H SER 24 9.670 7.276 19.425
2 HA SER 24 HA SER 24 7.793 9.345 18.788
3 HB2 SER 24 2HB SER 24 6.183 7.849 19.861
4 HB3 SER 24 1HB SER 24 7.225 7.696 21.272
5 HG SER 24 HG SER 24 7.012 10.089 21.360
6 H LYS 25 H LYS 25 10.218 7.916 20.794
7 HA LYS 25 HA LYS 25 10.683 10.040 22.634
8 HB2 LYS 25 2HB LYS 25 12.337 7.802 21.462
9 HB3 LYS 25 1HB LYS 25 12.972 8.878 22.708
10 HG2 LYS 25 2HG LYS 25 10.892 8.293 24.074
11 HG3 LYS 25 1HG LYS 25 10.607 7.004 22.904
12 HD2 LYS 25 2HD LYS 25 13.375 7.085 23.868
13 HD3 LYS 25 1HD LYS 25 12.204 6.793 25.155
14 HE2 LYS 25 2HE LYS 25 12.466 4.610 24.424
15 HE3 LYS 25 1HE LYS 25 11.213 5.116 23.272
16 HZ1 LYS 25 3HZ LYS 25 14.153 5.248 22.859
17 HZ2 LYS 25 1HZ LYS 25 13.003 5.886 21.789
18 HZ3 LYS 25 2HZ LYS 25 13.069 4.211 22.061
19 H LYS 26 H LYS 26 10.297 11.578 20.484
20 HA LYS 26 HA LYS 26 12.367 12.082 18.660
21 HB2 LYS 26 2HB LYS 26 11.340 14.328 18.543
22 HB3 LYS 26 1HB LYS 26 10.101 13.079 18.647
23 HG2 LYS 26 2HG LYS 26 10.672 13.650 21.307
24 HG3 LYS 26 1HG LYS 26 10.722 15.230 20.523
25 HD2 LYS 26 2HD LYS 26 8.496 13.817 19.447
26 HD3 LYS 26 1HD LYS 26 8.425 13.655 21.201
27 HE2 LYS 26 2HE LYS 26 9.047 16.360 20.064
28 HE3 LYS 26 1HE LYS 26 7.367 15.788 20.021
29 HZ1 LYS 26 3HZ LYS 26 7.374 16.542 22.139
30 HZ2 LYS 26 1HZ LYS 26 9.055 16.398 22.315
31 HZ3 LYS 26 2HZ LYS 26 8.067 15.023 22.460
32 H GLU 27 H GLU 27 13.247 14.696 19.060
33 HA GLU 27 HA GLU 27 15.121 15.785 20.018
34 HB2 GLU 27 2HB GLU 27 13.334 16.419 21.525
35 HB3 GLU 27 1HB GLU 27 13.446 14.878 22.375
36 HG2 GLU 27 2HG GLU 27 16.027 15.789 22.553
37 HG3 GLU 27 1HG GLU 27 15.110 17.294 22.645
38 H LYS 28 H LYS 28 14.881 13.707 22.828
39 HA LYS 28 HA LYS 28 17.514 12.978 23.104
40 HB2 LYS 28 2HB LYS 28 15.302 12.388 24.403
41 HB3 LYS 28 1HB LYS 28 15.355 10.911 23.441
42 HG2 LYS 28 2HG LYS 28 17.908 11.701 24.724
43 HG3 LYS 28 1HG LYS 28 16.629 11.179 25.821
44 HD2 LYS 28 2HD LYS 28 16.497 9.043 24.858
45 HD3 LYS 28 1HD LYS 28 17.267 9.567 23.360
46 HE2 LYS 28 2HE LYS 28 19.240 8.829 24.196
47 HE3 LYS 28 1HE LYS 28 19.131 10.093 25.438
48 HZ1 LYS 28 3HZ LYS 28 18.165 8.684 26.932
49 HZ2 LYS 28 1HZ LYS 28 19.133 7.567 26.102
50 HZ3 LYS 28 2HZ LYS 28 17.478 7.690 25.738
51 H LYS 29 H LYS 29 18.917 12.093 21.665
52 HA LYS 29 HA LYS 29 18.977 11.215 19.218
53 HB2 LYS 29 2HB LYS 29 20.688 10.788 21.026
54 HB3 LYS 29 1HB LYS 29 19.826 9.295 21.399
55 HG2 LYS 29 2HG LYS 29 20.097 9.095 18.681
56 HG3 LYS 29 1HG LYS 29 21.588 9.932 19.118
57 HD2 LYS 29 2HD LYS 29 20.732 7.571 20.754
58 HD3 LYS 29 1HD LYS 29 21.473 7.287 19.178
59 HE2 LYS 29 2HE LYS 29 23.511 8.288 19.816
60 HE3 LYS 29 1HE LYS 29 22.759 9.164 21.164
61 HZ1 LYS 29 3HZ LYS 29 23.665 7.373 22.258
62 HZ2 LYS 29 1HZ LYS 29 23.438 6.310 20.955
63 HZ3 LYS 29 2HZ LYS 29 22.113 6.772 21.915
64 H LYS 30 H LYS 30 16.713 10.752 18.589
65 HA LYS 30 HA LYS 30 15.102 8.642 19.408
66 HB2 LYS 30 2HB LYS 30 13.998 9.013 17.338
67 HB3 LYS 30 1HB LYS 30 14.776 10.550 17.710
68 HG2 LYS 30 2HG LYS 30 15.510 10.319 15.541
69 HG3 LYS 30 1HG LYS 30 16.784 9.402 16.343
70 HD2 LYS 30 2HD LYS 30 16.034 7.989 14.585
71 HD3 LYS 30 1HD LYS 30 15.266 7.348 16.037
72 HE2 LYS 30 2HE LYS 30 13.163 7.975 15.359
73 HE3 LYS 30 1HE LYS 30 13.750 9.460 14.584
74 HZ1 LYS 30 3HZ LYS 30 14.410 6.765 13.547
75 HZ2 LYS 30 1HZ LYS 30 14.577 8.258 12.760
76 HZ3 LYS 30 2HZ LYS 30 13.029 7.612 13.035
77 H GLY 31 H GLY 31 15.280 6.439 19.282
78 HA2 GLY 31 2HA GLY 31 16.357 4.371 18.911
79 HA3 GLY 31 1HA GLY 31 16.106 4.835 17.231
80 HA PRO 32 HA PRO 32 20.621 4.334 17.889
81 HB2 PRO 32 2HB PRO 32 21.044 3.023 15.550
82 HB3 PRO 32 1HB PRO 32 20.585 2.208 17.064
83 HG2 PRO 32 2HG PRO 32 18.889 3.029 14.773
84 HG3 PRO 32 1HG PRO 32 18.874 1.528 15.709
85 HD2 PRO 32 2HD PRO 32 17.067 3.491 16.104
86 HD3 PRO 32 1HD PRO 32 17.655 2.459 17.431
87 H GLU 33 H GLU 33 22.400 5.149 16.351
88 HA GLU 33 HA GLU 33 21.440 7.513 14.977
89 HB2 GLU 33 2HB GLU 33 23.329 8.316 15.963
90 HB3 GLU 33 1HB GLU 33 23.541 6.685 16.609
91 HG2 GLU 33 2HG GLU 33 24.860 6.010 14.726
92 HG3 GLU 33 1HG GLU 33 24.531 7.523 13.885
93 H LYS 34 H LYS 34 21.653 4.593 14.164
94 HA LYS 34 HA LYS 34 23.251 4.279 11.861
95 HB2 LYS 34 2HB LYS 34 21.221 3.013 13.415
96 HB3 LYS 34 1HB LYS 34 20.864 2.795 11.722
97 HG2 LYS 34 2HG LYS 34 23.623 2.337 12.826
98 HG3 LYS 34 1HG LYS 34 22.405 1.061 12.858
99 HD2 LYS 34 2HD LYS 34 22.380 0.836 10.548
100 HD3 LYS 34 1HD LYS 34 22.888 2.505 10.280
101 HE2 LYS 34 2HE LYS 34 24.880 1.403 9.781
102 HE3 LYS 34 1HE LYS 34 25.099 1.622 11.529
103 HZ1 LYS 34 3HZ LYS 34 24.624 -0.532 11.961
104 HZ2 LYS 34 1HZ LYS 34 25.176 -0.764 10.374
105 HZ3 LYS 34 2HZ LYS 34 23.508 -0.667 10.687
106 H THR 35 H THR 35 22.509 4.355 9.567
107 HA THR 35 HA THR 35 19.952 5.538 8.948
108 HB THR 35 HB THR 35 22.003 7.295 7.960
109 HG1 THR 35 1HG THR 35 22.888 7.911 9.782
110 HG21 THR 35 3HG2 THR 35 20.388 8.869 8.291
111 HG22 THR 35 1HG2 THR 35 19.950 8.224 9.872
112 HG23 THR 35 2HG2 THR 35 19.351 7.448 8.406
113 H ASP 36 H ASP 36 23.052 4.368 7.853
114 HA ASP 36 HA ASP 36 22.082 4.374 5.039
115 HB2 ASP 36 2HB ASP 36 24.495 5.024 6.179
116 HB3 ASP 36 1HB ASP 36 24.773 3.364 5.646
117 H GLU 37 H GLU 37 24.043 2.139 6.865
118 HA GLU 37 HA GLU 37 23.134 -0.184 5.499
119 HB2 GLU 37 2HB GLU 37 24.686 0.515 7.930
120 HB3 GLU 37 1HB GLU 37 24.025 -1.118 7.880
121 HG2 GLU 37 2HG GLU 37 25.023 -0.942 5.366
122 HG3 GLU 37 1HG GLU 37 26.153 0.111 6.218
123 H TYR 38 H TYR 38 21.745 1.795 7.856
124 HA TYR 38 HA TYR 38 20.021 -0.158 9.118
125 HB2 TYR 38 2HB TYR 38 19.853 1.536 10.602
126 HB3 TYR 38 1HB TYR 38 21.084 2.336 9.637
127 HD1 TYR 38 2HD TYR 38 19.794 3.260 7.259
128 HD2 TYR 38 1HD TYR 38 18.242 3.021 11.246
129 HE1 TYR 38 2HE TYR 38 18.159 5.045 6.728
130 HE2 TYR 38 1HE TYR 38 16.606 4.812 10.728
131 HH TYR 38 HH TYR 38 16.376 6.180 7.446
132 H LEU 39 H LEU 39 19.902 1.735 6.235
133 HA LEU 39 HA LEU 39 17.257 2.305 5.751
134 HB2 LEU 39 2HB LEU 39 19.635 1.508 4.251
135 HB3 LEU 39 1HB LEU 39 18.144 1.067 3.427
136 HG LEU 39 HG LEU 39 18.596 3.247 2.670
137 HD11 LEU 39 1HD1 LEU 39 16.701 4.414 3.286
138 HD12 LEU 39 2HD1 LEU 39 16.896 4.025 4.995
139 HD13 LEU 39 3HD1 LEU 39 16.289 2.803 3.876
140 HD21 LEU 39 3HD2 LEU 39 20.268 4.204 3.894
141 HD22 LEU 39 1HD2 LEU 39 19.642 3.572 5.417
142 HD23 LEU 39 2HD2 LEU 39 18.919 5.009 4.696
143 H LEU 40 H LEU 40 18.800 -0.832 5.032
144 HA LEU 40 HA LEU 40 16.392 -2.217 4.437
145 HB2 LEU 40 2HB LEU 40 19.217 -2.896 5.190
146 HB3 LEU 40 1HB LEU 40 18.029 -4.183 4.975
147 HG LEU 40 HG LEU 40 19.404 -3.487 2.908
148 HD11 LEU 40 1HD1 LEU 40 16.893 -3.245 1.729
149 HD12 LEU 40 2HD1 LEU 40 16.566 -4.093 3.241
150 HD13 LEU 40 3HD1 LEU 40 17.720 -4.760 2.085
151 HD21 LEU 40 3HD2 LEU 40 19.214 -1.059 3.159
152 HD22 LEU 40 1HD2 LEU 40 17.455 -1.167 3.078
153 HD23 LEU 40 2HD2 LEU 40 18.428 -1.556 1.661
154 H ALA 41 H ALA 41 18.119 -1.639 7.452
155 HA ALA 41 HA ALA 41 17.098 -3.501 9.207
156 HB1 ALA 41 1HB ALA 41 17.757 -1.957 10.793
157 HB2 ALA 41 2HB ALA 41 16.877 -0.643 10.014
158 HB3 ALA 41 3HB ALA 41 18.441 -1.155 9.380
159 H ARG 42 H ARG 42 15.399 -0.820 7.688
160 HA ARG 42 HA ARG 42 12.943 -1.292 9.138
161 HB2 ARG 42 2HB ARG 42 13.933 0.638 7.067
162 HB3 ARG 42 1HB ARG 42 12.262 0.660 7.635
163 HG2 ARG 42 2HG ARG 42 13.821 0.520 9.965
164 HG3 ARG 42 1HG ARG 42 14.648 1.686 8.933
165 HD2 ARG 42 2HD ARG 42 11.675 1.784 9.552
166 HD3 ARG 42 1HD ARG 42 12.905 2.763 10.376
167 HE ARG 42 HE ARG 42 12.743 2.854 7.400
168 HH11 ARG 42 1HH1 ARG 42 11.534 4.290 10.213
169 HH12 ARG 42 2HH1 ARG 42 11.913 5.914 9.744
170 HH21 ARG 42 1HH2 ARG 42 13.659 4.965 6.901
171 HH22 ARG 42 2HH2 ARG 42 13.124 6.295 7.871
172 H PHE 43 H PHE 43 14.380 -2.264 6.183
173 HA PHE 43 HA PHE 43 12.231 -2.576 4.399
174 HB2 PHE 43 2HB PHE 43 14.874 -3.815 4.936
175 HB3 PHE 43 1HB PHE 43 13.786 -4.728 3.904
176 HD1 PHE 43 2HD PHE 43 14.327 -1.056 4.322
177 HD2 PHE 43 1HD PHE 43 14.466 -4.451 1.699
178 HE1 PHE 43 2HE PHE 43 14.906 0.437 2.425
179 HE2 PHE 43 1HE PHE 43 15.046 -2.963 -0.201
180 HZ PHE 43 HZ PHE 43 15.263 -0.517 0.162
181 H LYS 44 H LYS 44 12.694 -4.165 7.416
182 HA LYS 44 HA LYS 44 11.547 -6.645 6.811
183 HB2 LYS 44 2HB LYS 44 12.139 -5.038 9.243
184 HB3 LYS 44 1HB LYS 44 11.268 -6.567 9.405
185 HG2 LYS 44 2HG LYS 44 13.696 -6.913 9.600
186 HG3 LYS 44 1HG LYS 44 13.050 -7.718 8.171
187 HD2 LYS 44 2HD LYS 44 13.904 -6.067 6.714
188 HD3 LYS 44 1HD LYS 44 14.196 -4.938 8.036
189 HE2 LYS 44 2HE LYS 44 16.195 -5.911 8.602
190 HE3 LYS 44 1HE LYS 44 15.610 -7.547 8.239
191 HZ1 LYS 44 3HZ LYS 44 15.732 -5.718 5.988
192 HZ2 LYS 44 1HZ LYS 44 16.143 -7.362 6.071
193 HZ3 LYS 44 2HZ LYS 44 17.238 -6.185 6.622
194 H GLY 45 H GLY 45 9.966 -3.995 6.316
195 HA2 GLY 45 2HA GLY 45 7.596 -4.052 7.868
196 HA3 GLY 45 1HA GLY 45 7.711 -3.382 6.246
197 H ASP 46 H ASP 46 7.247 -4.691 4.495
198 HA ASP 46 HA ASP 46 5.382 -6.892 5.022
199 HB2 ASP 46 2HB ASP 46 6.396 -5.943 2.347
200 HB3 ASP 46 1HB ASP 46 4.801 -6.558 2.770
201 H GLY 47 H GLY 47 8.343 -7.285 5.560
202 HA2 GLY 47 2HA GLY 47 9.156 -9.138 3.418
203 HA3 GLY 47 1HA GLY 47 10.112 -8.708 4.838
204 H VAL 48 H VAL 48 8.653 -9.256 6.871
205 HA VAL 48 HA VAL 48 8.823 -11.960 7.396
206 HB VAL 48 HB VAL 48 8.556 -10.632 9.283
207 HG11 VAL 48 1HG1 VAL 48 6.902 -9.007 7.473
208 HG12 VAL 48 2HG1 VAL 48 8.013 -8.500 8.747
209 HG13 VAL 48 3HG1 VAL 48 6.373 -9.012 9.153
210 HG21 VAL 48 3HG2 VAL 48 6.687 -12.395 9.140
211 HG22 VAL 48 1HG2 VAL 48 5.633 -11.015 8.833
212 HG23 VAL 48 2HG2 VAL 48 6.544 -11.109 10.342
213 H LYS 49 H LYS 49 5.944 -10.138 6.331
214 HA LYS 49 HA LYS 49 3.994 -12.052 6.441
215 HB2 LYS 49 2HB LYS 49 3.190 -10.889 4.285
216 HB3 LYS 49 1HB LYS 49 3.451 -9.900 5.717
217 HG2 LYS 49 2HG LYS 49 4.986 -8.673 4.647
218 HG3 LYS 49 1HG LYS 49 5.903 -10.111 4.211
219 HD2 LYS 49 2HD LYS 49 5.105 -8.847 2.204
220 HD3 LYS 49 1HD LYS 49 4.449 -10.483 2.270
221 HE2 LYS 49 2HE LYS 49 2.301 -9.748 2.705
222 HE3 LYS 49 1HE LYS 49 2.863 -8.319 3.594
223 HZ1 LYS 49 3HZ LYS 49 1.972 -8.154 1.118
224 HZ2 LYS 49 1HZ LYS 49 3.593 -8.520 0.772
225 HZ3 LYS 49 2HZ LYS 49 3.212 -7.147 1.698
226 H TYR 50 H TYR 50 6.008 -11.675 3.455
227 HA TYR 50 HA TYR 50 5.148 -14.327 2.623
228 HB2 TYR 50 2HB TYR 50 6.240 -13.649 0.569
229 HB3 TYR 50 1HB TYR 50 5.175 -12.380 1.157
230 HD1 TYR 50 1HD TYR 50 8.730 -13.505 1.510
231 HD2 TYR 50 2HD TYR 50 5.988 -10.225 1.197
232 HE1 TYR 50 1HE TYR 50 10.641 -11.921 1.465
233 HE2 TYR 50 2HE TYR 50 7.896 -8.631 1.159
234 HH TYR 50 HH TYR 50 10.581 -9.007 0.377
235 H LYS 51 H LYS 51 8.072 -12.809 3.936
236 HA LYS 51 HA LYS 51 9.996 -14.704 3.186
237 HB2 LYS 51 2HB LYS 51 9.539 -12.798 5.386
238 HB3 LYS 51 1HB LYS 51 10.697 -14.072 5.730
239 HG2 LYS 51 2HG LYS 51 10.945 -12.771 3.080
240 HG3 LYS 51 1HG LYS 51 11.385 -11.785 4.475
241 HD2 LYS 51 2HD LYS 51 12.645 -14.066 5.154
242 HD3 LYS 51 1HD LYS 51 12.685 -14.236 3.399
243 HE2 LYS 51 2HE LYS 51 13.562 -11.695 4.804
244 HE3 LYS 51 1HE LYS 51 14.685 -13.004 4.382
245 HZ1 LYS 51 3HZ LYS 51 14.137 -11.104 2.670
246 HZ2 LYS 51 1HZ LYS 51 12.789 -12.082 2.346
247 HZ3 LYS 51 2HZ LYS 51 14.356 -12.710 2.157
248 H ALA 52 H ALA 52 7.818 -14.724 5.895
249 HA ALA 52 HA ALA 52 8.567 -17.212 7.006
250 HB1 ALA 52 1HB ALA 52 6.155 -15.435 7.103
251 HB2 ALA 52 2HB ALA 52 7.374 -15.678 8.354
252 HB3 ALA 52 3HB ALA 52 6.200 -16.947 8.006
253 H LYS 53 H LYS 53 5.787 -16.304 5.119
254 HA LYS 53 HA LYS 53 4.644 -18.820 4.699
255 HB2 LYS 53 2HB LYS 53 4.742 -16.207 3.204
256 HB3 LYS 53 1HB LYS 53 3.781 -17.551 2.602
257 HG2 LYS 53 2HG LYS 53 2.720 -17.665 4.916
258 HG3 LYS 53 1HG LYS 53 3.499 -16.117 5.244
259 HD2 LYS 53 2HD LYS 53 2.383 -15.421 2.951
260 HD3 LYS 53 1HD LYS 53 1.287 -16.754 3.319
261 HE2 LYS 53 2HE LYS 53 1.417 -15.449 5.745
262 HE3 LYS 53 1HE LYS 53 1.485 -14.104 4.589
263 HZ1 LYS 53 3HZ LYS 53 -0.772 -14.513 4.736
264 HZ2 LYS 53 1HZ LYS 53 -0.577 -16.191 4.876
265 HZ3 LYS 53 2HZ LYS 53 -0.341 -15.432 3.374
266 H LEU 54 H LEU 54 6.826 -17.040 2.413
267 HA LEU 54 HA LEU 54 7.097 -18.986 0.484
268 HB2 LEU 54 2HB LEU 54 8.969 -17.009 1.708
269 HB3 LEU 54 1HB LEU 54 9.296 -17.850 0.184
270 HG LEU 54 HG LEU 54 6.915 -16.124 0.827
271 HD11 LEU 54 1HD1 LEU 54 9.186 -15.146 0.204
272 HD12 LEU 54 2HD1 LEU 54 7.798 -14.631 -0.754
273 HD13 LEU 54 3HD1 LEU 54 8.911 -15.845 -1.391
274 HD21 LEU 54 3HD2 LEU 54 5.938 -17.771 -0.475
275 HD22 LEU 54 1HD2 LEU 54 7.432 -18.119 -1.343
276 HD23 LEU 54 2HD2 LEU 54 6.506 -16.667 -1.727
277 H ILE 55 H ILE 55 8.500 -18.785 3.658
278 HA ILE 55 HA ILE 55 10.394 -20.878 3.405
279 HB ILE 55 HB ILE 55 9.366 -18.785 5.144
280 HG12 ILE 55 2HG1 ILE 55 11.520 -18.148 5.279
281 HG13 ILE 55 1HG1 ILE 55 12.153 -19.795 5.250
282 HG21 ILE 55 1HG2 ILE 55 8.949 -20.223 6.776
283 HG22 ILE 55 2HG2 ILE 55 10.666 -19.916 7.051
284 HG23 ILE 55 3HG2 ILE 55 10.150 -21.379 6.206
285 HD11 ILE 55 3HD1 ILE 55 10.780 -18.634 2.837
286 HD12 ILE 55 1HD1 ILE 55 11.971 -19.931 2.913
287 HD13 ILE 55 2HD1 ILE 55 12.473 -18.257 3.152
288 H GLY 56 H GLY 56 7.559 -20.437 5.514
289 HA2 GLY 56 2HA GLY 56 5.889 -21.907 6.194
290 HA3 GLY 56 1HA GLY 56 6.410 -22.954 4.909
291 H ILE 57 H ILE 57 8.077 -21.837 7.791
292 HA ILE 57 HA ILE 57 9.248 -24.331 8.359
293 HB ILE 57 HB ILE 57 9.987 -23.032 10.332
294 HG12 ILE 57 2HG1 ILE 57 8.774 -20.587 9.136
295 HG13 ILE 57 1HG1 ILE 57 7.692 -21.624 10.067
296 HG21 ILE 57 1HG2 ILE 57 11.555 -22.534 8.826
297 HG22 ILE 57 2HG2 ILE 57 10.639 -21.072 8.465
298 HG23 ILE 57 3HG2 ILE 57 10.364 -22.542 7.528
299 HD11 ILE 57 3HD1 ILE 57 9.892 -19.905 10.994
300 HD12 ILE 57 1HD1 ILE 57 9.924 -21.531 11.676
301 HD13 ILE 57 2HD1 ILE 57 8.495 -20.518 11.878
302 H ASP 58 H ASP 58 8.332 -23.210 11.096
303 HA ASP 58 HA ASP 58 5.673 -24.130 11.543
304 HB2 ASP 58 2HB ASP 58 7.122 -26.222 10.991
305 HB3 ASP 58 1HB ASP 58 7.780 -26.000 12.619
Start of MODEL 18
1 H SER 24 H SER 24 -4.749 14.503 14.711
2 HA SER 24 HA SER 24 -4.355 16.548 12.747
3 HB2 SER 24 2HB SER 24 -3.720 14.444 11.052
4 HB3 SER 24 1HB SER 24 -2.579 15.642 11.659
5 HG SER 24 HG SER 24 -3.206 13.094 12.738
6 H LYS 25 H LYS 25 -5.166 13.053 12.587
7 HA LYS 25 HA LYS 25 -7.992 13.454 12.599
8 HB2 LYS 25 2HB LYS 25 -7.416 14.592 10.475
9 HB3 LYS 25 1HB LYS 25 -6.661 13.106 9.895
10 HG2 LYS 25 2HG LYS 25 -8.655 12.191 9.345
11 HG3 LYS 25 1HG LYS 25 -9.383 12.672 10.878
12 HD2 LYS 25 2HD LYS 25 -10.323 14.522 9.973
13 HD3 LYS 25 1HD LYS 25 -8.847 14.945 9.106
14 HE2 LYS 25 2HE LYS 25 -10.550 14.451 7.446
15 HE3 LYS 25 1HE LYS 25 -9.418 13.084 7.455
16 HZ1 LYS 25 3HZ LYS 25 -11.879 13.213 9.112
17 HZ2 LYS 25 1HZ LYS 25 -10.842 11.884 8.929
18 HZ3 LYS 25 2HZ LYS 25 -11.788 12.409 7.619
19 H LYS 26 H LYS 26 -7.885 11.560 13.911
20 HA LYS 26 HA LYS 26 -7.870 9.236 14.334
21 HB2 LYS 26 2HB LYS 26 -9.274 9.776 12.073
22 HB3 LYS 26 1HB LYS 26 -8.056 8.677 11.423
23 HG2 LYS 26 2HG LYS 26 -8.897 6.880 12.541
24 HG3 LYS 26 1HG LYS 26 -9.251 7.824 13.988
25 HD2 LYS 26 2HD LYS 26 -11.357 8.404 13.264
26 HD3 LYS 26 1HD LYS 26 -10.891 8.390 11.563
27 HE2 LYS 26 2HE LYS 26 -11.051 6.026 11.419
28 HE3 LYS 26 1HE LYS 26 -11.040 5.838 13.184
29 HZ1 LYS 26 3HZ LYS 26 -13.270 5.818 12.899
30 HZ2 LYS 26 1HZ LYS 26 -13.212 6.655 11.424
31 HZ3 LYS 26 2HZ LYS 26 -13.081 7.507 12.889
32 H GLU 27 H GLU 27 -5.386 9.815 14.644
33 HA GLU 27 HA GLU 27 -3.326 9.330 12.898
34 HB2 GLU 27 2HB GLU 27 -3.499 9.729 15.505
35 HB3 GLU 27 1HB GLU 27 -3.312 7.976 15.576
36 HG2 GLU 27 2HG GLU 27 -1.337 8.503 13.848
37 HG3 GLU 27 1HG GLU 27 -1.366 10.056 14.682
38 H LYS 28 H LYS 28 -5.604 6.961 14.132
39 HA LYS 28 HA LYS 28 -4.238 4.553 13.646
40 HB2 LYS 28 2HB LYS 28 -6.307 4.512 14.798
41 HB3 LYS 28 1HB LYS 28 -7.122 5.430 13.531
42 HG2 LYS 28 2HG LYS 28 -7.716 3.003 13.491
43 HG3 LYS 28 1HG LYS 28 -6.950 3.541 11.996
44 HD2 LYS 28 2HD LYS 28 -4.731 2.802 13.224
45 HD3 LYS 28 1HD LYS 28 -5.834 1.808 14.176
46 HE2 LYS 28 2HE LYS 28 -6.357 0.442 12.391
47 HE3 LYS 28 1HE LYS 28 -6.176 1.752 11.205
48 HZ1 LYS 28 3HZ LYS 28 -3.719 1.681 12.099
49 HZ2 LYS 28 1HZ LYS 28 -4.225 0.651 10.849
50 HZ3 LYS 28 2HZ LYS 28 -4.123 0.066 12.441
51 H LYS 29 H LYS 29 -5.288 6.919 11.385
52 HA LYS 29 HA LYS 29 -6.029 5.561 9.097
53 HB2 LYS 29 2HB LYS 29 -4.745 8.072 9.839
54 HB3 LYS 29 1HB LYS 29 -4.253 7.528 8.235
55 HG2 LYS 29 2HG LYS 29 -7.149 7.314 8.873
56 HG3 LYS 29 1HG LYS 29 -6.510 8.943 8.654
57 HD2 LYS 29 2HD LYS 29 -6.976 8.461 6.452
58 HD3 LYS 29 1HD LYS 29 -5.353 7.774 6.535
59 HE2 LYS 29 2HE LYS 29 -6.325 5.838 5.821
60 HE3 LYS 29 1HE LYS 29 -6.974 5.706 7.468
61 HZ1 LYS 29 3HZ LYS 29 -8.265 6.739 5.042
62 HZ2 LYS 29 1HZ LYS 29 -8.693 7.419 6.535
63 HZ3 LYS 29 2HZ LYS 29 -8.908 5.755 6.270
64 H LYS 30 H LYS 30 -4.367 5.504 7.073
65 HA LYS 30 HA LYS 30 -2.816 3.258 7.108
66 HB2 LYS 30 2HB LYS 30 -2.878 5.810 5.638
67 HB3 LYS 30 1HB LYS 30 -1.348 4.940 5.506
68 HG2 LYS 30 2HG LYS 30 -2.450 2.968 4.678
69 HG3 LYS 30 1HG LYS 30 -4.041 3.636 5.041
70 HD2 LYS 30 2HD LYS 30 -4.055 4.971 3.182
71 HD3 LYS 30 1HD LYS 30 -2.321 5.283 3.270
72 HE2 LYS 30 2HE LYS 30 -3.030 2.471 2.666
73 HE3 LYS 30 1HE LYS 30 -3.449 3.643 1.400
74 HZ1 LYS 30 3HZ LYS 30 -0.852 3.844 2.763
75 HZ2 LYS 30 1HZ LYS 30 -1.287 4.357 1.205
76 HZ3 LYS 30 2HZ LYS 30 -1.046 2.704 1.518
77 H GLY 31 H GLY 31 -1.533 2.833 8.934
78 HA2 GLY 31 2HA GLY 31 0.258 3.005 10.416
79 HA3 GLY 31 1HA GLY 31 1.092 3.745 9.057
80 HA PRO 32 HA PRO 32 0.272 6.802 12.539
81 HB2 PRO 32 2HB PRO 32 2.825 7.104 13.398
82 HB3 PRO 32 1HB PRO 32 1.699 5.903 14.073
83 HG2 PRO 32 2HG PRO 32 3.835 5.560 12.051
84 HG3 PRO 32 1HG PRO 32 3.384 4.521 13.409
85 HD2 PRO 32 2HD PRO 32 2.670 3.986 10.854
86 HD3 PRO 32 1HD PRO 32 1.670 3.529 12.252
87 H GLU 33 H GLU 33 1.500 9.047 12.682
88 HA GLU 33 HA GLU 33 2.005 9.912 9.960
89 HB2 GLU 33 2HB GLU 33 0.793 11.641 10.805
90 HB3 GLU 33 1HB GLU 33 0.851 10.811 12.364
91 HG2 GLU 33 2HG GLU 33 1.781 12.909 12.831
92 HG3 GLU 33 1HG GLU 33 3.184 11.865 12.635
93 H LYS 34 H LYS 34 3.737 8.535 12.030
94 HA LYS 34 HA LYS 34 6.086 10.084 12.493
95 HB2 LYS 34 2HB LYS 34 4.867 7.589 13.042
96 HB3 LYS 34 1HB LYS 34 6.476 7.278 12.452
97 HG2 LYS 34 2HG LYS 34 6.158 9.482 14.397
98 HG3 LYS 34 1HG LYS 34 5.947 7.847 15.019
99 HD2 LYS 34 2HD LYS 34 8.154 7.203 14.200
100 HD3 LYS 34 1HD LYS 34 8.361 8.782 13.441
101 HE2 LYS 34 2HE LYS 34 7.892 8.446 16.419
102 HE3 LYS 34 1HE LYS 34 9.507 8.559 15.697
103 HZ1 LYS 34 3HZ LYS 34 7.827 10.537 14.582
104 HZ2 LYS 34 1HZ LYS 34 9.262 10.741 15.465
105 HZ3 LYS 34 2HZ LYS 34 7.771 10.655 16.277
106 H THR 35 H THR 35 8.293 8.942 11.587
107 HA THR 35 HA THR 35 8.100 7.893 8.909
108 HB THR 35 HB THR 35 9.510 10.437 8.873
109 HG1 THR 35 1HG THR 35 7.738 11.006 10.148
110 HG21 THR 35 3HG2 THR 35 7.661 8.872 7.123
111 HG22 THR 35 1HG2 THR 35 9.292 9.448 6.784
112 HG23 THR 35 2HG2 THR 35 7.939 10.580 6.783
113 H ASP 36 H ASP 36 10.096 8.894 11.576
114 HA ASP 36 HA ASP 36 12.508 7.814 10.184
115 HB2 ASP 36 2HB ASP 36 12.462 10.149 11.187
116 HB3 ASP 36 1HB ASP 36 12.358 9.370 12.765
117 H GLU 37 H GLU 37 11.553 7.904 13.546
118 HA GLU 37 HA GLU 37 12.768 5.413 14.205
119 HB2 GLU 37 2HB GLU 37 10.908 7.382 15.411
120 HB3 GLU 37 1HB GLU 37 10.866 5.764 16.109
121 HG2 GLU 37 2HG GLU 37 13.498 6.018 16.064
122 HG3 GLU 37 1HG GLU 37 13.119 7.741 16.044
123 H TYR 38 H TYR 38 9.958 6.254 12.557
124 HA TYR 38 HA TYR 38 8.346 3.921 13.116
125 HB2 TYR 38 2HB TYR 38 6.803 5.286 12.200
126 HB3 TYR 38 1HB TYR 38 8.072 6.500 12.204
127 HD1 TYR 38 2HD TYR 38 9.854 5.852 10.074
128 HD2 TYR 38 1HD TYR 38 5.599 5.380 10.261
129 HE1 TYR 38 2HE TYR 38 9.734 5.944 7.601
130 HE2 TYR 38 1HE TYR 38 5.466 5.483 7.790
131 HH TYR 38 HH TYR 38 8.289 5.313 5.797
132 H LEU 39 H LEU 39 10.940 4.663 10.973
133 HA LEU 39 HA LEU 39 10.549 3.182 8.690
134 HB2 LEU 39 2HB LEU 39 12.759 3.939 10.459
135 HB3 LEU 39 1HB LEU 39 13.097 2.496 9.513
136 HG LEU 39 HG LEU 39 13.816 4.290 8.157
137 HD11 LEU 39 1HD1 LEU 39 11.045 4.016 7.070
138 HD12 LEU 39 2HD1 LEU 39 12.069 2.584 7.180
139 HD13 LEU 39 3HD1 LEU 39 12.588 3.969 6.217
140 HD21 LEU 39 3HD2 LEU 39 12.736 6.078 9.466
141 HD22 LEU 39 1HD2 LEU 39 11.175 5.630 8.777
142 HD23 LEU 39 2HD2 LEU 39 12.441 6.290 7.741
143 H LEU 40 H LEU 40 11.909 1.866 11.727
144 HA LEU 40 HA LEU 40 11.788 -0.859 10.967
145 HB2 LEU 40 2HB LEU 40 11.908 0.726 13.512
146 HB3 LEU 40 1HB LEU 40 11.772 -1.032 13.586
147 HG LEU 40 HG LEU 40 14.148 0.003 13.550
148 HD11 LEU 40 1HD1 LEU 40 13.005 -2.338 12.212
149 HD12 LEU 40 2HD1 LEU 40 14.431 -2.226 13.245
150 HD13 LEU 40 3HD1 LEU 40 14.555 -1.853 11.526
151 HD21 LEU 40 3HD2 LEU 40 13.760 1.565 11.687
152 HD22 LEU 40 1HD2 LEU 40 13.394 0.212 10.618
153 HD23 LEU 40 2HD2 LEU 40 15.023 0.409 11.264
154 H ALA 41 H ALA 41 9.410 1.252 12.557
155 HA ALA 41 HA ALA 41 7.483 -0.581 13.365
156 HB1 ALA 41 1HB ALA 41 7.536 2.010 13.402
157 HB2 ALA 41 2HB ALA 41 5.963 1.250 13.156
158 HB3 ALA 41 3HB ALA 41 6.845 1.917 11.782
159 H ARG 42 H ARG 42 8.370 0.472 10.140
160 HA ARG 42 HA ARG 42 6.276 -1.045 8.846
161 HB2 ARG 42 2HB ARG 42 8.434 0.868 8.059
162 HB3 ARG 42 1HB ARG 42 7.585 -0.059 6.822
163 HG2 ARG 42 2HG ARG 42 5.767 1.134 8.776
164 HG3 ARG 42 1HG ARG 42 6.720 2.341 7.914
165 HD2 ARG 42 2HD ARG 42 5.891 0.420 5.983
166 HD3 ARG 42 1HD ARG 42 4.463 0.857 6.940
167 HE ARG 42 HE ARG 42 6.149 2.762 5.400
168 HH11 ARG 42 1HH1 ARG 42 4.338 2.844 8.199
169 HH12 ARG 42 2HH1 ARG 42 3.199 4.028 7.650
170 HH21 ARG 42 1HH2 ARG 42 4.322 3.978 4.369
171 HH22 ARG 42 2HH2 ARG 42 3.195 4.676 5.484
172 H PHE 43 H PHE 43 9.596 -1.454 9.713
173 HA PHE 43 HA PHE 43 10.731 -3.095 7.819
174 HB2 PHE 43 2HB PHE 43 10.817 -2.740 10.727
175 HB3 PHE 43 1HB PHE 43 11.283 -4.357 10.228
176 HD1 PHE 43 1HD PHE 43 11.737 -1.055 8.522
177 HD2 PHE 43 2HD PHE 43 13.624 -4.442 10.372
178 HE1 PHE 43 1HE PHE 43 13.961 -0.190 7.844
179 HE2 PHE 43 2HE PHE 43 15.846 -3.579 9.691
180 HZ PHE 43 HZ PHE 43 16.015 -1.453 8.426
181 H LYS 44 H LYS 44 8.399 -4.134 10.332
182 HA LYS 44 HA LYS 44 8.276 -6.804 9.381
183 HB2 LYS 44 2HB LYS 44 6.879 -5.114 11.400
184 HB3 LYS 44 1HB LYS 44 6.326 -6.762 11.080
185 HG2 LYS 44 2HG LYS 44 7.983 -6.682 12.918
186 HG3 LYS 44 1HG LYS 44 8.550 -7.630 11.546
187 HD2 LYS 44 2HD LYS 44 9.987 -5.894 10.807
188 HD3 LYS 44 1HD LYS 44 9.235 -4.715 11.880
189 HE2 LYS 44 2HE LYS 44 10.307 -5.554 13.781
190 HE3 LYS 44 1HE LYS 44 10.527 -7.163 13.064
191 HZ1 LYS 44 3HZ LYS 44 11.957 -4.655 12.405
192 HZ2 LYS 44 1HZ LYS 44 11.934 -5.973 11.339
193 HZ3 LYS 44 2HZ LYS 44 12.616 -6.144 12.886
194 H GLY 45 H GLY 45 7.316 -4.313 7.797
195 HA2 GLY 45 2HA GLY 45 4.514 -4.781 7.268
196 HA3 GLY 45 1HA GLY 45 5.570 -3.736 6.339
197 H ASP 46 H ASP 46 6.687 -4.599 4.598
198 HA ASP 46 HA ASP 46 5.576 -7.137 3.543
199 HB2 ASP 46 2HB ASP 46 7.214 -5.831 1.616
200 HB3 ASP 46 1HB ASP 46 5.456 -5.943 1.648
201 H GLY 47 H GLY 47 7.193 -7.916 5.361
202 HA2 GLY 47 2HA GLY 47 9.662 -8.757 3.933
203 HA3 GLY 47 1HA GLY 47 9.803 -8.097 5.562
204 H VAL 48 H VAL 48 8.419 -9.149 7.182
205 HA VAL 48 HA VAL 48 8.949 -11.905 7.443
206 HB VAL 48 HB VAL 48 8.693 -10.758 9.452
207 HG11 VAL 48 1HG1 VAL 48 6.725 -9.177 7.920
208 HG12 VAL 48 2HG1 VAL 48 7.898 -8.652 9.127
209 HG13 VAL 48 3HG1 VAL 48 6.370 -9.374 9.635
210 HG21 VAL 48 3HG2 VAL 48 7.103 -12.706 9.363
211 HG22 VAL 48 1HG2 VAL 48 5.830 -11.538 9.015
212 HG23 VAL 48 2HG2 VAL 48 6.705 -11.456 10.546
213 H LYS 49 H LYS 49 5.896 -10.236 6.681
214 HA LYS 49 HA LYS 49 4.035 -12.203 6.770
215 HB2 LYS 49 2HB LYS 49 3.130 -10.962 4.691
216 HB3 LYS 49 1HB LYS 49 3.417 -10.044 6.157
217 HG2 LYS 49 2HG LYS 49 5.050 -8.814 5.222
218 HG3 LYS 49 1HG LYS 49 5.793 -10.198 4.456
219 HD2 LYS 49 2HD LYS 49 3.561 -8.457 3.432
220 HD3 LYS 49 1HD LYS 49 5.087 -8.850 2.650
221 HE2 LYS 49 2HE LYS 49 4.273 -11.256 2.499
222 HE3 LYS 49 1HE LYS 49 2.683 -10.664 3.014
223 HZ1 LYS 49 3HZ LYS 49 2.944 -8.933 1.220
224 HZ2 LYS 49 1HZ LYS 49 2.657 -10.517 0.687
225 HZ3 LYS 49 2HZ LYS 49 4.225 -9.868 0.615
226 H TYR 50 H TYR 50 5.853 -11.666 3.657
227 HA TYR 50 HA TYR 50 4.952 -14.265 2.746
228 HB2 TYR 50 2HB TYR 50 6.260 -13.579 0.762
229 HB3 TYR 50 1HB TYR 50 5.076 -12.381 1.271
230 HD1 TYR 50 1HD TYR 50 8.659 -13.327 1.770
231 HD2 TYR 50 2HD TYR 50 5.740 -10.200 1.572
232 HE1 TYR 50 1HE TYR 50 10.471 -11.636 1.932
233 HE2 TYR 50 2HE TYR 50 7.536 -8.503 1.729
234 HH TYR 50 HH TYR 50 10.636 -9.044 1.112
235 H LYS 51 H LYS 51 7.976 -12.903 4.018
236 HA LYS 51 HA LYS 51 9.804 -14.880 3.318
237 HB2 LYS 51 2HB LYS 51 9.384 -12.927 5.450
238 HB3 LYS 51 1HB LYS 51 10.371 -14.291 5.951
239 HG2 LYS 51 2HG LYS 51 11.065 -13.252 3.292
240 HG3 LYS 51 1HG LYS 51 11.320 -12.094 4.599
241 HD2 LYS 51 2HD LYS 51 12.249 -14.640 5.496
242 HD3 LYS 51 1HD LYS 51 12.937 -14.345 3.899
243 HE2 LYS 51 2HE LYS 51 14.447 -12.969 4.883
244 HE3 LYS 51 1HE LYS 51 13.107 -11.880 5.300
245 HZ1 LYS 51 3HZ LYS 51 14.087 -12.537 7.338
246 HZ2 LYS 51 1HZ LYS 51 14.139 -14.169 6.882
247 HZ3 LYS 51 2HZ LYS 51 12.645 -13.426 7.202
248 H ALA 52 H ALA 52 7.853 -14.829 6.206
249 HA ALA 52 HA ALA 52 8.368 -17.329 7.277
250 HB1 ALA 52 1HB ALA 52 6.013 -17.090 8.170
251 HB2 ALA 52 2HB ALA 52 5.841 -15.702 7.096
252 HB3 ALA 52 3HB ALA 52 7.033 -15.669 8.397
253 H LYS 53 H LYS 53 5.747 -16.525 5.133
254 HA LYS 53 HA LYS 53 4.810 -19.167 4.696
255 HB2 LYS 53 2HB LYS 53 4.519 -16.483 3.373
256 HB3 LYS 53 1HB LYS 53 3.704 -17.899 2.724
257 HG2 LYS 53 2HG LYS 53 3.186 -18.054 5.449
258 HG3 LYS 53 1HG LYS 53 3.070 -16.328 5.103
259 HD2 LYS 53 2HD LYS 53 1.731 -17.444 2.966
260 HD3 LYS 53 1HD LYS 53 1.292 -18.524 4.291
261 HE2 LYS 53 2HE LYS 53 0.957 -16.181 5.570
262 HE3 LYS 53 1HE LYS 53 0.633 -15.637 3.913
263 HZ1 LYS 53 3HZ LYS 53 -1.167 -16.968 3.721
264 HZ2 LYS 53 1HZ LYS 53 -1.206 -16.827 5.411
265 HZ3 LYS 53 2HZ LYS 53 -0.511 -18.200 4.690
266 H LEU 54 H LEU 54 6.716 -17.039 2.456
267 HA LEU 54 HA LEU 54 7.067 -18.796 0.378
268 HB2 LEU 54 2HB LEU 54 8.815 -16.753 1.673
269 HB3 LEU 54 1HB LEU 54 9.141 -17.447 0.075
270 HG LEU 54 HG LEU 54 6.666 -15.975 0.952
271 HD11 LEU 54 1HD1 LEU 54 7.619 -14.908 -1.387
272 HD12 LEU 54 2HD1 LEU 54 9.094 -15.349 -0.523
273 HD13 LEU 54 3HD1 LEU 54 7.921 -14.266 0.227
274 HD21 LEU 54 3HD2 LEU 54 7.179 -17.834 -1.324
275 HD22 LEU 54 1HD2 LEU 54 6.195 -16.403 -1.639
276 HD23 LEU 54 2HD2 LEU 54 5.698 -17.564 -0.407
277 H ILE 55 H ILE 55 8.462 -18.871 3.545
278 HA ILE 55 HA ILE 55 10.645 -20.592 3.051
279 HB ILE 55 HB ILE 55 9.210 -19.091 5.075
280 HG12 ILE 55 2HG1 ILE 55 11.241 -18.281 5.597
281 HG13 ILE 55 1HG1 ILE 55 12.085 -19.797 5.275
282 HG21 ILE 55 1HG2 ILE 55 8.824 -20.961 6.250
283 HG22 ILE 55 2HG2 ILE 55 10.381 -20.424 6.885
284 HG23 ILE 55 3HG2 ILE 55 10.310 -21.737 5.706
285 HD11 ILE 55 3HD1 ILE 55 10.754 -18.352 3.013
286 HD12 ILE 55 1HD1 ILE 55 12.187 -19.379 2.989
287 HD13 ILE 55 2HD1 ILE 55 12.291 -17.733 3.615
288 H GLY 56 H GLY 56 7.575 -21.045 4.786
289 HA2 GLY 56 2HA GLY 56 6.070 -22.860 4.662
290 HA3 GLY 56 1HA GLY 56 7.223 -23.662 3.646
291 H ILE 57 H ILE 57 7.474 -22.438 6.927
292 HA ILE 57 HA ILE 57 8.964 -24.629 7.866
293 HB ILE 57 HB ILE 57 8.686 -23.343 9.956
294 HG12 ILE 57 2HG1 ILE 57 7.343 -21.167 8.430
295 HG13 ILE 57 1HG1 ILE 57 6.318 -22.516 8.920
296 HG21 ILE 57 1HG2 ILE 57 9.336 -21.157 8.273
297 HG22 ILE 57 2HG2 ILE 57 9.883 -22.636 7.479
298 HG23 ILE 57 3HG2 ILE 57 10.438 -22.253 9.109
299 HD11 ILE 57 3HD1 ILE 57 6.959 -20.369 10.521
300 HD12 ILE 57 1HD1 ILE 57 8.132 -21.579 11.038
301 HD13 ILE 57 2HD1 ILE 57 6.407 -21.937 11.113
302 H ASP 58 H ASP 58 7.002 -23.996 10.148
303 HA ASP 58 HA ASP 58 5.752 -26.527 10.380
304 HB2 ASP 58 2HB ASP 58 6.354 -24.713 12.130
305 HB3 ASP 58 1HB ASP 58 4.797 -23.988 11.701
Start of MODEL 19
1 H SER 24 H SER 24 18.681 29.211 16.839
2 HA SER 24 HA SER 24 20.997 28.204 18.189
3 HB2 SER 24 2HB SER 24 18.830 29.449 19.903
4 HB3 SER 24 1HB SER 24 20.022 28.317 20.535
5 HG SER 24 HG SER 24 20.640 30.715 19.143
6 H LYS 25 H LYS 25 17.553 28.048 19.148
7 HA LYS 25 HA LYS 25 17.306 25.306 19.457
8 HB2 LYS 25 2HB LYS 25 15.643 27.618 19.102
9 HB3 LYS 25 1HB LYS 25 14.946 26.276 18.193
10 HG2 LYS 25 2HG LYS 25 14.711 24.935 20.104
11 HG3 LYS 25 1HG LYS 25 15.907 25.858 21.014
12 HD2 LYS 25 2HD LYS 25 13.881 27.693 20.278
13 HD3 LYS 25 1HD LYS 25 13.055 26.253 20.877
14 HE2 LYS 25 2HE LYS 25 15.099 26.534 22.709
15 HE3 LYS 25 1HE LYS 25 14.665 28.219 22.360
16 HZ1 LYS 25 3HZ LYS 25 12.990 26.055 23.424
17 HZ2 LYS 25 1HZ LYS 25 12.261 27.244 22.460
18 HZ3 LYS 25 2HZ LYS 25 13.064 27.688 23.890
19 H LYS 26 H LYS 26 17.584 27.099 16.462
20 HA LYS 26 HA LYS 26 16.467 25.449 14.540
21 HB2 LYS 26 2HB LYS 26 18.592 27.414 14.772
22 HB3 LYS 26 1HB LYS 26 18.986 26.205 13.549
23 HG2 LYS 26 2HG LYS 26 16.209 27.305 13.567
24 HG3 LYS 26 1HG LYS 26 17.499 28.340 12.955
25 HD2 LYS 26 2HD LYS 26 18.202 26.227 11.584
26 HD3 LYS 26 1HD LYS 26 16.555 25.683 11.907
27 HE2 LYS 26 2HE LYS 26 15.630 27.249 10.509
28 HE3 LYS 26 1HE LYS 26 16.820 28.489 10.955
29 HZ1 LYS 26 3HZ LYS 26 17.319 26.112 9.241
30 HZ2 LYS 26 1HZ LYS 26 18.507 27.217 9.737
31 HZ3 LYS 26 2HZ LYS 26 17.248 27.726 8.716
32 H GLU 27 H GLU 27 19.985 25.230 15.057
33 HA GLU 27 HA GLU 27 21.412 23.351 15.107
34 HB2 GLU 27 2HB GLU 27 20.522 22.510 17.047
35 HB3 GLU 27 1HB GLU 27 18.869 22.618 16.452
36 HG2 GLU 27 2HG GLU 27 19.600 20.261 16.801
37 HG3 GLU 27 1HG GLU 27 19.180 20.588 15.120
38 H LYS 28 H LYS 28 22.055 22.543 13.156
39 HA LYS 28 HA LYS 28 20.604 22.092 10.855
40 HB2 LYS 28 2HB LYS 28 23.173 21.729 11.731
41 HB3 LYS 28 1HB LYS 28 22.675 20.063 11.431
42 HG2 LYS 28 2HG LYS 28 21.687 21.482 9.236
43 HG3 LYS 28 1HG LYS 28 23.285 22.173 9.520
44 HD2 LYS 28 2HD LYS 28 23.310 19.272 9.788
45 HD3 LYS 28 1HD LYS 28 22.740 19.774 8.195
46 HE2 LYS 28 2HE LYS 28 24.745 21.227 7.948
47 HE3 LYS 28 1HE LYS 28 25.332 20.647 9.519
48 HZ1 LYS 28 3HZ LYS 28 25.092 19.211 6.984
49 HZ2 LYS 28 1HZ LYS 28 24.746 18.340 8.398
50 HZ3 LYS 28 2HZ LYS 28 26.269 19.070 8.202
51 H LYS 29 H LYS 29 18.700 20.932 10.745
52 HA LYS 29 HA LYS 29 17.902 18.809 12.398
53 HB2 LYS 29 2HB LYS 29 17.034 20.244 10.067
54 HB3 LYS 29 1HB LYS 29 16.720 18.523 9.837
55 HG2 LYS 29 2HG LYS 29 14.926 18.707 11.179
56 HG3 LYS 29 1HG LYS 29 16.006 19.116 12.513
57 HD2 LYS 29 2HD LYS 29 15.657 21.388 12.285
58 HD3 LYS 29 1HD LYS 29 15.328 21.272 10.556
59 HE2 LYS 29 2HE LYS 29 13.204 21.741 11.549
60 HE3 LYS 29 1HE LYS 29 13.177 19.990 11.253
61 HZ1 LYS 29 3HZ LYS 29 12.612 20.119 13.479
62 HZ2 LYS 29 1HZ LYS 29 13.642 21.432 13.784
63 HZ3 LYS 29 2HZ LYS 29 14.292 19.879 13.562
64 H LYS 30 H LYS 30 19.995 17.510 12.397
65 HA LYS 30 HA LYS 30 21.202 16.233 10.260
66 HB2 LYS 30 2HB LYS 30 21.977 14.710 11.927
67 HB3 LYS 30 1HB LYS 30 21.677 16.228 12.774
68 HG2 LYS 30 2HG LYS 30 19.322 15.300 13.242
69 HG3 LYS 30 1HG LYS 30 19.973 13.736 12.749
70 HD2 LYS 30 2HD LYS 30 21.151 15.483 14.929
71 HD3 LYS 30 1HD LYS 30 20.115 14.084 15.212
72 HE2 LYS 30 2HE LYS 30 22.709 13.924 13.641
73 HE3 LYS 30 1HE LYS 30 22.590 13.567 15.376
74 HZ1 LYS 30 3HZ LYS 30 20.608 12.120 14.668
75 HZ2 LYS 30 1HZ LYS 30 22.171 11.519 14.402
76 HZ3 LYS 30 2HZ LYS 30 21.287 12.188 13.114
77 H GLY 31 H GLY 31 20.577 14.658 8.816
78 HA2 GLY 31 2HA GLY 31 17.977 13.863 8.347
79 HA3 GLY 31 1HA GLY 31 19.363 12.883 7.879
80 HA PRO 32 HA PRO 32 16.798 10.819 11.234
81 HB2 PRO 32 2HB PRO 32 15.846 8.756 9.756
82 HB3 PRO 32 1HB PRO 32 14.989 10.304 9.946
83 HG2 PRO 32 2HG PRO 32 16.695 9.350 7.725
84 HG3 PRO 32 1HG PRO 32 15.170 10.244 7.678
85 HD2 PRO 32 2HD PRO 32 17.575 11.422 7.291
86 HD3 PRO 32 1HD PRO 32 16.192 12.267 8.026
87 H GLU 33 H GLU 33 17.570 8.933 12.342
88 HA GLU 33 HA GLU 33 20.034 7.815 11.265
89 HB2 GLU 33 2HB GLU 33 20.658 8.181 13.424
90 HB3 GLU 33 1HB GLU 33 19.029 8.817 13.672
91 HG2 GLU 33 2HG GLU 33 18.190 6.632 14.266
92 HG3 GLU 33 1HG GLU 33 19.752 5.895 13.909
93 H LYS 34 H LYS 34 17.098 7.183 10.936
94 HA LYS 34 HA LYS 34 16.752 4.408 11.686
95 HB2 LYS 34 2HB LYS 34 15.386 6.683 10.568
96 HB3 LYS 34 1HB LYS 34 14.865 5.181 9.874
97 HG2 LYS 34 2HG LYS 34 15.156 4.891 12.723
98 HG3 LYS 34 1HG LYS 34 14.113 6.269 12.371
99 HD2 LYS 34 2HD LYS 34 13.312 4.254 10.584
100 HD3 LYS 34 1HD LYS 34 13.539 3.443 12.135
101 HE2 LYS 34 2HE LYS 34 11.259 4.249 12.102
102 HE3 LYS 34 1HE LYS 34 12.159 5.342 13.172
103 HZ1 LYS 34 3HZ LYS 34 10.749 6.346 11.269
104 HZ2 LYS 34 1HZ LYS 34 12.040 5.870 10.276
105 HZ3 LYS 34 2HZ LYS 34 12.309 6.959 11.553
106 H THR 35 H THR 35 18.491 3.378 10.525
107 HA THR 35 HA THR 35 17.900 2.844 7.722
108 HB THR 35 HB THR 35 20.707 3.440 8.080
109 HG1 THR 35 1HG THR 35 20.023 5.814 8.022
110 HG21 THR 35 3HG2 THR 35 18.782 3.461 6.047
111 HG22 THR 35 1HG2 THR 35 20.477 3.928 5.896
112 HG23 THR 35 2HG2 THR 35 19.255 5.149 6.248
113 H ASP 36 H ASP 36 19.778 2.188 10.581
114 HA ASP 36 HA ASP 36 20.453 -0.526 9.535
115 HB2 ASP 36 2HB ASP 36 22.093 1.342 10.596
116 HB3 ASP 36 1HB ASP 36 21.590 0.519 12.073
117 H GLU 37 H GLU 37 19.866 0.870 12.675
118 HA GLU 37 HA GLU 37 18.562 -1.433 13.747
119 HB2 GLU 37 2HB GLU 37 19.166 1.361 14.476
120 HB3 GLU 37 1HB GLU 37 17.736 0.695 15.266
121 HG2 GLU 37 2HG GLU 37 19.678 -1.338 15.391
122 HG3 GLU 37 1HG GLU 37 20.528 0.152 15.805
123 H TYR 38 H TYR 38 17.629 1.007 11.610
124 HA TYR 38 HA TYR 38 14.789 1.050 12.202
125 HB2 TYR 38 2HB TYR 38 14.946 2.914 10.937
126 HB3 TYR 38 1HB TYR 38 16.677 2.652 10.985
127 HD1 TYR 38 2HD TYR 38 17.241 0.507 9.227
128 HD2 TYR 38 1HD TYR 38 14.256 3.551 8.844
129 HE1 TYR 38 2HE TYR 38 17.229 0.175 6.762
130 HE2 TYR 38 1HE TYR 38 14.236 3.236 6.378
131 HH TYR 38 HH TYR 38 16.408 2.067 4.665
132 H LEU 39 H LEU 39 16.904 -0.932 10.321
133 HA LEU 39 HA LEU 39 15.380 -1.872 8.218
134 HB2 LEU 39 2HB LEU 39 17.459 -2.847 10.036
135 HB3 LEU 39 1HB LEU 39 16.479 -4.143 9.365
136 HG LEU 39 HG LEU 39 18.198 -3.882 7.792
137 HD11 LEU 39 1HD1 LEU 39 16.420 -1.928 6.456
138 HD12 LEU 39 2HD1 LEU 39 15.668 -3.428 6.998
139 HD13 LEU 39 3HD1 LEU 39 17.027 -3.479 5.874
140 HD21 LEU 39 3HD2 LEU 39 17.913 -0.976 8.440
141 HD22 LEU 39 1HD2 LEU 39 18.649 -1.450 6.912
142 HD23 LEU 39 2HD2 LEU 39 19.364 -1.972 8.437
143 H LEU 40 H LEU 40 15.355 -3.230 11.529
144 HA LEU 40 HA LEU 40 13.141 -4.952 11.177
145 HB2 LEU 40 2HB LEU 40 14.539 -3.584 13.455
146 HB3 LEU 40 1HB LEU 40 13.108 -4.567 13.770
147 HG LEU 40 HG LEU 40 15.425 -5.724 13.868
148 HD11 LEU 40 1HD1 LEU 40 14.301 -7.662 12.360
149 HD12 LEU 40 2HD1 LEU 40 12.902 -6.609 12.565
150 HD13 LEU 40 3HD1 LEU 40 13.725 -7.266 13.980
151 HD21 LEU 40 3HD2 LEU 40 14.991 -5.553 10.868
152 HD22 LEU 40 1HD2 LEU 40 16.198 -6.570 11.658
153 HD23 LEU 40 2HD2 LEU 40 16.316 -4.814 11.767
154 H ALA 41 H ALA 41 13.335 -1.541 12.102
155 HA ALA 41 HA ALA 41 10.774 -1.022 13.024
156 HB1 ALA 41 1HB ALA 41 11.423 1.149 12.645
157 HB2 ALA 41 2HB ALA 41 11.806 0.831 10.953
158 HB3 ALA 41 3HB ALA 41 12.965 0.411 12.213
159 H ARG 42 H ARG 42 11.856 -1.521 9.690
160 HA ARG 42 HA ARG 42 9.195 -1.206 8.602
161 HB2 ARG 42 2HB ARG 42 11.970 -1.644 7.571
162 HB3 ARG 42 1HB ARG 42 10.583 -1.767 6.487
163 HG2 ARG 42 2HG ARG 42 9.944 0.551 7.647
164 HG3 ARG 42 1HG ARG 42 11.691 0.629 7.885
165 HD2 ARG 42 2HD ARG 42 12.129 0.559 5.553
166 HD3 ARG 42 1HD ARG 42 10.491 -0.018 5.181
167 HE ARG 42 HE ARG 42 10.957 2.687 6.379
168 HH11 ARG 42 1HH1 ARG 42 8.367 0.973 5.523
169 HH12 ARG 42 2HH1 ARG 42 7.839 1.969 4.208
170 HH21 ARG 42 1HH2 ARG 42 10.778 3.807 4.074
171 HH22 ARG 42 2HH2 ARG 42 9.205 3.578 3.390
172 H PHE 43 H PHE 43 11.200 -3.763 9.700
173 HA PHE 43 HA PHE 43 10.680 -5.966 8.137
174 HB2 PHE 43 2HB PHE 43 11.130 -5.373 10.985
175 HB3 PHE 43 1HB PHE 43 10.360 -6.922 10.689
176 HD1 PHE 43 2HD PHE 43 12.716 -5.179 8.413
177 HD2 PHE 43 1HD PHE 43 12.169 -8.401 11.200
178 HE1 PHE 43 2HE PHE 43 14.908 -6.128 7.747
179 HE2 PHE 43 1HE PHE 43 14.364 -9.349 10.537
180 HZ PHE 43 HZ PHE 43 15.731 -8.214 8.806
181 H LYS 44 H LYS 44 8.429 -4.526 10.509
182 HA LYS 44 HA LYS 44 6.446 -6.497 10.308
183 HB2 LYS 44 2HB LYS 44 6.654 -3.695 11.282
184 HB3 LYS 44 1HB LYS 44 5.090 -4.517 11.306
185 HG2 LYS 44 2HG LYS 44 6.297 -4.845 13.427
186 HG3 LYS 44 1HG LYS 44 6.073 -6.370 12.573
187 HD2 LYS 44 2HD LYS 44 8.327 -6.388 11.813
188 HD3 LYS 44 1HD LYS 44 8.576 -4.713 12.309
189 HE2 LYS 44 2HE LYS 44 7.687 -6.444 14.516
190 HE3 LYS 44 1HE LYS 44 9.265 -6.899 13.844
191 HZ1 LYS 44 3HZ LYS 44 9.590 -4.317 13.829
192 HZ2 LYS 44 1HZ LYS 44 9.891 -5.213 15.236
193 HZ3 LYS 44 2HZ LYS 44 8.428 -4.366 15.068
194 H GLY 45 H GLY 45 7.335 -4.928 7.751
195 HA2 GLY 45 2HA GLY 45 4.611 -4.188 6.826
196 HA3 GLY 45 1HA GLY 45 6.101 -3.583 6.125
197 H ASP 46 H ASP 46 6.976 -4.658 4.451
198 HA ASP 46 HA ASP 46 5.611 -7.135 3.531
199 HB2 ASP 46 2HB ASP 46 7.201 -6.074 1.461
200 HB3 ASP 46 1HB ASP 46 5.449 -5.967 1.619
201 H GLY 47 H GLY 47 7.196 -7.999 5.279
202 HA2 GLY 47 2HA GLY 47 9.583 -9.002 3.828
203 HA3 GLY 47 1HA GLY 47 9.816 -8.286 5.426
204 H VAL 48 H VAL 48 8.531 -9.214 7.162
205 HA VAL 48 HA VAL 48 8.880 -11.963 7.524
206 HB VAL 48 HB VAL 48 8.662 -10.703 9.476
207 HG11 VAL 48 1HG1 VAL 48 6.852 -9.101 7.830
208 HG12 VAL 48 2HG1 VAL 48 7.869 -8.618 9.186
209 HG13 VAL 48 3HG1 VAL 48 6.278 -9.307 9.483
210 HG21 VAL 48 3HG2 VAL 48 6.605 -11.259 10.576
211 HG22 VAL 48 1HG2 VAL 48 7.077 -12.612 9.548
212 HG23 VAL 48 2HG2 VAL 48 5.804 -11.508 9.024
213 H LYS 49 H LYS 49 5.897 -10.188 6.709
214 HA LYS 49 HA LYS 49 3.972 -12.100 6.812
215 HB2 LYS 49 2HB LYS 49 3.122 -10.872 4.694
216 HB3 LYS 49 1HB LYS 49 3.400 -9.943 6.156
217 HG2 LYS 49 2HG LYS 49 5.040 -8.728 5.218
218 HG3 LYS 49 1HG LYS 49 5.814 -10.144 4.529
219 HD2 LYS 49 2HD LYS 49 3.636 -8.426 3.362
220 HD3 LYS 49 1HD LYS 49 5.170 -8.898 2.639
221 HE2 LYS 49 2HE LYS 49 3.871 -10.418 1.508
222 HE3 LYS 49 1HE LYS 49 3.968 -11.345 3.017
223 HZ1 LYS 49 3HZ LYS 49 1.749 -9.880 1.921
224 HZ2 LYS 49 1HZ LYS 49 2.058 -9.494 3.543
225 HZ3 LYS 49 2HZ LYS 49 1.762 -11.107 3.097
226 H TYR 50 H TYR 50 5.857 -11.659 3.731
227 HA TYR 50 HA TYR 50 4.938 -14.284 2.877
228 HB2 TYR 50 2HB TYR 50 6.114 -13.601 0.833
229 HB3 TYR 50 1HB TYR 50 4.986 -12.375 1.400
230 HD1 TYR 50 1HD TYR 50 8.574 -13.380 1.859
231 HD2 TYR 50 2HD TYR 50 5.711 -10.214 1.488
232 HE1 TYR 50 1HE TYR 50 10.416 -11.716 1.937
233 HE2 TYR 50 2HE TYR 50 7.539 -8.546 1.559
234 HH TYR 50 HH TYR 50 10.953 -9.562 1.720
235 H LYS 51 H LYS 51 7.899 -12.871 4.195
236 HA LYS 51 HA LYS 51 9.792 -14.765 3.390
237 HB2 LYS 51 2HB LYS 51 9.332 -12.927 5.651
238 HB3 LYS 51 1HB LYS 51 10.481 -14.216 5.960
239 HG2 LYS 51 2HG LYS 51 10.898 -13.033 3.338
240 HG3 LYS 51 1HG LYS 51 11.024 -11.832 4.623
241 HD2 LYS 51 2HD LYS 51 12.424 -13.859 5.748
242 HD3 LYS 51 1HD LYS 51 12.756 -14.171 4.044
243 HE2 LYS 51 2HE LYS 51 13.004 -11.359 5.090
244 HE3 LYS 51 1HE LYS 51 14.326 -12.515 5.353
245 HZ1 LYS 51 3HZ LYS 51 13.244 -11.472 2.835
246 HZ2 LYS 51 1HZ LYS 51 13.817 -13.069 2.853
247 HZ3 LYS 51 2HZ LYS 51 14.856 -11.789 3.268
248 H ALA 52 H ALA 52 7.766 -14.830 6.224
249 HA ALA 52 HA ALA 52 8.391 -17.335 7.264
250 HB1 ALA 52 1HB ALA 52 6.890 -16.479 8.710
251 HB2 ALA 52 2HB ALA 52 5.617 -16.882 7.556
252 HB3 ALA 52 3HB ALA 52 6.394 -15.300 7.496
253 H LYS 53 H LYS 53 5.757 -16.519 5.147
254 HA LYS 53 HA LYS 53 4.821 -19.145 4.653
255 HB2 LYS 53 2HB LYS 53 4.599 -16.466 3.289
256 HB3 LYS 53 1HB LYS 53 3.711 -17.874 2.725
257 HG2 LYS 53 2HG LYS 53 2.898 -18.110 5.165
258 HG3 LYS 53 1HG LYS 53 3.474 -16.456 5.371
259 HD2 LYS 53 2HD LYS 53 1.704 -17.099 3.037
260 HD3 LYS 53 1HD LYS 53 0.980 -16.897 4.632
261 HE2 LYS 53 2HE LYS 53 2.369 -14.694 4.746
262 HE3 LYS 53 1HE LYS 53 2.491 -14.870 2.985
263 HZ1 LYS 53 3HZ LYS 53 -0.013 -14.874 4.585
264 HZ2 LYS 53 1HZ LYS 53 0.068 -15.174 2.918
265 HZ3 LYS 53 2HZ LYS 53 0.499 -13.647 3.527
266 H LEU 54 H LEU 54 6.751 -16.997 2.455
267 HA LEU 54 HA LEU 54 7.104 -18.715 0.347
268 HB2 LEU 54 2HB LEU 54 8.854 -16.707 1.694
269 HB3 LEU 54 1HB LEU 54 9.196 -17.375 0.088
270 HG LEU 54 HG LEU 54 6.721 -15.903 0.963
271 HD11 LEU 54 1HD1 LEU 54 7.741 -14.136 0.076
272 HD12 LEU 54 2HD1 LEU 54 7.952 -15.001 -1.447
273 HD13 LEU 54 3HD1 LEU 54 9.174 -15.128 -0.181
274 HD21 LEU 54 3HD2 LEU 54 6.250 -16.280 -1.625
275 HD22 LEU 54 1HD2 LEU 54 5.769 -17.480 -0.425
276 HD23 LEU 54 2HD2 LEU 54 7.249 -17.710 -1.355
277 H ILE 55 H ILE 55 8.478 -18.869 3.511
278 HA ILE 55 HA ILE 55 10.669 -20.568 2.994
279 HB ILE 55 HB ILE 55 9.223 -19.113 5.035
280 HG12 ILE 55 2HG1 ILE 55 11.250 -18.330 5.596
281 HG13 ILE 55 1HG1 ILE 55 12.090 -19.844 5.252
282 HG21 ILE 55 1HG2 ILE 55 10.370 -21.755 5.664
283 HG22 ILE 55 2HG2 ILE 55 8.806 -21.069 6.108
284 HG23 ILE 55 3HG2 ILE 55 10.284 -20.462 6.860
285 HD11 ILE 55 3HD1 ILE 55 12.138 -19.405 2.944
286 HD12 ILE 55 1HD1 ILE 55 12.395 -17.801 3.634
287 HD13 ILE 55 2HD1 ILE 55 10.798 -18.262 3.041
288 H GLY 56 H GLY 56 7.579 -21.078 4.672
289 HA2 GLY 56 2HA GLY 56 6.158 -23.002 4.055
290 HA3 GLY 56 1HA GLY 56 7.648 -23.870 3.829
291 H ILE 57 H ILE 57 6.694 -21.791 6.446
292 HA ILE 57 HA ILE 57 7.636 -23.521 8.457
293 HB ILE 57 HB ILE 57 6.827 -21.642 9.823
294 HG12 ILE 57 2HG1 ILE 57 6.185 -20.071 7.394
295 HG13 ILE 57 1HG1 ILE 57 4.982 -21.284 7.828
296 HG21 ILE 57 1HG2 ILE 57 8.113 -20.225 7.636
297 HG22 ILE 57 2HG2 ILE 57 8.862 -21.792 7.947
298 HG23 ILE 57 3HG2 ILE 57 8.735 -20.602 9.243
299 HD11 ILE 57 3HD1 ILE 57 5.892 -18.882 9.377
300 HD12 ILE 57 1HD1 ILE 57 5.291 -20.290 10.251
301 HD13 ILE 57 2HD1 ILE 57 4.254 -19.465 9.086
302 H ASP 58 H ASP 58 5.107 -22.266 9.654
303 HA ASP 58 HA ASP 58 2.854 -23.824 8.910
304 HB2 ASP 58 2HB ASP 58 4.588 -25.517 9.820
305 HB3 ASP 58 1HB ASP 58 4.220 -24.832 11.408
Start of MODEL 20
1 H SER 24 H SER 24 -1.806 5.874 -0.599
2 HA SER 24 HA SER 24 -1.695 8.514 -1.698
3 HB2 SER 24 2HB SER 24 0.583 7.757 0.161
4 HB3 SER 24 1HB SER 24 0.531 9.196 -0.853
5 HG SER 24 HG SER 24 -0.643 8.706 1.551
6 H LYS 25 H LYS 25 1.366 8.067 -2.077
7 HA LYS 25 HA LYS 25 1.849 5.574 -3.303
8 HB2 LYS 25 2HB LYS 25 -0.059 7.147 -4.654
9 HB3 LYS 25 1HB LYS 25 1.417 7.277 -5.611
10 HG2 LYS 25 2HG LYS 25 1.500 4.993 -6.048
11 HG3 LYS 25 1HG LYS 25 0.576 4.580 -4.605
12 HD2 LYS 25 2HD LYS 25 -1.460 5.012 -5.613
13 HD3 LYS 25 1HD LYS 25 -0.778 6.203 -6.722
14 HE2 LYS 25 2HE LYS 25 -0.111 4.597 -8.252
15 HE3 LYS 25 1HE LYS 25 0.137 3.364 -7.001
16 HZ1 LYS 25 3HZ LYS 25 -2.397 4.308 -8.184
17 HZ2 LYS 25 1HZ LYS 25 -2.381 3.620 -6.634
18 HZ3 LYS 25 2HZ LYS 25 -1.850 2.713 -7.971
19 H LYS 26 H LYS 26 3.676 5.869 -5.075
20 HA LYS 26 HA LYS 26 5.170 8.295 -5.174
21 HB2 LYS 26 2HB LYS 26 5.386 7.818 -2.767
22 HB3 LYS 26 1HB LYS 26 6.025 6.216 -3.137
23 HG2 LYS 26 2HG LYS 26 8.032 7.086 -4.015
24 HG3 LYS 26 1HG LYS 26 7.346 8.696 -4.229
25 HD2 LYS 26 2HD LYS 26 7.612 9.257 -2.011
26 HD3 LYS 26 1HD LYS 26 7.416 7.592 -1.459
27 HE2 LYS 26 2HE LYS 26 9.657 7.013 -2.185
28 HE3 LYS 26 1HE LYS 26 9.860 8.597 -2.959
29 HZ1 LYS 26 3HZ LYS 26 9.150 9.435 -0.604
30 HZ2 LYS 26 1HZ LYS 26 10.766 9.020 -0.912
31 HZ3 LYS 26 2HZ LYS 26 9.748 7.927 -0.102
32 H GLU 27 H GLU 27 4.440 6.260 -7.022
33 HA GLU 27 HA GLU 27 6.182 4.215 -7.629
34 HB2 GLU 27 2HB GLU 27 5.596 4.767 -10.003
35 HB3 GLU 27 1HB GLU 27 4.200 4.806 -8.924
36 HG2 GLU 27 2HG GLU 27 4.555 7.286 -8.677
37 HG3 GLU 27 1HG GLU 27 5.788 7.178 -9.935
38 H LYS 28 H LYS 28 6.891 7.637 -7.658
39 HA LYS 28 HA LYS 28 9.030 7.857 -9.431
40 HB2 LYS 28 2HB LYS 28 9.524 9.824 -8.188
41 HB3 LYS 28 1HB LYS 28 7.795 9.565 -7.958
42 HG2 LYS 28 2HG LYS 28 8.311 8.368 -5.818
43 HG3 LYS 28 1HG LYS 28 10.008 8.800 -6.030
44 HD2 LYS 28 2HD LYS 28 7.796 10.863 -5.998
45 HD3 LYS 28 1HD LYS 28 8.650 10.361 -4.537
46 HE2 LYS 28 2HE LYS 28 10.813 11.005 -5.616
47 HE3 LYS 28 1HE LYS 28 9.897 11.611 -7.012
48 HZ1 LYS 28 3HZ LYS 28 9.561 12.484 -4.189
49 HZ2 LYS 28 1HZ LYS 28 8.623 13.021 -5.495
50 HZ3 LYS 28 2HZ LYS 28 10.280 13.393 -5.432
51 H LYS 29 H LYS 29 11.287 8.580 -7.954
52 HA LYS 29 HA LYS 29 12.913 6.396 -7.807
53 HB2 LYS 29 2HB LYS 29 12.912 9.066 -6.924
54 HB3 LYS 29 1HB LYS 29 13.418 8.109 -5.529
55 HG2 LYS 29 2HG LYS 29 14.931 6.879 -7.307
56 HG3 LYS 29 1HG LYS 29 14.722 8.377 -8.216
57 HD2 LYS 29 2HD LYS 29 16.725 8.580 -6.861
58 HD3 LYS 29 1HD LYS 29 15.491 9.645 -6.190
59 HE2 LYS 29 2HE LYS 29 15.146 8.283 -4.319
60 HE3 LYS 29 1HE LYS 29 15.739 6.828 -5.146
61 HZ1 LYS 29 3HZ LYS 29 17.383 7.778 -3.583
62 HZ2 LYS 29 1HZ LYS 29 17.410 9.202 -4.506
63 HZ3 LYS 29 2HZ LYS 29 17.944 7.739 -5.187
64 H LYS 30 H LYS 30 12.912 4.519 -6.653
65 HA LYS 30 HA LYS 30 11.012 3.922 -4.613
66 HB2 LYS 30 2HB LYS 30 13.462 2.686 -5.813
67 HB3 LYS 30 1HB LYS 30 12.768 1.956 -4.365
68 HG2 LYS 30 2HG LYS 30 10.508 2.157 -5.700
69 HG3 LYS 30 1HG LYS 30 11.573 2.231 -7.104
70 HD2 LYS 30 2HD LYS 30 11.920 0.013 -7.008
71 HD3 LYS 30 1HD LYS 30 12.464 0.140 -5.335
72 HE2 LYS 30 2HE LYS 30 10.448 -1.348 -5.611
73 HE3 LYS 30 1HE LYS 30 10.143 0.033 -4.540
74 HZ1 LYS 30 3HZ LYS 30 8.811 1.018 -6.037
75 HZ2 LYS 30 1HZ LYS 30 8.655 -0.536 -6.699
76 HZ3 LYS 30 2HZ LYS 30 9.770 0.560 -7.362
77 H GLY 31 H GLY 31 12.160 2.781 -2.508
78 HA2 GLY 31 2HA GLY 31 12.941 4.834 -0.791
79 HA3 GLY 31 1HA GLY 31 13.260 3.132 -0.483
80 HA PRO 32 HA PRO 32 17.290 5.337 -1.009
81 HB2 PRO 32 2HB PRO 32 18.468 4.208 1.160
82 HB3 PRO 32 1HB PRO 32 17.520 5.712 1.228
83 HG2 PRO 32 2HG PRO 32 16.699 2.934 1.859
84 HG3 PRO 32 1HG PRO 32 16.365 4.436 2.733
85 HD2 PRO 32 2HD PRO 32 14.531 3.270 1.148
86 HD3 PRO 32 1HD PRO 32 14.655 5.039 1.308
87 H GLU 33 H GLU 33 19.573 3.941 -0.588
88 HA GLU 33 HA GLU 33 19.295 1.661 -2.366
89 HB2 GLU 33 2HB GLU 33 21.208 2.606 -3.156
90 HB3 GLU 33 1HB GLU 33 20.975 3.829 -1.902
91 HG2 GLU 33 2HG GLU 33 22.265 2.541 -0.313
92 HG3 GLU 33 1HG GLU 33 22.444 1.227 -1.476
93 H LYS 34 H LYS 34 18.842 1.952 0.584
94 HA LYS 34 HA LYS 34 20.550 0.331 2.120
95 HB2 LYS 34 2HB LYS 34 18.053 1.697 2.174
96 HB3 LYS 34 1HB LYS 34 17.861 0.140 2.932
97 HG2 LYS 34 2HG LYS 34 20.045 2.123 3.570
98 HG3 LYS 34 1HG LYS 34 18.577 1.917 4.525
99 HD2 LYS 34 2HD LYS 34 19.439 0.121 5.589
100 HD3 LYS 34 1HD LYS 34 19.879 -0.634 4.056
101 HE2 LYS 34 2HE LYS 34 21.758 1.344 4.189
102 HE3 LYS 34 1HE LYS 34 21.556 0.945 5.908
103 HZ1 LYS 34 3HZ LYS 34 21.858 -1.361 5.430
104 HZ2 LYS 34 1HZ LYS 34 23.162 -0.521 4.745
105 HZ3 LYS 34 2HZ LYS 34 21.896 -1.074 3.756
106 H THR 35 H THR 35 20.196 -1.939 2.782
107 HA THR 35 HA THR 35 18.212 -3.547 1.444
108 HB THR 35 HB THR 35 20.917 -4.422 0.743
109 HG1 THR 35 1HG THR 35 20.481 -2.849 -1.171
110 HG21 THR 35 3HG2 THR 35 19.855 -5.151 -1.266
111 HG22 THR 35 1HG2 THR 35 18.474 -4.089 -0.991
112 HG23 THR 35 2HG2 THR 35 18.726 -5.495 0.045
113 H ASP 36 H ASP 36 21.033 -3.356 3.501
114 HA ASP 36 HA ASP 36 20.556 -6.099 4.533
115 HB2 ASP 36 2HB ASP 36 22.781 -4.332 4.177
116 HB3 ASP 36 1HB ASP 36 22.647 -4.740 5.888
117 H GLU 37 H GLU 37 21.422 -3.118 6.122
118 HA GLU 37 HA GLU 37 20.079 -3.717 8.557
119 HB2 GLU 37 2HB GLU 37 21.365 -1.384 7.232
120 HB3 GLU 37 1HB GLU 37 20.280 -1.025 8.576
121 HG2 GLU 37 2HG GLU 37 21.541 -2.594 10.013
122 HG3 GLU 37 1HG GLU 37 22.634 -2.936 8.671
123 H TYR 38 H TYR 38 19.004 -2.706 5.518
124 HA TYR 38 HA TYR 38 16.624 -1.288 6.346
125 HB2 TYR 38 2HB TYR 38 16.744 -0.652 4.190
126 HB3 TYR 38 1HB TYR 38 18.263 -1.527 4.137
127 HD1 TYR 38 2HD TYR 38 17.584 -4.324 4.080
128 HD2 TYR 38 1HD TYR 38 15.572 -0.993 2.285
129 HE1 TYR 38 2HE TYR 38 16.586 -5.837 2.383
130 HE2 TYR 38 1HE TYR 38 14.581 -2.492 0.579
131 HH TYR 38 HH TYR 38 14.579 -5.854 0.876
132 H LEU 39 H LEU 39 17.481 -4.601 5.906
133 HA LEU 39 HA LEU 39 15.169 -5.911 5.166
134 HB2 LEU 39 2HB LEU 39 17.504 -6.355 6.868
135 HB3 LEU 39 1HB LEU 39 16.108 -7.288 7.395
136 HG LEU 39 HG LEU 39 17.162 -8.694 5.841
137 HD11 LEU 39 1HD1 LEU 39 15.531 -9.044 4.247
138 HD12 LEU 39 2HD1 LEU 39 15.391 -7.328 3.870
139 HD13 LEU 39 3HD1 LEU 39 14.662 -7.970 5.343
140 HD21 LEU 39 3HD2 LEU 39 18.151 -6.225 4.827
141 HD22 LEU 39 1HD2 LEU 39 17.419 -7.107 3.486
142 HD23 LEU 39 2HD2 LEU 39 18.701 -7.855 4.440
143 H LEU 40 H LEU 40 16.037 -4.968 8.487
144 HA LEU 40 HA LEU 40 13.538 -5.557 9.681
145 HB2 LEU 40 2HB LEU 40 15.934 -3.849 10.276
146 HB3 LEU 40 1HB LEU 40 14.553 -3.838 11.374
147 HG LEU 40 HG LEU 40 16.431 -5.547 11.843
148 HD11 LEU 40 1HD1 LEU 40 14.555 -5.944 13.131
149 HD12 LEU 40 2HD1 LEU 40 14.508 -7.389 12.119
150 HD13 LEU 40 3HD1 LEU 40 13.484 -6.005 11.731
151 HD21 LEU 40 3HD2 LEU 40 15.043 -6.876 9.494
152 HD22 LEU 40 1HD2 LEU 40 16.166 -7.689 10.584
153 HD23 LEU 40 2HD2 LEU 40 16.732 -6.372 9.557
154 H ALA 41 H ALA 41 14.652 -2.830 7.831
155 HA ALA 41 HA ALA 41 12.880 -0.811 8.631
156 HB1 ALA 41 1HB ALA 41 13.574 -1.370 5.754
157 HB2 ALA 41 2HB ALA 41 14.838 -0.921 6.898
158 HB3 ALA 41 3HB ALA 41 13.502 0.186 6.582
159 H ARG 42 H ARG 42 12.460 -3.419 6.262
160 HA ARG 42 HA ARG 42 9.673 -2.783 5.814
161 HB2 ARG 42 2HB ARG 42 11.727 -4.668 4.738
162 HB3 ARG 42 1HB ARG 42 10.026 -4.929 4.355
163 HG2 ARG 42 2HG ARG 42 10.697 -2.143 4.014
164 HG3 ARG 42 1HG ARG 42 11.803 -3.150 3.077
165 HD2 ARG 42 2HD ARG 42 10.164 -3.362 1.524
166 HD3 ARG 42 1HD ARG 42 9.229 -4.282 2.722
167 HE ARG 42 HE ARG 42 7.918 -2.351 3.069
168 HH11 ARG 42 1HH1 ARG 42 8.991 -1.402 0.352
169 HH12 ARG 42 2HH1 ARG 42 9.506 0.203 0.753
170 HH21 ARG 42 1HH2 ARG 42 9.442 -0.346 4.177
171 HH22 ARG 42 2HH2 ARG 42 9.756 0.802 2.919
172 H PHE 43 H PHE 43 11.528 -4.849 7.823
173 HA PHE 43 HA PHE 43 10.143 -7.173 8.234
174 HB2 PHE 43 2HB PHE 43 11.709 -5.262 9.794
175 HB3 PHE 43 1HB PHE 43 10.606 -6.198 10.792
176 HD1 PHE 43 2HD PHE 43 12.226 -7.275 7.620
177 HD2 PHE 43 1HD PHE 43 12.110 -7.678 11.895
178 HE1 PHE 43 2HE PHE 43 13.782 -9.201 7.481
179 HE2 PHE 43 1HE PHE 43 13.669 -9.601 11.757
180 HZ PHE 43 HZ PHE 43 14.505 -10.365 9.550
181 H LYS 44 H LYS 44 9.196 -3.982 9.549
182 HA LYS 44 HA LYS 44 6.893 -4.946 10.859
183 HB2 LYS 44 2HB LYS 44 8.069 -2.318 10.115
184 HB3 LYS 44 1HB LYS 44 6.465 -2.382 10.855
185 HG2 LYS 44 2HG LYS 44 8.280 -2.155 12.537
186 HG3 LYS 44 1HG LYS 44 7.342 -3.632 12.739
187 HD2 LYS 44 2HD LYS 44 9.052 -4.957 11.714
188 HD3 LYS 44 1HD LYS 44 9.941 -3.521 11.206
189 HE2 LYS 44 2HE LYS 44 10.549 -2.978 13.463
190 HE3 LYS 44 1HE LYS 44 9.395 -4.153 14.123
191 HZ1 LYS 44 3HZ LYS 44 10.623 -5.893 12.874
192 HZ2 LYS 44 1HZ LYS 44 11.539 -5.173 14.107
193 HZ3 LYS 44 2HZ LYS 44 11.806 -4.735 12.488
194 H GLY 45 H GLY 45 7.191 -5.169 7.741
195 HA2 GLY 45 2HA GLY 45 4.332 -4.757 7.244
196 HA3 GLY 45 1HA GLY 45 5.394 -3.731 6.303
197 H ASP 46 H ASP 46 6.426 -4.580 4.558
198 HA ASP 46 HA ASP 46 5.526 -7.229 3.650
199 HB2 ASP 46 2HB ASP 46 7.271 -5.722 1.849
200 HB3 ASP 46 1HB ASP 46 5.625 -6.296 1.604
201 H GLY 47 H GLY 47 7.154 -7.795 5.590
202 HA2 GLY 47 2HA GLY 47 9.707 -8.580 4.250
203 HA3 GLY 47 1HA GLY 47 9.704 -7.988 5.915
204 H VAL 48 H VAL 48 8.094 -9.130 7.305
205 HA VAL 48 HA VAL 48 8.739 -11.879 7.553
206 HB VAL 48 HB VAL 48 8.278 -10.794 9.555
207 HG11 VAL 48 1HG1 VAL 48 6.289 -9.301 7.928
208 HG12 VAL 48 2HG1 VAL 48 7.459 -8.707 9.098
209 HG13 VAL 48 3HG1 VAL 48 5.968 -9.462 9.652
210 HG21 VAL 48 3HG2 VAL 48 6.298 -11.649 10.482
211 HG22 VAL 48 1HG2 VAL 48 6.733 -12.797 9.215
212 HG23 VAL 48 2HG2 VAL 48 5.466 -11.604 8.927
213 H LYS 49 H LYS 49 5.714 -10.283 6.543
214 HA LYS 49 HA LYS 49 3.894 -12.271 6.452
215 HB2 LYS 49 2HB LYS 49 3.228 -11.055 4.218
216 HB3 LYS 49 1HB LYS 49 3.203 -10.189 5.751
217 HG2 LYS 49 2HG LYS 49 4.876 -8.811 5.126
218 HG3 LYS 49 1HG LYS 49 5.818 -10.124 4.424
219 HD2 LYS 49 2HD LYS 49 5.233 -8.721 2.590
220 HD3 LYS 49 1HD LYS 49 4.133 -10.096 2.493
221 HE2 LYS 49 2HE LYS 49 2.665 -8.471 4.092
222 HE3 LYS 49 1HE LYS 49 3.540 -7.256 3.137
223 HZ1 LYS 49 3HZ LYS 49 1.427 -8.182 2.113
224 HZ2 LYS 49 1HZ LYS 49 2.282 -9.630 1.893
225 HZ3 LYS 49 2HZ LYS 49 2.817 -8.206 1.136
226 H TYR 50 H TYR 50 6.007 -11.729 3.540
227 HA TYR 50 HA TYR 50 5.172 -14.351 2.587
228 HB2 TYR 50 2HB TYR 50 6.444 -13.610 0.615
229 HB3 TYR 50 1HB TYR 50 5.231 -12.445 1.133
230 HD1 TYR 50 2HD TYR 50 8.853 -13.289 1.484
231 HD2 TYR 50 1HD TYR 50 5.822 -10.262 1.565
232 HE1 TYR 50 2HE TYR 50 10.614 -11.540 1.652
233 HE2 TYR 50 1HE TYR 50 7.566 -8.510 1.725
234 HH TYR 50 HH TYR 50 9.816 -8.119 1.438
235 H LYS 51 H LYS 51 8.214 -12.870 3.763
236 HA LYS 51 HA LYS 51 10.023 -14.867 3.080
237 HB2 LYS 51 2HB LYS 51 9.686 -12.843 5.163
238 HB3 LYS 51 1HB LYS 51 10.734 -14.172 5.637
239 HG2 LYS 51 2HG LYS 51 11.129 -13.032 2.915
240 HG3 LYS 51 1HG LYS 51 11.672 -12.062 4.285
241 HD2 LYS 51 2HD LYS 51 13.329 -13.542 4.853
242 HD3 LYS 51 1HD LYS 51 12.390 -14.946 4.343
243 HE2 LYS 51 2HE LYS 51 13.349 -13.009 2.252
244 HE3 LYS 51 1HE LYS 51 14.477 -14.209 2.910
245 HZ1 LYS 51 3HZ LYS 51 11.899 -15.331 2.408
246 HZ2 LYS 51 1HZ LYS 51 13.420 -15.853 1.869
247 HZ3 LYS 51 2HZ LYS 51 12.570 -14.671 0.994
248 H ALA 52 H ALA 52 8.116 -14.730 5.995
249 HA ALA 52 HA ALA 52 8.764 -17.225 7.089
250 HB1 ALA 52 1HB ALA 52 6.238 -16.787 7.937
251 HB2 ALA 52 2HB ALA 52 6.638 -15.191 7.299
252 HB3 ALA 52 3HB ALA 52 7.627 -15.906 8.573
253 H LYS 53 H LYS 53 5.957 -16.312 5.255
254 HA LYS 53 HA LYS 53 4.778 -18.859 4.976
255 HB2 LYS 53 2HB LYS 53 4.667 -16.215 3.550
256 HB3 LYS 53 1HB LYS 53 3.697 -17.571 2.988
257 HG2 LYS 53 2HG LYS 53 3.300 -17.569 5.744
258 HG3 LYS 53 1HG LYS 53 3.298 -15.859 5.312
259 HD2 LYS 53 2HD LYS 53 1.077 -16.355 4.913
260 HD3 LYS 53 1HD LYS 53 1.748 -16.735 3.327
261 HE2 LYS 53 2HE LYS 53 1.610 -19.043 3.671
262 HE3 LYS 53 1HE LYS 53 1.658 -18.880 5.437
263 HZ1 LYS 53 3HZ LYS 53 -0.606 -19.231 4.116
264 HZ2 LYS 53 1HZ LYS 53 -0.523 -17.539 4.042
265 HZ3 LYS 53 2HZ LYS 53 -0.520 -18.323 5.550
266 H LEU 54 H LEU 54 6.735 -17.046 2.523
267 HA LEU 54 HA LEU 54 6.775 -18.905 0.505
268 HB2 LEU 54 2HB LEU 54 8.793 -17.001 1.602
269 HB3 LEU 54 1HB LEU 54 8.948 -17.788 0.021
270 HG LEU 54 HG LEU 54 6.666 -16.066 0.968
271 HD11 LEU 54 1HD1 LEU 54 8.522 -15.743 -1.372
272 HD12 LEU 54 2HD1 LEU 54 8.811 -15.009 0.206
273 HD13 LEU 54 3HD1 LEU 54 7.384 -14.559 -0.730
274 HD21 LEU 54 3HD2 LEU 54 5.538 -17.640 -0.296
275 HD22 LEU 54 1HD2 LEU 54 6.942 -17.989 -1.305
276 HD23 LEU 54 2HD2 LEU 54 6.016 -16.509 -1.563
277 H ILE 55 H ILE 55 8.443 -18.951 3.546
278 HA ILE 55 HA ILE 55 10.384 -20.916 2.982
279 HB ILE 55 HB ILE 55 9.308 -19.154 5.007
280 HG12 ILE 55 2HG1 ILE 55 11.451 -18.580 5.332
281 HG13 ILE 55 1HG1 ILE 55 12.082 -20.203 5.046
282 HG21 ILE 55 1HG2 ILE 55 10.368 -20.468 6.852
283 HG22 ILE 55 2HG2 ILE 55 10.215 -21.855 5.768
284 HG23 ILE 55 3HG2 ILE 55 8.778 -20.965 6.276
285 HD11 ILE 55 3HD1 ILE 55 12.072 -19.914 2.741
286 HD12 ILE 55 1HD1 ILE 55 12.382 -18.254 3.252
287 HD13 ILE 55 2HD1 ILE 55 10.751 -18.747 2.794
288 H GLY 56 H GLY 56 7.415 -20.931 4.908
289 HA2 GLY 56 2HA GLY 56 5.757 -22.728 4.636
290 HA3 GLY 56 1HA GLY 56 7.113 -23.777 4.356
291 H ILE 57 H ILE 57 6.574 -21.400 6.842
292 HA ILE 57 HA ILE 57 7.585 -23.010 8.917
293 HB ILE 57 HB ILE 57 7.023 -20.968 10.164
294 HG12 ILE 57 2HG1 ILE 57 6.248 -19.557 7.684
295 HG13 ILE 57 1HG1 ILE 57 5.028 -20.673 8.298
296 HG21 ILE 57 1HG2 ILE 57 8.884 -21.411 8.184
297 HG22 ILE 57 2HG2 ILE 57 8.900 -20.054 9.312
298 HG23 ILE 57 3HG2 ILE 57 8.170 -19.868 7.715
299 HD11 ILE 57 3HD1 ILE 57 6.249 -18.287 9.682
300 HD12 ILE 57 1HD1 ILE 57 5.447 -19.565 10.595
301 HD13 ILE 57 2HD1 ILE 57 4.544 -18.636 9.397
302 H ASP 58 H ASP 58 5.267 -21.491 10.217
303 HA ASP 58 HA ASP 58 3.743 -23.497 11.324
304 HB2 ASP 58 2HB ASP 58 2.282 -21.737 11.939
305 HB3 ASP 58 1HB ASP 58 3.836 -20.939 11.691