Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
631696 | 6f55 RC | 34211 | cing | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 H1 MET 1 H MET 1 -20.623 8.393 7.771
2 HA MET 1 HA MET 1 -18.566 7.255 5.974
3 HB2 MET 1 HB2 MET 1 -19.029 10.152 6.828
4 HB3 MET 1 HB3 MET 1 -17.567 9.549 6.026
5 HG2 MET 1 HG2 MET 1 -18.833 8.841 4.096
6 HG3 MET 1 HG3 MET 1 -20.349 9.345 4.854
7 HE1 MET 1 HE1 MET 1 -16.767 11.243 4.611
8 HE2 MET 1 HE2 MET 1 -17.066 10.362 3.094
9 HE3 MET 1 HE3 MET 1 -17.096 12.138 3.117
10 H LYS 2 H LYS 2 -17.441 5.942 7.347
11 HA LYS 2 HA LYS 2 -16.436 7.152 9.902
12 HB2 LYS 2 HB2 LYS 2 -17.503 4.373 9.296
13 HB3 LYS 2 HB3 LYS 2 -16.480 4.715 10.687
14 HG2 LYS 2 HG2 LYS 2 -18.081 5.996 11.770
15 HG3 LYS 2 HG3 LYS 2 -18.875 6.503 10.290
16 HD2 LYS 2 HD2 LYS 2 -20.317 5.057 11.581
17 HD3 LYS 2 HD3 LYS 2 -19.951 4.361 9.996
18 HE2 LYS 2 HE2 LYS 2 -18.374 2.786 10.973
19 HE3 LYS 2 HE3 LYS 2 -18.454 3.601 12.540
20 HZ1 LYS 2 HZ1 LYS 2 -20.680 2.877 12.825
21 HZ2 LYS 2 HZ2 LYS 2 -19.783 1.578 12.448
22 HZ3 LYS 2 HZ3 LYS 2 -20.766 2.237 11.300
23 H VAL 3 H VAL 3 -15.720 4.944 7.141
24 HA VAL 3 HA VAL 3 -12.862 5.559 7.596
25 HB VAL 3 HB VAL 3 -13.822 2.732 7.043
26 HG11 VAL 3 HG11 VAL 3 -11.594 3.311 6.103
27 HG12 VAL 3 HG12 VAL 3 -11.087 3.937 7.691
28 HG13 VAL 3 HG13 VAL 3 -11.429 2.209 7.470
29 HG21 VAL 3 HG21 VAL 3 -14.384 3.232 9.371
30 HG22 VAL 3 HG22 VAL 3 -12.960 2.199 9.319
31 HG23 VAL 3 HG23 VAL 3 -12.769 3.930 9.638
32 HA PRO 4 HA PRO 4 -14.246 6.183 3.229
33 HB2 PRO 4 HB2 PRO 4 -12.993 8.559 2.734
34 HB3 PRO 4 HB3 PRO 4 -14.543 8.474 3.627
35 HG2 PRO 4 HG2 PRO 4 -11.739 8.654 4.765
36 HG3 PRO 4 HG3 PRO 4 -13.167 9.644 5.204
37 HD2 PRO 4 HD2 PRO 4 -12.396 7.458 6.653
38 HD3 PRO 4 HD3 PRO 4 -14.122 7.875 6.441
39 H GLY 5 H GLY 5 -12.597 6.445 1.201
40 HA2 GLY 5 HA2 GLY 5 -10.500 4.546 1.595
41 HA3 GLY 5 HA3 GLY 5 -10.815 5.562 0.165
42 H VAL 6 H VAL 6 -8.308 4.894 2.098
43 HA VAL 6 HA VAL 6 -7.540 7.747 2.611
44 HB VAL 6 HB VAL 6 -6.097 5.167 3.295
45 HG11 VAL 6 HG11 VAL 6 -5.653 7.986 4.318
46 HG12 VAL 6 HG12 VAL 6 -4.814 6.530 4.873
47 HG13 VAL 6 HG13 VAL 6 -4.594 7.090 3.213
48 HG21 VAL 6 HG21 VAL 6 -6.919 5.631 5.652
49 HG22 VAL 6 HG22 VAL 6 -8.061 6.786 4.930
50 HG23 VAL 6 HG23 VAL 6 -8.153 5.068 4.515
51 H ARG 7 H ARG 7 -6.654 8.698 0.880
52 HA ARG 7 HA ARG 7 -5.816 7.223 -1.464
53 HB2 ARG 7 HB2 ARG 7 -6.980 9.419 -1.491
54 HB3 ARG 7 HB3 ARG 7 -5.603 10.162 -0.675
55 HG2 ARG 7 HG2 ARG 7 -4.181 9.450 -2.697
56 HG3 ARG 7 HG3 ARG 7 -5.702 8.999 -3.484
57 HD2 ARG 7 HD2 ARG 7 -6.540 11.335 -3.052
58 HD3 ARG 7 HD3 ARG 7 -4.954 11.728 -2.331
59 HE ARG 7 HE ARG 7 -4.716 10.658 -5.008
60 HH11 ARG 7 HH11 ARG 7 -5.803 13.617 -3.389
61 HH12 ARG 7 HH12 ARG 7 -5.490 14.592 -4.815
62 HH21 ARG 7 HH21 ARG 7 -3.930 11.988 -6.627
63 HH22 ARG 7 HH22 ARG 7 -4.094 13.719 -6.513
64 H VAL 8 H VAL 8 -3.866 6.247 -1.686
65 HA VAL 8 HA VAL 8 -1.462 7.718 -0.717
66 HB VAL 8 HB VAL 8 -0.355 5.649 -0.025
67 HG11 VAL 8 HG11 VAL 8 -2.860 6.313 1.541
68 HG12 VAL 8 HG12 VAL 8 -1.506 5.298 2.118
69 HG13 VAL 8 HG13 VAL 8 -1.240 6.977 1.726
70 HG21 VAL 8 HG21 VAL 8 -2.966 4.313 -0.676
71 HG22 VAL 8 HG22 VAL 8 -1.316 3.953 -1.202
72 HG23 VAL 8 HG23 VAL 8 -1.764 3.613 0.463
73 H ARG 9 H ARG 9 0.503 7.070 -1.827
74 HA ARG 9 HA ARG 9 0.019 6.020 -4.559
75 HB2 ARG 9 HB2 ARG 9 0.098 8.430 -4.614
76 HB3 ARG 9 HB3 ARG 9 1.572 8.485 -3.631
77 HG2 ARG 9 HG2 ARG 9 2.883 7.511 -5.442
78 HG3 ARG 9 HG3 ARG 9 1.403 7.127 -6.335
79 HD2 ARG 9 HD2 ARG 9 2.194 9.040 -7.404
80 HD3 ARG 9 HD3 ARG 9 0.898 9.630 -6.362
81 HE ARG 9 HE ARG 9 3.350 9.858 -4.939
82 HH11 ARG 9 HH11 ARG 9 1.727 11.225 -7.808
83 HH12 ARG 9 HH12 ARG 9 2.534 12.761 -7.659
84 HH21 ARG 9 HH21 ARG 9 4.528 11.757 -4.893
85 HH22 ARG 9 HH22 ARG 9 4.231 13.075 -5.962
86 H ALA 10 H ALA 10 1.569 4.610 -5.272
87 HA ALA 10 HA ALA 10 3.464 3.680 -3.220
88 HB1 ALA 10 HB1 ALA 10 3.286 2.683 -6.073
89 HB2 ALA 10 HB2 ALA 10 4.142 1.946 -4.707
90 HB3 ALA 10 HB3 ALA 10 2.378 2.019 -4.676
91 H LEU 11 H LEU 11 5.573 3.867 -3.113
92 HA LEU 11 HA LEU 11 6.882 6.043 -4.566
93 HB2 LEU 11 HB2 LEU 11 7.882 4.069 -2.471
94 HB3 LEU 11 HB3 LEU 11 8.773 5.475 -3.033
95 HG LEU 11 HG LEU 11 6.082 5.621 -1.586
96 HD11 LEU 11 HD11 LEU 11 8.897 6.039 -0.494
97 HD12 LEU 11 HD12 LEU 11 7.817 4.683 -0.130
98 HD13 LEU 11 HD13 LEU 11 7.376 6.311 0.388
99 HD21 LEU 11 HD21 LEU 11 6.546 7.623 -2.987
100 HD22 LEU 11 HD22 LEU 11 8.132 7.786 -2.228
101 HD23 LEU 11 HD23 LEU 11 6.673 8.015 -1.259
102 H TYR 12 H TYR 12 6.520 2.653 -5.074
103 HA TYR 12 HA TYR 12 8.444 2.652 -7.238
104 HB2 TYR 12 HB2 TYR 12 8.729 0.166 -5.682
105 HB3 TYR 12 HB3 TYR 12 9.935 1.131 -6.505
106 HD1 TYR 12 HD1 TYR 12 8.033 0.658 -3.401
107 HD2 TYR 12 HD2 TYR 12 11.361 2.775 -5.181
108 HE1 TYR 12 HE1 TYR 12 8.863 1.324 -1.142
109 HE2 TYR 12 HE2 TYR 12 12.017 3.571 -3.000
110 HH TYR 12 HH TYR 12 10.337 2.766 0.010
111 H ASP 13 H ASP 13 8.227 0.321 -8.254
112 HA ASP 13 HA ASP 13 5.301 -0.230 -8.632
113 HB2 ASP 13 HB2 ASP 13 6.535 0.670 -10.559
114 HB3 ASP 13 HB3 ASP 13 7.733 -0.607 -10.433
115 H TYR 14 H TYR 14 4.743 -1.974 -7.338
116 HA TYR 14 HA TYR 14 6.371 -4.442 -7.422
117 HB2 TYR 14 HB2 TYR 14 5.837 -2.726 -5.060
118 HB3 TYR 14 HB3 TYR 14 5.281 -4.364 -4.832
119 HD1 TYR 14 HD1 TYR 14 6.807 -5.879 -3.832
120 HD2 TYR 14 HD2 TYR 14 8.332 -2.593 -6.194
121 HE1 TYR 14 HE1 TYR 14 9.100 -6.676 -3.451
122 HE2 TYR 14 HE2 TYR 14 10.619 -3.382 -5.811
123 HH TYR 14 HH TYR 14 11.934 -5.119 -5.011
124 H THR 15 H THR 15 5.037 -6.414 -6.977
125 HA THR 15 HA THR 15 2.125 -5.913 -7.256
126 HB THR 15 HB THR 15 3.083 -6.193 -9.442
127 HG1 THR 15 HG1 THR 15 1.804 -8.330 -9.815
128 HG21 THR 15 HG21 THR 15 3.982 -9.010 -8.735
129 HG22 THR 15 HG22 THR 15 5.055 -7.622 -9.013
130 HG23 THR 15 HG23 THR 15 4.013 -8.221 -10.313
131 H GLY 16 H GLY 16 1.964 -6.311 -5.041
132 HA2 GLY 16 HA2 GLY 16 1.534 -7.612 -3.201
133 HA3 GLY 16 HA3 GLY 16 1.067 -8.829 -4.412
134 H GLN 17 H GLN 17 1.745 -10.369 -2.768
135 HA GLN 17 HA GLN 17 4.593 -11.011 -3.030
136 HB2 GLN 17 HB2 GLN 17 4.151 -9.950 -0.758
137 HB3 GLN 17 HB3 GLN 17 3.136 -11.361 -0.398
138 HG2 GLN 17 HG2 GLN 17 5.427 -11.475 0.548
139 HG3 GLN 17 HG3 GLN 17 5.027 -12.839 -0.485
140 HE21 GLN 17 HE21 GLN 17 7.280 -13.331 -0.853
141 HE22 GLN 17 HE22 GLN 17 8.166 -12.374 -2.027
142 H GLU 18 H GLU 18 1.249 -11.932 -3.031
143 HA GLU 18 HA GLU 18 1.886 -14.562 -4.030
144 HB2 GLU 18 HB2 GLU 18 -0.195 -14.136 -1.839
145 HB3 GLU 18 HB3 GLU 18 0.217 -15.632 -2.639
146 HG2 GLU 18 HG2 GLU 18 2.513 -15.515 -1.622
147 HG3 GLU 18 HG3 GLU 18 1.971 -14.108 -0.681
148 H ALA 19 H ALA 19 -0.506 -15.399 -4.725
149 HA ALA 19 HA ALA 19 -1.494 -13.511 -6.637
150 HB1 ALA 19 HB1 ALA 19 -2.705 -16.161 -5.727
151 HB2 ALA 19 HB2 ALA 19 -2.986 -15.335 -7.269
152 HB3 ALA 19 HB3 ALA 19 -1.385 -16.019 -6.908
153 H ASP 20 H ASP 20 -2.242 -13.515 -3.341
154 HA ASP 20 HA ASP 20 -5.118 -12.783 -3.712
155 HB2 ASP 20 HB2 ASP 20 -3.401 -13.650 -1.370
156 HB3 ASP 20 HB3 ASP 20 -4.915 -12.790 -1.104
157 H GLU 21 H GLU 21 -2.163 -11.278 -3.736
158 HA GLU 21 HA GLU 21 -3.017 -8.873 -2.229
159 HB2 GLU 21 HB2 GLU 21 -0.421 -9.971 -3.358
160 HB3 GLU 21 HB3 GLU 21 -0.574 -8.290 -2.829
161 HG2 GLU 21 HG2 GLU 21 0.485 -9.811 -1.209
162 HG3 GLU 21 HG3 GLU 21 -0.860 -8.868 -0.587
163 H LEU 22 H LEU 22 -2.718 -6.841 -3.216
164 HA LEU 22 HA LEU 22 -3.803 -6.524 -5.888
165 HB2 LEU 22 HB2 LEU 22 -2.689 -4.620 -3.775
166 HB3 LEU 22 HB3 LEU 22 -3.400 -4.045 -5.270
167 HG LEU 22 HG LEU 22 -5.105 -5.834 -3.596
168 HD11 LEU 22 HD11 LEU 22 -5.825 -3.851 -2.239
169 HD12 LEU 22 HD12 LEU 22 -4.458 -2.954 -2.904
170 HD13 LEU 22 HD13 LEU 22 -4.170 -4.367 -1.891
171 HD21 LEU 22 HD21 LEU 22 -5.722 -3.244 -5.054
172 HD22 LEU 22 HD22 LEU 22 -6.891 -4.378 -4.374
173 HD23 LEU 22 HD23 LEU 22 -5.897 -4.857 -5.762
174 H SER 23 H SER 23 -2.810 -5.117 -7.464
175 HA SER 23 HA SER 23 0.176 -5.078 -7.416
176 HB2 SER 23 HB2 SER 23 -0.999 -6.683 -9.038
177 HB3 SER 23 HB3 SER 23 -1.672 -5.250 -9.839
178 HG SER 23 HG SER 23 0.850 -6.326 -9.746
179 H PHE 24 H PHE 24 1.037 -2.982 -7.586
180 HA PHE 24 HA PHE 24 -0.761 -0.900 -8.748
181 HB2 PHE 24 HB2 PHE 24 -0.015 0.692 -7.104
182 HB3 PHE 24 HB3 PHE 24 -0.987 -0.590 -6.433
183 HD1 PHE 24 HD1 PHE 24 2.720 -0.011 -7.030
184 HD2 PHE 24 HD2 PHE 24 -0.387 -1.116 -4.250
185 HE1 PHE 24 HE1 PHE 24 4.429 -0.496 -5.307
186 HE2 PHE 24 HE2 PHE 24 1.316 -1.419 -2.487
187 HZ PHE 24 HZ PHE 24 3.734 -1.185 -3.030
188 H LYS 25 H LYS 25 0.591 1.045 -9.400
189 HA LYS 25 HA LYS 25 3.182 0.122 -10.583
190 HB2 LYS 25 HB2 LYS 25 0.859 1.696 -11.714
191 HB3 LYS 25 HB3 LYS 25 2.476 2.158 -12.189
192 HG2 LYS 25 HG2 LYS 25 1.597 0.691 -13.837
193 HG3 LYS 25 HG3 LYS 25 2.906 -0.143 -12.996
194 HD2 LYS 25 HD2 LYS 25 1.291 -1.437 -11.706
195 HD3 LYS 25 HD3 LYS 25 -0.074 -0.564 -12.432
196 HE2 LYS 25 HE2 LYS 25 0.288 -1.532 -14.565
197 HE3 LYS 25 HE3 LYS 25 1.952 -1.996 -14.173
198 HZ1 LYS 25 HZ1 LYS 25 1.066 -3.634 -12.633
199 HZ2 LYS 25 HZ2 LYS 25 0.501 -3.899 -14.174
200 HZ3 LYS 25 HZ3 LYS 25 -0.477 -3.233 -13.053
201 H ALA 26 H ALA 26 4.774 1.924 -10.836
202 HA ALA 26 HA ALA 26 5.070 3.337 -8.346
203 HB1 ALA 26 HB1 ALA 26 6.950 4.477 -9.524
204 HB2 ALA 26 HB2 ALA 26 7.057 2.720 -9.638
205 HB3 ALA 26 HB3 ALA 26 6.493 3.666 -11.035
206 H GLY 27 H GLY 27 3.915 5.111 -7.762
207 HA2 GLY 27 HA2 GLY 27 3.199 7.305 -7.999
208 HA3 GLY 27 HA3 GLY 27 3.312 7.221 -9.747
209 H GLU 28 H GLU 28 1.702 4.418 -9.027
210 HA GLU 28 HA GLU 28 -0.846 5.411 -9.917
211 HB2 GLU 28 HB2 GLU 28 0.021 3.114 -10.342
212 HB3 GLU 28 HB3 GLU 28 -0.005 2.740 -8.656
213 HG2 GLU 28 HG2 GLU 28 -1.818 1.630 -9.589
214 HG3 GLU 28 HG3 GLU 28 -2.512 2.938 -8.652
215 H GLU 29 H GLU 29 -2.858 5.318 -8.575
216 HA GLU 29 HA GLU 29 -2.344 5.938 -5.704
217 HB2 GLU 29 HB2 GLU 29 -4.357 7.009 -7.697
218 HB3 GLU 29 HB3 GLU 29 -4.594 7.131 -5.945
219 HG2 GLU 29 HG2 GLU 29 -2.503 8.354 -5.676
220 HG3 GLU 29 HG3 GLU 29 -2.125 8.195 -7.391
221 H LEU 30 H LEU 30 -3.434 4.844 -4.183
222 HA LEU 30 HA LEU 30 -5.640 2.994 -4.983
223 HB2 LEU 30 HB2 LEU 30 -4.665 1.448 -3.205
224 HB3 LEU 30 HB3 LEU 30 -3.863 1.464 -4.787
225 HG LEU 30 HG LEU 30 -2.775 3.320 -2.727
226 HD11 LEU 30 HD11 LEU 30 -3.206 1.385 -1.301
227 HD12 LEU 30 HD12 LEU 30 -1.469 1.568 -1.586
228 HD13 LEU 30 HD13 LEU 30 -2.363 0.324 -2.464
229 HD21 LEU 30 HD21 LEU 30 -0.614 2.621 -3.638
230 HD22 LEU 30 HD22 LEU 30 -1.696 3.050 -4.957
231 HD23 LEU 30 HD23 LEU 30 -1.391 1.347 -4.589
232 H MET 31 H MET 31 -7.061 2.420 -3.152
233 HA MET 31 HA MET 31 -7.080 4.534 -1.075
234 HB2 MET 31 HB2 MET 31 -9.549 3.049 -1.973
235 HB3 MET 31 HB3 MET 31 -9.341 4.489 -0.995
236 HG2 MET 31 HG2 MET 31 -8.206 5.197 -3.427
237 HG3 MET 31 HG3 MET 31 -9.582 4.195 -3.889
238 HE1 MET 31 HE1 MET 31 -8.314 7.594 -2.910
239 HE2 MET 31 HE2 MET 31 -9.532 8.286 -1.814
240 HE3 MET 31 HE3 MET 31 -8.526 6.922 -1.276
241 H LYS 32 H LYS 32 -6.352 3.610 0.833
242 HA LYS 32 HA LYS 32 -6.608 0.752 1.302
243 HB2 LYS 32 HB2 LYS 32 -4.889 1.909 2.340
244 HB3 LYS 32 HB3 LYS 32 -5.979 3.113 3.063
245 HG2 LYS 32 HG2 LYS 32 -6.987 1.355 4.487
246 HG3 LYS 32 HG3 LYS 32 -5.824 0.206 3.799
247 HD2 LYS 32 HD2 LYS 32 -4.785 0.879 5.837
248 HD3 LYS 32 HD3 LYS 32 -3.965 1.808 4.594
249 HE2 LYS 32 HE2 LYS 32 -5.769 3.651 5.099
250 HE3 LYS 32 HE3 LYS 32 -6.104 2.704 6.558
251 HZ1 LYS 32 HZ1 LYS 32 -4.429 4.345 7.105
252 HZ2 LYS 32 HZ2 LYS 32 -3.563 3.986 5.754
253 HZ3 LYS 32 HZ3 LYS 32 -3.626 2.927 6.983
254 H ILE 33 H ILE 33 -8.158 -0.340 2.587
255 HA ILE 33 HA ILE 33 -10.476 1.309 3.424
256 HB ILE 33 HB ILE 33 -11.954 -0.380 2.656
257 HG12 ILE 33 HG12 ILE 33 -10.388 -1.960 0.844
258 HG13 ILE 33 HG13 ILE 33 -9.606 -2.069 2.406
259 HG21 ILE 33 HG21 ILE 33 -11.875 0.030 0.278
260 HG22 ILE 33 HG22 ILE 33 -11.281 1.479 1.095
261 HG23 ILE 33 HG23 ILE 33 -10.143 0.378 0.322
262 HD11 ILE 33 HD11 ILE 33 -11.153 -3.873 2.186
263 HD12 ILE 33 HD12 ILE 33 -11.783 -2.759 3.423
264 HD13 ILE 33 HD13 ILE 33 -12.485 -2.765 1.786
265 H SER 34 H SER 34 -8.189 -1.186 4.292
266 HA SER 34 HA SER 34 -9.606 -1.536 6.872
267 HB2 SER 34 HB2 SER 34 -7.953 -3.613 5.452
268 HB3 SER 34 HB3 SER 34 -8.916 -3.792 6.935
269 HG SER 34 HG SER 34 -10.787 -3.426 5.744
270 H GLU 35 H GLU 35 -7.638 -2.573 8.425
271 HA GLU 35 HA GLU 35 -5.735 -0.302 8.520
272 HB2 GLU 35 HB2 GLU 35 -5.405 -1.052 10.845
273 HB3 GLU 35 HB3 GLU 35 -7.082 -0.670 10.464
274 HG2 GLU 35 HG2 GLU 35 -7.645 -3.053 10.281
275 HG3 GLU 35 HG3 GLU 35 -5.944 -3.510 10.445
276 H GLU 36 H GLU 36 -3.619 -0.804 9.540
277 HA GLU 36 HA GLU 36 -2.150 -2.580 7.845
278 HB2 GLU 36 HB2 GLU 36 -1.548 -0.271 8.636
279 HB3 GLU 36 HB3 GLU 36 -1.203 -0.950 10.230
280 HG2 GLU 36 HG2 GLU 36 0.579 -2.314 9.313
281 HG3 GLU 36 HG3 GLU 36 0.109 -1.935 7.653
282 H ASP 37 H ASP 37 -0.886 -4.274 8.483
283 HA ASP 37 HA ASP 37 -1.698 -5.836 10.894
284 HB2 ASP 37 HB2 ASP 37 -0.248 -6.562 8.332
285 HB3 ASP 37 HB3 ASP 37 -0.551 -7.703 9.630
286 H GLU 38 H GLU 38 0.154 -7.207 11.747
287 HA GLU 38 HA GLU 38 2.258 -5.625 12.697
288 HB2 GLU 38 HB2 GLU 38 1.130 -7.785 13.531
289 HB3 GLU 38 HB3 GLU 38 2.288 -8.653 12.526
290 HG2 GLU 38 HG2 GLU 38 4.103 -8.007 13.868
291 HG3 GLU 38 HG3 GLU 38 3.270 -6.583 14.509
292 H GLN 39 H GLN 39 2.042 -7.383 9.724
293 HA GLN 39 HA GLN 39 4.945 -7.319 9.127
294 HB2 GLN 39 HB2 GLN 39 2.703 -8.967 8.421
295 HB3 GLN 39 HB3 GLN 39 3.243 -8.225 6.939
296 HG2 GLN 39 HG2 GLN 39 4.350 -10.348 7.181
297 HG3 GLN 39 HG3 GLN 39 5.546 -9.090 7.332
298 HE21 GLN 39 HE21 GLN 39 7.114 -9.904 8.818
299 HE22 GLN 39 HE22 GLN 39 6.669 -10.552 10.375
300 H GLY 40 H GLY 40 2.710 -4.925 9.130
301 HA2 GLY 40 HA2 GLY 40 2.608 -2.931 8.071
302 HA3 GLY 40 HA3 GLY 40 4.050 -3.349 7.144
303 H TRP 41 H TRP 41 1.155 -5.390 7.157
304 HA TRP 41 HA TRP 41 0.809 -5.068 4.241
305 HB2 TRP 41 HB2 TRP 41 0.141 -7.069 6.386
306 HB3 TRP 41 HB3 TRP 41 -1.072 -6.864 5.166
307 HD1 TRP 41 HD1 TRP 41 1.295 -9.208 5.910
308 HE1 TRP 41 HE1 TRP 41 2.135 -10.471 3.885
309 HE3 TRP 41 HE3 TRP 41 -0.113 -5.890 2.332
310 HZ2 TRP 41 HZ2 TRP 41 2.520 -9.896 1.054
311 HZ3 TRP 41 HZ3 TRP 41 0.502 -6.288 -0.040
312 HH2 TRP 41 HH2 TRP 41 1.872 -8.150 -0.688
313 H CYS 42 H CYS 42 -1.085 -4.017 3.397
314 HA CYS 42 HA CYS 42 -3.156 -3.202 5.384
315 HB2 CYS 42 HB2 CYS 42 -1.610 -1.463 3.448
316 HB3 CYS 42 HB3 CYS 42 -3.309 -1.109 3.799
317 HG CYS 42 HG CYS 42 -3.079 -1.059 6.417
318 H LYS 43 H LYS 43 -5.206 -3.454 4.621
319 HA LYS 43 HA LYS 43 -5.471 -4.652 1.925
320 HB2 LYS 43 HB2 LYS 43 -6.623 -5.187 4.512
321 HB3 LYS 43 HB3 LYS 43 -7.926 -4.701 3.441
322 HG2 LYS 43 HG2 LYS 43 -6.034 -6.665 2.204
323 HG3 LYS 43 HG3 LYS 43 -6.811 -7.242 3.682
324 HD2 LYS 43 HD2 LYS 43 -9.018 -6.733 2.741
325 HD3 LYS 43 HD3 LYS 43 -8.278 -6.020 1.313
326 HE2 LYS 43 HE2 LYS 43 -9.068 -8.299 0.845
327 HE3 LYS 43 HE3 LYS 43 -7.316 -8.195 0.690
328 HZ1 LYS 43 HZ1 LYS 43 -8.460 -9.105 3.237
329 HZ2 LYS 43 HZ2 LYS 43 -7.036 -9.569 2.503
330 HZ3 LYS 43 HZ3 LYS 43 -8.469 -10.129 1.979
331 H GLY 44 H GLY 44 -6.504 -3.630 0.280
332 HA2 GLY 44 HA2 GLY 44 -8.176 -1.293 0.827
333 HA3 GLY 44 HA3 GLY 44 -6.641 -0.925 0.068
334 H ARG 45 H ARG 45 -8.257 -0.067 -1.476
335 HA ARG 45 HA ARG 45 -8.936 -2.079 -3.497
336 HB2 ARG 45 HB2 ARG 45 -10.681 0.171 -2.427
337 HB3 ARG 45 HB3 ARG 45 -10.928 -0.510 -4.047
338 HG2 ARG 45 HG2 ARG 45 -11.198 -2.731 -3.157
339 HG3 ARG 45 HG3 ARG 45 -10.912 -2.140 -1.495
340 HD2 ARG 45 HD2 ARG 45 -12.883 -0.606 -1.828
341 HD3 ARG 45 HD3 ARG 45 -13.258 -1.509 -3.302
342 HE ARG 45 HE ARG 45 -13.224 -3.559 -1.754
343 HH11 ARG 45 HH11 ARG 45 -14.395 -0.375 -0.662
344 HH12 ARG 45 HH12 ARG 45 -15.328 -1.020 0.638
345 HH21 ARG 45 HH21 ARG 45 -14.386 -4.397 -0.001
346 HH22 ARG 45 HH22 ARG 45 -15.336 -3.363 1.022
347 H LEU 46 H LEU 46 -8.332 -1.611 -5.440
348 HA LEU 46 HA LEU 46 -6.776 0.869 -5.966
349 HB2 LEU 46 HB2 LEU 46 -7.624 -1.543 -7.603
350 HB3 LEU 46 HB3 LEU 46 -6.946 -0.137 -8.417
351 HG LEU 46 HG LEU 46 -5.439 -1.333 -6.101
352 HD11 LEU 46 HD11 LEU 46 -5.492 -2.305 -8.973
353 HD12 LEU 46 HD12 LEU 46 -6.012 -3.215 -7.554
354 HD13 LEU 46 HD13 LEU 46 -4.309 -2.825 -7.740
355 HD21 LEU 46 HD21 LEU 46 -4.565 0.094 -8.656
356 HD22 LEU 46 HD22 LEU 46 -3.493 -0.472 -7.374
357 HD23 LEU 46 HD23 LEU 46 -4.651 0.835 -7.046
358 H LEU 47 H LEU 47 -7.432 2.299 -7.846
359 HA LEU 47 HA LEU 47 -10.101 3.243 -7.557
360 HB2 LEU 47 HB2 LEU 47 -9.606 4.670 -9.488
361 HB3 LEU 47 HB3 LEU 47 -8.361 4.729 -8.270
362 HG LEU 47 HG LEU 47 -7.689 2.613 -10.148
363 HD11 LEU 47 HD11 LEU 47 -7.390 3.918 -12.207
364 HD12 LEU 47 HD12 LEU 47 -8.196 5.311 -11.449
365 HD13 LEU 47 HD13 LEU 47 -9.099 3.797 -11.765
366 HD21 LEU 47 HD21 LEU 47 -5.676 4.081 -10.506
367 HD22 LEU 47 HD22 LEU 47 -6.023 3.534 -8.872
368 HD23 LEU 47 HD23 LEU 47 -6.399 5.211 -9.333
369 H THR 48 H THR 48 -8.927 0.602 -9.453
370 HA THR 48 HA THR 48 -11.133 0.647 -11.363
371 HB THR 48 HB THR 48 -8.759 -0.013 -11.903
372 HG1 THR 48 HG1 THR 48 -9.409 -1.699 -13.255
373 HG21 THR 48 HG21 THR 48 -8.218 -1.400 -9.959
374 HG22 THR 48 HG22 THR 48 -8.104 -2.358 -11.434
375 HG23 THR 48 HG23 THR 48 -9.509 -2.550 -10.389
376 H GLY 49 H GLY 49 -10.965 -0.097 -8.128
377 HA2 GLY 49 HA2 GLY 49 -12.609 -0.987 -6.807
378 HA3 GLY 49 HA3 GLY 49 -13.342 -1.801 -8.189
379 H HIS 50 H HIS 50 -10.061 -2.542 -8.316
380 HA HIS 50 HA HIS 50 -10.464 -5.272 -7.555
381 HB2 HIS 50 HB2 HIS 50 -8.244 -3.688 -8.675
382 HB3 HIS 50 HB3 HIS 50 -7.698 -4.854 -7.477
383 HD1 HIS 50 HD1 HIS 50 -8.076 -7.461 -8.021
384 HD2 HIS 50 HD2 HIS 50 -9.469 -4.706 -10.892
385 HE1 HIS 50 HE1 HIS 50 -8.997 -8.834 -9.962
386 H VAL 51 H VAL 51 -9.915 -6.394 -5.709
387 HA VAL 51 HA VAL 51 -9.311 -4.772 -3.292
388 HB VAL 51 HB VAL 51 -10.549 -6.613 -2.115
389 HG11 VAL 51 HG11 VAL 51 -11.792 -4.653 -2.392
390 HG12 VAL 51 HG12 VAL 51 -12.110 -4.959 -4.117
391 HG13 VAL 51 HG13 VAL 51 -12.875 -5.953 -2.857
392 HG21 VAL 51 HG21 VAL 51 -10.395 -8.410 -3.796
393 HG22 VAL 51 HG22 VAL 51 -12.033 -8.098 -3.291
394 HG23 VAL 51 HG23 VAL 51 -11.495 -7.499 -4.866
395 H GLY 52 H GLY 52 -7.920 -5.712 -1.695
396 HA2 GLY 52 HA2 GLY 52 -6.932 -8.202 -1.438
397 HA3 GLY 52 HA3 GLY 52 -5.929 -7.595 -2.744
398 H LEU 53 H LEU 53 -4.263 -7.991 -1.077
399 HA LEU 53 HA LEU 53 -3.949 -5.924 1.038
400 HB2 LEU 53 HB2 LEU 53 -2.895 -8.677 0.443
401 HB3 LEU 53 HB3 LEU 53 -1.804 -7.589 1.249
402 HG LEU 53 HG LEU 53 -4.510 -8.442 2.307
403 HD11 LEU 53 HD11 LEU 53 -2.642 -10.175 2.263
404 HD12 LEU 53 HD12 LEU 53 -3.302 -9.804 3.847
405 HD13 LEU 53 HD13 LEU 53 -1.713 -9.134 3.344
406 HD21 LEU 53 HD21 LEU 53 -2.350 -6.626 3.438
407 HD22 LEU 53 HD22 LEU 53 -3.593 -7.403 4.460
408 HD23 LEU 53 HD23 LEU 53 -4.059 -6.266 3.211
409 H TYR 54 H TYR 54 -2.049 -4.542 0.937
410 HA TYR 54 HA TYR 54 -0.349 -4.705 -1.455
411 HB2 TYR 54 HB2 TYR 54 -0.522 -2.420 -1.971
412 HB3 TYR 54 HB3 TYR 54 -2.139 -3.019 -1.980
413 HD1 TYR 54 HD1 TYR 54 -3.760 -2.280 -0.170
414 HD2 TYR 54 HD2 TYR 54 0.334 -0.882 -0.270
415 HE1 TYR 54 HE1 TYR 54 -4.317 -0.468 1.449
416 HE2 TYR 54 HE2 TYR 54 -0.223 0.832 1.404
417 HH TYR 54 HH TYR 54 -1.760 1.690 2.840
418 HA PRO 55 HA PRO 55 2.418 -4.175 1.934
419 HB2 PRO 55 HB2 PRO 55 4.745 -3.430 0.754
420 HB3 PRO 55 HB3 PRO 55 4.039 -5.065 0.615
421 HG2 PRO 55 HG2 PRO 55 3.910 -2.796 -1.376
422 HG3 PRO 55 HG3 PRO 55 4.271 -4.516 -1.685
423 HD2 PRO 55 HD2 PRO 55 1.748 -3.528 -2.084
424 HD3 PRO 55 HD3 PRO 55 2.066 -5.157 -1.454
425 H ALA 56 H ALA 56 1.705 -2.532 3.257
426 HA ALA 56 HA ALA 56 1.321 0.142 2.551
427 HB1 ALA 56 HB1 ALA 56 0.484 -1.114 4.620
428 HB2 ALA 56 HB2 ALA 56 2.061 -0.786 5.345
429 HB3 ALA 56 HB3 ALA 56 1.018 0.563 4.878
430 H ASN 57 H ASN 57 4.148 -1.476 3.799
431 HA ASN 57 HA ASN 57 5.782 0.737 4.360
432 HB2 ASN 57 HB2 ASN 57 6.854 -1.879 3.250
433 HB3 ASN 57 HB3 ASN 57 7.632 -0.746 4.344
434 HD21 ASN 57 HD21 ASN 57 6.351 -3.792 4.329
435 HD22 ASN 57 HD22 ASN 57 5.796 -3.812 6.007
436 H TYR 58 H TYR 58 4.713 -0.197 1.194
437 HA TYR 58 HA TYR 58 7.088 1.026 -0.109
438 HB2 TYR 58 HB2 TYR 58 4.935 -0.870 -1.073
439 HB3 TYR 58 HB3 TYR 58 6.034 -0.066 -2.161
440 HD1 TYR 58 HD1 TYR 58 6.462 -2.088 1.042
441 HD2 TYR 58 HD2 TYR 58 7.614 -1.530 -3.078
442 HE1 TYR 58 HE1 TYR 58 8.156 -3.850 1.281
443 HE2 TYR 58 HE2 TYR 58 9.304 -3.257 -2.825
444 HH TYR 58 HH TYR 58 10.003 -5.015 0.204
445 H VAL 59 H VAL 59 4.176 2.114 1.063
446 HA VAL 59 HA VAL 59 3.971 4.093 -1.139
447 HB VAL 59 HB VAL 59 1.655 3.870 -1.353
448 HG11 VAL 59 HG11 VAL 59 2.355 0.946 -0.880
449 HG12 VAL 59 HG12 VAL 59 1.163 1.628 -2.004
450 HG13 VAL 59 HG13 VAL 59 2.886 1.826 -2.308
451 HG21 VAL 59 HG21 VAL 59 1.589 2.153 1.133
452 HG22 VAL 59 HG22 VAL 59 0.942 3.801 0.966
453 HG23 VAL 59 HG23 VAL 59 0.212 2.487 0.049
454 H GLU 60 H GLU 60 2.510 6.027 -0.444
455 HA GLU 60 HA GLU 60 2.442 6.591 2.374
456 HB2 GLU 60 HB2 GLU 60 4.781 7.398 0.886
457 HB3 GLU 60 HB3 GLU 60 3.842 8.852 1.210
458 HG2 GLU 60 HG2 GLU 60 4.498 6.778 3.343
459 HG3 GLU 60 HG3 GLU 60 5.560 8.128 2.964
460 H LYS 61 H LYS 61 1.443 8.803 2.694
461 HA LYS 61 HA LYS 61 -0.908 8.950 1.026
462 HB2 LYS 61 HB2 LYS 61 0.161 10.647 3.311
463 HB3 LYS 61 HB3 LYS 61 -1.263 11.151 2.371
464 HG2 LYS 61 HG2 LYS 61 -2.363 9.036 2.786
465 HG3 LYS 61 HG3 LYS 61 -0.977 8.469 3.740
466 HD2 LYS 61 HD2 LYS 61 -2.624 9.133 5.295
467 HD3 LYS 61 HD3 LYS 61 -1.393 10.408 5.339
468 HE2 LYS 61 HE2 LYS 61 -2.826 11.827 3.881
469 HE3 LYS 61 HE3 LYS 61 -3.984 10.497 3.729
470 HZ1 LYS 61 HZ1 LYS 61 -3.424 12.036 6.181
471 HZ2 LYS 61 HZ2 LYS 61 -4.312 10.644 6.149
472 HZ3 LYS 61 HZ3 LYS 61 -4.838 11.937 5.334
473 H VAL 62 H VAL 62 -1.719 10.699 -0.063
474 HA VAL 62 HA VAL 62 0.153 12.660 -1.039
475 HB VAL 62 HB VAL 62 0.403 10.650 -2.455
476 HG11 VAL 62 HG11 VAL 62 -1.296 10.051 -4.144
477 HG12 VAL 62 HG12 VAL 62 -1.803 9.685 -2.483
478 HG13 VAL 62 HG13 VAL 62 -2.451 11.099 -3.352
479 HG21 VAL 62 HG21 VAL 62 0.366 11.797 -4.615
480 HG22 VAL 62 HG22 VAL 62 -0.714 13.044 -3.959
481 HG23 VAL 62 HG23 VAL 62 0.944 12.877 -3.339
482 H GLY 63 H GLY 63 -1.596 13.000 0.835
483 HA2 GLY 63 HA2 GLY 63 -4.185 13.953 -0.244
484 HA3 GLY 63 HA3 GLY 63 -3.778 13.653 1.440
485 H LEU 64 H LEU 64 -2.162 15.170 2.485
486 HA LEU 64 HA LEU 64 -2.067 17.878 1.297
487 HB2 LEU 64 HB2 LEU 64 -3.042 16.960 4.018
488 HB3 LEU 64 HB3 LEU 64 -2.667 18.650 3.665
489 HG LEU 64 HG LEU 64 -4.841 17.044 2.237
490 HD11 LEU 64 HD11 LEU 64 -4.973 19.039 4.512
491 HD12 LEU 64 HD12 LEU 64 -5.437 17.326 4.559
492 HD13 LEU 64 HD13 LEU 64 -6.388 18.465 3.598
493 HD21 LEU 64 HD21 LEU 64 -5.623 19.219 1.422
494 HD22 LEU 64 HD22 LEU 64 -3.967 18.932 0.879
495 HD23 LEU 64 HD23 LEU 64 -4.266 20.032 2.226
496 H ALA 65 H ALA 65 -0.615 19.209 2.996
497 HA ALA 65 HA ALA 65 1.972 17.950 2.947
498 HB1 ALA 65 HB1 ALA 65 1.553 20.425 2.839
499 HB2 ALA 65 HB2 ALA 65 1.040 20.387 4.542
500 HB3 ALA 65 HB3 ALA 65 2.710 19.978 4.093
501 H ALA 66 H ALA 66 3.324 17.720 5.077
502 HA ALA 66 HA ALA 66 1.989 15.817 6.771
503 HB1 ALA 66 HB1 ALA 66 4.684 17.193 7.112
504 HB2 ALA 66 HB2 ALA 66 4.104 15.801 8.040
505 HB3 ALA 66 HB3 ALA 66 4.381 15.640 6.298
506 H ALA 67 H ALA 67 2.213 19.169 6.807
507 HA ALA 67 HA ALA 67 0.622 20.524 7.898
508 HB1 ALA 67 HB1 ALA 67 1.562 19.288 10.502
509 HB2 ALA 67 HB2 ALA 67 0.338 20.541 10.306
510 HB3 ALA 67 HB3 ALA 67 -0.001 18.895 9.735
511 H1 THR 101 H THR 101 -0.946 -12.895 10.931
512 HA THR 101 HA THR 101 -1.595 -11.160 9.424
513 HB THR 101 HB THR 101 0.735 -10.179 9.460
514 HG1 THR 101 HG1 THR 101 -0.968 -9.524 8.003
515 HG21 THR 101 HG21 THR 101 2.228 -10.873 7.511
516 HG22 THR 101 HG22 THR 101 1.242 -12.292 7.294
517 HG23 THR 101 HG23 THR 101 2.134 -12.067 8.809
518 H LYS 102 H LYS 102 -1.687 -11.475 6.785
519 HA LYS 102 HA LYS 102 -2.661 -14.155 6.430
520 HB2 LYS 102 HB2 LYS 102 -2.866 -11.706 4.972
521 HB3 LYS 102 HB3 LYS 102 -2.133 -12.867 3.871
522 HG2 LYS 102 HG2 LYS 102 -4.505 -13.036 3.602
523 HG3 LYS 102 HG3 LYS 102 -3.970 -14.494 4.444
524 HD2 LYS 102 HD2 LYS 102 -4.707 -13.428 6.602
525 HD3 LYS 102 HD3 LYS 102 -5.257 -12.010 5.690
526 HE2 LYS 102 HE2 LYS 102 -6.914 -13.233 4.543
527 HE3 LYS 102 HE3 LYS 102 -6.200 -14.799 4.951
528 HZ1 LYS 102 HZ1 LYS 102 -7.399 -12.977 6.936
529 HZ2 LYS 102 HZ2 LYS 102 -6.854 -14.514 7.199
530 HZ3 LYS 102 HZ3 LYS 102 -8.187 -14.246 6.243
531 H GLY 103 H GLY 103 0.089 -12.547 4.715
532 HA2 GLY 103 HA2 GLY 103 1.647 -15.037 4.962
533 HA3 GLY 103 HA3 GLY 103 1.410 -14.267 3.382
534 HA PRO 104 HA PRO 104 4.950 -12.319 5.955
535 HB2 PRO 104 HB2 PRO 104 7.170 -13.523 4.898
536 HB3 PRO 104 HB3 PRO 104 6.265 -14.164 6.299
537 HG2 PRO 104 HG2 PRO 104 6.058 -14.980 3.398
538 HG3 PRO 104 HG3 PRO 104 6.176 -16.047 4.835
539 HD2 PRO 104 HD2 PRO 104 3.786 -15.473 3.647
540 HD3 PRO 104 HD3 PRO 104 3.927 -15.658 5.421
541 H ALA 105 H ALA 105 4.630 -10.470 5.023
542 HA ALA 105 HA ALA 105 4.425 -9.588 2.461
543 HB1 ALA 105 HB1 ALA 105 5.513 -7.420 3.835
544 HB2 ALA 105 HB2 ALA 105 3.833 -7.943 3.965
545 HB3 ALA 105 HB3 ALA 105 5.036 -8.444 5.156
546 HA PRO 106 HA PRO 106 8.397 -9.121 0.561
547 HB2 PRO 106 HB2 PRO 106 8.278 -6.656 -0.668
548 HB3 PRO 106 HB3 PRO 106 7.345 -8.109 -1.100
549 HG2 PRO 106 HG2 PRO 106 6.415 -5.735 0.413
550 HG3 PRO 106 HG3 PRO 106 5.583 -6.605 -0.908
551 HD2 PRO 106 HD2 PRO 106 5.084 -7.038 1.769
552 HD3 PRO 106 HD3 PRO 106 4.851 -8.273 0.529
553 H ASN 107 H ASN 107 7.443 -7.228 2.890
554 HA ASN 107 HA ASN 107 9.193 -5.145 3.487
555 HB2 ASN 107 HB2 ASN 107 8.392 -5.122 5.711
556 HB3 ASN 107 HB3 ASN 107 7.073 -5.834 4.793
557 HD21 ASN 107 HD21 ASN 107 9.100 -6.316 7.607
558 HD22 ASN 107 HD22 ASN 107 8.720 -8.005 7.759
559 HA PRO 108 HA PRO 108 10.409 -4.269 5.683
560 HB2 PRO 108 HB2 PRO 108 12.983 -3.264 5.664
561 HB3 PRO 108 HB3 PRO 108 12.290 -4.251 6.989
562 HG2 PRO 108 HG2 PRO 108 14.051 -5.114 4.693
563 HG3 PRO 108 HG3 PRO 108 14.207 -5.540 6.424
564 HD2 PRO 108 HD2 PRO 108 13.027 -7.226 4.642
565 HD3 PRO 108 HD3 PRO 108 12.393 -7.052 6.305
566 HA PRO 109 HA PRO 109 10.199 -2.095 1.870
567 HB2 PRO 109 HB2 PRO 109 10.982 0.517 2.363
568 HB3 PRO 109 HB3 PRO 109 9.414 -0.204 2.820
569 HG2 PRO 109 HG2 PRO 109 11.867 0.152 4.542
570 HG3 PRO 109 HG3 PRO 109 10.145 0.487 4.953
571 HD2 PRO 109 HD2 PRO 109 11.397 -1.777 5.742
572 HD3 PRO 109 HD3 PRO 109 9.681 -1.792 5.259
573 HA PRO 110 HA PRO 110 14.134 -2.280 -0.028
574 HB2 PRO 110 HB2 PRO 110 13.810 -0.988 -2.414
575 HB3 PRO 110 HB3 PRO 110 12.977 -2.507 -1.989
576 HG2 PRO 110 HG2 PRO 110 11.939 0.308 -1.870
577 HG3 PRO 110 HG3 PRO 110 11.112 -1.145 -2.502
578 HD2 PRO 110 HD2 PRO 110 10.700 -0.130 0.043
579 HD3 PRO 110 HD3 PRO 110 10.539 -1.859 -0.355
580 H ILE 111 H ILE 111 13.136 1.202 -0.593
581 HA ILE 111 HA ILE 111 15.640 2.062 0.684
582 HB ILE 111 HB ILE 111 16.197 3.499 -1.228
583 HG12 ILE 111 HG12 ILE 111 14.059 2.020 -2.903
584 HG13 ILE 111 HG13 ILE 111 13.942 3.630 -2.242
585 HG21 ILE 111 HG21 ILE 111 17.233 1.240 -0.940
586 HG22 ILE 111 HG22 ILE 111 16.098 0.612 -2.152
587 HG23 ILE 111 HG23 ILE 111 17.266 1.860 -2.598
588 HD11 ILE 111 HD11 ILE 111 16.019 2.740 -4.269
589 HD12 ILE 111 HD12 ILE 111 14.604 3.755 -4.565
590 HD13 ILE 111 HD13 ILE 111 15.923 4.360 -3.542
591 H LEU 112 H LEU 112 14.906 4.742 -0.620
592 HA LEU 112 HA LEU 112 14.224 6.694 0.269
593 HB2 LEU 112 HB2 LEU 112 11.891 5.169 -0.785
594 HB3 LEU 112 HB3 LEU 112 11.551 6.676 0.029
595 HG LEU 112 HG LEU 112 12.803 7.974 -1.491
596 HD11 LEU 112 HD11 LEU 112 13.597 5.560 -3.123
597 HD12 LEU 112 HD12 LEU 112 14.717 6.406 -2.016
598 HD13 LEU 112 HD13 LEU 112 14.015 7.243 -3.400
599 HD21 LEU 112 HD21 LEU 112 11.208 5.907 -3.069
600 HD22 LEU 112 HD22 LEU 112 11.559 7.586 -3.545
601 HD23 LEU 112 HD23 LEU 112 10.521 7.272 -2.154
602 H LYS 113 H LYS 113 15.072 6.363 2.412
603 HA LYS 113 HA LYS 113 13.026 6.941 4.398
604 HB2 LYS 113 HB2 LYS 113 13.624 5.170 6.002
605 HB3 LYS 113 HB3 LYS 113 12.865 4.566 4.545
606 HG2 LYS 113 HG2 LYS 113 15.225 3.951 3.706
607 HG3 LYS 113 HG3 LYS 113 15.773 4.327 5.354
608 HD2 LYS 113 HD2 LYS 113 14.121 2.645 6.221
609 HD3 LYS 113 HD3 LYS 113 13.926 2.111 4.519
610 HE2 LYS 113 HE2 LYS 113 16.472 2.012 4.430
611 HE3 LYS 113 HE3 LYS 113 16.492 2.337 6.160
612 HZ1 LYS 113 HZ1 LYS 113 15.085 0.237 6.407
613 HZ2 LYS 113 HZ2 LYS 113 16.597 -0.039 5.866
614 HZ3 LYS 113 HZ3 LYS 113 15.363 -0.050 4.809
615 H VAL 114 H VAL 114 16.368 5.742 4.617
616 HA VAL 114 HA VAL 114 17.238 7.453 6.607
617 HB VAL 114 HB VAL 114 18.173 5.276 5.980
618 HG11 VAL 114 HG11 VAL 114 18.185 5.493 3.505
619 HG12 VAL 114 HG12 VAL 114 19.551 6.626 3.640
620 HG13 VAL 114 HG13 VAL 114 19.728 4.946 4.165
621 HG21 VAL 114 HG21 VAL 114 20.495 5.713 6.399
622 HG22 VAL 114 HG22 VAL 114 20.333 7.408 5.891
623 HG23 VAL 114 HG23 VAL 114 19.525 6.824 7.361
624 H TRP 115 H TRP 115 17.108 8.011 3.218
625 HA TRP 115 HA TRP 115 17.668 9.860 1.905
626 HB2 TRP 115 HB2 TRP 115 16.062 10.902 3.534
627 HB3 TRP 115 HB3 TRP 115 17.433 11.469 4.473
628 HD1 TRP 115 HD1 TRP 115 18.526 13.678 3.710
629 HE1 TRP 115 HE1 TRP 115 18.093 15.395 1.839
630 HE3 TRP 115 HE3 TRP 115 15.416 10.886 0.833
631 HZ2 TRP 115 HZ2 TRP 115 16.417 15.550 -0.549
632 HZ3 TRP 115 HZ3 TRP 115 14.389 11.822 -1.248
633 HH2 TRP 115 HH2 TRP 115 14.871 14.160 -1.913
Start of MODEL 2
1 H1 MET 1 H MET 1 -16.157 8.964 15.859
2 HA MET 1 HA MET 1 -14.694 8.575 14.077
3 HB2 MET 1 HB2 MET 1 -13.516 6.516 14.686
4 HB3 MET 1 HB3 MET 1 -13.961 7.477 16.089
5 HG2 MET 1 HG2 MET 1 -15.944 5.984 16.444
6 HG3 MET 1 HG3 MET 1 -15.380 4.954 15.127
7 HE1 MET 1 HE1 MET 1 -13.879 2.997 15.452
8 HE2 MET 1 HE2 MET 1 -12.531 4.154 15.312
9 HE3 MET 1 HE3 MET 1 -12.535 2.936 16.609
10 H LYS 2 H LYS 2 -14.220 7.800 12.121
11 HA LYS 2 HA LYS 2 -15.591 5.629 10.809
12 HB2 LYS 2 HB2 LYS 2 -16.236 8.538 10.201
13 HB3 LYS 2 HB3 LYS 2 -15.969 7.444 8.838
14 HG2 LYS 2 HG2 LYS 2 -17.665 5.880 9.720
15 HG3 LYS 2 HG3 LYS 2 -18.022 7.021 11.032
16 HD2 LYS 2 HD2 LYS 2 -18.759 8.711 9.426
17 HD3 LYS 2 HD3 LYS 2 -18.273 7.673 8.061
18 HE2 LYS 2 HE2 LYS 2 -19.854 5.947 8.745
19 HE3 LYS 2 HE3 LYS 2 -20.319 6.868 10.178
20 HZ1 LYS 2 HZ1 LYS 2 -21.754 6.974 8.088
21 HZ2 LYS 2 HZ2 LYS 2 -20.655 8.038 7.504
22 HZ3 LYS 2 HZ3 LYS 2 -21.470 8.382 8.898
23 H VAL 3 H VAL 3 -14.385 5.238 8.679
24 HA VAL 3 HA VAL 3 -11.899 6.816 8.481
25 HB VAL 3 HB VAL 3 -11.661 3.814 8.384
26 HG11 VAL 3 HG11 VAL 3 -9.759 6.145 8.913
27 HG12 VAL 3 HG12 VAL 3 -9.298 4.442 8.911
28 HG13 VAL 3 HG13 VAL 3 -9.866 5.205 7.417
29 HG21 VAL 3 HG21 VAL 3 -12.468 4.125 10.626
30 HG22 VAL 3 HG22 VAL 3 -10.736 3.831 10.663
31 HG23 VAL 3 HG23 VAL 3 -11.333 5.479 10.903
32 HA PRO 4 HA PRO 4 -13.562 6.075 4.302
33 HB2 PRO 4 HB2 PRO 4 -12.631 8.327 3.068
34 HB3 PRO 4 HB3 PRO 4 -14.074 8.344 4.124
35 HG2 PRO 4 HG2 PRO 4 -11.220 9.067 4.824
36 HG3 PRO 4 HG3 PRO 4 -12.696 10.002 5.192
37 HD2 PRO 4 HD2 PRO 4 -11.519 8.334 7.016
38 HD3 PRO 4 HD3 PRO 4 -13.290 8.546 6.954
39 H GLY 5 H GLY 5 -12.229 5.923 2.085
40 HA2 GLY 5 HA2 GLY 5 -9.971 4.370 2.627
41 HA3 GLY 5 HA3 GLY 5 -10.445 5.003 1.029
42 H VAL 6 H VAL 6 -7.729 4.831 2.519
43 HA VAL 6 HA VAL 6 -7.048 7.750 2.603
44 HB VAL 6 HB VAL 6 -5.291 5.388 3.370
45 HG11 VAL 6 HG11 VAL 6 -3.990 7.059 4.593
46 HG12 VAL 6 HG12 VAL 6 -4.121 7.545 2.904
47 HG13 VAL 6 HG13 VAL 6 -5.127 8.338 4.128
48 HG21 VAL 6 HG21 VAL 6 -5.806 5.881 5.729
49 HG22 VAL 6 HG22 VAL 6 -7.022 7.054 5.215
50 HG23 VAL 6 HG23 VAL 6 -7.244 5.328 4.868
51 H ARG 7 H ARG 7 -6.352 8.560 0.685
52 HA ARG 7 HA ARG 7 -5.551 6.774 -1.469
53 HB2 ARG 7 HB2 ARG 7 -5.386 8.602 -2.889
54 HB3 ARG 7 HB3 ARG 7 -6.802 8.899 -1.910
55 HG2 ARG 7 HG2 ARG 7 -4.126 10.300 -1.572
56 HG3 ARG 7 HG3 ARG 7 -5.492 10.911 -2.471
57 HD2 ARG 7 HD2 ARG 7 -5.566 10.337 0.505
58 HD3 ARG 7 HD3 ARG 7 -5.247 11.907 -0.213
59 HE ARG 7 HE ARG 7 -7.842 10.623 0.084
60 HH11 ARG 7 HH11 ARG 7 -6.167 13.138 -1.965
61 HH12 ARG 7 HH12 ARG 7 -7.638 14.031 -2.061
62 HH21 ARG 7 HH21 ARG 7 -9.623 11.822 -0.235
63 HH22 ARG 7 HH22 ARG 7 -9.592 13.278 -1.223
64 H VAL 8 H VAL 8 -3.488 6.042 -1.833
65 HA VAL 8 HA VAL 8 -1.216 7.536 -0.650
66 HB VAL 8 HB VAL 8 -0.278 5.376 0.178
67 HG11 VAL 8 HG11 VAL 8 -2.941 6.085 1.479
68 HG12 VAL 8 HG12 VAL 8 -1.529 5.358 2.248
69 HG13 VAL 8 HG13 VAL 8 -1.445 7.031 1.667
70 HG21 VAL 8 HG21 VAL 8 -3.111 4.270 -0.189
71 HG22 VAL 8 HG22 VAL 8 -1.648 3.751 -1.049
72 HG23 VAL 8 HG23 VAL 8 -1.783 3.495 0.690
73 H ARG 9 H ARG 9 0.621 7.481 -1.936
74 HA ARG 9 HA ARG 9 0.209 6.351 -4.647
75 HB2 ARG 9 HB2 ARG 9 0.526 8.788 -4.506
76 HB3 ARG 9 HB3 ARG 9 2.094 8.557 -3.715
77 HG2 ARG 9 HG2 ARG 9 2.993 7.517 -5.757
78 HG3 ARG 9 HG3 ARG 9 1.373 7.493 -6.479
79 HD2 ARG 9 HD2 ARG 9 2.503 9.315 -7.480
80 HD3 ARG 9 HD3 ARG 9 1.333 9.994 -6.354
81 HE ARG 9 HE ARG 9 4.070 9.626 -5.324
82 HH11 ARG 9 HH11 ARG 9 1.676 12.003 -6.573
83 HH12 ARG 9 HH12 ARG 9 2.755 13.334 -6.364
84 HH21 ARG 9 HH21 ARG 9 5.524 11.428 -5.236
85 HH22 ARG 9 HH22 ARG 9 4.951 12.998 -5.645
86 H ALA 10 H ALA 10 1.531 4.926 -5.456
87 HA ALA 10 HA ALA 10 3.441 3.477 -3.785
88 HB1 ALA 10 HB1 ALA 10 2.483 3.339 -6.661
89 HB2 ALA 10 HB2 ALA 10 3.615 2.174 -5.948
90 HB3 ALA 10 HB3 ALA 10 1.948 2.324 -5.317
91 H LEU 11 H LEU 11 5.556 4.106 -3.560
92 HA LEU 11 HA LEU 11 6.668 5.987 -5.559
93 HB2 LEU 11 HB2 LEU 11 7.875 4.936 -2.987
94 HB3 LEU 11 HB3 LEU 11 8.582 6.161 -4.026
95 HG LEU 11 HG LEU 11 5.954 6.457 -2.504
96 HD11 LEU 11 HD11 LEU 11 7.185 7.998 -1.089
97 HD12 LEU 11 HD12 LEU 11 8.653 7.797 -2.063
98 HD13 LEU 11 HD13 LEU 11 8.026 6.443 -1.102
99 HD21 LEU 11 HD21 LEU 11 7.438 8.393 -4.321
100 HD22 LEU 11 HD22 LEU 11 6.156 8.867 -3.185
101 HD23 LEU 11 HD23 LEU 11 5.783 7.769 -4.517
102 H TYR 12 H TYR 12 6.623 2.615 -5.014
103 HA TYR 12 HA TYR 12 8.876 2.155 -6.892
104 HB2 TYR 12 HB2 TYR 12 8.218 0.192 -4.665
105 HB3 TYR 12 HB3 TYR 12 9.672 0.295 -5.626
106 HD1 TYR 12 HD1 TYR 12 7.870 1.517 -2.619
107 HD2 TYR 12 HD2 TYR 12 11.366 2.170 -5.130
108 HE1 TYR 12 HE1 TYR 12 8.724 3.091 -1.027
109 HE2 TYR 12 HE2 TYR 12 12.137 3.870 -3.544
110 HH TYR 12 HH TYR 12 11.245 5.367 -1.756
111 H ASP 13 H ASP 13 8.521 -0.160 -7.911
112 HA ASP 13 HA ASP 13 5.612 -0.582 -8.383
113 HB2 ASP 13 HB2 ASP 13 6.143 -1.059 -10.620
114 HB3 ASP 13 HB3 ASP 13 6.882 0.480 -10.215
115 H TYR 14 H TYR 14 4.942 -2.375 -7.272
116 HA TYR 14 HA TYR 14 6.401 -4.892 -7.638
117 HB2 TYR 14 HB2 TYR 14 5.972 -3.431 -5.056
118 HB3 TYR 14 HB3 TYR 14 5.500 -5.067 -5.012
119 HD1 TYR 14 HD1 TYR 14 7.047 -6.762 -4.572
120 HD2 TYR 14 HD2 TYR 14 8.438 -2.927 -5.990
121 HE1 TYR 14 HE1 TYR 14 9.359 -7.470 -4.203
122 HE2 TYR 14 HE2 TYR 14 10.748 -3.596 -5.629
123 HH TYR 14 HH TYR 14 11.561 -6.966 -4.513
124 H THR 15 H THR 15 4.906 -6.755 -7.336
125 HA THR 15 HA THR 15 2.020 -6.007 -7.374
126 HB THR 15 HB THR 15 2.820 -6.343 -9.606
127 HG1 THR 15 HG1 THR 15 1.380 -8.657 -8.979
128 HG21 THR 15 HG21 THR 15 3.628 -8.342 -10.572
129 HG22 THR 15 HG22 THR 15 3.459 -9.265 -9.077
130 HG23 THR 15 HG23 THR 15 4.697 -8.016 -9.208
131 H GLY 16 H GLY 16 2.020 -6.406 -5.116
132 HA2 GLY 16 HA2 GLY 16 1.672 -7.655 -3.236
133 HA3 GLY 16 HA3 GLY 16 0.996 -8.862 -4.353
134 H GLN 17 H GLN 17 1.806 -10.405 -2.775
135 HA GLN 17 HA GLN 17 4.546 -11.247 -3.382
136 HB2 GLN 17 HB2 GLN 17 4.712 -10.100 -1.253
137 HB3 GLN 17 HB3 GLN 17 3.500 -11.162 -0.530
138 HG2 GLN 17 HG2 GLN 17 5.861 -11.689 0.094
139 HG3 GLN 17 HG3 GLN 17 5.016 -13.045 -0.621
140 HE21 GLN 17 HE21 GLN 17 5.578 -13.683 -2.801
141 HE22 GLN 17 HE22 GLN 17 7.050 -13.144 -3.593
142 H GLU 18 H GLU 18 1.279 -11.875 -3.551
143 HA GLU 18 HA GLU 18 1.654 -14.673 -4.101
144 HB2 GLU 18 HB2 GLU 18 0.872 -13.931 -1.487
145 HB3 GLU 18 HB3 GLU 18 -0.673 -14.135 -2.294
146 HG2 GLU 18 HG2 GLU 18 1.498 -16.245 -2.223
147 HG3 GLU 18 HG3 GLU 18 0.130 -16.149 -1.109
148 H ALA 19 H ALA 19 -0.697 -15.355 -5.025
149 HA ALA 19 HA ALA 19 -1.481 -13.284 -6.928
150 HB1 ALA 19 HB1 ALA 19 -2.944 -15.084 -7.830
151 HB2 ALA 19 HB2 ALA 19 -1.259 -15.583 -7.675
152 HB3 ALA 19 HB3 ALA 19 -2.468 -16.137 -6.483
153 H ASP 20 H ASP 20 -2.696 -14.318 -3.827
154 HA ASP 20 HA ASP 20 -5.445 -13.380 -4.314
155 HB2 ASP 20 HB2 ASP 20 -4.125 -15.151 -2.455
156 HB3 ASP 20 HB3 ASP 20 -4.921 -13.874 -1.547
157 H GLU 21 H GLU 21 -2.727 -11.756 -4.065
158 HA GLU 21 HA GLU 21 -3.616 -9.655 -2.205
159 HB2 GLU 21 HB2 GLU 21 -0.834 -9.783 -3.278
160 HB3 GLU 21 HB3 GLU 21 -1.411 -9.196 -1.728
161 HG2 GLU 21 HG2 GLU 21 -1.013 -12.046 -2.580
162 HG3 GLU 21 HG3 GLU 21 -0.073 -11.161 -1.406
163 H LEU 22 H LEU 22 -2.652 -7.453 -3.014
164 HA LEU 22 HA LEU 22 -4.016 -6.733 -5.493
165 HB2 LEU 22 HB2 LEU 22 -3.391 -5.461 -2.971
166 HB3 LEU 22 HB3 LEU 22 -2.531 -4.550 -4.185
167 HG LEU 22 HG LEU 22 -5.467 -5.206 -4.120
168 HD11 LEU 22 HD11 LEU 22 -5.836 -2.837 -3.589
169 HD12 LEU 22 HD12 LEU 22 -4.079 -2.563 -3.582
170 HD13 LEU 22 HD13 LEU 22 -4.831 -3.623 -2.368
171 HD21 LEU 22 HD21 LEU 22 -4.789 -4.867 -6.478
172 HD22 LEU 22 HD22 LEU 22 -3.974 -3.352 -6.032
173 HD23 LEU 22 HD23 LEU 22 -5.738 -3.494 -5.923
174 H SER 23 H SER 23 -2.785 -4.882 -6.771
175 HA SER 23 HA SER 23 0.082 -5.355 -7.106
176 HB2 SER 23 HB2 SER 23 -1.175 -6.983 -8.563
177 HB3 SER 23 HB3 SER 23 -2.117 -5.627 -9.211
178 HG SER 23 HG SER 23 0.450 -6.478 -9.718
179 H PHE 24 H PHE 24 1.011 -3.227 -7.493
180 HA PHE 24 HA PHE 24 -0.735 -1.205 -8.733
181 HB2 PHE 24 HB2 PHE 24 -0.144 0.465 -7.098
182 HB3 PHE 24 HB3 PHE 24 -1.147 -0.822 -6.462
183 HD1 PHE 24 HD1 PHE 24 2.501 0.141 -6.710
184 HD2 PHE 24 HD2 PHE 24 -0.614 -1.677 -4.310
185 HE1 PHE 24 HE1 PHE 24 3.982 0.128 -4.760
186 HE2 PHE 24 HE2 PHE 24 0.958 -1.695 -2.384
187 HZ PHE 24 HZ PHE 24 3.231 -0.767 -2.586
188 H LYS 25 H LYS 25 0.916 0.846 -9.134
189 HA LYS 25 HA LYS 25 3.573 -0.221 -9.945
190 HB2 LYS 25 HB2 LYS 25 1.754 1.517 -11.670
191 HB3 LYS 25 HB3 LYS 25 3.353 0.915 -12.107
192 HG2 LYS 25 HG2 LYS 25 0.897 -0.848 -11.637
193 HG3 LYS 25 HG3 LYS 25 1.409 -0.256 -13.199
194 HD2 LYS 25 HD2 LYS 25 3.600 -1.662 -11.761
195 HD3 LYS 25 HD3 LYS 25 2.161 -2.655 -12.002
196 HE2 LYS 25 HE2 LYS 25 3.623 -2.963 -13.909
197 HE3 LYS 25 HE3 LYS 25 2.150 -2.130 -14.402
198 HZ1 LYS 25 HZ1 LYS 25 3.402 -0.037 -14.347
199 HZ2 LYS 25 HZ2 LYS 25 4.049 -1.101 -15.399
200 HZ3 LYS 25 HZ3 LYS 25 4.782 -0.869 -13.972
201 H ALA 26 H ALA 26 5.179 1.605 -10.246
202 HA ALA 26 HA ALA 26 4.955 3.503 -8.164
203 HB1 ALA 26 HB1 ALA 26 6.722 3.495 -10.642
204 HB2 ALA 26 HB2 ALA 26 6.935 4.576 -9.245
205 HB3 ALA 26 HB3 ALA 26 7.130 2.825 -9.049
206 H GLY 27 H GLY 27 3.645 5.206 -8.060
207 HA2 GLY 27 HA2 GLY 27 3.006 7.407 -8.812
208 HA3 GLY 27 HA3 GLY 27 2.941 6.819 -10.481
209 H GLU 28 H GLU 28 1.584 4.229 -9.129
210 HA GLU 28 HA GLU 28 -1.088 5.069 -9.779
211 HB2 GLU 28 HB2 GLU 28 0.140 2.673 -9.833
212 HB3 GLU 28 HB3 GLU 28 -0.466 2.571 -8.182
213 HG2 GLU 28 HG2 GLU 28 -2.073 1.534 -9.630
214 HG3 GLU 28 HG3 GLU 28 -2.784 3.067 -9.127
215 H GLU 29 H GLU 29 -2.887 5.264 -8.265
216 HA GLU 29 HA GLU 29 -2.060 5.788 -5.456
217 HB2 GLU 29 HB2 GLU 29 -4.055 7.244 -7.172
218 HB3 GLU 29 HB3 GLU 29 -3.828 7.502 -5.434
219 HG2 GLU 29 HG2 GLU 29 -1.410 8.099 -5.948
220 HG3 GLU 29 HG3 GLU 29 -1.840 8.097 -7.667
221 H LEU 30 H LEU 30 -2.818 4.214 -4.287
222 HA LEU 30 HA LEU 30 -5.446 2.942 -4.925
223 HB2 LEU 30 HB2 LEU 30 -4.592 1.264 -3.190
224 HB3 LEU 30 HB3 LEU 30 -3.912 1.178 -4.828
225 HG LEU 30 HG LEU 30 -2.434 2.777 -2.753
226 HD11 LEU 30 HD11 LEU 30 -2.986 0.776 -1.495
227 HD12 LEU 30 HD12 LEU 30 -1.291 0.718 -1.966
228 HD13 LEU 30 HD13 LEU 30 -2.467 -0.268 -2.852
229 HD21 LEU 30 HD21 LEU 30 -0.465 1.765 -3.976
230 HD22 LEU 30 HD22 LEU 30 -1.508 2.704 -5.039
231 HD23 LEU 30 HD23 LEU 30 -1.609 0.938 -5.038
232 H MET 31 H MET 31 -6.826 2.390 -3.060
233 HA MET 31 HA MET 31 -6.736 4.492 -0.981
234 HB2 MET 31 HB2 MET 31 -9.309 3.167 -1.773
235 HB3 MET 31 HB3 MET 31 -9.019 4.693 -0.988
236 HG2 MET 31 HG2 MET 31 -8.398 4.083 -3.908
237 HG3 MET 31 HG3 MET 31 -9.809 4.951 -3.325
238 HE1 MET 31 HE1 MET 31 -9.037 7.114 -1.281
239 HE2 MET 31 HE2 MET 31 -8.745 8.389 -2.501
240 HE3 MET 31 HE3 MET 31 -10.010 7.190 -2.785
241 H LYS 32 H LYS 32 -5.909 3.536 0.798
242 HA LYS 32 HA LYS 32 -6.142 0.725 1.434
243 HB2 LYS 32 HB2 LYS 32 -4.428 2.305 2.280
244 HB3 LYS 32 HB3 LYS 32 -5.670 3.152 3.206
245 HG2 LYS 32 HG2 LYS 32 -6.154 1.006 4.480
246 HG3 LYS 32 HG3 LYS 32 -4.802 0.256 3.625
247 HD2 LYS 32 HD2 LYS 32 -4.019 0.929 5.790
248 HD3 LYS 32 HD3 LYS 32 -3.311 2.064 4.622
249 HE2 LYS 32 HE2 LYS 32 -5.349 3.583 5.176
250 HE3 LYS 32 HE3 LYS 32 -5.656 2.442 6.501
251 HZ1 LYS 32 HZ1 LYS 32 -3.401 2.927 7.269
252 HZ2 LYS 32 HZ2 LYS 32 -4.366 4.254 7.307
253 HZ3 LYS 32 HZ3 LYS 32 -3.229 4.075 6.111
254 H ILE 33 H ILE 33 -7.614 -0.299 3.052
255 HA ILE 33 HA ILE 33 -9.853 1.444 3.925
256 HB ILE 33 HB ILE 33 -11.502 0.034 3.283
257 HG12 ILE 33 HG12 ILE 33 -9.644 -2.135 2.256
258 HG13 ILE 33 HG13 ILE 33 -10.411 -2.164 3.826
259 HG21 ILE 33 HG21 ILE 33 -10.654 1.461 1.489
260 HG22 ILE 33 HG22 ILE 33 -9.751 0.091 0.824
261 HG23 ILE 33 HG23 ILE 33 -11.525 0.048 0.898
262 HD11 ILE 33 HD11 ILE 33 -11.876 -2.204 1.178
263 HD12 ILE 33 HD12 ILE 33 -11.709 -3.501 2.379
264 HD13 ILE 33 HD13 ILE 33 -12.646 -2.058 2.778
265 H SER 34 H SER 34 -7.468 -0.714 4.974
266 HA SER 34 HA SER 34 -8.924 -1.233 7.509
267 HB2 SER 34 HB2 SER 34 -7.248 -3.105 5.766
268 HB3 SER 34 HB3 SER 34 -7.630 -3.453 7.455
269 HG SER 34 HG SER 34 -9.770 -3.514 6.989
270 H GLU 35 H GLU 35 -6.993 -2.159 9.104
271 HA GLU 35 HA GLU 35 -5.085 0.072 9.236
272 HB2 GLU 35 HB2 GLU 35 -6.459 -1.532 11.128
273 HB3 GLU 35 HB3 GLU 35 -4.790 -2.057 11.241
274 HG2 GLU 35 HG2 GLU 35 -4.837 -0.303 12.759
275 HG3 GLU 35 HG3 GLU 35 -4.225 0.504 11.314
276 H GLU 36 H GLU 36 -2.727 -0.618 9.996
277 HA GLU 36 HA GLU 36 -1.643 -2.461 7.969
278 HB2 GLU 36 HB2 GLU 36 -0.769 -0.160 8.297
279 HB3 GLU 36 HB3 GLU 36 -0.249 -0.583 9.930
280 HG2 GLU 36 HG2 GLU 36 1.341 -2.188 9.048
281 HG3 GLU 36 HG3 GLU 36 0.648 -2.088 7.426
282 H ASP 37 H ASP 37 -0.426 -4.236 8.533
283 HA ASP 37 HA ASP 37 -0.824 -5.373 11.261
284 HB2 ASP 37 HB2 ASP 37 -0.173 -6.559 8.550
285 HB3 ASP 37 HB3 ASP 37 -0.108 -7.503 10.036
286 H GLU 38 H GLU 38 0.991 -6.912 11.891
287 HA GLU 38 HA GLU 38 3.428 -5.668 12.373
288 HB2 GLU 38 HB2 GLU 38 4.122 -7.961 13.125
289 HB3 GLU 38 HB3 GLU 38 2.559 -7.438 13.758
290 HG2 GLU 38 HG2 GLU 38 1.366 -8.828 12.098
291 HG3 GLU 38 HG3 GLU 38 2.898 -9.278 11.338
292 H GLN 39 H GLN 39 2.498 -7.202 9.464
293 HA GLN 39 HA GLN 39 5.306 -7.622 8.521
294 HB2 GLN 39 HB2 GLN 39 2.604 -8.778 7.806
295 HB3 GLN 39 HB3 GLN 39 3.758 -8.599 6.511
296 HG2 GLN 39 HG2 GLN 39 4.148 -10.370 8.941
297 HG3 GLN 39 HG3 GLN 39 3.817 -10.824 7.309
298 HE21 GLN 39 HE21 GLN 39 6.389 -9.481 9.483
299 HE22 GLN 39 HE22 GLN 39 7.650 -9.707 8.297
300 H GLY 40 H GLY 40 3.210 -5.062 8.711
301 HA2 GLY 40 HA2 GLY 40 3.146 -3.131 7.573
302 HA3 GLY 40 HA3 GLY 40 4.462 -3.697 6.520
303 H TRP 41 H TRP 41 1.456 -5.494 7.033
304 HA TRP 41 HA TRP 41 0.801 -5.369 4.151
305 HB2 TRP 41 HB2 TRP 41 0.186 -7.153 6.498
306 HB3 TRP 41 HB3 TRP 41 -1.090 -6.968 5.322
307 HD1 TRP 41 HD1 TRP 41 1.258 -9.389 6.068
308 HE1 TRP 41 HE1 TRP 41 1.868 -10.837 4.032
309 HE3 TRP 41 HE3 TRP 41 -0.314 -6.258 2.376
310 HZ2 TRP 41 HZ2 TRP 41 2.082 -10.466 1.231
311 HZ3 TRP 41 HZ3 TRP 41 0.107 -6.842 -0.015
312 HH2 TRP 41 HH2 TRP 41 1.181 -8.859 -0.624
313 H CYS 42 H CYS 42 -1.077 -4.377 3.414
314 HA CYS 42 HA CYS 42 -3.002 -3.351 5.393
315 HB2 CYS 42 HB2 CYS 42 -1.385 -1.784 3.363
316 HB3 CYS 42 HB3 CYS 42 -3.070 -1.331 3.680
317 HG CYS 42 HG CYS 42 -1.329 0.203 4.955
318 H LYS 43 H LYS 43 -5.089 -3.426 4.570
319 HA LYS 43 HA LYS 43 -5.414 -4.779 1.940
320 HB2 LYS 43 HB2 LYS 43 -6.346 -5.531 4.471
321 HB3 LYS 43 HB3 LYS 43 -7.750 -4.725 3.775
322 HG2 LYS 43 HG2 LYS 43 -6.242 -6.703 2.069
323 HG3 LYS 43 HG3 LYS 43 -7.168 -7.353 3.415
324 HD2 LYS 43 HD2 LYS 43 -9.229 -6.527 2.524
325 HD3 LYS 43 HD3 LYS 43 -8.378 -5.484 1.371
326 HE2 LYS 43 HE2 LYS 43 -9.303 -7.446 0.229
327 HE3 LYS 43 HE3 LYS 43 -7.545 -7.382 0.138
328 HZ1 LYS 43 HZ1 LYS 43 -9.072 -9.120 1.993
329 HZ2 LYS 43 HZ2 LYS 43 -7.426 -9.115 1.786
330 HZ3 LYS 43 HZ3 LYS 43 -8.415 -9.576 0.573
331 H GLY 44 H GLY 44 -6.522 -3.720 0.338
332 HA2 GLY 44 HA2 GLY 44 -8.182 -1.404 0.994
333 HA3 GLY 44 HA3 GLY 44 -6.642 -1.025 0.278
334 H ARG 45 H ARG 45 -8.275 -0.111 -1.256
335 HA ARG 45 HA ARG 45 -8.902 -2.089 -3.375
336 HB2 ARG 45 HB2 ARG 45 -10.523 0.284 -2.384
337 HB3 ARG 45 HB3 ARG 45 -10.693 -0.279 -4.045
338 HG2 ARG 45 HG2 ARG 45 -11.438 -2.462 -3.346
339 HG3 ARG 45 HG3 ARG 45 -11.194 -2.040 -1.629
340 HD2 ARG 45 HD2 ARG 45 -12.833 -0.150 -1.937
341 HD3 ARG 45 HD3 ARG 45 -13.149 -0.734 -3.577
342 HE ARG 45 HE ARG 45 -13.635 -2.975 -2.172
343 HH11 ARG 45 HH11 ARG 45 -14.935 0.360 -1.665
344 HH12 ARG 45 HH12 ARG 45 -16.278 -0.242 -0.745
345 HH21 ARG 45 HH21 ARG 45 -15.430 -3.638 -1.163
346 HH22 ARG 45 HH22 ARG 45 -16.724 -2.580 -0.705
347 H LEU 46 H LEU 46 -8.883 -1.076 -5.533
348 HA LEU 46 HA LEU 46 -6.819 1.097 -5.707
349 HB2 LEU 46 HB2 LEU 46 -7.123 -1.411 -7.160
350 HB3 LEU 46 HB3 LEU 46 -7.175 -0.064 -8.289
351 HG LEU 46 HG LEU 46 -5.035 -0.461 -6.183
352 HD11 LEU 46 HD11 LEU 46 -4.865 -0.983 -9.168
353 HD12 LEU 46 HD12 LEU 46 -4.979 -2.240 -7.940
354 HD13 LEU 46 HD13 LEU 46 -3.564 -1.170 -7.988
355 HD21 LEU 46 HD21 LEU 46 -5.242 1.942 -6.949
356 HD22 LEU 46 HD22 LEU 46 -5.074 1.388 -8.628
357 HD23 LEU 46 HD23 LEU 46 -3.735 1.202 -7.485
358 H LEU 47 H LEU 47 -7.211 2.454 -7.902
359 HA LEU 47 HA LEU 47 -9.735 3.743 -7.507
360 HB2 LEU 47 HB2 LEU 47 -9.227 4.989 -9.579
361 HB3 LEU 47 HB3 LEU 47 -8.040 5.119 -8.316
362 HG LEU 47 HG LEU 47 -7.341 2.933 -10.156
363 HD11 LEU 47 HD11 LEU 47 -8.571 4.309 -11.814
364 HD12 LEU 47 HD12 LEU 47 -6.831 4.328 -12.128
365 HD13 LEU 47 HD13 LEU 47 -7.604 5.729 -11.355
366 HD21 LEU 47 HD21 LEU 47 -5.784 3.917 -8.594
367 HD22 LEU 47 HD22 LEU 47 -5.964 5.515 -9.332
368 HD23 LEU 47 HD23 LEU 47 -5.210 4.188 -10.244
369 H THR 48 H THR 48 -8.703 1.228 -9.821
370 HA THR 48 HA THR 48 -11.121 1.324 -11.378
371 HB THR 48 HB THR 48 -8.831 0.497 -12.043
372 HG1 THR 48 HG1 THR 48 -10.956 -1.311 -12.508
373 HG21 THR 48 HG21 THR 48 -9.614 -2.083 -10.633
374 HG22 THR 48 HG22 THR 48 -8.337 -0.959 -10.096
375 HG23 THR 48 HG23 THR 48 -8.185 -1.809 -11.638
376 H GLY 49 H GLY 49 -10.813 0.473 -8.120
377 HA2 GLY 49 HA2 GLY 49 -12.458 -0.422 -6.804
378 HA3 GLY 49 HA3 GLY 49 -13.251 -1.138 -8.211
379 H HIS 50 H HIS 50 -9.937 -1.922 -8.350
380 HA HIS 50 HA HIS 50 -10.321 -4.678 -7.933
381 HB2 HIS 50 HB2 HIS 50 -8.295 -3.099 -8.942
382 HB3 HIS 50 HB3 HIS 50 -7.607 -3.544 -7.392
383 HD1 HIS 50 HD1 HIS 50 -8.563 -5.031 -10.792
384 HD2 HIS 50 HD2 HIS 50 -6.850 -6.123 -7.069
385 HE1 HIS 50 HE1 HIS 50 -7.461 -7.281 -11.122
386 H VAL 51 H VAL 51 -9.656 -6.046 -6.064
387 HA VAL 51 HA VAL 51 -9.217 -4.568 -3.526
388 HB VAL 51 HB VAL 51 -11.468 -4.963 -3.349
389 HG11 VAL 51 HG11 VAL 51 -11.222 -7.713 -4.622
390 HG12 VAL 51 HG12 VAL 51 -12.701 -7.021 -3.941
391 HG13 VAL 51 HG13 VAL 51 -11.965 -6.265 -5.352
392 HG21 VAL 51 HG21 VAL 51 -11.845 -6.628 -1.680
393 HG22 VAL 51 HG22 VAL 51 -10.489 -7.617 -2.234
394 HG23 VAL 51 HG23 VAL 51 -10.182 -6.059 -1.453
395 H GLY 52 H GLY 52 -7.655 -5.386 -2.235
396 HA2 GLY 52 HA2 GLY 52 -6.932 -8.112 -2.027
397 HA3 GLY 52 HA3 GLY 52 -5.867 -7.356 -3.217
398 H LEU 53 H LEU 53 -4.462 -8.204 -1.304
399 HA LEU 53 HA LEU 53 -4.091 -6.320 0.948
400 HB2 LEU 53 HB2 LEU 53 -3.359 -9.151 0.259
401 HB3 LEU 53 HB3 LEU 53 -2.132 -8.271 1.140
402 HG LEU 53 HG LEU 53 -4.998 -8.405 2.109
403 HD11 LEU 53 HD11 LEU 53 -4.114 -10.665 1.902
404 HD12 LEU 53 HD12 LEU 53 -4.299 -10.199 3.608
405 HD13 LEU 53 HD13 LEU 53 -2.688 -10.219 2.839
406 HD21 LEU 53 HD21 LEU 53 -3.538 -6.582 3.040
407 HD22 LEU 53 HD22 LEU 53 -2.380 -7.819 3.557
408 HD23 LEU 53 HD23 LEU 53 -4.003 -7.749 4.258
409 H TYR 54 H TYR 54 -2.392 -4.813 0.791
410 HA TYR 54 HA TYR 54 -0.549 -5.082 -1.497
411 HB2 TYR 54 HB2 TYR 54 -0.754 -2.865 -2.068
412 HB3 TYR 54 HB3 TYR 54 -2.381 -3.417 -1.911
413 HD1 TYR 54 HD1 TYR 54 -3.887 -2.403 -0.236
414 HD2 TYR 54 HD2 TYR 54 0.320 -1.419 -0.287
415 HE1 TYR 54 HE1 TYR 54 -4.280 -0.566 1.381
416 HE2 TYR 54 HE2 TYR 54 -0.079 0.327 1.368
417 HH TYR 54 HH TYR 54 -1.554 1.444 2.700
418 HA PRO 55 HA PRO 55 2.213 -4.494 2.007
419 HB2 PRO 55 HB2 PRO 55 4.604 -4.019 0.826
420 HB3 PRO 55 HB3 PRO 55 3.761 -5.602 0.749
421 HG2 PRO 55 HG2 PRO 55 3.845 -3.422 -1.322
422 HG3 PRO 55 HG3 PRO 55 4.071 -5.167 -1.572
423 HD2 PRO 55 HD2 PRO 55 1.656 -3.917 -2.011
424 HD3 PRO 55 HD3 PRO 55 1.789 -5.605 -1.433
425 H ALA 56 H ALA 56 1.820 -2.752 3.238
426 HA ALA 56 HA ALA 56 1.524 -0.065 2.463
427 HB1 ALA 56 HB1 ALA 56 2.372 -1.107 5.185
428 HB2 ALA 56 HB2 ALA 56 1.474 0.378 4.848
429 HB3 ALA 56 HB3 ALA 56 0.719 -1.211 4.588
430 H ASN 57 H ASN 57 4.364 -1.872 3.285
431 HA ASN 57 HA ASN 57 6.101 0.351 3.825
432 HB2 ASN 57 HB2 ASN 57 7.358 -2.093 2.644
433 HB3 ASN 57 HB3 ASN 57 7.754 -1.130 4.049
434 HD21 ASN 57 HD21 ASN 57 5.720 -3.864 2.872
435 HD22 ASN 57 HD22 ASN 57 5.255 -4.366 4.492
436 H TYR 58 H TYR 58 4.793 -0.780 0.793
437 HA TYR 58 HA TYR 58 7.005 0.499 -0.729
438 HB2 TYR 58 HB2 TYR 58 4.969 -1.577 -1.540
439 HB3 TYR 58 HB3 TYR 58 6.092 -0.773 -2.616
440 HD1 TYR 58 HD1 TYR 58 6.341 -2.715 0.637
441 HD2 TYR 58 HD2 TYR 58 7.818 -2.122 -3.358
442 HE1 TYR 58 HE1 TYR 58 8.093 -4.409 1.043
443 HE2 TYR 58 HE2 TYR 58 9.646 -3.712 -2.906
444 HH TYR 58 HH TYR 58 9.888 -5.787 -0.103
445 H VAL 59 H VAL 59 4.335 1.631 0.634
446 HA VAL 59 HA VAL 59 3.714 3.397 -1.655
447 HB VAL 59 HB VAL 59 1.999 1.397 -1.199
448 HG11 VAL 59 HG11 VAL 59 1.025 3.494 0.791
449 HG12 VAL 59 HG12 VAL 59 0.137 2.085 0.235
450 HG13 VAL 59 HG13 VAL 59 1.630 1.869 1.192
451 HG21 VAL 59 HG21 VAL 59 0.118 2.762 -1.959
452 HG22 VAL 59 HG22 VAL 59 1.073 4.230 -1.690
453 HG23 VAL 59 HG23 VAL 59 1.566 3.002 -2.894
454 H GLU 60 H GLU 60 2.913 5.573 -0.876
455 HA GLU 60 HA GLU 60 3.262 6.033 2.020
456 HB2 GLU 60 HB2 GLU 60 5.493 6.291 1.014
457 HB3 GLU 60 HB3 GLU 60 4.868 7.455 -0.166
458 HG2 GLU 60 HG2 GLU 60 4.531 9.114 1.494
459 HG3 GLU 60 HG3 GLU 60 4.492 7.942 2.797
460 H LYS 61 H LYS 61 2.630 8.394 2.497
461 HA LYS 61 HA LYS 61 0.040 8.832 1.265
462 HB2 LYS 61 HB2 LYS 61 1.586 10.198 3.478
463 HB3 LYS 61 HB3 LYS 61 0.359 11.134 2.611
464 HG2 LYS 61 HG2 LYS 61 -1.167 9.040 2.938
465 HG3 LYS 61 HG3 LYS 61 -0.029 8.621 4.227
466 HD2 LYS 61 HD2 LYS 61 -1.859 11.032 3.936
467 HD3 LYS 61 HD3 LYS 61 -1.855 9.804 5.210
468 HE2 LYS 61 HE2 LYS 61 0.394 10.639 5.939
469 HE3 LYS 61 HE3 LYS 61 0.307 11.899 4.686
470 HZ1 LYS 61 HZ1 LYS 61 -1.731 11.615 6.804
471 HZ2 LYS 61 HZ2 LYS 61 -1.487 12.895 5.779
472 HZ3 LYS 61 HZ3 LYS 61 -0.402 12.609 6.948
473 H VAL 62 H VAL 62 -0.642 10.837 0.360
474 HA VAL 62 HA VAL 62 1.444 12.252 -1.082
475 HB VAL 62 HB VAL 62 0.996 10.302 -2.441
476 HG11 VAL 62 HG11 VAL 62 -1.094 9.666 -3.401
477 HG12 VAL 62 HG12 VAL 62 -1.396 9.867 -1.680
478 HG13 VAL 62 HG13 VAL 62 -1.902 11.116 -2.852
479 HG21 VAL 62 HG21 VAL 62 1.526 12.452 -3.517
480 HG22 VAL 62 HG22 VAL 62 0.584 11.358 -4.535
481 HG23 VAL 62 HG23 VAL 62 -0.211 12.746 -3.768
482 H GLY 63 H GLY 63 -2.137 11.926 -1.220
483 HA2 GLY 63 HA2 GLY 63 -3.806 13.439 -0.832
484 HA3 GLY 63 HA3 GLY 63 -2.660 14.315 0.200
485 H LEU 64 H LEU 64 -3.970 16.086 -0.720
486 HA LEU 64 HA LEU 64 -3.615 16.931 -3.485
487 HB2 LEU 64 HB2 LEU 64 -4.479 18.457 -0.984
488 HB3 LEU 64 HB3 LEU 64 -4.624 19.048 -2.646
489 HG LEU 64 HG LEU 64 -6.072 16.604 -1.522
490 HD11 LEU 64 HD11 LEU 64 -7.103 19.377 -2.222
491 HD12 LEU 64 HD12 LEU 64 -6.897 18.717 -0.577
492 HD13 LEU 64 HD13 LEU 64 -8.083 17.998 -1.678
493 HD21 LEU 64 HD21 LEU 64 -6.229 17.983 -4.241
494 HD22 LEU 64 HD22 LEU 64 -7.364 16.755 -3.654
495 HD23 LEU 64 HD23 LEU 64 -5.679 16.326 -3.905
496 H ALA 65 H ALA 65 -2.577 19.112 -3.948
497 HA ALA 65 HA ALA 65 0.141 19.080 -2.920
498 HB1 ALA 65 HB1 ALA 65 -0.383 19.418 -5.308
499 HB2 ALA 65 HB2 ALA 65 -1.181 20.951 -4.897
500 HB3 ALA 65 HB3 ALA 65 0.563 20.738 -4.606
501 H ALA 66 H ALA 66 -0.945 19.504 -0.632
502 HA ALA 66 HA ALA 66 -0.251 22.158 0.200
503 HB1 ALA 66 HB1 ALA 66 -2.400 22.887 1.057
504 HB2 ALA 66 HB2 ALA 66 -2.641 22.550 -0.664
505 HB3 ALA 66 HB3 ALA 66 -3.184 21.378 0.558
506 H ALA 67 H ALA 67 -0.070 22.223 2.472
507 HA ALA 67 HA ALA 67 0.449 21.379 4.516
508 HB1 ALA 67 HB1 ALA 67 -1.967 21.855 4.783
509 HB2 ALA 67 HB2 ALA 67 -2.354 20.202 4.256
510 HB3 ALA 67 HB3 ALA 67 -1.466 20.482 5.775
511 H1 THR 101 H THR 101 -4.193 -9.898 7.573
512 HA THR 101 HA THR 101 -2.091 -10.210 6.413
513 HB THR 101 HB THR 101 -1.115 -10.564 9.261
514 HG1 THR 101 HG1 THR 101 -1.142 -8.508 7.993
515 HG21 THR 101 HG21 THR 101 0.010 -12.425 8.138
516 HG22 THR 101 HG22 THR 101 1.144 -11.087 8.338
517 HG23 THR 101 HG23 THR 101 0.404 -11.369 6.758
518 H LYS 102 H LYS 102 -1.263 -12.304 5.764
519 HA LYS 102 HA LYS 102 -2.527 -14.729 6.790
520 HB2 LYS 102 HB2 LYS 102 -3.494 -15.308 4.556
521 HB3 LYS 102 HB3 LYS 102 -4.312 -13.972 5.363
522 HG2 LYS 102 HG2 LYS 102 -3.420 -12.336 3.978
523 HG3 LYS 102 HG3 LYS 102 -2.104 -13.349 3.393
524 HD2 LYS 102 HD2 LYS 102 -5.042 -13.819 2.720
525 HD3 LYS 102 HD3 LYS 102 -3.884 -12.917 1.718
526 HE2 LYS 102 HE2 LYS 102 -2.378 -15.024 1.897
527 HE3 LYS 102 HE3 LYS 102 -3.850 -15.871 2.402
528 HZ1 LYS 102 HZ1 LYS 102 -3.481 -15.982 0.024
529 HZ2 LYS 102 HZ2 LYS 102 -3.484 -14.337 -0.105
530 HZ3 LYS 102 HZ3 LYS 102 -4.867 -15.165 0.336
531 H GLY 103 H GLY 103 0.263 -13.281 5.900
532 HA2 GLY 103 HA2 GLY 103 1.796 -15.493 5.658
533 HA3 GLY 103 HA3 GLY 103 1.402 -15.032 3.979
534 HA PRO 104 HA PRO 104 4.643 -12.173 5.892
535 HB2 PRO 104 HB2 PRO 104 6.985 -13.086 4.782
536 HB3 PRO 104 HB3 PRO 104 6.295 -13.716 6.308
537 HG2 PRO 104 HG2 PRO 104 6.094 -14.893 3.532
538 HG3 PRO 104 HG3 PRO 104 6.423 -15.727 5.086
539 HD2 PRO 104 HD2 PRO 104 3.929 -15.646 3.916
540 HD3 PRO 104 HD3 PRO 104 4.181 -15.707 5.676
541 H ALA 105 H ALA 105 4.804 -10.378 4.892
542 HA ALA 105 HA ALA 105 4.115 -9.716 2.232
543 HB1 ALA 105 HB1 ALA 105 5.460 -8.267 4.586
544 HB2 ALA 105 HB2 ALA 105 4.773 -7.405 3.214
545 HB3 ALA 105 HB3 ALA 105 3.721 -8.321 4.268
546 HA PRO 106 HA PRO 106 8.203 -9.622 0.359
547 HB2 PRO 106 HB2 PRO 106 8.145 -7.507 -1.327
548 HB3 PRO 106 HB3 PRO 106 7.009 -8.907 -1.354
549 HG2 PRO 106 HG2 PRO 106 6.470 -6.198 -0.171
550 HG3 PRO 106 HG3 PRO 106 5.509 -7.062 -1.418
551 HD2 PRO 106 HD2 PRO 106 5.016 -7.227 1.258
552 HD3 PRO 106 HD3 PRO 106 4.648 -8.564 0.168
553 H ASN 107 H ASN 107 7.458 -7.761 2.549
554 HA ASN 107 HA ASN 107 9.376 -5.567 2.630
555 HB2 ASN 107 HB2 ASN 107 8.415 -4.739 4.402
556 HB3 ASN 107 HB3 ASN 107 7.090 -5.874 4.020
557 HD21 ASN 107 HD21 ASN 107 7.353 -4.548 6.504
558 HD22 ASN 107 HD22 ASN 107 7.748 -5.745 7.696
559 HA PRO 108 HA PRO 108 10.331 -4.542 5.339
560 HB2 PRO 108 HB2 PRO 108 12.948 -3.641 5.345
561 HB3 PRO 108 HB3 PRO 108 12.161 -4.560 6.654
562 HG2 PRO 108 HG2 PRO 108 13.916 -5.620 4.424
563 HG3 PRO 108 HG3 PRO 108 14.022 -5.949 6.175
564 HD2 PRO 108 HD2 PRO 108 12.732 -7.699 4.602
565 HD3 PRO 108 HD3 PRO 108 11.950 -7.201 6.120
566 HA PRO 109 HA PRO 109 10.194 -2.252 1.610
567 HB2 PRO 109 HB2 PRO 109 10.916 0.332 2.314
568 HB3 PRO 109 HB3 PRO 109 9.357 -0.427 2.663
569 HG2 PRO 109 HG2 PRO 109 11.734 -0.137 4.497
570 HG3 PRO 109 HG3 PRO 109 10.011 0.147 4.857
571 HD2 PRO 109 HD2 PRO 109 11.290 -2.155 5.513
572 HD3 PRO 109 HD3 PRO 109 9.585 -2.174 5.001
573 HA PRO 110 HA PRO 110 14.123 -1.880 -0.357
574 HB2 PRO 110 HB2 PRO 110 13.656 -0.211 -2.478
575 HB3 PRO 110 HB3 PRO 110 12.969 -1.851 -2.346
576 HG2 PRO 110 HG2 PRO 110 11.617 0.785 -1.729
577 HG3 PRO 110 HG3 PRO 110 10.967 -0.629 -2.605
578 HD2 PRO 110 HD2 PRO 110 10.467 -0.123 0.058
579 HD3 PRO 110 HD3 PRO 110 10.513 -1.770 -0.630
580 H ILE 111 H ILE 111 12.933 1.542 -0.704
581 HA ILE 111 HA ILE 111 15.146 2.492 1.028
582 HB ILE 111 HB ILE 111 15.721 4.187 -0.641
583 HG12 ILE 111 HG12 ILE 111 13.861 2.689 -2.577
584 HG13 ILE 111 HG13 ILE 111 13.539 4.261 -1.831
585 HG21 ILE 111 HG21 ILE 111 15.917 1.410 -1.873
586 HG22 ILE 111 HG22 ILE 111 17.020 2.770 -2.082
587 HG23 ILE 111 HG23 ILE 111 16.919 1.982 -0.507
588 HD11 ILE 111 HD11 ILE 111 15.827 3.684 -3.739
589 HD12 ILE 111 HD12 ILE 111 14.326 4.538 -4.096
590 HD13 ILE 111 HD13 ILE 111 15.478 5.244 -2.942
591 H LEU 112 H LEU 112 12.265 2.202 1.464
592 HA LEU 112 HA LEU 112 10.830 4.619 1.231
593 HB2 LEU 112 HB2 LEU 112 10.050 2.266 1.869
594 HB3 LEU 112 HB3 LEU 112 10.548 2.645 3.514
595 HG LEU 112 HG LEU 112 8.205 2.851 3.332
596 HD11 LEU 112 HD11 LEU 112 9.046 5.752 3.209
597 HD12 LEU 112 HD12 LEU 112 9.307 4.708 4.629
598 HD13 LEU 112 HD13 LEU 112 7.668 5.044 4.039
599 HD21 LEU 112 HD21 LEU 112 7.015 4.292 1.753
600 HD22 LEU 112 HD22 LEU 112 7.940 3.024 0.925
601 HD23 LEU 112 HD23 LEU 112 8.552 4.699 0.942
602 H LYS 113 H LYS 113 13.113 3.578 3.861
603 HA LYS 113 HA LYS 113 13.043 6.415 4.826
604 HB2 LYS 113 HB2 LYS 113 11.898 4.798 6.338
605 HB3 LYS 113 HB3 LYS 113 13.397 3.884 6.463
606 HG2 LYS 113 HG2 LYS 113 14.311 6.404 7.161
607 HG3 LYS 113 HG3 LYS 113 12.622 6.529 7.619
608 HD2 LYS 113 HD2 LYS 113 13.414 5.734 9.556
609 HD3 LYS 113 HD3 LYS 113 13.129 4.171 8.828
610 HE2 LYS 113 HE2 LYS 113 15.783 5.693 8.896
611 HE3 LYS 113 HE3 LYS 113 15.330 4.405 10.005
612 HZ1 LYS 113 HZ1 LYS 113 16.741 3.561 8.276
613 HZ2 LYS 113 HZ2 LYS 113 15.777 4.127 7.098
614 HZ3 LYS 113 HZ3 LYS 113 15.270 2.892 8.057
615 H VAL 114 H VAL 114 14.873 7.026 3.524
616 HA VAL 114 HA VAL 114 17.382 5.528 3.841
617 HB VAL 114 HB VAL 114 16.697 8.149 2.488
618 HG11 VAL 114 HG11 VAL 114 19.029 8.311 3.247
619 HG12 VAL 114 HG12 VAL 114 19.390 6.726 2.532
620 HG13 VAL 114 HG13 VAL 114 18.961 8.108 1.500
621 HG21 VAL 114 HG21 VAL 114 17.524 5.447 1.352
622 HG22 VAL 114 HG22 VAL 114 15.872 6.086 1.367
623 HG23 VAL 114 HG23 VAL 114 17.118 6.898 0.417
624 H TRP 115 H TRP 115 16.611 8.948 4.548
625 HA TRP 115 HA TRP 115 17.276 10.365 6.075
626 HB2 TRP 115 HB2 TRP 115 15.467 8.697 7.154
627 HB3 TRP 115 HB3 TRP 115 16.755 8.425 8.304
628 HD1 TRP 115 HD1 TRP 115 17.357 11.860 7.683
629 HE1 TRP 115 HE1 TRP 115 15.971 13.479 9.033
630 HE3 TRP 115 HE3 TRP 115 13.798 8.600 9.406
631 HZ2 TRP 115 HZ2 TRP 115 13.690 13.364 10.853
632 HZ3 TRP 115 HZ3 TRP 115 12.067 9.374 11.001
633 HH2 TRP 115 HH2 TRP 115 12.007 11.751 11.737
Start of MODEL 3
1 H1 MET 1 H MET 1 -13.648 2.140 12.132
2 HA MET 1 HA MET 1 -15.871 0.454 11.137
3 HB2 MET 1 HB2 MET 1 -16.024 2.760 13.113
4 HB3 MET 1 HB3 MET 1 -17.377 1.901 12.419
5 HG2 MET 1 HG2 MET 1 -17.060 1.050 14.584
6 HG3 MET 1 HG3 MET 1 -16.552 -0.209 13.464
7 HE1 MET 1 HE1 MET 1 -14.460 -0.598 16.799
8 HE2 MET 1 HE2 MET 1 -15.996 0.299 16.763
9 HE3 MET 1 HE3 MET 1 -15.827 -1.208 15.841
10 H LYS 2 H LYS 2 -16.291 1.011 9.087
11 HA LYS 2 HA LYS 2 -16.132 2.185 7.099
12 HB2 LYS 2 HB2 LYS 2 -18.430 2.021 7.833
13 HB3 LYS 2 HB3 LYS 2 -18.300 3.528 8.725
14 HG2 LYS 2 HG2 LYS 2 -18.137 4.831 6.686
15 HG3 LYS 2 HG3 LYS 2 -18.002 3.373 5.705
16 HD2 LYS 2 HD2 LYS 2 -20.403 3.458 7.466
17 HD3 LYS 2 HD3 LYS 2 -20.351 4.769 6.301
18 HE2 LYS 2 HE2 LYS 2 -19.776 1.936 5.386
19 HE3 LYS 2 HE3 LYS 2 -21.447 2.441 5.686
20 HZ1 LYS 2 HZ1 LYS 2 -21.350 4.040 4.076
21 HZ2 LYS 2 HZ2 LYS 2 -20.606 2.742 3.372
22 HZ3 LYS 2 HZ3 LYS 2 -19.699 4.004 3.908
23 H VAL 3 H VAL 3 -13.905 3.065 7.489
24 HA VAL 3 HA VAL 3 -13.867 5.963 8.099
25 HB VAL 3 HB VAL 3 -11.414 5.659 8.127
26 HG11 VAL 3 HG11 VAL 3 -12.866 3.628 9.878
27 HG12 VAL 3 HG12 VAL 3 -11.294 4.373 10.194
28 HG13 VAL 3 HG13 VAL 3 -12.757 5.371 10.194
29 HG21 VAL 3 HG21 VAL 3 -11.194 3.764 6.521
30 HG22 VAL 3 HG22 VAL 3 -10.377 3.471 8.053
31 HG23 VAL 3 HG23 VAL 3 -11.922 2.679 7.727
32 HA PRO 4 HA PRO 4 -13.592 6.958 3.772
33 HB2 PRO 4 HB2 PRO 4 -12.073 9.221 3.688
34 HB3 PRO 4 HB3 PRO 4 -13.723 9.188 4.381
35 HG2 PRO 4 HG2 PRO 4 -11.076 9.015 5.849
36 HG3 PRO 4 HG3 PRO 4 -12.491 10.043 6.235
37 HD2 PRO 4 HD2 PRO 4 -12.035 7.664 7.486
38 HD3 PRO 4 HD3 PRO 4 -13.692 8.217 7.115
39 H GLY 5 H GLY 5 -12.033 7.000 1.870
40 HA2 GLY 5 HA2 GLY 5 -9.870 5.175 2.345
41 HA3 GLY 5 HA3 GLY 5 -10.333 5.937 0.808
42 H VAL 6 H VAL 6 -7.607 5.704 1.753
43 HA VAL 6 HA VAL 6 -6.930 8.590 2.206
44 HB VAL 6 HB VAL 6 -5.053 6.349 2.918
45 HG11 VAL 6 HG11 VAL 6 -4.086 8.571 2.737
46 HG12 VAL 6 HG12 VAL 6 -5.390 9.272 3.716
47 HG13 VAL 6 HG13 VAL 6 -4.237 8.174 4.464
48 HG21 VAL 6 HG21 VAL 6 -5.740 6.525 5.256
49 HG22 VAL 6 HG22 VAL 6 -7.068 7.600 4.818
50 HG23 VAL 6 HG23 VAL 6 -7.086 5.912 4.282
51 H ARG 7 H ARG 7 -5.897 9.527 0.595
52 HA ARG 7 HA ARG 7 -5.370 8.081 -1.855
53 HB2 ARG 7 HB2 ARG 7 -4.499 10.281 -2.641
54 HB3 ARG 7 HB3 ARG 7 -6.167 10.290 -2.141
55 HG2 ARG 7 HG2 ARG 7 -4.184 11.142 -0.046
56 HG3 ARG 7 HG3 ARG 7 -4.304 12.173 -1.464
57 HD2 ARG 7 HD2 ARG 7 -6.752 11.318 0.110
58 HD3 ARG 7 HD3 ARG 7 -5.798 12.734 0.543
59 HE ARG 7 HE ARG 7 -7.452 12.335 -1.880
60 HH11 ARG 7 HH11 ARG 7 -5.566 14.592 0.071
61 HH12 ARG 7 HH12 ARG 7 -5.798 15.949 -1.000
62 HH21 ARG 7 HH21 ARG 7 -7.943 14.113 -3.169
63 HH22 ARG 7 HH22 ARG 7 -7.404 15.707 -2.760
64 H VAL 8 H VAL 8 -3.570 6.953 -2.268
65 HA VAL 8 HA VAL 8 -1.007 7.827 -1.071
66 HB VAL 8 HB VAL 8 -0.347 5.644 -0.389
67 HG11 VAL 8 HG11 VAL 8 -1.712 5.259 1.554
68 HG12 VAL 8 HG12 VAL 8 -1.626 6.999 1.252
69 HG13 VAL 8 HG13 VAL 8 -3.097 6.107 0.828
70 HG21 VAL 8 HG21 VAL 8 -1.964 3.733 -0.298
71 HG22 VAL 8 HG22 VAL 8 -3.070 4.671 -1.328
72 HG23 VAL 8 HG23 VAL 8 -1.443 4.210 -1.916
73 H ARG 9 H ARG 9 0.884 6.920 -2.280
74 HA ARG 9 HA ARG 9 0.260 6.140 -5.081
75 HB2 ARG 9 HB2 ARG 9 0.631 8.674 -4.685
76 HB3 ARG 9 HB3 ARG 9 2.298 8.263 -4.275
77 HG2 ARG 9 HG2 ARG 9 2.598 7.291 -6.555
78 HG3 ARG 9 HG3 ARG 9 0.891 7.638 -6.908
79 HD2 ARG 9 HD2 ARG 9 1.451 10.101 -6.293
80 HD3 ARG 9 HD3 ARG 9 3.145 9.620 -6.399
81 HE ARG 9 HE ARG 9 3.005 9.563 -8.667
82 HH11 ARG 9 HH11 ARG 9 -0.221 10.268 -7.382
83 HH12 ARG 9 HH12 ARG 9 -1.015 10.151 -8.929
84 HH21 ARG 9 HH21 ARG 9 1.909 9.568 -10.749
85 HH22 ARG 9 HH22 ARG 9 0.163 9.742 -10.804
86 H ALA 10 H ALA 10 1.659 4.476 -5.721
87 HA ALA 10 HA ALA 10 3.396 3.416 -3.666
88 HB1 ALA 10 HB1 ALA 10 3.672 1.514 -4.874
89 HB2 ALA 10 HB2 ALA 10 1.992 1.971 -5.228
90 HB3 ALA 10 HB3 ALA 10 3.295 2.238 -6.422
91 H LEU 11 H LEU 11 5.591 3.294 -3.622
92 HA LEU 11 HA LEU 11 7.018 5.261 -5.333
93 HB2 LEU 11 HB2 LEU 11 7.348 4.207 -2.543
94 HB3 LEU 11 HB3 LEU 11 8.812 4.592 -3.430
95 HG LEU 11 HG LEU 11 7.938 6.427 -2.007
96 HD11 LEU 11 HD11 LEU 11 8.401 8.202 -3.644
97 HD12 LEU 11 HD12 LEU 11 8.204 7.052 -4.980
98 HD13 LEU 11 HD13 LEU 11 9.528 6.844 -3.825
99 HD21 LEU 11 HD21 LEU 11 5.767 6.789 -4.106
100 HD22 LEU 11 HD22 LEU 11 6.123 7.838 -2.735
101 HD23 LEU 11 HD23 LEU 11 5.519 6.194 -2.453
102 H TYR 12 H TYR 12 6.505 1.873 -5.253
103 HA TYR 12 HA TYR 12 8.815 1.525 -7.063
104 HB2 TYR 12 HB2 TYR 12 8.247 -0.514 -4.883
105 HB3 TYR 12 HB3 TYR 12 9.609 -0.427 -5.978
106 HD1 TYR 12 HD1 TYR 12 8.150 0.969 -2.835
107 HD2 TYR 12 HD2 TYR 12 11.452 1.255 -5.625
108 HE1 TYR 12 HE1 TYR 12 9.231 2.601 -1.383
109 HE2 TYR 12 HE2 TYR 12 12.565 2.847 -4.130
110 HH TYR 12 HH TYR 12 10.935 4.328 -1.355
111 H ASP 13 H ASP 13 8.567 -0.691 -8.217
112 HA ASP 13 HA ASP 13 5.793 -1.040 -9.137
113 HB2 ASP 13 HB2 ASP 13 6.901 -2.049 -11.103
114 HB3 ASP 13 HB3 ASP 13 7.401 -0.390 -10.824
115 H TYR 14 H TYR 14 5.036 -2.445 -7.384
116 HA TYR 14 HA TYR 14 6.132 -5.214 -7.524
117 HB2 TYR 14 HB2 TYR 14 5.893 -3.359 -5.205
118 HB3 TYR 14 HB3 TYR 14 5.268 -4.946 -4.939
119 HD1 TYR 14 HD1 TYR 14 6.744 -6.685 -4.190
120 HD2 TYR 14 HD2 TYR 14 8.296 -3.332 -6.442
121 HE1 TYR 14 HE1 TYR 14 9.028 -7.618 -4.024
122 HE2 TYR 14 HE2 TYR 14 10.535 -4.315 -6.387
123 HH TYR 14 HH TYR 14 11.405 -7.249 -4.551
124 H THR 15 H THR 15 4.606 -6.900 -7.305
125 HA THR 15 HA THR 15 1.757 -6.086 -7.411
126 HB THR 15 HB THR 15 2.567 -6.523 -9.615
127 HG1 THR 15 HG1 THR 15 0.625 -7.285 -9.492
128 HG21 THR 15 HG21 THR 15 3.419 -8.687 -10.363
129 HG22 THR 15 HG22 THR 15 3.552 -9.248 -8.692
130 HG23 THR 15 HG23 THR 15 4.551 -7.893 -9.253
131 H GLY 16 H GLY 16 1.730 -6.424 -5.149
132 HA2 GLY 16 HA2 GLY 16 1.257 -7.586 -3.271
133 HA3 GLY 16 HA3 GLY 16 0.562 -8.827 -4.356
134 H GLN 17 H GLN 17 1.251 -10.362 -2.687
135 HA GLN 17 HA GLN 17 4.102 -11.085 -2.957
136 HB2 GLN 17 HB2 GLN 17 2.762 -10.175 -0.582
137 HB3 GLN 17 HB3 GLN 17 2.939 -11.901 -0.373
138 HG2 GLN 17 HG2 GLN 17 5.292 -10.148 -1.188
139 HG3 GLN 17 HG3 GLN 17 4.757 -10.314 0.490
140 HE21 GLN 17 HE21 GLN 17 5.878 -12.390 -2.302
141 HE22 GLN 17 HE22 GLN 17 6.489 -13.613 -1.218
142 H GLU 18 H GLU 18 0.714 -11.990 -3.008
143 HA GLU 18 HA GLU 18 1.304 -14.495 -4.128
144 HB2 GLU 18 HB2 GLU 18 1.347 -14.613 -1.387
145 HB3 GLU 18 HB3 GLU 18 -0.394 -14.685 -1.628
146 HG2 GLU 18 HG2 GLU 18 0.600 -16.922 -1.462
147 HG3 GLU 18 HG3 GLU 18 -0.104 -16.677 -3.057
148 H ALA 19 H ALA 19 -1.008 -15.611 -4.340
149 HA ALA 19 HA ALA 19 -2.550 -14.054 -6.014
150 HB1 ALA 19 HB1 ALA 19 -4.014 -16.007 -6.104
151 HB2 ALA 19 HB2 ALA 19 -2.341 -16.521 -6.035
152 HB3 ALA 19 HB3 ALA 19 -3.352 -16.605 -4.579
153 H ASP 20 H ASP 20 -2.800 -13.422 -2.649
154 HA ASP 20 HA ASP 20 -5.684 -12.698 -3.026
155 HB2 ASP 20 HB2 ASP 20 -5.198 -14.494 -1.312
156 HB3 ASP 20 HB3 ASP 20 -4.388 -13.246 -0.352
157 H GLU 21 H GLU 21 -2.742 -11.403 -3.216
158 HA GLU 21 HA GLU 21 -3.464 -8.868 -1.863
159 HB2 GLU 21 HB2 GLU 21 -0.851 -9.988 -2.980
160 HB3 GLU 21 HB3 GLU 21 -1.050 -8.384 -2.279
161 HG2 GLU 21 HG2 GLU 21 -0.411 -9.442 -0.387
162 HG3 GLU 21 HG3 GLU 21 -2.125 -9.755 -0.251
163 H LEU 22 H LEU 22 -2.870 -6.927 -3.000
164 HA LEU 22 HA LEU 22 -4.192 -6.697 -5.618
165 HB2 LEU 22 HB2 LEU 22 -3.161 -4.822 -3.432
166 HB3 LEU 22 HB3 LEU 22 -3.578 -4.163 -4.996
167 HG LEU 22 HG LEU 22 -5.520 -5.721 -3.280
168 HD11 LEU 22 HD11 LEU 22 -4.891 -3.650 -2.202
169 HD12 LEU 22 HD12 LEU 22 -6.532 -3.501 -2.877
170 HD13 LEU 22 HD13 LEU 22 -5.139 -2.782 -3.717
171 HD21 LEU 22 HD21 LEU 22 -7.134 -4.526 -4.938
172 HD22 LEU 22 HD22 LEU 22 -6.282 -5.980 -5.446
173 HD23 LEU 22 HD23 LEU 22 -5.684 -4.398 -5.972
174 H SER 23 H SER 23 -3.140 -4.959 -7.130
175 HA SER 23 HA SER 23 -0.172 -5.251 -7.151
176 HB2 SER 23 HB2 SER 23 -1.282 -6.965 -8.598
177 HB3 SER 23 HB3 SER 23 -2.130 -5.673 -9.465
178 HG SER 23 HG SER 23 -0.205 -4.944 -10.282
179 H PHE 24 H PHE 24 0.825 -3.254 -7.475
180 HA PHE 24 HA PHE 24 -0.814 -1.132 -8.792
181 HB2 PHE 24 HB2 PHE 24 0.386 0.509 -7.350
182 HB3 PHE 24 HB3 PHE 24 -0.826 -0.438 -6.551
183 HD1 PHE 24 HD1 PHE 24 2.783 -0.271 -7.150
184 HD2 PHE 24 HD2 PHE 24 -0.385 -1.547 -4.502
185 HE1 PHE 24 HE1 PHE 24 4.493 -0.963 -5.419
186 HE2 PHE 24 HE2 PHE 24 1.299 -1.928 -2.720
187 HZ PHE 24 HZ PHE 24 3.708 -1.767 -3.196
188 H LYS 25 H LYS 25 0.565 0.442 -9.935
189 HA LYS 25 HA LYS 25 3.196 -0.702 -10.812
190 HB2 LYS 25 HB2 LYS 25 0.938 0.591 -12.303
191 HB3 LYS 25 HB3 LYS 25 2.521 1.145 -12.757
192 HG2 LYS 25 HG2 LYS 25 1.664 -1.768 -12.832
193 HG3 LYS 25 HG3 LYS 25 1.745 -0.654 -14.197
194 HD2 LYS 25 HD2 LYS 25 4.257 -0.329 -13.584
195 HD3 LYS 25 HD3 LYS 25 4.054 -1.738 -12.542
196 HE2 LYS 25 HE2 LYS 25 4.883 -2.650 -14.516
197 HE3 LYS 25 HE3 LYS 25 3.150 -2.968 -14.618
198 HZ1 LYS 25 HZ1 LYS 25 4.583 -0.745 -15.960
199 HZ2 LYS 25 HZ2 LYS 25 2.960 -1.041 -16.078
200 HZ3 LYS 25 HZ3 LYS 25 4.021 -2.127 -16.674
201 H ALA 26 H ALA 26 4.790 1.027 -11.518
202 HA ALA 26 HA ALA 26 5.058 2.851 -9.364
203 HB1 ALA 26 HB1 ALA 26 6.473 2.749 -12.079
204 HB2 ALA 26 HB2 ALA 26 6.973 3.774 -10.722
205 HB3 ALA 26 HB3 ALA 26 7.041 2.012 -10.560
206 H GLY 27 H GLY 27 3.841 4.689 -9.067
207 HA2 GLY 27 HA2 GLY 27 3.223 6.879 -9.718
208 HA3 GLY 27 HA3 GLY 27 3.144 6.381 -11.412
209 H GLU 28 H GLU 28 1.707 3.837 -9.911
210 HA GLU 28 HA GLU 28 -0.962 4.651 -10.645
211 HB2 GLU 28 HB2 GLU 28 0.129 2.229 -10.568
212 HB3 GLU 28 HB3 GLU 28 -0.271 2.255 -8.865
213 HG2 GLU 28 HG2 GLU 28 -2.700 2.997 -9.822
214 HG3 GLU 28 HG3 GLU 28 -2.082 2.344 -11.321
215 H GLU 29 H GLU 29 -2.756 4.703 -9.095
216 HA GLU 29 HA GLU 29 -2.061 5.504 -6.325
217 HB2 GLU 29 HB2 GLU 29 -4.057 6.716 -8.276
218 HB3 GLU 29 HB3 GLU 29 -4.141 6.952 -6.525
219 HG2 GLU 29 HG2 GLU 29 -1.785 7.844 -6.570
220 HG3 GLU 29 HG3 GLU 29 -1.847 7.770 -8.344
221 H LEU 30 H LEU 30 -3.622 4.938 -4.806
222 HA LEU 30 HA LEU 30 -5.780 3.071 -5.464
223 HB2 LEU 30 HB2 LEU 30 -4.792 1.676 -3.446
224 HB3 LEU 30 HB3 LEU 30 -4.134 1.379 -5.089
225 HG LEU 30 HG LEU 30 -2.717 3.440 -3.475
226 HD11 LEU 30 HD11 LEU 30 -2.606 0.538 -2.577
227 HD12 LEU 30 HD12 LEU 30 -3.227 1.907 -1.657
228 HD13 LEU 30 HD13 LEU 30 -1.506 1.820 -2.075
229 HD21 LEU 30 HD21 LEU 30 -0.719 2.333 -4.360
230 HD22 LEU 30 HD22 LEU 30 -1.873 2.624 -5.670
231 HD23 LEU 30 HD23 LEU 30 -1.716 1.007 -5.002
232 H MET 31 H MET 31 -6.963 2.616 -3.269
233 HA MET 31 HA MET 31 -6.726 5.001 -1.502
234 HB2 MET 31 HB2 MET 31 -9.451 3.750 -1.850
235 HB3 MET 31 HB3 MET 31 -8.920 5.275 -1.201
236 HG2 MET 31 HG2 MET 31 -8.033 5.776 -3.573
237 HG3 MET 31 HG3 MET 31 -9.056 4.453 -4.112
238 HE1 MET 31 HE1 MET 31 -10.481 8.458 -2.249
239 HE2 MET 31 HE2 MET 31 -9.867 7.177 -1.219
240 HE3 MET 31 HE3 MET 31 -8.792 7.940 -2.414
241 H LYS 32 H LYS 32 -5.901 4.329 0.340
242 HA LYS 32 HA LYS 32 -5.914 1.562 1.199
243 HB2 LYS 32 HB2 LYS 32 -4.258 3.180 1.897
244 HB3 LYS 32 HB3 LYS 32 -5.502 4.211 2.618
245 HG2 LYS 32 HG2 LYS 32 -5.937 1.778 3.965
246 HG3 LYS 32 HG3 LYS 32 -4.190 1.834 3.775
247 HD2 LYS 32 HD2 LYS 32 -4.242 3.037 5.677
248 HD3 LYS 32 HD3 LYS 32 -4.642 4.404 4.677
249 HE2 LYS 32 HE2 LYS 32 -7.065 4.029 5.160
250 HE3 LYS 32 HE3 LYS 32 -6.657 2.525 5.991
251 HZ1 LYS 32 HZ1 LYS 32 -5.290 3.953 7.529
252 HZ2 LYS 32 HZ2 LYS 32 -6.915 4.050 7.682
253 HZ3 LYS 32 HZ3 LYS 32 -6.054 5.259 6.945
254 H ILE 33 H ILE 33 -7.540 0.465 2.456
255 HA ILE 33 HA ILE 33 -9.772 2.198 3.322
256 HB ILE 33 HB ILE 33 -11.282 0.563 2.938
257 HG12 ILE 33 HG12 ILE 33 -9.458 -1.339 1.488
258 HG13 ILE 33 HG13 ILE 33 -9.657 -1.466 3.228
259 HG21 ILE 33 HG21 ILE 33 -9.701 0.872 0.364
260 HG22 ILE 33 HG22 ILE 33 -11.442 0.654 0.520
261 HG23 ILE 33 HG23 ILE 33 -10.680 2.142 1.087
262 HD11 ILE 33 HD11 ILE 33 -12.080 -1.749 2.955
263 HD12 ILE 33 HD12 ILE 33 -11.914 -1.586 1.192
264 HD13 ILE 33 HD13 ILE 33 -11.173 -2.961 2.029
265 H SER 34 H SER 34 -7.430 -0.073 4.592
266 HA SER 34 HA SER 34 -8.939 0.023 7.166
267 HB2 SER 34 HB2 SER 34 -7.413 -2.341 6.051
268 HB3 SER 34 HB3 SER 34 -8.302 -2.272 7.581
269 HG SER 34 HG SER 34 -9.287 -3.398 5.910
270 H GLU 35 H GLU 35 -7.513 -0.690 8.981
271 HA GLU 35 HA GLU 35 -5.174 0.956 9.164
272 HB2 GLU 35 HB2 GLU 35 -5.082 0.044 11.445
273 HB3 GLU 35 HB3 GLU 35 -6.593 0.823 11.007
274 HG2 GLU 35 HG2 GLU 35 -6.466 -2.187 10.717
275 HG3 GLU 35 HG3 GLU 35 -6.487 -1.515 12.342
276 H GLU 36 H GLU 36 -3.030 0.346 9.477
277 HA GLU 36 HA GLU 36 -2.047 -1.764 7.949
278 HB2 GLU 36 HB2 GLU 36 -1.095 0.545 8.428
279 HB3 GLU 36 HB3 GLU 36 -0.644 -0.048 10.025
280 HG2 GLU 36 HG2 GLU 36 0.750 -1.828 8.854
281 HG3 GLU 36 HG3 GLU 36 0.367 -1.044 7.321
282 H ASP 37 H ASP 37 -1.074 -3.722 8.443
283 HA ASP 37 HA ASP 37 -1.566 -4.883 11.126
284 HB2 ASP 37 HB2 ASP 37 -0.226 -6.108 8.684
285 HB3 ASP 37 HB3 ASP 37 -0.665 -6.969 10.139
286 H GLU 38 H GLU 38 0.379 -6.294 11.976
287 HA GLU 38 HA GLU 38 2.564 -4.666 12.622
288 HB2 GLU 38 HB2 GLU 38 3.471 -6.656 13.697
289 HB3 GLU 38 HB3 GLU 38 1.731 -6.498 13.984
290 HG2 GLU 38 HG2 GLU 38 1.334 -8.184 12.163
291 HG3 GLU 38 HG3 GLU 38 3.076 -8.404 12.012
292 H GLN 39 H GLN 39 2.107 -6.351 9.724
293 HA GLN 39 HA GLN 39 5.002 -6.546 9.011
294 HB2 GLN 39 HB2 GLN 39 2.417 -7.836 8.118
295 HB3 GLN 39 HB3 GLN 39 3.627 -7.610 6.899
296 HG2 GLN 39 HG2 GLN 39 3.963 -9.394 9.330
297 HG3 GLN 39 HG3 GLN 39 3.705 -9.825 7.685
298 HE21 GLN 39 HE21 GLN 39 6.177 -8.349 9.875
299 HE22 GLN 39 HE22 GLN 39 7.493 -8.520 8.762
300 H GLY 40 H GLY 40 2.876 -4.066 9.047
301 HA2 GLY 40 HA2 GLY 40 2.888 -2.086 7.860
302 HA3 GLY 40 HA3 GLY 40 4.121 -2.752 6.796
303 H TRP 41 H TRP 41 1.517 -4.891 7.000
304 HA TRP 41 HA TRP 41 0.741 -4.535 4.242
305 HB2 TRP 41 HB2 TRP 41 -0.061 -6.275 6.589
306 HB3 TRP 41 HB3 TRP 41 -1.167 -6.158 5.246
307 HD1 TRP 41 HD1 TRP 41 1.088 -8.543 6.343
308 HE1 TRP 41 HE1 TRP 41 1.774 -10.024 4.397
309 HE3 TRP 41 HE3 TRP 41 -0.262 -5.594 2.441
310 HZ2 TRP 41 HZ2 TRP 41 2.472 -9.689 1.697
311 HZ3 TRP 41 HZ3 TRP 41 0.264 -6.296 0.134
312 HH2 TRP 41 HH2 TRP 41 1.661 -8.230 -0.312
313 H CYS 42 H CYS 42 -1.246 -3.749 3.413
314 HA CYS 42 HA CYS 42 -3.177 -2.618 5.338
315 HB2 CYS 42 HB2 CYS 42 -1.632 -1.069 3.231
316 HB3 CYS 42 HB3 CYS 42 -3.265 -0.584 3.713
317 HG CYS 42 HG CYS 42 -0.769 -1.174 5.784
318 H LYS 43 H LYS 43 -5.237 -2.683 4.526
319 HA LYS 43 HA LYS 43 -5.542 -4.028 1.890
320 HB2 LYS 43 HB2 LYS 43 -6.826 -4.323 4.443
321 HB3 LYS 43 HB3 LYS 43 -8.041 -3.697 3.344
322 HG2 LYS 43 HG2 LYS 43 -6.329 -5.953 2.266
323 HG3 LYS 43 HG3 LYS 43 -7.348 -6.328 3.644
324 HD2 LYS 43 HD2 LYS 43 -9.321 -5.418 2.401
325 HD3 LYS 43 HD3 LYS 43 -8.288 -5.290 0.955
326 HE2 LYS 43 HE2 LYS 43 -7.718 -7.714 1.148
327 HE3 LYS 43 HE3 LYS 43 -8.553 -7.787 2.687
328 HZ1 LYS 43 HZ1 LYS 43 -10.637 -7.099 1.353
329 HZ2 LYS 43 HZ2 LYS 43 -10.106 -8.647 1.276
330 HZ3 LYS 43 HZ3 LYS 43 -9.803 -7.694 0.039
331 H GLY 44 H GLY 44 -6.608 -2.995 0.217
332 HA2 GLY 44 HA2 GLY 44 -7.817 -0.356 0.684
333 HA3 GLY 44 HA3 GLY 44 -6.372 -0.353 -0.275
334 H ARG 45 H ARG 45 -8.214 0.557 -1.688
335 HA ARG 45 HA ARG 45 -9.277 -1.612 -3.379
336 HB2 ARG 45 HB2 ARG 45 -11.195 -0.821 -2.084
337 HB3 ARG 45 HB3 ARG 45 -10.780 0.863 -2.378
338 HG2 ARG 45 HG2 ARG 45 -11.457 0.821 -4.605
339 HG3 ARG 45 HG3 ARG 45 -11.338 -0.931 -4.754
340 HD2 ARG 45 HD2 ARG 45 -13.308 0.119 -2.772
341 HD3 ARG 45 HD3 ARG 45 -13.682 0.400 -4.482
342 HE ARG 45 HE ARG 45 -13.047 -2.195 -4.567
343 HH11 ARG 45 HH11 ARG 45 -15.272 -0.545 -2.362
344 HH12 ARG 45 HH12 ARG 45 -16.463 -1.799 -2.394
345 HH21 ARG 45 HH21 ARG 45 -14.406 -3.976 -4.401
346 HH22 ARG 45 HH22 ARG 45 -15.834 -3.914 -3.482
347 H LEU 46 H LEU 46 -8.931 -1.308 -5.436
348 HA LEU 46 HA LEU 46 -7.187 0.872 -6.352
349 HB2 LEU 46 HB2 LEU 46 -8.274 -1.754 -7.442
350 HB3 LEU 46 HB3 LEU 46 -7.719 -0.535 -8.599
351 HG LEU 46 HG LEU 46 -5.562 -0.470 -7.667
352 HD11 LEU 46 HD11 LEU 46 -6.732 -2.274 -5.528
353 HD12 LEU 46 HD12 LEU 46 -5.789 -0.772 -5.332
354 HD13 LEU 46 HD13 LEU 46 -4.999 -2.254 -5.862
355 HD21 LEU 46 HD21 LEU 46 -6.488 -3.356 -8.041
356 HD22 LEU 46 HD22 LEU 46 -4.831 -2.770 -8.211
357 HD23 LEU 46 HD23 LEU 46 -6.067 -2.225 -9.342
358 H LEU 47 H LEU 47 -7.734 2.029 -8.385
359 HA LEU 47 HA LEU 47 -10.226 3.398 -8.168
360 HB2 LEU 47 HB2 LEU 47 -8.171 3.190 -10.408
361 HB3 LEU 47 HB3 LEU 47 -9.656 4.089 -10.623
362 HG LEU 47 HG LEU 47 -7.773 5.530 -10.035
363 HD11 LEU 47 HD11 LEU 47 -10.101 6.193 -9.457
364 HD12 LEU 47 HD12 LEU 47 -8.899 6.897 -8.375
365 HD13 LEU 47 HD13 LEU 47 -9.875 5.528 -7.825
366 HD21 LEU 47 HD21 LEU 47 -6.555 3.966 -8.550
367 HD22 LEU 47 HD22 LEU 47 -7.738 4.306 -7.263
368 HD23 LEU 47 HD23 LEU 47 -6.715 5.600 -7.907
369 H THR 48 H THR 48 -9.301 0.528 -9.932
370 HA THR 48 HA THR 48 -11.676 0.241 -11.518
371 HB THR 48 HB THR 48 -9.183 -0.527 -11.786
372 HG1 THR 48 HG1 THR 48 -9.824 -2.239 -13.099
373 HG21 THR 48 HG21 THR 48 -8.515 -2.628 -11.007
374 HG22 THR 48 HG22 THR 48 -10.164 -3.118 -10.590
375 HG23 THR 48 HG23 THR 48 -9.300 -1.914 -9.611
376 H GLY 49 H GLY 49 -11.478 0.059 -8.209
377 HA2 GLY 49 HA2 GLY 49 -13.004 -0.709 -6.718
378 HA3 GLY 49 HA3 GLY 49 -13.823 -1.617 -7.990
379 H HIS 50 H HIS 50 -10.633 -2.693 -8.268
380 HA HIS 50 HA HIS 50 -11.261 -5.209 -7.034
381 HB2 HIS 50 HB2 HIS 50 -9.788 -4.891 -9.010
382 HB3 HIS 50 HB3 HIS 50 -8.606 -4.082 -7.988
383 HD1 HIS 50 HD1 HIS 50 -10.369 -7.593 -7.532
384 HD2 HIS 50 HD2 HIS 50 -6.621 -5.736 -8.047
385 HE1 HIS 50 HE1 HIS 50 -8.626 -9.403 -7.295
386 H VAL 51 H VAL 51 -10.275 -6.120 -5.038
387 HA VAL 51 HA VAL 51 -9.106 -4.156 -3.166
388 HB VAL 51 HB VAL 51 -10.538 -5.213 -1.369
389 HG11 VAL 51 HG11 VAL 51 -11.986 -3.652 -3.519
390 HG12 VAL 51 HG12 VAL 51 -12.488 -3.797 -1.814
391 HG13 VAL 51 HG13 VAL 51 -10.965 -2.989 -2.223
392 HG21 VAL 51 HG21 VAL 51 -11.349 -7.225 -2.617
393 HG22 VAL 51 HG22 VAL 51 -12.664 -6.260 -1.941
394 HG23 VAL 51 HG23 VAL 51 -12.298 -6.172 -3.675
395 H GLY 52 H GLY 52 -7.794 -5.062 -1.520
396 HA2 GLY 52 HA2 GLY 52 -7.383 -7.662 -0.839
397 HA3 GLY 52 HA3 GLY 52 -6.388 -7.467 -2.284
398 H LEU 53 H LEU 53 -4.763 -7.944 -0.458
399 HA LEU 53 HA LEU 53 -4.021 -5.781 1.376
400 HB2 LEU 53 HB2 LEU 53 -3.575 -8.625 1.060
401 HB3 LEU 53 HB3 LEU 53 -2.013 -7.858 0.927
402 HG LEU 53 HG LEU 53 -2.290 -6.798 3.121
403 HD11 LEU 53 HD11 LEU 53 -4.573 -6.580 3.526
404 HD12 LEU 53 HD12 LEU 53 -4.144 -7.961 4.541
405 HD13 LEU 53 HD13 LEU 53 -4.928 -8.229 2.958
406 HD21 LEU 53 HD21 LEU 53 -1.212 -9.073 2.707
407 HD22 LEU 53 HD22 LEU 53 -2.760 -9.820 3.111
408 HD23 LEU 53 HD23 LEU 53 -1.870 -8.876 4.329
409 H TYR 54 H TYR 54 -2.151 -4.403 1.056
410 HA TYR 54 HA TYR 54 -0.507 -4.731 -1.318
411 HB2 TYR 54 HB2 TYR 54 -0.651 -2.561 -2.103
412 HB3 TYR 54 HB3 TYR 54 -2.297 -3.041 -2.028
413 HD1 TYR 54 HD1 TYR 54 -3.759 -2.001 -0.142
414 HD2 TYR 54 HD2 TYR 54 0.343 -0.833 -0.803
415 HE1 TYR 54 HE1 TYR 54 -4.089 -0.002 1.300
416 HE2 TYR 54 HE2 TYR 54 0.016 1.129 0.595
417 HH TYR 54 HH TYR 54 -1.341 2.242 2.004
418 HA PRO 55 HA PRO 55 2.158 -3.872 2.116
419 HB2 PRO 55 HB2 PRO 55 4.580 -3.543 0.944
420 HB3 PRO 55 HB3 PRO 55 3.722 -5.111 0.986
421 HG2 PRO 55 HG2 PRO 55 3.835 -3.131 -1.299
422 HG3 PRO 55 HG3 PRO 55 3.990 -4.907 -1.330
423 HD2 PRO 55 HD2 PRO 55 1.635 -3.767 -1.979
424 HD3 PRO 55 HD3 PRO 55 1.812 -5.322 -1.152
425 H ALA 56 H ALA 56 1.650 -1.984 3.138
426 HA ALA 56 HA ALA 56 1.541 0.521 1.815
427 HB1 ALA 56 HB1 ALA 56 0.348 -0.271 3.922
428 HB2 ALA 56 HB2 ALA 56 1.807 0.155 4.815
429 HB3 ALA 56 HB3 ALA 56 0.913 1.393 3.908
430 H ASN 57 H ASN 57 4.179 -1.144 3.293
431 HA ASN 57 HA ASN 57 5.874 1.068 3.812
432 HB2 ASN 57 HB2 ASN 57 6.988 -1.589 2.863
433 HB3 ASN 57 HB3 ASN 57 7.652 -0.474 4.043
434 HD21 ASN 57 HD21 ASN 57 6.518 -3.473 3.935
435 HD22 ASN 57 HD22 ASN 57 5.624 -3.563 5.437
436 H TYR 58 H TYR 58 4.993 -0.464 0.782
437 HA TYR 58 HA TYR 58 7.242 0.710 -0.705
438 HB2 TYR 58 HB2 TYR 58 5.032 -1.228 -1.409
439 HB3 TYR 58 HB3 TYR 58 6.112 -0.559 -2.610
440 HD1 TYR 58 HD1 TYR 58 6.407 -2.279 0.753
441 HD2 TYR 58 HD2 TYR 58 7.723 -2.104 -3.330
442 HE1 TYR 58 HE1 TYR 58 8.070 -4.014 1.233
443 HE2 TYR 58 HE2 TYR 58 9.423 -3.853 -2.849
444 HH TYR 58 HH TYR 58 10.350 -5.295 -1.187
445 H VAL 59 H VAL 59 4.521 2.093 0.518
446 HA VAL 59 HA VAL 59 4.224 3.825 -1.844
447 HB VAL 59 HB VAL 59 1.927 3.847 -1.811
448 HG11 VAL 59 HG11 VAL 59 2.309 0.984 -0.899
449 HG12 VAL 59 HG12 VAL 59 1.029 1.639 -1.941
450 HG13 VAL 59 HG13 VAL 59 2.694 1.568 -2.524
451 HG21 VAL 59 HG21 VAL 59 1.524 4.353 0.542
452 HG22 VAL 59 HG22 VAL 59 0.413 3.155 -0.087
453 HG23 VAL 59 HG23 VAL 59 1.773 2.653 0.954
454 H GLU 60 H GLU 60 3.123 5.950 -1.160
455 HA GLU 60 HA GLU 60 3.839 6.804 1.539
456 HB2 GLU 60 HB2 GLU 60 5.813 7.095 -0.086
457 HB3 GLU 60 HB3 GLU 60 4.819 8.309 -0.920
458 HG2 GLU 60 HG2 GLU 60 4.855 9.756 0.992
459 HG3 GLU 60 HG3 GLU 60 5.380 8.442 2.054
460 H LYS 61 H LYS 61 2.755 8.995 1.896
461 HA LYS 61 HA LYS 61 0.130 8.915 0.585
462 HB2 LYS 61 HB2 LYS 61 1.180 10.205 3.081
463 HB3 LYS 61 HB3 LYS 61 -0.233 10.938 2.276
464 HG2 LYS 61 HG2 LYS 61 -1.437 8.921 2.246
465 HG3 LYS 61 HG3 LYS 61 -0.023 7.956 2.688
466 HD2 LYS 61 HD2 LYS 61 -0.159 9.048 5.003
467 HD3 LYS 61 HD3 LYS 61 -1.735 9.700 4.463
468 HE2 LYS 61 HE2 LYS 61 -2.359 7.669 5.429
469 HE3 LYS 61 HE3 LYS 61 -2.248 7.310 3.682
470 HZ1 LYS 61 HZ1 LYS 61 -0.192 6.672 5.738
471 HZ2 LYS 61 HZ2 LYS 61 0.011 6.409 4.162
472 HZ3 LYS 61 HZ3 LYS 61 -1.158 5.579 4.981
473 H VAL 62 H VAL 62 -0.957 10.818 -0.218
474 HA VAL 62 HA VAL 62 0.844 12.716 -1.530
475 HB VAL 62 HB VAL 62 0.716 10.690 -2.920
476 HG11 VAL 62 HG11 VAL 62 -1.367 9.925 -3.967
477 HG12 VAL 62 HG12 VAL 62 -1.435 9.781 -2.208
478 HG13 VAL 62 HG13 VAL 62 -2.291 11.105 -3.017
479 HG21 VAL 62 HG21 VAL 62 0.871 12.906 -4.049
480 HG22 VAL 62 HG22 VAL 62 0.197 11.596 -5.021
481 HG23 VAL 62 HG23 VAL 62 -0.891 12.816 -4.359
482 H GLY 63 H GLY 63 -0.711 14.265 -2.892
483 HA2 GLY 63 HA2 GLY 63 -2.558 15.630 -3.006
484 HA3 GLY 63 HA3 GLY 63 -3.367 14.670 -1.761
485 H LEU 64 H LEU 64 -3.063 15.243 0.446
486 HA LEU 64 HA LEU 64 -2.319 17.999 0.865
487 HB2 LEU 64 HB2 LEU 64 -3.133 15.758 2.750
488 HB3 LEU 64 HB3 LEU 64 -2.644 17.331 3.369
489 HG LEU 64 HG LEU 64 -4.929 16.919 1.398
490 HD11 LEU 64 HD11 LEU 64 -5.543 15.964 3.511
491 HD12 LEU 64 HD12 LEU 64 -6.343 17.524 3.390
492 HD13 LEU 64 HD13 LEU 64 -4.897 17.360 4.403
493 HD21 LEU 64 HD21 LEU 64 -4.063 19.403 2.965
494 HD22 LEU 64 HD22 LEU 64 -5.521 19.251 1.958
495 HD23 LEU 64 HD23 LEU 64 -3.952 19.201 1.202
496 H ALA 65 H ALA 65 -0.869 18.624 2.772
497 HA ALA 65 HA ALA 65 1.695 17.164 2.713
498 HB1 ALA 65 HB1 ALA 65 1.719 19.004 1.027
499 HB2 ALA 65 HB2 ALA 65 1.212 20.153 2.287
500 HB3 ALA 65 HB3 ALA 65 2.803 19.364 2.377
501 H ALA 66 H ALA 66 3.160 18.320 4.363
502 HA ALA 66 HA ALA 66 3.692 18.512 6.554
503 HB1 ALA 66 HB1 ALA 66 1.347 20.447 6.622
504 HB2 ALA 66 HB2 ALA 66 2.739 20.420 7.724
505 HB3 ALA 66 HB3 ALA 66 2.973 20.823 6.016
506 H ALA 67 H ALA 67 2.219 16.287 6.004
507 HA ALA 67 HA ALA 67 -0.030 15.668 7.478
508 HB1 ALA 67 HB1 ALA 67 0.741 13.317 7.233
509 HB2 ALA 67 HB2 ALA 67 1.033 14.218 5.725
510 HB3 ALA 67 HB3 ALA 67 2.368 13.889 6.847
511 H1 THR 101 H THR 101 -2.686 -11.388 11.103
512 HA THR 101 HA THR 101 -2.212 -9.762 8.708
513 HB THR 101 HB THR 101 -0.026 -11.516 9.803
514 HG1 THR 101 HG1 THR 101 0.151 -10.223 11.429
515 HG21 THR 101 HG21 THR 101 1.344 -9.891 8.571
516 HG22 THR 101 HG22 THR 101 -0.105 -8.910 8.208
517 HG23 THR 101 HG23 THR 101 0.083 -10.524 7.501
518 H LYS 102 H LYS 102 -2.456 -10.899 6.795
519 HA LYS 102 HA LYS 102 -3.496 -13.630 6.875
520 HB2 LYS 102 HB2 LYS 102 -2.812 -11.625 4.689
521 HB3 LYS 102 HB3 LYS 102 -3.246 -13.287 4.279
522 HG2 LYS 102 HG2 LYS 102 -5.010 -11.673 6.143
523 HG3 LYS 102 HG3 LYS 102 -5.107 -11.459 4.400
524 HD2 LYS 102 HD2 LYS 102 -5.761 -13.724 4.004
525 HD3 LYS 102 HD3 LYS 102 -5.299 -14.230 5.635
526 HE2 LYS 102 HE2 LYS 102 -7.735 -14.043 5.463
527 HE3 LYS 102 HE3 LYS 102 -7.070 -12.909 6.640
528 HZ1 LYS 102 HZ1 LYS 102 -8.656 -11.784 5.366
529 HZ2 LYS 102 HZ2 LYS 102 -8.025 -12.284 3.929
530 HZ3 LYS 102 HZ3 LYS 102 -7.214 -11.199 4.847
531 H GLY 103 H GLY 103 -0.695 -12.287 5.054
532 HA2 GLY 103 HA2 GLY 103 0.954 -14.592 5.863
533 HA3 GLY 103 HA3 GLY 103 0.787 -14.135 4.150
534 HA PRO 104 HA PRO 104 4.042 -11.517 6.450
535 HB2 PRO 104 HB2 PRO 104 6.342 -12.465 5.316
536 HB3 PRO 104 HB3 PRO 104 5.601 -13.200 6.769
537 HG2 PRO 104 HG2 PRO 104 5.353 -14.105 3.887
538 HG3 PRO 104 HG3 PRO 104 5.705 -15.102 5.338
539 HD2 PRO 104 HD2 PRO 104 3.190 -14.897 4.293
540 HD3 PRO 104 HD3 PRO 104 3.466 -15.019 6.057
541 H ALA 105 H ALA 105 5.019 -9.792 5.489
542 HA ALA 105 HA ALA 105 4.124 -8.879 2.937
543 HB1 ALA 105 HB1 ALA 105 4.131 -7.396 4.817
544 HB2 ALA 105 HB2 ALA 105 5.823 -7.756 5.218
545 HB3 ALA 105 HB3 ALA 105 5.452 -6.812 3.800
546 HA PRO 106 HA PRO 106 7.716 -9.462 0.409
547 HB2 PRO 106 HB2 PRO 106 7.948 -6.955 -0.828
548 HB3 PRO 106 HB3 PRO 106 6.757 -8.242 -1.178
549 HG2 PRO 106 HG2 PRO 106 6.379 -5.773 0.478
550 HG3 PRO 106 HG3 PRO 106 5.309 -6.488 -0.779
551 HD2 PRO 106 HD2 PRO 106 4.866 -6.883 1.831
552 HD3 PRO 106 HD3 PRO 106 4.537 -8.134 0.626
553 H ASN 107 H ASN 107 7.587 -7.215 2.690
554 HA ASN 107 HA ASN 107 9.946 -5.712 2.769
555 HB2 ASN 107 HB2 ASN 107 7.969 -6.544 4.813
556 HB3 ASN 107 HB3 ASN 107 9.573 -6.327 5.476
557 HD21 ASN 107 HD21 ASN 107 8.526 -4.634 6.750
558 HD22 ASN 107 HD22 ASN 107 8.382 -3.054 6.055
559 HA PRO 108 HA PRO 108 11.730 -5.328 5.079
560 HB2 PRO 108 HB2 PRO 108 14.377 -4.923 4.362
561 HB3 PRO 108 HB3 PRO 108 13.808 -5.762 5.839
562 HG2 PRO 108 HG2 PRO 108 14.585 -6.994 3.181
563 HG3 PRO 108 HG3 PRO 108 15.129 -7.480 4.817
564 HD2 PRO 108 HD2 PRO 108 13.108 -8.801 3.655
565 HD3 PRO 108 HD3 PRO 108 12.938 -8.320 5.368
566 HA PRO 109 HA PRO 109 10.898 -2.768 1.705
567 HB2 PRO 109 HB2 PRO 109 11.903 -0.300 2.492
568 HB3 PRO 109 HB3 PRO 109 10.383 -1.037 3.094
569 HG2 PRO 109 HG2 PRO 109 13.142 -1.055 4.351
570 HG3 PRO 109 HG3 PRO 109 11.559 -0.738 5.139
571 HD2 PRO 109 HD2 PRO 109 12.755 -3.171 5.260
572 HD3 PRO 109 HD3 PRO 109 10.982 -3.024 5.099
573 HA PRO 110 HA PRO 110 14.335 -2.559 -1.031
574 HB2 PRO 110 HB2 PRO 110 13.495 -0.823 -2.975
575 HB3 PRO 110 HB3 PRO 110 12.755 -2.419 -2.674
576 HG2 PRO 110 HG2 PRO 110 11.789 0.266 -1.627
577 HG3 PRO 110 HG3 PRO 110 10.839 -0.982 -2.474
578 HD2 PRO 110 HD2 PRO 110 10.839 -0.868 0.215
579 HD3 PRO 110 HD3 PRO 110 10.897 -2.432 -0.628
580 H ILE 111 H ILE 111 13.396 0.924 -1.213
581 HA ILE 111 HA ILE 111 16.221 1.610 -0.659
582 HB ILE 111 HB ILE 111 14.099 3.453 -1.772
583 HG12 ILE 111 HG12 ILE 111 14.191 1.624 -3.348
584 HG13 ILE 111 HG13 ILE 111 14.937 3.064 -4.014
585 HG21 ILE 111 HG21 ILE 111 16.039 4.587 -0.844
586 HG22 ILE 111 HG22 ILE 111 17.133 3.577 -1.810
587 HG23 ILE 111 HG23 ILE 111 16.029 4.725 -2.605
588 HD11 ILE 111 HD11 ILE 111 16.114 1.060 -4.627
589 HD12 ILE 111 HD12 ILE 111 17.168 2.092 -3.640
590 HD13 ILE 111 HD13 ILE 111 16.410 0.638 -2.932
591 H LEU 112 H LEU 112 12.988 2.976 0.038
592 HA LEU 112 HA LEU 112 12.323 4.428 1.677
593 HB2 LEU 112 HB2 LEU 112 12.888 1.760 2.968
594 HB3 LEU 112 HB3 LEU 112 12.246 3.076 3.920
595 HG LEU 112 HG LEU 112 10.494 1.551 3.136
596 HD11 LEU 112 HD11 LEU 112 10.071 3.983 3.661
597 HD12 LEU 112 HD12 LEU 112 8.891 3.249 2.558
598 HD13 LEU 112 HD13 LEU 112 10.147 4.305 1.932
599 HD21 LEU 112 HD21 LEU 112 9.772 1.387 0.845
600 HD22 LEU 112 HD22 LEU 112 11.529 1.137 0.811
601 HD23 LEU 112 HD23 LEU 112 10.843 2.693 0.349
602 H LYS 113 H LYS 113 14.028 5.945 1.406
603 HA LYS 113 HA LYS 113 16.257 5.920 3.316
604 HB2 LYS 113 HB2 LYS 113 16.649 6.816 1.085
605 HB3 LYS 113 HB3 LYS 113 15.271 7.908 1.259
606 HG2 LYS 113 HG2 LYS 113 16.533 8.986 3.239
607 HG3 LYS 113 HG3 LYS 113 17.910 7.967 2.803
608 HD2 LYS 113 HD2 LYS 113 18.215 10.173 1.866
609 HD3 LYS 113 HD3 LYS 113 17.907 9.037 0.548
610 HE2 LYS 113 HE2 LYS 113 15.383 9.778 0.860
611 HE3 LYS 113 HE3 LYS 113 16.057 11.136 1.769
612 HZ1 LYS 113 HZ1 LYS 113 16.731 10.363 -0.997
613 HZ2 LYS 113 HZ2 LYS 113 17.320 11.696 -0.226
614 HZ3 LYS 113 HZ3 LYS 113 15.710 11.589 -0.617
615 H VAL 114 H VAL 114 15.910 6.610 5.406
616 HA VAL 114 HA VAL 114 13.913 8.771 5.865
617 HB VAL 114 HB VAL 114 14.119 6.241 7.548
618 HG11 VAL 114 HG11 VAL 114 13.355 8.167 8.851
619 HG12 VAL 114 HG12 VAL 114 12.172 8.586 7.590
620 HG13 VAL 114 HG13 VAL 114 11.974 7.108 8.540
621 HG21 VAL 114 HG21 VAL 114 11.826 5.692 6.685
622 HG22 VAL 114 HG22 VAL 114 12.012 6.975 5.463
623 HG23 VAL 114 HG23 VAL 114 13.080 5.554 5.466
624 H TRP 115 H TRP 115 14.511 10.224 7.438
625 HA TRP 115 HA TRP 115 17.260 9.978 8.570
626 HB2 TRP 115 HB2 TRP 115 15.347 12.314 8.081
627 HB3 TRP 115 HB3 TRP 115 16.600 12.384 9.301
628 HD1 TRP 115 HD1 TRP 115 16.118 13.766 6.175
629 HE1 TRP 115 HE1 TRP 115 18.348 14.422 5.060
630 HE3 TRP 115 HE3 TRP 115 19.293 11.023 9.057
631 HZ2 TRP 115 HZ2 TRP 115 21.166 13.851 5.421
632 HZ3 TRP 115 HZ3 TRP 115 21.758 11.237 8.787
633 HH2 TRP 115 HH2 TRP 115 22.697 12.633 6.947
Start of MODEL 4
1 H1 MET 1 H MET 1 -17.064 3.327 5.599
2 HA MET 1 HA MET 1 -17.930 5.171 6.953
3 HB2 MET 1 HB2 MET 1 -18.059 3.001 9.034
4 HB3 MET 1 HB3 MET 1 -17.943 4.721 9.488
5 HG2 MET 1 HG2 MET 1 -19.886 5.224 8.179
6 HG3 MET 1 HG3 MET 1 -20.009 3.580 7.545
7 HE1 MET 1 HE1 MET 1 -21.101 1.608 8.681
8 HE2 MET 1 HE2 MET 1 -19.788 1.565 9.887
9 HE3 MET 1 HE3 MET 1 -21.487 1.524 10.411
10 H LYS 2 H LYS 2 -15.654 3.432 9.215
11 HA LYS 2 HA LYS 2 -13.711 5.504 8.798
12 HB2 LYS 2 HB2 LYS 2 -13.487 2.637 9.837
13 HB3 LYS 2 HB3 LYS 2 -12.129 3.761 9.793
14 HG2 LYS 2 HG2 LYS 2 -13.262 5.314 11.286
15 HG3 LYS 2 HG3 LYS 2 -14.702 4.273 11.343
16 HD2 LYS 2 HD2 LYS 2 -13.356 2.430 12.300
17 HD3 LYS 2 HD3 LYS 2 -11.887 3.427 12.165
18 HE2 LYS 2 HE2 LYS 2 -13.030 5.135 13.644
19 HE3 LYS 2 HE3 LYS 2 -14.320 3.956 13.929
20 HZ1 LYS 2 HZ1 LYS 2 -12.584 3.948 15.613
21 HZ2 LYS 2 HZ2 LYS 2 -11.443 3.573 14.494
22 HZ3 LYS 2 HZ3 LYS 2 -12.612 2.462 14.837
23 H VAL 3 H VAL 3 -11.761 5.409 7.662
24 HA VAL 3 HA VAL 3 -10.744 5.355 5.617
25 HB VAL 3 HB VAL 3 -10.438 2.425 6.365
26 HG11 VAL 3 HG11 VAL 3 -8.424 4.428 5.251
27 HG12 VAL 3 HG12 VAL 3 -8.217 2.678 5.452
28 HG13 VAL 3 HG13 VAL 3 -9.346 3.297 4.246
29 HG21 VAL 3 HG21 VAL 3 -8.535 3.140 7.807
30 HG22 VAL 3 HG22 VAL 3 -9.031 4.835 7.604
31 HG23 VAL 3 HG23 VAL 3 -10.088 3.676 8.439
32 HA PRO 4 HA PRO 4 -14.176 3.377 3.177
33 HB2 PRO 4 HB2 PRO 4 -15.369 5.506 2.026
34 HB3 PRO 4 HB3 PRO 4 -15.655 5.093 3.746
35 HG2 PRO 4 HG2 PRO 4 -13.711 7.156 2.626
36 HG3 PRO 4 HG3 PRO 4 -14.915 7.364 3.933
37 HD2 PRO 4 HD2 PRO 4 -12.270 6.754 4.417
38 HD3 PRO 4 HD3 PRO 4 -13.587 6.210 5.481
39 H GLY 5 H GLY 5 -11.497 5.464 2.303
40 HA2 GLY 5 HA2 GLY 5 -10.485 4.194 0.173
41 HA3 GLY 5 HA3 GLY 5 -11.717 5.256 -0.551
42 H VAL 6 H VAL 6 -8.721 5.162 1.307
43 HA VAL 6 HA VAL 6 -8.525 8.150 1.338
44 HB VAL 6 HB VAL 6 -6.880 6.059 2.832
45 HG11 VAL 6 HG11 VAL 6 -5.611 8.116 2.481
46 HG12 VAL 6 HG12 VAL 6 -6.975 9.088 3.074
47 HG13 VAL 6 HG13 VAL 6 -6.122 8.002 4.172
48 HG21 VAL 6 HG21 VAL 6 -9.141 7.803 3.854
49 HG22 VAL 6 HG22 VAL 6 -9.173 6.040 3.695
50 HG23 VAL 6 HG23 VAL 6 -8.077 6.809 4.857
51 H ARG 7 H ARG 7 -7.396 8.960 -0.411
52 HA ARG 7 HA ARG 7 -6.074 7.265 -2.226
53 HB2 ARG 7 HB2 ARG 7 -5.548 9.109 -3.499
54 HB3 ARG 7 HB3 ARG 7 -7.069 9.518 -2.738
55 HG2 ARG 7 HG2 ARG 7 -4.311 10.592 -2.012
56 HG3 ARG 7 HG3 ARG 7 -5.571 11.433 -2.864
57 HD2 ARG 7 HD2 ARG 7 -5.575 10.619 0.046
58 HD3 ARG 7 HD3 ARG 7 -5.506 12.252 -0.615
59 HE ARG 7 HE ARG 7 -7.840 11.566 -1.618
60 HH11 ARG 7 HH11 ARG 7 -6.523 11.580 1.650
61 HH12 ARG 7 HH12 ARG 7 -8.038 11.175 2.438
62 HH21 ARG 7 HH21 ARG 7 -9.933 11.175 -0.527
63 HH22 ARG 7 HH22 ARG 7 -9.991 11.168 1.194
64 H VAL 8 H VAL 8 -4.053 6.622 -2.566
65 HA VAL 8 HA VAL 8 -1.790 7.745 -1.097
66 HB VAL 8 HB VAL 8 -1.031 5.395 -0.604
67 HG11 VAL 8 HG11 VAL 8 -3.556 6.215 0.873
68 HG12 VAL 8 HG12 VAL 8 -2.244 5.167 1.476
69 HG13 VAL 8 HG13 VAL 8 -1.925 6.883 1.159
70 HG21 VAL 8 HG21 VAL 8 -2.630 3.583 -0.389
71 HG22 VAL 8 HG22 VAL 8 -3.962 4.614 -0.943
72 HG23 VAL 8 HG23 VAL 8 -2.663 4.175 -2.054
73 H ARG 9 H ARG 9 0.225 7.228 -2.278
74 HA ARG 9 HA ARG 9 -0.270 6.349 -5.078
75 HB2 ARG 9 HB2 ARG 9 -0.072 8.834 -4.862
76 HB3 ARG 9 HB3 ARG 9 1.570 8.620 -4.232
77 HG2 ARG 9 HG2 ARG 9 2.217 7.516 -6.368
78 HG3 ARG 9 HG3 ARG 9 0.540 7.604 -6.922
79 HD2 ARG 9 HD2 ARG 9 1.760 9.338 -7.997
80 HD3 ARG 9 HD3 ARG 9 0.654 10.093 -6.832
81 HE ARG 9 HE ARG 9 3.228 9.643 -5.647
82 HH11 ARG 9 HH11 ARG 9 1.866 11.723 -8.244
83 HH12 ARG 9 HH12 ARG 9 2.916 13.013 -7.837
84 HH21 ARG 9 HH21 ARG 9 4.631 11.470 -5.223
85 HH22 ARG 9 HH22 ARG 9 4.266 12.965 -6.024
86 H ALA 10 H ALA 10 1.140 4.922 -5.866
87 HA ALA 10 HA ALA 10 2.811 3.399 -4.146
88 HB1 ALA 10 HB1 ALA 10 2.631 3.587 -7.152
89 HB2 ALA 10 HB2 ALA 10 3.428 2.274 -6.254
90 HB3 ALA 10 HB3 ALA 10 1.672 2.512 -6.119
91 H LEU 11 H LEU 11 4.856 3.334 -3.760
92 HA LEU 11 HA LEU 11 6.638 5.559 -4.523
93 HB2 LEU 11 HB2 LEU 11 6.857 3.220 -2.572
94 HB3 LEU 11 HB3 LEU 11 8.097 4.438 -2.785
95 HG LEU 11 HG LEU 11 5.265 5.004 -1.806
96 HD11 LEU 11 HD11 LEU 11 7.874 4.795 -0.258
97 HD12 LEU 11 HD12 LEU 11 6.516 3.663 -0.185
98 HD13 LEU 11 HD13 LEU 11 6.316 5.313 0.407
99 HD21 LEU 11 HD21 LEU 11 7.700 6.794 -2.135
100 HD22 LEU 11 HD22 LEU 11 6.316 7.218 -1.131
101 HD23 LEU 11 HD23 LEU 11 6.116 6.978 -2.879
102 H TYR 12 H TYR 12 6.130 2.085 -5.101
103 HA TYR 12 HA TYR 12 8.254 2.070 -7.118
104 HB2 TYR 12 HB2 TYR 12 8.218 -0.299 -5.303
105 HB3 TYR 12 HB3 TYR 12 9.544 0.397 -6.206
106 HD1 TYR 12 HD1 TYR 12 7.723 0.303 -3.079
107 HD2 TYR 12 HD2 TYR 12 10.744 2.441 -5.203
108 HE1 TYR 12 HE1 TYR 12 8.577 1.192 -0.906
109 HE2 TYR 12 HE2 TYR 12 11.536 3.444 -3.042
110 HH TYR 12 HH TYR 12 11.520 3.117 -0.666
111 H ASP 13 H ASP 13 8.167 -0.137 -8.258
112 HA ASP 13 HA ASP 13 5.370 -0.776 -8.915
113 HB2 ASP 13 HB2 ASP 13 6.333 -1.872 -10.881
114 HB3 ASP 13 HB3 ASP 13 6.821 -0.187 -10.773
115 H TYR 14 H TYR 14 4.795 -2.049 -7.060
116 HA TYR 14 HA TYR 14 6.010 -4.781 -7.074
117 HB2 TYR 14 HB2 TYR 14 5.489 -2.937 -4.765
118 HB3 TYR 14 HB3 TYR 14 5.095 -4.637 -4.557
119 HD1 TYR 14 HD1 TYR 14 6.751 -6.105 -3.793
120 HD2 TYR 14 HD2 TYR 14 7.911 -2.571 -6.003
121 HE1 TYR 14 HE1 TYR 14 9.137 -6.769 -3.643
122 HE2 TYR 14 HE2 TYR 14 10.266 -3.237 -5.871
123 HH TYR 14 HH TYR 14 11.611 -5.141 -5.556
124 H THR 15 H THR 15 4.596 -6.488 -6.966
125 HA THR 15 HA THR 15 1.699 -5.769 -7.209
126 HB THR 15 HB THR 15 2.513 -6.317 -9.318
127 HG1 THR 15 HG1 THR 15 1.480 -8.709 -8.243
128 HG21 THR 15 HG21 THR 15 4.026 -8.725 -8.268
129 HG22 THR 15 HG22 THR 15 4.711 -7.242 -8.971
130 HG23 THR 15 HG23 THR 15 3.758 -8.323 -9.976
131 H GLY 16 H GLY 16 1.649 -5.958 -4.838
132 HA2 GLY 16 HA2 GLY 16 1.269 -7.111 -2.928
133 HA3 GLY 16 HA3 GLY 16 0.603 -8.392 -3.981
134 H GLN 17 H GLN 17 1.404 -9.951 -2.544
135 HA GLN 17 HA GLN 17 4.289 -10.529 -2.856
136 HB2 GLN 17 HB2 GLN 17 3.477 -9.644 -0.495
137 HB3 GLN 17 HB3 GLN 17 2.897 -11.287 -0.293
138 HG2 GLN 17 HG2 GLN 17 5.776 -10.495 -0.984
139 HG3 GLN 17 HG3 GLN 17 5.198 -10.831 0.644
140 HE21 GLN 17 HE21 GLN 17 7.001 -12.276 -1.759
141 HE22 GLN 17 HE22 GLN 17 6.576 -13.935 -1.388
142 H GLU 18 H GLU 18 0.897 -11.572 -2.880
143 HA GLU 18 HA GLU 18 1.651 -14.173 -3.945
144 HB2 GLU 18 HB2 GLU 18 -0.388 -13.832 -1.695
145 HB3 GLU 18 HB3 GLU 18 0.204 -15.324 -2.397
146 HG2 GLU 18 HG2 GLU 18 2.428 -14.932 -1.374
147 HG3 GLU 18 HG3 GLU 18 1.824 -13.434 -0.645
148 H ALA 19 H ALA 19 -0.633 -15.264 -4.519
149 HA ALA 19 HA ALA 19 -1.927 -13.534 -6.386
150 HB1 ALA 19 HB1 ALA 19 -2.873 -16.237 -5.328
151 HB2 ALA 19 HB2 ALA 19 -3.251 -15.499 -6.893
152 HB3 ALA 19 HB3 ALA 19 -1.600 -16.058 -6.545
153 H ASP 20 H ASP 20 -2.694 -14.338 -3.036
154 HA ASP 20 HA ASP 20 -5.503 -13.630 -3.242
155 HB2 ASP 20 HB2 ASP 20 -4.222 -15.295 -1.657
156 HB3 ASP 20 HB3 ASP 20 -3.964 -13.881 -0.661
157 H GLU 21 H GLU 21 -2.793 -11.721 -3.213
158 HA GLU 21 HA GLU 21 -3.917 -9.490 -1.620
159 HB2 GLU 21 HB2 GLU 21 -1.155 -9.407 -2.740
160 HB3 GLU 21 HB3 GLU 21 -1.773 -8.820 -1.208
161 HG2 GLU 21 HG2 GLU 21 -0.970 -11.648 -1.931
162 HG3 GLU 21 HG3 GLU 21 -0.129 -10.552 -0.860
163 H LEU 22 H LEU 22 -3.132 -7.349 -2.673
164 HA LEU 22 HA LEU 22 -4.425 -7.009 -5.282
165 HB2 LEU 22 HB2 LEU 22 -4.662 -5.616 -2.972
166 HB3 LEU 22 HB3 LEU 22 -3.217 -4.835 -3.529
167 HG LEU 22 HG LEU 22 -4.382 -3.980 -5.486
168 HD11 LEU 22 HD11 LEU 22 -7.030 -4.415 -5.422
169 HD12 LEU 22 HD12 LEU 22 -6.509 -5.935 -4.666
170 HD13 LEU 22 HD13 LEU 22 -5.909 -5.498 -6.253
171 HD21 LEU 22 HD21 LEU 22 -5.944 -3.591 -2.935
172 HD22 LEU 22 HD22 LEU 22 -6.073 -2.568 -4.379
173 HD23 LEU 22 HD23 LEU 22 -4.535 -2.670 -3.491
174 H SER 23 H SER 23 -3.243 -5.079 -6.657
175 HA SER 23 HA SER 23 -0.337 -5.123 -6.368
176 HB2 SER 23 HB2 SER 23 -0.191 -5.709 -8.881
177 HB3 SER 23 HB3 SER 23 -0.443 -7.006 -7.700
178 HG SER 23 HG SER 23 -2.572 -5.840 -9.171
179 H PHE 24 H PHE 24 0.672 -3.287 -7.514
180 HA PHE 24 HA PHE 24 -1.135 -1.436 -8.878
181 HB2 PHE 24 HB2 PHE 24 -0.406 0.410 -7.428
182 HB3 PHE 24 HB3 PHE 24 -1.506 -0.723 -6.682
183 HD1 PHE 24 HD1 PHE 24 2.152 0.132 -6.895
184 HD2 PHE 24 HD2 PHE 24 -1.025 -1.636 -4.519
185 HE1 PHE 24 HE1 PHE 24 3.613 0.161 -4.908
186 HE2 PHE 24 HE2 PHE 24 0.479 -1.495 -2.527
187 HZ PHE 24 HZ PHE 24 2.706 -0.584 -2.697
188 H LYS 25 H LYS 25 0.365 0.457 -9.687
189 HA LYS 25 HA LYS 25 3.086 -0.624 -10.274
190 HB2 LYS 25 HB2 LYS 25 0.961 0.446 -12.067
191 HB3 LYS 25 HB3 LYS 25 2.539 1.143 -12.358
192 HG2 LYS 25 HG2 LYS 25 2.025 -1.867 -12.241
193 HG3 LYS 25 HG3 LYS 25 2.060 -0.899 -13.721
194 HD2 LYS 25 HD2 LYS 25 4.395 -0.164 -13.160
195 HD3 LYS 25 HD3 LYS 25 4.392 -1.258 -11.791
196 HE2 LYS 25 HE2 LYS 25 4.017 -2.132 -14.678
197 HE3 LYS 25 HE3 LYS 25 5.564 -2.094 -13.823
198 HZ1 LYS 25 HZ1 LYS 25 4.396 -3.614 -12.147
199 HZ2 LYS 25 HZ2 LYS 25 4.872 -4.231 -13.603
200 HZ3 LYS 25 HZ3 LYS 25 3.297 -3.873 -13.349
201 H ALA 26 H ALA 26 4.705 1.035 -10.859
202 HA ALA 26 HA ALA 26 5.165 2.754 -8.709
203 HB1 ALA 26 HB1 ALA 26 6.991 1.935 -10.025
204 HB2 ALA 26 HB2 ALA 26 6.289 2.590 -11.525
205 HB3 ALA 26 HB3 ALA 26 6.954 3.673 -10.298
206 H GLY 27 H GLY 27 4.293 4.653 -8.158
207 HA2 GLY 27 HA2 GLY 27 3.571 6.811 -8.345
208 HA3 GLY 27 HA3 GLY 27 3.721 6.723 -10.100
209 H GLU 28 H GLU 28 1.800 4.041 -9.297
210 HA GLU 28 HA GLU 28 -0.562 5.318 -10.314
211 HB2 GLU 28 HB2 GLU 28 0.047 2.897 -10.618
212 HB3 GLU 28 HB3 GLU 28 -0.249 2.646 -8.872
213 HG2 GLU 28 HG2 GLU 28 -2.598 3.227 -9.156
214 HG3 GLU 28 HG3 GLU 28 -2.331 3.558 -10.868
215 H GLU 29 H GLU 29 -2.508 5.766 -9.195
216 HA GLU 29 HA GLU 29 -2.209 6.234 -6.270
217 HB2 GLU 29 HB2 GLU 29 -4.200 7.401 -8.260
218 HB3 GLU 29 HB3 GLU 29 -4.248 7.615 -6.508
219 HG2 GLU 29 HG2 GLU 29 -1.934 8.622 -6.626
220 HG3 GLU 29 HG3 GLU 29 -2.106 8.646 -8.384
221 H LEU 30 H LEU 30 -3.611 5.208 -4.890
222 HA LEU 30 HA LEU 30 -5.760 3.419 -5.897
223 HB2 LEU 30 HB2 LEU 30 -4.795 1.913 -3.941
224 HB3 LEU 30 HB3 LEU 30 -4.461 1.628 -5.632
225 HG LEU 30 HG LEU 30 -2.500 3.155 -3.908
226 HD11 LEU 30 HD11 LEU 30 -1.346 0.995 -3.541
227 HD12 LEU 30 HD12 LEU 30 -2.695 0.139 -4.336
228 HD13 LEU 30 HD13 LEU 30 -2.933 0.980 -2.798
229 HD21 LEU 30 HD21 LEU 30 -1.988 3.264 -6.289
230 HD22 LEU 30 HD22 LEU 30 -2.272 1.540 -6.487
231 HD23 LEU 30 HD23 LEU 30 -0.872 2.140 -5.555
232 H MET 31 H MET 31 -7.227 2.871 -3.943
233 HA MET 31 HA MET 31 -7.166 5.065 -1.931
234 HB2 MET 31 HB2 MET 31 -9.756 3.727 -2.698
235 HB3 MET 31 HB3 MET 31 -9.455 5.242 -1.909
236 HG2 MET 31 HG2 MET 31 -8.830 4.711 -4.828
237 HG3 MET 31 HG3 MET 31 -10.260 5.534 -4.225
238 HE1 MET 31 HE1 MET 31 -9.174 8.976 -3.126
239 HE2 MET 31 HE2 MET 31 -10.468 7.809 -3.438
240 HE3 MET 31 HE3 MET 31 -9.409 7.608 -2.017
241 H LYS 32 H LYS 32 -6.463 4.245 -0.087
242 HA LYS 32 HA LYS 32 -6.542 1.498 0.642
243 HB2 LYS 32 HB2 LYS 32 -4.940 3.147 1.473
244 HB3 LYS 32 HB3 LYS 32 -6.232 4.044 2.277
245 HG2 LYS 32 HG2 LYS 32 -6.745 2.024 3.673
246 HG3 LYS 32 HG3 LYS 32 -5.350 1.207 2.944
247 HD2 LYS 32 HD2 LYS 32 -4.431 2.085 4.919
248 HD3 LYS 32 HD3 LYS 32 -3.957 3.273 3.703
249 HE2 LYS 32 HE2 LYS 32 -6.184 4.499 4.395
250 HE3 LYS 32 HE3 LYS 32 -6.141 3.426 5.808
251 HZ1 LYS 32 HZ1 LYS 32 -4.147 5.451 5.021
252 HZ2 LYS 32 HZ2 LYS 32 -3.840 4.315 6.151
253 HZ3 LYS 32 HZ3 LYS 32 -5.055 5.422 6.396
254 H ILE 33 H ILE 33 -7.986 0.294 2.002
255 HA ILE 33 HA ILE 33 -10.369 1.762 2.850
256 HB ILE 33 HB ILE 33 -11.791 0.080 2.322
257 HG12 ILE 33 HG12 ILE 33 -9.512 -1.620 1.251
258 HG13 ILE 33 HG13 ILE 33 -10.386 -1.916 2.735
259 HG21 ILE 33 HG21 ILE 33 -11.171 1.735 0.567
260 HG22 ILE 33 HG22 ILE 33 -10.060 0.543 -0.135
261 HG23 ILE 33 HG23 ILE 33 -11.795 0.224 -0.092
262 HD11 ILE 33 HD11 ILE 33 -12.502 -2.109 1.363
263 HD12 ILE 33 HD12 ILE 33 -11.495 -2.025 -0.088
264 HD13 ILE 33 HD13 ILE 33 -11.274 -3.359 1.061
265 H SER 34 H SER 34 -7.767 0.075 4.146
266 HA SER 34 HA SER 34 -9.229 -0.346 6.668
267 HB2 SER 34 HB2 SER 34 -7.448 -2.371 5.272
268 HB3 SER 34 HB3 SER 34 -7.911 -2.472 6.970
269 HG SER 34 HG SER 34 -9.257 -3.757 5.843
270 H GLU 35 H GLU 35 -7.409 -0.837 8.416
271 HA GLU 35 HA GLU 35 -5.562 1.421 8.230
272 HB2 GLU 35 HB2 GLU 35 -5.325 1.231 10.539
273 HB3 GLU 35 HB3 GLU 35 -7.000 0.788 10.238
274 HG2 GLU 35 HG2 GLU 35 -5.957 -1.697 10.168
275 HG3 GLU 35 HG3 GLU 35 -4.667 -0.934 11.103
276 H GLU 36 H GLU 36 -3.268 0.993 9.254
277 HA GLU 36 HA GLU 36 -2.001 -1.007 7.550
278 HB2 GLU 36 HB2 GLU 36 -1.368 1.449 7.982
279 HB3 GLU 36 HB3 GLU 36 -0.681 0.918 9.511
280 HG2 GLU 36 HG2 GLU 36 0.994 -0.353 8.447
281 HG3 GLU 36 HG3 GLU 36 0.108 -0.489 6.927
282 H ASP 37 H ASP 37 -1.753 -2.994 8.228
283 HA ASP 37 HA ASP 37 -2.101 -3.704 11.049
284 HB2 ASP 37 HB2 ASP 37 -3.173 -4.817 9.058
285 HB3 ASP 37 HB3 ASP 37 -1.622 -5.520 8.676
286 H GLU 38 H GLU 38 -0.443 -5.610 11.698
287 HA GLU 38 HA GLU 38 1.905 -4.398 12.426
288 HB2 GLU 38 HB2 GLU 38 0.551 -6.651 13.123
289 HB3 GLU 38 HB3 GLU 38 1.863 -7.398 12.218
290 HG2 GLU 38 HG2 GLU 38 2.513 -7.313 14.507
291 HG3 GLU 38 HG3 GLU 38 3.485 -6.106 13.683
292 H GLN 39 H GLN 39 1.538 -6.264 9.445
293 HA GLN 39 HA GLN 39 4.461 -6.033 8.956
294 HB2 GLN 39 HB2 GLN 39 2.289 -7.875 7.986
295 HB3 GLN 39 HB3 GLN 39 3.507 -7.462 6.829
296 HG2 GLN 39 HG2 GLN 39 3.864 -8.999 9.387
297 HG3 GLN 39 HG3 GLN 39 4.210 -9.469 7.745
298 HE21 GLN 39 HE21 GLN 39 5.432 -7.590 10.497
299 HE22 GLN 39 HE22 GLN 39 7.036 -7.322 9.868
300 H GLY 40 H GLY 40 2.280 -3.829 8.793
301 HA2 GLY 40 HA2 GLY 40 2.170 -1.919 7.512
302 HA3 GLY 40 HA3 GLY 40 3.512 -2.518 6.521
303 H TRP 41 H TRP 41 0.563 -4.391 7.155
304 HA TRP 41 HA TRP 41 0.058 -4.556 4.252
305 HB2 TRP 41 HB2 TRP 41 -0.584 -6.171 6.707
306 HB3 TRP 41 HB3 TRP 41 -1.766 -6.174 5.413
307 HD1 TRP 41 HD1 TRP 41 0.735 -8.343 6.461
308 HE1 TRP 41 HE1 TRP 41 1.543 -9.843 4.537
309 HE3 TRP 41 HE3 TRP 41 -0.953 -5.604 2.531
310 HZ2 TRP 41 HZ2 TRP 41 1.775 -9.659 1.688
311 HZ3 TRP 41 HZ3 TRP 41 -0.487 -6.357 0.208
312 HH2 TRP 41 HH2 TRP 41 0.808 -8.289 -0.255
313 H CYS 42 H CYS 42 -1.635 -3.440 3.315
314 HA CYS 42 HA CYS 42 -3.700 -2.256 5.128
315 HB2 CYS 42 HB2 CYS 42 -1.980 -0.956 3.006
316 HB3 CYS 42 HB3 CYS 42 -3.625 -0.376 3.325
317 HG CYS 42 HG CYS 42 -1.300 -0.783 5.596
318 H LYS 43 H LYS 43 -5.694 -2.896 4.411
319 HA LYS 43 HA LYS 43 -5.858 -4.111 1.707
320 HB2 LYS 43 HB2 LYS 43 -7.439 -4.236 4.153
321 HB3 LYS 43 HB3 LYS 43 -8.486 -3.768 2.812
322 HG2 LYS 43 HG2 LYS 43 -6.598 -6.028 2.226
323 HG3 LYS 43 HG3 LYS 43 -7.751 -6.315 3.526
324 HD2 LYS 43 HD2 LYS 43 -9.602 -5.720 1.941
325 HD3 LYS 43 HD3 LYS 43 -8.399 -5.484 0.668
326 HE2 LYS 43 HE2 LYS 43 -9.267 -7.747 0.467
327 HE3 LYS 43 HE3 LYS 43 -7.608 -7.882 1.050
328 HZ1 LYS 43 HZ1 LYS 43 -8.424 -8.363 3.225
329 HZ2 LYS 43 HZ2 LYS 43 -9.297 -9.278 2.186
330 HZ3 LYS 43 HZ3 LYS 43 -9.983 -7.948 2.812
331 H GLY 44 H GLY 44 -6.822 -3.118 -0.098
332 HA2 GLY 44 HA2 GLY 44 -8.093 -0.498 0.197
333 HA3 GLY 44 HA3 GLY 44 -6.535 -0.438 -0.542
334 H ARG 45 H ARG 45 -8.409 0.457 -2.047
335 HA ARG 45 HA ARG 45 -9.198 -1.650 -3.969
336 HB2 ARG 45 HB2 ARG 45 -11.116 -0.643 -2.708
337 HB3 ARG 45 HB3 ARG 45 -10.609 0.974 -3.202
338 HG2 ARG 45 HG2 ARG 45 -11.177 0.544 -5.510
339 HG3 ARG 45 HG3 ARG 45 -11.343 -1.186 -5.209
340 HD2 ARG 45 HD2 ARG 45 -13.533 -0.484 -5.351
341 HD3 ARG 45 HD3 ARG 45 -13.255 -0.582 -3.608
342 HE ARG 45 HE ARG 45 -12.723 2.086 -4.607
343 HH11 ARG 45 HH11 ARG 45 -15.340 -0.091 -3.675
344 HH12 ARG 45 HH12 ARG 45 -16.541 1.145 -3.591
345 HH21 ARG 45 HH21 ARG 45 -14.235 3.695 -4.444
346 HH22 ARG 45 HH22 ARG 45 -15.901 3.420 -3.992
347 H LEU 46 H LEU 46 -9.076 -0.981 -6.141
348 HA LEU 46 HA LEU 46 -7.019 1.170 -6.693
349 HB2 LEU 46 HB2 LEU 46 -7.826 -1.373 -8.133
350 HB3 LEU 46 HB3 LEU 46 -6.841 -0.143 -8.912
351 HG LEU 46 HG LEU 46 -5.900 -1.051 -6.216
352 HD11 LEU 46 HD11 LEU 46 -6.638 -3.123 -7.203
353 HD12 LEU 46 HD12 LEU 46 -4.862 -3.028 -7.315
354 HD13 LEU 46 HD13 LEU 46 -5.840 -2.719 -8.736
355 HD21 LEU 46 HD21 LEU 46 -3.715 -0.850 -7.290
356 HD22 LEU 46 HD22 LEU 46 -4.643 0.629 -7.606
357 HD23 LEU 46 HD23 LEU 46 -4.466 -0.595 -8.870
358 H LEU 47 H LEU 47 -7.363 2.247 -8.923
359 HA LEU 47 HA LEU 47 -9.859 3.604 -8.989
360 HB2 LEU 47 HB2 LEU 47 -7.550 3.263 -10.903
361 HB3 LEU 47 HB3 LEU 47 -9.022 3.967 -11.522
362 HG LEU 47 HG LEU 47 -7.229 5.564 -10.808
363 HD11 LEU 47 HD11 LEU 47 -8.780 7.189 -9.861
364 HD12 LEU 47 HD12 LEU 47 -9.937 5.906 -9.448
365 HD13 LEU 47 HD13 LEU 47 -9.559 6.266 -11.148
366 HD21 LEU 47 HD21 LEU 47 -6.670 4.366 -8.653
367 HD22 LEU 47 HD22 LEU 47 -8.115 5.106 -7.946
368 HD23 LEU 47 HD23 LEU 47 -6.782 6.114 -8.588
369 H THR 48 H THR 48 -8.740 0.714 -10.631
370 HA THR 48 HA THR 48 -10.972 0.358 -12.368
371 HB THR 48 HB THR 48 -8.651 -0.434 -12.747
372 HG1 THR 48 HG1 THR 48 -10.220 -1.435 -13.926
373 HG21 THR 48 HG21 THR 48 -9.249 -2.563 -10.650
374 HG22 THR 48 HG22 THR 48 -8.031 -1.264 -10.527
375 HG23 THR 48 HG23 THR 48 -7.858 -2.524 -11.744
376 H GLY 49 H GLY 49 -11.044 0.250 -9.050
377 HA2 GLY 49 HA2 GLY 49 -12.726 -0.344 -7.677
378 HA3 GLY 49 HA3 GLY 49 -13.516 -1.232 -8.978
379 H HIS 50 H HIS 50 -10.468 -2.566 -8.965
380 HA HIS 50 HA HIS 50 -11.360 -4.949 -7.626
381 HB2 HIS 50 HB2 HIS 50 -9.815 -4.939 -9.565
382 HB3 HIS 50 HB3 HIS 50 -8.592 -4.119 -8.581
383 HD1 HIS 50 HD1 HIS 50 -10.670 -7.350 -7.762
384 HD2 HIS 50 HD2 HIS 50 -6.776 -5.877 -8.312
385 HE1 HIS 50 HE1 HIS 50 -9.094 -9.257 -7.156
386 H VAL 51 H VAL 51 -10.522 -5.862 -5.565
387 HA VAL 51 HA VAL 51 -9.284 -3.872 -3.754
388 HB VAL 51 HB VAL 51 -11.591 -5.773 -3.139
389 HG11 VAL 51 HG11 VAL 51 -10.450 -3.493 -1.473
390 HG12 VAL 51 HG12 VAL 51 -11.856 -4.503 -1.053
391 HG13 VAL 51 HG13 VAL 51 -10.259 -5.220 -1.121
392 HG21 VAL 51 HG21 VAL 51 -11.704 -2.767 -3.549
393 HG22 VAL 51 HG22 VAL 51 -12.451 -4.005 -4.584
394 HG23 VAL 51 HG23 VAL 51 -13.029 -3.785 -2.943
395 H GLY 52 H GLY 52 -7.973 -4.703 -2.144
396 HA2 GLY 52 HA2 GLY 52 -7.711 -7.407 -1.357
397 HA3 GLY 52 HA3 GLY 52 -6.578 -7.138 -2.683
398 H LEU 53 H LEU 53 -5.275 -7.838 -0.558
399 HA LEU 53 HA LEU 53 -4.552 -5.636 1.244
400 HB2 LEU 53 HB2 LEU 53 -3.635 -8.487 0.759
401 HB3 LEU 53 HB3 LEU 53 -2.627 -7.457 1.734
402 HG LEU 53 HG LEU 53 -5.563 -7.960 2.362
403 HD11 LEU 53 HD11 LEU 53 -4.868 -9.499 4.050
404 HD12 LEU 53 HD12 LEU 53 -3.149 -9.181 3.731
405 HD13 LEU 53 HD13 LEU 53 -4.138 -10.030 2.529
406 HD21 LEU 53 HD21 LEU 53 -3.287 -6.797 4.023
407 HD22 LEU 53 HD22 LEU 53 -4.953 -7.052 4.578
408 HD23 LEU 53 HD23 LEU 53 -4.610 -5.841 3.350
409 H TYR 54 H TYR 54 -2.820 -4.221 0.920
410 HA TYR 54 HA TYR 54 -1.044 -4.779 -1.361
411 HB2 TYR 54 HB2 TYR 54 -1.210 -2.654 -2.233
412 HB3 TYR 54 HB3 TYR 54 -2.843 -3.146 -1.999
413 HD1 TYR 54 HD1 TYR 54 -4.350 -1.804 -0.707
414 HD2 TYR 54 HD2 TYR 54 -0.099 -1.113 -0.414
415 HE1 TYR 54 HE1 TYR 54 -4.756 0.159 0.764
416 HE2 TYR 54 HE2 TYR 54 -0.514 0.764 1.076
417 HH TYR 54 HH TYR 54 -2.028 1.982 2.223
418 HA PRO 55 HA PRO 55 1.811 -4.096 1.925
419 HB2 PRO 55 HB2 PRO 55 4.157 -3.931 0.608
420 HB3 PRO 55 HB3 PRO 55 3.195 -5.427 0.657
421 HG2 PRO 55 HG2 PRO 55 3.301 -3.361 -1.567
422 HG3 PRO 55 HG3 PRO 55 3.433 -5.143 -1.700
423 HD2 PRO 55 HD2 PRO 55 1.065 -3.786 -2.066
424 HD3 PRO 55 HD3 PRO 55 1.135 -5.434 -1.377
425 H ALA 56 H ALA 56 1.378 -2.203 2.965
426 HA ALA 56 HA ALA 56 1.288 0.354 1.838
427 HB1 ALA 56 HB1 ALA 56 0.251 -0.421 4.023
428 HB2 ALA 56 HB2 ALA 56 1.857 -0.236 4.758
429 HB3 ALA 56 HB3 ALA 56 1.038 1.172 4.070
430 H ASN 57 H ASN 57 4.095 -1.381 3.036
431 HA ASN 57 HA ASN 57 5.801 0.876 3.415
432 HB2 ASN 57 HB2 ASN 57 6.550 -1.890 2.376
433 HB3 ASN 57 HB3 ASN 57 7.653 -0.680 3.023
434 HD21 ASN 57 HD21 ASN 57 5.479 -3.361 3.898
435 HD22 ASN 57 HD22 ASN 57 5.923 -3.196 5.593
436 H TYR 58 H TYR 58 4.392 -0.288 0.490
437 HA TYR 58 HA TYR 58 6.481 0.894 -1.224
438 HB2 TYR 58 HB2 TYR 58 4.444 -1.257 -1.835
439 HB3 TYR 58 HB3 TYR 58 5.566 -0.578 -3.007
440 HD1 TYR 58 HD1 TYR 58 5.396 -2.306 0.300
441 HD2 TYR 58 HD2 TYR 58 7.666 -1.814 -3.325
442 HE1 TYR 58 HE1 TYR 58 7.050 -3.942 1.116
443 HE2 TYR 58 HE2 TYR 58 9.323 -3.415 -2.515
444 HH TYR 58 HH TYR 58 9.757 -5.149 -0.658
445 H VAL 59 H VAL 59 3.903 2.095 0.273
446 HA VAL 59 HA VAL 59 3.163 3.815 -1.986
447 HB VAL 59 HB VAL 59 1.504 1.727 -1.328
448 HG11 VAL 59 HG11 VAL 59 -0.382 2.598 0.029
449 HG12 VAL 59 HG12 VAL 59 1.125 2.453 1.004
450 HG13 VAL 59 HG13 VAL 59 0.511 4.015 0.441
451 HG21 VAL 59 HG21 VAL 59 0.983 3.074 -3.198
452 HG22 VAL 59 HG22 VAL 59 -0.428 2.919 -2.205
453 HG23 VAL 59 HG23 VAL 59 0.492 4.439 -2.149
454 H GLU 60 H GLU 60 2.013 5.837 -0.996
455 HA GLU 60 HA GLU 60 2.244 6.240 1.791
456 HB2 GLU 60 HB2 GLU 60 4.639 6.932 0.382
457 HB3 GLU 60 HB3 GLU 60 3.831 8.452 0.815
458 HG2 GLU 60 HG2 GLU 60 3.480 7.539 3.116
459 HG3 GLU 60 HG3 GLU 60 4.437 6.118 2.700
460 H LYS 61 H LYS 61 1.575 8.735 2.221
461 HA LYS 61 HA LYS 61 -0.888 8.906 0.668
462 HB2 LYS 61 HB2 LYS 61 -0.439 9.321 3.244
463 HB3 LYS 61 HB3 LYS 61 -0.067 10.966 2.717
464 HG2 LYS 61 HG2 LYS 61 -2.319 11.296 1.901
465 HG3 LYS 61 HG3 LYS 61 -2.624 9.558 1.847
466 HD2 LYS 61 HD2 LYS 61 -3.843 10.372 3.729
467 HD3 LYS 61 HD3 LYS 61 -2.469 9.428 4.311
468 HE2 LYS 61 HE2 LYS 61 -1.325 11.877 4.226
469 HE3 LYS 61 HE3 LYS 61 -2.979 12.401 4.477
470 HZ1 LYS 61 HZ1 LYS 61 -1.467 10.546 6.221
471 HZ2 LYS 61 HZ2 LYS 61 -3.037 10.987 6.460
472 HZ3 LYS 61 HZ3 LYS 61 -1.823 12.103 6.547
473 H VAL 62 H VAL 62 -1.563 10.875 -0.425
474 HA VAL 62 HA VAL 62 0.681 12.591 -1.353
475 HB VAL 62 HB VAL 62 0.425 10.646 -2.853
476 HG11 VAL 62 HG11 VAL 62 -1.520 10.498 -4.371
477 HG12 VAL 62 HG12 VAL 62 -1.975 10.204 -2.695
478 HG13 VAL 62 HG13 VAL 62 -2.341 11.769 -3.475
479 HG21 VAL 62 HG21 VAL 62 -0.291 13.277 -4.195
480 HG22 VAL 62 HG22 VAL 62 1.338 12.760 -3.707
481 HG23 VAL 62 HG23 VAL 62 0.461 11.860 -4.952
482 H GLY 63 H GLY 63 -2.776 12.318 -0.618
483 HA2 GLY 63 HA2 GLY 63 -3.550 14.783 -1.822
484 HA3 GLY 63 HA3 GLY 63 -4.386 13.952 -0.507
485 H LEU 64 H LEU 64 -2.904 14.001 1.616
486 HA LEU 64 HA LEU 64 -2.806 16.843 2.303
487 HB2 LEU 64 HB2 LEU 64 -3.201 14.339 3.727
488 HB3 LEU 64 HB3 LEU 64 -1.898 15.220 4.498
489 HG LEU 64 HG LEU 64 -4.634 16.378 3.875
490 HD11 LEU 64 HD11 LEU 64 -3.528 15.380 6.534
491 HD12 LEU 64 HD12 LEU 64 -4.757 14.559 5.551
492 HD13 LEU 64 HD13 LEU 64 -5.121 16.129 6.267
493 HD21 LEU 64 HD21 LEU 64 -2.391 17.471 5.642
494 HD22 LEU 64 HD22 LEU 64 -4.016 18.175 5.468
495 HD23 LEU 64 HD23 LEU 64 -2.928 18.160 4.090
496 H ALA 65 H ALA 65 -0.972 17.590 3.770
497 HA ALA 65 HA ALA 65 1.705 16.601 3.193
498 HB1 ALA 65 HB1 ALA 65 0.577 19.377 2.603
499 HB2 ALA 65 HB2 ALA 65 2.312 18.937 2.498
500 HB3 ALA 65 HB3 ALA 65 1.130 18.223 1.375
501 H ALA 66 H ALA 66 3.155 18.045 4.519
502 HA ALA 66 HA ALA 66 3.703 18.072 6.825
503 HB1 ALA 66 HB1 ALA 66 3.974 20.505 7.163
504 HB2 ALA 66 HB2 ALA 66 4.389 20.012 5.512
505 HB3 ALA 66 HB3 ALA 66 2.834 20.817 5.848
506 H ALA 67 H ALA 67 2.033 16.849 8.040
507 HA ALA 67 HA ALA 67 0.511 18.621 9.813
508 HB1 ALA 67 HB1 ALA 67 -1.131 17.751 8.115
509 HB2 ALA 67 HB2 ALA 67 -0.717 16.097 8.656
510 HB3 ALA 67 HB3 ALA 67 -1.452 17.223 9.786
511 H1 THR 101 H THR 101 2.269 -11.609 10.724
512 HA THR 101 HA THR 101 -0.523 -12.418 11.255
513 HB THR 101 HB THR 101 -0.183 -9.971 10.622
514 HG1 THR 101 HG1 THR 101 -1.909 -10.034 9.232
515 HG21 THR 101 HG21 THR 101 0.808 -11.191 7.984
516 HG22 THR 101 HG22 THR 101 1.579 -9.971 9.012
517 HG23 THR 101 HG23 THR 101 0.105 -9.619 8.094
518 H LYS 102 H LYS 102 -1.550 -13.391 9.193
519 HA LYS 102 HA LYS 102 0.276 -15.409 8.159
520 HB2 LYS 102 HB2 LYS 102 -2.371 -15.554 8.448
521 HB3 LYS 102 HB3 LYS 102 -2.374 -14.839 6.818
522 HG2 LYS 102 HG2 LYS 102 -0.883 -16.682 6.022
523 HG3 LYS 102 HG3 LYS 102 -0.864 -17.331 7.658
524 HD2 LYS 102 HD2 LYS 102 -3.576 -17.259 7.190
525 HD3 LYS 102 HD3 LYS 102 -2.976 -17.482 5.551
526 HE2 LYS 102 HE2 LYS 102 -3.451 -19.639 6.593
527 HE3 LYS 102 HE3 LYS 102 -1.716 -19.501 6.277
528 HZ1 LYS 102 HZ1 LYS 102 -2.402 -20.364 8.554
529 HZ2 LYS 102 HZ2 LYS 102 -2.925 -18.848 8.896
530 HZ3 LYS 102 HZ3 LYS 102 -1.331 -19.118 8.577
531 H GLY 103 H GLY 103 1.261 -15.385 6.093
532 HA2 GLY 103 HA2 GLY 103 1.934 -14.468 4.050
533 HA3 GLY 103 HA3 GLY 103 0.623 -13.297 4.176
534 HA PRO 104 HA PRO 104 4.257 -11.409 6.782
535 HB2 PRO 104 HB2 PRO 104 6.781 -12.449 6.368
536 HB3 PRO 104 HB3 PRO 104 5.657 -13.016 7.644
537 HG2 PRO 104 HG2 PRO 104 6.238 -14.257 4.945
538 HG3 PRO 104 HG3 PRO 104 6.022 -15.056 6.536
539 HD2 PRO 104 HD2 PRO 104 4.040 -14.893 4.637
540 HD3 PRO 104 HD3 PRO 104 3.701 -14.951 6.386
541 H ALA 105 H ALA 105 4.175 -9.653 5.563
542 HA ALA 105 HA ALA 105 4.188 -9.094 3.003
543 HB1 ALA 105 HB1 ALA 105 5.059 -6.753 3.830
544 HB2 ALA 105 HB2 ALA 105 3.615 -7.441 4.584
545 HB3 ALA 105 HB3 ALA 105 5.204 -7.540 5.386
546 HA PRO 106 HA PRO 106 8.001 -9.211 0.866
547 HB2 PRO 106 HB2 PRO 106 7.958 -6.727 -0.498
548 HB3 PRO 106 HB3 PRO 106 7.165 -8.257 -0.945
549 HG2 PRO 106 HG2 PRO 106 6.008 -5.847 0.389
550 HG3 PRO 106 HG3 PRO 106 5.263 -6.905 -0.847
551 HD2 PRO 106 HD2 PRO 106 4.692 -7.052 1.801
552 HD3 PRO 106 HD3 PRO 106 4.686 -8.487 0.776
553 H ASN 107 H ASN 107 7.506 -6.490 2.719
554 HA ASN 107 HA ASN 107 9.776 -4.921 2.654
555 HB2 ASN 107 HB2 ASN 107 9.096 -3.904 4.645
556 HB3 ASN 107 HB3 ASN 107 7.619 -4.635 4.064
557 HD21 ASN 107 HD21 ASN 107 6.508 -5.945 5.578
558 HD22 ASN 107 HD22 ASN 107 7.283 -6.763 6.896
559 HA PRO 108 HA PRO 108 11.152 -3.741 5.193
560 HB2 PRO 108 HB2 PRO 108 13.895 -3.229 4.872
561 HB3 PRO 108 HB3 PRO 108 13.054 -3.768 6.345
562 HG2 PRO 108 HG2 PRO 108 14.526 -5.433 4.298
563 HG3 PRO 108 HG3 PRO 108 14.564 -5.554 6.090
564 HD2 PRO 108 HD2 PRO 108 13.072 -7.224 4.603
565 HD3 PRO 108 HD3 PRO 108 12.442 -6.579 6.141
566 HA PRO 109 HA PRO 109 10.974 -1.347 1.534
567 HB2 PRO 109 HB2 PRO 109 12.332 1.019 2.008
568 HB3 PRO 109 HB3 PRO 109 10.701 0.608 2.607
569 HG2 PRO 109 HG2 PRO 109 13.351 0.308 4.044
570 HG3 PRO 109 HG3 PRO 109 11.823 1.000 4.669
571 HD2 PRO 109 HD2 PRO 109 12.528 -1.513 5.252
572 HD3 PRO 109 HD3 PRO 109 10.830 -1.152 4.852
573 HA PRO 110 HA PRO 110 14.545 -2.395 -0.874
574 HB2 PRO 110 HB2 PRO 110 13.792 -1.456 -3.350
575 HB3 PRO 110 HB3 PRO 110 13.109 -2.914 -2.578
576 HG2 PRO 110 HG2 PRO 110 11.952 -0.114 -2.640
577 HG3 PRO 110 HG3 PRO 110 11.121 -1.666 -2.954
578 HD2 PRO 110 HD2 PRO 110 11.011 -0.408 -0.529
579 HD3 PRO 110 HD3 PRO 110 11.036 -2.194 -0.662
580 H ILE 111 H ILE 111 13.383 0.932 -1.770
581 HA ILE 111 HA ILE 111 16.051 2.038 -1.210
582 HB ILE 111 HB ILE 111 16.022 3.284 -3.331
583 HG12 ILE 111 HG12 ILE 111 13.734 1.477 -4.247
584 HG13 ILE 111 HG13 ILE 111 13.541 3.146 -3.724
585 HG21 ILE 111 HG21 ILE 111 17.271 1.163 -3.108
586 HG22 ILE 111 HG22 ILE 111 15.884 0.295 -3.809
587 HG23 ILE 111 HG23 ILE 111 16.750 1.490 -4.766
588 HD11 ILE 111 HD11 ILE 111 13.640 3.235 -6.090
589 HD12 ILE 111 HD12 ILE 111 15.202 3.837 -5.520
590 HD13 ILE 111 HD13 ILE 111 15.067 2.182 -6.156
591 H LEU 112 H LEU 112 15.731 4.606 -1.809
592 HA LEU 112 HA LEU 112 14.954 6.556 -1.094
593 HB2 LEU 112 HB2 LEU 112 12.368 5.207 -1.816
594 HB3 LEU 112 HB3 LEU 112 12.324 6.757 -1.027
595 HG LEU 112 HG LEU 112 12.052 7.144 -3.283
596 HD11 LEU 112 HD11 LEU 112 14.887 8.015 -2.737
597 HD12 LEU 112 HD12 LEU 112 13.460 8.718 -1.932
598 HD13 LEU 112 HD13 LEU 112 13.625 8.824 -3.692
599 HD21 LEU 112 HD21 LEU 112 13.025 5.223 -4.340
600 HD22 LEU 112 HD22 LEU 112 14.673 5.709 -3.845
601 HD23 LEU 112 HD23 LEU 112 13.757 6.673 -5.016
602 H LYS 113 H LYS 113 15.596 4.515 0.986
603 HA LYS 113 HA LYS 113 13.779 4.836 3.152
604 HB2 LYS 113 HB2 LYS 113 16.769 4.240 3.069
605 HB3 LYS 113 HB3 LYS 113 15.859 4.324 4.563
606 HG2 LYS 113 HG2 LYS 113 14.316 2.533 3.697
607 HG3 LYS 113 HG3 LYS 113 15.313 2.390 2.254
608 HD2 LYS 113 HD2 LYS 113 15.795 0.642 3.991
609 HD3 LYS 113 HD3 LYS 113 17.202 1.601 3.527
610 HE2 LYS 113 HE2 LYS 113 17.113 1.195 5.976
611 HE3 LYS 113 HE3 LYS 113 17.110 2.899 5.559
612 HZ1 LYS 113 HZ1 LYS 113 14.852 1.300 6.571
613 HZ2 LYS 113 HZ2 LYS 113 14.607 2.779 5.824
614 HZ3 LYS 113 HZ3 LYS 113 15.501 2.686 7.158
615 H VAL 114 H VAL 114 14.142 5.977 5.148
616 HA VAL 114 HA VAL 114 15.254 8.715 4.798
617 HB VAL 114 HB VAL 114 12.899 7.783 6.496
618 HG11 VAL 114 HG11 VAL 114 12.476 10.185 6.860
619 HG12 VAL 114 HG12 VAL 114 14.079 9.748 7.465
620 HG13 VAL 114 HG13 VAL 114 13.922 10.605 5.921
621 HG21 VAL 114 HG21 VAL 114 12.283 7.743 4.110
622 HG22 VAL 114 HG22 VAL 114 11.492 9.082 4.946
623 HG23 VAL 114 HG23 VAL 114 12.911 9.399 3.924
624 H TRP 115 H TRP 115 17.238 8.493 5.664
625 HA TRP 115 HA TRP 115 18.947 7.773 6.961
626 HB2 TRP 115 HB2 TRP 115 17.231 9.752 8.295
627 HB3 TRP 115 HB3 TRP 115 18.256 8.907 9.422
628 HD1 TRP 115 HD1 TRP 115 18.851 10.551 5.968
629 HE1 TRP 115 HE1 TRP 115 21.131 11.772 6.025
630 HE3 TRP 115 HE3 TRP 115 20.212 9.531 10.799
631 HZ2 TRP 115 HZ2 TRP 115 23.293 12.123 7.872
632 HZ3 TRP 115 HZ3 TRP 115 22.383 10.333 11.681
633 HH2 TRP 115 HH2 TRP 115 23.943 11.606 10.224
Start of MODEL 5
1 H1 MET 1 H MET 1 -19.649 2.418 8.162
2 HA MET 1 HA MET 1 -18.402 3.385 9.940
3 HB2 MET 1 HB2 MET 1 -16.470 2.098 7.953
4 HB3 MET 1 HB3 MET 1 -16.162 2.376 9.664
5 HG2 MET 1 HG2 MET 1 -16.815 0.113 9.534
6 HG3 MET 1 HG3 MET 1 -18.182 0.976 10.211
7 HE1 MET 1 HE1 MET 1 -16.884 -1.321 7.285
8 HE2 MET 1 HE2 MET 1 -17.985 -0.896 5.959
9 HE3 MET 1 HE3 MET 1 -16.807 0.295 6.550
10 H LYS 2 H LYS 2 -17.522 5.269 10.589
11 HA LYS 2 HA LYS 2 -17.172 7.434 8.818
12 HB2 LYS 2 HB2 LYS 2 -16.401 6.955 11.706
13 HB3 LYS 2 HB3 LYS 2 -16.194 8.522 10.963
14 HG2 LYS 2 HG2 LYS 2 -18.944 7.236 10.867
15 HG3 LYS 2 HG3 LYS 2 -18.337 7.907 12.369
16 HD2 LYS 2 HD2 LYS 2 -19.528 9.676 11.483
17 HD3 LYS 2 HD3 LYS 2 -17.858 10.076 11.089
18 HE2 LYS 2 HE2 LYS 2 -18.327 9.028 8.769
19 HE3 LYS 2 HE3 LYS 2 -20.033 8.970 9.260
20 HZ1 LYS 2 HZ1 LYS 2 -19.813 11.441 9.631
21 HZ2 LYS 2 HZ2 LYS 2 -19.633 11.010 8.072
22 HZ3 LYS 2 HZ3 LYS 2 -18.322 11.364 8.962
23 H VAL 3 H VAL 3 -14.971 4.988 8.820
24 HA VAL 3 HA VAL 3 -12.638 6.774 8.497
25 HB VAL 3 HB VAL 3 -12.233 5.191 10.145
26 HG11 VAL 3 HG11 VAL 3 -13.115 2.931 8.326
27 HG12 VAL 3 HG12 VAL 3 -12.328 2.762 9.901
28 HG13 VAL 3 HG13 VAL 3 -13.922 3.496 9.809
29 HG21 VAL 3 HG21 VAL 3 -10.399 5.622 8.537
30 HG22 VAL 3 HG22 VAL 3 -10.278 4.060 9.359
31 HG23 VAL 3 HG23 VAL 3 -10.834 4.127 7.678
32 HA PRO 4 HA PRO 4 -13.863 5.728 4.162
33 HB2 PRO 4 HB2 PRO 4 -13.146 8.041 2.934
34 HB3 PRO 4 HB3 PRO 4 -14.625 7.940 3.939
35 HG2 PRO 4 HG2 PRO 4 -11.869 8.906 4.798
36 HG3 PRO 4 HG3 PRO 4 -13.418 9.781 4.959
37 HD2 PRO 4 HD2 PRO 4 -12.421 8.306 7.009
38 HD3 PRO 4 HD3 PRO 4 -14.175 8.315 6.647
39 H GLY 5 H GLY 5 -12.331 5.830 2.040
40 HA2 GLY 5 HA2 GLY 5 -9.880 4.669 2.869
41 HA3 GLY 5 HA3 GLY 5 -10.384 4.974 1.205
42 H VAL 6 H VAL 6 -7.693 5.347 2.137
43 HA VAL 6 HA VAL 6 -7.393 8.337 2.079
44 HB VAL 6 HB VAL 6 -5.077 7.835 2.869
45 HG11 VAL 6 HG11 VAL 6 -6.881 8.867 4.250
46 HG12 VAL 6 HG12 VAL 6 -7.342 7.238 4.808
47 HG13 VAL 6 HG13 VAL 6 -5.747 7.897 5.220
48 HG21 VAL 6 HG21 VAL 6 -4.983 5.394 2.622
49 HG22 VAL 6 HG22 VAL 6 -4.706 5.880 4.294
50 HG23 VAL 6 HG23 VAL 6 -6.291 5.226 3.828
51 H ARG 7 H ARG 7 -6.436 9.150 0.273
52 HA ARG 7 HA ARG 7 -5.786 7.193 -1.822
53 HB2 ARG 7 HB2 ARG 7 -5.938 8.866 -3.346
54 HB3 ARG 7 HB3 ARG 7 -7.138 9.361 -2.184
55 HG2 ARG 7 HG2 ARG 7 -4.338 10.542 -2.504
56 HG3 ARG 7 HG3 ARG 7 -5.821 11.227 -3.093
57 HD2 ARG 7 HD2 ARG 7 -5.024 10.919 -0.203
58 HD3 ARG 7 HD3 ARG 7 -5.097 12.409 -1.147
59 HE ARG 7 HE ARG 7 -7.606 11.645 -1.439
60 HH11 ARG 7 HH11 ARG 7 -5.634 11.668 1.481
61 HH12 ARG 7 HH12 ARG 7 -6.924 11.849 2.616
62 HH21 ARG 7 HH21 ARG 7 -9.348 12.163 -0.019
63 HH22 ARG 7 HH22 ARG 7 -9.137 12.220 1.693
64 H VAL 8 H VAL 8 -3.750 6.512 -2.220
65 HA VAL 8 HA VAL 8 -1.478 8.085 -1.204
66 HB VAL 8 HB VAL 8 -0.382 6.192 -0.224
67 HG11 VAL 8 HG11 VAL 8 -1.961 7.388 1.277
68 HG12 VAL 8 HG12 VAL 8 -3.251 6.261 0.841
69 HG13 VAL 8 HG13 VAL 8 -1.820 5.689 1.700
70 HG21 VAL 8 HG21 VAL 8 -1.029 4.397 -1.635
71 HG22 VAL 8 HG22 VAL 8 -1.578 3.988 -0.006
72 HG23 VAL 8 HG23 VAL 8 -2.743 4.577 -1.227
73 H ARG 9 H ARG 9 0.519 7.536 -2.430
74 HA ARG 9 HA ARG 9 -0.163 6.455 -5.132
75 HB2 ARG 9 HB2 ARG 9 0.058 8.996 -4.785
76 HB3 ARG 9 HB3 ARG 9 1.785 8.732 -4.580
77 HG2 ARG 9 HG2 ARG 9 0.219 7.717 -7.000
78 HG3 ARG 9 HG3 ARG 9 0.785 9.366 -6.905
79 HD2 ARG 9 HD2 ARG 9 2.924 7.458 -6.254
80 HD3 ARG 9 HD3 ARG 9 2.202 7.144 -7.836
81 HE ARG 9 HE ARG 9 2.608 9.865 -7.838
82 HH11 ARG 9 HH11 ARG 9 4.698 7.017 -7.398
83 HH12 ARG 9 HH12 ARG 9 6.122 7.742 -8.021
84 HH21 ARG 9 HH21 ARG 9 4.548 10.905 -8.730
85 HH22 ARG 9 HH22 ARG 9 6.011 9.994 -8.812
86 H ALA 10 H ALA 10 1.214 5.044 -6.004
87 HA ALA 10 HA ALA 10 3.063 3.694 -4.233
88 HB1 ALA 10 HB1 ALA 10 3.373 2.257 -6.223
89 HB2 ALA 10 HB2 ALA 10 1.660 2.466 -5.796
90 HB3 ALA 10 HB3 ALA 10 2.351 3.355 -7.177
91 H LEU 11 H LEU 11 5.116 4.252 -3.941
92 HA LEU 11 HA LEU 11 6.438 6.193 -5.715
93 HB2 LEU 11 HB2 LEU 11 7.412 4.799 -3.198
94 HB3 LEU 11 HB3 LEU 11 8.239 6.102 -4.041
95 HG LEU 11 HG LEU 11 5.573 6.302 -2.574
96 HD11 LEU 11 HD11 LEU 11 8.372 7.380 -2.004
97 HD12 LEU 11 HD12 LEU 11 7.502 6.124 -1.101
98 HD13 LEU 11 HD13 LEU 11 6.926 7.796 -1.082
99 HD21 LEU 11 HD21 LEU 11 7.129 8.444 -4.098
100 HD22 LEU 11 HD22 LEU 11 5.781 8.758 -2.982
101 HD23 LEU 11 HD23 LEU 11 5.493 7.850 -4.467
102 H TYR 12 H TYR 12 6.178 2.788 -5.600
103 HA TYR 12 HA TYR 12 8.334 2.430 -7.500
104 HB2 TYR 12 HB2 TYR 12 8.507 0.262 -5.552
105 HB3 TYR 12 HB3 TYR 12 9.750 1.209 -6.313
106 HD1 TYR 12 HD1 TYR 12 7.225 1.354 -3.608
107 HD2 TYR 12 HD2 TYR 12 11.099 2.647 -4.922
108 HE1 TYR 12 HE1 TYR 12 7.611 2.485 -1.378
109 HE2 TYR 12 HE2 TYR 12 11.529 3.621 -2.674
110 HH TYR 12 HH TYR 12 10.762 3.658 -0.418
111 H ASP 13 H ASP 13 8.212 -0.033 -8.141
112 HA ASP 13 HA ASP 13 5.367 -0.718 -8.650
113 HB2 ASP 13 HB2 ASP 13 6.242 -1.768 -10.669
114 HB3 ASP 13 HB3 ASP 13 6.707 -0.073 -10.547
115 H TYR 14 H TYR 14 4.726 -2.226 -7.033
116 HA TYR 14 HA TYR 14 6.086 -4.852 -7.084
117 HB2 TYR 14 HB2 TYR 14 5.728 -3.074 -4.662
118 HB3 TYR 14 HB3 TYR 14 5.458 -4.766 -4.485
119 HD1 TYR 14 HD1 TYR 14 7.278 -6.122 -3.806
120 HD2 TYR 14 HD2 TYR 14 8.064 -2.426 -5.896
121 HE1 TYR 14 HE1 TYR 14 9.697 -6.554 -3.679
122 HE2 TYR 14 HE2 TYR 14 10.480 -2.904 -5.863
123 HH TYR 14 HH TYR 14 12.122 -4.624 -5.420
124 H THR 15 H THR 15 4.638 -6.618 -6.312
125 HA THR 15 HA THR 15 1.772 -5.830 -6.070
126 HB THR 15 HB THR 15 1.998 -6.262 -8.394
127 HG1 THR 15 HG1 THR 15 0.635 -8.198 -6.893
128 HG21 THR 15 HG21 THR 15 3.291 -8.961 -7.890
129 HG22 THR 15 HG22 THR 15 4.129 -7.516 -8.468
130 HG23 THR 15 HG23 THR 15 2.832 -8.234 -9.436
131 H GLY 16 H GLY 16 2.271 -6.126 -3.955
132 HA2 GLY 16 HA2 GLY 16 2.560 -7.280 -1.969
133 HA3 GLY 16 HA3 GLY 16 1.453 -8.389 -2.743
134 H GLN 17 H GLN 17 2.384 -10.148 -1.660
135 HA GLN 17 HA GLN 17 4.934 -11.109 -2.708
136 HB2 GLN 17 HB2 GLN 17 5.181 -10.020 -0.376
137 HB3 GLN 17 HB3 GLN 17 4.222 -11.366 0.208
138 HG2 GLN 17 HG2 GLN 17 6.668 -11.682 0.528
139 HG3 GLN 17 HG3 GLN 17 6.003 -12.950 -0.501
140 HE21 GLN 17 HE21 GLN 17 6.825 -13.111 -2.714
141 HE22 GLN 17 HE22 GLN 17 8.081 -12.041 -3.262
142 H GLU 18 H GLU 18 1.732 -11.624 -2.888
143 HA GLU 18 HA GLU 18 1.998 -14.570 -2.834
144 HB2 GLU 18 HB2 GLU 18 1.126 -13.473 -0.648
145 HB3 GLU 18 HB3 GLU 18 -0.270 -12.955 -1.559
146 HG2 GLU 18 HG2 GLU 18 -0.968 -15.297 -1.880
147 HG3 GLU 18 HG3 GLU 18 0.526 -15.857 -1.124
148 H ALA 19 H ALA 19 -0.426 -15.275 -3.516
149 HA ALA 19 HA ALA 19 -0.961 -14.150 -6.186
150 HB1 ALA 19 HB1 ALA 19 -0.627 -16.604 -5.875
151 HB2 ALA 19 HB2 ALA 19 -1.987 -16.651 -4.728
152 HB3 ALA 19 HB3 ALA 19 -2.264 -16.229 -6.425
153 H ASP 20 H ASP 20 -1.969 -13.529 -3.058
154 HA ASP 20 HA ASP 20 -4.777 -12.837 -3.769
155 HB2 ASP 20 HB2 ASP 20 -3.678 -14.187 -1.299
156 HB3 ASP 20 HB3 ASP 20 -5.145 -13.233 -1.186
157 H GLU 21 H GLU 21 -2.535 -11.074 -4.077
158 HA GLU 21 HA GLU 21 -3.080 -8.958 -2.056
159 HB2 GLU 21 HB2 GLU 21 -0.720 -8.217 -2.823
160 HB3 GLU 21 HB3 GLU 21 -0.886 -9.543 -1.680
161 HG2 GLU 21 HG2 GLU 21 0.794 -10.106 -3.450
162 HG3 GLU 21 HG3 GLU 21 -0.546 -11.188 -3.353
163 H LEU 22 H LEU 22 -2.434 -6.750 -3.122
164 HA LEU 22 HA LEU 22 -3.912 -6.449 -5.687
165 HB2 LEU 22 HB2 LEU 22 -3.133 -4.576 -3.420
166 HB3 LEU 22 HB3 LEU 22 -3.601 -3.945 -4.998
167 HG LEU 22 HG LEU 22 -5.307 -5.774 -3.316
168 HD11 LEU 22 HD11 LEU 22 -5.447 -2.765 -3.611
169 HD12 LEU 22 HD12 LEU 22 -5.063 -3.684 -2.158
170 HD13 LEU 22 HD13 LEU 22 -6.685 -3.772 -2.858
171 HD21 LEU 22 HD21 LEU 22 -5.703 -4.539 -6.021
172 HD22 LEU 22 HD22 LEU 22 -7.104 -4.749 -4.958
173 HD23 LEU 22 HD23 LEU 22 -6.127 -6.144 -5.430
174 H SER 23 H SER 23 -2.904 -5.386 -7.423
175 HA SER 23 HA SER 23 0.036 -5.292 -7.276
176 HB2 SER 23 HB2 SER 23 -0.263 -5.587 -9.749
177 HB3 SER 23 HB3 SER 23 -0.939 -6.914 -8.795
178 HG SER 23 HG SER 23 -2.268 -6.301 -10.464
179 H PHE 24 H PHE 24 1.050 -3.224 -7.513
180 HA PHE 24 HA PHE 24 -0.661 -1.172 -8.790
181 HB2 PHE 24 HB2 PHE 24 -0.150 0.473 -7.141
182 HB3 PHE 24 HB3 PHE 24 -1.141 -0.836 -6.527
183 HD1 PHE 24 HD1 PHE 24 2.396 0.322 -6.720
184 HD2 PHE 24 HD2 PHE 24 -0.522 -1.910 -4.442
185 HE1 PHE 24 HE1 PHE 24 3.872 0.389 -4.757
186 HE2 PHE 24 HE2 PHE 24 1.033 -1.879 -2.505
187 HZ PHE 24 HZ PHE 24 3.197 -0.723 -2.660
188 H LYS 25 H LYS 25 0.441 0.106 -10.151
189 HA LYS 25 HA LYS 25 3.283 -0.640 -10.629
190 HB2 LYS 25 HB2 LYS 25 0.987 0.277 -12.278
191 HB3 LYS 25 HB3 LYS 25 2.453 1.172 -12.614
192 HG2 LYS 25 HG2 LYS 25 2.510 -0.699 -14.084
193 HG3 LYS 25 HG3 LYS 25 3.686 -1.022 -12.816
194 HD2 LYS 25 HD2 LYS 25 1.684 -2.375 -11.690
195 HD3 LYS 25 HD3 LYS 25 1.029 -2.334 -13.342
196 HE2 LYS 25 HE2 LYS 25 3.495 -3.105 -13.979
197 HE3 LYS 25 HE3 LYS 25 3.584 -3.586 -12.278
198 HZ1 LYS 25 HZ1 LYS 25 1.466 -4.874 -12.825
199 HZ2 LYS 25 HZ2 LYS 25 2.895 -5.448 -13.485
200 HZ3 LYS 25 HZ3 LYS 25 1.829 -4.571 -14.394
201 H ALA 26 H ALA 26 4.923 1.064 -11.075
202 HA ALA 26 HA ALA 26 4.956 3.004 -8.961
203 HB1 ALA 26 HB1 ALA 26 7.059 2.150 -9.930
204 HB2 ALA 26 HB2 ALA 26 6.641 2.851 -11.510
205 HB3 ALA 26 HB3 ALA 26 6.965 3.906 -10.123
206 H GLY 27 H GLY 27 3.759 4.837 -8.883
207 HA2 GLY 27 HA2 GLY 27 3.235 7.025 -9.777
208 HA3 GLY 27 HA3 GLY 27 3.109 6.337 -11.388
209 H GLU 28 H GLU 28 1.663 3.958 -9.750
210 HA GLU 28 HA GLU 28 -0.989 4.863 -10.399
211 HB2 GLU 28 HB2 GLU 28 -0.093 2.581 -10.802
212 HB3 GLU 28 HB3 GLU 28 -0.036 2.294 -9.055
213 HG2 GLU 28 HG2 GLU 28 -2.333 2.142 -8.854
214 HG3 GLU 28 HG3 GLU 28 -2.649 3.167 -10.259
215 H GLU 29 H GLU 29 -2.773 4.675 -8.874
216 HA GLU 29 HA GLU 29 -2.097 5.569 -6.121
217 HB2 GLU 29 HB2 GLU 29 -4.383 6.289 -7.974
218 HB3 GLU 29 HB3 GLU 29 -4.379 6.643 -6.241
219 HG2 GLU 29 HG2 GLU 29 -2.279 7.995 -6.587
220 HG3 GLU 29 HG3 GLU 29 -2.525 7.812 -8.341
221 H LEU 30 H LEU 30 -3.790 4.962 -4.543
222 HA LEU 30 HA LEU 30 -5.596 2.795 -5.171
223 HB2 LEU 30 HB2 LEU 30 -4.523 1.398 -3.279
224 HB3 LEU 30 HB3 LEU 30 -3.774 1.297 -4.892
225 HG LEU 30 HG LEU 30 -2.601 3.412 -3.162
226 HD11 LEU 30 HD11 LEU 30 -3.163 1.837 -1.387
227 HD12 LEU 30 HD12 LEU 30 -1.414 1.901 -1.662
228 HD13 LEU 30 HD13 LEU 30 -2.342 0.526 -2.261
229 HD21 LEU 30 HD21 LEU 30 -0.518 2.544 -3.974
230 HD22 LEU 30 HD22 LEU 30 -1.632 2.555 -5.334
231 HD23 LEU 30 HD23 LEU 30 -1.271 1.029 -4.514
232 H MET 31 H MET 31 -6.966 2.336 -3.270
233 HA MET 31 HA MET 31 -6.830 4.472 -1.204
234 HB2 MET 31 HB2 MET 31 -9.492 3.305 -2.030
235 HB3 MET 31 HB3 MET 31 -9.090 4.806 -1.209
236 HG2 MET 31 HG2 MET 31 -7.858 5.438 -3.409
237 HG3 MET 31 HG3 MET 31 -8.794 4.146 -4.144
238 HE1 MET 31 HE1 MET 31 -10.063 8.358 -2.978
239 HE2 MET 31 HE2 MET 31 -9.004 7.377 -1.938
240 HE3 MET 31 HE3 MET 31 -8.504 7.776 -3.599
241 H LYS 32 H LYS 32 -6.209 3.558 0.666
242 HA LYS 32 HA LYS 32 -6.519 0.741 1.213
243 HB2 LYS 32 HB2 LYS 32 -4.809 1.917 2.263
244 HB3 LYS 32 HB3 LYS 32 -5.882 3.195 2.866
245 HG2 LYS 32 HG2 LYS 32 -6.959 1.565 4.411
246 HG3 LYS 32 HG3 LYS 32 -5.896 0.323 3.753
247 HD2 LYS 32 HD2 LYS 32 -4.786 0.985 5.769
248 HD3 LYS 32 HD3 LYS 32 -3.915 1.770 4.460
249 HE2 LYS 32 HE2 LYS 32 -5.510 3.780 4.888
250 HE3 LYS 32 HE3 LYS 32 -5.915 2.979 6.406
251 HZ1 LYS 32 HZ1 LYS 32 -3.690 3.119 7.113
252 HZ2 LYS 32 HZ2 LYS 32 -4.075 4.615 6.596
253 HZ3 LYS 32 HZ3 LYS 32 -3.117 3.639 5.660
254 H ILE 33 H ILE 33 -8.125 -0.323 2.429
255 HA ILE 33 HA ILE 33 -10.311 1.370 3.436
256 HB ILE 33 HB ILE 33 -11.946 -0.087 2.543
257 HG12 ILE 33 HG12 ILE 33 -10.462 -1.587 0.530
258 HG13 ILE 33 HG13 ILE 33 -9.826 -1.981 2.124
259 HG21 ILE 33 HG21 ILE 33 -11.821 0.468 0.156
260 HG22 ILE 33 HG22 ILE 33 -11.284 1.834 1.149
261 HG23 ILE 33 HG23 ILE 33 -10.113 0.826 0.288
262 HD11 ILE 33 HD11 ILE 33 -12.068 -2.615 2.888
263 HD12 ILE 33 HD12 ILE 33 -12.742 -2.173 1.295
264 HD13 ILE 33 HD13 ILE 33 -11.581 -3.513 1.432
265 H SER 34 H SER 34 -8.013 -0.463 4.525
266 HA SER 34 HA SER 34 -9.537 -1.513 6.771
267 HB2 SER 34 HB2 SER 34 -9.170 -3.341 4.984
268 HB3 SER 34 HB3 SER 34 -7.436 -3.203 5.368
269 HG SER 34 HG SER 34 -9.580 -3.834 7.134
270 H GLU 35 H GLU 35 -7.460 -2.445 8.238
271 HA GLU 35 HA GLU 35 -5.822 -0.005 8.611
272 HB2 GLU 35 HB2 GLU 35 -5.566 -0.823 10.877
273 HB3 GLU 35 HB3 GLU 35 -7.275 -0.967 10.450
274 HG2 GLU 35 HG2 GLU 35 -6.649 -3.411 9.704
275 HG3 GLU 35 HG3 GLU 35 -5.174 -3.158 10.640
276 H GLU 36 H GLU 36 -3.579 -0.347 9.368
277 HA GLU 36 HA GLU 36 -2.116 -2.109 7.627
278 HB2 GLU 36 HB2 GLU 36 -1.554 0.319 8.152
279 HB3 GLU 36 HB3 GLU 36 -1.162 -0.206 9.793
280 HG2 GLU 36 HG2 GLU 36 0.484 -1.854 8.760
281 HG3 GLU 36 HG3 GLU 36 0.175 -1.102 7.194
282 H ASP 37 H ASP 37 -1.151 -3.997 8.340
283 HA ASP 37 HA ASP 37 -1.545 -4.856 11.168
284 HB2 ASP 37 HB2 ASP 37 -2.821 -6.051 9.526
285 HB3 ASP 37 HB3 ASP 37 -1.397 -6.472 8.627
286 H GLU 38 H GLU 38 0.287 -6.681 11.661
287 HA GLU 38 HA GLU 38 2.537 -5.270 12.274
288 HB2 GLU 38 HB2 GLU 38 1.479 -7.500 13.150
289 HB3 GLU 38 HB3 GLU 38 2.667 -8.279 12.110
290 HG2 GLU 38 HG2 GLU 38 4.494 -7.411 13.354
291 HG3 GLU 38 HG3 GLU 38 3.527 -6.071 13.999
292 H GLN 39 H GLN 39 2.211 -6.716 9.148
293 HA GLN 39 HA GLN 39 5.148 -6.464 8.690
294 HB2 GLN 39 HB2 GLN 39 3.163 -8.444 7.848
295 HB3 GLN 39 HB3 GLN 39 3.855 -7.684 6.454
296 HG2 GLN 39 HG2 GLN 39 5.180 -9.431 8.512
297 HG3 GLN 39 HG3 GLN 39 5.150 -9.581 6.774
298 HE21 GLN 39 HE21 GLN 39 7.046 -8.397 9.423
299 HE22 GLN 39 HE22 GLN 39 8.172 -7.465 8.463
300 H GLY 40 H GLY 40 2.704 -4.443 8.766
301 HA2 GLY 40 HA2 GLY 40 2.379 -2.418 7.728
302 HA3 GLY 40 HA3 GLY 40 3.707 -2.782 6.609
303 H TRP 41 H TRP 41 0.936 -5.007 7.104
304 HA TRP 41 HA TRP 41 0.402 -4.812 4.196
305 HB2 TRP 41 HB2 TRP 41 -0.613 -6.634 6.402
306 HB3 TRP 41 HB3 TRP 41 -1.448 -6.496 4.949
307 HD1 TRP 41 HD1 TRP 41 0.956 -8.880 6.129
308 HE1 TRP 41 HE1 TRP 41 1.973 -10.098 4.221
309 HE3 TRP 41 HE3 TRP 41 -0.467 -5.755 2.379
310 HZ2 TRP 41 HZ2 TRP 41 2.117 -9.875 1.376
311 HZ3 TRP 41 HZ3 TRP 41 -0.054 -6.399 0.048
312 HH2 TRP 41 HH2 TRP 41 1.128 -8.426 -0.511
313 H CYS 42 H CYS 42 -1.315 -3.687 3.310
314 HA CYS 42 HA CYS 42 -3.480 -2.820 5.211
315 HB2 CYS 42 HB2 CYS 42 -1.893 -1.269 3.152
316 HB3 CYS 42 HB3 CYS 42 -3.573 -0.832 3.513
317 HG CYS 42 HG CYS 42 -1.901 0.755 4.828
318 H LYS 43 H LYS 43 -5.464 -3.497 4.531
319 HA LYS 43 HA LYS 43 -5.668 -4.684 1.833
320 HB2 LYS 43 HB2 LYS 43 -6.809 -5.330 4.309
321 HB3 LYS 43 HB3 LYS 43 -8.142 -4.567 3.443
322 HG2 LYS 43 HG2 LYS 43 -6.478 -6.693 2.057
323 HG3 LYS 43 HG3 LYS 43 -7.640 -7.152 3.294
324 HD2 LYS 43 HD2 LYS 43 -9.454 -5.995 2.027
325 HD3 LYS 43 HD3 LYS 43 -8.294 -5.628 0.727
326 HE2 LYS 43 HE2 LYS 43 -7.782 -8.013 0.465
327 HE3 LYS 43 HE3 LYS 43 -8.734 -8.419 1.875
328 HZ1 LYS 43 HZ1 LYS 43 -9.867 -8.910 -0.171
329 HZ2 LYS 43 HZ2 LYS 43 -9.954 -7.318 -0.576
330 HZ3 LYS 43 HZ3 LYS 43 -10.726 -7.909 0.771
331 H GLY 44 H GLY 44 -6.672 -3.600 0.103
332 HA2 GLY 44 HA2 GLY 44 -8.206 -1.163 0.723
333 HA3 GLY 44 HA3 GLY 44 -6.755 -0.922 -0.187
334 H ARG 45 H ARG 45 -8.420 -0.052 -1.659
335 HA ARG 45 HA ARG 45 -9.450 -2.089 -3.481
336 HB2 ARG 45 HB2 ARG 45 -11.213 -1.185 -1.835
337 HB3 ARG 45 HB3 ARG 45 -11.110 0.343 -2.691
338 HG2 ARG 45 HG2 ARG 45 -11.504 -2.101 -4.392
339 HG3 ARG 45 HG3 ARG 45 -12.795 -1.789 -3.249
340 HD2 ARG 45 HD2 ARG 45 -11.822 0.141 -5.372
341 HD3 ARG 45 HD3 ARG 45 -13.260 -0.869 -5.458
342 HE ARG 45 HE ARG 45 -12.940 1.622 -4.031
343 HH11 ARG 45 HH11 ARG 45 -14.941 -1.356 -4.249
344 HH12 ARG 45 HH12 ARG 45 -16.331 -0.547 -3.602
345 HH21 ARG 45 HH21 ARG 45 -14.817 2.585 -3.193
346 HH22 ARG 45 HH22 ARG 45 -16.209 1.625 -2.812
347 H LEU 46 H LEU 46 -8.622 -1.712 -5.391
348 HA LEU 46 HA LEU 46 -6.984 0.580 -6.056
349 HB2 LEU 46 HB2 LEU 46 -7.793 -2.050 -7.211
350 HB3 LEU 46 HB3 LEU 46 -7.653 -0.797 -8.417
351 HG LEU 46 HG LEU 46 -5.316 -0.382 -7.822
352 HD11 LEU 46 HD11 LEU 46 -5.230 -0.746 -5.485
353 HD12 LEU 46 HD12 LEU 46 -4.219 -2.003 -6.247
354 HD13 LEU 46 HD13 LEU 46 -5.864 -2.392 -5.669
355 HD21 LEU 46 HD21 LEU 46 -5.890 -2.162 -9.449
356 HD22 LEU 46 HD22 LEU 46 -5.911 -3.359 -8.136
357 HD23 LEU 46 HD23 LEU 46 -4.414 -2.515 -8.572
358 H LEU 47 H LEU 47 -7.389 1.915 -8.083
359 HA LEU 47 HA LEU 47 -9.978 3.173 -7.924
360 HB2 LEU 47 HB2 LEU 47 -9.245 4.497 -9.870
361 HB3 LEU 47 HB3 LEU 47 -8.139 4.564 -8.519
362 HG LEU 47 HG LEU 47 -7.471 2.386 -10.391
363 HD11 LEU 47 HD11 LEU 47 -7.436 5.215 -11.469
364 HD12 LEU 47 HD12 LEU 47 -8.344 3.799 -12.094
365 HD13 LEU 47 HD13 LEU 47 -6.579 3.826 -12.192
366 HD21 LEU 47 HD21 LEU 47 -5.225 3.317 -10.186
367 HD22 LEU 47 HD22 LEU 47 -5.989 3.166 -8.600
368 HD23 LEU 47 HD23 LEU 47 -5.887 4.755 -9.370
369 H THR 48 H THR 48 -8.882 0.401 -9.668
370 HA THR 48 HA THR 48 -10.998 0.611 -11.703
371 HB THR 48 HB THR 48 -8.839 -0.142 -12.456
372 HG1 THR 48 HG1 THR 48 -10.746 -1.150 -13.275
373 HG21 THR 48 HG21 THR 48 -9.048 -2.430 -10.453
374 HG22 THR 48 HG22 THR 48 -7.815 -1.141 -10.515
375 HG23 THR 48 HG23 THR 48 -7.894 -2.332 -11.797
376 H GLY 49 H GLY 49 -10.785 -0.392 -8.461
377 HA2 GLY 49 HA2 GLY 49 -12.808 -1.030 -7.384
378 HA3 GLY 49 HA3 GLY 49 -13.257 -2.011 -8.757
379 H HIS 50 H HIS 50 -10.187 -2.919 -8.658
380 HA HIS 50 HA HIS 50 -10.595 -5.475 -7.637
381 HB2 HIS 50 HB2 HIS 50 -8.315 -3.747 -8.521
382 HB3 HIS 50 HB3 HIS 50 -7.872 -5.000 -7.391
383 HD1 HIS 50 HD1 HIS 50 -9.989 -5.142 -10.760
384 HD2 HIS 50 HD2 HIS 50 -6.728 -6.754 -8.608
385 HE1 HIS 50 HE1 HIS 50 -8.971 -6.877 -12.234
386 H VAL 51 H VAL 51 -10.095 -6.466 -5.630
387 HA VAL 51 HA VAL 51 -9.195 -4.649 -3.456
388 HB VAL 51 HB VAL 51 -10.657 -5.994 -1.906
389 HG11 VAL 51 HG11 VAL 51 -12.127 -4.430 -4.056
390 HG12 VAL 51 HG12 VAL 51 -12.725 -4.795 -2.428
391 HG13 VAL 51 HG13 VAL 51 -11.302 -3.764 -2.620
392 HG21 VAL 51 HG21 VAL 51 -11.082 -7.988 -3.349
393 HG22 VAL 51 HG22 VAL 51 -12.564 -7.235 -2.775
394 HG23 VAL 51 HG23 VAL 51 -12.041 -6.972 -4.441
395 H GLY 52 H GLY 52 -7.723 -5.539 -1.869
396 HA2 GLY 52 HA2 GLY 52 -7.179 -8.213 -1.357
397 HA3 GLY 52 HA3 GLY 52 -6.134 -7.736 -2.695
398 H LEU 53 H LEU 53 -4.559 -8.212 -0.763
399 HA LEU 53 HA LEU 53 -4.197 -5.985 1.156
400 HB2 LEU 53 HB2 LEU 53 -2.865 -8.667 0.604
401 HB3 LEU 53 HB3 LEU 53 -2.197 -7.531 1.749
402 HG LEU 53 HG LEU 53 -5.047 -8.459 2.047
403 HD11 LEU 53 HD11 LEU 53 -4.217 -10.208 3.533
404 HD12 LEU 53 HD12 LEU 53 -2.517 -9.735 3.229
405 HD13 LEU 53 HD13 LEU 53 -3.522 -10.431 1.937
406 HD21 LEU 53 HD21 LEU 53 -4.838 -7.825 4.326
407 HD22 LEU 53 HD22 LEU 53 -4.252 -6.459 3.371
408 HD23 LEU 53 HD23 LEU 53 -3.097 -7.548 4.160
409 H TYR 54 H TYR 54 -2.504 -4.436 0.884
410 HA TYR 54 HA TYR 54 -0.685 -4.776 -1.420
411 HB2 TYR 54 HB2 TYR 54 -0.916 -2.606 -2.127
412 HB3 TYR 54 HB3 TYR 54 -2.549 -3.099 -1.909
413 HD1 TYR 54 HD1 TYR 54 -3.938 -2.084 -0.129
414 HD2 TYR 54 HD2 TYR 54 0.204 -0.981 -0.594
415 HE1 TYR 54 HE1 TYR 54 -4.309 -0.098 1.303
416 HE2 TYR 54 HE2 TYR 54 -0.150 0.957 0.850
417 HH TYR 54 HH TYR 54 -1.610 2.010 2.374
418 HA PRO 55 HA PRO 55 1.990 -4.154 2.060
419 HB2 PRO 55 HB2 PRO 55 4.422 -3.833 0.916
420 HB3 PRO 55 HB3 PRO 55 3.534 -5.376 0.916
421 HG2 PRO 55 HG2 PRO 55 3.741 -3.366 -1.325
422 HG3 PRO 55 HG3 PRO 55 3.882 -5.147 -1.413
423 HD2 PRO 55 HD2 PRO 55 1.525 -3.834 -2.000
424 HD3 PRO 55 HD3 PRO 55 1.584 -5.456 -1.288
425 H ALA 56 H ALA 56 1.500 -2.323 3.162
426 HA ALA 56 HA ALA 56 1.304 0.279 2.082
427 HB1 ALA 56 HB1 ALA 56 0.937 1.004 4.327
428 HB2 ALA 56 HB2 ALA 56 0.238 -0.621 4.232
429 HB3 ALA 56 HB3 ALA 56 1.806 -0.372 5.013
430 H ASN 57 H ASN 57 4.016 -1.508 3.375
431 HA ASN 57 HA ASN 57 5.787 0.659 3.878
432 HB2 ASN 57 HB2 ASN 57 6.316 -2.223 3.034
433 HB3 ASN 57 HB3 ASN 57 7.532 -1.123 3.641
434 HD21 ASN 57 HD21 ASN 57 6.903 -3.658 4.797
435 HD22 ASN 57 HD22 ASN 57 6.279 -3.375 6.406
436 H TYR 58 H TYR 58 4.498 -0.348 0.850
437 HA TYR 58 HA TYR 58 6.840 0.626 -0.665
438 HB2 TYR 58 HB2 TYR 58 4.714 -1.396 -1.271
439 HB3 TYR 58 HB3 TYR 58 5.644 -0.641 -2.544
440 HD1 TYR 58 HD1 TYR 58 6.080 -2.505 0.671
441 HD2 TYR 58 HD2 TYR 58 7.734 -1.581 -3.196
442 HE1 TYR 58 HE1 TYR 58 7.986 -3.962 1.146
443 HE2 TYR 58 HE2 TYR 58 9.670 -2.995 -2.712
444 HH TYR 58 HH TYR 58 10.789 -4.329 -1.091
445 H VAL 59 H VAL 59 4.291 2.192 0.571
446 HA VAL 59 HA VAL 59 4.048 3.910 -1.831
447 HB VAL 59 HB VAL 59 1.674 4.042 -1.788
448 HG11 VAL 59 HG11 VAL 59 2.514 1.999 -2.950
449 HG12 VAL 59 HG12 VAL 59 2.216 1.066 -1.461
450 HG13 VAL 59 HG13 VAL 59 0.876 1.823 -2.327
451 HG21 VAL 59 HG21 VAL 59 0.260 2.752 -0.225
452 HG22 VAL 59 HG22 VAL 59 1.709 2.305 0.708
453 HG23 VAL 59 HG23 VAL 59 1.189 4.000 0.587
454 H GLU 60 H GLU 60 2.885 6.069 -1.233
455 HA GLU 60 HA GLU 60 3.131 6.721 1.622
456 HB2 GLU 60 HB2 GLU 60 5.351 7.139 0.678
457 HB3 GLU 60 HB3 GLU 60 4.663 8.222 -0.545
458 HG2 GLU 60 HG2 GLU 60 4.205 9.903 1.021
459 HG3 GLU 60 HG3 GLU 60 4.025 8.762 2.356
460 H LYS 61 H LYS 61 1.919 8.597 2.176
461 HA LYS 61 HA LYS 61 -0.493 8.883 0.697
462 HB2 LYS 61 HB2 LYS 61 -0.059 9.089 3.207
463 HB3 LYS 61 HB3 LYS 61 0.519 10.726 2.909
464 HG2 LYS 61 HG2 LYS 61 -1.666 11.468 2.277
465 HG3 LYS 61 HG3 LYS 61 -2.244 9.813 1.981
466 HD2 LYS 61 HD2 LYS 61 -2.077 9.278 4.357
467 HD3 LYS 61 HD3 LYS 61 -1.441 10.907 4.713
468 HE2 LYS 61 HE2 LYS 61 -3.644 11.836 3.887
469 HE3 LYS 61 HE3 LYS 61 -4.208 10.155 3.684
470 HZ1 LYS 61 HZ1 LYS 61 -3.579 9.894 6.103
471 HZ2 LYS 61 HZ2 LYS 61 -4.913 10.824 5.829
472 HZ3 LYS 61 HZ3 LYS 61 -3.443 11.495 6.192
473 H VAL 62 H VAL 62 -1.392 10.863 -0.193
474 HA VAL 62 HA VAL 62 0.532 12.886 -1.129
475 HB VAL 62 HB VAL 62 0.488 10.907 -2.666
476 HG11 VAL 62 HG11 VAL 62 -2.357 11.764 -3.307
477 HG12 VAL 62 HG12 VAL 62 -1.406 10.592 -4.202
478 HG13 VAL 62 HG13 VAL 62 -1.858 10.245 -2.530
479 HG21 VAL 62 HG21 VAL 62 -0.464 13.464 -3.965
480 HG22 VAL 62 HG22 VAL 62 1.207 13.105 -3.443
481 HG23 VAL 62 HG23 VAL 62 0.444 12.122 -4.715
482 H GLY 63 H GLY 63 -1.623 12.768 0.822
483 HA2 GLY 63 HA2 GLY 63 -3.931 14.229 -0.302
484 HA3 GLY 63 HA3 GLY 63 -3.756 13.641 1.340
485 H LEU 64 H LEU 64 -1.775 14.789 2.569
486 HA LEU 64 HA LEU 64 -1.892 17.720 2.063
487 HB2 LEU 64 HB2 LEU 64 -2.235 16.136 4.632
488 HB3 LEU 64 HB3 LEU 64 -2.025 17.887 4.585
489 HG LEU 64 HG LEU 64 -4.377 16.458 3.265
490 HD11 LEU 64 HD11 LEU 64 -4.186 17.733 6.023
491 HD12 LEU 64 HD12 LEU 64 -4.343 16.002 5.684
492 HD13 LEU 64 HD13 LEU 64 -5.663 17.104 5.259
493 HD21 LEU 64 HD21 LEU 64 -3.893 19.379 4.036
494 HD22 LEU 64 HD22 LEU 64 -5.364 18.717 3.308
495 HD23 LEU 64 HD23 LEU 64 -3.871 18.722 2.381
496 H ALA 65 H ALA 65 -0.187 18.884 2.935
497 HA ALA 65 HA ALA 65 2.346 17.411 3.318
498 HB1 ALA 65 HB1 ALA 65 2.370 19.405 1.853
499 HB2 ALA 65 HB2 ALA 65 1.714 20.408 3.174
500 HB3 ALA 65 HB3 ALA 65 3.336 19.692 3.310
501 H ALA 66 H ALA 66 1.422 16.378 5.174
502 HA ALA 66 HA ALA 66 1.531 17.951 7.685
503 HB1 ALA 66 HB1 ALA 66 -0.471 16.688 8.515
504 HB2 ALA 66 HB2 ALA 66 -0.860 17.814 7.211
505 HB3 ALA 66 HB3 ALA 66 -0.758 16.087 6.866
506 H ALA 67 H ALA 67 0.449 14.600 7.177
507 HA ALA 67 HA ALA 67 2.913 13.247 7.610
508 HB1 ALA 67 HB1 ALA 67 2.424 14.042 9.931
509 HB2 ALA 67 HB2 ALA 67 0.774 13.394 9.801
510 HB3 ALA 67 HB3 ALA 67 2.177 12.293 9.802
511 H1 THR 101 H THR 101 -1.641 -12.185 11.052
512 HA THR 101 HA THR 101 -0.802 -10.537 9.404
513 HB THR 101 HB THR 101 1.636 -12.343 9.462
514 HG1 THR 101 HG1 THR 101 2.602 -10.439 10.360
515 HG21 THR 101 HG21 THR 101 2.594 -10.844 7.869
516 HG22 THR 101 HG22 THR 101 1.314 -9.646 8.143
517 HG23 THR 101 HG23 THR 101 0.948 -11.103 7.254
518 H LYS 102 H LYS 102 -1.488 -10.892 7.376
519 HA LYS 102 HA LYS 102 -2.822 -13.402 6.760
520 HB2 LYS 102 HB2 LYS 102 -2.429 -10.792 5.232
521 HB3 LYS 102 HB3 LYS 102 -3.388 -12.133 4.644
522 HG2 LYS 102 HG2 LYS 102 -5.062 -10.952 5.444
523 HG3 LYS 102 HG3 LYS 102 -4.727 -11.857 6.902
524 HD2 LYS 102 HD2 LYS 102 -3.696 -9.913 7.919
525 HD3 LYS 102 HD3 LYS 102 -3.581 -9.082 6.340
526 HE2 LYS 102 HE2 LYS 102 -6.031 -9.014 6.171
527 HE3 LYS 102 HE3 LYS 102 -6.184 -9.818 7.736
528 HZ1 LYS 102 HZ1 LYS 102 -4.825 -7.180 7.448
529 HZ2 LYS 102 HZ2 LYS 102 -5.406 -7.924 8.820
530 HZ3 LYS 102 HZ3 LYS 102 -6.421 -7.353 7.675
531 H GLY 103 H GLY 103 0.428 -12.530 6.290
532 HA2 GLY 103 HA2 GLY 103 1.417 -14.610 4.980
533 HA3 GLY 103 HA3 GLY 103 0.878 -13.575 3.640
534 HA PRO 104 HA PRO 104 4.780 -11.726 5.809
535 HB2 PRO 104 HB2 PRO 104 6.855 -12.677 4.269
536 HB3 PRO 104 HB3 PRO 104 6.244 -13.528 5.720
537 HG2 PRO 104 HG2 PRO 104 5.561 -14.062 2.813
538 HG3 PRO 104 HG3 PRO 104 6.025 -15.256 4.062
539 HD2 PRO 104 HD2 PRO 104 3.422 -14.782 3.415
540 HD3 PRO 104 HD3 PRO 104 3.906 -15.118 5.098
541 H ALA 105 H ALA 105 4.922 -9.628 4.967
542 HA ALA 105 HA ALA 105 4.224 -9.039 2.207
543 HB1 ALA 105 HB1 ALA 105 3.632 -7.550 4.196
544 HB2 ALA 105 HB2 ALA 105 5.361 -7.214 4.383
545 HB3 ALA 105 HB3 ALA 105 4.499 -6.700 2.930
546 HA PRO 106 HA PRO 106 8.408 -8.983 0.673
547 HB2 PRO 106 HB2 PRO 106 8.434 -6.261 -0.417
548 HB3 PRO 106 HB3 PRO 106 8.375 -7.790 -1.287
549 HG2 PRO 106 HG2 PRO 106 6.238 -6.001 -1.142
550 HG3 PRO 106 HG3 PRO 106 6.045 -7.781 -1.363
551 HD2 PRO 106 HD2 PRO 106 5.834 -6.161 1.163
552 HD3 PRO 106 HD3 PRO 106 4.782 -7.484 0.599
553 H ASN 107 H ASN 107 9.952 -8.863 2.291
554 HA ASN 107 HA ASN 107 10.536 -6.232 3.507
555 HB2 ASN 107 HB2 ASN 107 10.377 -6.956 5.758
556 HB3 ASN 107 HB3 ASN 107 8.892 -7.444 4.962
557 HD21 ASN 107 HD21 ASN 107 11.098 -8.610 7.262
558 HD22 ASN 107 HD22 ASN 107 10.970 -10.287 6.830
559 HA PRO 108 HA PRO 108 12.166 -5.602 5.378
560 HB2 PRO 108 HB2 PRO 108 14.551 -4.244 5.011
561 HB3 PRO 108 HB3 PRO 108 14.296 -5.584 6.167
562 HG2 PRO 108 HG2 PRO 108 15.494 -5.693 3.406
563 HG3 PRO 108 HG3 PRO 108 16.110 -6.443 4.915
564 HD2 PRO 108 HD2 PRO 108 14.668 -7.805 3.064
565 HD3 PRO 108 HD3 PRO 108 14.528 -8.163 4.804
566 HA PRO 109 HA PRO 109 10.677 -2.700 2.467
567 HB2 PRO 109 HB2 PRO 109 11.417 -0.163 3.379
568 HB3 PRO 109 HB3 PRO 109 10.138 -1.196 4.078
569 HG2 PRO 109 HG2 PRO 109 13.019 -0.923 4.952
570 HG3 PRO 109 HG3 PRO 109 11.537 -0.841 5.962
571 HD2 PRO 109 HD2 PRO 109 12.946 -3.110 5.800
572 HD3 PRO 109 HD3 PRO 109 11.165 -3.178 5.749
573 HA PRO 110 HA PRO 110 13.566 -1.457 -0.656
574 HB2 PRO 110 HB2 PRO 110 12.110 0.154 -2.246
575 HB3 PRO 110 HB3 PRO 110 11.524 -1.486 -1.867
576 HG2 PRO 110 HG2 PRO 110 10.780 1.109 -0.471
577 HG3 PRO 110 HG3 PRO 110 9.665 -0.104 -1.177
578 HD2 PRO 110 HD2 PRO 110 10.403 -0.035 1.468
579 HD3 PRO 110 HD3 PRO 110 9.999 -1.559 0.628
580 H ILE 111 H ILE 111 13.740 1.137 -1.902
581 HA ILE 111 HA ILE 111 15.403 2.535 0.045
582 HB ILE 111 HB ILE 111 15.889 4.060 -1.776
583 HG12 ILE 111 HG12 ILE 111 13.652 3.791 -2.993
584 HG13 ILE 111 HG13 ILE 111 15.114 4.061 -3.908
585 HG21 ILE 111 HG21 ILE 111 17.302 2.142 -1.468
586 HG22 ILE 111 HG22 ILE 111 16.242 1.109 -2.447
587 HG23 ILE 111 HG23 ILE 111 17.123 2.452 -3.199
588 HD11 ILE 111 HD11 ILE 111 13.607 2.456 -4.974
589 HD12 ILE 111 HD12 ILE 111 15.183 1.744 -4.620
590 HD13 ILE 111 HD13 ILE 111 13.768 1.345 -3.610
591 H LEU 112 H LEU 112 15.011 5.095 0.070
592 HA LEU 112 HA LEU 112 13.797 6.807 0.903
593 HB2 LEU 112 HB2 LEU 112 11.415 5.649 -0.599
594 HB3 LEU 112 HB3 LEU 112 11.408 7.122 0.326
595 HG LEU 112 HG LEU 112 11.531 7.761 -1.883
596 HD11 LEU 112 HD11 LEU 112 14.402 8.000 -0.902
597 HD12 LEU 112 HD12 LEU 112 13.044 9.014 -0.352
598 HD13 LEU 112 HD13 LEU 112 13.548 9.039 -2.048
599 HD21 LEU 112 HD21 LEU 112 12.278 5.657 -2.911
600 HD22 LEU 112 HD22 LEU 112 13.946 5.984 -2.347
601 HD23 LEU 112 HD23 LEU 112 13.174 7.044 -3.518
602 H LYS 113 H LYS 113 14.245 6.037 2.946
603 HA LYS 113 HA LYS 113 11.975 4.698 4.372
604 HB2 LYS 113 HB2 LYS 113 14.967 4.507 4.864
605 HB3 LYS 113 HB3 LYS 113 13.730 3.854 5.935
606 HG2 LYS 113 HG2 LYS 113 12.836 2.499 3.963
607 HG3 LYS 113 HG3 LYS 113 14.233 3.036 3.030
608 HD2 LYS 113 HD2 LYS 113 14.285 1.360 5.573
609 HD3 LYS 113 HD3 LYS 113 14.581 0.803 3.914
610 HE2 LYS 113 HE2 LYS 113 16.459 2.539 3.798
611 HE3 LYS 113 HE3 LYS 113 16.245 2.754 5.550
612 HZ1 LYS 113 HZ1 LYS 113 17.121 0.337 4.122
613 HZ2 LYS 113 HZ2 LYS 113 16.616 0.270 5.667
614 HZ3 LYS 113 HZ3 LYS 113 17.940 1.197 5.245
615 H VAL 114 H VAL 114 14.607 7.067 4.702
616 HA VAL 114 HA VAL 114 12.849 8.608 6.538
617 HB VAL 114 HB VAL 114 14.727 9.229 7.913
618 HG11 VAL 114 HG11 VAL 114 14.484 6.191 7.800
619 HG12 VAL 114 HG12 VAL 114 14.934 7.190 9.197
620 HG13 VAL 114 HG13 VAL 114 13.303 7.296 8.536
621 HG21 VAL 114 HG21 VAL 114 16.848 7.870 7.904
622 HG22 VAL 114 HG22 VAL 114 16.395 7.218 6.313
623 HG23 VAL 114 HG23 VAL 114 16.711 8.960 6.547
624 H TRP 115 H TRP 115 15.937 8.791 4.700
625 HA TRP 115 HA TRP 115 15.343 11.465 3.687
626 HB2 TRP 115 HB2 TRP 115 17.458 9.335 3.101
627 HB3 TRP 115 HB3 TRP 115 17.313 10.802 2.146
628 HD1 TRP 115 HD1 TRP 115 19.653 9.640 4.284
629 HE1 TRP 115 HE1 TRP 115 20.913 11.562 5.495
630 HE3 TRP 115 HE3 TRP 115 16.290 13.448 3.597
631 HZ2 TRP 115 HZ2 TRP 115 20.509 14.283 6.095
632 HZ3 TRP 115 HZ3 TRP 115 16.851 15.728 4.327
633 HH2 TRP 115 HH2 TRP 115 19.003 16.179 5.499
Start of MODEL 6
1 H1 MET 1 H MET 1 -17.492 8.529 4.547
2 HA MET 1 HA MET 1 -19.661 9.062 5.510
3 HB2 MET 1 HB2 MET 1 -21.411 7.433 5.671
4 HB3 MET 1 HB3 MET 1 -21.035 7.783 3.986
5 HG2 MET 1 HG2 MET 1 -19.786 5.672 3.802
6 HG3 MET 1 HG3 MET 1 -20.100 5.308 5.503
7 HE1 MET 1 HE1 MET 1 -20.665 3.025 3.873
8 HE2 MET 1 HE2 MET 1 -22.193 2.897 2.968
9 HE3 MET 1 HE3 MET 1 -20.869 3.913 2.354
10 H LYS 2 H LYS 2 -17.577 6.129 5.845
11 HA LYS 2 HA LYS 2 -17.515 6.690 8.751
12 HB2 LYS 2 HB2 LYS 2 -19.202 4.881 8.311
13 HB3 LYS 2 HB3 LYS 2 -17.949 3.899 7.573
14 HG2 LYS 2 HG2 LYS 2 -16.637 4.097 9.742
15 HG3 LYS 2 HG3 LYS 2 -18.015 4.927 10.452
16 HD2 LYS 2 HD2 LYS 2 -18.109 2.128 9.231
17 HD3 LYS 2 HD3 LYS 2 -17.820 2.447 10.930
18 HE2 LYS 2 HE2 LYS 2 -20.328 3.289 9.429
19 HE3 LYS 2 HE3 LYS 2 -20.178 1.821 10.391
20 HZ1 LYS 2 HZ1 LYS 2 -19.755 3.231 12.331
21 HZ2 LYS 2 HZ2 LYS 2 -21.226 3.559 11.653
22 HZ3 LYS 2 HZ3 LYS 2 -19.986 4.586 11.434
23 H VAL 3 H VAL 3 -16.275 4.183 6.489
24 HA VAL 3 HA VAL 3 -13.501 4.979 7.204
25 HB VAL 3 HB VAL 3 -14.526 2.251 6.329
26 HG11 VAL 3 HG11 VAL 3 -11.800 3.107 7.408
27 HG12 VAL 3 HG12 VAL 3 -12.277 1.484 6.877
28 HG13 VAL 3 HG13 VAL 3 -12.148 2.782 5.696
29 HG21 VAL 3 HG21 VAL 3 -13.909 1.572 8.675
30 HG22 VAL 3 HG22 VAL 3 -13.778 3.290 9.097
31 HG23 VAL 3 HG23 VAL 3 -15.333 2.592 8.572
32 HA PRO 4 HA PRO 4 -14.362 5.939 2.769
33 HB2 PRO 4 HB2 PRO 4 -12.952 8.228 2.498
34 HB3 PRO 4 HB3 PRO 4 -14.514 8.222 3.372
35 HG2 PRO 4 HG2 PRO 4 -11.716 8.020 4.558
36 HG3 PRO 4 HG3 PRO 4 -13.036 9.135 5.021
37 HD2 PRO 4 HD2 PRO 4 -12.566 6.782 6.342
38 HD3 PRO 4 HD3 PRO 4 -14.215 7.456 6.136
39 H GLY 5 H GLY 5 -12.453 6.350 0.954
40 HA2 GLY 5 HA2 GLY 5 -10.476 4.304 1.364
41 HA3 GLY 5 HA3 GLY 5 -10.592 5.540 0.070
42 H VAL 6 H VAL 6 -8.315 4.683 2.235
43 HA VAL 6 HA VAL 6 -7.890 7.493 3.230
44 HB VAL 6 HB VAL 6 -6.202 5.113 4.010
45 HG11 VAL 6 HG11 VAL 6 -5.634 6.536 5.914
46 HG12 VAL 6 HG12 VAL 6 -5.254 7.352 4.395
47 HG13 VAL 6 HG13 VAL 6 -6.709 7.815 5.311
48 HG21 VAL 6 HG21 VAL 6 -8.477 4.523 4.711
49 HG22 VAL 6 HG22 VAL 6 -7.581 5.083 6.129
50 HG23 VAL 6 HG23 VAL 6 -8.743 6.162 5.335
51 H ARG 7 H ARG 7 -6.820 8.695 1.940
52 HA ARG 7 HA ARG 7 -5.669 7.836 -0.519
53 HB2 ARG 7 HB2 ARG 7 -5.054 10.186 -0.789
54 HB3 ARG 7 HB3 ARG 7 -6.725 9.953 -0.323
55 HG2 ARG 7 HG2 ARG 7 -5.514 10.369 2.147
56 HG3 ARG 7 HG3 ARG 7 -4.457 11.301 1.090
57 HD2 ARG 7 HD2 ARG 7 -7.281 11.763 0.455
58 HD3 ARG 7 HD3 ARG 7 -6.975 11.958 2.181
59 HE ARG 7 HE ARG 7 -6.083 13.961 1.760
60 HH11 ARG 7 HH11 ARG 7 -5.554 12.055 -1.242
61 HH12 ARG 7 HH12 ARG 7 -4.730 13.312 -2.050
62 HH21 ARG 7 HH21 ARG 7 -5.171 15.676 0.588
63 HH22 ARG 7 HH22 ARG 7 -4.725 15.505 -1.087
64 H VAL 8 H VAL 8 -3.889 6.947 -0.828
65 HA VAL 8 HA VAL 8 -1.469 7.859 0.639
66 HB VAL 8 HB VAL 8 -0.670 5.556 0.973
67 HG11 VAL 8 HG11 VAL 8 -1.780 6.751 2.840
68 HG12 VAL 8 HG12 VAL 8 -3.336 6.041 2.370
69 HG13 VAL 8 HG13 VAL 8 -2.012 5.005 2.935
70 HG21 VAL 8 HG21 VAL 8 -2.096 4.418 -0.712
71 HG22 VAL 8 HG22 VAL 8 -2.145 3.637 0.885
72 HG23 VAL 8 HG23 VAL 8 -3.503 4.651 0.357
73 H ARG 9 H ARG 9 0.553 7.193 -0.414
74 HA ARG 9 HA ARG 9 0.329 6.703 -3.320
75 HB2 ARG 9 HB2 ARG 9 0.524 9.222 -2.765
76 HB3 ARG 9 HB3 ARG 9 2.128 8.847 -2.117
77 HG2 ARG 9 HG2 ARG 9 2.658 7.810 -4.420
78 HG3 ARG 9 HG3 ARG 9 1.099 8.452 -4.955
79 HD2 ARG 9 HD2 ARG 9 2.639 10.072 -5.643
80 HD3 ARG 9 HD3 ARG 9 1.950 10.751 -4.172
81 HE ARG 9 HE ARG 9 3.959 10.025 -2.946
82 HH11 ARG 9 HH11 ARG 9 4.384 10.351 -6.506
83 HH12 ARG 9 HH12 ARG 9 6.103 10.436 -6.358
84 HH21 ARG 9 HH21 ARG 9 6.079 10.218 -2.802
85 HH22 ARG 9 HH22 ARG 9 7.124 10.461 -4.163
86 H ALA 10 H ALA 10 2.005 5.371 -3.992
87 HA ALA 10 HA ALA 10 3.498 4.068 -1.815
88 HB1 ALA 10 HB1 ALA 10 3.671 3.560 -4.790
89 HB2 ALA 10 HB2 ALA 10 4.398 2.584 -3.512
90 HB3 ALA 10 HB3 ALA 10 2.629 2.681 -3.621
91 H LEU 11 H LEU 11 5.567 4.201 -1.341
92 HA LEU 11 HA LEU 11 7.087 6.471 -2.429
93 HB2 LEU 11 HB2 LEU 11 7.741 4.398 -0.292
94 HB3 LEU 11 HB3 LEU 11 8.687 5.849 -0.642
95 HG LEU 11 HG LEU 11 5.818 5.811 0.424
96 HD11 LEU 11 HD11 LEU 11 6.895 6.638 2.515
97 HD12 LEU 11 HD12 LEU 11 8.480 6.368 1.760
98 HD13 LEU 11 HD13 LEU 11 7.399 4.994 2.077
99 HD21 LEU 11 HD21 LEU 11 7.731 8.152 0.005
100 HD22 LEU 11 HD22 LEU 11 6.158 8.231 0.822
101 HD23 LEU 11 HD23 LEU 11 6.229 7.852 -0.895
102 H TYR 12 H TYR 12 7.037 2.906 -2.710
103 HA TYR 12 HA TYR 12 9.248 3.125 -4.664
104 HB2 TYR 12 HB2 TYR 12 9.093 0.821 -2.721
105 HB3 TYR 12 HB3 TYR 12 10.440 1.329 -3.710
106 HD1 TYR 12 HD1 TYR 12 8.773 1.626 -0.505
107 HD2 TYR 12 HD2 TYR 12 11.702 3.558 -3.034
108 HE1 TYR 12 HE1 TYR 12 9.597 2.889 1.425
109 HE2 TYR 12 HE2 TYR 12 12.461 4.889 -1.120
110 HH TYR 12 HH TYR 12 11.035 4.547 2.155
111 H ASP 13 H ASP 13 9.393 1.226 -6.090
112 HA ASP 13 HA ASP 13 6.747 0.316 -7.003
113 HB2 ASP 13 HB2 ASP 13 8.262 1.139 -8.658
114 HB3 ASP 13 HB3 ASP 13 9.573 0.108 -8.098
115 H TYR 14 H TYR 14 5.922 -1.477 -5.959
116 HA TYR 14 HA TYR 14 7.522 -3.945 -5.878
117 HB2 TYR 14 HB2 TYR 14 6.502 -2.371 -3.560
118 HB3 TYR 14 HB3 TYR 14 6.107 -4.042 -3.513
119 HD1 TYR 14 HD1 TYR 14 7.623 -5.773 -2.886
120 HD2 TYR 14 HD2 TYR 14 9.138 -1.853 -3.941
121 HE1 TYR 14 HE1 TYR 14 9.858 -6.437 -2.189
122 HE2 TYR 14 HE2 TYR 14 11.425 -2.574 -3.309
123 HH TYR 14 HH TYR 14 12.024 -5.824 -1.884
124 H THR 15 H THR 15 6.017 -5.888 -5.849
125 HA THR 15 HA THR 15 3.181 -5.161 -6.479
126 HB THR 15 HB THR 15 4.335 -5.298 -8.528
127 HG1 THR 15 HG1 THR 15 3.163 -7.836 -8.414
128 HG21 THR 15 HG21 THR 15 6.374 -6.510 -8.054
129 HG22 THR 15 HG22 THR 15 5.516 -7.236 -9.412
130 HG23 THR 15 HG23 THR 15 5.470 -8.021 -7.826
131 H GLY 16 H GLY 16 2.782 -5.734 -4.250
132 HA2 GLY 16 HA2 GLY 16 2.182 -7.148 -2.545
133 HA3 GLY 16 HA3 GLY 16 1.749 -8.284 -3.841
134 H GLN 17 H GLN 17 2.370 -10.054 -2.334
135 HA GLN 17 HA GLN 17 5.274 -10.547 -2.369
136 HB2 GLN 17 HB2 GLN 17 4.010 -9.937 -0.049
137 HB3 GLN 17 HB3 GLN 17 3.655 -11.642 -0.087
138 HG2 GLN 17 HG2 GLN 17 6.477 -10.504 -0.369
139 HG3 GLN 17 HG3 GLN 17 5.751 -10.912 1.176
140 HE21 GLN 17 HE21 GLN 17 7.786 -12.169 -1.239
141 HE22 GLN 17 HE22 GLN 17 7.489 -13.878 -0.881
142 H GLU 18 H GLU 18 1.931 -11.679 -2.628
143 HA GLU 18 HA GLU 18 2.873 -14.083 -4.049
144 HB2 GLU 18 HB2 GLU 18 1.926 -14.106 -1.407
145 HB3 GLU 18 HB3 GLU 18 0.462 -14.348 -2.353
146 HG2 GLU 18 HG2 GLU 18 1.110 -16.512 -2.141
147 HG3 GLU 18 HG3 GLU 18 1.925 -16.145 -3.638
148 H ALA 19 H ALA 19 0.650 -15.123 -4.943
149 HA ALA 19 HA ALA 19 -0.300 -13.329 -6.916
150 HB1 ALA 19 HB1 ALA 19 -1.756 -15.216 -7.542
151 HB2 ALA 19 HB2 ALA 19 -0.084 -15.738 -7.268
152 HB3 ALA 19 HB3 ALA 19 -1.336 -16.056 -6.037
153 H ASP 20 H ASP 20 -1.882 -14.325 -3.850
154 HA ASP 20 HA ASP 20 -4.436 -13.166 -4.670
155 HB2 ASP 20 HB2 ASP 20 -3.579 -14.077 -1.917
156 HB3 ASP 20 HB3 ASP 20 -5.220 -13.697 -2.431
157 H GLU 21 H GLU 21 -1.931 -11.381 -4.333
158 HA GLU 21 HA GLU 21 -3.127 -9.356 -2.478
159 HB2 GLU 21 HB2 GLU 21 -0.257 -9.992 -3.129
160 HB3 GLU 21 HB3 GLU 21 -0.745 -8.506 -2.326
161 HG2 GLU 21 HG2 GLU 21 -1.038 -9.516 -0.340
162 HG3 GLU 21 HG3 GLU 21 -2.089 -10.744 -1.007
163 H LEU 22 H LEU 22 -2.316 -7.156 -3.071
164 HA LEU 22 HA LEU 22 -3.286 -6.481 -5.742
165 HB2 LEU 22 HB2 LEU 22 -3.818 -5.507 -3.294
166 HB3 LEU 22 HB3 LEU 22 -2.366 -4.568 -3.569
167 HG LEU 22 HG LEU 22 -3.402 -3.463 -5.443
168 HD11 LEU 22 HD11 LEU 22 -5.939 -3.945 -5.865
169 HD12 LEU 22 HD12 LEU 22 -5.590 -5.537 -5.156
170 HD13 LEU 22 HD13 LEU 22 -4.748 -5.018 -6.596
171 HD21 LEU 22 HD21 LEU 22 -5.353 -2.387 -4.247
172 HD22 LEU 22 HD22 LEU 22 -3.869 -2.503 -3.290
173 HD23 LEU 22 HD23 LEU 22 -5.208 -3.630 -3.008
174 H SER 23 H SER 23 -2.012 -4.499 -6.772
175 HA SER 23 HA SER 23 0.917 -4.678 -6.394
176 HB2 SER 23 HB2 SER 23 0.905 -4.829 -9.028
177 HB3 SER 23 HB3 SER 23 0.699 -6.301 -8.058
178 HG SER 23 HG SER 23 -1.217 -6.568 -8.705
179 H PHE 24 H PHE 24 1.792 -2.554 -6.535
180 HA PHE 24 HA PHE 24 0.179 -0.543 -8.017
181 HB2 PHE 24 HB2 PHE 24 0.360 1.002 -6.190
182 HB3 PHE 24 HB3 PHE 24 -0.556 -0.394 -5.741
183 HD1 PHE 24 HD1 PHE 24 3.044 0.800 -5.550
184 HD2 PHE 24 HD2 PHE 24 -0.184 -1.328 -3.637
185 HE1 PHE 24 HE1 PHE 24 4.529 0.244 -3.642
186 HE2 PHE 24 HE2 PHE 24 1.261 -1.699 -1.663
187 HZ PHE 24 HZ PHE 24 3.619 -0.978 -1.677
188 H LYS 25 H LYS 25 1.599 1.442 -8.500
189 HA LYS 25 HA LYS 25 4.433 0.538 -8.913
190 HB2 LYS 25 HB2 LYS 25 2.545 2.258 -10.533
191 HB3 LYS 25 HB3 LYS 25 4.275 2.499 -10.661
192 HG2 LYS 25 HG2 LYS 25 3.572 1.045 -12.409
193 HG3 LYS 25 HG3 LYS 25 4.612 0.162 -11.280
194 HD2 LYS 25 HD2 LYS 25 2.588 -0.903 -10.308
195 HD3 LYS 25 HD3 LYS 25 1.591 -0.110 -11.541
196 HE2 LYS 25 HE2 LYS 25 2.758 -1.291 -13.302
197 HE3 LYS 25 HE3 LYS 25 4.039 -1.805 -12.189
198 HZ1 LYS 25 HZ1 LYS 25 2.431 -3.192 -11.038
199 HZ2 LYS 25 HZ2 LYS 25 2.571 -3.597 -12.604
200 HZ3 LYS 25 HZ3 LYS 25 1.252 -2.751 -12.137
201 H ALA 26 H ALA 26 6.096 2.292 -8.953
202 HA ALA 26 HA ALA 26 6.051 3.666 -6.440
203 HB1 ALA 26 HB1 ALA 26 8.104 4.749 -7.202
204 HB2 ALA 26 HB2 ALA 26 8.176 3.024 -7.533
205 HB3 ALA 26 HB3 ALA 26 7.848 4.157 -8.866
206 H GLY 27 H GLY 27 4.971 5.527 -5.934
207 HA2 GLY 27 HA2 GLY 27 4.350 7.726 -6.177
208 HA3 GLY 27 HA3 GLY 27 4.744 7.691 -7.890
209 H GLU 28 H GLU 28 2.883 4.974 -7.694
210 HA GLU 28 HA GLU 28 0.531 6.343 -8.715
211 HB2 GLU 28 HB2 GLU 28 1.313 3.470 -8.218
212 HB3 GLU 28 HB3 GLU 28 -0.403 3.818 -8.220
213 HG2 GLU 28 HG2 GLU 28 1.487 4.550 -10.491
214 HG3 GLU 28 HG3 GLU 28 0.526 3.066 -10.388
215 H GLU 29 H GLU 29 -1.615 6.124 -7.760
216 HA GLU 29 HA GLU 29 -1.525 6.381 -4.768
217 HB2 GLU 29 HB2 GLU 29 -3.426 7.545 -6.846
218 HB3 GLU 29 HB3 GLU 29 -3.687 7.609 -5.097
219 HG2 GLU 29 HG2 GLU 29 -1.527 8.838 -4.839
220 HG3 GLU 29 HG3 GLU 29 -1.390 8.919 -6.598
221 H LEU 30 H LEU 30 -3.033 5.278 -3.533
222 HA LEU 30 HA LEU 30 -5.055 3.596 -4.793
223 HB2 LEU 30 HB2 LEU 30 -4.410 1.770 -3.106
224 HB3 LEU 30 HB3 LEU 30 -3.583 1.829 -4.682
225 HG LEU 30 HG LEU 30 -2.396 2.760 -2.038
226 HD11 LEU 30 HD11 LEU 30 -1.155 0.633 -2.109
227 HD12 LEU 30 HD12 LEU 30 -2.017 0.173 -3.597
228 HD13 LEU 30 HD13 LEU 30 -2.894 0.336 -2.064
229 HD21 LEU 30 HD21 LEU 30 -0.201 2.408 -3.311
230 HD22 LEU 30 HD22 LEU 30 -1.108 3.837 -3.757
231 HD23 LEU 30 HD23 LEU 30 -1.170 2.397 -4.793
232 H MET 31 H MET 31 -6.742 3.114 -3.253
233 HA MET 31 HA MET 31 -6.796 4.964 -0.914
234 HB2 MET 31 HB2 MET 31 -9.041 3.724 -2.579
235 HB3 MET 31 HB3 MET 31 -9.254 4.503 -1.033
236 HG2 MET 31 HG2 MET 31 -7.937 5.858 -3.368
237 HG3 MET 31 HG3 MET 31 -9.672 5.968 -3.045
238 HE1 MET 31 HE1 MET 31 -7.036 8.203 -3.088
239 HE2 MET 31 HE2 MET 31 -8.770 8.492 -3.404
240 HE3 MET 31 HE3 MET 31 -7.926 9.422 -2.144
241 H LYS 32 H LYS 32 -6.326 3.916 0.935
242 HA LYS 32 HA LYS 32 -6.412 1.040 1.115
243 HB2 LYS 32 HB2 LYS 32 -4.949 2.490 2.397
244 HB3 LYS 32 HB3 LYS 32 -6.352 3.189 3.244
245 HG2 LYS 32 HG2 LYS 32 -6.991 0.924 4.085
246 HG3 LYS 32 HG3 LYS 32 -5.496 0.280 3.392
247 HD2 LYS 32 HD2 LYS 32 -5.046 0.607 5.664
248 HD3 LYS 32 HD3 LYS 32 -4.268 2.004 4.898
249 HE2 LYS 32 HE2 LYS 32 -6.164 3.419 5.532
250 HE3 LYS 32 HE3 LYS 32 -7.090 2.006 6.048
251 HZ1 LYS 32 HZ1 LYS 32 -4.547 2.756 7.334
252 HZ2 LYS 32 HZ2 LYS 32 -5.640 1.649 7.832
253 HZ3 LYS 32 HZ3 LYS 32 -6.015 3.256 7.885
254 H ILE 33 H ILE 33 -8.045 -0.351 2.079
255 HA ILE 33 HA ILE 33 -10.457 1.082 2.891
256 HB ILE 33 HB ILE 33 -11.895 -0.329 1.770
257 HG12 ILE 33 HG12 ILE 33 -9.553 -2.050 0.873
258 HG13 ILE 33 HG13 ILE 33 -10.777 -2.480 2.055
259 HG21 ILE 33 HG21 ILE 33 -11.536 0.243 -0.527
260 HG22 ILE 33 HG22 ILE 33 -10.847 1.535 0.449
261 HG23 ILE 33 HG23 ILE 33 -9.783 0.342 -0.309
262 HD11 ILE 33 HD11 ILE 33 -12.524 -2.263 0.252
263 HD12 ILE 33 HD12 ILE 33 -11.192 -2.093 -0.922
264 HD13 ILE 33 HD13 ILE 33 -11.347 -3.573 0.043
265 H SER 34 H SER 34 -8.094 -0.907 4.099
266 HA SER 34 HA SER 34 -9.918 -1.897 6.212
267 HB2 SER 34 HB2 SER 34 -7.748 -3.466 4.776
268 HB3 SER 34 HB3 SER 34 -8.541 -3.982 6.264
269 HG SER 34 HG SER 34 -9.698 -4.942 4.806
270 H GLU 35 H GLU 35 -8.326 -2.858 8.028
271 HA GLU 35 HA GLU 35 -6.680 -0.563 8.851
272 HB2 GLU 35 HB2 GLU 35 -7.512 -3.137 10.273
273 HB3 GLU 35 HB3 GLU 35 -6.565 -1.813 10.995
274 HG2 GLU 35 HG2 GLU 35 -8.481 -0.252 10.295
275 HG3 GLU 35 HG3 GLU 35 -9.437 -1.713 10.005
276 H GLU 36 H GLU 36 -4.587 -1.150 10.026
277 HA GLU 36 HA GLU 36 -2.874 -2.638 8.171
278 HB2 GLU 36 HB2 GLU 36 -2.330 -0.322 9.020
279 HB3 GLU 36 HB3 GLU 36 -2.222 -1.011 10.642
280 HG2 GLU 36 HG2 GLU 36 -0.508 -2.704 9.496
281 HG3 GLU 36 HG3 GLU 36 -0.416 -1.456 8.248
282 H ASP 37 H ASP 37 -2.546 -4.716 8.483
283 HA ASP 37 HA ASP 37 -3.205 -6.036 11.021
284 HB2 ASP 37 HB2 ASP 37 -2.052 -7.012 8.404
285 HB3 ASP 37 HB3 ASP 37 -2.365 -8.076 9.766
286 H GLU 38 H GLU 38 -1.485 -7.547 11.970
287 HA GLU 38 HA GLU 38 0.673 -6.173 12.989
288 HB2 GLU 38 HB2 GLU 38 -0.551 -8.677 13.292
289 HB3 GLU 38 HB3 GLU 38 1.108 -9.094 12.892
290 HG2 GLU 38 HG2 GLU 38 1.943 -7.671 14.721
291 HG3 GLU 38 HG3 GLU 38 0.304 -7.095 15.050
292 H GLN 39 H GLN 39 0.658 -7.483 9.866
293 HA GLN 39 HA GLN 39 3.636 -7.620 9.723
294 HB2 GLN 39 HB2 GLN 39 1.777 -9.479 9.077
295 HB3 GLN 39 HB3 GLN 39 1.933 -8.691 7.516
296 HG2 GLN 39 HG2 GLN 39 3.328 -10.677 7.693
297 HG3 GLN 39 HG3 GLN 39 4.322 -9.254 7.510
298 HE21 GLN 39 HE21 GLN 39 5.798 -8.748 9.177
299 HE22 GLN 39 HE22 GLN 39 5.949 -9.591 10.692
300 H GLY 40 H GLY 40 1.288 -5.387 9.357
301 HA2 GLY 40 HA2 GLY 40 1.398 -3.289 8.444
302 HA3 GLY 40 HA3 GLY 40 2.847 -3.733 7.549
303 H TRP 41 H TRP 41 0.002 -5.801 7.425
304 HA TRP 41 HA TRP 41 -0.226 -5.390 4.526
305 HB2 TRP 41 HB2 TRP 41 -1.173 -7.389 6.579
306 HB3 TRP 41 HB3 TRP 41 -2.210 -7.143 5.200
307 HD1 TRP 41 HD1 TRP 41 -0.142 -9.606 6.181
308 HE1 TRP 41 HE1 TRP 41 1.115 -10.807 4.308
309 HE3 TRP 41 HE3 TRP 41 -0.824 -6.147 2.571
310 HZ2 TRP 41 HZ2 TRP 41 1.829 -10.221 1.505
311 HZ3 TRP 41 HZ3 TRP 41 0.054 -6.528 0.278
312 HH2 TRP 41 HH2 TRP 41 1.335 -8.454 -0.260
313 H CYS 42 H CYS 42 -2.037 -4.431 3.550
314 HA CYS 42 HA CYS 42 -4.295 -3.596 5.268
315 HB2 CYS 42 HB2 CYS 42 -2.440 -1.765 3.700
316 HB3 CYS 42 HB3 CYS 42 -4.152 -1.381 3.911
317 HG CYS 42 HG CYS 42 -3.903 -2.031 6.634
318 H LYS 43 H LYS 43 -6.157 -4.029 4.145
319 HA LYS 43 HA LYS 43 -5.878 -4.765 1.294
320 HB2 LYS 43 HB2 LYS 43 -7.752 -5.386 3.387
321 HB3 LYS 43 HB3 LYS 43 -8.657 -4.579 2.109
322 HG2 LYS 43 HG2 LYS 43 -6.714 -6.761 1.295
323 HG3 LYS 43 HG3 LYS 43 -8.135 -7.226 2.214
324 HD2 LYS 43 HD2 LYS 43 -9.638 -6.233 0.547
325 HD3 LYS 43 HD3 LYS 43 -8.231 -5.709 -0.418
326 HE2 LYS 43 HE2 LYS 43 -7.422 -8.095 -0.453
327 HE3 LYS 43 HE3 LYS 43 -8.798 -8.572 0.519
328 HZ1 LYS 43 HZ1 LYS 43 -10.253 -8.169 -1.253
329 HZ2 LYS 43 HZ2 LYS 43 -9.075 -9.161 -1.744
330 HZ3 LYS 43 HZ3 LYS 43 -9.043 -7.630 -2.283
331 H GLY 44 H GLY 44 -6.557 -3.409 -0.432
332 HA2 GLY 44 HA2 GLY 44 -7.902 -0.889 0.174
333 HA3 GLY 44 HA3 GLY 44 -6.256 -0.672 -0.327
334 H ARG 45 H ARG 45 -7.849 0.500 -1.952
335 HA ARG 45 HA ARG 45 -8.384 -1.303 -4.215
336 HB2 ARG 45 HB2 ARG 45 -10.409 -0.533 -2.898
337 HB3 ARG 45 HB3 ARG 45 -10.014 1.128 -3.313
338 HG2 ARG 45 HG2 ARG 45 -10.396 0.679 -5.690
339 HG3 ARG 45 HG3 ARG 45 -10.594 -1.035 -5.377
340 HD2 ARG 45 HD2 ARG 45 -12.449 0.037 -3.623
341 HD3 ARG 45 HD3 ARG 45 -12.467 1.243 -4.913
342 HE ARG 45 HE ARG 45 -12.722 -1.589 -5.730
343 HH11 ARG 45 HH11 ARG 45 -14.491 1.358 -4.851
344 HH12 ARG 45 HH12 ARG 45 -15.927 0.891 -5.703
345 HH21 ARG 45 HH21 ARG 45 -14.688 -2.313 -6.595
346 HH22 ARG 45 HH22 ARG 45 -16.121 -1.328 -6.531
347 H LEU 46 H LEU 46 -7.330 -0.801 -5.994
348 HA LEU 46 HA LEU 46 -5.733 1.634 -6.304
349 HB2 LEU 46 HB2 LEU 46 -6.317 -0.892 -7.901
350 HB3 LEU 46 HB3 LEU 46 -5.854 0.549 -8.799
351 HG LEU 46 HG LEU 46 -3.819 0.738 -7.310
352 HD11 LEU 46 HD11 LEU 46 -4.636 -2.031 -6.582
353 HD12 LEU 46 HD12 LEU 46 -4.448 -0.628 -5.482
354 HD13 LEU 46 HD13 LEU 46 -3.027 -1.316 -6.283
355 HD21 LEU 46 HD21 LEU 46 -3.816 -0.036 -9.669
356 HD22 LEU 46 HD22 LEU 46 -4.060 -1.701 -9.106
357 HD23 LEU 46 HD23 LEU 46 -2.577 -0.793 -8.693
358 H LEU 47 H LEU 47 -6.021 3.037 -8.339
359 HA LEU 47 HA LEU 47 -8.769 4.002 -8.455
360 HB2 LEU 47 HB2 LEU 47 -8.021 5.397 -10.406
361 HB3 LEU 47 HB3 LEU 47 -7.334 5.751 -8.850
362 HG LEU 47 HG LEU 47 -5.637 3.870 -10.320
363 HD11 LEU 47 HD11 LEU 47 -5.954 6.599 -11.644
364 HD12 LEU 47 HD12 LEU 47 -6.599 5.089 -12.310
365 HD13 LEU 47 HD13 LEU 47 -4.863 5.271 -12.109
366 HD21 LEU 47 HD21 LEU 47 -5.096 5.281 -8.331
367 HD22 LEU 47 HD22 LEU 47 -5.142 6.727 -9.357
368 HD23 LEU 47 HD23 LEU 47 -3.929 5.445 -9.644
369 H THR 48 H THR 48 -7.006 1.539 -10.132
370 HA THR 48 HA THR 48 -8.767 1.350 -12.432
371 HB THR 48 HB THR 48 -6.281 0.629 -12.045
372 HG1 THR 48 HG1 THR 48 -8.158 -0.825 -13.576
373 HG21 THR 48 HG21 THR 48 -6.857 -0.934 -10.123
374 HG22 THR 48 HG22 THR 48 -5.804 -1.580 -11.380
375 HG23 THR 48 HG23 THR 48 -7.528 -2.032 -11.334
376 H GLY 49 H GLY 49 -9.336 0.877 -9.179
377 HA2 GLY 49 HA2 GLY 49 -11.178 0.047 -8.118
378 HA3 GLY 49 HA3 GLY 49 -11.723 -0.676 -9.634
379 H HIS 50 H HIS 50 -8.503 -1.760 -9.008
380 HA HIS 50 HA HIS 50 -9.501 -4.413 -8.434
381 HB2 HIS 50 HB2 HIS 50 -7.298 -3.552 -9.662
382 HB3 HIS 50 HB3 HIS 50 -6.601 -3.578 -8.059
383 HD1 HIS 50 HD1 HIS 50 -8.927 -6.515 -8.327
384 HD2 HIS 50 HD2 HIS 50 -5.107 -5.398 -9.740
385 HE1 HIS 50 HE1 HIS 50 -7.896 -8.603 -9.245
386 H VAL 51 H VAL 51 -9.447 -5.525 -6.312
387 HA VAL 51 HA VAL 51 -8.679 -3.812 -4.020
388 HB VAL 51 HB VAL 51 -11.174 -5.496 -4.394
389 HG11 VAL 51 HG11 VAL 51 -10.467 -5.964 -2.136
390 HG12 VAL 51 HG12 VAL 51 -10.071 -4.256 -1.841
391 HG13 VAL 51 HG13 VAL 51 -11.762 -4.790 -2.045
392 HG21 VAL 51 HG21 VAL 51 -10.820 -2.592 -3.627
393 HG22 VAL 51 HG22 VAL 51 -11.264 -3.176 -5.248
394 HG23 VAL 51 HG23 VAL 51 -12.362 -3.431 -3.885
395 H GLY 52 H GLY 52 -6.934 -4.740 -3.066
396 HA2 GLY 52 HA2 GLY 52 -6.938 -7.626 -2.418
397 HA3 GLY 52 HA3 GLY 52 -5.685 -7.025 -3.481
398 H LEU 53 H LEU 53 -4.643 -8.036 -1.364
399 HA LEU 53 HA LEU 53 -4.335 -6.175 0.893
400 HB2 LEU 53 HB2 LEU 53 -3.255 -8.877 0.044
401 HB3 LEU 53 HB3 LEU 53 -2.403 -7.974 1.267
402 HG LEU 53 HG LEU 53 -5.306 -8.793 1.489
403 HD11 LEU 53 HD11 LEU 53 -4.482 -10.501 3.070
404 HD12 LEU 53 HD12 LEU 53 -2.805 -9.975 2.786
405 HD13 LEU 53 HD13 LEU 53 -3.739 -10.726 1.476
406 HD21 LEU 53 HD21 LEU 53 -3.362 -7.493 3.426
407 HD22 LEU 53 HD22 LEU 53 -4.876 -8.249 3.947
408 HD23 LEU 53 HD23 LEU 53 -4.922 -6.844 2.887
409 H TYR 54 H TYR 54 -2.588 -4.712 1.061
410 HA TYR 54 HA TYR 54 -0.464 -4.835 -0.936
411 HB2 TYR 54 HB2 TYR 54 -0.626 -2.650 -1.614
412 HB3 TYR 54 HB3 TYR 54 -2.264 -3.213 -1.686
413 HD1 TYR 54 HD1 TYR 54 -3.977 -2.253 -0.214
414 HD2 TYR 54 HD2 TYR 54 0.160 -1.097 0.174
415 HE1 TYR 54 HE1 TYR 54 -4.620 -0.473 1.392
416 HE2 TYR 54 HE2 TYR 54 -0.485 0.673 1.722
417 HH TYR 54 HH TYR 54 -2.137 1.500 3.087
418 HA PRO 55 HA PRO 55 1.612 -4.268 2.958
419 HB2 PRO 55 HB2 PRO 55 4.173 -3.829 2.211
420 HB3 PRO 55 HB3 PRO 55 3.322 -5.378 1.942
421 HG2 PRO 55 HG2 PRO 55 3.771 -3.161 -0.079
422 HG3 PRO 55 HG3 PRO 55 3.978 -4.940 -0.275
423 HD2 PRO 55 HD2 PRO 55 1.723 -3.636 -1.081
424 HD3 PRO 55 HD3 PRO 55 1.777 -5.324 -0.524
425 H ALA 56 H ALA 56 0.809 -2.515 3.976
426 HA ALA 56 HA ALA 56 0.847 0.156 3.111
427 HB1 ALA 56 HB1 ALA 56 -0.659 -0.727 4.834
428 HB2 ALA 56 HB2 ALA 56 0.705 -0.920 5.954
429 HB3 ALA 56 HB3 ALA 56 0.214 0.699 5.422
430 H ASN 57 H ASN 57 3.298 -1.663 4.785
431 HA ASN 57 HA ASN 57 4.818 0.458 5.846
432 HB2 ASN 57 HB2 ASN 57 6.199 -1.927 4.567
433 HB3 ASN 57 HB3 ASN 57 6.622 -1.033 6.016
434 HD21 ASN 57 HD21 ASN 57 5.125 -3.920 4.879
435 HD22 ASN 57 HD22 ASN 57 4.394 -4.365 6.402
436 H TYR 58 H TYR 58 4.522 -0.512 2.452
437 HA TYR 58 HA TYR 58 6.891 1.010 1.601
438 HB2 TYR 58 HB2 TYR 58 4.880 -0.760 0.170
439 HB3 TYR 58 HB3 TYR 58 6.170 0.101 -0.647
440 HD1 TYR 58 HD1 TYR 58 5.818 -2.333 2.239
441 HD2 TYR 58 HD2 TYR 58 8.051 -1.182 -1.285
442 HE1 TYR 58 HE1 TYR 58 7.373 -4.243 2.579
443 HE2 TYR 58 HE2 TYR 58 9.548 -3.044 -0.914
444 HH TYR 58 HH TYR 58 9.374 -5.406 1.699
445 H VAL 59 H VAL 59 3.764 2.017 2.401
446 HA VAL 59 HA VAL 59 3.902 4.181 0.392
447 HB VAL 59 HB VAL 59 1.675 3.988 -0.257
448 HG11 VAL 59 HG11 VAL 59 1.257 1.799 -1.129
449 HG12 VAL 59 HG12 VAL 59 3.007 2.019 -1.162
450 HG13 VAL 59 HG13 VAL 59 2.273 1.024 0.102
451 HG21 VAL 59 HG21 VAL 59 -0.035 2.585 0.778
452 HG22 VAL 59 HG22 VAL 59 1.134 2.139 2.069
453 HG23 VAL 59 HG23 VAL 59 0.568 3.802 1.895
454 H GLU 60 H GLU 60 2.550 6.090 1.072
455 HA GLU 60 HA GLU 60 1.948 6.205 3.954
456 HB2 GLU 60 HB2 GLU 60 4.188 7.740 2.575
457 HB3 GLU 60 HB3 GLU 60 3.277 8.474 3.890
458 HG2 GLU 60 HG2 GLU 60 3.793 6.294 5.229
459 HG3 GLU 60 HG3 GLU 60 5.068 6.049 4.024
460 H LYS 61 H LYS 61 0.928 8.250 4.506
461 HA LYS 61 HA LYS 61 -1.203 8.893 2.686
462 HB2 LYS 61 HB2 LYS 61 -0.254 9.884 5.383
463 HB3 LYS 61 HB3 LYS 61 -1.393 10.881 4.471
464 HG2 LYS 61 HG2 LYS 61 -2.966 9.085 4.251
465 HG3 LYS 61 HG3 LYS 61 -1.832 7.930 4.976
466 HD2 LYS 61 HD2 LYS 61 -3.395 8.451 6.682
467 HD3 LYS 61 HD3 LYS 61 -1.899 9.309 7.098
468 HE2 LYS 61 HE2 LYS 61 -2.955 11.354 5.939
469 HE3 LYS 61 HE3 LYS 61 -4.458 10.421 5.890
470 HZ1 LYS 61 HZ1 LYS 61 -3.001 11.417 8.244
471 HZ2 LYS 61 HZ2 LYS 61 -4.032 10.162 8.409
472 HZ3 LYS 61 HZ3 LYS 61 -4.585 11.617 7.859
473 H VAL 62 H VAL 62 -1.710 11.004 1.793
474 HA VAL 62 HA VAL 62 0.613 12.703 1.394
475 HB VAL 62 HB VAL 62 0.629 10.875 -0.341
476 HG11 VAL 62 HG11 VAL 62 -1.769 10.595 -0.727
477 HG12 VAL 62 HG12 VAL 62 -1.869 12.225 -1.426
478 HG13 VAL 62 HG13 VAL 62 -0.929 10.968 -2.238
479 HG21 VAL 62 HG21 VAL 62 1.218 12.251 -2.212
480 HG22 VAL 62 HG22 VAL 62 0.361 13.644 -1.531
481 HG23 VAL 62 HG23 VAL 62 1.804 12.987 -0.709
482 H GLY 63 H GLY 63 0.002 14.802 0.309
483 HA2 GLY 63 HA2 GLY 63 -1.824 16.224 -0.460
484 HA3 GLY 63 HA3 GLY 63 -2.838 15.554 0.811
485 H LEU 64 H LEU 64 -2.240 15.942 3.025
486 HA LEU 64 HA LEU 64 -1.851 18.721 3.532
487 HB2 LEU 64 HB2 LEU 64 -1.790 16.347 5.443
488 HB3 LEU 64 HB3 LEU 64 -1.883 18.034 5.939
489 HG LEU 64 HG LEU 64 -4.017 16.499 4.412
490 HD11 LEU 64 HD11 LEU 64 -5.342 16.925 6.506
491 HD12 LEU 64 HD12 LEU 64 -3.838 17.535 7.268
492 HD13 LEU 64 HD13 LEU 64 -3.967 15.860 6.716
493 HD21 LEU 64 HD21 LEU 64 -4.010 19.409 5.331
494 HD22 LEU 64 HD22 LEU 64 -5.447 18.515 4.777
495 HD23 LEU 64 HD23 LEU 64 -4.129 18.790 3.659
496 H ALA 65 H ALA 65 -0.360 19.580 5.161
497 HA ALA 65 HA ALA 65 2.434 18.598 4.851
498 HB1 ALA 65 HB1 ALA 65 1.375 21.457 4.988
499 HB2 ALA 65 HB2 ALA 65 3.088 21.001 5.009
500 HB3 ALA 65 HB3 ALA 65 2.112 20.665 3.573
501 H ALA 66 H ALA 66 3.803 19.547 6.721
502 HA ALA 66 HA ALA 66 4.350 19.461 8.868
503 HB1 ALA 66 HB1 ALA 66 3.140 21.654 8.803
504 HB2 ALA 66 HB2 ALA 66 1.724 20.822 9.496
505 HB3 ALA 66 HB3 ALA 66 3.235 20.902 10.400
506 H ALA 67 H ALA 67 2.758 17.135 7.781
507 HA ALA 67 HA ALA 67 2.096 15.839 10.356
508 HB1 ALA 67 HB1 ALA 67 -0.015 16.435 9.196
509 HB2 ALA 67 HB2 ALA 67 0.569 15.622 7.717
510 HB3 ALA 67 HB3 ALA 67 0.264 14.676 9.191
511 H1 THR 101 H THR 101 -1.140 -14.462 11.159
512 HA THR 101 HA THR 101 -1.461 -12.401 9.989
513 HB THR 101 HB THR 101 1.117 -13.061 8.528
514 HG1 THR 101 HG1 THR 101 2.036 -11.618 9.952
515 HG21 THR 101 HG21 THR 101 0.978 -10.903 7.605
516 HG22 THR 101 HG22 THR 101 -0.456 -10.467 8.592
517 HG23 THR 101 HG23 THR 101 -0.569 -11.663 7.284
518 H LYS 102 H LYS 102 -0.171 -15.372 8.442
519 HA LYS 102 HA LYS 102 -1.270 -16.975 7.292
520 HB2 LYS 102 HB2 LYS 102 -3.323 -14.963 6.303
521 HB3 LYS 102 HB3 LYS 102 -3.253 -16.667 5.902
522 HG2 LYS 102 HG2 LYS 102 -3.695 -17.356 8.180
523 HG3 LYS 102 HG3 LYS 102 -3.569 -15.699 8.760
524 HD2 LYS 102 HD2 LYS 102 -5.525 -15.169 7.100
525 HD3 LYS 102 HD3 LYS 102 -5.731 -16.922 7.034
526 HE2 LYS 102 HE2 LYS 102 -7.215 -16.189 8.728
527 HE3 LYS 102 HE3 LYS 102 -5.835 -16.879 9.599
528 HZ1 LYS 102 HZ1 LYS 102 -6.468 -14.758 10.550
529 HZ2 LYS 102 HZ2 LYS 102 -6.383 -14.019 9.100
530 HZ3 LYS 102 HZ3 LYS 102 -4.997 -14.565 9.829
531 H GLY 103 H GLY 103 -0.056 -13.944 6.264
532 HA2 GLY 103 HA2 GLY 103 1.155 -15.133 3.879
533 HA3 GLY 103 HA3 GLY 103 0.170 -13.674 3.683
534 HA PRO 104 HA PRO 104 4.024 -12.586 6.392
535 HB2 PRO 104 HB2 PRO 104 6.400 -13.467 5.416
536 HB3 PRO 104 HB3 PRO 104 5.384 -14.479 6.483
537 HG2 PRO 104 HG2 PRO 104 5.552 -14.573 3.455
538 HG3 PRO 104 HG3 PRO 104 5.620 -15.934 4.611
539 HD2 PRO 104 HD2 PRO 104 3.328 -15.143 3.297
540 HD3 PRO 104 HD3 PRO 104 3.284 -15.854 4.945
541 H ALA 105 H ALA 105 3.578 -10.569 5.689
542 HA ALA 105 HA ALA 105 3.668 -9.503 3.138
543 HB1 ALA 105 HB1 ALA 105 3.603 -7.334 4.260
544 HB2 ALA 105 HB2 ALA 105 2.774 -8.455 5.321
545 HB3 ALA 105 HB3 ALA 105 4.450 -7.984 5.665
546 HA PRO 106 HA PRO 106 7.990 -9.023 2.181
547 HB2 PRO 106 HB2 PRO 106 8.062 -6.901 0.494
548 HB3 PRO 106 HB3 PRO 106 7.160 -8.438 0.317
549 HG2 PRO 106 HG2 PRO 106 5.994 -5.837 1.286
550 HG3 PRO 106 HG3 PRO 106 5.468 -6.805 -0.144
551 HD2 PRO 106 HD2 PRO 106 4.385 -7.121 2.347
552 HD3 PRO 106 HD3 PRO 106 4.563 -8.467 1.224
553 H ASN 107 H ASN 107 6.835 -7.560 4.303
554 HA ASN 107 HA ASN 107 8.314 -5.141 5.044
555 HB2 ASN 107 HB2 ASN 107 7.229 -5.070 7.061
556 HB3 ASN 107 HB3 ASN 107 6.076 -6.032 6.141
557 HD21 ASN 107 HD21 ASN 107 8.086 -5.866 8.974
558 HD22 ASN 107 HD22 ASN 107 7.793 -7.500 9.518
559 HA PRO 108 HA PRO 108 9.367 -4.262 7.410
560 HB2 PRO 108 HB2 PRO 108 11.934 -3.236 7.576
561 HB3 PRO 108 HB3 PRO 108 11.180 -4.312 8.806
562 HG2 PRO 108 HG2 PRO 108 13.014 -5.103 6.526
563 HG3 PRO 108 HG3 PRO 108 13.160 -5.513 8.274
564 HD2 PRO 108 HD2 PRO 108 11.993 -7.245 6.569
565 HD3 PRO 108 HD3 PRO 108 11.227 -6.923 8.149
566 HA PRO 109 HA PRO 109 9.442 -1.959 3.651
567 HB2 PRO 109 HB2 PRO 109 9.623 0.671 4.374
568 HB3 PRO 109 HB3 PRO 109 8.220 -0.381 4.658
569 HG2 PRO 109 HG2 PRO 109 10.420 0.352 6.598
570 HG3 PRO 109 HG3 PRO 109 8.654 0.355 6.882
571 HD2 PRO 109 HD2 PRO 109 10.270 -1.728 7.629
572 HD3 PRO 109 HD3 PRO 109 8.587 -1.974 7.106
573 HA PRO 110 HA PRO 110 13.937 -1.265 2.962
574 HB2 PRO 110 HB2 PRO 110 14.024 -2.017 0.326
575 HB3 PRO 110 HB3 PRO 110 13.939 -3.260 1.635
576 HG2 PRO 110 HG2 PRO 110 11.752 -2.118 -0.127
577 HG3 PRO 110 HG3 PRO 110 12.024 -3.824 0.346
578 HD2 PRO 110 HD2 PRO 110 10.242 -2.118 1.613
579 HD3 PRO 110 HD3 PRO 110 11.024 -3.511 2.398
580 H ILE 111 H ILE 111 15.020 -0.167 1.003
581 HA ILE 111 HA ILE 111 13.398 1.852 -0.361
582 HB ILE 111 HB ILE 111 14.017 2.945 1.682
583 HG12 ILE 111 HG12 ILE 111 14.336 4.035 -0.646
584 HG13 ILE 111 HG13 ILE 111 14.844 4.891 0.802
585 HG21 ILE 111 HG21 ILE 111 15.792 1.603 2.593
586 HG22 ILE 111 HG22 ILE 111 16.885 1.993 1.255
587 HG23 ILE 111 HG23 ILE 111 16.408 3.237 2.417
588 HD11 ILE 111 HD11 ILE 111 16.793 3.258 -0.861
589 HD12 ILE 111 HD12 ILE 111 16.374 4.951 -1.225
590 HD13 ILE 111 HD13 ILE 111 17.140 4.509 0.329
591 H LEU 112 H LEU 112 14.409 2.459 -2.290
592 HA LEU 112 HA LEU 112 16.968 1.145 -3.020
593 HB2 LEU 112 HB2 LEU 112 16.252 0.788 -5.305
594 HB3 LEU 112 HB3 LEU 112 15.552 -0.315 -4.165
595 HG LEU 112 HG LEU 112 13.892 2.066 -5.029
596 HD11 LEU 112 HD11 LEU 112 14.349 -0.451 -6.679
597 HD12 LEU 112 HD12 LEU 112 14.800 1.205 -7.132
598 HD13 LEU 112 HD13 LEU 112 13.094 0.764 -6.981
599 HD21 LEU 112 HD21 LEU 112 12.941 0.589 -3.313
600 HD22 LEU 112 HD22 LEU 112 13.279 -0.836 -4.314
601 HD23 LEU 112 HD23 LEU 112 12.079 0.341 -4.849
602 H LYS 113 H LYS 113 14.507 3.599 -3.954
603 HA LYS 113 HA LYS 113 16.476 5.683 -3.926
604 HB2 LYS 113 HB2 LYS 113 16.162 4.391 -6.395
605 HB3 LYS 113 HB3 LYS 113 14.962 5.683 -6.500
606 HG2 LYS 113 HG2 LYS 113 16.833 7.271 -5.694
607 HG3 LYS 113 HG3 LYS 113 17.941 5.906 -5.900
608 HD2 LYS 113 HD2 LYS 113 17.108 5.771 -8.325
609 HD3 LYS 113 HD3 LYS 113 16.253 7.285 -8.025
610 HE2 LYS 113 HE2 LYS 113 18.286 7.942 -9.022
611 HE3 LYS 113 HE3 LYS 113 18.496 8.281 -7.298
612 HZ1 LYS 113 HZ1 LYS 113 19.489 5.830 -8.643
613 HZ2 LYS 113 HZ2 LYS 113 19.795 6.257 -7.110
614 HZ3 LYS 113 HZ3 LYS 113 20.414 7.157 -8.343
615 H VAL 114 H VAL 114 15.055 7.792 -4.704
616 HA VAL 114 HA VAL 114 12.274 7.471 -3.714
617 HB VAL 114 HB VAL 114 12.501 9.561 -2.439
618 HG11 VAL 114 HG11 VAL 114 14.492 7.429 -1.546
619 HG12 VAL 114 HG12 VAL 114 13.698 8.650 -0.528
620 HG13 VAL 114 HG13 VAL 114 12.737 7.393 -1.308
621 HG21 VAL 114 HG21 VAL 114 14.766 10.416 -1.834
622 HG22 VAL 114 HG22 VAL 114 15.479 9.381 -3.098
623 HG23 VAL 114 HG23 VAL 114 14.359 10.676 -3.527
624 H TRP 115 H TRP 115 13.255 7.460 -6.437
625 HA TRP 115 HA TRP 115 11.950 9.882 -7.484
626 HB2 TRP 115 HB2 TRP 115 14.598 9.835 -7.493
627 HB3 TRP 115 HB3 TRP 115 14.402 8.661 -8.787
628 HD1 TRP 115 HD1 TRP 115 14.659 12.249 -8.103
629 HE1 TRP 115 HE1 TRP 115 14.105 13.688 -10.098
630 HE3 TRP 115 HE3 TRP 115 12.599 8.639 -11.081
631 HZ2 TRP 115 HZ2 TRP 115 12.540 13.395 -12.559
632 HZ3 TRP 115 HZ3 TRP 115 11.533 9.259 -13.226
633 HH2 TRP 115 HH2 TRP 115 11.462 11.592 -13.967
Start of MODEL 7
1 H1 MET 1 H MET 1 -15.216 2.464 0.953
2 HA MET 1 HA MET 1 -17.103 1.058 1.065
3 HB2 MET 1 HB2 MET 1 -15.238 -1.046 1.103
4 HB3 MET 1 HB3 MET 1 -16.073 -1.187 2.627
5 HG2 MET 1 HG2 MET 1 -18.256 -1.073 1.449
6 HG3 MET 1 HG3 MET 1 -17.394 -0.977 -0.093
7 HE1 MET 1 HE1 MET 1 -19.635 -3.182 0.398
8 HE2 MET 1 HE2 MET 1 -18.680 -3.014 -1.089
9 HE3 MET 1 HE3 MET 1 -18.826 -4.597 -0.305
10 H LYS 2 H LYS 2 -15.697 -0.172 4.124
11 HA LYS 2 HA LYS 2 -17.419 1.609 5.522
12 HB2 LYS 2 HB2 LYS 2 -16.774 0.489 7.478
13 HB3 LYS 2 HB3 LYS 2 -17.018 -0.700 6.206
14 HG2 LYS 2 HG2 LYS 2 -14.611 -1.069 5.980
15 HG3 LYS 2 HG3 LYS 2 -14.262 0.315 7.035
16 HD2 LYS 2 HD2 LYS 2 -14.037 -1.573 8.464
17 HD3 LYS 2 HD3 LYS 2 -15.574 -0.828 8.857
18 HE2 LYS 2 HE2 LYS 2 -16.189 -3.030 8.811
19 HE3 LYS 2 HE3 LYS 2 -16.552 -2.589 7.138
20 HZ1 LYS 2 HZ1 LYS 2 -14.297 -3.476 6.596
21 HZ2 LYS 2 HZ2 LYS 2 -15.310 -4.619 7.208
22 HZ3 LYS 2 HZ3 LYS 2 -14.150 -3.950 8.167
23 H VAL 3 H VAL 3 -14.677 2.672 4.164
24 HA VAL 3 HA VAL 3 -14.392 4.765 6.118
25 HB VAL 3 HB VAL 3 -11.883 4.706 5.911
26 HG11 VAL 3 HG11 VAL 3 -11.492 3.250 7.761
27 HG12 VAL 3 HG12 VAL 3 -13.059 4.060 7.989
28 HG13 VAL 3 HG13 VAL 3 -13.000 2.357 7.471
29 HG21 VAL 3 HG21 VAL 3 -11.584 3.040 4.110
30 HG22 VAL 3 HG22 VAL 3 -10.731 2.593 5.595
31 HG23 VAL 3 HG23 VAL 3 -12.242 1.765 5.175
32 HA PRO 4 HA PRO 4 -14.547 6.847 2.247
33 HB2 PRO 4 HB2 PRO 4 -13.413 9.282 2.769
34 HB3 PRO 4 HB3 PRO 4 -14.971 8.760 3.471
35 HG2 PRO 4 HG2 PRO 4 -12.208 8.536 4.732
36 HG3 PRO 4 HG3 PRO 4 -13.672 9.289 5.444
37 HD2 PRO 4 HD2 PRO 4 -13.030 6.740 6.035
38 HD3 PRO 4 HD3 PRO 4 -14.738 7.162 5.697
39 H GLY 5 H GLY 5 -11.478 5.791 3.475
40 HA2 GLY 5 HA2 GLY 5 -9.775 5.043 2.149
41 HA3 GLY 5 HA3 GLY 5 -10.355 6.033 0.819
42 H VAL 6 H VAL 6 -7.646 5.763 2.461
43 HA VAL 6 HA VAL 6 -7.220 8.657 3.023
44 HB VAL 6 HB VAL 6 -5.581 6.220 3.779
45 HG11 VAL 6 HG11 VAL 6 -5.100 9.174 4.385
46 HG12 VAL 6 HG12 VAL 6 -4.202 7.815 5.093
47 HG13 VAL 6 HG13 VAL 6 -4.080 8.135 3.363
48 HG21 VAL 6 HG21 VAL 6 -7.228 8.175 5.445
49 HG22 VAL 6 HG22 VAL 6 -7.621 6.486 5.143
50 HG23 VAL 6 HG23 VAL 6 -6.193 6.889 6.097
51 H ARG 7 H ARG 7 -6.102 9.809 1.540
52 HA ARG 7 HA ARG 7 -5.454 8.657 -1.017
53 HB2 ARG 7 HB2 ARG 7 -4.718 10.861 -1.652
54 HB3 ARG 7 HB3 ARG 7 -6.267 10.941 -0.874
55 HG2 ARG 7 HG2 ARG 7 -3.828 11.579 0.819
56 HG3 ARG 7 HG3 ARG 7 -4.212 12.666 -0.494
57 HD2 ARG 7 HD2 ARG 7 -6.152 11.870 1.681
58 HD3 ARG 7 HD3 ARG 7 -5.146 13.322 1.712
59 HE ARG 7 HE ARG 7 -6.411 13.421 -0.743
60 HH11 ARG 7 HH11 ARG 7 -7.700 13.263 2.569
61 HH12 ARG 7 HH12 ARG 7 -9.267 13.791 2.080
62 HH21 ARG 7 HH21 ARG 7 -8.239 14.448 -1.254
63 HH22 ARG 7 HH22 ARG 7 -9.439 14.932 -0.079
64 H VAL 8 H VAL 8 -3.780 7.526 -1.566
65 HA VAL 8 HA VAL 8 -1.109 8.220 -0.480
66 HB VAL 8 HB VAL 8 -0.580 5.792 -0.313
67 HG11 VAL 8 HG11 VAL 8 -1.620 5.433 1.871
68 HG12 VAL 8 HG12 VAL 8 -1.067 7.105 1.707
69 HG13 VAL 8 HG13 VAL 8 -2.798 6.720 1.564
70 HG21 VAL 8 HG21 VAL 8 -2.326 4.114 -0.071
71 HG22 VAL 8 HG22 VAL 8 -3.594 5.322 -0.351
72 HG23 VAL 8 HG23 VAL 8 -2.480 4.873 -1.658
73 H ARG 9 H ARG 9 0.685 7.476 -1.921
74 HA ARG 9 HA ARG 9 -0.168 6.883 -4.707
75 HB2 ARG 9 HB2 ARG 9 0.377 9.321 -4.483
76 HB3 ARG 9 HB3 ARG 9 2.020 8.853 -3.997
77 HG2 ARG 9 HG2 ARG 9 2.273 7.585 -6.128
78 HG3 ARG 9 HG3 ARG 9 0.632 8.020 -6.606
79 HD2 ARG 9 HD2 ARG 9 2.853 10.022 -6.075
80 HD3 ARG 9 HD3 ARG 9 2.486 9.319 -7.670
81 HE ARG 9 HE ARG 9 0.075 10.406 -6.817
82 HH11 ARG 9 HH11 ARG 9 3.345 11.612 -7.584
83 HH12 ARG 9 HH12 ARG 9 2.758 13.144 -8.147
84 HH21 ARG 9 HH21 ARG 9 -0.654 12.228 -7.585
85 HH22 ARG 9 HH22 ARG 9 0.364 13.541 -8.173
86 H ALA 10 H ALA 10 1.020 5.231 -5.586
87 HA ALA 10 HA ALA 10 2.820 3.741 -3.843
88 HB1 ALA 10 HB1 ALA 10 1.982 3.414 -6.753
89 HB2 ALA 10 HB2 ALA 10 2.979 2.250 -5.857
90 HB3 ALA 10 HB3 ALA 10 1.295 2.545 -5.360
91 H LEU 11 H LEU 11 5.029 3.760 -3.925
92 HA LEU 11 HA LEU 11 6.275 5.793 -5.737
93 HB2 LEU 11 HB2 LEU 11 7.210 4.537 -3.142
94 HB3 LEU 11 HB3 LEU 11 8.129 5.714 -4.072
95 HG LEU 11 HG LEU 11 5.423 6.216 -2.745
96 HD11 LEU 11 HD11 LEU 11 6.860 7.712 -1.321
97 HD12 LEU 11 HD12 LEU 11 8.284 6.939 -2.025
98 HD13 LEU 11 HD13 LEU 11 7.139 5.966 -1.101
99 HD21 LEU 11 HD21 LEU 11 7.261 8.173 -4.205
100 HD22 LEU 11 HD22 LEU 11 5.819 8.594 -3.268
101 HD23 LEU 11 HD23 LEU 11 5.642 7.650 -4.741
102 H TYR 12 H TYR 12 6.003 2.395 -5.464
103 HA TYR 12 HA TYR 12 8.325 2.084 -7.259
104 HB2 TYR 12 HB2 TYR 12 7.851 -0.012 -5.162
105 HB3 TYR 12 HB3 TYR 12 9.299 0.346 -6.068
106 HD1 TYR 12 HD1 TYR 12 7.496 0.832 -3.037
107 HD2 TYR 12 HD2 TYR 12 10.613 2.679 -5.413
108 HE1 TYR 12 HE1 TYR 12 8.107 2.337 -1.124
109 HE2 TYR 12 HE2 TYR 12 11.085 4.192 -3.583
110 HH TYR 12 HH TYR 12 9.666 3.984 -0.364
111 H ASP 13 H ASP 13 8.197 -0.080 -8.312
112 HA ASP 13 HA ASP 13 5.381 -0.662 -9.102
113 HB2 ASP 13 HB2 ASP 13 6.472 -1.592 -11.215
114 HB3 ASP 13 HB3 ASP 13 6.287 0.139 -10.953
115 H TYR 14 H TYR 14 4.739 -2.151 -7.779
116 HA TYR 14 HA TYR 14 5.976 -4.830 -7.800
117 HB2 TYR 14 HB2 TYR 14 5.385 -2.990 -5.528
118 HB3 TYR 14 HB3 TYR 14 4.893 -4.654 -5.328
119 HD1 TYR 14 HD1 TYR 14 6.361 -6.064 -4.164
120 HD2 TYR 14 HD2 TYR 14 7.977 -2.840 -6.567
121 HE1 TYR 14 HE1 TYR 14 8.633 -6.905 -3.792
122 HE2 TYR 14 HE2 TYR 14 10.235 -3.668 -6.199
123 HH TYR 14 HH TYR 14 11.453 -5.642 -5.561
124 H THR 15 H THR 15 4.392 -6.551 -7.200
125 HA THR 15 HA THR 15 1.575 -5.884 -7.753
126 HB THR 15 HB THR 15 2.422 -6.302 -9.903
127 HG1 THR 15 HG1 THR 15 0.580 -7.766 -9.066
128 HG21 THR 15 HG21 THR 15 3.874 -8.757 -8.873
129 HG22 THR 15 HG22 THR 15 4.594 -7.289 -9.556
130 HG23 THR 15 HG23 THR 15 3.652 -8.363 -10.591
131 H GLY 16 H GLY 16 1.402 -6.226 -5.479
132 HA2 GLY 16 HA2 GLY 16 0.903 -7.331 -3.594
133 HA3 GLY 16 HA3 GLY 16 0.291 -8.630 -4.652
134 H GLN 17 H GLN 17 1.018 -10.102 -2.874
135 HA GLN 17 HA GLN 17 3.862 -10.769 -3.236
136 HB2 GLN 17 HB2 GLN 17 3.812 -9.504 -1.143
137 HB3 GLN 17 HB3 GLN 17 2.574 -10.584 -0.493
138 HG2 GLN 17 HG2 GLN 17 4.815 -11.081 0.402
139 HG3 GLN 17 HG3 GLN 17 4.142 -12.457 -0.449
140 HE21 GLN 17 HE21 GLN 17 5.176 -13.113 -2.477
141 HE22 GLN 17 HE22 GLN 17 6.801 -12.551 -2.867
142 H GLU 18 H GLU 18 0.489 -11.797 -2.726
143 HA GLU 18 HA GLU 18 1.249 -14.425 -3.589
144 HB2 GLU 18 HB2 GLU 18 0.701 -13.885 -0.784
145 HB3 GLU 18 HB3 GLU 18 -0.595 -14.870 -1.451
146 HG2 GLU 18 HG2 GLU 18 1.133 -16.419 -2.413
147 HG3 GLU 18 HG3 GLU 18 2.395 -15.465 -1.635
148 H ALA 19 H ALA 19 -1.189 -15.615 -3.522
149 HA ALA 19 HA ALA 19 -2.445 -14.226 -5.721
150 HB1 ALA 19 HB1 ALA 19 -2.113 -16.693 -5.541
151 HB2 ALA 19 HB2 ALA 19 -3.310 -16.720 -4.220
152 HB3 ALA 19 HB3 ALA 19 -3.777 -16.191 -5.852
153 H ASP 20 H ASP 20 -2.903 -13.606 -2.400
154 HA ASP 20 HA ASP 20 -5.809 -13.012 -2.793
155 HB2 ASP 20 HB2 ASP 20 -4.774 -14.671 -1.016
156 HB3 ASP 20 HB3 ASP 20 -4.460 -13.194 -0.114
157 H GLU 21 H GLU 21 -2.943 -11.430 -3.022
158 HA GLU 21 HA GLU 21 -3.741 -8.985 -1.538
159 HB2 GLU 21 HB2 GLU 21 -1.231 -9.990 -2.957
160 HB3 GLU 21 HB3 GLU 21 -1.357 -8.355 -2.329
161 HG2 GLU 21 HG2 GLU 21 -0.189 -9.903 -0.808
162 HG3 GLU 21 HG3 GLU 21 -1.579 -9.102 -0.070
163 H LEU 22 H LEU 22 -3.158 -6.970 -2.612
164 HA LEU 22 HA LEU 22 -4.599 -6.499 -5.116
165 HB2 LEU 22 HB2 LEU 22 -4.977 -5.358 -2.792
166 HB3 LEU 22 HB3 LEU 22 -3.439 -4.582 -3.045
167 HG LEU 22 HG LEU 22 -4.398 -3.434 -5.076
168 HD11 LEU 22 HD11 LEU 22 -6.126 -4.999 -5.690
169 HD12 LEU 22 HD12 LEU 22 -6.920 -3.469 -5.270
170 HD13 LEU 22 HD13 LEU 22 -6.942 -4.827 -4.133
171 HD21 LEU 22 HD21 LEU 22 -4.366 -2.244 -2.973
172 HD22 LEU 22 HD22 LEU 22 -5.832 -3.081 -2.424
173 HD23 LEU 22 HD23 LEU 22 -5.910 -1.921 -3.767
174 H SER 23 H SER 23 -3.536 -5.639 -6.913
175 HA SER 23 HA SER 23 -0.577 -5.089 -6.663
176 HB2 SER 23 HB2 SER 23 -2.254 -6.318 -8.878
177 HB3 SER 23 HB3 SER 23 -0.660 -5.601 -9.177
178 HG SER 23 HG SER 23 -1.266 -7.746 -7.387
179 H PHE 24 H PHE 24 0.053 -3.066 -7.081
180 HA PHE 24 HA PHE 24 -1.835 -1.216 -8.503
181 HB2 PHE 24 HB2 PHE 24 -0.826 0.544 -7.091
182 HB3 PHE 24 HB3 PHE 24 -1.823 -0.658 -6.282
183 HD1 PHE 24 HD1 PHE 24 1.818 0.044 -7.029
184 HD2 PHE 24 HD2 PHE 24 -1.098 -1.575 -4.236
185 HE1 PHE 24 HE1 PHE 24 3.611 -0.389 -5.392
186 HE2 PHE 24 HE2 PHE 24 0.738 -1.877 -2.591
187 HZ PHE 24 HZ PHE 24 3.048 -1.370 -3.160
188 H LYS 25 H LYS 25 -0.165 0.875 -9.100
189 HA LYS 25 HA LYS 25 2.129 -0.245 -10.605
190 HB2 LYS 25 HB2 LYS 25 -0.338 0.839 -11.717
191 HB3 LYS 25 HB3 LYS 25 0.920 2.039 -11.950
192 HG2 LYS 25 HG2 LYS 25 0.880 0.642 -13.896
193 HG3 LYS 25 HG3 LYS 25 2.362 0.294 -13.001
194 HD2 LYS 25 HD2 LYS 25 1.110 -1.684 -11.959
195 HD3 LYS 25 HD3 LYS 25 -0.168 -1.401 -13.153
196 HE2 LYS 25 HE2 LYS 25 1.323 -1.888 -14.972
197 HE3 LYS 25 HE3 LYS 25 2.752 -1.738 -13.933
198 HZ1 LYS 25 HZ1 LYS 25 0.759 -3.897 -13.913
199 HZ2 LYS 25 HZ2 LYS 25 1.871 -3.721 -12.705
200 HZ3 LYS 25 HZ3 LYS 25 2.336 -4.042 -14.256
201 H ALA 26 H ALA 26 3.898 1.366 -10.875
202 HA ALA 26 HA ALA 26 4.216 2.969 -8.526
203 HB1 ALA 26 HB1 ALA 26 5.686 3.144 -11.181
204 HB2 ALA 26 HB2 ALA 26 6.222 3.831 -9.635
205 HB3 ALA 26 HB3 ALA 26 6.145 2.079 -9.824
206 H GLY 27 H GLY 27 3.575 5.054 -8.128
207 HA2 GLY 27 HA2 GLY 27 3.003 7.233 -8.564
208 HA3 GLY 27 HA3 GLY 27 2.947 6.907 -10.297
209 H GLU 28 H GLU 28 1.149 4.406 -9.027
210 HA GLU 28 HA GLU 28 -1.351 5.642 -9.787
211 HB2 GLU 28 HB2 GLU 28 -0.762 3.215 -10.173
212 HB3 GLU 28 HB3 GLU 28 -0.790 2.964 -8.423
213 HG2 GLU 28 HG2 GLU 28 -2.826 2.145 -9.362
214 HG3 GLU 28 HG3 GLU 28 -3.204 3.535 -8.369
215 H GLU 29 H GLU 29 -3.140 6.083 -8.379
216 HA GLU 29 HA GLU 29 -2.383 6.415 -5.516
217 HB2 GLU 29 HB2 GLU 29 -4.078 8.093 -7.359
218 HB3 GLU 29 HB3 GLU 29 -4.167 8.197 -5.602
219 HG2 GLU 29 HG2 GLU 29 -1.631 8.553 -5.619
220 HG3 GLU 29 HG3 GLU 29 -1.737 8.731 -7.367
221 H LEU 30 H LEU 30 -3.217 4.796 -4.341
222 HA LEU 30 HA LEU 30 -5.920 3.746 -5.024
223 HB2 LEU 30 HB2 LEU 30 -5.148 2.018 -3.129
224 HB3 LEU 30 HB3 LEU 30 -4.822 1.747 -4.849
225 HG LEU 30 HG LEU 30 -2.746 3.009 -3.051
226 HD11 LEU 30 HD11 LEU 30 -1.855 0.745 -2.643
227 HD12 LEU 30 HD12 LEU 30 -3.299 0.038 -3.405
228 HD13 LEU 30 HD13 LEU 30 -3.436 0.979 -1.899
229 HD21 LEU 30 HD21 LEU 30 -1.230 1.894 -4.712
230 HD22 LEU 30 HD22 LEU 30 -2.371 2.938 -5.569
231 HD23 LEU 30 HD23 LEU 30 -2.660 1.212 -5.532
232 H MET 31 H MET 31 -7.168 3.164 -2.953
233 HA MET 31 HA MET 31 -6.826 5.363 -0.955
234 HB2 MET 31 HB2 MET 31 -9.484 4.004 -1.405
235 HB3 MET 31 HB3 MET 31 -9.059 5.531 -0.658
236 HG2 MET 31 HG2 MET 31 -8.942 4.953 -3.617
237 HG3 MET 31 HG3 MET 31 -10.173 5.902 -2.791
238 HE1 MET 31 HE1 MET 31 -8.194 9.122 -1.689
239 HE2 MET 31 HE2 MET 31 -9.754 8.274 -1.659
240 HE3 MET 31 HE3 MET 31 -8.386 7.684 -0.679
241 H LYS 32 H LYS 32 -5.887 4.511 0.824
242 HA LYS 32 HA LYS 32 -5.932 1.689 1.405
243 HB2 LYS 32 HB2 LYS 32 -4.215 3.186 2.236
244 HB3 LYS 32 HB3 LYS 32 -5.402 4.093 3.196
245 HG2 LYS 32 HG2 LYS 32 -5.961 2.029 4.503
246 HG3 LYS 32 HG3 LYS 32 -4.768 1.136 3.556
247 HD2 LYS 32 HD2 LYS 32 -3.829 1.638 5.643
248 HD3 LYS 32 HD3 LYS 32 -3.024 2.721 4.469
249 HE2 LYS 32 HE2 LYS 32 -4.719 4.498 5.230
250 HE3 LYS 32 HE3 LYS 32 -5.227 3.351 6.461
251 HZ1 LYS 32 HZ1 LYS 32 -3.669 4.780 7.435
252 HZ2 LYS 32 HZ2 LYS 32 -2.511 4.520 6.281
253 HZ3 LYS 32 HZ3 LYS 32 -2.919 3.316 7.272
254 H ILE 33 H ILE 33 -7.380 0.442 2.795
255 HA ILE 33 HA ILE 33 -9.536 2.016 3.952
256 HB ILE 33 HB ILE 33 -11.175 0.453 3.367
257 HG12 ILE 33 HG12 ILE 33 -9.594 -1.244 1.493
258 HG13 ILE 33 HG13 ILE 33 -9.311 -1.546 3.204
259 HG21 ILE 33 HG21 ILE 33 -9.673 1.067 0.818
260 HG22 ILE 33 HG22 ILE 33 -11.404 0.771 0.998
261 HG23 ILE 33 HG23 ILE 33 -10.679 2.218 1.721
262 HD11 ILE 33 HD11 ILE 33 -11.091 -2.983 2.367
263 HD12 ILE 33 HD12 ILE 33 -11.730 -1.860 3.580
264 HD13 ILE 33 HD13 ILE 33 -12.033 -1.567 1.849
265 H SER 34 H SER 34 -6.998 0.519 5.092
266 HA SER 34 HA SER 34 -8.408 -0.440 7.467
267 HB2 SER 34 HB2 SER 34 -7.918 -2.327 5.676
268 HB3 SER 34 HB3 SER 34 -6.248 -2.188 6.274
269 HG SER 34 HG SER 34 -6.869 -3.294 7.942
270 H GLU 35 H GLU 35 -6.383 -1.255 8.973
271 HA GLU 35 HA GLU 35 -4.593 1.100 9.162
272 HB2 GLU 35 HB2 GLU 35 -4.462 0.618 11.480
273 HB3 GLU 35 HB3 GLU 35 -6.167 0.617 11.027
274 HG2 GLU 35 HG2 GLU 35 -5.888 -1.974 10.804
275 HG3 GLU 35 HG3 GLU 35 -4.391 -1.757 11.713
276 H GLU 36 H GLU 36 -2.330 0.492 10.150
277 HA GLU 36 HA GLU 36 -1.164 -1.420 8.364
278 HB2 GLU 36 HB2 GLU 36 -0.233 0.808 9.018
279 HB3 GLU 36 HB3 GLU 36 0.130 0.142 10.622
280 HG2 GLU 36 HG2 GLU 36 1.600 -1.544 9.589
281 HG3 GLU 36 HG3 GLU 36 1.138 -0.984 7.972
282 H ASP 37 H ASP 37 -1.036 -3.462 8.639
283 HA ASP 37 HA ASP 37 -1.480 -4.869 11.148
284 HB2 ASP 37 HB2 ASP 37 -1.112 -5.541 8.281
285 HB3 ASP 37 HB3 ASP 37 -0.500 -6.766 9.372
286 H GLU 38 H GLU 38 0.177 -6.627 11.811
287 HA GLU 38 HA GLU 38 2.530 -5.491 12.695
288 HB2 GLU 38 HB2 GLU 38 1.236 -7.573 13.448
289 HB3 GLU 38 HB3 GLU 38 2.181 -8.469 12.242
290 HG2 GLU 38 HG2 GLU 38 4.265 -7.762 13.407
291 HG3 GLU 38 HG3 GLU 38 3.311 -6.808 14.549
292 H GLN 39 H GLN 39 2.044 -6.691 9.508
293 HA GLN 39 HA GLN 39 4.971 -6.777 9.007
294 HB2 GLN 39 HB2 GLN 39 2.845 -8.550 8.153
295 HB3 GLN 39 HB3 GLN 39 3.451 -7.770 6.746
296 HG2 GLN 39 HG2 GLN 39 4.689 -9.847 8.410
297 HG3 GLN 39 HG3 GLN 39 4.834 -9.541 6.706
298 HE21 GLN 39 HE21 GLN 39 6.492 -9.503 9.612
299 HE22 GLN 39 HE22 GLN 39 7.922 -8.633 9.073
300 H GLY 40 H GLY 40 2.898 -4.372 9.043
301 HA2 GLY 40 HA2 GLY 40 2.912 -2.366 7.880
302 HA3 GLY 40 HA3 GLY 40 4.207 -2.970 6.859
303 H TRP 41 H TRP 41 1.230 -4.763 7.313
304 HA TRP 41 HA TRP 41 0.617 -4.691 4.432
305 HB2 TRP 41 HB2 TRP 41 0.075 -6.446 6.814
306 HB3 TRP 41 HB3 TRP 41 -1.246 -6.306 5.672
307 HD1 TRP 41 HD1 TRP 41 1.133 -8.684 6.432
308 HE1 TRP 41 HE1 TRP 41 1.718 -10.135 4.408
309 HE3 TRP 41 HE3 TRP 41 -0.526 -5.630 2.705
310 HZ2 TRP 41 HZ2 TRP 41 1.991 -9.773 1.575
311 HZ3 TRP 41 HZ3 TRP 41 -0.134 -6.256 0.330
312 HH2 TRP 41 HH2 TRP 41 1.123 -8.182 -0.263
313 H CYS 42 H CYS 42 -1.239 -3.574 3.648
314 HA CYS 42 HA CYS 42 -3.148 -2.503 5.650
315 HB2 CYS 42 HB2 CYS 42 -1.434 -0.954 3.690
316 HB3 CYS 42 HB3 CYS 42 -3.080 -0.412 4.048
317 HG CYS 42 HG CYS 42 -1.334 0.945 5.550
318 H LYS 43 H LYS 43 -5.165 -2.966 4.975
319 HA LYS 43 HA LYS 43 -5.521 -4.060 2.253
320 HB2 LYS 43 HB2 LYS 43 -6.916 -4.247 4.794
321 HB3 LYS 43 HB3 LYS 43 -8.047 -3.653 3.591
322 HG2 LYS 43 HG2 LYS 43 -6.352 -5.980 2.693
323 HG3 LYS 43 HG3 LYS 43 -7.383 -6.277 4.086
324 HD2 LYS 43 HD2 LYS 43 -9.346 -5.401 2.746
325 HD3 LYS 43 HD3 LYS 43 -8.267 -5.311 1.333
326 HE2 LYS 43 HE2 LYS 43 -7.678 -7.734 1.647
327 HE3 LYS 43 HE3 LYS 43 -8.620 -7.762 3.129
328 HZ1 LYS 43 HZ1 LYS 43 -9.782 -8.794 1.453
329 HZ2 LYS 43 HZ2 LYS 43 -9.748 -7.576 0.407
330 HZ3 LYS 43 HZ3 LYS 43 -10.634 -7.432 1.806
331 H GLY 44 H GLY 44 -6.486 -2.921 0.522
332 HA2 GLY 44 HA2 GLY 44 -7.665 -0.284 1.023
333 HA3 GLY 44 HA3 GLY 44 -6.148 -0.247 0.155
334 H ARG 45 H ARG 45 -8.082 0.790 -1.237
335 HA ARG 45 HA ARG 45 -9.125 -1.305 -3.058
336 HB2 ARG 45 HB2 ARG 45 -10.813 0.018 -1.538
337 HB3 ARG 45 HB3 ARG 45 -10.386 1.414 -2.520
338 HG2 ARG 45 HG2 ARG 45 -11.052 -0.486 -4.450
339 HG3 ARG 45 HG3 ARG 45 -12.125 -0.923 -3.133
340 HD2 ARG 45 HD2 ARG 45 -11.896 1.719 -4.617
341 HD3 ARG 45 HD3 ARG 45 -13.228 0.573 -4.662
342 HE ARG 45 HE ARG 45 -12.500 2.297 -2.332
343 HH11 ARG 45 HH11 ARG 45 -15.113 0.978 -4.504
344 HH12 ARG 45 HH12 ARG 45 -16.312 1.646 -3.470
345 HH21 ARG 45 HH21 ARG 45 -14.267 3.257 -1.187
346 HH22 ARG 45 HH22 ARG 45 -15.873 3.019 -1.838
347 H LEU 46 H LEU 46 -9.016 -0.868 -5.232
348 HA LEU 46 HA LEU 46 -7.141 1.261 -6.058
349 HB2 LEU 46 HB2 LEU 46 -7.831 -1.507 -7.041
350 HB3 LEU 46 HB3 LEU 46 -7.476 -0.326 -8.308
351 HG LEU 46 HG LEU 46 -5.767 -0.760 -5.887
352 HD11 LEU 46 HD11 LEU 46 -5.960 -2.827 -7.285
353 HD12 LEU 46 HD12 LEU 46 -4.338 -2.135 -7.156
354 HD13 LEU 46 HD13 LEU 46 -5.291 -1.913 -8.650
355 HD21 LEU 46 HD21 LEU 46 -5.298 1.425 -7.077
356 HD22 LEU 46 HD22 LEU 46 -5.141 0.544 -8.603
357 HD23 LEU 46 HD23 LEU 46 -3.966 0.297 -7.309
358 H LEU 47 H LEU 47 -7.599 2.062 -8.378
359 HA LEU 47 HA LEU 47 -9.909 3.690 -8.251
360 HB2 LEU 47 HB2 LEU 47 -8.128 3.036 -10.631
361 HB3 LEU 47 HB3 LEU 47 -9.290 4.345 -10.551
362 HG LEU 47 HG LEU 47 -7.190 5.306 -10.213
363 HD11 LEU 47 HD11 LEU 47 -8.289 5.085 -7.402
364 HD12 LEU 47 HD12 LEU 47 -8.963 6.138 -8.677
365 HD13 LEU 47 HD13 LEU 47 -7.310 6.387 -8.088
366 HD21 LEU 47 HD21 LEU 47 -6.012 3.150 -9.587
367 HD22 LEU 47 HD22 LEU 47 -6.448 3.529 -7.888
368 HD23 LEU 47 HD23 LEU 47 -5.469 4.643 -8.828
369 H THR 48 H THR 48 -9.205 0.697 -10.034
370 HA THR 48 HA THR 48 -11.688 0.598 -11.452
371 HB THR 48 HB THR 48 -9.548 -0.455 -12.134
372 HG1 THR 48 HG1 THR 48 -11.844 -2.050 -11.896
373 HG21 THR 48 HG21 THR 48 -10.099 -2.457 -9.899
374 HG22 THR 48 HG22 THR 48 -8.686 -1.383 -10.058
375 HG23 THR 48 HG23 THR 48 -8.953 -2.693 -11.212
376 H GLY 49 H GLY 49 -11.471 0.636 -8.224
377 HA2 GLY 49 HA2 GLY 49 -12.983 0.130 -6.648
378 HA3 GLY 49 HA3 GLY 49 -13.904 -0.816 -7.810
379 H HIS 50 H HIS 50 -10.775 -2.173 -7.890
380 HA HIS 50 HA HIS 50 -11.701 -4.519 -6.504
381 HB2 HIS 50 HB2 HIS 50 -10.262 -4.572 -8.478
382 HB3 HIS 50 HB3 HIS 50 -9.019 -3.639 -7.651
383 HD1 HIS 50 HD1 HIS 50 -10.701 -6.912 -6.235
384 HD2 HIS 50 HD2 HIS 50 -7.121 -5.352 -7.831
385 HE1 HIS 50 HE1 HIS 50 -8.924 -8.685 -5.885
386 H VAL 51 H VAL 51 -10.993 -5.328 -4.411
387 HA VAL 51 HA VAL 51 -9.364 -3.458 -2.803
388 HB VAL 51 HB VAL 51 -11.894 -3.367 -2.464
389 HG11 VAL 51 HG11 VAL 51 -13.015 -5.044 -1.171
390 HG12 VAL 51 HG12 VAL 51 -12.291 -5.845 -2.568
391 HG13 VAL 51 HG13 VAL 51 -11.532 -5.997 -0.979
392 HG21 VAL 51 HG21 VAL 51 -11.797 -3.278 -0.012
393 HG22 VAL 51 HG22 VAL 51 -10.168 -3.993 -0.055
394 HG23 VAL 51 HG23 VAL 51 -10.483 -2.404 -0.799
395 H GLY 52 H GLY 52 -7.888 -4.451 -1.316
396 HA2 GLY 52 HA2 GLY 52 -7.786 -7.185 -0.633
397 HA3 GLY 52 HA3 GLY 52 -6.814 -6.956 -2.088
398 H LEU 53 H LEU 53 -5.285 -7.749 -0.111
399 HA LEU 53 HA LEU 53 -4.305 -5.625 1.642
400 HB2 LEU 53 HB2 LEU 53 -3.610 -8.502 1.026
401 HB3 LEU 53 HB3 LEU 53 -2.327 -7.502 1.653
402 HG LEU 53 HG LEU 53 -4.910 -8.156 3.083
403 HD11 LEU 53 HD11 LEU 53 -2.958 -9.840 2.897
404 HD12 LEU 53 HD12 LEU 53 -3.464 -9.410 4.552
405 HD13 LEU 53 HD13 LEU 53 -1.999 -8.706 3.831
406 HD21 LEU 53 HD21 LEU 53 -3.782 -6.967 5.028
407 HD22 LEU 53 HD22 LEU 53 -4.358 -5.885 3.781
408 HD23 LEU 53 HD23 LEU 53 -2.630 -6.276 3.863
409 H TYR 54 H TYR 54 -2.544 -4.277 1.290
410 HA TYR 54 HA TYR 54 -0.831 -4.715 -1.033
411 HB2 TYR 54 HB2 TYR 54 -1.116 -2.664 -1.977
412 HB3 TYR 54 HB3 TYR 54 -2.750 -3.071 -1.599
413 HD1 TYR 54 HD1 TYR 54 -4.013 -1.788 0.051
414 HD2 TYR 54 HD2 TYR 54 0.173 -0.961 -0.607
415 HE1 TYR 54 HE1 TYR 54 -4.170 0.225 1.492
416 HE2 TYR 54 HE2 TYR 54 0.015 1.002 0.775
417 HH TYR 54 HH TYR 54 -1.276 2.219 2.329
418 HA PRO 55 HA PRO 55 1.847 -3.788 2.397
419 HB2 PRO 55 HB2 PRO 55 4.238 -3.375 1.181
420 HB3 PRO 55 HB3 PRO 55 3.445 -4.983 1.237
421 HG2 PRO 55 HG2 PRO 55 3.394 -2.933 -0.985
422 HG3 PRO 55 HG3 PRO 55 3.740 -4.691 -1.101
423 HD2 PRO 55 HD2 PRO 55 1.285 -3.667 -1.680
424 HD3 PRO 55 HD3 PRO 55 1.499 -5.248 -0.881
425 H ALA 56 H ALA 56 1.585 -1.892 3.535
426 HA ALA 56 HA ALA 56 1.308 0.677 2.340
427 HB1 ALA 56 HB1 ALA 56 1.765 1.457 4.760
428 HB2 ALA 56 HB2 ALA 56 0.344 0.468 4.421
429 HB3 ALA 56 HB3 ALA 56 1.773 -0.270 5.175
430 H ASN 57 H ASN 57 4.089 -1.082 3.414
431 HA ASN 57 HA ASN 57 6.088 0.879 3.588
432 HB2 ASN 57 HB2 ASN 57 6.225 -1.960 2.462
433 HB3 ASN 57 HB3 ASN 57 7.638 -0.971 2.785
434 HD21 ASN 57 HD21 ASN 57 6.073 -3.572 4.028
435 HD22 ASN 57 HD22 ASN 57 6.525 -3.273 5.708
436 H TYR 58 H TYR 58 4.368 -0.055 0.659
437 HA TYR 58 HA TYR 58 6.565 0.961 -1.039
438 HB2 TYR 58 HB2 TYR 58 4.308 -0.927 -1.557
439 HB3 TYR 58 HB3 TYR 58 5.286 -0.252 -2.856
440 HD1 TYR 58 HD1 TYR 58 5.681 -2.049 0.403
441 HD2 TYR 58 HD2 TYR 58 7.082 -1.653 -3.630
442 HE1 TYR 58 HE1 TYR 58 7.482 -3.680 0.897
443 HE2 TYR 58 HE2 TYR 58 8.879 -3.283 -3.160
444 HH TYR 58 HH TYR 58 10.020 -4.451 -1.448
445 H VAL 59 H VAL 59 3.950 2.331 0.438
446 HA VAL 59 HA VAL 59 3.618 4.223 -1.802
447 HB VAL 59 HB VAL 59 1.281 4.250 -1.687
448 HG11 VAL 59 HG11 VAL 59 1.750 1.278 -1.193
449 HG12 VAL 59 HG12 VAL 59 0.420 2.047 -2.085
450 HG13 VAL 59 HG13 VAL 59 2.059 2.075 -2.739
451 HG21 VAL 59 HG21 VAL 59 1.410 2.696 0.910
452 HG22 VAL 59 HG22 VAL 59 0.934 4.385 0.710
453 HG23 VAL 59 HG23 VAL 59 -0.092 3.133 0.031
454 H GLU 60 H GLU 60 2.810 6.353 -1.005
455 HA GLU 60 HA GLU 60 3.244 6.843 1.891
456 HB2 GLU 60 HB2 GLU 60 4.712 8.100 -0.457
457 HB3 GLU 60 HB3 GLU 60 4.417 9.016 1.039
458 HG2 GLU 60 HG2 GLU 60 5.457 7.157 2.335
459 HG3 GLU 60 HG3 GLU 60 5.949 6.400 0.824
460 H LYS 61 H LYS 61 2.384 9.030 2.468
461 HA LYS 61 HA LYS 61 -0.221 9.350 1.197
462 HB2 LYS 61 HB2 LYS 61 1.218 10.559 3.535
463 HB3 LYS 61 HB3 LYS 61 0.046 11.589 2.708
464 HG2 LYS 61 HG2 LYS 61 -1.580 9.583 2.863
465 HG3 LYS 61 HG3 LYS 61 -0.476 8.958 4.096
466 HD2 LYS 61 HD2 LYS 61 -2.113 11.521 4.050
467 HD3 LYS 61 HD3 LYS 61 -2.187 10.227 5.249
468 HE2 LYS 61 HE2 LYS 61 0.195 12.068 4.739
469 HE3 LYS 61 HE3 LYS 61 -0.995 12.341 6.005
470 HZ1 LYS 61 HZ1 LYS 61 1.021 11.192 6.809
471 HZ2 LYS 61 HZ2 LYS 61 0.719 9.919 5.853
472 HZ3 LYS 61 HZ3 LYS 61 -0.354 10.303 7.053
473 H VAL 62 H VAL 62 -0.985 11.295 0.230
474 HA VAL 62 HA VAL 62 1.045 13.096 -0.859
475 HB VAL 62 HB VAL 62 0.799 11.059 -2.298
476 HG11 VAL 62 HG11 VAL 62 -1.263 10.660 -3.552
477 HG12 VAL 62 HG12 VAL 62 -1.562 10.563 -1.809
478 HG13 VAL 62 HG13 VAL 62 -2.064 12.000 -2.719
479 HG21 VAL 62 HG21 VAL 62 1.460 13.253 -3.287
480 HG22 VAL 62 HG22 VAL 62 0.747 12.083 -4.398
481 HG23 VAL 62 HG23 VAL 62 -0.227 13.447 -3.847
482 H GLY 63 H GLY 63 -0.428 14.660 -2.476
483 HA2 GLY 63 HA2 GLY 63 -2.337 15.926 -2.737
484 HA3 GLY 63 HA3 GLY 63 -2.964 15.354 -1.182
485 H LEU 64 H LEU 64 -1.136 16.043 0.602
486 HA LEU 64 HA LEU 64 -1.367 19.018 0.535
487 HB2 LEU 64 HB2 LEU 64 -1.114 17.074 2.840
488 HB3 LEU 64 HB3 LEU 64 -0.811 18.791 3.020
489 HG LEU 64 HG LEU 64 -3.136 19.188 1.976
490 HD11 LEU 64 HD11 LEU 64 -3.318 16.211 2.598
491 HD12 LEU 64 HD12 LEU 64 -3.749 17.041 1.089
492 HD13 LEU 64 HD13 LEU 64 -4.747 17.257 2.522
493 HD21 LEU 64 HD21 LEU 64 -2.605 19.576 4.315
494 HD22 LEU 64 HD22 LEU 64 -2.898 17.859 4.693
495 HD23 LEU 64 HD23 LEU 64 -4.241 18.893 4.137
496 H ALA 65 H ALA 65 0.360 20.251 1.742
497 HA ALA 65 HA ALA 65 3.086 19.308 1.104
498 HB1 ALA 65 HB1 ALA 65 1.733 21.924 0.328
499 HB2 ALA 65 HB2 ALA 65 3.473 21.665 0.230
500 HB3 ALA 65 HB3 ALA 65 2.382 20.685 -0.771
501 H ALA 66 H ALA 66 4.702 20.534 2.133
502 HA ALA 66 HA ALA 66 5.802 21.061 4.032
503 HB1 ALA 66 HB1 ALA 66 5.272 23.378 4.826
504 HB2 ALA 66 HB2 ALA 66 5.456 23.225 3.062
505 HB3 ALA 66 HB3 ALA 66 3.840 23.354 3.771
506 H ALA 67 H ALA 67 4.661 19.042 4.901
507 HA ALA 67 HA ALA 67 4.085 19.356 7.641
508 HB1 ALA 67 HB1 ALA 67 1.817 19.968 6.977
509 HB2 ALA 67 HB2 ALA 67 1.741 18.606 5.826
510 HB3 ALA 67 HB3 ALA 67 1.809 18.305 7.585
511 H1 THR 101 H THR 101 2.131 -13.567 11.534
512 HA THR 101 HA THR 101 -0.073 -12.753 11.397
513 HB THR 101 HB THR 101 0.547 -10.376 11.386
514 HG1 THR 101 HG1 THR 101 -1.283 -9.821 10.357
515 HG21 THR 101 HG21 THR 101 0.900 -9.148 9.322
516 HG22 THR 101 HG22 THR 101 0.963 -10.645 8.379
517 HG23 THR 101 HG23 THR 101 2.234 -10.291 9.581
518 H LYS 102 H LYS 102 -1.327 -13.886 10.005
519 HA LYS 102 HA LYS 102 -0.193 -15.648 8.133
520 HB2 LYS 102 HB2 LYS 102 -2.982 -14.576 8.582
521 HB3 LYS 102 HB3 LYS 102 -2.691 -15.676 7.251
522 HG2 LYS 102 HG2 LYS 102 -1.616 -16.610 9.889
523 HG3 LYS 102 HG3 LYS 102 -3.362 -16.412 9.826
524 HD2 LYS 102 HD2 LYS 102 -2.740 -18.714 9.243
525 HD3 LYS 102 HD3 LYS 102 -3.531 -17.896 7.881
526 HE2 LYS 102 HE2 LYS 102 -1.226 -17.323 7.013
527 HE3 LYS 102 HE3 LYS 102 -0.534 -18.353 8.248
528 HZ1 LYS 102 HZ1 LYS 102 -2.322 -19.162 6.055
529 HZ2 LYS 102 HZ2 LYS 102 -1.800 -20.211 7.234
530 HZ3 LYS 102 HZ3 LYS 102 -0.734 -19.486 6.189
531 H GLY 103 H GLY 103 0.539 -15.411 6.071
532 HA2 GLY 103 HA2 GLY 103 0.587 -14.586 3.879
533 HA3 GLY 103 HA3 GLY 103 -0.472 -13.263 4.333
534 HA PRO 104 HA PRO 104 4.026 -12.068 5.710
535 HB2 PRO 104 HB2 PRO 104 6.071 -12.987 4.124
536 HB3 PRO 104 HB3 PRO 104 5.459 -13.899 5.540
537 HG2 PRO 104 HG2 PRO 104 4.715 -14.266 2.621
538 HG3 PRO 104 HG3 PRO 104 5.195 -15.519 3.813
539 HD2 PRO 104 HD2 PRO 104 2.589 -14.978 3.216
540 HD3 PRO 104 HD3 PRO 104 3.088 -15.408 4.883
541 H ALA 105 H ALA 105 5.102 -10.270 4.872
542 HA ALA 105 HA ALA 105 3.984 -9.055 2.457
543 HB1 ALA 105 HB1 ALA 105 3.844 -7.794 4.530
544 HB2 ALA 105 HB2 ALA 105 5.569 -8.074 4.878
545 HB3 ALA 105 HB3 ALA 105 5.101 -7.006 3.580
546 HA PRO 106 HA PRO 106 7.777 -9.160 0.091
547 HB2 PRO 106 HB2 PRO 106 7.871 -6.557 -0.946
548 HB3 PRO 106 HB3 PRO 106 6.796 -7.880 -1.465
549 HG2 PRO 106 HG2 PRO 106 6.172 -5.586 0.344
550 HG3 PRO 106 HG3 PRO 106 5.213 -6.266 -1.018
551 HD2 PRO 106 HD2 PRO 106 4.713 -6.866 1.573
552 HD3 PRO 106 HD3 PRO 106 4.485 -8.054 0.284
553 H ASN 107 H ASN 107 7.429 -7.009 2.474
554 HA ASN 107 HA ASN 107 9.571 -5.375 2.893
555 HB2 ASN 107 HB2 ASN 107 7.614 -5.779 4.475
556 HB3 ASN 107 HB3 ASN 107 8.543 -7.128 5.143
557 HD21 ASN 107 HD21 ASN 107 8.416 -3.598 4.767
558 HD22 ASN 107 HD22 ASN 107 9.642 -3.200 5.912
559 HA PRO 108 HA PRO 108 11.739 -4.785 4.682
560 HB2 PRO 108 HB2 PRO 108 14.214 -4.361 3.489
561 HB3 PRO 108 HB3 PRO 108 13.898 -5.035 5.118
562 HG2 PRO 108 HG2 PRO 108 14.408 -6.521 2.533
563 HG3 PRO 108 HG3 PRO 108 15.110 -6.812 4.162
564 HD2 PRO 108 HD2 PRO 108 13.049 -8.300 3.277
565 HD3 PRO 108 HD3 PRO 108 13.050 -7.721 4.969
566 HA PRO 109 HA PRO 109 10.383 -2.516 1.235
567 HB2 PRO 109 HB2 PRO 109 11.131 0.044 1.799
568 HB3 PRO 109 HB3 PRO 109 9.923 -0.839 2.762
569 HG2 PRO 109 HG2 PRO 109 12.861 -0.458 3.387
570 HG3 PRO 109 HG3 PRO 109 11.452 -0.280 4.480
571 HD2 PRO 109 HD2 PRO 109 12.969 -2.536 4.379
572 HD3 PRO 109 HD3 PRO 109 11.231 -2.542 4.766
573 HA PRO 110 HA PRO 110 13.641 -2.323 -1.665
574 HB2 PRO 110 HB2 PRO 110 12.829 -0.585 -3.606
575 HB3 PRO 110 HB3 PRO 110 12.009 -2.130 -3.273
576 HG2 PRO 110 HG2 PRO 110 11.170 0.623 -2.385
577 HG3 PRO 110 HG3 PRO 110 10.166 -0.716 -3.018
578 HD2 PRO 110 HD2 PRO 110 10.501 -0.132 -0.323
579 HD3 PRO 110 HD3 PRO 110 10.089 -1.750 -0.941
580 H ILE 111 H ILE 111 12.793 1.150 -1.813
581 HA ILE 111 HA ILE 111 15.323 1.991 -0.580
582 HB ILE 111 HB ILE 111 15.580 3.515 -2.635
583 HG12 ILE 111 HG12 ILE 111 13.672 1.508 -3.963
584 HG13 ILE 111 HG13 ILE 111 13.256 3.152 -3.534
585 HG21 ILE 111 HG21 ILE 111 15.917 0.574 -3.267
586 HG22 ILE 111 HG22 ILE 111 16.900 1.947 -3.804
587 HG23 ILE 111 HG23 ILE 111 16.940 1.441 -2.116
588 HD11 ILE 111 HD11 ILE 111 15.008 3.964 -5.117
589 HD12 ILE 111 HD12 ILE 111 15.346 2.276 -5.565
590 HD13 ILE 111 HD13 ILE 111 13.757 2.975 -5.892
591 H LEU 112 H LEU 112 15.129 4.646 -1.008
592 HA LEU 112 HA LEU 112 14.361 6.477 0.015
593 HB2 LEU 112 HB2 LEU 112 11.897 5.696 -1.568
594 HB3 LEU 112 HB3 LEU 112 12.115 7.234 -0.777
595 HG LEU 112 HG LEU 112 12.515 7.648 -2.993
596 HD11 LEU 112 HD11 LEU 112 15.311 7.353 -1.831
597 HD12 LEU 112 HD12 LEU 112 14.171 8.675 -1.475
598 HD13 LEU 112 HD13 LEU 112 14.788 8.444 -3.121
599 HD21 LEU 112 HD21 LEU 112 14.460 5.342 -3.207
600 HD22 LEU 112 HD22 LEU 112 14.044 6.481 -4.478
601 HD23 LEU 112 HD23 LEU 112 12.809 5.378 -3.893
602 H LYS 113 H LYS 113 14.600 5.352 2.126
603 HA LYS 113 HA LYS 113 12.024 4.780 3.451
604 HB2 LYS 113 HB2 LYS 113 13.278 4.032 5.334
605 HB3 LYS 113 HB3 LYS 113 13.899 3.250 3.899
606 HG2 LYS 113 HG2 LYS 113 15.922 4.441 3.926
607 HG3 LYS 113 HG3 LYS 113 15.299 5.698 5.016
608 HD2 LYS 113 HD2 LYS 113 15.145 4.170 6.867
609 HD3 LYS 113 HD3 LYS 113 15.531 2.777 5.863
610 HE2 LYS 113 HE2 LYS 113 17.487 5.071 5.891
611 HE3 LYS 113 HE3 LYS 113 17.382 4.063 7.347
612 HZ1 LYS 113 HZ1 LYS 113 17.656 2.768 4.728
613 HZ2 LYS 113 HZ2 LYS 113 17.971 2.199 6.212
614 HZ3 LYS 113 HZ3 LYS 113 18.985 3.335 5.570
615 H VAL 114 H VAL 114 11.899 5.651 5.792
616 HA VAL 114 HA VAL 114 12.561 8.556 5.897
617 HB VAL 114 HB VAL 114 10.534 8.952 7.041
618 HG11 VAL 114 HG11 VAL 114 8.891 8.488 5.368
619 HG12 VAL 114 HG12 VAL 114 10.432 8.802 4.555
620 HG13 VAL 114 HG13 VAL 114 9.828 7.140 4.709
621 HG21 VAL 114 HG21 VAL 114 10.218 7.106 8.494
622 HG22 VAL 114 HG22 VAL 114 8.825 7.118 7.410
623 HG23 VAL 114 HG23 VAL 114 10.133 5.948 7.165
624 H TRP 115 H TRP 115 13.613 5.727 7.123
625 HA TRP 115 HA TRP 115 14.924 5.079 8.820
626 HB2 TRP 115 HB2 TRP 115 14.961 7.972 9.713
627 HB3 TRP 115 HB3 TRP 115 15.751 6.665 10.551
628 HD1 TRP 115 HD1 TRP 115 15.932 8.528 7.245
629 HE1 TRP 115 HE1 TRP 115 18.303 8.298 6.228
630 HE3 TRP 115 HE3 TRP 115 17.959 5.341 10.666
631 HZ2 TRP 115 HZ2 TRP 115 20.847 7.235 7.082
632 HZ3 TRP 115 HZ3 TRP 115 20.371 4.832 10.633
633 HH2 TRP 115 HH2 TRP 115 21.836 5.762 8.839
Start of MODEL 8
1 H1 MET 1 H MET 1 -19.757 10.848 12.369
2 HA MET 1 HA MET 1 -17.510 9.943 12.027
3 HB2 MET 1 HB2 MET 1 -17.611 8.214 13.665
4 HB3 MET 1 HB3 MET 1 -18.771 9.459 14.078
5 HG2 MET 1 HG2 MET 1 -20.548 7.938 13.038
6 HG3 MET 1 HG3 MET 1 -19.301 6.691 13.007
7 HE1 MET 1 HE1 MET 1 -21.691 5.578 15.920
8 HE2 MET 1 HE2 MET 1 -22.213 6.500 14.506
9 HE3 MET 1 HE3 MET 1 -21.035 5.187 14.316
10 H LYS 2 H LYS 2 -16.359 9.092 10.357
11 HA LYS 2 HA LYS 2 -17.336 6.666 8.999
12 HB2 LYS 2 HB2 LYS 2 -16.675 9.340 7.647
13 HB3 LYS 2 HB3 LYS 2 -16.706 7.798 6.798
14 HG2 LYS 2 HG2 LYS 2 -19.114 7.516 7.418
15 HG3 LYS 2 HG3 LYS 2 -19.086 9.153 8.097
16 HD2 LYS 2 HD2 LYS 2 -18.357 10.049 5.880
17 HD3 LYS 2 HD3 LYS 2 -18.393 8.399 5.223
18 HE2 LYS 2 HE2 LYS 2 -20.827 8.278 5.898
19 HE3 LYS 2 HE3 LYS 2 -20.761 10.006 6.282
20 HZ1 LYS 2 HZ1 LYS 2 -20.216 10.438 3.981
21 HZ2 LYS 2 HZ2 LYS 2 -21.574 9.529 4.026
22 HZ3 LYS 2 HZ3 LYS 2 -20.164 8.821 3.627
23 H VAL 3 H VAL 3 -15.587 5.854 7.550
24 HA VAL 3 HA VAL 3 -12.872 6.743 8.335
25 HB VAL 3 HB VAL 3 -13.330 4.965 9.771
26 HG11 VAL 3 HG11 VAL 3 -15.184 3.805 8.720
27 HG12 VAL 3 HG12 VAL 3 -14.132 3.238 7.408
28 HG13 VAL 3 HG13 VAL 3 -13.868 2.695 9.083
29 HG21 VAL 3 HG21 VAL 3 -11.584 3.906 7.523
30 HG22 VAL 3 HG22 VAL 3 -11.102 5.125 8.730
31 HG23 VAL 3 HG23 VAL 3 -11.512 3.493 9.256
32 HA PRO 4 HA PRO 4 -13.616 6.694 3.783
33 HB2 PRO 4 HB2 PRO 4 -12.241 8.965 3.148
34 HB3 PRO 4 HB3 PRO 4 -13.908 9.002 3.796
35 HG2 PRO 4 HG2 PRO 4 -11.317 9.365 5.319
36 HG3 PRO 4 HG3 PRO 4 -12.781 10.381 5.386
37 HD2 PRO 4 HD2 PRO 4 -12.212 8.427 7.212
38 HD3 PRO 4 HD3 PRO 4 -13.898 8.802 6.730
39 H GLY 5 H GLY 5 -11.926 6.469 1.991
40 HA2 GLY 5 HA2 GLY 5 -9.819 4.819 2.915
41 HA3 GLY 5 HA3 GLY 5 -10.106 5.387 1.252
42 H VAL 6 H VAL 6 -7.499 5.223 2.283
43 HA VAL 6 HA VAL 6 -6.728 8.117 2.555
44 HB VAL 6 HB VAL 6 -5.397 5.638 3.721
45 HG11 VAL 6 HG11 VAL 6 -3.838 7.221 4.792
46 HG12 VAL 6 HG12 VAL 6 -3.715 7.285 3.031
47 HG13 VAL 6 HG13 VAL 6 -4.582 8.566 3.897
48 HG21 VAL 6 HG21 VAL 6 -5.972 6.517 5.905
49 HG22 VAL 6 HG22 VAL 6 -6.705 7.962 5.171
50 HG23 VAL 6 HG23 VAL 6 -7.469 6.397 4.963
51 H ARG 7 H ARG 7 -5.866 8.715 0.592
52 HA ARG 7 HA ARG 7 -5.205 6.582 -1.297
53 HB2 ARG 7 HB2 ARG 7 -5.285 8.024 -2.966
54 HB3 ARG 7 HB3 ARG 7 -6.328 8.893 -1.872
55 HG2 ARG 7 HG2 ARG 7 -3.390 9.525 -2.369
56 HG3 ARG 7 HG3 ARG 7 -4.717 10.248 -3.227
57 HD2 ARG 7 HD2 ARG 7 -4.147 10.563 -0.250
58 HD3 ARG 7 HD3 ARG 7 -3.910 11.770 -1.512
59 HE ARG 7 HE ARG 7 -6.288 11.312 -0.053
60 HH11 ARG 7 HH11 ARG 7 -5.181 12.395 -3.283
61 HH12 ARG 7 HH12 ARG 7 -6.704 13.126 -3.629
62 HH21 ARG 7 HH21 ARG 7 -8.315 12.017 -0.685
63 HH22 ARG 7 HH22 ARG 7 -8.574 12.765 -2.215
64 H VAL 8 H VAL 8 -3.270 5.680 -1.485
65 HA VAL 8 HA VAL 8 -0.920 7.178 -0.472
66 HB VAL 8 HB VAL 8 0.027 5.086 0.392
67 HG11 VAL 8 HG11 VAL 8 -2.643 5.764 1.689
68 HG12 VAL 8 HG12 VAL 8 -1.239 5.018 2.466
69 HG13 VAL 8 HG13 VAL 8 -1.144 6.689 1.903
70 HG21 VAL 8 HG21 VAL 8 -1.411 3.170 0.931
71 HG22 VAL 8 HG22 VAL 8 -2.753 3.910 0.040
72 HG23 VAL 8 HG23 VAL 8 -1.264 3.412 -0.817
73 H ARG 9 H ARG 9 0.831 7.064 -1.800
74 HA ARG 9 HA ARG 9 0.255 6.005 -4.492
75 HB2 ARG 9 HB2 ARG 9 0.663 8.437 -4.218
76 HB3 ARG 9 HB3 ARG 9 2.296 8.086 -3.642
77 HG2 ARG 9 HG2 ARG 9 2.765 6.965 -5.854
78 HG3 ARG 9 HG3 ARG 9 1.099 7.315 -6.343
79 HD2 ARG 9 HD2 ARG 9 2.533 8.953 -7.355
80 HD3 ARG 9 HD3 ARG 9 1.577 9.769 -6.107
81 HE ARG 9 HE ARG 9 4.056 8.826 -5.026
82 HH11 ARG 9 HH11 ARG 9 2.972 11.321 -7.362
83 HH12 ARG 9 HH12 ARG 9 4.358 12.320 -7.060
84 HH21 ARG 9 HH21 ARG 9 5.832 10.187 -4.665
85 HH22 ARG 9 HH22 ARG 9 6.024 11.656 -5.525
86 H ALA 10 H ALA 10 1.370 4.407 -5.250
87 HA ALA 10 HA ALA 10 3.251 2.934 -3.597
88 HB1 ALA 10 HB1 ALA 10 3.418 1.545 -5.746
89 HB2 ALA 10 HB2 ALA 10 1.796 1.667 -5.018
90 HB3 ALA 10 HB3 ALA 10 2.214 2.650 -6.430
91 H LEU 11 H LEU 11 5.366 3.280 -3.394
92 HA LEU 11 HA LEU 11 6.746 5.255 -4.954
93 HB2 LEU 11 HB2 LEU 11 7.585 3.168 -2.906
94 HB3 LEU 11 HB3 LEU 11 8.718 4.323 -3.589
95 HG LEU 11 HG LEU 11 6.152 5.419 -2.413
96 HD11 LEU 11 HD11 LEU 11 6.755 3.890 -0.674
97 HD12 LEU 11 HD12 LEU 11 7.193 5.526 -0.159
98 HD13 LEU 11 HD13 LEU 11 8.442 4.398 -0.714
99 HD21 LEU 11 HD21 LEU 11 7.617 7.297 -1.814
100 HD22 LEU 11 HD22 LEU 11 7.753 6.919 -3.541
101 HD23 LEU 11 HD23 LEU 11 9.030 6.434 -2.423
102 H TYR 12 H TYR 12 6.412 1.747 -5.406
103 HA TYR 12 HA TYR 12 7.907 1.865 -7.879
104 HB2 TYR 12 HB2 TYR 12 9.084 -0.408 -6.784
105 HB3 TYR 12 HB3 TYR 12 9.872 1.089 -7.178
106 HD1 TYR 12 HD1 TYR 12 7.648 -0.111 -4.433
107 HD2 TYR 12 HD2 TYR 12 11.373 1.881 -5.390
108 HE1 TYR 12 HE1 TYR 12 8.149 0.184 -2.047
109 HE2 TYR 12 HE2 TYR 12 11.922 1.985 -3.084
110 HH TYR 12 HH TYR 12 9.617 1.127 -0.415
111 H ASP 13 H ASP 13 7.706 -0.245 -9.028
112 HA ASP 13 HA ASP 13 5.031 -1.261 -8.885
113 HB2 ASP 13 HB2 ASP 13 7.231 -2.223 -10.750
114 HB3 ASP 13 HB3 ASP 13 5.495 -2.196 -11.012
115 H TYR 14 H TYR 14 4.584 -2.747 -7.268
116 HA TYR 14 HA TYR 14 5.991 -5.347 -7.250
117 HB2 TYR 14 HB2 TYR 14 5.781 -3.431 -4.920
118 HB3 TYR 14 HB3 TYR 14 5.474 -5.121 -4.605
119 HD1 TYR 14 HD1 TYR 14 7.314 -6.494 -3.891
120 HD2 TYR 14 HD2 TYR 14 8.031 -2.948 -6.286
121 HE1 TYR 14 HE1 TYR 14 9.684 -7.054 -4.033
122 HE2 TYR 14 HE2 TYR 14 10.424 -3.446 -6.327
123 HH TYR 14 HH TYR 14 11.940 -5.250 -6.092
124 H THR 15 H THR 15 4.499 -7.094 -6.336
125 HA THR 15 HA THR 15 1.698 -6.191 -5.963
126 HB THR 15 HB THR 15 1.582 -6.668 -8.217
127 HG1 THR 15 HG1 THR 15 0.116 -7.917 -6.741
128 HG21 THR 15 HG21 THR 15 3.697 -7.717 -8.719
129 HG22 THR 15 HG22 THR 15 2.390 -8.768 -9.283
130 HG23 THR 15 HG23 THR 15 3.252 -9.161 -7.789
131 H GLY 16 H GLY 16 2.156 -6.478 -3.820
132 HA2 GLY 16 HA2 GLY 16 2.226 -7.677 -1.818
133 HA3 GLY 16 HA3 GLY 16 1.233 -8.857 -2.705
134 H GLN 17 H GLN 17 2.085 -10.643 -1.724
135 HA GLN 17 HA GLN 17 4.827 -11.416 -2.483
136 HB2 GLN 17 HB2 GLN 17 5.320 -12.376 -0.392
137 HB3 GLN 17 HB3 GLN 17 4.720 -10.787 -0.039
138 HG2 GLN 17 HG2 GLN 17 3.483 -11.839 1.532
139 HG3 GLN 17 HG3 GLN 17 2.372 -12.150 0.212
140 HE21 GLN 17 HE21 GLN 17 5.391 -13.640 1.553
141 HE22 GLN 17 HE22 GLN 17 4.810 -15.303 1.478
142 H GLU 18 H GLU 18 1.449 -12.061 -2.736
143 HA GLU 18 HA GLU 18 2.002 -14.721 -3.746
144 HB2 GLU 18 HB2 GLU 18 0.783 -14.128 -1.127
145 HB3 GLU 18 HB3 GLU 18 -0.381 -14.929 -2.171
146 HG2 GLU 18 HG2 GLU 18 2.436 -16.027 -1.898
147 HG3 GLU 18 HG3 GLU 18 1.188 -16.378 -0.704
148 H ALA 19 H ALA 19 -0.120 -15.579 -4.663
149 HA ALA 19 HA ALA 19 -1.095 -13.666 -6.599
150 HB1 ALA 19 HB1 ALA 19 -0.661 -16.081 -7.053
151 HB2 ALA 19 HB2 ALA 19 -2.011 -16.514 -5.980
152 HB3 ALA 19 HB3 ALA 19 -2.310 -15.602 -7.478
153 H ASP 20 H ASP 20 -2.108 -14.099 -3.407
154 HA ASP 20 HA ASP 20 -5.003 -13.707 -3.896
155 HB2 ASP 20 HB2 ASP 20 -3.290 -14.907 -1.829
156 HB3 ASP 20 HB3 ASP 20 -4.430 -13.768 -1.129
157 H GLU 21 H GLU 21 -2.344 -11.804 -3.613
158 HA GLU 21 HA GLU 21 -3.490 -9.587 -2.120
159 HB2 GLU 21 HB2 GLU 21 -0.787 -10.316 -3.298
160 HB3 GLU 21 HB3 GLU 21 -1.081 -8.750 -2.592
161 HG2 GLU 21 HG2 GLU 21 0.035 -10.530 -1.137
162 HG3 GLU 21 HG3 GLU 21 -1.226 -9.526 -0.444
163 H LEU 22 H LEU 22 -2.811 -7.419 -3.012
164 HA LEU 22 HA LEU 22 -4.217 -6.834 -5.501
165 HB2 LEU 22 HB2 LEU 22 -4.431 -5.593 -3.241
166 HB3 LEU 22 HB3 LEU 22 -2.794 -5.062 -3.462
167 HG LEU 22 HG LEU 22 -3.952 -4.132 -5.769
168 HD11 LEU 22 HD11 LEU 22 -6.057 -3.068 -5.225
169 HD12 LEU 22 HD12 LEU 22 -6.091 -3.898 -3.663
170 HD13 LEU 22 HD13 LEU 22 -6.162 -4.830 -5.184
171 HD21 LEU 22 HD21 LEU 22 -2.456 -2.916 -4.274
172 HD22 LEU 22 HD22 LEU 22 -3.837 -2.581 -3.213
173 HD23 LEU 22 HD23 LEU 22 -3.820 -1.957 -4.842
174 H SER 23 H SER 23 -3.080 -5.293 -7.085
175 HA SER 23 HA SER 23 -0.112 -5.575 -7.154
176 HB2 SER 23 HB2 SER 23 -0.463 -5.778 -9.651
177 HB3 SER 23 HB3 SER 23 -0.961 -7.175 -8.701
178 HG SER 23 HG SER 23 -3.120 -6.469 -8.843
179 H PHE 24 H PHE 24 0.924 -3.575 -7.343
180 HA PHE 24 HA PHE 24 -0.659 -1.376 -8.567
181 HB2 PHE 24 HB2 PHE 24 0.145 0.168 -6.891
182 HB3 PHE 24 HB3 PHE 24 -0.953 -1.041 -6.266
183 HD1 PHE 24 HD1 PHE 24 2.805 -0.632 -6.674
184 HD2 PHE 24 HD2 PHE 24 -0.476 -1.717 -4.075
185 HE1 PHE 24 HE1 PHE 24 4.386 -1.004 -4.813
186 HE2 PHE 24 HE2 PHE 24 1.134 -1.883 -2.185
187 HZ PHE 24 HZ PHE 24 3.532 -1.583 -2.564
188 H LYS 25 H LYS 25 0.740 0.376 -9.354
189 HA LYS 25 HA LYS 25 3.464 -0.522 -10.186
190 HB2 LYS 25 HB2 LYS 25 1.207 0.804 -11.720
191 HB3 LYS 25 HB3 LYS 25 2.875 1.194 -12.104
192 HG2 LYS 25 HG2 LYS 25 2.130 -0.497 -13.565
193 HG3 LYS 25 HG3 LYS 25 3.400 -1.150 -12.542
194 HD2 LYS 25 HD2 LYS 25 1.807 -2.472 -11.293
195 HD3 LYS 25 HD3 LYS 25 0.423 -1.658 -12.091
196 HE2 LYS 25 HE2 LYS 25 1.126 -2.496 -14.265
197 HE3 LYS 25 HE3 LYS 25 2.637 -3.113 -13.590
198 HZ1 LYS 25 HZ1 LYS 25 1.164 -4.885 -13.912
199 HZ2 LYS 25 HZ2 LYS 25 -0.050 -4.192 -13.035
200 HZ3 LYS 25 HZ3 LYS 25 1.339 -4.695 -12.299
201 H ALA 26 H ALA 26 4.917 1.375 -10.598
202 HA ALA 26 HA ALA 26 5.026 3.062 -8.303
203 HB1 ALA 26 HB1 ALA 26 6.986 2.459 -9.680
204 HB2 ALA 26 HB2 ALA 26 6.357 3.407 -11.029
205 HB3 ALA 26 HB3 ALA 26 6.832 4.220 -9.513
206 H GLY 27 H GLY 27 3.788 4.805 -7.852
207 HA2 GLY 27 HA2 GLY 27 3.008 6.992 -8.308
208 HA3 GLY 27 HA3 GLY 27 2.879 6.625 -10.019
209 H GLU 28 H GLU 28 1.540 3.903 -8.735
210 HA GLU 28 HA GLU 28 -1.132 4.769 -9.322
211 HB2 GLU 28 HB2 GLU 28 0.037 2.224 -8.078
212 HB3 GLU 28 HB3 GLU 28 -1.695 2.447 -8.302
213 HG2 GLU 28 HG2 GLU 28 0.333 2.620 -10.571
214 HG3 GLU 28 HG3 GLU 28 -0.636 1.190 -10.162
215 H GLU 29 H GLU 29 -2.842 5.243 -8.033
216 HA GLU 29 HA GLU 29 -2.274 5.804 -5.173
217 HB2 GLU 29 HB2 GLU 29 -4.182 6.949 -7.220
218 HB3 GLU 29 HB3 GLU 29 -4.506 7.111 -5.491
219 HG2 GLU 29 HG2 GLU 29 -2.546 8.352 -5.078
220 HG3 GLU 29 HG3 GLU 29 -1.802 7.884 -6.599
221 H LEU 30 H LEU 30 -2.854 4.174 -3.961
222 HA LEU 30 HA LEU 30 -5.345 2.654 -4.602
223 HB2 LEU 30 HB2 LEU 30 -4.343 1.056 -2.916
224 HB3 LEU 30 HB3 LEU 30 -3.740 0.983 -4.578
225 HG LEU 30 HG LEU 30 -2.243 2.426 -2.401
226 HD11 LEU 30 HD11 LEU 30 -2.124 -0.503 -3.210
227 HD12 LEU 30 HD12 LEU 30 -2.641 0.125 -1.652
228 HD13 LEU 30 HD13 LEU 30 -0.953 0.299 -2.135
229 HD21 LEU 30 HD21 LEU 30 -1.405 2.861 -4.699
230 HD22 LEU 30 HD22 LEU 30 -1.342 1.123 -5.018
231 HD23 LEU 30 HD23 LEU 30 -0.267 1.870 -3.815
232 H MET 31 H MET 31 -6.984 2.723 -3.131
233 HA MET 31 HA MET 31 -6.651 4.602 -0.900
234 HB2 MET 31 HB2 MET 31 -9.264 3.320 -1.745
235 HB3 MET 31 HB3 MET 31 -8.951 4.729 -0.731
236 HG2 MET 31 HG2 MET 31 -7.688 5.529 -2.997
237 HG3 MET 31 HG3 MET 31 -8.910 4.464 -3.690
238 HE1 MET 31 HE1 MET 31 -9.315 8.679 -2.171
239 HE2 MET 31 HE2 MET 31 -8.321 7.542 -1.223
240 HE3 MET 31 HE3 MET 31 -7.977 7.812 -2.950
241 H LYS 32 H LYS 32 -5.935 3.745 0.915
242 HA LYS 32 HA LYS 32 -6.143 0.974 1.630
243 HB2 LYS 32 HB2 LYS 32 -4.441 2.474 2.472
244 HB3 LYS 32 HB3 LYS 32 -5.651 3.514 3.218
245 HG2 LYS 32 HG2 LYS 32 -6.315 1.105 4.432
246 HG3 LYS 32 HG3 LYS 32 -4.580 0.908 4.188
247 HD2 LYS 32 HD2 LYS 32 -4.573 1.903 6.250
248 HD3 LYS 32 HD3 LYS 32 -4.463 3.356 5.270
249 HE2 LYS 32 HE2 LYS 32 -6.981 2.176 6.567
250 HE3 LYS 32 HE3 LYS 32 -6.085 3.570 7.122
251 HZ1 LYS 32 HZ1 LYS 32 -6.696 4.683 5.092
252 HZ2 LYS 32 HZ2 LYS 32 -7.982 4.258 6.001
253 HZ3 LYS 32 HZ3 LYS 32 -7.644 3.406 4.628
254 H ILE 33 H ILE 33 -7.894 -0.124 2.648
255 HA ILE 33 HA ILE 33 -10.043 1.616 3.742
256 HB ILE 33 HB ILE 33 -11.599 0.256 2.857
257 HG12 ILE 33 HG12 ILE 33 -9.703 -1.848 1.797
258 HG13 ILE 33 HG13 ILE 33 -10.548 -2.012 3.311
259 HG21 ILE 33 HG21 ILE 33 -11.543 0.589 0.586
260 HG22 ILE 33 HG22 ILE 33 -10.363 1.752 1.212
261 HG23 ILE 33 HG23 ILE 33 -9.823 0.240 0.465
262 HD11 ILE 33 HD11 ILE 33 -12.710 -1.964 2.184
263 HD12 ILE 33 HD12 ILE 33 -11.903 -1.713 0.616
264 HD13 ILE 33 HD13 ILE 33 -11.643 -3.222 1.500
265 H SER 34 H SER 34 -7.653 -0.155 4.962
266 HA SER 34 HA SER 34 -9.238 -0.990 7.285
267 HB2 SER 34 HB2 SER 34 -9.052 -2.893 5.490
268 HB3 SER 34 HB3 SER 34 -7.347 -2.972 5.943
269 HG SER 34 HG SER 34 -9.471 -4.048 7.117
270 H GLU 35 H GLU 35 -7.399 -2.076 8.834
271 HA GLU 35 HA GLU 35 -5.494 0.096 9.330
272 HB2 GLU 35 HB2 GLU 35 -5.060 -1.165 11.340
273 HB3 GLU 35 HB3 GLU 35 -6.784 -1.206 11.061
274 HG2 GLU 35 HG2 GLU 35 -6.461 -3.498 9.970
275 HG3 GLU 35 HG3 GLU 35 -4.795 -3.455 10.552
276 H GLU 36 H GLU 36 -3.139 -0.436 9.910
277 HA GLU 36 HA GLU 36 -1.863 -2.083 7.916
278 HB2 GLU 36 HB2 GLU 36 -1.098 0.253 8.451
279 HB3 GLU 36 HB3 GLU 36 -0.765 -0.282 10.110
280 HG2 GLU 36 HG2 GLU 36 0.849 -1.980 9.201
281 HG3 GLU 36 HG3 GLU 36 0.515 -1.395 7.558
282 H ASP 37 H ASP 37 -0.969 -4.029 8.432
283 HA ASP 37 HA ASP 37 -1.530 -5.097 11.137
284 HB2 ASP 37 HB2 ASP 37 -2.073 -6.156 8.680
285 HB3 ASP 37 HB3 ASP 37 -0.517 -6.924 9.024
286 H GLU 38 H GLU 38 0.120 -6.910 11.737
287 HA GLU 38 HA GLU 38 2.441 -5.809 12.704
288 HB2 GLU 38 HB2 GLU 38 3.155 -8.125 13.139
289 HB3 GLU 38 HB3 GLU 38 1.436 -7.882 13.524
290 HG2 GLU 38 HG2 GLU 38 0.851 -8.921 11.310
291 HG3 GLU 38 HG3 GLU 38 2.556 -9.213 11.004
292 H GLN 39 H GLN 39 2.086 -6.977 9.483
293 HA GLN 39 HA GLN 39 5.018 -7.014 9.109
294 HB2 GLN 39 HB2 GLN 39 3.033 -8.927 8.359
295 HB3 GLN 39 HB3 GLN 39 3.557 -8.175 6.876
296 HG2 GLN 39 HG2 GLN 39 5.160 -9.759 8.880
297 HG3 GLN 39 HG3 GLN 39 4.867 -10.095 7.195
298 HE21 GLN 39 HE21 GLN 39 6.776 -8.109 9.445
299 HE22 GLN 39 HE22 GLN 39 7.773 -7.345 8.227
300 H GLY 40 H GLY 40 2.821 -4.741 9.011
301 HA2 GLY 40 HA2 GLY 40 2.766 -2.763 7.864
302 HA3 GLY 40 HA3 GLY 40 4.111 -3.325 6.842
303 H TRP 41 H TRP 41 1.166 -5.292 7.342
304 HA TRP 41 HA TRP 41 0.664 -5.259 4.440
305 HB2 TRP 41 HB2 TRP 41 -0.178 -6.901 6.818
306 HB3 TRP 41 HB3 TRP 41 -1.387 -6.714 5.567
307 HD1 TRP 41 HD1 TRP 41 0.719 -9.207 6.516
308 HE1 TRP 41 HE1 TRP 41 1.237 -10.795 4.552
309 HE3 TRP 41 HE3 TRP 41 -0.291 -6.057 2.639
310 HZ2 TRP 41 HZ2 TRP 41 1.735 -10.474 1.701
311 HZ3 TRP 41 HZ3 TRP 41 0.220 -6.729 0.298
312 HH2 TRP 41 HH2 TRP 41 1.219 -8.866 -0.170
313 H CYS 42 H CYS 42 -1.424 -4.526 3.545
314 HA CYS 42 HA CYS 42 -3.300 -3.263 5.397
315 HB2 CYS 42 HB2 CYS 42 -1.603 -1.794 3.349
316 HB3 CYS 42 HB3 CYS 42 -3.259 -1.261 3.744
317 HG CYS 42 HG CYS 42 -1.065 -1.895 6.054
318 H LYS 43 H LYS 43 -5.349 -3.390 4.555
319 HA LYS 43 HA LYS 43 -5.679 -4.634 1.877
320 HB2 LYS 43 HB2 LYS 43 -6.612 -5.430 4.406
321 HB3 LYS 43 HB3 LYS 43 -8.034 -4.707 3.676
322 HG2 LYS 43 HG2 LYS 43 -6.379 -6.634 2.003
323 HG3 LYS 43 HG3 LYS 43 -7.289 -7.301 3.337
324 HD2 LYS 43 HD2 LYS 43 -9.390 -6.553 2.460
325 HD3 LYS 43 HD3 LYS 43 -8.588 -5.502 1.282
326 HE2 LYS 43 HE2 LYS 43 -9.342 -7.415 0.062
327 HE3 LYS 43 HE3 LYS 43 -7.584 -7.459 0.198
328 HZ1 LYS 43 HZ1 LYS 43 -7.851 -9.141 1.974
329 HZ2 LYS 43 HZ2 LYS 43 -8.468 -9.614 0.557
330 HZ3 LYS 43 HZ3 LYS 43 -9.493 -9.121 1.732
331 H GLY 44 H GLY 44 -6.338 -3.320 0.297
332 HA2 GLY 44 HA2 GLY 44 -8.096 -1.013 0.852
333 HA3 GLY 44 HA3 GLY 44 -6.560 -0.747 0.127
334 H ARG 45 H ARG 45 -8.107 0.127 -1.491
335 HA ARG 45 HA ARG 45 -8.598 -1.883 -3.647
336 HB2 ARG 45 HB2 ARG 45 -10.783 -1.267 -2.433
337 HB3 ARG 45 HB3 ARG 45 -10.395 0.431 -2.717
338 HG2 ARG 45 HG2 ARG 45 -10.652 0.012 -5.197
339 HG3 ARG 45 HG3 ARG 45 -11.246 -1.604 -4.811
340 HD2 ARG 45 HD2 ARG 45 -12.889 -0.358 -3.209
341 HD3 ARG 45 HD3 ARG 45 -12.410 1.097 -4.067
342 HE ARG 45 HE ARG 45 -13.201 0.063 -6.157
343 HH11 ARG 45 HH11 ARG 45 -14.497 -1.330 -3.133
344 HH12 ARG 45 HH12 ARG 45 -16.061 -1.648 -3.818
345 HH21 ARG 45 HH21 ARG 45 -15.144 -0.806 -7.102
346 HH22 ARG 45 HH22 ARG 45 -16.482 -1.129 -6.079
347 H LEU 46 H LEU 46 -8.129 -1.166 -5.632
348 HA LEU 46 HA LEU 46 -6.677 1.413 -5.832
349 HB2 LEU 46 HB2 LEU 46 -6.909 -1.144 -7.406
350 HB3 LEU 46 HB3 LEU 46 -6.498 0.307 -8.311
351 HG LEU 46 HG LEU 46 -5.001 -0.337 -5.787
352 HD11 LEU 46 HD11 LEU 46 -4.900 -2.329 -7.162
353 HD12 LEU 46 HD12 LEU 46 -3.336 -1.494 -7.154
354 HD13 LEU 46 HD13 LEU 46 -4.403 -1.366 -8.575
355 HD21 LEU 46 HD21 LEU 46 -3.228 0.974 -6.920
356 HD22 LEU 46 HD22 LEU 46 -4.723 1.914 -6.822
357 HD23 LEU 46 HD23 LEU 46 -4.250 1.155 -8.354
358 H LEU 47 H LEU 47 -6.975 2.758 -7.733
359 HA LEU 47 HA LEU 47 -9.612 3.680 -8.048
360 HB2 LEU 47 HB2 LEU 47 -8.704 5.132 -9.755
361 HB3 LEU 47 HB3 LEU 47 -7.657 5.065 -8.361
362 HG LEU 47 HG LEU 47 -6.610 3.037 -10.004
363 HD11 LEU 47 HD11 LEU 47 -8.024 3.843 -11.922
364 HD12 LEU 47 HD12 LEU 47 -6.288 4.048 -12.218
365 HD13 LEU 47 HD13 LEU 47 -7.273 5.444 -11.762
366 HD21 LEU 47 HD21 LEU 47 -5.723 5.906 -9.740
367 HD22 LEU 47 HD22 LEU 47 -4.738 4.531 -10.324
368 HD23 LEU 47 HD23 LEU 47 -5.353 4.542 -8.662
369 H THR 48 H THR 48 -7.746 1.367 -10.017
370 HA THR 48 HA THR 48 -9.702 1.109 -12.100
371 HB THR 48 HB THR 48 -7.402 0.576 -12.535
372 HG1 THR 48 HG1 THR 48 -9.020 -1.724 -12.514
373 HG21 THR 48 HG21 THR 48 -7.626 -1.599 -10.398
374 HG22 THR 48 HG22 THR 48 -6.539 -0.192 -10.400
375 HG23 THR 48 HG23 THR 48 -6.298 -1.473 -11.568
376 H GLY 49 H GLY 49 -10.162 0.451 -8.936
377 HA2 GLY 49 HA2 GLY 49 -11.930 -0.644 -7.941
378 HA3 GLY 49 HA3 GLY 49 -12.297 -1.422 -9.488
379 H HIS 50 H HIS 50 -9.127 -2.126 -9.003
380 HA HIS 50 HA HIS 50 -9.575 -4.886 -8.388
381 HB2 HIS 50 HB2 HIS 50 -7.762 -4.120 -9.824
382 HB3 HIS 50 HB3 HIS 50 -7.095 -3.131 -8.533
383 HD1 HIS 50 HD1 HIS 50 -7.912 -6.973 -8.346
384 HD2 HIS 50 HD2 HIS 50 -4.757 -4.178 -8.351
385 HE1 HIS 50 HE1 HIS 50 -5.824 -8.252 -7.710
386 H VAL 51 H VAL 51 -9.180 -6.031 -6.403
387 HA VAL 51 HA VAL 51 -8.517 -4.425 -4.005
388 HB VAL 51 HB VAL 51 -10.224 -5.622 -2.738
389 HG11 VAL 51 HG11 VAL 51 -11.455 -4.123 -5.080
390 HG12 VAL 51 HG12 VAL 51 -12.043 -4.256 -3.410
391 HG13 VAL 51 HG13 VAL 51 -10.559 -3.375 -3.733
392 HG21 VAL 51 HG21 VAL 51 -10.617 -7.629 -4.156
393 HG22 VAL 51 HG22 VAL 51 -12.118 -6.758 -3.785
394 HG23 VAL 51 HG23 VAL 51 -11.380 -6.598 -5.377
395 H GLY 52 H GLY 52 -7.564 -5.572 -2.292
396 HA2 GLY 52 HA2 GLY 52 -7.138 -8.219 -1.931
397 HA3 GLY 52 HA3 GLY 52 -5.880 -7.785 -3.117
398 H LEU 53 H LEU 53 -4.332 -8.230 -1.311
399 HA LEU 53 HA LEU 53 -4.248 -6.216 0.884
400 HB2 LEU 53 HB2 LEU 53 -3.316 -9.013 0.452
401 HB3 LEU 53 HB3 LEU 53 -2.108 -7.964 1.146
402 HG LEU 53 HG LEU 53 -4.843 -8.466 2.330
403 HD11 LEU 53 HD11 LEU 53 -2.039 -9.318 3.194
404 HD12 LEU 53 HD12 LEU 53 -3.191 -10.362 2.380
405 HD13 LEU 53 HD13 LEU 53 -3.581 -9.703 3.991
406 HD21 LEU 53 HD21 LEU 53 -2.529 -6.765 3.313
407 HD22 LEU 53 HD22 LEU 53 -3.802 -7.388 4.384
408 HD23 LEU 53 HD23 LEU 53 -4.231 -6.310 3.079
409 H TYR 54 H TYR 54 -2.398 -4.783 0.970
410 HA TYR 54 HA TYR 54 -0.599 -4.831 -1.367
411 HB2 TYR 54 HB2 TYR 54 -0.802 -2.595 -1.753
412 HB3 TYR 54 HB3 TYR 54 -2.423 -3.129 -1.595
413 HD1 TYR 54 HD1 TYR 54 -3.844 -2.253 0.294
414 HD2 TYR 54 HD2 TYR 54 0.325 -1.179 -0.016
415 HE1 TYR 54 HE1 TYR 54 -4.222 -0.349 1.805
416 HE2 TYR 54 HE2 TYR 54 -0.053 0.613 1.645
417 HH TYR 54 HH TYR 54 -1.502 1.711 3.001
418 HA PRO 55 HA PRO 55 2.147 -4.494 2.225
419 HB2 PRO 55 HB2 PRO 55 4.558 -4.080 1.047
420 HB3 PRO 55 HB3 PRO 55 3.679 -5.633 1.006
421 HG2 PRO 55 HG2 PRO 55 3.841 -3.558 -1.173
422 HG3 PRO 55 HG3 PRO 55 3.985 -5.324 -1.313
423 HD2 PRO 55 HD2 PRO 55 1.597 -4.032 -1.828
424 HD3 PRO 55 HD3 PRO 55 1.715 -5.672 -1.114
425 H ALA 56 H ALA 56 1.814 -2.722 3.467
426 HA ALA 56 HA ALA 56 1.632 -0.037 2.616
427 HB1 ALA 56 HB1 ALA 56 2.307 -0.910 5.454
428 HB2 ALA 56 HB2 ALA 56 1.374 0.490 4.933
429 HB3 ALA 56 HB3 ALA 56 0.695 -1.128 4.777
430 H ASN 57 H ASN 57 4.330 -1.979 3.726
431 HA ASN 57 HA ASN 57 6.275 0.020 4.225
432 HB2 ASN 57 HB2 ASN 57 6.612 -2.790 3.059
433 HB3 ASN 57 HB3 ASN 57 7.933 -1.772 3.617
434 HD21 ASN 57 HD21 ASN 57 6.106 -4.353 4.546
435 HD22 ASN 57 HD22 ASN 57 6.258 -4.160 6.280
436 H TYR 58 H TYR 58 4.859 -0.889 1.164
437 HA TYR 58 HA TYR 58 7.172 0.186 -0.325
438 HB2 TYR 58 HB2 TYR 58 4.923 -1.719 -0.944
439 HB3 TYR 58 HB3 TYR 58 5.756 -0.920 -2.258
440 HD1 TYR 58 HD1 TYR 58 6.517 -3.075 0.762
441 HD2 TYR 58 HD2 TYR 58 7.584 -1.935 -3.259
442 HE1 TYR 58 HE1 TYR 58 8.288 -4.780 0.736
443 HE2 TYR 58 HE2 TYR 58 9.397 -3.544 -3.248
444 HH TYR 58 HH TYR 58 10.156 -5.706 -0.512
445 H VAL 59 H VAL 59 4.361 1.489 0.920
446 HA VAL 59 HA VAL 59 4.215 3.396 -1.349
447 HB VAL 59 HB VAL 59 1.863 3.355 -1.416
448 HG11 VAL 59 HG11 VAL 59 1.222 1.160 -2.084
449 HG12 VAL 59 HG12 VAL 59 2.943 1.246 -2.460
450 HG13 VAL 59 HG13 VAL 59 2.409 0.385 -1.018
451 HG21 VAL 59 HG21 VAL 59 1.886 1.576 1.040
452 HG22 VAL 59 HG22 VAL 59 1.323 3.254 0.975
453 HG23 VAL 59 HG23 VAL 59 0.451 2.014 0.068
454 H GLU 60 H GLU 60 2.989 5.447 -0.637
455 HA GLU 60 HA GLU 60 3.184 5.955 2.242
456 HB2 GLU 60 HB2 GLU 60 4.673 7.796 2.003
457 HB3 GLU 60 HB3 GLU 60 5.458 6.341 1.333
458 HG2 GLU 60 HG2 GLU 60 5.165 7.113 -0.911
459 HG3 GLU 60 HG3 GLU 60 4.089 8.418 -0.404
460 H LYS 61 H LYS 61 2.288 8.194 2.745
461 HA LYS 61 HA LYS 61 -0.177 8.525 1.259
462 HB2 LYS 61 HB2 LYS 61 0.280 8.750 3.760
463 HB3 LYS 61 HB3 LYS 61 1.023 10.313 3.410
464 HG2 LYS 61 HG2 LYS 61 -1.081 11.230 2.681
465 HG3 LYS 61 HG3 LYS 61 -1.848 9.620 2.636
466 HD2 LYS 61 HD2 LYS 61 -1.645 9.363 5.039
467 HD3 LYS 61 HD3 LYS 61 -0.650 10.832 5.162
468 HE2 LYS 61 HE2 LYS 61 -2.573 12.166 4.346
469 HE3 LYS 61 HE3 LYS 61 -3.582 10.700 4.353
470 HZ1 LYS 61 HZ1 LYS 61 -2.237 11.936 6.671
471 HZ2 LYS 61 HZ2 LYS 61 -3.125 10.524 6.731
472 HZ3 LYS 61 HZ3 LYS 61 -3.869 11.933 6.394
473 H VAL 62 H VAL 62 -0.852 10.576 0.226
474 HA VAL 62 HA VAL 62 1.292 12.337 -0.696
475 HB VAL 62 HB VAL 62 1.300 10.351 -2.194
476 HG11 VAL 62 HG11 VAL 62 -1.604 11.063 -2.686
477 HG12 VAL 62 HG12 VAL 62 -0.670 10.101 -3.810
478 HG13 VAL 62 HG13 VAL 62 -0.921 9.515 -2.151
479 HG21 VAL 62 HG21 VAL 62 1.349 11.463 -4.287
480 HG22 VAL 62 HG22 VAL 62 0.268 12.742 -3.740
481 HG23 VAL 62 HG23 VAL 62 1.916 12.609 -3.068
482 H GLY 63 H GLY 63 0.182 14.129 -2.103
483 HA2 GLY 63 HA2 GLY 63 -1.516 15.611 -2.520
484 HA3 GLY 63 HA3 GLY 63 -2.615 14.532 -1.654
485 H LEU 64 H LEU 64 -1.428 14.377 0.733
486 HA LEU 64 HA LEU 64 -2.299 16.921 1.941
487 HB2 LEU 64 HB2 LEU 64 -1.873 14.137 2.911
488 HB3 LEU 64 HB3 LEU 64 -1.425 15.369 4.086
489 HG LEU 64 HG LEU 64 -4.092 15.411 2.631
490 HD11 LEU 64 HD11 LEU 64 -5.026 14.530 4.783
491 HD12 LEU 64 HD12 LEU 64 -3.371 14.178 5.309
492 HD13 LEU 64 HD13 LEU 64 -4.082 13.380 3.858
493 HD21 LEU 64 HD21 LEU 64 -4.763 16.877 4.502
494 HD22 LEU 64 HD22 LEU 64 -3.462 17.592 3.579
495 HD23 LEU 64 HD23 LEU 64 -3.095 16.825 5.138
496 H ALA 65 H ALA 65 -1.044 17.960 3.732
497 HA ALA 65 HA ALA 65 1.416 18.900 2.762
498 HB1 ALA 65 HB1 ALA 65 0.298 18.983 5.605
499 HB2 ALA 65 HB2 ALA 65 1.636 19.972 4.985
500 HB3 ALA 65 HB3 ALA 65 0.014 20.178 4.314
501 H ALA 66 H ALA 66 3.558 18.609 3.404
502 HA ALA 66 HA ALA 66 4.353 15.915 3.881
503 HB1 ALA 66 HB1 ALA 66 5.980 18.489 3.901
504 HB2 ALA 66 HB2 ALA 66 6.624 16.841 3.808
505 HB3 ALA 66 HB3 ALA 66 5.628 17.478 2.485
506 H ALA 67 H ALA 67 3.955 15.034 5.839
507 HA ALA 67 HA ALA 67 4.361 16.549 8.318
508 HB1 ALA 67 HB1 ALA 67 3.723 14.487 9.452
509 HB2 ALA 67 HB2 ALA 67 2.530 14.869 8.202
510 HB3 ALA 67 HB3 ALA 67 3.739 13.579 7.939
511 H1 THR 101 H THR 101 -1.627 -13.264 11.089
512 HA THR 101 HA THR 101 -2.537 -11.663 9.696
513 HB THR 101 HB THR 101 -0.749 -10.010 10.270
514 HG1 THR 101 HG1 THR 101 -2.190 -9.250 8.899
515 HG21 THR 101 HG21 THR 101 1.094 -9.658 8.759
516 HG22 THR 101 HG22 THR 101 0.697 -11.111 7.820
517 HG23 THR 101 HG23 THR 101 1.270 -11.246 9.497
518 H LYS 102 H LYS 102 -2.214 -11.389 7.194
519 HA LYS 102 HA LYS 102 -2.331 -14.035 6.052
520 HB2 LYS 102 HB2 LYS 102 -2.454 -11.224 4.990
521 HB3 LYS 102 HB3 LYS 102 -2.610 -12.606 3.910
522 HG2 LYS 102 HG2 LYS 102 -4.445 -12.539 6.295
523 HG3 LYS 102 HG3 LYS 102 -4.728 -11.363 5.012
524 HD2 LYS 102 HD2 LYS 102 -4.719 -13.229 3.348
525 HD3 LYS 102 HD3 LYS 102 -4.695 -14.382 4.687
526 HE2 LYS 102 HE2 LYS 102 -6.835 -13.479 5.531
527 HE3 LYS 102 HE3 LYS 102 -6.771 -12.192 4.316
528 HZ1 LYS 102 HZ1 LYS 102 -8.174 -13.757 3.365
529 HZ2 LYS 102 HZ2 LYS 102 -7.291 -15.041 3.873
530 HZ3 LYS 102 HZ3 LYS 102 -6.757 -14.087 2.645
531 H GLY 103 H GLY 103 -0.213 -14.830 6.493
532 HA2 GLY 103 HA2 GLY 103 1.879 -15.457 5.896
533 HA3 GLY 103 HA3 GLY 103 1.548 -14.754 4.316
534 HA PRO 104 HA PRO 104 4.955 -12.302 6.389
535 HB2 PRO 104 HB2 PRO 104 7.145 -13.285 5.193
536 HB3 PRO 104 HB3 PRO 104 6.341 -14.188 6.507
537 HG2 PRO 104 HG2 PRO 104 6.135 -14.683 3.533
538 HG3 PRO 104 HG3 PRO 104 6.311 -15.874 4.836
539 HD2 PRO 104 HD2 PRO 104 3.871 -15.135 3.687
540 HD3 PRO 104 HD3 PRO 104 4.061 -15.857 5.304
541 H ALA 105 H ALA 105 4.386 -10.362 5.404
542 HA ALA 105 HA ALA 105 4.025 -9.897 2.651
543 HB1 ALA 105 HB1 ALA 105 3.782 -7.616 3.338
544 HB2 ALA 105 HB2 ALA 105 3.324 -8.520 4.747
545 HB3 ALA 105 HB3 ALA 105 4.938 -7.820 4.677
546 HA PRO 106 HA PRO 106 8.133 -9.451 1.093
547 HB2 PRO 106 HB2 PRO 106 8.155 -7.109 -0.450
548 HB3 PRO 106 HB3 PRO 106 7.475 -8.693 -0.891
549 HG2 PRO 106 HG2 PRO 106 6.100 -6.218 0.109
550 HG3 PRO 106 HG3 PRO 106 5.513 -7.400 -1.092
551 HD2 PRO 106 HD2 PRO 106 4.800 -7.274 1.597
552 HD3 PRO 106 HD3 PRO 106 4.566 -8.698 0.595
553 H ASN 107 H ASN 107 9.736 -9.125 2.465
554 HA ASN 107 HA ASN 107 10.430 -6.548 3.475
555 HB2 ASN 107 HB2 ASN 107 10.187 -6.832 5.792
556 HB3 ASN 107 HB3 ASN 107 8.651 -7.365 5.155
557 HD21 ASN 107 HD21 ASN 107 8.494 -9.865 4.819
558 HD22 ASN 107 HD22 ASN 107 9.345 -10.870 5.984
559 HA PRO 108 HA PRO 108 12.192 -6.025 5.407
560 HB2 PRO 108 HB2 PRO 108 14.688 -5.002 4.782
561 HB3 PRO 108 HB3 PRO 108 14.377 -6.156 6.106
562 HG2 PRO 108 HG2 PRO 108 15.361 -6.727 3.323
563 HG3 PRO 108 HG3 PRO 108 15.999 -7.354 4.868
564 HD2 PRO 108 HD2 PRO 108 14.295 -8.817 3.308
565 HD3 PRO 108 HD3 PRO 108 14.169 -8.862 5.094
566 HA PRO 109 HA PRO 109 11.033 -3.475 2.033
567 HB2 PRO 109 HB2 PRO 109 11.600 -0.883 2.850
568 HB3 PRO 109 HB3 PRO 109 10.230 -1.863 3.450
569 HG2 PRO 109 HG2 PRO 109 12.948 -1.485 4.724
570 HG3 PRO 109 HG3 PRO 109 11.330 -1.396 5.500
571 HD2 PRO 109 HD2 PRO 109 12.881 -3.629 5.635
572 HD3 PRO 109 HD3 PRO 109 11.105 -3.748 5.474
573 HA PRO 110 HA PRO 110 14.777 -2.740 -0.283
574 HB2 PRO 110 HB2 PRO 110 13.794 -1.739 -2.603
575 HB3 PRO 110 HB3 PRO 110 13.205 -3.309 -1.987
576 HG2 PRO 110 HG2 PRO 110 11.987 -0.571 -1.573
577 HG3 PRO 110 HG3 PRO 110 11.175 -2.019 -2.252
578 HD2 PRO 110 HD2 PRO 110 11.027 -1.334 0.409
579 HD3 PRO 110 HD3 PRO 110 11.031 -3.035 -0.142
580 H ILE 111 H ILE 111 15.091 -0.476 -2.071
581 HA ILE 111 HA ILE 111 16.390 1.397 -0.402
582 HB ILE 111 HB ILE 111 16.697 2.655 -2.444
583 HG12 ILE 111 HG12 ILE 111 14.383 1.071 -3.641
584 HG13 ILE 111 HG13 ILE 111 14.498 2.811 -3.356
585 HG21 ILE 111 HG21 ILE 111 17.890 0.440 -2.177
586 HG22 ILE 111 HG22 ILE 111 16.725 -0.267 -3.308
587 HG23 ILE 111 HG23 ILE 111 17.801 1.049 -3.826
588 HD11 ILE 111 HD11 ILE 111 16.340 2.928 -5.046
589 HD12 ILE 111 HD12 ILE 111 15.966 1.229 -5.443
590 HD13 ILE 111 HD13 ILE 111 14.730 2.483 -5.658
591 H LEU 112 H LEU 112 15.713 3.512 0.261
592 HA LEU 112 HA LEU 112 13.689 5.075 -0.516
593 HB2 LEU 112 HB2 LEU 112 12.400 2.883 0.832
594 HB3 LEU 112 HB3 LEU 112 12.369 4.192 1.947
595 HG LEU 112 HG LEU 112 10.382 3.943 0.423
596 HD11 LEU 112 HD11 LEU 112 10.803 6.019 1.653
597 HD12 LEU 112 HD12 LEU 112 9.993 6.315 0.117
598 HD13 LEU 112 HD13 LEU 112 11.718 6.671 0.258
599 HD21 LEU 112 HD21 LEU 112 10.334 4.767 -1.834
600 HD22 LEU 112 HD22 LEU 112 11.592 3.584 -1.781
601 HD23 LEU 112 HD23 LEU 112 12.012 5.303 -1.771
602 H LYS 113 H LYS 113 12.932 6.438 1.704
603 HA LYS 113 HA LYS 113 14.870 6.826 3.699
604 HB2 LYS 113 HB2 LYS 113 15.874 8.951 2.928
605 HB3 LYS 113 HB3 LYS 113 16.320 7.651 1.845
606 HG2 LYS 113 HG2 LYS 113 14.554 8.353 0.231
607 HG3 LYS 113 HG3 LYS 113 14.104 9.681 1.318
608 HD2 LYS 113 HD2 LYS 113 16.456 10.534 1.159
609 HD3 LYS 113 HD3 LYS 113 16.788 9.308 -0.080
610 HE2 LYS 113 HE2 LYS 113 14.612 11.462 -0.210
611 HE3 LYS 113 HE3 LYS 113 16.162 11.558 -1.024
612 HZ1 LYS 113 HZ1 LYS 113 15.561 9.621 -2.343
613 HZ2 LYS 113 HZ2 LYS 113 14.374 10.769 -2.457
614 HZ3 LYS 113 HZ3 LYS 113 14.141 9.451 -1.531
615 H VAL 114 H VAL 114 14.381 9.597 4.165
616 HA VAL 114 HA VAL 114 11.462 9.934 3.984
617 HB VAL 114 HB VAL 114 11.856 8.949 6.141
618 HG11 VAL 114 HG11 VAL 114 13.251 9.942 7.889
619 HG12 VAL 114 HG12 VAL 114 14.235 9.393 6.535
620 HG13 VAL 114 HG13 VAL 114 13.895 11.125 6.733
621 HG21 VAL 114 HG21 VAL 114 10.921 10.660 7.593
622 HG22 VAL 114 HG22 VAL 114 11.455 11.942 6.476
623 HG23 VAL 114 HG23 VAL 114 10.203 10.777 5.982
624 H TRP 115 H TRP 115 10.968 11.985 3.380
625 HA TRP 115 HA TRP 115 11.215 13.999 2.440
626 HB2 TRP 115 HB2 TRP 115 12.919 14.299 4.921
627 HB3 TRP 115 HB3 TRP 115 12.656 15.600 3.797
628 HD1 TRP 115 HD1 TRP 115 9.819 13.271 5.070
629 HE1 TRP 115 HE1 TRP 115 8.039 14.766 6.230
630 HE3 TRP 115 HE3 TRP 115 12.224 17.761 4.727
631 HZ2 TRP 115 HZ2 TRP 115 7.669 17.571 6.719
632 HZ3 TRP 115 HZ3 TRP 115 11.076 19.853 5.389
633 HH2 TRP 115 HH2 TRP 115 8.777 19.774 6.322
Start of MODEL 9
1 H1 MET 1 H MET 1 -19.085 2.768 11.987
2 HA MET 1 HA MET 1 -17.260 1.991 10.564
3 HB2 MET 1 HB2 MET 1 -19.428 2.123 8.414
4 HB3 MET 1 HB3 MET 1 -17.693 2.006 8.098
5 HG2 MET 1 HG2 MET 1 -17.657 -0.157 9.339
6 HG3 MET 1 HG3 MET 1 -19.406 -0.049 9.529
7 HE1 MET 1 HE1 MET 1 -16.368 -0.433 7.139
8 HE2 MET 1 HE2 MET 1 -17.106 -0.754 5.555
9 HE3 MET 1 HE3 MET 1 -17.197 0.861 6.258
10 H LYS 2 H LYS 2 -16.028 3.885 10.708
11 HA LYS 2 HA LYS 2 -16.999 6.294 9.258
12 HB2 LYS 2 HB2 LYS 2 -16.210 6.189 12.208
13 HB3 LYS 2 HB3 LYS 2 -16.364 7.674 11.246
14 HG2 LYS 2 HG2 LYS 2 -18.722 7.207 10.801
15 HG3 LYS 2 HG3 LYS 2 -18.638 5.715 11.764
16 HD2 LYS 2 HD2 LYS 2 -18.171 6.914 13.782
17 HD3 LYS 2 HD3 LYS 2 -17.969 8.448 12.898
18 HE2 LYS 2 HE2 LYS 2 -20.291 8.467 12.216
19 HE3 LYS 2 HE3 LYS 2 -20.548 6.826 12.830
20 HZ1 LYS 2 HZ1 LYS 2 -21.415 8.415 14.344
21 HZ2 LYS 2 HZ2 LYS 2 -19.927 9.178 14.492
22 HZ3 LYS 2 HZ3 LYS 2 -20.156 7.631 15.036
23 H VAL 3 H VAL 3 -15.148 4.692 8.113
24 HA VAL 3 HA VAL 3 -12.662 6.197 8.655
25 HB VAL 3 HB VAL 3 -12.488 4.184 9.851
26 HG11 VAL 3 HG11 VAL 3 -12.316 1.970 8.823
27 HG12 VAL 3 HG12 VAL 3 -13.944 2.638 8.686
28 HG13 VAL 3 HG13 VAL 3 -12.872 2.626 7.274
29 HG21 VAL 3 HG21 VAL 3 -10.515 5.196 9.002
30 HG22 VAL 3 HG22 VAL 3 -10.333 3.434 8.919
31 HG23 VAL 3 HG23 VAL 3 -10.672 4.373 7.449
32 HA PRO 4 HA PRO 4 -13.487 6.706 4.211
33 HB2 PRO 4 HB2 PRO 4 -11.967 8.922 3.811
34 HB3 PRO 4 HB3 PRO 4 -13.533 9.000 4.676
35 HG2 PRO 4 HG2 PRO 4 -10.738 8.919 5.838
36 HG3 PRO 4 HG3 PRO 4 -12.119 9.967 6.302
37 HD2 PRO 4 HD2 PRO 4 -11.436 7.626 7.599
38 HD3 PRO 4 HD3 PRO 4 -13.106 8.282 7.553
39 H GLY 5 H GLY 5 -12.131 6.192 2.282
40 HA2 GLY 5 HA2 GLY 5 -9.787 4.662 2.929
41 HA3 GLY 5 HA3 GLY 5 -10.454 5.035 1.314
42 H VAL 6 H VAL 6 -7.637 5.364 2.604
43 HA VAL 6 HA VAL 6 -7.296 8.299 2.213
44 HB VAL 6 HB VAL 6 -5.030 7.858 3.164
45 HG11 VAL 6 HG11 VAL 6 -6.007 7.901 5.529
46 HG12 VAL 6 HG12 VAL 6 -6.755 9.040 4.401
47 HG13 VAL 6 HG13 VAL 6 -7.580 7.529 4.815
48 HG21 VAL 6 HG21 VAL 6 -6.273 5.268 4.175
49 HG22 VAL 6 HG22 VAL 6 -4.890 5.436 3.051
50 HG23 VAL 6 HG23 VAL 6 -4.750 5.992 4.711
51 H ARG 7 H ARG 7 -6.581 8.993 0.344
52 HA ARG 7 HA ARG 7 -5.805 7.150 -1.736
53 HB2 ARG 7 HB2 ARG 7 -5.708 9.040 -3.146
54 HB3 ARG 7 HB3 ARG 7 -7.070 9.269 -2.095
55 HG2 ARG 7 HG2 ARG 7 -4.418 10.749 -1.972
56 HG3 ARG 7 HG3 ARG 7 -5.986 11.359 -2.487
57 HD2 ARG 7 HD2 ARG 7 -6.835 10.888 -0.128
58 HD3 ARG 7 HD3 ARG 7 -5.140 10.625 0.328
59 HE ARG 7 HE ARG 7 -5.666 13.144 -1.054
60 HH11 ARG 7 HH11 ARG 7 -5.124 11.560 2.067
61 HH12 ARG 7 HH12 ARG 7 -5.161 12.994 3.008
62 HH21 ARG 7 HH21 ARG 7 -5.790 15.114 0.221
63 HH22 ARG 7 HH22 ARG 7 -5.437 15.077 1.910
64 H VAL 8 H VAL 8 -3.805 6.402 -2.187
65 HA VAL 8 HA VAL 8 -1.454 7.922 -1.276
66 HB VAL 8 HB VAL 8 -0.332 6.066 -0.289
67 HG11 VAL 8 HG11 VAL 8 -1.743 7.263 1.226
68 HG12 VAL 8 HG12 VAL 8 -3.123 6.233 0.883
69 HG13 VAL 8 HG13 VAL 8 -1.709 5.552 1.692
70 HG21 VAL 8 HG21 VAL 8 -1.419 3.841 0.056
71 HG22 VAL 8 HG22 VAL 8 -2.624 4.363 -1.164
72 HG23 VAL 8 HG23 VAL 8 -0.915 4.223 -1.593
73 H ARG 9 H ARG 9 0.542 7.074 -2.434
74 HA ARG 9 HA ARG 9 -0.140 5.881 -5.094
75 HB2 ARG 9 HB2 ARG 9 0.036 8.473 -4.931
76 HB3 ARG 9 HB3 ARG 9 1.773 8.219 -4.782
77 HG2 ARG 9 HG2 ARG 9 1.855 7.217 -7.003
78 HG3 ARG 9 HG3 ARG 9 0.088 7.040 -7.046
79 HD2 ARG 9 HD2 ARG 9 -0.033 9.617 -6.871
80 HD3 ARG 9 HD3 ARG 9 1.703 9.612 -7.229
81 HE ARG 9 HE ARG 9 -0.104 8.106 -9.035
82 HH11 ARG 9 HH11 ARG 9 1.492 11.247 -8.682
83 HH12 ARG 9 HH12 ARG 9 1.774 11.430 -10.386
84 HH21 ARG 9 HH21 ARG 9 0.105 8.427 -11.274
85 HH22 ARG 9 HH22 ARG 9 1.243 9.617 -11.813
86 H ALA 10 H ALA 10 1.482 4.644 -5.936
87 HA ALA 10 HA ALA 10 3.346 3.581 -3.925
88 HB1 ALA 10 HB1 ALA 10 2.858 2.538 -6.730
89 HB2 ALA 10 HB2 ALA 10 3.696 1.757 -5.397
90 HB3 ALA 10 HB3 ALA 10 1.941 2.034 -5.289
91 H LEU 11 H LEU 11 5.439 3.886 -3.844
92 HA LEU 11 HA LEU 11 6.615 5.716 -5.863
93 HB2 LEU 11 HB2 LEU 11 7.490 4.895 -3.087
94 HB3 LEU 11 HB3 LEU 11 8.559 5.693 -4.221
95 HG LEU 11 HG LEU 11 6.499 7.400 -4.467
96 HD11 LEU 11 HD11 LEU 11 5.480 7.812 -2.252
97 HD12 LEU 11 HD12 LEU 11 6.251 6.327 -1.630
98 HD13 LEU 11 HD13 LEU 11 5.010 6.245 -2.905
99 HD21 LEU 11 HD21 LEU 11 7.609 8.830 -2.755
100 HD22 LEU 11 HD22 LEU 11 8.737 8.097 -3.905
101 HD23 LEU 11 HD23 LEU 11 8.597 7.439 -2.264
102 H TYR 12 H TYR 12 6.249 2.429 -5.634
103 HA TYR 12 HA TYR 12 8.528 1.896 -7.398
104 HB2 TYR 12 HB2 TYR 12 7.901 -0.024 -5.117
105 HB3 TYR 12 HB3 TYR 12 9.314 0.025 -6.148
106 HD1 TYR 12 HD1 TYR 12 7.716 1.479 -3.091
107 HD2 TYR 12 HD2 TYR 12 11.126 1.823 -5.768
108 HE1 TYR 12 HE1 TYR 12 8.629 3.234 -1.743
109 HE2 TYR 12 HE2 TYR 12 11.893 3.692 -4.514
110 HH TYR 12 HH TYR 12 11.341 5.250 -2.788
111 H ASP 13 H ASP 13 8.079 -0.383 -8.405
112 HA ASP 13 HA ASP 13 5.123 -0.732 -8.768
113 HB2 ASP 13 HB2 ASP 13 5.697 -1.807 -10.968
114 HB3 ASP 13 HB3 ASP 13 5.806 -0.060 -10.835
115 H TYR 14 H TYR 14 4.587 -2.211 -7.314
116 HA TYR 14 HA TYR 14 5.857 -4.892 -7.484
117 HB2 TYR 14 HB2 TYR 14 5.736 -3.077 -5.105
118 HB3 TYR 14 HB3 TYR 14 5.213 -4.715 -4.809
119 HD1 TYR 14 HD1 TYR 14 6.861 -6.345 -4.113
120 HD2 TYR 14 HD2 TYR 14 8.077 -2.881 -6.448
121 HE1 TYR 14 HE1 TYR 14 9.126 -7.228 -4.274
122 HE2 TYR 14 HE2 TYR 14 10.361 -3.741 -6.527
123 HH TYR 14 HH TYR 14 11.797 -5.433 -5.806
124 H THR 15 H THR 15 4.412 -6.621 -7.317
125 HA THR 15 HA THR 15 1.525 -5.858 -7.081
126 HB THR 15 HB THR 15 2.939 -7.998 -8.711
127 HG1 THR 15 HG1 THR 15 2.581 -5.802 -9.578
128 HG21 THR 15 HG21 THR 15 0.500 -8.578 -9.427
129 HG22 THR 15 HG22 THR 15 0.031 -7.772 -7.913
130 HG23 THR 15 HG23 THR 15 1.076 -9.176 -7.875
131 H GLY 16 H GLY 16 1.639 -6.042 -4.812
132 HA2 GLY 16 HA2 GLY 16 1.699 -7.189 -2.791
133 HA3 GLY 16 HA3 GLY 16 0.973 -8.400 -3.828
134 H GLN 17 H GLN 17 1.877 -9.998 -2.449
135 HA GLN 17 HA GLN 17 4.542 -10.733 -3.188
136 HB2 GLN 17 HB2 GLN 17 4.955 -9.532 -1.057
137 HB3 GLN 17 HB3 GLN 17 3.845 -10.613 -0.213
138 HG2 GLN 17 HG2 GLN 17 6.158 -11.149 0.286
139 HG3 GLN 17 HG3 GLN 17 5.399 -12.490 -0.557
140 HE21 GLN 17 HE21 GLN 17 5.862 -12.654 -2.947
141 HE22 GLN 17 HE22 GLN 17 7.370 -12.060 -3.584
142 H GLU 18 H GLU 18 1.328 -11.565 -2.411
143 HA GLU 18 HA GLU 18 1.809 -14.476 -2.655
144 HB2 GLU 18 HB2 GLU 18 0.698 -13.103 -0.479
145 HB3 GLU 18 HB3 GLU 18 -0.702 -13.357 -1.455
146 HG2 GLU 18 HG2 GLU 18 -0.866 -15.320 -0.406
147 HG3 GLU 18 HG3 GLU 18 0.294 -15.890 -1.583
148 H ALA 19 H ALA 19 -0.820 -15.229 -3.193
149 HA ALA 19 HA ALA 19 -1.314 -14.157 -5.876
150 HB1 ALA 19 HB1 ALA 19 -2.683 -16.163 -6.138
151 HB2 ALA 19 HB2 ALA 19 -1.069 -16.596 -5.537
152 HB3 ALA 19 HB3 ALA 19 -2.462 -16.577 -4.425
153 H ASP 20 H ASP 20 -2.433 -13.320 -2.833
154 HA ASP 20 HA ASP 20 -5.203 -12.671 -3.739
155 HB2 ASP 20 HB2 ASP 20 -4.429 -13.056 -0.846
156 HB3 ASP 20 HB3 ASP 20 -6.033 -13.067 -1.559
157 H GLU 21 H GLU 21 -2.953 -10.962 -4.091
158 HA GLU 21 HA GLU 21 -3.423 -8.728 -2.195
159 HB2 GLU 21 HB2 GLU 21 -1.007 -8.164 -3.059
160 HB3 GLU 21 HB3 GLU 21 -1.283 -9.316 -1.770
161 HG2 GLU 21 HG2 GLU 21 0.348 -10.226 -3.385
162 HG3 GLU 21 HG3 GLU 21 -1.051 -11.206 -3.253
163 H LEU 22 H LEU 22 -2.599 -6.622 -3.247
164 HA LEU 22 HA LEU 22 -4.299 -6.065 -5.627
165 HB2 LEU 22 HB2 LEU 22 -3.050 -4.398 -3.384
166 HB3 LEU 22 HB3 LEU 22 -3.493 -3.660 -4.915
167 HG LEU 22 HG LEU 22 -5.404 -5.015 -3.044
168 HD11 LEU 22 HD11 LEU 22 -4.623 -2.825 -2.240
169 HD12 LEU 22 HD12 LEU 22 -6.324 -2.776 -2.728
170 HD13 LEU 22 HD13 LEU 22 -5.095 -2.087 -3.787
171 HD21 LEU 22 HD21 LEU 22 -6.296 -5.378 -5.183
172 HD22 LEU 22 HD22 LEU 22 -5.741 -3.819 -5.793
173 HD23 LEU 22 HD23 LEU 22 -7.097 -3.906 -4.637
174 H SER 23 H SER 23 -3.353 -4.892 -7.379
175 HA SER 23 HA SER 23 -0.379 -5.144 -7.467
176 HB2 SER 23 HB2 SER 23 -0.851 -5.253 -9.947
177 HB3 SER 23 HB3 SER 23 -1.389 -6.634 -8.997
178 HG SER 23 HG SER 23 -3.061 -6.278 -10.259
179 H PHE 24 H PHE 24 0.772 -3.221 -7.571
180 HA PHE 24 HA PHE 24 -0.700 -0.901 -8.736
181 HB2 PHE 24 HB2 PHE 24 0.256 0.597 -7.149
182 HB3 PHE 24 HB3 PHE 24 -0.845 -0.562 -6.426
183 HD1 PHE 24 HD1 PHE 24 2.825 -0.181 -7.144
184 HD2 PHE 24 HD2 PHE 24 -0.212 -1.352 -4.334
185 HE1 PHE 24 HE1 PHE 24 4.588 -0.711 -5.444
186 HE2 PHE 24 HE2 PHE 24 1.518 -1.680 -2.598
187 HZ PHE 24 HZ PHE 24 3.913 -1.417 -3.177
188 H LYS 25 H LYS 25 0.820 0.736 -9.500
189 HA LYS 25 HA LYS 25 3.437 -0.267 -10.424
190 HB2 LYS 25 HB2 LYS 25 1.067 0.061 -12.093
191 HB3 LYS 25 HB3 LYS 25 2.139 1.408 -12.440
192 HG2 LYS 25 HG2 LYS 25 2.791 -0.246 -13.947
193 HG3 LYS 25 HG3 LYS 25 4.005 -0.326 -12.677
194 HD2 LYS 25 HD2 LYS 25 3.558 -2.503 -12.487
195 HD3 LYS 25 HD3 LYS 25 1.996 -2.135 -11.798
196 HE2 LYS 25 HE2 LYS 25 2.395 -2.208 -14.815
197 HE3 LYS 25 HE3 LYS 25 2.143 -3.683 -13.900
198 HZ1 LYS 25 HZ1 LYS 25 0.218 -1.465 -14.122
199 HZ2 LYS 25 HZ2 LYS 25 0.050 -2.777 -13.089
200 HZ3 LYS 25 HZ3 LYS 25 0.114 -2.980 -14.708
201 H ALA 26 H ALA 26 4.694 1.654 -11.318
202 HA ALA 26 HA ALA 26 4.743 3.764 -9.402
203 HB1 ALA 26 HB1 ALA 26 6.691 3.114 -10.802
204 HB2 ALA 26 HB2 ALA 26 5.828 3.649 -12.267
205 HB3 ALA 26 HB3 ALA 26 6.296 4.833 -11.028
206 H GLY 27 H GLY 27 3.207 5.347 -9.198
207 HA2 GLY 27 HA2 GLY 27 2.060 7.202 -9.993
208 HA3 GLY 27 HA3 GLY 27 1.890 6.504 -11.597
209 H GLU 28 H GLU 28 0.988 3.838 -10.146
210 HA GLU 28 HA GLU 28 -1.843 4.286 -10.351
211 HB2 GLU 28 HB2 GLU 28 -0.183 2.027 -9.111
212 HB3 GLU 28 HB3 GLU 28 -1.925 1.979 -9.174
213 HG2 GLU 28 HG2 GLU 28 -0.271 2.292 -11.710
214 HG3 GLU 28 HG3 GLU 28 -0.676 0.734 -10.969
215 H GLU 29 H GLU 29 -3.249 4.990 -8.861
216 HA GLU 29 HA GLU 29 -2.321 5.455 -6.100
217 HB2 GLU 29 HB2 GLU 29 -4.779 6.411 -7.636
218 HB3 GLU 29 HB3 GLU 29 -4.485 6.732 -5.920
219 HG2 GLU 29 HG2 GLU 29 -2.322 7.812 -6.486
220 HG3 GLU 29 HG3 GLU 29 -2.644 7.598 -8.203
221 H LEU 30 H LEU 30 -3.792 4.837 -4.322
222 HA LEU 30 HA LEU 30 -5.682 2.651 -4.800
223 HB2 LEU 30 HB2 LEU 30 -4.462 1.297 -2.956
224 HB3 LEU 30 HB3 LEU 30 -3.845 1.184 -4.637
225 HG LEU 30 HG LEU 30 -2.553 3.288 -3.011
226 HD11 LEU 30 HD11 LEU 30 -2.886 1.654 -1.225
227 HD12 LEU 30 HD12 LEU 30 -1.181 1.674 -1.710
228 HD13 LEU 30 HD13 LEU 30 -2.234 0.361 -2.251
229 HD21 LEU 30 HD21 LEU 30 -1.350 0.990 -4.575
230 HD22 LEU 30 HD22 LEU 30 -0.519 2.442 -3.990
231 HD23 LEU 30 HD23 LEU 30 -1.740 2.577 -5.259
232 H MET 31 H MET 31 -6.934 2.194 -2.894
233 HA MET 31 HA MET 31 -6.733 4.327 -0.793
234 HB2 MET 31 HB2 MET 31 -9.438 3.158 -1.546
235 HB3 MET 31 HB3 MET 31 -8.985 4.489 -0.510
236 HG2 MET 31 HG2 MET 31 -7.959 5.573 -2.611
237 HG3 MET 31 HG3 MET 31 -8.957 4.430 -3.514
238 HE1 MET 31 HE1 MET 31 -8.786 7.910 -2.078
239 HE2 MET 31 HE2 MET 31 -10.178 8.055 -0.985
240 HE3 MET 31 HE3 MET 31 -8.858 6.930 -0.604
241 H LYS 32 H LYS 32 -6.026 3.409 0.933
242 HA LYS 32 HA LYS 32 -6.165 0.662 1.647
243 HB2 LYS 32 HB2 LYS 32 -4.509 1.953 2.583
244 HB3 LYS 32 HB3 LYS 32 -5.545 3.348 2.839
245 HG2 LYS 32 HG2 LYS 32 -6.715 2.297 4.712
246 HG3 LYS 32 HG3 LYS 32 -5.661 0.912 4.618
247 HD2 LYS 32 HD2 LYS 32 -3.831 1.924 5.493
248 HD3 LYS 32 HD3 LYS 32 -4.155 3.473 4.708
249 HE2 LYS 32 HE2 LYS 32 -5.991 3.890 6.353
250 HE3 LYS 32 HE3 LYS 32 -5.575 2.370 7.154
251 HZ1 LYS 32 HZ1 LYS 32 -4.447 4.089 8.292
252 HZ2 LYS 32 HZ2 LYS 32 -3.907 4.812 6.923
253 HZ3 LYS 32 HZ3 LYS 32 -3.270 3.379 7.396
254 H ILE 33 H ILE 33 -7.687 -0.427 3.005
255 HA ILE 33 HA ILE 33 -9.925 1.277 3.876
256 HB ILE 33 HB ILE 33 -11.547 -0.058 3.216
257 HG12 ILE 33 HG12 ILE 33 -9.602 -2.119 2.103
258 HG13 ILE 33 HG13 ILE 33 -10.580 -2.303 3.551
259 HG21 ILE 33 HG21 ILE 33 -11.584 0.200 0.831
260 HG22 ILE 33 HG22 ILE 33 -10.602 1.501 1.489
261 HG23 ILE 33 HG23 ILE 33 -9.819 0.104 0.736
262 HD11 ILE 33 HD11 ILE 33 -11.603 -3.532 1.774
263 HD12 ILE 33 HD12 ILE 33 -12.641 -2.129 2.108
264 HD13 ILE 33 HD13 ILE 33 -11.569 -2.147 0.682
265 H SER 34 H SER 34 -7.576 -0.772 4.997
266 HA SER 34 HA SER 34 -9.055 -1.150 7.539
267 HB2 SER 34 HB2 SER 34 -7.119 -3.124 6.250
268 HB3 SER 34 HB3 SER 34 -7.924 -3.295 7.808
269 HG SER 34 HG SER 34 -8.857 -4.532 6.333
270 H GLU 35 H GLU 35 -7.086 -1.878 9.192
271 HA GLU 35 HA GLU 35 -5.150 0.348 9.052
272 HB2 GLU 35 HB2 GLU 35 -4.608 -0.232 11.312
273 HB3 GLU 35 HB3 GLU 35 -6.356 -0.181 11.140
274 HG2 GLU 35 HG2 GLU 35 -5.627 -2.893 10.578
275 HG3 GLU 35 HG3 GLU 35 -4.626 -2.412 11.950
276 H GLU 36 H GLU 36 -2.808 -0.232 9.736
277 HA GLU 36 HA GLU 36 -1.717 -2.094 7.847
278 HB2 GLU 36 HB2 GLU 36 -0.918 0.167 8.332
279 HB3 GLU 36 HB3 GLU 36 -0.548 -0.317 10.000
280 HG2 GLU 36 HG2 GLU 36 1.222 -1.749 9.287
281 HG3 GLU 36 HG3 GLU 36 0.711 -1.651 7.592
282 H ASP 37 H ASP 37 -1.048 -4.068 8.290
283 HA ASP 37 HA ASP 37 -1.514 -5.321 10.901
284 HB2 ASP 37 HB2 ASP 37 -1.909 -6.157 8.346
285 HB3 ASP 37 HB3 ASP 37 -0.290 -6.805 8.621
286 H GLU 38 H GLU 38 0.220 -6.951 11.607
287 HA GLU 38 HA GLU 38 2.516 -5.709 12.507
288 HB2 GLU 38 HB2 GLU 38 1.316 -7.932 13.135
289 HB3 GLU 38 HB3 GLU 38 2.327 -8.682 11.918
290 HG2 GLU 38 HG2 GLU 38 3.694 -9.035 13.705
291 HG3 GLU 38 HG3 GLU 38 4.298 -7.435 13.312
292 H GLN 39 H GLN 39 2.135 -7.417 9.445
293 HA GLN 39 HA GLN 39 5.039 -7.356 8.853
294 HB2 GLN 39 HB2 GLN 39 2.601 -8.755 7.849
295 HB3 GLN 39 HB3 GLN 39 3.717 -8.292 6.598
296 HG2 GLN 39 HG2 GLN 39 4.442 -10.093 8.950
297 HG3 GLN 39 HG3 GLN 39 4.084 -10.553 7.319
298 HE21 GLN 39 HE21 GLN 39 6.631 -8.945 9.358
299 HE22 GLN 39 HE22 GLN 39 7.771 -8.973 8.002
300 H GLY 40 H GLY 40 2.943 -4.890 8.945
301 HA2 GLY 40 HA2 GLY 40 2.907 -2.862 7.906
302 HA3 GLY 40 HA3 GLY 40 4.294 -3.361 6.917
303 H TRP 41 H TRP 41 1.301 -5.206 7.169
304 HA TRP 41 HA TRP 41 0.899 -5.092 4.238
305 HB2 TRP 41 HB2 TRP 41 0.089 -6.871 6.517
306 HB3 TRP 41 HB3 TRP 41 -1.124 -6.640 5.289
307 HD1 TRP 41 HD1 TRP 41 1.114 -9.082 6.147
308 HE1 TRP 41 HE1 TRP 41 1.974 -10.484 4.183
309 HE3 TRP 41 HE3 TRP 41 -0.074 -5.901 2.343
310 HZ2 TRP 41 HZ2 TRP 41 2.265 -10.166 1.332
311 HZ3 TRP 41 HZ3 TRP 41 0.454 -6.528 -0.021
312 HH2 TRP 41 HH2 TRP 41 1.543 -8.592 -0.539
313 H CYS 42 H CYS 42 -0.945 -4.137 3.330
314 HA CYS 42 HA CYS 42 -2.899 -2.954 5.194
315 HB2 CYS 42 HB2 CYS 42 -1.011 -1.662 3.292
316 HB3 CYS 42 HB3 CYS 42 -2.677 -1.163 3.148
317 HG CYS 42 HG CYS 42 -1.178 0.488 4.648
318 H LYS 43 H LYS 43 -4.921 -3.490 4.607
319 HA LYS 43 HA LYS 43 -5.446 -4.881 2.056
320 HB2 LYS 43 HB2 LYS 43 -6.033 -5.596 4.645
321 HB3 LYS 43 HB3 LYS 43 -7.530 -4.780 4.220
322 HG2 LYS 43 HG2 LYS 43 -6.223 -6.941 2.521
323 HG3 LYS 43 HG3 LYS 43 -7.400 -7.293 3.788
324 HD2 LYS 43 HD2 LYS 43 -9.134 -6.079 2.604
325 HD3 LYS 43 HD3 LYS 43 -7.969 -5.444 1.438
326 HE2 LYS 43 HE2 LYS 43 -9.062 -7.233 0.347
327 HE3 LYS 43 HE3 LYS 43 -7.411 -7.766 0.721
328 HZ1 LYS 43 HZ1 LYS 43 -9.664 -8.443 2.500
329 HZ2 LYS 43 HZ2 LYS 43 -8.240 -9.257 2.300
330 HZ3 LYS 43 HZ3 LYS 43 -9.367 -9.286 1.120
331 H GLY 44 H GLY 44 -6.007 -3.481 0.479
332 HA2 GLY 44 HA2 GLY 44 -7.916 -1.261 1.105
333 HA3 GLY 44 HA3 GLY 44 -6.485 -1.006 0.152
334 H ARG 45 H ARG 45 -8.241 -0.165 -1.249
335 HA ARG 45 HA ARG 45 -9.183 -2.213 -3.147
336 HB2 ARG 45 HB2 ARG 45 -10.967 -1.072 -1.577
337 HB3 ARG 45 HB3 ARG 45 -10.718 0.321 -2.633
338 HG2 ARG 45 HG2 ARG 45 -11.081 -1.895 -4.384
339 HG3 ARG 45 HG3 ARG 45 -12.223 -2.178 -3.079
340 HD2 ARG 45 HD2 ARG 45 -11.990 0.263 -4.873
341 HD3 ARG 45 HD3 ARG 45 -13.270 -0.964 -4.900
342 HE ARG 45 HE ARG 45 -13.641 -0.150 -2.445
343 HH11 ARG 45 HH11 ARG 45 -13.112 1.842 -5.364
344 HH12 ARG 45 HH12 ARG 45 -13.924 3.224 -4.751
345 HH21 ARG 45 HH21 ARG 45 -14.704 1.709 -1.597
346 HH22 ARG 45 HH22 ARG 45 -14.938 3.101 -2.613
347 H LEU 46 H LEU 46 -8.424 -1.841 -5.139
348 HA LEU 46 HA LEU 46 -6.733 0.434 -5.726
349 HB2 LEU 46 HB2 LEU 46 -6.971 -2.198 -6.657
350 HB3 LEU 46 HB3 LEU 46 -7.707 -1.285 -7.955
351 HG LEU 46 HG LEU 46 -5.584 0.188 -7.906
352 HD11 LEU 46 HD11 LEU 46 -4.405 -2.146 -6.399
353 HD12 LEU 46 HD12 LEU 46 -4.856 -0.611 -5.623
354 HD13 LEU 46 HD13 LEU 46 -3.607 -0.639 -6.893
355 HD21 LEU 46 HD21 LEU 46 -4.260 -1.423 -9.212
356 HD22 LEU 46 HD22 LEU 46 -5.942 -1.520 -9.666
357 HD23 LEU 46 HD23 LEU 46 -5.263 -2.762 -8.600
358 H LEU 47 H LEU 47 -7.131 1.791 -7.772
359 HA LEU 47 HA LEU 47 -9.617 3.157 -7.521
360 HB2 LEU 47 HB2 LEU 47 -7.254 3.255 -9.334
361 HB3 LEU 47 HB3 LEU 47 -8.723 3.959 -9.961
362 HG LEU 47 HG LEU 47 -7.076 5.493 -8.755
363 HD11 LEU 47 HD11 LEU 47 -8.878 6.894 -7.845
364 HD12 LEU 47 HD12 LEU 47 -9.979 5.496 -7.853
365 HD13 LEU 47 HD13 LEU 47 -9.372 6.153 -9.373
366 HD21 LEU 47 HD21 LEU 47 -6.704 4.032 -6.772
367 HD22 LEU 47 HD22 LEU 47 -8.327 4.433 -6.198
368 HD23 LEU 47 HD23 LEU 47 -7.103 5.707 -6.387
369 H THR 48 H THR 48 -8.609 0.650 -9.847
370 HA THR 48 HA THR 48 -10.979 0.755 -11.424
371 HB THR 48 HB THR 48 -8.807 -0.123 -12.190
372 HG1 THR 48 HG1 THR 48 -10.438 -0.890 -13.313
373 HG21 THR 48 HG21 THR 48 -8.018 -2.363 -11.511
374 HG22 THR 48 HG22 THR 48 -9.262 -2.384 -10.232
375 HG23 THR 48 HG23 THR 48 -7.978 -1.189 -10.191
376 H GLY 49 H GLY 49 -10.715 -0.286 -8.201
377 HA2 GLY 49 HA2 GLY 49 -12.604 -1.009 -6.980
378 HA3 GLY 49 HA3 GLY 49 -13.259 -1.799 -8.403
379 H HIS 50 H HIS 50 -10.138 -2.726 -8.559
380 HA HIS 50 HA HIS 50 -10.531 -5.378 -7.667
381 HB2 HIS 50 HB2 HIS 50 -8.772 -4.274 -9.285
382 HB3 HIS 50 HB3 HIS 50 -7.810 -4.049 -7.831
383 HD1 HIS 50 HD1 HIS 50 -8.028 -6.282 -10.600
384 HD2 HIS 50 HD2 HIS 50 -7.496 -6.633 -6.435
385 HE1 HIS 50 HE1 HIS 50 -6.825 -8.505 -10.197
386 H VAL 51 H VAL 51 -9.886 -6.418 -5.620
387 HA VAL 51 HA VAL 51 -9.191 -4.528 -3.422
388 HB VAL 51 HB VAL 51 -11.573 -5.118 -3.511
389 HG11 VAL 51 HG11 VAL 51 -10.724 -8.016 -3.073
390 HG12 VAL 51 HG12 VAL 51 -12.377 -7.371 -3.058
391 HG13 VAL 51 HG13 VAL 51 -11.455 -7.366 -4.558
392 HG21 VAL 51 HG21 VAL 51 -10.491 -4.683 -1.327
393 HG22 VAL 51 HG22 VAL 51 -11.877 -5.770 -1.220
394 HG23 VAL 51 HG23 VAL 51 -10.237 -6.433 -1.130
395 H GLY 52 H GLY 52 -7.797 -5.423 -1.703
396 HA2 GLY 52 HA2 GLY 52 -6.966 -7.992 -1.371
397 HA3 GLY 52 HA3 GLY 52 -5.971 -7.424 -2.719
398 H LEU 53 H LEU 53 -4.396 -8.001 -0.954
399 HA LEU 53 HA LEU 53 -3.856 -5.919 1.067
400 HB2 LEU 53 HB2 LEU 53 -2.747 -8.652 0.320
401 HB3 LEU 53 HB3 LEU 53 -1.865 -7.597 1.389
402 HG LEU 53 HG LEU 53 -4.703 -8.405 2.017
403 HD11 LEU 53 HD11 LEU 53 -3.686 -10.106 3.508
404 HD12 LEU 53 HD12 LEU 53 -2.070 -9.688 2.906
405 HD13 LEU 53 HD13 LEU 53 -3.272 -10.398 1.814
406 HD21 LEU 53 HD21 LEU 53 -2.427 -7.295 3.702
407 HD22 LEU 53 HD22 LEU 53 -4.033 -7.772 4.314
408 HD23 LEU 53 HD23 LEU 53 -3.873 -6.407 3.211
409 H TYR 54 H TYR 54 -1.971 -4.524 0.924
410 HA TYR 54 HA TYR 54 -0.234 -4.758 -1.434
411 HB2 TYR 54 HB2 TYR 54 -0.362 -2.487 -1.977
412 HB3 TYR 54 HB3 TYR 54 -2.003 -3.029 -1.928
413 HD1 TYR 54 HD1 TYR 54 -3.598 -1.996 -0.309
414 HD2 TYR 54 HD2 TYR 54 0.611 -1.043 -0.194
415 HE1 TYR 54 HE1 TYR 54 -4.059 -0.086 1.228
416 HE2 TYR 54 HE2 TYR 54 0.126 0.761 1.435
417 HH TYR 54 HH TYR 54 -1.355 1.817 2.725
418 HA PRO 55 HA PRO 55 2.618 -4.208 1.921
419 HB2 PRO 55 HB2 PRO 55 4.946 -3.623 0.676
420 HB3 PRO 55 HB3 PRO 55 4.139 -5.207 0.549
421 HG2 PRO 55 HG2 PRO 55 4.011 -2.928 -1.433
422 HG3 PRO 55 HG3 PRO 55 4.374 -4.630 -1.774
423 HD2 PRO 55 HD2 PRO 55 1.824 -3.718 -2.117
424 HD3 PRO 55 HD3 PRO 55 2.137 -5.306 -1.379
425 H ALA 56 H ALA 56 2.096 -2.487 3.209
426 HA ALA 56 HA ALA 56 1.723 0.160 2.434
427 HB1 ALA 56 HB1 ALA 56 2.556 -0.883 5.162
428 HB2 ALA 56 HB2 ALA 56 1.813 0.676 4.837
429 HB3 ALA 56 HB3 ALA 56 0.893 -0.805 4.559
430 H ASN 57 H ASN 57 4.731 -1.396 3.400
431 HA ASN 57 HA ASN 57 6.247 0.984 3.751
432 HB2 ASN 57 HB2 ASN 57 7.584 -1.490 2.635
433 HB3 ASN 57 HB3 ASN 57 8.153 -0.296 3.788
434 HD21 ASN 57 HD21 ASN 57 6.235 -3.330 3.406
435 HD22 ASN 57 HD22 ASN 57 6.161 -3.590 5.111
436 H TYR 58 H TYR 58 5.047 -0.302 0.732
437 HA TYR 58 HA TYR 58 7.259 0.943 -0.822
438 HB2 TYR 58 HB2 TYR 58 5.108 -1.068 -1.458
439 HB3 TYR 58 HB3 TYR 58 6.126 -0.357 -2.692
440 HD1 TYR 58 HD1 TYR 58 6.624 -2.131 0.632
441 HD2 TYR 58 HD2 TYR 58 7.783 -1.809 -3.510
442 HE1 TYR 58 HE1 TYR 58 8.368 -3.823 0.995
443 HE2 TYR 58 HE2 TYR 58 9.425 -3.585 -3.179
444 HH TYR 58 HH TYR 58 10.176 -5.112 -0.002
445 H VAL 59 H VAL 59 4.380 2.057 0.465
446 HA VAL 59 HA VAL 59 4.010 3.875 -1.861
447 HB VAL 59 HB VAL 59 1.614 3.626 -1.751
448 HG11 VAL 59 HG11 VAL 59 2.579 0.731 -1.634
449 HG12 VAL 59 HG12 VAL 59 1.213 1.401 -2.541
450 HG13 VAL 59 HG13 VAL 59 2.874 1.749 -3.023
451 HG21 VAL 59 HG21 VAL 59 1.975 1.550 0.438
452 HG22 VAL 59 HG22 VAL 59 1.430 3.196 0.727
453 HG23 VAL 59 HG23 VAL 59 0.450 2.152 -0.283
454 H GLU 60 H GLU 60 2.921 5.957 -1.230
455 HA GLU 60 HA GLU 60 2.915 6.523 1.659
456 HB2 GLU 60 HB2 GLU 60 5.220 7.006 0.260
457 HB3 GLU 60 HB3 GLU 60 4.383 8.535 0.034
458 HG2 GLU 60 HG2 GLU 60 4.953 7.132 2.690
459 HG3 GLU 60 HG3 GLU 60 5.919 8.435 2.006
460 H LYS 61 H LYS 61 1.918 8.675 2.049
461 HA LYS 61 HA LYS 61 -0.495 9.017 0.481
462 HB2 LYS 61 HB2 LYS 61 0.764 10.316 2.920
463 HB3 LYS 61 HB3 LYS 61 -0.353 11.275 1.977
464 HG2 LYS 61 HG2 LYS 61 -1.879 10.413 3.350
465 HG3 LYS 61 HG3 LYS 61 -1.934 9.162 2.149
466 HD2 LYS 61 HD2 LYS 61 -0.471 9.125 4.837
467 HD3 LYS 61 HD3 LYS 61 -1.975 8.306 4.438
468 HE2 LYS 61 HE2 LYS 61 -0.932 6.489 3.799
469 HE3 LYS 61 HE3 LYS 61 -0.067 7.376 2.556
470 HZ1 LYS 61 HZ1 LYS 61 0.874 7.210 5.362
471 HZ2 LYS 61 HZ2 LYS 61 1.697 7.797 4.087
472 HZ3 LYS 61 HZ3 LYS 61 1.378 6.202 4.134
473 H VAL 62 H VAL 62 -1.078 11.071 -0.656
474 HA VAL 62 HA VAL 62 1.187 12.667 -1.519
475 HB VAL 62 HB VAL 62 1.069 10.591 -2.974
476 HG11 VAL 62 HG11 VAL 62 -1.488 11.883 -4.025
477 HG12 VAL 62 HG12 VAL 62 -0.629 10.531 -4.753
478 HG13 VAL 62 HG13 VAL 62 -1.352 10.351 -3.147
479 HG21 VAL 62 HG21 VAL 62 0.681 13.214 -4.480
480 HG22 VAL 62 HG22 VAL 62 2.176 12.736 -3.637
481 HG23 VAL 62 HG23 VAL 62 1.593 11.758 -4.974
482 H GLY 63 H GLY 63 0.430 14.611 -2.642
483 HA2 GLY 63 HA2 GLY 63 -1.748 15.691 -3.476
484 HA3 GLY 63 HA3 GLY 63 -2.330 15.334 -1.850
485 H LEU 64 H LEU 64 -0.216 15.826 -0.310
486 HA LEU 64 HA LEU 64 -0.291 18.750 -0.140
487 HB2 LEU 64 HB2 LEU 64 0.504 16.534 1.642
488 HB3 LEU 64 HB3 LEU 64 1.701 17.791 1.661
489 HG LEU 64 HG LEU 64 0.214 18.129 3.462
490 HD11 LEU 64 HD11 LEU 64 -0.327 20.289 1.387
491 HD12 LEU 64 HD12 LEU 64 1.160 20.121 2.347
492 HD13 LEU 64 HD13 LEU 64 -0.375 20.445 3.153
493 HD21 LEU 64 HD21 LEU 64 -1.805 17.054 2.627
494 HD22 LEU 64 HD22 LEU 64 -2.035 18.354 1.445
495 HD23 LEU 64 HD23 LEU 64 -2.154 18.695 3.188
496 H ALA 65 H ALA 65 1.927 19.818 0.484
497 HA ALA 65 HA ALA 65 3.913 19.340 -1.676
498 HB1 ALA 65 HB1 ALA 65 2.662 21.463 -1.967
499 HB2 ALA 65 HB2 ALA 65 3.054 21.934 -0.294
500 HB3 ALA 65 HB3 ALA 65 4.342 21.783 -1.503
501 H ALA 66 H ALA 66 6.129 20.247 -0.843
502 HA ALA 66 HA ALA 66 7.896 20.033 0.515
503 HB1 ALA 66 HB1 ALA 66 5.967 20.850 2.714
504 HB2 ALA 66 HB2 ALA 66 7.727 20.812 2.838
505 HB3 ALA 66 HB3 ALA 66 6.949 21.928 1.691
506 H ALA 67 H ALA 67 7.846 17.831 -0.149
507 HA ALA 67 HA ALA 67 8.294 15.963 1.917
508 HB1 ALA 67 HB1 ALA 67 6.678 14.247 1.026
509 HB2 ALA 67 HB2 ALA 67 5.889 15.583 1.878
510 HB3 ALA 67 HB3 ALA 67 5.886 15.521 0.081
511 H1 THR 101 H THR 101 -2.281 -11.511 10.117
512 HA THR 101 HA THR 101 -1.315 -10.268 7.617
513 HB THR 101 HB THR 101 0.194 -11.540 9.909
514 HG1 THR 101 HG1 THR 101 -0.042 -9.261 9.975
515 HG21 THR 101 HG21 THR 101 1.187 -10.985 7.086
516 HG22 THR 101 HG22 THR 101 1.126 -12.560 7.888
517 HG23 THR 101 HG23 THR 101 2.221 -11.328 8.502
518 H LYS 102 H LYS 102 -2.077 -11.479 5.906
519 HA LYS 102 HA LYS 102 -2.700 -14.286 6.338
520 HB2 LYS 102 HB2 LYS 102 -3.800 -14.284 4.395
521 HB3 LYS 102 HB3 LYS 102 -3.835 -12.587 4.775
522 HG2 LYS 102 HG2 LYS 102 -3.379 -12.531 2.552
523 HG3 LYS 102 HG3 LYS 102 -1.757 -12.352 3.216
524 HD2 LYS 102 HD2 LYS 102 -1.911 -13.804 1.219
525 HD3 LYS 102 HD3 LYS 102 -1.265 -14.705 2.586
526 HE2 LYS 102 HE2 LYS 102 -3.438 -15.761 2.986
527 HE3 LYS 102 HE3 LYS 102 -4.209 -14.705 1.798
528 HZ1 LYS 102 HZ1 LYS 102 -2.210 -16.795 1.158
529 HZ2 LYS 102 HZ2 LYS 102 -2.971 -15.785 0.062
530 HZ3 LYS 102 HZ3 LYS 102 -3.838 -16.845 0.898
531 H GLY 103 H GLY 103 0.291 -12.735 5.354
532 HA2 GLY 103 HA2 GLY 103 1.753 -15.132 5.470
533 HA3 GLY 103 HA3 GLY 103 1.492 -14.666 3.768
534 HA PRO 104 HA PRO 104 4.809 -11.966 5.924
535 HB2 PRO 104 HB2 PRO 104 7.104 -12.951 4.782
536 HB3 PRO 104 HB3 PRO 104 6.407 -13.545 6.324
537 HG2 PRO 104 HG2 PRO 104 6.155 -14.769 3.575
538 HG3 PRO 104 HG3 PRO 104 6.459 -15.584 5.134
539 HD2 PRO 104 HD2 PRO 104 3.964 -15.419 3.952
540 HD3 PRO 104 HD3 PRO 104 4.184 -15.459 5.727
541 H ALA 105 H ALA 105 5.027 -10.126 4.959
542 HA ALA 105 HA ALA 105 4.419 -9.570 2.213
543 HB1 ALA 105 HB1 ALA 105 4.118 -7.413 3.070
544 HB2 ALA 105 HB2 ALA 105 3.855 -8.344 4.495
545 HB3 ALA 105 HB3 ALA 105 5.445 -7.594 4.273
546 HA PRO 106 HA PRO 106 8.586 -9.011 0.732
547 HB2 PRO 106 HB2 PRO 106 8.489 -6.895 -0.955
548 HB3 PRO 106 HB3 PRO 106 7.284 -8.218 -0.981
549 HG2 PRO 106 HG2 PRO 106 6.974 -5.607 0.471
550 HG3 PRO 106 HG3 PRO 106 5.991 -6.196 -0.895
551 HD2 PRO 106 HD2 PRO 106 5.449 -6.660 1.743
552 HD3 PRO 106 HD3 PRO 106 5.016 -7.896 0.527
553 H ASN 107 H ASN 107 7.601 -7.094 2.939
554 HA ASN 107 HA ASN 107 9.336 -4.862 3.208
555 HB2 ASN 107 HB2 ASN 107 8.656 -4.493 5.342
556 HB3 ASN 107 HB3 ASN 107 7.283 -5.407 4.686
557 HD21 ASN 107 HD21 ASN 107 8.375 -4.889 7.507
558 HD22 ASN 107 HD22 ASN 107 8.388 -6.471 8.217
559 HA PRO 108 HA PRO 108 10.746 -3.641 5.093
560 HB2 PRO 108 HB2 PRO 108 13.312 -2.691 4.705
561 HB3 PRO 108 HB3 PRO 108 12.774 -3.544 6.181
562 HG2 PRO 108 HG2 PRO 108 14.178 -4.703 3.764
563 HG3 PRO 108 HG3 PRO 108 14.645 -4.853 5.491
564 HD2 PRO 108 HD2 PRO 108 13.202 -6.795 4.276
565 HD3 PRO 108 HD3 PRO 108 12.778 -6.289 5.944
566 HA PRO 109 HA PRO 109 10.367 -2.108 0.957
567 HB2 PRO 109 HB2 PRO 109 10.731 0.604 1.105
568 HB3 PRO 109 HB3 PRO 109 9.368 -0.266 1.850
569 HG2 PRO 109 HG2 PRO 109 11.949 0.624 3.151
570 HG3 PRO 109 HG3 PRO 109 10.280 0.916 3.745
571 HD2 PRO 109 HD2 PRO 109 11.849 -1.142 4.634
572 HD3 PRO 109 HD3 PRO 109 10.082 -1.310 4.501
573 HA PRO 110 HA PRO 110 14.291 -1.845 -1.018
574 HB2 PRO 110 HB2 PRO 110 13.816 -0.260 -3.258
575 HB3 PRO 110 HB3 PRO 110 13.257 -1.948 -3.062
576 HG2 PRO 110 HG2 PRO 110 11.707 0.600 -2.558
577 HG3 PRO 110 HG3 PRO 110 11.194 -0.852 -3.478
578 HD2 PRO 110 HD2 PRO 110 10.435 -0.521 -0.912
579 HD3 PRO 110 HD3 PRO 110 10.969 -2.126 -1.500
580 H ILE 111 H ILE 111 12.871 1.485 -1.266
581 HA ILE 111 HA ILE 111 15.248 2.504 0.212
582 HB ILE 111 HB ILE 111 15.528 4.271 -1.431
583 HG12 ILE 111 HG12 ILE 111 13.424 2.863 -3.169
584 HG13 ILE 111 HG13 ILE 111 13.271 4.438 -2.345
585 HG21 ILE 111 HG21 ILE 111 16.613 2.947 -3.130
586 HG22 ILE 111 HG22 ILE 111 16.753 2.074 -1.606
587 HG23 ILE 111 HG23 ILE 111 15.578 1.561 -2.839
588 HD11 ILE 111 HD11 ILE 111 15.086 3.741 -4.673
589 HD12 ILE 111 HD12 ILE 111 13.780 4.934 -4.612
590 HD13 ILE 111 HD13 ILE 111 15.272 5.228 -3.715
591 H LEU 112 H LEU 112 11.839 2.568 0.111
592 HA LEU 112 HA LEU 112 11.439 5.282 0.864
593 HB2 LEU 112 HB2 LEU 112 9.797 3.408 0.018
594 HB3 LEU 112 HB3 LEU 112 9.611 3.013 1.713
595 HG LEU 112 HG LEU 112 8.754 5.321 2.145
596 HD11 LEU 112 HD11 LEU 112 8.849 5.671 -0.880
597 HD12 LEU 112 HD12 LEU 112 9.871 6.553 0.263
598 HD13 LEU 112 HD13 LEU 112 8.131 6.801 0.286
599 HD21 LEU 112 HD21 LEU 112 7.376 3.676 -0.051
600 HD22 LEU 112 HD22 LEU 112 6.612 5.067 0.761
601 HD23 LEU 112 HD23 LEU 112 7.075 3.669 1.707
602 H LYS 113 H LYS 113 11.265 6.341 2.868
603 HA LYS 113 HA LYS 113 11.753 4.759 5.339
604 HB2 LYS 113 HB2 LYS 113 13.565 6.577 4.029
605 HB3 LYS 113 HB3 LYS 113 12.977 7.410 5.443
606 HG2 LYS 113 HG2 LYS 113 14.579 6.322 6.560
607 HG3 LYS 113 HG3 LYS 113 13.562 4.884 6.469
608 HD2 LYS 113 HD2 LYS 113 14.714 4.286 4.277
609 HD3 LYS 113 HD3 LYS 113 15.734 5.713 4.480
610 HE2 LYS 113 HE2 LYS 113 17.001 3.832 5.234
611 HE3 LYS 113 HE3 LYS 113 16.571 4.801 6.652
612 HZ1 LYS 113 HZ1 LYS 113 16.274 2.401 6.944
613 HZ2 LYS 113 HZ2 LYS 113 15.093 2.402 5.782
614 HZ3 LYS 113 HZ3 LYS 113 14.909 3.243 7.212
615 H VAL 114 H VAL 114 11.627 6.580 7.260
616 HA VAL 114 HA VAL 114 9.129 8.151 6.969
617 HB VAL 114 HB VAL 114 9.709 5.895 8.927
618 HG11 VAL 114 HG11 VAL 114 8.754 7.548 10.398
619 HG12 VAL 114 HG12 VAL 114 7.491 7.942 9.202
620 HG13 VAL 114 HG13 VAL 114 7.507 6.368 10.023
621 HG21 VAL 114 HG21 VAL 114 7.497 5.074 8.158
622 HG22 VAL 114 HG22 VAL 114 7.340 6.476 7.103
623 HG23 VAL 114 HG23 VAL 114 8.599 5.256 6.796
624 H TRP 115 H TRP 115 12.433 8.353 7.729
625 HA TRP 115 HA TRP 115 12.016 10.806 9.129
626 HB2 TRP 115 HB2 TRP 115 12.008 8.980 10.933
627 HB3 TRP 115 HB3 TRP 115 13.658 8.631 10.463
628 HD1 TRP 115 HD1 TRP 115 14.520 9.085 12.808
629 HE1 TRP 115 HE1 TRP 115 14.955 11.135 14.258
630 HE3 TRP 115 HE3 TRP 115 12.109 12.670 9.980
631 HZ2 TRP 115 HZ2 TRP 115 14.404 13.943 14.198
632 HZ3 TRP 115 HZ3 TRP 115 12.208 15.015 10.653
633 HH2 TRP 115 HH2 TRP 115 13.373 15.696 12.739
Start of MODEL 10
1 H1 MET 1 H MET 1 -14.668 7.380 14.363
2 HA MET 1 HA MET 1 -16.578 7.657 12.871
3 HB2 MET 1 HB2 MET 1 -15.064 9.556 13.669
4 HB3 MET 1 HB3 MET 1 -14.342 9.545 12.061
5 HG2 MET 1 HG2 MET 1 -16.596 9.990 11.093
6 HG3 MET 1 HG3 MET 1 -17.306 9.878 12.706
7 HE1 MET 1 HE1 MET 1 -15.316 11.976 10.135
8 HE2 MET 1 HE2 MET 1 -14.679 13.325 11.100
9 HE3 MET 1 HE3 MET 1 -14.019 11.694 11.314
10 H LYS 2 H LYS 2 -16.121 5.432 11.747
11 HA LYS 2 HA LYS 2 -16.253 4.229 9.915
12 HB2 LYS 2 HB2 LYS 2 -17.653 6.211 9.231
13 HB3 LYS 2 HB3 LYS 2 -16.307 6.742 8.216
14 HG2 LYS 2 HG2 LYS 2 -16.772 5.212 6.606
15 HG3 LYS 2 HG3 LYS 2 -17.101 3.927 7.775
16 HD2 LYS 2 HD2 LYS 2 -19.119 4.512 6.475
17 HD3 LYS 2 HD3 LYS 2 -19.297 4.732 8.221
18 HE2 LYS 2 HE2 LYS 2 -18.803 7.225 7.822
19 HE3 LYS 2 HE3 LYS 2 -18.958 6.885 6.092
20 HZ1 LYS 2 HZ1 LYS 2 -21.048 7.649 7.056
21 HZ2 LYS 2 HZ2 LYS 2 -21.059 6.379 8.125
22 HZ3 LYS 2 HZ3 LYS 2 -21.218 6.130 6.525
23 H VAL 3 H VAL 3 -15.128 3.996 7.541
24 HA VAL 3 HA VAL 3 -12.211 4.438 7.930
25 HB VAL 3 HB VAL 3 -13.522 1.941 6.789
26 HG11 VAL 3 HG11 VAL 3 -11.267 0.974 7.050
27 HG12 VAL 3 HG12 VAL 3 -11.200 2.394 5.999
28 HG13 VAL 3 HG13 VAL 3 -10.665 2.523 7.688
29 HG21 VAL 3 HG21 VAL 3 -14.068 2.002 9.177
30 HG22 VAL 3 HG22 VAL 3 -12.828 0.803 8.865
31 HG23 VAL 3 HG23 VAL 3 -12.377 2.373 9.576
32 HA PRO 4 HA PRO 4 -13.702 6.108 3.846
33 HB2 PRO 4 HB2 PRO 4 -12.343 8.478 3.850
34 HB3 PRO 4 HB3 PRO 4 -13.916 8.269 4.677
35 HG2 PRO 4 HG2 PRO 4 -11.144 8.185 5.891
36 HG3 PRO 4 HG3 PRO 4 -12.593 9.039 6.504
37 HD2 PRO 4 HD2 PRO 4 -11.772 6.573 7.411
38 HD3 PRO 4 HD3 PRO 4 -13.499 7.054 7.364
39 H GLY 5 H GLY 5 -12.399 5.887 1.899
40 HA2 GLY 5 HA2 GLY 5 -10.074 4.352 2.115
41 HA3 GLY 5 HA3 GLY 5 -10.629 5.226 0.672
42 H VAL 6 H VAL 6 -7.869 4.903 2.138
43 HA VAL 6 HA VAL 6 -7.238 7.809 2.496
44 HB VAL 6 HB VAL 6 -5.453 5.413 3.070
45 HG11 VAL 6 HG11 VAL 6 -4.271 7.541 2.702
46 HG12 VAL 6 HG12 VAL 6 -5.236 8.290 3.979
47 HG13 VAL 6 HG13 VAL 6 -4.120 6.968 4.365
48 HG21 VAL 6 HG21 VAL 6 -7.327 5.191 4.598
49 HG22 VAL 6 HG22 VAL 6 -5.975 5.909 5.505
50 HG23 VAL 6 HG23 VAL 6 -7.303 6.927 4.937
51 H ARG 7 H ARG 7 -6.590 8.756 0.659
52 HA ARG 7 HA ARG 7 -5.873 7.232 -1.711
53 HB2 ARG 7 HB2 ARG 7 -7.190 9.257 -1.921
54 HB3 ARG 7 HB3 ARG 7 -6.033 10.197 -0.997
55 HG2 ARG 7 HG2 ARG 7 -4.785 8.936 -3.362
56 HG3 ARG 7 HG3 ARG 7 -6.155 9.961 -3.803
57 HD2 ARG 7 HD2 ARG 7 -3.935 10.892 -1.939
58 HD3 ARG 7 HD3 ARG 7 -3.840 11.014 -3.682
59 HE ARG 7 HE ARG 7 -5.919 12.361 -2.002
60 HH11 ARG 7 HH11 ARG 7 -4.274 12.188 -5.153
61 HH12 ARG 7 HH12 ARG 7 -4.451 13.894 -5.459
62 HH21 ARG 7 HH21 ARG 7 -6.170 14.602 -2.450
63 HH22 ARG 7 HH22 ARG 7 -5.689 15.251 -3.970
64 H VAL 8 H VAL 8 -3.911 6.358 -1.942
65 HA VAL 8 HA VAL 8 -1.525 7.921 -1.108
66 HB VAL 8 HB VAL 8 -0.516 5.966 -0.133
67 HG11 VAL 8 HG11 VAL 8 -1.742 5.689 1.853
68 HG12 VAL 8 HG12 VAL 8 -2.123 7.316 1.293
69 HG13 VAL 8 HG13 VAL 8 -3.289 6.012 1.067
70 HG21 VAL 8 HG21 VAL 8 -1.346 4.102 -1.375
71 HG22 VAL 8 HG22 VAL 8 -1.886 3.871 0.291
72 HG23 VAL 8 HG23 VAL 8 -3.039 4.451 -0.910
73 H ARG 9 H ARG 9 0.041 7.999 -2.750
74 HA ARG 9 HA ARG 9 -0.699 6.587 -5.290
75 HB2 ARG 9 HB2 ARG 9 -0.502 9.128 -5.209
76 HB3 ARG 9 HB3 ARG 9 1.233 8.910 -4.991
77 HG2 ARG 9 HG2 ARG 9 1.168 7.495 -7.151
78 HG3 ARG 9 HG3 ARG 9 -0.512 7.987 -7.327
79 HD2 ARG 9 HD2 ARG 9 0.774 9.471 -8.697
80 HD3 ARG 9 HD3 ARG 9 0.293 10.414 -7.269
81 HE ARG 9 HE ARG 9 2.880 8.962 -7.285
82 HH11 ARG 9 HH11 ARG 9 1.501 12.253 -7.487
83 HH12 ARG 9 HH12 ARG 9 2.860 12.941 -6.640
84 HH21 ARG 9 HH21 ARG 9 4.558 9.829 -6.380
85 HH22 ARG 9 HH22 ARG 9 4.790 11.545 -6.199
86 H ALA 10 H ALA 10 0.446 4.746 -5.648
87 HA ALA 10 HA ALA 10 2.554 3.875 -3.976
88 HB1 ALA 10 HB1 ALA 10 2.948 2.238 -5.892
89 HB2 ALA 10 HB2 ALA 10 1.290 2.281 -5.242
90 HB3 ALA 10 HB3 ALA 10 1.667 3.097 -6.772
91 H LEU 11 H LEU 11 4.699 4.080 -4.012
92 HA LEU 11 HA LEU 11 5.899 6.089 -5.812
93 HB2 LEU 11 HB2 LEU 11 6.732 4.677 -3.269
94 HB3 LEU 11 HB3 LEU 11 7.846 5.714 -4.154
95 HG LEU 11 HG LEU 11 5.140 6.712 -3.176
96 HD11 LEU 11 HD11 LEU 11 6.342 7.659 -1.235
97 HD12 LEU 11 HD12 LEU 11 7.820 6.815 -1.730
98 HD13 LEU 11 HD13 LEU 11 6.392 5.890 -1.225
99 HD21 LEU 11 HD21 LEU 11 6.359 8.054 -4.940
100 HD22 LEU 11 HD22 LEU 11 7.728 8.183 -3.828
101 HD23 LEU 11 HD23 LEU 11 6.148 8.901 -3.403
102 H TYR 12 H TYR 12 6.034 2.583 -5.273
103 HA TYR 12 HA TYR 12 8.112 2.431 -7.380
104 HB2 TYR 12 HB2 TYR 12 8.051 0.297 -5.302
105 HB3 TYR 12 HB3 TYR 12 9.403 0.961 -6.199
106 HD1 TYR 12 HD1 TYR 12 7.187 1.350 -3.318
107 HD2 TYR 12 HD2 TYR 12 10.636 3.000 -5.287
108 HE1 TYR 12 HE1 TYR 12 7.577 2.880 -1.369
109 HE2 TYR 12 HE2 TYR 12 11.034 4.459 -3.349
110 HH TYR 12 HH TYR 12 8.942 4.451 -0.414
111 H ASP 13 H ASP 13 8.195 0.346 -8.373
112 HA ASP 13 HA ASP 13 5.491 -0.620 -9.156
113 HB2 ASP 13 HB2 ASP 13 8.244 -0.977 -10.381
114 HB3 ASP 13 HB3 ASP 13 6.756 -1.665 -11.050
115 H TYR 14 H TYR 14 4.948 -2.097 -7.414
116 HA TYR 14 HA TYR 14 6.407 -4.691 -7.495
117 HB2 TYR 14 HB2 TYR 14 5.927 -2.865 -5.147
118 HB3 TYR 14 HB3 TYR 14 5.681 -4.575 -4.913
119 HD1 TYR 14 HD1 TYR 14 7.502 -5.988 -4.317
120 HD2 TYR 14 HD2 TYR 14 8.297 -2.230 -6.306
121 HE1 TYR 14 HE1 TYR 14 9.917 -6.503 -4.342
122 HE2 TYR 14 HE2 TYR 14 10.705 -2.728 -6.302
123 HH TYR 14 HH TYR 14 12.354 -4.261 -5.758
124 H THR 15 H THR 15 5.090 -6.510 -6.889
125 HA THR 15 HA THR 15 2.179 -5.972 -6.602
126 HB THR 15 HB THR 15 2.725 -6.262 -8.940
127 HG1 THR 15 HG1 THR 15 1.541 -8.415 -9.157
128 HG21 THR 15 HG21 THR 15 4.845 -7.653 -8.712
129 HG22 THR 15 HG22 THR 15 3.710 -8.154 -9.966
130 HG23 THR 15 HG23 THR 15 3.807 -9.061 -8.449
131 H GLY 16 H GLY 16 2.482 -6.414 -4.371
132 HA2 GLY 16 HA2 GLY 16 2.653 -7.715 -2.486
133 HA3 GLY 16 HA3 GLY 16 1.771 -8.830 -3.506
134 H GLN 17 H GLN 17 2.649 -10.474 -2.181
135 HA GLN 17 HA GLN 17 5.270 -11.435 -3.007
136 HB2 GLN 17 HB2 GLN 17 5.186 -10.319 -0.546
137 HB3 GLN 17 HB3 GLN 17 4.603 -11.906 -0.095
138 HG2 GLN 17 HG2 GLN 17 7.201 -11.377 -1.621
139 HG3 GLN 17 HG3 GLN 17 7.102 -11.448 0.129
140 HE21 GLN 17 HE21 GLN 17 7.983 -13.319 -2.531
141 HE22 GLN 17 HE22 GLN 17 7.711 -14.881 -1.809
142 H GLU 18 H GLU 18 1.885 -12.091 -2.707
143 HA GLU 18 HA GLU 18 2.455 -14.988 -2.877
144 HB2 GLU 18 HB2 GLU 18 1.690 -13.878 -0.552
145 HB3 GLU 18 HB3 GLU 18 0.098 -13.958 -1.287
146 HG2 GLU 18 HG2 GLU 18 0.329 -16.409 -1.498
147 HG3 GLU 18 HG3 GLU 18 1.998 -16.324 -0.915
148 H ALA 19 H ALA 19 -0.021 -15.980 -3.268
149 HA ALA 19 HA ALA 19 -0.773 -14.871 -5.875
150 HB1 ALA 19 HB1 ALA 19 -2.037 -16.926 -6.126
151 HB2 ALA 19 HB2 ALA 19 -0.388 -17.287 -5.618
152 HB3 ALA 19 HB3 ALA 19 -1.729 -17.373 -4.437
153 H ASP 20 H ASP 20 -1.774 -14.049 -2.772
154 HA ASP 20 HA ASP 20 -4.460 -13.368 -3.803
155 HB2 ASP 20 HB2 ASP 20 -4.522 -15.509 -2.437
156 HB3 ASP 20 HB3 ASP 20 -4.181 -14.502 -1.018
157 H GLU 21 H GLU 21 -2.326 -11.659 -3.637
158 HA GLU 21 HA GLU 21 -2.989 -9.619 -1.633
159 HB2 GLU 21 HB2 GLU 21 -0.618 -8.811 -2.410
160 HB3 GLU 21 HB3 GLU 21 -0.812 -10.075 -1.200
161 HG2 GLU 21 HG2 GLU 21 0.951 -10.613 -2.785
162 HG3 GLU 21 HG3 GLU 21 -0.321 -11.800 -2.787
163 H LEU 22 H LEU 22 -2.256 -7.419 -2.772
164 HA LEU 22 HA LEU 22 -3.964 -7.021 -5.128
165 HB2 LEU 22 HB2 LEU 22 -4.163 -5.839 -2.783
166 HB3 LEU 22 HB3 LEU 22 -2.685 -5.018 -3.212
167 HG LEU 22 HG LEU 22 -3.752 -3.770 -4.897
168 HD11 LEU 22 HD11 LEU 22 -5.937 -5.871 -4.740
169 HD12 LEU 22 HD12 LEU 22 -5.031 -5.307 -6.134
170 HD13 LEU 22 HD13 LEU 22 -6.269 -4.270 -5.431
171 HD21 LEU 22 HD21 LEU 22 -4.321 -3.067 -2.606
172 HD22 LEU 22 HD22 LEU 22 -5.737 -4.136 -2.602
173 HD23 LEU 22 HD23 LEU 22 -5.682 -2.739 -3.674
174 H SER 23 H SER 23 -3.035 -5.444 -6.791
175 HA SER 23 HA SER 23 -0.052 -5.431 -6.849
176 HB2 SER 23 HB2 SER 23 -2.072 -5.989 -9.075
177 HB3 SER 23 HB3 SER 23 -0.307 -6.025 -9.227
178 HG SER 23 HG SER 23 -0.209 -7.814 -8.042
179 H PHE 24 H PHE 24 0.818 -3.331 -7.307
180 HA PHE 24 HA PHE 24 -0.972 -1.393 -8.672
181 HB2 PHE 24 HB2 PHE 24 -0.405 0.336 -7.087
182 HB3 PHE 24 HB3 PHE 24 -1.346 -0.948 -6.360
183 HD1 PHE 24 HD1 PHE 24 2.245 0.111 -6.835
184 HD2 PHE 24 HD2 PHE 24 -0.666 -1.722 -4.211
185 HE1 PHE 24 HE1 PHE 24 3.955 -0.066 -5.071
186 HE2 PHE 24 HE2 PHE 24 1.063 -1.765 -2.406
187 HZ PHE 24 HZ PHE 24 3.347 -1.003 -2.851
188 H LYS 25 H LYS 25 0.437 0.518 -9.451
189 HA LYS 25 HA LYS 25 3.265 -0.314 -9.946
190 HB2 LYS 25 HB2 LYS 25 1.185 0.730 -11.912
191 HB3 LYS 25 HB3 LYS 25 2.906 1.002 -12.146
192 HG2 LYS 25 HG2 LYS 25 2.425 -0.875 -13.420
193 HG3 LYS 25 HG3 LYS 25 3.316 -1.465 -12.022
194 HD2 LYS 25 HD2 LYS 25 1.343 -2.433 -11.058
195 HD3 LYS 25 HD3 LYS 25 0.273 -1.604 -12.193
196 HE2 LYS 25 HE2 LYS 25 2.428 -3.610 -13.000
197 HE3 LYS 25 HE3 LYS 25 0.764 -4.076 -12.620
198 HZ1 LYS 25 HZ1 LYS 25 -0.026 -2.755 -14.398
199 HZ2 LYS 25 HZ2 LYS 25 1.144 -3.757 -14.974
200 HZ3 LYS 25 HZ3 LYS 25 1.458 -2.155 -14.767
201 H ALA 26 H ALA 26 4.707 1.558 -10.305
202 HA ALA 26 HA ALA 26 4.276 3.545 -8.327
203 HB1 ALA 26 HB1 ALA 26 6.541 2.887 -9.172
204 HB2 ALA 26 HB2 ALA 26 6.196 3.714 -10.694
205 HB3 ALA 26 HB3 ALA 26 6.272 4.634 -9.187
206 H GLY 27 H GLY 27 2.953 5.218 -8.386
207 HA2 GLY 27 HA2 GLY 27 2.282 7.326 -9.355
208 HA3 GLY 27 HA3 GLY 27 2.225 6.550 -10.939
209 H GLU 28 H GLU 28 0.904 4.122 -9.313
210 HA GLU 28 HA GLU 28 -1.770 4.917 -9.995
211 HB2 GLU 28 HB2 GLU 28 -0.564 2.567 -10.104
212 HB3 GLU 28 HB3 GLU 28 -0.985 2.440 -8.404
213 HG2 GLU 28 HG2 GLU 28 -2.784 1.403 -9.492
214 HG3 GLU 28 HG3 GLU 28 -3.421 3.024 -9.217
215 H GLU 29 H GLU 29 -3.361 5.776 -8.653
216 HA GLU 29 HA GLU 29 -2.680 6.237 -5.806
217 HB2 GLU 29 HB2 GLU 29 -4.829 7.314 -7.663
218 HB3 GLU 29 HB3 GLU 29 -4.866 7.543 -5.908
219 HG2 GLU 29 HG2 GLU 29 -2.671 8.656 -5.965
220 HG3 GLU 29 HG3 GLU 29 -2.646 8.513 -7.736
221 H LEU 30 H LEU 30 -3.194 4.580 -4.508
222 HA LEU 30 HA LEU 30 -5.654 2.958 -5.030
223 HB2 LEU 30 HB2 LEU 30 -4.628 1.500 -3.206
224 HB3 LEU 30 HB3 LEU 30 -3.901 1.378 -4.832
225 HG LEU 30 HG LEU 30 -2.690 3.310 -2.898
226 HD11 LEU 30 HD11 LEU 30 -3.117 1.438 -1.387
227 HD12 LEU 30 HD12 LEU 30 -1.397 1.558 -1.739
228 HD13 LEU 30 HD13 LEU 30 -2.357 0.303 -2.545
229 HD21 LEU 30 HD21 LEU 30 -0.592 2.537 -3.853
230 HD22 LEU 30 HD22 LEU 30 -1.723 2.904 -5.164
231 HD23 LEU 30 HD23 LEU 30 -1.419 1.222 -4.711
232 H MET 31 H MET 31 -6.965 2.424 -3.238
233 HA MET 31 HA MET 31 -7.000 4.535 -1.140
234 HB2 MET 31 HB2 MET 31 -9.472 2.949 -1.822
235 HB3 MET 31 HB3 MET 31 -9.257 4.442 -0.948
236 HG2 MET 31 HG2 MET 31 -8.223 5.113 -3.435
237 HG3 MET 31 HG3 MET 31 -9.528 4.001 -3.838
238 HE1 MET 31 HE1 MET 31 -8.509 7.527 -3.201
239 HE2 MET 31 HE2 MET 31 -9.765 8.261 -2.179
240 HE3 MET 31 HE3 MET 31 -8.642 7.069 -1.484
241 H LYS 32 H LYS 32 -6.193 3.782 0.741
242 HA LYS 32 HA LYS 32 -6.013 0.942 1.355
243 HB2 LYS 32 HB2 LYS 32 -4.517 2.704 2.238
244 HB3 LYS 32 HB3 LYS 32 -5.878 3.375 3.175
245 HG2 LYS 32 HG2 LYS 32 -6.144 1.194 4.388
246 HG3 LYS 32 HG3 LYS 32 -4.695 0.615 3.566
247 HD2 LYS 32 HD2 LYS 32 -3.975 1.266 5.683
248 HD3 LYS 32 HD3 LYS 32 -3.455 2.593 4.636
249 HE2 LYS 32 HE2 LYS 32 -5.499 3.881 5.403
250 HE3 LYS 32 HE3 LYS 32 -5.899 2.516 6.465
251 HZ1 LYS 32 HZ1 LYS 32 -3.687 2.881 7.511
252 HZ2 LYS 32 HZ2 LYS 32 -4.761 4.065 7.800
253 HZ3 LYS 32 HZ3 LYS 32 -3.551 4.304 6.720
254 H ILE 33 H ILE 33 -7.440 -0.329 2.776
255 HA ILE 33 HA ILE 33 -9.807 1.136 3.775
256 HB ILE 33 HB ILE 33 -11.306 -0.335 2.957
257 HG12 ILE 33 HG12 ILE 33 -9.777 -2.125 1.202
258 HG13 ILE 33 HG13 ILE 33 -9.403 -2.379 2.906
259 HG21 ILE 33 HG21 ILE 33 -9.577 0.185 0.546
260 HG22 ILE 33 HG22 ILE 33 -11.326 -0.066 0.587
261 HG23 ILE 33 HG23 ILE 33 -10.622 1.377 1.338
262 HD11 ILE 33 HD11 ILE 33 -11.198 -3.814 2.222
263 HD12 ILE 33 HD12 ILE 33 -11.836 -2.622 3.369
264 HD13 ILE 33 HD13 ILE 33 -12.154 -2.445 1.619
265 H SER 34 H SER 34 -7.233 -0.550 4.847
266 HA SER 34 HA SER 34 -8.663 -1.556 7.214
267 HB2 SER 34 HB2 SER 34 -8.339 -3.429 5.609
268 HB3 SER 34 HB3 SER 34 -6.608 -3.101 5.571
269 HG SER 34 HG SER 34 -6.388 -4.252 7.246
270 H GLU 35 H GLU 35 -6.605 -2.356 8.666
271 HA GLU 35 HA GLU 35 -5.124 0.093 9.368
272 HB2 GLU 35 HB2 GLU 35 -4.671 -1.189 11.400
273 HB3 GLU 35 HB3 GLU 35 -6.383 -1.333 11.000
274 HG2 GLU 35 HG2 GLU 35 -5.673 -3.576 9.784
275 HG3 GLU 35 HG3 GLU 35 -4.204 -3.439 10.744
276 H GLU 36 H GLU 36 -2.678 -0.316 10.103
277 HA GLU 36 HA GLU 36 -1.127 -1.510 8.020
278 HB2 GLU 36 HB2 GLU 36 -0.538 0.711 9.067
279 HB3 GLU 36 HB3 GLU 36 -0.691 0.013 10.645
280 HG2 GLU 36 HG2 GLU 36 1.525 -0.039 10.631
281 HG3 GLU 36 HG3 GLU 36 1.350 -1.549 9.763
282 H ASP 37 H ASP 37 -0.673 -3.714 8.243
283 HA ASP 37 HA ASP 37 -1.151 -5.046 10.850
284 HB2 ASP 37 HB2 ASP 37 -0.577 -5.959 8.044
285 HB3 ASP 37 HB3 ASP 37 -0.236 -7.048 9.366
286 H GLU 38 H GLU 38 0.640 -6.450 11.717
287 HA GLU 38 HA GLU 38 2.944 -5.004 12.220
288 HB2 GLU 38 HB2 GLU 38 3.810 -6.989 13.273
289 HB3 GLU 38 HB3 GLU 38 2.091 -6.786 13.633
290 HG2 GLU 38 HG2 GLU 38 1.563 -8.528 11.894
291 HG3 GLU 38 HG3 GLU 38 3.295 -8.721 11.593
292 H GLN 39 H GLN 39 2.523 -7.215 9.549
293 HA GLN 39 HA GLN 39 5.415 -7.145 8.926
294 HB2 GLN 39 HB2 GLN 39 3.491 -9.091 8.730
295 HB3 GLN 39 HB3 GLN 39 3.551 -8.535 7.060
296 HG2 GLN 39 HG2 GLN 39 4.970 -10.481 7.457
297 HG3 GLN 39 HG3 GLN 39 5.954 -9.132 6.974
298 HE21 GLN 39 HE21 GLN 39 7.484 -8.192 8.664
299 HE22 GLN 39 HE22 GLN 39 7.661 -9.034 10.186
300 H GLY 40 H GLY 40 3.235 -4.858 8.675
301 HA2 GLY 40 HA2 GLY 40 3.182 -2.987 7.437
302 HA3 GLY 40 HA3 GLY 40 4.455 -3.609 6.376
303 H TRP 41 H TRP 41 1.440 -5.429 7.050
304 HA TRP 41 HA TRP 41 0.784 -5.362 4.192
305 HB2 TRP 41 HB2 TRP 41 0.230 -7.130 6.549
306 HB3 TRP 41 HB3 TRP 41 -1.079 -6.968 5.406
307 HD1 TRP 41 HD1 TRP 41 1.136 -9.346 6.171
308 HE1 TRP 41 HE1 TRP 41 1.937 -10.789 4.181
309 HE3 TRP 41 HE3 TRP 41 -0.081 -6.157 2.431
310 HZ2 TRP 41 HZ2 TRP 41 2.133 -10.461 1.298
311 HZ3 TRP 41 HZ3 TRP 41 0.407 -6.742 0.060
312 HH2 TRP 41 HH2 TRP 41 1.349 -8.788 -0.533
313 H CYS 42 H CYS 42 -0.995 -4.252 3.369
314 HA CYS 42 HA CYS 42 -2.925 -3.124 5.319
315 HB2 CYS 42 HB2 CYS 42 -1.253 -1.738 3.217
316 HB3 CYS 42 HB3 CYS 42 -2.946 -1.267 3.401
317 HG CYS 42 HG CYS 42 -1.546 0.459 4.612
318 H LYS 43 H LYS 43 -4.949 -3.765 4.770
319 HA LYS 43 HA LYS 43 -5.352 -4.991 2.106
320 HB2 LYS 43 HB2 LYS 43 -6.357 -5.593 4.636
321 HB3 LYS 43 HB3 LYS 43 -7.725 -4.774 3.875
322 HG2 LYS 43 HG2 LYS 43 -6.181 -6.998 2.442
323 HG3 LYS 43 HG3 LYS 43 -7.446 -7.341 3.634
324 HD2 LYS 43 HD2 LYS 43 -9.141 -6.211 2.332
325 HD3 LYS 43 HD3 LYS 43 -7.917 -5.567 1.223
326 HE2 LYS 43 HE2 LYS 43 -8.940 -7.448 0.138
327 HE3 LYS 43 HE3 LYS 43 -7.283 -7.872 0.577
328 HZ1 LYS 43 HZ1 LYS 43 -8.858 -9.605 1.014
329 HZ2 LYS 43 HZ2 LYS 43 -9.673 -8.691 2.113
330 HZ3 LYS 43 HZ3 LYS 43 -8.095 -9.145 2.397
331 H GLY 44 H GLY 44 -6.265 -3.871 0.392
332 HA2 GLY 44 HA2 GLY 44 -7.832 -1.434 0.945
333 HA3 GLY 44 HA3 GLY 44 -6.303 -1.200 0.153
334 H ARG 45 H ARG 45 -7.877 -0.285 -1.435
335 HA ARG 45 HA ARG 45 -8.573 -2.320 -3.450
336 HB2 ARG 45 HB2 ARG 45 -10.616 -1.655 -2.103
337 HB3 ARG 45 HB3 ARG 45 -10.403 -0.003 -2.698
338 HG2 ARG 45 HG2 ARG 45 -10.731 -0.794 -5.023
339 HG3 ARG 45 HG3 ARG 45 -10.751 -2.457 -4.479
340 HD2 ARG 45 HD2 ARG 45 -13.004 -1.859 -4.861
341 HD3 ARG 45 HD3 ARG 45 -12.809 -1.923 -3.101
342 HE ARG 45 HE ARG 45 -12.266 0.720 -3.850
343 HH11 ARG 45 HH11 ARG 45 -15.085 -1.418 -4.249
344 HH12 ARG 45 HH12 ARG 45 -16.185 -0.082 -4.473
345 HH21 ARG 45 HH21 ARG 45 -13.820 2.448 -3.812
346 HH22 ARG 45 HH22 ARG 45 -15.461 2.097 -4.164
347 H LEU 46 H LEU 46 -8.234 -1.611 -5.588
348 HA LEU 46 HA LEU 46 -6.518 0.796 -5.914
349 HB2 LEU 46 HB2 LEU 46 -7.311 -1.559 -7.675
350 HB3 LEU 46 HB3 LEU 46 -6.901 -0.056 -8.444
351 HG LEU 46 HG LEU 46 -4.715 -0.139 -7.003
352 HD11 LEU 46 HD11 LEU 46 -5.427 -2.091 -5.744
353 HD12 LEU 46 HD12 LEU 46 -3.869 -2.269 -6.568
354 HD13 LEU 46 HD13 LEU 46 -5.315 -3.058 -7.240
355 HD21 LEU 46 HD21 LEU 46 -4.829 -0.159 -9.491
356 HD22 LEU 46 HD22 LEU 46 -5.094 -1.915 -9.437
357 HD23 LEU 46 HD23 LEU 46 -3.567 -1.215 -8.852
358 H LEU 47 H LEU 47 -7.117 2.220 -7.843
359 HA LEU 47 HA LEU 47 -9.781 3.287 -7.519
360 HB2 LEU 47 HB2 LEU 47 -9.275 4.723 -9.396
361 HB3 LEU 47 HB3 LEU 47 -7.949 4.692 -8.246
362 HG LEU 47 HG LEU 47 -7.266 2.681 -10.126
363 HD11 LEU 47 HD11 LEU 47 -9.051 3.502 -11.663
364 HD12 LEU 47 HD12 LEU 47 -7.427 3.760 -12.317
365 HD13 LEU 47 HD13 LEU 47 -8.326 5.121 -11.612
366 HD21 LEU 47 HD21 LEU 47 -5.502 4.209 -10.755
367 HD22 LEU 47 HD22 LEU 47 -5.797 4.229 -9.005
368 HD23 LEU 47 HD23 LEU 47 -6.384 5.570 -9.998
369 H THR 48 H THR 48 -8.385 0.825 -9.654
370 HA THR 48 HA THR 48 -10.499 0.689 -11.582
371 HB THR 48 HB THR 48 -9.321 -1.508 -12.044
372 HG1 THR 48 HG1 THR 48 -7.417 -1.919 -10.876
373 HG21 THR 48 HG21 THR 48 -7.426 0.878 -11.794
374 HG22 THR 48 HG22 THR 48 -8.557 0.587 -13.133
375 HG23 THR 48 HG23 THR 48 -7.221 -0.539 -12.836
376 H GLY 49 H GLY 49 -10.321 -0.107 -8.297
377 HA2 GLY 49 HA2 GLY 49 -12.093 -0.984 -7.024
378 HA3 GLY 49 HA3 GLY 49 -12.754 -1.767 -8.470
379 H HIS 50 H HIS 50 -9.491 -2.551 -8.534
380 HA HIS 50 HA HIS 50 -9.960 -5.281 -7.844
381 HB2 HIS 50 HB2 HIS 50 -8.354 -4.517 -9.524
382 HB3 HIS 50 HB3 HIS 50 -7.439 -3.653 -8.304
383 HD1 HIS 50 HD1 HIS 50 -8.426 -7.396 -7.671
384 HD2 HIS 50 HD2 HIS 50 -5.223 -4.921 -8.920
385 HE1 HIS 50 HE1 HIS 50 -6.349 -8.808 -7.587
386 H VAL 51 H VAL 51 -9.591 -6.371 -5.838
387 HA VAL 51 HA VAL 51 -8.769 -4.687 -3.510
388 HB VAL 51 HB VAL 51 -10.231 -6.232 -2.204
389 HG11 VAL 51 HG11 VAL 51 -10.953 -3.965 -2.759
390 HG12 VAL 51 HG12 VAL 51 -11.694 -4.564 -4.271
391 HG13 VAL 51 HG13 VAL 51 -12.321 -5.079 -2.696
392 HG21 VAL 51 HG21 VAL 51 -11.480 -7.025 -4.863
393 HG22 VAL 51 HG22 VAL 51 -10.539 -8.098 -3.797
394 HG23 VAL 51 HG23 VAL 51 -12.072 -7.429 -3.247
395 H GLY 52 H GLY 52 -7.446 -5.626 -1.853
396 HA2 GLY 52 HA2 GLY 52 -6.820 -8.236 -1.467
397 HA3 GLY 52 HA3 GLY 52 -5.690 -7.717 -2.727
398 H LEU 53 H LEU 53 -4.296 -8.373 -0.812
399 HA LEU 53 HA LEU 53 -3.857 -6.376 1.316
400 HB2 LEU 53 HB2 LEU 53 -3.010 -9.197 0.641
401 HB3 LEU 53 HB3 LEU 53 -1.788 -8.211 1.383
402 HG LEU 53 HG LEU 53 -4.479 -8.857 2.604
403 HD11 LEU 53 HD11 LEU 53 -2.783 -10.688 2.486
404 HD12 LEU 53 HD12 LEU 53 -3.106 -10.176 4.161
405 HD13 LEU 53 HD13 LEU 53 -1.620 -9.675 3.345
406 HD21 LEU 53 HD21 LEU 53 -3.962 -6.685 3.446
407 HD22 LEU 53 HD22 LEU 53 -2.234 -7.057 3.543
408 HD23 LEU 53 HD23 LEU 53 -3.386 -7.802 4.679
409 H TYR 54 H TYR 54 -2.224 -4.803 1.058
410 HA TYR 54 HA TYR 54 -0.345 -5.093 -1.188
411 HB2 TYR 54 HB2 TYR 54 -0.640 -2.941 -1.933
412 HB3 TYR 54 HB3 TYR 54 -2.252 -3.524 -1.733
413 HD1 TYR 54 HD1 TYR 54 -3.802 -2.451 -0.216
414 HD2 TYR 54 HD2 TYR 54 0.368 -1.355 -0.203
415 HE1 TYR 54 HE1 TYR 54 -4.313 -0.510 1.234
416 HE2 TYR 54 HE2 TYR 54 -0.140 0.550 1.261
417 HH TYR 54 HH TYR 54 -1.760 1.567 2.628
418 HA PRO 55 HA PRO 55 2.456 -4.284 2.133
419 HB2 PRO 55 HB2 PRO 55 4.767 -3.804 0.822
420 HB3 PRO 55 HB3 PRO 55 3.888 -5.354 0.740
421 HG2 PRO 55 HG2 PRO 55 3.781 -3.146 -1.322
422 HG3 PRO 55 HG3 PRO 55 4.078 -4.895 -1.573
423 HD2 PRO 55 HD2 PRO 55 1.601 -3.859 -1.841
424 HD3 PRO 55 HD3 PRO 55 1.912 -5.500 -1.196
425 H ALA 56 H ALA 56 1.792 -2.509 3.262
426 HA ALA 56 HA ALA 56 1.486 0.136 2.480
427 HB1 ALA 56 HB1 ALA 56 0.753 -0.869 4.670
428 HB2 ALA 56 HB2 ALA 56 2.426 -0.757 5.239
429 HB3 ALA 56 HB3 ALA 56 1.518 0.709 4.850
430 H ASN 57 H ASN 57 4.459 -1.462 3.453
431 HA ASN 57 HA ASN 57 6.197 0.717 3.891
432 HB2 ASN 57 HB2 ASN 57 6.711 -2.014 2.614
433 HB3 ASN 57 HB3 ASN 57 7.972 -0.901 3.097
434 HD21 ASN 57 HD21 ASN 57 6.351 -3.681 4.124
435 HD22 ASN 57 HD22 ASN 57 6.629 -3.383 5.841
436 H TYR 58 H TYR 58 4.911 -0.456 0.807
437 HA TYR 58 HA TYR 58 6.946 0.984 -0.754
438 HB2 TYR 58 HB2 TYR 58 4.878 -1.117 -1.386
439 HB3 TYR 58 HB3 TYR 58 5.794 -0.307 -2.637
440 HD1 TYR 58 HD1 TYR 58 6.300 -2.261 0.526
441 HD2 TYR 58 HD2 TYR 58 7.760 -1.390 -3.424
442 HE1 TYR 58 HE1 TYR 58 8.151 -3.865 0.873
443 HE2 TYR 58 HE2 TYR 58 9.538 -3.082 -3.127
444 HH TYR 58 HH TYR 58 10.659 -4.508 -1.587
445 H VAL 59 H VAL 59 4.246 2.023 0.782
446 HA VAL 59 HA VAL 59 3.429 3.787 -1.460
447 HB VAL 59 HB VAL 59 1.318 3.061 -1.452
448 HG11 VAL 59 HG11 VAL 59 2.112 0.648 0.073
449 HG12 VAL 59 HG12 VAL 59 0.777 0.870 -1.077
450 HG13 VAL 59 HG13 VAL 59 2.425 0.934 -1.657
451 HG21 VAL 59 HG21 VAL 59 -0.085 2.557 0.449
452 HG22 VAL 59 HG22 VAL 59 1.319 2.617 1.551
453 HG23 VAL 59 HG23 VAL 59 0.733 4.076 0.706
454 H GLU 60 H GLU 60 2.356 5.783 -0.688
455 HA GLU 60 HA GLU 60 2.721 6.662 2.042
456 HB2 GLU 60 HB2 GLU 60 5.009 7.005 1.010
457 HB3 GLU 60 HB3 GLU 60 4.250 8.057 -0.204
458 HG2 GLU 60 HG2 GLU 60 3.436 9.547 1.626
459 HG3 GLU 60 HG3 GLU 60 4.160 8.481 2.818
460 H LYS 61 H LYS 61 1.384 8.493 2.410
461 HA LYS 61 HA LYS 61 -0.870 8.888 0.680
462 HB2 LYS 61 HB2 LYS 61 0.220 10.048 3.243
463 HB3 LYS 61 HB3 LYS 61 -0.742 11.137 2.271
464 HG2 LYS 61 HG2 LYS 61 -2.636 9.541 2.264
465 HG3 LYS 61 HG3 LYS 61 -1.675 8.420 3.255
466 HD2 LYS 61 HD2 LYS 61 -3.223 9.676 4.666
467 HD3 LYS 61 HD3 LYS 61 -1.543 10.062 5.049
468 HE2 LYS 61 HE2 LYS 61 -1.832 12.121 3.500
469 HE3 LYS 61 HE3 LYS 61 -3.567 11.762 3.518
470 HZ1 LYS 61 HZ1 LYS 61 -3.486 12.038 5.914
471 HZ2 LYS 61 HZ2 LYS 61 -2.943 13.383 5.187
472 HZ3 LYS 61 HZ3 LYS 61 -1.857 12.342 5.861
473 H VAL 62 H VAL 62 -1.477 10.759 -0.452
474 HA VAL 62 HA VAL 62 0.659 12.657 -1.077
475 HB VAL 62 HB VAL 62 0.553 10.648 -2.658
476 HG11 VAL 62 HG11 VAL 62 -0.973 11.118 -4.658
477 HG12 VAL 62 HG12 VAL 62 -1.754 10.466 -3.201
478 HG13 VAL 62 HG13 VAL 62 -1.883 12.196 -3.637
479 HG21 VAL 62 HG21 VAL 62 0.499 13.460 -3.821
480 HG22 VAL 62 HG22 VAL 62 1.891 12.692 -3.024
481 HG23 VAL 62 HG23 VAL 62 1.252 12.026 -4.530
482 H GLY 63 H GLY 63 -0.500 14.643 -2.332
483 HA2 GLY 63 HA2 GLY 63 -2.626 15.695 -2.723
484 HA3 GLY 63 HA3 GLY 63 -3.265 14.985 -1.245
485 H LEU 64 H LEU 64 -1.822 15.577 0.832
486 HA LEU 64 HA LEU 64 -1.879 18.482 0.909
487 HB2 LEU 64 HB2 LEU 64 -1.773 16.251 2.851
488 HB3 LEU 64 HB3 LEU 64 -0.785 17.605 3.350
489 HG LEU 64 HG LEU 64 -3.645 17.996 2.428
490 HD11 LEU 64 HD11 LEU 64 -4.271 18.017 4.831
491 HD12 LEU 64 HD12 LEU 64 -2.631 17.472 5.244
492 HD13 LEU 64 HD13 LEU 64 -3.704 16.430 4.281
493 HD21 LEU 64 HD21 LEU 64 -1.772 19.689 4.155
494 HD22 LEU 64 HD22 LEU 64 -3.457 20.077 3.804
495 HD23 LEU 64 HD23 LEU 64 -2.282 20.057 2.491
496 H ALA 65 H ALA 65 -0.144 19.672 2.088
497 HA ALA 65 HA ALA 65 2.595 18.978 1.164
498 HB1 ALA 65 HB1 ALA 65 2.868 21.368 0.633
499 HB2 ALA 65 HB2 ALA 65 1.567 20.636 -0.339
500 HB3 ALA 65 HB3 ALA 65 1.171 21.665 1.052
501 H ALA 66 H ALA 66 2.145 18.056 3.504
502 HA ALA 66 HA ALA 66 3.548 19.800 5.362
503 HB1 ALA 66 HB1 ALA 66 1.860 19.575 7.177
504 HB2 ALA 66 HB2 ALA 66 1.269 20.556 5.834
505 HB3 ALA 66 HB3 ALA 66 0.694 18.888 6.015
506 H ALA 67 H ALA 67 1.392 16.958 5.919
507 HA ALA 67 HA ALA 67 3.479 15.005 5.798
508 HB1 ALA 67 HB1 ALA 67 3.743 16.075 8.172
509 HB2 ALA 67 HB2 ALA 67 2.155 15.333 8.514
510 HB3 ALA 67 HB3 ALA 67 3.528 14.331 8.068
511 H1 THR 101 H THR 101 0.665 -13.655 11.186
512 HA THR 101 HA THR 101 -0.650 -11.681 10.440
513 HB THR 101 HB THR 101 1.394 -10.281 10.043
514 HG1 THR 101 HG1 THR 101 -0.696 -9.852 9.033
515 HG21 THR 101 HG21 THR 101 3.005 -11.429 8.844
516 HG22 THR 101 HG22 THR 101 2.247 -10.532 7.534
517 HG23 THR 101 HG23 THR 101 1.832 -12.210 7.750
518 H LYS 102 H LYS 102 -1.052 -11.569 7.719
519 HA LYS 102 HA LYS 102 -2.297 -14.042 7.125
520 HB2 LYS 102 HB2 LYS 102 -2.751 -11.612 6.258
521 HB3 LYS 102 HB3 LYS 102 -1.474 -11.914 5.101
522 HG2 LYS 102 HG2 LYS 102 -3.112 -12.684 3.760
523 HG3 LYS 102 HG3 LYS 102 -3.060 -14.151 4.708
524 HD2 LYS 102 HD2 LYS 102 -4.886 -11.755 5.140
525 HD3 LYS 102 HD3 LYS 102 -5.370 -13.306 4.439
526 HE2 LYS 102 HE2 LYS 102 -5.203 -14.454 6.511
527 HE3 LYS 102 HE3 LYS 102 -4.177 -13.198 7.217
528 HZ1 LYS 102 HZ1 LYS 102 -6.002 -11.707 7.275
529 HZ2 LYS 102 HZ2 LYS 102 -6.289 -13.044 8.136
530 HZ3 LYS 102 HZ3 LYS 102 -7.066 -12.850 6.694
531 H GLY 103 H GLY 103 0.649 -12.546 5.623
532 HA2 GLY 103 HA2 GLY 103 2.012 -15.092 5.481
533 HA3 GLY 103 HA3 GLY 103 1.503 -14.424 3.923
534 HA PRO 104 HA PRO 104 5.490 -12.404 5.637
535 HB2 PRO 104 HB2 PRO 104 7.373 -13.472 3.950
536 HB3 PRO 104 HB3 PRO 104 6.799 -14.316 5.424
537 HG2 PRO 104 HG2 PRO 104 5.837 -14.712 2.596
538 HG3 PRO 104 HG3 PRO 104 6.373 -15.961 3.767
539 HD2 PRO 104 HD2 PRO 104 3.742 -15.350 3.420
540 HD3 PRO 104 HD3 PRO 104 4.391 -15.721 5.049
541 H ALA 105 H ALA 105 4.810 -10.456 4.988
542 HA ALA 105 HA ALA 105 4.341 -9.639 2.341
543 HB1 ALA 105 HB1 ALA 105 4.095 -7.465 3.299
544 HB2 ALA 105 HB2 ALA 105 3.717 -8.528 4.656
545 HB3 ALA 105 HB3 ALA 105 5.321 -7.803 4.549
546 HA PRO 106 HA PRO 106 8.285 -8.593 0.502
547 HB2 PRO 106 HB3 PRO 106 7.085 -5.792 0.277
548 HB3 PRO 106 HB2 PRO 106 8.037 -6.677 -0.883
549 HG2 PRO 106 HG2 PRO 106 5.346 -6.692 -1.117
550 HG3 PRO 106 HG3 PRO 106 6.141 -8.299 -1.131
551 HD2 PRO 106 HD2 PRO 106 5.078 -6.806 1.313
552 HD3 PRO 106 HD3 PRO 106 4.579 -8.403 0.746
553 H ASN 107 H ASN 107 7.300 -6.828 3.126
554 HA ASN 107 HA ASN 107 9.021 -4.770 3.710
555 HB2 ASN 107 HB2 ASN 107 8.465 -4.947 5.982
556 HB3 ASN 107 HB3 ASN 107 7.073 -5.589 5.121
557 HD21 ASN 107 HD21 ASN 107 8.113 -8.389 4.703
558 HD22 ASN 107 HD22 ASN 107 8.172 -9.019 6.325
559 HA PRO 108 HA PRO 108 10.427 -3.875 5.800
560 HB2 PRO 108 HB2 PRO 108 12.943 -2.777 5.656
561 HB3 PRO 108 HB3 PRO 108 12.453 -3.943 6.893
562 HG2 PRO 108 HG2 PRO 108 13.890 -4.420 4.251
563 HG3 PRO 108 HG3 PRO 108 14.407 -4.967 5.880
564 HD2 PRO 108 HD2 PRO 108 13.040 -6.617 4.244
565 HD3 PRO 108 HD3 PRO 108 12.668 -6.571 5.983
566 HA PRO 109 HA PRO 109 9.985 -1.161 2.374
567 HB2 PRO 109 HB2 PRO 109 10.974 1.333 3.111
568 HB3 PRO 109 HB3 PRO 109 9.418 0.674 3.640
569 HG2 PRO 109 HG2 PRO 109 12.055 0.626 5.099
570 HG3 PRO 109 HG3 PRO 109 10.427 1.031 5.740
571 HD2 PRO 109 HD2 PRO 109 11.507 -1.391 6.135
572 HD3 PRO 109 HD3 PRO 109 9.782 -1.237 5.774
573 HA PRO 110 HA PRO 110 13.805 -1.848 0.244
574 HB2 PRO 110 HB2 PRO 110 13.220 -0.918 -2.255
575 HB3 PRO 110 HB3 PRO 110 12.448 -2.356 -1.526
576 HG2 PRO 110 HG2 PRO 110 11.343 0.488 -1.536
577 HG3 PRO 110 HG3 PRO 110 10.554 -0.996 -2.104
578 HD2 PRO 110 HD2 PRO 110 10.130 -0.111 0.414
579 HD3 PRO 110 HD3 PRO 110 10.367 -1.846 0.130
580 H ILE 111 H ILE 111 12.825 1.300 -1.187
581 HA ILE 111 HA ILE 111 15.273 2.621 -0.250
582 HB ILE 111 HB ILE 111 15.652 3.482 -2.509
583 HG12 ILE 111 HG12 ILE 111 13.474 1.602 -3.585
584 HG13 ILE 111 HG13 ILE 111 13.250 3.317 -3.328
585 HG21 ILE 111 HG21 ILE 111 16.819 1.411 -1.794
586 HG22 ILE 111 HG22 ILE 111 15.533 0.424 -2.505
587 HG23 ILE 111 HG23 ILE 111 16.554 1.384 -3.545
588 HD11 ILE 111 HD11 ILE 111 15.272 2.131 -5.237
589 HD12 ILE 111 HD12 ILE 111 13.736 2.912 -5.644
590 HD13 ILE 111 HD13 ILE 111 15.038 3.866 -4.911
591 H LEU 112 H LEU 112 14.964 4.938 -0.275
592 HA LEU 112 HA LEU 112 13.928 6.922 0.046
593 HB2 LEU 112 HB2 LEU 112 11.748 5.724 -1.679
594 HB3 LEU 112 HB3 LEU 112 11.581 7.277 -0.929
595 HG LEU 112 HG LEU 112 13.284 8.261 -2.228
596 HD11 LEU 112 HD11 LEU 112 14.999 6.516 -2.361
597 HD12 LEU 112 HD12 LEU 112 14.555 7.057 -3.977
598 HD13 LEU 112 HD13 LEU 112 13.927 5.515 -3.374
599 HD21 LEU 112 HD21 LEU 112 11.032 7.865 -3.296
600 HD22 LEU 112 HD22 LEU 112 11.684 6.410 -4.079
601 HD23 LEU 112 HD23 LEU 112 12.348 8.008 -4.471
602 H LYS 113 H LYS 113 12.764 7.838 1.717
603 HA LYS 113 HA LYS 113 11.953 7.727 3.893
604 HB2 LYS 113 HB2 LYS 113 9.574 6.857 2.207
605 HB3 LYS 113 HB3 LYS 113 9.465 7.561 3.812
606 HG2 LYS 113 HG2 LYS 113 10.627 8.959 1.362
607 HG3 LYS 113 HG3 LYS 113 9.002 9.179 1.969
608 HD2 LYS 113 HD2 LYS 113 11.523 9.837 3.568
609 HD3 LYS 113 HD3 LYS 113 10.641 11.000 2.605
610 HE2 LYS 113 HE2 LYS 113 9.424 9.459 4.933
611 HE3 LYS 113 HE3 LYS 113 10.114 11.079 5.046
612 HZ1 LYS 113 HZ1 LYS 113 7.745 10.323 3.432
613 HZ2 LYS 113 HZ2 LYS 113 8.450 11.795 3.384
614 HZ3 LYS 113 HZ3 LYS 113 7.792 11.268 4.783
615 H VAL 114 H VAL 114 13.475 5.666 3.875
616 HA VAL 114 HA VAL 114 12.481 3.086 4.288
617 HB VAL 114 HB VAL 114 14.891 4.149 5.778
618 HG11 VAL 114 HG11 VAL 114 15.897 2.011 5.064
619 HG12 VAL 114 HG12 VAL 114 14.376 1.754 5.936
620 HG13 VAL 114 HG13 VAL 114 14.415 1.621 4.153
621 HG21 VAL 114 HG21 VAL 114 15.200 5.280 3.669
622 HG22 VAL 114 HG22 VAL 114 16.307 3.924 3.759
623 HG23 VAL 114 HG23 VAL 114 14.853 3.790 2.757
624 H TRP 115 H TRP 115 12.344 5.860 6.334
625 HA TRP 115 HA TRP 115 10.835 4.601 8.423
626 HB2 TRP 115 HB2 TRP 115 12.301 5.523 10.170
627 HB3 TRP 115 HB3 TRP 115 13.138 4.265 9.262
628 HD1 TRP 115 HD1 TRP 115 15.317 4.975 7.960
629 HE1 TRP 115 HE1 TRP 115 16.728 7.112 7.856
630 HE3 TRP 115 HE3 TRP 115 12.173 8.120 10.454
631 HZ2 TRP 115 HZ2 TRP 115 16.304 9.964 8.411
632 HZ3 TRP 115 HZ3 TRP 115 12.682 10.538 10.646
633 HH2 TRP 115 HH2 TRP 115 14.732 11.471 9.570