Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
494526 | 2krm RC | 16641 | cing | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 H1 VAL 2 H1 VAL 2 66.613 23.431 27.801
2 H2 VAL 2 H2 VAL 2 67.567 22.988 29.126
3 H3 VAL 2 H3 VAL 2 66.709 24.445 29.153
4 HA VAL 2 HA VAL 2 65.657 22.743 30.518
5 HB VAL 2 HB VAL 2 64.296 24.519 29.468
6 HG11 VAL 2 HG11 VAL 2 64.714 24.002 27.127
7 HG12 VAL 2 HG12 VAL 2 62.983 24.037 27.460
8 HG13 VAL 2 HG13 VAL 2 63.816 22.493 27.286
9 HG21 VAL 2 HG21 VAL 2 63.277 22.838 30.961
10 HG22 VAL 2 HG22 VAL 2 62.864 21.866 29.548
11 HG23 VAL 2 HG23 VAL 2 62.144 23.461 29.762
12 H ASP 3 H ASP 3 64.656 20.739 30.752
13 HA ASP 3 HA ASP 3 65.649 18.746 28.846
14 HB2 ASP 3 HB2 ASP 3 64.134 18.479 31.450
15 HB3 ASP 3 HB3 ASP 3 64.700 17.116 30.490
16 H TYR 4 H TYR 4 64.334 17.052 27.951
17 HA TYR 4 HA TYR 4 61.476 17.809 27.590
18 HB2 TYR 4 HB2 TYR 4 63.575 17.431 25.513
19 HB3 TYR 4 HB3 TYR 4 61.972 16.806 25.167
20 HD1 TYR 4 HD2 TYR 4 63.510 19.958 26.501
21 HD2 TYR 4 HD1 TYR 4 60.569 18.182 23.994
22 HE1 TYR 4 HE2 TYR 4 62.805 22.191 25.753
23 HE2 TYR 4 HE1 TYR 4 59.859 20.409 23.237
24 HH TYR 4 HH TYR 4 59.942 22.763 24.095
25 H ILE 5 H ILE 5 60.052 16.092 27.084
26 HA ILE 5 HA ILE 5 61.218 13.413 27.687
27 HB ILE 5 HB ILE 5 59.673 14.098 29.449
28 HG12 ILE 5 HG12 ILE 5 58.444 11.983 27.668
29 HG13 ILE 5 HG13 ILE 5 59.781 11.718 28.780
30 HG21 ILE 5 HG21 ILE 5 57.258 14.399 28.939
31 HG22 ILE 5 HG22 ILE 5 57.668 14.428 27.225
32 HG23 ILE 5 HG23 ILE 5 58.289 15.678 28.301
33 HD11 ILE 5 HD11 ILE 5 57.709 10.926 29.731
34 HD12 ILE 5 HD12 ILE 5 56.978 12.517 29.526
35 HD13 ILE 5 HD13 ILE 5 58.315 12.299 30.655
36 H VAL 6 H VAL 6 60.874 11.763 26.278
37 HA VAL 6 HA VAL 6 59.881 12.551 23.659
38 HB VAL 6 HB VAL 6 60.706 9.800 24.597
39 HG11 VAL 6 HG11 VAL 6 61.174 9.453 22.178
40 HG12 VAL 6 HG12 VAL 6 60.416 11.012 21.853
41 HG13 VAL 6 HG13 VAL 6 59.468 9.697 22.547
42 HG21 VAL 6 HG21 VAL 6 62.496 11.447 24.964
43 HG22 VAL 6 HG22 VAL 6 62.396 11.917 23.268
44 HG23 VAL 6 HG23 VAL 6 62.911 10.287 23.703
45 H GLU 7 H GLU 7 57.888 12.410 22.934
46 HA GLU 7 HA GLU 7 55.994 10.680 24.441
47 HB2 GLU 7 HB2 GLU 7 55.349 12.966 22.569
48 HB3 GLU 7 HB3 GLU 7 54.221 12.107 23.607
49 HG2 GLU 7 HG2 GLU 7 56.502 13.837 24.540
50 HG3 GLU 7 HG3 GLU 7 54.802 14.297 24.506
51 H TYR 8 H TYR 8 57.570 11.141 21.392
52 HA TYR 8 HA TYR 8 55.978 8.884 20.294
53 HB2 TYR 8 HB2 TYR 8 56.819 11.375 18.793
54 HB3 TYR 8 HB3 TYR 8 56.104 9.946 18.053
55 HD1 TYR 8 HD2 TYR 8 53.740 9.380 18.481
56 HD2 TYR 8 HD1 TYR 8 55.472 12.966 19.981
57 HE1 TYR 8 HE2 TYR 8 51.493 10.288 18.889
58 HE2 TYR 8 HE1 TYR 8 53.229 13.883 20.394
59 HH TYR 8 HH TYR 8 50.891 13.520 19.501
60 H ASP 9 H ASP 9 57.102 7.365 19.136
61 HA ASP 9 HA ASP 9 59.961 7.319 19.616
62 HB2 ASP 9 HB2 ASP 9 58.656 5.256 19.699
63 HB3 ASP 9 HB3 ASP 9 58.193 5.456 18.012
64 H TYR 10 H TYR 10 61.592 7.914 18.355
65 HA TYR 10 HA TYR 10 60.999 8.436 15.481
66 HB2 TYR 10 HB2 TYR 10 61.124 10.603 16.474
67 HB3 TYR 10 HB3 TYR 10 62.535 10.159 17.426
68 HD1 TYR 10 HD2 TYR 10 61.347 11.024 14.043
69 HD2 TYR 10 HD1 TYR 10 64.736 10.244 16.492
70 HE1 TYR 10 HE2 TYR 10 62.818 11.906 12.280
71 HE2 TYR 10 HE1 TYR 10 66.216 11.125 14.739
72 HH TYR 10 HH TYR 10 66.136 11.435 12.239
73 H ASP 11 H ASP 11 62.384 7.602 14.051
74 HA ASP 11 HA ASP 11 64.702 6.134 15.185
75 HB2 ASP 11 HB2 ASP 11 63.335 5.886 12.495
76 HB3 ASP 11 HB3 ASP 11 64.689 4.900 13.038
77 H ALA 12 H ALA 12 66.621 7.048 15.100
78 HA ALA 12 HA ALA 12 67.166 9.405 13.600
79 HB1 ALA 12 HB1 ALA 12 69.103 7.425 14.790
80 HB2 ALA 12 HB2 ALA 12 68.394 8.811 15.619
81 HB3 ALA 12 HB3 ALA 12 69.493 9.061 14.262
82 H VAL 13 H VAL 13 67.093 9.501 11.462
83 HA VAL 13 HA VAL 13 67.875 7.226 9.821
84 HB VAL 13 HB VAL 13 67.252 10.069 8.984
85 HG11 VAL 13 HG11 VAL 13 68.494 8.879 7.277
86 HG12 VAL 13 HG12 VAL 13 66.815 9.071 6.774
87 HG13 VAL 13 HG13 VAL 13 67.381 7.515 7.383
88 HG21 VAL 13 HG21 VAL 13 65.363 9.080 10.146
89 HG22 VAL 13 HG22 VAL 13 65.459 7.646 9.124
90 HG23 VAL 13 HG23 VAL 13 65.019 9.203 8.421
91 H HIS 14 H HIS 14 69.191 10.385 10.732
92 HA HIS 14 HA HIS 14 71.665 9.776 9.219
93 HB2 HIS 14 HB2 HIS 14 70.834 12.304 10.656
94 HB3 HIS 14 HB3 HIS 14 72.287 12.111 9.688
95 HD1 HIS 14 HD1 HIS 14 72.125 12.647 7.260
96 HD2 HIS 14 HD2 HIS 14 68.382 12.074 9.061
97 HE1 HIS 14 HE1 HIS 14 70.389 13.253 5.514
98 HE2 HIS 14 HE2 HIS 14 68.122 12.796 6.567
99 H ASP 15 H ASP 15 73.700 10.772 10.444
100 HA ASP 15 HA ASP 15 73.972 9.074 12.804
101 HB2 ASP 15 HB2 ASP 15 75.763 9.237 11.095
102 HB3 ASP 15 HB3 ASP 15 75.985 10.932 11.513
103 H ASP 16 H ASP 16 73.489 12.464 12.087
104 HA ASP 16 HA ASP 16 74.171 13.238 14.853
105 HB2 ASP 16 HB2 ASP 16 73.870 15.522 14.095
106 HB3 ASP 16 HB3 ASP 16 74.881 14.663 12.938
107 H GLU 17 H GLU 17 71.620 11.717 13.565
108 HA GLU 17 HA GLU 17 69.565 13.398 14.845
109 HB2 GLU 17 HB2 GLU 17 69.384 10.911 13.141
110 HB3 GLU 17 HB3 GLU 17 67.992 11.677 13.894
111 HG2 GLU 17 HG2 GLU 17 69.803 12.849 11.803
112 HG3 GLU 17 HG3 GLU 17 68.116 12.375 11.614
113 H LEU 18 H LEU 18 68.543 12.905 16.687
114 HA LEU 18 HA LEU 18 69.718 10.708 18.251
115 HB2 LEU 18 HB2 LEU 18 68.759 13.280 18.841
116 HB3 LEU 18 HB3 LEU 18 67.634 12.172 19.603
117 HG LEU 18 HG LEU 18 70.618 12.266 20.053
118 HD11 LEU 18 HD11 LEU 18 68.307 12.978 21.852
119 HD12 LEU 18 HD12 LEU 18 69.411 14.117 21.082
120 HD13 LEU 18 HD13 LEU 18 70.012 12.993 22.300
121 HD21 LEU 18 HD21 LEU 18 70.188 10.590 21.800
122 HD22 LEU 18 HD22 LEU 18 69.817 9.980 20.188
123 HD23 LEU 18 HD23 LEU 18 68.512 10.478 21.264
124 H THR 19 H THR 19 68.811 8.805 18.583
125 HA THR 19 HA THR 19 66.150 8.324 17.434
126 HB THR 19 HB THR 19 67.955 6.371 18.891
127 HG1 THR 19 HG1 THR 19 69.082 6.324 17.107
128 HG21 THR 19 HG21 THR 19 65.647 5.913 16.994
129 HG22 THR 19 HG22 THR 19 65.608 5.663 18.739
130 HG23 THR 19 HG23 THR 19 66.648 4.660 17.728
131 H ILE 20 H ILE 20 64.810 9.576 18.808
132 HA ILE 20 HA ILE 20 64.873 9.014 21.677
133 HB ILE 20 HB ILE 20 63.051 10.661 21.814
134 HG12 ILE 20 HG12 ILE 20 63.367 10.918 18.815
135 HG13 ILE 20 HG13 ILE 20 62.006 10.138 19.612
136 HG21 ILE 20 HG21 ILE 20 65.321 11.455 21.938
137 HG22 ILE 20 HG22 ILE 20 64.351 12.617 21.037
138 HG23 ILE 20 HG23 ILE 20 65.433 11.520 20.181
139 HD11 ILE 20 HD11 ILE 20 61.509 12.424 18.875
140 HD12 ILE 20 HD12 ILE 20 62.775 13.027 19.945
141 HD13 ILE 20 HD13 ILE 20 61.355 12.227 20.620
142 H ARG 21 H ARG 21 63.491 7.824 22.844
143 HA ARG 21 HA ARG 21 61.276 6.485 21.353
144 HB2 ARG 21 HB2 ARG 21 63.068 5.414 23.541
145 HB3 ARG 21 HB3 ARG 21 61.605 4.602 23.001
146 HG2 ARG 21 HG2 ARG 21 62.506 4.069 20.935
147 HG3 ARG 21 HG3 ARG 21 63.748 5.317 21.041
148 HD2 ARG 21 HD2 ARG 21 63.664 2.952 22.896
149 HD3 ARG 21 HD3 ARG 21 64.503 2.909 21.346
150 HE ARG 21 HE ARG 21 65.375 5.198 22.776
151 HH11 ARG 21 HH11 ARG 21 65.589 1.667 22.926
152 HH12 ARG 21 HH12 ARG 21 67.120 1.675 23.733
153 HH21 ARG 21 HH21 ARG 21 67.389 5.161 23.836
154 HH22 ARG 21 HH22 ARG 21 68.142 3.658 24.251
155 H VAL 22 H VAL 22 59.258 6.453 22.250
156 HA VAL 22 HA VAL 22 58.438 8.447 23.955
157 HB VAL 22 HB VAL 22 57.161 5.710 23.843
158 HG11 VAL 22 HG11 VAL 22 55.077 6.962 24.279
159 HG12 VAL 22 HG12 VAL 22 56.030 8.431 24.488
160 HG13 VAL 22 HG13 VAL 22 56.236 7.080 25.603
161 HG21 VAL 22 HG21 VAL 22 56.948 8.061 21.976
162 HG22 VAL 22 HG22 VAL 22 55.755 6.764 22.033
163 HG23 VAL 22 HG23 VAL 22 57.424 6.407 21.591
164 H GLY 23 H GLY 23 58.730 8.978 26.002
165 HA2 GLY 23 HA2 GLY 23 58.455 8.363 28.332
166 HA3 GLY 23 HA3 GLY 23 59.071 6.762 27.966
167 H GLU 24 H GLU 24 61.220 8.256 26.221
168 HA GLU 24 HA GLU 24 63.160 8.303 28.371
169 HB2 GLU 24 HB2 GLU 24 63.405 8.940 25.432
170 HB3 GLU 24 HB3 GLU 24 64.761 8.866 26.548
171 HG2 GLU 24 HG2 GLU 24 63.995 6.480 27.038
172 HG3 GLU 24 HG3 GLU 24 63.001 6.639 25.591
173 H ILE 25 H ILE 25 64.562 9.981 28.951
174 HA ILE 25 HA ILE 25 63.389 12.693 28.522
175 HB ILE 25 HB ILE 25 65.098 11.744 30.832
176 HG12 ILE 25 HG12 ILE 25 62.862 10.741 30.906
177 HG13 ILE 25 HG13 ILE 25 63.050 11.937 32.184
178 HG21 ILE 25 HG21 ILE 25 64.484 13.908 31.850
179 HG22 ILE 25 HG22 ILE 25 63.696 14.368 30.341
180 HG23 ILE 25 HG23 ILE 25 65.437 14.091 30.378
181 HD11 ILE 25 HD11 ILE 25 61.603 12.351 29.577
182 HD12 ILE 25 HD12 ILE 25 61.789 13.551 30.856
183 HD13 ILE 25 HD13 ILE 25 60.859 12.082 31.153
184 H ILE 26 H ILE 26 64.556 14.132 27.430
185 HA ILE 26 HA ILE 26 67.348 13.373 26.778
186 HB ILE 26 HB ILE 26 65.683 15.546 25.513
187 HG12 ILE 26 HG12 ILE 26 66.183 12.737 24.506
188 HG13 ILE 26 HG13 ILE 26 64.682 13.268 25.256
189 HG21 ILE 26 HG21 ILE 26 67.340 15.328 23.686
190 HG22 ILE 26 HG22 ILE 26 68.246 14.190 24.680
191 HG23 ILE 26 HG23 ILE 26 68.059 15.863 25.204
192 HD11 ILE 26 HD11 ILE 26 65.852 14.154 22.641
193 HD12 ILE 26 HD12 ILE 26 64.508 14.980 23.428
194 HD13 ILE 26 HD13 ILE 26 64.338 13.298 22.926
195 H ARG 27 H ARG 27 69.028 14.325 27.670
196 HA ARG 27 HA ARG 27 68.624 16.426 29.600
197 HB2 ARG 27 HB2 ARG 27 70.273 14.663 29.935
198 HB3 ARG 27 HB3 ARG 27 71.159 15.199 28.516
199 HG2 ARG 27 HG2 ARG 27 71.597 17.350 29.634
200 HG3 ARG 27 HG3 ARG 27 70.772 16.742 31.071
201 HD2 ARG 27 HD2 ARG 27 72.406 14.929 31.238
202 HD3 ARG 27 HD3 ARG 27 73.226 15.533 29.800
203 HE ARG 27 HE ARG 27 73.035 17.595 31.780
204 HH11 ARG 27 HH11 ARG 27 74.787 14.616 31.009
205 HH12 ARG 27 HH12 ARG 27 76.198 15.072 31.902
206 HH21 ARG 27 HH21 ARG 27 74.914 18.156 32.944
207 HH22 ARG 27 HH22 ARG 27 76.270 17.081 33.000
208 H ASN 28 H ASN 28 68.675 18.544 29.391
209 HA ASN 28 HA ASN 28 68.938 20.600 28.465
210 HB2 ASN 28 HB2 ASN 28 71.520 19.433 27.409
211 HB3 ASN 28 HB3 ASN 28 71.149 21.149 27.538
212 HD21 ASN 28 HD21 ASN 28 73.286 19.486 28.742
213 HD22 ASN 28 HD22 ASN 28 73.137 19.769 30.512
214 H VAL 29 H VAL 29 67.060 19.822 27.078
215 HA VAL 29 HA VAL 29 67.765 19.534 24.241
216 HB VAL 29 HB VAL 29 65.081 19.668 25.616
217 HG11 VAL 29 HG11 VAL 29 64.780 20.476 23.389
218 HG12 VAL 29 HG12 VAL 29 64.212 18.807 23.430
219 HG13 VAL 29 HG13 VAL 29 65.783 19.187 22.726
220 HG21 VAL 29 HG21 VAL 29 65.096 17.219 24.790
221 HG22 VAL 29 HG22 VAL 29 66.012 17.640 26.235
222 HG23 VAL 29 HG23 VAL 29 66.842 17.436 24.693
223 H LYS 30 H LYS 30 68.412 21.288 23.201
224 HA LYS 30 HA LYS 30 66.953 23.830 23.740
225 HB2 LYS 30 HB2 LYS 30 69.613 23.515 22.345
226 HB3 LYS 30 HB3 LYS 30 68.890 25.000 22.946
227 HG2 LYS 30 HG2 LYS 30 69.958 22.714 24.590
228 HG3 LYS 30 HG3 LYS 30 70.663 24.321 24.417
229 HD2 LYS 30 HD2 LYS 30 67.950 23.759 25.617
230 HD3 LYS 30 HD3 LYS 30 69.428 23.995 26.550
231 HE2 LYS 30 HE2 LYS 30 68.247 26.016 24.647
232 HE3 LYS 30 HE3 LYS 30 68.025 26.032 26.395
233 HZ1 LYS 30 HZ1 LYS 30 70.595 26.329 24.936
234 HZ2 LYS 30 HZ2 LYS 30 70.459 26.216 26.618
235 HZ3 LYS 30 HZ3 LYS 30 69.778 27.532 25.802
236 H LYS 31 H LYS 31 66.724 25.310 21.838
237 HA LYS 31 HA LYS 31 65.650 23.705 19.608
238 HB2 LYS 31 HB2 LYS 31 64.270 25.494 20.631
239 HB3 LYS 31 HB3 LYS 31 65.458 26.681 20.114
240 HG2 LYS 31 HG2 LYS 31 65.000 26.204 17.798
241 HG3 LYS 31 HG3 LYS 31 63.914 24.890 18.249
242 HD2 LYS 31 HD2 LYS 31 63.494 27.775 19.020
243 HD3 LYS 31 HD3 LYS 31 62.758 27.010 17.610
244 HE2 LYS 31 HE2 LYS 31 61.663 25.378 19.080
245 HE3 LYS 31 HE3 LYS 31 62.387 26.162 20.483
246 HZ1 LYS 31 HZ1 LYS 31 61.170 28.177 19.941
247 HZ2 LYS 31 HZ2 LYS 31 60.106 26.878 20.144
248 HZ3 LYS 31 HZ3 LYS 31 60.480 27.429 18.589
249 H LEU 32 H LEU 32 66.454 23.609 17.602
250 HA LEU 32 HA LEU 32 69.056 24.959 17.181
251 HB2 LEU 32 HB2 LEU 32 67.675 22.704 15.726
252 HB3 LEU 32 HB3 LEU 32 69.211 23.388 15.230
253 HG LEU 32 HG LEU 32 68.732 22.078 17.908
254 HD11 LEU 32 HD11 LEU 32 70.005 20.963 15.412
255 HD12 LEU 32 HD12 LEU 32 68.481 20.443 16.132
256 HD13 LEU 32 HD13 LEU 32 69.996 20.186 16.996
257 HD21 LEU 32 HD21 LEU 32 71.221 23.032 16.499
258 HD22 LEU 32 HD22 LEU 32 71.223 22.024 17.945
259 HD23 LEU 32 HD23 LEU 32 70.541 23.648 18.005
260 H GLN 33 H GLN 33 69.385 25.264 14.589
261 HA GLN 33 HA GLN 33 67.519 27.424 13.957
262 HB2 GLN 33 HB2 GLN 33 69.928 26.358 12.474
263 HB3 GLN 33 HB3 GLN 33 69.013 27.781 11.998
264 HG2 GLN 33 HG2 GLN 33 69.581 28.824 14.165
265 HG3 GLN 33 HG3 GLN 33 70.580 27.423 14.542
266 HE21 GLN 33 HE21 GLN 33 71.580 27.052 11.838
267 HE22 GLN 33 HE22 GLN 33 72.732 28.400 11.554
268 H GLU 34 H GLU 34 67.306 24.160 13.600
269 HA GLU 34 HA GLU 34 66.011 24.321 10.936
270 HB2 GLU 34 HB2 GLU 34 66.760 21.882 12.562
271 HB3 GLU 34 HB3 GLU 34 66.133 21.885 10.921
272 HG2 GLU 34 HG2 GLU 34 68.128 22.891 10.083
273 HG3 GLU 34 HG3 GLU 34 68.741 23.149 11.716
274 H GLU 35 H GLU 35 63.897 24.656 10.931
275 HA GLU 35 HA GLU 35 62.291 24.578 13.258
276 HB2 GLU 35 HB2 GLU 35 61.466 24.362 10.354
277 HB3 GLU 35 HB3 GLU 35 60.364 24.680 11.686
278 HG2 GLU 35 HG2 GLU 35 61.525 26.763 12.169
279 HG3 GLU 35 HG3 GLU 35 62.663 26.440 10.862
280 H GLY 36 H GLY 36 61.601 22.940 14.455
281 HA2 GLY 36 HA2 GLY 36 60.422 20.908 14.748
282 HA3 GLY 36 HA3 GLY 36 60.739 20.472 13.078
283 H TRP 37 H TRP 37 63.501 21.641 14.735
284 HA TRP 37 HA TRP 37 64.276 18.877 15.476
285 HB2 TRP 37 HB2 TRP 37 65.915 20.799 13.814
286 HB3 TRP 37 HB3 TRP 37 66.548 19.318 14.526
287 HD1 TRP 37 HD1 TRP 37 65.189 20.531 11.379
288 HE1 TRP 37 HE1 TRP 37 64.375 18.600 9.849
289 HE3 TRP 37 HE3 TRP 37 65.127 16.795 14.864
290 HZ2 TRP 37 HZ2 TRP 37 63.793 15.848 10.155
291 HZ3 TRP 37 HZ3 TRP 37 64.426 14.543 14.166
292 HH2 TRP 37 HH2 TRP 37 63.772 14.081 11.861
293 H LEU 38 H LEU 38 65.304 18.655 17.319
294 HA LEU 38 HA LEU 38 66.158 21.156 18.710
295 HB2 LEU 38 HB2 LEU 38 64.885 18.689 19.904
296 HB3 LEU 38 HB3 LEU 38 65.514 20.040 20.827
297 HG LEU 38 HG LEU 38 63.213 20.204 18.876
298 HD11 LEU 38 HD11 LEU 38 63.202 20.204 21.891
299 HD12 LEU 38 HD12 LEU 38 62.666 18.878 20.861
300 HD13 LEU 38 HD13 LEU 38 61.800 20.413 20.842
301 HD21 LEU 38 HD21 LEU 38 64.415 22.303 19.051
302 HD22 LEU 38 HD22 LEU 38 64.346 22.222 20.811
303 HD23 LEU 38 HD23 LEU 38 62.863 22.423 19.878
304 H GLU 39 H GLU 39 67.749 20.703 20.510
305 HA GLU 39 HA GLU 39 69.538 18.452 19.718
306 HB2 GLU 39 HB2 GLU 39 70.501 20.508 18.867
307 HB3 GLU 39 HB3 GLU 39 70.328 21.283 20.434
308 HG2 GLU 39 HG2 GLU 39 72.639 20.574 19.905
309 HG3 GLU 39 HG3 GLU 39 72.001 19.880 21.393
310 H GLY 40 H GLY 40 69.880 17.054 21.301
311 HA2 GLY 40 HA2 GLY 40 70.246 18.053 24.042
312 HA3 GLY 40 HA3 GLY 40 68.818 17.063 23.802
313 H GLU 41 H GLU 41 70.785 16.389 25.602
314 HA GLU 41 HA GLU 41 72.383 14.287 24.278
315 HB2 GLU 41 HB2 GLU 41 73.457 15.800 25.927
316 HB3 GLU 41 HB3 GLU 41 72.369 15.191 27.165
317 HG2 GLU 41 HG2 GLU 41 74.153 13.334 25.641
318 HG3 GLU 41 HG3 GLU 41 74.757 14.249 27.020
319 H LEU 42 H LEU 42 71.230 12.554 23.818
320 HA LEU 42 HA LEU 42 69.763 11.284 26.078
321 HB2 LEU 42 HB2 LEU 42 68.143 12.268 24.506
322 HB3 LEU 42 HB3 LEU 42 68.868 11.359 23.195
323 HG LEU 42 HG LEU 42 68.230 9.251 24.415
324 HD11 LEU 42 HD11 LEU 42 67.992 10.234 26.645
325 HD12 LEU 42 HD12 LEU 42 66.528 9.391 26.139
326 HD13 LEU 42 HD13 LEU 42 66.595 11.153 26.086
327 HD21 LEU 42 HD21 LEU 42 65.900 9.334 23.723
328 HD22 LEU 42 HD22 LEU 42 66.935 10.113 22.527
329 HD23 LEU 42 HD23 LEU 42 65.975 11.093 23.635
330 H ASN 43 H ASN 43 69.984 9.111 26.309
331 HA ASN 43 HA ASN 43 70.935 7.050 26.048
332 HB2 ASN 43 HB2 ASN 43 71.291 7.774 23.130
333 HB3 ASN 43 HB3 ASN 43 71.322 6.156 23.818
334 HD21 ASN 43 HD21 ASN 43 69.621 7.371 21.725
335 HD22 ASN 43 HD22 ASN 43 67.937 7.113 22.301
336 H GLY 44 H GLY 44 72.580 9.660 26.388
337 HA2 GLY 44 HA2 GLY 44 74.816 9.834 27.034
338 HA3 GLY 44 HA3 GLY 44 75.156 8.275 26.310
339 H ARG 45 H ARG 45 73.456 10.410 24.254
340 HA ARG 45 HA ARG 45 75.964 11.462 23.105
341 HB2 ARG 45 HB2 ARG 45 75.200 10.803 20.824
342 HB3 ARG 45 HB3 ARG 45 75.625 9.439 21.849
343 HG2 ARG 45 HG2 ARG 45 73.451 8.719 22.031
344 HG3 ARG 45 HG3 ARG 45 72.781 10.322 21.722
345 HD2 ARG 45 HD2 ARG 45 74.213 8.668 19.651
346 HD3 ARG 45 HD3 ARG 45 72.463 8.672 19.867
347 HE ARG 45 HE ARG 45 73.387 11.353 19.571
348 HH11 ARG 45 HH11 ARG 45 72.909 8.389 17.694
349 HH12 ARG 45 HH12 ARG 45 72.674 9.231 16.200
350 HH21 ARG 45 HH21 ARG 45 73.075 12.419 17.583
351 HH22 ARG 45 HH22 ARG 45 72.771 11.517 16.137
352 H ARG 46 H ARG 46 75.732 13.307 21.811
353 HA ARG 46 HA ARG 46 73.201 14.742 22.381
354 HB2 ARG 46 HB2 ARG 46 75.898 15.715 21.404
355 HB3 ARG 46 HB3 ARG 46 74.489 16.751 21.582
356 HG2 ARG 46 HG2 ARG 46 74.430 16.197 23.989
357 HG3 ARG 46 HG3 ARG 46 75.910 15.259 23.778
358 HD2 ARG 46 HD2 ARG 46 75.604 18.205 23.200
359 HD3 ARG 46 HD3 ARG 46 76.345 17.522 24.646
360 HE ARG 46 HE ARG 46 77.751 16.380 22.558
361 HH11 ARG 46 HH11 ARG 46 77.037 19.690 23.595
362 HH12 ARG 46 HH12 ARG 46 78.504 20.338 22.945
363 HH21 ARG 46 HH21 ARG 46 79.669 17.275 21.716
364 HH22 ARG 46 HH22 ARG 46 79.998 18.968 21.875
365 H GLY 47 H GLY 47 71.659 14.713 20.882
366 HA2 GLY 47 HA2 GLY 47 72.538 14.768 18.045
367 HA3 GLY 47 HA3 GLY 47 71.446 13.496 18.561
368 H MET 48 H MET 48 70.373 14.635 16.638
369 HA MET 48 HA MET 48 68.716 16.873 17.684
370 HB2 MET 48 HB2 MET 48 69.251 16.152 14.794
371 HB3 MET 48 HB3 MET 48 68.346 17.545 15.370
372 HG2 MET 48 HG2 MET 48 70.377 18.429 16.407
373 HG3 MET 48 HG3 MET 48 71.280 17.038 15.811
374 HE1 MET 48 HE1 MET 48 72.633 19.933 13.560
375 HE2 MET 48 HE2 MET 48 73.055 18.621 14.660
376 HE3 MET 48 HE3 MET 48 72.188 20.032 15.264
377 H PHE 49 H PHE 49 66.553 16.668 17.778
378 HA PHE 49 HA PHE 49 65.364 14.255 16.514
379 HB2 PHE 49 HB2 PHE 49 64.004 14.068 18.739
380 HB3 PHE 49 HB3 PHE 49 65.630 13.395 18.660
381 HD1 PHE 49 HD2 PHE 49 67.488 14.495 19.779
382 HD2 PHE 49 HD1 PHE 49 63.518 15.994 20.094
383 HE1 PHE 49 HE2 PHE 49 68.173 15.892 21.680
384 HE2 PHE 49 HE1 PHE 49 64.200 17.399 21.995
385 HZ PHE 49 HZ PHE 49 66.529 17.348 22.789
386 HA PRO 50 HA PRO 50 61.997 16.796 15.301
387 HB2 PRO 50 HB2 PRO 50 59.832 15.202 15.953
388 HB3 PRO 50 HB3 PRO 50 60.798 15.046 14.484
389 HG2 PRO 50 HG2 PRO 50 60.953 13.492 17.027
390 HG3 PRO 50 HG3 PRO 50 61.125 12.930 15.356
391 HD2 PRO 50 HD2 PRO 50 63.251 13.293 16.954
392 HD3 PRO 50 HD3 PRO 50 63.321 13.639 15.214
393 H ASP 51 H ASP 51 60.898 18.460 16.116
394 HA ASP 51 HA ASP 51 60.874 18.889 18.949
395 HB2 ASP 51 HB2 ASP 51 61.055 20.703 17.285
396 HB3 ASP 51 HB3 ASP 51 59.401 20.389 16.773
397 H ASN 52 H ASN 52 58.366 17.897 16.626
398 HA ASN 52 HA ASN 52 56.249 18.062 18.608
399 HB2 ASN 52 HB2 ASN 52 56.308 16.768 15.877
400 HB3 ASN 52 HB3 ASN 52 54.861 17.001 16.854
401 HD21 ASN 52 HD21 ASN 52 54.014 19.068 17.164
402 HD22 ASN 52 HD22 ASN 52 54.496 20.431 16.095
403 H PHE 53 H PHE 53 58.757 15.982 18.560
404 HA PHE 53 HA PHE 53 57.098 13.620 19.274
405 HB2 PHE 53 HB2 PHE 53 59.939 13.933 18.356
406 HB3 PHE 53 HB3 PHE 53 59.422 12.476 19.196
407 HD1 PHE 53 HD1 PHE 53 57.876 14.608 16.540
408 HD2 PHE 53 HD2 PHE 53 59.177 10.735 17.730
409 HE1 PHE 53 HE1 PHE 53 57.045 13.682 14.419
410 HE2 PHE 53 HE2 PHE 53 58.348 9.803 15.610
411 HZ PHE 53 HZ PHE 53 57.282 11.277 13.952
412 H VAL 54 H VAL 54 59.197 16.072 20.538
413 HA VAL 54 HA VAL 54 59.201 14.655 23.159
414 HB VAL 54 HB VAL 54 61.174 16.072 23.736
415 HG11 VAL 54 HG11 VAL 54 61.502 13.775 23.077
416 HG12 VAL 54 HG12 VAL 54 62.792 14.768 22.397
417 HG13 VAL 54 HG13 VAL 54 61.464 14.224 21.372
418 HG21 VAL 54 HG21 VAL 54 61.240 16.693 20.784
419 HG22 VAL 54 HG22 VAL 54 62.407 17.206 22.001
420 HG23 VAL 54 HG23 VAL 54 60.761 17.833 22.040
421 H LYS 55 H LYS 55 58.537 15.725 24.976
422 HA LYS 55 HA LYS 55 57.333 18.407 24.471
423 HB2 LYS 55 HB2 LYS 55 55.697 16.599 24.947
424 HB3 LYS 55 HB3 LYS 55 56.486 16.319 26.491
425 HG2 LYS 55 HG2 LYS 55 54.502 17.627 26.832
426 HG3 LYS 55 HG3 LYS 55 55.918 18.623 27.167
427 HD2 LYS 55 HD2 LYS 55 54.322 19.916 25.903
428 HD3 LYS 55 HD3 LYS 55 55.726 19.583 24.888
429 HE2 LYS 55 HE2 LYS 55 54.512 17.749 23.814
430 HE3 LYS 55 HE3 LYS 55 53.112 18.075 24.835
431 HZ1 LYS 55 HZ1 LYS 55 54.281 19.946 22.845
432 HZ2 LYS 55 HZ2 LYS 55 52.945 20.272 23.830
433 HZ3 LYS 55 HZ3 LYS 55 52.851 19.062 22.652
434 H GLU 56 H GLU 56 58.162 20.081 25.543
435 HA GLU 56 HA GLU 56 60.411 19.902 27.176
436 HB2 GLU 56 HB2 GLU 56 59.423 21.969 26.091
437 HB3 GLU 56 HB3 GLU 56 58.317 22.057 27.454
438 HG2 GLU 56 HG2 GLU 56 60.120 22.381 28.986
439 HG3 GLU 56 HG3 GLU 56 61.312 22.071 27.725
440 H ILE 57 H ILE 57 60.866 19.831 29.353
441 HA ILE 57 HA ILE 57 58.735 18.628 30.980
442 HB ILE 57 HB ILE 57 61.620 19.184 31.706
443 HG12 ILE 57 HG12 ILE 57 61.421 17.646 29.784
444 HG13 ILE 57 HG13 ILE 57 62.049 16.834 31.213
445 HG21 ILE 57 HG21 ILE 57 59.536 17.445 33.019
446 HG22 ILE 57 HG22 ILE 57 60.232 18.931 33.665
447 HG23 ILE 57 HG23 ILE 57 61.241 17.499 33.468
448 HD11 ILE 57 HD11 ILE 57 59.804 15.920 31.637
449 HD12 ILE 57 HD12 ILE 57 60.475 15.419 30.086
450 HD13 ILE 57 HD13 ILE 57 59.241 16.677 30.146
451 H LYS 58 H LYS 58 57.300 20.273 31.455
452 HA LYS 58 HA LYS 58 58.379 22.714 32.707
453 HB2 LYS 58 HB2 LYS 58 55.528 21.938 32.051
454 HB3 LYS 58 HB3 LYS 58 56.047 23.510 32.643
455 HG2 LYS 58 HG2 LYS 58 56.840 22.257 30.020
456 HG3 LYS 58 HG3 LYS 58 55.661 23.549 30.243
457 HD2 LYS 58 HD2 LYS 58 58.587 23.727 30.966
458 HD3 LYS 58 HD3 LYS 58 57.867 24.374 29.492
459 HE2 LYS 58 HE2 LYS 58 57.085 25.185 32.290
460 HE3 LYS 58 HE3 LYS 58 58.202 26.079 31.261
461 HZ1 LYS 58 HZ1 LYS 58 56.387 26.325 29.637
462 HZ2 LYS 58 HZ2 LYS 58 56.028 27.050 31.121
463 HZ3 LYS 58 HZ3 LYS 58 55.327 25.566 30.716
Start of MODEL 2
1 H1 VAL 2 H1 VAL 2 67.017 23.240 28.127
2 H2 VAL 2 H2 VAL 2 67.712 22.766 29.594
3 H3 VAL 2 H3 VAL 2 66.964 24.276 29.463
4 HA VAL 2 HA VAL 2 65.584 22.700 30.661
5 HB VAL 2 HB VAL 2 64.491 24.491 29.419
6 HG11 VAL 2 HG11 VAL 2 64.477 22.558 27.107
7 HG12 VAL 2 HG12 VAL 2 65.337 24.095 27.201
8 HG13 VAL 2 HG13 VAL 2 63.575 24.073 27.161
9 HG21 VAL 2 HG21 VAL 2 63.104 22.848 30.599
10 HG22 VAL 2 HG22 VAL 2 62.999 21.886 29.124
11 HG23 VAL 2 HG23 VAL 2 62.286 23.498 29.178
12 H ASP 3 H ASP 3 64.688 20.711 30.911
13 HA ASP 3 HA ASP 3 65.694 18.661 29.068
14 HB2 ASP 3 HB2 ASP 3 65.652 18.549 31.657
15 HB3 ASP 3 HB3 ASP 3 63.952 18.136 31.465
16 H TYR 4 H TYR 4 64.461 17.117 28.005
17 HA TYR 4 HA TYR 4 61.571 17.791 27.685
18 HB2 TYR 4 HB2 TYR 4 63.680 17.472 25.596
19 HB3 TYR 4 HB3 TYR 4 62.058 16.906 25.236
20 HD1 TYR 4 HD2 TYR 4 63.529 19.957 26.855
21 HD2 TYR 4 HD1 TYR 4 60.847 18.370 23.960
22 HE1 TYR 4 HE2 TYR 4 62.878 22.238 26.215
23 HE2 TYR 4 HE1 TYR 4 60.192 20.647 23.310
24 HH TYR 4 HH TYR 4 60.177 22.933 24.350
25 H ILE 5 H ILE 5 60.192 16.064 27.093
26 HA ILE 5 HA ILE 5 61.397 13.393 27.652
27 HB ILE 5 HB ILE 5 59.821 14.076 29.409
28 HG12 ILE 5 HG12 ILE 5 58.632 11.895 27.681
29 HG13 ILE 5 HG13 ILE 5 60.047 11.683 28.707
30 HG21 ILE 5 HG21 ILE 5 58.399 15.569 28.133
31 HG22 ILE 5 HG22 ILE 5 57.428 14.323 28.914
32 HG23 ILE 5 HG23 ILE 5 57.783 14.212 27.191
33 HD11 ILE 5 HD11 ILE 5 57.279 12.401 29.646
34 HD12 ILE 5 HD12 ILE 5 58.696 12.186 30.673
35 HD13 ILE 5 HD13 ILE 5 58.046 10.819 29.770
36 H VAL 6 H VAL 6 61.031 11.732 26.246
37 HA VAL 6 HA VAL 6 60.140 12.529 23.601
38 HB VAL 6 HB VAL 6 60.782 9.747 24.590
39 HG11 VAL 6 HG11 VAL 6 60.669 10.945 21.826
40 HG12 VAL 6 HG12 VAL 6 59.603 9.710 22.495
41 HG13 VAL 6 HG13 VAL 6 61.302 9.341 22.196
42 HG21 VAL 6 HG21 VAL 6 63.038 10.105 23.761
43 HG22 VAL 6 HG22 VAL 6 62.648 11.291 25.006
44 HG23 VAL 6 HG23 VAL 6 62.627 11.759 23.306
45 H GLU 7 H GLU 7 58.157 12.532 22.851
46 HA GLU 7 HA GLU 7 56.128 10.919 24.297
47 HB2 GLU 7 HB2 GLU 7 54.474 12.399 23.156
48 HB3 GLU 7 HB3 GLU 7 55.585 13.266 24.206
49 HG2 GLU 7 HG2 GLU 7 56.898 13.945 22.266
50 HG3 GLU 7 HG3 GLU 7 55.797 13.068 21.209
51 H TYR 8 H TYR 8 57.849 11.173 21.307
52 HA TYR 8 HA TYR 8 56.205 8.936 20.251
53 HB2 TYR 8 HB2 TYR 8 57.042 11.433 18.782
54 HB3 TYR 8 HB3 TYR 8 56.621 9.948 17.936
55 HD1 TYR 8 HD2 TYR 8 54.292 8.949 18.428
56 HD2 TYR 8 HD1 TYR 8 55.375 12.951 19.378
57 HE1 TYR 8 HE2 TYR 8 51.913 9.563 18.524
58 HE2 TYR 8 HE1 TYR 8 53.000 13.578 19.478
59 HH TYR 8 HH TYR 8 50.505 11.326 19.607
60 H ASP 9 H ASP 9 57.294 7.344 19.172
61 HA ASP 9 HA ASP 9 60.166 7.258 19.680
62 HB2 ASP 9 HB2 ASP 9 58.802 5.249 19.984
63 HB3 ASP 9 HB3 ASP 9 58.325 5.295 18.290
64 H TYR 10 H TYR 10 61.779 7.755 18.322
65 HA TYR 10 HA TYR 10 61.074 8.024 15.436
66 HB2 TYR 10 HB2 TYR 10 61.331 10.237 16.619
67 HB3 TYR 10 HB3 TYR 10 63.013 9.812 16.912
68 HD1 TYR 10 HD1 TYR 10 64.574 9.575 14.984
69 HD2 TYR 10 HD2 TYR 10 60.605 11.017 14.486
70 HE1 TYR 10 HE1 TYR 10 65.181 10.470 12.778
71 HE2 TYR 10 HE2 TYR 10 61.202 11.918 12.280
72 HH TYR 10 HH TYR 10 63.243 12.649 11.071
73 H ASP 11 H ASP 11 62.452 7.186 13.969
74 HA ASP 11 HA ASP 11 64.716 5.635 15.081
75 HB2 ASP 11 HB2 ASP 11 63.136 4.446 13.628
76 HB3 ASP 11 HB3 ASP 11 63.445 5.596 12.330
77 H ALA 12 H ALA 12 66.702 6.430 15.056
78 HA ALA 12 HA ALA 12 67.340 8.863 13.695
79 HB1 ALA 12 HB1 ALA 12 68.484 8.205 15.728
80 HB2 ALA 12 HB2 ALA 12 69.644 8.432 14.419
81 HB3 ALA 12 HB3 ALA 12 69.176 6.804 14.910
82 H VAL 13 H VAL 13 67.234 8.968 11.544
83 HA VAL 13 HA VAL 13 68.397 6.777 9.946
84 HB VAL 13 HB VAL 13 67.529 8.000 7.986
85 HG11 VAL 13 HG11 VAL 13 65.148 7.681 8.445
86 HG12 VAL 13 HG12 VAL 13 65.490 7.610 10.174
87 HG13 VAL 13 HG13 VAL 13 66.116 6.359 9.100
88 HG21 VAL 13 HG21 VAL 13 66.480 9.978 10.011
89 HG22 VAL 13 HG22 VAL 13 66.081 9.956 8.293
90 HG23 VAL 13 HG23 VAL 13 67.735 10.282 8.810
91 H HIS 14 H HIS 14 68.961 10.136 10.845
92 HA HIS 14 HA HIS 14 71.315 10.303 9.080
93 HB2 HIS 14 HB2 HIS 14 70.250 12.321 11.073
94 HB3 HIS 14 HB3 HIS 14 71.476 12.614 9.844
95 HD1 HIS 14 HD1 HIS 14 67.830 12.593 10.434
96 HD2 HIS 14 HD2 HIS 14 70.439 12.616 7.150
97 HE1 HIS 14 HE1 HIS 14 66.442 13.265 8.420
98 HE2 HIS 14 HE2 HIS 14 68.026 13.301 6.431
99 H ASP 15 H ASP 15 73.272 11.511 10.284
100 HA ASP 15 HA ASP 15 74.171 9.545 12.233
101 HB2 ASP 15 HB2 ASP 15 75.517 12.035 11.160
102 HB3 ASP 15 HB3 ASP 15 76.294 10.843 12.195
103 H ASP 16 H ASP 16 73.462 13.038 12.237
104 HA ASP 16 HA ASP 16 73.963 13.257 15.092
105 HB2 ASP 16 HB2 ASP 16 73.113 15.552 14.841
106 HB3 ASP 16 HB3 ASP 16 74.315 15.177 13.609
107 H GLU 17 H GLU 17 71.273 12.380 13.082
108 HA GLU 17 HA GLU 17 69.086 13.109 14.640
109 HB2 GLU 17 HB2 GLU 17 69.040 12.000 12.393
110 HB3 GLU 17 HB3 GLU 17 69.404 10.477 13.189
111 HG2 GLU 17 HG2 GLU 17 67.057 10.598 12.742
112 HG3 GLU 17 HG3 GLU 17 67.319 10.686 14.482
113 H LEU 18 H LEU 18 68.355 12.646 16.589
114 HA LEU 18 HA LEU 18 69.761 10.558 18.126
115 HB2 LEU 18 HB2 LEU 18 68.937 13.053 18.798
116 HB3 LEU 18 HB3 LEU 18 67.583 12.108 19.381
117 HG LEU 18 HG LEU 18 70.469 11.766 20.204
118 HD11 LEU 18 HD11 LEU 18 69.736 12.597 22.357
119 HD12 LEU 18 HD12 LEU 18 68.091 12.783 21.752
120 HD13 LEU 18 HD13 LEU 18 69.389 13.780 21.098
121 HD21 LEU 18 HD21 LEU 18 69.513 10.208 21.899
122 HD22 LEU 18 HD22 LEU 18 69.405 9.620 20.241
123 HD23 LEU 18 HD23 LEU 18 67.978 10.284 21.035
124 H THR 19 H THR 19 68.970 8.610 18.576
125 HA THR 19 HA THR 19 66.321 7.928 17.530
126 HB THR 19 HB THR 19 68.148 6.135 19.149
127 HG1 THR 19 HG1 THR 19 69.390 5.965 17.447
128 HG21 THR 19 HG21 THR 19 65.853 5.333 18.841
129 HG22 THR 19 HG22 THR 19 67.001 4.338 17.945
130 HG23 THR 19 HG23 THR 19 66.016 5.528 17.096
131 H ILE 20 H ILE 20 64.923 9.203 18.842
132 HA ILE 20 HA ILE 20 65.042 8.734 21.743
133 HB ILE 20 HB ILE 20 63.374 10.492 21.911
134 HG12 ILE 20 HG12 ILE 20 63.417 10.499 18.883
135 HG13 ILE 20 HG13 ILE 20 62.067 10.006 19.899
136 HG21 ILE 20 HG21 ILE 20 65.535 11.311 19.975
137 HG22 ILE 20 HG22 ILE 20 65.774 11.076 21.704
138 HG23 ILE 20 HG23 ILE 20 64.697 12.346 21.130
139 HD11 ILE 20 HD11 ILE 20 61.822 12.260 18.922
140 HD12 ILE 20 HD12 ILE 20 63.228 12.779 19.852
141 HD13 ILE 20 HD13 ILE 20 61.768 12.246 20.685
142 H ARG 21 H ARG 21 63.598 7.625 22.927
143 HA ARG 21 HA ARG 21 61.340 6.363 21.434
144 HB2 ARG 21 HB2 ARG 21 62.926 5.250 23.761
145 HB3 ARG 21 HB3 ARG 21 61.522 4.479 23.038
146 HG2 ARG 21 HG2 ARG 21 63.222 3.344 22.017
147 HG3 ARG 21 HG3 ARG 21 62.936 4.629 20.845
148 HD2 ARG 21 HD2 ARG 21 64.791 5.903 21.747
149 HD3 ARG 21 HD3 ARG 21 65.045 4.688 22.999
150 HE ARG 21 HE ARG 21 65.181 3.598 20.312
151 HH11 ARG 21 HH11 ARG 21 67.013 5.260 22.846
152 HH12 ARG 21 HH12 ARG 21 68.546 4.697 22.274
153 HH21 ARG 21 HH21 ARG 21 67.222 2.881 19.593
154 HH22 ARG 21 HH22 ARG 21 68.666 3.350 20.427
155 H VAL 22 H VAL 22 59.303 6.410 22.321
156 HA VAL 22 HA VAL 22 58.563 8.507 23.956
157 HB VAL 22 HB VAL 22 57.145 5.840 23.868
158 HG11 VAL 22 HG11 VAL 22 56.264 7.280 25.595
159 HG12 VAL 22 HG12 VAL 22 55.123 7.205 24.253
160 HG13 VAL 22 HG13 VAL 22 56.150 8.624 24.460
161 HG21 VAL 22 HG21 VAL 22 57.485 6.498 21.613
162 HG22 VAL 22 HG22 VAL 22 57.077 8.174 21.971
163 HG23 VAL 22 HG23 VAL 22 55.826 6.933 22.020
164 H GLY 23 H GLY 23 58.766 9.058 26.008
165 HA2 GLY 23 HA2 GLY 23 58.445 8.482 28.343
166 HA3 GLY 23 HA3 GLY 23 59.038 6.866 28.013
167 H GLU 24 H GLU 24 61.231 8.301 26.282
168 HA GLU 24 HA GLU 24 63.148 8.343 28.459
169 HB2 GLU 24 HB2 GLU 24 63.437 8.918 25.511
170 HB3 GLU 24 HB3 GLU 24 64.779 8.871 26.643
171 HG2 GLU 24 HG2 GLU 24 64.067 6.503 27.179
172 HG3 GLU 24 HG3 GLU 24 63.008 6.611 25.773
173 H ILE 25 H ILE 25 64.585 10.023 29.008
174 HA ILE 25 HA ILE 25 63.420 12.729 28.531
175 HB ILE 25 HB ILE 25 64.602 13.396 30.643
176 HG12 ILE 25 HG12 ILE 25 64.841 10.407 31.073
177 HG13 ILE 25 HG13 ILE 25 66.191 11.467 30.680
178 HG21 ILE 25 HG21 ILE 25 62.890 12.503 32.115
179 HG22 ILE 25 HG22 ILE 25 62.510 11.245 30.938
180 HG23 ILE 25 HG23 ILE 25 62.195 12.937 30.553
181 HD11 ILE 25 HD11 ILE 25 65.838 12.689 32.759
182 HD12 ILE 25 HD12 ILE 25 66.112 10.972 33.053
183 HD13 ILE 25 HD13 ILE 25 64.480 11.634 33.149
184 H ILE 26 H ILE 26 64.587 14.181 27.472
185 HA ILE 26 HA ILE 26 67.381 13.420 26.820
186 HB ILE 26 HB ILE 26 65.738 15.606 25.549
187 HG12 ILE 26 HG12 ILE 26 65.741 13.818 23.614
188 HG13 ILE 26 HG13 ILE 26 65.923 12.679 24.943
189 HG21 ILE 26 HG21 ILE 26 68.254 14.206 24.661
190 HG22 ILE 26 HG22 ILE 26 68.151 15.843 25.308
191 HG23 ILE 26 HG23 ILE 26 67.397 15.455 23.763
192 HD11 ILE 26 HD11 ILE 26 63.572 13.160 24.106
193 HD12 ILE 26 HD12 ILE 26 63.730 14.721 24.910
194 HD13 ILE 26 HD13 ILE 26 63.841 13.231 25.846
195 H ARG 27 H ARG 27 69.055 14.409 27.731
196 HA ARG 27 HA ARG 27 68.555 16.555 29.615
197 HB2 ARG 27 HB2 ARG 27 70.188 14.747 30.036
198 HB3 ARG 27 HB3 ARG 27 71.176 15.355 28.716
199 HG2 ARG 27 HG2 ARG 27 71.479 17.467 29.919
200 HG3 ARG 27 HG3 ARG 27 70.501 16.842 31.248
201 HD2 ARG 27 HD2 ARG 27 73.077 15.617 30.264
202 HD3 ARG 27 HD3 ARG 27 72.932 16.672 31.667
203 HE ARG 27 HE ARG 27 71.114 14.518 31.974
204 HH11 ARG 27 HH11 ARG 27 74.600 15.139 31.944
205 HH12 ARG 27 HH12 ARG 27 74.967 13.806 32.984
206 HH21 ARG 27 HH21 ARG 27 71.643 12.773 33.341
207 HH22 ARG 27 HH22 ARG 27 73.291 12.462 33.777
208 H ASN 28 H ASN 28 68.699 18.668 29.365
209 HA ASN 28 HA ASN 28 69.059 20.688 28.402
210 HB2 ASN 28 HB2 ASN 28 71.414 20.079 28.889
211 HB3 ASN 28 HB3 ASN 28 71.558 19.418 27.265
212 HD21 ASN 28 HD21 ASN 28 73.175 20.790 26.619
213 HD22 ASN 28 HD22 ASN 28 72.885 22.546 26.355
214 H VAL 29 H VAL 29 67.114 19.903 27.091
215 HA VAL 29 HA VAL 29 67.753 19.588 24.236
216 HB VAL 29 HB VAL 29 65.112 19.636 25.694
217 HG11 VAL 29 HG11 VAL 29 64.708 20.484 23.499
218 HG12 VAL 29 HG12 VAL 29 64.184 18.801 23.523
219 HG13 VAL 29 HG13 VAL 29 65.718 19.237 22.769
220 HG21 VAL 29 HG21 VAL 29 65.165 17.208 24.798
221 HG22 VAL 29 HG22 VAL 29 66.104 17.621 26.230
222 HG23 VAL 29 HG23 VAL 29 66.902 17.478 24.665
223 H LYS 30 H LYS 30 68.318 21.349 23.167
224 HA LYS 30 HA LYS 30 66.787 23.844 23.735
225 HB2 LYS 30 HB2 LYS 30 69.550 23.462 22.569
226 HB3 LYS 30 HB3 LYS 30 68.732 25.013 22.694
227 HG2 LYS 30 HG2 LYS 30 69.467 23.236 25.013
228 HG3 LYS 30 HG3 LYS 30 70.353 24.672 24.495
229 HD2 LYS 30 HD2 LYS 30 68.426 26.068 24.971
230 HD3 LYS 30 HD3 LYS 30 67.474 24.646 25.403
231 HE2 LYS 30 HE2 LYS 30 69.000 24.189 27.259
232 HE3 LYS 30 HE3 LYS 30 69.954 25.607 26.826
233 HZ1 LYS 30 HZ1 LYS 30 68.043 27.001 27.290
234 HZ2 LYS 30 HZ2 LYS 30 68.428 26.069 28.648
235 HZ3 LYS 30 HZ3 LYS 30 67.108 25.645 27.679
236 H LYS 31 H LYS 31 66.609 25.346 21.829
237 HA LYS 31 HA LYS 31 65.558 23.740 19.583
238 HB2 LYS 31 HB2 LYS 31 65.245 26.658 20.310
239 HB3 LYS 31 HB3 LYS 31 64.573 25.939 18.853
240 HG2 LYS 31 HG2 LYS 31 63.211 24.440 20.203
241 HG3 LYS 31 HG3 LYS 31 63.907 25.122 21.675
242 HD2 LYS 31 HD2 LYS 31 62.962 27.296 21.142
243 HD3 LYS 31 HD3 LYS 31 62.327 26.669 19.620
244 HE2 LYS 31 HE2 LYS 31 60.559 26.764 21.265
245 HE3 LYS 31 HE3 LYS 31 60.927 25.084 20.882
246 HZ1 LYS 31 HZ1 LYS 31 62.204 24.921 22.915
247 HZ2 LYS 31 HZ2 LYS 31 60.634 25.442 23.264
248 HZ3 LYS 31 HZ3 LYS 31 61.913 26.550 23.273
249 H LEU 32 H LEU 32 66.341 23.759 17.543
250 HA LEU 32 HA LEU 32 68.951 25.122 17.210
251 HB2 LEU 32 HB2 LEU 32 67.605 22.951 15.600
252 HB3 LEU 32 HB3 LEU 32 69.173 23.636 15.224
253 HG LEU 32 HG LEU 32 68.525 22.169 17.783
254 HD11 LEU 32 HD11 LEU 32 69.804 20.324 16.853
255 HD12 LEU 32 HD12 LEU 32 70.024 21.214 15.348
256 HD13 LEU 32 HD13 LEU 32 68.412 20.689 15.834
257 HD21 LEU 32 HD21 LEU 32 71.009 22.111 17.990
258 HD22 LEU 32 HD22 LEU 32 70.316 23.728 18.113
259 HD23 LEU 32 HD23 LEU 32 71.102 23.217 16.619
260 H GLN 33 H GLN 33 69.301 25.526 14.628
261 HA GLN 33 HA GLN 33 67.456 27.726 14.090
262 HB2 GLN 33 HB2 GLN 33 68.956 28.272 12.247
263 HB3 GLN 33 HB3 GLN 33 69.870 27.998 13.721
264 HG2 GLN 33 HG2 GLN 33 70.470 25.766 12.948
265 HG3 GLN 33 HG3 GLN 33 69.528 26.014 11.480
266 HE21 GLN 33 HE21 GLN 33 72.425 26.843 13.248
267 HE22 GLN 33 HE22 GLN 33 73.274 27.620 11.867
268 H GLU 34 H GLU 34 67.204 24.488 13.579
269 HA GLU 34 HA GLU 34 65.876 24.820 10.944
270 HB2 GLU 34 HB2 GLU 34 66.804 22.328 12.384
271 HB3 GLU 34 HB3 GLU 34 65.958 22.339 10.843
272 HG2 GLU 34 HG2 GLU 34 67.781 23.454 9.775
273 HG3 GLU 34 HG3 GLU 34 68.606 23.684 11.316
274 H GLU 35 H GLU 35 63.751 24.957 10.892
275 HA GLU 35 HA GLU 35 62.165 24.828 13.240
276 HB2 GLU 35 HB2 GLU 35 61.523 26.083 11.222
277 HB3 GLU 35 HB3 GLU 35 61.299 24.574 10.350
278 HG2 GLU 35 HG2 GLU 35 59.508 23.962 11.928
279 HG3 GLU 35 HG3 GLU 35 59.706 25.523 12.720
280 H GLY 36 H GLY 36 61.571 23.152 14.431
281 HA2 GLY 36 HA2 GLY 36 60.431 21.092 14.714
282 HA3 GLY 36 HA3 GLY 36 60.744 20.677 13.038
283 H TRP 37 H TRP 37 63.533 21.890 14.581
284 HA TRP 37 HA TRP 37 64.370 19.133 15.306
285 HB2 TRP 37 HB2 TRP 37 65.884 21.144 13.640
286 HB3 TRP 37 HB3 TRP 37 66.634 19.723 14.360
287 HD1 TRP 37 HD1 TRP 37 65.249 20.774 11.195
288 HE1 TRP 37 HE1 TRP 37 64.517 18.775 9.711
289 HE3 TRP 37 HE3 TRP 37 65.262 17.136 14.784
290 HZ2 TRP 37 HZ2 TRP 37 64.021 16.014 10.090
291 HZ3 TRP 37 HZ3 TRP 37 64.644 14.844 14.143
292 HH2 TRP 37 HH2 TRP 37 64.037 14.296 11.844
293 H LEU 38 H LEU 38 65.292 18.898 17.190
294 HA LEU 38 HA LEU 38 66.254 21.357 18.585
295 HB2 LEU 38 HB2 LEU 38 64.660 19.035 19.655
296 HB3 LEU 38 HB3 LEU 38 65.570 20.102 20.705
297 HG LEU 38 HG LEU 38 64.215 22.017 19.762
298 HD11 LEU 38 HD11 LEU 38 62.704 19.716 18.554
299 HD12 LEU 38 HD12 LEU 38 63.371 21.132 17.741
300 HD13 LEU 38 HD13 LEU 38 61.988 21.305 18.818
301 HD21 LEU 38 HD21 LEU 38 63.754 21.135 21.956
302 HD22 LEU 38 HD22 LEU 38 62.803 19.820 21.266
303 HD23 LEU 38 HD23 LEU 38 62.232 21.485 21.137
304 H GLU 39 H GLU 39 67.745 20.774 20.467
305 HA GLU 39 HA GLU 39 69.456 18.464 19.671
306 HB2 GLU 39 HB2 GLU 39 70.403 20.661 18.930
307 HB3 GLU 39 HB3 GLU 39 70.469 21.152 20.615
308 HG2 GLU 39 HG2 GLU 39 72.640 20.422 19.894
309 HG3 GLU 39 HG3 GLU 39 71.999 19.285 21.079
310 H GLY 40 H GLY 40 69.767 17.031 21.251
311 HA2 GLY 40 HA2 GLY 40 70.080 17.995 24.011
312 HA3 GLY 40 HA3 GLY 40 68.645 17.029 23.726
313 H GLU 41 H GLU 41 70.546 16.312 25.573
314 HA GLU 41 HA GLU 41 72.144 14.174 24.287
315 HB2 GLU 41 HB2 GLU 41 72.114 15.065 27.176
316 HB3 GLU 41 HB3 GLU 41 73.283 13.991 26.421
317 HG2 GLU 41 HG2 GLU 41 74.260 15.733 25.197
318 HG3 GLU 41 HG3 GLU 41 72.899 16.815 25.490
319 H LEU 42 H LEU 42 70.966 12.423 23.872
320 HA LEU 42 HA LEU 42 69.467 11.267 26.171
321 HB2 LEU 42 HB2 LEU 42 67.903 12.200 24.487
322 HB3 LEU 42 HB3 LEU 42 68.607 11.137 23.283
323 HG LEU 42 HG LEU 42 67.873 9.183 24.635
324 HD11 LEU 42 HD11 LEU 42 67.786 10.465 26.791
325 HD12 LEU 42 HD12 LEU 42 66.404 9.419 26.474
326 HD13 LEU 42 HD13 LEU 42 66.266 11.161 26.228
327 HD21 LEU 42 HD21 LEU 42 65.783 11.138 23.706
328 HD22 LEU 42 HD22 LEU 42 65.433 9.469 24.152
329 HD23 LEU 42 HD23 LEU 42 66.505 9.812 22.795
330 H ASN 43 H ASN 43 69.717 9.139 26.564
331 HA ASN 43 HA ASN 43 70.689 7.079 26.469
332 HB2 ASN 43 HB2 ASN 43 70.636 7.651 23.505
333 HB3 ASN 43 HB3 ASN 43 71.208 6.124 24.164
334 HD21 ASN 43 HD21 ASN 43 69.762 4.754 25.281
335 HD22 ASN 43 HD22 ASN 43 67.993 4.897 25.001
336 H GLY 44 H GLY 44 72.333 9.647 26.624
337 HA2 GLY 44 HA2 GLY 44 74.587 9.880 27.149
338 HA3 GLY 44 HA3 GLY 44 74.904 8.275 26.521
339 H ARG 45 H ARG 45 73.139 10.216 24.353
340 HA ARG 45 HA ARG 45 75.629 11.148 23.047
341 HB2 ARG 45 HB2 ARG 45 74.714 10.433 20.850
342 HB3 ARG 45 HB3 ARG 45 75.083 9.084 21.915
343 HG2 ARG 45 HG2 ARG 45 72.857 8.571 22.261
344 HG3 ARG 45 HG3 ARG 45 72.311 10.191 21.826
345 HD2 ARG 45 HD2 ARG 45 73.518 8.219 19.891
346 HD3 ARG 45 HD3 ARG 45 71.786 8.454 20.123
347 HE ARG 45 HE ARG 45 72.816 10.988 19.591
348 HH11 ARG 45 HH11 ARG 45 72.667 7.866 17.926
349 HH12 ARG 45 HH12 ARG 45 72.673 8.575 16.347
350 HH21 ARG 45 HH21 ARG 45 72.825 11.876 17.499
351 HH22 ARG 45 HH22 ARG 45 72.765 10.851 16.104
352 H ARG 46 H ARG 46 75.455 13.016 21.827
353 HA ARG 46 HA ARG 46 73.000 14.559 22.431
354 HB2 ARG 46 HB2 ARG 46 75.377 15.459 22.830
355 HB3 ARG 46 HB3 ARG 46 75.499 15.590 21.080
356 HG2 ARG 46 HG2 ARG 46 73.178 16.883 21.472
357 HG3 ARG 46 HG3 ARG 46 73.980 17.224 23.005
358 HD2 ARG 46 HD2 ARG 46 74.497 18.985 21.459
359 HD3 ARG 46 HD3 ARG 46 75.954 18.031 21.735
360 HE ARG 46 HE ARG 46 74.799 16.895 19.491
361 HH11 ARG 46 HH11 ARG 46 75.901 20.139 20.385
362 HH12 ARG 46 HH12 ARG 46 76.302 20.579 18.760
363 HH21 ARG 46 HH21 ARG 46 75.341 17.516 17.369
364 HH22 ARG 46 HH22 ARG 46 75.988 19.090 17.048
365 H GLY 47 H GLY 47 71.402 14.530 20.966
366 HA2 GLY 47 HA2 GLY 47 72.214 14.527 18.119
367 HA3 GLY 47 HA3 GLY 47 71.182 13.224 18.668
368 H MET 48 H MET 48 70.704 15.122 16.616
369 HA MET 48 HA MET 48 68.750 17.012 17.643
370 HB2 MET 48 HB2 MET 48 70.138 17.500 15.661
371 HB3 MET 48 HB3 MET 48 69.395 16.154 14.812
372 HG2 MET 48 HG2 MET 48 67.192 17.347 15.118
373 HG3 MET 48 HG3 MET 48 68.130 18.742 15.645
374 HE1 MET 48 HE1 MET 48 70.724 18.331 13.844
375 HE2 MET 48 HE2 MET 48 70.016 19.937 14.000
376 HE3 MET 48 HE3 MET 48 70.381 19.285 12.402
377 H PHE 49 H PHE 49 66.546 16.855 17.640
378 HA PHE 49 HA PHE 49 65.359 14.434 16.414
379 HB2 PHE 49 HB2 PHE 49 63.943 14.301 18.625
380 HB3 PHE 49 HB3 PHE 49 65.527 13.539 18.540
381 HD1 PHE 49 HD1 PHE 49 63.750 16.574 19.703
382 HD2 PHE 49 HD2 PHE 49 67.244 14.165 19.993
383 HE1 PHE 49 HE1 PHE 49 64.494 17.890 21.643
384 HE2 PHE 49 HE2 PHE 49 67.992 15.476 21.933
385 HZ PHE 49 HZ PHE 49 66.616 17.341 22.760
386 HA PRO 50 HA PRO 50 62.029 16.987 15.167
387 HB2 PRO 50 HB2 PRO 50 60.092 15.032 16.245
388 HB3 PRO 50 HB3 PRO 50 60.310 15.603 14.590
389 HG2 PRO 50 HG2 PRO 50 61.071 13.146 15.314
390 HG3 PRO 50 HG3 PRO 50 62.013 14.100 14.152
391 HD2 PRO 50 HD2 PRO 50 62.535 13.588 17.056
392 HD3 PRO 50 HD3 PRO 50 63.678 13.645 15.697
393 H ASP 51 H ASP 51 60.675 18.569 15.854
394 HA ASP 51 HA ASP 51 60.753 19.256 18.634
395 HB2 ASP 51 HB2 ASP 51 60.654 20.963 16.908
396 HB3 ASP 51 HB3 ASP 51 59.080 20.379 16.377
397 H ASN 52 H ASN 52 58.237 17.779 16.588
398 HA ASN 52 HA ASN 52 56.321 17.860 18.808
399 HB2 ASN 52 HB2 ASN 52 54.742 16.887 17.256
400 HB3 ASN 52 HB3 ASN 52 55.593 18.209 16.467
401 HD21 ASN 52 HD21 ASN 52 54.969 14.805 16.551
402 HD22 ASN 52 HD22 ASN 52 55.840 14.404 15.030
403 H PHE 53 H PHE 53 58.952 16.068 18.538
404 HA PHE 53 HA PHE 53 57.621 13.513 19.271
405 HB2 PHE 53 HB2 PHE 53 60.293 14.182 18.105
406 HB3 PHE 53 HB3 PHE 53 60.129 12.723 19.075
407 HD1 PHE 53 HD1 PHE 53 58.234 14.446 16.349
408 HD2 PHE 53 HD2 PHE 53 59.760 10.794 17.911
409 HE1 PHE 53 HE1 PHE 53 57.348 13.243 14.396
410 HE2 PHE 53 HE2 PHE 53 58.875 9.587 15.961
411 HZ PHE 53 HZ PHE 53 57.668 10.811 14.200
412 H VAL 54 H VAL 54 59.574 16.147 20.428
413 HA VAL 54 HA VAL 54 59.809 14.763 23.053
414 HB VAL 54 HB VAL 54 61.633 16.387 23.557
415 HG11 VAL 54 HG11 VAL 54 62.127 14.696 21.110
416 HG12 VAL 54 HG12 VAL 54 62.114 14.111 22.773
417 HG13 VAL 54 HG13 VAL 54 63.342 15.265 22.253
418 HG21 VAL 54 HG21 VAL 54 61.463 17.064 20.620
419 HG22 VAL 54 HG22 VAL 54 62.664 17.658 21.765
420 HG23 VAL 54 HG23 VAL 54 60.975 18.126 21.940
421 H LYS 55 H LYS 55 58.996 15.731 24.862
422 HA LYS 55 HA LYS 55 57.561 18.302 24.387
423 HB2 LYS 55 HB2 LYS 55 56.003 16.465 24.724
424 HB3 LYS 55 HB3 LYS 55 56.832 15.992 26.199
425 HG2 LYS 55 HG2 LYS 55 54.787 17.164 26.721
426 HG3 LYS 55 HG3 LYS 55 56.180 18.117 27.235
427 HD2 LYS 55 HD2 LYS 55 55.983 19.481 25.203
428 HD3 LYS 55 HD3 LYS 55 54.578 18.532 24.710
429 HE2 LYS 55 HE2 LYS 55 53.388 19.252 26.723
430 HE3 LYS 55 HE3 LYS 55 54.793 20.194 27.219
431 HZ1 LYS 55 HZ1 LYS 55 53.130 21.585 26.163
432 HZ2 LYS 55 HZ2 LYS 55 53.190 20.644 24.758
433 HZ3 LYS 55 HZ3 LYS 55 54.541 21.546 25.230
434 H GLU 56 H GLU 56 58.235 20.001 25.519
435 HA GLU 56 HA GLU 56 60.401 19.888 27.300
436 HB2 GLU 56 HB2 GLU 56 59.556 21.935 26.146
437 HB3 GLU 56 HB3 GLU 56 58.214 21.978 27.282
438 HG2 GLU 56 HG2 GLU 56 59.755 22.286 29.129
439 HG3 GLU 56 HG3 GLU 56 61.124 22.171 28.026
440 H ILE 57 H ILE 57 60.680 19.504 29.428
441 HA ILE 57 HA ILE 57 58.266 18.661 30.913
442 HB ILE 57 HB ILE 57 61.162 18.395 31.743
443 HG12 ILE 57 HG12 ILE 57 59.360 16.352 30.417
444 HG13 ILE 57 HG13 ILE 57 60.701 17.183 29.634
445 HG21 ILE 57 HG21 ILE 57 60.324 16.735 33.317
446 HG22 ILE 57 HG22 ILE 57 58.678 17.005 32.745
447 HG23 ILE 57 HG23 ILE 57 59.542 18.293 33.583
448 HD11 ILE 57 HD11 ILE 57 60.865 15.233 31.916
449 HD12 ILE 57 HD12 ILE 57 62.231 16.150 31.285
450 HD13 ILE 57 HD13 ILE 57 61.401 14.985 30.255
451 H LYS 58 H LYS 58 57.528 20.903 31.037
452 HA LYS 58 HA LYS 58 59.042 22.769 32.661
453 HB2 LYS 58 HB2 LYS 58 57.474 23.499 30.899
454 HB3 LYS 58 HB3 LYS 58 56.134 22.843 31.829
455 HG2 LYS 58 HG2 LYS 58 56.575 24.433 33.616
456 HG3 LYS 58 HG3 LYS 58 57.953 25.074 32.720
457 HD2 LYS 58 HD2 LYS 58 55.097 25.094 31.742
458 HD3 LYS 58 HD3 LYS 58 55.908 26.461 32.507
459 HE2 LYS 58 HE2 LYS 58 56.789 25.111 29.954
460 HE3 LYS 58 HE3 LYS 58 55.890 26.623 30.047
461 HZ1 LYS 58 HZ1 LYS 58 58.205 27.093 29.747
462 HZ2 LYS 58 HZ2 LYS 58 58.635 26.131 31.070
463 HZ3 LYS 58 HZ3 LYS 58 57.768 27.563 31.313
Start of MODEL 3
1 H1 VAL 2 H1 VAL 2 66.805 23.442 28.002
2 H2 VAL 2 H2 VAL 2 67.650 22.966 29.386
3 H3 VAL 2 H3 VAL 2 66.811 24.433 29.375
4 HA VAL 2 HA VAL 2 65.640 22.716 30.627
5 HB VAL 2 HB VAL 2 63.440 22.885 29.424
6 HG11 VAL 2 HG11 VAL 2 64.194 24.594 31.007
7 HG12 VAL 2 HG12 VAL 2 63.233 25.293 29.704
8 HG13 VAL 2 HG13 VAL 2 64.988 25.459 29.692
9 HG21 VAL 2 HG21 VAL 2 65.058 24.420 27.389
10 HG22 VAL 2 HG22 VAL 2 63.302 24.260 27.417
11 HG23 VAL 2 HG23 VAL 2 64.311 22.844 27.131
12 H ASP 3 H ASP 3 64.656 20.720 30.780
13 HA ASP 3 HA ASP 3 65.667 18.775 28.820
14 HB2 ASP 3 HB2 ASP 3 64.403 18.583 31.535
15 HB3 ASP 3 HB3 ASP 3 64.502 17.161 30.501
16 H TYR 4 H TYR 4 64.339 17.101 27.908
17 HA TYR 4 HA TYR 4 61.483 17.885 27.596
18 HB2 TYR 4 HB2 TYR 4 63.541 17.484 25.469
19 HB3 TYR 4 HB3 TYR 4 61.893 16.971 25.146
20 HD1 TYR 4 HD2 TYR 4 63.582 19.975 26.630
21 HD2 TYR 4 HD1 TYR 4 60.627 18.472 23.967
22 HE1 TYR 4 HE2 TYR 4 62.997 22.273 25.990
23 HE2 TYR 4 HE1 TYR 4 60.035 20.767 23.317
24 HH TYR 4 HH TYR 4 61.947 23.426 24.009
25 H ILE 5 H ILE 5 60.039 16.209 27.068
26 HA ILE 5 HA ILE 5 61.145 13.511 27.687
27 HB ILE 5 HB ILE 5 59.505 14.270 29.350
28 HG12 ILE 5 HG12 ILE 5 58.381 12.094 27.571
29 HG13 ILE 5 HG13 ILE 5 59.666 11.868 28.751
30 HG21 ILE 5 HG21 ILE 5 57.117 14.521 28.675
31 HG22 ILE 5 HG22 ILE 5 57.647 14.526 26.993
32 HG23 ILE 5 HG23 ILE 5 58.177 15.800 28.088
33 HD11 ILE 5 HD11 ILE 5 58.134 12.446 30.547
34 HD12 ILE 5 HD12 ILE 5 57.518 11.098 29.593
35 HD13 ILE 5 HD13 ILE 5 56.847 12.713 29.372
36 H VAL 6 H VAL 6 60.762 11.822 26.316
37 HA VAL 6 HA VAL 6 59.976 12.626 23.617
38 HB VAL 6 HB VAL 6 60.720 9.874 24.619
39 HG11 VAL 6 HG11 VAL 6 60.604 11.069 21.855
40 HG12 VAL 6 HG12 VAL 6 59.596 9.774 22.501
41 HG13 VAL 6 HG13 VAL 6 61.318 9.503 22.233
42 HG21 VAL 6 HG21 VAL 6 62.976 10.330 23.878
43 HG22 VAL 6 HG22 VAL 6 62.492 11.537 25.069
44 HG23 VAL 6 HG23 VAL 6 62.509 11.948 23.354
45 H GLU 7 H GLU 7 57.978 12.621 22.895
46 HA GLU 7 HA GLU 7 56.010 10.861 24.253
47 HB2 GLU 7 HB2 GLU 7 55.476 13.160 22.362
48 HB3 GLU 7 HB3 GLU 7 54.298 12.320 23.361
49 HG2 GLU 7 HG2 GLU 7 56.569 14.022 24.369
50 HG3 GLU 7 HG3 GLU 7 54.875 14.501 24.280
51 H TYR 8 H TYR 8 57.757 11.287 21.303
52 HA TYR 8 HA TYR 8 56.137 9.108 20.088
53 HB2 TYR 8 HB2 TYR 8 57.237 11.559 18.695
54 HB3 TYR 8 HB3 TYR 8 56.564 10.163 17.861
55 HD1 TYR 8 HD1 TYR 8 55.736 12.914 20.205
56 HD2 TYR 8 HD2 TYR 8 54.233 9.942 17.559
57 HE1 TYR 8 HE1 TYR 8 53.494 13.906 20.375
58 HE2 TYR 8 HE2 TYR 8 51.986 10.926 17.720
59 HH TYR 8 HH TYR 8 51.391 13.968 18.962
60 H ASP 9 H ASP 9 57.248 7.476 19.128
61 HA ASP 9 HA ASP 9 60.075 7.310 19.760
62 HB2 ASP 9 HB2 ASP 9 58.476 5.367 19.803
63 HB3 ASP 9 HB3 ASP 9 58.439 5.431 18.044
64 H TYR 10 H TYR 10 61.787 7.806 18.547
65 HA TYR 10 HA TYR 10 61.284 8.366 15.660
66 HB2 TYR 10 HB2 TYR 10 61.772 10.391 17.044
67 HB3 TYR 10 HB3 TYR 10 63.330 9.686 17.458
68 HD1 TYR 10 HD2 TYR 10 61.289 10.846 14.573
69 HD2 TYR 10 HD1 TYR 10 65.184 10.007 16.062
70 HE1 TYR 10 HE2 TYR 10 62.271 11.856 12.558
71 HE2 TYR 10 HE1 TYR 10 66.176 11.017 14.055
72 HH TYR 10 HH TYR 10 65.584 11.544 11.766
73 H ASP 11 H ASP 11 62.525 7.360 14.192
74 HA ASP 11 HA ASP 11 64.506 5.439 15.253
75 HB2 ASP 11 HB2 ASP 11 64.397 4.398 13.048
76 HB3 ASP 11 HB3 ASP 11 62.774 4.620 13.693
77 H ALA 12 H ALA 12 66.603 5.186 14.311
78 HA ALA 12 HA ALA 12 67.944 7.681 13.961
79 HB1 ALA 12 HB1 ALA 12 68.939 4.916 13.269
80 HB2 ALA 12 HB2 ALA 12 69.013 5.650 14.871
81 HB3 ALA 12 HB3 ALA 12 69.926 6.354 13.537
82 H VAL 13 H VAL 13 67.918 8.968 12.270
83 HA VAL 13 HA VAL 13 67.479 7.744 9.588
84 HB VAL 13 HB VAL 13 67.008 10.606 10.449
85 HG11 VAL 13 HG11 VAL 13 66.408 9.198 7.850
86 HG12 VAL 13 HG12 VAL 13 67.602 10.470 8.106
87 HG13 VAL 13 HG13 VAL 13 65.884 10.829 8.266
88 HG21 VAL 13 HG21 VAL 13 64.613 10.051 10.174
89 HG22 VAL 13 HG22 VAL 13 65.380 9.146 11.477
90 HG23 VAL 13 HG23 VAL 13 65.059 8.362 9.930
91 H HIS 14 H HIS 14 69.588 9.686 11.577
92 HA HIS 14 HA HIS 14 71.660 9.547 9.501
93 HB2 HIS 14 HB2 HIS 14 70.719 12.169 10.687
94 HB3 HIS 14 HB3 HIS 14 72.225 11.973 9.802
95 HD1 HIS 14 HD1 HIS 14 68.717 12.809 9.360
96 HD2 HIS 14 HD2 HIS 14 71.745 11.095 7.019
97 HE1 HIS 14 HE1 HIS 14 67.952 12.994 6.948
98 HE2 HIS 14 HE2 HIS 14 69.787 11.956 5.528
99 H ASP 15 H ASP 15 73.710 10.798 10.524
100 HA ASP 15 HA ASP 15 74.266 9.301 12.952
101 HB2 ASP 15 HB2 ASP 15 75.921 11.336 11.437
102 HB3 ASP 15 HB3 ASP 15 76.510 10.376 12.791
103 H ASP 16 H ASP 16 73.376 12.594 12.134
104 HA ASP 16 HA ASP 16 73.939 13.503 14.887
105 HB2 ASP 16 HB2 ASP 16 73.375 15.734 14.045
106 HB3 ASP 16 HB3 ASP 16 74.578 14.965 13.013
107 H GLU 17 H GLU 17 71.553 11.718 13.630
108 HA GLU 17 HA GLU 17 69.341 13.266 14.828
109 HB2 GLU 17 HB2 GLU 17 69.409 10.767 13.142
110 HB3 GLU 17 HB3 GLU 17 67.942 11.364 13.902
111 HG2 GLU 17 HG2 GLU 17 69.608 12.783 11.839
112 HG3 GLU 17 HG3 GLU 17 68.011 12.073 11.608
113 H LEU 18 H LEU 18 68.412 12.794 16.723
114 HA LEU 18 HA LEU 18 69.696 10.666 18.299
115 HB2 LEU 18 HB2 LEU 18 68.728 13.199 18.890
116 HB3 LEU 18 HB3 LEU 18 67.543 12.122 19.602
117 HG LEU 18 HG LEU 18 70.500 12.179 20.192
118 HD11 LEU 18 HD11 LEU 18 69.785 12.844 22.424
119 HD12 LEU 18 HD12 LEU 18 68.102 12.827 21.899
120 HD13 LEU 18 HD13 LEU 18 69.230 13.994 21.209
121 HD21 LEU 18 HD21 LEU 18 68.364 10.364 21.307
122 HD22 LEU 18 HD22 LEU 18 70.043 10.441 21.840
123 HD23 LEU 18 HD23 LEU 18 69.661 9.883 20.212
124 H THR 19 H THR 19 68.900 8.719 18.603
125 HA THR 19 HA THR 19 66.229 8.099 17.568
126 HB THR 19 HB THR 19 68.189 6.273 18.988
127 HG1 THR 19 HG1 THR 19 69.267 6.637 17.176
128 HG21 THR 19 HG21 THR 19 65.861 5.628 17.170
129 HG22 THR 19 HG22 THR 19 65.862 5.451 18.925
130 HG23 THR 19 HG23 THR 19 66.941 4.464 17.940
131 H ILE 20 H ILE 20 64.909 9.336 18.957
132 HA ILE 20 HA ILE 20 65.035 8.740 21.834
133 HB ILE 20 HB ILE 20 63.334 10.482 22.063
134 HG12 ILE 20 HG12 ILE 20 63.485 10.695 19.045
135 HG13 ILE 20 HG13 ILE 20 62.115 10.071 19.957
136 HG21 ILE 20 HG21 ILE 20 64.679 12.391 21.171
137 HG22 ILE 20 HG22 ILE 20 65.699 11.213 20.347
138 HG23 ILE 20 HG23 ILE 20 65.603 11.218 22.107
139 HD11 ILE 20 HD11 ILE 20 61.747 12.242 20.947
140 HD12 ILE 20 HD12 ILE 20 61.776 12.369 19.188
141 HD13 ILE 20 HD13 ILE 20 63.175 12.881 20.132
142 H ARG 21 H ARG 21 63.477 7.720 23.029
143 HA ARG 21 HA ARG 21 61.265 6.473 21.457
144 HB2 ARG 21 HB2 ARG 21 62.746 5.290 23.816
145 HB3 ARG 21 HB3 ARG 21 61.396 4.542 22.980
146 HG2 ARG 21 HG2 ARG 21 63.180 3.452 22.042
147 HG3 ARG 21 HG3 ARG 21 62.928 4.759 20.885
148 HD2 ARG 21 HD2 ARG 21 65.286 4.537 21.374
149 HD3 ARG 21 HD3 ARG 21 64.683 6.063 22.013
150 HE ARG 21 HE ARG 21 64.826 3.743 23.843
151 HH11 ARG 21 HH11 ARG 21 66.147 6.865 22.799
152 HH12 ARG 21 HH12 ARG 21 67.067 7.091 24.247
153 HH21 ARG 21 HH21 ARG 21 66.053 4.089 25.728
154 HH22 ARG 21 HH22 ARG 21 67.014 5.517 25.908
155 H VAL 22 H VAL 22 59.220 6.409 22.348
156 HA VAL 22 HA VAL 22 58.425 8.530 23.946
157 HB VAL 22 HB VAL 22 57.036 5.849 23.842
158 HG11 VAL 22 HG11 VAL 22 56.111 7.288 25.546
159 HG12 VAL 22 HG12 VAL 22 54.994 7.202 24.183
160 HG13 VAL 22 HG13 VAL 22 56.008 8.628 24.404
161 HG21 VAL 22 HG21 VAL 22 56.966 8.179 21.934
162 HG22 VAL 22 HG22 VAL 22 55.745 6.908 21.961
163 HG23 VAL 22 HG23 VAL 22 57.422 6.511 21.589
164 H GLY 23 H GLY 23 58.586 9.090 25.998
165 HA2 GLY 23 HA2 GLY 23 58.232 8.548 28.327
166 HA3 GLY 23 HA3 GLY 23 58.799 6.918 28.025
167 H GLU 24 H GLU 24 61.056 8.337 26.326
168 HA GLU 24 HA GLU 24 62.903 8.372 28.568
169 HB2 GLU 24 HB2 GLU 24 63.140 8.531 25.594
170 HB3 GLU 24 HB3 GLU 24 64.504 9.016 26.589
171 HG2 GLU 24 HG2 GLU 24 64.502 6.634 25.771
172 HG3 GLU 24 HG3 GLU 24 64.749 6.866 27.500
173 H ILE 25 H ILE 25 64.441 10.022 29.001
174 HA ILE 25 HA ILE 25 63.319 12.746 28.510
175 HB ILE 25 HB ILE 25 64.985 11.813 30.857
176 HG12 ILE 25 HG12 ILE 25 62.699 10.932 30.949
177 HG13 ILE 25 HG13 ILE 25 62.942 12.160 32.185
178 HG21 ILE 25 HG21 ILE 25 63.723 14.490 30.271
179 HG22 ILE 25 HG22 ILE 25 65.448 14.125 30.329
180 HG23 ILE 25 HG23 ILE 25 64.478 14.039 31.799
181 HD11 ILE 25 HD11 ILE 25 61.535 12.559 29.555
182 HD12 ILE 25 HD12 ILE 25 61.774 13.790 30.795
183 HD13 ILE 25 HD13 ILE 25 60.768 12.382 31.134
184 H ILE 26 H ILE 26 64.524 14.170 27.444
185 HA ILE 26 HA ILE 26 67.292 13.329 26.776
186 HB ILE 26 HB ILE 26 65.682 15.530 25.491
187 HG12 ILE 26 HG12 ILE 26 66.071 12.679 24.551
188 HG13 ILE 26 HG13 ILE 26 64.586 13.310 25.254
189 HG21 ILE 26 HG21 ILE 26 68.093 15.725 25.195
190 HG22 ILE 26 HG22 ILE 26 67.312 15.294 23.675
191 HG23 ILE 26 HG23 ILE 26 68.166 14.064 24.607
192 HD11 ILE 26 HD11 ILE 26 65.845 14.037 22.632
193 HD12 ILE 26 HD12 ILE 26 64.544 14.975 23.367
194 HD13 ILE 26 HD13 ILE 26 64.275 13.289 22.923
195 H ARG 27 H ARG 27 69.009 14.268 27.622
196 HA ARG 27 HA ARG 27 68.697 16.337 29.588
197 HB2 ARG 27 HB2 ARG 27 71.177 15.175 28.323
198 HB3 ARG 27 HB3 ARG 27 71.172 16.243 29.719
199 HG2 ARG 27 HG2 ARG 27 70.010 14.613 31.037
200 HG3 ARG 27 HG3 ARG 27 69.795 13.568 29.631
201 HD2 ARG 27 HD2 ARG 27 72.461 14.366 30.791
202 HD3 ARG 27 HD3 ARG 27 71.635 12.847 31.135
203 HE ARG 27 HE ARG 27 71.738 12.730 28.459
204 HH11 ARG 27 HH11 ARG 27 74.240 13.636 30.801
205 HH12 ARG 27 HH12 ARG 27 75.540 13.088 29.799
206 HH21 ARG 27 HH21 ARG 27 73.482 12.021 27.180
207 HH22 ARG 27 HH22 ARG 27 75.112 12.174 27.745
208 H ASN 28 H ASN 28 68.652 18.456 29.413
209 HA ASN 28 HA ASN 28 68.746 20.521 28.487
210 HB2 ASN 28 HB2 ASN 28 71.136 20.098 29.102
211 HB3 ASN 28 HB3 ASN 28 71.434 19.642 27.428
212 HD21 ASN 28 HD21 ASN 28 70.617 22.248 29.624
213 HD22 ASN 28 HD22 ASN 28 71.026 23.581 28.488
214 H VAL 29 H VAL 29 66.977 19.771 27.027
215 HA VAL 29 HA VAL 29 67.775 19.476 24.224
216 HB VAL 29 HB VAL 29 65.055 19.661 25.520
217 HG11 VAL 29 HG11 VAL 29 64.870 20.532 23.286
218 HG12 VAL 29 HG12 VAL 29 64.190 18.906 23.316
219 HG13 VAL 29 HG13 VAL 29 65.796 19.179 22.637
220 HG21 VAL 29 HG21 VAL 29 66.786 17.409 24.590
221 HG22 VAL 29 HG22 VAL 29 65.033 17.231 24.634
222 HG23 VAL 29 HG23 VAL 29 65.918 17.596 26.114
223 H LYS 30 H LYS 30 68.467 21.191 23.162
224 HA LYS 30 HA LYS 30 67.170 23.810 23.734
225 HB2 LYS 30 HB2 LYS 30 69.731 23.398 23.903
226 HB3 LYS 30 HB3 LYS 30 69.696 23.432 22.147
227 HG2 LYS 30 HG2 LYS 30 70.298 25.598 22.915
228 HG3 LYS 30 HG3 LYS 30 68.655 25.692 22.281
229 HD2 LYS 30 HD2 LYS 30 67.755 25.592 24.538
230 HD3 LYS 30 HD3 LYS 30 69.381 25.416 25.197
231 HE2 LYS 30 HE2 LYS 30 69.959 27.628 24.248
232 HE3 LYS 30 HE3 LYS 30 68.290 27.801 23.708
233 HZ1 LYS 30 HZ1 LYS 30 68.672 28.946 25.800
234 HZ2 LYS 30 HZ2 LYS 30 69.167 27.503 26.530
235 HZ3 LYS 30 HZ3 LYS 30 67.568 27.680 26.009
236 H LYS 31 H LYS 31 66.780 25.269 21.918
237 HA LYS 31 HA LYS 31 65.681 23.728 19.653
238 HB2 LYS 31 HB2 LYS 31 64.357 25.517 20.863
239 HB3 LYS 31 HB3 LYS 31 65.455 26.700 20.167
240 HG2 LYS 31 HG2 LYS 31 63.413 26.574 18.877
241 HG3 LYS 31 HG3 LYS 31 64.777 25.998 17.919
242 HD2 LYS 31 HD2 LYS 31 64.144 23.700 18.327
243 HD3 LYS 31 HD3 LYS 31 62.853 24.216 19.414
244 HE2 LYS 31 HE2 LYS 31 61.741 25.345 17.543
245 HE3 LYS 31 HE3 LYS 31 63.028 24.814 16.461
246 HZ1 LYS 31 HZ1 LYS 31 60.985 23.422 16.408
247 HZ2 LYS 31 HZ2 LYS 31 61.306 22.950 18.000
248 HZ3 LYS 31 HZ3 LYS 31 62.395 22.558 16.767
249 H LEU 32 H LEU 32 66.448 23.773 17.603
250 HA LEU 32 HA LEU 32 69.032 25.183 17.262
251 HB2 LEU 32 HB2 LEU 32 67.735 23.013 15.610
252 HB3 LEU 32 HB3 LEU 32 69.320 23.700 15.309
253 HG LEU 32 HG LEU 32 68.540 22.153 17.783
254 HD11 LEU 32 HD11 LEU 32 70.227 21.354 15.417
255 HD12 LEU 32 HD12 LEU 32 68.628 20.727 15.816
256 HD13 LEU 32 HD13 LEU 32 69.993 20.405 16.885
257 HD21 LEU 32 HD21 LEU 32 70.248 23.780 18.288
258 HD22 LEU 32 HD22 LEU 32 71.185 23.288 16.877
259 HD23 LEU 32 HD23 LEU 32 70.975 22.176 18.229
260 H GLN 33 H GLN 33 69.364 25.597 14.680
261 HA GLN 33 HA GLN 33 67.455 27.749 14.150
262 HB2 GLN 33 HB2 GLN 33 69.974 26.842 12.756
263 HB3 GLN 33 HB3 GLN 33 68.971 28.153 12.153
264 HG2 GLN 33 HG2 GLN 33 70.729 29.156 13.353
265 HG3 GLN 33 HG3 GLN 33 69.300 29.282 14.376
266 HE21 GLN 33 HE21 GLN 33 72.387 27.700 13.883
267 HE22 GLN 33 HE22 GLN 33 72.535 27.055 15.555
268 H GLU 34 H GLU 34 67.253 24.531 13.666
269 HA GLU 34 HA GLU 34 66.010 24.795 10.982
270 HB2 GLU 34 HB2 GLU 34 66.767 22.273 12.474
271 HB3 GLU 34 HB3 GLU 34 66.179 22.373 10.822
272 HG2 GLU 34 HG2 GLU 34 68.472 22.047 10.607
273 HG3 GLU 34 HG3 GLU 34 68.252 23.776 10.344
274 H GLU 35 H GLU 35 63.891 25.068 10.970
275 HA GLU 35 HA GLU 35 62.294 24.873 13.300
276 HB2 GLU 35 HB2 GLU 35 61.409 24.750 10.407
277 HB3 GLU 35 HB3 GLU 35 60.367 25.092 11.781
278 HG2 GLU 35 HG2 GLU 35 62.638 26.788 10.768
279 HG3 GLU 35 HG3 GLU 35 60.915 27.141 10.659
280 H GLY 36 H GLY 36 61.633 23.183 14.418
281 HA2 GLY 36 HA2 GLY 36 60.450 21.140 14.606
282 HA3 GLY 36 HA3 GLY 36 60.814 20.761 12.933
283 H TRP 37 H TRP 37 63.589 21.878 14.541
284 HA TRP 37 HA TRP 37 64.323 19.101 15.297
285 HB2 TRP 37 HB2 TRP 37 65.982 21.034 13.669
286 HB3 TRP 37 HB3 TRP 37 66.599 19.536 14.360
287 HD1 TRP 37 HD1 TRP 37 65.335 20.788 11.211
288 HE1 TRP 37 HE1 TRP 37 64.476 18.892 9.660
289 HE3 TRP 37 HE3 TRP 37 65.048 17.052 14.687
290 HZ2 TRP 37 HZ2 TRP 37 63.779 16.165 9.949
291 HZ3 TRP 37 HZ3 TRP 37 64.273 14.830 13.970
292 HH2 TRP 37 HH2 TRP 37 63.651 14.397 11.650
293 H LEU 38 H LEU 38 65.263 18.844 17.163
294 HA LEU 38 HA LEU 38 66.250 21.286 18.568
295 HB2 LEU 38 HB2 LEU 38 64.727 18.929 19.687
296 HB3 LEU 38 HB3 LEU 38 65.548 20.112 20.684
297 HG LEU 38 HG LEU 38 64.069 21.866 19.557
298 HD11 LEU 38 HD11 LEU 38 61.886 20.937 18.755
299 HD12 LEU 38 HD12 LEU 38 62.657 19.353 18.694
300 HD13 LEU 38 HD13 LEU 38 63.252 20.663 17.677
301 HD21 LEU 38 HD21 LEU 38 62.840 19.761 21.331
302 HD22 LEU 38 HD22 LEU 38 62.185 21.377 21.065
303 HD23 LEU 38 HD23 LEU 38 63.749 21.178 21.855
304 H GLU 39 H GLU 39 67.756 20.671 20.432
305 HA GLU 39 HA GLU 39 69.403 18.322 19.621
306 HB2 GLU 39 HB2 GLU 39 70.453 20.413 18.816
307 HB3 GLU 39 HB3 GLU 39 70.478 21.022 20.465
308 HG2 GLU 39 HG2 GLU 39 71.984 19.243 21.129
309 HG3 GLU 39 HG3 GLU 39 71.916 18.556 19.506
310 H GLY 40 H GLY 40 69.757 16.917 21.198
311 HA2 GLY 40 HA2 GLY 40 70.016 17.910 23.965
312 HA3 GLY 40 HA3 GLY 40 68.647 16.856 23.657
313 H GLU 41 H GLU 41 70.672 16.303 25.510
314 HA GLU 41 HA GLU 41 72.325 14.240 24.175
315 HB2 GLU 41 HB2 GLU 41 72.399 15.260 27.022
316 HB3 GLU 41 HB3 GLU 41 73.517 14.098 26.326
317 HG2 GLU 41 HG2 GLU 41 74.697 16.079 26.241
318 HG3 GLU 41 HG3 GLU 41 74.040 15.940 24.612
319 H LEU 42 H LEU 42 71.207 12.454 23.804
320 HA LEU 42 HA LEU 42 69.858 11.212 26.155
321 HB2 LEU 42 HB2 LEU 42 68.198 12.023 24.526
322 HB3 LEU 42 HB3 LEU 42 68.970 11.075 23.273
323 HG LEU 42 HG LEU 42 68.406 9.009 24.544
324 HD11 LEU 42 HD11 LEU 42 66.776 9.130 26.343
325 HD12 LEU 42 HD12 LEU 42 66.798 10.892 26.263
326 HD13 LEU 42 HD13 LEU 42 68.241 10.013 26.769
327 HD21 LEU 42 HD21 LEU 42 66.065 10.773 23.839
328 HD22 LEU 42 HD22 LEU 42 66.036 9.015 23.973
329 HD23 LEU 42 HD23 LEU 42 66.994 9.788 22.710
330 H ASN 43 H ASN 43 70.262 9.091 26.547
331 HA ASN 43 HA ASN 43 71.399 7.120 26.455
332 HB2 ASN 43 HB2 ASN 43 71.198 7.653 23.491
333 HB3 ASN 43 HB3 ASN 43 71.916 6.182 24.138
334 HD21 ASN 43 HD21 ASN 43 70.370 4.872 23.181
335 HD22 ASN 43 HD22 ASN 43 68.688 4.804 23.810
336 H GLY 44 H GLY 44 72.865 9.814 26.501
337 HA2 GLY 44 HA2 GLY 44 75.118 10.194 26.960
338 HA3 GLY 44 HA3 GLY 44 75.523 8.611 26.328
339 H ARG 45 H ARG 45 73.559 10.311 24.162
340 HA ARG 45 HA ARG 45 75.931 11.436 22.781
341 HB2 ARG 45 HB2 ARG 45 75.485 9.312 21.712
342 HB3 ARG 45 HB3 ARG 45 73.776 9.693 21.574
343 HG2 ARG 45 HG2 ARG 45 74.862 9.938 19.435
344 HG3 ARG 45 HG3 ARG 45 74.318 11.511 20.017
345 HD2 ARG 45 HD2 ARG 45 76.642 11.889 20.878
346 HD3 ARG 45 HD3 ARG 45 77.124 10.412 20.046
347 HE ARG 45 HE ARG 45 76.094 11.677 17.979
348 HH11 ARG 45 HH11 ARG 45 78.048 13.058 20.596
349 HH12 ARG 45 HH12 ARG 45 78.682 14.328 19.609
350 HH21 ARG 45 HH21 ARG 45 76.957 13.365 16.722
351 HH22 ARG 45 HH22 ARG 45 78.066 14.504 17.413
352 H ARG 46 H ARG 46 75.610 13.315 21.635
353 HA ARG 46 HA ARG 46 73.050 14.654 22.275
354 HB2 ARG 46 HB2 ARG 46 75.269 15.777 22.740
355 HB3 ARG 46 HB3 ARG 46 75.523 15.851 21.002
356 HG2 ARG 46 HG2 ARG 46 73.442 17.181 20.800
357 HG3 ARG 46 HG3 ARG 46 73.320 17.185 22.561
358 HD2 ARG 46 HD2 ARG 46 74.333 19.238 21.933
359 HD3 ARG 46 HD3 ARG 46 75.605 18.226 22.616
360 HE ARG 46 HE ARG 46 75.545 17.833 19.804
361 HH11 ARG 46 HH11 ARG 46 76.369 20.324 22.183
362 HH12 ARG 46 HH12 ARG 46 77.547 21.077 21.162
363 HH21 ARG 46 HH21 ARG 46 77.103 18.855 18.495
364 HH22 ARG 46 HH22 ARG 46 77.965 20.244 19.068
365 H GLY 47 H GLY 47 71.459 14.545 20.829
366 HA2 GLY 47 HA2 GLY 47 72.264 14.529 17.962
367 HA3 GLY 47 HA3 GLY 47 71.129 13.335 18.563
368 H MET 48 H MET 48 70.150 14.540 16.572
369 HA MET 48 HA MET 48 68.552 16.818 17.619
370 HB2 MET 48 HB2 MET 48 69.271 16.072 14.776
371 HB3 MET 48 HB3 MET 48 68.139 17.348 15.200
372 HG2 MET 48 HG2 MET 48 69.865 18.613 16.265
373 HG3 MET 48 HG3 MET 48 71.015 17.292 16.074
374 HE1 MET 48 HE1 MET 48 68.403 18.297 13.309
375 HE2 MET 48 HE2 MET 48 69.266 19.584 12.466
376 HE3 MET 48 HE3 MET 48 68.720 19.828 14.125
377 H PHE 49 H PHE 49 66.379 16.696 17.685
378 HA PHE 49 HA PHE 49 65.124 14.324 16.409
379 HB2 PHE 49 HB2 PHE 49 63.680 14.326 18.633
380 HB3 PHE 49 HB3 PHE 49 65.209 13.456 18.545
381 HD1 PHE 49 HD1 PHE 49 63.471 16.350 19.936
382 HD2 PHE 49 HD2 PHE 49 67.176 14.274 19.693
383 HE1 PHE 49 HE1 PHE 49 64.331 17.666 21.828
384 HE2 PHE 49 HE2 PHE 49 68.040 15.581 21.586
385 HZ PHE 49 HZ PHE 49 66.617 17.282 22.655
386 HA PRO 50 HA PRO 50 61.911 17.005 15.073
387 HB2 PRO 50 HB2 PRO 50 59.879 15.120 16.105
388 HB3 PRO 50 HB3 PRO 50 60.155 15.684 14.455
389 HG2 PRO 50 HG2 PRO 50 60.811 13.200 15.192
390 HG3 PRO 50 HG3 PRO 50 61.817 14.121 14.057
391 HD2 PRO 50 HD2 PRO 50 62.243 13.592 16.974
392 HD3 PRO 50 HD3 PRO 50 63.423 13.600 15.645
393 H ASP 51 H ASP 51 60.508 18.593 15.716
394 HA ASP 51 HA ASP 51 60.606 19.329 18.482
395 HB2 ASP 51 HB2 ASP 51 59.325 21.253 17.852
396 HB3 ASP 51 HB3 ASP 51 60.440 20.909 16.534
397 H ASN 52 H ASN 52 58.073 17.841 16.470
398 HA ASN 52 HA ASN 52 56.186 17.909 18.719
399 HB2 ASN 52 HB2 ASN 52 54.613 16.860 17.137
400 HB3 ASN 52 HB3 ASN 52 55.336 18.323 16.478
401 HD21 ASN 52 HD21 ASN 52 55.042 14.873 16.239
402 HD22 ASN 52 HD22 ASN 52 55.908 14.711 14.671
403 H PHE 53 H PHE 53 58.787 16.175 18.556
404 HA PHE 53 HA PHE 53 57.477 13.570 19.137
405 HB2 PHE 53 HB2 PHE 53 60.159 14.341 18.088
406 HB3 PHE 53 HB3 PHE 53 60.051 12.889 19.076
407 HD1 PHE 53 HD1 PHE 53 57.861 14.366 16.430
408 HD2 PHE 53 HD2 PHE 53 60.119 11.017 17.768
409 HE1 PHE 53 HE1 PHE 53 57.117 13.086 14.466
410 HE2 PHE 53 HE2 PHE 53 59.380 9.732 15.806
411 HZ PHE 53 HZ PHE 53 57.877 10.764 14.153
412 H VAL 54 H VAL 54 59.307 16.209 20.472
413 HA VAL 54 HA VAL 54 59.333 14.787 23.088
414 HB VAL 54 HB VAL 54 61.322 16.126 23.696
415 HG11 VAL 54 HG11 VAL 54 61.671 13.872 22.949
416 HG12 VAL 54 HG12 VAL 54 62.943 14.890 22.277
417 HG13 VAL 54 HG13 VAL 54 61.599 14.374 21.261
418 HG21 VAL 54 HG21 VAL 54 61.412 16.893 20.779
419 HG22 VAL 54 HG22 VAL 54 62.577 17.333 22.025
420 HG23 VAL 54 HG23 VAL 54 60.938 17.972 22.089
421 H LYS 55 H LYS 55 58.755 15.950 24.911
422 HA LYS 55 HA LYS 55 57.651 18.668 24.358
423 HB2 LYS 55 HB2 LYS 55 55.874 16.952 24.663
424 HB3 LYS 55 HB3 LYS 55 56.522 16.603 26.260
425 HG2 LYS 55 HG2 LYS 55 56.064 18.939 26.918
426 HG3 LYS 55 HG3 LYS 55 55.323 19.206 25.339
427 HD2 LYS 55 HD2 LYS 55 53.691 17.429 25.829
428 HD3 LYS 55 HD3 LYS 55 54.415 17.221 27.424
429 HE2 LYS 55 HE2 LYS 55 53.149 19.760 26.395
430 HE3 LYS 55 HE3 LYS 55 52.379 18.608 27.484
431 HZ1 LYS 55 HZ1 LYS 55 53.283 20.444 28.725
432 HZ2 LYS 55 HZ2 LYS 55 54.818 20.205 28.057
433 HZ3 LYS 55 HZ3 LYS 55 54.159 19.044 29.095
434 H GLU 56 H GLU 56 58.394 20.275 25.616
435 HA GLU 56 HA GLU 56 60.552 19.899 27.353
436 HB2 GLU 56 HB2 GLU 56 59.689 22.075 26.342
437 HB3 GLU 56 HB3 GLU 56 58.553 22.131 27.681
438 HG2 GLU 56 HG2 GLU 56 60.389 22.172 29.267
439 HG3 GLU 56 HG3 GLU 56 61.551 22.051 27.948
440 H ILE 57 H ILE 57 60.867 19.508 29.492
441 HA ILE 57 HA ILE 57 58.539 18.413 30.894
442 HB ILE 57 HB ILE 57 60.742 17.238 30.877
443 HG12 ILE 57 HG12 ILE 57 59.000 16.826 32.613
444 HG13 ILE 57 HG13 ILE 57 60.635 16.487 33.161
445 HG21 ILE 57 HG21 ILE 57 61.685 19.287 32.860
446 HG22 ILE 57 HG22 ILE 57 62.094 19.350 31.147
447 HG23 ILE 57 HG23 ILE 57 62.599 17.971 32.124
448 HD11 ILE 57 HD11 ILE 57 58.877 18.804 33.889
449 HD12 ILE 57 HD12 ILE 57 60.609 18.783 34.219
450 HD13 ILE 57 HD13 ILE 57 59.558 17.566 34.943
451 H LYS 58 H LYS 58 57.217 19.864 31.725
452 HA LYS 58 HA LYS 58 58.248 22.337 32.890
453 HB2 LYS 58 HB2 LYS 58 55.436 21.218 32.812
454 HB3 LYS 58 HB3 LYS 58 55.868 22.835 33.350
455 HG2 LYS 58 HG2 LYS 58 56.337 21.760 30.575
456 HG3 LYS 58 HG3 LYS 58 54.980 22.780 31.054
457 HD2 LYS 58 HD2 LYS 58 56.543 24.555 31.694
458 HD3 LYS 58 HD3 LYS 58 57.901 23.531 31.219
459 HE2 LYS 58 HE2 LYS 58 57.147 23.528 28.925
460 HE3 LYS 58 HE3 LYS 58 55.698 24.430 29.365
461 HZ1 LYS 58 HZ1 LYS 58 58.489 25.427 29.590
462 HZ2 LYS 58 HZ2 LYS 58 57.097 26.293 30.007
463 HZ3 LYS 58 HZ3 LYS 58 57.375 25.869 28.394
Start of MODEL 4
1 H1 VAL 2 H1 VAL 2 66.782 23.314 27.682
2 H2 VAL 2 H2 VAL 2 67.463 22.930 29.181
3 H3 VAL 2 H3 VAL 2 66.690 24.417 28.961
4 HA VAL 2 HA VAL 2 65.334 22.848 30.221
5 HB VAL 2 HB VAL 2 63.270 23.011 28.813
6 HG11 VAL 2 HG11 VAL 2 64.918 25.531 28.972
7 HG12 VAL 2 HG12 VAL 2 63.976 24.833 30.290
8 HG13 VAL 2 HG13 VAL 2 63.162 25.439 28.847
9 HG21 VAL 2 HG21 VAL 2 63.389 24.219 26.688
10 HG22 VAL 2 HG22 VAL 2 64.292 22.707 26.617
11 HG23 VAL 2 HG23 VAL 2 65.149 24.237 26.794
12 H ASP 3 H ASP 3 64.677 20.819 30.591
13 HA ASP 3 HA ASP 3 65.613 18.761 28.754
14 HB2 ASP 3 HB2 ASP 3 64.133 18.614 31.385
15 HB3 ASP 3 HB3 ASP 3 64.675 17.203 30.483
16 H TYR 4 H TYR 4 64.388 17.124 27.799
17 HA TYR 4 HA TYR 4 61.493 17.755 27.481
18 HB2 TYR 4 HB2 TYR 4 63.572 17.468 25.370
19 HB3 TYR 4 HB3 TYR 4 61.982 16.794 25.045
20 HD1 TYR 4 HD2 TYR 4 63.607 19.951 26.196
21 HD2 TYR 4 HD1 TYR 4 60.337 18.160 24.154
22 HE1 TYR 4 HE2 TYR 4 62.805 22.180 25.538
23 HE2 TYR 4 HE1 TYR 4 59.523 20.382 23.491
24 HH TYR 4 HH TYR 4 59.733 22.747 24.320
25 H ILE 5 H ILE 5 60.127 15.995 26.962
26 HA ILE 5 HA ILE 5 61.405 13.359 27.507
27 HB ILE 5 HB ILE 5 60.027 14.086 29.425
28 HG12 ILE 5 HG12 ILE 5 58.756 11.786 27.924
29 HG13 ILE 5 HG13 ILE 5 60.279 11.678 28.802
30 HG21 ILE 5 HG21 ILE 5 58.409 15.447 28.150
31 HG22 ILE 5 HG22 ILE 5 57.633 14.313 29.253
32 HG23 ILE 5 HG23 ILE 5 57.688 13.964 27.526
33 HD11 ILE 5 HD11 ILE 5 58.388 10.786 30.074
34 HD12 ILE 5 HD12 ILE 5 57.620 12.373 30.026
35 HD13 ILE 5 HD13 ILE 5 59.147 12.158 30.881
36 H VAL 6 H VAL 6 61.202 11.895 25.957
37 HA VAL 6 HA VAL 6 59.882 12.550 23.519
38 HB VAL 6 HB VAL 6 60.711 9.792 24.424
39 HG11 VAL 6 HG11 VAL 6 60.983 9.381 22.013
40 HG12 VAL 6 HG12 VAL 6 60.362 10.997 21.682
41 HG13 VAL 6 HG13 VAL 6 59.322 9.789 22.438
42 HG21 VAL 6 HG21 VAL 6 62.586 11.315 24.696
43 HG22 VAL 6 HG22 VAL 6 62.359 11.915 23.054
44 HG23 VAL 6 HG23 VAL 6 62.862 10.246 23.321
45 H GLU 7 H GLU 7 57.903 12.275 22.801
46 HA GLU 7 HA GLU 7 56.057 10.653 24.482
47 HB2 GLU 7 HB2 GLU 7 55.502 13.058 24.329
48 HB3 GLU 7 HB3 GLU 7 55.417 12.919 22.580
49 HG2 GLU 7 HG2 GLU 7 53.201 12.918 23.519
50 HG3 GLU 7 HG3 GLU 7 53.549 11.345 22.806
51 H TYR 8 H TYR 8 57.437 11.117 21.313
52 HA TYR 8 HA TYR 8 55.947 8.715 20.387
53 HB2 TYR 8 HB2 TYR 8 56.620 11.092 18.638
54 HB3 TYR 8 HB3 TYR 8 55.683 9.670 18.187
55 HD1 TYR 8 HD1 TYR 8 53.382 9.387 19.006
56 HD2 TYR 8 HD2 TYR 8 55.629 12.889 19.898
57 HE1 TYR 8 HE1 TYR 8 51.316 10.536 19.678
58 HE2 TYR 8 HE2 TYR 8 53.570 14.048 20.571
59 HH TYR 8 HH TYR 8 50.699 12.486 21.199
60 H ASP 9 H ASP 9 57.120 7.214 19.273
61 HA ASP 9 HA ASP 9 59.979 7.339 19.579
62 HB2 ASP 9 HB2 ASP 9 59.994 5.181 18.406
63 HB3 ASP 9 HB3 ASP 9 58.760 5.214 19.660
64 H TYR 10 H TYR 10 61.628 7.630 18.120
65 HA TYR 10 HA TYR 10 60.841 8.401 15.361
66 HB2 TYR 10 HB2 TYR 10 61.107 10.451 16.775
67 HB3 TYR 10 HB3 TYR 10 62.782 9.987 17.046
68 HD1 TYR 10 HD2 TYR 10 60.450 10.433 14.153
69 HD2 TYR 10 HD1 TYR 10 64.356 11.026 15.730
70 HE1 TYR 10 HE2 TYR 10 61.098 11.599 12.089
71 HE2 TYR 10 HE1 TYR 10 65.016 12.196 13.672
72 HH TYR 10 HH TYR 10 62.841 13.327 11.413
73 H ASP 11 H ASP 11 61.998 7.408 13.863
74 HA ASP 11 HA ASP 11 64.287 5.800 14.702
75 HB2 ASP 11 HB2 ASP 11 62.656 4.881 13.125
76 HB3 ASP 11 HB3 ASP 11 63.010 6.172 11.983
77 H ALA 12 H ALA 12 66.276 6.531 14.831
78 HA ALA 12 HA ALA 12 67.074 9.012 13.605
79 HB1 ALA 12 HB1 ALA 12 68.054 8.300 15.696
80 HB2 ALA 12 HB2 ALA 12 69.313 8.456 14.471
81 HB3 ALA 12 HB3 ALA 12 68.721 6.859 14.926
82 H VAL 13 H VAL 13 67.172 9.175 11.473
83 HA VAL 13 HA VAL 13 68.192 6.941 9.860
84 HB VAL 13 HB VAL 13 67.311 9.703 8.986
85 HG11 VAL 13 HG11 VAL 13 67.114 8.687 6.757
86 HG12 VAL 13 HG12 VAL 13 67.783 7.183 7.393
87 HG13 VAL 13 HG13 VAL 13 68.772 8.643 7.358
88 HG21 VAL 13 HG21 VAL 13 65.219 8.597 8.299
89 HG22 VAL 13 HG22 VAL 13 65.475 8.520 10.042
90 HG23 VAL 13 HG23 VAL 13 65.784 7.101 9.043
91 H HIS 14 H HIS 14 69.135 10.185 10.910
92 HA HIS 14 HA HIS 14 71.645 10.021 9.380
93 HB2 HIS 14 HB2 HIS 14 70.496 12.153 11.187
94 HB3 HIS 14 HB3 HIS 14 72.057 12.288 10.388
95 HD1 HIS 14 HD1 HIS 14 72.085 13.245 8.085
96 HD2 HIS 14 HD2 HIS 14 68.271 11.974 9.282
97 HE1 HIS 14 HE1 HIS 14 70.479 13.987 6.269
98 HE2 HIS 14 HE2 HIS 14 68.159 13.268 7.020
99 H ASP 15 H ASP 15 73.657 10.864 10.659
100 HA ASP 15 HA ASP 15 74.088 8.874 12.754
101 HB2 ASP 15 HB2 ASP 15 75.933 10.960 11.562
102 HB3 ASP 15 HB3 ASP 15 76.429 9.737 12.728
103 H ASP 16 H ASP 16 73.581 12.346 12.512
104 HA ASP 16 HA ASP 16 74.113 12.622 15.419
105 HB2 ASP 16 HB2 ASP 16 73.679 14.695 13.256
106 HB3 ASP 16 HB3 ASP 16 73.935 15.070 14.958
107 H GLU 17 H GLU 17 71.682 11.383 13.928
108 HA GLU 17 HA GLU 17 69.559 13.157 14.972
109 HB2 GLU 17 HB2 GLU 17 69.496 12.142 12.636
110 HB3 GLU 17 HB3 GLU 17 69.221 10.593 13.418
111 HG2 GLU 17 HG2 GLU 17 67.134 11.270 14.261
112 HG3 GLU 17 HG3 GLU 17 67.455 12.968 13.906
113 H LEU 18 H LEU 18 68.569 12.781 16.851
114 HA LEU 18 HA LEU 18 69.401 10.442 18.387
115 HB2 LEU 18 HB2 LEU 18 67.636 12.801 18.988
116 HB3 LEU 18 HB3 LEU 18 67.777 11.456 20.102
117 HG LEU 18 HG LEU 18 70.017 13.266 19.198
118 HD11 LEU 18 HD11 LEU 18 70.021 13.641 21.772
119 HD12 LEU 18 HD12 LEU 18 68.349 13.091 21.666
120 HD13 LEU 18 HD13 LEU 18 68.873 14.508 20.756
121 HD21 LEU 18 HD21 LEU 18 70.880 11.035 19.511
122 HD22 LEU 18 HD22 LEU 18 70.054 10.898 21.063
123 HD23 LEU 18 HD23 LEU 18 71.375 12.050 20.865
124 H THR 19 H THR 19 68.336 8.624 18.815
125 HA THR 19 HA THR 19 65.849 8.165 17.308
126 HB THR 19 HB THR 19 67.252 6.167 19.087
127 HG1 THR 19 HG1 THR 19 68.872 6.420 17.733
128 HG21 THR 19 HG21 THR 19 65.528 5.855 16.627
129 HG22 THR 19 HG22 THR 19 65.032 5.529 18.287
130 HG23 THR 19 HG23 THR 19 66.278 4.539 17.529
131 H ILE 20 H ILE 20 65.156 10.015 19.067
132 HA ILE 20 HA ILE 20 64.523 9.384 21.665
133 HB ILE 20 HB ILE 20 62.541 10.920 21.400
134 HG12 ILE 20 HG12 ILE 20 63.586 11.226 18.579
135 HG13 ILE 20 HG13 ILE 20 62.117 10.352 18.999
136 HG21 ILE 20 HG21 ILE 20 63.945 12.905 20.970
137 HG22 ILE 20 HG22 ILE 20 65.235 11.838 20.413
138 HG23 ILE 20 HG23 ILE 20 64.687 11.762 22.087
139 HD11 ILE 20 HD11 ILE 20 62.635 13.281 19.435
140 HD12 ILE 20 HD12 ILE 20 61.180 12.419 19.927
141 HD13 ILE 20 HD13 ILE 20 61.582 12.565 18.216
142 H ARG 21 H ARG 21 63.443 7.885 22.651
143 HA ARG 21 HA ARG 21 61.164 6.596 21.220
144 HB2 ARG 21 HB2 ARG 21 63.004 5.051 21.682
145 HB3 ARG 21 HB3 ARG 21 62.988 5.507 23.379
146 HG2 ARG 21 HG2 ARG 21 60.559 4.662 23.369
147 HG3 ARG 21 HG3 ARG 21 60.996 3.877 21.850
148 HD2 ARG 21 HD2 ARG 21 61.289 2.334 23.695
149 HD3 ARG 21 HD3 ARG 21 62.854 2.742 22.993
150 HE ARG 21 HE ARG 21 62.044 4.368 25.295
151 HH11 ARG 21 HH11 ARG 21 63.817 1.515 24.165
152 HH12 ARG 21 HH12 ARG 21 64.823 1.439 25.571
153 HH21 ARG 21 HH21 ARG 21 63.389 4.225 27.127
154 HH22 ARG 21 HH22 ARG 21 64.581 2.974 27.253
155 H VAL 22 H VAL 22 59.157 6.557 22.199
156 HA VAL 22 HA VAL 22 58.399 8.483 23.984
157 HB VAL 22 HB VAL 22 57.177 5.720 23.993
158 HG11 VAL 22 HG11 VAL 22 56.281 7.124 25.719
159 HG12 VAL 22 HG12 VAL 22 55.086 6.990 24.429
160 HG13 VAL 22 HG13 VAL 22 56.056 8.454 24.585
161 HG21 VAL 22 HG21 VAL 22 55.664 6.724 22.203
162 HG22 VAL 22 HG22 VAL 22 57.292 6.260 21.709
163 HG23 VAL 22 HG23 VAL 22 56.911 7.956 22.004
164 H GLY 23 H GLY 23 58.809 9.002 26.025
165 HA2 GLY 23 HA2 GLY 23 58.728 8.360 28.352
166 HA3 GLY 23 HA3 GLY 23 59.330 6.769 27.925
167 H GLU 24 H GLU 24 61.343 8.305 26.056
168 HA GLU 24 HA GLU 24 63.408 8.379 28.101
169 HB2 GLU 24 HB2 GLU 24 63.516 8.964 25.140
170 HB3 GLU 24 HB3 GLU 24 64.919 8.877 26.196
171 HG2 GLU 24 HG2 GLU 24 64.197 6.515 26.738
172 HG3 GLU 24 HG3 GLU 24 63.057 6.660 25.402
173 H ILE 25 H ILE 25 64.716 10.085 28.716
174 HA ILE 25 HA ILE 25 63.515 12.767 28.190
175 HB ILE 25 HB ILE 25 65.122 11.831 30.578
176 HG12 ILE 25 HG12 ILE 25 62.885 12.538 31.722
177 HG13 ILE 25 HG13 ILE 25 62.196 12.339 30.115
178 HG21 ILE 25 HG21 ILE 25 63.917 14.530 29.976
179 HG22 ILE 25 HG22 ILE 25 65.634 14.141 30.090
180 HG23 ILE 25 HG23 ILE 25 64.613 14.053 31.526
181 HD11 ILE 25 HD11 ILE 25 62.876 10.022 30.078
182 HD12 ILE 25 HD12 ILE 25 61.921 10.354 31.521
183 HD13 ILE 25 HD13 ILE 25 63.674 10.208 31.639
184 H ILE 26 H ILE 26 64.688 14.254 27.159
185 HA ILE 26 HA ILE 26 67.503 13.546 26.569
186 HB ILE 26 HB ILE 26 65.811 15.720 25.327
187 HG12 ILE 26 HG12 ILE 26 65.997 14.099 23.307
188 HG13 ILE 26 HG13 ILE 26 66.375 12.877 24.514
189 HG21 ILE 26 HG21 ILE 26 68.222 16.157 25.255
190 HG22 ILE 26 HG22 ILE 26 67.569 15.844 23.650
191 HG23 ILE 26 HG23 ILE 26 68.478 14.589 24.490
192 HD11 ILE 26 HD11 ILE 26 63.892 14.556 24.634
193 HD12 ILE 26 HD12 ILE 26 64.249 13.067 25.510
194 HD13 ILE 26 HD13 ILE 26 63.976 13.022 23.769
195 H ARG 27 H ARG 27 69.129 14.446 27.631
196 HA ARG 27 HA ARG 27 68.617 16.517 29.566
197 HB2 ARG 27 HB2 ARG 27 71.111 15.126 28.627
198 HB3 ARG 27 HB3 ARG 27 71.164 16.421 29.813
199 HG2 ARG 27 HG2 ARG 27 69.709 13.798 30.090
200 HG3 ARG 27 HG3 ARG 27 71.195 14.273 30.914
201 HD2 ARG 27 HD2 ARG 27 68.452 15.479 31.251
202 HD3 ARG 27 HD3 ARG 27 69.351 14.530 32.432
203 HE ARG 27 HE ARG 27 70.943 16.757 31.765
204 HH11 ARG 27 HH11 ARG 27 67.852 16.070 33.350
205 HH12 ARG 27 HH12 ARG 27 67.913 17.483 34.347
206 HH21 ARG 27 HH21 ARG 27 70.981 18.607 33.092
207 HH22 ARG 27 HH22 ARG 27 69.688 18.925 34.200
208 H ASN 28 H ASN 28 68.742 18.652 29.439
209 HA ASN 28 HA ASN 28 69.005 20.712 28.528
210 HB2 ASN 28 HB2 ASN 28 71.647 19.560 27.612
211 HB3 ASN 28 HB3 ASN 28 71.260 21.275 27.704
212 HD21 ASN 28 HD21 ASN 28 71.981 18.361 29.483
213 HD22 ASN 28 HD22 ASN 28 72.261 19.168 31.064
214 H VAL 29 H VAL 29 67.204 20.102 27.059
215 HA VAL 29 HA VAL 29 67.999 19.699 24.265
216 HB VAL 29 HB VAL 29 65.254 20.122 25.449
217 HG11 VAL 29 HG11 VAL 29 66.137 19.192 22.723
218 HG12 VAL 29 HG12 VAL 29 65.238 20.659 23.111
219 HG13 VAL 29 HG13 VAL 29 64.484 19.078 23.326
220 HG21 VAL 29 HG21 VAL 29 65.180 17.574 24.884
221 HG22 VAL 29 HG22 VAL 29 65.905 18.127 26.392
222 HG23 VAL 29 HG23 VAL 29 66.932 17.693 25.027
223 H LYS 30 H LYS 30 68.741 21.343 23.139
224 HA LYS 30 HA LYS 30 67.576 24.039 23.598
225 HB2 LYS 30 HB2 LYS 30 70.045 23.775 23.749
226 HB3 LYS 30 HB3 LYS 30 70.067 23.229 22.078
227 HG2 LYS 30 HG2 LYS 30 69.202 25.406 21.362
228 HG3 LYS 30 HG3 LYS 30 69.206 25.952 23.040
229 HD2 LYS 30 HD2 LYS 30 71.640 25.035 21.506
230 HD3 LYS 30 HD3 LYS 30 71.186 26.719 21.771
231 HE2 LYS 30 HE2 LYS 30 71.380 26.396 24.185
232 HE3 LYS 30 HE3 LYS 30 71.808 24.705 23.932
233 HZ1 LYS 30 HZ1 LYS 30 73.380 27.043 22.986
234 HZ2 LYS 30 HZ2 LYS 30 73.794 25.420 22.757
235 HZ3 LYS 30 HZ3 LYS 30 73.763 26.071 24.317
236 H LYS 31 H LYS 31 66.997 25.369 21.752
237 HA LYS 31 HA LYS 31 65.655 23.749 19.727
238 HB2 LYS 31 HB2 LYS 31 64.623 25.782 20.750
239 HB3 LYS 31 HB3 LYS 31 65.831 26.761 19.927
240 HG2 LYS 31 HG2 LYS 31 64.984 26.104 17.778
241 HG3 LYS 31 HG3 LYS 31 63.867 24.960 18.526
242 HD2 LYS 31 HD2 LYS 31 62.705 26.814 19.624
243 HD3 LYS 31 HD3 LYS 31 63.824 27.957 18.879
244 HE2 LYS 31 HE2 LYS 31 63.056 27.297 16.668
245 HE3 LYS 31 HE3 LYS 31 61.980 26.097 17.382
246 HZ1 LYS 31 HZ1 LYS 31 60.822 28.146 16.765
247 HZ2 LYS 31 HZ2 LYS 31 61.792 29.027 17.834
248 HZ3 LYS 31 HZ3 LYS 31 60.729 27.854 18.429
249 H LEU 32 H LEU 32 66.408 23.158 17.838
250 HA LEU 32 HA LEU 32 69.010 24.108 16.950
251 HB2 LEU 32 HB2 LEU 32 68.120 21.749 16.720
252 HB3 LEU 32 HB3 LEU 32 67.050 22.349 15.469
253 HG LEU 32 HG LEU 32 69.045 23.036 14.148
254 HD11 LEU 32 HD11 LEU 32 70.644 23.301 15.949
255 HD12 LEU 32 HD12 LEU 32 71.232 22.118 14.782
256 HD13 LEU 32 HD13 LEU 32 70.549 21.579 16.317
257 HD21 LEU 32 HD21 LEU 32 68.851 20.134 14.939
258 HD22 LEU 32 HD22 LEU 32 69.703 20.738 13.517
259 HD23 LEU 32 HD23 LEU 32 67.957 20.946 13.653
260 H GLN 33 H GLN 33 69.372 24.857 14.676
261 HA GLN 33 HA GLN 33 67.850 27.211 14.199
262 HB2 GLN 33 HB2 GLN 33 70.174 26.952 13.462
263 HB3 GLN 33 HB3 GLN 33 69.689 25.688 12.342
264 HG2 GLN 33 HG2 GLN 33 68.311 27.336 11.129
265 HG3 GLN 33 HG3 GLN 33 68.904 28.591 12.216
266 HE21 GLN 33 HE21 GLN 33 71.028 29.312 12.072
267 HE22 GLN 33 HE22 GLN 33 72.042 28.938 10.636
268 H GLU 34 H GLU 34 67.495 23.901 13.094
269 HA GLU 34 HA GLU 34 65.599 24.660 11.013
270 HB2 GLU 34 HB2 GLU 34 66.544 22.006 12.084
271 HB3 GLU 34 HB3 GLU 34 65.292 22.141 10.859
272 HG2 GLU 34 HG2 GLU 34 67.420 21.672 9.829
273 HG3 GLU 34 HG3 GLU 34 66.872 23.283 9.377
274 H GLU 35 H GLU 35 63.472 24.801 11.146
275 HA GLU 35 HA GLU 35 62.215 24.771 13.717
276 HB2 GLU 35 HB2 GLU 35 61.453 26.123 11.749
277 HB3 GLU 35 HB3 GLU 35 60.871 24.638 11.007
278 HG2 GLU 35 HG2 GLU 35 59.061 25.872 12.053
279 HG3 GLU 35 HG3 GLU 35 59.306 24.315 12.841
280 H GLY 36 H GLY 36 61.476 23.135 14.901
281 HA2 GLY 36 HA2 GLY 36 60.301 21.105 15.213
282 HA3 GLY 36 HA3 GLY 36 60.508 20.711 13.513
283 H TRP 37 H TRP 37 63.313 21.856 15.150
284 HA TRP 37 HA TRP 37 64.198 19.076 15.671
285 HB2 TRP 37 HB2 TRP 37 65.609 21.151 14.002
286 HB3 TRP 37 HB3 TRP 37 66.466 19.799 14.738
287 HD1 TRP 37 HD1 TRP 37 64.384 20.696 11.757
288 HE1 TRP 37 HE1 TRP 37 63.997 18.611 10.259
289 HE3 TRP 37 HE3 TRP 37 66.100 17.125 14.989
290 HZ2 TRP 37 HZ2 TRP 37 64.393 15.819 10.492
291 HZ3 TRP 37 HZ3 TRP 37 66.060 14.771 14.276
292 HH2 TRP 37 HH2 TRP 37 65.223 14.134 12.074
293 H LEU 38 H LEU 38 65.341 18.777 17.447
294 HA LEU 38 HA LEU 38 66.195 21.215 18.933
295 HB2 LEU 38 HB2 LEU 38 64.972 18.706 20.092
296 HB3 LEU 38 HB3 LEU 38 65.582 20.063 21.019
297 HG LEU 38 HG LEU 38 63.262 20.223 19.093
298 HD11 LEU 38 HD11 LEU 38 63.232 20.135 22.106
299 HD12 LEU 38 HD12 LEU 38 62.783 18.798 21.047
300 HD13 LEU 38 HD13 LEU 38 61.835 20.285 21.040
301 HD21 LEU 38 HD21 LEU 38 64.361 22.188 21.101
302 HD22 LEU 38 HD22 LEU 38 62.862 22.392 20.195
303 HD23 LEU 38 HD23 LEU 38 64.405 22.341 19.344
304 H GLU 39 H GLU 39 67.893 20.783 20.565
305 HA GLU 39 HA GLU 39 69.609 18.498 19.718
306 HB2 GLU 39 HB2 GLU 39 70.384 20.739 18.842
307 HB3 GLU 39 HB3 GLU 39 70.634 21.226 20.513
308 HG2 GLU 39 HG2 GLU 39 72.228 19.373 20.787
309 HG3 GLU 39 HG3 GLU 39 72.013 18.962 19.087
310 H GLY 40 H GLY 40 70.001 17.129 21.333
311 HA2 GLY 40 HA2 GLY 40 70.540 18.198 24.010
312 HA3 GLY 40 HA3 GLY 40 69.045 17.293 23.885
313 H GLU 41 H GLU 41 70.992 16.535 25.627
314 HA GLU 41 HA GLU 41 72.545 14.392 24.357
315 HB2 GLU 41 HB2 GLU 41 73.528 15.748 26.165
316 HB3 GLU 41 HB3 GLU 41 72.276 15.190 27.263
317 HG2 GLU 41 HG2 GLU 41 74.098 13.252 25.892
318 HG3 GLU 41 HG3 GLU 41 74.596 14.093 27.358
319 H LEU 42 H LEU 42 71.539 12.613 23.788
320 HA LEU 42 HA LEU 42 69.696 11.382 25.770
321 HB2 LEU 42 HB2 LEU 42 68.335 12.419 24.017
322 HB3 LEU 42 HB3 LEU 42 69.240 11.554 22.790
323 HG LEU 42 HG LEU 42 68.396 9.411 23.749
324 HD11 LEU 42 HD11 LEU 42 66.720 11.262 25.435
325 HD12 LEU 42 HD12 LEU 42 67.920 10.102 26.003
326 HD13 LEU 42 HD13 LEU 42 66.434 9.532 25.246
327 HD21 LEU 42 HD21 LEU 42 67.323 10.350 21.809
328 HD22 LEU 42 HD22 LEU 42 66.348 11.415 22.820
329 HD23 LEU 42 HD23 LEU 42 66.096 9.670 22.879
330 H ASN 43 H ASN 43 69.993 9.276 26.141
331 HA ASN 43 HA ASN 43 70.942 7.204 26.031
332 HB2 ASN 43 HB2 ASN 43 71.372 7.781 23.092
333 HB3 ASN 43 HB3 ASN 43 71.406 6.196 23.856
334 HD21 ASN 43 HD21 ASN 43 69.736 7.270 21.674
335 HD22 ASN 43 HD22 ASN 43 68.043 7.031 22.231
336 H GLY 44 H GLY 44 72.608 9.758 26.384
337 HA2 GLY 44 HA2 GLY 44 74.827 9.917 27.086
338 HA3 GLY 44 HA3 GLY 44 75.170 8.349 26.386
339 H ARG 45 H ARG 45 73.572 10.610 24.334
340 HA ARG 45 HA ARG 45 76.136 11.567 23.234
341 HB2 ARG 45 HB2 ARG 45 75.413 9.380 22.103
342 HB3 ARG 45 HB3 ARG 45 74.086 10.310 21.419
343 HG2 ARG 45 HG2 ARG 45 75.961 11.900 20.590
344 HG3 ARG 45 HG3 ARG 45 77.017 10.517 20.880
345 HD2 ARG 45 HD2 ARG 45 76.390 10.337 18.625
346 HD3 ARG 45 HD3 ARG 45 75.374 9.174 19.475
347 HE ARG 45 HE ARG 45 74.173 11.816 19.121
348 HH11 ARG 45 HH11 ARG 45 74.592 8.568 17.770
349 HH12 ARG 45 HH12 ARG 45 73.181 8.672 16.774
350 HH21 ARG 45 HH21 ARG 45 72.326 11.907 17.791
351 HH22 ARG 45 HH22 ARG 45 71.896 10.565 16.785
352 H ARG 46 H ARG 46 75.960 13.401 21.885
353 HA ARG 46 HA ARG 46 73.477 14.922 22.441
354 HB2 ARG 46 HB2 ARG 46 75.575 16.025 23.038
355 HB3 ARG 46 HB3 ARG 46 76.191 15.798 21.408
356 HG2 ARG 46 HG2 ARG 46 75.494 18.081 21.706
357 HG3 ARG 46 HG3 ARG 46 74.423 17.282 20.554
358 HD2 ARG 46 HD2 ARG 46 73.102 18.623 22.039
359 HD3 ARG 46 HD3 ARG 46 72.796 16.926 22.391
360 HE ARG 46 HE ARG 46 74.598 17.336 24.249
361 HH11 ARG 46 HH11 ARG 46 72.105 19.624 23.189
362 HH12 ARG 46 HH12 ARG 46 72.010 20.411 24.727
363 HH21 ARG 46 HH21 ARG 46 74.435 18.406 26.249
364 HH22 ARG 46 HH22 ARG 46 73.336 19.726 26.460
365 H GLY 47 H GLY 47 71.926 14.931 20.944
366 HA2 GLY 47 HA2 GLY 47 72.789 14.959 18.103
367 HA3 GLY 47 HA3 GLY 47 71.689 13.700 18.627
368 H MET 48 H MET 48 70.496 14.734 16.787
369 HA MET 48 HA MET 48 68.862 16.986 17.842
370 HB2 MET 48 HB2 MET 48 69.595 16.345 14.979
371 HB3 MET 48 HB3 MET 48 68.457 17.597 15.458
372 HG2 MET 48 HG2 MET 48 70.131 18.914 16.422
373 HG3 MET 48 HG3 MET 48 71.279 17.577 16.465
374 HE1 MET 48 HE1 MET 48 73.127 19.858 13.966
375 HE2 MET 48 HE2 MET 48 73.236 18.867 15.421
376 HE3 MET 48 HE3 MET 48 72.271 20.343 15.430
377 H PHE 49 H PHE 49 66.670 16.814 17.797
378 HA PHE 49 HA PHE 49 65.518 14.442 16.460
379 HB2 PHE 49 HB2 PHE 49 64.218 13.935 18.594
380 HB3 PHE 49 HB3 PHE 49 65.923 13.502 18.593
381 HD1 PHE 49 HD2 PHE 49 67.550 15.205 19.634
382 HD2 PHE 49 HD1 PHE 49 63.349 15.241 20.300
383 HE1 PHE 49 HE2 PHE 49 67.890 16.531 21.675
384 HE2 PHE 49 HE1 PHE 49 63.686 16.568 22.345
385 HZ PHE 49 HZ PHE 49 65.956 17.214 23.031
386 HA PRO 50 HA PRO 50 62.069 16.956 15.453
387 HB2 PRO 50 HB2 PRO 50 60.273 14.875 16.571
388 HB3 PRO 50 HB3 PRO 50 60.319 15.570 14.948
389 HG2 PRO 50 HG2 PRO 50 61.230 13.109 15.409
390 HG3 PRO 50 HG3 PRO 50 62.045 14.188 14.261
391 HD2 PRO 50 HD2 PRO 50 62.820 13.451 17.053
392 HD3 PRO 50 HD3 PRO 50 63.845 13.706 15.626
393 H ASP 51 H ASP 51 60.871 18.537 16.297
394 HA ASP 51 HA ASP 51 60.930 18.910 19.171
395 HB2 ASP 51 HB2 ASP 51 61.177 20.798 17.627
396 HB3 ASP 51 HB3 ASP 51 59.550 20.521 17.012
397 H ASN 52 H ASN 52 58.426 18.090 16.781
398 HA ASN 52 HA ASN 52 56.284 18.226 18.729
399 HB2 ASN 52 HB2 ASN 52 56.374 17.005 15.966
400 HB3 ASN 52 HB3 ASN 52 54.911 17.225 16.923
401 HD21 ASN 52 HD21 ASN 52 54.049 19.271 17.235
402 HD22 ASN 52 HD22 ASN 52 54.581 20.669 16.237
403 H PHE 53 H PHE 53 58.743 15.991 18.400
404 HA PHE 53 HA PHE 53 57.047 13.671 19.082
405 HB2 PHE 53 HB2 PHE 53 59.943 14.013 18.353
406 HB3 PHE 53 HB3 PHE 53 59.372 12.528 19.107
407 HD1 PHE 53 HD2 PHE 53 58.114 14.781 16.398
408 HD2 PHE 53 HD1 PHE 53 59.092 10.823 17.615
409 HE1 PHE 53 HE2 PHE 53 57.401 13.934 14.202
410 HE2 PHE 53 HE1 PHE 53 58.380 9.970 15.421
411 HZ PHE 53 HZ PHE 53 57.533 11.525 13.712
412 H VAL 54 H VAL 54 59.406 15.889 20.467
413 HA VAL 54 HA VAL 54 59.164 14.470 23.064
414 HB VAL 54 HB VAL 54 61.038 15.919 23.804
415 HG11 VAL 54 HG11 VAL 54 61.383 13.646 22.860
416 HG12 VAL 54 HG12 VAL 54 62.764 14.720 22.649
417 HG13 VAL 54 HG13 VAL 54 61.689 14.390 21.291
418 HG21 VAL 54 HG21 VAL 54 61.422 16.704 20.932
419 HG22 VAL 54 HG22 VAL 54 62.181 17.376 22.375
420 HG23 VAL 54 HG23 VAL 54 60.483 17.701 22.041
421 H LYS 55 H LYS 55 58.432 15.489 24.914
422 HA LYS 55 HA LYS 55 57.005 18.045 24.368
423 HB2 LYS 55 HB2 LYS 55 56.400 15.978 26.491
424 HB3 LYS 55 HB3 LYS 55 55.452 17.416 26.137
425 HG2 LYS 55 HG2 LYS 55 55.865 15.063 24.299
426 HG3 LYS 55 HG3 LYS 55 54.404 15.432 25.218
427 HD2 LYS 55 HD2 LYS 55 54.122 17.504 23.966
428 HD3 LYS 55 HD3 LYS 55 55.613 17.187 23.079
429 HE2 LYS 55 HE2 LYS 55 53.779 16.557 21.684
430 HE3 LYS 55 HE3 LYS 55 54.577 15.084 22.229
431 HZ1 LYS 55 HZ1 LYS 55 52.185 14.868 22.361
432 HZ2 LYS 55 HZ2 LYS 55 52.078 16.230 23.357
433 HZ3 LYS 55 HZ3 LYS 55 52.849 14.833 23.917
434 H GLU 56 H GLU 56 57.514 19.829 25.464
435 HA GLU 56 HA GLU 56 59.828 20.044 27.000
436 HB2 GLU 56 HB2 GLU 56 58.692 21.972 26.031
437 HB3 GLU 56 HB3 GLU 56 57.326 21.743 27.113
438 HG2 GLU 56 HG2 GLU 56 58.617 23.546 27.952
439 HG3 GLU 56 HG3 GLU 56 58.865 22.174 29.029
440 H ILE 57 H ILE 57 60.417 19.712 29.082
441 HA ILE 57 HA ILE 57 58.361 18.482 30.813
442 HB ILE 57 HB ILE 57 61.350 18.689 31.233
443 HG12 ILE 57 HG12 ILE 57 59.676 16.340 30.303
444 HG13 ILE 57 HG13 ILE 57 60.731 17.303 29.275
445 HG21 ILE 57 HG21 ILE 57 60.131 18.471 33.328
446 HG22 ILE 57 HG22 ILE 57 61.003 16.983 32.964
447 HG23 ILE 57 HG23 ILE 57 59.263 17.073 32.696
448 HD11 ILE 57 HD11 ILE 57 61.786 15.213 29.890
449 HD12 ILE 57 HD12 ILE 57 61.596 15.599 31.601
450 HD13 ILE 57 HD13 ILE 57 62.661 16.575 30.588
451 H LYS 58 H LYS 58 57.211 20.437 31.220
452 HA LYS 58 HA LYS 58 58.564 22.615 32.586
453 HB2 LYS 58 HB2 LYS 58 56.314 23.573 32.843
454 HB3 LYS 58 HB3 LYS 58 56.630 23.075 31.189
455 HG2 LYS 58 HG2 LYS 58 55.338 20.999 31.622
456 HG3 LYS 58 HG3 LYS 58 54.939 21.631 33.220
457 HD2 LYS 58 HD2 LYS 58 54.249 22.926 30.582
458 HD3 LYS 58 HD3 LYS 58 53.132 22.041 31.621
459 HE2 LYS 58 HE2 LYS 58 54.601 24.573 32.360
460 HE3 LYS 58 HE3 LYS 58 52.907 24.469 31.890
461 HZ1 LYS 58 HZ1 LYS 58 53.122 24.573 34.278
462 HZ2 LYS 58 HZ2 LYS 58 54.131 23.216 34.290
463 HZ3 LYS 58 HZ3 LYS 58 52.510 23.060 33.830
Start of MODEL 5
1 H1 VAL 2 H1 VAL 2 66.732 23.287 27.813
2 H2 VAL 2 H2 VAL 2 67.400 22.870 29.309
3 H3 VAL 2 H3 VAL 2 66.626 24.361 29.116
4 HA VAL 2 HA VAL 2 65.248 22.789 30.328
5 HB VAL 2 HB VAL 2 63.219 22.886 28.812
6 HG11 VAL 2 HG11 VAL 2 63.759 24.648 30.420
7 HG12 VAL 2 HG12 VAL 2 63.018 25.307 28.962
8 HG13 VAL 2 HG13 VAL 2 64.759 25.449 29.207
9 HG21 VAL 2 HG21 VAL 2 64.438 22.750 26.674
10 HG22 VAL 2 HG22 VAL 2 65.119 24.347 26.977
11 HG23 VAL 2 HG23 VAL 2 63.381 24.159 26.753
12 H ASP 3 H ASP 3 64.612 20.761 30.700
13 HA ASP 3 HA ASP 3 65.572 18.700 28.872
14 HB2 ASP 3 HB2 ASP 3 65.554 18.660 31.471
15 HB3 ASP 3 HB3 ASP 3 63.866 18.188 31.299
16 H TYR 4 H TYR 4 64.342 17.083 27.885
17 HA TYR 4 HA TYR 4 61.446 17.727 27.579
18 HB2 TYR 4 HB2 TYR 4 63.519 17.325 25.463
19 HB3 TYR 4 HB3 TYR 4 61.875 16.788 25.156
20 HD1 TYR 4 HD2 TYR 4 63.548 19.834 26.564
21 HD2 TYR 4 HD1 TYR 4 60.569 18.253 23.974
22 HE1 TYR 4 HE2 TYR 4 62.928 22.115 25.891
23 HE2 TYR 4 HE1 TYR 4 59.944 20.529 23.291
24 HH TYR 4 HH TYR 4 61.836 23.219 23.902
25 H ILE 5 H ILE 5 60.061 15.987 27.097
26 HA ILE 5 HA ILE 5 61.291 13.331 27.671
27 HB ILE 5 HB ILE 5 59.847 14.058 29.519
28 HG12 ILE 5 HG12 ILE 5 58.555 11.841 27.915
29 HG13 ILE 5 HG13 ILE 5 60.014 11.654 28.884
30 HG21 ILE 5 HG21 ILE 5 57.424 14.304 29.195
31 HG22 ILE 5 HG22 ILE 5 57.652 14.159 27.453
32 HG23 ILE 5 HG23 ILE 5 58.340 15.531 28.322
33 HD11 ILE 5 HD11 ILE 5 58.119 10.819 30.097
34 HD12 ILE 5 HD12 ILE 5 57.266 12.349 29.890
35 HD13 ILE 5 HD13 ILE 5 58.720 12.277 30.886
36 H VAL 6 H VAL 6 61.090 11.812 26.154
37 HA VAL 6 HA VAL 6 59.857 12.501 23.654
38 HB VAL 6 HB VAL 6 60.747 9.763 24.572
39 HG11 VAL 6 HG11 VAL 6 60.343 10.949 21.829
40 HG12 VAL 6 HG12 VAL 6 59.395 9.666 22.580
41 HG13 VAL 6 HG13 VAL 6 61.079 9.379 22.147
42 HG21 VAL 6 HG21 VAL 6 62.550 11.406 24.838
43 HG22 VAL 6 HG22 VAL 6 62.349 11.894 23.157
44 HG23 VAL 6 HG23 VAL 6 62.898 10.263 23.542
45 H GLU 7 H GLU 7 57.888 12.203 22.911
46 HA GLU 7 HA GLU 7 56.046 10.549 24.565
47 HB2 GLU 7 HB2 GLU 7 55.540 12.996 24.399
48 HB3 GLU 7 HB3 GLU 7 55.334 12.792 22.666
49 HG2 GLU 7 HG2 GLU 7 53.459 11.321 23.019
50 HG3 GLU 7 HG3 GLU 7 53.706 11.376 24.764
51 H TYR 8 H TYR 8 57.486 10.996 21.438
52 HA TYR 8 HA TYR 8 55.952 8.644 20.464
53 HB2 TYR 8 HB2 TYR 8 56.630 11.111 18.844
54 HB3 TYR 8 HB3 TYR 8 55.883 9.648 18.211
55 HD1 TYR 8 HD2 TYR 8 53.613 8.962 19.243
56 HD2 TYR 8 HD1 TYR 8 55.300 12.847 19.647
57 HE1 TYR 8 HE2 TYR 8 51.389 9.866 19.775
58 HE2 TYR 8 HE1 TYR 8 53.081 13.761 20.181
59 HH TYR 8 HH TYR 8 50.668 13.125 19.742
60 H ASP 9 H ASP 9 57.100 7.146 19.300
61 HA ASP 9 HA ASP 9 59.971 7.233 19.653
62 HB2 ASP 9 HB2 ASP 9 59.963 5.055 18.510
63 HB3 ASP 9 HB3 ASP 9 58.741 5.117 19.774
64 H TYR 10 H TYR 10 61.593 7.664 18.241
65 HA TYR 10 HA TYR 10 60.837 8.248 15.430
66 HB2 TYR 10 HB2 TYR 10 60.836 10.388 16.693
67 HB3 TYR 10 HB3 TYR 10 62.513 10.096 17.138
68 HD1 TYR 10 HD2 TYR 10 60.365 10.318 14.086
69 HD2 TYR 10 HD1 TYR 10 64.171 11.049 15.842
70 HE1 TYR 10 HE2 TYR 10 61.100 11.420 12.016
71 HE2 TYR 10 HE1 TYR 10 64.916 12.155 13.778
72 HH TYR 10 HH TYR 10 64.285 12.078 11.309
73 H ASP 11 H ASP 11 62.165 7.394 14.000
74 HA ASP 11 HA ASP 11 64.536 5.988 14.953
75 HB2 ASP 11 HB2 ASP 11 64.723 5.168 12.664
76 HB3 ASP 11 HB3 ASP 11 63.061 5.015 13.222
77 H ALA 12 H ALA 12 66.678 6.224 14.009
78 HA ALA 12 HA ALA 12 67.217 9.100 13.455
79 HB1 ALA 12 HB1 ALA 12 69.517 8.620 14.211
80 HB2 ALA 12 HB2 ALA 12 69.028 6.964 14.571
81 HB3 ALA 12 HB3 ALA 12 68.306 8.310 15.454
82 H VAL 13 H VAL 13 66.978 9.239 11.262
83 HA VAL 13 HA VAL 13 68.149 7.286 9.474
84 HB VAL 13 HB VAL 13 67.214 10.100 8.859
85 HG11 VAL 13 HG11 VAL 13 68.617 9.168 7.107
86 HG12 VAL 13 HG12 VAL 13 66.941 9.263 6.569
87 HG13 VAL 13 HG13 VAL 13 67.623 7.713 7.061
88 HG21 VAL 13 HG21 VAL 13 65.413 8.843 9.884
89 HG22 VAL 13 HG22 VAL 13 65.690 7.498 8.776
90 HG23 VAL 13 HG23 VAL 13 65.101 9.042 8.159
91 H HIS 14 H HIS 14 69.035 10.441 10.789
92 HA HIS 14 HA HIS 14 71.547 10.425 9.238
93 HB2 HIS 14 HB2 HIS 14 70.291 12.469 11.076
94 HB3 HIS 14 HB3 HIS 14 71.885 12.668 10.357
95 HD1 HIS 14 HD1 HIS 14 72.026 13.128 7.803
96 HD2 HIS 14 HD2 HIS 14 68.134 12.862 9.342
97 HE1 HIS 14 HE1 HIS 14 70.480 14.042 6.011
98 HE2 HIS 14 HE2 HIS 14 68.117 13.831 6.922
99 H ASP 15 H ASP 15 73.581 11.041 10.420
100 HA ASP 15 HA ASP 15 73.997 9.090 12.520
101 HB2 ASP 15 HB2 ASP 15 76.333 9.889 12.487
102 HB3 ASP 15 HB3 ASP 15 75.744 9.537 10.865
103 H ASP 16 H ASP 16 73.570 12.582 12.336
104 HA ASP 16 HA ASP 16 74.100 12.824 15.236
105 HB2 ASP 16 HB2 ASP 16 73.909 15.260 14.824
106 HB3 ASP 16 HB3 ASP 16 75.128 14.504 13.804
107 H GLU 17 H GLU 17 71.663 11.534 13.821
108 HA GLU 17 HA GLU 17 69.533 13.258 14.930
109 HB2 GLU 17 HB2 GLU 17 69.430 12.258 12.588
110 HB3 GLU 17 HB3 GLU 17 69.200 10.699 13.367
111 HG2 GLU 17 HG2 GLU 17 67.121 11.327 14.249
112 HG3 GLU 17 HG3 GLU 17 67.410 13.037 13.928
113 H LEU 18 H LEU 18 68.516 12.807 16.788
114 HA LEU 18 HA LEU 18 69.470 10.485 18.300
115 HB2 LEU 18 HB2 LEU 18 68.064 12.990 18.903
116 HB3 LEU 18 HB3 LEU 18 67.526 11.619 19.855
117 HG LEU 18 HG LEU 18 70.335 12.707 19.701
118 HD11 LEU 18 HD11 LEU 18 69.965 13.112 22.120
119 HD12 LEU 18 HD12 LEU 18 68.277 12.652 21.896
120 HD13 LEU 18 HD13 LEU 18 68.922 14.070 21.072
121 HD21 LEU 18 HD21 LEU 18 70.446 10.300 19.861
122 HD22 LEU 18 HD22 LEU 18 69.270 10.302 21.173
123 HD23 LEU 18 HD23 LEU 18 70.866 11.014 21.417
124 H THR 19 H THR 19 68.477 8.613 18.629
125 HA THR 19 HA THR 19 65.902 8.186 17.265
126 HB THR 19 HB THR 19 67.499 6.146 18.829
127 HG1 THR 19 HG1 THR 19 68.943 6.530 17.303
128 HG21 THR 19 HG21 THR 19 66.375 4.540 17.360
129 HG22 THR 19 HG22 THR 19 65.514 5.860 16.569
130 HG23 THR 19 HG23 THR 19 65.204 5.497 18.266
131 H ILE 20 H ILE 20 65.033 9.842 18.934
132 HA ILE 20 HA ILE 20 64.717 9.123 21.640
133 HB ILE 20 HB ILE 20 62.802 10.727 21.624
134 HG12 ILE 20 HG12 ILE 20 63.499 11.043 18.695
135 HG13 ILE 20 HG13 ILE 20 62.044 10.261 19.301
136 HG21 ILE 20 HG21 ILE 20 65.042 11.503 22.059
137 HG22 ILE 20 HG22 ILE 20 64.187 12.696 21.083
138 HG23 ILE 20 HG23 ILE 20 65.371 11.626 20.331
139 HD11 ILE 20 HD11 ILE 20 62.799 13.143 19.717
140 HD12 ILE 20 HD12 ILE 20 61.334 12.360 20.310
141 HD13 ILE 20 HD13 ILE 20 61.600 12.533 18.576
142 H ARG 21 H ARG 21 63.528 7.736 22.704
143 HA ARG 21 HA ARG 21 61.221 6.484 21.279
144 HB2 ARG 21 HB2 ARG 21 63.022 4.893 21.742
145 HB3 ARG 21 HB3 ARG 21 63.017 5.352 23.438
146 HG2 ARG 21 HG2 ARG 21 60.652 4.527 23.557
147 HG3 ARG 21 HG3 ARG 21 60.868 3.890 21.926
148 HD2 ARG 21 HD2 ARG 21 61.260 2.133 23.532
149 HD3 ARG 21 HD3 ARG 21 62.778 2.551 22.739
150 HE ARG 21 HE ARG 21 62.544 4.080 25.122
151 HH11 ARG 21 HH11 ARG 21 63.040 0.731 24.080
152 HH12 ARG 21 HH12 ARG 21 63.921 0.293 25.504
153 HH21 ARG 21 HH21 ARG 21 63.708 3.458 26.979
154 HH22 ARG 21 HH22 ARG 21 64.301 1.841 27.151
155 H VAL 22 H VAL 22 59.218 6.435 22.275
156 HA VAL 22 HA VAL 22 58.481 8.386 24.051
157 HB VAL 22 HB VAL 22 57.236 5.633 24.056
158 HG11 VAL 22 HG11 VAL 22 55.166 6.869 24.558
159 HG12 VAL 22 HG12 VAL 22 56.096 8.365 24.632
160 HG13 VAL 22 HG13 VAL 22 56.395 7.083 25.805
161 HG21 VAL 22 HG21 VAL 22 57.349 6.202 21.774
162 HG22 VAL 22 HG22 VAL 22 56.967 7.893 22.094
163 HG23 VAL 22 HG23 VAL 22 55.723 6.658 22.283
164 H GLY 23 H GLY 23 58.793 8.891 26.117
165 HA2 GLY 23 HA2 GLY 23 58.730 8.243 28.437
166 HA3 GLY 23 HA3 GLY 23 59.362 6.664 28.009
167 H GLU 24 H GLU 24 61.348 8.195 26.146
168 HA GLU 24 HA GLU 24 63.443 8.279 28.141
169 HB2 GLU 24 HB2 GLU 24 63.457 8.997 25.206
170 HB3 GLU 24 HB3 GLU 24 64.891 8.893 26.217
171 HG2 GLU 24 HG2 GLU 24 63.008 6.617 25.629
172 HG3 GLU 24 HG3 GLU 24 64.554 6.897 24.830
173 H ILE 25 H ILE 25 64.710 9.986 28.819
174 HA ILE 25 HA ILE 25 63.449 12.661 28.424
175 HB ILE 25 HB ILE 25 64.673 13.307 30.523
176 HG12 ILE 25 HG12 ILE 25 65.028 10.316 30.842
177 HG13 ILE 25 HG13 ILE 25 66.329 11.438 30.456
178 HG21 ILE 25 HG21 ILE 25 62.291 12.801 30.517
179 HG22 ILE 25 HG22 ILE 25 63.044 12.265 32.019
180 HG23 ILE 25 HG23 ILE 25 62.643 11.091 30.766
181 HD11 ILE 25 HD11 ILE 25 64.677 11.454 32.971
182 HD12 ILE 25 HD12 ILE 25 65.988 12.569 32.587
183 HD13 ILE 25 HD13 ILE 25 66.327 10.854 32.812
184 H ILE 26 H ILE 26 64.517 14.166 27.333
185 HA ILE 26 HA ILE 26 67.314 13.545 26.589
186 HB ILE 26 HB ILE 26 65.762 15.859 25.491
187 HG12 ILE 26 HG12 ILE 26 64.275 13.934 25.236
188 HG13 ILE 26 HG13 ILE 26 64.938 14.407 23.676
189 HG21 ILE 26 HG21 ILE 26 67.994 14.112 24.483
190 HG22 ILE 26 HG22 ILE 26 68.068 15.820 24.914
191 HG23 ILE 26 HG23 ILE 26 67.165 15.307 23.492
192 HD11 ILE 26 HD11 ILE 26 65.968 12.137 25.360
193 HD12 ILE 26 HD12 ILE 26 66.487 12.570 23.731
194 HD13 ILE 26 HD13 ILE 26 64.852 11.972 24.005
195 H ARG 27 H ARG 27 68.949 14.423 27.626
196 HA ARG 27 HA ARG 27 68.502 16.520 29.563
197 HB2 ARG 27 HB2 ARG 27 71.057 15.258 28.566
198 HB3 ARG 27 HB3 ARG 27 70.937 16.331 29.953
199 HG2 ARG 27 HG2 ARG 27 69.588 14.741 31.140
200 HG3 ARG 27 HG3 ARG 27 69.497 13.698 29.720
201 HD2 ARG 27 HD2 ARG 27 72.039 14.413 31.175
202 HD3 ARG 27 HD3 ARG 27 71.133 12.919 31.410
203 HE ARG 27 HE ARG 27 71.606 13.032 28.681
204 HH11 ARG 27 HH11 ARG 27 73.607 13.046 31.603
205 HH12 ARG 27 HH12 ARG 27 74.952 12.281 30.830
206 HH21 ARG 27 HH21 ARG 27 73.402 12.024 27.705
207 HH22 ARG 27 HH22 ARG 27 74.838 11.705 28.618
208 H ASN 28 H ASN 28 68.664 18.646 29.394
209 HA ASN 28 HA ASN 28 68.953 20.686 28.457
210 HB2 ASN 28 HB2 ASN 28 71.315 20.048 29.033
211 HB3 ASN 28 HB3 ASN 28 71.536 19.575 27.352
212 HD21 ASN 28 HD21 ASN 28 71.708 21.115 25.748
213 HD22 ASN 28 HD22 ASN 28 71.923 22.857 26.134
214 H VAL 29 H VAL 29 67.100 20.087 27.042
215 HA VAL 29 HA VAL 29 67.851 19.704 24.224
216 HB VAL 29 HB VAL 29 65.128 20.012 25.490
217 HG11 VAL 29 HG11 VAL 29 65.006 20.665 23.190
218 HG12 VAL 29 HG12 VAL 29 64.327 19.045 23.335
219 HG13 VAL 29 HG13 VAL 29 65.953 19.264 22.691
220 HG21 VAL 29 HG21 VAL 29 66.840 17.649 24.850
221 HG22 VAL 29 HG22 VAL 29 65.084 17.505 24.825
222 HG23 VAL 29 HG23 VAL 29 65.906 17.995 26.306
223 H LYS 30 H LYS 30 68.536 21.398 23.122
224 HA LYS 30 HA LYS 30 67.208 24.017 23.630
225 HB2 LYS 30 HB2 LYS 30 69.896 23.345 22.422
226 HB3 LYS 30 HB3 LYS 30 69.212 24.964 22.443
227 HG2 LYS 30 HG2 LYS 30 69.155 24.870 24.911
228 HG3 LYS 30 HG3 LYS 30 69.936 23.290 24.840
229 HD2 LYS 30 HD2 LYS 30 71.762 24.642 25.149
230 HD3 LYS 30 HD3 LYS 30 71.704 24.586 23.388
231 HE2 LYS 30 HE2 LYS 30 70.500 26.767 25.091
232 HE3 LYS 30 HE3 LYS 30 72.064 26.867 24.287
233 HZ1 LYS 30 HZ1 LYS 30 70.564 27.947 22.879
234 HZ2 LYS 30 HZ2 LYS 30 69.377 26.758 23.053
235 HZ3 LYS 30 HZ3 LYS 30 70.778 26.429 22.164
236 H LYS 31 H LYS 31 66.940 25.447 21.724
237 HA LYS 31 HA LYS 31 65.769 23.839 19.548
238 HB2 LYS 31 HB2 LYS 31 65.279 26.461 20.709
239 HB3 LYS 31 HB3 LYS 31 65.356 26.532 18.954
240 HG2 LYS 31 HG2 LYS 31 63.572 24.711 20.558
241 HG3 LYS 31 HG3 LYS 31 63.074 26.204 19.760
242 HD2 LYS 31 HD2 LYS 31 64.209 23.773 18.371
243 HD3 LYS 31 HD3 LYS 31 62.498 24.197 18.447
244 HE2 LYS 31 HE2 LYS 31 62.973 26.289 17.261
245 HE3 LYS 31 HE3 LYS 31 64.679 25.855 17.181
246 HZ1 LYS 31 HZ1 LYS 31 63.534 25.341 15.118
247 HZ2 LYS 31 HZ2 LYS 31 62.453 24.333 15.940
248 HZ3 LYS 31 HZ3 LYS 31 64.092 23.924 15.855
249 H LEU 32 H LEU 32 66.609 23.573 17.593
250 HA LEU 32 HA LEU 32 69.196 24.874 17.048
251 HB2 LEU 32 HB2 LEU 32 67.680 22.674 15.643
252 HB3 LEU 32 HB3 LEU 32 69.226 23.295 15.096
253 HG LEU 32 HG LEU 32 68.790 22.021 17.797
254 HD11 LEU 32 HD11 LEU 32 69.946 20.820 15.285
255 HD12 LEU 32 HD12 LEU 32 68.394 20.403 16.010
256 HD13 LEU 32 HD13 LEU 32 69.892 20.054 16.872
257 HD21 LEU 32 HD21 LEU 32 71.275 22.809 16.279
258 HD22 LEU 32 HD22 LEU 32 71.260 21.872 17.772
259 HD23 LEU 32 HD23 LEU 32 70.669 23.532 17.770
260 H GLN 33 H GLN 33 69.505 25.230 14.499
261 HA GLN 33 HA GLN 33 67.704 27.440 13.904
262 HB2 GLN 33 HB2 GLN 33 70.120 26.291 12.520
263 HB3 GLN 33 HB3 GLN 33 69.161 27.572 11.795
264 HG2 GLN 33 HG2 GLN 33 71.046 28.547 12.887
265 HG3 GLN 33 HG3 GLN 33 69.594 28.970 13.790
266 HE21 GLN 33 HE21 GLN 33 69.255 28.159 15.847
267 HE22 GLN 33 HE22 GLN 33 70.566 27.339 16.762
268 H GLU 34 H GLU 34 67.420 24.159 13.474
269 HA GLU 34 HA GLU 34 66.006 24.426 10.883
270 HB2 GLU 34 HB2 GLU 34 66.715 21.930 12.433
271 HB3 GLU 34 HB3 GLU 34 66.038 21.990 10.813
272 HG2 GLU 34 HG2 GLU 34 68.055 23.007 9.965
273 HG3 GLU 34 HG3 GLU 34 68.732 23.083 11.593
274 H GLU 35 H GLU 35 63.889 24.734 10.898
275 HA GLU 35 HA GLU 35 62.368 24.706 13.303
276 HB2 GLU 35 HB2 GLU 35 61.422 24.562 10.431
277 HB3 GLU 35 HB3 GLU 35 60.389 24.902 11.812
278 HG2 GLU 35 HG2 GLU 35 62.691 26.592 10.856
279 HG3 GLU 35 HG3 GLU 35 60.977 26.938 10.633
280 H GLY 36 H GLY 36 61.702 23.068 14.493
281 HA2 GLY 36 HA2 GLY 36 60.473 21.054 14.787
282 HA3 GLY 36 HA3 GLY 36 60.773 20.617 13.113
283 H TRP 37 H TRP 37 63.505 21.800 14.854
284 HA TRP 37 HA TRP 37 64.342 19.025 15.482
285 HB2 TRP 37 HB2 TRP 37 65.938 21.074 13.938
286 HB3 TRP 37 HB3 TRP 37 66.630 19.607 14.623
287 HD1 TRP 37 HD1 TRP 37 64.778 20.877 11.625
288 HE1 TRP 37 HE1 TRP 37 64.286 18.942 9.968
289 HE3 TRP 37 HE3 TRP 37 66.032 16.959 14.661
290 HZ2 TRP 37 HZ2 TRP 37 64.432 16.117 10.015
291 HZ3 TRP 37 HZ3 TRP 37 65.824 14.671 13.779
292 HH2 TRP 37 HH2 TRP 37 65.040 14.263 11.502
293 H LEU 38 H LEU 38 65.301 18.743 17.351
294 HA LEU 38 HA LEU 38 66.108 21.187 18.866
295 HB2 LEU 38 HB2 LEU 38 64.752 18.673 19.842
296 HB3 LEU 38 HB3 LEU 38 65.496 19.840 20.917
297 HG LEU 38 HG LEU 38 63.261 20.528 19.016
298 HD11 LEU 38 HD11 LEU 38 62.476 18.867 20.608
299 HD12 LEU 38 HD12 LEU 38 61.784 20.450 20.962
300 HD13 LEU 38 HD13 LEU 38 63.111 19.829 21.943
301 HD21 LEU 38 HD21 LEU 38 64.654 22.407 19.719
302 HD22 LEU 38 HD22 LEU 38 64.393 21.973 21.408
303 HD23 LEU 38 HD23 LEU 38 63.038 22.511 20.416
304 H GLU 39 H GLU 39 67.765 20.783 20.552
305 HA GLU 39 HA GLU 39 69.558 18.542 19.734
306 HB2 GLU 39 HB2 GLU 39 70.362 20.779 18.960
307 HB3 GLU 39 HB3 GLU 39 70.437 21.292 20.638
308 HG2 GLU 39 HG2 GLU 39 72.630 20.672 19.841
309 HG3 GLU 39 HG3 GLU 39 72.095 19.552 21.093
310 H GLY 40 H GLY 40 69.823 17.097 21.308
311 HA2 GLY 40 HA2 GLY 40 70.300 18.066 24.042
312 HA3 GLY 40 HA3 GLY 40 68.815 17.158 23.833
313 H GLU 41 H GLU 41 70.748 16.361 25.598
314 HA GLU 41 HA GLU 41 72.268 14.220 24.259
315 HB2 GLU 41 HB2 GLU 41 72.188 15.136 27.138
316 HB3 GLU 41 HB3 GLU 41 73.189 13.819 26.549
317 HG2 GLU 41 HG2 GLU 41 74.616 15.658 26.651
318 HG3 GLU 41 HG3 GLU 41 74.203 15.507 24.945
319 H LEU 42 H LEU 42 71.439 12.322 23.909
320 HA LEU 42 HA LEU 42 69.587 11.192 25.945
321 HB2 LEU 42 HB2 LEU 42 68.162 11.908 24.155
322 HB3 LEU 42 HB3 LEU 42 69.218 11.194 22.953
323 HG LEU 42 HG LEU 42 68.649 8.942 23.831
324 HD11 LEU 42 HD11 LEU 42 66.763 8.683 25.343
325 HD12 LEU 42 HD12 LEU 42 66.632 10.434 25.502
326 HD13 LEU 42 HD13 LEU 42 68.060 9.598 26.112
327 HD21 LEU 42 HD21 LEU 42 66.425 8.845 22.868
328 HD22 LEU 42 HD22 LEU 42 67.462 9.903 21.911
329 HD23 LEU 42 HD23 LEU 42 66.268 10.596 23.007
330 H ASN 43 H ASN 43 70.057 9.201 26.591
331 HA ASN 43 HA ASN 43 71.171 7.219 26.760
332 HB2 ASN 43 HB2 ASN 43 71.290 7.381 23.739
333 HB3 ASN 43 HB3 ASN 43 71.615 5.937 24.692
334 HD21 ASN 43 HD21 ASN 43 69.590 6.490 22.614
335 HD22 ASN 43 HD22 ASN 43 68.014 6.138 23.404
336 H GLY 44 H GLY 44 72.697 9.808 26.757
337 HA2 GLY 44 HA2 GLY 44 74.946 10.164 27.250
338 HA3 GLY 44 HA3 GLY 44 75.331 8.554 26.680
339 H ARG 45 H ARG 45 73.482 10.423 24.478
340 HA ARG 45 HA ARG 45 75.937 11.399 23.149
341 HB2 ARG 45 HB2 ARG 45 75.171 9.093 22.281
342 HB3 ARG 45 HB3 ARG 45 73.815 9.958 21.572
343 HG2 ARG 45 HG2 ARG 45 76.476 11.079 21.000
344 HG3 ARG 45 HG3 ARG 45 76.143 9.493 20.304
345 HD2 ARG 45 HD2 ARG 45 74.294 11.853 20.023
346 HD3 ARG 45 HD3 ARG 45 75.554 11.466 18.853
347 HE ARG 45 HE ARG 45 74.050 9.127 19.207
348 HH11 ARG 45 HH11 ARG 45 73.521 12.426 18.040
349 HH12 ARG 45 HH12 ARG 45 72.271 11.961 16.937
350 HH21 ARG 45 HH21 ARG 45 72.410 8.559 17.735
351 HH22 ARG 45 HH22 ARG 45 71.642 9.766 16.759
352 H ARG 46 H ARG 46 75.657 13.180 21.797
353 HA ARG 46 HA ARG 46 73.117 14.611 22.355
354 HB2 ARG 46 HB2 ARG 46 75.288 15.722 22.900
355 HB3 ARG 46 HB3 ARG 46 75.701 15.681 21.191
356 HG2 ARG 46 HG2 ARG 46 73.762 17.090 20.695
357 HG3 ARG 46 HG3 ARG 46 73.371 17.147 22.414
358 HD2 ARG 46 HD2 ARG 46 74.538 19.156 21.856
359 HD3 ARG 46 HD3 ARG 46 75.620 18.147 22.816
360 HE ARG 46 HE ARG 46 75.949 17.742 19.965
361 HH11 ARG 46 HH11 ARG 46 76.855 19.805 22.697
362 HH12 ARG 46 HH12 ARG 46 78.324 20.343 21.957
363 HH21 ARG 46 HH21 ARG 46 77.890 18.477 19.029
364 HH22 ARG 46 HH22 ARG 46 78.912 19.591 19.874
365 H GLY 47 H GLY 47 71.579 14.679 20.855
366 HA2 GLY 47 HA2 GLY 47 72.398 14.758 18.021
367 HA3 GLY 47 HA3 GLY 47 71.447 13.373 18.513
368 H MET 48 H MET 48 70.799 15.324 16.532
369 HA MET 48 HA MET 48 68.779 17.040 17.711
370 HB2 MET 48 HB2 MET 48 68.338 17.798 15.472
371 HB3 MET 48 HB3 MET 48 70.079 17.666 15.676
372 HG2 MET 48 HG2 MET 48 70.116 15.603 14.438
373 HG3 MET 48 HG3 MET 48 68.357 15.592 14.336
374 HE1 MET 48 HE1 MET 48 68.379 15.285 11.733
375 HE2 MET 48 HE2 MET 48 70.142 15.216 11.762
376 HE3 MET 48 HE3 MET 48 69.319 16.288 10.628
377 H PHE 49 H PHE 49 66.587 16.855 17.690
378 HA PHE 49 HA PHE 49 65.437 14.419 16.461
379 HB2 PHE 49 HB2 PHE 49 64.083 14.163 18.672
380 HB3 PHE 49 HB3 PHE 49 65.725 13.533 18.599
381 HD1 PHE 49 HD2 PHE 49 67.537 14.654 19.754
382 HD2 PHE 49 HD1 PHE 49 63.533 16.050 20.060
383 HE1 PHE 49 HE2 PHE 49 68.168 16.019 21.695
384 HE2 PHE 49 HE1 PHE 49 64.160 17.425 22.004
385 HZ PHE 49 HZ PHE 49 66.479 17.407 22.823
386 HA PRO 50 HA PRO 50 61.993 16.919 15.381
387 HB2 PRO 50 HB2 PRO 50 60.113 14.944 16.515
388 HB3 PRO 50 HB3 PRO 50 60.285 15.505 14.850
389 HG2 PRO 50 HG2 PRO 50 61.082 13.059 15.582
390 HG3 PRO 50 HG3 PRO 50 61.981 14.005 14.380
391 HD2 PRO 50 HD2 PRO 50 62.596 13.540 17.272
392 HD3 PRO 50 HD3 PRO 50 63.695 13.576 15.877
393 H ASP 51 H ASP 51 60.706 18.506 16.135
394 HA ASP 51 HA ASP 51 60.785 19.061 18.968
395 HB2 ASP 51 HB2 ASP 51 59.851 20.429 16.531
396 HB3 ASP 51 HB3 ASP 51 58.973 20.852 17.996
397 H ASN 52 H ASN 52 58.251 17.926 16.737
398 HA ASN 52 HA ASN 52 56.199 18.052 18.798
399 HB2 ASN 52 HB2 ASN 52 56.190 16.804 16.047
400 HB3 ASN 52 HB3 ASN 52 54.777 16.938 17.089
401 HD21 ASN 52 HD21 ASN 52 55.311 18.028 14.410
402 HD22 ASN 52 HD22 ASN 52 55.086 19.803 14.578
403 H PHE 53 H PHE 53 58.738 15.956 18.510
404 HA PHE 53 HA PHE 53 57.140 13.578 19.265
405 HB2 PHE 53 HB2 PHE 53 59.978 13.977 18.362
406 HB3 PHE 53 HB3 PHE 53 59.498 12.497 19.187
407 HD1 PHE 53 HD1 PHE 53 58.136 14.657 16.451
408 HD2 PHE 53 HD2 PHE 53 59.053 10.730 17.810
409 HE1 PHE 53 HE1 PHE 53 57.321 13.734 14.323
410 HE2 PHE 53 HE2 PHE 53 58.239 9.801 15.683
411 HZ PHE 53 HZ PHE 53 57.372 11.303 13.937
412 H VAL 54 H VAL 54 59.435 15.926 20.511
413 HA VAL 54 HA VAL 54 59.312 14.546 23.148
414 HB VAL 54 HB VAL 54 61.284 15.921 23.769
415 HG11 VAL 54 HG11 VAL 54 61.663 14.211 21.316
416 HG12 VAL 54 HG12 VAL 54 61.566 13.632 22.978
417 HG13 VAL 54 HG13 VAL 54 62.917 14.649 22.477
418 HG21 VAL 54 HG21 VAL 54 61.467 16.629 20.848
419 HG22 VAL 54 HG22 VAL 54 62.505 17.177 22.162
420 HG23 VAL 54 HG23 VAL 54 60.834 17.722 22.077
421 H LYS 55 H LYS 55 58.448 15.528 24.890
422 HA LYS 55 HA LYS 55 57.300 18.233 24.405
423 HB2 LYS 55 HB2 LYS 55 55.649 16.482 24.852
424 HB3 LYS 55 HB3 LYS 55 56.468 16.071 26.351
425 HG2 LYS 55 HG2 LYS 55 55.926 18.257 27.270
426 HG3 LYS 55 HG3 LYS 55 55.143 18.710 25.754
427 HD2 LYS 55 HD2 LYS 55 53.461 18.043 27.353
428 HD3 LYS 55 HD3 LYS 55 53.551 16.838 26.066
429 HE2 LYS 55 HE2 LYS 55 54.954 15.425 27.508
430 HE3 LYS 55 HE3 LYS 55 54.824 16.624 28.794
431 HZ1 LYS 55 HZ1 LYS 55 53.258 14.827 29.125
432 HZ2 LYS 55 HZ2 LYS 55 52.569 15.098 27.606
433 HZ3 LYS 55 HZ3 LYS 55 52.426 16.268 28.819
434 H GLU 56 H GLU 56 58.010 19.933 25.537
435 HA GLU 56 HA GLU 56 60.268 19.741 27.215
436 HB2 GLU 56 HB2 GLU 56 59.455 21.804 26.043
437 HB3 GLU 56 HB3 GLU 56 58.198 21.943 27.264
438 HG2 GLU 56 HG2 GLU 56 59.877 22.201 28.997
439 HG3 GLU 56 HG3 GLU 56 61.160 21.997 27.804
440 H ILE 57 H ILE 57 60.619 19.538 29.372
441 HA ILE 57 HA ILE 57 58.257 18.713 30.948
442 HB ILE 57 HB ILE 57 61.184 18.521 31.687
443 HG12 ILE 57 HG12 ILE 57 59.345 16.378 30.590
444 HG13 ILE 57 HG13 ILE 57 60.615 17.181 29.674
445 HG21 ILE 57 HG21 ILE 57 59.688 18.519 33.611
446 HG22 ILE 57 HG22 ILE 57 60.410 16.928 33.379
447 HG23 ILE 57 HG23 ILE 57 58.741 17.219 32.888
448 HD11 ILE 57 HD11 ILE 57 62.264 16.285 31.296
449 HD12 ILE 57 HD12 ILE 57 61.407 15.047 30.380
450 HD13 ILE 57 HD13 ILE 57 60.957 15.375 32.053
451 H LYS 58 H LYS 58 57.342 20.785 31.247
452 HA LYS 58 HA LYS 58 58.908 22.826 32.628
453 HB2 LYS 58 HB2 LYS 58 57.167 23.424 30.989
454 HB3 LYS 58 HB3 LYS 58 55.945 22.707 32.030
455 HG2 LYS 58 HG2 LYS 58 56.445 24.362 33.760
456 HG3 LYS 58 HG3 LYS 58 57.673 25.079 32.716
457 HD2 LYS 58 HD2 LYS 58 55.654 26.384 32.563
458 HD3 LYS 58 HD3 LYS 58 55.909 25.539 31.035
459 HE2 LYS 58 HE2 LYS 58 54.292 23.833 31.704
460 HE3 LYS 58 HE3 LYS 58 54.052 24.656 33.245
461 HZ1 LYS 58 HZ1 LYS 58 53.439 25.794 30.569
462 HZ2 LYS 58 HZ2 LYS 58 53.190 26.569 32.052
463 HZ3 LYS 58 HZ3 LYS 58 52.302 25.183 31.664
Start of MODEL 6
1 H1 VAL 2 H1 VAL 2 66.861 23.481 28.001
2 H2 VAL 2 H2 VAL 2 67.503 23.064 29.509
3 H3 VAL 2 H3 VAL 2 66.694 24.535 29.315
4 HA VAL 2 HA VAL 2 65.358 22.859 30.473
5 HB VAL 2 HB VAL 2 64.230 24.654 29.272
6 HG11 VAL 2 HG11 VAL 2 65.175 24.357 27.065
7 HG12 VAL 2 HG12 VAL 2 63.414 24.326 26.972
8 HG13 VAL 2 HG13 VAL 2 64.328 22.821 26.880
9 HG21 VAL 2 HG21 VAL 2 62.867 22.914 30.336
10 HG22 VAL 2 HG22 VAL 2 62.845 22.012 28.821
11 HG23 VAL 2 HG23 VAL 2 62.071 23.594 28.916
12 H ASP 3 H ASP 3 64.562 20.835 30.647
13 HA ASP 3 HA ASP 3 65.615 18.897 28.700
14 HB2 ASP 3 HB2 ASP 3 64.175 18.500 31.332
15 HB3 ASP 3 HB3 ASP 3 64.856 17.208 30.347
16 H TYR 4 H TYR 4 64.345 17.165 27.853
17 HA TYR 4 HA TYR 4 61.448 17.805 27.584
18 HB2 TYR 4 HB2 TYR 4 63.450 17.457 25.382
19 HB3 TYR 4 HB3 TYR 4 61.799 16.917 25.134
20 HD1 TYR 4 HD2 TYR 4 63.490 19.958 26.541
21 HD2 TYR 4 HD1 TYR 4 60.465 18.388 23.996
22 HE1 TYR 4 HE2 TYR 4 62.834 22.242 25.918
23 HE2 TYR 4 HE1 TYR 4 59.804 20.667 23.364
24 HH TYR 4 HH TYR 4 61.682 23.358 23.947
25 H ILE 5 H ILE 5 60.093 16.034 27.050
26 HA ILE 5 HA ILE 5 61.392 13.404 27.588
27 HB ILE 5 HB ILE 5 59.962 14.074 29.470
28 HG12 ILE 5 HG12 ILE 5 58.703 11.841 27.862
29 HG13 ILE 5 HG13 ILE 5 60.184 11.683 28.800
30 HG21 ILE 5 HG21 ILE 5 57.526 14.253 29.185
31 HG22 ILE 5 HG22 ILE 5 57.735 14.145 27.438
32 HG23 ILE 5 HG23 ILE 5 58.396 15.520 28.322
33 HD11 ILE 5 HD11 ILE 5 58.929 12.211 30.838
34 HD12 ILE 5 HD12 ILE 5 58.306 10.780 30.016
35 HD13 ILE 5 HD13 ILE 5 57.450 12.316 29.883
36 H VAL 6 H VAL 6 61.118 11.835 26.115
37 HA VAL 6 HA VAL 6 59.917 12.539 23.603
38 HB VAL 6 HB VAL 6 60.733 9.781 24.523
39 HG11 VAL 6 HG11 VAL 6 59.447 9.753 22.487
40 HG12 VAL 6 HG12 VAL 6 61.138 9.420 22.108
41 HG13 VAL 6 HG13 VAL 6 60.459 11.016 21.786
42 HG21 VAL 6 HG21 VAL 6 62.566 11.384 24.875
43 HG22 VAL 6 HG22 VAL 6 62.444 11.877 23.187
44 HG23 VAL 6 HG23 VAL 6 62.932 10.232 23.592
45 H GLU 7 H GLU 7 57.921 12.316 22.888
46 HA GLU 7 HA GLU 7 56.082 10.609 24.489
47 HB2 GLU 7 HB2 GLU 7 54.261 12.009 23.686
48 HB3 GLU 7 HB3 GLU 7 55.498 13.005 24.439
49 HG2 GLU 7 HG2 GLU 7 56.369 13.537 22.181
50 HG3 GLU 7 HG3 GLU 7 55.019 12.642 21.491
51 H TYR 8 H TYR 8 57.606 11.014 21.427
52 HA TYR 8 HA TYR 8 55.998 8.748 20.373
53 HB2 TYR 8 HB2 TYR 8 56.896 11.146 18.756
54 HB3 TYR 8 HB3 TYR 8 56.056 9.734 18.128
55 HD1 TYR 8 HD2 TYR 8 53.846 9.257 19.831
56 HD2 TYR 8 HD1 TYR 8 55.545 13.001 18.739
57 HE1 TYR 8 HE2 TYR 8 51.692 10.354 20.266
58 HE2 TYR 8 HE1 TYR 8 53.395 14.110 19.172
59 HH TYR 8 HH TYR 8 50.932 13.410 19.216
60 H ASP 9 H ASP 9 57.121 7.223 19.189
61 HA ASP 9 HA ASP 9 59.990 7.194 19.689
62 HB2 ASP 9 HB2 ASP 9 58.643 5.137 19.835
63 HB3 ASP 9 HB3 ASP 9 58.250 5.271 18.124
64 H TYR 10 H TYR 10 61.612 7.760 18.375
65 HA TYR 10 HA TYR 10 60.927 8.248 15.513
66 HB2 TYR 10 HB2 TYR 10 61.159 10.409 16.564
67 HB3 TYR 10 HB3 TYR 10 62.667 9.925 17.331
68 HD1 TYR 10 HD2 TYR 10 61.089 10.797 14.109
69 HD2 TYR 10 HD1 TYR 10 64.739 10.018 16.150
70 HE1 TYR 10 HE2 TYR 10 62.345 11.651 12.176
71 HE2 TYR 10 HE1 TYR 10 66.006 10.870 14.224
72 HH TYR 10 HH TYR 10 65.618 11.142 11.737
73 H ASP 11 H ASP 11 62.180 7.303 14.049
74 HA ASP 11 HA ASP 11 64.490 5.758 15.056
75 HB2 ASP 11 HB2 ASP 11 63.103 5.734 12.363
76 HB3 ASP 11 HB3 ASP 11 64.414 4.657 12.840
77 H ALA 12 H ALA 12 66.410 6.696 15.078
78 HA ALA 12 HA ALA 12 67.017 9.068 13.616
79 HB1 ALA 12 HB1 ALA 12 68.921 7.087 14.858
80 HB2 ALA 12 HB2 ALA 12 68.159 8.445 15.687
81 HB3 ALA 12 HB3 ALA 12 69.305 8.740 14.380
82 H VAL 13 H VAL 13 67.019 9.170 11.488
83 HA VAL 13 HA VAL 13 67.982 6.900 9.900
84 HB VAL 13 HB VAL 13 67.408 8.275 7.935
85 HG11 VAL 13 HG11 VAL 13 65.707 6.863 8.975
86 HG12 VAL 13 HG12 VAL 13 64.993 8.317 8.277
87 HG13 VAL 13 HG13 VAL 13 65.231 8.200 10.020
88 HG21 VAL 13 HG21 VAL 13 66.276 10.433 8.225
89 HG22 VAL 13 HG22 VAL 13 67.935 10.483 8.814
90 HG23 VAL 13 HG23 VAL 13 66.598 10.366 9.956
91 H HIS 14 H HIS 14 68.996 10.150 10.824
92 HA HIS 14 HA HIS 14 71.477 9.868 9.246
93 HB2 HIS 14 HB2 HIS 14 70.373 12.142 10.905
94 HB3 HIS 14 HB3 HIS 14 71.922 12.198 10.072
95 HD1 HIS 14 HD1 HIS 14 68.311 12.740 9.607
96 HD2 HIS 14 HD2 HIS 14 71.673 12.098 7.183
97 HE1 HIS 14 HE1 HIS 14 67.648 13.439 7.260
98 HE2 HIS 14 HE2 HIS 14 69.669 13.007 5.781
99 H ASP 15 H ASP 15 73.489 10.843 10.486
100 HA ASP 15 HA ASP 15 73.928 8.988 12.697
101 HB2 ASP 15 HB2 ASP 15 75.750 11.017 11.383
102 HB3 ASP 15 HB3 ASP 15 76.258 9.899 12.644
103 H ASP 16 H ASP 16 73.448 12.448 12.235
104 HA ASP 16 HA ASP 16 74.137 13.072 15.003
105 HB2 ASP 16 HB2 ASP 16 73.534 15.343 14.444
106 HB3 ASP 16 HB3 ASP 16 74.474 14.680 13.111
107 H GLU 17 H GLU 17 71.290 12.253 13.144
108 HA GLU 17 HA GLU 17 69.311 13.279 14.859
109 HB2 GLU 17 HB2 GLU 17 69.466 11.321 12.695
110 HB3 GLU 17 HB3 GLU 17 68.214 10.948 13.872
111 HG2 GLU 17 HG2 GLU 17 67.518 12.341 11.893
112 HG3 GLU 17 HG3 GLU 17 67.089 12.970 13.482
113 H LEU 18 H LEU 18 68.386 12.677 16.695
114 HA LEU 18 HA LEU 18 69.687 10.452 18.137
115 HB2 LEU 18 HB2 LEU 18 67.922 12.728 18.991
116 HB3 LEU 18 HB3 LEU 18 68.233 11.371 20.057
117 HG LEU 18 HG LEU 18 70.294 13.268 18.937
118 HD11 LEU 18 HD11 LEU 18 68.896 13.013 21.553
119 HD12 LEU 18 HD12 LEU 18 69.320 14.458 20.635
120 HD13 LEU 18 HD13 LEU 18 70.565 13.578 21.520
121 HD21 LEU 18 HD21 LEU 18 71.880 12.075 20.389
122 HD22 LEU 18 HD22 LEU 18 71.233 11.041 19.116
123 HD23 LEU 18 HD23 LEU 18 70.627 10.892 20.764
124 H THR 19 H THR 19 68.763 8.579 18.654
125 HA THR 19 HA THR 19 66.138 8.034 17.446
126 HB THR 19 HB THR 19 67.876 6.135 19.045
127 HG1 THR 19 HG1 THR 19 69.171 6.444 17.368
128 HG21 THR 19 HG21 THR 19 65.551 5.414 18.741
129 HG22 THR 19 HG22 THR 19 66.662 4.396 17.823
130 HG23 THR 19 HG23 THR 19 65.712 5.631 16.998
131 H ILE 20 H ILE 20 64.918 9.509 18.846
132 HA ILE 20 HA ILE 20 64.878 8.957 21.695
133 HB ILE 20 HB ILE 20 63.030 10.604 21.744
134 HG12 ILE 20 HG12 ILE 20 63.503 10.794 18.760
135 HG13 ILE 20 HG13 ILE 20 62.070 10.110 19.521
136 HG21 ILE 20 HG21 ILE 20 65.297 11.371 21.994
137 HG22 ILE 20 HG22 ILE 20 64.388 12.544 21.044
138 HG23 ILE 20 HG23 ILE 20 65.505 11.437 20.245
139 HD11 ILE 20 HD11 ILE 20 62.972 12.968 19.786
140 HD12 ILE 20 HD12 ILE 20 61.492 12.265 20.440
141 HD13 ILE 20 HD13 ILE 20 61.715 12.387 18.695
142 H ARG 21 H ARG 21 63.547 7.730 22.844
143 HA ARG 21 HA ARG 21 61.297 6.421 21.380
144 HB2 ARG 21 HB2 ARG 21 62.944 5.308 23.664
145 HB3 ARG 21 HB3 ARG 21 61.613 4.487 22.862
146 HG2 ARG 21 HG2 ARG 21 62.853 4.324 20.824
147 HG3 ARG 21 HG3 ARG 21 64.139 5.344 21.467
148 HD2 ARG 21 HD2 ARG 21 63.353 2.664 22.606
149 HD3 ARG 21 HD3 ARG 21 64.675 2.913 21.465
150 HE ARG 21 HE ARG 21 64.901 4.611 23.796
151 HH11 ARG 21 HH11 ARG 21 65.502 1.344 22.574
152 HH12 ARG 21 HH12 ARG 21 66.777 1.029 23.702
153 HH21 ARG 21 HH21 ARG 21 66.582 4.156 25.261
154 HH22 ARG 21 HH22 ARG 21 67.390 2.625 25.229
155 H VAL 22 H VAL 22 59.293 6.396 22.302
156 HA VAL 22 HA VAL 22 58.492 8.414 23.988
157 HB VAL 22 HB VAL 22 57.222 5.670 23.956
158 HG11 VAL 22 HG11 VAL 22 55.142 6.930 24.397
159 HG12 VAL 22 HG12 VAL 22 56.099 8.403 24.557
160 HG13 VAL 22 HG13 VAL 22 56.324 7.078 25.698
161 HG21 VAL 22 HG21 VAL 22 57.444 6.311 21.686
162 HG22 VAL 22 HG22 VAL 22 56.979 7.974 22.038
163 HG23 VAL 22 HG23 VAL 22 55.782 6.684 22.145
164 H GLY 23 H GLY 23 58.872 8.985 26.019
165 HA2 GLY 23 HA2 GLY 23 58.630 8.376 28.366
166 HA3 GLY 23 HA3 GLY 23 59.284 6.791 27.997
167 H GLU 24 H GLU 24 61.367 8.249 26.198
168 HA GLU 24 HA GLU 24 63.343 8.414 28.305
169 HB2 GLU 24 HB2 GLU 24 63.475 8.922 25.336
170 HB3 GLU 24 HB3 GLU 24 64.868 9.061 26.398
171 HG2 GLU 24 HG2 GLU 24 64.441 6.668 27.069
172 HG3 GLU 24 HG3 GLU 24 63.283 6.599 25.741
173 H ILE 25 H ILE 25 64.737 10.157 28.773
174 HA ILE 25 HA ILE 25 63.473 12.816 28.275
175 HB ILE 25 HB ILE 25 65.044 11.892 30.688
176 HG12 ILE 25 HG12 ILE 25 62.158 12.767 30.413
177 HG13 ILE 25 HG13 ILE 25 62.700 11.102 30.595
178 HG21 ILE 25 HG21 ILE 25 65.629 14.173 30.236
179 HG22 ILE 25 HG22 ILE 25 64.510 14.151 31.599
180 HG23 ILE 25 HG23 ILE 25 63.938 14.609 29.995
181 HD11 ILE 25 HD11 ILE 25 61.878 11.967 32.693
182 HD12 ILE 25 HD12 ILE 25 63.021 13.308 32.614
183 HD13 ILE 25 HD13 ILE 25 63.612 11.657 32.799
184 H ILE 26 H ILE 26 64.644 14.301 27.246
185 HA ILE 26 HA ILE 26 67.454 13.584 26.640
186 HB ILE 26 HB ILE 26 65.775 15.781 25.426
187 HG12 ILE 26 HG12 ILE 26 65.919 14.165 23.396
188 HG13 ILE 26 HG13 ILE 26 66.270 12.931 24.601
189 HG21 ILE 26 HG21 ILE 26 68.439 14.624 24.623
190 HG22 ILE 26 HG22 ILE 26 68.155 16.226 25.301
191 HG23 ILE 26 HG23 ILE 26 67.529 15.821 23.706
192 HD11 ILE 26 HD11 ILE 26 63.875 13.127 23.873
193 HD12 ILE 26 HD12 ILE 26 63.829 14.673 24.719
194 HD13 ILE 26 HD13 ILE 26 64.155 13.188 25.611
195 H ARG 27 H ARG 27 69.120 14.523 27.610
196 HA ARG 27 HA ARG 27 68.610 16.617 29.548
197 HB2 ARG 27 HB2 ARG 27 71.175 15.283 28.679
198 HB3 ARG 27 HB3 ARG 27 71.050 16.424 30.008
199 HG2 ARG 27 HG2 ARG 27 71.022 14.347 31.049
200 HG3 ARG 27 HG3 ARG 27 69.320 14.806 30.987
201 HD2 ARG 27 HD2 ARG 27 68.964 13.388 29.065
202 HD3 ARG 27 HD3 ARG 27 70.684 13.016 28.978
203 HE ARG 27 HE ARG 27 69.695 12.279 31.544
204 HH11 ARG 27 HH11 ARG 27 69.498 11.307 28.142
205 HH12 ARG 27 HH12 ARG 27 69.194 9.642 28.510
206 HH21 ARG 27 HH21 ARG 27 69.293 10.076 31.983
207 HH22 ARG 27 HH22 ARG 27 69.078 8.943 30.691
208 H ASN 28 H ASN 28 68.739 18.732 29.329
209 HA ASN 28 HA ASN 28 69.183 20.773 28.452
210 HB2 ASN 28 HB2 ASN 28 71.657 19.398 27.383
211 HB3 ASN 28 HB3 ASN 28 71.397 21.137 27.338
212 HD21 ASN 28 HD21 ASN 28 73.199 21.570 28.587
213 HD22 ASN 28 HD22 ASN 28 73.226 21.211 30.349
214 H VAL 29 H VAL 29 67.215 20.027 27.154
215 HA VAL 29 HA VAL 29 67.768 19.715 24.290
216 HB VAL 29 HB VAL 29 65.133 20.013 25.732
217 HG11 VAL 29 HG11 VAL 29 65.811 19.254 22.899
218 HG12 VAL 29 HG12 VAL 29 64.816 20.601 23.452
219 HG13 VAL 29 HG13 VAL 29 64.239 18.945 23.637
220 HG21 VAL 29 HG21 VAL 29 66.227 17.456 24.634
221 HG22 VAL 29 HG22 VAL 29 64.987 17.702 25.862
222 HG23 VAL 29 HG23 VAL 29 66.678 18.006 26.245
223 H LYS 30 H LYS 30 68.474 21.464 23.263
224 HA LYS 30 HA LYS 30 67.074 24.040 23.794
225 HB2 LYS 30 HB2 LYS 30 69.733 23.546 22.433
226 HB3 LYS 30 HB3 LYS 30 69.029 25.118 22.789
227 HG2 LYS 30 HG2 LYS 30 69.190 24.666 25.177
228 HG3 LYS 30 HG3 LYS 30 69.868 23.072 24.834
229 HD2 LYS 30 HD2 LYS 30 71.772 24.146 23.705
230 HD3 LYS 30 HD3 LYS 30 71.097 25.729 24.095
231 HE2 LYS 30 HE2 LYS 30 71.277 25.216 26.481
232 HE3 LYS 30 HE3 LYS 30 71.947 23.633 26.091
233 HZ1 LYS 30 HZ1 LYS 30 73.185 26.244 25.404
234 HZ2 LYS 30 HZ2 LYS 30 73.832 24.722 25.051
235 HZ3 LYS 30 HZ3 LYS 30 73.677 25.223 26.659
236 H LYS 31 H LYS 31 66.724 25.475 21.912
237 HA LYS 31 HA LYS 31 65.554 23.875 19.750
238 HB2 LYS 31 HB2 LYS 31 64.342 25.798 20.767
239 HB3 LYS 31 HB3 LYS 31 65.571 26.877 20.121
240 HG2 LYS 31 HG2 LYS 31 64.948 26.344 17.871
241 HG3 LYS 31 HG3 LYS 31 63.845 25.085 18.427
242 HD2 LYS 31 HD2 LYS 31 63.562 28.011 19.098
243 HD3 LYS 31 HD3 LYS 31 62.719 27.211 17.771
244 HE2 LYS 31 HE2 LYS 31 61.675 25.675 19.384
245 HE3 LYS 31 HE3 LYS 31 62.492 26.519 20.700
246 HZ1 LYS 31 HZ1 LYS 31 60.213 27.272 20.447
247 HZ2 LYS 31 HZ2 LYS 31 60.509 27.724 18.844
248 HZ3 LYS 31 HZ3 LYS 31 61.291 28.532 20.107
249 H LEU 32 H LEU 32 66.298 23.625 17.743
250 HA LEU 32 HA LEU 32 68.981 24.717 17.178
251 HB2 LEU 32 HB2 LEU 32 68.254 22.272 16.884
252 HB3 LEU 32 HB3 LEU 32 67.372 22.823 15.474
253 HG LEU 32 HG LEU 32 69.480 23.572 14.449
254 HD11 LEU 32 HD11 LEU 32 70.742 24.097 16.453
255 HD12 LEU 32 HD12 LEU 32 71.618 22.922 15.470
256 HD13 LEU 32 HD13 LEU 32 70.754 22.394 16.915
257 HD21 LEU 32 HD21 LEU 32 70.407 21.359 14.016
258 HD22 LEU 32 HD22 LEU 32 68.644 21.329 14.002
259 HD23 LEU 32 HD23 LEU 32 69.526 20.714 15.400
260 H GLN 33 H GLN 33 69.370 25.321 14.761
261 HA GLN 33 HA GLN 33 67.547 27.511 14.186
262 HB2 GLN 33 HB2 GLN 33 70.058 27.569 13.870
263 HB3 GLN 33 HB3 GLN 33 69.835 26.514 12.482
264 HG2 GLN 33 HG2 GLN 33 68.504 28.198 11.369
265 HG3 GLN 33 HG3 GLN 33 68.604 29.245 12.784
266 HE21 GLN 33 HE21 GLN 33 70.298 27.900 10.038
267 HE22 GLN 33 HE22 GLN 33 71.701 29.023 10.113
268 H GLU 34 H GLU 34 67.306 24.262 13.639
269 HA GLU 34 HA GLU 34 65.999 24.601 10.999
270 HB2 GLU 34 HB2 GLU 34 66.822 22.084 12.464
271 HB3 GLU 34 HB3 GLU 34 66.073 22.139 10.874
272 HG2 GLU 34 HG2 GLU 34 68.009 23.310 9.985
273 HG3 GLU 34 HG3 GLU 34 68.757 23.305 11.581
274 H GLU 35 H GLU 35 63.864 24.736 10.915
275 HA GLU 35 HA GLU 35 62.268 24.635 13.268
276 HB2 GLU 35 HB2 GLU 35 61.401 24.390 10.376
277 HB3 GLU 35 HB3 GLU 35 60.336 24.737 11.731
278 HG2 GLU 35 HG2 GLU 35 62.587 26.477 10.743
279 HG3 GLU 35 HG3 GLU 35 60.864 26.756 10.503
280 H GLY 36 H GLY 36 61.649 22.968 14.451
281 HA2 GLY 36 HA2 GLY 36 60.521 20.898 14.726
282 HA3 GLY 36 HA3 GLY 36 60.870 20.477 13.058
283 H TRP 37 H TRP 37 63.554 21.755 14.782
284 HA TRP 37 HA TRP 37 64.455 19.010 15.471
285 HB2 TRP 37 HB2 TRP 37 65.952 21.074 13.860
286 HB3 TRP 37 HB3 TRP 37 66.758 19.727 14.658
287 HD1 TRP 37 HD1 TRP 37 65.266 20.618 11.439
288 HE1 TRP 37 HE1 TRP 37 64.825 18.528 9.967
289 HE3 TRP 37 HE3 TRP 37 65.826 17.035 15.041
290 HZ2 TRP 37 HZ2 TRP 37 64.740 15.726 10.355
291 HZ3 TRP 37 HZ3 TRP 37 65.546 14.673 14.410
292 HH2 TRP 37 HH2 TRP 37 65.014 14.036 12.114
293 H LEU 38 H LEU 38 65.402 18.771 17.351
294 HA LEU 38 HA LEU 38 66.124 21.252 18.846
295 HB2 LEU 38 HB2 LEU 38 64.899 18.683 19.855
296 HB3 LEU 38 HB3 LEU 38 65.550 19.927 20.904
297 HG LEU 38 HG LEU 38 63.271 20.362 18.972
298 HD11 LEU 38 HD11 LEU 38 63.237 19.834 21.939
299 HD12 LEU 38 HD12 LEU 38 62.577 18.802 20.670
300 HD13 LEU 38 HD13 LEU 38 61.853 20.377 20.991
301 HD21 LEU 38 HD21 LEU 38 64.367 22.062 21.210
302 HD22 LEU 38 HD22 LEU 38 62.931 22.424 20.252
303 HD23 LEU 38 HD23 LEU 38 64.516 22.387 19.482
304 H GLU 39 H GLU 39 67.772 20.903 20.562
305 HA GLU 39 HA GLU 39 69.691 18.767 19.734
306 HB2 GLU 39 HB2 GLU 39 70.399 21.030 18.984
307 HB3 GLU 39 HB3 GLU 39 70.371 21.571 20.656
308 HG2 GLU 39 HG2 GLU 39 72.630 21.118 20.014
309 HG3 GLU 39 HG3 GLU 39 72.115 19.908 21.188
310 H GLY 40 H GLY 40 70.038 17.326 21.301
311 HA2 GLY 40 HA2 GLY 40 70.484 18.247 24.036
312 HA3 GLY 40 HA3 GLY 40 68.970 17.386 23.837
313 H GLU 41 H GLU 41 70.705 16.411 25.605
314 HA GLU 41 HA GLU 41 72.252 14.279 24.261
315 HB2 GLU 41 HB2 GLU 41 72.007 14.955 27.198
316 HB3 GLU 41 HB3 GLU 41 73.126 13.796 26.496
317 HG2 GLU 41 HG2 GLU 41 74.338 15.521 25.392
318 HG3 GLU 41 HG3 GLU 41 73.122 16.723 25.817
319 H LEU 42 H LEU 42 71.071 12.623 23.594
320 HA LEU 42 HA LEU 42 69.176 11.442 25.571
321 HB2 LEU 42 HB2 LEU 42 68.074 12.585 23.602
322 HB3 LEU 42 HB3 LEU 42 68.826 11.384 22.574
323 HG LEU 42 HG LEU 42 66.384 11.022 23.236
324 HD11 LEU 42 HD11 LEU 42 66.626 8.643 23.270
325 HD12 LEU 42 HD12 LEU 42 68.289 8.773 23.836
326 HD13 LEU 42 HD13 LEU 42 67.867 9.316 22.213
327 HD21 LEU 42 HD21 LEU 42 67.592 9.982 25.785
328 HD22 LEU 42 HD22 LEU 42 65.887 10.092 25.351
329 HD23 LEU 42 HD23 LEU 42 66.814 11.559 25.661
330 H ASN 43 H ASN 43 69.465 9.365 26.055
331 HA ASN 43 HA ASN 43 70.385 7.275 26.049
332 HB2 ASN 43 HB2 ASN 43 69.326 7.240 23.743
333 HB3 ASN 43 HB3 ASN 43 70.914 7.630 23.093
334 HD21 ASN 43 HD21 ASN 43 71.111 5.752 21.924
335 HD22 ASN 43 HD22 ASN 43 71.351 4.158 22.720
336 H GLY 44 H GLY 44 72.065 9.759 26.384
337 HA2 GLY 44 HA2 GLY 44 74.288 9.971 27.025
338 HA3 GLY 44 HA3 GLY 44 74.619 8.362 26.413
339 H ARG 45 H ARG 45 73.018 10.371 24.160
340 HA ARG 45 HA ARG 45 75.622 11.147 22.962
341 HB2 ARG 45 HB2 ARG 45 74.684 9.105 21.868
342 HB3 ARG 45 HB3 ARG 45 73.259 10.040 21.434
343 HG2 ARG 45 HG2 ARG 45 74.756 11.584 20.163
344 HG3 ARG 45 HG3 ARG 45 76.082 10.464 20.479
345 HD2 ARG 45 HD2 ARG 45 73.526 9.833 19.005
346 HD3 ARG 45 HD3 ARG 45 75.112 10.073 18.277
347 HE ARG 45 HE ARG 45 75.568 8.046 20.054
348 HH11 ARG 45 HH11 ARG 45 73.190 8.536 17.473
349 HH12 ARG 45 HH12 ARG 45 73.025 6.845 17.141
350 HH21 ARG 45 HH21 ARG 45 75.317 5.833 19.584
351 HH22 ARG 45 HH22 ARG 45 74.231 5.310 18.341
352 H ARG 46 H ARG 46 75.706 13.100 21.944
353 HA ARG 46 HA ARG 46 73.375 14.849 22.449
354 HB2 ARG 46 HB2 ARG 46 75.524 15.701 23.201
355 HB3 ARG 46 HB3 ARG 46 76.233 15.431 21.616
356 HG2 ARG 46 HG2 ARG 46 75.826 17.759 21.846
357 HG3 ARG 46 HG3 ARG 46 74.653 17.123 20.695
358 HD2 ARG 46 HD2 ARG 46 73.441 18.573 22.101
359 HD3 ARG 46 HD3 ARG 46 73.044 16.946 22.647
360 HE ARG 46 HE ARG 46 75.114 17.578 24.281
361 HH11 ARG 46 HH11 ARG 46 72.166 19.333 23.402
362 HH12 ARG 46 HH12 ARG 46 72.068 20.166 24.916
363 HH21 ARG 46 HH21 ARG 46 74.949 18.700 26.255
364 HH22 ARG 46 HH22 ARG 46 73.650 19.811 26.535
365 H GLY 47 H GLY 47 71.899 15.047 20.877
366 HA2 GLY 47 HA2 GLY 47 72.870 15.303 18.109
367 HA3 GLY 47 HA3 GLY 47 71.863 13.907 18.436
368 H MET 48 H MET 48 70.633 14.956 16.673
369 HA MET 48 HA MET 48 68.886 17.102 17.762
370 HB2 MET 48 HB2 MET 48 69.427 16.413 14.868
371 HB3 MET 48 HB3 MET 48 68.419 17.733 15.444
372 HG2 MET 48 HG2 MET 48 70.298 18.889 16.327
373 HG3 MET 48 HG3 MET 48 71.351 17.501 16.060
374 HE1 MET 48 HE1 MET 48 72.246 20.344 15.119
375 HE2 MET 48 HE2 MET 48 72.827 20.001 13.490
376 HE3 MET 48 HE3 MET 48 73.169 18.874 14.803
377 H PHE 49 H PHE 49 66.699 16.859 17.782
378 HA PHE 49 HA PHE 49 65.590 14.395 16.555
379 HB2 PHE 49 HB2 PHE 49 64.252 14.140 18.777
380 HB3 PHE 49 HB3 PHE 49 65.904 13.536 18.699
381 HD1 PHE 49 HD2 PHE 49 67.727 14.782 19.765
382 HD2 PHE 49 HD1 PHE 49 63.664 15.958 20.210
383 HE1 PHE 49 HE2 PHE 49 68.350 16.186 21.681
384 HE2 PHE 49 HE1 PHE 49 64.283 17.372 22.127
385 HZ PHE 49 HZ PHE 49 66.627 17.485 22.863
386 HA PRO 50 HA PRO 50 62.163 16.822 15.283
387 HB2 PRO 50 HB2 PRO 50 60.073 15.143 16.061
388 HB3 PRO 50 HB3 PRO 50 60.936 15.079 14.524
389 HG2 PRO 50 HG2 PRO 50 61.313 13.434 16.980
390 HG3 PRO 50 HG3 PRO 50 61.454 12.964 15.278
391 HD2 PRO 50 HD2 PRO 50 63.618 13.364 16.806
392 HD3 PRO 50 HD3 PRO 50 63.598 13.822 15.091
393 H ASP 51 H ASP 51 61.063 18.475 16.080
394 HA ASP 51 HA ASP 51 61.035 18.953 18.905
395 HB2 ASP 51 HB2 ASP 51 61.186 20.733 17.189
396 HB3 ASP 51 HB3 ASP 51 59.518 20.408 16.730
397 H ASN 52 H ASN 52 58.525 17.874 16.616
398 HA ASN 52 HA ASN 52 56.453 18.043 18.666
399 HB2 ASN 52 HB2 ASN 52 54.948 17.213 16.970
400 HB3 ASN 52 HB3 ASN 52 55.985 18.448 16.264
401 HD21 ASN 52 HD21 ASN 52 55.036 15.125 16.277
402 HD22 ASN 52 HD22 ASN 52 56.009 14.629 14.850
403 H PHE 53 H PHE 53 58.944 15.976 18.505
404 HA PHE 53 HA PHE 53 57.322 13.573 19.154
405 HB2 PHE 53 HB2 PHE 53 60.134 13.995 18.223
406 HB3 PHE 53 HB3 PHE 53 59.744 12.547 19.142
407 HD1 PHE 53 HD1 PHE 53 58.293 14.483 16.290
408 HD2 PHE 53 HD2 PHE 53 59.285 10.677 17.914
409 HE1 PHE 53 HE1 PHE 53 57.490 13.399 14.233
410 HE2 PHE 53 HE2 PHE 53 58.482 9.588 15.861
411 HZ PHE 53 HZ PHE 53 57.584 10.948 14.017
412 H VAL 54 H VAL 54 59.430 15.999 20.483
413 HA VAL 54 HA VAL 54 59.332 14.580 23.102
414 HB VAL 54 HB VAL 54 61.301 15.936 23.752
415 HG11 VAL 54 HG11 VAL 54 62.950 14.692 22.433
416 HG12 VAL 54 HG12 VAL 54 61.690 14.253 21.280
417 HG13 VAL 54 HG13 VAL 54 61.609 13.665 22.941
418 HG21 VAL 54 HG21 VAL 54 62.579 17.141 22.083
419 HG22 VAL 54 HG22 VAL 54 60.947 17.797 22.175
420 HG23 VAL 54 HG23 VAL 54 61.395 16.733 20.843
421 H LYS 55 H LYS 55 58.499 15.598 24.853
422 HA LYS 55 HA LYS 55 57.381 18.314 24.334
423 HB2 LYS 55 HB2 LYS 55 55.725 16.484 24.701
424 HB3 LYS 55 HB3 LYS 55 56.407 16.230 26.300
425 HG2 LYS 55 HG2 LYS 55 55.746 18.469 26.963
426 HG3 LYS 55 HG3 LYS 55 55.119 18.781 25.344
427 HD2 LYS 55 HD2 LYS 55 54.117 16.634 27.216
428 HD3 LYS 55 HD3 LYS 55 53.342 18.198 26.956
429 HE2 LYS 55 HE2 LYS 55 53.041 17.644 24.585
430 HE3 LYS 55 HE3 LYS 55 53.799 16.076 24.859
431 HZ1 LYS 55 HZ1 LYS 55 51.283 17.020 26.127
432 HZ2 LYS 55 HZ2 LYS 55 52.005 15.510 26.374
433 HZ3 LYS 55 HZ3 LYS 55 51.388 15.913 24.852
434 H GLU 56 H GLU 56 58.048 19.978 25.548
435 HA GLU 56 HA GLU 56 60.260 19.808 27.220
436 HB2 GLU 56 HB2 GLU 56 59.704 22.038 28.013
437 HB3 GLU 56 HB3 GLU 56 59.396 21.912 26.290
438 HG2 GLU 56 HG2 GLU 56 57.560 23.077 27.042
439 HG3 GLU 56 HG3 GLU 56 56.960 21.422 26.992
440 H ILE 57 H ILE 57 60.687 19.604 29.376
441 HA ILE 57 HA ILE 57 58.497 18.350 30.919
442 HB ILE 57 HB ILE 57 61.447 18.508 31.568
443 HG12 ILE 57 HG12 ILE 57 59.842 16.194 30.458
444 HG13 ILE 57 HG13 ILE 57 60.929 17.203 29.510
445 HG21 ILE 57 HG21 ILE 57 60.938 16.730 33.194
446 HG22 ILE 57 HG22 ILE 57 59.225 16.885 32.807
447 HG23 ILE 57 HG23 ILE 57 60.084 18.230 33.557
448 HD11 ILE 57 HD11 ILE 57 61.971 15.097 30.116
449 HD12 ILE 57 HD12 ILE 57 61.720 15.453 31.826
450 HD13 ILE 57 HD13 ILE 57 62.808 16.456 30.867
451 H LYS 58 H LYS 58 57.273 20.134 31.499
452 HA LYS 58 HA LYS 58 58.433 22.444 32.765
453 HB2 LYS 58 HB2 LYS 58 56.258 22.514 31.622
454 HB3 LYS 58 HB3 LYS 58 55.582 21.431 32.828
455 HG2 LYS 58 HG2 LYS 58 54.917 23.717 33.264
456 HG3 LYS 58 HG3 LYS 58 55.960 23.123 34.557
457 HD2 LYS 58 HD2 LYS 58 56.610 25.374 33.997
458 HD3 LYS 58 HD3 LYS 58 57.877 24.267 33.469
459 HE2 LYS 58 HE2 LYS 58 56.983 24.354 31.183
460 HE3 LYS 58 HE3 LYS 58 55.738 25.481 31.720
461 HZ1 LYS 58 HZ1 LYS 58 57.590 26.630 30.679
462 HZ2 LYS 58 HZ2 LYS 58 58.666 25.976 31.807
463 HZ3 LYS 58 HZ3 LYS 58 57.468 27.059 32.310
Start of MODEL 7
1 H1 VAL 2 H1 VAL 2 67.832 22.647 29.546
2 H2 VAL 2 H2 VAL 2 67.161 24.194 29.428
3 H3 VAL 2 H3 VAL 2 67.185 23.179 28.075
4 HA VAL 2 HA VAL 2 65.679 22.683 30.577
5 HB VAL 2 HB VAL 2 64.741 24.542 29.255
6 HG11 VAL 2 HG11 VAL 2 64.457 22.505 27.048
7 HG12 VAL 2 HG12 VAL 2 65.546 23.892 27.047
8 HG13 VAL 2 HG13 VAL 2 63.800 24.141 27.038
9 HG21 VAL 2 HG21 VAL 2 63.254 23.100 30.543
10 HG22 VAL 2 HG22 VAL 2 63.076 22.028 29.154
11 HG23 VAL 2 HG23 VAL 2 62.464 23.681 29.077
12 H ASP 3 H ASP 3 64.697 20.726 30.799
13 HA ASP 3 HA ASP 3 65.642 18.656 28.940
14 HB2 ASP 3 HB2 ASP 3 64.258 18.588 31.614
15 HB3 ASP 3 HB3 ASP 3 64.475 17.133 30.646
16 H TYR 4 H TYR 4 64.346 17.090 27.958
17 HA TYR 4 HA TYR 4 61.487 17.859 27.615
18 HB2 TYR 4 HB2 TYR 4 63.577 17.482 25.526
19 HB3 TYR 4 HB3 TYR 4 61.951 16.917 25.175
20 HD1 TYR 4 HD2 TYR 4 63.548 19.972 26.649
21 HD2 TYR 4 HD1 TYR 4 60.629 18.373 24.000
22 HE1 TYR 4 HE2 TYR 4 62.898 22.251 25.995
23 HE2 TYR 4 HE1 TYR 4 59.973 20.647 23.338
24 HH TYR 4 HH TYR 4 60.080 22.956 24.306
25 H ILE 5 H ILE 5 60.057 16.170 27.040
26 HA ILE 5 HA ILE 5 61.163 13.476 27.686
27 HB ILE 5 HB ILE 5 59.560 14.286 29.374
28 HG12 ILE 5 HG12 ILE 5 57.883 12.357 29.140
29 HG13 ILE 5 HG13 ILE 5 58.723 11.964 27.645
30 HG21 ILE 5 HG21 ILE 5 57.615 14.422 27.078
31 HG22 ILE 5 HG22 ILE 5 58.201 15.765 28.058
32 HG23 ILE 5 HG23 ILE 5 57.172 14.532 28.781
33 HD11 ILE 5 HD11 ILE 5 60.790 11.646 28.876
34 HD12 ILE 5 HD12 ILE 5 59.508 10.621 29.520
35 HD13 ILE 5 HD13 ILE 5 59.978 12.089 30.376
36 H VAL 6 H VAL 6 60.880 11.838 26.254
37 HA VAL 6 HA VAL 6 59.963 12.591 23.603
38 HB VAL 6 HB VAL 6 60.685 9.836 24.617
39 HG11 VAL 6 HG11 VAL 6 60.509 10.985 21.835
40 HG12 VAL 6 HG12 VAL 6 59.475 9.741 22.537
41 HG13 VAL 6 HG13 VAL 6 61.177 9.401 22.225
42 HG21 VAL 6 HG21 VAL 6 62.503 11.474 24.968
43 HG22 VAL 6 HG22 VAL 6 62.463 11.850 23.247
44 HG23 VAL 6 HG23 VAL 6 62.918 10.235 23.786
45 H GLU 7 H GLU 7 57.987 12.505 22.828
46 HA GLU 7 HA GLU 7 55.997 10.875 24.312
47 HB2 GLU 7 HB2 GLU 7 54.303 12.302 23.189
48 HB3 GLU 7 HB3 GLU 7 55.426 13.225 24.177
49 HG2 GLU 7 HG2 GLU 7 56.684 13.823 22.149
50 HG3 GLU 7 HG3 GLU 7 55.501 12.950 21.180
51 H TYR 8 H TYR 8 57.698 11.135 21.306
52 HA TYR 8 HA TYR 8 56.080 8.864 20.271
53 HB2 TYR 8 HB2 TYR 8 56.972 11.315 18.747
54 HB3 TYR 8 HB3 TYR 8 56.446 9.831 17.960
55 HD1 TYR 8 HD2 TYR 8 54.081 8.944 18.851
56 HD2 TYR 8 HD1 TYR 8 55.410 12.979 19.029
57 HE1 TYR 8 HE2 TYR 8 51.745 9.699 18.984
58 HE2 TYR 8 HE1 TYR 8 53.079 13.749 19.163
59 HH TYR 8 HH TYR 8 50.800 12.857 18.479
60 H ASP 9 H ASP 9 57.177 7.271 19.207
61 HA ASP 9 HA ASP 9 60.037 7.165 19.737
62 HB2 ASP 9 HB2 ASP 9 58.306 5.235 18.170
63 HB3 ASP 9 HB3 ASP 9 59.914 4.912 18.814
64 H TYR 10 H TYR 10 61.690 7.656 18.411
65 HA TYR 10 HA TYR 10 61.044 7.985 15.520
66 HB2 TYR 10 HB2 TYR 10 61.179 10.199 16.664
67 HB3 TYR 10 HB3 TYR 10 62.837 9.823 17.119
68 HD1 TYR 10 HD1 TYR 10 64.611 9.790 15.442
69 HD2 TYR 10 HD2 TYR 10 60.610 10.772 14.380
70 HE1 TYR 10 HE1 TYR 10 65.407 10.685 13.295
71 HE2 TYR 10 HE2 TYR 10 61.393 11.672 12.232
72 HH TYR 10 HH TYR 10 63.446 12.560 11.236
73 H ASP 11 H ASP 11 62.461 7.171 14.094
74 HA ASP 11 HA ASP 11 64.782 5.735 15.249
75 HB2 ASP 11 HB2 ASP 11 63.251 4.430 13.851
76 HB3 ASP 11 HB3 ASP 11 63.493 5.550 12.514
77 H ALA 12 H ALA 12 66.739 6.596 15.174
78 HA ALA 12 HA ALA 12 67.284 9.007 13.730
79 HB1 ALA 12 HB1 ALA 12 68.475 8.400 15.774
80 HB2 ALA 12 HB2 ALA 12 69.596 8.690 14.445
81 HB3 ALA 12 HB3 ALA 12 69.225 7.039 14.940
82 H VAL 13 H VAL 13 67.193 9.079 11.588
83 HA VAL 13 HA VAL 13 68.249 6.839 10.000
84 HB VAL 13 HB VAL 13 67.060 9.465 9.073
85 HG11 VAL 13 HG11 VAL 13 67.673 6.916 7.580
86 HG12 VAL 13 HG12 VAL 13 68.447 8.486 7.360
87 HG13 VAL 13 HG13 VAL 13 66.751 8.271 6.926
88 HG21 VAL 13 HG21 VAL 13 65.026 8.153 8.623
89 HG22 VAL 13 HG22 VAL 13 65.430 8.186 10.339
90 HG23 VAL 13 HG23 VAL 13 65.780 6.748 9.380
91 H HIS 14 H HIS 14 68.996 10.195 10.818
92 HA HIS 14 HA HIS 14 71.383 10.162 9.091
93 HB2 HIS 14 HB2 HIS 14 70.350 12.295 10.976
94 HB3 HIS 14 HB3 HIS 14 71.678 12.488 9.840
95 HD1 HIS 14 HD1 HIS 14 71.124 13.228 7.510
96 HD2 HIS 14 HD2 HIS 14 67.773 11.932 9.671
97 HE1 HIS 14 HE1 HIS 14 69.097 13.772 6.086
98 HE2 HIS 14 HE2 HIS 14 67.073 12.907 7.355
99 H ASP 15 H ASP 15 73.358 11.367 10.308
100 HA ASP 15 HA ASP 15 74.189 9.393 12.278
101 HB2 ASP 15 HB2 ASP 15 75.790 10.171 10.615
102 HB3 ASP 15 HB3 ASP 15 75.600 11.831 11.170
103 H ASP 16 H ASP 16 73.557 12.909 12.265
104 HA ASP 16 HA ASP 16 74.094 13.106 15.116
105 HB2 ASP 16 HB2 ASP 16 74.477 15.000 13.550
106 HB3 ASP 16 HB3 ASP 16 72.738 15.102 13.288
107 H GLU 17 H GLU 17 71.338 12.366 13.119
108 HA GLU 17 HA GLU 17 69.233 13.188 14.747
109 HB2 GLU 17 HB2 GLU 17 69.595 10.907 12.851
110 HB3 GLU 17 HB3 GLU 17 68.139 10.971 13.835
111 HG2 GLU 17 HG2 GLU 17 69.087 13.089 11.917
112 HG3 GLU 17 HG3 GLU 17 67.752 11.965 11.666
113 H LEU 18 H LEU 18 68.344 12.620 16.602
114 HA LEU 18 HA LEU 18 69.714 10.492 18.129
115 HB2 LEU 18 HB2 LEU 18 69.017 13.001 18.837
116 HB3 LEU 18 HB3 LEU 18 67.590 12.138 19.371
117 HG LEU 18 HG LEU 18 70.414 11.517 20.242
118 HD11 LEU 18 HD11 LEU 18 68.186 12.855 21.767
119 HD12 LEU 18 HD12 LEU 18 69.574 13.685 21.064
120 HD13 LEU 18 HD13 LEU 18 69.813 12.509 22.354
121 HD21 LEU 18 HD21 LEU 18 67.753 10.425 21.151
122 HD22 LEU 18 HD22 LEU 18 69.301 10.107 21.931
123 HD23 LEU 18 HD23 LEU 18 69.012 9.545 20.287
124 H THR 19 H THR 19 68.834 8.581 18.588
125 HA THR 19 HA THR 19 66.163 8.024 17.506
126 HB THR 19 HB THR 19 68.003 6.154 19.029
127 HG1 THR 19 HG1 THR 19 69.161 6.318 17.257
128 HG21 THR 19 HG21 THR 19 65.679 5.598 17.179
129 HG22 THR 19 HG22 THR 19 65.674 5.403 18.931
130 HG23 THR 19 HG23 THR 19 66.709 4.382 17.933
131 H ILE 20 H ILE 20 64.820 9.319 18.862
132 HA ILE 20 HA ILE 20 64.954 8.826 21.750
133 HB ILE 20 HB ILE 20 63.190 10.532 21.905
134 HG12 ILE 20 HG12 ILE 20 63.442 10.703 18.892
135 HG13 ILE 20 HG13 ILE 20 62.055 10.052 19.760
136 HG21 ILE 20 HG21 ILE 20 64.536 12.438 21.090
137 HG22 ILE 20 HG22 ILE 20 65.564 11.302 20.217
138 HG23 ILE 20 HG23 ILE 20 65.489 11.249 21.978
139 HD11 ILE 20 HD11 ILE 20 63.035 12.887 19.978
140 HD12 ILE 20 HD12 ILE 20 61.572 12.213 20.696
141 HD13 ILE 20 HD13 ILE 20 61.714 12.347 18.943
142 H ARG 21 H ARG 21 63.540 7.723 22.966
143 HA ARG 21 HA ARG 21 61.309 6.359 21.518
144 HB2 ARG 21 HB2 ARG 21 63.099 4.830 22.274
145 HB3 ARG 21 HB3 ARG 21 62.894 5.407 23.921
146 HG2 ARG 21 HG2 ARG 21 60.497 4.589 23.755
147 HG3 ARG 21 HG3 ARG 21 60.996 3.766 22.276
148 HD2 ARG 21 HD2 ARG 21 62.264 3.387 24.985
149 HD3 ARG 21 HD3 ARG 21 61.072 2.306 24.265
150 HE ARG 21 HE ARG 21 63.335 2.699 22.522
151 HH11 ARG 21 HH11 ARG 21 62.247 0.946 25.400
152 HH12 ARG 21 HH12 ARG 21 63.359 -0.360 25.171
153 HH21 ARG 21 HH21 ARG 21 64.781 0.960 22.259
154 HH22 ARG 21 HH22 ARG 21 64.799 -0.353 23.387
155 H VAL 22 H VAL 22 59.252 6.519 22.333
156 HA VAL 22 HA VAL 22 58.532 8.620 23.964
157 HB VAL 22 HB VAL 22 56.925 7.354 22.632
158 HG11 VAL 22 HG11 VAL 22 56.050 5.219 23.333
159 HG12 VAL 22 HG12 VAL 22 57.091 5.218 24.755
160 HG13 VAL 22 HG13 VAL 22 57.798 5.097 23.144
161 HG21 VAL 22 HG21 VAL 22 56.177 7.407 25.555
162 HG22 VAL 22 HG22 VAL 22 55.057 7.391 24.192
163 HG23 VAL 22 HG23 VAL 22 56.112 8.780 24.450
164 H GLY 23 H GLY 23 58.717 9.159 26.018
165 HA2 GLY 23 HA2 GLY 23 58.378 8.595 28.348
166 HA3 GLY 23 HA3 GLY 23 58.930 6.963 28.020
167 H GLU 24 H GLU 24 61.154 8.388 26.285
168 HA GLU 24 HA GLU 24 63.058 8.420 28.486
169 HB2 GLU 24 HB2 GLU 24 63.428 8.909 25.529
170 HB3 GLU 24 HB3 GLU 24 64.733 8.757 26.696
171 HG2 GLU 24 HG2 GLU 24 62.744 6.621 25.961
172 HG3 GLU 24 HG3 GLU 24 64.434 6.696 25.468
173 H ILE 25 H ILE 25 64.460 10.083 29.063
174 HA ILE 25 HA ILE 25 63.371 12.796 28.461
175 HB ILE 25 HB ILE 25 64.999 11.900 30.849
176 HG12 ILE 25 HG12 ILE 25 62.082 12.695 30.666
177 HG13 ILE 25 HG13 ILE 25 62.670 11.044 30.833
178 HG21 ILE 25 HG21 ILE 25 64.531 14.134 31.746
179 HG22 ILE 25 HG22 ILE 25 63.725 14.568 30.239
180 HG23 ILE 25 HG23 ILE 25 65.453 14.217 30.245
181 HD11 ILE 25 HD11 ILE 25 63.059 13.257 32.834
182 HD12 ILE 25 HD12 ILE 25 63.620 11.595 33.005
183 HD13 ILE 25 HD13 ILE 25 61.891 11.942 32.954
184 H ILE 26 H ILE 26 64.588 14.223 27.401
185 HA ILE 26 HA ILE 26 67.365 13.385 26.777
186 HB ILE 26 HB ILE 26 65.764 15.596 25.491
187 HG12 ILE 26 HG12 ILE 26 65.807 13.843 23.544
188 HG13 ILE 26 HG13 ILE 26 66.030 12.678 24.844
189 HG21 ILE 26 HG21 ILE 26 67.466 15.495 23.750
190 HG22 ILE 26 HG22 ILE 26 68.313 14.232 24.638
191 HG23 ILE 26 HG23 ILE 26 68.189 15.854 25.317
192 HD11 ILE 26 HD11 ILE 26 63.935 13.154 25.773
193 HD12 ILE 26 HD12 ILE 26 63.665 13.088 24.032
194 HD13 ILE 26 HD13 ILE 26 63.771 14.647 24.848
195 H ARG 27 H ARG 27 69.078 14.324 27.657
196 HA ARG 27 HA ARG 27 68.685 16.445 29.579
197 HB2 ARG 27 HB2 ARG 27 71.193 15.126 28.541
198 HB3 ARG 27 HB3 ARG 27 71.159 16.288 29.860
199 HG2 ARG 27 HG2 ARG 27 69.694 14.765 31.127
200 HG3 ARG 27 HG3 ARG 27 69.820 13.591 29.817
201 HD2 ARG 27 HD2 ARG 27 71.375 13.019 31.578
202 HD3 ARG 27 HD3 ARG 27 72.261 13.527 30.141
203 HE ARG 27 HE ARG 27 71.789 15.704 32.000
204 HH11 ARG 27 HH11 ARG 27 73.903 12.957 31.264
205 HH12 ARG 27 HH12 ARG 27 75.265 13.633 32.091
206 HH21 ARG 27 HH21 ARG 27 73.608 16.553 33.077
207 HH22 ARG 27 HH22 ARG 27 75.099 15.672 33.120
208 H ASN 28 H ASN 28 68.773 18.558 29.347
209 HA ASN 28 HA ASN 28 69.068 20.595 28.404
210 HB2 ASN 28 HB2 ASN 28 71.455 19.927 28.903
211 HB3 ASN 28 HB3 ASN 28 71.613 19.503 27.202
212 HD21 ASN 28 HD21 ASN 28 71.725 21.088 25.640
213 HD22 ASN 28 HD22 ASN 28 71.942 22.821 26.066
214 H VAL 29 H VAL 29 67.171 19.864 27.050
215 HA VAL 29 HA VAL 29 67.832 19.517 24.209
216 HB VAL 29 HB VAL 29 65.150 19.806 25.571
217 HG11 VAL 29 HG11 VAL 29 64.266 18.862 23.441
218 HG12 VAL 29 HG12 VAL 29 65.868 19.080 22.734
219 HG13 VAL 29 HG13 VAL 29 64.945 20.481 23.279
220 HG21 VAL 29 HG21 VAL 29 65.939 17.782 26.338
221 HG22 VAL 29 HG22 VAL 29 66.863 17.467 24.871
222 HG23 VAL 29 HG23 VAL 29 65.109 17.297 24.860
223 H LYS 30 H LYS 30 68.546 21.247 23.165
224 HA LYS 30 HA LYS 30 67.246 23.860 23.742
225 HB2 LYS 30 HB2 LYS 30 69.200 24.854 22.611
226 HB3 LYS 30 HB3 LYS 30 69.662 23.867 23.989
227 HG2 LYS 30 HG2 LYS 30 70.376 22.086 22.559
228 HG3 LYS 30 HG3 LYS 30 69.738 22.911 21.136
229 HD2 LYS 30 HD2 LYS 30 71.926 24.018 22.891
230 HD3 LYS 30 HD3 LYS 30 72.216 23.090 21.419
231 HE2 LYS 30 HE2 LYS 30 70.952 24.769 20.138
232 HE3 LYS 30 HE3 LYS 30 70.723 25.704 21.614
233 HZ1 LYS 30 HZ1 LYS 30 73.343 25.062 20.370
234 HZ2 LYS 30 HZ2 LYS 30 73.117 25.972 21.777
235 HZ3 LYS 30 HZ3 LYS 30 72.556 26.559 20.294
236 H LYS 31 H LYS 31 66.835 25.322 21.933
237 HA LYS 31 HA LYS 31 65.656 23.789 19.706
238 HB2 LYS 31 HB2 LYS 31 65.431 26.691 20.521
239 HB3 LYS 31 HB3 LYS 31 64.656 26.016 19.095
240 HG2 LYS 31 HG2 LYS 31 63.332 24.533 20.469
241 HG3 LYS 31 HG3 LYS 31 64.165 25.095 21.919
242 HD2 LYS 31 HD2 LYS 31 63.266 27.323 21.611
243 HD3 LYS 31 HD3 LYS 31 62.510 26.836 20.093
244 HE2 LYS 31 HE2 LYS 31 60.872 26.881 21.890
245 HE3 LYS 31 HE3 LYS 31 61.108 25.236 21.306
246 HZ1 LYS 31 HZ1 LYS 31 62.456 24.742 23.202
247 HZ2 LYS 31 HZ2 LYS 31 61.010 25.422 23.753
248 HZ3 LYS 31 HZ3 LYS 31 62.422 26.351 23.725
249 H LEU 32 H LEU 32 66.384 23.759 17.667
250 HA LEU 32 HA LEU 32 68.951 25.153 17.192
251 HB2 LEU 32 HB2 LEU 32 67.535 22.977 15.647
252 HB3 LEU 32 HB3 LEU 32 69.090 23.661 15.208
253 HG LEU 32 HG LEU 32 68.545 22.200 17.794
254 HD11 LEU 32 HD11 LEU 32 68.337 20.696 15.886
255 HD12 LEU 32 HD12 LEU 32 69.797 20.351 16.813
256 HD13 LEU 32 HD13 LEU 32 69.908 21.228 15.286
257 HD21 LEU 32 HD21 LEU 32 70.356 23.767 18.020
258 HD22 LEU 32 HD22 LEU 32 71.084 23.206 16.514
259 HD23 LEU 32 HD23 LEU 32 71.024 22.138 17.916
260 H GLN 33 H GLN 33 69.219 25.664 14.668
261 HA GLN 33 HA GLN 33 67.264 27.778 14.191
262 HB2 GLN 33 HB2 GLN 33 69.729 28.040 13.803
263 HB3 GLN 33 HB3 GLN 33 69.585 26.927 12.451
264 HG2 GLN 33 HG2 GLN 33 69.628 29.278 11.752
265 HG3 GLN 33 HG3 GLN 33 68.142 28.459 11.281
266 HE21 GLN 33 HE21 GLN 33 69.607 30.839 13.386
267 HE22 GLN 33 HE22 GLN 33 68.065 31.608 13.901
268 H GLU 34 H GLU 34 67.120 24.550 13.665
269 HA GLU 34 HA GLU 34 65.767 24.823 11.040
270 HB2 GLU 34 HB2 GLU 34 66.664 22.328 12.497
271 HB3 GLU 34 HB3 GLU 34 65.948 22.386 10.893
272 HG2 GLU 34 HG2 GLU 34 67.862 23.573 10.033
273 HG3 GLU 34 HG3 GLU 34 68.568 23.660 11.648
274 H GLU 35 H GLU 35 63.635 24.938 11.024
275 HA GLU 35 HA GLU 35 62.101 24.778 13.415
276 HB2 GLU 35 HB2 GLU 35 61.163 24.575 10.543
277 HB3 GLU 35 HB3 GLU 35 60.133 24.898 11.930
278 HG2 GLU 35 HG2 GLU 35 62.350 26.663 10.910
279 HG3 GLU 35 HG3 GLU 35 60.620 26.938 10.719
280 H GLY 36 H GLY 36 61.525 23.087 14.583
281 HA2 GLY 36 HA2 GLY 36 60.409 21.011 14.850
282 HA3 GLY 36 HA3 GLY 36 60.707 20.624 13.165
283 H TRP 37 H TRP 37 63.494 21.850 14.705
284 HA TRP 37 HA TRP 37 64.375 19.090 15.366
285 HB2 TRP 37 HB2 TRP 37 65.853 21.169 13.753
286 HB3 TRP 37 HB3 TRP 37 66.626 19.744 14.438
287 HD1 TRP 37 HD1 TRP 37 65.326 20.830 11.281
288 HE1 TRP 37 HE1 TRP 37 64.597 18.867 9.751
289 HE3 TRP 37 HE3 TRP 37 65.163 17.149 14.820
290 HZ2 TRP 37 HZ2 TRP 37 64.036 16.114 10.077
291 HZ3 TRP 37 HZ3 TRP 37 64.516 14.879 14.131
292 HH2 TRP 37 HH2 TRP 37 63.964 14.374 11.808
293 H LEU 38 H LEU 38 65.323 18.821 17.234
294 HA LEU 38 HA LEU 38 66.247 21.261 18.684
295 HB2 LEU 38 HB2 LEU 38 64.908 18.816 19.850
296 HB3 LEU 38 HB3 LEU 38 65.522 20.177 20.769
297 HG LEU 38 HG LEU 38 63.242 20.287 18.791
298 HD11 LEU 38 HD11 LEU 38 62.643 19.077 20.808
299 HD12 LEU 38 HD12 LEU 38 61.850 20.652 20.774
300 HD13 LEU 38 HD13 LEU 38 63.260 20.396 21.803
301 HD21 LEU 38 HD21 LEU 38 62.906 22.557 19.624
302 HD22 LEU 38 HD22 LEU 38 64.496 22.381 18.881
303 HD23 LEU 38 HD23 LEU 38 64.341 22.404 20.638
304 H GLU 39 H GLU 39 67.815 20.716 20.476
305 HA GLU 39 HA GLU 39 69.521 18.412 19.649
306 HB2 GLU 39 HB2 GLU 39 70.377 20.695 18.920
307 HB3 GLU 39 HB3 GLU 39 70.598 21.059 20.624
308 HG2 GLU 39 HG2 GLU 39 72.688 20.367 19.687
309 HG3 GLU 39 HG3 GLU 39 72.121 19.127 20.805
310 H GLY 40 H GLY 40 69.863 16.985 21.228
311 HA2 GLY 40 HA2 GLY 40 70.215 17.960 23.981
312 HA3 GLY 40 HA3 GLY 40 68.781 16.984 23.721
313 H GLU 41 H GLU 41 70.747 16.293 25.536
314 HA GLU 41 HA GLU 41 72.315 14.169 24.201
315 HB2 GLU 41 HB2 GLU 41 72.394 15.220 27.033
316 HB3 GLU 41 HB3 GLU 41 73.421 13.934 26.417
317 HG2 GLU 41 HG2 GLU 41 74.775 15.808 26.317
318 HG3 GLU 41 HG3 GLU 41 74.181 15.644 24.665
319 H LEU 42 H LEU 42 71.176 12.411 23.822
320 HA LEU 42 HA LEU 42 69.774 11.197 26.148
321 HB2 LEU 42 HB2 LEU 42 68.089 12.136 24.628
322 HB3 LEU 42 HB3 LEU 42 68.774 11.220 23.301
323 HG LEU 42 HG LEU 42 68.194 9.117 24.526
324 HD11 LEU 42 HD11 LEU 42 66.654 10.983 26.324
325 HD12 LEU 42 HD12 LEU 42 68.106 10.089 26.778
326 HD13 LEU 42 HD13 LEU 42 66.628 9.220 26.369
327 HD21 LEU 42 HD21 LEU 42 65.791 9.240 24.036
328 HD22 LEU 42 HD22 LEU 42 66.769 9.939 22.747
329 HD23 LEU 42 HD23 LEU 42 65.922 10.991 23.881
330 H ASN 43 H ASN 43 70.074 9.063 26.462
331 HA ASN 43 HA ASN 43 71.010 6.995 26.215
332 HB2 ASN 43 HB2 ASN 43 69.842 7.182 23.924
333 HB3 ASN 43 HB3 ASN 43 71.445 7.511 23.277
334 HD21 ASN 43 HD21 ASN 43 69.389 5.160 24.880
335 HD22 ASN 43 HD22 ASN 43 70.398 3.729 24.470
336 H GLY 44 H GLY 44 72.625 9.622 26.469
337 HA2 GLY 44 HA2 GLY 44 74.871 9.844 27.055
338 HA3 GLY 44 HA3 GLY 44 75.214 8.271 26.367
339 H ARG 45 H ARG 45 73.458 10.342 24.293
340 HA ARG 45 HA ARG 45 75.929 11.415 23.090
341 HB2 ARG 45 HB2 ARG 45 75.489 9.243 21.977
342 HB3 ARG 45 HB3 ARG 45 73.891 9.819 21.524
343 HG2 ARG 45 HG2 ARG 45 74.906 11.586 20.175
344 HG3 ARG 45 HG3 ARG 45 76.511 11.010 20.631
345 HD2 ARG 45 HD2 ARG 45 76.006 8.842 19.585
346 HD3 ARG 45 HD3 ARG 45 74.427 9.458 19.099
347 HE ARG 45 HE ARG 45 76.330 11.258 18.095
348 HH11 ARG 45 HH11 ARG 45 75.465 7.850 17.681
349 HH12 ARG 45 HH12 ARG 45 76.024 7.782 16.044
350 HH21 ARG 45 HH21 ARG 45 77.052 11.125 15.937
351 HH22 ARG 45 HH22 ARG 45 76.926 9.640 15.055
352 H ARG 46 H ARG 46 75.623 13.218 21.740
353 HA ARG 46 HA ARG 46 73.076 14.603 22.349
354 HB2 ARG 46 HB2 ARG 46 75.278 15.733 22.790
355 HB3 ARG 46 HB3 ARG 46 75.579 15.715 21.058
356 HG2 ARG 46 HG2 ARG 46 73.656 17.129 20.674
357 HG3 ARG 46 HG3 ARG 46 73.255 17.090 22.391
358 HD2 ARG 46 HD2 ARG 46 74.374 19.161 21.884
359 HD3 ARG 46 HD3 ARG 46 75.425 18.161 22.884
360 HE ARG 46 HE ARG 46 75.926 17.797 20.058
361 HH11 ARG 46 HH11 ARG 46 76.586 19.892 22.834
362 HH12 ARG 46 HH12 ARG 46 78.074 20.490 22.182
363 HH21 ARG 46 HH21 ARG 46 77.893 18.609 19.237
364 HH22 ARG 46 HH22 ARG 46 78.816 19.763 20.141
365 H GLY 47 H GLY 47 71.475 14.518 20.903
366 HA2 GLY 47 HA2 GLY 47 72.254 14.481 18.043
367 HA3 GLY 47 HA3 GLY 47 71.239 13.183 18.636
368 H MET 48 H MET 48 70.756 15.124 16.559
369 HA MET 48 HA MET 48 68.769 16.955 17.628
370 HB2 MET 48 HB2 MET 48 70.153 17.524 15.665
371 HB3 MET 48 HB3 MET 48 69.423 16.201 14.769
372 HG2 MET 48 HG2 MET 48 67.281 17.289 14.818
373 HG3 MET 48 HG3 MET 48 67.913 18.564 15.856
374 HE1 MET 48 HE1 MET 48 67.831 17.037 12.251
375 HE2 MET 48 HE2 MET 48 69.517 16.800 12.708
376 HE3 MET 48 HE3 MET 48 69.102 17.950 11.438
377 H PHE 49 H PHE 49 66.592 16.763 17.664
378 HA PHE 49 HA PHE 49 65.407 14.369 16.381
379 HB2 PHE 49 HB2 PHE 49 64.035 14.110 18.586
380 HB3 PHE 49 HB3 PHE 49 65.658 13.434 18.494
381 HD1 PHE 49 HD2 PHE 49 63.660 16.250 19.799
382 HD2 PHE 49 HD1 PHE 49 67.390 14.208 19.894
383 HE1 PHE 49 HE2 PHE 49 64.322 17.553 21.777
384 HE2 PHE 49 HE1 PHE 49 68.058 15.507 21.870
385 HZ PHE 49 HZ PHE 49 66.522 17.183 22.814
386 HA PRO 50 HA PRO 50 62.050 16.924 15.221
387 HB2 PRO 50 HB2 PRO 50 60.148 14.934 16.308
388 HB3 PRO 50 HB3 PRO 50 60.308 15.556 14.664
389 HG2 PRO 50 HG2 PRO 50 61.108 13.085 15.290
390 HG3 PRO 50 HG3 PRO 50 62.008 14.079 14.129
391 HD2 PRO 50 HD2 PRO 50 62.631 13.468 16.988
392 HD3 PRO 50 HD3 PRO 50 63.728 13.604 15.598
393 H ASP 51 H ASP 51 60.854 18.559 15.991
394 HA ASP 51 HA ASP 51 60.909 19.089 18.810
395 HB2 ASP 51 HB2 ASP 51 60.947 20.834 17.037
396 HB3 ASP 51 HB3 ASP 51 59.264 20.465 16.675
397 H ASN 52 H ASN 52 58.395 17.871 16.612
398 HA ASN 52 HA ASN 52 56.371 17.976 18.720
399 HB2 ASN 52 HB2 ASN 52 54.856 17.071 17.069
400 HB3 ASN 52 HB3 ASN 52 55.809 18.355 16.334
401 HD21 ASN 52 HD21 ASN 52 55.040 14.980 16.374
402 HD22 ASN 52 HD22 ASN 52 55.991 14.541 14.913
403 H PHE 53 H PHE 53 58.950 16.023 18.453
404 HA PHE 53 HA PHE 53 57.470 13.545 19.148
405 HB2 PHE 53 HB2 PHE 53 60.209 14.106 18.097
406 HB3 PHE 53 HB3 PHE 53 59.962 12.661 19.072
407 HD1 PHE 53 HD1 PHE 53 58.275 14.425 16.238
408 HD2 PHE 53 HD2 PHE 53 59.528 10.729 17.936
409 HE1 PHE 53 HE1 PHE 53 57.430 13.233 14.259
410 HE2 PHE 53 HE2 PHE 53 58.683 9.533 15.961
411 HZ PHE 53 HZ PHE 53 57.634 10.784 14.119
412 H VAL 54 H VAL 54 59.401 16.108 20.440
413 HA VAL 54 HA VAL 54 59.431 14.698 23.062
414 HB VAL 54 HB VAL 54 61.354 16.152 23.674
415 HG11 VAL 54 HG11 VAL 54 61.721 13.860 22.924
416 HG12 VAL 54 HG12 VAL 54 63.039 14.913 22.411
417 HG13 VAL 54 HG13 VAL 54 61.809 14.412 21.252
418 HG21 VAL 54 HG21 VAL 54 60.916 17.940 22.025
419 HG22 VAL 54 HG22 VAL 54 61.430 16.848 20.739
420 HG23 VAL 54 HG23 VAL 54 62.579 17.356 21.975
421 H LYS 55 H LYS 55 58.715 15.795 24.863
422 HA LYS 55 HA LYS 55 57.436 18.426 24.271
423 HB2 LYS 55 HB2 LYS 55 55.812 16.611 24.656
424 HB3 LYS 55 HB3 LYS 55 56.543 16.291 26.221
425 HG2 LYS 55 HG2 LYS 55 55.886 18.502 26.997
426 HG3 LYS 55 HG3 LYS 55 55.178 18.852 25.419
427 HD2 LYS 55 HD2 LYS 55 53.600 17.006 25.716
428 HD3 LYS 55 HD3 LYS 55 54.314 16.647 27.289
429 HE2 LYS 55 HE2 LYS 55 53.645 18.843 28.107
430 HE3 LYS 55 HE3 LYS 55 52.969 19.237 26.528
431 HZ1 LYS 55 HZ1 LYS 55 51.252 18.540 28.076
432 HZ2 LYS 55 HZ2 LYS 55 52.029 17.058 28.315
433 HZ3 LYS 55 HZ3 LYS 55 51.379 17.435 26.800
434 H GLU 56 H GLU 56 58.047 20.137 25.444
435 HA GLU 56 HA GLU 56 60.241 20.034 27.193
436 HB2 GLU 56 HB2 GLU 56 59.150 22.052 26.017
437 HB3 GLU 56 HB3 GLU 56 58.075 22.122 27.405
438 HG2 GLU 56 HG2 GLU 56 61.052 22.156 27.731
439 HG3 GLU 56 HG3 GLU 56 60.143 23.625 27.386
440 H ILE 57 H ILE 57 60.539 19.556 29.311
441 HA ILE 57 HA ILE 57 58.168 18.587 30.765
442 HB ILE 57 HB ILE 57 61.067 18.519 31.621
443 HG12 ILE 57 HG12 ILE 57 59.419 16.327 30.334
444 HG13 ILE 57 HG13 ILE 57 60.632 17.286 29.492
445 HG21 ILE 57 HG21 ILE 57 60.281 16.719 33.135
446 HG22 ILE 57 HG22 ILE 57 58.625 17.069 32.638
447 HG23 ILE 57 HG23 ILE 57 59.566 18.291 33.493
448 HD11 ILE 57 HD11 ILE 57 62.346 16.418 31.023
449 HD12 ILE 57 HD12 ILE 57 61.540 15.143 30.109
450 HD13 ILE 57 HD13 ILE 57 61.118 15.417 31.799
451 H LYS 58 H LYS 58 57.171 20.656 31.052
452 HA LYS 58 HA LYS 58 58.565 22.615 32.720
453 HB2 LYS 58 HB2 LYS 58 56.837 23.053 30.824
454 HB3 LYS 58 HB3 LYS 58 55.637 22.718 32.062
455 HG2 LYS 58 HG2 LYS 58 56.468 24.532 33.420
456 HG3 LYS 58 HG3 LYS 58 57.771 24.831 32.268
457 HD2 LYS 58 HD2 LYS 58 56.009 25.271 30.535
458 HD3 LYS 58 HD3 LYS 58 54.810 25.193 31.829
459 HE2 LYS 58 HE2 LYS 58 57.140 27.109 31.709
460 HE3 LYS 58 HE3 LYS 58 55.471 27.505 31.301
461 HZ1 LYS 58 HZ1 LYS 58 55.957 28.215 33.530
462 HZ2 LYS 58 HZ2 LYS 58 56.481 26.668 33.967
463 HZ3 LYS 58 HZ3 LYS 58 54.853 26.935 33.598
Start of MODEL 8
1 H1 VAL 2 H1 VAL 2 65.642 23.648 27.641
2 H2 VAL 2 H2 VAL 2 67.064 23.344 28.503
3 H3 VAL 2 H3 VAL 2 66.064 24.631 28.952
4 HA VAL 2 HA VAL 2 65.824 22.765 30.464
5 HB VAL 2 HB VAL 2 63.369 22.502 30.341
6 HG11 VAL 2 HG11 VAL 2 64.324 24.497 31.364
7 HG12 VAL 2 HG12 VAL 2 62.798 24.867 30.560
8 HG13 VAL 2 HG13 VAL 2 64.327 25.311 29.800
9 HG21 VAL 2 HG21 VAL 2 62.101 23.575 28.553
10 HG22 VAL 2 HG22 VAL 2 63.144 22.307 27.912
11 HG23 VAL 2 HG23 VAL 2 63.602 24.000 27.730
12 H ASP 3 H ASP 3 64.607 20.663 30.773
13 HA ASP 3 HA ASP 3 65.659 18.784 28.774
14 HB2 ASP 3 HB2 ASP 3 64.995 17.045 30.401
15 HB3 ASP 3 HB3 ASP 3 66.017 18.279 31.131
16 H TYR 4 H TYR 4 64.412 17.075 27.841
17 HA TYR 4 HA TYR 4 61.518 17.756 27.580
18 HB2 TYR 4 HB2 TYR 4 63.547 17.271 25.432
19 HB3 TYR 4 HB3 TYR 4 61.871 16.822 25.158
20 HD1 TYR 4 HD2 TYR 4 63.659 19.790 26.601
21 HD2 TYR 4 HD1 TYR 4 60.697 18.344 23.913
22 HE1 TYR 4 HE2 TYR 4 63.161 22.097 25.917
23 HE2 TYR 4 HE1 TYR 4 60.191 20.647 23.221
24 HH TYR 4 HH TYR 4 60.421 22.958 24.186
25 H ILE 5 H ILE 5 60.096 16.061 27.121
26 HA ILE 5 HA ILE 5 61.237 13.374 27.734
27 HB ILE 5 HB ILE 5 59.682 14.165 29.470
28 HG12 ILE 5 HG12 ILE 5 57.997 12.244 29.278
29 HG13 ILE 5 HG13 ILE 5 58.775 11.867 27.745
30 HG21 ILE 5 HG21 ILE 5 58.281 15.664 28.259
31 HG22 ILE 5 HG22 ILE 5 57.261 14.388 28.919
32 HG23 ILE 5 HG23 ILE 5 57.701 14.369 27.213
33 HD11 ILE 5 HD11 ILE 5 59.694 10.470 29.449
34 HD12 ILE 5 HD12 ILE 5 60.043 11.864 30.469
35 HD13 ILE 5 HD13 ILE 5 60.923 11.636 28.960
36 H VAL 6 H VAL 6 60.901 11.722 26.325
37 HA VAL 6 HA VAL 6 59.897 12.495 23.699
38 HB VAL 6 HB VAL 6 60.761 9.757 24.643
39 HG11 VAL 6 HG11 VAL 6 59.494 9.656 22.598
40 HG12 VAL 6 HG12 VAL 6 61.198 9.391 22.228
41 HG13 VAL 6 HG13 VAL 6 60.456 10.955 21.893
42 HG21 VAL 6 HG21 VAL 6 62.410 11.900 23.301
43 HG22 VAL 6 HG22 VAL 6 62.951 10.273 23.713
44 HG23 VAL 6 HG23 VAL 6 62.539 11.414 24.991
45 H GLU 7 H GLU 7 57.908 12.311 22.971
46 HA GLU 7 HA GLU 7 56.051 10.551 24.491
47 HB2 GLU 7 HB2 GLU 7 55.393 12.897 22.701
48 HB3 GLU 7 HB3 GLU 7 54.244 11.965 23.648
49 HG2 GLU 7 HG2 GLU 7 56.444 13.720 24.717
50 HG3 GLU 7 HG3 GLU 7 54.716 14.066 24.733
51 H TYR 8 H TYR 8 57.641 10.996 21.471
52 HA TYR 8 HA TYR 8 55.998 8.795 20.334
53 HB2 TYR 8 HB2 TYR 8 56.966 11.239 18.835
54 HB3 TYR 8 HB3 TYR 8 56.134 9.865 18.119
55 HD1 TYR 8 HD1 TYR 8 55.751 12.754 20.388
56 HD2 TYR 8 HD2 TYR 8 53.758 9.672 18.234
57 HE1 TYR 8 HE1 TYR 8 53.595 13.850 20.826
58 HE2 TYR 8 HE2 TYR 8 51.596 10.762 18.664
59 HH TYR 8 HH TYR 8 50.641 12.353 20.389
60 H ASP 9 H ASP 9 57.093 7.244 19.190
61 HA ASP 9 HA ASP 9 59.969 7.152 19.641
62 HB2 ASP 9 HB2 ASP 9 58.145 5.275 18.115
63 HB3 ASP 9 HB3 ASP 9 59.831 4.953 18.500
64 H TYR 10 H TYR 10 61.579 7.727 18.305
65 HA TYR 10 HA TYR 10 60.862 8.179 15.443
66 HB2 TYR 10 HB2 TYR 10 61.140 10.307 16.802
67 HB3 TYR 10 HB3 TYR 10 62.837 9.870 16.978
68 HD1 TYR 10 HD2 TYR 10 60.220 10.663 14.472
69 HD2 TYR 10 HD1 TYR 10 64.387 10.345 15.262
70 HE1 TYR 10 HE2 TYR 10 60.703 11.723 12.309
71 HE2 TYR 10 HE1 TYR 10 64.882 11.403 13.098
72 HH TYR 10 HH TYR 10 62.576 13.021 11.267
73 H ASP 11 H ASP 11 62.222 7.413 13.925
74 HA ASP 11 HA ASP 11 64.469 5.777 14.935
75 HB2 ASP 11 HB2 ASP 11 62.869 4.697 13.427
76 HB3 ASP 11 HB3 ASP 11 63.190 5.912 12.194
77 H ALA 12 H ALA 12 66.462 6.530 14.959
78 HA ALA 12 HA ALA 12 67.165 8.989 13.654
79 HB1 ALA 12 HB1 ALA 12 68.911 6.887 14.926
80 HB2 ALA 12 HB2 ALA 12 68.261 8.333 15.700
81 HB3 ALA 12 HB3 ALA 12 69.458 8.482 14.414
82 H VAL 13 H VAL 13 67.166 9.143 11.523
83 HA VAL 13 HA VAL 13 68.223 6.920 9.899
84 HB VAL 13 HB VAL 13 67.082 9.577 9.003
85 HG11 VAL 13 HG11 VAL 13 66.815 8.440 6.826
86 HG12 VAL 13 HG12 VAL 13 67.685 7.048 7.471
87 HG13 VAL 13 HG13 VAL 13 68.503 8.601 7.310
88 HG21 VAL 13 HG21 VAL 13 65.407 8.296 10.206
89 HG22 VAL 13 HG22 VAL 13 65.760 6.873 9.226
90 HG23 VAL 13 HG23 VAL 13 65.042 8.300 8.481
91 H HIS 14 H HIS 14 68.993 10.216 10.883
92 HA HIS 14 HA HIS 14 71.410 10.239 9.194
93 HB2 HIS 14 HB2 HIS 14 70.451 12.319 11.172
94 HB3 HIS 14 HB3 HIS 14 71.681 12.531 9.933
95 HD1 HIS 14 HD1 HIS 14 68.065 12.786 10.564
96 HD2 HIS 14 HD2 HIS 14 70.607 12.530 7.238
97 HE1 HIS 14 HE1 HIS 14 66.696 13.514 8.558
98 HE2 HIS 14 HE2 HIS 14 68.205 13.266 6.528
99 H ASP 15 H ASP 15 73.450 11.157 10.326
100 HA ASP 15 HA ASP 15 74.119 9.244 12.414
101 HB2 ASP 15 HB2 ASP 15 75.727 11.475 11.144
102 HB3 ASP 15 HB3 ASP 15 76.376 10.319 12.304
103 H ASP 16 H ASP 16 73.511 12.719 12.167
104 HA ASP 16 HA ASP 16 74.041 13.055 15.052
105 HB2 ASP 16 HB2 ASP 16 73.722 15.443 14.625
106 HB3 ASP 16 HB3 ASP 16 74.867 14.764 13.473
107 H GLU 17 H GLU 17 71.660 11.565 13.685
108 HA GLU 17 HA GLU 17 69.413 13.138 14.767
109 HB2 GLU 17 HB2 GLU 17 69.161 12.102 12.554
110 HB3 GLU 17 HB3 GLU 17 69.476 10.519 13.249
111 HG2 GLU 17 HG2 GLU 17 67.100 10.885 12.833
112 HG3 GLU 17 HG3 GLU 17 67.439 10.647 14.545
113 H LEU 18 H LEU 18 68.510 12.768 16.696
114 HA LEU 18 HA LEU 18 69.649 10.597 18.309
115 HB2 LEU 18 HB2 LEU 18 68.711 13.165 18.842
116 HB3 LEU 18 HB3 LEU 18 67.507 12.110 19.553
117 HG LEU 18 HG LEU 18 70.459 12.150 20.180
118 HD11 LEU 18 HD11 LEU 18 68.048 12.833 21.857
119 HD12 LEU 18 HD12 LEU 18 69.180 13.989 21.157
120 HD13 LEU 18 HD13 LEU 18 69.728 12.858 22.391
121 HD21 LEU 18 HD21 LEU 18 69.932 10.451 21.873
122 HD22 LEU 18 HD22 LEU 18 69.644 9.864 20.235
123 HD23 LEU 18 HD23 LEU 18 68.285 10.351 21.249
124 H THR 19 H THR 19 68.778 8.676 18.632
125 HA THR 19 HA THR 19 66.136 8.106 17.503
126 HB THR 19 HB THR 19 67.874 6.233 19.129
127 HG1 THR 19 HG1 THR 19 69.205 6.556 17.483
128 HG21 THR 19 HG21 THR 19 65.615 5.429 18.814
129 HG22 THR 19 HG22 THR 19 66.707 4.500 17.788
130 HG23 THR 19 HG23 THR 19 65.700 5.766 17.085
131 H ILE 20 H ILE 20 64.792 9.465 18.838
132 HA ILE 20 HA ILE 20 64.810 8.938 21.714
133 HB ILE 20 HB ILE 20 63.010 10.626 21.796
134 HG12 ILE 20 HG12 ILE 20 63.429 10.840 18.804
135 HG13 ILE 20 HG13 ILE 20 62.010 10.143 19.577
136 HG21 ILE 20 HG21 ILE 20 65.277 11.377 22.013
137 HG22 ILE 20 HG22 ILE 20 64.391 12.546 21.036
138 HG23 ILE 20 HG23 ILE 20 65.485 11.400 20.263
139 HD11 ILE 20 HD11 ILE 20 62.909 12.993 19.907
140 HD12 ILE 20 HD12 ILE 20 61.418 12.270 20.516
141 HD13 ILE 20 HD13 ILE 20 61.669 12.446 18.779
142 H ARG 21 H ARG 21 63.463 7.695 22.833
143 HA ARG 21 HA ARG 21 61.180 6.475 21.343
144 HB2 ARG 21 HB2 ARG 21 62.912 5.257 23.504
145 HB3 ARG 21 HB3 ARG 21 61.479 4.498 22.823
146 HG2 ARG 21 HG2 ARG 21 62.520 4.363 20.656
147 HG3 ARG 21 HG3 ARG 21 63.923 5.261 21.238
148 HD2 ARG 21 HD2 ARG 21 63.024 2.578 22.280
149 HD3 ARG 21 HD3 ARG 21 64.320 2.826 21.111
150 HE ARG 21 HE ARG 21 64.400 3.307 23.999
151 HH11 ARG 21 HH11 ARG 21 65.924 3.937 20.863
152 HH12 ARG 21 HH12 ARG 21 67.469 4.297 21.552
153 HH21 ARG 21 HH21 ARG 21 66.452 3.793 24.862
154 HH22 ARG 21 HH22 ARG 21 67.770 4.217 23.821
155 H VAL 22 H VAL 22 59.184 6.435 22.295
156 HA VAL 22 HA VAL 22 58.425 8.388 24.058
157 HB VAL 22 HB VAL 22 57.154 5.648 23.931
158 HG11 VAL 22 HG11 VAL 22 55.082 6.880 24.497
159 HG12 VAL 22 HG12 VAL 22 56.046 8.337 24.734
160 HG13 VAL 22 HG13 VAL 22 56.292 6.937 25.777
161 HG21 VAL 22 HG21 VAL 22 56.796 8.074 22.181
162 HG22 VAL 22 HG22 VAL 22 55.681 6.710 22.209
163 HG23 VAL 22 HG23 VAL 22 57.351 6.474 21.699
164 H GLY 23 H GLY 23 58.837 8.903 26.084
165 HA2 GLY 23 HA2 GLY 23 58.637 8.248 28.422
166 HA3 GLY 23 HA3 GLY 23 59.269 6.665 28.008
167 H GLU 24 H GLU 24 61.325 8.180 26.196
168 HA GLU 24 HA GLU 24 63.357 8.252 28.247
169 HB2 GLU 24 HB2 GLU 24 63.376 8.856 25.296
170 HB3 GLU 24 HB3 GLU 24 64.807 9.023 26.300
171 HG2 GLU 24 HG2 GLU 24 64.472 6.602 26.948
172 HG3 GLU 24 HG3 GLU 24 63.282 6.523 25.648
173 H ILE 25 H ILE 25 64.700 9.938 28.864
174 HA ILE 25 HA ILE 25 63.469 12.636 28.520
175 HB ILE 25 HB ILE 25 65.232 11.660 30.777
176 HG12 ILE 25 HG12 ILE 25 62.269 12.279 30.778
177 HG13 ILE 25 HG13 ILE 25 62.954 10.658 30.775
178 HG21 ILE 25 HG21 ILE 25 64.604 13.796 31.851
179 HG22 ILE 25 HG22 ILE 25 63.789 14.276 30.363
180 HG23 ILE 25 HG23 ILE 25 65.534 14.022 30.370
181 HD11 ILE 25 HD11 ILE 25 63.290 12.719 32.943
182 HD12 ILE 25 HD12 ILE 25 63.993 11.101 32.941
183 HD13 ILE 25 HD13 ILE 25 62.242 11.302 32.999
184 H ILE 26 H ILE 26 64.583 14.114 27.431
185 HA ILE 26 HA ILE 26 67.380 13.423 26.718
186 HB ILE 26 HB ILE 26 65.676 15.597 25.507
187 HG12 ILE 26 HG12 ILE 26 66.122 12.777 24.496
188 HG13 ILE 26 HG13 ILE 26 64.630 13.357 25.229
189 HG21 ILE 26 HG21 ILE 26 68.119 15.798 25.226
190 HG22 ILE 26 HG22 ILE 26 67.286 15.518 23.699
191 HG23 ILE 26 HG23 ILE 26 68.146 14.197 24.486
192 HD11 ILE 26 HD11 ILE 26 64.301 13.377 22.898
193 HD12 ILE 26 HD12 ILE 26 65.846 14.178 22.613
194 HD13 ILE 26 HD13 ILE 26 64.525 15.058 23.382
195 H ARG 27 H ARG 27 69.036 14.390 27.657
196 HA ARG 27 HA ARG 27 68.547 16.487 29.585
197 HB2 ARG 27 HB2 ARG 27 71.213 15.485 28.583
198 HB3 ARG 27 HB3 ARG 27 70.891 16.319 30.097
199 HG2 ARG 27 HG2 ARG 27 69.994 13.547 29.334
200 HG3 ARG 27 HG3 ARG 27 71.217 13.982 30.529
201 HD2 ARG 27 HD2 ARG 27 69.575 14.963 31.958
202 HD3 ARG 27 HD3 ARG 27 68.331 14.826 30.717
203 HE ARG 27 HE ARG 27 69.428 12.249 31.371
204 HH11 ARG 27 HH11 ARG 27 67.208 14.743 32.550
205 HH12 ARG 27 HH12 ARG 27 66.242 13.627 33.452
206 HH21 ARG 27 HH21 ARG 27 68.126 10.814 32.569
207 HH22 ARG 27 HH22 ARG 27 66.762 11.396 33.464
208 H ASN 28 H ASN 28 68.788 18.610 29.485
209 HA ASN 28 HA ASN 28 68.942 20.654 28.526
210 HB2 ASN 28 HB2 ASN 28 71.200 21.219 27.574
211 HB3 ASN 28 HB3 ASN 28 71.224 20.481 29.169
212 HD21 ASN 28 HD21 ASN 28 72.059 18.423 29.459
213 HD22 ASN 28 HD22 ASN 28 73.027 17.616 28.176
214 H VAL 29 H VAL 29 67.139 19.979 27.099
215 HA VAL 29 HA VAL 29 67.892 19.640 24.283
216 HB VAL 29 HB VAL 29 65.193 19.871 25.612
217 HG11 VAL 29 HG11 VAL 29 64.972 20.688 23.371
218 HG12 VAL 29 HG12 VAL 29 64.309 19.056 23.428
219 HG13 VAL 29 HG13 VAL 29 65.905 19.335 22.734
220 HG21 VAL 29 HG21 VAL 29 66.034 17.810 26.247
221 HG22 VAL 29 HG22 VAL 29 66.897 17.580 24.728
222 HG23 VAL 29 HG23 VAL 29 65.143 17.418 24.777
223 H LYS 30 H LYS 30 68.556 21.334 23.175
224 HA LYS 30 HA LYS 30 67.279 23.970 23.718
225 HB2 LYS 30 HB2 LYS 30 69.741 23.827 23.996
226 HB3 LYS 30 HB3 LYS 30 69.886 23.330 22.317
227 HG2 LYS 30 HG2 LYS 30 68.924 25.494 21.626
228 HG3 LYS 30 HG3 LYS 30 68.881 25.986 23.319
229 HD2 LYS 30 HD2 LYS 30 70.850 26.901 22.252
230 HD3 LYS 30 HD3 LYS 30 71.328 25.685 23.436
231 HE2 LYS 30 HE2 LYS 30 72.629 25.442 21.399
232 HE3 LYS 30 HE3 LYS 30 71.585 24.041 21.634
233 HZ1 LYS 30 HZ1 LYS 30 70.064 24.901 20.003
234 HZ2 LYS 30 HZ2 LYS 30 71.614 24.850 19.327
235 HZ3 LYS 30 HZ3 LYS 30 70.963 26.325 19.837
236 H LYS 31 H LYS 31 66.930 25.402 21.840
237 HA LYS 31 HA LYS 31 65.745 23.819 19.654
238 HB2 LYS 31 HB2 LYS 31 65.634 26.779 20.274
239 HB3 LYS 31 HB3 LYS 31 64.797 26.011 18.931
240 HG2 LYS 31 HG2 LYS 31 63.561 24.615 20.564
241 HG3 LYS 31 HG3 LYS 31 64.332 25.523 21.866
242 HD2 LYS 31 HD2 LYS 31 63.342 27.594 20.987
243 HD3 LYS 31 HD3 LYS 31 62.549 26.663 19.714
244 HE2 LYS 31 HE2 LYS 31 61.348 25.377 21.439
245 HE3 LYS 31 HE3 LYS 31 62.106 26.369 22.685
246 HZ1 LYS 31 HZ1 LYS 31 60.281 27.347 20.554
247 HZ2 LYS 31 HZ2 LYS 31 61.024 28.316 21.725
248 HZ3 LYS 31 HZ3 LYS 31 59.887 27.153 22.188
249 H LEU 32 H LEU 32 66.503 23.680 17.623
250 HA LEU 32 HA LEU 32 69.153 24.895 17.151
251 HB2 LEU 32 HB2 LEU 32 67.584 22.787 15.669
252 HB3 LEU 32 HB3 LEU 32 69.149 23.382 15.149
253 HG LEU 32 HG LEU 32 68.655 22.025 17.800
254 HD11 LEU 32 HD11 LEU 32 68.255 20.484 15.949
255 HD12 LEU 32 HD12 LEU 32 69.738 20.076 16.813
256 HD13 LEU 32 HD13 LEU 32 69.823 20.901 15.257
257 HD21 LEU 32 HD21 LEU 32 71.185 22.800 16.351
258 HD22 LEU 32 HD22 LEU 32 71.114 21.838 17.826
259 HD23 LEU 32 HD23 LEU 32 70.564 23.513 17.839
260 H GLN 33 H GLN 33 69.485 25.308 14.611
261 HA GLN 33 HA GLN 33 67.734 27.581 14.066
262 HB2 GLN 33 HB2 GLN 33 70.167 26.456 12.684
263 HB3 GLN 33 HB3 GLN 33 69.253 27.804 12.025
264 HG2 GLN 33 HG2 GLN 33 71.125 28.676 13.205
265 HG3 GLN 33 HG3 GLN 33 69.674 29.047 14.133
266 HE21 GLN 33 HE21 GLN 33 72.581 27.097 13.941
267 HE22 GLN 33 HE22 GLN 33 72.574 26.586 15.664
268 H GLU 34 H GLU 34 67.358 24.348 13.568
269 HA GLU 34 HA GLU 34 66.016 24.724 10.946
270 HB2 GLU 34 HB2 GLU 34 66.770 22.160 12.366
271 HB3 GLU 34 HB3 GLU 34 66.058 22.284 10.763
272 HG2 GLU 34 HG2 GLU 34 68.774 23.296 11.579
273 HG3 GLU 34 HG3 GLU 34 68.442 21.843 10.637
274 H GLU 35 H GLU 35 63.897 24.970 10.936
275 HA GLU 35 HA GLU 35 62.346 24.882 13.308
276 HB2 GLU 35 HB2 GLU 35 61.470 24.748 10.415
277 HB3 GLU 35 HB3 GLU 35 60.383 25.015 11.772
278 HG2 GLU 35 HG2 GLU 35 61.557 27.083 12.312
279 HG3 GLU 35 HG3 GLU 35 62.660 26.813 10.965
280 H GLY 36 H GLY 36 61.689 23.228 14.489
281 HA2 GLY 36 HA2 GLY 36 60.461 21.213 14.753
282 HA3 GLY 36 HA3 GLY 36 60.786 20.784 13.083
283 H TRP 37 H TRP 37 63.555 21.933 14.732
284 HA TRP 37 HA TRP 37 64.328 19.154 15.437
285 HB2 TRP 37 HB2 TRP 37 65.913 21.140 13.807
286 HB3 TRP 37 HB3 TRP 37 66.637 19.723 14.562
287 HD1 TRP 37 HD1 TRP 37 65.236 20.765 11.371
288 HE1 TRP 37 HE1 TRP 37 64.580 18.742 9.882
289 HE3 TRP 37 HE3 TRP 37 65.398 17.124 14.949
290 HZ2 TRP 37 HZ2 TRP 37 64.194 15.962 10.254
291 HZ3 TRP 37 HZ3 TRP 37 64.870 14.812 14.304
292 HH2 TRP 37 HH2 TRP 37 64.280 14.244 12.005
293 H LEU 38 H LEU 38 65.234 18.885 17.325
294 HA LEU 38 HA LEU 38 66.173 21.323 18.773
295 HB2 LEU 38 HB2 LEU 38 64.702 18.913 19.848
296 HB3 LEU 38 HB3 LEU 38 65.482 20.110 20.865
297 HG LEU 38 HG LEU 38 63.960 21.828 19.716
298 HD11 LEU 38 HD11 LEU 38 63.185 20.556 17.851
299 HD12 LEU 38 HD12 LEU 38 61.811 20.848 18.914
300 HD13 LEU 38 HD13 LEU 38 62.596 19.269 18.902
301 HD21 LEU 38 HD21 LEU 38 62.078 21.270 21.223
302 HD22 LEU 38 HD22 LEU 38 63.652 21.191 22.015
303 HD23 LEU 38 HD23 LEU 38 62.831 19.706 21.535
304 H GLU 39 H GLU 39 67.761 20.788 20.552
305 HA GLU 39 HA GLU 39 69.428 18.453 19.733
306 HB2 GLU 39 HB2 GLU 39 70.443 20.491 18.855
307 HB3 GLU 39 HB3 GLU 39 70.406 21.224 20.451
308 HG2 GLU 39 HG2 GLU 39 72.633 20.374 19.762
309 HG3 GLU 39 HG3 GLU 39 72.035 19.695 21.275
310 H GLY 40 H GLY 40 69.805 17.056 21.307
311 HA2 GLY 40 HA2 GLY 40 70.239 18.047 24.041
312 HA3 GLY 40 HA3 GLY 40 68.793 17.078 23.824
313 H GLU 41 H GLU 41 70.818 16.375 25.583
314 HA GLU 41 HA GLU 41 72.321 14.242 24.188
315 HB2 GLU 41 HB2 GLU 41 73.474 15.777 25.795
316 HB3 GLU 41 HB3 GLU 41 72.491 15.091 27.082
317 HG2 GLU 41 HG2 GLU 41 73.480 12.927 26.759
318 HG3 GLU 41 HG3 GLU 41 74.363 13.500 25.344
319 H LEU 42 H LEU 42 71.156 12.498 23.821
320 HA LEU 42 HA LEU 42 69.722 11.312 26.151
321 HB2 LEU 42 HB2 LEU 42 68.096 12.161 24.533
322 HB3 LEU 42 HB3 LEU 42 68.875 11.249 23.255
323 HG LEU 42 HG LEU 42 68.269 9.144 24.448
324 HD11 LEU 42 HD11 LEU 42 68.074 10.144 26.698
325 HD12 LEU 42 HD12 LEU 42 66.662 9.194 26.238
326 HD13 LEU 42 HD13 LEU 42 66.596 10.955 26.179
327 HD21 LEU 42 HD21 LEU 42 66.903 10.015 22.612
328 HD22 LEU 42 HD22 LEU 42 65.952 10.950 23.766
329 HD23 LEU 42 HD23 LEU 42 65.920 9.188 23.819
330 H ASN 43 H ASN 43 70.049 9.191 26.561
331 HA ASN 43 HA ASN 43 71.085 7.159 26.466
332 HB2 ASN 43 HB2 ASN 43 69.872 7.191 24.179
333 HB3 ASN 43 HB3 ASN 43 71.468 7.478 23.495
334 HD21 ASN 43 HD21 ASN 43 69.416 5.235 25.239
335 HD22 ASN 43 HD22 ASN 43 70.433 3.783 24.937
336 H GLY 44 H GLY 44 72.643 9.791 26.597
337 HA2 GLY 44 HA2 GLY 44 74.890 10.139 27.069
338 HA3 GLY 44 HA3 GLY 44 75.261 8.524 26.492
339 H ARG 45 H ARG 45 73.395 10.325 24.290
340 HA ARG 45 HA ARG 45 75.835 11.261 22.892
341 HB2 ARG 45 HB2 ARG 45 75.204 9.118 21.896
342 HB3 ARG 45 HB3 ARG 45 73.561 9.691 21.660
343 HG2 ARG 45 HG2 ARG 45 74.776 9.748 19.576
344 HG3 ARG 45 HG3 ARG 45 74.385 11.389 20.093
345 HD2 ARG 45 HD2 ARG 45 76.669 11.598 21.016
346 HD3 ARG 45 HD3 ARG 45 77.044 9.994 20.392
347 HE ARG 45 HE ARG 45 76.445 11.005 18.107
348 HH11 ARG 45 HH11 ARG 45 77.875 12.879 20.763
349 HH12 ARG 45 HH12 ARG 45 78.626 14.020 19.703
350 HH21 ARG 45 HH21 ARG 45 77.455 12.532 16.763
351 HH22 ARG 45 HH22 ARG 45 78.389 13.826 17.436
352 H ARG 46 H ARG 46 75.626 13.123 21.697
353 HA ARG 46 HA ARG 46 73.148 14.631 22.300
354 HB2 ARG 46 HB2 ARG 46 75.819 15.563 21.208
355 HB3 ARG 46 HB3 ARG 46 74.452 16.610 21.568
356 HG2 ARG 46 HG2 ARG 46 74.590 15.938 23.933
357 HG3 ARG 46 HG3 ARG 46 76.006 14.957 23.550
358 HD2 ARG 46 HD2 ARG 46 77.195 16.954 22.806
359 HD3 ARG 46 HD3 ARG 46 75.777 17.940 23.158
360 HE ARG 46 HE ARG 46 77.721 16.870 25.059
361 HH11 ARG 46 HH11 ARG 46 74.458 18.178 24.626
362 HH12 ARG 46 HH12 ARG 46 74.321 18.702 26.269
363 HH21 ARG 46 HH21 ARG 46 77.495 17.579 27.215
364 HH22 ARG 46 HH22 ARG 46 76.043 18.364 27.738
365 H GLY 47 H GLY 47 71.589 14.629 20.828
366 HA2 GLY 47 HA2 GLY 47 72.378 14.783 17.986
367 HA3 GLY 47 HA3 GLY 47 71.430 13.390 18.468
368 H MET 48 H MET 48 70.780 15.427 16.540
369 HA MET 48 HA MET 48 68.771 17.097 17.789
370 HB2 MET 48 HB2 MET 48 68.305 17.927 15.600
371 HB3 MET 48 HB3 MET 48 70.047 17.726 15.713
372 HG2 MET 48 HG2 MET 48 69.963 15.719 14.412
373 HG3 MET 48 HG3 MET 48 68.200 15.724 14.433
374 HE1 MET 48 HE1 MET 48 67.986 15.493 11.849
375 HE2 MET 48 HE2 MET 48 69.741 15.375 11.726
376 HE3 MET 48 HE3 MET 48 68.859 16.495 10.687
377 H PHE 49 H PHE 49 66.534 16.953 17.650
378 HA PHE 49 HA PHE 49 65.440 14.471 16.476
379 HB2 PHE 49 HB2 PHE 49 64.047 14.276 18.691
380 HB3 PHE 49 HB3 PHE 49 65.669 13.596 18.609
381 HD1 PHE 49 HD1 PHE 49 63.623 16.337 19.943
382 HD2 PHE 49 HD2 PHE 49 67.468 14.521 19.869
383 HE1 PHE 49 HE1 PHE 49 64.303 17.703 21.872
384 HE2 PHE 49 HE2 PHE 49 68.152 15.880 21.798
385 HZ PHE 49 HZ PHE 49 66.571 17.474 22.802
386 HA PRO 50 HA PRO 50 62.049 16.924 15.174
387 HB2 PRO 50 HB2 PRO 50 59.906 15.291 15.839
388 HB3 PRO 50 HB3 PRO 50 60.874 15.159 14.369
389 HG2 PRO 50 HG2 PRO 50 61.060 13.601 16.907
390 HG3 PRO 50 HG3 PRO 50 61.260 13.054 15.235
391 HD2 PRO 50 HD2 PRO 50 63.364 13.460 16.848
392 HD3 PRO 50 HD3 PRO 50 63.437 13.825 15.111
393 H ASP 51 H ASP 51 60.537 18.375 15.833
394 HA ASP 51 HA ASP 51 60.601 19.067 18.636
395 HB2 ASP 51 HB2 ASP 51 59.324 21.002 18.013
396 HB3 ASP 51 HB3 ASP 51 60.513 20.707 16.750
397 H ASN 52 H ASN 52 58.075 17.694 16.505
398 HA ASN 52 HA ASN 52 56.119 17.788 18.673
399 HB2 ASN 52 HB2 ASN 52 54.582 16.780 17.070
400 HB3 ASN 52 HB3 ASN 52 55.424 18.148 16.353
401 HD21 ASN 52 HD21 ASN 52 54.834 14.749 16.267
402 HD22 ASN 52 HD22 ASN 52 55.773 14.417 14.770
403 H PHE 53 H PHE 53 58.700 15.922 18.552
404 HA PHE 53 HA PHE 53 57.244 13.433 19.282
405 HB2 PHE 53 HB2 PHE 53 60.018 13.967 18.274
406 HB3 PHE 53 HB3 PHE 53 59.667 12.487 19.159
407 HD1 PHE 53 HD1 PHE 53 58.271 14.483 16.324
408 HD2 PHE 53 HD2 PHE 53 59.086 10.634 17.944
409 HE1 PHE 53 HE1 PHE 53 57.445 13.440 14.255
410 HE2 PHE 53 HE2 PHE 53 58.259 9.587 15.879
411 HZ PHE 53 HZ PHE 53 57.439 10.990 14.031
412 H VAL 54 H VAL 54 59.329 15.977 20.457
413 HA VAL 54 HA VAL 54 59.390 14.627 23.112
414 HB VAL 54 HB VAL 54 61.377 16.003 23.625
415 HG11 VAL 54 HG11 VAL 54 61.607 14.267 21.172
416 HG12 VAL 54 HG12 VAL 54 61.714 13.745 22.853
417 HG13 VAL 54 HG13 VAL 54 62.963 14.785 22.172
418 HG21 VAL 54 HG21 VAL 54 60.917 17.846 22.051
419 HG22 VAL 54 HG22 VAL 54 61.300 16.773 20.706
420 HG23 VAL 54 HG23 VAL 54 62.549 17.206 21.872
421 H LYS 55 H LYS 55 58.702 15.732 24.899
422 HA LYS 55 HA LYS 55 57.583 18.445 24.351
423 HB2 LYS 55 HB2 LYS 55 56.522 16.384 26.295
424 HB3 LYS 55 HB3 LYS 55 55.819 17.960 25.963
425 HG2 LYS 55 HG2 LYS 55 56.060 15.695 23.993
426 HG3 LYS 55 HG3 LYS 55 54.594 16.166 24.855
427 HD2 LYS 55 HD2 LYS 55 54.551 18.292 23.738
428 HD3 LYS 55 HD3 LYS 55 56.125 17.988 23.002
429 HE2 LYS 55 HE2 LYS 55 53.625 16.379 22.492
430 HE3 LYS 55 HE3 LYS 55 54.256 17.638 21.431
431 HZ1 LYS 55 HZ1 LYS 55 55.580 15.070 22.121
432 HZ2 LYS 55 HZ2 LYS 55 56.308 16.305 21.223
433 HZ3 LYS 55 HZ3 LYS 55 54.942 15.512 20.617
434 H GLU 56 H GLU 56 58.328 20.079 25.554
435 HA GLU 56 HA GLU 56 60.449 19.664 27.395
436 HB2 GLU 56 HB2 GLU 56 60.176 22.042 27.973
437 HB3 GLU 56 HB3 GLU 56 60.149 21.785 26.237
438 HG2 GLU 56 HG2 GLU 56 57.683 21.913 26.292
439 HG3 GLU 56 HG3 GLU 56 57.774 22.283 28.013
440 H ILE 57 H ILE 57 60.563 19.302 29.553
441 HA ILE 57 HA ILE 57 57.996 18.769 30.890
442 HB ILE 57 HB ILE 57 60.793 18.351 31.955
443 HG12 ILE 57 HG12 ILE 57 58.920 16.462 30.509
444 HG13 ILE 57 HG13 ILE 57 60.500 17.008 29.959
445 HG21 ILE 57 HG21 ILE 57 59.704 16.833 33.544
446 HG22 ILE 57 HG22 ILE 57 58.131 17.267 32.872
447 HG23 ILE 57 HG23 ILE 57 59.102 18.483 33.701
448 HD11 ILE 57 HD11 ILE 57 61.460 15.856 31.989
449 HD12 ILE 57 HD12 ILE 57 60.789 14.810 30.740
450 HD13 ILE 57 HD13 ILE 57 59.870 15.128 32.211
451 H LYS 58 H LYS 58 57.200 20.875 31.096
452 HA LYS 58 HA LYS 58 58.722 22.858 32.592
453 HB2 LYS 58 HB2 LYS 58 55.796 22.859 31.824
454 HB3 LYS 58 HB3 LYS 58 56.724 24.245 32.380
455 HG2 LYS 58 HG2 LYS 58 58.131 24.102 30.384
456 HG3 LYS 58 HG3 LYS 58 57.194 22.716 29.828
457 HD2 LYS 58 HD2 LYS 58 56.371 24.637 28.681
458 HD3 LYS 58 HD3 LYS 58 55.160 24.183 29.880
459 HE2 LYS 58 HE2 LYS 58 55.441 26.578 29.893
460 HE3 LYS 58 HE3 LYS 58 56.065 25.909 31.400
461 HZ1 LYS 58 HZ1 LYS 58 58.297 26.114 30.561
462 HZ2 LYS 58 HZ2 LYS 58 57.522 27.611 30.430
463 HZ3 LYS 58 HZ3 LYS 58 57.736 26.648 29.056
Start of MODEL 9
1 H1 VAL 2 H1 VAL 2 66.877 24.291 29.394
2 H2 VAL 2 H2 VAL 2 66.965 23.232 28.077
3 H3 VAL 2 H3 VAL 2 67.630 22.786 29.567
4 HA VAL 2 HA VAL 2 65.497 22.687 30.589
5 HB VAL 2 HB VAL 2 64.452 24.521 29.322
6 HG11 VAL 2 HG11 VAL 2 65.274 23.956 27.092
7 HG12 VAL 2 HG12 VAL 2 63.521 24.144 27.101
8 HG13 VAL 2 HG13 VAL 2 64.235 22.531 27.065
9 HG21 VAL 2 HG21 VAL 2 62.218 23.575 29.165
10 HG22 VAL 2 HG22 VAL 2 63.057 22.944 30.582
11 HG23 VAL 2 HG23 VAL 2 62.891 21.945 29.137
12 H ASP 3 H ASP 3 64.624 20.689 30.804
13 HA ASP 3 HA ASP 3 65.613 18.680 28.909
14 HB2 ASP 3 HB2 ASP 3 64.133 18.474 31.534
15 HB3 ASP 3 HB3 ASP 3 64.577 17.073 30.562
16 H TYR 4 H TYR 4 64.316 17.042 27.954
17 HA TYR 4 HA TYR 4 61.468 17.829 27.569
18 HB2 TYR 4 HB2 TYR 4 63.579 17.427 25.513
19 HB3 TYR 4 HB3 TYR 4 61.970 16.827 25.148
20 HD1 TYR 4 HD2 TYR 4 63.446 19.944 26.629
21 HD2 TYR 4 HD1 TYR 4 60.683 18.240 23.882
22 HE1 TYR 4 HE2 TYR 4 62.766 22.198 25.923
23 HE2 TYR 4 HE1 TYR 4 59.998 20.488 23.166
24 HH TYR 4 HH TYR 4 60.003 22.810 24.115
25 H ILE 5 H ILE 5 60.023 16.165 27.041
26 HA ILE 5 HA ILE 5 61.076 13.454 27.708
27 HB ILE 5 HB ILE 5 59.578 14.071 29.454
28 HG12 ILE 5 HG12 ILE 5 57.638 12.516 29.123
29 HG13 ILE 5 HG13 ILE 5 58.126 12.339 27.442
30 HG21 ILE 5 HG21 ILE 5 57.682 14.980 27.299
31 HG22 ILE 5 HG22 ILE 5 58.491 15.974 28.510
32 HG23 ILE 5 HG23 ILE 5 57.247 14.825 29.002
33 HD11 ILE 5 HD11 ILE 5 58.926 10.466 28.676
34 HD12 ILE 5 HD12 ILE 5 59.673 11.513 29.881
35 HD13 ILE 5 HD13 ILE 5 60.309 11.466 28.238
36 H VAL 6 H VAL 6 60.871 11.889 26.227
37 HA VAL 6 HA VAL 6 59.827 12.622 23.625
38 HB VAL 6 HB VAL 6 60.679 9.884 24.577
39 HG11 VAL 6 HG11 VAL 6 60.441 11.088 21.823
40 HG12 VAL 6 HG12 VAL 6 59.443 9.805 22.508
41 HG13 VAL 6 HG13 VAL 6 61.150 9.514 22.177
42 HG21 VAL 6 HG21 VAL 6 62.888 10.379 23.738
43 HG22 VAL 6 HG22 VAL 6 62.442 11.581 24.947
44 HG23 VAL 6 HG23 VAL 6 62.373 11.989 23.234
45 H GLU 7 H GLU 7 57.833 12.427 22.886
46 HA GLU 7 HA GLU 7 55.982 10.666 24.413
47 HB2 GLU 7 HB2 GLU 7 55.580 13.219 24.143
48 HB3 GLU 7 HB3 GLU 7 55.096 12.811 22.503
49 HG2 GLU 7 HG2 GLU 7 53.806 11.103 24.445
50 HG3 GLU 7 HG3 GLU 7 53.499 12.808 24.769
51 H TYR 8 H TYR 8 57.568 11.118 21.378
52 HA TYR 8 HA TYR 8 55.942 8.888 20.262
53 HB2 TYR 8 HB2 TYR 8 56.975 11.294 18.741
54 HB3 TYR 8 HB3 TYR 8 56.174 9.902 18.022
55 HD1 TYR 8 HD1 TYR 8 53.770 9.569 18.304
56 HD2 TYR 8 HD2 TYR 8 55.721 12.974 19.944
57 HE1 TYR 8 HE1 TYR 8 51.590 10.662 18.611
58 HE2 TYR 8 HE2 TYR 8 53.548 14.077 20.257
59 HH TYR 8 HH TYR 8 51.244 13.932 19.246
60 H ASP 9 H ASP 9 57.040 7.294 19.192
61 HA ASP 9 HA ASP 9 59.899 7.161 19.718
62 HB2 ASP 9 HB2 ASP 9 58.009 5.314 18.244
63 HB3 ASP 9 HB3 ASP 9 59.714 4.963 18.495
64 H TYR 10 H TYR 10 61.576 7.588 18.393
65 HA TYR 10 HA TYR 10 60.955 7.994 15.513
66 HB2 TYR 10 HB2 TYR 10 61.094 10.193 16.729
67 HB3 TYR 10 HB3 TYR 10 62.771 9.811 17.107
68 HD1 TYR 10 HD1 TYR 10 64.473 9.815 15.355
69 HD2 TYR 10 HD2 TYR 10 60.428 10.794 14.476
70 HE1 TYR 10 HE1 TYR 10 65.173 10.748 13.190
71 HE2 TYR 10 HE2 TYR 10 61.117 11.730 12.312
72 HH TYR 10 HH TYR 10 63.204 12.696 11.298
73 H ASP 11 H ASP 11 62.315 7.064 14.137
74 HA ASP 11 HA ASP 11 64.647 5.671 15.312
75 HB2 ASP 11 HB2 ASP 11 63.314 5.401 12.607
76 HB3 ASP 11 HB3 ASP 11 64.692 4.446 13.146
77 H ALA 12 H ALA 12 66.604 6.496 15.202
78 HA ALA 12 HA ALA 12 67.173 8.876 13.733
79 HB1 ALA 12 HB1 ALA 12 69.515 8.470 14.391
80 HB2 ALA 12 HB2 ALA 12 69.048 6.877 14.986
81 HB3 ALA 12 HB3 ALA 12 68.390 8.329 15.743
82 H VAL 13 H VAL 13 67.120 8.984 11.603
83 HA VAL 13 HA VAL 13 68.113 6.722 10.004
84 HB VAL 13 HB VAL 13 66.048 7.894 9.311
85 HG11 VAL 13 HG11 VAL 13 66.633 10.151 10.040
86 HG12 VAL 13 HG12 VAL 13 66.151 10.130 8.345
87 HG13 VAL 13 HG13 VAL 13 67.857 10.247 8.775
88 HG21 VAL 13 HG21 VAL 13 68.325 8.168 7.350
89 HG22 VAL 13 HG22 VAL 13 66.610 8.132 6.942
90 HG23 VAL 13 HG23 VAL 13 67.378 6.710 7.648
91 H HIS 14 H HIS 14 68.947 10.048 10.846
92 HA HIS 14 HA HIS 14 71.360 9.952 9.156
93 HB2 HIS 14 HB2 HIS 14 70.505 12.125 11.080
94 HB3 HIS 14 HB3 HIS 14 71.679 12.259 9.777
95 HD1 HIS 14 HD1 HIS 14 68.177 12.833 10.579
96 HD2 HIS 14 HD2 HIS 14 70.402 11.990 7.124
97 HE1 HIS 14 HE1 HIS 14 66.718 13.484 8.608
98 HE2 HIS 14 HE2 HIS 14 68.050 12.942 6.513
99 H ASP 15 H ASP 15 73.424 10.883 10.256
100 HA ASP 15 HA ASP 15 74.063 9.026 12.410
101 HB2 ASP 15 HB2 ASP 15 75.726 11.176 11.072
102 HB3 ASP 15 HB3 ASP 15 76.344 10.015 12.242
103 H ASP 16 H ASP 16 73.493 12.485 12.027
104 HA ASP 16 HA ASP 16 74.086 12.956 14.878
105 HB2 ASP 16 HB2 ASP 16 73.666 15.335 14.314
106 HB3 ASP 16 HB3 ASP 16 74.903 14.610 13.292
107 H GLU 17 H GLU 17 71.612 11.509 13.472
108 HA GLU 17 HA GLU 17 69.422 13.110 14.594
109 HB2 GLU 17 HB2 GLU 17 69.122 11.993 12.429
110 HB3 GLU 17 HB3 GLU 17 69.444 10.435 13.175
111 HG2 GLU 17 HG2 GLU 17 67.062 10.804 12.781
112 HG3 GLU 17 HG3 GLU 17 67.430 10.606 14.493
113 H LEU 18 H LEU 18 68.582 12.842 16.564
114 HA LEU 18 HA LEU 18 69.708 10.723 18.241
115 HB2 LEU 18 HB2 LEU 18 69.172 13.240 18.809
116 HB3 LEU 18 HB3 LEU 18 67.576 12.604 19.153
117 HG LEU 18 HG LEU 18 68.491 11.126 20.859
118 HD11 LEU 18 HD11 LEU 18 71.155 12.324 20.105
119 HD12 LEU 18 HD12 LEU 18 70.656 10.647 19.888
120 HD13 LEU 18 HD13 LEU 18 70.860 11.301 21.512
121 HD21 LEU 18 HD21 LEU 18 69.410 12.917 22.400
122 HD22 LEU 18 HD22 LEU 18 67.829 13.233 21.686
123 HD23 LEU 18 HD23 LEU 18 69.264 14.027 21.038
124 H THR 19 H THR 19 68.810 8.850 18.723
125 HA THR 19 HA THR 19 66.170 8.246 17.588
126 HB THR 19 HB THR 19 67.917 6.424 19.263
127 HG1 THR 19 HG1 THR 19 69.225 6.633 17.588
128 HG21 THR 19 HG21 THR 19 65.592 5.695 18.971
129 HG22 THR 19 HG22 THR 19 66.711 4.636 18.113
130 HG23 THR 19 HG23 THR 19 65.770 5.832 17.222
131 H ILE 20 H ILE 20 64.740 9.540 18.835
132 HA ILE 20 HA ILE 20 64.796 9.156 21.743
133 HB ILE 20 HB ILE 20 62.985 10.827 21.768
134 HG12 ILE 20 HG12 ILE 20 63.357 10.880 18.762
135 HG13 ILE 20 HG13 ILE 20 61.945 10.253 19.604
136 HG21 ILE 20 HG21 ILE 20 65.259 11.604 21.911
137 HG22 ILE 20 HG22 ILE 20 64.326 12.732 20.931
138 HG23 ILE 20 HG23 ILE 20 65.416 11.584 20.155
139 HD11 ILE 20 HD11 ILE 20 62.881 13.103 19.785
140 HD12 ILE 20 HD12 ILE 20 61.366 12.427 20.386
141 HD13 ILE 20 HD13 ILE 20 61.662 12.524 18.651
142 H ARG 21 H ARG 21 63.482 7.878 22.884
143 HA ARG 21 HA ARG 21 61.248 6.572 21.392
144 HB2 ARG 21 HB2 ARG 21 62.675 5.382 23.768
145 HB3 ARG 21 HB3 ARG 21 61.606 4.574 22.631
146 HG2 ARG 21 HG2 ARG 21 64.390 5.587 22.087
147 HG3 ARG 21 HG3 ARG 21 63.876 3.905 22.217
148 HD2 ARG 21 HD2 ARG 21 62.926 5.854 20.119
149 HD3 ARG 21 HD3 ARG 21 64.188 4.649 19.880
150 HE ARG 21 HE ARG 21 61.917 3.278 20.808
151 HH11 ARG 21 HH11 ARG 21 62.874 5.204 17.993
152 HH12 ARG 21 HH12 ARG 21 61.807 4.374 16.912
153 HH21 ARG 21 HH21 ARG 21 60.524 2.214 19.349
154 HH22 ARG 21 HH22 ARG 21 60.472 2.678 17.681
155 H VAL 22 H VAL 22 59.232 6.507 22.302
156 HA VAL 22 HA VAL 22 58.398 8.495 24.007
157 HB VAL 22 HB VAL 22 57.172 5.734 23.880
158 HG11 VAL 22 HG11 VAL 22 56.266 7.038 25.705
159 HG12 VAL 22 HG12 VAL 22 55.073 6.916 24.412
160 HG13 VAL 22 HG13 VAL 22 55.990 8.406 24.628
161 HG21 VAL 22 HG21 VAL 22 57.427 6.588 21.647
162 HG22 VAL 22 HG22 VAL 22 56.768 8.148 22.124
163 HG23 VAL 22 HG23 VAL 22 55.732 6.723 22.111
164 H GLY 23 H GLY 23 58.696 9.035 26.054
165 HA2 GLY 23 HA2 GLY 23 58.488 8.431 28.386
166 HA3 GLY 23 HA3 GLY 23 59.095 6.829 28.014
167 H GLU 24 H GLU 24 61.217 8.280 26.217
168 HA GLU 24 HA GLU 24 63.206 8.337 28.311
169 HB2 GLU 24 HB2 GLU 24 63.308 8.884 25.348
170 HB3 GLU 24 HB3 GLU 24 64.723 8.983 26.384
171 HG2 GLU 24 HG2 GLU 24 63.025 6.519 26.093
172 HG3 GLU 24 HG3 GLU 24 64.480 6.838 25.149
173 H ILE 25 H ILE 25 64.522 9.985 28.997
174 HA ILE 25 HA ILE 25 63.392 12.711 28.571
175 HB ILE 25 HB ILE 25 65.121 11.692 30.836
176 HG12 ILE 25 HG12 ILE 25 62.828 10.782 30.891
177 HG13 ILE 25 HG13 ILE 25 63.122 11.892 32.226
178 HG21 ILE 25 HG21 ILE 25 65.551 14.025 30.438
179 HG22 ILE 25 HG22 ILE 25 64.580 13.863 31.901
180 HG23 ILE 25 HG23 ILE 25 63.824 14.376 30.392
181 HD11 ILE 25 HD11 ILE 25 61.652 12.574 29.690
182 HD12 ILE 25 HD12 ILE 25 61.897 13.635 31.075
183 HD13 ILE 25 HD13 ILE 25 60.907 12.187 31.239
184 H ILE 26 H ILE 26 64.531 14.116 27.410
185 HA ILE 26 HA ILE 26 67.323 13.377 26.751
186 HB ILE 26 HB ILE 26 65.649 15.559 25.512
187 HG12 ILE 26 HG12 ILE 26 66.139 12.747 24.501
188 HG13 ILE 26 HG13 ILE 26 64.634 13.300 25.231
189 HG21 ILE 26 HG21 ILE 26 68.019 15.885 25.191
190 HG22 ILE 26 HG22 ILE 26 67.299 15.350 23.673
191 HG23 ILE 26 HG23 ILE 26 68.213 14.214 24.664
192 HD11 ILE 26 HD11 ILE 26 65.848 14.162 22.626
193 HD12 ILE 26 HD12 ILE 26 64.503 15.005 23.394
194 HD13 ILE 26 HD13 ILE 26 64.320 13.323 22.896
195 H ARG 27 H ARG 27 69.008 14.320 27.654
196 HA ARG 27 HA ARG 27 68.587 16.402 29.601
197 HB2 ARG 27 HB2 ARG 27 70.980 14.925 28.573
198 HB3 ARG 27 HB3 ARG 27 71.190 16.331 29.605
199 HG2 ARG 27 HG2 ARG 27 71.268 14.400 30.984
200 HG3 ARG 27 HG3 ARG 27 69.739 15.219 31.299
201 HD2 ARG 27 HD2 ARG 27 69.336 12.857 31.165
202 HD3 ARG 27 HD3 ARG 27 68.628 13.629 29.749
203 HE ARG 27 HE ARG 27 71.152 12.875 28.917
204 HH11 ARG 27 HH11 ARG 27 68.365 11.199 30.321
205 HH12 ARG 27 HH12 ARG 27 68.726 9.696 29.542
206 HH21 ARG 27 HH21 ARG 27 71.588 10.878 27.913
207 HH22 ARG 27 HH22 ARG 27 70.557 9.512 28.180
208 H ASN 28 H ASN 28 68.689 18.527 29.452
209 HA ASN 28 HA ASN 28 68.886 20.584 28.519
210 HB2 ASN 28 HB2 ASN 28 71.260 20.045 29.086
211 HB3 ASN 28 HB3 ASN 28 71.499 19.548 27.414
212 HD21 ASN 28 HD21 ASN 28 70.843 22.233 29.576
213 HD22 ASN 28 HD22 ASN 28 71.318 23.520 28.415
214 H VAL 29 H VAL 29 67.047 19.858 27.107
215 HA VAL 29 HA VAL 29 67.775 19.541 24.283
216 HB VAL 29 HB VAL 29 65.090 19.743 25.647
217 HG11 VAL 29 HG11 VAL 29 65.772 19.301 22.746
218 HG12 VAL 29 HG12 VAL 29 64.799 20.597 23.439
219 HG13 VAL 29 HG13 VAL 29 64.195 18.941 23.446
220 HG21 VAL 29 HG21 VAL 29 66.823 17.495 24.733
221 HG22 VAL 29 HG22 VAL 29 65.072 17.300 24.713
222 HG23 VAL 29 HG23 VAL 29 65.899 17.669 26.225
223 H LYS 30 H LYS 30 68.488 21.262 23.242
224 HA LYS 30 HA LYS 30 67.198 23.885 23.790
225 HB2 LYS 30 HB2 LYS 30 69.623 23.840 24.054
226 HB3 LYS 30 HB3 LYS 30 69.813 23.186 22.435
227 HG2 LYS 30 HG2 LYS 30 68.898 25.263 21.502
228 HG3 LYS 30 HG3 LYS 30 68.749 25.916 23.135
229 HD2 LYS 30 HD2 LYS 30 71.147 25.788 23.440
230 HD3 LYS 30 HD3 LYS 30 71.334 25.013 21.866
231 HE2 LYS 30 HE2 LYS 30 70.211 27.780 22.289
232 HE3 LYS 30 HE3 LYS 30 71.888 27.438 21.866
233 HZ1 LYS 30 HZ1 LYS 30 71.078 26.353 19.833
234 HZ2 LYS 30 HZ2 LYS 30 70.645 27.985 19.901
235 HZ3 LYS 30 HZ3 LYS 30 69.492 26.792 20.230
236 H LYS 31 H LYS 31 66.713 25.303 21.983
237 HA LYS 31 HA LYS 31 65.594 23.732 19.752
238 HB2 LYS 31 HB2 LYS 31 65.295 26.633 20.554
239 HB3 LYS 31 HB3 LYS 31 64.547 25.935 19.124
240 HG2 LYS 31 HG2 LYS 31 63.256 24.418 20.496
241 HG3 LYS 31 HG3 LYS 31 64.058 25.017 21.950
242 HD2 LYS 31 HD2 LYS 31 63.094 27.213 21.618
243 HD3 LYS 31 HD3 LYS 31 62.372 26.696 20.093
244 HE2 LYS 31 HE2 LYS 31 60.687 26.682 21.818
245 HE3 LYS 31 HE3 LYS 31 61.038 25.025 21.331
246 HZ1 LYS 31 HZ1 LYS 31 62.157 26.360 23.738
247 HZ2 LYS 31 HZ2 LYS 31 62.396 24.746 23.288
248 HZ3 LYS 31 HZ3 LYS 31 60.857 25.277 23.745
249 H LEU 32 H LEU 32 66.391 23.665 17.738
250 HA LEU 32 HA LEU 32 68.934 25.099 17.295
251 HB2 LEU 32 HB2 LEU 32 67.544 22.932 15.717
252 HB3 LEU 32 HB3 LEU 32 69.089 23.636 15.284
253 HG LEU 32 HG LEU 32 68.581 22.168 17.871
254 HD11 LEU 32 HD11 LEU 32 69.753 20.292 16.882
255 HD12 LEU 32 HD12 LEU 32 69.916 21.167 15.360
256 HD13 LEU 32 HD13 LEU 32 68.320 20.681 15.931
257 HD21 LEU 32 HD21 LEU 32 71.044 22.102 17.968
258 HD22 LEU 32 HD22 LEU 32 70.410 23.746 18.010
259 HD23 LEU 32 HD23 LEU 32 71.110 23.110 16.522
260 H GLN 33 H GLN 33 69.250 25.645 14.796
261 HA GLN 33 HA GLN 33 67.309 27.761 14.298
262 HB2 GLN 33 HB2 GLN 33 69.762 28.047 13.951
263 HB3 GLN 33 HB3 GLN 33 69.676 26.903 12.621
264 HG2 GLN 33 HG2 GLN 33 69.718 29.218 11.845
265 HG3 GLN 33 HG3 GLN 33 68.231 28.397 11.383
266 HE21 GLN 33 HE21 GLN 33 67.064 30.275 11.105
267 HE22 GLN 33 HE22 GLN 33 66.571 31.299 12.499
268 H GLU 34 H GLU 34 67.152 24.537 13.739
269 HA GLU 34 HA GLU 34 65.825 24.861 11.105
270 HB2 GLU 34 HB2 GLU 34 66.616 22.285 12.472
271 HB3 GLU 34 HB3 GLU 34 66.071 22.481 10.815
272 HG2 GLU 34 HG2 GLU 34 68.352 22.213 10.586
273 HG3 GLU 34 HG3 GLU 34 68.156 23.964 10.531
274 H GLU 35 H GLU 35 63.689 24.918 11.046
275 HA GLU 35 HA GLU 35 62.132 24.724 13.423
276 HB2 GLU 35 HB2 GLU 35 61.573 25.947 11.245
277 HB3 GLU 35 HB3 GLU 35 61.052 24.389 10.623
278 HG2 GLU 35 HG2 GLU 35 59.925 25.706 13.084
279 HG3 GLU 35 HG3 GLU 35 59.209 25.802 11.477
280 H GLY 36 H GLY 36 61.603 22.999 14.572
281 HA2 GLY 36 HA2 GLY 36 60.517 20.898 14.796
282 HA3 GLY 36 HA3 GLY 36 60.858 20.534 13.113
283 H TRP 37 H TRP 37 63.570 21.816 14.758
284 HA TRP 37 HA TRP 37 64.510 19.071 15.396
285 HB2 TRP 37 HB2 TRP 37 65.963 21.192 13.818
286 HB3 TRP 37 HB3 TRP 37 66.783 19.815 14.549
287 HD1 TRP 37 HD1 TRP 37 65.583 20.781 11.328
288 HE1 TRP 37 HE1 TRP 37 64.972 18.765 9.814
289 HE3 TRP 37 HE3 TRP 37 65.358 17.175 14.943
290 HZ2 TRP 37 HZ2 TRP 37 64.467 16.005 10.180
291 HZ3 TRP 37 HZ3 TRP 37 64.802 14.873 14.280
292 HH2 TRP 37 HH2 TRP 37 64.364 14.302 11.947
293 H LEU 38 H LEU 38 65.414 18.803 17.281
294 HA LEU 38 HA LEU 38 66.204 21.250 18.800
295 HB2 LEU 38 HB2 LEU 38 64.976 18.708 19.883
296 HB3 LEU 38 HB3 LEU 38 65.497 20.078 20.845
297 HG LEU 38 HG LEU 38 63.264 20.140 18.810
298 HD11 LEU 38 HD11 LEU 38 62.715 18.782 20.773
299 HD12 LEU 38 HD12 LEU 38 61.774 20.272 20.723
300 HD13 LEU 38 HD13 LEU 38 63.145 20.131 21.823
301 HD21 LEU 38 HD21 LEU 38 62.768 22.336 19.802
302 HD22 LEU 38 HD22 LEU 38 64.352 22.296 19.028
303 HD23 LEU 38 HD23 LEU 38 64.227 22.207 20.786
304 H GLU 39 H GLU 39 67.784 20.755 20.589
305 HA GLU 39 HA GLU 39 69.595 18.532 19.756
306 HB2 GLU 39 HB2 GLU 39 70.508 20.667 18.979
307 HB3 GLU 39 HB3 GLU 39 70.400 21.323 20.607
308 HG2 GLU 39 HG2 GLU 39 72.024 19.653 21.372
309 HG3 GLU 39 HG3 GLU 39 72.150 19.037 19.726
310 H GLY 40 H GLY 40 69.964 17.100 21.320
311 HA2 GLY 40 HA2 GLY 40 70.311 18.050 24.074
312 HA3 GLY 40 HA3 GLY 40 68.875 17.076 23.819
313 H GLU 41 H GLU 41 70.779 16.338 25.625
314 HA GLU 41 HA GLU 41 72.422 14.272 24.299
315 HB2 GLU 41 HB2 GLU 41 72.278 14.979 27.237
316 HB3 GLU 41 HB3 GLU 41 73.494 13.984 26.451
317 HG2 GLU 41 HG2 GLU 41 74.634 15.945 26.642
318 HG3 GLU 41 HG3 GLU 41 73.912 16.160 25.050
319 H LEU 42 H LEU 42 71.343 12.502 23.767
320 HA LEU 42 HA LEU 42 69.764 11.208 25.934
321 HB2 LEU 42 HB2 LEU 42 68.246 12.221 24.242
322 HB3 LEU 42 HB3 LEU 42 69.000 11.223 23.015
323 HG LEU 42 HG LEU 42 68.233 9.199 24.242
324 HD11 LEU 42 HD11 LEU 42 68.048 10.162 26.469
325 HD12 LEU 42 HD12 LEU 42 66.517 9.448 25.966
326 HD13 LEU 42 HD13 LEU 42 66.730 11.198 25.925
327 HD21 LEU 42 HD21 LEU 42 65.920 9.355 23.545
328 HD22 LEU 42 HD22 LEU 42 66.962 10.139 22.358
329 HD23 LEU 42 HD23 LEU 42 66.030 11.114 23.493
330 H ASN 43 H ASN 43 70.068 9.083 26.223
331 HA ASN 43 HA ASN 43 71.068 7.039 26.030
332 HB2 ASN 43 HB2 ASN 43 71.384 7.687 23.088
333 HB3 ASN 43 HB3 ASN 43 71.472 6.090 23.820
334 HD21 ASN 43 HD21 ASN 43 69.704 7.254 21.724
335 HD22 ASN 43 HD22 ASN 43 68.038 6.941 22.323
336 H GLY 44 H GLY 44 72.662 9.666 26.330
337 HA2 GLY 44 HA2 GLY 44 74.897 9.910 26.944
338 HA3 GLY 44 HA3 GLY 44 75.262 8.338 26.263
339 H ARG 45 H ARG 45 73.522 10.358 24.134
340 HA ARG 45 HA ARG 45 76.034 11.369 22.935
341 HB2 ARG 45 HB2 ARG 45 73.880 9.823 21.486
342 HB3 ARG 45 HB3 ARG 45 75.152 10.727 20.679
343 HG2 ARG 45 HG2 ARG 45 75.618 8.435 22.575
344 HG3 ARG 45 HG3 ARG 45 75.602 8.308 20.815
345 HD2 ARG 45 HD2 ARG 45 77.461 9.920 20.707
346 HD3 ARG 45 HD3 ARG 45 77.493 9.977 22.469
347 HE ARG 45 HE ARG 45 77.745 7.280 21.462
348 HH11 ARG 45 HH11 ARG 45 79.529 10.275 22.081
349 HH12 ARG 45 HH12 ARG 45 81.055 9.474 22.247
350 HH21 ARG 45 HH21 ARG 45 79.775 6.264 21.688
351 HH22 ARG 45 HH22 ARG 45 81.195 7.198 22.023
352 H ARG 46 H ARG 46 75.869 13.260 21.754
353 HA ARG 46 HA ARG 46 73.390 14.772 22.336
354 HB2 ARG 46 HB2 ARG 46 76.049 15.715 21.221
355 HB3 ARG 46 HB3 ARG 46 74.698 16.751 21.655
356 HG2 ARG 46 HG2 ARG 46 75.031 15.512 23.990
357 HG3 ARG 46 HG3 ARG 46 76.677 15.384 23.371
358 HD2 ARG 46 HD2 ARG 46 76.402 17.406 24.707
359 HD3 ARG 46 HD3 ARG 46 76.744 17.799 23.022
360 HE ARG 46 HE ARG 46 73.906 17.708 23.552
361 HH11 ARG 46 HH11 ARG 46 76.794 19.734 23.874
362 HH12 ARG 46 HH12 ARG 46 75.899 21.215 23.878
363 HH21 ARG 46 HH21 ARG 46 72.770 19.682 23.559
364 HH22 ARG 46 HH22 ARG 46 73.615 21.187 23.697
365 H GLY 47 H GLY 47 71.841 14.838 20.840
366 HA2 GLY 47 HA2 GLY 47 72.698 14.966 18.006
367 HA3 GLY 47 HA3 GLY 47 71.627 13.659 18.478
368 H MET 48 H MET 48 70.487 14.843 16.623
369 HA MET 48 HA MET 48 68.809 16.983 17.822
370 HB2 MET 48 HB2 MET 48 68.354 17.800 15.574
371 HB3 MET 48 HB3 MET 48 70.085 17.766 15.868
372 HG2 MET 48 HG2 MET 48 70.374 15.862 14.499
373 HG3 MET 48 HG3 MET 48 68.638 15.573 14.414
374 HE1 MET 48 HE1 MET 48 70.695 19.195 12.419
375 HE2 MET 48 HE2 MET 48 71.557 18.000 13.389
376 HE3 MET 48 HE3 MET 48 70.397 19.085 14.154
377 H PHE 49 H PHE 49 66.616 16.819 17.781
378 HA PHE 49 HA PHE 49 65.489 14.388 16.504
379 HB2 PHE 49 HB2 PHE 49 64.083 14.196 18.709
380 HB3 PHE 49 HB3 PHE 49 65.706 13.513 18.646
381 HD1 PHE 49 HD2 PHE 49 67.569 14.639 19.757
382 HD2 PHE 49 HD1 PHE 49 63.580 16.071 20.112
383 HE1 PHE 49 HE2 PHE 49 68.239 16.013 21.680
384 HE2 PHE 49 HE1 PHE 49 64.247 17.453 22.037
385 HZ PHE 49 HZ PHE 49 66.578 17.423 22.821
386 HA PRO 50 HA PRO 50 62.093 16.891 15.279
387 HB2 PRO 50 HB2 PRO 50 60.218 14.848 16.307
388 HB3 PRO 50 HB3 PRO 50 60.415 15.468 14.665
389 HG2 PRO 50 HG2 PRO 50 61.250 13.019 15.329
390 HG3 PRO 50 HG3 PRO 50 62.160 14.026 14.188
391 HD2 PRO 50 HD2 PRO 50 62.710 13.456 17.074
392 HD3 PRO 50 HD3 PRO 50 63.844 13.590 15.715
393 H ASP 51 H ASP 51 60.979 18.551 16.101
394 HA ASP 51 HA ASP 51 60.900 18.936 18.941
395 HB2 ASP 51 HB2 ASP 51 61.090 20.792 17.340
396 HB3 ASP 51 HB3 ASP 51 59.469 20.453 16.746
397 H ASN 52 H ASN 52 58.481 17.894 16.558
398 HA ASN 52 HA ASN 52 56.307 17.991 18.485
399 HB2 ASN 52 HB2 ASN 52 56.466 16.707 15.754
400 HB3 ASN 52 HB3 ASN 52 54.993 16.902 16.697
401 HD21 ASN 52 HD21 ASN 52 55.727 17.912 14.033
402 HD22 ASN 52 HD22 ASN 52 55.538 19.697 14.144
403 H PHE 53 H PHE 53 58.880 15.951 18.412
404 HA PHE 53 HA PHE 53 57.263 13.555 19.095
405 HB2 PHE 53 HB2 PHE 53 60.096 13.947 18.192
406 HB3 PHE 53 HB3 PHE 53 59.648 12.491 19.075
407 HD1 PHE 53 HD1 PHE 53 58.246 14.525 16.268
408 HD2 PHE 53 HD2 PHE 53 59.211 10.664 17.774
409 HE1 PHE 53 HE1 PHE 53 57.432 13.512 14.182
410 HE2 PHE 53 HE2 PHE 53 58.398 9.644 15.691
411 HZ PHE 53 HZ PHE 53 57.507 11.068 13.890
412 H VAL 54 H VAL 54 59.309 16.028 20.409
413 HA VAL 54 HA VAL 54 59.200 14.648 23.047
414 HB VAL 54 HB VAL 54 61.223 15.945 23.671
415 HG11 VAL 54 HG11 VAL 54 62.819 14.599 22.367
416 HG12 VAL 54 HG12 VAL 54 61.519 14.153 21.264
417 HG13 VAL 54 HG13 VAL 54 61.456 13.645 22.951
418 HG21 VAL 54 HG21 VAL 54 60.913 17.751 21.989
419 HG22 VAL 54 HG22 VAL 54 61.411 16.616 20.736
420 HG23 VAL 54 HG23 VAL 54 62.540 17.076 22.008
421 H LYS 55 H LYS 55 58.472 15.779 24.796
422 HA LYS 55 HA LYS 55 57.441 18.507 24.172
423 HB2 LYS 55 HB2 LYS 55 55.649 16.888 24.571
424 HB3 LYS 55 HB3 LYS 55 56.370 16.450 26.114
425 HG2 LYS 55 HG2 LYS 55 54.482 17.915 26.457
426 HG3 LYS 55 HG3 LYS 55 55.973 18.726 26.937
427 HD2 LYS 55 HD2 LYS 55 56.000 19.830 24.690
428 HD3 LYS 55 HD3 LYS 55 54.405 19.136 24.393
429 HE2 LYS 55 HE2 LYS 55 55.107 20.987 26.671
430 HE3 LYS 55 HE3 LYS 55 54.294 21.469 25.183
431 HZ1 LYS 55 HZ1 LYS 55 53.259 19.557 27.209
432 HZ2 LYS 55 HZ2 LYS 55 52.487 19.933 25.752
433 HZ3 LYS 55 HZ3 LYS 55 52.694 21.127 26.931
434 H GLU 56 H GLU 56 58.050 20.195 25.398
435 HA GLU 56 HA GLU 56 60.282 20.010 27.080
436 HB2 GLU 56 HB2 GLU 56 59.384 22.097 26.037
437 HB3 GLU 56 HB3 GLU 56 58.108 22.105 27.244
438 HG2 GLU 56 HG2 GLU 56 59.729 22.367 29.014
439 HG3 GLU 56 HG3 GLU 56 61.050 22.248 27.852
440 H ILE 57 H ILE 57 60.653 19.746 29.241
441 HA ILE 57 HA ILE 57 58.372 18.630 30.746
442 HB ILE 57 HB ILE 57 61.299 18.730 31.500
443 HG12 ILE 57 HG12 ILE 57 59.691 16.414 30.398
444 HG13 ILE 57 HG13 ILE 57 60.797 17.394 29.443
445 HG21 ILE 57 HG21 ILE 57 58.988 17.196 32.689
446 HG22 ILE 57 HG22 ILE 57 59.868 18.526 33.443
447 HG23 ILE 57 HG23 ILE 57 60.682 16.992 33.137
448 HD11 ILE 57 HD11 ILE 57 61.525 15.667 31.796
449 HD12 ILE 57 HD12 ILE 57 62.645 16.682 30.887
450 HD13 ILE 57 HD13 ILE 57 61.846 15.324 30.096
451 H LYS 58 H LYS 58 57.214 20.544 31.140
452 HA LYS 58 HA LYS 58 58.504 22.698 32.629
453 HB2 LYS 58 HB2 LYS 58 56.544 22.886 30.955
454 HB3 LYS 58 HB3 LYS 58 55.531 22.360 32.291
455 HG2 LYS 58 HG2 LYS 58 57.338 24.763 32.408
456 HG3 LYS 58 HG3 LYS 58 55.636 24.830 31.950
457 HD2 LYS 58 HD2 LYS 58 55.008 23.917 34.128
458 HD3 LYS 58 HD3 LYS 58 56.710 23.817 34.584
459 HE2 LYS 58 HE2 LYS 58 55.268 26.367 33.870
460 HE3 LYS 58 HE3 LYS 58 55.550 25.801 35.515
461 HZ1 LYS 58 HZ1 LYS 58 57.616 26.549 33.517
462 HZ2 LYS 58 HZ2 LYS 58 57.956 25.864 35.025
463 HZ3 LYS 58 HZ3 LYS 58 57.224 27.386 34.935
Start of MODEL 10
1 H1 VAL 2 H1 VAL 2 66.748 24.571 29.333
2 H2 VAL 2 H2 VAL 2 66.709 23.639 27.921
3 H3 VAL 2 H3 VAL 2 67.614 23.119 29.251
4 HA VAL 2 HA VAL 2 65.652 22.790 30.554
5 HB VAL 2 HB VAL 2 64.324 24.618 29.544
6 HG11 VAL 2 HG11 VAL 2 63.109 24.265 27.467
7 HG12 VAL 2 HG12 VAL 2 63.897 22.702 27.257
8 HG13 VAL 2 HG13 VAL 2 64.849 24.184 27.194
9 HG21 VAL 2 HG21 VAL 2 63.271 22.834 30.909
10 HG22 VAL 2 HG22 VAL 2 62.887 21.969 29.421
11 HG23 VAL 2 HG23 VAL 2 62.174 23.553 29.730
12 H ASP 3 H ASP 3 64.650 20.772 30.632
13 HA ASP 3 HA ASP 3 65.663 18.939 28.553
14 HB2 ASP 3 HB2 ASP 3 64.951 17.156 30.152
15 HB3 ASP 3 HB3 ASP 3 66.129 18.281 30.816
16 H TYR 4 H TYR 4 64.347 17.185 27.743
17 HA TYR 4 HA TYR 4 61.462 17.911 27.513
18 HB2 TYR 4 HB2 TYR 4 63.444 17.469 25.320
19 HB3 TYR 4 HB3 TYR 4 61.782 16.963 25.075
20 HD1 TYR 4 HD2 TYR 4 63.504 19.990 26.476
21 HD2 TYR 4 HD1 TYR 4 60.521 18.445 23.869
22 HE1 TYR 4 HE2 TYR 4 62.903 22.279 25.814
23 HE2 TYR 4 HE1 TYR 4 59.914 20.728 23.198
24 HH TYR 4 HH TYR 4 61.819 23.402 23.820
25 H ILE 5 H ILE 5 60.031 16.196 27.018
26 HA ILE 5 HA ILE 5 61.200 13.527 27.654
27 HB ILE 5 HB ILE 5 59.597 14.309 29.355
28 HG12 ILE 5 HG12 ILE 5 58.477 12.038 27.699
29 HG13 ILE 5 HG13 ILE 5 59.832 11.892 28.812
30 HG21 ILE 5 HG21 ILE 5 57.177 14.437 28.741
31 HG22 ILE 5 HG22 ILE 5 57.668 14.429 27.047
32 HG23 ILE 5 HG23 ILE 5 58.169 15.746 28.104
33 HD11 ILE 5 HD11 ILE 5 58.349 12.542 30.661
34 HD12 ILE 5 HD12 ILE 5 57.817 11.073 29.842
35 HD13 ILE 5 HD13 ILE 5 56.998 12.603 29.529
36 H VAL 6 H VAL 6 60.786 11.801 26.340
37 HA VAL 6 HA VAL 6 59.881 12.522 23.651
38 HB VAL 6 HB VAL 6 60.697 9.798 24.672
39 HG11 VAL 6 HG11 VAL 6 60.540 10.958 21.894
40 HG12 VAL 6 HG12 VAL 6 59.503 9.705 22.575
41 HG13 VAL 6 HG13 VAL 6 61.212 9.378 22.293
42 HG21 VAL 6 HG21 VAL 6 62.500 11.364 25.090
43 HG22 VAL 6 HG22 VAL 6 62.400 11.959 23.433
44 HG23 VAL 6 HG23 VAL 6 62.923 10.304 23.746
45 H GLU 7 H GLU 7 57.873 12.407 22.959
46 HA GLU 7 HA GLU 7 55.993 10.667 24.471
47 HB2 GLU 7 HB2 GLU 7 55.372 12.951 22.588
48 HB3 GLU 7 HB3 GLU 7 54.208 12.058 23.556
49 HG2 GLU 7 HG2 GLU 7 56.406 13.837 24.591
50 HG3 GLU 7 HG3 GLU 7 54.682 14.199 24.564
51 H TYR 8 H TYR 8 57.606 11.046 21.444
52 HA TYR 8 HA TYR 8 56.007 8.779 20.376
53 HB2 TYR 8 HB2 TYR 8 56.906 11.222 18.830
54 HB3 TYR 8 HB3 TYR 8 56.203 9.780 18.107
55 HD1 TYR 8 HD1 TYR 8 55.534 12.773 20.113
56 HD2 TYR 8 HD2 TYR 8 53.832 9.308 18.325
57 HE1 TYR 8 HE1 TYR 8 53.287 13.712 20.450
58 HE2 TYR 8 HE2 TYR 8 51.580 10.238 18.654
59 HH TYR 8 HH TYR 8 50.991 13.435 19.389
60 H ASP 9 H ASP 9 57.133 7.205 19.306
61 HA ASP 9 HA ASP 9 59.999 7.188 19.815
62 HB2 ASP 9 HB2 ASP 9 58.574 5.158 20.035
63 HB3 ASP 9 HB3 ASP 9 58.325 5.179 18.293
64 H TYR 10 H TYR 10 61.627 7.655 18.489
65 HA TYR 10 HA TYR 10 61.009 7.929 15.591
66 HB2 TYR 10 HB2 TYR 10 61.106 10.168 16.726
67 HB3 TYR 10 HB3 TYR 10 62.776 9.819 17.158
68 HD1 TYR 10 HD1 TYR 10 64.521 9.762 15.442
69 HD2 TYR 10 HD2 TYR 10 60.499 10.732 14.454
70 HE1 TYR 10 HE1 TYR 10 65.270 10.646 13.276
71 HE2 TYR 10 HE2 TYR 10 61.239 11.621 12.286
72 HH TYR 10 HH TYR 10 63.371 12.569 11.310
73 H ASP 11 H ASP 11 62.486 7.116 14.207
74 HA ASP 11 HA ASP 11 64.810 5.768 15.475
75 HB2 ASP 11 HB2 ASP 11 63.460 5.330 12.802
76 HB3 ASP 11 HB3 ASP 11 64.893 4.462 13.345
77 H ALA 12 H ALA 12 66.753 6.624 15.313
78 HA ALA 12 HA ALA 12 67.256 8.967 13.772
79 HB1 ALA 12 HB1 ALA 12 69.237 7.056 14.997
80 HB2 ALA 12 HB2 ALA 12 68.492 8.436 15.803
81 HB3 ALA 12 HB3 ALA 12 69.582 8.694 14.442
82 H VAL 13 H VAL 13 67.230 9.061 11.657
83 HA VAL 13 HA VAL 13 68.217 6.784 10.071
84 HB VAL 13 HB VAL 13 67.072 9.429 9.142
85 HG11 VAL 13 HG11 VAL 13 66.732 8.251 7.000
86 HG12 VAL 13 HG12 VAL 13 67.603 6.861 7.649
87 HG13 VAL 13 HG13 VAL 13 68.434 8.401 7.430
88 HG21 VAL 13 HG21 VAL 13 65.020 8.104 8.679
89 HG22 VAL 13 HG22 VAL 13 65.399 8.241 10.395
90 HG23 VAL 13 HG23 VAL 13 65.752 6.745 9.530
91 H HIS 14 H HIS 14 69.019 10.122 10.888
92 HA HIS 14 HA HIS 14 71.426 10.044 9.182
93 HB2 HIS 14 HB2 HIS 14 70.461 12.247 11.019
94 HB3 HIS 14 HB3 HIS 14 71.684 12.383 9.761
95 HD1 HIS 14 HD1 HIS 14 68.067 12.649 10.392
96 HD2 HIS 14 HD2 HIS 14 70.597 12.188 7.078
97 HE1 HIS 14 HE1 HIS 14 66.678 13.212 8.346
98 HE2 HIS 14 HE2 HIS 14 68.194 12.885 6.332
99 H ASP 15 H ASP 15 73.437 11.130 10.288
100 HA ASP 15 HA ASP 15 74.174 9.325 12.449
101 HB2 ASP 15 HB2 ASP 15 76.396 10.360 12.267
102 HB3 ASP 15 HB3 ASP 15 75.785 9.901 10.681
103 H ASP 16 H ASP 16 73.421 12.752 12.070
104 HA ASP 16 HA ASP 16 73.954 13.235 14.935
105 HB2 ASP 16 HB2 ASP 16 73.325 15.612 14.315
106 HB3 ASP 16 HB3 ASP 16 74.751 14.972 13.505
107 H GLU 17 H GLU 17 71.599 11.643 13.581
108 HA GLU 17 HA GLU 17 69.315 13.170 14.647
109 HB2 GLU 17 HB2 GLU 17 69.164 12.036 12.440
110 HB3 GLU 17 HB3 GLU 17 69.415 10.492 13.238
111 HG2 GLU 17 HG2 GLU 17 67.089 10.760 12.778
112 HG3 GLU 17 HG3 GLU 17 67.337 10.858 14.519
113 H LEU 18 H LEU 18 68.385 12.779 16.579
114 HA LEU 18 HA LEU 18 69.596 10.666 18.222
115 HB2 LEU 18 HB2 LEU 18 69.065 13.112 18.909
116 HB3 LEU 18 HB3 LEU 18 67.424 12.534 19.111
117 HG LEU 18 HG LEU 18 68.485 12.530 21.253
118 HD11 LEU 18 HD11 LEU 18 67.030 10.579 20.622
119 HD12 LEU 18 HD12 LEU 18 68.152 10.294 21.948
120 HD13 LEU 18 HD13 LEU 18 68.512 9.665 20.345
121 HD21 LEU 18 HD21 LEU 18 70.522 11.222 21.699
122 HD22 LEU 18 HD22 LEU 18 70.801 12.541 20.564
123 HD23 LEU 18 HD23 LEU 18 70.663 10.885 19.974
124 H THR 19 H THR 19 68.763 8.732 18.571
125 HA THR 19 HA THR 19 66.098 8.115 17.519
126 HB THR 19 HB THR 19 67.973 6.314 19.081
127 HG1 THR 19 HG1 THR 19 69.048 6.052 17.278
128 HG21 THR 19 HG21 THR 19 65.608 5.574 18.965
129 HG22 THR 19 HG22 THR 19 66.710 4.487 18.120
130 HG23 THR 19 HG23 THR 19 65.711 5.617 17.205
131 H ILE 20 H ILE 20 64.732 9.411 18.848
132 HA ILE 20 HA ILE 20 64.848 8.967 21.744
133 HB ILE 20 HB ILE 20 62.999 10.609 21.831
134 HG12 ILE 20 HG12 ILE 20 63.367 10.728 18.827
135 HG13 ILE 20 HG13 ILE 20 61.955 10.091 19.664
136 HG21 ILE 20 HG21 ILE 20 65.338 11.333 21.933
137 HG22 ILE 20 HG22 ILE 20 64.314 12.544 21.162
138 HG23 ILE 20 HG23 ILE 20 65.354 11.513 20.180
139 HD11 ILE 20 HD11 ILE 20 61.391 12.258 20.489
140 HD12 ILE 20 HD12 ILE 20 61.662 12.371 18.750
141 HD13 ILE 20 HD13 ILE 20 62.897 12.936 19.873
142 H ARG 21 H ARG 21 63.490 7.769 22.945
143 HA ARG 21 HA ARG 21 61.257 6.424 21.484
144 HB2 ARG 21 HB2 ARG 21 62.777 5.292 23.838
145 HB3 ARG 21 HB3 ARG 21 61.602 4.463 22.827
146 HG2 ARG 21 HG2 ARG 21 63.177 4.748 20.905
147 HG3 ARG 21 HG3 ARG 21 64.368 5.359 22.054
148 HD2 ARG 21 HD2 ARG 21 64.831 3.051 21.741
149 HD3 ARG 21 HD3 ARG 21 64.089 3.217 23.331
150 HE ARG 21 HE ARG 21 62.220 2.041 22.608
151 HH11 ARG 21 HH11 ARG 21 64.339 2.791 19.868
152 HH12 ARG 21 HH12 ARG 21 63.518 1.716 18.787
153 HH21 ARG 21 HH21 ARG 21 61.171 0.641 21.148
154 HH22 ARG 21 HH22 ARG 21 61.721 0.498 19.512
155 H VAL 22 H VAL 22 59.245 6.393 22.404
156 HA VAL 22 HA VAL 22 58.437 8.408 24.082
157 HB VAL 22 HB VAL 22 57.172 5.663 24.035
158 HG11 VAL 22 HG11 VAL 22 55.995 8.384 24.594
159 HG12 VAL 22 HG12 VAL 22 56.290 7.116 25.783
160 HG13 VAL 22 HG13 VAL 22 55.096 6.869 24.509
161 HG21 VAL 22 HG21 VAL 22 57.417 6.327 21.768
162 HG22 VAL 22 HG22 VAL 22 56.926 7.981 22.131
163 HG23 VAL 22 HG23 VAL 22 55.747 6.673 22.217
164 H GLY 23 H GLY 23 58.741 8.983 26.112
165 HA2 GLY 23 HA2 GLY 23 58.514 8.407 28.462
166 HA3 GLY 23 HA3 GLY 23 59.158 6.813 28.116
167 H GLU 24 H GLU 24 61.241 8.301 26.302
168 HA GLU 24 HA GLU 24 63.235 8.429 28.392
169 HB2 GLU 24 HB2 GLU 24 63.306 8.974 25.430
170 HB3 GLU 24 HB3 GLU 24 64.716 9.174 26.457
171 HG2 GLU 24 HG2 GLU 24 64.359 6.753 27.150
172 HG3 GLU 24 HG3 GLU 24 63.236 6.653 25.794
173 H ILE 25 H ILE 25 64.639 10.160 28.872
174 HA ILE 25 HA ILE 25 63.361 12.829 28.487
175 HB ILE 25 HB ILE 25 65.098 11.901 30.784
176 HG12 ILE 25 HG12 ILE 25 62.151 12.599 30.722
177 HG13 ILE 25 HG13 ILE 25 62.797 10.963 30.793
178 HG21 ILE 25 HG21 ILE 25 64.527 14.083 31.792
179 HG22 ILE 25 HG22 ILE 25 63.738 14.548 30.285
180 HG23 ILE 25 HG23 ILE 25 65.475 14.242 30.313
181 HD11 ILE 25 HD11 ILE 25 62.073 11.686 32.978
182 HD12 ILE 25 HD12 ILE 25 63.124 13.099 32.887
183 HD13 ILE 25 HD13 ILE 25 63.825 11.482 32.957
184 H ILE 26 H ILE 26 64.476 14.310 27.395
185 HA ILE 26 HA ILE 26 67.222 13.583 26.569
186 HB ILE 26 HB ILE 26 65.799 16.039 25.627
187 HG12 ILE 26 HG12 ILE 26 64.153 14.250 25.353
188 HG13 ILE 26 HG13 ILE 26 64.788 14.749 23.790
189 HG21 ILE 26 HG21 ILE 26 67.607 14.170 24.124
190 HG22 ILE 26 HG22 ILE 26 68.212 15.501 25.110
191 HG23 ILE 26 HG23 ILE 26 67.174 15.831 23.726
192 HD11 ILE 26 HD11 ILE 26 66.266 12.796 23.786
193 HD12 ILE 26 HD12 ILE 26 64.562 12.353 23.888
194 HD13 ILE 26 HD13 ILE 26 65.577 12.291 25.329
195 H ARG 27 H ARG 27 68.946 14.335 27.606
196 HA ARG 27 HA ARG 27 68.661 16.408 29.588
197 HB2 ARG 27 HB2 ARG 27 70.967 14.803 28.543
198 HB3 ARG 27 HB3 ARG 27 71.247 16.161 29.623
199 HG2 ARG 27 HG2 ARG 27 71.177 14.254 30.992
200 HG3 ARG 27 HG3 ARG 27 69.627 15.063 31.221
201 HD2 ARG 27 HD2 ARG 27 69.167 12.746 31.012
202 HD3 ARG 27 HD3 ARG 27 68.673 13.498 29.497
203 HE ARG 27 HE ARG 27 71.305 12.666 29.100
204 HH11 ARG 27 HH11 ARG 27 68.199 11.155 29.886
205 HH12 ARG 27 HH12 ARG 27 68.617 9.641 29.157
206 HH21 ARG 27 HH21 ARG 27 71.810 10.657 28.154
207 HH22 ARG 27 HH22 ARG 27 70.669 9.355 28.183
208 H ASN 28 H ASN 28 68.740 18.524 29.377
209 HA ASN 28 HA ASN 28 69.134 20.582 28.518
210 HB2 ASN 28 HB2 ASN 28 71.660 19.293 27.475
211 HB3 ASN 28 HB3 ASN 28 71.370 21.028 27.547
212 HD21 ASN 28 HD21 ASN 28 72.046 18.119 29.343
213 HD22 ASN 28 HD22 ASN 28 72.438 18.939 30.894
214 H VAL 29 H VAL 29 67.216 19.991 27.121
215 HA VAL 29 HA VAL 29 67.863 19.669 24.285
216 HB VAL 29 HB VAL 29 65.198 20.185 25.607
217 HG11 VAL 29 HG11 VAL 29 64.253 19.322 23.497
218 HG12 VAL 29 HG12 VAL 29 65.876 19.282 22.810
219 HG13 VAL 29 HG13 VAL 29 65.152 20.823 23.271
220 HG21 VAL 29 HG21 VAL 29 65.017 17.657 24.879
221 HG22 VAL 29 HG22 VAL 29 65.718 18.123 26.427
222 HG23 VAL 29 HG23 VAL 29 66.768 17.725 25.066
223 H LYS 30 H LYS 30 68.687 21.332 23.220
224 HA LYS 30 HA LYS 30 67.590 24.039 23.784
225 HB2 LYS 30 HB2 LYS 30 70.063 23.383 22.182
226 HB3 LYS 30 HB3 LYS 30 69.600 24.938 22.857
227 HG2 LYS 30 HG2 LYS 30 70.411 22.504 24.435
228 HG3 LYS 30 HG3 LYS 30 71.416 23.917 24.115
229 HD2 LYS 30 HD2 LYS 30 69.903 25.325 25.372
230 HD3 LYS 30 HD3 LYS 30 68.794 23.973 25.608
231 HE2 LYS 30 HE2 LYS 30 70.474 22.794 26.909
232 HE3 LYS 30 HE3 LYS 30 71.631 24.092 26.626
233 HZ1 LYS 30 HZ1 LYS 30 69.061 24.386 28.087
234 HZ2 LYS 30 HZ2 LYS 30 70.222 25.596 27.860
235 HZ3 LYS 30 HZ3 LYS 30 70.584 24.245 28.812
236 H LYS 31 H LYS 31 67.143 25.478 21.994
237 HA LYS 31 HA LYS 31 65.816 24.009 19.837
238 HB2 LYS 31 HB2 LYS 31 66.012 26.966 20.450
239 HB3 LYS 31 HB3 LYS 31 65.087 26.296 19.113
240 HG2 LYS 31 HG2 LYS 31 63.694 25.058 20.698
241 HG3 LYS 31 HG3 LYS 31 64.619 25.740 22.037
242 HD2 LYS 31 HD2 LYS 31 63.923 27.992 21.362
243 HD3 LYS 31 HD3 LYS 31 62.994 27.304 20.029
244 HE2 LYS 31 HE2 LYS 31 62.526 26.718 22.951
245 HE3 LYS 31 HE3 LYS 31 61.604 27.876 21.993
246 HZ1 LYS 31 HZ1 LYS 31 60.420 25.810 22.119
247 HZ2 LYS 31 HZ2 LYS 31 61.755 24.942 21.550
248 HZ3 LYS 31 HZ3 LYS 31 60.954 26.027 20.527
249 H LEU 32 H LEU 32 66.545 23.650 17.855
250 HA LEU 32 HA LEU 32 69.240 24.643 17.204
251 HB2 LEU 32 HB2 LEU 32 68.373 22.229 16.933
252 HB3 LEU 32 HB3 LEU 32 67.526 22.829 15.522
253 HG LEU 32 HG LEU 32 69.649 23.439 14.477
254 HD11 LEU 32 HD11 LEU 32 71.773 22.750 15.515
255 HD12 LEU 32 HD12 LEU 32 70.896 22.315 16.982
256 HD13 LEU 32 HD13 LEU 32 70.942 23.994 16.448
257 HD21 LEU 32 HD21 LEU 32 70.529 21.174 14.140
258 HD22 LEU 32 HD22 LEU 32 68.766 21.216 14.080
259 HD23 LEU 32 HD23 LEU 32 69.585 20.612 15.520
260 H GLN 33 H GLN 33 69.593 25.215 14.780
261 HA GLN 33 HA GLN 33 67.831 27.474 14.252
262 HB2 GLN 33 HB2 GLN 33 69.372 27.935 12.374
263 HB3 GLN 33 HB3 GLN 33 70.213 27.749 13.905
264 HG2 GLN 33 HG2 GLN 33 70.750 25.410 13.255
265 HG3 GLN 33 HG3 GLN 33 70.037 25.737 11.680
266 HE21 GLN 33 HE21 GLN 33 72.705 26.344 13.840
267 HE22 GLN 33 HE22 GLN 33 73.775 27.107 12.613
268 H GLU 34 H GLU 34 67.454 24.261 13.710
269 HA GLU 34 HA GLU 34 66.144 24.640 11.075
270 HB2 GLU 34 HB2 GLU 34 67.277 22.274 12.515
271 HB3 GLU 34 HB3 GLU 34 65.964 22.022 11.378
272 HG2 GLU 34 HG2 GLU 34 68.148 21.658 10.357
273 HG3 GLU 34 HG3 GLU 34 67.270 22.980 9.591
274 H GLU 35 H GLU 35 64.059 25.063 11.116
275 HA GLU 35 HA GLU 35 62.479 24.990 13.447
276 HB2 GLU 35 HB2 GLU 35 60.591 25.442 12.048
277 HB3 GLU 35 HB3 GLU 35 61.972 26.284 11.365
278 HG2 GLU 35 HG2 GLU 35 60.884 23.659 10.365
279 HG3 GLU 35 HG3 GLU 35 60.527 25.236 9.670
280 H GLY 36 H GLY 36 61.629 23.413 14.614
281 HA2 GLY 36 HA2 GLY 36 60.357 21.452 14.899
282 HA3 GLY 36 HA3 GLY 36 60.646 21.006 13.227
283 H TRP 37 H TRP 37 63.459 22.006 14.911
284 HA TRP 37 HA TRP 37 64.082 19.193 15.614
285 HB2 TRP 37 HB2 TRP 37 65.866 21.049 14.026
286 HB3 TRP 37 HB3 TRP 37 66.342 19.469 14.644
287 HD1 TRP 37 HD1 TRP 37 64.605 21.110 11.751
288 HE1 TRP 37 HE1 TRP 37 63.789 19.331 10.050
289 HE3 TRP 37 HE3 TRP 37 65.371 16.943 14.609
290 HZ2 TRP 37 HZ2 TRP 37 63.523 16.516 9.998
291 HZ3 TRP 37 HZ3 TRP 37 64.805 14.746 13.661
292 HH2 TRP 37 HH2 TRP 37 63.900 14.537 11.405
293 H LEU 38 H LEU 38 65.081 18.885 17.458
294 HA LEU 38 HA LEU 38 66.041 21.311 18.910
295 HB2 LEU 38 HB2 LEU 38 64.574 18.880 19.926
296 HB3 LEU 38 HB3 LEU 38 65.454 19.956 20.993
297 HG LEU 38 HG LEU 38 63.124 20.514 21.086
298 HD11 LEU 38 HD11 LEU 38 64.577 22.568 19.427
299 HD12 LEU 38 HD12 LEU 38 64.705 22.377 21.176
300 HD13 LEU 38 HD13 LEU 38 63.171 22.856 20.452
301 HD21 LEU 38 HD21 LEU 38 62.542 19.536 18.866
302 HD22 LEU 38 HD22 LEU 38 63.185 20.996 18.114
303 HD23 LEU 38 HD23 LEU 38 61.795 21.100 19.191
304 H GLU 39 H GLU 39 67.693 20.802 20.611
305 HA GLU 39 HA GLU 39 69.404 18.527 19.709
306 HB2 GLU 39 HB2 GLU 39 70.195 20.851 19.022
307 HB3 GLU 39 HB3 GLU 39 70.459 21.164 20.731
308 HG2 GLU 39 HG2 GLU 39 72.530 20.534 19.706
309 HG3 GLU 39 HG3 GLU 39 72.018 19.261 20.811
310 H GLY 40 H GLY 40 69.739 17.055 21.250
311 HA2 GLY 40 HA2 GLY 40 70.142 17.983 24.015
312 HA3 GLY 40 HA3 GLY 40 68.713 17.001 23.757
313 H GLU 41 H GLU 41 70.731 16.321 25.526
314 HA GLU 41 HA GLU 41 72.303 14.233 24.156
315 HB2 GLU 41 HB2 GLU 41 73.365 15.786 25.808
316 HB3 GLU 41 HB3 GLU 41 72.352 15.081 27.058
317 HG2 GLU 41 HG2 GLU 41 74.204 13.403 25.402
318 HG3 GLU 41 HG3 GLU 41 74.756 14.253 26.845
319 H LEU 42 H LEU 42 71.217 12.446 23.753
320 HA LEU 42 HA LEU 42 69.846 11.162 26.057
321 HB2 LEU 42 HB2 LEU 42 68.157 12.140 24.517
322 HB3 LEU 42 HB3 LEU 42 68.802 11.142 23.228
323 HG LEU 42 HG LEU 42 68.238 9.126 24.654
324 HD11 LEU 42 HD11 LEU 42 66.573 9.428 26.404
325 HD12 LEU 42 HD12 LEU 42 66.676 11.177 26.208
326 HD13 LEU 42 HD13 LEU 42 68.071 10.272 26.793
327 HD21 LEU 42 HD21 LEU 42 66.226 10.954 23.429
328 HD22 LEU 42 HD22 LEU 42 65.687 9.486 24.241
329 HD23 LEU 42 HD23 LEU 42 66.800 9.382 22.877
330 H ASN 43 H ASN 43 70.071 8.990 26.244
331 HA ASN 43 HA ASN 43 71.037 6.944 25.951
332 HB2 ASN 43 HB2 ASN 43 71.286 7.721 23.034
333 HB3 ASN 43 HB3 ASN 43 71.491 6.099 23.682
334 HD21 ASN 43 HD21 ASN 43 69.305 8.488 22.572
335 HD22 ASN 43 HD22 ASN 43 67.797 7.548 22.844
336 H GLY 44 H GLY 44 72.653 9.580 26.283
337 HA2 GLY 44 HA2 GLY 44 74.894 9.763 26.916
338 HA3 GLY 44 HA3 GLY 44 75.244 8.221 26.163
339 H ARG 45 H ARG 45 73.506 10.407 24.183
340 HA ARG 45 HA ARG 45 75.972 11.547 23.055
341 HB2 ARG 45 HB2 ARG 45 75.571 9.362 21.890
342 HB3 ARG 45 HB3 ARG 45 74.023 9.991 21.343
343 HG2 ARG 45 HG2 ARG 45 75.684 10.170 19.592
344 HG3 ARG 45 HG3 ARG 45 75.180 11.774 20.127
345 HD2 ARG 45 HD2 ARG 45 77.202 11.825 21.602
346 HD3 ARG 45 HD3 ARG 45 77.722 10.320 20.846
347 HE ARG 45 HE ARG 45 77.267 12.042 18.726
348 HH11 ARG 45 HH11 ARG 45 79.300 12.082 21.626
349 HH12 ARG 45 HH12 ARG 45 80.529 13.059 20.897
350 HH21 ARG 45 HH21 ARG 45 78.911 13.328 17.807
351 HH22 ARG 45 HH22 ARG 45 80.309 13.767 18.730
352 H ARG 46 H ARG 46 75.623 13.340 21.659
353 HA ARG 46 HA ARG 46 73.037 14.651 22.280
354 HB2 ARG 46 HB2 ARG 46 75.257 15.797 22.759
355 HB3 ARG 46 HB3 ARG 46 75.479 15.912 21.019
356 HG2 ARG 46 HG2 ARG 46 73.328 17.170 20.903
357 HG3 ARG 46 HG3 ARG 46 73.301 17.176 22.666
358 HD2 ARG 46 HD2 ARG 46 74.216 19.256 21.944
359 HD3 ARG 46 HD3 ARG 46 75.530 18.297 22.621
360 HE ARG 46 HE ARG 46 75.634 17.718 19.936
361 HH11 ARG 46 HH11 ARG 46 75.662 20.713 21.824
362 HH12 ARG 46 HH12 ARG 46 76.616 21.577 20.665
363 HH21 ARG 46 HH21 ARG 46 76.888 18.892 18.436
364 HH22 ARG 46 HH22 ARG 46 77.313 20.543 18.742
365 H GLY 47 H GLY 47 71.475 14.646 20.809
366 HA2 GLY 47 HA2 GLY 47 72.253 14.753 17.956
367 HA3 GLY 47 HA3 GLY 47 71.308 13.371 18.475
368 H MET 48 H MET 48 70.697 15.478 16.529
369 HA MET 48 HA MET 48 68.662 17.104 17.801
370 HB2 MET 48 HB2 MET 48 68.162 17.927 15.573
371 HB3 MET 48 HB3 MET 48 69.900 17.909 15.825
372 HG2 MET 48 HG2 MET 48 70.110 15.904 14.500
373 HG3 MET 48 HG3 MET 48 68.360 15.801 14.325
374 HE1 MET 48 HE1 MET 48 70.962 19.127 12.462
375 HE2 MET 48 HE2 MET 48 71.614 17.769 13.378
376 HE3 MET 48 HE3 MET 48 70.655 19.002 14.194
377 H PHE 49 H PHE 49 66.439 16.970 17.614
378 HA PHE 49 HA PHE 49 65.358 14.509 16.381
379 HB2 PHE 49 HB2 PHE 49 63.924 14.293 18.576
380 HB3 PHE 49 HB3 PHE 49 65.536 13.587 18.497
381 HD1 PHE 49 HD1 PHE 49 63.533 16.361 19.842
382 HD2 PHE 49 HD2 PHE 49 67.325 14.435 19.819
383 HE1 PHE 49 HE1 PHE 49 64.214 17.680 21.805
384 HE2 PHE 49 HE2 PHE 49 68.009 15.746 21.781
385 HZ PHE 49 HZ PHE 49 66.452 17.372 22.776
386 HA PRO 50 HA PRO 50 61.980 17.016 15.137
387 HB2 PRO 50 HB2 PRO 50 60.087 14.926 16.022
388 HB3 PRO 50 HB3 PRO 50 60.355 15.588 14.409
389 HG2 PRO 50 HG2 PRO 50 61.180 13.127 15.055
390 HG3 PRO 50 HG3 PRO 50 62.126 14.166 13.974
391 HD2 PRO 50 HD2 PRO 50 62.562 13.543 16.869
392 HD3 PRO 50 HD3 PRO 50 63.750 13.706 15.558
393 H ASP 51 H ASP 51 60.547 18.491 15.862
394 HA ASP 51 HA ASP 51 60.471 18.994 18.688
395 HB2 ASP 51 HB2 ASP 51 59.145 20.929 18.137
396 HB3 ASP 51 HB3 ASP 51 60.401 20.750 16.917
397 H ASN 52 H ASN 52 58.124 17.597 16.410
398 HA ASN 52 HA ASN 52 55.991 17.561 18.386
399 HB2 ASN 52 HB2 ASN 52 56.203 16.146 15.723
400 HB3 ASN 52 HB3 ASN 52 54.739 16.295 16.689
401 HD21 ASN 52 HD21 ASN 52 56.907 17.816 14.474
402 HD22 ASN 52 HD22 ASN 52 55.962 19.332 14.270
403 H PHE 53 H PHE 53 58.745 15.813 18.416
404 HA PHE 53 HA PHE 53 57.362 13.306 19.225
405 HB2 PHE 53 HB2 PHE 53 60.129 13.860 18.190
406 HB3 PHE 53 HB3 PHE 53 59.774 12.383 19.081
407 HD1 PHE 53 HD1 PHE 53 58.289 14.369 16.282
408 HD2 PHE 53 HD2 PHE 53 59.282 10.531 17.831
409 HE1 PHE 53 HE1 PHE 53 57.454 13.324 14.219
410 HE2 PHE 53 HE2 PHE 53 58.449 9.481 15.769
411 HZ PHE 53 HZ PHE 53 57.535 10.876 13.960
412 H VAL 54 H VAL 54 59.310 15.966 20.337
413 HA VAL 54 HA VAL 54 59.407 14.681 23.022
414 HB VAL 54 HB VAL 54 61.377 16.095 23.515
415 HG11 VAL 54 HG11 VAL 54 61.729 14.311 21.110
416 HG12 VAL 54 HG12 VAL 54 61.675 13.781 22.790
417 HG13 VAL 54 HG13 VAL 54 62.999 14.803 22.230
418 HG21 VAL 54 HG21 VAL 54 60.877 17.844 21.812
419 HG22 VAL 54 HG22 VAL 54 61.408 16.717 20.564
420 HG23 VAL 54 HG23 VAL 54 62.545 17.280 21.786
421 H LYS 55 H LYS 55 58.695 15.852 24.765
422 HA LYS 55 HA LYS 55 57.640 18.566 24.118
423 HB2 LYS 55 HB2 LYS 55 56.389 16.487 25.924
424 HB3 LYS 55 HB3 LYS 55 55.790 18.124 25.694
425 HG2 LYS 55 HG2 LYS 55 55.528 17.582 23.259
426 HG3 LYS 55 HG3 LYS 55 55.895 15.906 23.667
427 HD2 LYS 55 HD2 LYS 55 53.986 15.932 25.256
428 HD3 LYS 55 HD3 LYS 55 53.589 17.557 24.696
429 HE2 LYS 55 HE2 LYS 55 53.684 15.079 22.976
430 HE3 LYS 55 HE3 LYS 55 52.220 15.839 23.595
431 HZ1 LYS 55 HZ1 LYS 55 52.788 17.839 22.337
432 HZ2 LYS 55 HZ2 LYS 55 52.627 16.498 21.321
433 HZ3 LYS 55 HZ3 LYS 55 54.166 17.074 21.718
434 H GLU 56 H GLU 56 58.203 20.196 25.436
435 HA GLU 56 HA GLU 56 60.328 19.892 27.242
436 HB2 GLU 56 HB2 GLU 56 59.512 22.031 26.185
437 HB3 GLU 56 HB3 GLU 56 58.232 22.063 27.390
438 HG2 GLU 56 HG2 GLU 56 59.909 22.154 29.166
439 HG3 GLU 56 HG3 GLU 56 61.188 22.137 27.953
440 H ILE 57 H ILE 57 60.552 19.344 29.341
441 HA ILE 57 HA ILE 57 58.115 18.413 30.700
442 HB ILE 57 HB ILE 57 60.990 18.225 31.609
443 HG12 ILE 57 HG12 ILE 57 59.230 16.206 30.196
444 HG13 ILE 57 HG13 ILE 57 60.641 17.007 29.514
445 HG21 ILE 57 HG21 ILE 57 59.460 18.058 33.468
446 HG22 ILE 57 HG22 ILE 57 60.125 16.463 33.115
447 HG23 ILE 57 HG23 ILE 57 58.487 16.869 32.602
448 HD11 ILE 57 HD11 ILE 57 61.155 14.731 30.167
449 HD12 ILE 57 HD12 ILE 57 60.650 15.075 31.821
450 HD13 ILE 57 HD13 ILE 57 62.065 15.879 31.145
451 H LYS 58 H LYS 58 57.110 20.412 31.087
452 HA LYS 58 HA LYS 58 58.457 22.408 32.724
453 HB2 LYS 58 HB2 LYS 58 55.538 22.146 31.968
454 HB3 LYS 58 HB3 LYS 58 56.276 23.555 32.716
455 HG2 LYS 58 HG2 LYS 58 57.668 23.894 30.755
456 HG3 LYS 58 HG3 LYS 58 56.986 22.450 30.005
457 HD2 LYS 58 HD2 LYS 58 54.756 23.502 30.069
458 HD3 LYS 58 HD3 LYS 58 55.481 24.957 30.758
459 HE2 LYS 58 HE2 LYS 58 56.839 25.245 28.759
460 HE3 LYS 58 HE3 LYS 58 56.176 23.761 28.077
461 HZ1 LYS 58 HZ1 LYS 58 54.624 26.212 28.720
462 HZ2 LYS 58 HZ2 LYS 58 53.989 24.790 28.059
463 HZ3 LYS 58 HZ3 LYS 58 55.090 25.717 27.171